USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=24 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+ 142:sc= 1.14 (180deg=-0.516) USER MOD Single : A 48 MET CE :methyl -163:sc= -2.95! (180deg=-4.32!) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.0606 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ -156:sc= -0.124 (180deg=-0.462) USER MOD Single : A 71 THR OG1 : rot -42:sc= 0.896 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ -175:sc= 0.363 (180deg=0.356) USER MOD Single : A 75 SER OG : rot 180:sc= -1.65 USER MOD Single : A 76 LYS NZ :NH3+ -139:sc= -0.0246 (180deg=-0.329) USER MOD Single : A 79 ASN : amide:sc= 1.9 K(o=1.9,f=-4.1!) USER MOD Single : A 86 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0082) USER MOD Single : A 91 MET CE :methyl -110:sc= -0.332 (180deg=-3.21!) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 ASN :FLIP amide:sc= -1.37 F(o=-2.5,f=-1.4) USER MOD Single : B 45 LYS NZ :NH3+ 144:sc= 1.08 (180deg=-0.57) USER MOD Single : B 48 MET CE :methyl -161:sc= -3.25! (180deg=-4.43!) USER MOD Single : B 58 THR OG1 : rot 180:sc= -0.0674 USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 67 LYS NZ :NH3+ -159:sc= -0.0722 (180deg=-0.399) USER MOD Single : B 71 THR OG1 : rot -47:sc= 0.856 USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 LYS NZ :NH3+ -166:sc= 0.333 (180deg=0.284) USER MOD Single : B 75 SER OG : rot 180:sc= -1.59 USER MOD Single : B 76 LYS NZ :NH3+ -141:sc= -0.0327 (180deg=-0.262) USER MOD Single : B 79 ASN : amide:sc= 1.94 K(o=1.9,f=-3.9!) USER MOD Single : B 86 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0112) USER MOD Single : B 91 MET CE :methyl -108:sc= -0.0807 (180deg=-2.68!) USER MOD Single : B 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 96 ASN :FLIP amide:sc= -1.37 F(o=-2.5,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 357 N PRO A 43 -1.996 -18.410 -7.223 1.00 0.37 N ATOM 358 CA PRO A 43 -1.584 -17.703 -5.997 1.00 0.37 C ATOM 359 C PRO A 43 -2.449 -16.456 -5.780 1.00 0.31 C ATOM 360 O PRO A 43 -2.982 -16.237 -4.708 1.00 0.34 O ATOM 361 CB PRO A 43 -0.144 -17.306 -6.297 1.00 0.43 C ATOM 362 CG PRO A 43 -0.045 -17.231 -7.793 1.00 0.45 C ATOM 363 CD PRO A 43 -1.229 -17.957 -8.387 1.00 0.42 C ATOM 0 HA PRO A 43 -1.687 -18.307 -5.095 1.00 0.37 H new ATOM 0 HB2 PRO A 43 0.101 -16.347 -5.840 1.00 0.43 H new ATOM 0 HB3 PRO A 43 0.556 -18.039 -5.895 1.00 0.43 H new ATOM 0 HG2 PRO A 43 -0.034 -16.191 -8.121 1.00 0.45 H new ATOM 0 HG3 PRO A 43 0.887 -17.682 -8.134 1.00 0.45 H new ATOM 0 HD2 PRO A 43 -1.822 -17.299 -9.022 1.00 0.42 H new ATOM 0 HD3 PRO A 43 -0.912 -18.796 -9.006 1.00 0.42 H new ATOM 371 N LEU A 44 -2.577 -15.635 -6.794 1.00 0.29 N ATOM 372 CA LEU A 44 -3.389 -14.385 -6.676 1.00 0.26 C ATOM 373 C LEU A 44 -2.875 -13.518 -5.524 1.00 0.24 C ATOM 374 O LEU A 44 -3.578 -12.662 -5.021 1.00 0.32 O ATOM 375 CB LEU A 44 -4.823 -14.838 -6.406 1.00 0.29 C ATOM 376 CG LEU A 44 -5.776 -13.675 -6.708 1.00 0.41 C ATOM 377 CD1 LEU A 44 -6.754 -14.084 -7.811 1.00 0.59 C ATOM 378 CD2 LEU A 44 -6.558 -13.300 -5.443 1.00 0.59 C ATOM 0 H LEU A 44 -2.148 -15.780 -7.708 1.00 0.29 H new ATOM 0 HA LEU A 44 -3.325 -13.782 -7.582 1.00 0.26 H new ATOM 0 HB2 LEU A 44 -5.070 -15.699 -7.027 1.00 0.29 H new ATOM 0 HB3 LEU A 44 -4.930 -15.153 -5.368 1.00 0.29 H new ATOM 0 HG LEU A 44 -5.195 -12.815 -7.039 1.00 0.41 H new ATOM 0 HD11 LEU A 44 -7.430 -13.256 -8.023 1.00 0.59 H new ATOM 0 HD12 LEU A 44 -6.199 -14.340 -8.713 1.00 0.59 H new ATOM 0 HD13 LEU A 44 -7.331 -14.948 -7.483 1.00 0.59 H new ATOM 0 HD21 LEU A 44 -7.233 -12.473 -5.664 1.00 0.59 H new ATOM 0 HD22 LEU A 44 -7.136 -14.160 -5.104 1.00 0.59 H new ATOM 0 HD23 LEU A 44 -5.861 -13.000 -4.660 1.00 0.59 H new ATOM 390 N LYS A 45 -1.650 -13.726 -5.116 1.00 0.23 N ATOM 391 CA LYS A 45 -1.078 -12.907 -4.008 1.00 0.23 C ATOM 392 C LYS A 45 -0.294 -11.729 -4.591 1.00 0.23 C ATOM 393 O LYS A 45 -0.093 -10.730 -3.937 1.00 0.28 O ATOM 394 CB LYS A 45 -0.154 -13.850 -3.230 1.00 0.29 C ATOM 395 CG LYS A 45 0.922 -14.421 -4.158 1.00 0.36 C ATOM 396 CD LYS A 45 2.227 -14.596 -3.378 1.00 0.40 C ATOM 397 CE LYS A 45 2.170 -15.897 -2.572 1.00 0.45 C ATOM 398 NZ LYS A 45 3.462 -16.583 -2.853 1.00 0.34 N ATOM 0 H LYS A 45 -1.021 -14.429 -5.503 1.00 0.23 H new ATOM 0 HA LYS A 45 -1.849 -12.491 -3.359 1.00 0.23 H new ATOM 0 HB2 LYS A 45 0.314 -13.313 -2.405 1.00 0.29 H new ATOM 0 HB3 LYS A 45 -0.735 -14.662 -2.793 1.00 0.29 H new ATOM 0 HG2 LYS A 45 0.597 -15.379 -4.563 1.00 0.36 H new ATOM 0 HG3 LYS A 45 1.079 -13.753 -5.005 1.00 0.36 H new ATOM 0 HD2 LYS A 45 3.073 -14.618 -4.065 1.00 0.40 H new ATOM 0 HD3 LYS A 45 2.380 -13.748 -2.710 1.00 0.40 H new ATOM 0 HE2 LYS A 45 2.053 -15.696 -1.507 1.00 0.45 H new ATOM 0 HE3 LYS A 45 1.323 -16.512 -2.875 1.00 0.45 H new ATOM 0 HZ1 LYS A 45 3.805 -17.046 -1.987 1.00 0.34 H new ATOM 0 HZ2 LYS A 45 3.321 -17.298 -3.595 1.00 0.34 H new ATOM 0 HZ3 LYS A 45 4.163 -15.885 -3.173 1.00 0.34 H new ATOM 412 N LEU A 46 0.142 -11.851 -5.823 1.00 0.22 N ATOM 413 CA LEU A 46 0.912 -10.750 -6.487 1.00 0.24 C ATOM 414 C LEU A 46 0.252 -9.386 -6.229 1.00 0.26 C ATOM 415 O LEU A 46 0.923 -8.376 -6.106 1.00 0.28 O ATOM 416 CB LEU A 46 0.860 -11.094 -7.982 1.00 0.27 C ATOM 417 CG LEU A 46 2.282 -11.241 -8.533 1.00 0.33 C ATOM 418 CD1 LEU A 46 2.599 -12.724 -8.742 1.00 0.44 C ATOM 419 CD2 LEU A 46 2.389 -10.507 -9.872 1.00 0.38 C ATOM 0 H LEU A 46 -0.005 -12.677 -6.404 1.00 0.22 H new ATOM 0 HA LEU A 46 1.931 -10.676 -6.108 1.00 0.24 H new ATOM 0 HB2 LEU A 46 0.305 -12.020 -8.132 1.00 0.27 H new ATOM 0 HB3 LEU A 46 0.329 -10.313 -8.526 1.00 0.27 H new ATOM 0 HG LEU A 46 2.991 -10.813 -7.824 1.00 0.33 H new ATOM 0 HD11 LEU A 46 3.611 -12.828 -9.134 1.00 0.44 H new ATOM 0 HD12 LEU A 46 2.523 -13.250 -7.790 1.00 0.44 H new ATOM 0 HD13 LEU A 46 1.890 -13.151 -9.451 1.00 0.44 H new ATOM 0 HD21 LEU A 46 3.401 -10.611 -10.264 1.00 0.38 H new ATOM 0 HD22 LEU A 46 1.679 -10.936 -10.580 1.00 0.38 H new ATOM 0 HD23 LEU A 46 2.163 -9.451 -9.727 1.00 0.38 H new ATOM 431 N PHE A 47 -1.056 -9.357 -6.126 1.00 0.26 N ATOM 432 CA PHE A 47 -1.764 -8.069 -5.864 1.00 0.29 C ATOM 433 C PHE A 47 -1.648 -7.733 -4.381 1.00 0.27 C ATOM 434 O PHE A 47 -1.404 -6.602 -4.003 1.00 0.30 O ATOM 435 CB PHE A 47 -3.225 -8.332 -6.260 1.00 0.37 C ATOM 436 CG PHE A 47 -4.133 -7.290 -5.638 1.00 0.34 C ATOM 437 CD1 PHE A 47 -3.815 -5.930 -5.739 1.00 0.40 C ATOM 438 CD2 PHE A 47 -5.291 -7.689 -4.958 1.00 0.49 C ATOM 439 CE1 PHE A 47 -4.653 -4.971 -5.161 1.00 0.53 C ATOM 440 CE2 PHE A 47 -6.128 -6.728 -4.379 1.00 0.57 C ATOM 441 CZ PHE A 47 -5.810 -5.369 -4.481 1.00 0.57 C ATOM 0 H PHE A 47 -1.662 -10.173 -6.213 1.00 0.26 H new ATOM 0 HA PHE A 47 -1.350 -7.228 -6.421 1.00 0.29 H new ATOM 0 HB2 PHE A 47 -3.325 -8.310 -7.345 1.00 0.37 H new ATOM 0 HB3 PHE A 47 -3.524 -9.328 -5.932 1.00 0.37 H new ATOM 0 HD1 PHE A 47 -2.923 -5.622 -6.263 1.00 0.40 H new ATOM 0 HD2 PHE A 47 -5.538 -8.738 -4.881 1.00 0.49 H new ATOM 0 HE1 PHE A 47 -4.407 -3.922 -5.239 1.00 0.53 H new ATOM 0 HE2 PHE A 47 -7.020 -7.036 -3.853 1.00 0.57 H new ATOM 0 HZ PHE A 47 -6.457 -4.628 -4.035 1.00 0.57 H new ATOM 451 N MET A 48 -1.814 -8.720 -3.546 1.00 0.28 N ATOM 452 CA MET A 48 -1.710 -8.492 -2.081 1.00 0.30 C ATOM 453 C MET A 48 -0.271 -8.132 -1.717 1.00 0.28 C ATOM 454 O MET A 48 -0.023 -7.155 -1.044 1.00 0.36 O ATOM 455 CB MET A 48 -2.109 -9.826 -1.445 1.00 0.37 C ATOM 456 CG MET A 48 -3.124 -9.575 -0.331 1.00 0.51 C ATOM 457 SD MET A 48 -4.769 -10.112 -0.864 1.00 0.49 S ATOM 458 CE MET A 48 -4.936 -8.961 -2.249 1.00 0.49 C ATOM 0 H MET A 48 -2.019 -9.681 -3.819 1.00 0.28 H new ATOM 0 HA MET A 48 -2.344 -7.674 -1.737 1.00 0.30 H new ATOM 0 HB2 MET A 48 -2.536 -10.487 -2.199 1.00 0.37 H new ATOM 0 HB3 MET A 48 -1.229 -10.328 -1.043 1.00 0.37 H new ATOM 0 HG2 MET A 48 -2.830 -10.114 0.569 1.00 0.51 H new ATOM 0 HG3 MET A 48 -3.143 -8.515 -0.076 1.00 0.51 H new ATOM 0 HE1 MET A 48 -5.983 -8.897 -2.544 1.00 0.49 H new ATOM 0 HE2 MET A 48 -4.583 -7.975 -1.947 1.00 0.49 H new ATOM 0 HE3 MET A 48 -4.343 -9.317 -3.091 1.00 0.49 H new ATOM 468 N ALA A 49 0.673 -8.920 -2.165 1.00 0.27 N ATOM 469 CA ALA A 49 2.110 -8.647 -1.859 1.00 0.30 C ATOM 470 C ALA A 49 2.507 -7.246 -2.331 1.00 0.29 C ATOM 471 O ALA A 49 3.119 -6.491 -1.598 1.00 0.35 O ATOM 472 CB ALA A 49 2.888 -9.710 -2.636 1.00 0.35 C ATOM 0 H ALA A 49 0.508 -9.749 -2.735 1.00 0.27 H new ATOM 0 HA ALA A 49 2.313 -8.686 -0.789 1.00 0.30 H new ATOM 0 HB1 ALA A 49 3.956 -9.578 -2.464 1.00 0.35 H new ATOM 0 HB2 ALA A 49 2.586 -10.701 -2.298 1.00 0.35 H new ATOM 0 HB3 ALA A 49 2.677 -9.610 -3.701 1.00 0.35 H new ATOM 478 N LEU A 50 2.175 -6.895 -3.551 1.00 0.28 N ATOM 479 CA LEU A 50 2.547 -5.542 -4.067 1.00 0.31 C ATOM 480 C LEU A 50 1.962 -4.445 -3.170 1.00 0.29 C ATOM 481 O LEU A 50 2.688 -3.639 -2.613 1.00 0.31 O ATOM 482 CB LEU A 50 1.949 -5.465 -5.473 1.00 0.36 C ATOM 483 CG LEU A 50 2.604 -4.317 -6.245 1.00 0.49 C ATOM 484 CD1 LEU A 50 4.105 -4.582 -6.386 1.00 0.91 C ATOM 485 CD2 LEU A 50 1.972 -4.214 -7.635 1.00 0.72 C ATOM 0 H LEU A 50 1.665 -7.485 -4.208 1.00 0.28 H new ATOM 0 HA LEU A 50 3.627 -5.395 -4.079 1.00 0.31 H new ATOM 0 HB2 LEU A 50 2.106 -6.407 -5.999 1.00 0.36 H new ATOM 0 HB3 LEU A 50 0.872 -5.309 -5.413 1.00 0.36 H new ATOM 0 HG LEU A 50 2.452 -3.383 -5.704 1.00 0.49 H new ATOM 0 HD11 LEU A 50 4.569 -3.763 -6.936 1.00 0.91 H new ATOM 0 HD12 LEU A 50 4.556 -4.656 -5.396 1.00 0.91 H new ATOM 0 HD13 LEU A 50 4.260 -5.516 -6.926 1.00 0.91 H new ATOM 0 HD21 LEU A 50 2.437 -3.397 -8.187 1.00 0.72 H new ATOM 0 HD22 LEU A 50 2.125 -5.149 -8.174 1.00 0.72 H new ATOM 0 HD23 LEU A 50 0.904 -4.023 -7.536 1.00 0.72 H new ATOM 497 N VAL A 51 0.660 -4.405 -3.025 1.00 0.28 N ATOM 498 CA VAL A 51 0.039 -3.362 -2.167 1.00 0.30 C ATOM 499 C VAL A 51 0.515 -3.521 -0.718 1.00 0.29 C ATOM 500 O VAL A 51 0.643 -2.552 0.001 1.00 0.34 O ATOM 501 CB VAL A 51 -1.471 -3.588 -2.290 1.00 0.35 C ATOM 502 CG1 VAL A 51 -2.206 -2.583 -1.414 1.00 0.44 C ATOM 503 CG2 VAL A 51 -1.895 -3.392 -3.748 1.00 0.45 C ATOM 0 H VAL A 51 0.005 -5.051 -3.465 1.00 0.28 H new ATOM 0 HA VAL A 51 0.312 -2.352 -2.472 1.00 0.30 H new ATOM 0 HB VAL A 51 -1.716 -4.601 -1.969 1.00 0.35 H new ATOM 0 HG11 VAL A 51 -3.281 -2.743 -1.500 1.00 0.44 H new ATOM 0 HG12 VAL A 51 -1.902 -2.715 -0.376 1.00 0.44 H new ATOM 0 HG13 VAL A 51 -1.962 -1.571 -1.738 1.00 0.44 H new ATOM 0 HG21 VAL A 51 -2.969 -3.552 -3.839 1.00 0.45 H new ATOM 0 HG22 VAL A 51 -1.651 -2.378 -4.065 1.00 0.45 H new ATOM 0 HG23 VAL A 51 -1.367 -4.106 -4.380 1.00 0.45 H new ATOM 513 N ALA A 52 0.794 -4.730 -0.291 1.00 0.29 N ATOM 514 CA ALA A 52 1.280 -4.940 1.111 1.00 0.32 C ATOM 515 C ALA A 52 2.647 -4.281 1.278 1.00 0.28 C ATOM 516 O ALA A 52 2.858 -3.493 2.180 1.00 0.30 O ATOM 517 CB ALA A 52 1.396 -6.454 1.289 1.00 0.40 C ATOM 0 H ALA A 52 0.707 -5.578 -0.851 1.00 0.29 H new ATOM 0 HA ALA A 52 0.607 -4.505 1.849 1.00 0.32 H new ATOM 0 HB1 ALA A 52 1.748 -6.676 2.296 1.00 0.40 H new ATOM 0 HB2 ALA A 52 0.420 -6.914 1.136 1.00 0.40 H new ATOM 0 HB3 ALA A 52 2.103 -6.853 0.562 1.00 0.40 H new ATOM 523 N PHE A 53 3.569 -4.591 0.398 1.00 0.28 N ATOM 524 CA PHE A 53 4.931 -3.978 0.471 1.00 0.28 C ATOM 525 C PHE A 53 4.789 -2.459 0.593 1.00 0.27 C ATOM 526 O PHE A 53 5.248 -1.847 1.547 1.00 0.29 O ATOM 527 CB PHE A 53 5.595 -4.365 -0.855 1.00 0.32 C ATOM 528 CG PHE A 53 6.950 -3.711 -0.970 1.00 0.41 C ATOM 529 CD1 PHE A 53 7.893 -3.864 0.052 1.00 0.61 C ATOM 530 CD2 PHE A 53 7.262 -2.952 -2.103 1.00 0.71 C ATOM 531 CE1 PHE A 53 9.149 -3.256 -0.059 1.00 0.76 C ATOM 532 CE2 PHE A 53 8.517 -2.344 -2.215 1.00 0.84 C ATOM 533 CZ PHE A 53 9.461 -2.496 -1.193 1.00 0.77 C ATOM 0 H PHE A 53 3.434 -5.246 -0.372 1.00 0.28 H new ATOM 0 HA PHE A 53 5.516 -4.316 1.326 1.00 0.28 H new ATOM 0 HB2 PHE A 53 5.700 -5.448 -0.915 1.00 0.32 H new ATOM 0 HB3 PHE A 53 4.964 -4.059 -1.689 1.00 0.32 H new ATOM 0 HD1 PHE A 53 7.652 -4.451 0.926 1.00 0.61 H new ATOM 0 HD2 PHE A 53 6.534 -2.835 -2.892 1.00 0.71 H new ATOM 0 HE1 PHE A 53 9.877 -3.373 0.730 1.00 0.76 H new ATOM 0 HE2 PHE A 53 8.757 -1.758 -3.090 1.00 0.84 H new ATOM 0 HZ PHE A 53 10.430 -2.027 -1.279 1.00 0.77 H new ATOM 543 N LEU A 54 4.122 -1.854 -0.353 1.00 0.27 N ATOM 544 CA LEU A 54 3.911 -0.382 -0.291 1.00 0.29 C ATOM 545 C LEU A 54 3.157 -0.036 0.997 1.00 0.28 C ATOM 546 O LEU A 54 3.457 0.938 1.656 1.00 0.31 O ATOM 547 CB LEU A 54 3.071 -0.048 -1.527 1.00 0.34 C ATOM 548 CG LEU A 54 3.989 0.213 -2.727 1.00 0.38 C ATOM 549 CD1 LEU A 54 4.896 1.411 -2.434 1.00 0.48 C ATOM 550 CD2 LEU A 54 4.852 -1.024 -2.994 1.00 0.55 C ATOM 0 H LEU A 54 3.715 -2.317 -1.165 1.00 0.27 H new ATOM 0 HA LEU A 54 4.843 0.183 -0.283 1.00 0.29 H new ATOM 0 HB2 LEU A 54 2.392 -0.871 -1.750 1.00 0.34 H new ATOM 0 HB3 LEU A 54 2.454 0.829 -1.332 1.00 0.34 H new ATOM 0 HG LEU A 54 3.378 0.427 -3.604 1.00 0.38 H new ATOM 0 HD11 LEU A 54 5.547 1.593 -3.290 1.00 0.48 H new ATOM 0 HD12 LEU A 54 4.284 2.294 -2.249 1.00 0.48 H new ATOM 0 HD13 LEU A 54 5.504 1.200 -1.554 1.00 0.48 H new ATOM 0 HD21 LEU A 54 5.503 -0.836 -3.847 1.00 0.55 H new ATOM 0 HD22 LEU A 54 5.459 -1.241 -2.115 1.00 0.55 H new ATOM 