USER MOD reduce.3.24.130724 H: found=0, std=0, add=594, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 594 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : B 411 MET CE :methyl 136:sc= -0.873 (180deg=-2.77!) USER MOD Single : B 413 LYS NZ :NH3+ -145:sc= -0.607 (180deg=-0.89) USER MOD Single : B 415 GLN : amide:sc= -3.12 K(o=-3.1,f=-0.41) USER MOD Single : B 417 GLN : amide:sc= -5.52! C(o=-5.5!,f=-5.4!) USER MOD Single : B 418 HIS : no HD1:sc= -0.858 K(o=-0.86,f=-0.28) USER MOD Single : B 420 TYR OH : rot 101:sc= 0.363 USER MOD Single : B 421 THR OG1 : rot 180:sc= 0 USER MOD Single : B 423 THR OG1 : rot 54:sc= 0.484 USER MOD Single : B 425 THR OG1 : rot -35:sc= 0.602 USER MOD Single : B 429 GLN : amide:sc= 0.101 X(o=0.1,f=0) USER MOD Single : B 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 453 MET CE :methyl 136:sc= -3.31 (180deg=-6.19!) USER MOD Single : B 456 LYS NZ :NH3+ -140:sc= -1.26 (180deg=-3.34!) USER MOD Single : B 458 SER OG : rot 180:sc= 0 USER MOD Single : B 461 ASN : amide:sc= -3.53 K(o=-3.5,f=-0.48) USER MOD Single : B 462 GLN : amide:sc= -1.49 K(o=-1.5,f=-0.93) USER MOD Single : B 463 HIS : no HD1:sc= -2.51! C(o=-2.5!,f=-4.2!) USER MOD Single : B 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 465 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 468 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 469 CYS SG : rot -77:sc= -2.49! USER MOD Single : B 476 ASN : amide:sc= -4.1! C(o=-4.1!,f=-10!) USER MOD Single : B 478 THR OG1 : rot -86:sc= -0.199 USER MOD ----------------------------------------------------------------- ATOM 67 N PRO A 59 3.643 -7.419 -9.408 1.00 0.00 N ATOM 68 CA PRO A 59 3.674 -8.866 -9.535 1.00 0.00 C ATOM 69 C PRO A 59 4.674 -9.301 -10.609 1.00 0.00 C ATOM 70 O PRO A 59 5.203 -8.468 -11.343 1.00 0.00 O ATOM 71 CB PRO A 59 2.244 -9.263 -9.860 1.00 0.00 C ATOM 72 CG PRO A 59 1.563 -7.999 -10.360 1.00 0.00 C ATOM 73 CD PRO A 59 2.453 -6.819 -10.005 1.00 0.00 C ATOM 0 HA PRO A 59 4.014 -9.361 -8.625 1.00 0.00 H new ATOM 0 HB2 PRO A 59 2.219 -10.046 -10.618 1.00 0.00 H new ATOM 0 HB3 PRO A 59 1.738 -9.656 -8.978 1.00 0.00 H new ATOM 0 HG2 PRO A 59 1.408 -8.050 -11.438 1.00 0.00 H new ATOM 0 HG3 PRO A 59 0.580 -7.888 -9.901 1.00 0.00 H new ATOM 0 HD2 PRO A 59 2.706 -6.233 -10.889 1.00 0.00 H new ATOM 0 HD3 PRO A 59 1.957 -6.145 -9.307 1.00 0.00 H new ATOM 81 N PRO A 60 4.909 -10.639 -10.668 1.00 0.00 N ATOM 82 CA PRO A 60 5.835 -11.195 -11.640 1.00 0.00 C ATOM 83 C PRO A 60 5.218 -11.206 -13.040 1.00 0.00 C ATOM 84 O PRO A 60 4.005 -11.068 -13.189 1.00 0.00 O ATOM 85 CB PRO A 60 6.160 -12.586 -11.123 1.00 0.00 C ATOM 86 CG PRO A 60 5.055 -12.934 -10.138 1.00 0.00 C ATOM 87 CD PRO A 60 4.301 -11.655 -9.813 1.00 0.00 C ATOM 0 HA PRO A 60 6.743 -10.601 -11.744 1.00 0.00 H new ATOM 0 HB2 PRO A 60 6.197 -13.307 -11.939 1.00 0.00 H new ATOM 0 HB3 PRO A 60 7.136 -12.604 -10.638 1.00 0.00 H new ATOM 0 HG2 PRO A 60 4.381 -13.676 -10.567 1.00 0.00 H new ATOM 0 HG3 PRO A 60 5.475 -13.370 -9.232 1.00 0.00 H new ATOM 0 HD2 PRO A 60 3.236 -11.760 -10.019 1.00 0.00 H new ATOM 0 HD3 PRO A 60 4.398 -11.395 -8.759 1.00 0.00 H new ATOM 95 N LEU A 61 6.082 -11.372 -14.031 1.00 0.00 N ATOM 96 CA LEU A 61 5.638 -11.403 -15.414 1.00 0.00 C ATOM 97 C LEU A 61 4.609 -12.522 -15.589 1.00 0.00 C ATOM 98 O LEU A 61 4.842 -13.656 -15.174 1.00 0.00 O ATOM 99 CB LEU A 61 6.835 -11.516 -16.359 1.00 0.00 C ATOM 100 CG LEU A 61 7.127 -10.286 -17.222 1.00 0.00 C ATOM 101 CD1 LEU A 61 8.620 -10.181 -17.540 1.00 0.00 C ATOM 102 CD2 LEU A 61 6.269 -10.290 -18.489 1.00 0.00 C ATOM 0 H LEU A 61 7.087 -11.486 -13.903 1.00 0.00 H new ATOM 0 HA LEU A 61 5.142 -10.468 -15.676 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.722 -11.737 -15.765 1.00 0.00 H new ATOM 0 HB3 LEU A 61 6.672 -12.368 -17.019 1.00 0.00 H new ATOM 0 HG LEU A 61 6.857 -9.397 -16.653 1.00 0.00 H new ATOM 0 HD11 LEU A 61 8.800 -9.299 -18.154 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.185 -10.098 -16.611 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.940 -11.071 -18.081 1.00 0.00 H new ATOM 0 HD21 LEU A 61 6.496 -9.406 -19.085 1.00 0.00 H new ATOM 0 HD22 LEU A 61 6.485 -11.185 -19.072 1.00 0.00 H new ATOM 0 HD23 LEU A 61 5.214 -10.282 -18.214 1.00 0.00 H new ATOM 114 N SER A 62 3.492 -12.164 -16.205 1.00 0.00 N ATOM 115 CA SER A 62 2.427 -13.124 -16.441 1.00 0.00 C ATOM 116 C SER A 62 2.621 -13.797 -17.802 1.00 0.00 C ATOM 117 O SER A 62 3.280 -13.246 -18.682 1.00 0.00 O ATOM 118 CB SER A 62 1.054 -12.451 -16.373 1.00 0.00 C ATOM 119 OG SER A 62 0.920 -11.413 -17.340 1.00 0.00 O ATOM 0 H SER A 62 3.301 -11.222 -16.548 1.00 0.00 H new ATOM 0 HA SER A 62 2.470 -13.882 -15.659 1.00 0.00 H new ATOM 0 HB2 SER A 62 0.276 -13.198 -16.532 1.00 0.00 H new ATOM 0 HB3 SER A 62 0.901 -12.039 -15.375 1.00 0.00 H new ATOM 0 HG SER A 62 0.030 -11.010 -17.266 1.00 0.00 H new ATOM 125 N PRO A 63 2.019 -15.009 -17.934 1.00 0.00 N ATOM 126 CA PRO A 63 2.118 -15.763 -19.172 1.00 0.00 C ATOM 127 C PRO A 63 1.221 -15.160 -20.255 1.00 0.00 C ATOM 128 O PRO A 63 0.446 -14.243 -19.985 1.00 0.00 O ATOM 129 CB PRO A 63 1.728 -17.184 -18.801 1.00 0.00 C ATOM 130 CG PRO A 63 0.979 -17.079 -17.482 1.00 0.00 C ATOM 131 CD PRO A 63 1.230 -15.692 -16.913 1.00 0.00 C ATOM 0 HA PRO A 63 3.120 -15.739 -19.599 1.00 0.00 H new ATOM 0 HB2 PRO A 63 1.100 -17.631 -19.572 1.00 0.00 H new ATOM 0 HB3 PRO A 63 2.609 -17.817 -18.701 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -0.088 -17.242 -17.635 1.00 0.00 H new ATOM 0 HG3 PRO A 63 1.322 -17.845 -16.786 1.00 0.00 H new ATOM 0 HD2 PRO A 63 0.294 -15.168 -16.720 1.00 0.00 H new ATOM 0 HD3 PRO A 63 1.768 -15.744 -15.966 1.00 0.00 H new ATOM 279 N LEU B 406 -23.896 -2.066 -20.980 1.00 0.00 N ATOM 280 CA LEU B 406 -22.838 -2.524 -20.095 1.00 0.00 C ATOM 281 C LEU B 406 -22.427 -3.944 -20.489 1.00 0.00 C ATOM 282 O LEU B 406 -23.186 -4.653 -21.147 1.00 0.00 O ATOM 283 CB LEU B 406 -23.269 -2.392 -18.632 1.00 0.00 C ATOM 284 CG LEU B 406 -23.448 -3.703 -17.865 1.00 0.00 C ATOM 285 CD1 LEU B 406 -23.432 -3.462 -16.355 1.00 0.00 C ATOM 286 CD2 LEU B 406 -24.715 -4.433 -18.316 1.00 0.00 C ATOM 0 HA LEU B 406 -21.954 -1.895 -20.201 1.00 0.00 H new ATOM 0 HB2 LEU B 406 -22.529 -1.786 -18.109 1.00 0.00 H new ATOM 0 HB3 LEU B 406 -24.210 -1.844 -18.599 1.00 0.00 H new ATOM 0 HG LEU B 406 -22.603 -4.352 -18.096 1.00 0.00 H new ATOM 0 HD11 LEU B 406 -23.561 -4.411 -15.834 1.00 0.00 H new ATOM 0 HD12 LEU B 406 -22.479 -3.017 -16.068 1.00 0.00 H new ATOM 0 HD13 LEU B 406 -24.244 -2.787 -16.086 1.00 0.00 H new ATOM 0 HD21 LEU B 406 -24.819 -5.362 -17.755 1.00 0.00 H new ATOM 0 HD22 LEU B 406 -25.584 -3.800 -18.134 1.00 0.00 H new ATOM 0 HD23 LEU B 406 -24.646 -4.658 -19.380 1.00 0.00 H new ATOM 298 N PRO B 407 -21.194 -4.325 -20.059 1.00 0.00 N ATOM 299 CA PRO B 407 -20.673 -5.648 -20.361 1.00 0.00 C ATOM 300 C PRO B 407 -21.345 -6.713 -19.491 1.00 0.00 C ATOM 301 O PRO B 407 -21.488 -6.533 -18.283 1.00 0.00 O ATOM 302 CB PRO B 407 -19.176 -5.544 -20.122 1.00 0.00 C ATOM 303 CG PRO B 407 -18.976 -4.312 -19.255 1.00 0.00 C ATOM 304 CD PRO B 407 -20.268 -3.512 -19.278 1.00 0.00 C ATOM 0 HA PRO B 407 -20.879 -5.958 -21.385 1.00 0.00 H new ATOM 0 HB2 PRO B 407 -18.797 -6.437 -19.625 1.00 0.00 H new ATOM 0 HB3 PRO B 407 -18.636 -5.450 -21.064 1.00 0.00 H new ATOM 0 HG2 PRO B 407 -18.723 -4.600 -18.235 1.00 0.00 H new ATOM 0 HG3 PRO B 407 -18.148 -3.711 -19.631 1.00 0.00 H new ATOM 0 HD2 PRO B 407 -20.645 -3.340 -18.270 1.00 0.00 H new ATOM 0 HD3 PRO B 407 -20.119 -2.533 -19.734 1.00 0.00 H new ATOM 312 N PRO B 408 -21.749 -7.828 -20.157 1.00 0.00 N ATOM 313 CA PRO B 408 -22.401 -8.922 -19.459 1.00 0.00 C ATOM 314 C PRO B 408 -21.391 -9.733 -18.645 1.00 0.00 C ATOM 315 O PRO B 408 -20.252 -9.920 -19.071 1.00 0.00 O ATOM 316 CB PRO B 408 -23.077 -9.738 -20.549 1.00 0.00 C ATOM 317 CG PRO B 408 -22.397 -9.340 -21.849 1.00 0.00 C ATOM 318 CD PRO B 408 -21.596 -8.075 -21.588 1.00 0.00 C ATOM 0 HA PRO B 408 -23.132 -8.577 -18.727 1.00 0.00 H new ATOM 0 HB2 PRO B 408 -22.968 -10.806 -20.362 1.00 0.00 H new ATOM 0 HB3 PRO B 408 -24.146 -9.529 -20.587 1.00 0.00 H new ATOM 0 HG2 PRO B 408 -21.744 -10.140 -22.199 1.00 0.00 H new ATOM 0 HG3 PRO B 408 -23.138 -9.168 -22.630 1.00 0.00 H new ATOM 0 HD2 PRO B 408 -20.548 -8.207 -21.857 1.00 0.00 H new ATOM 0 HD3 PRO B 408 -21.973 -7.239 -22.177 1.00 0.00 H new ATOM 326 N GLY B 409 -21.843 -10.192 -17.488 1.00 0.00 N ATOM 327 CA GLY B 409 -20.993 -10.979 -16.610 1.00 0.00 C ATOM 328 C GLY B 409 -20.185 -10.076 -15.676 1.00 0.00 C ATOM 329 O GLY B 409 -19.717 -10.520 -14.629 1.00 0.00 O ATOM 0 H GLY B 409 -22.788 -10.034 -17.137 1.00 0.00 H new ATOM 0 HA2 GLY B 409 -21.605 -11.662 -16.021 1.00 0.00 H new ATOM 0 HA3 GLY B 409 -20.316 -11.591 -17.206 1.00 0.00 H new ATOM 333 N PHE B 410 -20.045 -8.825 -16.090 1.00 0.00 N ATOM 334 CA PHE B 410 -19.301 -7.855 -15.303 