USER MOD reduce.3.24.130724 H: found=0, std=0, add=613, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 614 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 263 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 TYR OH : rot 180:sc= 0.128 USER MOD Single : A 269 ASN : amide:sc= 0 X(o=0,f=-0.086) USER MOD Single : A 271 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 273 THR OG1 : rot 180:sc= 0 USER MOD Single : A 274 SER OG : rot 29:sc= 0.149 USER MOD Single : A 276 MET CE :methyl 177:sc= -8.62! (180deg=-8.87!) USER MOD Single : A 277 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 280 CYS SG : rot 21:sc= 0.167 USER MOD Single : A 283 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 289 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 HIS : no HD1:sc= -0.442 X(o=-0.44,f=-0.8) USER MOD Single : A 298 SER OG : rot 180:sc= 0 USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 315 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.0638) USER MOD Single : A 317 GLN : amide:sc= -0.178 X(o=-0.18,f=-0.013) USER MOD Single : A 320 LYS NZ :NH3+ 149:sc= 0.6 (180deg=-0.386) USER MOD Single : A 322 LYS NZ :NH3+ 175:sc= -0.203 (180deg=-0.263) USER MOD Single : A 325 SER OG : rot 180:sc= 0 USER MOD Single : A 327 THR OG1 : rot 180:sc= 0 USER MOD Single : A 329 THR OG1 : rot 180:sc= 0 USER MOD Single : A 330 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 331 THR OG1 : rot 180:sc= 0 USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 334 SER OG : rot -160:sc= -0.014 USER MOD Single : A 335 MET CE :methyl 152:sc= -0.148 (180deg=-0.919) USER MOD Single : A 336 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.191) USER MOD Single : A 340 GLN : amide:sc= -0.801 K(o=-0.8,f=-1.8) USER MOD Single : A 342 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N GLU A 260 8.668 14.434 0.155 1.00 0.00 N ATOM 67 CA GLU A 260 8.503 14.168 1.579 1.00 0.00 C ATOM 68 C GLU A 260 7.263 13.316 1.834 1.00 0.00 C ATOM 69 O GLU A 260 7.353 12.225 2.394 1.00 0.00 O ATOM 70 CB GLU A 260 8.401 15.482 2.357 1.00 0.00 C ATOM 71 CG GLU A 260 9.618 16.378 2.200 1.00 0.00 C ATOM 72 CD GLU A 260 9.631 17.119 0.877 1.00 0.00 C ATOM 73 OE1 GLU A 260 8.653 17.843 0.594 1.00 0.00 O ATOM 74 OE2 GLU A 260 10.617 16.974 0.125 1.00 0.00 O ATOM 0 HA GLU A 260 9.378 13.617 1.923 1.00 0.00 H new ATOM 0 HB2 GLU A 260 7.516 16.024 2.024 1.00 0.00 H new ATOM 0 HB3 GLU A 260 8.259 15.258 3.414 1.00 0.00 H new ATOM 0 HG2 GLU A 260 9.641 17.100 3.016 1.00 0.00 H new ATOM 0 HG3 GLU A 260 10.522 15.774 2.283 1.00 0.00 H new ATOM 81 N GLU A 261 6.107 13.825 1.418 1.00 0.00 N ATOM 82 CA GLU A 261 4.849 13.111 1.603 1.00 0.00 C ATOM 83 C GLU A 261 4.431 12.404 0.316 1.00 0.00 C ATOM 84 O GLU A 261 4.673 12.883 -0.792 1.00 0.00 O ATOM 85 CB GLU A 261 3.749 14.077 2.047 1.00 0.00 C ATOM 86 CG GLU A 261 4.057 14.789 3.354 1.00 0.00 C ATOM 87 CD GLU A 261 2.864 15.553 3.897 1.00 0.00 C ATOM 88 OE1 GLU A 261 2.023 15.993 3.085 1.00 0.00 O ATOM 89 OE2 GLU A 261 2.772 15.711 5.132 1.00 0.00 O ATOM 0 H GLU A 261 6.016 14.727 0.951 1.00 0.00 H new ATOM 0 HA GLU A 261 4.998 12.360 2.379 1.00 0.00 H new ATOM 0 HB2 GLU A 261 3.593 14.821 1.266 1.00 0.00 H new ATOM 0 HB3 GLU A 261 2.815 13.526 2.154 1.00 0.00 H new ATOM 0 HG2 GLU A 261 4.383 14.058 4.094 1.00 0.00 H new ATOM 0 HG3 GLU A 261 4.887 15.479 3.201 1.00 0.00 H new ATOM 96 N PRO A 262 3.788 11.237 0.465 1.00 0.00 N ATOM 97 CA PRO A 262 3.322 10.438 -0.672 1.00 0.00 C ATOM 98 C PRO A 262 2.159 11.098 -1.405 1.00 0.00 C ATOM 99 O PRO A 262 1.347 11.799 -0.800 1.00 0.00 O ATOM 100 CB PRO A 262 2.872 9.127 -0.025 1.00 0.00 C ATOM 101 CG PRO A 262 2.526 9.495 1.377 1.00 0.00 C ATOM 102 CD PRO A 262 3.465 10.606 1.756 1.00 0.00 C ATOM 0 HA PRO A 262 4.098 10.311 -1.426 1.00 0.00 H new ATOM 0 HB2 PRO A 262 2.014 8.703 -0.546 1.00 0.00 H new ATOM 0 HB3 PRO A 262 3.664 8.379 -0.054 1.00 0.00 H new ATOM 0 HG2 PRO A 262 1.488 9.819 1.451 1.00 0.00 H new ATOM 0 HG3 PRO A 262 2.642 8.641 2.045 1.00 0.00 H new ATOM 0 HD2 PRO A 262 2.996 11.312 2.442 1.00 0.00 H new ATOM 0 HD3 PRO A 262 4.358 10.225 2.252 1.00 0.00 H new ATOM 110 N THR A 263 2.082 10.868 -2.713 1.00 0.00 N ATOM 111 CA THR A 263 1.018 11.440 -3.528 1.00 0.00 C ATOM 112 C THR A 263 -0.143 10.465 -3.679 1.00 0.00 C ATOM 113 O THR A 263 0.046 9.319 -4.089 1.00 0.00 O ATOM 114 CB THR A 263 1.531 11.830 -4.927 1.00 0.00 C ATOM 115 OG1 THR A 263 2.698 12.653 -4.809 1.00 0.00 O ATOM 116 CG2 THR A 263 0.458 12.573 -5.709 1.00 0.00 C ATOM 0 H THR A 263 2.744 10.289 -3.230 1.00 0.00 H new ATOM 0 HA THR A 263 0.672 12.336 -3.013 1.00 0.00 H new ATOM 0 HB THR A 263 1.784 10.916 -5.465 1.00 0.00 H new ATOM 0 HG1 THR A 263 3.019 12.895 -5.703 1.00 0.00 H new ATOM 0 HG21 THR A 263 0.843 12.838 -6.694 1.00 0.00 H new ATOM 0 HG22 THR A 263 -0.418 11.934 -5.822 1.00 0.00 H new ATOM 0 HG23 THR A 263 0.179 13.480 -5.172 1.00 0.00 H new ATOM 124 N ILE A 264 -1.344 10.926 -3.348 1.00 0.00 N ATOM 125 CA ILE A 264 -2.537 10.094 -3.449 1.00 0.00 C ATOM 126 C ILE A 264 -2.836 9.736 -4.901 1.00 0.00 C ATOM 127 O ILE A 264 -2.853 10.603 -5.774 1.00 0.00 O ATOM 128 CB ILE A 264 -3.766 10.796 -2.842 1.00 0.00 C ATOM 129 CG1 ILE A 264 -3.549 11.049 -1.348 1.00 0.00 C ATOM 130 CG2 ILE A 264 -5.017 9.960 -3.066 1.00 0.00 C ATOM 131 CD1 ILE A 264 -4.558 12.001 -0.744 1.00 0.00 C ATOM 0 H ILE A 264 -1.517 11.872 -3.007 1.00 0.00 H new ATOM 0 HA ILE A 264 -2.335 9.183 -2.886 1.00 0.00 H new ATOM 0 HB ILE A 264 -3.900 11.757 -3.339 1.00 0.00 H new ATOM 0 HG12 ILE A 264 -3.595 10.099 -0.816 1.00 0.00 H new ATOM 0 HG13 ILE A 264 -2.547 11.451 -1.197 1.00 0.00 H new ATOM 0 HG21 ILE A 264 -5.877 10.469 -2.632 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -5.177 9.825 -4.136 1.00 0.00 H new ATOM 0 HG23 ILE A 264 -4.894 8.986 -2.592 1.00 0.00 H new ATOM 0 HD11 ILE A 264 -4.344 12.134 0.316 1.00 0.00 H new ATOM 0 HD12 ILE A 264 -4.497 12.965 -1.250 1.00 0.00 H new ATOM 0 HD13 ILE A 264 -5.561 11.591 -0.863 1.00 0.00 H new ATOM 143 N GLY A 265 -3.073 8.452 -5.151 1.00 0.00 N ATOM 144 CA GLY A 265 -3.370 8.002 -6.499 1.00 0.00 C ATOM 145 C GLY A 265 -2.140 7.495 -7.225 1.00 0.00 C ATOM 146 O GLY A 265 -2.245 6.899 -8.297 1.00 0.00 O ATOM 0 H GLY A 265 -3.065 7.716 -4.445 1.00 0.00 H new ATOM 0 HA2 GLY A 265 -4.116 7.209 -6.458 1.00 0.00 H new ATOM 0 HA3 GLY A 265 -3.809 8.824 -7.065 1.00 0.00 H new ATOM 150 N ASP A 266 -0.971 7.732 -6.641 1.00 0.00 N ATOM 151 CA ASP A 266 0.285 7.296 -7.240 1.00 0.00 C ATOM 152 C ASP A 266 0.780 6.008 -6.589 1.00 0.00 C ATOM 153 O ASP A 266 0.544 5.770 -5.404 1.00 0.00 O ATOM 154 CB ASP A 266 1.346 8.389 -7.106 1.00 0.00 C ATOM 155 CG ASP A 266 1.326 9.361 -8.270 1.00 0.00 C ATOM 156 OD1 ASP A 266 0.229 9.621 -8.806 1.00 0.00 O ATOM 157 OD2 ASP A 266 2.407 9.861 -8.645 1.00 0.00 O ATOM 0 H ASP A 266 -0.867 8.224 -5.753 1.00 0.00 H new ATOM 0 HA ASP A 266 0.106 7.102 -8.298 1.00 0.00 H new ATOM 0 HB2 ASP A 266 1.185 8.936 -6.177 1.00 0.00 H new ATOM 0 HB3 ASP A 266 2.332 7.928 -7.038 1.00 0.00 H new ATOM 162 N ILE A 267 1.465 5.180 -7.370 1.00 0.00 N ATOM 163 CA ILE A 267 1.992 3.917 -6.869 1.00 0.00 C ATOM 164 C ILE A 267 3.395 4.094 -6.299 1.00 0.00 C ATOM 165 O ILE A 267 4.158 4.947 -6.754 1.00 0.00 O ATOM 166 CB ILE A 267 2.030 2.845 -7.974 1.00 0.00 C ATOM 167 CG1 ILE A 267 0.615 2.357 -8.291 1.00 0.00 C ATOM 168 CG2 ILE A 267 2.915 1.682 -7.552 1.00 0.00 C ATOM 169 CD1 ILE A 267 -0.069 3.153 -9.380 1.00 0.00 C ATOM 0 H ILE A 267 1.668 5.361 -8.353 1.00 0.00 H new ATOM 0 HA ILE A 267 1.320 3.587 -6.077 1.00 0.00 H new ATOM 0 HB ILE A 267 2.451 3.289 -8.876 1.00 0.00 H new ATOM 0 HG12 ILE A 267 0.659 1.310 -8.591 1.00 0.00 H new ATOM 0 HG13 ILE A 267 0.012 2.404 -7.384 1.00 0.00 H new ATOM 0 HG21 ILE A 267 2.932 0.932 -8.343 1.00 0.00 H new ATOM 0 HG22 ILE A 267 3.928 2.042 -7.371 1.00 0.00 H new ATOM 0 HG23 ILE A 267 2.520 1.237 -6.639 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -1.068 2.751 -9.552 1.00 0.00 H new ATOM 0 HD12 ILE A 267 -0.145 4.197 -9.075 1.00 0.00 H new ATOM 0 HD13 ILE A 267 0.512 3.086 -10.300 1.00 0.00 H new ATOM 181 N TYR A 268 3.730 3.282 -5.303 1.00 0.00 N ATOM 182 CA TYR A 268 5.042 3.350 -4.670 1.00 0.00 C ATOM 183 C TYR A 268 5.519 1.961 -4.257 1.00 0.00 C ATOM 184 O TYR A 268 4.731 1.019 -4.178 1.00 0.00 O ATOM 185 CB TYR A 268 4.995 4.269 -3.448 1.00 0.00 C ATOM 186 CG TYR A 268 4.793 5.727 -3.795 1.00 0.00 C ATOM 187 CD1 TYR A 268 3.582 6.179 -4.305 1.00 0.00 C ATOM 188 CD2 TYR A 268 5.814 6.653 -3.613 1.00 0.00 C ATOM 189 CE1 TYR A 268 3.394 7.510 -4.624 1.00 0.00 C ATOM 190 CE2 TYR A 268 5.633 7.986 -3.928 1.00 0.00 C ATOM 191 CZ TYR A 268 4.422 8.409 -4.433 1.00 0.00 C ATOM 192 OH TYR A 268 4.238 9.736 -4.748 1.00 0.00 O ATOM 0 H TYR A 268 3.112 2.569 -4.916 1.00 0.00 H new ATOM 0 HA TYR A 268 5.747 3.757 -5.395 1.00 0.00 H new ATOM 0 HB2 TYR A 268 4.188 3.945 -2.791 1.00 0.00 H new ATOM 0 HB3 TYR A 268 5.924 4.163 -2.888 1.00 0.00 H new ATOM 0 HD1 TYR A 268 2.774 5.478 -4.455 1.00 0.00 H new ATOM 0 HD2 TYR A 268 6.764 6.325 -3.219 1.00 0.00 H new ATOM 0 HE1 TYR A 268 2.447 7.845 -5.021 1.00 0.00 H new ATOM 0 HE2 TYR A 268 6.436 8.693 -3.779 1.00 0.00 H new ATOM 0 HH TYR A 268 5.058 10.235 -4.553 1.00 0.00 H new ATOM 202 N ASN A 269 6.816 1.842 -3.993 1.00 0.00 N ATOM 203 CA ASN A 269 7.401 0.569 -3.588 1.00 0.00 C ATOM 204 C ASN A 269 7.425 0.441 -2.068 1.00 0.00 C ATOM 205 O ASN A 269 7.606 1.426 -1.354 1.00 0.00 O ATOM 206 CB ASN A 269 8.819 0.435 -4.145 1.00 0.00 C ATOM 207 CG ASN A 269 8.911 0.849 -5.601 1.00 0.00 C ATOM 208 OD1 ASN A 269 8.458 0.130 -6.492 1.00 0.00 O ATOM 209 ND2 ASN A 269 9.499 2.013 -5.849 1.00 0.00 N ATOM 0 H ASN A 269 7.482 2.612 -4.052 1.00 0.00 H new ATOM 0 HA ASN A 269 6.782 -0.232 -3.993 1.00 0.00 H new ATOM 0 HB2 ASN A 269 9.498 1.048 -3.552 1.00 0.00 H new ATOM 0 HB3 ASN A 269 9.150 -0.598 -4.043 1.00 0.00 H new ATOM 0 HD21 ASN A 269 9.590 2.344 -6.809 1.00 0.00 H new ATOM 0 HD22 ASN A 269 9.860 2.576 -5.079 1.00 0.00 H new ATOM 216 N GLY A 270 7.241 -0.782 -1.579 1.00 0.00 N ATOM 217 CA GLY A 270 7.245 -1.018 -0.147 1.00 0.00 C ATOM 218 C GLY A 270 7.854 -2.357 0.218 1.00 0.00 C ATOM 219 O GLY A 270 8.144 -3.175 -0.655 1.00 0.00 O ATOM 0 H GLY A 270 7.089 -1.614 -2.150 1.00 0.00 H new ATOM 0 HA2 GLY A 270 7.802 -0.222 0.348 1.00 0.00 H new ATOM 0 HA3 GLY A 270 6.223 -0.973 0.228 1.00 0.00 H new ATOM 223 N LYS A 271 8.050 -2.582 1.513 1.00 0.00 N ATOM 224 CA LYS A 271 8.629 -3.831 1.994 1.00 0.00 C ATOM 225 C LYS A 271 8.032 -4.224 3.341 1.00 0.00 C ATOM 226 O LYS A 271 8.135 -3.482 4.318 1.00 0.00 O ATOM 227 CB LYS A 271 10.149 -3.698 2.117 1.00 0.00 C ATOM 228 CG LYS A 271 10.805 -4.866 2.832 1.00 0.00 C ATOM 229 CD LYS A 271 10.898 -4.623 4.329 1.00 0.00 C ATOM 230 CE LYS A 271 12.125 -5.293 4.927 1.00 0.00 C ATOM 231 NZ LYS A 271 13.309 -4.390 4.920 1.00 0.00 N ATOM 0 H LYS A 271 7.816 -1.915 2.249 1.00 0.00 H new ATOM 0 HA LYS A 271 8.396 -4.613 1.271 1.00 0.00 H new ATOM 0 HB2 LYS A 271 10.579 -3.605 1.120 1.00 0.00 H new ATOM 0 HB3 LYS A 271 10.383 -2.778 2.652 1.00 0.00 H new ATOM 0 HG2 LYS A 271 10.234 -5.775 2.645 1.00 0.00 H new ATOM 0 HG3 LYS A 271 11.804 -5.028 2.426 1.00 0.00 H new ATOM 0 HD2 LYS A 271 10.937 -3.551 4.523 1.00 0.00 H new ATOM 0 HD3 LYS A 271 10.000 -5.003 4.817 1.00 0.00 H new ATOM 0 HE2 LYS A 271 11.909 -5.600 5.950 1.00 0.00 H new ATOM 0 HE3 LYS A 271 12.355 -6.198 4.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 271 14.125 -4.884 5.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 271 13.532 -4.117 3.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 271 13.099 -3.538 5.478 1.00 0.00 H new ATOM 245 N VAL A 272 7.408 -5.397 3.387 1.00 0.00 N ATOM 246 CA VAL A 272 6.796 -5.890 4.615 1.00 0.00 C ATOM 247 C VAL A 272 7.823 -5.991 5.738 1.00 0.00 C ATOM 248 O VAL A 272 8.830 -6.690 5.613 1.00 0.00 O ATOM 249 CB VAL A 272 6.145 -7.270 4.404 1.00 0.00 C ATOM 250 CG1 VAL A 272 5.790 -7.903 5.740 1.00 0.00 C ATOM 251 CG2 VAL A 272 4.914 -7.147 3.518 1.00 0.00 C ATOM 0 H VAL A 272 7.313 -6.023 2.588 1.00 0.00 H new ATOM 0 HA VAL A 272 6.025 -5.172 4.894 1.00 0.00 H new ATOM 0 HB VAL A 272 6.863 -7.919 3.902 1.00 0.00 H new ATOM 0 HG11 VAL A 272 5.331 -8.877 5.571 1.00 0.00 H new ATOM 0 HG12 VAL A 272 6.694 -8.026 6.336 1.00 0.00 H new ATOM 0 HG13 VAL A 272 5.090 -7.260 6.273 1.00 0.00 H new ATOM 0 HG21 VAL A 272 4.466 -8.131 3.379 1.00 0.00 H new ATOM 0 HG22 VAL A 272 4.191 -6.482 3.990 1.00 0.00 H new ATOM 0 HG23 VAL A 272 5.202 -6.739 2.549 1.00 0.00 H new ATOM 261 N THR A 273 7.562 -5.290 6.836 1.00 0.00 N ATOM 262 CA THR A 273 8.463 -5.300 7.982 1.00 0.00 C ATOM 263 C THR A 273 7.911 -6.165 9.109 1.00 0.00 C ATOM 264 O THR A 273 8.667 -6.781 9.859 1.00 0.00 O ATOM 265 CB THR A 273 8.708 -3.876 8.516 1.00 0.00 C ATOM 266 OG1 THR A 273 7.465 -3.273 8.892 1.00 0.00 O ATOM 267 CG2 THR A 273 9.399 -3.016 7.468 1.00 0.00 C ATOM 0 H THR A 273 6.733 -4.708 6.956 1.00 0.00 H new ATOM 0 HA THR A 273 9.408 -5.719 7.637 1.00 0.00 H new ATOM 0 HB THR A 273 9.356 -3.946 9.390 1.00 0.00 H new ATOM 0 HG1 THR A 273 7.630 -2.369 9.232 1.00 0.00 H new ATOM 0 HG21 THR A 273 9.561 -2.015 7.868 1.00 0.00 H new ATOM 0 HG22 THR A 273 10.358 -3.462 7.206 1.00 0.00 H new ATOM 0 HG23 THR A 273 8.773 -2.954 6.578 1.00 0.00 H new ATOM 275 N SER A 274 6.587 -6.208 9.221 1.00 0.00 N ATOM 276 CA SER A 274 5.933 -6.996 10.259 1.00 0.00 C ATOM 277 C SER A 274 4.557 -7.468 9.797 1.00 0.00 C ATOM 278 O SER A 274 3.711 -6.662 9.410 1.00 0.00 O ATOM 279 CB SER A 274 5.799 -6.176 11.543 1.00 0.00 C ATOM 280 OG SER A 274 6.938 -6.335 12.371 1.00 0.00 O ATOM 0 H SER A 274 5.946 -5.706 8.606 1.00 0.00 H new ATOM 0 HA SER A 274 6.550 -7.872 10.459 1.00 0.00 H new ATOM 0 HB2 SER A 274 5.671 -5.123 11.294 1.00 0.00 H new ATOM 0 HB3 SER A 274 4.906 -6.486 12.085 1.00 0.00 H new ATOM 0 HG SER A 274 7.723 -6.524 11.815 1.00 0.00 H new ATOM 286 N ILE A 275 4.343 -8.778 9.842 1.00 0.00 N ATOM 287 CA ILE A 275 3.070 -9.358 9.429 1.00 0.00 C ATOM 288 C ILE A 275 2.121 -9.498 10.614 1.00 0.00 C ATOM 289 O ILE A 275 2.550 -9.749 11.740 1.00 0.00 O ATOM 290 CB ILE A 275 3.266 -10.739 8.776 1.00 0.00 C ATOM 291 CG1 ILE A 275 4.083 -10.607 7.489 1.00 0.00 C ATOM 292 CG2 ILE A 275 1.919 -11.386 8.491 1.00 0.00 C ATOM 293 CD1 ILE A 275 5.572 -10.492 7.728 1.00 0.00 C ATOM 0 H ILE A 275 5.034 -9.458 10.160 1.00 0.00 H new ATOM 0 HA ILE A 275 2.635 -8.678 8.696 1.00 0.00 H new ATOM 0 HB ILE A 275 3.814 -11.378 9.468 1.00 0.00 H new ATOM 0 HG12 ILE A 275 3.891 -11.473 6.856 1.00 0.00 H new ATOM 0 HG13 ILE A 275 3.742 -9.729 6.940 1.00 0.00 H new ATOM 0 HG21 ILE A 275 2.074 -12.361 8.030 1.00 0.00 H new ATOM 0 HG22 ILE A 275 1.370 -11.509 9.424 1.00 0.00 H new ATOM 0 HG23 ILE A 275 1.346 -10.752 7.814 1.00 0.00 H new ATOM 0 HD11 ILE A 275 6.088 -10.402 6.772 1.00 0.00 H new ATOM 0 HD12 ILE A 275 5.776 -9.610 8.335 1.00 0.00 H new ATOM 0 HD13 ILE A 275 5.927 -11.381 8.249 1.00 0.00 H new ATOM 305 N MET A 276 0.828 -9.337 10.351 1.00 0.00 N ATOM 306 CA MET A 276 -0.184 -9.449 11.396 1.00 0.00 C ATOM 307 C MET A 276 -1.354 -10.308 10.929 1.00 0.00 C ATOM 308 O MET A 276 -1.646 -10.379 9.735 1.00 0.00 O ATOM 309 CB MET A 276 -0.684 -8.061 11.801 1.00 0.00 C ATOM 310 CG MET A 276 0.342 -7.246 12.570 1.00 0.00 C ATOM 311 SD MET A 276 1.527 -6.423 11.488 1.00 0.00 S ATOM 312 CE MET A 276 0.435 -5.395 10.509 1.00 0.00 C ATOM 0 H MET A 276 0.456 -9.129 9.424 1.00 0.00 H new ATOM 0 HA MET A 276 0.273 -9.929 12.261 1.00 0.00 H new ATOM 0 HB2 MET A 276 -0.974 -7.512 10.905 1.00 0.00 H new ATOM 0 HB3 MET A 276 -1.580 -8.171 12.411 1.00 0.00 H new ATOM 0 HG2 MET A 276 -0.172 -6.499 13.174 1.00 0.00 H new ATOM 0 HG3 MET A 276 0.877 -7.900 13.259 1.00 0.00 H new ATOM 0 HE1 MET A 276 1.026 -4.783 9.827 1.00 0.00 H new ATOM 0 HE2 MET A 276 -0.242 -6.027 9.935 1.00 0.00 H new ATOM 0 HE3 MET A 276 -0.144 -4.748 11.168 1.00 0.00 H new ATOM 322 N GLN A 277 -2.020 -10.959 11.877 1.00 0.00 N ATOM 323 CA GLN A 277 -3.158 -11.815 11.562 1.00 0.00 C ATOM 324 C GLN A 277 -4.213 -11.047 10.772 1.00 0.00 C ATOM 325 O GLN A 277 -5.032 -11.641 10.070 1.00 0.00 O ATOM 326 CB GLN A 277 -3.772 -12.376 12.845 1.00 0.00 C ATOM 327 CG GLN A 277 -4.810 -13.459 12.599 1.00 0.00 C ATOM 328 CD GLN A 277 -5.433 -13.973 13.883 1.00 0.00 C ATOM 329 OE1 GLN A 277 -4.832 -13.890 14.954 1.00 0.00 O ATOM 330 NE2 GLN A 277 -6.644 -14.508 13.781 1.00 0.00 N ATOM 0 H GLN A 277 -1.791 -10.910 12.870 1.00 0.00 H new ATOM 0 HA GLN A 277 -2.800 -12.642 10.948 1.00 0.00 H new ATOM 0 HB2 GLN A 277 -2.977 -12.781 13.471 1.00 0.00 H new ATOM 0 HB3 GLN A 277 -4.234 -11.562 13.403 1.00 0.00 H new ATOM 0 HG2 GLN A 277 -5.594 -13.066 11.952 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -4.345 -14.289 12.068 1.00 0.00 H new ATOM 0 HE21 GLN A 277 -7.105 -14.556 12.873 1.00 0.00 H new ATOM 0 HE22 GLN A 277 -7.113 -14.871 14.611 1.00 0.00 H new ATOM 339 N PHE A 278 -4.188 -9.724 10.891 1.00 0.00 N ATOM 340 CA PHE A 278 -5.143 -8.875 10.189 1.00 0.00 C ATOM 341 C PHE A 278 -4.555 -8.364 8.877 1.00 0.00 C ATOM 342 O PHE A 278 -5.140 -8.544 7.810 1.00 0.00 O ATOM 343 CB PHE A 278 -5.553 -7.694 11.072 1.00 0.00 C ATOM 344 CG PHE A 278 -4.469 -7.240 12.006 1.00 0.00 C ATOM 345 CD1 PHE A 278 -4.178 -7.960 13.154 1.00 0.00 C ATOM 346 CD2 PHE A 278 -3.741 -6.092 11.738 1.00 0.00 C ATOM 347 CE1 PHE A 278 -3.180 -7.545 14.016 1.00 0.00 C ATOM 348 CE2 PHE A 278 -2.742 -5.672 12.596 1.00 0.00 C ATOM 349 CZ PHE A 278 -2.462 -6.398 13.737 1.00 0.00 C ATOM 0 H PHE A 278 -3.517 -9.216 11.467 