USER MOD reduce.3.24.130724 H: found=0, std=0, add=270, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 272 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 265 LYS NZ :NH3+ 180:sc= -3.32! (180deg=-3.32!) USER MOD Single : A 270 SER OG : rot 180:sc= 0 USER MOD Single : A 272 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 307 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 311 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 313 SER OG : rot -30:sc= 0.484 USER MOD Single : A 321 LYS NZ :NH3+ 167:sc= -0.0201 (180deg=-0.22) USER MOD ----------------------------------------------------------------- ATOM 155 N GLU A 259 61.520 -8.937 -1.681 1.00 0.00 N ATOM 156 CA GLU A 259 60.731 -8.957 -0.454 1.00 0.00 C ATOM 157 C GLU A 259 60.051 -7.612 -0.222 1.00 0.00 C ATOM 158 O GLU A 259 58.884 -7.554 0.167 1.00 0.00 O ATOM 159 CB GLU A 259 61.620 -9.304 0.742 1.00 0.00 C ATOM 160 CG GLU A 259 60.868 -9.388 2.063 1.00 0.00 C ATOM 161 CD GLU A 259 59.846 -10.510 2.089 1.00 0.00 C ATOM 162 OE1 GLU A 259 58.900 -10.474 1.273 1.00 0.00 O ATOM 163 OE2 GLU A 259 59.991 -11.425 2.926 1.00 0.00 O ATOM 0 HA GLU A 259 59.960 -9.720 -0.560 1.00 0.00 H new ATOM 0 HB2 GLU A 259 62.111 -10.259 0.553 1.00 0.00 H new ATOM 0 HB3 GLU A 259 62.405 -8.553 0.829 1.00 0.00 H new ATOM 0 HG2 GLU A 259 61.582 -9.535 2.873 1.00 0.00 H new ATOM 0 HG3 GLU A 259 60.364 -8.440 2.250 1.00 0.00 H new ATOM 170 N GLU A 260 60.791 -6.535 -0.462 1.00 0.00 N ATOM 171 CA GLU A 260 60.269 -5.185 -0.279 1.00 0.00 C ATOM 172 C GLU A 260 59.022 -4.958 -1.129 1.00 0.00 C ATOM 173 O GLU A 260 58.064 -4.327 -0.685 1.00 0.00 O ATOM 174 CB GLU A 260 61.338 -4.151 -0.637 1.00 0.00 C ATOM 175 CG GLU A 260 62.597 -4.251 0.211 1.00 0.00 C ATOM 176 CD GLU A 260 62.353 -3.925 1.674 1.00 0.00 C ATOM 177 OE1 GLU A 260 61.208 -3.569 2.025 1.00 0.00 O ATOM 178 OE2 GLU A 260 63.312 -4.019 2.469 1.00 0.00 O ATOM 0 H GLU A 260 61.758 -6.571 -0.785 1.00 0.00 H new ATOM 0 HA GLU A 260 59.995 -5.070 0.770 1.00 0.00 H new ATOM 0 HB2 GLU A 260 61.608 -4.269 -1.686 1.00 0.00 H new ATOM 0 HB3 GLU A 260 60.915 -3.152 -0.527 1.00 0.00 H new ATOM 0 HG2 GLU A 260 63.003 -5.259 0.132 1.00 0.00 H new ATOM 0 HG3 GLU A 260 63.351 -3.572 -0.186 1.00 0.00 H new ATOM 185 N GLU A 261 59.048 -5.469 -2.356 1.00 0.00 N ATOM 186 CA GLU A 261 57.924 -5.317 -3.275 1.00 0.00 C ATOM 187 C GLU A 261 56.651 -5.940 -2.703 1.00 0.00 C ATOM 188 O GLU A 261 55.585 -5.323 -2.724 1.00 0.00 O ATOM 189 CB GLU A 261 58.257 -5.961 -4.623 1.00 0.00 C ATOM 190 CG GLU A 261 57.153 -5.819 -5.659 1.00 0.00 C ATOM 191 CD GLU A 261 57.495 -6.500 -6.970 1.00 0.00 C ATOM 192 OE1 GLU A 261 57.712 -7.730 -6.961 1.00 0.00 O ATOM 193 OE2 GLU A 261 57.546 -5.804 -8.006 1.00 0.00 O ATOM 0 H GLU A 261 59.836 -5.993 -2.738 1.00 0.00 H new ATOM 0 HA GLU A 261 57.747 -4.251 -3.416 1.00 0.00 H new ATOM 0 HB2 GLU A 261 59.170 -5.512 -5.014 1.00 0.00 H new ATOM 0 HB3 GLU A 261 58.464 -7.020 -4.468 1.00 0.00 H new ATOM 0 HG2 GLU A 261 56.231 -6.244 -5.263 1.00 0.00 H new ATOM 0 HG3 GLU A 261 56.964 -4.761 -5.841 1.00 0.00 H new ATOM 200 N LEU A 262 56.768 -7.166 -2.201 1.00 0.00 N ATOM 201 CA LEU A 262 55.625 -7.874 -1.633 1.00 0.00 C ATOM 202 C LEU A 262 55.065 -7.143 -0.415 1.00 0.00 C ATOM 203 O LEU A 262 53.853 -6.968 -0.290 1.00 0.00 O ATOM 204 CB LEU A 262 56.023 -9.300 -1.243 1.00 0.00 C ATOM 205 CG LEU A 262 56.524 -10.176 -2.394 1.00 0.00 C ATOM 206 CD1 LEU A 262 56.905 -11.558 -1.885 1.00 0.00 C ATOM 207 CD2 LEU A 262 55.468 -10.282 -3.485 1.00 0.00 C ATOM 0 H LEU A 262 57.643 -7.690 -2.176 1.00 0.00 H new ATOM 0 HA LEU A 262 54.847 -7.911 -2.396 1.00 0.00 H new ATOM 0 HB2 LEU A 262 56.802 -9.247 -0.482 1.00 0.00 H new ATOM 0 HB3 LEU A 262 55.163 -9.788 -0.785 1.00 0.00 H new ATOM 0 HG LEU A 262 57.412 -9.708 -2.820 1.00 0.00 H new ATOM 0 HD11 