0 HD23 LEU A 54 4.209 -1.877 -3.210 1.00 0.55 H new ATOM 562 N ARG A 55 2.193 -0.848 1.368 1.00 0.27 N ATOM 563 CA ARG A 55 1.421 -0.587 2.624 1.00 0.27 C ATOM 564 C ARG A 55 2.275 -0.897 3.860 1.00 0.27 C ATOM 565 O ARG A 55 1.842 -0.710 4.982 1.00 0.33 O ATOM 566 CB ARG A 55 0.213 -1.523 2.561 1.00 0.29 C ATOM 567 CG ARG A 55 -0.695 -1.272 3.769 1.00 0.38 C ATOM 568 CD ARG A 55 -0.568 -2.432 4.759 1.00 0.55 C ATOM 569 NE ARG A 55 -1.340 -1.999 5.956 1.00 0.61 N ATOM 570 CZ ARG A 55 -0.771 -1.989 7.131 1.00 0.49 C ATOM 571 NH1 ARG A 55 0.234 -1.189 7.363 1.00 0.44 N ATOM 572 NH2 ARG A 55 -1.208 -2.779 8.073 1.00 0.61 N ATOM 0 H ARG A 55 1.908 -1.681 0.853 1.00 0.27 H new ATOM 0 HA ARG A 55 1.122 0.458 2.703 1.00 0.27 H new ATOM 0 HB2 ARG A 55 -0.340 -1.357 1.637 1.00 0.29 H new ATOM 0 HB3 ARG A 55 0.545 -2.561 2.552 1.00 0.29 H new ATOM 0 HG2 ARG A 55 -0.420 -0.335 4.254 1.00 0.38 H new ATOM 0 HG3 ARG A 55 -1.730 -1.171 3.443 1.00 0.38 H new ATOM 0 HD2 ARG A 55 -0.971 -3.354 4.341 1.00 0.55 H new ATOM 0 HD3 ARG A 55 0.475 -2.625 5.010 1.00 0.55 H new ATOM 0 HE ARG A 55 -2.313 -1.710 5.858 1.00 0.61 H new ATOM 0 HH11 ARG A 55 0.575 -0.571 6.626 1.00 0.44 H new ATOM 0 HH12 ARG A 55 0.678 -1.181 8.281 1.00 0.44 H new ATOM 0 HH21 ARG A 55 -1.994 -3.404 7.891 1.00 0.61 H new ATOM 0 HH22 ARG A 55 -0.764 -2.772 8.991 1.00 0.61 H new ATOM 586 N PHE A 56 3.478 -1.370 3.666 1.00 0.27 N ATOM 587 CA PHE A 56 4.353 -1.687 4.830 1.00 0.26 C ATOM 588 C PHE A 56 5.433 -0.611 4.993 1.00 0.27 C ATOM 589 O PHE A 56 5.998 -0.457 6.059 1.00 0.29 O ATOM 590 CB PHE A 56 4.989 -3.037 4.493 1.00 0.27 C ATOM 591 CG PHE A 56 4.305 -4.133 5.278 1.00 0.29 C ATOM 592 CD1 PHE A 56 2.930 -4.364 5.122 1.00 0.42 C ATOM 593 CD2 PHE A 56 5.049 -4.920 6.164 1.00 0.50 C ATOM 594 CE1 PHE A 56 2.305 -5.381 5.852 1.00 0.44 C ATOM 595 CE2 PHE A 56 4.423 -5.936 6.893 1.00 0.57 C ATOM 596 CZ PHE A 56 3.051 -6.167 6.738 1.00 0.42 C ATOM 0 H PHE A 56 3.891 -1.550 2.751 1.00 0.27 H new ATOM 0 HA PHE A 56 3.796 -1.721 5.766 1.00 0.26 H new ATOM 0 HB2 PHE A 56 4.903 -3.234 3.424 1.00 0.27 H new ATOM 0 HB3 PHE A 56 6.053 -3.017 4.729 1.00 0.27 H new ATOM 0 HD1 PHE A 56 2.354 -3.757 4.439 1.00 0.42 H new ATOM 0 HD2 PHE A 56 6.107 -4.743 6.285 1.00 0.50 H new ATOM 0 HE1 PHE A 56 1.247 -5.560 5.732 1.00 0.44 H new ATOM 0 HE2 PHE A 56 4.999 -6.543 7.576 1.00 0.57 H new ATOM 0 HZ PHE A 56 2.568 -6.951 7.302 1.00 0.42 H new ATOM 606 N LEU A 57 5.740 0.121 3.944 1.00 0.29 N ATOM 607 CA LEU A 57 6.809 1.168 4.059 1.00 0.32 C ATOM 608 C LEU A 57 6.233 2.595 4.047 1.00 0.37 C ATOM 609 O LEU A 57 6.693 3.450 4.782 1.00 0.43 O ATOM 610 CB LEU A 57 7.717 0.956 2.843 1.00 0.35 C ATOM 611 CG LEU A 57 8.024 -0.536 2.663 1.00 0.34 C ATOM 612 CD1 LEU A 57 8.990 -0.721 1.490 1.00 0.45 C ATOM 613 CD2 LEU A 57 8.664 -1.096 3.939 1.00 0.37 C ATOM 0 H LEU A 57 5.303 0.040 3.026 1.00 0.29 H new ATOM 0 HA LEU A 57 7.341 1.070 5.005 1.00 0.32 H new ATOM 0 HB2 LEU A 57 7.234 1.346 1.947 1.00 0.35 H new ATOM 0 HB3 LEU A 57 8.645 1.513 2.972 1.00 0.35 H new ATOM 0 HG LEU A 57 7.095 -1.069 2.462 1.00 0.34 H new ATOM 0 HD11 LEU A 57 9.208 -1.781 1.362 1.00 0.45 H new ATOM 0 HD12 LEU A 57 8.535 -0.332 0.579 1.00 0.45 H new ATOM 0 HD13 LEU A 57 9.916 -0.182 1.692 1.00 0.45 H new ATOM 0 HD21 LEU A 57 8.879 -2.156 3.803 1.00 0.37 H new ATOM 0 HD22 LEU A 57 9.591 -0.561 4.146 1.00 0.37 H new ATOM 0 HD23 LEU A 57 7.978 -0.969 4.776 1.00 0.37 H new ATOM 625 N THR A 58 5.260 2.873 3.212 1.00 0.39 N ATOM 626 CA THR A 58 4.698 4.264 3.154 1.00 0.46 C ATOM 627 C THR A 58 3.169 4.254 3.008 1.00 0.43 C ATOM 628 O THR A 58 2.518 5.266 3.187 1.00 0.47 O ATOM 629 CB THR A 58 5.345 4.885 1.915 1.00 0.52 C ATOM 630 OG1 THR A 58 6.751 4.679 1.960 1.00 0.68 O ATOM 631 CG2 THR A 58 5.049 6.383 1.878 1.00 0.68 C ATOM 0 H THR A 58 4.832 2.204 2.572 1.00 0.39 H new ATOM 0 HA THR A 58 4.907 4.820 4.068 1.00 0.46 H new ATOM 0 HB THR A 58 4.938 4.414 1.020 1.00 0.52 H new ATOM 0 HG1 THR A 58 7.165 5.076 1.165 1.00 0.68 H new ATOM 0 HG21 THR A 58 5.511 6.823 0.994 1.00 0.68 H new ATOM 0 HG22 THR A 58 3.971 6.540 1.840 1.00 0.68 H new ATOM 0 HG23 THR A 58 5.454 6.856 2.773 1.00 0.68 H new ATOM 639 N ILE A 59 2.599 3.123 2.688 1.00 0.38 N ATOM 640 CA ILE A 59 1.118 3.016 2.528 1.00 0.37 C ATOM 641 C ILE A 59 0.566 4.054 1.535 1.00 0.36 C ATOM 642 O ILE A 59 -0.251 4.881 1.895 1.00 0.38 O ATOM 643 CB ILE A 59 0.548 3.244 3.926 1.00 0.41 C ATOM 644 CG1 ILE A 59 1.153 2.229 4.896 1.00 0.47 C ATOM 645 CG2 ILE A 59 -0.973 3.064 3.889 1.00 0.45 C ATOM 646 CD1 ILE A 59 2.402 2.826 5.548 1.00 0.46 C ATOM 0 H ILE A 59 3.106 2.253 2.528 1.00 0.38 H new ATOM 0 HA ILE A 59 0.837 2.046 2.119 1.00 0.37 H new ATOM 0 HB ILE A 59 0.791 4.254 4.257 1.00 0.41 H new ATOM 0 HG12 ILE A 59 0.424 1.961 5.660 1.00 0.47 H new ATOM 0 HG13 ILE A 59 1.410 1.312 4.366 1.00 0.47 H new ATOM 0 HG21 ILE A 59 -1.383 3.226 4.886 1.00 0.45 H new ATOM 0 HG22 ILE A 59 -1.408 3.784 3.196 1.00 0.45 H new ATOM 0 HG23 ILE A 59 -1.212 2.053 3.559 1.00 0.45 H new ATOM 0 HD11 ILE A 59 2.833 2.102 6.239 1.00 0.46 H new ATOM 0 HD12 ILE A 59 3.133 3.071 4.777 1.00 0.46 H new ATOM 0 HD13 ILE A 59 2.131 3.731 6.092 1.00 0.46 H new ATOM 658 N PRO A 60 1.008 3.958 0.304 1.00 0.39 N ATOM 659 CA PRO A 60 0.534 4.842 -0.773 1.00 0.43 C ATOM 660 C PRO A 60 -0.423 4.057 -1.702 1.00 0.43 C ATOM 661 O PRO A 60 -0.117 3.866 -2.866 1.00 0.50 O ATOM 662 CB PRO A 60 1.842 5.141 -1.507 1.00 0.52 C ATOM 663 CG PRO A 60 2.739 3.957 -1.217 1.00 0.53 C ATOM 664 CD PRO A 60 2.019 3.064 -0.226 1.00 0.45 C ATOM 0 HA PRO A 60 -0.007 5.726 -0.435 1.00 0.43 H new ATOM 0 HB2 PRO A 60 1.675 5.256 -2.578 1.00 0.52 H new ATOM 0 HB3 PRO A 60 2.289 6.070 -1.153 1.00 0.52 H new ATOM 0 HG2 PRO A 60 2.959 3.411 -2.134 1.00 0.53 H new ATOM 0 HG3 PRO A 60 3.693 4.291 -0.808 1.00 0.53 H new ATOM 0 HD2 PRO A 60 1.580 2.191 -0.708 1.00 0.45 H new ATOM 0 HD3 PRO A 60 2.687 2.696 0.553 1.00 0.45 H new ATOM 672 N PRO A 61 -1.540 3.596 -1.173 1.00 0.40 N ATOM 673 CA PRO A 61 -2.486 2.808 -2.001 1.00 0.43 C ATOM 674 C PRO A 61 -3.157 3.694 -3.051 1.00 0.45 C ATOM 675 O PRO A 61 -3.904 4.598 -2.728 1.00 0.73 O ATOM 676 CB PRO A 61 -3.505 2.282 -0.998 1.00 0.45 C ATOM 677 CG PRO A 61 -3.449 3.241 0.139 1.00 0.43 C ATOM 678 CD PRO A 61 -2.034 3.758 0.200 1.00 0.40 C ATOM 0 HA PRO A 61 -1.995 2.008 -2.555 1.00 0.43 H new ATOM 0 HB2 PRO A 61 -4.504 2.242 -1.433 1.00 0.45 H new ATOM 0 HB3 PRO A 61 -3.257 1.271 -0.675 1.00 0.45 H new ATOM 0 HG2 PRO A 61 -4.154 4.059 -0.010 1.00 0.43 H new ATOM 0 HG3 PRO A 61 -3.722 2.750 1.073 1.00 0.43 H new ATOM 0 HD2 PRO A 61 -2.003 4.801 0.515 1.00 0.40 H new ATOM 0 HD3 PRO A 61 -1.432 3.192 0.911 1.00 0.40 H new ATOM 686 N THR A 62 -2.893 3.432 -4.304 1.00 0.36 N ATOM 687 CA THR A 62 -3.508 4.245 -5.395 1.00 0.35 C ATOM 688 C THR A 62 -5.041 4.181 -5.289 1.00 0.34 C ATOM 689 O THR A 62 -5.580 3.389 -4.542 1.00 0.40 O ATOM 690 CB THR A 62 -2.970 3.613 -6.695 1.00 0.37 C ATOM 691 OG1 THR A 62 -2.566 4.642 -7.582 1.00 0.42 O ATOM 692 CG2 THR A 62 -4.031 2.744 -7.377 1.00 0.36 C ATOM 0 H THR A 62 -2.274 2.685 -4.621 1.00 0.36 H new ATOM 0 HA THR A 62 -3.257 5.305 -5.349 1.00 0.35 H new ATOM 0 HB THR A 62 -2.123 2.976 -6.439 1.00 0.37 H new ATOM 0 HG1 THR A 62 -2.222 4.245 -8.409 1.00 0.42 H new ATOM 0 HG21 THR A 62 -3.618 2.315 -8.290 1.00 0.36 H new ATOM 0 HG22 THR A 62 -4.333 1.942 -6.703 1.00 0.36 H new ATOM 0 HG23 THR A 62 -4.898 3.356 -7.624 1.00 0.36 H new ATOM 700 N ALA A 63 -5.735 5.020 -6.015 1.00 0.34 N ATOM 701 CA ALA A 63 -7.233 5.031 -5.948 1.00 0.35 C ATOM 702 C ALA A 63 -7.819 3.639 -6.219 1.00 0.32 C ATOM 703 O ALA A 63 -8.778 3.230 -5.591 1.00 0.36 O ATOM 704 CB ALA A 63 -7.668 6.008 -7.041 1.00 0.37 C ATOM 0 H ALA A 63 -5.329 5.702 -6.655 1.00 0.34 H new ATOM 0 HA ALA A 63 -7.585 5.322 -4.958 1.00 0.35 H new ATOM 0 HB1 ALA A 63 -8.756 6.074 -7.058 1.00 0.37 H new ATOM 0 HB2 ALA A 63 -7.248 6.993 -6.837 1.00 0.37 H new ATOM 0 HB3 ALA A 63 -7.310 5.655 -8.008 1.00 0.37 H new ATOM 710 N GLY A 64 -7.262 2.922 -7.158 1.00 0.30 N ATOM 711 CA GLY A 64 -7.792 1.566 -7.493 1.00 0.30 C ATOM 712 C GLY A 64 -7.733 0.639 -6.275 1.00 0.29 C ATOM 713 O GLY A 64 -8.691 -0.034 -5.965 1.00 0.31 O ATOM 0 H GLY A 64 -6.458 3.218 -7.711 1.00 0.30 H new ATOM 0 HA2 GLY A 64 -8.821 1.650 -7.842 1.00 0.30 H new ATOM 0 HA3 GLY A 64 -7.212 1.136 -8.310 1.00 0.30 H new ATOM 717 N ILE A 65 -6.615 0.588 -5.597 1.00 0.29 N ATOM 718 CA ILE A 65 -6.478 -0.310 -4.406 1.00 0.31 C ATOM 719 C ILE A 65 -7.669 -0.146 -3.455 1.00 0.31 C ATOM 720 O ILE A 65 -8.130 -1.104 -2.866 1.00 0.33 O ATOM 721 CB ILE A 65 -5.173 0.128 -3.724 1.00 0.32 C ATOM 722 CG1 ILE A 65 -3.998 -0.029 -4.699 1.00 0.39 C ATOM 723 CG2 ILE A 65 -4.916 -0.738 -2.485 1.00 0.35 C ATOM 724 CD1 ILE A 65 -3.999 -1.443 -5.283 1.00 0.46 C ATOM 0 H ILE A 65 -5.783 1.134 -5.818 1.00 0.29 H new ATOM 0 HA ILE A 65 -6.458 -1.362 -4.692 1.00 0.31 H new ATOM 0 HB ILE A 65 -5.265 1.173 -3.427 1.00 0.32 H new ATOM 0 HG12 ILE A 65 -4.077 0.706 -5.500 1.00 0.39 H new ATOM 0 HG13 ILE A 65 -3.057 0.161 -4.183 1.00 0.39 H new ATOM 0 HG21 ILE A 65 -3.989 -0.422 -2.006 1.00 0.35 H new ATOM 0 HG22 ILE A 65 -5.743 -0.625 -1.784 1.00 0.35 H new ATOM 0 HG23 ILE A 65 -4.833 -1.783 -2.783 1.00 0.35 H new ATOM 0 HD11 ILE A 65 -3.164 -1.552 -5.975 1.00 0.46 H new ATOM 0 HD12 ILE A 65 -3.899 -2.170 -4.477 1.00 0.46 H new ATOM 0 HD13 ILE A 65 -4.935 -1.617 -5.814 1.00 0.46 H new ATOM 736 N LEU A 66 -8.175 1.053 -3.312 1.00 0.32 N ATOM 737 CA LEU A 66 -9.339 1.268 -2.399 1.00 0.34 C ATOM 738 C LEU A 66 -10.644 0.897 -3.108 1.00 0.32 C ATOM 739 O LEU A 66 -11.415 0.092 -2.618 1.00 0.35 O ATOM 740 CB LEU A 66 -9.328 2.764 -2.054 1.00 0.40 C ATOM 741 CG LEU A 66 -8.205 3.086 -1.054 1.00 0.46 C ATOM 742 CD1 LEU A 66 -8.225 2.093 0.112 1.00 0.56 C ATOM 743 CD2 LEU A 66 -6.853 3.010 -1.765 1.00 0.45 C ATOM 0 H LEU A 66 -7.834 1.889 -3.786 1.00 0.32 H new ATOM 0 HA LEU A 66 -9.269 0.649 -1.505 1.00 0.34 H new ATOM 0 HB2 LEU A 66 -9.191 3.350 -2.963 1.00 0.40 H new ATOM 0 HB3 LEU A 66 -10.291 3.051 -1.631 1.00 0.40 H new ATOM 0 HG LEU A 66 -8.361 4.091 -0.662 1.00 0.46 H new ATOM 0 HD11 LEU A 66 -7.424 2.335 0.810 1.00 0.56 H new ATOM 0 HD12 LEU A 66 -9.185 2.154 0.625 1.00 0.56 H new ATOM 0 HD13 LEU A 66 -8.081 1.082 -0.269 1.00 0.56 H new ATOM 0 HD21 LEU A 66 -6.056 3.238 -1.057 1.00 0.45 H new ATOM 0 HD22 LEU A 66 -6.708 2.006 -2.164 1.00 0.45 H new ATOM 0 HD23 LEU A 66 -6.830 3.732 -2.582 1.00 0.45 H new ATOM 755 N LYS A 67 -10.894 1.477 -4.256 1.00 0.32 N ATOM 756 CA LYS A 67 -12.149 1.161 -5.005 1.00 0.34 C ATOM 757 C LYS A 67 -12.239 -0.345 -5.261 1.00 0.32 C ATOM 758 O LYS A 67 -13.301 -0.934 -5.194 1.00 0.38 O ATOM 759 CB LYS A 67 -12.030 1.922 -6.326 1.00 0.38 C ATOM 760 CG LYS A 67 -12.384 3.393 -6.102 1.00 0.42 C ATOM 761 CD LYS A 67 -13.901 3.538 -5.948 1.00 0.47 C ATOM 762 CE LYS A 67 -14.594 3.131 -7.252 1.00 0.57 C ATOM 763 NZ LYS A 67 -15.267 1.838 -6.944 1.00 0.71 N ATOM 0 H LYS A 67 -10.282 2.157 -4.707 1.00 0.32 H new ATOM 0 HA LYS A 67 -13.044 1.448 -4.452 1.00 0.34 H new ATOM 0 HB2 LYS A 67 -11.016 1.837 -6.717 1.00 0.38 H new ATOM 0 HB3 LYS A 67 -12.696 1.486 -7.070 1.00 0.38 H new ATOM 0 HG2 LYS A 67 -11.880 3.767 -5.211 1.00 0.42 H new ATOM 0 HG3 LYS A 67 -12.034 3.994 -6.942 1.00 0.42 H new ATOM 0 HD2 LYS A 67 -14.254 2.914 -5.127 1.00 0.47 H new ATOM 0 HD3 LYS A 67 -14.154 4.568 -5.697 1.00 0.47 H new ATOM 0 HE2 LYS A 67 -15.314 3.885 -7.568 1.00 0.57 H new ATOM 0 HE3 LYS A 67 -13.874 3.018 -8.063 1.00 0.57 H new ATOM 0 HZ1 LYS A 67 -15.407 1.301 -7.824 1.00 0.71 H new ATOM 0 HZ2 LYS A 67 -14.675 1.285 -6.292 1.00 0.71 H new ATOM 0 HZ3 LYS A 67 -16.190 2.024 -6.501 1.00 0.71 H new ATOM 777 N ARG A 68 -11.124 -0.967 -5.543 1.00 0.28 N ATOM 778 CA ARG A 68 -11.120 -2.435 -5.794 1.00 0.27 C ATOM 779 C ARG A 68 -11.224 -3.182 -4.457 1.00 0.25 C ATOM 780 O ARG A 68 -11.773 -4.263 -4.380 1.00 0.28 O ATOM 781 CB ARG A 68 -9.791 -2.715 -6.521 1.00 0.28 C ATOM 782 CG ARG A 68 -8.684 -3.085 -5.528 1.00 0.30 C ATOM 783 CD ARG A 68 -7.340 -3.146 -6.264 1.00 0.37 C ATOM 784 NE ARG A 68 -7.373 -4.427 -7.025 1.00 0.42 N ATOM 785 CZ ARG A 68 -7.941 -4.479 -8.200 1.00 0.36 C ATOM 786 NH1 ARG A 68 -7.736 -3.528 -9.070 1.00 0.36 N ATOM 787 NH2 ARG A 68 -8.716 -5.484 -8.505 1.00 0.50 N ATOM 0 H ARG A 68 -10.211 -0.516 -5.610 1.00 0.28 H new ATOM 0 HA ARG A 68 -11.963 -2.772 -6.398 1.00 0.27 H new ATOM 0 HB2 ARG A 68 -9.928 -3.526 -7.236 1.00 0.28 H new ATOM 0 HB3 ARG A 68 -9.493 -1.835 -7.091 1.00 0.28 H new ATOM 0 HG2 ARG A 68 -8.639 -2.349 -4.726 1.00 0.30 H new ATOM 0 HG3 ARG A 68 -8.902 -4.048 -5.065 1.00 0.30 H new ATOM 0 HD2 ARG A 68 -7.217 -2.293 -6.932 1.00 0.37 H new ATOM 0 HD3 ARG A 68 -6.505 -3.125 -5.563 1.00 0.37 H new ATOM 0 HE ARG A 68 -6.951 -5.266 -6.627 1.00 0.42 H new ATOM 0 HH11 ARG A 68 -7.131 -2.742 -8.833 1.00 0.36 H new ATOM 0 HH12 ARG A 68 -8.181 -3.571 -9.987 1.00 0.36 H new ATOM 0 HH21 ARG A 68 -8.878 -6.228 -7.826 1.00 0.50 H new ATOM 0 HH22 ARG A 68 -9.160 -5.526 -9.422 1.00 0.50 H new ATOM 801 N TRP A 69 -10.699 -2.594 -3.409 1.00 0.25 N ATOM 802 CA TRP A 69 -10.747 -3.226 -2.050 