USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 986 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 45 LYS NZ :NH3+ -129:sc= 0.398 (180deg=0) USER MOD Single : A 48 MET CE :methyl -145:sc= -3.56! (180deg=-4.75!) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.21 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot -50:sc= 0.139 USER MOD Single : A 73 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.0109) USER MOD Single : A 74 LYS NZ :NH3+ 143:sc= -0.422 (180deg=-2.61!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 1.07 K(o=1.1,f=-0.33) USER MOD Single : A 86 LYS NZ :NH3+ -120:sc= -0.0551 (180deg=-0.422) USER MOD Single : A 91 MET CE :methyl -126:sc= -0.337 (180deg=-2.28) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 ASN :FLIP amide:sc= -0.0131 F(o=-1.1,f=-0.013) USER MOD Single : B 45 LYS NZ :NH3+ -128:sc= 0.425 (180deg=0) USER MOD Single : B 48 MET CE :methyl -156:sc= -3.54! (180deg=-4.57!) USER MOD Single : B 58 THR OG1 : rot 180:sc= -0.187 USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 THR OG1 : rot -49:sc= 0.142 USER MOD Single : B 73 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.0101) USER MOD Single : B 74 LYS NZ :NH3+ 142:sc= -0.363 (180deg=-2.52!) USER MOD Single : B 75 SER OG : rot 180:sc= 0 USER MOD Single : B 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 79 ASN : amide:sc= 1.07 K(o=1.1,f=-0.32) USER MOD Single : B 86 LYS NZ :NH3+ -134:sc= -0.0537 (180deg=-0.425) USER MOD Single : B 91 MET CE :methyl -127:sc= -0.446 (180deg=-2.37!) USER MOD Single : B 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 96 ASN :FLIP amide:sc= -0.0137 F(o=-1.2,f=-0.014) USER MOD ----------------------------------------------------------------- ATOM 357 N PRO A 43 -2.263 -18.079 -7.716 1.00 0.32 N ATOM 358 CA PRO A 43 -1.919 -17.462 -6.418 1.00 0.33 C ATOM 359 C PRO A 43 -2.669 -16.139 -6.239 1.00 0.28 C ATOM 360 O PRO A 43 -3.227 -15.869 -5.192 1.00 0.30 O ATOM 361 CB PRO A 43 -0.418 -17.221 -6.531 1.00 0.36 C ATOM 362 CG PRO A 43 -0.131 -17.116 -8.002 1.00 0.36 C ATOM 363 CD PRO A 43 -1.291 -17.725 -8.756 1.00 0.34 C ATOM 0 HA PRO A 43 -2.187 -18.081 -5.562 1.00 0.33 H new ATOM 0 HB2 PRO A 43 -0.128 -16.309 -6.010 1.00 0.36 H new ATOM 0 HB3 PRO A 43 0.145 -18.038 -6.080 1.00 0.36 H new ATOM 0 HG2 PRO A 43 0.003 -16.073 -8.289 1.00 0.36 H new ATOM 0 HG3 PRO A 43 0.796 -17.636 -8.246 1.00 0.36 H new ATOM 0 HD2 PRO A 43 -1.714 -17.019 -9.470 1.00 0.34 H new ATOM 0 HD3 PRO A 43 -0.979 -18.603 -9.322 1.00 0.34 H new ATOM 371 N LEU A 44 -2.676 -15.314 -7.257 1.00 0.27 N ATOM 372 CA LEU A 44 -3.376 -13.995 -7.175 1.00 0.27 C ATOM 373 C LEU A 44 -2.850 -13.168 -5.996 1.00 0.24 C ATOM 374 O LEU A 44 -3.469 -12.203 -5.586 1.00 0.33 O ATOM 375 CB LEU A 44 -4.857 -14.325 -6.980 1.00 0.33 C ATOM 376 CG LEU A 44 -5.697 -13.079 -7.283 1.00 0.41 C ATOM 377 CD1 LEU A 44 -6.412 -13.252 -8.625 1.00 0.80 C ATOM 378 CD2 LEU A 44 -6.735 -12.881 -6.175 1.00 0.75 C ATOM 0 H LEU A 44 -2.221 -15.501 -8.151 1.00 0.27 H new ATOM 0 HA LEU A 44 -3.209 -13.400 -8.073 1.00 0.27 H new ATOM 0 HB2 LEU A 44 -5.149 -15.143 -7.638 1.00 0.33 H new ATOM 0 HB3 LEU A 44 -5.036 -14.659 -5.958 1.00 0.33 H new ATOM 0 HG LEU A 44 -5.044 -12.208 -7.332 1.00 0.41 H new ATOM 0 HD11 LEU A 44 -7.008 -12.364 -8.837 1.00 0.80 H new ATOM 0 HD12 LEU A 44 -5.674 -13.391 -9.415 1.00 0.80 H new ATOM 0 HD13 LEU A 44 -7.064 -14.124 -8.580 1.00 0.80 H new ATOM 0 HD21 LEU A 44 -7.332 -11.995 -6.390 1.00 0.75 H new ATOM 0 HD22 LEU A 44 -7.386 -13.754 -6.126 1.00 0.75 H new ATOM 0 HD23 LEU A 44 -6.227 -12.753 -5.219 1.00 0.75 H new ATOM 390 N LYS A 45 -1.709 -13.524 -5.460 1.00 0.24 N ATOM 391 CA LYS A 45 -1.140 -12.741 -4.324 1.00 0.24 C ATOM 392 C LYS A 45 -0.427 -11.505 -4.876 1.00 0.24 C ATOM 393 O LYS A 45 -0.319 -10.498 -4.213 1.00 0.29 O ATOM 394 CB LYS A 45 -0.153 -13.685 -3.627 1.00 0.30 C ATOM 395 CG LYS A 45 0.996 -14.038 -4.576 1.00 0.44 C ATOM 396 CD LYS A 45 2.074 -14.808 -3.810 1.00 0.51 C ATOM 397 CE LYS A 45 1.518 -16.163 -3.369 1.00 0.46 C ATOM 398 NZ LYS A 45 2.715 -17.029 -3.187 1.00 0.43 N ATOM 0 H LYS A 45 -1.149 -14.322 -5.760 1.00 0.24 H new ATOM 0 HA LYS A 45 -1.902 -12.393 -3.626 1.00 0.24 H new ATOM 0 HB2 LYS A 45 0.240 -13.213 -2.727 1.00 0.30 H new ATOM 0 HB3 LYS A 45 -0.667 -14.593 -3.312 1.00 0.30 H new ATOM 0 HG2 LYS A 45 0.625 -14.640 -5.405 1.00 0.44 H new ATOM 0 HG3 LYS A 45 1.419 -13.130 -5.005 1.00 0.44 H new ATOM 0 HD2 LYS A 45 2.951 -14.951 -4.441 1.00 0.51 H new ATOM 0 HD3 LYS A 45 2.397 -14.235 -2.941 1.00 0.51 H new ATOM 0 HE2 LYS A 45 0.950 -16.074 -2.443 1.00 0.46 H new ATOM 0 HE3 LYS A 45 0.843 -16.575 -4.118 1.00 0.46 H new ATOM 0 HZ1 LYS A 45 2.583 -17.919 -3.709 1.00 0.43 H new ATOM 0 HZ2 LYS A 45 3.557 -16.537 -3.548 1.00 0.43 H new ATOM 0 HZ3 LYS A 45 2.843 -17.237 -2.176 1.00 0.43 H new ATOM 412 N LEU A 46 0.051 -11.597 -6.095 1.00 0.24 N ATOM 413 CA LEU A 46 0.765 -10.456 -6.759 1.00 0.26 C ATOM 414 C LEU A 46 0.152 -9.096 -6.374 1.00 0.25 C ATOM 415 O LEU A 46 0.859 -8.126 -6.159 1.00 0.29 O ATOM 416 CB LEU A 46 0.559 -10.711 -8.260 1.00 0.29 C ATOM 417 CG LEU A 46 1.891 -10.616 -9.013 1.00 0.38 C ATOM 418 CD1 LEU A 46 2.604 -9.305 -8.663 1.00 0.50 C ATOM 419 CD2 LEU A 46 2.777 -11.805 -8.632 1.00 0.48 C ATOM 0 H LEU A 46 -0.025 -12.435 -6.672 1.00 0.24 H new ATOM 0 HA LEU A 46 1.813 -10.411 -6.463 1.00 0.26 H new ATOM 0 HB2 LEU A 46 0.120 -11.698 -8.410 1.00 0.29 H new ATOM 0 HB3 LEU A 46 -0.146 -9.984 -8.664 1.00 0.29 H new ATOM 0 HG LEU A 46 1.697 -10.634 -10.085 1.00 0.38 H new ATOM 0 HD11 LEU A 46 3.549 -9.249 -9.204 1.00 0.50 H new ATOM 0 HD12 LEU A 46 1.974 -8.462 -8.945 1.00 0.50 H new ATOM 0 HD13 LEU A 46 2.797 -9.271 -7.591 1.00 0.50 H new ATOM 0 HD21 LEU A 46 3.725 -11.739 -9.167 1.00 0.48 H new ATOM 0 HD22 LEU A 46 2.964 -11.790 -7.558 1.00 0.48 H new ATOM 0 HD23 LEU A 46 2.274 -12.734 -8.899 1.00 0.48 H new ATOM 431 N PHE A 47 -1.154 -9.026 -6.282 1.00 0.23 N ATOM 432 CA PHE A 47 -1.822 -7.741 -5.919 1.00 0.23 C ATOM 433 C PHE A 47 -1.667 -7.490 -4.422 1.00 0.22 C ATOM 434 O PHE A 47 -1.311 -6.408 -3.995 1.00 0.26 O ATOM 435 CB PHE A 47 -3.296 -7.949 -6.305 1.00 0.25 C ATOM 436 CG PHE A 47 -4.194 -7.020 -5.515 1.00 0.23 C ATOM 437 CD1 PHE A 47 -3.852 -5.671 -5.355 1.00 0.27 C ATOM 438 CD2 PHE A 47 -5.373 -7.515 -4.944 1.00 0.27 C ATOM 439 CE1 PHE A 47 -4.689 -4.820 -4.624 1.00 0.33 C ATOM 440 CE2 PHE A 47 -6.209 -6.663 -4.213 1.00 0.32 C ATOM 441 CZ PHE A 47 -5.867 -5.316 -4.053 1.00 0.34 C ATOM 0 H PHE A 47 -1.787 -9.809 -6.444 1.00 0.23 H new ATOM 0 HA PHE A 47 -1.396 -6.875 -6.426 1.00 0.23 H new ATOM 0 HB2 PHE A 47 -3.426 -7.768 -7.372 1.00 0.25 H new ATOM 0 HB3 PHE A 47 -3.583 -8.984 -6.120 1.00 0.25 H new ATOM 0 HD1 PHE A 47 -2.943 -5.288 -5.795 1.00 0.27 H new ATOM 0 HD2 PHE A 47 -5.637 -8.555 -5.068 1.00 0.27 H new ATOM 0 HE1 PHE A 47 -4.426 -3.780 -4.500 1.00 0.33 H new ATOM 0 HE2 PHE A 47 -7.118 -7.045 -3.773 1.00 0.32 H new ATOM 0 HZ PHE A 47 -6.512 -4.659 -3.489 1.00 0.34 H new ATOM 451 N MET A 48 -1.927 -8.491 -3.629 1.00 0.22 N ATOM 452 CA MET A 48 -1.793 -8.334 -2.156 1.00 0.25 C ATOM 453 C MET A 48 -0.331 -8.076 -1.792 1.00 0.26 C ATOM 454 O MET A 48 -0.025 -7.184 -1.032 1.00 0.31 O ATOM 455 CB MET A 48 -2.267 -9.665 -1.570 1.00 0.28 C ATOM 456 CG MET A 48 -3.307 -9.399 -0.484 1.00 0.35 C ATOM 457 SD MET A 48 -4.901 -10.103 -0.971 1.00 0.38 S ATOM 458 CE MET A 48 -5.148 -9.075 -2.437 1.00 0.37 C ATOM 0 H MET A 48 -2.228 -9.415 -3.940 1.00 0.22 H new ATOM 0 HA MET A 48 -2.372 -7.494 -1.772 1.00 0.25 H new ATOM 0 HB2 MET A 48 -2.696 -10.288 -2.355 1.00 0.28 H new ATOM 0 HB3 MET A 48 -1.422 -10.213 -1.153 1.00 0.28 H new ATOM 0 HG2 MET A 48 -2.980 -9.836 0.460 1.00 0.35 H new ATOM 0 HG3 MET A 48 -3.408 -8.326 -0.320 1.00 0.35 H new ATOM 0 HE1 MET A 48 -6.209 -8.852 -2.551 1.00 0.37 H new ATOM 0 HE2 MET A 48 -4.591 -8.144 -2.327 1.00 0.37 H new ATOM 0 HE3 MET A 48 -4.793 -9.608 -3.319 1.00 0.37 H new ATOM 468 N ALA A 49 0.567 -8.858 -2.331 1.00 0.26 N ATOM 469 CA ALA A 49 2.020 -8.681 -2.028 1.00 0.29 C ATOM 470 C ALA A 49 2.476 -7.256 -2.355 1.00 0.28 C ATOM 471 O ALA A 49 3.082 -6.592 -1.535 1.00 0.35 O ATOM 472 CB ALA A 49 2.738 -9.690 -2.928 1.00 0.33 C ATOM 0 H ALA A 49 0.354 -9.620 -2.975 1.00 0.26 H new ATOM 0 HA ALA A 49 2.236 -8.842 -0.972 1.00 0.29 H new ATOM 0 HB1 ALA A 49 3.814 -9.622 -2.765 1.00 0.33 H new ATOM 0 HB2 ALA A 49 2.397 -10.697 -2.689 1.00 0.33 H new ATOM 0 HB3 ALA A 49 2.515 -9.469 -3.972 1.00 0.33 H new ATOM 478 N LEU A 50 2.201 -6.785 -3.547 1.00 0.25 N ATOM 479 CA LEU A 50 2.636 -5.403 -3.921 1.00 0.27 C ATOM 480 C LEU A 50 2.029 -4.364 -2.972 1.00 0.25 C ATOM 481 O LEU A 50 2.741 -3.636 -2.303 1.00 0.31 O ATOM 482 CB LEU A 50 2.128 -5.190 -5.346 1.00 0.31 C ATOM 483 CG LEU A 50 3.137 -4.338 -6.118 1.00 0.40 C ATOM 484 CD1 LEU A 50 4.443 -5.118 -6.284 1.00 0.52 C ATOM 485 CD2 LEU A 50 2.567 -3.998 -7.496 1.00 0.56 C ATOM 0 H LEU A 50 1.697 -7.294 -4.273 1.00 0.25 H new ATOM 0 HA LEU A 50 3.718 -5.290 -3.854 1.00 0.27 H new ATOM 0 HB2 LEU A 50 1.990 -6.150 -5.843 1.00 0.31 H new ATOM 0 HB3 LEU A 50 1.156 -4.697 -5.328 1.00 0.31 H new ATOM 0 HG LEU A 50 3.332 -3.417 -5.568 1.00 0.40 H new ATOM 0 HD11 LEU A 50 5.162 -4.511 -6.834 1.00 0.52 H new ATOM 0 HD12 LEU A 50 4.849 -5.361 -5.302 1.00 0.52 H new ATOM 0 HD13 LEU A 50 4.249 -6.039 -6.834 1.00 0.52 H new ATOM 0 HD21 LEU A 50 3.285 -3.391 -8.047 1.00 0.56 H new ATOM 0 HD22 LEU A 50 2.372 -4.918 -8.046 1.00 0.56 H new ATOM 0 HD23 LEU A 50 1.637 -3.442 -7.378 1.00 0.56 H new ATOM 497 N VAL A 51 0.722 -4.283 -2.911 1.00 0.23 N ATOM 498 CA VAL A 51 0.071 -3.288 -2.013 1.00 0.24 C ATOM 499 C VAL A 51 0.502 -3.522 -0.560 1.00 0.24 C ATOM 500 O VAL A 51 0.709 -2.585 0.182 1.00 0.27 O ATOM 501 CB VAL A 51 -1.432 -3.523 -2.202 1.00 0.25 C ATOM 502 CG1 VAL A 51 -2.219 -2.770 -1.132 1.00 0.30 C ATOM 503 CG2 VAL A 51 -1.848 -3.017 -3.585 1.00 0.35 C ATOM 0 H VAL A 51 0.079 -4.866 -3.447 1.00 0.23 H new ATOM 0 HA VAL A 51 0.348 -2.260 -2.247 1.00 0.24 H new ATOM 0 HB VAL A 51 -1.643 -4.589 -2.115 1.00 0.25 H new ATOM 0 HG11 VAL A 51 -3.286 -2.944 -1.275 1.00 0.30 H new ATOM 0 HG12 VAL A 51 -1.923 -3.125 -0.145 1.00 0.30 H new ATOM 0 HG13 VAL A 51 -2.011 -1.703 -1.211 1.00 0.30 H new ATOM 0 HG21 VAL A 51 -2.916 -3.181 -3.726 1.00 0.35 H new ATOM 0 HG22 VAL A 51 -1.631 -1.952 -3.663 1.00 0.35 H new ATOM 0 HG23 VAL A 51 -1.293 -3.557 -4.352 1.00 0.35 H new ATOM 513 N ALA A 52 0.646 -4.760 -0.155 1.00 0.24 N ATOM 514 CA ALA A 52 1.070 -5.050 1.252 1.00 0.25 C ATOM 515 C ALA A 52 2.440 -4.426 1.526 1.00 0.25 C ATOM 516 O ALA A 52 2.610 -3.679 2.473 1.00 0.27 O ATOM 517 CB ALA A 52 1.148 -6.574 1.346 1.00 0.30 C ATOM 0 H ALA A 52 0.489 -5.583 -0.737 1.00 0.24 H new ATOM 0 HA ALA A 52 0.376 -4.636 1.983 1.00 0.25 H new ATOM 0 HB1 ALA A 52 1.454 -6.861 2.352 1.00 0.30 H new ATOM 0 HB2 ALA A 52 0.170 -7.003 1.128 1.00 0.30 H new ATOM 0 HB3 ALA A 52 1.876 -6.946 0.625 1.00 0.30 H new ATOM 523 N PHE A 53 3.411 -4.722 0.694 1.00 0.25 N ATOM 524 CA PHE A 53 4.779 -4.141 0.878 1.00 0.27 C ATOM 525 C PHE A 53 4.660 -2.625 1.057 1.00 0.26 C ATOM 526 O PHE A 53 5.113 -2.056 2.039 1.00 0.29 O ATOM 527 CB PHE A 53 5.519 -4.491 -0.420 1.00 0.32 C ATOM 528 CG PHE A 53 6.798 -3.694 -0.530 1.00 0.34 C ATOM 529 CD1 PHE A 53 7.918 -4.056 0.226 1.00 0.42 C ATOM 530 CD2 PHE A 53 6.863 -2.596 -1.396 1.00 0.56 C ATOM 531 CE1 PHE A 53 9.103 -3.318 0.118 1.00 0.44 C ATOM 532 CE2 PHE A 53 8.047 -1.859 -1.505 1.00 0.61 C ATOM 533 CZ PHE A 53 9.168 -2.220 -0.748 1.00 0.45 C ATOM 0 H PHE A 53 3.314 -5.344 -0.108 1.00 0.25 H new ATOM 0 HA PHE A 53 5.302 -4.525 1.754 1.00 0.27 H new ATOM 0 HB2 PHE A 53 5.745 -5.557 -0.441 1.00 0.32 H new ATOM 0 HB3 PHE A 53 4.879 -4.284 -1.278 1.00 0.32 H new ATOM 0 HD1 PHE A 53 7.869 -4.904 0.893 1.00 0.42 H new ATOM 0 HD2 PHE A 53 5.998 -2.318 -1.980 1.00 0.56 H new ATOM 0 HE1 PHE A 53 9.967 -3.596 0.703 1.00 0.44 H new ATOM 0 HE2 PHE A 53 8.096 -1.012 -2.173 1.00 0.61 H new ATOM 0 HZ PHE A 53 10.083 -1.652 -0.832 1.00 0.45 H new ATOM 543 N LEU A 54 4.017 -1.976 0.125 1.00 0.26 N ATOM 544 CA LEU A 54 3.828 -0.504 0.237 1.00 0.29 C ATOM 545 C LEU A 54 3.061 -0.199 1.527 1.00 0.27 C ATOM 546 O LEU A 54 3.350 0.756 2.219 1.00 0.30 O ATOM 547 CB LEU A 54 3.007 -0.109 -0.995 1.00 0.31 C ATOM 548 CG LEU A 54 3.721 -0.570 -2.269 1.00 0.37 C ATOM 549 CD1 LEU A 54 2.799 -0.361 -3.470 1.00 0.46 C ATOM 550 CD2 LEU A 54 5.002 0.245 -2.459 1.00 0.49 C ATOM 0 H LEU A 54 3.615 -2.403 -0.709 1.00 0.26 H new ATOM 0 HA LEU A 54 4.768 0.046 0.275 1.00 0.29 H new ATOM 0 HB2 LEU A 54 2.015 -0.558 -0.941 1.00 0.31 H new ATOM 0 HB3 LEU A 54 2.866 0.972 -1.018 1.00 0.31 H new ATOM 0 HG LEU A 54 3.974 -1.627 -2.184 1.00 0.37 H new ATOM 0 HD11 LEU A 54 3.305 -0.688 -4.378 1.00 0.46 H new ATOM 0 HD12 LEU A 54 1.887 -0.941 -3.334 1.00 0.46 H new ATOM 0 HD13 LEU A 54 2.547 0.696 -3.556 1.00 0.46 H new ATOM 0 HD21 LEU A 54 5.511 -0.083 -3.366 1.00 0.49 H new ATOM 0 HD22 LEU A 54 4.751 1.302 -2.546 1.00 0.49 H new ATOM 0 HD23 LEU A 54 5.658 0.097 -1.601 1.00 0.49 H new ATOM 562 N ARG A 55 2.096 -1.025 1.856 1.00 0.26 N ATOM 563 