LEU A 262 57.259 -12.167 -2.717 1.00 0.00 H new ATOM 0 HD12 LEU A 262 57.696 -11.466 -1.140 1.00 0.00 H new ATOM 0 HD13 LEU A 262 56.034 -12.032 -1.433 1.00 0.00 H new ATOM 0 HD21 LEU A 262 55.843 -10.909 -4.294 1.00 0.00 H new ATOM 0 HD22 LEU A 262 54.562 -10.726 -3.072 1.00 0.00 H new ATOM 0 HD23 LEU A 262 55.242 -9.288 -3.871 1.00 0.00 H new ATOM 219 N ILE A 263 55.953 -6.726 0.482 1.00 0.00 N ATOM 220 CA ILE A 263 55.543 -6.023 1.693 1.00 0.00 C ATOM 221 C ILE A 263 54.808 -4.728 1.361 1.00 0.00 C ATOM 222 O ILE A 263 53.754 -4.442 1.927 1.00 0.00 O ATOM 223 CB ILE A 263 56.753 -5.699 2.592 1.00 0.00 C ATOM 224 CG1 ILE A 263 57.477 -6.988 2.990 1.00 0.00 C ATOM 225 CG2 ILE A 263 56.304 -4.931 3.828 1.00 0.00 C ATOM 226 CD1 ILE A 263 58.717 -6.757 3.828 1.00 0.00 C ATOM 0 H ILE A 263 56.960 -6.862 0.394 1.00 0.00 H new ATOM 0 HA ILE A 263 54.868 -6.690 2.230 1.00 0.00 H new ATOM 0 HB ILE A 263 57.448 -5.072 2.033 1.00 0.00 H new ATOM 0 HG12 ILE A 263 56.788 -7.625 3.545 1.00 0.00 H new ATOM 0 HG13 ILE A 263 57.756 -7.531 2.087 1.00 0.00 H new ATOM 0 HG21 ILE A 263 57.169 -4.709 4.453 1.00 0.00 H new ATOM 0 HG22 ILE A 263 55.828 -3.999 3.524 1.00 0.00 H new ATOM 0 HG23 ILE A 263 55.593 -5.534 4.393 1.00 0.00 H new ATOM 0 HD11 ILE A 263 59.176 -7.715 4.071 1.00 0.00 H new ATOM 0 HD12 ILE A 263 59.426 -6.147 3.268 1.00 0.00 H new ATOM 0 HD13 ILE A 263 58.443 -6.242 4.749 1.00 0.00 H new ATOM 238 N ARG A 264 55.371 -3.949 0.443 1.00 0.00 N ATOM 239 CA ARG A 264 54.770 -2.682 0.039 1.00 0.00 C ATOM 240 C ARG A 264 53.372 -2.898 -0.532 1.00 0.00 C ATOM 241 O ARG A 264 52.440 -2.157 -0.215 1.00 0.00 O ATOM 242 CB ARG A 264 55.656 -1.980 -0.993 1.00 0.00 C ATOM 243 CG ARG A 264 55.114 -0.636 -1.451 1.00 0.00 C ATOM 244 CD ARG A 264 56.062 0.041 -2.427 1.00 0.00 C ATOM 245 NE ARG A 264 56.297 -0.773 -3.617 1.00 0.00 N ATOM 246 CZ ARG A 264 57.104 -0.414 -4.611 1.00 0.00 C ATOM 247 NH1 ARG A 264 57.753 0.742 -4.560 1.00 0.00 N ATOM 248 NH2 ARG A 264 57.262 -1.213 -5.658 1.00 0.00 N ATOM 0 H ARG A 264 56.243 -4.173 -0.036 1.00 0.00 H new ATOM 0 HA ARG A 264 54.685 -2.050 0.923 1.00 0.00 H new ATOM 0 HB2 ARG A 264 56.649 -1.835 -0.568 1.00 0.00 H new ATOM 0 HB3 ARG A 264 55.772 -2.630 -1.861 1.00 0.00 H new ATOM 0 HG2 ARG A 264 54.142 -0.776 -1.924 1.00 0.00 H new ATOM 0 HG3 ARG A 264 54.958 0.009 -0.586 1.00 0.00 H new ATOM 0 HD2 ARG A 264 55.649 1.005 -2.723 1.00 0.00 H new ATOM 0 HD3 ARG A 264 57.012 0.240 -1.931 1.00 0.00 H new ATOM 0 HE ARG A 264 55.814 -1.669 -3.690 1.00 0.00 H new ATOM 0 HH11 ARG A 264 57.634 1.359 -3.756 1.00 0.00 H new ATOM 0 HH12 ARG A 264 58.371 1.014 -5.324 1.00 0.00 H new ATOM 0 HH21 ARG A 264 56.765 -2.102 -5.700 1.00 0.00 H new ATOM 0 HH22 ARG A 264 57.881 -0.938 -6.421 1.00 0.00 H new ATOM 262 N LYS A 265 53.233 -3.914 -1.377 1.00 0.00 N ATOM 263 CA LYS A 265 51.949 -4.227 -1.994 1.00 0.00 C ATOM 264 C LYS A 265 50.896 -4.536 -0.932 1.00 0.00 C ATOM 265 O LYS A 265 49.774 -4.026 -0.986 1.00 0.00 O ATOM 266 CB LYS A 265 52.099 -5.417 -2.946 1.00 0.00 C ATOM 267 CG LYS A 265 50.824 -5.766 -3.698 1.00 0.00 C ATOM 268 CD LYS A 265 50.399 -4.642 -4.631 1.00 0.00 C ATOM 269 CE LYS A 265 49.151 -5.013 -5.416 1.00 0.00 C ATOM 270 NZ LYS A 265 48.002 -5.319 -4.520 1.00 0.00 N ATOM 0 H LYS A 265 53.994 -4.535 -1.650 1.00 0.00 H new ATOM 0 HA LYS A 265 51.620 -3.356 -2.560 1.00 0.00 H new ATOM 0 HB2 LYS A 265 52.886 -5.197 -3.667 1.00 0.00 H new ATOM 0 HB3 LYS A 265 52.423 -6.288 -2.376 1.00 0.00 H new ATOM 0 HG2 LYS A 265 50.979 -6.679 -4.274 1.00 0.00 H new ATOM 0 HG3 LYS A 265 50.025 -5.970 -2.985 1.00 0.00 H new ATOM 0 HD2 LYS A 265 50.211 -3.738 -4.052 1.00 0.00 H new ATOM 0 HD3 LYS A 265 51.211 -4.414 -5.322 1.00 0.00 H new ATOM 0 HE2 LYS A 265 48.884 -4.192 -6.082 1.00 0.00 H new ATOM 0 HE3 LYS A 265 49.361 -5.878 -6.