1.00 0.26 C ATOM 803 C TRP A 69 -12.153 -3.735 -1.698 1.00 0.28 C ATOM 804 O TRP A 69 -12.301 -4.744 -1.035 1.00 0.31 O ATOM 805 CB TRP A 69 -10.378 -2.089 -1.104 1.00 0.28 C ATOM 806 CG TRP A 69 -9.694 -2.620 0.110 1.00 0.26 C ATOM 807 CD1 TRP A 69 -10.117 -2.414 1.376 1.00 0.29 C ATOM 808 CD2 TRP A 69 -8.478 -3.421 0.209 1.00 0.27 C ATOM 809 NE1 TRP A 69 -9.242 -3.030 2.245 1.00 0.31 N ATOM 810 CE2 TRP A 69 -8.216 -3.661 1.579 1.00 0.29 C ATOM 811 CE3 TRP A 69 -7.583 -3.957 -0.738 1.00 0.30 C ATOM 812 CZ2 TRP A 69 -7.111 -4.399 1.995 1.00 0.33 C ATOM 813 CZ3 TRP A 69 -6.470 -4.701 -0.318 1.00 0.35 C ATOM 814 CH2 TRP A 69 -6.237 -4.917 1.046 1.00 0.35 C ATOM 0 H TRP A 69 -10.231 -1.688 -3.437 1.00 0.25 H new ATOM 0 HA TRP A 69 -10.085 -4.090 -1.992 1.00 0.26 H new ATOM 0 HB2 TRP A 69 -9.726 -1.380 -1.615 1.00 0.28 H new ATOM 0 HB3 TRP A 69 -11.276 -1.544 -0.813 1.00 0.28 H new ATOM 0 HD1 TRP A 69 -10.997 -1.857 1.661 1.00 0.29 H new ATOM 0 HE1 TRP A 69 -9.343 -3.019 3.260 1.00 0.31 H new ATOM 0 HE3 TRP A 69 -7.754 -3.794 -1.792 1.00 0.30 H new ATOM 0 HZ2 TRP A 69 -6.934 -4.568 3.047 1.00 0.33 H new ATOM 0 HZ3 TRP A 69 -5.789 -5.109 -1.050 1.00 0.35 H new ATOM 0 HH2 TRP A 69 -5.376 -5.488 1.361 1.00 0.35 H new ATOM 825 N GLY A 70 -13.179 -3.028 -2.108 1.00 0.30 N ATOM 826 CA GLY A 70 -14.570 -3.454 -1.764 1.00 0.34 C ATOM 827 C GLY A 70 -15.300 -3.977 -3.000 1.00 0.34 C ATOM 828 O GLY A 70 -16.457 -3.668 -3.218 1.00 0.39 O ATOM 0 H GLY A 70 -13.112 -2.176 -2.665 1.00 0.30 H new ATOM 0 HA2 GLY A 70 -14.539 -4.230 -0.999 1.00 0.34 H new ATOM 0 HA3 GLY A 70 -15.119 -2.612 -1.341 1.00 0.34 H new ATOM 832 N THR A 71 -14.647 -4.775 -3.803 1.00 0.32 N ATOM 833 CA THR A 71 -15.322 -5.327 -5.016 1.00 0.35 C ATOM 834 C THR A 71 -14.480 -6.443 -5.645 1.00 0.34 C ATOM 835 O THR A 71 -14.555 -6.690 -6.834 1.00 0.39 O ATOM 836 CB THR A 71 -15.469 -4.142 -5.974 1.00 0.37 C ATOM 837 OG1 THR A 71 -16.155 -4.566 -7.144 1.00 0.45 O ATOM 838 CG2 THR A 71 -14.090 -3.611 -6.354 1.00 0.39 C ATOM 0 H THR A 71 -13.679 -5.068 -3.673 1.00 0.32 H new ATOM 0 HA THR A 71 -16.288 -5.771 -4.777 1.00 0.35 H new ATOM 0 HB THR A 71 -16.035 -3.349 -5.485 1.00 0.37 H new ATOM 0 HG1 THR A 71 -15.820 -5.445 -7.419 1.00 0.45 H new ATOM 0 HG21 THR A 71 -14.200 -2.768 -7.036 1.00 0.39 H new ATOM 0 HG22 THR A 71 -13.565 -3.285 -5.456 1.00 0.39 H new ATOM 0 HG23 THR A 71 -13.518 -4.400 -6.842 1.00 0.39 H new ATOM 846 N ILE A 72 -13.692 -7.127 -4.852 1.00 0.34 N ATOM 847 CA ILE A 72 -12.858 -8.239 -5.398 1.00 0.35 C ATOM 848 C ILE A 72 -13.501 -9.587 -5.038 1.00 0.36 C ATOM 849 O ILE A 72 -14.659 -9.818 -5.330 1.00 0.45 O ATOM 850 CB ILE A 72 -11.472 -8.077 -4.756 1.00 0.34 C ATOM 851 CG1 ILE A 72 -11.597 -8.086 -3.230 1.00 0.36 C ATOM 852 CG2 ILE A 72 -10.840 -6.758 -5.210 1.00 0.40 C ATOM 853 CD1 ILE A 72 -10.346 -8.730 -2.627 1.00 0.34 C ATOM 0 H ILE A 72 -13.591 -6.962 -3.850 1.00 0.34 H new ATOM 0 HA ILE A 72 -12.778 -8.210 -6.485 1.00 0.35 H new ATOM 0 HB ILE A 72 -10.839 -8.908 -5.069 1.00 0.34 H new ATOM 0 HG12 ILE A 72 -11.713 -7.069 -2.857 1.00 0.36 H new ATOM 0 HG13 ILE A 72 -12.487 -8.639 -2.929 1.00 0.36 H new ATOM 0 HG21 ILE A 72 -9.857 -6.649 -4.751 1.00 0.40 H new ATOM 0 HG22 ILE A 72 -10.736 -6.759 -6.295 1.00 0.40 H new ATOM 0 HG23 ILE A 72 -11.476 -5.926 -4.907 1.00 0.40 H new ATOM 0 HD11 ILE A 72 -10.429 -8.739 -1.540 1.00 0.34 H new ATOM 0 HD12 ILE A 72 -10.251 -9.753 -2.992 1.00 0.34 H new ATOM 0 HD13 ILE A 72 -9.466 -8.157 -2.919 1.00 0.34 H new ATOM 865 N LYS A 73 -12.765 -10.477 -4.421 1.00 0.34 N ATOM 866 CA LYS A 73 -13.336 -11.809 -4.059 1.00 0.36 C ATOM 867 C LYS A 73 -13.316 -12.018 -2.551 1.00 0.33 C ATOM 868 O LYS A 73 -14.178 -12.677 -2.001 1.00 0.36 O ATOM 869 CB LYS A 73 -12.410 -12.818 -4.730 1.00 0.38 C ATOM 870 CG LYS A 73 -12.917 -14.233 -4.470 1.00 0.40 C ATOM 871 CD LYS A 73 -14.004 -14.587 -5.488 1.00 0.51 C ATOM 872 CE LYS A 73 -13.382 -14.702 -6.883 1.00 0.58 C ATOM 873 NZ LYS A 73 -14.437 -15.334 -7.722 1.00 0.71 N ATOM 0 H LYS A 73 -11.791 -10.338 -4.152 1.00 0.34 H new ATOM 0 HA LYS A 73 -14.374 -11.905 -4.378 1.00 0.36 H new ATOM 0 HB2 LYS A 73 -12.366 -12.628 -5.802 1.00 0.38 H new ATOM 0 HB3 LYS A 73 -11.396 -12.708 -4.345 1.00 0.38 H new ATOM 0 HG2 LYS A 73 -12.093 -14.943 -4.541 1.00 0.40 H new ATOM 0 HG3 LYS A 73 -13.315 -14.307 -3.458 1.00 0.40 H new ATOM 0 HD2 LYS A 73 -14.482 -15.527 -5.213 1.00 0.51 H new ATOM 0 HD3 LYS A 73 -14.781 -13.822 -5.487 1.00 0.51 H new ATOM 0 HE2 LYS A 73 -13.101 -13.723 -7.272 1.00 0.58 H new ATOM 0 HE3 LYS A 73 -12.477 -15.309 -6.863 1.00 0.58 H new ATOM 0 HZ1 LYS A 73 -14.086 -15.447 -8.694 1.00 0.71 H new ATOM 0 HZ2 LYS A 73 -14.679 -16.267 -7.331 1.00 0.71 H new ATOM 0 HZ3 LYS A 73 -15.284 -14.731 -7.727 1.00 0.71 H new ATOM 887 N LYS A 74 -12.321 -11.485 -1.895 1.00 0.30 N ATOM 888 CA LYS A 74 -12.172 -11.649 -0.413 1.00 0.28 C ATOM 889 C LYS A 74 -11.773 -13.091 -0.086 1.00 0.27 C ATOM 890 O LYS A 74 -10.841 -13.328 0.657 1.00 0.29 O ATOM 891 CB LYS A 74 -13.522 -11.310 0.248 1.00 0.30 C ATOM 892 CG LYS A 74 -14.197 -10.114 -0.426 1.00 0.31 C ATOM 893 CD LYS A 74 -13.208 -8.958 -0.601 1.00 0.32 C ATOM 894 CE LYS A 74 -12.983 -8.273 0.747 1.00 0.32 C ATOM 895 NZ LYS A 74 -13.138 -6.817 0.470 1.00 0.30 N ATOM 0 H LYS A 74 -11.586 -10.929 -2.332 1.00 0.30 H new ATOM 0 HA LYS A 74 -11.395 -10.984 -0.036 1.00 0.28 H new ATOM 0 HB2 LYS A 74 -14.181 -12.177 0.196 1.00 0.30 H new ATOM 0 HB3 LYS A 74 -13.365 -11.092 1.304 1.00 0.30 H new ATOM 0 HG2 LYS A 74 -14.590 -10.413 -1.398 1.00 0.31 H new ATOM 0 HG3 LYS A 74 -15.046 -9.785 0.173 1.00 0.31 H new ATOM 0 HD2 LYS A 74 -12.262 -9.331 -0.994 1.00 0.32 H new ATOM 0 HD3 LYS A 74 -13.594 -8.241 -1.326 1.00 0.32 H new ATOM 0 HE2 LYS A 74 -13.706 -8.613 1.488 1.00 0.32 H new ATOM 0 HE3 LYS A 74 -11.992 -8.496 1.143 1.00 0.32 H new ATOM 0 HZ1 LYS A 74 -12.914 -6.275 1.329 1.00 0.30 H new ATOM 0 HZ2 LYS A 74 -12.490 -6.538 -0.294 1.00 0.30 H new ATOM 0 HZ3 LYS A 74 -14.118 -6.621 0.182 1.00 0.30 H new ATOM 909 N SER A 75 -12.464 -14.057 -0.642 1.00 0.28 N ATOM 910 CA SER A 75 -12.119 -15.481 -0.363 1.00 0.30 C ATOM 911 C SER A 75 -10.680 -15.747 -0.793 1.00 0.28 C ATOM 912 O SER A 75 -9.920 -16.373 -0.086 1.00 0.33 O ATOM 913 CB SER A 75 -13.104 -16.310 -1.193 1.00 0.37 C ATOM 914 OG SER A 75 -12.700 -16.311 -2.557 1.00 0.42 O ATOM 0 H SER A 75 -13.251 -13.918 -1.276 1.00 0.28 H new ATOM 0 HA SER A 75 -12.191 -15.731 0.695 1.00 0.30 H new ATOM 0 HB2 SER A 75 -13.143 -17.331 -0.815 1.00 0.37 H new ATOM 0 HB3 SER A 75 -14.109 -15.897 -1.102 1.00 0.37 H new ATOM 0 HG SER A 75 -13.331 -16.844 -3.085 1.00 0.42 H new ATOM 920 N LYS A 76 -10.304 -15.257 -1.945 1.00 0.27 N ATOM 921 CA LYS A 76 -8.911 -15.461 -2.430 1.00 0.27 C ATOM 922 C LYS A 76 -7.957 -14.535 -1.673 1.00 0.26 C ATOM 923 O LYS A 76 -6.902 -14.949 -1.232 1.00 0.30 O ATOM 924 CB LYS A 76 -8.950 -15.098 -3.913 1.00 0.32 C ATOM 925 CG LYS A 76 -7.861 -15.873 -4.658 1.00 0.32 C ATOM 926 CD LYS A 76 -8.156 -17.375 -4.592 1.00 0.41 C ATOM 927 CE LYS A 76 -7.109 -18.066 -3.713 1.00 0.40 C ATOM 928 NZ LYS A 76 -5.859 -18.055 -4.523 1.00 0.40 N ATOM 0 H LYS A 76 -10.906 -14.723 -2.572 1.00 0.27 H new ATOM 0 HA LYS A 76 -8.560 -16.481 -2.273 1.00 0.27 H new ATOM 0 HB2 LYS A 76 -9.929 -15.334 -4.330 1.00 0.32 H new ATOM 0 HB3 LYS A 76 -8.799 -14.026 -4.040 1.00 0.32 H new ATOM 0 HG2 LYS A 76 -7.816 -15.547 -5.697 1.00 0.32 H new ATOM 0 HG3 LYS A 76 -6.887 -15.665 -4.216 1.00 0.32 H new ATOM 0 HD2 LYS A 76 -9.154 -17.542 -4.186 1.00 0.41 H new ATOM 0 HD3 LYS A 76 -8.143 -17.803 -5.594 1.00 0.41 H new ATOM 0 HE2 LYS A 76 -6.973 -17.536 -2.770 1.00 0.40 H new ATOM 0 HE3 LYS A 76 -7.411 -19.084 -3.466 1.00 0.40 H new ATOM 0 HZ1 LYS A 76 -5.371 -18.967 -4.420 1.00 0.40 H new ATOM 0 HZ2 LYS A 76 -6.095 -17.900 -5.524 1.00 0.40 H new ATOM 0 HZ3 LYS A 76 -5.237 -17.290 -4.191 1.00 0.40 H new ATOM 942 N ALA A 77 -8.326 -13.287 -1.514 1.00 0.27 N ATOM 943 CA ALA A 77 -7.446 -12.327 -0.778 1.00 0.27 C ATOM 944 C ALA A 77 -7.219 -12.818 0.652 1.00 0.24 C ATOM 945 O ALA A 77 -6.095 -12.958 1.097 1.00 0.29 O ATOM 946 CB ALA A 77 -8.209 -11.002 -0.767 1.00 0.30 C ATOM 0 H ALA A 77 -9.199 -12.892 -1.863 1.00 0.27 H new ATOM 0 HA ALA A 77 -6.467 -12.227 -1.248 1.00 0.27 H new ATOM 0 HB1 ALA A 77 -7.622 -10.248 -0.242 1.00 0.30 H new ATOM 0 HB2 ALA A 77 -8.386 -10.675 -1.792 1.00 0.30 H new ATOM 0 HB3 ALA A 77 -9.164 -11.136 -0.259 1.00 0.30 H new ATOM 952 N ILE A 78 -8.281 -13.081 1.372 1.00 0.24 N ATOM 953 CA ILE A 78 -8.133 -13.565 2.776 1.00 0.24 C ATOM 954 C ILE A 78 -7.343 -14.879 2.795 1.00 0.25 C ATOM 955 O ILE A 78 -6.460 -15.063 3.613 1.00 0.29 O ATOM 956 CB ILE A 78 -9.564 -13.762 3.284 1.00 0.27 C ATOM 957 CG1 ILE A 78 -10.287 -12.408 3.283 1.00 0.28 C ATOM 958 CG2 ILE A 78 -9.533 -14.321 4.708 1.00 0.32 C ATOM 959 CD1 ILE A 78 -11.795 -12.622 3.129 1.00 0.36 C ATOM 0 H ILE A 78 -9.243 -12.981 1.047 1.00 0.24 H new ATOM 0 HA ILE A 78 -7.585 -12.866 3.407 1.00 0.24 H new ATOM 0 HB ILE A 78 -10.089 -14.463 2.635 1.00 0.27 H new ATOM 0 HG12 ILE A 78 -10.080 -11.875 4.211 1.00 0.28 H new ATOM 0 HG13 ILE A 78 -9.914 -11.787 2.468 1.00 0.28 H new ATOM 0 HG21 ILE A 78 -10.553 -14.460 5.067 1.00 0.32 H new ATOM 0 HG22 ILE A 78 -9.013 -15.279 4.712 1.00 0.32 H new ATOM 0 HG23 ILE A 78 -9.011 -13.623 5.362 1.00 0.32 H new ATOM 0 HD11 ILE A 78 -12.301 -11.657 3.129 1.00 0.36 H new ATOM 0 HD12 ILE A 78 -11.995 -13.137 2.189 1.00 0.36 H new ATOM 0 HD13 ILE A 78 -12.164 -13.225 3.959 1.00 0.36 H new ATOM 971 N ASN A 79 -7.631 -15.784 1.888 1.00 0.25 N ATOM 972 CA ASN A 79 -6.864 -17.068 1.851 1.00 0.27 C ATOM 973 C ASN A 79 -5.403 -16.757 1.538 1.00 0.27 C ATOM 974 O ASN A 79 -4.497 -17.338 2.105 1.00 0.31 O ATOM 975 CB ASN A 79 -7.486 -17.897 0.727 1.00 0.29 C ATOM 976 CG ASN A 79 -8.523 -18.858 1.314 1.00 0.33 C ATOM 977 OD1 ASN A 79 -8.206 -19.663 2.167 1.00 0.42 O ATOM 978 ND2 ASN A 79 -9.756 -18.808 0.892 1.00 0.38 N ATOM 0 H ASN A 79 -8.358 -15.689 1.178 1.00 0.25 H new ATOM 0 HA ASN A 79 -6.903 -17.606 2.798 1.00 0.27 H new ATOM 0 HB2 ASN A 79 -7.956 -17.241 -0.005 1.00 0.29 H new ATOM 0 HB3 ASN A 79 -6.712 -18.457 0.203 1.00 0.29 H new ATOM 0 HD21 ASN A 79 -10.453 -19.444 1.278 1.00 0.38 H new ATOM 0 HD22 ASN A 79 -10.023 -18.132 0.176 1.00 0.38 H new ATOM 985 N VAL A 80 -5.177 -15.820 0.650 1.00 0.26 N ATOM 986 CA VAL A 80 -3.780 -15.431 0.299 1.00 0.28 C ATOM 987 C VAL A 80 -3.072 -14.952 1.566 1.00 0.27 C ATOM 988 O VAL A 80 -1.985 -15.395 1.887 1.00 0.30 O ATOM 989 CB VAL A 80 -3.932 -14.294 -0.726 1.00 0.31 C ATOM 990 CG1 VAL A 80 -2.960 -13.151 -0.414 1.00 0.34 C ATOM 991 CG2 VAL A 80 -3.640 -14.834 -2.128 1.00 0.45 C ATOM 0 H VAL A 80 -5.905 -15.307 0.152 1.00 0.26 H new ATOM 0 HA VAL A 80 -3.189 -16.249 -0.112 1.00 0.28 H new ATOM 0 HB VAL A 80 -4.952 -13.912 -0.675 1.00 0.31 H new ATOM 0 HG11 VAL A 80 -3.084 -12.357 -1.151 1.00 0.34 H new ATOM 0 HG12 VAL A 80 -3.168 -12.758 0.581 1.00 0.34 H new ATOM 0 HG13 VAL A 80 -1.936 -13.524 -0.451 1.00 0.34 H new ATOM 0 HG21 VAL A 80 -3.747 -14.031 -2.857 1.00 0.45 H new ATOM 0 HG22 VAL A 80 -2.622 -15.223 -2.163 1.00 0.45 H new ATOM 0 HG23 VAL A 80 -4.342 -15.633 -2.364 1.00 0.45 H new ATOM 1001 N LEU A 81 -3.697 -14.058 2.293 1.00 0.28 N ATOM 1002 CA LEU A 81 -3.085 -13.546 3.554 1.00 0.30 C ATOM 1003 C LEU A 81 -2.781 -14.718 4.487 1.00 0.30 C ATOM 1004 O LEU A 81 -1.805 -14.711 5.215 1.00 0.33 O ATOM 1005 CB LEU A 81 -4.139 -12.626 4.165 1.00 0.35 C ATOM 1006 CG LEU A 81 -3.633 -11.188 4.127 1.00 0.42 C ATOM 1007 CD1 LEU A 81 -4.009 -10.551 2.789 1.00 0.78 C ATOM 1008 CD2 LEU A 81 -4.276 -10.401 5.264 1.00 0.51 C ATOM 0 H LEU A 81 -4.608 -13.661 2.064 1.00 0.28 H new ATOM 0 HA LEU A 81 -2.147 -13.018 3.382 1.00 0.30 H new ATOM 0 HB2 LEU A 81 -5.075 -12.709 3.613 1.00 0.35 H new ATOM 0 HB3 LEU A 81 -4.347 -12.924 5.193 1.00 0.35 H new ATOM 0 HG LEU A 81 -2.549 -11.177 4.241 1.00 0.42 H new ATOM 0 HD11 LEU A 81 -3.648 -9.523 2.761 1.00 0.78 H new ATOM 0 HD12 LEU A 81 -3.555 -11.117 1.976 1.00 0.78 H new ATOM 0 HD13 LEU A 81 -5.093 -10.558 2.675 1.00 0.78 H new ATOM 0 HD21 LEU A 81 -3.918 -9.372 5.242 1.00 0.51 H new ATOM 0 HD22 LEU A 81 -5.360 -10.411 5.146 1.00 0.51 H new ATOM 0 HD23 LEU A 81 -4.011 -10.857 6.218 1.00 0.51 H new ATOM 1020 N ARG A 82 -3.600 -15.737 4.450 1.00 0.30 N ATOM 1021 CA ARG A 82 -3.341 -16.923 5.310 1.00 0.32 C ATOM 1022 C ARG A 82 -2.044 -17.578 4.838 1.00 0.29 C ATOM 1023 O ARG A 82 -1.247 -18.059 5.624 1.00 0.32 O ATOM 1024 CB ARG A 82 -4.535 -17.854 5.091 1.00 0.35 C ATOM 1025 CG ARG A 82 -4.757 -18.707 6.344 1.00 0.38 C ATOM 1026 CD ARG A 82 -5.879 -18.097 7.188 1.00 0.38 C ATOM 1027 NE ARG A 82 -7.060 -18.972 6.948 1.00 0.44 N ATOM 1028 CZ ARG A 82 -7.708 -18.898 5.817 1.00 0.45 C ATOM 1029 NH1 ARG A 82 -8.633 -17.992 5.654 1.00 0.56 N ATOM 1030 NH2 ARG A 82 -7.430 -19.729 4.851 1.00 0.54 N ATOM 0 H ARG A 82 -4.432 -15.797 3.863 1.00 0.30 H new ATOM 0 HA ARG A 82 -3.233 -16.677 6.366 1.00 0.32 H new ATOM 0 HB2 ARG A 82 -5.429 -17.270 4.873 1.00 0.35 H new ATOM 0 HB3 ARG A 82 -4.355 -18.496 4.229 1.00 0.35 H new ATOM 0 HG2 ARG A 82 -5.015 -19.727 6.061 1.00 