1.00 0.00 H new ATOM 0 HA PHE A 278 -6.025 -9.474 9.962 1.00 0.00 H new ATOM 0 HB2 PHE A 278 -5.846 -6.859 10.435 1.00 0.00 H new ATOM 0 HB3 PHE A 278 -6.430 -7.974 11.655 1.00 0.00 H new ATOM 0 HD1 PHE A 278 -4.738 -8.856 13.378 1.00 0.00 H new ATOM 0 HD2 PHE A 278 -3.957 -5.519 10.848 1.00 0.00 H new ATOM 0 HE1 PHE A 278 -2.962 -8.116 14.906 1.00 0.00 H new ATOM 0 HE2 PHE A 278 -2.181 -4.776 12.374 1.00 0.00 H new ATOM 0 HZ PHE A 278 -1.683 -6.070 14.410 1.00 0.00 H new ATOM 359 N GLY A 279 -3.393 -7.724 8.966 1.00 0.00 N ATOM 360 CA GLY A 279 -2.745 -7.195 7.780 1.00 0.00 C ATOM 361 C GLY A 279 -1.234 -7.275 7.861 1.00 0.00 C ATOM 362 O GLY A 279 -0.688 -8.036 8.661 1.00 0.00 O ATOM 0 H GLY A 279 -2.889 -7.562 9.838 1.00 0.00 H new ATOM 0 HA2 GLY A 279 -3.089 -7.747 6.905 1.00 0.00 H new ATOM 0 HA3 GLY A 279 -3.044 -6.156 7.639 1.00 0.00 H new ATOM 366 N CYS A 280 -0.556 -6.490 7.031 1.00 0.00 N ATOM 367 CA CYS A 280 0.902 -6.477 7.010 1.00 0.00 C ATOM 368 C CYS A 280 1.432 -5.050 6.917 1.00 0.00 C ATOM 369 O CYS A 280 0.928 -4.238 6.142 1.00 0.00 O ATOM 370 CB CYS A 280 1.424 -7.305 5.834 1.00 0.00 C ATOM 371 SG CYS A 280 1.107 -6.567 4.214 1.00 0.00 S ATOM 0 H CYS A 280 -0.993 -5.854 6.364 1.00 0.00 H new ATOM 0 HA CYS A 280 1.258 -6.918 7.941 1.00 0.00 H new ATOM 0 HB2 CYS A 280 2.498 -7.448 5.952 1.00 0.00 H new ATOM 0 HB3 CYS A 280 0.965 -8.293 5.867 1.00 0.00 H new ATOM 0 HG CYS A 280 0.900 -5.291 4.351 1.00 0.00 H new ATOM 377 N PHE A 281 2.452 -4.750 7.715 1.00 0.00 N ATOM 378 CA PHE A 281 3.049 -3.420 7.726 1.00 0.00 C ATOM 379 C PHE A 281 4.053 -3.265 6.588 1.00 0.00 C ATOM 380 O PHE A 281 5.122 -3.877 6.601 1.00 0.00 O ATOM 381 CB PHE A 281 3.736 -3.157 9.067 1.00 0.00 C ATOM 382 CG PHE A 281 2.777 -3.015 10.215 1.00 0.00 C ATOM 383 CD1 PHE A 281 1.715 -2.129 10.142 1.00 0.00 C ATOM 384 CD2 PHE A 281 2.938 -3.769 11.366 1.00 0.00 C ATOM 385 CE1 PHE A 281 0.831 -1.997 11.196 1.00 0.00 C ATOM 386 CE2 PHE A 281 2.057 -3.642 12.423 1.00 0.00 C ATOM 387 CZ PHE A 281 1.002 -2.754 12.338 1.00 0.00 C ATOM 0 H PHE A 281 2.882 -5.410 8.362 1.00 0.00 H new ATOM 0 HA PHE A 281 2.252 -2.690 7.585 1.00 0.00 H new ATOM 0 HB2 PHE A 281 4.426 -3.974 9.279 1.00 0.00 H new ATOM 0 HB3 PHE A 281 4.333 -2.248 8.988 1.00 0.00 H new ATOM 0 HD1 PHE A 281 1.576 -1.534 9.251 1.00 0.00 H new ATOM 0 HD2 PHE A 281 3.762 -4.464 11.438 1.00 0.00 H new ATOM 0 HE1 PHE A 281 0.007 -1.302 11.126 1.00 0.00 H new ATOM 0 HE2 PHE A 281 2.193 -4.236 13.315 1.00 0.00 H new ATOM 0 HZ PHE A 281 0.313 -2.652 13.163 1.00 0.00 H new ATOM 397 N VAL A 282 3.702 -2.444 5.604 1.00 0.00 N ATOM 398 CA VAL A 282 4.572 -2.208 4.458 1.00 0.00 C ATOM 399 C VAL A 282 5.248 -0.845 4.552 1.00 0.00 C ATOM 400 O VAL A 282 4.579 0.186 4.630 1.00 0.00 O ATOM 401 CB VAL A 282 3.790 -2.290 3.133 1.00 0.00 C ATOM 402 CG1 VAL A 282 4.663 -1.847 1.969 1.00 0.00 C ATOM 403 CG2 VAL A 282 3.267 -3.701 2.911 1.00 0.00 C ATOM 0 H VAL A 282 2.821 -1.931 5.577 1.00 0.00 H new ATOM 0 HA VAL A 282 5.332 -2.989 4.472 1.00 0.00 H new ATOM 0 HB VAL A 282 2.936 -1.615 3.192 1.00 0.00 H new ATOM 0 HG11 VAL A 282 4.094 -1.912 1.042 1.00 0.00 H new ATOM 0 HG12 VAL A 282 4.984 -0.817 2.126 1.00 0.00 H new ATOM 0 HG13 VAL A 282 5.538 -2.494 1.903 1.00 0.00 H new ATOM 0 HG21 VAL A 282 2.717 -3.741 1.971 1.00 0.00 H new ATOM 0 HG22 VAL A 282 4.105 -4.397 2.872 1.00 0.00 H new ATOM 0 HG23 VAL A 282 2.604 -3.977 3.731 1.00 0.00 H new ATOM 413 N GLN A 283 6.577 -0.847 4.544 1.00 0.00 N ATOM 414 CA GLN A 283 7.343 0.390 4.629 1.00 0.00 C ATOM 415 C GLN A 283 7.709 0.901 3.239 1.00 0.00 C ATOM 416 O GLN A 283 8.373 0.209 2.467 1.00 0.00 O ATOM 417 CB GLN A 283 8.612 0.174 5.455 1.00 0.00 C ATOM 418 CG GLN A 283 9.418 1.443 5.678 1.00 0.00 C ATOM 419 CD GLN A 283 10.687 1.198 6.470 1.00 0.00 C ATOM 420 OE1 GLN A 283 11.272 0.116 6.408 1.00 0.00 O ATOM 421 NE2 GLN A 283 11.120 2.204 7.221 1.00 0.00 N ATOM 0 H GLN A 283 7.145 -1.692 4.480 1.00 0.00 H new ATOM 0 HA GLN A 283 6.721 1.139 5.120 1.00 0.00 H new ATOM 0 HB2 GLN A 283 8.338 -0.247 6.422 1.00 0.00 H new ATOM 0 HB3 GLN A 283 9.241 -0.562 4.954 1.00 0.00 H new ATOM 0 HG2 GLN A 283 9.675 1.879 4.713 1.00 0.00 H new ATOM 0 HG3 GLN A 283 8.802 2.172 6.203 1.00 0.00 H new ATOM 0 HE21 GLN A 283 10.604 3.083 7.242 1.00 0.00 H new ATOM 0 HE22 GLN A 283 11.969 2.097 7.776 1.00 0.00 H new ATOM 430 N LEU A 284 7.271 2.116 2.927 1.00 0.00 N ATOM 431 CA LEU A 284 7.552 2.720 1.629 1.00 0.00 C ATOM 432 C LEU A 284 9.036 3.040 1.487 1.00 0.00 C ATOM 433 O LEU A 284 9.753 3.153 2.480 1.00 0.00 O ATOM 434 CB LEU A 284 6.723 3.993 1.447 1.00 0.00 C ATOM 435 CG LEU A 284 5.206 3.824 1.531 1.00 0.00 C ATOM 436 CD1 LEU A 284 4.514 5.177 1.460 1.00 0.00 C ATOM 437 CD2 LEU A 284 4.709 2.910 0.420 1.00 0.00 C ATOM 0 H LEU A 284 6.720 2.702 3.555 1.00 0.00 H new ATOM 0 HA LEU A 284 7.279 2.003 0.855 1.00 0.00 H new ATOM 0 HB2 LEU A 284 7.031 4.714 2.204 1.00 0.00 H new ATOM 0 HB3 LEU A 284 6.967 4.426 0.477 1.00 0.00 H new ATOM 0 HG LEU A 284 4.963 3.364 2.489 1.00 0.00 H new ATOM 0 HD11 LEU A 284 3.435 5.037 1.521 1.00 0.00 H new ATOM 0 HD12 LEU A 284 4.847 5.800 2.290 1.00 0.00 H new ATOM 0 HD13 LEU A 284 4.764 5.664 0.518 1.00 0.00 H new ATOM 0 HD21 LEU A 284 3.627 2.801 0.495 1.00 0.00 H new ATOM 0 HD22 LEU A 284 4.964 3.342 -0.548 1.00 0.00 H new ATOM 0 HD23 LEU A 284 5.180 1.932 0.516 1.00 0.00 H new ATOM 449 N GLU A 285 9.489 3.188 0.246 1.00 0.00 N ATOM 450 CA GLU A 285 10.888 3.497 -0.025 1.00 0.00 C ATOM 451 C GLU A 285 11.008 4.661 -1.005 1.00 0.00 C ATOM 452 O GLU A 285 10.058 4.990 -1.714 1.00 0.00 O ATOM 453 CB GLU A 285 11.606 2.268 -0.585 1.00 0.00 C ATOM 454 CG GLU A 285 11.585 1.072 0.352 1.00 0.00 C ATOM 455 CD GLU A 285 12.527 1.235 1.529 1.00 0.00 C ATOM 456 OE1 GLU A 285 13.548 1.938 1.379 1.00 0.00 O ATOM 457 OE2 GLU A 285 12.242 0.660 2.600 1.00 0.00 O ATOM 0 H GLU A 285 8.908 3.099 -0.587 1.00 0.00 H new ATOM 0 HA GLU A 285 11.358 3.786 0.915 1.00 0.00 H new ATOM 0 HB2 GLU A 285 11.143 1.986 -1.531 1.00 0.00 H new ATOM 0 HB3 GLU A 285 12.641 2.530 -0.803 1.00 0.00 H new ATOM 0 HG2 GLU A 285 10.570 0.923 0.722 1.00 0.00 H new ATOM 0 HG3 GLU A 285 11.857 0.175 -0.204 1.00 0.00 H new ATOM 464 N GLY A 286 12.184 5.280 -1.038 1.00 0.00 N ATOM 465 CA GLY A 286 12.408 6.400 -1.933 1.00 0.00 C ATOM 466 C GLY A 286 12.157 7.737 -1.264 1.00 0.00 C ATOM 467 O GLY A 286 13.041 8.593 -1.218 1.00 0.00 O ATOM 0 H GLY A 286 12.986 5.026 -0.461 1.00 0.00 H new ATOM 0 HA2 GLY A 286 13.434 6.368 -2.300 1.00 0.00 H new ATOM 0 HA3 GLY A 286 11.756 6.303 -2.801 1.00 0.00 H new ATOM 471 N LEU A 287 10.948 7.918 -0.743 1.00 0.00 N ATOM 472 CA LEU A 287 10.581 9.161 -0.074 1.00 0.00 C ATOM 473 C LEU A 287 11.600 9.520 1.004 1.00 0.00 C ATOM 474 O LEU A 287 12.528 8.758 1.272 1.00 0.00 O ATOM 475 CB LEU A 287 9.188 9.039 0.545 1.00 0.00 C ATOM 476 CG LEU A 287 8.049 8.720 -0.423 1.00 0.00 C ATOM 477 CD1 LEU A 287 6.850 8.161 0.328 1.00 0.00 C ATOM 478 CD2 LEU A 287 7.656 9.960 -1.212 1.00 0.00 C ATOM 0 H LEU A 287 10.205 7.219 -0.771 1.00 0.00 H new ATOM 0 HA LEU A 287 10.571 9.957 -0.819 1.00 0.00 H new ATOM 0 HB2 LEU A 287 9.218 8.261 1.308 1.00 0.00 H new ATOM 0 HB3 LEU A 287 8.955 9.975 1.053 1.00 0.00 H new ATOM 0 HG LEU A 287 8.397 7.962 -1.125 1.00 0.00 H new ATOM 0 HD11 LEU A 287 6.049 7.940 -0.378 1.00 0.00 H new ATOM 0 HD12 LEU A 287 7.139 7.247 0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 287 6.501 8.895 1.054 1.00 0.00 H new ATOM 0 HD21 LEU A 287 6.844 9.714 -1.896 1.00 0.00 H new ATOM 0 HD22 LEU A 287 7.328 10.740 -0.525 1.00 0.00 H new ATOM 0 HD23 LEU A 287 8.514 10.316 -1.781 1.00 0.00 H new ATOM 490 N ARG A 288 11.417 10.684 1.619 1.00 0.00 N ATOM 491 CA ARG A 288 12.319 11.143 2.668 1.00 0.00 C ATOM 492 C ARG A 288 11.828 10.696 4.042 1.00 0.00 C ATOM 493 O ARG A 288 12.540 10.009 4.775 1.00 0.00 O ATOM 494 CB ARG A 288 12.445 12.667 2.631 1.00 0.00 C ATOM 495 CG ARG A 288 12.893 13.274 3.951 1.00 0.00 C ATOM 496 CD ARG A 288 14.191 12.649 4.439 1.00 0.00 C ATOM 497 NE ARG A 288 15.296 12.891 3.516 1.00 0.00 N ATOM 498 CZ ARG A 288 15.968 14.036 3.458 1.00 0.00 C ATOM 499 NH1 ARG A 288 15.648 15.038 4.265 1.00 0.00 N ATOM 500 NH2 ARG A 288 16.962 14.180 2.590 1.00 0.00 N ATOM 0 H ARG A 288 10.653 11.326 1.409 1.00 0.00 H new ATOM 0 HA ARG A 288 13.299 10.700 2.489 1.00 0.00 H new ATOM 0 HB2 ARG A 288 13.156 12.945 1.853 1.00 0.00 H new ATOM 0 HB3 ARG A 288 11.483 13.096 2.352 1.00 0.00 H new ATOM 0 HG2 ARG A 288 13.028 14.349 3.831 1.00 0.00 H new ATOM 0 HG3 ARG A 288 12.115 13.132 4.701 1.00 0.00 H new ATOM 0 HD2 ARG A 288 14.442 13.054 5.419 1.00 0.00 H new ATOM 0 HD3 ARG A 288 14.052 11.575 4.564 1.00 0.00 H new ATOM 0 HE ARG A 288 15.567 12.140 2.881 1.00 0.00 H new ATOM 0 HH11 ARG A 288 14.884 14.931 4.933 1.00 0.00 H new ATOM 0 HH12 ARG A 288 16.166 15.916 4.218 1.00 0.00 H new ATOM 0 HH21 ARG A 288 17.210 13.412 1.967 1.00 0.00 H new ATOM 0 HH22 ARG A 288 17.477 15.059 2.546 1.00 0.00 H new ATOM 514 N LYS A 289 10.606 11.091 4.385 1.00 0.00 N ATOM 515 CA LYS A 289 10.018 10.731 5.669 1.00 0.00 C ATOM 516 C LYS A 289 9.513 9.292 5.653 1.00 0.00 C ATOM 517 O LYS A 289 8.517 8.982 4.998 1.00 0.00 O ATOM 518 CB LYS A 289 8.869 11.683 6.012 1.00 0.00 C ATOM 519 CG LYS A 289 9.326 12.987 6.641 1.00 0.00 C ATOM 520 CD LYS A 289 8.147 13.839 7.078 1.00 0.00 C ATOM 521 CE LYS A 289 7.623 14.694 5.934 1.00 0.00 C ATOM 522 NZ LYS A 289 6.516 15.588 6.371 1.00 0.00 N ATOM 0 H LYS A 289 10.004 11.661 3.791 1.00 0.00 H new ATOM 0 HA LYS A 289 10.792 10.816 6.431 1.00 0.00 H new ATOM 0 HB2 LYS A 289 8.309 11.904 5.104 1.00 0.00 H new ATOM 0 HB3 LYS A 289 8.184 11.181 6.695 1.00 0.00 H new ATOM 0 HG2 LYS A 289 9.961 12.774 7.501 1.00 0.00 H new ATOM 0 HG3 LYS A 289 9.933 13.543 5.927 1.00 0.00 H new ATOM 0 HD2 LYS A 289 7.349 13.195 7.448 1.00 0.00 H new ATOM 0 HD3 LYS A 289 8.448 14.481 7.906 1.00 0.00 H new ATOM 0 HE2 LYS A 289 8.436 15.295 5.528 1.00 0.00 H new ATOM 0 HE3 LYS A 289 7.272 14.048 5.