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 47.171 -5.567 -5.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 48.247 -6.119 -3.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 47.784 -4.485 -3.938 1.00 0.00 H new ATOM 284 N ALA A 266 51.267 -5.372 0.034 1.00 0.00 N ATOM 285 CA ALA A 266 50.359 -5.750 1.111 1.00 0.00 C ATOM 286 C ALA A 266 49.891 -4.525 1.887 1.00 0.00 C ATOM 287 O ALA A 266 48.708 -4.392 2.201 1.00 0.00 O ATOM 288 CB ALA A 266 51.032 -6.745 2.045 1.00 0.00 C ATOM 0 H ALA A 266 52.191 -5.800 0.092 1.00 0.00 H new ATOM 0 HA ALA A 266 49.483 -6.223 0.666 1.00 0.00 H new ATOM 0 HB1 ALA A 266 50.342 -7.018 2.844 1.00 0.00 H new ATOM 0 HB2 ALA A 266 51.311 -7.638 1.486 1.00 0.00 H new ATOM 0 HB3 ALA A 266 51.925 -6.293 2.476 1.00 0.00 H new ATOM 294 N ILE A 267 50.828 -3.631 2.191 1.00 0.00 N ATOM 295 CA ILE A 267 50.512 -2.413 2.927 1.00 0.00 C ATOM 296 C ILE A 267 49.495 -1.567 2.168 1.00 0.00 C ATOM 297 O ILE A 267 48.561 -1.027 2.759 1.00 0.00 O ATOM 298 CB ILE A 267 51.777 -1.569 3.189 1.00 0.00 C ATOM 299 CG1 ILE A 267 52.806 -2.376 3.988 1.00 0.00 C ATOM 300 CG2 ILE A 267 51.418 -0.283 3.921 1.00 0.00 C ATOM 301 CD1 ILE A 267 52.303 -2.847 5.337 1.00 0.00 C ATOM 0 H ILE A 267 51.812 -3.728 1.939 1.00 0.00 H new ATOM 0 HA ILE A 267 50.087 -2.719 3.883 1.00 0.00 H new ATOM 0 HB ILE A 267 52.220 -1.305 2.229 1.00 0.00 H new ATOM 0 HG12 ILE A 267 53.108 -3.243 3.401 1.00 0.00 H new ATOM 0 HG13 ILE A 267 53.697 -1.765 4.136 1.00 0.00 H new ATOM 0 HG21 ILE A 267 52.322 0.300 4.097 1.00 0.00 H new ATOM 0 HG22 ILE A 267 50.724 0.299 3.315 1.00 0.00 H new ATOM 0 HG23 ILE A 267 50.951 -0.526 4.875 1.00 0.00 H new ATOM 0 HD11 ILE A 267 53.088 -3.410 5.842 1.00 0.00 H new ATOM 0 HD12 ILE A 267 52.028 -1.985 5.944 1.00 0.00 H new ATOM 0 HD13 ILE A 267 51.431 -3.485 5.197 1.00 0.00 H new ATOM 313 N GLU A 268 49.684 -1.456 0.857 1.00 0.00 N ATOM 314 CA GLU A 268 48.782 -0.674 0.018 1.00 0.00 C ATOM 315 C GLU A 268 47.362 -1.230 0.073 1.00 0.00 C ATOM 316 O GLU A 268 46.397 -0.476 0.194 1.00 0.00 O ATOM 317 CB GLU A 268 49.283 -0.657 -1.429 1.00 0.00 C ATOM 318 CG GLU A 268 48.398 0.143 -2.372 1.00 0.00 C ATOM 319 CD GLU A 268 48.268 1.597 -1.961 1.00 0.00 C ATOM 320 OE1 GLU A 268 49.303 2.292 -1.895 1.00 0.00 O ATOM 321 OE2 GLU A 268 47.129 2.041 -1.706 1.00 0.00 O ATOM 0 H GLU A 268 50.453 -1.897 0.353 1.00 0.00 H new ATOM 0 HA GLU A 268 48.765 0.346 0.401 1.00 0.00 H new ATOM 0 HB2 GLU A 268 50.291 -0.242 -1.451 1.00 0.00 H new ATOM 0 HB3 GLU A 268 49.353 -1.682 -1.792 1.00 0.00 H new ATOM 0 HG2 GLU A 268 48.808 0.090 -3.381 1.00 0.00 H new ATOM 0 HG3 GLU A 268 47.407 -0.311 -2.406 1.00 0.00 H new ATOM 328 N LEU A 269 47.240 -2.552 -0.018 1.00 0.00 N ATOM 329 CA LEU A 269 45.934 -3.204 0.020 1.00 0.00 C ATOM 330 C LEU A 269 45.228 -2.956 1.351 1.00 0.00 C ATOM 331 O LEU A 269 44.035 -2.652 1.383 1.00 0.00 O ATOM 332 CB LEU A 269 46.082 -4.710 -0.217 1.00 0.00 C ATOM 333 CG LEU A 269 46.578 -5.104 -1.610 1.00 0.00 C ATOM 334 CD1 LEU A 269 46.760 -6.611 -1.703 1.00 0.00 C ATOM 335 CD2 LEU A 269 45.610 -4.617 -2.678 1.00 0.00 C ATOM 0 H LEU A 269 48.028 -3.192 -0.118 1.00 0.00 H new ATOM 0 HA LEU A 269 45.326 -2.773 -0.775 1.00 0.00 H new ATOM 0 HB2 LEU A 269 46.772 -5.112 0.524 1.00 0.00 H new ATOM 0 HB3 LEU A 269 45.116 -5.186 -0.045 1.00 0.00 H new ATOM 0 HG LEU A 269 47.544 -4.629 -1.779 1.00 0.00 H new ATOM 0 HD11 LEU A 269 47.113 -6.874 -2.700 1.00 0.00 H new ATOM 0 HD12 LEU A 269 47.490 -6.936 -0.962 1.00 0.00 H new ATOM 0 HD13 LEU A 269 45.807 -7.105 -1.514 1.00 0.00 H new ATOM 0 HD21 LEU A 269 45.979 -4.906 -3.662 1.00 0.00 H new ATOM 0 HD22 LEU A 269 44.630 -5.064 -2.512 1.00 0.00 H new ATOM 0 HD23 LEU A 269 45.527 -3.531 -2.626 1.00 0.00 H new ATOM 347 N SER A 270 45.971 -3.093 2.444 1.00 0.00 N ATOM 348 CA SER A 270 45.414 -2.889 3.779 1.00 0.00 C ATOM 349 C SER A 270 44.908 -1.459 3.954 1.00 0.00 C ATOM 350 O SER A 270 43.791 -1.239 4.423 1.00 0.00 O ATOM 351 CB SER A 270 46.466 -3.203 4.845 1.00 0.00 C ATOM 352 OG SER A 270 45.941 -3.022 6.148 1.00 0.00 O ATOM 0 H SER A 270 46.960 -3.344 2.433 1.00 0.00 H new ATOM 0 HA SER A 270 44.569 -3.567 3.897 1.00 0.00 H new ATOM 0 HB2 SER A 270 46.811 -4.230 4.728 1.00 0.00 H new ATOM 0 HB3 SER A 270 47.333 -2.557 4.706 1.00 0.00 H new ATOM 0 HG SER A 270 46.632 -3.230 6.811 1.00 0.00 H new ATOM 358 N LEU A 271 45.739 -0.493 3.575 1.00 0.00 N ATOM 359 CA LEU A 271 45.381 0.917 3.689 1.00 0.00 C ATOM 360 C LEU A 271 44.201 1.256 2.784 1.00 0.00 C ATOM 361 O LEU A 271 43.362 2.088 3.129 1.00 0.00 O ATOM 362 CB LEU A 271 46.580 1.800 3.335 1.00 0.00 C ATOM 363 CG LEU A 271 47.826 1.585 4.198 1.00 0.00 C ATOM 364 CD1 LEU A 271 48.955 2.492 3.736 1.00 0.00 C ATOM 365 CD2 LEU A 271 47.512 1.832 5.666 1.00 0.00 C ATOM 0 H LEU A 271 46.667 -0.661 3.186 1.00 0.00 H new ATOM 0 HA LEU A 271 45.089 1.108 4.722 1.00 0.00 H new ATOM 0 HB2 LEU A 271 46.845 1.624 2.292 1.00 0.00 H new ATOM 0 HB3 LEU A 271 46.278 2.844 3.415 1.00 0.00 H new ATOM 0 HG LEU A 271 48.146 0.549 4.086 1.00 0.00 H new ATOM 0 HD11 LEU A 271 49.833 2.327 4.360 1.00 0.00 H new ATOM 0 HD12 LEU A 271 49.200 2.268 2.698 1.00 0.00 H new ATOM 0 HD13 LEU A 271 48.642 3.533 3.818 1.00 0.00 H new ATOM 0 HD21 LEU A 271 48.411 1.674 6.262 1.00 0.00 H new ATOM 0 HD22 LEU A 271 47.166 2.857 5.797 1.00 0.00 H new ATOM 0 HD23 LEU A 271 46.734 1.142 5.993 1.00 0.00 H new ATOM 377 N LYS A 272 44.151 0.609 1.623 1.00 0.00 N ATOM 378 CA LYS A 272 43.081 0.838 0.657 1.00 0.00 C ATOM 379 C LYS A 272 41.709 0.714 1.315 1.00 0.00 C ATOM 380 O LYS A 272 40.780 1.447 0.971 1.00 0.00 O ATOM 381 CB LYS A 272 43.195 -0.153 -0.505 1.00 0.00 C ATOM 382 CG LYS A 272 42.148 0.050 -1.590 1.00 0.00 C ATOM 383 CD LYS A 272 42.271 1.421 -2.238 1.00 0.00 C ATOM 384 CE LYS A 272 41.228 1.620 -3.326 1.00 0.00 C ATOM 385 NZ LYS A 272 41.320 2.972 -3.943 1.00 0.00 N ATOM 0 H LYS A 272 44.842 -0.081 1.328 1.00 0.00 H new ATOM 0 HA LYS A 272 43.186 1.853 0.274 1.00 0.00 H new ATOM 0 HB2 LYS A 272 44.187 -0.065 -0.949 1.00 0.00 H new ATOM 0 HB3 LYS A 272 43.109 -1.167 -0.115 1.00 0.00 H new ATOM 0 HG2 LYS A 272 42.257 -0.723 -2.350 1.00 0.00 H new ATOM 0 HG3 LYS A 272 41.152 -0.062 -1.161 1.00 0.00 H new ATOM 0 HD2 LYS A 272 42.158 2.195 -1.479 1.00 0.00 H new ATOM 0 HD3 LYS A 272 43.268 1.535 -2.663 1.00 0.00 H new ATOM 0 HE2 LYS A 272 41.358 0.860 -4.096 1.00 0.00 H new ATOM 0 HE3 LYS A 272 40.233 1.480 -2.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 40.592 3.068 -4.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 41.171 3.698 -3.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 42.261 3.096 -4.368 1.00 0.00 H new ATOM 892 N ASP A 305 -39.957 6.460 1.500 1.00 0.00 N ATOM 893 CA ASP A 305 -41.230 7.171 1.570 1.00 0.00 C ATOM 894 C ASP A 305 -42.113 6.861 0.363 1.00 0.00 C ATOM 895 O ASP A 305 -43.306 6.595 0.510 1.00 0.00 O ATOM 896 CB ASP A 305 -40.990 8.678 1.664 1.00 0.00 C ATOM 897 CG ASP A 305 -42.282 9.467 1.756 1.00 0.00 C ATOM 898 OD1 ASP A 305 -43.048 9.242 2.716 1.00 0.00 O ATOM 899 OD2 ASP A 305 -42.526 10.311 0.868 1.00 0.00 O ATOM 0 HA ASP A 305 -41.750 6.830 2.465 1.00 0.00 H new ATOM 0 HB2 ASP A 305 -40.375 8.891 2.538 1.00 0.00 H new ATOM 0 HB3 ASP A 305 -40.428 9.008 0.791 1.00 0.00 H new ATOM 904 N LEU A 306 -41.526 6.905 -0.829 1.00 0.00 N ATOM 905 CA LEU A 306 -42.270 6.637 -2.057 1.00 0.00 C ATOM 906 C LEU A 306 -42.782 5.199 -2.079 1.00 0.00 C ATOM 907 O LEU A 306 -43.964 4.954 -2.329 1.00 0.00 O ATOM 908 CB LEU A 306 -41.381 6.911 -3.280 1.00 0.00 C ATOM 909 CG LEU A 306 -42.100 6.980 -4.637 1.00 0.00 C ATOM 910 CD1 LEU A 306 -42.600 5.608 -5.067 1.00 0.00 C ATOM 