EXPDTA T0319TS247_2-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called T0319TS247_2-scwrl ATOM 1 N MET A 1 0.000 0.000 0.000 1.00 0.00 ATOM 2 CA MET A 1 0.000 0.000 1.455 1.00 0.00 ATOM 3 CB MET A 1 1.241 -0.717 1.991 1.00 0.00 ATOM 4 CG MET A 1 1.317 -0.777 3.508 1.00 0.00 ATOM 5 SD MET A 1 2.805 -1.606 4.098 1.00 0.00 ATOM 6 CE MET A 1 4.055 -0.392 3.683 1.00 0.00 ATOM 7 O MET A 1 -0.899 1.784 2.785 1.00 0.00 ATOM 8 C MET A 1 0.000 1.411 2.031 1.00 0.00 ATOM 9 N LYS A 2 1.018 2.199 1.672 1.00 0.00 ATOM 10 CA LYS A 2 1.142 3.588 2.115 1.00 0.00 ATOM 11 CB LYS A 2 2.369 4.245 1.480 1.00 0.00 ATOM 12 CG LYS A 2 3.696 3.725 2.010 1.00 0.00 ATOM 13 CD LYS A 2 4.869 4.422 1.340 1.00 0.00 ATOM 14 CE LYS A 2 6.195 3.884 1.852 1.00 0.00 ATOM 15 NZ LYS A 2 7.354 4.534 1.180 1.00 0.00 ATOM 16 O LYS A 2 -0.520 5.268 2.574 1.00 0.00 ATOM 17 C LYS A 2 -0.058 4.471 1.757 1.00 0.00 ATOM 18 N PHE A 3 -0.581 4.343 0.533 1.00 0.00 ATOM 19 CA PHE A 3 -1.754 5.102 0.103 1.00 0.00 ATOM 20 CB PHE A 3 -2.008 4.895 -1.391 1.00 0.00 ATOM 21 CG PHE A 3 -1.078 5.673 -2.278 1.00 0.00 ATOM 22 CD1 PHE A 3 0.004 5.056 -2.881 1.00 0.00 ATOM 23 CD2 PHE A 3 -1.285 7.021 -2.509 1.00 0.00 ATOM 24 CE1 PHE A 3 0.860 5.772 -3.697 1.00 0.00 ATOM 25 CE2 PHE A 3 -0.429 7.737 -3.325 1.00 0.00 ATOM 26 CZ PHE A 3 0.640 7.118 -3.917 1.00 0.00 ATOM 27 O PHE A 3 -3.906 5.505 1.129 1.00 0.00 ATOM 28 C PHE A 3 -3.026 4.694 0.836 1.00 0.00 ATOM 29 N LEU A 4 -3.117 3.398 1.137 1.00 0.00 ATOM 30 CA LEU A 4 -4.213 2.849 1.922 1.00 0.00 ATOM 31 CB LEU A 4 -4.076 1.330 2.044 1.00 0.00 ATOM 32 CG LEU A 4 -4.304 0.524 0.764 1.00 0.00 ATOM 33 CD1 LEU A 4 -3.961 -0.942 0.984 1.00 0.00 ATOM 34 CD2 LEU A 4 -5.758 0.611 0.325 1.00 0.00 ATOM 35 O LEU A 4 -5.353 3.674 3.860 1.00 0.00 ATOM 36 C LEU A 4 -4.268 3.412 3.339 1.00 0.00 ATOM 37 N THR A 5 -3.085 3.594 3.950 1.00 0.00 ATOM 38 CA THR A 5 -2.918 4.353 5.188 1.00 0.00 ATOM 39 CB THR A 5 -1.431 4.596 5.505 1.00 0.00 ATOM 40 CG2 THR A 5 -1.284 5.395 6.791 1.00 0.00 ATOM 41 OG1 THR A 5 -0.761 3.339 5.661 1.00 0.00 ATOM 42 O THR A 5 -4.495 6.008 5.921 1.00 0.00 ATOM 43 C THR A 5 -3.583 5.724 5.136 1.00 0.00 ATOM 44 N THR A 6 -3.124 6.575 4.207 1.00 0.00 ATOM 45 CA THR A 6 -3.502 7.976 4.202 1.00 0.00 ATOM 46 CB THR A 6 -2.717 8.769 3.141 1.00 0.00 ATOM 47 CG2 THR A 6 -3.158 10.224 3.128 1.00 0.00 ATOM 48 OG1 THR A 6 -1.316 8.711 3.437 1.00 0.00 ATOM 49 O THR A 6 -5.632 9.029 4.458 1.00 0.00 ATOM 50 C THR A 6 -4.980 8.144 3.898 1.00 0.00 ATOM 51 N ASN A 7 -5.506 7.295 3.010 1.00 0.00 ATOM 52 CA ASN A 7 -6.942 7.195 2.775 1.00 0.00 ATOM 53 CB ASN A 7 -7.250 6.039 1.821 1.00 0.00 ATOM 54 CG ASN A 7 -6.857 6.345 0.389 1.00 0.00 ATOM 55 ND2 ASN A 7 -6.782 5.308 -0.437 1.00 0.00 ATOM 56 OD1 ASN A 7 -6.624 7.500 0.033 1.00 0.00 ATOM 57 O ASN A 7 -8.810 7.582 4.181 1.00 0.00 ATOM 58 C ASN A 7 -7.768 6.947 4.037 1.00 0.00 ATOM 59 N PHE A 8 -7.361 6.054 4.967 1.00 0.00 ATOM 60 CA PHE A 8 -8.088 5.930 6.238 1.00 0.00 ATOM 61 CB PHE A 8 -7.644 4.673 6.989 1.00 0.00 ATOM 62 CG PHE A 8 -8.324 4.487 8.315 1.00 0.00 ATOM 63 CD1 PHE A 8 -9.615 3.992 8.384 1.00 0.00 ATOM 64 CD2 PHE A 8 -7.673 4.807 9.494 1.00 0.00 ATOM 65 CE1 PHE A 8 -10.241 3.821 9.604 1.00 0.00 ATOM 66 CE2 PHE A 8 -8.299 4.636 10.714 1.00 0.00 ATOM 67 CZ PHE A 8 -9.577 4.146 10.773 1.00 0.00 ATOM 68 O PHE A 8 -8.759 7.765 7.602 1.00 0.00 ATOM 69 C PHE A 8 -7.808 7.151 7.111 1.00 0.00 ATOM 70 N LEU A 9 -6.533 7.525 7.320 1.00 0.00 ATOM 71 CA LEU A 9 -6.171 8.629 8.201 1.00 0.00 ATOM 72 CB LEU A 9 -4.676 8.935 8.091 1.00 0.00 ATOM 73 CG LEU A 9 -4.153 10.083 8.956 1.00 0.00 ATOM 74 CD1 LEU A 9 -4.330 9.766 10.433 1.00 0.00 ATOM 75 CD2 LEU A 9 -2.674 10.322 8.695 1.00 0.00 ATOM 76 O LEU A 9 -7.418 10.569 8.817 1.00 0.00 ATOM 77 C LEU A 9 -6.900 9.930 7.903 1.00 0.00 ATOM 78 N LYS A 10 -6.940 10.321 6.628 1.00 0.00 ATOM 79 CA LYS A 10 -7.696 11.482 6.193 1.00 0.00 ATOM 80 CB LYS A 10 -7.436 11.767 4.712 1.00 0.00 ATOM 81 CG LYS A 10 -6.039 12.287 4.416 1.00 0.00 ATOM 82 CD LYS A 10 -5.852 12.552 2.931 1.00 0.00 ATOM 83 CE LYS A 10 -4.444 13.039 2.630 1.00 0.00 ATOM 84 NZ LYS A 10 -4.239 13.281 1.175 1.00 0.00 ATOM 85 O LYS A 10 -9.853 12.243 6.806 1.00 0.00 ATOM 86 C LYS A 10 -9.198 11.297 6.364 1.00 0.00 ATOM 87 N CYS A 11 -9.783 10.130 6.040 1.00 0.00 ATOM 88 CA CYS A 11 -11.205 9.889 6.279 1.00 0.00 ATOM 89 CB CYS A 11 -11.589 8.473 5.845 1.00 0.00 ATOM 90 SG CYS A 11 -13.350 8.096 5.999 1.00 0.00 ATOM 91 O CYS A 11 -12.636 10.643 8.029 1.00 0.00 ATOM 92 C CYS A 11 -11.610 10.026 7.744 1.00 0.00 ATOM 93 N SER A 12 -10.835 9.469 8.686 1.00 0.00 ATOM 94 CA SER A 12 -11.062 9.692 10.108 1.00 0.00 ATOM 95 CB SER A 12 -10.078 8.870 10.943 1.00 0.00 ATOM 96 OG SER A 12 -10.323 7.482 10.799 1.00 0.00 ATOM 97 O SER A 12 -11.783 11.651 11.242 1.00 0.00 ATOM 98 C SER A 12 -10.897 11.141 10.554 1.00 0.00 ATOM 99 N VAL A 13 -9.796 11.825 10.188 1.00 0.00 ATOM 100 CA VAL A 13 -9.603 13.242 10.522 1.00 0.00 ATOM 101 CB VAL A 13 -8.317 13.801 9.887 1.00 0.00 ATOM 102 CG1 VAL A 13 -8.240 15.309 10.077 1.00 0.00 ATOM 103 CG2 VAL A 13 -7.089 13.173 10.528 1.00 0.00 ATOM 104 O VAL A 13 -11.263 14.979 10.728 1.00 