1.00 0.00 C ATOM 335 C PHE B 410 -19.509 -8.089 -13.805 1.00 0.00 C ATOM 336 O PHE B 410 -20.587 -8.504 -13.382 1.00 0.00 O ATOM 337 CB PHE B 410 -19.841 -6.472 -15.671 1.00 0.00 C ATOM 338 CG PHE B 410 -19.627 -5.412 -14.588 1.00 0.00 C ATOM 339 CD1 PHE B 410 -18.422 -4.795 -14.470 1.00 0.00 C ATOM 340 CD2 PHE B 410 -20.643 -5.088 -13.744 1.00 0.00 C ATOM 341 CE1 PHE B 410 -18.223 -3.811 -13.465 1.00 0.00 C ATOM 342 CE2 PHE B 410 -20.445 -4.105 -12.739 1.00 0.00 C ATOM 343 CZ PHE B 410 -19.239 -3.487 -12.621 1.00 0.00 C ATOM 0 H PHE B 410 -20.434 -8.461 -16.960 1.00 0.00 H new ATOM 0 HA PHE B 410 -18.235 -7.945 -15.513 1.00 0.00 H new ATOM 0 HB2 PHE B 410 -19.361 -6.139 -16.591 1.00 0.00 H new ATOM 0 HB3 PHE B 410 -20.908 -6.553 -15.880 1.00 0.00 H new ATOM 0 HD1 PHE B 410 -17.615 -5.053 -15.140 1.00 0.00 H new ATOM 0 HD2 PHE B 410 -21.601 -5.579 -13.838 1.00 0.00 H new ATOM 0 HE1 PHE B 410 -17.265 -3.320 -13.371 1.00 0.00 H new ATOM 0 HE2 PHE B 410 -21.252 -3.848 -12.068 1.00 0.00 H new ATOM 0 HZ PHE B 410 -19.088 -2.739 -11.857 1.00 0.00 H new ATOM 353 N MET B 411 -18.459 -7.813 -13.045 1.00 0.00 N ATOM 354 CA MET B 411 -18.513 -7.988 -11.603 1.00 0.00 C ATOM 355 C MET B 411 -18.613 -6.637 -10.891 1.00 0.00 C ATOM 356 O MET B 411 -19.669 -6.283 -10.370 1.00 0.00 O ATOM 357 CB MET B 411 -17.258 -8.723 -11.131 1.00 0.00 C ATOM 358 CG MET B 411 -17.156 -10.106 -11.778 1.00 0.00 C ATOM 359 SD MET B 411 -16.071 -11.150 -10.820 1.00 0.00 S ATOM 360 CE MET B 411 -15.007 -11.763 -12.115 1.00 0.00 C ATOM 0 H MET B 411 -17.567 -7.470 -13.400 1.00 0.00 H new ATOM 0 HA MET B 411 -19.400 -8.573 -11.359 1.00 0.00 H new ATOM 0 HB2 MET B 411 -16.374 -8.136 -11.379 1.00 0.00 H new ATOM 0 HB3 MET B 411 -17.279 -8.826 -10.046 1.00 0.00 H new ATOM 0 HG2 MET B 411 -18.145 -10.559 -11.844 1.00 0.00 H new ATOM 0 HG3 MET B 411 -16.779 -10.013 -12.796 1.00 0.00 H new ATOM 0 HE1 MET B 411 -13.970 -11.731 -11.780 1.00 0.00 H new ATOM 0 HE2 MET B 411 -15.279 -12.791 -12.353 1.00 0.00 H new ATOM 0 HE3 MET B 411 -15.121 -11.142 -13.004 1.00 0.00 H new ATOM 370 N PHE B 412 -17.498 -5.920 -10.892 1.00 0.00 N ATOM 371 CA PHE B 412 -17.446 -4.618 -10.251 1.00 0.00 C ATOM 372 C PHE B 412 -16.379 -3.731 -10.897 1.00 0.00 C ATOM 373 O PHE B 412 -15.701 -4.152 -11.833 1.00 0.00 O ATOM 374 CB PHE B 412 -17.077 -4.854 -8.786 1.00 0.00 C ATOM 375 CG PHE B 412 -15.906 -5.819 -8.587 1.00 0.00 C ATOM 376 CD1 PHE B 412 -14.632 -5.346 -8.562 1.00 0.00 C ATOM 377 CD2 PHE B 412 -16.140 -7.150 -8.436 1.00 0.00 C ATOM 378 CE1 PHE B 412 -13.545 -6.242 -8.378 1.00 0.00 C ATOM 379 CE2 PHE B 412 -15.054 -8.046 -8.251 1.00 0.00 C ATOM 380 CZ PHE B 412 -13.779 -7.573 -8.226 1.00 0.00 C ATOM 0 H PHE B 412 -16.624 -6.217 -11.327 1.00 0.00 H new ATOM 0 HA PHE B 412 -18.408 -4.116 -10.352 1.00 0.00 H new ATOM 0 HB2 PHE B 412 -16.829 -3.898 -8.326 1.00 0.00 H new ATOM 0 HB3 PHE B 412 -17.949 -5.244 -8.261 1.00 0.00 H new ATOM 0 HD1 PHE B 412 -14.446 -4.289 -8.682 1.00 0.00 H new ATOM 0 HD2 PHE B 412 -17.152 -7.526 -8.457 1.00 0.00 H new ATOM 0 HE1 PHE B 412 -12.533 -5.866 -8.359 1.00 0.00 H new ATOM 0 HE2 PHE B 412 -15.240 -9.103 -8.130 1.00 0.00 H new ATOM 0 HZ PHE B 412 -12.953 -8.254 -8.085 1.00 0.00 H new ATOM 390 N LYS B 413 -16.264 -2.521 -10.371 1.00 0.00 N ATOM 391 CA LYS B 413 -15.291 -1.571 -10.885 1.00 0.00 C ATOM 392 C LYS B 413 -14.100 -1.500 -9.928 1.00 0.00 C ATOM 393 O LYS B 413 -14.278 -1.441 -8.712 1.00 0.00 O ATOM 394 CB LYS B 413 -15.952 -0.216 -11.147 1.00 0.00 C ATOM 395 CG LYS B 413 -15.725 0.235 -12.591 1.00 0.00 C ATOM 396 CD LYS B 413 -14.265 0.632 -12.818 1.00 0.00 C ATOM 397 CE LYS B 413 -13.779 1.585 -11.725 1.00 0.00 C ATOM 398 NZ LYS B 413 -14.745 2.690 -11.534 1.00 0.00 N ATOM 0 H LYS B 413 -16.828 -2.176 -9.594 1.00 0.00 H new ATOM 0 HA LYS B 413 -14.906 -1.903 -11.849 1.00 0.00 H new ATOM 0 HB2 LYS B 413 -17.021 -0.285 -10.948 1.00 0.00 H new ATOM 0 HB3 LYS B 413 -15.547 0.529 -10.462 1.00 0.00 H new ATOM 0 HG2 LYS B 413 -15.997 -0.570 -13.274 1.00 0.00 H new ATOM 0 HG3 LYS B 413 -16.375 1.080 -12.818 1.00 0.00 H new ATOM 0 HD2 LYS B 413 -13.640 -0.261 -12.831 1.00 0.00 H new ATOM 0 HD3 LYS B 413 -14.161 1.108 -13.793 1.00 0.00 H new ATOM 0 HE2 LYS B 413 -13.651 1.040 -10.790 1.00 0.00 H new ATOM 0 HE3 LYS B 413 -12.803 1.989 -11.994 1.00 0.00 H new ATOM 0 HZ1 LYS B 413 -14.231 3.564 -11.302 1.00 0.00 H new ATOM 0 HZ2 LYS B 413 -15.289 2.830 -12.409 1.00 0.00 H new ATOM 0 HZ3 LYS B 413 -15.394 2.453 -10.757 1.00 0.00 H new ATOM 412 N VAL B 414 -12.911 -1.507 -10.512 1.00 0.00 N ATOM 413 CA VAL B 414 -11.690 -1.446 -9.726 1.00 0.00 C ATOM 414 C VAL B 414 -10.904 -0.191 -10.111 1.00 0.00 C ATOM 415 O VAL B 414 -11.217 0.462 -11.105 1.00 0.00 O ATOM 416 CB VAL B 414 -10.885 -2.734 -9.908 1.00 0.00 C ATOM 417 CG1 VAL B 414 -11.783 -3.966 -9.771 1.00 0.00 C ATOM 418 CG2 VAL B 414 -10.151 -2.737 -11.250 1.00 0.00 C ATOM 0 H VAL B 414 -12.767 -1.554 -11.521 1.00 0.00 H new ATOM 0 HA VAL B 414 -11.923 -1.372 -8.664 1.00 0.00 H new ATOM 0 HB VAL B 414 -10.136 -2.776 -9.117 1.00 0.00 H new ATOM 0 HG11 VAL B 414 -11.186 -4.868 -9.905 1.00 0.00 H new ATOM 0 HG12 VAL B 414 -12.239 -3.976 -8.781 1.00 0.00 H new ATOM 0 HG13 VAL B 414 -12.565 -3.933 -10.530 1.00 0.00 H new ATOM 0 HG21 VAL B 414 -9.587 -3.664 -11.354 1.00 0.00 H new ATOM 0 HG22 VAL B 414 -10.875 -2.660 -12.061 1.00 0.00 H new ATOM 0 HG23 VAL B 414 -9.467 -1.889 -11.293 1.00 0.00 H new ATOM 428 N GLN B 415 -9.899 0.110 -9.302 1.00 0.00 N ATOM 429 CA GLN B 415 -9.065 1.275 -9.545 1.00 0.00 C ATOM 430 C GLN B 415 -7.586 0.908 -9.406 1.00 0.00 C ATOM 431 O GLN B 415 -7.188 0.282 -8.425 1.00 0.00 O ATOM 432 CB GLN B 415 -9.437 2.421 -8.602 1.00 0.00 C ATOM 433 CG GLN B 415 -8.403 3.547 -8.673 1.00 0.00 C ATOM 434 CD GLN B 415 -9.006 4.806 -9.300 1.00 0.00 C ATOM 435 OE1 GLN B 415 -9.915 5.421 -8.767 1.00 0.00 O ATOM 436 NE2 GLN B 415 -8.452 5.152 -10.458 1.00 0.00 N ATOM 0 H GLN B 415 -9.643 -0.433 -8.477 1.00 0.00 H new ATOM 0 HA GLN B 415 -9.239 1.616 -10.565 1.00 0.00 H new ATOM 0 HB2 GLN B 415 -10.421 2.809 -8.866 1.00 0.00 H new ATOM 0 HB3 GLN B 415 -9.505 2.048 -7.580 1.00 0.00 H new ATOM 0 HG2 GLN B 415 -8.038 3.774 -7.671 1.00 0.00 H new ATOM 0 HG3 GLN B 415 -7.544 3.220 -9.259 1.00 0.00 H new ATOM 0 HE21 GLN B 415 -7.694 4.592 -10.848 1.00 0.00 H new ATOM 0 HE22 GLN B 415 -8.785 5.977 -10.956 1.00 0.00 H new ATOM 445 N ALA B 416 -6.813 1.314 -10.402 1.00 0.00 N ATOM 446 CA ALA B 416 -5.387 1.035 -10.403 1.00 0.00 C ATOM 447 C ALA B 416 -4.688 1.970 -9.414 1.00 0.00 C ATOM 448 O ALA B 416 -5.084 3.125 -9.259 1.00 0.00 O ATOM 449 CB ALA B 416 -4.840 1.177 -11.825 1.00 0.00 C ATOM 0 H ALA B 416 -7.147 1.834 -11.214 1.00 0.00 H new ATOM 0 HA ALA B 416 -5.196 0.011 -10.081 1.00 0.00 H new ATOM 0 HB1 ALA B 416 -3.770 0.968 -11.826 1.00 0.00 H new ATOM 0 HB2 ALA B 416 -5.348 0.472 -12.482 1.00 0.00 H new ATOM 0 HB3 ALA B 416 -5.011 2.193 -12.181 1.00 0.00 H new ATOM 455 N GLN B 417 -3.661 1.437 -8.769 1.00 0.00 N ATOM 456 CA GLN B 417 -2.903 2.209 -7.799 1.00 0.00 C ATOM 457 C GLN B 417 -1.460 2.389 -8.274 1.00 0.00 C ATOM 458 O GLN B 417 -0.656 3.029 -7.599 1.00 0.00 O ATOM 459 CB GLN B 417 -2.948 1.551 -6.419 1.00 0.00 C ATOM 460 CG GLN B 417 -4.276 0.821 -6.202 1.00 0.00 C ATOM 461 CD GLN B 417 -4.393 0.312 -4.764 1.00 0.00 C ATOM 462 OE1 GLN B 417 -4.422 1.071 -3.810 1.00 0.00 O ATOM 463 NE2 GLN B 417 -4.459 -1.013 -4.663 1.00 0.00 N ATOM 0 H GLN B 417 -3.336 0.479 -8.899 1.00 0.00 H new ATOM 0 HA GLN B 417 -3.361 3.194 -7.711 1.00 0.00 H new ATOM 0 HB2 GLN B 417 -2.122 0.847 -6.321 1.00 0.00 H new ATOM 0 HB3 GLN B 417 -2.815 2.308 -5.647 1.00 0.00 H new ATOM 0 HG2 GLN B 417 -5.105 1.494 -6.422 1.00 0.00 H new ATOM 0 HG3 GLN B 417 -4.352 -0.017 -6.895 1.00 0.00 H new ATOM 0 HE21 GLN B 417 -4.429 -1.591 -5.503 1.00 0.00 H new ATOM 0 HE22 GLN B 417 -4.539 -1.451 -3.745 1.00 0.00 H new ATOM 472 N HIS B 418 -1.176 1.811 -9.432 1.00 0.00 N ATOM 473 CA HIS B 418 0.157 1.900 -10.005 1.00 0.00 C ATOM 474 C HIS B 418 0.055 1.984 -11.530 1.00 0.00 C ATOM 475 O HIS B 418 -1.020 1.788 -12.095 1.00 0.00 O ATOM 476 CB HIS B 418 1.030 0.736 -9.533 1.00 0.00 C ATOM 477 CG HIS B 418 1.333 0.757 -8.053 1.00 0.00 C ATOM 478 ND1 HIS B 418 2.515 1.258 -7.537 1.00 0.00 N ATOM 479 CD2 HIS B 418 0.595 0.334 -6.987 1.00 0.00 C ATOM 480 CE1 HIS B 418 2.479 1.136 -6.218 1.00 0.00 C ATOM 481 NE2 HIS B 418 1.289 0.563 -5.879 1.00 0.00 N ATOM 0 H HIS B 418 -1.845 1.280 -9.989 1.00 0.00 H new ATOM 0 HA HIS B 418 0.646 2.810 -9.657 1.00 0.00 H new ATOM 0 HB2 HIS B 418 0.531 -0.202 -9.778 1.00 0.00 H new ATOM 0 HB3 HIS B 418 1.969 0.752 -10.086 1.00 0.00 H new ATOM 0 HD2 HIS B 418 -0.388 -0.112 -7.036 1.00 0.00 H new ATOM 0 HE1 HIS B 418 3.256 1.438 -5.532 1.00 0.00 H new ATOM 0 HE2 HIS B 418 0.983 0.346 -4.931 1.00 0.00 H new ATOM 489 N ASP B 419 1.188 2.275 -12.151 1.00 0.00 N ATOM 490 CA ASP B 419 1.240 