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 289 6.187 16.154 5.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 289 5.729 15.014 6.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 289 6.858 16.222 7.121 1.00 0.00 H new ATOM 536 N ARG A 290 10.204 8.419 6.377 1.00 0.00 N ATOM 537 CA ARG A 290 9.824 7.013 6.445 1.00 0.00 C ATOM 538 C ARG A 290 8.350 6.865 6.809 1.00 0.00 C ATOM 539 O ARG A 290 7.953 7.117 7.947 1.00 0.00 O ATOM 540 CB ARG A 290 10.690 6.278 7.470 1.00 0.00 C ATOM 541 CG ARG A 290 11.965 5.694 6.884 1.00 0.00 C ATOM 542 CD ARG A 290 13.111 6.692 6.938 1.00 0.00 C ATOM 543 NE ARG A 290 13.167 7.526 5.741 1.00 0.00 N ATOM 544 CZ ARG A 290 13.599 7.091 4.562 1.00 0.00 C ATOM 545 NH1 ARG A 290 14.009 5.838 4.424 1.00 0.00 N ATOM 546 NH2 ARG A 290 13.620 7.911 3.519 1.00 0.00 N ATOM 0 H ARG A 290 11.030 8.660 6.925 1.00 0.00 H new ATOM 0 HA ARG A 290 9.983 6.571 5.461 1.00 0.00 H new ATOM 0 HB2 ARG A 290 10.952 6.967 8.273 1.00 0.00 H new ATOM 0 HB3 ARG A 290 10.105 5.475 7.918 1.00 0.00 H new ATOM 0 HG2 ARG A 290 12.240 4.793 7.433 1.00 0.00 H new ATOM 0 HG3 ARG A 290 11.789 5.396 5.850 1.00 0.00 H new ATOM 0 HD2 ARG A 290 12.998 7.327 7.817 1.00 0.00 H new ATOM 0 HD3 ARG A 290 14.053 6.156 7.051 1.00 0.00 H new ATOM 0 HE ARG A 290 12.858 8.495 5.814 1.00 0.00 H new ATOM 0 HH11 ARG A 290 13.993 5.205 5.224 1.00 0.00 H new ATOM 0 HH12 ARG A 290 14.340 5.507 3.518 1.00 0.00 H new ATOM 0 HH21 ARG A 290 13.305 8.875 3.622 1.00 0.00 H new ATOM 0 HH22 ARG A 290 13.952 7.577 2.614 1.00 0.00 H new ATOM 560 N TRP A 291 7.544 6.456 5.836 1.00 0.00 N ATOM 561 CA TRP A 291 6.113 6.275 6.054 1.00 0.00 C ATOM 562 C TRP A 291 5.762 4.795 6.164 1.00 0.00 C ATOM 563 O TRP A 291 6.016 4.018 5.244 1.00 0.00 O ATOM 564 CB TRP A 291 5.318 6.917 4.915 1.00 0.00 C ATOM 565 CG TRP A 291 5.271 8.413 4.994 1.00 0.00 C ATOM 566 CD1 TRP A 291 5.639 9.296 4.021 1.00 0.00 C ATOM 567 CD2 TRP A 291 4.831 9.199 6.107 1.00 0.00 C ATOM 568 NE1 TRP A 291 5.455 10.585 4.461 1.00 0.00 N ATOM 569 CE2 TRP A 291 4.960 10.552 5.738 1.00 0.00 C ATOM 570 CE3 TRP A 291 4.339 8.891 7.378 1.00 0.00 C ATOM 571 CZ2 TRP A 291 4.615 11.593 6.596 1.00 0.00 C ATOM 572 CZ3 TRP A 291 3.998 9.926 8.229 1.00 0.00 C ATOM 573 CH2 TRP A 291 4.137 11.263 7.834 1.00 0.00 C ATOM 0 H TRP A 291 7.857 6.243 4.889 1.00 0.00 H new ATOM 0 HA TRP A 291 5.849 6.763 6.992 1.00 0.00 H new ATOM 0 HB2 TRP A 291 5.760 6.624 3.963 1.00 0.00 H new ATOM 0 HB3 TRP A 291 4.300 6.527 4.927 1.00 0.00 H new ATOM 0 HD1 TRP A 291 6.019 9.022 3.048 1.00 0.00 H new ATOM 0 HE1 TRP A 291 5.655 11.429 3.924 1.00 0.00 H new ATOM 0 HE3 TRP A 291 4.227 7.863 7.690 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 4.721 12.625 6.294 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 3.618 9.700 9.214 1.00 0.00 H new ATOM 0 HH2 TRP A 291 3.861 12.049 8.521 1.00 0.00 H new ATOM 584 N GLU A 292 5.178 4.413 7.295 1.00 0.00 N ATOM 585 CA GLU A 292 4.793 3.025 7.524 1.00 0.00 C ATOM 586 C GLU A 292 3.279 2.858 7.435 1.00 0.00 C ATOM 587 O GLU A 292 2.532 3.430 8.229 1.00 0.00 O ATOM 588 CB GLU A 292 5.289 2.554 8.893 1.00 0.00 C ATOM 589 CG GLU A 292 4.638 1.266 9.366 1.00 0.00 C ATOM 590 CD GLU A 292 3.368 1.510 10.158 1.00 0.00 C ATOM 591 OE1 GLU A 292 3.392 2.366 11.068 1.00 0.00 O ATOM 592 OE2 GLU A 292 2.350 0.847 9.868 1.00 0.00 O ATOM 0 H GLU A 292 4.961 5.044 8.066 1.00 0.00 H new ATOM 0 HA GLU A 292 5.255 2.414 6.748 1.00 0.00 H new ATOM 0 HB2 GLU A 292 6.369 2.411 8.849 1.00 0.00 H new ATOM 0 HB3 GLU A 292 5.101 3.337 9.627 1.00 0.00 H new ATOM 0 HG2 GLU A 292 4.409 0.641 8.503 1.00 0.00 H new ATOM 0 HG3 GLU A 292 5.345 0.711 9.983 1.00 0.00 H new ATOM 599 N GLY A 293 2.832 2.071 6.461 1.00 0.00 N ATOM 600 CA GLY A 293 1.410 1.843 6.285 1.00 0.00 C ATOM 601 C GLY A 293 1.009 0.413 6.590 1.00 0.00 C ATOM 602 O GLY A 293 1.859 -0.475 6.665 1.00 0.00 O ATOM 0 H GLY A 293 3.430 1.587 5.791 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.854 2.519 6.934 1.00 0.00 H new ATOM 0 HA3 GLY A 293 1.131 2.084 5.259 1.00 0.00 H new ATOM 606 N LEU A 294 -0.288 0.190 6.770 1.00 0.00 N ATOM 607 CA LEU A 294 -0.800 -1.142 7.072 1.00 0.00 C ATOM 608 C LEU A 294 -1.772 -1.609 5.993 1.00 0.00 C ATOM 609 O LEU A 294 -2.634 -0.850 5.548 1.00 0.00 O ATOM 610 CB LEU A 294 -1.493 -1.147 8.436 1.00 0.00 C ATOM 611 CG LEU A 294 -2.468 -2.297 8.689 1.00 0.00 C ATOM 612 CD1 LEU A 294 -1.714 -3.601 8.897 1.00 0.00 C ATOM 613 CD2 LEU A 294 -3.352 -1.993 9.890 1.00 0.00 C ATOM 0 H LEU A 294 -1.004 0.914 6.712 1.00 0.00 H new ATOM 0 HA LEU A 294 0.044 -1.831 7.098 1.00 0.00 H new ATOM 0 HB2 LEU A 294 -0.726 -1.170 9.211 1.00 0.00 H new ATOM 0 HB3 LEU A 294 -2.033 -0.207 8.550 1.00 0.00 H new ATOM 0 HG LEU A 294 -3.106 -2.406 7.812 1.00 0.00 H new ATOM 0 HD11 LEU A 294 -2.425 -4.408 9.076 1.00 0.00 H new ATOM 0 HD12 LEU A 294 -1.125 -3.827 8.008 1.00 0.00 H new ATOM 0 HD13 LEU A 294 -1.051 -3.505 9.757 1.00 0.00 H new ATOM 0 HD21 LEU A 294 -4.040 -2.823 10.055 1.00 0.00 H new ATOM 0 HD22 LEU A 294 -2.730 -1.856 10.774 1.00 0.00 H new ATOM 0 HD23 LEU A 294 -3.921 -1.082 9.702 1.00 0.00 H new ATOM 625 N VAL A 295 -1.630 -2.864 5.578 1.00 0.00 N ATOM 626 CA VAL A 295 -2.498 -3.433 4.554 1.00 0.00 C ATOM 627 C VAL A 295 -3.431 -4.483 5.146 1.00 0.00 C ATOM 628 O VAL A 295 -3.008 -5.592 5.472 1.00 0.00 O ATOM 629 CB VAL A 295 -1.679 -4.073 3.417 1.00 0.00 C ATOM 630 CG1 VAL A 295 -2.584 -4.448 2.253 1.00 0.00 C ATOM 631 CG2 VAL A 295 -0.573 -3.132 2.962 1.00 0.00 C ATOM 0 H VAL A 295 -0.922 -3.506 5.935 1.00 0.00 H new ATOM 0 HA VAL A 295 -3.090 -2.612 4.149 1.00 0.00 H new ATOM 0 HB VAL A 295 -1.216 -4.985 3.795 1.00 0.00 H new ATOM 0 HG11 VAL A 295 -1.988 -4.899 1.459 1.00 0.00 H new ATOM 0 HG12 VAL A 295 -3.336 -5.161 2.592 1.00 0.00 H new ATOM 0 HG13 VAL A 295 -3.077 -3.553 1.873 1.00 0.00 H new ATOM 0 HG21 VAL A 295 -0.005 -3.600 2.158 1.00 0.00 H new ATOM 0 HG22 VAL A 295 -1.012 -2.202 2.601 1.00 0.00 H new ATOM 0 HG23 VAL A 295 0.091 -2.919 3.800 1.00 0.00 H new ATOM 641 N HIS A 296 -4.704 -4.125 5.282 1.00 0.00 N ATOM 642 CA HIS A 296 -5.699 -5.037 5.835 1.00 0.00 C ATOM 643 C HIS A 296 -5.787 -6.314 5.004 1.00 0.00 C ATOM 644 O HIS A 296 -5.306 -6.363 3.871 1.00 0.00 O ATOM 645 CB HIS A 296 -7.068 -4.358 5.893 1.00 0.00 C ATOM 646 CG HIS A 296 -8.038 -5.043 6.805 1.00 0.00 C ATOM 647 ND1 HIS A 296 -9.266 -5.509 6.384 1.00 0.00 N ATOM 648 CD2 HIS A 296 -7.955 -5.342 8.123 1.00 0.00 C ATOM 649 CE1 HIS A 296 -9.897 -6.063 7.404 1.00 0.00 C ATOM 650 NE2 HIS A 296 -9.123 -5.975 8.471 1.00 0.00 N ATOM 0 H HIS A 296 -5.071 -3.211 5.017 1.00 0.00 H new ATOM 0 HA HIS A 296 -5.390 -5.302 6.846 1.00 0.00 H new ATOM 0 HB2 HIS A 296 -6.939 -3.327 6.222 1.00 0.00 H new ATOM 0 HB3 HIS A 296 -7.490 -4.322 4.888 1.00 0.00 H new ATOM 0 HD2 HIS A 296 -7.125 -5.123 8.778 1.00 0.00 H new ATOM 0 HE1 HIS A 296 -10.879 -6.512 7.371 1.00 0.00 H new ATOM 0 HE2 HIS A 296 -9.355 -6.321 9.402 1.00 0.00 H new ATOM 658 N ILE A 297 -6.403 -7.344 5.573 1.00 0.00 N ATOM 659 CA ILE A 297 -6.554 -8.620 4.885 1.00 0.00 C ATOM 660 C ILE A 297 -7.431 -8.475 3.646 1.00 0.00 C ATOM 661 O ILE A 297 -7.404 -9.321 2.752 1.00 0.00 O ATOM 662 CB ILE A 297 -7.163 -9.690 5.809 1.00 0.00 C ATOM 663 CG1 ILE A 297 -7.302 -11.019 5.064 1.00 0.00 C ATOM 664 CG2 ILE A 297 -8.513 -9.228 6.337 1.00 0.00 C ATOM 665 CD1 ILE A 297 -7.430 -12.215 5.981 1.00 0.00 C ATOM 0 H ILE A 297 -6.806 -7.320 6.510 1.00 0.00 H new ATOM 0 HA ILE A 297 -5.555 -8.937 4.586 1.00 0.00 H new ATOM 0 HB ILE A 297 -6.495 -9.839 6.657 1.00 0.00 H new