USER MOD reduce.3.24.130724 H: found=0, std=0, add=645, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 645 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 401 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 414 THR OG1 : rot 180:sc= -0.999 USER MOD Set 2.1: A 390 ASN : amide:sc= -2.46! C(o=-8!,f=-16!) USER MOD Set 2.2: A 393 THR OG1 : rot -177:sc= -5.53! USER MOD Set 3.1: A 369 ASN : amide:sc= -9.65! C(o=-17!,f=-23!) USER MOD Set 3.2: A 436 GLN : amide:sc= -7.12! C(o=-17!,f=-17!) USER MOD Single : A 361 SER OG : rot 21:sc= 0.302 USER MOD Single : A 364 TYR OH : rot 180:sc= 0 USER MOD Single : A 366 GLN : amide:sc= -0.123 X(o=-0.12,f=0) USER MOD Single : A 371 SER OG : rot 180:sc= 0 USER MOD Single : A 373 THR OG1 : rot -79:sc= 0.444 USER MOD Single : A 382 LYS NZ :NH3+ 157:sc= -0.108 (180deg=-0.713) USER MOD Single : A 383 GLN : amide:sc= -0.0313 K(o=-0.031,f=-1.7!) USER MOD Single : A 384 CYS SG : rot -120:sc= -0.331 USER MOD Single : A 388 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 389 MET CE :methyl -166:sc= -2.06 (180deg=-2.74) USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 395 GLN : amide:sc= 0.00835 X(o=0.0083,f=0) USER MOD Single : A 397 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 399 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 406 THR OG1 : rot -120:sc= -0.514 USER MOD Single : A 408 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 410 LYS NZ :NH3+ 142:sc= -0.257 (180deg=-1.85!) USER MOD Single : A 416 SER OG : rot 180:sc= 0 USER MOD Single : A 417 TYR OH : rot 11:sc= 0.741 USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 433 LYS NZ :NH3+ -118:sc= 0.385 (180deg=-0.867) USER MOD Single : A 438 SER OG : rot 180:sc= 0 USER MOD Single : A 439 LYS NZ :NH3+ -157:sc= -0.045 (180deg=-0.538) USER MOD Single : A 441 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 SER OG : rot 180:sc= -0.0144 USER MOD ----------------------------------------------------------------- ATOM 168 N SER A 361 0.727 8.524 1.326 1.00 0.00 N ATOM 169 CA SER A 361 0.953 8.216 -0.082 1.00 0.00 C ATOM 170 C SER A 361 1.639 6.863 -0.239 1.00 0.00 C ATOM 171 O SER A 361 2.364 6.630 -1.206 1.00 0.00 O ATOM 172 CB SER A 361 1.803 9.310 -0.734 1.00 0.00 C ATOM 173 OG SER A 361 1.407 10.595 -0.290 1.00 0.00 O ATOM 0 HA SER A 361 -0.016 8.172 -0.579 1.00 0.00 H new ATOM 0 HB2 SER A 361 2.854 9.148 -0.497 1.00 0.00 H new ATOM 0 HB3 SER A 361 1.708 9.251 -1.818 1.00 0.00 H new ATOM 0 HG SER A 361 0.918 10.513 0.555 1.00 0.00 H new ATOM 179 N ALA A 362 1.404 5.973 0.719 1.00 0.00 N ATOM 180 CA ALA A 362 1.996 4.641 0.687 1.00 0.00 C ATOM 181 C ALA A 362 0.938 3.564 0.898 1.00 0.00 C ATOM 182 O ALA A 362 -0.163 3.847 1.373 1.00 0.00 O ATOM 183 CB ALA A 362 3.088 4.524 1.740 1.00 0.00 C ATOM 0 H ALA A 362 0.808 6.150 1.527 1.00 0.00 H new ATOM 0 HA ALA A 362 2.438 4.491 -0.298 1.00 0.00 H new ATOM 0 HB1 ALA A 362 3.521 3.525 1.705 1.00 0.00 H new ATOM 0 HB2 ALA A 362 3.864 5.263 1.543 1.00 0.00 H new ATOM 0 HB3 ALA A 362 2.662 4.700 2.728 1.00 0.00 H new ATOM 189 N ILE A 363 1.277 2.330 0.541 1.00 0.00 N ATOM 190 CA ILE A 363 0.355 1.211 0.692 1.00 0.00 C ATOM 191 C ILE A 363 1.046 0.011 1.330 1.00 0.00 C ATOM 192 O ILE A 363 2.224 -0.245 1.079 1.00 0.00 O ATOM 193 CB ILE A 363 -0.242 0.785 -0.663 1.00 0.00 C ATOM 194 CG1 ILE A 363 0.848 0.197 -1.561 1.00 0.00 C ATOM 195 CG2 ILE A 363 -0.913 1.970 -1.342 1.00 0.00 C ATOM 196 CD1 ILE A 363 0.307 -0.501 -2.790 1.00 0.00 C ATOM 0 H ILE A 363 2.183 2.080 0.145 1.00 0.00 H new ATOM 0 HA ILE A 363 -0.450 1.552 1.343 1.00 0.00 H new ATOM 0 HB ILE A 363 -0.996 0.018 -0.487 1.00 0.00 H new ATOM 0 HG12 ILE A 363 1.520 0.996 -1.873 1.00 0.00 H new ATOM 0 HG13 ILE A 363 1.441 -0.511 -0.982 1.00 0.00 H new ATOM 0 HG21 ILE A 363 -1.330 1.653 -2.298 1.00 0.00 H new ATOM 0 HG22 ILE A 363 -1.712 2.349 -0.705 1.00 0.00 H new ATOM 0 HG23 ILE A 363 -0.178 2.757 -1.510 1.00 0.00 H new ATOM 0 HD11 ILE A 363 1.135 -0.893 -3.380 1.00 0.00 H new ATOM 0 HD12 ILE A 363 -0.343 -1.322 -2.486 1.00 0.00 H new ATOM 0 HD13 ILE A 363 -0.262 0.209 -3.391 1.00 0.00 H new ATOM 208 N TYR A 364 0.305 -0.723 2.153 1.00 0.00 N ATOM 209 CA TYR A 364 0.847 -1.896 2.828 1.00 0.00 C ATOM 210 C TYR A 364 0.387 -3.179 2.142 1.00 0.00 C ATOM 211 O TYR A 364 -0.802 -3.498 2.129 1.00 0.00 O ATOM 212 CB TYR A 364 0.421 -1.908 4.296 1.00 0.00 C ATOM 213 CG TYR A 364 1.402 -2.610 5.207 1.00 0.00 C ATOM 214 CD1 TYR A 364 1.391 -3.993 5.340 1.00 0.00 C ATOM 215 CD2 TYR A 364 2.344 -1.890 5.933 1.00 0.00 C ATOM 216 CE1 TYR A 364 2.286 -4.638 6.172 1.00 0.00 C ATOM 217 CE2 TYR A 364 3.245 -2.527 6.765 1.00 0.00 C ATOM 218 CZ TYR A 364 3.211 -3.900 6.881 1.00 0.00 C ATOM 219 OH TYR A 364 4.105 -4.539 7.709 1.00 0.00 O ATOM 0 H TYR A 364 -0.672 -0.526 2.369 1.00 0.00 H new ATOM 0 HA TYR A 364 1.934 -1.846 2.773 1.00 0.00 H new ATOM 0 HB2 TYR A 364 0.293 -0.880 4.637 1.00 0.00 H new ATOM 0 HB3 TYR A 364 -0.551 -2.394 4.379 1.00 0.00 H new ATOM 0 HD1 TYR A 364 0.670 -4.574 4.783 1.00 0.00 H new ATOM 0 HD2 TYR A 364 2.372 -0.814 5.845 1.00 0.00 H new ATOM 0 HE1 TYR A 364 2.261 -5.714 6.267 1.00 0.00 H new ATOM 0 HE2 TYR A 364 3.971 -1.953 7.321 1.00 0.00 H new ATOM 0 HH TYR A 364 4.689 -3.876 8.134 1.00 0.00 H new ATOM 229 N VAL A 365 1.340 -3.913 1.574 1.00 0.00 N ATOM 230 CA VAL A 365 1.035 -5.162 0.888 1.00 0.00 C ATOM 231 C VAL A 365 1.341 -6.364 1.773 1.00 0.00 C ATOM 232 O VAL A 365 2.379 -6.413 2.432 1.00 0.00 O ATOM 233 CB VAL A 365 1.831 -5.289 -0.426 1.00 0.00 C ATOM 234 CG1 VAL A 365 1.307 -6.451 -1.256 1.00 0.00 C ATOM 235 CG2 VAL A 365 1.768 -3.990 -1.214 1.00 0.00 C ATOM 0 H VAL A 365 2.329 -3.663 1.576 1.00 0.00 H new ATOM 0 HA VAL A 365 -0.031 -5.146 0.659 1.00 0.00 H new ATOM 0 HB VAL A 365 2.874 -5.489 -0.181 1.00 0.00 H new ATOM 0 HG11 VAL A 365 1.880 -6.526 -2.180 1.00 0.00 H new ATOM 0 HG12 VAL A 365 1.408 -7.377 -0.690 1.00 0.00 H new ATOM 0 HG13 VAL A 365 0.256 -6.284 -1.494 1.00 0.00 H new ATOM 0 HG21 VAL A 365 2.335 -4.097 -2.139 1.00 0.00 H new ATOM 0 HG22 VAL A 365 0.730 -3.758 -1.450 1.00 0.00 H new ATOM 0 HG23 VAL A 365 2.194 -3.182 -0.619 1.00 0.00 H new ATOM 245 N GLN A 366 0.432 -7.333 1.783 1.00 0.00 N ATOM 246 CA GLN A 366 0.605 -8.536 2.588 1.00 0.00 C ATOM 247 C GLN A 366 0.057 -9.760 1.862 1.00 0.00 C ATOM 248 O GLN A 366 -1.124 -9.818 1.524 1.00 0.00 O ATOM 249 CB GLN A 366 -0.093 -8.375 3.939 1.00 0.00 C ATOM 250 CG GLN A 366 0.791 -7.761 5.012 1.00 0.00 C ATOM 251 CD GLN A 366 0.015 -7.363 6.252 1.00 0.00 C ATOM 252 OE1 GLN A 366 0.323 -7.804 7.359 1.00 0.00 O ATOM 253 NE2 GLN A 366 -0.997 -6.524 6.072 1.00 0.00 N ATOM 0 H GLN A 366 -0.433 -7.308 1.242 1.00 0.00 H new ATOM 0 HA GLN A 366 1.672 -8.682 2.753 1.00 0.00 H new ATOM 0 HB2 GLN A 366 -0.978 -7.752 3.809 1.00 0.00 H new ATOM 0 HB3 GLN A 366 -0.438 -9.352 4.279 1.00 0.00 H new ATOM 0 HG2 GLN A 366 1.568 -8.473 5.288 1.00 0.00 H new ATOM 0 HG3 GLN A 366 1.293 -6.883 4.605 1.00 0.00 H new ATOM 0 HE21 GLN A 366 -1.217 -6.183 5.136 1.00 0.00 H new ATOM 0 HE22 GLN A 366 -1.555 -6.220 6.870 1.00 0.00 H new ATOM 262 N GLY A 367 0.926 -10.739 1.624 1.00 0.00 N ATOM 263 CA GLY A 367 0.510 -11.949 0.940 1.00 0.00 C ATOM 264 C GLY A 367 1.414 -12.294 -0.227 1.00 0.00 C ATOM 265 O GLY A 367 1.023 -13.040 -1.126 1.00 0.00 O ATOM 0 H GLY A 367 1.910 -10.715 1.893 1.00 0.00 H new ATOM 0 HA2 GLY A 367 0.502 -12.778 1.647 1.00 0.00 H new ATOM 0 HA3 GLY A 367 -0.512 -11.827 0.581 1.00 0.00 H new ATOM 269 N LEU A 368 2.625 -11.749 -0.218 1.00 0.00 N ATOM 270 CA LEU A 368 3.587 -12.001 -1.284 1.00 0.00 C ATOM 271 C LEU A 368 4.262 -13.356 -1.100 1.00 0.00 C ATOM 272 O LEU A 368 4.343 -13.875 0.012 1.00 0.00 O ATOM 273 CB LEU A 368 4.643 -10.894 -1.319 1.00 0.00 C ATOM 274 CG LEU A 368 4.137 -9.495 -1.675 1.00 0.00 C ATOM 275 CD1 LEU A 368 5.225 -8.459 -1.445 1.00 0.00 C ATOM 276 CD2 LEU A 368 3.652 -9.454 -3.116 1.00 0.00 C ATOM 0 H LEU A 368 2.964 -11.129 0.517 1.00 0.00 H new ATOM 0 HA LEU A 368 3.047 -12.010 -2.231 1.00 0.00 H new ATOM 0 HB2 LEU A 368 5.124 -10.847 -0.342 1.00 0.00 H new ATOM 0 HB3 LEU A 368 5.411 -11.175 -2.039 1.00 0.00 H new ATOM 0 HG LEU A 368 3.296 -9.257 -1.024 1.00 0.00 H new ATOM 0 HD11 LEU A 368 4.846 -7.470 -1.704 1.00 0.00 H new ATOM 0 HD12 LEU A 368 5.523 -8.471 -0.397 1.00 0.00 H new ATOM 0 HD13 LEU A 368 6.087 -8.692 -2.070 1.00 0.00 H new ATOM 0 HD21 LEU A 368 3.296 -8.451 -3.352 1.00 0.00 H new ATOM 0 HD22 LEU A 368 4.473 -9.713 -3.784 1.00 0.00 H new ATOM 0 HD23 LEU A 368 2.839 -10.168 -3.247 1.00 0.00 H new ATOM 288 N ASN A 369 4.747 -13.925 -2.199 1.00 0.00 N ATOM 289 CA ASN A 369 5.416 -15.220 -2.158 1.00 0.00 C ATOM 290 C ASN A 369 6.819 -15.088 -1.573 1.00 0.00 C ATOM 291 O ASN A 369 7.264 -13.990 -1.241 1.00 0.00 O ATOM 292 CB ASN A 369 5.492 -15.822 -3.563 1.00 0.00 C ATOM 293 CG ASN A 369 6.066 -14.852 -4.579 1.00 0.00 C ATOM 294 OD1 ASN A 369 7.273 -14.830 -4.819 1.00 0.00 O ATOM 295 ND2 ASN A 369 5.200 -14.045 -5.179 1.00 0.00 N ATOM 0 H ASN A 369 4.689 -13.510 -3.129 1.00 0.00 H new ATOM 0 HA ASN A 369 4.834 -15.882 -1.517 1.00 0.00 H new ATOM 0 HB2 ASN A 369 6.107 -16.722 -3.537 1.00 0.00 H new ATOM 0 HB3 ASN A 369 4.494 -16.126 -3.879 1.00 0.00 H new ATOM 0 HD21 ASN A 369 5.526 -13.371 -5.871 1.00 0.00 H new ATOM 0 HD22 ASN A 369 4.208 -14.099 -4.948 1.00 0.00 H new ATOM 302 N ASP A 370 7.510 -16.216 -1.450 1.00 0.00 N ATOM 303 CA ASP A 370 8.864 -16.228 -0.906 1.00 0.00 C ATOM 304 C ASP A 370 9.898 -16.084 -2.019 1.00 0.00 C ATOM 305 O ASP A 370 11.088 -16.315 -1.806 1.00 0.00 O ATOM 306 CB ASP A 370 9.111 -17.520 -0.126 1.00 0.00 C ATOM 307 CG ASP A 370 8.788 -18.758 -0.940 1.00 0.00 C ATOM 308 OD1 ASP A 370 7.953 -18.660 -1.862 1.00 0.00 O ATOM 309 OD2 ASP A 370 9.369 -19.826 -0.652 1.00 0.00 O ATOM 0 H ASP A 370 7.156 -17.134 -1.719 1.00 0.00 H new ATOM 0 HA ASP A 370 8.965 -15.380 -0.229 1.00 0.00 H new ATOM 0 HB2 ASP A 370 10.154 -17.557 0.189 1.00 0.00 H new ATOM 0 HB3 ASP A 370 8.505 -17.516 0.780 1.00 0.00 H new ATOM 314 N SER A 371 9.435 -15.702 -3.204 1.00 0.00 N ATOM 315 CA SER A 371 10.319 -15.531 -4.351 1.00 0.00 C ATOM 316 C SER A 371 10.086 -14.181 -5.021 1.00 0.00 C ATOM 317 O SER A 371 10.551 -13.938 -6.135 1.00 0.00 O ATOM 318 CB SER A 371 10.099 -16.659 -5.362 1.00 0.00 C ATOM 319 OG SER A 371 10.938 -17.766 -5.081 1.00 0.00 O ATOM 0 H SER A 371 8.453 -15.505 -3.395 1.00 0.00 H new ATOM 0 HA SER A 371 11.348 -15.566 -3.994 1.00 0.00 H new ATOM 0 HB2 SER A 371 9.056 -16.974 -5.339 1.00 0.00 H new ATOM 0 HB3 SER A 371 10.299 -16.293 -6.369 1.00 0.00 H new ATOM 0 HG SER A 371 10.777 -18.474 -5.740 1.00 0.00 H new ATOM 325 N VAL A 372 9.363 -13.302 -4.333 1.00 0.00 N ATOM 326 CA VAL A 372 9.068 -11.975 -4.859 1.00 0.00 C ATOM 327 C VAL A 372 10.287 -11.064 -4.764 1.00 0.00 C ATOM 328 O VAL A 372 11.040 -11.113 -3.792 1.00 0.00 O ATOM 329 CB VAL A 372 7.894 -11.321 -4.106 1.00 0.00 C ATOM 330 CG1 VAL A 372 8.197 -11.228 -2.619 1.00 0.00 C ATOM 331 CG2 VAL A 372 7.590 -9.947 -4.685 1.00 0.00 C ATOM 0 H VAL A 372 8.971 -13.486 -3.410 1.00 0.00 H new ATOM 0 HA VAL A 372 8.793 -12.103 -5.906 1.00 0.00 H new ATOM 0 HB VAL A 372 7.011 -11.947 -4.232 1.00 0.00 H new ATOM 0 HG11 VAL A 372 7.356 -10.763 -2.105 1.00 0.00 H new ATOM 0 HG12 VAL A 372 8.360 -12.228 -2.218 1.00 0.00 H new ATOM 0 HG13 VAL A 372 9.093 -10.626 -2.467 1.00 0.00 H new ATOM 0 HG21 VAL A 372 6.758 -9.499 -4.141 1.00 0.00 H new ATOM 0 HG22 VAL A 372 8.470 -9.310 -4.591 1.00 0.00 H new ATOM 0 HG23 VAL A 372 7.324 -10.046 -5.737 1.00 0.00 H new ATOM 341 N THR A 373 10.476 -10.231 -5.784 1.00 0.00 N ATOM 342 CA THR A 373 11.604 -9.309 -5.817 1.00 0.00 C ATOM 343 C THR A 373 11.130 -7.865 -5.928 1.00 0.00 C ATOM 344 O THR A 373 9.997 -7.601 -6.332 1.00 0.00 O ATOM 345 CB THR A 373 12.549 -9.618 -6.995 1.00 0.00 C ATOM 346 OG1 THR A 373 11.829 -9.552 -8.231 1.00 0.00 O ATOM 347 CG2 THR A 373 13.172 -10.997 -6.839 1.00 0.00 C ATOM 0 H THR A 373 9.862 -10.177 -6.597 1.00 0.00 H new ATOM 0 HA THR A 373 12.147 -9.441 -4.881 1.00 0.00 H new ATOM 0 HB THR A 373 13.345 -8.874 -6.999 1.00 0.00 H new ATOM 0 HG1 THR A 373 11.314 -10.377 -8.354 1.00 0.00 H new ATOM 0 HG21 THR A 373 13.835 -11.194 -7.681 1.00 0.00 H new ATOM 0 HG22 THR A 373 13.743 -11.036 -5.911 1.00 0.00 H new ATOM 0 HG23 THR A 373 12.385 -11.751 -6.813 1.00 0.00 H new ATOM 355 N LEU A 374 12.004 -6.931 -5.568 1.00 0.00 N ATOM 356 CA LEU A 374 11.674 -5.511 -5.627 1.00 0.00 C ATOM 357 C LEU A 374 11.235 -5.113 -7.032 1.00 0.00 C ATOM 358 O LEU A 374 10.128 -4.612 -7.229 1.00 0.00 O ATOM 359 CB LEU A 374 12.877 -4.670 -5.198 1.00 0.00 C ATOM 360 CG LEU A 374 12.842 -3.195 -5.600 1.00 0.00 C ATOM 361 CD1 LEU A 374 11.923 -2.412 -4.676 1.00 0.00 C ATOM 362 CD2 LEU A 374 14.244 -2.604 -5.584 1.00 0.00 C ATOM 0 H LEU A 374 12.946 -7.131 -5.232 1.00 0.00 H new ATOM 0 HA LEU A 374 10.847 -5.326 -4.942 1.00 0.00 H new ATOM 0 HB2 LEU A 374 12.968 -4.728 -4.113 1.00 0.00 H new ATOM 0 HB3 LEU A 374 13.777 -5.119 -5.618 1.00 0.00 H new ATOM 0 HG LEU A 374 12.451 -3.125 -6.615 1.00 0.00 H new ATOM 0 HD11 LEU A 374 11.911 -1.365 -4.977 1.00 0.00 H new ATOM 0 HD12 LEU A 374 10.914 -2.819 -4.736 1.00 0.00 H new ATOM 0 HD13 LEU A 374 12.285 -2.490 -3.651 1.00 0.00 H new ATOM 0 HD21 LEU A 374 14.199 -1.554 -5.873 1.00 0.00 H new ATOM 0 HD22 LEU A 374 14.662 -2.687 -4.581 1.00 0.00 H new ATOM 0 HD23 LEU A 374 14.876 -3.147 -6.287 1.00 0.00 H new ATOM 374 N ASP A 375 12.109 -5.340 -8.006 1.00 0.00 N ATOM 375 CA ASP A 375 11.811 -5.006 -9.394 1.00 0.00 C ATOM 376 C ASP A 375 10.459 -5.577 -9.811 1.00 0.00 C ATOM 377 O ASP A 375 9.707 -4.941 -10.550 1.00 0.00 O ATOM 378 CB ASP A 375 12.909 -5.539 -10.316 1.00 0.00 C ATOM 379 CG ASP A 375 14.199 -4.752 -10.194 1.00 0.00 C ATOM 380 OD1 ASP A 375 14.974 -5.023 -9.253 1.00 0.00 O ATOM 381 OD2 ASP A 375 14.435 -3.863 -11.040 1.00 0.00 O ATOM 0 H ASP A 375 13.030 -5.754 -7.860 1.00 0.00 H new ATOM 0 HA ASP A 375 11.770 -3.920 -9.480 1.00 0.00 H new ATOM 0 HB2 ASP A 375 13.101 -6.586 -10.080 1.00 0.00 H new ATOM 0 HB3 ASP A 375 12.561 -5.504 -11.348 1.00 0.00 H new ATOM 386 N ASP A 376 10.158 -6.780 -9.335 1.00 0.00 N ATOM 387 CA ASP A 376 8.897 -7.437 -9.657 1.00 0.00 C ATOM 388 C ASP A 376 7.720 -6.685 -9.043 1.00 0.00 C ATOM 389 O ASP A 376 6.603 -6.728 -9.562 1.00 0.00 O ATOM 390 CB ASP A 376 8.908 -8.884 -9.161 1.00 0.00 C ATOM 391 CG ASP A 376 9.449 -9.847 -10.200 1.00 0.00 C ATOM 392 OD1 ASP A 376 9.157 -9.653 -11.399 1.00 0.00 O ATOM 393 OD2 ASP A 376 10.164 -10.795 -9.814 1.00 0.00 O ATOM 0 H ASP A 376 10.771 -7.320 -8.724 1.00 0.00 H new ATOM 0 HA ASP A 376 8.782 -7.434 -10.741 1.00 0.00 H new ATOM 0 HB2 ASP A 376 9.514 -8.951 -8.257 1.00 0.00 H new ATOM 0 HB3 ASP A 376 7.895 -9.179 -8.888 1.00 0.00 H new ATOM 398 N LEU A 377 7.976 -5.997 -7.936 1.00 0.00 N ATOM 399 CA LEU A 377 6.938 -5.237 -7.250 1.00 0.00 C ATOM 400 C LEU A 377 6.854 -3.816 -7.796 1.00 0.00 C ATOM 401 O LEU A 377 5.781 -3.215 -7.830 1.00 0.00 O ATOM 402 CB LEU A 377 7.213 -5.203 -5.745 1.00 0.00 C ATOM 403 CG LEU A 377 7.002 -6.519 -4.994 1.00 0.00 C ATOM 404 CD1 LEU A 377 7.274 -6.334 -3.510 1.00 0.00 C ATOM 405 CD2 LEU A 377 5.591 -7.041 -5.220 1.00 0.00 C ATOM 0 H LEU A 377 8.894 -5.950 -7.494 1.00 0.00 H new ATOM 0 HA LEU A 377 5.983 -5.731 -7.427 1.00 0.00 H new ATOM 0 HB2 LEU A 377 8.243 -4.881 -5.591 1.00 0.00 H new ATOM 0 HB3 LEU A 377 6.572 -4.445 -5.296 1.00 0.00 H new ATOM 0 HG LEU A 377 7.706 -7.255 -5.382 1.00 0.00 H new ATOM 0 HD11 LEU A 377 7.119 -7.280 -2.991 1.00 0.00 H new ATOM 0 HD12 LEU A 377 8.304 -6.006 -3.367 1.00 0.00 H new ATOM 0 HD13 LEU A 377 6.595 -5.583 -3.106 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.458 -7.978 -4.679 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.870 -6.308 -4.859 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.432 -7.212 -6.285 1.00 0.00 H new ATOM 417 N ALA A 378 7.994 -3.283 -8.224 1.00 0.00 N ATOM 418 CA ALA A 378 8.049 -1.934 -8.772 1.00 0.00 C ATOM 419 C ALA A 378 7.428 -1.880 -10.163 1.00 0.00 C ATOM 420 O ALA A 378 6.820 -0.880 -10.545 1.00 0.00 O ATOM 421 CB ALA A 378 9.488 -1.439 -8.815 1.00 0.00 C ATOM 0 H ALA A 378 8.892 -3.766 -8.201 1.00 0.00 H new ATOM 0 HA ALA A 378 7.471 -1.280 -8.119 1.00 0.00 H new ATOM 0 HB1 ALA A 378 9.514 -0.430 -9.227 1.00 0.00 H new ATOM 0 HB2 ALA A 378 9.900 -1.430 -7.806 1.00 0.00 H new ATOM 0 HB3 ALA A 378 10.082 -2.102 -9.443 1.00 0.00 H new ATOM 427 N ASP A 379 7.584 -2.963 -10.917 1.00 0.00 N ATOM 428 CA ASP A 379 7.038 -3.040 -12.267 1.00 0.00 C ATOM 429 C ASP A 379 5.566 -3.440 -12.236 1.00 0.00 C ATOM 430 O ASP A 379 4.830 -3.211 -13.195 1.00 0.00 O ATOM 431 CB ASP A 379 7.834 -4.040 -13.106 1.00 0.00 C ATOM 432 CG ASP A 379 7.609 -3.856 -14.594 1.00 0.00 C ATOM 433 OD1 ASP A 379 6.446 -3.648 -14.997 1.00 0.00 O ATOM 434 OD2 ASP A 379 8.597 -3.923 -15.357 1.00 0.00 O ATOM 0 H ASP A 379 8.084 -3.800 -10.616 1.00 0.00 H new ATOM 0 HA ASP A 379 7.118 -2.052 -12.721 1.00 0.00 H new ATOM 0 HB2 ASP A 379 8.896 -3.930 -12.886 1.00 0.00 H new ATOM 0 HB3 ASP A 379 7.552 -5.054 -12.822 1.00 0.00 H new ATOM 439 N PHE A 380 5.146 -4.040 -11.127 1.00 0.00 N ATOM 440 CA PHE A 380 3.762 -4.476 -10.972 1.00 0.00 C ATOM 441 C PHE A 380 2.925 -3.394 -10.295 1.00 0.00 C ATOM 442 O PHE A 380 1.837 -3.053 -10.761 1.00 0.00 O ATOM 443 CB PHE A 380 3.701 -5.768 -10.156 1.00 0.00 C ATOM 444 CG PHE A 380 2.301 -6.205 -9.831 1.00 0.00 C ATOM 445 CD1 PHE A 380 1.392 -6.473 -10.841 1.00 0.00 C ATOM 446 CD2 PHE A 380 1.895 -6.349 -8.514 1.00 0.00 C ATOM 447 CE1 PHE A 380 0.103 -6.876 -10.544 1.00 0.00 C ATOM 448 CE2 PHE A 380 0.608 -6.752 -8.211 1.00 0.00 C ATOM 449 CZ PHE A 380 -0.290 -7.014 -9.229 1.00 0.00 C ATOM 0 H PHE A 380 5.743 -4.235 -10.323 1.00 0.00 H new ATOM 0 HA PHE A 380 3.352 -4.662 -11.965 1.00 0.00 H new ATOM 0 HB2 PHE A 380 4.202 -6.562 -10.710 1.00 0.00 H new ATOM 0 HB3 PHE A 380 4.255 -5.629 -9.227 1.00 0.00 H new ATOM 0 HD1 PHE A 380 1.693 -6.366 -11.873 1.00 0.00 H new ATOM 0 HD2 PHE A 380 2.592 -6.144 -7.715 1.00 0.00 H new ATOM 0 HE1 PHE A 380 -0.596 -7.083 -11.341 1.00 0.00 H new ATOM 0 HE2 PHE A 380 0.304 -6.862 -7.180 1.00 0.00 H new ATOM 0 HZ PHE A 380 -1.297 -7.326 -8.995 1.00 0.00 H new ATOM 459 N PHE A 381 3.440 -2.858 -9.193 1.00 0.00 N ATOM 460 CA PHE A 381 2.741 -1.816 -8.451 1.00 0.00 C ATOM 461 C PHE A 381 2.588 -0.554 -9.296 1.00 0.00 C ATOM 462 O PHE A 381 1.750 0.301 -9.011 1.00 0.00 O ATOM 463 CB PHE A 381 3.491 -1.490 -7.158 1.00 0.00 C ATOM 464 CG PHE A 381 3.281 -2.505 -6.071 1.00 0.00 C ATOM 465 CD1 PHE A 381 2.002 -2.882 -5.695 1.00 0.00 C ATOM 466 CD2 PHE A 381 4.364 -3.081 -5.425 1.00 0.00 C ATOM 467 CE1 PHE A 381 1.806 -3.817 -4.695 1.00 0.00 C ATOM 468 CE2 PHE A 381 4.173 -4.016 -4.425 1.00 0.00 C ATOM 469 CZ PHE A 381 2.893 -4.382 -4.058 1.00 0.00 C ATOM 0 H PHE A 381 4.339 -3.128 -8.794 1.00 0.00 H new ATOM 0 HA PHE A 381 1.747 -2.188 -8.202 1.00 0.00 H new ATOM 0 