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 139:sc= -1.21 (180deg=-2.92!) USER MOD Single : B 413 LYS NZ :NH3+ -151:sc= -0.439 (180deg=-0.859) USER MOD Single : B 415 GLN : amide:sc= -3.94 K(o=-3.9,f=-1.1) USER MOD Single : B 417 GLN : amide:sc= -2.72! C(o=-2.7!,f=-2.6!) USER MOD Single : B 418 HIS : no HD1:sc= -0.872 X(o=-0.87,f=-0.54) USER MOD Single : B 420 TYR OH : rot -174:sc= 0.611 USER MOD Single : B 421 THR OG1 : rot 180:sc= 0 USER MOD Single : B 423 THR OG1 : rot 50:sc= 0.323 USER MOD Single : B 425 THR OG1 : rot -34:sc= 0.476 USER MOD Single : B 429 GLN : amide:sc= -0.151 X(o=-0.15,f=-0.042) USER MOD Single : B 431 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0369) USER MOD Single : B 453 MET CE :methyl 137:sc= -2.73 (180deg=-5.65!) USER MOD Single : B 456 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 458 SER OG : rot 180:sc= 0 USER MOD Single : B 461 ASN : amide:sc= -0.964 K(o=-0.96,f=-0.025) USER MOD Single : B 462 GLN : amide:sc= -1.69 K(o=-1.7,f=-0.092) USER MOD Single : B 463 HIS : no HD1:sc= -3.24! C(o=-3.2!,f=-1.3!) 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 90:sc= -5.54! USER MOD Single : B 476 ASN : amide:sc= -5.27! C(o=-5.3!,f=-11!) USER MOD Single : B 478 THR OG1 : rot -88:sc= -0.509 USER MOD ----------------------------------------------------------------- ATOM 67 N PRO A 59 4.953 -7.620 -8.830 1.00 0.00 N ATOM 68 CA PRO A 59 4.862 -9.064 -8.973 1.00 0.00 C ATOM 69 C PRO A 59 6.050 -9.612 -9.767 1.00 0.00 C ATOM 70 O PRO A 59 6.836 -8.847 -10.323 1.00 0.00 O ATOM 71 CB PRO A 59 3.527 -9.308 -9.657 1.00 0.00 C ATOM 72 CG PRO A 59 3.134 -7.982 -10.288 1.00 0.00 C ATOM 73 CD PRO A 59 4.024 -6.902 -9.697 1.00 0.00 C ATOM 0 HA PRO A 59 4.905 -9.585 -8.017 1.00 0.00 H new ATOM 0 HB2 PRO A 59 3.612 -10.090 -10.412 1.00 0.00 H new ATOM 0 HB3 PRO A 59 2.775 -9.637 -8.940 1.00 0.00 H new ATOM 0 HG2 PRO A 59 3.253 -8.024 -11.371 1.00 0.00 H new ATOM 0 HG3 PRO A 59 2.085 -7.762 -10.091 1.00 0.00 H new ATOM 0 HD2 PRO A 59 4.553 -6.354 -10.477 1.00 0.00 H new ATOM 0 HD3 PRO A 59 3.441 -6.172 -9.135 1.00 0.00 H new ATOM 81 N PRO A 60 6.146 -10.968 -9.794 1.00 0.00 N ATOM 82 CA PRO A 60 7.224 -11.628 -10.511 1.00 0.00 C ATOM 83 C PRO A 60 6.988 -11.579 -12.022 1.00 0.00 C ATOM 84 O PRO A 60 5.873 -11.316 -12.472 1.00 0.00 O ATOM 85 CB PRO A 60 7.254 -13.044 -9.960 1.00 0.00 C ATOM 86 CG PRO A 60 5.903 -13.262 -9.297 1.00 0.00 C ATOM 87 CD PRO A 60 5.234 -11.906 -9.146 1.00 0.00 C ATOM 0 HA PRO A 60 8.187 -11.138 -10.366 1.00 0.00 H new ATOM 0 HB2 PRO A 60 7.420 -13.770 -10.756 1.00 0.00 H new ATOM 0 HB3 PRO A 60 8.065 -13.167 -9.243 1.00 0.00 H new ATOM 0 HG2 PRO A 60 5.285 -13.928 -9.900 1.00 0.00 H new ATOM 0 HG3 PRO A 60 6.028 -13.737 -8.324 1.00 0.00 H new ATOM 0 HD2 PRO A 60 4.252 -11.894 -9.619 1.00 0.00 H new ATOM 0 HD3 PRO A 60 5.085 -11.653 -8.096 1.00 0.00 H new ATOM 95 N LEU A 61 8.055 -11.837 -12.764 1.00 0.00 N ATOM 96 CA LEU A 61 7.978 -11.826 -14.215 1.00 0.00 C ATOM 97 C LEU A 61 6.925 -12.837 -14.673 1.00 0.00 C ATOM 98 O LEU A 61 6.941 -13.991 -14.248 1.00 0.00 O ATOM 99 CB LEU A 61 9.361 -12.058 -14.827 1.00 0.00 C ATOM 100 CG LEU A 61 9.657 -11.298 -16.121 1.00 0.00 C ATOM 101 CD1 LEU A 61 10.667 -10.175 -15.879 1.00 0.00 C ATOM 102 CD2 LEU A 61 10.117 -12.254 -17.224 1.00 0.00 C ATOM 0 H LEU A 61 8.978 -12.055 -12.387 1.00 0.00 H new ATOM 0 HA LEU A 61 7.657 -10.847 -14.572 1.00 0.00 H new ATOM 0 HB2 LEU A 61 10.114 -11.785 -14.088 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.477 -13.124 -15.021 1.00 0.00 H new ATOM 0 HG LEU A 61 8.733 -10.831 -16.462 1.00 0.00 H new ATOM 0 HD11 LEU A 61 10.860 -9.651 -16.815 1.00 0.00 H new ATOM 0 HD12 LEU A 61 10.264 -9.475 -15.147 1.00 0.00 H new ATOM 0 HD13 LEU A 61 11.598 -10.598 -15.502 1.00 0.00 H new ATOM 0 HD21 LEU A 61 10.321 -11.689 -18.133 1.00 0.00 H new ATOM 0 HD22 LEU A 61 11.024 -12.768 -16.905 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.334 -12.987 -17.420 1.00 0.00 H new ATOM 114 N SER A 62 6.035 -12.367 -15.535 1.00 0.00 N ATOM 115 CA SER A 62 4.977 -13.216 -16.056 1.00 0.00 C ATOM 116 C SER A 62 5.433 -13.881 -17.357 1.00 0.00 C ATOM 117 O SER A 62 6.321 -13.373 -18.040 1.00 0.00 O ATOM 118 CB SER A 62 3.694 -12.416 -16.290 1.00 0.00 C ATOM 119 OG SER A 62 3.862 -11.418 -17.293 1.00 0.00 O ATOM 0 H SER A 62 6.025 -11.409 -15.886 1.00 0.00 H new ATOM 0 HA SER A 62 4.762 -13.988 -15.317 1.00 0.00 H new ATOM 0 HB2 SER A 62 2.893 -13.094 -16.584 1.00 0.00 H new ATOM 0 HB3 SER A 62 3.386 -11.944 -15.357 1.00 0.00 H new ATOM 0 HG SER A 62 3.020 -10.931 -17.414 1.00 0.00 H new ATOM 125 N PRO A 63 4.788 -15.037 -17.668 1.00 0.00 N ATOM 126 CA PRO A 63 5.118 -15.777 -18.874 1.00 0.00 C ATOM 127 C PRO A 63 4.548 -15.085 -20.114 1.00 0.00 C ATOM 128 O PRO A 63 3.797 -14.117 -20.000 1.00 0.00 O ATOM 129 CB PRO A 63 4.544 -17.167 -18.653 1.00 0.00 C ATOM 130 CG PRO A 63 3.517 -17.022 -17.541 1.00 0.00 C ATOM 131 CD PRO A 63 3.732 -15.669 -16.882 1.00 0.00 C ATOM 0 HA PRO A 63 6.192 -15.829 -19.055 1.00 0.00 H new ATOM 0 HB2 PRO A 63 4.082 -17.548 -19.564 1.00 0.00 H new ATOM 0 HB3 PRO A 63 5.326 -17.873 -18.373 1.00 0.00 H new ATOM 0 HG2 PRO A 63 2.506 -17.095 -17.943 1.00 0.00 H new ATOM 0 HG3 PRO A 63 3.628 -17.824 -16.811 1.00 0.00 H new ATOM 0 HD2 PRO A 63 2.819 -15.073 -16.894 1.00 0.00 H new ATOM 0 HD3 PRO A 63 4.027 -15.779 -15.839 1.00 0.00 H new ATOM 279 N LEU B 406 -18.539 0.196 -26.832 1.00 0.00 N ATOM 280 CA LEU B 406 -17.733 -0.317 -25.737 1.00 0.00 C ATOM 281 C LEU B 406 -17.346 -1.768 -26.031 1.00 0.00 C ATOM 282 O LEU B 406 -17.986 -2.432 -26.844 1.00 0.00 O ATOM 283 CB LEU B 406 -18.461 -0.133 -24.404 1.00 0.00 C ATOM 284 CG LEU B 406 -18.969 -1.412 -23.735 1.00 0.00 C ATOM 285 CD1 LEU B 406 -19.206 -1.191 -22.239 1.00 0.00 C ATOM 286 CD2 LEU B 406 -20.219 -1.941 -24.441 1.00 0.00 C ATOM 0 HA LEU B 406 -16.806 0.249 -25.648 1.00 0.00 H new ATOM 0 HB2 LEU B 406 -17.788 0.373 -23.712 1.00 0.00 H new ATOM 0 HB3 LEU B 406 -19.310 0.531 -24.565 1.00 0.00 H new ATOM 0 HG LEU B 406 -18.198 -2.177 -23.830 1.00 0.00 H new ATOM 0 HD11 LEU B 406 -19.567 -2.115 -21.787 1.00 0.00 H new ATOM 0 HD12 LEU B 406 -18.272 -0.895 -21.762 1.00 0.00 H new ATOM 0 HD13 LEU B 406 -19.949 -0.405 -22.100 1.00 0.00 H new ATOM 0 HD21 LEU B 406 -20.559 -2.850 -23.946 1.00 0.00 H new ATOM 0 HD22 LEU B 406 -21.006 -1.189 -24.399 1.00 0.00 H new ATOM 0 HD23 LEU B 406 -19.983 -2.162 -25.482 1.00 0.00 H new ATOM 298 N PRO B 407 -16.272 -2.228 -25.335 1.00 0.00 N ATOM 299 CA PRO B 407 -15.792 -3.588 -25.513 1.00 0.00 C ATOM 300 C PRO B 407 -16.716 -4.591 -24.819 1.00 0.00 C ATOM 301 O PRO B 407 -17.116 -4.383 -23.674 1.00 0.00 O ATOM 302 CB PRO B 407 -14.383 -3.586 -24.943 1.00 0.00 C ATOM 303 CG PRO B 407 -14.296 -2.358 -24.051 1.00 0.00 C ATOM 304 CD PRO B 407 -15.490 -1.470 -24.363 1.00 0.00 C ATOM 0 HA PRO B 407 -15.784 -3.898 -26.558 1.00 0.00 H new ATOM 0 HB2 PRO B 407 -14.190 -4.496 -24.375 1.00 0.00 H new ATOM 0 HB3 PRO B 407 -13.640 -3.544 -25.739 1.00 0.00 H new ATOM 0 HG2 PRO B 407 -14.300 -2.648 -23.000 1.00 0.00 H new ATOM 0 HG3 PRO B 407 -13.364 -1.822 -24.230 1.00 0.00 H new ATOM 0 HD2 PRO B 407 -16.071 -1.259 -23.466 1.00 0.00 H new ATOM 0 HD3 PRO B 407 -15.174 -0.510 -24.771 1.00 0.00 H new ATOM 312 N PRO B 408 -17.036 -5.686 -25.560 1.00 0.00 N ATOM 313 CA PRO B 408 -17.905 -6.722 -25.027 1.00 0.00 C ATOM 314 C PRO B 408 -17.164 -7.587 -24.006 1.00 0.00 C ATOM 315 O PRO B 408 -15.984 -7.889 -24.182 1.00 0.00 O ATOM 316 CB PRO B 408 -18.372 -7.506 -26.243 1.00 0.00 C ATOM 317 CG PRO B 408 -17.389 -7.177 -27.354 1.00 0.00 C ATOM 318 CD PRO B 408 -16.581 -5.965 -26.919 1.00 0.00 C ATOM 0 HA PRO B 408 -18.756 -6.318 -24.479 1.00 0.00 H new ATOM 0 HB2 PRO B 408 -18.384 -8.576 -26.037 1.00 0.00 H new ATOM 0 HB3 PRO B 408 -19.387 -7.224 -26.523 1.00 0.00 H new ATOM 0 HG2 PRO B 408 -16.732 -8.025 -27.545 1.00 0.00 H new ATOM 0 HG3 PRO B 408 -17.919 -6.969 -28.283 1.00 0.00 H new ATOM 0 HD2 PRO B 408 -15.511 -6.172 -26.944 1.00 0.00 H new ATOM 0 HD3 PRO B 408 -16.756 -5.115 -27.578 1.00 0.00 H new ATOM 326 N GLY B 409 -17.886 -7.961 -22.960 1.00 0.00 N ATOM 327 CA GLY B 409 -17.313 -8.786 -21.910 1.00 0.00 C ATOM 328 C GLY B 409 -16.664 -7.922 -20.827 1.00 0.00 C ATOM 329 O GLY B 409 -16.507 -8.361 -19.689 1.00 0.00 O ATOM 0 H GLY B 409 -18.864 -7.708 -22.817 1.00 0.00 H new ATOM 0 HA2 GLY B 409 -18.090 -9.408 -21.467 1.00 0.00 H new ATOM 0 HA3 GLY B 409 -16.570 -9.460 -22.337 1.00 0.00 H new ATOM 333 N PHE B 410 -16.306 -6.708 -21.219 1.00 0.00 N ATOM 334 CA PHE B 410 -15.678 -5.778 -20.295 1.00 0.00 C ATOM 335 C PHE B 410 -16.260 -5.927 -18.888 1.00 0.00 C ATOM 336 O PHE B 410 -17.434 -6.255 -18.729 1.00 0.00 O ATOM 337 CB PHE B 410 -15.974 -4.368 -20.810 1.00 0.00 C ATOM 338 CG PHE B 410 -15.891 -3.283 -19.735 1.00 0.00 C ATOM 339 CD1 PHE B 410 -14.681 -2.796 -19.351 1.00 0.00 C ATOM 340 CD2 PHE B 410 -17.029 -2.804 -19.163 1.00 0.00 C ATOM 341 CE1 PHE B 410 -14.604 -1.789 -18.353 1.00 0.00 C ATOM 342 CE2 PHE B 410 -16.952 -1.797 -18.165 1.00 0.00 C ATOM 343 CZ PHE B 410 -15.741 -1.311 -17.781 1.00 0.00 C ATOM 0 H PHE B 410 -16.439 -6.347 -22.164 1.00 0.00 H new ATOM 0 HA PHE B 410 -14.607 -5.974 -20.239 1.00 0.00 H new ATOM 0 HB2 PHE B 410 -15.271 -4.129 -21.608 1.00 0.00 H new ATOM 0 HB3 PHE B 410 -16.972 -4.355 -21.249 1.00 0.00 H new ATOM 0 HD1 PHE B 410 -13.778 -3.175 -19.805 1.00 0.00 H new ATOM 0 HD2 PHE B 410 -17.991 -3.190 -19.468 1.00 0.00 H new ATOM 0 HE1 PHE B 410 -13.643 -1.403 -18.048 1.00 0.00 H new ATOM 0 HE2 PHE B 410 -17.855 -1.417 -17.711 1.00 0.00 H new ATOM 0 HZ PHE B 410 -15.683 -0.545 -17.022 1.00 0.00 H new ATOM 353 N MET B 411 -15.410 -5.678 -17.902 1.00 0.00 N ATOM 354 CA MET B 411 -15.825 -5.780 -16.513 1.00 0.00 C ATOM 355 C MET B 411 -15.985 -4.393 -15.887 1.00 0.00 C ATOM 356 O MET B 411 -17.104 -3.948 -15.634 1.00 0.00 O ATOM 357 CB MET B 411 -14.784 -6.579 -15.726 1.00 0.00 C ATOM 358 CG MET B 411 -14.647 -7.997 -16.282 1.00 0.00 C ATOM 359 SD MET B 411 -13.865 -9.053 -15.074 1.00 0.00 S ATOM 360 CE MET B 411 -12.641 -9.848 -16.103 1.00 0.00 C ATOM 0 H MET B 411 -14.436 -5.406 -18.038 1.00 0.00 H new ATOM 0 HA MET B 411 -16.788 -6.288 -16.477 1.00 0.00 H new ATOM 0 HB2 MET B 411 -13.820 -6.072 -15.772 1.00 0.00 H new ATOM 0 HB3 MET B 411 -15.072 -6.623 -14.676 1.00 0.00 H new ATOM 0 HG2 MET B 411 -15.630 -8.392 -16.540 1.00 0.00 H new ATOM 0 HG3 MET B 411 -14.058 -7.982 -17.199 1.00 0.00 H new ATOM 0 HE1 MET B 411 -11.701 -9.925 -15.557 1.00 0.00 H new ATOM 0 HE2 MET B 411 -12.986 -10.846 -16.374 1.00 0.00 H new ATOM 0 HE3 MET B 411 -12.488 -9.259 -17.008 1.00 0.00 H new ATOM 370 N PHE B 412 -14.851 -3.749 -15.654 1.00 0.00 N ATOM 371 CA PHE B 412 -14.852 -2.423 -15.060 1.00 0.00 C ATOM 372 C PHE B 412 -13.531 -1.700 -15.333 1.00 0.00 C ATOM 373 O PHE B 412 -12.621 -2.267 -15.936 1.00 0.00 O ATOM 374 CB PHE B 412 -15.015 -2.609 -13.550 1.00 0.00 C ATOM 375 CG PHE B 412 -14.134 -3.712 -12.960 1.00 0.00 C ATOM 376 CD1 PHE B 412 -12.799 -3.506 -12.803 1.00 0.00 C ATOM 377 CD2 PHE B 412 -14.686 -4.900 -12.593 1.00 0.00 C ATOM 378 CE1 PHE B 412 -11.982 -4.530 -12.256 1.00 0.00 C ATOM 379 CE2 PHE B 412 -13.869 -5.924 -12.046 1.00 0.00 C ATOM 380 CZ PHE B 412 -12.534 -5.717 -11.889 1.00 0.00 C ATOM 0 H PHE B 412 -13.925 -4.121 -15.866 1.00 0.00 H new ATOM 0 HA PHE B 412 -15.658 -1.825 -15.485 1.00 0.00 H new ATOM 0 HB2 PHE B 412 -14.784 -1.668 -13.051 1.00 0.00 H new ATOM 0 HB3 PHE B 412 -16.059 -2.837 -13.333 1.00 0.00 H new ATOM 0 HD1 PHE B 412 -12.360 -2.563 -13.095 1.00 0.00 H new ATOM 0 HD2 PHE B 412 -15.746 -5.064 -12.718 1.00 0.00 H new ATOM 0 HE1 PHE B 412 -10.922 -4.366 -12.131 1.00 0.00 H new ATOM 0 HE2 PHE B 412 -14.307 -6.867 -11.755 1.00 0.00 H new ATOM 0 HZ PHE B 412 -11.912 -6.496 -11.473 1.00 0.00 H new ATOM 390 N LYS B 413 -13.469 -0.457 -14.877 1.00 0.00 N ATOM 391 CA LYS B 413 -12.275 0.350 -15.065 1.00 0.00 C ATOM 392 C LYS B 413 -11.377 0.219 -13.833 1.00 0.00 C ATOM 393 O LYS B 413 -11.864 0.207 -12.704 1.00 0.00 O ATOM 394 CB LYS B 413 -12.653 1.794 -15.400 1.00 0.00 C ATOM 395 CG LYS B 413 -12.063 2.216 -16.747 1.00 0.00 C ATOM 396 CD LYS B 413 -10.553 2.438 -16.640 1.00 0.00 C ATOM 397 CE LYS B 413 -10.217 3.363 -15.467 1.00 0.00 C ATOM 398 NZ LYS B 413 -11.105 4.547 -15.470 1.00 0.00 N ATOM 0 H LYS B 413 -14.226 0.011 -14.378 1.00 0.00 H new ATOM 0 HA LYS B 413 -11.701 -0.011 -15.918 1.00 0.00 H new ATOM 0 HB2 LYS B 413 -13.738 1.893 -15.427 1.00 0.00 H new ATOM 0 HB3 LYS B 413 -12.292 2.460 -14.616 1.00 0.00 H new ATOM 0 HG2 LYS B 413 -12.269 1.450 -17.494 1.00 0.00 H new ATOM 0 HG3 LYS B 413 -12.545 3.132 -17.088 1.00 0.00 H new ATOM 0 HD2 LYS B 413 -10.049 1.480 -16.509 1.00 0.00 H new ATOM 0 HD3 LYS B 413 -10.179 2.870 -17.568 1.00 0.00 H new ATOM 0 HE2 LYS B 413 -10.325 2.822 -14.527 1.00 0.00 H new ATOM 0 HE3 LYS B 413 -9.177 3.681 -15.533 1.00 0.00 H new ATOM 0 HZ1 LYS B 413 -10.609 5.354 -15.042 1.00 0.00 H new ATOM 0 HZ2 LYS B 413 -11.368 4.781 -16.449 1.00 0.00 H new ATOM 0 HZ3 LYS B 413 -11.964 4.338 -14.922 1.00 0.00 H new ATOM 412 N VAL B 414 -10.081 0.124 -14.093 1.00 0.00 N ATOM 413 CA VAL B 414 -9.111 -0.007 -13.019 1.00 0.00 C ATOM 414 C VAL B 414 -8.144 1.178 -13.065 1.00 0.00 C ATOM 415 O VAL B 414 -8.114 1.923 -14.043 1.00 0.00 O ATOM 416 CB VAL B 414 -8.404 -1.360 -13.116 1.00 0.00 C ATOM 417 CG1 VAL B 414 -9.416 -2.506 -13.157 1.00 0.00 C ATOM 418 CG2 VAL B 414 -7.473 -1.407 -14.329 1.00 0.00 C ATOM 0 H VAL B 414 -9.680 0.135 -15.031 1.00 0.00 H new ATOM 0 HA VAL B 414 -9.608 0.016 -12.049 1.00 0.00 H new ATOM 0 HB VAL B 414 -7.794 -1.484 -12.221 1.00 0.00 H new ATOM 0 HG11 VAL B 414 -8.887 -3.456 -13.226 1.00 0.00 H new ATOM 0 HG12 VAL B 414 -10.019 -2.492 -12.249 1.00 0.00 H new ATOM 0 HG13 VAL B 414 -10.064 -2.388 -14.025 1.00 0.00 H new ATOM 0 HG21 VAL B 414 -6.983 -2.380 -14.374 1.00 0.00 H new ATOM 0 HG22 VAL B 414 -8.052 -1.250 -15.239 1.00 0.00 H new ATOM 0 HG23 VAL B 414 -6.719 -0.625 -14.240 1.00 0.00 H new ATOM 428 N GLN B 415 -7.376 1.316 -11.993 1.00 0.00 N ATOM 429 CA GLN B 415 -6.410 2.397 -11.899 1.00 0.00 C ATOM 430 C GLN B 415 -5.065 1.865 -11.402 1.00 0.00 C ATOM 431 O GLN B 415 -5.004 1.166 -10.392 1.00 0.00 O ATOM 432 CB GLN B 415 -6.926 3.515 -10.990 1.00 0.00 C ATOM 433 CG GLN B 415 -5.852 4.582 -10.770 1.00 0.00 C ATOM 434 CD GLN B 415 -6.090 5.794 -11.673 1.00 0.00 C ATOM 435 OE1 GLN B 415 -7.091 6.485 -11.577 1.00 0.00 O ATOM 436 NE2 GLN B 415 -5.118 6.013 -12.554 1.00 0.00 N ATOM 0 H GLN B 415 -7.404 0.697 -11.183 1.00 0.00 H new ATOM 0 HA GLN B 415 -6.267 2.818 -12.894 1.00 0.00 H new ATOM 0 HB2 GLN B 415 -7.811 3.971 -11.434 1.00 0.00 H new ATOM 0 HB3 GLN B 415 -7.231 3.097 -10.030 1.00 0.00 H new ATOM 0 HG2 GLN B 415 -5.854 4.896 -9.726 1.00 0.00 H new ATOM 0 HG3 GLN B 415 -4.868 4.160 -10.974 1.00 0.00 H new ATOM 0 HE21 GLN B 415 -4.306 5.396 -12.582 1.00 0.00 H new ATOM 0 HE22 GLN B 415 -5.184 6.798 -13.202 1.00 0.00 H new ATOM 445 N ALA B 416 -4.019 2.215 -12.137 1.00 0.00 N ATOM 446 CA ALA B 416 -2.678 1.780 -11.784 1.00 0.00 C ATOM 447 C ALA B 416 -2.166 2.621 -10.612 1.00 0.00 C ATOM 448 O ALA B 416 -2.498 3.799 -10.497 1.00 0.00 O ATOM 449 CB ALA B 416 -1.770 1.878 -13.012 1.00 0.00 C ATOM 0 H ALA B 416 -4.073 2.794 -12.975 1.00 0.00 H new ATOM 0 HA ALA B 416 -2.684 0.738 -11.465 1.00 0.00 H new ATOM 0 HB1 ALA B 416 -0.764 1.552 -12.748 1.00 0.00 H new ATOM 0 HB2 ALA B 416 -2.161 1.241 -13.805 1.00 0.00 H new ATOM 0 HB3 ALA B 416 -1.737 2.911 -13.359 1.00 0.00 H new ATOM 455 N GLN B 417 -1.366 1.981 -9.772 1.00 0.00 N ATOM 456 CA GLN B 417 -0.805 2.655 -8.614 1.00 0.00 C ATOM 457 C GLN B 417 0.722 2.695 -8.710 1.00 0.00 C ATOM 458 O GLN B 417 1.389 3.241 -7.833 1.00 0.00 O ATOM 459 CB GLN B 417 -1.254 1.980 -7.316 1.00 0.00 C ATOM 460 CG GLN B 417 -2.640 1.352 -7.476 1.00 0.00 C ATOM 461 CD GLN B 417 -3.208 0.925 -6.121 1.00 0.00 C ATOM 462 OE1 GLN B 417 -3.328 1.709 -5.194 1.00 0.00 O ATOM 463 NE2 GLN B 417 -3.550 -0.359 -6.058 1.00 0.00 N ATOM 0 H GLN B 417 -1.093 1.003 -9.870 1.00 0.00 H new ATOM 0 HA GLN B 417 -1.176 3.680 -8.600 1.00 0.00 H new ATOM 0 HB2 GLN B 417 -0.534 1.213 -7.033 1.00 0.00 H new ATOM 0 HB3 GLN B 417 -1.274 2.712 -6.509 1.00 0.00 H new ATOM 0 HG2 GLN B 417 -3.314 2.066 -7.948 1.00 0.00 H new ATOM 0 HG3 GLN B 417 -2.577 0.487 -8.137 1.00 0.00 H new ATOM 0 HE21 GLN B 417 -3.423 -0.961 -6.872 1.00 0.00 H new ATOM 0 HE22 GLN B 417 -3.939 -0.741 -5.196 1.00 0.00 H new ATOM 472 N HIS B 418 1.230 2.109 -9.785 1.00 0.00 N ATOM 473 CA HIS B 418 2.666 2.072 -10.008 1.00 0.00 C ATOM 474 C HIS B 418 2.953 2.130 -11.509 1.00 0.00 C ATOM 475 O HIS B 418 2.043 1.991 -12.325 1.00 0.00 O ATOM 476 CB HIS B 418 3.289 0.849 -9.332 1.00 0.00 C ATOM 477 CG HIS B 418 3.183 0.860 -7.825 1.00 0.00 C ATOM 478 ND1 HIS B 418 4.168 1.387 -7.008 1.00 0.00 N ATOM 479 CD2 HIS B 418 2.200 0.404 -6.998 1.00 0.00 C ATOM 480 CE1 HIS B 418 3.784 1.249 -5.748 1.00 0.00 C ATOM 481 NE2 HIS B 418 2.564 0.638 -5.743 1.00 0.00 N ATOM 0 H HIS B 418 0.674 1.657 -10.510 1.00 0.00 H new ATOM 0 HA HIS B 418 3.132 2.945 -9.550 1.00 0.00 H new ATOM 0 HB2 HIS B 418 2.805 -0.050 -9.714 1.00 0.00 H new ATOM 0 HB3 HIS B 418 4.341 0.788 -9.612 1.00 0.00 H new ATOM 0 HD2 HIS B 418 1.280 -0.068 -7.311 1.00 0.00 H new ATOM 0 HE1 HIS B 418 4.339 1.565 -4.877 1.00 0.00 H new ATOM 0 HE2 HIS B 418 2.022 0.400 -4.913 1.00 0.00 H new ATOM 489 N ASP B 419 4.223 2.335 -11.829 1.00 0.00 N ATOM 490 CA ASP B 419 4.642 2.413 -13.218 1.00 0.00 C ATOM 491 C ASP B 419 5.422 1.148 -13.582 1.00 0.00 C ATOM 492 O ASP B 419 6.584 1.002 -13.205 