911 CD2 LEU A 306 -43.253 7.973 -4.582 1.00 0.00 C ATOM 0 H LEU A 306 -40.540 7.123 -0.972 1.00 0.00 H new ATOM 0 HA LEU A 306 -43.133 7.302 -2.092 1.00 0.00 H new ATOM 0 HB2 LEU A 306 -40.859 7.854 -3.120 1.00 0.00 H new ATOM 0 HB3 LEU A 306 -40.621 6.131 -3.334 1.00 0.00 H new ATOM 0 HG LEU A 306 -41.379 7.323 -5.379 1.00 0.00 H new ATOM 0 HD11 LEU A 306 -43.104 5.690 -6.030 1.00 0.00 H new ATOM 0 HD12 LEU A 306 -41.756 4.925 -5.156 1.00 0.00 H new ATOM 0 HD13 LEU A 306 -43.299 5.226 -4.323 1.00 0.00 H new ATOM 0 HD21 LEU A 306 -43.750 8.008 -5.552 1.00 0.00 H new ATOM 0 HD22 LEU A 306 -43.967 7.660 -3.820 1.00 0.00 H new ATOM 0 HD23 LEU A 306 -42.869 8.963 -4.335 1.00 0.00 H new ATOM 923 N LYS A 307 -41.887 4.252 -1.815 1.00 0.00 N ATOM 924 CA LYS A 307 -42.249 2.839 -1.806 1.00 0.00 C ATOM 925 C LYS A 307 -43.369 2.577 -0.805 1.00 0.00 C ATOM 926 O LYS A 307 -44.325 1.857 -1.097 1.00 0.00 O ATOM 927 CB LYS A 307 -41.026 1.985 -1.465 1.00 0.00 C ATOM 928 CG LYS A 307 -41.295 0.488 -1.499 1.00 0.00 C ATOM 929 CD LYS A 307 -40.046 -0.316 -1.164 1.00 0.00 C ATOM 930 CE LYS A 307 -38.930 -0.065 -2.168 1.00 0.00 C ATOM 931 NZ LYS A 307 -37.702 -0.842 -1.843 1.00 0.00 N ATOM 0 H LYS A 307 -40.906 4.437 -1.605 1.00 0.00 H new ATOM 0 HA LYS A 307 -42.605 2.567 -2.800 1.00 0.00 H new ATOM 0 HB2 LYS A 307 -40.225 2.217 -2.167 1.00 0.00 H new ATOM 0 HB3 LYS A 307 -40.669 2.258 -0.472 1.00 0.00 H new ATOM 0 HG2 LYS A 307 -42.086 0.244 -0.790 1.00 0.00 H new ATOM 0 HG3 LYS A 307 -41.655 0.205 -2.488 1.00 0.00 H new ATOM 0 HD2 LYS A 307 -39.702 -0.054 -0.164 1.00 0.00 H new ATOM 0 HD3 LYS A 307 -40.290 -1.378 -1.149 1.00 0.00 H new ATOM 0 HE2 LYS A 307 -39.274 -0.332 -3.167 1.00 0.00 H new ATOM 0 HE3 LYS A 307 -38.692 0.998 -2.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 307 -36.967 -0.642 -2.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 307 -37.358 -0.569 -0.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 307 -37.922 -1.858 -1.850 1.00 0.00 H new ATOM 945 N ALA A 308 -43.243 3.175 0.375 1.00 0.00 N ATOM 946 CA ALA A 308 -44.242 3.020 1.424 1.00 0.00 C ATOM 947 C ALA A 308 -45.591 3.561 0.969 1.00 0.00 C ATOM 948 O ALA A 308 -46.631 2.953 1.223 1.00 0.00 O ATOM 949 CB ALA A 308 -43.785 3.724 2.693 1.00 0.00 C ATOM 0 H ALA A 308 -42.456 3.773 0.628 1.00 0.00 H new ATOM 0 HA ALA A 308 -44.357 1.957 1.636 1.00 0.00 H new ATOM 0 HB1 ALA A 308 -44.540 3.601 3.469 1.00 0.00 H new ATOM 0 HB2 ALA A 308 -42.843 3.291 3.031 1.00 0.00 H new ATOM 0 HB3 ALA A 308 -43.644 4.785 2.489 1.00 0.00 H new ATOM 955 N ALA A 309 -45.566 4.706 0.292 1.00 0.00 N ATOM 956 CA ALA A 309 -46.787 5.330 -0.204 1.00 0.00 C ATOM 957 C ALA A 309 -47.535 4.389 -1.140 1.00 0.00 C ATOM 958 O ALA A 309 -48.749 4.218 -1.025 1.00 0.00 O ATOM 959 CB ALA A 309 -46.463 6.636 -0.912 1.00 0.00 C ATOM 0 H ALA A 309 -44.712 5.220 0.075 1.00 0.00 H new ATOM 0 HA ALA A 309 -47.432 5.545 0.648 1.00 0.00 H new ATOM 0 HB1 ALA A 309 -47.384 7.090 -1.277 1.00 0.00 H new ATOM 0 HB2 ALA A 309 -45.974 7.316 -0.215 1.00 0.00 H new ATOM 0 HB3 ALA A 309 -45.798 6.439 -1.753 1.00 0.00 H new ATOM 965 N ILE A 310 -46.801 3.777 -2.064 1.00 0.00 N ATOM 966 CA ILE A 310 -47.392 2.847 -3.019 1.00 0.00 C ATOM 967 C ILE A 310 -48.005 1.648 -2.302 1.00 0.00 C ATOM 968 O ILE A 310 -49.097 1.195 -2.647 1.00 0.00 O ATOM 969 CB ILE A 310 -46.347 2.345 -4.038 1.00 0.00 C ATOM 970 CG1 ILE A 310 -45.727 3.524 -4.797 1.00 0.00 C ATOM 971 CG2 ILE A 310 -46.977 1.354 -5.007 1.00 0.00 C ATOM 972 CD1 ILE A 310 -46.729 4.339 -5.588 1.00 0.00 C ATOM 0 H ILE A 310 -45.795 3.909 -2.171 1.00 0.00 H new ATOM 0 HA ILE A 310 -48.173 3.390 -3.552 1.00 0.00 H new ATOM 0 HB ILE A 310 -45.554 1.833 -3.493 1.00 0.00 H new ATOM 0 HG12 ILE A 310 -45.223 4.177 -4.085 1.00 0.00 H new ATOM 0 HG13 ILE A 310 -44.964 3.145 -5.477 1.00 