USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 448 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 Set 1.1: A 303 THR OG1 : rot 118:sc= 0.201 USER MOD Set 1.2: A 305 CYS SG : rot 180:sc= 0.276 USER MOD Set 2.1: A 297 TYR OH : rot 46:sc= 0.408 USER MOD Set 2.2: A 306 SER OG : rot 180:sc= 0.382 USER MOD Set 3.1: A 288 GLN : amide:sc= 0.0161 X(o=-0.018,f=0.29) USER MOD Set 3.2: A 291 THR OG1 : rot 150:sc= -0.0343 USER MOD Single : A 258 THR OG1 : rot 180:sc= 0 USER MOD Single : A 260 GLN : amide:sc= -4.18! C(o=-4.2!,f=-5.4!) USER MOD Single : A 263 TYR OH : rot 180:sc= 0 USER MOD Single : A 265 TYR OH : rot 79:sc= 0.199 USER MOD Single : A 266 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 GLN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 269 ASN : amide:sc= -8.25! C(o=-8.3!,f=-13!) USER MOD Single : A 283 MET CE :methyl -141:sc= -1.3 (180deg=-2.49) USER MOD Single : A 284 SER OG : rot 180:sc= -0.921 USER MOD Single : A 286 MET CE :methyl 161:sc= -0.0387 (180deg=-0.356) USER MOD Single : A 289 THR OG1 : rot -0:sc= 0.629! USER MOD Single : A 290 SER OG : rot 180:sc= 0 USER MOD Single : A 292 SER OG : rot 180:sc= 0 USER MOD Single : A 299 THR OG1 : rot -160:sc= -1.1 USER MOD Single : A 300 SER OG : rot 180:sc= 0 USER MOD Single : A 302 THR OG1 : rot 171:sc= -0.0423 USER MOD Single : A 312 ASN : amide:sc= -0.49 X(o=-0.49,f=-0.33) USER MOD Single : A 313 TYR OH : rot 180:sc= 0 USER MOD Single : A 315 THR OG1 : rot 180:sc= 0 USER MOD Single : A 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 217 N GLU A 257 5.703 0.789 -3.293 1.00 0.00 N ATOM 218 CA GLU A 257 5.418 1.747 -4.355 1.00 0.00 C ATOM 219 C GLU A 257 4.465 2.834 -3.866 1.00 0.00 C ATOM 220 O GLU A 257 3.913 2.745 -2.769 1.00 0.00 O ATOM 221 CB GLU A 257 4.815 1.034 -5.567 1.00 0.00 C ATOM 222 CG GLU A 257 5.853 0.545 -6.564 1.00 0.00 C ATOM 223 CD GLU A 257 6.783 1.650 -7.027 1.00 0.00 C ATOM 224 OE1 GLU A 257 6.316 2.801 -7.160 1.00 0.00 O ATOM 225 OE2 GLU A 257 7.976 1.364 -7.256 1.00 0.00 O ATOM 0 HA GLU A 257 6.358 2.216 -4.648 1.00 0.00 H new ATOM 0 HB2 GLU A 257 4.226 0.184 -5.222 1.00 0.00 H new ATOM 0 HB3 GLU A 257 4.129 1.713 -6.073 1.00 0.00 H new ATOM 0 HG2 GLU A 257 6.441 -0.253 -6.109 1.00 0.00 H new ATOM 0 HG3 GLU A 257 5.347 0.115 -7.428 1.00 0.00 H new ATOM 232 N THR A 258 4.278 3.863 -4.687 1.00 0.00 N ATOM 233 CA THR A 258 3.395 4.968 -4.339 1.00 0.00 C ATOM 234 C THR A 258 2.468 5.318 -5.498 1.00 0.00 C ATOM 235 O THR A 258 2.918 5.519 -6.627 1.00 0.00 O ATOM 236 CB THR A 258 4.196 6.223 -3.940 1.00 0.00 C ATOM 237 OG1 THR A 258 5.336 5.848 -3.159 1.00 0.00 O ATOM 238 CG2 THR A 258 3.328 7.189 -3.148 1.00 0.00 C ATOM 0 H THR A 258 4.727 3.953 -5.598 1.00 0.00 H new ATOM 0 HA THR A 258 2.799 4.640 -3.487 1.00 0.00 H new ATOM 0 HB THR A 258 4.528 6.721 -4.851 1.00 0.00 H new ATOM 0 HG1 THR A 258 5.841 6.650 -2.911 1.00 0.00 H new ATOM 0 HG21 THR A 258 3.914 8.067 -2.877 1.00 0.00 H new ATOM 0 HG22 THR A 258 2.476 7.495 -3.756 1.00 0.00 H new ATOM 0 HG23 THR A 258 2.970 6.698 -2.243 1.00 0.00 H new ATOM 246 N LEU A 259 1.173 5.390 -5.212 1.00 0.00 N ATOM 247 CA LEU A 259 0.182 5.717 -6.231 1.00 0.00 C ATOM 248 C LEU A 259 -0.736 6.840 -5.758 1.00 0.00 C ATOM 249 O LEU A 259 -1.002 6.975 -4.564 1.00 0.00 O ATOM 250 CB LEU A 259 -0.646 4.479 -6.581 1.00 0.00 C ATOM 251 CG LEU A 259 0.131 3.170 -6.724 1.00 0.00 C ATOM 252 CD1 LEU A 259 -0.821 1.985 -6.753 1.00 0.00 C ATOM 253 CD2 LEU A 259 0.993 3.196 -7.978 1.00 0.00 C ATOM 0 H LEU A 259 0.785 5.226 -4.283 1.00 0.00 H new ATOM 0 HA LEU A 259 0.711 6.056 -7.121 1.00 0.00 H new ATOM 0 HB2 LEU A 259 -1.406 4.345 -5.811 1.00 0.00 H new ATOM 0 HB3 LEU A 259 -1.171 4.671 -7.517 1.00 0.00 H new ATOM 0 HG LEU A 259 0.786 3.062 -5.860 1.00 0.00 H new ATOM 0 HD11 LEU A 259 -0.250 1.062 -6.855 1.00 0.00 H new ATOM 0 HD12 LEU A 259 -1.394 1.956 -5.826 1.00 0.00 H new ATOM 0 HD13 LEU A 259 -1.502 2.086 -7.598 1.00 0.00 H new ATOM 0 HD21 LEU A 259 1.539 2.256 -8.064 1.00 0.00 H new ATOM 0 HD22 LEU A 259 0.357 3.328 -8.854 1.00 0.00 H new ATOM 0 HD23 LEU A 259 1.701 4.023 -7.916 1.00 0.00 H new ATOM 265 N GLN A 260 -1.218 7.641 -6.702 1.00 0.00 N ATOM 266 CA GLN A 260 -2.108 8.750 -6.381 1.00 0.00 C ATOM 267 C GLN A 260 -3.530 8.462 -6.851 1.00 0.00 C ATOM 268 O GLN A 260 -3.761 8.175 -8.026 1.00 0.00 O ATOM 269 CB GLN A 260 -1.599 10.042 -7.024 1.00 0.00 C ATOM 270 CG GLN A 260 -2.332 11.287 -6.550 1.00 0.00 C ATOM 271 CD GLN A 260 -3.600 11.552 -7.338 1.00 0.00 C ATOM 272 OE1 GLN A 260 -3.734 11.123 -8.484 1.00 0.00 O ATOM 273 NE2 GLN A 260 -4.539 12.264 -6.726 1.00 0.00 N ATOM 0 H GLN A 260 -1.007 7.543 -7.695 1.00 0.00 H new ATOM 0 HA GLN A 260 -2.120 8.870 -5.298 1.00 0.00 H new ATOM 0 HB2 GLN A 260 -0.536 10.152 -6.808 1.00 0.00 H new ATOM 0 HB3 GLN A 260 -1.697 9.963 -8.107 1.00 0.00 H new ATOM 0 HG2 GLN A 260 -2.581 11.178 -5.494 1.00 0.00 H new ATOM 0 HG3 GLN A 260 -1.669 12.148 -6.634 1.00 0.00 H new ATOM 0 HE21 GLN A 260 -4.386 12.600 -5.775 1.00 0.00 H new ATOM 0 HE22 GLN A 260 -5.414 12.475 -7.207 1.00 0.00 H new ATOM 282 N VAL A 261 -4.481 8.538 -5.925 1.00 0.00 N ATOM 283 CA VAL A 261 -5.881 8.285 -6.244 1.00 0.00 C ATOM 284 C VAL A 261 -6.376 9.233 -7.330 1.00 0.00 C ATOM 285 O VAL A 261 -6.062 10.424 -7.320 1.00 0.00 O ATOM 286 CB VAL A 261 -6.776 8.435 -4.999 1.00 0.00 C ATOM 287 CG1 VAL A 261 -8.237 8.226 -5.364 1.00 0.00 C ATOM 288 CG2 VAL A 261 -6.344 7.462 -3.913 1.00 0.00 C ATOM 0 H VAL A 261 -4.307 8.773 -4.948 1.00 0.00 H new ATOM 0 HA VAL A 261 -5.944 7.259 -6.605 1.00 0.00 H new ATOM 0 HB VAL A 261 -6.665 9.448 -4.612 1.00 0.00 H new ATOM 0 HG11 VAL A 261 -8.854 8.336 -4.472 1.00 0.00 H new ATOM 0 HG12 VAL A 261 -8.536 8.967 -6.106 1.00 0.00 H new ATOM 0 HG13 VAL A 261 -8.370 7.226 -5.776 1.00 0.00 H new ATOM 0 HG21 VAL A 261 -6.987 7.581 -3.041 1.00 0.00 H new ATOM 0 HG22 VAL A 261 -6.425 6.441 -4.286 1.00 0.00 H new ATOM 0 HG23 VAL A 261 -5.310 7.665 -3.633 1.00 0.00 H new ATOM 298 N ILE A 262 -7.153 8.698 -8.266 1.00 0.00 N ATOM 299 CA ILE A 262 -7.694 9.497 -9.358 1.00 0.00 C ATOM 300 C ILE A 262 -9.216 9.562 -9.291 1.00 0.00 C ATOM 301 O ILE A 262 -9.845 10.359 -9.987 1.00 0.00 O ATOM 302 CB ILE A 262 -7.276 8.933 -10.729 1.00 0.00 C ATOM 303 CG1 ILE A 262 -7.129 7.411 -10.655 1.00 0.00 C ATOM 304 CG2 ILE A 262 -5.976 9.574 -11.191 1.00 0.00 C ATOM 305 CD1 ILE A 262 -7.040 6.747 -12.011 1.00 0.00 C ATOM 0 H ILE A 262 -7.422 7.714 -8.290 1.00 0.00 H new ATOM 0 HA ILE A 262 -7.285 10.501 -9.247 1.00 0.00 H new ATOM 0 HB ILE A 262 -8.053 9.170 -11.456 1.00 0.00 H new ATOM 0 HG12 ILE A 262 -6.235 7.168 -10.081 1.00 0.00 H new ATOM 0 HG13 ILE A 262 -7.979 6.998 -10.112 1.00 0.00 H new ATOM 0 HG21 ILE A 262 -5.693 9.165 -12.161 1.00 0.00 H new ATOM 0 HG22 ILE A 262 -6.112 10.652 -11.277 1.00 0.00 H new ATOM 0 HG23 ILE A 262 -5.189 9.365 -10.466 1.00 0.00 H new ATOM 0 HD11 ILE A 262 -6.937 5.669 -11.882 1.00 0.00 H new ATOM 0 HD12 ILE A 262 -7.945 6.960 -12.580 1.00 0.00 H new ATOM 0 HD13 ILE A 262 -6.174 7.132 -12.549 1.00 0.00 H new ATOM 317 N TYR A 263 -9.802 8.719 -8.447 1.00 0.00 N ATOM 318 CA TYR A 263 -11.251 8.680 -8.289 1.00 0.00 C ATOM 319 C TYR A 263 -11.637 7.985 -6.987 1.00 0.00 C ATOM 320 O TYR A 263 -10.998 7.028 -6.550 1.00 0.00 O ATOM 321 CB TYR A 263 -11.895 7.960 -9.475 1.00 0.00 C ATOM 322 CG TYR A 263 -11.551 8.572 -10.814 1.00 0.00 C ATOM 323 CD1 TYR A 263 -12.255 9.666 -11.302 1.00 0.00 C ATOM 324 CD2 TYR A 263 -10.520 8.056 -11.591 1.00 0.00 C ATOM 325 CE1 TYR A 263 -11.944 10.227 -12.526 1.00 0.00 C ATOM 326 CE2 TYR A 263 -10.201 8.612 -12.815 1.00 0.00 C ATOM 327 CZ TYR A 263 -10.916 9.697 -13.278 1.00 0.00 C ATOM 328 OH TYR A 263 -10.602 10.254 -14.496 1.00 0.00 O ATOM 0 H TYR A 263 -9.296 8.054 -7.862 1.00 0.00 H new ATOM 0 HA TYR A 263 -11.616 9.707 -8.254 1.00 0.00 H new ATOM 0 HB2 TYR A 263 -11.580 6.916 -9.470 1.00 0.00 H new ATOM 0 HB3 TYR A 263 -12.978 7.967 -9.349 1.00 0.00 H new ATOM 0 HD1 TYR A 263 -13.059 10.085 -10.715 1.00 0.00 H new ATOM 0 HD2 TYR A 263 -9.959 7.206 -11.232 1.00 0.00 H new ATOM 0 HE1 TYR A 263 -12.503 11.076 -12.892 1.00 0.00 H new ATOM 0 HE2 TYR A 263 -9.397 8.200 -13.406 1.00 0.00 H new ATOM 0 HH TYR A 263 -9.854 9.764 -14.897 1.00 0.00 H new ATOM 338 N PRO A 264 -12.711 8.477 -6.351 1.00 0.00 N ATOM 339 CA PRO A 264 -13.210 7.919 -5.091 1.00 0.00 C ATOM 340 C PRO A 264 -13.829 6.538 -5.273 1.00 0.00 C ATOM 341 O PRO A 264 -14.399 6.236 -6.322 1.00 0.00 O ATOM 342 CB PRO A 264 -14.274 8.929 -4.652 1.00 0.00 C ATOM 343 CG PRO A 264 -14.726 9.575 -5.916 1.00 0.00 C ATOM 344 CD PRO A 264 -13.521 9.616 -6.815 1.00 0.00 C ATOM 0 HA PRO A 264 -12.411 7.778 -4.363 1.00 0.00 H new ATOM 0 HB2 PRO A 264 -15.101 8.436 -4.141 1.00 0.00 H new ATOM 0 HB3 PRO A 264 -13.862 9.662 -3.958 1.00 0.00 H new ATOM 0 HG2 PRO A 264 -15.536 9.009 -6.375 1.00 0.00 H new ATOM 0 HG3 PRO A 264 -15.106 10.579 -5.727 1.00 0.00 H new ATOM 0 HD2 PRO A 264 -13.798 9.511 -7.864 1.00 0.00 H new ATOM 0 HD3 PRO A 264 -12.981 10.558 -6.721 1.00 0.00 H new ATOM 352 N TYR A 265 -13.714 5.703 -4.247 1.00 0.00 N ATOM 353 CA TYR A 265 -14.262 4.352 -4.295 1.00 0.00 C ATOM 354 C TYR A 265 -14.920 3.984 -2.969 1.00 0.00 C ATOM 355 O TYR A 265 -14.371 4.238 -1.896 1.00 0.00 O ATOM 356 CB TYR A 265 -13.160 3.345 -4.627 1.00 0.00 C ATOM 357 CG TYR A 265 -13.539 1.912 -4.326 1.00 0.00 C ATOM 358 CD1 TYR A 265 -14.366 1.197 -5.183 1.00 0.00 C ATOM 359 CD2 TYR A 265 -13.070 1.274 -3.184 1.00 0.00 C ATOM 360 CE1 TYR A 265 -14.715 -0.112 -4.912 1.00 0.00 C ATOM 361 CE2 TYR A 265 -13.413 -0.035 -2.905 1.00 0.00 C ATOM 362 CZ TYR A 265 -14.236 -0.723 -3.772 1.00 0.00 C ATOM 363 OH TYR A 265 -14.581 -2.027 -3.497 1.00 0.00 O ATOM 0 H TYR A 265 -13.246 5.937 -3.371 1.00 0.00 H new ATOM 0 HA TYR A 265 -15.021 4.322 -5.077 1.00 0.00 H new ATOM 0 HB2 TYR A 265 -12.907 3.431 -5.684 1.00 0.00 H new ATOM 0 HB3 TYR A 265 -12.263 3.601 -4.063 1.00 0.00 H new ATOM 0 HD1 TYR A 265 -14.743 1.673 -6.077 1.00 0.00 H new ATOM 0 HD2 TYR A 265 -12.426 1.811 -2.503 1.00 0.00 H new ATOM 0 HE1 TYR A 265 -15.359 -0.654 -5.589 1.00 0.00 H new ATOM 0 HE2 TYR A 265 -13.039 -0.517 -2.014 1.00 0.00 H new ATOM 0 HH TYR A 265 -14.031 -2.632 -4.038 1.00 0.00 H new ATOM 373 N THR A 266 -16.103 3.382 -3.050 1.00 0.00 N ATOM 374 CA THR A 266 -16.839 2.978 -1.859 1.00 0.00 C ATOM 375 C THR A 266 -16.756 1.471 -1.646 1.00 0.00 C ATOM 376 O THR A 266 -17.398 0.685 -2.343 1.00 0.00 O ATOM 377 CB THR A 266 -18.320 3.392 -1.945 1.00 0.00 C ATOM 378 OG1 THR A 266 -18.423 4.751 -2.385 1.00 0.00 O ATOM 379 CG2 THR A 266 -19.005 3.237 -0.596 1.00 0.00 C ATOM 0 H THR A 266 -16.572 3.164 -3.929 1.00 0.00 H new ATOM 0 HA THR A 266 -16.376 3.488 -1.014 1.00 0.00 H new ATOM 0 HB THR A 266 -18.816 2.739 -2.663 1.00 0.00 H new ATOM 0 HG1 THR A 266 -19.368 5.007 -2.439 1.00 0.00 H new ATOM 0 HG21 THR A 266 -20.050 3.535 -0.682 1.00 0.00 H new ATOM 0 HG22 THR A 266 -18.950 2.196 -0.277 1.00 0.00 H new ATOM 0 HG23 THR A 266 -18.507 3.868 0.140 1.00 0.00 H new ATOM 387 N PRO A 267 -15.947 1.055 -0.660 1.00 0.00 N ATOM 388 CA PRO A 267 -15.763 -0.362 -0.332 1.00 0.00 C ATOM 389 C PRO A 267 -17.008 -0.978 0.296 1.00 0.00 C ATOM 390 O PRO A 267 -17.956 -0.272 0.636 1.00 0.00 O ATOM 391 CB PRO A 267 -14.608 -0.346 0.673 1.00 0.00 C ATOM 392 CG PRO A 267 -14.662 1.009 1.290 1.00 0.00 C ATOM 393 CD PRO A 267 -15.151 1.936 0.211 1.00 0.00 C ATOM 0 HA PRO A 267 -15.566 -0.964 -1.219 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -14.725 -1.128 1.423 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -13.651 -0.519 0.180 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -15.334 1.020 2.148 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -13.679 1.313 1.650 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -15.753 2.747 0.620 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -14.324 2.395 -0.330 1.00 0.00 H new ATOM 401 N GLN A 268 -16.997 -2.299 0.448 1.00 0.00 N ATOM 402 CA GLN A 268 -18.126 -3.009 1.035 1.00 0.00 C ATOM 403 C GLN A 268 -17.678 -3.860 2.219 1.00 0.00 C ATOM 404 O GLN A 268 -18.495 -4.288 3.033 1.00 0.00 O ATOM 405 CB GLN A 268 -18.803 -3.892 -0.015 1.00 0.00 C ATOM 406 CG GLN A 268 -19.114 -3.164 -1.312 1.00 0.00 C ATOM 407 CD GLN A 268 -20.471 -2.487 -1.291 1.00 0.00 C ATOM 408 OE1 GLN A 268 -21.498 -3.136 -1.091 1.00 0.00 O ATOM 409 NE2 GLN A 268 -20.482 -1.175 -1.496 1.00 0.00 N ATOM 0 H GLN A 268 -16.219 -2.898 0.173 1.00 0.00 H new ATOM 0 HA GLN A 268 -18.841 -2.269 1.393 1.00 0.00 H new ATOM 0 HB2 GLN A 268 -18.158 -4.744 -0.232 1.00 0.00 H new ATOM 0 HB3 GLN A 268 -19.729 -4.290 0.400 1.00 0.00 H new ATOM 0 HG2 GLN A 268 -18.342 -2.417 -1.499 1.00 0.00 H new ATOM 0 HG3 GLN A 268 -19.079 -3.873 -2.139 1.00 0.00 H new ATOM 0 HE21 GLN A 268 -19.607 -0.677 -1.658 1.00 0.00 H new ATOM 0 HE22 GLN A 268 -21.366 -0.666 -1.492 1.00 0.00 H new ATOM 418 N ASN A 269 -16.374 -4.101 2.308 1.00 0.00 N ATOM 419 CA ASN A 269 -15.817 -4.902 3.392 1.00 0.00 C ATOM 420 C ASN A 269 -14.370 -4.506 3.673 1.00 0.00 C ATOM 421 O ASN A 269 -13.783 -3.704 2.947 1.00 0.00 O ATOM 422 CB ASN A 269 -15.892 -6.390 3.046 1.00 0.00 C ATOM 423 CG ASN A 269 -15.854 -6.638 1.550 1.00 0.00 C ATOM 424 OD1 ASN A 269 -14.794 -6.896 0.979 1.00 0.00 O ATOM 425 ND2 ASN A 269 -17.014 -6.561 0.908 1.00 0.00 N ATOM 0 H ASN A 269 -15.683 -3.753 1.643 1.00 0.00 H new ATOM 0 HA ASN A 269 -16.407 -4.715 4.289 1.00 0.00 H new ATOM 0 HB2 