HB2 PHE A 381 4.557 -1.416 -7.374 1.00 0.00 H new ATOM 0 HB3 PHE A 381 3.170 -0.512 -6.798 1.00 0.00 H new ATOM 0 HD1 PHE A 381 1.149 -2.441 -6.188 1.00 0.00 H new ATOM 0 HD2 PHE A 381 5.367 -2.796 -5.706 1.00 0.00 H new ATOM 0 HE1 PHE A 381 0.804 -4.105 -4.413 1.00 0.00 H new ATOM 0 HE2 PHE A 381 5.024 -4.460 -3.931 1.00 0.00 H new ATOM 0 HZ PHE A 381 2.742 -5.109 -3.274 1.00 0.00 H new ATOM 479 N LYS A 382 3.406 -0.445 -10.337 1.00 0.00 N ATOM 480 CA LYS A 382 3.364 0.710 -11.227 1.00 0.00 C ATOM 481 C LYS A 382 2.170 0.626 -12.172 1.00 0.00 C ATOM 482 O LYS A 382 1.890 1.565 -12.916 1.00 0.00 O ATOM 483 CB LYS A 382 4.661 0.805 -12.033 1.00 0.00 C ATOM 484 CG LYS A 382 4.811 -0.287 -13.076 1.00 0.00 C ATOM 485 CD LYS A 382 5.631 0.185 -14.265 1.00 0.00 C ATOM 486 CE LYS A 382 4.752 0.820 -15.332 1.00 0.00 C ATOM 487 NZ LYS A 382 4.556 2.277 -15.093 1.00 0.00 N ATOM 0 H LYS A 382 4.107 -1.143 -10.586 1.00 0.00 H new ATOM 0 HA LYS A 382 3.257 1.606 -10.615 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.701 1.776 -12.527 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.508 0.761 -11.349 1.00 0.00 H new ATOM 0 HG2 LYS A 382 5.289 -1.157 -12.626 1.00 0.00 H new ATOM 0 HG3 LYS A 382 3.825 -0.604 -13.416 1.00 0.00 H new ATOM 0 HD2 LYS A 382 6.377 0.906 -13.931 1.00 0.00 H new ATOM 0 HD3 LYS A 382 6.172 -0.659 -14.693 1.00 0.00 H new ATOM 0 HE2 LYS A 382 5.205 0.670 -16.312 1.00 0.00 H new ATOM 0 HE3 LYS A 382 3.783 0.321 -15.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 4.307 2.745 -15.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 3.789 2.416 -14.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 5.435 2.689 -14.720 1.00 0.00 H new ATOM 501 N GLN A 383 1.471 -0.503 -12.135 1.00 0.00 N ATOM 502 CA GLN A 383 0.306 -0.709 -12.989 1.00 0.00 C ATOM 503 C GLN A 383 -0.704 0.421 -12.812 1.00 0.00 C ATOM 504 O GLN A 383 -1.073 1.093 -13.776 1.00 0.00 O ATOM 505 CB GLN A 383 -0.353 -2.052 -12.674 1.00 0.00 C ATOM 506 CG GLN A 383 0.300 -3.230 -13.377 1.00 0.00 C ATOM 507 CD GLN A 383 -0.576 -4.467 -13.381 1.00 0.00 C ATOM 508 OE1 GLN A 383 -1.738 -4.419 -12.978 1.00 0.00 O ATOM 509 NE2 GLN A 383 -0.022 -5.585 -13.837 1.00 0.00 N ATOM 0 H GLN A 383 1.690 -1.289 -11.523 1.00 0.00 H new ATOM 0 HA GLN A 383 0.643 -0.713 -14.026 1.00 0.00 H new ATOM 0 HB2 GLN A 383 -0.321 -2.219 -11.597 1.00 0.00 H new ATOM 0 HB3 GLN A 383 -1.404 -2.007 -12.959 1.00 0.00 H new ATOM 0 HG2 GLN A 383 0.533 -2.951 -14.405 1.00 0.00 H new ATOM 0 HG3 GLN A 383 1.246 -3.461 -12.887 1.00 0.00 H new ATOM 0 HE21 GLN A 383 0.945 -5.579 -14.161 1.00 0.00 H new ATOM 0 HE22 GLN A 383 -0.564 -6.449 -13.863 1.00 0.00 H new ATOM 518 N CYS A 384 -1.145 0.625 -11.577 1.00 0.00 N ATOM 519 CA CYS A 384 -2.114 1.673 -11.274 1.00 0.00 C ATOM 520 C CYS A 384 -1.601 3.035 -11.728 1.00 0.00 C ATOM 521 O CYS A 384 -2.166 3.655 -12.628 1.00 0.00 O ATOM 522 CB CYS A 384 -2.415 1.701 -9.774 1.00 0.00 C ATOM 523 SG CYS A 384 -3.482 3.067 -9.261 1.00 0.00 S ATOM 0 H CYS A 384 -0.848 0.079 -10.768 1.00 0.00 H new ATOM 0 HA CYS A 384 -3.033 1.452 -11.817 1.00 0.00 H new ATOM 0 HB2 CYS A 384 -2.887 0.760 -9.491 1.00 0.00 H new ATOM 0 HB3 CYS A 384 -1.474 1.763 -9.227 1.00 0.00 H new ATOM 0 HG CYS A 384 -2.854 3.807 -8.396 1.00 0.00 H new ATOM 529 N GLY A 385 -0.525 3.496 -11.098 1.00 0.00 N ATOM 530 CA GLY A 385 0.046 4.785 -11.449 1.00 0.00 C ATOM 531 C GLY A 385 1.557 4.739 -11.555 1.00 0.00 C ATOM 532 O GLY A 385 2.111 3.917 -12.284 1.00 0.00 O ATOM 0 H GLY A 385 -0.038 3.001 -10.351 1.00 0.00 H new ATOM 0 HA2 GLY A 385 -0.372 5.118 -12.399 1.00 0.00 H new ATOM 0 HA3 GLY A 385 -0.240 5.522 -10.699 1.00 0.00 H new ATOM 536 N VAL A 386 2.226 5.625 -10.824 1.00 0.00 N ATOM 537 CA VAL A 386 3.683 5.684 -10.839 1.00 0.00 C ATOM 538 C VAL A 386 4.252 5.567 -9.429 1.00 0.00 C ATOM 539 O VAL A 386 3.795 6.239 -8.506 1.00 0.00 O ATOM 540 CB VAL A 386 4.186 6.992 -11.477 1.00 0.00 C ATOM 541 CG1 VAL A 386 5.673 7.177 -11.216 1.00 0.00 C ATOM 542 CG2 VAL A 386 3.892 7.005 -12.970 1.00 0.00 C ATOM 0 H VAL A 386 1.782 6.312 -10.214 1.00 0.00 H new ATOM 0 HA VAL A 386 4.028 4.841 -11.438 1.00 0.00 H new ATOM 0 HB VAL A 386 3.655 7.826 -11.019 1.00 0.00 H new ATOM 0 HG11 VAL A 386 6.010 8.107 -11.675 1.00 0.00 H new ATOM 0 HG12 VAL A 386 5.852 7.217 -10.141 1.00 0.00 H new ATOM 0 HG13 VAL A 386 6.225 6.340 -11.645 1.00 0.00 H new ATOM 0 HG21 VAL A 386 4.254 7.937 -13.404 1.00 0.00 H new ATOM 0 HG22 VAL A 386 4.394 6.163 -13.447 1.00 0.00 H new ATOM 0 HG23 VAL A 386 2.817 6.924 -13.130 1.00 0.00 H new ATOM 552 N VAL A 387 5.254 4.707 -9.271 1.00 0.00 N ATOM 553 CA VAL A 387 5.887 4.503 -7.975 1.00 0.00 C ATOM 554 C VAL A 387 7.016 5.503 -7.749 1.00 0.00 C ATOM 555 O VAL A 387 7.899 5.659 -8.592 1.00 0.00 O ATOM 556 CB VAL A 387 6.449 3.074 -7.843 1.00 0.00 C ATOM 557 CG1 VAL A 387 7.081 2.872 -6.474 1.00 0.00 C ATOM 558 CG2 VAL A 387 5.355 2.047 -8.093 1.00 0.00 C ATOM 0 H VAL A 387 5.644 4.141 -10.025 1.00 0.00 H new ATOM 0 HA VAL A 387 5.115 4.654 -7.220 1.00 0.00 H new ATOM 0 HB VAL A 387 7.224 2.936 -8.597 1.00 0.00 H new ATOM 0 HG11 VAL A 387 7.472 1.857 -6.400 1.00 0.00 H new ATOM 0 HG12 VAL A 387 7.894 3.585 -6.340 1.00 0.00 H new ATOM 0 HG13 VAL A 387 6.330 3.029 -5.700 1.00 0.00 H new ATOM 0 HG21 VAL A 387 5.769 1.043 -7.996 1.00 0.00 H new ATOM 0 HG22 VAL A 387 4.556 2.182 -7.364 1.00 0.00 H new ATOM 0 HG23 VAL A 387 4.955 2.179 -9.098 1.00 0.00 H new ATOM 568 N LYS A 388 6.980 6.180 -6.607 1.00 0.00 N ATOM 569 CA LYS A 388 8.000 7.166 -6.268 1.00 0.00 C ATOM 570 C LYS A 388 9.399 6.584 -6.448 1.00 0.00 C ATOM 571 O LYS A 388 9.834 5.739 -5.668 1.00 0.00 O ATOM 572 CB LYS A 388 7.816 7.645 -4.827 1.00 0.00 C ATOM 573 CG LYS A 388 8.674 8.848 -4.472 1.00 0.00 C ATOM 574 CD LYS A 388 8.016 9.706 -3.405 1.00 0.00 C ATOM 575 CE LYS A 388 8.873 10.913 -3.054 1.00 0.00 C ATOM 576 NZ LYS A 388 8.098 11.946 -2.312 1.00 0.00 N ATOM 0 H LYS A 388 6.255 6.064 -5.899 1.00 0.00 H new ATOM 0 HA LYS A 388 7.889 8.015 -6.943 1.00 0.00 H new ATOM 0 HB2 LYS A 388 6.768 7.897 -4.668 1.00 0.00 H new ATOM 0 HB3 LYS A 388 8.054 6.826 -4.148 1.00 0.00 H new ATOM 0 HG2 LYS A 388 9.648 8.510 -4.119 1.00 0.00 H new ATOM 0 HG3 LYS A 388 8.849 9.447 -5.365 1.00 0.00 H new ATOM 0 HD2 LYS A 388 7.040 10.041 -3.757 1.00 0.00 H new ATOM 0 HD3 LYS A 388 7.844 9.108 -2.510 1.00 0.00 H new ATOM 0 HE2 LYS A 388 9.722 10.592 -2.450 1.00 0.00 H new ATOM 0 HE3 LYS A 388 9.278 11.349 -3.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 8.717 12.752 -2.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 7.302 12.271 -2.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 7.733 11.538 -1.428 1.00 0.00 H new ATOM 590 N MET A 389 10.097 7.044 -7.481 1.00 0.00 N ATOM 591 CA MET A 389 11.448 6.571 -7.760 1.00 0.00 C ATOM 592 C MET A 389 12.485 7.610 -7.342 1.00 0.00 C ATOM 593 O MET A 389 12.455 8.750 -7.802 1.00 0.00 O ATOM 594 CB MET A 389 11.602 6.250 -9.248 1.00 0.00 C ATOM 595 CG MET A 389 11.018 4.904 -9.643 1.00 0.00 C ATOM 596 SD MET A 389 11.957 3.516 -8.977 1.00 0.00 S ATOM 597 CE MET A 389 13.525 3.736 -9.816 1.00 0.00 C ATOM 0 H MET A 389 9.750 7.743 -8.138 1.00 0.00 H new ATOM 0 HA MET A 389 11.615 5.663 -7.181 1.00 0.00 H new ATOM 0 HB2 MET A 389 11.118 7.032 -9.832 1.00 0.00 H new ATOM 0 HB3 MET A 389 12.661 6.268 -9.507 1.00 0.00 H new ATOM 0 HG2 MET A 389 9.988 4.842 -9.292 1.00 0.00 H new ATOM 0 HG3 MET A 389 10.989 4.830 -10.730 1.00 0.00 H new ATOM 0 HE1 MET A 389 14.125 2.832 -9.709 1.00 0.00 H new ATOM 0 HE2 MET A 389 13.348 3.930 -10.874 1.00 0.00 H new ATOM 0 HE3 MET A 389 14.058 4.579 -9.377 1.00 0.00 H new ATOM 607 N ASN A 390 13.401 7.206 -6.468 1.00 0.00 N ATOM 608 CA ASN A 390 14.446 8.102 -5.987 1.00 0.00 C ATOM 609 C ASN A 390 15.106 8.840 -7.148 1.00 0.00 C ATOM 610 O ASN A 390 15.295 8.279 -8.228 1.00 0.00 O ATOM 611 CB ASN A 390 15.500 7.317 -5.203 1.00 0.00 C ATOM 612 CG ASN A 390 16.277 8.194 -4.241 1.00 0.00 C ATOM 613 OD1 ASN A 390 16.675 9.307 -4.582 1.00 0.00 O ATOM 614 ND2 ASN A 390 16.495 7.694 -3.029 1.00 0.00 N ATOM 0 H ASN A 390 13.441 6.264 -6.079 1.00 0.00 H new ATOM 0 HA ASN A 390 13.984 8.836 -5.327 1.00 0.00 H new ATOM 0 HB2 ASN A 390 15.013 6.515 -4.647 1.00 0.00 H new ATOM 0 HB3 ASN A 390 16.192 6.846 -5.901 1.00 0.00 H new ATOM 0 HD21 ASN A 390 17.011 8.238 -2.338 1.00 0.00 H new ATOM 0 HD22 ASN A 390 16.146 6.766 -2.790 1.00 0.00 H new ATOM 621 N LYS A 391 15.455 10.102 -6.919 1.00 0.00 N ATOM 622 CA LYS A 391 16.096 10.917 -7.944 1.00 0.00 C ATOM 623 C LYS A 391 17.615 10.851 -7.821 1.00 0.00 C ATOM 624 O LYS A 391 18.337 11.174 -8.764 1.00 0.00 O ATOM 625 CB LYS A 391 15.626 12.369 -7.835 1.00 0.00 C ATOM 626 CG LYS A 391 16.278 13.297 -8.847 1.00 0.00 C ATOM 627 CD LYS A 391 15.730 14.710 -8.742 1.00 0.00 C ATOM 628 CE LYS A 391 16.015 15.513 -10.003 1.00 0.00 C ATOM 629 NZ LYS A 391 17.387 16.091 -9.992 1.00 0.00 N ATOM 0 H LYS A 391 15.304 10.582 -6.032 1.00 0.00 H new ATOM 0 HA LYS A 391 15.812 10.521 -8.919 1.00 0.00 H new ATOM 0 HB2 LYS A 391 14.545 12.403 -7.967 1.00 0.00 H new ATOM 0 HB3 LYS A 391 15.836 12.736 -6.830 1.00 0.00 H new ATOM 0 HG2 LYS A 391 17.356 13.311 -8.687 1.00 0.00 H new ATOM 0 HG3 LYS A 391 16.110 12.915 -9.854 1.00 0.00 H new ATOM 0 HD2 LYS A 391 14.655 14.672 -8.568 1.00 0.00 H new ATOM 0 HD3 LYS A 391 16.174 15.211 -7.882 1.00 0.00 H new ATOM 0 HE2 LYS A 391 15.898 14.872 -10.877 1.00 0.00 H new ATOM 0 HE3 LYS A 391 15.283 16.315 -10.