USER MOD reduce.3.24.130724 H: found=0, std=0, add=594, rem=0, adj=13 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 Set 1.1: B 462 GLN : amide:sc= -0.657 K(o=-0.62,f=-3.1!) USER MOD Set 1.2: B 465 LYS NZ :NH3+ -131:sc= 0.038 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : B 411 MET CE :methyl 137:sc= -1.69 (180deg=-3.86!) USER MOD Single : B 413 LYS NZ :NH3+ -178:sc= -2.15 (180deg=-2.21) USER MOD Single : B 415 GLN : amide:sc= -3.03 K(o=-3,f=-0.47) USER MOD Single : B 417 GLN : amide:sc= -2.49 X(o=-2.5,f=-2.6) USER MOD Single : B 418 HIS : no HD1:sc= -0.851 X(o=-0.85,f=-0.36) USER MOD Single : B 420 TYR OH : rot 180:sc= -0.0619 USER MOD Single : B 421 THR OG1 : rot 180:sc= 0 USER MOD Single : B 423 THR OG1 : rot 53:sc= 0.393 USER MOD Single : B 425 THR OG1 : rot -28:sc= 0.0391 USER MOD Single : B 429 GLN : amide:sc= 0.22 X(o=0.22,f=-0.024) USER MOD Single : B 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 453 MET CE :methyl -105:sc= -3.27! (180deg=-7.05!) USER MOD Single : B 456 LYS NZ :NH3+ -108:sc= -0.236 (180deg=-1.41) USER MOD Single : B 458 SER OG : rot 180:sc= 0 USER MOD Single : B 461 ASN : amide:sc=-0.00691 X(o=-0.0069,f=0) USER MOD Single : B 463 HIS : no HD1:sc= -0.0318 X(o=-0.032,f=-0.089) USER MOD Single : B 464 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 -56:sc= -4.35! USER MOD Single : B 476 ASN : amide:sc= -0.94 X(o=-0.94,f=-1.2) USER MOD Single : B 478 THR OG1 : rot -87:sc= -0.621 USER MOD ----------------------------------------------------------------- ATOM 67 N PRO A 59 1.578 -6.873 -10.014 1.00 0.00 N ATOM 68 CA PRO A 59 1.948 -8.207 -10.453 1.00 0.00 C ATOM 69 C PRO A 59 2.451 -8.189 -11.898 1.00 0.00 C ATOM 70 O PRO A 59 2.376 -7.164 -12.572 1.00 0.00 O ATOM 71 CB PRO A 59 0.692 -9.044 -10.271 1.00 0.00 C ATOM 72 CG PRO A 59 -0.458 -8.054 -10.180 1.00 0.00 C ATOM 73 CD PRO A 59 0.133 -6.672 -9.954 1.00 0.00 C ATOM 0 HA PRO A 59 2.775 -8.625 -9.879 1.00 0.00 H new ATOM 0 HB2 PRO A 59 0.553 -9.728 -11.108 1.00 0.00 H new ATOM 0 HB3 PRO A 59 0.756 -9.653 -9.369 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -1.050 -8.071 -11.095 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -1.128 -8.321 -9.363 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.201 -5.969 -10.717 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -0.170 -6.264 -8.990 1.00 0.00 H new ATOM 81 N PRO A 60 2.966 -9.367 -12.342 1.00 0.00 N ATOM 82 CA PRO A 60 3.480 -9.497 -13.694 1.00 0.00 C ATOM 83 C PRO A 60 2.339 -9.573 -14.710 1.00 0.00 C ATOM 84 O PRO A 60 1.198 -9.854 -14.347 1.00 0.00 O ATOM 85 CB PRO A 60 4.339 -10.751 -13.670 1.00 0.00 C ATOM 86 CG PRO A 60 3.904 -11.530 -12.440 1.00 0.00 C ATOM 87 CD PRO A 60 3.072 -10.602 -11.570 1.00 0.00 C ATOM 0 HA PRO A 60 4.068 -8.634 -14.005 1.00 0.00 H new ATOM 0 HB2 PRO A 60 4.196 -11.340 -14.576 1.00 0.00 H new ATOM 0 HB3 PRO A 60 5.398 -10.498 -13.618 1.00 0.00 H new ATOM 0 HG2 PRO A 60 3.323 -12.406 -12.729 1.00 0.00 H new ATOM 0 HG3 PRO A 60 4.773 -11.891 -11.890 1.00 0.00 H new ATOM 0 HD2 PRO A 60 2.089 -11.027 -11.365 1.00 0.00 H new ATOM 0 HD3 PRO A 60 3.551 -10.427 -10.607 1.00 0.00 H new ATOM 95 N LEU A 61 2.686 -9.318 -15.963 1.00 0.00 N ATOM 96 CA LEU A 61 1.705 -9.354 -17.034 1.00 0.00 C ATOM 97 C LEU A 61 1.087 -10.751 -17.106 1.00 0.00 C ATOM 98 O LEU A 61 1.803 -11.751 -17.130 1.00 0.00 O ATOM 99 CB LEU A 61 2.331 -8.889 -18.350 1.00 0.00 C ATOM 100 CG LEU A 61 1.669 -7.683 -19.019 1.00 0.00 C ATOM 101 CD1 LEU A 61 0.205 -7.977 -19.356 1.00 0.00 C ATOM 102 CD2 LEU A 61 1.817 -6.428 -18.157 1.00 0.00 C ATOM 0 H LEU A 61 3.634 -9.085 -16.261 1.00 0.00 H new ATOM 0 HA LEU A 61 0.893 -8.656 -16.831 1.00 0.00 H new ATOM 0 HB2 LEU A 61 3.378 -8.648 -18.166 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.315 -9.723 -19.052 1.00 0.00 H new ATOM 0 HG LEU A 61 2.184 -7.490 -19.960 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -0.242 -7.103 -19.831 1.00 0.00 H new ATOM 0 HD12 LEU A 61 0.152 -8.827 -20.037 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -0.339 -8.211 -18.441 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.338 -5.586 -18.656 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.344 -6.594 -17.189 1.00 0.00 H new ATOM 0 HD23 LEU A 61 2.875 -6.209 -18.011 1.00 0.00 H new ATOM 114 N SER A 62 -0.238 -10.777 -17.139 1.00 0.00 N ATOM 115 CA SER A 62 -0.960 -12.036 -17.209 1.00 0.00 C ATOM 116 C SER A 62 -1.232 -12.403 -18.669 1.00 0.00 C ATOM 117 O SER A 62 -1.227 -11.536 -19.542 1.00 0.00 O ATOM 118 CB SER A 62 -2.274 -11.961 -16.428 1.00 0.00 C ATOM 119 OG SER A 62 -3.273 -11.230 -17.133 1.00 0.00 O ATOM 0 H SER A 62 -0.830 -9.946 -17.119 1.00 0.00 H new ATOM 0 HA SER A 62 -0.342 -12.810 -16.755 1.00 0.00 H new ATOM 0 HB2 SER A 62 -2.636 -12.970 -16.229 1.00 0.00 H new ATOM 0 HB3 SER A 62 -2.095 -11.490 -15.461 1.00 0.00 H new ATOM 0 HG SER A 62 -4.097 -11.206 -16.602 1.00 0.00 H new ATOM 125 N PRO A 63 -1.468 -13.723 -18.896 1.00 0.00 N ATOM 126 CA PRO A 63 -1.741 -14.215 -20.235 1.00 0.00 C ATOM 127 C PRO A 63 -3.160 -13.851 -20.675 1.00 0.00 C ATOM 128 O PRO A 63 -3.950 -13.345 -19.879 1.00 0.00 O ATOM 129 CB PRO A 63 -1.510 -15.716 -20.157 1.00 0.00 C ATOM 130 CG PRO A 63 -1.571 -16.071 -18.681 1.00 0.00 C ATOM 131 CD PRO A 63 -1.481 -14.778 -17.886 1.00 0.00 C ATOM 0 HA PRO A 63 -1.095 -13.764 -20.988 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -2.270 -16.258 -20.721 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -0.544 -15.985 -20.584 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -2.499 -16.596 -18.453 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -0.753 -16.740 -18.415 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -2.329 -14.669 -17.210 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -0.580 -14.751 -17.274 1.00 0.00 H new ATOM 279 N LEU B 406 -28.769 -11.461 -9.576 1.00 0.00 N ATOM 280 CA LEU B 406 -27.343 -11.497 -9.299 1.00 0.00 C ATOM 281 C LEU B 406 -26.705 -12.649 -10.076 1.00 0.00 C ATOM 282 O LEU B 406 -27.395 -13.578 -10.494 1.00 0.00 O ATOM 283 CB LEU B 406 -27.091 -11.559 -7.791 1.00 0.00 C ATOM 284 CG LEU B 406 -26.600 -12.902 -7.247 1.00 0.00 C ATOM 285 CD1 LEU B 406 -25.875 -12.721 -5.912 1.00 0.00 C ATOM 286 CD2 LEU B 406 -27.751 -13.905 -7.144 1.00 0.00 C ATOM 0 HA LEU B 406 -26.866 -10.579 -9.641 1.00 0.00 H new ATOM 0 HB2 LEU B 406 -26.357 -10.795 -7.534 1.00 0.00 H new ATOM 0 HB3 LEU B 406 -28.016 -11.298 -7.277 1.00 0.00 H new ATOM 0 HG LEU B 406 -25.877 -13.313 -7.952 1.00 0.00 H new ATOM 0 HD11 LEU B 406 -25.536 -13.691 -5.547 1.00 0.00 H new ATOM 0 HD12 LEU B 406 -25.015 -12.065 -6.051 1.00 0.00 H new ATOM 0 HD13 LEU B 406 -26.556 -12.278 -5.185 1.00 0.00 H new ATOM 0 HD21 LEU B 406 -27.375 -14.851 -6.755 1.00 0.00 H new ATOM 0 HD22 LEU B 406 -28.515 -13.514 -6.472 1.00 0.00 H new ATOM 0 HD23 LEU B 406 -28.184 -14.065 -8.132 1.00 0.00 H new ATOM 298 N PRO B 407 -25.360 -12.549 -10.252 1.00 0.00 N ATOM 299 CA PRO B 407 -24.621 -13.573 -10.973 1.00 0.00 C ATOM 300 C PRO B 407 -24.451 -14.830 -10.118 1.00 0.00 C ATOM 301 O PRO B 407 -24.111 -14.742 -8.939 1.00 0.00 O ATOM 302 CB PRO B 407 -23.299 -12.919 -11.338 1.00 0.00 C ATOM 303 CG PRO B 407 -23.157 -11.720 -10.414 1.00 0.00 C ATOM 304 CD PRO B 407 -24.510 -11.464 -9.772 1.00 0.00 C ATOM 0 HA PRO B 407 -25.140 -13.917 -11.868 1.00 0.00 H new ATOM 0 HB2 PRO B 407 -22.470 -13.614 -11.206 1.00 0.00 H new ATOM 0 HB3 PRO B 407 -23.292 -12.610 -12.383 1.00 0.00 H new ATOM 0 HG2 PRO B 407 -22.403 -11.913 -9.651 1.00 0.00 H new ATOM 0 HG3 PRO B 407 -22.828 -10.844 -10.973 1.00 0.00 H new ATOM 0 HD2 PRO B 407 -24.439 -11.468 -8.684 1.00 0.00 H new ATOM 0 HD3 PRO B 407 -24.908 -10.492 -10.062 1.00 0.00 H new ATOM 312 N PRO B 408 -24.701 -16.001 -10.762 1.00 0.00 N ATOM 313 CA PRO B 408 -24.578 -17.275 -10.074 1.00 0.00 C ATOM 314 C PRO B 408 -23.109 -17.655 -9.882 1.00 0.00 C ATOM 315 O PRO B 408 -22.279 -17.397 -10.752 1.00 0.00 O ATOM 316 CB PRO B 408 -25.340 -18.265 -10.940 1.00 0.00 C ATOM 317 CG PRO B 408 -25.464 -17.613 -12.307 1.00 0.00 C ATOM 318 CD PRO B 408 -25.107 -16.143 -12.157 1.00 0.00 C ATOM 0 HA PRO B 408 -24.990 -17.250 -9.065 1.00 0.00 H new ATOM 0 HB2 PRO B 408 -24.809 -19.215 -11.007 1.00 0.00 H new ATOM 0 HB3 PRO B 408 -26.322 -18.478 -10.518 1.00 0.00 H new ATOM 0 HG2 PRO B 408 -24.798 -18.096 -13.022 1.00 0.00 H new ATOM 0 HG3 PRO B 408 -26.478 -17.722 -12.691 1.00 0.00 H new ATOM 0 HD2 PRO B 408 -24.302 -15.860 -12.835 1.00 0.00 H new ATOM 0 HD3 PRO B 408 -25.958 -15.503 -12.389 1.00 0.00 H new ATOM 326 N GLY B 409 -22.832 -18.262 -8.737 1.00 0.00 N ATOM 327 CA GLY B 409 -21.478 -18.680 -8.420 1.00 0.00 C ATOM 328 C GLY B 409 -20.711 -17.562 -7.710 1.00 0.00 C ATOM 329 O GLY B 409 -19.735 -17.823 -7.007 1.00 0.00 O ATOM 0 H GLY B 409 -23.523 -18.474 -8.017 1.00 0.00 H new ATOM 0 HA2 GLY B 409 -21.506 -19.566 -7.786 1.00 0.00 H new ATOM 0 HA3 GLY B 409 -20.956 -18.960 -9.335 1.00 0.00 H new ATOM 333 N PHE B 