0.00 ATOM 105 C VAL A 13 -10.775 14.096 10.020 1.00 0.00 ATOM 106 N LYS A 14 -11.241 13.843 8.793 1.00 0.00 ATOM 107 CA LYS A 14 -12.392 14.541 8.234 1.00 0.00 ATOM 108 CB LYS A 14 -12.487 14.296 6.727 1.00 0.00 ATOM 109 CG LYS A 14 -11.373 14.943 5.921 1.00 0.00 ATOM 110 CD LYS A 14 -11.511 14.633 4.439 1.00 0.00 ATOM 111 CE LYS A 14 -10.416 15.309 3.630 1.00 0.00 ATOM 112 NZ LYS A 14 -10.531 15.002 2.177 1.00 0.00 ATOM 113 O LYS A 14 -14.720 14.850 8.693 1.00 0.00 ATOM 114 C LYS A 14 -13.737 14.119 8.823 1.00 0.00 ATOM 115 N ALA A 15 -13.828 12.953 9.476 1.00 0.00 ATOM 116 CA ALA A 15 -15.069 12.523 10.115 1.00 0.00 ATOM 117 CB ALA A 15 -15.144 11.004 10.159 1.00 0.00 ATOM 118 O ALA A 15 -16.186 12.557 12.261 1.00 0.00 ATOM 119 C ALA A 15 -15.271 12.989 11.558 1.00 0.00 ATOM 120 N CYS A 16 -14.394 13.893 12.004 1.00 0.00 ATOM 121 CA CYS A 16 -14.543 14.571 13.280 1.00 0.00 ATOM 122 CB CYS A 16 -13.175 14.819 13.918 1.00 0.00 ATOM 123 SG CYS A 16 -12.288 13.317 14.392 1.00 0.00 ATOM 124 O CYS A 16 -14.797 16.718 12.254 1.00 0.00 ATOM 125 C CYS A 16 -15.239 15.915 13.087 1.00 0.00 ATOM 126 N ASP A 17 -16.321 16.197 13.830 1.00 0.00 ATOM 127 CA ASP A 17 -17.065 17.453 13.689 1.00 0.00 ATOM 128 CB ASP A 17 -18.530 17.255 14.085 1.00 0.00 ATOM 129 CG ASP A 17 -19.328 16.531 13.019 1.00 0.00 ATOM 130 OD1 ASP A 17 -18.829 16.412 11.881 1.00 0.00 ATOM 131 OD2 ASP A 17 -20.454 16.082 13.323 1.00 0.00 ATOM 132 O ASP A 17 -16.186 19.664 13.999 1.00 0.00 ATOM 133 C ASP A 17 -16.569 18.623 14.533 1.00 0.00 ATOM 134 N THR A 18 -16.572 18.459 15.860 1.00 0.00 ATOM 135 CA THR A 18 -16.063 19.464 16.783 1.00 0.00 ATOM 136 CB THR A 18 -16.803 19.417 18.133 1.00 0.00 ATOM 137 CG2 THR A 18 -18.284 19.700 17.939 1.00 0.00 ATOM 138 OG1 THR A 18 -16.652 18.118 18.719 1.00 0.00 ATOM 139 O THR A 18 -13.745 19.431 16.111 1.00 0.00 ATOM 140 C THR A 18 -14.576 19.123 16.966 1.00 0.00 ATOM 141 N SER A 19 -14.180 18.481 18.073 1.00 0.00 ATOM 142 CA SER A 19 -13.751 17.083 18.105 1.00 0.00 ATOM 143 CB SER A 19 -14.266 16.336 16.873 1.00 0.00 ATOM 144 OG SER A 19 -13.788 15.003 16.848 1.00 0.00 ATOM 145 O SER A 19 -11.475 17.318 17.300 1.00 0.00 ATOM 146 C SER A 19 -12.249 16.840 18.125 1.00 0.00 ATOM 147 N ASN A 20 -11.863 16.056 19.132 1.00 0.00 ATOM 148 CA ASN A 20 -10.480 15.666 19.327 1.00 0.00 ATOM 149 CB ASN A 20 -10.100 15.759 20.806 1.00 0.00 ATOM 150 CG ASN A 20 -10.180 17.176 21.340 1.00 0.00 ATOM 151 ND2 ASN A 20 -11.083 17.401 22.286 1.00 0.00 ATOM 152 OD1 ASN A 20 -9.437 18.056 20.905 1.00 0.00 ATOM 153 O ASN A 20 -10.949 13.307 19.391 1.00 0.00 ATOM 154 C ASN A 20 -10.342 14.226 18.841 1.00 0.00 ATOM 155 N ASP A 21 -9.532 14.038 17.798 1.00 0.00 ATOM 156 CA ASP A 21 -9.380 12.757 17.111 1.00 0.00 ATOM 157 CB ASP A 21 -8.693 12.953 15.758 1.00 0.00 ATOM 158 CG ASP A 21 -8.572 11.661 14.974 1.00 0.00 ATOM 159 OD1 ASP A 21 -8.953 10.601 15.513 1.00 0.00 ATOM 160 OD2 ASP A 21 -8.096 11.709 13.820 1.00 0.00 ATOM 161 O ASP A 21 -7.374 11.971 18.183 1.00 0.00 ATOM 162 C ASP A 21 -8.545 11.733 17.878 1.00 0.00 ATOM 163 N ASN A 22 -9.148 10.583 18.195 1.00 0.00 ATOM 164 CA ASN A 22 -8.446 9.490 18.856 1.00 0.00 ATOM 165 CB ASN A 22 -9.224 9.020 20.087 1.00 0.00 ATOM 166 CG ASN A 22 -8.495 7.938 20.859 1.00 0.00 ATOM 167 ND2 ASN A 22 -8.855 7.773 22.126 1.00 0.00 ATOM 168 OD1 ASN A 22 -7.620 7.260 20.320 1.00 0.00 ATOM 169 O ASN A 22 -9.292 7.676 17.507 1.00 0.00 ATOM 170 C ASN A 22 -8.321 8.348 17.857 1.00 0.00 ATOM 171 N PHE A 23 -7.084 8.146 17.405 1.00 0.00 ATOM 172 CA PHE A 23 -6.808 7.360 16.215 1.00 0.00 ATOM 173 CB PHE A 23 -6.195 8.239 15.123 1.00 0.00 ATOM 174 CG PHE A 23 -5.982 7.525 13.819 1.00 0.00 ATOM 175 CD1 PHE A 23 -7.047 7.268 12.972 1.00 0.00 ATOM 176 CD2 PHE A 23 -4.718 7.109 13.438 1.00 0.00 ATOM 177 CE1 PHE A 23 -6.851 6.611 11.772 1.00 0.00 ATOM 178 CE2 PHE A 23 -4.523 6.452 12.238 1.00 0.00 ATOM 179 CZ PHE A 23 -5.583 6.203 11.406 1.00 0.00 ATOM 180 O PHE A 23 -4.630 6.467 16.650 1.00 0.00 ATOM 181 C PHE A 23 -5.826 6.215 16.494 1.00 0.00 ATOM 182 N PRO A 24 -6.250 4.947 16.569 1.00 0.00 ATOM 183 CA PRO A 24 -5.343 3.799 16.537 1.00 0.00 ATOM 184 CB PRO A 24 -6.083 2.721 17.332 1.00 0.00 ATOM 185 CG PRO A 24 -7.528 3.031 17.127 1.00 0.00 ATOM 186 CD PRO A 24 -7.611 4.519 16.931 1.00 0.00 ATOM 187 O PRO A 24 -5.856 2.656 14.473 1.00 0.00 ATOM 188 C PRO A 24 -5.025 3.289 15.129 1.00 0.00 ATOM 189 N LEU A 25 -3.805 3.562 14.647 1.00 0.00 ATOM 190 CA LEU A 25 -3.365 3.113 13.327 1.00 0.00 ATOM 191 CB LEU A 25 -2.425 4.142 12.697 1.00 0.00 ATOM 192 CG LEU A 25 -1.860 3.791 11.319 1.00 0.00 ATOM 193 CD1 LEU A 25 -2.974 3.713 10.286 1.00 0.00 ATOM 194 CD2 LEU A 25 -0.861 4.843 10.863 1.00 0.00 ATOM 195 O LEU A 25 -1.588 1.722 14.114 1.00 0.00 ATOM 196 C LEU A 25 -2.627 1.787 13.455 1.00 0.00 ATOM 197 N GLN A 26 -3.136 0.714 12.840 1.00 0.00 ATOM 198 CA GLN A 26 -2.480 -0.582 12.930 1.00 0.00 ATOM 199 CB GLN A 26 -3.415 -1.613 13.566 1.00 0.00 ATOM 200 CG GLN A 26 -3.775 -1.315 15.013 1.00 0.00 ATOM 201 CD GLN A 26 -4.688 -2.365 15.614 1.00 0.00 ATOM 202 OE1 GLN A 26 -5.036 -3.347 14.959 1.00 0.00 ATOM 203 NE2 GLN A 26 -5.078 -2.161 16.867 1.00 