Browse entries in the PDBbind-CN Database
HEADER 5UNJ_COMPLEX COMPND 5UNJ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 29 SER ILE PRO HIS LEU ILE LEU GLU LEU LEU LYS CYS GLU SEQRES 2 A 29 PRO ASP GLU PRO GLN VAL GLN ALA LYS ILE MET ALA TYR SEQRES 3 A 29 LEU GLN GLN SEQRES 1 A 123 LEU SER THR PHE GLY LEU MET CYS LYS MET ALA ASP GLN SEQRES 2 A 123 THR LEU PHE SER ILE VAL GLU TRP ALA ARG SER SER ILE SEQRES 3 A 123 PHE PHE ARG GLU LEU LYS VAL ASP ASP GLN MET LYS LEU SEQRES 4 A 123 LEU GLN ASN CYS TRP SER GLU LEU LEU ILE LEU ASP HIS SEQRES 5 A 123 ILE TYR ARG GLN VAL VAL HIS GLY LYS GLU GLY SER ILE SEQRES 6 A 123 PHE LEU VAL THR GLY GLN GLN VAL ASP TYR SER ILE ILE SEQRES 7 A 123 ALA SER GLN ALA GLY ALA THR LEU ASN ASN LEU MET SER SEQRES 8 A 123 HIS ALA GLN GLU LEU VAL ALA LYS LEU ARG SER LEU GLN SEQRES 9 A 123 PHE ASP GLN ARG GLU PHE VAL CYS LEU LYS PHE LEU VAL SEQRES 10 A 123 LEU PHE SER LEU ASP VAL SEQRES 1 A 75 LEU GLU ASN PHE GLN LEU VAL GLU GLY VAL GLN GLU GLN SEQRES 2 A 75 VAL ASN ALA ALA LEU LEU ASP TYR THR MET CYS ASN TYR SEQRES 3 A 75 PRO GLN GLN THR GLU LYS PHE GLY GLN LEU LEU LEU ARG SEQRES 4 A 75 LEU PRO GLU ILE ARG ALA ILE SER MET GLN ALA GLU GLU SEQRES 5 A 75 TYR LEU TYR TYR LYS HIS LEU ASN GLY ASP VAL PRO TYR SEQRES 6 A 75 ASN ASN LEU LEU ILE GLU MET LEU HIS ALA HET SER A 286 163 ATOM 1 N SER A 300 -5.939 39.041 -35.274 1.00 79.59 N ATOM 2 CA SER A 300 -7.171 38.261 -35.313 1.00 78.24 C ATOM 3 C SER A 300 -6.900 36.822 -34.875 1.00 73.64 C ATOM 4 O SER A 300 -5.779 36.486 -34.490 1.00 76.36 O ATOM 5 CB SER A 300 -7.777 38.295 -36.717 1.00 79.93 C ATOM 6 OG SER A 300 -9.107 37.806 -36.712 1.00 80.27 O ATOM 7 HG SER A 300 -9.473 37.839 -37.631 1.00 0.00 H ATOM 8 HN3 SER A 300 -5.240 38.615 -35.916 1.00 0.00 H ATOM 9 HN2 SER A 300 -5.563 39.045 -34.304 1.00 0.00 H ATOM 10 HN1 SER A 300 -6.138 40.017 -35.574 1.00 0.00 H ATOM 11 N ILE A 301 -7.920 35.979 -34.937 1.00 61.94 N ATOM 12 CA ILE A 301 -7.848 34.597 -34.462 1.00 48.95 C ATOM 13 C ILE A 301 -7.821 33.674 -35.675 1.00 46.28 C ATOM 14 O ILE A 301 -8.714 33.765 -36.524 1.00 44.26 O ATOM 15 CB ILE A 301 -9.037 34.245 -33.546 1.00 43.29 C ATOM 16 CG1 ILE A 301 -9.092 35.209 -32.358 1.00 45.48 C ATOM 17 CG2 ILE A 301 -8.922 32.801 -33.064 1.00 39.12 C ATOM 18 CD1 ILE A 301 -10.287 35.002 -31.443 1.00 46.88 C ATOM 19 H ILE A 301 -8.816 36.316 -35.343 1.00 0.00 H ATOM 20 N PRO A 302 -6.839 32.777 -35.793 1.00 39.25 N ATOM 21 CA PRO A 302 -6.861 31.815 -36.902 1.00 40.00 C ATOM 22 C PRO A 302 -8.160 31.021 -36.925 1.00 34.54 C ATOM 23 O PRO A 302 -8.715 30.669 -35.881 1.00 35.06 O ATOM 24 CB PRO A 302 -5.653 30.914 -36.618 1.00 39.57 C ATOM 25 CG PRO A 302 -4.738 31.751 -35.792 1.00 42.01 C ATOM 26 CD PRO A 302 -5.635 32.626 -34.959 1.00 41.35 C ATOM 27 N HIS A 303 -8.644 30.739 -38.137 1.00 36.59 N ATOM 28 CA HIS A 303 -9.887 29.986 -38.279 1.00 33.91 C ATOM 29 C HIS A 303 -9.783 28.612 -37.638 1.00 28.94 C ATOM 30 O HIS A 303 -10.777 28.092 -37.118 1.00 31.12 O ATOM 31 CB HIS A 303 -10.253 29.852 -39.758 1.00 37.78 C ATOM 32 CG HIS A 303 -10.681 31.137 -40.392 1.00 45.40 C ATOM 33 ND1 HIS A 303 -10.825 31.283 -41.755 1.00 50.12 N ATOM 34 CD2 HIS A 303 -11.002 32.336 -39.850 1.00 48.69 C ATOM 35 CE1 HIS A 303 -11.213 32.516 -42.025 1.00 52.90 C ATOM 36 NE2 HIS A 303 -11.329 33.175 -40.887 1.00 52.07 N ATOM 37 H HIS A 303 -8.133 31.057 -38.985 1.00 0.00 H ATOM 38 N LEU A 304 -8.594 28.008 -37.664 1.00 28.38 N ATOM 39 CA LEU A 304 -8.414 26.710 -37.025 1.00 30.21 C ATOM 40 C LEU A 304 -8.745 26.780 -35.540 1.00 26.40 C ATOM 41 O LEU A 304 -9.413 25.889 -35.002 1.00 28.31 O ATOM 42 CB LEU A 304 -6.981 26.222 -37.234 1.00 32.03 C ATOM 43 CG LEU A 304 -6.591 24.928 -36.513 1.00 35.42 C ATOM 44 CD1 LEU A 304 -7.558 23.803 -36.831 1.00 37.57 C ATOM 45 CD2 LEU A 304 -5.169 24.521 -36.887 1.00 41.80 C ATOM 46 H LEU A 304 -7.792 28.465 -38.142 1.00 0.00 H ATOM 47 N ILE A 305 -8.289 27.834 -34.859 1.00 30.36 N ATOM 48 CA ILE A 305 -8.564 27.963 -33.433 1.00 27.03 C ATOM 49 C ILE A 305 -10.043 28.230 -33.194 1.00 28.46 C ATOM 50 O ILE A 305 -10.610 27.762 -32.198 1.00 30.87 O ATOM 51 CB ILE A 305 -7.671 29.058 -32.820 1.00 29.06 C ATOM 52 CG1 ILE A 305 -6.197 28.632 -32.917 1.00 28.26 C ATOM 53 CG2 ILE A 305 -8.068 29.326 -31.364 1.00 29.84 C ATOM 54 CD1 ILE A 305 -5.203 29.649 -32.391 1.00 28.16 C ATOM 55 H ILE A 305 -7.735 28.566 -35.348 1.00 0.00 H ATOM 56 N LEU A 306 -10.701 28.967 -34.092 1.00 30.91 N ATOM 57 CA LEU A 306 -12.138 29.181 -33.944 1.00 32.25 C ATOM 58 C LEU A 306 -12.892 27.861 -33.986 1.00 30.48 C ATOM 59 O LEU A 306 -13.884 27.681 -33.270 1.00 35.62 O ATOM 60 CB LEU A 306 -12.651 30.124 -35.033 1.00 36.67 C ATOM 61 CG LEU A 306 -12.167 31.574 -34.962 1.00 38.68 C ATOM 62 CD1 LEU A 306 -12.715 32.372 -36.130 1.00 40.73 C ATOM 63 CD2 LEU A 306 -12.572 32.226 -33.649 1.00 40.01 C ATOM 64 H LEU A 306 -10.191 29.388 -34.895 1.00 0.00 H ATOM 65 N GLU A 307 -12.438 26.919 -34.814 1.00 29.50 N ATOM 66 CA GLU A 307 -13.082 25.612 -34.848 1.00 32.32 C ATOM 67 C GLU A 307 -12.810 24.824 -33.569 1.00 32.18 C ATOM 68 O GLU A 307 -13.677 24.069 -33.112 1.00 35.51 O ATOM 69 CB GLU A 307 -12.614 24.835 -36.082 1.00 39.05 C ATOM 70 CG GLU A 307 -13.716 24.094 -36.842 1.00 48.25 C ATOM 71 CD GLU A 307 -14.895 24.976 -37.224 1.00 51.23 C ATOM 72 OE1 GLU A 307 -14.678 26.143 -37.621 1.00 48.54 O ATOM 73 OE2 GLU A 307 -16.043 24.500 -37.122 1.00 56.63 O ATOM 74 H GLU A 307 -11.627 27.117 -35.434 1.00 0.00 H ATOM 75 N LEU A 308 -11.629 24.994 -32.969 1.00 35.07 N ATOM 76 CA LEU A 308 -11.344 24.330 -31.700 1.00 31.50 C ATOM 77 C LEU A 308 -12.222 24.879 -30.581 1.00 34.69 C ATOM 78 O LEU A 308 -12.673 24.123 -29.711 1.00 35.47 O ATOM 79 CB LEU A 308 -9.866 24.492 -31.347 1.00 31.38 C ATOM 80 CG LEU A 308 -8.838 24.024 -32.385 1.00 33.19 C ATOM 81 CD1 LEU A 308 -7.441 24.047 -31.786 1.00 31.38 C ATOM 82 CD2 LEU A 308 -9.169 22.638 -32.931 1.00 33.86 C ATOM 83 H LEU A 308 -10.909 25.602 -33.408 1.00 0.00 H ATOM 84 N LEU A 309 -12.479 26.190 -30.585 1.00 31.38 N ATOM 85 CA LEU A 309 -13.302 26.790 -29.539 1.00 30.90 C ATOM 86 C LEU A 309 -14.737 26.282 -29.594 1.00 32.09 C ATOM 87 O LEU A 309 -15.400 26.186 -28.557 1.00 34.90 O ATOM 88 CB LEU A 309 -13.265 28.314 -29.658 1.00 29.29 C ATOM 89 CG LEU A 309 -11.935 28.959 -29.243 1.00 30.05 C ATOM 90 CD1 LEU A 309 -11.816 30.377 -29.772 1.00 30.25 C ATOM 91 CD2 LEU A 309 -11.790 28.959 -27.728 1.00 32.42 C ATOM 92 H LEU A 309 -12.089 26.789 -31.341 1.00 0.00 H ATOM 93 N LYS A 310 -15.230 25.948 -30.787 1.00 36.96 N ATOM 94 CA LYS A 310 -16.578 25.404 -30.911 1.00 40.81 C ATOM 95 C LYS A 310 -16.741 24.091 -30.161 1.00 42.75 C ATOM 96 O LYS A 310 -17.851 23.757 -29.732 1.00 44.77 O ATOM 97 CB LYS A 310 -16.919 25.188 -32.382 1.00 47.96 C ATOM 98 CG LYS A 310 -17.087 26.462 -33.160 1.00 54.01 C ATOM 99 CD LYS A 310 -17.129 26.183 -34.645 1.00 61.17 C ATOM 100 CE LYS A 310 -17.349 27.458 -35.423 1.00 66.27 C ATOM 101 NZ LYS A 310 -17.374 27.200 -36.882 1.00 70.51 N ATOM 102 HZ1 LYS A 310 -16.467 26.785 -37.175 1.00 0.00 H ATOM 103 HZ2 LYS A 310 -18.146 26.539 -37.103 1.00 0.00 H ATOM 104 HZ3 LYS A 310 -17.527 28.095 -37.389 1.00 0.00 H ATOM 105 H LYS A 310 -14.647 26.077 -31.639 1.00 0.00 H ATOM 106 N CYS A 311 -15.669 23.317 -30.025 1.00 41.02 N ATOM 107 CA CYS A 311 -15.748 22.029 -29.353 1.00 44.23 C ATOM 108 C CYS A 311 -15.776 22.157 -27.838 1.00 40.34 C ATOM 109 O CYS A 311 -15.988 21.152 -27.152 1.00 43.19 O ATOM 110 CB CYS A 311 -14.566 21.153 -29.779 1.00 50.95 C ATOM 111 SG CYS A 311 -14.486 20.885 -31.562 1.00 60.25 S ATOM 112 H CYS A 311 -14.756 23.638 -30.406 1.00 0.00 H ATOM 113 N GLU A 312 -15.584 23.358 -27.302 1.00 34.64 N ATOM 114 CA GLU A 312 -15.525 23.513 -25.859 1.00 34.16 C ATOM 115 C GLU A 312 -16.882 23.183 -25.241 1.00 31.35 C ATOM 116 O GLU A 312 -17.920 23.584 -25.778 1.00 34.48 O ATOM 117 CB GLU A 312 -15.113 24.936 -25.483 1.00 30.87 C ATOM 118 CG GLU A 312 -13.618 25.180 -25.607 1.00 33.00 C ATOM 119 CD GLU A 312 -12.815 24.328 -24.640 1.00 35.74 C ATOM 120 OE1 GLU A 312 -12.641 24.751 -23.478 1.00 37.68 O ATOM 121 OE2 GLU A 312 -12.387 23.223 -25.037 1.00 33.16 O ATOM 122 H GLU A 312 -15.476 24.189 -27.918 1.00 0.00 H ATOM 123 N PRO A 313 -16.913 22.457 -24.126 1.00 40.74 N ATOM 124 CA PRO A 313 -18.198 22.159 -23.486 1.00 41.76 C ATOM 125 C PRO A 313 -18.847 23.409 -22.915 1.00 40.23 C ATOM 126 O PRO A 313 -18.180 24.390 -22.580 1.00 36.22 O ATOM 127 CB PRO A 313 -17.826 21.173 -22.370 1.00 42.36 C ATOM 128 CG PRO A 313 -16.459 20.683 -22.709 1.00 43.52 C ATOM 129 CD PRO A 313 -15.793 21.795 -23.430 1.00 42.31 C ATOM 130 N ASP A 314 -20.171 23.363 -22.800 1.00 36.88 N ATOM 131 CA ASP A 314 -20.912 24.433 -22.141 1.00 37.49 C ATOM 132 C ASP A 314 -20.589 24.399 -20.652 1.00 35.35 C ATOM 133 O ASP A 314 -20.973 23.460 -19.947 1.00 36.56 O ATOM 134 CB ASP A 314 -22.408 24.266 -22.396 1.00 39.20 C ATOM 135 CG ASP A 314 -23.235 25.381 -21.790 1.00 39.83 C ATOM 136 OD1 ASP A 314 -23.603 25.264 -20.603 1.00 40.20 O ATOM 137 OD2 ASP A 314 -23.528 26.366 -22.500 1.00 42.09 O ATOM 138 H ASP A 314 -20.688 22.548 -23.187 1.00 0.00 H ATOM 139 N GLU A 315 -19.868 25.413 -20.172 1.00 38.80 N ATOM 140 CA GLU A 315 -19.388 25.396 -18.792 1.00 41.38 C ATOM 141 C GLU A 315 -20.521 25.350 -17.778 1.00 44.72 C ATOM 142 O GLU A 315 -20.464 24.511 -16.861 1.00 42.38 O ATOM 143 CB GLU A 315 -18.477 26.605 -18.555 1.00 52.65 C ATOM 144 CG GLU A 315 -17.755 26.597 -17.221 1.00 60.45 C ATOM 145 CD GLU A 315 -16.829 27.788 -17.065 1.00 68.75 C ATOM 146 OE1 GLU A 315 -15.901 27.928 -17.890 1.00 69.21 O ATOM 147 OE2 GLU A 315 -17.038 28.591 -16.132 1.00 73.97 O ATOM 148 H GLU A 315 -19.645 26.223 -20.785 1.00 0.00 H ATOM 149 N PRO A 316 -21.559 26.188 -17.864 1.00 45.85 N ATOM 150 CA PRO A 316 -22.625 26.105 -16.851 1.00 47.63 C ATOM 151 C PRO A 316 -23.311 24.753 -16.821 1.00 43.31 C ATOM 152 O PRO A 316 -23.680 24.278 -15.742 1.00 40.32 O ATOM 153 CB PRO A 316 -23.591 27.228 -17.261 1.00 49.90 C ATOM 154 CG PRO A 316 -22.781 28.140 -18.125 1.00 51.11 C ATOM 155 CD PRO A 316 -21.820 27.256 -18.845 1.00 48.33 C ATOM 156 N GLN A 317 -23.486 24.109 -17.977 1.00 42.94 N ATOM 157 CA GLN A 317 -24.187 22.829 -18.000 1.00 41.21 C ATOM 158 C GLN A 317 -23.316 21.710 -17.441 1.00 40.24 C ATOM 159 O GLN A 317 -23.827 20.781 -16.803 1.00 40.34 O ATOM 160 CB GLN A 317 -24.636 22.504 -19.424 1.00 42.93 C ATOM 161 CG GLN A 317 -25.627 21.355 -19.517 1.00 46.66 C ATOM 162 CD GLN A 317 -26.867 21.579 -18.668 1.00 50.35 C ATOM 163 OE1 GLN A 317 -27.815 22.244 -19.091 1.00 56.96 O ATOM 164 NE2 GLN A 317 -26.863 21.025 -17.460 1.00 46.19 N ATOM 165 HE22 GLN A 317 -26.041 20.472 -17.144 1.00 0.00 H ATOM 166 HE21 GLN A 317 -27.682 21.145 -16.830 1.00 0.00 H ATOM 167 H GLN A 317 -23.123 24.519 -18.861 1.00 0.00 H ATOM 168 N VAL A 318 -22.002 21.770 -17.674 1.00 34.77 N ATOM 169 CA VAL A 318 -21.105 20.786 -17.073 1.00 34.89 C ATOM 170 C VAL A 318 -21.110 20.931 -15.558 1.00 32.12 C ATOM 171 O VAL A 318 -21.174 19.937 -14.824 1.00 33.77 O ATOM 172 CB VAL A 318 -19.683 20.924 -17.651 1.00 37.46 C ATOM 173 CG1 VAL A 318 -18.720 19.967 -16.953 1.00 37.00 C ATOM 174 CG2 VAL A 318 -19.683 20.654 -19.150 1.00 41.38 C ATOM 175 H VAL A 318 -21.617 22.519 -18.284 1.00 0.00 H ATOM 176 N GLN A 319 -21.052 22.170 -15.063 1.00 34.42 N ATOM 177 CA GLN A 319 -21.051 22.389 -13.620 1.00 37.97 C ATOM 178 C GLN A 319 -22.324 21.845 -12.987 1.00 38.43 C ATOM 179 O GLN A 319 -22.273 21.118 -11.988 1.00 37.48 O ATOM 180 CB GLN A 319 -20.892 23.880 -13.313 1.00 47.54 C ATOM 181 CG GLN A 319 -19.549 24.460 -13.728 1.00 55.20 C ATOM 182 CD GLN A 319 -19.374 25.904 -13.298 1.00 63.68 C ATOM 183 OE1 GLN A 319 -20.220 26.464 -12.601 1.00 66.31 O ATOM 184 NE2 GLN A 319 -18.267 26.512 -13.708 1.00 66.95 N ATOM 185 HE22 GLN A 319 -17.579 25.999 -14.296 1.00 0.00 H ATOM 186 HE21 GLN A 319 -18.088 27.501 -13.441 1.00 0.00 H ATOM 187 H GLN A 319 -21.007 22.983 -15.709 1.00 0.00 H ATOM 188 N ALA A 320 -23.481 22.186 -13.560 1.00 38.49 N ATOM 189 CA ALA A 320 -24.748 21.734 -12.997 1.00 36.99 C ATOM 190 C ALA A 320 -24.839 20.214 -12.992 1.00 34.45 C ATOM 191 O ALA A 320 -25.397 19.620 -12.061 1.00 34.48 O ATOM 192 CB ALA A 320 -25.913 22.335 -13.786 1.00 41.72 C ATOM 193 H ALA A 320 -23.478 22.779 -14.415 1.00 0.00 H ATOM 194 N LYS A 321 -24.294 19.568 -14.022 1.00 33.70 N ATOM 195 CA LYS A 321 -24.402 18.118 -14.133 1.00 36.47 C ATOM 196 C LYS A 321 -23.543 17.416 -13.086 1.00 32.75 C ATOM 197 O LYS A 321 -24.017 16.516 -12.385 1.00 32.86 O ATOM 198 CB LYS A 321 -24.011 17.682 -15.542 1.00 40.79 C ATOM 199 CG LYS A 321 -23.914 16.181 -15.745 1.00 45.54 C ATOM 200 CD LYS A 321 -22.516 15.796 -16.178 1.00 49.93 C ATOM 201 CE LYS A 321 -22.304 14.302 -16.113 1.00 52.40 C ATOM 202 NZ LYS A 321 -20.921 13.932 -16.530 1.00 53.85 N ATOM 203 HZ1 LYS A 321 -20.759 14.247 -17.508 1.00 0.00 H ATOM 204 HZ2 LYS A 321 -20.235 14.392 -15.898 1.00 0.00 H ATOM 205 HZ3 LYS A 321 -20.808 12.900 -16.474 1.00 0.00 H ATOM 206 H LYS A 321 -23.786 20.104 -14.755 1.00 0.00 H ATOM 207 N ILE A 322 -22.272 17.805 -12.971 1.00 31.85 N ATOM 208 CA ILE A 322 -21.390 17.162 -11.999 1.00 30.71 C ATOM 209 C ILE A 322 -21.827 17.511 -10.583 1.00 33.19 C ATOM 210 O ILE A 322 -21.740 16.682 -9.666 1.00 34.77 O ATOM 211 CB ILE A 322 -19.923 17.553 -12.264 1.00 34.24 C ATOM 212 CG1 ILE A 322 -19.522 17.133 -13.680 1.00 32.14 C ATOM 213 CG2 ILE A 322 -19.003 16.904 -11.226 1.00 34.67 C ATOM 214 CD1 ILE A 322 -18.096 17.491 -14.066 1.00 33.98 C ATOM 215 H ILE A 322 -21.907 18.569 -13.575 1.00 0.00 H ATOM 216 N MET A 323 -22.319 18.735 -10.382 1.00 34.25 N ATOM 217 CA MET A 323 -22.863 19.116 -9.083 1.00 38.29 C ATOM 218 C MET A 323 -23.980 18.169 -8.659 1.00 37.75 C ATOM 219 O MET A 323 -24.025 17.723 -7.506 1.00 37.92 O ATOM 220 CB MET A 323 -23.369 20.556 -9.145 1.00 47.83 C ATOM 221 CG MET A 323 -23.511 21.245 -7.796 1.00 59.39 C ATOM 222 SD MET A 323 -24.308 22.862 -7.932 1.00 69.19 S ATOM 223 CE MET A 323 -23.314 23.653 -9.199 1.00 67.33 C ATOM 224 H MET A 323 -22.315 19.425 -11.160 1.00 0.00 H ATOM 225 N ALA A 324 -24.888 17.844 -9.582 1.00 34.54 N ATOM 226 CA ALA A 324 -25.976 16.924 -9.270 1.00 35.89 C ATOM 227 C ALA A 324 -25.445 15.543 -8.907 1.00 35.19 C ATOM 228 O ALA A 324 -25.947 14.902 -7.975 1.00 36.39 O ATOM 229 CB ALA A 324 -26.935 16.832 -10.457 1.00 40.07 C ATOM 230 H ALA A 324 -24.819 18.252 -10.536 1.00 0.00 H ATOM 231 N TYR A 325 -24.430 15.067 -9.633 1.00 36.39 N ATOM 232 CA TYR A 325 -23.875 13.743 -9.364 1.00 41.02 C ATOM 233 C TYR A 325 -23.306 13.659 -7.955 1.00 41.60 C ATOM 234 O TYR A 325 -23.556 12.690 -7.228 1.00 45.45 O ATOM 235 CB TYR A 325 -22.792 13.402 -10.389 1.00 38.68 C ATOM 236 CG TYR A 325 -23.274 12.507 -11.503 1.00 43.73 C ATOM 237 CD1 TYR A 325 -23.500 11.155 -11.282 1.00 44.25 C ATOM 238 CD2 TYR A 325 -23.502 13.011 -12.776 1.00 44.70 C ATOM 239 CE1 TYR A 325 -23.945 10.330 -12.296 1.00 45.64 C ATOM 240 CE2 TYR A 325 -23.945 12.195 -13.796 1.00 49.76 C ATOM 241 CZ TYR A 325 -24.165 10.857 -13.552 1.00 49.49 C ATOM 242 OH TYR A 325 -24.609 10.047 -14.572 1.00 49.48 O ATOM 243 HH TYR A 325 -25.480 10.382 -14.903 1.00 0.00 H ATOM 244 H TYR A 325 -24.030 15.646 -10.399 1.00 0.00 H ATOM 245 N LEU A 326 -22.525 14.661 -7.554 1.00 43.02 N ATOM 246 CA LEU A 326 -21.903 14.617 -6.236 1.00 45.93 C ATOM 247 C LEU A 326 -22.942 14.767 -5.134 1.00 47.66 C ATOM 248 O LEU A 326 -22.835 14.125 -4.083 1.00 49.20 O ATOM 249 CB LEU A 326 -20.835 15.702 -6.119 1.00 47.54 C ATOM 250 CG LEU A 326 -19.745 15.719 -7.196 1.00 50.02 C ATOM 251 CD1 LEU A 326 -18.652 16.686 -6.788 1.00 53.28 C ATOM 252 CD2 LEU A 326 -19.167 14.336 -7.451 1.00 48.15 C ATOM 253 H LEU A 326 -22.359 15.474 -8.181 1.00 0.00 H ATOM 254 N GLN A 327 -23.954 15.611 -5.353 1.00 48.41 N ATOM 255 CA GLN A 327 -25.018 15.760 -4.366 1.00 50.35 C ATOM 256 C GLN A 327 -25.830 14.479 -4.222 1.00 48.51 C ATOM 257 O GLN A 327 -26.362 14.202 -3.142 1.00 49.55 O ATOM 258 CB GLN A 327 -25.928 16.929 -4.746 1.00 56.90 C ATOM 259 CG GLN A 327 -25.336 18.294 -4.429 1.00 64.72 C ATOM 260 CD GLN A 327 -25.276 18.571 -2.936 1.00 71.74 C ATOM 261 OE1 GLN A 327 -26.252 18.364 -2.214 1.00 75.67 O ATOM 262 NE2 GLN A 327 -24.123 19.037 -2.466 1.00 72.50 N ATOM 263 HE22 GLN A 327 -23.324 19.197 -3.113 1.00 0.00 H ATOM 264 HE21 GLN A 327 -24.020 19.242 -1.452 1.00 0.00 H ATOM 265 H GLN A 327 -23.984 16.165 -6.232 1.00 0.00 H ATOM 266 N GLN A 328 -25.937 13.695 -5.289 1.00 49.00 N ATOM 267 CA GLN A 328 -26.604 12.401 -5.236 1.00 54.20 C ATOM 268 C GLN A 328 -25.903 11.500 -4.226 1.00 54.38 C ATOM 269 O GLN A 328 -26.535 10.936 -3.337 1.00 53.28 O ATOM 270 CB GLN A 328 -26.609 11.746 -6.620 1.00 57.44 C ATOM 271 CG GLN A 328 -27.326 10.403 -6.697 1.00 61.15 C ATOM 272 CD GLN A 328 -26.855 9.561 -7.870 1.00 64.44 C ATOM 273 OE1 GLN A 328 -25.671 9.558 -8.212 1.00 63.13 O ATOM 274 NE2 GLN A 328 -27.783 8.846 -8.497 1.00 68.65 N ATOM 275 HE22 GLN A 328 -28.771 8.879 -8.174 1.00 0.00 H ATOM 276 HE21 GLN A 328 -27.521 8.254 -9.311 1.00 0.00 H ATOM 277 H GLN A 328 -25.531 14.015 -6.191 1.00 0.00 H TER 278 GLN A 328 ATOM 279 N LEU A 339 -18.187 8.195 2.805 1.00 59.42 N ATOM 280 CA LEU A 339 -17.393 8.599 1.649 1.00 57.51 C ATOM 281 C LEU A 339 -16.430 9.724 2.021 1.00 55.93 C ATOM 282 O LEU A 339 -16.853 10.821 2.387 1.00 55.70 O ATOM 283 CB LEU A 339 -18.301 9.048 0.503 1.00 60.15 C ATOM 284 CG LEU A 339 -17.663 9.076 -0.889 1.00 60.58 C ATOM 285 CD1 LEU A 339 -17.581 7.671 -1.472 1.00 61.78 C ATOM 286 CD2 LEU A 339 -18.431 9.999 -1.820 1.00 61.39 C ATOM 287 HN3 LEU A 339 -18.737 9.009 3.148 1.00 0.00 H ATOM 288 HN2 LEU A 339 -17.554 7.860 3.559 1.00 0.00 H ATOM 289 HN1 LEU A 339 -18.834 7.429 2.529 1.00 0.00 H ATOM 290 N SER A 340 -15.134 9.444 1.928 1.00 52.31 N ATOM 291 CA SER A 340 -14.125 10.445 2.233 1.00 49.93 C ATOM 292 C SER A 340 -14.151 11.565 1.198 1.00 45.32 C ATOM 293 O SER A 340 -14.693 11.422 0.098 1.00 41.54 O ATOM 294 CB SER A 340 -12.735 9.813 2.263 1.00 52.52 C ATOM 295 OG SER A 340 -12.482 9.100 1.067 1.00 48.75 O ATOM 296 HG SER A 340 -11.578 8.699 1.108 1.00 0.00 H ATOM 297 H SER A 340 -14.837 8.492 1.632 1.00 0.00 H ATOM 298 N THR A 341 -13.551 12.701 1.563 1.00 42.59 N ATOM 299 CA THR A 341 -13.387 13.777 0.593 1.00 43.31 C ATOM 300 C THR A 341 -12.564 