0.00 H new ATOM 0 HG21 ILE A 310 -46.225 1.011 -5.718 1.00 0.00 H new ATOM 0 HG22 ILE A 310 -47.367 0.501 -4.452 1.00 0.00 H new ATOM 0 HG23 ILE A 310 -47.791 1.839 -5.546 1.00 0.00 H new ATOM 0 HD11 ILE A 310 -46.214 5.154 -6.097 1.00 0.00 H new ATOM 0 HD12 ILE A 310 -47.216 3.701 -6.325 1.00 0.00 H new ATOM 0 HD13 ILE A 310 -47.479 4.749 -4.912 1.00 0.00 H new ATOM 984 N GLN A 311 -47.292 1.138 -1.303 1.00 0.00 N ATOM 985 CA GLN A 311 -47.758 -0.011 -0.533 1.00 0.00 C ATOM 986 C GLN A 311 -49.066 0.296 0.193 1.00 0.00 C ATOM 987 O GLN A 311 -49.985 -0.523 0.204 1.00 0.00 O ATOM 988 CB GLN A 311 -46.690 -0.434 0.479 1.00 0.00 C ATOM 989 CG GLN A 311 -47.112 -1.599 1.359 1.00 0.00 C ATOM 990 CD GLN A 311 -46.055 -1.972 2.380 1.00 0.00 C ATOM 991 OE1 GLN A 311 -45.655 -1.151 3.205 1.00 0.00 O ATOM 992 NE2 GLN A 311 -45.597 -3.218 2.330 1.00 0.00 N ATOM 0 H GLN A 311 -46.387 1.503 -1.007 1.00 0.00 H new ATOM 0 HA GLN A 311 -47.942 -0.827 -1.231 1.00 0.00 H new ATOM 0 HB2 GLN A 311 -45.781 -0.706 -0.057 1.00 0.00 H new ATOM 0 HB3 GLN A 311 -46.444 0.418 1.112 1.00 0.00 H new ATOM 0 HG2 GLN A 311 -48.037 -1.343 1.876 1.00 0.00 H new ATOM 0 HG3 GLN A 311 -47.327 -2.464 0.732 1.00 0.00 H new ATOM 0 HE21 GLN A 311 -45.957 -3.866 1.629 1.00 0.00 H new ATOM 0 HE22 GLN A 311 -44.886 -3.527 2.992 1.00 0.00 H new ATOM 1001 N GLU A 312 -49.137 1.470 0.812 1.00 0.00 N ATOM 1002 CA GLU A 312 -50.326 1.877 1.556 1.00 0.00 C ATOM 1003 C GLU A 312 -51.537 2.048 0.644 1.00 0.00 C ATOM 1004 O GLU A 312 -52.635 1.593 0.967 1.00 0.00 O ATOM 1005 CB GLU A 312 -50.056 3.177 2.313 1.00 0.00 C ATOM 1006 CG GLU A 312 -48.936 3.063 3.333 1.00 0.00 C ATOM 1007 CD GLU A 312 -48.685 4.363 4.073 1.00 0.00 C ATOM 1008 OE1 GLU A 312 -48.363 5.371 3.410 1.00 0.00 O ATOM 1009 OE2 GLU A 312 -48.811 4.372 5.316 1.00 0.00 O ATOM 0 H GLU A 312 -48.384 2.158 0.814 1.00 0.00 H new ATOM 0 HA GLU A 312 -50.555 1.083 2.267 1.00 0.00 H new ATOM 0 HB2 GLU A 312 -49.806 3.960 1.597 1.00 0.00 H new ATOM 0 HB3 GLU A 312 -50.969 3.489 2.821 1.00 0.00 H new ATOM 0 HG2 GLU A 312 -49.183 2.282 4.052 1.00 0.00 H new ATOM 0 HG3 GLU A 312 -48.020 2.754 2.829 1.00 0.00 H new ATOM 1016 N SER A 313 -51.337 2.713 -0.487 1.00 0.00 N ATOM 1017 CA SER A 313 -52.421 2.951 -1.437 1.00 0.00 C ATOM 1018 C SER A 313 -52.982 1.638 -1.977 1.00 0.00 C ATOM 1019 O SER A 313 -54.196 1.424 -1.977 1.00 0.00 O ATOM 1020 CB SER A 313 -51.930 3.823 -2.594 1.00 0.00 C ATOM 1021 OG SER A 313 -50.879 3.190 -3.302 1.00 0.00 O ATOM 0 H SER A 313 -50.436 3.098 -0.770 1.00 0.00 H new ATOM 0 HA SER A 313 -53.220 3.471 -0.909 1.00 0.00 H new ATOM 0 HB2 SER A 313 -52.757 4.030 -3.273 1.00 0.00 H new ATOM 0 HB3 SER A 313 -51.586 4.783 -2.209 1.00 0.00 H new ATOM 0 HG SER A 313 -50.369 2.620 -2.689 1.00 0.00 H new ATOM 1027 N LEU A 314 -52.094 0.764 -2.436 1.00 0.00 N ATOM 1028 CA LEU A 314 -52.499 -0.528 -2.981 1.00 0.00 C ATOM 1029 C LEU A 314 -53.167 -1.389 -1.914 1.00 0.00 C ATOM 1030 O LEU A 314 -54.159 -2.067 -2.182 1.00 0.00 O ATOM 1031 CB LEU A 314 -51.289 -1.260 -3.566 1.00 0.00 C ATOM 1032 CG LEU A 314 -50.604 -0.549 -4.737 1.00 0.00 C ATOM 1033 CD1 LEU A 314 -49.386 -1.333 -5.201 1.00 0.00 C ATOM 1034 CD2 LEU A 314 -51.580 -0.352 -5.889 1.00 0.00 C ATOM 0 H LEU A 314 -51.087 0.926 -2.442 1.00 0.00 H new ATOM 0 HA LEU A 314 -53.223 -0.347 -3.775 1.00 0.00 H new ATOM 0 HB2 LEU A 314 -50.556 -1.410 -2.773 1.00 0.00 H new ATOM 0 HB3 LEU A 314 -51.607 -2.249 -3.897 1.00 0.00 H new ATOM 0 HG LEU A 314 -50.273 0.431 -4.394 1.00 0.00 H new ATOM 0 HD11 LEU A 314 -48.913 -0.812 -6.033 1.00 0.00 H new ATOM 0 HD12 LEU A 314 -48.676 -1.423 -4.379 1.00 0.00 H new ATOM 0 HD13 LEU A 314 -49.695 -2.327 -5.524 1.00 0.00 H new ATOM 0 HD21 LEU A 314 -51.075 0.155 -6.711 1.00 0.00 H new ATOM 0 HD22 LEU A 314 -51.943 -1.322 -6.229 1.00 0.00 H new