1.00 0.00 O ATOM 493 CB ASP B 419 5.556 3.617 -13.451 1.00 0.00 C ATOM 494 CG ASP B 419 6.824 3.640 -12.595 1.00 0.00 C ATOM 495 OD1 ASP B 419 6.693 3.383 -11.379 1.00 0.00 O ATOM 496 OD2 ASP B 419 7.896 3.916 -13.176 1.00 0.00 O ATOM 0 H ASP B 419 4.975 2.449 -11.150 1.00 0.00 H new ATOM 0 HA ASP B 419 3.749 2.515 -13.835 1.00 0.00 H new ATOM 0 HB2 ASP B 419 5.844 3.637 -14.502 1.00 0.00 H new ATOM 0 HB3 ASP B 419 4.989 4.528 -13.258 1.00 0.00 H new ATOM 501 N TYR B 420 4.753 0.267 -14.311 1.00 0.00 N ATOM 502 CA TYR B 420 5.370 -0.980 -14.729 1.00 0.00 C ATOM 503 C TYR B 420 5.544 -1.023 -16.249 1.00 0.00 C ATOM 504 O TYR B 420 4.565 -1.119 -16.987 1.00 0.00 O ATOM 505 CB TYR B 420 4.404 -2.090 -14.308 1.00 0.00 C ATOM 506 CG TYR B 420 4.419 -3.311 -15.229 1.00 0.00 C ATOM 507 CD1 TYR B 420 5.548 -4.102 -15.309 1.00 0.00 C ATOM 508 CD2 TYR B 420 3.305 -3.622 -15.981 1.00 0.00 C ATOM 509 CE1 TYR B 420 5.562 -5.251 -16.176 1.00 0.00 C ATOM 510 CE2 TYR B 420 3.319 -4.772 -16.848 1.00 0.00 C ATOM 511 CZ TYR B 420 4.447 -5.530 -16.903 1.00 0.00 C ATOM 512 OH TYR B 420 4.460 -6.615 -17.722 1.00 0.00 O ATOM 0 H TYR B 420 3.790 0.392 -14.623 1.00 0.00 H new ATOM 0 HA TYR B 420 6.356 -1.090 -14.278 1.00 0.00 H new ATOM 0 HB2 TYR B 420 4.652 -2.409 -13.296 1.00 0.00 H new ATOM 0 HB3 TYR B 420 3.393 -1.684 -14.276 1.00 0.00 H new ATOM 0 HD1 TYR B 420 6.421 -3.859 -14.721 1.00 0.00 H new ATOM 0 HD2 TYR B 420 2.422 -3.003 -15.920 1.00 0.00 H new ATOM 0 HE1 TYR B 420 6.439 -5.878 -16.248 1.00 0.00 H new ATOM 0 HE2 TYR B 420 2.453 -5.027 -17.441 1.00 0.00 H new ATOM 0 HH TYR B 420 3.632 -6.639 -18.246 1.00 0.00 H new ATOM 522 N THR B 421 6.798 -0.949 -16.671 1.00 0.00 N ATOM 523 CA THR B 421 7.114 -0.979 -18.089 1.00 0.00 C ATOM 524 C THR B 421 7.113 -2.420 -18.605 1.00 0.00 C ATOM 525 O THR B 421 7.959 -3.223 -18.214 1.00 0.00 O ATOM 526 CB THR B 421 8.449 -0.261 -18.291 1.00 0.00 C ATOM 527 OG1 THR B 421 8.096 1.118 -18.354 1.00 0.00 O ATOM 528 CG2 THR B 421 9.068 -0.550 -19.660 1.00 0.00 C ATOM 0 H THR B 421 7.607 -0.868 -16.055 1.00 0.00 H new ATOM 0 HA THR B 421 6.357 -0.457 -18.675 1.00 0.00 H new ATOM 0 HB THR B 421 9.145 -0.561 -17.507 1.00 0.00 H new ATOM 0 HG1 THR B 421 8.904 1.657 -18.482 1.00 0.00 H new ATOM 0 HG21 THR B 421 10.014 -0.016 -19.752 1.00 0.00 H new ATOM 0 HG22 THR B 421 9.244 -1.621 -19.761 1.00 0.00 H new ATOM 0 HG23 THR B 421 8.387 -0.219 -20.444 1.00 0.00 H new ATOM 536 N ALA B 422 6.155 -2.702 -19.475 1.00 0.00 N ATOM 537 CA ALA B 422 6.034 -4.032 -20.048 1.00 0.00 C ATOM 538 C ALA B 422 6.343 -3.967 -21.545 1.00 0.00 C ATOM 539 O ALA B 422 5.643 -3.291 -22.299 1.00 0.00 O ATOM 540 CB ALA B 422 4.635 -4.585 -19.765 1.00 0.00 C ATOM 0 H ALA B 422 5.456 -2.033 -19.797 1.00 0.00 H new ATOM 0 HA ALA B 422 6.752 -4.713 -19.592 1.00 0.00 H new ATOM 0 HB1 ALA B 422 4.544 -5.583 -20.195 1.00 0.00 H new ATOM 0 HB2 ALA B 422 4.476 -4.638 -18.688 1.00 0.00 H new ATOM 0 HB3 ALA B 422 3.887 -3.929 -20.210 1.00 0.00 H new ATOM 546 N THR B 423 7.392 -4.678 -21.932 1.00 0.00 N ATOM 547 CA THR B 423 7.802 -4.709 -23.326 1.00 0.00 C ATOM 548 C THR B 423 7.709 -6.133 -23.878 1.00 0.00 C ATOM 549 O THR B 423 8.650 -6.914 -23.752 1.00 0.00 O ATOM 550 CB THR B 423 9.208 -4.113 -23.417 1.00 0.00 C ATOM 551 OG1 THR B 423 9.938 -4.787 -22.396 1.00 0.00 O ATOM 552 CG2 THR B 423 9.250 -2.642 -22.997 1.00 0.00 C ATOM 0 H THR B 423 7.970 -5.237 -21.305 1.00 0.00 H new ATOM 0 HA THR B 423 7.137 -4.109 -23.948 1.00 0.00 H new ATOM 0 HB THR B 423 9.577 -4.209 -24.438 1.00 0.00 H new ATOM 0 HG1 THR B 423 9.806 -5.754 -22.484 1.00 0.00 H new ATOM 0 HG21 THR B 423 10.271 -2.269 -23.080 1.00 0.00 H new ATOM 0 HG22 THR B 423 8.596 -2.059 -23.646 1.00 0.00 H new ATOM 0 HG23 THR B 423 8.913 -2.549 -21.965 1.00 0.00 H new ATOM 560 N ASP B 424 6.564 -6.427 -24.477 1.00 0.00 N ATOM 561 CA ASP B 424 6.335 -7.743 -25.048 1.00 0.00 C ATOM 562 C ASP B 424 5.548 -7.599 -26.352 1.00 0.00 C ATOM 563 O ASP B 424 5.293 -6.485 -26.807 1.00 0.00 O ATOM 564 CB ASP B 424 5.519 -8.621 -24.098 1.00 0.00 C ATOM 565 CG ASP B 424 5.829 -10.118 -24.173 1.00 0.00 C ATOM 566 OD1 ASP B 424 5.563 -10.699 -25.247 1.00 0.00 O ATOM 567 OD2 ASP B 424 6.325 -10.646 -23.154 1.00 0.00 O ATOM 0 H ASP B 424 5.785 -5.776 -24.579 1.00 0.00 H new ATOM 0 HA ASP B 424 7.305 -8.207 -25.224 1.00 0.00 H new ATOM 0 HB2 ASP B 424 5.689 -8.281 -23.077 1.00 0.00 H new ATOM 0 HB3 ASP B 424 4.460 -8.474 -24.311 1.00 0.00 H new ATOM 572 N THR B 425 5.185 -8.741 -26.916 1.00 0.00 N ATOM 573 CA THR B 425 4.432 -8.756 -28.159 1.00 0.00 C ATOM 574 C THR B 425 2.930 -8.693 -27.873 1.00 0.00 C ATOM 575 O THR B 425 2.118 -8.679 -28.797 1.00 0.00 O ATOM 576 CB THR B 425 4.848 -9.998 -28.949 1.00 0.00 C ATOM 577 OG1 THR B 425 4.261 -9.805 -30.233 1.00 0.00 O ATOM 578 CG2 THR B 425 4.186 -11.274 -28.425 1.00 0.00 C ATOM 0 H THR B 425 5.398 -9.663 -26.535 1.00 0.00 H new ATOM 0 HA THR B 425 4.653 -7.878 -28.766 1.00 0.00 H new ATOM 0 HB THR B 425 5.932 -10.108 -28.908 1.00 0.00 H new ATOM 0 HG1 THR B 425 3.406 -9.336 -30.135 1.00 0.00 H new ATOM 0 HG21 THR B 425 4.515 -12.126 -29.020 1.00 0.00 H new ATOM 0 HG22 THR B 425 4.468 -11.429 -27.384 1.00 0.00 H new ATOM 0 HG23 THR B 425 3.103 -11.178 -28.497 1.00 0.00 H new ATOM 586 N ASP B 426 2.606 -8.655 -26.589 1.00 0.00 N ATOM 587 CA ASP B 426 1.216 -8.595 -26.169 1.00 0.00 C ATOM 588 C ASP B 426 1.150 -8.200 -24.692 1.00 0.00 C ATOM 589 O ASP B 426 0.290 -8.681 -23.955 1.00 0.00 O ATOM 590 CB ASP B 426 0.534 -9.956 -26.326 1.00 0.00 C ATOM 591 CG ASP B 426 0.115 -10.309 -27.754 1.00 0.00 C ATOM 592 OD1 ASP B 426 -0.239 -9.363 -28.492 1.00 0.00 O ATOM 593 OD2 ASP B 426 0.159 -11.515 -28.077 1.00 0.00 O ATOM 0 H ASP B 426 3.282 -8.665 -25.825 1.00 0.00 H new ATOM 0 HA ASP B 426 0.706 -7.862 -26.794 1.00 0.00 H new ATOM 0 HB2 ASP B 426 1.210 -10.729 -25.961 1.00 0.00 H new ATOM 0 HB3 ASP B 426 -0.350 -9.978 -25.688 1.00 0.00 H new ATOM 598 N GLU B 427 2.069 -7.329 -24.304 1.00 0.00 N ATOM 599 CA GLU B 427 2.126 -6.864 -22.929 1.00 0.00 C ATOM 600 C GLU B 427 1.312 -5.578 -22.769 1.00 0.00 C ATOM 601 O GLU B 427 0.972 -4.928 -23.756 1.00 0.00 O ATOM 602 CB GLU B 427 3.573 -6.656 -22.479 1.00 0.00 C ATOM 603 CG GLU B 427 3.970 -7.682 -21.416 1.00 0.00 C ATOM 604 CD GLU B 427 2.935 -7.734 -20.291 1.00 0.00 C ATOM 605 OE1 GLU B 427 2.671 -6.657 -19.713 1.00 0.00 O ATOM 606 OE2 GLU B 427 2.432 -8.848 -20.034 1.00 0.00 O ATOM 0 H GLU B 427 2.781 -6.933 -24.918 1.00 0.00 H new ATOM 0 HA GLU B 427 1.688 -7.630 -22.289 1.00 0.00 H new ATOM 0 HB2 GLU B 427 4.240 -6.740 -23.337 1.00 0.00 H new ATOM 0 HB3 GLU B 427 3.692 -5.649 -22.080 1.00 0.00 H new ATOM 0 HG2 GLU B 427 4.065 -8.667 -21.873 1.00 0.00 H new ATOM 0 HG3 GLU B 427 4.947 -7.426 -21.005 1.00 0.00 H new ATOM 613 N LEU B 428 1.024 -5.249 -21.518 1.00 0.00 N ATOM 614 CA LEU B 428 0.257 -4.052 -21.217 1.00 0.00 C ATOM 615 C LEU B 428 1.077 -3.143 -20.299 1.00 0.00 C ATOM 616 O LEU B 428 1.351 -3.496 -19.153 1.00 0.00 O ATOM 617 CB LEU B 428 -1.114 -4.424 -20.648 1.00 0.00 C ATOM 618 CG LEU B 428 -2.261 -3.470 -20.985 1.00 0.00 C ATOM 619 CD1 LEU B 428 -2.890 -3.822 -22.335 1.00 0.00 C ATOM 620 CD2 LEU B 428 -3.298 -3.440 -19.860 1.00 0.00 C ATOM 0 H LEU B 428 1.308 -5.790 -20.701 1.00 0.00 H new ATOM 0 HA LEU B 428 0.057 -3.489 -22.128 1.00 0.00 H new ATOM 0 HB2 LEU B 428 -1.377 -5.418 -21.008 1.00 0.00 H new ATOM 0 HB3 LEU B 428 -1.029 -4.490 -19.563 1.00 0.00 H new ATOM 0 HG LEU B 428 -1.852 -2.463 -21.073 1.00 0.00 H new ATOM 0 HD11 LEU B 428 -3.703 -3.128 -22.550 1.00 0.00 H new ATOM 0 HD12 LEU B 428 -2.135 -3.750 -23.118 1.00 0.00 H new ATOM 0 HD13 LEU B 428 -3.281 -4.839 -22.300 1.00 0.00 H new ATOM 0 HD21 LEU B 428 -4.103 -2.754 -20.125 1.00 0.00 H new ATOM 0 HD22 LEU B 428 -3.707 -4.440 -19.715 1.00 0.00 H new ATOM 0 HD23 LEU B 428 -2.824 -3.104 -18.937 1.00 0.00 H new ATOM 632 N GLN B 429 1.447 -1.991 -20.838 1.00 0.00 N ATOM 633 CA GLN B 429 2.229 -1.028 -20.082 1.00 0.00 C ATOM 634 C GLN B 429 1.312 -0.164 -19.214 1.00 0.00 C ATOM 635 O GLN B 429 0.260 0.283 -19.670 1.00 0.00 O ATOM 636 CB GLN B 429 3.080 -0.161 -21.012 1.00 0.00 C ATOM 637 CG GLN B 429 4.206 0.530 -20.240 1.00 0.00 C ATOM 638 CD GLN B 429 5.374 0.874 -21.166 1.00 0.00 C ATOM 639 OE1 GLN B 429 5.752 2.023 -21.330 1.00 0.00 O ATOM 640 NE2 GLN B 429 5.923 -0.182 -21.759 1.00 0.00 N ATOM 0 H GLN B 429 1.220 -1.703 -21.790 1.00 0.00 H new ATOM 0 HA GLN B 429 2.908 -1.575 -19.427 1.00 0.00 H new ATOM 0 HB2 GLN B 429 3.503 -0.778 -21.804 1.00 0.00 H new ATOM 0 HB3 GLN B 429 2.451 0.588 -21.493 1.00 0.00 H new ATOM 0 HG2 GLN B 429 3.827 1.439 -19.773 1.00 0.00 H new ATOM 0 HG3 GLN B 429 4.553 -0.120 -19.437 1.00 0.00 H new ATOM 0 HE21 GLN B 429 5.557 -1.117 -21.577 1.00 0.00 H new ATOM 0 HE22 GLN B 429 6.710 -0.057 -22.396 