USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=30 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 143:sc= 1.93 USER MOD Set 1.2: A 133 THR OG1 : rot 95:sc= 0.813 USER MOD Set 2.1: A 119 GLN : amide:sc= -3.92! K(o=-4!,f=1.8) USER MOD Set 2.2: A 137 SER OG : rot 170:sc= -0.0915 USER MOD Single : A 25 SER OG : rot 58:sc= -2.77! USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 169:sc= 1.16 (180deg=1.14) USER MOD Single : A 38 SER OG : rot 180:sc= -0.258 USER MOD Single : A 41 TYR OH : rot 159:sc= 1.63 USER MOD Single : A 44 LYS NZ :NH3+ 158:sc= 1.12 (180deg=0.754) USER MOD Single : A 46 SER OG : rot 18:sc= -0.127 USER MOD Single : A 48 THR OG1 : rot 180:sc= -1.16 USER MOD Single : A 49 ASN : amide:sc= -2.51 K(o=-2.5,f=-5.5!) USER MOD Single : A 51 TYR OH : rot 180:sc= -0.106 USER MOD Single : A 52 SER OG : rot 180:sc= 0.0269 USER MOD Single : A 53 HIS : no HD1:sc= 0 X(o=0,f=-0.0014) USER MOD Single : A 54 SER OG : rot -58:sc= 1.33 USER MOD Single : A 58 CYS SG : rot 180:sc= -3.01! USER MOD Single : A 61 SER OG : rot -48:sc= 0.461 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HE2:sc= -2.02 K(o=-2,f=-1.4) USER MOD Single : A 66 SER OG : rot 106:sc= -0.384! USER MOD Single : A 73 LYS NZ :NH3+ -169:sc= 1.25 (180deg=0.927) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 30:sc= 0.475 USER MOD Single : A 83 LYS NZ :NH3+ 155:sc= 0.551 (180deg=0.241) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 MET CE :methyl 144:sc= -0.471 (180deg=-1.67) USER MOD Single : A 88 THR OG1 : rot 180: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= 0.949 K(o=0.95,f=-0.31) USER MOD Single : A 116 TYR OH : rot 130:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ -136:sc= 1.21 (180deg=-0.131) USER MOD Single : A 143 LYS NZ :NH3+ 163:sc= -0.0685 (180deg=-0.336) USER MOD ----------------------------------------------------------------- ATOM 364 N GLY A 24 9.228 -0.496 -4.719 1.00 0.54 N ATOM 365 CA GLY A 24 7.784 -0.459 -4.649 1.00 0.46 C ATOM 366 C GLY A 24 7.170 -1.492 -3.738 1.00 0.33 C ATOM 367 O GLY A 24 7.878 -2.241 -3.078 1.00 0.39 O ATOM 0 HA2 GLY A 24 7.475 0.531 -4.313 1.00 0.46 H new ATOM 0 HA3 GLY A 24 7.382 -0.595 -5.653 1.00 0.46 H new ATOM 371 N SER A 25 5.840 -1.463 -3.678 1.00 0.28 N ATOM 372 CA SER A 25 5.010 -2.460 -2.993 1.00 0.30 C ATOM 373 C SER A 25 3.556 -2.211 -3.369 1.00 0.32 C ATOM 374 O SER A 25 2.635 -2.401 -2.582 1.00 0.39 O ATOM 375 CB SER A 25 5.155 -2.390 -1.480 1.00 0.37 C ATOM 376 OG SER A 25 6.382 -2.940 -1.038 1.00 1.20 O ATOM 0 H SER A 25 5.291 -0.724 -4.117 1.00 0.28 H new ATOM 0 HA SER A 25 5.338 -3.451 -3.306 1.00 0.30 H new ATOM 0 HB2 SER A 25 5.086 -1.351 -1.157 1.00 0.37 H new ATOM 0 HB3 SER A 25 4.329 -2.925 -1.012 1.00 0.37 H new ATOM 0 HG SER A 25 7.126 -2.468 -1.468 1.00 1.20 H new ATOM 382 N VAL A 26 3.381 -1.773 -4.592 1.00 0.28 N ATOM 383 CA VAL A 26 2.084 -1.382 -5.113 1.00 0.30 C ATOM 384 C VAL A 26 1.905 -1.972 -6.501 1.00 0.30 C ATOM 385 O VAL A 26 2.893 -2.326 -7.143 1.00 0.30 O ATOM 386 CB VAL A 26 1.947 0.156 -5.183 1.00 0.33 C ATOM 387 CG1 VAL A 26 1.933 0.762 -3.789 1.00 0.93 C ATOM 388 CG2 VAL A 26 3.077 0.742 -6.012 1.00 0.88 C ATOM 0 H VAL A 26 4.141 -1.675 -5.265 1.00 0.28 H new ATOM 0 HA VAL A 26 1.314 -1.760 -4.440 1.00 0.30 H new ATOM 0 HB VAL A 26 0.999 0.399 -5.663 1.00 0.33 H new ATOM 0 HG11 VAL A 26 1.836 1.845 -3.864 1.00 0.93 H new ATOM 0 HG12 VAL A 26 1.091 0.360 -3.226 1.00 0.93 H new ATOM 0 HG13 VAL A 26 2.863 0.516 -3.276 1.00 0.93 H new ATOM 0 HG21 VAL A 26 2.972 1.826 -6.056 1.00 0.88 H new ATOM 0 HG22 VAL A 26 4.033 0.488 -5.555 1.00 0.88 H new ATOM 0 HG23 VAL A 26 3.038 0.333 -7.022 1.00 0.88 H new ATOM 398 N THR A 27 0.663 -2.139 -6.925 1.00 0.33 N ATOM 399 CA THR A 27 0.367 -2.475 -8.310 1.00 0.36 C ATOM 400 C THR A 27 -1.138 -2.460 -8.601 1.00 0.38 C ATOM 401 O THR A 27 -1.558 -2.023 -9.675 1.00 0.48 O ATOM 402 CB THR A 27 0.969 -3.839 -8.714 1.00 0.39 C ATOM 403 OG1 THR A 27 0.519 -4.214 -10.020 1.00 0.47 O ATOM 404 CG2 THR A 27 0.614 -4.921 -7.708 1.00 0.39 C ATOM 0 H THR A 27 -0.159 -2.047 -6.329 1.00 0.33 H new ATOM 0 HA THR A 27 0.837 -1.699 -8.914 1.00 0.36 H new ATOM 0 HB THR A 27 2.054 -3.734 -8.727 1.00 0.39 H new ATOM 0 HG1 THR A 27 0.909 -5.079 -10.264 1.00 0.47 H new ATOM 0 HG21 THR A 27 1.053 -5.868 -8.022 1.00 0.39 H new ATOM 0 HG22 THR A 27 1.004 -4.648 -6.727 1.00 0.39 H new ATOM 0 HG23 THR A 27 -0.470 -5.024 -7.652 1.00 0.39 H new ATOM 412 N ASP A 28 -1.954 -2.914 -7.652 1.00 0.35 N ATOM 413 CA ASP A 28 -3.387 -3.063 -7.904 1.00 0.42 C ATOM 414 C ASP A 28 -4.165 -3.129 -6.601 1.00 0.35 C ATOM 415 O ASP A 28 -3.615 -3.464 -5.562 1.00 0.37 O ATOM 416 CB ASP A 28 -3.626 -4.353 -8.689 1.00 0.57 C ATOM 417 CG ASP A 28 -4.983 -4.425 -9.353 1.00 1.08 C ATOM 418 OD1 ASP A 28 -5.224 -3.657 -10.305 1.00 1.69 O ATOM 419 OD2 ASP A 28 -5.823 -5.228 -8.905 1.00 1.44 O ATOM 0 H ASP A 28 -1.654 -3.182 -6.715 1.00 0.35 H new ATOM 0 HA ASP A 28 -3.730 -2.199 -8.473 1.00 0.42 H new ATOM 0 HB2 ASP A 28 -2.854 -4.451 -9.452 1.00 0.57 H new ATOM 0 HB3 ASP A 28 -3.517 -5.202 -8.015 1.00 0.57 H new ATOM 424 N VAL A 29 -5.441 -2.795 -6.665 1.00 0.39 N ATOM 425 CA VAL A 29 -6.349 -2.988 -5.544 1.00 0.41 C ATOM 426 C VAL A 29 -7.709 -3.421 -6.085 1.00 0.37 C ATOM 427 O VAL A 29 -8.200 -2.856 -7.063 1.00 0.42 O ATOM 428 CB VAL A 29 -6.498 -1.718 -4.671 1.00 0.60 C ATOM 429 CG1 VAL A 29 -7.570 -1.928 -3.619 1.00 1.13 C ATOM 430 CG2 VAL A 29 -5.179 -1.349 -3.998 1.00 1.14 C ATOM 0 H VAL A 29 -5.878 -2.384 -7.490 1.00 0.39 H new ATOM 0 HA VAL A 29 -5.930 -3.759 -4.898 1.00 0.41 H new ATOM 0 HB VAL A 29 -6.789 -0.896 -5.325 1.00 0.60 H new ATOM 0 HG11 VAL A 29 -7.665 -1.028 -3.012 1.00 1.13 H new ATOM 0 HG12 VAL A 29 -8.522 -2.139 -4.106 1.00 1.13 H new ATOM 0 HG13 VAL A 29 -7.295 -2.768 -2.982 1.00 1.13 H new ATOM 0 HG21 VAL A 29 -5.318 -0.453 -3.393 1.00 1.14 H new ATOM 0 HG22 VAL A 29 -4.853 -2.171 -3.361 1.00 1.14 H new ATOM 0 HG23 VAL A 29 -4.423 -1.159 -4.760 1.00 1.14 H new ATOM 440 N ASP A 30 -8.303 -4.429 -5.463 1.00 0.37 N ATOM 441 CA ASP A 30 -9.517 -5.044 -5.988 1.00 0.38 C ATOM 442 C ASP A 30 -10.627 -5.041 -4.946 1.00 0.42 C ATOM 443 O ASP A 30 -10.415 -5.426 -3.796 1.00 0.54 O ATOM 444 CB ASP A 30 -9.219 -6.476 -6.442 1.00 0.51 C ATOM 445 CG ASP A 30 -10.449 -7.207 -6.940 1.00 1.00 C ATOM 446 OD1 ASP A 30 -10.842 -6.989 -8.103 1.00 1.16 O ATOM 447 OD2 ASP A 30 -11.041 -7.981 -6.165 1.00 1.83 O ATOM 0 H ASP A 30 -7.965 -4.840 -4.593 1.00 0.37 H new ATOM 0 HA ASP A 30 -9.857 -4.459 -6.843 1.00 0.38 H new ATOM 0 HB2 ASP A 30 -8.472 -6.452 -7.235 1.00 0.51 H new ATOM 0 HB3 ASP A 30 -8.784 -7.032 -5.611 1.00 0.51 H new ATOM 452 N LEU A 31 -11.809 -4.617 -5.358 1.00 0.47 N ATOM 453 CA LEU A 31 -12.916 -4.427 -4.435 1.00 0.57 C ATOM 454 C LEU A 31 -13.902 -5.589 -4.496 1.00 0.58 C ATOM 455 O LEU A 31 -14.377 -5.967 -5.571 1.00 0.67 O ATOM 456 CB LEU A 31 -13.623 -3.094 -4.748 1.00 0.71 C ATOM 457 CG LEU A 31 -14.766 -2.683 -3.804 1.00 0.85 C ATOM 458 CD1 LEU A 31 -16.080 -3.330 -4.216 1.00 0.94 C ATOM 459 CD2 LEU A 31 -14.426 -3.044 -2.363 1.00 0.86 C ATOM 0 H LEU A 31 -12.028 -4.397 -6.330 1.00 0.47 H new ATOM 0 HA LEU A 31 -12.519 -4.395 -3.420 1.00 0.57 H new ATOM 0 HB2 LEU A 31 -12.875 -2.302 -4.742 1.00 0.71 H new ATOM 0 HB3 LEU A 31 -14.021 -3.149 -5.761 1.00 0.71 H new ATOM 0 HG LEU A 31 -14.885 -1.602 -3.875 1.00 0.85 H new ATOM 0 HD11 LEU A 31 -16.869 -3.021 -3.530 1.00 0.94 H new ATOM 0 HD12 LEU A 31 -16.337 -3.019 -5.229 1.00 0.94 H new ATOM 0 HD13 LEU A 31 -15.977 -4.415 -4.185 1.00 0.94 H new ATOM 0 HD21 LEU A 31 -15.246 -2.746 -1.710 1.00 0.86 H new ATOM 0 HD22 LEU A 31 -14.272 -4.120 -2.284 1.00 0.86 H new ATOM 0 HD23 LEU A 31 -13.516 -2.525 -2.063 1.00 0.86 H new ATOM 471 N LYS A 32 -14.195 -6.155 -3.331 1.00 0.56 N ATOM 472 CA LYS A 32 -15.288 -7.102 -3.192 1.00 0.60 C ATOM 473 C LYS A 32 -16.149 -6.735 -1.983 1.00 0.82 C ATOM 474 O LYS A 32 -16.741 -5.657 -1.952 1.00 1.33 O ATOM 475 CB LYS A 32 -14.789 -8.553 -3.102 1.00 0.62 C ATOM 476 CG LYS A 32 -13.619 -8.771 -2.153 1.00 0.65 C ATOM 477 CD LYS A 32 -12.305 -8.831 -2.909 1.00 0.90 C ATOM 478 CE LYS A 32 -12.350 -9.901 -3.986 1.00 1.10 C ATOM 479 NZ LYS A 32 -11.031 -10.104 -4.635 1.00 1.32 N ATOM 0 H LYS A 32 -13.686 -5.971 -2.466 1.00 0.56 H new ATOM 0 HA LYS A 32 -15.901 -7.040 -4.091 1.00 0.60 H new ATOM 0 HB2 LYS A 32 -15.617 -9.188 -2.786 1.00 0.62 H new ATOM 0 HB3 LYS A 32 -14.496 -8.884 -4.099 1.00 0.62 H new ATOM 0 HG2 LYS A 32 -13.585 -7.963 -1.422 1.00 0.65 H new ATOM 0 HG3 LYS A 32 -13.765 -9.698 -1.598 1.00 0.65 H new ATOM 0 HD2 LYS A 32 -12.096 -7.862 -3.362 1.00 0.90 H new ATOM 0 HD3 LYS A 32 -11.491 -9.041 -2.216 1.00 0.90 H new ATOM 0 HE2 LYS A 32 -12.685 -10.841 -3.547 1.00 1.10 H new ATOM 0 HE3 LYS A 32 -13.085 -9.622 -4.741 1.00 1.10 H new ATOM 0 HZ1 LYS A 32 -11.062 -10.960 -5.224 1.00 1.32 H new ATOM 0 HZ2 LYS A 32 -10.807 -9.282 -5.231 1.00 1.32 H new ATOM 0 HZ3 LYS A 32 -10.298 -10.212 -3.905 1.00 1.32 H new ATOM 493 N ASP A 33 -16.179 -7.597 -0.976 1.00 0.60 N ATOM 494 CA ASP A 33 -17.067 -7.417 0.172 1.00 0.94 C ATOM 495 C ASP A 33 -17.039 -8.643 1.058 1.00 0.53 C ATOM 496 O ASP A 33 -16.395 -9.641 0.726 1.00 1.46 O ATOM 497 CB ASP A 33 -18.512 -7.161 -0.260 1.00 2.08 C ATOM 498 CG ASP A 33 -19.186 -8.391 -0.841 1.00 2.37 C ATOM 499 OD1 ASP A 33 -18.825 -8.797 -1.964 1.00 2.85 O ATOM 500 OD2 ASP A 33 -20.082 -8.954 -0.177 1.00 2.32 O ATOM 0 H ASP A 33 -15.597 -8.433 -0.928 1.00 0.60 H new ATOM 0 HA ASP A 33 -16.705 -6.547 0.719 1.00 0.94 H new ATOM 0 HB2 ASP A 33 -19.085 -6.811 0.599 1.00 2.08 H new ATOM 0 HB3 ASP A 33 -18.527 -6.361 -1.001 1.00 2.08 H new ATOM 571 N SER A 38 -18.361 -6.276 7.332 1.00 0.54 N ATOM 572 CA SER A 38 -17.230 -5.547 6.851 1.00 0.48 C ATOM 573 C SER A 38 -17.235 -5.723 5.343 1.00 0.50 C ATOM 574 O SER A 38 -18.146 -6.358 4.812 1.00 0.94 O ATOM 575 CB SER A 38 -15.969 -6.113 7.508 1.00 0.55 C ATOM 576 OG SER A 38 -14.789 -5.531 6.983 1.00 0.76 O ATOM 0 HA SER A 38 -17.261 -4.485 7.093 1.00 0.48 H new ATOM 0 HB2 SER A 38 -16.011 -5.939 8.583 1.00 0.55 H new ATOM 0 HB3 SER A 38 -15.937 -7.193 7.361 1.00 0.55 H new ATOM 0 HG SER A 38 -14.007 -5.918 7.429 1.00 0.76 H new ATOM 582 N VAL A 39 -16.299 -5.131 4.647 1.00 0.33 N ATOM 583 CA VAL A 39 -16.129 -5.418 3.236 1.00 0.35 C ATOM 584 C VAL A 39 -14.657 -5.702 2.957 1.00 0.31 C ATOM 585 O VAL A 39 -13.790 -5.367 3.762 1.00 0.34 O ATOM 586 CB VAL A 39 -16.720 -4.288 2.352 1.00 0.43 C ATOM 587 CG1 VAL A 39 -16.156 -4.283 0.938 1.00 0.86 C ATOM 588 CG2 VAL A 39 -18.234 -4.451 2.298 1.00 0.86 C ATOM 0 H VAL A 39 -15.643 -4.449 5.027 1.00 0.33 H new ATOM 0 HA VAL A 39 -16.693 -6.312 2.970 1.00 0.35 H new ATOM 0 HB VAL A 39 -16.443 -3.336 2.804 1.00 0.43 H new ATOM 0 HG11 VAL A 39 -16.608 -3.470 0.369 1.00 0.86 H new ATOM 0 HG12 VAL A 39 -15.076 -4.142 0.978 1.00 0.86 H new ATOM 0 HG13 VAL A 39 -16.380 -5.233 0.454 1.00 0.86 H new ATOM 0 HG21 VAL A 39 -18.663 -3.663 1.679 1.00 0.86 H new ATOM 0 HG22 VAL A 39 -18.480 -5.423 1.870 1.00 0.86 H new ATOM 0 HG23 VAL A 39 -18.643 -4.384 3.306 1.00 0.86 H new ATOM 598 N GLU A 40 -14.369 -6.365 1.858 1.00 0.33 N ATOM 599 CA GLU A 40 -13.034 -6.866 1.644 1.00 0.36 C ATOM 600 C GLU A 40 -12.344 -6.189 0.479 1.00 0.38 C ATOM 601 O GLU A 40 -12.925 -6.003 -0.594 1.00 0.50 O ATOM 602 CB GLU A 40 -13.079 -8.376 1.467 1.00 0.52 C ATOM 603 CG GLU A 40 -13.248 -9.100 2.789 1.00 0.62 C ATOM 604 CD GLU A 40 -13.256 -10.608 2.645 1.00 0.89 C ATOM 605 OE1 GLU A 40 -13.347 -11.097 1.500 1.00 1.16 O ATOM 606 OE2 GLU A 40 -13.184 -11.313 3.673 1.00 1.19 O ATOM 0 H GLU A 40 -15.032 -6.566 1.110 1.00 0.33 H new ATOM 0 HA GLU A 40 -12.437 -6.629 2.525 1.00 0.36 H new ATOM 0 HB2 GLU A 40 -13.902 -8.638 0.803 1.00 0.52 H new ATOM 0 HB3 GLU A 40 -12.161 -8.712 0.985 1.00 0.52 H new ATOM 0 HG2 GLU A 40 -12.440 -8.810 3.461 1.00 0.62 H new ATOM 0 HG3 GLU A 40 -14.180 -8.781 3.255 1.00 0.62 H new ATOM 613 N TYR A 41 -11.095 -5.815 0.713 1.00 0.37 N ATOM 614 CA TYR A 41 -10.286 -5.146 -0.298 1.00 0.56 C ATOM 615 C TYR A 41 -9.028 -5.944 -0.575 1.00 0.43 C ATOM 616 O TYR A 41 -8.111 -5.962 0.249 1.00 0.40 O ATOM 617 CB TYR A 41 -9.870 -3.750 0.165 1.00 0.89 C ATOM 618 CG TYR A 41 -10.291 -2.626 -0.752 1.00 0.86 C ATOM 619 CD1 TYR A 41 -10.647 -2.871 -2.070 1.00 1.65 C ATOM 620 CD2 TYR A 41 -10.314 -1.314 -0.299 1.00 1.30 C ATOM 621 CE1 TYR A 41 -11.016 -1.839 -2.911 1.00 2.63 C ATOM 622 CE2 TYR A 41 -10.686 -0.278 -1.134 1.00 2.04 C ATOM 623 CZ TYR A 41 -11.034 -0.548 -2.439 1.00 2.72 C ATOM 624 OH TYR A 41 -11.399 0.475 -3.279 1.00 3.73 O ATOM 0 H TYR A 41 -10.616 -5.964 1.601 1.00 0.37 H new ATOM 0 HA TYR A 41 -10.893 -5.066 -1.200 1.00 0.56 H new ATOM 0 HB2 TYR A 41 -10.291 -3.570 1.154 1.00 0.89 H new ATOM 0 HB3 TYR A 41 -8.785 -3.726 0.271 1.00 0.89 H new ATOM 0 HD1 TYR A 41 -10.636 -3.884 -2.444 1.00 1.65 H new ATOM 0 HD2 TYR A 41 -10.037 -1.100 0.723 1.00 1.30 H new ATOM 0 HE1 TYR A 41 -11.289 -2.046 -3.935 1.00 2.63 H new ATOM 0 HE2 TYR A 41 -10.704 0.737 -0.766 1.00 2.04 H new ATOM 0 HH TYR A 41 -11.684 1.248 -2.748 1.00 3.73 H new ATOM 634 N LEU A 42 -8.984 -6.606 -1.715 1.00 0.41 N ATOM 635 CA LEU A 42 -7.781 -7.325 -2.112 1.00 0.38 C ATOM 636 C LEU A 42 -6.740 -6.302 -2.552 1.00 0.34 C ATOM 637 O LEU A 42 -6.894 -5.661 -3.589 1.00 0.38 O ATOM 638 CB LEU A 42 -8.088 -8.306 -3.264 1.00 0.49 C ATOM 639 CG LEU A 42 -7.109 -9.485 -3.459 1.00 0.55 C ATOM 640 CD1 LEU A 42 -5.675 -9.014 -3.659 1.00 0.71 C ATOM 641 CD2 LEU A 42 -7.186 -10.446 -2.287 1.00 0.81 C ATOM 0 H LEU A 42 -9.756 -6.663 -2.379 1.00 0.41 H new ATOM 0 HA LEU A 42 -7.404 -7.908 -1.272 1.00 0.38 H new ATOM 0 HB2 LEU A 42 -9.085 -8.716 -3.103 1.00 0.49 H new ATOM 0 HB3 LEU A 42 -8.123 -7.737 -4.193 1.00 0.49 H new ATOM 0 HG LEU A 42 -7.414 -10.005 -4.367 1.00 0.55 H new ATOM 0 HD11 LEU A 42 -5.024 -9.878 -3.792 1.00 0.71 H new ATOM 0 HD12 LEU A 42 -5.621 -8.379 -4.543 1.00 0.71 H new ATOM 0 HD13 LEU A 42 -5.353 -8.448 -2.785 1.00 0.71 H new ATOM 0 HD21 LEU A 42 -6.489 -11.269 -2.445 1.00 0.81 H new ATOM 0 HD22 LEU A 42 -6.926 -9.921 -1.368 1.00 0.81 H new ATOM 0 HD23 LEU A 42 -8.199 -10.840 -2.205 1.00 0.81 H new ATOM 653 N ALA A 43 -5.690 -6.140 -1.772 1.00 0.33 N ATOM 654 CA ALA A 43 -4.649 -5.200 -2.135 1.00 0.36 C ATOM 655 C ALA A 43 -3.493 -5.927 -2.785 1.00 0.35 C ATOM 656 O ALA A 43 -2.767 -6.687 -2.141 1.00 0.37 O ATOM 657 CB ALA A 43 -4.182 -4.396 -0.937 1.00 0.42 C ATOM 0 H ALA A 43 -5.536 -6.639 -0.896 1.00 0.33 H new ATOM 0 HA ALA A 43 -5.065 -4.494 -2.854 1.00 0.36 H new ATOM 0 HB1 ALA A 43 -3.401 -3.702 -1.247 1.00 0.42 H new ATOM 0 HB2 ALA A 43 -5.022 -3.837 -0.524 1.00 0.42 H new ATOM 0 HB3 ALA A 43 -3.787 -5.071 -0.178 1.00 0.42 H new ATOM 663 N LYS A 44 -3.351 -5.694 -4.068 1.00 0.38 N ATOM 664 CA LYS A 44 -2.357 -6.362 -4.869 1.00 0.39 C ATOM 665 C LYS A 44 -1.056 -5.577 -4.815 1.00 0.36 C ATOM 666 O LYS A 44 -0.987 -4.417 -5.230 1.00 0.47 O ATOM 667 CB LYS A 44 -2.884 -6.481 -6.295 1.00 0.53 C ATOM 668 CG LYS A 44 -2.208 -7.536 -7.151 1.00 0.95 C ATOM 669 CD LYS A 44 -3.009 -7.759 -8.424 1.00 1.58 C ATOM 670 CE LYS A 44 -4.436 -8.173 -8.100 1.00 1.61 C ATOM 671 NZ LYS A 44 -5.359 -7.989 -9.252 1.00 2.63 N ATOM 0 H LYS A 44 -3.926 -5.031 -4.588 1.00 0.38 H new ATOM 0 HA LYS A 44 -2.157 -7.363 -4.487 1.00 0.39 H new ATOM 0 HB2 LYS A 44 -3.951 -6.700 -6.253 1.00 0.53 H new ATOM 0 HB3 LYS A 44 -2.776 -5.514 -6.786 1.00 0.53 H new ATOM 0 HG2 LYS A 44 -1.194 -7.221 -7.399 1.00 0.95 H new ATOM 0 HG3 LYS A 44 -2.125 -8.470 -6.595 1.00 0.95 H new ATOM 0 HD2 LYS A 44 -3.017 -6.845 -9.018 1.00 1.58 H new ATOM 0 HD3 LYS A 44 -2.531 -8.529 -9.029 1.00 1.58 H new ATOM 0 HE2 LYS A 44 -4.447 -9.219 -7.794 1.00 1.61 H new ATOM 0 HE3 LYS A 44 -4.797 -7.589 -7.253 1.00 1.61 H new ATOM 0 HZ1 LYS A 44 -6.190 -8.602 -9.132 1.00 2.63 H new ATOM 0 HZ2 LYS A 44 -5.665 -6.996 -9.297 1.00 2.63 H new ATOM 0 HZ3 LYS A 44 -4.868 -8.240 -10.134 1.00 2.63 H new ATOM 685 N VAL A 45 -0.039 -6.213 -4.282 1.00 0.31 N ATOM 686 CA VAL A 45 1.237 -5.575 -4.028 1.00 0.33 C ATOM 687 C VAL A 45 2.274 -6.022 -5.027 1.00 0.28 C ATOM 688 O VAL A 45 2.279 -7.167 -5.469 1.00 0.30 O ATOM 689 CB VAL A 45 1.740 -5.948 -2.624 1.00 0.44 C ATOM 690 CG1 VAL A 45 3.077 -5.300 -2.309 1.00 0.82 C ATOM 691 CG2 VAL A 45 0.698 -5.586 -1.577 1.00 0.51 C ATOM 0 H VAL A 45 -0.071 -7.195 -4.009 1.00 0.31 H new ATOM 0 HA VAL A 45 1.089 -4.498 -4.111 1.00 0.33 H new ATOM 0 HB VAL A 45 1.897 -7.026 -2.603 1.00 0.44 H new ATOM 0 HG11 VAL A 45 3.395 -5.590 -1.308 1.00 0.82 H new ATOM 0 HG12 VAL A 45 3.821 -5.628 -3.035 1.00 0.82 H new ATOM 0 HG13 VAL A 45 2.976 -4.216 -2.358 1.00 0.82 H new ATOM 0 HG21 VAL A 45 1.067 -5.856 -0.588 1.00 0.51 H new ATOM 0 HG22 VAL A 45 0.504 -4.514 -1.612 1.00 0.51 H new ATOM 0 HG23 VAL A 45 -0.225 -6.129 -1.780 1.00 0.51 H new ATOM 701 N SER A 46 3.131 -5.113 -5.407 1.00 0.25 N ATOM 702 CA SER A 46 4.325 -5.475 -6.109 1.00 0.25 C ATOM 703 C SER A 46 5.507 -4.723 -5.520 1.00 0.24 C ATOM 704 O SER A 46 5.728 -3.554 -5.831 1.00 0.26 O ATOM 705 CB SER A 46 4.150 -5.194 -7.594 1.00 0.28 C ATOM 706 OG SER A 46 3.431 -6.239 -8.229 1.00 0.72 O ATOM 0 H SER A 46 3.021 -4.113 -5.240 1.00 0.25 H new ATOM 0 HA SER A 46 4.521 -6.541 -5.997 1.00 0.25 H new ATOM 0 HB2 SER A 46 3.622 -4.250 -7.729 1.00 0.28 H new ATOM 0 HB3 SER A 46 5.127 -5.082 -8.064 1.00 0.28 H new ATOM 0 HG SER A 46 2.957 -6.767 -7.553 1.00 0.72 H new ATOM 712 N VAL A 47 6.238 -5.387 -4.628 1.00 0.25 N ATOM 713 CA VAL A 47 7.379 -4.768 -3.987 1.00 0.28 C ATOM 714 C VAL A 47 8.633 -4.934 -4.830 1.00 0.28 C ATOM 715 O VAL A 47 8.985 -6.040 -5.250 1.00 0.30 O ATOM 716 CB VAL A 47 7.598 -5.223 -2.503 1.00 0.41 C ATOM 717 CG1 VAL A 47 6.976 -6.576 -2.185 1.00 1.14 C ATOM 718 CG2 VAL A 47 9.079 -5.214 -2.131 1.00 1.05 C ATOM 0 H VAL A 47 6.056 -6.348 -4.339 1.00 0.25 H new ATOM 0 HA VAL A 47 7.152 -3.704 -3.922 1.00 0.28 H new ATOM 0 HB VAL A 47 7.075 -4.489 -1.890 1.00 0.41 H new ATOM 0 HG11 VAL A 47 7.166 -6.828 -1.142 1.00 1.14 H new ATOM 0 HG12 VAL A 47 5.901 -6.532 -2.357 1.00 1.14 H new ATOM 0 HG13 VAL A 47 7.415 -7.339 -2.828 1.00 1.14 H new ATOM 0 HG21 VAL A 47 9.196 -5.534 -1.096 1.00 1.05 H new ATOM 0 HG22 VAL A 47 9.623 -5.895 -2.785 1.00 1.05 H new ATOM 0 HG23 VAL A 47 9.477 -4.206 -2.246 1.00 1.05 H new ATOM 728 N THR A 48 9.277 -3.808 -5.099 1.00 0.30 N ATOM 729 CA THR A 48 10.439 -3.771 -5.959 1.00 0.31 C ATOM 730 C THR A 48 11.700 -3.678 -5.128 1.00 0.34 C ATOM 731 O THR A 48 11.879 -2.708 -4.402 1.00 0.37 O ATOM 732 CB THR A 48 10.401 -2.561 -6.911 1.00 0.36 C ATOM 733 OG1 THR A 48 9.115 -2.464 -7.537 1.00 0.41 O ATOM 734 CG2 THR A 48 11.486 -2.688 -7.972 1.00 0.41 C ATOM 0 H THR A 48 9.005 -2.899 -4.726 1.00 0.30 H new ATOM 0 HA THR A 48 10.433 -4.689 -6.547 1.00 0.31 H new ATOM 0 HB THR A 48 10.581 -1.657 -6.330 1.00 0.36 H new ATOM 0 HG1 THR A 48 9.102 -1.691 -8.139 1.00 0.41 H new ATOM 0 HG21 THR A 48 11.447 -1.826 -8.638 1.00 0.41 H new ATOM 0 HG22 THR A 48 12.463 -2.730 -7.490 1.00 0.41 H new ATOM 0 HG23 THR A 48 11.326 -3.599 -8.549 1.00 0.41 H new ATOM 742 N ASN A 49 12.544 -4.695 -5.251 1.00 0.38 N ATOM 743 CA ASN A 49 13.842 -4.745 -4.583 1.00 0.44 C ATOM 744 C ASN A 49 14.902 -4.108 -5.481 1.00 0.42 C ATOM 745 O ASN A 49 15.070 -4.525 -6.625 1.00 0.46 O ATOM 746 CB ASN A 49 14.186 -6.209 -4.311 1.00 0.59 C ATOM 747 CG ASN A 49 15.592 -6.439 -3.800 1.00 0.73 C ATOM 748 OD1 ASN A 49 16.182 -5.589 -3.147 1.00 1.48 O ATOM 749 ND2 ASN A 49 16.129 -7.615 -4.090 1.00 0.76 N ATOM 0 H ASN A 49 12.346 -5.517 -5.822 1.00 0.38 H new ATOM 0 HA ASN A 49 13.809 -4.195 -3.642 1.00 0.44 H new ATOM 0 HB2 ASN A 49 13.479 -6.606 -3.583 1.00 0.59 H new ATOM 0 HB3 ASN A 49 14.050 -6.778 -5.231 1.00 0.59 H new ATOM 0 HD21 ASN A 49 17.070 -7.840 -3.766 1.00 0.76 H new ATOM 0 HD22 ASN A 49 15.602 -8.295 -4.637 1.00 0.76 H new ATOM 756 N PRO A 50 15.622 -3.094 -4.977 1.00 0.46 N ATOM 757 CA PRO A 50 16.540 -2.276 -5.778 1.00 0.51 C ATOM 758 C PRO A 50 17.947 -2.857 -5.961 1.00 0.53 C ATOM 759 O PRO A 50 18.798 -2.216 -6.578 1.00 0.65 O ATOM 760 CB PRO A 50 16.608 -0.988 -4.967 1.00 0.64 C ATOM 761 CG PRO A 50 16.490 -1.445 -3.557 1.00 0.73 C ATOM 762 CD PRO A 50 15.570 -2.636 -3.576 1.00 0.55 C ATOM 0 HA PRO A 50 16.180 -2.179 -6.802 1.00 0.51 H new ATOM 0 HB2 PRO A 50 17.545 -0.458 -5.138 1.00 0.64 H new ATOM 0 HB3 PRO A 50 15.802 -0.305 -5.234 1.00 0.64 H new ATOM 0 HG2 PRO A 50 17.466 -1.714 -3.152 1.00 0.73 H new ATOM 0 HG3 PRO A 50 16.089 -0.654 -2.924 1.00 0.73 H new ATOM 0 HD2 PRO A 50 15.905 -3.412 -2.888 1.00 0.55 H new ATOM 0 HD3 PRO A 50 14.557 -2.364 -3.281 1.00 0.55 H new ATOM 770 N TYR A 51 18.215 -4.049 -5.436 1.00 0.53 N ATOM 771 CA TYR A 51 19.507 -4.675 -5.653 1.00 0.68 C ATOM 772 C TYR A 51 19.316 -6.129 -6.015 1.00 0.88 C ATOM 773 O TYR A 51 18.265 -6.710 -5.761 1.00 1.88 O ATOM 774 CB TYR A 51 20.450 -4.548 -4.451 1.00 0.74 C ATOM 775 CG TYR A 51 20.152 -5.470 -3.299 1.00 0.88 C ATOM 776 CD1 TYR A 51 19.014 -5.323 -2.530 1.00 1.22 C ATOM 777 CD2 TYR A 51 21.031 -6.494 -2.982 1.00 1.06 C ATOM 778 CE1 TYR A 51 18.758 -6.174 -1.477 1.00 1.63 C ATOM 779 CE2 TYR A 51 20.782 -7.345 -1.931 1.00 1.36 C ATOM 780 CZ TYR A 51 19.645 -7.186 -1.183 1.00 1.64 C ATOM 781 OH TYR A 51 19.396 -8.040 -0.132 1.00 2.08 O ATOM 0 H TYR A 51 17.564 -4.590 -4.867 1.00 0.53 H new ATOM 0 HA TYR A 51 19.983 -4.143 -6.476 1.00 0.68 H new ATOM 0 HB2 TYR A 51 21.470 -4.733 -4.789 1.00 0.74 H new ATOM 0 HB3 TYR A 51 20.416 -3.520 -4.090 1.00 0.74 H new ATOM 0 HD1 TYR A 51 18.316 -4.531 -2.757 1.00 1.22 H new ATOM 0 HD2 TYR A 51 21.927 -6.626 -3.571 1.00 1.06 H new ATOM 0 HE1 TYR A 51 17.864 -6.048 -0.884 1.00 1.63 H new ATOM 0 HE2 TYR A 51 21.480 -8.135 -1.696 1.00 1.36 H new ATOM 0 HH TYR A 51 20.121 -8.696 -0.064 1.00 2.08 H new ATOM 791 N SER A 52 20.349 -6.717 -6.567 1.00 0.69 N ATOM 792 CA SER A 52 20.235 -7.982 -7.256 1.00 0.66 C ATOM 793 C SER A 52 20.230 -9.196 -6.324 1.00 0.65 C ATOM 794 O SER A 52 20.514 -10.306 -6.763 1.00 0.77 O ATOM 795 CB SER A 52 21.379 -8.067 -8.247 1.00 0.80 C ATOM 796 OG SER A 52 22.623 -7.872 -7.594 1.00 1.51 O ATOM 0 H SER A 52 21.294 -6.333 -6.552 1.00 0.69 H new ATOM 0 HA SER A 52 19.268 -8.012 -7.759 1.00 0.66 H new ATOM 0 HB2 SER A 52 21.369 -9.040 -8.739 1.00 0.80 H new ATOM 0 HB3 SER A 52 21.249 -7.315 -9.025 1.00 0.80 H new ATOM 0 HG SER A 52 23.349 -7.932 -8.249 1.00 1.51 H new ATOM 802 N HIS A 53 19.893 -9.008 -5.052 1.00 0.58 N ATOM 803 CA HIS A 53 19.769 -10.153 -4.153 1.00 0.66 C ATOM 804 C HIS A 53 18.464 -10.105 -3.371 1.00 0.65 C ATOM 805 O HIS A 53 18.090 -9.071 -2.823 1.00 1.08 O ATOM 806 CB HIS A 53 20.956 -10.251 -3.186 1.00 0.74 C ATOM 807 CG HIS A 53 22.280 -10.382 -3.872 1.00 0.95 C ATOM 808 ND1 HIS A 53 23.324 -9.505 -3.674 1.00 1.06 N ATOM 809 CD2 HIS A 53 22.715 -11.277 -4.787 1.00 1.41 C ATOM 810 CE1 HIS A 53 24.334 -9.849 -4.447 1.00 1.43 C ATOM 811 NE2 HIS A 53 23.992 -10.923 -5.131 1.00 1.67 N ATOM 0 H HIS A 53 19.705 -8.100 -4.627 1.00 0.58 H new ATOM 0 HA HIS A 53 19.768 -11.044 -4.780 1.00 0.66 H new ATOM 0 HB2 HIS A 53 20.971 -9.365 -2.552 1.00 0.74 H new ATOM 0 HB3 HIS A 53 20.810 -11.109 -2.530 1.00 0.74 H new ATOM 0 HD2 HIS A 53 22.158 -12.117 -5.175 1.00 1.41 H new ATOM 0 HE1 HIS A 53 25.283 -9.337 -4.510 1.00 1.43 H new ATOM 0 HE2 HIS A 53 24.582 -11.410 -5.806 1.00 1.67 H new ATOM 820 N SER A 54 17.760 -11.224 -3.398 1.00 0.55 N ATOM 821 CA SER A 54 16.595 -11.485 -2.567 1.00 0.51 C ATOM 822 C SER A 54 16.748 -10.962 -1.143 1.00 0.47 C ATOM 823 O SER A 54 17.438 -11.576 -0.366 1.00 0.51 O ATOM 824 CB SER A 54 16.443 -13.004 -2.474 1.00 0.61 C ATOM 825 OG SER A 54 16.663 -13.610 -3.737 1.00 1.39 O ATOM 0 H SER A 54 17.990 -12.001 -4.018 1.00 0.55 H new ATOM 0 HA SER A 54 15.740 -10.983 -3.019 1.00 0.51 H new ATOM 0 HB2 SER A 54 17.151 -13.401 -1.747 1.00 0.61 H new ATOM 0 HB3 SER A 54 15.444 -13.253 -2.115 1.00 0.61 H new ATOM 0 HG SER A 54 16.027 -13.248 -4.389 1.00 1.39 H new ATOM 831 N ILE A 55 16.010 -9.928 -0.750 1.00 0.44 N ATOM 832 CA ILE A 55 16.105 -9.459 0.631 1.00 0.49 C ATOM 833 C ILE A 55 15.408 -10.467 1.510 1.00 0.58 C ATOM 834 O ILE A 55 14.839 -11.403 0.993 1.00 1.03 O ATOM 835 CB ILE A 55 15.433 -8.083 0.843 1.00 0.49 C ATOM 836 CG1 ILE A 55 14.111 -7.988 0.087 1.00 0.47 C ATOM 837 CG2 ILE A 55 16.367 -6.965 0.440 1.00 0.48 C ATOM 838 CD1 ILE A 55 13.424 -6.647 0.223 1.00 0.56 C ATOM 0 H ILE A 55 15.360 -9.413 -1.344 1.00 0.44 H new ATOM 0 HA ILE A 55 17.161 -9.350 0.878 1.00 0.49 H new ATOM 0 HB ILE A 55 15.213 -7.979 1.905 1.00 0.49 H new ATOM 0 HG12 ILE A 55 14.292 -8.187 -0.969 1.00 0.47 H new ATOM 0 HG13 ILE A 55 13.440 -8.768 0.448 1.00 0.47 H new ATOM 0 HG21 ILE A 55 15.875 -6.005 0.597 1.00 0.48 H new ATOM 0 HG22 ILE A 55 17.273 -7.012 1.045 1.00 0.48 H new ATOM 0 HG23 ILE A 55 16.628 -7.071 -0.613 1.00 0.48 H new ATOM 0 HD11 ILE A 55 12.492 -6.657 -0.342 1.00 0.56 H new ATOM 0 HD12 ILE A 55 13.210 -6.453 1.274 1.00 0.56 H new ATOM 0 HD13 ILE A 55 14.075 -5.864 -0.165 1.00 0.56 H new ATOM 850 N PRO A 56 15.516 -10.376 2.831 1.00 0.35 N ATOM 851 CA PRO A 56 14.876 -11.335 3.703 1.00 0.34 C ATOM 852 C PRO A 56 13.446 -10.962 4.062 1.00 0.30 C ATOM 853 O PRO A 56 12.520 -11.742 3.842 1.00 0.32 O ATOM 854 CB PRO A 56 15.753 -11.328 4.950 1.00 0.37 C ATOM 855 CG PRO A 56 16.709 -10.176 4.806 1.00 0.35 C ATOM 856 CD PRO A 56 16.290 -9.396 3.590 1.00 0.35 C ATOM 0 HA PRO A 56 14.793 -12.310 3.222 1.00 0.34 H new ATOM 0 HB2 PRO A 56 15.146 -11.216 5.848 1.00 0.37 H new ATOM 0 HB3 PRO A 56 16.294 -12.269 5.047 1.00 0.37 H new ATOM 0 HG2 PRO A 56 16.686 -9.545 5.694 1.00 0.35 H new ATOM 0 HG3 PRO A 56 17.732 -10.537 4.697 1.00 0.35 H new ATOM 0 HD2 PRO A 56 15.691 -8.524 3.854 1.00 0.35 H new ATOM 0 HD3 PRO A 56 17.149 -9.033 3.026 1.00 0.35 H new ATOM 864 N ILE A 57 13.267 -9.786 4.641 1.00 0.29 N ATOM 865 CA ILE A 57 11.964 -9.417 5.190 1.00 0.30 C ATOM 866 C ILE A 57 11.642 -7.945 4.971 1.00 0.27 C ATOM 867 O ILE A 57 12.534 -7.123 4.789 1.00 0.30 O ATOM 868 CB ILE A 57 11.903 -9.793 6.697 1.00 0.38 C ATOM 869 CG1 ILE A 57 11.731 -11.305 6.828 1.00 0.58 C ATOM 870 CG2 ILE A 57 10.796 -9.060 7.448 1.00 0.38 C ATOM 871 CD1 ILE A 57 11.600 -11.787 8.246 1.00 1.23 C ATOM 0 H ILE A 57 13.993 -9.077 4.744 1.00 0.29 H new ATOM 0 HA ILE A 57 11.200 -9.980 4.654 1.00 0.30 H new ATOM 0 HB ILE A 57 12.840 -9.479 7.156 1.00 0.38 H new ATOM 0 HG12 ILE A 57 10.846 -11.609 6.269 1.00 0.58 H new ATOM 0 HG13 ILE A 57 12.586 -11.799 6.365 1.00 0.58 H new ATOM 0 HG21 ILE A 57 10.804 -9.364 8.495 1.00 0.38 H new ATOM 0 HG22 ILE A 57 10.961 -7.985 7.381 1.00 0.38 H new ATOM 0 HG23 ILE A 57 9.831 -9.307 7.006 1.00 0.38 H new ATOM 0 HD11 ILE A 57 11.482 -12.871 8.253 1.00 1.23 H new ATOM 0 HD12 ILE A 57 12.495 -11.516 8.806 1.00 1.23 H new ATOM 0 HD13 ILE A 57 10.728 -11.324 8.709 1.00 1.23 H new ATOM 883 N CYS A 58 10.355 -7.630 4.968 1.00 0.26 N ATOM 884 CA CYS A 58 9.902 -6.280 4.767 1.00 0.24 C ATOM 885 C CYS A 58 8.698 -5.976 5.643 1.00 0.23 C ATOM 886 O CYS A 58 8.261 -6.788 6.455 1.00 0.25 O ATOM 887 CB CYS A 58 9.539 -6.045 3.303 1.00 0.26 C ATOM 888 SG CYS A 58 8.322 -7.208 2.643 1.00 1.15 S ATOM 0 H CYS A 58 9.605 -8.308 5.105 1.00 0.26 H new ATOM 0 HA CYS A 58 10.718 -5.613 5.044 1.00 0.24 H new ATOM 0 HB2 CYS A 58 9.152 -5.032 3.195 1.00 0.26 H new ATOM 0 HB3 CYS A 58 10.446 -6.106 2.702 1.00 0.26 H new ATOM 0 HG CYS A 58 8.081 -6.923 1.398 1.00 1.15 H new ATOM 894 N GLU A 59 8.207 -4.779 5.465 1.00 0.25 N ATOM 895 CA GLU A 59 7.030 -4.316 6.149 1.00 0.27 C ATOM 896 C GLU A 59 6.128 -3.580 5.185 1.00 0.29 C ATOM 897 O GLU A 59 6.496 -2.538 4.640 1.00 0.32 O ATOM 898 CB GLU A 59 7.430 -3.412 7.318 1.00 0.32 C ATOM 899 CG GLU A 59 6.259 -2.804 8.074 1.00 0.39 C ATOM 900 CD GLU A 59 6.713 -1.864 9.172 1.00 0.67 C ATOM 901 OE1 GLU A 59 7.098 -0.717 8.860 1.00 1.04 O ATOM 902 OE2 GLU A 59 6.699 -2.270 10.351 1.00 1.36 O ATOM 0 H GLU A 59 8.618 -4.091 4.834 1.00 0.25 H new ATOM 0 HA GLU A 59 6.483 -5.171 6.545 1.00 0.27 H new ATOM 0 HB2 GLU A 59 8.037 -3.989 8.016 1.00 0.32 H new ATOM 0 HB3 GLU A 59 8.059 -2.607 6.939 1.00 0.32 H new ATOM 0 HG2 GLU A 59 5.620 -2.263 7.376 1.00 0.39 H new ATOM 0 HG3 GLU A 59 5.655 -3.601 8.507 1.00 0.39 H new ATOM 909 N ILE A 60 4.961 -4.150 4.963 1.00 0.32 N ATOM 910 CA ILE A 60 3.907 -3.444 4.279 1.00 0.34 C ATOM 911 C ILE A 60 2.952 -2.831 5.298 1.00 0.31 C ATOM 912 O ILE A 60 2.215 -3.517 6.006 1.00 0.36 O ATOM 913 CB ILE A 60 3.148 -4.322 3.240 1.00 0.48 C ATOM 914 CG1 ILE A 60 3.276 -5.821 3.528 1.00 0.33 C ATOM 915 CG2 ILE A 60 3.657 -4.034 1.837 1.00 0.99 C ATOM 916 CD1 ILE A 60 2.440 -6.311 4.687 1.00 1.05 C ATOM 0 H ILE A 60 4.723 -5.100 5.248 1.00 0.32 H new ATOM 0 HA ILE A 60 4.374 -2.648 3.698 1.00 0.34 H new ATOM 0 HB ILE A 60 2.093 -4.059 3.319 1.00 0.48 H new ATOM 0 HG12 ILE A 60 2.993 -6.375 2.633 1.00 0.33 H new ATOM 0 HG13 ILE A 60 4.322 -6.051 3.728 1.00 0.33 H new ATOM 0 HG21 ILE A 60 3.119 -4.654 1.120 1.00 0.99 H new ATOM 0 HG22 ILE A 60 3.496 -2.982 1.600 1.00 0.99 H new ATOM 0 HG23 ILE A 60 4.722 -4.259 1.783 1.00 0.99 H new ATOM 0 HD11 ILE A 60 2.593 -7.382 4.819 1.00 1.05 H new ATOM 0 HD12 ILE A 60 2.736 -5.788 5.596 1.00 1.05 H new ATOM 0 HD13 ILE A 60 1.387 -6.117 