USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 915 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 123 THR OG1 : rot 137:sc= 1.29 USER MOD Set 1.2: A 133 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 48 THR OG1 : rot 156:sc= -0.211 USER MOD Set 2.2: A 87 MET CE :methyl -172:sc= -0.2 (180deg=-0.45) USER MOD Set 3.1: A 52 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 53 HIS : no HD1:sc= -0.225 X(o=-0.22,f=-0.14) USER MOD Single : A 25 SER OG : rot 59:sc= -3.71! USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -172:sc= -0.0194 (180deg=-0.138) USER MOD Single : A 38 SER OG : rot 180:sc= -0.718 USER MOD Single : A 41 TYR OH : rot 152:sc= 1.7 USER MOD Single : A 44 LYS NZ :NH3+ -157:sc= 1.22 (180deg=1.14) USER MOD Single : A 46 SER OG : rot 24:sc= 0.0713 USER MOD Single : A 49 ASN : amide:sc= -4.65! C(o=-4.6!,f=-6.4!) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= -0.626 USER MOD Single : A 58 CYS SG : rot -17:sc= -0.321 USER MOD Single : A 61 SER OG : rot -72:sc= 1.15 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 HIS :FLIP no HD1:sc= -0.73 F(o=-2.3!,f=-0.73) USER MOD Single : A 66 SER OG : rot 109:sc= 1.04 USER MOD Single : A 73 LYS NZ :NH3+ -162:sc= 1.27 (180deg=1.05) USER MOD Single : A 75 LYS NZ :NH3+ -175:sc=-0.00586 (180deg=-0.0543) USER MOD Single : A 81 SER OG : rot 24:sc= 0.328 USER MOD Single : A 83 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00741) USER MOD Single : A 85 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0158) USER MOD Single : A 88 THR OG1 : rot -170:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 0.998 K(o=1,f=-3.2!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 GLN :FLIP amide:sc= -1.94 F(o=-7.2!,f=-1.9) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 169:sc= 0.25 (180deg=0.173) USER MOD Single : A 143 LYS NZ :NH3+ -172:sc= -0.0229 (180deg=-0.178) USER MOD ----------------------------------------------------------------- ATOM 364 N GLY A 24 8.643 -0.417 -4.040 1.00 0.54 N ATOM 365 CA GLY A 24 7.214 -0.437 -4.128 1.00 0.46 C ATOM 366 C GLY A 24 6.566 -1.549 -3.348 1.00 0.33 C ATOM 367 O GLY A 24 7.239 -2.343 -2.697 1.00 0.39 O ATOM 0 HA2 GLY A 24 6.825 0.517 -3.771 1.00 0.46 H new ATOM 0 HA3 GLY A 24 6.926 -0.527 -5.176 1.00 0.46 H new ATOM 371 N SER A 25 5.246 -1.563 -3.413 1.00 0.28 N ATOM 372 CA SER A 25 4.397 -2.584 -2.821 1.00 0.30 C ATOM 373 C SER A 25 2.982 -2.360 -3.313 1.00 0.32 C ATOM 374 O SER A 25 2.001 -2.556 -2.603 1.00 0.39 O ATOM 375 CB SER A 25 4.428 -2.541 -1.301 1.00 0.37 C ATOM 376 OG SER A 25 5.606 -3.141 -0.800 1.00 1.20 O ATOM 0 H SER A 25 4.716 -0.838 -3.897 1.00 0.28 H new ATOM 0 HA SER A 25 4.765 -3.565 -3.120 1.00 0.30 H new ATOM 0 HB2 SER A 25 4.370 -1.507 -0.962 1.00 0.37 H new ATOM 0 HB3 SER A 25 3.555 -3.057 -0.901 1.00 0.37 H new ATOM 0 HG SER A 25 6.389 -2.673 -1.157 1.00 1.20 H new ATOM 382 N VAL A 26 2.906 -1.952 -4.556 1.00 0.28 N ATOM 383 CA VAL A 26 1.653 -1.584 -5.179 1.00 0.30 C ATOM 384 C VAL A 26 1.561 -2.242 -6.543 1.00 0.30 C ATOM 385 O VAL A 26 2.583 -2.597 -7.122 1.00 0.30 O ATOM 386 CB VAL A 26 1.547 -0.049 -5.340 1.00 0.33 C ATOM 387 CG1 VAL A 26 1.516 0.640 -3.987 1.00 0.93 C ATOM 388 CG2 VAL A 26 2.706 0.462 -6.179 1.00 0.88 C ATOM 0 H VAL A 26 3.716 -1.864 -5.170 1.00 0.28 H new ATOM 0 HA VAL A 26 0.835 -1.922 -4.543 1.00 0.30 H new ATOM 0 HB VAL A 26 0.612 0.184 -5.850 1.00 0.33 H new ATOM 0 HG11 VAL A 26 1.441 1.718 -4.129 1.00 0.93 H new ATOM 0 HG12 VAL A 26 0.655 0.288 -3.419 1.00 0.93 H new ATOM 0 HG13 VAL A 26 2.430 0.409 -3.440 1.00 0.93 H new ATOM 0 HG21 VAL A 26 2.626 1.543 -6.289 1.00 0.88 H new ATOM 0 HG22 VAL A 26 3.647 0.216 -5.688 1.00 0.88 H new ATOM 0 HG23 VAL A 26 2.677 -0.006 -7.163 1.00 0.88 H new ATOM 398 N THR A 27 0.347 -2.457 -7.010 1.00 0.33 N ATOM 399 CA THR A 27 0.103 -2.856 -8.387 1.00 0.36 C ATOM 400 C THR A 27 -1.392 -2.763 -8.719 1.00 0.38 C ATOM 401 O THR A 27 -1.756 -2.294 -9.799 1.00 0.48 O ATOM 402 CB THR A 27 0.666 -4.266 -8.705 1.00 0.39 C ATOM 403 OG1 THR A 27 0.198 -4.724 -9.977 1.00 0.47 O ATOM 404 CG2 THR A 27 0.297 -5.269 -7.630 1.00 0.39 C ATOM 0 H THR A 27 -0.499 -2.361 -6.448 1.00 0.33 H new ATOM 0 HA THR A 27 0.643 -2.158 -9.026 1.00 0.36 H new ATOM 0 HB THR A 27 1.752 -4.181 -8.734 1.00 0.39 H new ATOM 0 HG1 THR A 27 0.565 -5.614 -10.160 1.00 0.47 H new ATOM 0 HG21 THR A 27 0.708 -6.245 -7.887 1.00 0.39 H new ATOM 0 HG22 THR A 27 0.705 -4.943 -6.673 1.00 0.39 H new ATOM 0 HG23 THR A 27 -0.788 -5.341 -7.556 1.00 0.39 H new ATOM 412 N ASP A 28 -2.259 -3.186 -7.790 1.00 0.35 N ATOM 413 CA ASP A 28 -3.710 -3.037 -7.968 1.00 0.42 C ATOM 414 C ASP A 28 -4.443 -3.445 -6.700 1.00 0.35 C ATOM 415 O ASP A 28 -3.890 -4.159 -5.865 1.00 0.37 O ATOM 416 CB ASP A 28 -4.206 -3.903 -9.123 1.00 0.57 C ATOM 417 CG ASP A 28 -5.598 -3.532 -9.589 1.00 1.08 C ATOM 418 OD1 ASP A 28 -5.826 -2.354 -9.924 1.00 1.69 O ATOM 419 OD2 ASP A 28 -6.465 -4.428 -9.641 1.00 1.44 O ATOM 0 H ASP A 28 -1.984 -3.631 -6.914 1.00 0.35 H new ATOM 0 HA ASP A 28 -3.912 -1.989 -8.190 1.00 0.42 H new ATOM 0 HB2 ASP A 28 -3.513 -3.813 -9.960 1.00 0.57 H new ATOM 0 HB3 ASP A 28 -4.199 -4.948 -8.814 1.00 0.57 H new ATOM 424 N VAL A 29 -5.680 -2.998 -6.555 1.00 0.39 N ATOM 425 CA VAL A 29 -6.491 -3.357 -5.401 1.00 0.41 C ATOM 426 C VAL A 29 -7.924 -3.678 -5.842 1.00 0.37 C ATOM 427 O VAL A 29 -8.504 -2.961 -6.657 1.00 0.42 O ATOM 428 CB VAL A 29 -6.497 -2.233 -4.340 1.00 0.60 C ATOM 429 CG1 VAL A 29 -7.306 -2.653 -3.135 1.00 1.13 C ATOM 430 CG2 VAL A 29 -5.080 -1.864 -3.914 1.00 1.14 C ATOM 0 H VAL A 29 -6.146 -2.384 -7.223 1.00 0.39 H new ATOM 0 HA VAL A 29 -6.049 -4.243 -4.944 1.00 0.41 H new ATOM 0 HB VAL A 29 -6.956 -1.353 -4.790 1.00 0.60 H new ATOM 0 HG11 VAL A 29 -7.301 -1.852 -2.396 1.00 1.13 H new ATOM 0 HG12 VAL A 29 -8.332 -2.860 -3.440 1.00 1.13 H new ATOM 0 HG13 VAL A 29 -6.869 -3.551 -2.699 1.00 1.13 H new ATOM 0 HG21 VAL A 29 -5.119 -1.071 -3.167 1.00 1.14 H new ATOM 0 HG22 VAL A 29 -4.589 -2.739 -3.488 1.00 1.14 H new ATOM 0 HG23 VAL A 29 -4.518 -1.518 -4.781 1.00 1.14 H new ATOM 440 N ASP A 30 -8.479 -4.757 -5.303 1.00 0.37 N ATOM 441 CA ASP A 30 -9.781 -5.267 -5.729 1.00 0.38 C ATOM 442 C ASP A 30 -10.845 -5.016 -4.673 1.00 0.42 C ATOM 443 O ASP A 30 -10.725 -5.475 -3.534 1.00 0.54 O ATOM 444 CB ASP A 30 -9.709 -6.774 -5.999 1.00 0.51 C ATOM 445 CG ASP A 30 -8.831 -7.137 -7.177 1.00 1.00 C ATOM 446 OD1 ASP A 30 -9.307 -7.051 -8.327 1.00 1.16 O ATOM 447 OD2 ASP A 30 -7.667 -7.543 -6.960 1.00 1.83 O ATOM 0 H ASP A 30 -8.042 -5.303 -4.560 1.00 0.37 H new ATOM 0 HA ASP A 30 -10.049 -4.737 -6.643 1.00 0.38 H new ATOM 0 HB2 ASP A 30 -9.333 -7.277 -5.108 1.00 0.51 H new ATOM 0 HB3 ASP A 30 -10.716 -7.151 -6.177 1.00 0.51 H new ATOM 452 N LEU A 31 -11.899 -4.318 -5.064 1.00 0.47 N ATOM 453 CA LEU A 31 -12.984 -3.994 -4.150 1.00 0.57 C ATOM 454 C LEU A 31 -14.024 -5.106 -4.148 1.00 0.58 C ATOM 455 O LEU A 31 -14.624 -5.408 -5.180 1.00 0.67 O ATOM 456 CB LEU A 31 -13.628 -2.649 -4.553 1.00 0.71 C ATOM 457 CG LEU A 31 -14.676 -2.058 -3.587 1.00 0.85 C ATOM 458 CD1 LEU A 31 -16.039 -2.705 -3.786 1.00 0.94 C ATOM 459 CD2 LEU A 31 -14.226 -2.207 -2.140 1.00 0.86 C ATOM 0 H LEU A 31 -12.027 -3.963 -6.012 1.00 0.47 H new ATOM 0 HA LEU A 31 -12.581 -3.900 -3.141 1.00 0.57 H new ATOM 0 HB2 LEU A 31 -12.831 -1.916 -4.679 1.00 0.71 H new ATOM 0 HB3 LEU A 31 -14.099 -2.777 -5.527 1.00 0.71 H new ATOM 0 HG LEU A 31 -14.769 -0.996 -3.814 1.00 0.85 H new ATOM 0 HD11 LEU A 31 -16.755 -2.267 -3.091 1.00 0.94 H new ATOM 0 HD12 LEU A 31 -16.376 -2.536 -4.809 1.00 0.94 H new ATOM 0 HD13 LEU A 31 -15.963 -3.777 -3.602 1.00 0.94 H new ATOM 0 HD21 LEU A 31 -14.981 -1.783 -1.479 1.00 0.86 H new ATOM 0 HD22 LEU A 31 -14.092 -3.263 -1.908 1.00 0.86 H new ATOM 0 HD23 LEU A 31 -13.282 -1.681 -1.997 1.00 0.86 H new ATOM 471 N LYS A 32 -14.219 -5.734 -2.996 1.00 0.56 N ATOM 472 CA LYS A 32 -15.334 -6.644 -2.827 1.00 0.60 C ATOM 473 C LYS A 32 -16.156 -6.227 -1.610 1.00 0.82 C ATOM 474 O LYS A 32 -16.596 -5.083 -1.537 1.00 1.33 O ATOM 475 CB LYS A 32 -14.883 -8.117 -2.745 1.00 0.62 C ATOM 476 CG LYS A 32 -13.815 -8.420 -1.701 1.00 0.65 C ATOM 477 CD LYS A 32 -12.413 -8.123 -2.213 1.00 0.90 C ATOM 478 CE LYS A 32 -12.078 -8.934 -3.459 1.00 1.10 C ATOM 479 NZ LYS A 32 -12.210 -10.400 -3.233 1.00 1.32 N ATOM 0 H LYS A 32 -13.624 -5.629 -2.174 1.00 0.56 H new ATOM 0 HA LYS A 32 -15.966 -6.579 -3.713 1.00 0.60 H new ATOM 0 HB2 LYS A 32 -15.756 -8.735 -2.536 1.00 0.62 H new ATOM 0 HB3 LYS A 32 -14.506 -8.418 -3.722 1.00 0.62 H new ATOM 0 HG2 LYS A 32 -14.006 -7.829 -0.805 1.00 0.65 H new ATOM 0 HG3 LYS A 32 -13.880 -9.469 -1.411 1.00 0.65 H new ATOM 0 HD2 LYS A 32 -12.327 -7.060 -2.438 1.00 0.90 H new ATOM 0 HD3 LYS A 32 -11.687 -8.343 -1.431 1.00 0.90 H new ATOM 0 HE2 LYS A 32 -12.737 -8.634 -4.273 1.00 1.10 H new ATOM 0 HE3 LYS A 32 -11.059 -8.708 -3.774 1.00 1.10 H new ATOM 0 HZ1 LYS A 32 -11.844 -10.913 -4.060 1.00 1.32 H new ATOM 0 HZ2 LYS A 32 -11.667 -10.671 -2.389 1.00 1.32 H new ATOM 0 HZ3 LYS A 32 -13.212 -10.641 -3.092 1.00 1.32 H new ATOM 493 N ASP A 33 -16.322 -7.129 -0.651 1.00 0.60 N ATOM 494 CA ASP A 33 -17.200 -6.902 0.496 1.00 0.94 C ATOM 495 C ASP A 33 -17.332 -8.163 1.311 1.00 0.53 C ATOM 496 O ASP A 33 -16.784 -9.201 0.943 1.00 1.46 O ATOM 497 CB ASP A 33 -18.591 -6.431 0.067 1.00 2.08 C ATOM 498 CG ASP A 33 -19.313 -7.399 -0.858 1.00 2.37 C ATOM 499 OD1 ASP A 33 -19.997 -8.315 -0.354 1.00 2.32 O ATOM 500 OD2 ASP A 33 -19.208 -7.238 -2.095 1.00 2.85 O ATOM 0 H ASP A 33 -15.855 -8.036 -0.644 1.00 0.60 H new ATOM 0 HA ASP A 33 -16.745 -6.116 1.098 1.00 0.94 H new ATOM 0 HB2 ASP A 33 -19.200 -6.272 0.957 1.00 2.08 H new ATOM 0 HB3 ASP A 33 -18.499 -5.467 -0.433 1.00 2.08 H new ATOM 571 N SER A 38 -18.368 -6.068 7.615 1.00 0.54 N ATOM 572 CA SER A 38 -17.211 -5.366 7.134 1.00 0.48 C ATOM 573 C SER A 38 -17.267 -5.432 5.623 1.00 0.50 C ATOM 574 O SER A 38 -18.216 -5.979 5.062 1.00 0.94 O ATOM 575 CB SER A 38 -15.929 -6.016 7.674 1.00 0.55 C ATOM 576 OG SER A 38 -14.785 -5.213 7.415 1.00 0.76 O ATOM 0 HA SER A 38 -17.203 -4.330 7.472 1.00 0.48 H new ATOM 0 HB2 SER A 38 -16.026 -6.176 8.748 1.00 0.55 H new ATOM 0 HB3 SER A 38 -15.797 -6.996 7.216 1.00 0.55 H new ATOM 0 HG SER A 38 -13.987 -5.655 7.773 1.00 0.76 H new ATOM 582 N VAL A 39 -16.316 -4.833 4.965 1.00 0.33 N ATOM 583 CA VAL A 39 -16.131 -5.064 3.553 1.00 0.35 C ATOM 584 C VAL A 39 -14.670 -5.421 3.322 1.00 0.31 C ATOM 585 O VAL A 39 -13.840 -5.226 4.210 1.00 0.34 O ATOM 586 CB VAL A 39 -16.633 -3.852 2.724 1.00 0.43 C ATOM 587 CG1 VAL A 39 -16.063 -3.820 1.314 1.00 0.86 C ATOM 588 CG2 VAL A 39 -18.155 -3.910 2.660 1.00 0.86 C ATOM 0 H VAL A 39 -15.653 -4.179 5.381 1.00 0.33 H new ATOM 0 HA VAL A 39 -16.734 -5.903 3.206 1.00 0.35 H new ATOM 0 HB VAL A 39 -16.291 -2.943 3.219 1.00 0.43 H new ATOM 0 HG11 VAL A 39 -16.451 -2.950 0.784 1.00 0.86 H new ATOM 0 HG12 VAL A 39 -14.976 -3.760 1.362 1.00 0.86 H new ATOM 0 HG13 VAL A 39 -16.353 -4.727 0.784 1.00 0.86 H new ATOM 0 HG21 VAL A 39 -18.527 -3.065 2.081 1.00 0.86 H new ATOM 0 HG22 VAL A 39 -18.464 -4.841 2.184 1.00 0.86 H new ATOM 0 HG23 VAL A 39 -18.564 -3.866 3.670 1.00 0.86 H new ATOM 598 N GLU A 40 -14.349 -6.002 2.190 1.00 0.33 N ATOM 599 CA GLU A 40 -13.029 -6.550 2.017 1.00 0.36 C ATOM 600 C GLU A 40 -12.326 -5.971 0.814 1.00 0.38 C ATOM 601 O GLU A 40 -12.946 -5.677 -0.212 1.00 0.50 O ATOM 602 CB GLU A 40 -13.105 -8.066 1.931 1.00 0.52 C ATOM 603 CG GLU A 40 -13.286 -8.707 3.295 1.00 0.62 C ATOM 604 CD GLU A 40 -13.188 -10.217 3.265 1.00 0.89 C ATOM 605 OE1 GLU A 40 -13.611 -10.833 2.267 1.00 1.16 O ATOM 606 OE2 GLU A 40 -12.683 -10.797 4.248 1.00 1.19 O ATOM 0 H GLU A 40 -14.973 -6.106 1.389 1.00 0.33 H new ATOM 0 HA GLU A 40 -12.434 -6.274 2.888 1.00 0.36 H new ATOM 0 HB2 GLU A 40 -13.935 -8.351 1.284 1.00 0.52 H new ATOM 0 HB3 GLU A 40 -12.195 -8.449 1.469 1.00 0.52 H new ATOM 0 HG2 GLU A 40 -12.531 -8.314 3.976 1.00 0.62 H new ATOM 0 HG3 GLU A 40 -14.258 -8.421 3.697 1.00 0.62 H new ATOM 613 N TYR A 41 -11.025 -5.804 0.955 1.00 0.37 N ATOM 614 CA TYR A 41 -10.212 -5.255 -0.124 1.00 0.56 C ATOM 615 C TYR A 41 -9.049 -6.176 -0.440 1.00 0.43 C ATOM 616 O TYR A 41 -8.064 -6.205 0.298 1.00 0.40 O ATOM 617 CB TYR A 41 -9.651 -3.886 0.264 1.00 0.89 C ATOM 618 CG TYR A 41 -10.108 -2.746 -0.613 1.00 0.86 C ATOM 619 CD1 TYR A 41 -10.352 -2.939 -1.963 1.00 1.65 C ATOM 620 CD2 TYR A 41 -10.274 -1.469 -0.095 1.00 1.30 C ATOM 621 CE1 TYR A 41 -10.744 -1.898 -2.775 1.00 2.63 C ATOM 622 CE2 TYR A 41 -10.673 -0.418 -0.903 1.00 2.04 C ATOM 623 CZ TYR A 41 -10.905 -0.643 -2.243 1.00 2.72 C ATOM 624 OH TYR A 41 -11.294 0.391 -3.061 1.00 3.73 O ATOM 0 H TYR A 41 -10.506 -6.038 1.801 1.00 0.37 H new ATOM 0 HA TYR A 41 -10.854 -5.156 -0.999 1.00 0.56 H new ATOM 0 HB2 TYR A 41 -9.935 -3.671 1.294 1.00 0.89 H new ATOM 0 HB3 TYR A 41 -8.562 -3.934 0.237 1.00 0.89 H new ATOM 0 HD1 TYR A 41 -10.232 -3.925 -2.387 1.00 1.65 H new ATOM 0 HD2 TYR A 41 -10.089 -1.293 0.954 1.00 1.30 H new ATOM 0 HE1 TYR A 41 -10.924 -2.068 -3.826 1.00 2.63 H new ATOM 0 HE2 TYR A 41 -10.801 0.570 -0.487 1.00 2.04 H new ATOM 0 HH TYR A 41 -11.779 1.060 -2.534 1.00 3.73 H new ATOM 634 N LEU A 42 -9.148 -6.913 -1.534 1.00 0.41 N ATOM 635 CA LEU A 42 -8.044 -7.766 -1.949 1.00 0.38 C ATOM 636 C LEU A 42 -7.031 -6.904 -2.675 1.00 0.34 C ATOM 637 O LEU A 42 -7.273 -6.454 -3.784 1.00 0.38 O ATOM 638 CB LEU A 42 -8.533 -8.899 -2.869 1.00 0.49 C ATOM 639 CG LEU A 42 -7.679 -10.185 -2.892 1.00 0.55 C ATOM 640 CD1 LEU A 42 -6.213 -9.888 -3.169 1.00 0.71 C ATOM 641 CD2 LEU A 42 -7.819 -10.948 -1.586 1.00 0.81 C ATOM 0 H LEU A 42 -9.966 -6.940 -2.143 1.00 0.41 H new ATOM 0 HA LEU A 42 -7.592 -8.230 -1.072 1.00 0.38 H new ATOM 0 HB2 LEU A 42 -9.546 -9.168 -2.570 1.00 0.49 H new ATOM 0 HB3 LEU A 42 -8.593 -8.511 -3.886 1.00 0.49 H new ATOM 0 HG LEU A 42 -8.054 -10.804 -3.707 1.00 0.55 H new ATOM 0 HD11 LEU A 42 -5.648 -10.820 -3.176 1.00 0.71 H new ATOM 0 HD12 LEU A 42 -6.118 -9.398 -4.138 1.00 0.71 H new ATOM 0 HD13 LEU A 42 -5.821 -9.233 -2.391 1.00 0.71 H new ATOM 0 HD21 LEU A 42 -7.209 -11.850 -1.625 1.00 0.81 H new ATOM 0 HD22 LEU A 42 -7.486 -10.320 -0.760 1.00 0.81 H new ATOM 0 HD23 LEU A 42 -8.863 -11.222 -1.435 1.00 0.81 H new ATOM 653 N ALA A 43 -5.900 -6.675 -2.057 1.00 0.33 N ATOM 654 CA ALA A 43 -4.902 -5.811 -2.643 1.00 0.36 C ATOM 655 C ALA A 43 -3.694 -6.609 -3.065 1.00 0.35 C ATOM 656 O ALA A 43 -2.996 -7.187 -2.233 1.00 0.37 O ATOM 657 CB ALA A 43 -4.509 -4.717 -1.665 1.00 0.42 C ATOM 0 H ALA A 43 -5.646 -7.072 -1.152 1.00 0.33 H new ATOM 0 HA ALA A 43 -5.327 -5.342 -3.530 1.00 0.36 H new ATOM 0 HB1 ALA A 43 -3.756 -4.074 -2.121 1.00 0.42 H new ATOM 0 HB2 ALA A 43 -5.387 -4.123 -1.411 1.00 0.42 H new ATOM 0 HB3 ALA A 43 -4.101 -5.167 -0.760 1.00 0.42 H new ATOM 663 N LYS A 44 -3.452 -6.655 -4.361 1.00 0.38 N ATOM 664 CA LYS A 44 -2.251 -7.281 -4.852 1.00 0.39 C ATOM 665 C LYS A 44 -1.122 -6.268 -4.780 1.00 0.36 C ATOM 666 O LYS A 44 -1.286 -5.093 -5.117 1.00 0.47 O ATOM 667 CB LYS A 44 -2.425 -7.836 -6.276 1.00 0.53 C ATOM 668 CG LYS A 44 -2.822 -6.795 -7.304 1.00 0.95 C ATOM 669 CD LYS A 44 -4.301 -6.868 -7.654 1.00 1.58 C ATOM 670 CE LYS A 44 -4.621 -8.092 -8.494 1.00 1.61 C ATOM 671 NZ LYS A 44 -6.027 -8.075 -8.984 1.00 2.63 N ATOM 0 H LYS A 44 -4.065 -6.271 -5.080 1.00 0.38 H new ATOM 0 HA LYS A 44 -2.015 -8.142 -4.227 1.00 0.39 H new ATOM 0 HB2 LYS A 44 -1.491 -8.302 -6.589 1.00 0.53 H new ATOM 0 HB3 LYS A 44 -3.182 -8.620 -6.258 1.00 0.53 H new ATOM 0 HG2 LYS A 44 -2.590 -5.801 -6.921 1.00 0.95 H new ATOM 0 HG3 LYS A 44 -2.229 -6.935 -8.208 1.00 0.95 H new ATOM 0 HD2 LYS A 44 -4.891 -6.891 -6.738 1.00 1.58 H new ATOM 0 HD3 LYS A 44 -4.591 -5.968 -8.197 1.00 1.58 H new ATOM 0 HE2 LYS A 44 -3.940 -8.137 -9.344 1.00 1.61 H new ATOM 0 HE3 LYS A 44 -4.453 -8.992 -7.903 1.00 1.61 H new ATOM 0 HZ1 LYS A 44 -6.330 -9.046 -9.202 1.00 2.63 H new ATOM 0 HZ2 LYS A 44 -6.646 -7.675 -8.250 1.00 2.63 H new ATOM 0 HZ3 LYS A 44 -6.088 -7.492 -9.843 1.00 2.63 H new ATOM 685 N VAL A 45 0.000 -6.724 -4.290 1.00 0.31 N ATOM 686 CA VAL A 45 1.139 -5.874 -4.023 1.00 0.33 C ATOM 687 C VAL A 45 2.280 -6.224 -4.955 1.00 0.28 C ATOM 688 O VAL A 45 2.405 -7.362 -5.394 1.00 0.30 O ATOM 689 CB VAL A 45 1.583 -6.071 -2.559 1.00 0.44 C ATOM 690 CG1 VAL A 45 2.948 -5.473 -2.288 1.00 0.82 C ATOM 691 CG2 VAL A 45 0.552 -5.483 -1.615 1.00 0.51 C ATOM 0 H VAL A 45 0.155 -7.706 -4.061 1.00 0.31 H new ATOM 0 HA VAL A 45 0.860 -4.833 -4.187 1.00 0.33 H new ATOM 0 HB VAL A 45 1.661 -7.144 -2.385 1.00 0.44 H new ATOM 0 HG11 VAL A 45 3.216 -5.637 -1.244 1.00 0.82 H new ATOM 0 HG12 VAL A 45 3.688 -5.948 -2.932 1.00 0.82 H new ATOM 0 HG13 VAL A 45 2.923 -4.403 -2.492 1.00 0.82 H new ATOM 0 HG21 VAL A 45 0.877 -5.629 -0.585 1.00 0.51 H new ATOM 0 HG22 VAL A 45 0.443 -4.417 -1.814 1.00 0.51 H new ATOM 0 HG23 VAL A 45 -0.406 -5.980 -1.767 1.00 0.51 H new ATOM 701 N SER A 46 3.078 -5.243 -5.304 1.00 0.25 N ATOM 702 CA SER A 46 4.299 -5.512 -6.011 1.00 0.25 C ATOM 703 C SER A 46 5.463 -4.736 -5.394 1.00 0.24 C ATOM 704 O SER A 46 5.613 -3.533 -5.604 1.00 0.26 O ATOM 705 CB SER A 46 4.102 -5.207 -7.489 1.00 0.28 C ATOM 706 OG SER A 46 3.510 -6.310 -8.151 1.00 0.72 O ATOM 0 H SER A 46 2.902 -4.257 -5.109 1.00 0.25 H new ATOM 0 HA SER A 46 4.556 -6.567 -5.922 1.00 0.25 H new ATOM 0 HB2 SER A 46 3.471 -4.326 -7.603 1.00 0.28 H new ATOM 0 HB3 SER A 46 5.062 -4.973 -7.949 1.00 0.28 H new ATOM 0 HG SER A 46 3.023 -6.859 -7.501 1.00 0.72 H new ATOM 712 N VAL A 47 6.259 -5.454 -4.602 1.00 0.25 N ATOM 713 CA VAL A 47 7.383 -4.881 -3.870 1.00 0.28 C ATOM 714 C VAL A 47 8.614 -4.790 -4.759 1.00 0.28 C ATOM 715 O VAL A 47 9.051 -5.783 -5.329 1.00 0.30 O ATOM 716 CB VAL A 47 7.751 -5.720 -2.617 1.00 0.41 C ATOM 717 CG1 VAL A 47 8.924 -5.094 -1.868 1.00 1.14 C ATOM 718 CG2 VAL A 47 6.553 -5.881 -1.690 1.00 1.05 C ATOM 0 H VAL A 47 6.139 -6.456 -4.451 1.00 0.25 H new ATOM 0 HA VAL A 47 7.069 -3.887 -3.552 1.00 0.28 H new ATOM 0 HB VAL A 47 8.050 -6.711 -2.959 1.00 0.41 H new ATOM 0 HG11 VAL A 47 9.163 -5.700 -0.994 1.00 1.14 H new ATOM 0 HG12 VAL A 47 9.792 -5.047 -2.525 1.00 1.14 H new ATOM 0 HG13 VAL A 47 8.656 -4.087 -1.549 1.00 1.14 H new ATOM 0 HG21 VAL A 47 6.842 -6.473 -0.822 1.00 1.05 H new ATOM 0 HG22 VAL A 47 6.212 -4.899 -1.362 1.00 1.05 H new ATOM 0 HG23 VAL A 47 5.747 -6.386 -2.222 1.00 1.05 H new ATOM 728 N THR A 48 9.166 -3.597 -4.871 1.00 0.30 N ATOM 729 CA THR A 48 10.361 -3.380 -5.670 1.00 0.31 C ATOM 730 C THR A 48 11.556 -3.117 -4.767 1.00 0.34 C ATOM 731 O THR A 48 11.534 -2.155 -4.012 1.00 0.37 O ATOM 732 CB THR A 48 10.173 -2.170 -6.603 1.00 0.36 C ATOM 733 OG1 THR A 48 8.883 -2.240 -7.222 1.00 0.41 O ATOM 734 CG2 THR A 48 11.257 -2.133 -7.674 1.00 0.41 C ATOM 0 H THR A 48 8.805 -2.758 -4.417 1.00 0.30 H new ATOM 0 HA THR A 48 10.536 -4.276 -6.265 1.00 0.31 H new ATOM 0 HB THR A 48 10.249 -1.259 -6.009 1.00 0.36 H new ATOM 0 HG1 THR A 48 8.600 -1.341 -7.491 1.00 0.41 H new ATOM 0 HG21 THR A 48 11.101 -1.269 -8.320 1.00 0.41 H new ATOM 0 HG22 THR A 48 12.235 -2.059 -7.199 1.00 0.41 H new ATOM 0 HG23 THR A 48 11.211 -3.044 -8.270 1.00 0.41 H new ATOM 742 N ASN A 49 12.577 -3.977 -4.821 1.00 0.38 N ATOM 743 CA ASN A 49 13.788 -3.750 -4.021 1.00 0.44 C ATOM 744 C ASN A 49 14.860 -3.063 -4.861 1.00 0.42 C ATOM 745 O ASN A 49 14.972 -3.327 -6.067 1.00 0.46 O ATOM 746 CB ASN A 49 14.348 -5.053 -3.434 1.00 0.59 C ATOM 747 CG ASN A 49 15.299 -5.784 -4.365 1.00 0.73 C ATOM 748 OD1 ASN A 49 16.515 -5.578 -4.339 1.00 1.48 O ATOM 749 ND2 ASN A 49 14.751 -6.639 -5.197 1.00 0.76 N ATOM 0 H ASN A 49 12.593 -4.819 -5.396 1.00 0.38 H new ATOM 0 HA ASN A 49 13.504 -3.105 -3.189 1.00 0.44 H new ATOM 0 HB2 ASN A 49 14.867 -4.828 -2.503 1.00 0.59 H new ATOM 0 HB3 ASN A 49 13.518 -5.714 -3.184 1.00 0.59 H new ATOM 0 HD21 ASN A 49 15.335 -7.160 -5.851 1.00 0.76 H new ATOM 0 HD22 ASN A 49 13.741 -6.783 -5.189 1.00 0.76 H new ATOM 756 N PRO A 50 15.667 -2.196 -4.220 1.00 0.46 N ATOM 757 CA PRO A 50 16.670 -1.364 -4.890 1.00 0.51 C ATOM 758 C PRO A 50 18.052 -2.001 -5.011 1.00 0.53 C ATOM 759 O PRO A 50 18.983 -1.353 -5.502 1.00 0.65 O ATOM 760 CB PRO A 50 16.750 -0.156 -3.954 1.00 0.64 C ATOM 761 CG PRO A 50 16.546 -0.733 -2.595 1.00 0.73 C ATOM 762 CD PRO A 50 15.636 -1.924 -2.767 1.00 0.55 C ATOM 0 HA PRO A 50 16.385 -1.160 -5.922 1.00 0.51 H new ATOM 0 HB2 PRO A 50 17.714 0.346 -4.033 1.00 0.64 H new ATOM 0 HB3 PRO A 50 15.985 0.583 -4.192 1.00 0.64 H new ATOM 0 HG2 PRO A 50 17.497 -1.032 -2.154 1.00 0.73 H new ATOM 0 HG3 PRO A 50 16.101 0.002 -1.924 1.00 0.73 H new ATOM 0 HD2 PRO A 50 15.989 -2.781 -2.194 1.00 0.55 H new ATOM 0 HD3 PRO A 50 14.625 -1.706 -2.424 1.00 0.55 H new ATOM 770 N TYR A 51 18.210 -3.255 -4.598 1.00 0.53 N ATOM 771 CA TYR A 51 19.553 -3.818 -4.507 1.00 0.68 C ATOM 772 C TYR A 51 19.884 -4.585 -5.769 1.00 0.88 C ATOM 773 O TYR A 51 20.043 -4.010 -6.842 1.00 1.88 O ATOM 774 CB TYR A 51 19.701 -4.744 -3.291 1.00 0.74 C ATOM 775 CG TYR A 51 21.108 -4.766 -2.720 1.00 0.88 C ATOM 776 CD1 TYR A 51 22.080 -5.611 -3.243 1.00 1.06 C ATOM 777 CD2 TYR A 51 21.466 -3.934 -1.669 1.00 1.22 C ATOM 778 CE1 TYR A 51 23.365 -5.628 -2.734 1.00 1.36 C ATOM 779 CE2 TYR A 51 22.750 -3.943 -1.156 1.00 1.63 C ATOM 780 CZ TYR A 51 23.696 -4.792 -1.691 1.00 1.64 C ATOM 781 OH TYR A 51 24.980 -4.798 -1.185 1.00 2.08 O ATOM 0 H TYR A 51 17.453 -3.883 -4.329 1.00 0.53 H new ATOM 0 HA TYR A 51 20.248 -2.987 -4.387 1.00 0.68 H new ATOM 0 HB2 TYR A 51 19.006 -4.426 -2.514 1.00 0.74 H new ATOM 0 HB3 TYR A 51 19.417 -5.757 -3.577 1.00 0.74 H new ATOM 0 HD1 TYR A 51 21.826 -6.267 -4.063 1.00 1.06 H new ATOM 0 HD2 TYR A 51 20.729 -3.268 -1.244 1.00 1.22 H new ATOM 0 HE1 TYR A 51 24.106 -6.294 -3.152 1.00 1.36 H new ATOM 0 HE2 TYR A 51 23.011 -3.287 -0.339 1.00 1.63 H new ATOM 0 HH TYR A 51 25.046 -4.149 -0.453 1.00 2.08 H new ATOM 791 N SER A 52 20.022 -5.885 -5.607 1.00 0.69 N ATOM 792 CA SER A 52 20.156 -6.808 -6.703 1.00 0.66 C ATOM 793 C SER A 52 19.928 -8.212 -6.179 1.00 0.65 C ATOM 794 O SER A 52 20.324 -9.192 -6.806 1.00 0.77 O ATOM 795 CB SER A 52 21.551 -6.688 -7.315 1.00 0.80 C ATOM 796 OG SER A 52 22.555 -6.856 -6.323 1.00 1.51 O ATOM 0 H SER A 52 20.044 -6.333 -4.691 1.00 0.69 H new ATOM 0 HA SER A 52 19.423 -6.582 -7.477 1.00 0.66 H new ATOM 0 HB2 SER A 52 21.676 -7.438 -8.096 1.00 0.80 H new ATOM 0 HB3 SER A 52 21.662 -5.713 -7.789 1.00 0.80 H new ATOM 0 HG SER A 52 23.440 -6.777 -6.737 1.00 1.51 H new ATOM 802 N HIS A 53 19.270 -8.311 -5.021 1.00 0.58 N ATOM 803 CA HIS A 53 19.076 -9.592 -4.376 1.00 0.66 C ATOM 804 C HIS A 53 17.745 -9.636 -3.652 1.00 0.65 C ATOM 805 O HIS A 53 17.148 -8.602 -3.347 1.00 1.08 O ATOM 806 CB HIS A 53 20.210 -9.888 -3.386 1.00 0.74 C ATOM 807 CG HIS A 53 21.536 -10.096 -4.043 1.00 0.95 C ATOM 808 ND1 HIS A 53 22.639 -9.323 -3.768 1.00 1.06 N ATOM 809 CD2 HIS A 53 21.926 -10.981 -4.986 1.00 1.41 C ATOM 810 CE1 HIS A 53 23.645 -9.713 -4.523 1.00 1.43 C ATOM 811 NE2 HIS A 53 23.242 -10.723 -5.271 1.00 1.67 N ATOM 0 H HIS A 53 18.868 -7.518 -4.521 1.00 0.58 H new ATOM 0 HA HIS A 53 19.082 -10.355 -5.155 1.00 0.66 H new ATOM 0 HB2 HIS A 53 20.289 -9.062 -2.679 1.00 0.74 H new ATOM 0 HB3 HIS A 53 19.955 -10.777 -2.810 1.00 0.74 H new ATOM 0 HD2 HIS A 53 21.314 -11.750 -5.433 1.00 1.41 H new ATOM 0 HE1 HIS A 53 24.634 -9.279 -4.529 1.00 1.43 H new ATOM 0 HE2 HIS A 53 23.814 -11.227 -5.948 1.00 1.67 H new ATOM 820 N SER A 54 17.292 -10.847 -3.433 1.00 0.55 N ATOM 821 CA SER A 54 16.111 -11.140 -2.650 1.00 0.51 C ATOM 822 C SER A 54 16.205 -10.549 -1.244 1.00 0.47 C ATOM 823 O SER A 54 16.876 -11.113 -0.399 1.00 0.51 O ATOM 824 CB SER A 54 15.980 -12.667 -2.545 1.00 0.61 C ATOM 825 OG SER A 54 14.936 -13.058 -1.674 1.00 1.39 O ATOM 0 H SER A 54 17.746 -11.681 -3.804 1.00 0.55 H new ATOM 0 HA SER A 54 15.244 -10.697 -3.140 1.00 0.51 H new ATOM 0 HB2 SER A 54 15.798 -13.083 -3.536 1.00 0.61 H new ATOM 0 HB3 SER A 54 16.922 -13.087 -2.191 1.00 0.61 H new ATOM 0 HG SER A 54 14.888 -14.036 -1.639 1.00 1.39 H new ATOM 831 N ILE A 55 15.502 -9.453 -0.975 1.00 0.44 N ATOM 832 CA ILE A 55 15.525 -8.868 0.366 1.00 0.49 C ATOM 833 C ILE A 55 14.614 -9.642 1.278 1.00 0.58 C ATOM 834 O ILE A 55 13.428 -9.722 1.037 1.00 1.03 O ATOM 835 CB ILE A 55 15.078 -7.404 0.398 1.00 0.49 C ATOM 836 CG1 ILE A 55 13.835 -7.184 -0.467 1.00 0.47 C ATOM 837 CG2 ILE A 55 16.217 -6.512 -0.037 1.00 0.48 C ATOM 838 CD1 ILE A 55 13.213 -5.814 -0.308 1.00 0.56 C ATOM 0 H ILE A 55 14.920 -8.958 -1.651 1.00 0.44 H new ATOM 0 HA ILE A 55 16.563 -8.915 0.694 1.00 0.49 H new ATOM 0 HB ILE A 55 14.805 -7.144 1.421 1.00 0.49 H new ATOM 0 HG12 ILE A 55 14.102 -7.332 -1.513 1.00 0.47 H new ATOM 0 HG13 ILE A 55 13.092 -7.941 -0.217 1.00 0.47 H new ATOM 0 HG21 ILE A 55 15.894 -5.471 -0.013 1.00 0.48 H new ATOM 0 HG22 ILE A 55 17.062 -6.646 0.638 1.00 0.48 H new ATOM 0 HG23 ILE A 55 16.518 -6.775 -1.051 1.00 0.48 H new ATOM 0 HD11 ILE A 55 12.338 -5.735 -0.953 1.00 0.56 H new ATOM 0 HD12 ILE A 55 12.914 -5.669 0.730 1.00 0.56 H new ATOM 0 HD13 ILE A 55 13.939 -5.050 -0.587 1.00 0.56 H new ATOM 850 N PRO A 56 15.149 -10.150 2.380 1.00 0.35 N ATOM 851 CA PRO A 56 14.523 -11.243 3.100 1.00 0.34 C ATOM 852 C PRO A 56 13.159 -10.880 3.657 1.00 0.30 C ATOM 853 O PRO A 56 12.164 -11.553 3.382 1.00 0.32 O ATOM 854 CB PRO A 56 15.501 -11.553 4.226 1.00 0.37 C ATOM 855 CG PRO A 56 16.333 -10.327 4.393 1.00 0.35 C ATOM 856 CD PRO A 56 16.343 -9.629 3.061 1.00 0.35 C ATOM 0 HA PRO A 56 14.335 -12.092 2.443 1.00 0.34 H new ATOM 0 HB2 PRO A 56 14.972 -11.795 5.148 1.00 0.37 H new ATOM 0 HB3 PRO A 56 16.121 -12.415 3.979 1.00 0.37 H new ATOM 0 HG2 PRO A 56 15.919 -9.680 5.166 1.00 0.35 H new ATOM 0 HG3 PRO A 56 17.346 -10.585 