USER MOD reduce.3.24.130724 H: found=0, std=0, add=572, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 573 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 451 ASN : amide:sc= -0.892 K(o=-0.82,f=-5.5!) USER MOD Set 1.2: A 454 SER OG : rot 98:sc= 0.0685 USER MOD Single : A 395 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 402 ASN :FLIP amide:sc= -2 F(o=-3.5!,f=-2) USER MOD Single : A 406 TYR OH : rot 180:sc= 0 USER MOD Single : A 407 HIS : no HD1:sc= -0.28 X(o=-0.28,f=-0.026) USER MOD Single : A 410 GLN : amide:sc= -0.517 K(o=-0.52,f=-2!) USER MOD Single : A 415 GLN : amide:sc=-0.00057 X(o=-0.00057,f=0) USER MOD Single : A 419 GLN : amide:sc= -6.31! C(o=-6.3!,f=-11!) USER MOD Single : A 420 MET CE :methyl 179:sc= -0.011 (180deg=-0.0111) USER MOD Single : A 422 MET CE :methyl -107:sc= -1.51 (180deg=-7.57!) USER MOD Single : A 426 ASN : amide:sc= -0.782 K(o=-0.78,f=-6!) USER MOD Single : A 429 SER OG : rot 156:sc= -0.746 USER MOD Single : A 431 LYS NZ :NH3+ -159:sc= -0.0621 (180deg=-0.376) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 448 SER OG : rot 97:sc= 1.29 USER MOD Single : A 449 TYR OH : rot -93:sc= 1.05 USER MOD Single : A 456 GLN :FLIP amide:sc= -0.252 F(o=-1.3,f=-0.25) USER MOD Single : A 460 GLN : amide:sc= -1.11 K(o=-1.1,f=-2.5!) USER MOD Single : A 461 SER OG : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl -121:sc=-0.000996 (180deg=-1.95!) USER MOD Single : A 463 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 466 GLN : amide:sc= -1.63 K(o=-1.6,f=-2.3) USER MOD Single : A 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 470 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000205) USER MOD Single : A 473 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= 0 X(o=0,f=-0.00044) USER MOD Single : A 477 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 225 N LYS A 395 9.289 4.762 3.671 1.00 0.00 N ATOM 226 CA LYS A 395 9.087 6.197 3.511 1.00 0.00 C ATOM 227 C LYS A 395 7.649 6.503 3.108 1.00 0.00 C ATOM 228 O LYS A 395 6.845 5.594 2.907 1.00 0.00 O ATOM 229 CB LYS A 395 10.052 6.754 2.462 1.00 0.00 C ATOM 230 CG LYS A 395 10.410 5.757 1.374 1.00 0.00 C ATOM 231 CD LYS A 395 10.712 6.452 0.057 1.00 0.00 C ATOM 232 CE LYS A 395 12.146 6.958 0.011 1.00 0.00 C ATOM 233 NZ LYS A 395 13.083 5.926 -0.511 1.00 0.00 N ATOM 0 HA LYS A 395 9.286 6.676 4.470 1.00 0.00 H new ATOM 0 HB2 LYS A 395 9.606 7.636 2.002 1.00 0.00 H new ATOM 0 HB3 LYS A 395 10.966 7.081 2.958 1.00 0.00 H new ATOM 0 HG2 LYS A 395 11.276 5.173 1.685 1.00 0.00 H new ATOM 0 HG3 LYS A 395 9.586 5.056 1.236 1.00 0.00 H new ATOM 0 HD2 LYS A 395 10.542 5.760 -0.768 1.00 0.00 H new ATOM 0 HD3 LYS A 395 10.025 7.287 -0.081 1.00 0.00 H new ATOM 0 HE2 LYS A 395 12.197 7.846 -0.618 1.00 0.00 H new ATOM 0 HE3 LYS A 395 12.457 7.258 1.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 14.049 6.310 -0.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 13.054 5.088 0.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 12.802 5.658 -1.476 1.00 0.00 H new ATOM 247 N GLU A 396 7.333 7.789 2.991 1.00 0.00 N ATOM 248 CA GLU A 396 5.990 8.214 2.611 1.00 0.00 C ATOM 249 C GLU A 396 6.046 9.335 1.579 1.00 0.00 C ATOM 250 O GLU A 396 7.123 9.726 1.128 1.00 0.00 O ATOM 251 CB GLU A 396 5.210 8.676 3.843 1.00 0.00 C ATOM 252 CG GLU A 396 5.509 7.867 5.093 1.00 0.00 C ATOM 253 CD GLU A 396 4.655 8.281 6.275 1.00 0.00 C ATOM 254 OE1 GLU A 396 3.413 8.235 6.155 1.00 0.00 O ATOM 255 OE2 GLU A 396 5.229 8.652 7.322 1.00 0.00 O ATOM 0 H GLU A 396 7.988 8.554 3.154 1.00 0.00 H new ATOM 0 HA GLU A 396 5.478 7.361 2.166 1.00 0.00 H new ATOM 0 HB2 GLU A 396 5.440 9.724 4.036 1.00 0.00 H new ATOM 0 HB3 GLU A 396 4.143 8.617 3.630 1.00 0.00 H new ATOM 0 HG2 GLU A 396 5.346 6.810 4.884 1.00 0.00 H new ATOM 0 HG3 GLU A 396 6.561 7.982 5.352 1.00 0.00 H new ATOM 262 N GLY A 397 4.877 9.851 1.209 1.00 0.00 N ATOM 263 CA GLY A 397 4.815 10.922 0.232 1.00 0.00 C ATOM 264 C GLY A 397 4.468 12.259 0.859 1.00 0.00 C ATOM 265 O GLY A 397 4.895 12.576 1.970 1.00 0.00 O ATOM 0 H GLY A 397 3.973 9.546 1.569 1.00 0.00 H new ATOM 0 HA2 GLY A 397 5.775 11.001 -0.277 1.00 0.00 H new ATOM 0 HA3 GLY A 397 4.072 10.676 -0.526 1.00 0.00 H new ATOM 269 N PRO A 398 3.678 13.068 0.138 1.00 0.00 N ATOM 270 CA PRO A 398 3.259 14.391 0.610 1.00 0.00 C ATOM 271 C PRO A 398 2.197 14.306 1.702 1.00 0.00 C ATOM 272 O PRO A 398 1.422 13.352 1.753 1.00 0.00 O ATOM 273 CB PRO A 398 2.684 15.049 -0.645 1.00 0.00 C ATOM 274 CG PRO A 398 2.211 13.915 -1.487 1.00 0.00 C ATOM 275 CD PRO A 398 3.135 12.755 -1.193 1.00 0.00 C ATOM 0 HA PRO A 398 4.084 14.945 1.058 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.866 15.726 -0.397 1.00 0.00 H new ATOM 0 HB3 PRO A 398 3.440 15.639 -1.164 1.00 0.00 H new ATOM 0 HG2 PRO A 398 1.178 13.659 -1.250 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.240 14.177 -2.545 1.00 0.00 H new ATOM 0 HD2 PRO A 398 2.599 11.806 -1.193 1.00 0.00 H new ATOM 0 HD3 PRO A 398 3.926 12.674 -1.939 1.00 0.00 H new ATOM 283 N GLU A 399 2.167 15.312 2.571 1.00 0.00 N ATOM 284 CA GLU A 399 1.198 15.350 3.660 1.00 0.00 C ATOM 285 C GLU A 399 -0.226 15.241 3.127 1.00 0.00 C ATOM 286 O GLU A 399 -0.795 16.218 2.642 1.00 0.00 O ATOM 287 CB GLU A 399 1.356 16.640 4.467 1.00 0.00 C ATOM 288 CG GLU A 399 0.752 16.565 5.860 1.00 0.00 C ATOM 289 CD GLU A 399 1.705 15.970 6.877 1.00 0.00 C ATOM 290 OE1 GLU A 399 2.931 16.148 6.718 1.00 0.00 O ATOM 291 OE2 GLU A 399 1.226 15.323 7.833 1.00 0.00 O ATOM 0 H GLU A 399 2.802 16.110 2.542 1.00 0.00 H new ATOM 0 HA GLU A 399 1.388 14.497 4.311 1.00 0.00 H new ATOM 0 HB2 GLU A 399 2.416 16.878 4.552 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.889 17.460 3.921 1.00 0.00 H new ATOM 0 HG2 GLU A 399 0.462 17.566 6.181 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.158 15.966 5.826 1.00 0.00 H new ATOM 298 N GLY A 400 -0.797 14.044 3.219 1.00 0.00 N ATOM 299 CA GLY A 400 -2.150 13.829 2.742 1.00 0.00 C ATOM 300 C GLY A 400 -2.288 12.544 1.949 1.00 0.00 C ATOM 301 O GLY A 400 -3.372 11.966 1.874 1.00 0.00 O ATOM 0 H GLY A 400 -0.346 13.219 3.616 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -2.832 13.803 3.592 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -2.450 14.671 2.119 1.00 0.00 H new ATOM 305 N ALA A 401 -1.188 12.097 1.355 1.00 0.00 N ATOM 306 CA ALA A 401 -1.190 10.873 0.564 1.00 0.00 C ATOM 307 C ALA A 401 -0.661 9.694 1.375 1.00 0.00 C ATOM 308 O ALA A 401 0.424 9.761 1.949 1.00 0.00 O ATOM 309 CB ALA A 401 -0.363 11.058 -0.700 1.00 0.00 C ATOM 0 H ALA A 401 -0.283 12.564 1.406 1.00 0.00 H new ATOM 0 HA ALA A 401 -2.220 10.655 0.282 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -0.374 10.135 -1.280 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -0.786 11.867 -1.296 1.00 0.00 H new ATOM 0 HB3 ALA A 401 0.664 11.305 -0.430 1.00 0.00 H new ATOM 315 N ASN A 402 -1.438 8.616 1.420 1.00 0.00 N ATOM 316 CA ASN A 402 -1.049 7.423 2.162 1.00 0.00 C ATOM 317 C ASN A 402 -1.802 6.197 1.656 1.00 0.00 C ATOM 318 O ASN A 402 -2.766 6.316 0.899 1.00 0.00 O ATOM 319 CB ASN A 402 -1.315 7.618 3.656 1.00 0.00 C ATOM 320 CG ASN A 402 -0.216 8.409 4.341 1.00 0.00 C ATOM 321 OD1 ASN A 402 -0.324 9.732 4.295 1.00 0.00 O flip ATOM 322 ND2 ASN A 402 0.717 7.836 4.904 1.00 0.00 N flip ATOM 0 H ASN A 402 -2.341 8.545 0.951 1.00 0.00 H new ATOM 0 HA ASN A 402 0.018 7.261 2.007 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -2.266 8.133 3.789 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -1.411 6.644 4.135 1.00 0.00 H new ATOM 0 HD21 ASN A 402 0.758 6.817 4.914 1.00 0.00 H new ATOM 0 HD22 ASN A 402 1.449 8.380 5.361 1.00 0.00 H new ATOM 329 N LEU A 403 -1.356 5.019 2.079 1.00 0.00 N ATOM 330 CA LEU A 403 -1.988 3.770 1.669 1.00 0.00 C ATOM 331 C LEU A 403 -1.664 2.649 2.651 1.00 0.00 C ATOM 332 O LEU A 403 -0.497 2.360 2.918 1.00 0.00 O ATOM 333 CB LEU A 403 -1.528 3.380 0.263 1.00 0.00 C ATOM 334 CG LEU A 403 -2.095 4.217 -0.885 1.00 0.00 C ATOM 335 CD1 LEU A 403 -1.552 3.730 -2.219 1.00 0.00 C ATOM 336 CD2 LEU A 403 -3.616 4.170 -0.877 1.00 0.00 C ATOM 0 H LEU A 403 -0.559 4.903 2.705 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.067 3.922 1.662 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -0.440 3.441 0.228 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -1.794 2.337 0.092 1.00 0.00 H new ATOM 0 HG LEU A 403 -1.782 5.252 -0.745 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -1.966 4.337 -3.024 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -0.465 3.815 -2.223 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -1.835 2.688 -2.368 