410 -21.181 -16.341 -7.918 1.00 0.00 N ATOM 334 CA PHE B 410 -20.551 -15.183 -7.307 1.00 0.00 C ATOM 335 C PHE B 410 -20.038 -15.513 -5.904 1.00 0.00 C ATOM 336 O PHE B 410 -20.638 -16.320 -5.194 1.00 0.00 O ATOM 337 CB PHE B 410 -21.622 -14.095 -7.202 1.00 0.00 C ATOM 338 CG PHE B 410 -21.326 -13.030 -6.145 1.00 0.00 C ATOM 339 CD1 PHE B 410 -20.465 -12.015 -6.424 1.00 0.00 C ATOM 340 CD2 PHE B 410 -21.924 -13.098 -4.925 1.00 0.00 C ATOM 341 CE1 PHE B 410 -20.190 -11.026 -5.443 1.00 0.00 C ATOM 342 CE2 PHE B 410 -21.650 -12.109 -3.944 1.00 0.00 C ATOM 343 CZ PHE B 410 -20.788 -11.094 -4.223 1.00 0.00 C ATOM 0 H PHE B 410 -21.991 -16.128 -8.501 1.00 0.00 H new ATOM 0 HA PHE B 410 -19.701 -14.862 -7.909 1.00 0.00 H new ATOM 0 HB2 PHE B 410 -21.728 -13.610 -8.172 1.00 0.00 H new ATOM 0 HB3 PHE B 410 -22.579 -14.563 -6.973 1.00 0.00 H new ATOM 0 HD1 PHE B 410 -19.990 -11.961 -7.392 1.00 0.00 H new ATOM 0 HD2 PHE B 410 -22.607 -13.904 -4.703 1.00 0.00 H new ATOM 0 HE1 PHE B 410 -19.506 -10.220 -5.665 1.00 0.00 H new ATOM 0 HE2 PHE B 410 -22.126 -12.162 -2.976 1.00 0.00 H new ATOM 0 HZ PHE B 410 -20.579 -10.343 -3.476 1.00 0.00 H new ATOM 353 N MET B 411 -18.934 -14.874 -5.547 1.00 0.00 N ATOM 354 CA MET B 411 -18.335 -15.090 -4.241 1.00 0.00 C ATOM 355 C MET B 411 -18.588 -13.896 -3.317 1.00 0.00 C ATOM 356 O MET B 411 -19.367 -13.994 -2.370 1.00 0.00 O ATOM 357 CB MET B 411 -16.828 -15.302 -4.400 1.00 0.00 C ATOM 358 CG MET B 411 -16.535 -16.480 -5.331 1.00 0.00 C ATOM 359 SD MET B 411 -14.841 -17.008 -5.134 1.00 0.00 S ATOM 360 CE MET B 411 -14.329 -17.048 -6.843 1.00 0.00 C ATOM 0 H MET B 411 -18.439 -14.207 -6.139 1.00 0.00 H new ATOM 0 HA MET B 411 -18.791 -15.974 -3.794 1.00 0.00 H new ATOM 0 HB2 MET B 411 -16.370 -14.397 -4.798 1.00 0.00 H new ATOM 0 HB3 MET B 411 -16.378 -15.484 -3.424 1.00 0.00 H new ATOM 0 HG2 MET B 411 -17.210 -17.306 -5.109 1.00 0.00 H new ATOM 0 HG3 MET B 411 -16.716 -16.190 -6.366 1.00 0.00 H new ATOM 0 HE1 MET B 411 -13.335 -16.610 -6.935 1.00 0.00 H new ATOM 0 HE2 MET B 411 -14.304 -18.081 -7.191 1.00 0.00 H new ATOM 0 HE3 MET B 411 -15.035 -16.478 -7.448 1.00 0.00 H new ATOM 370 N PHE B 412 -17.915 -12.797 -3.625 1.00 0.00 N ATOM 371 CA PHE B 412 -18.056 -11.587 -2.834 1.00 0.00 C ATOM 372 C PHE B 412 -17.597 -10.359 -3.623 1.00 0.00 C ATOM 373 O PHE B 412 -17.170 -10.478 -4.771 1.00 0.00 O ATOM 374 CB PHE B 412 -17.162 -11.751 -1.603 1.00 0.00 C ATOM 375 CG PHE B 412 -15.756 -12.263 -1.919 1.00 0.00 C ATOM 376 CD1 PHE B 412 -14.805 -11.404 -2.374 1.00 0.00 C ATOM 377 CD2 PHE B 412 -15.456 -13.578 -1.745 1.00 0.00 C ATOM 378 CE1 PHE B 412 -13.499 -11.880 -2.667 1.00 0.00 C ATOM 379 CE2 PHE B 412 -14.151 -14.054 -2.038 1.00 0.00 C ATOM 380 CZ PHE B 412 -13.200 -13.195 -2.493 1.00 0.00 C ATOM 0 H PHE B 412 -17.270 -12.720 -4.412 1.00 0.00 H new ATOM 0 HA PHE B 412 -19.101 -11.440 -2.562 1.00 0.00 H new ATOM 0 HB2 PHE B 412 -17.082 -10.790 -1.094 1.00 0.00 H new ATOM 0 HB3 PHE B 412 -17.641 -12.441 -0.908 1.00 0.00 H new ATOM 0 HD1 PHE B 412 -15.043 -10.360 -2.513 1.00 0.00 H new ATOM 0 HD2 PHE B 412 -16.211 -14.261 -1.384 1.00 0.00 H new ATOM 0 HE1 PHE B 412 -12.744 -11.198 -3.028 1.00 0.00 H new ATOM 0 HE2 PHE B 412 -13.913 -15.098 -1.900 1.00 0.00 H new ATOM 0 HZ PHE B 412 -12.207 -13.557 -2.716 1.00 0.00 H new ATOM 390 N LYS B 413 -17.701 -9.207 -2.977 1.00 0.00 N ATOM 391 CA LYS B 413 -17.302 -7.959 -3.604 1.00 0.00 C ATOM 392 C LYS B 413 -15.895 -7.584 -3.136 1.00 0.00 C ATOM 393 O LYS B 413 -15.530 -7.840 -1.989 1.00 0.00 O ATOM 394 CB LYS B 413 -18.347 -6.871 -3.345 1.00 0.00 C ATOM 395 CG LYS B 413 -18.264 -5.768 -4.402 1.00 0.00 C ATOM 396 CD LYS B 413 -18.285 -4.383 -3.752 1.00 0.00 C ATOM 397 CE LYS B 413 -16.866 -3.839 -3.574 1.00 0.00 C ATOM 398 NZ LYS B 413 -16.831 -2.823 -2.499 1.00 0.00 N ATOM 0 H LYS B 413 -18.056 -9.112 -2.025 1.00 0.00 H new ATOM 0 HA LYS B 413 -17.257 -8.075 -4.687 1.00 0.00 H new ATOM 0 HB2 LYS B 413 -19.344 -7.311 -3.351 1.00 0.00 H new ATOM 0 HB3 LYS B 413 -18.193 -6.443 -2.355 1.00 0.00 H new ATOM 0 HG2 LYS B 413 -17.351 -5.886 -4.985 1.00 0.00 H new ATOM 0 HG3 LYS B 413 -19.099 -5.861 -5.096 1.00 0.00 H new ATOM 0 HD2 LYS B 413 -18.867 -3.697 -4.368 1.00 0.00 H new ATOM 0 HD3 LYS B 413 -18.781 -4.440 -2.783 1.00 0.00 H new ATOM 0 HE2 LYS B 413 -16.185 -4.655 -3.333 1.00 0.00 H new ATOM 0 HE3 LYS B 413 -16.519 -3.400 -4.509 1.00 0.00 H new ATOM 0 HZ1 LYS B 413 -15.868 -2.440 -2.415 1.00 0.00 H new ATOM 0 HZ2 LYS B 413 -17.491 -2.053 -2.728 1.00 0.00 H new ATOM 0 HZ3 LYS B 413 -17.109 -3.261 -1.598 1.00 0.00 H new ATOM 412 N VAL B 414 -15.143 -6.984 -4.046 1.00 0.00 N ATOM 413 CA VAL B 414 -13.783 -6.572 -3.741 1.00 0.00 C ATOM 414 C VAL B 414 -13.623 -5.083 -4.050 1.00 0.00 C ATOM 415 O VAL B 414 -14.477 -4.486 -4.706 1.00 0.00 O ATOM 416 CB VAL B 414 -12.787 -7.451 -4.502 1.00 0.00 C ATOM 417 CG1 VAL B 414 -13.187 -8.926 -4.425 1.00 0.00 C ATOM 418 CG2 VAL B 414 -12.653 -6.994 -5.956 1.00 0.00 C ATOM 0 H VAL B 414 -15.449 -6.773 -4.996 1.00 0.00 H new ATOM 0 HA VAL B 414 -13.572 -6.708 -2.680 1.00 0.00 H new ATOM 0 HB VAL B 414 -11.812 -7.343 -4.026 1.00 0.00 H new ATOM 0 HG11 VAL B 414 -12.463 -9.528 -4.974 1.00 0.00 H new ATOM 0 HG12 VAL B 414 -13.207 -9.243 -3.382 1.00 0.00 H new ATOM 0 HG13 VAL B 414 -14.176 -9.058 -4.864 1.00 0.00 H new ATOM 0 HG21 VAL B 414 -11.940 -7.635 -6.475 1.00 0.00 H new ATOM 0 HG22 VAL B 414 -13.623 -7.058 -6.448 1.00 0.00 H new ATOM 0 HG23 VAL B 414 -12.300 -5.963 -5.982 1.00 0.00 H new ATOM 428 N GLN B 415 -12.525 -4.524 -3.564 1.00 0.00 N ATOM 429 CA GLN B 415 -12.243 -3.115 -3.781 1.00 0.00 C ATOM 430 C GLN B 415 -10.788 -2.926 -4.216 1.00 0.00 C ATOM 431 O GLN B 415 -9.866 -3.313 -3.499 1.00 0.00 O ATOM 432 CB GLN B 415 -12.550 -2.295 -2.527 1.00 0.00 C ATOM 433 CG GLN B 415 -12.063 -0.853 -2.681 1.00 0.00 C ATOM 434 CD GLN B 415 -13.235 0.100 -2.921 1.00 0.00 C ATOM 435 OE1 GLN B 415 -14.128 0.245 -2.102 1.00 0.00 O ATOM 436 NE2 GLN B 415 -13.184 0.738 -4.086 1.00 0.00 N ATOM 0 H GLN B 415 -11.820 -5.021 -3.020 1.00 0.00 H new ATOM 0 HA GLN B 415 -12.891 -2.754 -4.579 1.00 0.00 H new ATOM 0 HB2 GLN B 415 -13.623 -2.302 -2.338 1.00 0.00 H new ATOM 0 HB3 GLN B 415 -12.071 -2.754 -1.662 1.00 0.00 H new ATOM 0 HG2 GLN B 415 -11.522 -0.551 -1.784 1.00 0.00 H new ATOM 0 HG3 GLN B 415 -11.362 -0.789 -3.513 1.00 0.00 H new ATOM 0 HE21 GLN B 415 -12.408 0.570 -4.726 1.00 0.00 H new ATOM 0 HE22 GLN B 415 -13.921 1.395 -4.340 1.00 0.00 H new ATOM 445 N ALA B 416 -10.627 -2.331 -5.389 1.00 0.00 N ATOM 446 CA ALA B 416 -9.301 -2.086 -5.929 1.00 0.00 C ATOM 447 C ALA B 416 -8.600 -1.021 -5.083 1.00 0.00 C ATOM 448 O ALA B 416 -9.254 -0.170 -4.483 1.00 0.00 O ATOM 449 CB ALA B 416 -9.414 -1.680 -7.399 1.00 0.00 C ATOM 0 H ALA B 416 -11.394 -2.011 -5.981 1.00 0.00 H new ATOM 0 HA ALA B 416 -8.697 -2.992 -5.887 1.00 0.00 H new ATOM 0 HB1 ALA B 416 -8.419 -1.496 -7.803 1.00 0.00 H new ATOM 0 HB2 ALA B 416 -9.892 -2.481 -7.962 1.00 0.00 H new ATOM 0 HB3 ALA B 416 -10.012 -0.772 -7.481 1.00 0.00 H new ATOM 455 N GLN B 417 -7.277 -1.104 -5.062 1.00 0.00 N ATOM 456 CA GLN B 417 -6.480 -0.158 -4.299 1.00 0.00 C ATOM 457 C GLN B 417 -5.509 0.582 -5.222 1.00 0.00 C ATOM 458 O GLN B 417 -4.750 1.438 -4.770 1.00 0.00 O ATOM 459 CB GLN B 417 -5.732 -0.860 -3.165 1.00 0.00 C ATOM 460 CG GLN B 417 -6.521 -2.066 -2.651 1.00 0.00 C ATOM 461 CD GLN B 417 -5.874 -2.649 -1.393 1.00 0.00 C ATOM 462 OE1 GLN B 417 -5.673 -1.975 -0.397 1.00 0.00 O ATOM 463 NE2 GLN B 417 -5.560 -3.938 -1.495 1.00 0.00 N ATOM 0 H GLN B 417 -6.738 -1.811 -5.561 1.00 0.00 H new ATOM 0 HA GLN B 417 -7.151 0.573 -3.848 1.00 0.00 H new ATOM 0 HB2 GLN B 417 -4.753 -1.185 -3.517 1.00 0.00 H new ATOM 0 HB3 GLN B 417 -5.561 -0.158 -2.349 1.00 0.00 H new ATOM 0 HG2 GLN B 417 -7.546 -1.768 -2.432 1.00 0.00 H new ATOM 0 HG3 GLN B 417 -6.570 -2.830 -3.427 1.00 0.00 H new ATOM 0 HE21 GLN B 417 -5.756 -4.444 -2.359 1.00 0.00 H new ATOM 0 HE22 GLN B 417 -5.123 -4.420 -0.709 1.00 0.00 H new ATOM 472 N HIS B 418 -5.565 0.225 -6.496 1.00 0.00 N ATOM 473 CA HIS B 418 -4.701 0.845 -7.486 1.00 0.00 C ATOM 474 C HIS B 418 -5.443 0.957 -8.819 1.00 0.00 C ATOM 475 O HIS B 418 -6.522 0.388 -8.982 1.00 0.00 O ATOM 476 CB HIS B 418 -3.379 0.084 -7.605 1.00 0.00 C ATOM 477 CG HIS B 418 -2.531 0.125 -6.356 1.00 0.00 C ATOM 478 ND1 HIS B 418 -1.511 1.041 -6.172 1.00 0.00 N ATOM 479 CD2 HIS B 418 -2.565 -0.646 -5.231 1.00 0.00 C ATOM 480 CE1 HIS B 418 -0.961 0.822 -4.987 1.00 0.00 C ATOM 481 NE2 HIS B 418 -1.615 -0.224 -4.405 1.00 0.00 N ATOM 0 H HIS B 418 -6.196 -0.486 -6.866 1.00 0.00 H new ATOM 0 HA HIS B 418 -4.445 1.856 -7.168 1.00 0.00 H new ATOM 0 HB2 HIS B 418 -3.591 -0.956 -7.853 1.00 0.00 H new ATOM 0 HB3 HIS B 418 -2.806 0.499 -8.434 1.00 0.00 H new ATOM 0 HD2 HIS B 418 -3.248 -1.461 -5.044 1.00 0.00 H new ATOM 0 HE1 HIS B 418 -0.139 1.375 -4.557 1.00 0.00 H new ATOM 0 HE2 HIS B 418 -1.408 -0.617 -3.487 1.00 0.00 H new ATOM 489 N ASP