USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=16 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 167:sc= -1.94 (180deg=-3.17!) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.0168 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ -125:sc= -1.77! (180deg=-3.89!) USER MOD Single : A 74 LYS NZ :NH3+ -129:sc= 0.928 (180deg=-1.46) USER MOD Single : A 75 SER OG : rot 180:sc= -1.29 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 1.13 K(o=1.1,f=-1.4) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl -111:sc= 0 (180deg=-2.14!) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 ASN : amide:sc= -0.401 X(o=-0.4,f=-0.15) USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 MET CE :methyl -174:sc= -1.65 (180deg=-2.09) USER MOD Single : B 58 THR OG1 : rot 180:sc= -0.0214 USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 THR OG1 : rot 180:sc= 0 USER MOD Single : B 73 LYS NZ :NH3+ 153:sc= -2.27! (180deg=-4.12!) USER MOD Single : B 74 LYS NZ :NH3+ -129:sc= 1.05 (180deg=-1.5) USER MOD Single : B 75 SER OG : rot 180:sc= -1.43 USER MOD Single : B 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 79 ASN : amide:sc= 1.08 K(o=1.1,f=-1.1) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 MET CE :methyl -107:sc= 0 (180deg=-2.1!) USER MOD Single : B 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 96 ASN : amide:sc= -0.443 X(o=-0.44,f=-0.16) USER MOD ----------------------------------------------------------------- ATOM 357 N PRO A 43 -1.831 -18.498 -6.804 1.00 0.40 N ATOM 358 CA PRO A 43 -1.691 -17.762 -5.530 1.00 0.36 C ATOM 359 C PRO A 43 -2.525 -16.478 -5.558 1.00 0.31 C ATOM 360 O PRO A 43 -3.171 -16.128 -4.589 1.00 0.33 O ATOM 361 CB PRO A 43 -0.202 -17.438 -5.472 1.00 0.44 C ATOM 362 CG PRO A 43 0.267 -17.427 -6.897 1.00 0.49 C ATOM 363 CD PRO A 43 -0.727 -18.206 -7.727 1.00 0.47 C ATOM 0 HA PRO A 43 -2.037 -18.329 -4.666 1.00 0.36 H new ATOM 0 HB2 PRO A 43 -0.030 -16.473 -4.996 1.00 0.44 H new ATOM 0 HB3 PRO A 43 0.338 -18.183 -4.888 1.00 0.44 H new ATOM 0 HG2 PRO A 43 0.348 -16.403 -7.263 1.00 0.49 H new ATOM 0 HG3 PRO A 43 1.259 -17.873 -6.974 1.00 0.49 H new ATOM 0 HD2 PRO A 43 -1.069 -17.626 -8.584 1.00 0.47 H new ATOM 0 HD3 PRO A 43 -0.285 -19.122 -8.119 1.00 0.47 H new ATOM 371 N LEU A 44 -2.503 -15.774 -6.663 1.00 0.32 N ATOM 372 CA LEU A 44 -3.280 -14.499 -6.780 1.00 0.32 C ATOM 373 C LEU A 44 -2.901 -13.527 -5.657 1.00 0.31 C ATOM 374 O LEU A 44 -3.629 -12.601 -5.355 1.00 0.51 O ATOM 375 CB LEU A 44 -4.753 -14.897 -6.666 1.00 0.36 C ATOM 376 CG LEU A 44 -5.624 -13.717 -7.107 1.00 0.47 C ATOM 377 CD1 LEU A 44 -6.670 -14.196 -8.117 1.00 0.53 C ATOM 378 CD2 LEU A 44 -6.329 -13.111 -5.889 1.00 0.56 C ATOM 0 H LEU A 44 -1.975 -16.030 -7.497 1.00 0.32 H new ATOM 0 HA LEU A 44 -3.071 -13.991 -7.722 1.00 0.32 H new ATOM 0 HB2 LEU A 44 -4.957 -15.768 -7.288 1.00 0.36 H new ATOM 0 HB3 LEU A 44 -4.989 -15.176 -5.639 1.00 0.36 H new ATOM 0 HG LEU A 44 -4.992 -12.961 -7.572 1.00 0.47 H new ATOM 0 HD11 LEU A 44 -7.288 -13.354 -8.428 1.00 0.53 H new ATOM 0 HD12 LEU A 44 -6.168 -14.619 -8.987 1.00 0.53 H new ATOM 0 HD13 LEU A 44 -7.300 -14.957 -7.656 1.00 0.53 H new ATOM 0 HD21 LEU A 44 -6.948 -12.272 -6.207 1.00 0.56 H new ATOM 0 HD22 LEU A 44 -6.957 -13.867 -5.419 1.00 0.56 H new ATOM 0 HD23 LEU A 44 -5.584 -12.762 -5.174 1.00 0.56 H new ATOM 390 N LYS A 45 -1.762 -13.726 -5.047 1.00 0.29 N ATOM 391 CA LYS A 45 -1.327 -12.812 -3.950 1.00 0.28 C ATOM 392 C LYS A 45 -0.452 -11.691 -4.521 1.00 0.26 C ATOM 393 O LYS A 45 -0.251 -10.676 -3.889 1.00 0.31 O ATOM 394 CB LYS A 45 -0.532 -13.693 -2.978 1.00 0.31 C ATOM 395 CG LYS A 45 0.790 -14.129 -3.620 1.00 0.37 C ATOM 396 CD LYS A 45 1.578 -14.988 -2.630 1.00 0.53 C ATOM 397 CE LYS A 45 1.164 -16.453 -2.781 1.00 0.51 C ATOM 398 NZ LYS A 45 1.787 -17.150 -1.621 1.00 0.45 N ATOM 0 H LYS A 45 -1.113 -14.483 -5.262 1.00 0.29 H new ATOM 0 HA LYS A 45 -2.168 -12.332 -3.450 1.00 0.28 H new ATOM 0 HB2 LYS A 45 -0.334 -13.144 -2.057 1.00 0.31 H new ATOM 0 HB3 LYS A 45 -1.120 -14.570 -2.707 1.00 0.31 H new ATOM 0 HG2 LYS A 45 0.595 -14.693 -4.532 1.00 0.37 H new ATOM 0 HG3 LYS A 45 1.375 -13.254 -3.905 1.00 0.37 H new ATOM 0 HD2 LYS A 45 2.648 -14.881 -2.811 1.00 0.53 H new ATOM 0 HD3 LYS A 45 1.392 -14.650 -1.611 1.00 0.53 H new ATOM 0 HE2 LYS A 45 0.079 -16.560 -2.770 1.00 0.51 H new ATOM 0 HE3 LYS A 45 1.516 -16.867 -3.726 1.00 0.51 H new ATOM 0 HZ1 LYS A 45 1.548 -18.162 -1.655 1.00 0.45 H new ATOM 0 HZ2 LYS A 45 2.820 -17.037 -1.662 1.00 0.45 H new ATOM 0 HZ3 LYS A 45 1.428 -16.739 -0.736 1.00 0.45 H new ATOM 412 N LEU A 46 0.067 -11.880 -5.713 1.00 0.24 N ATOM 413 CA LEU A 46 0.938 -10.844 -6.359 1.00 0.24 C ATOM 414 C LEU A 46 0.373 -9.428 -6.151 1.00 0.23 C ATOM 415 O LEU A 46 1.115 -8.480 -5.958 1.00 0.27 O ATOM 416 CB LEU A 46 0.929 -11.208 -7.848 1.00 0.27 C ATOM 417 CG LEU A 46 2.365 -11.245 -8.383 1.00 0.46 C ATOM 418 CD1 LEU A 46 2.798 -12.698 -8.589 1.00 0.62 C ATOM 419 CD2 LEU A 46 2.430 -10.504 -9.722 1.00 0.66 C ATOM 0 H LEU A 46 -0.078 -12.720 -6.273 1.00 0.24 H new ATOM 0 HA LEU A 46 1.941 -10.836 -5.933 1.00 0.24 H new ATOM 0 HB2 LEU A 46 0.453 -12.178 -7.992 1.00 0.27 H new ATOM 0 HB3 LEU A 46 0.342 -10.479 -8.406 1.00 0.27 H new ATOM 0 HG LEU A 46 3.030 -10.765 -7.665 1.00 0.46 H new ATOM 0 HD11 LEU A 46 3.819 -12.723 -8.969 1.00 0.62 H new ATOM 0 HD12 LEU A 46 2.752 -13.230 -7.639 1.00 0.62 H new ATOM 0 HD13 LEU A 46 2.132 -13.178 -9.306 1.00 0.62 H new ATOM 0 HD21 LEU A 46 3.451 -10.530 -10.103 1.00 0.66 H new ATOM 0 HD22 LEU A 46 1.763 -10.986 -10.437 1.00 0.66 H new ATOM 0 HD23 LEU A 46 2.122 -9.468 -9.580 1.00 0.66 H new ATOM 431 N PHE A 47 -0.931 -9.284 -6.163 1.00 0.22 N ATOM 432 CA PHE A 47 -1.537 -7.937 -5.948 1.00 0.22 C ATOM 433 C PHE A 47 -1.495 -7.621 -4.460 1.00 0.22 C ATOM 434 O PHE A 47 -1.107 -6.545 -4.045 1.00 0.28 O ATOM 435 CB PHE A 47 -2.986 -8.057 -6.441 1.00 0.23 C ATOM 436 CG PHE A 47 -3.815 -6.929 -5.864 1.00 0.25 C ATOM 437 CD1 PHE A 47 -3.413 -5.600 -6.049 1.00 0.32 C ATOM 438 CD2 PHE A 47 -4.978 -7.213 -5.136 1.00 0.28 C ATOM 439 CE1 PHE A 47 -4.173 -4.557 -5.507 1.00 0.37 C ATOM 440 CE2 PHE A 47 -5.737 -6.168 -4.593 1.00 0.34 C ATOM 441 CZ PHE A 47 -5.335 -4.841 -4.779 1.00 0.36 C ATOM 0 H PHE A 47 -1.598 -10.041 -6.312 1.00 0.22 H new ATOM 0 HA PHE A 47 -1.012 -7.141 -6.476 1.00 0.22 H new ATOM 0 HB2 PHE A 47 -3.014 -8.022 -7.530 1.00 0.23 H new ATOM 0 HB3 PHE A 47 -3.404 -9.018 -6.142 1.00 0.23 H new ATOM 0 HD1 PHE A 47 -2.517 -5.380 -6.610 1.00 0.32 H new ATOM 0 HD2 PHE A 47 -5.289 -8.237 -4.993 1.00 0.28 H new ATOM 0 HE1 PHE A 47 -3.863 -3.532 -5.650 1.00 0.37 H new ATOM 0 HE2 PHE A 47 -6.633 -6.387 -4.031 1.00 0.34 H new ATOM 0 HZ PHE A 47 -5.921 -4.036 -4.361 1.00 0.36 H new ATOM 451 N MET A 48 -1.887 -8.572 -3.663 1.00 0.25 N ATOM 452 CA MET A 48 -1.877 -8.382 -2.190 1.00 0.28 C ATOM 453 C MET A 48 -0.458 -8.058 -1.726 1.00 0.29 C ATOM 454 O MET A 48 -0.226 -7.071 -1.062 1.00 0.36 O ATOM 455 CB MET A 48 -2.337 -9.732 -1.639 1.00 0.30 C ATOM 456 CG MET A 48 -2.862 -9.577 -0.212 1.00 0.51 C ATOM 457 SD MET A 48 -4.222 -8.368 -0.128 1.00 0.67 S ATOM 458 CE MET A 48 -4.992 -8.679 -1.739 1.00 0.61 C ATOM 0 H MET A 48 -2.218 -9.485 -3.975 1.00 0.25 H new ATOM 0 HA MET A 48 -2.514 -7.563 -1.854 1.00 0.28 H new ATOM 0 HB2 MET A 48 -3.118 -10.145 -2.277 1.00 0.30 H new ATOM 0 HB3 MET A 48 -1.507 -10.439 -1.653 1.00 0.30 H new ATOM 0 HG2 MET A 48 -3.209 -10.543 0.156 1.00 0.51 H new ATOM 0 HG3 MET A 48 -2.051 -9.259 0.443 1.00 0.51 H new ATOM 0 HE1 MET A 48 -5.970 -8.200 -1.773 1.00 0.61 H new ATOM 0 HE2 MET A 48 -4.361 -8.272 -2.529 1.00 0.61 H new ATOM 0 HE3 MET A 48 -5.109 -9.753 -1.885 1.00 0.61 H new ATOM 468 N ALA A 49 0.488 -8.885 -2.087 1.00 0.28 N ATOM 469 CA ALA A 49 1.907 -8.647 -1.688 1.00 0.31 C ATOM 470 C ALA A 49 2.363 -7.253 -2.128 1.00 0.31 C ATOM 471 O ALA A 49 2.983 -6.530 -1.370 1.00 0.35 O ATOM 472 CB ALA A 49 2.704 -9.725 -2.422 1.00 0.36 C ATOM 0 H ALA A 49 0.336 -9.724 -2.647 1.00 0.28 H new ATOM 0 HA ALA A 49 2.044 -8.695 -0.608 1.00 0.31 H new ATOM 0 HB1 ALA A 49 3.762 -9.621 -2.183 1.00 0.36 H new ATOM 0 HB2 ALA A 49 2.356 -10.710 -2.110 1.00 0.36 H new ATOM 0 HB3 ALA A 49 2.562 -9.614 -3.497 1.00 0.36 H new ATOM 478 N LEU A 50 2.063 -6.870 -3.347 1.00 0.30 N ATOM 479 CA LEU A 50 2.485 -5.519 -3.829 1.00 0.32 C ATOM 480 C LEU A 50 1.904 -4.422 -2.928 1.00 0.30 C ATOM 481 O LEU A 50 2.634 -3.659 -2.318 1.00 0.35 O ATOM 482 CB LEU A 50 1.927 -5.403 -5.248 1.00 0.39 C ATOM 483 CG LEU A 50 2.709 -4.338 -6.020 1.00 0.56 C ATOM 484 CD1 LEU A 50 4.173 -4.769 -6.150 1.00 0.89 C ATOM 485 CD2 LEU A 50 2.102 -4.173 -7.415 1.00 0.93 C ATOM 0 H LEU A 50 1.547 -7.432 -4.024 1.00 0.30 H new ATOM 0 HA LEU A 50 3.568 -5.400 -3.810 1.00 0.32 H new ATOM 0 HB2 LEU A 50 2.000 -6.364 -5.758 1.00 0.39 H new ATOM 0 HB3 LEU A 50 0.870 -5.139 -5.214 1.00 0.39 H new ATOM 0 HG LEU A 50 2.657 -3.390 -5.484 1.00 0.56 H new ATOM 0 HD11 LEU A 50 4.728 -4.009 -6.700 1.00 0.89 H new ATOM 0 HD12 LEU A 50 4.607 -4.888 -5.157 1.00 0.89 H new ATOM 0 HD13 LEU A 50 4.227 -5.717 -6.685 1.00 0.89 H new ATOM 0 HD21 LEU A 50 2.658 -3.415 -7.966 1.00 0.93 H new ATOM 0 HD22 LEU A 50 2.155 -5.122 -7.949 1.00 0.93 H new ATOM 0 HD23 LEU A 50 1.060 -3.865 -7.324 1.00 0.93 H new ATOM 497 N VAL A 51 0.598 -4.337 -2.839 1.00 0.30 N ATOM 498 CA VAL A 51 -0.024 -3.292 -1.981 1.00 0.31 C ATOM 499 C VAL A 51 0.398 -3.493 -0.521 1.00 0.30 C ATOM 500 O VAL A 51 0.547 -2.542 0.219 1.00 0.35 O ATOM 501 CB VAL A 51 -1.535 -3.474 -2.150 1.00 0.33 C ATOM 502 CG1 VAL A 51 -2.259 -2.381 -1.377 1.00 0.39 C ATOM 503 CG2 VAL A 51 -1.906 -3.372 -3.634 1.00 0.41 C ATOM 0 H VAL A 51 -0.059 -4.947 -3.325 1.00 0.30 H new ATOM 0 HA VAL A 51 0.286 -2.286 -2.262 1.00 0.31 H new ATOM 0 HB VAL A 51 -1.827 -4.453 -1.771 1.00 0.33 H new ATOM 0 HG11 VAL A 51 -3.336 -2.505 -1.493 1.00 0.39 H new ATOM 0 HG12 VAL A 51 -1.998 -2.448 -0.321 1.00 0.39 H new ATOM 0 HG13 VAL A 51 -1.963 -1.405 -1.762 1.00 0.39 H new ATOM 0 HG21 VAL A 51 -2.982 -3.502 -3.750 1.00 0.41 H new ATOM 0 HG22 VAL A 51 -1.616 -2.393 -4.015 1.00 0.41 H new ATOM 0 HG23 VAL A 51 -1.384 -4.148 -4.194 1.00 0.41 H new ATOM 513 N ALA A 52 0.606 -4.722 -0.106 1.00 0.28 N ATOM 514 CA ALA A 52 1.035 -4.975 1.305 1.00 0.29 C ATOM 515 C ALA A 52 2.421 -4.373 1.533 1.00 0.27 C ATOM 516 O ALA A 52 2.644 -3.661 2.494 1.00 0.31 O ATOM 517 CB ALA A 52 1.079 -6.496 1.461 1.00 0.33 C ATOM 0 H ALA A 52 0.497 -5.557 -0.682 1.00 0.28 H new ATOM 0 HA ALA A 52 0.356 -4.524 2.029 1.00 0.29 H new ATOM 0 HB1 ALA A 52 1.387 -6.749 2.475 1.00 0.33 H new ATOM 0 HB2 ALA A 52 0.089 -6.910 1.269 1.00 0.33 H new ATOM 0 HB3 ALA A 52 1.792 -6.914 0.750 1.00 0.33 H new ATOM 523 N PHE A 53 3.348 -4.640 0.640 1.00 0.27 N ATOM 524 CA PHE A 53 4.723 -4.068 0.779 1.00 0.28 C ATOM 525 C PHE A 53 4.610 -2.553 0.958 1.00 0.30 C ATOM 526 O PHE A 53 5.053 -1.988 1.949 1.00 0.33 O ATOM 527 CB PHE A 53 5.427 -4.412 -0.539 1.00 0.32 C ATOM 528 CG PHE A 53 6.783 -3.747 -0.589 1.00 0.35 C ATOM 529 CD1 PHE A 53 7.692 -3.928 0.459 1.00 0.49 C ATOM 530 CD2 PHE A 53 7.130 -2.948 -1.685 1.00 0.63 C ATOM 531 CE1 PHE A 53 8.948 -3.311 0.412 1.00 0.59 C ATOM 532 CE2 PHE A 53 8.385 -2.331 -1.733 1.00 0.74 C ATOM 533 CZ PHE A 53 9.294 -2.513 -0.684 1.00 0.61 C ATOM 0 H PHE A 53 3.208 -5.231 -0.180 1.00 0.27 H new ATOM 0 HA PHE A 53 5.270 -4.461 1.636 1.00 0.28 H new ATOM 0 HB2 PHE A 53 5.539 -5.492 -0.630 1.00 0.32 H new ATOM 0 HB3 PHE A 53 4.820 -4.082 -1.382 1.00 0.32 H new ATOM 0 HD1 PHE A 53 7.425 -4.544 1.305 1.00 0.49 H new ATOM 0 HD2 PHE A 53 6.428 -2.808 -2.494 1.00 0.63 H new ATOM 0 HE1 PHE A 53 9.649 -3.451 1.221 1.00 0.59 H new ATOM 0 HE2 PHE A 53 8.652 -1.715 -2.579 1.00 0.74 H new ATOM 0 HZ PHE A 53 10.263 -2.037 -0.721 1.00 0.61 H new ATOM 543 N LEU A 54 3.980 -1.897 0.018 1.00 0.32 N ATOM 544 CA LEU A 54 3.792 -0.426 0.134 1.00 0.37 C ATOM 545 C LEU A 54 3.032 -0.127 1.429 1.00 0.41 C ATOM 546 O LEU A 54 3.331 0.819 2.129 1.00 0.47 O ATOM 547 CB LEU A 54 2.969 -0.032 -1.096 1.00 0.41 C ATOM 548 CG LEU A 54 3.902 0.270 -2.274 1.00 0.47 C ATOM 549 CD1 LEU A 54 4.812 1.449 -1.922 1.00 0.59 C ATOM 550 CD2 LEU A 54 4.760 -0.961 -2.579 1.00 0.57 C ATOM 0 H LEU A 54 3.589 -2.319 -0.824 1.00 0.32 H new ATOM 0 HA LEU A 54 4.730 0.128 0.170 1.00 0.37 H new ATOM 0 HB2 LEU A 54 2.285 -0.839 -1.360 1.00 0.41 H new ATOM 0 HB3 LEU A 54 2.359 0.843 -0.871 1.00 0.41 H new ATOM 0 HG LEU A 54 3.304 0.523 -3.149 1.00 0.47 H new ATOM 0 HD11 LEU A 54 5.474 1.661 -2.762 1.00 0.59 H new ATOM 0 HD12 LEU A 54 4.203 2.328 -1.709 1.00 0.59 H new ATOM 0 HD13 LEU A 54 5.408 1.199 -1.044 1.00 0.59 H new ATOM 0 HD21 LEU A 54 5.423 -0.744 -3.417 1.00 0.57 H new ATOM 0 HD22 LEU A 54 5.355 -1.216 -1.702 1.00 0.57 H new ATOM 0 HD23 LEU A 54 4.114 -1.800 -2.835 1.00 0.57 H new ATOM 562 N ARG A 55 2.068 -0.954 1.763 1.00 0.39 N ATOM 563 CA ARG A 55 1.293 -0.748 3.025 1.00 0.45 C ATOM 564 C ARG A 55 2.155 -1.098 4.244 1.00 0.45 C ATOM 565 O ARG A 55 1.744 -0.921 5.375 1.00 0.60 O ATOM 566 CB ARG A 55 0.092 -1.690 2.928 1.00 0.47 C ATOM 567 CG ARG A 55 -0.880 -1.397 