ASN A 269 -15.061 -6.913 3.519 1.00 0.00 H new ATOM 0 HB3 ASN A 269 -16.809 -6.810 3.458 1.00 0.00 H new ATOM 0 HD21 ASN A 269 -17.051 -6.718 -0.099 1.00 0.00 H new ATOM 0 HD22 ASN A 269 -17.868 -6.344 1.422 1.00 0.00 H new ATOM 432 N ASP A 270 -13.802 -5.075 4.731 1.00 0.00 N ATOM 433 CA ASP A 270 -12.423 -4.784 5.107 1.00 0.00 C ATOM 434 C ASP A 270 -11.463 -5.152 3.981 1.00 0.00 C ATOM 435 O ASP A 270 -10.513 -4.422 3.697 1.00 0.00 O ATOM 436 CB ASP A 270 -12.049 -5.541 6.382 1.00 0.00 C ATOM 437 CG ASP A 270 -10.549 -5.644 6.575 1.00 0.00 C ATOM 438 OD1 ASP A 270 -9.928 -4.629 6.954 1.00 0.00 O ATOM 439 OD2 ASP A 270 -9.996 -6.740 6.348 1.00 0.00 O ATOM 0 H ASP A 270 -14.275 -5.740 5.343 1.00 0.00 H new ATOM 0 HA ASP A 270 -12.342 -3.713 5.293 1.00 0.00 H new ATOM 0 HB2 ASP A 270 -12.489 -5.037 7.243 1.00 0.00 H new ATOM 0 HB3 ASP A 270 -12.477 -6.543 6.345 1.00 0.00 H new ATOM 444 N ASP A 271 -11.716 -6.290 3.343 1.00 0.00 N ATOM 445 CA ASP A 271 -10.874 -6.756 2.247 1.00 0.00 C ATOM 446 C ASP A 271 -10.357 -5.582 1.422 1.00 0.00 C ATOM 447 O ASP A 271 -9.179 -5.530 1.070 1.00 0.00 O ATOM 448 CB ASP A 271 -11.653 -7.721 1.352 1.00 0.00 C ATOM 449 CG ASP A 271 -11.105 -7.771 -0.060 1.00 0.00 C ATOM 450 OD1 ASP A 271 -11.104 -6.720 -0.734 1.00 0.00 O ATOM 451 OD2 ASP A 271 -10.677 -8.862 -0.493 1.00 0.00 O ATOM 0 H ASP A 271 -12.497 -6.907 3.566 1.00 0.00 H new ATOM 0 HA ASP A 271 -10.019 -7.280 2.675 1.00 0.00 H new ATOM 0 HB2 ASP A 271 -11.622 -8.720 1.786 1.00 0.00 H new ATOM 0 HB3 ASP A 271 -12.700 -7.419 1.322 1.00 0.00 H new ATOM 456 N GLU A 272 -11.246 -4.643 1.116 1.00 0.00 N ATOM 457 CA GLU A 272 -10.879 -3.471 0.330 1.00 0.00 C ATOM 458 C GLU A 272 -10.635 -2.265 1.233 1.00 0.00 C ATOM 459 O GLU A 272 -10.781 -2.349 2.453 1.00 0.00 O ATOM 460 CB GLU A 272 -11.976 -3.146 -0.686 1.00 0.00 C ATOM 461 CG GLU A 272 -13.374 -3.135 -0.091 1.00 0.00 C ATOM 462 CD GLU A 272 -14.003 -4.514 -0.055 1.00 0.00 C ATOM 463 OE1 GLU A 272 -13.266 -5.507 -0.232 1.00 0.00 O ATOM 464 OE2 GLU A 272 -15.232 -4.601 0.149 1.00 0.00 O ATOM 0 H GLU A 272 -12.225 -4.671 1.400 1.00 0.00 H new ATOM 0 HA GLU A 272 -9.956 -3.698 -0.203 1.00 0.00 H new ATOM 0 HB2 GLU A 272 -11.771 -2.171 -1.129 1.00 0.00 H new ATOM 0 HB3 GLU A 272 -11.940 -3.877 -1.493 1.00 0.00 H new ATOM 0 HG2 GLU A 272 -13.331 -2.733 0.921 1.00 0.00 H new ATOM 0 HG3 GLU A 272 -14.007 -2.466 -0.673 1.00 0.00 H new ATOM 471 N LEU A 273 -10.261 -1.144 0.626 1.00 0.00 N ATOM 472 CA LEU A 273 -9.995 0.080 1.373 1.00 0.00 C ATOM 473 C LEU A 273 -10.634 1.285 0.690 1.00 0.00 C ATOM 474 O LEU A 273 -10.760 1.321 -0.533 1.00 0.00 O ATOM 475 CB LEU A 273 -8.488 0.298 1.514 1.00 0.00 C ATOM 476 CG LEU A 273 -8.045 1.720 1.860 1.00 0.00 C ATOM 477 CD1 LEU A 273 -8.158 1.965 3.357 1.00 0.00 C ATOM 478 CD2 LEU A 273 -6.621 1.966 1.383 1.00 0.00 C ATOM 0 H LEU A 273 -10.135 -1.058 -0.382 1.00 0.00 H new ATOM 0 HA LEU A 273 -10.434 -0.027 2.365 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -8.114 -0.375 2.285 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -8.010 0.007 0.578 1.00 0.00 H new ATOM 0 HG LEU A 273 -8.704 2.420 1.347 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -7.838 2.982 3.584 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -9.193 1.831 3.670 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -7.523 1.257 3.890 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -6.323 2.983 1.638 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -5.948 1.258 1.867 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -6.571 1.833 0.302 1.00 0.00 H new ATOM 490 N GLU A 274 -11.033 2.269 1.490 1.00 0.00 N ATOM 491 CA GLU A 274 -11.657 3.476 0.961 1.00 0.00 C ATOM 492 C GLU A 274 -10.649 4.312 0.178 1.00 0.00 C ATOM 493 O GLU A 274 -9.488 4.433 0.571 1.00 0.00 O ATOM 494 CB GLU A 274 -12.253 4.309 2.097 1.00 0.00 C ATOM 495 CG GLU A 274 -12.981 5.556 1.622 1.00 0.00 C ATOM 496 CD GLU A 274 -13.353 6.484 2.762 1.00 0.00 C ATOM 497 OE1 GLU A 274 -13.779 5.981 3.822 1.00 0.00 O ATOM 498 OE2 GLU A 274 -13.218 7.714 2.592 1.00 0.00 O ATOM 0 H GLU A 274 -10.935 2.254 2.505 1.00 0.00 H new ATOM 0 HA GLU A 274 -12.456 3.173 0.284 1.00 0.00 H new ATOM 0 HB2 GLU A 274 -12.946 3.689 2.666 1.00 0.00 H new ATOM 0 HB3 GLU A 274 -11.454 4.602 2.778 1.00 0.00 H new ATOM 0 HG2 GLU A 274 -12.350 6.092 0.913 1.00 0.00 H new ATOM 0 HG3 GLU A 274 -13.885 5.263 1.087 1.00 0.00 H new ATOM 505 N LEU A 275 -11.100 4.886 -0.932 1.00 0.00 N ATOM 506 CA LEU A 275 -10.238 5.711 -1.772 1.00 0.00 C ATOM 507 C LEU A 275 -10.670 7.173 -1.726 1.00 0.00 C ATOM 508 O LEU A 275 -11.863 7.478 -1.708 1.00 0.00 O ATOM 509 CB LEU A 275 -10.263 5.204 -3.215 1.00 0.00 C ATOM 510 CG LEU A 275 -9.754 3.779 -3.435 1.00 0.00 C ATOM 511 CD1 LEU A 275 -9.370 3.569 -4.892 1.00 0.00 C ATOM 512 CD2 LEU A 275 -8.572 3.488 -2.522 1.00 0.00 C ATOM 0 H LEU A 275 -12.058 4.795 -1.271 1.00 0.00 H new ATOM 0 HA LEU A 275 -9.221 5.640 -1.386 1.00 0.00 H new ATOM 0 HB2 LEU A 275 -11.288 5.263 -3.582 1.00 0.00 H new ATOM 0 HB3 LEU A 275 -9.666 5.880 -3.827 1.00 0.00 H new ATOM 0 HG LEU A 275 -10.557 3.084 -3.188 1.00 0.00 H new ATOM 0 HD11 LEU A 275 -9.010 2.549 -5.030 1.00 0.00 H new ATOM 0 HD12 LEU A 275 -10.241 3.735 -5.525 1.00 0.00 H new ATOM 0 HD13 LEU A 275 -8.583 4.272 -5.166 1.00 0.00 H new ATOM 0 HD21 LEU A 275 -8.223 2.470 -2.692 1.00 0.00 H new ATOM 0 HD22 LEU A 275 -7.765 4.189 -2.737 1.00 0.00 H new ATOM 0 HD23 LEU A 275 -8.880 3.597 -1.482 1.00 0.00 H new ATOM 524 N VAL A 276 -9.693 8.073 -1.710 1.00 0.00 N ATOM 525 CA VAL A 276 -9.972 9.504 -1.670 1.00 0.00 C ATOM 526 C VAL A 276 -9.206 10.244 -2.761 1.00 0.00 C ATOM 527 O VAL A 276 -8.018 10.011 -2.988 1.00 0.00 O ATOM 528 CB VAL A 276 -9.607 10.109 -0.302 1.00 0.00 C ATOM 529 CG1 VAL A 276 -9.865 11.608 -0.295 1.00 0.00 C ATOM 530 CG2 VAL A 276 -10.386 9.421 0.809 1.00 0.00 C ATOM 0 H VAL A 276 -8.701 7.837 -1.724 1.00 0.00 H new ATOM 0 HA VAL A 276 -11.043 9.622 -1.837 1.00 0.00 H new ATOM 0 HB VAL A 276 -8.544 9.947 -0.124 1.00 0.00 H new ATOM 0 HG11 VAL A 276 -9.601 12.018 0.680 1.00 0.00 H new ATOM 0 HG12 VAL A 276 -9.259 12.085 -1.065 1.00 0.00 H new ATOM 0 HG13 VAL A 276 -10.920 11.797 -0.495 1.00 0.00 H new ATOM 0 HG21 VAL A 276 -10.116 9.861 1.769 1.00 0.00 H new ATOM 0 HG22 VAL A 276 -11.455 9.551 0.638 1.00 0.00 H new ATOM 0 HG23 VAL A 276 -10.146 8.358 0.817 1.00 0.00 H new ATOM 540 N PRO A 277 -9.900 11.158 -3.455 1.00 0.00 N ATOM 541 CA PRO A 277 -9.305 11.952 -4.534 1.00 0.00 C ATOM 542 C PRO A 277 -8.294 12.970 -4.015 1.00 0.00 C ATOM 543 O PRO A 277 -8.667 13.998 -3.452 1.00 0.00 O ATOM 544 CB PRO A 277 -10.509 12.664 -5.156 1.00 0.00 C ATOM 545 CG PRO A 277 -11.517 12.731 -4.061 1.00 