2.387 -13.599 1.00 0.00 C ATOM 491 C ASP B 419 2.073 1.236 -14.165 1.00 0.00 C ATOM 492 O ASP B 419 3.301 1.262 -14.099 1.00 0.00 O ATOM 493 CB ASP B 419 1.897 3.701 -14.027 1.00 0.00 C ATOM 494 CG ASP B 419 3.394 3.803 -13.729 1.00 0.00 C ATOM 495 OD1 ASP B 419 3.730 3.879 -12.528 1.00 0.00 O ATOM 496 OD2 ASP B 419 4.169 3.802 -14.710 1.00 0.00 O ATOM 0 H ASP B 419 2.077 2.437 -11.678 1.00 0.00 H new ATOM 0 HA ASP B 419 0.218 2.355 -13.977 1.00 0.00 H new ATOM 0 HB2 ASP B 419 1.745 3.833 -15.098 1.00 0.00 H new ATOM 0 HB3 ASP B 419 1.386 4.525 -13.528 1.00 0.00 H new ATOM 501 N TYR B 420 1.372 0.253 -14.710 1.00 0.00 N ATOM 502 CA TYR B 420 2.032 -0.906 -15.287 1.00 0.00 C ATOM 503 C TYR B 420 1.767 -0.996 -16.792 1.00 0.00 C ATOM 504 O TYR B 420 0.623 -1.154 -17.216 1.00 0.00 O ATOM 505 CB TYR B 420 1.418 -2.127 -14.600 1.00 0.00 C ATOM 506 CG TYR B 420 1.413 -3.390 -15.463 1.00 0.00 C ATOM 507 CD1 TYR B 420 2.582 -4.096 -15.661 1.00 0.00 C ATOM 508 CD2 TYR B 420 0.238 -3.824 -16.044 1.00 0.00 C ATOM 509 CE1 TYR B 420 2.578 -5.285 -16.473 1.00 0.00 C ATOM 510 CE2 TYR B 420 0.234 -5.013 -16.857 1.00 0.00 C ATOM 511 CZ TYR B 420 1.404 -5.685 -17.031 1.00 0.00 C ATOM 512 OH TYR B 420 1.399 -6.808 -17.798 1.00 0.00 O ATOM 0 H TYR B 420 0.354 0.235 -14.764 1.00 0.00 H new ATOM 0 HA TYR B 420 3.111 -0.844 -15.143 1.00 0.00 H new ATOM 0 HB2 TYR B 420 1.969 -2.329 -13.681 1.00 0.00 H new ATOM 0 HB3 TYR B 420 0.393 -1.892 -14.312 1.00 0.00 H new ATOM 0 HD1 TYR B 420 3.501 -3.756 -15.206 1.00 0.00 H new ATOM 0 HD2 TYR B 420 -0.677 -3.272 -15.889 1.00 0.00 H new ATOM 0 HE1 TYR B 420 3.486 -5.846 -16.635 1.00 0.00 H new ATOM 0 HE2 TYR B 420 -0.678 -5.363 -17.318 1.00 0.00 H new ATOM 0 HH TYR B 420 1.043 -7.558 -17.277 1.00 0.00 H new ATOM 522 N THR B 421 2.844 -0.890 -17.557 1.00 0.00 N ATOM 523 CA THR B 421 2.742 -0.958 -19.005 1.00 0.00 C ATOM 524 C THR B 421 2.690 -2.415 -19.468 1.00 0.00 C ATOM 525 O THR B 421 3.667 -3.149 -19.331 1.00 0.00 O ATOM 526 CB THR B 421 3.913 -0.173 -19.598 1.00 0.00 C ATOM 527 OG1 THR B 421 3.454 1.176 -19.615 1.00 0.00 O ATOM 528 CG2 THR B 421 4.153 -0.504 -21.073 1.00 0.00 C ATOM 0 H THR B 421 3.791 -0.758 -17.202 1.00 0.00 H new ATOM 0 HA THR B 421 1.816 -0.505 -19.358 1.00 0.00 H new ATOM 0 HB THR B 421 4.817 -0.384 -19.027 1.00 0.00 H new ATOM 0 HG1 THR B 421 4.153 1.755 -19.984 1.00 0.00 H new ATOM 0 HG21 THR B 421 4.995 0.080 -21.445 1.00 0.00 H new ATOM 0 HG22 THR B 421 4.375 -1.566 -21.176 1.00 0.00 H new ATOM 0 HG23 THR B 421 3.261 -0.262 -21.650 1.00 0.00 H new ATOM 536 N ALA B 422 1.539 -2.790 -20.007 1.00 0.00 N ATOM 537 CA ALA B 422 1.347 -4.147 -20.492 1.00 0.00 C ATOM 538 C ALA B 422 1.191 -4.123 -22.013 1.00 0.00 C ATOM 539 O ALA B 422 0.241 -3.540 -22.534 1.00 0.00 O ATOM 540 CB ALA B 422 0.139 -4.773 -19.791 1.00 0.00 C ATOM 0 H ALA B 422 0.730 -2.178 -20.119 1.00 0.00 H new ATOM 0 HA ALA B 422 2.215 -4.764 -20.260 1.00 0.00 H new ATOM 0 HB1 ALA B 422 -0.006 -5.790 -20.154 1.00 0.00 H new ATOM 0 HB2 ALA B 422 0.313 -4.793 -18.715 1.00 0.00 H new ATOM 0 HB3 ALA B 422 -0.752 -4.182 -20.004 1.00 0.00 H new ATOM 546 N THR B 423 2.137 -4.764 -22.684 1.00 0.00 N ATOM 547 CA THR B 423 2.117 -4.823 -24.135 1.00 0.00 C ATOM 548 C THR B 423 2.029 -6.275 -24.609 1.00 0.00 C ATOM 549 O THR B 423 3.047 -6.952 -24.740 1.00 0.00 O ATOM 550 CB THR B 423 3.354 -4.088 -24.655 1.00 0.00 C ATOM 551 OG1 THR B 423 4.434 -4.672 -23.932 1.00 0.00 O ATOM 552 CG2 THR B 423 3.379 -2.616 -24.239 1.00 0.00 C ATOM 0 H THR B 423 2.923 -5.247 -22.249 1.00 0.00 H new ATOM 0 HA THR B 423 1.233 -4.328 -24.539 1.00 0.00 H new ATOM 0 HB THR B 423 3.387 -4.158 -25.742 1.00 0.00 H new ATOM 0 HG1 THR B 423 4.411 -5.646 -24.040 1.00 0.00 H new ATOM 0 HG21 THR B 423 4.277 -2.141 -24.634 1.00 0.00 H new ATOM 0 HG22 THR B 423 2.498 -2.111 -24.635 1.00 0.00 H new ATOM 0 HG23 THR B 423 3.380 -2.545 -23.151 1.00 0.00 H new ATOM 560 N ASP B 424 0.801 -6.711 -24.853 1.00 0.00 N ATOM 561 CA ASP B 424 0.567 -8.070 -25.308 1.00 0.00 C ATOM 562 C ASP B 424 -0.565 -8.071 -26.338 1.00 0.00 C ATOM 563 O ASP B 424 -1.058 -7.012 -26.724 1.00 0.00 O ATOM 564 CB ASP B 424 0.150 -8.976 -24.147 1.00 0.00 C ATOM 565 CG ASP B 424 0.628 -10.425 -24.254 1.00 0.00 C ATOM 566 OD1 ASP B 424 1.715 -10.623 -24.839 1.00 0.00 O ATOM 567 OD2 ASP B 424 -0.104 -11.303 -23.748 1.00 0.00 O ATOM 0 H ASP B 424 -0.042 -6.147 -24.744 1.00 0.00 H new ATOM 0 HA ASP B 424 1.494 -8.444 -25.743 1.00 0.00 H new ATOM 0 HB2 ASP B 424 0.532 -8.551 -23.219 1.00 0.00 H new ATOM 0 HB3 ASP B 424 -0.938 -8.972 -24.076 1.00 0.00 H new ATOM 572 N THR B 425 -0.944 -9.270 -26.753 1.00 0.00 N ATOM 573 CA THR B 425 -2.008 -9.422 -27.731 1.00 0.00 C ATOM 574 C THR B 425 -3.365 -9.520 -27.030 1.00 0.00 C ATOM 575 O THR B 425 -4.399 -9.635 -27.686 1.00 0.00 O ATOM 576 CB THR B 425 -1.683 -10.640 -28.598 1.00 0.00 C ATOM 577 OG1 THR B 425 -2.676 -10.613 -29.620 1.00 0.00 O ATOM 578 CG2 THR B 425 -1.934 -11.962 -27.870 1.00 0.00 C ATOM 0 H THR B 425 -0.533 -10.146 -26.430 1.00 0.00 H new ATOM 0 HA THR B 425 -2.075 -8.550 -28.382 1.00 0.00 H new ATOM 0 HB THR B 425 -0.641 -10.592 -28.914 1.00 0.00 H new ATOM 0 HG1 THR B 425 -3.519 -10.280 -29.248 1.00 0.00 H new ATOM 0 HG21 THR B 425 -1.687 -12.793 -28.530 1.00 0.00 H new ATOM 0 HG22 THR B 425 -1.310 -12.010 -26.977 1.00 0.00 H new ATOM 0 HG23 THR B 425 -2.984 -12.026 -27.583 1.00 0.00 H new ATOM 586 N ASP B 426 -3.317 -9.470 -25.707 1.00 0.00 N ATOM 587 CA ASP B 426 -4.529 -9.553 -24.911 1.00 0.00 C ATOM 588 C ASP B 426 -4.244 -9.034 -23.500 1.00 0.00 C ATOM 589 O ASP B 426 -4.837 -9.504 -22.530 1.00 0.00 O ATOM 590 CB ASP B 426 -5.013 -11.000 -24.793 1.00 0.00 C ATOM 591 CG ASP B 426 -6.417 -11.259 -25.342 1.00 0.00 C ATOM 592 OD1 ASP B 426 -7.370 -10.718 -24.740 1.00 0.00 O ATOM 593 OD2 ASP B 426 -6.506 -11.992 -26.351 1.00 0.00 O ATOM 0 H ASP B 426 -2.457 -9.373 -25.166 1.00 0.00 H new ATOM 0 HA ASP B 426 -5.296 -8.955 -25.402 1.00 0.00 H new ATOM 0 HB2 ASP B 426 -4.309 -11.647 -25.317 1.00 0.00 H new ATOM 0 HB3 ASP B 426 -4.991 -11.290 -23.743 1.00 0.00 H new ATOM 598 N GLU B 427 -3.336 -8.071 -23.431 1.00 0.00 N ATOM 599 CA GLU B 427 -2.965 -7.483 -22.155 1.00 0.00 C ATOM 600 C GLU B 427 -3.832 -6.256 -21.864 1.00 0.00 C ATOM 601 O GLU B 427 -4.573 -5.796 -22.731 1.00 0.00 O ATOM 602 CB GLU B 427 -1.479 -7.123 -22.128 1.00 0.00 C ATOM 603 CG GLU B 427 -0.713 -8.024 -21.158 1.00 0.00 C ATOM 604 CD GLU B 427 -1.405 -8.075 -19.794 1.00 0.00 C ATOM 605 OE1 GLU B 427 -1.571 -6.987 -19.201 1.00 0.00 O ATOM 606 OE2 GLU B 427 -1.753 -9.200 -19.376 1.00 0.00 O ATOM 0 H GLU B 427 -2.847 -7.684 -24.238 1.00 0.00 H new ATOM 0 HA GLU B 427 -3.140 -8.221 -21.373 1.00 0.00 H new ATOM 0 HB2 GLU B 427 -1.059 -7.221 -23.129 1.00 0.00 H new ATOM 0 HB3 GLU B 427 -1.359 -6.081 -21.833 1.00 0.00 H new ATOM 0 HG2 GLU B 427 -0.641 -9.030 -21.571 1.00 0.00 H new ATOM 0 HG3 GLU B 427 0.305 -7.654 -21.039 1.00 0.00 H new ATOM 613 N LEU B 428 -3.711 -5.761 -20.641 1.00 0.00 N ATOM 614 CA LEU B 428 -4.474 -4.597 -20.226 1.00 0.00 C ATOM 615 C LEU B 428 -3.541 -3.600 -19.536 1.00 0.00 C ATOM 616 O LEU B 428 -3.018 -3.878 -18.458 1.00 0.00 O ATOM 617 CB LEU B 428 -5.668 -5.018 -19.366 1.00 0.00 C ATOM 618 CG LEU B 428 -6.968 -4.246 -19.600 1.00 0.00 C ATOM 619 CD1 LEU B 428 -6.728 -2.736 -19.536 1.00 0.00 C ATOM 620 CD2 LEU B 428 -7.627 -4.667 -20.915 1.00 0.00 C ATOM 0 H LEU B 428 -3.096 -6.145 -19.924 1.00 0.00 H new ATOM 0 HA LEU B 428 -4.897 -4.090 -21.093 1.00 0.00 H new ATOM 0 HB2 LEU B 428 -5.861 -6.077 -19.540 1.00 0.00 H new ATOM 0 HB3 LEU B 428 -5.390 -4.913 -18.317 1.00 0.00 H new ATOM 0 HG LEU B 428 -7.663 -4.496 -18.798 1.00 0.00 H new ATOM 0 HD11 LEU B 428 -7.668 -2.211 -19.706 1.00 0.00 H new ATOM 0 HD12 LEU B 428 -6.336 -2.471 -18.554 1.00 0.00 H new ATOM 0 HD13 LEU B 428 -6.009 -2.449 -20.303 1.00 0.00 H new ATOM 0 HD21 LEU B 428 -8.549 -4.103 -21.057 1.00 0.00 H new ATOM 0 HD22 LEU B 428 -6.948 -4.466 -21.743 1.00 0.00 H new ATOM 0 HD23 LEU B 428 -7.855 -5.732 -20.883 1.00 0.00 H new ATOM 632 N GLN B 429 -3.360 -2.460 -20.186 1.00 0.00 N ATOM 633 CA GLN B 429 -2.500 -1.420 -19.648 1.00 0.00 C ATOM 634 C GLN B 429 -3.208 -0.681 -18.511 1.00 0.00 C ATOM 635 O GLN B 429 -4.385 -0.343 -18.624 1.00 0.00 O ATOM 636 CB GLN B 429 -2.063 -0.447 -20.746 1.00 0.00 C ATOM 637 CG GLN B 429 -0.732 0.219 -20.391 1.00 0.00 C ATOM 638 CD GLN B 429 0.062 0.563 -21.653 1.00 0.00 C ATOM 639 OE1 GLN B 429 0.300 1.716 -21.972 1.00 0.00 O ATOM 640 NE2 GLN B 429 0.458 -0.499 -22.349 1.00 0.00 N ATOM 0 H GLN B 429 -3.794 -2.234 -21.081 1.00 0.00 H new ATOM 0 HA GLN B 429 -1.602 -1.890 -19.246 1.00 0.00 H new ATOM 0 HB2 GLN B 429 -1.966 -0.980 -21.692 1.00 0.00 H new ATOM 0 HB3 GLN B 429 -2.829 0.316 -20.887 1.00 0.00 H new ATOM 0 HG2 GLN B 429 -0.917 1.126 -19.815 1.00 0.00 H new ATOM 0 HG3 GLN B 429 -0.145 -0.447 -19.758 1.00 0.00 H new ATOM 