B 419 -4.836 1.693 -9.738 1.00 0.00 N ATOM 490 CA ASP B 419 -5.427 1.886 -11.052 1.00 0.00 C ATOM 491 C ASP B 419 -4.609 1.117 -12.091 1.00 0.00 C ATOM 492 O ASP B 419 -3.527 1.553 -12.482 1.00 0.00 O ATOM 493 CB ASP B 419 -5.422 3.364 -11.446 1.00 0.00 C ATOM 494 CG ASP B 419 -4.334 4.208 -10.778 1.00 0.00 C ATOM 495 OD1 ASP B 419 -4.514 4.522 -9.582 1.00 0.00 O ATOM 496 OD2 ASP B 419 -3.348 4.520 -11.480 1.00 0.00 O ATOM 0 H ASP B 419 -3.941 2.163 -9.599 1.00 0.00 H new ATOM 0 HA ASP B 419 -6.455 1.526 -11.016 1.00 0.00 H new ATOM 0 HB2 ASP B 419 -5.304 3.436 -12.527 1.00 0.00 H new ATOM 0 HB3 ASP B 419 -6.394 3.793 -11.202 1.00 0.00 H new ATOM 501 N TYR B 420 -5.157 -0.014 -12.510 1.00 0.00 N ATOM 502 CA TYR B 420 -4.492 -0.848 -13.496 1.00 0.00 C ATOM 503 C TYR B 420 -5.303 -0.919 -14.791 1.00 0.00 C ATOM 504 O TYR B 420 -6.367 -1.535 -14.829 1.00 0.00 O ATOM 505 CB TYR B 420 -4.412 -2.247 -12.881 1.00 0.00 C ATOM 506 CG TYR B 420 -4.463 -3.382 -13.906 1.00 0.00 C ATOM 507 CD1 TYR B 420 -3.391 -3.597 -14.749 1.00 0.00 C ATOM 508 CD2 TYR B 420 -5.579 -4.189 -13.988 1.00 0.00 C ATOM 509 CE1 TYR B 420 -3.439 -4.665 -15.714 1.00 0.00 C ATOM 510 CE2 TYR B 420 -5.626 -5.257 -14.953 1.00 0.00 C ATOM 511 CZ TYR B 420 -4.553 -5.442 -15.768 1.00 0.00 C ATOM 512 OH TYR B 420 -4.598 -6.451 -16.680 1.00 0.00 O ATOM 0 H TYR B 420 -6.055 -0.372 -12.184 1.00 0.00 H new ATOM 0 HA TYR B 420 -3.510 -0.443 -13.742 1.00 0.00 H new ATOM 0 HB2 TYR B 420 -3.488 -2.329 -12.309 1.00 0.00 H new ATOM 0 HB3 TYR B 420 -5.234 -2.370 -12.176 1.00 0.00 H new ATOM 0 HD1 TYR B 420 -2.518 -2.965 -14.685 1.00 0.00 H new ATOM 0 HD2 TYR B 420 -6.417 -4.020 -13.329 1.00 0.00 H new ATOM 0 HE1 TYR B 420 -2.608 -4.845 -16.380 1.00 0.00 H new ATOM 0 HE2 TYR B 420 -6.493 -5.896 -15.028 1.00 0.00 H new ATOM 0 HH TYR B 420 -5.453 -6.923 -16.604 1.00 0.00 H new ATOM 522 N THR B 421 -4.769 -0.280 -15.822 1.00 0.00 N ATOM 523 CA THR B 421 -5.430 -0.263 -17.116 1.00 0.00 C ATOM 524 C THR B 421 -5.200 -1.586 -17.849 1.00 0.00 C ATOM 525 O THR B 421 -4.074 -1.900 -18.233 1.00 0.00 O ATOM 526 CB THR B 421 -4.924 0.956 -17.890 1.00 0.00 C ATOM 527 OG1 THR B 421 -5.564 2.060 -17.256 1.00 0.00 O ATOM 528 CG2 THR B 421 -5.447 0.996 -19.327 1.00 0.00 C ATOM 0 H THR B 421 -3.886 0.230 -15.787 1.00 0.00 H new ATOM 0 HA THR B 421 -6.511 -0.171 -17.007 1.00 0.00 H new ATOM 0 HB THR B 421 -3.834 0.952 -17.901 1.00 0.00 H new ATOM 0 HG1 THR B 421 -5.290 2.893 -17.694 1.00 0.00 H new ATOM 0 HG21 THR B 421 -5.058 1.881 -19.831 1.00 0.00 H new ATOM 0 HG22 THR B 421 -5.120 0.102 -19.858 1.00 0.00 H new ATOM 0 HG23 THR B 421 -6.536 1.034 -19.317 1.00 0.00 H new ATOM 536 N ALA B 422 -6.285 -2.327 -18.021 1.00 0.00 N ATOM 537 CA ALA B 422 -6.216 -3.609 -18.701 1.00 0.00 C ATOM 538 C ALA B 422 -6.967 -3.517 -20.031 1.00 0.00 C ATOM 539 O ALA B 422 -8.175 -3.288 -20.051 1.00 0.00 O ATOM 540 CB ALA B 422 -6.776 -4.702 -17.789 1.00 0.00 C ATOM 0 H ALA B 422 -7.217 -2.064 -17.701 1.00 0.00 H new ATOM 0 HA ALA B 422 -5.181 -3.870 -18.924 1.00 0.00 H new ATOM 0 HB1 ALA B 422 -6.724 -5.664 -18.299 1.00 0.00 H new ATOM 0 HB2 ALA B 422 -6.189 -4.746 -16.871 1.00 0.00 H new ATOM 0 HB3 ALA B 422 -7.814 -4.476 -17.545 1.00 0.00 H new ATOM 546 N THR B 423 -6.220 -3.702 -21.110 1.00 0.00 N ATOM 547 CA THR B 423 -6.800 -3.642 -22.441 1.00 0.00 C ATOM 548 C THR B 423 -6.612 -4.977 -23.165 1.00 0.00 C ATOM 549 O THR B 423 -5.585 -5.202 -23.803 1.00 0.00 O ATOM 550 CB THR B 423 -6.171 -2.457 -23.177 1.00 0.00 C ATOM 551 OG1 THR B 423 -4.770 -2.630 -22.981 1.00 0.00 O ATOM 552 CG2 THR B 423 -6.479 -1.118 -22.504 1.00 0.00 C ATOM 0 H THR B 423 -5.218 -3.893 -21.089 1.00 0.00 H new ATOM 0 HA THR B 423 -7.877 -3.481 -22.397 1.00 0.00 H new ATOM 0 HB THR B 423 -6.531 -2.437 -24.206 1.00 0.00 H new ATOM 0 HG1 THR B 423 -4.510 -3.533 -23.258 1.00 0.00 H new ATOM 0 HG21 THR B 423 -6.009 -0.311 -23.067 1.00 0.00 H new ATOM 0 HG22 THR B 423 -7.558 -0.963 -22.479 1.00 0.00 H new ATOM 0 HG23 THR B 423 -6.090 -1.125 -21.486 1.00 0.00 H new ATOM 560 N ASP B 424 -7.621 -5.827 -23.041 1.00 0.00 N ATOM 561 CA ASP B 424 -7.580 -7.134 -23.675 1.00 0.00 C ATOM 562 C ASP B 424 -8.972 -7.482 -24.206 1.00 0.00 C ATOM 563 O ASP B 424 -9.888 -6.664 -24.141 1.00 0.00 O ATOM 564 CB ASP B 424 -7.170 -8.218 -22.676 1.00 0.00 C ATOM 565 CG ASP B 424 -6.234 -9.291 -23.235 1.00 0.00 C ATOM 566 OD1 ASP B 424 -6.493 -9.732 -24.376 1.00 0.00 O ATOM 567 OD2 ASP B 424 -5.281 -9.647 -22.509 1.00 0.00 O ATOM 0 H ASP B 424 -8.471 -5.636 -22.511 1.00 0.00 H new ATOM 0 HA ASP B 424 -6.850 -7.094 -24.483 1.00 0.00 H new ATOM 0 HB2 ASP B 424 -6.684 -7.741 -21.824 1.00 0.00 H new ATOM 0 HB3 ASP B 424 -8.070 -8.703 -22.299 1.00 0.00 H new ATOM 572 N THR B 425 -9.087 -8.698 -24.719 1.00 0.00 N ATOM 573 CA THR B 425 -10.352 -9.165 -25.261 1.00 0.00 C ATOM 574 C THR B 425 -11.264 -9.658 -24.136 1.00 0.00 C ATOM 575 O THR B 425 -12.450 -9.900 -24.354 1.00 0.00 O ATOM 576 CB THR B 425 -10.051 -10.235 -26.312 1.00 0.00 C ATOM 577 OG1 THR B 425 -11.236 -10.291 -27.101 1.00 0.00 O ATOM 578 CG2 THR B 425 -9.940 -11.636 -25.706 1.00 0.00 C ATOM 0 H THR B 425 -8.325 -9.374 -24.771 1.00 0.00 H new ATOM 0 HA THR B 425 -10.896 -8.356 -25.748 1.00 0.00 H new ATOM 0 HB THR B 425 -9.122 -9.987 -26.826 1.00 0.00 H new ATOM 0 HG1 THR B 425 -12.006 -10.033 -26.553 1.00 0.00 H new ATOM 0 HG21 THR B 425 -9.726 -12.358 -26.494 1.00 0.00 H new ATOM 0 HG22 THR B 425 -9.135 -11.652 -24.971 1.00 0.00 H new ATOM 0 HG23 THR B 425 -10.880 -11.898 -25.220 1.00 0.00 H new ATOM 586 N ASP B 426 -10.676 -9.793 -22.956 1.00 0.00 N ATOM 587 CA ASP B 426 -11.420 -10.254 -21.797 1.00 0.00 C ATOM 588 C ASP B 426 -10.715 -9.784 -20.523 1.00 0.00 C ATOM 589 O ASP B 426 -10.644 -10.520 -19.541 1.00 0.00 O ATOM 590 CB ASP B 426 -11.491 -11.782 -21.761 1.00 0.00 C ATOM 591 CG ASP B 426 -12.599 -12.399 -22.617 1.00 0.00 C ATOM 592 OD1 ASP B 426 -13.753 -12.405 -22.134 1.00 0.00 O ATOM 593 OD2 ASP B 426 -12.268 -12.850 -23.735 1.00 0.00 O ATOM 0 H ASP B 426 -9.692 -9.591 -22.778 1.00 0.00 H new ATOM 0 HA ASP B 426 -12.429 -9.847 -21.860 1.00 0.00 H new ATOM 0 HB2 ASP B 426 -10.532 -12.183 -22.090 1.00 0.00 H new ATOM 0 HB3 ASP B 426 -11.631 -12.100 -20.728 1.00 0.00 H new ATOM 598 N GLU B 427 -10.212 -8.559 -20.581 1.00 0.00 N ATOM 599 CA GLU B 427 -9.516 -7.981 -19.445 1.00 0.00 C ATOM 600 C GLU B 427 -10.493 -7.199 -18.565 1.00 0.00 C ATOM 601 O GLU B 427 -11.584 -6.842 -19.009 1.00 0.00 O ATOM 602 CB GLU B 427 -8.359 -7.092 -19.905 1.00 0.00 C ATOM 603 CG GLU B 427 -7.018 -7.635 -19.406 1.00 0.00 C ATOM 604 CD GLU B 427 -6.927 -9.148 -19.617 1.00 0.00 C ATOM 605 OE1 GLU B 427 -7.766 -9.665 -20.385 1.00 0.00 O ATOM 606 OE2 GLU B 427 -6.019 -9.752 -19.007 1.00 0.00 O ATOM 0 H GLU B 427 -10.273 -7.951 -21.398 1.00 0.00 H new ATOM 0 HA GLU B 427 -9.094 -8.792 -18.852 1.00 0.00 H new ATOM 0 HB2 GLU B 427 -8.350 -7.035 -20.993 1.00 0.00 H new ATOM 0 HB3 GLU B 427 -8.505 -6.078 -19.534 1.00 0.00 H new ATOM 0 HG2 GLU B 427 -6.202 -7.141 -19.934 1.00 0.00 H new ATOM 0 HG3 GLU B 427 -6.899 -7.404 -18.347 1.00 0.00 H new ATOM 613 N LEU B 428 -10.067 -6.955 -17.335 1.00 0.00 N ATOM 614 CA LEU B 428 -10.892 -6.221 -16.389 1.00 0.00 C ATOM 615 C LEU B 428 -10.126 -4.990 -15.900 1.00 0.00 C ATOM 616 O LEU B 428 -9.117 -5.117 -15.207 1.00 0.00 O ATOM 617 CB LEU B 428 -11.362 -7.141 -15.262 1.00 0.00 C ATOM 618 CG LEU B 428 -12.639 -6.714 -14.535 1.00 0.00 C ATOM 619 CD1 LEU B 428 -13.848 -6.774 -15.471 1.00 0.00 C ATOM 620 CD2 LEU B 428 -12.853 -7.544 -13.268 1.00 0.00 C ATOM 0 H LEU B 428 -9.162 -7.252 -16.971 1.00 0.00 H new ATOM 0 HA LEU B 428 -11.799 -5.861 -16.874 1.00 0.00 H new ATOM 0 HB2 LEU B 428 -11.519 -8.137 -15.675 1.00 0.00 H new ATOM 0 HB3 LEU B 428 -10.560 -7.223 -14.528 1.00 0.00 H new ATOM 0 HG LEU B 428 -12.524 -5.676 -14.223 1.00 0.00 H new ATOM 0 HD11 LEU B 428 -14.743 -6.466 -14.930 1.00 0.00 H new ATOM 0 HD12 LEU B 428 -13.687 -6.105 -16.317 1.00 0.00 H new ATOM 0 HD13 LEU B 428 -13.977 -7.794 -15.834 1.00 0.00 H new ATOM 0 HD21 LEU B 428 -13.767 -7.220 -12.771 1.00 0.00 H new ATOM 0 HD22 LEU B 428 -12.938 -8.598 -13.533 1.00 0.00 H new ATOM 0 HD23 LEU B 428 -12.006 -7.407 -12.596 1.00 0.00 H new ATOM 632 N GLN B 429 -10.634 -3.827 -16.278 1.00 0.00 N ATOM 633 CA GLN B 429 -10.011 -2.574 -15.885 1.00 0.00 C ATOM 634 C GLN B 429 -10.373 -2.233 -14.438 1.00 0.00 C ATOM 635 O GLN B 429 -11.524 -2.382 -14.030 1.00 0.00 O ATOM 636 CB GLN B 429 -10.412 -1.442 -16.832 1.00 0.00 C ATOM 637 CG GLN B 429 -9.324 -0.368 -16.894 1.00 0.00 C ATOM 638 CD GLN B 429 -9.250 0.258 -18.288 1.00 0.00 C ATOM 639 OE1 GLN B 429 -9.445 1.448 -18.474 1.00 0.00 O ATOM 640 NE2 GLN B 429 -8.958 -0.608 -19.255 1.00 0.00 N ATOM 0 H GLN B 429 -11.471 -3.725 -16.853 1.00 0.00 H new ATOM 0 HA GLN B 429 -8.929 -2.692 -15.950 1.00 0.00 H new ATOM 0 HB2 GLN B 429 -10.589 -1.843 -17.830 1.00 0.00 H new ATOM 0 HB3 GLN B 429 -11.349 -0.997 -16.496 1.00 0.00 H new ATOM 