ATOM 0 HD23 LEU A 314 -52.422 0.253 -5.553 1.00 0.00 H new ATOM 1046 N ARG A 315 -52.616 -1.360 -0.704 1.00 0.00 N ATOM 1047 CA ARG A 315 -53.157 -2.139 0.405 1.00 0.00 C ATOM 1048 C ARG A 315 -54.590 -1.724 0.722 1.00 0.00 C ATOM 1049 O ARG A 315 -55.465 -2.571 0.896 1.00 0.00 O ATOM 1050 CB ARG A 315 -52.279 -1.972 1.648 1.00 0.00 C ATOM 1051 CG ARG A 315 -52.823 -2.679 2.879 1.00 0.00 C ATOM 1052 CD ARG A 315 -51.897 -2.511 4.072 1.00 0.00 C ATOM 1053 NE ARG A 315 -52.440 -3.130 5.279 1.00 0.00 N ATOM 1054 CZ ARG A 315 -51.812 -3.137 6.451 1.00 0.00 C ATOM 1055 NH1 ARG A 315 -50.617 -2.572 6.572 1.00 0.00 N ATOM 1056 NH2 ARG A 315 -52.377 -3.711 7.504 1.00 0.00 N ATOM 0 H ARG A 315 -51.794 -0.805 -0.466 1.00 0.00 H new ATOM 0 HA ARG A 315 -53.162 -3.188 0.107 1.00 0.00 H new ATOM 0 HB2 ARG A 315 -51.281 -2.354 1.431 1.00 0.00 H new ATOM 0 HB3 ARG A 315 -52.173 -0.910 1.867 1.00 0.00 H new ATOM 0 HG2 ARG A 315 -53.808 -2.281 3.123 1.00 0.00 H new ATOM 0 HG3 ARG A 315 -52.952 -3.740 2.664 1.00 0.00 H new ATOM 0 HD2 ARG A 315 -50.927 -2.953 3.843 1.00 0.00 H new ATOM 0 HD3 ARG A 315 -51.729 -1.449 4.253 1.00 0.00 H new ATOM 0 HE ARG A 315 -53.352 -3.582 5.219 1.00 0.00 H new ATOM 0 HH11 ARG A 315 -50.177 -2.131 5.764 1.00 0.00 H new ATOM 0 HH12 ARG A 315 -50.138 -2.579 7.473 1.00 0.00 H new ATOM 0 HH21 ARG A 315 -53.294 -4.148 7.416 1.00 0.00 H new ATOM 0 HH22 ARG A 315 -51.894 -3.716 8.403 1.00 0.00 H new ATOM 1070 N GLU A 316 -54.821 -0.418 0.801 1.00 0.00 N ATOM 1071 CA GLU A 316 -56.148 0.107 1.103 1.00 0.00 C ATOM 1072 C GLU A 316 -57.144 -0.242 0.002 1.00 0.00 C ATOM 1073 O GLU A 316 -58.295 -0.578 0.279 1.00 0.00 O ATOM 1074 CB GLU A 316 -56.090 1.624 1.293 1.00 0.00 C ATOM 1075 CG GLU A 316 -57.434 2.244 1.638 1.00 0.00 C ATOM 1076 CD GLU A 316 -57.354 3.746 1.825 1.00 0.00 C ATOM 1077 OE1 GLU A 316 -56.610 4.194 2.722 1.00 0.00 O ATOM 1078 OE2 GLU A 316 -58.034 4.475 1.072 1.00 0.00 O ATOM 0 H GLU A 316 -54.107 0.296 0.660 1.00 0.00 H new ATOM 0 HA GLU A 316 -56.487 -0.357 2.029 1.00 0.00 H new ATOM 0 HB2 GLU A 316 -55.378 1.856 2.085 1.00 0.00 H new ATOM 0 HB3 GLU A 316 -55.711 2.082 0.379 1.00 0.00 H new ATOM 0 HG2 GLU A 316 -58.148 2.018 0.846 1.00 0.00 H new ATOM 0 HG3 GLU A 316 -57.816 1.788 2.551 1.00 0.00 H new ATOM 1085 N ALA A 317 -56.699 -0.148 -1.247 1.00 0.00 N ATOM 1086 CA ALA A 317 -57.559 -0.444 -2.389 1.00 0.00 C ATOM 1087 C ALA A 317 -58.034 -1.895 -2.378 1.00 0.00 C ATOM 1088 O ALA A 317 -59.229 -2.166 -2.496 1.00 0.00 O ATOM 1089 CB ALA A 317 -56.829 -0.137 -3.688 1.00 0.00 C ATOM 0 H ALA A 317 -55.749 0.130 -1.495 1.00 0.00 H new ATOM 0 HA ALA A 317 -58.441 0.192 -2.314 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -57.480 -0.362 -4.533 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -56.555 0.918 -3.711 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -55.928 -0.747 -3.752 1.00 0.00 H new ATOM 1095 N GLU A 318 -57.092 -2.825 -2.244 1.00 0.00 N ATOM 1096 CA GLU A 318 -57.419 -4.248 -2.228 1.00 0.00 C ATOM 1097 C GLU A 318 -58.254 -4.610 -1.003 1.00 0.00 C ATOM 1098 O GLU A 318 -59.249 -5.327 -1.110 1.00 0.00 O ATOM 1099 CB GLU A 318 -56.141 -5.089 -2.255 1.00 0.00 C ATOM 1100 CG GLU A 318 -56.402 -6.587 -2.299 1.00 0.00 C ATOM 1101 CD GLU A 318 -55.126 -7.405 -2.349 1.00 0.00 C ATOM 1102 OE1 GLU A 318 -54.032 -6.802 -2.349 1.00 0.00 O ATOM 1103 OE2 GLU A 318 -55.221 -8.649 -2.389 1.00 0.00 O ATOM 0 H GLU A 318 -56.098 -2.619 -2.145 1.00 0.00 H new ATOM 0 HA GLU A 318 -58.008 -4.464 -3.119 1.00 0.00 H new ATOM 0 HB2 GLU A 318 -55.547 -4.806 -3.124 1.00 0.00 H new ATOM 0 HB3 GLU A 318 -55.544 -4.858 -1.373 1.00 0.00 H new ATOM 0 HG2 GLU A 318 -56.979 -6.876 -1.421 1.00 0.00 H new ATOM 0 HG3 GLU A 318 -57.012 -6.819 -3.172 1.00 0.00 H new ATOM 1110 N GLU A 319 -57.841 -4.111 0.158 1.00 0.00 N ATOM 1111 CA GLU