4.075 1.00 0.58 C ATOM 568 CD ARG A 55 -0.731 -2.463 5.163 1.00 0.65 C ATOM 569 NE ARG A 55 -1.204 -1.803 6.412 1.00 0.69 N ATOM 570 CZ ARG A 55 -0.584 -2.017 7.540 1.00 0.67 C ATOM 571 NH1 ARG A 55 0.603 -1.513 7.739 1.00 0.62 N ATOM 572 NH2 ARG A 55 -1.153 -2.733 8.472 1.00 0.87 N ATOM 0 H ARG A 55 1.785 -1.765 1.212 1.00 0.39 H new ATOM 0 HA ARG A 55 0.981 0.290 3.144 1.00 0.45 H new ATOM 0 HB2 ARG A 55 -0.410 -1.559 1.969 1.00 0.47 H new ATOM 0 HB3 ARG A 55 0.425 -2.727 2.975 1.00 0.47 H new ATOM 0 HG2 ARG A 55 -0.680 -0.409 4.490 1.00 0.58 H new ATOM 0 HG3 ARG A 55 -1.904 -1.385 3.702 1.00 0.58 H new ATOM 0 HD2 ARG A 55 -1.325 -3.347 4.934 1.00 0.65 H new ATOM 0 HD3 ARG A 55 0.304 -2.790 5.257 1.00 0.65 H new ATOM 0 HE ARG A 55 -2.014 -1.183 6.385 1.00 0.69 H new ATOM 0 HH11 ARG A 55 1.047 -0.951 7.013 1.00 0.62 H new ATOM 0 HH12 ARG A 55 1.087 -1.681 8.621 1.00 0.62 H new ATOM 0 HH21 ARG A 55 -2.082 -3.125 8.318 1.00 0.87 H new ATOM 0 HH22 ARG A 55 -0.668 -2.900 9.354 1.00 0.87 H new ATOM 586 N PHE A 56 3.345 -1.594 4.024 1.00 0.35 N ATOM 587 CA PHE A 56 4.231 -1.948 5.167 1.00 0.36 C ATOM 588 C PHE A 56 5.294 -0.862 5.364 1.00 0.39 C ATOM 589 O PHE A 56 5.890 -0.760 6.420 1.00 0.43 O ATOM 590 CB PHE A 56 4.884 -3.275 4.774 1.00 0.33 C ATOM 591 CG PHE A 56 4.282 -4.398 5.586 1.00 0.32 C ATOM 592 CD1 PHE A 56 2.924 -4.719 5.449 1.00 0.44 C ATOM 593 CD2 PHE A 56 5.084 -5.119 6.478 1.00 0.47 C ATOM 594 CE1 PHE A 56 2.371 -5.760 6.204 1.00 0.48 C ATOM 595 CE2 PHE A 56 4.530 -6.161 7.233 1.00 0.61 C ATOM 596 CZ PHE A 56 3.174 -6.481 7.095 1.00 0.54 C ATOM 0 H PHE A 56 3.740 -1.769 3.100 1.00 0.35 H new ATOM 0 HA PHE A 56 3.681 -2.031 6.105 1.00 0.36 H new ATOM 0 HB2 PHE A 56 4.737 -3.463 3.710 1.00 0.33 H new ATOM 0 HB3 PHE A 56 5.960 -3.227 4.944 1.00 0.33 H new ATOM 0 HD1 PHE A 56 2.305 -4.163 4.761 1.00 0.44 H new ATOM 0 HD2 PHE A 56 6.130 -4.872 6.584 1.00 0.47 H new ATOM 0 HE1 PHE A 56 1.325 -6.007 6.099 1.00 0.48 H new ATOM 0 HE2 PHE A 56 5.149 -6.717 7.921 1.00 0.61 H new ATOM 0 HZ PHE A 56 2.747 -7.285 7.677 1.00 0.54 H new ATOM 606 N LEU A 57 5.552 -0.062 4.352 1.00 0.38 N ATOM 607 CA LEU A 57 6.601 1.002 4.494 1.00 0.42 C ATOM 608 C LEU A 57 5.990 2.411 4.593 1.00 0.49 C ATOM 609 O LEU A 57 6.418 3.212 5.403 1.00 0.58 O ATOM 610 CB LEU A 57 7.466 0.888 3.235 1.00 0.42 C ATOM 611 CG LEU A 57 7.854 -0.575 2.991 1.00 0.38 C ATOM 612 CD1 LEU A 57 8.871 -0.652 1.848 1.00 0.47 C ATOM 613 CD2 LEU A 57 8.473 -1.171 4.261 1.00 0.41 C ATOM 0 H LEU A 57 5.088 -0.099 3.445 1.00 0.38 H new ATOM 0 HA LEU A 57 7.173 0.860 5.411 1.00 0.42 H new ATOM 0 HB2 LEU A 57 6.921 1.276 2.374 1.00 0.42 H new ATOM 0 HB3 LEU A 57 8.364 1.497 3.345 1.00 0.42 H new ATOM 0 HG LEU A 57 6.960 -1.140 2.726 1.00 0.38 H new ATOM 0 HD11 LEU A 57 9.146 -1.692 1.675 1.00 0.47 H new ATOM 0 HD12 LEU A 57 8.431 -0.238 0.941 1.00 0.47 H new ATOM 0 HD13 LEU A 57 9.761 -0.081 2.113 1.00 0.47 H new ATOM 0 HD21 LEU A 57 8.746 -2.211 4.079 1.00 0.41 H new ATOM 0 HD22 LEU A 57 9.364 -0.604 4.532 1.00 0.41 H new ATOM 0 HD23 LEU A 57 7.750 -1.123 5.075 1.00 0.41 H new ATOM 625 N THR A 58 5.019 2.733 3.770 1.00 0.51 N ATOM 626 CA THR A 58 4.421 4.108 3.821 1.00 0.61 C ATOM 627 C THR A 58 2.897 4.070 3.633 1.00 0.61 C ATOM 628 O THR A 58 2.220 5.061 3.834 1.00 0.69 O ATOM 629 CB THR A 58 5.082 4.858 2.663 1.00 0.65 C ATOM 630 OG1 THR A 58 6.489 4.886 2.862 1.00 0.66 O ATOM 631 CG2 THR A 58 4.545 6.287 2.605 1.00 0.87 C ATOM 0 H THR A 58 4.617 2.109 3.070 1.00 0.51 H new ATOM 0 HA THR A 58 4.592 4.585 4.786 1.00 0.61 H new ATOM 0 HB THR A 58 4.857 4.350 1.725 1.00 0.65 H new ATOM 0 HG1 THR A 58 6.915 5.365 2.120 1.00 0.66 H new ATOM 0 HG21 THR A 58 5.017 6.820 1.780 1.00 0.87 H new ATOM 0 HG22 THR A 58 3.466 6.264 2.453 1.00 0.87 H new ATOM 0 HG23 THR A 58 4.768 6.798 3.542 1.00 0.87 H new ATOM 639 N ILE A 59 2.357 2.939 3.259 1.00 0.54 N ATOM 640 CA ILE A 59 0.880 2.814 3.063 1.00 0.55 C ATOM 641 C ILE A 59 0.334 3.890 2.110 1.00 0.58 C ATOM 642 O ILE A 59 -0.453 4.729 2.509 1.00 0.67 O ATOM 643 CB ILE A 59 0.284 2.975 4.459 1.00 0.64 C ATOM 644 CG1 ILE A 59 0.905 1.946 5.403 1.00 0.62 C ATOM 645 CG2 ILE A 59 -1.231 2.756 4.394 1.00 0.71 C ATOM 646 CD1 ILE A 59 2.119 2.562 6.103 1.00 0.62 C ATOM 0 H ILE A 59 2.884 2.084 3.078 1.00 0.54 H new ATOM 0 HA ILE A 59 0.620 1.859 2.606 1.00 0.55 H new ATOM 0 HB ILE A 59 0.493 3.979 4.829 1.00 0.64 H new ATOM 0 HG12 ILE A 59 0.171 1.624 6.141 1.00 0.62 H new ATOM 0 HG13 ILE A 59 1.205 1.059 4.845 1.00 0.62 H new ATOM 0 HG21 ILE A 59 -1.658 2.871 5.390 1.00 0.71 H new ATOM 0 HG22 ILE A 59 -1.676 3.489 3.722 1.00 0.71 H new ATOM 0 HG23 ILE A 59 -1.438 1.752 4.024 1.00 0.71 H new ATOM 0 HD11 ILE A 59 2.562 1.828 6.776 1.00 0.62 H new ATOM 0 HD12 ILE A 59 2.856 2.862 5.358 1.00 0.62 H new ATOM 0 HD13 ILE A 59 1.805 3.436 6.674 1.00 0.62 H new ATOM 658 N PRO A 60 0.753 3.815 0.870 1.00 0.53 N ATOM 659 CA PRO A 60 0.291 4.742 -0.177 1.00 0.57 C ATOM 660 C PRO A 60 -0.705 4.028 -1.127 1.00 0.50 C ATOM 661 O PRO A 60 -0.453 3.947 -2.316 1.00 0.52 O ATOM 662 CB PRO A 60 1.600 5.021 -0.918 1.00 0.61 C ATOM 663 CG PRO A 60 2.464 3.803 -0.671 1.00 0.55 C ATOM 664 CD PRO A 60 1.730 2.907 0.305 1.00 0.48 C ATOM 0 HA PRO A 60 -0.223 5.627 0.199 1.00 0.57 H new ATOM 0 HB2 PRO A 60 1.425 5.170 -1.984 1.00 0.61 H new ATOM 0 HB3 PRO A 60 2.079 5.926 -0.544 1.00 0.61 H new ATOM 0 HG2 PRO A 60 2.656 3.275 -1.605 1.00 0.55 H new ATOM 0 HG3 PRO A 60 3.432 4.097 -0.266 1.00 0.55 H new ATOM 0 HD2 PRO A 60 1.259 2.060 -0.194 1.00 0.48 H new ATOM 0 HD3 PRO A 60 2.396 2.500 1.065 1.00 0.48 H new ATOM 672 N PRO A 61 -1.799 3.515 -0.594 1.00 0.48 N ATOM 673 CA PRO A 61 -2.778 2.803 -1.452 1.00 0.44 C ATOM 674 C PRO A 61 -3.504 3.793 -2.362 1.00 0.42 C ATOM 675 O PRO A 61 -4.282 4.613 -1.910 1.00 0.47 O ATOM 676 CB PRO A 61 -3.740 2.160 -0.462 1.00 0.46 C ATOM 677 CG PRO A 61 -3.638 2.998 0.766 1.00 0.52 C ATOM 678 CD PRO A 61 -2.233 3.545 0.808 1.00 0.53 C ATOM 0 HA PRO A 61 -2.313 2.069 -2.110 1.00 0.44 H new ATOM 0 HB2 PRO A 61 -4.758 2.149 -0.850 1.00 0.46 H new ATOM 0 HB3 PRO A 61 -3.465 1.125 -0.259 1.00 0.46 H new ATOM 0 HG2 PRO A 61 -4.367 3.808 0.742 1.00 0.52 H new ATOM 0 HG3 PRO A 61 -3.848 2.406 1.656 1.00 0.52 H new ATOM 0 HD2 PRO A 61 -2.211 4.557 1.211 1.00 0.53 H new ATOM 0 HD3 PRO A 61 -1.586 2.936 1.439 1.00 0.53 H new ATOM 686 N THR A 62 -3.245 3.722 -3.641 1.00 0.42 N ATOM 687 CA THR A 62 -3.904 4.655 -4.602 1.00 0.43 C ATOM 688 C THR A 62 -5.432 4.522 -4.511 1.00 0.37 C ATOM 689 O THR A 62 -5.947 3.681 -3.801 1.00 0.35 O ATOM 690 CB THR A 62 -3.357 4.237 -5.980 1.00 0.48 C ATOM 691 OG1 THR A 62 -2.918 5.392 -6.677 1.00 0.60 O ATOM 692 CG2 THR A 62 -4.429 3.523 -6.808 1.00 0.44 C ATOM 0 H THR A 62 -2.601 3.053 -4.064 1.00 0.42 H new ATOM 0 HA THR A 62 -3.693 5.705 -4.397 1.00 0.43 H new ATOM 0 HB THR A 62 -2.527 3.548 -5.827 1.00 0.48 H new ATOM 0 HG1 THR A 62 -2.567 5.131 -7.554 1.00 0.60 H new ATOM 0 HG21 THR A 62 -4.013 3.240 -7.775 1.00 0.44 H new ATOM 0 HG22 THR A 62 -4.761 2.629 -6.280 1.00 0.44 H new ATOM 0 HG23 THR A 62 -5.277 4.191 -6.959 1.00 0.44 H new ATOM 700 N ALA A 63 -6.151 5.355 -5.218 1.00 0.38 N ATOM 701 CA ALA A 63 -7.647 5.303 -5.176 1.00 0.38 C ATOM 702 C ALA A 63 -8.162 3.908 -5.549 1.00 0.34 C ATOM 703 O ALA A 63 -9.055 3.378 -4.916 1.00 0.37 O ATOM 704 CB ALA A 63 -8.103 6.330 -6.213 1.00 0.43 C ATOM 0 H ALA A 63 -5.765 6.075 -5.828 1.00 0.38 H new ATOM 0 HA ALA A 63 -8.030 5.517 -4.178 1.00 0.38 H new ATOM 0 HB1 ALA A 63 -9.192 6.355 -6.246 1.00 0.43 H new ATOM 0 HB2 ALA A 63 -7.725 7.315 -5.940 1.00 0.43 H new ATOM 0 HB3 ALA A 63 -7.717 6.053 -7.194 1.00 0.43 H new ATOM 710 N GLY A 64 -7.616 3.325 -6.583 1.00 0.34 N ATOM 711 CA GLY A 64 -8.074 1.975 -7.028 1.00 0.34 C ATOM 712 C GLY A 64 -7.948 0.953 -5.896 1.00 0.30 C ATOM 713 O GLY A 64 -8.834 0.160 -5.682 1.00 0.31 O ATOM 0 H GLY A 64 -6.866 3.729 -7.143 1.00 0.34 H new ATOM 0 HA2 GLY A 64 -9.111 2.030 -7.360 1.00 0.34 H new ATOM 0 HA3 GLY A 64 -7.482 1.650 -7.884 1.00 0.34 H new ATOM 717 N ILE A 65 -6.854 0.953 -5.184 1.00 0.28 N ATOM 718 CA ILE A 65 -6.668 -0.035 -4.075 1.00 0.26 C ATOM 719 C ILE A 65 -7.851 0.009 -3.105 1.00 0.26 C ATOM 720 O ILE A 65 -8.284 -1.011 -2.604 1.00 0.30 O ATOM 721 CB ILE A 65 -5.374 0.384 -3.364 1.00 0.28 C ATOM 722 CG1 ILE A 65 -4.209 0.439 -4.366 1.00 0.31 C ATOM 723 CG2 ILE A 65 -5.045 -0.624 -2.258 1.00 0.32 C ATOM 724 CD1 ILE A 65 -4.030 -0.921 -5.048 1.00 0.34 C ATOM 0 H ILE A 65 -6.075 1.597 -5.321 1.00 0.28 H new ATOM 0 HA ILE A 65 -6.611 -1.056 -4.453 1.00 0.26 H new ATOM 0 HB ILE A 65 -5.517 1.373 -2.930 1.00 0.28 H new ATOM 0 HG12 ILE A 65 -4.401 1.207 -5.115 1.00 0.31 H new ATOM 0 HG13 ILE A 65 -3.290 0.719 -3.851 1.00 0.31 H new ATOM 0 HG21 ILE A 65 -4.126 -0.325 -1.754 1.00 0.32 H new ATOM 0 HG22 ILE A 65 -5.862 -0.652 -1.536 1.00 0.32 H new ATOM 0 HG23 ILE A 65 -4.913 -1.614 -2.695 1.00 0.32 H new ATOM 0 HD11 ILE A 65 -3.202 -0.867 -5.755 1.00 0.34 H new ATOM 0 HD12 ILE A 65 -3.816 -1.680 -4.295 1.00 0.34 H new ATOM 0 HD13 ILE A 65 -4.944 -1.185 -5.580 1.00 0.34 H new ATOM 736 N LEU A 66 -8.382 1.176 -2.844 1.00 0.28 N ATOM 737 CA LEU A 66 -9.539 1.276 -1.906 1.00 0.32 C ATOM 738 C LEU A 66 -10.844 1.001 -2.655 1.00 0.30 C ATOM 739 O LEU A 66 -11.663 0.215 -2.216 1.00 0.33 O ATOM 740 CB LEU A 66 -9.515 2.714 -1.368 1.00 0.39 C ATOM 741 CG LEU A 66 -8.322 2.935 -0.414 1.00 0.43 C ATOM 742 CD1 LEU A 66 -7.982 1.649 0.350 1.00 0.55 C ATOM 743 CD2 LEU A 66 -7.099 3.384 -1.217 1.00 0.44 C ATOM 0 H LEU A 66 -8.065 2.061 -3.239 1.00 0.28 H new ATOM 0 HA LEU A 66 -9.473 0.549 -1.097 1.00 0.32 H new ATOM 0 HB2 LEU A 66 -9.453 3.415 -2.200 1.00 0.39 H new ATOM 0 HB3 LEU A 66 -10.447 2.924 -0.843 1.00 0.39 H new ATOM 0 HG LEU A 66 -8.599 3.704 0.307 1.00 0.43 H new ATOM 0 HD11 LEU A 66 -7.138 1.833 1.015 1.00 0.55 H new ATOM 0 HD12 LEU A 66 -8.845 1.336 0.937 1.00 0.55 H new ATOM 0 HD13 LEU A 66 -7.721 0.863 -0.359 1.00 0.55 H new ATOM 0 HD21 LEU A 66 -6.258 3.540 -0.542 1.00 0.44 H new ATOM 0 HD22 LEU A 66 -6.841 2.617 -1.947 1.00 0.44 H new ATOM 0 HD23 LEU A 66 -7.326 4.316 -1.735 1.00 0.44 H new ATOM 755 N LYS A 67 -11.039 1.631 -3.787 1.00 0.31 N ATOM 756 CA LYS A 67 -12.288 1.395 -4.574 1.00 0.33 C ATOM 757 C LYS A 67 -12.387 -0.089 -4.932 1.00 0.31 C ATOM 758 O LYS A 67 -13.448 -0.683 -4.888 1.00 0.38 O ATOM 759 CB LYS A 67 -12.132 2.242 -5.836 1.00 0.37 C ATOM 760 CG LYS A 67 -12.689 3.644 -5.583 1.00 0.46 C ATOM 761 CD LYS A 67 -14.218 3.604 -5.634 1.00 0.63 C ATOM 762 CE LYS A 67 -14.677 3.339 -7.070 1.00 0.76 C ATOM 763 NZ LYS A 67 -15.757 2.320 -6.947 1.00 0.90 N ATOM 0 H LYS A 67 -10.387 2.298 -4.200 1.00 0.31 H new ATOM 0 HA LYS A 67 -13.190 1.661 -4.023 1.00 0.33 H new ATOM 0 HB2 LYS A 67 -11.081 2.302 -6.118 1.00 0.37 H new ATOM 0 HB3 LYS A 67 -12.659 1.775 -6.668 1.00 0.37 H new ATOM 0 HG2 LYS A 67 -12.357 4.009 -4.611 1.00 0.46 H new ATOM 0 HG3 LYS A 67 -12.308 4.339 -6.332 1.00 0.46 H new ATOM 0 HD2 LYS A 67 -14.594 2.824 -4.972 1.00 0.63 H new ATOM 0 HD3 LYS A 67 -14.629 4.549 -5.279 1.00 0.63 H new ATOM 0 HE2 LYS A 67 -15.046 4.250 -7.541 1.00 0.76 H new ATOM 0 HE3 LYS A 67 -13.856 2.972 -7.686 1.00 0.76 H new ATOM 0 HZ1 LYS A 67 -16.123 2.086 -7.892 1.00 0.90 H new ATOM 0 HZ2 LYS A 67 -15.375 1.461 -6.501 1.00 0.90 H new ATOM 0 HZ3 LYS A 67 -16.528 2.700 -6.362 1.00 0.90 H new ATOM 777 N ARG A 68 -11.275 -0.686 -5.270 1.00 0.28 N ATOM 778 CA ARG A 68 -11.263 -2.133 -5.620 1.00 0.27 C ATOM 779 C ARG A 68 -11.347 -2.963 -4.332 1.00 0.26 C ATOM 780 O ARG A 68 -11.870 -4.061 -4.322 1.00 0.31 O ATOM 781 CB ARG A 68 -9.936 -2.352 -6.373 1.00 0.29 C ATOM 782 CG ARG A 68 -8.798 -2.681 -5.403 1.00 0.31 C ATOM 783 CD ARG A 68 -7.483 -2.778 -6.184 1.00 0.31 C ATOM 784 NE ARG A 68 -7.514 -4.126 -6.817 1.00 0.37 N ATOM 785 CZ ARG A 68 -7.802 -4.247 -8.084 1.00 0.43 C ATOM 786 NH1 ARG A 68 -7.122 -3.579 -8.975 1.00 0.66 N ATOM 787 NH2 ARG A 68 -8.771 -5.036 -8.461 1.00 0.53 N ATOM 0 H ARG A 68 -10.366 -0.226 -5.318 1.00 0.28 H new ATOM 0 HA ARG A 68 -12.106 -2.438 -6.239 1.00 0.27 H new ATOM 0 HB2 ARG A 68 -10.052 -3.164 -7.091 1.00 0.29 H new ATOM 0 HB3 ARG A 68 -9.685 -1.457 -6.942 1.00 0.29 H new ATOM 0 HG2 ARG A 68 -8.723 -1.910 -4.636 1.00 0.31 H new ATOM 0 HG3 ARG A 68 -9.001 -3.622 -4.891 1.00 0.31 H new ATOM 0 HD2 ARG A 68 -7.410 -1.991 -6.934 1.00 0.31 H new ATOM 0 HD3 ARG A 68 -6.622 -2.671 -5.524 1.00 0.31 H new ATOM 0 HE ARG A 68 -7.310 -4.955 -6.259 1.00 0.37 H new ATOM 0 HH11 ARG A 68 -6.365 -2.962 -8.681 1.00 0.66 H new ATOM 0 HH12 ARG A 68 -7.348 -3.674 -9.965 1.00 0.66 H new ATOM 0 HH21 ARG A 68 -9.303 -5.558 -7.765 1.00 0.53 H new ATOM 0 HH22 ARG A 68 -8.996 -5.130 -9.451 1.00 0.53 H new ATOM 801 N TRP A 69 -10.843 -2.425 -3.245 1.00 0.25 N ATOM 802 CA TRP A 69 -10.887 -3.139 -1.928 1.00 0.25 C ATOM 803 C TRP A 69 -12.287 -3.700 -1.645 1.00 0.27 C ATOM 804 O TRP A 69 -12.432 -4.768 -1.079 1.00 0.32 O ATOM 805 CB TRP A 69 -10.564 -2.050 -0.910 1.00 0.27 C ATOM 806 CG TRP A 69 -9.955 -2.643 0.316 1.00 0.25 C ATOM 807 CD1 TRP A 69 -10.483 -2.544 1.556 1.00 0.27 C ATOM 808 CD2 TRP A 