0 HG2 GLN B 429 -9.529 0.406 -16.154 1.00 0.00 H new ATOM 0 HG3 GLN B 429 -8.360 -0.807 -16.637 1.00 0.00 H new ATOM 0 HE21 GLN B 429 -8.807 -1.591 -19.030 1.00 0.00 H new ATOM 0 HE22 GLN B 429 -8.886 -0.289 -20.221 1.00 0.00 H new ATOM 649 N LEU B 430 -9.369 -1.782 -13.701 1.00 0.00 N ATOM 650 CA LEU B 430 -9.566 -1.418 -12.309 1.00 0.00 C ATOM 651 C LEU B 430 -8.971 -0.031 -12.059 1.00 0.00 C ATOM 652 O LEU B 430 -7.940 0.318 -12.631 1.00 0.00 O ATOM 653 CB LEU B 430 -9.006 -2.503 -11.387 1.00 0.00 C ATOM 654 CG LEU B 430 -9.951 -3.662 -11.064 1.00 0.00 C ATOM 655 CD1 LEU B 430 -11.287 -3.148 -10.526 1.00 0.00 C ATOM 656 CD2 LEU B 430 -10.134 -4.574 -12.279 1.00 0.00 C ATOM 0 H LEU B 430 -8.416 -1.660 -14.042 1.00 0.00 H new ATOM 0 HA LEU B 430 -10.630 -1.355 -12.079 1.00 0.00 H new ATOM 0 HB2 LEU B 430 -8.105 -2.912 -11.845 1.00 0.00 H new ATOM 0 HB3 LEU B 430 -8.703 -2.035 -10.450 1.00 0.00 H new ATOM 0 HG LEU B 430 -9.498 -4.263 -10.275 1.00 0.00 H new ATOM 0 HD11 LEU B 430 -11.939 -3.993 -10.305 1.00 0.00 H new ATOM 0 HD12 LEU B 430 -11.116 -2.573 -9.616 1.00 0.00 H new ATOM 0 HD13 LEU B 430 -11.759 -2.511 -11.274 1.00 0.00 H new ATOM 0 HD21 LEU B 430 -10.810 -5.390 -12.023 1.00 0.00 H new ATOM 0 HD22 LEU B 430 -10.554 -4.000 -13.105 1.00 0.00 H new ATOM 0 HD23 LEU B 430 -9.168 -4.983 -12.576 1.00 0.00 H new ATOM 668 N LYS B 431 -9.647 0.723 -11.204 1.00 0.00 N ATOM 669 CA LYS B 431 -9.197 2.064 -10.871 1.00 0.00 C ATOM 670 C LYS B 431 -9.031 2.179 -9.354 1.00 0.00 C ATOM 671 O LYS B 431 -9.912 1.774 -8.597 1.00 0.00 O ATOM 672 CB LYS B 431 -10.142 3.110 -11.467 1.00 0.00 C ATOM 673 CG LYS B 431 -11.518 3.049 -10.801 1.00 0.00 C ATOM 674 CD LYS B 431 -12.457 2.115 -11.567 1.00 0.00 C ATOM 675 CE LYS B 431 -12.842 2.714 -12.921 1.00 0.00 C ATOM 676 NZ LYS B 431 -14.195 3.311 -12.857 1.00 0.00 N ATOM 0 H LYS B 431 -10.503 0.431 -10.732 1.00 0.00 H new ATOM 0 HA LYS B 431 -8.221 2.260 -11.315 1.00 0.00 H new ATOM 0 HB2 LYS B 431 -9.716 4.105 -11.339 1.00 0.00 H new ATOM 0 HB3 LYS B 431 -10.245 2.943 -12.539 1.00 0.00 H new ATOM 0 HG2 LYS B 431 -11.413 2.702 -9.773 1.00 0.00 H new ATOM 0 HG3 LYS B 431 -11.950 4.049 -10.758 1.00 0.00 H new ATOM 0 HD2 LYS B 431 -11.973 1.150 -11.717 1.00 0.00 H new ATOM 0 HD3 LYS B 431 -13.355 1.933 -10.977 1.00 0.00 H new ATOM 0 HE2 LYS B 431 -12.116 3.474 -13.209 1.00 0.00 H new ATOM 0 HE3 LYS B 431 -12.815 1.941 -13.689 1.00 0.00 H new ATOM 0 HZ1 LYS B 431 -14.441 3.713 -13.784 1.00 0.00 H new ATOM 0 HZ2 LYS B 431 -14.887 2.577 -12.603 1.00 0.00 H new ATOM 0 HZ3 LYS B 431 -14.209 4.063 -12.139 1.00 0.00 H new ATOM 690 N ALA B 432 -7.895 2.733 -8.956 1.00 0.00 N ATOM 691 CA ALA B 432 -7.602 2.907 -7.544 1.00 0.00 C ATOM 692 C ALA B 432 -8.880 3.319 -6.809 1.00 0.00 C ATOM 693 O ALA B 432 -9.241 4.495 -6.797 1.00 0.00 O ATOM 694 CB ALA B 432 -6.478 3.932 -7.378 1.00 0.00 C ATOM 0 H ALA B 432 -7.167 3.067 -9.587 1.00 0.00 H new ATOM 0 HA ALA B 432 -7.257 1.971 -7.106 1.00 0.00 H new ATOM 0 HB1 ALA B 432 -6.258 4.063 -6.318 1.00 0.00 H new ATOM 0 HB2 ALA B 432 -5.585 3.579 -7.893 1.00 0.00 H new ATOM 0 HB3 ALA B 432 -6.789 4.886 -7.804 1.00 0.00 H new ATOM 700 N GLY B 433 -9.528 2.329 -6.215 1.00 0.00 N ATOM 701 CA GLY B 433 -10.757 2.574 -5.480 1.00 0.00 C ATOM 702 C GLY B 433 -11.982 2.202 -6.318 1.00 0.00 C ATOM 703 O GLY B 433 -12.926 2.983 -6.426 1.00 0.00 O ATOM 0 H GLY B 433 -9.225 1.355 -6.227 1.00 0.00 H new ATOM 0 HA2 GLY B 433 -10.754 1.995 -4.557 1.00 0.00 H new ATOM 0 HA3 GLY B 433 -10.812 3.625 -5.196 1.00 0.00 H new ATOM 707 N ASP B 434 -11.927 1.008 -6.891 1.00 0.00 N ATOM 708 CA ASP B 434 -13.019 0.524 -7.718 1.00 0.00 C ATOM 709 C ASP B 434 -13.710 -0.643 -7.010 1.00 0.00 C ATOM 710 O ASP B 434 -13.206 -1.154 -6.011 1.00 0.00 O ATOM 711 CB ASP B 434 -12.506 0.020 -9.068 1.00 0.00 C ATOM 712 CG ASP B 434 -13.584 -0.524 -10.008 1.00 0.00 C ATOM 713 OD1 ASP B 434 -14.540 0.235 -10.274 1.00 0.00 O ATOM 714 OD2 ASP B 434 -13.427 -1.688 -10.438 1.00 0.00 O ATOM 0 H ASP B 434 -11.143 0.362 -6.799 1.00 0.00 H new ATOM 0 HA ASP B 434 -13.711 1.351 -7.881 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -11.986 0.836 -9.570 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -11.771 -0.765 -8.890 1.00 0.00 H new ATOM 719 N VAL B 435 -14.854 -1.030 -7.555 1.00 0.00 N ATOM 720 CA VAL B 435 -15.620 -2.127 -6.988 1.00 0.00 C ATOM 721 C VAL B 435 -15.703 -3.266 -8.007 1.00 0.00 C ATOM 722 O VAL B 435 -16.081 -3.047 -9.157 1.00 0.00 O ATOM 723 CB VAL B 435 -16.993 -1.628 -6.536 1.00 0.00 C ATOM 724 CG1 VAL B 435 -16.877 -0.778 -5.268 1.00 0.00 C ATOM 725 CG2 VAL B 435 -17.690 -0.851 -7.655 1.00 0.00 C ATOM 0 H VAL B 435 -15.269 -0.603 -8.383 1.00 0.00 H new ATOM 0 HA VAL B 435 -15.124 -2.520 -6.101 1.00 0.00 H new ATOM 0 HB VAL B 435 -17.605 -2.499 -6.301 1.00 0.00 H new ATOM 0 HG11 VAL B 435 -17.867 -0.436 -4.968 1.00 0.00 H new ATOM 0 HG12 VAL B 435 -16.442 -1.376 -4.468 1.00 0.00 H new ATOM 0 HG13 VAL B 435 -16.239 0.084 -5.465 1.00 0.00 H new ATOM 0 HG21 VAL B 435 -18.664 -0.507 -7.307 1.00 0.00 H new ATOM 0 HG22 VAL B 435 -17.081 0.008 -7.935 1.00 0.00 H new ATOM 0 HG23 VAL B 435 -17.822 -1.500 -8.521 1.00 0.00 H new ATOM 735 N VAL B 436 -15.344 -4.455 -7.548 1.00 0.00 N ATOM 736 CA VAL B 436 -15.375 -5.629 -8.405 1.00 0.00 C ATOM 737 C VAL B 436 -15.942 -6.813 -7.620 1.00 0.00 C ATOM 738 O VAL B 436 -15.763 -6.901 -6.406 1.00 0.00 O ATOM 739 CB VAL B 436 -13.980 -5.899 -8.971 1.00 0.00 C ATOM 740 CG1 VAL B 436 -13.875 -7.328 -9.510 1.00 0.00 C ATOM 741 CG2 VAL B 436 -13.620 -4.878 -10.052 1.00 0.00 C ATOM 0 H VAL B 436 -15.030 -4.632 -6.594 1.00 0.00 H new ATOM 0 HA VAL B 436 -16.031 -5.462 -9.259 1.00 0.00 H new ATOM 0 HB VAL B 436 -13.262 -5.793 -8.158 1.00 0.00 H new ATOM 0 HG11 VAL B 436 -12.874 -7.495 -9.907 1.00 0.00 H new ATOM 0 HG12 VAL B 436 -14.068 -8.036 -8.704 1.00 0.00 H new ATOM 0 HG13 VAL B 436 -14.608 -7.472 -10.303 1.00 0.00 H new ATOM 0 HG21 VAL B 436 -12.623 -5.093 -10.438 1.00 0.00 H new ATOM 0 HG22 VAL B 436 -14.344 -4.938 -10.864 1.00 0.00 H new ATOM 0 HG23 VAL B 436 -13.636 -3.875 -9.625 1.00 0.00 H new ATOM 751 N LEU B 437 -16.614 -7.695 -8.345 1.00 0.00 N ATOM 752 CA LEU B 437 -17.208 -8.871 -7.731 1.00 0.00 C ATOM 753 C LEU B 437 -16.422 -10.114 -8.152 1.00 0.00 C ATOM 754 O LEU B 437 -16.125 -10.295 -9.332 1.00 0.00 O ATOM 755 CB LEU B 437 -18.701 -8.948 -8.058 1.00 0.00 C ATOM 756 CG LEU B 437 -19.236 -7.878 -9.012 1.00 0.00 C ATOM 757 CD1 LEU B 437 -20.650 -8.220 -9.483 1.00 0.00 C ATOM 758 CD2 LEU B 437 -19.165 -6.489 -8.373 1.00 0.00 C ATOM 0 H LEU B 437 -16.760 -7.619 -9.352 1.00 0.00 H new ATOM 0 HA LEU B 437 -17.145 -8.807 -6.645 1.00 0.00 H new ATOM 0 HB2 LEU B 437 -18.908 -9.927 -8.490 1.00 0.00 H new ATOM 0 HB3 LEU B 437 -19.261 -8.887 -7.125 1.00 0.00 H new ATOM 0 HG LEU B 437 -18.598 -7.859 -9.896 1.00 0.00 H new ATOM 0 HD11 LEU B 437 -21.006 -7.443 -10.160 1.00 0.00 H new ATOM 0 HD12 LEU B 437 -20.638 -9.177 -10.004 1.00 0.00 H new ATOM 0 HD13 LEU B 437 -21.315 -8.283 -8.622 1.00 0.00 H new ATOM 0 HD21 LEU B 437 -19.551 -5.747 -9.072 1.00 0.00 H new ATOM 0 HD22 LEU B 437 -19.764 -6.476 -7.462 1.00 0.00 H new ATOM 0 HD23 LEU B 437 -18.129 -6.253 -8.129 1.00 0.00 H new ATOM 770 N VAL B 438 -16.107 -10.938 -7.164 1.00 0.00 N ATOM 771 CA VAL B 438 -15.361 -12.159 -7.417 1.00 0.00 C ATOM 772 C VAL B 438 -16.334 -13.276 -7.798 1.00 0.00 C ATOM 773 O VAL B 438 -17.105 -13.746 -6.962 1.00 0.00 O ATOM 774 CB VAL B 438 -14.498 -12.507 -6.202 1.00 0.00 C ATOM 775 CG1 VAL B 438 -13.986 -13.946 -6.287 1.00 0.00 C ATOM 776 CG2 VAL B 438 -13.338 -11.520 -6.053 1.00 0.00 C ATOM 0 H VAL B 438 -16.355 -10.784 -6.187 1.00 0.00 H new ATOM 0 HA VAL B 438 -14.678 -12.022 -8.255 1.00 0.00 H new ATOM 0 HB VAL B 438 -15.123 -12.426 -5.313 1.00 0.00 H new ATOM 0 HG11 VAL B 438 -13.376 -14.167 -5.411 1.00 0.00 H new ATOM 0 HG12 VAL B 438 -14.832 -14.632 -6.322 1.00 0.00 H new ATOM 0 HG13 VAL B 438 -13.385 -14.066 -7.188 1.00 0.00 H new ATOM 0 HG21 VAL B 438 -12.740 -11.790 -5.182 1.00 0.00 H new ATOM 0 HG22 VAL B 438 -12.714 -11.554 -6.946 1.00 0.00 H new ATOM 0 HG23 VAL B 438 -13.732 -10.512 -5.924 1.00 0.00 H new ATOM 786 N ILE B 439 -16.267 -13.670 -9.062 1.00 0.00 N ATOM 787 CA ILE B 439 -17.133 -14.724 -9.564 1.00 0.00 C ATOM 788 C ILE B 439 -16.279 -15.922 -9.985 1.00 0.00 C ATOM 789 O ILE B 439 -15.110 -15.764 -10.333 1.00 0.00 O ATOM 790 CB ILE B 439 -18.036 -14.190 -10.678 1.00 0.00 C ATOM 791 CG1 ILE B 439 -17.217 -13.818 -11.916 1.00 0.00 C ATOM 792 CG2 ILE B 439 -18.887 -13.021 -10.180 1.00 0.00 C ATOM 793 CD1 ILE B 439 -16.850 -12.332 -11.904 1.00 0.00 C ATOM 0 H ILE B 439 -15.627 -13.278 -9.753 1.00 0.00 H new ATOM 0 HA ILE B 439 -17.805 -15.071 -8.780 1.00 0.00 H new ATOM 0 HB ILE B 439 -18.722 -14.984 -10.973 1.00 0.00 H new ATOM 0 HG12 ILE B 439 -16.309 -14.420 -11.950 1.00 0.00 H new ATOM 0 HG13 ILE B 439 -17.787 -14.048 -12.816 1.00 0.00 H new ATOM 0 HG21 ILE B 439 -19.520 -12.660 -10.991 1.00 0.00 H new ATOM 0 HG22 ILE B 439 -19.513 -13.353 -9.352 1.00 0.00 H new ATOM 0 HG23 ILE B 439 -18.236 -12.215 -9.842 1.00 0.00 H new ATOM 0 HD11 ILE B 439 -16.268 -12.094 -12.794 1.00 0.00 H new ATOM 0 HD12 ILE B 439 -17.760 -11.732 -11.894 1.00 0.00 H new ATOM 0 HD13 ILE B 439 -16.260 -12.110 -11.015 1.00 0.00 H new ATOM 805 N PRO B 440 -16.913 -17.124 -9.938 1.00 0.00 N ATOM 806 CA PRO B 440 -16.225 -18.348 -10.310 1.00 0.00 C ATOM 807 C PRO B 440 -16.070 -18.450 -11.829 1.00 0.00 C ATOM 808 O PRO B 440 -17.061 -18.533 -12.553 1.00 0.00 O ATOM 809 CB PRO B 440 -17.068 -19.468 -9.722 1.00 0.00 C ATOM 810 CG PRO B 440 -18.433 -18.861 -9.446 1.00 0.00 C ATOM 811 CD PRO B 440 -18.297 -17.349 -9.530 1.00 0.00 C ATOM 0 HA PRO B 440 -15.206 -18.391 -9.926 1.00 0.00 H new ATOM 0 HB2 PRO B 440 -17.146 -20.304 -10.417 1.00 0.00 H new ATOM 0 HB3 PRO B 440 -16.620 -19.855 -8.807 1.00 0.00 H new ATOM 0 HG2 PRO B 440 -19.164 -19.219 -10.171 1.00 0.00 H new ATOM 0 HG3 PRO B 440 -18.790 -19.158 -8.460 1.00 0.00 H new ATOM 0 HD2 PRO B 440 -18.996 -16.928 -10.252 1.00 0.00 H new ATOM 0 HD3 PRO B 440 -18.508 -16.878 -8.570 1.00 0.00 H new ATOM 819 N PHE B 441 -14.820 -18.441 -12.266 1.00 0.00 N ATOM 820 CA PHE B 441 -14.523 -18.531 -13.686 1.00 0.00 C ATOM 821 C PHE B 441 -15.140 -19.791 -14.296 1.00 0.00 C ATOM 822 O PHE B 441 -15.825 -20.546 -13.609 1.00 0.00 O ATOM 823 CB PHE B 441 -13.000 -18.606 -13.820 1.00 0.00 C ATOM 824 CG PHE B 441 -12.315 -19.395 -12.703 1.00 0.00 C ATOM 825 CD1 PHE B 441 -12.956 -20.444 -12.120 1.00 0.00 C ATOM 826 CD2 PHE B 441 -11.066 -19.048 -12.293 1.00 0.00 C ATOM 827 CE1 PHE B 441 -12.320 -21.176 -11.083 1.00 0.00 C ATOM 828 CE2 PHE B 441 -10.430 -19.781 -11.255 1.00 0.00 C ATOM 829 CZ PHE B 441 -11.070 -20.829 -10.672 1.00 0.00 C ATOM 0 H PHE B 441 -14.001 -18.373 -11.662 1.00 0.00 H new ATOM 0 HA PHE B 441 -14.935 -17.668 -14.208 1.00 0.00 H new ATOM 0 HB2 PHE B 441 -12.752 -19.063 -14.778 1.00 0.00 H new ATOM 0 HB3 PHE B 441 -12.597 -17.593 -13.836 1.00 0.00 H new ATOM 0 HD1 PHE B 441 -13.948 -20.720 -12.446 1.00 0.00 H new ATOM 0 HD2 PHE B 441 -10.557 -18.215 -12.756 1.00 0.00 H new ATOM 0 HE1 PHE B 441 -12.829 -22.009 -10.620 1.00 0.00 H new ATOM 0 HE2 PHE B 441 -9.438 -19.505 -10.929 1.00 0.00 H new ATOM 0 HZ PHE B 441 -10.587 -21.386 -9.883 1.00 0.00 H new ATOM 931 N ASP B 448 -5.374 -17.196 -13.817 1.00 0.00 N ATOM 932 CA ASP B 448 -3.984 -16.774 -13.870 1.00 0.00 C ATOM 933 C ASP B 448 -3.437 -16.653 -12.447 1.00 0.00 C ATOM 934 O ASP B 448 -4.192 -16.407 -11.507 1.00 0.00 O ATOM 935 CB ASP B 448 -3.849 -15.408 -14.546 1.00 0.00 C ATOM 936 CG ASP B 448 -2.479 -14.744 -14.394 1.00 0.00 C ATOM 937 OD1 ASP B 448 -1.475 -15.473 -14.544 1.00 0.00 O ATOM 938 OD2 ASP B 448 -2.467 -13.522 -14.130 1.00 0.00 O ATOM 0 HA ASP B 448 -3.428 -17.517 -14.442 1.00 0.00 H new ATOM 0 HB2 ASP B 448 -4.065 -15.522 -15.608 1.00 0.00 H new ATOM 0 HB3 ASP B 448 -4.607 -14.740 -14.137 1.00 0.00 H new ATOM 943 N GLU B 449 -2.130 -16.832 -12.332 1.00 0.00 N ATOM 944 CA GLU B 449 -1.473 -16.746 -11.039 1.00 0.00 C ATOM 945 C GLU B 449 -1.384 -15.288 -10.584 1.00 0.00 C ATOM 946 O GLU B 449 -0.666 -14.490 -11.184 1.00 0.00 O ATOM 947 CB GLU B 449 -0.087 -17.392 -11.083 1.00 0.00 C ATOM 948 CG GLU B 449 0.242 -18.077 -9.756 1.00 0.00 C ATOM 949 CD GLU B 449 -0.454 -19.436 -9.653 1.00 0.00 C ATOM 950 OE1 GLU B 449 -1.689 -19.428 -9.461 1.00 0.00 O ATOM 951 OE2 GLU B 449 0.266 -20.452 -9.769 1.00 0.00 O ATOM 0 H GLU B 449 -1.507 -17.036 -13.114 1.00 0.00 H new ATOM 0 HA GLU B 449 -2.071 -17.297 -10.313 1.00 0.00 H new ATOM 0 HB2 GLU B 449 -0.048 -18.121 -11.892 1.00 0.00 H new ATOM 0 HB3 GLU B 449 0.665 -16.633 -11.301 1.00 0.00 H new ATOM 0 HG2 GLU B 449 1.320 -18.209 -9.668 1.00 0.00 H new ATOM 0 HG3 GLU B 449 -0.070 -17.441 -8.927 1.00 0.00 H new ATOM 958 N GLY B 450 -2.125 -14.984 -9.529 1.00 0.00 N ATOM 959 CA GLY B 450 -2.138 -13.636 -8.987 1.00 0.00 C ATOM 960 C GLY B 450 -3.333 -12.843 -9.520 1.00 0.00 C ATOM 961 O GLY B 450 -3.567 -11.710 -9.102 1.00 0.00 O ATOM 0 H GLY B 450 -2.721 -15.648 -9.035 1.00 0.00 H new ATOM 0 HA2 GLY B 450 -2.181 -13.678 -7.899 1.00 0.00 H new ATOM 0 HA3 GLY B 450 -1.212 -13.125 -9.250 1.00 0.00 H new ATOM 965 N TRP B 451 -4.059 -13.470 -10.434 1.00 0.00 N ATOM 966 CA TRP B 451 -5.224 -12.837 -11.028 1.00 0.00 C ATOM 967 C TRP B 451 -6.362 -13.859 -11.042 1.00 0.00 C ATOM 968 O TRP B 451 -6.119 -15.063 -11.117 1.00 0.00 O ATOM 969 CB TRP B 451 -4.899 -12.286 -12.418 1.00 0.00 C ATOM 970 CG TRP B 451 -3.543 -11.583 -12.508 1.00 0.00 C ATOM 971 CD1 TRP B 451 -2.353 -12.031 -12.086 1.00 0.00 C ATOM 972 CD2 TRP B 451 -3.285 -10.282 -13.076 1.00 0.00 C ATOM 973 NE1 TRP B 451 -1.350 -11.116 -12.339 1.00 0.00 N ATOM 974 CE2 TRP B 451 -1.936 -10.019 -12.960 1.00 0.00 C ATOM 975 CE3 TRP B 451 -4.163 -9.357 -13.667 1.00 0.00 C ATOM 976 CZ2 TRP B 451 -1.343 -8.834 -13.413 1.00 0.00 C ATOM 977 CZ3 TRP B 451 -3.556 -8.177 -14.115 1.00 0.00 C ATOM 978 CH2 TRP B 451 -2.199 -7.898 -14.006 1.00 0.00 C ATOM 0 H TRP B 451 -3.863 -14.410 -10.778 1.00 0.00 H new ATOM 0 HA TRP B 451 -5.537 -11.975 -10.439 1.00 0.00 H new ATOM 0 HB2 TRP B 451 -4.920 -13.106 -13.136 1.00 0.00 H new ATOM 0 HB3 TRP B 451 -5.680 -11.585 -12.711 1.00 0.00 H new ATOM 0 HD1 TRP B 451 -2.198 -12.987 -11.608 1.00 0.00 H new ATOM 0 HE1 TRP B 451 -0.362 -11.225 -12.112 1.00 0.00 H new ATOM 0 HE3 TRP B 451 -5.222 -9.542 -13.768 1.00 0.00 H new ATOM 0 HZ2 TRP B 451 -0.283 -8.652 -13.311 1.00 0.00 H new ATOM 0 HZ3 TRP B 451 -4.186 -7.432 -14.577 1.00 0.00 H new ATOM 0 HH2 TRP B 451 -1.806 -6.963 -14.377 1.00 0.00 H new ATOM 989 N LEU B 452 -7.580 -13.343 -10.966 1.00 0.00 N ATOM 990 CA LEU B 452 -8.756 -14.195 -10.970 1.00 0.00 C ATOM 991 C LEU B 452 -9.841 -13.557 -11.840 1.00 0.00 C ATOM 992 O LEU B 452 -9.695 -12.420 -12.285 1.00 0.00 O ATOM 993 CB LEU B 452 -9.209 -14.489 -9.538 1.00 0.00 C ATOM 994 CG LEU B 452 -8.574 -13.628 -8.444 1.00 0.00 C ATOM 995 CD1 LEU B 452 -9.359 -13.737 -7.135 1.00 0.00 C ATOM 996 CD2 LEU B 452 -7.097 -13.981 -8.257 1.00 0.00 C ATOM 0 H LEU B 452 -7.777 -12.344 -10.901 1.00 0.00 H new ATOM 0 HA LEU B 452 -8.523 -15.164 -11.412 1.00 0.00 H new ATOM 0 HB2 LEU B 452 -10.291 -14.366 -9.488 1.00 0.00 H new ATOM 0 HB3 LEU B 452 -8.997 -15.535 -9.318 1.00 0.00 H new ATOM 0 HG LEU B 452 -8.619 -12.586 -8.761 1.00 0.00 H new ATOM 0 HD11 LEU B 452 -8.886 -13.115 -6.374 1.00 0.00 H new ATOM 0 HD12 LEU B 452 -10.383 -13.399 -7.295 1.00 0.00 H new ATOM 0 HD13 LEU B 452 -9.368 -14.775 -6.801 1.00 0.00 H new ATOM 0 HD21 LEU B 452 -6.670 -13.355 -7.474 1.00 0.00 H new ATOM 0 HD22 LEU B 452 -7.007 -15.029 -7.973 1.00 0.00 H new ATOM 0 HD23 LEU B 452 -6.561 -13.811 -9.191 1.00 0.00 H new ATOM 1008 N MET B 453 -10.905 -14.317 -12.055 1.00 0.00 N ATOM 1009 CA MET B 453 -12.014 -13.840 -12.863 1.00 0.00 C ATOM 1010 C MET B 453 -13.026 -13.075 -12.008 1.00 0.00 C ATOM 1011 O MET B 453 -13.682 -13.658 -11.146 1.00 0.00 O ATOM 1012 CB MET B 453 -12.706 -15.028 -13.533 1.00 0.00 C ATOM 1013 CG MET B 453 -14.058 -14.616 -14.120 1.00 0.00 C ATOM 1014 SD MET B 453 -14.134 -15.058 -15.847 1.00 0.00 S ATOM 1015 CE MET B 453 -12.674 -14.224 -16.446 1.00 0.00 C ATOM 0 H MET B 453 -11.022 -15.260 -11.684 1.00 0.00 H new ATOM 0 HA MET B 453 -11.621 -13.162 -13.621 1.00 0.00 H new ATOM 0 HB2 MET B 453 -12.069 -15.426 -14.323 1.00 0.00 H new ATOM 0 HB3 MET B 453 -12.850 -15.827 -12.806 1.00 0.00 H new ATOM 0 HG2 MET B 453 -14.865 -15.106 -13.575 1.00 0.00 H new ATOM 0 HG3 MET B 453 -14.202 -13.542 -14.004 1.00 0.00 H new ATOM 0 HE1 MET B 453 -12.966 -13.330 -16.998 1.00 0.00 H new ATOM 0 HE2 MET B 453 -12.045 -13.940 -15.602 1.00 0.00 H new ATOM 0 HE3 MET B 453 -12.118 -14.891 -17.104 1.00 0.00 H new ATOM 1025 N GLY B 454 -13.122 -11.781 -12.276 1.00 0.00 N ATOM 1026 CA GLY B 454 -14.042 -10.930 -11.542 1.00 0.00 C ATOM 1027 C GLY B 454 -14.793 -9.990 -12.487 1.00 0.00 C ATOM 1028 O GLY B 454 -14.507 -9.948 -13.683 1.00 0.00 O ATOM 0 H GLY B 454 -12.577 -11.301 -12.992 1.00 0.00 H new ATOM 0 HA2 GLY B 454 -14.755 -11.546 -10.994 1.00 0.00 H new ATOM 0 HA3 GLY B 454 -13.492 -10.346 -10.804 1.00 0.00 H new ATOM 1032 N VAL B 455 -15.738 -9.259 -11.915 1.00 0.00 N ATOM 1033 CA VAL B 455 -16.531 -8.320 -12.691 1.00 0.00 C ATOM 1034 C VAL B 455 -16.674 -7.012 -11.911 1.00 0.00 C ATOM 1035 O VAL B 455 -16.747 -7.023 -10.683 1.00 0.00 O ATOM 1036 CB VAL B 455 -17.877 -8.949 -13.057 1.00 0.00 C ATOM 1037 CG1 VAL B 455 -18.620 -9.419 -11.805 1.00 0.00 C ATOM 1038 CG2 VAL B 455 -18.733 -7.977 -13.871 1.00 0.00 C ATOM 0 H VAL B 455 -15.973 -9.298 -10.923 1.00 0.00 H new ATOM 0 HA VAL B 455 -16.032 -8.084 -13.631 1.00 0.00 H new ATOM 0 HB VAL B 455 -17.681 -9.823 -13.678 1.00 0.00 H new ATOM 0 HG11 VAL B 455 -19.573 -9.862 -12.093 1.00 0.00 H new ATOM 0 HG12 VAL B 455 -18.018 -10.162 -11.282 1.00 0.00 H new ATOM 0 HG13 VAL B 455 -18.799 -8.568 -11.147 1.00 0.00 H new ATOM 0 HG21 VAL B 