0.00 C ATOM 546 CD PRO A 277 -11.319 11.487 -3.240 1.00 0.00 C ATOM 0 HA PRO A 277 -8.749 11.332 -5.237 1.00 0.00 H new ATOM 0 HB2 PRO A 277 -10.241 13.660 -5.509 1.00 0.00 H new ATOM 0 HB3 PRO A 277 -10.894 12.114 -6.015 1.00 0.00 H new ATOM 0 HG2 PRO A 277 -11.376 13.626 -3.454 1.00 0.00 H new ATOM 0 HG3 PRO A 277 -12.529 12.776 -4.464 1.00 0.00 H new ATOM 0 HD2 PRO A 277 -11.536 11.662 -2.186 1.00 0.00 H new ATOM 0 HD3 PRO A 277 -11.973 10.680 -3.570 1.00 0.00 H new ATOM 554 N GLY A 278 -7.012 12.676 -4.210 1.00 0.00 N ATOM 555 CA GLY A 278 -5.968 13.575 -3.756 1.00 0.00 C ATOM 556 C GLY A 278 -5.097 12.957 -2.680 1.00 0.00 C ATOM 557 O GLY A 278 -4.329 13.654 -2.017 1.00 0.00 O ATOM 0 H GLY A 278 -6.678 11.831 -4.674 1.00 0.00 H new ATOM 0 HA2 GLY A 278 -5.345 13.861 -4.604 1.00 0.00 H new ATOM 0 HA3 GLY A 278 -6.422 14.489 -3.372 1.00 0.00 H new ATOM 561 N ASP A 279 -5.218 11.646 -2.504 1.00 0.00 N ATOM 562 CA ASP A 279 -4.436 10.933 -1.500 1.00 0.00 C ATOM 563 C ASP A 279 -3.479 9.945 -2.158 1.00 0.00 C ATOM 564 O ASP A 279 -3.585 9.662 -3.352 1.00 0.00 O ATOM 565 CB ASP A 279 -5.362 10.197 -0.530 1.00 0.00 C ATOM 566 CG ASP A 279 -5.750 11.052 0.661 1.00 0.00 C ATOM 567 OD1 ASP A 279 -5.673 12.293 0.550 1.00 0.00 O ATOM 568 OD2 ASP A 279 -6.129 10.479 1.704 1.00 0.00 O ATOM 0 H ASP A 279 -5.850 11.055 -3.044 1.00 0.00 H new ATOM 0 HA ASP A 279 -3.849 11.665 -0.945 1.00 0.00 H new ATOM 0 HB2 ASP A 279 -6.263 9.885 -1.058 1.00 0.00 H new ATOM 0 HB3 ASP A 279 -4.869 9.291 -0.178 1.00 0.00 H new ATOM 573 N PHE A 280 -2.543 9.423 -1.372 1.00 0.00 N ATOM 574 CA PHE A 280 -1.565 8.467 -1.878 1.00 0.00 C ATOM 575 C PHE A 280 -1.862 7.061 -1.365 1.00 0.00 C ATOM 576 O PHE A 280 -2.649 6.882 -0.436 1.00 0.00 O ATOM 577 CB PHE A 280 -0.152 8.885 -1.467 1.00 0.00 C ATOM 578 CG PHE A 280 0.480 9.871 -2.408 1.00 0.00 C ATOM 579 CD1 PHE A 280 0.727 9.528 -3.727 1.00 0.00 C ATOM 580 CD2 PHE A 280 0.825 11.140 -1.973 1.00 0.00 C ATOM 581 CE1 PHE A 280 1.309 10.433 -4.595 1.00 0.00 C ATOM 582 CE2 PHE A 280 1.407 12.049 -2.836 1.00 0.00 C ATOM 583 CZ PHE A 280 1.648 11.696 -4.149 1.00 0.00 C ATOM 0 H PHE A 280 -2.441 9.646 -0.382 1.00 0.00 H new ATOM 0 HA PHE A 280 -1.632 8.459 -2.966 1.00 0.00 H new ATOM 0 HB2 PHE A 280 -0.187 9.319 -0.468 1.00 0.00 H new ATOM 0 HB3 PHE A 280 0.478 7.997 -1.407 1.00 0.00 H new ATOM 0 HD1 PHE A 280 0.462 8.543 -4.081 1.00 0.00 H new ATOM 0 HD2 PHE A 280 0.637 11.422 -0.948 1.00 0.00 H new ATOM 0 HE1 PHE A 280 1.499 10.153 -5.621 1.00 0.00 H new ATOM 0 HE2 PHE A 280 1.673 13.035 -2.484 1.00 0.00 H new ATOM 0 HZ PHE A 280 2.100 12.406 -4.826 1.00 0.00 H new ATOM 593 N ILE A 281 -1.226 6.068 -1.977 1.00 0.00 N ATOM 594 CA ILE A 281 -1.421 4.678 -1.582 1.00 0.00 C ATOM 595 C ILE A 281 -0.129 3.881 -1.721 1.00 0.00 C ATOM 596 O ILE A 281 0.426 3.762 -2.813 1.00 0.00 O ATOM 597 CB ILE A 281 -2.521 4.003 -2.423 1.00 0.00 C ATOM 598 CG1 ILE A 281 -3.792 4.855 -2.418 1.00 0.00 C ATOM 599 CG2 ILE A 281 -2.810 2.607 -1.893 1.00 0.00 C ATOM 600 CD1 ILE A 281 -4.547 4.807 -1.108 1.00 0.00 C ATOM 0 H ILE A 281 -0.571 6.200 -2.748 1.00 0.00 H new ATOM 0 HA ILE A 281 -1.729 4.687 -0.536 1.00 0.00 H new ATOM 0 HB ILE A 281 -2.170 3.915 -3.451 1.00 0.00 H new ATOM 0 HG12 ILE A 281 -3.527 5.889 -2.638 1.00 0.00 H new ATOM 0 HG13 ILE A 281 -4.449 4.517 -3.219 1.00 0.00 H new ATOM 0 HG21 ILE A 281 -3.589 2.143 -2.497 1.00 0.00 H new ATOM 0 HG22 ILE A 281 -1.904 2.004 -1.944 1.00 0.00 H new ATOM 0 HG23 ILE A 281 -3.145 2.673 -0.858 1.00 0.00 H new ATOM 0 HD11 ILE A 281 -5.436 5.434 -1.177 1.00 0.00 H new ATOM 0 HD12 ILE A 281 -4.843 3.780 -0.896 1.00 0.00 H new ATOM 0 HD13 ILE A 281 -3.907 5.173 -0.305 1.00 0.00 H new ATOM 612 N PHE A 282 0.345 3.333 -0.606 1.00 0.00 N ATOM 613 CA PHE A 282 1.572 2.545 -0.603 1.00 0.00 C ATOM 614 C PHE A 282 1.279 1.082 -0.923 1.00 0.00 C ATOM 615 O PHE A 282 0.592 0.396 -0.167 1.00 0.00 O ATOM 616 CB PHE A 282 2.268 2.653 0.755 1.00 0.00 C ATOM 617 CG PHE A 282 2.764 4.036 1.067 1.00 0.00 C ATOM 618 CD1 PHE A 282 3.526 4.737 0.147 1.00 0.00 C ATOM 619 CD2 PHE A 282 2.468 4.635 2.281 1.00 0.00 C ATOM 620 CE1 PHE A 282 3.984 6.010 0.430 1.00 0.00 C ATOM 621 CE2 PHE A 282 2.922 5.908 2.570 1.00 0.00 C ATOM 622 CZ PHE A 282 3.682 6.596 1.644 1.00 0.00 C ATOM 0 H PHE A 282 -0.102 3.420 0.307 1.00 0.00 H new ATOM 0 HA PHE A 282 2.232 2.942 -1.374 1.00 0.00 H new ATOM 0 HB2 PHE A 282 1.575 2.340 1.535 1.00 0.00 H new ATOM 0 HB3 PHE A 282 3.109 1.960 0.779 1.00 0.00 H new ATOM 0 HD1 PHE A 282 3.765 4.283 -0.803 1.00 0.00 H new ATOM 0 HD2 PHE A 282 1.876 4.101 3.010 1.00 0.00 H new ATOM 0 HE1 PHE A 282 4.577 6.546 -0.297 1.00 0.00 H new ATOM 0 HE2 PHE A 282 2.683 6.365 3.519 1.00 0.00 H new ATOM 0 HZ PHE A 282 4.039 7.590 1.869 1.00 0.00 H new ATOM 632 N MET A 283 1.806 0.613 -2.049 1.00 0.00 N ATOM 633 CA MET A 283 1.603 -0.769 -2.469 1.00 0.00 C ATOM 634 C MET A 283 2.806 -1.631 -2.104 1.00 0.00 C ATOM 635 O MET A 283 3.951 -1.191 -2.206 1.00 0.00 O ATOM 636 CB MET A 283 1.353 -0.834 -3.977 1.00 0.00 C ATOM 637 CG MET A 283 0.455 -1.987 -4.395 1.00 0.00 C ATOM 638 SD MET A 283 1.200 -3.598 -4.081 1.00 0.00 S ATOM 639 CE MET A 283 2.797 -3.391 -4.866 1.00 0.00 C ATOM 0 H MET A 283 2.376 1.169 -2.687 1.00 0.00 H new ATOM 0 HA MET A 283 0.729 -1.157 -1.946 1.00 0.00 H new ATOM 0 HB2 MET A 283 0.902 0.103 -4.303 1.00 0.00 H new ATOM 0 HB3 MET A 283 2.309 -0.924 -4.492 1.00 0.00 H new ATOM 0 HG2 MET A 283 -0.491 -1.918 -3.858 1.00 0.00 H new ATOM 0 HG3 MET A 283 0.227 -1.898 -5.457 1.00 0.00 H new ATOM 0 HE1 MET A 283 3.076 -4.315 -5.373 1.00 0.00 H new ATOM 0 HE2 MET A 283 2.743 -2.581 -5.593 1.00 0.00 H new ATOM 0 HE3 MET A 283 3.545 -3.151 -4.111 1.00 0.00 H new ATOM 649 N SER A 284 2.540 -2.862 -1.677 1.00 0.00 N ATOM 650 CA SER A 284 3.601 -3.784 -1.292 1.00 0.00 C ATOM 651 C SER A 284 3.370 -5.164 -1.902 1.00 0.00 C ATOM 652 O SER A 284 2.241 -5.644 -2.004 1.00 0.00 O ATOM 653 CB SER A 284 3.682 -3.895 0.232 1.00 0.00 C ATOM 654 OG SER A 284 4.938 -4.410 0.640 1.00 0.00 O ATOM 0 H SER A 284 1.598 -3.243 -1.589 1.00 0.00 H new ATOM 0 HA SER A 284 4.544 -3.391 -1.671 1.00 0.00 H new ATOM 0 HB2 SER A 284 3.525 -2.914 0.680 1.00 0.00 H new ATOM 0 HB3 SER A 284 2.884 -4.543 0.595 1.00 0.00 H new ATOM 0 HG SER A 284 4.965 -4.470 1.618 1.00 0.00 H new ATOM 660 N PRO A 285 4.465 -5.817 -2.317 1.00 0.00 N ATOM 661 CA PRO A 285 4.408 -7.150 -2.924 1.00 0.00 C ATOM 662 C PRO A 285 4.027 -8.230 -1.917 1.00 0.00 C ATOM 663 O PRO A 285 3.372 -9.212 -2.264 1.00 0.00 O ATOM 664 CB PRO A 285 5.836 -7.371 -3.429 1.00 0.00 C ATOM 665 CG PRO A 285 6.683 -6.506 -2.560 1.00 0.00 C ATOM 666 CD PRO A 285 5.842 -5.305 -2.227 1.00 0.00 C ATOM 0 HA PRO A 285 3.650 -7.210 -3.705 1.00 0.00 H new ATOM 0 HB2 PRO A 285 6.127 -8.418 -3.349 1.00 0.00 H new ATOM 0 HB3 PRO A 285 5.932 -7.093 -4.479 1.00 0.00 H new ATOM 0 HG2 PRO A 285 6.983 -7.036 -1.656 1.00 0.00 H new ATOM 0 HG3 PRO A 285 7.597 -6.212 -3.075 1.00 0.00 H new ATOM 0 HD2 PRO A 285 6.064 -4.923 -1.231 1.00 0.00 H new ATOM 0 HD3 PRO A 285 6.013 -4.488 -2.928 1.00 0.00 H new ATOM 674 N MET A 286 4.441 -8.040 -0.668 1.00 0.00 N ATOM 675 CA MET A 286 4.140 -8.998 0.390 1.00 0.00 C ATOM 676 C MET A 286 2.682 -8.888 0.824 1.00 0.00 C ATOM 677 O MET A 286 2.230 -9.622 1.703 1.00 0.00 O ATOM 678 CB MET A 286 5.061 -8.770 1.590 1.00 0.00 C ATOM 679 CG MET A 286 6.539 -8.791 1.235 1.00 0.00 C ATOM 680 SD MET A 286 7.602 -8.843 2.691 1.00 0.00 S ATOM 681 CE MET A 286 7.333 -10.524 3.246 1.00 0.00 C ATOM 0 H MET A 286 4.985 -7.233 -0.364 1.00 0.00 H new ATOM 0 HA MET A 286 4.309 -10.001 -0.003 1.00 0.00 H new ATOM 0 HB2 MET A 286 4.819 -7.810 2.046 1.00 0.00 H new ATOM 0 HB3 MET A 286 4.865 -9.537 2.339 1.00 0.00 H new ATOM 0 HG2 MET A 286 6.746 -9.658 0.608 1.00 0.00 H new ATOM 0 HG3 MET A 286 6.780 -7.906 0.645 1.00 0.00 H new ATOM 0 HE1 MET A 286 8.145 -10.822 3.910 1.00 0.00 H new ATOM 0 HE2 MET A 286 6.386 -10.583 3.782 1.00 0.00 H new ATOM 0 HE3 MET A 286 7.305 -11.191 2.385 1.00 0.00 H new ATOM 691 N GLU A 287 1.952 -7.967 0.203 1.00 0.00 N ATOM 692 CA GLU A 287 0.545 -7.762 0.528 1.00 0.00 C ATOM 693 C GLU A 287 -0.323 -7.866 -0.723 1.00 0.00 C ATOM 694 O GLU A 287 -1.484 -7.458 -0.720 1.00 0.00 O ATOM 695 CB GLU A 287 0.345 -6.397 1.189 1.00 0.00 C ATOM 696 CG GLU A 287 1.189 -6.196 2.437 1.00 0.00 C ATOM 697 CD GLU A 287 0.567 -6.824 3.669 1.00 0.00 C ATOM 698 OE1 GLU A 287 -0.252 -7.754 3.511 1.00 0.00 O ATOM 699 OE2 GLU A 287 0.898 -6.387 4.791 1.00 0.00 O ATOM 0 H GLU A 287 2.311 -7.352 -0.527 1.00 0.00 H new ATOM 0 HA GLU A 287 0.242 -8.543 1.225 1.00 0.00 H new ATOM 0 HB2 GLU A 287 0.585 -5.615 0.468 1.00 0.00 H new ATOM 0 HB3 GLU A 287 -0.707 -6.279 1.449 1.00 0.00 H new ATOM 0 HG2 GLU A 287 2.178 -6.625 2.275 1.00 0.00 H new ATOM 0 HG3 GLU A 287 1.328 -5.129 2.609 1.00 0.00 H new ATOM 706 N GLN A 288 0.250 -8.413 -1.790 1.00 0.00 N ATOM 707 CA GLN A 288 -0.470 -8.569 -3.048 1.00 0.00 C ATOM 708 C GLN A 288 -1.469 -9.718 -2.964 1.00 0.00 C ATOM 709 O GLN A 288 -1.154 -10.856 -3.314 1.00 0.00 O ATOM 710 CB GLN A 288 0.511 -8.813 -4.196 1.00 0.00 C ATOM 711 CG GLN A 288 0.992 -7.536 -4.867 1.00 0.00 C ATOM 712 CD GLN A 288 1.496 -7.772 -6.277 1.00 0.00 C ATOM 713 OE1 GLN A 288 0.825 -8.410 -7.089 1.00 0.00 O ATOM 714 NE2 GLN A 288 2.683 -7.258 -6.576 1.00 0.00 N ATOM 0 H GLN A 288 1.211 -8.756 -1.808 1.00 0.00 H new ATOM 0 HA GLN A 288 -1.019 -7.647 -3.240 1.00 0.00 H new ATOM 0 HB2 GLN A 288 1.373 -9.361 -3.816 1.00 0.00 H new ATOM 0 HB3 GLN A 288 0.034 -9.448 -4.942 1.00 0.00 H new ATOM 0 HG2 GLN A 288 0.176 -6.814 -4.893 1.00 0.00 H new ATOM 0 HG3 GLN A 288 1.789 -7.094 -4.269 1.00 0.00 H new ATOM 0 HE21 GLN A 288 3.205 -6.736 -5.872 1.00 0.00 H new ATOM 0 HE22 GLN A 288 3.073 -7.385 -7.510 1.00 0.00 H new ATOM 723 N THR A 289 -2.677 -9.414 -2.499 1.00 0.00 N ATOM 724 CA THR A 289 -3.722 -10.421 -2.368 1.00 0.00 C ATOM 725 C THR A 289 -4.883 -10.135 -3.313 1.00 0.00 C ATOM 726 O THR A 289 -5.489 -9.065 -3.260 1.00 0.00 O ATOM 727 CB THR A 289 -4.255 -10.494 -0.925 1.00 0.00 C ATOM 728 OG1 THR A 289 -5.162 -9.413 -0.683 1.00 0.00 O ATOM 729 CG2 THR A 289 -3.112 -10.437 0.078 1.00 0.00 C ATOM 0 H THR A 289 -2.955 -8.477 -2.207 1.00 0.00 H new ATOM 0 HA THR A 289 -3.272 -11.379 -2.630 1.00 0.00 H new ATOM 0 HB THR A 289 -4.778 -11.442 -0.802 1.00 0.00 H new ATOM 0 HG1 THR A 289 -5.240 -8.864 -1.491 1.00 0.00 H new ATOM 0 HG21 THR A 289 -3.513 -10.490 1.090 1.00 0.00 H new ATOM 0 HG22 THR A 289 -2.438 -11.277 -0.090 1.00 0.00 H new ATOM 0 HG23 THR A 289 -2.565 -9.503 -0.047 1.00 0.00 H new ATOM 737 N SER A 290 -5.188 -11.098 -4.177 1.00 0.00 N ATOM 738 CA SER A 290 -6.276 -10.948 -5.136 1.00 0.00 C ATOM 739 C SER A 290 -6.075 -9.703 -5.995 1.00 0.00 C ATOM 740 O SER A 290 -7.033 -9.128 -6.511 1.00 0.00 O ATOM 741 CB SER A 290 -7.619 -10.867 -4.408 1.00 0.00 C ATOM 742 OG SER A 290 -7.751 -11.915 -3.463 1.00 0.00 O ATOM 0 H SER A 290 -4.697 -11.990 -4.232 1.00 0.00 H new ATOM 0 HA SER A 290 -6.276 -11.822 -5.787 1.00 0.00 H new ATOM 0 HB2 SER A 290 -7.705 -9.905 -3.903 1.00 0.00 H new ATOM 0 HB3 SER A 290 -8.432 -10.921 -5.132 1.00 0.00 H new ATOM 0 HG SER A 290 -8.617 -11.840 -3.010 1.00 0.00 H new ATOM 748 N THR A 291 -4.819 -9.292 -6.145 1.00 0.00 N ATOM 749 CA THR A 291 -4.490 -8.115 -6.939 1.00 0.00 C ATOM 750 C THR A 291 -4.251 -8.486 -8.398 1.00 0.00 C ATOM 751 O THR A 291 -4.700 -7.789 -9.308 1.00 0.00 O ATOM 752 CB THR A 291 -3.241 -7.399 -6.392 1.00 0.00 C ATOM 753 OG1 THR A 291 -2.077 -8.203 -6.618 1.00 0.00 O ATOM 754 CG2 THR A 291 -3.387 -7.116 -4.904 1.00 0.00 C ATOM 0 H THR A 291 -4.013 -9.757 -5.727 1.00 0.00 H new ATOM 0 HA THR A 291 -5.344 -7.441 -6.873 1.00 0.00 H new ATOM 0 HB THR A 291 -3.134 -6.450 -6.917 1.00 0.00 H new ATOM 0 HG1 THR A 291 -1.295 -7.623 -6.730 1.00 0.00 H new ATOM 0 HG21 THR A 291 -2.493 -6.610 -4.540 1.00 0.00 H new ATOM 0 HG22 THR A 291 -4.257 -6.480 -4.738 1.00 0.00 H new ATOM 0 HG23 THR A 291 -3.517 -8.055 -4.366 1.00 0.00 H new ATOM 762 N SER A 292 -3.541 -9.589 -8.615 1.00 0.00 N ATOM 763 CA SER A 292 -3.239 -10.051 -9.964 1.00 0.00 C ATOM 764 C SER A 292 -4.496 -10.060 -10.829 1.00 0.00 C ATOM 765 O SER A 292 -4.427 -9.881 -12.045 1.00 0.00 O ATOM 766 CB SER A 292 -2.627 -11.453 -9.921 1.00 0.00 C ATOM 767 OG SER A 292 -2.113 -11.824 -11.189 1.00 0.00 O ATOM 0 H SER A 292 -3.164 -10.179 -7.873 1.00 0.00 H new ATOM 0 HA SER A 292 -2.519 -9.361 -10.405 1.00 0.00 H new ATOM 0 HB2 SER A 292 -1.829 -11.482 -9.179 1.00 0.00 H new ATOM 0 HB3 SER A 292 -3.382 -12.173 -9.606 1.00 0.00 H new ATOM 0 HG SER A 292 -1.726 -12.723 -11.135 1.00 0.00 H new ATOM 773 N GLU A 293 -5.644 -10.269 -10.192 1.00 0.00 N ATOM 774 CA GLU A 293 -6.917 -10.302 -10.903 1.00 0.00 C ATOM 775 C GLU A 293 -7.288 -8.914 -11.419 1.00 0.00 C ATOM 776 O GLU A 293 -7.856 -8.774 -12.501 1.00 0.00 O ATOM 777 CB GLU A 293 -8.024 -10.830 -9.989 1.00 0.00 C ATOM 778 CG GLU A 293 -9.385 -10.900 -10.659 1.00 0.00 C ATOM 779 CD GLU A 293 -10.481 -11.344 -9.709 1.00 0.00 C ATOM 780 OE1 GLU A 293 -10.464 -12.520 -9.290 1.00 0.00 O ATOM 781 OE2 GLU A 293 -11.356 -10.513 -9.385 1.00 0.00 O ATOM 0 H GLU A 293 -5.719 -10.418 -9.186 1.00 0.00 H new ATOM 0 HA GLU A 293 -6.810 -10.972 -11.756 1.00 0.00 H new ATOM 0 HB2 GLU A 293 -7.750 -11.825 -9.638 1.00 0.00 H new ATOM 0 HB3 GLU A 293 -8.094 -10.190 -9.110 1.00 0.00 H new ATOM 0 HG2 GLU A 293 -9.637 -9.920 -11.065 1.00 0.00 H new ATOM 