4.484 1.00 1.05 H new ATOM 928 N SER A 61 3.024 -1.518 5.367 1.00 0.26 N ATOM 929 CA SER A 61 2.210 -0.746 6.287 1.00 0.25 C ATOM 930 C SER A 61 1.237 0.096 5.489 1.00 0.24 C ATOM 931 O SER A 61 1.598 1.131 4.941 1.00 0.24 O ATOM 932 CB SER A 61 3.083 0.115 7.205 1.00 0.29 C ATOM 933 OG SER A 61 4.006 0.897 6.466 1.00 0.83 O ATOM 0 H SER A 61 3.647 -0.955 4.788 1.00 0.26 H new ATOM 0 HA SER A 61 1.648 -1.420 6.933 1.00 0.25 H new ATOM 0 HB2 SER A 61 2.448 0.769 7.803 1.00 0.29 H new ATOM 0 HB3 SER A 61 3.624 -0.527 7.900 1.00 0.29 H new ATOM 0 HG SER A 61 4.457 0.332 5.804 1.00 0.83 H new ATOM 939 N PHE A 62 -0.003 -0.335 5.437 1.00 0.24 N ATOM 940 CA PHE A 62 -0.931 0.182 4.460 1.00 0.25 C ATOM 941 C PHE A 62 -2.056 0.920 5.140 1.00 0.26 C ATOM 942 O PHE A 62 -2.592 0.476 6.150 1.00 0.30 O ATOM 943 CB PHE A 62 -1.484 -0.952 3.590 1.00 0.27 C ATOM 944 CG PHE A 62 -1.916 -2.159 4.380 1.00 0.29 C ATOM 945 CD1 PHE A 62 -1.012 -3.163 4.693 1.00 0.34 C ATOM 946 CD2 PHE A 62 -3.231 -2.295 4.796 1.00 0.31 C ATOM 947 CE1 PHE A 62 -1.413 -4.277 5.406 1.00 0.40 C ATOM 948 CE2 PHE A 62 -3.639 -3.406 5.505 1.00 0.37 C ATOM 949 CZ PHE A 62 -2.696 -4.376 5.866 1.00 0.40 C ATOM 0 H PHE A 62 -0.391 -1.043 6.061 1.00 0.24 H new ATOM 0 HA PHE A 62 -0.398 0.881 3.816 1.00 0.25 H new ATOM 0 HB2 PHE A 62 -2.333 -0.579 3.018 1.00 0.27 H new ATOM 0 HB3 PHE A 62 -0.722 -1.252 2.871 1.00 0.27 H new ATOM 0 HD1 PHE A 62 0.017 -3.073 4.376 1.00 0.34 H new ATOM 0 HD2 PHE A 62 -3.946 -1.520 4.562 1.00 0.31 H new ATOM 0 HE1 PHE A 62 -0.709 -5.073 5.600 1.00 0.40 H new ATOM 0 HE2 PHE A 62 -4.677 -3.526 5.779 1.00 0.37 H new ATOM 0 HZ PHE A 62 -2.981 -5.199 6.505 1.00 0.40 H new ATOM 959 N THR A 63 -2.360 2.063 4.598 1.00 0.25 N ATOM 960 CA THR A 63 -3.451 2.873 5.073 1.00 0.27 C ATOM 961 C THR A 63 -4.300 3.307 3.893 1.00 0.25 C ATOM 962 O THR A 63 -3.869 4.095 3.059 1.00 0.27 O ATOM 963 CB THR A 63 -2.933 4.102 5.840 1.00 0.32 C ATOM 964 OG1 THR A 63 -1.962 3.686 6.811 1.00 0.36 O ATOM 965 CG2 THR A 63 -4.072 4.824 6.539 1.00 0.38 C ATOM 0 H THR A 63 -1.856 2.465 3.808 1.00 0.25 H new ATOM 0 HA THR A 63 -4.056 2.283 5.762 1.00 0.27 H new ATOM 0 HB THR A 63 -2.475 4.787 5.127 1.00 0.32 H new ATOM 0 HG1 THR A 63 -1.631 4.469 7.299 1.00 0.36 H new ATOM 0 HG21 THR A 63 -3.680 5.689 7.074 1.00 0.38 H new ATOM 0 HG22 THR A 63 -4.801 5.154 5.800 1.00 0.38 H new ATOM 0 HG23 THR A 63 -4.553 4.147 7.246 1.00 0.38 H new ATOM 973 N PHE A 64 -5.498 2.781 3.820 1.00 0.24 N ATOM 974 CA PHE A 64 -6.378 3.061 2.707 1.00 0.24 C ATOM 975 C PHE A 64 -7.351 4.164 3.074 1.00 0.22 C ATOM 976 O PHE A 64 -7.828 4.230 4.201 1.00 0.23 O ATOM 977 CB PHE A 64 -7.153 1.813 2.299 1.00 0.27 C ATOM 978 CG PHE A 64 -6.301 0.749 1.686 1.00 0.43 C ATOM 979 CD1 PHE A 64 -5.992 0.786 0.336 1.00 0.58 C ATOM 980 CD2 PHE A 64 -5.806 -0.288 2.458 1.00 0.65 C ATOM 981 CE1 PHE A 64 -5.204 -0.191 -0.229 1.00 0.84 C ATOM 982 CE2 PHE A 64 -5.017 -1.269 1.895 1.00 0.90 C ATOM 983 CZ PHE A 64 -4.716 -1.217 0.550 1.00 0.96 C ATOM 0 H PHE A 64 -5.890 2.153 4.522 1.00 0.24 H new ATOM 0 HA PHE A 64 -5.765 3.383 1.865 1.00 0.24 H new ATOM 0 HB2 PHE A 64 -7.654 1.404 3.177 1.00 0.27 H new ATOM 0 HB3 PHE A 64 -7.932 2.095 1.590 1.00 0.27 H new ATOM 0 HD1 PHE A 64 -6.373 1.588 -0.278 1.00 0.58 H new ATOM 0 HD2 PHE A 64 -6.040 -0.329 3.512 1.00 0.65 H new ATOM 0 HE1 PHE A 64 -4.968 -0.153 -1.282 1.00 0.84 H new ATOM 0 HE2 PHE A 64 -4.636 -2.075 2.505 1.00 0.90 H new ATOM 0 HZ PHE A 64 -4.096 -1.982 0.107 1.00 0.96 H new ATOM 993 N HIS A 65 -7.596 5.051 2.131 1.00 0.24 N ATOM 994 CA HIS A 65 -8.568 6.124 2.287 1.00 0.26 C ATOM 995 C HIS A 65 -9.454 6.125 1.067 1.00 0.24 C ATOM 996 O HIS A 65 -8.997 5.775 -0.010 1.00 0.36 O ATOM 997 CB HIS A 65 -7.904 7.501 2.407 1.00 0.42 C ATOM 998 CG HIS A 65 -6.932 7.668 3.538 1.00 0.51 C ATOM 999 ND1 HIS A 65 -6.836 8.831 4.269 1.00 1.02 N ATOM 1000 CD2 HIS A 65 -5.977 6.843 4.028 1.00 0.53 C ATOM 1001 CE1 HIS A 65 -5.868 8.714 5.154 1.00 1.29 C ATOM 1002 NE2 HIS A 65 -5.328 7.518 5.031 1.00 1.02 N ATOM 0 H HIS A 65 -7.125 5.051 1.226 1.00 0.24 H new ATOM 0 HA HIS A 65 -9.129 5.947 3.204 1.00 0.26 H new ATOM 0 HB2 HIS A 65 -7.384 7.714 1.473 1.00 0.42 H new ATOM 0 HB3 HIS A 65 -8.687 8.252 2.514 1.00 0.42 H new ATOM 0 HD1 HIS A 65 -7.424 9.655 4.144 1.00 1.02 H new ATOM 0 HD2 HIS A 65 -5.765 5.839 3.692 1.00 0.53 H new ATOM 0 HE1 HIS A 65 -5.567 9.472 5.862 1.00 1.29 H new ATOM 1011 N SER A 66 -10.719 6.450 1.221 1.00 0.22 N ATOM 1012 CA SER A 66 -11.582 6.535 0.063 1.00 0.25 C ATOM 1013 C SER A 66 -11.923 7.978 -0.263 1.00 0.24 C ATOM 1014 O SER A 66 -11.103 8.680 -0.849 1.00 0.30 O ATOM 1015 CB SER A 66 -12.846 5.718 0.265 1.00 0.38 C ATOM 1016 OG SER A 66 -13.640 5.702 -0.898 1.00 1.27 O ATOM 0 H SER A 66 -11.165 6.656 2.115 1.00 0.22 H new ATOM 0 HA SER A 66 -11.039 6.118 -0.785 1.00 0.25 H new ATOM 0 HB2 SER A 66 -12.581 4.697 0.540 1.00 0.38 H new ATOM 0 HB3 SER A 66 -13.420 6.133 1.094 1.00 0.38 H new ATOM 0 HG SER A 66 -13.566 4.827 -1.332 1.00 1.27 H new ATOM 1022 N ALA A 67 -13.109 8.436 0.149 1.00 0.24 N ATOM 1023 CA ALA A 67 -13.568 9.764 -0.220 1.00 0.28 C ATOM 1024 C ALA A 67 -12.609 10.793 0.346 1.00 0.30 C ATOM 1025 O ALA A 67 -12.076 11.637 -0.374 1.00 0.36 O ATOM 1026 CB ALA A 67 -14.981 10.004 0.287 1.00 0.32 C ATOM 0 H ALA A 67 -13.758 7.907 0.732 1.00 0.24 H new ATOM 0 HA ALA A 67 -13.589 9.852 -1.306 1.00 0.28 H new ATOM 0 HB1 ALA A 67 -15.306 11.004 -0.000 1.00 0.32 H new ATOM 0 HB2 ALA A 67 -15.654 9.265 -0.148 1.00 0.32 H new ATOM 0 HB3 ALA A 67 -14.998 9.915 1.373 1.00 0.32 H new ATOM 1032 N GLY A 68 -12.408 10.742 1.655 1.00 0.29 N ATOM 1033 CA GLY A 68 -11.298 11.432 2.270 1.00 0.32 C ATOM 1034 C GLY A 68 -11.120 10.898 3.670 1.00 0.34 C ATOM 1035 O GLY A 68 -10.496 11.513 4.531 1.00 0.39 O ATOM 0 H GLY A 68 -13.002 10.229 2.306 1.00 0.29 H new ATOM 0 HA2 GLY A 68 -10.389 11.281 1.688 1.00 0.32 H new ATOM 0 HA3 GLY A 68 -11.486 12.505 2.295 1.00 0.32 H new ATOM 1039 N ARG A 69 -11.708 9.730 3.884 1.00 0.36 N ATOM 1040 CA ARG A 69 -11.723 9.076 5.171 1.00 0.46 C ATOM 1041 C ARG A 69 -10.915 7.792 5.072 1.00 0.52 C ATOM 1042 O ARG A 69 -10.572 7.373 3.969 1.00 1.08 O ATOM 1043 CB ARG A 69 -13.177 8.809 5.556 1.00 0.48 C ATOM 1044 CG ARG A 69 -13.978 8.211 4.421 1.00 0.47 C ATOM 1045 CD ARG A 69 -15.464 8.247 4.697 1.00 0.58 C ATOM 1046 NE ARG A 69 -16.014 9.602 4.652 1.00 0.55 N ATOM 1047 CZ ARG A 69 -16.622 10.214 5.669 1.00 1.05 C ATOM 1048 NH1 ARG A 69 -16.585 9.701 6.892 1.00 1.97 N ATOM 1049 NH2 ARG A 69 -17.227 11.374 5.465 1.00 1.04 N ATOM 0 H ARG A 69 -12.193 9.208 3.154 1.00 0.36 H new ATOM 0 HA ARG A 69 -11.273 9.698 5.945 1.00 0.46 H new ATOM 0 HB2 ARG A 69 -13.205 8.133 6.411 1.00 0.48 H new ATOM 0 HB3 ARG A 69 -13.643 9.742 5.872 1.00 0.48 H new ATOM 0 HG2 ARG A 69 -13.767 8.756 3.501 1.00 0.47 H new ATOM 0 HG3 ARG A 69 -13.664 7.180 4.259 1.00 0.47 H new ATOM 0 HD2 ARG A 69 -15.980 7.625 3.966 1.00 0.58 H new ATOM 0 HD3 ARG A 69 -15.658 7.813 5.678 1.00 0.58 H new ATOM 0 HE ARG A 69 -15.926 10.118 3.776 1.00 0.55 H new ATOM 0 HH11 ARG A 69 -16.087 8.828 7.064 1.00 1.97 H new ATOM 0 HH12 ARG A 69 -17.055 10.180 7.660 1.00 1.97 H new ATOM 0 HH21 ARG A 69 -17.226 11.793 4.535 1.00 1.04 H new ATOM 0 HH22 ARG A 69 -17.694 11.848 6.238 1.00 1.04 H new ATOM 1063 N GLU A 70 -10.655 7.138 6.187 1.00 0.52 N ATOM 1064 CA GLU A 70 -9.672 6.084 6.208 1.00 0.52 C ATOM 1065 C GLU A 70 -10.342 4.739 6.060 1.00 0.67 C ATOM 1066 O GLU A 70 -10.828 4.143 7.018 1.00 1.28 O ATOM 1067 CB GLU A 70 -8.792 6.154 7.464 1.00 0.66 C ATOM 1068 CG GLU A 70 -9.552 6.370 8.762 1.00 1.35 C ATOM 1069 CD GLU A 70 -8.619 6.607 9.931 1.00 1.91 C ATOM 1070 OE1 GLU A 70 -8.099 7.730 10.071 1.00 2.12 O ATOM 1071 OE2 GLU A 70 -8.411 5.671 10.729 1.00 2.61 O ATOM 0 H GLU A 70 -11.109 7.319 7.082 1.00 0.52 H new ATOM 0 HA GLU A 70 -9.005 6.221 5.357 1.00 0.52 H new ATOM 0 HB2 GLU A 70 -8.221 5.229 7.543 1.00 0.66 H new ATOM 0 HB3 GLU A 70 -8.072 6.963 7.342 1.00 0.66 H new ATOM 0 HG2 GLU A 70 -10.221 7.224 8.653 1.00 1.35 H new ATOM 0 HG3 GLU A 70 -10.176 5.500 8.966 1.00 1.35 H new ATOM 1078 N ILE A 71 -10.388 4.312 4.815 1.00 0.28 N ATOM 1079 CA ILE A 71 -10.960 3.047 4.417 1.00 0.28 C ATOM 1080 C ILE A 71 -10.451 1.893 5.272 1.00 0.29 C ATOM 1081 O ILE A 71 -11.228 1.056 5.717 1.00 0.33 O ATOM 1082 CB ILE A 71 -10.640 2.787 2.931 1.00 0.31 C ATOM 1083 CG1 ILE A 71 -11.755 3.321 2.052 1.00 0.37 C ATOM 1084 CG2 ILE A 71 -10.399 1.323 2.662 1.00 0.30 C ATOM 1085 CD1 ILE A 71 -13.110 2.772 2.416 1.00 0.40 C ATOM 0 H ILE A 71 -10.018 4.852 4.033 1.00 0.28 H new ATOM 0 HA ILE A 71 -12.039 3.105 4.563 1.00 0.28 H new ATOM 0 HB ILE A 71 -9.719 3.317 2.689 1.00 0.31 H new ATOM 0 HG12 ILE A 71 -11.778 4.408 2.126 1.00 0.37 H new ATOM 0 HG13 ILE A 71 -11.538 3.077 1.012 1.00 0.37 H new ATOM 0 HG21 ILE A 71 -10.177 1.179 1.605 1.00 0.30 H new ATOM 0 HG22 ILE A 71 -9.556 0.977 3.260 1.00 0.30 H new ATOM 0 HG23 ILE A 71 -11.290 0.753 2.926 1.00 0.30 H new ATOM 0 HD11 ILE A 71 -13.864 3.193 1.750 1.00 0.40 H new ATOM 0 HD12 ILE A 71 -13.102 1.687 2.315 1.00 0.40 H new ATOM 0 HD13 ILE A 71 -13.346 3.039 3.446 1.00 0.40 H new ATOM 1097 N GLY A 72 -9.154 1.864 5.509 1.00 0.29 N ATOM 1098 CA GLY A 72 -8.578 0.755 6.240 1.00 0.36 C ATOM 1099 C GLY A 72 -7.119 0.980 6.535 1.00 0.34 C ATOM 1100 O GLY A 72 -6.524 1.913 6.012 1.00 0.49 O ATOM 0 H GLY A 72 -8.491 2.581 5.213 1.00 0.29 H new ATOM 0 HA2 GLY A 72 -9.121 0.614 7.175 1.00 0.36 H new ATOM 0 HA3 GLY A 72 -8.695 -0.162 5.662 1.00 0.36 H new ATOM 1104 N LYS A 73 -6.542 0.156 7.389 1.00 0.36 N ATOM 1105 CA LYS A 73 -5.125 0.258 7.679 1.00 0.35 C ATOM 1106 C LYS A 73 -4.613 -1.016 8.334 1.00 0.39 C ATOM 1107 O LYS A 73 -5.381 -1.773 8.933 1.00 