69 -8.718 -3.403 0.456 1.00 0.26 C ATOM 809 NE1 TRP A 69 -9.652 -3.190 2.448 1.00 0.28 N ATOM 810 CE2 TRP A 69 -8.553 -3.734 1.822 1.00 0.27 C ATOM 811 CE3 TRP A 69 -7.729 -3.835 -0.453 1.00 0.29 C ATOM 812 CZ2 TRP A 69 -7.455 -4.460 2.272 1.00 0.30 C ATOM 813 CZ3 TRP A 69 -6.623 -4.567 0.003 1.00 0.32 C ATOM 814 CH2 TRP A 69 -6.489 -4.875 1.362 1.00 0.32 C ATOM 0 H TRP A 69 -10.397 -1.508 -3.215 1.00 0.25 H new ATOM 0 HA TRP A 69 -10.199 -3.984 -1.900 1.00 0.25 H new ATOM 0 HB2 TRP A 69 -9.878 -1.325 -1.349 1.00 0.27 H new ATOM 0 HB3 TRP A 69 -11.473 -1.510 -0.646 1.00 0.27 H new ATOM 0 HD1 TRP A 69 -11.405 -2.041 1.808 1.00 0.27 H new ATOM 0 HE1 TRP A 69 -9.830 -3.257 3.450 1.00 0.28 H new ATOM 0 HE3 TRP A 69 -7.824 -3.601 -1.503 1.00 0.29 H new ATOM 0 HZ2 TRP A 69 -7.354 -4.699 3.320 1.00 0.30 H new ATOM 0 HZ3 TRP A 69 -5.870 -4.895 -0.698 1.00 0.32 H new ATOM 0 HH2 TRP A 69 -5.633 -5.437 1.705 1.00 0.32 H new ATOM 825 N GLY A 70 -13.315 -2.974 -2.013 1.00 0.31 N ATOM 826 CA GLY A 70 -14.708 -3.443 -1.746 1.00 0.38 C ATOM 827 C GLY A 70 -15.344 -4.007 -3.019 1.00 0.37 C ATOM 828 O GLY A 70 -16.539 -3.892 -3.218 1.00 0.43 O ATOM 0 H GLY A 70 -13.247 -2.074 -2.488 1.00 0.31 H new ATOM 0 HA2 GLY A 70 -14.697 -4.208 -0.970 1.00 0.38 H new ATOM 0 HA3 GLY A 70 -15.309 -2.616 -1.369 1.00 0.38 H new ATOM 832 N THR A 71 -14.570 -4.623 -3.876 1.00 0.36 N ATOM 833 CA THR A 71 -15.157 -5.199 -5.124 1.00 0.41 C ATOM 834 C THR A 71 -14.253 -6.296 -5.702 1.00 0.39 C ATOM 835 O THR A 71 -14.325 -6.606 -6.877 1.00 0.50 O ATOM 836 CB THR A 71 -15.292 -4.014 -6.093 1.00 0.47 C ATOM 837 OG1 THR A 71 -16.323 -4.292 -7.031 1.00 0.64 O ATOM 838 CG2 THR A 71 -13.977 -3.779 -6.841 1.00 0.54 C ATOM 0 H THR A 71 -13.564 -4.752 -3.767 1.00 0.36 H new ATOM 0 HA THR A 71 -16.120 -5.675 -4.938 1.00 0.41 H new ATOM 0 HB THR A 71 -15.536 -3.118 -5.522 1.00 0.47 H new ATOM 0 HG1 THR A 71 -16.414 -3.538 -7.650 1.00 0.64 H new ATOM 0 HG21 THR A 71 -14.092 -2.936 -7.523 1.00 0.54 H new ATOM 0 HG22 THR A 71 -13.185 -3.561 -6.125 1.00 0.54 H new ATOM 0 HG23 THR A 71 -13.717 -4.672 -7.409 1.00 0.54 H new ATOM 846 N ILE A 72 -13.416 -6.893 -4.890 1.00 0.39 N ATOM 847 CA ILE A 72 -12.528 -7.978 -5.405 1.00 0.39 C ATOM 848 C ILE A 72 -13.161 -9.348 -5.120 1.00 0.39 C ATOM 849 O ILE A 72 -14.287 -9.599 -5.507 1.00 0.59 O ATOM 850 CB ILE A 72 -11.183 -7.798 -4.686 1.00 0.39 C ATOM 851 CG1 ILE A 72 -11.376 -7.886 -3.171 1.00 0.40 C ATOM 852 CG2 ILE A 72 -10.582 -6.437 -5.046 1.00 0.46 C ATOM 853 CD1 ILE A 72 -10.137 -8.534 -2.549 1.00 0.37 C ATOM 0 H ILE A 72 -13.310 -6.677 -3.899 1.00 0.39 H new ATOM 0 HA ILE A 72 -12.387 -7.926 -6.485 1.00 0.39 H new ATOM 0 HB ILE A 72 -10.507 -8.591 -5.005 1.00 0.39 H new ATOM 0 HG12 ILE A 72 -11.531 -6.892 -2.753 1.00 0.40 H new ATOM 0 HG13 ILE A 72 -12.265 -8.472 -2.938 1.00 0.40 H new ATOM 0 HG21 ILE A 72 -9.628 -6.314 -4.534 1.00 0.46 H new ATOM 0 HG22 ILE A 72 -10.425 -6.382 -6.123 1.00 0.46 H new ATOM 0 HG23 ILE A 72 -11.264 -5.645 -4.738 1.00 0.46 H new ATOM 0 HD11 ILE A 72 -10.265 -8.601 -1.469 1.00 0.37 H new ATOM 0 HD12 ILE A 72 -10.004 -9.534 -2.961 1.00 0.37 H new ATOM 0 HD13 ILE A 72 -9.259 -7.929 -2.773 1.00 0.37 H new ATOM 865 N LYS A 73 -12.454 -10.239 -4.472 1.00 0.38 N ATOM 866 CA LYS A 73 -13.023 -11.593 -4.195 1.00 0.39 C ATOM 867 C LYS A 73 -13.117 -11.871 -2.697 1.00 0.34 C ATOM 868 O LYS A 73 -14.036 -12.522 -2.245 1.00 0.39 O ATOM 869 CB LYS A 73 -12.032 -12.560 -4.835 1.00 0.42 C ATOM 870 CG LYS A 73 -12.546 -13.989 -4.694 1.00 0.45 C ATOM 871 CD LYS A 73 -13.736 -14.222 -5.632 1.00 0.45 C ATOM 872 CE LYS A 73 -13.307 -14.047 -7.093 1.00 0.47 C ATOM 873 NZ LYS A 73 -13.568 -12.614 -7.424 1.00 0.54 N ATOM 0 H LYS A 73 -11.508 -10.087 -4.123 1.00 0.38 H new ATOM 0 HA LYS A 73 -14.035 -11.687 -4.588 1.00 0.39 H new ATOM 0 HB2 LYS A 73 -11.897 -12.314 -5.888 1.00 0.42 H new ATOM 0 HB3 LYS A 73 -11.057 -12.465 -4.358 1.00 0.42 H new ATOM 0 HG2 LYS A 73 -11.748 -14.694 -4.926 1.00 0.45 H new ATOM 0 HG3 LYS A 73 -12.846 -14.175 -3.663 1.00 0.45 H new ATOM 0 HD2 LYS A 73 -14.135 -15.225 -5.481 1.00 0.45 H new ATOM 0 HD3 LYS A 73 -14.537 -13.521 -5.395 1.00 0.45 H new ATOM 0 HE2 LYS A 73 -12.253 -14.293 -7.223 1.00 0.47 H new ATOM 0 HE3 LYS A 73 -13.872 -14.709 -7.749 1.00 0.47 H new ATOM 0 HZ1 LYS A 73 -14.179 -12.557 -8.263 1.00 0.54 H new ATOM 0 HZ2 LYS A 73 -14.040 -12.152 -6.620 1.00 0.54 H new ATOM 0 HZ3 LYS A 73 -12.667 -12.133 -7.619 1.00 0.54 H new ATOM 887 N LYS A 74 -12.151 -11.411 -1.947 1.00 0.29 N ATOM 888 CA LYS A 74 -12.110 -11.651 -0.468 1.00 0.28 C ATOM 889 C LYS A 74 -11.794 -13.120 -0.171 1.00 0.28 C ATOM 890 O LYS A 74 -10.941 -13.420 0.642 1.00 0.29 O ATOM 891 CB LYS A 74 -13.484 -11.277 0.110 1.00 0.31 C ATOM 892 CG LYS A 74 -13.858 -9.843 -0.269 1.00 0.32 C ATOM 893 CD LYS A 74 -12.651 -8.921 -0.110 1.00 0.38 C ATOM 894 CE LYS A 74 -13.135 -7.511 0.223 1.00 0.49 C ATOM 895 NZ LYS A 74 -13.937 -7.088 -0.959 1.00 0.47 N ATOM 0 H LYS A 74 -11.367 -10.865 -2.304 1.00 0.29 H new ATOM 0 HA LYS A 74 -11.328 -11.043 -0.012 1.00 0.28 H new ATOM 0 HB2 LYS A 74 -14.241 -11.966 -0.264 1.00 0.31 H new ATOM 0 HB3 LYS A 74 -13.468 -11.379 1.195 1.00 0.31 H new ATOM 0 HG2 LYS A 74 -14.214 -9.813 -1.299 1.00 0.32 H new ATOM 0 HG3 LYS A 74 -14.676 -9.495 0.361 1.00 0.32 H new ATOM 0 HD2 LYS A 74 -11.998 -9.290 0.681 1.00 0.38 H new ATOM 0 HD3 LYS A 74 -12.064 -8.909 -1.028 1.00 0.38 H new ATOM 0 HE2 LYS A 74 -13.738 -7.505 1.131 1.00 0.49 H new ATOM 0 HE3 LYS A 74 -12.296 -6.836 0.393 1.00 0.49 H new ATOM 0 HZ1 LYS A 74 -13.610 -6.156 -1.285 1.00 0.47 H new ATOM 0 HZ2 LYS A 74 -13.820 -7.783 -1.724 1.00 0.47 H new ATOM 0 HZ3 LYS A 74 -14.941 -7.030 -0.694 1.00 0.47 H new ATOM 909 N SER A 75 -12.462 -14.038 -0.826 1.00 0.32 N ATOM 910 CA SER A 75 -12.182 -15.481 -0.575 1.00 0.35 C ATOM 911 C SER A 75 -10.734 -15.776 -0.950 1.00 0.33 C ATOM 912 O SER A 75 -10.016 -16.430 -0.223 1.00 0.35 O ATOM 913 CB SER A 75 -13.159 -16.251 -1.470 1.00 0.40 C ATOM 914 OG SER A 75 -12.682 -16.259 -2.810 1.00 0.54 O ATOM 0 H SER A 75 -13.185 -13.849 -1.520 1.00 0.32 H new ATOM 0 HA SER A 75 -12.312 -15.765 0.469 1.00 0.35 H new ATOM 0 HB2 SER A 75 -13.270 -17.273 -1.108 1.00 0.40 H new ATOM 0 HB3 SER A 75 -14.146 -15.789 -1.428 1.00 0.40 H new ATOM 0 HG SER A 75 -13.309 -16.754 -3.378 1.00 0.54 H new ATOM 920 N LYS A 76 -10.303 -15.272 -2.076 1.00 0.33 N ATOM 921 CA LYS A 76 -8.896 -15.491 -2.512 1.00 0.34 C ATOM 922 C LYS A 76 -7.963 -14.600 -1.691 1.00 0.32 C ATOM 923 O LYS A 76 -6.926 -15.035 -1.231 1.00 0.37 O ATOM 924 CB LYS A 76 -8.874 -15.086 -3.986 1.00 0.36 C ATOM 925 CG LYS A 76 -7.626 -15.661 -4.664 1.00 0.39 C ATOM 926 CD LYS A 76 -7.651 -17.191 -4.585 1.00 0.50 C ATOM 927 CE LYS A 76 -6.657 -17.668 -3.522 1.00 0.55 C ATOM 928 NZ LYS A 76 -5.921 -18.795 -4.160 1.00 0.52 N ATOM 0 H LYS A 76 -10.870 -14.715 -2.715 1.00 0.33 H new ATOM 0 HA LYS A 76 -8.565 -16.520 -2.373 1.00 0.34 H new ATOM 0 HB2 LYS A 76 -9.771 -15.451 -4.486 1.00 0.36 H new ATOM 0 HB3 LYS A 76 -8.879 -14.000 -4.074 1.00 0.36 H new ATOM 0 HG2 LYS A 76 -7.587 -15.342 -5.706 1.00 0.39 H new ATOM 0 HG3 LYS A 76 -6.728 -15.277 -4.179 1.00 0.39 H new ATOM 0 HD2 LYS A 76 -8.655 -17.536 -4.339 1.00 0.50 H new ATOM 0 HD3 LYS A 76 -7.396 -17.619 -5.554 1.00 0.50 H new ATOM 0 HE2 LYS A 76 -5.977 -16.868 -3.230 1.00 0.55 H new ATOM 0 HE3 LYS A 76 -7.172 -17.994 -2.618 1.00 0.55 H new ATOM 0 HZ1 LYS A 76 -5.221 -19.175 -3.492 1.00 0.52 H new ATOM 0 HZ2 LYS A 76 -6.593 -19.545 -4.421 1.00 0.52 H new ATOM 0 HZ3 LYS A 76 -5.435 -18.453 -5.014 1.00 0.52 H new ATOM 942 N ALA A 77 -8.334 -13.356 -1.499 1.00 0.30 N ATOM 943 CA ALA A 77 -7.478 -12.423 -0.700 1.00 0.30 C ATOM 944 C ALA A 77 -7.276 -12.973 0.711 1.00 0.29 C ATOM 945 O ALA A 77 -6.162 -13.160 1.161 1.00 0.32 O ATOM 946 CB ALA A 77 -8.257 -11.108 -0.638 1.00 0.32 C ATOM 0 H ALA A 77 -9.195 -12.946 -1.862 1.00 0.30 H new ATOM 0 HA ALA A 77 -6.492 -12.295 -1.147 1.00 0.30 H new ATOM 0 HB1 ALA A 77 -7.688 -10.375 -0.066 1.00 0.32 H new ATOM 0 HB2 ALA A 77 -8.419 -10.733 -1.649 1.00 0.32 H new ATOM 0 HB3 ALA A 77 -9.219 -11.278 -0.155 1.00 0.32 H new ATOM 952 N ILE A 78 -8.353 -13.226 1.410 1.00 0.27 N ATOM 953 CA ILE A 78 -8.242 -13.759 2.799 1.00 0.28 C ATOM 954 C ILE A 78 -7.474 -15.085 2.790 1.00 0.29 C ATOM 955 O ILE A 78 -6.619 -15.312 3.626 1.00 0.34 O ATOM 956 CB ILE A 78 -9.687 -13.934 3.274 1.00 0.29 C ATOM 957 CG1 ILE A 78 -10.373 -12.561 3.293 1.00 0.30 C ATOM 958 CG2 ILE A 78 -9.702 -14.530 4.684 1.00 0.35 C ATOM 959 CD1 ILE A 78 -11.887 -12.731 3.179 1.00 0.35 C ATOM 0 H ILE A 78 -9.307 -13.086 1.076 1.00 0.27 H new ATOM 0 HA ILE A 78 -7.691 -13.096 3.466 1.00 0.28 H new ATOM 0 HB ILE A 78 -10.215 -14.606 2.598 1.00 0.29 H new ATOM 0 HG12 ILE A 78 -10.126 -12.035 4.215 1.00 0.30 H new ATOM 0 HG13 ILE A 78 -10.004 -11.950 2.469 1.00 0.30 H new ATOM 0 HG21 ILE A 78 -10.733 -14.652 5.016 1.00 0.35 H new ATOM 0 HG22 ILE A 78 -9.207 -15.501 4.674 1.00 0.35 H new ATOM 0 HG23 ILE A 78 -9.177 -13.862 5.367 1.00 0.35 H new ATOM 0 HD11 ILE A 78 -12.365 -11.752 3.193 1.00 0.35 H new ATOM 0 HD12 ILE A 78 -12.127 -13.238 2.245 1.00 0.35 H new ATOM 0 HD13 ILE A 78 -12.251 -13.325 4.018 1.00 0.35 H new ATOM 971 N ASN A 79 -7.742 -15.949 1.839 1.00 0.29 N ATOM 972 CA ASN A 79 -6.987 -17.238 1.778 1.00 0.30 C ATOM 973 C ASN A 79 -5.515 -16.925 1.519 1.00 0.30 C ATOM 974 O ASN A 79 -4.625 -17.536 2.082 1.00 0.34 O ATOM 975 CB ASN A 79 -7.585 -18.020 0.609 1.00 0.32 C ATOM 976 CG ASN A 79 -8.648 -18.988 1.134 1.00 0.37 C ATOM 977 OD1 ASN A 79 -8.365 -19.823 1.970 1.00 0.46 O ATOM 978 ND2 ASN A 79 -9.868 -18.910 0.678 1.00 0.45 N ATOM 0 H ASN A 79 -8.444 -15.818 1.110 1.00 0.29 H new ATOM 0 HA ASN A 79 -7.057 -17.812 2.702 1.00 0.30 H new ATOM 0 HB2 ASN A 79 -8.027 -17.334 -0.113 1.00 0.32 H new ATOM 0 HB3 ASN A 79 -6.802 -18.571 0.087 1.00 0.32 H new ATOM 0 HD21 ASN A 79 -10.583 -19.550 1.023 1.00 0.45 H new ATOM 0 HD22 ASN A 79 -10.106 -18.209 -0.024 1.00 0.45 H new ATOM 985 N VAL A 80 -5.263 -15.951 0.682 1.00 0.28 N ATOM 986 CA VAL A 80 -3.858 -15.552 0.384 1.00 0.31 C ATOM 987 C VAL A 80 -3.201 -15.067 1.677 1.00 0.31 C ATOM 988 O VAL A 80 -2.090 -15.443 2.001 1.00 0.35 O ATOM 989 CB VAL A 80 -3.983 -14.419 -0.655 1.00 0.32 C ATOM 990 CG1 VAL A 80 -3.044 -13.253 -0.320 1.00 0.41 C ATOM 991 CG2 VAL A 80 -3.627 -14.967 -2.039 1.00 0.49 C ATOM 0 H VAL A 80 -5.976 -15.413 0.190 1.00 0.28 H new ATOM 0 HA VAL A 80 -3.242 -16.365 -0.001 1.00 0.31 H new ATOM 0 HB VAL A 80 -5.009 -14.050 -0.641 1.00 0.32 H new ATOM 0 HG11 VAL A 80 -3.155 -12.470 -1.070 1.00 0.41 H new ATOM 0 HG12 VAL A 80 -3.296 -12.853 0.662 1.00 0.41 H new ATOM 0 HG13 VAL A 80 -2.013 -13.606 -0.314 1.00 0.41 H new ATOM 0 HG21 VAL A 80 -3.713 -14.171 -2.779 1.00 0.49 H new ATOM 0 HG22 VAL A 80 -2.604 -15.344 -2.029 1.00 0.49 H new ATOM 0 HG23 VAL A 80 -4.310 -15.777 -2.296 1.00 0.49 H new ATOM 1001 N LEU A 81 -3.893 -14.239 2.418 1.00 0.31 N ATOM 1002 CA LEU A 81 -3.328 -13.722 3.698 1.00 0.33 C ATOM 1003 C LEU A 81 -3.033 -14.889 4.638 1.00 0.35 C ATOM 1004 O LEU A 81 -2.053 -14.884 5.361 1.00 0.38 O ATOM 1005 CB LEU A 81 -4.409 -12.808 4.273 1.00 0.39 C ATOM 1006 CG LEU A 81 -3.889 -11.372 4.303 1.00 0.52 C ATOM 1007 CD1 LEU A 81 -4.270 -10.662 3.003 1.00 0.96 C ATOM 1008 CD2 LEU A 81 -4.511 -10.635 5.485 1.00 0.88 C ATOM 0 H LEU A 81 -4.827 -13.899 2.190 1.00 0.31 H new ATOM 0 HA LEU A 81 -2.390 -13.184 3.558 1.00 0.33 H new ATOM 0 HB2 LEU A 81 -5.313 -12.868 3.667 1.00 0.39 H new ATOM 0 HB3 LEU A 81 -4.678 -13.131 5.279 1.00 0.39 H new ATOM 0 HG LEU A 81 -2.804 -11.380 4.406 1.00 0.52 H new ATOM 0 HD11 LEU A 81 -3.898 -9.638 3.026 1.00 0.96 H new ATOM 0 HD12 LEU A 81 -3.829 -11.190 2.157 1.00 0.96 H new ATOM 0 HD13 LEU A 81 -5.355 -10.652 2.898 1.00 0.96 H new ATOM 0 HD21 LEU A 81 -4.142 -9.610 5.509 1.00 0.88 H new ATOM 0 HD22 LEU A 81 -5.596 -10.628 5.379 1.00 0.88 H new ATOM 0 HD23 LEU A 81 -4.240 -11.140 6.412 1.00 0.88 H new ATOM 1020 N ARG A 82 -3.858 -15.906 4.617 1.00 0.37 N ATOM 1021 CA ARG A 82 -3.597 -17.085 5.489 1.00 0.42 C ATOM 1022 C ARG A 82 -2.274 -17.717 5.051 1.00 0.40 C ATOM 1023 O ARG A 82 -1.482 -18.172 5.859 1.00 0.46 O ATOM 1024 CB ARG A 82 -4.772 -18.039 5.253 1.00 0.44 C ATOM 1025 CG ARG A 82 -5.302 -18.537 6.601 1.00 0.49 C ATOM 1026 CD ARG A 82 -6.192 -17.452 7.232 1.00 0.51 C ATOM 1027 NE ARG A 82 -7.619 -17.780 6.886 1.00 0.56 N ATOM 1028 CZ ARG A 82 -7.917 -18.639 5.943 1.00 0.53 C ATOM 1029 NH1 ARG A 82 -8.005 -18.246 4.704 1.00 0.61 N ATOM 1030 NH2 ARG A 82 -8.133 -19.889 6.247 1.00 0.67 N ATOM 0 H ARG A 82 -4.695 -15.968 4.037 1.00 0.37 H new ATOM 0 HA ARG A 82 -3.517 -16.833 6.546 1.00 0.42 H new ATOM 0 HB2 ARG A 82 -5.564 -17.529 4.704 1.00 0.44 H new ATOM 0 HB3 ARG A 82 -4.452 -18.883 4.641 1.00 0.44 H new ATOM 0 HG2 ARG A 82 -5.872 -19.456 6.463 1.00 0.49 H new ATOM 0 HG3 ARG A 82 -4.471 -18.774 7.266 1.00 0.49 H new ATOM 0 HD2 ARG A 82 -6.056 -17.426 8.313 1.00 0.51 H new ATOM 0 HD3 ARG A 82 -5.922 -16.466 6.853 1.00 0.51 H new ATOM 0 HE ARG A 82 -8.373 -17.322 7.398 1.00 0.56 H new ATOM 0 HH11 