4.703 1.00 0.35 H new ATOM 0 HD2 PRO A 56 16.296 -8.546 3.177 1.00 0.35 H new ATOM 0 HD3 PRO A 56 17.251 -9.851 2.501 1.00 0.35 H new ATOM 864 N ILE A 57 13.104 -9.816 4.435 1.00 0.29 N ATOM 865 CA ILE A 57 11.877 -9.492 5.147 1.00 0.30 C ATOM 866 C ILE A 57 11.498 -8.033 4.948 1.00 0.27 C ATOM 867 O ILE A 57 12.352 -7.202 4.647 1.00 0.30 O ATOM 868 CB ILE A 57 12.040 -9.829 6.652 1.00 0.38 C ATOM 869 CG1 ILE A 57 12.316 -11.332 6.815 1.00 0.58 C ATOM 870 CG2 ILE A 57 10.812 -9.422 7.462 1.00 0.38 C ATOM 871 CD1 ILE A 57 11.113 -12.210 6.538 1.00 1.23 C ATOM 0 H ILE A 57 13.878 -9.170 4.591 1.00 0.29 H new ATOM 0 HA ILE A 57 11.065 -10.095 4.740 1.00 0.30 H new ATOM 0 HB ILE A 57 12.884 -9.258 7.038 1.00 0.38 H new ATOM 0 HG12 ILE A 57 13.125 -11.618 6.143 1.00 0.58 H new ATOM 0 HG13 ILE A 57 12.664 -11.520 7.831 1.00 0.58 H new ATOM 0 HG21 ILE A 57 10.967 -9.676 8.511 1.00 0.38 H new ATOM 0 HG22 ILE A 57 10.654 -8.348 7.368 1.00 0.38 H new ATOM 0 HG23 ILE A 57 9.937 -9.952 7.087 1.00 0.38 H new ATOM 0 HD11 ILE A 57 11.387 -13.256 6.674 1.00 1.23 H new ATOM 0 HD12 ILE A 57 10.309 -11.953 7.227 1.00 1.23 H new ATOM 0 HD13 ILE A 57 10.776 -12.053 5.513 1.00 1.23 H new ATOM 883 N CYS A 58 10.214 -7.731 5.070 1.00 0.26 N ATOM 884 CA CYS A 58 9.744 -6.379 4.918 1.00 0.24 C ATOM 885 C CYS A 58 8.550 -6.096 5.812 1.00 0.23 C ATOM 886 O CYS A 58 8.052 -6.962 6.533 1.00 0.25 O ATOM 887 CB CYS A 58 9.379 -6.081 3.464 1.00 0.26 C ATOM 888 SG CYS A 58 8.095 -7.146 2.770 1.00 1.15 S ATOM 0 H CYS A 58 9.483 -8.413 5.275 1.00 0.26 H new ATOM 0 HA CYS A 58 10.563 -5.725 5.219 1.00 0.24 H new ATOM 0 HB2 CYS A 58 9.049 -5.045 3.392 1.00 0.26 H new ATOM 0 HB3 CYS A 58 10.277 -6.173 2.853 1.00 0.26 H new ATOM 0 HG CYS A 58 7.968 -8.209 3.507 1.00 1.15 H new ATOM 894 N GLU A 59 8.116 -4.863 5.730 1.00 0.25 N ATOM 895 CA GLU A 59 7.029 -4.380 6.534 1.00 0.27 C ATOM 896 C GLU A 59 6.156 -3.474 5.705 1.00 0.29 C ATOM 897 O GLU A 59 6.571 -2.402 5.261 1.00 0.32 O ATOM 898 CB GLU A 59 7.595 -3.677 7.772 1.00 0.32 C ATOM 899 CG GLU A 59 6.566 -3.293 8.820 1.00 0.39 C ATOM 900 CD GLU A 59 6.107 -1.861 8.690 1.00 0.67 C ATOM 901 OE1 GLU A 59 6.959 -0.947 8.763 1.00 1.04 O ATOM 902 OE2 GLU A 59 4.894 -1.638 8.547 1.00 1.36 O ATOM 0 H GLU A 59 8.511 -4.165 5.100 1.00 0.25 H new ATOM 0 HA GLU A 59 6.405 -5.205 6.878 1.00 0.27 H new ATOM 0 HB2 GLU A 59 8.336 -4.329 8.234 1.00 0.32 H new ATOM 0 HB3 GLU A 59 8.119 -2.776 7.452 1.00 0.32 H new ATOM 0 HG2 GLU A 59 5.704 -3.955 8.737 1.00 0.39 H new ATOM 0 HG3 GLU A 59 6.990 -3.445 9.812 1.00 0.39 H new ATOM 909 N ILE A 60 4.961 -3.962 5.479 1.00 0.32 N ATOM 910 CA ILE A 60 3.962 -3.244 4.736 1.00 0.34 C ATOM 911 C ILE A 60 2.967 -2.558 5.663 1.00 0.31 C ATOM 912 O ILE A 60 2.216 -3.196 6.405 1.00 0.36 O ATOM 913 CB ILE A 60 3.252 -4.173 3.727 1.00 0.48 C ATOM 914 CG1 ILE A 60 3.476 -5.641 4.102 1.00 0.33 C ATOM 915 CG2 ILE A 60 3.755 -3.907 2.314 1.00 0.99 C ATOM 916 CD1 ILE A 60 2.327 -6.259 4.859 1.00 1.05 C ATOM 0 H ILE A 60 4.655 -4.877 5.810 1.00 0.32 H new ATOM 0 HA ILE A 60 4.465 -2.461 4.168 1.00 0.34 H new ATOM 0 HB ILE A 60 2.183 -3.965 3.761 1.00 0.48 H new ATOM 0 HG12 ILE A 60 3.651 -6.216 3.193 1.00 0.33 H new ATOM 0 HG13 ILE A 60 4.380 -5.718 4.706 1.00 0.33 H new ATOM 0 HG21 ILE A 60 3.245 -4.570 1.615 1.00 0.99 H new ATOM 0 HG22 ILE A 60 3.552 -2.870 2.045 1.00 0.99 H new ATOM 0 HG23 ILE A 60 4.829 -4.090 2.269 1.00 0.99 H new ATOM 0 HD11 ILE A 60 2.560 -7.299 5.089 1.00 1.05 H new ATOM 0 HD12 ILE A 60 2.165 -5.710 5.787 1.00 1.05 H new ATOM 0 HD13 ILE A 60 1.424 -6.216 4.249 1.00 1.05 H new ATOM 928 N SER A 61 3.000 -1.242 5.595 1.00 0.26 N ATOM 929 CA SER A 61 2.127 -0.392 6.376 1.00 0.25 C ATOM 930 C SER A 61 1.135 0.265 5.442 1.00 0.24 C ATOM 931 O SER A 61 1.471 1.217 4.748 1.00 0.24 O ATOM 932 CB SER A 61 2.931 0.680 7.106 1.00 0.29 C ATOM 933 OG SER A 61 4.317 0.393 7.077 1.00 0.83 O ATOM 0 H SER A 61 3.641 -0.729 4.990 1.00 0.26 H new ATOM 0 HA SER A 61 1.607 -0.995 7.120 1.00 0.25 H new ATOM 0 HB2 SER A 61 2.749 1.651 6.645 1.00 0.29 H new ATOM 0 HB3 SER A 61 2.593 0.750 8.140 1.00 0.29 H new ATOM 0 HG SER A 61 4.507 -0.363 7.671 1.00 0.83 H new ATOM 939 N PHE A 62 -0.086 -0.217 5.421 1.00 0.24 N ATOM 940 CA PHE A 62 -1.021 0.201 4.405 1.00 0.25 C ATOM 941 C PHE A 62 -2.085 1.065 5.025 1.00 0.26 C ATOM 942 O PHE A 62 -2.613 0.765 6.086 1.00 0.30 O ATOM 943 CB PHE A 62 -1.643 -1.007 3.695 1.00 0.27 C ATOM 944 CG PHE A 62 -2.026 -2.127 4.628 1.00 0.29 C ATOM 945 CD1 PHE A 62 -3.261 -2.135 5.261 1.00 0.31 C ATOM 946 CD2 PHE A 62 -1.140 -3.164 4.884 1.00 0.34 C ATOM 947 CE1 PHE A 62 -3.602 -3.154 6.131 1.00 0.37 C ATOM 948 CE2 PHE A 62 -1.479 -4.184 5.750 1.00 0.40 C ATOM 949 CZ PHE A 62 -2.709 -4.179 6.375 1.00 0.40 C ATOM 0 H PHE A 62 -0.452 -0.894 6.091 1.00 0.24 H new ATOM 0 HA PHE A 62 -0.486 0.781 3.653 1.00 0.25 H new ATOM 0 HB2 PHE A 62 -2.529 -0.681 3.150 1.00 0.27 H new ATOM 0 HB3 PHE A 62 -0.937 -1.387 2.957 1.00 0.27 H new ATOM 0 HD1 PHE A 62 -3.963 -1.337 5.072 1.00 0.31 H new ATOM 0 HD2 PHE A 62 -0.174 -3.173 4.400 1.00 0.34 H new ATOM 0 HE1 PHE A 62 -4.565 -3.148 6.619 1.00 0.37 H new ATOM 0 HE2 PHE A 62 -0.781 -4.986 5.938 1.00 0.40 H new ATOM 0 HZ PHE A 62 -2.973 -4.976 7.054 1.00 0.40 H new ATOM 959 N THR A 63 -2.341 2.167 4.386 1.00 0.25 N ATOM 960 CA THR A 63 -3.393 3.052 4.798 1.00 0.27 C ATOM 961 C THR A 63 -4.284 3.361 3.619 1.00 0.25 C ATOM 962 O THR A 63 -3.937 4.157 2.753 1.00 0.27 O ATOM 963 CB THR A 63 -2.829 4.355 5.382 1.00 0.32 C ATOM 964 OG1 THR A 63 -1.878 4.047 6.410 1.00 0.36 O ATOM 965 CG2 THR A 63 -3.941 5.223 5.952 1.00 0.38 C ATOM 0 H THR A 63 -1.826 2.480 3.563 1.00 0.25 H new ATOM 0 HA THR A 63 -3.972 2.557 5.578 1.00 0.27 H new ATOM 0 HB THR A 63 -2.339 4.910 4.582 1.00 0.32 H new ATOM 0 HG1 THR A 63 -1.517 4.879 6.782 1.00 0.36 H new ATOM 0 HG21 THR A 63 -3.515 6.140 6.359 1.00 0.38 H new ATOM 0 HG22 THR A 63 -4.649 5.472 5.162 1.00 0.38 H new ATOM 0 HG23 THR A 63 -4.457 4.680 6.744 1.00 0.38 H new ATOM 973 N PHE A 64 -5.421 2.715 3.577 1.00 0.24 N ATOM 974 CA PHE A 64 -6.368 2.953 2.520 1.00 0.24 C ATOM 975 C PHE A 64 -7.398 3.950 3.005 1.00 0.22 C ATOM 976 O PHE A 64 -7.759 3.947 4.177 1.00 0.23 O ATOM 977 CB PHE A 64 -7.063 1.661 2.102 1.00 0.27 C ATOM 978 CG PHE A 64 -6.169 0.634 1.479 1.00 0.43 C ATOM 979 CD1 PHE A 64 -5.861 0.689 0.128 1.00 0.58 C ATOM 980 CD2 PHE A 64 -5.656 -0.402 2.239 1.00 0.65 C ATOM 981 CE1 PHE A 64 -5.057 -0.270 -0.447 1.00 0.84 C ATOM 982 CE2 PHE A 64 -4.847 -1.362 1.668 1.00 0.90 C ATOM 983 CZ PHE A 64 -4.548 -1.295 0.323 1.00 0.96 C ATOM 0 H PHE A 64 -5.713 2.020 4.264 1.00 0.24 H new ATOM 0 HA PHE A 64 -5.837 3.346 1.653 1.00 0.24 H new ATOM 0 HB2 PHE A 64 -7.539 1.222 2.979 1.00 0.27 H new ATOM 0 HB3 PHE A 64 -7.857 1.905 1.397 1.00 0.27 H new ATOM 0 HD1 PHE A 64 -6.255 1.491 -0.479 1.00 0.58 H new ATOM 0 HD2 PHE A 64 -5.892 -0.460 3.291 1.00 0.65 H new ATOM 0 HE1 PHE A 64 -4.825 -0.219 -1.501 1.00 0.84 H new ATOM 0 HE2 PHE A 64 -4.449 -2.164 2.272 1.00 0.90 H new ATOM 0 HZ PHE A 64 -3.915 -2.045 -0.127 1.00 0.96 H new ATOM 993 N HIS A 65 -7.772 4.866 2.130 1.00 0.24 N ATOM 994 CA HIS A 65 -8.826 5.842 2.398 1.00 0.26 C ATOM 995 C HIS A 65 -9.565 6.137 1.111 1.00 0.24 C ATOM 996 O HIS A 65 -8.947 6.244 0.060 1.00 0.36 O ATOM 997 CB HIS A 65 -8.294 7.132 3.053 1.00 0.42 C ATOM 998 CG HIS A 65 -6.880 7.490 2.703 1.00 0.51 C ATOM 999 ND1 HIS A 65 -5.751 6.751 2.750 1.00 1.02 N flip ATOM 1000 CD2 HIS A 65 -6.497 8.745 2.303 1.00 0.53 C flip ATOM 1001 CE1 HIS A 65 -4.710 7.565 2.379 1.00 1.29 C flip ATOM 1002 NE2 HIS A 65 -5.194 8.768 2.118 1.00 1.02 N flip ATOM 0 H HIS A 65 -7.353 4.959 1.205 1.00 0.24 H new ATOM 0 HA HIS A 65 -9.514 5.409 3.123 1.00 0.26 H new ATOM 0 HB2 HIS A 65 -8.943 7.960 2.767 1.00 0.42 H new ATOM 0 HB3 HIS A 65 -8.368 7.028 4.135 1.00 0.42 H new ATOM 0 HD2 HIS A 65 -7.162 9.584 2.162 1.00 0.53 H new ATOM 0 HE1 HIS A 65 -3.672 7.273 2.312 1.00 1.29 H new ATOM 0 HE2 HIS A 65 -4.649 9.578 1.823 1.00 1.02 H new ATOM 1011 N SER A 66 -10.881 6.231 1.178 1.00 0.22 N ATOM 1012 CA SER A 66 -11.670 6.378 -0.030 1.00 0.25 C ATOM 1013 C SER A 66 -11.978 7.831 -0.314 1.00 0.24 C ATOM 1014 O SER A 66 -11.128 8.549 -0.834 1.00 0.30 O ATOM 1015 CB SER A 66 -12.957 5.574 0.067 1.00 0.38 C ATOM 1016 OG SER A 66 -13.754 5.713 -1.093 1.00 1.27 O ATOM 0 H SER A 66 -11.419 6.209 2.044 1.00 0.22 H new ATOM 0 HA SER A 66 -11.078 5.991 -0.859 1.00 0.25 H new ATOM 0 HB2 SER A 66 -12.717 4.522 0.219 1.00 0.38 H new ATOM 0 HB3 SER A 66 -13.524 5.901 0.939 1.00 0.38 H new ATOM 0 HG SER A 66 -13.742 4.875 -1.601 1.00 1.27 H new ATOM 1022 N ALA A 67 -13.180 8.271 0.060 1.00 0.24 N ATOM 1023 CA ALA A 67 -13.622 9.615 -0.261 1.00 0.28 C ATOM 1024 C ALA A 67 -12.634 10.618 0.290 1.00 0.30 C ATOM 1025 O ALA A 67 -12.056 11.415 -0.446 1.00 0.36 O ATOM 1026 CB ALA A 67 -15.010 9.858 0.301 1.00 0.32 C ATOM 0 H ALA A 67 -13.857 7.715 0.582 1.00 0.24 H new ATOM 0 HA ALA A 67 -13.671 9.731 -1.344 1.00 0.28 H new ATOM 0 HB1 ALA A 67 -15.331 10.870 0.054 1.00 0.32 H new ATOM 0 HB2 ALA A 67 -15.708 9.140 -0.130 1.00 0.32 H new ATOM 0 HB3 ALA A 67 -14.990 9.738 1.384 1.00 0.32 H new ATOM 1032 N GLY A 68 -12.451 10.600 1.600 1.00 0.29 N ATOM 1033 CA GLY A 68 -11.388 11.353 2.199 1.00 0.32 C ATOM 1034 C GLY A 68 -11.341 11.059 3.673 1.00 0.34 C ATOM 1035 O GLY A 68 -10.756 11.806 4.457 1.00 0.39 O ATOM 0 H GLY A 68 -13.027 10.072 2.256 1.00 0.29 H new ATOM 0 HA2 GLY A 68 -10.437 11.094 1.734 1.00 0.32 H new ATOM 0 HA3 GLY A 68 -11.544 12.419 2.034 1.00 0.32 H new ATOM 1039 N ARG A 69 -11.972 9.948 4.051 1.00 0.36 N ATOM 1040 CA ARG A 69 -12.128 9.615 5.452 1.00 0.46 C ATOM 1041 C ARG A 69 -11.154 8.526 5.866 1.00 0.52 C ATOM 1042 O ARG A 69 -10.346 8.720 6.773 1.00 1.08 O ATOM 1043 CB ARG A 69 -13.586 9.220 5.771 1.00 0.48 C ATOM 1044 CG ARG A 69 -14.205 8.104 4.919 1.00 0.47 C ATOM 1045 CD ARG A 69 -15.293 8.603 3.967 1.00 0.58 C ATOM 1046 NE ARG A 69 -16.080 9.702 4.541 1.00 0.55 N ATOM 1047 CZ ARG A 69 -16.953 10.465 3.875 1.00 1.05 C ATOM 1048 NH1 ARG A 69 -17.203 10.261 2.587 1.00 1.97 N ATOM 1049 NH2 ARG A 69 -17.575 11.442 4.513 1.00 1.04 N ATOM 0 H ARG A 69 -12.379 9.271 3.405 1.00 0.36 H new ATOM 0 HA ARG A 69 -11.894 10.505 6.036 1.00 0.46 H new ATOM 0 HB2 ARG A 69 -13.634 8.915 6.816 1.00 0.48 H new ATOM 0 HB3 ARG A 69 -14.208 10.109 5.670 1.00 0.48 H new ATOM 0 HG2 ARG A 69 -13.419 7.620 4.340 1.00 0.47 H new ATOM 0 HG3 ARG A 69 -14.628 7.346 5.578 1.00 0.47 H new ATOM 0 HD2 ARG A 69 -14.833 8.937 3.037 1.00 0.58 H new ATOM 0 HD3 ARG A 69 -15.958 7.777 3.715 1.00 0.58 H new ATOM 0 HE ARG A 69 -15.949 9.900 5.533 1.00 0.55 H new ATOM 0 HH11 ARG A 69 -16.725 9.511 2.087 1.00 1.97 H new ATOM 0 HH12 ARG A 69 -17.873 10.854 2.097 1.00 1.97 H new ATOM 0 HH21 ARG A 69 -17.387 11.606 5.502 1.00 1.04 H new ATOM 0 HH22 ARG A 69 -18.243 12.031 4.016 1.00 1.04 H new ATOM 1063 N GLU A 70 -11.214 7.406 5.163 1.00 0.52 N ATOM 1064 CA GLU A 70 -10.403 6.244 5.437 1.00 0.52 C ATOM 1065 C GLU A 70 -10.926 5.127 4.553 1.00 0.67 C ATOM 1066 O GLU A 70 -11.833 5.357 3.749 1.00 1.28 O ATOM 1067 CB GLU A 70 -10.473 5.833 6.920 1.00 0.66 C ATOM 1068 CG GLU A 70 -9.403 4.827 7.331 1.00 1.35 C ATOM 1069 CD GLU A 70 -9.390 4.549 8.819 1.00 1.91 C ATOM 1070 OE1 GLU A 70 -8.725 5.306 9.559 1.00 2.12 O ATOM 1071 OE2 GLU A 70 -10.021 3.567 9.256 1.00 2.61 O ATOM 0 H GLU A 70 -11.844 7.283 4.370 1.00 0.52 H new ATOM 0 HA GLU A 70 -9.356 6.462 5.228 1.00 0.52 H new ATOM 0 HB2 GLU A 70 -10.377 6.725 7.539 1.00 0.66 H new ATOM 0 HB3 GLU A 70 -11.456 5.408 7.124 1.00 0.66 H new ATOM 0 HG2 GLU A 70 -9.566 3.892 6.794 1.00 1.35 H new ATOM 0 HG3 GLU A 70 -8.425 5.202 7.029 1.00 1.35 H new ATOM 1078 N ILE A 71 -10.267 3.996 4.618 1.00 0.28 N ATOM 1079 CA ILE A 71 -10.749 2.732 4.085 1.00 0.28 C ATOM 1080 C ILE A 71 -10.273 1.611 4.995 1.00 0.29 C ATOM 1081 O ILE A 71 -11.051 0.757 5.406 1.00 0.33 O ATOM 1082 CB ILE A 71 -10.246 2.472 2.646 1.00 0.31 C ATOM 1083 CG1 ILE A 71 -11.136 3.155 1.623 1.00 0.37 C ATOM 1084 CG2 ILE A 71 -10.168 0.988 2.354 1.00 0.30 C ATOM 1085 CD1 ILE A 71 -12.519 2.556 1.529 1.00 0.40 C ATOM 0 H ILE A 71 -9.349 3.921 5.057 1.00 0.28 H new ATOM 0 HA ILE A 71 -11.838 2.773 4.046 1.00 0.28 H new ATOM 0 HB ILE A 71 -9.244 2.894 2.571 1.00 0.31 H new ATOM 0 HG12 ILE A 71 -11.223 4.211 1.877 1.00 0.37 H new ATOM 0 HG13 ILE A 71 -10.658 3.101 0.645 1.00 0.37 H new ATOM 0 HG21 ILE A 71 -9.811 0.836 1.335 1.00 0.30 H new ATOM 0 HG22 ILE A 71 -9.479 0.515 3.054 1.00 0.30 H new ATOM 0 HG23 ILE A 71 -11.157 0.543 2.462 1.00 0.30 H new ATOM 0 HD11 ILE A 71 -13.098 3.094 0.779 1.00 0.40 H new ATOM 0 HD12 ILE A 71 -12.442 1.507 1.244 1.00 0.40 H new ATOM 0 HD13 ILE A 71 -13.016 2.634 2.496 1.00 0.40 H new ATOM 1097 N GLY A 72 -8.989 1.646 5.330 1.00 0.29 N ATOM 1098 CA GLY A 72 -8.427 0.611 6.170 