0.47 O ATOM 1108 CB LYS A 73 -4.843 1.451 8.601 1.00 0.44 C ATOM 1109 CG LYS A 73 -5.304 1.226 10.031 1.00 0.61 C ATOM 1110 CD LYS A 73 -6.810 1.387 10.188 1.00 0.68 C ATOM 1111 CE LYS A 73 -7.233 2.841 10.077 1.00 1.26 C ATOM 1112 NZ LYS A 73 -6.749 3.649 11.227 1.00 1.81 N ATOM 0 H LYS A 73 -7.029 -0.587 7.891 1.00 0.36 H new ATOM 0 HA LYS A 73 -4.605 0.406 6.733 1.00 0.35 H new ATOM 0 HB2 LYS A 73 -3.773 1.658 8.600 1.00 0.44 H new ATOM 0 HB3 LYS A 73 -5.339 2.336 8.201 1.00 0.44 H new ATOM 0 HG2 LYS A 73 -5.013 0.225 10.350 1.00 0.61 H new ATOM 0 HG3 LYS A 73 -4.796 1.931 10.689 1.00 0.61 H new ATOM 0 HD2 LYS A 73 -7.320 0.800 9.424 1.00 0.68 H new ATOM 0 HD3 LYS A 73 -7.120 0.990 11.155 1.00 0.68 H new ATOM 0 HE2 LYS A 73 -6.846 3.262 9.149 1.00 1.26 H new ATOM 0 HE3 LYS A 73 -8.320 2.900 10.024 1.00 1.26 H new ATOM 0 HZ1 LYS A 73 -7.208 4.582 11.214 1.00 1.81 H new ATOM 0 HZ2 LYS A 73 -6.981 3.161 12.116 1.00 1.81 H new ATOM 0 HZ3 LYS A 73 -5.718 3.770 11.157 1.00 1.81 H new ATOM 1126 N GLY A 74 -3.322 -1.254 8.191 1.00 0.39 N ATOM 1127 CA GLY A 74 -2.672 -2.353 8.864 1.00 0.43 C ATOM 1128 C GLY A 74 -1.186 -2.320 8.619 1.00 0.34 C ATOM 1129 O GLY A 74 -0.733 -1.752 7.624 1.00 0.32 O ATOM 0 H GLY A 74 -2.702 -0.692 7.608 1.00 0.39 H new ATOM 0 HA2 GLY A 74 -2.871 -2.300 9.934 1.00 0.43 H new ATOM 0 HA3 GLY A 74 -3.084 -3.298 8.510 1.00 0.43 H new ATOM 1133 N LYS A 75 -0.421 -2.901 9.520 1.00 0.37 N ATOM 1134 CA LYS A 75 1.024 -2.932 9.383 1.00 0.37 C ATOM 1135 C LYS A 75 1.526 -4.340 9.635 1.00 0.39 C ATOM 1136 O LYS A 75 1.325 -4.895 10.711 1.00 0.50 O ATOM 1137 CB LYS A 75 1.667 -1.943 10.359 1.00 0.56 C ATOM 1138 CG LYS A 75 1.192 -0.513 10.159 1.00 0.84 C ATOM 1139 CD LYS A 75 1.793 0.430 11.185 1.00 0.90 C ATOM 1140 CE LYS A 75 1.235 1.836 11.033 1.00 1.17 C ATOM 1141 NZ LYS A 75 1.794 2.766 12.048 1.00 1.72 N ATOM 0 H LYS A 75 -0.776 -3.360 10.359 1.00 0.37 H new ATOM 0 HA LYS A 75 1.299 -2.637 8.370 1.00 0.37 H new ATOM 0 HB2 LYS A 75 1.445 -2.254 11.380 1.00 0.56 H new ATOM 0 HB3 LYS A 75 2.750 -1.979 10.243 1.00 0.56 H new ATOM 0 HG2 LYS A 75 1.460 -0.178 9.157 1.00 0.84 H new ATOM 0 HG3 LYS A 75 0.105 -0.478 10.227 1.00 0.84 H new ATOM 0 HD2 LYS A 75 1.585 0.060 12.189 1.00 0.90 H new ATOM 0 HD3 LYS A 75 2.877 0.452 11.072 1.00 0.90 H new ATOM 0 HE2 LYS A 75 1.460 2.210 10.034 1.00 1.17 H new ATOM 0 HE3 LYS A 75 0.149 1.808 11.125 1.00 1.17 H new ATOM 0 HZ1 LYS A 75 1.389 3.714 11.911 1.00 1.72 H new ATOM 0 HZ2 LYS A 75 1.557 2.423 13.001 1.00 1.72 H new ATOM 0 HZ3 LYS A 75 2.828 2.813 11.944 1.00 1.72 H new ATOM 1155 N ILE A 76 2.173 -4.922 8.637 1.00 0.35 N ATOM 1156 CA ILE A 76 2.546 -6.322 8.700 1.00 0.39 C ATOM 1157 C ILE A 76 3.995 -6.521 8.269 1.00 0.34 C ATOM 1158 O ILE A 76 4.360 -6.223 7.131 1.00 0.35 O ATOM 1159 CB ILE A 76 1.637 -7.181 7.792 1.00 0.45 C ATOM 1160 CG1 ILE A 76 0.159 -6.981 8.148 1.00 0.51 C ATOM 1161 CG2 ILE A 76 2.012 -8.651 7.903 1.00 0.56 C ATOM 1162 CD1 ILE A 76 -0.795 -7.655 7.185 1.00 0.73 C ATOM 0 H ILE A 76 2.449 -4.447 7.778 1.00 0.35 H new ATOM 0 HA ILE A 76 2.427 -6.639 9.736 1.00 0.39 H new ATOM 0 HB ILE A 76 1.786 -6.858 6.762 1.00 0.45 H new ATOM 0 HG12 ILE A 76 -0.019 -7.367 9.152 1.00 0.51 H new ATOM 0 HG13 ILE A 76 -0.058 -5.913 8.173 1.00 0.51 H new ATOM 0 HG21 ILE A 76 1.362 -9.242 7.257 1.00 0.56 H new ATOM 0 HG22 ILE A 76 3.049 -8.786 7.596 1.00 0.56 H new ATOM 0 HG23 ILE A 76 1.894 -8.980 8.935 1.00 0.56 H new ATOM 0 HD11 ILE A 76 -1.822 -7.470 7.501 1.00 0.73 H new ATOM 0 HD12 ILE A 76 -0.645 -7.253 6.183 1.00 0.73 H new ATOM 0 HD13 ILE A 76 -0.606 -8.728 7.177 1.00 0.73 H new ATOM 1174 N PRO A 77 4.852 -6.984 9.185 1.00 0.34 N ATOM 1175 CA PRO A 77 6.190 -7.445 8.836 1.00 0.32 C ATOM 1176 C PRO A 77 6.111 -8.783 8.105 1.00 0.33 C ATOM 1177 O PRO A 77 5.732 -9.803 8.692 1.00 0.44 O ATOM 1178 CB PRO A 77 6.897 -7.603 10.193 1.00 0.40 C ATOM 1179 CG PRO A 77 5.990 -6.962 11.193 1.00 0.57 C ATOM 1180 CD PRO A 77 4.605 -7.074 10.625 1.00 0.42 C ATOM 0 HA PRO A 77 6.717 -6.760 8.172 1.00 0.32 H new ATOM 0 HB2 PRO A 77 7.062 -8.654 10.430 1.00 0.40 H new ATOM 0 HB3 PRO A 77 7.875 -7.121 10.185 1.00 0.40 H new ATOM 0 HG2 PRO A 77 6.058 -7.463 12.159 1.00 0.57 H new ATOM 0 HG3 PRO A 77 6.262 -5.919 11.355 1.00 0.57 H new ATOM 0 HD2 PRO A 77 4.128 -8.015 10.898 1.00 0.42 H new ATOM 0 HD3 PRO A 77 3.955 -6.273 10.977 1.00 0.42 H new ATOM 1188 N ASP A 78 6.450 -8.779 6.827 1.00 0.30 N ATOM 1189 CA ASP A 78 6.280 -9.955 5.991 1.00 0.35 C ATOM 1190 C ASP A 78 7.634 -10.451 5.522 1.00 0.32 C ATOM 1191 O ASP A 78 8.546 -9.648 5.324 1.00 0.28 O ATOM 1192 CB ASP A 78 5.388 -9.625 4.784 1.00 0.39 C ATOM 1193 CG ASP A 78 5.127 -10.827 3.892 1.00 0.52 C ATOM 1194 OD1 ASP A 78 4.165 -11.576 4.165 1.00 0.79 O ATOM 1195 OD2 ASP A 78 5.875 -11.027 2.912 1.00 0.52 O ATOM 0 H ASP A 78 6.846 -7.972 6.345 1.00 0.30 H new ATOM 0 HA ASP A 78 5.797 -10.739 6.575 1.00 0.35 H new ATOM 0 HB2 ASP A 78 4.436 -9.230 5.140 1.00 0.39 H new ATOM 0 HB3 ASP A 78 5.859 -8.838 4.195 1.00 0.39 H new ATOM 1200 N PRO A 79 7.808 -11.776 5.397 1.00 0.39 N ATOM 1201 CA PRO A 79 9.008 -12.366 4.800 1.00 0.40 C ATOM 1202 C PRO A 79 9.187 -11.937 3.343 1.00 0.38 C ATOM 1203 O PRO A 79 8.973 -12.720 2.415 1.00 0.47 O ATOM 1204 CB PRO A 79 8.765 -13.878 4.892 1.00 0.52 C ATOM 1205 CG PRO A 79 7.298 -14.026 5.101 1.00 0.58 C ATOM 1206 CD PRO A 79 6.862 -12.804 5.854 1.00 0.49 C ATOM 0 HA PRO A 79 9.916 -12.047 5.312 1.00 0.40 H new ATOM 0 HB2 PRO A 79 9.086 -14.384 3.982 1.00 0.52 H new ATOM 0 HB3 PRO A 79 9.326 -14.318 5.716 1.00 0.52 H new ATOM 0 HG2 PRO A 79 6.774 -14.105 4.148 1.00 0.58 H new ATOM 0 HG3 PRO A 79 7.074 -14.932 5.664 1.00 0.58 H new ATOM 0 HD2 PRO A 79 5.831 -12.535 5.623 1.00 0.49 H new ATOM 0 HD3 PRO A 79 6.919 -12.953 6.932 1.00 0.49 H new ATOM 1214 N GLY A 80 9.584 -10.684 3.165 1.00 0.34 N ATOM 1215 CA GLY A 80 9.719 -10.091 1.854 1.00 0.40 C ATOM 1216 C GLY A 80 10.962 -10.535 1.113 1.00 0.35 C ATOM 1217 O GLY A 80 11.569 -9.759 0.380 1.00 0.40 O ATOM 0 H GLY A 80 9.820 -10.054 3.932 1.00 0.34 H new ATOM 0 HA2 GLY A 80 8.842 -10.343 1.258 1.00 0.40 H new ATOM 0 HA3 GLY A 80 9.735 -9.006 1.955 1.00 0.40 H new ATOM 1221 N SER A 81 11.335 -11.784 1.305 1.00 0.34 N ATOM 1222 CA SER A 81 12.463 -12.359 0.616 1.00 0.36 C ATOM 1223 C SER A 81 12.086 -12.615 -0.843 1.00 0.37 C ATOM 1224 O SER A 81 11.145 -13.365 -1.113 1.00 0.43 O ATOM 1225 CB SER A 81 12.888 -13.639 1.342 1.00 0.41 C ATOM 1226 OG SER A 81 11.867 -14.630 1.313 1.00 0.62 O ATOM 0 H SER A 81 10.863 -12.425 1.943 1.00 0.34 H new ATOM 0 HA SER A 81 13.313 -11.676 0.619 1.00 0.36 H new ATOM 0 HB2 SER A 81 13.792 -14.036 0.880 1.00 0.41 H new ATOM 0 HB3 SER A 81 13.136 -13.404 2.377 1.00 0.41 H new ATOM 0 HG SER A 81 11.330 -14.523 0.500 1.00 0.62 H new ATOM 1232 N LEU A 82 12.790 -11.996 -1.800 1.00 0.37 N ATOM 1233 CA LEU A 82 12.194 -11.901 -3.154 1.00 0.39 C ATOM 1234 C LEU A 82 13.190 -12.113 -4.292 1.00 0.49 C ATOM 1235 O LEU A 82 14.280 -12.610 -4.083 1.00 0.82 O ATOM 1236 CB LEU A 82 11.464 -10.555 -3.334 1.00 0.36 C ATOM 1237 CG LEU A 82 12.320 -9.365 -3.771 1.00 0.52 C ATOM 1238 CD1 LEU A 82 11.469 -8.109 -3.856 1.00 1.10 C ATOM 1239 CD2 LEU A 82 13.483 -9.159 -2.825 1.00 1.08 C ATOM 0 H LEU A 82 13.713 -11.576 -1.685 1.00 0.37 H new ATOM 0 HA LEU A 82 11.481 -12.723 -3.217 1.00 0.39 H new ATOM 0 HB2 LEU A 82 10.671 -10.693 -4.069 1.00 0.36 H new ATOM 0 HB3 LEU A 82 10.982 -10.300 -2.390 1.00 0.36 H new ATOM 0 HG LEU A 82 12.726 -9.579 -4.760 1.00 0.52 H new ATOM 0 HD11 LEU A 82 12.090 -7.269 -4.168 1.00 1.10 H new ATOM 0 HD12 LEU A 82 10.670 -8.259 -4.582 1.00 1.10 H new ATOM 0 HD13 LEU A 82 11.036 -7.896 -2.879 1.00 1.10 H new ATOM 0 HD21 LEU A 82 14.076 -8.307 -3.158 1.00 1.08 H new ATOM 0 HD22 LEU A 82 13.105 -8.968 -1.820 1.00 1.08 H new ATOM 0 HD23 LEU A 82 14.106 -10.053 -2.815 1.00 1.08 H new ATOM 1251 N LYS A 83 12.781 -11.724 -5.504 1.00 0.40 N ATOM 1252 CA LYS A 83 13.550 -11.985 -6.719 1.00 0.46 C ATOM 1253 C LYS A 83 14.984 -11.463 -6.634 1.00 0.47 C ATOM 1254 O LYS A 83 15.868 -12.145 -6.112 1.00 0.63 O ATOM 1255 CB LYS A 83 12.854 -11.357 -7.930 1.00 0.52 C ATOM 1256 CG LYS A 83 11.397 -11.758 -8.076 1.00 0.58 C ATOM 1257 CD LYS A 83 10.783 -11.155 -9.325 1.00 0.68 C ATOM 1258 CE LYS A 83 9.325 -11.546 -9.477 1.00 1.08 C ATOM 1259 NZ LYS A 83 8.721 -10.947 -10.694 1.00 1.84 N ATOM 0 H LYS A 83 11.909 -11.221 -5.667 1.00 0.40 H new ATOM 0 HA LYS A 83 13.599 -13.068 -6.831 1.00 0.46 H new ATOM 0 HB2 LYS A 83 12.916 -10.272 -7.850 1.00 0.52 H new ATOM 0 HB3 LYS A 83 13.392 -11.642 -8.834 1.00 0.52 H new ATOM 0 HG2 LYS A 83 11.319 -12.844 -8.118 1.00 0.58 H new ATOM 0 HG3 LYS A 83 10.838 -11.432 -7.199 1.00 0.58 H new ATOM 0 HD2 LYS A 83 10.866 -10.069 -9.284 1.00 0.68 H new ATOM 0 HD3 LYS A 83 11.342 -11.485 -10.201 1.00 0.68 H new ATOM 0 HE2 LYS A 83 9.242 -12.632 -9.526 1.00 1.08 H new ATOM 0 HE3 LYS A 83 8.768 -11.223 -8.597 1.00 1.08 H new ATOM 0 HZ1 LYS A 83 7.917 -11.529 -11.005 1.00 1.84 H new ATOM 0 HZ2 LYS A 83 8.390 -9.985 -10.480 1.00 1.84 H new ATOM 0 HZ3 LYS A 83 9.433 -10.908 -11.451 1.00 1.84 H new ATOM 1273 N ALA A 84 15.189 -10.238 -7.129 1.00 0.47 N ATOM 1274 CA ALA A 84 16.511 -9.659 -7.304 1.00 0.50 C ATOM 1275 C ALA A 84 16.387 -8.499 -8.260 1.00 0.58 C ATOM 1276 O ALA A 84 16.087 -8.711 -9.433 1.00 0.99 O ATOM 1277 CB ALA A 84 17.504 -10.669 -7.872 1.00 0.56 C ATOM 0 H ALA A 84 14.431 -9.621 -7.420 1.00 0.47 H new ATOM 0 HA ALA A 84 16.885 -9.339 -6.331 1.00 0.50 H new ATOM 0 HB1 ALA A 84 18.479 -10.195 -7.987 1.00 0.56 H new ATOM 0 HB2 ALA A 84 17.590 -11.516 -7.192 1.00 0.56 H new ATOM 0 HB3 ALA A 84 17.153 -11.018 -8.843 1.00 0.56 H new ATOM 1283 N LYS A 85 16.589 -7.288 -7.744 1.00 0.49 