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 17.543 16.631 -10.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 17.491 16.723 -9.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 18.086 15.324 -9.929 1.00 0.00 H new ATOM 643 N ARG A 392 18.091 10.431 -6.654 1.00 0.00 N ATOM 644 CA ARG A 392 19.524 10.323 -6.408 1.00 0.00 C ATOM 645 C ARG A 392 19.998 8.882 -6.579 1.00 0.00 C ATOM 646 O ARG A 392 21.009 8.622 -7.231 1.00 0.00 O ATOM 647 CB ARG A 392 19.861 10.819 -5.001 1.00 0.00 C ATOM 648 CG ARG A 392 21.338 10.718 -4.657 1.00 0.00 C ATOM 649 CD ARG A 392 21.563 10.726 -3.153 1.00 0.00 C ATOM 650 NE ARG A 392 22.981 10.686 -2.810 1.00 0.00 N ATOM 651 CZ ARG A 392 23.782 11.744 -2.870 1.00 0.00 C ATOM 652 NH1 ARG A 392 23.305 12.919 -3.256 1.00 0.00 N ATOM 653 NH2 ARG A 392 25.062 11.628 -2.543 1.00 0.00 N ATOM 0 H ARG A 392 17.506 10.160 -5.864 1.00 0.00 H new ATOM 0 HA ARG A 392 20.040 10.946 -7.138 1.00 0.00 H new ATOM 0 HB2 ARG A 392 19.545 11.858 -4.906 1.00 0.00 H new ATOM 0 HB3 ARG A 392 19.287 10.243 -4.275 1.00 0.00 H new ATOM 0 HG2 ARG A 392 21.750 9.803 -5.082 1.00 0.00 H new ATOM 0 HG3 ARG A 392 21.876 11.550 -5.111 1.00 0.00 H new ATOM 0 HD2 ARG A 392 21.112 11.621 -2.724 1.00 0.00 H new ATOM 0 HD3 ARG A 392 21.058 9.869 -2.707 1.00 0.00 H new ATOM 0 HE ARG A 392 23.379 9.797 -2.508 1.00 0.00 H new ATOM 0 HH11 ARG A 392 22.321 13.012 -3.508 1.00 0.00 H new ATOM 0 HH12 ARG A 392 23.922 13.730 -3.301 1.00 0.00 H new ATOM 0 HH21 ARG A 392 25.432 10.726 -2.245 1.00 0.00 H new ATOM 0 HH22 ARG A 392 25.676 12.441 -2.590 1.00 0.00 H new ATOM 667 N THR A 393 19.259 7.948 -5.988 1.00 0.00 N ATOM 668 CA THR A 393 19.605 6.534 -6.072 1.00 0.00 C ATOM 669 C THR A 393 18.953 5.882 -7.286 1.00 0.00 C ATOM 670 O THR A 393 19.443 4.876 -7.800 1.00 0.00 O ATOM 671 CB THR A 393 19.175 5.774 -4.803 1.00 0.00 C ATOM 672 OG1 THR A 393 17.799 6.044 -4.511 1.00 0.00 O ATOM 673 CG2 THR A 393 20.038 6.175 -3.616 1.00 0.00 C ATOM 0 H THR A 393 18.418 8.145 -5.446 1.00 0.00 H new ATOM 0 HA THR A 393 20.689 6.478 -6.170 1.00 0.00 H new ATOM 0 HB THR A 393 19.304 4.707 -4.984 1.00 0.00 H new ATOM 0 HG1 THR A 393 17.547 5.595 -3.677 1.00 0.00 H new ATOM 0 HG21 THR A 393 19.717 5.626 -2.731 1.00 0.00 H new ATOM 0 HG22 THR A 393 21.081 5.941 -3.829 1.00 0.00 H new ATOM 0 HG23 THR A 393 19.935 7.245 -3.437 1.00 0.00 H new ATOM 681 N GLY A 394 17.846 6.460 -7.741 1.00 0.00 N ATOM 682 CA GLY A 394 17.146 5.920 -8.892 1.00 0.00 C ATOM 683 C GLY A 394 16.485 4.588 -8.597 1.00 0.00 C ATOM 684 O GLY A 394 16.373 3.736 -9.478 1.00 0.00 O ATOM 0 H GLY A 394 17.421 7.293 -7.333 1.00 0.00 H new ATOM 0 HA2 GLY A 394 16.389 6.633 -9.220 1.00 0.00 H new ATOM 0 HA3 GLY A 394 17.849 5.799 -9.716 1.00 0.00 H new ATOM 688 N GLN A 395 16.049 4.409 -7.355 1.00 0.00 N ATOM 689 CA GLN A 395 15.399 3.169 -6.945 1.00 0.00 C ATOM 690 C GLN A 395 13.998 3.441 -6.408 1.00 0.00 C ATOM 691 O GLN A 395 13.697 4.526 -5.910 1.00 0.00 O ATOM 692 CB GLN A 395 16.236 2.456 -5.883 1.00 0.00 C ATOM 693 CG GLN A 395 16.572 3.330 -4.686 1.00 0.00 C ATOM 694 CD GLN A 395 16.724 2.532 -3.406 1.00 0.00 C ATOM 695 OE1 GLN A 395 17.827 2.385 -2.880 1.00 0.00 O ATOM 696 NE2 GLN A 395 15.614 2.012 -2.896 1.00 0.00 N ATOM 0 H GLN A 395 16.134 5.106 -6.615 1.00 0.00 H new ATOM 0 HA GLN A 395 15.314 2.526 -7.821 1.00 0.00 H new ATOM 0 HB2 GLN A 395 15.696 1.574 -5.538 1.00 0.00 H new ATOM 0 HB3 GLN A 395 17.162 2.105 -6.338 1.00 0.00 H new ATOM 0 HG2 GLN A 395 17.497 3.871 -4.884 1.00 0.00 H new ATOM 0 HG3 GLN A 395 15.788 4.076 -4.554 1.00 0.00 H new ATOM 0 HE21 GLN A 395 14.720 2.158 -3.365 1.00 0.00 H new ATOM 0 HE22 GLN A 395 15.655 1.466 -2.035 1.00 0.00 H new ATOM 705 N PRO A 396 13.117 2.435 -6.512 1.00 0.00 N ATOM 706 CA PRO A 396 11.734 2.541 -6.040 1.00 0.00 C ATOM 707 C PRO A 396 11.641 2.598 -4.519 1.00 0.00 C ATOM 708 O PRO A 396 12.438 1.976 -3.818 1.00 0.00 O ATOM 709 CB PRO A 396 11.079 1.263 -6.570 1.00 0.00 C ATOM 710 CG PRO A 396 12.202 0.296 -6.718 1.00 0.00 C ATOM 711 CD PRO A 396 13.406 1.114 -7.094 1.00 0.00 C ATOM 0 HA PRO A 396 11.255 3.457 -6.386 1.00 0.00 H new ATOM 0 HB2 PRO A 396 10.323 0.889 -5.879 1.00 0.00 H new ATOM 0 HB3 PRO A 396 10.580 1.440 -7.523 1.00 0.00 H new ATOM 0 HG2 PRO A 396 12.374 -0.247 -5.789 1.00 0.00 H new ATOM 0 HG3 PRO A 396 11.979 -0.446 -7.485 1.00 0.00 H new ATOM 0 HD2 PRO A 396 14.324 0.688 -6.688 1.00 0.00 H new ATOM 0 HD3 PRO A 396 13.532 1.170 -8.175 1.00 0.00 H new ATOM 719 N MET A 397 10.662 3.344 -4.018 1.00 0.00 N ATOM 720 CA MET A 397 10.466 3.479 -2.579 1.00 0.00 C ATOM 721 C MET A 397 9.686 2.291 -2.024 1.00 0.00 C ATOM 722 O MET A 397 8.818 2.453 -1.166 1.00 0.00 O ATOM 723 CB MET A 397 9.726 4.781 -2.264 1.00 0.00 C ATOM 724 CG MET A 397 10.498 6.029 -2.662 1.00 0.00 C ATOM 725 SD MET A 397 11.565 6.637 -1.342 1.00 0.00 S ATOM 726 CE MET A 397 13.154 6.647 -2.168 1.00 0.00 C ATOM 0 H MET A 397 9.993 3.864 -4.586 1.00 0.00 H new ATOM 0 HA MET A 397 11.447 3.502 -2.104 1.00 0.00 H new ATOM 0 HB2 MET A 397 8.766 4.778 -2.780 1.00 0.00 H new ATOM 0 HB3 MET A 397 9.514 4.820 -1.196 1.00 0.00 H new ATOM 0 HG2 MET A 397 11.103 5.812 -3.542 1.00 0.00 H new ATOM 0 HG3 MET A 397 9.794 6.812 -2.945 1.00 0.00 H new ATOM 0 HE1 MET A 397 13.920 7.001 -1.478 1.00 0.00 H new ATOM 0 HE2 MET A 397 13.400 5.637 -2.496 1.00 0.00 H new ATOM 0 HE3 MET A 397 13.110 7.309 -3.033 1.00 0.00 H new ATOM 736 N ILE A 398 10.002 1.099 -2.519 1.00 0.00 N ATOM 737 CA ILE A 398 9.331 -0.115 -2.071 1.00 0.00 C ATOM 738 C ILE A 398 10.140 -0.824 -0.990 1.00 0.00 C ATOM 739 O ILE A 398 11.371 -0.806 -1.008 1.00 0.00 O ATOM 740 CB ILE A 398 9.092 -1.091 -3.239 1.00 0.00 C ATOM 741 CG1 ILE A 398 8.089 -0.497 -4.231 1.00 0.00 C ATOM 742 CG2 ILE A 398 8.598 -2.432 -2.718 1.00 0.00 C ATOM 743 CD1 ILE A 398 7.930 -1.316 -5.492 1.00 0.00 C ATOM 0 H ILE A 398 10.718 0.948 -3.230 1.00 0.00 H new ATOM 0 HA ILE A 398 8.369 0.191 -1.660 1.00 0.00 H new ATOM 0 HB ILE A 398 10.037 -1.251 -3.758 1.00 0.00 H new ATOM 0 HG12 ILE A 398 7.119 -0.404 -3.743 1.00 0.00 H new ATOM 0 HG13 ILE A 398 8.408 0.510 -4.499 1.00 0.00 H new ATOM 0 HG21 ILE A 398 8.434 -3.110 -3.556 1.00 0.00 H new ATOM 0 HG22 ILE A 398 9.343 -2.858 -2.047 1.00 0.00 H new ATOM 0 HG23 ILE A 398 7.662 -2.290 -2.178 1.00 0.00 H new ATOM 0 HD11 ILE A 398 7.204 -0.836 -6.149 1.00 0.00 H new ATOM 0 HD12 ILE A 398 8.890 -1.387 -6.003 1.00 0.00 H new ATOM 0 HD13 ILE A 398 7.581 -2.316 -5.235 1.00 0.00 H new ATOM 755 N HIS A 399 9.440 -1.449 -0.049 1.00 0.00 N ATOM 756 CA HIS A 399 10.094 -2.167 1.040 1.00 0.00 C ATOM 757 C HIS A 399 9.591 -3.606 1.122 1.00 0.00 C ATOM 758 O HIS A 399 8.390 -3.860 1.021 1.00 0.00 O ATOM 759 CB HIS A 399 9.849 -1.453 2.370 1.00 0.00 C ATOM 760 CG HIS A 399 10.961 -1.627 3.357 1.00 0.00 C ATOM 761 ND1 HIS A 399 12.116 -0.876 3.331 1.00 0.00 N ATOM 762 CD2 HIS A 399 11.088 -2.472 4.407 1.00 0.00 C ATOM 763 CE1 HIS A 399 12.908 -1.253 4.319 1.00 0.00 C ATOM 764 NE2 HIS A 399 12.306 -2.221 4.987 1.00 0.00 N ATOM 0 H HIS A 399 8.421 -1.473 -0.018 1.00 0.00 H new ATOM 0 HA HIS A 399 11.165 -2.186 0.838 1.00 0.00 H new ATOM 0 HB2 HIS A 399 9.705 -0.389 2.181 1.00 0.00 H new ATOM 0 HB3 HIS A 399 8.924 -1.826 2.808 1.00 0.00 H new ATOM 0 HD2 HIS A 399 10.365 -3.207 4.728 1.00 0.00 H new ATOM 0 HE1 HIS A 399 13.881 -0.841 4.542 1.00 0.00 H new ATOM 0 HE2 HIS A 399 12.685 -2.704 5.802 1.00 0.00 H new ATOM 772 N ILE A 400 10.517 -4.541 1.305 1.00 0.00 N ATOM 773 CA ILE A 400 10.167 -5.952 1.400 1.00 0.00 C ATOM 774 C ILE A 400 10.826 -6.602 2.612 1.00 0.00 C ATOM 775 O ILE A 400 11.974 -7.041 2.547 1.00 0.00 O ATOM 776 CB ILE A 400 10.581 -6.722 0.131 1.00 0.00 C ATOM 777 CG1 ILE A 400 9.886 -6.134 -1.098 1.00 0.00 C ATOM 778 CG2 ILE A 400 10.250 -8.199 0.277 1.00 0.00 C ATOM 779 CD1 ILE A 400 10.231 -6.848 -2.386 1.00 0.00 C ATOM 0 H ILE A 400 11.515 -4.347 1.390 1.00 0.00 H new ATOM 0 HA ILE A 400 9.083 -6.001 1.508 1.00 0.00 H new ATOM 0 HB ILE A 400 11.658 -6.622 -0.002 1.00 0.00 H new ATOM 0 HG12 ILE A 400 8.807 -6.172 -0.948 1.00 0.00 H new ATOM 0 HG13 ILE A 400 10.158 -5.082 -1.191 1.00 0.00 H new ATOM 0 HG21 ILE A 400 10.548 -8.730 -0.627 1.00 0.00 H new ATOM 0 HG22 ILE A 400 10.787 -8.609 1.132 1.00 0.00 H new ATOM 0 HG23 ILE A 400 9.177 -8.318 0.431 1.00 0.00 H new ATOM 0 HD11 ILE A 400 9.703 -6.378 -3.215 1.00 0.00 H new ATOM 0 HD12 ILE A 400 11.305 -6.787 -2.559 1.00 0.00 H new ATOM 0 HD13 ILE A 400 9.934 -7.894 -2.313 1.00 0.00 H new ATOM 791 N TYR A 401 10.091 -6.659 3.717 1.00 0.00 N ATOM 792 CA TYR A 401 10.604 -7.253 4.946 1.00 0.00 C ATOM 793 C TYR A 401 10.937 -8.728 4.740 1.00 0.00 C ATOM 794 O TYR A 401 10.107 -9.503 4.263 1.00 0.00 O ATOM 795 CB TYR A 401 9.584 -7.102 6.076 1.00 0.00 C ATOM 796 CG TYR A 401 8.951 -5.731 6.140 1.00 0.00 C ATOM 797 CD1 TYR A 401 7.887 -5.395 5.311 1.00 0.00 C ATOM 798 CD2 TYR A 401 9.417 -4.769 7.028 1.00 0.00 C ATOM 799 CE1 TYR A 401 7.306 -4.144 5.366 1.00 0.00 C ATOM 800 CE2 TYR A 401 8.841 -3.515 7.091 1.00 0.00 C ATOM 801 CZ TYR A 401 7.786 -3.207 6.257 1.00 0.00 C ATOM 802 OH TYR A 401 7.211 -1.959 6.316 1.00 0.00 O ATOM 0 H TYR A 401 9.138 -6.301 3.787 1.00 0.00 H new ATOM 0 HA TYR A 401 11.519 -6.727 5.219 1.00 0.00 H new ATOM 0 HB2 TYR A 401 8.801 -7.849 5.949 1.00 0.00 H new ATOM 0 HB3 TYR A 401 10.074 -7.312 7.027 1.00 0.00 H new ATOM 0 HD1 TYR A 401 7.508 -6.126 4.612 1.00 0.00 H new ATOM 0 HD2 TYR A 401 10.244 -5.006 7.681 1.00 0.00 H