13.306 -0.598 1.00 36.39 C ATOM 301 O THR A 341 -12.903 13.597 -1.752 1.00 36.30 O ATOM 302 CB THR A 341 -12.734 14.992 1.249 1.00 42.81 C ATOM 303 OG1 THR A 341 -13.505 15.393 2.386 1.00 47.13 O ATOM 304 CG2 THR A 341 -12.659 16.160 0.264 1.00 44.62 C ATOM 305 HG1 THR A 341 -13.081 16.180 2.810 1.00 0.00 H ATOM 306 H THR A 341 -13.202 12.818 2.536 1.00 0.00 H ATOM 307 N PHE A 342 -11.477 12.574 -0.339 1.00 38.20 N ATOM 308 CA PHE A 342 -10.730 11.955 -1.428 1.00 39.20 C ATOM 309 C PHE A 342 -11.642 11.084 -2.282 1.00 40.10 C ATOM 310 O PHE A 342 -11.581 11.127 -3.515 1.00 38.25 O ATOM 311 CB PHE A 342 -9.568 11.130 -0.868 1.00 42.18 C ATOM 312 CG PHE A 342 -8.891 10.269 -1.895 1.00 40.26 C ATOM 313 CD1 PHE A 342 -7.976 10.813 -2.780 1.00 40.47 C ATOM 314 CD2 PHE A 342 -9.174 8.914 -1.980 1.00 42.40 C ATOM 315 CE1 PHE A 342 -7.356 10.023 -3.735 1.00 42.21 C ATOM 316 CE2 PHE A 342 -8.556 8.119 -2.932 1.00 42.19 C ATOM 317 CZ PHE A 342 -7.646 8.676 -3.810 1.00 40.95 C ATOM 318 H PHE A 342 -11.162 12.445 0.644 1.00 0.00 H ATOM 319 N GLY A 343 -12.502 10.291 -1.640 1.00 42.25 N ATOM 320 CA GLY A 343 -13.448 9.483 -2.390 1.00 44.07 C ATOM 321 C GLY A 343 -14.405 10.322 -3.214 1.00 40.14 C ATOM 322 O GLY A 343 -14.745 9.965 -4.344 1.00 38.05 O ATOM 323 H GLY A 343 -12.495 10.251 -0.601 1.00 0.00 H ATOM 324 N LEU A 344 -14.852 11.451 -2.660 1.00 42.27 N ATOM 325 CA LEU A 344 -15.718 12.350 -3.415 1.00 37.76 C ATOM 326 C LEU A 344 -14.986 12.933 -4.618 1.00 35.53 C ATOM 327 O LEU A 344 -15.582 13.137 -5.683 1.00 32.74 O ATOM 328 CB LEU A 344 -16.227 13.467 -2.506 1.00 41.16 C ATOM 329 CG LEU A 344 -17.299 14.379 -3.106 1.00 47.22 C ATOM 330 CD1 LEU A 344 -18.610 13.621 -3.290 1.00 49.93 C ATOM 331 CD2 LEU A 344 -17.504 15.607 -2.228 1.00 52.13 C ATOM 332 H LEU A 344 -14.582 11.691 -1.685 1.00 0.00 H ATOM 333 N MET A 345 -13.690 13.210 -4.466 1.00 35.61 N ATOM 334 CA MET A 345 -12.909 13.733 -5.582 1.00 34.57 C ATOM 335 C MET A 345 -12.678 12.672 -6.650 1.00 32.16 C ATOM 336 O MET A 345 -12.576 13.003 -7.837 1.00 35.99 O ATOM 337 CB MET A 345 -11.575 14.275 -5.074 1.00 36.31 C ATOM 338 CG MET A 345 -11.702 15.460 -4.129 1.00 42.73 C ATOM 339 SD MET A 345 -12.425 16.934 -4.882 1.00 42.94 S ATOM 340 CE MET A 345 -14.125 16.801 -4.332 1.00 51.91 C ATOM 341 H MET A 345 -13.233 13.052 -3.545 1.00 0.00 H ATOM 342 N CYS A 346 -12.581 11.400 -6.257 1.00 35.25 N ATOM 343 CA CYS A 346 -12.539 10.332 -7.249 1.00 32.30 C ATOM 344 C CYS A 346 -13.810 10.325 -8.086 1.00 31.40 C ATOM 345 O CYS A 346 -13.760 10.145 -9.310 1.00 36.96 O ATOM 346 CB CYS A 346 -12.345 8.981 -6.562 1.00 36.84 C ATOM 347 SG CYS A 346 -10.701 8.744 -5.837 1.00 36.73 S ATOM 348 H CYS A 346 -12.535 11.171 -5.244 1.00 0.00 H ATOM 349 N LYS A 347 -14.960 10.526 -7.440 1.00 37.74 N ATOM 350 CA LYS A 347 -16.223 10.625 -8.162 1.00 37.28 C ATOM 351 C LYS A 347 -16.239 11.842 -9.078 1.00 36.99 C ATOM 352 O LYS A 347 -16.681 11.757 -10.228 1.00 34.59 O ATOM 353 CB LYS A 347 -17.380 10.692 -7.165 1.00 45.45 C ATOM 354 CG LYS A 347 -18.755 10.895 -7.790 1.00 59.38 C ATOM 355 CD LYS A 347 -19.053 9.891 -8.893 1.00 71.10 C ATOM 356 CE LYS A 347 -19.043 8.453 -8.387 1.00 80.06 C ATOM 357 NZ LYS A 347 -18.942 7.483 -9.507 1.00 83.05 N ATOM 358 HZ1 LYS A 347 -19.756 7.603 -10.143 1.00 0.00 H ATOM 359 HZ2 LYS A 347 -18.061 7.654 -10.033 1.00 0.00 H ATOM 360 HZ3 LYS A 347 -18.938 6.515 -9.126 1.00 0.00 H ATOM 361 H LYS A 347 -14.956 10.614 -6.404 1.00 0.00 H ATOM 362 N MET A 348 -15.759 12.984 -8.583 1.00 36.54 N ATOM 363 CA MET A 348 -15.729 14.196 -9.394 1.00 36.23 C ATOM 364 C MET A 348 -14.826 14.020 -10.607 1.00 33.74 C ATOM 365 O MET A 348 -15.173 14.442 -11.716 1.00 34.52 O ATOM 366 CB MET A 348 -15.259 15.371 -8.537 1.00 36.50 C ATOM 367 CG MET A 348 -15.445 16.741 -9.172 1.00 39.66 C ATOM 368 SD MET A 348 -14.737 18.060 -8.160 1.00 40.01 S ATOM 369 CE MET A 348 -12.993 17.671 -8.274 1.00 39.53 C ATOM 370 H MET A 348 -15.402 13.010 -7.607 1.00 0.00 H ATOM 371 N ALA A 349 -13.659 13.400 -10.415 1.00 36.48 N ATOM 372 CA ALA A 349 -12.750 13.162 -11.531 1.00 26.91 C ATOM 373 C ALA A 349 -13.351 12.175 -12.525 1.00 30.42 C ATOM 374 O ALA A 349 -13.226 12.356 -13.742 1.00 26.01 O ATOM 375 CB ALA A 349 -11.405 12.655 -11.007 1.00 34.54 C ATOM 376 H ALA A 349 -13.395 13.084 -9.460 1.00 0.00 H ATOM 377 N ASP A 350 -14.006 11.127 -12.023 1.00 32.97 N ATOM 378 CA ASP A 350 -14.686 10.178 -12.900 1.00 28.37 C ATOM 379 C ASP A 350 -15.685 10.895 -13.802 1.00 34.11 C ATOM 380 O ASP A 350 -15.729 10.658 -15.015 1.00 27.00 O ATOM 381 CB ASP A 350 -15.376 9.106 -12.051 1.00 35.49 C ATOM 382 CG ASP A 350 -15.929 7.957 -12.879 1.00 38.92 C ATOM 383 OD1 ASP A 350 -15.130 7.165 -13.423 1.00 39.42 O ATOM 384 OD2 ASP A 350 -17.168 7.829 -12.964 1.00 44.26 O ATOM 385 H ASP A 350 -14.033 10.984 -10.993 1.00 0.00 H ATOM 386 N GLN A 351 -16.489 11.793 -13.225 1.00 33.64 N ATOM 387 CA GLN A 351 -17.451 12.545 -14.023 1.00 30.77 C ATOM 388 C GLN A 351 -16.763 13.502 -14.989 1.00 34.67 C ATOM 389 O GLN A 351 -17.256 13.714 -16.103 1.00 27.33 O ATOM 390 CB GLN A 351 -18.401 13.316 -13.110 1.00 36.14 C ATOM 391 CG GLN A 351 -19.438 12.439 -12.427 1.00 41.13 C ATOM 392 CD GLN A 351 -20.363 11.758 -13.415 1.00 45.44 C ATOM 393 OE1 GLN A 351 -20.695 12.319 -14.461 1.00 48.99 O ATOM 394 NE2 GLN A 351 -20.770 10.536 -13.098 1.00 49.69 N ATOM 395 HE22 GLN A 351 -20.464 10.102 -12.204 1.00 0.00 H ATOM 396 HE21 GLN A 351 -21.395 10.012 -13.744 1.00 0.00 H ATOM 397 H GLN A 351 -16.428 11.957 -12.200 1.00 0.00 H ATOM 398 N THR A 352 -15.638 14.094 -14.586 1.00 27.85 N ATOM 399 CA THR A 352 -14.906 14.968 -15.496 1.00 27.28 C ATOM 400 C THR A 352 -14.394 14.184 -16.695 1.00 30.01 C ATOM 401 O THR A 352 -14.413 14.680 -17.828 1.00 30.63 O ATOM 402 CB THR A 352 -13.751 15.643 -14.757 1.00 29.75 C ATOM 403 OG1 THR A 352 -14.256 16.329 -13.603 1.00 30.81 O ATOM 404 CG2 THR A 352 -13.041 16.643 -15.660 1.00 29.57 C ATOM 405 HG1 THR A 352 -14.698 15.679 -13.001 1.00 0.00 H ATOM 406 H THR A 352 -15.282 13.932 -13.622 1.00 0.00 H ATOM 407 N LEU A 353 -13.944 12.946 -16.467 1.00 30.32 N ATOM 408 CA LEU A 353 -13.469 12.119 -17.571 1.00 27.09 C ATOM 409 C LEU A 353 -14.578 11.853 -18.579 1.00 26.01 C ATOM 410 O LEU A 353 -14.329 11.824 -19.791 1.00 26.89 O ATOM 411 CB LEU A 353 -12.899 10.804 -17.038 1.00 25.92 C ATOM 412 CG LEU A 353 -11.564 10.895 -16.298 1.00 31.07 C ATOM 413 CD1 LEU A 353 -11.155 9.518 -15.799 1.00 32.95 C ATOM 414 CD2 LEU A 353 -10.473 11.485 -17.184 1.00 35.15 C ATOM 415 H LEU A 353 -13.932 12.570 -15.497 1.00 0.00 H ATOM 416 N PHE A 354 -15.809 11.647 -18.106 1.00 27.92 N ATOM 417 CA PHE A 354 -16.930 11.512 -19.030 1.00 30.10 C ATOM 418 C PHE A 354 -17.056 12.751 -19.907 1.00 29.37 C ATOM 419 O PHE A 354 -17.231 12.650 -21.127 1.00 29.63 O ATOM 420 CB PHE A 354 -18.229 11.267 -18.258 1.00 36.75 C ATOM 421 CG PHE A 354 -18.466 9.823 -17.900 1.00 36.38 C ATOM 422 CD1 PHE A 354 -18.867 8.914 -18.866 1.00 37.12 C ATOM 423 CD2 PHE A 354 -18.298 9.381 -16.600 1.00 34.56 C ATOM 424 CE1 PHE A 354 -19.091 7.588 -18.540 1.00 39.83 C ATOM 425 CE2 PHE A 354 -18.523 8.055 -16.267 1.00 37.44 C ATOM 426 CZ PHE A 354 -18.918 7.159 -17.237 1.00 40.41 C ATOM 427 H PHE A 354 -15.969 11.583 -17.080 1.00 0.00 H ATOM 428 N SER A 355 -16.972 13.937 -19.298 1.00 30.83 N ATOM 429 CA SER A 355 -17.044 15.170 -20.073 1.00 30.49 C ATOM 430 C SER A 355 -15.875 15.275 -21.046 1.00 30.49 C ATOM 431 O SER A 355 -16.033 15.784 -22.163 1.00 29.73 O ATOM 432 CB SER A 355 -17.075 16.379 -19.135 1.00 33.26 C ATOM 433 OG SER A 355 -18.253 16.375 -18.347 1.00 43.29 O ATOM 434 HG SER A 355 -18.251 17.164 -17.749 1.00 0.00 H ATOM 435 H SER A 355 -16.855 13.981 -18.266 1.00 0.00 H ATOM 436 N ILE A 356 -14.696 14.795 -20.643 1.00 28.03 N ATOM 437 CA ILE A 356 -13.526 14.858 -21.517 1.00 28.93 C ATOM 438 C ILE A 356 -13.714 13.948 -22.725 1.00 28.73 C ATOM 439 O ILE A 356 -13.423 14.331 -23.864 1.00 30.55 O ATOM 440 CB ILE A 356 -12.252 14.500 -20.731 1.00 29.51 C ATOM 441 CG1 ILE A 356 -11.896 15.642 -19.773 1.00 29.92 C ATOM 442 CG2 ILE A 356 -11.089 14.215 -21.681 1.00 30.79 C ATOM 443 CD1 ILE A 356 -10.774 15.324 -18.811 1.00 31.98 C ATOM 444 H ILE A 356 -14.609 14.372 -19.697 1.00 0.00 H ATOM 445 N VAL A 357 -14.181 12.719 -22.493 1.00 29.43 N ATOM 446 CA VAL A 357 -14.425 11.795 -23.599 1.00 29.73 C ATOM 447 C VAL A 357 -15.429 12.387 -24.578 1.00 29.63 C ATOM 448 O VAL A 357 -15.266 12.276 -25.799 1.00 31.18 O ATOM 449 CB VAL A 357 -14.899 10.432 -23.060 1.00 29.15 C ATOM 450 CG1 VAL A 357 -15.358 9.527 -24.194 1.00 32.05 C ATOM 451 CG2 VAL A 357 -13.781 9.761 -22.278 1.00 29.52 C ATOM 452 H VAL A 357 -14.373 12.416 -21.517 1.00 0.00 H ATOM 453 N GLU A 358 -16.488 13.016 -24.067 1.00 30.72 N ATOM 454 CA GLU A 358 -17.471 13.614 -24.964 1.00 35.31 C ATOM 455 C GLU A 358 -16.883 14.802 -25.713 1.00 34.80 C ATOM 456 O GLU A 358 -17.162 14.991 -26.903 1.00 32.96 O ATOM 457 CB GLU A 358 -18.714 14.042 -24.191 1.00 37.65 C ATOM 458 CG GLU A 358 -19.776 14.658 -25.085 1.00 42.07 C ATOM 459 CD GLU A 358 -20.332 13.681 -26.104 1.00 44.55 C ATOM 460 OE1 GLU A 358 -20.327 12.462 -25.830 1.00 47.96 O ATOM 461 OE2 GLU A 358 -20.761 14.128 -27.187 1.00 43.37 O ATOM 462 H GLU A 358 -16.612 13.080 -23.036 1.00 0.00 H ATOM 463 N TRP A 359 -16.080 15.621 -25.031 1.00 30.68 N ATOM 464 CA TRP A 359 -15.393 16.721 -25.702 1.00 30.66 C ATOM 465 C TRP A 359 -14.600 16.221 -26.904 1.00 34.95 C ATOM 466 O TRP A 359 -14.764 16.717 -28.025 1.00 37.98 O ATOM 467 CB TRP A 359 -14.474 17.441 -24.714 1.00 31.12 C ATOM 468 CG TRP A 359 -13.394 18.237 -25.382 1.00 32.10 C ATOM 469 CD1 TRP A 359 -13.525 19.453 -25.987 1.00 37.84 C ATOM 470 CD2 TRP A 359 -12.018 17.868 -25.518 1.00 30.82 C ATOM 471 NE1 TRP A 359 -12.314 19.866 -26.486 1.00 36.51 N ATOM 472 CE2 TRP A 359 -11.373 18.909 -26.216 1.00 33.98 C ATOM 473 CE3 TRP A 359 -11.268 16.758 -25.119 1.00 28.84 C ATOM 474 CZ2 TRP A 359 -10.016 18.872 -26.522 1.00 33.47 C ATOM 475 CZ3 TRP A 359 -9.922 16.725 -25.422 1.00 30.08 C ATOM 476 CH2 TRP A 359 -9.308 17.776 -26.115 1.00 33.02 C ATOM 477 HE1 TRP A 359 -12.140 20.760 -26.987 1.00 0.00 H ATOM 478 H TRP A 359 -15.942 15.474 -24.011 1.00 0.00 H ATOM 479 N ALA A 360 -13.732 15.230 -26.688 1.00 31.01 N ATOM 480 CA ALA A 360 -12.952 14.678 -27.789 1.00 29.91 C ATOM 481 C ALA A 360 -13.857 14.048 -28.840 1.00 31.30 C ATOM 482 O ALA A 360 -13.650 14.235 -30.043 1.00 33.41 O ATOM 483 CB ALA A 360 -11.952 13.653 -27.259 1.00 29.24 C ATOM 484 H ALA A 360 -13.611 14.849 -25.728 1.00 0.00 H ATOM 485 N ARG A 361 -14.864 13.292 -28.401 1.00 34.10 N ATOM 486 CA ARG A 361 -15.827 12.714 -29.333 1.00 35.79 C ATOM 487 C ARG A 361 -16.477 13.793 -30.188 1.00 41.97 C ATOM 488 O ARG A 361 -16.635 13.626 -31.403 1.00 45.42 O ATOM 489 CB ARG A 361 -16.895 11.942 -28.561 1.00 40.74 C ATOM 490 CG ARG A 361 -17.096 10.518 -29.014 1.00 47.02 C ATOM 491 CD ARG A 361 -18.230 9.880 -28.232 1.00 50.53 C ATOM 492 NE ARG A 361 -19.530 10.285 -28.754 1.00 53.86 N ATOM 493 CZ ARG A 361 -20.139 9.705 -29.784 1.00 60.06 C ATOM 494 NH1 ARG A 361 -19.567 8.687 -30.409 1.00 62.47 N ATOM 495 NH2 ARG A 361 -21.322 10.146 -30.191 1.00 63.03 N ATOM 496 HE ARG A 361 -20.013 11.080 -28.290 1.00 0.00 H ATOM 497 HH12 ARG A 361 -20.046 8.236 -31.214 1.00 0.00 H ATOM 498 HH11 ARG A 361 -18.639 8.339 -30.095 1.00 0.00 H ATOM 499 HH22 ARG A 361 -21.797 9.692 -30.997 1.00 0.00 H ATOM 500 HH21 ARG A 361 -21.774 10.946 -29.704 1.00 0.00 H ATOM 501 H ARG A 361 -14.964 13.112 -27.382 1.00 0.00 H ATOM 502 N SER A 362 -16.868 14.906 -29.565 1.00 49.08 N ATOM 503 CA SER A 362 -17.470 16.015 -30.294 1.00 55.10 C ATOM 504 C SER A 362 -16.510 16.629 -31.297 1.00 48.89 C ATOM 505 O SER A 362 -16.949 17.323 -32.222 1.00 45.46 O ATOM 506 CB SER A 362 -17.912 17.108 -29.318 1.00 63.43 C ATOM 507 OG SER A 362 -16.878 18.065 -29.140 1.00 63.71 O ATOM 508 HG SER A 362 -16.073 17.616 -28.778 1.00 0.00 H ATOM 509 H SER A 362 -16.740 14.984 -28.536 1.00 0.00 H ATOM 510 N SER A 363 -15.218 16.371 -31.145 1.00 41.79 N ATOM 511 CA SER A 363 -14.200 17.264 -31.671 1.00 43.55 C ATOM 512 C SER A 363 -14.003 17.077 -33.166 1.00 41.25 C ATOM 513 O SER A 363 -13.923 15.950 -33.668 1.00 36.45 O ATOM 514 CB SER A 363 -12.874 17.049 -30.938 1.00 49.06 C ATOM 515 OG SER A 363 -11.792 17.579 -31.677 1.00 55.90 O ATOM 516 HG SER A 363 -11.744 17.130 -32.558 1.00 0.00 H ATOM 517 H SER A 363 -14.927 15.511 -30.638 1.00 0.00 H ATOM 518 N ILE A 364 -13.946 18.200 -33.877 1.00 42.37 N ATOM 519 CA ILE A 364 -13.356 18.218 -35.202 1.00 45.87 C ATOM 520 C ILE A 364 -12.025 17.476 -35.157 1.00 39.07 C ATOM 521 O ILE A 364 -11.300 17.527 -34.156 1.00 40.86 O ATOM 522 CB ILE A 364 -13.197 19.679 -35.657 1.00 52.46 C ATOM 523 CG1 ILE A 364 -12.762 19.754 -37.117 1.00 56.15 C ATOM 524 CG2 ILE A 364 -12.220 20.419 -34.732 1.00 53.07 C ATOM 525 CD1 ILE A 364 -12.888 21.137 -37.698 1.00 62.78 C ATOM 526 H ILE A 364 -14.331 19.079 -33.476 1.00 0.00 H ATOM 527 N PHE A 365 -11.718 16.759 -36.241 1.00 34.65 N ATOM 528 CA PHE A 365 -10.481 15.990 -36.385 1.00 33.57 C ATOM 529 C PHE A 365 -10.548 14.669 -35.632 1.00 30.73 C ATOM 530 O PHE A 365 -10.363 13.603 -36.227 1.00 37.55 O ATOM 531 CB PHE A 365 -9.264 16.790 -35.912 1.00 33.72 C ATOM 532 CG PHE A 365 -9.190 18.173 -36.485 1.00 35.27 C ATOM 533 CD1 PHE A 365 -9.394 18.387 -37.837 1.00 39.64 C ATOM 534 CD2 PHE A 365 -8.925 19.259 -35.673 1.00 39.18 C ATOM 535 CE1 PHE A 365 -9.329 19.662 -38.369 1.00 43.20 C ATOM 536 CE2 PHE A 365 -8.861 20.533 -36.197 1.00 41.74 C ATOM 537 CZ PHE A 365 -9.065 20.737 -37.547 1.00 45.83 C ATOM 538 H PHE A 365 -12.397 16.746 -37.028 1.00 0.00 H ATOM 539 N PHE A 366 -10.807 14.721 -34.325 1.00 31.12 N ATOM 540 CA PHE A 366 -10.836 13.494 -33.537 1.00 30.24 C ATOM 541 C PHE A 366 -11.927 12.551 -34.025 1.00 36.56 C ATOM 542 O PHE A 366 -11.727 11.332 -34.074 1.00 39.85 O ATOM 543 CB PHE A 366 -11.045 13.827 -32.061 1.00 30.80 C ATOM 544 CG PHE A 366 -10.786 12.672 -31.130 1.00 29.49 C ATOM 545 CD1 PHE A 366 -9.498 12.368 -30.727 1.00 32.53 C ATOM 546 CD2 PHE A 366 -11.831 11.901 -30.648 1.00 31.85 C ATOM 547 CE1 PHE A 366 -9.256 11.313 -29.860 1.00 31.06 C ATOM 548 CE2 PHE A 366 -11.592 10.845 -29.781 1.00 30.32 C ATOM 549 CZ PHE A 366 -10.307 10.553 -29.389 1.00 29.97 C ATOM 550 H PHE A 366 -10.988 15.637 -33.867 1.00 0.00 H ATOM 551 N ARG A 367 -13.090 13.094 -34.397 1.00 39.25 N ATOM 552 CA ARG A 367 -14.212 12.245 -34.775 1.00 45.59 C ATOM 553 C ARG A 367 -13.981 11.528 -36.097 1.00 47.31 C ATOM 554 O ARG A 367 -14.812 10.700 -36.484 1.00 54.89 O ATOM 555 CB ARG A 367 -15.504 13.068 -34.837 1.00 55.38 C ATOM 556 CG ARG A 367 -15.518 14.179 -35.878 1.00 69.63 C ATOM 557 CD ARG A 367 -16.773 15.038 -35.742 1.00 84.02 C ATOM 558 NE ARG A 367 -16.670 16.296 -36.480 1.00 96.53 N ATOM 559 CZ ARG A 367 -16.670 17.514 -35.938 1.00105.10 C ATOM 560 NH1 ARG A 367 -16.781 17.682 -34.628 1.00105.83 N ATOM 561 NH2 ARG A 367 -16.568 18.580 -36.719 1.00110.92 N ATOM 562 HE ARG A 367 -16.590 16.236 -37.515 1.00 0.00 H ATOM 563 HH12 ARG A 367 -16.779 18.641 -34.225 1.00 0.00 H ATOM 564 HH11 ARG A 367 -16.870 16.855 -34.003 1.00 0.00 H ATOM 565 HH22 ARG A 367 -16.567 19.532 -36.301 1.00 0.00 H ATOM 566 HH21 ARG A 367 -16.488 18.464 -37.749 1.00 0.00 H ATOM 567 H ARG A 367 -13.195 14.129 -34.417 1.00 0.00 H ATOM 568 N GLU A 368 -12.881 11.817 -36.791 1.00 45.51 N ATOM 569 CA GLU A 368 -12.545 11.107 -38.017 1.00 48.34 C ATOM 570 C GLU A 368 -11.732 9.846 -37.761 1.00 48.02 C ATOM 571 O GLU A 368 -11.771 8.914 -38.573 1.00 51.77 O ATOM 572 CB GLU A 368 -11.770 12.033 -38.957 1.00 49.96 C ATOM 573 CG GLU A 368 -12.542 13.288 -39.330 1.00 51.87 C ATOM 574 CD GLU A 368 -12.164 13.837 -40.690 1.00 54.45 C ATOM 575 OE1 GLU A 368 -12.238 15.072 -40.868 1.00 52.98 O ATOM 576 OE2 GLU A 368 -11.802 13.039 -41.580 1.00 56.71 O ATOM 577 H GLU A 368 -12.247 12.567 -36.449 1.00 0.00 H ATOM 578 N LEU A 369 -10.985 9.800 -36.662 1.00 43.40 N ATOM 579 CA LEU A 369 -10.236 8.601 -36.321 1.00 41.88 C ATOM 580 C LEU A 369 -11.192 7.453 -36.020 1.00 42.55 C ATOM 581 O LEU A 369 -12.309 7.656 -35.536 1.00 43.84 O ATOM 582 CB LEU A 369 -9.340 8.862 -35.111 1.00 42.11 C ATOM 583 CG LEU A 369 -8.207 9.867 -35.309 1.00 41.95 C ATOM 584 CD1 LEU A 369 -7.670 10.332 -33.964 1.00 41.00 C ATOM 585 CD2 LEU A 369 -7.094 9.251 -36.143 1.00 45.11 C ATOM 586 H LEU A 369 -10.936 10.631 -36.039 1.00 0.00 H ATOM 587 N LYS A 370 -10.749 6.237 -36.320 1.00 44.66 N ATOM 588 CA LYS A 370 -11.515 5.064 -35.939 1.00 47.00 C ATOM 589 C LYS A 370 -11.369 4.821 -34.439 1.00 42.43 C ATOM 590 O LYS A 370 -10.443 5.315 -33.790 1.00 41.06 O ATOM 591 CB LYS A 370 -11.065 3.840 -36.739 1.00 54.60 C ATOM 592 CG LYS A 370 -11.087 4.063 -38.246 1.00 65.53 C ATOM 593 CD LYS A 370 -11.282 2.766 -39.024 1.00 81.57 C ATOM 594 CE LYS A 370 -12.746 2.338 -39.066 1.00 93.54 C ATOM 595 NZ LYS A 370 -13.624 3.336 -39.748 1.00100.26 N ATOM 596 HZ1 LYS A 370 -13.573 4.243 -39.243 1.00 0.00 H ATOM 597 HZ2 LYS A 370 -13.303 3.465 -40.729 1.00 0.00 H ATOM 598 HZ3 LYS A 370 -14.605 2.991 -39.746 1.00 0.00 H ATOM 599 H LYS A 370 -9.850 6.125 -36.830 1.00 0.00 H ATOM 600 N VAL A 371 -12.312 4.051 -33.888 1.00 42.45 N ATOM 601 CA VAL A 371 -12.420 3.916 -32.435 1.00 41.75 C ATOM 602 C VAL A 371 -11.096 3.475 -31.827 1.00 40.63 C ATOM 603 O VAL A 371 -10.671 3.991 -30.785 1.00 36.19 O ATOM 604 CB VAL A 371 -13.557 2.942 -32.078 1.00 42.72 C ATOM 605 CG1 VAL A 371 -13.556 2.621 -30.589 1.00 42.37 C ATOM 606 CG2 VAL A 371 -14.893 3.540 -32.476 1.00 43.61 C ATOM 607 H VAL A 371 -12.979 3.540 -34.501 1.00 0.00 H ATOM 608 N ASP A 372 -10.427 2.508 -32.457 1.00 46.01 N ATOM 609 CA ASP A 372 -9.173 2.007 -31.905 1.00 48.80 C ATOM 610 C ASP A 372 -8.177 3.141 -31.696 1.00 43.89 C ATOM 611 O ASP A 372 -7.587 3.270 -30.618 1.00 40.77 O ATOM 612 CB ASP A 372 -8.592 0.926 -32.817 1.00 59.29 C ATOM 613 CG ASP A 372 -9.394 -0.360 -32.777 1.00 68.72 C ATOM 614 OD1 ASP A 372 -9.790 -0.778 -31.667 1.00 71.37 O ATOM 615 OD2 ASP A 372 -9.636 -0.951 -33.850 1.00 74.87 O ATOM 616 H ASP A 372 -10.800 2.111 -33.343 1.00 0.00 H ATOM 617 N ASP A 373 -7.989 3.990 -32.710 1.00 40.01 N ATOM 618 CA ASP A 373 -7.090 5.130 -32.553 1.00 36.64 C ATOM 619 C ASP A 373 -7.609 6.099 -31.496 1.00 35.03 C ATOM 620 O ASP A 373 -6.826 