CA ARG A 55 1.304 -0.811 3.106 1.00 0.27 C ATOM 564 C ARG A 55 2.190 -1.000 4.341 1.00 0.28 C ATOM 565 O ARG A 55 1.825 -0.622 5.438 1.00 0.33 O ATOM 566 CB ARG A 55 0.197 -1.867 3.073 1.00 0.29 C ATOM 567 CG ARG A 55 -0.927 -1.463 4.030 1.00 0.34 C ATOM 568 CD ARG A 55 -0.820 -2.276 5.320 1.00 0.39 C ATOM 569 NE ARG A 55 -1.211 -1.331 6.402 1.00 0.34 N ATOM 570 CZ ARG A 55 -0.720 -1.473 7.602 1.00 0.34 C ATOM 571 NH1 ARG A 55 0.477 -1.031 7.873 1.00 0.35 N ATOM 572 NH2 ARG A 55 -1.426 -2.057 8.530 1.00 0.47 N ATOM 0 H ARG A 55 1.823 -1.841 1.309 1.00 0.26 H new ATOM 0 HA ARG A 55 0.898 0.199 3.160 1.00 0.27 H new ATOM 0 HB2 ARG A 55 -0.193 -1.968 2.060 1.00 0.29 H new ATOM 0 HB3 ARG A 55 0.599 -2.839 3.358 1.00 0.29 H new ATOM 0 HG2 ARG A 55 -0.863 -0.398 4.253 1.00 0.34 H new ATOM 0 HG3 ARG A 55 -1.896 -1.633 3.561 1.00 0.34 H new ATOM 0 HD2 ARG A 55 -1.479 -3.144 5.296 1.00 0.39 H new ATOM 0 HD3 ARG A 55 0.193 -2.650 5.469 1.00 0.39 H new ATOM 0 HE ARG A 55 -1.863 -0.572 6.205 1.00 0.34 H new ATOM 0 HH11 ARG A 55 1.029 -0.574 7.147 1.00 0.35 H new ATOM 0 HH12 ARG A 55 0.861 -1.142 8.811 1.00 0.35 H new ATOM 0 HH21 ARG A 55 -2.362 -2.403 8.317 1.00 0.47 H new ATOM 0 HH22 ARG A 55 -1.042 -2.168 9.469 1.00 0.47 H new ATOM 586 N PHE A 56 3.351 -1.578 4.176 1.00 0.28 N ATOM 587 CA PHE A 56 4.252 -1.779 5.347 1.00 0.32 C ATOM 588 C PHE A 56 5.253 -0.628 5.449 1.00 0.33 C ATOM 589 O PHE A 56 5.819 -0.386 6.499 1.00 0.37 O ATOM 590 CB PHE A 56 4.994 -3.092 5.080 1.00 0.33 C ATOM 591 CG PHE A 56 4.014 -4.236 4.907 1.00 0.33 C ATOM 592 CD1 PHE A 56 2.782 -4.236 5.581 1.00 0.50 C ATOM 593 CD2 PHE A 56 4.350 -5.307 4.070 1.00 0.43 C ATOM 594 CE1 PHE A 56 1.894 -5.305 5.415 1.00 0.61 C ATOM 595 CE2 PHE A 56 3.460 -6.375 3.905 1.00 0.50 C ATOM 596 CZ PHE A 56 2.233 -6.373 4.578 1.00 0.54 C ATOM 0 H PHE A 56 3.712 -1.918 3.285 1.00 0.28 H new ATOM 0 HA PHE A 56 3.692 -1.811 6.282 1.00 0.32 H new ATOM 0 HB2 PHE A 56 5.607 -2.993 4.184 1.00 0.33 H new ATOM 0 HB3 PHE A 56 5.670 -3.308 5.907 1.00 0.33 H new ATOM 0 HD1 PHE A 56 2.520 -3.411 6.227 1.00 0.50 H new ATOM 0 HD2 PHE A 56 5.297 -5.309 3.551 1.00 0.43 H new ATOM 0 HE1 PHE A 56 0.947 -5.305 5.933 1.00 0.61 H new ATOM 0 HE2 PHE A 56 3.720 -7.200 3.259 1.00 0.50 H new ATOM 0 HZ PHE A 56 1.547 -7.197 4.451 1.00 0.54 H new ATOM 606 N LEU A 57 5.501 0.067 4.363 1.00 0.33 N ATOM 607 CA LEU A 57 6.501 1.181 4.411 1.00 0.37 C ATOM 608 C LEU A 57 5.836 2.567 4.359 1.00 0.40 C ATOM 609 O LEU A 57 6.292 3.490 5.007 1.00 0.45 O ATOM 610 CB LEU A 57 7.394 0.973 3.183 1.00 0.41 C ATOM 611 CG LEU A 57 7.735 -0.514 3.026 1.00 0.39 C ATOM 612 CD1 LEU A 57 8.606 -0.713 1.783 1.00 0.49 C ATOM 613 CD2 LEU A 57 8.487 -1.009 4.268 1.00 0.43 C ATOM 0 H LEU A 57 5.060 -0.087 3.456 1.00 0.33 H new ATOM 0 HA LEU A 57 7.059 1.158 5.347 1.00 0.37 H new ATOM 0 HB2 LEU A 57 6.886 1.334 2.289 1.00 0.41 H new ATOM 0 HB3 LEU A 57 8.310 1.555 3.287 1.00 0.41 H new ATOM 0 HG LEU A 57 6.812 -1.084 2.916 1.00 0.39 H new ATOM 0 HD11 LEU A 57 8.847 -1.770 1.673 1.00 0.49 H new ATOM 0 HD12 LEU A 57 8.065 -0.371 0.901 1.00 0.49 H new ATOM 0 HD13 LEU A 57 9.527 -0.140 1.889 1.00 0.49 H new ATOM 0 HD21 LEU A 57 8.727 -2.066 4.151 1.00 0.43 H new ATOM 0 HD22 LEU A 57 9.408 -0.439 4.387 1.00 0.43 H new ATOM 0 HD23 LEU A 57 7.861 -0.874 5.150 1.00 0.43 H new ATOM 625 N THR A 58 4.788 2.740 3.586 1.00 0.39 N ATOM 626 CA THR A 58 4.148 4.095 3.505 1.00 0.44 C ATOM 627 C THR A 58 2.624 4.017 3.310 1.00 0.40 C ATOM 628 O THR A 58 1.940 5.020 3.391 1.00 0.48 O ATOM 629 CB THR A 58 4.803 4.750 2.289 1.00 0.51 C ATOM 630 OG1 THR A 58 6.211 4.784 2.472 1.00 0.91 O ATOM 631 CG2 THR A 58 4.273 6.173 2.128 1.00 0.78 C ATOM 0 H THR A 58 4.353 2.014 3.016 1.00 0.39 H new ATOM 0 HA THR A 58 4.292 4.654 4.429 1.00 0.44 H new ATOM 0 HB THR A 58 4.567 4.174 1.394 1.00 0.51 H new ATOM 0 HG1 THR A 58 6.632 5.202 1.692 1.00 0.91 H new ATOM 0 HG21 THR A 58 4.740 6.639 1.261 1.00 0.78 H new ATOM 0 HG22 THR A 58 3.193 6.145 1.987 1.00 0.78 H new ATOM 0 HG23 THR A 58 4.507 6.752 3.022 1.00 0.78 H new ATOM 639 N ILE A 59 2.092 2.850 3.051 1.00 0.34 N ATOM 640 CA ILE A 59 0.615 2.706 2.846 1.00 0.33 C ATOM 641 C ILE A 59 0.102 3.692 1.780 1.00 0.34 C ATOM 642 O ILE A 59 -0.731 4.533 2.062 1.00 0.39 O ATOM 643 CB ILE A 59 -0.016 3.001 4.211 1.00 0.37 C ATOM 644 CG1 ILE A 59 0.463 1.971 5.237 1.00 0.37 C ATOM 645 CG2 ILE A 59 -1.545 2.924 4.095 1.00 0.39 C ATOM 646 CD1 ILE A 59 1.848 2.362 5.760 1.00 0.41 C ATOM 0 H ILE A 59 2.621 1.982 2.972 1.00 0.34 H new ATOM 0 HA ILE A 59 0.357 1.710 2.486 1.00 0.33 H new ATOM 0 HB ILE A 59 0.280 3.999 4.534 1.00 0.37 H new ATOM 0 HG12 ILE A 59 -0.245 1.912 6.064 1.00 0.37 H new ATOM 0 HG13 ILE A 59 0.503 0.982 4.781 1.00 0.37 H new ATOM 0 HG21 ILE A 59 -1.995 3.134 5.066 1.00 0.39 H new ATOM 0 HG22 ILE A 59 -1.892 3.658 3.368 1.00 0.39 H new ATOM 0 HG23 ILE A 59 -1.835 1.925 3.769 1.00 0.39 H new ATOM 0 HD11 ILE A 59 2.183 1.625 6.490 1.00 0.41 H new ATOM 0 HD12 ILE A 59 2.554 2.397 4.930 1.00 0.41 H new ATOM 0 HD13 ILE A 59 1.795 3.343 6.233 1.00 0.41 H new ATOM 658 N PRO A 60 0.612 3.550 0.580 1.00 0.34 N ATOM 659 CA PRO A 60 0.201 4.395 -0.553 1.00 0.37 C ATOM 660 C PRO A 60 -0.725 3.603 -1.508 1.00 0.34 C ATOM 661 O PRO A 60 -0.362 3.363 -2.646 1.00 0.38 O ATOM 662 CB PRO A 60 1.547 4.654 -1.232 1.00 0.44 C ATOM 663 CG PRO A 60 2.420 3.477 -0.850 1.00 0.43 C ATOM 664 CD PRO A 60 1.649 2.633 0.144 1.00 0.36 C ATOM 0 HA PRO A 60 -0.348 5.292 -0.268 1.00 0.37 H new ATOM 0 HB2 PRO A 60 1.435 4.726 -2.314 1.00 0.44 H new ATOM 0 HB3 PRO A 60 1.984 5.594 -0.894 1.00 0.44 H new ATOM 0 HG2 PRO A 60 2.677 2.890 -1.732 1.00 0.43 H new ATOM 0 HG3 PRO A 60 3.357 3.822 -0.413 1.00 0.43 H new ATOM 0 HD2 PRO A 60 1.234 1.737 -0.317 1.00 0.36 H new ATOM 0 HD3 PRO A 60 2.276 2.303 0.972 1.00 0.36 H new ATOM 672 N PRO A 61 -1.887 3.202 -1.032 1.00 0.31 N ATOM 673 CA PRO A 61 -2.814 2.425 -1.891 1.00 0.30 C ATOM 674 C PRO A 61 -3.413 3.321 -2.977 1.00 0.30 C ATOM 675 O PRO A 61 -4.172 4.228 -2.694 1.00 0.35 O ATOM 676 CB PRO A 61 -3.890 1.941 -0.928 1.00 0.31 C ATOM 677 CG PRO A 61 -3.867 2.922 0.194 1.00 0.33 C ATOM 678 CD PRO A 61 -2.449 3.422 0.306 1.00 0.35 C ATOM 0 HA PRO A 61 -2.323 1.603 -2.412 1.00 0.30 H new ATOM 0 HB2 PRO A 61 -4.868 1.913 -1.409 1.00 0.31 H new ATOM 0 HB3 PRO A 61 -3.680 0.931 -0.575 1.00 0.31 H new ATOM 0 HG2 PRO A 61 -4.554 3.746 0.001 1.00 0.33 H new ATOM 0 HG3 PRO A 61 -4.186 2.453 1.125 1.00 0.33 H new ATOM 0 HD2 PRO A 61 -2.418 4.476 0.583 1.00 0.35 H new ATOM 0 HD3 PRO A 61 -1.892 2.876 1.067 1.00 0.35 H new ATOM 686 N THR A 62 -3.073 3.070 -4.215 1.00 0.31 N ATOM 687 CA THR A 62 -3.615 3.901 -5.332 1.00 0.33 C ATOM 688 C THR A 62 -5.151 3.844 -5.326 1.00 0.34 C ATOM 689 O THR A 62 -5.742 3.011 -4.667 1.00 0.35 O ATOM 690 CB THR A 62 -3.012 3.284 -6.609 1.00 0.35 C ATOM 691 OG1 THR A 62 -2.211 4.258 -7.260 1.00 0.40 O ATOM 692 CG2 THR A 62 -4.112 2.818 -7.567 1.00 0.39 C ATOM 0 H THR A 62 -2.441 2.322 -4.501 1.00 0.31 H new ATOM 0 HA THR A 62 -3.355 4.956 -5.250 1.00 0.33 H new ATOM 0 HB THR A 62 -2.410 2.420 -6.327 1.00 0.35 H new ATOM 0 HG1 THR A 62 -1.823 3.872 -8.073 1.00 0.40 H new ATOM 0 HG21 THR A 62 -3.659 2.387 -8.460 1.00 0.39 H new ATOM 0 HG22 THR A 62 -4.729 2.067 -7.074 1.00 0.39 H new ATOM 0 HG23 THR A 62 -4.732 3.668 -7.850 1.00 0.39 H new ATOM 700 N ALA A 63 -5.789 4.735 -6.046 1.00 0.38 N ATOM 701 CA ALA A 63 -7.288 4.765 -6.088 1.00 0.41 C ATOM 702 C ALA A 63 -7.864 3.373 -6.377 1.00 0.38 C ATOM 703 O ALA A 63 -8.807 2.941 -5.740 1.00 0.41 O ATOM 704 CB ALA A 63 -7.632 5.730 -7.226 1.00 0.49 C ATOM 0 H ALA A 63 -5.332 5.450 -6.612 1.00 0.38 H new ATOM 0 HA ALA A 63 -7.710 5.079 -5.133 1.00 0.41 H new ATOM 0 HB1 ALA A 63 -8.715 5.808 -7.322 1.00 0.49 H new ATOM 0 HB2 ALA A 63 -7.216 6.713 -7.008 1.00 0.49 H new ATOM 0 HB3 ALA A 63 -7.211 5.357 -8.159 1.00 0.49 H new ATOM 710 N GLY A 64 -7.311 2.677 -7.336 1.00 0.37 N ATOM 711 CA GLY A 64 -7.824 1.319 -7.680 1.00 0.37 C ATOM 712 C GLY A 64 -7.782 0.406 -6.453 1.00 0.32 C ATOM 713 O GLY A 64 -8.722 -0.305 -6.178 1.00 0.34 O ATOM 0 H GLY A 64 -6.521 2.994 -7.899 1.00 0.37 H new ATOM 0 HA2 GLY A 64 -8.846 1.393 -8.051 1.00 0.37 H new ATOM 0 HA3 GLY A 64 -7.224 0.889 -8.482 1.00 0.37 H new ATOM 717 N ILE A 65 -6.695 0.414 -5.723 1.00 0.28 N ATOM 718 CA ILE A 65 -6.578 -0.464 -4.510 1.00 0.25 C ATOM 719 C ILE A 65 -7.826 -0.336 -3.630 1.00 0.26 C ATOM 720 O ILE A 65 -8.295 -1.306 -3.068 1.00 0.31 O ATOM 721 CB ILE A 65 -5.336 0.032 -3.751 1.00 0.24 C ATOM 722 CG1 ILE A 65 -4.120 0.117 -4.691 1.00 0.28 C ATOM 723 CG2 ILE A 65 -5.016 -0.934 -2.603 1.00 0.26 C ATOM 724 CD1 ILE A 65 -3.989 -1.169 -5.517 1.00 0.30 C ATOM 0 H ILE A 65 -5.877 0.993 -5.913 1.00 0.28 H new ATOM 0 HA ILE A 65 -6.488 -1.515 -4.786 1.00 0.25 H new ATOM 0 HB ILE A 65 -5.547 1.026 -3.357 1.00 0.24 H new ATOM 0 HG12 ILE A 65 -4.226 0.974 -5.356 1.00 0.28 H new ATOM 0 HG13 ILE A 65 -3.213 0.276 -4.108 1.00 0.28 H new ATOM 0 HG21 ILE A 65 -4.136 -0.582 -2.066 1.00 0.26 H new ATOM 0 HG22 ILE A 65 -5.864 -0.980 -1.920 1.00 0.26 H new ATOM 0 HG23 ILE A 65 -4.821 -1.927 -3.007 1.00 0.26 H new ATOM 0 HD11 ILE A 65 -3.124 -1.092 -6.176 1.00 0.30 H new ATOM 0 HD12 ILE A 65 -3.860 -2.020 -4.848 1.00 0.30 H new ATOM 0 HD13 ILE A 65 -4.889 -1.311 -6.115 1.00 0.30 H new ATOM 736 N LEU A 66 -8.367 0.851 -3.515 1.00 0.27 N ATOM 737 CA LEU A 66 -9.587 1.044 -2.672 1.00 0.30 C ATOM 738 C LEU A 66 -10.838 0.654 -3.462 1.00 0.30 C ATOM 739 O LEU A 66 -11.658 -0.116 -2.998 1.00 0.35 O ATOM 740 CB LEU A 66 -9.621 2.538 -2.325 1.00 0.36 C ATOM 741 CG LEU A 66 -8.543 2.885 -1.286 1.00 0.38 C ATOM 742 CD1 LEU A 66 -8.699 2.009 -0.038 1.00 0.57 C ATOM 743 CD2 LEU A 66 -7.155 2.667 -1.892 1.00 0.36 C ATOM 0 H LEU A 66 -8.017 1.695 -3.968 1.00 0.27 H new ATOM 0 HA LEU A 66 -9.562 0.425 -1.775 1.00 0.30 H new ATOM 0 HB2 LEU A 66 -9.465 3.129 -3.228 1.00 0.36 H new ATOM 0 HB3 LEU A 66 -10.604 2.803 -1.937 1.00 0.36 H new ATOM 0 HG LEU A 66 -8.659 3.930 -0.999 1.00 0.38 H new ATOM 0 HD11 LEU A 66 -7.928 2.268 0.687 1.00 0.57 H new ATOM 0 HD12 LEU A 66 -9.682 2.175 0.403 1.00 0.57 H new ATOM 0 HD13 LEU A 66 -8.599 0.960 -0.315 1.00 0.57 H new ATOM 0 HD21 LEU A 66 -6.393 2.914 -1.153 1.00 0.36 H new ATOM 0 HD22 LEU A 66 -7.048 1.624 -2.190 1.00 0.36 H new ATOM 0 HD23 LEU A 66 -7.035 3.308 -2.766 1.00 0.36 H new ATOM 755 N LYS A 67 -10.987 1.179 -4.653 1.00 0.31 N ATOM 756 CA LYS A 67 -12.183 0.841 -5.485 1.00 0.35 C ATOM 757 C LYS A 67 -12.259 -0.672 -5.696 1.00 0.34 C ATOM 758 O LYS A 67 -13.329 -1.249 -5.750 1.00 0.40 O ATOM 759 CB LYS A 67 -11.956 1.558 -6.817 1.00 0.39 C ATOM 760 CG LYS A 67 -12.458 3.000 -6.713 1.00 0.48 C ATOM 761 CD LYS A 67 -13.986 3.013 -6.763 1.00 0.62 C ATOM 762 CE LYS A 67 -14.452 2.805 -8.206 1.00 0.89 C ATOM 763 NZ LYS A 67 -15.830 2.253 -8.089 1.00 1.21 N ATOM 0 H LYS A 67 -10.330 1.829 -5.086 1.00 0.31 H new ATOM 0 HA LYS A 67 -13.117 1.147 -5.014 1.00 0.35 H new ATOM 0 HB2 LYS A 67 -10.896 1.548 -7.071 1.00 0.39 H new ATOM 0 HB3 LYS A 67 -12.481 1.036 -7.617 1.00 0.39 H new ATOM 0 HG2 LYS A 67 -12.110 3.451 -5.784 1.00 0.48 H new ATOM 0 HG3 LYS A 67 -12.052 3.597 -7.529 1.00 0.48 H new ATOM 0 HD2 LYS A 67 -14.388 2.227 -6.123 1.00 0.62 H new ATOM 0 HD3 LYS A 67 -14.365 3.961 -6.380 1.00 0.62 H new ATOM 0 HE2 LYS A 67 -14.448 3.743 -8.761 1.00 0.89 H new ATOM 0 HE3 LYS A 67 -13.795 2.117 -8.738 1.00 0.89 H new ATOM 0 HZ1 LYS A 67 -16.218 2.083 -9.039 1.00 1.21 H new ATOM 0 HZ2 LYS A 67 -15.801 1.357 -7.562 1.00 1.21 H new ATOM 0 HZ3 LYS A 67 -16.434 2.932 -7.584 1.00 1.21 H new ATOM 777 N ARG A 68 -11.125 -1.313 -5.806 1.00 0.30 N ATOM 778 CA ARG A 68 -11.104 -2.790 -6.004 1.00 0.32 C ATOM 779 C ARG A 68 -11.270 -3.490 -4.649 1.00 0.31 C ATOM 780 O ARG A 68 -11.805 -4.578 -4.563 1.00 0.40 O ATOM 781 CB ARG A 68 -9.735 -3.084 -6.645 1.00 0.33 C ATOM 782 CG ARG A 68 -8.711 -3.497 -5.581 1.00 0.35 C ATOM 783 CD ARG A 68 -7.308 -3.503 -6.198 1.00 0.38 C ATOM 784 NE ARG A 68 -7.168 -4.850 -6.821 1.00 0.35 N ATOM 785 CZ ARG A 68 -7.829 -5.139 -7.909 1.00 0.36 C ATOM 786 NH1 ARG A 68 -7.876 -4.281 -8.891 1.00 0.47 N ATOM 787 NH2 ARG A 68 -8.443 -6.285 -8.014 1.00 0.49 N ATOM 0 H ARG A 68 -10.206 -0.872 -5.767 1.00 0.30 H new ATOM 0 HA ARG A 68 -11.913 -3.153 -6.637 1.00 0.32 H new ATOM 0 HB2 ARG A 68 -9.838 -3.878 -7.384 1.00 0.33 H new ATOM 0 HB3 ARG A 68 -9.379 -2.200 -7.174 1.00 0.33 H new ATOM 0 HG2 ARG A 68 -8.747 -2.806 -4.739 1.00 0.35 H new ATOM 0 HG3 ARG A 68 -8.953 -4.486 -5.192 1.00 0.35 H new ATOM 0 HD2 ARG A 68 -7.199 -2.712 -6.940 1.00 0.38 H new ATOM 0 HD3 ARG A 68 -6.542 -3.337 -5.440 1.00 0.38 H new ATOM 0 HE ARG A 68 -6.555 -5.546 -6.397 1.00 0.35 H new ATOM 0 HH11 ARG A 68 -7.396 -3.385 -8.808 1.00 0.47 H new ATOM 0 HH12 ARG A 68 -8.392 -4.507 -9.741 1.00 0.47 H new ATOM 0 HH21 ARG A 68 -8.407 -6.955 -7.246 1.00 0.49 H new ATOM 0 HH22 ARG A 68 -8.960 -6.511 -8.864 1.00 0.49 H new ATOM 801 N TRP A 69 -10.812 -2.858 -3.595 1.00 0.26 N ATOM 802 CA TRP A 69 -10.926 -3.449 -2.223 1.00 0.26 C ATOM 803 C TRP A 69 -12.354 -3.934 -1.939 1.00 0.31 C ATOM 804 O TRP A 69 -12.554 -4.902 -1.233 1.00 0.38 O ATOM 805 CB TRP A 69 -10.587 -2.292 -1.287 1.00 0.25 C ATOM 806 CG TRP A 69 -9.948 -2.799 -0.037 1.00 0.25 C ATOM 807 CD1 TRP A 69 -10.460 -2.636 1.203 1.00 0.28 C ATOM 808 CD2 TRP A 69 -8.692 -3.527 0.131 1.00 0.28 C ATOM 809 NE1 TRP A 69 -9.604 -3.211 2.120 1.00 0.31 N ATOM 810 CE2 TRP A 69 -8.502 -3.771 1.513 1.00 0.30 C ATOM 811 CE3 TRP A 69 -7.707 -3.994 -0.764 1.00 0.31 C ATOM 812 CZ2 TRP A 69 -7.382 -4.449 1.989 1.00 0.34 C ATOM 813 CZ3 TRP A 69 -6.580 -4.677 -0.282 1.00 0.35 C ATOM 814 CH2 TRP A 69 -6.420 -4.900 1.091 1.00 0.36 C ATOM 0 H TRP A 69 -10.358 -1.945 -3.627 1.00 0.26 H new ATOM 0 HA TRP A 69 -10.273 -4.313 -2.102 1.00 0.26 H new ATOM 0 HB2 TRP A 69 -9.915 -1.596 -1.789 1.00 0.25 H new ATOM 0 HB3 TRP A 69 -11.493 -1.739 -1.040 1.00 0.25 H new ATOM 0 HD1 TRP A 69 -11.388 -2.137 1.438 1.00 0.28 H new ATOM 0 HE1 TRP A 69 -9.768 -3.220 3.127 1.00 0.31 H new ATOM 0 HE3 TRP A 69 -7.821 -3.825 -1.825 1.00 0.31 H new ATOM 0 HZ2 TRP A 69 -7.261 -4.623 3.048 1.00 0.34 H new ATOM 0 HZ3 TRP A 69 -5.831 -5.033 -0.974 1.00 0.35 H new ATOM 0 HH2 TRP A 69 -5.548 -5.423 1.454 1.00 0.36 H new ATOM 825 N GLY A 70 -13.345 -3.252 -2.462 1.00 0.32 N ATOM 826 CA GLY A 70 -14.761 -3.656 -2.197 1.00 0.39 C ATOM 827 C GLY A 70 -15.443 -4.136 -3.480 1.00 0.40 C ATOM 828 O GLY A 70 -16.564 -3.758 -3.767 1.00 0.46 O ATOM 0 H GLY A 70 -13.234 -2.434 -3.061 1.00 0.32 H new ATOM 0 HA2 GLY A 70 -14.783 -4.450 -1.450 1.00 0.39 H new ATOM 0 HA3 GLY A 70 -15.312 -2.812 -1.782 1.00 0.39 H new ATOM 832 N THR A 71 -14.793 -4.976 -4.245 1.00 0.39 N ATOM 833 CA THR A 71 -15.427 -5.490 -5.499 1.00 0.42 C ATOM 834 C THR A 71 -14.614 -6.654 -6.079 1.00 0.40 C ATOM 835 O THR A 71 -14.622 -6.889 -7.273 1.00 0.48 O ATOM 836 CB THR A 71 -15.457 -4.297 -6.465 1.00 0.52 C ATOM 837 OG1 THR A 71 -16.364 -4.574 -7.522 1.00 0.62 O ATOM 838 CG2 THR A 71 -14.063 -4.047 -7.044 1.00 0.60 C ATOM 0 H THR A 71 -13.854 -5.328 -4.057 1.00 0.39 H new ATOM 0 HA THR A 71 -16.429 -5.878 -5.317 1.00 0.42 H new ATOM 0 HB THR A 71 -15.778 -3.408 -5.922 1.00 0.52 H new ATOM 0 HG1 THR A 71 -16.163 -5.454 -7.903 1.00 0.62 H new ATOM 0 HG21 THR A 71 -14.100 -3.198 -7.727 1.00 0.60 H new ATOM 0 HG22 THR A 71 -13.366 -3.831 -6.234 1.00 0.60 H new ATOM 0 HG23 THR A 71 -13.729 -4.933 -7.584 1.00 0.60 H new ATOM 846 N ILE A 72 -13.923 -7.387 -5.240 1.00 0.36 N ATOM 847 CA ILE A 72 -13.119 -8.544 -5.736 1.00 0.37 C ATOM 848 C ILE A 72 -13.720 -9.859 -5.218 1.00 0.36 C ATOM 849 O ILE A 72 -14.900 -10.107 -5.380 1.00 0.54 O ATOM 850 CB ILE A 72 -11.703 -8.315 -5.195 1.00 0.35 C ATOM 851 CG1 ILE A 72 -11.739 -8.218 -3.668 1.00 0.35 C ATOM 852 CG2 ILE A 72 -11.134 -7.020 -5.775 1.00 0.38 C ATOM 853 CD1 ILE A 72 -10.404 -8.703 -3.101 1.00 0.32 C ATOM 0 H ILE A 72 -13.882 -7.233 -4.233 1.00 0.36 H new ATOM 0 HA ILE A 72 -13.113 -8.616 -6.824 1.00 0.37 H new ATOM 0 HB ILE A 72 -11.070 -9.153 -5.487 1.00 0.35 H new ATOM 0 HG12 ILE A 72 -11.925 -7.189 -3.361 1.00 0.35 H new ATOM 0 HG13 ILE A 72 -12.556 -8.821 -3.273 1.00 0.35 H new ATOM 0 HG21 ILE A 72 -10.127 -6.860 -5.389 1.00 0.38 H new ATOM 0 HG22 ILE A 72 -11.098 -7.093 -6.862 1.00 0.38 H new ATOM 0 HG23 ILE A 72 -11.770 -6.183 -5.488 1.00 0.38 H new ATOM 0 HD11 ILE A 72 -10.425 -8.636 -2.013 1.00 0.32 H new ATOM 0 HD12 ILE A 72 -10.238 -9.739 -3.397 1.00 0.32 H new ATOM 0 HD13 ILE A 72 -9.597 -8.081 -3.488 1.00 0.32 H new ATOM 865 N LYS A 73 -12.925 -10.707 -4.610 1.00 0.39 N ATOM 866 CA LYS A 73 -13.456 -12.006 -4.102 1.00 0.36 C ATOM 867 C LYS A 73 -13.324 -12.098 -2.586 1.00 0.31 C ATOM 868 O LYS A 73 -14.162 -12.677 -1.923 1.00 0.34 O ATOM 869 CB LYS A 73 -12.577 -13.063 -4.768 1.00 0.42 C ATOM 870 CG LYS A 73 -12.976 -14.455 -4.282 1.00 0.40 C ATOM 871 CD LYS A 73 -14.047 -15.037 -5.207 1.00 0.51 C ATOM 872 CE LYS A 73 -14.880 -16.066 -4.439 1.00 0.52 C ATOM 873 NZ LYS A 73 -15.925 -15.270 -3.737 1.00 0.49 N ATOM 0 H LYS A 73 -11.930 -10.553 -4.445 1.00 0.39 H new ATOM 0 HA LYS A 73 -14.515 -12.129 -4.329 1.00 0.36 H new ATOM 0 HB2 LYS A 73 -12.680 -13.004 -5.851 1.00 0.42 H new ATOM 0 HB3 LYS A 73 -11.529 -12.875 -4.537 1.00 0.42 H new ATOM 0 HG2 LYS A 73 -12.104 -15.108 -4.264 1.00 0.40 H new ATOM 0 HG3 LYS A 73 -13.354 -14.400 -3.261 1.00 0.40 H new ATOM 0 HD2 LYS A 73 -14.690 -14.241 -5.583 1.00 0.51 H new ATOM 0 HD3 LYS A 73 -13.579 -15.505 -6.073 1.00 0.51 H new ATOM 0 HE2 LYS A 73 -15.327 -16.795 -5.115 1.00 0.52 H new ATOM 0 HE3 LYS A 73 -14.265 -16.622 -3.731 1.00 0.52 H new ATOM 0 HZ1 LYS A 73 -16.202 -15.757 -2.861 1.00 0.49 H new ATOM 0 HZ2 LYS A 73 -15.547 -14.329 -3.505 1.00 0.49 H new ATOM 0 HZ3 LYS A 73 -16.756 -15.167 -4.354 1.00 0.49 H new ATOM 887 N LYS A 74 -12.259 -11.563 -2.051 1.00 0.28 N ATOM 888 CA LYS A 74 -12.002 -11.625 -0.575 1.00 0.28 C ATOM 889 C LYS A 74 -11.603 -13.050 -0.182 1.00 0.26 C ATOM 890 O LYS A 74 -10.639 -13.255 0.527 1.00 0.29 O ATOM 891 CB LYS A 74 -13.294 -11.214 0.155 1.00 0.30 C ATOM 892 CG LYS A 74 -13.944 -9.999 -0.509 1.00 0.34 C ATOM 893 CD LYS A 74 -12.898 -8.913 -0.774 1.00 0.39 C ATOM 894 CE LYS A 74 -12.340 -8.410 0.559 1.00 0.66 C ATOM 895 NZ LYS A 74 -11.994 -6.981 0.320 1.00 0.95 N ATOM 0 H LYS A 74 -11.539 -11.074 -2.583 1.00 0.28 H new ATOM 0 HA LYS A 74 -11.190 -10.951 -0.301 1.00 0.28 H new ATOM 0 HB2 LYS A 74 -13.995 -12.049 0.156 1.00 0.30 H new ATOM 0 HB3 LYS A 74 -13.069 -10.985 1.197 1.00 0.30 H new ATOM 0 HG2 LYS A 74 -14.414 -10.297 -1.446 1.00 0.34 H new ATOM 0 HG3 LYS A 74 -14.733 -9.605 0.132 1.00 0.34 H new ATOM 0 HD2 LYS A 74 -12.093 -9.311 -1.391 1.00 0.39 H new ATOM 0 HD3 LYS A 74 -13.346 -8.088 -1.328 1.00 0.39 H new ATOM 0 HE2 LYS A 74 -13.076 -8.509 1.357 1.00 0.66 H new ATOM 0 HE3 LYS A 74 -11.463 -8.983 0.861 1.00 0.66 H new ATOM 0 HZ1 LYS A 74 -12.210 -6.424 1.172 1.00 0.95 H new ATOM 0 HZ2 LYS A 74 -10.980 -6.901 0.102 1.00 0.95 H new ATOM 0 HZ3 LYS A 74 -12.550 -6.618 -0.480 1.00 0.95 H new ATOM 909 N SER A 75 -12.330 -14.036 -0.649 1.00 0.27 N ATOM 910 CA SER A 75 -11.984 -15.446 -0.310 1.00 0.33 C ATOM 911 C SER A 75 -10.577 -15.745 -0.815 1.00 0.32 C ATOM 912 O SER A 75 -9.801 -16.411 -0.162 1.00 0.38 O ATOM 913 CB SER A 75 -13.021 -16.300 -1.040 1.00 0.38 C ATOM 914 OG SER A 75 -14.216 -16.347 -0.270 1.00 0.46 O ATOM 0 H SER A 75 -13.147 -13.922 -1.249 1.00 0.27 H new ATOM 0 HA SER A 75 -11.997 -15.644 0.762 1.00 0.33 H new ATOM 0 HB2 SER A 75 -13.226 -15.881 -2.025 1.00 0.38 H new ATOM 0 HB3 SER A 75 -12.635 -17.307 -1.196 1.00 0.38 H new ATOM 0 HG SER A 75 -14.884 -16.892 -0.736 1.00 0.46 H new ATOM 920 N LYS A 76 -10.244 -15.229 -1.969 1.00 0.30 N ATOM 921 CA LYS A 76 -8.882 -15.448 -2.532 1.00 0.31 C ATOM 922 C LYS A 76 -7.880 -14.548 -1.807 1.00 0.28 C ATOM 923 O LYS A 76 -6.805 -14.978 -1.435 1.00 0.32 O ATOM 924 CB LYS A 76 -8.995 -15.051 -4.002 1.00 0.37 C ATOM 925 CG LYS A 76 -9.186 -16.304 -4.858 1.00 0.57 C ATOM 926 CD LYS A 76 -8.890 -15.972 -6.322 1.00 0.66 C ATOM 927 CE LYS A 76 -7.399 -16.173 -6.600 1.00 0.81 C ATOM 928 NZ LYS A 76 -7.272 -17.604 -6.990 1.00 0.88 N ATOM 0 H LYS A 76 -10.863 -14.662 -2.548 1.00 0.30 H new ATOM 0 HA LYS A 76 -8.538 -16.476 -2.417 1.00 0.31 H new ATOM 0 HB2 LYS A 76 -9.835 -14.371 -4.142 1.00 0.37 H new ATOM 0 HB3 LYS A 76 -8.098 -14.518 -4.315 1.00 0.37 H new ATOM 0 HG2 LYS A 76 -8.523 -17.098 -4.513 1.00 0.57 H new ATOM 0 HG3 LYS A 76 -10.206 -16.674 -4.757 1.00 0.57 H new ATOM 0 HD2 LYS A 76 -9.482 -16.610 -6.978 1.00 0.66 H new ATOM 0 HD3 LYS A 76 -9.175 -14.942 -6.537 1.00 0.66 H new ATOM 0 HE2 LYS A 76 -7.053 -15.514 -7.397 1.00 0.81 H new ATOM 0 HE3 LYS A 76 -6.799 -15.949 -5.718 1.00 0.81 H new ATOM 0 HZ1 LYS A 76 -6.276 -17.820 -7.197 1.00 0.88 H new ATOM 0 HZ2 LYS A 76 -7.602 -18.207 -6.210 1.00 0.88 H new ATOM 0 HZ3 LYS A 76 -7.849 -17.786 -7.836 1.00 0.88 H new ATOM 942 N ALA A 77 -8.233 -13.301 -1.599 1.00 0.27 N ATOM 943 CA ALA A 77 -7.310 -12.364 -0.889 1.00 0.26 C ATOM 944 C ALA A 77 -7.062 -12.861 0.533 1.00 0.25 C ATOM 945 O ALA A 77 -5.933 -13.016 0.960 1.00 0.29 O ATOM 946 CB ALA A 77 -8.039 -11.019 -0.858 1.00 0.29 C ATOM 0 H ALA A 77 -9.121 -12.893 -1.891 1.00 0.27 H new ATOM 0 HA ALA A 77 -6.342 -12.288 -1.384 1.00 0.26 H new ATOM 0 HB1 ALA A 77 -7.419 -10.281 -0.350 1.00 0.29 H new ATOM 0 HB2 ALA A 77 -8.235 -10.688 -1.878 1.00 0.29 H new ATOM 0 HB3 ALA A 77 -8.983 -11.129 -0.324 1.00 0.29 H new ATOM 952 N ILE A 78 -8.116 -13.113 1.267 1.00 0.24 N ATOM 953 CA ILE A 78 -7.962 -13.605 2.667 1.00 0.26 C ATOM 954 C ILE A 78 -7.163 -14.913 2.673 1.00 0.29 C ATOM 955 O ILE A 78 -6.282 -15.100 3.492 1.00 0.34 O ATOM 956 CB ILE A 78 -9.392 -13.811 3.174 1.00 0.29 C ATOM 957 CG1 ILE A 78 -10.107 -12.454 3.210 1.00 0.27 C ATOM 958 CG2 ILE A 78 -9.360 -14.407 4.584 1.00 0.38 C ATOM 959 CD1 ILE A 78 -11.616 -12.648 3.026 1.00 0.28 C ATOM 0 H ILE A 78 -9.080 -12.998 0.954 1.00 0.24 H new ATOM 0 HA ILE A 78 -7.417 -12.909 3.305 1.00 0.26 H new ATOM 0 HB ILE A 78 -9.922 -14.493 2.509 1.00 0.29 H new ATOM 0 HG12 ILE A 78 -9.910 -11.955 4.159 1.00 0.27 H new ATOM 0 HG13 ILE A 78 -9.717 -11.808 2.423 1.00 0.27 H new ATOM 0 HG21 ILE A 78 -10.380 -14.552 4.941 1.00 0.38 H new ATOM 0 HG22 ILE A 78 -8.843 -15.367 4.562 1.00 0.38 H new ATOM 0 HG23 ILE A 78 -8.834 -13.727 5.254 1.00 0.38 H new ATOM 0 HD11 ILE A 78 -12.113 -11.679 3.053 1.00 0.28 H new ATOM 0 HD12 ILE A 78 -11.807 -13.127 2.066 1.00 0.28 H new ATOM 0 HD13 ILE A 78 -12.002 -13.277 3.828 1.00 0.28 H new ATOM 971 N ASN A 79 -7.439 -15.808 1.752 1.00 0.29 N ATOM 972 CA ASN A 79 -6.659 -17.082 1.703 1.00 0.33 C ATOM 973 C ASN A 79 -5.207 -16.749 1.368 1.00 0.29 C ATOM 974 O ASN A 79 -4.284 -17.295 1.944 1.00 0.32 O ATOM 975 CB ASN A 79 -7.290 -17.919 0.591 1.00 0.38 C ATOM 976 CG ASN A 79 -8.292 -18.903 1.201 1.00 0.51 C ATOM 977 OD1 ASN A 79 -7.934 -19.714 2.031 1.00 0.94 O ATOM 978 ND2 ASN A 79 -9.541 -18.865 0.824 1.00 0.47 N ATOM 0 H ASN A 79 -8.163 -15.711 1.040 1.00 0.29 H new ATOM 0 HA ASN A 79 -6.676 -17.623 2.649 1.00 0.33 H new ATOM 0 HB2 ASN A 79 -7.792 -17.270 -0.127 1.00 0.38 H new ATOM 0 HB3 ASN A 79 -6.517 -18.461 0.046 1.00 0.38 H new ATOM 0 HD21 ASN A 79 -10.215 -19.516 1.226 1.00 0.47 H new ATOM 0 HD22 ASN A 79 -9.843 -18.184 0.127 1.00 0.47 H new ATOM 985 N VAL A 80 -5.006 -15.829 0.454 1.00 0.29 N ATOM 986 CA VAL A 80 -3.619 -15.416 0.087 1.00 0.28 C ATOM 987 C VAL A 80 -2.923 -14.892 1.344 1.00 0.28 C ATOM 988 O VAL A 80 -1.799 -15.250 1.642 1.00 0.32 O ATOM 989 CB VAL A 80 -3.799 -14.308 -0.968 1.00 0.30 C ATOM 990 CG1 VAL A 80 -2.890 -13.111 -0.666 1.00 0.31 C ATOM 991 CG2 VAL A 80 -3.456 -14.866 -2.352 1.00 0.46 C ATOM 0 H VAL A 80 -5.747 -15.346 -0.054 1.00 0.29 H new ATOM 0 HA VAL A 80 -3.008 -16.228 -0.309 1.00 0.28 H new ATOM 0 HB VAL A 80 -4.836 -13.972 -0.944 1.00 0.30 H new ATOM 0 HG11 VAL A 80 -3.036 -12.343 -1.425 1.00 0.31 H new ATOM 0 HG12 VAL A 80 -3.138 -12.704 0.314 1.00 0.31 H new ATOM 0 HG13 VAL A 80 -1.849 -13.434 -0.672 1.00 0.31 H new ATOM 0 HG21 VAL A 80 -3.582 -14.084 -3.101 1.00 0.46 H new ATOM 0 HG22 VAL A 80 -2.422 -15.212 -2.359 1.00 0.46 H new ATOM 0 HG23 VAL A 80 -4.119 -15.700 -2.583 1.00 0.46 H new ATOM 1001 N LEU A 81 -3.603 -14.056 2.088 1.00 0.28 N ATOM 1002 CA LEU A 81 -3.012 -13.508 3.342 1.00 0.32 C ATOM 1003 C LEU A 81 -2.645 -14.664 4.272 1.00 0.35 C ATOM 1004 O LEU A 81 -1.618 -14.649 4.924 1.00 0.39 O ATOM 1005 CB LEU A 81 -4.110 -12.637 3.953 1.00 0.34 C ATOM 1006 CG LEU A 81 -3.613 -11.196 4.055 1.00 0.41 C ATOM 1007 CD1 LEU A 81 -3.922 -10.457 2.753 1.00 0.62 C ATOM 1008 CD2 LEU A 81 -4.321 -10.500 5.216 1.00 0.46 C ATOM 0 H LEU A 81 -4.546 -13.729 1.878 1.00 0.28 H new ATOM 0 HA LEU A 81 -2.103 -12.932 3.169 1.00 0.32 H new ATOM 0 HB2 LEU A 81 -5.009 -12.681 3.339 1.00 0.34 H new ATOM 0 HB3 LEU A 81 -4.380 -13.011 4.940 1.00 0.34 H new ATOM 0 HG LEU A 81 -2.537 -11.191 4.227 1.00 0.41 H new ATOM 0 HD11 LEU A 81 -3.568 -9.429 2.825 1.00 0.62 H new ATOM 0 HD12 LEU A 81 -3.421 -10.956 1.924 1.00 0.62 H new ATOM 0 HD13 LEU A 81 -4.998 -10.458 2.580 1.00 0.62 H new ATOM 0 HD21 LEU A 81 -3.969 -9.471 5.292 1.00 0.46 H new ATOM 0 HD22 LEU A 81 -5.397 -10.504 5.041 1.00 0.46 H new ATOM 0 HD23 LEU A 81 -4.103 -11.028 6.144 1.00 0.46 H new ATOM 1020 N ARG A 82 -3.470 -15.680 4.313 1.00 0.38 N ATOM 1021 CA ARG A 82 -3.161 -16.857 5.171 1.00 0.41 C ATOM 1022 C ARG A 82 -1.925 -17.556 4.606 1.00 0.38 C ATOM 1023 O ARG A 82 -1.063 -18.013 5.335 1.00 0.41 O ATOM 1024 CB ARG A 82 -4.390 -17.763 5.076 1.00 0.46 C ATOM 1025 CG ARG A 82 -4.530 -18.572 6.368 1.00 0.62 C ATOM 1026 CD ARG A 82 -5.487 -17.853 7.323 1.00 0.90 C ATOM 1027 NE ARG A 82 -6.594 -18.820 7.562 1.00 1.34 N ATOM 1028 CZ ARG A 82 -7.489 -19.029 6.636 1.00 1.87 C ATOM 1029 NH1 ARG A 82 -8.055 -18.018 6.036 1.00 2.27 N ATOM 1030 NH2 ARG A 82 -7.818 -20.249 6.310 1.00 2.35 N ATOM 0 H ARG A 82 -4.343 -15.742 3.789 1.00 0.38 H new ATOM 0 HA ARG A 82 -2.953 -16.591 6.207 1.00 0.41 H new ATOM 0 HB2 ARG A 82 -5.285 -17.163 4.911 1.00 0.46 H new ATOM 0 HB3 ARG A 82 -4.295 -18.434 4.223 1.00 0.46 H new ATOM 0 HG2 ARG A 82 -4.905 -19.571 6.145 1.00 0.62 H new ATOM 0 HG3 ARG A 82 -3.555 -18.696 6.839 1.00 0.62 H new ATOM 