A 319 -58.549 -4.383 1.404 1.00 0.00 C ATOM 1112 C GLU A 319 -59.992 -3.897 1.326 1.00 0.00 C ATOM 1113 O GLU A 319 -60.912 -4.580 1.774 1.00 0.00 O ATOM 1114 CB GLU A 319 -57.834 -3.712 2.579 1.00 0.00 C ATOM 1115 CG GLU A 319 -58.490 -3.981 3.924 1.00 0.00 C ATOM 1116 CD GLU A 319 -57.757 -3.322 5.077 1.00 0.00 C ATOM 1117 OE1 GLU A 319 -56.740 -2.641 4.825 1.00 0.00 O ATOM 1118 OE2 GLU A 319 -58.201 -3.486 6.233 1.00 0.00 O ATOM 0 H GLU A 319 -57.019 -3.516 0.262 1.00 0.00 H new ATOM 0 HA GLU A 319 -58.556 -5.462 1.561 1.00 0.00 H new ATOM 0 HB2 GLU A 319 -56.801 -4.060 2.612 1.00 0.00 H new ATOM 0 HB3 GLU A 319 -57.803 -2.636 2.408 1.00 0.00 H new ATOM 0 HG2 GLU A 319 -59.519 -3.621 3.900 1.00 0.00 H new ATOM 0 HG3 GLU A 319 -58.533 -5.057 4.094 1.00 0.00 H new ATOM 1125 N ALA A 320 -60.179 -2.711 0.757 1.00 0.00 N ATOM 1126 CA ALA A 320 -61.508 -2.127 0.620 1.00 0.00 C ATOM 1127 C ALA A 320 -62.382 -2.952 -0.319 1.00 0.00 C ATOM 1128 O ALA A 320 -63.558 -3.186 -0.040 1.00 0.00 O ATOM 1129 CB ALA A 320 -61.404 -0.693 0.125 1.00 0.00 C ATOM 0 H ALA A 320 -59.425 -2.134 0.383 1.00 0.00 H new ATOM 0 HA ALA A 320 -61.980 -2.129 1.603 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -62.403 -0.269 0.027 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -60.827 -0.103 0.837 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -60.907 -0.678 -0.845 1.00 0.00 H new ATOM 1135 N LYS A 321 -61.804 -3.387 -1.434 1.00 0.00 N ATOM 1136 CA LYS A 321 -62.536 -4.183 -2.414 1.00 0.00 C ATOM 1137 C LYS A 321 -63.032 -5.489 -1.797 1.00 0.00 C ATOM 1138 O LYS A 321 -64.189 -5.869 -1.975 1.00 0.00 O ATOM 1139 CB LYS A 321 -61.651 -4.477 -3.627 1.00 0.00 C ATOM 1140 CG LYS A 321 -62.348 -5.280 -4.714 1.00 0.00 C ATOM 1141 CD LYS A 321 -61.431 -5.514 -5.904 1.00 0.00 C ATOM 1142 CE LYS A 321 -62.130 -6.295 -7.006 1.00 0.00 C ATOM 1143 NZ LYS A 321 -63.325 -5.575 -7.527 1.00 0.00 N ATOM 0 H LYS A 321 -60.832 -3.202 -1.682 1.00 0.00 H new ATOM 0 HA LYS A 321 -63.403 -3.607 -2.738 1.00 0.00 H new ATOM 0 HB2 LYS A 321 -61.305 -3.534 -4.050 1.00 0.00 H new ATOM 0 HB3 LYS A 321 -60.766 -5.021 -3.296 1.00 0.00 H new ATOM 0 HG2 LYS A 321 -62.673 -6.238 -4.309 1.00 0.00 H new ATOM 0 HG3 LYS A 321 -63.244 -4.752 -5.041 1.00 0.00 H new ATOM 0 HD2 LYS A 321 -61.092 -4.555 -6.296 1.00 0.00 H new ATOM 0 HD3 LYS A 321 -60.544 -6.058 -5.579 1.00 0.00 H new ATOM 0 HE2 LYS A 321 -61.431 -6.475 -7.822 1.00 0.00 H new ATOM 0 HE3 LYS A 321 -62.432 -7.270 -6.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 321 -63.642 -6.022 -8.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 321 -64.090 -5.618 -6.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 321 -63.079 -4.581 -7.711 1.00 0.00 H new ATOM 1157 N LEU A 322 -62.152 -6.169 -1.069 1.00 0.00 N ATOM 1158 CA LEU A 322 -62.505 -7.429 -0.423 1.00 0.00 C ATOM 1159 C LEU A 322 -63.550 -7.207 0.667 1.00 0.00 C ATOM 1160 O LEU A 322 -64.540 -7.933 0.752 1.00 0.00 O ATOM 1161 CB LEU A 322 -61.260 -8.086 0.170 1.00 0.00 C ATOM 1162 CG LEU A 322 -60.177 -8.468 -0.843 1.00 0.00 C ATOM 1163 CD1 LEU A 322 -58.946 -9.009 -0.131 1.00 0.00 C ATOM 1164 CD2 LEU A 322 -60.710 -9.493 -1.834 1.00 0.00 C ATOM 0 H LEU A 322 -61.190 -5.869 -0.911 1.00 0.00 H new ATOM 0 HA LEU A 322 -62.931 -8.091 -1.177 1.00 0.00 H new ATOM 0 HB2 LEU A 322 -60.825 -7.407 0.903 1.00 0.00 H new ATOM 0 HB3 LEU A 322 -61.564 -8.984 0.708 1.00 0.00 H new ATOM 0 HG LEU A 322 -59.891 -7.571 -1.393 1.00 0.00 H new ATOM 0 HD11 LEU A 322 -58.187 -9.275 -0.867 1.00 0.00 H new ATOM 0 HD12 LEU A 322 -58.549 -8.247 0.540 1.00 0.00 H new ATOM 0 HD13 LEU A 322 -59.218 -9.893 0.445 1.00 0.00 H new ATOM 0 HD21 LEU A 322 -59.926 -9.752 -2.546 1.00 0.00 H new ATOM 0 HD22 LEU A 322 -61.024 -10.389 -1.298 1.00 0.00 H new ATOM 0 HD23 LEU A 322 -61.562 -9.073 -2.369 1.00 0.00 H new