1.00 0.00 H new ATOM 649 N LEU B 430 1.744 0.046 -17.979 1.00 0.00 N ATOM 650 CA LEU B 430 0.975 0.849 -17.043 1.00 0.00 C ATOM 651 C LEU B 430 1.888 1.900 -16.410 1.00 0.00 C ATOM 652 O LEU B 430 3.092 1.685 -16.281 1.00 0.00 O ATOM 653 CB LEU B 430 0.268 -0.047 -16.024 1.00 0.00 C ATOM 654 CG LEU B 430 -1.128 -0.536 -16.416 1.00 0.00 C ATOM 655 CD1 LEU B 430 -1.110 -2.027 -16.757 1.00 0.00 C ATOM 656 CD2 LEU B 430 -2.149 -0.211 -15.324 1.00 0.00 C ATOM 0 H LEU B 430 2.617 -0.326 -17.605 1.00 0.00 H new ATOM 0 HA LEU B 430 0.183 1.387 -17.563 1.00 0.00 H new ATOM 0 HB2 LEU B 430 0.897 -0.917 -15.837 1.00 0.00 H new ATOM 0 HB3 LEU B 430 0.190 0.498 -15.083 1.00 0.00 H new ATOM 0 HG LEU B 430 -1.437 -0.003 -17.315 1.00 0.00 H new ATOM 0 HD11 LEU B 430 -2.114 -2.349 -17.032 1.00 0.00 H new ATOM 0 HD12 LEU B 430 -0.431 -2.201 -17.592 1.00 0.00 H new ATOM 0 HD13 LEU B 430 -0.772 -2.594 -15.890 1.00 0.00 H new ATOM 0 HD21 LEU B 430 -3.133 -0.569 -15.627 1.00 0.00 H new ATOM 0 HD22 LEU B 430 -1.856 -0.699 -14.395 1.00 0.00 H new ATOM 0 HD23 LEU B 430 -2.187 0.867 -15.171 1.00 0.00 H new ATOM 668 N LYS B 431 1.280 3.014 -16.030 1.00 0.00 N ATOM 669 CA LYS B 431 2.023 4.099 -15.412 1.00 0.00 C ATOM 670 C LYS B 431 1.319 4.524 -14.122 1.00 0.00 C ATOM 671 O LYS B 431 0.108 4.740 -14.114 1.00 0.00 O ATOM 672 CB LYS B 431 2.228 5.243 -16.406 1.00 0.00 C ATOM 673 CG LYS B 431 0.889 5.859 -16.817 1.00 0.00 C ATOM 674 CD LYS B 431 0.291 5.122 -18.017 1.00 0.00 C ATOM 675 CE LYS B 431 1.068 5.438 -19.297 1.00 0.00 C ATOM 676 NZ LYS B 431 0.710 6.783 -19.801 1.00 0.00 N ATOM 0 H LYS B 431 0.281 3.189 -16.138 1.00 0.00 H new ATOM 0 HA LYS B 431 3.023 3.766 -15.135 1.00 0.00 H new ATOM 0 HB2 LYS B 431 2.863 6.008 -15.959 1.00 0.00 H new ATOM 0 HB3 LYS B 431 2.749 4.873 -17.289 1.00 0.00 H new ATOM 0 HG2 LYS B 431 0.194 5.819 -15.978 1.00 0.00 H new ATOM 0 HG3 LYS B 431 1.030 6.911 -17.065 1.00 0.00 H new ATOM 0 HD2 LYS B 431 0.307 4.048 -17.833 1.00 0.00 H new ATOM 0 HD3 LYS B 431 -0.753 5.409 -18.141 1.00 0.00 H new ATOM 0 HE2 LYS B 431 2.139 5.390 -19.101 1.00 0.00 H new ATOM 0 HE3 LYS B 431 0.849 4.688 -20.057 1.00 0.00 H new ATOM 0 HZ1 LYS B 431 1.139 6.929 -20.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 431 -0.324 6.861 -19.878 1.00 0.00 H new ATOM 0 HZ3 LYS B 431 1.063 7.506 -19.142 1.00 0.00 H new ATOM 690 N ALA B 432 2.107 4.630 -13.062 1.00 0.00 N ATOM 691 CA ALA B 432 1.574 5.026 -11.770 1.00 0.00 C ATOM 692 C ALA B 432 0.490 6.086 -11.973 1.00 0.00 C ATOM 693 O ALA B 432 0.795 7.260 -12.176 1.00 0.00 O ATOM 694 CB ALA B 432 2.714 5.521 -10.877 1.00 0.00 C ATOM 0 H ALA B 432 3.111 4.448 -13.072 1.00 0.00 H new ATOM 0 HA ALA B 432 1.113 4.175 -11.268 1.00 0.00 H new ATOM 0 HB1 ALA B 432 2.314 5.818 -9.908 1.00 0.00 H new ATOM 0 HB2 ALA B 432 3.442 4.721 -10.740 1.00 0.00 H new ATOM 0 HB3 ALA B 432 3.199 6.376 -11.347 1.00 0.00 H new ATOM 700 N GLY B 433 -0.754 5.634 -11.911 1.00 0.00 N ATOM 701 CA GLY B 433 -1.885 6.529 -12.084 1.00 0.00 C ATOM 702 C GLY B 433 -2.441 6.441 -13.507 1.00 0.00 C ATOM 703 O GLY B 433 -2.725 7.463 -14.130 1.00 0.00 O ATOM 0 H GLY B 433 -1.003 4.659 -11.743 1.00 0.00 H new ATOM 0 HA2 GLY B 433 -2.667 6.276 -11.368 1.00 0.00 H new ATOM 0 HA3 GLY B 433 -1.579 7.553 -11.872 1.00 0.00 H new ATOM 707 N ASP B 434 -2.578 5.211 -13.979 1.00 0.00 N ATOM 708 CA ASP B 434 -3.093 4.977 -15.318 1.00 0.00 C ATOM 709 C ASP B 434 -4.494 4.370 -15.221 1.00 0.00 C ATOM 710 O ASP B 434 -4.934 3.984 -14.140 1.00 0.00 O ATOM 711 CB ASP B 434 -2.205 3.996 -16.086 1.00 0.00 C ATOM 712 CG ASP B 434 -2.680 3.666 -17.502 1.00 0.00 C ATOM 713 OD1 ASP B 434 -2.915 4.631 -18.262 1.00 0.00 O ATOM 714 OD2 ASP B 434 -2.799 2.456 -17.793 1.00 0.00 O ATOM 0 H ASP B 434 -2.342 4.366 -13.459 1.00 0.00 H new ATOM 0 HA ASP B 434 -3.114 5.932 -15.843 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -1.198 4.410 -16.144 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -2.137 3.069 -15.517 1.00 0.00 H new ATOM 719 N VAL B 435 -5.156 4.303 -16.367 1.00 0.00 N ATOM 720 CA VAL B 435 -6.498 3.750 -16.426 1.00 0.00 C ATOM 721 C VAL B 435 -6.495 2.511 -17.325 1.00 0.00 C ATOM 722 O VAL B 435 -6.043 2.570 -18.467 1.00 0.00 O ATOM 723 CB VAL B 435 -7.487 4.822 -16.888 1.00 0.00 C ATOM 724 CG1 VAL B 435 -7.914 5.713 -15.720 1.00 0.00 C ATOM 725 CG2 VAL B 435 -6.898 5.656 -18.028 1.00 0.00 C ATOM 0 H VAL B 435 -4.787 4.623 -17.263 1.00 0.00 H new ATOM 0 HA VAL B 435 -6.824 3.433 -15.436 1.00 0.00 H new ATOM 0 HB VAL B 435 -8.376 4.318 -17.267 1.00 0.00 H new ATOM 0 HG11 VAL B 435 -8.617 6.467 -16.075 1.00 0.00 H new ATOM 0 HG12 VAL B 435 -8.392 5.103 -14.953 1.00 0.00 H new ATOM 0 HG13 VAL B 435 -7.037 6.205 -15.298 1.00 0.00 H new ATOM 0 HG21 VAL B 435 -7.621 6.411 -18.338 1.00 0.00 H new ATOM 0 HG22 VAL B 435 -5.986 6.146 -17.687 1.00 0.00 H new ATOM 0 HG23 VAL B 435 -6.667 5.006 -18.872 1.00 0.00 H new ATOM 735 N VAL B 436 -7.005 1.419 -16.775 1.00 0.00 N ATOM 736 CA VAL B 436 -7.069 0.169 -17.513 1.00 0.00 C ATOM 737 C VAL B 436 -8.441 -0.474 -17.302 1.00 0.00 C ATOM 738 O VAL B 436 -9.003 -0.401 -16.210 1.00 0.00 O ATOM 739 CB VAL B 436 -5.911 -0.742 -17.099 1.00 0.00 C ATOM 740 CG1 VAL B 436 -6.144 -2.176 -17.579 1.00 0.00 C ATOM 741 CG2 VAL B 436 -4.576 -0.201 -17.615 1.00 0.00 C ATOM 0 H VAL B 436 -7.378 1.374 -15.827 1.00 0.00 H new ATOM 0 HA VAL B 436 -6.957 0.350 -18.582 1.00 0.00 H new ATOM 0 HB VAL B 436 -5.868 -0.756 -16.010 1.00 0.00 H new ATOM 0 HG11 VAL B 436 -5.307 -2.803 -17.272 1.00 0.00 H new ATOM 0 HG12 VAL B 436 -7.065 -2.561 -17.142 1.00 0.00 H new ATOM 0 HG13 VAL B 436 -6.226 -2.187 -18.666 1.00 0.00 H new ATOM 0 HG21 VAL B 436 -3.770 -0.867 -17.307 1.00 0.00 H new ATOM 0 HG22 VAL B 436 -4.603 -0.143 -18.703 1.00 0.00 H new ATOM 0 HG23 VAL B 436 -4.403 0.793 -17.203 1.00 0.00 H new ATOM 751 N LEU B 437 -8.940 -1.090 -18.363 1.00 0.00 N ATOM 752 CA LEU B 437 -10.236 -1.745 -18.308 1.00 0.00 C ATOM 753 C LEU B 437 -10.034 -3.257 -18.192 1.00 0.00 C ATOM 754 O LEU B 437 -9.234 -3.838 -18.924 1.00 0.00 O ATOM 755 CB LEU B 437 -11.097 -1.329 -19.502 1.00 0.00 C ATOM 756 CG LEU B 437 -10.495 -0.270 -20.428 1.00 0.00 C ATOM 757 CD1 LEU B 437 -11.297 -0.157 -21.726 1.00 0.00 C ATOM 758 CD2 LEU B 437 -10.370 1.076 -19.712 1.00 0.00 C ATOM 0 H LEU B 437 -8.470 -1.150 -19.266 1.00 0.00 H new ATOM 0 HA LEU B 437 -10.786 -1.428 -17.422 1.00 0.00 H new ATOM 0 HB2 LEU B 437 -11.316 -2.218 -20.094 1.00 0.00 H new ATOM 0 HB3 LEU B 437 -12.049 -0.955 -19.125 1.00 0.00 H new ATOM 0 HG LEU B 437 -9.487 -0.585 -20.699 1.00 0.00 H new ATOM 0 HD11 LEU B 437 -10.848 0.602 -22.366 1.00 0.00 H new ATOM 0 HD12 LEU B 437 -11.291 -1.117 -22.242 1.00 0.00 H new ATOM 0 HD13 LEU B 437 -12.325 0.124 -21.495 1.00 0.00 H new ATOM 0 HD21 LEU B 437 -9.940 1.811 -20.392 1.00 0.00 H new ATOM 0 HD22 LEU B 437 -11.357 1.411 -19.393 1.00 0.00 H new ATOM 0 HD23 LEU B 437 -9.724 0.966 -18.841 1.00 0.00 H new ATOM 770 N VAL B 438 -10.773 -3.851 -17.266 1.00 0.00 N ATOM 771 CA VAL B 438 -10.685 -5.284 -17.045 1.00 0.00 C ATOM 772 C VAL B 438 -11.653 -6.002 -17.988 1.00 0.00 C ATOM 773 O VAL B 438 -12.868 -5.914 -17.820 1.00 0.00 O ATOM 774 CB VAL B 438 -10.940 -5.603 -15.570 1.00 0.00 C ATOM 775 CG1 VAL B 438 -11.351 -7.065 -15.389 1.00 0.00 C ATOM 776 CG2 VAL B 438 -9.716 -5.267 -14.717 1.00 0.00 C ATOM 0 H VAL B 438 -11.435 -3.366 -16.661 1.00 0.00 H new ATOM 0 HA VAL B 438 -9.682 -5.644 -17.273 1.00 0.00 H new ATOM 0 HB VAL B 438 -11.766 -4.979 -15.230 1.00 0.00 H new ATOM 0 HG11 VAL B 438 -11.526 -7.266 -14.332 1.00 0.00 H new ATOM 0 HG12 VAL B 438 -12.264 -7.258 -15.951 1.00 0.00 H new ATOM 0 HG13 VAL B 438 -10.556 -7.714 -15.754 1.00 0.00 H new ATOM 0 HG21 VAL B 438 -9.924 -5.503 -13.673 1.00 0.00 H new ATOM 0 HG22 VAL B 438 -8.863 -5.853 -15.059 1.00 0.00 H new ATOM 0 HG23 VAL B 438 -9.488 -4.205 -14.810 1.00 0.00 H new ATOM 786 N ILE B 439 -11.078 -6.695 -18.959 1.00 0.00 N ATOM 787 CA ILE B 439 -11.875 -7.427 -19.929 1.00 0.00 C ATOM 788 C ILE B 439 -11.612 -8.926 -19.771 1.00 0.00 C ATOM 789 O ILE B 439 -10.541 -9.328 -19.318 1.00 0.00 O ATOM 790 CB ILE B 439 -11.614 -6.903 -21.343 1.00 0.00 C ATOM 791 CG1 ILE B 439 -10.184 -7.216 -21.789 1.00 0.00 C ATOM 792 CG2 ILE B 439 -11.930 -5.409 -21.440 1.00 0.00 C ATOM 793 CD1 ILE B 439 -9.248 -6.043 -21.494 1.00 0.00 C ATOM 0 H ILE B 439 -10.070 -6.765 -19.095 1.00 0.00 H new ATOM 0 HA ILE B 439 -12.938 -7.268 -19.746 1.00 0.00 H new ATOM 0 HB ILE B 439 -12.285 -7.420 -22.028 1.00 0.00 H new ATOM 0 HG12 ILE B 439 -9.827 -8.109 -21.276 1.00 0.00 H new ATOM 0 HG13 ILE B 439 -10.172 -7.436 -22.857 1.00 0.00 H new ATOM 0 HG21 ILE B 439 -11.736 -5.061 -22.455 1.00 0.00 H new ATOM 0 HG22 ILE B 439 -12.979 -5.242 -21.193 1.00 0.00 H new ATOM 0 HG23 ILE B 439 -11.301 -4.858 -20.741 1.00 0.00 H new