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.003 4.771 -1.700 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -3.949 3.139 -0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -3.987 4.567 0.068 1.00 0.00 H new ATOM 348 N PHE A 404 -2.705 2.018 3.184 1.00 0.00 N ATOM 349 CA PHE A 404 -2.532 0.927 4.136 1.00 0.00 C ATOM 350 C PHE A 404 -3.366 -0.286 3.732 1.00 0.00 C ATOM 351 O PHE A 404 -4.596 -0.254 3.792 1.00 0.00 O ATOM 352 CB PHE A 404 -2.923 1.383 5.544 1.00 0.00 C ATOM 353 CG PHE A 404 -1.862 2.200 6.225 1.00 0.00 C ATOM 354 CD1 PHE A 404 -1.602 3.498 5.819 1.00 0.00 C ATOM 355 CD2 PHE A 404 -1.127 1.670 7.272 1.00 0.00 C ATOM 356 CE1 PHE A 404 -0.626 4.252 6.443 1.00 0.00 C ATOM 357 CE2 PHE A 404 -0.150 2.418 7.902 1.00 0.00 C ATOM 358 CZ PHE A 404 0.099 3.712 7.486 1.00 0.00 C ATOM 0 H PHE A 404 -3.677 2.243 2.973 1.00 0.00 H new ATOM 0 HA PHE A 404 -1.481 0.640 4.133 1.00 0.00 H new ATOM 0 HB2 PHE A 404 -3.840 1.969 5.486 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -3.143 0.506 6.153 1.00 0.00 H new ATOM 0 HD1 PHE A 404 -2.168 3.926 5.005 1.00 0.00 H new ATOM 0 HD2 PHE A 404 -1.319 0.659 7.601 1.00 0.00 H new ATOM 0 HE1 PHE A 404 -0.431 5.262 6.115 1.00 0.00 H new ATOM 0 HE2 PHE A 404 0.417 1.992 8.717 1.00 0.00 H new ATOM 0 HZ PHE A 404 0.860 4.300 7.977 1.00 0.00 H new ATOM 368 N ILE A 405 -2.689 -1.351 3.320 1.00 0.00 N ATOM 369 CA ILE A 405 -3.367 -2.573 2.906 1.00 0.00 C ATOM 370 C ILE A 405 -3.532 -3.535 4.079 1.00 0.00 C ATOM 371 O ILE A 405 -2.583 -3.793 4.821 1.00 0.00 O ATOM 372 CB ILE A 405 -2.602 -3.287 1.776 1.00 0.00 C ATOM 373 CG1 ILE A 405 -2.499 -2.378 0.549 1.00 0.00 C ATOM 374 CG2 ILE A 405 -3.288 -4.596 1.416 1.00 0.00 C ATOM 375 CD1 ILE A 405 -1.525 -1.234 0.725 1.00 0.00 C ATOM 0 H ILE A 405 -1.671 -1.393 3.264 1.00 0.00 H new ATOM 0 HA ILE A 405 -4.350 -2.279 2.539 1.00 0.00 H new ATOM 0 HB ILE A 405 -1.594 -3.512 2.125 1.00 0.00 H new ATOM 0 HG12 ILE A 405 -2.195 -2.975 -0.311 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -3.485 -1.973 0.323 1.00 0.00 H new ATOM 0 HG21 ILE A 405 -2.735 -5.088 0.616 1.00 0.00 H new ATOM 0 HG22 ILE A 405 -3.315 -5.245 2.291 1.00 0.00 H new ATOM 0 HG23 ILE A 405 -4.306 -4.394 1.082 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.503 -0.632 -0.183 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -1.840 -0.614 1.564 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.529 -1.631 0.921 1.00 0.00 H new ATOM 387 N TYR A 406 -4.740 -4.063 4.238 1.00 0.00 N ATOM 388 CA TYR A 406 -5.029 -4.996 5.321 1.00 0.00 C ATOM 389 C TYR A 406 -5.546 -6.323 4.773 1.00 0.00 C ATOM 390 O TYR A 406 -6.050 -6.391 3.651 1.00 0.00 O ATOM 391 CB TYR A 406 -6.056 -4.393 6.281 1.00 0.00 C ATOM 392 CG TYR A 406 -5.623 -3.074 6.880 1.00 0.00 C ATOM 393 CD1 TYR A 406 -4.590 -3.017 7.808 1.00 0.00 C ATOM 394 CD2 TYR A 406 -6.246 -1.886 6.519 1.00 0.00 C ATOM 395 CE1 TYR A 406 -4.192 -1.814 8.359 1.00 0.00 C ATOM 396 CE2 TYR A 406 -5.853 -0.679 7.063 1.00 0.00 C ATOM 397 CZ TYR A 406 -4.826 -0.648 7.983 1.00 0.00 C ATOM 398 OH TYR A 406 -4.432 0.553 8.529 1.00 0.00 O ATOM 0 H TYR A 406 -5.535 -3.861 3.631 1.00 0.00 H new ATOM 0 HA TYR A 406 -4.102 -5.184 5.862 1.00 0.00 H new ATOM 0 HB2 TYR A 406 -6.997 -4.250 5.750 1.00 0.00 H new ATOM 0 HB3 TYR A 406 -6.249 -5.102 7.086 1.00 0.00 H new ATOM 0 HD1 TYR A 406 -4.090 -3.928 8.103 1.00 0.00 H new ATOM 0 HD2 TYR A 406 -7.052 -1.907 5.800 1.00 0.00 H new ATOM 0 HE1 TYR A 406 -3.389 -1.787 9.080 1.00 0.00 H new ATOM 0 HE2 TYR A 406 -6.347 0.235 6.770 1.00 0.00 H new ATOM 0 HH TYR A 406 -4.979 1.276 8.157 1.00 0.00 H new ATOM 408 N HIS A 407 -5.419 -7.376 5.573 1.00 0.00 N ATOM 409 CA HIS A 407 -5.874 -8.702 5.171 1.00 0.00 C ATOM 410 C HIS A 407 -5.031 -9.239 4.018 1.00 0.00 C ATOM 411 O HIS A 407 -5.559 -9.610 2.969 1.00 0.00 O ATOM 412 CB HIS A 407 -7.347 -8.657 4.763 1.00 0.00 C ATOM 413 CG HIS A 407 -8.225 -7.969 5.763 1.00 0.00 C ATOM 414 ND1 HIS A 407 -8.836 -8.628 6.809 1.00 0.00 N ATOM 415 CD2 HIS A 407 -8.591 -6.670 5.874 1.00 0.00 C ATOM 416 CE1 HIS A 407 -9.541 -7.766 7.518 1.00 0.00 C ATOM 417 NE2 HIS A 407 -9.408 -6.570 6.972 1.00 0.00 N ATOM 0 H HIS A 407 -5.005 -7.337 6.504 1.00 0.00 H new ATOM 0 HA HIS A 407 -5.761 -9.372 6.023 1.00 0.00 H new ATOM 0 HB2 HIS A 407 -7.434 -8.147 3.804 1.00 0.00 H new ATOM 0 HB3 HIS A 407 -7.706 -9.676 4.616 1.00 0.00 H new ATOM 0 HD2 HIS A 407 -8.295 -5.863 5.220 1.00 0.00 H new ATOM 0 HE1 HIS A 407 -10.127 -7.999 8.395 1.00 0.00 H new ATOM 0 HE2 HIS A 407 -9.842 -5.712 7.312 1.00 0.00 H new ATOM 425 N LEU A 408 -3.719 -9.278 4.219 1.00 0.00 N ATOM 426 CA LEU A 408 -2.802 -9.769 3.196 1.00 0.00 C ATOM 427 C LEU A 408 -2.368 -11.200 3.496 1.00 0.00 C ATOM 428 O LEU A 408 -1.939 -11.527 4.602 1.00 0.00 O ATOM 429 CB LEU A 408 -1.574 -8.861 3.105 1.00 0.00 C ATOM 430 CG LEU A 408 -1.766 -7.549 2.343 1.00 0.00 C ATOM 431 CD1 LEU A 408 -0.591 -6.614 2.587 1.00 0.00 C ATOM 432 CD2 LEU A 408 -1.938 -7.816 0.855 1.00 0.00 C ATOM 0 H LEU A 408 -3.266 -8.976 5.081 1.00 0.00 H new ATOM 0 HA LEU A 408 -3.325 -9.760 2.240 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -1.245 -8.626 4.117 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -0.768 -9.420 2.630 1.00 0.00 H new ATOM 0 HG LEU A 408 -2.671 -7.066 2.711 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -0.745 -5.686 2.037 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -0.514 -6.396 3.652 1.00 0.00 H new ATOM 0 HD13 LEU A 408 0.329 -7.089 2.247 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -2.073 -6.871 0.329 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -1.052 -8.321 0.471 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -2.812 -8.447 0.697 1.00 0.00 H new ATOM 444 N PRO A 409 -2.480 -12.076 2.486 1.00 0.00 N ATOM 445 CA PRO A 409 -2.102 -13.487 2.616 1.00 0.00 C ATOM 446 C PRO A 409 -0.728 -13.662 3.253 1.00 0.00 C ATOM 447 O PRO A 409 -0.077 -12.686 3.626 1.00 0.00 O ATOM 448 CB PRO A 409 -2.086 -13.984 1.169 1.00 0.00 C ATOM 449 CG PRO A 409 -3.052 -13.103 0.454 1.00 0.00 C ATOM 450 CD PRO A 409 -2.983 -11.757 1.140 1.00 0.00 C ATOM 0 HA PRO A 409 -2.788 -14.035 3.262 1.00 0.00 H new ATOM 0 HB2 PRO A 409 -1.088 -13.910 0.736 1.00 0.00 H new ATOM 0 HB3 PRO A 409 -2.384 -15.031 1.107 1.00 0.00 H new ATOM 0 HG2 PRO A 409 -2.792 -13.016 -0.601 1.00 0.00 H new ATOM 0 HG3 PRO A 409 -4.061 -13.513 0.501 1.00 0.00 H new ATOM 0 HD2 PRO A 409 -2.316 -11.074 0.615 1.00 0.00 H new ATOM 0 HD3 PRO A 409 -3.961 -11.278 1.181 1.00 0.00 H new ATOM 458 N GLN A 410 -0.293 -14.912 3.377 1.00 0.00 N ATOM 459 CA GLN A 410 1.005 -15.213 3.970 1.00 0.00 C ATOM 460 C GLN A 410 2.105 -15.187 2.915 1.00 0.00 C ATOM 461 O GLN A 410 3.195 -14.668 3.155 1.00 0.00 O ATOM 462 CB GLN A 410 0.970 -16.582 4.654 1.00 0.00 C ATOM 463 CG GLN A 410 2.055 -16.765 5.702 1.00 0.00 C ATOM 464 CD GLN A 410 1.817 -15.928 6.943 1.00 0.00 C ATOM 465 OE1 GLN A 410 1.955 -14.705 6.916 1.00 0.00 O ATOM 466 NE2 GLN A 410 1.457 -16.584 8.040 1.00 0.00 N ATOM 0 H GLN A 410 -0.820 -15.732 3.075 1.00 0.00 H new ATOM 0 HA GLN A 410 1.223 -14.447 4.714 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -0.004 -16.720 5.123 1.00 0.00 H new ATOM 0 HB3 GLN A 410 1.072 -17.360 3.897 1.00 0.00 H new ATOM 0 HG2 GLN A 410 2.109 -17.817 5.983 1.00 0.00 H new ATOM 0 HG3 GLN A 410 3.020 -16.500 5.270 1.00 0.00 H new ATOM 0 HE21 GLN A 410 1.354 -17.599 8.017 1.00 0.00 H new ATOM 0 HE22 GLN A 410 1.283 -16.073 8.906 1.00 0.00 H new ATOM 475 N GLU A 411 1.813 -15.751 1.747 1.00 0.00 N ATOM 476 CA GLU A 411 2.779 -15.792 0.657 1.00 0.00 C ATOM 477 C GLU A 411 3.192 -14.384 0.242 1.00 0.00 C ATOM 478 O GLU A 411 4.348 -14.141 -0.110 1.00 0.00 O ATOM 479 CB GLU A 411 2.194 -16.539 -0.545 1.00 0.00 C ATOM 480 CG GLU A 411 0.943 -15.892 -1.112 1.00 0.00 C ATOM 481 CD GLU A 411 0.450 -16.579 -2.371 1.00 0.00 C ATOM 482 OE1 GLU A 411 1.285 -17.151 -3.100 1.00 0.00 O ATOM 483 OE2 GLU A 411 -0.772 -16.543 -2.626 1.00 0.00 O ATOM 0 H GLU A 411 0.915 -16.185 1.532 1.00 0.00 H new ATOM 0 HA GLU A 411 3.664 -16.322 1.010 1.00 0.00 H new ATOM 0 HB2 GLU A 411 2.950 -16.598 -1.328 1.00 0.00 H new ATOM 0 HB3 GLU A 411 1.962 -17.562 -0.249 1.00 0.00 H new ATOM 0 HG2 GLU A 411 0.155 -15.912 -0.359 1.00 0.00 H new ATOM 0 HG3 GLU A 411 1.148 -14.844 -1.331 1.00 0.00 H new ATOM 490 N PHE A 412 2.241 -13.457 0.284 1.00 0.00 N ATOM 491 CA PHE A 412 2.504 -12.073 -0.089 1.00 0.00 C ATOM 492 C PHE A 412 3.626 -11.484 0.762 1.00 0.00 C ATOM 493 O PHE A 412 3.597 -11.565 1.990 1.00 0.00 O ATOM 494 CB PHE A 412 1.236 -11.231 0.067 1.00 0.00 C ATOM 495 CG PHE A 412 0.391 -11.183 -1.174 1.00 0.00 C ATOM 496 CD1 PHE A 412 -0.236 -12.325 -1.644 1.00 0.00 C ATOM 497 CD2 PHE A 412 0.227 -9.997 -1.872 1.00 0.00 C ATOM 498 CE1 PHE A 412 -1.014 -12.285 -2.786 1.00 0.00 C ATOM 499 CE2 PHE A 412 -0.550 -9.950 -3.013 1.00 0.00 C ATOM 500 CZ PHE A 412 -1.171 -11.096 -3.472 1.00 0.00 C ATOM 0 H PHE A 412 1.280 -13.640 0.573 1.00 0.00 H new ATOM 0 HA PHE A 412 2.817 -12.058 -1.133 1.00 0.00 H new ATOM 0 HB2 PHE A 412 0.641 -11.634 0.887 1.00 0.00 H new ATOM 0 HB3 PHE A 412 1.516 -10.215 0.346 1.00 0.00 H new ATOM 0 HD1 PHE A 412 -0.116 -13.257 -1.112 1.00 0.00 H new ATOM 0 HD2 PHE A 412 0.712 -9.099 -1.520 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -1.499 -13.182 -3.142 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -0.672 -9.019 -3.546 1.00 0.00 H new ATOM 0 HZ PHE A 412 -1.778 -11.062 -4.365 1.00 0.00 H new ATOM 510 N GLY A 413 4.615 -10.892 0.100 1.00 0.00 N ATOM 511 CA GLY A 413 5.734 -10.299 0.809 1.00 0.00 C ATOM 512 C GLY A 413 5.815 -8.799 0.614 1.00 0.00 C ATOM 513 O GLY A 413 4.797 -8.106 0.644 1.00 0.00 O ATOM 0 H GLY A 413 4.661 -10.812 -0.916 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.644 -10.520 1.873 1.00 0.00 H new ATOM 0 HA3 GLY A 413 6.661 -10.757 0.466 1.00 0.00 H new ATOM 517 N ASP A 414 7.028 -8.295 0.416 1.00 0.00 N ATOM 518 CA ASP A 414 7.238 -6.864 0.217 1.00 0.00 C ATOM 519 C ASP A 414 7.171 -6.509 -1.265 1.00 0.00 C ATOM 520 O ASP A 414 6.343 -5.698 -1.681 1.00 0.00 O ATOM 521 CB ASP A 414 8.588 -6.441 0.795 1.00 0.00 C ATOM 522 CG ASP A 414 8.814 -6.983 2.193 1.00 0.00 C ATOM 523 OD1 ASP A 414 7.989 -6.692 3.084 1.00 0.00 O ATOM 524 OD2 ASP A 414 9.817 -7.698 2.396 1.00 0.00 O ATOM 0 H ASP A 414 7.880 -8.854 0.389 1.00 0.00 H new ATOM 0 HA ASP A 414 6.445 -6.327 0.738 1.00 0.00 H new ATOM 0 HB2 ASP A 414 9.386 -6.790 0.140 1.00 0.00 H new ATOM 0 HB3 ASP A 414 8.646 -5.353 0.816 1.00 0.00 H new ATOM 529 N GLN A 415 8.049 -7.117 -2.056 1.00 0.00 N ATOM 530 CA GLN A 415 8.092 -6.861 -3.491 1.00 0.00 C ATOM 531 C GLN A 415 6.708 -7.021 -4.112 1.00 0.00 C ATOM 532 O GLN A 415 6.216 -6.124 -4.797 1.00 0.00 O ATOM 533 CB GLN A 415 9.082 -7.808 -4.171 1.00 0.00 C ATOM 534 CG GLN A 415 10.520 -7.610 -3.720 1.00 0.00 C ATOM 535 CD GLN A 415 11.524 -7.960 -4.801 1.00 0.00 C ATOM 536 OE1 GLN A 415 11.567 -9.094 -5.280 1.00 0.00 O ATOM 537 NE2 GLN A 415 12.338 -6.986 -5.190 1.00 0.00 N ATOM 0 H GLN A 415 8.741 -7.791 -1.727 1.00 0.00 H new ATOM 0 HA GLN A 415 8.423 -5.833 -3.642 1.00 0.00 H new ATOM 0 HB2 GLN A 415 8.785 -8.837 -3.969 1.00 0.00 H new ATOM 0 HB3 GLN A 415 9.025 -7.666 -5.250 1.00 0.00 H new ATOM 0 HG2 GLN A 415 10.663 -6.572 -3.419 1.00 0.00 H new ATOM 0 HG3 GLN A 415 10.709 -8.226 -2.841 1.00 0.00 H new ATOM 0 HE21 GLN A 415 12.266 -6.061 -4.765 1.00 0.00 H new ATOM 0 HE22 GLN A 415 13.035 -7.162 -5.914 1.00 0.00 H new ATOM 546 N ASP A 416 6.085 -8.170 -3.870 1.00 0.00 N ATOM 547 CA ASP A 416 4.759 -8.448 -4.406 1.00 0.00 C ATOM 548 C ASP A 416 3.855 -7.225 -4.281 1.00 0.00 C ATOM 549 O ASP A 416 3.384 -6.683 -5.282 1.00 0.00 O ATOM 550 CB ASP A 416 4.130 -9.638 -3.679 1.00 0.00 C ATOM 551 CG ASP A 416 5.003 -10.876 -3.730 1.00 0.00 C ATOM 552 OD1 ASP A 416 5.212 -11.408 -4.841 1.00 0.00 O ATOM 553 OD2 ASP A 416 5.479 -11.313 -2.661 1.00 0.00 O ATOM 0 H ASP A 416 6.478 -8.923 -3.306 1.00 0.00 H new ATOM 0 HA ASP A 416 4.866 -8.693 -5.463 1.00 0.00 H new ATOM 0 HB2 ASP A 416 3.947 -9.369 -2.639 1.00 0.00 H new ATOM 0 HB3 ASP A 416 3.161 -9.862 -4.125 1.00 0.00 H new ATOM 558 N LEU A 417 3.616 -6.796 -3.047 1.00 0.00 N ATOM 559 CA LEU A 417 2.768 -5.636 -2.791 1.00 0.00 C ATOM 560 C LEU A 417 3.067 -4.514 -3.779 1.00 0.00 C ATOM 561 O LEU A 417 2.159 -3.956 -4.396 1.00 0.00 O ATOM 562 CB LEU A 417 2.971 -5.138 -1.359 1.00 0.00 C ATOM 563 CG LEU A 417 2.029 -4.026 -0.896 1.00 0.00 C ATOM 564 CD1 LEU A 417 0.606 -4.548 -0.772 1.00 0.00 C ATOM 565 CD2 LEU A 417 2.502 -3.444 0.428 1.00 0.00 C ATOM 0 H LEU A 417 3.997 -7.233 -2.208 1.00 0.00 H new ATOM 0 HA LEU A 417 1.729 -5.940 -2.920 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.861 -5.985 -0.682 1.00 0.00 H new ATOM 0 HB3 LEU A 417 3.997 -4.782 -1.261 1.00 0.00 H new ATOM 0 HG LEU A 417 2.039 -3.233 -1.644 1.00 0.00 H new ATOM 0 HD11 LEU A 417 -0.050 -3.742 -0.441 1.00 0.00 H new ATOM 0 HD12 LEU A 417 0.268 -4.917 -1.740 1.00 0.00 H new ATOM 0 HD13 LEU A 417 0.578 -5.360 -0.045 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.820 -2.654 0.743 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.522 -4.229 1.184 1.00 0.00 H new ATOM 0 HD23 LEU A 417 3.504 -3.032 0.307 1.00 0.00 H new ATOM 577 N LEU A 418 4.347 -4.187 -3.926 1.00 0.00 N ATOM 578 CA LEU A 418 4.767 -3.133 -4.841 1.00 0.00 C ATOM 579 C LEU A 418 4.251 -3.398 -6.252 1.00 0.00 C ATOM 580 O LEU A 418 3.525 -2.584 -6.821 1.00 0.00 O ATOM 581 CB LEU A 418 6.293 -3.020 -4.857 1.00 0.00 C ATOM 582 CG LEU A 418 6.881 -1.985 -5.816 1.00 0.00 C ATOM 583 CD1 LEU A 418 6.318 -0.604 -5.522 1.00 0.00 C ATOM 584 CD2 LEU A 418 8.399 -1.975 -5.725 1.00 0.00 C ATOM 0 H LEU A 418 5.111 -4.637 -3.423 1.00 0.00 H new ATOM 0 HA LEU A 418 4.343 -2.192 -4.489 1.00 0.00 H new ATOM 0 HB2 LEU A 418 6.630 -2.783 -3.848 1.00 0.00 H new ATOM 0 HB3 LEU A 418 6.707 -3.996 -5.110 1.00 0.00 H new ATOM 0 HG LEU A 418 6.600 -2.260 -6.833 1.00 0.00 H new ATOM 0 HD11 LEU A 418 6.748 0.119 -6.215 1.00 0.00 H new ATOM 0 HD12 LEU A 418 5.235 -0.620 -5.641 1.00 0.00 H new ATOM 0 HD13 LEU A 418 6.567 -0.320 -4.500 1.00 0.00 H new ATOM 0 HD21 LEU A 418 8.800 -1.232 -6.415 1.00 0.00 H new ATOM 0 HD22 LEU A 418 8.701 -1.726 -4.708 1.00 0.00 H new ATOM 0 HD23 LEU A 418 8.786 -2.960 -5.987 1.00 0.00 H new ATOM 596 N GLN A 419 4.630 -4.544 -6.809 1.00 0.00 N ATOM 597 CA GLN A 419 4.204 -4.917 -8.153 1.00 0.00 C ATOM 598 C GLN A 419 2.683 -4.951 -8.252 1.00 0.00 C ATOM 599 O GLN A 419 2.120 -4.855 -9.343 1.00 0.00 O ATOM 600 CB GLN A 419 4.783 -6.282 -8.532 1.00 0.00 C ATOM 601 CG GLN A 419 6.274 -6.251 -8.824 1.00 0.00 C ATOM 602 CD GLN A 419 7.070 -5.583 -7.721 1.00 0.00 C ATOM 603 OE1 GLN A 419 6.977 -4.372 -7.518 1.00 0.00 O ATOM 604 NE2 GLN A 419 7.858 -6.370 -6.998 1.00 0.00 N ATOM 0 H GLN A 419 5.231 -5.230 -6.351 1.00 0.00 H new ATOM 0 HA GLN A 419 4.578 -4.165 -8.848 1.00 0.00 H new ATOM 0 HB2 GLN A 419 4.595 -6.985 -7.721 1.00 0.00 H new ATOM 0 HB3 GLN A 419 4.257 -6.659 -9.409 1.00 0.00 H new ATOM 0 HG2 GLN A 419 6.635 -7.270 -8.961 1.00 0.00 H new ATOM 0 HG3 GLN A 419 6.446 -5.723 -9.762 1.00 0.00 H new ATOM 0 HE21 GLN A 419 7.905 -7.369 -7.200 1.00 0.00 H new ATOM 0 HE22 GLN A 419 8.416 -5.976 -6.241 1.00 0.00 H new ATOM 613 N MET A 420 2.023 -5.088 -7.107 1.00 0.00 N ATOM 614 CA MET A 420 0.566 -5.134 -7.066 1.00 0.00 C ATOM 615 C MET A 420 -0.023 -3.727 -7.098 1.00 0.00 C ATOM 616 O MET A 420 -1.129 -3.518 -7.598 1.00 0.00 O ATOM 617 CB MET A 420 0.093 -5.869 -5.810 1.00 0.00 C ATOM 618 CG MET A 420 -1.411 -5.804 -5.598 1.00 0.00 C ATOM 619 SD MET A 420 -1.907 -6.366 -3.959 1.00 0.00 S ATOM 620 CE MET A 420 -2.893 -7.801 -4.377 1.00 0.00 C ATOM 0 H MET A 420 2.474 -5.169 -6.196 1.00 0.00 H new ATOM 0 HA MET A 420 0.219 -5.674 -7.947 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.398 -6.914 -5.874 1.00 0.00 H new ATOM 0 HB3 MET A 420 0.593 -5.444 -4.940 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.750 -4.779 -5.744 1.00 0.00 H new ATOM 0 HG3 MET A 420 -1.907 -6.415 -6.353 1.00 0.00 H new ATOM 0 HE1 MET A 420 -3.258 -8.271 -3.463 1.00 0.00 H new ATOM 0 HE2 MET A 420 -3.740 -7.494 -4.990 1.00 0.00 H new ATOM 0 HE3 MET A 420 -2.282 -8.513 -4.932 1.00 0.00 H new ATOM 630 N PHE A 421 0.723 -2.766 -6.564 1.00 0.00 N ATOM 631 CA PHE A 421 0.273 -1.379 -6.532 1.00 0.00 C ATOM 632 C PHE A 421 1.044 -0.534 -7.543 1.00 0.00 C ATOM 633 O PHE A 421 0.867 0.682 -7.615 1.00 0.00 O ATOM 634 CB PHE A 421 0.446 -0.797 -5.127 1.00 0.00 C ATOM 635 CG PHE A 421 -0.644 -1.197 -4.175 1.00 0.00 C ATOM 636 CD1 PHE A 421 -1.050 -2.518 -4.081 1.00 0.00 C ATOM 637 CD2 PHE A 421 -1.263 -0.252 -3.374 1.00 0.00 C ATOM 638 CE1 PHE A 421 -2.054 -2.890 -3.206 1.00 0.00 C ATOM 639 CE2 PHE A 421 -2.266 -0.617 -2.496 1.00 0.00 C ATOM 640 CZ PHE A 421 -2.663 -1.937 -2.413 1.00 0.00 C ATOM 0 H PHE A 421 1.641 -2.922 -6.148 1.00 0.00 H new ATOM 0 HA PHE A 421 -0.784 -1.359 -6.799 1.00 0.00 H new ATOM 0 HB2 PHE A 421 1.406 -1.120 -4.724 1.00 0.00 H new ATOM 0 HB3 PHE A 421 0.478 0.290 -5.194 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -0.577 -3.267 -4.699 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -0.958 0.782 -3.436 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -2.361 -3.923 -3.143 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -2.739 0.130 -1.875 1.00 0.00 H new ATOM 0 HZ PHE A 421 -3.448 -2.224 -1.729 1.00 0.00 H new ATOM 650 N MET A 422 1.900 -1.188 -8.321 1.00 0.00 N ATOM 651 CA MET A 422 2.696 -0.497 -9.329 1.00 0.00 C ATOM 652 C MET A 422 1.832 -0.081 -10.515 1.00 0.00 C ATOM 653 O MET A 422 1.910 1.045 -11.006 1.00 0.00 O ATOM 654 CB MET A 422 3.841 -1.393 -9.807 1.00 0.00 C ATOM 655 CG MET A 422 5.135 -1.186 -9.036 1.00 0.00 C ATOM 656 SD MET A 422 6.459 -2.274 -9.600 1.00 0.00 S ATOM 657 CE MET A 422 7.893 -1.437 -8.928 1.00 0.00 C ATOM 0 H MET A 422 2.060 -2.194 -8.273 1.00 0.00 H new ATOM 0 HA MET A 422 3.112 0.402 -8.873 1.00 0.00 H new ATOM 0 HB2 MET A 422 3.537 -2.436 -9.718 1.00 0.00 H new ATOM 0 HB3 MET A 422 4.023 -1.203 -10.865 1.00 0.00 H new ATOM 0 HG2 MET A 422 5.453 -0.149 -9.139 1.00 0.00 H new ATOM 0 HG3 MET A 422 4.954 -1.360 -7.975 1.00 0.00 H new ATOM 0 HE1 MET A 422 8.443 -0.952 -9.735 1.00 0.00 H new ATOM 0 HE2 MET A 422 7.571 -0.686 -8.206 1.00 0.00 H new ATOM 0 HE3 MET A 422 8.539 -2.162 -8.433 1.00 0.00 H new ATOM 667 N PRO A 423 0.988 -1.010 -10.988 1.00 0.00 N ATOM 668 CA PRO A 423 0.093 -0.762 -12.122 1.00 0.00 C ATOM 669 C PRO A 423 -0.666 0.553 -11.985 1.00 0.00 C ATOM 670 O PRO A 423 -0.758 1.330 -12.935 1.00 0.00 O ATOM 671 CB PRO A 423 -0.876 -1.947 -12.074 1.00 0.00 C ATOM 672 CG PRO A 423 -0.113 -3.034 -11.398 1.00 0.00 C ATOM 673 CD PRO A 423 0.843 -2.374 -10.452 1.00 0.00 C ATOM 0 HA PRO A 423 0.639 -0.678 -13.062 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -1.781 -1.696 -11.521 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -1.187 -2.245 -13.075 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -0.787 -3.702 -10.862 1.00 0.00 H new ATOM 0 HG3 PRO A 423 0.423 -3.640 -12.128 1.00 0.00 H new ATOM 0 HD2 PRO A 423 0.454 -2.364 -9.434 1.00 0.00 H new ATOM 0 HD3 PRO A 423 1.800 -2.895 -10.423 1.00 0.00 H new ATOM 681 N PHE A 424 -1.209 0.796 -10.797 1.00 0.00 N ATOM 682 CA PHE A 424 -1.961 2.018 -10.535 1.00 0.00 C ATOM 683 C PHE A 424 -1.078 3.249 -10.712 1.00 0.00 C ATOM 684 O PHE A 424 -1.567 4.342 -10.997 1.00 0.00 O ATOM 685 CB PHE A 424 -2.541 1.992 -9.119 1.00 0.00 C ATOM 686 CG PHE A 424 -3.676 1.023 -8.954 1.00 0.00 C ATOM 687 CD1 PHE A 424 -4.976 1.404 -9.244 1.00 0.00 C ATOM 688 CD2 PHE A 424 -3.445 -0.267 -8.506 1.00 0.00 C ATOM 689 CE1 PHE A 424 -6.025 0.515 -9.094 1.00 0.00 C ATOM 690 CE2 PHE A 424 -4.488 -1.161 -8.354 1.00 0.00 C ATOM 691 CZ PHE A 424 -5.780 -0.768 -8.647 1.00 0.00 C ATOM 0 H PHE A 424 -1.142 0.163 -10.000 1.00 0.00 H new ATOM 0 HA PHE A 424 -2.778 2.073 -11.254 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -1.749 1.735 -8.415 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -2.887 2.992 -8.858 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -5.173 2.407 -9.591 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -2.437 -0.578 -8.273 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -7.034 0.824 -9.326 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -4.294 -2.165 -8.007 1.00 0.00 H new ATOM 0 HZ PHE A 424 -6.597 -1.464 -8.526 1.00 0.00 H new ATOM 701 N GLY A 425 0.227 3.063 -10.543 1.00 0.00 N ATOM 702 CA GLY A 425 1.159 4.167 -10.688 1.00 0.00 C ATOM 703 C GLY A 425 2.488 3.896 -10.011 1.00 0.00 C ATOM 704 O GLY A 425 2.703 2.817 -9.460 1.00 0.00 O ATOM 0 H GLY A 425 0.656 2.168 -10.308 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.327 4.360 -11.748 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.717 5.070 -10.266 1.00 0.00 H new ATOM 708 N ASN A 426 3.383 4.878 -10.054 1.00 0.00 N ATOM 709 CA ASN A 426 4.700 4.739 -9.441 1.00 0.00 C ATOM 710 C ASN A 426 4.603 4.820 -7.920 1.00 0.00 C ATOM 711 O ASN A 426 4.510 5.907 -7.350 1.00 0.00 O ATOM 712 CB ASN A 426 5.644 5.824 -9.962 1.00 0.00 C ATOM 713 CG ASN A 426 5.606 5.946 -11.473 1.00 0.00 C ATOM 714 OD1 ASN A 426 4.536 5.931 -12.081 1.00 0.00 O ATOM 715 ND2 ASN A 426 6.778 6.070 -12.086 1.00 0.00 N ATOM 0 H ASN A 426 3.221 5.778 -10.506 1.00 0.00 H new ATOM 0 HA ASN A 426 5.098 3.761 -9.710 1.00 0.00 H new ATOM 0 HB2 ASN A 426 5.374 6.781 -9.516 1.00 0.00 H new ATOM 0 HB3 ASN A 426 6.662 5.600 -9.644 1.00 0.00 H new ATOM 0 HD21 ASN A 426 6.816 6.158 -13.102 1.00 0.00 H new ATOM 0 HD22 ASN A 426 7.640 6.077 -11.541 1.00 0.00 H new ATOM 722 N VAL A 427 4.626 3.661 -7.270 1.00 0.00 N ATOM 723 CA VAL A 427 4.543 3.601 -5.815 1.00 0.00 C ATOM 724 C VAL A 427 5.786 4.202 -5.168 1.00 0.00 C ATOM 725 O VAL A 427 6.908 3.767 -5.428 1.00 0.00 O ATOM 726 CB VAL A 427 4.373 2.151 -5.323 1.00 0.00 C ATOM 727 CG1 VAL A 427 4.532 2.077 -3.812 1.00 0.00 C ATOM 728 CG2 VAL A 427 3.022 1.599 -5.752 1.00 0.00 C ATOM 0 H VAL A 427 4.701 2.752 -7.727 1.00 0.00 H new ATOM 0 HA VAL A 427 3.668 4.182 -5.523 1.00 0.00 H new ATOM 0 HB VAL A 427 5.152 1.538 -5.777 1.00 0.00 H new ATOM 0 HG11 VAL A 427 4.409 1.045 -3.483 1.00 0.00 H new ATOM 0 HG12 VAL A 427 5.525 2.431 -3.533 1.00 0.00 H new ATOM 0 HG13 VAL A 427 3.777 2.702 -3.336 1.00 0.00 H new ATOM 0 HG21 VAL A 427 2.918 0.574 -5.396 1.00 0.00 H new ATOM 0 HG22 VAL A 427 2.227 2.212 -5.328 1.00 0.00 H new ATOM 0 HG23 VAL A 427 2.951 1.615 -6.840 1.00 0.00 H new ATOM 738 N VAL A 428 5.579 5.206 -4.322 1.00 0.00 N ATOM 739 CA VAL A 428 6.682 5.868 -3.635 1.00 0.00 C ATOM 740 C VAL A 428 7.224 5.001 -2.505 1.00 0.00 C ATOM 741 O VAL A 428 8.427 4.985 -2.243 1.00 0.00 O ATOM 742 CB VAL A 428 6.249 7.230 -3.061 1.00 0.00 C ATOM 743 CG1 VAL A 428 7.350 7.816 -2.190 1.00 0.00 C ATOM 744 CG2 VAL A 428 5.879 8.188 -4.183 1.00 0.00 C ATOM 0 H VAL A 428 4.657 5.579 -4.096 1.00 0.00 H new ATOM 0 HA VAL A 428 7.466 6.027 -4.375 1.00 0.00 H new ATOM 0 HB VAL A 428 5.367 7.079 -2.438 1.00 0.00 H new ATOM 0 HG11 VAL A 428 7.027 8.778 -1.793 1.00 0.00 H new ATOM 0 HG12 VAL A 428 7.562 7.136 -1.365 1.00 0.00 H new ATOM 0 HG13 VAL A 428 8.251 7.954 -2.787 1.00 0.00 H new ATOM 0 HG21 VAL A 428 5.576 9.145 -3.759 1.00 0.00 H new ATOM 0 HG22 VAL A 428 6.741 8.336 -4.834 1.00 0.00 H new ATOM 0 HG23 VAL A 428 5.055 7.770 -4.761 1.00 0.00 H new ATOM 754 N SER A 429 6.328 4.281 -1.837 1.00 0.00 N ATOM 755 CA SER A 429 6.717 3.414 -0.731 1.00 0.00 C ATOM 756 C SER A 429 5.858 2.153 -0.702 1.00 0.00 C ATOM 757 O SER A 429 4.667 2.194 -1.007 1.00 0.00 O ATOM 758 CB SER A 429 6.591 4.160 0.599 1.00 0.00 C ATOM 759 OG SER A 429 6.888 5.536 0.441 1.00 0.00 O ATOM 0 H SER A 429 5.329 4.281 -2.042 1.00 0.00 H new ATOM 0 HA SER A 429 7.757 3.122 -0.879 1.00 0.00 H new ATOM 0 HB2 SER A 429 5.580 4.045 0.990 1.00 0.00 H new ATOM 0 HB3 SER A 429 7.268 3.720 1.332 1.00 0.00 H new ATOM 0 HG SER A 429 6.452 6.049 1.153 1.00 0.00 H new ATOM 765 N ALA A 430 6.472 1.034 -0.333 1.00 0.00 N ATOM 766 CA ALA A 430 5.764 -0.238 -0.262 1.00 0.00 C ATOM 767 C ALA A 430 6.522 -1.240 0.604 1.00 0.00 C ATOM 768 O ALA A 430 7.627 -1.662 0.262 1.00 0.00 O ATOM 769 CB ALA A 430 5.551 -0.801 -1.658 1.00 0.00 C ATOM 0 H ALA A 430 7.458 0.982 -0.079 1.00 0.00 H new ATOM 0 HA ALA A 430 4.792 -0.060 0.199 1.00 0.00 H new ATOM 0 HB1 ALA A 430 5.021 -1.751 -1.590 1.00 0.00 H new ATOM 0 HB2 ALA A 430 4.962 -0.098 -2.248 1.00 0.00 H new ATOM 0 HB3 ALA A 430 6.517 -0.958 -2.138 1.00 0.00 H new ATOM 775 N LYS A 431 5.920 -1.618 1.727 1.00 0.00 N ATOM 776 CA LYS A 431 6.537 -2.570 2.643 1.00 0.00 C ATOM 777 C LYS A 431 5.495 -3.184 3.572 1.00 0.00 C ATOM 778 O LYS A 431 4.576 -2.502 4.026 1.00 0.00 O ATOM 779 CB LYS A 431 7.629 -1.883 3.466 1.00 0.00 C ATOM 780 CG LYS A 431 8.176 -2.747 4.590 1.00 0.00 C ATOM 781 CD LYS A 431 7.393 -2.547 5.878 1.00 0.00 C ATOM 782 CE LYS A 431 7.833 -1.288 6.608 1.00 0.00 C ATOM 783 NZ LYS A 431 9.225 -1.401 7.122 1.00 0.00 N ATOM 0 H LYS A 431 5.005 -1.279 2.025 1.00 0.00 H new ATOM 0 HA LYS A 431 6.985 -3.368 2.051 1.00 0.00 H new ATOM 0 HB2 LYS A 431 8.448 -1.601 2.804 1.00 0.00 H new ATOM 0 HB3 LYS A 431 7.229 -0.962 3.889 1.00 0.00 H new ATOM 0 HG2 LYS A 431 8.135 -3.796 4.297 1.00 0.00 H new ATOM 0 HG3 LYS A 431 9.225 -2.504 4.759 1.00 0.00 H new ATOM 0 HD2 LYS A 431 6.329 -2.484 5.652 1.00 0.00 H new ATOM 0 HD3 LYS A 431 7.531 -3.412 6.527 1.00 0.00 H new ATOM 0 HE2 LYS A 431 7.763 -0.435 5.934 1.00 0.00 H new ATOM 0 HE3 LYS A 431 7.154 -1.094 7.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 9.368 -0.715 7.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 9.385 -2.363 7.