N ATOM 1284 CA LYS A 85 16.465 -6.053 -8.525 1.00 0.54 C ATOM 1285 C LYS A 85 15.244 -6.094 -9.438 1.00 0.53 C ATOM 1286 O LYS A 85 15.308 -5.745 -10.618 1.00 0.61 O ATOM 1287 CB LYS A 85 17.754 -5.773 -9.313 1.00 0.65 C ATOM 1288 CG LYS A 85 18.133 -6.876 -10.273 1.00 1.07 C ATOM 1289 CD LYS A 85 19.518 -6.668 -10.839 1.00 1.25 C ATOM 1290 CE LYS A 85 20.025 -7.935 -11.496 1.00 1.60 C ATOM 1291 NZ LYS A 85 21.279 -7.701 -12.257 1.00 1.84 N ATOM 0 H LYS A 85 16.844 -7.132 -6.769 1.00 0.49 H new ATOM 0 HA LYS A 85 16.317 -5.227 -7.829 1.00 0.54 H new ATOM 0 HB2 LYS A 85 17.633 -4.844 -9.871 1.00 0.65 H new ATOM 0 HB3 LYS A 85 18.572 -5.619 -8.610 1.00 0.65 H new ATOM 0 HG2 LYS A 85 18.089 -7.837 -9.760 1.00 1.07 H new ATOM 0 HG3 LYS A 85 17.409 -6.916 -11.087 1.00 1.07 H new ATOM 0 HD2 LYS A 85 19.500 -5.857 -11.567 1.00 1.25 H new ATOM 0 HD3 LYS A 85 20.200 -6.367 -10.043 1.00 1.25 H new ATOM 0 HE2 LYS A 85 20.199 -8.694 -10.734 1.00 1.60 H new ATOM 0 HE3 LYS A 85 19.261 -8.327 -12.167 1.00 1.60 H new ATOM 0 HZ1 LYS A 85 21.593 -8.592 -12.691 1.00 1.84 H new ATOM 0 HZ2 LYS A 85 21.107 -6.995 -13.001 1.00 1.84 H new ATOM 0 HZ3 LYS A 85 22.016 -7.352 -11.612 1.00 1.84 H new ATOM 1305 N ASP A 86 14.120 -6.494 -8.862 1.00 0.48 N ATOM 1306 CA ASP A 86 12.911 -6.726 -9.633 1.00 0.46 C ATOM 1307 C ASP A 86 11.689 -6.468 -8.758 1.00 0.40 C ATOM 1308 O ASP A 86 11.814 -6.000 -7.627 1.00 0.38 O ATOM 1309 CB ASP A 86 12.893 -8.164 -10.179 1.00 0.49 C ATOM 1310 CG ASP A 86 11.988 -8.338 -11.392 1.00 0.53 C ATOM 1311 OD1 ASP A 86 10.775 -8.571 -11.209 1.00 0.55 O ATOM 1312 OD2 ASP A 86 12.483 -8.230 -12.533 1.00 0.64 O ATOM 0 H ASP A 86 14.022 -6.665 -7.861 1.00 0.48 H new ATOM 0 HA ASP A 86 12.889 -6.041 -10.481 1.00 0.46 H new ATOM 0 HB2 ASP A 86 13.908 -8.456 -10.447 1.00 0.49 H new ATOM 0 HB3 ASP A 86 12.565 -8.841 -9.390 1.00 0.49 H new ATOM 1317 N MET A 87 10.531 -6.828 -9.268 1.00 0.39 N ATOM 1318 CA MET A 87 9.270 -6.472 -8.648 1.00 0.35 C ATOM 1319 C MET A 87 8.462 -7.726 -8.338 1.00 0.34 C ATOM 1320 O MET A 87 8.068 -8.462 -9.239 1.00 0.37 O ATOM 1321 CB MET A 87 8.502 -5.531 -9.579 1.00 0.35 C ATOM 1322 CG MET A 87 7.425 -4.717 -8.890 1.00 0.35 C ATOM 1323 SD MET A 87 6.669 -3.507 -9.998 1.00 0.41 S ATOM 1324 CE MET A 87 5.877 -2.408 -8.827 1.00 1.35 C ATOM 0 H MET A 87 10.436 -7.375 -10.123 1.00 0.39 H new ATOM 0 HA MET A 87 9.454 -5.958 -7.705 1.00 0.35 H new ATOM 0 HB2 MET A 87 9.209 -4.850 -10.053 1.00 0.35 H new ATOM 0 HB3 MET A 87 8.044 -6.119 -10.374 1.00 0.35 H new ATOM 0 HG2 MET A 87 6.655 -5.387 -8.507 1.00 0.35 H new ATOM 0 HG3 MET A 87 7.855 -4.202 -8.031 1.00 0.35 H new ATOM 0 HE1 MET A 87 5.936 -1.383 -9.193 1.00 1.35 H new ATOM 0 HE2 MET A 87 4.831 -2.692 -8.711 1.00 1.35 H new ATOM 0 HE3 MET A 87 6.381 -2.479 -7.863 1.00 1.35 H new ATOM 1334 N THR A 88 8.224 -7.968 -7.060 1.00 0.31 N ATOM 1335 CA THR A 88 7.572 -9.191 -6.625 1.00 0.30 C ATOM 1336 C THR A 88 6.125 -8.915 -6.217 1.00 0.27 C ATOM 1337 O THR A 88 5.816 -7.876 -5.639 1.00 0.27 O ATOM 1338 CB THR A 88 8.343 -9.842 -5.453 1.00 0.32 C ATOM 1339 OG1 THR A 88 7.966 -11.216 -5.313 1.00 0.77 O ATOM 1340 CG2 THR A 88 8.074 -9.115 -4.145 1.00 0.54 C ATOM 0 H THR A 88 8.474 -7.331 -6.303 1.00 0.31 H new ATOM 0 HA THR A 88 7.571 -9.887 -7.464 1.00 0.30 H new ATOM 0 HB THR A 88 9.407 -9.773 -5.680 1.00 0.32 H new ATOM 0 HG1 THR A 88 8.462 -11.617 -4.569 1.00 0.77 H new ATOM 0 HG21 THR A 88 8.630 -9.596 -3.340 1.00 0.54 H new ATOM 0 HG22 THR A 88 8.391 -8.076 -4.234 1.00 0.54 H new ATOM 0 HG23 THR A 88 7.008 -9.151 -3.921 1.00 0.54 H new ATOM 1348 N ALA A 89 5.246 -9.843 -6.529 1.00 0.27 N ATOM 1349 CA ALA A 89 3.838 -9.680 -6.262 1.00 0.28 C ATOM 1350 C ALA A 89 3.500 -10.202 -4.879 1.00 0.29 C ATOM 1351 O ALA A 89 3.468 -11.405 -4.633 1.00 0.48 O ATOM 1352 CB ALA A 89 3.009 -10.380 -7.324 1.00 0.31 C ATOM 0 H ALA A 89 5.489 -10.728 -6.974 1.00 0.27 H new ATOM 0 HA ALA A 89 3.598 -8.617 -6.294 1.00 0.28 H new ATOM 0 HB1 ALA A 89 1.950 -10.246 -7.106 1.00 0.31 H new ATOM 0 HB2 ALA A 89 3.235 -9.954 -8.301 1.00 0.31 H new ATOM 0 HB3 ALA A 89 3.247 -11.444 -7.329 1.00 0.31 H new ATOM 1358 N LEU A 90 3.269 -9.270 -3.985 1.00 0.27 N ATOM 1359 CA LEU A 90 2.873 -9.561 -2.626 1.00 0.30 C ATOM 1360 C LEU A 90 1.377 -9.264 -2.520 1.00 0.29 C ATOM 1361 O LEU A 90 0.806 -8.690 -3.451 1.00 0.32 O ATOM 1362 CB LEU A 90 3.739 -8.697 -1.688 1.00 0.35 C ATOM 1363 CG LEU A 90 3.468 -8.780 -0.183 1.00 0.40 C ATOM 1364 CD1 LEU A 90 4.775 -8.665 0.587 1.00 0.77 C ATOM 1365 CD2 LEU A 90 2.532 -7.662 0.242 1.00 0.72 C ATOM 0 H LEU A 90 3.352 -8.273 -4.184 1.00 0.27 H new ATOM 0 HA LEU A 90 3.028 -10.601 -2.340 1.00 0.30 H new ATOM 0 HB2 LEU A 90 4.782 -8.965 -1.855 1.00 0.35 H new ATOM 0 HB3 LEU A 90 3.625 -7.656 -1.991 1.00 0.35 H new ATOM 0 HG LEU A 90 3.002 -9.741 0.035 1.00 0.40 H new ATOM 0 HD11 LEU A 90 4.574 -8.725 1.657 1.00 0.77 H new ATOM 0 HD12 LEU A 90 5.441 -9.478 0.297 1.00 0.77 H new ATOM 0 HD13 LEU A 90 5.248 -7.710 0.360 1.00 0.77 H new ATOM 0 HD21 LEU A 90 2.346 -7.731 1.314 1.00 0.72 H new ATOM 0 HD22 LEU A 90 2.988 -6.699 0.014 1.00 0.72 H new ATOM 0 HD23 LEU A 90 1.589 -7.753 -0.296 1.00 0.72 H new ATOM 1377 N ASP A 91 0.716 -9.663 -1.454 1.00 0.35 N ATOM 1378 CA ASP A 91 -0.709 -9.390 -1.350 1.00 0.43 C ATOM 1379 C ASP A 91 -1.113 -9.028 0.066 1.00 0.43 C ATOM 1380 O ASP A 91 -0.564 -9.544 1.042 1.00 0.52 O ATOM 1381 CB ASP A 91 -1.541 -10.577 -1.853 1.00 0.63 C ATOM 1382 CG ASP A 91 -1.470 -11.796 -0.952 1.00 1.07 C ATOM 1383 OD1 ASP A 91 -0.510 -12.585 -1.083 1.00 1.81 O ATOM 1384 OD2 ASP A 91 -2.388 -11.987 -0.125 1.00 1.67 O ATOM 0 H ASP A 91 1.125 -10.164 -0.665 1.00 0.35 H new ATOM 0 HA ASP A 91 -0.913 -8.529 -1.987 1.00 0.43 H new ATOM 0 HB2 ASP A 91 -2.581 -10.266 -1.948 1.00 0.63 H new ATOM 0 HB3 ASP A 91 -1.199 -10.853 -2.850 1.00 0.63 H new ATOM 1389 N ILE A 92 -2.050 -8.100 0.161 1.00 0.39 N ATOM 1390 CA ILE A 92 -2.698 -7.781 1.416 1.00 0.38 C ATOM 1391 C ILE A 92 -4.104 -8.351 1.371 1.00 0.38 C ATOM 1392 O ILE A 92 -4.872 -7.973 0.488 1.00 0.54 O ATOM 1393 CB ILE A 92 -2.794 -6.261 1.658 1.00 0.43 C ATOM 1394 CG1 ILE A 92 -1.437 -5.575 1.446 1.00 0.52 C ATOM 1395 CG2 ILE A 92 -3.327 -5.980 3.054 1.00 0.52 C ATOM 1396 CD1 ILE A 92 -0.331 -6.102 2.334 1.00 0.65 C ATOM 0 H ILE A 92 -2.381 -7.548 -0.631 1.00 0.39 H new ATOM 0 HA ILE A 92 -2.106 -8.208 2.225 1.00 0.38 H new ATOM 0 HB ILE A 92 -3.491 -5.847 0.929 1.00 0.43 H new ATOM 0 HG12 ILE A 92 -1.140 -5.696 0.404 1.00 0.52 H new ATOM 0 HG13 ILE A 92 -1.551 -4.506 1.623 1.00 0.52 H new ATOM 0 HG21 ILE A 92 -3.389 -4.903 3.210 1.00 0.52 H new ATOM 0 HG22 ILE A 92 -4.319 -6.420 3.160 1.00 0.52 H new ATOM 0 HG23 ILE A 92 -2.656 -6.416 3.794 1.00 0.52 H new ATOM 0 HD11 ILE A 92 0.593 -5.565 2.121 1.00 0.65 H new ATOM 0 HD12 ILE A 92 -0.603 -5.956 3.379 1.00 0.65 H new ATOM 0 HD13 ILE A 92 -0.185 -7.165 2.142 1.00 0.65 H new ATOM 1408 N PRO A 93 -4.439 -9.252 2.319 1.00 0.41 N ATOM 1409 CA PRO A 93 -5.679 -10.033 2.330 1.00 0.55 C ATOM 1410 C PRO A 93 -6.884 -9.332 1.696 1.00 0.61 C ATOM 1411 O PRO A 93 -7.050 -9.375 0.484 1.00 1.07 O ATOM 1412 CB PRO A 93 -5.896 -10.273 3.820 1.00 0.67 C ATOM 1413 CG PRO A 93 -4.518 -10.393 4.379 1.00 0.70 C ATOM 1414 CD PRO A 93 -3.605 -9.581 3.485 1.00 0.52 C ATOM 0 HA PRO A 93 -5.589 -10.937 1.727 1.00 0.55 H new ATOM 0 HB2 PRO A 93 -6.442 -9.449 4.280 1.00 0.67 H new ATOM 0 HB3 PRO A 93 -6.477 -11.178 3.997 1.00 0.67 H new ATOM 0 HG2 PRO A 93 -4.484 -10.022 5.403 1.00 0.70 H new ATOM 0 HG3 PRO A 93 -4.203 -11.436 4.407 1.00 0.70 H new ATOM 0 HD2 PRO A 93 -3.252 -8.681 3.989 1.00 0.52 H new ATOM 0 HD3 PRO A 93 -2.722 -10.151 3.195 1.00 0.52 H new ATOM 1422 N VAL A 94 -7.729 -8.709 2.510 1.00 0.38 N ATOM 1423 CA VAL A 94 -8.920 -8.027 2.010 1.00 0.34 C ATOM 1424 C VAL A 94 -9.495 -7.096 3.075 1.00 0.34 C ATOM 1425 O VAL A 94 -10.326 -7.509 3.866 1.00 0.36 O ATOM 1426 CB VAL A 94 -10.016 -9.038 1.589 1.00 0.36 C ATOM 1427 CG1 VAL A 94 -9.954 -9.347 0.100 1.00 0.42 C ATOM 1428 CG2 VAL A 94 -9.907 -10.325 2.401 1.00 0.46 C ATOM 0 H VAL A 94 -7.612 -8.661 3.522 1.00 0.38 H new ATOM 0 HA VAL A 94 -8.615 -7.448 1.138 1.00 0.34 H new ATOM 0 HB VAL A 94 -10.981 -8.574 1.794 1.00 0.36 H new ATOM 0 HG11 VAL A 94 -10.738 -10.059 -0.157 1.00 0.42 H new ATOM 0 HG12 VAL A 94 -10.098 -8.428 -0.469 1.00 0.42 H new ATOM 0 HG13 VAL A 94 -8.981 -9.775 -0.143 1.00 0.42 H new ATOM 0 HG21 VAL A 94 -10.686 -11.020 2.088 1.00 0.46 H new ATOM 0 HG22 VAL A 94 -8.929 -10.778 2.236 1.00 0.46 H new ATOM 0 HG23 VAL A 94 -10.027 -10.098 3.460 1.00 0.46 H new ATOM 1438 N VAL A 95 -9.122 -5.824 3.060 1.00 0.35 N ATOM 1439 CA VAL A 95 -9.450 -4.959 4.193 1.00 0.35 C ATOM 1440 C VAL A 95 -10.172 -3.660 3.812 1.00 0.36 C ATOM 1441 O VAL A 95 -9.571 -2.729 3.277 1.00 0.44 O ATOM 1442 CB VAL A 95 -8.172 -4.617 4.998 1.00 0.42 C ATOM 1443 CG1 VAL A 95 -7.130 -3.947 4.106 1.00 0.48 C ATOM 1444 CG2 VAL A 95 -8.505 -3.744 6.201 1.00 0.45 C ATOM 0 H VAL A 95 -8.608 -5.375 2.302 1.00 0.35 H new ATOM 0 HA VAL A 95 -10.149 -5.534 4.800 1.00 0.35 H new ATOM 0 HB VAL A 95 -7.746 -5.549 5.369 1.00 0.42 H new ATOM 0 HG11 VAL A 95 -6.242 -3.716 4.694 1.00 0.48 H new ATOM 0 HG12 VAL A 95 -6.861 -4.620 3.292 1.00 0.48 H new ATOM 0 HG13 VAL A 95 -7.542 -3.026 3.694 1.00 0.48 H new ATOM 0 HG21 VAL A 95 -7.591 -3.517 6.750 1.00 0.45 H new ATOM 0 HG22 VAL A 95 -8.964 -2.816 5.861 1.00 0.45 H new ATOM 0 HG23 VAL A 95 -9.199 -4.274 6.854 1.00 0.45 H new ATOM 1454 N VAL A 96 -11.476 -3.615 4.046 1.00 0.34 N ATOM 1455 CA VAL A 96 -12.177 -2.347 4.124 1.00 0.34 C ATOM 1456 C VAL A 96 -13.403 -2.467 5.031 1.00 0.36 C ATOM 1457 O VAL A 96 -14.454 -2.955 4.611 1.00 0.47 O ATOM 1458 CB VAL A 96 -12.552 -1.775 2.738 1.00 0.45 C