ARG A 82 -7.842 -17.268 4.466 1.00 0.61 H new ATOM 0 HH12 ARG A 82 -8.237 -18.917 3.971 1.00 0.61 H new ATOM 0 HH21 ARG A 82 -8.070 -20.196 7.218 1.00 0.67 H new ATOM 0 HH22 ARG A 82 -8.365 -20.559 5.514 1.00 0.67 H new ATOM 1044 N GLY A 83 -2.025 -17.713 3.764 1.00 0.38 N ATOM 1045 CA GLY A 83 -0.751 -18.277 3.237 1.00 0.40 C ATOM 1046 C GLY A 83 0.386 -17.305 3.558 1.00 0.38 C ATOM 1047 O GLY A 83 1.518 -17.704 3.749 1.00 0.43 O ATOM 0 H GLY A 83 -2.656 -17.340 3.055 1.00 0.38 H new ATOM 0 HA2 GLY A 83 -0.554 -19.250 3.687 1.00 0.40 H new ATOM 0 HA3 GLY A 83 -0.823 -18.432 2.160 1.00 0.40 H new ATOM 1051 N PHE A 84 0.084 -16.030 3.637 1.00 0.36 N ATOM 1052 CA PHE A 84 1.136 -15.021 3.966 1.00 0.36 C ATOM 1053 C PHE A 84 1.705 -15.341 5.346 1.00 0.38 C ATOM 1054 O PHE A 84 2.899 -15.278 5.572 1.00 0.39 O ATOM 1055 CB PHE A 84 0.412 -13.671 3.993 1.00 0.38 C ATOM 1056 CG PHE A 84 0.776 -12.854 2.785 1.00 0.56 C ATOM 1057 CD1 PHE A 84 1.912 -12.039 2.807 1.00 0.82 C ATOM 1058 CD2 PHE A 84 -0.040 -12.892 1.650 1.00 0.81 C ATOM 1059 CE1 PHE A 84 2.232 -11.262 1.692 1.00 1.08 C ATOM 1060 CE2 PHE A 84 0.282 -12.119 0.535 1.00 1.07 C ATOM 1061 CZ PHE A 84 1.416 -11.304 0.556 1.00 1.15 C ATOM 0 H PHE A 84 -0.849 -15.646 3.487 1.00 0.36 H new ATOM 0 HA PHE A 84 1.957 -15.017 3.249 1.00 0.36 H new ATOM 0 HB2 PHE A 84 -0.666 -13.830 4.020 1.00 0.38 H new ATOM 0 HB3 PHE A 84 0.677 -13.128 4.900 1.00 0.38 H new ATOM 0 HD1 PHE A 84 2.541 -12.011 3.685 1.00 0.82 H new ATOM 0 HD2 PHE A 84 -0.919 -13.520 1.637 1.00 0.81 H new ATOM 0 HE1 PHE A 84 3.108 -10.630 1.706 1.00 1.08 H new ATOM 0 HE2 PHE A 84 -0.345 -12.150 -0.344 1.00 1.07 H new ATOM 0 HZ PHE A 84 1.664 -10.704 -0.307 1.00 1.15 H new ATOM 1071 N ARG A 85 0.843 -15.698 6.264 1.00 0.41 N ATOM 1072 CA ARG A 85 1.302 -16.043 7.638 1.00 0.45 C ATOM 1073 C ARG A 85 2.046 -17.379 7.609 1.00 0.45 C ATOM 1074 O ARG A 85 3.057 -17.548 8.259 1.00 0.51 O ATOM 1075 CB ARG A 85 0.026 -16.149 8.472 1.00 0.50 C ATOM 1076 CG ARG A 85 0.393 -16.430 9.930 1.00 0.62 C ATOM 1077 CD ARG A 85 0.406 -17.940 10.167 1.00 0.73 C ATOM 1078 NE ARG A 85 -0.169 -18.119 11.528 1.00 0.69 N ATOM 1079 CZ ARG A 85 -0.711 -19.257 11.862 1.00 0.53 C ATOM 1080 NH1 ARG A 85 -1.918 -19.548 11.461 1.00 0.85 N ATOM 1081 NH2 ARG A 85 -0.044 -20.105 12.595 1.00 0.77 N ATOM 0 H ARG A 85 -0.164 -15.765 6.117 1.00 0.41 H new ATOM 0 HA ARG A 85 1.987 -15.302 8.051 1.00 0.45 H new ATOM 0 HB2 ARG A 85 -0.546 -15.224 8.401 1.00 0.50 H new ATOM 0 HB3 ARG A 85 -0.609 -16.946 8.085 1.00 0.50 H new ATOM 0 HG2 ARG A 85 1.371 -16.006 10.159 1.00 0.62 H new ATOM 0 HG3 ARG A 85 -0.325 -15.952 10.596 1.00 0.62 H new ATOM 0 HD2 ARG A 85 -0.186 -18.463 9.416 1.00 0.73 H new ATOM 0 HD3 ARG A 85 1.418 -18.340 10.110 1.00 0.73 H new ATOM 0 HE ARG A 85 -0.139 -17.352 12.199 1.00 0.69 H new ATOM 0 HH11 ARG A 85 -2.438 -18.885 10.886 1.00 0.85 H new ATOM 0 HH12 ARG A 85 -2.342 -20.438 11.723 1.00 0.85 H new ATOM 0 HH21 ARG A 85 0.900 -19.878 12.906 1.00 0.77 H new ATOM 0 HH22 ARG A 85 -0.467 -20.996 12.857 1.00 0.77 H new ATOM 1095 N LYS A 86 1.561 -18.329 6.850 1.00 0.44 N ATOM 1096 CA LYS A 86 2.263 -19.646 6.776 1.00 0.47 C ATOM 1097 C LYS A 86 3.618 -19.460 6.089 1.00 0.44 C ATOM 1098 O LYS A 86 4.605 -20.071 6.460 1.00 0.47 O ATOM 1099 CB LYS A 86 1.352 -20.549 5.942 1.00 0.51 C ATOM 1100 CG LYS A 86 1.172 -21.891 6.654 1.00 0.59 C ATOM 1101 CD LYS A 86 0.221 -21.717 7.841 1.00 0.72 C ATOM 1102 CE LYS A 86 1.031 -21.549 9.129 1.00 0.79 C ATOM 1103 NZ LYS A 86 0.251 -22.274 10.170 1.00 0.60 N ATOM 0 H LYS A 86 0.717 -18.251 6.283 1.00 0.44 H new ATOM 0 HA LYS A 86 2.450 -20.076 7.760 1.00 0.47 H new ATOM 0 HB2 LYS A 86 0.384 -20.070 5.795 1.00 0.51 H new ATOM 0 HB3 LYS A 86 1.783 -20.705 4.953 1.00 0.51 H new ATOM 0 HG2 LYS A 86 0.773 -22.632 5.961 1.00 0.59 H new ATOM 0 HG3 LYS A 86 2.136 -22.264 6.999 1.00 0.59 H new ATOM 0 HD2 LYS A 86 -0.416 -20.847 7.684 1.00 0.72 H new ATOM 0 HD3 LYS A 86 -0.436 -22.583 7.923 1.00 0.72 H new ATOM 0 HE2 LYS A 86 2.032 -21.967 9.023 1.00 0.79 H new ATOM 0 HE3 LYS A 86 1.150 -20.497 9.386 1.00 0.79 H new ATOM 0 HZ1 LYS A 86 0.743 -22.204 11.084 1.00 0.60 H new ATOM 0 HZ2 LYS A 86 -0.695 -21.850 10.253 1.00 0.60 H new ATOM 0 HZ3 LYS A 86 0.160 -23.275 9.901 1.00 0.60 H new ATOM 1117 N GLU A 87 3.668 -18.611 5.094 1.00 0.43 N ATOM 1118 CA GLU A 87 4.953 -18.366 4.377 1.00 0.42 C ATOM 1119 C GLU A 87 5.942 -17.667 5.312 1.00 0.42 C ATOM 1120 O GLU A 87 7.124 -17.955 5.301 1.00 0.45 O ATOM 1121 CB GLU A 87 4.586 -17.469 3.193 1.00 0.43 C ATOM 1122 CG GLU A 87 3.988 -18.328 2.073 1.00 0.46 C ATOM 1123 CD GLU A 87 4.562 -17.893 0.723 1.00 0.46 C ATOM 1124 OE1 GLU A 87 4.564 -16.702 0.458 1.00 0.51 O ATOM 1125 OE2 GLU A 87 4.986 -18.759 -0.024 1.00 0.49 O ATOM 0 H GLU A 87 2.871 -18.076 4.748 1.00 0.43 H new ATOM 0 HA GLU A 87 5.430 -19.288 4.044 1.00 0.42 H new ATOM 0 HB2 GLU A 87 3.870 -16.709 3.506 1.00 0.43 H new ATOM 0 HB3 GLU A 87 5.470 -16.944 2.832 1.00 0.43 H new ATOM 0 HG2 GLU A 87 4.210 -19.380 2.251 1.00 0.46 H new ATOM 0 HG3 GLU A 87 2.903 -18.228 2.066 1.00 0.46 H new ATOM 1132 N ILE A 88 5.466 -16.763 6.133 1.00 0.42 N ATOM 1133 CA ILE A 88 6.381 -16.064 7.081 1.00 0.46 C ATOM 1134 C ILE A 88 6.897 -17.075 8.112 1.00 0.45 C ATOM 1135 O ILE A 88 8.052 -17.052 8.497 1.00 0.47 O ATOM 1136 CB ILE A 88 5.527 -14.956 7.725 1.00 0.51 C ATOM 1137 CG1 ILE A 88 6.356 -13.670 7.823 1.00 0.58 C ATOM 1138 CG2 ILE A 88 5.060 -15.367 9.128 1.00 0.55 C ATOM 1139 CD1 ILE A 88 5.814 -12.637 6.833 1.00 0.94 C ATOM 0 H ILE A 88 4.487 -16.481 6.186 1.00 0.42 H new ATOM 0 HA ILE A 88 7.259 -15.633 6.601 1.00 0.46 H new ATOM 0 HB ILE A 88 4.648 -14.791 7.102 1.00 0.51 H new ATOM 0 HG12 ILE A 88 6.314 -13.274 8.838 1.00 0.58 H new ATOM 0 HG13 ILE A 88 7.403 -13.882 7.607 1.00 0.58 H new ATOM 0 HG21 ILE A 88 4.459 -14.567 9.560 1.00 0.55 H new ATOM 0 HG22 ILE A 88 4.461 -16.275 9.061 1.00 0.55 H new ATOM 0 HG23 ILE A 88 5.928 -15.551 9.761 1.00 0.55 H new ATOM 0 HD11 ILE A 88 6.403 -11.723 6.902 1.00 0.94 H new ATOM 0 HD12 ILE A 88 5.879 -13.035 5.820 1.00 0.94 H new ATOM 0 HD13 ILE A 88 4.773 -12.417 7.070 1.00 0.94 H new ATOM 1151 N GLY A 89 6.047 -17.979 8.538 1.00 0.47 N ATOM 1152 CA GLY A 89 6.478 -19.015 9.521 1.00 0.50 C ATOM 1153 C GLY A 89 7.604 -19.832 8.892 1.00 0.47 C ATOM 1154 O GLY A 89 8.555 -20.216 9.549 1.00 0.50 O ATOM 0 H GLY A 89 5.072 -18.041 8.245 1.00 0.47 H new ATOM 0 HA2 GLY A 89 6.819 -18.545 10.443 1.00 0.50 H new ATOM 0 HA3 GLY A 89 5.641 -19.661 9.784 1.00 0.50 H new ATOM 1158 N ARG A 90 7.508 -20.082 7.612 1.00 0.44 N ATOM 1159 CA ARG A 90 8.576 -20.855 6.919 1.00 0.43 C ATOM 1160 C ARG A 90 9.855 -20.019 6.874 1.00 0.40 C ATOM 1161 O ARG A 90 10.948 -20.532 7.040 1.00 0.41 O ATOM 1162 CB ARG A 90 8.052 -21.092 5.503 1.00 0.43 C ATOM 1163 CG ARG A 90 7.083 -22.274 5.499 1.00 0.46 C ATOM 1164 CD ARG A 90 6.542 -22.471 4.083 1.00 0.46 C ATOM 1165 NE ARG A 90 6.128 -23.901 4.017 1.00 0.56 N ATOM 1166 CZ ARG A 90 5.637 -24.385 2.910 1.00 0.57 C ATOM 1167 NH1 ARG A 90 4.690 -23.743 2.281 1.00 0.62 N ATOM 1168 NH2 ARG A 90 6.092 -25.511 2.430 1.00 0.80 N ATOM 0 H ARG A 90 6.735 -19.783 7.018 1.00 0.44 H new ATOM 0 HA ARG A 90 8.806 -21.793 7.424 1.00 0.43 H new ATOM 0 HB2 ARG A 90 7.549 -20.197 5.137 1.00 0.43 H new ATOM 0 HB3 ARG A 90 8.883 -21.290 4.826 1.00 0.43 H new ATOM 0 HG2 ARG A 90 7.590 -23.178 5.837 1.00 0.46 H new ATOM 0 HG3 ARG A 90 6.263 -22.090 6.193 1.00 0.46 H new ATOM 0 HD2 ARG A 90 5.699 -21.808 3.888 1.00 0.46 H new ATOM 0 HD3 ARG A 90 7.303 -22.247 3.336 1.00 0.46 H new ATOM 0 HE ARG A 90 6.228 -24.500 4.836 1.00 0.56 H new ATOM 0 HH11 ARG A 90 4.335 -22.863 2.655 1.00 0.62 H new ATOM 0 HH12 ARG A 90 4.306 -24.121 1.415 1.00 0.62 H new ATOM 0 HH21 ARG A 90 6.832 -26.013 2.921 1.00 0.80 H new ATOM 0 HH22 ARG A 90 5.707 -25.889 1.564 1.00 0.80 H new ATOM 1182 N MET A 91 9.717 -18.725 6.673 1.00 0.39 N ATOM 1183 CA MET A 91 10.912 -17.831 6.631 1.00 0.37 C ATOM 1184 C MET A 91 11.674 -17.989 7.936 1.00 0.38 C ATOM 1185 O MET A 91 12.889 -18.044 7.962 1.00 0.38 O ATOM 1186 CB MET A 91 10.355 -16.409 6.487 1.00 0.38 C ATOM 1187 CG MET A 91 11.028 -15.713 5.303 1.00 0.60 C ATOM 1188 SD MET A 91 10.397 -14.022 5.157 1.00 0.66 S ATOM 1189 CE MET A 91 8.883 -14.420 4.248 1.00 0.56 C ATOM 0 H MET A 91 8.823 -18.254 6.536 1.00 0.39 H new ATOM 0 HA MET A 91 11.595 -18.062 5.813 1.00 0.37 H new ATOM 0 HB2 MET A 91 9.276 -16.444 6.336 1.00 0.38 H new ATOM 0 HB3 MET A 91 10.531 -15.844 7.402 1.00 0.38 H new ATOM 0 HG2 MET A 91 12.109 -15.698 5.443 1.00 0.60 H new ATOM 0 HG3 MET A 91 10.833 -16.266 4.384 1.00 0.60 H new ATOM 0 HE1 MET A 91 8.959 -14.039 3.230 1.00 0.56 H new ATOM 0 HE2 MET A 91 8.748 -15.501 4.222 1.00 0.56 H new ATOM 0 HE3 MET A 91 8.029 -13.960 4.745 1.00 0.56 H new ATOM 1199 N LEU A 92 10.950 -18.101 9.016 1.00 0.41 N ATOM 1200 CA LEU A 92 11.600 -18.300 10.335 1.00 0.43 C ATOM 1201 C LEU A 92 12.320 -19.632 10.315 1.00 0.44 C ATOM 1202 O LEU A 92 13.454 -19.735 10.735 1.00 0.46 O ATOM 1203 CB LEU A 92 10.463 -18.285 11.338 1.00 0.49 C ATOM 1204 CG LEU A 92 9.848 -16.897 11.299 1.00 0.51 C ATOM 1205 CD1 LEU A 92 8.372 -16.965 11.705 1.00 0.59 C ATOM 1206 CD2 LEU A 92 10.610 -15.971 12.253 1.00 0.57 C ATOM 0 H LEU A 92 9.931 -18.063 9.038 1.00 0.41 H new ATOM 0 HA LEU A 92 12.338 -17.538 10.584 1.00 0.43 H new ATOM 0 HB2 LEU A 92 9.720 -19.042 11.088 1.00 0.49 H new ATOM 0 HB3 LEU A 92 10.829 -18.516 12.338 1.00 0.49 H new ATOM 0 HG LEU A 92 9.916 -16.504 10.285 1.00 0.51 H new ATOM 0 HD11 LEU A 92 7.940 -15.965 11.674 1.00 0.59 H new ATOM 0 HD12 LEU A 92 7.834 -17.614 11.014 1.00 0.59 H new ATOM 0 HD13 LEU A 92 8.291 -17.364 12.716 1.00 0.59 H new ATOM 0 HD21 LEU A 92 10.168 -14.975 12.224 1.00 0.57 H new ATOM 0 HD22 LEU A 92 10.551 -16.365 13.267 1.00 0.57 H new ATOM 0 HD23 LEU A 92 11.655 -15.913 11.947 1.00 0.57 H new ATOM 1218 N ASN A 93 11.682 -20.644 9.776 1.00 0.45 N ATOM 1219 CA ASN A 93 12.352 -21.971 9.669 1.00 0.48 C ATOM 1220 C ASN A 93 13.697 -21.769 8.968 1.00 0.45 C ATOM 1221 O ASN A 93 14.637 -22.516 9.170 1.00 0.51 O ATOM 1222 CB ASN A 93 11.417 -22.836 8.819 1.00 0.52 C ATOM 1223 CG ASN A 93 11.259 -24.213 9.468 1.00 0.59 C ATOM 1224 OD1 ASN A 93 12.169 -25.018 9.441 1.00 0.76 O ATOM 1225 ND2 ASN A 93 10.135 -24.518 10.055 1.00 0.95 N ATOM 0 H ASN A 93 10.731 -20.605 9.408 1.00 0.45 H new ATOM 0 HA ASN A 93 12.538 -22.440 10.635 1.00 0.48 H new ATOM 0 HB2 ASN A 93 10.444 -22.353 8.725 1.00 0.52 H new ATOM 0 HB3 ASN A 93 11.819 -22.942 7.811 1.00 0.52 H new ATOM 0 HD21 ASN A 93 10.019 -25.433 10.492 1.00 0.95 H new ATOM 0 HD22 ASN A 93 9.372 -23.842 10.077 1.00 0.95 H new ATOM 1232 N ILE A 94 13.793 -20.734 8.161 1.00 0.40 N ATOM 1233 CA ILE A 94 15.078 -20.444 7.460 1.00 0.38 C ATOM 1234 C ILE A 94 15.985 -19.591 8.356 1.00 0.36 C ATOM 1235 O ILE A 94 17.190 -19.768 8.355 1.00 0.40 O ATOM 1236 CB ILE A 94 14.738 -19.663 6.175 1.00 0.40 C ATOM 1237 CG1 ILE A 94 13.362 -20.085 5.631 1.00 0.43 C ATOM 1238 CG2 ILE A 94 15.823 -19.941 5.124 1.00 0.44 C ATOM 1239 CD1 ILE A 94 13.152 -19.532 4.216 1.00 0.54 C ATOM 0 H ILE A 94 13.035 -20.082 7.961 1.00 0.40 H new ATOM 0 HA ILE A 94 15.601 -21.371 7.225 1.00 0.38 H new ATOM 0 HB ILE A 94 14.702 -18.597 6.401 1.00 0.40 H new ATOM 0 HG12 ILE A 94 13.287 -21.172 5.618 1.00 0.43 H new ATOM 0 HG13 ILE A 94 12.576 -19.720 6.291 1.00 0.43 H new ATOM 0 HG21 ILE A 94 15.593 -19.393 4.210 1.00 0.44 H new ATOM 0 HG22 ILE A 94 16.791 -19.618 5.506 1.00 0.44 H new ATOM 0 HG23 ILE A 94 15.856 -21.009 4.909 1.00 0.44 H new ATOM 0 HD11 ILE A 94 12.174 -19.840 3.846 1.00 0.54 H new ATOM 0 HD12 ILE A 94 13.205 -18.444 4.239 1.00 0.54 H new ATOM 0 HD13 ILE A 94 13.928 -19.919 3.555 1.00 0.54 H new ATOM 1251 N LEU A 95 15.435 -18.656 9.111 1.00 0.36 N ATOM 1252 CA LEU A 95 16.320 -17.805 9.974 1.00 0.36 C ATOM 1253 C LEU A 95 16.330 -18.300 11.429 1.00 0.39 C ATOM 1254 O LEU A 95 16.705 -17.575 12.331 1.00 0.48 O ATOM 1255 CB LEU A 95 15.756 -16.383 9.880 1.00 0.37 C ATOM 1256 CG LEU A 95 14.316 -16.356 10.380 1.00 0.41 C ATOM 1257 CD1 LEU A 95 14.249 -15.620 11.720 1.00 0.57 C ATOM 1258 CD2 LEU A 95 13.438 -15.632 9.356 1.00 0.44 C ATOM 0 H LEU A 95 14.437 -18.452 9.164 1.00 0.36 H new ATOM 0 HA LEU A 95 17.355 -17.847 9.636 1.00 0.36 H new ATOM 0 HB2 LEU A 95 16.367 -15.701 10.471 1.00 0.37 H new ATOM 0 HB3 LEU A 95 15.797 -16.035 8.848 1.00 0.37 H new ATOM 0 HG LEU A 95 13.959 -17.377 10.512 1.00 0.41 H new ATOM 0 HD11 LEU A 95 13.218 -15.603 12.074 1.00 0.57 H new ATOM 0 HD12 LEU A 95 14.875 -16.134 12.449 1.00 0.57 H new ATOM 0 HD13 LEU A 95 14.606 -14.598 11.592 1.00 0.57 H new ATOM 0 HD21 LEU A 95 12.407 -15.611 9.711 1.00 0.44 H new ATOM 0 HD22 LEU A 95 13.798 -14.611 9.225 1.00 0.44 H new ATOM 0 HD23 LEU A 95 13.483 -16.157 8.402 1.00 0.44 H new ATOM 1270 N ASN A 96 15.939 -19.532 11.661 1.00 0.36 N ATOM 1271 CA ASN A 96 15.943 -20.080 13.057 1.00 0.39 C ATOM 1272 C ASN A 96 16.861 -21.305 13.148 1.00 0.41 C ATOM 1273 O ASN A 96 17.277 -21.698 14.222 1.00 0.45 O ATOM 1274 CB ASN A 96 14.498 -20.487 13.348 1.00 