new ATOM 0 HE1 TYR A 401 6.480 -3.900 4.715 1.00 0.00 H new ATOM 0 HE2 TYR A 401 9.214 -2.780 7.789 1.00 0.00 H new ATOM 0 HH TYR A 401 7.667 -1.421 6.997 1.00 0.00 H new ATOM 812 N LEU A 402 12.156 -9.110 5.104 1.00 0.00 N ATOM 813 CA LEU A 402 12.600 -10.492 4.961 1.00 0.00 C ATOM 814 C LEU A 402 12.800 -11.144 6.324 1.00 0.00 C ATOM 815 O LEU A 402 13.380 -10.546 7.231 1.00 0.00 O ATOM 816 CB LEU A 402 13.902 -10.549 4.159 1.00 0.00 C ATOM 817 CG LEU A 402 13.918 -9.762 2.849 1.00 0.00 C ATOM 818 CD1 LEU A 402 15.301 -9.807 2.217 1.00 0.00 C ATOM 819 CD2 LEU A 402 12.872 -10.304 1.887 1.00 0.00 C ATOM 0 H LEU A 402 12.855 -8.482 5.501 1.00 0.00 H new ATOM 0 HA LEU A 402 11.826 -11.043 4.426 1.00 0.00 H new ATOM 0 HB2 LEU A 402 14.711 -10.181 4.791 1.00 0.00 H new ATOM 0 HB3 LEU A 402 14.122 -11.593 3.935 1.00 0.00 H new ATOM 0 HG LEU A 402 13.675 -8.723 3.069 1.00 0.00 H new ATOM 0 HD11 LEU A 402 15.294 -9.242 1.285 1.00 0.00 H new ATOM 0 HD12 LEU A 402 16.028 -9.370 2.901 1.00 0.00 H new ATOM 0 HD13 LEU A 402 15.573 -10.842 2.011 1.00 0.00 H new ATOM 0 HD21 LEU A 402 12.899 -9.731 0.960 1.00 0.00 H new ATOM 0 HD22 LEU A 402 13.083 -11.352 1.672 1.00 0.00 H new ATOM 0 HD23 LEU A 402 11.884 -10.218 2.338 1.00 0.00 H new ATOM 831 N ASP A 403 12.317 -12.374 6.463 1.00 0.00 N ATOM 832 CA ASP A 403 12.447 -13.109 7.716 1.00 0.00 C ATOM 833 C ASP A 403 13.907 -13.199 8.146 1.00 0.00 C ATOM 834 O ASP A 403 14.754 -13.699 7.405 1.00 0.00 O ATOM 835 CB ASP A 403 11.857 -14.513 7.570 1.00 0.00 C ATOM 836 CG ASP A 403 11.334 -15.060 8.885 1.00 0.00 C ATOM 837 OD1 ASP A 403 10.839 -14.259 9.706 1.00 0.00 O ATOM 838 OD2 ASP A 403 11.419 -16.289 9.091 1.00 0.00 O ATOM 0 H ASP A 403 11.832 -12.883 5.724 1.00 0.00 H new ATOM 0 HA ASP A 403 11.895 -12.568 8.485 1.00 0.00 H new ATOM 0 HB2 ASP A 403 11.047 -14.490 6.841 1.00 0.00 H new ATOM 0 HB3 ASP A 403 12.620 -15.186 7.177 1.00 0.00 H new ATOM 843 N LYS A 404 14.197 -12.712 9.347 1.00 0.00 N ATOM 844 CA LYS A 404 15.554 -12.736 9.877 1.00 0.00 C ATOM 845 C LYS A 404 15.970 -14.158 10.243 1.00 0.00 C ATOM 846 O LYS A 404 17.093 -14.391 10.689 1.00 0.00 O ATOM 847 CB LYS A 404 15.661 -11.831 11.105 1.00 0.00 C ATOM 848 CG LYS A 404 14.756 -12.249 12.251 1.00 0.00 C ATOM 849 CD LYS A 404 15.412 -13.309 13.120 1.00 0.00 C ATOM 850 CE LYS A 404 14.762 -13.384 14.494 1.00 0.00 C ATOM 851 NZ LYS A 404 15.723 -13.833 15.538 1.00 0.00 N ATOM 0 H LYS A 404 13.508 -12.295 9.973 1.00 0.00 H new ATOM 0 HA LYS A 404 16.226 -12.367 9.102 1.00 0.00 H new ATOM 0 HB2 LYS A 404 16.694 -11.826 11.453 1.00 0.00 H new ATOM 0 HB3 LYS A 404 15.417 -10.809 10.815 1.00 0.00 H new ATOM 0 HG2 LYS A 404 14.512 -11.378 12.859 1.00 0.00 H new ATOM 0 HG3 LYS A 404 13.817 -12.633 11.853 1.00 0.00 H new ATOM 0 HD2 LYS A 404 15.340 -14.279 12.629 1.00 0.00 H new ATOM 0 HD3 LYS A 404 16.473 -13.085 13.230 1.00 0.00 H new ATOM 0 HE2 LYS A 404 14.366 -12.405 14.762 1.00 0.00 H new ATOM 0 HE3 LYS A 404 13.917 -14.071 14.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 15.242 -13.871 16.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 16.082 -14.778 15.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 16.517 -13.164 15.590 1.00 0.00 H new ATOM 865 N GLU A 405 15.056 -15.104 10.051 1.00 0.00 N ATOM 866 CA GLU A 405 15.329 -16.502 10.362 1.00 0.00 C ATOM 867 C GLU A 405 15.916 -17.223 9.151 1.00 0.00 C ATOM 868 O GLU A 405 16.777 -18.093 9.289 1.00 0.00 O ATOM 869 CB GLU A 405 14.049 -17.206 10.817 1.00 0.00 C ATOM 870 CG GLU A 405 13.237 -16.404 11.820 1.00 0.00 C ATOM 871 CD GLU A 405 12.407 -17.284 12.735 1.00 0.00 C ATOM 872 OE1 GLU A 405 11.439 -17.902 12.247 1.00 0.00 O ATOM 873 OE2 GLU A 405 12.727 -17.353 13.941 1.00 0.00 O ATOM 0 H GLU A 405 14.121 -14.928 9.682 1.00 0.00 H new ATOM 0 HA GLU A 405 16.059 -16.532 11.171 1.00 0.00 H new ATOM 0 HB2 GLU A 405 13.430 -17.415 9.945 1.00 0.00 H new ATOM 0 HB3 GLU A 405 14.311 -18.167 11.260 1.00 0.00 H new ATOM 0 HG2 GLU A 405 13.910 -15.793 12.422 1.00 0.00 H new ATOM 0 HG3 GLU A 405 12.579 -15.720 11.285 1.00 0.00 H new ATOM 880 N THR A 406 15.443 -16.857 7.964 1.00 0.00 N ATOM 881 CA THR A 406 15.918 -17.469 6.730 1.00 0.00 C ATOM 882 C THR A 406 16.420 -16.413 5.751 1.00 0.00 C ATOM 883 O THR A 406 17.384 -16.639 5.021 1.00 0.00 O ATOM 884 CB THR A 406 14.811 -18.297 6.051 1.00 0.00 C ATOM 885 OG1 THR A 406 13.781 -17.430 5.564 1.00 0.00 O ATOM 886 CG2 THR A 406 14.217 -19.304 7.022 1.00 0.00 C ATOM 0 H THR A 406 14.731 -16.139 7.831 1.00 0.00 H new ATOM 0 HA THR A 406 16.741 -18.130 7.001 1.00 0.00 H new ATOM 0 HB THR A 406 15.253 -18.840 5.216 1.00 0.00 H new ATOM 0 HG1 THR A 406 12.930 -17.661 5.992 1.00 0.00 H new ATOM 0 HG21 THR A 406 13.437 -19.877 6.520 1.00 0.00 H new ATOM 0 HG22 THR A 406 14.999 -19.980 7.368 1.00 0.00 H new ATOM 0 HG23 THR A 406 13.788 -18.778 7.875 1.00 0.00 H new ATOM 894 N GLY A 407 15.761 -15.259 5.742 1.00 0.00 N ATOM 895 CA GLY A 407 16.156 -14.185 4.850 1.00 0.00 C ATOM 896 C GLY A 407 15.190 -14.005 3.696 1.00 0.00 C ATOM 897 O GLY A 407 15.342 -13.092 2.884 1.00 0.00 O ATOM 0 H GLY A 407 14.960 -15.048 6.337 1.00 0.00 H new ATOM 0 HA2 GLY A 407 16.221 -13.254 5.414 1.00 0.00 H new ATOM 0 HA3 GLY A 407 17.152 -14.391 4.457 1.00 0.00 H new ATOM 901 N LYS A 408 14.191 -14.878 3.622 1.00 0.00 N ATOM 902 CA LYS A 408 13.194 -14.814 2.558 1.00 0.00 C ATOM 903 C LYS A 408 12.099 -13.809 2.901 1.00 0.00 C ATOM 904 O LYS A 408 11.807 -13.544 4.067 1.00 0.00 O ATOM 905 CB LYS A 408 12.579 -16.194 2.323 1.00 0.00 C ATOM 906 CG LYS A 408 11.687 -16.664 3.459 1.00 0.00 C ATOM 907 CD LYS A 408 11.532 -18.176 3.457 1.00 0.00 C ATOM 908 CE LYS A 408 10.527 -18.635 4.503 1.00 0.00 C ATOM 909 NZ LYS A 408 10.058 -20.026 4.249 1.00 0.00 N ATOM 0 H LYS A 408 14.050 -15.639 4.286 1.00 0.00 H new ATOM 0 HA LYS A 408 13.692 -14.486 1.646 1.00 0.00 H new ATOM 0 HB2 LYS A 408 11.998 -16.171 1.401 1.00 0.00 H new ATOM 0 HB3 LYS A 408 13.380 -16.919 2.177 1.00 0.00 H new ATOM 0 HG2 LYS A 408 12.109 -16.342 4.411 1.00 0.00 H new ATOM 0 HG3 LYS A 408 10.706 -16.197 3.370 1.00 0.00 H new ATOM 0 HD2 LYS A 408 11.209 -18.508 2.470 1.00 0.00 H new ATOM 0 HD3 LYS A 408 12.498 -18.642 3.650 1.00 0.00 H new ATOM 0 HE2 LYS A 408 10.982 -18.580 5.492 1.00 0.00 H new ATOM 0 HE3 LYS A 408 9.672 -17.959 4.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 9.375 -20.301 4.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 9.601 -20.073 3.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 10.870 -20.675 4.271 1.00 0.00 H new ATOM 923 N PRO A 409 11.475 -13.235 1.861 1.00 0.00 N ATOM 924 CA PRO A 409 10.401 -12.251 2.026 1.00 0.00 C ATOM 925 C PRO A 409 9.122 -12.877 2.575 1.00 0.00 C ATOM 926 O PRO A 409 8.308 -13.410 1.821 1.00 0.00 O ATOM 927 CB PRO A 409 10.175 -11.730 0.606 1.00 0.00 C ATOM 928 CG PRO A 409 10.635 -12.835 -0.281 1.00 0.00 C ATOM 929 CD PRO A 409 11.771 -13.502 0.443 1.00 0.00 C ATOM 0 HA PRO A 409 10.667 -11.473 2.742 1.00 0.00 H new ATOM 0 HB2 PRO A 409 9.125 -11.495 0.433 1.00 0.00 H new ATOM 0 HB3 PRO A 409 10.740 -10.816 0.425 1.00 0.00 H new ATOM 0 HG2 PRO A 409 9.828 -13.541 -0.475 1.00 0.00 H new ATOM 0 HG3 PRO A 409 10.961 -12.450 -1.247 1.00 0.00 H new ATOM 0 HD2 PRO A 409 11.808 -14.571 0.235 1.00 0.00 H new ATOM 0 HD3 PRO A 409 12.735 -13.086 0.148 1.00 0.00 H new ATOM 937 N LYS A 410 8.953 -12.808 3.890 1.00 0.00 N ATOM 938 CA LYS A 410 7.771 -13.366 4.539 1.00 0.00 C ATOM 939 C LYS A 410 6.546 -13.241 3.641 1.00 0.00 C ATOM 940 O LYS A 410 5.829 -14.214 3.413 1.00 0.00 O ATOM 941 CB LYS A 410 7.515 -12.658 5.872 1.00 0.00 C ATOM 942 CG LYS A 410 7.765 -11.161 5.823 1.00 0.00 C ATOM 943 CD LYS A 410 8.087 -10.605 7.199 1.00 0.00 C ATOM 944 CE LYS A 410 6.831 -10.421 8.036 1.00 0.00 C ATOM 945 NZ LYS A 410 6.333 -11.715 8.580 1.00 0.00 N ATOM 0 H LYS A 410 9.618 -12.372 4.528 1.00 0.00 H new ATOM 0 HA LYS A 410 7.955 -14.424 4.725 1.00 0.00 H new ATOM 0 HB2 LYS A 410 6.484 -12.836 6.176 1.00 0.00 H new ATOM 0 HB3 LYS A 410 8.154 -13.100 6.637 1.00 0.00 H new ATOM 0 HG2 LYS A 410 8.590 -10.951 5.142 1.00 0.00 H new ATOM 0 HG3 LYS A 410 6.885 -10.657 5.423 1.00 0.00 H new ATOM 0 HD2 LYS A 410 8.772 -11.279 7.713 1.00 0.00 H new ATOM 0 HD3 LYS A 410 8.599 -9.648 7.095 1.00 0.00 H new ATOM 0 HE2 LYS A 410 7.040 -9.737 8.859 1.00 0.00 H new ATOM 0 HE3 LYS A 410 6.053 -9.959 7.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 410 5.973 -11.570 9.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 410 5.567 -12.074 7.