455 -19.684 -8.449 -14.118 1.00 0.00 H new ATOM 0 HG22 VAL B 455 -18.916 -7.076 -13.286 1.00 0.00 H new ATOM 0 HG23 VAL B 455 -18.210 -7.713 -14.790 1.00 0.00 H new ATOM 1048 N LYS B 456 -16.711 -5.917 -12.655 1.00 0.00 N ATOM 1049 CA LYS B 456 -16.844 -4.604 -12.048 1.00 0.00 C ATOM 1050 C LYS B 456 -18.318 -4.339 -11.734 1.00 0.00 C ATOM 1051 O LYS B 456 -19.201 -4.989 -12.291 1.00 0.00 O ATOM 1052 CB LYS B 456 -16.203 -3.535 -12.936 1.00 0.00 C ATOM 1053 CG LYS B 456 -14.850 -3.095 -12.374 1.00 0.00 C ATOM 1054 CD LYS B 456 -14.439 -1.733 -12.937 1.00 0.00 C ATOM 1055 CE LYS B 456 -14.516 -1.726 -14.465 1.00 0.00 C ATOM 1056 NZ LYS B 456 -15.822 -1.195 -14.916 1.00 0.00 N ATOM 0 H LYS B 456 -16.651 -5.912 -13.673 1.00 0.00 H new ATOM 0 HA LYS B 456 -16.304 -4.566 -11.102 1.00 0.00 H new ATOM 0 HB2 LYS B 456 -16.072 -3.926 -13.945 1.00 0.00 H new ATOM 0 HB3 LYS B 456 -16.867 -2.674 -13.012 1.00 0.00 H new ATOM 0 HG2 LYS B 456 -14.904 -3.042 -11.287 1.00 0.00 H new ATOM 0 HG3 LYS B 456 -14.091 -3.838 -12.620 1.00 0.00 H new ATOM 0 HD2 LYS B 456 -15.089 -0.957 -12.533 1.00 0.00 H new ATOM 0 HD3 LYS B 456 -13.424 -1.495 -12.619 1.00 0.00 H new ATOM 0 HE2 LYS B 456 -13.709 -1.117 -14.873 1.00 0.00 H new ATOM 0 HE3 LYS B 456 -14.377 -2.737 -14.847 1.00 0.00 H new ATOM 0 HZ1 LYS B 456 -16.400 -1.972 -15.296 1.00 0.00 H new ATOM 0 HZ2 LYS B 456 -16.316 -0.758 -14.112 1.00 0.00 H new ATOM 0 HZ3 LYS B 456 -15.669 -0.482 -15.657 1.00 0.00 H new ATOM 1070 N GLU B 457 -18.538 -3.384 -10.842 1.00 0.00 N ATOM 1071 CA GLU B 457 -19.889 -3.025 -10.448 1.00 0.00 C ATOM 1072 C GLU B 457 -20.701 -2.589 -11.669 1.00 0.00 C ATOM 1073 O GLU B 457 -21.866 -2.958 -11.809 1.00 0.00 O ATOM 1074 CB GLU B 457 -19.876 -1.931 -9.378 1.00 0.00 C ATOM 1075 CG GLU B 457 -21.274 -1.341 -9.180 1.00 0.00 C ATOM 1076 CD GLU B 457 -21.478 -0.888 -7.733 1.00 0.00 C ATOM 1077 OE1 GLU B 457 -21.751 -1.774 -6.894 1.00 0.00 O ATOM 1078 OE2 GLU B 457 -21.357 0.334 -7.498 1.00 0.00 O ATOM 0 H GLU B 457 -17.803 -2.848 -10.381 1.00 0.00 H new ATOM 0 HA GLU B 457 -20.366 -3.905 -10.015 1.00 0.00 H new ATOM 0 HB2 GLU B 457 -19.515 -2.343 -8.436 1.00 0.00 H new ATOM 0 HB3 GLU B 457 -19.182 -1.142 -9.668 1.00 0.00 H new ATOM 0 HG2 GLU B 457 -21.414 -0.495 -9.853 1.00 0.00 H new ATOM 0 HG3 GLU B 457 -22.027 -2.085 -9.442 1.00 0.00 H new ATOM 1085 N SER B 458 -20.054 -1.808 -12.522 1.00 0.00 N ATOM 1086 CA SER B 458 -20.701 -1.317 -13.726 1.00 0.00 C ATOM 1087 C SER B 458 -21.107 -2.492 -14.618 1.00 0.00 C ATOM 1088 O SER B 458 -22.216 -2.519 -15.149 1.00 0.00 O ATOM 1089 CB SER B 458 -19.785 -0.361 -14.493 1.00 0.00 C ATOM 1090 OG SER B 458 -20.468 0.822 -14.899 1.00 0.00 O ATOM 0 H SER B 458 -19.088 -1.503 -12.403 1.00 0.00 H new ATOM 0 HA SER B 458 -21.594 -0.765 -13.433 1.00 0.00 H new ATOM 0 HB2 SER B 458 -18.935 -0.092 -13.866 1.00 0.00 H new ATOM 0 HB3 SER B 458 -19.385 -0.868 -15.371 1.00 0.00 H new ATOM 0 HG SER B 458 -19.849 1.407 -15.384 1.00 0.00 H new ATOM 1096 N ASP B 459 -20.186 -3.436 -14.755 1.00 0.00 N ATOM 1097 CA ASP B 459 -20.435 -4.610 -15.573 1.00 0.00 C ATOM 1098 C ASP B 459 -21.614 -5.392 -14.991 1.00 0.00 C ATOM 1099 O ASP B 459 -22.384 -6.004 -15.730 1.00 0.00 O ATOM 1100 CB ASP B 459 -19.217 -5.537 -15.591 1.00 0.00 C ATOM 1101 CG ASP B 459 -18.182 -5.222 -16.673 1.00 0.00 C ATOM 1102 OD1 ASP B 459 -18.147 -4.048 -17.101 1.00 0.00 O ATOM 1103 OD2 ASP B 459 -17.448 -6.163 -17.047 1.00 0.00 O ATOM 0 H ASP B 459 -19.267 -3.411 -14.313 1.00 0.00 H new ATOM 0 HA ASP B 459 -20.649 -4.274 -16.588 1.00 0.00 H new ATOM 0 HB2 ASP B 459 -18.729 -5.490 -14.618 1.00 0.00 H new ATOM 0 HB3 ASP B 459 -19.561 -6.562 -15.726 1.00 0.00 H new ATOM 1108 N TRP B 460 -21.720 -5.345 -13.671 1.00 0.00 N ATOM 1109 CA TRP B 460 -22.793 -6.041 -12.981 1.00 0.00 C ATOM 1110 C TRP B 460 -24.119 -5.611 -13.612 1.00 0.00 C ATOM 1111 O TRP B 460 -24.959 -6.449 -13.933 1.00 0.00 O ATOM 1112 CB TRP B 460 -22.736 -5.781 -11.475 1.00 0.00 C ATOM 1113 CG TRP B 460 -23.627 -6.710 -10.648 1.00 0.00 C ATOM 1114 CD1 TRP B 460 -24.615 -7.505 -11.081 1.00 0.00 C ATOM 1115 CD2 TRP B 460 -23.570 -6.910 -9.220 1.00 0.00 C ATOM 1116 NE1 TRP B 460 -25.198 -8.200 -10.040 1.00 0.00 N ATOM 1117 CE2 TRP B 460 -24.541 -7.827 -8.873 1.00 0.00 C ATOM 1118 CE3 TRP B 460 -22.725 -6.336 -8.254 1.00 0.00 C ATOM 1119 CZ2 TRP B 460 -24.760 -8.250 -7.556 1.00 0.00 C ATOM 1120 CZ3 TRP B 460 -22.956 -6.770 -6.943 1.00 0.00 C ATOM 1121 CH2 TRP B 460 -23.930 -7.691 -6.577 1.00 0.00 C ATOM 0 H TRP B 460 -21.080 -4.836 -13.061 1.00 0.00 H new ATOM 0 HA TRP B 460 -22.687 -7.120 -13.094 1.00 0.00 H new ATOM 0 HB2 TRP B 460 -21.705 -5.888 -11.137 1.00 0.00 H new ATOM 0 HB3 TRP B 460 -23.029 -4.749 -11.284 1.00 0.00 H new ATOM 0 HD1 TRP B 460 -24.917 -7.591 -12.114 1.00 0.00 H new ATOM 0 HE1 TRP B 460 -25.968 -8.864 -10.114 1.00 0.00 H new ATOM 0 HE3 TRP B 460 -21.958 -5.617 -8.503 1.00 0.00 H new ATOM 0 HZ2 TRP B 460 -25.528 -8.968 -7.309 1.00 0.00 H new ATOM 0 HZ3 TRP B 460 -22.333 -6.360 -6.161 1.00 0.00 H new ATOM 0 HH2 TRP B 460 -24.046 -7.974 -5.541 1.00 0.00 H new ATOM 1132 N ASN B 461 -24.264 -4.303 -13.771 1.00 0.00 N ATOM 1133 CA ASN B 461 -25.473 -3.751 -14.358 1.00 0.00 C ATOM 1134 C ASN B 461 -25.718 -4.404 -15.720 1.00 0.00 C ATOM 1135 O ASN B 461 -26.856 -4.478 -16.181 1.00 0.00 O ATOM 1136 CB ASN B 461 -25.341 -2.242 -14.574 1.00 0.00 C ATOM 1137 CG ASN B 461 -25.490 -1.484 -13.254 1.00 0.00 C ATOM 1138 OD1 ASN B 461 -26.571 -1.082 -12.857 1.00 0.00 O ATOM 1139 ND2 ASN B 461 -24.346 -1.311 -12.598 1.00 0.00 N ATOM 0 H ASN B 461 -23.565 -3.610 -13.504 1.00 0.00 H new ATOM 0 HA ASN B 461 -26.299 -3.947 -13.675 1.00 0.00 H new ATOM 0 HB2 ASN B 461 -24.371 -2.018 -15.018 1.00 0.00 H new ATOM 0 HB3 ASN B 461 -26.100 -1.904 -15.279 1.00 0.00 H new ATOM 0 HD21 ASN B 461 -24.339 -0.816 -11.706 1.00 0.00 H new ATOM 0 HD22 ASN B 461 -23.475 -1.673 -12.987 1.00 0.00 H new ATOM 1146 N GLN B 462 -24.632 -4.861 -16.325 1.00 0.00 N ATOM 1147 CA GLN B 462 -24.715 -5.505 -17.625 1.00 0.00 C ATOM 1148 C GLN B 462 -24.878 -7.017 -17.460 1.00 0.00 C ATOM 1149 O GLN B 462 -24.642 -7.777 -18.398 1.00 0.00 O ATOM 1150 CB GLN B 462 -23.488 -5.176 -18.479 1.00 0.00 C ATOM 1151 CG GLN B 462 -23.256 -3.665 -18.546 1.00 0.00 C ATOM 1152 CD GLN B 462 -24.572 -2.917 -18.768 1.00 0.00 C ATOM 1153 OE1 GLN B 462 -25.240 -3.071 -19.777 1.00 0.00 O ATOM 1154 NE2 GLN B 462 -24.905 -2.101 -17.773 1.00 0.00 N ATOM 0 H GLN B 462 -23.690 -4.798 -15.939 1.00 0.00 H new ATOM 0 HA GLN B 462 -25.593 -5.120 -18.144 1.00 0.00 H new ATOM 0 HB2 GLN B 462 -22.608 -5.665 -18.061 1.00 0.00 H new ATOM 0 HB3 GLN B 462 -23.624 -5.572 -19.485 1.00 0.00 H new ATOM 0 HG2 GLN B 462 -22.791 -3.324 -17.621 1.00 0.00 H new ATOM 0 HG3 GLN B 462 -22.562 -3.436 -19.355 1.00 0.00 H new ATOM 0 HE21 GLN B 462 -24.300 -2.019 -16.956 1.00 0.00 H new ATOM 0 HE22 GLN B 462 -25.766 -1.556 -17.826 1.00 0.00 H new ATOM 1163 N HIS B 463 -25.281 -7.409 -16.260 1.00 0.00 N ATOM 1164 CA HIS B 463 -25.478 -8.816 -15.959 1.00 0.00 C ATOM 1165 C HIS B 463 -26.241 -9.484 -17.105 1.00 0.00 C ATOM 1166 O HIS B 463 -26.144 -10.695 -17.297 1.00 0.00 O ATOM 1167 CB HIS B 463 -26.170 -8.991 -14.606 1.00 0.00 C ATOM 1168 CG HIS B 463 -27.102 -10.178 -14.541 1.00 0.00 C ATOM 1169 ND1 HIS B 463 -26.676 -11.447 -14.192 1.00 0.00 N ATOM 1170 CD2 HIS B 463 -28.441 -10.273 -14.783 1.00 0.00 C ATOM 1171 CE1 HIS B 463 -27.720 -12.263 -14.226 1.00 0.00 C ATOM 1172 NE2 HIS B 463 -28.812 -11.533 -14.593 1.00 0.00 N ATOM 0 H HIS B 463 -25.476 -6.776 -15.485 1.00 0.00 H new ATOM 0 HA HIS B 463 -24.511 -9.312 -15.874 1.00 0.00 H new ATOM 0 HB2 HIS B 463 -25.410 -9.096 -13.832 1.00 0.00 H new ATOM 0 HB3 HIS B 463 -26.734 -8.086 -14.378 1.00 0.00 H new ATOM 0 HD2 HIS B 463 -29.089 -9.461 -15.079 1.00 0.00 H new ATOM 0 HE1 HIS B 463 -27.708 -13.320 -14.003 1.00 0.00 H new ATOM 0 HE2 HIS B 463 -29.759 -11.896 -14.703 1.00 0.00 H new ATOM 1180 N LYS B 464 -26.982 -8.665 -17.837 1.00 0.00 N ATOM 1181 CA LYS B 464 -27.760 -9.161 -18.959 1.00 0.00 C ATOM 1182 C LYS B 464 -26.829 -9.860 -19.951 1.00 0.00 C ATOM 1183 O LYS B 464 -27.237 -10.794 -20.639 1.00 0.00 O ATOM 1184 CB LYS B 464 -28.585 -8.032 -19.580 1.00 0.00 C ATOM 1185 CG LYS B 464 -29.955 -8.539 -20.036 1.00 0.00 C ATOM 1186 CD LYS B 464 -31.067 -7.587 -19.593 1.00 0.00 C ATOM 1187 CE LYS B 464 -31.902 -7.126 -20.789 1.00 0.00 C ATOM 1188 NZ LYS B 464 -31.583 -5.723 -21.134 1.00 0.00 N ATOM 0 H LYS B 464 -27.060 -7.661 -17.675 1.00 0.00 H new ATOM 0 HA LYS B 464 -28.483 -9.904 -18.622 1.00 0.00 H new ATOM 0 HB2 LYS B 464 -28.714 -7.229 -18.854 1.00 0.00 H new ATOM 0 HB3 LYS B 464 -28.048 -7.610 -20.430 1.00 0.00 H new ATOM 0 HG2 LYS B 464 -29.967 -8.638 -21.121 1.00 0.00 H new ATOM 0 HG3 LYS B 464 -30.135 -9.532 -19.623 1.00 0.00 H new ATOM 0 HD2 LYS B 464 -31.709 -8.085 -18.867 1.00 0.00 H new ATOM 0 HD3 LYS B 464 -30.632 -6.721 -19.093 1.00 0.00 H new ATOM 0 HE2 LYS B 464 -31.707 -7.771 -21.646 1.00 0.00 H new ATOM 0 HE3 LYS B 464 -32.963 -7.217 -20.556 1.00 0.00 H new ATOM 0 HZ1 LYS B 464 -32.159 -5.426 -21.948 1.00 0.00 H new ATOM 0 HZ2 LYS B 464 -31.791 -5.110 -20.320 1.00 0.00 H new ATOM 0 HZ3 LYS B 464 -30.575 -5.646 -21.377 1.00 0.00 H new ATOM 1202 N LYS B 465 -25.595 -9.380 -19.994 1.00 0.00 N ATOM 1203 CA LYS B 465 -24.602 -9.947 -20.891 1.00 0.00 C ATOM 1204 C LYS B 465 -23.279 -10.114 -20.140 1.00 0.00 C ATOM 1205 O LYS B 465 -22.228 -9.704 -20.629 1.00 0.00 O ATOM 1206 CB LYS B 465 -24.485 -9.104 -22.162 1.00 0.00 C ATOM 1207 CG LYS B 465 -24.055 -7.673 -21.834 1.00 0.00 C ATOM 1208 CD LYS B 465 -25.263 -6.734 -21.792 1.00 0.00 C ATOM 1209 CE LYS B 465 -24.868 -5.314 -22.202 1.00 0.00 C ATOM 1210 NZ LYS B 465 -26.073 -4.502 -22.482 1.00 0.00 N ATOM 0 H LYS B 465 -25.260 -8.605 -19.422 1.00 0.00 H new ATOM 0 HA LYS B 465 -24.909 -10.939 -21.221 1.00 0.00 H new ATOM 0 HB2 LYS B 465 -23.762 -9.559 -22.839 1.00 0.00 H new ATOM 0 HB3 LYS B 465 -25.443 -9.089 -22.682 1.00 0.00 H new ATOM 0 HG2 LYS B 465 -23.542 -7.655 -20.872 1.00 0.00 H new ATOM 0 HG3 LYS B 465 -23.343 -7.323 -22.582 1.00 0.00 H new ATOM 0 HD2 LYS B 465 -26.041 -7.106 -22.459 1.00 0.00 H new ATOM 0 HD3 LYS B 465 -25.684 -6.722 -20.787 1.00 0.00 H new ATOM 0 HE2 LYS B 465 -24.285 -4.848 -21.407 1.00 0.00 H new ATOM 0 HE3 LYS B 465 -24.232 -5.348 -23.086 1.00 0.00 H new ATOM 0 HZ1 LYS B 465 -25.960 -4.017 -23.395 1.00 0.00 H new ATOM 0 HZ2 LYS B 465 -26.908 -5.121 -22.519 1.00 0.00 H new ATOM 0 HZ3 LYS B 465 -26.199 -3.796 -21.728 1.00 0.00 H new ATOM 1224 N LEU B 466 -23.375 -10.718 -18.964 1.00 0.00 N ATOM 1225 CA LEU B 466 -22.199 -10.945 -18.141 1.00 0.00 C ATOM 1226 C LEU B 466 -21.156 -11.716 -18.952 1.00 0.00 C ATOM 1227 O LEU B 466 -19.955 -11.539 -18.753 1.00 0.00 O ATOM 1228 CB LEU B 466 -22.587 -11.629 -16.829 1.00 0.00 C ATOM 1229 CG LEU B 466 -23.149 -13.047 -16.953 1.00 0.00 C ATOM 1230 CD1 LEU B 466 -22.203 -14.069 -16.319 1.00 0.00 C ATOM 1231 CD2 LEU B 466 -24.560 -13.131 -16.367 1.00 0.00 C ATOM 0 H LEU B 466 -24.249 -11.057 -18.562 1.00 0.00 H new ATOM 0 HA LEU B 466 -21.744 -9.996 -17.856 1.00 0.00 H new ATOM 0 HB2 LEU B 466 -21.708 -11.663 -16.186 1.00 0.00 H new ATOM 0 HB3 LEU B 466 -23.327 -11.009 -16.324 1.00 0.00 H new ATOM 0 HG LEU B 466 -23.225 -13.293 -18.012 1.00 0.00 H new ATOM 0 HD11 LEU B 466 -22.626 -15.068 -16.421 1.00 0.00 H new ATOM 0 HD12 LEU B 466 -21.237 -14.031 -16.822 1.00 0.00 H new ATOM 0 HD13 LEU B 466 -22.072 -13.837 -15.262 1.00 0.00 H new ATOM 0 HD21 LEU B 466 -24.936 -14.149 -16.468 1.00 0.00 H new ATOM 0 HD22 LEU B 466 -24.533 -12.857 -15.312 1.00 0.00 H new ATOM 0 HD23 LEU B 466 -25.218 -12.447 -16.903 1.00 0.00 H new ATOM 1243 N GLU B 467 -21.652 -12.555 -19.849 1.00 0.00 N ATOM 1244 CA GLU B 467 -20.778 -13.355 -20.690 1.00 0.00 C ATOM 1245 C GLU B 467 -19.823 -12.451 -21.473 1.00 0.00 C ATOM 1246 O GLU B 467 -18.810 -12.916 -21.993 1.00 0.00 O ATOM 1247 CB GLU B 467 -21.589 -14.244 -21.635 1.00 0.00 C ATOM 1248 CG GLU B 467 -21.996 -15.548 -20.946 1.00 0.00 C ATOM 1249 CD GLU B 467 -23.201 -16.184 -21.644 1.00 0.00 C ATOM 1250 OE1 GLU B 467 -24.271 -15.538 -21.627 1.00 0.00 O ATOM 1251 OE2 GLU B 467 -23.024 -17.300 -22.177 1.00 0.00 O ATOM 0 H GLU B 467 -22.649 -12.698 -20.012 1.00 0.00 H new ATOM 0 HA GLU B 467 -20.186 -14.008 -20.048 1.00 0.00 H new ATOM 0 HB2 GLU B 467 -22.480 -13.711 -21.967 1.00 0.00 H new ATOM 0 HB3 GLU B 467 -21.001 -14.467 -22.525 1.00 0.00 H new ATOM 0 HG2 GLU B 467 -21.158 -16.244 -20.953 1.00 0.00 H new ATOM 0 HG3 GLU B 467 -22.238 -15.352 -19.902 1.00 0.00 H new ATOM 1258 N LYS B 468 -20.179 -11.177 -21.531 1.00 0.00 N ATOM 1259 CA LYS B 468 -19.366 -10.204 -22.242 1.00 0.00 C ATOM 1260 C LYS B 468 -18.815 -9.182 -21.246 1.00 0.00 C ATOM 1261 O LYS B 468 -18.215 -8.184 -21.643 1.00 0.00 O ATOM 1262 CB LYS B 468 -20.161 -9.578 -23.389 1.00 0.00 C ATOM 1263 CG LYS B 468 -20.803 -10.657 -24.264 1.00 0.00 C ATOM 1264 CD LYS B 468 -20.404 -10.482 -25.731 1.00 0.00 C ATOM 1265 CE LYS B 468 -19.411 -11.563 -26.162 1.00 0.00 C ATOM 1266 NZ LYS B 468 -19.845 -12.189 -27.431 1.00 0.00 N ATOM 0 H LYS B 468 -21.020 -10.795 -21.097 1.00 0.00 H new ATOM 0 HA LYS B 468 -18.509 -10.691 -22.707 1.00 0.00 H new ATOM 0 HB2 LYS B 468 -20.934 -8.924 -22.986 1.00 0.00 H new ATOM 0 HB3 LYS B 468 -19.503 -8.957 -23.996 1.00 0.00 H new ATOM 0 HG2 LYS B 468 -20.497 -11.643 -23.915 1.00 0.00 H new ATOM 0 HG3 LYS B 468 -21.888 -10.609 -24.170 1.00 0.00 H new ATOM 0 HD2 LYS B 468 -21.292 -10.527 -26.361 1.00 0.00 H new ATOM 0 HD3 LYS B 468 -19.960 -9.497 -25.876 1.00 0.00 H new ATOM 0 HE2 LYS B 468 -18.420 -11.126 -26.285 1.00 0.00 H new ATOM 0 HE3 LYS B 468 -19.330 -12.322 -25.384 1.00 0.00 H new ATOM 0 HZ1 LYS B 468 -19.160 -12.920 -27.709 1.00 0.00 H new ATOM 0 HZ2 LYS B 468 -20.781 -12.623 -27.302 1.00 0.00 H new ATOM 0 HZ3 LYS B 468 -19.899 -11.464 -28.175 1.00 0.00 H new ATOM 1280 N CYS B 469 -19.039 -9.465 -19.971 1.00 0.00 N ATOM 1281 CA CYS B 469 -18.573 -8.582 -18.915 1.00 0.00 C ATOM 1282 C CYS B 469 -17.417 -9.271 -18.188 1.00 0.00 C ATOM 1283 O CYS B 469 -16.582 -8.609 -17.574 1.00 0.00 O ATOM 1284 CB CYS B 469 -19.703 -8.200 -17.957 1.00 0.00 C ATOM 1285 SG CYS B 469 -19.712 -9.330 -16.518 1.00 0.00 S ATOM 0 H CYS B 469 -19.537 -10.293 -19.645 1.00 0.00 H new ATOM 0 HA CYS B 469 -18.222 -7.646 -19.349 1.00 0.00 H new ATOM 0 HB2 CYS B 469 -19.574 -7.171 -17.621 1.00 0.00 H new ATOM 0 HB3 CYS B 469 -20.661 -8.249 -18.474 1.00 0.00 H new ATOM 0 HG CYS B 469 -19.812 -10.558 -16.931 1.00 0.00 H new ATOM 1291 N ARG B 470 -17.405 -10.593 -18.282 1.00 0.00 N ATOM 1292 CA ARG B 470 -16.365 -11.379 -17.641 1.00 0.00 C ATOM 1293 C ARG B 470 -14.984 -10.828 -18.002 1.00 0.00 C ATOM 1294 O ARG B 470 -14.760 -10.397 -19.132 1.00 0.00 O ATOM 1295 CB ARG B 470 -16.446 -12.848 -18.062 1.00 0.00 C ATOM 1296 CG ARG B 470 -17.868 -13.388 -17.895 1.00 0.00 C ATOM 1297 CD ARG B 470 -17.861 -14.734 -17.168 1.00 0.00 C ATOM 1298 NE ARG B 470 -18.534 -15.760 -17.995 1.00 0.00 N ATOM 1299 CZ ARG B 470 -18.538 -17.070 -17.712 1.00 0.00 C ATOM 1300 NH1 ARG B 470 -17.905 -17.521 -16.620 1.00 0.00 N ATOM 1301 NH2 ARG B 470 -19.175 -17.928 -18.520 1.00 0.00 N ATOM 0 H ARG B 470 -18.099 -11.139 -18.792 1.00 0.00 H new ATOM 0 HA ARG B 470 -16.516 -11.313 -16.564 1.00 0.00 H new ATOM 0 HB2 ARG B 470 -16.134 -12.950 -19.101 1.00 0.00 H new ATOM 0 HB3 ARG B 470 -15.755 -13.441 -17.462 1.00 0.00 H new ATOM 0 HG2 ARG B 470 -18.470 -12.672 -17.336 1.00 0.00 H new ATOM 0 HG3 ARG B 470 -18.335 -13.501 -18.873 1.00 0.00 H new ATOM 0 HD2 ARG B 470 -16.835 -15.039 -16.960 1.00 0.00 H new ATOM 0 HD3 ARG B 470 -18.367 -14.640 -16.207 1.00 0.00 H new ATOM 0 HE ARG B 470 -19.026 -15.451 -18.833 1.00 0.00 H new ATOM 0 HH11 ARG B 470 -17.421 -16.867 -16.005 1.00 0.00 H new ATOM 0 HH12 ARG B 470 -17.908 -18.518 -16.404 1.00 0.00 H new ATOM 0 HH21 ARG B 470 -19.657 -17.584 -19.351 1.00 0.00 H new ATOM 0 HH22 ARG B 470 -19.178 -18.925 -18.305 1.00 0.00 H new ATOM 1315 N GLY B 471 -14.094 -10.860 -17.021 1.00 0.00 N ATOM 1316 CA GLY B 471 -12.742 -10.368 -17.221 1.00 0.00 C ATOM 1317 C GLY B 471 -11.789 -10.939 -16.169 1.00 0.00 C ATOM 1318 O GLY B 471 -12.208 -11.692 -15.290 1.00 0.00 O ATOM 0 H GLY B 471 -14.283 -11.219 -16.085 1.00 0.00 H new ATOM 0 HA2 GLY B 471 -12.395 -10.642 -18.218 1.00 0.00 H new ATOM 0 HA3 GLY B 471 -12.736 -9.279 -17.169 1.00 0.00 H new ATOM 1322 N VAL B 472 -10.526 -10.560 -16.292 1.00 0.00 N ATOM 1323 CA VAL B 472 -9.510 -11.025 -15.363 1.00 0.00 C ATOM 1324 C VAL B 472 -8.800 -9.819 -14.745 1.00 0.00 C ATOM 1325 O VAL B 472 -8.562 -8.820 -15.422 1.00 0.00 O ATOM 1326 CB VAL B 472 -8.552 -11.984 -16.072 1.00 0.00 C ATOM 1327 CG1 VAL B 472 -7.278 -12.194 -15.250 1.00 0.00 C ATOM 1328 CG2 VAL B 472 -9.236 -13.319 -16.374 1.00 0.00 C ATOM 0 H VAL B 472 -10.182 -9.936 -17.022 1.00 0.00 H new ATOM 0 HA VAL B 472 -9.966 -11.587 -14.548 1.00 0.00 H new ATOM 0 HB VAL B 472 -8.267 -11.531 -17.022 1.00 0.00 H new ATOM 0 HG11 VAL B 472 -6.614 -12.880 -15.776 1.00 0.00 H new ATOM 0 HG12 VAL B 472 -6.774 -11.238 -15.109 1.00 0.00 H new ATOM 0 HG13 VAL B 472 -7.537 -12.614 -14.278 1.00 0.00 H new ATOM 0 HG21 VAL B 472 -8.533 -13.982 -16.878 1.00 0.00 H new ATOM 0 HG22 VAL B 472 -9.564 -13.779 -15.442 1.00 0.00 H new ATOM 0 HG23 VAL B 472 -10.099 -13.148 -17.018 1.00 0.00 H new ATOM 1338 N PHE B 473 -8.482 -9.952 -13.465 1.00 0.00 N ATOM 1339 CA PHE B 473 -7.802 -8.886 -12.748 1.00 0.00 C ATOM 1340 C PHE B 473 -6.898 -9.453 -11.652 1.00 0.00 C ATOM 1341 O PHE B 473 -7.157 -10.534 -11.126 1.00 0.00 O ATOM 1342 CB PHE B 473 -8.886 -8.020 -12.102 1.00 0.00 C ATOM 1343 CG PHE B 473 -9.589 -8.685 -10.918 1.00 0.00 C ATOM 1344 CD1 PHE B 473 -10.436 -9.728 -11.128 1.00 0.00 C ATOM 1345 CD2 PHE B 473 -9.367 -8.234 -9.654 1.00 0.00 C ATOM 1346 CE1 PHE B 473 -11.089 -10.346 -10.028 1.00 0.00 C ATOM 1347 CE2 PHE B 473 -10.020 -8.851 -8.554 1.00 0.00 C