ATOM 0 HD11 ILE B 439 -8.238 -6.292 -21.821 1.00 0.00 H new ATOM 0 HD12 ILE B 439 -9.594 -5.158 -22.028 1.00 0.00 H new ATOM 0 HD13 ILE B 439 -9.243 -5.842 -20.423 1.00 0.00 H new ATOM 805 N PRO B 440 -12.633 -9.733 -20.164 1.00 0.00 N ATOM 806 CA PRO B 440 -12.523 -11.179 -20.070 1.00 0.00 C ATOM 807 C PRO B 440 -11.617 -11.732 -21.172 1.00 0.00 C ATOM 808 O PRO B 440 -11.933 -11.619 -22.355 1.00 0.00 O ATOM 809 CB PRO B 440 -13.952 -11.690 -20.164 1.00 0.00 C ATOM 810 CG PRO B 440 -14.761 -10.555 -20.770 1.00 0.00 C ATOM 811 CD PRO B 440 -13.916 -9.293 -20.705 1.00 0.00 C ATOM 0 HA PRO B 440 -12.058 -11.506 -19.140 1.00 0.00 H new ATOM 0 HB2 PRO B 440 -14.007 -12.584 -20.785 1.00 0.00 H new ATOM 0 HB3 PRO B 440 -14.335 -11.961 -19.180 1.00 0.00 H new ATOM 0 HG2 PRO B 440 -15.026 -10.784 -21.802 1.00 0.00 H new ATOM 0 HG3 PRO B 440 -15.694 -10.418 -20.224 1.00 0.00 H new ATOM 0 HD2 PRO B 440 -13.797 -8.845 -21.692 1.00 0.00 H new ATOM 0 HD3 PRO B 440 -14.378 -8.540 -20.066 1.00 0.00 H new ATOM 819 N PHE B 441 -10.509 -12.318 -20.744 1.00 0.00 N ATOM 820 CA PHE B 441 -9.554 -12.889 -21.679 1.00 0.00 C ATOM 821 C PHE B 441 -10.220 -13.941 -22.568 1.00 0.00 C ATOM 822 O PHE B 441 -11.432 -14.140 -22.500 1.00 0.00 O ATOM 823 CB PHE B 441 -8.459 -13.559 -20.848 1.00 0.00 C ATOM 824 CG PHE B 441 -8.967 -14.212 -19.560 1.00 0.00 C ATOM 825 CD1 PHE B 441 -10.214 -14.753 -19.518 1.00 0.00 C ATOM 826 CD2 PHE B 441 -8.171 -14.251 -18.458 1.00 0.00 C ATOM 827 CE1 PHE B 441 -10.685 -15.358 -18.323 1.00 0.00 C ATOM 828 CE2 PHE B 441 -8.642 -14.856 -17.263 1.00 0.00 C ATOM 829 CZ PHE B 441 -9.889 -15.397 -17.221 1.00 0.00 C ATOM 0 H PHE B 441 -10.251 -12.410 -19.762 1.00 0.00 H new ATOM 0 HA PHE B 441 -9.153 -12.108 -22.325 1.00 0.00 H new ATOM 0 HB2 PHE B 441 -7.967 -14.317 -21.458 1.00 0.00 H new ATOM 0 HB3 PHE B 441 -7.704 -12.815 -20.593 1.00 0.00 H new ATOM 0 HD1 PHE B 441 -10.846 -14.722 -20.393 1.00 0.00 H new ATOM 0 HD2 PHE B 441 -7.181 -13.822 -18.492 1.00 0.00 H new ATOM 0 HE1 PHE B 441 -11.675 -15.787 -18.289 1.00 0.00 H new ATOM 0 HE2 PHE B 441 -8.010 -14.887 -16.388 1.00 0.00 H new ATOM 0 HZ PHE B 441 -10.247 -15.858 -16.312 1.00 0.00 H new ATOM 931 N ASP B 448 -2.370 -15.182 -16.330 1.00 0.00 N ATOM 932 CA ASP B 448 -1.161 -15.356 -15.543 1.00 0.00 C ATOM 933 C ASP B 448 -1.478 -15.109 -14.067 1.00 0.00 C ATOM 934 O ASP B 448 -2.356 -14.311 -13.742 1.00 0.00 O ATOM 935 CB ASP B 448 -0.079 -14.361 -15.968 1.00 0.00 C ATOM 936 CG ASP B 448 1.053 -14.167 -14.957 1.00 0.00 C ATOM 937 OD1 ASP B 448 1.407 -15.171 -14.302 1.00 0.00 O ATOM 938 OD2 ASP B 448 1.538 -13.019 -14.863 1.00 0.00 O ATOM 0 HA ASP B 448 -0.799 -16.372 -15.702 1.00 0.00 H new ATOM 0 HB2 ASP B 448 0.351 -14.696 -16.912 1.00 0.00 H new ATOM 0 HB3 ASP B 448 -0.548 -13.395 -16.156 1.00 0.00 H new ATOM 943 N GLU B 449 -0.745 -15.807 -13.212 1.00 0.00 N ATOM 944 CA GLU B 449 -0.937 -15.673 -11.778 1.00 0.00 C ATOM 945 C GLU B 449 -0.457 -14.300 -11.304 1.00 0.00 C ATOM 946 O GLU B 449 0.740 -14.017 -11.323 1.00 0.00 O ATOM 947 CB GLU B 449 -0.223 -16.795 -11.022 1.00 0.00 C ATOM 948 CG GLU B 449 -1.202 -17.903 -10.630 1.00 0.00 C ATOM 949 CD GLU B 449 -1.146 -19.063 -11.626 1.00 0.00 C ATOM 950 OE1 GLU B 449 -1.071 -18.767 -12.838 1.00 0.00 O ATOM 951 OE2 GLU B 449 -1.178 -20.219 -11.152 1.00 0.00 O ATOM 0 H GLU B 449 -0.017 -16.467 -13.485 1.00 0.00 H new ATOM 0 HA GLU B 449 -2.003 -15.757 -11.564 1.00 0.00 H new ATOM 0 HB2 GLU B 449 0.570 -17.209 -11.644 1.00 0.00 H new ATOM 0 HB3 GLU B 449 0.251 -16.391 -10.128 1.00 0.00 H new ATOM 0 HG2 GLU B 449 -0.964 -18.266 -9.630 1.00 0.00 H new ATOM 0 HG3 GLU B 449 -2.215 -17.501 -10.591 1.00 0.00 H new ATOM 958 N GLY B 450 -1.415 -13.484 -10.890 1.00 0.00 N ATOM 959 CA GLY B 450 -1.104 -12.147 -10.412 1.00 0.00 C ATOM 960 C GLY B 450 -1.277 -11.112 -11.526 1.00 0.00 C ATOM 961 O GLY B 450 -1.055 -9.922 -11.312 1.00 0.00 O ATOM 0 H GLY B 450 -2.407 -13.722 -10.876 1.00 0.00 H new ATOM 0 HA2 GLY B 450 -1.754 -11.896 -9.574 1.00 0.00 H new ATOM 0 HA3 GLY B 450 -0.080 -12.119 -10.041 1.00 0.00 H new ATOM 965 N TRP B 451 -1.673 -11.604 -12.691 1.00 0.00 N ATOM 966 CA TRP B 451 -1.878 -10.737 -13.839 1.00 0.00 C ATOM 967 C TRP B 451 -3.150 -11.194 -14.555 1.00 0.00 C ATOM 968 O TRP B 451 -3.469 -12.382 -14.564 1.00 0.00 O ATOM 969 CB TRP B 451 -0.649 -10.732 -14.749 1.00 0.00 C ATOM 970 CG TRP B 451 0.682 -10.644 -13.998 1.00 0.00 C ATOM 971 CD1 TRP B 451 1.108 -11.408 -12.982 1.00 0.00 C ATOM 972 CD2 TRP B 451 1.749 -9.705 -14.247 1.00 0.00 C ATOM 973 NE1 TRP B 451 2.366 -11.031 -12.560 1.00 0.00 N ATOM 974 CE2 TRP B 451 2.769 -9.963 -13.353 1.00 0.00 C ATOM 975 CE3 TRP B 451 1.850 -8.673 -15.196 1.00 0.00 C ATOM 976 CZ2 TRP B 451 3.962 -9.231 -13.320 1.00 0.00 C ATOM 977 CZ3 TRP B 451 3.048 -7.951 -15.149 1.00 0.00 C ATOM 978 CH2 TRP B 451 4.084 -8.197 -14.256 1.00 0.00 C ATOM 0 H TRP B 451 -1.857 -12.592 -12.865 1.00 0.00 H new ATOM 0 HA TRP B 451 -2.009 -9.702 -13.522 1.00 0.00 H new ATOM 0 HB2 TRP B 451 -0.654 -11.639 -15.354 1.00 0.00 H new ATOM 0 HB3 TRP B 451 -0.723 -9.890 -15.437 1.00 0.00 H new ATOM 0 HD1 TRP B 451 0.538 -12.217 -12.549 1.00 0.00 H new ATOM 0 HE1 TRP B 451 2.902 -11.458 -11.804 1.00 0.00 H new ATOM 0 HE3 TRP B 451 1.065 -8.455 -15.905 1.00 0.00 H new ATOM 0 HZ2 TRP B 451 4.746 -9.452 -12.611 1.00 0.00 H new ATOM 0 HZ3 TRP B 451 3.176 -7.146 -15.857 1.00 0.00 H new ATOM 0 HH2 TRP B 451 4.979 -7.593 -14.284 1.00 0.00 H new ATOM 989 N LEU B 452 -3.843 -10.227 -15.138 1.00 0.00 N ATOM 990 CA LEU B 452 -5.073 -10.515 -15.856 1.00 0.00 C ATOM 991 C LEU B 452 -5.068 -9.765 -17.189 1.00 0.00 C ATOM 992 O LEU B 452 -4.188 -8.942 -17.439 1.00 0.00 O ATOM 993 CB LEU B 452 -6.289 -10.207 -14.981 1.00 0.00 C ATOM 994 CG LEU B 452 -6.017 -9.382 -13.721 1.00 0.00 C ATOM 995 CD1 LEU B 452 -7.203 -8.473 -13.394 1.00 0.00 C ATOM 996 CD2 LEU B 452 -5.646 -10.286 -12.543 1.00 0.00 C ATOM 0 H LEU B 452 -3.576 -9.243 -15.128 1.00 0.00 H new ATOM 0 HA LEU B 452 -5.138 -11.578 -16.089 1.00 0.00 H new ATOM 0 HB2 LEU B 452 -7.023 -9.676 -15.587 1.00 0.00 H new ATOM 0 HB3 LEU B 452 -6.745 -11.151 -14.682 1.00 0.00 H new ATOM 0 HG LEU B 452 -5.160 -8.736 -13.914 1.00 0.00 H new ATOM 0 HD11 LEU B 452 -6.984 -7.898 -12.494 1.00 0.00 H new ATOM 0 HD12 LEU B 452 -7.379 -7.792 -14.226 1.00 0.00 H new ATOM 0 HD13 LEU B 452 -8.092 -9.081 -13.228 1.00 0.00 H new ATOM 0 HD21 LEU B 452 -5.458 -9.675 -11.660 1.00 0.00 H new ATOM 0 HD22 LEU B 452 -6.467 -10.974 -12.340 1.00 0.00 H new ATOM 0 HD23 LEU B 452 -4.749 -10.854 -12.789 1.00 0.00 H new ATOM 1008 N MET B 453 -6.061 -10.075 -18.010 1.00 0.00 N ATOM 1009 CA MET B 453 -6.183 -9.439 -19.311 1.00 0.00 C ATOM 1010 C MET B 453 -6.975 -8.134 -19.211 1.00 0.00 C ATOM 1011 O MET B 453 -8.168 -8.149 -18.914 1.00 0.00 O ATOM 1012 CB MET B 453 -6.887 -10.391 -20.280 1.00 0.00 C ATOM 1013 CG MET B 453 -7.287 -9.666 -21.566 1.00 0.00 C ATOM 1014 SD MET B 453 -6.612 -10.517 -22.983 1.00 0.00 S ATOM 1015 CE MET B 453 -4.869 -10.372 -22.629 1.00 0.00 C ATOM 0 H MET B 453 -6.788 -10.758 -17.799 1.00 0.00 H new ATOM 0 HA MET B 453 -5.183 -9.208 -19.677 1.00 0.00 H new ATOM 0 HB2 MET B 453 -6.228 -11.226 -20.519 1.00 0.00 H new ATOM 0 HB3 MET B 453 -7.773 -10.811 -19.804 1.00 0.00 H new ATOM 0 HG2 MET B 453 -8.373 -9.619 -21.644 1.00 0.00 H new ATOM 0 HG3 MET B 453 -6.924 -8.639 -21.542 1.00 0.00 H new ATOM 0 HE1 MET B 453 -4.376 -11.322 -22.835 1.00 0.00 H new ATOM 0 HE2 MET B 453 -4.434 -9.593 -23.256 1.00 0.00 H new ATOM 0 HE3 MET B 453 -4.731 -10.112 -21.579 1.00 0.00 H new ATOM 1025 N GLY B 454 -6.278 -7.036 -19.465 1.00 0.00 N ATOM 1026 CA GLY B 454 -6.901 -5.724 -19.407 1.00 0.00 C ATOM 1027 C GLY B 454 -6.421 -4.838 -20.558 1.00 0.00 C ATOM 1028 O GLY B 454 -5.518 -5.216 -21.303 1.00 0.00 O ATOM 0 H GLY B 454 -5.288 -7.028 -19.711 1.00 0.00 H new ATOM 0 HA2 GLY B 454 -7.985 -5.830 -19.452 1.00 0.00 H new ATOM 0 HA3 GLY B 454 -6.667 -5.248 -18.455 1.00 0.00 H new ATOM 1032 N VAL B 455 -7.047 -3.675 -20.668 1.00 0.00 N ATOM 1033 CA VAL B 455 -6.693 -2.731 -21.715 1.00 0.00 C ATOM 1034 C VAL B 455 -6.639 -1.320 -21.126 1.00 0.00 C ATOM 1035 O VAL B 455 -7.411 -0.989 -20.227 1.00 0.00 O ATOM 1036 CB VAL B 455 -7.674 -2.854 -22.883 1.00 0.00 C ATOM 1037 CG1 VAL B 455 -9.043 -2.282 -22.512 1.00 0.00 C ATOM 1038 CG2 VAL B 455 -7.118 -2.178 -24.138 1.00 0.00 C ATOM 0 H VAL B 455 -7.797 -3.365 -20.050 1.00 0.00 H new ATOM 0 HA VAL B 455 -5.704 -2.955 -22.113 1.00 0.00 H new ATOM 0 HB VAL B 455 -7.803 -3.914 -23.103 1.00 0.00 H new ATOM 0 HG11 VAL B 455 -9.721 -2.382 -23.360 1.00 0.00 H new ATOM 0 HG12 VAL B 455 -9.446 -2.827 -21.659 1.00 0.00 H new ATOM 0 HG13 VAL B 455 -8.939 -1.228 -22.253 1.00 0.00 H new ATOM 0 HG21 VAL B 455 -7.834 -2.280 -24.954 1.00 0.00 H new ATOM 0 HG22 VAL B 455 -6.946 -1.121 -23.936 1.00 0.00 H new ATOM 0 HG23 VAL B 455 -6.178 -2.651 -24.420 1.00 0.00 H new ATOM 1048 N LYS B 456 -5.720 -0.527 -21.656 1.00 0.00 N ATOM 1049 CA LYS B 456 -5.555 0.841 -21.194 1.00 0.00 C ATOM 1050 C LYS B 456 -6.655 1.715 -21.800 1.00 0.00 C ATOM 1051 O LYS B 456 -7.269 1.343 -22.799 1.00 0.00 O ATOM 1052 CB LYS B 456 -4.139 1.340 -21.491 1.00 0.00 C ATOM 1053 CG LYS B 456 -3.226 1.152 -20.278 1.00 0.00 C ATOM 1054 CD LYS B 456 -2.052 2.132 -20.318 1.00 0.00 C ATOM 1055 CE LYS B 456 -1.314 2.049 -21.655 1.00 0.00 C ATOM 1056 NZ LYS B 456 -1.334 3.360 -22.341 1.00 0.00 N ATOM 0 H LYS B 456 -5.082 -0.805 -22.401 1.00 0.00 H new ATOM 0 HA LYS B 456 -5.666 0.894 -20.111 1.00 0.00 H new ATOM 0 HB2 LYS B 456 -3.731 0.800 -22.345 1.00 0.00 H new ATOM 0 HB3 LYS B 456 -4.171 2.394 -21.766 1.00 0.00 H new ATOM 0 HG2 LYS B 456 -3.797 1.301 -19.362 1.00 0.00 H new ATOM 0 HG3 LYS B 456 -2.850 0.129 -20.257 1.00 0.00 H new ATOM 0 HD2 LYS B 456 -2.416 3.148 -20.162 1.00 0.00 H new ATOM 0 HD3 LYS B 456 -1.362 1.912 -19.503 1.00 0.00 H new ATOM 0 HE2 LYS B 456 -0.284 1.734 -21.489 1.00 0.00 H new ATOM 0 HE3 LYS B 456 -1.780 1.294 -22.288 1.00 0.00 H new ATOM 0 HZ1 LYS B 456 -0.829 3.286 -23.247 1.00 0.00 H new ATOM 0 HZ2 LYS B 456 -2.319 3.645 -22.516 1.00 0.00 H new ATOM 0 HZ3 LYS B 456 -0.869 4.072 -21.743 1.00 0.00 H new ATOM 1070 N GLU B 457 -6.870 2.861 -21.170 1.00 0.00 N ATOM 1071 CA GLU B 457 -7.885 3.791 -21.635 1.00 0.00 C ATOM 1072 C GLU B 457 -7.608 4.199 -23.083 1.00 0.00 C ATOM 1073 O GLU B 457 -8.524 4.253 -23.902 1.00 0.00 O ATOM 1074 CB GLU B 457 -7.961 5.018 -20.724 1.00 0.00 C ATOM 1075 CG GLU B 457 -8.883 6.085 -21.319 1.00 0.00 C ATOM 1076 CD GLU B 457 -9.796 6.680 -20.245 1.00 0.00 C ATOM 1077 OE1 GLU B 457 -9.269 7.455 -19.417 1.00 0.00 O ATOM 1078 OE2 GLU B 457 -11.001 6.347 -20.276 1.00 0.00 O ATOM 0 H GLU B 457 -6.359 3.166 -20.342 1.00 0.00 H new ATOM 0 HA GLU B 457 -8.853 3.291 -21.599 1.00 0.00 H new ATOM 0 HB2 GLU B 457 -8.327 4.723 -19.740 1.00 0.00 H new ATOM 0 HB3 GLU B 457 -6.963 5.433 -20.582 1.00 0.00 H new ATOM 0 HG2 GLU B 457 -8.285 6.876 -21.772 1.00 0.00 H new ATOM 0 HG3 GLU B 457 -9.487 5.647 -22.113 1.00 0.00 H new ATOM 1085 N SER B 458 -6.341 4.476 -23.355 1.00 0.00 N ATOM 1086 CA SER B 458 -5.932 4.877 -24.690 1.00 0.00 C ATOM 1087 C SER B 458 -6.299 3.787 -25.699 1.00 0.00 C ATOM 1088 O SER B 458 -6.705 4.086 -26.821 1.00 0.00 O ATOM 1089 CB SER B 458 -4.431 5.165 -24.743 1.00 0.00 C ATOM 1090 OG SER B 458 -4.148 6.409 -25.378 1.00 0.00 O ATOM 0 H SER B 458 -5.584 4.430 -22.673 1.00 0.00 H new ATOM 0 HA SER B 458 -6.460 5.795 -24.948 1.00 0.00 H new ATOM 0 HB2 SER B 458 -4.028 5.175 -23.730 1.00 0.00 H new ATOM 0 HB3 SER B 458 -3.926 4.361 -25.279 1.00 0.00 H new ATOM 0 HG SER B 458 -3.179 6.557 -25.390 1.00 0.00 H new ATOM 1096 N ASP B 459 -6.143 2.545 -25.264 1.00 0.00 N ATOM 1097 CA ASP B 459 -6.453 1.410 -26.115 1.00 0.00 C ATOM 1098 C ASP B 459 -7.957 1.382 -26.394 1.00 0.00 C ATOM 1099 O ASP B 459 -8.386 0.958 -27.466 1.00 0.00 O ATOM 1100 CB ASP B 459 -6.075 0.092 -25.436 1.00 0.00 C ATOM 1101 CG ASP B 459 -4.578 -0.225 -25.429 1.00 0.00 C ATOM 1102 OD1 ASP B 459 -3.799 0.705 -25.732 1.00 0.00 O ATOM 1103 OD2 ASP B 459 -4.246 -1.390 -25.120 1.00 0.00 O ATOM 0 H ASP B 459 -5.806 2.300 -24.333 1.00 0.00 H new ATOM 0 HA ASP B 459 -5.884 1.517 -27.038 1.00 0.00 H new ATOM 0 HB2 ASP B 459 -6.431 0.116 -24.406 1.00 0.00 H new ATOM 0 HB3 ASP B 459 -6.601 -0.721 -25.936 1.00 0.00 H new ATOM 1108 N TRP B 460 -8.718 1.841 -25.410 1.00 0.00 N ATOM 1109 CA TRP B 460 -10.165 1.874 -25.536 1.00 0.00 C ATOM 1110 C TRP B 460 -10.509 2.578 -26.850 1.00 0.00 C ATOM 1111 O TRP B 460 -11.337 2.093 -27.620 1.00 0.00 O ATOM 1112 CB TRP B 460 -10.806 2.538 -24.316 1.00 0.00 C ATOM 1113 CG TRP B 460 -12.306 2.272 -24.179 1.00 0.00 C ATOM 1114 CD1 TRP B 460 -13.203 2.081 -25.157 1.00 0.00 C ATOM 1115 CD2 TRP B 460 -13.053 2.173 -22.948 1.00 0.00 C ATOM 1116 NE1 TRP B 460 -14.468 1.868 -24.648 1.00 0.00 N ATOM 1117 CE2 TRP B 460 -14.374 1.926 -23.263 1.00 0.00 C ATOM 1118 CE3 TRP B 460 -12.627 2.289 -21.614 1.00 0.00 C ATOM 1119 CZ2 TRP B 460 -15.376 1.774 -22.297 1.00 0.00 C ATOM 1120 CZ3 TRP B 460 -13.641 2.135 -20.660 1.00 0.00 C ATOM 1121 CH2 TRP B 460 -14.975 1.885 -20.960 1.00 0.00 C ATOM 0 H TRP B 460 -8.359 2.193 -24.522 1.00 0.00 H new ATOM 0 HA TRP B 460 -10.573 0.864 -25.565 1.00 0.00 H new ATOM 0 HB2 TRP B 460 -10.301 2.186 -23.416 1.00 0.00 H new ATOM 0 HB3 TRP B 460 -10.642 3.614 -24.373 1.00 0.00 H new ATOM 0 HD1 TRP B 460 -12.966 2.092 -26.211 1.00 0.00 H new ATOM 0 HE1 TRP B 460 -15.316 1.699 -25.189 1.00 0.00 H new ATOM 0 HE3 TRP B 460 -11.599 2.482 -21.345 1.00 0.00 H new ATOM 0 HZ2 TRP B 460 -16.403 1.581 -22.569 1.00 0.00 H new ATOM 0 HZ3 TRP B 460 -13.367 2.216 -19.618 1.00 0.00 H new ATOM 0 HH2 TRP B 460 -15.699 1.777 -20.166 1.00 0.00 H new ATOM 1132 N ASN B 461 -9.857 3.711 -27.066 1.00 0.00 N ATOM 1133 CA ASN B 461 -10.083 4.487 -28.273 1.00 0.00 C ATOM 1134 C ASN B 461 -9.787 3.617 -29.496 1.00 0.00 C ATOM 1135 O ASN B 461 -10.341 3.841 -30.571 1.00 0.00 O ATOM 1136 CB ASN B 461 -9.161 5.706 -28.326 1.00 0.00 C ATOM 1137 CG ASN B 461 -9.407 6.632 -27.133 1.00 0.00 C ATOM 1138 OD1 ASN B 461 -10.232 7.530 -27.171 1.00 0.00 O ATOM 1139 ND2 ASN B 461 -8.648 6.364 -26.074 1.00 0.00 N ATOM 0 H ASN B 461 -9.172 4.110 -26.425 1.00 0.00 H new ATOM 0 HA ASN B 461 -11.121 4.820 -28.270 1.00 0.00 H new ATOM 0 HB2 ASN B 461 -8.121 5.380 -28.329 1.00 0.00 H new ATOM 0 HB3 ASN B 461 -9.327 6.252 -29.255 1.00 0.00 H new ATOM 0 HD21 ASN B 461 -8.738 6.925 -25.227 1.00 0.00 H new ATOM 0 HD22 ASN B 461 -7.976 5.597 -26.109 1.00 0.00 H new ATOM 1146 N GLN B 462 -8.913 2.642 -29.292 1.00 0.00 N ATOM 1147 CA GLN B 462 -8.536 1.738 -30.365 1.00 0.00 C ATOM 1148 C GLN B 462 -9.424 0.492 -30.347 1.00 0.00 C ATOM 1149 O GLN B 462 -9.089 -0.522 -30.956 1.00 0.00 O ATOM 1150 CB GLN B 462 -7.057 1.358 -30.267 1.00 0.00 C ATOM 1151 CG GLN B 462 -6.192 2.298 -31.109 1.00 0.00 C ATOM 1152 CD GLN B 462 -5.811 3.550 -30.316 1.00 0.00 C ATOM 1153 OE1 GLN B 462 -4.696 3.701 -29.843 1.00 0.00 O ATOM 1154 NE2 GLN B 462 -6.795 4.437 -30.198 1.00 0.00 N ATOM 0 H GLN B 462 -8.455 2.458 -28.399 1.00 0.00 H new ATOM 0 HA GLN B 462 -8.684 2.252 -31.315 1.00 0.00 H new ATOM 0 HB2 GLN B 462 -6.736 1.397 -29.226 1.00 0.00 H new ATOM 0 HB3 GLN B 462 -6.919 0.331 -30.604 1.00 0.00 H new ATOM 0 HG2 GLN B 462 -5.290 1.778 -31.430 1.00 0.00 H new ATOM 0 HG3 GLN B 462 -6.732 2.585 -32.011 1.00 0.00 H new ATOM 0 HE21 GLN B 462 -7.705 4.248 -30.618 1.00 0.00 H new ATOM 0 HE22 GLN B 462 -6.640 5.306 -29.687 1.00 0.00 H new ATOM 1163 N HIS B 463 -10.539 0.610 -29.641 1.00 0.00 N ATOM 1164 CA HIS B 463 -11.478 -0.494 -29.535 1.00 0.00 C ATOM 1165 C HIS B 463 -11.710 -1.105 -30.918 1.00 0.00 C ATOM 1166 O HIS B 463 -12.103 -2.265 -31.030 1.00 0.00 O ATOM 1167 CB HIS B 463 -12.775 -0.041 -28.862 1.00 0.00 C ATOM 1168 CG HIS B 463 -14.026 -0.576 -29.517 1.00 0.00 C ATOM 1169 ND1 HIS B 463 -15.002 -1.266 -28.820 1.00 0.00 N ATOM 1170 CD2 HIS B 463 -14.450 -0.514 -30.812 1.00 0.00 C ATOM 1171 CE1 HIS B 463 -15.965 -1.600 -29.667 1.00 0.00 C ATOM 1172 NE2 HIS B 463 -15.620 -1.133 -30.901 1.00 0.00 N ATOM 0 H HIS B 463 -10.813 1.453 -29.137 1.00 0.00 H new ATOM 0 HA HIS B 463 -11.059 -1.273 -28.898 1.00 0.00 H new ATOM 0 HB2 HIS B 463 -12.760 -0.356 -27.819 1.00 0.00 H new ATOM 0 HB3 HIS B 463 -12.813 1.048 -28.865 1.00 0.00 H new ATOM 0 HD2 HIS B 463 -13.922 -0.041 -31.627 1.00 0.00 H new ATOM 0 HE1 HIS B 463 -16.864 -2.146 -29.423 1.00 0.00 H new ATOM 0 HE2 HIS B 463 -16.171 -1.242 -31.752 1.00 0.00 H new ATOM 1180 N LYS B 464 -11.456 -0.297 -31.937 1.00 0.00 N ATOM 1181 CA LYS B 464 -11.632 -0.744 -33.308 1.00 0.00 C ATOM 1182 C LYS B 464 -10.763 -1.979 -33.553 1.00 0.00 C ATOM 1183 O LYS B 464 -11.112 -2.838 -34.362 1.00 0.00 O ATOM 1184 CB LYS B 464 -11.360 0.403 -34.285 1.00 0.00 C ATOM 1185 CG LYS B 464 -11.999 0.125 -35.647 1.00 0.00 C ATOM 1186 CD LYS B 464 -11.422 1.051 -36.721 1.00 0.00 C ATOM 1187 CE LYS B 464 -12.539 1.708 -37.535 1.00 0.00 C ATOM 1188 NZ LYS B 464 -11.969 2.583 -38.584 1.00 0.00 N ATOM 0 H LYS B 464 -11.130 0.665 -31.840 1.00 0.00 H new ATOM 0 HA LYS B 464 -12.666 -1.042 -33.482 1.00 0.00 H new ATOM 0 HB2 LYS B 464 -11.754 1.334 -33.877 1.00 0.00 H new ATOM 0 HB3 LYS B 464 -10.285 0.537 -34.404 1.00 0.00 H new ATOM 0 HG2 LYS B 464 -11.829 -0.914 -35.928 1.00 0.00 H new ATOM 0 HG3 LYS B 464 -13.078 0.265 -35.582 1.00 0.00 H new ATOM 0 HD2 LYS B 464 -10.808 1.820 -36.252 1.00 0.00 H new ATOM 0 HD3 LYS B 464 -10.770 0.483 -37.384 1.00 0.00 H new ATOM 0 HE2 LYS B 464 -13.163 0.941 -37.993 1.00 0.00 H new ATOM 0 HE3 LYS B 464 -13.182 2.291 -36.876 1.00 0.00 H new ATOM 0 HZ1 LYS B 464 -12.740 