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 410 7.111 -12.405 8.601 1.00 0.00 H new ATOM 959 N GLY A 411 6.312 -12.035 3.132 1.00 0.00 N ATOM 960 CA GLY A 411 5.172 -11.805 2.263 1.00 0.00 C ATOM 961 C GLY A 411 4.651 -10.385 2.354 1.00 0.00 C ATOM 962 O GLY A 411 3.898 -9.936 1.490 1.00 0.00 O ATOM 0 H GLY A 411 6.891 -11.214 3.306 1.00 0.00 H new ATOM 0 HA2 GLY A 411 5.455 -12.019 1.233 1.00 0.00 H new ATOM 0 HA3 GLY A 411 4.374 -12.499 2.525 1.00 0.00 H new ATOM 966 N ASP A 412 5.049 -9.677 3.406 1.00 0.00 N ATOM 967 CA ASP A 412 4.615 -8.299 3.607 1.00 0.00 C ATOM 968 C ASP A 412 5.552 -7.325 2.897 1.00 0.00 C ATOM 969 O ASP A 412 6.713 -7.641 2.641 1.00 0.00 O ATOM 970 CB ASP A 412 4.559 -7.973 5.100 1.00 0.00 C ATOM 971 CG ASP A 412 5.923 -8.036 5.759 1.00 0.00 C ATOM 972 OD1 ASP A 412 6.878 -8.499 5.101 1.00 0.00 O ATOM 973 OD2 ASP A 412 6.035 -7.623 6.933 1.00 0.00 O ATOM 0 H ASP A 412 5.671 -10.034 4.132 1.00 0.00 H new ATOM 0 HA ASP A 412 3.617 -8.192 3.181 1.00 0.00 H new ATOM 0 HB2 ASP A 412 4.139 -6.976 5.236 1.00 0.00 H new ATOM 0 HB3 ASP A 412 3.886 -8.672 5.596 1.00 0.00 H new ATOM 978 N ALA A 413 5.037 -6.141 2.580 1.00 0.00 N ATOM 979 CA ALA A 413 5.826 -5.122 1.900 1.00 0.00 C ATOM 980 C ALA A 413 5.096 -3.783 1.884 1.00 0.00 C ATOM 981 O ALA A 413 3.937 -3.690 2.289 1.00 0.00 O ATOM 982 CB ALA A 413 6.151 -5.565 0.482 1.00 0.00 C ATOM 0 H ALA A 413 4.077 -5.864 2.784 1.00 0.00 H new ATOM 0 HA ALA A 413 6.758 -4.992 2.450 1.00 0.00 H new ATOM 0 HB1 ALA A 413 6.741 -4.794 -0.014 1.00 0.00 H new ATOM 0 HB2 ALA A 413 6.720 -6.494 0.513 1.00 0.00 H new ATOM 0 HB3 ALA A 413 5.225 -5.725 -0.070 1.00 0.00 H new ATOM 988 N THR A 414 5.783 -2.747 1.414 1.00 0.00 N ATOM 989 CA THR A 414 5.201 -1.412 1.346 1.00 0.00 C ATOM 990 C THR A 414 5.642 -0.683 0.082 1.00 0.00 C ATOM 991 O THR A 414 6.789 -0.805 -0.349 1.00 0.00 O ATOM 992 CB THR A 414 5.589 -0.567 2.575 1.00 0.00 C ATOM 993 OG1 THR A 414 6.873 -0.972 3.062 1.00 0.00 O ATOM 994 CG2 THR A 414 4.554 -0.711 3.680 1.00 0.00 C ATOM 0 H THR A 414 6.743 -2.806 1.075 1.00 0.00 H new ATOM 0 HA THR A 414 4.119 -1.540 1.329 1.00 0.00 H new ATOM 0 HB THR A 414 5.629 0.479 2.271 1.00 0.00 H new ATOM 0 HG1 THR A 414 7.113 -0.429 3.842 1.00 0.00 H new ATOM 0 HG21 THR A 414 4.850 -0.105 4.537 1.00 0.00 H new ATOM 0 HG22 THR A 414 3.583 -0.374 3.316 1.00 0.00 H new ATOM 0 HG23 THR A 414 4.486 -1.756 3.981 1.00 0.00 H new ATOM 1002 N VAL A 415 4.725 0.077 -0.507 1.00 0.00 N ATOM 1003 CA VAL A 415 5.020 0.829 -1.722 1.00 0.00 C ATOM 1004 C VAL A 415 4.622 2.293 -1.573 1.00 0.00 C ATOM 1005 O VAL A 415 3.448 2.611 -1.385 1.00 0.00 O ATOM 1006 CB VAL A 415 4.294 0.231 -2.941 1.00 0.00 C ATOM 1007 CG1 VAL A 415 4.650 1.000 -4.204 1.00 0.00 C ATOM 1008 CG2 VAL A 415 4.632 -1.244 -3.092 1.00 0.00 C ATOM 0 H VAL A 415 3.771 0.189 -0.163 1.00 0.00 H new ATOM 0 HA VAL A 415 6.096 0.764 -1.882 1.00 0.00 H new ATOM 0 HB VAL A 415 3.219 0.319 -2.781 1.00 0.00 H new ATOM 0 HG11 VAL A 415 4.128 0.563 -5.055 1.00 0.00 H new ATOM 0 HG12 VAL A 415 4.352 2.042 -4.091 1.00 0.00 H new ATOM 0 HG13 VAL A 415 5.726 0.946 -4.372 1.00 0.00 H new ATOM 0 HG21 VAL A 415 4.110 -1.650 -3.959 1.00 0.00 H new ATOM 0 HG22 VAL A 415 5.707 -1.359 -3.229 1.00 0.00 H new ATOM 0 HG23 VAL A 415 4.321 -1.782 -2.196 1.00 0.00 H new ATOM 1018 N SER A 416 5.607 3.180 -1.659 1.00 0.00 N ATOM 1019 CA SER A 416 5.361 4.611 -1.531 1.00 0.00 C ATOM 1020 C SER A 416 5.131 5.248 -2.899 1.00 0.00 C ATOM 1021 O SER A 416 6.042 5.316 -3.724 1.00 0.00 O ATOM 1022 CB SER A 416 6.537 5.293 -0.830 1.00 0.00 C ATOM 1023 OG SER A 416 6.533 5.014 0.559 1.00 0.00 O ATOM 0 H SER A 416 6.584 2.933 -1.817 1.00 0.00 H new ATOM 0 HA SER A 416 4.462 4.746 -0.930 1.00 0.00 H new ATOM 0 HB2 SER A 416 7.474 4.952 -1.270 1.00 0.00 H new ATOM 0 HB3 SER A 416 6.484 6.370 -0.988 1.00 0.00 H new ATOM 0 HG SER A 416 7.295 5.460 0.984 1.00 0.00 H new ATOM 1029 N TYR A 417 3.908 5.712 -3.131 1.00 0.00 N ATOM 1030 CA TYR A 417 3.557 6.340 -4.398 1.00 0.00 C ATOM 1031 C TYR A 417 3.873 7.833 -4.373 1.00 0.00 C ATOM 1032 O TYR A 417 4.066 8.419 -3.308 1.00 0.00 O ATOM 1033 CB TYR A 417 2.073 6.127 -4.704 1.00 0.00 C ATOM 1034 CG TYR A 417 1.748 4.730 -5.183 1.00 0.00 C ATOM 1035 CD1 TYR A 417 2.096 4.315 -6.463 1.00 0.00 C ATOM 1036 CD2 TYR A 417 1.095 3.826 -4.355 1.00 0.00 C ATOM 1037 CE1 TYR A 417 1.799 3.040 -6.905 1.00 0.00 C ATOM 1038 CE2 TYR A 417 0.797 2.548 -4.788 1.00 0.00 C ATOM 1039 CZ TYR A 417 1.151 2.160 -6.064 1.00 0.00 C ATOM 1040 OH TYR A 417 0.855 0.889 -6.499 1.00 0.00 O ATOM 0 H TYR A 417 3.143 5.665 -2.458 1.00 0.00 H new ATOM 0 HA TYR A 417 4.154 5.874 -5.182 1.00 0.00 H new ATOM 0 HB2 TYR A 417 1.492 6.339 -3.807 1.00 0.00 H new ATOM 0 HB3 TYR A 417 1.761 6.844 -5.463 1.00 0.00 H new ATOM 0 HD1 TYR A 417 2.607 5.000 -7.123 1.00 0.00 H new ATOM 0 HD2 TYR A 417 0.815 4.127 -3.356 1.00 0.00 H new ATOM 0 HE1 TYR A 417 2.073 2.734 -7.904 1.00 0.00 H new ATOM 0 HE2 TYR A 417 0.290 1.857 -4.131 1.00 0.00 H new ATOM 0 HH TYR A 417 1.316 0.718 -7.347 1.00 0.00 H new ATOM 1050 N GLU A 418 3.924 8.441 -5.554 1.00 0.00 N ATOM 1051 CA GLU A 418 4.217 9.865 -5.667 1.00 0.00 C ATOM 1052 C GLU A 418 3.204 10.693 -4.880 1.00 0.00 C ATOM 1053 O GLU A 418 3.552 11.353 -3.901 1.00 0.00 O ATOM 1054 CB GLU A 418 4.212 10.294 -7.136 1.00 0.00 C ATOM 1055 CG GLU A 418 4.853 9.280 -8.068 1.00 0.00 C ATOM 1056 CD GLU A 418 5.474 9.924 -9.292 1.00 0.00 C ATOM 1057 OE1 GLU A 418 4.751 10.634 -10.022 1.00 0.00 O ATOM 1058 OE2 GLU A 418 6.685 9.718 -9.519 1.00 0.00 O ATOM 0 H GLU A 418 3.766 7.970 -6.445 1.00 0.00 H new ATOM 0 HA GLU A 418 5.208 10.041 -5.248 1.00 0.00 H new ATOM 0 HB2 GLU A 418 3.183 10.466 -7.452 1.00 0.00 H new ATOM 0 HB3 GLU A 418 4.737 11.244 -7.230 1.00 0.00 H new ATOM 0 HG2 GLU A 418 5.619 8.727 -7.525 1.00 0.00 H new ATOM 0 HG3 GLU A 418 4.101 8.557 -8.384 1.00 0.00 H new ATOM 1065 N ASP A 419 1.950 10.653 -5.317 1.00 0.00 N ATOM 1066 CA ASP A 419 0.886 11.398 -4.655 1.00 0.00 C ATOM 1067 C ASP A 419 -0.131 10.451 -4.025 1.00 0.00 C ATOM 1068 O ASP A 419 -0.282 9.300 -4.436 1.00 0.00 O ATOM 1069 CB ASP A 419 0.188 12.326 -5.651 1.00 0.00 C ATOM 1070 CG ASP A 419 1.158 12.962 -6.628 1.00 0.00 C ATOM 1071 OD1 ASP A 419 2.006 13.763 -6.183 1.00 0.00 O ATOM 1072 OD2 ASP A 419 1.068 12.660 -7.836 1.00 0.00 O ATOM 0 H ASP A 419 1.646 10.113 -6.127 1.00 0.00 H new ATOM 0 HA ASP A 419 1.335 11.998 -3.864 1.00 0.00 H new ATOM 0 HB2 ASP A 419 -0.563 11.762 -6.204 1.00 0.00 H new ATOM 0 HB3 ASP A 419 -0.339 13.109 -5.106 1.00 0.00 H new ATOM 1077 N PRO A 420 -0.845 10.944 -3.002 1.00 0.00 N ATOM 1078 CA PRO A 420 -1.858 10.158 -2.293 1.00 0.00 C ATOM 1079 C PRO A 420 -2.944 9.635 -3.227 1.00 0.00 C ATOM 1080 O PRO A 420 -3.371 8.483 -3.139 1.00 0.00 O ATOM 1081 CB PRO A 420 -2.448 11.157 -1.295 1.00 0.00 C ATOM 1082 CG PRO A 420 -1.406 12.213 -1.157 1.00 0.00 C ATOM 1083 CD PRO A 420 -0.717 12.307 -2.459 1.00 0.00 C ATOM 0 HA PRO A 420 -1.432 9.270 -1.827 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -3.387 11.573 -1.659 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -2.660 10.682 -0.337 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -1.857 13.168 -0.889 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -0.702 11.960 -0.365 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -1.184 13.046 -3.110 1.00 0.00 H new ATOM 0 HD3 PRO A 420 0.327 12.599 -2.343 1.00 0.00 H new ATOM 1091 N PRO A 421 -3.403 10.498 -4.146 1.00 0.00 N ATOM 1092 CA PRO A 421 -4.444 10.144 -5.115 1.00 0.00 C ATOM 1093 C PRO A 421 -4.148 8.831 -5.831 1.00 0.00 C ATOM 1094 O PRO A 421 -5.061 8.119 -6.247 1.00 0.00 O ATOM 1095 CB PRO A 421 -4.417 11.311 -6.105 1.00 0.00 C ATOM 1096 CG PRO A 421 -3.876 12.458 -5.325 1.00 0.00 C ATOM 1097 CD PRO A 421 -2.939 11.886 -4.309 1.00 0.00 C ATOM 0 HA PRO A 421 -5.412 9.994 -4.637 1.00 0.00 H new ATOM 0 HB2 PRO A 421 -3.787 11.085 -6.965 1.00 0.00 H new ATOM 0 HB3 PRO A 421 -5.414 11.528 -6.488 1.00 0.00 H new ATOM 0 HG2 PRO A 421 -3.357 13.159 -5.978 1.00 0.00 H new ATOM 0 HG3 PRO A 421 -4.681 13.010 -4.841 1.00 0.00 H new ATOM 0 HD2 PRO A 421 -1.905 11.925 -4.652 1.00 0.00 H new ATOM 0 HD3 PRO A 421 -2.984 12.436 -3.369 1.00 0.00 H new ATOM 1105 N THR A 422 -2.863 8.515 -5.971 1.00 0.00 N ATOM 1106 CA THR A 422 -2.447 7.288 -6.637 1.00 0.00 C ATOM 1107 C THR A 422 -2.396 6.121 -5.658 1.00 0.00 C ATOM 1108 O THR A 422 -2.835 5.015 -5.971 1.00 0.00 O ATOM 1109 CB THR A 422 -1.066 7.449 -7.299 1.00 0.00 C ATOM 1110 OG1 THR A 422 -1.078 8.571 -8.190 1.00 0.00 O ATOM 1111 CG2 THR A 422 -0.682 6.192 -8.064 1.00 0.00 C ATOM 0 H THR A 422 -2.094 9.093 -5.632 1.00 0.00 H new ATOM 0 HA THR A 422 -3.189 7.080 -7.408 1.00 0.00 H new ATOM 0 HB THR A 422 -0.329 7.616 -6.514 1.00 0.00 H new ATOM 0 HG1 THR A 422 -0.196 8.668 -8.606 1.00 0.00 H new ATOM 0 HG21 THR A 422 0.297 6.330 -8.523 1.00 0.00 H new ATOM 0 HG22 THR A 422 -0.645 5.346 -7.378 1.00 0.00 H new ATOM 0 HG23 THR A 422 -1.422 5.998 -8.840 1.00 0.00 H new ATOM 1119 N ALA A 423 -1.855 6.375 -4.470 1.00 0.00 N ATOM 1120 CA ALA A 423 -1.750 5.346 -3.444 1.00 0.00 C ATOM 1121 C ALA A 423 -3.123 4.805 -3.064 1.00 0.00 C ATOM 1122 O ALA A 423 -3.331 3.592 -3.003 1.00 0.00 O ATOM 1123 CB ALA A 423 -1.039 5.896 -2.216 1.00 0.00 C ATOM 0 H ALA A 423 -1.483 7.284 -4.195 1.00 0.00 H new ATOM 0 HA ALA A 423 -1.165 4.522 -3.851 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.968 5.117 -1.457 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.038 6.226 -2.493 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.602 6.740 -1.817 1.00 0.00 H new ATOM 1129 N LYS A 424 -4.061 5.711 -2.807 1.00 0.00 N ATOM 1130 CA LYS A 424 -5.417 5.326 -2.433 1.00 0.00 C ATOM 1131 C LYS A 424 -6.081 4.525 -3.548 1.00 0.00 C ATOM 1132 O LYS A 424 -6.794 3.556 -3.289 1.00 0.00 O ATOM 1133 CB LYS A 424 -6.252 6.568 -2.115 1.00 0.00 C ATOM 1134 CG LYS A 424 -5.713 7.381 -0.951 1.00 0.00 C ATOM 1135 CD LYS A 424 -6.336 8.767 -0.903 1.00 0.00 C ATOM 1136 CE LYS A 424 -5.590 9.681 0.056 1.00 0.00 C ATOM 1137 NZ LYS A 424 -6.378 10.900 0.387 1.00 0.00 N ATOM 0 H LYS A 424 -3.906 6.718 -2.851 1.00 0.00 H new ATOM 0 HA LYS A 424 -5.358 4.698 -1.544 1.00 0.00 H new ATOM 0 HB2 LYS A 424 -6.297 7.202 -3.000 1.00 0.00 H new ATOM 0 HB3 LYS A 424 -7.274 6.261 -1.891 1.00 0.00 H new ATOM 0 HG2 LYS A 424 -5.915 6.858 -0.016 1.00 0.00 H new ATOM 0 HG3 LYS A 424 -4.630 7.471 -1.039 1.00 0.00 H new ATOM 0 HD2 LYS A 424 -6.331 9.204 -1.902 1.00 0.00 H new ATOM 0 HD3 LYS A 424 -7.379 8.688 -0.595 1.00 0.00 H new ATOM 0 HE2 LYS A 424 -5.361 9.137 0.972 1.00 0.00 H new ATOM 0 HE3 LYS A 424 -4.638 9.973 -0.