1.00 0.36 C ATOM 1099 C GLY A 72 -6.924 0.712 6.263 1.00 0.34 C ATOM 1100 O GLY A 72 -6.232 0.690 5.246 1.00 0.49 O ATOM 0 H GLY A 72 -8.332 2.369 5.036 1.00 0.29 H new ATOM 0 HA2 GLY A 72 -8.858 0.681 7.169 1.00 0.36 H new ATOM 0 HA3 GLY A 72 -8.701 -0.367 5.773 1.00 0.36 H new ATOM 1104 N LYS A 73 -6.414 0.862 7.473 1.00 0.36 N ATOM 1105 CA LYS A 73 -4.977 0.947 7.664 1.00 0.35 C ATOM 1106 C LYS A 73 -4.472 -0.099 8.649 1.00 0.39 C ATOM 1107 O LYS A 73 -5.240 -0.704 9.403 1.00 0.47 O ATOM 1108 CB LYS A 73 -4.541 2.353 8.112 1.00 0.44 C ATOM 1109 CG LYS A 73 -4.764 2.657 9.585 1.00 0.61 C ATOM 1110 CD LYS A 73 -6.210 2.993 9.891 1.00 0.68 C ATOM 1111 CE LYS A 73 -6.371 3.387 11.345 1.00 1.26 C ATOM 1112 NZ LYS A 73 -7.726 3.926 11.631 1.00 1.81 N ATOM 0 H LYS A 73 -6.966 0.927 8.328 1.00 0.36 H new ATOM 0 HA LYS A 73 -4.526 0.744 6.693 1.00 0.35 H new ATOM 0 HB2 LYS A 73 -3.482 2.477 7.887 1.00 0.44 H new ATOM 0 HB3 LYS A 73 -5.081 3.091 7.519 1.00 0.44 H new ATOM 0 HG2 LYS A 73 -4.459 1.797 10.181 1.00 0.61 H new ATOM 0 HG3 LYS A 73 -4.129 3.492 9.882 1.00 0.61 H new ATOM 0 HD2 LYS A 73 -6.543 3.808 9.249 1.00 0.68 H new ATOM 0 HD3 LYS A 73 -6.843 2.134 9.669 1.00 0.68 H new ATOM 0 HE2 LYS A 73 -6.185 2.519 11.978 1.00 1.26 H new ATOM 0 HE3 LYS A 73 -5.622 4.136 11.602 1.00 1.26 H new ATOM 0 HZ1 LYS A 73 -7.707 4.456 12.526 1.00 1.81 H new ATOM 0 HZ2 LYS A 73 -8.018 4.560 10.859 1.00 1.81 H new ATOM 0 HZ3 LYS A 73 -8.403 3.140 11.708 1.00 1.81 H new ATOM 1126 N GLY A 74 -3.169 -0.300 8.619 1.00 0.39 N ATOM 1127 CA GLY A 74 -2.515 -1.272 9.464 1.00 0.43 C ATOM 1128 C GLY A 74 -1.132 -1.575 8.933 1.00 0.34 C ATOM 1129 O GLY A 74 -0.798 -1.162 7.823 1.00 0.32 O ATOM 0 H GLY A 74 -2.534 0.210 8.004 1.00 0.39 H new ATOM 0 HA2 GLY A 74 -2.446 -0.892 10.483 1.00 0.43 H new ATOM 0 HA3 GLY A 74 -3.106 -2.187 9.504 1.00 0.43 H new ATOM 1133 N LYS A 75 -0.324 -2.282 9.699 1.00 0.37 N ATOM 1134 CA LYS A 75 1.023 -2.603 9.255 1.00 0.37 C ATOM 1135 C LYS A 75 1.440 -3.989 9.720 1.00 0.39 C ATOM 1136 O LYS A 75 1.217 -4.366 10.872 1.00 0.50 O ATOM 1137 CB LYS A 75 2.009 -1.527 9.715 1.00 0.56 C ATOM 1138 CG LYS A 75 2.048 -1.302 11.214 1.00 0.84 C ATOM 1139 CD LYS A 75 2.571 0.088 11.555 1.00 0.90 C ATOM 1140 CE LYS A 75 3.945 0.353 10.952 1.00 1.17 C ATOM 1141 NZ LYS A 75 4.961 -0.616 11.435 1.00 1.72 N ATOM 0 H LYS A 75 -0.570 -2.642 10.621 1.00 0.37 H new ATOM 0 HA LYS A 75 1.032 -2.618 8.165 1.00 0.37 H new ATOM 0 HB2 LYS A 75 3.008 -1.801 9.376 1.00 0.56 H new ATOM 0 HB3 LYS A 75 1.753 -0.587 9.227 1.00 0.56 H new ATOM 0 HG2 LYS A 75 1.048 -1.428 11.628 1.00 0.84 H new ATOM 0 HG3 LYS A 75 2.683 -2.056 11.680 1.00 0.84 H new ATOM 0 HD2 LYS A 75 1.867 0.837 11.193 1.00 0.90 H new ATOM 0 HD3 LYS A 75 2.625 0.198 12.638 1.00 0.90 H new ATOM 0 HE2 LYS A 75 3.880 0.299 9.865 1.00 1.17 H new ATOM 0 HE3 LYS A 75 4.262 1.365 11.203 1.00 1.17 H new ATOM 0 HZ1 LYS A 75 5.897 -0.350 11.068 1.00 1.72 H new ATOM 0 HZ2 LYS A 75 4.982 -0.608 12.475 1.00 1.72 H new ATOM 0 HZ3 LYS A 75 4.717 -1.570 11.101 1.00 1.72 H new ATOM 1155 N ILE A 76 2.034 -4.747 8.809 1.00 0.35 N ATOM 1156 CA ILE A 76 2.367 -6.144 9.055 1.00 0.39 C ATOM 1157 C ILE A 76 3.737 -6.472 8.459 1.00 0.34 C ATOM 1158 O ILE A 76 4.065 -6.011 7.369 1.00 0.35 O ATOM 1159 CB ILE A 76 1.311 -7.088 8.418 1.00 0.45 C ATOM 1160 CG1 ILE A 76 -0.108 -6.709 8.858 1.00 0.51 C ATOM 1161 CG2 ILE A 76 1.599 -8.539 8.781 1.00 0.56 C ATOM 1162 CD1 ILE A 76 -1.193 -7.516 8.179 1.00 0.73 C ATOM 0 H ILE A 76 2.298 -4.413 7.882 1.00 0.35 H new ATOM 0 HA ILE A 76 2.381 -6.296 10.134 1.00 0.39 H new ATOM 0 HB ILE A 76 1.376 -6.975 7.336 1.00 0.45 H new ATOM 0 HG12 ILE A 76 -0.191 -6.841 9.937 1.00 0.51 H new ATOM 0 HG13 ILE A 76 -0.272 -5.651 8.652 1.00 0.51 H new ATOM 0 HG21 ILE A 76 0.848 -9.184 8.325 1.00 0.56 H new ATOM 0 HG22 ILE A 76 2.587 -8.817 8.414 1.00 0.56 H new ATOM 0 HG23 ILE A 76 1.568 -8.656 9.864 1.00 0.56 H new ATOM 0 HD11 ILE A 76 -2.168 -7.191 8.541 1.00 0.73 H new ATOM 0 HD12 ILE A 76 -1.138 -7.366 7.101 1.00 0.73 H new ATOM 0 HD13 ILE A 76 -1.056 -8.573 8.405 1.00 0.73 H new ATOM 1174 N PRO A 77 4.573 -7.237 9.176 1.00 0.34 N ATOM 1175 CA PRO A 77 5.828 -7.751 8.632 1.00 0.32 C ATOM 1176 C PRO A 77 5.584 -8.955 7.720 1.00 0.33 C ATOM 1177 O PRO A 77 4.949 -9.933 8.126 1.00 0.44 O ATOM 1178 CB PRO A 77 6.630 -8.172 9.874 1.00 0.40 C ATOM 1179 CG PRO A 77 5.809 -7.763 11.058 1.00 0.57 C ATOM 1180 CD PRO A 77 4.392 -7.637 10.573 1.00 0.42 C ATOM 0 HA PRO A 77 6.346 -7.011 8.022 1.00 0.32 H new ATOM 0 HB2 PRO A 77 6.808 -9.247 9.876 1.00 0.40 H new ATOM 0 HB3 PRO A 77 7.606 -7.687 9.890 1.00 0.40 H new ATOM 0 HG2 PRO A 77 5.882 -8.503 11.855 1.00 0.57 H new ATOM 0 HG3 PRO A 77 6.164 -6.818 11.468 1.00 0.57 H new ATOM 0 HD2 PRO A 77 3.848 -8.578 10.659 1.00 0.42 H new ATOM 0 HD3 PRO A 77 3.833 -6.892 11.140 1.00 0.42 H new ATOM 1188 N ASP A 78 6.085 -8.887 6.496 1.00 0.30 N ATOM 1189 CA ASP A 78 5.857 -9.947 5.518 1.00 0.35 C ATOM 1190 C ASP A 78 7.185 -10.348 4.884 1.00 0.32 C ATOM 1191 O ASP A 78 8.079 -9.513 4.750 1.00 0.28 O ATOM 1192 CB ASP A 78 4.873 -9.463 4.439 1.00 0.39 C ATOM 1193 CG ASP A 78 4.145 -10.599 3.738 1.00 0.52 C ATOM 1194 OD1 ASP A 78 4.646 -11.103 2.711 1.00 0.52 O ATOM 1195 OD2 ASP A 78 3.055 -10.988 4.214 1.00 0.79 O ATOM 0 H ASP A 78 6.652 -8.111 6.154 1.00 0.30 H new ATOM 0 HA ASP A 78 5.425 -10.815 6.017 1.00 0.35 H new ATOM 0 HB2 ASP A 78 4.140 -8.798 4.897 1.00 0.39 H new ATOM 0 HB3 ASP A 78 5.416 -8.876 3.698 1.00 0.39 H new ATOM 1200 N PRO A 79 7.365 -11.632 4.535 1.00 0.39 N ATOM 1201 CA PRO A 79 8.561 -12.088 3.823 1.00 0.40 C ATOM 1202 C PRO A 79 8.634 -11.512 2.410 1.00 0.38 C ATOM 1203 O PRO A 79 8.082 -12.077 1.461 1.00 0.47 O ATOM 1204 CB PRO A 79 8.412 -13.615 3.776 1.00 0.52 C ATOM 1205 CG PRO A 79 7.355 -13.941 4.777 1.00 0.58 C ATOM 1206 CD PRO A 79 6.449 -12.744 4.827 1.00 0.49 C ATOM 0 HA PRO A 79 9.476 -11.764 4.319 1.00 0.40 H new ATOM 0 HB2 PRO A 79 8.126 -13.951 2.779 1.00 0.52 H new ATOM 0 HB3 PRO A 79 9.352 -14.109 4.022 1.00 0.52 H new ATOM 0 HG2 PRO A 79 6.804 -14.835 4.486 1.00 0.58 H new ATOM 0 HG3 PRO A 79 7.792 -14.141 5.755 1.00 0.58 H new ATOM 0 HD2 PRO A 79 5.647 -12.812 4.091 1.00 0.49 H new ATOM 0 HD3 PRO A 79 5.977 -12.634 5.803 1.00 0.49 H new ATOM 1214 N GLY A 80 9.308 -10.377 2.280 1.00 0.34 N ATOM 1215 CA GLY A 80 9.423 -9.712 0.997 1.00 0.40 C ATOM 1216 C GLY A 80 10.661 -10.135 0.242 1.00 0.35 C ATOM 1217 O GLY A 80 11.159 -9.402 -0.613 1.00 0.40 O ATOM 0 H GLY A 80 9.781 -9.901 3.048 1.00 0.34 H new ATOM 0 HA2 GLY A 80 8.541 -9.932 0.396 1.00 0.40 H new ATOM 0 HA3 GLY A 80 9.444 -8.633 1.150 1.00 0.40 H new ATOM 1221 N SER A 81 11.135 -11.333 0.547 1.00 0.34 N ATOM 1222 CA SER A 81 12.313 -11.888 -0.090 1.00 0.36 C ATOM 1223 C SER A 81 11.973 -12.229 -1.536 1.00 0.37 C ATOM 1224 O SER A 81 11.075 -13.030 -1.800 1.00 0.43 O ATOM 1225 CB SER A 81 12.757 -13.117 0.706 1.00 0.41 C ATOM 1226 OG SER A 81 11.745 -14.112 0.728 1.00 0.62 O ATOM 0 H SER A 81 10.712 -11.946 1.244 1.00 0.34 H new ATOM 0 HA SER A 81 13.138 -11.175 -0.102 1.00 0.36 H new ATOM 0 HB2 SER A 81 13.665 -13.529 0.266 1.00 0.41 H new ATOM 0 HB3 SER A 81 13.002 -12.823 1.726 1.00 0.41 H new ATOM 0 HG SER A 81 11.157 -13.998 -0.048 1.00 0.62 H new ATOM 1232 N LEU A 82 12.678 -11.613 -2.481 1.00 0.37 N ATOM 1233 CA LEU A 82 12.142 -11.522 -3.842 1.00 0.39 C ATOM 1234 C LEU A 82 13.196 -11.700 -4.934 1.00 0.49 C ATOM 1235 O LEU A 82 14.257 -12.268 -4.708 1.00 0.82 O ATOM 1236 CB LEU A 82 11.435 -10.169 -4.027 1.00 0.36 C ATOM 1237 CG LEU A 82 12.334 -8.955 -4.324 1.00 0.52 C ATOM 1238 CD1 LEU A 82 11.499 -7.695 -4.473 1.00 1.10 C ATOM 1239 CD2 LEU A 82 13.378 -8.762 -3.245 1.00 1.08 C ATOM 0 H LEU A 82 13.592 -11.182 -2.341 1.00 0.37 H new ATOM 0 HA LEU A 82 11.440 -12.348 -3.952 1.00 0.39 H new ATOM 0 HB2 LEU A 82 10.717 -10.268 -4.841 1.00 0.36 H new ATOM 0 HB3 LEU A 82 10.864 -9.957 -3.123 1.00 0.36 H new ATOM 0 HG LEU A 82 12.851 -9.151 -5.264 1.00 0.52 H new ATOM 0 HD11 LEU A 82 12.152 -6.848 -4.683 1.00 1.10 H new ATOM 0 HD12 LEU A 82 10.794 -7.821 -5.294 1.00 1.10 H new ATOM 0 HD13 LEU A 82 10.951 -7.510 -3.549 1.00 1.10 H new ATOM 0 HD21 LEU A 82 13.995 -7.897 -3.486 1.00 1.08 H new ATOM 0 HD22 LEU A 82 12.885 -8.600 -2.286 1.00 1.08 H new ATOM 0 HD23 LEU A 82 14.007 -9.650 -3.184 1.00 1.08 H new ATOM 1251 N LYS A 83 12.854 -11.212 -6.127 1.00 0.40 N ATOM 1252 CA LYS A 83 13.708 -11.290 -7.307 1.00 0.46 C ATOM 1253 C LYS A 83 15.115 -10.756 -7.055 1.00 0.47 C ATOM 1254 O LYS A 83 15.981 -11.468 -6.545 1.00 0.63 O ATOM 1255 CB LYS A 83 13.072 -10.497 -8.449 1.00 0.52 C ATOM 1256 CG LYS A 83 11.728 -11.036 -8.894 1.00 0.58 C ATOM 1257 CD LYS A 83 11.065 -10.106 -9.893 1.00 0.68 C ATOM 1258 CE LYS A 83 9.780 -10.701 -10.437 1.00 1.08 C ATOM 1259 NZ LYS A 83 10.040 -11.775 -11.431 1.00 1.84 N ATOM 0 H LYS A 83 11.964 -10.746 -6.300 1.00 0.40 H new ATOM 0 HA LYS A 83 13.799 -12.345 -7.567 1.00 0.46 H new ATOM 0 HB2 LYS A 83 12.951 -9.460 -8.136 1.00 0.52 H new ATOM 0 HB3 LYS A 83 13.752 -10.495 -9.301 1.00 0.52 H new ATOM 0 HG2 LYS A 83 11.859 -12.021 -9.342 1.00 0.58 H new ATOM 0 HG3 LYS A 83 11.080 -11.164 -8.027 1.00 0.58 H new ATOM 0 HD2 LYS A 83 10.851 -9.150 -9.415 1.00 0.68 H new ATOM 0 HD3 LYS A 83 11.751 -9.905 -10.716 1.00 0.68 H new ATOM 0 HE2 LYS A 83 9.190 -11.104 -9.614 1.00 1.08 H new ATOM 0 HE3 LYS A 83 9.184 -9.915 -10.901 1.00 1.08 H new ATOM 0 HZ1 LYS A 83 9.138 -12.107 -11.827 1.00 1.84 H new ATOM 0 HZ2 LYS A 83 10.638 -11.403 -12.196 1.00 1.84 H new ATOM 0 HZ3 LYS A 83 10.527 -12.568 -10.966 1.00 1.84 H new ATOM 1273 N ALA A 84 15.322 -9.487 -7.408 1.00 0.47 N ATOM 1274 CA ALA A 84 16.628 -8.875 -7.397 1.00 0.50 C ATOM 1275 C ALA A 84 16.523 -7.544 -8.110 1.00 0.58 C ATOM 1276 O ALA A 84 16.255 -7.524 -9.308 1.00 0.99 O ATOM 1277 CB ALA A 84 17.649 -9.756 -8.108 1.00 0.56 C ATOM 0 H ALA A 84 14.576 -8.860 -7.710 1.00 0.47 H new ATOM 0 HA ALA A 84 16.960 -8.741 -6.368 1.00 0.50 H new ATOM 0 HB1 ALA A 84 18.625 -9.272 -8.086 1.00 0.56 H new ATOM 0 HB2 ALA A 84 17.711 -10.721 -7.604 1.00 0.56 H new ATOM 0 HB3 ALA A 84 17.342 -9.906 -9.143 1.00 0.56 H new ATOM 1283 N LYS A 85 16.706 -6.450 -7.367 1.00 0.49 N ATOM 1284 CA LYS A 85 16.545 -5.086 -7.894 1.00 0.54 C ATOM 1285 C LYS A 85 15.334 -4.968 -8.817 1.00 0.53 C ATOM 1286 O LYS A 85 15.423 -4.430 -9.920 1.00 0.61 O ATOM 1287 CB LYS A 85 17.827 -4.628 -8.602 1.00 0.65 C ATOM 1288 CG LYS A 85 18.223 -5.468 -9.809 1.00 1.07 C ATOM 1289 CD LYS A 85 19.723 -5.446 -10.056 1.00 1.25 C ATOM 1290 CE LYS A 85 20.272 -4.034 -10.071 1.00 1.60 C ATOM 1291 NZ LYS A 85 19.676 -3.211 -11.161 1.00 1.84 N ATOM 0 H LYS A 85 16.970 -6.481 -6.382 1.00 0.49 H new ATOM 0 HA LYS A 85 16.363 -4.425 -7.046 1.00 0.54 H new ATOM 0 HB2 LYS A 85 17.699 -3.594 -8.922 1.00 0.65 H new ATOM 0 HB3 LYS A 85 18.647 -4.640 -7.884 1.00 0.65 H new ATOM 0 HG2 LYS A 85 17.897 -6.497 -9.657 1.00 1.07 H new ATOM 0 HG3 LYS A 85 17.705 -5.097 -10.694 1.00 1.07 H new ATOM 0 HD2 LYS A 85 20.227 -6.023 -9.281 1.00 1.25 H new ATOM 0 HD3 LYS A 85 19.941 -5.931 -11.008 1.00 1.25 H new ATOM 0 HE2 LYS A 85 20.075 -3.559 -9.110 1.00 1.60 H new ATOM 0 HE3 LYS A 85 21.355 -4.068 -10.194 1.00 1.60 H new ATOM 0 HZ1 LYS A 85 20.141 -2.281 -11.187 1.00 1.84 H new ATOM 0 HZ2 LYS A 85 19.812 -3.692 -12.073 1.00 1.84 H new ATOM 0 HZ3 LYS A 85 18.659 -3.085 -10.984 1.00 1.84 H new ATOM 1305 N ASP A 86 14.189 -5.424 -8.334 1.00 0.48 N ATOM 1306 CA ASP A 86 13.024 -5.576 -9.196 1.00 0.46 C ATOM 1307 C ASP A 86 11.746 -5.676 -8.374 1.00 0.40 C ATOM 1308 O ASP A 86 11.770 -5.521 -7.152 1.00 0.38 O ATOM 1309 CB ASP A 86 13.180 -6.817 -10.084 1.00 0.49 C ATOM 1310 CG ASP A 86 12.409 -6.709 -11.386 1.00 0.53 C ATOM 1311 OD1 ASP A 86 11.210 -7.055 -11.408 1.00 0.55 O ATOM 1312 OD2 ASP A 86 13.000 -6.284 -12.395 1.00 0.64 O ATOM 0 H ASP A 86 14.040 -5.693 -7.361 1.00 0.48 H new ATOM 0 HA ASP A 86 12.953 -4.692 -9.830 1.00 0.46 H new ATOM 0 HB2 ASP A 86 14.236 -6.970 -10.304 1.00 0.49 H new ATOM 0 HB3 ASP A 86 12.838 -7.695 -9.536 1.00 0.49 H new ATOM 1317 N MET A 87 10.652 -5.993 -9.051 1.00 0.39 N ATOM 1318 CA MET A 87 9.324 -5.917 -8.471 1.00 0.35 C ATOM 1319 C MET A 87 8.712 -7.308 -8.305 1.00 0.34 C ATOM 1320 O MET A 87 8.507 -8.031 -9.280 1.00 0.37 O ATOM 1321 CB MET A 87 8.443 -5.047 -9.364 1.00 0.35 C ATOM 1322 CG MET A 87 7.138 -4.623 -8.723 1.00 0.35 C ATOM 1323 SD MET A 87 6.079 -3.703 -9.857 1.00 0.41 S ATOM 1324 CE MET A 87 7.090 -2.259 -10.179 1.00 1.35 C ATOM 0 H MET A 87 10.663 -6.311 -10.020 1.00 0.39 H new ATOM 0 HA MET A 87 9.395 -5.472 -7.478 1.00 0.35 H new ATOM 0 HB2 MET A 87 9.002 -4.155 -9.649 1.00 0.35 H new ATOM 0 HB3 MET A 87 8.224 -5.593 -10.282 1.00 0.35 H new ATOM 0 HG2 MET A 87 6.606 -5.507 -8.370 1.00 0.35 H new ATOM 0 HG3 MET A 87 7.349 -4.008 -7.848 1.00 0.35 H new ATOM 0 