0.00 ATOM 204 O GLN A 26 -2.831 -1.350 10.679 1.00 0.00 ATOM 205 C GLN A 26 -2.039 -1.186 11.611 1.00 0.00 ATOM 206 N TYR A 27 -0.746 -1.518 11.551 1.00 0.00 ATOM 207 CA TYR A 27 -0.217 -2.366 10.499 1.00 0.00 ATOM 208 CB TYR A 27 1.122 -1.823 9.995 1.00 0.00 ATOM 209 CG TYR A 27 1.024 -0.463 9.342 1.00 0.00 ATOM 210 CD1 TYR A 27 1.317 0.692 10.057 1.00 0.00 ATOM 211 CD2 TYR A 27 0.640 -0.337 8.013 1.00 0.00 ATOM 212 CE1 TYR A 27 1.230 1.939 9.468 1.00 0.00 ATOM 213 CE2 TYR A 27 0.548 0.902 7.408 1.00 0.00 ATOM 214 CZ TYR A 27 0.847 2.044 8.149 1.00 0.00 ATOM 215 OH TYR A 27 0.760 3.285 7.560 1.00 0.00 ATOM 216 O TYR A 27 1.096 -4.183 11.395 1.00 0.00 ATOM 217 C TYR A 27 -0.012 -3.769 11.050 1.00 0.00 ATOM 218 N ASP A 28 -1.104 -4.528 11.138 1.00 0.00 ATOM 219 CA ASP A 28 -1.015 -5.946 11.459 1.00 0.00 ATOM 220 CB ASP A 28 -1.851 -6.268 12.699 1.00 0.00 ATOM 221 CG ASP A 28 -1.656 -7.693 13.180 1.00 0.00 ATOM 222 OD1 ASP A 28 -0.765 -8.384 12.643 1.00 0.00 ATOM 223 OD2 ASP A 28 -2.394 -8.118 14.093 1.00 0.00 ATOM 224 O ASP A 28 -2.560 -7.447 10.378 1.00 0.00 ATOM 225 C ASP A 28 -1.539 -6.763 10.276 1.00 0.00 ATOM 226 N GLY A 29 -0.935 -6.782 9.091 1.00 0.00 ATOM 227 CA GLY A 29 0.466 -6.451 8.889 1.00 0.00 ATOM 228 O GLY A 29 0.978 -5.767 6.653 1.00 0.00 ATOM 229 C GLY A 29 0.842 -6.699 7.443 1.00 0.00 ATOM 230 N SER A 30 1.007 -7.979 7.114 1.00 0.00 ATOM 231 CA SER A 30 1.160 -8.441 5.744 1.00 0.00 ATOM 232 CB SER A 30 1.723 -9.864 5.718 1.00 0.00 ATOM 233 OG SER A 30 0.811 -10.783 6.294 1.00 0.00 ATOM 234 O SER A 30 -0.191 -8.213 3.764 1.00 0.00 ATOM 235 C SER A 30 -0.154 -8.467 4.965 1.00 0.00 ATOM 236 N LYS A 31 -1.240 -8.784 5.680 1.00 0.00 ATOM 237 CA LYS A 31 -2.516 -9.115 5.058 1.00 0.00 ATOM 238 CB LYS A 31 -3.194 -10.265 5.806 1.00 0.00 ATOM 239 CG LYS A 31 -2.421 -11.573 5.765 1.00 0.00 ATOM 240 CD LYS A 31 -3.211 -12.701 6.409 1.00 0.00 ATOM 241 CE LYS A 31 -2.427 -14.003 6.392 1.00 0.00 ATOM 242 NZ LYS A 31 -3.188 -15.118 7.022 1.00 0.00 ATOM 243 O LYS A 31 -3.984 -7.530 3.967 1.00 0.00 ATOM 244 C LYS A 31 -3.535 -7.982 5.021 1.00 0.00 ATOM 245 N CYS A 32 -3.898 -7.525 6.217 1.00 0.00 ATOM 246 CA CYS A 32 -5.060 -6.688 6.448 1.00 0.00 ATOM 247 CB CYS A 32 -6.211 -7.516 7.022 1.00 0.00 ATOM 248 SG CYS A 32 -7.720 -6.574 7.346 1.00 0.00 ATOM 249 O CYS A 32 -3.816 -6.000 8.348 1.00 0.00 ATOM 250 C CYS A 32 -4.562 -5.651 7.436 1.00 0.00 ATOM 251 N GLN A 33 -4.938 -4.384 7.300 1.00 0.00 ATOM 252 CA GLN A 33 -4.594 -3.388 8.300 1.00 0.00 ATOM 253 CB GLN A 33 -3.530 -2.431 7.759 1.00 0.00 ATOM 254 CG GLN A 33 -2.202 -3.097 7.439 1.00 0.00 ATOM 255 CD GLN A 33 -2.188 -3.739 6.065 1.00 0.00 ATOM 256 OE1 GLN A 33 -2.726 -3.186 5.106 1.00 0.00 ATOM 257 NE2 GLN A 33 -1.571 -4.911 5.968 1.00 0.00 ATOM 258 O GLN A 33 -6.836 -2.645 7.862 1.00 0.00 ATOM 259 C GLN A 33 -5.872 -2.617 8.633 1.00 0.00 ATOM 260 N LEU A 34 -5.924 -1.914 9.768 1.00 0.00 ATOM 261 CA LEU A 34 -7.193 -1.539 10.379 1.00 0.00 ATOM 262 CB LEU A 34 -7.717 -2.672 11.263 1.00 0.00 ATOM 263 CG LEU A 34 -8.146 -3.952 10.542 1.00 0.00 ATOM 264 CD1 LEU A 34 -8.409 -5.069 11.541 1.00 0.00 ATOM 265 CD2 LEU A 34 -9.419 -3.718 9.744 1.00 0.00 ATOM 266 O LEU A 34 -5.953 -0.122 11.854 1.00 0.00 ATOM 267 C LEU A 34 -7.007 -0.296 11.236 1.00 0.00 ATOM 268 N VAL A 35 -8.032 0.567 11.273 1.00 0.00 ATOM 269 CA VAL A 35 -8.057 1.759 12.113 1.00 0.00 ATOM 270 CB VAL A 35 -7.686 3.021 11.313 1.00 0.00 ATOM 271 CG1 VAL A 35 -6.265 2.915 10.779 1.00 0.00 ATOM 272 CG2 VAL A 35 -8.630 3.202 10.134 1.00 0.00 ATOM 273 O VAL A 35 -10.438 1.342 12.133 1.00 0.00 ATOM 274 C VAL A 35 -9.483 1.908 12.669 1.00 0.00 ATOM 275 N GLN A 36 -9.625 2.677 13.754 1.00 0.00 ATOM 276 CA GLN A 36 -10.884 2.986 14.410 1.00 0.00 ATOM 277 CB GLN A 36 -11.058 2.130 15.666 1.00 0.00 ATOM 278 CG GLN A 36 -11.144 0.637 15.392 1.00 0.00 ATOM 279 CD GLN A 36 -12.437 0.244 14.705 1.00 0.00 ATOM 280 OE1 GLN A 36 -13.484 0.848 14.938 1.00 0.00 ATOM 281 NE2 GLN A 36 -12.368 -0.773 13.854 1.00 0.00 ATOM 282 O GLN A 36 -9.797 5.107 14.809 1.00 0.00 ATOM 283 C GLN A 36 -10.856 4.474 14.791 1.00 0.00 ATOM 284 N ASP A 37 -12.015 5.058 15.101 1.00 0.00 ATOM 285 CA ASP A 37 -12.164 6.408 15.660 1.00 0.00 ATOM 286 CB ASP A 37 -12.270 7.444 14.539 1.00 0.00 ATOM 287 CG ASP A 37 -11.922 8.844 15.004 1.00 0.00 ATOM 288 OD1 ASP A 37 -11.545 9.001 16.184 1.00 0.00 ATOM 289 OD2 ASP A 37 -12.026 9.784 14.188 1.00 0.00 ATOM 290 O ASP A 37 -14.132 5.310 16.340 1.00 0.00 ATOM 291 C ASP A 37 -13.467 6.336 16.492 1.00 0.00 ATOM 292 N GLU A 38 -14.130 7.098 17.381 1.00 0.00 ATOM 293 CA GLU A 38 -14.165 8.541 17.599 1.00 0.00 ATOM 294 CB GLU A 38 -12.788 9.052 18.028 1.00 0.00 ATOM 295 CG GLU A 38 -12.286 8.459 19.335 1.00 0.00 ATOM 296 CD GLU A 38 -13.072 8.947 20.536 1.00 0.00 ATOM 297 OE1 GLU A 38 -13.860 9.903 20.382 1.00 0.00 ATOM 298 OE2 GLU A 38 -12.899 8.372 21.631 1.00 0.00 ATOM 299 O GLU A 38 -13.973 10.500 16.203 1.00 0.00 ATOM 300 C GLU A 38 -14.553 9.435 16.421 1.00 0.00 ATOM 301 N SER A 39 -15.550 9.006 15.642 1.00 0.00 ATOM 302 CA SER A 39 -16.003 9.750 14.476 1.00 0.00 ATOM 303 CB SER A 39 -15.250 9.295 13.224 1.00 0.00 ATOM 304 OG SER