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 9.896 -1.204 6.352 1.00 0.00 H new ATOM 797 N VAL A 432 5.645 -4.474 3.851 1.00 0.00 N ATOM 798 CA VAL A 432 4.719 -5.179 4.729 1.00 0.00 C ATOM 799 C VAL A 432 5.186 -5.126 6.179 1.00 0.00 C ATOM 800 O VAL A 432 6.377 -5.257 6.465 1.00 0.00 O ATOM 801 CB VAL A 432 4.556 -6.652 4.309 1.00 0.00 C ATOM 802 CG1 VAL A 432 3.573 -7.364 5.224 1.00 0.00 C ATOM 803 CG2 VAL A 432 4.109 -6.744 2.857 1.00 0.00 C ATOM 0 H VAL A 432 6.399 -5.053 3.482 1.00 0.00 H new ATOM 0 HA VAL A 432 3.757 -4.675 4.641 1.00 0.00 H new ATOM 0 HB VAL A 432 5.523 -7.147 4.401 1.00 0.00 H new ATOM 0 HG11 VAL A 432 3.472 -8.403 4.911 1.00 0.00 H new ATOM 0 HG12 VAL A 432 3.939 -7.328 6.250 1.00 0.00 H new ATOM 0 HG13 VAL A 432 2.602 -6.872 5.168 1.00 0.00 H new ATOM 0 HG21 VAL A 432 3.999 -7.791 2.576 1.00 0.00 H new ATOM 0 HG22 VAL A 432 3.153 -6.233 2.737 1.00 0.00 H new ATOM 0 HG23 VAL A 432 4.855 -6.273 2.216 1.00 0.00 H new ATOM 813 N PHE A 433 4.241 -4.933 7.094 1.00 0.00 N ATOM 814 CA PHE A 433 4.556 -4.862 8.516 1.00 0.00 C ATOM 815 C PHE A 433 4.676 -6.258 9.117 1.00 0.00 C ATOM 816 O PHE A 433 4.072 -7.212 8.625 1.00 0.00 O ATOM 817 CB PHE A 433 3.481 -4.065 9.259 1.00 0.00 C ATOM 818 CG PHE A 433 3.629 -2.578 9.112 1.00 0.00 C ATOM 819 CD1 PHE A 433 4.165 -2.031 7.958 1.00 0.00 C ATOM 820 CD2 PHE A 433 3.233 -1.725 10.131 1.00 0.00 C ATOM 821 CE1 PHE A 433 4.302 -0.662 7.820 1.00 0.00 C ATOM 822 CE2 PHE A 433 3.368 -0.356 9.999 1.00 0.00 C ATOM 823 CZ PHE A 433 3.904 0.176 8.843 1.00 0.00 C ATOM 0 H PHE A 433 3.251 -4.823 6.876 1.00 0.00 H new ATOM 0 HA PHE A 433 5.515 -4.355 8.625 1.00 0.00 H new ATOM 0 HB2 PHE A 433 2.499 -4.363 8.890 1.00 0.00 H new ATOM 0 HB3 PHE A 433 3.515 -4.323 10.318 1.00 0.00 H new ATOM 0 HD1 PHE A 433 4.480 -2.682 7.156 1.00 0.00 H new ATOM 0 HD2 PHE A 433 2.814 -2.135 11.038 1.00 0.00 H new ATOM 0 HE1 PHE A 433 4.720 -0.249 6.914 1.00 0.00 H new ATOM 0 HE2 PHE A 433 3.054 0.297 10.800 1.00 0.00 H new ATOM 0 HZ PHE A 433 4.012 1.246 8.739 1.00 0.00 H new ATOM 983 N CYS A 443 -0.628 -9.372 8.366 1.00 0.00 N ATOM 984 CA CYS A 443 -1.586 -9.431 7.268 1.00 0.00 C ATOM 985 C CYS A 443 -1.950 -8.030 6.787 1.00 0.00 C ATOM 986 O CYS A 443 -3.087 -7.775 6.392 1.00 0.00 O ATOM 987 CB CYS A 443 -2.848 -10.177 7.705 1.00 0.00 C ATOM 988 SG CYS A 443 -3.708 -9.419 9.103 1.00 0.00 S ATOM 0 HA CYS A 443 -1.121 -9.969 6.442 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -3.533 -10.236 6.859 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -2.579 -11.200 7.969 1.00 0.00 H new ATOM 0 HG CYS A 443 -4.762 -10.121 9.396 1.00 0.00 H new ATOM 994 N PHE A 444 -0.976 -7.126 6.823 1.00 0.00 N ATOM 995 CA PHE A 444 -1.194 -5.750 6.394 1.00 0.00 C ATOM 996 C PHE A 444 0.134 -5.051 6.114 1.00 0.00 C ATOM 997 O PHE A 444 1.141 -5.328 6.762 1.00 0.00 O ATOM 998 CB PHE A 444 -1.976 -4.979 7.458 1.00 0.00 C ATOM 999 CG PHE A 444 -1.123 -4.503 8.600 1.00 0.00 C ATOM 1000 CD1 PHE A 444 -0.362 -3.351 8.480 1.00 0.00 C ATOM 1001 CD2 PHE A 444 -1.083 -5.206 9.793 1.00 0.00 C ATOM 1002 CE1 PHE A 444 0.423 -2.911 9.530 1.00 0.00 C ATOM 1003 CE2 PHE A 444 -0.300 -4.772 10.845 1.00 0.00 C ATOM 1004 CZ PHE A 444 0.454 -3.621 10.713 1.00 0.00 C ATOM 0 H PHE A 444 -0.028 -7.322 7.145 1.00 0.00 H new ATOM 0 HA PHE A 444 -1.775 -5.771 5.472 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -2.458 -4.120 6.992 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -2.769 -5.617 7.848 1.00 0.00 H new ATOM 0 HD1 PHE A 444 -0.382 -2.791 7.557 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -1.672 -6.105 9.902 1.00 0.00 H new ATOM 0 HE1 PHE A 444 1.012 -2.012 9.424 1.00 0.00 H new ATOM 0 HE2 PHE A 444 -0.277 -5.331 11.769 1.00 0.00 H new ATOM 0 HZ PHE A 444 1.066 -3.278 11.534 1.00 0.00 H new ATOM 1014 N GLY A 445 0.125 -4.143 5.143 1.00 0.00 N ATOM 1015 CA GLY A 445 1.332 -3.419 4.793 1.00 0.00 C ATOM 1016 C GLY A 445 1.085 -1.935 4.604 1.00 0.00 C ATOM 1017 O GLY A 445 -0.048 -1.467 4.727 1.00 0.00 O ATOM 0 H GLY A 445 -0.697 -3.896 4.592 1.00 0.00 H new ATOM 0 HA2 GLY A 445 2.078 -3.563 5.575 1.00 0.00 H new ATOM 0 HA3 GLY A 445 1.748 -3.835 3.875 1.00 0.00 H new ATOM 1021 N PHE A 446 2.146 -1.193 4.307 1.00 0.00 N ATOM 1022 CA PHE A 446 2.039 0.247 4.104 1.00 0.00 C ATOM 1023 C PHE A 446 2.430 0.626 2.678 1.00 0.00 C ATOM 1024 O PHE A 446 3.190 -0.086 2.021 1.00 0.00 O ATOM 1025 CB PHE A 446 2.927 0.991 5.103 1.00 0.00 C ATOM 1026 CG PHE A 446 3.014 2.468 4.842 1.00 0.00 C ATOM 1027 CD1 PHE A 446 1.866 3.241 4.766 1.00 0.00 C ATOM 1028 CD2 PHE A 446 4.243 3.084 4.674 1.00 0.00 C ATOM 1029 CE1 PHE A 446 1.943 4.600 4.527 1.00 0.00 C ATOM 1030 CE2 PHE A 446 4.327 4.443 4.435 1.00 0.00 C ATOM 1031 CZ PHE A 446 3.176 5.202 4.362 1.00 0.00 C ATOM 0 H PHE A 446 3.090 -1.565 4.201 1.00 0.00 H new ATOM 0 HA PHE A 446 1.000 0.536 4.266 1.00 0.00 H new ATOM 0 HB2 PHE A 446 2.542 0.830 6.110 1.00 0.00 H new ATOM 0 HB3 PHE A 446 3.930 0.565 5.073 1.00 0.00 H new ATOM 0 HD1 PHE A 446 0.900 2.776 4.895 1.00 0.00 H new ATOM 0 HD2 PHE A 446 5.147 2.495 4.730 1.00 0.00 H new ATOM 0 HE1 PHE A 446 1.041 5.191 4.469 1.00 0.00 H new ATOM 0 HE2 PHE A 446 5.292 4.910 4.306 1.00 0.00 H new ATOM 0 HZ PHE A 446 3.239 6.264 4.176 1.00 0.00 H new ATOM 1041 N VAL A 447 1.903 1.751 2.206 1.00 0.00 N ATOM 1042 CA VAL A 447 2.197 2.225 0.859 1.00 0.00 C ATOM 1043 C VAL A 447 1.935 3.722 0.734 1.00 0.00 C ATOM 1044 O VAL A 447 1.147 4.290 1.490 1.00 0.00 O ATOM 1045 CB VAL A 447 1.356 1.479 -0.195 1.00 0.00 C ATOM 1046 CG1 VAL A 447 1.563 2.089 -1.573 1.00 0.00 C ATOM 1047 CG2 VAL A 447 1.703 -0.001 -0.201 1.00 0.00 C ATOM 0 H VAL A 447 1.271 2.351 2.736 1.00 0.00 H new ATOM 0 HA VAL A 447 3.253 2.027 0.677 1.00 0.00 H new ATOM 0 HB VAL A 447 0.303 1.581 0.066 1.00 0.00 H new ATOM 0 HG11 VAL A 447 0.961 1.549 -2.304 1.00 0.00 H new ATOM 0 HG12 VAL A 447 1.261 3.136 -1.556 1.00 0.00 H new ATOM 0 HG13 VAL A 447 2.616 2.019 -1.847 1.00 0.00 H new ATOM 0 HG21 VAL A 447 1.100 -0.513 -0.951 1.00 0.00 H new ATOM 0 HG22 VAL A 447 2.760 -0.126 -0.438 1.00 0.00 H new ATOM 0 HG23 VAL A 447 1.498 -0.427 0.781 1.00 0.00 H new ATOM 1057 N SER A 448 2.601 4.356 -0.227 1.00 0.00 N ATOM 1058 CA SER A 448 2.444 5.788 -0.448 1.00 0.00 C ATOM 1059 C SER A 448 2.765 6.152 -1.894 1.00 0.00 C ATOM 1060 O SER A 448 3.528 5.457 -2.567 1.00 0.00 O ATOM 1061 CB SER A 448 3.349 6.576 0.502 1.00 0.00 C ATOM 1062 OG SER A 448 2.740 6.736 1.771 1.00 0.00 O ATOM 0 H SER A 448 3.254 3.900 -0.864 1.00 0.00 H new ATOM 0 HA SER A 448 1.405 6.050 -0.247 1.00 0.00 H new ATOM 0 HB2 SER A 448 4.301 6.058 0.615 1.00 0.00 H new ATOM 0 HB3 SER A 448 3.567 7.554 0.074 1.00 0.00 H new ATOM 0 HG SER A 448 3.070 6.045 2.382 1.00 0.00 H new ATOM 1068 N TYR A 449 2.179 7.247 -2.366 1.00 0.00 N ATOM 1069 CA TYR A 449 2.400 7.703 -3.733 1.00 0.00 C ATOM 1070 C TYR A 449 3.042 9.088 -3.748 1.00 0.00 C ATOM 1071 O TYR A 449 3.384 9.637 -2.701 1.00 0.00 O ATOM 1072 CB TYR A 449 1.079 7.733 -4.503 1.00 0.00 C ATOM 1073 CG TYR A 449 0.646 6.377 -5.015 1.00 0.00 C ATOM 1074 CD1 TYR A 449 0.630 5.270 -4.176 1.00 0.00 C ATOM 1075 CD2 TYR A 449 0.255 6.204 -6.337 1.00 0.00 C ATOM 1076 CE1 TYR A 449 0.236 4.029 -4.640 1.00 0.00 C ATOM 1077 CE2 TYR A 449 -0.142 4.968 -6.809 1.00 0.00 C ATOM 1078 CZ TYR A 449 -0.150 3.884 -5.957 1.00 0.00 C ATOM 1079 OH TYR A 449 -0.544 2.650 -6.422 1.00 0.00 O ATOM 0 H TYR A 449 1.548 7.835 -1.822 1.00 0.00 H new ATOM 0 HA TYR A 449 3.079 7.002 -4.218 1.00 0.00 H new ATOM 0 HB2 TYR A 449 0.299 8.133 -3.855 1.00 0.00 H new ATOM 0 HB3 TYR A 449 1.175 8.417 -5.346 1.00 0.00 H new ATOM 0 HD1 TYR A 449 0.930 5.381 -3.145 1.00 0.00 H new ATOM 0 HD2 TYR A 449 0.262 7.051 -7.007 1.00 0.00 H new ATOM 0 HE1 TYR A 449 0.230 3.178 -3.976 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -0.444 4.851 -7.839 1.00 0.00 H new ATOM 0 HH TYR A 449 0.225 2.189 -6.817 1.00 0.00 H new ATOM 1089 N ASP A 450 3.200 9.646 -4.944 1.00 0.00 N ATOM 1090 CA ASP A 450 3.799 10.967 -5.097 1.00 0.00 C ATOM 1091 C ASP A 450 2.772 12.063 -4.832 1.00 0.00 C ATOM 1092 O ASP A 450 3.122 13.233 -4.688 1.00 0.00 O ATOM 1093 CB ASP A 450 4.383 11.125 -6.502 1.00 0.00 C ATOM 1094 CG ASP A 450 4.646 12.575 -6.859 1.00 0.00 C ATOM 1095 OD1 ASP A 450 3.667 13.332 -7.025 1.00 0.00 O ATOM 1096 OD2 ASP A 450 5.831 12.953 -6.974 1.00 0.00 O ATOM 0 H ASP A 450 2.922 9.205 -5.820 1.00 0.00 H new ATOM 0 HA ASP A 450 4.602 11.063 -4.366 1.00 0.00 H new ATOM 0 HB2 ASP A 450 5.314 10.562 -6.571 1.00 0.00 H new ATOM 0 HB3 ASP A 450 3.695 10.694 -7.229 1.00 0.00 H new ATOM 1101 N ASN A 451 1.501 11.674 -4.773 1.00 0.00 N ATOM 1102 CA ASN A 451 0.422 12.625 -4.528 1.00 0.00 C ATOM 1103 C ASN A 451 -0.808 11.918 -3.970 1.00 0.00 C ATOM 1104 O ASN A 451 -1.007 10.718 -4.163 1.00 0.00 O ATOM 1105 CB ASN A 451 0.060 