0 HD2 ARG A 82 -4.988 -17.586 8.255 1.00 0.90 H new ATOM 0 HD3 ARG A 82 -5.860 -16.927 6.885 1.00 0.90 H new ATOM 0 HE ARG A 82 -6.653 -19.319 8.450 1.00 1.34 H new ATOM 0 HH11 ARG A 82 -7.798 -17.064 6.291 1.00 2.27 H new ATOM 0 HH12 ARG A 82 -8.755 -18.181 5.312 1.00 2.27 H new ATOM 0 HH21 ARG A 82 -7.375 -21.039 6.779 1.00 2.35 H new ATOM 0 HH22 ARG A 82 -8.518 -20.412 5.586 1.00 2.35 H new ATOM 1044 N GLY A 83 -1.829 -17.615 3.299 1.00 0.36 N ATOM 1045 CA GLY A 83 -0.646 -18.255 2.657 1.00 0.35 C ATOM 1046 C GLY A 83 0.594 -17.442 3.018 1.00 0.32 C ATOM 1047 O GLY A 83 1.641 -17.988 3.313 1.00 0.36 O ATOM 0 H GLY A 83 -2.524 -17.245 2.650 1.00 0.36 H new ATOM 0 HA2 GLY A 83 -0.538 -19.284 3.000 1.00 0.35 H new ATOM 0 HA3 GLY A 83 -0.774 -18.291 1.575 1.00 0.35 H new ATOM 1051 N PHE A 84 0.474 -16.135 3.017 1.00 0.30 N ATOM 1052 CA PHE A 84 1.636 -15.273 3.385 1.00 0.31 C ATOM 1053 C PHE A 84 2.071 -15.615 4.810 1.00 0.32 C ATOM 1054 O PHE A 84 3.247 -15.659 5.119 1.00 0.37 O ATOM 1055 CB PHE A 84 1.118 -13.834 3.311 1.00 0.34 C ATOM 1056 CG PHE A 84 1.223 -13.320 1.902 1.00 0.32 C ATOM 1057 CD1 PHE A 84 2.435 -13.410 1.209 1.00 0.55 C ATOM 1058 CD2 PHE A 84 0.106 -12.742 1.291 1.00 0.54 C ATOM 1059 CE1 PHE A 84 2.526 -12.922 -0.097 1.00 0.56 C ATOM 1060 CE2 PHE A 84 0.199 -12.254 -0.012 1.00 0.63 C ATOM 1061 CZ PHE A 84 1.407 -12.345 -0.705 1.00 0.47 C ATOM 0 H PHE A 84 -0.380 -15.631 2.777 1.00 0.30 H new ATOM 0 HA PHE A 84 2.494 -15.416 2.728 1.00 0.31 H new ATOM 0 HB2 PHE A 84 0.081 -13.795 3.645 1.00 0.34 H new ATOM 0 HB3 PHE A 84 1.693 -13.197 3.983 1.00 0.34 H new ATOM 0 HD1 PHE A 84 3.298 -13.855 1.682 1.00 0.55 H new ATOM 0 HD2 PHE A 84 -0.829 -12.674 1.828 1.00 0.54 H new ATOM 0 HE1 PHE A 84 3.459 -12.990 -0.636 1.00 0.56 H new ATOM 0 HE2 PHE A 84 -0.663 -11.806 -0.484 1.00 0.63 H new ATOM 0 HZ PHE A 84 1.478 -11.968 -1.715 1.00 0.47 H new ATOM 1071 N ARG A 85 1.119 -15.878 5.673 1.00 0.33 N ATOM 1072 CA ARG A 85 1.457 -16.245 7.078 1.00 0.37 C ATOM 1073 C ARG A 85 2.255 -17.548 7.073 1.00 0.38 C ATOM 1074 O ARG A 85 3.199 -17.714 7.822 1.00 0.43 O ATOM 1075 CB ARG A 85 0.112 -16.435 7.781 1.00 0.43 C ATOM 1076 CG ARG A 85 0.207 -15.911 9.216 1.00 0.58 C ATOM 1077 CD ARG A 85 0.442 -17.081 10.175 1.00 0.76 C ATOM 1078 NE ARG A 85 1.917 -17.125 10.372 1.00 0.95 N ATOM 1079 CZ ARG A 85 2.410 -17.446 11.537 1.00 0.89 C ATOM 1080 NH1 ARG A 85 1.913 -18.454 12.200 1.00 1.33 N ATOM 1081 NH2 ARG A 85 3.398 -16.758 12.040 1.00 0.54 N ATOM 0 H ARG A 85 0.122 -15.853 5.461 1.00 0.33 H new ATOM 0 HA ARG A 85 2.061 -15.489 7.581 1.00 0.37 H new ATOM 0 HB2 ARG A 85 -0.671 -15.904 7.240 1.00 0.43 H new ATOM 0 HB3 ARG A 85 -0.162 -17.490 7.785 1.00 0.43 H new ATOM 0 HG2 ARG A 85 1.021 -15.191 9.298 1.00 0.58 H new ATOM 0 HG3 ARG A 85 -0.710 -15.386 9.484 1.00 0.58 H new ATOM 0 HD2 ARG A 85 -0.078 -16.927 11.120 1.00 0.76 H new ATOM 0 HD3 ARG A 85 0.071 -18.016 9.755 1.00 0.76 H new ATOM 0 HE ARG A 85 2.542 -16.904 9.597 1.00 0.95 H new ATOM 0 HH11 ARG A 85 1.139 -18.991 11.808 1.00 1.33 H new ATOM 0 HH12 ARG A 85 2.298 -18.705 13.111 1.00 1.33 H new ATOM 0 HH21 ARG A 85 3.785 -15.969 11.523 1.00 0.54 H new ATOM 0 HH22 ARG A 85 3.783 -17.009 12.951 1.00 0.54 H new ATOM 1095 N LYS A 86 1.890 -18.465 6.212 1.00 0.37 N ATOM 1096 CA LYS A 86 2.636 -19.754 6.127 1.00 0.40 C ATOM 1097 C LYS A 86 3.982 -19.503 5.446 1.00 0.35 C ATOM 1098 O LYS A 86 4.987 -20.095 5.791 1.00 0.37 O ATOM 1099 CB LYS A 86 1.761 -20.676 5.274 1.00 0.46 C ATOM 1100 CG LYS A 86 1.144 -21.762 6.159 1.00 0.60 C ATOM 1101 CD LYS A 86 -0.132 -21.226 6.811 1.00 0.64 C ATOM 1102 CE LYS A 86 0.195 -20.672 8.200 1.00 0.62 C ATOM 1103 NZ LYS A 86 0.377 -21.874 9.061 1.00 0.85 N ATOM 0 H LYS A 86 1.107 -18.375 5.565 1.00 0.37 H new ATOM 0 HA LYS A 86 2.834 -20.194 7.104 1.00 0.40 H new ATOM 0 HB2 LYS A 86 0.975 -20.099 4.787 1.00 0.46 H new ATOM 0 HB3 LYS A 86 2.358 -21.132 4.484 1.00 0.46 H new ATOM 0 HG2 LYS A 86 0.917 -22.646 5.563 1.00 0.60 H new ATOM 0 HG3 LYS A 86 1.855 -22.069 6.926 1.00 0.60 H new ATOM 0 HD2 LYS A 86 -0.569 -20.444 6.190 1.00 0.64 H new ATOM 0 HD3 LYS A 86 -0.873 -22.021 6.891 1.00 0.64 H new ATOM 0 HE2 LYS A 86 1.098 -20.061 8.179 1.00 0.62 H new ATOM 0 HE3 LYS A 86 -0.610 -20.038 8.572 1.00 0.62 H new ATOM 0 HZ1 LYS A 86 -0.316 -21.854 9.837 1.00 0.85 H new ATOM 0 HZ2 LYS A 86 0.235 -22.733 8.492 1.00 0.85 H new ATOM 0 HZ3 LYS A 86 1.339 -21.876 9.456 1.00 0.85 H new ATOM 1117 N GLU A 87 4.002 -18.610 4.487 1.00 0.30 N ATOM 1118 CA GLU A 87 5.275 -18.290 3.779 1.00 0.30 C ATOM 1119 C GLU A 87 6.225 -17.572 4.740 1.00 0.29 C ATOM 1120 O GLU A 87 7.416 -17.822 4.750 1.00 0.32 O ATOM 1121 CB GLU A 87 4.873 -17.367 2.627 1.00 0.31 C ATOM 1122 CG GLU A 87 3.972 -18.126 1.651 1.00 0.33 C ATOM 1123 CD GLU A 87 4.820 -18.715 0.523 1.00 0.37 C ATOM 1124 OE1 GLU A 87 5.707 -19.498 0.822 1.00 0.43 O ATOM 1125 OE2 GLU A 87 4.569 -18.373 -0.621 1.00 0.46 O ATOM 0 H GLU A 87 3.187 -18.088 4.165 1.00 0.30 H new ATOM 0 HA GLU A 87 5.789 -19.180 3.416 1.00 0.30 H new ATOM 0 HB2 GLU A 87 4.351 -16.492 3.014 1.00 0.31 H new ATOM 0 HB3 GLU A 87 5.762 -17.005 2.111 1.00 0.31 H new ATOM 0 HG2 GLU A 87 3.441 -18.921 2.174 1.00 0.33 H new ATOM 0 HG3 GLU A 87 3.217 -17.455 1.240 1.00 0.33 H new ATOM 1132 N ILE A 88 5.703 -16.689 5.555 1.00 0.30 N ATOM 1133 CA ILE A 88 6.573 -15.963 6.526 1.00 0.33 C ATOM 1134 C ILE A 88 7.058 -16.945 7.600 1.00 0.31 C ATOM 1135 O ILE A 88 8.175 -16.856 8.081 1.00 0.32 O ATOM 1136 CB ILE A 88 5.687 -14.837 7.102 1.00 0.39 C ATOM 1137 CG1 ILE A 88 6.546 -13.587 7.324 1.00 0.46 C ATOM 1138 CG2 ILE A 88 5.044 -15.248 8.435 1.00 0.42 C ATOM 1139 CD1 ILE A 88 6.227 -12.548 6.247 1.00 0.54 C ATOM 0 H ILE A 88 4.714 -16.441 5.589 1.00 0.30 H new ATOM 0 HA ILE A 88 7.470 -15.539 6.075 1.00 0.33 H new ATOM 0 HB ILE A 88 4.889 -14.635 6.388 1.00 0.39 H new ATOM 0 HG12 ILE A 88 6.353 -13.172 8.313 1.00 0.46 H new ATOM 0 HG13 ILE A 88 7.603 -13.849 7.289 1.00 0.46 H new ATOM 0 HG21 ILE A 88 4.428 -14.430 8.809 1.00 0.42 H new ATOM 0 HG22 ILE A 88 4.422 -16.130 8.282 1.00 0.42 H new ATOM 0 HG23 ILE A 88 5.825 -15.476 9.161 1.00 0.42 H new ATOM 0 HD11 ILE A 88 6.838 -11.660 6.406 1.00 0.54 H new ATOM 0 HD12 ILE A 88 6.442 -12.966 5.263 1.00 0.54 H new ATOM 0 HD13 ILE A 88 5.173 -12.278 6.303 1.00 0.54 H new ATOM 1151 N GLY A 89 6.230 -17.900 7.954 1.00 0.33 N ATOM 1152 CA GLY A 89 6.637 -18.912 8.970 1.00 0.33 C ATOM 1153 C GLY A 89 7.794 -19.719 8.392 1.00 0.30 C ATOM 1154 O GLY A 89 8.715 -20.100 9.090 1.00 0.31 O ATOM 0 H GLY A 89 5.289 -18.019 7.580 1.00 0.33 H new ATOM 0 HA2 GLY A 89 6.939 -18.423 9.896 1.00 0.33 H new ATOM 0 HA3 GLY A 89 5.800 -19.566 9.213 1.00 0.33 H new ATOM 1158 N ARG A 90 7.757 -19.959 7.107 1.00 0.31 N ATOM 1159 CA ARG A 90 8.860 -20.716 6.455 1.00 0.31 C ATOM 1160 C ARG A 90 10.124 -19.859 6.467 1.00 0.29 C ATOM 1161 O ARG A 90 11.218 -20.356 6.665 1.00 0.30 O ATOM 1162 CB ARG A 90 8.396 -20.952 5.018 1.00 0.35 C ATOM 1163 CG ARG A 90 7.446 -22.149 4.968 1.00 0.37 C ATOM 1164 CD ARG A 90 7.041 -22.405 3.516 1.00 0.39 C ATOM 1165 NE ARG A 90 5.619 -22.843 3.582 1.00 0.41 N ATOM 1166 CZ ARG A 90 4.859 -22.755 2.524 1.00 0.42 C ATOM 1167 NH1 ARG A 90 4.407 -21.593 2.140 1.00 0.44 N ATOM 1168 NH2 ARG A 90 4.554 -23.829 1.848 1.00 0.61 N ATOM 0 H ARG A 90 7.008 -19.662 6.482 1.00 0.31 H new ATOM 0 HA ARG A 90 9.083 -21.655 6.962 1.00 0.31 H new ATOM 0 HB2 ARG A 90 7.894 -20.062 4.638 1.00 0.35 H new ATOM 0 HB3 ARG A 90 9.257 -21.132 4.374 1.00 0.35 H new ATOM 0 HG2 ARG A 90 7.931 -23.032 5.384 1.00 0.37 H new ATOM 0 HG3 ARG A 90 6.563 -21.954 5.576 1.00 0.37 H new ATOM 0 HD2 ARG A 90 7.148 -21.504 2.912 1.00 0.39 H new ATOM 0 HD3 ARG A 90 7.669 -23.171 3.061 1.00 0.39 H new ATOM 0 HE ARG A 90 5.239 -23.212 4.454 1.00 0.41 H new ATOM 0 HH11 ARG A 90 4.647 -20.753 2.666 1.00 0.44 H new ATOM 0 HH12 ARG A 90 3.813 -21.525 1.313 1.00 0.44 H new ATOM 0 HH21 ARG A 90 4.909 -24.737 2.146 1.00 0.61 H new ATOM 0 HH22 ARG A 90 3.960 -23.760 1.022 1.00 0.61 H new ATOM 1182 N MET A 91 9.969 -18.565 6.282 1.00 0.29 N ATOM 1183 CA MET A 91 11.150 -17.653 6.296 1.00 0.27 C ATOM 1184 C MET A 91 11.855 -17.813 7.632 1.00 0.24 C ATOM 1185 O MET A 91 13.068 -17.855 7.712 1.00 0.25 O ATOM 1186 CB MET A 91 10.579 -16.239 6.135 1.00 0.30 C ATOM 1187 CG MET A 91 11.371 -15.488 5.062 1.00 0.40 C ATOM 1188 SD MET A 91 10.753 -13.791 4.930 1.00 0.58 S ATOM 1189 CE MET A 91 9.212 -14.174 4.063 1.00 0.99 C ATOM 0 H MET A 91 9.072 -18.106 6.122 1.00 0.29 H new ATOM 0 HA MET A 91 11.872 -17.865 5.507 1.00 0.27 H new ATOM 0 HB2 MET A 91 9.526 -16.290 5.856 1.00 0.30 H new ATOM 0 HB3 MET A 91 10.632 -15.704 7.083 1.00 0.30 H new ATOM 0 HG2 MET A 91 12.431 -15.481 5.316 1.00 0.40 H new ATOM 0 HG3 MET A 91 11.276 -15.996 4.103 1.00 0.40 H new ATOM 0 HE1 MET A 91 9.150 -13.579 3.152 1.00 0.99 H new ATOM 0 HE2 MET A 91 9.192 -15.233 3.807 1.00 0.99 H new ATOM 0 HE3 MET A 91 8.364 -13.941 4.707 1.00 0.99 H new ATOM 1199 N LEU A 92 11.085 -17.943 8.678 1.00 0.25 N ATOM 1200 CA LEU A 92 11.679 -18.146 10.022 1.00 0.25 C ATOM 1201 C LEU A 92 12.404 -19.476 10.030 1.00 0.24 C ATOM 1202 O LEU A 92 13.512 -19.581 10.516 1.00 0.27 O ATOM 1203 CB LEU A 92 10.500 -18.137 10.974 1.00 0.28 C ATOM 1204 CG LEU A 92 9.889 -16.748 10.916 1.00 0.30 C ATOM 1205 CD1 LEU A 92 8.387 -16.825 11.208 1.00 0.36 C ATOM 1206 CD2 LEU A 92 10.576 -15.845 11.944 1.00 0.37 C ATOM 0 H LEU A 92 10.066 -17.917 8.655 1.00 0.25 H new ATOM 0 HA LEU A 92 12.405 -17.383 10.305 1.00 0.25 H new ATOM 0 HB2 LEU A 92 9.768 -18.892 10.687 1.00 0.28 H new ATOM 0 HB3 LEU A 92 10.822 -18.374 11.988 1.00 0.28 H new ATOM 0 HG LEU A 92 10.032 -16.332 9.919 1.00 0.30 H new ATOM 0 HD11 LEU A 92 7.956 -15.825 11.165 1.00 0.36 H new ATOM 0 HD12 LEU A 92 7.904 -17.461 10.466 1.00 0.36 H new ATOM 0 HD13 LEU A 92 8.231 -17.245 12.202 1.00 0.36 H new ATOM 0 HD21 LEU A 92 10.138 -14.848 11.903 1.00 0.37 H new ATOM 0 HD22 LEU A 92 10.439 -16.261 12.942 1.00 0.37 H new ATOM 0 HD23 LEU A 92 11.641 -15.783 11.720 1.00 0.37 H new ATOM 1218 N ASN A 93 11.804 -20.482 9.441 1.00 0.25 N ATOM 1219 CA ASN A 93 12.484 -21.804 9.358 1.00 0.26 C ATOM 1220 C ASN A 93 13.855 -21.589 8.708 1.00 0.26 C ATOM 1221 O ASN A 93 14.786 -22.339 8.928 1.00 0.32 O ATOM 1222 CB ASN A 93 11.584 -22.672 8.472 1.00 0.30 C ATOM 1223 CG ASN A 93 11.287 -23.995 9.183 1.00 0.55 C ATOM 1224 OD1 ASN A 93 12.162 -24.823 9.339 1.00 0.95 O ATOM 1225 ND2 ASN A 93 10.082 -24.227 9.625 1.00 0.82 N ATOM 0 H ASN A 93 10.877 -20.442 9.017 1.00 0.25 H new ATOM 0 HA ASN A 93 12.637 -22.277 10.328 1.00 0.26 H new ATOM 0 HB2 ASN A 93 10.654 -22.147 8.256 1.00 0.30 H new ATOM 0 HB3 ASN A 93 12.072 -22.863 7.516 1.00 0.30 H new ATOM 0 HD21 ASN A 93 9.874 -25.104 10.102 1.00 0.82 H new ATOM 0 HD22 ASN A 93 9.348 -23.531 9.494 1.00 0.82 H new ATOM 1232 N ILE A 94 13.978 -20.541 7.921 1.00 0.24 N ATOM 1233 CA ILE A 94 15.286 -20.240 7.268 1.00 0.27 C ATOM 1234 C ILE A 94 16.161 -19.377 8.187 1.00 0.26 C ATOM 1235 O ILE A 94 17.368 -19.530 8.204 1.00 0.31 O ATOM 1236 CB ILE A 94 14.974 -19.465 5.980 1.00 0.30 C ATOM 1237 CG1 ILE A 94 13.685 -19.997 5.335 1.00 0.34 C ATOM 1238 CG2 ILE A 94 16.148 -19.624 5.011 1.00 0.36 C ATOM 1239 CD1 ILE A 94 13.692 -19.737 3.823 1.00 0.50 C ATOM 0 H ILE A 94 13.227 -19.885 7.706 1.00 0.24 H new ATOM 0 HA ILE A 94 15.828 -21.162 7.058 1.00 0.27 H new ATOM 0 HB ILE A 94 14.829 -18.411 6.216 1.00 0.30 H new ATOM 0 HG12 ILE A 94 13.591 -21.066 5.525 1.00 0.34 H new ATOM 0 HG13 ILE A 94 12.819 -19.515 5.789 1.00 0.34 H new ATOM 0 HG21 ILE A 94 15.938 -19.077 4.092 1.00 0.36 H new ATOM 0 HG22 ILE A 94 17.054 -19.228 5.469 1.00 0.36 H new ATOM 0 HG23 ILE A 94 16.289 -20.680 4.781 1.00 0.36 H new ATOM 0 HD11 ILE A 94 12.771 -20.121 3.384 1.00 0.50 H new ATOM 0 HD12 ILE A 94 13.763 -18.665 3.638 1.00 0.50 H new ATOM 0 HD13 ILE A 94 14.547 -20.240 3.371 1.00 0.50 H new ATOM 1251 N LEU A 95 15.583 -18.454 8.936 1.00 0.24 N ATOM 1252 CA LEU A 95 16.442 -17.592 9.815 1.00 0.26 C ATOM 1253 C LEU A 95 16.487 -18.113 11.259 1.00 0.28 C ATOM 1254 O LEU A 95 16.977 -17.439 12.146 1.00 0.34 O ATOM 1255 CB LEU A 95 15.834 -16.188 9.756 1.00 0.26 C ATOM 1256 CG LEU A 95 14.386 -16.219 10.232 1.00 0.25 C ATOM 1257 CD1 LEU A 95 14.286 -15.571 11.613 1.00 0.33 C ATOM 1258 CD2 LEU A 95 13.516 -15.443 9.240 1.00 0.28 C ATOM 0 H LEU A 95 14.581 -18.267 8.975 1.00 0.24 H new ATOM 0 HA LEU A 95 17.475 -17.596 9.468 1.00 0.26 H new ATOM 0 HB2 LEU A 95 16.414 -15.506 10.378 1.00 0.26 H new ATOM 0 HB3 LEU A 95 15.881 -15.806 8.736 1.00 0.26 H new ATOM 0 HG LEU A 95 14.043 -17.252 10.294 1.00 0.25 H new ATOM 0 HD11 LEU A 95 13.250 -15.594 11.952 1.00 0.33 H new ATOM 0 HD12 LEU A 95 14.911 -16.119 12.318 1.00 0.33 H new ATOM 0 HD13 LEU A 95 14.626 -14.537 11.555 1.00 0.33 H new ATOM 0 HD21 LEU A 95 12.479 -15.461 9.574 1.00 0.28 H new ATOM 0 HD22 LEU A 95 13.861 -14.411 9.183 1.00 0.28 H new ATOM 0 HD23 LEU A 95 13.588 -15.904 8.255 1.00 0.28 H new ATOM 1270 N ASN A 96 16.007 -19.309 11.500 1.00 0.28 N ATOM 1271 CA ASN A 96 16.054 -19.875 12.886 1.00 0.33 C ATOM 1272 C ASN A 96 