A 39 -15.608 7.971 12.867 1.00 0.00 ATOM 305 O SER A 39 -18.183 8.818 14.879 1.00 0.00 ATOM 306 C SER A 39 -17.491 9.570 14.195 1.00 0.00 ATOM 307 N ILE A 40 -17.979 10.278 13.167 1.00 0.00 ATOM 308 CA ILE A 40 -19.316 10.053 12.631 1.00 0.00 ATOM 309 CB ILE A 40 -19.737 11.182 11.672 1.00 0.00 ATOM 310 CG1 ILE A 40 -19.811 12.516 12.418 1.00 0.00 ATOM 311 CG2 ILE A 40 -21.104 10.889 11.072 1.00 0.00 ATOM 312 CD1 ILE A 40 -19.995 13.713 11.512 1.00 0.00 ATOM 313 O ILE A 40 -18.569 8.593 10.868 1.00 0.00 ATOM 314 C ILE A 40 -19.268 8.724 11.881 1.00 0.00 ATOM 315 N GLU A 41 -20.002 7.716 12.352 1.00 0.00 ATOM 316 CA GLU A 41 -20.186 6.496 11.582 1.00 0.00 ATOM 317 CB GLU A 41 -20.409 5.303 12.514 1.00 0.00 ATOM 318 CG GLU A 41 -20.513 3.967 11.797 1.00 0.00 ATOM 319 CD GLU A 41 -20.785 2.816 12.746 1.00 0.00 ATOM 320 OE1 GLU A 41 -20.910 3.067 13.963 1.00 0.00 ATOM 321 OE2 GLU A 41 -20.872 1.664 12.272 1.00 0.00 ATOM 322 O GLU A 41 -22.562 6.607 11.124 1.00 0.00 ATOM 323 C GLU A 41 -21.408 6.710 10.697 1.00 0.00 ATOM 324 N PHE A 42 -21.103 7.015 9.434 1.00 0.00 ATOM 325 CA PHE A 42 -22.015 7.645 8.484 1.00 0.00 ATOM 326 CB PHE A 42 -21.290 7.960 7.174 1.00 0.00 ATOM 327 CG PHE A 42 -20.136 8.908 7.333 1.00 0.00 ATOM 328 CD1 PHE A 42 -18.835 8.437 7.363 1.00 0.00 ATOM 329 CD2 PHE A 42 -20.350 10.270 7.451 1.00 0.00 ATOM 330 CE1 PHE A 42 -17.772 9.309 7.509 1.00 0.00 ATOM 331 CE2 PHE A 42 -19.288 11.141 7.597 1.00 0.00 ATOM 332 CZ PHE A 42 -18.003 10.666 7.626 1.00 0.00 ATOM 333 O PHE A 42 -23.446 6.696 6.806 1.00 0.00 ATOM 334 C PHE A 42 -23.282 6.923 8.005 1.00 0.00 ATOM 335 N ASN A 43 -24.198 6.550 8.912 1.00 0.00 ATOM 336 CA ASN A 43 -25.534 6.020 8.611 1.00 0.00 ATOM 337 CB ASN A 43 -26.324 7.012 7.755 1.00 0.00 ATOM 338 CG ASN A 43 -26.699 8.268 8.516 1.00 0.00 ATOM 339 ND2 ASN A 43 -26.887 9.365 7.790 1.00 0.00 ATOM 340 OD1 ASN A 43 -26.818 8.251 9.741 1.00 0.00 ATOM 341 O ASN A 43 -25.064 4.586 6.743 1.00 0.00 ATOM 342 C ASN A 43 -25.605 4.695 7.844 1.00 0.00 ATOM 343 N PRO A 44 -26.259 3.642 8.370 1.00 0.00 ATOM 344 CA PRO A 44 -26.320 2.300 7.772 1.00 0.00 ATOM 345 CB PRO A 44 -27.438 1.600 8.547 1.00 0.00 ATOM 346 CG PRO A 44 -27.418 2.242 9.894 1.00 0.00 ATOM 347 CD PRO A 44 -27.151 3.702 9.656 1.00 0.00 ATOM 348 O PRO A 44 -26.023 1.431 5.550 1.00 0.00 ATOM 349 C PRO A 44 -26.631 2.218 6.278 1.00 0.00 ATOM 350 N GLU A 45 -27.583 3.035 5.813 1.00 0.00 ATOM 351 CA GLU A 45 -27.970 3.084 4.407 1.00 0.00 ATOM 352 CB GLU A 45 -29.180 4.001 4.216 1.00 0.00 ATOM 353 CG GLU A 45 -30.474 3.448 4.789 1.00 0.00 ATOM 354 CD GLU A 45 -31.630 4.421 4.663 1.00 0.00 ATOM 355 OE1 GLU A 45 -31.404 5.553 4.184 1.00 0.00 ATOM 356 OE2 GLU A 45 -32.761 4.053 5.043 1.00 0.00 ATOM 357 O GLU A 45 -26.859 3.257 2.289 1.00 0.00 ATOM 358 C GLU A 45 -26.883 3.606 3.469 1.00 0.00 ATOM 359 N PHE A 46 -25.968 4.445 3.968 1.00 0.00 ATOM 360 CA PHE A 46 -24.943 5.047 3.125 1.00 0.00 ATOM 361 CB PHE A 46 -24.491 6.388 3.706 1.00 0.00 ATOM 362 CG PHE A 46 -25.547 7.455 3.661 1.00 0.00 ATOM 363 CD1 PHE A 46 -26.326 7.726 4.773 1.00 0.00 ATOM 364 CD2 PHE A 46 -25.762 8.188 2.507 1.00 0.00 ATOM 365 CE1 PHE A 46 -27.298 8.707 4.731 1.00 0.00 ATOM 366 CE2 PHE A 46 -26.734 9.170 2.466 1.00 0.00 ATOM 367 CZ PHE A 46 -27.501 9.431 3.571 1.00 0.00 ATOM 368 O PHE A 46 -22.930 4.343 2.037 1.00 0.00 ATOM 369 C PHE A 46 -23.699 4.176 2.986 1.00 0.00 ATOM 370 N LEU A 47 -23.498 3.243 3.931 1.00 0.00 ATOM 371 CA LEU A 47 -22.302 2.406 4.007 1.00 0.00 ATOM 372 CB LEU A 47 -22.492 1.292 5.039 1.00 0.00 ATOM 373 CG LEU A 47 -21.318 0.328 5.220 1.00 0.00 ATOM 374 CD1 LEU A 47 -20.091 1.066 5.733 1.00 0.00 ATOM 375 CD2 LEU A 47 -21.668 -0.764 6.218 1.00 0.00 ATOM 376 O LEU A 47 -20.706 1.722 2.363 1.00 0.00 ATOM 377 C LEU A 47 -21.888 1.698 2.724 1.00 0.00 ATOM 378 N LEU A 48 -22.838 1.067 2.024 1.00 0.00 ATOM 379 CA LEU A 48 -22.555 0.386 0.765 1.00 0.00 ATOM 380 CB LEU A 48 -23.828 -0.250 0.202 1.00 0.00 ATOM 381 CG LEU A 48 -24.376 -1.458 0.964 1.00 0.00 ATOM 382 CD1 LEU A 48 -25.734 -1.868 0.415 1.00 0.00 ATOM 383 CD2 LEU A 48 -23.434 -2.646 0.838 1.00 0.00 ATOM 384 O LEU A 48 -21.004 1.035 -0.952 1.00 0.00 ATOM 385 C LEU A 48 -22.008 1.329 -0.303 1.00 0.00 ATOM 386 N ASN A 49 -22.666 2.477 -0.496 1.00 0.00 ATOM 387 CA ASN A 49 -22.258 3.434 -1.517 1.00 0.00 ATOM 388 CB ASN A 49 -23.345 4.490 -1.726 1.00 0.00 ATOM 389 CG ASN A 49 -24.557 3.943 -2.455 1.00 0.00 ATOM 390 ND2 ASN A 49 -25.689 4.621 -2.309 1.00 0.00 ATOM 391 OD1 ASN A 49 -24.473 2.923 -3.139 1.00 0.00 ATOM 392 O ASN A 49 -20.232 4.568 -2.079 1.00 0.00 ATOM 393 C ASN A 49 -20.977 4.184 -1.176 1.00 0.00 ATOM 394 N ILE A 50 -20.698 4.405 0.116 1.00 0.00 ATOM 395 CA ILE A 50 -19.476 5.086 0.527 1.00 0.00 ATOM 396 CB ILE A 50 -19.521 5.477 2.016 1.00 0.00 ATOM 397 CG1 ILE A 50 -20.570 6.566 2.250 1.00 0.00 ATOM 398 CG2 ILE A 50 -18.169 6.005 2.469 1.00 0.00 ATOM 399 CD1 ILE A 50 -20.866 6.825 3.711 1.00 0.00 ATOM 400 O ILE A 50 -17.121 4.765 0.158 1.00 0.00 ATOM 401 C ILE A 50 -18.216 4.231 0.340 1.00 0.00 ATOM 402 N VAL A 51 -18.341 2.896 0.381 1.00 0.00 ATOM 403 CA VAL A 51 -17.197 2.017 0.160 1.00 0.00 ATOM 404 CB VAL