0.38 H new ATOM 0 HG3 ARG A 82 -3.838 -18.761 6.927 1.00 0.38 H new ATOM 0 HD2 ARG A 82 -5.611 -18.076 8.244 1.00 0.38 H new ATOM 0 HD3 ARG A 82 -6.083 -17.068 6.890 1.00 0.38 H new ATOM 0 HE ARG A 82 -7.363 -19.629 7.667 1.00 0.44 H new ATOM 0 HH11 ARG A 82 -8.849 -17.342 6.410 1.00 0.56 H new ATOM 0 HH12 ARG A 82 -9.140 -17.934 4.771 1.00 0.56 H new ATOM 0 HH21 ARG A 82 -6.707 -20.436 4.979 1.00 0.54 H new ATOM 0 HH22 ARG A 82 -7.936 -19.671 3.967 1.00 0.54 H new ATOM 1044 N GLY A 83 -1.824 -17.569 3.545 1.00 0.28 N ATOM 1045 CA GLY A 83 -0.576 -18.156 2.983 1.00 0.30 C ATOM 1046 C GLY A 83 0.591 -17.231 3.326 1.00 0.27 C ATOM 1047 O GLY A 83 1.708 -17.673 3.513 1.00 0.31 O ATOM 0 H GLY A 83 -2.463 -17.176 2.854 1.00 0.28 H new ATOM 0 HA2 GLY A 83 -0.405 -19.150 3.396 1.00 0.30 H new ATOM 0 HA3 GLY A 83 -0.664 -18.270 1.903 1.00 0.30 H new ATOM 1051 N PHE A 84 0.331 -15.947 3.429 1.00 0.30 N ATOM 1052 CA PHE A 84 1.416 -14.986 3.786 1.00 0.31 C ATOM 1053 C PHE A 84 1.973 -15.370 5.154 1.00 0.29 C ATOM 1054 O PHE A 84 3.170 -15.451 5.349 1.00 0.31 O ATOM 1055 CB PHE A 84 0.743 -13.611 3.847 1.00 0.36 C ATOM 1056 CG PHE A 84 1.065 -12.821 2.609 1.00 0.40 C ATOM 1057 CD1 PHE A 84 0.358 -13.060 1.427 1.00 0.65 C ATOM 1058 CD2 PHE A 84 2.058 -11.837 2.649 1.00 0.64 C ATOM 1059 CE1 PHE A 84 0.646 -12.317 0.282 1.00 0.72 C ATOM 1060 CE2 PHE A 84 2.343 -11.091 1.504 1.00 0.79 C ATOM 1061 CZ PHE A 84 1.637 -11.333 0.321 1.00 0.69 C ATOM 0 H PHE A 84 -0.587 -15.527 3.281 1.00 0.30 H new ATOM 0 HA PHE A 84 2.238 -14.988 3.071 1.00 0.31 H new ATOM 0 HB2 PHE A 84 -0.336 -13.730 3.941 1.00 0.36 H new ATOM 0 HB3 PHE A 84 1.082 -13.071 4.731 1.00 0.36 H new ATOM 0 HD1 PHE A 84 -0.410 -13.819 1.400 1.00 0.65 H new ATOM 0 HD2 PHE A 84 2.603 -11.655 3.563 1.00 0.64 H new ATOM 0 HE1 PHE A 84 0.104 -12.502 -0.633 1.00 0.72 H new ATOM 0 HE2 PHE A 84 3.107 -10.328 1.532 1.00 0.79 H new ATOM 0 HZ PHE A 84 1.859 -10.757 -0.565 1.00 0.69 H new ATOM 1071 N ARG A 85 1.099 -15.628 6.096 1.00 0.30 N ATOM 1072 CA ARG A 85 1.554 -16.034 7.458 1.00 0.30 C ATOM 1073 C ARG A 85 2.320 -17.354 7.359 1.00 0.27 C ATOM 1074 O ARG A 85 3.399 -17.497 7.901 1.00 0.31 O ATOM 1075 CB ARG A 85 0.273 -16.214 8.273 1.00 0.38 C ATOM 1076 CG ARG A 85 0.576 -15.996 9.756 1.00 0.46 C ATOM 1077 CD ARG A 85 0.862 -17.344 10.423 1.00 0.68 C ATOM 1078 NE ARG A 85 1.260 -17.006 11.817 1.00 0.79 N ATOM 1079 CZ ARG A 85 1.923 -17.871 12.535 1.00 1.26 C ATOM 1080 NH1 ARG A 85 3.222 -17.942 12.437 1.00 1.69 N ATOM 1081 NH2 ARG A 85 1.285 -18.666 13.350 1.00 1.75 N ATOM 0 H ARG A 85 0.087 -15.574 5.978 1.00 0.30 H new ATOM 0 HA ARG A 85 2.218 -15.301 7.917 1.00 0.30 H new ATOM 0 HB2 ARG A 85 -0.486 -15.507 7.938 1.00 0.38 H new ATOM 0 HB3 ARG A 85 -0.132 -17.214 8.117 1.00 0.38 H new ATOM 0 HG2 ARG A 85 1.434 -15.333 9.869 1.00 0.46 H new ATOM 0 HG3 ARG A 85 -0.269 -15.509 10.243 1.00 0.46 H new ATOM 0 HD2 ARG A 85 -0.018 -17.986 10.408 1.00 0.68 H new ATOM 0 HD3 ARG A 85 1.657 -17.880 9.904 1.00 0.68 H new ATOM 0 HE ARG A 85 1.014 -16.098 12.211 1.00 0.79 H new ATOM 0 HH11 ARG A 85 3.720 -17.321 11.799 1.00 1.69 H new ATOM 0 HH12 ARG A 85 3.740 -18.618 12.998 1.00 1.69 H new ATOM 0 HH21 ARG A 85 0.269 -18.611 13.425 1.00 1.75 H new ATOM 0 HH22 ARG A 85 1.802 -19.342 13.912 1.00 1.75 H new ATOM 1095 N LYS A 86 1.773 -18.314 6.654 1.00 0.28 N ATOM 1096 CA LYS A 86 2.475 -19.624 6.498 1.00 0.30 C ATOM 1097 C LYS A 86 3.826 -19.392 5.818 1.00 0.28 C ATOM 1098 O LYS A 86 4.813 -20.030 6.137 1.00 0.34 O ATOM 1099 CB LYS A 86 1.559 -20.471 5.609 1.00 0.36 C ATOM 1100 CG LYS A 86 0.956 -21.613 6.432 1.00 0.48 C ATOM 1101 CD LYS A 86 -0.277 -21.106 7.181 1.00 0.51 C ATOM 1102 CE LYS A 86 0.165 -20.285 8.394 1.00 0.47 C ATOM 1103 NZ LYS A 86 -0.855 -20.569 9.442 1.00 0.63 N ATOM 0 H LYS A 86 0.872 -18.246 6.181 1.00 0.28 H new ATOM 0 HA LYS A 86 2.666 -20.116 7.451 1.00 0.30 H new ATOM 0 HB2 LYS A 86 0.765 -19.851 5.193 1.00 0.36 H new ATOM 0 HB3 LYS A 86 2.123 -20.874 4.768 1.00 0.36 H new ATOM 0 HG2 LYS A 86 0.683 -22.441 5.779 1.00 0.48 H new ATOM 0 HG3 LYS A 86 1.693 -21.994 7.139 1.00 0.48 H new ATOM 0 HD2 LYS A 86 -0.892 -20.495 6.520 1.00 0.51 H new ATOM 0 HD3 LYS A 86 -0.892 -21.947 7.502 1.00 0.51 H new ATOM 0 HE2 LYS A 86 1.162 -20.575 8.725 1.00 0.47 H new ATOM 0 HE3 LYS A 86 0.204 -19.221 8.158 1.00 0.47 H new ATOM 0 HZ1 LYS A 86 -0.593 -20.081 10.322 1.00 0.63 H new ATOM 0 HZ2 LYS A 86 -1.785 -20.231 9.122 1.00 0.63 H new ATOM 0 HZ3 LYS A 86 -0.900 -21.594 9.614 1.00 0.63 H new ATOM 1117 N GLU A 87 3.872 -18.468 4.891 1.00 0.26 N ATOM 1118 CA GLU A 87 5.152 -18.164 4.185 1.00 0.26 C ATOM 1119 C GLU A 87 6.099 -17.433 5.138 1.00 0.25 C ATOM 1120 O GLU A 87 7.293 -17.663 5.139 1.00 0.29 O ATOM 1121 CB GLU A 87 4.758 -17.260 3.016 1.00 0.30 C ATOM 1122 CG GLU A 87 4.194 -18.111 1.875 1.00 0.38 C ATOM 1123 CD GLU A 87 5.280 -18.342 0.821 1.00 0.78 C ATOM 1124 OE1 GLU A 87 5.450 -17.479 -0.024 1.00 1.07 O ATOM 1125 OE2 GLU A 87 5.921 -19.378 0.878 1.00 1.29 O ATOM 0 H GLU A 87 3.073 -17.909 4.592 1.00 0.26 H new ATOM 0 HA GLU A 87 5.666 -19.062 3.841 1.00 0.26 H new ATOM 0 HB2 GLU A 87 4.015 -16.531 3.341 1.00 0.30 H new ATOM 0 HB3 GLU A 87 5.625 -16.698 2.669 1.00 0.30 H new ATOM 0 HG2 GLU A 87 3.839 -19.066 2.262 1.00 0.38 H new ATOM 0 HG3 GLU A 87 3.336 -17.611 1.425 1.00 0.38 H new ATOM 1132 N ILE A 88 5.567 -16.559 5.957 1.00 0.26 N ATOM 1133 CA ILE A 88 6.426 -15.817 6.925 1.00 0.26 C ATOM 1134 C ILE A 88 6.964 -16.803 7.972 1.00 0.25 C ATOM 1135 O ILE A 88 8.123 -16.758 8.347 1.00 0.26 O ATOM 1136 CB ILE A 88 5.503 -14.734 7.527 1.00 0.29 C ATOM 1137 CG1 ILE A 88 6.235 -13.389 7.520 1.00 0.33 C ATOM 1138 CG2 ILE A 88 5.086 -15.073 8.964 1.00 0.31 C ATOM 1139 CD1 ILE A 88 5.818 -12.590 6.284 1.00 0.57 C ATOM 0 H ILE A 88 4.574 -16.329 5.995 1.00 0.26 H new ATOM 0 HA ILE A 88 7.302 -15.350 6.475 1.00 0.26 H new ATOM 0 HB ILE A 88 4.600 -14.685 6.918 1.00 0.29 H new ATOM 0 HG12 ILE A 88 5.999 -12.829 8.425 1.00 0.33 H new ATOM 0 HG13 ILE A 88 7.313 -13.549 7.516 1.00 0.33 H new ATOM 0 HG21 ILE A 88 4.438 -14.286 9.350 1.00 0.31 H new ATOM 0 HG22 ILE A 88 4.550 -16.022 8.973 1.00 0.31 H new ATOM 0 HG23 ILE A 88 5.974 -15.152 9.591 1.00 0.31 H new ATOM 0 HD11 ILE A 88 6.338 -11.632 6.277 1.00 0.57 H new ATOM 0 HD12 ILE A 88 6.076 -13.149 5.385 1.00 0.57 H new ATOM 0 HD13 ILE A 88 4.742 -12.418 6.308 1.00 0.57 H new ATOM 1151 N GLY A 89 6.135 -17.719 8.414 1.00 0.27 N ATOM 1152 CA GLY A 89 6.597 -18.733 9.405 1.00 0.30 C ATOM 1153 C GLY A 89 7.688 -19.569 8.743 1.00 0.30 C ATOM 1154 O GLY A 89 8.651 -19.974 9.369 1.00 0.32 O ATOM 0 H GLY A 89 5.159 -17.805 8.129 1.00 0.27 H new ATOM 0 HA2 GLY A 89 6.981 -18.245 10.301 1.00 0.30 H new ATOM 0 HA3 GLY A 89 5.767 -19.367 9.718 1.00 0.30 H new ATOM 1158 N ARG A 90 7.546 -19.806 7.464 1.00 0.30 N ATOM 1159 CA ARG A 90 8.574 -20.589 6.728 1.00 0.31 C ATOM 1160 C ARG A 90 9.855 -19.764 6.637 1.00 0.28 C ATOM 1161 O ARG A 90 10.949 -20.292 6.721 1.00 0.31 O ATOM 1162 CB ARG A 90 7.991 -20.812 5.333 1.00 0.36 C ATOM 1163 CG ARG A 90 7.180 -22.106 5.312 1.00 0.45 C ATOM 1164 CD ARG A 90 6.523 -22.261 3.941 1.00 0.57 C ATOM 1165 NE ARG A 90 5.270 -23.028 4.195 1.00 0.90 N ATOM 1166 CZ ARG A 90 4.559 -23.467 3.193 1.00 0.60 C ATOM 1167 NH1 ARG A 90 3.685 -22.685 2.622 1.00 0.95 N ATOM 1168 NH2 ARG A 90 4.724 -24.687 2.762 1.00 1.03 N ATOM 0 H ARG A 90 6.758 -19.488 6.899 1.00 0.30 H new ATOM 0 HA ARG A 90 8.813 -21.533 7.217 1.00 0.31 H new ATOM 0 HB2 ARG A 90 7.357 -19.970 5.055 1.00 0.36 H new ATOM 0 HB3 ARG A 90 8.794 -20.863 4.597 1.00 0.36 H new ATOM 0 HG2 ARG A 90 7.827 -22.959 5.518 1.00 0.45 H new ATOM 0 HG3 ARG A 90 6.420 -22.087 6.093 1.00 0.45 H new ATOM 0 HD2 ARG A 90 6.307 -21.290 3.495 1.00 0.57 H new ATOM 0 HD3 ARG A 90 7.176 -22.792 3.248 1.00 0.57 H new ATOM 0 HE ARG A 90 4.969 -23.210 5.152 1.00 0.90 H new ATOM 0 HH11 ARG A 90 3.558 -21.731 2.959 1.00 0.95 H new ATOM 0 HH12 ARG A 90 3.129 -23.028 1.839 1.00 0.95 H new ATOM 0 HH21 ARG A 90 5.409 -25.297 3.208 1.00 1.03 H new ATOM 0 HH22 ARG A 90 4.168 -25.031 1.979 1.00 1.03 H new ATOM 1182 N MET A 91 9.718 -18.462 6.490 1.00 0.26 N ATOM 1183 CA MET A 91 10.919 -17.580 6.411 1.00 0.25 C ATOM 1184 C MET A 91 11.737 -17.780 7.675 1.00 0.23 C ATOM 1185 O MET A 91 12.950 -17.862 7.645 1.00 0.25 O ATOM 1186 CB MET A 91 10.375 -16.150 6.328 1.00 0.27 C ATOM 1187 CG MET A 91 11.066 -15.408 5.182 1.00 0.42 C ATOM 1188 SD MET A 91 10.434 -13.714 5.090 1.00 0.55 S ATOM 1189 CE MET A 91 9.055 -14.046 3.966 1.00 0.97 C ATOM 0 H MET A 91 8.823 -17.978 6.422 1.00 0.26 H new ATOM 0 HA MET A 91 11.559 -17.797 5.555 1.00 0.25 H new ATOM 0 HB2 MET A 91 9.297 -16.168 6.166 1.00 0.27 H new ATOM 0 HB3 MET A 91 10.547 -15.629 7.270 1.00 0.27 H new ATOM 0 HG2 MET A 91 12.144 -15.397 5.340 1.00 0.42 H new ATOM 0 HG3 MET A 91 10.887 -15.926 4.240 1.00 0.42 H new ATOM 0 HE1 MET A 91 9.263 -13.600 2.993 1.00 0.97 H new ATOM 0 HE2 MET A 91 8.930 -15.123 3.852 1.00 0.97 H new ATOM 0 HE3 MET A 91 8.141 -13.616 4.375 1.00 0.97 H new ATOM 1199 N LEU A 92 11.060 -17.894 8.785 1.00 0.24 N ATOM 1200 CA LEU A 92 11.763 -18.131 10.072 1.00 0.26 C ATOM 1201 C LEU A 92 12.454 -19.479 10.006 1.00 0.28 C ATOM 1202 O LEU A 92 13.603 -19.614 10.386 1.00 0.31 O ATOM 1203 CB LEU A 92 10.668 -18.104 11.120 1.00 0.29 C ATOM 1204 CG LEU A 92 10.075 -16.703 11.120 1.00 0.30 C ATOM 1205 CD1 LEU A 92 8.592 -16.762 11.500 1.00 0.38 C ATOM 1206 CD2 LEU A 92 10.833 -15.827 12.122 1.00 0.35 C ATOM 0 H LEU A 92 10.044 -17.832 8.853 1.00 0.24 H new ATOM 0 HA LEU A 92 12.531 -17.392 10.299 1.00 0.26 H new ATOM 0 HB2 LEU A 92 9.902 -18.845 10.894 1.00 0.29 H new ATOM 0 HB3 LEU A 92 11.070 -18.351 12.102 1.00 0.29 H new ATOM 0 HG LEU A 92 10.167 -16.274 10.122 1.00 0.30 H new ATOM 0 HD11 LEU A 92 8.175 -15.755 11.498 1.00 0.38 H new ATOM 0 HD12 LEU A 92 8.056 -17.378 10.778 1.00 0.38 H new ATOM 0 HD13 LEU A 92 8.488 -17.195 12.495 1.00 0.38 H new ATOM 0 HD21 LEU A 92 10.408 -14.823 12.122 1.00 0.35 H new ATOM 0 HD22 LEU A 92 10.747 -16.257 13.120 1.00 0.35 H new ATOM 0 HD23 LEU A 92 11.884 -15.776 11.838 1.00 0.35 H new ATOM 1218 N ASN A 93 11.776 -20.470 9.474 1.00 0.30 N ATOM 1219 CA ASN A 93 12.413 -21.808 9.323 1.00 0.34 C ATOM 1220 C ASN A 93 13.722 -21.622 8.553 1.00 0.34 C ATOM 1221 O ASN A 93 14.659 -22.384 8.698 1.00 0.40 O ATOM 1222 CB ASN A 93 11.419 -22.648 8.514 1.00 0.40 C ATOM 1223 CG ASN A 93 11.233 -24.011 9.184 1.00 0.75 C ATOM 1224 OD1 ASN A 93 12.080 -24.876 9.074 1.00 1.21 O ATOM 1225 ND2 ASN A 93 10.152 -24.241 9.878 1.00 1.07 N ATOM 0 H ASN A 93 10.814 -20.406 9.141 1.00 0.30 H new ATOM 0 HA ASN A 93 12.639 -22.290 10.274 1.00 0.34 H new ATOM 0 HB2 ASN A 93 10.462 -22.131 8.446 1.00 0.40 H new ATOM 0 HB3 ASN A 93 11.783 -22.779 7.495 1.00 0.40 H new ATOM 0 HD21 ASN A 93 10.018 -25.146 10.328 1.00 1.07 H new ATOM 0 HD22 ASN A 93 9.441 -23.515 9.970 1.00 1.07 H new ATOM 1232 N ILE A 94 13.787 -20.582 7.748 1.00 0.31 N ATOM 1233 CA ILE A 94 15.033 -20.305 6.977 1.00 0.35 C ATOM 1234 C ILE A 94 16.020 -19.512 7.841 1.00 0.33 C ATOM 1235 O ILE A 94 17.212 -19.756 7.791 1.00 0.38 O ATOM 1236 CB ILE A 94 14.626 -19.468 5.754 1.00 0.38 C ATOM 1237 CG1 ILE A 94 13.279 -19.959 5.199 1.00 0.41 C ATOM 1238 CG2 ILE A 94 15.715 -19.591 4.682 1.00 0.46 C ATOM 1239 CD1 ILE A 94 13.220 -19.793 3.675 1.00 0.59 C ATOM 0 H ILE A 94 13.028 -19.918 7.596 1.00 0.31 H new ATOM 0 HA ILE A 94 15.517 -21.234 6.675 1.00 0.35 H new ATOM 0 HB ILE A 94 14.517 -18.424 6.047 1.00 0.38 H new ATOM 0 HG12 ILE A 94 13.134 -21.007 5.460 1.00 0.41 H new ATOM 0 HG13 ILE A 94 12.465 -19.400 5.661 1.00 0.41 H new ATOM 0 HG21 ILE A 94 15.435 -19.000 3.810 1.00 0.46 H new ATOM 0 HG22 ILE A 94 16.661 -19.224 5.080 1.00 0.46 H new ATOM 0 HG23 ILE A 94 15.824 -20.636 4.393 1.00 0.46 H new ATOM 0 HD11 ILE A 94 12.257 -20.148 3.307 1.00 0.59 H new ATOM 0 HD12 ILE A 94 13.341 -18.740 3.419 1.00 0.59 H new ATOM 0 HD13 ILE A 94 14.020 -20.373 3.215 1.00 0.59 H new ATOM 1251 N LEU A 95 15.555 -18.553 8.623 1.00 0.31 N ATOM 1252 CA LEU A 95 16.526 -17.766 9.452 1.00 0.34 C ATOM 1253 C LEU A 95 16.681 -18.368 10.856 1.00 0.37 C ATOM 1254 O LEU A 95 17.235 -17.746 11.743 1.00 0.47 O ATOM 1255 CB LEU A 95 15.979 -16.336 9.515 1.00 0.32 C ATOM 1256 CG LEU A 95 14.573 -16.330 10.106 1.00 0.31 C ATOM 1257 CD1 LEU A 95 14.608 -15.724 11.510 1.00 0.40 C ATOM 1258 CD2 LEU A 95 13.656 -15.490 9.210 1.00 0.32 C ATOM 0 H LEU A 95 14.574 -18.291 8.719 1.00 0.31 H new ATOM 0 HA LEU A 95 17.521 -17.784 9.008 1.00 0.34 H new ATOM 0 HB2 LEU A 95 16.638 -15.714 10.121 1.00 0.32 H new ATOM 0 HB3 LEU A 95 15.962 -15.902 8.515 1.00 0.32 H new ATOM 0 HG LEU A 95 14.197 -17.351 10.165 1.00 0.31 H new ATOM 0 HD11 LEU A 95 13.602 -15.721 11.930 1.00 0.40 H new ATOM 0 HD12 LEU A 95 15.265 -16.317 12.146 1.00 0.40 H new ATOM 0 HD13 LEU A 95 14.982 -14.702 11.456 1.00 0.40 H new ATOM 0 HD21 LEU A 95 12.649 -15.481 9.627 1.00 0.32 H new ATOM 0 HD22 LEU A 95 14.035 -14.470 9.156 1.00 0.32 H new ATOM 0 HD23 LEU A 95 13.631 -15.921 8.209 1.00 0.32 H new ATOM 1270 N ASN A 96 16.223 -19.581 11.054 1.00 0.33 N ATOM 1271 CA ASN A 