ATOM 0 HG12 ILE A 297 -8.177 -10.973 4.416 1.00 0.00 H new ATOM 0 HG13 ILE A 297 -6.434 -11.157 4.419 1.00 0.00 H new ATOM 0 HG21 ILE A 297 -8.931 -9.995 6.989 1.00 0.00 H new ATOM 0 HG22 ILE A 297 -8.386 -8.303 6.900 1.00 0.00 H new ATOM 0 HG23 ILE A 297 -9.190 -9.054 5.501 1.00 0.00 H new ATOM 0 HD11 ILE A 297 -7.525 -13.122 5.384 1.00 0.00 H new ATOM 0 HD12 ILE A 297 -6.544 -12.286 6.612 1.00 0.00 H new ATOM 0 HD13 ILE A 297 -8.314 -12.099 6.609 1.00 0.00 H new ATOM 677 N SER A 298 -8.207 -7.398 3.599 1.00 0.00 N ATOM 678 CA SER A 298 -9.095 -7.143 2.471 1.00 0.00 C ATOM 679 C SER A 298 -8.308 -6.645 1.262 1.00 0.00 C ATOM 680 O SER A 298 -8.747 -6.787 0.122 1.00 0.00 O ATOM 681 CB SER A 298 -10.163 -6.117 2.856 1.00 0.00 C ATOM 682 OG SER A 298 -11.258 -6.159 1.957 1.00 0.00 O ATOM 0 H SER A 298 -8.239 -6.687 4.330 1.00 0.00 H new ATOM 0 HA SER A 298 -9.582 -8.081 2.205 1.00 0.00 H new ATOM 0 HB2 SER A 298 -10.513 -6.314 3.869 1.00 0.00 H new ATOM 0 HB3 SER A 298 -9.728 -5.118 2.858 1.00 0.00 H new ATOM 0 HG SER A 298 -11.927 -5.495 2.225 1.00 0.00 H new ATOM 688 N GLU A 299 -7.142 -6.062 1.523 1.00 0.00 N ATOM 689 CA GLU A 299 -6.294 -5.542 0.457 1.00 0.00 C ATOM 690 C GLU A 299 -5.197 -6.540 0.098 1.00 0.00 C ATOM 691 O GLU A 299 -4.025 -6.179 -0.014 1.00 0.00 O ATOM 692 CB GLU A 299 -5.669 -4.209 0.876 1.00 0.00 C ATOM 693 CG GLU A 299 -6.645 -3.045 0.853 1.00 0.00 C ATOM 694 CD GLU A 299 -6.953 -2.569 -0.554 1.00 0.00 C ATOM 695 OE1 GLU A 299 -6.888 -3.397 -1.487 1.00 0.00 O ATOM 696 OE2 GLU A 299 -7.258 -1.370 -0.721 1.00 0.00 O ATOM 0 H GLU A 299 -6.764 -5.938 2.462 1.00 0.00 H new ATOM 0 HA GLU A 299 -6.918 -5.382 -0.423 1.00 0.00 H new ATOM 0 HB2 GLU A 299 -5.260 -4.309 1.881 1.00 0.00 H new ATOM 0 HB3 GLU A 299 -4.834 -3.985 0.213 1.00 0.00 H new ATOM 0 HG2 GLU A 299 -7.572 -3.343 1.343 1.00 0.00 H new ATOM 0 HG3 GLU A 299 -6.232 -2.218 1.430 1.00 0.00 H new ATOM 703 N LEU A 300 -5.585 -7.798 -0.080 1.00 0.00 N ATOM 704 CA LEU A 300 -4.636 -8.851 -0.425 1.00 0.00 C ATOM 705 C LEU A 300 -5.164 -9.706 -1.571 1.00 0.00 C ATOM 706 O LEU A 300 -4.523 -9.827 -2.615 1.00 0.00 O ATOM 707 CB LEU A 300 -4.354 -9.730 0.795 1.00 0.00 C ATOM 708 CG LEU A 300 -3.915 -8.997 2.064 1.00 0.00 C ATOM 709 CD1 LEU A 300 -3.813 -9.967 3.231 1.00 0.00 C ATOM 710 CD2 LEU A 300 -2.588 -8.288 1.838 1.00 0.00 C ATOM 0 H LEU A 300 -6.551 -8.114 0.009 1.00 0.00 H new ATOM 0 HA LEU A 300 -3.708 -8.379 -0.747 1.00 0.00 H new ATOM 0 HB2 LEU A 300 -5.254 -10.301 1.022 1.00 0.00 H new ATOM 0 HB3 LEU A 300 -3.579 -10.449 0.528 1.00 0.00 H new ATOM 0 HG LEU A 300 -4.667 -8.246 2.307 1.00 0.00 H new ATOM 0 HD11 LEU A 300 -3.500 -9.429 4.125 1.00 0.00 H new ATOM 0 HD12 LEU A 300 -4.785 -10.428 3.407 1.00 0.00 H new ATOM 0 HD13 LEU A 300 -3.081 -10.741 2.998 1.00 0.00 H new ATOM 0 HD21 LEU A 300 -2.291 -7.772 2.751 1.00 0.00 H new ATOM 0 HD22 LEU A 300 -1.826 -9.020 1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 300 -2.695 -7.564 1.030 1.00 0.00 H new ATOM 856 N VAL A 309 -2.812 -13.934 6.426 1.00 0.00 N ATOM 857 CA VAL A 309 -1.805 -13.105 5.773 1.00 0.00 C ATOM 858 C VAL A 309 -0.444 -13.791 5.772 1.00 0.00 C ATOM 859 O VAL A 309 0.295 -13.725 4.791 1.00 0.00 O ATOM 860 CB VAL A 309 -1.676 -11.733 6.461 1.00 0.00 C ATOM 861 CG1 VAL A 309 -0.978 -10.740 5.545 1.00 0.00 C ATOM 862 CG2 VAL A 309 -3.044 -11.216 6.878 1.00 0.00 C ATOM 0 HA VAL A 309 -2.135 -12.958 4.744 1.00 0.00 H new ATOM 0 HB VAL A 309 -1.069 -11.851 7.358 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -0.896 -9.776 6.048 1.00 0.00 H new ATOM 0 HG12 VAL A 309 0.019 -11.108 5.301 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -1.556 -10.623 4.628 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -2.934 -10.246 7.362 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -3.678 -11.112 5.997 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -3.502 -11.919 7.574 1.00 0.00 H new ATOM 872 N ALA A 310 -0.120 -14.451 6.880 1.00 0.00 N ATOM 873 CA ALA A 310 1.152 -15.153 7.006 1.00 0.00 C ATOM 874 C ALA A 310 1.551 -15.808 5.688 1.00 0.00 C ATOM 875 O ALA A 310 2.631 -15.549 5.157 1.00 0.00 O ATOM 876 CB ALA A 310 1.072 -16.194 8.113 1.00 0.00 C ATOM 0 H ALA A 310 -0.720 -14.514 7.702 1.00 0.00 H new ATOM 0 HA ALA A 310 1.918 -14.422 7.264 1.00 0.00 H new ATOM 0 HB1 ALA A 310 2.028 -16.711 8.196 1.00 0.00 H new ATOM 0 HB2 ALA A 310 0.841 -15.703 9.058 1.00 0.00 H new ATOM 0 HB3 ALA A 310 0.289 -16.915 7.878 1.00 0.00 H new ATOM 882 N ASP A 311 0.673 -16.658 5.166 1.00 0.00 N ATOM 883 CA ASP A 311 0.934 -17.351 3.910 1.00 0.00 C ATOM 884 C ASP A 311 0.829 -16.391 2.729 1.00 0.00 C ATOM 885 O ASP A 311 1.401 -16.634 1.666 1.00 0.00 O ATOM 886 CB ASP A 311 -0.046 -18.511 3.729 1.00 0.00 C ATOM 887 CG ASP A 311 0.444 -19.789 4.380 1.00 0.00 C ATOM 888 OD1 ASP A 311 1.629 -20.137 4.189 1.00 0.00 O ATOM 889 OD2 ASP A 311 -0.356 -20.442 5.082 1.00 0.00 O ATOM 0 H ASP A 311 -0.225 -16.883 5.593 1.00 0.00 H new ATOM 0 HA ASP A 311 1.949 -17.746 3.945 1.00 0.00 H new ATOM 0 HB2 ASP A 311 -1.011 -18.237 4.154 1.00 0.00 H new ATOM 0 HB3 ASP A 311 -0.205 -18.686 2.665 1.00 0.00 H new ATOM 894 N VAL A 312 0.093 -15.302 2.921 1.00 0.00 N ATOM 895 CA VAL A 312 -0.088 -14.305 1.872 1.00 0.00 C ATOM 896 C VAL A 312 1.208 -13.548 1.604 1.00 0.00 C ATOM 897 O VAL A 312 1.753 -13.600 0.502 1.00 0.00 O ATOM 898 CB VAL A 312 -1.192 -13.296 2.240 1.00 0.00 C ATOM 899 CG1 VAL A 312 -1.329 -12.236 1.158 1.00 0.00 C ATOM 900 CG2 VAL A 312 -2.514 -14.014 2.466 1.00 0.00 C ATOM 0 H VAL A 312 -0.388 -15.087 3.794 1.00 0.00 H new ATOM 0 HA VAL A 312 -0.384 -14.844 0.972 1.00 0.00 H new ATOM 0 HB VAL A 312 -0.911 -12.798 3.168 1.00 0.00 H new ATOM 0 HG11 VAL A 312 -2.114 -11.532 1.435 1.00 0.00 H new ATOM 0 HG12 VAL A 312 -0.385 -11.703 1.050 1.00 0.00 H new ATOM 0 HG13 VAL A 312 -1.587 -12.713 0.212 1.00 0.00 H new ATOM 0 HG21 VAL A 312 -3.283 -13.287 2.725 1.00 0.00 H new ATOM 0 HG22 VAL A 312 -2.803 -14.539 1.556 1.00 0.00 H new ATOM 0 HG23 VAL A 312 -2.404 -14.731 3.279 1.00 0.00 H new ATOM 910 N VAL A 313 1.698 -12.846 2.621 1.00 0.00 N ATOM 911 CA VAL A 313 2.932 -12.079 2.496 1.00 0.00 C ATOM 912 C VAL A 313 4.020 -12.638 3.405 1.00 0.00 C ATOM 913 O VAL A 313 3.736 -13.361 4.360 1.00 0.00 O ATOM 914 CB VAL A 313 2.706 -10.594 2.837 1.00 0.00 C ATOM 915 CG1 VAL A 313 1.765 -9.951 1.829 1.00 0.00 C ATOM 916 CG2 VAL A 313 2.165 -10.448 4.252 1.00 0.00 C ATOM 0 H VAL A 313 1.259 -12.793 3.540 1.00 0.00 H new ATOM 0 HA VAL A 313 3.253 -12.161 1.457 1.00 0.00 H new ATOM 0 HB VAL A 313 3.665 -10.078 2.784 1.00 0.00 H new ATOM 0 HG11 VAL A 313 1.618 -8.902 2.087 1.00 0.00 H new ATOM 0 HG12 VAL A 313 2.197 -10.022 0.831 1.00 0.00 H new ATOM 0 HG13 VAL A 313 0.805 -10.467 1.846 1.00 0.00 H new ATOM 0 HG21 VAL A 313 2.011 -9.392 4.476 1.00 0.00 H new ATOM 0 HG22 VAL A 313 1.216 -10.978 4.335 1.00 0.00 H new ATOM 0 HG23 VAL A 313 2.879 -10.869 4.960 1.00 0.00 H new ATOM 926 N SER A 314 5.269 -12.297 3.103 1.00 0.00 N ATOM 927 CA SER A 314 6.402 -12.767 3.891 1.00 0.00 C ATOM 928 C SER A 314 6.988 -11.635 4.729 1.00 0.00 C ATOM 929 O SER A 314 6.536 -10.492 4.654 1.00 0.00 O ATOM 930 CB SER A 314 7.480 -13.349 2.975 1.00 0.00 C ATOM 931 OG SER A 314 7.126 -14.648 2.531 1.00 0.00 O ATOM 0 H SER A 314 5.522 -11.697 2.318 1.00 0.00 H new ATOM 0 HA SER A 314 6.046 -13.547 4.564 1.00 0.00 H new ATOM 0 HB2 SER A 314 7.624 -12.694 2.116 1.00 0.00 H new ATOM 0 HB3 SER A 314 8.430 -13.390 3.507 1.00 0.00 H new ATOM 0 HG SER A 314 7.830 -14.997 1.946 1.00 0.00 H new ATOM 937 N LYS A 315 7.998 -11.961 5.529 1.00 0.00 N ATOM 938 CA LYS A 315 8.649 -10.974 6.382 1.00 0.00 C ATOM 939 C LYS A 315 9.863 -10.369 5.685 1.00 0.00 C ATOM 940 O LYS A 315 10.809 -11.076 5.339 1.00 0.00 O ATOM 941 CB LYS A 315 9.073 -11.614 7.706 1.00 0.00 C ATOM 942 CG LYS A 315 9.153 -10.629 8.859 1.00 0.00 C ATOM 943 CD LYS A 315 9.661 -11.296 10.127 1.00 0.00 C ATOM 944 CE LYS A 315 9.485 -10.394 11.339 1.00 0.00 C ATOM 945 NZ LYS A 315 8.061 -10.314 11.769 1.00 0.00 N ATOM 0 H LYS A 315 8.384 -12.902 5.604 1.00 0.00 H new ATOM 0 HA LYS A 315 7.934 -10.177 6.584 1.00 0.00 H new ATOM 0 HB2 LYS A 315 8.366 -12.403 7.962 1.00 0.00 H new ATOM 0 HB3 LYS A 315 10.046 -12.088 7.576 1.00 0.00 H new ATOM 0 HG2 LYS A 315 9.814 -9.805 8.590 1.00 0.00 H new ATOM 0 HG3 LYS A 315 8.168 -10.200 9.042 1.00 0.00 H new ATOM 0 HD2 LYS A 315 9.125 -12.232 10.287 1.00 0.00 H new ATOM 0 HD3 LYS A 315 10.715 -11.548 10.010 1.00 0.00 H new ATOM 0 HE2 LYS A 315 10.092 -10.770 12.162 1.00 0.00 H new ATOM 0 HE3 LYS A 315 9.850 -9.394 11.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 7.808 -9.321 11.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 7.450 -10.697 11.