A 51 -17.130 0.900 1.218 1.00 0.00 ATOM 405 CG1 VAL A 51 -17.013 1.495 2.613 1.00 0.00 ATOM 406 CG2 VAL A 51 -18.384 0.041 1.166 1.00 0.00 ATOM 407 O VAL A 51 -16.072 1.010 -1.701 1.00 0.00 ATOM 408 C VAL A 51 -17.157 1.286 -1.183 1.00 0.00 ATOM 409 N ASP A 52 -18.294 0.942 -1.800 1.00 0.00 ATOM 410 CA ASP A 52 -18.296 0.011 -2.926 1.00 0.00 ATOM 411 CB ASP A 52 -19.434 -1.001 -2.782 1.00 0.00 ATOM 412 CG ASP A 52 -19.239 -1.934 -1.603 1.00 0.00 ATOM 413 OD1 ASP A 52 -18.143 -2.522 -1.486 1.00 0.00 ATOM 414 OD2 ASP A 52 -20.182 -2.077 -0.797 1.00 0.00 ATOM 415 O ASP A 52 -19.247 0.145 -5.143 1.00 0.00 ATOM 416 C ASP A 52 -18.475 0.628 -4.315 1.00 0.00 ATOM 417 N ARG A 53 -17.757 1.719 -4.600 1.00 0.00 ATOM 418 CA ARG A 53 -17.736 2.316 -5.932 1.00 0.00 ATOM 419 CB ARG A 53 -18.080 3.805 -5.857 1.00 0.00 ATOM 420 CG ARG A 53 -18.138 4.497 -7.209 1.00 0.00 ATOM 421 CD ARG A 53 -18.539 5.956 -7.066 1.00 0.00 ATOM 422 NE ARG A 53 -18.590 6.639 -8.356 1.00 0.00 ATOM 423 CZ ARG A 53 -18.824 7.939 -8.505 1.00 0.00 ATOM 424 NH1 ARG A 53 -18.852 8.473 -9.718 1.00 0.00 ATOM 425 NH2 ARG A 53 -19.029 8.702 -7.440 1.00 0.00 ATOM 426 O ARG A 53 -15.359 2.519 -5.817 1.00 0.00 ATOM 427 C ARG A 53 -16.325 2.124 -6.475 1.00 0.00 ATOM 428 N VAL A 54 -16.170 1.526 -7.662 1.00 0.00 ATOM 429 CA VAL A 54 -14.848 1.092 -8.092 1.00 0.00 ATOM 430 CB VAL A 54 -14.909 -0.260 -8.826 1.00 0.00 ATOM 431 CG1 VAL A 54 -13.529 -0.656 -9.330 1.00 0.00 ATOM 432 CG2 VAL A 54 -15.411 -1.351 -7.893 1.00 0.00 ATOM 433 O VAL A 54 -12.945 2.323 -8.754 1.00 0.00 ATOM 434 C VAL A 54 -14.103 2.030 -9.059 1.00 0.00 ATOM 435 N ASP A 55 -14.439 2.630 -10.213 1.00 0.00 ATOM 436 CA ASP A 55 -15.466 2.237 -11.170 1.00 0.00 ATOM 437 CB ASP A 55 -16.085 3.471 -11.829 1.00 0.00 ATOM 438 CG ASP A 55 -16.866 4.325 -10.849 1.00 0.00 ATOM 439 OD1 ASP A 55 -17.668 3.759 -10.077 1.00 0.00 ATOM 440 OD2 ASP A 55 -16.676 5.559 -10.854 1.00 0.00 ATOM 441 O ASP A 55 -15.246 0.187 -12.349 1.00 0.00 ATOM 442 C ASP A 55 -14.867 1.352 -12.267 1.00 0.00 ATOM 443 N TRP A 56 -13.945 1.852 -13.116 1.00 0.00 ATOM 444 CA TRP A 56 -13.389 1.075 -14.230 1.00 0.00 ATOM 445 CB TRP A 56 -12.251 1.844 -14.905 1.00 0.00 ATOM 446 CG TRP A 56 -12.721 2.980 -15.761 1.00 0.00 ATOM 447 CD1 TRP A 56 -12.611 4.313 -15.487 1.00 0.00 ATOM 448 CD2 TRP A 56 -13.375 2.884 -17.032 1.00 0.00 ATOM 449 CE2 TRP A 56 -13.632 4.198 -17.470 1.00 0.00 ATOM 450 CE3 TRP A 56 -13.768 1.815 -17.843 1.00 0.00 ATOM 451 NE1 TRP A 56 -13.156 5.054 -16.508 1.00 0.00 ATOM 452 CZ2 TRP A 56 -14.264 4.472 -18.681 1.00 0.00 ATOM 453 CZ3 TRP A 56 -14.394 2.091 -19.044 1.00 0.00 ATOM 454 CH2 TRP A 56 -14.638 3.406 -19.454 1.00 0.00 ATOM 455 O TRP A 56 -13.088 -1.237 -14.619 1.00 0.00 ATOM 456 C TRP A 56 -12.796 -0.294 -13.889 1.00 0.00 ATOM 457 N PRO A 57 -11.979 -0.501 -12.834 1.00 0.00 ATOM 458 CA PRO A 57 -11.569 -1.833 -12.399 1.00 0.00 ATOM 459 CB PRO A 57 -10.671 -1.567 -11.189 1.00 0.00 ATOM 460 CG PRO A 57 -10.168 -0.178 -11.395 1.00 0.00 ATOM 461 CD PRO A 57 -11.293 0.581 -12.044 1.00 0.00 ATOM 462 O PRO A 57 -12.468 -3.989 -11.947 1.00 0.00 ATOM 463 C PRO A 57 -12.702 -2.776 -11.993 1.00 0.00 ATOM 464 N ALA A 58 -13.932 -2.321 -11.689 1.00 0.00 ATOM 465 CA ALA A 58 -15.045 -3.230 -11.414 1.00 0.00 ATOM 466 CB ALA A 58 -16.257 -2.452 -10.924 1.00 0.00 ATOM 467 O ALA A 58 -15.739 -5.202 -12.563 1.00 0.00 ATOM 468 C ALA A 58 -15.466 -4.008 -12.648 1.00 0.00 ATOM 469 N VAL A 59 -15.516 -3.319 -13.798 1.00 0.00 ATOM 470 CA VAL A 59 -15.871 -3.929 -15.077 1.00 0.00 ATOM 471 CB VAL A 59 -15.875 -2.892 -16.215 1.00 0.00 ATOM 472 CG1 VAL A 59 -16.050 -3.578 -17.561 1.00 0.00 ATOM 473 CG2 VAL A 59 -17.015 -1.902 -16.029 1.00 0.00 ATOM 474 O VAL A 59 -15.191 -6.113 -15.844 1.00 0.00 ATOM 475 C VAL A 59 -14.848 -5.016 -15.405 1.00 0.00 ATOM 476 N LEU A 60 -13.572 -4.682 -15.181 1.00 0.00 ATOM 477 CA LEU A 60 -12.481 -5.622 -15.369 1.00 0.00 ATOM 478 CB LEU A 60 -11.133 -4.920 -15.196 1.00 0.00 ATOM 479 CG LEU A 60 -10.750 -3.911 -16.281 1.00 0.00 ATOM 480 CD1 LEU A 60 -9.484 -3.162 -15.896 1.00 0.00 ATOM 481 CD2 LEU A 60 -10.502 -4.615 -17.607 1.00 0.00 ATOM 482 O LEU A 60 -12.191 -7.912 -14.802 1.00 0.00 ATOM 483 C LEU A 60 -12.494 -6.790 -14.386 1.00 0.00 ATOM 484 N THR A 61 -12.827 -6.594 -13.100 1.00 0.00 ATOM 485 CA THR A 61 -12.968 -7.695 -12.150 1.00 0.00 ATOM 486 CB THR A 61 -13.172 -7.178 -10.714 1.00 0.00 ATOM 487 CG2 THR A 61 -13.355 -8.341 -9.750 1.00 0.00 ATOM 488 OG1 THR A 61 -12.027 -6.417 -10.309 1.00 0.00 ATOM 489 O THR A 61 -14.050 -9.816 -12.279 1.00 0.00 ATOM 490 C THR A 61 -14.158 -8.603 -12.459 1.00 0.00 ATOM 491 N VAL A 62 -15.301 -8.068 -12.920 1.00 0.00 ATOM 492 CA VAL A 62 -16.415 -8.895 -13.385 1.00 0.00 ATOM 493 CB VAL A 62 -17.611 -8.033 -13.830 1.00 0.00 ATOM 494 CG1 VAL A 62 -18.673 -8.896 -14.492 1.00 0.00 ATOM 495 CG2 VAL A 62 -18.237 -7.332 -12.634 1.00 0.00 ATOM 496 O VAL A 62 -16.143 -10.959 -14.581 1.00 0.00 ATOM 497 C VAL A 62 -15.954 -9.739 -14.574 1.00 0.00 ATOM 498 N ALA A 63 -15.346 -9.101 -15.586 1.00 0.00 ATOM 499 CA ALA A 63 -14.777 -9.810 -16.726 1.00 0.00 ATOM 500 CB ALA A 63 -14.186 -8.824 -17.722 1.00 0.00 ATOM 