0.45 C ATOM 1275 CG ASN A 96 13.713 -19.274 13.853 1.00 0.57 C ATOM 1276 OD1 ASN A 96 13.403 -19.182 15.024 1.00 0.84 O ATOM 1277 ND2 ASN A 96 13.376 -18.333 13.014 1.00 0.67 N ATOM 0 H ASN A 96 15.617 -20.182 10.944 1.00 0.36 H new ATOM 0 HA ASN A 96 16.310 -19.345 13.773 1.00 0.39 H new ATOM 0 HB2 ASN A 96 14.033 -20.884 12.446 1.00 0.45 H new ATOM 0 HB3 ASN A 96 14.477 -21.282 14.093 1.00 0.45 H new ATOM 0 HD21 ASN A 96 12.853 -17.521 13.342 1.00 0.67 H new ATOM 0 HD22 ASN A 96 13.636 -18.409 12.031 1.00 0.67 H new ATOM 1738 N PRO B 43 11.153 0.068 12.355 1.00 0.62 N ATOM 1739 CA PRO B 43 10.597 -1.224 11.902 1.00 0.56 C ATOM 1740 C PRO B 43 11.710 -2.131 11.366 1.00 0.49 C ATOM 1741 O PRO B 43 11.733 -3.318 11.627 1.00 0.51 O ATOM 1742 CB PRO B 43 9.642 -0.826 10.783 1.00 0.59 C ATOM 1743 CG PRO B 43 10.152 0.484 10.261 1.00 0.64 C ATOM 1744 CD PRO B 43 11.032 1.105 11.322 1.00 0.67 C ATOM 0 HA PRO B 43 10.108 -1.782 12.700 1.00 0.56 H new ATOM 0 HB2 PRO B 43 9.624 -1.581 9.997 1.00 0.59 H new ATOM 0 HB3 PRO B 43 8.622 -0.729 11.155 1.00 0.59 H new ATOM 0 HG2 PRO B 43 10.716 0.333 9.340 1.00 0.64 H new ATOM 0 HG3 PRO B 43 9.321 1.147 10.021 1.00 0.64 H new ATOM 0 HD2 PRO B 43 12.007 1.378 10.918 1.00 0.67 H new ATOM 0 HD3 PRO B 43 10.587 2.015 11.724 1.00 0.67 H new ATOM 1752 N LEU B 44 12.624 -1.574 10.610 1.00 0.48 N ATOM 1753 CA LEU B 44 13.744 -2.382 10.032 1.00 0.47 C ATOM 1754 C LEU B 44 13.200 -3.566 9.224 1.00 0.42 C ATOM 1755 O LEU B 44 13.903 -4.523 8.961 1.00 0.57 O ATOM 1756 CB LEU B 44 14.556 -2.882 11.230 1.00 0.58 C ATOM 1757 CG LEU B 44 15.891 -3.441 10.730 1.00 0.71 C ATOM 1758 CD1 LEU B 44 17.039 -2.843 11.546 1.00 0.91 C ATOM 1759 CD2 LEU B 44 15.901 -4.967 10.879 1.00 0.81 C ATOM 0 H LEU B 44 12.642 -0.584 10.366 1.00 0.48 H new ATOM 0 HA LEU B 44 14.353 -1.788 9.350 1.00 0.47 H new ATOM 0 HB2 LEU B 44 14.729 -2.068 11.934 1.00 0.58 H new ATOM 0 HB3 LEU B 44 14.002 -3.653 11.765 1.00 0.58 H new ATOM 0 HG LEU B 44 16.017 -3.178 9.680 1.00 0.71 H new ATOM 0 HD11 LEU B 44 17.987 -3.243 11.187 1.00 0.91 H new ATOM 0 HD12 LEU B 44 17.038 -1.759 11.435 1.00 0.91 H new ATOM 0 HD13 LEU B 44 16.911 -3.101 12.597 1.00 0.91 H new ATOM 0 HD21 LEU B 44 16.853 -5.361 10.522 1.00 0.81 H new ATOM 0 HD22 LEU B 44 15.769 -5.231 11.928 1.00 0.81 H new ATOM 0 HD23 LEU B 44 15.088 -5.395 10.293 1.00 0.81 H new ATOM 1771 N LYS B 45 11.958 -3.502 8.820 1.00 0.37 N ATOM 1772 CA LYS B 45 11.367 -4.616 8.019 1.00 0.33 C ATOM 1773 C LYS B 45 11.530 -4.328 6.523 1.00 0.32 C ATOM 1774 O LYS B 45 11.403 -5.211 5.703 1.00 0.35 O ATOM 1775 CB LYS B 45 9.886 -4.659 8.414 1.00 0.37 C ATOM 1776 CG LYS B 45 9.162 -3.417 7.882 1.00 0.39 C ATOM 1777 CD LYS B 45 7.683 -3.484 8.268 1.00 0.39 C ATOM 1778 CE LYS B 45 7.488 -2.861 9.652 1.00 0.41 C ATOM 1779 NZ LYS B 45 6.090 -3.206 10.034 1.00 0.37 N ATOM 0 H LYS B 45 11.326 -2.725 9.011 1.00 0.37 H new ATOM 0 HA LYS B 45 11.856 -5.571 8.212 1.00 0.33 H new ATOM 0 HB2 LYS B 45 9.421 -5.560 8.014 1.00 0.37 H new ATOM 0 HB3 LYS B 45 9.792 -4.707 9.499 1.00 0.37 H new ATOM 0 HG2 LYS B 45 9.615 -2.515 8.293 1.00 0.39 H new ATOM 0 HG3 LYS B 45 9.264 -3.360 6.798 1.00 0.39 H new ATOM 0 HD2 LYS B 45 7.079 -2.954 7.531 1.00 0.39 H new ATOM 0 HD3 LYS B 45 7.344 -4.520 8.273 1.00 0.39 H new ATOM 0 HE2 LYS B 45 8.204 -3.261 10.370 1.00 0.41 H new ATOM 0 HE3 LYS B 45 7.635 -1.781 9.624 1.00 0.41 H new ATOM 0 HZ1 LYS B 45 5.880 -2.813 10.974 1.00 0.37 H new ATOM 0 HZ2 LYS B 45 5.431 -2.806 9.336 1.00 0.37 H new ATOM 0 HZ3 LYS B 45 5.982 -4.240 10.059 1.00 0.37 H new ATOM 1793 N LEU B 46 11.807 -3.093 6.175 1.00 0.34 N ATOM 1794 CA LEU B 46 11.985 -2.710 4.736 1.00 0.35 C ATOM 1795 C LEU B 46 12.819 -3.760 3.983 1.00 0.33 C ATOM 1796 O LEU B 46 12.568 -4.047 2.824 1.00 0.37 O ATOM 1797 CB LEU B 46 12.730 -1.371 4.785 1.00 0.40 C ATOM 1798 CG LEU B 46 12.031 -0.355 3.876 1.00 0.62 C ATOM 1799 CD1 LEU B 46 11.238 0.637 4.732 1.00 0.76 C ATOM 1800 CD2 LEU B 46 13.078 0.406 3.059 1.00 0.76 C ATOM 0 H LEU B 46 11.919 -2.324 6.836 1.00 0.34 H new ATOM 0 HA LEU B 46 11.032 -2.642 4.210 1.00 0.35 H new ATOM 0 HB2 LEU B 46 12.759 -0.998 5.809 1.00 0.40 H new ATOM 0 HB3 LEU B 46 13.763 -1.507 4.466 1.00 0.40 H new ATOM 0 HG LEU B 46 11.353 -0.880 3.203 1.00 0.62 H new ATOM 0 HD11 LEU B 46 10.741 1.360 4.085 1.00 0.76 H new ATOM 0 HD12 LEU B 46 10.491 0.098 5.315 1.00 0.76 H new ATOM 0 HD13 LEU B 46 11.917 1.160 5.406 1.00 0.76 H new ATOM 0 HD21 LEU B 46 12.580 1.129 2.412 1.00 0.76 H new ATOM 0 HD22 LEU B 46 13.756 0.929 3.733 1.00 0.76 H new ATOM 0 HD23 LEU B 46 13.645 -0.297 2.448 1.00 0.76 H new ATOM 1812 N PHE B 47 13.789 -4.350 4.639 1.00 0.31 N ATOM 1813 CA PHE B 47 14.622 -5.390 3.968 1.00 0.31 C ATOM 1814 C PHE B 47 13.843 -6.699 3.955 1.00 0.27 C ATOM 1815 O PHE B 47 13.771 -7.389 2.955 1.00 0.29 O ATOM 1816 CB PHE B 47 15.888 -5.514 4.827 1.00 0.32 C ATOM 1817 CG PHE B 47 16.592 -6.816 4.513 1.00 0.35 C ATOM 1818 CD1 PHE B 47 16.955 -7.113 3.194 1.00 0.51 C ATOM 1819 CD2 PHE B 47 16.869 -7.729 5.538 1.00 0.45 C ATOM 1820 CE1 PHE B 47 17.597 -8.322 2.901 1.00 0.66 C ATOM 1821 CE2 PHE B 47 17.509 -8.939 5.244 1.00 0.59 C ATOM 1822 CZ PHE B 47 17.873 -9.235 3.926 1.00 0.66 C ATOM 0 H PHE B 47 14.038 -4.155 5.609 1.00 0.31 H new ATOM 0 HA PHE B 47 14.874 -5.140 2.938 1.00 0.31 H new ATOM 0 HB2 PHE B 47 16.554 -4.673 4.633 1.00 0.32 H new ATOM 0 HB3 PHE B 47 15.627 -5.477 5.885 1.00 0.32 H new ATOM 0 HD1 PHE B 47 16.740 -6.410 2.403 1.00 0.51 H new ATOM 0 HD2 PHE B 47 16.589 -7.500 6.556 1.00 0.45 H new ATOM 0 HE1 PHE B 47 17.879 -8.551 1.884 1.00 0.66 H new ATOM 0 HE2 PHE B 47 17.722 -9.644 6.034 1.00 0.59 H new ATOM 0 HZ PHE B 47 18.367 -10.168 3.699 1.00 0.66 H new ATOM 1832 N MET B 48 13.250 -7.026 5.068 1.00 0.28 N ATOM 1833 CA MET B 48 12.450 -8.275 5.161 1.00 0.28 C ATOM 1834 C MET B 48 11.319 -8.236 4.137 1.00 0.26 C ATOM 1835 O MET B 48 11.149 -9.147 3.355 1.00 0.29 O ATOM 1836 CB MET B 48 11.885 -8.263 6.580 1.00 0.35 C ATOM 1837 CG MET B 48 11.676 -9.698 7.052 1.00 0.47 C ATOM 1838 SD MET B 48 12.966 -10.161 8.240 1.00 0.53 S ATOM 1839 CE MET B 48 14.404 -9.648 7.267 1.00 0.48 C ATOM 0 H MET B 48 13.287 -6.475 5.925 1.00 0.28 H new ATOM 0 HA MET B 48 13.037 -9.171 4.961 1.00 0.28 H new ATOM 0 HB2 MET B 48 12.568 -7.743 7.251 1.00 0.35 H new ATOM 0 HB3 MET B 48 10.941 -7.719 6.603 1.00 0.35 H new ATOM 0 HG2 MET B 48 10.694 -9.797 7.514 1.00 0.47 H new ATOM 0 HG3 MET B 48 11.697 -10.376 6.199 1.00 0.47 H new ATOM 0 HE1 MET B 48 15.317 -9.947 7.782 1.00 0.48 H new ATOM 0 HE2 MET B 48 14.368 -10.122 6.286 1.00 0.48 H new ATOM 0 HE3 MET B 48 14.394 -8.565 7.147 1.00 0.48 H new ATOM 1849 N ALA B 49 10.554 -7.176 4.144 1.00 0.27 N ATOM 1850 CA ALA B 49 9.424 -7.039 3.181 1.00 0.28 C ATOM 1851 C ALA B 49 9.931 -7.156 1.741 1.00 0.28 C ATOM 1852 O ALA B 49 9.349 -7.851 0.929 1.00 0.34 O ATOM 1853 CB ALA B 49 8.859 -5.642 3.437 1.00 0.33 C ATOM 0 H ALA B 49 10.667 -6.390 4.785 1.00 0.27 H new ATOM 0 HA ALA B 49 8.673 -7.818 3.314 1.00 0.28 H new ATOM 0 HB1 ALA B 49 8.020 -5.460 2.766 1.00 0.33 H new ATOM 0 HB2 ALA B 49 8.520 -5.571 4.470 1.00 0.33 H new ATOM 0 HB3 ALA B 49 9.635 -4.897 3.258 1.00 0.33 H new ATOM 1859 N LEU B 50 11.009 -6.481 1.418 1.00 0.29 N ATOM 1860 CA LEU B 50 11.545 -6.559 0.024 1.00 0.34 C ATOM 1861 C LEU B 50 11.864 -8.012 -0.347 1.00 0.31 C ATOM 1862 O LEU B 50 11.298 -8.558 -1.280 1.00 0.35 O ATOM 1863 CB LEU B 50 12.819 -5.711 0.030 1.00 0.43 C ATOM 1864 CG LEU B 50 13.147 -5.272 -1.399 1.00 0.59 C ATOM 1865 CD1 LEU B 50 12.020 -4.386 -1.937 1.00 0.93 C ATOM 1866 CD2 LEU B 50 14.458 -4.482 -1.400 1.00 0.90 C ATOM 0 H LEU B 50 11.537 -5.884 2.055 1.00 0.29 H new ATOM 0 HA LEU B 50 10.824 -6.198 -0.710 1.00 0.34 H new ATOM 0 HB2 LEU B 50 12.684 -4.838 0.668 1.00 0.43 H new ATOM 0 HB3 LEU B 50 13.648 -6.284 0.445 1.00 0.43 H new ATOM 0 HG LEU B 50 13.249 -6.153 -2.033 1.00 0.59 H new ATOM 0 HD11 LEU B 50 12.256 -4.075 -2.955 1.00 0.93 H new ATOM 0 HD12 LEU B 50 11.085 -4.946 -1.937 1.00 0.93 H new ATOM 0 HD13 LEU B 50 11.916 -3.505 -1.303 1.00 0.93 H new ATOM 0 HD21 LEU B 50 14.693 -4.169 -2.417 1.00 0.90 H new ATOM 0 HD22 LEU B 50 14.353 -3.603 -0.764 1.00 0.90 H new ATOM 0 HD23 LEU B 50 15.262 -5.111 -1.019 1.00 0.90 H new ATOM 1878 N VAL B 51 12.761 -8.643 0.371 1.00 0.30 N ATOM 1879 CA VAL B 51 13.108 -10.054 0.056 1.00 0.32 C ATOM 1880 C VAL B 51 11.867 -10.942 0.211 1.00 0.29 C ATOM 1881 O VAL B 51 11.708 -11.918 -0.493 1.00 0.33 O ATOM 1882 CB VAL B 51 14.199 -10.441 1.058 1.00 0.36 C ATOM 1883 CG1 VAL B 51 14.691 -11.846 0.742 1.00 0.46 C ATOM 1884 CG2 VAL B 51 15.373 -9.461 0.948 1.00 0.49 C ATOM 0 H VAL B 51 13.265 -8.238 1.160 1.00 0.30 H new ATOM 0 HA VAL B 51 13.458 -10.178 -0.969 1.00 0.32 H new ATOM 0 HB VAL B 51 13.792 -10.407 2.068 1.00 0.36 H new ATOM 0 HG11 VAL B 51 15.468 -12.128 1.452 1.00 0.46 H new ATOM 0 HG12 VAL B 51 13.860 -12.548 0.816 1.00 0.46 H new ATOM 0 HG13 VAL B 51 15.097 -11.870 -0.269 1.00 0.46 H new ATOM 0 HG21 VAL B 51 16.148 -9.739 1.663 1.00 0.49 H new ATOM 0 HG22 VAL B 51 15.782 -9.495 -0.062 1.00 0.49 H new ATOM 0 HG23 VAL B 51 15.025 -8.451 1.165 1.00 0.49 H new ATOM 1894 N ALA B 52 10.981 -10.596 1.115 1.00 0.26 N ATOM 1895 CA ALA B 52 9.738 -11.410 1.302 1.00 0.27 C ATOM 1896 C ALA B 52 8.882 -11.331 0.040 1.00 0.25 C ATOM 1897 O ALA B 52 8.467 -12.339 -0.500 1.00 0.30 O ATOM 1898 CB ALA B 52 9.003 -10.775 2.483 1.00 0.32 C ATOM 0 H ALA B 52 11.065 -9.787 1.730 1.00 0.26 H new ATOM 0 HA ALA B 52 9.958 -12.461 1.488 1.00 0.27 H new ATOM 0 HB1 ALA B 52 8.081 -11.323 2.675 1.00 0.32 H new ATOM 0 HB2 ALA B 52 9.638 -10.811 3.368 1.00 0.32 H new ATOM 0 HB3 ALA B 52 8.766 -9.737 2.249 1.00 0.32 H new ATOM 1904 N PHE B 53 8.632 -10.135 -0.441 1.00 0.25 N ATOM 1905 CA PHE B 53 7.820 -9.968 -1.686 1.00 0.28 C ATOM 1906 C PHE B 53 8.407 -10.856 -2.784 1.00 0.29 C ATOM 1907 O PHE B 53 7.741 -11.727 -3.329 1.00 0.33 O ATOM 1908 CB PHE B 53 7.961 -8.485 -2.048 1.00 0.32 C ATOM 1909 CG PHE B 53 7.300 -8.215 -3.379 1.00 0.41 C ATOM 1910 CD1 PHE B 53 5.974 -8.602 -3.595 1.00 0.57 C ATOM 1911 CD2 PHE B 53 8.018 -7.576 -4.397 1.00 0.62 C ATOM 1912 CE1 PHE B 53 5.363 -8.352 -4.829 1.00 0.68 C ATOM 1913 CE2 PHE B 53 7.408 -7.326 -5.632 1.00 0.74 C ATOM 1914 CZ PHE B 53 6.081 -7.714 -5.848 1.00 0.69 C ATOM 0 H PHE B 53 8.958 -9.264 -0.021 1.00 0.25 H new ATOM 0 HA PHE B 53 6.775 -10.250 -1.561 1.00 0.28 H new ATOM 0 HB2 PHE B 53 7.505 -7.868 -1.274 1.00 0.32 H new ATOM 0 HB3 PHE B 53 9.015 -8.212 -2.094 1.00 0.32 H new ATOM 0 HD1 PHE B 53 5.421 -9.094 -2.809 1.00 0.57 H new ATOM 0 HD2 PHE B 53 9.042 -7.276 -4.230 1.00 0.62 H new ATOM 0 HE1 PHE B 53 4.339 -8.651 -4.995 1.00 0.68 H new ATOM 0 HE2 PHE B 53 7.962 -6.834 -6.418 1.00 0.74 H new ATOM 0 HZ PHE B 53 5.610 -7.521 -6.801 1.00 0.69 H new ATOM 1924 N LEU B 54 9.664 -10.663 -3.085 1.00 0.31 N ATOM 1925 CA LEU B 54 10.321 -11.508 -4.118 1.00 0.36 C ATOM 1926 C LEU B 54 10.218 -12.976 -3.695 1.00 0.33 C ATOM 1927 O LEU B 54 9.978 -13.847 -4.506 1.00 0.37 O ATOM 1928 CB LEU B 54 11.779 -11.042 -4.147 1.00 0.41 C ATOM 1929 CG LEU B 54 11.933 -9.871 -5.125 1.00 0.50 C ATOM 1930 CD1 LEU B 54 11.558 -10.326 -6.538 1.00 0.60 C ATOM 1931 CD2 LEU B 54 11.015 -8.722 -4.700 1.00 0.62 C ATOM 0 H LEU B 54 10.262 -9.956 -2.658 1.00 0.31 H new ATOM 0 HA LEU B 54 9.862 -11.419 -5.103 1.00 0.36 H new ATOM 0 HB2 LEU B 54 12.092 -10.737 -3.149 1.00 0.41 H new ATOM 0 HB3 LEU B 54 12.427 -11.865 -4.447 1.00 0.41 H new ATOM 0 HG LEU B 54 12.969 -9.531 -5.117 1.00 0.50 H new ATOM 0 HD11 LEU B 54 11.669 -9.491 -7.230 1.00 0.60 H new ATOM 0 HD12 LEU B 54 12.214 -11.141 -6.844 1.00 0.60 H new ATOM 0 HD13 LEU B 54 10.524 -10.670 -6.547 1.00 0.60 H new ATOM 0 HD21 LEU B 54 11.126 -7.891 -5.396 1.00 0.62 H new ATOM 0 HD22 LEU B 54 9.980 -9.063 -4.704 1.00 0.62 H new ATOM 0 HD23 LEU B 54 11.285 -8.393 -3.696 1.00 0.62 H new ATOM 1943 N ARG B 55 10.368 -13.246 -2.419 1.00 0.30 N ATOM 1944 CA ARG B 55 10.256 -14.652 -1.924 1.00 0.31 C ATOM 1945 C ARG B 55 8.794 -15.112 -1.950 1.00 0.29 C ATOM 1946 O ARG B 55 8.490 -16.255 -1.665 1.00 0.36 O ATOM 1947 CB ARG B 55 10.785 -14.627 -0.489 1.00 0.33 C ATOM 1948 CG ARG B 55 10.901 -16.060 0.037 1.00 0.35 C ATOM 1949 CD ARG B 55 9.731 -16.363 0.976 1.00 0.45 C ATOM 1950 NE ARG B 55 9.592 -17.846 0.947 1.00 0.55 N ATOM 1951 CZ ARG B 55 8.406 -18.393 0.935 1.00 0.49 C ATOM 1952 NH1 ARG B 55 7.657 -18.303 -0.129 1.00 0.48 N ATOM 1953 NH2 ARG B 55 7.972 -19.031 1.987 1.00 0.53 N ATOM 0 H ARG B 55 10.564 -12.550 -1.699 1.00 0.30 H new ATOM 0 HA ARG B 55 10.819 -15.346 -2.548 1.00 0.31 H new ATOM 0 HB2 ARG B 55 11.758 -14.137 -0.457 1.00 0.33 H new ATOM 0 HB3 ARG B 55 10.115 -14.048 0.147 1.00 0.33 H new ATOM 0 HG2 ARG B 55 10.903 -16.764 -0.795 1.00 0.35 H new ATOM 0 HG3 ARG B 55 11.846 -16.188 0.565 1.00 0.35 H new ATOM 0 HD2 ARG B 55 9.931 -16.004 1.986 1.00 0.45 H new ATOM 0 HD3 ARG B 55 8.817 -15.874 0.639 1.00 0.45 H new ATOM 0 HE ARG B 55 10.425 -18.435 0.936 1.00 0.55 H new ATOM 0 HH11 ARG B 55 7.997 -17.805 -0.952 1.00 0.48 H new ATOM 0 HH12 ARG B 55 6.731 -18.730 -0.138 1.00 0.48 