16.867 -21.173 12.888 1.00 0.36 C ATOM 1273 O ASN A 96 17.524 -21.504 13.857 1.00 0.42 O ATOM 1274 CB ASN A 96 14.601 -20.152 13.276 1.00 0.35 C ATOM 1275 CG ASN A 96 13.974 -18.878 13.848 1.00 0.38 C ATOM 1276 OD1 ASN A 96 13.069 -18.242 13.157 1.00 0.47 O flip ATOM 1277 ND2 ASN A 96 14.313 -18.457 14.936 1.00 0.42 N flip ATOM 0 H ASN A 96 15.585 -19.917 10.798 1.00 0.28 H new ATOM 0 HA ASN A 96 16.528 -19.191 13.590 1.00 0.33 H new ATOM 0 HB2 ASN A 96 14.038 -20.488 12.406 1.00 0.35 H new ATOM 0 HB3 ASN A 96 14.558 -20.954 14.013 1.00 0.35 H new ATOM 0 HD21 ASN A 96 15.021 -18.954 15.477 1.00 0.42 H new ATOM 0 HD22 ASN A 96 13.890 -17.607 15.308 1.00 0.42 H new ATOM 1738 N PRO B 43 12.098 0.378 12.249 1.00 0.30 N ATOM 1739 CA PRO B 43 11.345 -0.796 11.760 1.00 0.30 C ATOM 1740 C PRO B 43 12.303 -1.837 11.175 1.00 0.29 C ATOM 1741 O PRO B 43 12.198 -3.017 11.455 1.00 0.35 O ATOM 1742 CB PRO B 43 10.452 -0.211 10.673 1.00 0.33 C ATOM 1743 CG PRO B 43 11.151 1.028 10.192 1.00 0.35 C ATOM 1744 CD PRO B 43 12.165 1.436 11.236 1.00 0.35 C ATOM 0 HA PRO B 43 10.783 -1.306 12.543 1.00 0.30 H new ATOM 0 HB2 PRO B 43 10.311 -0.921 9.859 1.00 0.33 H new ATOM 0 HB3 PRO B 43 9.463 0.025 11.065 1.00 0.33 H new ATOM 0 HG2 PRO B 43 11.643 0.840 9.238 1.00 0.35 H new ATOM 0 HG3 PRO B 43 10.432 1.830 10.027 1.00 0.35 H new ATOM 0 HD2 PRO B 43 13.165 1.513 10.809 1.00 0.35 H new ATOM 0 HD3 PRO B 43 11.925 2.410 11.663 1.00 0.35 H new ATOM 1752 N LEU B 44 13.231 -1.403 10.359 1.00 0.28 N ATOM 1753 CA LEU B 44 14.209 -2.346 9.733 1.00 0.32 C ATOM 1754 C LEU B 44 13.482 -3.447 8.953 1.00 0.31 C ATOM 1755 O LEU B 44 14.066 -4.460 8.614 1.00 0.41 O ATOM 1756 CB LEU B 44 15.006 -2.945 10.893 1.00 0.37 C ATOM 1757 CG LEU B 44 16.278 -3.602 10.347 1.00 0.46 C ATOM 1758 CD1 LEU B 44 17.494 -2.738 10.690 1.00 0.61 C ATOM 1759 CD2 LEU B 44 16.446 -4.989 10.973 1.00 0.67 C ATOM 0 H LEU B 44 13.354 -0.425 10.097 1.00 0.28 H new ATOM 0 HA LEU B 44 14.856 -1.835 9.021 1.00 0.32 H new ATOM 0 HB2 LEU B 44 15.264 -2.167 11.612 1.00 0.37 H new ATOM 0 HB3 LEU B 44 14.401 -3.681 11.423 1.00 0.37 H new ATOM 0 HG LEU B 44 16.197 -3.698 9.264 1.00 0.46 H new ATOM 0 HD11 LEU B 44 18.396 -3.209 10.300 1.00 0.61 H new ATOM 0 HD12 LEU B 44 17.377 -1.751 10.242 1.00 0.61 H new ATOM 0 HD13 LEU B 44 17.576 -2.638 11.772 1.00 0.61 H new ATOM 0 HD21 LEU B 44 17.351 -5.456 10.585 1.00 0.67 H new ATOM 0 HD22 LEU B 44 16.524 -4.892 12.056 1.00 0.67 H new ATOM 0 HD23 LEU B 44 15.583 -5.607 10.725 1.00 0.67 H new ATOM 1771 N LYS B 45 12.223 -3.252 8.650 1.00 0.28 N ATOM 1772 CA LYS B 45 11.472 -4.282 7.872 1.00 0.28 C ATOM 1773 C LYS B 45 11.791 -4.114 6.386 1.00 0.28 C ATOM 1774 O LYS B 45 11.732 -5.053 5.624 1.00 0.31 O ATOM 1775 CB LYS B 45 9.989 -4.013 8.156 1.00 0.31 C ATOM 1776 CG LYS B 45 9.593 -2.634 7.620 1.00 0.33 C ATOM 1777 CD LYS B 45 8.076 -2.463 7.722 1.00 0.37 C ATOM 1778 CE LYS B 45 7.662 -2.425 9.195 1.00 0.40 C ATOM 1779 NZ LYS B 45 6.364 -1.695 9.211 1.00 0.31 N ATOM 0 H LYS B 45 11.684 -2.425 8.908 1.00 0.28 H new ATOM 0 HA LYS B 45 11.739 -5.302 8.150 1.00 0.28 H new ATOM 0 HB2 LYS B 45 9.376 -4.783 7.689 1.00 0.31 H new ATOM 0 HB3 LYS B 45 9.801 -4.063 9.229 1.00 0.31 H new ATOM 0 HG2 LYS B 45 10.097 -1.853 8.189 1.00 0.33 H new ATOM 0 HG3 LYS B 45 9.912 -2.530 6.583 1.00 0.33 H new ATOM 0 HD2 LYS B 45 7.769 -1.543 7.224 1.00 0.37 H new ATOM 0 HD3 LYS B 45 7.572 -3.285 7.213 1.00 0.37 H new ATOM 0 HE2 LYS B 45 7.554 -3.431 9.601 1.00 0.40 H new ATOM 0 HE3 LYS B 45 8.410 -1.915 9.802 1.00 0.40 H new ATOM 0 HZ1 LYS B 45 6.410 -0.920 9.903 1.00 0.31 H new ATOM 0 HZ2 LYS B 45 6.174 -1.305 8.266 1.00 0.31 H new ATOM 0 HZ3 LYS B 45 5.601 -2.350 9.475 1.00 0.31 H new ATOM 1793 N LEU B 46 12.131 -2.910 5.989 1.00 0.29 N ATOM 1794 CA LEU B 46 12.477 -2.610 4.559 1.00 0.32 C ATOM 1795 C LEU B 46 13.231 -3.777 3.895 1.00 0.32 C ATOM 1796 O LEU B 46 12.997 -4.102 2.743 1.00 0.37 O ATOM 1797 CB LEU B 46 13.396 -1.382 4.648 1.00 0.34 C ATOM 1798 CG LEU B 46 12.933 -0.289 3.678 1.00 0.49 C ATOM 1799 CD1 LEU B 46 12.759 -0.869 2.271 1.00 0.69 C ATOM 1800 CD2 LEU B 46 11.604 0.294 4.166 1.00 0.60 C ATOM 0 H LEU B 46 12.185 -2.103 6.610 1.00 0.29 H new ATOM 0 HA LEU B 46 11.584 -2.445 3.956 1.00 0.32 H new ATOM 0 HB2 LEU B 46 13.397 -0.995 5.667 1.00 0.34 H new ATOM 0 HB3 LEU B 46 14.421 -1.671 4.416 1.00 0.34 H new ATOM 0 HG LEU B 46 13.686 0.498 3.642 1.00 0.49 H new ATOM 0 HD11 LEU B 46 12.430 -0.083 1.592 1.00 0.69 H new ATOM 0 HD12 LEU B 46 13.710 -1.274 1.924 1.00 0.69 H new ATOM 0 HD13 LEU B 46 12.013 -1.664 2.295 1.00 0.69 H new ATOM 0 HD21 LEU B 46 11.273 1.072 3.477 1.00 0.60 H new ATOM 0 HD22 LEU B 46 10.854 -0.496 4.209 1.00 0.60 H new ATOM 0 HD23 LEU B 46 11.737 0.722 5.160 1.00 0.60 H new ATOM 1812 N PHE B 47 14.127 -4.407 4.616 1.00 0.30 N ATOM 1813 CA PHE B 47 14.902 -5.546 4.038 1.00 0.31 C ATOM 1814 C PHE B 47 14.017 -6.788 3.984 1.00 0.29 C ATOM 1815 O PHE B 47 13.948 -7.473 2.980 1.00 0.31 O ATOM 1816 CB PHE B 47 16.084 -5.740 5.002 1.00 0.34 C ATOM 1817 CG PHE B 47 16.626 -7.151 4.909 1.00 0.32 C ATOM 1818 CD1 PHE B 47 16.837 -7.748 3.659 1.00 0.36 C ATOM 1819 CD2 PHE B 47 16.917 -7.862 6.079 1.00 0.35 C ATOM 1820 CE1 PHE B 47 17.339 -9.053 3.582 1.00 0.40 C ATOM 1821 CE2 PHE B 47 17.418 -9.166 6.002 1.00 0.39 C ATOM 1822 CZ PHE B 47 17.629 -9.762 4.754 1.00 0.39 C ATOM 0 H PHE B 47 14.355 -4.179 5.584 1.00 0.30 H new ATOM 0 HA PHE B 47 15.245 -5.361 3.020 1.00 0.31 H new ATOM 0 HB2 PHE B 47 16.873 -5.026 4.766 1.00 0.34 H new ATOM 0 HB3 PHE B 47 15.764 -5.535 6.024 1.00 0.34 H new ATOM 0 HD1 PHE B 47 16.612 -7.202 2.755 1.00 0.36 H new ATOM 0 HD2 PHE B 47 16.754 -7.403 7.043 1.00 0.35 H new ATOM 0 HE1 PHE B 47 17.502 -9.513 2.618 1.00 0.40 H new ATOM 0 HE2 PHE B 47 17.642 -9.713 6.906 1.00 0.39 H new ATOM 0 HZ PHE B 47 18.015 -10.769 4.695 1.00 0.39 H new ATOM 1832 N MET B 48 13.337 -7.071 5.058 1.00 0.29 N ATOM 1833 CA MET B 48 12.443 -8.259 5.088 1.00 0.29 C ATOM 1834 C MET B 48 11.305 -8.079 4.085 1.00 0.27 C ATOM 1835 O MET B 48 11.007 -8.964 3.313 1.00 0.32 O ATOM 1836 CB MET B 48 11.899 -8.310 6.517 1.00 0.33 C ATOM 1837 CG MET B 48 12.093 -9.715 7.083 1.00 0.36 C ATOM 1838 SD MET B 48 13.217 -9.657 8.500 1.00 0.39 S ATOM 1839 CE MET B 48 14.664 -9.051 7.601 1.00 0.38 C ATOM 0 H MET B 48 13.362 -6.527 5.921 1.00 0.29 H new ATOM 0 HA MET B 48 12.963 -9.179 4.820 1.00 0.29 H new ATOM 0 HB2 MET B 48 12.415 -7.580 7.141 1.00 0.33 H new ATOM 0 HB3 MET B 48 10.842 -8.045 6.525 1.00 0.33 H new ATOM 0 HG2 MET B 48 11.132 -10.130 7.387 1.00 0.36 H new ATOM 0 HG3 MET B 48 12.496 -10.374 6.314 1.00 0.36 H new ATOM 0 HE1 MET B 48 15.570 -9.330 8.139 1.00 0.38 H new ATOM 0 HE2 MET B 48 14.684 -9.491 6.604 1.00 0.38 H new ATOM 0 HE3 MET B 48 14.612 -7.965 7.517 1.00 0.38 H new ATOM 1849 N ALA B 49 10.670 -6.936 4.099 1.00 0.28 N ATOM 1850 CA ALA B 49 9.541 -6.675 3.155 1.00 0.31 C ATOM 1851 C ALA B 49 9.985 -6.874 1.702 1.00 0.31 C ATOM 1852 O ALA B 49 9.350 -7.586 0.947 1.00 0.37 O ATOM 1853 CB ALA B 49 9.151 -5.216 3.398 1.00 0.35 C ATOM 0 H ALA B 49 10.887 -6.165 4.730 1.00 0.28 H new ATOM 0 HA ALA B 49 8.709 -7.359 3.321 1.00 0.31 H new ATOM 0 HB1 ALA B 49 8.325 -4.946 2.740 1.00 0.35 H new ATOM 0 HB2 ALA B 49 8.844 -5.089 4.436 1.00 0.35 H new ATOM 0 HB3 ALA B 49 10.005 -4.572 3.191 1.00 0.35 H new ATOM 1859 N LEU B 50 11.063 -6.245 1.301 1.00 0.31 N ATOM 1860 CA LEU B 50 11.532 -6.396 -0.112 1.00 0.36 C ATOM 1861 C LEU B 50 11.823 -7.866 -0.436 1.00 0.33 C ATOM 1862 O LEU B 50 11.221 -8.442 -1.325 1.00 0.37 O ATOM 1863 CB LEU B 50 12.809 -5.562 -0.207 1.00 0.44 C ATOM 1864 CG LEU B 50 12.892 -4.926 -1.595 1.00 0.57 C ATOM 1865 CD1 LEU B 50 11.756 -3.913 -1.761 1.00 0.93 C ATOM 1866 CD2 LEU B 50 14.236 -4.213 -1.751 1.00 0.92 C ATOM 0 H LEU B 50 11.635 -5.637 1.887 1.00 0.31 H new ATOM 0 HA LEU B 50 10.776 -6.065 -0.824 1.00 0.36 H new ATOM 0 HB2 LEU B 50 12.811 -4.789 0.561 1.00 0.44 H new ATOM 0 HB3 LEU B 50 13.682 -6.190 -0.029 1.00 0.44 H new ATOM 0 HG LEU B 50 12.802 -5.702 -2.355 1.00 0.57 H new ATOM 0 HD11 LEU B 50 11.815 -3.459 -2.750 1.00 0.93 H new ATOM 0 HD12 LEU B 50 10.797 -4.420 -1.651 1.00 0.93 H new ATOM 0 HD13 LEU B 50 11.846 -3.138 -1.000 1.00 0.93 H new ATOM 0 HD21 LEU B 50 14.295 -3.760 -2.741 1.00 0.92 H new ATOM 0 HD22 LEU B 50 14.327 -3.437 -0.991 1.00 0.92 H new ATOM 0 HD23 LEU B 50 15.046 -4.933 -1.633 1.00 0.92 H new ATOM 1878 N VAL B 51 12.742 -8.476 0.272 1.00 0.29 N ATOM 1879 CA VAL B 51 13.077 -9.902 0.002 1.00 0.30 C ATOM 1880 C VAL B 51 11.831 -10.782 0.166 1.00 0.27 C ATOM 1881 O VAL B 51 11.632 -11.718 -0.580 1.00 0.31 O ATOM 1882 CB VAL B 51 14.155 -10.250 1.036 1.00 0.37 C ATOM 1883 CG1 VAL B 51 14.377 -11.760 1.074 1.00 0.48 C ATOM 1884 CG2 VAL B 51 15.463 -9.557 0.651 1.00 0.52 C ATOM 0 H VAL B 51 13.274 -8.043 1.027 1.00 0.29 H new ATOM 0 HA VAL B 51 13.430 -10.068 -1.016 1.00 0.30 H new ATOM 0 HB VAL B 51 13.830 -9.912 2.020 1.00 0.37 H new ATOM 0 HG11 VAL B 51 15.144 -11.997 1.811 1.00 0.48 H new ATOM 0 HG12 VAL B 51 13.446 -12.258 1.346 1.00 0.48 H new ATOM 0 HG13 VAL B 51 14.699 -12.105 0.092 1.00 0.48 H new ATOM 0 HG21 VAL B 51 16.233 -9.801 1.383 1.00 0.52 H new ATOM 0 HG22 VAL B 51 15.779 -9.898 -0.335 1.00 0.52 H new ATOM 0 HG23 VAL B 51 15.311 -8.478 0.631 1.00 0.52 H new ATOM 1894 N ALA B 52 10.992 -10.483 1.127 1.00 0.26 N ATOM 1895 CA ALA B 52 9.755 -11.303 1.332 1.00 0.29 C ATOM 1896 C ALA B 52 8.880 -11.254 0.080 1.00 0.29 C ATOM 1897 O ALA B 52 8.507 -12.278 -0.464 1.00 0.35 O ATOM 1898 CB ALA B 52 9.032 -10.658 2.515 1.00 0.36 C ATOM 0 H ALA B 52 11.109 -9.707 1.779 1.00 0.26 H new ATOM 0 HA ALA B 52 9.985 -12.351 1.523 1.00 0.29 H new ATOM 0 HB1 ALA B 52 8.114 -11.207 2.723 1.00 0.36 H new ATOM 0 HB2 ALA B 52 9.677 -10.683 3.393 1.00 0.36 H new ATOM 0 HB3 ALA B 52 8.789 -9.623 2.273 1.00 0.36 H new ATOM 1904 N PHE B 53 8.563 -10.068 -0.385 1.00 0.30 N ATOM 1905 CA PHE B 53 7.724 -9.928 -1.617 1.00 0.35 C ATOM 1906 C PHE B 53 8.314 -10.804 -2.726 1.00 0.33 C ATOM 1907 O PHE B 53 7.650 -11.663 -3.289 1.00 0.38 O ATOM 1908 CB PHE B 53 7.820 -8.438 -1.974 1.00 0.42 C ATOM 1909 CG PHE B 53 7.305 -8.195 -3.375 1.00 0.46 C ATOM 1910 CD1 PHE B 53 5.928 -8.178 -3.623 1.00 0.52 C ATOM 1911 CD2 PHE B 53 8.209 -7.981 -4.422 1.00 0.63 C ATOM 1912 CE1 PHE B 53 5.455 -7.947 -4.921 1.00 0.64 C ATOM 1913 CE2 PHE B 53 7.736 -7.750 -5.719 1.00 0.76 C ATOM 1914 CZ PHE B 53 6.359 -7.733 -5.968 1.00 0.73 C ATOM 0 H PHE B 53 8.852 -9.186 0.039 1.00 0.30 H new ATOM 0 HA PHE B 53 6.689 -10.241 -1.480 1.00 0.35 H new ATOM 0 HB2 PHE B 53 7.243 -7.849 -1.261 1.00 0.42 H new ATOM 0 HB3 PHE B 53 8.855 -8.106 -1.898 1.00 0.42 H new ATOM 0 HD1 PHE B 53 5.231 -8.343 -2.815 1.00 0.52 H new ATOM 0 HD2 PHE B 53 9.272 -7.994 -4.229 1.00 0.63 H new ATOM 0 HE1 PHE B 53 4.392 -7.934 -5.114 1.00 0.64 H new ATOM 0 HE2 PHE B 53 8.433 -7.585 -6.527 1.00 0.76 H new ATOM 0 HZ PHE B 53 5.994 -7.555 -6.969 1.00 0.73 H new ATOM 1924 N LEU B 54 9.572 -10.612 -3.013 1.00 0.33 N ATOM 1925 CA LEU B 54 10.234 -11.442 -4.056 1.00 0.38 C ATOM 1926 C LEU B 54 10.143 -12.916 -3.650 1.00 0.35 C ATOM 1927 O LEU B 54 9.918 -13.781 -4.471 1.00 0.39 O ATOM 1928 CB LEU B 54 11.691 -10.970 -4.082 1.00 0.44 C ATOM 1929 CG LEU B 54 11.746 -9.461 -4.337 1.00 0.59 C ATOM 1930 CD1 LEU B 54 13.181 -8.968 -4.149 1.00 0.97 C ATOM 1931 CD2 LEU B 54 11.288 -9.169 -5.768 1.00 1.11 C ATOM 0 H LEU B 54 10.170 -9.915 -2.569 1.00 0.33 H new ATOM 0 HA LEU B 54 9.771 -11.342 -5.038 1.00 0.38 H new ATOM 0 HB2 LEU B 54 12.175 -11.205 -3.134 1.00 0.44 H new ATOM 0 HB3 LEU B 54 12.240 -11.499 -4.861 1.00 0.44 H new ATOM 0 HG LEU B 54 11.089 -8.947 -3.635 1.00 0.59 H new ATOM 0 HD11 LEU B 54 13.223 -7.894 -4.330 1.00 0.97 H new ATOM 0 HD12 LEU B 54 13.507 -9.178 -3.130 1.00 0.97 H new ATOM 0 HD13 LEU B 54 13.837 -9.481 -4.853 1.00 0.97 H new ATOM 0 HD21 LEU B 54 11.327 -8.095 -5.950 1.00 1.11 H new ATOM 0 HD22 LEU B 54 11.945 -9.681 -6.472 1.00 1.11 H new ATOM 0 HD23 LEU B 54 10.266 -9.523 -5.902 1.00 1.11 H new ATOM 1943 N ARG B 55 10.299 -13.195 -2.377 1.00 0.34 N ATOM 1944 CA ARG B 55 10.212 -14.606 -1.892 1.00 0.35 C ATOM 1945 C ARG B 55 8.790 -15.148 -2.067 1.00 0.34 C ATOM 1946 O ARG B 55 8.560 -16.339 -1.986 1.00 0.35 O ATOM 1947 CB ARG B 55 10.586 -14.549 -0.408 1.00 0.38 C ATOM 1948 CG ARG B 55 10.977 -15.947 0.076 1.00 0.41 C ATOM 1949 CD ARG B 55 9.817 -16.561 0.861 1.00 0.45 C ATOM 1950 NE ARG B 55 9.840 -18.007 0.509 1.00 0.43 N ATOM 1951 CZ ARG B 55 8.735 -18.701 0.524 1.00 0.39 C ATOM 1952 NH1 ARG B 55 7.910 -18.634 -0.484 1.00 0.38 N ATOM 1953 NH2 ARG B 55 8.456 -19.460 1.548 1.00 0.45 N ATOM 0 H ARG B 55 10.484 -12.502 -1.652 1.00 0.34 H new ATOM 0 HA ARG B 55 10.873 -15.268 -2.452 1.00 0.35 H new ATOM 0 HB2 ARG B 55 11.414 -13.856 -0.257 1.00 0.38 H new ATOM 0 HB3 ARG B 55 9.745 -14.173 0.175 1.00 0.38 H new ATOM 0 HG2 ARG B 55 11.229 -16.580 -0.775 1.00 0.41 H new ATOM 0 HG3 ARG B 55 11.865 -15.890 0.705 1.00 0.41 H new ATOM 0 HD2 ARG B 55 9.944 -16.413 1.933 1.00 0.45 H new ATOM 0 HD3 ARG B 55 8.867 -16.102 0.586 1.00 0.45 H new ATOM 0 HE ARG B 55 10.720 -18.456 0.256 1.00 0.43 