6.660 -30.719 1.00 35.13 O ATOM 621 CB ASP A 373 -6.908 5.851 -33.889 1.00 38.53 C ATOM 622 CG ASP A 373 -6.015 5.090 -34.850 1.00 41.51 C ATOM 623 OD1 ASP A 373 -5.354 4.122 -34.418 1.00 41.66 O ATOM 624 OD2 ASP A 373 -5.964 5.472 -36.039 1.00 45.07 O ATOM 625 H ASP A 373 -8.483 3.839 -33.612 1.00 0.00 H ATOM 626 N GLN A 374 -8.926 6.315 -31.454 1.00 36.11 N ATOM 627 CA GLN A 374 -9.499 7.196 -30.441 1.00 34.88 C ATOM 628 C GLN A 374 -9.188 6.697 -29.037 1.00 33.27 C ATOM 629 O GLN A 374 -8.896 7.494 -28.136 1.00 31.33 O ATOM 630 CB GLN A 374 -11.011 7.310 -30.636 1.00 35.56 C ATOM 631 CG GLN A 374 -11.424 8.066 -31.887 1.00 34.51 C ATOM 632 CD GLN A 374 -12.928 8.264 -31.976 1.00 38.09 C ATOM 633 OE1 GLN A 374 -13.702 7.509 -31.388 1.00 37.14 O ATOM 634 NE2 GLN A 374 -13.347 9.282 -32.713 1.00 42.78 N ATOM 635 HE22 GLN A 374 -12.657 9.895 -33.193 1.00 0.00 H ATOM 636 HE21 GLN A 374 -14.365 9.468 -32.812 1.00 0.00 H ATOM 637 H GLN A 374 -9.548 5.852 -32.148 1.00 0.00 H ATOM 638 N MET A 375 -9.246 5.380 -28.830 1.00 35.15 N ATOM 639 CA MET A 375 -8.958 4.824 -27.513 1.00 37.29 C ATOM 640 C MET A 375 -7.503 5.046 -27.116 1.00 37.59 C ATOM 641 O MET A 375 -7.221 5.420 -25.972 1.00 36.57 O ATOM 642 CB MET A 375 -9.290 3.332 -27.482 1.00 43.60 C ATOM 643 CG MET A 375 -10.776 3.017 -27.495 1.00 48.09 C ATOM 644 SD MET A 375 -11.113 1.257 -27.254 1.00 49.10 S ATOM 645 CE MET A 375 -10.606 1.030 -25.552 1.00 46.14 C ATOM 646 H MET A 375 -9.499 4.745 -29.614 1.00 0.00 H ATOM 647 N LYS A 376 -6.562 4.811 -28.039 1.00 36.21 N ATOM 648 CA LYS A 376 -5.147 4.960 -27.703 1.00 38.46 C ATOM 649 C LYS A 376 -4.846 6.382 -27.255 1.00 34.30 C ATOM 650 O LYS A 376 -4.195 6.597 -26.228 1.00 36.81 O ATOM 651 CB LYS A 376 -4.254 4.602 -28.894 1.00 44.15 C ATOM 652 CG LYS A 376 -4.656 3.382 -29.692 1.00 53.31 C ATOM 653 CD LYS A 376 -4.975 2.183 -28.818 1.00 61.51 C ATOM 654 CE LYS A 376 -5.300 0.968 -29.672 1.00 68.26 C ATOM 655 NZ LYS A 376 -6.505 0.240 -29.181 1.00 70.09 N ATOM 656 HZ1 LYS A 376 -6.340 -0.084 -28.207 1.00 0.00 H ATOM 657 HZ2 LYS A 376 -7.326 0.878 -29.201 1.00 0.00 H ATOM 658 HZ3 LYS A 376 -6.687 -0.580 -29.794 1.00 0.00 H ATOM 659 H LYS A 376 -6.839 4.521 -28.999 1.00 0.00 H ATOM 660 N LEU A 377 -5.300 7.370 -28.029 1.00 33.60 N ATOM 661 CA LEU A 377 -5.010 8.758 -27.695 1.00 31.83 C ATOM 662 C LEU A 377 -5.569 9.114 -26.325 1.00 29.86 C ATOM 663 O LEU A 377 -4.872 9.705 -25.493 1.00 33.64 O ATOM 664 CB LEU A 377 -5.573 9.689 -28.770 1.00 32.04 C ATOM 665 CG LEU A 377 -4.971 9.574 -30.176 1.00 34.88 C ATOM 666 CD1 LEU A 377 -5.621 10.589 -31.101 1.00 37.08 C ATOM 667 CD2 LEU A 377 -3.456 9.761 -30.164 1.00 33.90 C ATOM 668 H LEU A 377 -5.863 7.148 -28.874 1.00 0.00 H ATOM 669 N LEU A 378 -6.827 8.748 -26.065 1.00 32.32 N ATOM 670 CA LEU A 378 -7.449 9.094 -24.791 1.00 28.66 C ATOM 671 C LEU A 378 -6.802 8.342 -23.636 1.00 33.91 C ATOM 672 O LEU A 378 -6.615 8.903 -22.549 1.00 33.04 O ATOM 673 CB LEU A 378 -8.951 8.811 -24.845 1.00 32.00 C ATOM 674 CG LEU A 378 -9.790 9.853 -25.587 1.00 31.74 C ATOM 675 CD1 LEU A 378 -11.203 9.341 -25.821 1.00 33.66 C ATOM 676 CD2 LEU A 378 -9.825 11.166 -24.812 1.00 31.55 C ATOM 677 H LEU A 378 -7.367 8.213 -26.775 1.00 0.00 H ATOM 678 N GLN A 379 -6.455 7.072 -23.845 1.00 35.70 N ATOM 679 CA GLN A 379 -5.770 6.322 -22.799 1.00 35.85 C ATOM 680 C GLN A 379 -4.406 6.921 -22.489 1.00 34.33 C ATOM 681 O GLN A 379 -3.902 6.769 -21.371 1.00 35.37 O ATOM 682 CB GLN A 379 -5.622 4.860 -23.215 1.00 38.60 C ATOM 683 CG GLN A 379 -6.927 4.081 -23.224 1.00 42.54 C ATOM 684 CD GLN A 379 -6.782 2.700 -23.836 1.00 48.11 C ATOM 685 OE1 GLN A 379 -5.827 2.426 -24.564 1.00 50.07 O ATOM 686 NE2 GLN A 379 -7.730 1.819 -23.538 1.00 51.66 N ATOM 687 HE22 GLN A 379 -8.519 2.094 -22.919 1.00 0.00 H ATOM 688 HE21 GLN A 379 -7.683 0.854 -23.924 1.00 0.00 H ATOM 689 H GLN A 379 -6.673 6.616 -24.754 1.00 0.00 H ATOM 690 N ASN A 380 -3.800 7.608 -23.457 1.00 37.13 N ATOM 691 CA ASN A 380 -2.456 8.142 -23.290 1.00 35.34 C ATOM 692 C ASN A 380 -2.422 9.488 -22.575 1.00 37.72 C ATOM 693 O ASN A 380 -1.379 9.844 -22.014 1.00 40.53 O ATOM 694 CB ASN A 380 -1.786 8.287 -24.659 1.00 36.53 C ATOM 695 CG ASN A 380 -0.441 8.984 -24.582 1.00 41.02 C ATOM 696 OD1 ASN A 380 0.558 8.387 -24.180 1.00 43.47 O ATOM 697 ND2 ASN A 380 -0.406 10.253 -24.978 1.00 41.83 N ATOM 698 HD22 ASN A 380 -1.275 10.718 -25.310 1.00 0.00 H ATOM 699 HD21 ASN A 380 0.490 10.780 -24.955 1.00 0.00 H ATOM 700 H ASN A 380 -4.300 7.767 -24.355 1.00 0.00 H ATOM 701 N CYS A 381 -3.523 10.245 -22.578 1.00 35.05 N ATOM 702 CA CYS A 381 -3.490 11.632 -22.129 1.00 35.42 C ATOM 703 C CYS A 381 -4.598 11.996 -21.147 1.00 33.37 C ATOM 704 O CYS A 381 -4.706 13.170 -20.775 1.00 33.13 O ATOM 705 CB CYS A 381 -3.572 12.572 -23.337 1.00 32.80 C ATOM 706 SG CYS A 381 -5.239 12.717 -24.052 1.00 38.25 S ATOM 707 H CYS A 381 -4.421 9.837 -22.907 1.00 0.00 H ATOM 708 N TRP A 382 -5.419 11.037 -20.712 1.00 34.00 N ATOM 709 CA TRP A 382 -6.591 11.384 -19.911 1.00 30.82 C ATOM 710 C TRP A 382 -6.203 12.147 -18.647 1.00 27.88 C ATOM 711 O TRP A 382 -6.837 13.150 -18.302 1.00 32.74 O ATOM 712 CB TRP A 382 -7.384 10.124 -19.557 1.00 31.12 C ATOM 713 CG TRP A 382 -6.652 9.164 -18.671 1.00 32.27 C ATOM 714 CD1 TRP A 382 -5.811 8.165 -19.063 1.00 35.72 C ATOM 715 CD2 TRP A 382 -6.697 9.110 -17.238 1.00 34.65 C ATOM 716 NE1 TRP A 382 -5.326 7.494 -17.965 1.00 35.42 N ATOM 717 CE2 TRP A 382 -5.858 8.054 -16.833 1.00 33.78 C ATOM 718 CE3 TRP A 382 -7.362 9.855 -16.259 1.00 32.45 C ATOM 719 CZ2 TRP A 382 -5.666 7.723 -15.491 1.00 36.29 C ATOM 720 CZ3 TRP A 382 -7.172 9.524 -14.929 1.00 32.63 C ATOM 721 CH2 TRP A 382 -6.330 8.469 -14.558 1.00 34.92 C ATOM 722 HE1 TRP A 382 -4.664 6.693 -17.990 1.00 0.00 H ATOM 723 H TRP A 382 -5.224 10.042 -20.943 1.00 0.00 H ATOM 724 N SER A 383 -5.156 11.703 -17.950 1.00 35.71 N ATOM 725 CA SER A 383 -4.761 12.386 -16.723 1.00 30.44 C ATOM 726 C SER A 383 -4.123 13.738 -17.019 1.00 32.52 C ATOM 727 O SER A 383 -4.310 14.691 -16.253 1.00 30.71 O ATOM 728 CB SER A 383 -3.813 11.506 -15.910 1.00 37.13 C ATOM 729 OG SER A 383 -2.631 11.199 -16.630 1.00 36.62 O ATOM 730 HG SER A 383 -2.868 10.716 -17.461 1.00 0.00 H ATOM 731 H SER A 383 -4.623 10.873 -18.280 1.00 0.00 H ATOM 732 N GLU A 384 -3.384 13.850 -18.124 1.00 30.03 N ATOM 733 CA GLU A 384 -2.816 15.141 -18.494 1.00 28.43 C ATOM 734 C GLU A 384 -3.916 16.150 -18.808 1.00 31.92 C ATOM 735 O GLU A 384 -3.834 17.316 -18.401 1.00 31.56 O ATOM 736 CB GLU A 384 -1.865 14.970 -19.681 1.00 33.40 C ATOM 737 CG GLU A 384 -0.946 16.156 -19.921 1.00 39.64 C ATOM 738 CD GLU A 384 0.110 15.881 -20.979 1.00 44.88 C ATOM 739 OE1 GLU A 384 0.168 14.741 -21.494 1.00 48.04 O ATOM 740 OE2 GLU A 384 0.884 16.809 -21.294 1.00 41.47 O ATOM 741 H GLU A 384 -3.213 13.016 -18.722 1.00 0.00 H ATOM 742 N LEU A 385 -4.967 15.718 -19.513 1.00 29.12 N ATOM 743 CA LEU A 385 -6.094 16.609 -19.775 1.00 32.80 C ATOM 744 C LEU A 385 -6.800 16.995 -18.482 1.00 29.80 C ATOM 745 O LEU A 385 -7.260 18.133 -18.331 1.00 29.95 O ATOM 746 CB LEU A 385 -7.082 15.946 -20.740 1.00 28.21 C ATOM 747 CG LEU A 385 -6.630 15.735 -22.191 1.00 31.45 C ATOM 748 CD1 LEU A 385 -7.699 14.978 -22.970 1.00 27.53 C ATOM 749 CD2 LEU A 385 -6.319 17.060 -22.876 1.00 28.21 C ATOM 750 H LEU A 385 -4.982 14.744 -19.876 1.00 0.00 H ATOM 751 N LEU A 386 -6.898 16.059 -17.538 1.00 32.49 N ATOM 752 CA LEU A 386 -7.533 16.354 -16.262 1.00 30.09 C ATOM 753 C LEU A 386 -6.770 17.443 -15.511 1.00 33.43 C ATOM 754 O LEU A 386 -7.375 18.384 -14.982 1.00 31.84 O ATOM 755 CB LEU A 386 -7.618 15.068 -15.440 1.00 36.38 C ATOM 756 CG LEU A 386 -8.656 14.941 -14.336 1.00 41.70 C ATOM 757 CD1 LEU A 386 -10.075 14.972 -14.884 1.00 39.47 C ATOM 758 CD2 LEU A 386 -8.401 13.647 -13.575 1.00 45.16 C ATOM 759 H LEU A 386 -6.517 15.108 -17.715 1.00 0.00 H ATOM 760 N ILE A 387 -5.438 17.343 -15.478 1.00 28.23 N ATOM 761 CA ILE A 387 -4.618 18.326 -14.772 1.00 32.37 C ATOM 762 C ILE A 387 -4.592 19.649 -15.526 1.00 30.42 C ATOM 763 O ILE A 387 -4.649 20.725 -14.920 1.00 31.29 O ATOM 764 CB ILE A 387 -3.194 17.778 -14.561 1.00 32.02 C ATOM 765 CG1 ILE A 387 -3.225 16.464 -13.773 1.00 35.80 C ATOM 766 CG2 ILE A 387 -2.315 18.808 -13.860 1.00 33.27 C ATOM 767 CD1 ILE A 387 -3.863 16.560 -12.410 1.00 39.93 C ATOM 768 H ILE A 387 -4.975 16.549 -15.965 1.00 0.00 H ATOM 769 N LEU A 388 -4.472 19.599 -16.854 1.00 30.36 N ATOM 770 CA LEU A 388 -4.492 20.832 -17.634 1.00 29.77 C ATOM 771 C LEU A 388 -5.799 21.585 -17.427 1.00 31.27 C ATOM 772 O LEU A 388 -5.796 22.806 -17.226 1.00 30.01 O ATOM 773 CB LEU A 388 -4.277 20.517 -19.115 1.00 28.54 C ATOM 774 CG LEU A 388 -4.368 21.686 -20.102 1.00 27.40 C ATOM 775 CD1 LEU A 388 -3.377 22.784 -19.748 1.00 30.42 C ATOM 776 CD2 LEU A 388 -4.124 21.201 -21.520 1.00 27.02 C ATOM 777 H LEU A 388 -4.364 18.682 -17.333 1.00 0.00 H ATOM 778 N ASP A 389 -6.927 20.870 -17.468 1.00 31.45 N ATOM 779 CA ASP A 389 -8.220 21.494 -17.213 1.00 32.09 C ATOM 780 C ASP A 389 -8.259 22.121 -15.826 1.00 28.46 C ATOM 781 O ASP A 389 -8.734 23.251 -15.657 1.00 33.90 O ATOM 782 CB ASP A 389 -9.327 20.450 -17.368 1.00 35.18 C ATOM 783 CG ASP A 389 -10.710 21.015 -17.119 1.00 40.99 C ATOM 784 OD1 ASP A 389 -11.105 21.970 -17.823 1.00 41.40 O ATOM 785 OD2 ASP A 389 -11.405 20.499 -16.217 1.00 43.62 O ATOM 786 H ASP A 389 -6.882 19.854 -17.685 1.00 0.00 H ATOM 787 N HIS A 390 -7.762 21.399 -14.820 1.00 32.11 N ATOM 788 CA HIS A 390 -7.691 21.934 -13.463 1.00 28.49 C ATOM 789 C HIS A 390 -6.847 23.201 -13.413 1.00 32.60 C ATOM 790 O HIS A 390 -7.242 24.204 -12.804 1.00 29.48 O ATOM 791 CB HIS A 390 -7.115 20.872 -12.526 1.00 30.19 C ATOM 792 CG HIS A 390 -6.701 21.400 -11.188 1.00 27.04 C ATOM 793 ND1 HIS A 390 -7.610 21.720 -10.203 1.00 32.60 N ATOM 794 CD2 HIS A 390 -5.477 21.663 -10.669 1.00 28.52 C ATOM 795 CE1 HIS A 390 -6.965 22.153 -9.134 1.00 29.04 C ATOM 796 NE2 HIS A 390 -5.669 22.128 -9.390 1.00 32.47 N ATOM 797 H HIS A 390 -7.418 20.435 -15.006 1.00 0.00 H ATOM 798 N ILE A 391 -5.678 23.172 -14.055 1.00 28.88 N ATOM 799 CA ILE A 391 -4.769 24.317 -14.024 1.00 32.73 C ATOM 800 C ILE A 391 -5.417 25.530 -14.678 1.00 29.14 C ATOM 801 O ILE A 391 -5.411 26.634 -14.122 1.00 31.09 O ATOM 802 CB ILE A 391 -3.431 23.951 -14.694 1.00 29.11 C ATOM 803 CG1 ILE A 391 -2.619 23.054 -13.755 1.00 30.44 C ATOM 804 CG2 ILE A 391 -2.634 25.203 -15.061 1.00 34.10 C ATOM 805 CD1 ILE A 391 -1.385 22.433 -14.385 1.00 29.76 C ATOM 806 H ILE A 391 -5.408 22.320 -14.587 1.00 0.00 H ATOM 807 N TYR A 392 -5.982 25.350 -15.874 1.00 32.37 N ATOM 808 CA TYR A 392 -6.602 26.485 -16.547 1.00 31.88 C ATOM 809 C TYR A 392 -7.787 27.023 -15.755 1.00 30.13 C ATOM 810 O TYR A 392 -8.041 28.232 -15.770 1.00 32.04 O ATOM 811 CB TYR A 392 -7.046 26.103 -17.959 1.00 29.34 C ATOM 812 CG TYR A 392 -7.697 27.251 -18.699 1.00 33.54 C ATOM 813 CD1 TYR A 392 -6.962 28.375 -19.054 1.00 33.86 C ATOM 814 CD2 TYR A 392 -9.046 27.218 -19.034 1.00 33.22 C ATOM 815 CE1 TYR A 392 -7.550 29.430 -19.725 1.00 33.87 C ATOM 816 CE2 TYR A 392 -9.639 28.266 -19.705 1.00 33.13 C ATOM 817 CZ TYR A 392 -8.885 29.369 -20.049 1.00 35.66 C ATOM 818 OH TYR A 392 -9.470 30.420 -20.713 1.00 40.80 O ATOM 819 HH TYR A 392 -10.202 30.792 -20.160 1.00 0.00 H ATOM 820 H TYR A 392 -5.980 24.411 -16.321 1.00 0.00 H ATOM 821 N ARG A 393 -8.520 26.148 -15.061 1.00 36.97 N ATOM 822 CA ARG A 393 -9.635 26.603 -14.238 1.00 31.24 C ATOM 823 C ARG A 393 -9.159 27.558 -13.148 1.00 34.72 C ATOM 824 O ARG A 393 -9.842 28.540 -12.831 1.00 31.17 O ATOM 825 CB ARG A 393 -10.357 25.399 -13.630 1.00 39.45 C ATOM 826 CG ARG A 393 -11.560 25.757 -12.761 1.00 40.92 C ATOM 827 CD ARG A 393 -12.392 24.529 -12.398 1.00 39.85 C ATOM 828 NE ARG A 393 -12.869 23.836 -13.593 1.00 41.02 N ATOM 829 CZ ARG A 393 -12.439 22.654 -14.030 1.00 41.54 C ATOM 830 NH1 ARG A 393 -11.515 21.973 -13.368 1.00 38.12 N ATOM 831 NH2 ARG A 393 -12.953 22.143 -15.142 1.00 44.02 N ATOM 832 HE ARG A 393 -13.609 24.307 -14.151 1.00 0.00 H ATOM 833 HH12 ARG A 393 -11.192 21.051 -13.726 1.00 0.00 H ATOM 834 HH11 ARG A 393 -11.113 22.360 -12.491 1.00 0.00 H ATOM 835 HH22 ARG A 393 -12.623 21.220 -15.491 1.00 0.00 H ATOM 836 HH21 ARG A 393 -13.685 22.665 -15.664 1.00 0.00 H ATOM 837 H ARG A 393 -8.294 25.134 -15.108 1.00 0.00 H ATOM 838 N GLN A 394 -7.986 27.288 -12.561 1.00 34.41 N ATOM 839 CA GLN A 394 -7.433 28.202 -11.566 1.00 34.34 C ATOM 840 C GLN A 394 -6.986 29.506 -12.211 1.00 35.65 C ATOM 841 O GLN A 394 -7.148 30.582 -11.624 1.00 35.68 O ATOM 842 CB GLN A 394 -6.255 27.556 -10.832 1.00 33.29 C ATOM 843 CG GLN A 394 -6.498 26.141 -10.346 1.00 30.32 C ATOM 844 CD GLN A 394 -7.828 25.979 -9.645 1.00 33.40 C ATOM 845 OE1 GLN A 394 -8.184 26.765 -8.764 1.00 30.89 O ATOM 846 NE2 GLN A 394 -8.579 24.956 -10.038 1.00 34.15 N ATOM 847 HE22 GLN A 394 -8.239 24.318 -10.785 1.00 0.00 H ATOM 848 HE21 GLN A 394 -9.507 24.793 -9.598 1.00 0.00 H ATOM 849 H GLN A 394 -7.467 26.423 -12.815 1.00 0.00 H ATOM 850 N VAL A 395 -6.413 29.428 -13.414 1.00 33.16 N ATOM 851 CA VAL A 395 -5.931 30.629 -14.091 1.00 36.26 C ATOM 852 C VAL A 395 -7.072 31.620 -14.280 1.00 38.92 C ATOM 853 O VAL A 395 -6.934 32.816 -13.996 1.00 40.67 O ATOM 854 CB VAL A 395 -5.275 30.257 -15.434 1.00 34.99 C ATOM 855 CG1 VAL A 395 -4.959 31.503 -16.252 1.00 35.58 C ATOM 856 CG2 VAL A 395 -4.002 29.448 -15.191 1.00 33.18 C ATOM 857 H VAL A 395 -6.309 28.501 -13.875 1.00 0.00 H ATOM 858 N VAL A 396 -8.215 31.136 -14.762 1.00 39.19 N ATOM 859 CA VAL A 396 -9.365 31.989 -15.043 1.00 41.49 C ATOM 860 C VAL A 396 -10.074 32.356 -13.747 1.00 49.42 C ATOM 861 O VAL A 396 -10.023 33.508 -13.303 1.00 50.03 O ATOM 862 CB VAL A 396 -10.337 31.298 -16.018 1.00 38.80 C ATOM 863 CG1 VAL A 396 -11.622 32.114 -16.180 1.00 45.58 C ATOM 864 CG2 VAL A 396 -9.669 31.096 -17.369 1.00 37.36 C ATOM 865 H VAL A 396 -8.291 30.115 -14.944 1.00 0.00 H ATOM 866 N HIS A 397 -10.749 31.378 -13.139 1.00 58.00 N ATOM 867 CA HIS A 397 -11.608 31.613 -11.986 1.00 65.25 C ATOM 868 C HIS A 397 -10.863 31.593 -10.658 1.00 70.11 C ATOM 869 O HIS A 397 -11.469 31.895 -9.626 1.00 72.58 O ATOM 870 CB HIS A 397 -12.722 30.558 -11.929 1.00 67.08 C ATOM 871 CG HIS A 397 -13.428 30.344 -13.232 1.00 70.31 C ATOM 872 ND1 HIS A 397 -14.429 31.177 -13.684 1.00 72.83 N ATOM 873 CD2 HIS A 397 -13.288 29.381 -14.174 1.00 69.84 C ATOM 874 CE1 HIS A 397 -14.869 30.741 -14.851 1.00 73.28 C ATOM 875 NE2 HIS A 397 -14.192 29.653 -15.171 1.00 71.43 N ATOM 876 H HIS A 397 -10.658 30.408 -13.503 1.00 0.00 H ATOM 877 N GLY A 398 -9.576 31.245 -10.651 1.00 70.36 N ATOM 878 CA GLY A 398 -8.878 31.048 -9.400 1.00 70.60 C ATOM 879 C GLY A 398 -8.498 32.340 -8.705 1.00 73.69 C ATOM 880 O GLY A 398 -8.354 33.401 -9.312 1.00 76.33 O ATOM 881 H GLY A 398 -9.071 31.114 -11.551 1.00 0.00 H ATOM 882 N LYS A 399 -8.343 32.226 -7.388 1.00 74.58 N ATOM 883 CA LYS A 399 -7.871 33.307 -6.538 1.00 73.28 C ATOM 884 C LYS A 399 -6.740 32.788 -5.662 1.00 72.06 C ATOM 885 O LYS A 399 -6.501 31.581 -5.566 1.00 66.17 O ATOM 886 CB LYS A 399 -8.998 33.874 -5.664 1.00 71.72 C ATOM 887 CG LYS A 399 -10.083 34.599 -6.440 1.00 70.67 C ATOM 888 CD LYS A 399 -11.154 35.153 -5.513 1.00 72.02 C ATOM 889 CE LYS A 399 -12.224 35.906 -6.290 1.00 73.58 C ATOM 890 NZ LYS A 399 -13.298 36.437 -5.403 1.00 75.96 N ATOM 891 HZ1 LYS A 399 -13.756 35.648 -4.905 1.00 0.00 H ATOM 892 HZ2 LYS A 399 -12.882 37.091 -4.710 1.00 0.00 H ATOM 893 HZ3 LYS A 399 -14.003 36.941 -5.978 1.00 0.00 H ATOM 894 H LYS A 399 -8.572 31.314 -6.943 1.00 0.00 H ATOM 895 N GLU A 400 -6.039 33.719 -5.019 1.00 76.41 N ATOM 896 CA GLU A 400 -4.958 33.348 -4.116 1.00 75.27 C ATOM 897 C GLU A 400 -5.501 32.557 -2.934 1.00 66.93 C ATOM 898 O GLU A 400 -6.433 32.993 -2.252 1.00 68.16 O ATOM 899 CB GLU A 400 -4.226 34.595 -3.617 1.00 84.92 C ATOM 900 CG GLU A 400 -3.031 35.012 -4.464 1.00 90.37 C ATOM 901 CD GLU A 400 -3.414 35.899 -5.632 1.00 94.21 C ATOM 902 OE1 GLU A 400 -2.611 36.787 -5.990 1.00 98.86 O ATOM 903 OE2 GLU A 400 -4.518 35.716 -6.187 1.00 92.92 O ATOM 904 H GLU A 400 -6.266 34.724 -5.163 1.00 0.00 H ATOM 905 N GLY A 401 -4.914 31.387 -2.696 1.00 58.17 N ATOM 906 CA GLY A 401 -5.262 30.595 -1.533 1.00 52.43 C ATOM 907 C GLY A 401 -6.570 29.846 -1.631 1.00 41.50 C ATOM 908 O GLY A 401 -7.099 29.415 -0.601 1.00 38.08 O ATOM 909 H GLY A 401 -4.192 31.034 -3.356 1.00 0.00 H ATOM 910 N SER A 402 -7.112 29.678 -2.834 1.00 39.58 N ATOM 911 CA SER A 402 -8.330 28.911 -3.043 1.00 37.02 C ATOM 912 C SER A 402 -8.103 27.897 -4.154 1.00 35.52 C ATOM 913 O SER A 402 -7.144 27.988 -4.926 1.00 36.57 O ATOM 914 CB SER A 402 -9.522 29.810 -3.408 1.00 40.84 C ATOM 915 OG SER A 402 -9.709 30.844 -2.460 1.00 48.16 O ATOM 916 HG SER A 402 -10.483 31.400 -2.728 1.00 0.00 H ATOM 917 H SER A 402 -6.647 30.112 -3.657 1.00 0.00 H ATOM 918 N ILE A 403 -8.998 26.915 -4.214 1.00 34.22 N ATOM 919 CA ILE A 403 -9.062 25.959 -5.313 1.00 35.69 C ATOM 920 C ILE A 403 -10.483 25.972 -5.854 1.00 36.03 C ATOM 921 O ILE A 403 -11.447 25.876 -5.083 1.00 36.60 O ATOM 922 CB ILE A 403 -8.665 24.537 -4.868 1.00 39.81 C ATOM 923 CG1 ILE A 403 -7.178 24.478 -4.504 1.00 42.29 C ATOM 924 CG2 ILE A 403 -9.000 23.508 -5.950 1.00 38.42 C ATOM 925 CD1 ILE A 403 -6.227 24.727 -5.665 1.00 40.70 C ATOM 926 H ILE A 403 -9.686 26.825 -3.439 1.00 0.00 H ATOM 927 N PHE A 404 -10.614 26.093 -7.171 1.00 30.32 N ATOM 928 CA PHE A 404 -11.909 26.066 -7.833 1.00 32.50 C ATOM 929 C PHE A 404 -12.099 24.716 -8.506 1.00 28.79 C ATOM 930 O PHE A 404 -11.228 24.258 -9.252 1.00 34.57 O ATOM 931 CB PHE A 404 -12.031 27.199 -8.852 1.00 37.29 C ATOM 932 CG PHE A 404 -12.254 28.543 -8.225 1.00 50.64 C ATOM 933 CD1 PHE A 404 -11.248 29.154 -7.496 1.00 56.81 C ATOM 934 CD2 PHE A 404 -13.471 29.191 -8.351 1.00 55.14 C ATOM 935 CE1 PHE A 404 -11.447 30.390 -6.912 1.00 59.93 C ATOM 936 CE2 PHE A 404 -13.675 30.429 -7.768 1.00 59.50 C ATOM 937 CZ PHE A 404 -12.661 31.027 -7.048 1.00 60.39 C ATOM 938 H PHE A 404 -9.758 26.211 -7.750 1.00 0.00 H ATOM 939 N LEU A 405 -13.226 24.077 -8.221 1.00 28.71 N ATOM 940 CA LEU A 405 -13.526 22.744 -8.714 1.00 31.42 C ATOM 941 C LEU A 405 -14.450 22.823 -9.923 1.00 31.60 C ATOM 942 O LEU A 405 -15.159 23.811 -10.132 1.00 34.22 O ATOM 943 CB LEU A 405 -14.168 21.897 -7.610 1.00 32.94 C ATOM 944 CG LEU A 405 -13.385 21.827 -6.294 1.00 36.46 C ATOM 945 CD1 LEU A 405 -14.134 20.984 -5.265 1.00 35.33 C ATOM 946 CD2 LEU A 405 -11.983 21.276 -6.521 1.00 32.63 C ATOM 947 H LEU A 405 -13.927 24.552 -7.617 1.00 0.00 H ATOM 948 N VAL A 406 -14.433 21.750 -10.719 1.00 33.49 N ATOM 949 CA VAL A 406 -15.249 21.675 -11.925 1.00 35.82 C ATOM 950 C VAL A 406 -16.728 21.854 -11.614 1.00 39.52 C ATOM 951 O VAL A 406 -17.506 22.227 -12.499 1.00 42.04 O ATOM 952 CB VAL A 406 -14.988 20.334 -12.645 1.00 35.49 C ATOM 953 CG1 VAL A 406 -15.441 19.159 -11.784 1.00 34.53 C ATOM 954 CG2 VAL A 406 -15.664 20.311 -14.020 1.00 38.21 C ATOM 955 H VAL A 406 -13.821 20.946 -10.472 1.00 0.00 H ATOM 956 N THR A 407 -17.143 21.587 -10.374 1.00 41.67 N ATOM 957 CA THR A 407 -18.518 21.824 -9.946 1.00 45.08 C ATOM 958 C THR A 407 -18.826 23.298 -9.732 1.00 46.23 C ATOM 959 O THR A 407 -19.981 23.633 -9.447 1.00 45.74 O ATOM 960 CB THR A 407 -18.803 21.064 -8.649 1.00 47.75 C ATOM 961 OG1 THR A 407 -17.776 21.348 -7.688 1.00 44.53 O ATOM 962 CG2 THR A 407 -18.859 19.571 -8.906 1.00 48.30 C ATOM 963 HG1 THR A 407 -17.964 20.855 -6.850 1.00 0.00 H ATOM 964 H THR A 407 -16.464 21.197 -9.690 1.00 0.00 H ATOM 965 N GLY A 408 -17.837 24.180 -9.856 1.00 45.46 N ATOM 966 CA GLY A 408 -18.026 25.587 -9.585 1.00 44.63 C ATOM 967 C GLY A 408 -17.773 25.999 -8.151 1.00 44.00 C ATOM 968 O GLY A 408 -17.831 27.198 -7.851 1.00 47.54 O ATOM 969 H GLY A 408 -16.899 23.846 -10.157 1.00 0.00 H ATOM 970 N GLN A 409 -17.486 25.053 -7.260 1.00 42.63 N ATOM 971 CA GLN A 409 -17.261 25.372 -5.858 1.00 46.55 C ATOM 972 C GLN A 409 -15.877 25.976 -5.658 1.00 41.03 C ATOM 973 O GLN A 409 -14.904 25.588 -6.311 1.00 38.77 O ATOM 974 CB GLN A 409 -17.378 24.128 -4.978 1.00 57.45 C ATOM 975 CG GLN A 409 -18.528 23.192 -5.301 1.00 68.79 C ATOM 976 CD GLN A 409 -18.382 21.855 -4.600 1.00 74.98 C ATOM 977 OE1 GLN A 409 -18.577 20.799 -5.204 1.00 75.25 O ATOM 978 NE2 GLN A 409 -18.030 21.893 -3.319 1.00 77.84 N ATOM 979 HE22 GLN A 409 -17.876 22.808 -2.849 1.00 0.00 H ATOM 980 HE21 GLN A 409 -17.909 21.008 -2.787 1.00 0.00 H ATOM 981 H GLN A 409 -17.421 24.063 -7.573 1.00 0.00 H ATOM 982 N GLN A 410 -15.796 26.918 -4.725 1.00 40.58 N ATOM 983 CA GLN A 410 -14.541 27.528 -4.309 1.00 41.28 C ATOM 984 C GLN A 410 -14.235 27.058 -2.893 1.00 39.87 C ATOM 985 O GLN A 410 -15.017 27.312 -1.971 1.00 42.70 O ATOM 986 CB GLN A 410 -14.630 29.054 -4.369 1.00 44.80 C ATOM 987 CG GLN A 410 -13.432 29.781 -3.774 1.00 51.58 C ATOM 988 CD GLN A 410 -13.504 31.281 -3.977 1.00 61.54 C ATOM 989 OE1 GLN A 410 -14.504 31.806 -4.467 1.00 66.30 O ATOM 990 NE2 GLN A 410 -12.440 31.980 -3.602 1.00 65.57 N ATOM 991 HE22 GLN A 410 -11.617 31.494 -3.192 1.00 0.00 H ATOM 992 HE21 GLN A 410 -12.430 33.013 -3.718 1.00 0.00 H ATOM 993 H GLN A 410 -16.674 27.236 -4.268 1.00 0.00 H ATOM 994 N VAL A 411 -13.110 26.366 -2.726 1.00 39.92 N ATOM 995 CA VAL A 411 -12.690 25.837 -1.434 1.00 43.99 C ATOM 996 C VAL A 411 -11.346 26.450 -1.067 1.00 41.22 C ATOM 997 O VAL A 411 -10.509 26.701 -1.941 1.00 39.48 O ATOM 998 CB VAL A 411 -12.603 24.295 -1.453 1.00 47.38 C ATOM 999 CG1 VAL A 411 -13.986 23.688 -1.645 1.00 51.54 C ATOM 1000 CG2 VAL A 411 -11.660 23.817 -2.546 1.00 45.98 C ATOM 1001 H VAL A 411 -12.504 26.195 -3.554 1.00 0.00 H ATOM 1002 N ASP A 412 -11.147 26.700 0.227 1.00 40.37 N ATOM 1003 CA ASP A 412 -9.861 27.187 0.708 1.00 41.74 C ATOM 1004 C ASP A 412 -8.784 26.133 0.473 1.00 37.88 C ATOM 1005 O ASP A 412 -9.004 24.938 0.690 1.00 38.21 O ATOM 1006 CB ASP A 412 -9.956 27.536 2.196 1.00 47.44 C ATOM 1007 CG ASP A 412 -8.608 27.862 2.812 1.00 55.15 C ATOM 1008 OD1 ASP A 412 -8.139 29.011 2.661 1.00 58.63 O ATOM 1009 OD2 ASP A 412 -8.022 26.969 3.459 1.00 56.43 O ATOM 1010 H ASP A 412 -11.922 26.545 0.904 1.00 0.00 H ATOM 1011 N TYR A 413 -7.611 26.581 0.017 1.00 36.33 N ATOM 1012 CA TYR A 413 -6.554 25.641 -0.349 1.00 36.59 C ATOM 1013 C TYR A 413 -6.097 24.824 0.854 1.00 34.23 C ATOM 1014 O TYR A 413 -5.918 23.604 0.760 1.00 33.40 O ATOM 1015 CB TYR A 413 -5.365 26.383 -0.962 1.00 38.47 C ATOM 1016 CG TYR A 413 -4.264 25.448 -1.412 1.00 39.78 C ATOM 1017 CD1 TYR A 413 -3.312 24.980 -0.516 1.00 39.39 C ATOM 1018 CD2 TYR A 413 -4.184 25.026 -2.732 1.00 41.30 C ATOM 1019 CE1 TYR A 413 -2.312 24.118 -0.920 1.00 41.80 C ATOM 1020 CE2 TYR A 413 -3.184 24.167 -3.147 1.00 41.35 C ATOM 1021 CZ TYR A 413 -2.253 23.715 -2.237 1.00 43.96 C ATOM 1022 OH TYR A 413 -1.259 22.858 -2.648 1.00 46.67 O ATOM 1023 HH TYR A 413 -0.680 22.632 -1.877 1.00 0.00 H ATOM 1024 H TYR A 413 -7.449 27.604 -0.078 1.00 0.00 H ATOM 1025 N SER A 414 -5.878 25.486 1.994 1.00 35.25 N ATOM 1026 CA SER A 414 -5.346 24.787 3.160 1.00 39.26 C ATOM 1027 C SER A 414 -6.308 23.722 3.667 1.00 40.10 C ATOM 1028 O SER A 414 -5.869 22.685 4.177 1.00 41.48 O ATOM 1029 CB SER A 414 -5.025 25.785 4.274 1.00 42.55 C ATOM 1030 OG SER A 414 -6.171 26.535 4.644 1.00 47.64 O ATOM 1031 HG SER A 414 -6.503 27.037 3.858 1.00 0.00 H ATOM 1032 H SER A 414 -6.087 26.503 2.051 1.00 0.00 H ATOM 1033 N ILE A 415 -7.616 23.954 3.544 1.00 39.27 N ATOM 1034 CA ILE A 415 -8.588 22.960 3.989 1.00 38.39 C ATOM 1035 C ILE A 415 -8.547 21.736 3.082 1.00 38.93 C ATOM 1036 O ILE A 415 -8.403 20.601 3.552 1.00 40.72 O ATOM 1037 CB ILE A 415 -9.997 23.579 4.048 1.00 42.81 C ATOM 1038 CG1 ILE A 415 -10.062 24.620 5.172 1.00 46.49 C ATOM 1039 CG2 ILE A 415 -11.054 22.496 4.261 1.00 42.92 C ATOM 1040 CD1 ILE A 415 -11.342 25.429 5.203 1.00 51.64 C ATOM 1041 H ILE A 415 -7.945 24.849 3.128 1.00 0.00 H ATOM 1042 N ILE A 416 -8.671 21.945 1.769 1.00 34.82 N ATOM 1043 CA ILE A 416 -8.703 20.813 0.849 1.00 37.58 C ATOM 1044 C ILE A 416 -7.333 20.157 0.761 1.00 36.89 C ATOM 1045 O ILE A 416 -7.233 18.945 0.535 1.00 37.68 O ATOM 1046 CB ILE A 416 -9.214 21.252 -0.538 1.00 39.98 C ATOM 1047 CG1 ILE A 416 -9.445 20.030 -1.431 1.00 42.83 C ATOM 1048 CG2 ILE A 416 -8.236 22.218 -1.208 1.00 38.88 C ATOM 1049 CD1 ILE A 416 -10.430 20.277 -2.560 1.00 44.78 C ATOM 1050 H ILE A 416 -8.745 22.915 1.402 1.00 0.00 H ATOM 1051 N ALA A 417 -6.260 20.933 0.937 1.00 36.10 N ATOM 1052 CA ALA A 417 -4.923 20.350 0.971 1.00 37.97 C ATOM 1053 C ALA A 417 -4.766 19.411 2.159 1.00 39.23 C ATOM 1054 O ALA A 417 -4.157 18.342 2.039 1.00 41.16 O ATOM 1055 CB ALA A 417 -3.868 21.455 1.016 1.00 39.26 C ATOM 1056 H ALA A 417 -6.379 21.960 1.051 1.00 0.00 H ATOM 1057 N SER A 418 -5.309 19.791 3.318 1.00 40.39 N ATOM 1058 CA SER A 418 -5.320 18.877 4.455 1.00 39.76 C ATOM 1059 C SER A 418 -6.038 17.584 4.095 1.00 40.21 C ATOM 1060 O SER A 418 -5.501 16.486 4.282 1.00 45.81 O ATOM 1061 CB SER A 418 -5.986 19.542 5.663 1.00 37.29 C ATOM 1062 OG SER A 418 -5.240 20.656 6.118 1.00 39.63 O ATOM 1063 HG SER A 418 -5.170 21.324 5.391 1.00 0.00 H ATOM 1064 H SER A 418 -5.725 20.740 3.410 1.00 0.00 H ATOM 1065 N GLN A 419 -7.257 17.697 3.563 1.00 37.43 N ATOM 1066 CA GLN A 419 -8.042 16.517 3.223 1.00 38.42 C ATOM 1067 C GLN A 419 -7.374 15.673 2.147 1.00 38.72 C ATOM 1068 O GLN A 419 -7.653 14.472 2.055 1.00 40.98 O ATOM 1069 CB GLN A 419 -9.437 16.941 2.759 1.00 39.05 C ATOM 1070 CG GLN A 419 -10.248 17.670 3.827 1.00 38.02 C ATOM 1071 CD GLN A 419 -11.460 18.384 3.260 1.00 41.38 C ATOM 1072 OE1 GLN A 419 -11.444 18.851 2.122 1.00 44.59 O ATOM 1073 NE2 GLN A 419 -12.519 18.475 4.054 1.00 44.77 N ATOM 1074 HE22 GLN A 419 -12.489 18.066 5.010 1.00 0.00 H ATOM 1075 HE21 GLN A 419 -13.379 18.956 3.721 1.00 0.00 H ATOM 1076 H GLN A 419 -7.653 18.643 3.388 1.00 0.00 H ATOM 1077 N ALA A 420 -6.497 16.269 1.340 1.00 37.49 N ATOM 1078 CA ALA A 420 -5.840 15.542 0.262 1.00 37.24 C ATOM 1079 C ALA A 420 -4.653 14.717 0.739 1.00 37.56 C ATOM 1080 O ALA A 420 -4.244 13.785 0.039 1.00 38.14 O ATOM 1081 CB ALA A 420 -5.374 16.520 -0.818 1.00 37.74 C ATOM 1082 H ALA A 420 -6.277 17.275 1.483 1.00 0.00 H ATOM 1083 N GLY A 421 -4.094 15.029 1.904 1.00 38.50 N ATOM 1084 CA GLY A 421 -2.910 14.349 2.382 1.00 40.28 C ATOM 1085 C GLY A 421 -1.636 14.974 1.844 1.00 35.98 C ATOM 1086 O GLY A 421 -1.639 15.813 0.941 1.00 38.35 O ATOM 1087 H GLY A 421 -4.518 15.780 2.486 1.00 0.00 H ATOM 1088 N ALA A 422 -0.513 14.534 2.413 1.00 44.65 N ATOM 1089 CA ALA A 422 0.773 15.155 2.107 1.00 44.84 C ATOM 1090 C ALA A 422 1.157 14.959 0.644 1.00 45.65 C ATOM 1091 O ALA A 422 1.504 15.922 -0.050 1.00 43.05 O ATOM 1092 CB ALA A 422 1.853 14.593 3.033 1.00 49.40 C ATOM 1093 H ALA A 422 -0.553 13.739 3.083 1.00 0.00 H ATOM 1094 N THR A 423 1.106 13.717 0.154 1.00 44.96 N ATOM 1095 CA THR A 423 1.538 13.443 -1.215 1.00 43.68 C ATOM 1096 C THR A 423 0.767 14.295 -2.214 1.00 38.47 C ATOM 1097 O THR A 423 1.358 15.024 -3.019 1.00 39.28 O ATOM 1098 CB THR A 423 1.362 11.959 -1.548 1.00 46.26 C ATOM 1099 OG1 THR A 423 2.165 11.160 -0.674 1.00 47.19 O ATOM 1100 CG2 THR A 423 1.793 11.674 -2.983 1.00 46.51 C ATOM 1101 HG1 THR A 423 2.043 10.203 -0.898 1.00 0.00 H ATOM 1102 H THR A 423 0.757 12.940 0.751 1.00 0.00 H ATOM 1103 N LEU A 424 -0.564 14.198 -2.191 1.00 38.40 N ATOM 1104 CA LEU A 424 -1.365 14.928 -3.167 1.00 34.90 C ATOM 1105 C LEU A 424 -1.174 16.431 -3.026 1.00 36.34 C ATOM 1106 O LEU A 424 -1.128 17.153 -4.029 1.00 37.12 O ATOM 1107 CB LEU A 424 -2.846 14.569 -3.027 1.00 39.62 C ATOM 1108 CG LEU A 424 -3.435 13.522 -3.974 1.00 41.81 C ATOM 1109 CD1 LEU A 424 -4.939 13.402 -3.732 1.00 38.98 C ATOM 1110 CD2 LEU A 424 -3.157 13.840 -5.446 1.00 38.48 C ATOM 1111 H LEU A 424 -1.030 13.602 -1.477 1.00 0.00 H ATOM 1112 N ASN A 425 -1.075 16.928 -1.790 1.00 37.17 N ATOM 1113 CA ASN A 425 -0.836 18.355 -1.598 1.00 41.35 C ATOM 1114 C ASN A 425 0.399 18.804 -2.366 1.00 37.74 C ATOM 1115 O ASN A 425 0.416 19.894 -2.948 1.00 36.39 O ATOM 1116 CB ASN A 425 -0.678 18.678 -0.112 1.00 47.55 C ATOM 1117 CG ASN A 425 -0.395 20.153 0.132 1.00 51.48 C ATOM 1118 OD1 ASN A 425 -0.957 21.022 -0.535 1.00 51.01 O ATOM 1119 ND2 ASN A 425 0.486 20.439 1.083 1.00 56.33 N ATOM 1120 HD22 ASN A 425 0.937 19.672 1.622 1.00 0.00 H ATOM 1121 HD21 ASN A 425 0.725 21.430 1.289 1.00 0.00 H ATOM 1122 H ASN A 425 -1.168 16.300 -0.967 1.00 0.00 H ATOM 1123 N ASN A 426 1.442 17.969 -2.379 1.00 40.01 N ATOM 1124 CA ASN A 426 2.655 18.303 -3.118 1.00 42.98 C ATOM 1125 C ASN A 426 2.371 18.459 -4.607 1.00 38.49 C ATOM 1126 O ASN A 426 2.854 19.403 -5.243 1.00 33.57 O ATOM 1127 CB ASN A 426 3.719 17.230 -2.891 1.00 55.23 C ATOM 1128 CG ASN A 426 4.951 17.445 -3.746 1.00 67.37 C ATOM 1129 OD1 ASN A 426 5.440 18.567 -3.879 1.00 72.73 O ATOM 1130 ND2 ASN A 426 5.450 16.371 -4.345 1.00 71.05 N ATOM 1131 HD22 ASN A 426 5.004 15.442 -4.204 1.00 0.00 H ATOM 1132 HD21 ASN A 426 6.287 16.458 -4.956 1.00 0.00 H ATOM 1133 H ASN A 426 1.389 17.071 -1.857 1.00 0.00 H ATOM 1134 N LEU A 427 1.600 17.535 -5.185 1.00 36.46 N ATOM 1135 CA LEU A 427 1.254 17.649 -6.599 1.00 34.27 C ATOM 1136 C LEU A 427 0.353 18.852 -6.847 1.00 36.43 C ATOM 1137 O LEU A 427 0.518 19.561 -7.848 1.00 33.23 O ATOM 1138 CB LEU A 427 0.582 16.364 -7.082 1.00 32.88 C ATOM 1139 CG LEU A 427 1.378 15.068 -6.908 1.00 35.30 C ATOM 1140 CD1 LEU A 427 0.569 13.884 -7.417 1.00 35.50 C ATOM 1141 CD2 LEU A 427 2.722 15.144 -7.614 1.00 37.78 C ATOM 1142 H LEU A 427 1.245 16.732 -4.627 1.00 0.00 H ATOM 1143 N MET A 428 -0.607 19.097 -5.950 1.00 35.97 N ATOM 1144 CA MET A 428 -1.459 20.275 -6.079 1.00 36.01 C ATOM 1145 C MET A 428 -0.634 21.556 -6.012 1.00 34.38 C ATOM 1146 O MET A 428 -0.904 22.519 -6.741 1.00 33.35 O ATOM 1147 CB MET A 428 -2.526 20.272 -4.983 1.00 37.30 C ATOM 1148 CG MET A 428 -3.502 19.099 -5.040 1.00 36.57 C ATOM 1149 SD MET A 428 -4.458 18.909 -3.516 1.00 44.68 S ATOM 1150 CE MET A 428 -5.236 20.517 -3.400 1.00 41.99 C ATOM 1151 H MET A 428 -0.748 18.443 -5.154 1.00 0.00 H ATOM 1152 N SER A 429 0.376 21.583 -5.137 1.00 34.29 N ATOM 1153 CA SER A 429 1.225 22.763 -5.008 1.00 35.35 C ATOM 1154 C SER A 429 2.058 22.986 -6.266 1.00 35.67 C ATOM 1155 O SER A 429 2.212 24.124 -6.722 1.00 35.69 O ATOM 1156 CB SER A 429 2.129 22.620 -3.784 1.00 40.61 C ATOM 1157 OG SER A 429 2.904 23.789 -3.590 1.00 45.35 O ATOM 1158 HG SER A 429 3.480 23.673 -2.793 1.00 0.00 H ATOM 1159 H SER A 429 0.559 20.752 -4.540 1.00 0.00 H ATOM 1160 N HIS A 430 2.619 21.912 -6.826 1.00 37.88 N ATOM 1161 CA HIS A 430 3.317 22.015 -8.104 1.00 37.52 C ATOM 1162 C HIS A 430 2.400 22.583 -9.183 1.00 36.14 C ATOM 1163 O HIS A 430 2.795 23.481 -9.935 1.00 37.67 O ATOM 1164 CB HIS A 430 3.847 20.638 -8.508 1.00 41.78 C ATOM 1165 CG HIS A 430 4.818 20.661 -9.649 1.00 47.19 C ATOM 1166 ND1 HIS A 430 5.185 21.820 -10.299 1.00 49.14 N ATOM 1167 CD2 HIS A 430 5.503 19.660 -10.251 1.00 49.25 C ATOM 1168 CE1 HIS A 430 6.052 21.531 -11.254 1.00 48.98 C ATOM 1169 NE2 HIS A 430 6.261 20.227 -11.246 1.00 50.27 N ATOM 1170 H HIS A 430 2.558 20.991 -6.346 1.00 0.00 H ATOM 1171 N ALA A 431 1.163 22.087 -9.262 1.00 34.23 N ATOM 1172 CA ALA A 431 0.223 22.616 -10.242 1.00 30.14 C ATOM 1173 C ALA A 431 -0.044 24.096 -10.005 1.00 32.67 C ATOM 1174 O ALA A 431 -0.135 24.879 -10.958 1.00 31.69 O ATOM 1175 CB ALA A 431 -1.081 21.822 -10.202 1.00 32.65 C ATOM 1176 H ALA A 431 0.869 21.321 -8.623 1.00 0.00 H ATOM 1177 N GLN A 432 -0.167 24.503 -8.740 1.00 31.48 N ATOM 1178 CA GLN A 432 -0.387 25.916 -8.451 1.00 34.50 C ATOM 1179 C GLN A 432 0.782 26.768 -8.926 1.00 34.60 C ATOM 1180 O GLN A 432 0.583 27.916 -9.337 1.00 34.60 O ATOM 1181 CB GLN A 432 -0.628 26.125 -6.953 1.00 36.66 C ATOM 1182 CG GLN A 432 -1.962 25.585 -6.457 1.00 41.72 C ATOM 1183 CD GLN A 432 -3.151 26.223 -7.159 1.00 41.22 C ATOM 1184 OE1 GLN A 432 -3.938 25.539 -7.811 1.00 36.20 O ATOM 1185 NE2 GLN A 432 -3.286 27.537 -7.024 1.00 45.11 N ATOM 1186 HE22 GLN A 432 -2.596 28.076 -6.463 1.00 0.00 H ATOM 1187 HE21 GLN A 432 -4.082 28.027 -7.480 1.00 0.00 H ATOM 1188 H GLN A 432 -0.106 23.815 -7.963 1.00 0.00 H ATOM 1189 N GLU A 433 2.005 26.231 -8.881 1.00 38.37 N ATOM 1190 CA GLU A 433 3.142 26.949 -9.444 1.00 40.70 C ATOM 1191 C GLU A 433 2.940 27.194 -10.933 1.00 40.00 C ATOM 1192 O GLU A 433 3.199 28.295 -11.431 1.00 40.86 O ATOM 1193 CB GLU A 433 4.435 26.168 -9.200 1.00 44.05 C ATOM 1194 CG GLU A 433 4.783 25.976 -7.728 1.00 50.69 C ATOM 1195 CD GLU A 433 6.022 25.127 -7.529 1.00 56.96 C ATOM 1196 OE1 GLU A 433 6.842 25.041 -8.467 1.00 57.49 O ATOM 1197 OE2 GLU A 433 6.173 24.540 -6.437 1.00 61.56 O ATOM 1198 H GLU A 433 2.146 25.298 -8.443 1.00 0.00 H ATOM 1199 N LEU A 434 2.466 26.178 -11.658 1.00 35.77 N ATOM 1200 CA LEU A 434 2.200 26.346 -13.082 1.00 35.08 C ATOM 1201 C LEU A 434 1.089 27.363 -13.318 1.00 35.68 C ATOM 1202 O LEU A 434 1.149 28.145 -14.273 1.00 35.45 O ATOM 1203 CB LEU A 434 1.844 24.999 -13.712 1.00 40.37 C ATOM 1204 CG LEU A 434 3.029 24.143 -14.170 1.00 47.73 C ATOM 1205 CD1 LEU A 434 3.902 23.738 -13.000 1.00 51.89 C ATOM 1206 CD2 LEU A 434 2.546 22.912 -14.921 1.00 49.00 C ATOM 1207 H LEU A 434 2.285 25.260 -11.204 1.00 0.00 H ATOM 1208 N VAL A 435 0.062 27.362 -12.461 1.00 33.37 N ATOM 1209 CA VAL A 435 -0.994 28.371 -12.551 1.00 31.51 C ATOM 1210 C VAL A 435 -0.394 29.772 -12.496 1.00 32.51 C ATOM 1211 O VAL A 435 -0.725 30.643 -13.309 1.00 34.23 O ATOM 1212 CB VAL A 435 -2.029 28.165 -11.429 1.00 30.05 C ATOM 1213 CG1 VAL A 435 -3.031 29.311 -11.397 1.00 29.82 C ATOM 1214 CG2 VAL A 435 -2.756 26.839 -11.606 1.00 29.72 C ATOM 1215 H VAL A 435 0.013 26.634 -11.720 1.00 0.00 H ATOM 1216 N ALA A 436 0.484 30.014 -11.522 1.00 35.75 N ATOM 1217 CA ALA A 436 1.065 31.342 -11.357 1.00 37.47 C ATOM 1218 C ALA A 436 1.904 31.737 -12.567 1.00 38.18 C ATOM 1219 O ALA A 436 1.874 32.895 -13.002 1.00 39.54 O ATOM 1220 CB ALA A 436 1.906 31.386 -10.082 1.00 39.71 C ATOM 1221 H ALA A 436 0.757 29.248 -10.873 1.00 0.00 H ATOM 1222 N LYS A 437 2.659 30.789 -13.126 1.00 37.66 N ATOM 1223 CA LYS A 437 3.469 31.092 -14.303 1.00 38.76 C ATOM 1224 C LYS A 437 2.595 31.384 -15.518 1.00 32.72 C ATOM 1225 O LYS A 437 2.870 32.321 -16.276 1.00 34.65 O ATOM 1226 CB LYS A 437 4.421 29.933 -14.595 1.00 44.17 C ATOM 1227 CG LYS A 437 5.425 29.678 -13.482 1.00 54.09 C ATOM 1228 CD LYS A 437 6.386 28.552 -13.830 1.00 59.80 C ATOM 1229 CE LYS A 437 7.331 28.261 -12.675 1.00 63.08 C ATOM 1230 NZ LYS A 437 8.053 29.482 -12.216 1.00 64.24 N ATOM 1231 HZ1 LYS A 437 8.613 29.868 -13.003 1.00 0.00 H ATOM 1232 HZ2 LYS A 437 7.363 30.192 -11.898 1.00 0.00 H ATOM 1233 HZ3 LYS A 437 8.685 29.234 -11.428 1.00 0.00 H ATOM 1234 H LYS A 437 2.671 29.831 -12.722 1.00 0.00 H ATOM 1235 N LEU A 438 1.540 30.596 -15.724 1.00 29.15 N ATOM 1236 CA LEU A 438 0.670 30.825 -16.872 1.00 29.47 C ATOM 1237 C LEU A 438 -0.061 32.157 -16.759 1.00 30.69 C ATOM 1238 O LEU A 438 -0.288 32.832 -17.769 1.00 34.26 O ATOM 1239 CB LEU A 438 -0.320 29.669 -17.019 1.00 30.15 C ATOM 1240 CG LEU A 438 0.297 28.350 -17.490 1.00 34.88 C ATOM 1241 CD1 LEU A 438 -0.677 27.207 -17.306 1.00 28.48 C ATOM 1242 CD2 LEU A 438 0.724 28.443 -18.952 1.00 32.30 C ATOM 1243 H LEU A 438 1.337 29.817 -15.066 1.00 0.00 H ATOM 1244 N ARG A 439 -0.442 32.553 -15.544 1.00 32.44 N ATOM 1245 CA ARG A 439 -1.053 33.866 -15.354 1.00 36.24 C ATOM 1246 C ARG A 439 -0.108 34.977 -15.797 1.00 38.21 C ATOM 1247 O ARG A 439 -0.512 35.905 -16.508 1.00 39.77 O ATOM 1248 CB ARG A 439 -1.446 34.055 -13.890 1.00 41.27 C ATOM 1249 CG ARG A 439 -2.693 33.302 -13.466 1.00 46.31 C ATOM 1250 CD ARG A 439 -2.932 33.483 -11.979 1.00 53.88 C ATOM 1251 NE ARG A 439 -4.233 34.088 -11.699 1.00 66.52 N ATOM 1252 CZ ARG A 439 -5.162 33.581 -10.891 1.00 77.80 C ATOM 1253 NH1 ARG A 439 -4.959 32.445 -10.240 1.00 79.57 N ATOM 1254 NH2 ARG A 439 -6.306 34.231 -10.720 1.00 83.36 N ATOM 1255 HE ARG A 439 -4.451 34.989 -12.170 1.00 0.00 H ATOM 1256 HH12 ARG A 439 -5.697 32.066 -9.613 1.00 0.00 H ATOM 1257 HH11 ARG A 439 -4.061 31.933 -10.356 1.00 0.00 H ATOM 1258 HH22 ARG A 439 -7.036 33.841 -10.091 1.00 0.00 H ATOM 1259 HH21 ARG A 439 -6.472 35.130 -11.215 1.00 0.00 H ATOM 1260 H ARG A 439 -0.303 31.924 -14.728 1.00 0.00 H ATOM 1261 N SER A 440 1.159 34.904 -15.379 1.00 42.17 N ATOM 1262 CA SER A 440 2.111 35.950 -15.735 1.00 43.15 C ATOM 1263 C SER A 440 2.350 35.992 -17.237 1.00 45.21 C ATOM 1264 O SER A 440 2.722 37.038 -17.778 1.00 47.17 O ATOM 1265 CB SER A 440 3.432 35.737 -14.994 1.00 46.55 C ATOM 1266 OG SER A 440 4.100 34.580 -15.465 1.00 47.55 O ATOM 1267 HG SER A 440 3.525 33.787 -15.322 1.00 0.00 H ATOM 1268 H SER A 440 1.467 34.099 -14.798 1.00 