HE1 MET A 87 6.513 -1.531 -10.749 1.00 1.35 H new ATOM 0 HE2 MET A 87 7.402 -1.815 -9.234 1.00 1.35 H new ATOM 0 HE3 MET A 87 7.971 -2.552 -10.750 1.00 1.35 H new ATOM 1334 N THR A 88 8.423 -7.666 -7.064 1.00 0.31 N ATOM 1335 CA THR A 88 7.878 -8.973 -6.726 1.00 0.30 C ATOM 1336 C THR A 88 6.399 -8.863 -6.367 1.00 0.27 C ATOM 1337 O THR A 88 5.969 -7.872 -5.777 1.00 0.27 O ATOM 1338 CB THR A 88 8.641 -9.606 -5.542 1.00 0.32 C ATOM 1339 OG1 THR A 88 8.391 -11.016 -5.486 1.00 0.77 O ATOM 1340 CG2 THR A 88 8.229 -8.967 -4.217 1.00 0.54 C ATOM 0 H THR A 88 8.560 -7.056 -6.258 1.00 0.31 H new ATOM 0 HA THR A 88 7.993 -9.611 -7.603 1.00 0.30 H new ATOM 0 HB THR A 88 9.705 -9.429 -5.700 1.00 0.32 H new ATOM 0 HG1 THR A 88 8.747 -11.378 -4.648 1.00 0.77 H new ATOM 0 HG21 THR A 88 8.782 -9.432 -3.401 1.00 0.54 H new ATOM 0 HG22 THR A 88 8.450 -7.900 -4.243 1.00 0.54 H new ATOM 0 HG23 THR A 88 7.160 -9.112 -4.060 1.00 0.54 H new ATOM 1348 N ALA A 89 5.618 -9.864 -6.729 1.00 0.27 N ATOM 1349 CA ALA A 89 4.198 -9.839 -6.428 1.00 0.28 C ATOM 1350 C ALA A 89 3.927 -10.361 -5.017 1.00 0.29 C ATOM 1351 O ALA A 89 4.223 -11.511 -4.687 1.00 0.48 O ATOM 1352 CB ALA A 89 3.411 -10.613 -7.467 1.00 0.31 C ATOM 0 H ALA A 89 5.937 -10.695 -7.226 1.00 0.27 H new ATOM 0 HA ALA A 89 3.862 -8.803 -6.464 1.00 0.28 H new ATOM 0 HB1 ALA A 89 2.350 -10.579 -7.219 1.00 0.31 H new ATOM 0 HB2 ALA A 89 3.569 -10.167 -8.449 1.00 0.31 H new ATOM 0 HB3 ALA A 89 3.748 -11.650 -7.481 1.00 0.31 H new ATOM 1358 N LEU A 90 3.375 -9.482 -4.198 1.00 0.27 N ATOM 1359 CA LEU A 90 3.044 -9.760 -2.806 1.00 0.30 C ATOM 1360 C LEU A 90 1.535 -9.574 -2.639 1.00 0.29 C ATOM 1361 O LEU A 90 0.865 -9.184 -3.594 1.00 0.32 O ATOM 1362 CB LEU A 90 3.856 -8.803 -1.911 1.00 0.35 C ATOM 1363 CG LEU A 90 3.707 -8.964 -0.394 1.00 0.40 C ATOM 1364 CD1 LEU A 90 5.063 -8.829 0.275 1.00 0.77 C ATOM 1365 CD2 LEU A 90 2.760 -7.913 0.164 1.00 0.72 C ATOM 0 H LEU A 90 3.138 -8.533 -4.487 1.00 0.27 H new ATOM 0 HA LEU A 90 3.298 -10.780 -2.516 1.00 0.30 H new ATOM 0 HB2 LEU A 90 4.910 -8.921 -2.161 1.00 0.35 H new ATOM 0 HB3 LEU A 90 3.579 -7.781 -2.171 1.00 0.35 H new ATOM 0 HG LEU A 90 3.296 -9.953 -0.191 1.00 0.40 H new ATOM 0 HD11 LEU A 90 4.950 -8.944 1.353 1.00 0.77 H new ATOM 0 HD12 LEU A 90 5.734 -9.600 -0.104 1.00 0.77 H new ATOM 0 HD13 LEU A 90 5.480 -7.846 0.057 1.00 0.77 H new ATOM 0 HD21 LEU A 90 2.667 -8.043 1.242 1.00 0.72 H new ATOM 0 HD22 LEU A 90 3.153 -6.919 -0.049 1.00 0.72 H new ATOM 0 HD23 LEU A 90 1.780 -8.023 -0.301 1.00 0.72 H new ATOM 1377 N ASP A 91 0.983 -9.858 -1.466 1.00 0.35 N ATOM 1378 CA ASP A 91 -0.461 -9.746 -1.285 1.00 0.43 C ATOM 1379 C ASP A 91 -0.815 -9.077 0.036 1.00 0.43 C ATOM 1380 O ASP A 91 -0.147 -9.281 1.052 1.00 0.52 O ATOM 1381 CB ASP A 91 -1.133 -11.123 -1.305 1.00 0.63 C ATOM 1382 CG ASP A 91 -0.802 -11.956 -2.522 1.00 1.07 C ATOM 1383 OD1 ASP A 91 -1.452 -11.783 -3.574 1.00 1.67 O ATOM 1384 OD2 ASP A 91 0.093 -12.820 -2.416 1.00 1.81 O ATOM 0 H ASP A 91 1.499 -10.162 -0.640 1.00 0.35 H new ATOM 0 HA ASP A 91 -0.822 -9.138 -2.114 1.00 0.43 H new ATOM 0 HB2 ASP A 91 -0.837 -11.672 -0.411 1.00 0.63 H new ATOM 0 HB3 ASP A 91 -2.213 -10.988 -1.254 1.00 0.63 H new ATOM 1389 N ILE A 92 -1.865 -8.275 0.003 1.00 0.39 N ATOM 1390 CA ILE A 92 -2.528 -7.802 1.205 1.00 0.38 C ATOM 1391 C ILE A 92 -3.922 -8.416 1.221 1.00 0.38 C ATOM 1392 O ILE A 92 -4.611 -8.372 0.202 1.00 0.54 O ATOM 1393 CB ILE A 92 -2.632 -6.256 1.250 1.00 0.43 C ATOM 1394 CG1 ILE A 92 -1.242 -5.613 1.180 1.00 0.52 C ATOM 1395 CG2 ILE A 92 -3.367 -5.789 2.502 1.00 0.52 C ATOM 1396 CD1 ILE A 92 -0.276 -6.114 2.236 1.00 0.65 C ATOM 0 H ILE A 92 -2.283 -7.932 -0.862 1.00 0.39 H new ATOM 0 HA ILE A 92 -1.946 -8.099 2.078 1.00 0.38 H new ATOM 0 HB ILE A 92 -3.206 -5.939 0.379 1.00 0.43 H new ATOM 0 HG12 ILE A 92 -0.816 -5.800 0.194 1.00 0.52 H new ATOM 0 HG13 ILE A 92 -1.347 -4.533 1.282 1.00 0.52 H new ATOM 0 HG21 ILE A 92 -3.424 -4.701 2.506 1.00 0.52 H new ATOM 0 HG22 ILE A 92 -4.374 -6.205 2.509 1.00 0.52 H new ATOM 0 HG23 ILE A 92 -2.828 -6.127 3.387 1.00 0.52 H new ATOM 0 HD11 ILE A 92 0.684 -5.611 2.119 1.00 0.65 H new ATOM 0 HD12 ILE A 92 -0.678 -5.902 3.227 1.00 0.65 H new ATOM 0 HD13 ILE A 92 -0.138 -7.189 2.122 1.00 0.65 H new ATOM 1408 N PRO A 93 -4.332 -9.030 2.347 1.00 0.41 N ATOM 1409 CA PRO A 93 -5.582 -9.804 2.438 1.00 0.55 C ATOM 1410 C PRO A 93 -6.821 -9.068 1.915 1.00 0.61 C ATOM 1411 O PRO A 93 -7.054 -9.039 0.713 1.00 1.07 O ATOM 1412 CB PRO A 93 -5.700 -10.115 3.933 1.00 0.67 C ATOM 1413 CG PRO A 93 -4.298 -10.084 4.431 1.00 0.70 C ATOM 1414 CD PRO A 93 -3.599 -9.028 3.624 1.00 0.52 C ATOM 0 HA PRO A 93 -5.542 -10.690 1.805 1.00 0.55 H new ATOM 0 HB2 PRO A 93 -6.319 -9.378 4.444 1.00 0.67 H new ATOM 0 HB3 PRO A 93 -6.160 -11.089 4.101 1.00 0.67 H new ATOM 0 HG2 PRO A 93 -4.266 -9.848 5.495 1.00 0.70 H new ATOM 0 HG3 PRO A 93 -3.817 -11.054 4.305 1.00 0.70 H new ATOM 0 HD2 PRO A 93 -3.645 -8.054 4.112 1.00 0.52 H new ATOM 0 HD3 PRO A 93 -2.544 -9.264 3.482 1.00 0.52 H new ATOM 1422 N VAL A 94 -7.624 -8.489 2.806 1.00 0.38 N ATOM 1423 CA VAL A 94 -8.871 -7.841 2.398 1.00 0.34 C ATOM 1424 C VAL A 94 -9.402 -6.917 3.492 1.00 0.34 C ATOM 1425 O VAL A 94 -10.230 -7.332 4.284 1.00 0.36 O ATOM 1426 CB VAL A 94 -9.972 -8.893 2.091 1.00 0.36 C ATOM 1427 CG1 VAL A 94 -9.993 -9.281 0.624 1.00 0.42 C ATOM 1428 CG2 VAL A 94 -9.788 -10.137 2.954 1.00 0.46 C ATOM 0 H VAL A 94 -7.436 -8.455 3.808 1.00 0.38 H new ATOM 0 HA VAL A 94 -8.642 -7.263 1.503 1.00 0.34 H new ATOM 0 HB VAL A 94 -10.930 -8.430 2.330 1.00 0.36 H new ATOM 0 HG11 VAL A 94 -10.777 -10.018 0.454 1.00 0.42 H new ATOM 0 HG12 VAL A 94 -10.188 -8.397 0.017 1.00 0.42 H new ATOM 0 HG13 VAL A 94 -9.029 -9.707 0.346 1.00 0.42 H new ATOM 0 HG21 VAL A 94 -10.570 -10.860 2.722 1.00 0.46 H new ATOM 0 HG22 VAL A 94 -8.813 -10.580 2.751 1.00 0.46 H new ATOM 0 HG23 VAL A 94 -9.849 -9.862 4.007 1.00 0.46 H new ATOM 1438 N VAL A 95 -9.037 -5.642 3.473 1.00 0.35 N ATOM 1439 CA VAL A 95 -9.350 -4.786 4.617 1.00 0.35 C ATOM 1440 C VAL A 95 -10.084 -3.493 4.248 1.00 0.36 C ATOM 1441 O VAL A 95 -9.496 -2.562 3.697 1.00 0.44 O ATOM 1442 CB VAL A 95 -8.064 -4.435 5.408 1.00 0.42 C ATOM 1443 CG1 VAL A 95 -7.041 -3.743 4.514 1.00 0.48 C ATOM 1444 CG2 VAL A 95 -8.392 -3.572 6.618 1.00 0.45 C ATOM 0 H VAL A 95 -8.540 -5.186 2.708 1.00 0.35 H new ATOM 0 HA VAL A 95 -10.031 -5.371 5.235 1.00 0.35 H new ATOM 0 HB VAL A 95 -7.625 -5.368 5.762 1.00 0.42 H new ATOM 0 HG11 VAL A 95 -6.149 -3.509 5.095 1.00 0.48 H new ATOM 0 HG12 VAL A 95 -6.773 -4.403 3.689 1.00 0.48 H new ATOM 0 HG13 VAL A 95 -7.468 -2.822 4.118 1.00 0.48 H new ATOM 0 HG21 VAL A 95 -7.474 -3.338 7.158 1.00 0.45 H new ATOM 0 HG22 VAL A 95 -8.864 -2.647 6.288 1.00 0.45 H new ATOM 0 HG23 VAL A 95 -9.073 -4.112 7.276 1.00 0.45 H new ATOM 1454 N VAL A 96 -11.390 -3.458 4.492 1.00 0.34 N ATOM 1455 CA VAL A 96 -12.094 -2.191 4.583 1.00 0.34 C ATOM 1456 C VAL A 96 -13.354 -2.310 5.448 1.00 0.36 C ATOM 1457 O VAL A 96 -14.384 -2.799 4.989 1.00 0.47 O ATOM 1458 CB VAL A 96 -12.419 -1.586 3.205 1.00 0.45 C ATOM 1459 CG1 VAL A 96 -13.056 -2.599 2.274 1.00 1.02 C ATOM 1460 CG2 VAL A 96 -13.304 -0.376 3.384 1.00 1.07 C ATOM 0 H VAL A 96 -11.974 -4.283 4.628 1.00 0.34 H new ATOM 0 HA VAL A 96 -11.411 -1.497 5.073 1.00 0.34 H new ATOM 0 HB VAL A 96 -11.484 -1.281 2.735 1.00 0.45 H new ATOM 0 HG11 VAL A 96 -13.268 -2.128 1.314 1.00 1.02 H new ATOM 0 HG12 VAL A 96 -12.374 -3.436 2.125 1.00 1.02 H new ATOM 0 HG13 VAL A 96 -13.985 -2.962 2.713 1.00 1.02 H new ATOM 0 HG21 VAL A 96 -13.535 0.053 2.409 1.00 1.07 H new ATOM 0 HG22 VAL A 96 -14.229 -0.672 3.878 1.00 1.07 H new ATOM 0 HG23 VAL A 96 -12.788 0.365 3.994 1.00 1.07 H new ATOM 1470 N PRO A 97 -13.293 -1.891 6.719 1.00 0.34 N ATOM 1471 CA PRO A 97 -14.451 -1.939 7.612 1.00 0.36 C ATOM 1472 C PRO A 97 -15.701 -1.319 6.984 1.00 0.33 C ATOM 1473 O PRO A 97 -15.634 -0.273 6.338 1.00 0.34 O ATOM 1474 CB PRO A 97 -14.009 -1.148 8.852 1.00 0.41 C ATOM 1475 CG PRO A 97 -12.697 -0.524 8.500 1.00 0.48 C ATOM 1476 CD PRO A 97 -12.107 -1.352 7.392 1.00 0.36 C ATOM 0 HA PRO A 97 -14.734 -2.966 7.842 1.00 0.36 H new ATOM 0 HB2 PRO A 97 -14.745 -0.387 9.112 1.00 0.41 H new ATOM 0 HB3 PRO A 97 -13.909 -1.803 9.717 1.00 0.41 H new ATOM 0 HG2 PRO A 97 -12.833 0.509 8.180 1.00 0.48 H new ATOM 0 HG3 PRO A 97 -12.033 -0.505 9.364 1.00 0.48 H new ATOM 0 HD2 PRO A 97 -11.499 -0.750 6.717 1.00 0.36 H new ATOM 0 HD3 PRO A 97 -11.466 -2.145 7.777 1.00 0.36 H new ATOM 1484 N TYR A 98 -16.838 -1.984 7.180 1.00 0.35 N ATOM 1485 CA TYR A 98 -18.114 -1.558 6.599 1.00 0.37 C ATOM 1486 C TYR A 98 -18.430 -0.102 6.949 1.00 0.36 C ATOM 1487 O TYR A 98 -19.032 0.620 6.154 1.00 0.39 O ATOM 1488 CB TYR A 98 -19.236 -2.492 7.078 1.00 0.47 C ATOM 1489 CG TYR A 98 -20.632 -1.932 6.900 1.00 0.60 C ATOM 1490 CD1 TYR A 98 -21.161 -1.700 5.638 1.00 1.04 C ATOM 1491 CD2 TYR A 98 -21.422 -1.636 8.005 1.00 0.90 C ATOM 1492 CE1 TYR A 98 -22.436 -1.188 5.482 1.00 1.23 C ATOM 1493 CE2 TYR A 98 -22.695 -1.125 7.855 1.00 1.06 C ATOM 1494 CZ TYR A 98 -23.197 -0.902 6.594 1.00 1.08 C ATOM 1495 OH TYR A 98 -24.465 -0.389 6.446 1.00 1.31 O ATOM 0 H TYR A 98 -16.903 -2.831 7.744 1.00 0.35 H new ATOM 0 HA TYR A 98 -18.038 -1.619 5.513 1.00 0.37 H new ATOM 0 HB2 TYR A 98 -19.164 -3.435 6.536 1.00 0.47 H new ATOM 0 HB3 TYR A 98 -19.079 -2.718 8.133 1.00 0.47 H new ATOM 0 HD1 TYR A 98 -20.567 -1.923 4.764 1.00 1.04 H new ATOM 0 HD2 TYR A 98 -21.033 -1.809 8.998 1.00 0.90 H new ATOM 0 HE1 TYR A 98 -22.833 -1.013 4.493 1.00 1.23 H new ATOM 0 HE2 TYR A 98 -23.295 -0.901 8.725 1.00 1.06 H new ATOM 0 HH TYR A 98 -24.865 -0.245 7.329 1.00 1.31 H new ATOM 1505 N SER A 99 -17.988 0.319 8.123 1.00 0.37 N ATOM 1506 CA SER A 99 -18.176 1.684 8.589 1.00 0.41 C ATOM 1507 C SER A 99 -17.671 2.708 7.572 1.00 0.38 C ATOM 1508 O SER A 99 -18.217 3.800 7.441 1.00 0.39 O ATOM 1509 CB SER A 99 -17.419 1.855 9.901 1.00 0.50 C ATOM 1510 OG SER A 99 -17.899 0.953 10.883 1.00 1.20 O ATOM 0 H SER A 99 -17.487 -0.278 8.782 1.00 0.37 H new ATOM 0 HA SER A 99 -19.243 1.859 8.728 1.00 0.41 H new ATOM 0 HB2 SER A 99 -16.355 1.687 9.736 1.00 0.50 H new ATOM 0 HB3 SER A 99 -17.528 2.879 10.258 1.00 0.50 H new ATOM 0 HG SER A 99 -17.398 1.079 11.716 1.00 1.20 H new ATOM 1516 N ILE A 100 -16.647 2.333 6.837 1.00 0.36 N ATOM 1517 CA ILE A 100 -15.981 3.254 5.938 1.00 0.37 C ATOM 1518 C ILE A 100 -16.792 3.486 4.680 1.00 0.34 C ATOM 1519 O ILE A 100 -17.123 4.620 4.318 1.00 0.36 O ATOM 1520 CB ILE A 100 -14.639 2.668 5.511 1.00 0.41 C ATOM 1521 CG1 ILE A 100 -13.838 2.222 6.736 1.00 0.45 C ATOM 1522 CG2 ILE A 100 -13.882 3.690 4.709 1.00 0.48 C ATOM 1523 CD1 ILE A 100 -13.579 3.325 7.737 1.00 0.51 C ATOM 0 H ILE A 100 -16.255 1.392 6.844 1.00 0.36 H new ATOM 0 HA ILE A 100 -15.856 4.196 6.471 1.00 0.37 H new ATOM 0 HB ILE A 100 -14.806 1.789 4.888 1.00 0.41 H new ATOM 0 HG12 ILE A 100 -14.374 1.413 7.233 1.00 0.45 H new ATOM 0 HG13 ILE A 100 -12.883 1.815 6.404 1.00 0.45 H new ATOM 0 HG21 ILE A 100 -12.922 3.274 4.402 1.00 0.48 H new ATOM 0 HG22 ILE A 100 -14.460 3.959 3.825 1.00 0.48 H new ATOM 0 HG23 ILE A 100 -13.714 4.579 5.318 1.00 0.48 H new ATOM 0 HD11 ILE A 100 -13.006 2.928 8.575 1.00 0.51 H new ATOM 0 HD12 ILE A 100 -13.015 4.126 7.258 1.00 0.51 H new ATOM 0 HD13 ILE A 100 -14.529 3.717 8.100 1.00 0.51 H new ATOM 1535 N LEU A 101 -17.064 2.379 4.022 1.00 0.33 N ATOM 1536 CA LEU A 101 -17.914 2.328 2.836 1.00 0.34 C ATOM 1537 C LEU A 101 -19.262 2.956 3.113 1.00 0.34 C ATOM 1538 O LEU A 101 -19.913 3.494 2.229 1.00 0.36 O ATOM 1539 CB LEU A 101 -18.060 0.898 2.368 1.00 0.35 C ATOM 1540 CG LEU A 101 -16.974 0.457 1.395 1.00 0.41 C ATOM 1541 CD1 LEU A 101 -17.282 0.940 -0.007 1.00 0.89 C ATOM 1542 CD2 LEU A 101 -15.622 0.984 1.809 1.00 1.00 C ATOM 0 H LEU A 101 -16.697 1.468 4.296 1.00 0.33 H new ATOM 0 HA LEU A 101 -17.443 2.904 2.039 1.00 0.34 H new ATOM 0 HB2 LEU A 101 -18.048 0.238 3.236 1.00 0.35 H new ATOM 0 HB3 LEU A 101 -19.033 0.779 1.891 1.00 0.35 H new ATOM 0 HG LEU A 101 -16.951 -0.633 1.409 1.00 0.41 H new ATOM 0 HD11 LEU A 101 -16.494 0.614 -0.686 1.00 0.89 H new ATOM 0 HD12 LEU A 101 -18.236 0.526 -0.333 1.00 0.89 H new ATOM 0 HD13 LEU A 101 -17.338 2.029 -0.013 1.00 0.89 H new ATOM 0 HD21 LEU A 101 -14.868 0.652 1.095 1.00 1.00 H new ATOM 0 HD22 LEU A 101 -15.647 2.073 1.830 1.00 1.00 H new ATOM 0 HD23 LEU A 101 -15.373 0.607 2.801 1.00 1.00 H new ATOM 1554 N PHE A 102 -19.629 2.911 4.373 1.00 0.34 N ATOM 1555 CA PHE A 102 -20.861 3.515 4.822 1.00 0.36 C ATOM 1556 C PHE A 102 -20.766 5.018 4.617 1.00 0.35 C ATOM 1557 O PHE A 102 -21.663 5.638 4.068 1.00 0.36 O ATOM 1558 CB PHE A 102 -21.134 3.181 6.293 1.00 0.42 C ATOM 1559 CG PHE A 102 -22.353 3.859 6.851 1.00 0.57 C ATOM 1560 CD1 PHE A 102 -23.611 3.301 6.687 1.00 0.74 C ATOM 1561 CD2 PHE A 102 -22.240 5.059 7.539 1.00 