0 HE21 GLN B 429 0.224 -1.437 -22.025 1.00 0.00 H new ATOM 0 HE22 GLN B 429 0.996 -0.375 -23.207 1.00 0.00 H new ATOM 649 N LEU B 430 -2.460 -0.453 -17.441 1.00 0.00 N ATOM 650 CA LEU B 430 -3.002 0.240 -16.284 1.00 0.00 C ATOM 651 C LEU B 430 -2.108 1.434 -15.946 1.00 0.00 C ATOM 652 O LEU B 430 -0.893 1.378 -16.133 1.00 0.00 O ATOM 653 CB LEU B 430 -3.195 -0.733 -15.119 1.00 0.00 C ATOM 654 CG LEU B 430 -4.613 -1.274 -14.926 1.00 0.00 C ATOM 655 CD1 LEU B 430 -5.542 -0.192 -14.371 1.00 0.00 C ATOM 656 CD2 LEU B 430 -5.151 -1.881 -16.223 1.00 0.00 C ATOM 0 H LEU B 430 -1.484 -0.736 -17.351 1.00 0.00 H new ATOM 0 HA LEU B 430 -3.993 0.636 -16.506 1.00 0.00 H new ATOM 0 HB2 LEU B 430 -2.521 -1.578 -15.262 1.00 0.00 H new ATOM 0 HB3 LEU B 430 -2.890 -0.233 -14.200 1.00 0.00 H new ATOM 0 HG LEU B 430 -4.574 -2.075 -14.188 1.00 0.00 H new ATOM 0 HD11 LEU B 430 -6.544 -0.603 -14.243 1.00 0.00 H new ATOM 0 HD12 LEU B 430 -5.165 0.152 -13.408 1.00 0.00 H new ATOM 0 HD13 LEU B 430 -5.580 0.647 -15.066 1.00 0.00 H new ATOM 0 HD21 LEU B 430 -6.160 -2.258 -16.057 1.00 0.00 H new ATOM 0 HD22 LEU B 430 -5.172 -1.118 -17.001 1.00 0.00 H new ATOM 0 HD23 LEU B 430 -4.505 -2.701 -16.537 1.00 0.00 H new ATOM 668 N LYS B 431 -2.743 2.487 -15.453 1.00 0.00 N ATOM 669 CA LYS B 431 -2.020 3.693 -15.085 1.00 0.00 C ATOM 670 C LYS B 431 -2.411 4.104 -13.665 1.00 0.00 C ATOM 671 O LYS B 431 -3.593 4.260 -13.363 1.00 0.00 O ATOM 672 CB LYS B 431 -2.244 4.791 -16.127 1.00 0.00 C ATOM 673 CG LYS B 431 -3.681 5.315 -16.070 1.00 0.00 C ATOM 674 CD LYS B 431 -4.332 5.282 -17.454 1.00 0.00 C ATOM 675 CE LYS B 431 -5.844 5.495 -17.354 1.00 0.00 C ATOM 676 NZ LYS B 431 -6.215 6.826 -17.885 1.00 0.00 N ATOM 0 H LYS B 431 -3.750 2.530 -15.300 1.00 0.00 H new ATOM 0 HA LYS B 431 -0.946 3.506 -15.078 1.00 0.00 H new ATOM 0 HB2 LYS B 431 -1.547 5.611 -15.953 1.00 0.00 H new ATOM 0 HB3 LYS B 431 -2.034 4.401 -17.123 1.00 0.00 H new ATOM 0 HG2 LYS B 431 -4.265 4.711 -15.375 1.00 0.00 H new ATOM 0 HG3 LYS B 431 -3.685 6.335 -15.687 1.00 0.00 H new ATOM 0 HD2 LYS B 431 -3.893 6.055 -18.085 1.00 0.00 H new ATOM 0 HD3 LYS B 431 -4.127 4.325 -17.934 1.00 0.00 H new ATOM 0 HE2 LYS B 431 -6.365 4.716 -17.911 1.00 0.00 H new ATOM 0 HE3 LYS B 431 -6.162 5.410 -16.315 1.00 0.00 H new ATOM 0 HZ1 LYS B 431 -7.244 6.955 -17.810 1.00 0.00 H new ATOM 0 HZ2 LYS B 431 -5.732 7.566 -17.336 1.00 0.00 H new ATOM 0 HZ3 LYS B 431 -5.929 6.894 -18.883 1.00 0.00 H new ATOM 690 N ALA B 432 -1.396 4.269 -12.830 1.00 0.00 N ATOM 691 CA ALA B 432 -1.619 4.659 -11.448 1.00 0.00 C ATOM 692 C ALA B 432 -2.827 5.595 -11.376 1.00 0.00 C ATOM 693 O ALA B 432 -2.704 6.793 -11.627 1.00 0.00 O ATOM 694 CB ALA B 432 -0.348 5.302 -10.888 1.00 0.00 C ATOM 0 H ALA B 432 -0.417 4.140 -13.084 1.00 0.00 H new ATOM 0 HA ALA B 432 -1.841 3.787 -10.833 1.00 0.00 H new ATOM 0 HB1 ALA B 432 -0.515 5.595 -9.851 1.00 0.00 H new ATOM 0 HB2 ALA B 432 0.473 4.587 -10.935 1.00 0.00 H new ATOM 0 HB3 ALA B 432 -0.096 6.183 -11.478 1.00 0.00 H new ATOM 700 N GLY B 433 -3.966 5.013 -11.031 1.00 0.00 N ATOM 701 CA GLY B 433 -5.195 5.780 -10.921 1.00 0.00 C ATOM 702 C GLY B 433 -6.073 5.589 -12.159 1.00 0.00 C ATOM 703 O GLY B 433 -6.527 6.562 -12.759 1.00 0.00 O ATOM 0 H GLY B 433 -4.064 4.019 -10.824 1.00 0.00 H new ATOM 0 HA2 GLY B 433 -5.743 5.470 -10.031 1.00 0.00 H new ATOM 0 HA3 GLY B 433 -4.959 6.837 -10.798 1.00 0.00 H new ATOM 707 N ASP B 434 -6.286 4.328 -12.505 1.00 0.00 N ATOM 708 CA ASP B 434 -7.101 3.996 -13.662 1.00 0.00 C ATOM 709 C ASP B 434 -8.383 3.305 -13.196 1.00 0.00 C ATOM 710 O ASP B 434 -8.529 2.989 -12.016 1.00 0.00 O ATOM 711 CB ASP B 434 -6.362 3.039 -14.600 1.00 0.00 C ATOM 712 CG ASP B 434 -6.794 3.108 -16.066 1.00 0.00 C ATOM 713 OD1 ASP B 434 -7.967 3.476 -16.295 1.00 0.00 O ATOM 714 OD2 ASP B 434 -5.943 2.791 -16.924 1.00 0.00 O ATOM 0 H ASP B 434 -5.908 3.523 -12.005 1.00 0.00 H new ATOM 0 HA ASP B 434 -7.325 4.921 -14.193 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -5.294 3.249 -14.541 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -6.506 2.020 -14.242 1.00 0.00 H new ATOM 719 N VAL B 435 -9.281 3.089 -14.146 1.00 0.00 N ATOM 720 CA VAL B 435 -10.546 2.441 -13.848 1.00 0.00 C ATOM 721 C VAL B 435 -10.670 1.165 -14.683 1.00 0.00 C ATOM 722 O VAL B 435 -10.634 1.217 -15.912 1.00 0.00 O ATOM 723 CB VAL B 435 -11.701 3.418 -14.074 1.00 0.00 C ATOM 724 CG1 VAL B 435 -12.039 4.175 -12.788 1.00 0.00 C ATOM 725 CG2 VAL B 435 -11.383 4.389 -15.214 1.00 0.00 C ATOM 0 H VAL B 435 -9.157 3.352 -15.124 1.00 0.00 H new ATOM 0 HA VAL B 435 -10.587 2.148 -12.799 1.00 0.00 H new ATOM 0 HB VAL B 435 -12.578 2.838 -14.362 1.00 0.00 H new ATOM 0 HG11 VAL B 435 -12.863 4.863 -12.977 1.00 0.00 H new ATOM 0 HG12 VAL B 435 -12.329 3.465 -12.013 1.00 0.00 H new ATOM 0 HG13 VAL B 435 -11.166 4.737 -12.457 1.00 0.00 H new ATOM 0 HG21 VAL B 435 -12.220 5.073 -15.354 1.00 0.00 H new ATOM 0 HG22 VAL B 435 -10.487 4.959 -14.968 1.00 0.00 H new ATOM 0 HG23 VAL B 435 -11.215 3.828 -16.133 1.00 0.00 H new ATOM 735 N VAL B 436 -10.814 0.049 -13.984 1.00 0.00 N ATOM 736 CA VAL B 436 -10.945 -1.238 -14.645 1.00 0.00 C ATOM 737 C VAL B 436 -12.133 -1.994 -14.049 1.00 0.00 C ATOM 738 O VAL B 436 -12.324 -2.000 -12.834 1.00 0.00 O ATOM 739 CB VAL B 436 -9.630 -2.014 -14.545 1.00 0.00 C ATOM 740 CG1 VAL B 436 -9.702 -3.319 -15.341 1.00 0.00 C ATOM 741 CG2 VAL B 436 -8.450 -1.155 -15.004 1.00 0.00 C ATOM 0 H VAL B 436 -10.843 0.010 -12.965 1.00 0.00 H new ATOM 0 HA VAL B 436 -11.147 -1.103 -15.708 1.00 0.00 H new ATOM 0 HB VAL B 436 -9.470 -2.269 -13.497 1.00 0.00 H new ATOM 0 HG11 VAL B 436 -8.755 -3.851 -15.253 1.00 0.00 H new ATOM 0 HG12 VAL B 436 -10.506 -3.941 -14.948 1.00 0.00 H new ATOM 0 HG13 VAL B 436 -9.897 -3.095 -16.390 1.00 0.00 H new ATOM 0 HG21 VAL B 436 -7.528 -1.730 -14.923 1.00 0.00 H new ATOM 0 HG22 VAL B 436 -8.600 -0.855 -16.041 1.00 0.00 H new ATOM 0 HG23 VAL B 436 -8.380 -0.267 -14.376 1.00 0.00 H new ATOM 751 N LEU B 437 -12.902 -2.615 -14.932 1.00 0.00 N ATOM 752 CA LEU B 437 -14.067 -3.373 -14.508 1.00 0.00 C ATOM 753 C LEU B 437 -13.743 -4.868 -14.556 1.00 0.00 C ATOM 754 O LEU B 437 -13.351 -5.388 -15.599 1.00 0.00 O ATOM 755 CB LEU B 437 -15.291 -2.982 -15.338 1.00 0.00 C ATOM 756 CG LEU B 437 -15.027 -2.062 -16.532 1.00 0.00 C ATOM 757 CD1 LEU B 437 -16.249 -1.988 -17.449 1.00 0.00 C ATOM 758 CD2 LEU B 437 -14.574 -0.677 -16.067 1.00 0.00 C ATOM 0 H LEU B 437 -12.741 -2.609 -15.939 1.00 0.00 H new ATOM 0 HA LEU B 437 -14.321 -3.135 -13.475 1.00 0.00 H new ATOM 0 HB2 LEU B 437 -15.763 -3.894 -15.705 1.00 0.00 H new ATOM 0 HB3 LEU B 437 -16.010 -2.493 -14.680 1.00 0.00 H new ATOM 0 HG LEU B 437 -14.212 -2.488 -17.117 1.00 0.00 H new ATOM 0 HD11 LEU B 437 -16.034 -1.328 -18.289 1.00 0.00 H new ATOM 0 HD12 LEU B 437 -16.485 -2.985 -17.822 1.00 0.00 H new ATOM 0 HD13 LEU B 437 -17.100 -1.599 -16.890 1.00 0.00 H new ATOM 0 HD21 LEU B 437 -14.393 -0.043 -16.935 1.00 0.00 H new ATOM 0 HD22 LEU B 437 -15.350 -0.230 -15.446 1.00 0.00 H new ATOM 0 HD23 LEU B 437 -13.655 -0.770 -15.488 1.00 0.00 H new ATOM 770 N VAL B 438 -13.920 -5.516 -13.414 1.00 0.00 N ATOM 771 CA VAL B 438 -13.652 -6.940 -13.313 1.00 0.00 C ATOM 772 C VAL B 438 -14.769 -7.716 -14.014 1.00 0.00 C ATOM 773 O VAL B 438 -15.902 -7.749 -13.534 1.00 0.00 O ATOM 774 CB VAL B 438 -13.477 -7.337 -11.846 1.00 0.00 C ATOM 775 CG1 VAL B 438 -13.641 -8.848 -11.663 1.00 0.00 C ATOM 776 CG2 VAL B 438 -12.126 -6.863 -11.307 1.00 0.00 C ATOM 0 H VAL B 438 -14.246 -5.081 -12.551 1.00 0.00 H new ATOM 0 HA VAL B 438 -12.718 -7.189 -13.816 1.00 0.00 H new ATOM 0 HB VAL B 438 -14.259 -6.843 -11.270 1.00 0.00 H new ATOM 0 HG11 VAL B 438 -13.512 -9.103 -10.611 1.00 0.00 H new ATOM 0 HG12 VAL B 438 -14.637 -9.148 -11.990 1.00 0.00 H new ATOM 0 HG13 VAL B 438 -12.891 -9.370 -12.258 1.00 0.00 H new ATOM 0 HG21 VAL B 438 -12.027 -7.158 -10.262 1.00 0.00 H new ATOM 0 HG22 VAL B 438 -11.323 -7.315 -11.889 1.00 0.00 H new ATOM 0 HG23 VAL B 438 -12.064 -5.778 -11.385 1.00 0.00 H new ATOM 786 N ILE B 439 -14.412 -8.321 -15.137 1.00 0.00 N ATOM 787 CA ILE B 439 -15.370 -9.095 -15.908 1.00 0.00 C ATOM 788 C ILE B 439 -14.954 -10.567 -15.901 1.00 0.00 C ATOM 789 O ILE B 439 -13.773 -10.881 -15.760 1.00 0.00 O ATOM 790 CB ILE B 439 -15.528 -8.507 -17.311 1.00 0.00 C ATOM 791 CG1 ILE B 439 -14.252 -8.699 -18.133 1.00 0.00 C ATOM 792 CG2 ILE B 439 -15.952 -7.038 -17.246 1.00 0.00 C ATOM 793 CD1 ILE B 439 -13.374 -7.448 -18.083 1.00 0.00 C ATOM 0 H ILE B 439 -13.472 -8.291 -15.532 1.00 0.00 H new ATOM 0 HA ILE B 439 -16.358 -9.041 -15.452 1.00 0.00 H new ATOM 0 HB ILE B 439 -16.324 -9.050 -17.821 1.00 0.00 H new ATOM 0 HG12 ILE B 439 -13.695 -9.554 -17.751 1.00 0.00 H new ATOM 0 HG13 ILE B 439 -14.512 -8.924 -19.167 1.00 0.00 H new ATOM 0 HG21 ILE B 439 -16.057 -6.645 -18.257 1.00 0.00 H new ATOM 0 HG22 ILE B 439 -16.906 -6.957 -16.724 1.00 