0.00 H ATOM 1269 N LEU A 441 2.144 34.870 -17.922 1.00 38.29 N ATOM 1270 CA LEU A 441 2.265 34.814 -19.371 1.00 37.06 C ATOM 1271 C LEU A 441 1.005 35.278 -20.090 1.00 35.47 C ATOM 1272 O LEU A 441 1.013 35.350 -21.323 1.00 38.52 O ATOM 1273 CB LEU A 441 2.604 33.386 -19.813 1.00 36.03 C ATOM 1274 CG LEU A 441 3.967 32.829 -19.398 1.00 38.33 C ATOM 1275 CD1 LEU A 441 4.066 31.358 -19.771 1.00 40.58 C ATOM 1276 CD2 LEU A 441 5.105 33.614 -20.035 1.00 39.91 C ATOM 1277 H LEU A 441 1.888 34.005 -17.405 1.00 0.00 H ATOM 1278 N GLN A 442 -0.067 35.589 -19.359 1.00 35.31 N ATOM 1279 CA GLN A 442 -1.336 36.000 -19.961 1.00 35.90 C ATOM 1280 C GLN A 442 -1.941 34.867 -20.790 1.00 34.93 C ATOM 1281 O GLN A 442 -2.498 35.084 -21.867 1.00 33.70 O ATOM 1282 CB GLN A 442 -1.164 37.265 -20.805 1.00 44.89 C ATOM 1283 CG GLN A 442 -0.608 38.450 -20.032 1.00 49.28 C ATOM 1284 CD GLN A 442 -0.525 39.705 -20.876 1.00 53.96 C ATOM 1285 OE1 GLN A 442 -1.413 40.556 -20.831 1.00 56.49 O ATOM 1286 NE2 GLN A 442 0.543 39.825 -21.657 1.00 55.09 N ATOM 1287 HE22 GLN A 442 1.269 39.081 -21.663 1.00 0.00 H ATOM 1288 HE21 GLN A 442 0.653 40.663 -22.262 1.00 0.00 H ATOM 1289 H GLN A 442 0.002 35.537 -18.323 1.00 0.00 H ATOM 1290 N PHE A 443 -1.816 33.646 -20.277 1.00 32.39 N ATOM 1291 CA PHE A 443 -2.462 32.474 -20.858 1.00 30.73 C ATOM 1292 C PHE A 443 -3.961 32.717 -21.024 1.00 29.83 C ATOM 1293 O PHE A 443 -4.644 33.080 -20.064 1.00 32.08 O ATOM 1294 CB PHE A 443 -2.191 31.286 -19.928 1.00 30.65 C ATOM 1295 CG PHE A 443 -2.608 29.948 -20.465 1.00 33.48 C ATOM 1296 CD1 PHE A 443 -2.365 29.591 -21.779 1.00 32.87 C ATOM 1297 CD2 PHE A 443 -3.198 29.019 -19.620 1.00 31.98 C ATOM 1298 CE1 PHE A 443 -2.733 28.346 -22.248 1.00 31.99 C ATOM 1299 CE2 PHE A 443 -3.569 27.776 -20.081 1.00 33.05 C ATOM 1300 CZ PHE A 443 -3.335 27.437 -21.398 1.00 30.85 C ATOM 1301 H PHE A 443 -1.233 33.522 -19.425 1.00 0.00 H ATOM 1302 N ASP A 444 -4.477 32.527 -22.244 1.00 28.69 N ATOM 1303 CA ASP A 444 -5.893 32.782 -22.520 1.00 29.22 C ATOM 1304 C ASP A 444 -6.552 31.551 -23.140 1.00 30.61 C ATOM 1305 O ASP A 444 -5.920 30.510 -23.348 1.00 31.21 O ATOM 1306 CB ASP A 444 -6.080 34.023 -23.409 1.00 28.07 C ATOM 1307 CG ASP A 444 -5.624 33.820 -24.852 1.00 30.80 C ATOM 1308 OD1 ASP A 444 -5.572 32.673 -25.347 1.00 33.45 O ATOM 1309 OD2 ASP A 444 -5.339 34.842 -25.509 1.00 33.53 O ATOM 1310 H ASP A 444 -3.861 32.192 -23.012 1.00 0.00 H ATOM 1311 N GLN A 445 -7.851 31.688 -23.442 1.00 32.45 N ATOM 1312 CA GLN A 445 -8.662 30.532 -23.818 1.00 28.91 C ATOM 1313 C GLN A 445 -8.274 29.997 -25.190 1.00 28.42 C ATOM 1314 O GLN A 445 -8.342 28.785 -25.428 1.00 27.78 O ATOM 1315 CB GLN A 445 -10.148 30.896 -23.796 1.00 30.22 C ATOM 1316 CG GLN A 445 -11.072 29.696 -24.000 1.00 31.31 C ATOM 1317 CD GLN A 445 -12.530 30.083 -24.125 1.00 39.51 C ATOM 1318 OE1 GLN A 445 -12.857 31.207 -24.506 1.00 45.56 O ATOM 1319 NE2 GLN A 445 -13.418 29.149 -23.804 1.00 41.05 N ATOM 1320 HE22 GLN A 445 -13.096 28.212 -23.487 1.00 0.00 H ATOM 1321 HE21 GLN A 445 -14.435 29.354 -23.870 1.00 0.00 H ATOM 1322 H GLN A 445 -8.288 32.631 -23.408 1.00 0.00 H ATOM 1323 N ARG A 446 -7.891 30.883 -26.112 1.00 31.58 N ATOM 1324 CA ARG A 446 -7.442 30.435 -27.426 1.00 28.30 C ATOM 1325 C ARG A 446 -6.215 29.541 -27.296 1.00 28.61 C ATOM 1326 O ARG A 446 -6.133 28.478 -27.923 1.00 29.40 O ATOM 1327 CB ARG A 446 -7.139 31.641 -28.320 1.00 28.14 C ATOM 1328 CG ARG A 446 -8.369 32.306 -28.952 1.00 32.90 C ATOM 1329 CD ARG A 446 -9.267 32.970 -27.916 1.00 37.75 C ATOM 1330 NE ARG A 446 -8.582 34.035 -27.189 1.00 41.74 N ATOM 1331 CZ ARG A 446 -9.127 34.742 -26.202 1.00 47.90 C ATOM 1332 NH1 ARG A 446 -10.373 34.499 -25.813 1.00 51.14 N ATOM 1333 NH2 ARG A 446 -8.427 35.695 -25.601 1.00 46.35 N ATOM 1334 HE ARG A 446 -7.603 34.256 -27.461 1.00 0.00 H ATOM 1335 HH12 ARG A 446 -10.794 35.054 -25.041 1.00 0.00 H ATOM 1336 HH11 ARG A 446 -10.928 33.753 -26.280 1.00 0.00 H ATOM 1337 HH22 ARG A 446 -8.855 36.246 -24.830 1.00 0.00 H ATOM 1338 HH21 ARG A 446 -7.451 35.891 -25.901 1.00 0.00 H ATOM 1339 H ARG A 446 -7.913 31.899 -25.892 1.00 0.00 H ATOM 1340 N GLU A 447 -5.252 29.957 -26.472 1.00 31.15 N ATOM 1341 CA GLU A 447 -4.064 29.145 -26.240 1.00 23.35 C ATOM 1342 C GLU A 447 -4.406 27.862 -25.495 1.00 26.45 C ATOM 1343 O GLU A 447 -3.801 26.813 -25.750 1.00 25.41 O ATOM 1344 CB GLU A 447 -3.034 29.967 -25.465 1.00 28.00 C ATOM 1345 CG GLU A 447 -2.493 31.152 -26.261 1.00 26.68 C ATOM 1346 CD GLU A 447 -2.036 32.314 -25.399 1.00 29.61 C ATOM 1347 OE1 GLU A 447 -2.205 32.263 -24.159 1.00 28.83 O ATOM 1348 OE2 GLU A 447 -1.512 33.292 -25.976 1.00 32.67 O ATOM 1349 H GLU A 447 -5.350 30.873 -25.989 1.00 0.00 H ATOM 1350 N PHE A 448 -5.381 27.926 -24.587 1.00 28.92 N ATOM 1351 CA PHE A 448 -5.775 26.755 -23.808 1.00 27.30 C ATOM 1352 C PHE A 448 -6.284 25.635 -24.708 1.00 28.73 C ATOM 1353 O PHE A 448 -5.832 24.489 -24.605 1.00 26.67 O ATOM 1354 CB PHE A 448 -6.838 27.170 -22.787 1.00 27.29 C ATOM 1355 CG PHE A 448 -7.501 26.023 -22.072 1.00 28.65 C ATOM 1356 CD1 PHE A 448 -6.774 25.189 -21.240 1.00 28.11 C ATOM 1357 CD2 PHE A 448 -8.865 25.810 -22.202 1.00 30.60 C ATOM 1358 CE1 PHE A 448 -7.389 24.144 -20.565 1.00 32.17 C ATOM 1359 CE2 PHE A 448 -9.490 24.771 -21.528 1.00 32.74 C ATOM 1360 CZ PHE A 448 -8.749 23.939 -20.705 1.00 33.48 C ATOM 1361 H PHE A 448 -5.871 28.830 -24.430 1.00 0.00 H ATOM 1362 N VAL A 449 -7.234 25.943 -25.597 1.00 30.63 N ATOM 1363 CA VAL A 449 -7.783 24.898 -26.457 1.00 25.80 C ATOM 1364 C VAL A 449 -6.700 24.333 -27.366 1.00 24.20 C ATOM 1365 O VAL A 449 -6.704 23.136 -27.677 1.00 30.85 O ATOM 1366 CB VAL A 449 -8.995 25.425 -27.256 1.00 32.57 C ATOM 1367 CG1 VAL A 449 -10.122 25.812 -26.302 1.00 31.82 C ATOM 1368 CG2 VAL A 449 -8.617 26.604 -28.154 1.00 34.29 C ATOM 1369 H VAL A 449 -7.580 26.921 -25.676 1.00 0.00 H ATOM 1370 N CYS A 450 -5.737 25.162 -27.780 1.00 26.74 N ATOM 1371 CA CYS A 450 -4.618 24.650 -28.566 1.00 25.69 C ATOM 1372 C CYS A 450 -3.824 23.612 -27.785 1.00 29.15 C ATOM 1373 O CYS A 450 -3.468 22.557 -28.324 1.00 40.48 O ATOM 1374 CB CYS A 450 -3.703 25.795 -29.002 1.00 31.70 C ATOM 1375 SG CYS A 450 -4.346 26.807 -30.356 1.00 23.75 S ATOM 1376 H CYS A 450 -5.785 26.173 -27.542 1.00 0.00 H ATOM 1377 N LEU A 451 -3.532 23.889 -26.511 1.00 26.86 N ATOM 1378 CA LEU A 451 -2.759 22.939 -25.719 1.00 28.36 C ATOM 1379 C LEU A 451 -3.544 21.656 -25.487 1.00 24.20 C ATOM 1380 O LEU A 451 -2.968 20.562 -25.495 1.00 23.52 O ATOM 1381 CB LEU A 451 -2.346 23.570 -24.387 1.00 25.80 C ATOM 1382 CG LEU A 451 -1.377 24.760 -24.442 1.00 29.58 C ATOM 1383 CD1 LEU A 451 -0.904 25.118 -23.031 1.00 29.21 C ATOM 1384 CD2 LEU A 451 -0.186 24.500 -25.346 1.00 34.47 C ATOM 1385 H LEU A 451 -3.855 24.781 -26.085 1.00 0.00 H ATOM 1386 N LYS A 452 -4.861 21.766 -25.300 1.00 22.98 N ATOM 1387 CA LYS A 452 -5.687 20.575 -25.130 1.00 26.58 C ATOM 1388 C LYS A 452 -5.558 19.648 -26.331 1.00 25.31 C ATOM 1389 O LYS A 452 -5.423 18.428 -26.179 1.00 30.31 O ATOM 1390 CB LYS A 452 -7.149 20.966 -24.934 1.00 29.55 C ATOM 1391 CG LYS A 452 -7.488 21.531 -23.572 1.00 36.37 C ATOM 1392 CD LYS A 452 -8.975 21.852 -23.480 1.00 42.15 C ATOM 1393 CE LYS A 452 -9.832 20.601 -23.406 1.00 49.27 C ATOM 1394 NZ LYS A 452 -11.289 20.928 -23.393 1.00 51.06 N ATOM 1395 HZ1 LYS A 452 -11.503 21.521 -22.566 1.00 0.00 H ATOM 1396 HZ2 LYS A 452 -11.535 21.443 -24.263 1.00 0.00 H ATOM 1397 HZ3 LYS A 452 -11.840 20.048 -23.342 1.00 0.00 H ATOM 1398 H LYS A 452 -5.302 22.708 -25.275 1.00 0.00 H ATOM 1399 N PHE A 453 -5.614 20.210 -27.539 1.00 26.50 N ATOM 1400 CA PHE A 453 -5.511 19.383 -28.735 1.00 26.79 C ATOM 1401 C PHE A 453 -4.095 18.864 -28.943 1.00 26.68 C ATOM 1402 O PHE A 453 -3.918 17.744 -29.435 1.00 26.65 O ATOM 1403 CB PHE A 453 -5.987 20.166 -29.958 1.00 25.34 C ATOM 1404 CG PHE A 453 -7.471 20.084 -30.178 1.00 27.41 C ATOM 1405 CD1 PHE A 453 -8.340 20.838 -29.410 1.00 26.60 C ATOM 1406 CD2 PHE A 453 -7.994 19.245 -31.146 1.00 32.78 C ATOM 1407 CE1 PHE A 453 -9.706 20.758 -29.602 1.00 27.24 C ATOM 1408 CE2 PHE A 453 -9.358 19.163 -31.348 1.00 35.02 C ATOM 1409 CZ PHE A 453 -10.216 19.919 -30.574 1.00 32.94 C ATOM 1410 H PHE A 453 -5.731 21.240 -27.628 1.00 0.00 H ATOM 1411 N LEU A 454 -3.078 19.647 -28.572 1.00 28.70 N ATOM 1412 CA LEU A 454 -1.707 19.148 -28.654 1.00 29.20 C ATOM 1413 C LEU A 454 -1.502 17.973 -27.707 1.00 28.65 C ATOM 1414 O LEU A 454 -0.798 17.012 -28.038 1.00 30.09 O ATOM 1415 CB LEU A 454 -0.712 20.268 -28.338 1.00 28.95 C ATOM 1416 CG LEU A 454 -0.562 21.401 -29.358 1.00 32.43 C ATOM 1417 CD1 LEU A 454 0.406 22.461 -28.847 1.00 33.61 C ATOM 1418 CD2 LEU A 454 -0.086 20.871 -30.702 1.00 36.83 C ATOM 1419 H LEU A 454 -3.262 20.610 -28.225 1.00 0.00 H ATOM 1420 N VAL A 455 -2.104 18.038 -26.519 1.00 30.35 N ATOM 1421 CA VAL A 455 -2.031 16.924 -25.579 1.00 30.74 C ATOM 1422 C VAL A 455 -2.783 15.715 -26.123 1.00 30.72 C ATOM 1423 O VAL A 455 -2.306 14.575 -26.033 1.00 28.34 O ATOM 1424 CB VAL A 455 -2.578 17.368 -24.210 1.00 35.78 C ATOM 1425 CG1 VAL A 455 -2.776 16.181 -23.280 1.00 37.36 C ATOM 1426 CG2 VAL A 455 -1.640 18.386 -23.579 1.00 35.36 C ATOM 1427 H VAL A 455 -2.633 18.895 -26.259 1.00 0.00 H ATOM 1428 N LEU A 456 -3.969 15.942 -26.692 1.00 26.18 N ATOM 1429 CA LEU A 456 -4.767 14.843 -27.227 1.00 27.19 C ATOM 1430 C LEU A 456 -4.089 14.201 -28.433 1.00 30.59 C ATOM 1431 O LEU A 456 -3.976 12.972 -28.509 1.00 34.37 O ATOM 1432 CB LEU A 456 -6.166 15.348 -27.595 1.00 28.16 C ATOM 1433 CG LEU A 456 -7.147 14.326 -28.178 1.00 29.92 C ATOM 1434 CD1 LEU A 456 -7.410 13.195 -27.193 1.00 34.00 C ATOM 1435 CD2 LEU A 456 -8.459 14.999 -28.579 1.00 31.05 C ATOM 1436 H LEU A 456 -4.330 16.915 -26.755 1.00 0.00 H ATOM 1437 N PHE A 457 -3.621 15.017 -29.380 1.00 23.38 N ATOM 1438 CA PHE A 457 -3.016 14.513 -30.616 1.00 32.47 C ATOM 1439 C PHE A 457 -1.502 14.400 -30.441 1.00 35.68 C ATOM 1440 O PHE A 457 -0.701 15.075 -31.090 1.00 40.11 O ATOM 1441 CB PHE A 457 -3.375 15.412 -31.790 1.00 31.25 C ATOM 1442 CG PHE A 457 -4.785 15.237 -32.273 1.00 32.88 C ATOM 1443 CD1 PHE A 457 -5.834 15.868 -31.629 1.00 31.80 C ATOM 1444 CD2 PHE A 457 -5.060 14.437 -33.370 1.00 36.47 C ATOM 1445 CE1 PHE A 457 -7.134 15.705 -32.072 1.00 29.84 C ATOM 1446 CE2 PHE A 457 -6.356 14.269 -33.813 1.00 34.67 C ATOM 1447 CZ PHE A 457 -7.393 14.903 -33.164 1.00 30.66 C ATOM 1448 H PHE A 457 -3.688 16.045 -29.236 1.00 0.00 H ATOM 1449 N SER A 458 -1.120 13.500 -29.545 1.00 42.04 N ATOM 1450 CA SER A 458 0.285 13.300 -29.239 1.00 48.64 C ATOM 1451 C SER A 458 0.983 12.511 -30.345 1.00 52.00 C ATOM 1452 O SER A 458 0.390 11.637 -30.982 1.00 53.24 O ATOM 1453 CB SER A 458 0.423 12.566 -27.910 1.00 54.31 C ATOM 1454 OG SER A 458 1.731 12.062 -27.764 1.00 60.54 O ATOM 1455 HG SER A 458 1.806 11.588 -26.898 1.00 0.00 H ATOM 1456 H SER A 458 -1.838 12.929 -29.054 1.00 0.00 H ATOM 1457 N LEU A 459 2.261 12.831 -30.571 1.00 56.54 N ATOM 1458 CA LEU A 459 3.102 12.079 -31.499 1.00 66.62 C ATOM 1459 C LEU A 459 3.835 10.919 -30.833 1.00 72.36 C ATOM 1460 O LEU A 459 4.364 10.056 -31.544 1.00 76.59 O ATOM 1461 CB LEU A 459 4.133 13.006 -32.167 1.00 69.56 C ATOM 1462 CG LEU A 459 3.593 14.222 -32.926 1.00 70.38 C ATOM 1463 CD1 LEU A 459 4.722 14.951 -33.633 1.00 72.75 C ATOM 1464 CD2 LEU A 459 2.512 13.825 -33.924 1.00 71.85 C ATOM 1465 H LEU A 459 2.671 13.644 -30.068 1.00 0.00 H ATOM 1466 N ASP A 460 3.889 10.878 -29.499 1.00 72.80 N ATOM 1467 CA ASP A 460 4.544 9.782 -28.791 1.00 76.45 C ATOM 1468 C ASP A 460 3.647 8.558 -28.636 1.00 70.92 C ATOM 1469 O ASP A 460 4.064 7.586 -27.996 1.00 70.53 O ATOM 1470 CB ASP A 460 5.044 10.247 -27.410 1.00 82.89 C ATOM 1471 CG ASP A 460 3.944 10.827 -26.535 1.00 85.36 C ATOM 1472 OD1 ASP A 460 2.809 10.304 -26.549 1.00 86.48 O ATOM 1473 OD2 ASP A 460 4.217 11.817 -25.822 1.00 85.44 O ATOM 1474 H ASP A 460 3.453 11.647 -28.951 1.00 0.00 H ATOM 1475 N VAL A 461 2.440 8.578 -29.196 1.00 66.43 N ATOM 1476 CA VAL A 461 1.589 7.394 -29.226 1.00 65.70 C ATOM 1477 C VAL A 461 2.014 6.511 -30.394 1.00 67.26 C ATOM 1478 O VAL A 461 1.987 6.936 -31.550 1.00 66.91 O ATOM 1479 CB VAL A 461 0.093 7.770 -29.329 1.00 62.40 C ATOM 1480 CG1 VAL A 461 -0.765 6.528 -29.554 1.00 63.66 C ATOM 1481 CG2 VAL A 461 -0.363 8.500 -28.071 1.00 60.51 C ATOM 1482 H VAL A 461 2.095 9.461 -29.623 1.00 0.00 H TER 1483 VAL A 461 ATOM 1484 N LEU A 464 -0.870 3.321 -34.511 1.00 60.59 N ATOM 1485 CA LEU A 464 -1.957 4.159 -35.007 1.00 59.61 C ATOM 1486 C LEU A 464 -2.284 3.836 -36.461 1.00 62.47 C ATOM 1487 O LEU A 464 -1.405 3.855 -37.321 1.00 65.93 O ATOM 1488 CB LEU A 464 -1.594 5.641 -34.880 1.00 58.70 C ATOM 1489 CG LEU A 464 -1.486 6.236 -33.473 1.00 58.49 C ATOM 1490 CD1 LEU A 464 -1.179 7.722 -33.563 1.00 56.96 C ATOM 1491 CD2 LEU A 464 -2.753 6.013 -32.667 1.00 57.91 C ATOM 1492 HN3 LEU A 464 -0.019 3.483 -35.087 1.00 0.00 H ATOM 1493 HN2 LEU A 464 -1.148 2.321 -34.575 1.00 0.00 H ATOM 1494 HN1 LEU A 464 -0.671 3.564 -33.520 1.00 0.00 H ATOM 1495 N GLU A 465 -3.559 3.547 -36.733 1.00 63.52 N ATOM 1496 CA GLU A 465 -3.971 3.266 -38.104 1.00 68.76 C ATOM 1497 C GLU A 465 -3.878 4.508 -38.980 1.00 69.98 C ATOM 1498 O GLU A 465 -3.673 4.393 -40.194 1.00 79.46 O ATOM 1499 CB GLU A 465 -5.396 2.707 -38.124 1.00 72.40 C ATOM 1500 CG GLU A 465 -5.866 2.220 -39.497 1.00 80.45 C ATOM 1501 CD GLU A 465 -6.392 3.334 -40.390 1.00 84.39 C ATOM 1502 OE1 GLU A 465 -6.700 4.427 -39.870 1.00 82.60 O ATOM 1503 OE2 GLU A 465 -6.495 3.112 -41.615 1.00 88.01 O ATOM 1504 H GLU A 465 -4.260 3.522 -35.965 1.00 0.00 H ATOM 1505 N ASN A 466 -4.017 5.697 -38.390 1.00 56.91 N ATOM 1506 CA ASN A 466 -3.989 6.952 -39.137 1.00 52.38 C ATOM 1507 C ASN A 466 -3.055 7.946 -38.442 1.00 46.24 C ATOM 1508 O ASN A 466 -3.462 9.014 -37.987 1.00 43.18 O ATOM 1509 CB ASN A 466 -5.394 7.537 -39.281 1.00 51.72 C ATOM 1510 CG ASN A 466 -5.466 8.617 -40.345 1.00 52.18 C ATOM 1511 OD1 ASN A 466 -4.441 9.117 -40.803 1.00 50.33 O ATOM 1512 ND2 ASN A 466 -6.679 8.987 -40.736 1.00 52.92 N ATOM 1513 HD22 ASN A 466 -7.519 8.536 -40.321 1.00 0.00 H ATOM 1514 HD21 ASN A 466 -6.789 9.728 -41.458 1.00 0.00 H ATOM 1515 H ASN A 466 -4.150 5.731 -37.359 1.00 0.00 H ATOM 1516 N PHE A 467 -1.772 7.583 -38.363 1.00 47.75 N ATOM 1517 CA PHE A 467 -0.775 8.502 -37.828 1.00 48.84 C ATOM 1518 C PHE A 467 -0.638 9.755 -38.685 1.00 49.47 C ATOM 1519 O PHE A 467 -0.214 10.797 -38.175 1.00 48.31 O ATOM 1520 CB PHE A 467 0.578 7.795 -37.712 1.00 55.53 C ATOM 1521 CG PHE A 467 1.685 8.675 -37.195 1.00 60.45 C ATOM 1522 CD1 PHE A 467 1.833 8.899 -35.837 1.00 61.06 C ATOM 1523 CD2 PHE A 467 2.584 9.269 -38.068 1.00 63.67 C ATOM 1524 CE1 PHE A 467 2.851 9.705 -35.358 1.00 62.93 C ATOM 1525 CE2 PHE A 467 3.604 10.077 -37.594 1.00 62.97 C ATOM 1526 CZ PHE A 467 3.738 10.293 -36.238 1.00 63.01 C ATOM 1527 H PHE A 467 -1.482 6.638 -38.686 1.00 0.00 H ATOM 1528 N GLN A 468 -0.992 9.677 -39.971 1.00 52.73 N ATOM 1529 CA GLN A 468 -0.913 10.846 -40.842 1.00 51.90 C ATOM 1530 C GLN A 468 -1.845 11.951 -40.366 1.00 45.10 C ATOM 1531 O GLN A 468 -1.471 13.130 -40.355 1.00 40.66 O ATOM 1532 CB GLN A 468 -1.256 10.450 -42.277 1.00 56.86 C ATOM 1533 CG GLN A 468 -0.385 9.349 -42.839 1.00 64.88 C ATOM 1534 CD GLN A 468 1.047 9.789 -43.029 1.00 69.58 C ATOM 1535 OE1 GLN A 468 1.714 10.206 -42.084 1.00 70.02 O ATOM 1536 NE2 GLN A 468 1.529 9.702 -44.263 1.00 74.50 N ATOM 1537 HE22 GLN A 468 0.928 9.343 -45.032 1.00 0.00 H ATOM 1538 HE21 GLN A 468 2.508 9.993 -44.461 1.00 0.00 H ATOM 1539 H GLN A 468 -1.328 8.772 -40.357 1.00 0.00 H ATOM 1540 N LEU A 469 -3.070 11.590 -39.982 1.00 44.59 N ATOM 1541 CA LEU A 469 -4.009 12.576 -39.459 1.00 43.19 C ATOM 1542 C LEU A 469 -3.493 13.180 -38.158 1.00 40.09 C ATOM 1543 O LEU A 469 -3.490 14.404 -37.985 1.00 38.01 O ATOM 1544 CB LEU A 469 -5.379 11.925 -39.252 1.00 46.29 C ATOM 1545 CG LEU A 469 -6.521 12.812 -38.749 1.00 50.55 C ATOM 1546 CD1 LEU A 469 -6.818 13.928 -39.733 1.00 52.93 C ATOM 1547 CD2 LEU A 469 -7.769 11.977 -38.503 1.00 54.91 C ATOM 1548 H LEU A 469 -3.359 10.594 -40.056 1.00 0.00 H ATOM 1549 N VAL A 470 -3.039 12.331 -37.233 1.00 40.75 N ATOM 1550 CA VAL A 470 -2.549 12.819 -35.945 1.00 37.77 C ATOM 1551 C VAL A 470 -1.366 13.757 -36.152 1.00 40.03 C ATOM 1552 O VAL A 470 -1.320 14.862 -35.599 1.00 37.10 O ATOM 1553 CB VAL A 470 -2.183 11.635 -35.030 1.00 37.44 C ATOM 1554 CG1 VAL A 470 -1.570 12.119 -33.720 1.00 37.08 C ATOM 1555 CG2 VAL A 470 -3.414 10.784 -34.746 1.00 36.11 C ATOM 1556 H VAL A 470 -3.034 11.310 -37.431 1.00 0.00 H ATOM 1557 N GLU A 471 -0.391 13.330 -36.957 1.00 42.58 N ATOM 1558 CA GLU A 471 0.773 14.170 -37.214 1.00 47.11 C ATOM 1559 C GLU A 471 0.365 15.489 -37.858 1.00 44.73 C ATOM 1560 O GLU A 471 0.886 16.552 -37.499 1.00 43.17 O ATOM 1561 CB GLU A 471 1.768 13.421 -38.100 1.00 57.54 C ATOM 1562 CG GLU A 471 3.016 14.213 -38.457 1.00 65.26 C ATOM 1563 CD GLU A 471 3.882 13.496 -39.468 1.00 71.60 C ATOM 1564 OE1 GLU A 471 3.570 12.332 -39.799 1.00 71.31 O ATOM 1565 OE2 GLU A 471 4.870 14.098 -39.936 1.00 77.93 O ATOM 1566 H GLU A 471 -0.462 12.393 -37.403 1.00 0.00 H ATOM 1567 N GLY A 472 -0.569 15.441 -38.809 1.00 41.76 N ATOM 1568 CA GLY A 472 -0.999 16.658 -39.475 1.00 40.54 C ATOM 1569 C GLY A 472 -1.741 17.602 -38.549 1.00 36.59 C ATOM 1570 O GLY A 472 -1.550 18.820 -38.608 1.00 36.28 O ATOM 1571 H GLY A 472 -0.991 14.528 -39.075 1.00 0.00 H ATOM 1572 N VAL A 473 -2.602 17.061 -37.687 1.00 38.16 N ATOM 1573 CA VAL A 473 -3.285 17.904 -36.711 1.00 34.02 C ATOM 1574 C VAL A 473 -2.265 18.568 -35.795 1.00 33.67 C ATOM 1575 O VAL A 473 -2.332 19.775 -35.530 1.00 33.34 O ATOM 1576 CB VAL A 473 -4.316 17.081 -35.915 1.00 33.42 C ATOM 1577 CG1 VAL A 473 -4.848 17.876 -34.736 1.00 31.36 C ATOM 1578 CG2 VAL A 473 -5.467 16.669 -36.826 1.00 33.99 C ATOM 1579 H VAL A 473 -2.787 16.038 -37.710 1.00 0.00 H ATOM 1580 N GLN A 474 -1.294 17.789 -35.311 1.00 36.80 N ATOM 1581 CA GLN A 474 -0.266 18.340 -34.433 1.00 36.72 C ATOM 1582 C GLN A 474 0.469 19.497 -35.103 1.00 38.52 C ATOM 1583 O GLN A 474 0.704 20.538 -34.477 1.00 37.79 O ATOM 1584 CB GLN A 474 0.717 17.238 -34.025 1.00 44.51 C ATOM 1585 CG GLN A 474 1.930 17.697 -33.200 1.00 53.81 C ATOM 1586 CD GLN A 474 1.631 17.864 -31.720 1.00 61.54 C ATOM 1587 OE1 GLN A 474 0.637 17.348 -31.211 1.00 63.48 O ATOM 1588 NE2 