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 424 -5.835 11.497 1.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 424 -6.575 11.433 -0.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 424 -7.275 10.623 0.834 1.00 0.00 H new ATOM 1151 N ALA A 425 -5.842 4.936 -4.790 1.00 0.00 N ATOM 1152 CA ALA A 425 -6.415 4.254 -5.944 1.00 0.00 C ATOM 1153 C ALA A 425 -5.707 2.930 -6.206 1.00 0.00 C ATOM 1154 O ALA A 425 -6.320 1.968 -6.668 1.00 0.00 O ATOM 1155 CB ALA A 425 -6.343 5.147 -7.174 1.00 0.00 C ATOM 0 H ALA A 425 -5.256 5.738 -5.022 1.00 0.00 H new ATOM 0 HA ALA A 425 -7.461 4.039 -5.726 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -6.774 4.625 -8.028 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -6.901 6.065 -6.990 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -5.302 5.391 -7.386 1.00 0.00 H new ATOM 1161 N ALA A 426 -4.413 2.888 -5.911 1.00 0.00 N ATOM 1162 CA ALA A 426 -3.621 1.681 -6.114 1.00 0.00 C ATOM 1163 C ALA A 426 -4.008 0.596 -5.114 1.00 0.00 C ATOM 1164 O ALA A 426 -3.959 -0.594 -5.425 1.00 0.00 O ATOM 1165 CB ALA A 426 -2.137 1.998 -6.003 1.00 0.00 C ATOM 0 H ALA A 426 -3.890 3.676 -5.530 1.00 0.00 H new ATOM 0 HA ALA A 426 -3.827 1.306 -7.116 1.00 0.00 H new ATOM 0 HB1 ALA A 426 -1.558 1.087 -6.157 1.00 0.00 H new ATOM 0 HB2 ALA A 426 -1.864 2.733 -6.760 1.00 0.00 H new ATOM 0 HB3 ALA A 426 -1.924 2.401 -5.013 1.00 0.00 H new ATOM 1171 N VAL A 427 -4.392 1.015 -3.913 1.00 0.00 N ATOM 1172 CA VAL A 427 -4.788 0.079 -2.868 1.00 0.00 C ATOM 1173 C VAL A 427 -5.914 -0.832 -3.343 1.00 0.00 C ATOM 1174 O VAL A 427 -5.760 -2.052 -3.392 1.00 0.00 O ATOM 1175 CB VAL A 427 -5.244 0.818 -1.595 1.00 0.00 C ATOM 1176 CG1 VAL A 427 -5.772 -0.168 -0.564 1.00 0.00 C ATOM 1177 CG2 VAL A 427 -4.101 1.642 -1.021 1.00 0.00 C ATOM 0 H VAL A 427 -4.437 1.997 -3.639 1.00 0.00 H new ATOM 0 HA VAL A 427 -3.910 -0.524 -2.635 1.00 0.00 H new ATOM 0 HB VAL A 427 -6.055 1.497 -1.860 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -6.089 0.373 0.328 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.621 -0.710 -0.981 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -4.985 -0.874 -0.299 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -4.440 2.158 -0.122 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -3.269 0.984 -0.770 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -3.775 2.375 -1.759 1.00 0.00 H new ATOM 1187 N GLU A 428 -7.046 -0.231 -3.694 1.00 0.00 N ATOM 1188 CA GLU A 428 -8.199 -0.989 -4.166 1.00 0.00 C ATOM 1189 C GLU A 428 -7.906 -1.640 -5.515 1.00 0.00 C ATOM 1190 O GLU A 428 -8.651 -2.506 -5.973 1.00 0.00 O ATOM 1191 CB GLU A 428 -9.424 -0.080 -4.280 1.00 0.00 C ATOM 1192 CG GLU A 428 -9.848 0.541 -2.959 1.00 0.00 C ATOM 1193 CD GLU A 428 -11.315 0.922 -2.938 1.00 0.00 C ATOM 1194 OE1 GLU A 428 -11.636 2.068 -3.320 1.00 0.00 O ATOM 1195 OE2 GLU A 428 -12.142 0.076 -2.540 1.00 0.00 O ATOM 0 H GLU A 428 -7.190 0.778 -3.661 1.00 0.00 H new ATOM 0 HA GLU A 428 -8.407 -1.775 -3.440 1.00 0.00 H new ATOM 0 HB2 GLU A 428 -9.210 0.716 -4.994 1.00 0.00 H new ATOM 0 HB3 GLU A 428 -10.256 -0.656 -4.685 1.00 0.00 H new ATOM 0 HG2 GLU A 428 -9.647 -0.162 -2.150 1.00 0.00 H new ATOM 0 HG3 GLU A 428 -9.243 1.428 -2.768 1.00 0.00 H new ATOM 1202 N TRP A 429 -6.818 -1.214 -6.147 1.00 0.00 N ATOM 1203 CA TRP A 429 -6.428 -1.754 -7.444 1.00 0.00 C ATOM 1204 C TRP A 429 -5.731 -3.101 -7.285 1.00 0.00 C ATOM 1205 O TRP A 429 -6.109 -4.086 -7.922 1.00 0.00 O ATOM 1206 CB TRP A 429 -5.508 -0.773 -8.171 1.00 0.00 C ATOM 1207 CG TRP A 429 -4.813 -1.376 -9.355 1.00 0.00 C ATOM 1208 CD1 TRP A 429 -3.972 -2.453 -9.351 1.00 0.00 C ATOM 1209 CD2 TRP A 429 -4.898 -0.936 -10.714 1.00 0.00 C ATOM 1210 NE1 TRP A 429 -3.530 -2.708 -10.627 1.00 0.00 N ATOM 1211 CE2 TRP A 429 -4.084 -1.792 -11.481 1.00 0.00 C ATOM 1212 CE3 TRP A 429 -5.584 0.097 -11.359 1.00 0.00 C ATOM 1213 CZ2 TRP A 429 -3.937 -1.644 -12.858 1.00 0.00 C ATOM 1214 CZ3 TRP A 429 -5.437 0.243 -12.726 1.00 0.00 C ATOM 1215 CH2 TRP A 429 -4.620 -0.625 -13.464 1.00 0.00 C ATOM 0 H TRP A 429 -6.191 -0.497 -5.782 1.00 0.00 H new ATOM 0 HA TRP A 429 -7.332 -1.901 -8.036 1.00 0.00 H new ATOM 0 HB2 TRP A 429 -6.092 0.086 -8.501 1.00 0.00 H new ATOM 0 HB3 TRP A 429 -4.760 -0.400 -7.471 1.00 0.00 H new ATOM 0 HD1 TRP A 429 -3.695 -3.020 -8.474 1.00 0.00 H new ATOM 0 HE1 TRP A 429 -2.893 -3.458 -10.895 1.00 0.00 H new ATOM 0 HE3 TRP A 429 -6.218 0.769 -10.799 1.00 0.00 H new ATOM 0 HZ2 TRP A 429 -3.306 -2.310 -13.428 1.00 0.00 H new ATOM 0 HZ3 TRP A 429 -5.961 1.039 -13.234 1.00 0.00 H new ATOM 0 HH2 TRP A 429 -4.528 -0.487 -14.531 1.00 0.00 H new ATOM 1226 N PHE A 430 -4.712 -3.140 -6.433 1.00 0.00 N ATOM 1227 CA PHE A 430 -3.963 -4.367 -6.192 1.00 0.00 C ATOM 1228 C PHE A 430 -4.601 -5.182 -5.071 1.00 0.00 C ATOM 1229 O PHE A 430 -4.318 -6.371 -4.914 1.00 0.00 O ATOM 1230 CB PHE A 430 -2.511 -4.042 -5.838 1.00 0.00 C ATOM 1231 CG PHE A 430 -1.792 -3.270 -6.908 1.00 0.00 C ATOM 1232 CD1 PHE A 430 -1.312 -3.910 -8.039 1.00 0.00 C ATOM 1233 CD2 PHE A 430 -1.595 -1.905 -6.782 1.00 0.00 C ATOM 1234 CE1 PHE A 430 -0.651 -3.204 -9.026 1.00 0.00 C ATOM 1235 CE2 PHE A 430 -0.935 -1.192 -7.765 1.00 0.00 C ATOM 1236 CZ PHE A 430 -0.461 -1.842 -8.887 1.00 0.00 C ATOM 0 H PHE A 430 -4.386 -2.335 -5.898 1.00 0.00 H new ATOM 0 HA PHE A 430 -3.983 -4.961 -7.106 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.491 -3.468 -4.911 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -1.974 -4.972 -5.649 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.456 -4.974 -8.151 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -1.961 -1.392 -5.905 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -0.284 -3.715 -9.904 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -0.790 -0.127 -7.656 1.00 0.00 H new ATOM 0 HZ PHE A 430 0.057 -1.287 -9.655 1.00 0.00 H new ATOM 1246 N ASP A 431 -5.462 -4.536 -4.293 1.00 0.00 N ATOM 1247 CA ASP A 431 -6.141 -5.199 -3.186 1.00 0.00 C ATOM 1248 C ASP A 431 -6.986 -6.366 -3.688 1.00 0.00 C ATOM 1249 O ASP A 431 -8.140 -6.190 -4.075 1.00 0.00 O ATOM 1250 CB ASP A 431 -7.023 -4.203 -2.430 1.00 0.00 C ATOM 1251 CG ASP A 431 -8.187 -4.877 -1.731 1.00 0.00 C ATOM 1252 OD1 ASP A 431 -7.940 -5.770 -0.892 1.00 0.00 O ATOM 1253 OD2 ASP A 431 -9.345 -4.510 -2.019 1.00 0.00 O ATOM 0 H ASP A 431 -5.707 -3.553 -4.409 1.00 0.00 H new ATOM 0 HA ASP A 431 -5.382 -5.588 -2.507 1.00 0.00 H new ATOM 0 HB2 ASP A 431 -6.419 -3.672 -1.694 1.00 0.00 H new ATOM 0 HB3 ASP A 431 -7.404 -3.457 -3.127 1.00 0.00 H new ATOM 1258 N GLY A 432 -6.400 -7.560 -3.680 1.00 0.00 N ATOM 1259 CA GLY A 432 -7.112 -8.738 -4.137 1.00 0.00 C ATOM 1260 C GLY A 432 -6.507 -9.330 -5.395 1.00 0.00 C ATOM 1261 O GLY A 432 -7.145 -10.125 -6.086 1.00 0.00 O ATOM 0 H GLY A 432 -5.445 -7.732 -3.365 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -7.109 -9.490 -3.348 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -8.154 -8.479 -4.326 1.00 0.00 H new ATOM 1265 N LYS A 433 -5.273 -8.941 -5.695 1.00 0.00 N ATOM 1266 CA LYS A 433 -4.580 -9.436 -6.879 1.00 0.00 C ATOM 1267 C LYS A 433 -3.951 -10.799 -6.610 1.00 0.00 C ATOM 1268 O LYS A 433 -3.800 -11.208 -5.460 1.00 0.00 O ATOM 1269 CB LYS A 433 -3.502 -8.442 -7.318 1.00 0.00 C ATOM 1270 CG LYS A 433 -4.053 -7.227 -8.043 1.00 0.00 C ATOM 1271 CD LYS A 433 -4.580 -7.590 -9.421 1.00 0.00 C ATOM 1272 CE LYS A 433 -3.491 -7.483 -10.478 1.00 0.00 C ATOM 1273 NZ LYS A 433 -2.745 -8.762 -10.638 1.00 0.00 N ATOM 0 H LYS A 433 -4.731 -8.284 -5.134 1.00 0.00 H new ATOM 0 HA LYS A 433 -5.312 -9.544 -7.679 1.00 0.00 H new ATOM 0 HB2 LYS A 433 -2.947 -8.110 -6.441 1.00 0.00 H new ATOM 0 HB3 LYS A 433 -2.793 -8.953 -7.970 1.00 0.00 H new ATOM 0 HG2 LYS A 433 -4.854 -6.782 -7.452 1.00 0.00 H new ATOM 0 HG3 LYS A 433 -3.271 -6.474 -8.139 1.00 0.00 H new ATOM 0 HD2 LYS A 433 -4.975 -8.606 -9.405 1.00 0.00 H new ATOM 0 HD3 LYS A 433 -5.408 -6.930 -9.681 1.00 0.00 H new ATOM 0 HE2 LYS A 433 -3.937 -7.201 -11.432 1.00 0.00 H new ATOM 0 HE3 LYS A 433 -2.796 -6.689 -10.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 -1.745 -8.614 -10.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 -3.152 -9.482 -10.