0.80 C ATOM 1562 CE1 PHE A 102 -24.733 3.926 7.199 1.00 0.90 C ATOM 1563 CE2 PHE A 102 -23.358 5.687 8.052 1.00 0.96 C ATOM 1564 CZ PHE A 102 -24.606 5.120 7.882 1.00 0.94 C ATOM 0 H PHE A 102 -19.087 2.459 5.109 1.00 0.34 H new ATOM 0 HA PHE A 102 -21.694 3.117 4.242 1.00 0.36 H new ATOM 0 HB2 PHE A 102 -21.250 2.102 6.396 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -20.266 3.466 6.888 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -23.716 2.368 6.153 1.00 0.74 H new ATOM 0 HD2 PHE A 102 -21.267 5.507 7.675 1.00 0.80 H new ATOM 0 HE1 PHE A 102 -25.708 3.481 7.065 1.00 0.90 H new ATOM 0 HE2 PHE A 102 -23.257 6.621 8.586 1.00 0.96 H new ATOM 0 HZ PHE A 102 -25.481 5.610 8.283 1.00 0.94 H new ATOM 1574 N ASN A 103 -19.636 5.581 5.013 1.00 0.36 N ATOM 1575 CA ASN A 103 -19.413 7.014 4.912 1.00 0.38 C ATOM 1576 C ASN A 103 -19.183 7.453 3.463 1.00 0.36 C ATOM 1577 O ASN A 103 -19.888 8.328 2.959 1.00 0.38 O ATOM 1578 CB ASN A 103 -18.204 7.407 5.757 1.00 0.43 C ATOM 1579 CG ASN A 103 -18.512 7.530 7.239 1.00 0.49 C ATOM 1580 OD1 ASN A 103 -18.856 8.605 7.723 1.00 0.82 O ATOM 1581 ND2 ASN A 103 -18.387 6.439 7.973 1.00 0.49 N ATOM 0 H ASN A 103 -18.853 5.062 5.411 1.00 0.36 H new ATOM 0 HA ASN A 103 -20.309 7.515 5.279 1.00 0.38 H new ATOM 0 HB2 ASN A 103 -17.418 6.665 5.618 1.00 0.43 H new ATOM 0 HB3 ASN A 103 -17.812 8.358 5.396 1.00 0.43 H new ATOM 0 HD21 ASN A 103 -18.578 6.473 8.974 1.00 0.49 H new ATOM 0 HD22 ASN A 103 -18.099 5.562 7.538 1.00 0.49 H new ATOM 1588 N LEU A 104 -18.182 6.862 2.806 1.00 0.36 N ATOM 1589 CA LEU A 104 -17.834 7.234 1.431 1.00 0.39 C ATOM 1590 C LEU A 104 -18.976 6.998 0.436 1.00 0.37 C ATOM 1591 O LEU A 104 -19.345 7.910 -0.292 1.00 0.40 O ATOM 1592 CB LEU A 104 -16.573 6.490 0.985 1.00 0.45 C ATOM 1593 CG LEU A 104 -16.686 4.969 0.956 1.00 0.51 C ATOM 1594 CD1 LEU A 104 -16.864 4.467 -0.469 1.00 0.55 C ATOM 1595 CD2 LEU A 104 -15.471 4.344 1.600 1.00 0.65 C ATOM 0 H LEU A 104 -17.599 6.125 3.202 1.00 0.36 H new ATOM 0 HA LEU A 104 -17.644 8.307 1.434 1.00 0.39 H new ATOM 0 HB2 LEU A 104 -16.301 6.836 -0.012 1.00 0.45 H new ATOM 0 HB3 LEU A 104 -15.755 6.764 1.652 1.00 0.45 H new ATOM 0 HG LEU A 104 -17.568 4.676 1.525 1.00 0.51 H new ATOM 0 HD11 LEU A 104 -16.942 3.380 -0.465 1.00 0.55 H new ATOM 0 HD12 LEU A 104 -17.772 4.894 -0.895 1.00 0.55 H new ATOM 0 HD13 LEU A 104 -16.006 4.767 -1.070 1.00 0.55 H new ATOM 0 HD21 LEU A 104 -15.563 3.258 1.573 1.00 0.65 H new ATOM 0 HD22 LEU A 104 -14.576 4.646 1.057 1.00 0.65 H new ATOM 0 HD23 LEU A 104 -15.396 4.677 2.635 1.00 0.65 H new ATOM 1607 N ALA A 105 -19.534 5.790 0.408 1.00 0.35 N ATOM 1608 CA ALA A 105 -20.592 5.452 -0.549 1.00 0.38 C ATOM 1609 C ALA A 105 -21.838 6.266 -0.266 1.00 0.37 C ATOM 1610 O ALA A 105 -22.660 6.510 -1.136 1.00 0.39 O ATOM 1611 CB ALA A 105 -20.912 3.976 -0.490 1.00 0.43 C ATOM 0 H ALA A 105 -19.274 5.028 1.034 1.00 0.35 H new ATOM 0 HA ALA A 105 -20.236 5.690 -1.551 1.00 0.38 H new ATOM 0 HB1 ALA A 105 -21.699 3.745 -1.208 1.00 0.43 H new ATOM 0 HB2 ALA A 105 -20.019 3.400 -0.734 1.00 0.43 H new ATOM 0 HB3 ALA A 105 -21.249 3.716 0.514 1.00 0.43 H new ATOM 1617 N ARG A 106 -21.956 6.670 0.970 1.00 0.36 N ATOM 1618 CA ARG A 106 -23.038 7.547 1.354 1.00 0.40 C ATOM 1619 C ARG A 106 -22.892 8.898 0.655 1.00 0.38 C ATOM 1620 O ARG A 106 -23.814 9.367 0.005 1.00 0.40 O ATOM 1621 CB ARG A 106 -23.069 7.727 2.856 1.00 0.48 C ATOM 1622 CG ARG A 106 -23.918 8.885 3.320 1.00 0.53 C ATOM 1623 CD ARG A 106 -23.538 9.260 4.731 1.00 0.73 C ATOM 1624 NE ARG A 106 -22.087 9.376 4.841 1.00 0.91 N ATOM 1625 CZ ARG A 106 -21.459 10.075 5.776 1.00 1.38 C ATOM 1626 NH1 ARG A 106 -22.144 10.654 6.754 1.00 1.52 N ATOM 1627 NH2 ARG A 106 -20.141 10.177 5.736 1.00 1.81 N ATOM 0 H ARG A 106 -21.323 6.410 1.727 1.00 0.36 H new ATOM 0 HA ARG A 106 -23.980 7.094 1.046 1.00 0.40 H new ATOM 0 HB2 ARG A 106 -23.442 6.811 3.313 1.00 0.48 H new ATOM 0 HB3 ARG A 106 -22.050 7.871 3.215 1.00 0.48 H new ATOM 0 HG2 ARG A 106 -23.780 9.739 2.657 1.00 0.53 H new ATOM 0 HG3 ARG A 106 -24.973 8.615 3.277 1.00 0.53 H new ATOM 0 HD2 ARG A 106 -24.009 10.204 5.005 1.00 0.73 H new ATOM 0 HD3 ARG A 106 -23.905 8.507 5.428 1.00 0.73 H new ATOM 0 HE ARG A 106 -21.517 8.886 4.151 1.00 0.91 H new ATOM 0 HH11 ARG A 106 -23.159 10.562 6.789 1.00 1.52 H new ATOM 0 HH12 ARG A 106 -21.655 11.191 7.471 1.00 1.52 H new ATOM 0 HH21 ARG A 106 -19.617 9.720 4.990 1.00 1.81 H new ATOM 0 HH22 ARG A 106 -19.649 10.713 6.451 1.00 1.81 H new ATOM 1641 N ASP A 107 -21.719 9.507 0.772 1.00 0.37 N ATOM 1642 CA ASP A 107 -21.505 10.849 0.231 1.00 0.41 C ATOM 1643 C ASP A 107 -21.174 10.828 -1.263 1.00 0.38 C ATOM 1644 O ASP A 107 -21.823 11.491 -2.078 1.00 0.41 O ATOM 1645 CB ASP A 107 -20.369 11.528 0.989 1.00 0.46 C ATOM 1646 CG ASP A 107 -20.160 12.965 0.559 1.00 0.57 C ATOM 1647 OD1 ASP A 107 -20.918 13.839 1.026 1.00 0.80 O ATOM 1648 OD2 ASP A 107 -19.226 13.225 -0.226 1.00 0.68 O ATOM 0 H ASP A 107 -20.905 9.100 1.232 1.00 0.37 H new ATOM 0 HA ASP A 107 -22.435 11.404 0.356 1.00 0.41 H new ATOM 0 HB2 ASP A 107 -20.582 11.500 2.058 1.00 0.46 H new ATOM 0 HB3 ASP A 107 -19.447 10.968 0.833 1.00 0.46 H new ATOM 1653 N VAL A 108 -20.182 10.047 -1.639 1.00 0.34 N ATOM 1654 CA VAL A 108 -19.743 10.032 -3.019 1.00 0.33 C ATOM 1655 C VAL A 108 -20.596 9.061 -3.828 1.00 0.32 C ATOM 1656 O VAL A 108 -20.755 9.218 -5.029 1.00 0.37 O ATOM 1657 CB VAL A 108 -18.253 9.659 -3.153 1.00 0.32 C ATOM 1658 CG1 VAL A 108 -17.732 10.058 -4.522 1.00 0.77 C ATOM 1659 CG2 VAL A 108 -17.417 10.308 -2.059 1.00 0.88 C ATOM 0 H VAL A 108 -19.670 9.421 -1.017 1.00 0.34 H new ATOM 0 HA VAL A 108 -19.864 11.043 -3.409 1.00 0.33 H new ATOM 0 HB VAL A 108 -18.167 8.578 -3.041 1.00 0.32 H new ATOM 0 HG11 VAL A 108 -16.679 9.789 -4.603 1.00 0.77 H new ATOM 0 HG12 VAL A 108 -18.300 9.538 -5.293 1.00 0.77 H new ATOM 0 HG13 VAL A 108 -17.843 11.134 -4.654 1.00 0.77 H new ATOM 0 HG21 VAL A 108 -16.372 10.024 -2.183 1.00 0.88 H new ATOM 0 HG22 VAL A 108 -17.509 11.392 -2.126 1.00 0.88 H new ATOM 0 HG23 VAL A 108 -17.771 9.973 -1.084 1.00 0.88 H new ATOM 1669 N GLY A 109 -21.113 8.036 -3.160 1.00 0.29 N ATOM 1670 CA GLY A 109 -22.094 7.160 -3.785 1.00 0.30 C ATOM 1671 C GLY A 109 -23.440 7.840 -3.918 1.00 0.33 C ATOM 1672 O GLY A 109 -24.293 7.417 -4.695 1.00 0.38 O ATOM 0 H GLY A 109 -20.873 7.794 -2.199 1.00 0.29 H new ATOM 0 HA2 GLY A 109 -21.739 6.858 -4.770 1.00 0.30 H new ATOM 0 HA3 GLY A 109 -22.201 6.251 -3.193 1.00 0.30 H new ATOM 1676 N VAL A 110 -23.622 8.871 -3.101 1.00 0.37 N ATOM 1677 CA VAL A 110 -24.709 9.818 -3.317 1.00 0.46 C ATOM 1678 C VAL A 110 -24.652 10.238 -4.784 1.00 0.47 C ATOM 1679 O VAL A 110 -25.668 10.263 -5.481 1.00 0.54 O ATOM 1680 CB VAL A 110 -24.639 11.049 -2.372 1.00 0.56 C ATOM 1681 CG1 VAL A 110 -24.588 12.367 -3.134 1.00 1.09 C ATOM 1682 CG2 VAL A 110 -25.821 11.045 -1.414 1.00 0.78 C ATOM 0 H VAL A 110 -23.037 9.071 -2.290 1.00 0.37 H new ATOM 0 HA VAL A 110 -25.659 9.338 -3.083 1.00 0.46 H new ATOM 0 HB VAL A 110 -23.710 10.966 -1.808 1.00 0.56 H new ATOM 0 HG11 VAL A 110 -24.540 13.195 -2.426 1.00 1.09 H new ATOM 0 HG12 VAL A 110 -23.705 12.384 -3.773 1.00 1.09 H new ATOM 0 HG13 VAL A 110 -25.483 12.467 -3.749 1.00 1.09 H new ATOM 0 HG21 VAL A 110 -25.760 11.913 -0.757 1.00 0.78 H new ATOM 0 HG22 VAL A 110 -26.750 11.085 -1.982 1.00 0.78 H new ATOM 0 HG23 VAL A 110 -25.801 10.135 -0.815 1.00 0.78 H new ATOM 1692 N ASP A 111 -23.443 10.575 -5.238 1.00 0.45 N ATOM 1693 CA ASP A 111 -23.158 10.638 -6.672 1.00 0.52 C ATOM 1694 C ASP A 111 -23.231 9.232 -7.277 1.00 0.59 C ATOM 1695 O ASP A 111 -24.295 8.806 -7.727 1.00 1.05 O ATOM 1696 CB ASP A 111 -21.776 11.259 -6.939 1.00 0.60 C ATOM 1697 CG ASP A 111 -21.672 12.696 -6.474 1.00 1.30 C ATOM 1698 OD1 ASP A 111 -21.803 12.946 -5.259 1.00 1.87 O ATOM 1699 OD2 ASP A 111 -21.453 13.590 -7.320 1.00 1.86 O ATOM 0 H ASP A 111 -22.651 10.807 -4.638 1.00 0.45 H new ATOM 0 HA ASP A 111 -23.908 11.274 -7.142 1.00 0.52 H new ATOM 0 HB2 ASP A 111 -21.014 10.664 -6.436 1.00 0.60 H new ATOM 0 HB3 ASP A 111 -21.563 11.212 -8.007 1.00 0.60 H new ATOM 1704 N TRP A 112 -22.093 8.532 -7.285 1.00 0.43 N ATOM 1705 CA TRP A 112 -22.031 7.111 -7.659 1.00 0.45 C ATOM 1706 C TRP A 112 -20.590 6.580 -7.621 1.00 0.42 C ATOM 1707 O TRP A 112 -20.306 5.591 -6.954 1.00 0.43 O ATOM 1708 CB TRP A 112 -22.656 6.840 -9.047 1.00 0.57 C ATOM 1709 CG TRP A 112 -21.947 7.482 -10.201 1.00 0.64 C ATOM 1710 CD1 TRP A 112 -21.853 8.813 -10.496 1.00 0.72 C ATOM 1711 CD2 TRP A 112 -21.238 6.794 -11.225 1.00 0.78 C ATOM 1712 NE1 TRP A 112 -21.110 8.985 -11.639 1.00 0.83 N ATOM 1713 CE2 TRP A 112 -20.719 7.756 -12.104 1.00 0.86 C ATOM 1714 CE3 TRP A 112 -20.989 5.448 -11.468 1.00 0.96 C ATOM 1715 CZ2 TRP A 112 -19.962 7.409 -13.222 1.00 1.04 C ATOM 1716 CZ3 TRP A 112 -20.239 5.097 -12.574 1.00 1.16 C ATOM 1717 CH2 TRP A 112 -19.730 6.077 -13.441 1.00 1.17 C ATOM 0 H TRP A 112 -21.189 8.931 -7.033 1.00 0.43 H new ATOM 0 HA TRP A 112 -22.622 6.576 -6.916 1.00 0.45 H new ATOM 0 HB2 TRP A 112 -22.683 5.763 -9.212 1.00 0.57 H new ATOM 0 HB3 TRP A 112 -23.689 7.187 -9.037 1.00 0.57 H new ATOM 0 HD1 TRP A 112 -22.296 9.610 -9.918 1.00 0.72 H new ATOM 0 HE1 TRP A 112 -20.886 9.881 -12.071 1.00 0.83 H new ATOM 0 HE3 TRP A 112 -21.375 4.689 -10.803 1.00 0.96 H new ATOM 0 HZ2 TRP A 112 -19.573 8.163 -13.891 1.00 1.04 H new ATOM 0 HZ3 TRP A 112 -20.042 4.054 -12.774 1.00 1.16 H new ATOM 0 HH2 TRP A 112 -19.144 5.775 -14.297 1.00 1.17 H new ATOM 1728 N ASP A 113 -19.689 7.237 -8.338 1.00 0.42 N ATOM 1729 CA ASP A 113 -18.303 6.772 -8.410 1.00 0.42 C ATOM 1730 C ASP A 113 -17.435 7.475 -7.374 1.00 0.40 C ATOM 1731 O ASP A 113 -17.434 8.703 -7.270 1.00 0.50 O ATOM 1732 CB ASP A 113 -17.725 6.945 -9.825 1.00 0.51 C ATOM 1733 CG ASP A 113 -17.400 8.379 -10.194 1.00 1.26 C ATOM 1734 OD1 ASP A 113 -18.328 9.207 -10.295 1.00 2.15 O ATOM 1735 OD2 ASP A 113 -16.205 8.687 -10.400 1.00 1.61 O ATOM 0 H ASP A 113 -19.885 8.083 -8.873 1.00 0.42 H new ATOM 0 HA ASP A 113 -18.301 5.706 -8.182 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -16.819 6.346 -9.911 1.00 0.51 H new ATOM 0 HB3 ASP A 113 -18.439 6.549 -10.547 1.00 0.51 H new ATOM 1740 N ILE A 114 -16.701 6.678 -6.600 1.00 0.32 N ATOM 1741 CA ILE A 114 -15.923 7.199 -5.482 1.00 0.32 C ATOM 1742 C ILE A 114 -14.434 7.052 -5.764 1.00 0.32 C ATOM 1743 O ILE A 114 -14.019 6.200 -6.555 1.00 0.33 O ATOM 1744 CB ILE A 114 -16.258 6.496 -4.123 1.00 0.31 C ATOM 1745 CG1 ILE A 114 -17.768 6.315 -3.944 1.00 0.39 C ATOM 1746 CG2 ILE A 114 -15.690 7.283 -2.950 1.00 0.33 C ATOM 1747 CD1 ILE A 114 -18.297 5.052 -4.585 1.00 0.38 C ATOM 0 H ILE A 114 -16.630 5.669 -6.728 1.00 0.32 H new ATOM 0 HA ILE A 114 -16.192 8.251 -5.384 1.00 0.32 H new ATOM 0 HB ILE A 114 -15.794 5.510 -4.146 1.00 0.31 H new ATOM 0 HG12 ILE A 114 -18.002 6.300 -2.879 1.00 0.39 H new ATOM 0 HG13 ILE A 114 -18.284 7.175 -4.371 1.00 0.39 H new ATOM 0 HG21 ILE A 114 -15.936 6.775 -2.018 1.00 0.33 H new ATOM 0 HG22 ILE A 114 -14.607 7.354 -3.050 1.00 0.33 H new ATOM 0 HG23 ILE A 114 -16.120 8.285 -2.941 1.00 0.33 H new ATOM 0 HD11 ILE A 114 -19.373 4.984 -4.422 1.00 0.38 H new ATOM 0 HD12 ILE A 114 -18.093 5.074 -5.656 1.00 0.38 H new ATOM 0 HD13 ILE A 114 -17.807 4.186 -4.140 1.00 0.38 H new ATOM 1759 N ASP A 115 -13.644 7.887 -5.116 1.00 0.35 N ATOM 1760 CA ASP A 115 -12.201 7.852 -5.243 1.00 0.38 C ATOM 1761 C ASP A 115 -11.618 7.082 -4.071 1.00 0.34 C ATOM 1762 O ASP A 115 -12.250 6.983 -3.022 1.00 0.31 O ATOM 1763 CB ASP A 115 -11.626 9.273 -5.295 1.00 0.46 C ATOM 1764 CG ASP A 115 -11.926 10.089 -4.055 1.00 1.27 C ATOM 1765 OD1 ASP A 115 -13.116 10.395 -3.815 1.00 2.11 O ATOM 1766 OD2 ASP A 115 -10.969 10.470 -3.344 1.00 1.36 O ATOM 0 H ASP A 115 -13.987 8.611 -4.485 1.00 0.35 H new ATOM 0 HA ASP A 115 -11.934 7.352 -6.174 1.00 0.38 H new ATOM 0 HB2 ASP A 115 -10.546 9.215 -5.430 1.00 0.46 H new ATOM 0 HB3 ASP A 115 -12.029 9.789 -6.167 1.00 0.46 H new ATOM 1771 N TYR A 116 -10.451 6.486 -4.259 1.00 0.37 N ATOM 1772 CA TYR A 116 -9.796 5.719 -3.206 1.00 0.37 C ATOM 1773 C TYR A 116 -8.298 6.004 -3.255 1.00 0.40 C ATOM 1774 O TYR A 116 -7.820 6.560 -4.241 1.00 0.62 O ATOM 1775 CB TYR A 116 -10.032 4.212 -3.386 1.00 0.38 C ATOM 1776 CG TYR A 116 -11.473 3.770 -3.240 1.00 0.37 C ATOM 1777 CD1 TYR A 116 -12.389 3.961 -4.266 1.00 0.37 C ATOM 1778 CD2 TYR A 116 -11.914 3.150 -2.080 1.00 0.40 C ATOM 1779 CE1 TYR A 116 -13.701 3.551 -4.137 1.00 0.39 C ATOM 1780 CE2 TYR A 116 -13.227 2.735 -1.944 1.00 0.42 C ATOM 1781 CZ TYR A 116 -14.114 2.939 -2.976 1.00 0.41 C ATOM 1782 OH TYR A 116 -15.421 2.530 -2.846 1.00 0.45 O ATOM 0 H TYR A 116 -9.933 6.518 -5.137 1.00 0.37 H new ATOM 0 HA TYR A 116 -10.214 6.015 -2.244 1.00 0.37 H new ATOM 0 HB2 TYR A 116 -9.676 3.919 -4.373 1.00 0.38 H new ATOM 0 HB3 TYR A 116 -9.427 3.675 -2.656 