3.021 -39.127 1.00 0.00 H new ATOM 0 HZ2 LYS B 464 -11.392 3.326 -38.141 1.00 0.00 H new ATOM 0 HZ3 LYS B 464 -11.374 2.017 -39.222 1.00 0.00 H new ATOM 1202 N LYS B 465 -9.647 -2.029 -32.840 1.00 0.00 N ATOM 1203 CA LYS B 465 -8.726 -3.145 -32.970 1.00 0.00 C ATOM 1204 C LYS B 465 -8.356 -3.660 -31.577 1.00 0.00 C ATOM 1205 O LYS B 465 -7.179 -3.849 -31.274 1.00 0.00 O ATOM 1206 CB LYS B 465 -7.517 -2.746 -33.819 1.00 0.00 C ATOM 1207 CG LYS B 465 -7.925 -2.503 -35.273 1.00 0.00 C ATOM 1208 CD LYS B 465 -7.013 -3.268 -36.234 1.00 0.00 C ATOM 1209 CE LYS B 465 -6.647 -2.408 -37.445 1.00 0.00 C ATOM 1210 NZ LYS B 465 -7.764 -2.380 -38.416 1.00 0.00 N ATOM 0 H LYS B 465 -9.360 -1.315 -32.171 1.00 0.00 H new ATOM 0 HA LYS B 465 -9.200 -3.971 -33.500 1.00 0.00 H new ATOM 0 HB2 LYS B 465 -7.062 -1.844 -33.409 1.00 0.00 H new ATOM 0 HB3 LYS B 465 -6.762 -3.531 -33.776 1.00 0.00 H new ATOM 0 HG2 LYS B 465 -8.959 -2.815 -35.421 1.00 0.00 H new ATOM 0 HG3 LYS B 465 -7.879 -1.437 -35.494 1.00 0.00 H new ATOM 0 HD2 LYS B 465 -6.106 -3.574 -35.713 1.00 0.00 H new ATOM 0 HD3 LYS B 465 -7.512 -4.178 -36.567 1.00 0.00 H new ATOM 0 HE2 LYS B 465 -6.413 -1.394 -37.121 1.00 0.00 H new ATOM 0 HE3 LYS B 465 -5.751 -2.805 -37.923 1.00 0.00 H new ATOM 0 HZ1 LYS B 465 -7.500 -1.792 -39.232 1.00 0.00 H new ATOM 0 HZ2 LYS B 465 -7.969 -3.348 -38.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 465 -8.610 -1.981 -37.961 1.00 0.00 H new ATOM 1224 N LEU B 466 -9.383 -3.871 -30.767 1.00 0.00 N ATOM 1225 CA LEU B 466 -9.181 -4.361 -29.414 1.00 0.00 C ATOM 1226 C LEU B 466 -8.373 -5.659 -29.462 1.00 0.00 C ATOM 1227 O LEU B 466 -7.608 -5.953 -28.545 1.00 0.00 O ATOM 1228 CB LEU B 466 -10.521 -4.497 -28.688 1.00 0.00 C ATOM 1229 CG LEU B 466 -11.496 -5.524 -29.266 1.00 0.00 C ATOM 1230 CD1 LEU B 466 -11.341 -6.878 -28.572 1.00 0.00 C ATOM 1231 CD2 LEU B 466 -12.935 -5.009 -29.204 1.00 0.00 C ATOM 0 H LEU B 466 -10.358 -3.712 -31.022 1.00 0.00 H new ATOM 0 HA LEU B 466 -8.601 -3.645 -28.832 1.00 0.00 H new ATOM 0 HB2 LEU B 466 -10.323 -4.758 -27.648 1.00 0.00 H new ATOM 0 HB3 LEU B 466 -11.010 -3.523 -28.685 1.00 0.00 H new ATOM 0 HG LEU B 466 -11.252 -5.672 -30.318 1.00 0.00 H new ATOM 0 HD11 LEU B 466 -12.046 -7.590 -29.002 1.00 0.00 H new ATOM 0 HD12 LEU B 466 -10.324 -7.244 -28.712 1.00 0.00 H new ATOM 0 HD13 LEU B 466 -11.543 -6.766 -27.507 1.00 0.00 H new ATOM 0 HD21 LEU B 466 -13.608 -5.758 -29.621 1.00 0.00 H new ATOM 0 HD22 LEU B 466 -13.207 -4.814 -28.167 1.00 0.00 H new ATOM 0 HD23 LEU B 466 -13.017 -4.087 -29.780 1.00 0.00 H new ATOM 1243 N GLU B 467 -8.571 -6.403 -30.541 1.00 0.00 N ATOM 1244 CA GLU B 467 -7.871 -7.663 -30.720 1.00 0.00 C ATOM 1245 C GLU B 467 -6.362 -7.424 -30.814 1.00 0.00 C ATOM 1246 O GLU B 467 -5.571 -8.346 -30.621 1.00 0.00 O ATOM 1247 CB GLU B 467 -8.386 -8.406 -31.954 1.00 0.00 C ATOM 1248 CG GLU B 467 -9.266 -9.591 -31.553 1.00 0.00 C ATOM 1249 CD GLU B 467 -9.195 -10.706 -32.599 1.00 0.00 C ATOM 1250 OE1 GLU B 467 -8.306 -11.571 -32.446 1.00 0.00 O ATOM 1251 OE2 GLU B 467 -10.032 -10.667 -33.527 1.00 0.00 O ATOM 0 H GLU B 467 -9.206 -6.157 -31.300 1.00 0.00 H new ATOM 0 HA GLU B 467 -8.066 -8.291 -29.851 1.00 0.00 H new ATOM 0 HB2 GLU B 467 -8.956 -7.722 -32.583 1.00 0.00 H new ATOM 0 HB3 GLU B 467 -7.543 -8.759 -32.548 1.00 0.00 H new ATOM 0 HG2 GLU B 467 -8.946 -9.975 -30.585 1.00 0.00 H new ATOM 0 HG3 GLU B 467 -10.298 -9.260 -31.439 1.00 0.00 H new ATOM 1258 N LYS B 468 -6.010 -6.182 -31.110 1.00 0.00 N ATOM 1259 CA LYS B 468 -4.611 -5.810 -31.232 1.00 0.00 C ATOM 1260 C LYS B 468 -4.254 -4.812 -30.128 1.00 0.00 C ATOM 1261 O LYS B 468 -3.156 -4.258 -30.118 1.00 0.00 O ATOM 1262 CB LYS B 468 -4.313 -5.298 -32.643 1.00 0.00 C ATOM 1263 CG LYS B 468 -4.855 -6.261 -33.701 1.00 0.00 C ATOM 1264 CD LYS B 468 -3.727 -6.796 -34.584 1.00 0.00 C ATOM 1265 CE LYS B 468 -3.553 -5.932 -35.835 1.00 0.00 C ATOM 1266 NZ LYS B 468 -3.236 -6.777 -37.008 1.00 0.00 N ATOM 0 H LYS B 468 -6.669 -5.420 -31.269 1.00 0.00 H new ATOM 0 HA LYS B 468 -3.972 -6.682 -31.093 1.00 0.00 H new ATOM 0 HB2 LYS B 468 -4.761 -4.313 -32.779 1.00 0.00 H new ATOM 0 HB3 LYS B 468 -3.237 -5.179 -32.771 1.00 0.00 H new ATOM 0 HG2 LYS B 468 -5.366 -7.092 -33.214 1.00 0.00 H new ATOM 0 HG3 LYS B 468 -5.594 -5.750 -34.318 1.00 0.00 H new ATOM 0 HD2 LYS B 468 -2.795 -6.815 -34.018 1.00 0.00 H new ATOM 0 HD3 LYS B 468 -3.944 -7.824 -34.875 1.00 0.00 H new ATOM 0 HE2 LYS B 468 -4.465 -5.366 -36.023 1.00 0.00 H new ATOM 0 HE3 LYS B 468 -2.755 -5.207 -35.675 1.00 0.00 H new ATOM 0 HZ1 LYS B 468 -3.121 -6.175 -37.848 1.00 0.00 H new ATOM 0 HZ2 LYS B 468 -2.353 -7.298 -36.832 1.00 0.00 H new ATOM 0 HZ3 LYS B 468 -4.010 -7.452 -37.169 1.00 0.00 H new ATOM 1280 N CYS B 469 -5.203 -4.613 -29.225 1.00 0.00 N ATOM 1281 CA CYS B 469 -5.003 -3.692 -28.120 1.00 0.00 C ATOM 1282 C CYS B 469 -4.949 -4.502 -26.823 1.00 0.00 C ATOM 1283 O CYS B 469 -4.590 -3.974 -25.772 1.00 0.00 O ATOM 1284 CB CYS B 469 -6.091 -2.617 -28.076 1.00 0.00 C ATOM 1285 SG CYS B 469 -5.337 -0.957 -28.235 1.00 0.00 S ATOM 0 H CYS B 469 -6.113 -5.074 -29.236 1.00 0.00 H new ATOM 0 HA CYS B 469 -4.062 -3.159 -28.254 1.00 0.00 H new ATOM 0 HB2 CYS B 469 -6.807 -2.779 -28.882 1.00 0.00 H new ATOM 0 HB3 CYS B 469 -6.644 -2.686 -27.139 1.00 0.00 H new ATOM 0 HG CYS B 469 -5.270 -0.629 -29.491 1.00 0.00 H new ATOM 1291 N ARG B 470 -5.310 -5.771 -26.940 1.00 0.00 N ATOM 1292 CA ARG B 470 -5.307 -6.659 -25.790 1.00 0.00 C ATOM 1293 C ARG B 470 -3.897 -6.762 -25.203 1.00 0.00 C ATOM 1294 O ARG B 470 -2.910 -6.629 -25.924 1.00 0.00 O ATOM 1295 CB ARG B 470 -5.796 -8.058 -26.173 1.00 0.00 C ATOM 1296 CG ARG B 470 -7.192 -7.999 -26.795 1.00 0.00 C ATOM 1297 CD ARG B 470 -8.098 -9.087 -26.214 1.00 0.00 C ATOM 1298 NE ARG B 470 -8.351 -10.131 -27.232 1.00 0.00 N ATOM 1299 CZ ARG B 470 -8.869 -11.336 -26.958 1.00 0.00 C ATOM 1300 NH1 ARG B 470 -9.192 -11.656 -25.698 1.00 0.00 N ATOM 1301 NH2 ARG B 470 -9.063 -12.222 -27.945 1.00 0.00 N ATOM 0 H ARG B 470 -5.607 -6.206 -27.814 1.00 0.00 H new ATOM 0 HA ARG B 470 -5.985 -6.241 -25.046 1.00 0.00 H new ATOM 0 HB2 ARG B 470 -5.099 -8.511 -26.878 1.00 0.00 H new ATOM 0 HB3 ARG B 470 -5.814 -8.695 -25.289 1.00 0.00 H new ATOM 0 HG2 ARG B 470 -7.633 -7.019 -26.615 1.00 0.00 H new ATOM 0 HG3 ARG B 470 -7.118 -8.121 -27.876 1.00 0.00 H new ATOM 0 HD2 ARG B 470 -7.630 -9.530 -25.335 1.00 0.00 H new ATOM 0 HD3 ARG B 470 -9.041 -8.650 -25.887 1.00 0.00 H new ATOM 0 HE ARG B 470 -8.117 -9.920 -28.202 1.00 0.00 H new ATOM 0 HH11 ARG B 470 -9.044 -10.982 -24.947 1.00 0.00 H new ATOM 0 HH12 ARG B 470 -9.586 -12.573 -25.490 1.00 0.00 H new ATOM 0 HH21 ARG B 470 -8.816 -11.979 -28.904 1.00 0.00 H new ATOM 0 HH22 ARG B 470 -9.457 -13.139 -27.737 1.00 0.00 H new ATOM 1315 N GLY B 471 -3.849 -6.998 -23.900 1.00 0.00 N ATOM 1316 CA GLY B 471 -2.578 -7.119 -23.208 1.00 0.00 C ATOM 1317 C GLY B 471 -2.764 -7.743 -21.823 1.00 0.00 C ATOM 1318 O GLY B 471 -3.883 -8.069 -21.431 1.00 0.00 O ATOM 0 H GLY B 471 -4.670 -7.109 -23.306 1.00 0.00 H new ATOM 0 HA2 GLY B 471 -1.896 -7.731 -23.798 1.00 0.00 H new ATOM 0 HA3 GLY B 471 -2.119 -6.135 -23.109 1.00 0.00 H new ATOM 1322 N VAL B 472 -1.650 -7.891 -21.121 1.00 0.00 N ATOM 1323 CA VAL B 472 -1.676 -8.471 -19.789 1.00 0.00 C ATOM 1324 C VAL B 472 -1.006 -7.509 -18.806 1.00 0.00 C ATOM 1325 O VAL B 472 -0.021 -6.855 -19.146 1.00 0.00 O ATOM 1326 CB VAL B 472 -1.026 -9.855 -19.808 1.00 0.00 C ATOM 1327 CG1 VAL B 472 -0.667 -10.312 -18.393 1.00 0.00 C ATOM 1328 CG2 VAL B 472 -1.931 -10.876 -20.501 1.00 0.00 C ATOM 0 H VAL B 472 -0.723 -7.619 -21.450 1.00 0.00 H new ATOM 0 HA VAL B 472 -2.704 -8.614 -19.455 1.00 0.00 H new ATOM 0 HB VAL B 472 -0.102 -9.783 -20.381 1.00 0.00 H new ATOM 0 HG11 VAL B 472 -0.206 -11.299 -18.435 1.00 0.00 H new ATOM 0 HG12 VAL B 472 0.032 -9.604 -17.948 1.00 0.00 H new ATOM 0 HG13 VAL B 472 -1.571 -10.359 -17.786 1.00 0.00 H new ATOM 0 HG21 VAL B 472 -1.445 -11.852 -20.501 1.00 0.00 H new ATOM 0 HG22 VAL B 472 -2.879 -10.943 -19.968 1.00 0.00 H new ATOM 0 HG23 VAL B 472 -2.114 -10.562 -21.529 1.00 0.00 H new ATOM 1338 N PHE B 473 -1.567 -7.453 -17.607 1.00 0.00 N ATOM 1339 CA PHE B 473 -1.035 -6.583 -16.572 1.00 0.00 C ATOM 1340 C PHE B 473 -1.276 -7.175 -15.181 1.00 0.00 C ATOM 1341 O PHE B 473 -2.251 -7.893 -14.969 1.00 0.00 O ATOM 1342 CB PHE B 473 -1.779 -5.251 -16.681 1.00 0.00 C ATOM 1343 CG PHE B 473 -3.229 -5.306 -16.196 1.00 0.00 C ATOM 1344 CD1 PHE B 473 -4.161 -5.989 -16.913 1.00 0.00 C ATOM 1345 CD2 PHE B 473 -3.586 -4.672 -15.046 1.00 0.00 C ATOM 1346 CE1 PHE B 473 -5.507 -6.040 -16.462 1.00 0.00 C ATOM 1347 CE2 PHE B 473 -4.931 -4.723 -14.596 1.00 0.00 C ATOM 1348 CZ PHE B 473 -5.863 -5.406 -15.313 1.00 0.00 C ATOM 0 H PHE B 473 -2.385 -7.996 -17.329 1.00 0.00 H new ATOM 0 HA PHE B 473 