96 16.372 -20.238 12.392 1.00 0.40 C ATOM 1272 C ASN A 96 17.270 -21.476 12.273 1.00 0.43 C ATOM 1273 O ASN A 96 17.500 -22.180 13.238 1.00 0.50 O ATOM 1274 CB ASN A 96 14.959 -20.646 12.807 1.00 0.41 C ATOM 1275 CG ASN A 96 14.233 -19.436 13.396 1.00 0.50 C ATOM 1276 OD1 ASN A 96 12.994 -19.210 13.066 1.00 0.70 O flip ATOM 1277 ND2 ASN A 96 14.801 -18.688 14.167 1.00 0.49 N flip ATOM 0 H ASN A 96 15.752 -20.145 10.347 1.00 0.33 H new ATOM 0 HA ASN A 96 16.831 -19.573 13.124 1.00 0.40 H new ATOM 0 HB2 ASN A 96 14.411 -21.029 11.946 1.00 0.41 H new ATOM 0 HB3 ASN A 96 15.002 -21.451 13.541 1.00 0.41 H new ATOM 0 HD21 ASN A 96 15.772 -18.864 14.426 1.00 0.49 H new ATOM 0 HD22 ASN A 96 14.307 -17.884 14.555 1.00 0.49 H new ATOM 1738 N PRO B 43 11.443 0.353 12.331 1.00 0.37 N ATOM 1739 CA PRO B 43 10.727 -0.787 11.729 1.00 0.35 C ATOM 1740 C PRO B 43 11.718 -1.874 11.297 1.00 0.32 C ATOM 1741 O PRO B 43 11.556 -3.037 11.615 1.00 0.34 O ATOM 1742 CB PRO B 43 10.051 -0.166 10.514 1.00 0.40 C ATOM 1743 CG PRO B 43 10.880 1.031 10.151 1.00 0.43 C ATOM 1744 CD PRO B 43 11.764 1.373 11.328 1.00 0.42 C ATOM 0 HA PRO B 43 10.027 -1.267 12.412 1.00 0.35 H new ATOM 0 HB2 PRO B 43 10.005 -0.875 9.687 1.00 0.40 H new ATOM 0 HB3 PRO B 43 9.025 0.124 10.743 1.00 0.40 H new ATOM 0 HG2 PRO B 43 11.486 0.820 9.270 1.00 0.43 H new ATOM 0 HG3 PRO B 43 10.238 1.875 9.901 1.00 0.43 H new ATOM 0 HD2 PRO B 43 12.819 1.344 11.055 1.00 0.42 H new ATOM 0 HD3 PRO B 43 11.559 2.376 11.701 1.00 0.42 H new ATOM 1752 N LEU B 44 12.736 -1.496 10.563 1.00 0.31 N ATOM 1753 CA LEU B 44 13.748 -2.485 10.081 1.00 0.30 C ATOM 1754 C LEU B 44 13.070 -3.604 9.287 1.00 0.31 C ATOM 1755 O LEU B 44 13.621 -4.675 9.114 1.00 0.51 O ATOM 1756 CB LEU B 44 14.417 -3.048 11.334 1.00 0.33 C ATOM 1757 CG LEU B 44 15.740 -3.713 10.936 1.00 0.39 C ATOM 1758 CD1 LEU B 44 16.901 -3.022 11.655 1.00 0.47 C ATOM 1759 CD2 LEU B 44 15.710 -5.198 11.317 1.00 0.56 C ATOM 0 H LEU B 44 12.910 -0.533 10.275 1.00 0.31 H new ATOM 0 HA LEU B 44 14.475 -2.018 9.416 1.00 0.30 H new ATOM 0 HB2 LEU B 44 14.598 -2.251 12.055 1.00 0.33 H new ATOM 0 HB3 LEU B 44 13.762 -3.772 11.818 1.00 0.33 H new ATOM 0 HG LEU B 44 15.876 -3.621 9.858 1.00 0.39 H new ATOM 0 HD11 LEU B 44 17.840 -3.497 11.370 1.00 0.47 H new ATOM 0 HD12 LEU B 44 16.927 -1.969 11.375 1.00 0.47 H new ATOM 0 HD13 LEU B 44 16.764 -3.107 12.733 1.00 0.47 H new ATOM 0 HD21 LEU B 44 16.652 -5.666 11.032 1.00 0.56 H new ATOM 0 HD22 LEU B 44 15.568 -5.295 12.393 1.00 0.56 H new ATOM 0 HD23 LEU B 44 14.889 -5.691 10.797 1.00 0.56 H new ATOM 1771 N LYS B 45 11.886 -3.356 8.792 1.00 0.25 N ATOM 1772 CA LYS B 45 11.170 -4.394 7.993 1.00 0.25 C ATOM 1773 C LYS B 45 11.429 -4.162 6.504 1.00 0.24 C ATOM 1774 O LYS B 45 11.281 -5.056 5.699 1.00 0.26 O ATOM 1775 CB LYS B 45 9.684 -4.219 8.323 1.00 0.29 C ATOM 1776 CG LYS B 45 9.235 -2.791 7.997 1.00 0.35 C ATOM 1777 CD LYS B 45 7.799 -2.815 7.471 1.00 0.46 C ATOM 1778 CE LYS B 45 6.822 -2.874 8.649 1.00 0.49 C ATOM 1779 NZ LYS B 45 5.805 -1.824 8.362 1.00 0.33 N ATOM 0 H LYS B 45 11.382 -2.476 8.907 1.00 0.25 H new ATOM 0 HA LYS B 45 11.507 -5.404 8.227 1.00 0.25 H new ATOM 0 HB2 LYS B 45 9.091 -4.934 7.753 1.00 0.29 H new ATOM 0 HB3 LYS B 45 9.511 -4.431 9.378 1.00 0.29 H new ATOM 0 HG2 LYS B 45 9.297 -2.167 8.888 1.00 0.35 H new ATOM 0 HG3 LYS B 45 9.899 -2.351 7.253 1.00 0.35 H new ATOM 0 HD2 LYS B 45 7.606 -1.927 6.870 1.00 0.46 H new ATOM 0 HD3 LYS B 45 7.653 -3.678 6.821 1.00 0.46 H new ATOM 0 HE2 LYS B 45 6.361 -3.858 8.730 1.00 0.49 H new ATOM 0 HE3 LYS B 45 7.331 -2.682 9.594 1.00 0.49 H new ATOM 0 HZ1 LYS B 45 4.871 -2.148 8.684 1.00 0.33 H new ATOM 0 HZ2 LYS B 45 6.059 -0.949 8.863 1.00 0.33 H new ATOM 0 HZ3 LYS B 45 5.774 -1.641 7.339 1.00 0.33 H new ATOM 1793 N LEU B 46 11.820 -2.962 6.143 1.00 0.26 N ATOM 1794 CA LEU B 46 12.108 -2.638 4.709 1.00 0.28 C ATOM 1795 C LEU B 46 12.965 -3.739 4.066 1.00 0.26 C ATOM 1796 O LEU B 46 12.819 -4.049 2.896 1.00 0.28 O ATOM 1797 CB LEU B 46 12.887 -1.316 4.761 1.00 0.32 C ATOM 1798 CG LEU B 46 12.163 -0.250 3.932 1.00 0.47 C ATOM 1799 CD1 LEU B 46 11.460 0.737 4.868 1.00 0.66 C ATOM 1800 CD2 LEU B 46 13.180 0.506 3.073 1.00 0.58 C ATOM 0 H LEU B 46 11.953 -2.184 6.789 1.00 0.26 H new ATOM 0 HA LEU B 46 11.199 -2.563 4.113 1.00 0.28 H new ATOM 0 HB2 LEU B 46 12.984 -0.982 5.794 1.00 0.32 H new ATOM 0 HB3 LEU B 46 13.897 -1.464 4.377 1.00 0.32 H new ATOM 0 HG LEU B 46 11.426 -0.731 3.289 1.00 0.47 H new ATOM 0 HD11 LEU B 46 10.945 1.495 4.277 1.00 0.66 H new ATOM 0 HD12 LEU B 46 10.736 0.203 5.483 1.00 0.66 H new ATOM 0 HD13 LEU B 46 12.198 1.217 5.511 1.00 0.66 H new ATOM 0 HD21 LEU B 46 12.666 1.264 2.483 1.00 0.58 H new ATOM 0 HD22 LEU B 46 13.916 0.986 3.718 1.00 0.58 H new ATOM 0 HD23 LEU B 46 13.684 -0.193 2.405 1.00 0.58 H new ATOM 1812 N PHE B 47 13.842 -4.343 4.831 1.00 0.24 N ATOM 1813 CA PHE B 47 14.703 -5.430 4.283 1.00 0.24 C ATOM 1814 C PHE B 47 13.882 -6.713 4.188 1.00 0.22 C ATOM 1815 O PHE B 47 13.955 -7.444 3.218 1.00 0.24 O ATOM 1816 CB PHE B 47 15.848 -5.575 5.297 1.00 0.27 C ATOM 1817 CG PHE B 47 16.542 -6.908 5.117 1.00 0.25 C ATOM 1818 CD1 PHE B 47 16.934 -7.331 3.841 1.00 0.31 C ATOM 1819 CD2 PHE B 47 16.790 -7.722 6.230 1.00 0.29 C ATOM 1820 CE1 PHE B 47 17.573 -8.565 3.678 1.00 0.37 C ATOM 1821 CE2 PHE B 47 17.429 -8.957 6.066 1.00 0.35 C ATOM 1822 CZ PHE B 47 17.820 -9.378 4.790 1.00 0.38 C ATOM 0 H PHE B 47 13.997 -4.126 5.816 1.00 0.24 H new ATOM 0 HA PHE B 47 15.086 -5.217 3.285 1.00 0.24 H new ATOM 0 HB2 PHE B 47 16.564 -4.764 5.166 1.00 0.27 H new ATOM 0 HB3 PHE B 47 15.457 -5.495 6.311 1.00 0.27 H new ATOM 0 HD1 PHE B 47 16.743 -6.704 2.982 1.00 0.31 H new ATOM 0 HD2 PHE B 47 16.488 -7.397 7.215 1.00 0.29 H new ATOM 0 HE1 PHE B 47 17.876 -8.890 2.694 1.00 0.37 H new ATOM 0 HE2 PHE B 47 17.620 -9.584 6.924 1.00 0.35 H new ATOM 0 HZ PHE B 47 18.313 -10.331 4.663 1.00 0.38 H new ATOM 1832 N MET B 48 13.095 -6.977 5.194 1.00 0.22 N ATOM 1833 CA MET B 48 12.247 -8.199 5.188 1.00 0.23 C ATOM 1834 C MET B 48 11.178 -8.077 4.103 1.00 0.24 C ATOM 1835 O MET B 48 11.031 -8.944 3.269 1.00 0.31 O ATOM 1836 CB MET B 48 11.604 -8.240 6.577 1.00 0.28 C ATOM 1837 CG MET B 48 11.785 -9.632 7.182 1.00 0.43 C ATOM 1838 SD MET B 48 13.033 -9.576 8.492 1.00 0.56 S ATOM 1839 CE MET B 48 14.432 -9.124 7.440 1.00 0.47 C ATOM 0 H MET B 48 13.003 -6.393 6.025 1.00 0.22 H new ATOM 0 HA MET B 48 12.816 -9.105 4.980 1.00 0.23 H new ATOM 0 HB2 MET B 48 12.060 -7.489 7.223 1.00 0.28 H new ATOM 0 HB3 MET B 48 10.544 -7.998 6.506 1.00 0.28 H new ATOM 0 HG2 MET B 48 10.837 -9.989 7.585 1.00 0.43 H new ATOM 0 HG3 MET B 48 12.088 -10.338 6.409 1.00 0.43 H new ATOM 0 HE1 MET B 48 15.364 -9.356 7.955 1.00 0.47 H new ATOM 0 HE2 MET B 48 14.383 -9.686 6.508 1.00 0.47 H new ATOM 0 HE3 MET B 48 14.394 -8.057 7.222 1.00 0.47 H new ATOM 1849 N ALA B 49 10.437 -7.000 4.115 1.00 0.25 N ATOM 1850 CA ALA B 49 9.366 -6.795 3.094 1.00 0.28 C ATOM 1851 C ALA B 49 9.934 -6.912 1.676 1.00 0.28 C ATOM 1852 O ALA B 49 9.369 -7.582 0.832 1.00 0.33 O ATOM 1853 CB ALA B 49 8.850 -5.377 3.345 1.00 0.31 C ATOM 0 H ALA B 49 10.529 -6.246 4.796 1.00 0.25 H new ATOM 0 HA ALA B 49 8.578 -7.544 3.176 1.00 0.28 H new ATOM 0 HB1 ALA B 49 8.057 -5.147 2.633 1.00 0.31 H new ATOM 0 HB2 ALA B 49 8.458 -5.307 4.360 1.00 0.31 H new ATOM 0 HB3 ALA B 49 9.666 -4.665 3.221 1.00 0.31 H new ATOM 1859 N LEU B 50 11.039 -6.262 1.406 1.00 0.28 N ATOM 1860 CA LEU B 50 11.631 -6.335 0.035 1.00 0.32 C ATOM 1861 C LEU B 50 11.963 -7.786 -0.335 1.00 0.30 C ATOM 1862 O LEU B 50 11.449 -8.319 -1.304 1.00 0.33 O ATOM 1863 CB LEU B 50 12.904 -5.489 0.096 1.00 0.35 C ATOM 1864 CG LEU B 50 13.363 -5.153 -1.325 1.00 0.52 C ATOM 1865 CD1 LEU B 50 12.284 -4.329 -2.033 1.00 0.93 C ATOM 1866 CD2 LEU B 50 14.660 -4.344 -1.264 1.00 0.65 C ATOM 0 H LEU B 50 11.554 -5.687 2.072 1.00 0.28 H new ATOM 0 HA LEU B 50 10.939 -5.970 -0.724 1.00 0.32 H new ATOM 0 HB2 LEU B 50 12.718 -4.572 0.656 1.00 0.35 H new ATOM 0 HB3 LEU B 50 13.688 -6.031 0.624 1.00 0.35 H new ATOM 0 HG LEU B 50 13.534 -6.077 -1.877 1.00 0.52 H new ATOM 0 HD11 LEU B 50 12.613 -4.091 -3.044 1.00 0.93 H new ATOM 0 HD12 LEU B 50 11.359 -4.903 -2.078 1.00 0.93 H new ATOM 0 HD13 LEU B 50 12.111 -3.405 -1.481 1.00 0.93 H new ATOM 0 HD21 LEU B 50 14.987 -4.104 -2.276 1.00 0.65 H new ATOM 0 HD22 LEU B 50 14.487 -3.421 -0.710 1.00 0.65 H new ATOM 0 HD23 LEU B 50 15.431 -4.929 -0.762 1.00 0.65 H new ATOM 1878 N VAL B 51 12.820 -8.428 0.423 1.00 0.29 N ATOM 1879 CA VAL B 51 13.184 -9.836 0.108 1.00 0.31 C ATOM 1880 C VAL B 51 11.945 -10.736 0.188 1.00 0.30 C ATOM 1881 O VAL B 51 11.829 -11.695 -0.546 1.00 0.35 O ATOM 1882 CB VAL B 51 14.228 -10.222 1.159 1.00 0.35 C ATOM 1883 CG1 VAL B 51 14.640 -11.674 0.956 1.00 0.45 C ATOM 1884 CG2 VAL B 51 15.457 -9.322 1.007 1.00 0.48 C ATOM 0 H VAL B 51 13.280 -8.034 1.244 1.00 0.29 H new ATOM 0 HA VAL B 51 13.578 -9.950 -0.902 1.00 0.31 H new ATOM 0 HB VAL B 51 13.804 -10.099 2.155 1.00 0.35 H new ATOM 0 HG11 VAL B 51 15.383 -11.949 1.704 1.00 0.45 H new ATOM 0 HG12 VAL B 51 13.766 -12.318 1.058 1.00 0.45 H new ATOM 0 HG13 VAL B 51 15.065 -11.796 -0.040 1.00 0.45 H new ATOM 0 HG21 VAL B 51 16.202 -9.595 1.754 1.00 0.48 H new ATOM 0 HG22 VAL B 51 15.880 -9.448 0.010 1.00 0.48 H new ATOM 0 HG23 VAL B 51 15.166 -8.281 1.148 1.00 0.48 H new ATOM 1894 N ALA B 52 11.015 -10.429 1.062 1.00 0.29 N ATOM 1895 CA ALA B 52 9.780 -11.268 1.170 1.00 0.30 C ATOM 1896 C ALA B 52 8.972 -11.154 -0.123 1.00 0.29 C ATOM 1897 O ALA B 52 8.605 -12.147 -0.722 1.00 0.32 O ATOM 1898 CB ALA B 52 8.991 -10.697 2.350 1.00 0.33 C ATOM 0 H ALA B 52 11.058 -9.636 1.703 1.00 0.29 H new ATOM 0 HA ALA B 52 10.009 -12.323 1.323 1.00 0.30 H new ATOM 0 HB1 ALA B 52 8.072 -11.268 2.484 1.00 0.33 H new ATOM 0 HB2 ALA B 52 9.594 -10.762 3.256 1.00 0.33 H new ATOM 0 HB3 ALA B 52 8.744 -9.654 2.152 1.00 0.33 H new ATOM 1904 N PHE B 53 8.712 -9.945 -0.564 1.00 0.30 N ATOM 1905 CA PHE B 53 7.947 -9.745 -1.836 1.00 0.33 C ATOM 1906 C PHE B 53 8.584 -10.594 -2.938 1.00 0.33 C ATOM 1907 O PHE B 53 7.948 -11.450 -3.538 1.00 0.37 O ATOM 1908 CB PHE B 53 8.090 -8.249 -2.141 1.00 0.38 C ATOM 1909 CG PHE B 53 7.473 -7.930 -3.481 1.00 0.40 C ATOM 1910 CD1 PHE B 53 6.151 -8.300 -3.752 1.00 0.51 C ATOM 1911 CD2 PHE B 53 8.225 -7.259 -4.453 1.00 0.53 C ATOM 1912 CE1 PHE B 53 5.581 -8.001 -4.995 1.00 0.56 C ATOM 1913 CE2 PHE B 53 7.656 -6.960 -5.696 1.00 0.58 C ATOM 1914 CZ PHE B 53 6.334 -7.331 -5.967 1.00 0.52 C ATOM 0 H PHE B 53 8.998 -9.085 -0.095 1.00 0.30 H new ATOM 0 HA PHE B 53 6.900 -10.040 -1.764 1.00 0.33 H new ATOM 0 HB2 PHE B 53 7.605 -7.663 -1.360 1.00 0.38 H new ATOM 0 HB3 PHE B 53 9.144 -7.969 -2.141 1.00 0.38 H new ATOM 0 HD1 PHE B 53 5.570 -8.816 -3.002 1.00 0.51 H new ATOM 0 HD2 PHE B 53 9.245 -6.972 -4.243 1.00 0.53 H new ATOM 0 HE1 PHE B 53 4.561 -8.287 -5.204 1.00 0.56 H new ATOM 0 HE2 PHE B 53 8.237 -6.443 -6.446 1.00 0.58 H new ATOM 0 HZ PHE B 53 5.894 -7.100 -6.926 1.00 0.52 H new ATOM 1924 N LEU B 54 9.852 -10.387 -3.179 1.00 0.33 N ATOM 1925 CA LEU B 54 10.557 -11.195 -4.210 1.00 0.37 C ATOM 1926 C LEU B 54 10.472 -12.675 -3.826 1.00 0.36 C ATOM 1927 O LEU B 54 10.272 -13.530 -4.664 1.00 0.42 O ATOM 1928 CB LEU B 54 12.007 -10.701 -4.181 1.00 0.40 C ATOM 1929 CG LEU B 54 12.174 -9.513 -5.135 1.00 0.44 C ATOM 1930 CD1 LEU B 54 11.854 -9.949 -6.567 1.00 0.50 C ATOM 1931 CD2 LEU B 54 11.225 -8.384 -4.722 1.00 0.46 C ATOM 0 H LEU B 54 10.428 -9.692 -2.704 1.00 0.33 H new ATOM 0 HA LEU B 54 10.126 -11.091 -5.206 1.00 0.37 H new ATOM 0 HB2 LEU B 54 12.279 -10.406 -3.168 1.00 0.40 H new ATOM 0 HB3 LEU B 54 12.681 -11.508 -4.470 1.00 0.40 H new ATOM 0 HG LEU B 54 13.204 -9.159 -5.087 1.00 0.44 H new ATOM 0 HD11 LEU B 54 11.974 -9.101 -7.241 1.00 0.50 H new ATOM 0 HD12 LEU B 54 12.533 -10.748 -6.864 1.00 0.50 H new ATOM 0 HD13 LEU B 54 10.826 -10.309 -6.617 1.00 0.50 H new ATOM 0 HD21 LEU B 54 11.346 -7.540 -5.402 1.00 0.46 H new ATOM 0 HD22 LEU B 54 10.196 -8.740 -4.765 1.00 0.46 H new ATOM 0 HD23 LEU B 54 11.457 -8.067 -3.705 1.00 0.46 H new ATOM 1943 N ARG B 55 10.600 -12.973 -2.554 1.00 0.34 N ATOM 1944 CA ARG B 55 10.512 -14.394 -2.092 1.00 0.37 C ATOM 1945 C ARG B 55 9.065 -14.897 -2.154 1.00 0.36 C ATOM 1946 O ARG B 55 8.788 -16.045 -1.859 1.00 0.49 O ATOM 1947 CB ARG B 55 11.014 -14.383 -0.646 1.00 0.38 C ATOM 1948 CG ARG B 55 11.048 -15.815 -0.103 1.00 0.51 C ATOM 1949 CD ARG B 55 9.910 -16.013 0.901 1.00 0.67 C ATOM 1950 NE ARG B 55 9.931 -17.468 1.220 1.00 0.64 N ATOM 1951 CZ ARG B 55 8.852 -18.186 1.064 1.00 0.62 C ATOM 1952 NH1 ARG B 55 8.343 -18.350 -0.126 1.00 0.57 N ATOM 1953 NH2 ARG B 55 8.283 -18.739 2.100 1.00 0.87 N ATOM 0 H ARG B 55 10.762 -12.290 -1.814 1.00 0.34 H new ATOM 0 HA ARG B 55 11.102 -15.059 -2.723 1.00 0.37 H new ATOM 0 HB2 ARG B 55 12.010 -13.942 -0.599 1.00 0.38 H new ATOM 0 HB3 ARG B 55 10.362 -13.765 -0.029 1.00 0.38 H new ATOM 0 HG2 ARG B 55 10.951 -16.527 -0.922 1.00 0.51 H new ATOM 0 HG3 ARG B 55 12.007 -16.010 0.377 1.00 0.51 H new ATOM 0 HD2 ARG B 55 10.063 -15.410 1.796 1.00 0.67 H new ATOM 0 HD3 ARG B 55 8.951 -15.715 0.476 1.00 0.67 H new ATOM 0 