0 HG3 GLU A 293 -9.337 -11.591 -11.500 1.00 0.00 H new ATOM 788 N GLY A 294 -6.961 -7.891 -10.635 1.00 0.00 N ATOM 789 CA GLY A 294 -7.268 -6.528 -11.028 1.00 0.00 C ATOM 790 C GLY A 294 -7.161 -5.553 -9.873 1.00 0.00 C ATOM 791 O GLY A 294 -6.920 -4.363 -10.076 1.00 0.00 O ATOM 0 H GLY A 294 -6.489 -7.982 -9.735 1.00 0.00 H new ATOM 0 HA2 GLY A 294 -6.588 -6.221 -11.823 1.00 0.00 H new ATOM 0 HA3 GLY A 294 -8.277 -6.490 -11.439 1.00 0.00 H new ATOM 795 N TRP A 295 -7.341 -6.057 -8.657 1.00 0.00 N ATOM 796 CA TRP A 295 -7.265 -5.221 -7.464 1.00 0.00 C ATOM 797 C TRP A 295 -5.815 -4.973 -7.065 1.00 0.00 C ATOM 798 O TRP A 295 -4.890 -5.448 -7.725 1.00 0.00 O ATOM 799 CB TRP A 295 -8.020 -5.878 -6.307 1.00 0.00 C ATOM 800 CG TRP A 295 -9.465 -6.138 -6.612 1.00 0.00 C ATOM 801 CD1 TRP A 295 -9.976 -7.180 -7.333 1.00 0.00 C ATOM 802 CD2 TRP A 295 -10.583 -5.342 -6.206 1.00 0.00 C ATOM 803 NE1 TRP A 295 -11.344 -7.079 -7.399 1.00 0.00 N ATOM 804 CE2 TRP A 295 -11.741 -5.960 -6.715 1.00 0.00 C ATOM 805 CE3 TRP A 295 -10.718 -4.168 -5.461 1.00 0.00 C ATOM 806 CZ2 TRP A 295 -13.016 -5.442 -6.503 1.00 0.00 C ATOM 807 CZ3 TRP A 295 -11.984 -3.654 -5.251 1.00 0.00 C ATOM 808 CH2 TRP A 295 -13.119 -4.291 -5.770 1.00 0.00 C ATOM 0 H TRP A 295 -7.540 -7.040 -8.471 1.00 0.00 H new ATOM 0 HA TRP A 295 -7.729 -4.261 -7.693 1.00 0.00 H new ATOM 0 HB2 TRP A 295 -7.534 -6.820 -6.054 1.00 0.00 H new ATOM 0 HB3 TRP A 295 -7.951 -5.238 -5.428 1.00 0.00 H new ATOM 0 HD1 TRP A 295 -9.390 -7.967 -7.785 1.00 0.00 H new ATOM 0 HE1 TRP A 295 -11.964 -7.731 -7.879 1.00 0.00 H new ATOM 0 HE3 TRP A 295 -9.849 -3.671 -5.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 295 -13.892 -5.931 -6.903 1.00 0.00 H new ATOM 0 HZ3 TRP A 295 -12.100 -2.746 -4.677 1.00 0.00 H new ATOM 0 HH2 TRP A 295 -14.095 -3.865 -5.588 1.00 0.00 H new ATOM 819 N ILE A 296 -5.623 -4.226 -5.983 1.00 0.00 N ATOM 820 CA ILE A 296 -4.285 -3.916 -5.497 1.00 0.00 C ATOM 821 C ILE A 296 -4.307 -3.558 -4.015 1.00 0.00 C ATOM 822 O ILE A 296 -5.081 -2.703 -3.583 1.00 0.00 O ATOM 823 CB ILE A 296 -3.655 -2.752 -6.285 1.00 0.00 C ATOM 824 CG1 ILE A 296 -4.720 -1.712 -6.639 1.00 0.00 C ATOM 825 CG2 ILE A 296 -2.974 -3.271 -7.542 1.00 0.00 C ATOM 826 CD1 ILE A 296 -4.180 -0.302 -6.733 1.00 0.00 C ATOM 0 H ILE A 296 -6.378 -3.824 -5.426 1.00 0.00 H new ATOM 0 HA ILE A 296 -3.682 -4.812 -5.643 1.00 0.00 H new ATOM 0 HB ILE A 296 -2.902 -2.274 -5.659 1.00 0.00 H new ATOM 0 HG12 ILE A 296 -5.177 -1.982 -7.591 1.00 0.00 H new ATOM 0 HG13 ILE A 296 -5.509 -1.741 -5.887 1.00 0.00 H new ATOM 0 HG21 ILE A 296 -2.534 -2.437 -8.088 1.00 0.00 H new ATOM 0 HG22 ILE A 296 -2.191 -3.978 -7.266 1.00 0.00 H new ATOM 0 HG23 ILE A 296 -3.708 -3.771 -8.174 1.00 0.00 H new ATOM 0 HD11 ILE A 296 -4.990 0.382 -6.987 1.00 0.00 H new ATOM 0 HD12 ILE A 296 -3.748 -0.013 -5.775 1.00 0.00 H new ATOM 0 HD13 ILE A 296 -3.412 -0.257 -7.505 1.00 0.00 H new ATOM 838 N TYR A 297 -3.453 -4.218 -3.240 1.00 0.00 N ATOM 839 CA TYR A 297 -3.375 -3.970 -1.805 1.00 0.00 C ATOM 840 C TYR A 297 -2.433 -2.809 -1.503 1.00 0.00 C ATOM 841 O TYR A 297 -1.223 -2.907 -1.705 1.00 0.00 O ATOM 842 CB TYR A 297 -2.903 -5.228 -1.074 1.00 0.00 C ATOM 843 CG TYR A 297 -3.151 -5.191 0.417 1.00 0.00 C ATOM 844 CD1 TYR A 297 -2.262 -4.554 1.273 1.00 0.00 C ATOM 845 CD2 TYR A 297 -4.274 -5.794 0.969 1.00 0.00 C ATOM 846 CE1 TYR A 297 -2.485 -4.518 2.637 1.00 0.00 C ATOM 847 CE2 TYR A 297 -4.506 -5.762 2.331 1.00 0.00 C ATOM 848 CZ TYR A 297 -3.608 -5.123 3.160 1.00 0.00 C ATOM 849 OH TYR A 297 -3.834 -5.090 4.517 1.00 0.00 O ATOM 0 H TYR A 297 -2.805 -4.928 -3.581 1.00 0.00 H new ATOM 0 HA TYR A 297 -4.372 -3.706 -1.453 1.00 0.00 H new ATOM 0 HB2 TYR A 297 -3.410 -6.095 -1.497 1.00 0.00 H new ATOM 0 HB3 TYR A 297 -1.836 -5.364 -1.253 1.00 0.00 H new ATOM 0 HD1 TYR A 297 -1.382 -4.079 0.866 1.00 0.00 H new ATOM 0 HD2 TYR A 297 -4.978 -6.297 0.323 1.00 0.00 H new ATOM 0 HE1 TYR A 297 -1.784 -4.019 3.289 1.00 0.00 H new ATOM 0 HE2 TYR A 297 -5.385 -6.234 2.744 1.00 0.00 H new ATOM 0 HH TYR A 297 -3.681 -4.182 4.852 1.00 0.00 H new ATOM 859 N GLY A 298 -2.998 -1.708 -1.017 1.00 0.00 N ATOM 860 CA GLY A 298 -2.195 -0.543 -0.694 1.00 0.00 C ATOM 861 C GLY A 298 -2.570 0.067 0.643 1.00 0.00 C ATOM 862 O GLY A 298 -3.553 -0.336 1.265 1.00 0.00 O ATOM 0 H GLY A 298 -3.997 -1.602 -0.841 1.00 0.00 H new ATOM 0 HA2 GLY A 298 -1.142 -0.824 -0.679 1.00 0.00 H new ATOM 0 HA3 GLY A 298 -2.314 0.205 -1.478 1.00 0.00 H new ATOM 866 N THR A 299 -1.783 1.041 1.088 1.00 0.00 N ATOM 867 CA THR A 299 -2.034 1.706 2.361 1.00 0.00 C ATOM 868 C THR A 299 -2.118 3.217 2.185 1.00 0.00 C ATOM 869 O THR A 299 -1.128 3.868 1.850 1.00 0.00 O ATOM 870 CB THR A 299 -0.937 1.380 3.392 1.00 0.00 C ATOM 871 OG1 THR A 299 -0.840 -0.037 3.572 1.00 0.00 O ATOM 872 CG2 THR A 299 -1.233 2.047 4.726 1.00 0.00 C ATOM 0 H THR A 299 -0.966 1.387 0.585 1.00 0.00 H new ATOM 0 HA THR A 299 -2.990 1.333 2.729 1.00 0.00 H new ATOM 0 HB THR A 299 0.011 1.764 3.015 1.00 0.00 H new ATOM 0 HG1 THR A 299 -0.394 -0.229 4.423 1.00 0.00 H new ATOM 0 HG21 THR A 299 -0.445 1.802 5.438 1.00 0.00 H new ATOM 0 HG22 THR A 299 -1.277 3.128 4.591 1.00 0.00 H new ATOM 0 HG23 THR A 299 -2.190 1.690 5.107 1.00 0.00 H new ATOM 880 N SER A 300 -3.305 3.771 2.414 1.00 0.00 N ATOM 881 CA SER A 300 -3.518 5.207 2.277 1.00 0.00 C ATOM 882 C SER A 300 -2.452 5.989 3.039 1.00 0.00 C ATOM 883 O SER A 300 -1.629 5.410 3.749 1.00 0.00 O ATOM 884 CB SER A 300 -4.909 5.588 2.787 1.00 0.00 C ATOM 885 OG SER A 300 -5.332 6.824 2.238 1.00 0.00 O ATOM 0 H SER A 300 -4.134 3.247 2.695 1.00 0.00 H new ATOM 0 HA SER A 300 -3.444 5.462 1.220 1.00 0.00 H new ATOM 0 HB2 SER A 300 -5.623 4.807 2.525 1.00 0.00 H new ATOM 0 HB3 SER A 300 -4.895 5.655 3.875 1.00 0.00 H new ATOM 0 HG SER A 300 -6.224 7.045 2.578 1.00 0.00 H new ATOM 891 N LEU A 301 -2.474 7.308 2.887 1.00 0.00 N ATOM 892 CA LEU A 301 -1.510 8.172 3.560 1.00 0.00 C ATOM 893 C LEU A 301 -2.204 9.071 4.579 1.00 0.00 C ATOM 894 O LEU A 301 -1.598 9.494 5.565 1.00 0.00 O ATOM 895 CB LEU A 301 -0.760 9.026 2.537 1.00 0.00 C ATOM 896 CG LEU A 301 0.594 9.578 2.987 1.00 0.00 C ATOM 897 CD1 LEU A 301 1.630 8.466 3.048 1.00 0.00 C ATOM 898 CD2 LEU A 301 1.055 10.687 2.053 1.00 0.00 C ATOM 0 H LEU A 301 -3.149 7.803 2.304 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.797 7.538 4.087 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -0.606 8.429 1.638 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -1.397 9.865 2.257 1.00 0.00 H new ATOM 0 HG LEU A 301 0.480 9.996 3.987 1.00 0.00 H new ATOM 0 HD11 LEU A 301 2.587 8.877 3.370 1.00 0.00 H new ATOM 0 HD12 LEU A 301 1.305 7.705 3.757 1.00 0.00 H new ATOM 0 HD13 LEU A 301 