0.00 H new ATOM 0 HG23 ILE B 439 -15.196 -6.464 -16.710 1.00 0.00 H new ATOM 0 HD11 ILE B 439 -12.474 -7.611 -18.675 1.00 0.00 H new ATOM 0 HD12 ILE B 439 -13.926 -6.600 -18.488 1.00 0.00 H new ATOM 0 HD13 ILE B 439 -13.096 -7.240 -17.050 1.00 0.00 H new ATOM 805 N PRO B 440 -15.974 -11.453 -16.059 1.00 0.00 N ATOM 806 CA PRO B 440 -15.725 -12.885 -16.073 1.00 0.00 C ATOM 807 C PRO B 440 -15.096 -13.320 -17.398 1.00 0.00 C ATOM 808 O PRO B 440 -15.713 -13.191 -18.454 1.00 0.00 O ATOM 809 CB PRO B 440 -17.083 -13.522 -15.823 1.00 0.00 C ATOM 810 CG PRO B 440 -18.111 -12.449 -16.141 1.00 0.00 C ATOM 811 CD PRO B 440 -17.384 -11.117 -16.229 1.00 0.00 C ATOM 0 HA PRO B 440 -15.008 -13.195 -15.313 1.00 0.00 H new ATOM 0 HB2 PRO B 440 -17.225 -14.399 -16.455 1.00 0.00 H new ATOM 0 HB3 PRO B 440 -17.174 -13.856 -14.789 1.00 0.00 H new ATOM 0 HG2 PRO B 440 -18.616 -12.671 -17.081 1.00 0.00 H new ATOM 0 HG3 PRO B 440 -18.878 -12.415 -15.368 1.00 0.00 H new ATOM 0 HD2 PRO B 440 -17.562 -10.631 -17.188 1.00 0.00 H new ATOM 0 HD3 PRO B 440 -17.723 -10.429 -15.455 1.00 0.00 H new ATOM 819 N PHE B 441 -13.875 -13.826 -17.298 1.00 0.00 N ATOM 820 CA PHE B 441 -13.155 -14.280 -18.476 1.00 0.00 C ATOM 821 C PHE B 441 -13.918 -15.399 -19.188 1.00 0.00 C ATOM 822 O PHE B 441 -15.057 -15.700 -18.835 1.00 0.00 O ATOM 823 CB PHE B 441 -11.808 -14.823 -17.995 1.00 0.00 C ATOM 824 CG PHE B 441 -11.879 -15.568 -16.660 1.00 0.00 C ATOM 825 CD1 PHE B 441 -13.008 -16.244 -16.318 1.00 0.00 C ATOM 826 CD2 PHE B 441 -10.812 -15.553 -15.816 1.00 0.00 C ATOM 827 CE1 PHE B 441 -13.073 -16.936 -15.079 1.00 0.00 C ATOM 828 CE2 PHE B 441 -10.878 -16.245 -14.578 1.00 0.00 C ATOM 829 CZ PHE B 441 -12.007 -16.921 -14.235 1.00 0.00 C ATOM 0 H PHE B 441 -13.367 -13.931 -16.420 1.00 0.00 H new ATOM 0 HA PHE B 441 -13.034 -13.456 -19.179 1.00 0.00 H new ATOM 0 HB2 PHE B 441 -11.407 -15.495 -18.754 1.00 0.00 H new ATOM 0 HB3 PHE B 441 -11.106 -13.994 -17.900 1.00 0.00 H new ATOM 0 HD1 PHE B 441 -13.855 -16.255 -16.988 1.00 0.00 H new ATOM 0 HD2 PHE B 441 -9.916 -15.015 -16.087 1.00 0.00 H new ATOM 0 HE1 PHE B 441 -13.969 -17.474 -14.807 1.00 0.00 H new ATOM 0 HE2 PHE B 441 -10.031 -16.234 -13.908 1.00 0.00 H new ATOM 0 HZ PHE B 441 -12.057 -17.446 -13.292 1.00 0.00 H new ATOM 931 N ASP B 448 -4.538 -15.844 -15.022 1.00 0.00 N ATOM 932 CA ASP B 448 -3.160 -15.897 -14.564 1.00 0.00 C ATOM 933 C ASP B 448 -3.123 -15.699 -13.048 1.00 0.00 C ATOM 934 O ASP B 448 -4.032 -15.101 -12.474 1.00 0.00 O ATOM 935 CB ASP B 448 -2.323 -14.789 -15.206 1.00 0.00 C ATOM 936 CG ASP B 448 -0.936 -14.589 -14.593 1.00 0.00 C ATOM 937 OD1 ASP B 448 -0.306 -15.617 -14.266 1.00 0.00 O ATOM 938 OD2 ASP B 448 -0.537 -13.411 -14.465 1.00 0.00 O ATOM 0 HA ASP B 448 -2.749 -16.867 -14.843 1.00 0.00 H new ATOM 0 HB2 ASP B 448 -2.206 -15.011 -16.267 1.00 0.00 H new ATOM 0 HB3 ASP B 448 -2.874 -13.851 -15.135 1.00 0.00 H new ATOM 943 N GLU B 449 -2.063 -16.213 -12.442 1.00 0.00 N ATOM 944 CA GLU B 449 -1.895 -16.100 -11.003 1.00 0.00 C ATOM 945 C GLU B 449 -1.460 -14.681 -10.629 1.00 0.00 C ATOM 946 O GLU B 449 -0.345 -14.267 -10.944 1.00 0.00 O ATOM 947 CB GLU B 449 -0.895 -17.135 -10.484 1.00 0.00 C ATOM 948 CG GLU B 449 -1.617 -18.342 -9.882 1.00 0.00 C ATOM 949 CD GLU B 449 -0.622 -19.434 -9.484 1.00 0.00 C ATOM 950 OE1 GLU B 449 0.069 -19.933 -10.398 1.00 0.00 O ATOM 951 OE2 GLU B 449 -0.575 -19.745 -8.274 1.00 0.00 O ATOM 0 H GLU B 449 -1.312 -16.709 -12.921 1.00 0.00 H new ATOM 0 HA GLU B 449 -2.855 -16.302 -10.528 1.00 0.00 H new ATOM 0 HB2 GLU B 449 -0.249 -17.462 -11.299 1.00 0.00 H new ATOM 0 HB3 GLU B 449 -0.252 -16.679 -9.731 1.00 0.00 H new ATOM 0 HG2 GLU B 449 -2.188 -18.030 -9.008 1.00 0.00 H new ATOM 0 HG3 GLU B 449 -2.330 -18.740 -10.603 1.00 0.00 H new ATOM 958 N GLY B 450 -2.362 -13.976 -9.962 1.00 0.00 N ATOM 959 CA GLY B 450 -2.085 -12.613 -9.542 1.00 0.00 C ATOM 960 C GLY B 450 -2.675 -11.604 -10.529 1.00 0.00 C ATOM 961 O GLY B 450 -2.576 -10.396 -10.321 1.00 0.00 O ATOM 0 H GLY B 450 -3.285 -14.323 -9.702 1.00 0.00 H new ATOM 0 HA2 GLY B 450 -2.502 -12.443 -8.550 1.00 0.00 H new ATOM 0 HA3 GLY B 450 -1.008 -12.464 -9.465 1.00 0.00 H new ATOM 965 N TRP B 451 -3.275 -12.137 -11.583 1.00 0.00 N ATOM 966 CA TRP B 451 -3.880 -11.299 -12.604 1.00 0.00 C ATOM 967 C TRP B 451 -5.230 -11.913 -12.981 1.00 0.00 C ATOM 968 O TRP B 451 -5.434 -13.115 -12.824 1.00 0.00 O ATOM 969 CB TRP B 451 -2.944 -11.131 -13.802 1.00 0.00 C ATOM 970 CG TRP B 451 -1.478 -10.918 -13.421 1.00 0.00 C ATOM 971 CD1 TRP B 451 -0.728 -11.648 -12.584 1.00 0.00 C ATOM 972 CD2 TRP B 451 -0.608 -9.871 -13.901 1.00 0.00 C ATOM 973 NE1 TRP B 451 0.556 -11.151 -12.490 1.00 0.00 N ATOM 974 CE2 TRP B 451 0.631 -10.035 -13.316 1.00 0.00 C ATOM 975 CE3 TRP B 451 -0.860 -8.820 -14.800 1.00 0.00 C ATOM 976 CZ2 TRP B 451 1.715 -9.186 -13.565 1.00 0.00 C ATOM 977 CZ3 TRP B 451 0.234 -7.979 -15.038 1.00 0.00 C ATOM 978 CH2 TRP B 451 1.487 -8.131 -14.457 1.00 0.00 C ATOM 0 H TRP B 451 -3.355 -13.140 -11.752 1.00 0.00 H new ATOM 0 HA TRP B 451 -4.050 -10.291 -12.225 1.00 0.00 H new ATOM 0 HB2 TRP B 451 -3.019 -12.015 -14.436 1.00 0.00 H new ATOM 0 HB3 TRP B 451 -3.281 -10.282 -14.397 1.00 0.00 H new ATOM 0 HD1 TRP B 451 -1.084 -12.517 -12.050 1.00 0.00 H new ATOM 0 HE1 TRP B 451 1.311 -11.532 -11.920 1.00 0.00 H new ATOM 0 HE3 TRP B 451 -1.821 -8.673 -15.270 1.00 0.00 H new ATOM 0 HZ2 TRP B 451 2.676 -9.336 -13.095 1.00 0.00 H new ATOM 0 HZ3 TRP B 451 0.094 -7.154 -15.721 1.00 0.00 H new ATOM 0 HH2 TRP B 451 2.282 -7.438 -14.692 1.00 0.00 H new ATOM 989 N LEU B 452 -6.117 -11.058 -13.470 1.00 0.00 N ATOM 990 CA LEU B 452 -7.441 -11.502 -13.871 1.00 0.00 C ATOM 991 C LEU B 452 -7.869 -10.742 -15.129 1.00 0.00 C ATOM 992 O LEU B 452 -7.192 -9.807 -15.554 1.00 0.00 O ATOM 993 CB LEU B 452 -8.425 -11.370 -12.708 1.00 0.00 C ATOM 994 CG LEU B 452 -7.950 -10.535 -11.518 1.00 0.00 C ATOM 995 CD1 LEU B 452 -9.136 -10.013 -10.705 1.00 0.00 C ATOM 996 CD2 LEU B 452 -6.965 -11.324 -10.653 1.00 0.00 C ATOM 0 H LEU B 452 -5.944 -10.061 -13.597 1.00 0.00 H new ATOM 0 HA LEU B 452 -7.427 -12.561 -14.127 1.00 0.00 H new ATOM 0 HB2 LEU B 452 -9.348 -10.933 -13.088 1.00 0.00 H new ATOM 0 HB3 LEU B 452 -8.670 -12.370 -12.350 1.00 0.00 H new ATOM 0 HG LEU B 452 -7.417 -9.666 -11.903 1.00 0.00 H new ATOM 0 HD11 LEU B 452 -8.770 -9.423 -9.865 1.00 0.00 H new ATOM 0 HD12 LEU B 452 -9.766 -9.389 -11.340 1.00 0.00 H new ATOM 0 HD13 LEU B 452 -9.719 -10.854 -10.330 1.00 0.00 H new ATOM 0 HD21 LEU B 452 -6.643 -10.707 -9.814 1.00 0.00 H new ATOM 0 HD22 LEU B 452 -7.451 -12.224 -10.276 1.00 0.00 H new ATOM 0 HD23 LEU B 452 -6.098 -11.604 -11.252 1.00 0.00 H new ATOM 1008 N MET B 453 -8.990 -11.172 -15.688 1.00 0.00 N ATOM 1009 CA MET B 453 -9.517 -10.544 -16.887 1.00 0.00 C ATOM 1010 C MET B 453 -10.408 -9.351 -16.535 1.00 0.00 C ATOM 1011 O MET B 453 -11.474 -9.520 -15.946 1.00 0.00 O ATOM 1012 CB MET B 453 -10.327 -11.567 -17.687 1.00 0.00 C ATOM 1013 CG MET B 453 -11.106 -10.889 -18.815 1.00 0.00 C ATOM 1014 SD MET B 453 -10.636 -11.588 -20.388 1.00 0.00 S ATOM 1015 CE MET B 453 -8.892 -11.207 -20.388 1.00 0.00 C ATOM 0 H MET B 453 -9.548 -11.948 -15.333 1.00 0.00 H new ATOM 0 HA MET B 453 -8.679 -10.185 -17.484 1.00 0.00 H new ATOM 0 HB2 MET B 453 -9.658 -12.320 -18.104 1.00 0.00 H new ATOM 0 HB3 MET B 453 -11.019 -12.087 -17.024 1.00 0.00 H new ATOM 0 HG2 MET B 453 -12.177 -11.017 -18.656 1.00 0.00 H new ATOM 0 HG3 MET B 453 -10.909 -9.817 -18.811 1.00 0.00 H new ATOM 0 HE1 MET B 453 -8.330 -12.075 -20.732 1.00 0.00 H new ATOM 0 HE2 MET B 453 -8.703 -10.366 -21.055 1.00 0.00 H new ATOM 0 HE3 MET B 453 -8.576 -10.947 -19.378 1.00 0.00 H new ATOM 1025 N GLY B 454 -9.937 -8.171 -16.911 1.00 0.00 N ATOM 1026 CA GLY B 454 -10.678 -6.950 -16.642 1.00 0.00 C ATOM 1027 C GLY B 454 -10.666 -6.022 -17.858 1.00 0.00 C ATOM 1028 O GLY B 454 -9.963 -6.280 -18.834 1.00 0.00 O ATOM 0 H GLY B 454 -9.052 -8.034 -17.399 1.00 0.00 H new ATOM 0 HA2 GLY B 454 -11.707 -7.195 -16.378 1.00 0.00 H new ATOM 0 HA3 GLY B 454 -10.242 -6.437 -15.785 1.00 0.00 H new ATOM 1032 N VAL B 455 -11.454 -4.961 -17.761 1.00 0.00 N ATOM 1033 CA VAL B 455 -11.542 -3.993 -18.841 1.00 0.00 C ATOM 1034 C VAL B 455 -11.487 -2.579 -18.258 1.00 0.00 C ATOM 1035 O VAL B 455 -12.094 -2.306 -17.224 1.00 0.00 O ATOM 1036 CB VAL B 455 -12.802 -4.248 -19.671 1.00 0.00 C ATOM 1037 CG1 VAL B 455 -14.055 -4.207 -18.794 1.00 0.00 C ATOM 1038 CG2 VAL B 455 -12.908 -3.251 -20.826 1.00 0.00 C ATOM 0 H VAL B 455 -12.037 -4.751 -16.951 1.00 0.00 H new ATOM 0 HA VAL B 455 -10.695 -4.099 -19.519 1.00 0.00 H new ATOM 0 HB VAL B 455 -12.725 -5.248 -20.097 1.00 0.00 H new ATOM 0 HG11 VAL B 455 -14.936 -4.391 -19.409 1.00 0.00 H new ATOM 0 HG12 VAL B 455 -13.984 -4.974 -18.022 1.00 0.00 H new ATOM 0 HG13 VAL B 455 -14.139 -3.227 -18.325 1.00 0.00 H new ATOM 0 HG21 VAL B 455 -13.812 -3.454 -21.400 1.00 0.00 H new ATOM 0 HG22 VAL B 455 -12.951 -2.237 -20.429 1.00 0.00 H new ATOM 0 HG23 VAL B 455 -12.037 -3.350 -21.474 1.00 0.00 H new ATOM 1048 N LYS B 456 -10.753 -1.718 -18.947 1.00 0.00 N ATOM 1049 CA LYS B 456 -10.610 -0.339 -18.511 1.00 0.00 C ATOM 1050 C LYS B 456 -11.896 0.427 -18.827 1.00 0.00 C ATOM 1051 O LYS B 456 -12.703 -0.017 -19.643 1.00 0.00 O ATOM 1052 CB LYS B 456 -9.355 0.288 -19.120 1.00 0.00 C ATOM 1053 CG LYS B 456 -8.284 0.521 -18.052 1.00 0.00 C ATOM 1054 CD LYS B 456 -6.889 0.579 -18.678 1.00 0.00 C ATOM 1055 CE LYS B 456 -6.805 1.688 -19.728 1.00 0.00 C ATOM 1056 NZ LYS B 456 -7.351 1.219 -21.022 1.00 0.00 N ATOM 0 H LYS B 456 -10.251 -1.948 -19.804 1.00 0.00 H new ATOM 0 HA LYS B 456 -10.469 -0.293 -17.431 1.00 0.00 H new ATOM 0 HB2 LYS B 456 -8.960 -0.364 -19.900 1.00 0.00 H new ATOM 0 HB3 LYS B 456 -9.611 1.235 -19.595 1.00 0.00 H new ATOM 0 HG2 LYS B 456 -8.489 1.452 -17.524 1.00 0.00 H new ATOM 0 HG3 LYS B 456 -8.322 -0.279 -17.313 1.00 0.00 H new ATOM 0 HD2 LYS B 456 -6.145 0.752 -17.901 1.00 0.00 H new ATOM 0 HD3 LYS B 456 -6.653 -0.381 -19.138 1.00 0.00 H new ATOM 0 HE2 LYS B 456 -7.360 2.562 -19.388 1.00 0.00 H new ATOM 0 HE3 LYS B 456 -5.768 1.999 -19.855 1.00 0.00 H new ATOM 0 HZ1 LYS B 456 -6.759 1.577 -21.