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 7.930 -10.868 12.639 1.00 0.00 H new ATOM 959 N GLY A 316 9.831 -9.055 5.484 1.00 0.00 N ATOM 960 CA GLY A 316 10.935 -8.377 4.831 1.00 0.00 C ATOM 961 C GLY A 316 10.969 -8.630 3.336 1.00 0.00 C ATOM 962 O GLY A 316 12.038 -8.646 2.728 1.00 0.00 O ATOM 0 H GLY A 316 9.060 -8.448 5.762 1.00 0.00 H new ATOM 0 HA2 GLY A 316 10.858 -7.305 5.013 1.00 0.00 H new ATOM 0 HA3 GLY A 316 11.874 -8.709 5.274 1.00 0.00 H new ATOM 966 N GLN A 317 9.795 -8.830 2.745 1.00 0.00 N ATOM 967 CA GLN A 317 9.696 -9.086 1.313 1.00 0.00 C ATOM 968 C GLN A 317 9.293 -7.822 0.561 1.00 0.00 C ATOM 969 O GLN A 317 8.442 -7.060 1.019 1.00 0.00 O ATOM 970 CB GLN A 317 8.683 -10.200 1.042 1.00 0.00 C ATOM 971 CG GLN A 317 8.375 -10.396 -0.434 1.00 0.00 C ATOM 972 CD GLN A 317 7.223 -11.353 -0.667 1.00 0.00 C ATOM 973 OE1 GLN A 317 7.379 -12.570 -0.557 1.00 0.00 O ATOM 974 NE2 GLN A 317 6.056 -10.808 -0.991 1.00 0.00 N ATOM 0 H GLN A 317 8.901 -8.820 3.235 1.00 0.00 H new ATOM 0 HA GLN A 317 10.677 -9.402 0.957 1.00 0.00 H new ATOM 0 HB2 GLN A 317 9.065 -11.135 1.452 1.00 0.00 H new ATOM 0 HB3 GLN A 317 7.757 -9.974 1.571 1.00 0.00 H new ATOM 0 HG2 GLN A 317 8.138 -9.432 -0.883 1.00 0.00 H new ATOM 0 HG3 GLN A 317 9.264 -10.773 -0.940 1.00 0.00 H new ATOM 0 HE21 GLN A 317 5.971 -9.795 -1.071 1.00 0.00 H new ATOM 0 HE22 GLN A 317 5.245 -11.403 -1.159 1.00 0.00 H new ATOM 983 N ARG A 318 9.910 -7.606 -0.596 1.00 0.00 N ATOM 984 CA ARG A 318 9.617 -6.433 -1.411 1.00 0.00 C ATOM 985 C ARG A 318 8.216 -6.524 -2.010 1.00 0.00 C ATOM 986 O ARG A 318 7.930 -7.411 -2.814 1.00 0.00 O ATOM 987 CB ARG A 318 10.653 -6.290 -2.528 1.00 0.00 C ATOM 988 CG ARG A 318 12.082 -6.177 -2.022 1.00 0.00 C ATOM 989 CD ARG A 318 13.077 -6.137 -3.171 1.00 0.00 C ATOM 990 NE ARG A 318 13.405 -7.475 -3.657 1.00 0.00 N ATOM 991 CZ ARG A 318 14.134 -8.348 -2.971 1.00 0.00 C ATOM 992 NH1 ARG A 318 14.607 -8.027 -1.775 1.00 0.00 N ATOM 993 NH2 ARG A 318 14.389 -9.546 -3.481 1.00 0.00 N ATOM 0 H ARG A 318 10.616 -8.228 -0.990 1.00 0.00 H new ATOM 0 HA ARG A 318 9.662 -5.554 -0.768 1.00 0.00 H new ATOM 0 HB2 ARG A 318 10.579 -7.150 -3.193 1.00 0.00 H new ATOM 0 HB3 ARG A 318 10.416 -5.407 -3.121 1.00 0.00 H new ATOM 0 HG2 ARG A 318 12.185 -5.276 -1.418 1.00 0.00 H new ATOM 0 HG3 ARG A 318 12.308 -7.023 -1.373 1.00 0.00 H new ATOM 0 HD2 ARG A 318 12.664 -5.546 -3.988 1.00 0.00 H new ATOM 0 HD3 ARG A 318 13.988 -5.636 -2.844 1.00 0.00 H new ATOM 0 HE ARG A 318 13.055 -7.754 -4.573 1.00 0.00 H new ATOM 0 HH11 ARG A 318 14.411 -7.108 -1.379 1.00 0.00 H new ATOM 0 HH12 ARG A 318 15.167 -8.700 -1.251 1.00 0.00 H new ATOM 0 HH21 ARG A 318 14.025 -9.797 -4.400 1.00 0.00 H new ATOM 0 HH22 ARG A 318 14.949 -10.216 -2.954 1.00 0.00 H new ATOM 1007 N VAL A 319 7.347 -5.600 -1.612 1.00 0.00 N ATOM 1008 CA VAL A 319 5.977 -5.575 -2.110 1.00 0.00 C ATOM 1009 C VAL A 319 5.618 -4.201 -2.663 1.00 0.00 C ATOM 1010 O VAL A 319 6.048 -3.175 -2.136 1.00 0.00 O ATOM 1011 CB VAL A 319 4.972 -5.950 -1.004 1.00 0.00 C ATOM 1012 CG1 VAL A 319 5.098 -7.422 -0.644 1.00 0.00 C ATOM 1013 CG2 VAL A 319 5.177 -5.072 0.221 1.00 0.00 C ATOM 0 H VAL A 319 7.568 -4.859 -0.946 1.00 0.00 H new ATOM 0 HA VAL A 319 5.917 -6.312 -2.911 1.00 0.00 H new ATOM 0 HB VAL A 319 3.963 -5.779 -1.380 1.00 0.00 H new ATOM 0 HG11 VAL A 319 4.380 -7.668 0.139 1.00 0.00 H new ATOM 0 HG12 VAL A 319 4.896 -8.031 -1.525 1.00 0.00 H new ATOM 0 HG13 VAL A 319 6.108 -7.624 -0.287 1.00 0.00 H new ATOM 0 HG21 VAL A 319 4.459 -5.350 0.992 1.00 0.00 H new ATOM 0 HG22 VAL A 319 6.189 -5.209 0.601 1.00 0.00 H new ATOM 0 HG23 VAL A 319 5.030 -4.027 -0.052 1.00 0.00 H new ATOM 1023 N LYS A 320 4.827 -4.187 -3.731 1.00 0.00 N ATOM 1024 CA LYS A 320 4.407 -2.939 -4.357 1.00 0.00 C ATOM 1025 C LYS A 320 3.020 -2.527 -3.874 1.00 0.00 C ATOM 1026 O LYS A 320 2.077 -3.317 -3.917 1.00 0.00 O ATOM 1027 CB LYS A 320 4.406 -3.083 -5.880 1.00 0.00 C ATOM 1028 CG LYS A 320 5.783 -3.345 -6.467 1.00 0.00 C ATOM 1029 CD LYS A 320 5.858 -2.919 -7.923 1.00 0.00 C ATOM 1030 CE LYS A 320 5.716 -1.412 -8.071 1.00 0.00 C ATOM 1031 NZ LYS A 320 6.394 -0.908 -9.297 1.00 0.00 N ATOM 0 H LYS A 320 4.464 -5.027 -4.181 1.00 0.00 H new ATOM 0 HA LYS A 320 5.117 -2.163 -4.072 1.00 0.00 H new ATOM 0 HB2 LYS A 320 3.740 -3.899 -6.159 1.00 0.00 H new ATOM 0 HB3 LYS A 320 3.999 -2.174 -6.322 1.00 0.00 H new ATOM 0 HG2 LYS A 320 6.534 -2.806 -5.890 1.00 0.00 H new ATOM 0 HG3 LYS A 320 6.019 -4.406 -6.385 1.00 0.00 H new ATOM 0 HD2 LYS A 320 6.809 -3.239 -8.348 1.00 0.00 H new ATOM 0 HD3 LYS A 320 5.071 -3.417 -8.490 1.00 0.00 H new ATOM 0 HE2 LYS A 320 4.659 -1.149 -8.107 1.00 0.00 H new ATOM 0 HE3 LYS A 320 6.138 -0.920 -7.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 320 5.888 -0.073 -9.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 320 7.374 -0.647 -9.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 320 6.394 -1.652 -10.024 1.00 0.00 H new ATOM 1045 N VAL A 321 2.902 -1.285 -3.415 1.00 0.00 N ATOM 1046 CA VAL A 321 1.629 -0.768 -2.927 1.00 0.00 C ATOM 1047 C VAL A 321 1.347 0.620 -3.491 1.00 0.00 C ATOM 1048 O VAL A 321 2.227 1.258 -4.069 1.00 0.00 O ATOM 1049 CB VAL A 321 1.605 -0.699 -1.388 1.00 0.00 C ATOM 1050 CG1 VAL A 321 1.679 -2.095 -0.789 1.00 0.00 C ATOM 1051 CG2 VAL A 321 2.743 0.171 -0.876 1.00 0.00 C ATOM 0 H VAL A 321 3.673 -0.618 -3.371 1.00 0.00 H new ATOM 0 HA VAL A 321 0.856 -1.458 -3.265 1.00 0.00 H new ATOM 0 HB VAL A 321 0.664 -0.246 -1.077 1.00 0.00 H new ATOM 0 HG11 VAL A 321 1.661 -2.026 0.299 1.00 0.00 H new ATOM 0 HG12 VAL A 321 0.826 -2.683 -1.129 1.00 0.00 H new ATOM 0 HG13 VAL A 321 2.603 -2.579 -1.106 1.00 0.00 H new ATOM 0 HG21 VAL A 321 2.711 0.209 0.213 1.00 0.00 H new ATOM 0 HG22 VAL A 321 3.696 -0.250 -1.196 1.00 0.00 H new ATOM 0 HG23 VAL A 321 2.639 1.179 -1.277 1.00 0.00 H new ATOM 1061 N LYS A 322 0.113 1.082 -3.321 1.00 0.00 N ATOM 1062 CA LYS A 322 -0.287 2.395 -3.812 1.00 0.00 C ATOM 1063 C LYS A 322 -0.829 3.258 -2.676 1.00 0.00 C ATOM 1064 O LYS A 322 -1.458 2.754 -1.746 1.00 0.00 O ATOM 1065 CB LYS A 322 -1.346 2.252 -4.907 1.00 0.00 C ATOM 1066 CG LYS A 322 -1.663 3.555 -5.620 1.00 0.00 C ATOM 1067 CD LYS A 322 -2.467 3.316 -6.888 1.00 0.00 C ATOM 1068 CE LYS A 322 -3.894 2.896 -6.571 1.00 0.00 C ATOM 1069 NZ LYS A 322 -4.520 2.161 -7.705 1.00 0.00 N ATOM 0 H LYS A 322 -0.628 0.566 -2.846 1.00 0.00 H new ATOM 0 HA LYS A 322 0.594 2.884 -4.229 1.00 0.00 H new ATOM 0 HB2 LYS A 322 -1.003 1.521 -5.639 1.00 0.00 H new ATOM 0 HB3 LYS A 322 -2.261 1.857 -4.466 1.00 0.00 H new ATOM 0 HG2 LYS A 322 -2.222 4.210 -4.952 1.00 0.00 H new ATOM 0 HG3 LYS A 322 -0.735 4.070 -5.868 1.00 0.00 H new ATOM 0 HD2 LYS A 322 -2.479 4.225 -7.489 1.00 0.00 H new ATOM 0 HD3 LYS A 322 -1.984 2.544 -7.487 1.00 0.00 H new ATOM 0 HE2 LYS A 322 -3.898 2.265 -5.682 1.00 0.00 H new ATOM 0 HE3 LYS A 322 -4.489 3.779 -6.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 322 -5.460 1.818 -7.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 322 -4.617 2.799 -8.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 322 -3.921 1.352 -7.967 1.00 0.00 H new ATOM 1083 N VAL A 323 -0.582 4.561 -2.760 1.00 0.00 N ATOM 1084 CA VAL A 323 -1.047 5.495 -1.741 1.00 0.00 C ATOM 1085 C VAL A 323 -2.547 5.739 -1.863 1.00 0.00 C ATOM 1086 O VAL A 323 -3.011 6.356 -2.823 1.00 0.00 O ATOM 1087 CB VAL A 323 -0.309 6.844 -1.837 1.00 0.00 C ATOM 1088 CG1 VAL A 323 -0.729 7.764 -0.701 1.00 0.00 C ATOM 1089 CG2 VAL A 323 1.197 6.628 -1.830 1.00 0.00 C ATOM 0 H VAL A 323 -0.062 4.994 -3.523 1.00 0.00 H new ATOM 0 HA VAL A 323 -0.833 5.040 -0.774 1.00 0.00 H new ATOM 0 HB VAL A 323 -0.581 7.321 -2.779 1.00 0.00 H new ATOM 0 HG11 VAL A 323 -0.198 8.712 -0.785 1.00 0.00 H new ATOM 0 HG12 VAL A 323 -1.803 7.944 -0.756 1.00 0.00 H new ATOM 0 HG13 VAL A 323 -0.488 7.297 0.254 1.00 0.00 H new ATOM 0 HG21 VAL A 323 1.703 7.591 -1.898 1.00 0.00 H new ATOM 0 HG22 VAL A 323 1.489 6.130 -0.906 1.00 0.00 H new ATOM 0 HG23 VAL A 323 1.480 6.008 -2.681 1.00 0.00 H new ATOM 1099 N LEU A 324 -3.301 5.251 -0.884 1.00 0.00 N ATOM 1100 CA LEU A 324 -4.751 5.416 -0.881 1.00 0.00 C ATOM 1101 C LEU A 324 -5.142 6.780 -0.322 1.00 0.00 C ATOM 1102 O LEU A 324 -5.964 7.488 -0.903 1.00 0.00 O ATOM 1103 CB LEU A 324 -5.408 4.307 -0.057 1.00 0.00 C ATOM 1104 CG LEU A 324 -5.310 2.895 -0.634 1.00 0.00 C ATOM 1105 CD1 LEU A 324 -5.975 1.891 0.295 1.00 0.00 C ATOM 1106 CD2 LEU A 324 -5.938 2.839 -2.019 1.00 0.00 C ATOM 0 H LEU A 324 -2.933 4.738 -0.083 1.00 0.00 H new ATOM 0 HA LEU A 324 -5.102 5.352 -1.911 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -4.958 4.304 0.936 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -6.462 4.553 0.071 1.00 0.00 H new ATOM 0 HG LEU A 324 -4.256 2.633 -0.724 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -5.895 