1.741 8.018 2.061 1.00 0.00 H new ATOM 0 HD21 LEU A 301 2.020 11.068 2.388 1.00 0.00 H new ATOM 0 HD22 LEU A 301 1.152 10.294 1.041 1.00 0.00 H new ATOM 0 HD23 LEU A 301 0.324 11.495 2.059 1.00 0.00 H new ATOM 910 N THR A 302 -3.479 9.359 4.336 1.00 0.00 N ATOM 911 CA THR A 302 -4.255 10.206 5.232 1.00 0.00 C ATOM 912 C THR A 302 -4.775 9.413 6.426 1.00 0.00 C ATOM 913 O THR A 302 -4.548 9.784 7.578 1.00 0.00 O ATOM 914 CB THR A 302 -5.447 10.853 4.502 1.00 0.00 C ATOM 915 OG1 THR A 302 -4.991 11.936 3.684 1.00 0.00 O ATOM 916 CG2 THR A 302 -6.480 11.361 5.496 1.00 0.00 C ATOM 0 H THR A 302 -3.996 9.018 3.526 1.00 0.00 H new ATOM 0 HA THR A 302 -3.585 10.990 5.584 1.00 0.00 H new ATOM 0 HB THR A 302 -5.914 10.095 3.873 1.00 0.00 H new ATOM 0 HG1 THR A 302 -5.725 12.248 3.115 1.00 0.00 H new ATOM 0 HG21 THR A 302 -7.312 11.814 4.957 1.00 0.00 H new ATOM 0 HG22 THR A 302 -6.847 10.529 6.097 1.00 0.00 H new ATOM 0 HG23 THR A 302 -6.022 12.105 6.148 1.00 0.00 H new ATOM 924 N THR A 303 -5.473 8.317 6.144 1.00 0.00 N ATOM 925 CA THR A 303 -6.026 7.472 7.195 1.00 0.00 C ATOM 926 C THR A 303 -5.007 6.438 7.661 1.00 0.00 C ATOM 927 O THR A 303 -5.045 5.986 8.804 1.00 0.00 O ATOM 928 CB THR A 303 -7.298 6.745 6.720 1.00 0.00 C ATOM 929 OG1 THR A 303 -6.961 5.760 5.736 1.00 0.00 O ATOM 930 CG2 THR A 303 -8.299 7.731 6.136 1.00 0.00 C ATOM 0 H THR A 303 -5.669 7.994 5.196 1.00 0.00 H new ATOM 0 HA THR A 303 -6.281 8.128 8.027 1.00 0.00 H new ATOM 0 HB THR A 303 -7.754 6.256 7.581 1.00 0.00 H new ATOM 0 HG1 THR A 303 -7.198 4.870 6.070 1.00 0.00 H new ATOM 0 HG21 THR A 303 -9.189 7.194 5.807 1.00 0.00 H new ATOM 0 HG22 THR A 303 -8.576 8.462 6.896 1.00 0.00 H new ATOM 0 HG23 THR A 303 -7.850 8.244 5.286 1.00 0.00 H new ATOM 938 N GLY A 304 -4.096 6.067 6.766 1.00 0.00 N ATOM 939 CA GLY A 304 -3.079 5.089 7.106 1.00 0.00 C ATOM 940 C GLY A 304 -3.612 3.670 7.092 1.00 0.00 C ATOM 941 O GLY A 304 -2.967 2.752 7.600 1.00 0.00 O ATOM 0 H GLY A 304 -4.044 6.426 5.813 1.00 0.00 H new ATOM 0 HA2 GLY A 304 -2.251 5.170 6.401 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -2.679 5.314 8.095 1.00 0.00 H new ATOM 945 N CYS A 305 -4.792 3.489 6.510 1.00 0.00 N ATOM 946 CA CYS A 305 -5.413 2.171 6.434 1.00 0.00 C ATOM 947 C CYS A 305 -4.893 1.393 5.230 1.00 0.00 C ATOM 948 O CYS A 305 -4.545 1.977 4.204 1.00 0.00 O ATOM 949 CB CYS A 305 -6.934 2.305 6.351 1.00 0.00 C ATOM 950 SG CYS A 305 -7.686 3.095 7.794 1.00 0.00 S ATOM 0 H CYS A 305 -5.338 4.238 6.084 1.00 0.00 H new ATOM 0 HA CYS A 305 -5.152 1.622 7.339 1.00 0.00 H new ATOM 0 HB2 CYS A 305 -7.189 2.880 5.461 1.00 0.00 H new ATOM 0 HB3 CYS A 305 -7.369 1.314 6.225 1.00 0.00 H new ATOM 0 HG CYS A 305 -8.974 3.165 7.629 1.00 0.00 H new ATOM 956 N SER A 306 -4.840 0.072 5.364 1.00 0.00 N ATOM 957 CA SER A 306 -4.356 -0.787 4.288 1.00 0.00 C ATOM 958 C SER A 306 -5.434 -1.776 3.857 1.00 0.00 C ATOM 959 O SER A 306 -6.044 -2.449 4.687 1.00 0.00 O ATOM 960 CB SER A 306 -3.103 -1.542 4.735 1.00 0.00 C ATOM 961 OG SER A 306 -3.388 -2.402 5.825 1.00 0.00 O ATOM 0 H SER A 306 -5.126 -0.427 6.206 1.00 0.00 H new ATOM 0 HA SER A 306 -4.106 -0.155 3.436 1.00 0.00 H new ATOM 0 HB2 SER A 306 -2.709 -2.124 3.902 1.00 0.00 H new ATOM 0 HB3 SER A 306 -2.329 -0.830 5.022 1.00 0.00 H new ATOM 0 HG SER A 306 -2.572 -2.874 6.091 1.00 0.00 H new ATOM 967 N GLY A 307 -5.664 -1.859 2.550 1.00 0.00 N ATOM 968 CA GLY A 307 -6.668 -2.768 2.029 1.00 0.00 C ATOM 969 C GLY A 307 -6.607 -2.896 0.520 1.00 0.00 C ATOM 970 O GLY A 307 -5.711 -2.346 -0.122 1.00 0.00 O ATOM 0 H GLY A 307 -5.173 -1.313 1.843 1.00 0.00 H new ATOM 0 HA2 GLY A 307 -6.532 -3.751 2.480 1.00 0.00 H new ATOM 0 HA3 GLY A 307 -7.658 -2.417 2.321 1.00 0.00 H new ATOM 974 N LEU A 308 -7.561 -3.624 -0.050 1.00 0.00 N ATOM 975 CA LEU A 308 -7.612 -3.824 -1.494 1.00 0.00 C ATOM 976 C LEU A 308 -8.393 -2.703 -2.172 1.00 0.00 C ATOM 977 O LEU A 308 -9.316 -2.134 -1.588 1.00 0.00 O ATOM 978 CB LEU A 308 -8.252 -5.175 -1.819 1.00 0.00 C ATOM 979 CG LEU A 308 -7.323 -6.389 -1.763 1.00 0.00 C ATOM 980 CD1 LEU A 308 -8.128 -7.679 -1.786 1.00 0.00 C ATOM 981 CD2 LEU A 308 -6.333 -6.356 -2.918 1.00 0.00 C ATOM 0 H LEU A 308 -8.310 -4.086 0.466 1.00 0.00 H new ATOM 0 HA LEU A 308 -6.590 -3.811 -1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 308 -9.076 -5.341 -1.125 1.00 0.00 H new ATOM 0 HB3 LEU A 308 -8.684 -5.119 -2.818 1.00 0.00 H new ATOM 0 HG LEU A 308 -6.763 -6.351 -0.829 1.00 0.00 H new ATOM 0 HD11 LEU A 308 -7.450 -8.532 -1.746 1.00 0.00 H new ATOM 0 HD12 LEU A 308 -8.797 -7.706 -0.926 1.00 0.00 H new ATOM 0 HD13 LEU A 308 -8.715 -7.725 -2.703 1.00 0.00 H new ATOM 0 HD21 LEU A 308 -5.680 -7.227 -2.862 1.00 0.00 H new ATOM 0 HD22 LEU A 308 -6.876 -6.369 -3.863 1.00 0.00 H new ATOM 0 HD23 LEU A 308 -5.733 -5.448 -2.857 1.00 0.00 H new ATOM 993 N LEU A 309 -8.018 -2.392 -3.408 1.00 0.00 N ATOM 994 CA LEU A 309 -8.684 -1.340 -4.167 1.00 0.00 C ATOM 995 C LEU A 309 -8.531 -1.571 -5.667 1.00 0.00 C ATOM 996 O LEU A 309 -7.611 -2.249 -6.125 1.00 0.00 O ATOM 997 CB LEU A 309 -8.113 0.028 -3.790 1.00 0.00 C ATOM 998 CG LEU A 309 -6.602 0.087 -3.567 1.00 0.00 C ATOM 999 CD1 LEU A 309 -6.095 1.514 -3.712 1.00 0.00 C ATOM 1000 CD2 LEU A 309 -6.242 -0.471 -2.197 1.00 0.00 C ATOM 0 H LEU A 309 -7.256 -2.853 -3.906 1.00 0.00 H new ATOM 0 HA LEU A 309 -9.745 -1.365 -3.920 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -8.372 0.737 -4.577 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -8.608 0.367 -2.880 1.00 0.00 H new ATOM 0 HG LEU A 309 -6.119 -0.528 -4.327 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -5.017 1.536 -3.550 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -6.318 1.879 -4.714 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -6.586 2.151 -2.976 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -5.162 -0.421 -2.056 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -6.737 0.116 -1.423 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -6.569 -1.509 -2.129 1.00 0.00 H new ATOM 1012 N PRO A 310 -9.452 -0.993 -6.452 1.00 0.00 N ATOM 1013 CA PRO A 310 -9.440 -1.120 -7.913 1.00 0.00 C ATOM 1014 C PRO A 310 -8.280 -0.362 -8.550 1.00 0.00 C ATOM 1015 O PRO A 310 -8.142 0.847 -8.368 1.00 0.00 O ATOM 1016 CB PRO A 310 -10.776 -0.503 -8.333 1.00 0.00 C ATOM 1017 CG PRO A 310 -11.120 0.443 -7.235 1.00 0.00 C ATOM 1018 CD PRO A 310 -10.577 -0.171 -5.975 1.00 0.00 C ATOM 0 HA PRO A 310 -9.314 -2.155 -8.232 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -10.690 0.014 -9.288 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -11.544 -1.267 -8.452 1.00 0.00 H new ATOM 0 HG2 PRO A 310 -10.679 1.424 -7.413 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -12.198 0.586 -7.166 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -10.247 0.590 -5.267 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -11.328 -0.775 -5.466 1.00 0.00 H new ATOM 1026 N GLU A 311 -7.450 -1.082 -9.298 1.00 0.00 N ATOM 1027 CA GLU A 311 -6.301 -0.476 -9.962 1.00 0.00 C ATOM 1028 C GLU A 311 -6.746 0.616 -10.930 1.00 0.00 C ATOM 1029 O GLU A 311 -5.926 1.372 -11.450 1.00 0.00 O ATOM 1030 CB GLU A 311 -5.498 -1.541 -10.712 1.00 0.00 C ATOM 1031 CG GLU A 311 -6.047 -1.857 -12.093 1.00 0.00 C ATOM 1032 CD GLU A 311 -5.099 -2.706 -12.918 1.00 0.00 C ATOM 1033 OE1 GLU A 311 -4.021 -2.197 -13.292 1.00 0.00 O ATOM 1034 OE2 GLU A 311 -5.434 -3.878 -13.189 1.00 0.00 O ATOM 0 H GLU A 311 -7.551 -2.084 -9.459 1.00 0.00 H new ATOM 0 HA GLU A 311 -5.668 -0.025 -9.198 1.00 0.00 H new ATOM 0 HB2 GLU A 311 -4.466 -1.204 -10.809 1.00 0.00 H new ATOM 0 HB3 GLU A 311 -5.481 -2.455 -10.119 1.00 0.00 H new ATOM 0 HG2 GLU A 311 -6.999 -2.377 -11.991 1.00 0.00 H new ATOM 0 HG3 GLU A 311 -6.248 -0.925 -12.622 1.00 0.00 H new ATOM 1041 N ASN A 312 -8.052 0.693 -11.167 1.00 0.00 N ATOM 1042 CA ASN A 312 -8.607 1.692 -12.074 1.00 0.00 C ATOM 1043 C ASN A 312 -9.082 2.920 -11.304 1.00 0.00 C ATOM 1044 O ASN A 312 -9.931 3.675 -11.780 1.00 0.00 O ATOM 1045 CB ASN A 312 -9.768 1.096 -12.873 1.00 0.00 C ATOM 1046 CG ASN A 312 -10.060 1.880 -14.138 1.00 0.00 C ATOM 1047 OD1 ASN A 312 -10.778 2.879 -14.111 1.00 0.00 O ATOM 1048 ND2 ASN A 312 -9.504 1.427 -15.256 1.00 0.00 N ATOM 0 H ASN A 312 -8.745 0.076 -10.744 1.00 0.00 H new ATOM 0 HA ASN A 312 -7.820 1.999 -12.763 1.00 0.00 H new ATOM 0 HB2 ASN A 312 -9.534 0.064 -13.134 1.00 0.00 H new ATOM 0 HB3 ASN A 312 -10.661 1.072 -12.249 1.00 0.00 H new ATOM 0 HD21 ASN A 312 -9.666 1.912 -16.139 1.00 0.00 H new ATOM 0 HD22 ASN A 312 -8.915 0.594 -15.232 1.00 0.00 H new ATOM 1055 N TYR A 313 -8.530 3.114 -10.112 1.00 0.00 N ATOM 1056 CA TYR A 313 -8.898 4.250 -9.274 1.00 0.00 C ATOM 1057 C TYR A 313 -7.657 4.982 -8.772 1.00 0.00 C ATOM 1058 O TYR A 313 -7.758 5.994 -8.078 1.00 0.00 O ATOM 1059 CB TYR A 313 -9.743 3.783 -8.088 1.00 0.00 C ATOM 1060 CG TYR A 313 -11.182 3.491 -8.448 1.00 0.00 C ATOM 1061 CD1 TYR A 313 -11.500 2.526 -9.396 1.00 0.00 C ATOM 1062 CD2 TYR A 313 -12.224 4.181 -7.841 1.00 0.00 C ATOM 1063 CE1 TYR A 313 -12.813 2.256 -9.728 1.00 0.00 C ATOM 1064 CE2 TYR A 313 -13.541 3.917 -8.166 1.00 0.00 C ATOM 1065 CZ TYR A 313 -13.830 2.954 -9.110 1.00 0.00 C ATOM 1066 OH TYR A 313 -15.140 2.689 -9.438 1.00 0.00 O ATOM 0 H TYR A 313 -7.826 2.499 -9.704 1.00 0.00 H new ATOM 0 HA TYR A 313 -9.484 4.941 -9.880 1.00 0.00 H new ATOM 0 HB2 TYR A 313 -9.294 2.885 -7.664 1.00 0.00 H new ATOM 0 HB3 TYR A 313 -9.719 4.548 -7.312 1.00 0.00 H new ATOM 0 HD1 TYR A 313 -10.706 1.978 -9.882 1.00 0.00 H new ATOM 0 HD2 TYR A 313 -12.001 4.937 -7.102 1.00 0.00 H new ATOM 0 HE1 TYR A 313 -13.042 1.503 -10.467 1.00 0.00 H new ATOM 0 HE2 TYR A 313 -14.339 4.462 -7.684 1.00 0.00 H new ATOM 0 HH TYR A 313 -15.732 3.266 -8.912 1.00 0.00 H new ATOM 1076 N ILE A 314 -6.487 4.462 -9.129 1.00 0.00 N ATOM 1077 CA ILE A 314 -5.226 5.066 -8.716 1.00 0.00 C ATOM 1078 C ILE A 314 -4.263 5.184 -9.892 1.00 0.00 C ATOM 1079 O ILE A 314 -4.524 4.667 -10.979 1.00 0.00 O ATOM 1080 CB ILE A 314 -4.552 4.253 -7.595 1.00 0.00 C ATOM 1081 CG1 ILE A 314 -4.417 2.786 -8.010 1.00 0.00 C ATOM 1082 CG2 ILE A 314 -5.347 4.373 -6.303 1.00 0.00 C ATOM 1083 CD1 ILE A 314 -3.225 2.517 -8.901 1.00 0.00 C ATOM 0 H ILE A 314 -6.386 3.625 -9.703 1.00 0.00 H new ATOM 0 HA ILE A 314 -5.461 6.062 -8.340 1.00 0.00 H new ATOM 0 HB ILE A 314 -3.554 4.656 -7.423 1.00 0.00 H new ATOM 0 HG12 ILE A 314 -4.337 2.169 -7.115 1.00 0.00 H new ATOM 0 HG13 ILE A 314 -5.325 2.479 -8.529 1.00 0.00 H new ATOM 0 HG21 ILE A 314 -4.858 3.793 -5.520 1.00 0.00 H new ATOM 0 HG22 ILE A 314 -5.397 5.419 -6.002 1.00 0.00 H new ATOM 0 HG23 ILE A 314 -6.356 3.992 -6.460 1.00 0.00 H new ATOM 0 HD11 ILE A 314 -3.193 1.458 -9.155 1.00 0.00 H new ATOM 0 HD12 ILE A 314 -3.312 3.107 -9.814 1.00 0.00 H new ATOM 0 HD13 ILE A 314 -2.310 2.793 -8.377 1.00 0.00 H new ATOM 1095 N THR A 315 -3.144 5.867 -9.668 1.00 0.00 N ATOM 1096 CA THR A 315 -2.141 6.053 -10.708 1.00 0.00 C ATOM 1097 C THR A 315 -0.737 6.101 -10.116 1.00 0.00 C ATOM 1098 O THR A 315 -0.567 6.275 -8.909 1.00 0.00 O ATOM 1099 CB THR A 315 -2.393 7.346 -11.508 1.00 0.00 C ATOM 1100 OG1 THR A 315 -1.721 7.280 -12.770 1.00 0.00 O ATOM 1101 CG2 THR A 315 -1.910 8.563 -10.734 1.00 0.00 C ATOM 0 H THR A 315 -2.910 6.300 -8.775 1.00 0.00 H new ATOM 0 HA THR A 315 -2.220 5.198 -11.379 1.00 0.00 H new ATOM 0 HB THR A 315 -3.466 7.442 -11.673 1.00 0.00 H new ATOM 0 HG1 THR A 315 -1.888 8.105 -13.273 1.00 0.00 H new ATOM 0 HG21 THR A 315 -2.098 9.464 -11.318 1.00 0.00 H new ATOM 0 HG22 THR A 315 -2.444 8.627 -9.786 1.00 0.00 H new ATOM 0 HG23 THR A 315 -0.841 8.472 -10.542 1.00 0.00 H new ATOM 1109 N LYS A 316 0.267 5.946 -10.972 1.00 0.00 N ATOM 1110 CA LYS A 316 1.658 5.974 -10.534 1.00 0.00 C ATOM 1111 C LYS A 316 2.057 7.373 -10.077 1.00 0.00 C ATOM 1112 O LYS A 316 1.515 8.370 -10.554 1.00 0.00 O ATOM 1113 CB LYS A 316 2.579 5.513 -11.666 1.00 0.00 C ATOM 1114 CG LYS A 316 2.810 4.012 -11.689 1.00 0.00 C ATOM 1115 CD LYS A 316 1.621 3.274 -12.281 1.00 0.00 C ATOM 1116 CE LYS A 316 1.589 1.820 -11.836 1.00 0.00 C ATOM 1117 NZ LYS A 316 0.669 1.003 -12.675 1.00 0.00 N ATOM 0 H LYS A 316 0.144 5.800 -11.974 1.00 0.00 H new ATOM 0 HA LYS A 316 1.761 5.293 -9.689 1.00 0.00 H new ATOM 0 HB2 LYS A 316 2.151 5.821 -12.620 1.00 0.00 H new ATOM 0 HB3 LYS A 316 3.540 6.019 -11.570 1.00 0.00 H new ATOM 0 HG2 LYS A 316 3.704 3.789 -12.271 1.00 0.00 H new ATOM 0 HG3 LYS A 316 2.993 3.655 -10.675 1.00 0.00 H new ATOM 0 HD2 LYS A 316 0.698 3.768 -11.979 1.00 0.00 H new ATOM 0 HD3 LYS A 316 1.667 3.322 -13.369 1.00 0.00 H new ATOM 0 HE2 LYS A 316 2.594 1.402 -11.887 1.00 0.00 H new ATOM 0 HE3 LYS A 316 1.274 1.766 -10.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 316 0.676 0.019 -12.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 316 -0.296 1.386 -12.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 316 0.984 1.033 -13.666 1.00 0.00 H new ATOM 1131 N ALA A 317 3.008 7.440 -9.152 1.00 0.00 N ATOM 1132 CA ALA A 317 3.482 8.717 -8.634 1.00 0.00 C ATOM 1133 C ALA A 317 4.385 9.418 -9.643 1.00 0.00 C ATOM 1134 O ALA A 317 5.600 9.222 -9.644 1.00 0.00 O ATOM 1135 CB ALA A 317 4.217 8.513 -7.317 1.00 0.00 C ATOM 0 H ALA A 317 3.466 6.624 -8.746 1.00 0.00 H new ATOM 0 HA ALA A 317 2.615 9.354 -8.458 1.00 0.00 H new ATOM 0 HB1 ALA A 317 4.565 9.475 -6.942 1.00 0.00 H new ATOM 0 HB2 ALA A 317 3.542 8.063 -6.589 1.00 0.00 H new ATOM 0 HB3 ALA A 317 5.071 7.855 -7.475 1.00 0.00 H new