0.040 -6.461 -16.705 1.00 0.00 H new ATOM 0 HB2 PHE B 473 -1.242 -4.498 -16.104 1.00 0.00 H new ATOM 0 HB3 PHE B 473 -1.767 -4.924 -17.721 1.00 0.00 H new ATOM 0 HD1 PHE B 473 -3.878 -6.493 -17.825 1.00 0.00 H new ATOM 0 HD2 PHE B 473 -2.846 -4.130 -14.476 1.00 0.00 H new ATOM 0 HE1 PHE B 473 -6.247 -6.582 -17.032 1.00 0.00 H new ATOM 0 HE2 PHE B 473 -5.214 -4.219 -13.684 1.00 0.00 H new ATOM 0 HZ PHE B 473 -6.886 -5.445 -14.970 1.00 0.00 H new ATOM 1358 N PRO B 474 -0.345 -6.843 -14.247 1.00 0.00 N ATOM 1359 CA PRO B 474 -0.447 -7.334 -12.883 1.00 0.00 C ATOM 1360 C PRO B 474 -1.538 -6.588 -12.112 1.00 0.00 C ATOM 1361 O PRO B 474 -1.430 -5.384 -11.884 1.00 0.00 O ATOM 1362 CB PRO B 474 0.939 -7.137 -12.290 1.00 0.00 C ATOM 1363 CG PRO B 474 1.635 -6.124 -13.184 1.00 0.00 C ATOM 1364 CD PRO B 474 0.823 -5.995 -14.463 1.00 0.00 C ATOM 0 HA PRO B 474 -0.742 -8.382 -12.834 1.00 0.00 H new ATOM 0 HB2 PRO B 474 0.877 -6.775 -11.264 1.00 0.00 H new ATOM 0 HB3 PRO B 474 1.490 -8.077 -12.263 1.00 0.00 H new ATOM 0 HG2 PRO B 474 1.711 -5.160 -12.681 1.00 0.00 H new ATOM 0 HG3 PRO B 474 2.651 -6.448 -13.408 1.00 0.00 H new ATOM 0 HD2 PRO B 474 0.533 -4.960 -14.645 1.00 0.00 H new ATOM 0 HD3 PRO B 474 1.396 -6.323 -15.330 1.00 0.00 H new ATOM 1372 N GLU B 475 -2.564 -7.335 -11.731 1.00 0.00 N ATOM 1373 CA GLU B 475 -3.674 -6.760 -10.990 1.00 0.00 C ATOM 1374 C GLU B 475 -3.225 -6.365 -9.582 1.00 0.00 C ATOM 1375 O GLU B 475 -3.760 -5.424 -8.997 1.00 0.00 O ATOM 1376 CB GLU B 475 -4.858 -7.728 -10.937 1.00 0.00 C ATOM 1377 CG GLU B 475 -5.819 -7.357 -9.807 1.00 0.00 C ATOM 1378 CD GLU B 475 -7.273 -7.582 -10.227 1.00 0.00 C ATOM 1379 OE1 GLU B 475 -7.748 -6.793 -11.072 1.00 0.00 O ATOM 1380 OE2 GLU B 475 -7.876 -8.539 -9.694 1.00 0.00 O ATOM 0 H GLU B 475 -2.650 -8.333 -11.922 1.00 0.00 H new ATOM 0 HA GLU B 475 -4.005 -5.861 -11.510 1.00 0.00 H new ATOM 0 HB2 GLU B 475 -5.388 -7.713 -11.889 1.00 0.00 H new ATOM 0 HB3 GLU B 475 -4.494 -8.745 -10.791 1.00 0.00 H new ATOM 0 HG2 GLU B 475 -5.595 -7.955 -8.924 1.00 0.00 H new ATOM 0 HG3 GLU B 475 -5.674 -6.313 -9.530 1.00 0.00 H new ATOM 1387 N ASN B 476 -2.247 -7.104 -9.078 1.00 0.00 N ATOM 1388 CA ASN B 476 -1.721 -6.843 -7.749 1.00 0.00 C ATOM 1389 C ASN B 476 -0.900 -5.552 -7.775 1.00 0.00 C ATOM 1390 O ASN B 476 -0.441 -5.083 -6.735 1.00 0.00 O ATOM 1391 CB ASN B 476 -0.803 -7.977 -7.288 1.00 0.00 C ATOM 1392 CG ASN B 476 0.371 -8.159 -8.251 1.00 0.00 C ATOM 1393 OD1 ASN B 476 1.434 -7.581 -8.092 1.00 0.00 O ATOM 1394 ND2 ASN B 476 0.122 -8.992 -9.258 1.00 0.00 N ATOM 0 H ASN B 476 -1.805 -7.883 -9.566 1.00 0.00 H new ATOM 0 HA ASN B 476 -2.564 -6.759 -7.063 1.00 0.00 H new ATOM 0 HB2 ASN B 476 -0.427 -7.761 -6.288 1.00 0.00 H new ATOM 0 HB3 ASN B 476 -1.371 -8.905 -7.222 1.00 0.00 H new ATOM 0 HD21 ASN B 476 0.843 -9.179 -9.955 1.00 0.00 H new ATOM 0 HD22 ASN B 476 -0.790 -9.443 -9.333 1.00 0.00 H new ATOM 1401 N PHE B 477 -0.741 -5.014 -8.975 1.00 0.00 N ATOM 1402 CA PHE B 477 0.017 -3.786 -9.150 1.00 0.00 C ATOM 1403 C PHE B 477 -0.900 -2.630 -9.556 1.00 0.00 C ATOM 1404 O PHE B 477 -0.433 -1.516 -9.790 1.00 0.00 O ATOM 1405 CB PHE B 477 1.026 -4.039 -10.272 1.00 0.00 C ATOM 1406 CG PHE B 477 1.241 -2.840 -11.197 1.00 0.00 C ATOM 1407 CD1 PHE B 477 0.353 -2.583 -12.195 1.00 0.00 C ATOM 1408 CD2 PHE B 477 2.320 -2.030 -11.022 1.00 0.00 C ATOM 1409 CE1 PHE B 477 0.553 -1.470 -13.054 1.00 0.00 C ATOM 1410 CE2 PHE B 477 2.519 -0.917 -11.881 1.00 0.00 C ATOM 1411 CZ PHE B 477 1.632 -0.661 -12.879 1.00 0.00 C ATOM 0 H PHE B 477 -1.124 -5.405 -9.836 1.00 0.00 H new ATOM 0 HA PHE B 477 0.508 -3.515 -8.215 1.00 0.00 H new ATOM 0 HB2 PHE B 477 1.982 -4.320 -9.830 1.00 0.00 H new ATOM 0 HB3 PHE B 477 0.688 -4.888 -10.867 1.00 0.00 H new ATOM 0 HD1 PHE B 477 -0.504 -3.225 -12.334 1.00 0.00 H new ATOM 0 HD2 PHE B 477 3.025 -2.234 -10.230 1.00 0.00 H new ATOM 0 HE1 PHE B 477 -0.152 -1.266 -13.846 1.00 0.00 H new ATOM 0 HE2 PHE B 477 3.375 -0.274 -11.742 1.00 0.00 H new ATOM 0 HZ PHE B 477 1.784 0.185 -13.533 1.00 0.00 H new ATOM 1421 N THR B 478 -2.187 -2.934 -9.626 1.00 0.00 N ATOM 1422 CA THR B 478 -3.173 -1.933 -9.997 1.00 0.00 C ATOM 1423 C THR B 478 -4.304 -1.891 -8.968 1.00 0.00 C ATOM 1424 O THR B 478 -4.287 -2.637 -7.990 1.00 0.00 O ATOM 1425 CB THR B 478 -3.654 -2.247 -11.415 1.00 0.00 C ATOM 1426 OG1 THR B 478 -3.714 -3.670 -11.455 1.00 0.00 O ATOM 1427 CG2 THR B 478 -2.615 -1.888 -12.479 1.00 0.00 C ATOM 0 H THR B 478 -2.570 -3.859 -9.432 1.00 0.00 H new ATOM 0 HA THR B 478 -2.740 -0.933 -9.998 1.00 0.00 H new ATOM 0 HB THR B 478 -4.578 -1.704 -11.612 1.00 0.00 H new ATOM 0 HG1 THR B 478 -2.842 -4.027 -11.724 1.00 0.00 H new ATOM 0 HG21 THR B 478 -3.007 -2.131 -13.467 1.00 0.00 H new ATOM 0 HG22 THR B 478 -2.395 -0.822 -12.428 1.00 0.00 H new ATOM 0 HG23 THR B 478 -1.701 -2.455 -12.302 1.00 0.00 H new ATOM 1435 N GLU B 479 -5.261 -1.010 -9.222 1.00 0.00 N ATOM 1436 CA GLU B 479 -6.398 -0.861 -8.330 1.00 0.00 C ATOM 1437 C GLU B 479 -7.703 -0.873 -9.127 1.00 0.00 C ATOM 1438 O GLU B 479 -7.732 -0.455 -10.284 1.00 0.00 O ATOM 1439 CB GLU B 479 -6.276 0.415 -7.495 1.00 0.00 C ATOM 1440 CG GLU B 479 -6.860 0.213 -6.096 1.00 0.00 C ATOM 1441 CD GLU B 479 -7.041 1.553 -5.379 1.00 0.00 C ATOM 1442 OE1 GLU B 479 -6.002 2.175 -5.067 1.00 0.00 O ATOM 1443 OE2 GLU B 479 -8.214 1.924 -5.158 1.00 0.00 O ATOM 0 H GLU B 479 -5.272 -0.392 -10.033 1.00 0.00 H new ATOM 0 HA GLU B 479 -6.408 -1.706 -7.642 1.00 0.00 H new ATOM 0 HB2 GLU B 479 -5.228 0.704 -7.417 1.00 0.00 H new ATOM 0 HB3 GLU B 479 -6.796 1.232 -7.995 1.00 0.00 H new ATOM 0 HG2 GLU B 479 -7.820 -0.297 -6.169 1.00 0.00 H new ATOM 0 HG3 GLU B 479 -6.201 -0.430 -5.512 1.00 0.00 H new ATOM 1450 N ARG B 480 -8.752 -1.357 -8.478 1.00 0.00 N ATOM 1451 CA ARG B 480 -10.057 -1.428 -9.111 1.00 0.00 C ATOM 1452 C ARG B 480 -10.840 -0.137 -8.861 1.00 0.00 C ATOM 1453 O ARG B 480 -10.889 0.355 -7.735 1.00 0.00 O ATOM 1454 CB ARG B 480 -10.863 -2.616 -8.581 1.00 0.00 C ATOM 1455 CG ARG B 480 -10.133 -3.934 -8.843 1.00 0.00 C ATOM 1456 CD ARG B 480 -11.117 -5.038 -9.237 1.00 0.00 C ATOM 1457 NE ARG B 480 -11.580 -5.757 -8.029 1.00 0.00 N ATOM 1458 CZ ARG B 480 -10.798 -6.544 -7.278 1.00 0.00 C ATOM 1459 NH1 ARG B 480 -9.510 -6.719 -7.605 1.00 0.00 N ATOM 1460 NH2 ARG B 480 -11.303 -7.158 -6.199 1.00 0.00 N ATOM 0 H ARG B 480 -8.724 -1.704 -7.519 1.00 0.00 H new ATOM 0 HA ARG B 480 -9.899 -1.559 -10.181 1.00 0.00 H new ATOM 0 HB2 ARG B 480 -11.033 -2.497 -7.511 1.00 0.00 H new ATOM 0 HB3 ARG B 480 -11.843 -2.638 -9.059 1.00 0.00 H new ATOM 0 HG2 ARG B 480 -9.399 -3.796 -9.637 1.00 0.00 H new ATOM 0 HG3 ARG B 480 -9.584 -4.233 -7.950 1.00 0.00 H new ATOM 0 HD2 ARG B 480 -11.969 -4.607 -9.763 1.00 0.00 H new ATOM 0 HD3 ARG B 480 -10.638 -5.735 -9.924 1.00 0.00 H new ATOM 0 HE ARG B 480 -12.555 -5.646 -7.751 1.00 0.00 H new ATOM 0 HH11 ARG B 480 -9.124 -6.253 -8.426 1.00 0.00 H new ATOM 0 HH12 ARG B 480 -8.915 -7.318 -7.033 1.00 0.00 H new ATOM 0 HH21 ARG B 480 -12.283 -7.026 -5.949 1.00 0.00 H new ATOM 0 HH22 ARG B 480 -10.707 -7.757 -5.628 1.00 0.00 H new ATOM 1474 N VAL B 481 -11.433 0.374 -9.930 1.00 0.00 N ATOM 1475 CA VAL B 481 -12.210 1.599 -9.841 1.00 0.00 C ATOM 1476 C VAL B 481 -13.690 1.275 -10.054 1.00 0.00 C ATOM 1477 O VAL B 481 -14.083 0.829 -11.131 1.00 0.00 O ATOM 1478 CB VAL B 481 -11.675 2.632 -10.834 1.00 0.00 C ATOM 1479 CG1 VAL B 481 -12.399 3.970 -10.676 1.00 0.00 C ATOM 1480 CG2 VAL B 481 -10.163 2.805 -10.684 1.00 0.00 C ATOM 0 H VAL B 481 -11.391 -0.038 -10.862 1.00 0.00 H new ATOM 0 HA VAL B 481 -12.113 2.042 -8.850 1.00 0.00 H new ATOM 0 HB VAL B 481 -11.871 2.262 -11.840 1.00 0.00 H new ATOM 0 HG11 VAL B 481 -12.000 4.687 -11.394 1.00 0.00 H new ATOM 0 HG12 VAL B 481 -13.465 3.831 -10.857 1.00 0.00 H new ATOM 0 HG13 VAL B 481 -12.249 4.348 -9.664 1.00 0.00 H new ATOM 0 HG21 VAL B 481 -9.808 3.545 -11.402 1.00 0.00 H new ATOM 0 HG22 VAL B 481 -9.934 3.141 -9.673 1.00 0.00 H new ATOM 0 HG23 VAL B 481 -9.667 1.852 -10.870 1.00 0.00 H new ATOM 1490 N PRO B 482 -14.492 1.517 -8.983 1.00 0.00 N ATOM 1491 CA PRO B 482 -15.920 1.255 -9.042 1.00 0.00 C ATOM 1492 C PRO B 482 -16.640 2.324 -9.866 1.00 0.00 C ATOM 1493 O PRO B 482 -17.518 3.019 -9.357 1.00 0.00 O ATOM 1494 CB PRO B 482 -16.374 1.218 -7.591 1.00 0.00 C ATOM 1495 CG PRO B 482 -15.284 1.918 -6.796 1.00 0.00 C ATOM 1496 CD PRO B 482 -14.062 2.046 -7.691 1.00 0.00 C ATOM 0 HA PRO B 482 -16.155 0.316 -9.543 1.00 0.00 H new ATOM 0 HB2 PRO B 482 -17.332 1.723 -7.468 1.00 0.00 H new ATOM 0 HB3 PRO B 482 -16.508 0.192 -7.250 1.00 0.00 H new ATOM 0 HG2 PRO B 482 -15.622 2.901 -6.469 1.00 0.00 H new ATOM 0 HG3 PRO B 482 -15.042 1.349 -5.898 1.00 0.00 H new ATOM 0 HD2 PRO B 482 -13.740 3.084 -7.775 1.00 0.00 H new ATOM 0 HD3 PRO B 482 -13.219 1.482 -7.293 1.00 0.00 H new