501 O ALA A 63 -13.460 -11.783 -17.081 1.00 0.00 ATOM 502 C ALA A 63 -13.656 -10.789 -16.378 1.00 0.00 ATOM 503 N ALA A 64 -12.903 -10.540 -15.300 1.00 0.00 ATOM 504 CA ALA A 64 -11.924 -11.494 -14.798 1.00 0.00 ATOM 505 CB ALA A 64 -11.070 -10.856 -13.713 1.00 0.00 ATOM 506 O ALA A 64 -12.251 -13.855 -14.584 1.00 0.00 ATOM 507 C ALA A 64 -12.582 -12.730 -14.200 1.00 0.00 ATOM 508 N GLU A 65 -13.516 -12.541 -13.259 1.00 0.00 ATOM 509 CA GLU A 65 -14.236 -13.635 -12.610 1.00 0.00 ATOM 510 CB GLU A 65 -15.202 -13.090 -11.556 1.00 0.00 ATOM 511 CG GLU A 65 -14.519 -12.526 -10.321 1.00 0.00 ATOM 512 CD GLU A 65 -15.501 -11.911 -9.343 1.00 0.00 ATOM 513 OE1 GLU A 65 -16.707 -11.863 -9.662 1.00 0.00 ATOM 514 OE2 GLU A 65 -15.063 -11.477 -8.256 1.00 0.00 ATOM 515 O GLU A 65 -15.230 -15.685 -13.372 1.00 0.00 ATOM 516 C GLU A 65 -15.067 -14.481 -13.570 1.00 0.00 ATOM 517 N LEU A 66 -15.602 -13.855 -14.624 1.00 0.00 ATOM 518 CA LEU A 66 -16.255 -14.582 -15.708 1.00 0.00 ATOM 519 CB LEU A 66 -16.979 -13.612 -16.644 1.00 0.00 ATOM 520 CG LEU A 66 -18.174 -12.863 -16.051 1.00 0.00 ATOM 521 CD1 LEU A 66 -18.721 -11.850 -17.046 1.00 0.00 ATOM 522 CD2 LEU A 66 -19.292 -13.830 -15.694 1.00 0.00 ATOM 523 O LEU A 66 -15.752 -16.335 -17.256 1.00 0.00 ATOM 524 C LEU A 66 -15.311 -15.399 -16.588 1.00 0.00 ATOM 525 N GLY A 67 -14.012 -15.074 -16.611 1.00 0.00 ATOM 526 CA GLY A 67 -13.038 -15.837 -17.381 1.00 0.00 ATOM 527 O GLY A 67 -12.120 -15.881 -19.589 1.00 0.00 ATOM 528 C GLY A 67 -12.616 -15.191 -18.696 1.00 0.00 ATOM 529 N ASN A 68 -12.798 -13.877 -18.845 1.00 0.00 ATOM 530 CA ASN A 68 -12.410 -13.174 -20.064 1.00 0.00 ATOM 531 CB ASN A 68 -13.476 -12.148 -20.454 1.00 0.00 ATOM 532 CG ASN A 68 -14.785 -12.795 -20.862 1.00 0.00 ATOM 533 ND2 ASN A 68 -15.878 -12.051 -20.732 1.00 0.00 ATOM 534 OD1 ASN A 68 -14.812 -13.950 -21.288 1.00 0.00 ATOM 535 O ASN A 68 -10.212 -12.481 -20.744 1.00 0.00 ATOM 536 C ASN A 68 -11.093 -12.435 -19.884 1.00 0.00 ATOM 537 N ASN A 69 -10.940 -11.738 -18.754 1.00 0.00 ATOM 538 CA ASN A 69 -9.738 -10.965 -18.496 1.00 0.00 ATOM 539 CB ASN A 69 -10.094 -9.608 -17.886 1.00 0.00 ATOM 540 CG ASN A 69 -10.836 -8.710 -18.856 1.00 0.00 ATOM 541 ND2 ASN A 69 -11.672 -7.826 -18.322 1.00 0.00 ATOM 542 OD1 ASN A 69 -10.659 -8.810 -20.070 1.00 0.00 ATOM 543 O ASN A 69 -9.330 -12.245 -16.510 1.00 0.00 ATOM 544 C ASN A 69 -8.854 -11.734 -17.525 1.00 0.00 ATOM 545 N ALA A 70 -7.559 -11.824 -17.828 1.00 0.00 ATOM 546 CA ALA A 70 -6.618 -12.536 -16.976 1.00 0.00 ATOM 547 CB ALA A 70 -5.329 -12.820 -17.732 1.00 0.00 ATOM 548 O ALA A 70 -6.081 -12.324 -14.646 1.00 0.00 ATOM 549 C ALA A 70 -6.244 -11.752 -15.723 1.00 0.00 ATOM 550 N LEU A 71 -6.103 -10.427 -15.852 1.00 0.00 ATOM 551 CA LEU A 71 -5.656 -9.587 -14.753 1.00 0.00 ATOM 552 CB LEU A 71 -4.198 -9.170 -14.956 1.00 0.00 ATOM 553 CG LEU A 71 -3.161 -10.295 -14.925 1.00 0.00 ATOM 554 CD1 LEU A 71 -1.788 -9.770 -15.316 1.00 0.00 ATOM 555 CD2 LEU A 71 -3.061 -10.896 -13.532 1.00 0.00 ATOM 556 O LEU A 71 -6.515 -7.537 -15.628 1.00 0.00 ATOM 557 C LEU A 71 -6.530 -8.340 -14.694 1.00 0.00 ATOM 558 N PRO A 72 -7.311 -8.121 -13.624 1.00 0.00 ATOM 559 CA PRO A 72 -8.149 -6.932 -13.454 1.00 0.00 ATOM 560 CB PRO A 72 -9.043 -7.276 -12.261 1.00 0.00 ATOM 561 CG PRO A 72 -8.236 -8.239 -11.455 1.00 0.00 ATOM 562 CD PRO A 72 -7.450 -9.054 -12.444 1.00 0.00 ATOM 563 O PRO A 72 -8.434 -4.617 -13.128 1.00 0.00 ATOM 564 C PRO A 72 -7.600 -5.526 -13.162 1.00 0.00 ATOM 565 N PRO A 73 -6.310 -5.188 -12.941 1.00 0.00 ATOM 566 CA PRO A 73 -5.855 -3.807 -12.767 1.00 0.00 ATOM 567 CB PRO A 73 -4.371 -3.947 -12.420 1.00 0.00 ATOM 568 CG PRO A 73 -4.239 -5.339 -11.900 1.00 0.00 ATOM 569 CD PRO A 73 -5.206 -6.174 -12.692 1.00 0.00 ATOM 570 O PRO A 73 -5.817 -3.211 -15.119 1.00 0.00 ATOM 571 C PRO A 73 -5.981 -2.853 -13.949 1.00 0.00 ATOM 572 N THR A 74 -6.281 -1.607 -13.599 1.00 0.00 ATOM 573 CA THR A 74 -6.095 -0.467 -14.481 1.00 0.00 ATOM 574 CB THR A 74 -7.064 0.679 -14.134 1.00 0.00 ATOM 575 CG2 THR A 74 -8.504 0.191 -14.181 1.00 0.00 ATOM 576 OG1 THR A 74 -6.781 1.165 -12.816 1.00 0.00 ATOM 577 O THR A 74 -3.885 -0.413 -13.520 1.00 0.00 ATOM 578 C THR A 74 -4.664 0.058 -14.352 1.00 0.00 ATOM 579 N LYS A 75 -4.286 1.043 -15.170 1.00 0.00 ATOM 580 CA LYS A 75 -2.960 1.640 -15.080 1.00 0.00 ATOM 581 CB LYS A 75 -2.599 2.343 -16.390 1.00 0.00 ATOM 582 CG LYS A 75 -2.398 1.401 -17.565 1.00 0.00 ATOM 583 CD LYS A 75 -1.999 2.160 -18.820 1.00 0.00 ATOM 584 CE LYS A 75 -1.855 1.224 -20.010 1.00 0.00 ATOM 585 NZ LYS A 75 -1.468 1.955 -21.247 1.00 0.00 ATOM 586 O LYS A 75 -3.822 3.409 -13.717 1.00 0.00 ATOM 587 C LYS A 75 -2.856 2.679 -13.963 1.00 0.00 ATOM 588 N PRO A 76 -1.716 2.794 -13.258 1.00 0.00 ATOM 589 CA PRO A 76 -1.450 3.857 -12.286 1.00 0.00 ATOM 590 CB PRO A 76 0.019 3.655 -11.909 1.00 0.00 ATOM 591 CG PRO A 76 0.267 2.202 -12.138 1.00 0.00 ATOM 592 CD PRO A 76 -0.515 1.834 -13.369 1.00 0.00 ATOM 593 O PRO A 76 -1.321 5.509 -14.019 1.00 0.00 ATOM 594 C PRO A 76 -1.672 5.261 -12.859 1.00 0.00 ATOM 595 N SER A 77 -2.233 6.266 -12.183 1.00 0.00 ATOM 596 CA SER A 77 -2.510 6.271 -10.754 1.00 0.00 ATOM 597 CB SER A 