1.00 0.38 H new ATOM 0 HD1 TYR A 116 -12.070 4.438 -5.181 1.00 0.37 H new ATOM 0 HD2 TYR A 116 -11.220 2.988 -1.268 1.00 0.40 H new ATOM 0 HE1 TYR A 116 -14.400 3.710 -4.944 1.00 0.39 H new ATOM 0 HE2 TYR A 116 -13.553 2.254 -1.034 1.00 0.42 H new ATOM 0 HH TYR A 116 -15.548 2.116 -1.967 1.00 0.45 H new ATOM 1792 N GLU A 117 -7.561 5.629 -2.213 1.00 0.27 N ATOM 1793 CA GLU A 117 -6.118 5.812 -2.191 1.00 0.28 C ATOM 1794 C GLU A 117 -5.462 4.843 -1.218 1.00 0.28 C ATOM 1795 O GLU A 117 -5.960 4.624 -0.109 1.00 0.31 O ATOM 1796 CB GLU A 117 -5.745 7.240 -1.787 1.00 0.31 C ATOM 1797 CG GLU A 117 -4.243 7.479 -1.795 1.00 0.39 C ATOM 1798 CD GLU A 117 -3.841 8.772 -1.127 1.00 0.51 C ATOM 1799 OE1 GLU A 117 -4.124 9.848 -1.689 1.00 0.66 O ATOM 1800 OE2 GLU A 117 -3.219 8.709 -0.049 1.00 0.80 O ATOM 0 H GLU A 117 -7.943 5.196 -1.372 1.00 0.27 H new ATOM 0 HA GLU A 117 -5.757 5.618 -3.201 1.00 0.28 H new ATOM 0 HB2 GLU A 117 -6.224 7.943 -2.468 1.00 0.31 H new ATOM 0 HB3 GLU A 117 -6.136 7.445 -0.790 1.00 0.31 H new ATOM 0 HG2 GLU A 117 -3.747 6.649 -1.292 1.00 0.39 H new ATOM 0 HG3 GLU A 117 -3.888 7.485 -2.826 1.00 0.39 H new ATOM 1807 N LEU A 118 -4.351 4.268 -1.641 1.00 0.29 N ATOM 1808 CA LEU A 118 -3.522 3.451 -0.778 1.00 0.28 C ATOM 1809 C LEU A 118 -2.290 4.228 -0.354 1.00 0.28 C ATOM 1810 O LEU A 118 -1.633 4.860 -1.174 1.00 0.32 O ATOM 1811 CB LEU A 118 -3.098 2.170 -1.502 1.00 0.35 C ATOM 1812 CG LEU A 118 -1.905 1.431 -0.885 1.00 0.40 C ATOM 1813 CD1 LEU A 118 -2.201 1.030 0.550 1.00 1.24 C ATOM 1814 CD2 LEU A 118 -1.542 0.211 -1.717 1.00 1.25 C ATOM 0 H LEU A 118 -3.999 4.355 -2.594 1.00 0.29 H new ATOM 0 HA LEU A 118 -4.101 3.183 0.106 1.00 0.28 H new ATOM 0 HB2 LEU A 118 -3.950 1.490 -1.531 1.00 0.35 H new ATOM 0 HB3 LEU A 118 -2.854 2.420 -2.535 1.00 0.35 H new ATOM 0 HG LEU A 118 -1.052 2.110 -0.879 1.00 0.40 H new ATOM 0 HD11 LEU A 118 -1.340 0.507 0.967 1.00 1.24 H new ATOM 0 HD12 LEU A 118 -2.405 1.922 1.142 1.00 1.24 H new ATOM 0 HD13 LEU A 118 -3.070 0.373 0.572 1.00 1.24 H new ATOM 0 HD21 LEU A 118 -0.693 -0.300 -1.263 1.00 1.25 H new ATOM 0 HD22 LEU A 118 -2.394 -0.468 -1.759 1.00 1.25 H new ATOM 0 HD23 LEU A 118 -1.278 0.525 -2.727 1.00 1.25 H new ATOM 1826 N GLN A 119 -1.995 4.184 0.928 1.00 0.26 N ATOM 1827 CA GLN A 119 -0.765 4.746 1.452 1.00 0.27 C ATOM 1828 C GLN A 119 0.036 3.630 2.093 1.00 0.26 C ATOM 1829 O GLN A 119 -0.250 3.219 3.209 1.00 0.27 O ATOM 1830 CB GLN A 119 -1.057 5.826 2.490 1.00 0.30 C ATOM 1831 CG GLN A 119 0.166 6.642 2.881 1.00 0.37 C ATOM 1832 CD GLN A 119 0.500 7.730 1.878 1.00 0.46 C ATOM 1833 OE1 GLN A 119 0.188 7.497 0.614 1.00 0.63 O flip ATOM 1834 NE2 GLN A 119 1.037 8.776 2.237 1.00 0.51 N flip ATOM 0 H GLN A 119 -2.597 3.760 1.634 1.00 0.26 H new ATOM 0 HA GLN A 119 -0.204 5.203 0.637 1.00 0.27 H new ATOM 0 HB2 GLN A 119 -1.821 6.497 2.098 1.00 0.30 H new ATOM 0 HB3 GLN A 119 -1.471 5.358 3.383 1.00 0.30 H new ATOM 0 HG2 GLN A 119 -0.004 7.096 3.857 1.00 0.37 H new ATOM 0 HG3 GLN A 119 1.022 5.976 2.984 1.00 0.37 H new ATOM 0 HE21 GLN A 119 1.263 8.921 3.221 1.00 0.51 H new ATOM 0 HE22 GLN A 119 1.256 9.498 1.551 1.00 0.51 H new ATOM 1843 N ILE A 120 1.016 3.133 1.379 1.00 0.26 N ATOM 1844 CA ILE A 120 1.748 1.971 1.832 1.00 0.26 C ATOM 1845 C ILE A 120 3.190 2.331 2.191 1.00 0.23 C ATOM 1846 O ILE A 120 3.967 2.770 1.344 1.00 0.24 O ATOM 1847 CB ILE A 120 1.685 0.843 0.769 1.00 0.31 C ATOM 1848 CG1 ILE A 120 2.395 -0.421 1.252 1.00 0.45 C ATOM 1849 CG2 ILE A 120 2.247 1.295 -0.567 1.00 0.36 C ATOM 1850 CD1 ILE A 120 1.655 -1.139 2.354 1.00 0.81 C ATOM 0 H ILE A 120 1.326 3.512 0.484 1.00 0.26 H new ATOM 0 HA ILE A 120 1.276 1.600 2.742 1.00 0.26 H new ATOM 0 HB ILE A 120 0.631 0.605 0.623 1.00 0.31 H new ATOM 0 HG12 ILE A 120 2.526 -1.100 0.409 1.00 0.45 H new ATOM 0 HG13 ILE A 120 3.392 -0.157 1.606 1.00 0.45 H new ATOM 0 HG21 ILE A 120 2.185 0.476 -1.284 1.00 0.36 H new ATOM 0 HG22 ILE A 120 1.671 2.144 -0.935 1.00 0.36 H new ATOM 0 HG23 ILE A 120 3.289 1.590 -0.442 1.00 0.36 H new ATOM 0 HD11 ILE A 120 2.214 -2.027 2.649 1.00 0.81 H new ATOM 0 HD12 ILE A 120 1.547 -0.476 3.212 1.00 0.81 H new ATOM 0 HD13 ILE A 120 0.668 -1.434 1.997 1.00 0.81 H new ATOM 1862 N GLY A 121 3.522 2.198 3.467 1.00 0.23 N ATOM 1863 CA GLY A 121 4.876 2.423 3.908 1.00 0.23 C ATOM 1864 C GLY A 121 5.660 1.137 3.893 1.00 0.22 C ATOM 1865 O GLY A 121 5.119 0.075 4.203 1.00 0.26 O ATOM 0 H GLY A 121 2.870 1.936 4.206 1.00 0.23 H new ATOM 0 HA2 GLY A 121 5.358 3.156 3.261 1.00 0.23 H new ATOM 0 HA3 GLY A 121 4.871 2.841 4.915 1.00 0.23 H new ATOM 1869 N LEU A 122 6.916 1.227 3.520 1.00 0.23 N ATOM 1870 CA LEU A 122 7.734 0.051 3.320 1.00 0.25 C ATOM 1871 C LEU A 122 8.958 0.045 4.198 1.00 0.23 C ATOM 1872 O LEU A 122 9.774 0.957 4.158 1.00 0.30 O ATOM 1873 CB LEU A 122 8.154 -0.055 1.861 1.00 0.30 C ATOM 1874 CG LEU A 122 7.333 -1.037 1.041 1.00 0.45 C ATOM 1875 CD1 LEU A 122 7.521 -2.452 1.566 1.00 1.20 C ATOM 1876 CD2 LEU A 122 5.871 -0.644 1.072 1.00 1.00 C ATOM 0 H LEU A 122 7.397 2.110 3.348 1.00 0.23 H new ATOM 0 HA LEU A 122 7.125 -0.810 3.596 1.00 0.25 H new ATOM 0 HB2 LEU A 122 8.083 0.931 1.402 1.00 0.30 H new ATOM 0 HB3 LEU A 122 9.202 -0.351 1.818 1.00 0.30 H new ATOM 0 HG LEU A 122 7.678 -1.009 0.007 1.00 0.45 H new ATOM 0 HD11 LEU A 122 6.927 -3.144 0.969 1.00 1.20 H new ATOM 0 HD12 LEU A 122 8.574 -2.728 1.500 1.00 1.20 H new ATOM 0 HD13 LEU A 122 7.198 -2.500 2.606 1.00 1.20 H new ATOM 0 HD21 LEU A 122 5.291 -1.353 0.482 1.00 1.00 H new ATOM 0 HD22 LEU A 122 5.514 -0.651 2.102 1.00 1.00 H new ATOM 0 HD23 LEU A 122 5.754 0.356 0.655 1.00 1.00 H new ATOM 1888 N THR A 123 9.065 -0.998 4.988 1.00 0.22 N ATOM 1889 CA THR A 123 10.255 -1.265 5.765 1.00 0.21 C ATOM 1890 C THR A 123 10.871 -2.571 5.293 1.00 0.23 C ATOM 1891 O THR A 123 10.457 -3.641 5.711 1.00 0.32 O ATOM 1892 CB THR A 123 9.917 -1.383 7.257 1.00 0.24 C ATOM 1893 OG1 THR A 123 9.287 -0.181 7.721 1.00 0.26 O ATOM 1894 CG2 THR A 123 11.159 -1.680 8.084 1.00 0.26 C ATOM 0 H THR A 123 8.325 -1.689 5.111 1.00 0.22 H new ATOM 0 HA THR A 123 10.954 -0.440 5.629 1.00 0.21 H new ATOM 0 HB THR A 123 9.225 -2.216 7.379 1.00 0.24 H new ATOM 0 HG1 THR A 123 8.527 -0.411 8.295 1.00 0.26 H new ATOM 0 HG21 THR A 123 10.885 -1.758 9.136 1.00 0.26 H new ATOM 0 HG22 THR A 123 11.600 -2.620 7.753 1.00 0.26 H new ATOM 0 HG23 THR A 123 11.883 -0.875 7.956 1.00 0.26 H new ATOM 1902 N ILE A 124 11.842 -2.492 4.414 1.00 0.20 N ATOM 1903 CA ILE A 124 12.411 -3.697 3.839 1.00 0.21 C ATOM 1904 C ILE A 124 13.806 -3.943 4.386 1.00 0.24 C ATOM 1905 O ILE A 124 14.570 -2.997 4.579 1.00 0.32 O ATOM 1906 CB ILE A 124 12.445 -3.653 2.292 1.00 0.23 C ATOM 1907 CG1 ILE A 124 13.166 -2.394 1.767 1.00 0.25 C ATOM 1908 CG2 ILE A 124 11.028 -3.740 1.738 1.00 0.25 C ATOM 1909 CD1 ILE A 124 12.278 -1.172 1.588 1.00 0.98 C ATOM 0 H ILE A 124 12.253 -1.620 4.082 1.00 0.20 H new ATOM 0 HA ILE A 124 11.761 -4.523 4.127 1.00 0.21 H new ATOM 0 HB ILE A 124 13.016 -4.514 1.944 1.00 0.23 H new ATOM 0 HG12 ILE A 124 13.972 -2.141 2.456 1.00 0.25 H new ATOM 0 HG13 ILE A 124 13.629 -2.632 0.809 1.00 0.25 H new ATOM 0 HG21 ILE A 124 11.061 -3.708 0.649 1.00 0.25 H new ATOM 0 HG22 ILE A 124 10.568 -4.674 2.060 1.00 0.25 H new ATOM 0 HG23 ILE A 124 10.440 -2.900 2.108 1.00 0.25 H new ATOM 0 HD11 ILE A 124 12.875 -0.340 1.216 1.00 0.98 H new ATOM 0 HD12 ILE A 124 11.487 -1.399 0.874 1.00 0.98 H new ATOM 0 HD13 ILE A 124 11.835 -0.901 2.546 1.00 0.98 H new ATOM 1921 N ASP A 125 14.136 -5.204 4.648 1.00 0.25 N ATOM 1922 CA ASP A 125 15.428 -5.533 5.204 1.00 0.30 C ATOM 1923 C ASP A 125 16.416 -5.650 4.074 1.00 0.30 C ATOM 1924 O ASP A 125 16.386 -6.624 3.314 1.00 0.31 O ATOM 1925 CB ASP A 125 15.370 -6.836 6.009 1.00 0.37 C ATOM 1926 CG ASP A 125 14.772 -6.651 7.393 1.00 0.91 C ATOM 1927 OD1 ASP A 125 13.569 -6.342 7.495 1.00 1.52 O ATOM 1928 OD2 ASP A 125 15.503 -6.829 8.392 1.00 1.44 O ATOM 0 H ASP A 125 13.526 -6.004 4.483 1.00 0.25 H new ATOM 0 HA ASP A 125 15.739 -4.745 5.891 1.00 0.30 H new ATOM 0 HB2 ASP A 125 14.781 -7.570 5.460 1.00 0.37 H new ATOM 0 HB3 ASP A 125 16.377 -7.243 6.105 1.00 0.37 H new ATOM 1933 N LEU A 126 17.262 -4.628 3.979 1.00 0.32 N ATOM 1934 CA LEU A 126 18.253 -4.491 2.921 1.00 0.33 C ATOM 1935 C LEU A 126 19.640 -4.666 3.512 1.00 0.37 C ATOM 1936 O LEU A 126 19.892 -4.201 4.610 1.00 0.55 O ATOM 1937 CB LEU A 126 18.158 -3.094 2.302 1.00 0.42 C ATOM 1938 CG LEU A 126 16.823 -2.746 1.645 1.00 0.38 C ATOM 1939 CD1 LEU A 126 16.648 -1.243 1.570 1.00 1.26 C ATOM 1940 CD2 LEU A 126 16.746 -3.342 0.255 1.00 1.28 C ATOM 0 H LEU A 126 17.277 -3.859 4.649 1.00 0.32 H new ATOM 0 HA LEU A 126 18.069 -5.246 2.157 1.00 0.33 H new ATOM 0 HB2 LEU A 126 18.361 -2.358 3.080 1.00 0.42 H new ATOM 0 HB3 LEU A 126 18.946 -2.994 1.555 1.00 0.42 H new ATOM 0 HG LEU A 126 16.022 -3.166 2.254 1.00 0.38 H new ATOM 0 HD11 LEU A 126 15.692 -1.011 1.100 1.00 1.26 H new ATOM 0 HD12 LEU A 126 16.669 -0.824 2.576 1.00 1.26 H new ATOM 0 HD13 LEU A 126 17.457 -0.811 0.980 1.00 1.26 H new ATOM 0 HD21 LEU A 126 15.789 -3.085 -0.199 1.00 1.28 H new ATOM 0 HD22 LEU A 126 17.556 -2.945 -0.357 1.00 1.28 H new ATOM 0 HD23 LEU A 126 16.838 -4.426 0.318 1.00 1.28 H new ATOM 1952 N PRO A 127 20.568 -5.295 2.790 1.00 0.43 N ATOM 1953 CA PRO A 127 21.908 -5.593 3.324 1.00 0.52 C ATOM 1954 C PRO A 127 22.692 -4.350 3.783 1.00 0.60 C ATOM 1955 O PRO A 127 23.575 -4.450 4.635 1.00 0.74 O ATOM 1956 CB PRO A 127 22.623 -6.263 2.147 1.00 0.60 C ATOM 1957 CG PRO A 127 21.535 -6.752 1.253 1.00 0.73 C ATOM 1958 CD PRO A 127 20.396 -5.786 1.411 1.00 0.55 C ATOM 0 HA PRO A 127 21.837 -6.209 4.221 1.00 0.52 H new ATOM 0 HB2 PRO A 127 23.272 -5.558 1.628 1.00 0.60 H new ATOM 0 HB3 PRO A 127 23.253 -7.085 2.486 1.00 0.60 H new ATOM 0 HG2 PRO A 127 21.871 -6.791 0.217 1.00 0.73 H new ATOM 0 HG3 PRO A 127 21.230 -7.762 1.528 1.00 0.73 H new ATOM 0 HD2 PRO A 127 20.450 -4.976 0.684 1.00 0.55 H new ATOM 0 HD3 PRO A 127 19.431 -6.274 1.273 1.00 0.55 H new ATOM 1966 N VAL A 128 22.371 -3.186 3.223 1.00 0.60 N ATOM 1967 CA VAL A 128 23.135 -1.967 3.507 1.00 0.72 C ATOM 1968 C VAL A 128 22.841 -1.390 4.899 1.00 0.71 C ATOM 1969 O VAL A 128 23.745 -1.250 5.721 1.00 0.82 O ATOM 1970 CB VAL A 128 22.868 -0.878 2.450 1.00 0.83 C ATOM 1971 CG1 VAL A 128 23.687 0.365 2.746 1.00 1.12 C ATOM 1972 CG2 VAL A 128 23.174 -1.394 1.054 1.00 1.02 C ATOM 0 H VAL A 128 21.594 -3.058 2.575 1.00 0.60 H new ATOM 0 HA VAL A 128 24.183 -2.264 3.475 1.00 0.72 H new ATOM 0 HB VAL A 128 21.811 -0.615 2.494 1.00 0.83 H new ATOM 0 HG11 VAL A 128 23.485 1.123 1.989 1.00 1.12 H new ATOM 0 HG12 VAL A 128 23.418 0.753 3.728 1.00 1.12 H new ATOM 0 HG13 VAL A 128 24.748 0.113 2.734 1.00 1.12 H new ATOM 0 HG21 VAL A 128 22.978 -0.608 0.325 1.00 1.02 H new ATOM 0 HG22 VAL A 128 24.222 -1.689 0.997 1.00 1.02 H new ATOM 0 HG23 VAL A 128 22.542 -2.255 0.838 1.00 1.02 H new ATOM 1982 N VAL A 129 21.582 -1.062 5.165 1.00 0.62 N ATOM 1983 CA VAL A 129 21.210 -0.435 6.438 1.00 0.63 C ATOM 1984 C VAL A 129 20.509 -1.457 7.323 1.00 0.55 C ATOM 1985 O VAL A 129 20.167 -1.214 8.479 1.00 0.55 O ATOM 1986 CB VAL A 129 20.295 0.792 6.209 1.00 0.69 C ATOM 1987 CG1 VAL A 129 19.997 1.525 7.509 1.00 1.35 C ATOM 1988 CG2 VAL A 129 20.934 1.738 5.215 1.00 1.26 C ATOM 0 H VAL A 129 20.803 -1.216 4.525 1.00 0.62 H new ATOM 0 HA VAL A 129 22.117 -0.087 6.932 1.00 0.63 H new ATOM 0 HB VAL A 129 19.348 0.429 5.809 1.00 0.69 H new ATOM 0 HG11 VAL A 129 19.352 2.380 7.305 1.00 1.35 H new ATOM 0 HG12 VAL A 129 19.495 0.849 8.201 1.00 1.35 H new ATOM 0 HG13 VAL A 129 20.930 1.872 7.953 1.00 1.35 H new ATOM 0 HG21 VAL A 129 20.282 2.598 5.061 1.00 1.26 H new ATOM 0 HG22 VAL A 129 21.896 2.076 5.601 1.00 1.26 H new ATOM 0 HG23 VAL A 129 21.085 1.222 4.267 1.00 1.26 H new ATOM 1998 N GLY A 130 20.343 -2.622 6.745 1.00 0.53 N ATOM 1999 CA GLY A 130 19.596 -3.691 7.384 1.00 0.55 C ATOM 2000 C GLY A 130 18.107 -3.435 7.350 1.00 0.58 C ATOM 2001 O GLY A 130 17.320 -4.245 7.833 1.00 1.05 O ATOM 0 H GLY A 130 20.716 -2.860 5.826 1.00 0.53 H new ATOM 0 HA2 GLY A 130 19.814 -4.635 6.885 1.00 0.55 H new ATOM 0 HA3 GLY A 130 19.923 -3.795 8.419 1.00 0.55 H new ATOM 2005 N GLU A 131 17.731 -2.300 6.775 1.00 0.49 N ATOM 2006 CA GLU A 131 16.341 -1.906 6.652 1.00 0.46 C ATOM 2007 C GLU A 131 16.249 -0.603 5.872 1.00 0.49 C ATOM 2008 O GLU A 131 17.272 0.004 5.541 1.00 0.75 O ATOM 2009 CB GLU A 131 15.705 -1.716 8.029 1.00 0.59 C ATOM 2010 CG GLU A 131 16.302 -0.562 8.814 1.00 0.73 C ATOM 2011 CD GLU A 131 15.589 -0.318 10.123 1.00 0.93 C ATOM 2012 OE1 GLU A 131 15.587 -1.223 10.981 1.00 1.01 O ATOM 2013 OE2 GLU A 131 15.019 0.781 10.295 1.00 1.16 O ATOM 0 H GLU A 131 18.388 -1.627 6.380 1.00 0.49 H new ATOM 0 HA GLU A 131 15.804 -2.695 6.126 1.00 0.46 H new ATOM 0 HB2 GLU A 131 14.635 -1.548 7.907 1.00 0.59 H new ATOM 0 HB3 GLU A 131 15.820 -2.635 8.604 1.00 0.59 H new ATOM 0 HG2 GLU A 131 17.354 -0.767 9.011 1.00 0.73 H new ATOM 0 HG3 GLU A 131 16.262 0.343 8.209 1.00 0.73 H new ATOM 2020 N PHE A 132 15.027 -0.194 5.582 1.00 0.39 N ATOM 2021 CA PHE A 132 14.762 1.088 4.955 1.00 0.48 C ATOM 2022 C PHE A 132 13.262 1.331 4.979 1.00 0.35 C ATOM 2023 O PHE A 132 12.497 0.483 4.521 1.00 0.33 O ATOM 2024 CB PHE A 132 15.289 1.101 3.515 1.00 0.69 C ATOM 2025 CG PHE A 132 15.390 2.468 2.903 1.00 1.02 C ATOM 2026 CD1 PHE A 132 15.966 3.516 3.604 1.00 1.22 C ATOM 2027 CD2 PHE A 132 14.919 2.701 1.622 1.00 1.31 C ATOM 2028 CE1 PHE A 132 16.068 4.772 3.038 1.00 1.66 C ATOM 2029 CE2 PHE A 132 15.021 3.954 1.050 1.00 1.74 C ATOM 2030 CZ PHE A 132 15.596 4.991 1.759 1.00 1.91 C ATOM 0 H PHE A 132 14.189 -0.743 5.775 1.00 0.39 H new ATOM 0 HA PHE A 132 15.273 1.881 5.500 1.00 0.48 H new ATOM 0 HB2 PHE A 132 16.274 0.635 3.498 1.00 0.69 H new ATOM 0 HB3 PHE A 132 14.635 0.487 2.896 1.00 0.69 H new ATOM 0 HD1 PHE A 132 16.339 3.349 4.604 1.00 1.22 H new ATOM 0 HD2 PHE A 132 14.467 1.894 1.064 1.00 1.31 H new ATOM 0 HE1 PHE A 132 16.516 5.581 3.595 1.00 1.66 H new ATOM 0 HE2 PHE A 132 14.652 4.123 0.049 1.00 1.74 H new ATOM 0 HZ PHE A 132 15.676 5.972 1.313 1.00 1.91 H new ATOM 2040 N THR A 133 12.839 2.450 5.552 1.00 0.37 N ATOM 2041 CA THR A 133 11.421 2.740 5.669 1.00 0.32 C ATOM 2042 C THR A 133 11.021 3.956 4.829 1.00 0.31 C ATOM 2043 O THR A 133 11.303 5.104 5.172 1.00 0.36 O ATOM 2044 CB THR A 133 10.989 2.917 7.149 1.00 0.44 C ATOM 2045 OG1 THR A 133 9.577 3.143 7.232 1.00 1.19 O ATOM 2046 CG2 THR A 133 11.731 4.060 7.834 1.00 1.17 C ATOM 0 H THR A 133 13.454 3.165 5.940 1.00 0.37 H new ATOM 0 HA THR A 133 10.888 1.876 5.273 1.00 0.32 H new ATOM 0 HB THR A 133 11.246 1.994 7.669 1.00 0.44 H new ATOM 0 HG1 THR A 133 9.318 3.251 8.171 1.00 1.19 H new ATOM 0 HG21 THR A 133 11.395 4.145 8.867 1.00 1.17 H new ATOM 0 HG22 THR A 133 12.802 3.861 7.816 1.00 1.17 H new ATOM 0 HG23 THR A 133 11.527 4.993 7.309 1.00 1.17 H new ATOM 2054 N ILE A 134 10.404 3.681 3.693 1.00 0.28 N ATOM 2055 CA ILE A 134 9.888 4.719 2.812 1.00 0.31 C ATOM 2056 C ILE A 134 8.427 4.447 2.481 1.00 0.28 C ATOM 2057 O ILE A 134 8.019 3.297 2.394 1.00 0.26 O ATOM 2058 CB ILE A 134 10.710 4.813 1.507 1.00 0.36 C ATOM 2059 CG1 ILE A 134 10.915 3.427 0.881 1.00 0.41 C ATOM 2060 CG2 ILE A 134 12.046 5.484 1.775 1.00 0.41 C ATOM 2061 CD1 ILE A 134 9.820 3.019 -0.082 1.00 0.50 C ATOM 0 H ILE A 134 10.246 2.732 3.354 1.00 0.28 H new ATOM 0 HA ILE A 134 9.972 5.671 3.336 1.00 0.31 H new ATOM 0 HB ILE A 134 10.151 5.420 0.795 1.00 0.36 H new ATOM 0 HG12 ILE A 134 11.870 3.414 0.356 1.00 0.41 H new ATOM 0 HG13 ILE A 134 10.979 2.686 1.677 1.00 0.41 H new ATOM 0 HG21 ILE A 134 12.616 5.544 0.848 1.00 0.41 H new ATOM 0 HG22 ILE A 134 11.877 6.489 2.163 1.00 0.41 H new ATOM 0 HG23 ILE A 134 12.605 4.902 2.507 1.00 0.41 H new ATOM 0 HD11 ILE A 134 10.037 2.028 -0.482 1.00 0.50 H new ATOM 0 HD12 ILE A 134 8.864 2.997 0.442 1.00 0.50 H new ATOM 0 HD13 ILE A 134 9.769 3.737 -0.900 1.00 0.50 H new ATOM 2073 N PRO A 135 7.604 5.486 2.336 1.00 0.30 N ATOM 2074 CA PRO A 135 6.217 5.325 1.945 1.00 0.29 C ATOM 2075 C PRO A 135 5.989 5.518 0.443 1.00 0.28 C ATOM 2076 O PRO A 135 6.820 6.094 -0.262 1.00 0.31 O ATOM 2077 CB PRO A 135 5.529 6.431 2.746 1.00 0.35 C ATOM 2078 CG PRO A 135 6.578 7.488 2.969 1.00 0.45 C ATOM 2079 CD PRO A 135 7.920 6.893 2.591 1.00 0.39 C ATOM 0 HA PRO A 135 5.843 4.320 2.141 1.00 0.29 H new ATOM 0 HB2 PRO A 135 4.676 6.835 2.201 1.00 0.35 H new ATOM 0 HB3 PRO A 135 5.150 6.050 3.694 1.00 0.35 H new ATOM 0 HG2 PRO A 135 6.367 8.370 2.364 1.00 0.45 H new ATOM 0 HG3 PRO A 135 6.582 7.809 4.011 1.00 0.45 H new ATOM 0 HD2 PRO A 135 8.341 7.377 1.710 1.00 0.39 H new ATOM 0 HD3 PRO A 135 8.649 7.003 3.394 1.00 0.39 H new ATOM 2087 N ILE A 136 4.848 5.039 -0.027 1.00 0.26 N ATOM 2088 CA ILE A 136 4.458 5.147 -1.423 1.00 0.27 C ATOM 2089 C ILE A 136 2.942 4.950 -1.501 1.00 0.26 C ATOM 2090 O ILE A 136 2.323 4.543 -0.516 1.00 0.26 O ATOM 2091 CB ILE A 136 5.247 4.133 -2.314 1.00 0.28 C ATOM 2092 CG1 ILE A 136 4.930 4.320 -3.812 1.00 0.44 C ATOM 2093 CG2 ILE A 136 4.998 2.697 -1.869 1.00 0.33 C ATOM 2094 CD1 ILE A 136 3.947 3.316 -4.383 1.00 0.32 C ATOM 0 H ILE A 136 4.161 4.560 0.555 1.00 0.26 H new ATOM 0 HA ILE A 136 4.710 6.132 -1.816 1.00 0.27 H new ATOM 0 HB ILE A 136 6.308 4.343 -2.181 1.00 0.28 H new ATOM 0 HG12 ILE A 136 4.532 5.323 -3.962 1.00 0.44 H new ATOM 0 HG13 ILE A 136 5.860 4.258 -4.377 1.00 0.44 H new ATOM 0 HG21 ILE A 136 5.560 2.016 -2.508 1.00 0.33 H new ATOM 0 HG22 ILE A 136 5.321 2.575 -0.835 1.00 0.33 H new ATOM 0 HG23 ILE A 136 3.934 2.472 -1.945 1.00 0.33 H new ATOM 0 HD11 ILE A 136 3.786 3.526 -5.440 1.00 0.32 H new ATOM 0 HD12 ILE A 136 4.349 2.309 -4.270 1.00 0.32 H new ATOM 0 HD13 ILE A 136 2.999 3.391 -3.850 1.00 0.32 H new ATOM 2106 N SER A 137 2.331 5.252 -2.630 1.00 0.28 N ATOM 2107 CA SER A 137 0.886 5.325 -2.681 1.00 0.30 C ATOM 2108 C SER A 137 0.325 4.871 -4.019 1.00 0.30 C ATOM 2109 O SER A 137 1.029 4.856 -5.029 1.00 0.32 O ATOM 2110 CB SER A 137 0.456 6.757 -2.398 1.00 0.34 C ATOM 2111 OG SER A 137 0.960 7.645 -3.381 1.00 0.88 O ATOM 0 H SER A 137 2.805 5.448 -3.512 1.00 0.28 H new ATOM 0 HA SER A 137 0.489 4.647 -1.926 1.00 0.30 H new ATOM 0 HB2 SER A 137 -0.632 6.815 -2.375 1.00 0.34 H new ATOM 0 HB3 SER A 137 0.813 7.059 -1.413 1.00 0.34 H new ATOM 0 HG SER A 137 0.668 8.558 -3.177 1.00 0.88 H new ATOM 2117 N SER A 138 -0.950 4.499 -4.019 1.00 0.31 N ATOM 2118 CA SER A 138 -1.658 4.163 -5.239 1.00 0.34 C ATOM 2119 C SER A 138 -3.140 4.484 -5.054 1.00 0.34 C ATOM 2120 O SER A 138 -3.823 3.835 -4.267 1.00 0.35 O ATOM 2121 CB SER A 138 -1.471 2.678 -5.573 1.00 0.40 C ATOM 2122 OG SER A 138 -2.032 2.358 -6.835 1.00 0.96 O ATOM 0 H SER A 138 -1.516 4.423 -3.174 1.00 0.31 H new ATOM 0 HA SER A 138 -1.258 4.748 -6.067 1.00 0.34 H new ATOM 0 HB2 SER A 138 -0.409 2.434 -5.573 1.00 0.40 H new ATOM 0 HB3 SER A 138 -1.938 2.068 -4.800 1.00 0.40 H new ATOM 0 HG SER A 138 -1.896 1.406 -7.021 1.00 0.96 H new ATOM 2128 N LYS A 139 -3.623 5.511 -5.738 1.00 0.36 N ATOM 2129 CA LYS A 139 -5.024 5.906 -5.627 1.00 0.38 C ATOM 2130 C LYS A 139 -5.777 5.532 -6.893 1.00 0.41 C ATOM 2131 O LYS A 139 -5.196 5.530 -7.980 1.00 0.47 O ATOM 2132 CB LYS A 139 -5.165 7.412 -5.346 1.00 0.44 C ATOM 2133 CG LYS A 139 -4.410 8.330 -6.305 1.00 0.57 C ATOM 2134 CD LYS A 139 -2.969 8.559 -5.869 1.00 0.92 C ATOM 2135 CE LYS A 139 -2.895 9.149 -4.469 1.00 1.35 C ATOM 2136 NZ LYS A 139 -3.546 10.486 -4.381 1.00 1.76 N ATOM 0 H LYS A 139 -3.070 6.085 -6.374 1.00 0.36 H new ATOM 0 HA LYS A 139 -5.457 5.369 -4.783 1.00 0.38 H new ATOM 0 HB2 LYS A 139 -6.223 7.673 -5.377 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -4.818 7.609 -4.332 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -4.420 7.896 -7.305 1.00 0.57 H new ATOM 0 HG3 LYS A 139 -4.925 9.289 -6.369 1.00 0.57 H new ATOM 0 HD2 LYS A 139 -2.426 7.614 -5.896 1.00 0.92 H new ATOM 0 HD3 LYS A 139 -2.477 9.230 -6.574 1.00 0.92 H new ATOM 0 HE2 LYS A 139 -3.373 8.468 -3.765 1.00 1.35 H new ATOM 0 HE3 LYS A 139 -1.851 9.236 -4.169 1.00 1.35 H new ATOM 0 HZ1 LYS A 139 -3.636 10.763 -3.383 1.00 1.76 H new ATOM 0 HZ2 LYS A 139 -2.967 11.188 -4.884 1.00 1.76 H new ATOM 0 HZ3 LYS A 139 -4.490 10.442 -4.815 1.00 1.76 H new ATOM 2150 N GLY A 140 -7.060 5.203 -6.764 1.00 0.42 N ATOM 2151 CA GLY A 140 -7.832 4.790 -7.908 1.00 0.50 C ATOM 2152 C GLY A 140 -9.323 4.922 -7.661 1.00 0.46 C ATOM 2153 O GLY A 140 -9.810 4.682 -6.557 1.00 0.47 O ATOM 0 H GLY A 140 -7.573 5.217 -5.883 1.00 0.42 H new ATOM 0 HA2 GLY A 140 -7.552 5.393 -8.772 1.00 0.50 H new ATOM 0 HA3 GLY A 140 -7.595 3.754 -8.152 1.00 0.50 H new ATOM 2157 N GLU A 141 -10.028 5.322 -8.698 1.00 0.44 N ATOM 2158 CA GLU A 141 -11.466 5.552 -8.616 1.00 0.42 C ATOM 2159 C GLU A 141 -12.215 4.531 -9.459 1.00 0.43 C ATOM 2160 O GLU A 141 -11.840 4.282 -10.607 1.00 0.48 O ATOM 2161 CB GLU A 141 -11.822 6.967 -9.087 1.00 0.45 C ATOM 2162 CG GLU A 141 -10.873 8.054 -8.593 1.00 0.52 C ATOM 2163 CD GLU A 141 -9.570 8.094 -9.367 1.00 1.24 C ATOM 2164 OE1 GLU A 141 -9.618 8.075 -10.618 1.00 1.51 O ATOM 2165 OE2 GLU A 141 -8.498 8.135 -8.734 1.00 2.10 O ATOM 0 H GLU A 141 -9.629 5.498 -9.620 1.00 0.44 H new ATOM 0 HA GLU A 141 -11.763 5.445 -7.573 1.00 0.42 H new ATOM 0 HB2 GLU A 141 -11.835 6.981 -10.177 1.00 0.45 H new ATOM 0 HB3 GLU A 141 -12.832 7.204 -8.753 1.00 0.45 H new ATOM 0 HG2 GLU A 141 -11.366 9.023 -8.671 1.00 0.52 H new ATOM 0 HG3 GLU A 141 -10.658 7.890 -7.537 1.00 0.52 H new ATOM 2172 N ILE A 142 -13.277 3.940 -8.910 1.00 0.42 N ATOM 2173 CA ILE A 142 -14.054 2.943 -9.633 1.00 0.47 C ATOM 2174 C ILE A 142 -15.532 3.165 -9.327 1.00 0.46 C ATOM 2175 O ILE A 142 -15.877 4.031 -8.517 1.00 0.42 O ATOM 2176 CB ILE A 142 -13.664 1.464 -9.312 1.00 0.54 C ATOM 2177 CG1 ILE A 142 -14.307 0.958 -8.011 1.00 0.76 C ATOM 2178 CG2 ILE A 142 -12.153 1.293 -9.252 1.00 0.60 C ATOM 2179 CD1 ILE A 142 -13.810 1.632 -6.756 1.00 0.67 C ATOM 0 H ILE A 142 -13.615 4.137 -7.968 1.00 0.42 H new ATOM 0 HA ILE A 142 -13.836 3.079 -10.692 1.00 0.47 H new ATOM 0 HB ILE A 142 -14.054 0.858 -10.129 1.00 0.54 H new ATOM 0 HG12 ILE A 142 -15.386 1.096 -8.078 1.00 0.76 H new ATOM 0 HG13 ILE A 142 -14.128 -0.114 -7.926 1.00 0.76 H new ATOM 0 HG21 ILE A 142 -11.913 0.254 -9.027 1.00 0.60 H new ATOM 0 HG22 ILE A 142 -11.717 1.566 -10.213 1.00 0.60 H new ATOM 0 HG23 ILE A 142 -11.745 1.937 -8.473 1.00 0.60 H new ATOM 0 HD11 ILE A 142 -14.320 1.210 -5.890 1.00 0.67 H new ATOM 0 HD12 ILE A 142 -12.736 1.472 -6.658 1.00 0.67 H new ATOM 0 HD13 ILE A 142 -14.014 2.701 -6.812 1.00 0.67 H new ATOM 2191 N LYS A 143 -16.394 2.408 -9.985 1.00 0.53 N ATOM 2192 CA LYS A 143 -17.835 2.594 -9.861 1.00 0.57 C ATOM 2193 C LYS A 143 -18.339 2.190 -8.469 1.00 0.54 C ATOM 2194 O LYS A 143 -17.579 1.673 -7.646 1.00 0.57 O ATOM 2195 CB LYS A 143 -18.539 1.794 -10.958 1.00 0.70 C ATOM 2196 CG LYS A 143 -17.927 2.024 -12.332 1.00 1.44 C ATOM 2197 CD LYS A 143 -18.575 1.170 -13.405 1.00 2.04 C ATOM 2198 CE LYS A 143 -17.806 1.261 -14.714 1.00 2.74 C ATOM 2199 NZ LYS A 143 -17.669 2.665 -15.188 1.00 3.53 N ATOM 0 H LYS A 143 -16.121 1.654 -10.615 1.00 0.53 H new ATOM 0 HA LYS A 143 -18.066 3.652 -9.982 1.00 0.57 H new ATOM 0 HB2 LYS A 143 -18.492 0.732 -10.716 1.00 0.70 H new ATOM 0 HB3 LYS A 143 -19.594 2.068 -10.983 1.00 0.70 H new ATOM 0 HG2 LYS A 143 -18.027 3.076 -12.599 1.00 1.44 H new ATOM 0 HG3 LYS A 143 -16.860 1.805 -12.293 1.00 1.44 H new ATOM 0 HD2 LYS A 143 -18.614 0.132 -13.074 1.00 2.04 H new ATOM 0 HD3 LYS A 143 -19.604 1.494 -13.561 1.00 2.04 H new ATOM 0 HE2 LYS A 143 -16.816 0.825 -14.583 1.00 2.74 H new ATOM 0 HE3 LYS A 143 -18.316 0.670 -15.475 1.00 2.74 H new ATOM 0 HZ1 LYS A 143 -17.260 2.670 -16.144 1.00 3.53 H new ATOM 0 HZ2 LYS A 143 -18.605 3.117 -15.209 1.00 3.53 H new ATOM 0 HZ3 LYS A 143 -17.045 3.190 -14.542 1.00 3.53 H new ATOM 2213 N LEU A 144 -19.628 2.418 -8.230 1.00 0.60 N ATOM 2214 CA LEU A 144 -20.237 2.236 -6.909 1.00 0.66 C ATOM 2215 C LEU A 144 -20.040 0.805 -6.385 1.00 0.60 C ATOM 2216 O LEU A 144 -20.183 -0.167 -7.130 1.00 0.63 O ATOM 2217 CB LEU A 144 -21.734 2.579 -6.991 1.00 0.83 C ATOM 2218 CG LEU A 144 -22.473 2.727 -5.654 1.00 0.69 C ATOM 2219 CD1 LEU A 144 -21.990 3.957 -4.896 1.00 1.21 C ATOM 2220 CD2 LEU A 144 -23.974 2.806 -5.886 1.00 1.23 C ATOM 0 H LEU A 144 -20.283 2.734 -8.945 1.00 0.60 H new ATOM 0 HA LEU A 144 -19.744 2.906 -6.205 1.00 0.66 H new ATOM 0 HB2 LEU A 144 -21.841 3.511 -7.546 1.00 0.83 H new ATOM 0 HB3 LEU A 144 -22.231 1.803 -7.572 1.00 0.83 H new ATOM 0 HG LEU A 144 -22.256 1.848 -5.048 1.00 0.69 H new ATOM 0 HD11 LEU A 144 -22.530 4.038 -3.953 1.00 1.21 H new ATOM 0 HD12 LEU A 144 -20.922 3.865 -4.696 1.00 1.21 H new ATOM 0 HD13 LEU A 144 -22.172 4.849 -5.496 1.00 1.21 H new ATOM 0 HD21 LEU A 144 -24.485 2.911 -4.929 1.00 1.23 H new ATOM 0 HD22 LEU A 144 -24.200 3.667 -6.514 1.00 1.23 H new ATOM 0 HD23 LEU A 144 -24.314 1.896 -6.381 1.00 1.23 H new ATOM 2232 N PRO A 145 -19.685 0.673 -5.096 1.00 0.61 N ATOM 2233 CA PRO A 145 -19.489 -0.626 -4.437 1.00 0.64 C ATOM 2234 C PRO A 145 -20.805 -1.347 -4.139 1.00 0.66 C ATOM 2235 O PRO A 145 -21.888 -0.806 -4.367 1.00 0.65 O ATOM 2236 CB PRO A 145 -18.786 -0.253 -3.134 1.00 0.71 C ATOM 2237 CG PRO A 145 -19.258 1.126 -2.838 1.00 0.69 C ATOM 2238 CD PRO A 145 -19.426 1.794 -4.173 1.00 0.67 C ATOM 0 HA PRO A 145 -18.929 -1.316 -5.067 1.00 0.64 H new ATOM 0 HB2 PRO A 145 -19.046 -0.943 -2.331 1.00 0.71 H new ATOM 0 HB3 PRO A 145 -17.702 -0.287 -3.244 1.00 0.71 H new ATOM 0 HG2 PRO A 145 -20.199 1.108 -2.288 1.00 0.69 H new ATOM 0 HG3 PRO A 145 -18.538 1.662 -2.220 1.00 0.69 H new ATOM 0 HD2 PRO A 145 -20.253 2.504 -4.164 1.00 0.67 H new ATOM 0 HD3 PRO A 145 -18.532 2.349 -4.458 1.00 0.67 H new