H new ATOM 0 HH11 ARG B 55 8.129 -18.039 -1.283 1.00 0.38 H new ATOM 0 HH12 ARG B 55 7.046 -19.176 -0.473 1.00 0.38 H new ATOM 0 HH21 ARG B 55 9.101 -19.511 2.336 1.00 0.45 H new ATOM 0 HH22 ARG B 55 7.592 -20.003 1.560 1.00 0.45 H new ATOM 1967 N PHE B 56 7.835 -14.288 -2.308 1.00 0.35 N ATOM 1968 CA PHE B 56 6.436 -14.768 -2.492 1.00 0.35 C ATOM 1969 C PHE B 56 6.134 -14.965 -3.978 1.00 0.36 C ATOM 1970 O PHE B 56 5.218 -15.682 -4.336 1.00 0.39 O ATOM 1971 CB PHE B 56 5.539 -13.665 -1.921 1.00 0.34 C ATOM 1972 CG PHE B 56 5.871 -13.404 -0.465 1.00 0.31 C ATOM 1973 CD1 PHE B 56 6.348 -14.435 0.361 1.00 0.39 C ATOM 1974 CD2 PHE B 56 5.690 -12.119 0.061 1.00 0.45 C ATOM 1975 CE1 PHE B 56 6.640 -14.177 1.705 1.00 0.38 C ATOM 1976 CE2 PHE B 56 5.984 -11.863 1.405 1.00 0.56 C ATOM 1977 CZ PHE B 56 6.459 -12.891 2.227 1.00 0.46 C ATOM 0 H PHE B 56 7.963 -13.279 -2.385 1.00 0.35 H new ATOM 0 HA PHE B 56 6.273 -15.724 -1.994 1.00 0.35 H new ATOM 0 HB2 PHE B 56 5.668 -12.749 -2.498 1.00 0.34 H new ATOM 0 HB3 PHE B 56 4.493 -13.956 -2.014 1.00 0.34 H new ATOM 0 HD1 PHE B 56 6.489 -15.427 -0.041 1.00 0.39 H new ATOM 0 HD2 PHE B 56 5.323 -11.324 -0.571 1.00 0.45 H new ATOM 0 HE1 PHE B 56 7.005 -14.971 2.340 1.00 0.38 H new ATOM 0 HE2 PHE B 56 5.844 -10.871 1.808 1.00 0.56 H new ATOM 0 HZ PHE B 56 6.686 -12.692 3.264 1.00 0.46 H new ATOM 1987 N LEU B 57 6.873 -14.315 -4.846 1.00 0.36 N ATOM 1988 CA LEU B 57 6.588 -14.453 -6.310 1.00 0.39 C ATOM 1989 C LEU B 57 7.643 -15.306 -7.034 1.00 0.49 C ATOM 1990 O LEU B 57 7.314 -16.052 -7.937 1.00 0.59 O ATOM 1991 CB LEU B 57 6.594 -13.022 -6.858 1.00 0.38 C ATOM 1992 CG LEU B 57 5.846 -12.088 -5.898 1.00 0.34 C ATOM 1993 CD1 LEU B 57 5.879 -10.658 -6.443 1.00 0.41 C ATOM 1994 CD2 LEU B 57 4.391 -12.552 -5.751 1.00 0.35 C ATOM 0 H LEU B 57 7.652 -13.702 -4.608 1.00 0.36 H new ATOM 0 HA LEU B 57 5.638 -14.962 -6.471 1.00 0.39 H new ATOM 0 HB2 LEU B 57 7.620 -12.678 -6.987 1.00 0.38 H new ATOM 0 HB3 LEU B 57 6.124 -12.999 -7.841 1.00 0.38 H new ATOM 0 HG LEU B 57 6.330 -12.113 -4.922 1.00 0.34 H new ATOM 0 HD11 LEU B 57 5.347 -9.996 -5.760 1.00 0.41 H new ATOM 0 HD12 LEU B 57 6.914 -10.328 -6.536 1.00 0.41 H new ATOM 0 HD13 LEU B 57 5.400 -10.630 -7.422 1.00 0.41 H new ATOM 0 HD21 LEU B 57 3.864 -11.886 -5.068 1.00 0.35 H new ATOM 0 HD22 LEU B 57 3.903 -12.533 -6.725 1.00 0.35 H new ATOM 0 HD23 LEU B 57 4.371 -13.567 -5.355 1.00 0.35 H new ATOM 2006 N THR B 58 8.903 -15.193 -6.679 1.00 0.50 N ATOM 2007 CA THR B 58 9.946 -15.997 -7.398 1.00 0.62 C ATOM 2008 C THR B 58 11.101 -16.422 -6.475 1.00 0.56 C ATOM 2009 O THR B 58 11.938 -17.217 -6.861 1.00 0.60 O ATOM 2010 CB THR B 58 10.459 -15.059 -8.490 1.00 0.71 C ATOM 2011 OG1 THR B 58 9.374 -14.653 -9.313 1.00 1.09 O ATOM 2012 CG2 THR B 58 11.501 -15.785 -9.339 1.00 1.00 C ATOM 0 H THR B 58 9.251 -14.589 -5.934 1.00 0.50 H new ATOM 0 HA THR B 58 9.530 -16.927 -7.786 1.00 0.62 H new ATOM 0 HB THR B 58 10.915 -14.182 -8.031 1.00 0.71 H new ATOM 0 HG1 THR B 58 9.702 -14.050 -10.013 1.00 1.09 H new ATOM 0 HG21 THR B 58 11.866 -15.115 -10.118 1.00 1.00 H new ATOM 0 HG22 THR B 58 12.333 -16.095 -8.707 1.00 1.00 H new ATOM 0 HG23 THR B 58 11.048 -16.663 -9.799 1.00 1.00 H new ATOM 2020 N ILE B 59 11.159 -15.902 -5.275 1.00 0.52 N ATOM 2021 CA ILE B 59 12.259 -16.269 -4.329 1.00 0.50 C ATOM 2022 C ILE B 59 13.642 -16.071 -4.978 1.00 0.50 C ATOM 2023 O ILE B 59 14.403 -17.010 -5.116 1.00 0.55 O ATOM 2024 CB ILE B 59 12.024 -17.743 -3.981 1.00 0.55 C ATOM 2025 CG1 ILE B 59 10.671 -17.901 -3.282 1.00 0.58 C ATOM 2026 CG2 ILE B 59 13.137 -18.229 -3.042 1.00 0.56 C ATOM 2027 CD1 ILE B 59 9.548 -17.933 -4.323 1.00 0.58 C ATOM 0 H ILE B 59 10.485 -15.232 -4.906 1.00 0.52 H new ATOM 0 HA ILE B 59 12.249 -15.637 -3.441 1.00 0.50 H new ATOM 0 HB ILE B 59 12.030 -18.333 -4.897 1.00 0.55 H new ATOM 0 HG12 ILE B 59 10.660 -18.819 -2.694 1.00 0.58 H new ATOM 0 HG13 ILE B 59 10.512 -17.076 -2.588 1.00 0.58 H new ATOM 0 HG21 ILE B 59 12.971 -19.277 -2.793 1.00 0.56 H new ATOM 0 HG22 ILE B 59 14.103 -18.121 -3.536 1.00 0.56 H new ATOM 0 HG23 ILE B 59 13.128 -17.634 -2.129 1.00 0.56 H new ATOM 0 HD11 ILE B 59 8.588 -18.046 -3.819 1.00 0.58 H new ATOM 0 HD12 ILE B 59 9.552 -17.003 -4.892 1.00 0.58 H new ATOM 0 HD13 ILE B 59 9.703 -18.773 -5.000 1.00 0.58 H new ATOM 2039 N PRO B 60 13.927 -14.845 -5.349 1.00 0.49 N ATOM 2040 CA PRO B 60 15.221 -14.488 -5.956 1.00 0.52 C ATOM 2041 C PRO B 60 16.111 -13.744 -4.932 1.00 0.45 C ATOM 2042 O PRO B 60 16.421 -12.582 -5.129 1.00 0.51 O ATOM 2043 CB PRO B 60 14.775 -13.522 -7.055 1.00 0.63 C ATOM 2044 CG PRO B 60 13.461 -12.946 -6.570 1.00 0.62 C ATOM 2045 CD PRO B 60 13.082 -13.667 -5.293 1.00 0.53 C ATOM 0 HA PRO B 60 15.804 -15.341 -6.304 1.00 0.52 H new ATOM 0 HB2 PRO B 60 15.514 -12.737 -7.213 1.00 0.63 H new ATOM 0 HB3 PRO B 60 14.651 -14.039 -8.007 1.00 0.63 H new ATOM 0 HG2 PRO B 60 13.557 -11.875 -6.390 1.00 0.62 H new ATOM 0 HG3 PRO B 60 12.686 -13.074 -7.325 1.00 0.62 H new ATOM 0 HD2 PRO B 60 13.283 -13.063 -4.408 1.00 0.53 H new ATOM 0 HD3 PRO B 60 12.023 -13.925 -5.269 1.00 0.53 H new ATOM 2053 N PRO B 61 16.491 -14.411 -3.861 1.00 0.39 N ATOM 2054 CA PRO B 61 17.332 -13.749 -2.834 1.00 0.37 C ATOM 2055 C PRO B 61 18.749 -13.530 -3.367 1.00 0.33 C ATOM 2056 O PRO B 61 19.488 -14.470 -3.591 1.00 0.37 O ATOM 2057 CB PRO B 61 17.332 -14.732 -1.670 1.00 0.37 C ATOM 2058 CG PRO B 61 17.057 -16.058 -2.291 1.00 0.37 C ATOM 2059 CD PRO B 61 16.195 -15.803 -3.502 1.00 0.40 C ATOM 0 HA PRO B 61 16.959 -12.766 -2.547 1.00 0.37 H new ATOM 0 HB2 PRO B 61 18.290 -14.730 -1.150 1.00 0.37 H new ATOM 0 HB3 PRO B 61 16.570 -14.474 -0.935 1.00 0.37 H new ATOM 0 HG2 PRO B 61 17.986 -16.552 -2.575 1.00 0.37 H new ATOM 0 HG3 PRO B 61 16.549 -16.717 -1.587 1.00 0.37 H new ATOM 0 HD2 PRO B 61 16.438 -16.486 -4.316 1.00 0.40 H new ATOM 0 HD3 PRO B 61 15.138 -15.941 -3.276 1.00 0.40 H new ATOM 2067 N THR B 62 19.128 -12.294 -3.572 1.00 0.33 N ATOM 2068 CA THR B 62 20.497 -11.997 -4.092 1.00 0.34 C ATOM 2069 C THR B 62 21.555 -12.596 -3.151 1.00 0.31 C ATOM 2070 O THR B 62 21.250 -12.992 -2.043 1.00 0.32 O ATOM 2071 CB THR B 62 20.569 -10.458 -4.154 1.00 0.42 C ATOM 2072 OG1 THR B 62 20.796 -10.058 -5.497 1.00 0.59 O ATOM 2073 CG2 THR B 62 21.701 -9.924 -3.274 1.00 0.38 C ATOM 0 H THR B 62 18.545 -11.474 -3.401 1.00 0.33 H new ATOM 0 HA THR B 62 20.690 -12.433 -5.072 1.00 0.34 H new ATOM 0 HB THR B 62 19.626 -10.052 -3.788 1.00 0.42 H new ATOM 0 HG1 THR B 62 20.841 -9.080 -5.544 1.00 0.59 H new ATOM 0 HG21 THR B 62 21.729 -8.836 -3.337 1.00 0.38 H new ATOM 0 HG22 THR B 62 21.530 -10.223 -2.240 1.00 0.38 H new ATOM 0 HG23 THR B 62 22.652 -10.331 -3.617 1.00 0.38 H new ATOM 2081 N ALA B 63 22.785 -12.676 -3.598 1.00 0.36 N ATOM 2082 CA ALA B 63 23.876 -13.265 -2.753 1.00 0.40 C ATOM 2083 C ALA B 63 23.895 -12.638 -1.353 1.00 0.36 C ATOM 2084 O ALA B 63 24.025 -13.328 -0.360 1.00 0.39 O ATOM 2085 CB ALA B 63 25.174 -12.943 -3.499 1.00 0.53 C ATOM 0 H ALA B 63 23.084 -12.356 -4.519 1.00 0.36 H new ATOM 0 HA ALA B 63 23.735 -14.336 -2.607 1.00 0.40 H new ATOM 0 HB1 ALA B 63 26.022 -13.342 -2.943 1.00 0.53 H new ATOM 0 HB2 ALA B 63 25.145 -13.395 -4.491 1.00 0.53 H new ATOM 0 HB3 ALA B 63 25.280 -11.862 -3.596 1.00 0.53 H new ATOM 2091 N GLY B 64 23.776 -11.339 -1.272 1.00 0.34 N ATOM 2092 CA GLY B 64 23.795 -10.659 0.055 1.00 0.33 C ATOM 2093 C GLY B 64 22.679 -11.203 0.948 1.00 0.27 C ATOM 2094 O GLY B 64 22.892 -11.471 2.110 1.00 0.29 O ATOM 0 H GLY B 64 23.666 -10.717 -2.073 1.00 0.34 H new ATOM 0 HA2 GLY B 64 24.761 -10.812 0.536 1.00 0.33 H new ATOM 0 HA3 GLY B 64 23.672 -9.584 -0.078 1.00 0.33 H new ATOM 2098 N ILE B 65 21.492 -11.359 0.416 1.00 0.25 N ATOM 2099 CA ILE B 65 20.348 -11.879 1.238 1.00 0.23 C ATOM 2100 C ILE B 65 20.769 -13.134 2.008 1.00 0.24 C ATOM 2101 O ILE B 65 20.383 -13.329 3.144 1.00 0.28 O ATOM 2102 CB ILE B 65 19.228 -12.226 0.240 1.00 0.23 C ATOM 2103 CG1 ILE B 65 18.940 -11.041 -0.697 1.00 0.29 C ATOM 2104 CG2 ILE B 65 17.947 -12.577 1.008 1.00 0.27 C ATOM 2105 CD1 ILE B 65 18.752 -9.753 0.110 1.00 0.34 C ATOM 0 H ILE B 65 21.262 -11.149 -0.555 1.00 0.25 H new ATOM 0 HA ILE B 65 20.021 -11.141 1.970 1.00 0.23 H new ATOM 0 HB ILE B 65 19.555 -13.077 -0.358 1.00 0.23 H new ATOM 0 HG12 ILE B 65 19.762 -10.919 -1.402 1.00 0.29 H new ATOM 0 HG13 ILE B 65 18.044 -11.243 -1.284 1.00 0.29 H new ATOM 0 HG21 ILE B 65 17.155 -12.823 0.301 1.00 0.27 H new ATOM 0 HG22 ILE B 65 18.134 -13.434 1.655 1.00 0.27 H new ATOM 0 HG23 ILE B 65 17.641 -11.724 1.614 1.00 0.27 H new ATOM 0 HD11 ILE B 65 18.549 -8.925 -0.569 1.00 0.34 H new ATOM 0 HD12 ILE B 65 17.914 -9.873 0.797 1.00 0.34 H new ATOM 0 HD13 ILE B 65 19.659 -9.543 0.677 1.00 0.34 H new ATOM 2117 N LEU B 66 21.560 -13.980 1.397 1.00 0.25 N ATOM 2118 CA LEU B 66 22.005 -15.226 2.091 1.00 0.30 C ATOM 2119 C LEU B 66 23.184 -14.920 3.018 1.00 0.32 C ATOM 2120 O LEU B 66 23.166 -15.256 4.187 1.00 0.37 O ATOM 2121 CB LEU B 66 22.442 -16.188 0.978 1.00 0.34 C ATOM 2122 CG LEU B 66 21.221 -16.759 0.240 1.00 0.36 C ATOM 2123 CD1 LEU B 66 20.286 -17.473 1.225 1.00 0.53 C ATOM 2124 CD2 LEU B 66 20.466 -15.625 -0.458 1.00 0.39 C ATOM 0 H LEU B 66 21.916 -13.861 0.449 1.00 0.25 H new ATOM 0 HA LEU B 66 21.211 -15.653 2.704 1.00 0.30 H new ATOM 0 HB2 LEU B 66 23.088 -15.665 0.272 1.00 0.34 H new ATOM 0 HB3 LEU B 66 23.029 -17.002 1.404 1.00 0.34 H new ATOM 0 HG LEU B 66 21.564 -17.480 -0.502 1.00 0.36 H new ATOM 0 HD11 LEU B 66 19.426 -17.872 0.687 1.00 0.53 H new ATOM 0 HD12 LEU B 66 20.822 -18.290 1.709 1.00 0.53 H new ATOM 0 HD13 LEU B 66 19.945 -16.765 1.981 1.00 0.53 H new ATOM 0 HD21 LEU B 66 19.600 -16.032 -0.981 1.00 0.39 H new ATOM 0 HD22 LEU B 66 20.134 -14.899 0.284 1.00 0.39 H new ATOM 0 HD23 LEU B 66 21.126 -15.136 -1.175 1.00 0.39 H new ATOM 2136 N LYS B 67 24.207 -14.283 2.501 1.00 0.33 N ATOM 2137 CA LYS B 67 25.395 -13.947 3.345 1.00 0.38 C ATOM 2138 C LYS B 67 24.958 -13.125 4.559 1.00 0.36 C ATOM 2139 O LYS B 67 25.500 -13.257 5.640 1.00 0.43 O ATOM 2140 CB LYS B 67 26.306 -13.118 2.438 1.00 0.44 C ATOM 2141 CG LYS B 67 27.173 -14.053 1.593 1.00 0.50 C ATOM 2142 CD LYS B 67 28.290 -14.636 2.459 1.00 0.65 C ATOM 2143 CE LYS B 67 29.376 -13.580 2.671 1.00 0.86 C ATOM 2144 NZ LYS B 67 30.055 -13.975 3.937 1.00 1.64 N ATOM 0 H LYS B 67 24.270 -13.981 1.529 1.00 0.33 H new ATOM 0 HA LYS B 67 25.899 -14.836 3.724 1.00 0.38 H new ATOM 0 HB2 LYS B 67 25.707 -12.477 1.791 1.00 0.44 H new ATOM 0 HB3 LYS B 67 26.937 -12.464 3.039 1.00 0.44 H new ATOM 0 HG2 LYS B 67 26.563 -14.856 1.179 1.00 0.50 H new ATOM 0 HG3 LYS B 67 27.599 -13.509 0.750 1.00 0.50 H new ATOM 0 HD2 LYS B 67 27.889 -14.958 3.420 1.00 0.65 H new ATOM 0 HD3 LYS B 67 28.714 -15.518 1.979 1.00 0.65 H new ATOM 0 HE2 LYS B 67 30.077 -13.561 1.836 1.00 0.86 H new ATOM 0 HE3 LYS B 67 28.946 -12.581 2.749 1.00 0.86 H new ATOM 0 HZ1 LYS B 67 30.814 -13.297 4.150 1.00 1.64 H new ATOM 0 HZ2 LYS B 67 29.365 -13.977 4.715 1.00 1.64 H new ATOM 0 HZ3 LYS B 67 30.461 -14.927 3.831 1.00 1.64 H new ATOM 2158 N ARG B 68 23.973 -12.284 4.382 1.00 0.32 N ATOM 2159 CA ARG B 68 23.476 -11.449 5.511 1.00 0.32 C ATOM 2160 C ARG B 68 22.519 -12.276 6.379 1.00 0.29 C ATOM 2161 O ARG B 68 22.406 -12.065 7.571 1.00 0.30 O ATOM 2162 CB ARG B 68 22.767 -10.258 4.841 1.00 0.32 C ATOM 2163 CG ARG B 68 21.258 -10.507 4.741 1.00 0.31 C ATOM 2164 CD ARG B 68 20.628 -9.452 3.826 1.00 0.36 C ATOM 2165 NE ARG B 68 20.348 -8.289 4.715 1.00 0.52 N ATOM 2166 CZ ARG B 68 21.332 -7.558 5.164 1.00 0.49 C ATOM 2167 NH1 ARG B 68 22.291 -7.189 4.360 1.00 0.47 N ATOM 2168 NH2 ARG B 68 21.358 -7.199 6.418 1.00 0.70 N ATOM 0 H ARG B 68 23.489 -12.140 3.496 1.00 0.32 H new ATOM 0 HA ARG B 68 24.270 -11.104 6.174 1.00 0.32 H new ATOM 0 HB2 ARG B 68 22.953 -9.350 5.414 1.00 0.32 H new ATOM 0 HB3 ARG B 68 23.180 -10.097 3.845 1.00 0.32 H new ATOM 0 HG2 ARG B 68 21.068 -11.506 4.348 1.00 0.31 H new ATOM 0 HG3 ARG B 68 20.805 -10.463 5.731 1.00 0.31 H new ATOM 0 HD2 ARG B 68 21.304 -9.177 3.017 1.00 0.36 H new ATOM 0 HD3 ARG B 68 19.714 -9.825 3.364 1.00 0.36 H new ATOM 0 HE ARG B 68 19.387 -8.064 4.973 1.00 0.52 H new ATOM 0 HH11 ARG B 68 22.272 -7.472 3.380 1.00 0.47 H new ATOM 0 HH12 ARG B 68 23.060 -6.618 4.711 1.00 0.47 H new ATOM 0 HH21 ARG B 68 20.610 -7.490 7.047 1.00 0.70 H new ATOM 0 HH22 ARG B 68 22.127 -6.628 6.769 1.00 0.70 H new ATOM 2182 N TRP B 69 21.836 -13.219 5.775 1.00 0.28 N ATOM 2183 CA TRP B 69 20.876 -14.087 6.528 1.00 0.26 C ATOM 2184 C TRP B 69 21.519 -14.668 7.796 1.00 0.28 C ATOM 2185 O TRP B 69 20.855 -14.868 8.794 1.00 0.35 O ATOM 2186 CB TRP B 69 20.555 -15.221 5.557 1.00 0.27 C ATOM 2187 CG TRP B 69 19.168 -15.727 5.784 1.00 0.26 C ATOM 2188 CD1 TRP B 69 18.867 -16.993 6.147 1.00 0.29 C ATOM 2189 CD2 TRP B 69 17.894 -15.023 5.658 1.00 0.25 C ATOM 2190 NE1 TRP B 69 17.496 -17.115 6.249 1.00 0.30 N ATOM 2191 CE2 TRP B 69 16.852 -15.933 5.958 1.00 0.28 C ATOM 2192 CE3 TRP B 69 17.539 -13.701 5.316 1.00 0.26 C ATOM 2193 CZ2 TRP B 69 15.513 -15.552 5.919 1.00 0.30 C ATOM 2194 CZ3 TRP B 69 16.189 -13.319 5.278 1.00 0.28 C ATOM 2195 CH2 TRP B 69 15.182 -14.244 