H new ATOM 0 HH21 ARG B 55 8.559 -19.102 2.818 1.00 0.53 H new ATOM 0 HH22 ARG B 55 7.046 -19.458 1.978 1.00 0.53 H new ATOM 1967 N PHE B 56 7.887 -14.233 -2.289 1.00 0.30 N ATOM 1968 CA PHE B 56 6.451 -14.622 -2.339 1.00 0.30 C ATOM 1969 C PHE B 56 6.019 -14.854 -3.792 1.00 0.33 C ATOM 1970 O PHE B 56 5.021 -15.501 -4.047 1.00 0.37 O ATOM 1971 CB PHE B 56 5.693 -13.436 -1.736 1.00 0.29 C ATOM 1972 CG PHE B 56 5.185 -13.803 -0.360 1.00 0.30 C ATOM 1973 CD1 PHE B 56 6.089 -14.091 0.673 1.00 0.40 C ATOM 1974 CD2 PHE B 56 3.808 -13.856 -0.117 1.00 0.44 C ATOM 1975 CE1 PHE B 56 5.614 -14.431 1.945 1.00 0.46 C ATOM 1976 CE2 PHE B 56 3.333 -14.195 1.156 1.00 0.48 C ATOM 1977 CZ PHE B 56 4.236 -14.482 2.187 1.00 0.41 C ATOM 0 H PHE B 56 8.082 -13.262 -2.533 1.00 0.30 H new ATOM 0 HA PHE B 56 6.255 -15.546 -1.796 1.00 0.30 H new ATOM 0 HB2 PHE B 56 6.348 -12.567 -1.673 1.00 0.29 H new ATOM 0 HB3 PHE B 56 4.859 -13.159 -2.381 1.00 0.29 H new ATOM 0 HD1 PHE B 56 7.152 -14.050 0.487 1.00 0.40 H new ATOM 0 HD2 PHE B 56 3.111 -13.635 -0.912 1.00 0.44 H new ATOM 0 HE1 PHE B 56 6.310 -14.654 2.740 1.00 0.46 H new ATOM 0 HE2 PHE B 56 2.270 -14.235 1.343 1.00 0.48 H new ATOM 0 HZ PHE B 56 3.869 -14.743 3.169 1.00 0.41 H new ATOM 1987 N LEU B 57 6.750 -14.318 -4.746 1.00 0.35 N ATOM 1988 CA LEU B 57 6.353 -14.503 -6.180 1.00 0.40 C ATOM 1989 C LEU B 57 7.282 -15.480 -6.921 1.00 0.48 C ATOM 1990 O LEU B 57 6.821 -16.321 -7.670 1.00 0.55 O ATOM 1991 CB LEU B 57 6.443 -13.108 -6.808 1.00 0.46 C ATOM 1992 CG LEU B 57 5.724 -12.084 -5.922 1.00 0.41 C ATOM 1993 CD1 LEU B 57 5.646 -10.739 -6.650 1.00 0.56 C ATOM 1994 CD2 LEU B 57 4.305 -12.573 -5.608 1.00 0.42 C ATOM 0 H LEU B 57 7.595 -13.767 -4.595 1.00 0.35 H new ATOM 0 HA LEU B 57 5.354 -14.933 -6.250 1.00 0.40 H new ATOM 0 HB2 LEU B 57 7.488 -12.823 -6.932 1.00 0.46 H new ATOM 0 HB3 LEU B 57 5.995 -13.118 -7.802 1.00 0.46 H new ATOM 0 HG LEU B 57 6.280 -11.965 -4.992 1.00 0.41 H new ATOM 0 HD11 LEU B 57 5.135 -10.013 -6.018 1.00 0.56 H new ATOM 0 HD12 LEU B 57 6.653 -10.384 -6.868 1.00 0.56 H new ATOM 0 HD13 LEU B 57 5.094 -10.861 -7.582 1.00 0.56 H new ATOM 0 HD21 LEU B 57 3.799 -11.841 -4.978 1.00 0.42 H new ATOM 0 HD22 LEU B 57 3.749 -12.698 -6.537 1.00 0.42 H new ATOM 0 HD23 LEU B 57 4.357 -13.528 -5.085 1.00 0.42 H new ATOM 2006 N THR B 58 8.578 -15.367 -6.747 1.00 0.52 N ATOM 2007 CA THR B 58 9.513 -16.285 -7.477 1.00 0.63 C ATOM 2008 C THR B 58 10.686 -16.721 -6.588 1.00 0.59 C ATOM 2009 O THR B 58 11.443 -17.603 -6.945 1.00 0.66 O ATOM 2010 CB THR B 58 10.019 -15.456 -8.658 1.00 0.71 C ATOM 2011 OG1 THR B 58 8.919 -15.071 -9.471 1.00 1.03 O ATOM 2012 CG2 THR B 58 11.000 -16.286 -9.483 1.00 1.00 C ATOM 0 H THR B 58 9.027 -14.685 -6.136 1.00 0.52 H new ATOM 0 HA THR B 58 9.015 -17.204 -7.787 1.00 0.63 H new ATOM 0 HB THR B 58 10.525 -14.565 -8.286 1.00 0.71 H new ATOM 0 HG1 THR B 58 9.242 -14.538 -10.227 1.00 1.03 H new ATOM 0 HG21 THR B 58 11.360 -15.694 -10.324 1.00 1.00 H new ATOM 0 HG22 THR B 58 11.844 -16.579 -8.858 1.00 1.00 H new ATOM 0 HG23 THR B 58 10.498 -17.178 -9.856 1.00 1.00 H new ATOM 2020 N ILE B 59 10.834 -16.117 -5.438 1.00 0.51 N ATOM 2021 CA ILE B 59 11.945 -16.485 -4.509 1.00 0.49 C ATOM 2022 C ILE B 59 13.314 -16.442 -5.207 1.00 0.50 C ATOM 2023 O ILE B 59 13.967 -17.459 -5.354 1.00 0.55 O ATOM 2024 CB ILE B 59 11.620 -17.901 -4.044 1.00 0.55 C ATOM 2025 CG1 ILE B 59 10.218 -17.932 -3.435 1.00 0.57 C ATOM 2026 CG2 ILE B 59 12.641 -18.336 -2.988 1.00 0.59 C ATOM 2027 CD1 ILE B 59 9.198 -18.289 -4.518 1.00 0.55 C ATOM 0 H ILE B 59 10.224 -15.374 -5.098 1.00 0.51 H new ATOM 0 HA ILE B 59 12.016 -15.781 -3.680 1.00 0.49 H new ATOM 0 HB ILE B 59 11.661 -18.580 -4.896 1.00 0.55 H new ATOM 0 HG12 ILE B 59 10.177 -18.663 -2.627 1.00 0.57 H new ATOM 0 HG13 ILE B 59 9.978 -16.962 -3.000 1.00 0.57 H new ATOM 0 HG21 ILE B 59 12.411 -19.348 -2.654 1.00 0.59 H new ATOM 0 HG22 ILE B 59 13.642 -18.315 -3.419 1.00 0.59 H new ATOM 0 HG23 ILE B 59 12.598 -17.655 -2.138 1.00 0.59 H new ATOM 0 HD11 ILE B 59 8.199 -18.311 -4.083 1.00 0.55 H new ATOM 0 HD12 ILE B 59 9.233 -17.542 -5.311 1.00 0.55 H new ATOM 0 HD13 ILE B 59 9.435 -19.269 -4.932 1.00 0.55 H new ATOM 2039 N PRO B 60 13.716 -15.256 -5.592 1.00 0.47 N ATOM 2040 CA PRO B 60 15.023 -15.035 -6.230 1.00 0.49 C ATOM 2041 C PRO B 60 15.995 -14.357 -5.231 1.00 0.43 C ATOM 2042 O PRO B 60 16.488 -13.277 -5.504 1.00 0.47 O ATOM 2043 CB PRO B 60 14.646 -14.047 -7.336 1.00 0.57 C ATOM 2044 CG PRO B 60 13.405 -13.341 -6.832 1.00 0.56 C ATOM 2045 CD PRO B 60 12.998 -14.000 -5.530 1.00 0.49 C ATOM 0 HA PRO B 60 15.517 -15.943 -6.576 1.00 0.49 H new ATOM 0 HB2 PRO B 60 15.453 -13.339 -7.523 1.00 0.57 H new ATOM 0 HB3 PRO B 60 14.451 -14.564 -8.276 1.00 0.57 H new ATOM 0 HG2 PRO B 60 13.604 -12.280 -6.678 1.00 0.56 H new ATOM 0 HG3 PRO B 60 12.601 -13.411 -7.564 1.00 0.56 H new ATOM 0 HD2 PRO B 60 13.289 -13.406 -4.664 1.00 0.49 H new ATOM 0 HD3 PRO B 60 11.920 -14.149 -5.467 1.00 0.49 H new ATOM 2053 N PRO B 61 16.237 -14.985 -4.095 1.00 0.40 N ATOM 2054 CA PRO B 61 17.142 -14.377 -3.087 1.00 0.39 C ATOM 2055 C PRO B 61 18.586 -14.395 -3.590 1.00 0.39 C ATOM 2056 O PRO B 61 19.203 -15.437 -3.699 1.00 0.44 O ATOM 2057 CB PRO B 61 16.974 -15.264 -1.859 1.00 0.43 C ATOM 2058 CG PRO B 61 16.521 -16.576 -2.397 1.00 0.47 C ATOM 2059 CD PRO B 61 15.725 -16.284 -3.642 1.00 0.48 C ATOM 0 HA PRO B 61 16.908 -13.333 -2.877 1.00 0.39 H new ATOM 0 HB2 PRO B 61 17.911 -15.363 -1.311 1.00 0.43 H new ATOM 0 HB3 PRO B 61 16.243 -14.847 -1.167 1.00 0.43 H new ATOM 0 HG2 PRO B 61 17.374 -17.216 -2.624 1.00 0.47 H new ATOM 0 HG3 PRO B 61 15.912 -17.105 -1.664 1.00 0.47 H new ATOM 0 HD2 PRO B 61 15.870 -17.056 -4.398 1.00 0.48 H new ATOM 0 HD3 PRO B 61 14.656 -16.240 -3.431 1.00 0.48 H new ATOM 2067 N THR B 62 19.120 -13.243 -3.902 1.00 0.38 N ATOM 2068 CA THR B 62 20.524 -13.170 -4.409 1.00 0.42 C ATOM 2069 C THR B 62 21.493 -13.781 -3.385 1.00 0.36 C ATOM 2070 O THR B 62 21.105 -14.129 -2.288 1.00 0.35 O ATOM 2071 CB THR B 62 20.778 -11.667 -4.630 1.00 0.47 C ATOM 2072 OG1 THR B 62 21.345 -11.476 -5.917 1.00 0.63 O ATOM 2073 CG2 THR B 62 21.727 -11.104 -3.570 1.00 0.44 C ATOM 0 H THR B 62 18.642 -12.345 -3.827 1.00 0.38 H new ATOM 0 HA THR B 62 20.677 -13.735 -5.329 1.00 0.42 H new ATOM 0 HB THR B 62 19.827 -11.140 -4.552 1.00 0.47 H new ATOM 0 HG1 THR B 62 21.507 -10.521 -6.064 1.00 0.63 H new ATOM 0 HG21 THR B 62 21.887 -10.041 -3.752 1.00 0.44 H new ATOM 0 HG22 THR B 62 21.290 -11.241 -2.581 1.00 0.44 H new ATOM 0 HG23 THR B 62 22.681 -11.628 -3.620 1.00 0.44 H new ATOM 2081 N ALA B 63 22.743 -13.916 -3.749 1.00 0.41 N ATOM 2082 CA ALA B 63 23.754 -14.513 -2.820 1.00 0.41 C ATOM 2083 C ALA B 63 23.777 -13.774 -1.477 1.00 0.35 C ATOM 2084 O ALA B 63 23.814 -14.385 -0.425 1.00 0.37 O ATOM 2085 CB ALA B 63 25.094 -14.347 -3.538 1.00 0.49 C ATOM 0 H ALA B 63 23.111 -13.636 -4.658 1.00 0.41 H new ATOM 0 HA ALA B 63 23.527 -15.555 -2.595 1.00 0.41 H new ATOM 0 HB1 ALA B 63 25.891 -14.761 -2.921 1.00 0.49 H new ATOM 0 HB2 ALA B 63 25.063 -14.873 -4.492 1.00 0.49 H new ATOM 0 HB3 ALA B 63 25.284 -13.288 -3.714 1.00 0.49 H new ATOM 2091 N GLY B 64 23.773 -12.468 -1.510 1.00 0.33 N ATOM 2092 CA GLY B 64 23.813 -11.671 -0.246 1.00 0.32 C ATOM 2093 C GLY B 64 22.654 -12.059 0.679 1.00 0.29 C ATOM 2094 O GLY B 64 22.834 -12.203 1.864 1.00 0.32 O ATOM 0 H GLY B 64 23.743 -11.913 -2.365 1.00 0.33 H new ATOM 0 HA2 GLY B 64 24.762 -11.837 0.264 1.00 0.32 H new ATOM 0 HA3 GLY B 64 23.758 -10.608 -0.479 1.00 0.32 H new ATOM 2098 N ILE B 65 21.470 -12.213 0.150 1.00 0.29 N ATOM 2099 CA ILE B 65 20.296 -12.576 1.005 1.00 0.29 C ATOM 2100 C ILE B 65 20.593 -13.830 1.836 1.00 0.29 C ATOM 2101 O ILE B 65 20.242 -13.899 2.997 1.00 0.32 O ATOM 2102 CB ILE B 65 19.140 -12.834 0.030 1.00 0.31 C ATOM 2103 CG1 ILE B 65 18.926 -11.610 -0.875 1.00 0.38 C ATOM 2104 CG2 ILE B 65 17.856 -13.106 0.821 1.00 0.32 C ATOM 2105 CD1 ILE B 65 18.689 -10.362 -0.021 1.00 0.40 C ATOM 0 H ILE B 65 21.262 -12.103 -0.842 1.00 0.29 H new ATOM 0 HA ILE B 65 20.057 -11.783 1.714 1.00 0.29 H new ATOM 0 HB ILE B 65 19.385 -13.698 -0.588 1.00 0.31 H new ATOM 0 HG12 ILE B 65 19.797 -11.463 -1.514 1.00 0.38 H new ATOM 0 HG13 ILE B 65 18.073 -11.778 -1.532 1.00 0.38 H new ATOM 0 HG21 ILE B 65 17.034 -13.289 0.129 1.00 0.32 H new ATOM 0 HG22 ILE B 65 17.998 -13.981 1.456 1.00 0.32 H new ATOM 0 HG23 ILE B 65 17.621 -12.242 1.442 1.00 0.32 H new ATOM 0 HD11 ILE B 65 18.538 -9.500 -0.671 1.00 0.40 H new ATOM 0 HD12 ILE B 65 17.805 -10.508 0.599 1.00 0.40 H new ATOM 0 HD13 ILE B 65 19.555 -10.188 0.618 1.00 0.40 H new ATOM 2117 N LEU B 66 21.241 -14.814 1.261 1.00 0.33 N ATOM 2118 CA LEU B 66 21.557 -16.051 2.040 1.00 0.37 C ATOM 2119 C LEU B 66 22.810 -15.831 2.890 1.00 0.35 C ATOM 2120 O LEU B 66 22.826 -16.126 4.070 1.00 0.38 O ATOM 2121 CB LEU B 66 21.804 -17.156 1.003 1.00 0.44 C ATOM 2122 CG LEU B 66 20.517 -17.486 0.228 1.00 0.48 C ATOM 2123 CD1 LEU B 66 19.290 -17.401 1.145 1.00 0.57 C ATOM 2124 CD2 LEU B 66 20.362 -16.500 -0.930 1.00 0.47 C ATOM 0 H LEU B 66 21.563 -14.814 0.293 1.00 0.33 H new ATOM 0 HA LEU B 66 20.745 -16.316 2.717 1.00 0.37 H new ATOM 0 HB2 LEU B 66 22.580 -16.839 0.307 1.00 0.44 H new ATOM 0 HB3 LEU B 66 22.171 -18.052 1.503 1.00 0.44 H new ATOM 0 HG LEU B 66 20.589 -18.504 -0.155 1.00 0.48 H new ATOM 0 HD11 LEU B 66 18.392 -17.638 0.574 1.00 0.57 H new ATOM 0 HD12 LEU B 66 19.398 -18.112 1.964 1.00 0.57 H new ATOM 0 HD13 LEU B 66 19.207 -16.392 1.549 1.00 0.57 H new ATOM 0 HD21 LEU B 66 19.451 -16.729 -1.483 1.00 0.47 H new ATOM 0 HD22 LEU B 66 20.303 -15.485 -0.538 1.00 0.47 H new ATOM 0 HD23 LEU B 66 21.221 -16.582 -1.596 1.00 0.47 H new ATOM 2136 N LYS B 67 23.858 -15.309 2.300 1.00 0.36 N ATOM 2137 CA LYS B 67 25.112 -15.060 3.076 1.00 0.38 C ATOM 2138 C LYS B 67 24.808 -14.130 4.252 1.00 0.34 C ATOM 2139 O LYS B 67 25.300 -14.315 5.349 1.00 0.39 O ATOM 2140 CB LYS B 67 26.065 -14.384 2.089 1.00 0.43 C ATOM 2141 CG LYS B 67 26.883 -15.450 1.358 1.00 0.53 C ATOM 2142 CD LYS B 67 27.960 -16.000 2.294 1.00 0.65 C ATOM 2143 CE LYS B 67 29.029 -14.929 2.531 1.00 0.72 C ATOM 2144 NZ LYS B 67 29.320 -14.993 3.990 1.00 0.79 N ATOM 0 H LYS B 67 23.899 -15.045 1.316 1.00 0.36 H new ATOM 0 HA LYS B 67 25.541 -15.975 3.485 1.00 0.38 H new ATOM 0 HB2 LYS B 67 25.500 -13.788 1.372 1.00 0.43 H new ATOM 0 HB3 LYS B 67 26.729 -13.700 2.618 1.00 0.43 H new ATOM 0 HG2 LYS B 67 26.231 -16.257 1.023 1.00 0.53 H new ATOM 0 HG3 LYS B 67 27.344 -15.022 0.468 1.00 0.53 H new ATOM 0 HD2 LYS B 67 27.514 -16.299 3.242 1.00 0.65 H new ATOM 0 HD3 LYS B 67 28.413 -16.891 1.860 1.00 0.65 H new ATOM 0 HE2 LYS B 67 29.924 -15.127 1.941 1.00 0.72 H new ATOM 0 HE3 LYS B 67 28.669 -13.941 2.243 1.00 0.72 H new ATOM 0 HZ1 LYS B 67 30.045 -14.287 4.231 1.00 0.79 H new ATOM 0 HZ2 LYS B 67 28.451 -14.794 4.526 1.00 0.79 H new ATOM 0 HZ3 LYS B 67 29.667 -15.943 4.233 1.00 0.79 H new ATOM 2158 N ARG B 68 23.984 -13.142 4.022 1.00 0.31 N ATOM 2159 CA ARG B 68 23.613 -12.193 5.108 1.00 0.30 C ATOM 2160 C ARG B 68 22.584 -12.860 6.031 1.00 0.28 C ATOM 2161 O ARG B 68 22.500 -12.558 7.205 1.00 0.32 O ATOM 2162 CB ARG B 68 23.038 -10.960 4.384 1.00 0.29 C ATOM 2163 CG ARG B 68 21.532 -11.114 4.146 1.00 0.30 C ATOM 2164 CD ARG B 68 21.031 -9.931 3.312 1.00 0.42 C ATOM 2165 NE ARG B 68 20.885 -8.813 4.286 1.00 0.57 N ATOM 2166 CZ ARG B 68 21.786 -7.870 4.337 1.00 0.48 C ATOM 2167 NH1 ARG B 68 22.095 -7.203 3.258 1.00 0.50 N ATOM 2168 NH2 ARG B 68 22.377 -7.592 5.467 1.00 0.87 N ATOM 0 H ARG B 68 23.549 -12.952 3.119 1.00 0.31 H new ATOM 0 HA ARG B 68 24.453 -11.906 5.740 1.00 0.30 H new ATOM 0 HB2 ARG B 68 23.226 -10.065 4.977 1.00 0.29 H new ATOM 0 HB3 ARG B 68 23.548 -10.823 3.430 1.00 0.29 H new ATOM 0 HG2 ARG B 68 21.327 -12.052 3.629 1.00 0.30 H new ATOM 0 HG3 ARG B 68 21.003 -11.153 5.098 1.00 0.30 H new ATOM 0 HD2 ARG B 68 21.737 -9.677 2.521 1.00 0.42 H new ATOM 0 HD3 ARG B 68 20.081 -10.161 2.829 1.00 0.42 H new ATOM 0 HE ARG B 68 20.081 -8.785 4.913 1.00 0.57 H new ATOM 0 HH11 ARG B 68 21.632 -7.419 2.375 1.00 0.50 H new ATOM 0 HH12 ARG B 68 22.799 -6.466 3.298 1.00 0.50 H new ATOM 0 HH21 ARG B 68 22.135 -8.112 6.311 1.00 0.87 H new ATOM 0 HH22 ARG B 68 23.081 -6.855 5.507 1.00 0.87 H new ATOM 2182 N TRP B 69 21.815 -13.777 5.494 1.00 0.25 N ATOM 2183 CA TRP B 69 20.787 -14.506 6.305 1.00 0.25 C ATOM 2184 C TRP B 69 21.384 -15.032 7.616 1.00 0.25 C ATOM 2185 O TRP B 69 20.732 -15.041 8.644 1.00 0.28 O ATOM 2186 CB TRP B 69 20.392 -15.685 5.420 1.00 0.28 C ATOM 2187 CG TRP B 69 19.007 -16.137 5.735 1.00 0.27 C ATOM 2188 CD1 TRP B 69 18.687 -17.376 6.168 1.00 0.31 C ATOM 2189 CD2 TRP B 69 17.752 -15.399 5.637 1.00 0.27 C ATOM 2190 NE1 TRP B 69 17.320 -17.451 6.339 1.00 0.32 N ATOM 2191 CE2 TRP B 69 16.699 -16.261 6.026 1.00 0.30 C ATOM 2192 CE3 TRP B 69 17.422 -14.084 5.253 1.00 0.30 C ATOM 2193 CZ2 TRP B 69 15.373 -15.839 6.033 1.00 0.34 C ATOM 2194 CZ3 TRP B 69 16.085 -13.659 5.260 1.00 0.34 C ATOM 2195 CH2 TRP B 69 15.066 -14.538 5.648 1.00 0.35 C ATOM 0 H TRP B 69 21.857 -14.055 4.514 1.00 0.25 H new ATOM 