0.891 -0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -5.480 1.911 1.266 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -7.027 2.150 0.418 1.00 0.00 H new ATOM 0 HD21 LEU A 324 -5.859 1.826 -2.414 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -6.989 3.122 -1.954 1.00 0.00 H new ATOM 0 HD23 LEU A 324 -5.417 3.529 -2.683 1.00 0.00 H new ATOM 1118 N SER A 325 -4.545 7.144 0.809 1.00 0.00 N ATOM 1119 CA SER A 325 -4.832 8.423 1.447 1.00 0.00 C ATOM 1120 C SER A 325 -3.842 8.703 2.574 1.00 0.00 C ATOM 1121 O SER A 325 -3.287 7.780 3.171 1.00 0.00 O ATOM 1122 CB SER A 325 -6.261 8.435 1.994 1.00 0.00 C ATOM 1123 OG SER A 325 -6.667 9.750 2.332 1.00 0.00 O ATOM 0 H SER A 325 -3.860 6.571 1.302 1.00 0.00 H new ATOM 0 HA SER A 325 -4.731 9.206 0.695 1.00 0.00 H new ATOM 0 HB2 SER A 325 -6.942 8.021 1.250 1.00 0.00 H new ATOM 0 HB3 SER A 325 -6.322 7.795 2.874 1.00 0.00 H new ATOM 0 HG SER A 325 -7.584 9.731 2.677 1.00 0.00 H new ATOM 1129 N PHE A 326 -3.626 9.982 2.859 1.00 0.00 N ATOM 1130 CA PHE A 326 -2.702 10.385 3.913 1.00 0.00 C ATOM 1131 C PHE A 326 -3.267 11.554 4.715 1.00 0.00 C ATOM 1132 O PHE A 326 -3.596 12.602 4.159 1.00 0.00 O ATOM 1133 CB PHE A 326 -1.348 10.771 3.314 1.00 0.00 C ATOM 1134 CG PHE A 326 -0.427 11.440 4.294 1.00 0.00 C ATOM 1135 CD1 PHE A 326 -0.615 12.766 4.647 1.00 0.00 C ATOM 1136 CD2 PHE A 326 0.626 10.742 4.863 1.00 0.00 C ATOM 1137 CE1 PHE A 326 0.231 13.384 5.548 1.00 0.00 C ATOM 1138 CE2 PHE A 326 1.475 11.354 5.765 1.00 0.00 C ATOM 1139 CZ PHE A 326 1.277 12.677 6.109 1.00 0.00 C ATOM 0 H PHE A 326 -4.078 10.758 2.375 1.00 0.00 H new ATOM 0 HA PHE A 326 -2.566 9.538 4.585 1.00 0.00 H new ATOM 0 HB2 PHE A 326 -0.863 9.875 2.925 1.00 0.00 H new ATOM 0 HB3 PHE A 326 -1.511 11.438 2.468 1.00 0.00 H new ATOM 0 HD1 PHE A 326 -1.432 13.323 4.213 1.00 0.00 H new ATOM 0 HD2 PHE A 326 0.785 9.707 4.598 1.00 0.00 H new ATOM 0 HE1 PHE A 326 0.075 14.419 5.813 1.00 0.00 H new ATOM 0 HE2 PHE A 326 2.292 10.799 6.201 1.00 0.00 H new ATOM 0 HZ PHE A 326 1.938 13.158 6.815 1.00 0.00 H new ATOM 1149 N THR A 327 -3.378 11.365 6.026 1.00 0.00 N ATOM 1150 CA THR A 327 -3.905 12.401 6.906 1.00 0.00 C ATOM 1151 C THR A 327 -3.197 12.390 8.255 1.00 0.00 C ATOM 1152 O THR A 327 -3.363 11.463 9.047 1.00 0.00 O ATOM 1153 CB THR A 327 -5.419 12.229 7.132 1.00 0.00 C ATOM 1154 OG1 THR A 327 -5.837 13.003 8.262 1.00 0.00 O ATOM 1155 CG2 THR A 327 -5.770 10.766 7.356 1.00 0.00 C ATOM 0 H THR A 327 -3.110 10.504 6.502 1.00 0.00 H new ATOM 0 HA THR A 327 -3.725 13.356 6.413 1.00 0.00 H new ATOM 0 HB THR A 327 -5.939 12.579 6.240 1.00 0.00 H new ATOM 0 HG1 THR A 327 -6.801 12.889 8.398 1.00 0.00 H new ATOM 0 HG21 THR A 327 -6.844 10.670 7.513 1.00 0.00 H new ATOM 0 HG22 THR A 327 -5.477 10.184 6.482 1.00 0.00 H new ATOM 0 HG23 THR A 327 -5.240 10.395 8.233 1.00 0.00 H new ATOM 1163 N GLY A 328 -2.406 13.427 8.512 1.00 0.00 N ATOM 1164 CA GLY A 328 -1.684 13.517 9.768 1.00 0.00 C ATOM 1165 C GLY A 328 -0.658 12.412 9.927 1.00 0.00 C ATOM 1166 O GLY A 328 0.355 12.389 9.228 1.00 0.00 O ATOM 0 H GLY A 328 -2.252 14.207 7.873 1.00 0.00 H new ATOM 0 HA2 GLY A 328 -1.184 14.484 9.828 1.00 0.00 H new ATOM 0 HA3 GLY A 328 -2.393 13.472 10.595 1.00 0.00 H new ATOM 1170 N THR A 329 -0.920 11.493 10.851 1.00 0.00 N ATOM 1171 CA THR A 329 -0.011 10.382 11.102 1.00 0.00 C ATOM 1172 C THR A 329 -0.632 9.056 10.677 1.00 0.00 C ATOM 1173 O THR A 329 -0.515 8.050 11.377 1.00 0.00 O ATOM 1174 CB THR A 329 0.377 10.299 12.591 1.00 0.00 C ATOM 1175 OG1 THR A 329 -0.799 10.165 13.397 1.00 0.00 O ATOM 1176 CG2 THR A 329 1.152 11.537 13.017 1.00 0.00 C ATOM 0 H THR A 329 -1.754 11.496 11.438 1.00 0.00 H new ATOM 0 HA THR A 329 0.885 10.567 10.510 1.00 0.00 H new ATOM 0 HB THR A 329 1.013 9.425 12.730 1.00 0.00 H new ATOM 0 HG1 THR A 329 -0.544 10.111 14.342 1.00 0.00 H new ATOM 0 HG21 THR A 329 1.415 11.456 14.072 1.00 0.00 H new ATOM 0 HG22 THR A 329 2.061 11.620 12.421 1.00 0.00 H new ATOM 0 HG23 THR A 329 0.536 12.423 12.864 1.00 0.00 H new ATOM 1184 N LYS A 330 -1.293 9.061 9.524 1.00 0.00 N ATOM 1185 CA LYS A 330 -1.932 7.858 9.003 1.00 0.00 C ATOM 1186 C LYS A 330 -1.734 7.747 7.495 1.00 0.00 C ATOM 1187 O LYS A 330 -2.054 8.671 6.746 1.00 0.00 O ATOM 1188 CB LYS A 330 -3.427 7.866 9.332 1.00 0.00 C ATOM 1189 CG LYS A 330 -4.079 6.498 9.233 1.00 0.00 C ATOM 1190 CD LYS A 330 -3.695 5.610 10.405 1.00 0.00 C ATOM 1191 CE LYS A 330 -4.088 4.162 10.159 1.00 0.00 C ATOM 1192 NZ LYS A 330 -3.770 3.295 11.328 1.00 0.00 N ATOM 0 H LYS A 330 -1.400 9.885 8.932 1.00 0.00 H new ATOM 0 HA LYS A 330 -1.466 6.995 9.478 1.00 0.00 H new ATOM 0 HB2 LYS A 330 -3.566 8.253 10.341 1.00 0.00 H new ATOM 0 HB3 LYS A 330 -3.936 8.552 8.654 1.00 0.00 H new ATOM 0 HG2 LYS A 330 -5.163 6.612 9.202 1.00 0.00 H new ATOM 0 HG3 LYS A 330 -3.782 6.019 8.300 1.00 0.00 H new ATOM 0 HD2 LYS A 330 -2.620 5.673 10.573 1.00 0.00 H new ATOM 0 HD3 LYS A 330 -4.181 5.971 11.311 1.00 0.00 H new ATOM 0 HE2 LYS A 330 -5.155 4.107 9.945 1.00 0.00 H new ATOM 0 HE3 LYS A 330 -3.567 3.789 9.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 330 -4.053 2.316 11.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 330 -2.748 3.328 11.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 330 -4.287 3.635 12.164 1.00 0.00 H new ATOM 1206 N THR A 331 -1.205 6.609 7.054 1.00 0.00 N ATOM 1207 CA THR A 331 -0.965 6.377 5.635 1.00 0.00 C ATOM 1208 C THR A 331 -1.534 5.034 5.194 1.00 0.00 C ATOM 1209 O THR A 331 -1.057 3.979 5.612 1.00 0.00 O ATOM 1210 CB THR A 331 0.539 6.418 5.306 1.00 0.00 C ATOM 1211 OG1 THR A 331 1.159 7.518 5.982 1.00 0.00 O ATOM 1212 CG2 THR A 331 0.762 6.546 3.807 1.00 0.00 C ATOM 0 H THR A 331 -0.935 5.834 7.660 1.00 0.00 H new ATOM 0 HA THR A 331 -1.470 7.177 5.094 1.00 0.00 H new ATOM 0 HB THR A 331 0.988 5.484 5.645 1.00 0.00 H new ATOM 0 HG1 THR A 331 2.115 7.536 5.769 1.00 0.00 H new ATOM 0 HG21 THR A 331 1.832 6.573 3.599 1.00 0.00 H new ATOM 0 HG22 THR A 331 0.315 5.692 3.298 1.00 0.00 H new ATOM 0 HG23 THR A 331 0.299 7.465 3.447 1.00 0.00 H new ATOM 1220 N SER A 332 -2.556 5.079 4.345 1.00 0.00 N ATOM 1221 CA SER A 332 -3.193 3.865 3.849 1.00 0.00 C ATOM 1222 C SER A 332 -2.530 3.392 2.559 1.00 0.00 C ATOM 1223 O SER A 332 -2.236 4.192 1.669 1.00 0.00 O ATOM 1224 CB SER A 332 -4.685 4.106 3.611 1.00 0.00 C ATOM 1225 OG SER A 332 -5.363 4.348 4.831 1.00 0.00 O ATOM 0 H SER A 332 -2.961 5.944 3.986 1.00 0.00 H new ATOM 0 HA SER A 332 -3.075 3.088 4.604 1.00 0.00 H new ATOM 0 HB2 SER A 332 -4.817 4.957 2.943 1.00 0.00 H new ATOM 0 HB3 SER A 332 -5.122 3.240 3.114 1.00 0.00 H new ATOM 0 HG SER A 332 -6.314 4.501 4.652 1.00 0.00 H new ATOM 1231 N LEU A 333 -2.297 2.088 2.464 1.00 0.00 N ATOM 1232 CA LEU A 333 -1.669 1.507 1.283 1.00 0.00 C ATOM 1233 C LEU A 333 -2.452 0.294 0.791 1.00 0.00 C ATOM 1234 O LEU A 333 -3.041 -0.441 1.583 1.00 0.00 O ATOM 1235 CB LEU A 333 -0.226 1.104 1.594 1.00 0.00 C ATOM 1236 CG LEU A 333 0.654 2.189 2.216 1.00 0.00 C ATOM 1237 CD1 LEU A 333 2.010 1.620 2.603 1.00 0.00 C ATOM 1238 CD2 LEU A 333 0.819 3.358 1.254 1.00 0.00 C ATOM 0 H LEU A 333 -2.534 1.413 3.191 1.00 0.00 H new ATOM 0 HA LEU A 333 -1.668 2.260 0.495 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -0.246 0.249 2.270 1.00 0.00 H new ATOM 0 HB3 LEU A 333 0.244 0.769 0.669 1.00 0.00 H new ATOM 0 HG LEU A 333 0.165 2.553 3.119 1.00 0.00 H new ATOM 0 HD11 LEU A 333 2.622 2.407 3.044 1.00 0.00 H new ATOM 0 HD12 LEU A 333 1.874 0.817 3.327 1.00 0.00 H new ATOM 0 HD13 LEU A 333 2.507 1.228 1.716 1.00 0.00 H new ATOM 0 HD21 LEU A 333 1.448 4.121 1.713 1.00 0.00 H new ATOM 0 HD22 LEU A 333 1.286 3.008 0.333 1.00 0.00 H new ATOM 0 HD23 LEU A 333 -0.159 3.783 1.026 1.00 0.00 H new ATOM 1250 N SER A 334 -2.453 0.090 -0.523 1.00 0.00 N ATOM 1251 CA SER A 334 -3.165 -1.033 -1.121 1.00 0.00 C ATOM 1252 C SER A 334 -2.208 -1.930 -1.901 1.00 0.00 C ATOM 1253 O SER A 334 -1.268 -1.451 -2.533 1.00 0.00 O ATOM 1254 CB SER A 334 -4.274 -0.527 -2.045 1.00 0.00 C ATOM 1255 OG SER A 334 -3.757 -0.168 -3.315 1.00 0.00 O ATOM 0 H SER A 334 -1.969 0.688 -1.193 1.00 0.00 H new ATOM 0 HA SER A 334 -3.610 -1.619 -0.317 1.00 0.00 H new ATOM 0 HB2 SER A 334 -5.033 -1.300 -2.164 1.00 0.00 H new ATOM 0 HB3 SER A 334 -4.764 0.335 -1.592 1.00 0.00 H new ATOM 0 HG SER A 334 -4.387 0.431 -3.767 1.00 0.00 H new ATOM 1261 N MET A 335 -2.456 -3.235 -1.850 1.00 0.00 N ATOM 1262 CA MET A 335 -1.617 -4.199 -2.552 1.00 0.00 C ATOM 1263 C MET A 335 -2.340 -4.761 -3.772 1.00 0.00 C ATOM 1264 O MET A 335 -1.724 -5.021 -4.806 1.00 0.00 O ATOM 1265 CB MET A 335 -1.217 -5.339 -1.612 1.00 0.00 C ATOM 1266 CG MET A 335 -0.065 -4.986 -0.685 1.00 0.00 C ATOM 1267 SD MET A 335 0.466 -6.382 0.325 1.00 0.00 S ATOM 1268 CE MET A 335 1.089 -7.493 -0.933 1.00 