GLN A 474 2.503 18.584 -31.019 1.00 65.70 N ATOM 1589 HE22 GLN A 474 3.330 19.002 -31.491 1.00 0.00 H ATOM 1590 HE21 GLN A 474 2.357 18.729 -29.999 1.00 0.00 H ATOM 1591 H GLN A 474 -1.270 16.780 -35.562 1.00 0.00 H ATOM 1592 N GLU A 475 0.835 19.340 -36.377 1.00 40.07 N ATOM 1593 CA GLU A 475 1.619 20.373 -37.046 1.00 45.20 C ATOM 1594 C GLU A 475 0.788 21.629 -37.292 1.00 38.19 C ATOM 1595 O GLU A 475 1.294 22.749 -37.157 1.00 35.77 O ATOM 1596 CB GLU A 475 2.194 19.827 -38.355 1.00 53.14 C ATOM 1597 CG GLU A 475 1.359 20.096 -39.599 1.00 59.95 C ATOM 1598 CD GLU A 475 1.848 19.311 -40.804 1.00 66.64 C ATOM 1599 OE1 GLU A 475 2.946 18.718 -40.723 1.00 67.95 O ATOM 1600 OE2 GLU A 475 1.134 19.282 -41.829 1.00 68.33 O ATOM 1601 H GLU A 475 0.561 18.480 -36.894 1.00 0.00 H ATOM 1602 N GLN A 476 -0.491 21.469 -37.634 1.00 35.11 N ATOM 1603 CA GLN A 476 -1.332 22.628 -37.916 1.00 31.44 C ATOM 1604 C GLN A 476 -1.752 23.355 -36.645 1.00 28.70 C ATOM 1605 O GLN A 476 -1.859 24.586 -36.652 1.00 30.32 O ATOM 1606 CB GLN A 476 -2.566 22.201 -38.714 1.00 33.20 C ATOM 1607 CG GLN A 476 -2.243 21.676 -40.110 1.00 34.08 C ATOM 1608 CD GLN A 476 -1.674 22.744 -41.022 1.00 35.87 C ATOM 1609 OE1 GLN A 476 -1.934 23.933 -40.843 1.00 38.84 O ATOM 1610 NE2 GLN A 476 -0.889 22.324 -42.007 1.00 38.13 N ATOM 1611 HE22 GLN A 476 -0.696 21.308 -42.121 1.00 0.00 H ATOM 1612 HE21 GLN A 476 -0.467 23.011 -42.664 1.00 0.00 H ATOM 1613 H GLN A 476 -0.892 20.512 -37.700 1.00 0.00 H ATOM 1614 N VAL A 477 -1.996 22.625 -35.556 1.00 24.59 N ATOM 1615 CA VAL A 477 -2.314 23.277 -34.290 1.00 29.56 C ATOM 1616 C VAL A 477 -1.104 24.041 -33.769 1.00 26.46 C ATOM 1617 O VAL A 477 -1.230 25.177 -33.298 1.00 28.55 O ATOM 1618 CB VAL A 477 -2.822 22.242 -33.269 1.00 30.22 C ATOM 1619 CG1 VAL A 477 -2.952 22.860 -31.874 1.00 26.50 C ATOM 1620 CG2 VAL A 477 -4.168 21.690 -33.715 1.00 30.05 C ATOM 1621 H VAL A 477 -1.959 21.587 -35.609 1.00 0.00 H ATOM 1622 N ASN A 478 0.085 23.439 -33.845 1.00 30.32 N ATOM 1623 CA ASN A 478 1.300 24.146 -33.453 1.00 31.72 C ATOM 1624 C ASN A 478 1.460 25.439 -34.245 1.00 32.73 C ATOM 1625 O ASN A 478 1.756 26.496 -33.677 1.00 34.14 O ATOM 1626 CB ASN A 478 2.520 23.244 -33.647 1.00 34.81 C ATOM 1627 CG ASN A 478 2.931 22.532 -32.371 1.00 37.06 C ATOM 1628 OD1 ASN A 478 2.901 23.111 -31.286 1.00 37.00 O ATOM 1629 ND2 ASN A 478 3.322 21.270 -32.498 1.00 41.38 N ATOM 1630 HD22 ASN A 478 3.331 20.820 -33.436 1.00 0.00 H ATOM 1631 HD21 ASN A 478 3.619 20.731 -31.660 1.00 0.00 H ATOM 1632 H ASN A 478 0.146 22.458 -34.186 1.00 0.00 H ATOM 1633 N ALA A 479 1.256 25.374 -35.563 1.00 30.00 N ATOM 1634 CA ALA A 479 1.417 26.562 -36.397 1.00 35.55 C ATOM 1635 C ALA A 479 0.381 27.625 -36.052 1.00 25.71 C ATOM 1636 O ALA A 479 0.695 28.822 -36.037 1.00 27.65 O ATOM 1637 CB ALA A 479 1.321 26.181 -37.875 1.00 31.07 C ATOM 1638 H ALA A 479 0.980 24.471 -35.999 1.00 0.00 H ATOM 1639 N ALA A 480 -0.859 27.210 -35.780 1.00 28.83 N ATOM 1640 CA ALA A 480 -1.904 28.163 -35.415 1.00 28.57 C ATOM 1641 C ALA A 480 -1.628 28.796 -34.057 1.00 26.29 C ATOM 1642 O ALA A 480 -1.906 29.984 -33.852 1.00 25.44 O ATOM 1643 CB ALA A 480 -3.269 27.473 -35.409 1.00 28.94 C ATOM 1644 H ALA A 480 -1.083 26.196 -35.829 1.00 0.00 H ATOM 1645 N LEU A 481 -1.093 28.018 -33.112 1.00 26.74 N ATOM 1646 CA LEU A 481 -0.758 28.570 -31.801 1.00 25.82 C ATOM 1647 C LEU A 481 0.395 29.560 -31.899 1.00 25.96 C ATOM 1648 O LEU A 481 0.365 30.619 -31.262 1.00 29.45 O ATOM 1649 CB LEU A 481 -0.411 27.441 -30.828 1.00 25.06 C ATOM 1650 CG LEU A 481 0.007 27.856 -29.412 1.00 27.35 C ATOM 1651 CD1 LEU A 481 -1.121 28.596 -28.703 1.00 26.25 C ATOM 1652 CD2 LEU A 481 0.442 26.640 -28.608 1.00 27.23 C ATOM 1653 H LEU A 481 -0.914 27.013 -33.311 1.00 0.00 H ATOM 1654 N LEU A 482 1.424 29.233 -32.685 1.00 23.40 N ATOM 1655 CA LEU A 482 2.522 30.172 -32.895 1.00 28.07 C ATOM 1656 C LEU A 482 2.021 31.455 -33.546 1.00 29.44 C ATOM 1657 O LEU A 482 2.338 32.562 -33.095 1.00 27.52 O ATOM 1658 CB LEU A 482 3.611 29.523 -33.749 1.00 26.86 C ATOM 1659 CG LEU A 482 4.744 30.446 -34.206 1.00 31.70 C ATOM 1660 CD1 LEU A 482 5.434 31.100 -33.014 1.00 35.08 C ATOM 1661 CD2 LEU A 482 5.743 29.678 -35.045 1.00 32.76 C ATOM 1662 H LEU A 482 1.443 28.303 -33.151 1.00 0.00 H ATOM 1663 N ASP A 483 1.226 31.324 -34.609 1.00 31.50 N ATOM 1664 CA ASP A 483 0.678 32.504 -35.266 1.00 32.62 C ATOM 1665 C ASP A 483 -0.122 33.354 -34.288 1.00 27.11 C ATOM 1666 O ASP A 483 0.019 34.582 -34.262 1.00 29.75 O ATOM 1667 CB ASP A 483 -0.196 32.086 -36.447 1.00 37.79 C ATOM 1668 CG ASP A 483 -0.520 33.245 -37.369 1.00 50.23 C ATOM 1669 OD1 ASP A 483 -1.546 33.920 -37.146 1.00 54.11 O ATOM 1670 OD2 ASP A 483 0.257 33.480 -38.317 1.00 58.72 O ATOM 1671 H ASP A 483 0.996 30.376 -34.970 1.00 0.00 H ATOM 1672 N TYR A 484 -0.963 32.718 -33.471 1.00 28.89 N ATOM 1673 CA TYR A 484 -1.824 33.470 -32.564 1.00 28.18 C ATOM 1674 C TYR A 484 -1.009 34.187 -31.493 1.00 28.45 C ATOM 1675 O TYR A 484 -1.230 35.374 -31.223 1.00 29.53 O ATOM 1676 CB TYR A 484 -2.853 32.540 -31.920 1.00 29.89 C ATOM 1677 CG TYR A 484 -3.694 33.224 -30.866 1.00 28.66 C ATOM 1678 CD1 TYR A 484 -4.847 33.920 -31.211 1.00 29.99 C ATOM 1679 CD2 TYR A 484 -3.330 33.182 -29.526 1.00 30.50 C ATOM 1680 CE1 TYR A 484 -5.615 34.550 -30.252 1.00 29.02 C ATOM 1681 CE2 TYR A 484 -4.090 33.809 -28.559 1.00 31.34 C ATOM 1682 CZ TYR A 484 -5.232 34.490 -28.927 1.00 34.26 C ATOM 1683 OH TYR A 484 -5.992 35.118 -27.969 1.00 34.96 O ATOM 1684 HH TYR A 484 -6.310 34.450 -27.312 1.00 0.00 H ATOM 1685 H TYR A 484 -1.005 31.679 -33.480 1.00 0.00 H ATOM 1686 N THR A 485 -0.065 33.483 -30.861 1.00 29.02 N ATOM 1687 CA THR A 485 0.702 34.103 -29.783 1.00 29.45 C ATOM 1688 C THR A 485 1.589 35.220 -30.313 1.00 29.96 C ATOM 1689 O THR A 485 1.715 36.272 -29.677 1.00 32.54 O ATOM 1690 CB THR A 485 1.549 33.060 -29.050 1.00 33.79 C ATOM 1691 OG1 THR A 485 2.478 32.454 -29.959 1.00 33.91 O ATOM 1692 CG2 THR A 485 0.669 31.988 -28.422 1.00 33.24 C ATOM 1693 HG1 THR A 485 1.980 32.013 -30.692 1.00 0.00 H ATOM 1694 H THR A 485 0.123 32.498 -31.135 1.00 0.00 H ATOM 1695 N MET A 486 2.208 35.014 -31.479 1.00 32.50 N ATOM 1696 CA MET A 486 3.065 36.048 -32.047 1.00 34.50 C ATOM 1697 C MET A 486 2.262 37.285 -32.420 1.00 37.16 C ATOM 1698 O MET A 486 2.723 38.416 -32.224 1.00 40.69 O ATOM 1699 CB MET A 486 3.805 35.507 -33.269 1.00 39.49 C ATOM 1700 CG MET A 486 5.064 34.730 -32.936 1.00 47.83 C ATOM 1701 SD MET A 486 6.224 34.641 -34.318 1.00 55.69 S ATOM 1702 CE MET A 486 6.740 36.352 -34.450 1.00 59.44 C ATOM 1703 H MET A 486 2.078 34.114 -31.983 1.00 0.00 H ATOM 1704 N CYS A 487 1.056 37.095 -32.958 1.00 35.75 N ATOM 1705 CA CYS A 487 0.269 38.231 -33.420 1.00 36.87 C ATOM 1706 C CYS A 487 -0.472 38.922 -32.283 1.00 36.31 C ATOM 1707 O CYS A 487 -0.702 40.134 -32.349 1.00 37.63 O ATOM 1708 CB CYS A 487 -0.726 37.783 -34.492 1.00 42.57 C ATOM 1709 SG CYS A 487 0.036 37.366 -36.085 1.00 51.98 S ATOM 1710 H CYS A 487 0.676 36.131 -33.048 1.00 0.00 H ATOM 1711 N ASN A 488 -0.844 38.186 -31.237 1.00 34.65 N ATOM 1712 CA ASN A 488 -1.667 38.750 -30.175 1.00 36.25 C ATOM 1713 C ASN A 488 -0.895 39.083 -28.907 1.00 36.16 C ATOM 1714 O ASN A 488 -1.413 39.833 -28.071 1.00 35.70 O ATOM 1715 CB ASN A 488 -2.812 37.792 -29.834 1.00 34.39 C ATOM 1716 CG ASN A 488 -3.898 37.793 -30.893 1.00 37.03 C ATOM 1717 OD1 ASN A 488 -4.835 38.586 -30.830 1.00 39.74 O ATOM 1718 ND2 ASN A 488 -3.762 36.921 -31.887 1.00 35.93 N ATOM 1719 HD22 ASN A 488 -2.952 36.268 -31.899 1.00 0.00 H ATOM 1720 HD21 ASN A 488 -4.465 36.891 -32.653 1.00 0.00 H ATOM 1721 H ASN A 488 -0.542 37.193 -31.177 1.00 0.00 H ATOM 1722 N TYR A 489 0.317 38.552 -28.740 1.00 35.47 N ATOM 1723 CA TYR A 489 1.172 38.890 -27.600 1.00 35.35 C ATOM 1724 C TYR A 489 2.604 39.070 -28.090 1.00 34.51 C ATOM 1725 O TYR A 489 3.531 38.406 -27.617 1.00 35.21 O ATOM 1726 CB TYR A 489 1.087 37.814 -26.518 1.00 32.15 C ATOM 1727 CG TYR A 489 -0.308 37.608 -25.979 1.00 33.75 C ATOM 1728 CD1 TYR A 489 -1.171 36.698 -26.569 1.00 32.16 C ATOM 1729 CD2 TYR A 489 -0.762 38.325 -24.879 1.00 37.49 C ATOM 1730 CE1 TYR A 489 -2.448 36.503 -26.081 1.00 30.62 C ATOM 1731 CE2 TYR A 489 -2.041 38.139 -24.383 1.00 35.49 C ATOM 1732 CZ TYR A 489 -2.878 37.224 -24.987 1.00 32.96 C ATOM 1733 OH TYR A 489 -4.154 37.033 -24.505 1.00 32.54 O ATOM 1734 HH TYR A 489 -4.613 36.347 -25.051 1.00 0.00 H ATOM 1735 H TYR A 489 0.668 37.873 -29.445 1.00 0.00 H ATOM 1736 N PRO A 490 2.821 39.981 -29.043 1.00 35.76 N ATOM 1737 CA PRO A 490 4.169 40.117 -29.615 1.00 39.90 C ATOM 1738 C PRO A 490 5.192 40.662 -28.636 1.00 39.29 C ATOM 1739 O PRO A 490 6.387 40.388 -28.797 1.00 38.85 O ATOM 1740 CB PRO A 490 3.951 41.072 -30.796 1.00 40.88 C ATOM 1741 CG PRO A 490 2.771 41.875 -30.404 1.00 39.60 C ATOM 1742 CD PRO A 490 1.882 40.964 -29.607 1.00 37.50 C ATOM 1743 N GLN A 491 4.773 41.434 -27.631 1.00 41.13 N ATOM 1744 CA GLN A 491 5.718 41.921 -26.633 1.00 44.97 C ATOM 1745 C GLN A 491 6.137 40.833 -25.655 1.00 44.71 C ATOM 1746 O GLN A 491 7.198 40.951 -25.033 1.00 47.61 O ATOM 1747 CB GLN A 491 5.118 43.104 -25.868 1.00 45.79 C ATOM 1748 CG GLN A 491 5.017 44.381 -26.687 1.00 46.70 C ATOM 1749 CD GLN A 491 6.375 44.918 -27.101 1.00 53.24 C ATOM 1750 OE1 GLN A 491 7.315 44.929 -26.307 1.00 56.78 O ATOM 1751 NE2 GLN A 491 6.484 45.362 -28.348 1.00 54.54 N ATOM 1752 HE22 GLN A 491 5.662 45.333 -28.984 1.00 0.00 H ATOM 1753 HE21 GLN A 491 7.392 45.739 -28.688 1.00 0.00 H ATOM 1754 H GLN A 491 3.767 41.689 -27.559 1.00 0.00 H ATOM 1755 N GLN A 492 5.333 39.783 -25.507 1.00 46.11 N ATOM 1756 CA GLN A 492 5.685 38.636 -24.674 1.00 49.28 C ATOM 1757 C GLN A 492 6.577 37.718 -25.505 1.00 47.15 C ATOM 1758 O GLN A 492 6.107 36.830 -26.219 1.00 43.62 O ATOM 1759 CB GLN A 492 4.431 37.921 -24.190 1.00 54.72 C ATOM 1760 CG GLN A 492 4.704 36.835 -23.163 1.00 65.59 C ATOM 1761 CD GLN A 492 4.562 37.325 -21.733 1.00 75.73 C ATOM 1762 OE1 GLN A 492 3.678 38.123 -21.419 1.00 78.23 O ATOM 1763 NE2 GLN A 492 5.440 36.849 -20.857 1.00 81.22 N ATOM 1764 HE22 GLN A 492 6.170 36.176 -21.166 1.00 0.00 H ATOM 1765 HE21 GLN A 492 5.397 37.149 -19.862 1.00 0.00 H ATOM 1766 H GLN A 492 4.419 39.779 -26.003 1.00 0.00 H ATOM 1767 N THR A 493 7.886 37.939 -25.406 1.00 48.59 N ATOM 1768 CA THR A 493 8.837 37.224 -26.247 1.00 47.94 C ATOM 1769 C THR A 493 8.749 35.722 -26.008 1.00 43.66 C ATOM 1770 O THR A 493 8.710 35.263 -24.863 1.00 40.77 O ATOM 1771 CB THR A 493 10.261 37.708 -25.968 1.00 53.55 C ATOM 1772 OG1 THR A 493 10.267 39.134 -25.832 1.00 57.37 O ATOM 1773 CG2 THR A 493 11.193 37.304 -27.108 1.00 51.51 C ATOM 1774 HG1 THR A 493 11.190 39.443 -25.652 1.00 0.00 H ATOM 1775 H THR A 493 8.236 38.634 -24.716 1.00 0.00 H ATOM 1776 N GLU A 494 8.714 34.957 -27.099 1.00 39.83 N ATOM 1777 CA GLU A 494 8.814 33.501 -27.030 1.00 43.93 C ATOM 1778 C GLU A 494 7.653 32.887 -26.249 1.00 38.84 C ATOM 1779 O GLU A 494 7.793 31.822 -25.643 1.00 38.88 O ATOM 1780 CB GLU A 494 10.151 33.086 -26.408 1.00 56.67 C ATOM 1781 CG GLU A 494 10.557 31.642 -26.655 1.00 67.39 C ATOM 1782 CD GLU A 494 10.980 31.392 -28.087 1.00 73.85 C ATOM 1783 OE1 GLU A 494 10.872 32.320 -28.915 1.00 75.04 O ATOM 1784 OE2 GLU A 494 11.425 30.267 -28.383 1.00 76.96 O ATOM 1785 H GLU A 494 8.612 35.411 -28.029 1.00 0.00 H ATOM 1786 N LYS A 495 6.491 33.545 -26.248 1.00 27.71 N ATOM 1787 CA LYS A 495 5.355 33.008 -25.501 1.00 30.72 C ATOM 1788 C LYS A 495 4.994 31.612 -25.991 1.00 26.75 C ATOM 1789 O LYS A 495 4.659 30.730 -25.191 1.00 28.39 O ATOM 1790 CB LYS A 495 4.147 33.940 -25.616 1.00 28.72 C ATOM 1791 CG LYS A 495 2.951 33.452 -24.805 1.00 30.65 C ATOM 1792 CD LYS A 495 1.798 34.438 -24.784 1.00 31.43 C ATOM 1793 CE LYS A 495 0.645 33.882 -23.953 1.00 30.87 C ATOM 1794 NZ LYS A 495 -0.541 34.776 -23.944 1.00 31.44 N ATOM 1795 HZ1 LYS A 495 -0.275 35.698 -23.543 1.00 0.00 H ATOM 1796 HZ2 LYS A 495 -0.883 34.905 -24.917 1.00 0.00 H ATOM 1797 HZ3 LYS A 495 -1.292 34.348 -23.365 1.00 0.00 H ATOM 1798 H LYS A 495 6.395 34.436 -26.776 1.00 0.00 H ATOM 1799 N PHE A 496 5.056 31.398 -27.305 1.00 30.50 N ATOM 1800 CA PHE A 496 4.803 30.079 -27.877 1.00 29.59 C ATOM 1801 C PHE A 496 5.644 29.007 -27.189 1.00 34.20 C ATOM 1802 O PHE A 496 5.115 28.007 -26.690 1.00 31.30 O ATOM 1803 CB PHE A 496 5.091 30.135 -29.379 1.00 31.83 C ATOM 1804 CG PHE A 496 4.997 28.812 -30.080 1.00 30.12 C ATOM 1805 CD1 PHE A 496 3.793 28.133 -30.156 1.00 33.92 C ATOM 1806 CD2 PHE A 496 6.109 28.268 -30.703 1.00 27.75 C ATOM 1807 CE1 PHE A 496 3.706 26.923 -30.820 1.00 33.66 C ATOM 1808 CE2 PHE A 496 6.030 27.060 -31.369 1.00 33.30 C ATOM 1809 CZ PHE A 496 4.826 26.388 -31.431 1.00 33.60 C ATOM 1810 H PHE A 496 5.290 32.189 -27.938 1.00 0.00 H ATOM 1811 N GLY A 497 6.960 29.210 -27.143 1.00 28.79 N ATOM 1812 CA GLY A 497 7.829 28.229 -26.512 1.00 32.18 C ATOM 1813 C GLY A 497 7.584 28.099 -25.021 1.00 29.35 C ATOM 1814 O GLY A 497 7.664 27.000 -24.464 1.00 31.24 O ATOM 1815 H GLY A 497 7.367 30.072 -27.559 1.00 0.00 H ATOM 1816 N GLN A 498 7.286 29.215 -24.351 1.00 32.14 N ATOM 1817 CA GLN A 498 7.026 29.166 -22.915 1.00 34.17 C ATOM 1818 C GLN A 498 5.759 28.384 -22.595 1.00 32.96 C ATOM 1819 O GLN A 498 5.667 27.771 -21.526 1.00 32.67 O ATOM 1820 CB GLN A 498 6.928 30.584 -22.350 1.00 36.53 C ATOM 1821 CG GLN A 498 8.266 31.310 -22.279 1.00 39.10 C ATOM 1822 CD GLN A 498 9.187 30.731 -21.222 1.00 45.35 C ATOM 1823 OE1 GLN A 498 8.731 30.171 -20.226 1.00 44.29 O ATOM 1824 NE2 GLN A 498 10.493 30.859 -21.437 1.00 47.41 N ATOM 1825 HE22 GLN A 498 10.834 31.340 -22.293 1.00 0.00 H ATOM 1826 HE21 GLN A 498 11.173 30.478 -20.749 1.00 0.00 H ATOM 1827 H GLN A 498 7.239 30.124 -24.855 1.00 0.00 H ATOM 1828 N LEU A 499 4.774 28.394 -23.493 1.00 33.73 N ATOM 1829 CA LEU A 499 3.576 27.591 -23.272 1.00 27.74 C ATOM 1830 C LEU A 499 3.874 26.108 -23.463 1.00 28.12 C ATOM 1831 O LEU A 499 3.483 25.275 -22.638 1.00 33.21 O ATOM 1832 CB LEU A 499 2.457 28.047 -24.212 1.00 29.00 C ATOM 1833 CG LEU A 499 1.854 29.434 -23.956 1.00 32.51 C ATOM 1834 CD1 LEU A 499 0.822 29.762 -25.022 1.00 34.64 C ATOM 1835 CD2 LEU A 499 1.227 29.525 -22.571 1.00 29.38 C ATOM 1836 H LEU A 499 4.859 28.975 -24.352 1.00 0.00 H ATOM 1837 N LEU A 500 4.572 25.758 -24.546 1.00 29.83 N ATOM 1838 CA LEU A 500 4.874 24.354 -24.806 1.00 30.47 C ATOM 1839 C LEU A 500 5.732 23.746 -23.702 1.00 35.83 C ATOM 1840 O LEU A 500 5.636 22.543 -23.434 1.00 37.71 O ATOM 1841 CB LEU A 500 5.575 24.211 -26.156 1.00 32.25 C ATOM 1842 CG LEU A 500 4.753 24.628 -27.378 1.00 29.41 C ATOM 1843 CD1 LEU A 500 5.562 24.432 -28.643 1.00 33.91 C ATOM 1844 CD2 LEU A 500 3.447 23.847 -27.456 1.00 31.23 C ATOM 1845 H LEU A 500 4.902 26.489 -25.208 1.00 0.00 H ATOM 1846 N LEU A 501 6.574 24.554 -23.056 1.00 36.38 N ATOM 1847 CA LEU A 501 7.405 24.044 -21.969 1.00 39.61 C ATOM 1848 C LEU A 501 6.573 23.440 -20.852 1.00 39.27 C ATOM 1849 O LEU A 501 7.050 22.554 -20.134 1.00 41.74 O ATOM 1850 CB LEU A 501 8.269 25.163 -21.400 1.00 45.19 C ATOM 1851 CG LEU A 501 9.570 25.453 -22.129 1.00 49.86 C ATOM 1852 CD1 LEU A 501 10.151 26.730 -21.575 1.00 52.23 C ATOM 1853 CD2 LEU A 501 10.542 24.283 -21.974 1.00 54.78 C ATOM 1854 H LEU A 501 6.639 25.555 -23.329 1.00 0.00 H ATOM 1855 N ARG A 502 5.339 23.909 -20.678 1.00 35.97 N ATOM 1856 CA ARG A 502 4.523 23.469 -19.556 1.00 35.01 C ATOM 1857 C ARG A 502 3.923 22.090 -19.794 1.00 36.08 C ATOM 1858 O ARG A 502 3.539 21.421 -18.831 1.00 33.90 O ATOM 1859 CB ARG A 502 3.404 24.481 -19.286 1.00 36.73 C ATOM 1860 CG ARG A 502 3.776 25.968 -19.456 1.00 41.86 C ATOM 1861 CD ARG A 502 4.297 26.594 -18.178 1.00 43.44 C ATOM 1862 NE ARG A 502 5.657 26.172 -17.845 1.00 41.77 N ATOM 1863 CZ ARG A 502 6.760 26.869 -18.107 1.00 47.33 C ATOM 1864 NH1 ARG A 502 6.695 28.041 -18.723 1.00 50.38 N ATOM 1865 NH2 ARG A 502 7.943 26.385 -17.752 1.00 51.55 N ATOM 1866 HE ARG A 502 5.771 25.256 -17.366 1.00 0.00 H ATOM 1867 HH12 ARG A 502 7.566 28.574 -18.921 1.00 0.00 H ATOM 1868 HH11 ARG A 502 5.773 28.428 -19.009 1.00 0.00 H ATOM 1869 HH22 ARG A 502 8.808 26.926 -17.954 1.00 0.00 H ATOM 1870 HH21 ARG A 502 8.005 25.465 -17.271 1.00 0.00 H ATOM 1871 H ARG A 502 4.953 24.599 -21.353 1.00 0.00 H ATOM 1872 N LEU A 503 3.856 21.638 -21.053 1.00 34.62 N ATOM 1873 CA LEU A 503 3.239 20.341 -21.322 1.00 34.10 C ATOM 1874 C LEU A 503 4.047 19.204 -20.714 1.00 32.16 C ATOM 1875 O LEU A 503 3.450 18.337 -20.051 1.00 33.90 O ATOM 1876 CB LEU A 503 3.033 20.157 -22.830 1.00 33.44 C ATOM 1877 CG LEU A 503 1.994 21.054 -23.505 1.00 32.15 C ATOM 1878 CD1 LEU A 503 1.860 20.667 -24.973 1.00 33.42 C ATOM 1879 CD2 LEU A 503 0.642 20.982 -22.814 1.00 31.53 C ATOM 1880 H LEU A 503 4.241 22.207 -21.834 1.00 0.00 H ATOM 1881 N PRO A 504 5.371 19.135 -20.879 1.00 33.56 N ATOM 1882 CA PRO A 504 6.130 18.111 -20.143 1.00 35.42 C ATOM 1883 C PRO A 504 5.979 18.221 -18.635 1.00 36.03 C ATOM 1884 O PRO A 504 5.967 17.191 -17.948 1.00 35.32 O ATOM 1885 CB PRO A 504 7.578 18.357 -20.590 1.00 37.13 C ATOM 1886 CG PRO A 504 7.465 19.041 -21.901 1.00 36.31 C ATOM 1887 CD PRO A 504 6.222 19.873 -21.831 1.00 32.14 C ATOM 1888 N GLU A 505 5.857 19.438 -18.097 1.00 37.94 N ATOM 1889 CA GLU A 505 5.681 19.604 -16.655 1.00 39.19 C ATOM 1890 C GLU A 505 4.332 19.057 -16.202 1.00 32.38 C ATOM 1891 O GLU A 505 4.245 18.338 -15.200 1.00 31.48 O ATOM 1892 CB GLU A 505 5.808 21.082 -16.279 1.00 42.15 C ATOM 1893 CG GLU A 505 7.153 21.705 -16.609 1.00 46.11 C ATOM 1894 CD GLU A 505 7.181 23.202 -16.354 1.00 48.77 C ATOM 1895 OE1 GLU A 505 6.106 23.786 -16.104 1.00 48.58 O ATOM 1896 OE2 GLU A 505 8.278 23.796 -16.405 1.00 51.90 O ATOM 1897 H GLU A 505 5.888 20.277 -18.711 1.00 0.00 H ATOM 1898 N ILE A 506 3.263 19.403 -16.923 1.00 30.63 N ATOM 1899 CA ILE A 506 1.940 18.885 -16.586 1.00 32.20 C ATOM 1900 C ILE A 506 1.929 17.366 -16.692 1.00 32.19 C ATOM 1901 O ILE A 506 1.330 16.674 -15.861 1.00 34.09 O ATOM 1902 CB ILE A 506 0.868 19.527 -17.487 1.00 32.11 C ATOM 1903 CG1 ILE A 506 0.786 21.037 -17.227 1.00 34.63 C ATOM 1904 CG2 ILE A 506 -0.499 18.881 -17.250 1.00 31.91 C ATOM 1905 CD1 ILE A 506 -0.109 21.794 -18.200 1.00 34.15 C ATOM 1906 H ILE A 506 3.374 20.047 -17.732 1.00 0.00 H ATOM 1907 N ARG A 507 2.596 16.821 -17.712 1.00 34.16 N ATOM 1908 CA ARG A 507 2.581 15.374 -17.899 1.00 33.36 