ATOM 1459 CG1 VAL A 96 -13.134 -2.839 1.825 1.00 1.02 C ATOM 1460 CG2 VAL A 96 -13.518 -0.618 2.891 1.00 1.07 C ATOM 0 H VAL A 96 -12.064 -4.437 4.184 1.00 0.34 H new ATOM 0 HA VAL A 96 -11.485 -1.629 4.565 1.00 0.34 H new ATOM 0 HB VAL A 96 -11.636 -1.413 2.271 1.00 0.45 H new ATOM 0 HG11 VAL A 96 -13.384 -2.395 0.862 1.00 1.02 H new ATOM 0 HG12 VAL A 96 -12.402 -3.633 1.679 1.00 1.02 H new ATOM 0 HG13 VAL A 96 -14.035 -3.254 2.278 1.00 1.02 H new ATOM 0 HG21 VAL A 96 -13.774 -0.225 1.907 1.00 1.07 H new ATOM 0 HG22 VAL A 96 -14.423 -0.963 3.390 1.00 1.07 H new ATOM 0 HG23 VAL A 96 -13.053 0.168 3.486 1.00 1.07 H new ATOM 1470 N PRO A 97 -13.284 -2.048 6.299 1.00 0.34 N ATOM 1471 CA PRO A 97 -14.396 -2.096 7.243 1.00 0.36 C ATOM 1472 C PRO A 97 -15.657 -1.459 6.667 1.00 0.33 C ATOM 1473 O PRO A 97 -15.626 -0.331 6.167 1.00 0.34 O ATOM 1474 CB PRO A 97 -13.883 -1.308 8.447 1.00 0.41 C ATOM 1475 CG PRO A 97 -12.402 -1.442 8.379 1.00 0.48 C ATOM 1476 CD PRO A 97 -12.060 -1.507 6.915 1.00 0.36 C ATOM 0 HA PRO A 97 -14.683 -3.118 7.493 1.00 0.36 H new ATOM 0 HB2 PRO A 97 -14.189 -0.263 8.397 1.00 0.41 H new ATOM 0 HB3 PRO A 97 -14.275 -1.711 9.381 1.00 0.41 H new ATOM 0 HG2 PRO A 97 -11.911 -0.595 8.857 1.00 0.48 H new ATOM 0 HG3 PRO A 97 -12.067 -2.340 8.899 1.00 0.48 H new ATOM 0 HD2 PRO A 97 -11.812 -0.523 6.517 1.00 0.36 H new ATOM 0 HD3 PRO A 97 -11.200 -2.151 6.732 1.00 0.36 H new ATOM 1484 N TYR A 98 -16.757 -2.202 6.743 1.00 0.35 N ATOM 1485 CA TYR A 98 -18.034 -1.794 6.161 1.00 0.37 C ATOM 1486 C TYR A 98 -18.395 -0.357 6.545 1.00 0.36 C ATOM 1487 O TYR A 98 -18.880 0.411 5.714 1.00 0.39 O ATOM 1488 CB TYR A 98 -19.135 -2.775 6.610 1.00 0.47 C ATOM 1489 CG TYR A 98 -20.545 -2.369 6.225 1.00 0.60 C ATOM 1490 CD1 TYR A 98 -21.202 -1.352 6.903 1.00 0.90 C ATOM 1491 CD2 TYR A 98 -21.210 -2.989 5.172 1.00 1.04 C ATOM 1492 CE1 TYR A 98 -22.480 -0.969 6.547 1.00 1.06 C ATOM 1493 CE2 TYR A 98 -22.483 -2.610 4.808 1.00 1.23 C ATOM 1494 CZ TYR A 98 -23.140 -1.644 5.544 1.00 1.08 C ATOM 1495 OH TYR A 98 -24.384 -1.218 5.135 1.00 1.31 O ATOM 0 H TYR A 98 -16.789 -3.108 7.211 1.00 0.35 H new ATOM 0 HA TYR A 98 -17.946 -1.821 5.075 1.00 0.37 H new ATOM 0 HB2 TYR A 98 -18.925 -3.755 6.182 1.00 0.47 H new ATOM 0 HB3 TYR A 98 -19.086 -2.883 7.694 1.00 0.47 H new ATOM 0 HD1 TYR A 98 -20.706 -0.852 7.722 1.00 0.90 H new ATOM 0 HD2 TYR A 98 -20.718 -3.783 4.629 1.00 1.04 H new ATOM 0 HE1 TYR A 98 -22.960 -0.144 7.053 1.00 1.06 H new ATOM 0 HE2 TYR A 98 -22.963 -3.065 3.954 1.00 1.23 H new ATOM 0 HH TYR A 98 -24.711 -1.802 4.419 1.00 1.31 H new ATOM 1505 N SER A 99 -18.131 0.001 7.794 1.00 0.37 N ATOM 1506 CA SER A 99 -18.508 1.302 8.324 1.00 0.41 C ATOM 1507 C SER A 99 -17.884 2.454 7.535 1.00 0.38 C ATOM 1508 O SER A 99 -18.462 3.536 7.451 1.00 0.39 O ATOM 1509 CB SER A 99 -18.109 1.395 9.794 1.00 0.50 C ATOM 1510 OG SER A 99 -18.651 0.307 10.525 1.00 1.20 O ATOM 0 H SER A 99 -17.652 -0.600 8.465 1.00 0.37 H new ATOM 0 HA SER A 99 -19.590 1.395 8.227 1.00 0.41 H new ATOM 0 HB2 SER A 99 -17.023 1.395 9.883 1.00 0.50 H new ATOM 0 HB3 SER A 99 -18.464 2.336 10.214 1.00 0.50 H new ATOM 0 HG SER A 99 -18.385 0.380 11.465 1.00 1.20 H new ATOM 1516 N ILE A 100 -16.721 2.230 6.936 1.00 0.36 N ATOM 1517 CA ILE A 100 -16.053 3.303 6.215 1.00 0.37 C ATOM 1518 C ILE A 100 -16.736 3.533 4.873 1.00 0.34 C ATOM 1519 O ILE A 100 -17.161 4.652 4.569 1.00 0.36 O ATOM 1520 CB ILE A 100 -14.562 3.007 5.971 1.00 0.41 C ATOM 1521 CG1 ILE A 100 -13.934 2.290 7.173 1.00 0.45 C ATOM 1522 CG2 ILE A 100 -13.828 4.306 5.688 1.00 0.48 C ATOM 1523 CD1 ILE A 100 -14.058 3.037 8.484 1.00 0.51 C ATOM 0 H ILE A 100 -16.231 1.336 6.934 1.00 0.36 H new ATOM 0 HA ILE A 100 -16.123 4.195 6.838 1.00 0.37 H new ATOM 0 HB ILE A 100 -14.476 2.345 5.109 1.00 0.41 H new ATOM 0 HG12 ILE A 100 -14.402 1.311 7.281 1.00 0.45 H new ATOM 0 HG13 ILE A 100 -12.878 2.117 6.966 1.00 0.45 H new ATOM 0 HG21 ILE A 100 -12.772 4.097 5.515 1.00 0.48 H new ATOM 0 HG22 ILE A 100 -14.254 4.779 4.803 1.00 0.48 H new ATOM 0 HG23 ILE A 100 -13.930 4.975 6.542 1.00 0.48 H new ATOM 0 HD11 ILE A 100 -13.587 2.458 9.279 1.00 0.51 H new ATOM 0 HD12 ILE A 100 -13.564 4.005 8.399 1.00 0.51 H new ATOM 0 HD13 ILE A 100 -15.112 3.186 8.719 1.00 0.51 H new ATOM 1535 N LEU A 101 -16.840 2.457 4.089 1.00 0.33 N ATOM 1536 CA LEU A 101 -17.611 2.459 2.836 1.00 0.34 C ATOM 1537 C LEU A 101 -19.007 3.017 3.062 1.00 0.34 C ATOM 1538 O LEU A 101 -19.599 3.625 2.180 1.00 0.36 O ATOM 1539 CB LEU A 101 -17.722 1.049 2.251 1.00 0.35 C ATOM 1540 CG LEU A 101 -16.449 0.498 1.619 1.00 0.41 C ATOM 1541 CD1 LEU A 101 -16.715 -0.870 1.016 1.00 0.89 C ATOM 1542 CD2 LEU A 101 -15.923 1.451 0.559 1.00 1.00 C ATOM 0 H LEU A 101 -16.396 1.563 4.300 1.00 0.33 H new ATOM 0 HA LEU A 101 -17.077 3.094 2.129 1.00 0.34 H new ATOM 0 HB2 LEU A 101 -18.037 0.370 3.043 1.00 0.35 H new ATOM 0 HB3 LEU A 101 -18.510 1.048 1.498 1.00 0.35 H new ATOM 0 HG LEU A 101 -15.691 0.398 2.396 1.00 0.41 H new ATOM 0 HD11 LEU A 101 -15.799 -1.254 0.567 1.00 0.89 H new ATOM 0 HD12 LEU A 101 -17.051 -1.553 1.797 1.00 0.89 H new ATOM 0 HD13 LEU A 101 -17.487 -0.786 0.251 1.00 0.89 H new ATOM 0 HD21 LEU A 101 -15.014 1.040 0.119 1.00 1.00 H new ATOM 0 HD22 LEU A 101 -16.675 1.581 -0.219 1.00 1.00 H new ATOM 0 HD23 LEU A 101 -15.702 2.416 1.015 1.00 1.00 H new ATOM 1554 N PHE A 102 -19.481 2.848 4.275 1.00 0.34 N ATOM 1555 CA PHE A 102 -20.804 3.304 4.640 1.00 0.36 C ATOM 1556 C PHE A 102 -20.852 4.828 4.559 1.00 0.35 C ATOM 1557 O PHE A 102 -21.773 5.406 3.988 1.00 0.36 O ATOM 1558 CB PHE A 102 -21.179 2.808 6.038 1.00 0.42 C ATOM 1559 CG PHE A 102 -22.577 3.161 6.458 1.00 0.57 C ATOM 1560 CD1 PHE A 102 -23.666 2.524 5.886 1.00 0.74 C ATOM 1561 CD2 PHE A 102 -22.801 4.134 7.418 1.00 0.80 C ATOM 1562 CE1 PHE A 102 -24.953 2.850 6.268 1.00 0.90 C ATOM 1563 CE2 PHE A 102 -24.086 4.466 7.802 1.00 0.96 C ATOM 1564 CZ PHE A 102 -25.163 3.806 7.242 1.00 0.94 C ATOM 0 H PHE A 102 -18.967 2.395 5.031 1.00 0.34 H new ATOM 0 HA PHE A 102 -21.535 2.893 3.943 1.00 0.36 H new ATOM 0 HB2 PHE A 102 -21.064 1.725 6.071 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -20.478 3.225 6.760 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -23.507 1.765 5.134 1.00 0.74 H new ATOM 0 HD2 PHE A 102 -21.961 4.639 7.872 1.00 0.80 H new ATOM 0 HE1 PHE A 102 -25.795 2.357 5.805 1.00 0.90 H new ATOM 0 HE2 PHE A 102 -24.248 5.239 8.538 1.00 0.96 H new ATOM 0 HZ PHE A 102 -26.167 4.037 7.565 1.00 0.94 H new ATOM 1574 N ASN A 103 -19.823 5.473 5.086 1.00 0.36 N ATOM 1575 CA ASN A 103 -19.758 6.930 5.103 1.00 0.38 C ATOM 1576 C ASN A 103 -19.462 7.510 3.723 1.00 0.36 C ATOM 1577 O ASN A 103 -20.248 8.299 3.199 1.00 0.38 O ATOM 1578 CB ASN A 103 -18.676 7.382 6.078 1.00 0.43 C ATOM 1579 CG ASN A 103 -19.100 7.279 7.532 1.00 0.49 C ATOM 1580 OD1 ASN A 103 -19.611 8.239 8.106 1.00 0.82 O ATOM 1581 ND2 ASN A 103 -18.897 6.124 8.141 1.00 0.49 N ATOM 0 H ASN A 103 -19.018 5.011 5.509 1.00 0.36 H new ATOM 0 HA ASN A 103 -20.735 7.297 5.418 1.00 0.38 H new ATOM 0 HB2 ASN A 103 -17.782 6.778 5.923 1.00 0.43 H new ATOM 0 HB3 ASN A 103 -18.406 8.415 5.857 1.00 0.43 H new ATOM 0 HD21 ASN A 103 -19.167 6.008 9.118 1.00 0.49 H new ATOM 0 HD22 ASN A 103 -18.471 5.348 7.634 1.00 0.49 H new ATOM 1588 N LEU A 104 -18.338 7.113 3.131 1.00 0.36 N ATOM 1589 CA LEU A 104 -17.945 7.628 1.821 1.00 0.39 C ATOM 1590 C LEU A 104 -18.977 7.340 0.727 1.00 0.37 C ATOM 1591 O LEU A 104 -19.452 8.269 0.079 1.00 0.40 O ATOM 1592 CB LEU A 104 -16.589 7.061 1.431 1.00 0.45 C ATOM 1593 CG LEU A 104 -16.452 5.557 1.602 1.00 0.51 C ATOM 1594 CD1 LEU A 104 -16.461 4.854 0.255 1.00 0.55 C ATOM 1595 CD2 LEU A 104 -15.192 5.246 2.376 1.00 0.65 C ATOM 0 H LEU A 104 -17.686 6.440 3.535 1.00 0.36 H new ATOM 0 HA LEU A 104 -17.884 8.713 1.910 1.00 0.39 H new ATOM 0 HB2 LEU A 104 -16.392 7.313 0.389 1.00 0.45 H new ATOM 0 HB3 LEU A 104 -15.821 7.552 2.029 1.00 0.45 H new ATOM 0 HG LEU A 104 -17.307 5.185 2.166 1.00 0.51 H new ATOM 0 HD11 LEU A 104 -16.362 3.779 0.405 1.00 0.55 H new ATOM 0 HD12 LEU A 104 -17.399 5.064 -0.259 1.00 0.55 H new ATOM 0 HD13 LEU A 104 -15.628 5.215 -0.349 1.00 0.55 H new ATOM 0 HD21 LEU A 104 -15.096 4.167 2.497 1.00 0.65 H new ATOM 0 HD22 LEU A 104 -14.328 5.628 1.833 1.00 0.65 H new ATOM 0 HD23 LEU A 104 -15.242 5.718 3.357 1.00 0.65 H new ATOM 1607 N ALA A 105 -19.350 6.069 0.550 1.00 0.35 N ATOM 1608 CA ALA A 105 -20.259 5.672 -0.533 1.00 0.38 C ATOM 1609 C ALA A 105 -21.618 6.316 -0.349 1.00 0.37 C ATOM 1610 O ALA A 105 -22.382 6.478 -1.283 1.00 0.39 O ATOM 1611 CB ALA A 105 -20.397 4.161 -0.599 1.00 0.43 C ATOM 0 H ALA A 105 -19.038 5.298 1.140 1.00 0.35 H new ATOM 0 HA ALA A 105 -19.833 6.018 -1.475 1.00 0.38 H new ATOM 0 HB1 ALA A 105 -21.075 3.893 -1.409 1.00 0.43 H new ATOM 0 HB2 ALA A 105 -19.420 3.714 -0.781 1.00 0.43 H new ATOM 0 HB3 ALA A 105 -20.795 3.790 0.346 1.00 0.43 H new ATOM 1617 N ARG A 106 -21.902 6.648 0.879 1.00 0.36 N ATOM 1618 CA ARG A 106 -23.128 7.355 1.178 1.00 0.40 C ATOM 1619 C ARG A 106 -23.128 8.743 0.534 1.00 0.38 C ATOM 1620 O ARG A 106 -24.117 9.158 -0.059 1.00 0.40 O ATOM 1621 CB ARG A 106 -23.345 7.461 2.667 1.00 0.48 C ATOM 1622 CG ARG A 106 -24.390 8.483 3.061 1.00 0.53 C ATOM 1623 CD ARG A 106 -24.680 8.387 4.541 1.00 0.73 C ATOM 1624 NE ARG A 106 -23.501 7.926 5.262 1.00 0.91 N ATOM 1625 CZ ARG A 106 -23.430 7.801 6.576 1.00 1.38 C ATOM 1626 NH1 ARG A 106 -24.489 8.051 7.335 1.00 1.52 N ATOM 1627 NH2 ARG A 106 -22.302 7.385 7.125 1.00 1.81 N ATOM 0 H ARG A 106 -21.312 6.446 1.686 1.00 0.36 H new ATOM 0 HA ARG A 106 -23.954 6.782 0.756 1.00 0.40 H new ATOM 0 HB2 ARG A 106 -23.641 6.485 3.052 1.00 0.48 H new ATOM 0 HB3 ARG A 106 -22.400 7.719 3.145 1.00 0.48 H new ATOM 