5.577 1.00 0.30 C ATOM 0 H TRP B 69 21.904 -13.427 4.779 1.00 0.28 H new ATOM 0 HA TRP B 69 19.998 -13.528 6.852 1.00 0.26 H new ATOM 0 HB2 TRP B 69 20.656 -14.868 4.531 1.00 0.27 H new ATOM 0 HB3 TRP B 69 21.271 -16.033 5.687 1.00 0.27 H new ATOM 0 HD1 TRP B 69 19.583 -17.781 6.328 1.00 0.29 H new ATOM 0 HE1 TRP B 69 17.017 -17.977 6.509 1.00 0.30 H new ATOM 0 HE3 TRP B 69 18.309 -12.980 5.083 1.00 0.26 H new ATOM 0 HZ2 TRP B 69 14.737 -16.266 6.152 1.00 0.30 H new ATOM 0 HZ3 TRP B 69 15.926 -12.305 5.016 1.00 0.28 H new ATOM 0 HH2 TRP B 69 14.146 -13.942 5.542 1.00 0.30 H new ATOM 2206 N GLY B 70 22.797 -14.961 7.754 1.00 0.28 N ATOM 2207 CA GLY B 70 23.472 -15.557 8.948 1.00 0.33 C ATOM 2208 C GLY B 70 24.517 -14.597 9.522 1.00 0.35 C ATOM 2209 O GLY B 70 25.630 -14.992 9.816 1.00 0.49 O ATOM 0 H GLY B 70 23.400 -14.813 6.945 1.00 0.28 H new ATOM 0 HA2 GLY B 70 22.730 -15.791 9.711 1.00 0.33 H new ATOM 0 HA3 GLY B 70 23.950 -16.496 8.669 1.00 0.33 H new ATOM 2213 N THR B 71 24.168 -13.349 9.704 1.00 0.29 N ATOM 2214 CA THR B 71 25.144 -12.375 10.283 1.00 0.33 C ATOM 2215 C THR B 71 24.443 -11.061 10.647 1.00 0.30 C ATOM 2216 O THR B 71 25.049 -10.006 10.647 1.00 0.37 O ATOM 2217 CB THR B 71 26.205 -12.157 9.195 1.00 0.39 C ATOM 2218 OG1 THR B 71 27.352 -11.551 9.774 1.00 0.43 O ATOM 2219 CG2 THR B 71 25.656 -11.250 8.091 1.00 0.44 C ATOM 0 H THR B 71 23.252 -12.962 9.478 1.00 0.29 H new ATOM 0 HA THR B 71 25.593 -12.748 11.204 1.00 0.33 H new ATOM 0 HB THR B 71 26.471 -13.121 8.761 1.00 0.39 H new ATOM 0 HG1 THR B 71 27.078 -10.778 10.310 1.00 0.43 H new ATOM 0 HG21 THR B 71 26.419 -11.104 7.327 1.00 0.44 H new ATOM 0 HG22 THR B 71 24.777 -11.714 7.643 1.00 0.44 H new ATOM 0 HG23 THR B 71 25.380 -10.285 8.516 1.00 0.44 H new ATOM 2227 N ILE B 72 23.173 -11.123 10.964 1.00 0.31 N ATOM 2228 CA ILE B 72 22.427 -9.886 11.339 1.00 0.31 C ATOM 2229 C ILE B 72 22.011 -9.951 12.816 1.00 0.33 C ATOM 2230 O ILE B 72 22.834 -10.191 13.680 1.00 0.45 O ATOM 2231 CB ILE B 72 21.209 -9.848 10.407 1.00 0.30 C ATOM 2232 CG1 ILE B 72 20.383 -11.125 10.576 1.00 0.30 C ATOM 2233 CG2 ILE B 72 21.678 -9.734 8.956 1.00 0.36 C ATOM 2234 CD1 ILE B 72 18.912 -10.816 10.289 1.00 0.28 C ATOM 0 H ILE B 72 22.621 -11.981 10.979 1.00 0.31 H new ATOM 0 HA ILE B 72 23.029 -8.984 11.229 1.00 0.31 H new ATOM 0 HB ILE B 72 20.593 -8.986 10.661 1.00 0.30 H new ATOM 0 HG12 ILE B 72 20.744 -11.898 9.897 1.00 0.30 H new ATOM 0 HG13 ILE B 72 20.494 -11.513 11.589 1.00 0.30 H new ATOM 0 HG21 ILE B 72 20.812 -9.707 8.295 1.00 0.36 H new ATOM 0 HG22 ILE B 72 22.258 -8.819 8.832 1.00 0.36 H new ATOM 0 HG23 ILE B 72 22.299 -10.594 8.706 1.00 0.36 H new ATOM 0 HD11 ILE B 72 18.320 -11.723 10.408 1.00 0.28 H new ATOM 0 HD12 ILE B 72 18.557 -10.057 10.986 1.00 0.28 H new ATOM 0 HD13 ILE B 72 18.810 -10.448 9.268 1.00 0.28 H new ATOM 2246 N LYS B 73 20.755 -9.727 13.117 1.00 0.31 N ATOM 2247 CA LYS B 73 20.304 -9.759 14.540 1.00 0.32 C ATOM 2248 C LYS B 73 19.288 -10.870 14.771 1.00 0.29 C ATOM 2249 O LYS B 73 19.249 -11.467 15.829 1.00 0.33 O ATOM 2250 CB LYS B 73 19.646 -8.398 14.758 1.00 0.36 C ATOM 2251 CG LYS B 73 19.096 -8.308 16.180 1.00 0.39 C ATOM 2252 CD LYS B 73 20.167 -7.740 17.112 1.00 0.47 C ATOM 2253 CE LYS B 73 19.897 -8.206 18.544 1.00 0.54 C ATOM 2254 NZ LYS B 73 20.541 -9.546 18.640 1.00 0.53 N ATOM 0 H LYS B 73 20.023 -9.523 12.436 1.00 0.31 H new ATOM 0 HA LYS B 73 21.131 -9.949 15.224 1.00 0.32 H new ATOM 0 HB2 LYS B 73 20.371 -7.602 14.588 1.00 0.36 H new ATOM 0 HB3 LYS B 73 18.841 -8.254 14.038 1.00 0.36 H new ATOM 0 HG2 LYS B 73 18.210 -7.673 16.198 1.00 0.39 H new ATOM 0 HG3 LYS B 73 18.787 -9.295 16.524 1.00 0.39 H new ATOM 0 HD2 LYS B 73 21.155 -8.070 16.791 1.00 0.47 H new ATOM 0 HD3 LYS B 73 20.164 -6.651 17.066 1.00 0.47 H new ATOM 0 HE2 LYS B 73 20.319 -7.512 19.271 1.00 0.54 H new ATOM 0 HE3 LYS B 73 18.827 -8.267 18.744 1.00 0.54 H new ATOM 0 HZ1 LYS B 73 20.119 -10.078 19.428 1.00 0.53 H new ATOM 0 HZ2 LYS B 73 20.393 -10.067 17.752 1.00 0.53 H new ATOM 0 HZ3 LYS B 73 21.561 -9.430 18.808 1.00 0.53 H new ATOM 2268 N LYS B 74 18.450 -11.118 13.800 1.00 0.28 N ATOM 2269 CA LYS B 74 17.380 -12.160 13.927 1.00 0.27 C ATOM 2270 C LYS B 74 16.291 -11.669 14.883 1.00 0.27 C ATOM 2271 O LYS B 74 15.116 -11.747 14.586 1.00 0.29 O ATOM 2272 CB LYS B 74 18.029 -13.446 14.471 1.00 0.29 C ATOM 2273 CG LYS B 74 19.366 -13.722 13.782 1.00 0.31 C ATOM 2274 CD LYS B 74 19.223 -13.581 12.265 1.00 0.33 C ATOM 2275 CE LYS B 74 18.254 -14.643 11.745 1.00 0.36 C ATOM 2276 NZ LYS B 74 18.718 -14.947 10.363 1.00 0.43 N ATOM 0 H LYS B 74 18.460 -10.633 12.903 1.00 0.28 H new ATOM 0 HA LYS B 74 16.921 -12.356 12.958 1.00 0.27 H new ATOM 0 HB2 LYS B 74 18.183 -13.353 15.546 1.00 0.29 H new ATOM 0 HB3 LYS B 74 17.356 -14.290 14.317 1.00 0.29 H new ATOM 0 HG2 LYS B 74 20.122 -13.027 14.149 1.00 0.31 H new ATOM 0 HG3 LYS B 74 19.710 -14.726 14.030 1.00 0.31 H new ATOM 0 HD2 LYS B 74 18.857 -12.585 12.014 1.00 0.33 H new ATOM 0 HD3 LYS B 74 20.195 -13.694 11.785 1.00 0.33 H new ATOM 0 HE2 LYS B 74 18.272 -15.534 12.372 1.00 0.36 H new ATOM 0 HE3 LYS B 74 17.228 -14.274 11.744 1.00 0.36 H new ATOM 0 HZ1 LYS B 74 18.614 -15.965 10.178 1.00 0.43 H new ATOM 0 HZ2 LYS B 74 18.147 -14.411 9.679 1.00 0.43 H new ATOM 0 HZ3 LYS B 74 19.718 -14.678 10.265 1.00 0.43 H new ATOM 2290 N SER B 75 16.674 -11.144 16.023 1.00 0.29 N ATOM 2291 CA SER B 75 15.662 -10.633 16.991 1.00 0.31 C ATOM 2292 C SER B 75 14.849 -9.532 16.321 1.00 0.29 C ATOM 2293 O SER B 75 13.650 -9.447 16.482 1.00 0.32 O ATOM 2294 CB SER B 75 16.470 -10.074 18.163 1.00 0.37 C ATOM 2295 OG SER B 75 16.928 -11.148 18.972 1.00 0.37 O ATOM 0 H SER B 75 17.645 -11.049 16.321 1.00 0.29 H new ATOM 0 HA SER B 75 14.966 -11.403 17.324 1.00 0.31 H new ATOM 0 HB2 SER B 75 17.317 -9.496 17.793 1.00 0.37 H new ATOM 0 HB3 SER B 75 15.854 -9.396 18.754 1.00 0.37 H new ATOM 0 HG SER B 75 17.448 -10.793 19.723 1.00 0.37 H new ATOM 2301 N LYS B 76 15.504 -8.701 15.554 1.00 0.28 N ATOM 2302 CA LYS B 76 14.790 -7.605 14.842 1.00 0.28 C ATOM 2303 C LYS B 76 14.022 -8.182 13.651 1.00 0.26 C ATOM 2304 O LYS B 76 12.872 -7.857 13.431 1.00 0.31 O ATOM 2305 CB LYS B 76 15.893 -6.662 14.363 1.00 0.32 C ATOM 2306 CG LYS B 76 16.016 -5.486 15.333 1.00 0.42 C ATOM 2307 CD LYS B 76 16.797 -4.353 14.664 1.00 0.43 C ATOM 2308 CE LYS B 76 15.827 -3.441 13.907 1.00 0.49 C ATOM 2309 NZ LYS B 76 15.388 -2.431 14.910 1.00 0.40 N ATOM 0 H LYS B 76 16.510 -8.736 15.390 1.00 0.28 H new ATOM 0 HA LYS B 76 14.067 -7.092 15.476 1.00 0.28 H new ATOM 0 HB2 LYS B 76 16.841 -7.196 14.301 1.00 0.32 H new ATOM 0 HB3 LYS B 76 15.665 -6.298 13.361 1.00 0.32 H new ATOM 0 HG2 LYS B 76 15.026 -5.136 15.625 1.00 0.42 H new ATOM 0 HG3 LYS B 76 16.523 -5.804 16.244 1.00 0.42 H new ATOM 0 HD2 LYS B 76 17.341 -3.780 15.414 1.00 0.43 H new ATOM 0 HD3 LYS B 76 17.538 -4.763 13.978 1.00 0.43 H new ATOM 0 HE2 LYS B 76 16.314 -2.966 13.056 1.00 0.49 H new ATOM 0 HE3 LYS B 76 14.979 -4.004 13.516 1.00 0.49 H new ATOM 0 HZ1 LYS B 76 14.720 -1.769 14.466 1.00 0.40 H new ATOM 0 HZ2 LYS B 76 14.922 -2.912 15.706 1.00 0.40 H new ATOM 0 HZ3 LYS B 76 16.215 -1.906 15.259 1.00 0.40 H new ATOM 2323 N ALA B 77 14.653 -9.043 12.888 1.00 0.27 N ATOM 2324 CA ALA B 77 13.962 -9.655 11.712 1.00 0.26 C ATOM 2325 C ALA B 77 12.754 -10.459 12.186 1.00 0.25 C ATOM 2326 O ALA B 77 11.645 -10.258 11.728 1.00 0.27 O ATOM 2327 CB ALA B 77 14.994 -10.584 11.070 1.00 0.29 C ATOM 0 H ALA B 77 15.616 -9.347 13.030 1.00 0.27 H new ATOM 0 HA ALA B 77 13.603 -8.903 11.009 1.00 0.26 H new ATOM 0 HB1 ALA B 77 14.555 -11.069 10.198 1.00 0.29 H new ATOM 0 HB2 ALA B 77 15.864 -10.004 10.763 1.00 0.29 H new ATOM 0 HB3 ALA B 77 15.299 -11.342 11.791 1.00 0.29 H new ATOM 2333 N ILE B 78 12.967 -11.368 13.104 1.00 0.25 N ATOM 2334 CA ILE B 78 11.840 -12.194 13.624 1.00 0.25 C ATOM 2335 C ILE B 78 10.749 -11.283 14.200 1.00 0.24 C ATOM 2336 O ILE B 78 9.575 -11.487 13.955 1.00 0.26 O ATOM 2337 CB ILE B 78 12.463 -13.082 14.705 1.00 0.26 C ATOM 2338 CG1 ILE B 78 13.485 -14.022 14.053 1.00 0.27 C ATOM 2339 CG2 ILE B 78 11.372 -13.912 15.386 1.00 0.31 C ATOM 2340 CD1 ILE B 78 14.577 -14.393 15.062 1.00 0.32 C ATOM 0 H ILE B 78 13.877 -11.573 13.516 1.00 0.25 H new ATOM 0 HA ILE B 78 11.363 -12.795 12.850 1.00 0.25 H new ATOM 0 HB ILE B 78 12.955 -12.457 15.450 1.00 0.26 H new ATOM 0 HG12 ILE B 78 12.986 -14.924 13.697 1.00 0.27 H new ATOM 0 HG13 ILE B 78 13.931 -13.540 13.183 1.00 0.27 H new ATOM 0 HG21 ILE B 78 11.820 -14.542 16.154 1.00 0.31 H new ATOM 0 HG22 ILE B 78 10.641 -13.246 15.844 1.00 0.31 H new ATOM 0 HG23 ILE B 78 10.877 -14.540 14.645 1.00 0.31 H new ATOM 0 HD11 ILE B 78 15.297 -15.061 14.589 1.00 0.32 H new ATOM 0 HD12 ILE B 78 15.085 -13.489 15.397 1.00 0.32 H new ATOM 0 HD13 ILE B 78 14.126 -14.894 15.919 1.00 0.32 H new ATOM 2352 N ASN B 79 11.126 -10.265 14.938 1.00 0.27 N ATOM 2353 CA ASN B 79 10.097 -9.332 15.491 1.00 0.29 C ATOM 2354 C ASN B 79 9.407 -8.627 14.326 1.00 0.27 C ATOM 2355 O ASN B 79 8.204 -8.444 14.318 1.00 0.30 O ATOM 2356 CB ASN B 79 10.861 -8.326 16.352 1.00 0.32 C ATOM 2357 CG ASN B 79 10.816 -8.770 17.817 1.00 0.36 C ATOM 2358 OD1 ASN B 79 9.752 -8.910 18.388 1.00 0.45 O ATOM 2359 ND2 ASN B 79 11.931 -8.999 18.453 1.00 0.41 N ATOM 0 H ASN B 79 12.092 -10.043 15.178 1.00 0.27 H new ATOM 0 HA ASN B 79 9.336 -9.844 16.080 1.00 0.29 H new ATOM 0 HB2 ASN B 79 11.895 -8.253 16.014 1.00 0.32 H new ATOM 0 HB3 ASN B 79 10.421 -7.334 16.248 1.00 0.32 H new ATOM 0 HD21 ASN B 79 11.910 -9.295 19.429 1.00 0.41 H new ATOM 0 HD22 ASN B 79 12.824 -8.882 17.975 1.00 0.41 H new ATOM 2366 N VAL B 80 10.170 -8.257 13.326 1.00 0.27 N ATOM 2367 CA VAL B 80 9.579 -7.589 12.129 1.00 0.27 C ATOM 2368 C VAL B 80 8.558 -8.541 11.502 1.00 0.26 C ATOM 2369 O VAL B 80 7.458 -8.153 11.157 1.00 0.30 O ATOM 2370 CB VAL B 80 10.776 -7.330 11.192 1.00 0.29 C ATOM 2371 CG1 VAL B 80 10.440 -7.717 9.747 1.00 0.33 C ATOM 2372 CG2 VAL B 80 11.141 -5.843 11.242 1.00 0.41 C ATOM 0 H VAL B 80 11.181 -8.390 13.289 1.00 0.27 H new ATOM 0 HA VAL B 80 9.058 -6.658 12.351 1.00 0.27 H new ATOM 0 HB VAL B 80 11.615 -7.940 11.527 1.00 0.29 H new ATOM 0 HG11 VAL B 80 11.302 -7.524 9.109 1.00 0.33 H new ATOM 0 HG12 VAL B 80 10.187 -8.776 9.704 1.00 0.33 H new ATOM 0 HG13 VAL B 80 9.592 -7.127 9.400 1.00 0.33 H new ATOM 0 HG21 VAL B 80 11.987 -5.654 10.581 1.00 0.41 H new ATOM 0 HG22 VAL B 80 10.287 -5.248 10.918 1.00 0.41 H new ATOM 0 HG23 VAL B 80 11.409 -5.568 12.262 1.00 0.41 H new ATOM 2382 N LEU B 81 8.924 -9.792 11.371 1.00 0.25 N ATOM 2383 CA LEU B 81 7.987 -10.795 10.786 1.00 0.27 C ATOM 2384 C LEU B 81 6.721 -10.858 11.639 1.00 0.28 C ATOM 2385 O LEU B 81 5.621 -10.963 11.129 1.00 0.32 O ATOM 2386 CB LEU B 81 8.747 -12.121 10.829 1.00 0.30 C ATOM 2387 CG LEU B 81 8.932 -12.643 9.405 1.00 0.46 C ATOM 2388 CD1 LEU B 81 10.219 -12.066 8.813 1.00 1.05 C ATOM 2389 CD2 LEU B 81 9.025 -14.167 9.437 1.00 0.64 C ATOM 0 H LEU B 81 9.834 -10.161 11.645 1.00 0.25 H new ATOM 0 HA LEU B 81 7.679 -10.550 9.770 1.00 0.27 H new ATOM 0 HB2 LEU B 81 9.717 -11.982 11.307 1.00 0.30 H new ATOM 0 HB3 LEU B 81 8.198 -12.849 11.427 1.00 0.30 H new ATOM 0 HG LEU B 81 8.084 -12.340 8.791 1.00 0.46 H new ATOM 0 HD11 LEU B 81 10.351 -12.438 7.797 1.00 1.05 H new ATOM 0 HD12 LEU B 81 10.156 -10.978 8.795 1.00 1.05 H new ATOM 0 HD13 LEU B 81 11.069 -12.370 9.424 1.00 1.05 H new ATOM 0 HD21 LEU B 81 9.157 -14.545 8.423 1.00 0.64 H new ATOM 0 HD22 LEU B 81 9.875 -14.467 10.050 1.00 0.64 H new ATOM 0 HD23 LEU B 81 8.109 -14.579 9.861 1.00 0.64 H new ATOM 2401 N ARG B 82 6.871 -10.768 12.936 1.00 0.28 N ATOM 2402 CA ARG B 82 5.678 -10.791 13.827 1.00 0.31 C ATOM 2403 C ARG B 82 4.857 -9.528 13.568 1.00 0.31 C ATOM 2404 O ARG B 82 3.640 -9.553 13.548 1.00 0.35 O ATOM 2405 CB ARG B 82 6.234 -10.797 15.252 1.00 0.35 C ATOM 2406 CG ARG B 82 5.255 -11.521 16.180 1.00 0.42 C ATOM 2407 CD ARG B 82 5.664 -12.992 16.310 1.00 0.52 C ATOM 2408 NE ARG B 82 5.918 -13.194 17.764 1.00 0.61 N ATOM 2409 CZ ARG B 82 7.006 -12.720 18.308 1.00 0.62 C ATOM 2410 NH1 ARG B 82 8.163 -12.927 17.741 1.00 0.77 N ATOM 2411 NH2 ARG B 82 6.936 -12.040 19.419 1.00 0.72 N ATOM 0 H ARG B 82 7.768 -10.680 13.414 1.00 0.28 H new ATOM 0 HA ARG B 82 5.032 -11.653 13.658 1.00 0.31 H new ATOM 0 HB2 ARG B 82 7.205 -11.292 15.273 1.00 0.35 H new ATOM 0 HB3 ARG B 82 6.390 -9.775 15.597 1.00 0.35 H new ATOM 0 HG2 ARG B 82 5.249 -11.046 17.161 1.00 0.42 H new ATOM 0 HG3 ARG B 82 4.242 -11.448 15.785 1.00 0.42 H new ATOM 0 HD2 ARG B 82 4.876 -13.654 15.951 1.00 0.52 H new ATOM 0 HD3 ARG B 82 6.555 -13.208 15.720 1.00 0.52 H new ATOM 0 HE ARG B 82 5.242 -13.702 18.334 1.00 0.61 H new ATOM 0 HH11 ARG B 82 8.217 -13.459 16.873 1.00 0.77 H new ATOM 0 HH12 ARG B 82 9.013 -12.557 18.166 1.00 0.77 H new ATOM 0 HH21 ARG B 82 6.032 -11.879 19.862 1.00 0.72 H new ATOM 0 HH22 ARG B 82 7.786 -11.669 19.845 1.00 0.72 H new ATOM 2425 N GLY B 83 5.532 -8.425 13.345 1.00 0.30 N ATOM 2426 CA GLY B 83 4.819 -7.149 13.057 1.00 0.33 C ATOM 2427 C GLY B 83 4.062 -7.306 11.741 1.00 0.31 C ATOM 2428 O GLY B 83 2.933 -6.872 11.609 1.00 