77 -2.681 7.704 -10.246 1.00 0.00 ATOM 598 OG SER A 77 -3.818 8.319 -10.826 1.00 0.00 ATOM 599 O SER A 77 -4.026 5.653 -9.021 1.00 0.00 ATOM 600 C SER A 77 -3.750 5.554 -10.216 1.00 0.00 ATOM 601 N PHE A 78 -4.517 4.830 -11.042 1.00 0.00 ATOM 602 CA PHE A 78 -5.686 4.105 -10.558 1.00 0.00 ATOM 603 CB PHE A 78 -6.493 3.545 -11.731 1.00 0.00 ATOM 604 CG PHE A 78 -7.215 4.594 -12.526 1.00 0.00 ATOM 605 CD1 PHE A 78 -6.696 5.055 -13.724 1.00 0.00 ATOM 606 CD2 PHE A 78 -8.413 5.121 -12.077 1.00 0.00 ATOM 607 CE1 PHE A 78 -7.361 6.021 -14.456 1.00 0.00 ATOM 608 CE2 PHE A 78 -9.078 6.087 -12.809 1.00 0.00 ATOM 609 CZ PHE A 78 -8.556 6.537 -13.994 1.00 0.00 ATOM 610 O PHE A 78 -4.488 2.090 -10.059 1.00 0.00 ATOM 611 C PHE A 78 -5.297 2.933 -9.660 1.00 0.00 ATOM 612 N PRO A 79 -5.848 2.840 -8.442 1.00 0.00 ATOM 613 CA PRO A 79 -5.631 1.708 -7.545 1.00 0.00 ATOM 614 CB PRO A 79 -5.994 2.256 -6.163 1.00 0.00 ATOM 615 CG PRO A 79 -7.063 3.262 -6.429 1.00 0.00 ATOM 616 CD PRO A 79 -6.692 3.931 -7.723 1.00 0.00 ATOM 617 O PRO A 79 -7.337 0.488 -8.744 1.00 0.00 ATOM 618 C PRO A 79 -6.481 0.473 -7.853 1.00 0.00 ATOM 619 N SER A 80 -6.247 -0.612 -7.111 1.00 0.00 ATOM 620 CA SER A 80 -6.981 -1.862 -7.257 1.00 0.00 ATOM 621 CB SER A 80 -6.110 -3.047 -6.835 1.00 0.00 ATOM 622 OG SER A 80 -5.778 -2.971 -5.459 1.00 0.00 ATOM 623 O SER A 80 -8.827 -0.841 -6.104 1.00 0.00 ATOM 624 C SER A 80 -8.254 -1.893 -6.396 1.00 0.00 ATOM 625 N SER A 81 -8.747 -3.065 -5.958 1.00 0.00 ATOM 626 CA SER A 81 -9.732 -3.132 -4.882 1.00 0.00 ATOM 627 CB SER A 81 -10.207 -4.572 -4.679 1.00 0.00 ATOM 628 OG SER A 81 -11.133 -4.658 -3.610 1.00 0.00 ATOM 629 O SER A 81 -8.115 -3.242 -3.085 1.00 0.00 ATOM 630 C SER A 81 -9.028 -2.617 -3.633 1.00 0.00 ATOM 631 N ILE A 82 -9.496 -1.446 -3.211 1.00 0.00 ATOM 632 CA ILE A 82 -8.770 -0.614 -2.276 1.00 0.00 ATOM 633 CB ILE A 82 -7.926 0.449 -3.004 1.00 0.00 ATOM 634 CG1 ILE A 82 -7.124 1.275 -1.996 1.00 0.00 ATOM 635 CG2 ILE A 82 -8.821 1.390 -3.795 1.00 0.00 ATOM 636 CD1 ILE A 82 -6.053 2.137 -2.628 1.00 0.00 ATOM 637 O ILE A 82 -10.768 0.658 -1.936 1.00 0.00 ATOM 638 C ILE A 82 -9.831 0.050 -1.411 1.00 0.00 ATOM 639 N GLN A 83 -9.677 -0.071 -0.091 1.00 0.00 ATOM 640 CA GLN A 83 -10.480 0.660 0.875 1.00 0.00 ATOM 641 CB GLN A 83 -11.924 0.155 0.862 1.00 0.00 ATOM 642 CG GLN A 83 -12.860 0.928 1.778 1.00 0.00 ATOM 643 CD GLN A 83 -13.053 2.365 1.334 1.00 0.00 ATOM 644 OE1 GLN A 83 -13.250 2.639 0.150 1.00 0.00 ATOM 645 NE2 GLN A 83 -12.997 3.290 2.286 1.00 0.00 ATOM 646 O GLN A 83 -9.845 -0.726 2.712 1.00 0.00 ATOM 647 C GLN A 83 -9.827 0.404 2.221 1.00 0.00 ATOM 648 N GLU A 84 -9.250 1.454 2.818 1.00 0.00 ATOM 649 CA GLU A 84 -8.859 1.480 4.226 1.00 0.00 ATOM 650 CB GLU A 84 -10.096 1.524 5.125 1.00 0.00 ATOM 651 CG GLU A 84 -10.948 2.770 4.948 1.00 0.00 ATOM 652 CD GLU A 84 -12.149 2.791 5.872 1.00 0.00 ATOM 653 OE1 GLU A 84 -12.350 1.802 6.608 1.00 0.00 ATOM 654 OE2 GLU A 84 -12.890 3.797 5.861 1.00 0.00 ATOM 655 O GLU A 84 -8.223 -0.153 5.896 1.00 0.00 ATOM 656 C GLU A 84 -8.038 0.314 4.778 1.00 0.00 ATOM 657 N LEU A 85 -7.114 -0.124 3.913 1.00 0.00 ATOM 658 CA LEU A 85 -6.198 -1.242 4.127 1.00 0.00 ATOM 659 CB LEU A 85 -5.407 -1.047 5.422 1.00 0.00 ATOM 660 CG LEU A 85 -4.594 0.245 5.532 1.00 0.00 ATOM 661 CD1 LEU A 85 -3.897 0.329 6.881 1.00 0.00 ATOM 662 CD2 LEU A 85 -3.533 0.306 4.444 1.00 0.00 ATOM 663 O LEU A 85 -6.243 -3.573 4.783 1.00 0.00 ATOM 664 C LEU A 85 -6.834 -2.634 4.248 1.00 0.00 ATOM 665 N THR A 86 -8.064 -2.793 3.747 1.00 0.00 ATOM 666 CA THR A 86 -8.740 -4.083 3.730 1.00 0.00 ATOM 667 CB THR A 86 -10.044 -4.048 4.548 1.00 0.00 ATOM 668 CG2 THR A 86 -9.772 -3.560 5.963 1.00 0.00 ATOM 669 OG1 THR A 86 -10.980 -3.160 3.924 1.00 0.00 ATOM 670 O THR A 86 -8.693 -3.885 1.322 1.00 0.00 ATOM 671 C THR A 86 -9.109 -4.511 2.303 1.00 0.00 ATOM 672 N ASP A 87 -9.895 -5.583 2.139 1.00 0.00 ATOM 673 CA ASP A 87 -10.434 -5.991 0.844 1.00 0.00 ATOM 674 CB ASP A 87 -9.902 -7.371 0.453 1.00 0.00 ATOM 675 CG ASP A 87 -8.399 -7.382 0.254 1.00 0.00 ATOM 676 OD1 ASP A 87 -7.895 -6.529 -0.508 1.00 0.00 ATOM 677 OD2 ASP A 87 -7.726 -8.242 0.859 1.00 0.00 ATOM 678 O ASP A 87 -12.363 -6.409 2.167 1.00 0.00 ATOM 679 C ASP A 87 -11.937 -6.003 1.082 1.00 0.00 ATOM 680 N ASP A 88 -12.773 -5.579 0.122 1.00 0.00 ATOM 681 CA ASP A 88 -14.180 -5.345 0.441 1.00 0.00 ATOM 682 CB ASP A 88 -14.428 -3.860 0.715 1.00 0.00 ATOM 683 CG ASP A 88 -13.789 -3.392 2.008 1.00 0.00 ATOM 684 OD1 ASP A 88 -13.355 -4.253 2.802 1.00 0.00 ATOM 685 OD2 ASP A 88 -13.723 -2.164 2.228 1.00 0.00 ATOM 686 O ASP A 88 -16.286 -6.258 -0.260 1.00 0.00 ATOM 687 C ASP A 88 -15.231 -5.714 -0.602 1.00 0.00 ATOM 688 N ASP A 89 -14.976 -5.432 -1.886 1.00 0.00 ATOM 689 CA ASP A 89 -15.988 -5.554 -2.944 1.00 0.00 ATOM 690 CB ASP A 89 -15.501 -4.885 -4.231 1.00 0.00 ATOM 691 CG ASP A 89 -15.496 -3.372 -4.134 1.00 0.00 ATOM 692 OD1 ASP A 89 -16.096 -2.835 -3.180 1.00 0.00 ATOM 693 OD2 ASP A 89 -14.891 -2.723 -5.014 1.00 0.00 ATOM 694 O ASP A 89 -17.390 -7.160 -4.057 1.00 0.00 ATOM 695 C ASP A 89 -16.391 -6.970 -3.365 1.00 0.00 ATOM 696 N MET A 90 -15.613 -7.979 -2.947 1.00 0.00 ATOM 697 CA MET