HE ARG B 55 10.788 -17.903 1.560 1.00 0.64 H new ATOM 0 HH11 ARG B 55 8.788 -17.917 -0.935 1.00 0.57 H new ATOM 0 HH12 ARG B 55 7.500 -18.911 -0.247 1.00 0.57 H new ATOM 0 HH21 ARG B 55 8.681 -18.610 3.030 1.00 0.87 H new ATOM 0 HH22 ARG B 55 7.440 -19.300 1.980 1.00 0.87 H new ATOM 1967 N PHE B 56 8.140 -14.050 -2.530 1.00 0.33 N ATOM 1968 CA PHE B 56 6.717 -14.485 -2.612 1.00 0.32 C ATOM 1969 C PHE B 56 6.307 -14.699 -4.073 1.00 0.34 C ATOM 1970 O PHE B 56 5.357 -15.406 -4.353 1.00 0.36 O ATOM 1971 CB PHE B 56 5.913 -13.338 -1.995 1.00 0.31 C ATOM 1972 CG PHE B 56 5.484 -13.713 -0.596 1.00 0.31 C ATOM 1973 CD1 PHE B 56 6.444 -14.017 0.379 1.00 0.42 C ATOM 1974 CD2 PHE B 56 4.123 -13.755 -0.273 1.00 0.76 C ATOM 1975 CE1 PHE B 56 6.041 -14.362 1.674 1.00 0.39 C ATOM 1976 CE2 PHE B 56 3.721 -14.101 1.022 1.00 0.94 C ATOM 1977 CZ PHE B 56 4.680 -14.404 1.996 1.00 0.63 C ATOM 0 H PHE B 56 8.311 -13.077 -2.783 1.00 0.33 H new ATOM 0 HA PHE B 56 6.547 -15.429 -2.094 1.00 0.32 H new ATOM 0 HB2 PHE B 56 6.516 -12.430 -1.970 1.00 0.31 H new ATOM 0 HB3 PHE B 56 5.038 -13.123 -2.609 1.00 0.31 H new ATOM 0 HD1 PHE B 56 7.495 -13.985 0.131 1.00 0.42 H new ATOM 0 HD2 PHE B 56 3.383 -13.520 -1.023 1.00 0.76 H new ATOM 0 HE1 PHE B 56 6.781 -14.596 2.425 1.00 0.39 H new ATOM 0 HE2 PHE B 56 2.670 -14.134 1.270 1.00 0.94 H new ATOM 0 HZ PHE B 56 4.369 -14.670 2.996 1.00 0.63 H new ATOM 1987 N LEU B 57 6.995 -14.079 -5.007 1.00 0.37 N ATOM 1988 CA LEU B 57 6.606 -14.243 -6.447 1.00 0.41 C ATOM 1989 C LEU B 57 7.604 -15.117 -7.227 1.00 0.49 C ATOM 1990 O LEU B 57 7.206 -15.912 -8.057 1.00 0.57 O ATOM 1991 CB LEU B 57 6.581 -12.824 -7.027 1.00 0.46 C ATOM 1992 CG LEU B 57 5.868 -11.868 -6.062 1.00 0.40 C ATOM 1993 CD1 LEU B 57 5.832 -10.463 -6.668 1.00 0.53 C ATOM 1994 CD2 LEU B 57 4.435 -12.350 -5.817 1.00 0.41 C ATOM 0 H LEU B 57 7.799 -13.474 -4.837 1.00 0.37 H new ATOM 0 HA LEU B 57 5.643 -14.747 -6.527 1.00 0.41 H new ATOM 0 HB2 LEU B 57 7.599 -12.479 -7.206 1.00 0.46 H new ATOM 0 HB3 LEU B 57 6.071 -12.826 -7.990 1.00 0.46 H new ATOM 0 HG LEU B 57 6.409 -11.846 -5.116 1.00 0.40 H new ATOM 0 HD11 LEU B 57 5.325 -9.784 -5.982 1.00 0.53 H new ATOM 0 HD12 LEU B 57 6.850 -10.114 -6.838 1.00 0.53 H new ATOM 0 HD13 LEU B 57 5.294 -10.489 -7.616 1.00 0.53 H new ATOM 0 HD21 LEU B 57 3.934 -11.667 -5.131 1.00 0.41 H new ATOM 0 HD22 LEU B 57 3.893 -12.377 -6.763 1.00 0.41 H new ATOM 0 HD23 LEU B 57 4.457 -13.350 -5.383 1.00 0.41 H new ATOM 2006 N THR B 58 8.888 -14.966 -6.995 1.00 0.54 N ATOM 2007 CA THR B 58 9.886 -15.784 -7.764 1.00 0.66 C ATOM 2008 C THR B 58 11.040 -16.263 -6.869 1.00 0.62 C ATOM 2009 O THR B 58 11.802 -17.134 -7.245 1.00 0.70 O ATOM 2010 CB THR B 58 10.410 -14.833 -8.841 1.00 0.77 C ATOM 2011 OG1 THR B 58 9.314 -14.227 -9.513 1.00 1.12 O ATOM 2012 CG2 THR B 58 11.256 -15.613 -9.845 1.00 1.08 C ATOM 0 H THR B 58 9.286 -14.319 -6.314 1.00 0.54 H new ATOM 0 HA THR B 58 9.433 -16.686 -8.176 1.00 0.66 H new ATOM 0 HB THR B 58 11.022 -14.061 -8.375 1.00 0.77 H new ATOM 0 HG1 THR B 58 9.650 -13.616 -10.202 1.00 1.12 H new ATOM 0 HG21 THR B 58 11.629 -14.934 -10.612 1.00 1.08 H new ATOM 0 HG22 THR B 58 12.098 -16.076 -9.330 1.00 1.08 H new ATOM 0 HG23 THR B 58 10.646 -16.387 -10.311 1.00 1.08 H new ATOM 2020 N ILE B 59 11.167 -15.704 -5.695 1.00 0.53 N ATOM 2021 CA ILE B 59 12.254 -16.110 -4.754 1.00 0.51 C ATOM 2022 C ILE B 59 13.645 -16.027 -5.407 1.00 0.54 C ATOM 2023 O ILE B 59 14.340 -17.020 -5.514 1.00 0.63 O ATOM 2024 CB ILE B 59 11.923 -17.546 -4.357 1.00 0.59 C ATOM 2025 CG1 ILE B 59 10.506 -17.606 -3.787 1.00 0.57 C ATOM 2026 CG2 ILE B 59 12.916 -18.022 -3.291 1.00 0.67 C ATOM 2027 CD1 ILE B 59 9.515 -17.925 -4.908 1.00 0.57 C ATOM 0 H ILE B 59 10.553 -14.970 -5.342 1.00 0.53 H new ATOM 0 HA ILE B 59 12.298 -15.443 -3.893 1.00 0.51 H new ATOM 0 HB ILE B 59 11.991 -18.188 -5.235 1.00 0.59 H new ATOM 0 HG12 ILE B 59 10.448 -18.367 -3.009 1.00 0.57 H new ATOM 0 HG13 ILE B 59 10.250 -16.654 -3.321 1.00 0.57 H new ATOM 0 HG21 ILE B 59 12.681 -19.048 -3.007 1.00 0.67 H new ATOM 0 HG22 ILE B 59 13.929 -17.980 -3.692 1.00 0.67 H new ATOM 0 HG23 ILE B 59 12.846 -17.377 -2.415 1.00 0.67 H new ATOM 0 HD11 ILE B 59 8.505 -17.967 -4.500 1.00 0.57 H new ATOM 0 HD12 ILE B 59 9.566 -17.148 -5.671 1.00 0.57 H new ATOM 0 HD13 ILE B 59 9.767 -18.887 -5.353 1.00 0.57 H new ATOM 2039 N PRO B 60 14.020 -14.832 -5.797 1.00 0.52 N ATOM 2040 CA PRO B 60 15.342 -14.575 -6.390 1.00 0.57 C ATOM 2041 C PRO B 60 16.235 -13.844 -5.358 1.00 0.47 C ATOM 2042 O PRO B 60 16.625 -12.713 -5.586 1.00 0.55 O ATOM 2043 CB PRO B 60 14.976 -13.619 -7.526 1.00 0.71 C ATOM 2044 CG PRO B 60 13.695 -12.946 -7.079 1.00 0.70 C ATOM 2045 CD PRO B 60 13.260 -13.598 -5.782 1.00 0.55 C ATOM 0 HA PRO B 60 15.884 -15.466 -6.706 1.00 0.57 H new ATOM 0 HB2 PRO B 60 15.767 -12.888 -7.696 1.00 0.71 H new ATOM 0 HB3 PRO B 60 14.832 -14.157 -8.463 1.00 0.71 H new ATOM 0 HG2 PRO B 60 13.855 -11.877 -6.935 1.00 0.70 H new ATOM 0 HG3 PRO B 60 12.921 -13.053 -7.839 1.00 0.70 H new ATOM 0 HD2 PRO B 60 13.499 -12.982 -4.915 1.00 0.55 H new ATOM 0 HD3 PRO B 60 12.186 -13.780 -5.757 1.00 0.55 H new ATOM 2053 N PRO B 61 16.519 -14.485 -4.241 1.00 0.40 N ATOM 2054 CA PRO B 61 17.343 -13.829 -3.195 1.00 0.40 C ATOM 2055 C PRO B 61 18.788 -13.675 -3.666 1.00 0.43 C ATOM 2056 O PRO B 61 19.489 -14.646 -3.879 1.00 0.48 O ATOM 2057 CB PRO B 61 17.255 -14.777 -2.006 1.00 0.42 C ATOM 2058 CG PRO B 61 16.945 -16.106 -2.604 1.00 0.45 C ATOM 2059 CD PRO B 61 16.127 -15.843 -3.843 1.00 0.45 C ATOM 0 HA PRO B 61 16.996 -12.825 -2.953 1.00 0.40 H new ATOM 0 HB2 PRO B 61 18.192 -14.802 -1.449 1.00 0.42 H new ATOM 0 HB3 PRO B 61 16.478 -14.466 -1.308 1.00 0.42 H new ATOM 0 HG2 PRO B 61 17.861 -16.642 -2.852 1.00 0.45 H new ATOM 0 HG3 PRO B 61 16.392 -16.728 -1.900 1.00 0.45 H new ATOM 0 HD2 PRO B 61 16.345 -16.568 -4.627 1.00 0.45 H new ATOM 0 HD3 PRO B 61 15.058 -15.907 -3.638 1.00 0.45 H new ATOM 2067 N THR B 62 19.234 -12.456 -3.826 1.00 0.47 N ATOM 2068 CA THR B 62 20.635 -12.218 -4.281 1.00 0.53 C ATOM 2069 C THR B 62 21.618 -12.866 -3.291 1.00 0.47 C ATOM 2070 O THR B 62 21.235 -13.289 -2.217 1.00 0.43 O ATOM 2071 CB THR B 62 20.768 -10.682 -4.344 1.00 0.59 C ATOM 2072 OG1 THR B 62 21.303 -10.313 -5.606 1.00 0.75 O ATOM 2073 CG2 THR B 62 21.684 -10.153 -3.237 1.00 0.53 C ATOM 0 H THR B 62 18.685 -11.612 -3.660 1.00 0.47 H new ATOM 0 HA THR B 62 20.863 -12.661 -5.250 1.00 0.53 H new ATOM 0 HB THR B 62 19.778 -10.248 -4.205 1.00 0.59 H new ATOM 0 HG1 THR B 62 21.388 -9.338 -5.653 1.00 0.75 H new ATOM 0 HG21 THR B 62 21.755 -9.068 -3.311 1.00 0.53 H new ATOM 0 HG22 THR B 62 21.273 -10.424 -2.264 1.00 0.53 H new ATOM 0 HG23 THR B 62 22.677 -10.590 -3.346 1.00 0.53 H new ATOM 2081 N ALA B 63 22.872 -12.963 -3.660 1.00 0.50 N ATOM 2082 CA ALA B 63 23.891 -13.604 -2.763 1.00 0.49 C ATOM 2083 C ALA B 63 23.862 -13.000 -1.353 1.00 0.43 C ATOM 2084 O ALA B 63 23.865 -13.712 -0.366 1.00 0.43 O ATOM 2085 CB ALA B 63 25.236 -13.319 -3.433 1.00 0.57 C ATOM 0 H ALA B 63 23.238 -12.624 -4.550 1.00 0.50 H new ATOM 0 HA ALA B 63 23.699 -14.670 -2.640 1.00 0.49 H new ATOM 0 HB1 ALA B 63 26.038 -13.756 -2.838 1.00 0.57 H new ATOM 0 HB2 ALA B 63 25.245 -13.756 -4.431 1.00 0.57 H new ATOM 0 HB3 ALA B 63 25.384 -12.242 -3.507 1.00 0.57 H new ATOM 2091 N GLY B 64 23.859 -11.697 -1.257 1.00 0.42 N ATOM 2092 CA GLY B 64 23.856 -11.029 0.079 1.00 0.39 C ATOM 2093 C GLY B 64 22.686 -11.513 0.940 1.00 0.34 C ATOM 2094 O GLY B 64 22.865 -11.817 2.096 1.00 0.38 O ATOM 0 H GLY B 64 23.858 -11.060 -2.054 1.00 0.42 H new ATOM 0 HA2 GLY B 64 24.796 -11.232 0.592 1.00 0.39 H new ATOM 0 HA3 GLY B 64 23.791 -9.949 -0.052 1.00 0.39 H new ATOM 2098 N ILE B 65 21.493 -11.574 0.400 1.00 0.34 N ATOM 2099 CA ILE B 65 20.319 -12.029 1.212 1.00 0.32 C ATOM 2100 C ILE B 65 20.651 -13.327 1.957 1.00 0.32 C ATOM 2101 O ILE B 65 20.233 -13.526 3.080 1.00 0.32 O ATOM 2102 CB ILE B 65 19.185 -12.252 0.199 1.00 0.33 C ATOM 2103 CG1 ILE B 65 18.871 -10.937 -0.526 1.00 0.38 C ATOM 2104 CG2 ILE B 65 17.924 -12.736 0.926 1.00 0.35 C ATOM 2105 CD1 ILE B 65 18.620 -9.832 0.502 1.00 0.40 C ATOM 0 H ILE B 65 21.281 -11.329 -0.567 1.00 0.34 H new ATOM 0 HA ILE B 65 20.040 -11.298 1.971 1.00 0.32 H new ATOM 0 HB ILE B 65 19.501 -13.004 -0.524 1.00 0.33 H new ATOM 0 HG12 ILE B 65 19.701 -10.661 -1.176 1.00 0.38 H new ATOM 0 HG13 ILE B 65 17.995 -11.061 -1.163 1.00 0.38 H new ATOM 0 HG21 ILE B 65 17.124 -12.892 0.202 1.00 0.35 H new ATOM 0 HG22 ILE B 65 18.137 -13.674 1.439 1.00 0.35 H new ATOM 0 HG23 ILE B 65 17.613 -11.987 1.654 1.00 0.35 H new ATOM 0 HD11 ILE B 65 18.397 -8.898 -0.014 1.00 0.40 H new ATOM 0 HD12 ILE B 65 17.776 -10.108 1.134 1.00 0.40 H new ATOM 0 HD13 ILE B 65 19.508 -9.702 1.120 1.00 0.40 H new ATOM 2117 N LEU B 66 21.408 -14.202 1.343 1.00 0.34 N ATOM 2118 CA LEU B 66 21.770 -15.483 2.018 1.00 0.35 C ATOM 2119 C LEU B 66 22.952 -15.267 2.968 1.00 0.36 C ATOM 2120 O LEU B 66 22.885 -15.599 4.136 1.00 0.39 O ATOM 2121 CB LEU B 66 22.160 -16.446 0.889 1.00 0.40 C ATOM 2122 CG LEU B 66 20.916 -16.924 0.120 1.00 0.42 C ATOM 2123 CD1 LEU B 66 19.812 -17.344 1.096 1.00 0.47 C ATOM 2124 CD2 LEU B 66 20.403 -15.798 -0.781 1.00 0.48 C ATOM 0 H LEU B 66 21.790 -14.083 0.405 1.00 0.34 H new ATOM 0 HA LEU B 66 20.946 -15.874 2.615 1.00 0.35 H new ATOM 0 HB2 LEU B 66 22.847 -15.950 0.204 1.00 0.40 H new ATOM 0 HB3 LEU B 66 22.688 -17.305 1.304 1.00 0.40 H new ATOM 0 HG LEU B 66 21.191 -17.784 -0.490 1.00 0.42 H new ATOM 0 HD11 LEU B 66 18.939 -17.679 0.536 1.00 0.47 H new ATOM 0 HD12 LEU B 66 20.173 -18.157 1.726 1.00 0.47 H new ATOM 0 HD13 LEU B 66 19.537 -16.495 1.722 1.00 0.47 H new ATOM 0 HD21 LEU B 66 19.522 -16.140 -1.324 1.00 0.48 H new ATOM 0 HD22 LEU B 66 20.140 -14.934 -0.170 1.00 0.48 H new ATOM 0 HD23 LEU B 66 21.181 -15.517 -1.491 1.00 0.48 H new ATOM 2136 N LYS B 67 24.033 -14.713 2.473 1.00 0.37 N ATOM 2137 CA LYS B 67 25.225 -14.470 3.344 1.00 0.40 C ATOM 2138 C LYS B 67 24.828 -13.607 4.544 1.00 0.38 C ATOM 2139 O LYS B 67 25.296 -13.808 5.649 1.00 0.44 O ATOM 2140 CB LYS B 67 26.223 -13.727 2.456 1.00 0.45 C ATOM 2141 CG LYS B 67 26.941 -14.725 1.545 1.00 0.59 C ATOM 2142 CD LYS B 67 27.977 -15.508 2.357 1.00 0.70 C ATOM 2143 CE LYS B 67 29.060 -14.552 2.868 1.00 1.03 C ATOM 2144 NZ LYS B 67 28.831 -14.460 4.337 1.00 1.27 N ATOM 0 H LYS B 67 24.141 -14.419 1.502 1.00 0.37 H new ATOM 0 HA LYS B 67 25.645 -15.395 3.739 1.00 0.40 H new ATOM 0 HB2 LYS B 67 25.705 -12.979 1.856 1.00 0.45 H new ATOM 0 HB3 LYS B 67 26.948 -13.195 3.072 1.00 0.45 H new ATOM 0 HG2 LYS B 67 26.220 -15.410 1.099 1.00 0.59 H new ATOM 0 HG3 LYS B 67 27.429 -14.198 0.725 1.00 0.59 H new ATOM 0 HD2 LYS B 67 27.494 -16.008 3.196 1.00 0.70 H new ATOM 0 HD3 LYS B 67 28.426 -16.285 1.739 1.00 0.70 H new ATOM 0 HE2 LYS B 67 30.058 -14.931 2.647 1.00 1.03 H new ATOM 0 HE3 LYS B 67 28.979 -13.574 2.394 1.00 1.03 H new ATOM 0 HZ1 LYS B 67 29.269 -13.590 4.703 1.00 1.27 H new ATOM 0 HZ2 LYS B 67 27.809 -14.440 4.528 1.00 1.27 H new ATOM 0 HZ3 LYS B 67 29.255 -15.285 4.807 1.00 1.27 H new ATOM 2158 N ARG B 68 23.956 -12.658 4.327 1.00 0.34 N ATOM 2159 CA ARG B 68 23.500 -11.778 5.438 1.00 0.34 C ATOM 2160 C ARG B 68 22.485 -12.536 6.304 1.00 0.33 C ATOM 2161 O ARG B 68 22.386 -12.320 7.496 1.00 0.37 O ATOM 2162 CB ARG B 68 22.880 -10.548 4.747 1.00 0.33 C ATOM 2163 CG ARG B 68 21.373 -10.732 4.537 1.00 0.34 C ATOM 2164 CD ARG B 68 20.839 -9.597 3.654 1.00 0.37 C ATOM 2165 NE ARG B 68 20.788 -8.403 4.546 1.00 0.48 N ATOM 2166 CZ ARG B 68 21.853 -7.669 4.721 1.00 0.48 C ATOM 2167 NH1 ARG B 68 22.594 -7.336 3.700 1.00 0.48 N ATOM 2168 NH2 ARG B 68 22.177 -7.266 5.920 1.00 0.76 N ATOM 0 H ARG B 68 23.538 -12.455 3.419 1.00 0.34 H new ATOM 0 HA ARG B 68 24.304 -11.473 6.107 1.00 0.34 H new ATOM 0 HB2 ARG B 68 23.060 -9.659 5.351 1.00 0.33 H new ATOM 0 HB3 ARG B 68 23.367 -10.384 3.786 1.00 0.33 H new ATOM 0 HG2 ARG B 68 21.175 -11.696 4.068 1.00 0.34 H new ATOM 0 HG3 ARG B 68 20.858 -10.733 5.498 1.00 0.34 H new ATOM 0 HD2 ARG B 68 21.492 -9.423 2.799 1.00 0.37 H new ATOM 0 HD3 ARG B 68 19.852 -9.836 3.258 1.00 0.37 H new ATOM 0 HE ARG B 68 19.919 -8.159 5.021 1.00 0.48 H new ATOM 0 HH11 ARG B 68 22.341 -7.649 2.763 1.00 0.48 H new ATOM 0 HH12 ARG B 68 23.426 -6.762 3.839 1.00 0.48 H new ATOM 0 HH21 ARG B 68 21.598 -7.525 6.719 1.00 0.76 H new ATOM 0 HH22 ARG B 68 23.009 -6.692 6.058 1.00 0.76 H new ATOM 2182 N TRP B 69 21.742 -13.430 5.697 1.00 0.31 N ATOM 2183 CA TRP B 69 20.721 -14.240 6.441 1.00 0.32 C ATOM 2184 C TRP B 69 21.294 -14.836 7.736 1.00 0.35 C ATOM 2185 O TRP B 69 20.597 -14.961 8.725 1.00 0.37 O ATOM 2186 CB TRP B 69 20.382 -15.372 5.477 1.00 0.31 C ATOM 2187 CG TRP B 69 18.973 -15.829 5.672 1.00 0.29 C ATOM 2188 CD1 TRP B 69 18.618 -17.102 5.950 1.00 0.33 C ATOM 2189 CD2 TRP B 69 17.731 -15.065 5.593 1.00 0.28 C ATOM 2190 NE1 TRP B 69 17.244 -17.172 6.043 1.00 0.34 N ATOM 2191 CE2 TRP B 69 16.651 -15.949 5.831 1.00 0.31 C ATOM 2192 CE3 TRP B 69 17.433 -13.710 5.341 1.00 0.29 C ATOM 2193 CZ2 TRP B 69 15.329 -15.512 5.816 1.00 0.34 C ATOM 2194 CZ3 TRP B 69 16.100 -13.271 5.327 1.00 0.32 C ATOM 2195 CH2 