0 HA TRP B 69 19.951 -13.862 6.578 1.00 0.25 H new ATOM 0 HB2 TRP B 69 20.456 -15.397 4.371 1.00 0.28 H new ATOM 0 HB3 TRP B 69 21.091 -16.508 5.568 1.00 0.28 H new ATOM 0 HD1 TRP B 69 19.387 -18.178 6.351 1.00 0.31 H new ATOM 0 HE1 TRP B 69 16.829 -18.286 6.658 1.00 0.32 H new ATOM 0 HE3 TRP B 69 18.202 -13.400 4.952 1.00 0.30 H new ATOM 0 HZ2 TRP B 69 14.588 -16.517 6.335 1.00 0.34 H new ATOM 0 HZ3 TRP B 69 15.840 -12.649 4.965 1.00 0.34 H new ATOM 0 HH2 TRP B 69 14.039 -14.205 5.648 1.00 0.35 H new ATOM 2206 N GLY B 70 22.611 -15.491 7.577 1.00 0.27 N ATOM 2207 CA GLY B 70 23.251 -16.045 8.807 1.00 0.30 C ATOM 2208 C GLY B 70 24.217 -15.028 9.420 1.00 0.33 C ATOM 2209 O GLY B 70 25.214 -15.399 10.012 1.00 0.42 O ATOM 0 H GLY B 70 23.197 -15.505 6.743 1.00 0.27 H new ATOM 0 HA2 GLY B 70 22.484 -16.309 9.535 1.00 0.30 H new ATOM 0 HA3 GLY B 70 23.787 -16.962 8.562 1.00 0.30 H new ATOM 2213 N THR B 71 23.934 -13.755 9.298 1.00 0.32 N ATOM 2214 CA THR B 71 24.849 -12.734 9.895 1.00 0.39 C ATOM 2215 C THR B 71 24.111 -11.413 10.151 1.00 0.41 C ATOM 2216 O THR B 71 24.728 -10.371 10.279 1.00 0.57 O ATOM 2217 CB THR B 71 25.981 -12.555 8.872 1.00 0.42 C ATOM 2218 OG1 THR B 71 27.148 -12.097 9.542 1.00 0.50 O ATOM 2219 CG2 THR B 71 25.581 -11.539 7.799 1.00 0.48 C ATOM 0 H THR B 71 23.117 -13.381 8.816 1.00 0.32 H new ATOM 0 HA THR B 71 25.233 -13.052 10.864 1.00 0.39 H new ATOM 0 HB THR B 71 26.176 -13.513 8.391 1.00 0.42 H new ATOM 0 HG1 THR B 71 27.874 -11.983 8.894 1.00 0.50 H new ATOM 0 HG21 THR B 71 26.395 -11.426 7.084 1.00 0.48 H new ATOM 0 HG22 THR B 71 24.689 -11.890 7.280 1.00 0.48 H new ATOM 0 HG23 THR B 71 25.374 -10.577 8.268 1.00 0.48 H new ATOM 2227 N ILE B 72 22.804 -11.444 10.241 1.00 0.39 N ATOM 2228 CA ILE B 72 22.049 -10.184 10.507 1.00 0.42 C ATOM 2229 C ILE B 72 21.790 -10.046 12.015 1.00 0.43 C ATOM 2230 O ILE B 72 22.716 -10.081 12.804 1.00 0.54 O ATOM 2231 CB ILE B 72 20.746 -10.291 9.702 1.00 0.43 C ATOM 2232 CG1 ILE B 72 19.956 -11.527 10.136 1.00 0.40 C ATOM 2233 CG2 ILE B 72 21.066 -10.388 8.207 1.00 0.49 C ATOM 2234 CD1 ILE B 72 18.461 -11.207 10.064 1.00 0.42 C ATOM 0 H ILE B 72 22.232 -12.283 10.142 1.00 0.39 H new ATOM 0 HA ILE B 72 22.601 -9.294 10.206 1.00 0.42 H new ATOM 0 HB ILE B 72 20.145 -9.401 9.888 1.00 0.43 H new ATOM 0 HG12 ILE B 72 20.193 -12.372 9.490 1.00 0.40 H new ATOM 0 HG13 ILE B 72 20.232 -11.814 11.151 1.00 0.40 H new ATOM 0 HG21 ILE B 72 20.138 -10.464 7.640 1.00 0.49 H new ATOM 0 HG22 ILE B 72 21.611 -9.498 7.893 1.00 0.49 H new ATOM 0 HG23 ILE B 72 21.677 -11.272 8.022 1.00 0.49 H new ATOM 0 HD11 ILE B 72 17.887 -12.081 10.371 1.00 0.42 H new ATOM 0 HD12 ILE B 72 18.235 -10.373 10.728 1.00 0.42 H new ATOM 0 HD13 ILE B 72 18.195 -10.939 9.041 1.00 0.42 H new ATOM 2246 N LYS B 73 20.559 -9.872 12.423 1.00 0.37 N ATOM 2247 CA LYS B 73 20.269 -9.711 13.880 1.00 0.38 C ATOM 2248 C LYS B 73 19.336 -10.800 14.398 1.00 0.34 C ATOM 2249 O LYS B 73 19.459 -11.234 15.527 1.00 0.37 O ATOM 2250 CB LYS B 73 19.576 -8.358 13.982 1.00 0.43 C ATOM 2251 CG LYS B 73 19.391 -7.993 15.451 1.00 0.46 C ATOM 2252 CD LYS B 73 20.030 -6.632 15.737 1.00 0.68 C ATOM 2253 CE LYS B 73 21.544 -6.781 15.908 1.00 0.80 C ATOM 2254 NZ LYS B 73 22.093 -6.916 14.528 1.00 0.74 N ATOM 0 H LYS B 73 19.743 -9.834 11.812 1.00 0.37 H new ATOM 0 HA LYS B 73 21.181 -9.780 14.474 1.00 0.38 H new ATOM 0 HB2 LYS B 73 20.169 -7.595 13.478 1.00 0.43 H new ATOM 0 HB3 LYS B 73 18.609 -8.394 13.480 1.00 0.43 H new ATOM 0 HG2 LYS B 73 18.329 -7.964 15.696 1.00 0.46 H new ATOM 0 HG3 LYS B 73 19.844 -8.757 16.084 1.00 0.46 H new ATOM 0 HD2 LYS B 73 19.816 -5.943 14.920 1.00 0.68 H new ATOM 0 HD3 LYS B 73 19.596 -6.201 16.639 1.00 0.68 H new ATOM 0 HE2 LYS B 73 21.968 -5.915 16.415 1.00 0.80 H new ATOM 0 HE3 LYS B 73 21.786 -7.655 16.513 1.00 0.80 H new ATOM 0 HZ1 LYS B 73 23.074 -6.572 14.509 1.00 0.74 H new ATOM 0 HZ2 LYS B 73 22.071 -7.916 14.242 1.00 0.74 H new ATOM 0 HZ3 LYS B 73 21.517 -6.355 13.869 1.00 0.74 H new ATOM 2268 N LYS B 74 18.391 -11.205 13.593 1.00 0.33 N ATOM 2269 CA LYS B 74 17.389 -12.243 14.002 1.00 0.32 C ATOM 2270 C LYS B 74 16.408 -11.668 15.028 1.00 0.33 C ATOM 2271 O LYS B 74 15.209 -11.818 14.894 1.00 0.35 O ATOM 2272 CB LYS B 74 18.159 -13.428 14.606 1.00 0.35 C ATOM 2273 CG LYS B 74 19.221 -13.934 13.630 1.00 0.34 C ATOM 2274 CD LYS B 74 18.652 -13.998 12.215 1.00 0.39 C ATOM 2275 CE LYS B 74 19.352 -15.111 11.438 1.00 0.33 C ATOM 2276 NZ LYS B 74 20.779 -14.693 11.367 1.00 0.33 N ATOM 0 H LYS B 74 18.265 -10.853 12.644 1.00 0.33 H new ATOM 0 HA LYS B 74 16.810 -12.568 13.137 1.00 0.32 H new ATOM 0 HB2 LYS B 74 18.631 -13.123 15.540 1.00 0.35 H new ATOM 0 HB3 LYS B 74 17.466 -14.234 14.847 1.00 0.35 H new ATOM 0 HG2 LYS B 74 20.088 -13.274 13.651 1.00 0.34 H new ATOM 0 HG3 LYS B 74 19.565 -14.922 13.936 1.00 0.34 H new ATOM 0 HD2 LYS B 74 17.579 -14.184 12.251 1.00 0.39 H new ATOM 0 HD3 LYS B 74 18.794 -13.042 11.710 1.00 0.39 H new ATOM 0 HE2 LYS B 74 19.247 -16.071 11.943 1.00 0.33 H new ATOM 0 HE3 LYS B 74 18.924 -15.226 10.442 1.00 0.33 H new ATOM 0 HZ1 LYS B 74 21.106 -14.740 10.381 1.00 0.33 H new ATOM 0 HZ2 LYS B 74 20.873 -13.718 11.717 1.00 0.33 H new ATOM 0 HZ3 LYS B 74 21.357 -15.329 11.954 1.00 0.33 H new ATOM 2290 N SER B 75 16.901 -11.004 16.045 1.00 0.36 N ATOM 2291 CA SER B 75 15.983 -10.421 17.067 1.00 0.38 C ATOM 2292 C SER B 75 15.065 -9.405 16.390 1.00 0.36 C ATOM 2293 O SER B 75 13.871 -9.392 16.610 1.00 0.38 O ATOM 2294 CB SER B 75 16.895 -9.750 18.101 1.00 0.43 C ATOM 2295 OG SER B 75 17.326 -8.484 17.616 1.00 0.47 O ATOM 0 H SER B 75 17.895 -10.842 16.209 1.00 0.36 H new ATOM 0 HA SER B 75 15.345 -11.167 17.542 1.00 0.38 H new ATOM 0 HB2 SER B 75 16.362 -9.626 19.043 1.00 0.43 H new ATOM 0 HB3 SER B 75 17.758 -10.384 18.304 1.00 0.43 H new ATOM 0 HG SER B 75 17.907 -8.059 18.281 1.00 0.47 H new ATOM 2301 N LYS B 76 15.622 -8.572 15.551 1.00 0.38 N ATOM 2302 CA LYS B 76 14.798 -7.562 14.831 1.00 0.38 C ATOM 2303 C LYS B 76 14.013 -8.247 13.712 1.00 0.37 C ATOM 2304 O LYS B 76 12.840 -7.994 13.523 1.00 0.44 O ATOM 2305 CB LYS B 76 15.806 -6.567 14.254 1.00 0.41 C ATOM 2306 CG LYS B 76 15.090 -5.270 13.865 1.00 0.47 C ATOM 2307 CD LYS B 76 14.454 -4.637 15.107 1.00 0.53 C ATOM 2308 CE LYS B 76 12.938 -4.851 15.074 1.00 0.81 C ATOM 2309 NZ LYS B 76 12.356 -3.526 15.426 1.00 0.76 N ATOM 0 H LYS B 76 16.618 -8.549 15.334 1.00 0.38 H new ATOM 0 HA LYS B 76 14.074 -7.069 15.479 1.00 0.38 H new ATOM 0 HB2 LYS B 76 16.585 -6.357 14.987 1.00 0.41 H new ATOM 0 HB3 LYS B 76 16.297 -6.998 13.382 1.00 0.41 H new ATOM 0 HG2 LYS B 76 15.797 -4.575 13.413 1.00 0.47 H new ATOM 0 HG3 LYS B 76 14.324 -5.477 13.118 1.00 0.47 H new ATOM 0 HD2 LYS B 76 14.874 -5.081 16.009 1.00 0.53 H new ATOM 0 HD3 LYS B 76 14.680 -3.571 15.141 1.00 0.53 H new ATOM 0 HE2 LYS B 76 12.607 -5.179 14.089 1.00 0.81 H new ATOM 0 HE3 LYS B 76 12.632 -5.618 15.785 1.00 0.81 H new ATOM 0 HZ1 LYS B 76 11.318 -3.591 15.424 1.00 0.76 H new ATOM 0 HZ2 LYS B 76 12.684 -3.243 16.372 1.00 0.76 H new ATOM 0 HZ3 LYS B 76 12.659 -2.817 14.728 1.00 0.76 H new ATOM 2323 N ALA B 77 14.656 -9.122 12.976 1.00 0.33 N ATOM 2324 CA ALA B 77 13.956 -9.840 11.866 1.00 0.34 C ATOM 2325 C ALA B 77 12.764 -10.623 12.416 1.00 0.32 C ATOM 2326 O ALA B 77 11.642 -10.450 11.981 1.00 0.36 O ATOM 2327 CB ALA B 77 14.992 -10.807 11.289 1.00 0.37 C ATOM 0 H ALA B 77 15.638 -9.370 13.097 1.00 0.33 H new ATOM 0 HA ALA B 77 13.576 -9.150 11.113 1.00 0.34 H new ATOM 0 HB1 ALA B 77 14.547 -11.369 10.468 1.00 0.37 H new ATOM 0 HB2 ALA B 77 15.850 -10.244 10.921 1.00 0.37 H new ATOM 0 HB3 ALA B 77 15.318 -11.498 12.067 1.00 0.37 H new ATOM 2333 N ILE B 78 13.008 -11.485 13.370 1.00 0.32 N ATOM 2334 CA ILE B 78 11.898 -12.292 13.957 1.00 0.34 C ATOM 2335 C ILE B 78 10.833 -11.363 14.551 1.00 0.33 C ATOM 2336 O ILE B 78 9.650 -11.577 14.364 1.00 0.35 O ATOM 2337 CB ILE B 78 12.564 -13.162 15.027 1.00 0.38 C ATOM 2338 CG1 ILE B 78 13.582 -14.089 14.347 1.00 0.39 C ATOM 2339 CG2 ILE B 78 11.506 -14.006 15.742 1.00 0.46 C ATOM 2340 CD1 ILE B 78 14.652 -14.517 15.352 1.00 0.43 C ATOM 0 H ILE B 78 13.930 -11.664 13.768 1.00 0.32 H new ATOM 0 HA ILE B 78 11.383 -12.908 13.220 1.00 0.34 H new ATOM 0 HB ILE B 78 13.065 -12.527 15.757 1.00 0.38 H new ATOM 0 HG12 ILE B 78 13.076 -14.967 13.946 1.00 0.39 H new ATOM 0 HG13 ILE B 78 14.047 -13.577 13.504 1.00 0.39 H new ATOM 0 HG21 ILE B 78 11.985 -14.623 16.502 1.00 0.46 H new ATOM 0 HG22 ILE B 78 10.776 -13.350 16.215 1.00 0.46 H new ATOM 0 HG23 ILE B 78 11.002 -14.647 15.019 1.00 0.46 H new ATOM 0 HD11 ILE B 78 15.370 -15.174 14.861 1.00 0.43 H new ATOM 0 HD12 ILE B 78 15.168 -13.635 15.732 1.00 0.43 H new ATOM 0 HD13 ILE B 78 14.182 -15.047 16.180 1.00 0.43 H new ATOM 2352 N ASN B 79 11.236 -10.319 15.237 1.00 0.35 N ATOM 2353 CA ASN B 79 10.227 -9.370 15.802 1.00 0.35 C ATOM 2354 C ASN B 79 9.470 -8.720 14.647 1.00 0.34 C ATOM 2355 O ASN B 79 8.268 -8.531 14.701 1.00 0.36 O ATOM 2356 CB ASN B 79 11.027 -8.323 16.577 1.00 0.37 C ATOM 2357 CG ASN B 79 11.083 -8.717 18.055 1.00 0.45 C ATOM 2358 OD1 ASN B 79 10.061 -8.882 18.690 1.00 0.65 O ATOM 2359 ND2 ASN B 79 12.241 -8.877 18.633 1.00 0.63 N ATOM 0 H ASN B 79 12.210 -10.086 15.428 1.00 0.35 H new ATOM 0 HA ASN B 79 9.502 -9.862 16.450 1.00 0.35 H new ATOM 0 HB2 ASN B 79 12.036 -8.247 16.171 1.00 0.37 H new ATOM 0 HB3 ASN B 79 10.564 -7.342 16.468 1.00 0.37 H new ATOM 0 HD21 ASN B 79 12.288 -9.140 19.617 1.00 0.63 H new ATOM 0 HD22 ASN B 79 13.100 -8.739 18.101 1.00 0.63 H new ATOM 2366 N VAL B 80 10.173 -8.402 13.589 1.00 0.34 N ATOM 2367 CA VAL B 80 9.514 -7.787 12.400 1.00 0.35 C ATOM 2368 C VAL B 80 8.491 -8.776 11.839 1.00 0.33 C ATOM 2369 O VAL B 80 7.360 -8.424 11.559 1.00 0.38 O ATOM 2370 CB VAL B 80 10.661 -7.530 11.403 1.00 0.35 C ATOM 2371 CG1 VAL B 80 10.269 -7.974 9.988 1.00 0.39 C ATOM 2372 CG2 VAL B 80 10.989 -6.036 11.387 1.00 0.44 C ATOM 0 H VAL B 80 11.179 -8.543 13.499 1.00 0.34 H new ATOM 0 HA VAL B 80 8.979 -6.864 12.624 1.00 0.35 H new ATOM 0 HB VAL B 80 11.530 -8.106 11.720 1.00 0.35 H new ATOM 0 HG11 VAL B 80 11.096 -7.782 9.304 1.00 0.39 H new ATOM 0 HG12 VAL B 80 10.041 -9.040 9.991 1.00 0.39 H new ATOM 0 HG13 VAL B 80 9.391 -7.416 9.662 1.00 0.39 H new ATOM 0 HG21 VAL B 80 11.800 -5.849 10.683 1.00 0.44 H new ATOM 0 HG22 VAL B 80 10.107 -5.473 11.082 1.00 0.44 H new ATOM 0 HG23 VAL B 80 11.294 -5.720 12.384 1.00 0.44 H new ATOM 2382 N LEU B 81 8.888 -10.014 11.684 1.00 0.32 N ATOM 2383 CA LEU B 81 7.951 -11.044 11.150 1.00 0.33 C ATOM 2384 C LEU B 81 6.728 -11.146 12.061 1.00 0.32 C ATOM 2385 O LEU B 81 5.615 -11.331 11.604 1.00 0.32 O ATOM 2386 CB LEU B 81 8.749 -12.347 11.149 1.00 0.37 C ATOM 2387 CG LEU B 81 8.922 -12.829 9.710 1.00 0.45 C ATOM 2388 CD1 LEU B 81 10.230 -12.279 9.140 1.00 0.86 C ATOM 2389 CD2 LEU B 81 8.961 -14.355 9.691 1.00 0.50 C ATOM 0 H LEU B 81 9.824 -10.355 11.905 1.00 0.32 H new ATOM 0 HA LEU B 81 7.584 -10.804 10.152 1.00 0.33 H new ATOM 0 HB2 LEU B 81 9.723 -12.191 11.613 1.00 0.37 H new ATOM 0 HB3 LEU B 81 8.233 -13.104 11.739 1.00 0.37 H new ATOM 0 HG LEU B 81 8.087 -12.476 9.104 1.00 0.45 H new ATOM 0 HD11 LEU B 81 10.353 -12.623 8.113 1.00 0.86 H new ATOM 0 HD12 LEU B 81 10.204 -11.189 9.157 1.00 0.86 H new ATOM 0 HD13 LEU B 81 11.067 -12.632 9.743 1.00 0.86 H new ATOM 0 HD21 LEU B 81 9.084 -14.703 8.665 1.00 0.50 H new ATOM 0 HD22 LEU B 81 9.797 -14.705 10.296 1.00 0.50 H new ATOM 0 HD23 LEU B 81 8.029 -14.748 10.098 1.00 0.50 H new ATOM 2401 N ARG B 82 6.921 -10.998 13.346 1.00 0.36 N ATOM 2402 CA ARG B 82 5.762 -11.051 14.279 1.00 0.37 C ATOM 2403 C ARG B 82 4.826 -9.889 13.938 1.00 0.35 C ATOM 2404 O ARG B 82 3.613 -10.015 13.959 1.00 0.35 O ATOM 2405 CB ARG B 82 6.362 -10.888 15.678 1.00 0.44 C ATOM 2406 CG ARG B 82 5.639 -11.815 16.658 1.00 0.50 C ATOM 2407 CD ARG B 82 6.220 -13.236 16.562 1.00 0.49 C ATOM 2408 NE ARG B 82 7.614 -13.179 17.116 1.00 0.52 N ATOM 2409 CZ ARG B 82 7.926 -12.367 18.094 1.00 0.66 C ATOM 2410 NH1 ARG B 82 7.207 -12.338 19.183 1.00 0.87 N ATOM 2411 NH2 ARG B 82 8.970 -11.594 17.982 1.00 0.78 N ATOM 0 H ARG B 82 7.828 -10.843 13.786 1.00 0.36 H new ATOM 0 HA ARG B 82 5.189 -11.976 14.213 1.00 0.37 H new ATOM 0 HB2 ARG B 82 7.426 -11.122 15.658 1.00 0.44 H new ATOM 0 HB3 ARG B 82 6.270 -9.853 16.006 1.00 0.44 H new ATOM 0 HG2 ARG B 82 5.746 -11.437 17.675 1.00 0.50 H new ATOM 0 HG3 ARG B 82 4.572 -11.833 16.435 1.00 0.50 H new ATOM 0 HD2 ARG B 82 5.609 -13.941 17.126 1.00 0.49 H new ATOM 0 HD3 ARG B 82 6.230 -13.579 15.528 1.00 0.49 H new ATOM 0 HE ARG B 82 8.333 -13.786 16.722 1.00 0.52 H new ATOM 0 HH11 ARG B 82 6.397 -12.950 19.276 1.00 0.87 H new ATOM 0 HH12 ARG B 82 7.456 -11.703 19.941 1.00 0.87 H new ATOM 0 HH21 ARG B 82 9.538 -11.624 17.136 1.00 0.78 H new ATOM 0 HH22 ARG B 82 9.218 -10.959 18.741 1.00 0.78 H new ATOM 2425 N GLY B 83 5.399 -8.763 13.589 1.00 0.35 N ATOM 2426 CA GLY B 83 4.578 -7.580 13.206 1.00 0.36 C ATOM 2427 C GLY B 83 3.973 -7.832 11.824 1.00 0.32 C ATOM 2428 O GLY B 83 2.895 -7.362 11.517 1.00 0.33 O ATOM 0 H GLY B 83 6.408 -8.615 13.554 