C ATOM 1909 C ARG A 507 3.279 14.660 -16.749 1.00 37.49 C ATOM 1910 O ARG A 507 2.822 13.601 -16.303 1.00 29.71 O ATOM 1911 CB ARG A 507 3.229 15.009 -19.233 1.00 36.64 C ATOM 1912 CG ARG A 507 3.099 13.539 -19.585 1.00 46.85 C ATOM 1913 CD ARG A 507 3.488 13.276 -21.025 1.00 59.03 C ATOM 1914 NE ARG A 507 3.367 11.862 -21.373 1.00 74.37 N ATOM 1915 CZ ARG A 507 2.242 11.268 -21.765 1.00 84.58 C ATOM 1916 NH1 ARG A 507 1.112 11.955 -21.865 1.00 87.19 N ATOM 1917 NH2 ARG A 507 2.248 9.974 -22.057 1.00 89.76 N ATOM 1918 HE ARG A 507 4.224 11.276 -21.310 1.00 0.00 H ATOM 1919 HH12 ARG A 507 0.240 11.479 -22.172 1.00 0.00 H ATOM 1920 HH11 ARG A 507 1.098 12.969 -21.636 1.00 0.00 H ATOM 1921 HH22 ARG A 507 1.371 9.506 -22.364 1.00 0.00 H ATOM 1922 HH21 ARG A 507 3.129 9.427 -21.979 1.00 0.00 H ATOM 1923 H ARG A 507 3.125 17.426 -18.372 1.00 0.00 H ATOM 1924 N ALA A 508 4.392 15.214 -16.265 1.00 27.85 N ATOM 1925 CA ALA A 508 5.068 14.622 -15.115 1.00 34.22 C ATOM 1926 C ALA A 508 4.157 14.628 -13.894 1.00 35.42 C ATOM 1927 O ALA A 508 4.072 13.632 -13.164 1.00 34.58 O ATOM 1928 CB ALA A 508 6.369 15.373 -14.828 1.00 34.33 C ATOM 1929 H ALA A 508 4.779 16.071 -16.709 1.00 0.00 H ATOM 1930 N ILE A 509 3.450 15.737 -13.668 1.00 32.84 N ATOM 1931 CA ILE A 509 2.500 15.803 -12.562 1.00 29.72 C ATOM 1932 C ILE A 509 1.414 14.749 -12.728 1.00 30.63 C ATOM 1933 O ILE A 509 1.036 14.073 -11.765 1.00 31.21 O ATOM 1934 CB ILE A 509 1.905 17.219 -12.454 1.00 32.24 C ATOM 1935 CG1 ILE A 509 3.012 18.225 -12.129 1.00 34.42 C ATOM 1936 CG2 ILE A 509 0.808 17.266 -11.377 1.00 34.24 C ATOM 1937 CD1 ILE A 509 2.574 19.676 -12.201 1.00 35.20 C ATOM 1938 H ILE A 509 3.577 16.563 -14.287 1.00 0.00 H ATOM 1939 N SER A 510 0.888 14.593 -13.949 1.00 28.71 N ATOM 1940 CA SER A 510 -0.189 13.630 -14.163 1.00 29.06 C ATOM 1941 C SER A 510 0.297 12.192 -14.007 1.00 31.72 C ATOM 1942 O SER A 510 -0.463 11.332 -13.546 1.00 30.80 O ATOM 1943 CB SER A 510 -0.823 13.836 -15.543 1.00 31.28 C ATOM 1944 OG SER A 510 0.073 13.491 -16.583 1.00 35.54 O ATOM 1945 HG SER A 510 0.882 14.058 -16.522 1.00 0.00 H ATOM 1946 H SER A 510 1.246 15.158 -14.745 1.00 0.00 H ATOM 1947 N MET A 511 1.547 11.902 -14.377 1.00 30.66 N ATOM 1948 CA MET A 511 2.083 10.564 -14.144 1.00 35.54 C ATOM 1949 C MET A 511 2.183 10.266 -12.653 1.00 36.06 C ATOM 1950 O MET A 511 1.852 9.161 -12.208 1.00 39.62 O ATOM 1951 CB MET A 511 3.455 10.416 -14.800 1.00 41.52 C ATOM 1952 CG MET A 511 3.430 10.354 -16.318 1.00 52.48 C ATOM 1953 SD MET A 511 4.997 9.764 -17.001 1.00 64.80 S ATOM 1954 CE MET A 511 6.177 10.825 -16.169 1.00 68.10 C ATOM 1955 H MET A 511 2.138 12.628 -14.830 1.00 0.00 H ATOM 1956 N GLN A 512 2.658 11.234 -11.866 1.00 34.79 N ATOM 1957 CA GLN A 512 2.708 11.050 -10.420 1.00 37.29 C ATOM 1958 C GLN A 512 1.308 10.907 -9.838 1.00 33.47 C ATOM 1959 O GLN A 512 1.087 10.117 -8.913 1.00 32.98 O ATOM 1960 CB GLN A 512 3.439 12.222 -9.767 1.00 37.53 C ATOM 1961 CG GLN A 512 4.930 12.276 -10.071 1.00 40.72 C ATOM 1962 CD GLN A 512 5.614 13.475 -9.438 1.00 47.71 C ATOM 1963 OE1 GLN A 512 5.328 14.623 -9.781 1.00 51.36 O ATOM 1964 NE2 GLN A 512 6.520 13.214 -8.508 1.00 51.03 N ATOM 1965 HE22 GLN A 512 6.731 12.229 -8.249 1.00 0.00 H ATOM 1966 HE21 GLN A 512 7.021 13.994 -8.037 1.00 0.00 H ATOM 1967 H GLN A 512 2.994 12.124 -12.286 1.00 0.00 H ATOM 1968 N ALA A 513 0.349 11.668 -10.365 1.00 32.70 N ATOM 1969 CA ALA A 513 -1.024 11.561 -9.884 1.00 35.69 C ATOM 1970 C ALA A 513 -1.603 10.182 -10.175 1.00 33.40 C ATOM 1971 O ALA A 513 -2.267 9.588 -9.318 1.00 31.17 O ATOM 1972 CB ALA A 513 -1.882 12.653 -10.517 1.00 31.60 C ATOM 1973 H ALA A 513 0.581 12.341 -11.123 1.00 0.00 H ATOM 1974 N GLU A 514 -1.358 9.653 -11.378 1.00 31.23 N ATOM 1975 CA GLU A 514 -1.855 8.323 -11.719 1.00 32.81 C ATOM 1976 C GLU A 514 -1.259 7.256 -10.812 1.00 34.19 C ATOM 1977 O GLU A 514 -1.967 6.347 -10.366 1.00 35.28 O ATOM 1978 CB GLU A 514 -1.534 7.987 -13.174 1.00 36.58 C ATOM 1979 CG GLU A 514 -2.429 8.639 -14.195 1.00 37.18 C ATOM 1980 CD GLU A 514 -2.314 7.973 -15.553 1.00 38.17 C ATOM 1981 OE1 GLU A 514 -2.316 6.723 -15.608 1.00 38.76 O ATOM 1982 OE2 GLU A 514 -2.209 8.699 -16.562 1.00 36.92 O ATOM 1983 H GLU A 514 -0.809 10.193 -12.077 1.00 0.00 H ATOM 1984 N GLU A 515 0.051 7.328 -10.563 1.00 32.89 N ATOM 1985 CA GLU A 515 0.697 6.345 -9.702 1.00 39.58 C ATOM 1986 C GLU A 515 0.109 6.381 -8.299 1.00 37.35 C ATOM 1987 O GLU A 515 -0.053 5.338 -7.656 1.00 37.90 O ATOM 1988 CB GLU A 515 2.205 6.601 -9.659 1.00 44.26 C ATOM 1989 CG GLU A 515 2.933 6.217 -10.932 1.00 52.87 C ATOM 1990 CD GLU A 515 3.406 4.778 -10.923 1.00 66.01 C ATOM 1991 OE1 GLU A 515 4.317 4.456 -10.130 1.00 73.72 O ATOM 1992 OE2 GLU A 515 2.864 3.968 -11.704 1.00 68.38 O ATOM 1993 H GLU A 515 0.615 8.092 -10.987 1.00 0.00 H ATOM 1994 N TYR A 516 -0.217 7.576 -7.808 1.00 40.08 N ATOM 1995 CA TYR A 516 -0.809 7.693 -6.481 1.00 36.93 C ATOM 1996 C TYR A 516 -2.214 7.102 -6.458 1.00 36.57 C ATOM 1997 O TYR A 516 -2.561 6.341 -5.548 1.00 35.17 O ATOM 1998 CB TYR A 516 -0.835 9.157 -6.047 1.00 36.02 C ATOM 1999 CG TYR A 516 -1.399 9.359 -4.662 1.00 38.23 C ATOM 2000 CD1 TYR A 516 -0.644 9.060 -3.538 1.00 40.87 C ATOM 2001 CD2 TYR A 516 -2.685 9.846 -4.476 1.00 36.07 C ATOM 2002 CE1 TYR A 516 -1.148 9.238 -2.268 1.00 45.21 C ATOM 2003 CE2 TYR A 516 -3.201 10.029 -3.202 1.00 39.85 C ATOM 2004 CZ TYR A 516 -2.424 9.726 -2.104 1.00 43.38 C ATOM 2005 OH TYR A 516 -2.924 9.901 -0.831 1.00 48.40 O ATOM 2006 HH TYR A 516 -3.162 10.853 -0.699 1.00 0.00 H ATOM 2007 H TYR A 516 -0.048 8.431 -8.375 1.00 0.00 H ATOM 2008 N LEU A 517 -3.035 7.439 -7.455 1.00 37.23 N ATOM 2009 CA LEU A 517 -4.391 6.901 -7.507 1.00 36.32 C ATOM 2010 C LEU A 517 -4.378 5.395 -7.735 1.00 34.58 C ATOM 2011 O LEU A 517 -5.215 4.671 -7.185 1.00 35.05 O ATOM 2012 CB LEU A 517 -5.191 7.600 -8.605 1.00 31.84 C ATOM 2013 CG LEU A 517 -5.426 9.102 -8.438 1.00 30.86 C ATOM 2014 CD1 LEU A 517 -6.147 9.664 -9.660 1.00 33.60 C ATOM 2015 CD2 LEU A 517 -6.219 9.394 -7.168 1.00 32.17 C ATOM 2016 H LEU A 517 -2.707 8.088 -8.198 1.00 0.00 H ATOM 2017 N TYR A 518 -3.443 4.907 -8.554 1.00 36.12 N ATOM 2018 CA TYR A 518 -3.310 3.467 -8.744 1.00 37.52 C ATOM 2019 C TYR A 518 -2.940 2.783 -7.434 1.00 37.79 C ATOM 2020 O TYR A 518 -3.473 1.716 -7.105 1.00 38.80 O ATOM 2021 CB TYR A 518 -2.264 3.180 -9.821 1.00 41.20 C ATOM 2022 CG TYR A 518 -2.368 1.803 -10.441 1.00 47.40 C ATOM 2023 CD1 TYR A 518 -3.222 1.567 -11.507 1.00 53.08 C ATOM 2024 CD2 TYR A 518 -1.606 0.745 -9.969 1.00 52.94 C ATOM 2025 CE1 TYR A 518 -3.320 0.313 -12.082 1.00 56.90 C ATOM 2026 CE2 TYR A 518 -1.697 -0.512 -10.539 1.00 56.75 C ATOM 2027 CZ TYR A 518 -2.556 -0.721 -11.594 1.00 58.95 C ATOM 2028 OH TYR A 518 -2.650 -1.970 -12.164 1.00 63.86 O ATOM 2029 HH TYR A 518 -3.308 -1.945 -12.903 1.00 0.00 H ATOM 2030 H TYR A 518 -2.807 5.557 -9.059 1.00 0.00 H ATOM 2031 N TYR A 519 -2.034 3.390 -6.666 1.00 38.88 N ATOM 2032 CA TYR A 519 -1.699 2.854 -5.351 1.00 37.67 C ATOM 2033 C TYR A 519 -2.933 2.792 -4.462 1.00 36.40 C ATOM 2034 O TYR A 519 -3.216 1.760 -3.841 1.00 36.14 O ATOM 2035 CB TYR A 519 -0.610 3.710 -4.701 1.00 36.15 C ATOM 2036 CG TYR A 519 -0.216 3.250 -3.315 1.00 39.23 C ATOM 2037 CD1 TYR A 519 0.618 2.154 -3.137 1.00 40.60 C ATOM 2038 CD2 TYR A 519 -0.673 3.915 -2.186 1.00 43.67 C ATOM 2039 CE1 TYR A 519 0.980 1.729 -1.875 1.00 47.95 C ATOM 2040 CE2 TYR A 519 -0.313 3.497 -0.914 1.00 45.66 C ATOM 2041 CZ TYR A 519 0.513 2.402 -0.767 1.00 50.16 C ATOM 2042 OH TYR A 519 0.877 1.979 0.492 1.00 57.40 O ATOM 2043 HH TYR A 519 1.467 1.188 0.415 1.00 0.00 H ATOM 2044 H TYR A 519 -1.563 4.252 -7.007 1.00 0.00 H ATOM 2045 N LYS A 520 -3.692 3.889 -4.399 1.00 38.35 N ATOM 2046 CA LYS A 520 -4.871 3.925 -3.539 1.00 39.82 C ATOM 2047 C LYS A 520 -5.894 2.882 -3.969 1.00 36.59 C ATOM 2048 O LYS A 520 -6.571 2.281 -3.127 1.00 39.47 O ATOM 2049 CB LYS A 520 -5.496 5.321 -3.558 1.00 39.99 C ATOM 2050 CG LYS A 520 -4.529 6.457 -3.264 1.00 42.77 C ATOM 2051 CD LYS A 520 -4.650 6.961 -1.837 1.00 49.18 C ATOM 2052 CE LYS A 520 -4.129 5.952 -0.831 1.00 57.35 C ATOM 2053 NZ LYS A 520 -3.693 6.617 0.431 1.00 64.97 N ATOM 2054 HZ1 LYS A 520 -2.934 7.295 0.219 1.00 0.00 H ATOM 2055 HZ2 LYS A 520 -4.500 7.119 0.854 1.00 0.00 H ATOM 2056 HZ3 LYS A 520 -3.343 5.899 1.097 1.00 0.00 H ATOM 2057 H LYS A 520 -3.441 4.724 -4.967 1.00 0.00 H ATOM 2058 N HIS A 521 -6.024 2.657 -5.277 1.00 36.73 N ATOM 2059 CA HIS A 521 -6.952 1.644 -5.769 1.00 36.06 C ATOM 2060 C HIS A 521 -6.523 0.251 -5.331 1.00 38.00 C ATOM 2061 O HIS A 521 -7.319 -0.503 -4.758 1.00 39.20 O ATOM 2062 CB HIS A 521 -7.052 1.717 -7.290 1.00 39.30 C ATOM 2063 CG HIS A 521 -7.872 0.620 -7.890 1.00 41.73 C ATOM 2064 ND1 HIS A 521 -9.195 0.416 -7.561 1.00 44.92 N ATOM 2065 CD2 HIS A 521 -7.556 -0.339 -8.791 1.00 45.93 C ATOM 2066 CE1 HIS A 521 -9.660 -0.619 -8.238 1.00 47.61 C ATOM 2067 NE2 HIS A 521 -8.685 -1.095 -8.992 1.00 50.11 N ATOM 2068 H HIS A 521 -5.458 3.209 -5.953 1.00 0.00 H ATOM 2069 N LEU A 522 -5.266 -0.116 -5.603 1.00 37.10 N ATOM 2070 CA LEU A 522 -4.747 -1.386 -5.110 1.00 40.22 C ATOM 2071 C LEU A 522 -4.902 -1.490 -3.601 1.00 38.71 C ATOM 2072 O LEU A 522 -5.127 -2.585 -3.071 1.00 42.46 O ATOM 2073 CB LEU A 522 -3.276 -1.545 -5.500 1.00 42.59 C ATOM 2074 CG LEU A 522 -2.975 -1.628 -6.998 1.00 45.87 C ATOM 2075 CD1 LEU A 522 -1.479 -1.734 -7.235 1.00 48.76 C ATOM 2076 CD2 LEU A 522 -3.687 -2.809 -7.626 1.00 47.13 C ATOM 2077 H LEU A 522 -4.656 0.508 -6.169 1.00 0.00 H ATOM 2078 N ASN A 523 -4.788 -0.365 -2.898 1.00 46.67 N ATOM 2079 CA ASN A 523 -4.947 -0.337 -1.451 1.00 49.16 C ATOM 2080 C ASN A 523 -6.404 -0.424 -1.017 1.00 50.42 C ATOM 2081 O ASN A 523 -6.668 -0.581 0.179 1.00 53.21 O ATOM 2082 CB ASN A 523 -4.318 0.944 -0.892 1.00 54.63 C ATOM 2083 CG ASN A 523 -3.713 0.750 0.479 1.00 59.80 C ATOM 2084 OD1 ASN A 523 -3.241 -0.337 0.816 1.00 60.42 O ATOM 2085 ND2 ASN A 523 -3.718 1.809 1.281 1.00 64.23 N ATOM 2086 HD22 ASN A 523 -4.128 2.707 0.954 1.00 0.00 H ATOM 2087 HD21 ASN A 523 -3.312 1.740 2.236 1.00 0.00 H ATOM 2088 H ASN A 523 -4.579 0.522 -3.399 1.00 0.00 H ATOM 2089 N GLY A 524 -7.348 -0.327 -1.951 1.00 47.33 N ATOM 2090 CA GLY A 524 -8.755 -0.400 -1.615 1.00 49.98 C ATOM 2091 C GLY A 524 -9.378 0.910 -1.192 1.00 53.46 C ATOM 2092 O GLY A 524 -10.415 0.898 -0.521 1.00 56.67 O ATOM 2093 H GLY A 524 -7.069 -0.196 -2.944 1.00 0.00 H ATOM 2094 N ASP A 525 -8.784 2.044 -1.567 1.00 51.09 N ATOM 2095 CA ASP A 525 -9.259 3.351 -1.134 1.00 50.31 C ATOM 2096 C ASP A 525 -10.016 4.113 -2.213 1.00 47.54 C ATOM 2097 O ASP A 525 -10.562 5.181 -1.925 1.00 48.30 O ATOM 2098 CB ASP A 525 -8.082 4.208 -0.658 1.00 50.70 C ATOM 2099 CG ASP A 525 -7.382 3.620 0.549 1.00 54.44 C ATOM 2100 OD1 ASP A 525 -8.057 2.970 1.376 1.00 59.43 O ATOM 2101 OD2 ASP A 525 -6.155 3.808 0.667 1.00 53.81 O ATOM 2102 H ASP A 525 -7.953 1.993 -2.190 1.00 0.00 H ATOM 2103 N VAL A 526 -10.065 3.603 -3.443 1.00 44.46 N ATOM 2104 CA VAL A 526 -10.761 4.263 -4.537 1.00 44.83 C ATOM 2105 C VAL A 526 -12.130 3.594 -4.685 1.00 50.52 C ATOM 2106 O VAL A 526 -12.189 2.427 -5.105 1.00 55.09 O ATOM 2107 CB VAL A 526 -9.962 4.188 -5.843 1.00 40.52 C ATOM 2108 CG1 VAL A 526 -10.690 4.916 -6.963 1.00 40.74 C ATOM 2109 CG2 VAL A 526 -8.575 4.789 -5.642 1.00 41.56 C ATOM 2110 H VAL A 526 -9.587 2.698 -3.628 1.00 0.00 H ATOM 2111 N PRO A 527 -13.226 4.266 -4.341 1.00 49.42 N ATOM 2112 CA PRO A 527 -14.546 3.646 -4.497 1.00 52.14 C ATOM 2113 C PRO A 527 -14.883 3.407 -5.959 1.00 51.41 C ATOM 2114 O PRO A 527 -14.170 3.810 -6.880 1.00 48.58 O ATOM 2115 CB PRO A 527 -15.504 4.661 -3.859 1.00 51.91 C ATOM 2116 CG PRO A 527 -14.642 5.487 -2.964 1.00 53.07 C ATOM 2117 CD PRO A 527 -13.321 5.570 -3.664 1.00 50.08 C ATOM 2118 N TYR A 528 -16.014 2.732 -6.150 1.00 58.99 N ATOM 2119 CA TYR A 528 -16.464 2.306 -7.468 1.00 63.94 C ATOM 2120 C TYR A 528 -16.556 3.470 -8.449 1.00 58.92 C ATOM 2121 O TYR A 528 -17.412 4.349 -8.309 1.00 60.82 O ATOM 2122 CB TYR A 528 -17.814 1.594 -7.329 1.00 77.27 C ATOM 2123 CG TYR A 528 -18.633 1.489 -8.597 1.00 85.97 C ATOM 2124 CD1 TYR A 528 -18.467 0.421 -9.470 1.00 89.11 C ATOM 2125 CD2 TYR A 528 -19.593 2.443 -8.906 1.00 90.00 C ATOM 2126 CE1 TYR A 528 -19.223 0.317 -10.625 1.00 91.67 C ATOM 2127 CE2 TYR A 528 -20.352 2.349 -10.057 1.00 92.50 C ATOM 2128 CZ TYR A 528 -20.164 1.285 -10.912 1.00 93.74 C ATOM 2129 OH TYR A 528 -20.921 1.190 -12.058 1.00 95.15 O ATOM 2130 HH TYR A 528 -20.663 0.374 -12.556 1.00 0.00 H ATOM 2131 H TYR A 528 -16.601 2.499 -5.324 1.00 0.00 H ATOM 2132 N ASN A 529 -15.663 3.482 -9.443 1.00 54.19 N ATOM 2133 CA ASN A 529 -15.663 4.486 -10.513 1.00 49.75 C ATOM 2134 C ASN A 529 -15.092 3.795 -11.752 1.00 42.73 C ATOM 2135 O ASN A 529 -13.889 3.858 -12.011 1.00 43.24 O ATOM 2136 CB ASN A 529 -14.851 5.719 -10.142 1.00 48.12 C ATOM 2137 CG ASN A 529 -15.517 6.563 -9.074 1.00 52.28 C ATOM 2138 OD1 ASN A 529 -16.454 7.312 -9.353 1.00 55.22 O ATOM 2139 ND2 ASN A 529 -15.025 6.461 -7.845 1.00 52.48 N ATOM 2140 HD22 ASN A 529 -14.232 5.815 -7.654 1.00 0.00 H ATOM 2141 HD21 ASN A 529 -15.432 7.027 -7.073 1.00 0.00 H ATOM 2142 H ASN A 529 -14.932 2.743 -9.459 1.00 0.00 H ATOM 2143 N ASN A 530 -15.975 3.151 -12.518 1.00 43.31 N ATOM 2144 CA ASN A 530 -15.520 2.225 -13.551 1.00 46.76 C ATOM 2145 C ASN A 530 -14.646 2.917 -14.590 1.00 41.61 C ATOM 2146 O ASN A 530 -13.644 2.348 -15.038 1.00 41.34 O ATOM 2147 CB ASN A 530 -16.718 1.550 -14.218 1.00 53.12 C ATOM 2148 CG ASN A 530 -17.318 0.455 -13.357 1.00 61.19 C ATOM 2149 OD1 ASN A 530 -16.687 -0.023 -12.415 1.00 64.90 O ATOM 2150 ND2 ASN A 530 -18.538 0.046 -13.682 1.00 66.66 N ATOM 2151 HD22 ASN A 530 -19.034 0.479 -14.487 1.00 0.00 H ATOM 2152 HD21 ASN A 530 -18.998 -0.707 -13.132 1.00 0.00 H ATOM 2153 H ASN A 530 -16.993 3.310 -12.378 1.00 0.00 H ATOM 2154 N LEU A 531 -14.999 4.140 -14.991 1.00 38.80 N ATOM 2155 CA LEU A 531 -14.221 4.804 -16.034 1.00 34.53 C ATOM 2156 C LEU A 531 -12.847 5.210 -15.514 1.00 35.81 C ATOM 2157 O LEU A 531 -11.830 4.975 -16.176 1.00 35.48 O ATOM 2158 CB LEU A 531 -14.973 6.018 -16.579 1.00 34.34 C ATOM 2159 CG LEU A 531 -14.270 6.768 -17.721 1.00 33.32 C ATOM 2160 CD1 LEU A 531 -13.859 5.823 -18.844 1.00 34.36 C ATOM 2161 CD2 LEU A 531 -15.162 7.874 -18.276 1.00 35.43 C ATOM 2162 H LEU A 531 -15.820 4.616 -14.565 1.00 0.00 H ATOM 2163 N LEU A 532 -12.795 5.813 -14.325 1.00 37.97 N ATOM 2164 CA LEU A 532 -11.513 6.189 -13.741 1.00 33.73 C ATOM 2165 C LEU A 532 -10.606 4.974 -13.588 1.00 36.98 C ATOM 2166 O LEU A 532 -9.425 5.012 -13.956 1.00 34.57 O ATOM 2167 CB LEU A 532 -11.737 6.868 -12.389 1.00 35.27 C ATOM 2168 CG LEU A 532 -10.491 7.308 -11.620 1.00 34.61 C ATOM 2169 CD1 LEU A 532 -9.732 8.378 -12.386 1.00 35.86 C ATOM 2170 CD2 LEU A 532 -10.865 7.809 -10.229 1.00 36.50 C ATOM 2171 H LEU A 532 -13.676 6.016 -13.811 1.00 0.00 H ATOM 2172 N ILE A 533 -11.145 3.878 -13.051 1.00 37.61 N ATOM 2173 CA ILE A 533 -10.332 2.689 -12.823 1.00 38.14 C ATOM 2174 C ILE A 533 -9.896 2.080 -14.148 1.00 39.77 C ATOM 2175 O ILE A 533 -8.750 1.641 -14.298 1.00 39.75 O ATOM 2176 CB ILE A 533 -11.103 1.673 -11.959 1.00 41.16 C ATOM 2177 CG1 ILE A 533 -11.488 2.295 -10.613 1.00 44.25 C ATOM 2178 CG2 ILE A 533 -10.280 0.401 -11.750 1.00 42.71 C ATOM 2179 CD1 ILE A 533 -10.319 2.727 -9.762 1.00 46.98 C ATOM 2180 H ILE A 533 -12.152 3.872 -12.793 1.00 0.00 H ATOM 2181 N GLU A 534 -10.801 2.035 -15.128 1.00 39.68 N ATOM 2182 CA GLU A 534 -10.444 1.480 -16.429 1.00 39.61 C ATOM 2183 C GLU A 534 -9.295 2.258 -17.059 1.00 36.49 C ATOM 2184 O GLU A 534 -8.371 1.664 -17.629 1.00 37.89 O ATOM 2185 CB GLU A 534 -11.663 1.479 -17.352 1.00 39.86 C ATOM 2186 CG GLU A 534 -11.367 1.006 -18.767 1.00 39.44 C ATOM 2187 CD GLU A 534 -12.613 0.905 -19.620 1.00 44.19 C ATOM 2188 OE1 GLU A 534 -13.627 0.353 -19.138 1.00 49.09 O ATOM 2189 OE2 GLU A 534 -12.578 1.385 -20.772 1.00 42.32 O ATOM 2190 H GLU A 534 -11.762 2.396 -14.964 1.00 0.00 H ATOM 2191 N MET A 535 -9.329 3.588 -16.964 1.00 37.20 N ATOM 2192 CA MET A 535 -8.245 4.386 -17.526 1.00 36.87 C ATOM 2193 C MET A 535 -6.941 4.170 -16.768 1.00 36.69 C ATOM 2194 O MET A 535 -5.861 4.252 -17.364 1.00 39.05 O ATOM 2195 CB MET A 535 -8.623 5.867 -17.521 1.00 35.42 C ATOM 2196 CG MET A 535 -9.881 6.193 -18.320 1.00 38.54 C ATOM 2197 SD MET A 535 -9.784 5.750 -20.068 1.00 43.75 S ATOM 2198 CE MET A 535 -8.764 7.069 -20.705 1.00 40.76 C ATOM 2199 H MET A 535 -10.128 4.056 -16.490 1.00 0.00 H ATOM 2200 N LEU A 536 -7.014 3.893 -15.464 1.00 39.58 N ATOM 2201 CA LEU A 536 -5.806 3.585 -14.707 1.00 42.42 C ATOM 2202 C LEU A 536 -5.179 2.272 -15.159 1.00 46.35 C ATOM 2203 O LEU A 536 -3.950 2.137 -15.141 1.00 50.06 O ATOM 2204 CB LEU A 536 -6.119 3.526 -13.210 1.00 44.94 C ATOM 2205 CG LEU A 536 -6.290 4.859 -12.479 1.00 45.95 C ATOM 2206 CD1 LEU A 536 -6.834 4.627 -11.078 1.00 48.05 C ATOM 2207 CD2 LEU A 536 -4.974 5.621 -12.414 1.00 46.34 C ATOM 2208 H LEU A 536 -7.937 3.897 -14.985 1.00 0.00 H ATOM 2209 N HIS A 537 -5.997 1.298 -15.558 1.00 46.42 N ATOM 2210 CA HIS A 537 -5.497 0.010 -16.026 1.00 53.57 C ATOM 2211 C HIS A 537 -5.071 0.028 -17.488 1.00 56.42 C ATOM 2212 O HIS A 537 -4.546 -0.981 -17.972 1.00 59.16 O ATOM 2213 CB HIS A 537 -6.561 -1.073 -15.828 1.00 61.23 C ATOM 2214 CG HIS A 537 -6.573 -1.667 -14.455 1.00 72.45 C ATOM 2215 ND1 HIS A 537 -7.121 -1.022 -13.368 1.00 77.94 N ATOM 2216 CD2 HIS A 537 -6.100 -2.848 -13.993 1.00 78.00 C ATOM 2217 CE1 HIS A 537 -6.987 -1.781 -12.295 1.00 81.67 C ATOM 2218 NE2 HIS A 537 -6.370 -2.895 -12.647 1.00 82.25 N ATOM 2219 H HIS A 537 -7.024 1.461 -15.535 1.00 0.00 H ATOM 2220 N ALA A 538 -5.281 1.132 -18.200 1.00 56.09 N ATOM 2221 CA ALA A 538 -4.921 1.211 -19.612 1.00 57.32 C ATOM 2222 C ALA A 538 -3.405 1.211 -19.792 1.00 54.68 C ATOM 2223 O ALA A 538 -2.680 1.876 -19.051 1.00 53.50 O ATOM 2224 CB ALA A 538 -5.530 2.455 -20.241 1.00 60.36 C ATOM 2225 H ALA A 538 -5.712 1.959 -17.739 1.00 0.00 H TER 2226 ALA A 538 HETATM 2227 O HOH 1 -25.651 8.345 -14.309 1.00 43.47 O HETATM 2228 O HOH 2 -6.369 35.316 -8.730 1.00 57.76 O HETATM 2229 O HOH 3 -3.605 23.187 -7.841 1.00 31.71 O HETATM 2230 O HOH 4 2.281 16.622 -23.257 1.00 41.54 O HETATM 2231 O HOH 5 -24.769 11.408 -16.596 1.00 46.97 O HETATM 2232 O HOH 6 -9.914 12.735 -43.129 1.00 36.93 O HETATM 2233 O HOH 