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 456 -7.355 0.179 -21.040 1.00 0.00 H new ATOM 0 HZ3 LYS B 456 -8.323 1.571 -21.137 1.00 0.00 H new ATOM 1070 N GLU B 457 -12.047 1.565 -18.166 1.00 0.00 N ATOM 1071 CA GLU B 457 -13.221 2.397 -18.366 1.00 0.00 C ATOM 1072 C GLU B 457 -13.320 2.833 -19.829 1.00 0.00 C ATOM 1073 O GLU B 457 -14.408 2.860 -20.401 1.00 0.00 O ATOM 1074 CB GLU B 457 -13.200 3.609 -17.433 1.00 0.00 C ATOM 1075 CG GLU B 457 -14.293 4.611 -17.810 1.00 0.00 C ATOM 1076 CD GLU B 457 -14.836 5.323 -16.569 1.00 0.00 C ATOM 1077 OE1 GLU B 457 -15.712 4.725 -15.909 1.00 0.00 O ATOM 1078 OE2 GLU B 457 -14.362 6.450 -16.309 1.00 0.00 O ATOM 0 H GLU B 457 -11.375 1.931 -17.491 1.00 0.00 H new ATOM 0 HA GLU B 457 -14.105 1.808 -18.122 1.00 0.00 H new ATOM 0 HB2 GLU B 457 -13.341 3.282 -16.403 1.00 0.00 H new ATOM 0 HB3 GLU B 457 -12.225 4.094 -17.483 1.00 0.00 H new ATOM 0 HG2 GLU B 457 -13.893 5.345 -18.509 1.00 0.00 H new ATOM 0 HG3 GLU B 457 -15.105 4.094 -18.321 1.00 0.00 H new ATOM 1085 N SER B 458 -12.167 3.163 -20.393 1.00 0.00 N ATOM 1086 CA SER B 458 -12.110 3.597 -21.779 1.00 0.00 C ATOM 1087 C SER B 458 -12.641 2.492 -22.695 1.00 0.00 C ATOM 1088 O SER B 458 -13.314 2.773 -23.686 1.00 0.00 O ATOM 1089 CB SER B 458 -10.683 3.977 -22.179 1.00 0.00 C ATOM 1090 OG SER B 458 -10.603 5.313 -22.667 1.00 0.00 O ATOM 0 H SER B 458 -11.266 3.139 -19.916 1.00 0.00 H new ATOM 0 HA SER B 458 -12.737 4.482 -21.886 1.00 0.00 H new ATOM 0 HB2 SER B 458 -10.023 3.865 -21.318 1.00 0.00 H new ATOM 0 HB3 SER B 458 -10.326 3.289 -22.946 1.00 0.00 H new ATOM 0 HG SER B 458 -9.676 5.518 -22.910 1.00 0.00 H new ATOM 1096 N ASP B 459 -12.319 1.260 -22.332 1.00 0.00 N ATOM 1097 CA ASP B 459 -12.756 0.112 -23.108 1.00 0.00 C ATOM 1098 C ASP B 459 -14.272 -0.041 -22.975 1.00 0.00 C ATOM 1099 O ASP B 459 -14.940 -0.474 -23.913 1.00 0.00 O ATOM 1100 CB ASP B 459 -12.105 -1.176 -22.601 1.00 0.00 C ATOM 1101 CG ASP B 459 -10.702 -1.450 -23.148 1.00 0.00 C ATOM 1102 OD1 ASP B 459 -10.205 -0.582 -23.897 1.00 0.00 O ATOM 1103 OD2 ASP B 459 -10.159 -2.522 -22.804 1.00 0.00 O ATOM 0 H ASP B 459 -11.760 1.031 -21.510 1.00 0.00 H new ATOM 0 HA ASP B 459 -12.467 0.278 -24.146 1.00 0.00 H new ATOM 0 HB2 ASP B 459 -12.053 -1.135 -21.513 1.00 0.00 H new ATOM 0 HB3 ASP B 459 -12.749 -2.017 -22.858 1.00 0.00 H new ATOM 1108 N TRP B 460 -14.771 0.324 -21.803 1.00 0.00 N ATOM 1109 CA TRP B 460 -16.197 0.232 -21.536 1.00 0.00 C ATOM 1110 C TRP B 460 -16.937 0.945 -22.669 1.00 0.00 C ATOM 1111 O TRP B 460 -17.873 0.395 -23.247 1.00 0.00 O ATOM 1112 CB TRP B 460 -16.532 0.797 -20.154 1.00 0.00 C ATOM 1113 CG TRP B 460 -17.968 0.524 -19.703 1.00 0.00 C ATOM 1114 CD1 TRP B 460 -19.056 0.359 -20.467 1.00 0.00 C ATOM 1115 CD2 TRP B 460 -18.431 0.391 -18.342 1.00 0.00 C ATOM 1116 NE1 TRP B 460 -20.182 0.130 -19.702 1.00 0.00 N ATOM 1117 CE2 TRP B 460 -19.790 0.150 -18.369 1.00 0.00 C ATOM 1118 CE3 TRP B 460 -17.725 0.471 -17.129 1.00 0.00 C ATOM 1119 CZ2 TRP B 460 -20.559 -0.031 -17.214 1.00 0.00 C ATOM 1120 CZ3 TRP B 460 -18.509 0.288 -15.983 1.00 0.00 C ATOM 1121 CH2 TRP B 460 -19.877 0.045 -15.993 1.00 0.00 C ATOM 0 H TRP B 460 -14.214 0.684 -21.028 1.00 0.00 H new ATOM 0 HA TRP B 460 -16.519 -0.809 -21.511 1.00 0.00 H new ATOM 0 HB2 TRP B 460 -15.845 0.372 -19.422 1.00 0.00 H new ATOM 0 HB3 TRP B 460 -16.363 1.874 -20.162 1.00 0.00 H new ATOM 0 HD1 TRP B 460 -19.053 0.400 -21.546 1.00 0.00 H new ATOM 0 HE1 TRP B 460 -21.128 -0.025 -20.051 1.00 0.00 H new ATOM 0 HE3 TRP B 460 -16.662 0.659 -17.084 1.00 0.00 H new ATOM 0 HZ2 TRP B 460 -21.621 -0.219 -17.262 1.00 0.00 H new ATOM 0 HZ3 TRP B 460 -18.015 0.339 -15.024 1.00 0.00 H new ATOM 0 HH2 TRP B 460 -20.412 -0.085 -15.064 1.00 0.00 H new ATOM 1132 N ASN B 461 -16.490 2.160 -22.953 1.00 0.00 N ATOM 1133 CA ASN B 461 -17.098 2.954 -24.007 1.00 0.00 C ATOM 1134 C ASN B 461 -17.097 2.152 -25.310 1.00 0.00 C ATOM 1135 O ASN B 461 -17.939 2.370 -26.179 1.00 0.00 O ATOM 1136 CB ASN B 461 -16.314 4.246 -24.246 1.00 0.00 C ATOM 1137 CG ASN B 461 -16.141 5.031 -22.944 1.00 0.00 C ATOM 1138 OD1 ASN B 461 -16.930 5.894 -22.600 1.00 0.00 O ATOM 1139 ND2 ASN B 461 -15.066 4.684 -22.243 1.00 0.00 N ATOM 0 H ASN B 461 -15.714 2.614 -22.471 1.00 0.00 H new ATOM 0 HA ASN B 461 -18.114 3.201 -23.699 1.00 0.00 H new ATOM 0 HB2 ASN B 461 -15.336 4.010 -24.665 1.00 0.00 H new ATOM 0 HB3 ASN B 461 -16.835 4.861 -24.979 1.00 0.00 H new ATOM 0 HD21 ASN B 461 -14.861 5.150 -21.359 1.00 0.00 H new ATOM 0 HD22 ASN B 461 -14.446 3.952 -22.589 1.00 0.00 H new ATOM 1146 N GLN B 462 -16.141 1.239 -25.404 1.00 0.00 N ATOM 1147 CA GLN B 462 -16.017 0.404 -26.587 1.00 0.00 C ATOM 1148 C GLN B 462 -16.530 -1.008 -26.295 1.00 0.00 C ATOM 1149 O GLN B 462 -16.197 -1.953 -27.009 1.00 0.00 O ATOM 1150 CB GLN B 462 -14.572 0.370 -27.086 1.00 0.00 C ATOM 1151 CG GLN B 462 -14.338 1.433 -28.162 1.00 0.00 C ATOM 1152 CD GLN B 462 -15.135 2.703 -27.860 1.00 0.00 C ATOM 1153 OE1 GLN B 462 -16.164 2.978 -28.454 1.00 0.00 O ATOM 1154 NE2 GLN B 462 -14.603 3.461 -26.904 1.00 0.00 N ATOM 0 H GLN B 462 -15.445 1.059 -24.680 1.00 0.00 H new ATOM 0 HA GLN B 462 -16.629 0.836 -27.379 1.00 0.00 H new ATOM 0 HB2 GLN B 462 -13.891 0.537 -26.251 1.00 0.00 H new ATOM 0 HB3 GLN B 462 -14.346 -0.617 -27.490 1.00 0.00 H new ATOM 0 HG2 GLN B 462 -13.276 1.671 -28.218 1.00 0.00 H new ATOM 0 HG3 GLN B 462 -14.629 1.040 -29.136 1.00 0.00 H new ATOM 0 HE21 GLN B 462 -13.738 3.172 -26.446 1.00 0.00 H new ATOM 0 HE22 GLN B 462 -15.060 4.330 -26.629 1.00 0.00 H new ATOM 1163 N HIS B 463 -17.332 -1.106 -25.245 1.00 0.00 N ATOM 1164 CA HIS B 463 -17.893 -2.387 -24.850 1.00 0.00 C ATOM 1165 C HIS B 463 -18.424 -3.118 -26.085 1.00 0.00 C ATOM 1166 O HIS B 463 -18.565 -4.340 -26.075 1.00 0.00 O ATOM 1167 CB HIS B 463 -18.958 -2.203 -23.767 1.00 0.00 C ATOM 1168 CG HIS B 463 -20.048 -3.248 -23.793 1.00 0.00 C ATOM 1169 ND1 HIS B 463 -19.784 -4.603 -23.883 1.00 0.00 N ATOM 1170 CD2 HIS B 463 -21.405 -3.122 -23.737 1.00 0.00 C ATOM 1171 CE1 HIS B 463 -20.938 -5.255 -23.883 1.00 0.00 C ATOM 1172 NE2 HIS B 463 -21.941 -4.335 -23.793 1.00 0.00 N ATOM 0 H HIS B 463 -17.607 -0.320 -24.656 1.00 0.00 H new ATOM 0 HA HIS B 463 -17.113 -3.009 -24.410 1.00 0.00 H new ATOM 0 HB2 HIS B 463 -18.475 -2.221 -22.790 1.00 0.00 H new ATOM 0 HB3 HIS B 463 -19.411 -1.218 -23.881 1.00 0.00 H new ATOM 0 HD2 HIS B 463 -21.951 -2.193 -23.660 1.00 0.00 H new ATOM 0 HE1 HIS B 463 -21.062 -6.326 -23.944 1.00 0.00 H new ATOM 0 HE2 HIS B 463 -22.939 -4.545 -23.772 1.00 0.00 H new ATOM 1180 N LYS B 464 -18.704 -2.338 -27.119 1.00 0.00 N ATOM 1181 CA LYS B 464 -19.217 -2.896 -28.359 1.00 0.00 C ATOM 1182 C LYS B 464 -18.230 -3.938 -28.891 1.00 0.00 C ATOM 1183 O LYS B 464 -18.630 -4.903 -29.540 1.00 0.00 O ATOM 1184 CB LYS B 464 -19.531 -1.781 -29.359 1.00 0.00 C ATOM 1185 CG LYS B 464 -20.169 -2.347 -30.629 1.00 0.00 C ATOM 1186 CD LYS B 464 -21.031 -1.293 -31.327 1.00 0.00 C ATOM 1187 CE LYS B 464 -20.544 -1.044 -32.755 1.00 0.00 C ATOM 1188 NZ LYS B 464 -20.398 0.408 -33.007 1.00 0.00 N ATOM 0 H LYS B 464 -18.585 -1.325 -27.124 1.00 0.00 H new ATOM 0 HA LYS B 464 -20.162 -3.411 -28.183 1.00 0.00 H new ATOM 0 HB2 LYS B 464 -20.204 -1.056 -28.901 1.00 0.00 H new ATOM 0 HB3 LYS B 464 -18.615 -1.248 -29.614 1.00 0.00 H new ATOM 0 HG2 LYS B 464 -19.390 -2.693 -31.308 1.00 0.00 H new ATOM 0 HG3 LYS B 464 -20.780 -3.214 -30.378 1.00 0.00 H new ATOM 0 HD2 LYS B 464 -22.070 -1.622 -31.346 1.00 0.00 H new ATOM 0 HD3 LYS B 464 -21.002 -0.362 -30.761 1.00 0.00 H new ATOM 0 HE2 LYS B 464 -19.588 -1.544 -32.912 1.00 0.00 H new ATOM 0 HE3 