13.360 -5.820 1.00 0.00 C ATOM 1106 CG ASN A 451 -0.079 12.420 -7.002 1.00 0.00 C ATOM 1107 OD1 ASN A 451 -0.485 11.268 -6.848 1.00 0.00 O ATOM 1108 ND2 ASN A 451 0.260 12.909 -8.189 1.00 0.00 N ATOM 0 H ASN A 451 1.194 10.709 -4.891 1.00 0.00 H new ATOM 0 HA ASN A 451 0.769 13.349 -3.791 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -0.876 13.900 -5.677 1.00 0.00 H new ATOM 0 HB3 ASN A 451 0.827 14.103 -6.039 1.00 0.00 H new ATOM 0 HD21 ASN A 451 0.189 12.323 -9.021 1.00 0.00 H new ATOM 0 HD22 ASN A 451 0.592 13.870 -8.269 1.00 0.00 H new ATOM 1115 N PRO A 452 -1.656 12.678 -3.260 1.00 0.00 N ATOM 1116 CA PRO A 452 -2.883 12.145 -2.660 1.00 0.00 C ATOM 1117 C PRO A 452 -3.980 11.912 -3.694 1.00 0.00 C ATOM 1118 O PRO A 452 -5.079 11.469 -3.358 1.00 0.00 O ATOM 1119 CB PRO A 452 -3.300 13.240 -1.676 1.00 0.00 C ATOM 1120 CG PRO A 452 -2.744 14.497 -2.250 1.00 0.00 C ATOM 1121 CD PRO A 452 -1.483 14.115 -2.991 1.00 0.00 C ATOM 0 HA PRO A 452 -2.721 11.173 -2.194 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -4.384 13.294 -1.580 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -2.901 13.050 -0.680 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -3.462 14.966 -2.923 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -2.527 15.219 -1.463 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -1.373 14.684 -3.914 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -0.593 14.305 -2.391 1.00 0.00 H new ATOM 1129 N VAL A 453 -3.675 12.212 -4.953 1.00 0.00 N ATOM 1130 CA VAL A 453 -4.634 12.033 -6.035 1.00 0.00 C ATOM 1131 C VAL A 453 -4.521 10.640 -6.645 1.00 0.00 C ATOM 1132 O VAL A 453 -5.527 10.019 -6.989 1.00 0.00 O ATOM 1133 CB VAL A 453 -4.433 13.084 -7.143 1.00 0.00 C ATOM 1134 CG1 VAL A 453 -5.419 12.858 -8.279 1.00 0.00 C ATOM 1135 CG2 VAL A 453 -4.574 14.488 -6.575 1.00 0.00 C ATOM 0 H VAL A 453 -2.771 12.580 -5.248 1.00 0.00 H new ATOM 0 HA VAL A 453 -5.626 12.158 -5.602 1.00 0.00 H new ATOM 0 HB VAL A 453 -3.425 12.977 -7.543 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -5.262 13.610 -9.052 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -5.266 11.865 -8.702 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -6.437 12.937 -7.898 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -4.429 15.219 -7.371 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -5.569 14.609 -6.148 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -3.825 14.643 -5.799 1.00 0.00 H new ATOM 1145 N SER A 454 -3.291 10.154 -6.773 1.00 0.00 N ATOM 1146 CA SER A 454 -3.046 8.835 -7.345 1.00 0.00 C ATOM 1147 C SER A 454 -3.307 7.740 -6.315 1.00 0.00 C ATOM 1148 O SER A 454 -3.838 6.680 -6.642 1.00 0.00 O ATOM 1149 CB SER A 454 -1.608 8.737 -7.857 1.00 0.00 C ATOM 1150 OG SER A 454 -1.439 9.483 -9.050 1.00 0.00 O ATOM 0 H SER A 454 -2.448 10.653 -6.488 1.00 0.00 H new ATOM 0 HA SER A 454 -3.732 8.695 -8.181 1.00 0.00 H new ATOM 0 HB2 SER A 454 -0.921 9.104 -7.094 1.00 0.00 H new ATOM 0 HB3 SER A 454 -1.354 7.693 -8.038 1.00 0.00 H new ATOM 0 HG SER A 454 -1.050 10.357 -8.837 1.00 0.00 H new ATOM 1156 N ALA A 455 -2.927 8.005 -5.069 1.00 0.00 N ATOM 1157 CA ALA A 455 -3.120 7.045 -3.991 1.00 0.00 C ATOM 1158 C ALA A 455 -4.562 6.549 -3.950 1.00 0.00 C ATOM 1159 O ALA A 455 -4.813 5.357 -3.773 1.00 0.00 O ATOM 1160 CB ALA A 455 -2.735 7.665 -2.656 1.00 0.00 C ATOM 0 H ALA A 455 -2.483 8.878 -4.782 1.00 0.00 H new ATOM 0 HA ALA A 455 -2.473 6.188 -4.181 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -2.884 6.936 -1.860 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -1.687 7.964 -2.682 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -3.357 8.540 -2.468 1.00 0.00 H new ATOM 1166 N GLN A 456 -5.506 7.471 -4.113 1.00 0.00 N ATOM 1167 CA GLN A 456 -6.922 7.127 -4.093 1.00 0.00 C ATOM 1168 C GLN A 456 -7.254 6.123 -5.192 1.00 0.00 C ATOM 1169 O GLN A 456 -7.865 5.085 -4.935 1.00 0.00 O ATOM 1170 CB GLN A 456 -7.777 8.384 -4.260 1.00 0.00 C ATOM 1171 CG GLN A 456 -8.096 9.081 -2.947 1.00 0.00 C ATOM 1172 CD GLN A 456 -8.923 8.218 -2.014 1.00 0.00 C ATOM 1173 OE1 GLN A 456 -8.267 7.609 -1.033 1.00 0.00 O flip ATOM 1174 NE2 GLN A 456 -10.138 8.099 -2.173 1.00 0.00 N flip ATOM 0 H GLN A 456 -5.315 8.462 -4.260 1.00 0.00 H new ATOM 0 HA GLN A 456 -7.145 6.670 -3.129 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -7.257 9.083 -4.916 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.710 8.116 -4.756 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -7.165 9.357 -2.451 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -8.634 10.006 -3.153 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -10.602 8.585 -2.940 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -10.681 7.514 -1.537 1.00 0.00 H new ATOM 1183 N ALA A 457 -6.846 6.438 -6.417 1.00 0.00 N ATOM 1184 CA ALA A 457 -7.099 5.562 -7.555 1.00 0.00 C ATOM 1185 C ALA A 457 -6.994 4.095 -7.152 1.00 0.00 C ATOM 1186 O ALA A 457 -7.806 3.269 -7.567 1.00 0.00 O ATOM 1187 CB ALA A 457 -6.128 5.872 -8.685 1.00 0.00 C ATOM 0 H ALA A 457 -6.339 7.293 -6.647 1.00 0.00 H new ATOM 0 HA ALA A 457 -8.116 5.744 -7.904 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -6.328 5.211 -9.528 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -6.254 6.908 -8.999 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -5.106 5.719 -8.339 1.00 0.00 H new ATOM 1193 N ALA A 458 -5.989 3.779 -6.343 1.00 0.00 N ATOM 1194 CA ALA A 458 -5.779 2.411 -5.885 1.00 0.00 C ATOM 1195 C ALA A 458 -6.940 1.940 -5.015 1.00 0.00 C ATOM 1196 O ALA A 458 -7.721 1.079 -5.419 1.00 0.00 O ATOM 1197 CB ALA A 458 -4.468 2.306 -5.119 1.00 0.00 C ATOM 0 H ALA A 458 -5.307 4.451 -5.991 1.00 0.00 H new ATOM 0 HA ALA A 458 -5.728 1.764 -6.761 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -4.324 1.279 -4.783 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -3.642 2.594 -5.770 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -4.497 2.970 -4.255 1.00 0.00 H new ATOM 1203 N ILE A 459 -7.046 2.510 -3.819 1.00 0.00 N ATOM 1204 CA ILE A 459 -8.112 2.148 -2.893 1.00 0.00 C ATOM 1205 C ILE A 459 -9.451 2.034 -3.614 1.00 0.00 C ATOM 1206 O ILE A 459 -10.224 1.109 -3.364 1.00 0.00 O ATOM 1207 CB ILE A 459 -8.241 3.175 -1.753 1.00 0.00 C ATOM 1208 CG1 ILE A 459 -6.951 3.223 -0.931 1.00 0.00 C ATOM 1209 CG2 ILE A 459 -9.429 2.836 -0.865 1.00 0.00 C ATOM 1210 CD1 ILE A 459 -6.857 4.429 -0.023 1.00 0.00 C ATOM 0 H ILE A 459 -6.407 3.224 -3.469 1.00 0.00 H new ATOM 0 HA ILE A 459 -7.846 1.179 -2.469 1.00 0.00 H new ATOM 0 HB ILE A 459 -8.408 4.160 -2.189 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -6.880 2.318 -0.328 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.098 3.222 -1.609 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -9.506 3.571 -0.064 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -10.343 2.849 -1.459 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -9.290 1.844 -0.435 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -5.917 4.397 0.528 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -6.895 5.339 -0.622 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -7.690 4.421 0.679 1.00 0.00 H new ATOM 1222 N GLN A 460 -9.718 2.979 -4.508 1.00 0.00 N ATOM 1223 CA GLN A 460 -10.963 2.984 -5.266 1.00 0.00 C ATOM 1224 C GLN A 460 -11.353 1.569 -5.682 1.00 0.00 C ATOM 1225 O GLN A 460 -12.509 1.167 -5.547 1.00 0.00 O ATOM 1226 CB GLN A 460 -10.829 3.873 -6.503 1.00 0.00 C ATOM 1227 CG GLN A 460 -10.781 5.359 -6.183 1.00 0.00 C ATOM 1228 CD GLN A 460 -12.022 5.839 -5.456 1.00 0.00 C ATOM 1229 OE1 GLN A 460 -12.237 5.512 -4.289 1.00 0.00 O ATOM 1230 NE2 GLN A 460 -12.847 6.618 -6.145 1.00 0.00 N ATOM 0 H GLN A 460 -9.089 3.752 -4.726 1.00 0.00 H new ATOM 0 HA GLN A 460 -11.748 3.384 -4.624 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.923 3.597 -7.042 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -11.669 3.681 -7.171 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -9.903 5.567 -5.572 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -10.666 5.923 -7.109 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -12.629 6.864 -7.111 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -13.699 6.971 -5.709 1.00 0.00 H new ATOM 1239 N SER A 461 -10.381 0.819 -6.190 1.00 0.00 N ATOM 1240 CA SER A 461 -10.622 -0.551 -6.630 1.00 0.00 C ATOM 1241 C SER A 461 -10.147 -1.551 -5.581 1.00 0.00 C ATOM 1242 O SER A 461 -10.916 -2.390 -5.113 1.00 0.00 O ATOM 1243 CB SER A 461 -9.915 -0.813 -7.961 1.00 0.00 C ATOM 1244 OG SER A 461 -10.230 -2.103 -8.460 1.00 0.00 O ATOM 0 H SER A 461 -9.419 1.136 -6.307 1.00 0.00 H new ATOM 0 HA SER A 461 -11.696 -0.679 -6.766 1.00 0.00 H new ATOM 0 HB2 SER A 461 -10.209 -0.056 -8.688 1.00 0.00 H new ATOM 0 HB3 SER A 461 -8.837 -0.724 -7.828 1.00 0.00 H new ATOM 0 HG SER A 461 -9.768 -2.246 -9.312 1.00 0.00 H new ATOM 1250 N MET A 462 -8.872 -1.455 -5.217 1.00 0.00 N ATOM 1251 CA MET A 462 -8.292 -2.350 -4.222 1.00 0.00 C ATOM 1252 C MET A 462 -9.239 -2.536 -3.040 1.00 0.00 C ATOM 1253 O MET A 462 -9.286 -3.603 -2.433 1.00 0.00 O ATOM 1254 CB MET A 462 -6.950 -1.804 -3.734 1.00 0.00 C ATOM 1255 CG MET A 462 -5.914 -1.662 -4.838 1.00 0.00 C ATOM 1256 SD MET A 462 -5.770 -3.148 -5.849 1.00 0.00 S ATOM 1257 CE MET A 462 -4.964 -4.262 -4.702 1.00 0.00 C ATOM 0 H MET A 462 -8.221 -0.767 -5.596 1.00 0.00 H new ATOM 0 HA MET A 462 -8.132 -3.320 -4.692 1.00 0.00 H new ATOM 0 HB2 MET A 462 -7.110 -0.831 -3.270 1.00 0.00 H new ATOM 0 HB3 MET A 462 -6.557 -2.465 -2.961 1.00 0.00 H new ATOM 0 HG2 MET A 462 -6.180 -0.818 -5.475 1.00 0.00 H new ATOM 0 HG3 MET A 462 -4.945 -1.433 -4.395 1.00 0.00 H new ATOM 0 HE1 MET A 462 -4.017 -4.597 -5.125 1.00 0.00 H new ATOM 0 HE2 MET A 462 -4.779 -3.744 -3.761 1.00 0.00 H new ATOM 0 HE3 MET A 462 -5.605 -5.125 -4.521 1.00 0.00 H new ATOM 1267 N ASN A 463 -9.991 -1.487 -2.720 1.00 0.00 N ATOM 1268 CA ASN A 463 -10.935 -1.534 -1.610 1.00 0.00 C ATOM 1269 C ASN A 463 -11.873 -2.731 -1.744 1.00 0.00 C ATOM 1270 O ASN A 463 -12.811 -2.711 -2.539 1.00 0.00 O ATOM 1271 CB ASN A 463 -11.748 -0.240 -1.548 1.00 0.00 C ATOM 1272 CG ASN A 463 -12.962 -0.361 -0.648 1.00 0.00 C ATOM 1273 OD1 ASN A 463 -14.089 -0.104 -1.069 1.00 0.00 O ATOM 1274 ND2 ASN A 463 -12.735 -0.754 0.600 1.00 0.00 N ATOM 0 H ASN A 463 -9.965 -0.595 -3.214 1.00 0.00 H new ATOM 0 HA ASN A 463 -10.366 -1.642 -0.687 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -11.112 0.568 -1.188 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -12.070 0.032 -2.553 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -13.512 -0.853 1.253 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -11.783 -0.956 0.906 1.00 0.00 H new ATOM 1281 N GLY A 464 -11.612 -3.771 -0.959 1.00 0.00 N ATOM 1282 CA GLY A 464 -12.441 -4.961 -1.006 1.00 0.00 C ATOM 1283 C GLY A 464 -12.039 -5.906 -2.120 1.00 0.00 C ATOM 1284 O GLY A 464 -12.877 -6.617 -2.674 1.00 0.00 O ATOM 0 H GLY A 464 -10.842 -3.811 -0.292 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -12.377 -5.482 -0.051 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -13.483 -4.669 -1.140 1.00 0.00 H new ATOM 1288 N PHE A 465 -10.751 -5.913 -2.452 1.00 0.00 N ATOM 1289 CA PHE A 465 -10.239 -6.775 -3.510 1.00 0.00 C ATOM 1290 C PHE A 465 -10.324 -8.244 -3.104 1.00 0.00 C ATOM 1291 O PHE A 465 -9.598 -8.696 -2.218 1.00 0.00 O ATOM 1292 CB PHE A 465 -8.792 -6.408 -3.840 1.00 0.00 C ATOM 1293 CG PHE A 465 -8.218 -7.198 -4.981 1.00 0.00 C ATOM 1294 CD1 PHE A 465 -7.794 -8.504 -4.794 1.00 0.00 C ATOM 1295 CD2 PHE A 465 -8.101 -6.635 -6.243 1.00 0.00 C ATOM 1296 CE1 PHE A 465 -7.267 -9.235 -5.842 1.00 0.00 C ATOM 1297 CE2 PHE A 465 -7.574 -7.361 -7.294 1.00 0.00 C ATOM 1298 CZ PHE A 465 -7.156 -8.661 -7.093 1.00 0.00 C ATOM 0 H PHE A 465 -10.044 -5.331 -2.003 1.00 0.00 H new ATOM 0 HA PHE A 465 -10.855 -6.625 -4.396 1.00 0.00 H new ATOM 0 HB2 PHE A 465 -8.741 -5.346 -4.082 1.00 0.00 H new ATOM 0 HB3 PHE A 465 -8.175 -6.563 -2.955 1.00 0.00 H new ATOM 0 HD1 PHE A 465 -7.876 -8.956 -3.817 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -8.425 -5.618 -6.406 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -6.943 -10.253 -5.683 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -7.489 -6.911 -8.272 1.00 0.00 H new ATOM 0 HZ PHE A 465 -6.742 -9.229 -7.913 1.00 0.00 H new ATOM 1308 N GLN A 466 -11.215 -8.981 -3.757 1.00 0.00 N ATOM 1309 CA GLN A 466 -11.395 -10.399 -3.463 1.00 0.00 C ATOM 1310 C GLN A 466 -10.150 -11.195 -3.839 1.00 0.00 C ATOM 1311 O GLN A 466 -9.869 -11.407 -5.019 1.00 0.00 O ATOM 1312 CB GLN A 466 -12.611 -10.946 -4.213 1.00 0.00 C ATOM 1313 CG GLN A 466 -13.119 -12.269 -3.663 1.00 0.00 C ATOM 1314 CD GLN A 466 -12.153 -13.412 -3.903 1.00 0.00 C ATOM 1315 OE1 GLN A 466 -11.621 -13.570 -5.003 1.00 0.00 O ATOM 1316 NE2 GLN A 466 -11.920 -14.217 -2.874 1.00 0.00 N ATOM 0 H GLN A 466 -11.823 -8.622 -4.492 1.00 0.00 H new ATOM 0 HA GLN A 466 -11.561 -10.504 -2.391 1.00 0.00 H new ATOM 0 HB2 GLN A 466 -13.415 -10.211 -4.170 1.00 0.00 H new ATOM 0 HB3 GLN A 466 -12.352 -11.074 -5.264 1.00 0.00 H new ATOM 0 HG2 GLN A 466 -13.297 -12.168 -2.592 1.00 0.00 H new ATOM 0 HG3 GLN A 466 -14.077 -12.506 -4.125 1.00 0.00 H new ATOM 0 HE21 GLN A 466 -12.382 -14.049 -1.980 1.00 0.00 H new ATOM 0 HE22 GLN A 466 -11.279 -15.003 -2.977 1.00 0.00 H new ATOM 1325 N ILE A 467 -9.406 -11.634 -2.828 1.00 0.00 N ATOM 1326 CA ILE A 467 -8.191 -12.407 -3.053 1.00 0.00 C ATOM 1327 C ILE A 467 -8.284 -13.778 -2.393 1.00 0.00 C ATOM 1328 O ILE A 467 -8.759 -13.905 -1.266 1.00 0.00 O ATOM 1329 CB ILE A 467 -6.949 -11.673 -2.516 1.00 0.00 C ATOM 1330 CG1 ILE A 467 -5.673 -12.320 -3.058 1.00 0.00 C ATOM 1331 CG2 ILE A 467 -6.948 -11.679 -0.995 1.00 0.00 C ATOM 1332 CD1 ILE A 467 -4.447 -11.445 -2.923 1.00 0.00 C ATOM 0 H ILE A 467 -9.624 -11.467 -1.846 1.00 0.00 H new ATOM 0 HA ILE A 467 -8.090 -12.531 -4.131 1.00 0.00 H new ATOM 0 HB ILE A 467 -6.981 -10.638 -2.856 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.499 -13.258 -2.531 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -5.819 -12.567 -4.110 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -6.064 -11.156 -0.630 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -7.843 -11.177 -0.629 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -6.936 -12.708 -0.635 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -3.580 -11.968 -3.328 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -4.600 -10.517 -3.473 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -4.275 -11.219 -1.871 1.00 0.00 H new ATOM 1344 N GLY A 468 -7.821 -14.803 -3.103 1.00 0.00 N ATOM 1345 CA GLY A 468 -7.858 -16.153 -2.570 1.00 0.00 C ATOM 1346 C GLY A 468 -9.243 -16.553 -2.103 1.00 0.00 C ATOM 1347 O GLY A 468 -10.073 -16.987 -2.901 1.00 0.00 O ATOM 0 H GLY A 468 -7.421 -14.722 -4.038 1.00 0.00 H new ATOM 0 HA2 GLY A 468 -7.520 -16.852 -3.335 1.00 0.00 H new ATOM 0 HA3 GLY A 468 -7.160 -16.231 -1.736 1.00 0.00 H new ATOM 1351 N MET A 469 -9.493 -16.409 -0.805 1.00 0.00 N ATOM 1352 CA MET A 469 -10.788 -16.760 -0.233 1.00 0.00 C ATOM 1353 C MET A 469 -11.307 -15.642 0.665 1.00 0.00 C ATOM 1354 O MET A 469 -12.398 -15.738 1.227 1.00 0.00 O ATOM 1355 CB MET A 469 -10.681 -18.062 0.564 1.00 0.00 C ATOM 1356 CG MET A 469 -12.022 -18.733 0.814 1.00 0.00 C ATOM 1357 SD MET A 469 -11.853 -20.454 1.324 1.00 0.00 S ATOM 1358 CE MET A 469 -12.963 -21.259 0.172 1.00 0.00 C ATOM 0 H MET A 469 -8.816 -16.052 -0.130 1.00 0.00 H new ATOM 0 HA MET A 469 -11.493 -16.900 -1.052 1.00 0.00 H new ATOM 0 HB2 MET A 469 -10.032 -18.754 0.028 1.00 0.00 H new ATOM 0 HB3 MET A 469 -10.204 -17.854 1.522 1.00 0.00 H new ATOM 0 HG2 MET A 469 -12.562 -18.181 1.584 1.00 0.00 H new ATOM 0 HG3 MET A 469 -12.623 -18.685 -0.094 1.00 0.00 H new ATOM 0 HE1 MET A 469 -12.968 -22.332 0.361 1.00 0.00 H new ATOM 0 HE2 MET A 469 -13.970 -20.863 0.301 1.00 0.00 H new ATOM 0 HE3 MET A 469 -12.627 -21.072 -0.848 1.00 0.00 H new ATOM 1368 N LYS A 470 -10.518 -14.580 0.796 1.00 0.00 N ATOM 1369 CA LYS A 470 -10.897 -13.443 1.625 1.00 0.00 C ATOM 1370 C LYS A 470 -10.823 -12.142 0.831 1.00 0.00 C ATOM 1371 O LYS A 470 -10.383 -12.131 -0.320 1.00 0.00 O ATOM 1372 CB LYS A 470 -9.989 -13.354 2.853 1.00 0.00 C ATOM 1373 CG LYS A 470 -8.509 -13.312 2.514 1.00 0.00 C ATOM 1374 CD LYS A 470 -7.713 -12.584 3.585 1.00 0.00 C ATOM 1375 CE LYS A 470 -7.243 -13.537 4.673 1.00 0.00 C ATOM 1376 NZ LYS A 470 -8.244 -13.667 5.767 1.00 0.00 N ATOM 0 H LYS A 470 -9.612 -14.484 0.338 1.00 0.00 H new ATOM 0 HA LYS A 470 -11.926 -13.592 1.952 1.00 0.00 H new ATOM 0 HB2 LYS A 470 -10.248 -12.461 3.422 1.00 0.00 H new ATOM 0 HB3 LYS A 470 -10.181 -14.211 3.499 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -8.130 -14.328 2.406 1.00 0.00 H new ATOM 0 HG3 LYS A 470 -8.368 -12.815 1.554 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -6.851 -12.095 3.130 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -8.328 -11.800 4.027 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -7.051 -14.518 4.238 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -6.299 -13.180 5.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -7.879 -14.312 6.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -8.422 -12.733 6.