7 -19.143 10.513 -24.863 1.00 38.33 O HETATM 2234 O HOH 8 6.383 19.012 -13.415 1.00 43.25 O HETATM 2235 O HOH 9 -6.369 28.696 5.871 1.00 34.80 O HETATM 2236 O HOH 10 9.259 21.470 -19.683 1.00 44.83 O HETATM 2237 O HOH 11 3.638 23.560 -37.696 1.00 43.86 O HETATM 2238 O HOH 12 -1.979 12.662 -0.205 1.00 35.89 O HETATM 2239 O HOH 13 -4.251 34.493 -17.983 1.00 40.42 O HETATM 2240 O HOH 14 1.282 34.822 -11.443 1.00 45.33 O HETATM 2241 O HOH 15 -12.003 22.552 -27.480 1.00 43.63 O HETATM 2242 O HOH 16 -5.662 28.521 2.169 1.00 44.70 O HETATM 2243 O HOH 17 -0.321 13.804 -24.571 1.00 39.27 O HETATM 2244 O HOH 18 -6.695 28.525 -7.429 1.00 32.18 O HETATM 2245 O HOH 19 -12.104 17.780 -12.410 1.00 28.82 O HETATM 2246 O HOH 20 -10.781 24.514 -17.305 1.00 45.46 O HETATM 2247 O HOH 21 -2.393 25.889 -38.873 1.00 32.84 O HETATM 2248 O HOH 22 7.247 14.973 -18.628 1.00 41.98 O HETATM 2249 O HOH 23 -10.338 22.086 -10.518 1.00 34.62 O HETATM 2250 O HOH 24 -12.141 30.456 -20.549 1.00 44.63 O HETATM 2251 O HOH 25 -8.319 5.930 -37.503 1.00 57.72 O HETATM 2252 O HOH 26 -10.202 18.869 -14.356 1.00 27.65 O HETATM 2253 O HOH 27 -7.117 31.585 -40.264 1.00 42.16 O HETATM 2254 O HOH 28 -1.940 11.406 -19.286 1.00 37.74 O HETATM 2255 O HOH 29 4.552 36.063 -28.662 1.00 34.77 O HETATM 2256 O HOH 30 -12.331 19.967 -10.480 1.00 33.30 O HETATM 2257 O HOH 31 4.993 33.460 -29.340 1.00 36.97 O HETATM 2258 O HOH 32 3.965 20.778 -29.838 1.00 42.93 O HETATM 2259 O HOH 33 -3.354 5.473 -17.881 1.00 44.22 O HETATM 2260 O HOH 34 -2.093 42.024 -26.461 1.00 37.79 O HETATM 2261 O HOH 35 -17.671 5.341 -14.182 1.00 55.39 O HETATM 2262 O HOH 36 -2.731 11.294 -26.424 1.00 29.78 O HETATM 2263 O HOH 37 1.748 16.504 -26.897 1.00 48.99 O HETATM 2264 O HOH 38 3.830 14.932 -29.392 1.00 51.91 O HETATM 2265 O HOH 39 -30.055 23.302 -17.608 1.00 43.12 O HETATM 2266 O HOH 40 -28.706 15.630 -7.520 1.00 42.39 O HETATM 2267 O HOH 41 -1.655 4.126 -14.514 1.00 42.28 O HETATM 2268 O HOH 42 6.853 16.493 -11.391 1.00 47.69 O HETATM 2269 O HOH 43 -5.533 11.123 -0.452 1.00 39.63 O HETATM 2270 O HOH 44 -9.942 0.730 -4.205 1.00 43.15 O HETATM 2271 O HOH 45 2.845 18.163 -43.975 1.00 39.86 O HETATM 2272 O HOH 46 6.717 12.252 -13.288 1.00 48.24 O HETATM 2273 O HOH 47 6.947 34.798 -22.420 1.00 46.00 O HETATM 2274 O HOH 48 1.690 41.575 -23.789 1.00 43.57 O HETATM 2275 O HOH 49 -9.272 34.151 -22.467 1.00 40.45 O HETATM 2276 O HOH 50 -14.521 3.013 -35.659 1.00 48.83 O HETATM 2277 O HOH 51 -4.952 36.816 -21.199 1.00 52.93 O HETATM 2278 O HOH 52 -4.615 30.254 -8.068 1.00 44.75 O HETATM 2279 O HOH 53 -18.887 4.319 -12.015 1.00 50.27 O HETATM 2280 O HOH 54 -12.448 27.119 -16.980 1.00 52.98 O HETATM 2281 O HOH 55 -10.841 -1.842 -15.279 1.00 57.79 O HETATM 2282 O HOH 56 -15.888 22.399 -17.884 1.00 49.74 O HETATM 2283 O HOH 57 -16.281 8.110 -31.466 1.00 46.94 O HETATM 2284 O HOH 58 -20.847 8.607 -25.921 1.00 40.47 O HETATM 2285 N SER A 59 -15.157 -2.949 -22.492 1.00 0.24 N HETATM 2286 CA SER A 59 -14.542 -1.656 -22.215 1.00 0.09 C HETATM 2287 C SER A 59 -15.584 -0.545 -22.218 1.00 0.23 C HETATM 2288 O SER A 59 -16.307 -0.361 -23.197 1.00 -0.39 O HETATM 2289 N SER A 59 -15.657 0.197 -21.112 1.00 -0.26 N HETATM 2290 CA SER A 59 -16.595 1.311 -21.035 1.00 0.13 C HETATM 2291 C SER A 59 -16.189 2.437 -21.975 1.00 0.20 C HETATM 2292 O SER A 59 -17.047 3.069 -22.603 1.00 -0.39 O HETATM 2293 N SER A 59 -14.887 2.704 -22.084 1.00 -0.26 N HETATM 2294 CA SER A 59 -14.418 3.743 -22.994 1.00 0.13 C HETATM 2295 C SER A 59 -14.822 3.427 -24.427 1.00 0.20 C HETATM 2296 O SER A 59 -15.330 4.293 -25.148 1.00 -0.39 O HETATM 2297 N SER A 59 -14.609 2.181 -24.856 1.00 -0.26 N HETATM 2298 CA SER A 59 -15.006 1.794 -26.204 1.00 0.13 C HETATM 2299 C SER A 59 -16.510 1.936 -26.386 1.00 0.20 C HETATM 2300 O SER A 59 -16.981 2.329 -27.460 1.00 -0.39 O HETATM 2301 N SER A 59 -17.280 1.636 -25.338 1.00 -0.26 N HETATM 2302 CA SER A 59 -18.727 1.805 -25.404 1.00 0.13 C HETATM 2303 C SER A 59 -19.097 3.269 -25.617 1.00 0.20 C HETATM 2304 O SER A 59 -20.031 3.580 -26.367 1.00 -0.39 O HETATM 2305 N SER A 59 -18.366 4.184 -24.974 1.00 -0.26 N HETATM 2306 CA SER A 59 -18.636 5.610 -25.138 1.00 0.13 C HETATM 2307 C SER A 59 -18.293 6.083 -26.543 1.00 0.20 C HETATM 2308 O SER A 59 -19.026 6.887 -27.131 1.00 -0.39 O HETATM 2309 N SER A 59 -17.175 5.607 -27.093 1.00 -0.26 N HETATM 2310 CA SER A 59 -16.742 6.070 -28.406 1.00 0.13 C HETATM 2311 C SER A 59 -17.586 5.472 -29.525 1.00 0.20 C HETATM 2312 O SER A 59 -17.689 6.066 -30.604 1.00 -0.39 O HETATM 2313 N SER A 59 -18.198 4.308 -29.294 1.00 -0.26 N HETATM 2314 CA SER A 59 -19.039 3.683 -30.309 1.00 0.13 C HETATM 2315 C SER A 59 -20.452 4.251 -30.341 1.00 0.20 C HETATM 2316 O SER A 59 -21.161 4.047 -31.332 1.00 -0.39 O HETATM 2317 N SER A 59 -20.878 4.947 -29.293 1.00 -0.27 N HETATM 2318 CA SER A 59 -22.245 5.453 -29.219 1.00 0.09 C HETATM 2319 C SER A 59 -22.512 6.492 -30.304 1.00 0.06 C HETATM 2320 O SER A 59 -21.615 7.233 -30.707 1.00 -0.57 O HETATM 2321 OXT SER A 59 -23.631 6.615 -30.803 1.00 -0.57 O HETATM 2322 CB SER A 59 -22.512 6.041 -27.844 1.00 -0.03 C HETATM 2323 H91 SER A 59 -23.544 6.418 -27.801 1.00 0.03 H HETATM 2324 H92 SER A 59 -21.811 6.868 -27.656 1.00 0.03 H HETATM 2325 H93 SER A 59 -22.374 5.263 -27.079 1.00 0.03 H HETATM 2326 H90 SER A 59 -22.933 4.609 -29.375 1.00 0.07 H HETATM 2327 H89 SER A 59 -20.248 5.128 -28.538 1.00 0.19 H HETATM 2328 CB SER A 59 -19.115 2.171 -30.076 1.00 -0.01 C HETATM 2329 CG SER A 59 -17.913 1.327 -30.503 1.00 -0.04 C HETATM 2330 CD1 SER A 59 -18.073 -0.103 -30.006 1.00 -0.06 C HETATM 2331 H83 SER A 59 -17.203 -0.699 -30.319 1.00 0.02 H HETATM 2332 H84 SER A 59 -18.989 -0.539 -30.432 1.00 0.02 H HETATM 2333 H85 SER A 59 -18.142 -0.104 -28.908 1.00 0.02 H HETATM 2334 CD2 SER A 59 -17.756 1.345 -32.012 1.00 -0.06 C HETATM 2335 H86 SER A 59 -17.642 2.383 -32.356 1.00 0.02 H HETATM 2336 H87 SER A 59 -18.647 0.900 -32.479 1.00 0.02 H HETATM 2337 H88 SER A 59 -16.866 0.765 -32.295 1.00 0.02 H HETATM 2338 H82 SER A 59 -17.006 1.756 -30.052 1.00 0.03 H HETATM 2339 H80 SER A 59 -19.991 1.797 -30.626 1.00 0.03 H HETATM 2340 H81 SER A 59 -19.263 2.011 -28.998 1.00 0.03 H HETATM 2341 H79 SER A 59 -18.575 3.865 -31.290 1.00 0.08 H HETATM 2342 H78 SER A 59 -18.078 3.857 -28.410 1.00 0.19 H HETATM 2343 CB SER A 59 -15.263 5.735 -28.605 1.00 -0.01 C HETATM 2344 CG SER A 59 -14.313 6.400 -27.604 1.00 -0.04 C HETATM 2345 CD1 SER A 59 -12.924 5.798 -27.711 1.00 -0.06 C HETATM 2346 H72 SER A 59 -12.256 6.286 -26.986 1.00 0.02 H HETATM 2347 H73 SER A 59 -12.536 5.951 -28.729 1.00 0.02 H HETATM 2348 H74 SER A 59 -12.974 4.721 -27.495 1.00 0.02 H HETATM 2349 CD2 SER A 59 -14.258 7.907 -27.816 1.00 -0.06 C HETATM 2350 H75 SER A 59 -15.272 8.326 -27.735 1.00 0.02 H HETATM 2351 H76 SER A 59 -13.851 8.122 -28.815 1.00 0.02 H HETATM 2352 H77 SER A 59 -13.611 8.362 -27.051 1.00 0.02 H HETATM 2353 H71 SER A 59 -14.695 6.210 -26.590 1.00 0.03 H HETATM 2354 H69 SER A 59 -14.973 6.055 -29.617 1.00 0.03 H HETATM 2355 H70 SER A 59 -15.144 4.645 -28.517 1.00 0.03 H HETATM 2356 H68 SER A 59 -16.858 7.163 -28.440 1.00 0.08 H HETATM 2357 H67 SER A 59 -16.630 4.928 -26.601 1.00 0.19 H HETATM 2358 CB SER A 59 -17.840 6.416 -24.111 1.00 -0.01 C HETATM 2359 CG SER A 59 -18.234 6.254 -22.643 1.00 -0.04 C HETATM 2360 CD1 SER A 59 -17.204 6.928 -21.756 1.00 -0.06 C HETATM 2361 H61 SER A 59 -17.493 6.808 -20.702 1.00 0.02 H HETATM 2362 H62 SER A 59 -17.152 7.999 -22.002 1.00 0.02 H HETATM 2363 H63 SER A 59 -16.220 6.466 -21.921 1.00 0.02 H HETATM 2364 CD2 SER A 59 -19.613 6.833 -22.390 1.00 -0.06 C HETATM 2365 H64 SER A 59 -20.346 6.333 -23.041 1.00 0.02 H HETATM 2366 H65 SER A 59 -19.604 7.911 -22.609 1.00 0.02 H HETATM 2367 H66 SER A 59 -19.890 6.675 -21.337 1.00 0.02 H HETATM 2368 H60 SER A 59 -18.257 5.181 -22.402 1.00 0.03 H HETATM 2369 H58 SER A 59 -17.949 7.480 -24.368 1.00 0.03 H HETATM 2370 H59 SER A 59 -16.784 6.122 -24.205 1.00 0.03 H HETATM 2371 H57 SER A 59 -19.709 5.782 -24.966 1.00 0.08 H HETATM 2372 H56 SER A 59 -17.624 3.889 -24.372 1.00 0.19 H HETATM 2373 CB SER A 59 -19.365 1.261 -24.125 1.00 -0.01 C HETATM 2374 CG SER A 59 -20.882 1.300 -24.101 1.00 -0.04 C HETATM 2375 CD SER A 59 -21.418 0.710 -22.805 1.00 -0.01 C HETATM 2376 CE SER A 59 -22.939 0.753 -22.755 1.00 -0.04 C HETATM 2377 NZ SER A 59 -23.472 0.183 -21.488 1.00 0.22 N HETATM 2378 H53 SER A 59 -24.479 0.231 -21.496 1.00 0.20 H HETATM 2379 H54 SER A 59 -23.117 0.711 -20.706 1.00 0.20 H HETATM 2380 H55 SER A 59 -23.182 -0.779 -21.404 1.00 0.20 H HETATM 2381 H51 SER A 59 -23.338 0.174 -23.601 1.00 0.08 H HETATM 2382 H52 SER A 59 -23.268 1.799 -22.839 1.00 0.08 H HETATM 2383 H49 SER A 59 -21.017 1.286 -21.958 1.00 0.03 H HETATM 2384 H50 SER A 59 -21.088 -0.336 -22.726 1.00 0.03 H HETATM 2385 H47 SER A 59 -21.271 0.719 -24.950 1.00 0.03 H HETATM 2386 H48 SER A 59 -21.217 2.344 -24.188 1.00 0.03 H HETATM 2387 H45 SER A 59 -18.994 1.857 -23.278 1.00 0.03 H HETATM 2388 H46 SER A 59 -19.048 0.215 -24.003 1.00 0.03 H HETATM 2389 H44 SER A 59 -19.108 1.226 -26.258 1.00 0.08 H HETATM 2390 H43 SER A 59 -16.860 1.292 -24.498 1.00 0.19 H HETATM 2391 CB SER A 59 -14.555 0.361 -26.491 1.00 -0.01 C HETATM 2392 CG SER A 59 -14.775 -0.077 -27.931 1.00 -0.04 C HETATM 2393 CD SER A 59 -13.867 -1.236 -28.322 1.00 -0.01 C HETATM 2394 CE SER A 59 -14.664 -2.481 -28.672 1.00 -0.04 C HETATM 2395 NZ SER A 59 -13.793 -3.568 -29.201 1.00 0.22 N HETATM 2396 H40 SER A 59 -14.357 -4.374 -29.421 1.00 0.20 H HETATM 2397 H41 SER A 59 -13.107 -3.817 -28.506 1.00 0.20 H HETATM 2398 H42 SER A 59 -13.325 -3.248 -30.035 1.00 0.20 H HETATM 2399 H38 SER A 59 -15.412 -2.221 -29.436 1.00 0.08 H HETATM 2400 H39 SER A 59 -15.174 -2.843 -27.767 1.00 0.08 H HETATM 2401 H36 SER A 59 -13.199 -1.466 -27.479 1.00 0.03 H HETATM 2402 H37 SER A 59 -13.267 -0.940 -29.195 1.00 0.03 H HETATM 2403 H34 SER A 59 -14.570 0.775 -28.596 1.00 0.03 H HETATM 2404 H35 SER A 59 -15.822 -0.391 -28.050 1.00 0.03 H HETATM 2405 H32 SER A 59 -15.117 -0.318 -25.833 1.00 0.03 H HETATM 2406 H33 SER A 59 -13.481 0.284 -26.266 1.00 0.03 H HETATM 2407 H31 SER A 59 -14.508 2.465 -26.919 1.00 0.08 H HETATM 2408 H30 SER A 59 -14.176 1.512 -24.252 1.00 0.19 H HETATM 2409 CB SER A 59 -12.901 3.894 -22.878 1.00 -0.01 C HETATM 2410 CG SER A 59 -12.215 4.852 -23.857 1.00 -0.04 C HETATM 2411 CD1 SER A 59 -12.780 6.260 -23.747 1.00 -0.06 C HETATM 2412 H24 SER A 59 -12.265 6.918 -24.462 1.00 0.02 H HETATM 2413 H25 SER A 59 -12.627 6.638 -22.725 1.00 0.02 H HETATM 2414 H26 SER A 59 -13.856 6.242 -23.974 1.00 0.02 H HETATM 2415 CD2 SER A 59 -10.716 4.864 -23.616 1.00 -0.06 C HETATM 2416 H27 SER A 59 -10.323 3.840 -23.699 1.00 0.02 H HETATM 2417 H28 SER A 59 -10.510 5.255 -22.609 1.00 0.02 H HETATM 2418 H29 SER A 59 -10.229 5.505 -24.366 1.00 0.02 H HETATM 2419 H23 SER A 59 -12.399 4.488 -24.879 1.00 0.03 H HETATM 2420 H21 SER A 59 -12.457 2.898 -23.024 1.00 0.03 H HETATM 2421 H22 SER A 59 -12.681 4.248 -21.860 1.00 0.03 H HETATM 2422 H20 SER A 59 -14.886 4.696 -22.705 1.00 0.08 H HETATM 2423 H19 SER A 59 -14.227 2.188 -21.538 1.00 0.19 H HETATM 2424 CB SER A 59 -16.686 1.820 -19.598 1.00 -0.01 C HETATM 2425 CG SER A 59 -17.540 3.071 -19.384 1.00 -0.04 C HETATM 2426 CD1 SER A 59 -18.952 2.856 -19.898 1.00 -0.06 C HETATM 2427 H13 SER A 59 -19.545 3.768 -19.733 1.00 0.02 H HETATM 2428 H14 SER A 59 -19.414 2.015 -19.360 1.00 0.02 H HETATM 2429 H15 SER A 59 -18.920 2.629 -20.974 1.00 0.02 H HETATM 2430 CD2 SER A 59 -17.554 3.456 -17.911 1.00 -0.06 C HETATM 2431 H16 SER A 59 -16.522 3.606 -17.561 1.00 0.02 H HETATM 2432 H17 SER A 59 -18.026 2.652 -17.326 1.00 0.02 H HETATM 2433 H18 SER A 59 -18.124 4.388 -17.781 1.00 0.02 H HETATM 2434 H12 SER A 59 -17.090 3.898 -19.953 1.00 0.03 H HETATM 2435 H10 SER A 59 -15.665 2.046 -19.256 1.00 0.03 H HETATM 2436 H11 SER A 59 -17.109 1.014 -18.981 1.00 0.03 H HETATM 2437 H9 SER A 59 -17.588 0.949 -21.340 1.00 0.08 H HETATM 2438 H8 SER A 59 -15.066 -0.011 -20.333 1.00 0.19 H HETATM 2439 CB SER A 59 -13.451 -1.353 -23.243 1.00 0.10 C HETATM 2440 OG SER A 59 -13.043 0.001 -23.173 1.00 -0.39 O HETATM 2441 H7 SER A 59 -12.702 0.183 -22.305 1.00 0.21 H HETATM 2442 H5 SER A 59 -13.841 -1.559 -24.251 1.00 0.06 H HETATM 2443 H6 SER A 59 -12.583 -2.000 -23.046 1.00 0.06 H HETATM 2444 H4 SER A 59 -14.081 -1.698 -21.217 1.00 0.11 H HETATM 2445 H1 SER A 59 -14.449 -3.666 -22.485 1.00 0.20 H HETATM 2446 H2 SER A 59 -15.600 -2.923 -23.397 1.00 0.20 H HETATM 2447 H3 SER A 59 -15.847 -3.151 -21.786 1.00 0.20 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 279 280 287 288 289 CONECT 287 279 CONECT 288 279 CONECT 289 279 CONECT 1484 1485 1492 1493 1494 CONECT 1492 1484 CONECT 1493 1484 CONECT 1494 1484 CONECT 2285 2286 2445 2446 2447 CONECT 2286 2285 2287 2439 2444 CONECT 2287 2286 2288 2289 CONECT 2288 2287 CONECT 2289 2287 2290 2438 CONECT 2290 2289 2291 2424 2437 CONECT 2291 2290 2292 2293 CONECT 2292 2291 CONECT 2293 2291 2294 2423 CONECT 2294 2293 2295 2409 2422 CONECT 2295 2294 2296 2297 CONECT 2296 2295 CONECT 2297 2295 2298 2408 CONECT 2298 2297 2299 2391 2407 CONECT 2299 2298 2300 2301 CONECT 2300 2299 CONECT 2301 2299 2302 2390 CONECT 2302 2301 2303 2373 2389 CONECT 2303 2302 2304 2305 CONECT 2304 2303 CONECT 2305 2303 2306 2372 CONECT 2306 2305 2307 2358 2371 CONECT 2307 2306 2308 2309 CONECT 2308 2307 CONECT 2309 2307 2310 2357 CONECT 2310 2309 2311 2343 2356 CONECT 2311 2310 2312 2313 CONECT 2312 2311 CONECT 2313 2311 2314 2342 CONECT 2314 2313 2315 2328 2341 CONECT 2315 2314 2316 2317 CONECT 2316 2315 CONECT 2317 2315 2318 2327 CONECT 2318 2317 2319 2322 2326 CONECT 2319 2318 2320 2321 CONECT 2320 2319 CONECT 2321 2319 CONECT 2322 2318 2323 2324 2325 CONECT 2323 2322 CONECT 2324 2322 CONECT 2325 2322 CONECT 2326 2318 CONECT 2327 2317 CONECT 2328 2314 2329 2339 2340 CONECT 2329 2328 2330 2334 2338 CONECT 2330 2329 2331 2332 2333 CONECT 2331 2330 CONECT 2332 2330 CONECT 2333 2330 CONECT 2334 2329 2335 2336 2337 CONECT 2335 2334 CONECT 2336 2334 CONECT 2337 2334 CONECT 2338 2329 CONECT 2339 2328 CONECT 2340 2328 CONECT 2341 2314 CONECT 2342 2313 CONECT 2343 2310 2344 2354 2355 CONECT 2344 2343 2345 2349 2353 CONECT 2345 2344 2346 2347 2348 CONECT 2346 2345 CONECT 2347 2345 CONECT 2348 2345 CONECT 2349 2344 2350 2351 2352 CONECT 2350 2349 CONECT 2351 2349 CONECT 2352 2349 CONECT 2353 2344 CONECT 2354 2343 CONECT 2355 2343 CONECT 2356 2310 CONECT 2357 2309 CONECT 2358 2306 2359 2369 2370 CONECT 2359 2358 2360 2364 2368 CONECT 2360 2359 2361 2362 2363 CONECT 2361 2360 CONECT 2362 2360 CONECT 2363 2360 CONECT 2364 2359 2365 2366 2367 CONECT 2365 2364 CONECT 2366 2364 CONECT 2367 2364 CONECT 2368 2359 CONECT 2369 2358 CONECT 2370 2358 CONECT 2371 2306 CONECT 2372 2305 CONECT 2373 2302 2374 2387 2388 CONECT 2374 2373 2375 2385 2386 CONECT 2375 2374 2376 2383 2384 CONECT 2376 2375 2377 2381 2382 CONECT 2377 2376 2378 2379 2380 CONECT 2378 2377 CONECT 2379 2377 CONECT 2380 2377 CONECT 2381 2376 CONECT 2382 2376 CONECT 2383 2375 CONECT 2384 2375 CONECT 2385 2374 CONECT 2386 2374 CONECT 2387 2373 CONECT 2388 2373 CONECT 2389 2302 CONECT 2390 2301 CONECT 2391 2298 2392 2405 2406 CONECT 2392 2391 2393 2403 2404 CONECT 2393 2392 2394 2401 2402 CONECT 2394 2393 2395 2399 2400 CONECT 2395 2394 2396 2397 2398 CONECT 2396 2395 CONECT 2397 2395 CONECT 2398 2395 CONECT 2399 2394 CONECT 2400 2394 CONECT 2401 2393 CONECT 2402 2393 CONECT 2403 2392 CONECT 2404 2392 CONECT 2405 2391 CONECT 2406 2391 CONECT 2407 2298 CONECT 2408 2297 CONECT 2409 2294 2410 2420 2421 CONECT 2410 2409 2411 2415 2419 CONECT 2411 2410 2412 2413 2414 CONECT 2412 2411 CONECT 2413 2411 CONECT 2414 2411 CONECT 2415 2410 2416 2417 2418 CONECT 2416 2415 CONECT 2417 2415 CONECT 2418 2415 CONECT 2419 2410 CONECT 2420 2409 CONECT 2421 2409 CONECT 2422 2294 CONECT 2423 2293 CONECT 2424 2290 2425 2435 2436 CONECT 2425 2424 2426 2430 2434 CONECT 2426 2425 2427 2428 2429 CONECT 2427 2426 CONECT 2428 2426 CONECT 2429 2426 CONECT 2430 2425 2431 2432 2433 CONECT 2431 2430 CONECT 2432 2430 CONECT 2433 2430 CONECT 2434 2425 CONECT 2435 2424 CONECT 2436 2424 CONECT 2437 2290 CONECT 2438 2289 CONECT 2439 2286 2440 2442 2443 CONECT 2440 2439 2441 CONECT 2441 2440 CONECT 2442 2439 CONECT 2443 2439 CONECT 2444 2286 CONECT 2445 2285 CONECT 2446 2285 CONECT 2447 2285 MASTER 0 0 0 0 0 0 0 0 2444 3 175 19 END
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14-mer
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RCSB PDB
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PDBbind
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PDBbind
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RCSB PDB
PDBbind
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PDBbind
14-mer
2fx9
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
14-mer
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
14-mer
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Entry Information
PDB ID
5unj
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Nuclear receptor subfamily 5 group A member 2
Ligand Name
14-mer
EC.Number
E.C.-.-.-.-
Resolution
1.96(Å)
Affinity (Kd/Ki/IC50)
Kd=0.24uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Mol. Pharmacol. Vol. 92: pp. 1-11
Ligand Properties
Formula
C
4
8
H
9
4
N
1
1
O
1
1
Molecular Weight
1001.330
Exact Mass
1000.710
No. of atoms
164
No. of bonds
163
Polar Surface Area
373.25
LOGP Value
0.94 (
Computed with XLOGP3
)
0.75 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 12
No. of Hydrogen Bond Acceptors: 11
No. of Rotatable Bonds: 44
No. of Nitrogen and Oxygen Atoms: 22
No. of Rings: 0
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(C)C)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CC(C)C)CC(C)C)CCCC[NH3+]
InChI String
InChI=1S/C48H91N11O11/c1-26(2)20-35(43(64)52-31(11)48(69)70)57-47(68)39(24-30(9)10)59-46(67)38(23-29(7)8)56-42(63)34(17-13-15-19-50)53-41(62)33(16-12-14-18-49)54-44(65)37(22-28(5)6)58-45(66)36(21-27(3)4)55-40(61)32(51)25-60/h26-39,60H,12-25,49-51H2,1-11H3,(H,52,64)(H,53,62)(H,54,65)(H,55,61)(H,56,63)(H,57,68)(H,58,66)(H,59,67)(H,69,70)/p+3/t31-,32-,33-,34-,35-,36-,37-,38-,39-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9UBK2
O00482
Entrez Gene ID
NCBI Entrez Gene ID:
10891
2494
ASD
Information of known allosteric effects of PDB entries
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