TRP B 69 15.053 -14.172 5.563 1.00 0.33 C ATOM 0 H TRP B 69 21.800 -13.637 4.700 1.00 0.31 H new ATOM 0 HA TRP B 69 19.865 -13.632 6.735 1.00 0.32 H new ATOM 0 HB2 TRP B 69 20.521 -15.035 4.450 1.00 0.31 H new ATOM 0 HB3 TRP B 69 21.065 -16.207 5.634 1.00 0.31 H new ATOM 0 HD1 TRP B 69 19.299 -17.930 6.079 1.00 0.33 H new ATOM 0 HE1 TRP B 69 16.729 -18.029 6.245 1.00 0.34 H new ATOM 0 HE3 TRP B 69 18.233 -13.008 5.158 1.00 0.29 H new ATOM 0 HZ2 TRP B 69 14.524 -16.208 5.999 1.00 0.34 H new ATOM 0 HZ3 TRP B 69 15.880 -12.232 5.133 1.00 0.32 H new ATOM 0 HH2 TRP B 69 14.030 -13.826 5.548 1.00 0.33 H new ATOM 2206 N GLY B 70 22.545 -15.234 7.725 1.00 0.39 N ATOM 2207 CA GLY B 70 23.146 -15.857 8.945 1.00 0.44 C ATOM 2208 C GLY B 70 24.171 -14.920 9.585 1.00 0.42 C ATOM 2209 O GLY B 70 25.235 -15.347 9.992 1.00 0.46 O ATOM 0 H GLY B 70 23.173 -15.154 6.925 1.00 0.39 H new ATOM 0 HA2 GLY B 70 22.361 -16.090 9.664 1.00 0.44 H new ATOM 0 HA3 GLY B 70 23.625 -16.800 8.679 1.00 0.44 H new ATOM 2213 N THR B 71 23.858 -13.655 9.694 1.00 0.39 N ATOM 2214 CA THR B 71 24.817 -12.703 10.330 1.00 0.40 C ATOM 2215 C THR B 71 24.140 -11.354 10.598 1.00 0.39 C ATOM 2216 O THR B 71 24.787 -10.324 10.636 1.00 0.47 O ATOM 2217 CB THR B 71 25.966 -12.551 9.330 1.00 0.44 C ATOM 2218 OG1 THR B 71 26.959 -11.695 9.878 1.00 0.51 O ATOM 2219 CG2 THR B 71 25.441 -11.956 8.026 1.00 0.49 C ATOM 0 H THR B 71 22.983 -13.241 9.372 1.00 0.39 H new ATOM 0 HA THR B 71 25.172 -13.067 11.294 1.00 0.40 H new ATOM 0 HB THR B 71 26.400 -13.530 9.128 1.00 0.44 H new ATOM 0 HG1 THR B 71 26.532 -10.896 10.251 1.00 0.51 H new ATOM 0 HG21 THR B 71 26.263 -11.850 7.318 1.00 0.49 H new ATOM 0 HG22 THR B 71 24.682 -12.615 7.605 1.00 0.49 H new ATOM 0 HG23 THR B 71 25.003 -10.977 8.223 1.00 0.49 H new ATOM 2227 N ILE B 72 22.846 -11.357 10.801 1.00 0.37 N ATOM 2228 CA ILE B 72 22.126 -10.079 11.086 1.00 0.38 C ATOM 2229 C ILE B 72 21.819 -9.987 12.587 1.00 0.38 C ATOM 2230 O ILE B 72 22.710 -10.101 13.409 1.00 0.48 O ATOM 2231 CB ILE B 72 20.843 -10.125 10.241 1.00 0.38 C ATOM 2232 CG1 ILE B 72 20.040 -11.385 10.577 1.00 0.36 C ATOM 2233 CG2 ILE B 72 21.200 -10.126 8.753 1.00 0.44 C ATOM 2234 CD1 ILE B 72 18.546 -11.085 10.432 1.00 0.38 C ATOM 0 H ILE B 72 22.257 -12.190 10.782 1.00 0.37 H new ATOM 0 HA ILE B 72 22.716 -9.198 10.833 1.00 0.38 H new ATOM 0 HB ILE B 72 20.240 -9.245 10.466 1.00 0.38 H new ATOM 0 HG12 ILE B 72 20.325 -12.200 9.912 1.00 0.36 H new ATOM 0 HG13 ILE B 72 20.261 -11.711 11.594 1.00 0.36 H new ATOM 0 HG21 ILE B 72 20.286 -10.159 8.160 1.00 0.44 H new ATOM 0 HG22 ILE B 72 21.757 -9.221 8.512 1.00 0.44 H new ATOM 0 HG23 ILE B 72 21.811 -10.999 8.526 1.00 0.44 H new ATOM 0 HD11 ILE B 72 17.970 -11.979 10.670 1.00 0.38 H new ATOM 0 HD12 ILE B 72 18.268 -10.282 11.115 1.00 0.38 H new ATOM 0 HD13 ILE B 72 18.334 -10.779 9.407 1.00 0.38 H new ATOM 2246 N LYS B 73 20.581 -9.773 12.954 1.00 0.36 N ATOM 2247 CA LYS B 73 20.231 -9.664 14.401 1.00 0.38 C ATOM 2248 C LYS B 73 19.250 -10.755 14.807 1.00 0.33 C ATOM 2249 O LYS B 73 19.263 -11.222 15.930 1.00 0.37 O ATOM 2250 CB LYS B 73 19.563 -8.298 14.534 1.00 0.40 C ATOM 2251 CG LYS B 73 19.192 -8.048 15.992 1.00 0.48 C ATOM 2252 CD LYS B 73 20.406 -7.500 16.748 1.00 0.62 C ATOM 2253 CE LYS B 73 20.740 -6.097 16.237 1.00 0.72 C ATOM 2254 NZ LYS B 73 21.711 -5.549 17.224 1.00 0.83 N ATOM 0 H LYS B 73 19.796 -9.669 12.311 1.00 0.36 H new ATOM 0 HA LYS B 73 21.109 -9.773 15.038 1.00 0.38 H new ATOM 0 HB2 LYS B 73 20.236 -7.517 14.181 1.00 0.40 H new ATOM 0 HB3 LYS B 73 18.671 -8.256 13.909 1.00 0.40 H new ATOM 0 HG2 LYS B 73 18.365 -7.340 16.050 1.00 0.48 H new ATOM 0 HG3 LYS B 73 18.852 -8.974 16.454 1.00 0.48 H new ATOM 0 HD2 LYS B 73 20.197 -7.468 17.817 1.00 0.62 H new ATOM 0 HD3 LYS B 73 21.262 -8.161 16.610 1.00 0.62 H new ATOM 0 HE2 LYS B 73 21.172 -6.134 15.237 1.00 0.72 H new ATOM 0 HE3 LYS B 73 19.846 -5.476 16.176 1.00 0.72 H new ATOM 0 HZ1 LYS B 73 21.988 -4.587 16.941 1.00 0.83 H new ATOM 0 HZ2 LYS B 73 21.270 -5.520 18.165 1.00 0.83 H new ATOM 0 HZ3 LYS B 73 22.554 -6.157 17.256 1.00 0.83 H new ATOM 2268 N LYS B 74 18.386 -11.135 13.904 1.00 0.30 N ATOM 2269 CA LYS B 74 17.348 -12.176 14.190 1.00 0.29 C ATOM 2270 C LYS B 74 16.289 -11.610 15.141 1.00 0.28 C ATOM 2271 O LYS B 74 15.104 -11.721 14.895 1.00 0.28 O ATOM 2272 CB LYS B 74 18.047 -13.388 14.836 1.00 0.33 C ATOM 2273 CG LYS B 74 19.402 -13.673 14.183 1.00 0.37 C ATOM 2274 CD LYS B 74 19.278 -13.685 12.657 1.00 0.39 C ATOM 2275 CE LYS B 74 18.618 -14.990 12.211 1.00 0.44 C ATOM 2276 NZ LYS B 74 19.484 -15.505 11.114 1.00 0.40 N ATOM 0 H LYS B 74 18.354 -10.760 12.956 1.00 0.30 H new ATOM 0 HA LYS B 74 16.853 -12.478 13.267 1.00 0.29 H new ATOM 0 HB2 LYS B 74 18.188 -13.202 15.901 1.00 0.33 H new ATOM 0 HB3 LYS B 74 17.408 -14.267 14.747 1.00 0.33 H new ATOM 0 HG2 LYS B 74 20.124 -12.916 14.488 1.00 0.37 H new ATOM 0 HG3 LYS B 74 19.783 -14.634 14.529 1.00 0.37 H new ATOM 0 HD2 LYS B 74 18.686 -12.833 12.323 1.00 0.39 H new ATOM 0 HD3 LYS B 74 20.263 -13.588 12.200 1.00 0.39 H new ATOM 0 HE2 LYS B 74 18.557 -15.703 13.033 1.00 0.44 H new ATOM 0 HE3 LYS B 74 17.600 -14.818 11.862 1.00 0.44 H new ATOM 0 HZ1 LYS B 74 18.983 -16.258 10.600 1.00 0.40 H new ATOM 0 HZ2 LYS B 74 19.711 -14.730 10.458 1.00 0.40 H new ATOM 0 HZ3 LYS B 74 20.364 -15.887 11.516 1.00 0.40 H new ATOM 2290 N SER B 75 16.706 -10.993 16.220 1.00 0.30 N ATOM 2291 CA SER B 75 15.722 -10.416 17.181 1.00 0.30 C ATOM 2292 C SER B 75 14.857 -9.386 16.463 1.00 0.28 C ATOM 2293 O SER B 75 13.656 -9.353 16.628 1.00 0.31 O ATOM 2294 CB SER B 75 16.563 -9.757 18.279 1.00 0.36 C ATOM 2295 OG SER B 75 17.074 -8.515 17.811 1.00 0.40 O ATOM 0 H SER B 75 17.686 -10.865 16.474 1.00 0.30 H new ATOM 0 HA SER B 75 15.051 -11.168 17.598 1.00 0.30 H new ATOM 0 HB2 SER B 75 15.956 -9.599 19.170 1.00 0.36 H new ATOM 0 HB3 SER B 75 17.384 -10.414 18.566 1.00 0.36 H new ATOM 0 HG SER B 75 17.610 -8.095 18.516 1.00 0.40 H new ATOM 2301 N LYS B 76 15.465 -8.558 15.656 1.00 0.28 N ATOM 2302 CA LYS B 76 14.689 -7.531 14.907 1.00 0.28 C ATOM 2303 C LYS B 76 13.949 -8.188 13.740 1.00 0.26 C ATOM 2304 O LYS B 76 12.784 -7.927 13.512 1.00 0.29 O ATOM 2305 CB LYS B 76 15.731 -6.539 14.396 1.00 0.32 C ATOM 2306 CG LYS B 76 15.089 -5.159 14.237 1.00 0.35 C ATOM 2307 CD LYS B 76 14.652 -4.629 15.606 1.00 0.44 C ATOM 2308 CE LYS B 76 13.123 -4.596 15.681 1.00 0.47 C ATOM 2309 NZ LYS B 76 12.718 -3.466 14.799 1.00 0.45 N ATOM 0 H LYS B 76 16.470 -8.550 15.484 1.00 0.28 H new ATOM 0 HA LYS B 76 13.938 -7.042 15.527 1.00 0.28 H new ATOM 0 HB2 LYS B 76 16.568 -6.484 15.092 1.00 0.32 H new ATOM 0 HB3 LYS B 76 16.132 -6.877 13.441 1.00 0.32 H new ATOM 0 HG2 LYS B 76 15.797 -4.469 13.779 1.00 0.35 H new ATOM 0 HG3 LYS B 76 14.229 -5.222 13.570 1.00 0.35 H new ATOM 0 HD2 LYS B 76 15.051 -5.264 16.397 1.00 0.44 H new ATOM 0 HD3 LYS B 76 15.055 -3.629 15.766 1.00 0.44 H new ATOM 0 HE2 LYS B 76 12.691 -5.537 15.340 1.00 0.47 H new ATOM 0 HE3 LYS B 76 12.781 -4.440 16.704 1.00 0.47 H new ATOM 0 HZ1 LYS B 76 11.923 -2.954 15.233 1.00 0.45 H new ATOM 0 HZ2 LYS B 76 13.521 -2.817 14.675 1.00 0.45 H new ATOM 0 HZ3 LYS B 76 12.426 -3.836 13.872 1.00 0.45 H new ATOM 2323 N ALA B 77 14.618 -9.044 13.004 1.00 0.26 N ATOM 2324 CA ALA B 77 13.955 -9.728 11.851 1.00 0.27 C ATOM 2325 C ALA B 77 12.761 -10.544 12.347 1.00 0.25 C ATOM 2326 O ALA B 77 11.653 -10.391 11.869 1.00 0.30 O ATOM 2327 CB ALA B 77 15.018 -10.656 11.260 1.00 0.30 C ATOM 0 H ALA B 77 15.595 -9.298 13.153 1.00 0.26 H new ATOM 0 HA ALA B 77 13.583 -9.017 11.113 1.00 0.27 H new ATOM 0 HB1 ALA B 77 14.600 -11.192 10.408 1.00 0.30 H new ATOM 0 HB2 ALA B 77 15.875 -10.067 10.934 1.00 0.30 H new ATOM 0 HB3 ALA B 77 15.337 -11.372 12.017 1.00 0.30 H new ATOM 2333 N ILE B 78 12.984 -11.410 13.303 1.00 0.24 N ATOM 2334 CA ILE B 78 11.865 -12.241 13.837 1.00 0.25 C ATOM 2335 C ILE B 78 10.766 -11.335 14.403 1.00 0.24 C ATOM 2336 O ILE B 78 9.593 -11.553 14.160 1.00 0.29 O ATOM 2337 CB ILE B 78 12.496 -13.109 14.929 1.00 0.27 C ATOM 2338 CG1 ILE B 78 13.554 -14.022 14.295 1.00 0.29 C ATOM 2339 CG2 ILE B 78 11.417 -13.966 15.595 1.00 0.34 C ATOM 2340 CD1 ILE B 78 14.619 -14.384 15.334 1.00 0.32 C ATOM 0 H ILE B 78 13.892 -11.577 13.736 1.00 0.24 H new ATOM 0 HA ILE B 78 11.394 -12.856 13.070 1.00 0.25 H new ATOM 0 HB ILE B 78 12.961 -12.470 15.680 1.00 0.27 H new ATOM 0 HG12 ILE B 78 13.083 -14.928 13.913 1.00 0.29 H new ATOM 0 HG13 ILE B 78 14.018 -13.521 13.445 1.00 0.29 H new ATOM 0 HG21 ILE B 78 11.870 -14.582 16.372 1.00 0.34 H new ATOM 0 HG22 ILE B 78 10.661 -13.319 16.040 1.00 0.34 H new ATOM 0 HG23 ILE B 78 10.950 -14.608 14.848 1.00 0.34 H new ATOM 0 HD11 ILE B 78 15.367 -15.032 14.878 1.00 0.32 H new ATOM 0 HD12 ILE B 78 15.099 -13.474 15.695 1.00 0.32 H new ATOM 0 HD13 ILE B 78 14.150 -14.903 16.170 1.00 0.32 H new ATOM 2352 N ASN B 79 11.131 -10.306 15.133 1.00 0.23 N ATOM 2353 CA ASN B 79 10.094 -9.379 15.680 1.00 0.24 C ATOM 2354 C ASN B 79 9.376 -8.705 14.514 1.00 0.24 C ATOM 2355 O ASN B 79 8.172 -8.533 14.526 1.00 0.28 O ATOM 2356 CB ASN B 79 10.852 -8.343 16.510 1.00 0.26 C ATOM 2357 CG ASN B 79 10.842 -8.764 17.982 1.00 0.30 C ATOM 2358 OD1 ASN B 79 9.793 -8.940 18.568 1.00 0.36 O ATOM 2359 ND2 ASN B 79 11.974 -8.934 18.609 1.00 0.36 N ATOM 0 H ASN B 79 12.095 -10.071 15.371 1.00 0.23 H new ATOM 0 HA ASN B 79 9.350 -9.895 16.287 1.00 0.24 H new ATOM 0 HB2 ASN B 79 11.878 -8.255 16.153 1.00 0.26 H new ATOM 0 HB3 ASN B 79 10.390 -7.362 16.398 1.00 0.26 H new ATOM 0 HD21 ASN B 79 11.977 -9.214 19.590 1.00 0.36 H new ATOM 0 HD22 ASN B 79 12.856 -8.787 18.118 1.00 0.36 H new ATOM 2366 N VAL B 80 10.117 -8.344 13.495 1.00 0.23 N ATOM 2367 CA VAL B 80 9.500 -7.701 12.299 1.00 0.25 C ATOM 2368 C VAL B 80 8.457 -8.654 11.713 1.00 0.24 C ATOM 2369 O VAL B 80 7.327 -8.278 11.468 1.00 0.26 O ATOM 2370 CB VAL B 80 10.668 -7.473 11.324 1.00 0.28 C ATOM 2371 CG1 VAL B 80 10.267 -7.869 9.899 1.00 0.32 C ATOM 2372 CG2 VAL B 80 11.063 -5.996 11.344 1.00 0.43 C ATOM 0 H VAL B 80 11.128 -8.469 13.443 1.00 0.23 H new ATOM 0 HA VAL B 80 8.992 -6.763 12.522 1.00 0.25 H new ATOM 0 HB VAL B 80 11.510 -8.091 11.637 1.00 0.28 H new ATOM 0 HG11 VAL B 80 11.107 -7.700 9.225 1.00 0.32 H new ATOM 0 HG12 VAL B 80 9.991 -8.923 9.878 1.00 0.32 H new ATOM 0 HG13 VAL B 80 9.418 -7.265 9.579 1.00 0.32 H new ATOM 0 HG21 VAL B 80 11.891 -5.831 10.654 1.00 0.43 H new ATOM 0 HG22 VAL B 80 10.211 -5.387 11.041 1.00 0.43 H new ATOM 0 HG23 VAL B 80 11.369 -5.715 12.352 1.00 0.43 H new ATOM 2382 N LEU B 81 8.837 -9.891 11.504 1.00 0.23 N ATOM 2383 CA LEU B 81 7.878 -10.892 10.949 1.00 0.23 C ATOM 2384 C LEU B 81 6.645 -10.968 11.847 1.00 0.24 C ATOM 2385 O LEU B 81 5.536 -11.168 11.384 1.00 0.29 O ATOM 2386 CB LEU B 81 8.636 -12.217 10.955 1.00 0.25 C ATOM 2387 CG LEU B 81 8.879 -12.666 9.517 1.00 0.31 C ATOM 2388 CD1 LEU B 81 10.180 -12.048 9.004 1.00 0.60 C ATOM 2389 CD2 LEU B 81 8.986 -14.187 9.478 1.00 0.37 C ATOM 0 H LEU B 81 9.773 -10.250 11.695 1.00 0.23 H new ATOM 0 HA LEU B 81 7.533 -10.635 9.947 1.00 0.23 H new ATOM 0 HB2 LEU B 81 9.586 -12.103 11.478 1.00 0.25 H new ATOM 0 HB3 LEU B 81 8.064 -12.974 11.493 1.00 0.25 H new ATOM 0 HG LEU B 81 8.052 -12.342 8.886 1.00 0.31 H new ATOM 0 HD11 LEU B 81 10.355 -12.368 7.977 1.00 0.60 H new ATOM 0 HD12 LEU B 81 10.105 -10.961 9.038 1.00 0.60 H new ATOM 0 HD13 LEU B 81 11.010 -12.374 9.631 1.00 0.60 H new ATOM 0 HD21 LEU B 81 9.160 -14.513 8.453 1.00 0.37 H new ATOM 0 HD22 LEU B 81 9.816 -14.510 10.107 1.00 0.37 H new ATOM 0 HD23 LEU B 81 8.059 -14.627 9.847 1.00 0.37 H new ATOM 2401 N ARG B 82 6.828 -10.783 13.128 1.00 0.24 N ATOM 2402 CA ARG B 82 5.663 -10.812 14.052 1.00 0.28 C ATOM 2403 C ARG B 82 4.765 -9.621 13.720 1.00 0.29 C ATOM 2404 O ARG B 82 3.551 -9.705 13.761 1.00 0.33 O ATOM 2405 CB ARG B 82 6.252 -10.677 15.458 1.00 0.29 C ATOM 2406 CG ARG B 82 5.329 -11.363 16.469 1.00 0.38 C ATOM 2407 CD ARG B 82 5.871 -12.757 16.797 1.00 0.46 C ATOM 2408 NE ARG B 82 6.486 -12.623 18.147 1.00 0.50 N ATOM 2409 CZ ARG B 82 7.631 -12.012 18.285 1.00 0.49 C ATOM 2410 NH1 ARG B 82 8.746 -12.665 18.095 1.00 0.60 N ATOM 2411 NH2 ARG B 82 7.662 -10.750 18.613 1.00 0.58 N ATOM 0 H ARG B 82 7.731 -10.614 13.570 1.00 0.24 H new ATOM 0 HA ARG B 82 5.068 -11.721 13.970 1.00 0.28 H new ATOM 0 HB2 ARG B 82 7.244 -11.127 15.492 1.00 0.29 H new ATOM 0 HB3 ARG B 82 6.370 -9.624 15.714 1.00 0.29 H new ATOM 0 HG2 ARG B 82 5.261 -10.765 17.378 1.00 0.38 H new ATOM 0 HG3 ARG B 82 4.321 -11.440 16.062 1.00 0.38 H new ATOM 0 HD2 ARG B 82 5.074 -13.500 16.798 1.00 0.46 H new ATOM 0 HD3 ARG B 82 6.606 -13.079 16.059 1.00 0.46 H new ATOM 0 HE ARG B 82 6.012 -13.009 18.964 1.00 0.50 H new ATOM 0 HH11 ARG B 82 8.722 -13.652 17.839 1.00 0.60 H new ATOM 0 HH12 ARG B 82 9.641 -12.188 18.203 1.00 0.60 H new ATOM 0 HH21 ARG B 82 6.791 -10.240 18.762 1.00 0.58 H new ATOM 0 HH22 ARG B 82 8.557 -10.273 18.721 1.00 0.58 H new ATOM 2425 N GLY B 83 5.373 -8.515 13.362 1.00 0.29 N ATOM 2426 CA GLY B 83 4.590 -7.305 12.989 1.00 0.32 C ATOM 2427 C GLY B 83 3.945 -7.548 11.626 1.00 0.29 C ATOM 2428 O GLY B 83 2.873 -7.052 