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 -2.816 -9.084 -11.624 1.00 0.00 H new ATOM 1287 N ASP A 434 -3.584 -11.498 -7.680 1.00 0.00 N ATOM 1288 CA ASP A 434 -2.969 -12.813 -7.559 1.00 0.00 C ATOM 1289 C ASP A 434 -1.498 -12.766 -7.962 1.00 0.00 C ATOM 1290 O ASP A 434 -1.171 -12.619 -9.139 1.00 0.00 O ATOM 1291 CB ASP A 434 -3.714 -13.831 -8.425 1.00 0.00 C ATOM 1292 CG ASP A 434 -3.445 -13.638 -9.904 1.00 0.00 C ATOM 1293 OD1 ASP A 434 -4.075 -12.745 -10.512 1.00 0.00 O ATOM 1294 OD2 ASP A 434 -2.604 -14.379 -10.456 1.00 0.00 O ATOM 0 H ASP A 434 -3.702 -11.175 -8.640 1.00 0.00 H new ATOM 0 HA ASP A 434 -3.032 -13.120 -6.515 1.00 0.00 H new ATOM 0 HB2 ASP A 434 -3.418 -14.838 -8.133 1.00 0.00 H new ATOM 0 HB3 ASP A 434 -4.785 -13.747 -8.239 1.00 0.00 H new ATOM 1299 N PHE A 435 -0.616 -12.887 -6.976 1.00 0.00 N ATOM 1300 CA PHE A 435 0.820 -12.855 -7.226 1.00 0.00 C ATOM 1301 C PHE A 435 1.438 -14.236 -7.028 1.00 0.00 C ATOM 1302 O PHE A 435 1.552 -14.720 -5.902 1.00 0.00 O ATOM 1303 CB PHE A 435 1.498 -11.843 -6.301 1.00 0.00 C ATOM 1304 CG PHE A 435 2.727 -11.217 -6.896 1.00 0.00 C ATOM 1305 CD1 PHE A 435 3.892 -11.952 -7.047 1.00 0.00 C ATOM 1306 CD2 PHE A 435 2.719 -9.892 -7.302 1.00 0.00 C ATOM 1307 CE1 PHE A 435 5.025 -11.380 -7.594 1.00 0.00 C ATOM 1308 CE2 PHE A 435 3.848 -9.314 -7.850 1.00 0.00 C ATOM 1309 CZ PHE A 435 5.003 -10.058 -7.996 1.00 0.00 C ATOM 0 H PHE A 435 -0.871 -13.008 -5.996 1.00 0.00 H new ATOM 0 HA PHE A 435 0.976 -12.552 -8.261 1.00 0.00 H new ATOM 0 HB2 PHE A 435 0.785 -11.058 -6.050 1.00 0.00 H new ATOM 0 HB3 PHE A 435 1.768 -12.339 -5.368 1.00 0.00 H new ATOM 0 HD1 PHE A 435 3.915 -12.985 -6.733 1.00 0.00 H new ATOM 0 HD2 PHE A 435 1.820 -9.304 -7.189 1.00 0.00 H new ATOM 0 HE1 PHE A 435 5.926 -11.965 -7.707 1.00 0.00 H new ATOM 0 HE2 PHE A 435 3.828 -8.281 -8.164 1.00 0.00 H new ATOM 0 HZ PHE A 435 5.887 -9.607 -8.423 1.00 0.00 H new ATOM 1319 N GLN A 436 1.834 -14.864 -8.130 1.00 0.00 N ATOM 1320 CA GLN A 436 2.438 -16.190 -8.078 1.00 0.00 C ATOM 1321 C GLN A 436 1.469 -17.208 -7.489 1.00 0.00 C ATOM 1322 O GLN A 436 1.882 -18.214 -6.914 1.00 0.00 O ATOM 1323 CB GLN A 436 3.725 -16.154 -7.252 1.00 0.00 C ATOM 1324 CG GLN A 436 4.892 -15.497 -7.970 1.00 0.00 C ATOM 1325 CD GLN A 436 6.214 -15.721 -7.262 1.00 0.00 C ATOM 1326 OE1 GLN A 436 6.470 -16.800 -6.727 1.00 0.00 O ATOM 1327 NE2 GLN A 436 7.063 -14.700 -7.257 1.00 0.00 N ATOM 0 H GLN A 436 1.748 -14.476 -9.069 1.00 0.00 H new ATOM 0 HA GLN A 436 2.677 -16.493 -9.097 1.00 0.00 H new ATOM 0 HB2 GLN A 436 3.534 -15.619 -6.322 1.00 0.00 H new ATOM 0 HB3 GLN A 436 4.002 -17.173 -6.983 1.00 0.00 H new ATOM 0 HG2 GLN A 436 4.957 -15.890 -8.985 1.00 0.00 H new ATOM 0 HG3 GLN A 436 4.706 -14.426 -8.054 1.00 0.00 H new ATOM 0 HE21 GLN A 436 6.809 -13.824 -7.713 1.00 0.00 H new ATOM 0 HE22 GLN A 436 7.969 -14.792 -6.797 1.00 0.00 H new ATOM 1336 N GLY A 437 0.175 -16.939 -7.633 1.00 0.00 N ATOM 1337 CA GLY A 437 -0.835 -17.840 -7.108 1.00 0.00 C ATOM 1338 C GLY A 437 -1.306 -17.441 -5.724 1.00 0.00 C ATOM 1339 O GLY A 437 -2.322 -17.939 -5.240 1.00 0.00 O ATOM 0 H GLY A 437 -0.192 -16.112 -8.104 1.00 0.00 H new ATOM 0 HA2 GLY A 437 -1.688 -17.860 -7.787 1.00 0.00 H new ATOM 0 HA3 GLY A 437 -0.432 -18.852 -7.073 1.00 0.00 H new ATOM 1343 N SER A 438 -0.565 -16.542 -5.085 1.00 0.00 N ATOM 1344 CA SER A 438 -0.909 -16.081 -3.746 1.00 0.00 C ATOM 1345 C SER A 438 -1.599 -14.720 -3.800 1.00 0.00 C ATOM 1346 O SER A 438 -1.102 -13.784 -4.425 1.00 0.00 O ATOM 1347 CB SER A 438 0.346 -15.993 -2.875 1.00 0.00 C ATOM 1348 OG SER A 438 0.792 -17.283 -2.493 1.00 0.00 O ATOM 0 H SER A 438 0.278 -16.118 -5.473 1.00 0.00 H new ATOM 0 HA SER A 438 -1.598 -16.802 -3.307 1.00 0.00 H new ATOM 0 HB2 SER A 438 1.136 -15.478 -3.421 1.00 0.00 H new ATOM 0 HB3 SER A 438 0.135 -15.399 -1.986 1.00 0.00 H new ATOM 0 HG SER A 438 1.596 -17.200 -1.939 1.00 0.00 H new ATOM 1354 N LYS A 439 -2.748 -14.621 -3.141 1.00 0.00 N ATOM 1355 CA LYS A 439 -3.508 -13.377 -3.112 1.00 0.00 C ATOM 1356 C LYS A 439 -2.794 -12.323 -2.271 1.00 0.00 C ATOM 1357 O LYS A 439 -2.255 -12.624 -1.206 1.00 0.00 O ATOM 1358 CB LYS A 439 -4.911 -13.625 -2.552 1.00 0.00 C ATOM 1359 CG LYS A 439 -5.909 -12.536 -2.907 1.00 0.00 C ATOM 1360 CD LYS A 439 -7.321 -13.087 -3.010 1.00 0.00 C ATOM 1361 CE LYS A 439 -7.877 -13.456 -1.644 1.00 0.00 C ATOM 1362 NZ LYS A 439 -7.543 -14.859 -1.271 1.00 0.00 N ATOM 0 H LYS A 439 -3.174 -15.387 -2.620 1.00 0.00 H new ATOM 0 HA LYS A 439 -3.591 -13.007 -4.134 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -5.279 -14.580 -2.927 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -4.850 -13.711 -1.467 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -5.878 -11.752 -2.151 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -5.626 -12.077 -3.854 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -7.968 -12.346 -3.479 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -7.323 -13.966 -3.654 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -7.477 -12.775 -0.893 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -8.959 -13.328 -1.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -8.226 -15.203 -0.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -7.585 -15.463 -2.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -6.584 -14.893 -0.870 1.00 0.00 H new ATOM 1376 N LEU A 440 -2.796 -11.086 -2.756 1.00 0.00 N ATOM 1377 CA LEU A 440 -2.150 -9.985 -2.048 1.00 0.00 C ATOM 1378 C LEU A 440 -3.183 -9.096 -1.365 1.00 0.00 C ATOM 1379 O LEU A 440 -4.329 -9.005 -1.806 1.00 0.00 O ATOM 1380 CB LEU A 440 -1.306 -9.156 -3.018 1.00 0.00 C ATOM 1381 CG LEU A 440 -0.407 -9.944 -3.971 1.00 0.00 C ATOM 1382 CD1 LEU A 440 0.564 -9.015 -4.680 1.00 0.00 C ATOM 1383 CD2 LEU A 440 0.346 -11.031 -3.216 1.00 0.00 C ATOM 0 H LEU A 440 -3.237 -10.820 -3.636 1.00 0.00 H new ATOM 0 HA LEU A 440 -1.501 -10.408 -1.282 1.00 0.00 H new ATOM 0 HB2 LEU A 440 -1.977 -8.536 -3.613 1.00 0.00 H new ATOM 0 HB3 LEU A 440 -0.680 -8.480 -2.436 1.00 0.00 H new ATOM 0 HG LEU A 440 -1.036 -10.420 -4.723 1.00 0.00 H new ATOM 0 HD11 LEU A 440 1.195 -9.594 -5.354 1.00 0.00 H new ATOM 0 HD12 LEU A 440 0.006 -8.274 -5.253 1.00 0.00 H new ATOM 0 HD13 LEU A 440 1.188 -8.510 -3.943 1.00 0.00 H new ATOM 0 HD21 LEU A 440 0.981 -11.582 -3.909 1.00 0.00 H new ATOM 0 HD22 LEU A 440 0.964 -10.575 -2.442 1.00 0.00 H new ATOM 0 HD23 LEU A 440 -0.367 -11.715 -2.755 1.00 0.00 H new ATOM 1395 N LYS A 441 -2.770 -8.439 -0.286 1.00 0.00 N ATOM 1396 CA LYS A 441 -3.657 -7.552 0.457 1.00 0.00 C ATOM 1397 C LYS A 441 -3.038 -6.168 0.612 1.00 0.00 C ATOM 1398 O LYS A 441 -2.110 -5.975 1.398 1.00 0.00 O ATOM 1399 CB LYS A 441 -3.963 -8.143 1.836 1.00 0.00 C ATOM 1400 CG LYS A 441 -4.959 -9.289 1.799 1.00 0.00 C ATOM 1401 CD LYS A 441 -5.605 -9.509 3.156 1.00 0.00 C ATOM 1402 CE LYS A 441 -6.414 -10.797 3.186 1.00 0.00 C ATOM 1403 NZ LYS A 441 -7.793 -10.597 2.660 1.00 0.00 N ATOM 0 H LYS A 441 -1.825 -8.504 0.093 1.00 0.00 H new ATOM 0 HA LYS A 441 -4.586 -7.454 -0.105 1.00 0.00 H new ATOM 0 HB2 LYS A 441 -3.034 -8.494 2.286 1.00 0.00 H new ATOM 0 HB3 LYS A 441 -4.352 -7.355 2.481 1.00 0.00 H new ATOM 0 HG2 LYS A 441 -5.730 -9.079 1.058 1.00 0.00 H new ATOM 0 HG3 LYS A 441 -4.454 -10.202 1.483 1.00 0.00 H new ATOM 0 HD2 LYS A 441 -4.834 -9.544 3.926 1.00 0.00 H new ATOM 0 HD3 LYS A 441 -6.253 -8.665 3.393 1.00 0.00 H new ATOM 0 HE2 LYS A 441 -5.906 -11.559 2.594 1.00 0.00 H new ATOM 0 HE3 LYS A 441 -6.466 -11.170 4.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 441 -8.313 -11.497 2.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 441 -8.286 -9.888 3.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 441 -7.744 -10.265 1.675 1.00 0.00 H new ATOM 1417 N VAL A 442 -3.559 -5.204 -0.143 1.00 0.00 N ATOM 1418 CA VAL A 442 -3.059 -3.835 -0.088 1.00 0.00 C ATOM 1419 C VAL A 442 -3.949 -2.960 0.787 1.00 0.00 C ATOM 1420 O VAL A 442 -5.175 -3.054 0.733 1.00 0.00 O ATOM 1421 CB VAL A 442 -2.968 -3.214 -1.494 1.00 0.00 C ATOM 1422 CG1 VAL A 442 -2.203 -1.899 -1.449 1.00 0.00 C ATOM 1423 CG2 VAL A 442 -2.316 -4.186 -2.465 1.00 0.00 C ATOM 0 H VAL A 442 -4.327 -5.346 -0.799 1.00 0.00 H new ATOM 0 HA VAL A 442 -2.060 -3.880 0.346 1.00 0.00 H new ATOM 0 HB VAL A 442 -3.979 -3.007 -1.846 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -2.149 -1.475 -2.452 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.717 -1.202 -0.787 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.195 -2.077 -1.076 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -2.260 -3.730 -3.454 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -1.311 -4.427 -2.119 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -2.909 -5.099 -2.519 1.00 0.00 H new ATOM 1433 N SER A 443 -3.323 -2.107 1.592 1.00 0.00 N ATOM 1434 CA SER A 443 -4.059 -1.217 2.482 1.00 0.00 C ATOM 1435 C SER A 443 -3.180 -0.054 2.935 1.00 0.00 C ATOM 1436 O SER A 443 -2.053 -0.253 3.391 1.00 0.00 O ATOM 1437 CB SER A 443 -4.573 -1.987 3.699 1.00 0.00 C ATOM 1438 OG SER A 443 -3.626 -1.967 4.753 1.00 0.00 O ATOM 0 H SER A 443 -2.309 -2.014 1.646 1.00 0.00 H new ATOM 0 HA SER A 443 -4.909 -0.815 1.931 1.00 0.00 H new ATOM 0 HB2 SER A 443 -5.511 -1.549 4.040 1.00 0.00 H new ATOM 0 HB3 SER A 443 -4.786 -3.018 3.417 1.00 0.00 H new ATOM 0 HG SER A 443 -3.979 -2.465 5.520 1.00 0.00 H new ATOM 1444 N LEU A 444 -3.703 1.160 2.807 1.00 0.00 N ATOM 1445 CA LEU A 444 -2.968 2.356 3.203 1.00 0.00 C ATOM 1446 C LEU A 444 -2.269 2.146 4.543 1.00 0.00 C ATOM 1447 O LEU A 444 -2.912 1.851 5.550 1.00 0.00 O ATOM 1448 CB LEU A 444 -3.914 3.555 3.289 1.00 0.00 C ATOM 1449 CG LEU A 444 -4.328 4.180 1.958 1.00 0.00 C ATOM 1450 CD1 LEU A 444 -5.414 5.222 2.172 1.00 0.00 C ATOM 1451 CD2 LEU A 444 -3.125 4.798 1.261 1.00 0.00 C ATOM 0 H LEU A 444 -4.634 1.342 2.432 1.00 0.00 H new ATOM 0 HA LEU A 444 -2.209 2.554 2.446 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -4.815 3.244 3.817 1.00 0.00 H new ATOM 0 HB3 LEU A 444 -3.438 4.325 3.896 1.00 0.00 H new ATOM 0 HG LEU A 444 -4.729 3.393 1.319 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -5.696 5.656 1.213 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -6.285 4.751 2.627 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -5.041 6.007 2.830 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -3.439 5.238 0.315 1.00 0.00 H new ATOM 0 HD22 LEU A 444 -2.695 5.572 1.896 1.00 0.00 H new ATOM 0 HD23 LEU A 444 -2.378 4.027 1.072 1.00 0.00 H new