A 90 -15.797 -9.366 -3.362 1.00 0.00 ATOM 698 CB MET A 90 -14.809 -10.279 -2.633 1.00 0.00 ATOM 699 CG MET A 90 -13.361 -10.091 -3.058 1.00 0.00 ATOM 700 SD MET A 90 -13.097 -10.453 -4.805 1.00 0.00 ATOM 701 CE MET A 90 -13.352 -12.225 -4.826 1.00 0.00 ATOM 702 O MET A 90 -17.653 -10.767 -3.907 1.00 0.00 ATOM 703 C MET A 90 -17.174 -9.964 -3.100 1.00 0.00 ATOM 704 N ALA A 91 -17.826 -9.594 -1.989 1.00 0.00 ATOM 705 CA ALA A 91 -19.169 -10.071 -1.671 1.00 0.00 ATOM 706 CB ALA A 91 -19.625 -9.516 -0.330 1.00 0.00 ATOM 707 O ALA A 91 -21.093 -10.458 -3.059 1.00 0.00 ATOM 708 C ALA A 91 -20.223 -9.665 -2.699 1.00 0.00 ATOM 709 N ILE A 92 -20.142 -8.415 -3.177 1.00 0.00 ATOM 710 CA ILE A 92 -21.072 -7.912 -4.181 1.00 0.00 ATOM 711 CB ILE A 92 -20.935 -6.389 -4.365 1.00 0.00 ATOM 712 CG1 ILE A 92 -21.394 -5.656 -3.102 1.00 0.00 ATOM 713 CG2 ILE A 92 -21.785 -5.915 -5.533 1.00 0.00 ATOM 714 CD1 ILE A 92 -21.048 -4.183 -3.092 1.00 0.00 ATOM 715 O ILE A 92 -21.721 -9.048 -6.182 1.00 0.00 ATOM 716 C ILE A 92 -20.786 -8.589 -5.517 1.00 0.00 ATOM 717 N LEU A 93 -19.512 -8.660 -5.923 1.00 0.00 ATOM 718 CA LEU A 93 -19.121 -9.302 -7.176 1.00 0.00 ATOM 719 CB LEU A 93 -17.604 -9.231 -7.364 1.00 0.00 ATOM 720 CG LEU A 93 -17.020 -7.845 -7.642 1.00 0.00 ATOM 721 CD1 LEU A 93 -15.499 -7.889 -7.626 1.00 0.00 ATOM 722 CD2 LEU A 93 -17.467 -7.336 -9.004 1.00 0.00 ATOM 723 O LEU A 93 -19.962 -11.258 -8.294 1.00 0.00 ATOM 724 C LEU A 93 -19.506 -10.780 -7.256 1.00 0.00 ATOM 725 N ASN A 94 -19.320 -11.509 -6.147 1.00 0.00 ATOM 726 CA ASN A 94 -19.796 -12.881 -5.987 1.00 0.00 ATOM 727 CB ASN A 94 -19.478 -13.398 -4.582 1.00 0.00 ATOM 728 CG ASN A 94 -18.004 -13.692 -4.389 1.00 0.00 ATOM 729 ND2 ASN A 94 -17.574 -13.755 -3.134 1.00 0.00 ATOM 730 OD1 ASN A 94 -17.262 -13.859 -5.358 1.00 0.00 ATOM 731 O ASN A 94 -21.789 -13.857 -6.918 1.00 0.00 ATOM 732 C ASN A 94 -21.306 -12.984 -6.191 1.00 0.00 ATOM 733 N ASP A 95 -22.064 -12.087 -5.547 1.00 0.00 ATOM 734 CA ASP A 95 -23.518 -12.062 -5.674 1.00 0.00 ATOM 735 CB ASP A 95 -24.120 -11.016 -4.734 1.00 0.00 ATOM 736 CG ASP A 95 -24.068 -11.440 -3.280 1.00 0.00 ATOM 737 OD1 ASP A 95 -23.788 -12.629 -3.017 1.00 0.00 ATOM 738 OD2 ASP A 95 -24.307 -10.584 -2.402 1.00 0.00 ATOM 739 O ASP A 95 -24.978 -12.275 -7.564 1.00 0.00 ATOM 740 C ASP A 95 -23.986 -11.721 -7.085 1.00 0.00 ATOM 741 N LEU A 96 -23.274 -10.807 -7.759 1.00 0.00 ATOM 742 CA LEU A 96 -23.518 -10.478 -9.158 1.00 0.00 ATOM 743 CB LEU A 96 -22.592 -9.348 -9.612 1.00 0.00 ATOM 744 CG LEU A 96 -22.865 -7.966 -9.016 1.00 0.00 ATOM 745 CD1 LEU A 96 -21.770 -6.986 -9.407 1.00 0.00 ATOM 746 CD2 LEU A 96 -24.193 -7.419 -9.515 1.00 0.00 ATOM 747 O LEU A 96 -24.078 -11.895 -10.989 1.00 0.00 ATOM 748 C LEU A 96 -23.278 -11.666 -10.079 1.00 0.00 ATOM 749 N HIS A 97 -22.195 -12.429 -9.870 1.00 0.00 ATOM 750 CA HIS A 97 -21.926 -13.635 -10.647 1.00 0.00 ATOM 751 CB HIS A 97 -20.641 -14.309 -10.163 1.00 0.00 ATOM 752 CG HIS A 97 -20.324 -15.588 -10.873 1.00 0.00 ATOM 753 CD2 HIS A 97 -20.390 -17.004 -10.542 1.00 0.00 ATOM 754 ND1 HIS A 97 -19.842 -15.623 -12.164 1.00 0.00 ATOM 755 CE1 HIS A 97 -19.655 -16.904 -12.527 1.00 0.00 ATOM 756 NE2 HIS A 97 -19.982 -17.738 -11.559 1.00 0.00 ATOM 757 O HIS A 97 -23.538 -15.162 -11.537 1.00 0.00 ATOM 758 C HIS A 97 -23.061 -14.652 -10.525 1.00 0.00 ATOM 759 N THR A 98 -23.495 -14.950 -9.291 1.00 0.00 ATOM 760 CA THR A 98 -24.657 -15.799 -9.041 1.00 0.00 ATOM 761 CB THR A 98 -24.997 -15.863 -7.540 1.00 0.00 ATOM 762 CG2 THR A 98 -26.222 -16.734 -7.308 1.00 0.00 ATOM 763 OG1 THR A 98 -23.889 -16.419 -6.820 1.00 0.00 ATOM 764 O THR A 98 -26.604 -16.088 -10.411 1.00 0.00 ATOM 765 C THR A 98 -25.914 -15.300 -9.758 1.00 0.00 ATOM 766 N LEU A 99 -26.227 -14.000 -9.648 1.00 0.00 ATOM 767 CA LEU A 99 -27.371 -13.402 -10.330 1.00 0.00 ATOM 768 CB LEU A 99 -27.458 -11.906 -10.020 1.00 0.00 ATOM 769 CG LEU A 99 -28.605 -11.142 -10.684 1.00 0.00 ATOM 770 CD1 LEU A 99 -29.949 -11.689 -10.230 1.00 0.00 ATOM 771 CD2 LEU A 99 -28.546 -9.665 -10.324 1.00 0.00 ATOM 772 O LEU A 99 -28.296 -13.907 -12.481 1.00 0.00 ATOM 773 C LEU A 99 -27.299 -13.544 -11.851 1.00 0.00 ATOM 774 N LEU A 100 -26.139 -13.266 -12.459 1.00 0.00 ATOM 775 CA LEU A 100 -25.949 -13.393 -13.900 1.00 0.00 ATOM 776 CB LEU A 100 -24.575 -12.858 -14.308 1.00 0.00 ATOM 777 CG LEU A 100 -24.364 -11.350 -14.165 1.00 0.00 ATOM 778 CD1 LEU A 100 -22.918 -10.979 -14.455 1.00 0.00 ATOM 779 CD2 LEU A 100 -25.254 -10.588 -15.134 1.00 0.00 ATOM 780 O LEU A 100 -26.433 -15.045 -15.564 1.00 0.00 ATOM 781 C LEU A 100 -26.026 -14.825 -14.423 1.00 0.00 ATOM 782 N LEU A 101 -25.640 -15.815 -13.607 1.00 0.00 ATOM 783 CA LEU A 101 -25.846 -17.218 -13.953 1.00 0.00 ATOM 784 CB LEU A 101 -25.027 -18.123 -13.031 1.00 0.00 ATOM 785 CG LEU A 101 -23.507 -18.052 -13.187 1.00 0.00 ATOM 786 CD1 LEU A 101 -22.817 -18.879 -12.112 1.00 0.00 ATOM 787 CD2 LEU A 101 -23.080 -18.586 -14.545 1.00 0.00 ATOM 788 O LEU A 101 -27.778 -18.498 -14.591 1.00 0.00 ATOM 789 C LEU A 101 -27.305 -17.652 -13.831 1.00 0.00 ATOM 790 N GLN 102 -28.044 -17.082 -12.874 1.00 0.00 ATOM 791 CA GLN 102 -29.459 -17.394 -12.708 1.00 0.00 ENDMDL