LYS B 464 -21.249 -1.474 -33.466 1.00 0.00 H new ATOM 0 HZ1 LYS B 464 -20.067 0.560 -33.981 1.00 0.00 H new ATOM 0 HZ2 LYS B 464 -21.317 0.877 -32.877 1.00 0.00 H new ATOM 0 HZ3 LYS B 464 -19.708 0.808 -32.340 1.00 0.00 H new ATOM 1202 N LYS B 465 -16.959 -3.707 -28.596 1.00 0.00 N ATOM 1203 CA LYS B 465 -15.912 -4.613 -29.036 1.00 0.00 C ATOM 1204 C LYS B 465 -15.079 -5.047 -27.829 1.00 0.00 C ATOM 1205 O LYS B 465 -13.850 -5.060 -27.890 1.00 0.00 O ATOM 1206 CB LYS B 465 -15.087 -3.976 -30.156 1.00 0.00 C ATOM 1207 CG LYS B 465 -15.918 -3.825 -31.431 1.00 0.00 C ATOM 1208 CD LYS B 465 -15.387 -2.683 -32.300 1.00 0.00 C ATOM 1209 CE LYS B 465 -15.821 -1.325 -31.745 1.00 0.00 C ATOM 1210 NZ LYS B 465 -14.854 -0.273 -32.133 1.00 0.00 N ATOM 0 H LYS B 465 -16.631 -2.905 -28.058 1.00 0.00 H new ATOM 0 HA LYS B 465 -16.346 -5.516 -29.466 1.00 0.00 H new ATOM 0 HB2 LYS B 465 -14.725 -2.999 -29.836 1.00 0.00 H new ATOM 0 HB3 LYS B 465 -14.209 -4.589 -30.360 1.00 0.00 H new ATOM 0 HG2 LYS B 465 -15.896 -4.757 -31.996 1.00 0.00 H new ATOM 0 HG3 LYS B 465 -16.959 -3.635 -31.170 1.00 0.00 H new ATOM 0 HD2 LYS B 465 -14.299 -2.731 -32.345 1.00 0.00 H new ATOM 0 HD3 LYS B 465 -15.753 -2.797 -33.320 1.00 0.00 H new ATOM 0 HE2 LYS B 465 -16.813 -1.072 -32.121 1.00 0.00 H new ATOM 0 HE3 LYS B 465 -15.895 -1.376 -30.659 1.00 0.00 H new ATOM 0 HZ1 LYS B 465 -15.164 0.642 -31.748 1.00 0.00 H new ATOM 0 HZ2 LYS B 465 -13.915 -0.508 -31.754 1.00 0.00 H new ATOM 0 HZ3 LYS B 465 -14.804 -0.213 -33.170 1.00 0.00 H new ATOM 1224 N LEU B 466 -15.780 -5.392 -26.759 1.00 0.00 N ATOM 1225 CA LEU B 466 -15.120 -5.826 -25.539 1.00 0.00 C ATOM 1226 C LEU B 466 -14.213 -7.018 -25.852 1.00 0.00 C ATOM 1227 O LEU B 466 -13.129 -7.143 -25.284 1.00 0.00 O ATOM 1228 CB LEU B 466 -16.151 -6.108 -24.444 1.00 0.00 C ATOM 1229 CG LEU B 466 -16.730 -7.524 -24.416 1.00 0.00 C ATOM 1230 CD1 LEU B 466 -17.212 -7.891 -23.011 1.00 0.00 C ATOM 1231 CD2 LEU B 466 -17.835 -7.685 -25.462 1.00 0.00 C ATOM 0 H LEU B 466 -16.799 -5.380 -26.711 1.00 0.00 H new ATOM 0 HA LEU B 466 -14.482 -5.034 -25.148 1.00 0.00 H new ATOM 0 HB2 LEU B 466 -15.689 -5.907 -23.477 1.00 0.00 H new ATOM 0 HB3 LEU B 466 -16.974 -5.402 -24.557 1.00 0.00 H new ATOM 0 HG LEU B 466 -15.936 -8.224 -24.677 1.00 0.00 H new ATOM 0 HD11 LEU B 466 -17.619 -8.902 -23.019 1.00 0.00 H new ATOM 0 HD12 LEU B 466 -16.375 -7.842 -22.315 1.00 0.00 H new ATOM 0 HD13 LEU B 466 -17.986 -7.191 -22.697 1.00 0.00 H new ATOM 0 HD21 LEU B 466 -18.230 -8.700 -25.421 1.00 0.00 H new ATOM 0 HD22 LEU B 466 -18.637 -6.976 -25.257 1.00 0.00 H new ATOM 0 HD23 LEU B 466 -17.427 -7.494 -26.455 1.00 0.00 H new ATOM 1243 N GLU B 467 -14.691 -7.864 -26.753 1.00 0.00 N ATOM 1244 CA GLU B 467 -13.937 -9.042 -27.148 1.00 0.00 C ATOM 1245 C GLU B 467 -12.583 -8.634 -27.732 1.00 0.00 C ATOM 1246 O GLU B 467 -11.675 -9.457 -27.836 1.00 0.00 O ATOM 1247 CB GLU B 467 -14.729 -9.893 -28.142 1.00 0.00 C ATOM 1248 CG GLU B 467 -14.820 -11.345 -27.670 1.00 0.00 C ATOM 1249 CD GLU B 467 -15.249 -12.267 -28.813 1.00 0.00 C ATOM 1250 OE1 GLU B 467 -16.200 -11.882 -29.527 1.00 0.00 O ATOM 1251 OE2 GLU B 467 -14.616 -13.337 -28.947 1.00 0.00 O ATOM 0 H GLU B 467 -15.591 -7.757 -27.221 1.00 0.00 H new ATOM 0 HA GLU B 467 -13.760 -9.650 -26.261 1.00 0.00 H new ATOM 0 HB2 GLU B 467 -15.732 -9.482 -28.260 1.00 0.00 H new ATOM 0 HB3 GLU B 467 -14.251 -9.854 -29.121 1.00 0.00 H new ATOM 0 HG2 GLU B 467 -13.853 -11.666 -27.282 1.00 0.00 H new ATOM 0 HG3 GLU B 467 -15.534 -11.420 -26.850 1.00 0.00 H new ATOM 1258 N LYS B 468 -12.490 -7.364 -28.098 1.00 0.00 N ATOM 1259 CA LYS B 468 -11.263 -6.838 -28.670 1.00 0.00 C ATOM 1260 C LYS B 468 -10.674 -5.789 -27.724 1.00 0.00 C ATOM 1261 O LYS B 468 -9.666 -5.158 -28.042 1.00 0.00 O ATOM 1262 CB LYS B 468 -11.511 -6.318 -30.087 1.00 0.00 C ATOM 1263 CG LYS B 468 -12.216 -7.373 -30.942 1.00 0.00 C ATOM 1264 CD LYS B 468 -11.380 -7.726 -32.175 1.00 0.00 C ATOM 1265 CE LYS B 468 -11.317 -9.241 -32.378 1.00 0.00 C ATOM 1266 NZ LYS B 468 -12.495 -9.711 -33.142 1.00 0.00 N ATOM 0 H LYS B 468 -13.245 -6.684 -28.009 1.00 0.00 H new ATOM 0 HA LYS B 468 -10.521 -7.629 -28.772 1.00 0.00 H new ATOM 0 HB2 LYS B 468 -12.118 -5.413 -30.045 1.00 0.00 H new ATOM 0 HB3 LYS B 468 -10.562 -6.045 -30.549 1.00 0.00 H new ATOM 0 HG2 LYS B 468 -12.392 -8.270 -30.348 1.00 0.00 H new ATOM 0 HG3 LYS B 468 -13.192 -7.001 -31.254 1.00 0.00 H new ATOM 0 HD2 LYS B 468 -11.811 -7.255 -33.058 1.00 0.00 H new ATOM 0 HD3 LYS B 468 -10.372 -7.328 -32.061 1.00 0.00 H new ATOM 0 HE2 LYS B 468 -10.403 -9.505 -32.909 1.00 0.00 H new ATOM 0 HE3 LYS B 468 -11.280 -9.742 -31.411 1.00 0.00 H new ATOM 0 HZ1 LYS B 468 -12.437 -10.741 -33.271 1.00 0.00 H new ATOM 0 HZ2 LYS B 468 -13.363 -9.476 -32.620 1.00 0.00 H new ATOM 0 HZ3 LYS B 468 -12.514 -9.246 -34.072 1.00 0.00 H new ATOM 1280 N CYS B 469 -11.327 -5.635 -26.582 1.00 0.00 N ATOM 1281 CA CYS B 469 -10.880 -4.673 -25.588 1.00 0.00 C ATOM 1282 C CYS B 469 -10.444 -5.441 -24.339 1.00 0.00 C ATOM 1283 O CYS B 469 -9.711 -4.911 -23.505 1.00 0.00 O ATOM 1284 CB CYS B 469 -11.965 -3.640 -25.274 1.00 0.00 C ATOM 1285 SG CYS B 469 -11.505 -2.016 -25.980 1.00 0.00 S ATOM 0 H CYS B 469 -12.162 -6.160 -26.322 1.00 0.00 H new ATOM 0 HA CYS B 469 -10.034 -4.107 -25.979 1.00 0.00 H new ATOM 0 HB2 CYS B 469 -12.920 -3.967 -25.685 1.00 0.00 H new ATOM 0 HB3 CYS B 469 -12.095 -3.553 -24.195 1.00 0.00 H new ATOM 0 HG CYS B 469 -10.594 -1.462 -25.236 1.00 0.00 H new ATOM 1291 N ARG B 470 -10.912 -6.677 -24.249 1.00 0.00 N ATOM 1292 CA ARG B 470 -10.579 -7.522 -23.115 1.00 0.00 C ATOM 1293 C ARG B 470 -9.063 -7.571 -22.917 1.00 0.00 C ATOM 1294 O ARG B 470 -8.303 -7.411 -23.871 1.00 0.00 O ATOM 1295 CB ARG B 470 -11.106 -8.944 -23.315 1.00 0.00 C ATOM 1296 CG ARG B 470 -12.628 -8.948 -23.471 1.00 0.00 C ATOM 1297 CD ARG B 470 -13.275 -9.956 -22.518 1.00 0.00 C ATOM 1298 NE ARG B 470 -13.636 -11.188 -23.254 1.00 0.00 N ATOM 1299 CZ ARG B 470 -14.419 -12.156 -22.759 1.00 0.00 C ATOM 1300 NH1 ARG B 470 -14.927 -12.042 -21.525 1.00 0.00 N ATOM 1301 NH2 ARG B 470 -14.694 -13.239 -23.499 1.00 0.00 N ATOM 0 H ARG B 470 -11.519 -7.114 -24.943 1.00 0.00 H new ATOM 0 HA ARG B 470 -11.051 -7.092 -22.231 1.00 0.00 H new ATOM 0 HB2 ARG B 470 -10.645 -9.385 -24.199 1.00 0.00 H new ATOM 0 HB3 ARG B 470 -10.822 -9.564 -22.464 1.00 0.00 H new ATOM 0 HG2 ARG B 470 -13.020 -7.951 -23.272 1.00 0.00 H new ATOM 0 HG3 ARG B 470 -12.891 -9.194 -24.500 1.00 0.00 H new ATOM 0 HD2 ARG B 470 -12.587 -10.195 -21.707 1.00 0.00 H new ATOM 0 HD3 ARG B 470 -14.165 -9.520 -22.063 1.00 0.00 H new ATOM 0 HE ARG B 470 -13.266 -11.308 -24.197 1.00 0.00 H new ATOM 0 HH11 ARG B 470 -14.718 -11.218 -20.962 1.00 0.00 H new ATOM 0 HH12 ARG B 470 -15.523 -12.779 -21.149 1.00 0.00 H new ATOM 0 HH21 ARG B 470 -14.307 -13.326 -24.439 1.00 0.00 H new ATOM 0 HH22 ARG B 470 -15.290 -13.976 -23.122 1.00 0.00 H new ATOM 1315 N GLY B 471 -8.668 -7.793 -21.672 1.00 0.00 N ATOM 1316 CA GLY B 471 -7.256 -7.863 -21.336 1.00 0.00 C ATOM 1317 C GLY B 471 -7.053 -8.457 -19.940 1.00 0.00 C ATOM 1318 O GLY B 471 -8.019 -8.798 -19.261 1.00 0.00 O ATOM 0 H GLY B 471 -9.301 -7.927 -20.884 1.00 0.00 H new ATOM 0 HA2 GLY B 471 -6.733 -8.472 -22.074 1.00 0.00 H new ATOM 0 HA3 GLY B 471 -6.819 -6.865 -21.378 1.00 0.00 H new ATOM 1322 N VAL B 472 -5.790 -8.562 -19.555 1.00 0.00 N ATOM 1323 CA VAL B 472 -5.448 -9.108 -18.252 1.00 0.00 C ATOM 1324 C VAL B 472 -4.655 -8.067 -17.460 1.00 0.00 C ATOM 1325 O VAL B 472 -3.839 -7.340 -18.025 1.00 0.00 O ATOM 1326 CB VAL B 472 -4.697 -10.430 -18.421 1.00 0.00 C ATOM 1327 CG1 VAL B 472 -4.191 -10.949 -17.073 1.00 0.00 C ATOM 1328 CG2 VAL B 472 -5.573 -11.474 -19.115 1.00 0.00 C ATOM 0 H VAL B 472 -4.991 -8.278 -20.122 1.00 0.00 H new ATOM 0 HA VAL B 472 -6.350 -9.332 -17.682 1.00 0.00 H new ATOM 0 HB VAL B 472 -3.831 -10.244 -19.056 1.00 0.00 H new ATOM 0 HG11 VAL B 472 -3.661 -11.890 -17.221 1.00 0.00 H new ATOM 0 HG12 VAL B 472 -3.515 -10.217 -16.632 1.00 0.00 H new ATOM 0 HG13 VAL B 472 -5.037 -11.111 -16.405 1.00 0.00 H new ATOM 0 HG21 VAL B 472 -5.015 -12.404 -19.222 1.00 0.00 H new ATOM 0 HG22 VAL B 472 -6.467 -11.654 -18.518 1.00 0.00 H new ATOM 0 HG23 VAL B 472 -5.863 -11.109 -20.100 1.00 0.00 H new ATOM 1338 N PHE B 473 -4.922 -8.028 -16.163 1.00 0.00 N ATOM 1339 CA PHE B 473 -4.243 -7.089 -15.286 1.00 0.00 C ATOM 1340 C PHE B 473 -4.047 -7.684 -13.891 1.00 0.00 C ATOM 1341 O PHE B 473 -4.856 -8.493 -13.438 1.00 0.00 O ATOM 1342 CB PHE B 473 -5.136 -5.851 -15.179 1.00 0.00 C ATOM 1343 CG PHE B 473 -6.408 -6.070 -14.357 1.00 0.00 C ATOM 1344 CD1 PHE B 473 -7.407 -6.851 -14.847 1.00 0.00 C ATOM 1345 CD2 PHE B 473 -6.538 -5.484 -13.137 1.00 0.00 C ATOM 1346 CE1 PHE B 473 -8.588 -7.055 -14.085 1.00 0.00 C ATOM 1347 CE2 PHE B 473 -7.719 -5.688 -12.375 1.00 0.00 C ATOM 1348 CZ PHE B 473 -8.718 -6.469 -12.864 1.00 0.00 C ATOM 0 H