0.00 C ATOM 0 H MET A 335 -3.230 -3.649 -1.330 1.00 0.00 H new ATOM 0 HA MET A 335 -0.718 -3.683 -2.889 1.00 0.00 H new ATOM 0 HB2 MET A 335 -2.081 -5.624 -1.012 1.00 0.00 H new ATOM 0 HB3 MET A 335 -0.940 -6.209 -2.207 1.00 0.00 H new ATOM 0 HG2 MET A 335 0.778 -4.630 -1.278 1.00 0.00 H new ATOM 0 HG3 MET A 335 -0.366 -4.165 -0.034 1.00 0.00 H new ATOM 0 HE1 MET A 335 1.865 -8.128 -0.506 1.00 0.00 H new ATOM 0 HE2 MET A 335 0.275 -8.115 -1.305 1.00 0.00 H new ATOM 0 HE3 MET A 335 1.507 -6.913 -1.756 1.00 0.00 H new ATOM 1278 N LYS A 336 -3.649 -4.947 -3.645 1.00 0.00 N ATOM 1279 CA LYS A 336 -4.456 -5.477 -4.738 1.00 0.00 C ATOM 1280 C LYS A 336 -4.382 -4.568 -5.960 1.00 0.00 C ATOM 1281 O LYS A 336 -3.779 -4.924 -6.974 1.00 0.00 O ATOM 1282 CB LYS A 336 -5.913 -5.634 -4.294 1.00 0.00 C ATOM 1283 CG LYS A 336 -6.090 -6.564 -3.106 1.00 0.00 C ATOM 1284 CD LYS A 336 -7.439 -7.262 -3.141 1.00 0.00 C ATOM 1285 CE LYS A 336 -8.562 -6.327 -2.718 1.00 0.00 C ATOM 1286 NZ LYS A 336 -9.143 -5.597 -3.880 1.00 0.00 N ATOM 0 H LYS A 336 -4.174 -4.739 -2.796 1.00 0.00 H new ATOM 0 HA LYS A 336 -4.057 -6.454 -5.009 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -6.314 -4.653 -4.040 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -6.500 -6.011 -5.131 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -5.294 -7.309 -3.104 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -5.997 -5.995 -2.181 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -7.632 -7.632 -4.148 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -7.418 -8.129 -2.481 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -9.345 -6.901 -2.221 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -8.183 -5.609 -1.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -9.074 -4.572 -3.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -8.619 -5.845 -4.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -10.142 -5.863 -3.993 1.00 0.00 H new ATOM 1300 N ASP A 337 -4.995 -3.395 -5.858 1.00 0.00 N ATOM 1301 CA ASP A 337 -4.996 -2.434 -6.955 1.00 0.00 C ATOM 1302 C ASP A 337 -3.644 -2.414 -7.661 1.00 0.00 C ATOM 1303 O ASP A 337 -3.553 -2.083 -8.843 1.00 0.00 O ATOM 1304 CB ASP A 337 -5.334 -1.035 -6.436 1.00 0.00 C ATOM 1305 CG ASP A 337 -6.798 -0.893 -6.067 1.00 0.00 C ATOM 1306 OD1 ASP A 337 -7.464 -1.931 -5.869 1.00 0.00 O ATOM 1307 OD2 ASP A 337 -7.277 0.256 -5.975 1.00 0.00 O ATOM 0 H ASP A 337 -5.498 -3.086 -5.026 1.00 0.00 H new ATOM 0 HA ASP A 337 -5.757 -2.741 -7.673 1.00 0.00 H new ATOM 0 HB2 ASP A 337 -4.719 -0.816 -5.563 1.00 0.00 H new ATOM 0 HB3 ASP A 337 -5.081 -0.297 -7.197 1.00 0.00 H new ATOM 1312 N VAL A 338 -2.594 -2.771 -6.928 1.00 0.00 N ATOM 1313 CA VAL A 338 -1.246 -2.795 -7.483 1.00 0.00 C ATOM 1314 C VAL A 338 -0.836 -4.211 -7.871 1.00 0.00 C ATOM 1315 O VAL A 338 -0.983 -5.148 -7.085 1.00 0.00 O ATOM 1316 CB VAL A 338 -0.217 -2.229 -6.486 1.00 0.00 C ATOM 1317 CG1 VAL A 338 1.171 -2.207 -7.105 1.00 0.00 C ATOM 1318 CG2 VAL A 338 -0.629 -0.838 -6.028 1.00 0.00 C ATOM 0 H VAL A 338 -2.651 -3.048 -5.948 1.00 0.00 H new ATOM 0 HA VAL A 338 -1.260 -2.167 -8.374 1.00 0.00 H new ATOM 0 HB VAL A 338 -0.187 -2.880 -5.612 1.00 0.00 H new ATOM 0 HG11 VAL A 338 1.884 -1.804 -6.386 1.00 0.00 H new ATOM 0 HG12 VAL A 338 1.464 -3.221 -7.377 1.00 0.00 H new ATOM 0 HG13 VAL A 338 1.162 -1.580 -7.997 1.00 0.00 H new ATOM 0 HG21 VAL A 338 0.109 -0.453 -5.324 1.00 0.00 H new ATOM 0 HG22 VAL A 338 -0.689 -0.174 -6.890 1.00 0.00 H new ATOM 0 HG23 VAL A 338 -1.603 -0.889 -5.541 1.00 0.00 H new ATOM 1328 N ASP A 339 -0.322 -4.360 -9.087 1.00 0.00 N ATOM 1329 CA ASP A 339 0.111 -5.663 -9.579 1.00 0.00 C ATOM 1330 C ASP A 339 1.490 -6.019 -9.032 1.00 0.00 C ATOM 1331 O ASP A 339 2.465 -5.307 -9.269 1.00 0.00 O ATOM 1332 CB ASP A 339 0.138 -5.670 -11.108 1.00 0.00 C ATOM 1333 CG ASP A 339 -0.135 -7.046 -11.685 1.00 0.00 C ATOM 1334 OD1 ASP A 339 0.512 -8.016 -11.238 1.00 0.00 O ATOM 1335 OD2 ASP A 339 -0.997 -7.152 -12.583 1.00 0.00 O ATOM 0 H ASP A 339 -0.195 -3.595 -9.750 1.00 0.00 H new ATOM 0 HA ASP A 339 -0.602 -6.411 -9.232 1.00 0.00 H new ATOM 0 HB2 ASP A 339 -0.605 -4.967 -11.485 1.00 0.00 H new ATOM 0 HB3 ASP A 339 1.111 -5.321 -11.453 1.00 0.00 H new ATOM 1340 N GLN A 340 1.562 -7.126 -8.299 1.00 0.00 N ATOM 1341 CA GLN A 340 2.821 -7.575 -7.718 1.00 0.00 C ATOM 1342 C GLN A 340 3.804 -7.995 -8.805 1.00 0.00 C ATOM 1343 O GLN A 340 4.953 -8.332 -8.520 1.00 0.00 O ATOM 1344 CB GLN A 340 2.577 -8.740 -6.757 1.00 0.00 C ATOM 1345 CG GLN A 340 1.901 -8.328 -5.460 1.00 0.00 C ATOM 1346 CD GLN A 340 2.527 -7.093 -4.843 1.00 0.00 C ATOM 1347 OE1 GLN A 340 3.401 -7.190 -3.980 1.00 0.00 O ATOM 1348 NE2 GLN A 340 2.083 -5.921 -5.282 1.00 0.00 N ATOM 0 H GLN A 340 0.764 -7.727 -8.094 1.00 0.00 H new ATOM 0 HA GLN A 340 3.254 -6.741 -7.165 1.00 0.00 H new ATOM 0 HB2 GLN A 340 1.961 -9.489 -7.256 1.00 0.00 H new ATOM 0 HB3 GLN A 340 3.531 -9.214 -6.525 1.00 0.00 H new ATOM 0 HG2 GLN A 340 0.844 -8.139 -5.649 1.00 0.00 H new ATOM 0 HG3 GLN A 340 1.955 -9.152 -4.749 1.00 0.00 H new ATOM 0 HE21 GLN A 340 1.358 -5.886 -5.998 1.00 0.00 H new ATOM 0 HE22 GLN A 340 2.467 -5.056 -4.903 1.00 0.00 H new ATOM 1357 N GLU A 341 3.345 -7.972 -10.053 1.00 0.00 N ATOM 1358 CA GLU A 341 4.185 -8.352 -11.182 1.00 0.00 C ATOM 1359 C GLU A 341 5.174 -7.241 -11.523 1.00 0.00 C ATOM 1360 O GLU A 341 6.385 -7.458 -11.550 1.00 0.00 O ATOM 1361 CB GLU A 341 3.320 -8.673 -12.404 1.00 0.00 C ATOM 1362 CG GLU A 341 4.115 -8.818 -13.691 1.00 0.00 C ATOM 1363 CD GLU A 341 3.472 -9.782 -14.668 1.00 0.00 C ATOM 1364 OE1 GLU A 341 2.514 -9.376 -15.358 1.00 0.00 O ATOM 1365 OE2 GLU A 341 3.926 -10.943 -14.742 1.00 0.00 O ATOM 0 H GLU A 341 2.397 -7.694 -10.307 1.00 0.00 H new ATOM 0 HA GLU A 341 4.748 -9.242 -10.900 1.00 0.00 H new ATOM 0 HB2 GLU A 341 2.773 -9.597 -12.219 1.00 0.00 H new ATOM 0 HB3 GLU A 341 2.579 -7.884 -12.532 1.00 0.00 H new ATOM 0 HG2 GLU A 341 4.216 -7.841 -14.163 1.00 0.00 H new ATOM 0 HG3 GLU A 341 5.122 -9.163 -13.455 1.00 0.00 H new ATOM 1372 N THR A 342 4.648 -6.048 -11.784 1.00 0.00 N ATOM 1373 CA THR A 342 5.482 -4.903 -12.125 1.00 0.00 C ATOM 1374 C THR A 342 5.120 -3.688 -11.278 1.00 0.00 C ATOM 1375 O THR A 342 5.996 -3.006 -10.747 1.00 0.00 O ATOM 1376 CB THR A 342 5.349 -4.534 -13.615 1.00 0.00 C ATOM 1377 OG1 THR A 342 6.136 -3.373 -13.904 1.00 0.00 O ATOM 1378 CG2 THR A 342 3.896 -4.273 -13.980 1.00 0.00 C ATOM 0 H THR A 342 3.648 -5.850 -11.766 1.00 0.00 H new ATOM 0 HA THR A 342 6.513 -5.191 -11.921 1.00 0.00 H new ATOM 0 HB THR A 342 5.710 -5.374 -14.209 1.00 0.00 H new ATOM 0 HG1 THR A 342 6.047 -3.146 -14.853 1.00 0.00 H new ATOM 0 HG21 THR A 342 3.827 -4.014 -15.037 1.00 0.00 H new ATOM 0 HG22 THR A 342 3.306 -5.169 -13.786 1.00 0.00 H new ATOM 0 HG23 THR A 342 3.512 -3.449 -13.379 1.00 0.00 H new ATOM 1386 N GLY A 343 3.823 -3.422 -11.157 1.00 0.00 N ATOM 1387 CA GLY A 343 3.369 -2.288 -10.372 1.00 0.00 C ATOM 1388 C GLY A 343 2.515 -1.330 -11.179 1.00 0.00 C ATOM 1389 O GLY A 343 2.483 -0.132 -10.899 1.00 0.00 O ATOM 0 H GLY A 343 3.079 -3.971 -11.588 1.00 0.00 H new ATOM 0 HA2 GLY A 343 2.797 -2.648 -9.517 1.00 0.00 H new ATOM 0 HA3 GLY A 343 4.233 -1.755 -9.976 1.00 0.00 H new ATOM 1393 N GLU A 344 1.824 -1.858 -12.184 1.00 0.00 N ATOM 1394 CA GLU A 344 0.968 -1.040 -13.035 1.00 0.00 C ATOM 1395 C GLU A 344 -0.293 -0.613 -12.289 1.00 0.00 C ATOM 1396 O GLU A 344 -0.773 -1.321 -11.404 1.00 0.00 O ATOM 1397 CB GLU A 344 0.588 -1.807 -14.303 1.00 0.00 C ATOM 1398 CG GLU A 344 0.239 -0.908 -15.477 1.00 0.00 C ATOM 1399 CD GLU A 344 -0.356 -1.674 -16.643 1.00 0.00 C ATOM 1400 OE1 GLU A 344 -1.084 -2.658 -16.396 1.00 0.00 O ATOM 1401 OE2 GLU A 344 -0.094 -1.289 -17.801 1.00 0.00 O ATOM 0 H GLU A 344 1.840 -2.848 -12.429 1.00 0.00 H new ATOM 0 HA GLU A 344 1.525 -0.146 -13.313 1.00 0.00 H new ATOM 0 HB2 GLU A 344 1.417 -2.456 -14.587 1.00 0.00 H new ATOM 0 HB3 GLU A 344 -0.263 -2.453 -14.086 1.00 0.00 H new ATOM 0 HG2 GLU A 344 -0.468 -0.147 -15.149 1.00 0.00 H new ATOM 0 HG3 GLU A 344 1.137 -0.387 -15.810 1.00 0.00 H new ATOM 1408 N ASP A 345 -0.823 0.550 -12.653 1.00 0.00 N ATOM 1409 CA ASP A 345 -2.028 1.072 -12.020 1.00 0.00 C ATOM 1410 C ASP A 345 -3.270 0.354 -12.539 1.00 0.00 C ATOM 1411 O ASP A 345 -3.776 0.667 -13.617 1.00 0.00 O ATOM 1412 CB ASP A 345 -2.151 2.576 -12.270 1.00 0.00 C ATOM 1413 CG ASP A 345 -3.569 3.079 -12.085 1.00 0.00 C ATOM 1414 OD1 ASP A 345 -4.264 2.574 -11.180 1.00 0.00 O ATOM 1415 OD2 ASP A 345 -3.984 3.979 -12.847 1.00 0.00 O ATOM 0 H ASP A 345 -0.437 1.149 -13.383 1.00 0.00 H new ATOM 0 HA ASP A 345 -1.950 0.895 -10.947 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -1.487 3.110 -11.590 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -1.818 2.802 -13.283 1.00 0.00 H new