ATOM 1348 CZ PHE B 473 -10.868 -9.894 -8.765 1.00 0.00 C ATOM 0 H PHE B 473 -8.683 -10.781 -12.906 1.00 0.00 H new ATOM 0 HA PHE B 473 -7.179 -8.313 -13.435 1.00 0.00 H new ATOM 0 HB2 PHE B 473 -8.438 -7.085 -11.767 1.00 0.00 H new ATOM 0 HB3 PHE B 473 -9.630 -7.764 -12.856 1.00 0.00 H new ATOM 0 HD1 PHE B 473 -10.612 -10.087 -12.131 1.00 0.00 H new ATOM 0 HD2 PHE B 473 -8.694 -7.406 -9.487 1.00 0.00 H new ATOM 0 HE1 PHE B 473 -11.761 -11.175 -10.195 1.00 0.00 H new ATOM 0 HE2 PHE B 473 -9.844 -8.493 -7.551 1.00 0.00 H new ATOM 0 HZ PHE B 473 -11.366 -10.363 -7.929 1.00 0.00 H new ATOM 1358 N PRO B 474 -5.827 -8.677 -11.333 1.00 0.00 N ATOM 1359 CA PRO B 474 -4.883 -9.090 -10.309 1.00 0.00 C ATOM 1360 C PRO B 474 -5.476 -8.908 -8.910 1.00 0.00 C ATOM 1361 O PRO B 474 -5.717 -7.783 -8.476 1.00 0.00 O ATOM 1362 CB PRO B 474 -3.647 -8.237 -10.546 1.00 0.00 C ATOM 1363 CG PRO B 474 -4.109 -7.060 -11.390 1.00 0.00 C ATOM 1364 CD PRO B 474 -5.489 -7.391 -11.936 1.00 0.00 C ATOM 0 HA PRO B 474 -4.636 -10.150 -10.368 1.00 0.00 H new ATOM 0 HB2 PRO B 474 -3.220 -7.897 -9.602 1.00 0.00 H new ATOM 0 HB3 PRO B 474 -2.872 -8.806 -11.060 1.00 0.00 H new ATOM 0 HG2 PRO B 474 -4.144 -6.151 -10.790 1.00 0.00 H new ATOM 0 HG3 PRO B 474 -3.409 -6.877 -12.206 1.00 0.00 H new ATOM 0 HD2 PRO B 474 -6.216 -6.624 -11.667 1.00 0.00 H new ATOM 0 HD3 PRO B 474 -5.480 -7.454 -13.024 1.00 0.00 H new ATOM 1372 N GLU B 475 -5.694 -10.032 -8.244 1.00 0.00 N ATOM 1373 CA GLU B 475 -6.254 -10.011 -6.903 1.00 0.00 C ATOM 1374 C GLU B 475 -5.251 -9.408 -5.918 1.00 0.00 C ATOM 1375 O GLU B 475 -5.641 -8.838 -4.900 1.00 0.00 O ATOM 1376 CB GLU B 475 -6.679 -11.413 -6.464 1.00 0.00 C ATOM 1377 CG GLU B 475 -6.714 -11.523 -4.939 1.00 0.00 C ATOM 1378 CD GLU B 475 -7.773 -12.530 -4.486 1.00 0.00 C ATOM 1379 OE1 GLU B 475 -8.969 -12.197 -4.626 1.00 0.00 O ATOM 1380 OE2 GLU B 475 -7.362 -13.610 -4.009 1.00 0.00 O ATOM 0 H GLU B 475 -5.493 -10.964 -8.608 1.00 0.00 H new ATOM 0 HA GLU B 475 -7.145 -9.384 -6.913 1.00 0.00 H new ATOM 0 HB2 GLU B 475 -7.664 -11.643 -6.871 1.00 0.00 H new ATOM 0 HB3 GLU B 475 -5.986 -12.150 -6.870 1.00 0.00 H new ATOM 0 HG2 GLU B 475 -5.735 -11.829 -4.570 1.00 0.00 H new ATOM 0 HG3 GLU B 475 -6.927 -10.546 -4.505 1.00 0.00 H new ATOM 1387 N ASN B 476 -3.978 -9.555 -6.255 1.00 0.00 N ATOM 1388 CA ASN B 476 -2.916 -9.033 -5.412 1.00 0.00 C ATOM 1389 C ASN B 476 -2.881 -7.508 -5.529 1.00 0.00 C ATOM 1390 O ASN B 476 -2.142 -6.843 -4.804 1.00 0.00 O ATOM 1391 CB ASN B 476 -1.552 -9.571 -5.847 1.00 0.00 C ATOM 1392 CG ASN B 476 -1.639 -11.054 -6.213 1.00 0.00 C ATOM 1393 OD1 ASN B 476 -2.495 -11.787 -5.744 1.00 0.00 O ATOM 1394 ND2 ASN B 476 -0.709 -11.455 -7.076 1.00 0.00 N ATOM 0 H ASN B 476 -3.658 -10.028 -7.100 1.00 0.00 H new ATOM 0 HA ASN B 476 -3.116 -9.344 -4.387 1.00 0.00 H new ATOM 0 HB2 ASN B 476 -1.189 -9.002 -6.703 1.00 0.00 H new ATOM 0 HB3 ASN B 476 -0.829 -9.433 -5.043 1.00 0.00 H new ATOM 0 HD21 ASN B 476 -0.684 -12.427 -7.383 1.00 0.00 H new ATOM 0 HD22 ASN B 476 -0.021 -10.790 -7.430 1.00 0.00 H new ATOM 1401 N PHE B 477 -3.690 -6.998 -6.446 1.00 0.00 N ATOM 1402 CA PHE B 477 -3.761 -5.563 -6.667 1.00 0.00 C ATOM 1403 C PHE B 477 -5.099 -5.000 -6.185 1.00 0.00 C ATOM 1404 O PHE B 477 -5.362 -3.807 -6.328 1.00 0.00 O ATOM 1405 CB PHE B 477 -3.639 -5.336 -8.175 1.00 0.00 C ATOM 1406 CG PHE B 477 -4.551 -4.232 -8.714 1.00 0.00 C ATOM 1407 CD1 PHE B 477 -5.878 -4.470 -8.888 1.00 0.00 C ATOM 1408 CD2 PHE B 477 -4.034 -3.011 -9.017 1.00 0.00 C ATOM 1409 CE1 PHE B 477 -6.724 -3.445 -9.388 1.00 0.00 C ATOM 1410 CE2 PHE B 477 -4.879 -1.986 -9.517 1.00 0.00 C ATOM 1411 CZ PHE B 477 -6.207 -2.224 -9.692 1.00 0.00 C ATOM 0 H PHE B 477 -4.302 -7.553 -7.045 1.00 0.00 H new ATOM 0 HA PHE B 477 -2.966 -5.062 -6.115 1.00 0.00 H new ATOM 0 HB2 PHE B 477 -2.605 -5.087 -8.412 1.00 0.00 H new ATOM 0 HB3 PHE B 477 -3.869 -6.268 -8.692 1.00 0.00 H new ATOM 0 HD1 PHE B 477 -6.289 -5.439 -8.646 1.00 0.00 H new ATOM 0 HD2 PHE B 477 -2.980 -2.821 -8.877 1.00 0.00 H new ATOM 0 HE1 PHE B 477 -7.778 -3.635 -9.527 1.00 0.00 H new ATOM 0 HE2 PHE B 477 -4.468 -1.017 -9.759 1.00 0.00 H new ATOM 0 HZ PHE B 477 -6.850 -1.444 -10.072 1.00 0.00 H new ATOM 1421 N THR B 478 -5.909 -5.885 -5.623 1.00 0.00 N ATOM 1422 CA THR B 478 -7.213 -5.490 -5.116 1.00 0.00 C ATOM 1423 C THR B 478 -7.379 -5.940 -3.663 1.00 0.00 C ATOM 1424 O THR B 478 -6.496 -6.591 -3.106 1.00 0.00 O ATOM 1425 CB THR B 478 -8.277 -6.062 -6.055 1.00 0.00 C ATOM 1426 OG1 THR B 478 -7.719 -7.294 -6.503 1.00 0.00 O ATOM 1427 CG2 THR B 478 -8.434 -5.237 -7.334 1.00 0.00 C ATOM 0 H THR B 478 -5.688 -6.874 -5.507 1.00 0.00 H new ATOM 0 HA THR B 478 -7.320 -4.405 -5.101 1.00 0.00 H new ATOM 0 HB THR B 478 -9.233 -6.109 -5.534 1.00 0.00 H new ATOM 0 HG1 THR B 478 -7.159 -7.132 -7.291 1.00 0.00 H new ATOM 0 HG21 THR B 478 -9.201 -5.686 -7.965 1.00 0.00 H new ATOM 0 HG22 THR B 478 -8.726 -4.219 -7.077 1.00 0.00 H new ATOM 0 HG23 THR B 478 -7.487 -5.217 -7.873 1.00 0.00 H new ATOM 1435 N GLU B 479 -8.517 -5.575 -3.091 1.00 0.00 N ATOM 1436 CA GLU B 479 -8.810 -5.934 -1.714 1.00 0.00 C ATOM 1437 C GLU B 479 -10.204 -6.558 -1.613 1.00 0.00 C ATOM 1438 O GLU B 479 -11.124 -6.148 -2.319 1.00 0.00 O ATOM 1439 CB GLU B 479 -8.686 -4.718 -0.793 1.00 0.00 C ATOM 1440 CG GLU B 479 -8.334 -5.145 0.634 1.00 0.00 C ATOM 1441 CD GLU B 479 -8.093 -3.926 1.527 1.00 0.00 C ATOM 1442 OE1 GLU B 479 -7.019 -3.308 1.365 1.00 0.00 O ATOM 1443 OE2 GLU B 479 -8.988 -3.641 2.351 1.00 0.00 O ATOM 0 H GLU B 479 -9.247 -5.035 -3.556 1.00 0.00 H new ATOM 0 HA GLU B 479 -8.078 -6.673 -1.388 1.00 0.00 H new ATOM 0 HB2 GLU B 479 -7.918 -4.045 -1.175 1.00 0.00 H new ATOM 0 HB3 GLU B 479 -9.624 -4.163 -0.789 1.00 0.00 H new ATOM 0 HG2 GLU B 479 -9.142 -5.749 1.047 1.00 0.00 H new ATOM 0 HG3 GLU B 479 -7.443 -5.772 0.620 1.00 0.00 H new ATOM 1450 N ARG B 480 -10.315 -7.539 -0.730 1.00 0.00 N ATOM 1451 CA ARG B 480 -11.581 -8.223 -0.527 1.00 0.00 C ATOM 1452 C ARG B 480 -12.471 -7.423 0.426 1.00 0.00 C ATOM 1453 O ARG B 480 -12.009 -6.954 1.465 1.00 0.00 O ATOM 1454 CB ARG B 480 -11.363 -9.625 0.046 1.00 0.00 C ATOM 1455 CG ARG B 480 -10.362 -10.414 -0.801 1.00 0.00 C ATOM 1456 CD ARG B 480 -10.745 -11.894 -0.865 1.00 0.00 C ATOM 1457 NE ARG B 480 -9.598 -12.732 -0.451 1.00 0.00 N ATOM 1458 CZ ARG B 480 -9.150 -12.823 0.808 1.00 0.00 C ATOM 1459 NH1 ARG B 480 -9.749 -12.129 1.785 1.00 0.00 N ATOM 1460 NH2 ARG B 480 -8.102 -13.609 1.092 1.00 0.00 N ATOM 0 H ARG B 480 -9.549 -7.877 -0.147 1.00 0.00 H new ATOM 0 HA ARG B 480 -12.070 -8.311 -1.497 1.00 0.00 H new ATOM 0 HB2 ARG B 480 -10.999 -9.550 1.071 1.00 0.00 H new ATOM 0 HB3 ARG B 480 -12.313 -10.158 0.084 1.00 0.00 H new ATOM 0 HG2 ARG B 480 -10.327 -10.000 -1.809 1.00 0.00 H new ATOM 0 HG3 ARG B 480 -9.362 -10.311 -0.379 1.00 0.00 H new ATOM 0 HD2 ARG B 480 -11.599 -12.085 -0.215 1.00 0.00 H new ATOM 0 HD3 ARG B 480 -11.050 -12.156 -1.878 1.00 0.00 H new ATOM 0 HE ARG B 480 -9.118 -13.274 -1.169 1.00 0.00 H new ATOM 0 HH11 ARG B 480 -10.547 -11.531 1.570 1.00 0.00 H new ATOM 0 HH12 ARG B 480 -9.407 -12.199 2.744 1.00 0.00 H new ATOM 0 HH21 ARG B 480 -7.645 -14.138 0.349 1.00 0.00 H new ATOM 0 HH22 ARG B 480 -7.761 -13.678 2.051 1.00 0.00 H new ATOM 1474 N VAL B 481 -13.730 -7.290 0.037 1.00 0.00 N ATOM 1475 CA VAL B 481 -14.689 -6.554 0.844 1.00 0.00 C ATOM 1476 C VAL B 481 -15.605 -7.542 1.568 1.00 0.00 C ATOM 1477 O VAL B 481 -16.357 -8.278 0.932 1.00 0.00 O ATOM 1478 CB VAL B 481 -15.455 -5.560 -0.032 1.00 0.00 C ATOM 1479 CG1 VAL B 481 -16.384 -4.687 0.815 1.00 0.00 C ATOM 1480 CG2 VAL B 481 -14.494 -4.700 -0.855 1.00 0.00 C ATOM 0 H VAL B 481 -14.109 -7.679 -0.826 1.00 0.00 H new ATOM 0 HA VAL B 481 -14.176 -5.968 1.607 1.00 0.00 H new ATOM 0 HB VAL B 481 -16.071 -6.131 -0.727 1.00 0.00 H new ATOM 0 HG11 VAL B 481 -16.917 -3.989 0.169 1.00 0.00 H new ATOM 0 HG12 VAL B 481 -17.102 -5.320 1.336 1.00 0.00 H new ATOM 0 HG13 VAL B 481 -15.795 -4.130 1.544 1.00 0.00 H new ATOM 0 HG21 VAL B 481 -15.064 -4.002 -1.468 1.00 0.00 H new ATOM 0 HG22 VAL B 481 -13.840 -4.143 -0.185 1.00 0.00 H new ATOM 0 HG23 VAL B 481 -13.892 -5.341 -1.499 1.00 0.00 H new ATOM 1490 N PRO B 482 -15.509 -7.525 2.925 1.00 0.00 N ATOM 1491 CA PRO B 482 -16.319 -8.412 3.743 1.00 0.00 C ATOM 1492 C PRO B 482 -17.770 -7.928 3.805 1.00 0.00 C ATOM 1493 O PRO B 482 -18.680 -8.626 3.362 1.00 0.00 O ATOM 1494 CB PRO B 482 -15.639 -8.424 5.102 1.00 0.00 C ATOM 1495 CG PRO B 482 -14.749 -7.192 5.134 1.00 0.00 C ATOM 1496 CD PRO B 482 -14.631 -6.666 3.713 1.00 0.00 C ATOM 0 HA PRO B 482 -16.382 -9.421 3.335 1.00 0.00 H new ATOM 0 HB2 PRO B 482 -16.374 -8.396 5.907 1.00 0.00 H new ATOM 0 HB3 PRO B 482 -15.053 -9.333 5.237 1.00 0.00 H new ATOM 0 HG2 PRO B 482 -15.174 -6.431 5.789 1.00 0.00 H new ATOM 0 HG3 PRO B 482 -13.765 -7.442 5.532 1.00 0.00 H new ATOM 0 HD2 PRO B 482 -14.938 -5.622 3.651 1.00 0.00 H new ATOM 0 HD3 PRO B 482 -13.602 -6.717 3.356 1.00 0.00 H new