PHE B 473 -5.600 -8.632 -15.698 1.00 0.00 H new ATOM 0 HA PHE B 473 -3.260 -6.848 -15.690 1.00 0.00 H new ATOM 0 HB2 PHE B 473 -4.562 -5.039 -14.732 1.00 0.00 H new ATOM 0 HB3 PHE B 473 -5.415 -5.529 -16.182 1.00 0.00 H new ATOM 0 HD1 PHE B 473 -7.303 -7.316 -15.816 1.00 0.00 H new ATOM 0 HD2 PHE B 473 -5.744 -4.864 -12.748 1.00 0.00 H new ATOM 0 HE1 PHE B 473 -9.382 -7.675 -14.474 1.00 0.00 H new ATOM 0 HE2 PHE B 473 -7.823 -5.222 -11.406 1.00 0.00 H new ATOM 0 HZ PHE B 473 -9.615 -6.624 -12.283 1.00 0.00 H new ATOM 1358 N PRO B 474 -2.941 -7.250 -13.230 1.00 0.00 N ATOM 1359 CA PRO B 474 -2.628 -7.731 -11.895 1.00 0.00 C ATOM 1360 C PRO B 474 -3.545 -7.088 -10.853 1.00 0.00 C ATOM 1361 O PRO B 474 -3.518 -5.873 -10.662 1.00 0.00 O ATOM 1362 CB PRO B 474 -1.162 -7.391 -11.687 1.00 0.00 C ATOM 1363 CG PRO B 474 -0.831 -6.324 -12.719 1.00 0.00 C ATOM 1364 CD PRO B 474 -1.961 -6.293 -13.735 1.00 0.00 C ATOM 0 HA PRO B 474 -2.793 -8.803 -11.784 1.00 0.00 H new ATOM 0 HB2 PRO B 474 -0.986 -7.024 -10.676 1.00 0.00 H new ATOM 0 HB3 PRO B 474 -0.534 -8.272 -11.821 1.00 0.00 H new ATOM 0 HG2 PRO B 474 -0.721 -5.351 -12.240 1.00 0.00 H new ATOM 0 HG3 PRO B 474 0.117 -6.547 -13.209 1.00 0.00 H new ATOM 0 HD2 PRO B 474 -2.390 -5.295 -13.820 1.00 0.00 H new ATOM 0 HD3 PRO B 474 -1.609 -6.574 -14.728 1.00 0.00 H new ATOM 1372 N GLU B 475 -4.335 -7.932 -10.205 1.00 0.00 N ATOM 1373 CA GLU B 475 -5.259 -7.462 -9.187 1.00 0.00 C ATOM 1374 C GLU B 475 -4.490 -6.971 -7.959 1.00 0.00 C ATOM 1375 O GLU B 475 -4.934 -6.054 -7.270 1.00 0.00 O ATOM 1376 CB GLU B 475 -6.259 -8.555 -8.807 1.00 0.00 C ATOM 1377 CG GLU B 475 -6.908 -8.258 -7.453 1.00 0.00 C ATOM 1378 CD GLU B 475 -8.386 -8.654 -7.455 1.00 0.00 C ATOM 1379 OE1 GLU B 475 -9.166 -7.932 -8.111 1.00 0.00 O ATOM 1380 OE2 GLU B 475 -8.701 -9.670 -6.799 1.00 0.00 O ATOM 0 H GLU B 475 -4.354 -8.939 -10.366 1.00 0.00 H new ATOM 0 HA GLU B 475 -5.825 -6.625 -9.596 1.00 0.00 H new ATOM 0 HB2 GLU B 475 -7.029 -8.631 -9.575 1.00 0.00 H new ATOM 0 HB3 GLU B 475 -5.752 -9.519 -8.768 1.00 0.00 H new ATOM 0 HG2 GLU B 475 -6.383 -8.801 -6.667 1.00 0.00 H new ATOM 0 HG3 GLU B 475 -6.813 -7.196 -7.225 1.00 0.00 H new ATOM 1387 N ASN B 476 -3.349 -7.603 -7.723 1.00 0.00 N ATOM 1388 CA ASN B 476 -2.515 -7.243 -6.589 1.00 0.00 C ATOM 1389 C ASN B 476 -1.867 -5.882 -6.851 1.00 0.00 C ATOM 1390 O ASN B 476 -1.199 -5.330 -5.977 1.00 0.00 O ATOM 1391 CB ASN B 476 -1.397 -8.266 -6.381 1.00 0.00 C ATOM 1392 CG ASN B 476 -0.510 -8.371 -7.624 1.00 0.00 C ATOM 1393 OD1 ASN B 476 0.487 -7.683 -7.766 1.00 0.00 O ATOM 1394 ND2 ASN B 476 -0.929 -9.267 -8.513 1.00 0.00 N ATOM 0 H ASN B 476 -2.983 -8.362 -8.298 1.00 0.00 H new ATOM 0 HA ASN B 476 -3.147 -7.214 -5.701 1.00 0.00 H new ATOM 0 HB2 ASN B 476 -0.792 -7.978 -5.521 1.00 0.00 H new ATOM 0 HB3 ASN B 476 -1.829 -9.241 -6.155 1.00 0.00 H new ATOM 0 HD21 ASN B 476 -0.406 -9.411 -9.377 1.00 0.00 H new ATOM 0 HD22 ASN B 476 -1.773 -9.810 -8.331 1.00 0.00 H new ATOM 1401 N PHE B 477 -2.087 -5.379 -8.057 1.00 0.00 N ATOM 1402 CA PHE B 477 -1.533 -4.093 -8.444 1.00 0.00 C ATOM 1403 C PHE B 477 -2.638 -3.046 -8.605 1.00 0.00 C ATOM 1404 O PHE B 477 -2.366 -1.902 -8.964 1.00 0.00 O ATOM 1405 CB PHE B 477 -0.837 -4.293 -9.791 1.00 0.00 C ATOM 1406 CG PHE B 477 -0.958 -3.097 -10.738 1.00 0.00 C ATOM 1407 CD1 PHE B 477 -2.133 -2.852 -11.377 1.00 0.00 C ATOM 1408 CD2 PHE B 477 0.110 -2.280 -10.941 1.00 0.00 C ATOM 1409 CE1 PHE B 477 -2.245 -1.742 -12.256 1.00 0.00 C ATOM 1410 CE2 PHE B 477 -0.002 -1.170 -11.820 1.00 0.00 C ATOM 1411 CZ PHE B 477 -1.177 -0.925 -12.458 1.00 0.00 C ATOM 0 H PHE B 477 -2.641 -5.839 -8.779 1.00 0.00 H new ATOM 0 HA PHE B 477 -0.843 -3.740 -7.678 1.00 0.00 H new ATOM 0 HB2 PHE B 477 0.219 -4.499 -9.616 1.00 0.00 H new ATOM 0 HB3 PHE B 477 -1.257 -5.173 -10.278 1.00 0.00 H new ATOM 0 HD1 PHE B 477 -2.981 -3.501 -11.216 1.00 0.00 H new ATOM 0 HD2 PHE B 477 1.043 -2.475 -10.434 1.00 0.00 H new ATOM 0 HE1 PHE B 477 -3.178 -1.547 -12.764 1.00 0.00 H new ATOM 0 HE2 PHE B 477 0.846 -0.521 -11.981 1.00 0.00 H new ATOM 0 HZ PHE B 477 -1.262 -0.081 -13.126 1.00 0.00 H new ATOM 1421 N THR B 478 -3.861 -3.477 -8.331 1.00 0.00 N ATOM 1422 CA THR B 478 -5.007 -2.591 -8.439 1.00 0.00 C ATOM 1423 C THR B 478 -5.807 -2.592 -7.135 1.00 0.00 C ATOM 1424 O THR B 478 -5.454 -3.291 -6.187 1.00 0.00 O ATOM 1425 CB THR B 478 -5.828 -3.025 -9.656 1.00 0.00 C ATOM 1426 OG1 THR B 478 -5.622 -4.433 -9.728 1.00 0.00 O ATOM 1427 CG2 THR B 478 -5.251 -2.496 -10.970 1.00 0.00 C ATOM 0 H THR B 478 -4.083 -4.427 -8.035 1.00 0.00 H new ATOM 0 HA THR B 478 -4.695 -1.558 -8.591 1.00 0.00 H new ATOM 0 HB THR B 478 -6.855 -2.677 -9.545 1.00 0.00 H new ATOM 0 HG1 THR B 478 -4.806 -4.619 -10.239 1.00 0.00 H new ATOM 0 HG21 THR B 478 -5.871 -2.833 -11.801 1.00 0.00 H new ATOM 0 HG22 THR B 478 -5.235 -1.406 -10.948 1.00 0.00 H new ATOM 0 HG23 THR B 478 -4.236 -2.872 -11.099 1.00 0.00 H new ATOM 1435 N GLU B 479 -6.871 -1.802 -7.130 1.00 0.00 N ATOM 1436 CA GLU B 479 -7.724 -1.703 -5.958 1.00 0.00 C ATOM 1437 C GLU B 479 -9.190 -1.901 -6.350 1.00 0.00 C ATOM 1438 O GLU B 479 -9.605 -1.496 -7.435 1.00 0.00 O ATOM 1439 CB GLU B 479 -7.523 -0.365 -5.244 1.00 0.00 C ATOM 1440 CG GLU B 479 -7.427 -0.561 -3.729 1.00 0.00 C ATOM 1441 CD GLU B 479 -7.598 0.770 -2.993 1.00 0.00 C ATOM 1442 OE1 GLU B 479 -6.650 1.582 -3.061 1.00 0.00 O ATOM 1443 OE2 GLU B 479 -8.672 0.944 -2.378 1.00 0.00 O ATOM 0 H GLU B 479 -7.162 -1.225 -7.919 1.00 0.00 H new ATOM 0 HA GLU B 479 -7.444 -2.494 -5.262 1.00 0.00 H new ATOM 0 HB2 GLU B 479 -6.615 0.114 -5.611 1.00 0.00 H new ATOM 0 HB3 GLU B 479 -8.352 0.303 -5.476 1.00 0.00 H new ATOM 0 HG2 GLU B 479 -8.193 -1.264 -3.400 1.00 0.00 H new ATOM 0 HG3 GLU B 479 -6.462 -1.000 -3.476 1.00 0.00 H new ATOM 1450 N ARG B 480 -9.932 -2.522 -5.446 1.00 0.00 N ATOM 1451 CA ARG B 480 -11.343 -2.778 -5.684 1.00 0.00 C ATOM 1452 C ARG B 480 -12.182 -1.578 -5.240 1.00 0.00 C ATOM 1453 O ARG B 480 -12.009 -1.071 -4.133 1.00 0.00 O ATOM 1454 CB ARG B 480 -11.811 -4.025 -4.932 1.00 0.00 C ATOM 1455 CG ARG B 480 -10.969 -5.244 -5.315 1.00 0.00 C ATOM 1456 CD ARG B 480 -11.806 -6.525 -5.270 1.00 0.00 C ATOM 1457 NE ARG B 480 -11.141 -7.534 -4.416 1.00 0.00 N ATOM 1458 CZ ARG B 480 -11.210 -7.549 -3.078 1.00 0.00 C ATOM 1459 NH1 ARG B 480 -11.916 -6.610 -2.433 1.00 0.00 N ATOM 1460 NH2 ARG B 480 -10.575 -8.503 -2.384 1.00 0.00 N ATOM 0 H ARG B 480 -9.583 -2.856 -4.547 1.00 0.00 H new ATOM 0 HA ARG B 480 -11.475 -2.942 -6.754 1.00 0.00 H new ATOM 0 HB2 ARG B 480 -11.742 -3.854 -3.858 1.00 0.00 H new ATOM 0 HB3 ARG B 480 -12.860 -4.218 -5.157 1.00 0.00 H new ATOM 0 HG2 ARG B 480 -10.560 -5.108 -6.316 1.00 0.00 H new ATOM 0 HG3 ARG B 480 -10.123 -5.334 -4.634 1.00 0.00 H new ATOM 0 HD2 ARG B 480 -12.800 -6.306 -4.881 1.00 0.00 H new ATOM 0 HD3 ARG B 480 -11.937 -6.919 -6.278 1.00 0.00 H new ATOM 0 HE ARG B 480 -10.596 -8.264 -4.875 1.00 0.00 H new ATOM 0 HH11 ARG B 480 -12.401 -5.884 -2.961 1.00 0.00 H new ATOM 0 HH12 ARG B 480 -11.969 -6.621 -1.414 1.00 0.00 H new ATOM 0 HH21 ARG B 480 -10.038 -9.219 -2.874 1.00 0.00 H new ATOM 0 HH22 ARG B 480 -10.628 -8.514 -1.365 1.00 0.00 H new ATOM 1474 N VAL B 481 -13.073 -1.159 -6.126 1.00 0.00 N ATOM 1475 CA VAL B 481 -13.939 -0.028 -5.840 1.00 0.00 C ATOM 1476 C VAL B 481 -15.366 -0.530 -5.608 1.00 0.00 C ATOM 1477 O VAL B 481 -15.974 -1.117 -6.501 1.00 0.00 O ATOM 1478 CB VAL B 481 -13.844 1.003 -6.966 1.00 0.00 C ATOM 1479 CG1 VAL B 481 -14.609 2.278 -6.608 1.00 0.00 C ATOM 1480 CG2 VAL B 481 -12.384 1.315 -7.301 1.00 0.00 C ATOM 0 H VAL B 481 -13.214 -1.583 -7.043 1.00 0.00 H new ATOM 0 HA VAL B 481 -13.619 0.477 -4.928 1.00 0.00 H new ATOM 0 HB VAL B 481 -14.307 0.573 -7.854 1.00 0.00 H new ATOM 0 HG11 VAL B 481 -14.525 2.994 -7.425 1.00 0.00 H new ATOM 0 HG12 VAL B 481 -15.659 2.038 -6.442 1.00 0.00 H new ATOM 0 HG13 VAL B 481 -14.189 2.712 -5.701 1.00 0.00 H new ATOM 0 HG21 VAL B 481 -12.344 2.051 -8.104 1.00 0.00 H new ATOM 0 HG22 VAL B 481 -11.886 1.715 -6.418 1.00 0.00 H new ATOM 0 HG23 VAL B 481 -11.881 0.402 -7.620 1.00 0.00 H new ATOM 1490 N PRO B 482 -15.872 -0.273 -4.371 1.00 0.00 N ATOM 1491 CA PRO B 482 -17.215 -0.693 -4.010 1.00 0.00 C ATOM 1492 C PRO B 482 -18.265 0.207 -4.665 1.00 0.00 C ATOM 1493 O PRO B 482 -18.410 0.211 -5.886 1.00 0.00 O ATOM 1494 CB PRO B 482 -17.249 -0.638 -2.492 1.00 0.00 C ATOM 1495 CG PRO B 482 -16.086 0.249 -2.080 1.00 0.00 C ATOM 1496 CD PRO B 482 -15.180 0.421 -3.289 1.00 0.00 C ATOM 0 HA PRO B 482 -17.452 -1.696 -4.364 1.00 0.00 H new ATOM 0 HB2 PRO B 482 -18.196 -0.230 -2.137 1.00 0.00 H new ATOM 0 HB3 PRO B 482 -17.151 -1.635 -2.063 1.00 0.00 H new ATOM 0 HG2 PRO B 482 -16.448 1.217 -1.734 1.00 0.00 H new ATOM 0 HG3 PRO B 482 -15.537 -0.201 -1.253 1.00 0.00 H new ATOM 0 HD2 PRO B 482 -15.031 1.475 -3.526 1.00 0.00 H new ATOM 0 HD3 PRO B 482 -14.194 -0.008 -3.110 1.00 0.00 H new