0.34 O ATOM 0 H GLY B 83 6.550 -8.358 13.351 1.00 0.30 H new ATOM 0 HA2 GLY B 83 4.128 -6.910 13.866 1.00 0.33 H new ATOM 0 HA3 GLY B 83 5.529 -6.325 12.990 1.00 0.33 H new ATOM 2432 N PHE B 84 4.673 -7.947 10.772 1.00 0.32 N ATOM 2433 CA PHE B 84 3.986 -8.161 9.464 1.00 0.33 C ATOM 2434 C PHE B 84 2.707 -8.962 9.704 1.00 0.32 C ATOM 2435 O PHE B 84 1.682 -8.714 9.098 1.00 0.37 O ATOM 2436 CB PHE B 84 4.972 -8.963 8.610 1.00 0.37 C ATOM 2437 CG PHE B 84 5.934 -8.032 7.924 1.00 0.39 C ATOM 2438 CD1 PHE B 84 5.455 -6.949 7.180 1.00 0.64 C ATOM 2439 CD2 PHE B 84 7.310 -8.261 8.025 1.00 0.41 C ATOM 2440 CE1 PHE B 84 6.356 -6.094 6.540 1.00 0.76 C ATOM 2441 CE2 PHE B 84 8.207 -7.408 7.384 1.00 0.53 C ATOM 2442 CZ PHE B 84 7.731 -6.326 6.643 1.00 0.65 C ATOM 0 H PHE B 84 5.617 -8.330 10.833 1.00 0.32 H new ATOM 0 HA PHE B 84 3.710 -7.228 8.973 1.00 0.33 H new ATOM 0 HB2 PHE B 84 5.519 -9.668 9.236 1.00 0.37 H new ATOM 0 HB3 PHE B 84 4.430 -9.550 7.869 1.00 0.37 H new ATOM 0 HD1 PHE B 84 4.392 -6.774 7.100 1.00 0.64 H new ATOM 0 HD2 PHE B 84 7.677 -9.098 8.599 1.00 0.41 H new ATOM 0 HE1 PHE B 84 5.991 -5.255 5.966 1.00 0.76 H new ATOM 0 HE2 PHE B 84 9.270 -7.585 7.461 1.00 0.53 H new ATOM 0 HZ PHE B 84 8.427 -5.665 6.147 1.00 0.65 H new ATOM 2452 N ARG B 85 2.762 -9.910 10.609 1.00 0.33 N ATOM 2453 CA ARG B 85 1.551 -10.723 10.925 1.00 0.35 C ATOM 2454 C ARG B 85 0.470 -9.803 11.493 1.00 0.33 C ATOM 2455 O ARG B 85 -0.699 -9.934 11.183 1.00 0.39 O ATOM 2456 CB ARG B 85 2.009 -11.737 11.975 1.00 0.40 C ATOM 2457 CG ARG B 85 1.321 -13.081 11.724 1.00 0.45 C ATOM 2458 CD ARG B 85 0.125 -13.229 12.668 1.00 0.53 C ATOM 2459 NE ARG B 85 -1.048 -12.769 11.875 1.00 0.55 N ATOM 2460 CZ ARG B 85 -2.206 -13.353 12.024 1.00 0.58 C ATOM 2461 NH1 ARG B 85 -2.650 -13.625 13.220 1.00 0.72 N ATOM 2462 NH2 ARG B 85 -2.918 -13.667 10.976 1.00 0.85 N ATOM 0 H ARG B 85 3.597 -10.154 11.142 1.00 0.33 H new ATOM 0 HA ARG B 85 1.134 -11.223 10.051 1.00 0.35 H new ATOM 0 HB2 ARG B 85 3.091 -11.857 11.931 1.00 0.40 H new ATOM 0 HB3 ARG B 85 1.768 -11.375 12.975 1.00 0.40 H new ATOM 0 HG2 ARG B 85 0.989 -13.143 10.688 1.00 0.45 H new ATOM 0 HG3 ARG B 85 2.026 -13.897 11.883 1.00 0.45 H new ATOM 0 HD2 ARG B 85 0.002 -14.263 12.991 1.00 0.53 H new ATOM 0 HD3 ARG B 85 0.255 -12.627 13.567 1.00 0.53 H new ATOM 0 HE ARG B 85 -0.947 -11.998 11.215 1.00 0.55 H new ATOM 0 HH11 ARG B 85 -2.092 -13.381 14.039 1.00 0.72 H new ATOM 0 HH12 ARG B 85 -3.555 -14.081 13.337 1.00 0.72 H new ATOM 0 HH21 ARG B 85 -2.570 -13.456 10.041 1.00 0.85 H new ATOM 0 HH22 ARG B 85 -3.823 -14.123 11.092 1.00 0.85 H new ATOM 2476 N LYS B 86 0.864 -8.857 12.309 1.00 0.31 N ATOM 2477 CA LYS B 86 -0.127 -7.903 12.884 1.00 0.32 C ATOM 2478 C LYS B 86 -0.569 -6.929 11.792 1.00 0.30 C ATOM 2479 O LYS B 86 -1.714 -6.518 11.733 1.00 0.34 O ATOM 2480 CB LYS B 86 0.618 -7.165 14.000 1.00 0.36 C ATOM 2481 CG LYS B 86 0.095 -7.629 15.361 1.00 0.52 C ATOM 2482 CD LYS B 86 0.830 -8.903 15.784 1.00 0.70 C ATOM 2483 CE LYS B 86 0.012 -10.128 15.369 1.00 0.75 C ATOM 2484 NZ LYS B 86 -1.102 -10.200 16.355 1.00 0.88 N ATOM 0 H LYS B 86 1.830 -8.706 12.600 1.00 0.31 H new ATOM 0 HA LYS B 86 -1.019 -8.399 13.268 1.00 0.32 H new ATOM 0 HB2 LYS B 86 1.688 -7.358 13.926 1.00 0.36 H new ATOM 0 HB3 LYS B 86 0.480 -6.089 13.894 1.00 0.36 H new ATOM 0 HG2 LYS B 86 0.244 -6.847 16.105 1.00 0.52 H new ATOM 0 HG3 LYS B 86 -0.977 -7.817 15.306 1.00 0.52 H new ATOM 0 HD2 LYS B 86 1.816 -8.937 15.321 1.00 0.70 H new ATOM 0 HD3 LYS B 86 0.985 -8.905 16.863 1.00 0.70 H new ATOM 0 HE2 LYS B 86 -0.367 -10.024 14.352 1.00 0.75 H new ATOM 0 HE3 LYS B 86 0.618 -11.034 15.392 1.00 0.75 H new ATOM 0 HZ1 LYS B 86 -1.205 -11.179 16.691 1.00 0.88 H new ATOM 0 HZ2 LYS B 86 -0.893 -9.577 17.161 1.00 0.88 H new ATOM 0 HZ3 LYS B 86 -1.987 -9.894 15.902 1.00 0.88 H new ATOM 2498 N GLU B 87 0.337 -6.573 10.915 1.00 0.29 N ATOM 2499 CA GLU B 87 -0.010 -5.639 9.805 1.00 0.30 C ATOM 2500 C GLU B 87 -0.956 -6.340 8.828 1.00 0.30 C ATOM 2501 O GLU B 87 -1.901 -5.753 8.336 1.00 0.34 O ATOM 2502 CB GLU B 87 1.321 -5.310 9.127 1.00 0.34 C ATOM 2503 CG GLU B 87 2.218 -4.548 10.104 1.00 0.38 C ATOM 2504 CD GLU B 87 2.039 -3.043 9.896 1.00 0.37 C ATOM 2505 OE1 GLU B 87 0.923 -2.574 10.047 1.00 0.42 O ATOM 2506 OE2 GLU B 87 3.020 -2.386 9.591 1.00 0.52 O ATOM 0 H GLU B 87 1.306 -6.892 10.922 1.00 0.29 H new ATOM 0 HA GLU B 87 -0.513 -4.737 10.155 1.00 0.30 H new ATOM 0 HB2 GLU B 87 1.813 -6.227 8.805 1.00 0.34 H new ATOM 0 HB3 GLU B 87 1.147 -4.711 8.233 1.00 0.34 H new ATOM 0 HG2 GLU B 87 1.966 -4.816 11.130 1.00 0.38 H new ATOM 0 HG3 GLU B 87 3.261 -4.826 9.949 1.00 0.38 H new ATOM 2513 N ILE B 88 -0.713 -7.599 8.556 1.00 0.30 N ATOM 2514 CA ILE B 88 -1.605 -8.346 7.624 1.00 0.33 C ATOM 2515 C ILE B 88 -2.967 -8.553 8.296 1.00 0.32 C ATOM 2516 O ILE B 88 -4.004 -8.493 7.658 1.00 0.36 O ATOM 2517 CB ILE B 88 -0.866 -9.671 7.331 1.00 0.38 C ATOM 2518 CG1 ILE B 88 -1.113 -10.073 5.873 1.00 0.46 C ATOM 2519 CG2 ILE B 88 -1.332 -10.811 8.253 1.00 0.40 C ATOM 2520 CD1 ILE B 88 0.151 -9.814 5.049 1.00 0.76 C ATOM 0 H ILE B 88 0.063 -8.138 8.940 1.00 0.30 H new ATOM 0 HA ILE B 88 -1.806 -7.821 6.690 1.00 0.33 H new ATOM 0 HB ILE B 88 0.196 -9.507 7.514 1.00 0.38 H new ATOM 0 HG12 ILE B 88 -1.387 -11.127 5.817 1.00 0.46 H new ATOM 0 HG13 ILE B 88 -1.949 -9.504 5.465 1.00 0.46 H new ATOM 0 HG21 ILE B 88 -0.785 -11.722 8.010 1.00 0.40 H new ATOM 0 HG22 ILE B 88 -1.142 -10.540 9.291 1.00 0.40 H new ATOM 0 HG23 ILE B 88 -2.399 -10.980 8.112 1.00 0.40 H new ATOM 0 HD11 ILE B 88 -0.026 -10.100 4.012 1.00 0.76 H new ATOM 0 HD12 ILE B 88 0.405 -8.755 5.095 1.00 0.76 H new ATOM 0 HD13 ILE B 88 0.975 -10.402 5.452 1.00 0.76 H new ATOM 2532 N GLY B 89 -2.966 -8.769 9.591 1.00 0.32 N ATOM 2533 CA GLY B 89 -4.252 -8.953 10.324 1.00 0.37 C ATOM 2534 C GLY B 89 -5.058 -7.664 10.194 1.00 0.35 C ATOM 2535 O GLY B 89 -6.268 -7.680 10.063 1.00 0.40 O ATOM 0 H GLY B 89 -2.127 -8.825 10.169 1.00 0.32 H new ATOM 0 HA2 GLY B 89 -4.809 -9.794 9.911 1.00 0.37 H new ATOM 0 HA3 GLY B 89 -4.063 -9.180 11.373 1.00 0.37 H new ATOM 2539 N ARG B 90 -4.381 -6.545 10.208 1.00 0.34 N ATOM 2540 CA ARG B 90 -5.085 -5.242 10.060 1.00 0.37 C ATOM 2541 C ARG B 90 -5.636 -5.130 8.640 1.00 0.32 C ATOM 2542 O ARG B 90 -6.724 -4.624 8.426 1.00 0.35 O ATOM 2543 CB ARG B 90 -4.017 -4.174 10.295 1.00 0.40 C ATOM 2544 CG ARG B 90 -3.799 -3.976 11.795 1.00 0.45 C ATOM 2545 CD ARG B 90 -2.771 -2.863 12.008 1.00 0.51 C ATOM 2546 NE ARG B 90 -1.982 -3.289 13.197 1.00 0.64 N ATOM 2547 CZ ARG B 90 -0.794 -2.790 13.404 1.00 0.63 C ATOM 2548 NH1 ARG B 90 0.217 -3.191 12.681 1.00 0.76 N ATOM 2549 NH2 ARG B 90 -0.616 -1.888 14.330 1.00 0.75 N ATOM 0 H ARG B 90 -3.369 -6.480 10.316 1.00 0.34 H new ATOM 0 HA ARG B 90 -5.918 -5.136 10.755 1.00 0.37 H new ATOM 0 HB2 ARG B 90 -3.082 -4.471 9.819 1.00 0.40 H new ATOM 0 HB3 ARG B 90 -4.323 -3.234 9.836 1.00 0.40 H new ATOM 0 HG2 ARG B 90 -4.740 -3.717 12.281 1.00 0.45 H new ATOM 0 HG3 ARG B 90 -3.450 -4.903 12.250 1.00 0.45 H new ATOM 0 HD2 ARG B 90 -2.132 -2.743 11.133 1.00 0.51 H new ATOM 0 HD3 ARG B 90 -3.258 -1.903 12.181 1.00 0.51 H new ATOM 0 HE ARG B 90 -2.370 -3.970 13.849 1.00 0.64 H new ATOM 0 HH11 ARG B 90 0.078 -3.894 11.955 1.00 0.76 H new ATOM 0 HH12 ARG B 90 1.146 -2.801 12.842 1.00 0.76 H new ATOM 0 HH21 ARG B 90 -1.406 -1.572 14.893 1.00 0.75 H new ATOM 0 HH22 ARG B 90 0.313 -1.499 14.491 1.00 0.75 H new ATOM 2563 N MET B 91 -4.896 -5.626 7.671 1.00 0.30 N ATOM 2564 CA MET B 91 -5.368 -5.573 6.256 1.00 0.29 C ATOM 2565 C MET B 91 -6.710 -6.281 6.177 1.00 0.27 C ATOM 2566 O MET B 91 -7.624 -5.843 5.504 1.00 0.29 O ATOM 2567 CB MET B 91 -4.302 -6.314 5.440 1.00 0.31 C ATOM 2568 CG MET B 91 -3.927 -5.479 4.212 1.00 0.51 C ATOM 2569 SD MET B 91 -2.732 -6.391 3.202 1.00 0.69 S ATOM 2570 CE MET B 91 -1.294 -6.153 4.276 1.00 0.80 C ATOM 0 H MET B 91 -3.985 -6.065 7.805 1.00 0.30 H new ATOM 0 HA MET B 91 -5.500 -4.558 5.881 1.00 0.29 H new ATOM 0 HB2 MET B 91 -3.419 -6.494 6.054 1.00 0.31 H new ATOM 0 HB3 MET B 91 -4.679 -7.288 5.129 1.00 0.31 H new ATOM 0 HG2 MET B 91 -4.818 -5.255 3.626 1.00 0.51 H new ATOM 0 HG3 MET B 91 -3.502 -4.525 4.524 1.00 0.51 H new ATOM 0 HE1 MET B 91 -0.470 -5.739 3.695 1.00 0.80 H new ATOM 0 HE2 MET B 91 -1.551 -5.465 5.081 1.00 0.80 H new ATOM 0 HE3 MET B 91 -0.994 -7.111 4.700 1.00 0.80 H new ATOM 2580 N LEU B 92 -6.837 -7.358 6.903 1.00 0.28 N ATOM 2581 CA LEU B 92 -8.124 -8.097 6.926 1.00 0.29 C ATOM 2582 C LEU B 92 -9.173 -7.211 7.562 1.00 0.31 C ATOM 2583 O LEU B 92 -10.280 -7.103 7.074 1.00 0.34 O ATOM 2584 CB LEU B 92 -7.846 -9.335 7.755 1.00 0.33 C ATOM 2585 CG LEU B 92 -6.822 -10.161 6.996 1.00 0.34 C ATOM 2586 CD1 LEU B 92 -5.961 -10.959 7.980 1.00 0.41 C ATOM 2587 CD2 LEU B 92 -7.543 -11.114 6.037 1.00 0.42 C ATOM 0 H LEU B 92 -6.099 -7.757 7.483 1.00 0.28 H new ATOM 0 HA LEU B 92 -8.495 -8.373 5.939 1.00 0.29 H new ATOM 0 HB2 LEU B 92 -7.467 -9.062 8.740 1.00 0.33 H new ATOM 0 HB3 LEU B 92 -8.761 -9.906 7.913 1.00 0.33 H new ATOM 0 HG LEU B 92 -6.175 -9.496 6.423 1.00 0.34 H new ATOM 0 HD11 LEU B 92 -5.229 -11.549 7.428 1.00 0.41 H new ATOM 0 HD12 LEU B 92 -5.443 -10.273 8.650 1.00 0.41 H new ATOM 0 HD13 LEU B 92 -6.597 -11.624 8.564 1.00 0.41 H new ATOM 0 HD21 LEU B 92 -6.808 -11.707 5.492 1.00 0.42 H new ATOM 0 HD22 LEU B 92 -8.195 -11.777 6.605 1.00 0.42 H new ATOM 0 HD23 LEU B 92 -8.139 -10.537 5.330 1.00 0.42 H new ATOM 2599 N ASN B 93 -8.811 -6.529 8.621 1.00 0.33 N ATOM 2600 CA ASN B 93 -9.773 -5.592 9.262 1.00 0.38 C ATOM 2601 C ASN B 93 -10.270 -4.619 8.187 1.00 0.37 C ATOM 2602 O ASN B 93 -11.355 -4.078 8.274 1.00 0.43 O ATOM 2603 CB ASN B 93 -8.972 -4.857 10.342 1.00 0.43 C ATOM 2604 CG ASN B 93 -9.711 -4.946 11.678 1.00 0.71 C ATOM 2605 OD1 ASN B 93 -10.753 -4.344 11.851 1.00 0.97 O ATOM 2606 ND2 ASN B 93 -9.214 -5.677 12.638 1.00 1.06 N ATOM 0 H ASN B 93 -7.894 -6.583 9.065 1.00 0.33 H new ATOM 0 HA ASN B 93 -10.639 -6.089 9.700 1.00 0.38 H new ATOM 0 HB2 ASN B 93 -7.979 -5.296 10.434 1.00 0.43 H new ATOM 0 HB3 ASN B 93 -8.834 -3.813 10.060 1.00 0.43 H new ATOM 0 HD21 ASN B 93 -9.700 -5.743 13.533 1.00 1.06 H new ATOM 0 HD22 ASN B 93 -8.340 -6.182 12.494 1.00 1.06 H new ATOM 2613 N ILE B 94 -9.475 -4.418 7.156 1.00 0.33 N ATOM 2614 CA ILE B 94 -9.894 -3.506 6.052 1.00 0.34 C ATOM 2615 C ILE B 94 -10.698 -4.274 4.994 1.00 0.32 C ATOM 2616 O ILE B 94 -11.619 -3.732 4.411 1.00 0.38 O ATOM 2617 CB ILE B 94 -8.609 -2.953 5.418 1.00 0.35 C ATOM 2618 CG1 ILE B 94 -7.538 -2.720 6.495 1.00 0.38 C ATOM 2619 CG2 ILE B 94 -8.936 -1.635 4.712 1.00 0.39 C ATOM 2620 CD1 ILE B 94 -6.552 -1.635 6.046 1.00 0.53 C ATOM 0 H ILE B 94 -8.558 -4.848 7.038 1.00 0.33 H new ATOM 0 HA ILE B 94 -10.526 -2.706 6.438 1.00 0.34 H new ATOM 0 HB ILE B 94 -8.219 -3.673 4.698 1.00 0.35 H new ATOM 0 HG12 ILE B 94 -8.013 -2.424 7.430 1.00 0.38 H new ATOM 0 HG13 ILE B 94 -7.002 -3.649 6.690 1.00 0.38 H new ATOM 0 HG21 ILE B 94 -8.031 -1.232 4.257 1.00 0.39 H new ATOM 0 HG22 ILE B 94 -9.683 -1.812 3.938 1.00 0.39 H new ATOM 0 HG23 ILE B 94 -9.327 -0.921 5.437 1.00 0.39 H new ATOM 0 HD11 ILE B 94 -5.801 -1.483 6.821 1.00 0.53 H new ATOM 0 HD12 ILE B 94 -6.063 -1.947 5.123 1.00 0.53 H new ATOM 0 HD13 ILE B 94 -7.090 -0.703 5.875 1.00 0.53 H new ATOM 2632 N LEU B 95 -10.358 -5.520 4.714 1.00 0.28 N ATOM 2633 CA LEU B 95 -11.129 -6.263 3.661 1.00 0.27 C ATOM 2634 C LEU B 95 -12.216 -7.158 4.273 1.00 0.29 C ATOM 2635 O LEU B 95 -12.810 -7.969 3.587 1.00 0.34 O ATOM 2636 CB LEU B 95 -10.100 -7.096 2.891 1.00 0.28 C ATOM 2637 CG LEU B 95 -9.380 -8.049 3.838 1.00 0.29 C ATOM 2638 CD1 LEU B 95 -9.861 -9.479 3.591 1.00 0.43 C ATOM 2639 CD2 LEU B 95 -7.872 -7.965 3.580 1.00 0.32 C ATOM 0 H LEU B 95 -9.600 -6.039 5.158 1.00 0.28 H new ATOM 0 HA LEU B 95 -11.653 -5.568 3.005 1.00 0.27 H new ATOM 0 HB2 LEU B 95 -10.596 -7.661 2.102 1.00 0.28 H new ATOM 0 HB3 LEU B 95 -9.378 -6.439 2.407 1.00 0.28 H new ATOM 0 HG LEU B 95 -9.594 -7.772 4.870 1.00 0.29 H new ATOM 0 HD11 LEU B 95 -9.345 -10.159 4.269 1.00 0.43 H new ATOM 0 HD12 LEU B 95 -10.935 -9.537 3.767 1.00 0.43 H new ATOM 0 HD13 LEU B 95 -9.646 -9.762 2.561 1.00 0.43 H new ATOM 0 HD21 LEU B 95 -7.349 -8.644 4.254 1.00 0.32 H new ATOM 0 HD22 LEU B 95 -7.663 -8.246 2.548 1.00 0.32 H new ATOM 0 HD23 LEU B 95 -7.529 -6.945 3.755 1.00 0.32 H new ATOM 2651 N ASN B 96 -12.501 -7.003 5.543 1.00 0.30 N ATOM 2652 CA ASN B 96 -13.575 -7.830 6.181 1.00 0.34 C ATOM 2653 C ASN B 96 -14.671 -6.913 6.733 1.00 0.38 C ATOM 2654 O ASN B 96 -15.832 -7.274 6.773 1.00 0.44 O ATOM 2655 CB ASN B 96 -12.897 -8.597 7.318 1.00 0.37 C ATOM 2656 CG ASN B 96 -12.274 -9.883 6.769 1.00 0.40 C ATOM 2657 OD1 ASN B 96 -10.976 -9.985 6.690 1.00 0.57 O flip ATOM 2658 ND2 ASN B 96 -12.977 -10.807 6.412 1.00 0.39 N flip ATOM 0 H ASN B 96 -12.038 -6.341 6.165 1.00 0.30 H new ATOM 0 HA ASN B 96 -14.042 -8.511 5.470 1.00 0.34 H new ATOM 0 HB2 ASN B 96 -12.129 -7.977 7.781 1.00 0.37 H new ATOM 0 HB3 ASN B 96 -13.624 -8.836 8.094 1.00 0.37 H new ATOM 0 HD21 ASN B 96 -13.992 -10.729 6.473 1.00 0.39 H new ATOM 0 HD22 ASN B 96 -12.552 -11.661 6.051 1.00 0.39 H new