11.341 1.00 0.32 O ATOM 0 H GLY B 83 6.386 -8.403 13.313 1.00 0.29 H new ATOM 0 HA2 GLY B 83 3.826 -7.102 13.739 1.00 0.32 H new ATOM 0 HA3 GLY B 83 5.239 -6.430 12.951 1.00 0.32 H new ATOM 2432 N PHE B 84 4.587 -8.331 10.789 1.00 0.27 N ATOM 2433 CA PHE B 84 4.007 -8.635 9.448 1.00 0.27 C ATOM 2434 C PHE B 84 2.658 -9.323 9.648 1.00 0.28 C ATOM 2435 O PHE B 84 1.671 -8.970 9.031 1.00 0.33 O ATOM 2436 CB PHE B 84 5.001 -9.589 8.777 1.00 0.29 C ATOM 2437 CG PHE B 84 5.820 -8.851 7.757 1.00 0.30 C ATOM 2438 CD1 PHE B 84 6.911 -8.077 8.166 1.00 0.37 C ATOM 2439 CD2 PHE B 84 5.500 -8.952 6.399 1.00 0.51 C ATOM 2440 CE1 PHE B 84 7.681 -7.403 7.217 1.00 0.46 C ATOM 2441 CE2 PHE B 84 6.272 -8.280 5.450 1.00 0.61 C ATOM 2442 CZ PHE B 84 7.362 -7.505 5.861 1.00 0.52 C ATOM 0 H PHE B 84 5.487 -8.771 10.980 1.00 0.27 H new ATOM 0 HA PHE B 84 3.849 -7.743 8.841 1.00 0.27 H new ATOM 0 HB2 PHE B 84 5.655 -10.032 9.528 1.00 0.29 H new ATOM 0 HB3 PHE B 84 4.464 -10.408 8.299 1.00 0.29 H new ATOM 0 HD1 PHE B 84 7.157 -8.001 9.215 1.00 0.37 H new ATOM 0 HD2 PHE B 84 4.657 -9.549 6.085 1.00 0.51 H new ATOM 0 HE1 PHE B 84 8.523 -6.803 7.531 1.00 0.46 H new ATOM 0 HE2 PHE B 84 6.029 -8.358 4.401 1.00 0.61 H new ATOM 0 HZ PHE B 84 7.959 -6.984 5.127 1.00 0.52 H new ATOM 2452 N ARG B 85 2.614 -10.292 10.529 1.00 0.28 N ATOM 2453 CA ARG B 85 1.332 -11.003 10.806 1.00 0.32 C ATOM 2454 C ARG B 85 0.317 -10.010 11.374 1.00 0.33 C ATOM 2455 O ARG B 85 -0.816 -9.946 10.936 1.00 0.39 O ATOM 2456 CB ARG B 85 1.679 -12.072 11.843 1.00 0.37 C ATOM 2457 CG ARG B 85 0.688 -13.233 11.733 1.00 0.42 C ATOM 2458 CD ARG B 85 -0.449 -13.032 12.737 1.00 0.53 C ATOM 2459 NE ARG B 85 -1.406 -14.141 12.461 1.00 0.64 N ATOM 2460 CZ ARG B 85 -2.642 -14.053 12.870 1.00 0.51 C ATOM 2461 NH1 ARG B 85 -3.529 -13.437 12.139 1.00 0.69 N ATOM 2462 NH2 ARG B 85 -2.991 -14.584 14.010 1.00 0.59 N ATOM 0 H ARG B 85 3.415 -10.621 11.069 1.00 0.28 H new ATOM 0 HA ARG B 85 0.894 -11.445 9.911 1.00 0.32 H new ATOM 0 HB2 ARG B 85 2.696 -12.432 11.684 1.00 0.37 H new ATOM 0 HB3 ARG B 85 1.645 -11.645 12.845 1.00 0.37 H new ATOM 0 HG2 ARG B 85 0.288 -13.288 10.721 1.00 0.42 H new ATOM 0 HG3 ARG B 85 1.196 -14.178 11.927 1.00 0.42 H new ATOM 0 HD2 ARG B 85 -0.082 -13.073 13.763 1.00 0.53 H new ATOM 0 HD3 ARG B 85 -0.923 -12.059 12.607 1.00 0.53 H new ATOM 0 HE ARG B 85 -1.095 -14.969 11.952 1.00 0.64 H new ATOM 0 HH11 ARG B 85 -3.257 -13.024 11.247 1.00 0.69 H new ATOM 0 HH12 ARG B 85 -4.495 -13.368 12.459 1.00 0.69 H new ATOM 0 HH21 ARG B 85 -2.298 -15.068 14.581 1.00 0.59 H new ATOM 0 HH22 ARG B 85 -3.957 -14.515 14.330 1.00 0.59 H new ATOM 2476 N LYS B 86 0.725 -9.221 12.338 1.00 0.32 N ATOM 2477 CA LYS B 86 -0.208 -8.213 12.926 1.00 0.35 C ATOM 2478 C LYS B 86 -0.661 -7.247 11.828 1.00 0.33 C ATOM 2479 O LYS B 86 -1.796 -6.810 11.800 1.00 0.38 O ATOM 2480 CB LYS B 86 0.610 -7.476 13.991 1.00 0.38 C ATOM 2481 CG LYS B 86 0.087 -7.843 15.382 1.00 0.49 C ATOM 2482 CD LYS B 86 0.721 -9.160 15.833 1.00 0.62 C ATOM 2483 CE LYS B 86 0.034 -10.327 15.121 1.00 0.55 C ATOM 2484 NZ LYS B 86 0.017 -11.431 16.120 1.00 0.57 N ATOM 0 H LYS B 86 1.662 -9.232 12.741 1.00 0.32 H new ATOM 0 HA LYS B 86 -1.101 -8.666 13.356 1.00 0.35 H new ATOM 0 HB2 LYS B 86 1.663 -7.743 13.905 1.00 0.38 H new ATOM 0 HB3 LYS B 86 0.541 -6.399 13.837 1.00 0.38 H new ATOM 0 HG2 LYS B 86 0.324 -7.051 16.092 1.00 0.49 H new ATOM 0 HG3 LYS B 86 -0.999 -7.938 15.361 1.00 0.49 H new ATOM 0 HD2 LYS B 86 1.787 -9.159 15.607 1.00 0.62 H new ATOM 0 HD3 LYS B 86 0.624 -9.271 16.913 1.00 0.62 H new ATOM 0 HE2 LYS B 86 -0.976 -10.060 14.810 1.00 0.55 H new ATOM 0 HE3 LYS B 86 0.578 -10.616 14.222 1.00 0.55 H new ATOM 0 HZ1 LYS B 86 -0.499 -12.245 15.729 1.00 0.57 H new ATOM 0 HZ2 LYS B 86 0.993 -11.714 16.341 1.00 0.57 H new ATOM 0 HZ3 LYS B 86 -0.455 -11.106 16.988 1.00 0.57 H new ATOM 2498 N GLU B 87 0.224 -6.930 10.917 1.00 0.31 N ATOM 2499 CA GLU B 87 -0.136 -6.008 9.800 1.00 0.32 C ATOM 2500 C GLU B 87 -1.065 -6.732 8.824 1.00 0.31 C ATOM 2501 O GLU B 87 -2.008 -6.160 8.311 1.00 0.34 O ATOM 2502 CB GLU B 87 1.191 -5.660 9.124 1.00 0.36 C ATOM 2503 CG GLU B 87 1.920 -4.592 9.942 1.00 0.42 C ATOM 2504 CD GLU B 87 1.684 -3.216 9.316 1.00 0.44 C ATOM 2505 OE1 GLU B 87 2.356 -2.905 8.346 1.00 0.50 O ATOM 2506 OE2 GLU B 87 0.834 -2.497 9.816 1.00 0.55 O ATOM 0 H GLU B 87 1.185 -7.272 10.900 1.00 0.31 H new ATOM 0 HA GLU B 87 -0.656 -5.113 10.144 1.00 0.32 H new ATOM 0 HB2 GLU B 87 1.811 -6.552 9.037 1.00 0.36 H new ATOM 0 HB3 GLU B 87 1.011 -5.297 8.112 1.00 0.36 H new ATOM 0 HG2 GLU B 87 1.562 -4.601 10.971 1.00 0.42 H new ATOM 0 HG3 GLU B 87 2.988 -4.810 9.974 1.00 0.42 H new ATOM 2513 N ILE B 88 -0.810 -7.994 8.578 1.00 0.31 N ATOM 2514 CA ILE B 88 -1.684 -8.766 7.649 1.00 0.31 C ATOM 2515 C ILE B 88 -3.072 -8.912 8.285 1.00 0.31 C ATOM 2516 O ILE B 88 -4.087 -8.713 7.640 1.00 0.34 O ATOM 2517 CB ILE B 88 -0.961 -10.119 7.448 1.00 0.32 C ATOM 2518 CG1 ILE B 88 -0.914 -10.443 5.952 1.00 0.36 C ATOM 2519 CG2 ILE B 88 -1.663 -11.266 8.192 1.00 0.32 C ATOM 2520 CD1 ILE B 88 0.446 -10.033 5.383 1.00 0.50 C ATOM 0 H ILE B 88 -0.035 -8.520 8.981 1.00 0.31 H new ATOM 0 HA ILE B 88 -1.842 -8.285 6.684 1.00 0.31 H new ATOM 0 HB ILE B 88 0.045 -10.025 7.857 1.00 0.32 H new ATOM 0 HG12 ILE B 88 -1.080 -11.509 5.795 1.00 0.36 H new ATOM 0 HG13 ILE B 88 -1.712 -9.916 5.430 1.00 0.36 H new ATOM 0 HG21 ILE B 88 -1.120 -12.196 8.022 1.00 0.32 H new ATOM 0 HG22 ILE B 88 -1.684 -11.048 9.260 1.00 0.32 H new ATOM 0 HG23 ILE B 88 -2.683 -11.369 7.823 1.00 0.32 H new ATOM 0 HD11 ILE B 88 0.479 -10.264 4.318 1.00 0.50 H new ATOM 0 HD12 ILE B 88 0.593 -8.963 5.527 1.00 0.50 H new ATOM 0 HD13 ILE B 88 1.236 -10.580 5.898 1.00 0.50 H new ATOM 2532 N GLY B 89 -3.119 -9.229 9.557 1.00 0.30 N ATOM 2533 CA GLY B 89 -4.433 -9.359 10.253 1.00 0.31 C ATOM 2534 C GLY B 89 -5.152 -8.015 10.159 1.00 0.30 C ATOM 2535 O GLY B 89 -6.359 -7.945 10.008 1.00 0.33 O ATOM 0 H GLY B 89 -2.302 -9.403 10.142 1.00 0.30 H new ATOM 0 HA2 GLY B 89 -5.032 -10.145 9.792 1.00 0.31 H new ATOM 0 HA3 GLY B 89 -4.286 -9.640 11.296 1.00 0.31 H new ATOM 2539 N ARG B 90 -4.402 -6.946 10.225 1.00 0.30 N ATOM 2540 CA ARG B 90 -5.011 -5.592 10.116 1.00 0.30 C ATOM 2541 C ARG B 90 -5.521 -5.388 8.691 1.00 0.28 C ATOM 2542 O ARG B 90 -6.553 -4.779 8.475 1.00 0.30 O ATOM 2543 CB ARG B 90 -3.874 -4.615 10.413 1.00 0.32 C ATOM 2544 CG ARG B 90 -3.835 -4.302 11.908 1.00 0.37 C ATOM 2545 CD ARG B 90 -2.647 -3.382 12.197 1.00 0.46 C ATOM 2546 NE ARG B 90 -2.217 -3.725 13.582 1.00 0.55 N ATOM 2547 CZ ARG B 90 -1.308 -3.004 14.181 1.00 0.51 C ATOM 2548 NH1 ARG B 90 -0.043 -3.257 13.988 1.00 0.76 N ATOM 2549 NH2 ARG B 90 -1.665 -2.028 14.971 1.00 0.77 N ATOM 0 H ARG B 90 -3.390 -6.955 10.350 1.00 0.30 H new ATOM 0 HA ARG B 90 -5.850 -5.452 10.798 1.00 0.30 H new ATOM 0 HB2 ARG B 90 -2.923 -5.044 10.097 1.00 0.32 H new ATOM 0 HB3 ARG B 90 -4.014 -3.696 9.844 1.00 0.32 H new ATOM 0 HG2 ARG B 90 -4.765 -3.824 12.216 1.00 0.37 H new ATOM 0 HG3 ARG B 90 -3.745 -5.224 12.483 1.00 0.37 H new ATOM 0 HD2 ARG B 90 -1.840 -3.544 11.482 1.00 0.46 H new ATOM 0 HD3 ARG B 90 -2.933 -2.333 12.122 1.00 0.46 H new ATOM 0 HE ARG B 90 -2.633 -4.523 14.062 1.00 0.55 H new ATOM 0 HH11 ARG B 90 0.236 -4.018 13.369 1.00 0.76 H new ATOM 0 HH12 ARG B 90 0.667 -2.694 14.456 1.00 0.76 H new ATOM 0 HH21 ARG B 90 -2.654 -1.829 15.120 1.00 0.77 H new ATOM 0 HH22 ARG B 90 -0.955 -1.465 15.439 1.00 0.77 H new ATOM 2563 N MET B 91 -4.808 -5.919 7.720 1.00 0.27 N ATOM 2564 CA MET B 91 -5.243 -5.780 6.300 1.00 0.27 C ATOM 2565 C MET B 91 -6.635 -6.378 6.168 1.00 0.24 C ATOM 2566 O MET B 91 -7.493 -5.851 5.487 1.00 0.26 O ATOM 2567 CB MET B 91 -4.219 -6.571 5.479 1.00 0.30 C ATOM 2568 CG MET B 91 -3.789 -5.746 4.264 1.00 0.46 C ATOM 2569 SD MET B 91 -2.588 -6.686 3.288 1.00 0.53 S ATOM 2570 CE MET B 91 -1.103 -6.171 4.188 1.00 0.57 C ATOM 0 H MET B 91 -3.943 -6.442 7.856 1.00 0.27 H new ATOM 0 HA MET B 91 -5.289 -4.745 5.960 1.00 0.27 H new ATOM 0 HB2 MET B 91 -3.352 -6.811 6.094 1.00 0.30 H new ATOM 0 HB3 MET B 91 -4.651 -7.518 5.154 1.00 0.30 H new ATOM 0 HG2 MET B 91 -4.657 -5.500 3.653 1.00 0.46 H new ATOM 0 HG3 MET B 91 -3.350 -4.802 4.589 1.00 0.46 H new ATOM 0 HE1 MET B 91 -0.523 -5.485 3.571 1.00 0.57 H new ATOM 0 HE2 MET B 91 -1.393 -5.671 5.112 1.00 0.57 H new ATOM 0 HE3 MET B 91 -0.498 -7.047 4.424 1.00 0.57 H new ATOM 2580 N LEU B 92 -6.863 -7.463 6.857 1.00 0.24 N ATOM 2581 CA LEU B 92 -8.203 -8.103 6.827 1.00 0.25 C ATOM 2582 C LEU B 92 -9.200 -7.162 7.472 1.00 0.26 C ATOM 2583 O LEU B 92 -10.285 -6.951 6.961 1.00 0.29 O ATOM 2584 CB LEU B 92 -8.038 -9.386 7.618 1.00 0.29 C ATOM 2585 CG LEU B 92 -7.053 -10.261 6.859 1.00 0.32 C ATOM 2586 CD1 LEU B 92 -6.243 -11.111 7.843 1.00 0.42 C ATOM 2587 CD2 LEU B 92 -7.818 -11.171 5.891 1.00 0.37 C ATOM 0 H LEU B 92 -6.173 -7.934 7.442 1.00 0.24 H new ATOM 0 HA LEU B 92 -8.569 -8.317 5.823 1.00 0.25 H new ATOM 0 HB2 LEU B 92 -7.670 -9.174 8.622 1.00 0.29 H new ATOM 0 HB3 LEU B 92 -8.996 -9.894 7.731 1.00 0.29 H new ATOM 0 HG LEU B 92 -6.369 -9.627 6.295 1.00 0.32 H new ATOM 0 HD11 LEU B 92 -5.540 -11.735 7.292 1.00 0.42 H new ATOM 0 HD12 LEU B 92 -5.694 -10.458 8.522 1.00 0.42 H new ATOM 0 HD13 LEU B 92 -6.918 -11.746 8.417 1.00 0.42 H new ATOM 0 HD21 LEU B 92 -7.112 -11.798 5.347 1.00 0.37 H new ATOM 0 HD22 LEU B 92 -8.507 -11.802 6.453 1.00 0.37 H new ATOM 0 HD23 LEU B 92 -8.380 -10.560 5.185 1.00 0.37 H new ATOM 2599 N ASN B 93 -8.818 -6.553 8.570 1.00 0.27 N ATOM 2600 CA ASN B 93 -9.724 -5.571 9.226 1.00 0.30 C ATOM 2601 C ASN B 93 -10.125 -4.529 8.179 1.00 0.28 C ATOM 2602 O ASN B 93 -11.182 -3.929 8.252 1.00 0.31 O ATOM 2603 CB ASN B 93 -8.895 -4.932 10.343 1.00 0.34 C ATOM 2604 CG ASN B 93 -9.714 -4.899 11.634 1.00 0.41 C ATOM 2605 OD1 ASN B 93 -10.593 -4.075 11.789 1.00 0.52 O ATOM 2606 ND2 ASN B 93 -9.460 -5.768 12.574 1.00 0.59 N ATOM 0 H ASN B 93 -7.921 -6.696 9.035 1.00 0.27 H new ATOM 0 HA ASN B 93 -10.632 -6.019 9.630 1.00 0.30 H new ATOM 0 HB2 ASN B 93 -7.976 -5.498 10.497 1.00 0.34 H new ATOM 0 HB3 ASN B 93 -8.603 -3.921 10.060 1.00 0.34 H new ATOM 0 HD21 ASN B 93 -10.000 -5.756 13.439 1.00 0.59 H new ATOM 0 HD22 ASN B 93 -8.722 -6.460 12.443 1.00 0.59 H new ATOM 2613 N ILE B 94 -9.280 -4.334 7.188 1.00 0.27 N ATOM 2614 CA ILE B 94 -9.600 -3.356 6.108 1.00 0.28 C ATOM 2615 C ILE B 94 -10.462 -4.021 5.028 1.00 0.26 C ATOM 2616 O ILE B 94 -11.362 -3.400 4.495 1.00 0.30 O ATOM 2617 CB ILE B 94 -8.262 -2.904 5.501 1.00 0.31 C ATOM 2618 CG1 ILE B 94 -7.192 -2.786 6.598 1.00 0.36 C ATOM 2619 CG2 ILE B 94 -8.463 -1.548 4.816 1.00 0.35 C ATOM 2620 CD1 ILE B 94 -6.159 -1.710 6.237 1.00 0.50 C ATOM 0 H ILE B 94 -8.385 -4.813 7.086 1.00 0.27 H new ATOM 0 HA ILE B 94 -10.157 -2.509 6.508 1.00 0.28 H new ATOM 0 HB ILE B 94 -7.925 -3.640 4.771 1.00 0.31 H new ATOM 0 HG12 ILE B 94 -7.665 -2.539 7.548 1.00 0.36 H new ATOM 0 HG13 ILE B 94 -6.693 -3.746 6.731 1.00 0.36 H new ATOM 0 HG21 ILE B 94 -7.520 -1.217 4.381 1.00 0.35 H new ATOM 0 HG22 ILE B 94 -9.211 -1.645 4.029 1.00 0.35 H new ATOM 0 HG23 ILE B 94 -8.801 -0.816 5.550 1.00 0.35 H new ATOM 0 HD11 ILE B 94 -5.411 -1.644 7.027 1.00 0.50 H new ATOM 0 HD12 ILE B 94 -5.672 -1.974 5.298 1.00 0.50 H new ATOM 0 HD13 ILE B 94 -6.659 -0.747 6.129 1.00 0.50 H new ATOM 2632 N LEU B 95 -10.201 -5.269 4.682 1.00 0.24 N ATOM 2633 CA LEU B 95 -11.038 -5.909 3.615 1.00 0.25 C ATOM 2634 C LEU B 95 -12.210 -6.693 4.221 1.00 0.27 C ATOM 2635 O LEU B 95 -12.856 -7.472 3.545 1.00 0.35 O ATOM 2636 CB LEU B 95 -10.102 -6.828 2.824 1.00 0.27 C ATOM 2637 CG LEU B 95 -9.462 -7.858 3.748 1.00 0.29 C ATOM 2638 CD1 LEU B 95 -10.070 -9.236 3.480 1.00 0.36 C ATOM 2639 CD2 LEU B 95 -7.955 -7.903 3.478 1.00 0.34 C ATOM 0 H LEU B 95 -9.466 -5.853 5.081 1.00 0.24 H new ATOM 0 HA LEU B 95 -11.484 -5.156 2.966 1.00 0.25 H new ATOM 0 HB2 LEU B 95 -10.660 -7.334 2.036 1.00 0.27 H new ATOM 0 HB3 LEU B 95 -9.327 -6.236 2.337 1.00 0.27 H new ATOM 0 HG LEU B 95 -9.643 -7.582 4.787 1.00 0.29 H new ATOM 0 HD11 LEU B 95 -9.611 -9.971 4.141 1.00 0.36 H new ATOM 0 HD12 LEU B 95 -11.144 -9.202 3.664 1.00 0.36 H new ATOM 0 HD13 LEU B 95 -9.889 -9.518 2.443 1.00 0.36 H new ATOM 0 HD21 LEU B 95 -7.489 -8.638 4.135 1.00 0.34 H new ATOM 0 HD22 LEU B 95 -7.780 -8.183 2.439 1.00 0.34 H new ATOM 0 HD23 LEU B 95 -7.522 -6.921 3.667 1.00 0.34 H new ATOM 2651 N ASN B 96 -12.504 -6.474 5.481 1.00 0.28 N ATOM 2652 CA ASN B 96 -13.655 -7.183 6.126 1.00 0.33 C ATOM 2653 C ASN B 96 -14.728 -6.172 6.547 1.00 0.37 C ATOM 2654 O ASN B 96 -15.744 -6.533 7.112 1.00 0.45 O ATOM 2655 CB ASN B 96 -13.072 -7.878 7.355 1.00 0.37 C ATOM 2656 CG ASN B 96 -12.417 -9.193 6.932 1.00 0.45 C ATOM 2657 OD1 ASN B 96 -11.259 -9.520 7.431 1.00 0.61 O flip ATOM 2658 ND2 ASN B 96 -12.967 -9.932 6.140 1.00 0.51 N flip ATOM 0 H ASN B 96 -11.996 -5.834 6.091 1.00 0.28 H new ATOM 0 HA ASN B 96 -14.127 -7.893 5.447 1.00 0.33 H new ATOM 0 HB2 ASN B 96 -12.338 -7.232 7.838 1.00 0.37 H new ATOM 0 HB3 ASN B 96 -13.858 -8.069 8.086 1.00 0.37 H new ATOM 0 HD21 ASN B 96 -13.874 -9.676 5.749 1.00 0.51 H new ATOM 0 HD22 ASN B 96 -12.522 -10.808 5.866 1.00 0.51 H new