1.00 0.35 H new ATOM 0 HA2 GLY B 83 3.789 -7.414 13.940 1.00 0.36 H new ATOM 0 HA3 GLY B 83 5.194 -6.681 13.191 1.00 0.36 H new ATOM 2432 N PHE B 84 4.653 -8.591 10.995 1.00 0.31 N ATOM 2433 CA PHE B 84 4.111 -8.899 9.636 1.00 0.31 C ATOM 2434 C PHE B 84 2.773 -9.617 9.795 1.00 0.29 C ATOM 2435 O PHE B 84 1.816 -9.340 9.098 1.00 0.31 O ATOM 2436 CB PHE B 84 5.139 -9.831 8.984 1.00 0.33 C ATOM 2437 CG PHE B 84 5.912 -9.101 7.922 1.00 0.28 C ATOM 2438 CD1 PHE B 84 5.425 -9.051 6.611 1.00 0.48 C ATOM 2439 CD2 PHE B 84 7.129 -8.494 8.244 1.00 0.40 C ATOM 2440 CE1 PHE B 84 6.159 -8.392 5.623 1.00 0.50 C ATOM 2441 CE2 PHE B 84 7.860 -7.832 7.257 1.00 0.44 C ATOM 2442 CZ PHE B 84 7.376 -7.782 5.947 1.00 0.36 C ATOM 0 H PHE B 84 5.560 -9.009 11.203 1.00 0.31 H new ATOM 0 HA PHE B 84 3.950 -8.005 9.033 1.00 0.31 H new ATOM 0 HB2 PHE B 84 5.823 -10.214 9.741 1.00 0.33 H new ATOM 0 HB3 PHE B 84 4.633 -10.692 8.547 1.00 0.33 H new ATOM 0 HD1 PHE B 84 4.484 -9.521 6.364 1.00 0.48 H new ATOM 0 HD2 PHE B 84 7.503 -8.537 9.256 1.00 0.40 H new ATOM 0 HE1 PHE B 84 5.788 -8.353 4.610 1.00 0.50 H new ATOM 0 HE2 PHE B 84 8.799 -7.359 7.505 1.00 0.44 H new ATOM 0 HZ PHE B 84 7.943 -7.271 5.183 1.00 0.36 H new ATOM 2452 N ARG B 85 2.709 -10.532 10.730 1.00 0.30 N ATOM 2453 CA ARG B 85 1.441 -11.277 10.974 1.00 0.32 C ATOM 2454 C ARG B 85 0.401 -10.329 11.572 1.00 0.31 C ATOM 2455 O ARG B 85 -0.755 -10.355 11.204 1.00 0.35 O ATOM 2456 CB ARG B 85 1.807 -12.376 11.971 1.00 0.40 C ATOM 2457 CG ARG B 85 0.589 -13.270 12.214 1.00 0.48 C ATOM 2458 CD ARG B 85 -0.189 -12.752 13.426 1.00 0.72 C ATOM 2459 NE ARG B 85 -0.655 -13.976 14.134 1.00 0.80 N ATOM 2460 CZ ARG B 85 -0.922 -13.928 15.411 1.00 0.77 C ATOM 2461 NH1 ARG B 85 0.050 -13.955 16.281 1.00 0.80 N ATOM 2462 NH2 ARG B 85 -2.160 -13.853 15.816 1.00 1.03 N ATOM 0 H ARG B 85 3.486 -10.794 11.337 1.00 0.30 H new ATOM 0 HA ARG B 85 1.016 -11.693 10.061 1.00 0.32 H new ATOM 0 HB2 ARG B 85 2.636 -12.970 11.586 1.00 0.40 H new ATOM 0 HB3 ARG B 85 2.140 -11.934 12.910 1.00 0.40 H new ATOM 0 HG2 ARG B 85 -0.052 -13.277 11.333 1.00 0.48 H new ATOM 0 HG3 ARG B 85 0.907 -14.298 12.385 1.00 0.48 H new ATOM 0 HD2 ARG B 85 0.443 -12.140 14.069 1.00 0.72 H new ATOM 0 HD3 ARG B 85 -1.029 -12.129 13.119 1.00 0.72 H new ATOM 0 HE ARG B 85 -0.766 -14.851 13.622 1.00 0.80 H new ATOM 0 HH11 ARG B 85 1.017 -14.014 15.963 1.00 0.80 H new ATOM 0 HH12 ARG B 85 -0.158 -13.918 17.279 1.00 0.80 H new ATOM 0 HH21 ARG B 85 -2.919 -13.832 15.135 1.00 1.03 H new ATOM 0 HH22 ARG B 85 -2.369 -13.816 16.814 1.00 1.03 H new ATOM 2476 N LYS B 86 0.805 -9.486 12.488 1.00 0.30 N ATOM 2477 CA LYS B 86 -0.170 -8.531 13.096 1.00 0.31 C ATOM 2478 C LYS B 86 -0.648 -7.537 12.033 1.00 0.29 C ATOM 2479 O LYS B 86 -1.813 -7.188 11.974 1.00 0.36 O ATOM 2480 CB LYS B 86 0.602 -7.812 14.205 1.00 0.36 C ATOM 2481 CG LYS B 86 -0.219 -7.836 15.496 1.00 0.42 C ATOM 2482 CD LYS B 86 -0.182 -9.241 16.103 1.00 0.53 C ATOM 2483 CE LYS B 86 -1.443 -10.010 15.698 1.00 0.51 C ATOM 2484 NZ LYS B 86 -1.805 -10.814 16.898 1.00 0.67 N ATOM 0 H LYS B 86 1.760 -9.418 12.839 1.00 0.30 H new ATOM 0 HA LYS B 86 -1.054 -9.033 13.490 1.00 0.31 H new ATOM 0 HB2 LYS B 86 1.565 -8.296 14.365 1.00 0.36 H new ATOM 0 HB3 LYS B 86 0.808 -6.783 13.911 1.00 0.36 H new ATOM 0 HG2 LYS B 86 0.180 -7.112 16.206 1.00 0.42 H new ATOM 0 HG3 LYS B 86 -1.249 -7.545 15.289 1.00 0.42 H new ATOM 0 HD2 LYS B 86 0.706 -9.773 15.761 1.00 0.53 H new ATOM 0 HD3 LYS B 86 -0.116 -9.177 17.189 1.00 0.53 H new ATOM 0 HE2 LYS B 86 -2.248 -9.330 15.421 1.00 0.51 H new ATOM 0 HE3 LYS B 86 -1.255 -10.650 14.836 1.00 0.51 H new ATOM 0 HZ1 LYS B 86 -2.661 -11.370 16.698 1.00 0.67 H new ATOM 0 HZ2 LYS B 86 -1.022 -11.457 17.134 1.00 0.67 H new ATOM 0 HZ3 LYS B 86 -1.985 -10.178 17.701 1.00 0.67 H new ATOM 2498 N GLU B 87 0.246 -7.089 11.186 1.00 0.26 N ATOM 2499 CA GLU B 87 -0.147 -6.124 10.116 1.00 0.28 C ATOM 2500 C GLU B 87 -1.113 -6.798 9.139 1.00 0.28 C ATOM 2501 O GLU B 87 -2.047 -6.184 8.657 1.00 0.33 O ATOM 2502 CB GLU B 87 1.159 -5.748 9.412 1.00 0.31 C ATOM 2503 CG GLU B 87 1.915 -4.714 10.253 1.00 0.38 C ATOM 2504 CD GLU B 87 2.461 -3.611 9.344 1.00 0.35 C ATOM 2505 OE1 GLU B 87 3.084 -3.943 8.350 1.00 0.40 O ATOM 2506 OE2 GLU B 87 2.247 -2.452 9.659 1.00 0.50 O ATOM 0 H GLU B 87 1.232 -7.351 11.191 1.00 0.26 H new ATOM 0 HA GLU B 87 -0.654 -5.245 10.515 1.00 0.28 H new ATOM 0 HB2 GLU B 87 1.775 -6.636 9.268 1.00 0.31 H new ATOM 0 HB3 GLU B 87 0.947 -5.343 8.423 1.00 0.31 H new ATOM 0 HG2 GLU B 87 1.251 -4.285 11.003 1.00 0.38 H new ATOM 0 HG3 GLU B 87 2.733 -5.195 10.789 1.00 0.38 H new ATOM 2513 N ILE B 88 -0.901 -8.059 8.852 1.00 0.27 N ATOM 2514 CA ILE B 88 -1.815 -8.776 7.915 1.00 0.29 C ATOM 2515 C ILE B 88 -3.189 -8.943 8.578 1.00 0.29 C ATOM 2516 O ILE B 88 -4.219 -8.863 7.929 1.00 0.33 O ATOM 2517 CB ILE B 88 -1.127 -10.127 7.635 1.00 0.33 C ATOM 2518 CG1 ILE B 88 -1.278 -10.473 6.148 1.00 0.45 C ATOM 2519 CG2 ILE B 88 -1.743 -11.248 8.480 1.00 0.36 C ATOM 2520 CD1 ILE B 88 0.087 -10.389 5.461 1.00 0.70 C ATOM 0 H ILE B 88 -0.136 -8.620 9.226 1.00 0.27 H new ATOM 0 HA ILE B 88 -1.989 -8.240 6.982 1.00 0.29 H new ATOM 0 HB ILE B 88 -0.073 -10.037 7.898 1.00 0.33 H new ATOM 0 HG12 ILE B 88 -1.691 -11.476 6.038 1.00 0.45 H new ATOM 0 HG13 ILE B 88 -1.978 -9.786 5.673 1.00 0.45 H new ATOM 0 HG21 ILE B 88 -1.237 -12.189 8.261 1.00 0.36 H new ATOM 0 HG22 ILE B 88 -1.627 -11.012 9.538 1.00 0.36 H new ATOM 0 HG23 ILE B 88 -2.803 -11.342 8.243 1.00 0.36 H new ATOM 0 HD11 ILE B 88 -0.022 -10.635 4.405 1.00 0.70 H new ATOM 0 HD12 ILE B 88 0.482 -9.378 5.559 1.00 0.70 H new ATOM 0 HD13 ILE B 88 0.774 -11.094 5.929 1.00 0.70 H new ATOM 2532 N GLY B 89 -3.207 -9.147 9.873 1.00 0.29 N ATOM 2533 CA GLY B 89 -4.505 -9.291 10.594 1.00 0.33 C ATOM 2534 C GLY B 89 -5.260 -7.971 10.478 1.00 0.30 C ATOM 2535 O GLY B 89 -6.469 -7.940 10.334 1.00 0.36 O ATOM 0 H GLY B 89 -2.376 -9.220 10.460 1.00 0.29 H new ATOM 0 HA2 GLY B 89 -5.091 -10.104 10.165 1.00 0.33 H new ATOM 0 HA3 GLY B 89 -4.333 -9.541 11.641 1.00 0.33 H new ATOM 2539 N ARG B 90 -4.543 -6.879 10.520 1.00 0.27 N ATOM 2540 CA ARG B 90 -5.197 -5.549 10.390 1.00 0.26 C ATOM 2541 C ARG B 90 -5.734 -5.389 8.969 1.00 0.23 C ATOM 2542 O ARG B 90 -6.806 -4.849 8.759 1.00 0.26 O ATOM 2543 CB ARG B 90 -4.091 -4.527 10.655 1.00 0.29 C ATOM 2544 CG ARG B 90 -3.875 -4.372 12.160 1.00 0.38 C ATOM 2545 CD ARG B 90 -2.729 -3.388 12.401 1.00 0.50 C ATOM 2546 NE ARG B 90 -2.968 -2.834 13.764 1.00 0.43 N ATOM 2547 CZ ARG B 90 -2.166 -1.926 14.249 1.00 0.74 C ATOM 2548 NH1 ARG B 90 -0.873 -2.100 14.190 1.00 1.20 N ATOM 2549 NH2 ARG B 90 -2.654 -0.845 14.794 1.00 0.74 N ATOM 0 H ARG B 90 -3.530 -6.853 10.639 1.00 0.27 H new ATOM 0 HA ARG B 90 -6.032 -5.425 11.079 1.00 0.26 H new ATOM 0 HB2 ARG B 90 -3.165 -4.848 10.177 1.00 0.29 H new ATOM 0 HB3 ARG B 90 -4.359 -3.566 10.217 1.00 0.29 H new ATOM 0 HG2 ARG B 90 -4.787 -4.011 12.636 1.00 0.38 H new ATOM 0 HG3 ARG B 90 -3.642 -5.338 12.608 1.00 0.38 H new ATOM 0 HD2 ARG B 90 -1.762 -3.888 12.343 1.00 0.50 H new ATOM 0 HD3 ARG B 90 -2.724 -2.598 11.650 1.00 0.50 H new ATOM 0 HE ARG B 90 -3.758 -3.165 14.318 1.00 0.43 H new ATOM 0 HH11 ARG B 90 -0.491 -2.945 13.765 1.00 1.20 H new ATOM 0 HH12 ARG B 90 -0.245 -1.391 14.569 1.00 1.20 H new ATOM 0 HH21 ARG B 90 -3.664 -0.709 14.841 1.00 0.74 H new ATOM 0 HH22 ARG B 90 -2.026 -0.136 15.173 1.00 0.74 H new ATOM 2563 N MET B 91 -5.000 -5.883 7.993 1.00 0.23 N ATOM 2564 CA MET B 91 -5.457 -5.786 6.575 1.00 0.23 C ATOM 2565 C MET B 91 -6.822 -6.442 6.469 1.00 0.24 C ATOM 2566 O MET B 91 -7.716 -5.951 5.806 1.00 0.27 O ATOM 2567 CB MET B 91 -4.413 -6.551 5.752 1.00 0.27 C ATOM 2568 CG MET B 91 -3.912 -5.663 4.611 1.00 0.43 C ATOM 2569 SD MET B 91 -2.710 -6.580 3.615 1.00 0.54 S ATOM 2570 CE MET B 91 -1.267 -6.285 4.666 1.00 0.99 C ATOM 0 H MET B 91 -4.102 -6.349 8.124 1.00 0.23 H new ATOM 0 HA MET B 91 -5.547 -4.759 6.221 1.00 0.23 H new ATOM 0 HB2 MET B 91 -3.580 -6.848 6.388 1.00 0.27 H new ATOM 0 HB3 MET B 91 -4.850 -7.465 5.351 1.00 0.27 H new ATOM 0 HG2 MET B 91 -4.749 -5.345 3.989 1.00 0.43 H new ATOM 0 HG3 MET B 91 -3.453 -4.760 5.013 1.00 0.43 H new ATOM 0 HE1 MET B 91 -0.604 -5.569 4.181 1.00 0.99 H new ATOM 0 HE2 MET B 91 -1.592 -5.886 5.627 1.00 0.99 H new ATOM 0 HE3 MET B 91 -0.734 -7.223 4.824 1.00 0.99 H new ATOM 2580 N LEU B 92 -6.991 -7.538 7.158 1.00 0.26 N ATOM 2581 CA LEU B 92 -8.304 -8.230 7.151 1.00 0.30 C ATOM 2582 C LEU B 92 -9.332 -7.313 7.783 1.00 0.30 C ATOM 2583 O LEU B 92 -10.418 -7.145 7.267 1.00 0.33 O ATOM 2584 CB LEU B 92 -8.086 -9.487 7.970 1.00 0.36 C ATOM 2585 CG LEU B 92 -7.076 -10.339 7.222 1.00 0.40 C ATOM 2586 CD1 LEU B 92 -6.292 -11.210 8.208 1.00 0.48 C ATOM 2587 CD2 LEU B 92 -7.805 -11.225 6.205 1.00 0.47 C ATOM 0 H LEU B 92 -6.271 -7.983 7.727 1.00 0.26 H new ATOM 0 HA LEU B 92 -8.667 -8.481 6.154 1.00 0.30 H new ATOM 0 HB2 LEU B 92 -7.718 -9.239 8.966 1.00 0.36 H new ATOM 0 HB3 LEU B 92 -9.023 -10.028 8.102 1.00 0.36 H new ATOM 0 HG LEU B 92 -6.377 -9.688 6.696 1.00 0.40 H new ATOM 0 HD11 LEU B 92 -5.570 -11.818 7.662 1.00 0.48 H new ATOM 0 HD12 LEU B 92 -5.766 -10.572 8.918 1.00 0.48 H new ATOM 0 HD13 LEU B 92 -6.981 -11.861 8.746 1.00 0.48 H new ATOM 0 HD21 LEU B 92 -7.079 -11.836 5.669 1.00 0.47 H new ATOM 0 HD22 LEU B 92 -8.510 -11.873 6.726 1.00 0.47 H new ATOM 0 HD23 LEU B 92 -8.345 -10.597 5.496 1.00 0.47 H new ATOM 2599 N ASN B 93 -8.973 -6.676 8.873 1.00 0.31 N ATOM 2600 CA ASN B 93 -9.914 -5.714 9.515 1.00 0.34 C ATOM 2601 C ASN B 93 -10.371 -4.715 8.450 1.00 0.32 C ATOM 2602 O ASN B 93 -11.450 -4.157 8.524 1.00 0.39 O ATOM 2603 CB ASN B 93 -9.101 -5.013 10.607 1.00 0.38 C ATOM 2604 CG ASN B 93 -9.919 -4.956 11.899 1.00 0.44 C ATOM 2605 OD1 ASN B 93 -10.866 -4.201 12.000 1.00 1.20 O ATOM 2606 ND2 ASN B 93 -9.591 -5.728 12.898 1.00 1.16 N ATOM 0 H ASN B 93 -8.073 -6.782 9.341 1.00 0.31 H new ATOM 0 HA ASN B 93 -10.798 -6.191 9.938 1.00 0.34 H new ATOM 0 HB2 ASN B 93 -8.167 -5.548 10.779 1.00 0.38 H new ATOM 0 HB3 ASN B 93 -8.837 -4.005 10.287 1.00 0.38 H new ATOM 0 HD21 ASN B 93 -10.129 -5.698 13.764 1.00 1.16 H new ATOM 0 HD22 ASN B 93 -8.796 -6.362 12.813 1.00 1.16 H new ATOM 2613 N ILE B 94 -9.551 -4.513 7.441 1.00 0.28 N ATOM 2614 CA ILE B 94 -9.929 -3.578 6.341 1.00 0.30 C ATOM 2615 C ILE B 94 -10.755 -4.317 5.282 1.00 0.28 C ATOM 2616 O ILE B 94 -11.678 -3.755 4.720 1.00 0.34 O ATOM 2617 CB ILE B 94 -8.621 -3.065 5.711 1.00 0.31 C ATOM 2618 CG1 ILE B 94 -7.509 -2.978 6.768 1.00 0.33 C ATOM 2619 CG2 ILE B 94 -8.871 -1.678 5.110 1.00 0.38 C ATOM 2620 CD1 ILE B 94 -6.341 -2.131 6.250 1.00 0.50 C ATOM 0 H ILE B 94 -8.639 -4.957 7.337 1.00 0.28 H new ATOM 0 HA ILE B 94 -10.529 -2.754 6.727 1.00 0.30 H new ATOM 0 HB ILE B 94 -8.302 -3.759 4.933 1.00 0.31 H new ATOM 0 HG12 ILE B 94 -7.904 -2.541 7.685 1.00 0.33 H new ATOM 0 HG13 ILE B 94 -7.157 -3.979 7.018 1.00 0.33 H new ATOM 0 HG21 ILE B 94 -7.951 -1.305 4.661 1.00 0.38 H new ATOM 0 HG22 ILE B 94 -9.646 -1.747 4.346 1.00 0.38 H new ATOM 0 HG23 ILE B 94 -9.195 -0.994 5.895 1.00 0.38 H new ATOM 0 HD11 ILE B 94 -5.563 -2.080 7.011 1.00 0.50 H new ATOM 0 HD12 ILE B 94 -5.935 -2.585 5.346 1.00 0.50 H new ATOM 0 HD13 ILE B 94 -6.694 -1.125 6.024 1.00 0.50 H new ATOM 2632 N LEU B 95 -10.434 -5.563 4.981 1.00 0.27 N ATOM 2633 CA LEU B 95 -11.225 -6.286 3.931 1.00 0.29 C ATOM 2634 C LEU B 95 -12.284 -7.206 4.558 1.00 0.34 C ATOM 2635 O LEU B 95 -12.788 -8.105 3.911 1.00 0.44 O ATOM 2636 CB LEU B 95 -10.206 -7.091 3.119 1.00 0.30 C ATOM 2637 CG LEU B 95 -9.474 -8.076 4.025 1.00 0.32 C ATOM 2638 CD1 LEU B 95 -9.920 -9.504 3.700 1.00 0.43 C ATOM 2639 CD2 LEU B 95 -7.966 -7.947 3.797 1.00 0.35 C ATOM 0 H LEU B 95 -9.676 -6.096 5.408 1.00 0.27 H new ATOM 0 HA LEU B 95 -11.774 -5.586 3.301 1.00 0.29 H new ATOM 0 HB2 LEU B 95 -10.712 -7.629 2.317 1.00 0.30 H new ATOM 0 HB3 LEU B 95 -9.490 -6.417 2.648 1.00 0.30 H new ATOM 0 HG LEU B 95 -9.707 -7.855 5.067 1.00 0.32 H new ATOM 0 HD11 LEU B 95 -9.395 -10.206 4.349 1.00 0.43 H new ATOM 0 HD12 LEU B 95 -10.994 -9.595 3.860 1.00 0.43 H new ATOM 0 HD13 LEU B 95 -9.688 -9.730 2.659 1.00 0.43 H new ATOM 0 HD21 LEU B 95 -7.439 -8.649 4.443 1.00 0.35 H new ATOM 0 HD22 LEU B 95 -7.735 -8.169 2.755 1.00 0.35 H new ATOM 0 HD23 LEU B 95 -7.648 -6.931 4.031 1.00 0.35 H new ATOM 2651 N ASN B 96 -12.635 -6.979 5.802 1.00 0.38 N ATOM 2652 CA ASN B 96 -13.677 -7.830 6.464 1.00 0.46 C ATOM 2653 C ASN B 96 -14.863 -6.969 6.913 1.00 0.50 C ATOM 2654 O ASN B 96 -15.945 -7.470 7.159 1.00 0.56 O ATOM 2655 CB ASN B 96 -12.992 -8.453 7.681 1.00 0.51 C ATOM 2656 CG ASN B 96 -12.252 -9.724 7.259 1.00 0.55 C ATOM 2657 OD1 ASN B 96 -12.684 -10.820 7.559 1.00 0.66 O ATOM 2658 ND2 ASN B 96 -11.148 -9.626 6.572 1.00 0.59 N ATOM 0 H ASN B 96 -12.245 -6.241 6.388 1.00 0.38 H new ATOM 0 HA ASN B 96 -14.065 -8.588 5.784 1.00 0.46 H new ATOM 0 HB2 ASN B 96 -12.293 -7.742 8.121 1.00 0.51 H new ATOM 0 HB3 ASN B 96 -13.731 -8.688 8.447 1.00 0.51 H new ATOM 0 HD21 ASN B 96 -10.648 -10.468 6.287 1.00 0.59 H new ATOM 0 HD22 ASN B 96 -10.784 -8.707 6.320 1.00 0.59 H new