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -9.132 -14.048 5.382 1.00 0.00 H new ATOM 1390 N ARG A 471 -11.252 -11.048 1.452 1.00 0.00 N ATOM 1391 CA ARG A 471 -11.233 -9.743 0.803 1.00 0.00 C ATOM 1392 C ARG A 471 -10.102 -8.879 1.354 1.00 0.00 C ATOM 1393 O ARG A 471 -9.436 -9.251 2.321 1.00 0.00 O ATOM 1394 CB ARG A 471 -12.574 -9.034 0.998 1.00 0.00 C ATOM 1395 CG ARG A 471 -13.745 -9.756 0.353 1.00 0.00 C ATOM 1396 CD ARG A 471 -15.008 -8.912 0.390 1.00 0.00 C ATOM 1397 NE ARG A 471 -15.767 -9.114 1.622 1.00 0.00 N ATOM 1398 CZ ARG A 471 -16.792 -8.353 1.987 1.00 0.00 C ATOM 1399 NH1 ARG A 471 -17.180 -7.344 1.219 1.00 0.00 N ATOM 1400 NH2 ARG A 471 -17.432 -8.600 3.123 1.00 0.00 N ATOM 0 H ARG A 471 -11.617 -11.040 2.404 1.00 0.00 H new ATOM 0 HA ARG A 471 -11.063 -9.896 -0.263 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -12.767 -8.928 2.065 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -12.507 -8.028 0.585 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -13.499 -10.000 -0.681 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -13.921 -10.700 0.870 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -14.743 -7.859 0.296 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -15.635 -9.160 -0.467 1.00 0.00 H new ATOM 0 HE ARG A 471 -15.494 -9.882 2.235 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -16.691 -7.151 0.345 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -17.968 -6.761 1.502 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -17.137 -9.375 3.717 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -18.219 -8.015 3.402 1.00 0.00 H new ATOM 1414 N LEU A 472 -9.892 -7.725 0.732 1.00 0.00 N ATOM 1415 CA LEU A 472 -8.842 -6.806 1.159 1.00 0.00 C ATOM 1416 C LEU A 472 -9.425 -5.447 1.531 1.00 0.00 C ATOM 1417 O LEU A 472 -10.501 -5.072 1.066 1.00 0.00 O ATOM 1418 CB LEU A 472 -7.799 -6.641 0.051 1.00 0.00 C ATOM 1419 CG LEU A 472 -7.124 -7.925 -0.432 1.00 0.00 C ATOM 1420 CD1 LEU A 472 -6.136 -7.621 -1.547 1.00 0.00 C ATOM 1421 CD2 LEU A 472 -6.427 -8.628 0.724 1.00 0.00 C ATOM 0 H LEU A 472 -10.434 -7.403 -0.070 1.00 0.00 H new ATOM 0 HA LEU A 472 -8.362 -7.228 2.042 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.278 -6.163 -0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -7.026 -5.959 0.406 1.00 0.00 H new ATOM 0 HG LEU A 472 -7.892 -8.591 -0.826 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -5.665 -8.547 -1.878 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -6.662 -7.162 -2.384 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -5.372 -6.937 -1.179 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -5.952 -9.540 0.362 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -5.670 -7.968 1.148 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -7.159 -8.880 1.491 1.00 0.00 H new ATOM 1433 N LYS A 473 -8.705 -4.709 2.371 1.00 0.00 N ATOM 1434 CA LYS A 473 -9.149 -3.390 2.803 1.00 0.00 C ATOM 1435 C LYS A 473 -8.008 -2.381 2.727 1.00 0.00 C ATOM 1436 O LYS A 473 -7.073 -2.424 3.528 1.00 0.00 O ATOM 1437 CB LYS A 473 -9.692 -3.455 4.233 1.00 0.00 C ATOM 1438 CG LYS A 473 -10.165 -2.112 4.765 1.00 0.00 C ATOM 1439 CD LYS A 473 -11.182 -2.282 5.881 1.00 0.00 C ATOM 1440 CE LYS A 473 -10.504 -2.514 7.223 1.00 0.00 C ATOM 1441 NZ LYS A 473 -11.494 -2.704 8.319 1.00 0.00 N ATOM 0 H LYS A 473 -7.812 -5.003 2.765 1.00 0.00 H new ATOM 0 HA LYS A 473 -9.945 -3.064 2.133 1.00 0.00 H new ATOM 0 HB2 LYS A 473 -10.521 -4.162 4.266 1.00 0.00 H new ATOM 0 HB3 LYS A 473 -8.915 -3.844 4.891 1.00 0.00 H new ATOM 0 HG2 LYS A 473 -9.311 -1.544 5.133 1.00 0.00 H new ATOM 0 HG3 LYS A 473 -10.607 -1.533 3.954 1.00 0.00 H new ATOM 0 HD2 LYS A 473 -11.812 -1.394 5.939 1.00 0.00 H new ATOM 0 HD3 LYS A 473 -11.837 -3.123 5.653 1.00 0.00 H new ATOM 0 HE2 LYS A 473 -9.861 -3.392 7.158 1.00 0.00 H new ATOM 0 HE3 LYS A 473 -9.862 -1.665 7.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 -10.992 -2.859 9.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 -12.091 -1.856 8.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 -12.091 -3.529 8.109 1.00 0.00 H new ATOM 1455 N VAL A 474 -8.090 -1.471 1.761 1.00 0.00 N ATOM 1456 CA VAL A 474 -7.066 -0.450 1.583 1.00 0.00 C ATOM 1457 C VAL A 474 -7.593 0.929 1.959 1.00 0.00 C ATOM 1458 O VAL A 474 -8.694 1.313 1.563 1.00 0.00 O ATOM 1459 CB VAL A 474 -6.556 -0.413 0.129 1.00 0.00 C ATOM 1460 CG1 VAL A 474 -5.286 0.416 0.029 1.00 0.00 C ATOM 1461 CG2 VAL A 474 -6.324 -1.825 -0.390 1.00 0.00 C ATOM 0 H VAL A 474 -8.856 -1.421 1.090 1.00 0.00 H new ATOM 0 HA VAL A 474 -6.240 -0.713 2.244 1.00 0.00 H new ATOM 0 HB VAL A 474 -7.317 0.058 -0.493 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -4.941 0.430 -1.005 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -5.490 1.435 0.358 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -4.515 -0.022 0.663 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -5.964 -1.780 -1.418 1.00 0.00 H new ATOM 0 HG22 VAL A 474 -5.582 -2.324 0.233 1.00 0.00 H new ATOM 0 HG23 VAL A 474 -7.260 -2.383 -0.357 1.00 0.00 H new ATOM 1471 N GLN A 475 -6.801 1.670 2.727 1.00 0.00 N ATOM 1472 CA GLN A 475 -7.189 3.008 3.159 1.00 0.00 C ATOM 1473 C GLN A 475 -5.964 3.842 3.516 1.00 0.00 C ATOM 1474 O GLN A 475 -5.022 3.347 4.135 1.00 0.00 O ATOM 1475 CB GLN A 475 -8.133 2.927 4.359 1.00 0.00 C ATOM 1476 CG GLN A 475 -9.600 2.822 3.974 1.00 0.00 C ATOM 1477 CD GLN A 475 -10.530 3.108 5.136 1.00 0.00 C ATOM 1478 OE1 GLN A 475 -10.537 4.212 5.684 1.00 0.00 O ATOM 1479 NE2 GLN A 475 -11.322 2.114 5.521 1.00 0.00 N ATOM 0 H GLN A 475 -5.887 1.367 3.063 1.00 0.00 H new ATOM 0 HA GLN A 475 -7.707 3.493 2.331 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -7.863 2.063 4.966 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -7.992 3.810 4.982 1.00 0.00 H new ATOM 0 HG2 GLN A 475 -9.810 3.521 3.165 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -9.800 1.821 3.591 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -11.284 1.216 5.039 1.00 0.00 H new ATOM 0 HE22 GLN A 475 -11.969 2.249 6.298 1.00 0.00 H new ATOM 1488 N LEU A 476 -5.981 5.111 3.121 1.00 0.00 N ATOM 1489 CA LEU A 476 -4.871 6.014 3.399 1.00 0.00 C ATOM 1490 C LEU A 476 -4.955 6.559 4.822 1.00 0.00 C ATOM 1491 O LEU A 476 -6.029 6.936 5.292 1.00 0.00 O ATOM 1492 CB LEU A 476 -4.864 7.171 2.398 1.00 0.00 C ATOM 1493 CG LEU A 476 -5.846 8.309 2.681 1.00 0.00 C ATOM 1494 CD1 LEU A 476 -5.288 9.243 3.744 1.00 0.00 C ATOM 1495 CD2 LEU A 476 -6.156 9.076 1.404 1.00 0.00 C ATOM 0 H LEU A 476 -6.752 5.537 2.607 1.00 0.00 H new ATOM 0 HA LEU A 476 -3.944 5.450 3.299 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -3.857 7.587 2.361 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -5.079 6.770 1.408 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.774 7.878 3.056 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -6.000 10.047 3.932 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -5.118 8.686 4.665 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -4.346 9.667 3.397 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -6.856 9.882 1.624 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -5.235 9.496 0.999 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.599 8.400 0.672 1.00 0.00 H new ATOM 1507 N LYS A 477 -3.815 6.599 5.503 1.00 0.00 N ATOM 1508 CA LYS A 477 -3.758 7.101 6.871 1.00 0.00 C ATOM 1509 C LYS A 477 -4.760 8.232 7.078 1.00 0.00 C ATOM 1510 O LYS A 477 -4.565 9.344 6.585 1.00 0.00 O ATOM 1511 CB LYS A 477 -2.345 7.590 7.198 1.00 0.00 C ATOM 1512 CG LYS A 477 -1.987 7.473 8.670 1.00 0.00 C ATOM 1513 CD LYS A 477 -1.750 6.028 9.073 1.00 0.00 C ATOM 1514 CE LYS A 477 -1.820 5.851 10.581 1.00 0.00 C ATOM 1515 NZ LYS A 477 -1.352 4.503 11.005 1.00 0.00 N ATOM 0 H LYS A 477 -2.918 6.290 5.130 1.00 0.00 H new ATOM 0 HA LYS A 477 -4.017 6.283 7.543 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -1.626 7.018 6.611 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -2.250 8.632 6.891 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -1.092 8.060 8.875 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -2.790 7.893 9.275 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -2.494 5.390 8.596 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -0.774 5.704 8.713 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -1.211 6.615 11.065 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -2.846 6.001 10.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -1.416 4.423 12.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 -1.948 3.774 10.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -0.365 4.369 10.708 1.00 0.00 H new