0 HG2 ARG A 106 -24.040 9.486 2.816 1.00 0.53 H new ATOM 0 HG3 ARG A 106 -25.305 8.317 2.492 1.00 0.53 H new ATOM 0 HD2 ARG A 106 -24.989 9.361 4.921 1.00 0.73 H new ATOM 0 HD3 ARG A 106 -25.510 7.701 4.712 1.00 0.73 H new ATOM 0 HE ARG A 106 -22.674 7.683 4.716 1.00 0.91 H new ATOM 0 HH11 ARG A 106 -25.367 8.342 6.905 1.00 1.52 H new ATOM 0 HH12 ARG A 106 -24.425 7.952 8.348 1.00 1.52 H new ATOM 0 HH21 ARG A 106 -21.499 7.165 6.536 1.00 1.81 H new ATOM 0 HH22 ARG A 106 -22.234 7.284 8.138 1.00 1.81 H new ATOM 1641 N ASP A 107 -22.010 9.449 0.640 1.00 0.37 N ATOM 1642 CA ASP A 107 -21.937 10.833 0.176 1.00 0.41 C ATOM 1643 C ASP A 107 -21.617 10.905 -1.320 1.00 0.38 C ATOM 1644 O ASP A 107 -22.342 11.514 -2.117 1.00 0.41 O ATOM 1645 CB ASP A 107 -20.880 11.582 0.993 1.00 0.46 C ATOM 1646 CG ASP A 107 -20.796 13.055 0.647 1.00 0.57 C ATOM 1647 OD1 ASP A 107 -21.691 13.824 1.054 1.00 0.80 O ATOM 1648 OD2 ASP A 107 -19.843 13.445 -0.063 1.00 0.68 O ATOM 0 H ASP A 107 -21.143 9.090 1.041 1.00 0.37 H new ATOM 0 HA ASP A 107 -22.910 11.304 0.320 1.00 0.41 H new ATOM 0 HB2 ASP A 107 -21.107 11.476 2.054 1.00 0.46 H new ATOM 0 HB3 ASP A 107 -19.907 11.120 0.828 1.00 0.46 H new ATOM 1653 N VAL A 108 -20.561 10.226 -1.713 1.00 0.34 N ATOM 1654 CA VAL A 108 -20.142 10.236 -3.104 1.00 0.33 C ATOM 1655 C VAL A 108 -21.040 9.338 -3.926 1.00 0.32 C ATOM 1656 O VAL A 108 -21.235 9.556 -5.111 1.00 0.37 O ATOM 1657 CB VAL A 108 -18.704 9.747 -3.263 1.00 0.32 C ATOM 1658 CG1 VAL A 108 -17.727 10.661 -2.563 1.00 0.77 C ATOM 1659 CG2 VAL A 108 -18.579 8.354 -2.724 1.00 0.88 C ATOM 0 H VAL A 108 -19.977 9.662 -1.095 1.00 0.34 H new ATOM 0 HA VAL A 108 -20.209 11.267 -3.451 1.00 0.33 H new ATOM 0 HB VAL A 108 -18.462 9.751 -4.326 1.00 0.32 H new ATOM 0 HG11 VAL A 108 -16.714 10.282 -2.697 1.00 0.77 H new ATOM 0 HG12 VAL A 108 -17.799 11.663 -2.986 1.00 0.77 H new ATOM 0 HG13 VAL A 108 -17.962 10.699 -1.499 1.00 0.77 H new ATOM 0 HG21 VAL A 108 -17.551 8.010 -2.840 1.00 0.88 H new ATOM 0 HG22 VAL A 108 -18.847 8.347 -1.667 1.00 0.88 H new ATOM 0 HG23 VAL A 108 -19.248 7.690 -3.272 1.00 0.88 H new ATOM 1669 N GLY A 109 -21.535 8.302 -3.275 1.00 0.29 N ATOM 1670 CA GLY A 109 -22.490 7.398 -3.883 1.00 0.30 C ATOM 1671 C GLY A 109 -23.883 7.976 -3.882 1.00 0.33 C ATOM 1672 O GLY A 109 -24.781 7.478 -4.563 1.00 0.38 O ATOM 0 H GLY A 109 -21.287 8.065 -2.314 1.00 0.29 H new ATOM 0 HA2 GLY A 109 -22.186 7.182 -4.907 1.00 0.30 H new ATOM 0 HA3 GLY A 109 -22.489 6.451 -3.344 1.00 0.30 H new ATOM 1676 N VAL A 110 -24.056 9.006 -3.064 1.00 0.37 N ATOM 1677 CA VAL A 110 -25.191 9.899 -3.226 1.00 0.46 C ATOM 1678 C VAL A 110 -25.226 10.282 -4.704 1.00 0.47 C ATOM 1679 O VAL A 110 -26.289 10.333 -5.326 1.00 0.54 O ATOM 1680 CB VAL A 110 -25.125 11.148 -2.305 1.00 0.56 C ATOM 1681 CG1 VAL A 110 -25.162 12.450 -3.098 1.00 1.09 C ATOM 1682 CG2 VAL A 110 -26.258 11.111 -1.291 1.00 0.78 C ATOM 0 H VAL A 110 -23.432 9.240 -2.292 1.00 0.37 H new ATOM 0 HA VAL A 110 -26.109 9.394 -2.924 1.00 0.46 H new ATOM 0 HB VAL A 110 -24.170 11.118 -1.780 1.00 0.56 H new ATOM 0 HG11 VAL A 110 -25.114 13.295 -2.412 1.00 1.09 H new ATOM 0 HG12 VAL A 110 -24.311 12.486 -3.779 1.00 1.09 H new ATOM 0 HG13 VAL A 110 -26.088 12.501 -3.671 1.00 1.09 H new ATOM 0 HG21 VAL A 110 -26.202 11.991 -0.651 1.00 0.78 H new ATOM 0 HG22 VAL A 110 -27.214 11.103 -1.814 1.00 0.78 H new ATOM 0 HG23 VAL A 110 -26.171 10.212 -0.681 1.00 0.78 H new ATOM 1692 N ASP A 111 -24.037 10.555 -5.257 1.00 0.45 N ATOM 1693 CA ASP A 111 -23.843 10.463 -6.712 1.00 0.52 C ATOM 1694 C ASP A 111 -23.747 8.991 -7.145 1.00 0.59 C ATOM 1695 O ASP A 111 -24.755 8.398 -7.537 1.00 1.05 O ATOM 1696 CB ASP A 111 -22.597 11.226 -7.178 1.00 0.60 C ATOM 1697 CG ASP A 111 -22.737 12.727 -7.045 1.00 1.30 C ATOM 1698 OD1 ASP A 111 -23.556 13.322 -7.779 1.00 1.86 O ATOM 1699 OD2 ASP A 111 -22.028 13.323 -6.211 1.00 1.87 O ATOM 0 H ASP A 111 -23.209 10.836 -4.732 1.00 0.45 H new ATOM 0 HA ASP A 111 -24.710 10.927 -7.183 1.00 0.52 H new ATOM 0 HB2 ASP A 111 -21.736 10.894 -6.597 1.00 0.60 H new ATOM 0 HB3 ASP A 111 -22.394 10.977 -8.219 1.00 0.60 H new ATOM 1704 N TRP A 112 -22.531 8.414 -7.064 1.00 0.43 N ATOM 1705 CA TRP A 112 -22.304 6.974 -7.303 1.00 0.45 C ATOM 1706 C TRP A 112 -20.811 6.607 -7.294 1.00 0.42 C ATOM 1707 O TRP A 112 -20.434 5.545 -6.824 1.00 0.43 O ATOM 1708 CB TRP A 112 -22.922 6.496 -8.625 1.00 0.57 C ATOM 1709 CG TRP A 112 -22.345 7.145 -9.851 1.00 0.64 C ATOM 1710 CD1 TRP A 112 -22.325 8.475 -10.164 1.00 0.72 C ATOM 1711 CD2 TRP A 112 -21.724 6.469 -10.939 1.00 0.78 C ATOM 1712 NE1 TRP A 112 -21.707 8.662 -11.378 1.00 0.83 N ATOM 1713 CE2 TRP A 112 -21.333 7.442 -11.875 1.00 0.86 C ATOM 1714 CE3 TRP A 112 -21.458 5.132 -11.202 1.00 0.96 C ATOM 1715 CZ2 TRP A 112 -20.683 7.111 -13.063 1.00 1.04 C ATOM 1716 CZ3 TRP A 112 -20.818 4.799 -12.380 1.00 1.16 C ATOM 1717 CH2 TRP A 112 -20.437 5.785 -13.299 1.00 1.17 C ATOM 0 H TRP A 112 -21.682 8.930 -6.832 1.00 0.43 H new ATOM 0 HA TRP A 112 -22.800 6.467 -6.475 1.00 0.45 H new ATOM 0 HB2 TRP A 112 -22.790 5.417 -8.704 1.00 0.57 H new ATOM 0 HB3 TRP A 112 -23.995 6.685 -8.600 1.00 0.57 H new ATOM 0 HD1 TRP A 112 -22.734 9.263 -9.549 1.00 0.72 H new ATOM 0 HE1 TRP A 112 -21.553 9.561 -11.833 1.00 0.83 H new ATOM 0 HE3 TRP A 112 -21.746 4.366 -10.498 1.00 0.96 H new ATOM 0 HZ2 TRP A 112 -20.385 7.871 -13.770 1.00 1.04 H new ATOM 0 HZ3 TRP A 112 -20.608 3.762 -12.596 1.00 1.16 H new ATOM 0 HH2 TRP A 112 -19.939 5.493 -14.212 1.00 1.17 H new ATOM 1728 N ASP A 113 -19.973 7.467 -7.833 1.00 0.42 N ATOM 1729 CA ASP A 113 -18.553 7.133 -7.969 1.00 0.42 C ATOM 1730 C ASP A 113 -17.734 7.631 -6.782 1.00 0.40 C ATOM 1731 O ASP A 113 -17.908 8.760 -6.322 1.00 0.50 O ATOM 1732 CB ASP A 113 -17.989 7.698 -9.278 1.00 0.51 C ATOM 1733 CG ASP A 113 -17.911 9.214 -9.295 1.00 1.26 C ATOM 1734 OD1 ASP A 113 -18.964 9.866 -9.447 1.00 2.15 O ATOM 1735 OD2 ASP A 113 -16.799 9.762 -9.132 1.00 1.61 O ATOM 0 H ASP A 113 -20.234 8.389 -8.182 1.00 0.42 H new ATOM 0 HA ASP A 113 -18.477 6.046 -7.989 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -16.992 7.288 -9.443 1.00 0.51 H new ATOM 0 HB3 ASP A 113 -18.612 7.364 -10.108 1.00 0.51 H new ATOM 1740 N ILE A 114 -16.861 6.763 -6.262 1.00 0.32 N ATOM 1741 CA ILE A 114 -15.995 7.127 -5.147 1.00 0.32 C ATOM 1742 C ILE A 114 -14.536 7.070 -5.586 1.00 0.32 C ATOM 1743 O ILE A 114 -14.170 6.306 -6.481 1.00 0.33 O ATOM 1744 CB ILE A 114 -16.141 6.202 -3.892 1.00 0.31 C ATOM 1745 CG1 ILE A 114 -17.571 5.678 -3.687 1.00 0.39 C ATOM 1746 CG2 ILE A 114 -15.679 6.943 -2.649 1.00 0.33 C ATOM 1747 CD1 ILE A 114 -17.983 4.603 -4.661 1.00 0.38 C ATOM 0 H ILE A 114 -16.739 5.807 -6.597 1.00 0.32 H new ATOM 0 HA ILE A 114 -16.304 8.132 -4.859 1.00 0.32 H new ATOM 0 HB ILE A 114 -15.511 5.330 -4.069 1.00 0.31 H new ATOM 0 HG12 ILE A 114 -17.661 5.287 -2.673 1.00 0.39 H new ATOM 0 HG13 ILE A 114 -18.267 6.513 -3.770 1.00 0.39 H new ATOM 0 HG21 ILE A 114 -15.783 6.294 -1.779 1.00 0.33 H new ATOM 0 HG22 ILE A 114 -14.634 7.231 -2.764 1.00 0.33 H new ATOM 0 HG23 ILE A 114 -16.288 7.836 -2.510 1.00 0.33 H new ATOM 0 HD11 ILE A 114 -19.005 4.290 -4.446 1.00 0.38 H new ATOM 0 HD12 ILE A 114 -17.929 4.993 -5.677 1.00 0.38 H new ATOM 0 HD13 ILE A 114 -17.313 3.748 -4.564 1.00 0.38 H new ATOM 1759 N ASP A 115 -13.721 7.883 -4.945 1.00 0.35 N ATOM 1760 CA ASP A 115 -12.285 7.866 -5.142 1.00 0.38 C ATOM 1761 C ASP A 115 -11.637 7.120 -3.982 1.00 0.34 C ATOM 1762 O ASP A 115 -12.233 7.016 -2.912 1.00 0.31 O ATOM 1763 CB ASP A 115 -11.749 9.298 -5.241 1.00 0.46 C ATOM 1764 CG ASP A 115 -11.948 10.097 -3.973 1.00 1.27 C ATOM 1765 OD1 ASP A 115 -13.113 10.285 -3.557 1.00 2.11 O ATOM 1766 OD2 ASP A 115 -10.943 10.579 -3.412 1.00 1.36 O ATOM 0 H ASP A 115 -14.038 8.578 -4.269 1.00 0.35 H new ATOM 0 HA ASP A 115 -12.044 7.355 -6.074 1.00 0.38 H new ATOM 0 HB2 ASP A 115 -10.686 9.266 -5.479 1.00 0.46 H new ATOM 0 HB3 ASP A 115 -12.245 9.809 -6.066 1.00 0.46 H new ATOM 1771 N TYR A 116 -10.462 6.542 -4.200 1.00 0.37 N ATOM 1772 CA TYR A 116 -9.767 5.790 -3.156 1.00 0.37 C ATOM 1773 C TYR A 116 -8.271 6.075 -3.244 1.00 0.40 C ATOM 1774 O TYR A 116 -7.787 6.509 -4.287 1.00 0.62 O ATOM 1775 CB TYR A 116 -10.003 4.275 -3.293 1.00 0.38 C ATOM 1776 CG TYR A 116 -11.431 3.827 -3.052 1.00 0.37 C ATOM 1777 CD1 TYR A 116 -12.416 4.027 -4.009 1.00 0.37 C ATOM 1778 CD2 TYR A 116 -11.787 3.191 -1.870 1.00 0.40 C ATOM 1779 CE1 TYR A 116 -13.715 3.613 -3.795 1.00 0.39 C ATOM 1780 CE2 TYR A 116 -13.086 2.771 -1.650 1.00 0.42 C ATOM 1781 CZ TYR A 116 -14.045 2.985 -2.617 1.00 0.41 C ATOM 1782 OH TYR A 116 -15.339 2.573 -2.403 1.00 0.45 O ATOM 0 H TYR A 116 -9.968 6.578 -5.091 1.00 0.37 H new ATOM 0 HA TYR A 116 -10.162 6.107 -2.191 1.00 0.37 H new ATOM 0 HB2 TYR A 116 -9.704 3.965 -4.294 1.00 0.38 H new ATOM 0 HB3 TYR A 116 -9.351 3.756 -2.591 1.00 0.38 H new ATOM 0 HD1 TYR A 116 -12.161 4.515 -4.938 1.00 0.37 H new ATOM 0 HD2 TYR A 116 -11.038 3.022 -1.111 1.00 0.40 H new ATOM 0 HE1 TYR A 116 -14.469 3.782 -4.549 1.00 0.39 H new ATOM 0 HE2 TYR A 116 -13.348 2.278 -0.726 1.00 0.42 H new ATOM 0 HH TYR A 116 -15.340 1.637 -2.112 1.00 0.45 H new ATOM 1792 N GLU A 117 -7.544 5.822 -2.165 1.00 0.27 N ATOM 1793 CA GLU A 117 -6.110 6.053 -2.124 1.00 0.28 C ATOM 1794 C GLU A 117 -5.459 5.100 -1.134 1.00 0.28 C ATOM 1795 O GLU A 117 -5.933 4.936 -0.008 1.00 0.31 O ATOM 1796 CB GLU A 117 -5.797 7.496 -1.716 1.00 0.31 C ATOM 1797 CG GLU A 117 -4.312 7.835 -1.762 1.00 0.39 C ATOM 1798 CD GLU A 117 -3.982 9.145 -1.072 1.00 0.51 C ATOM 1799 OE1 GLU A 117 -4.171 10.212 -1.691 1.00 0.66 O ATOM 1800 OE2 GLU A 117 -3.535 9.114 0.093 1.00 0.80 O ATOM 0 H GLU A 117 -7.931 5.452 -1.297 1.00 0.27 H new ATOM 0 HA GLU A 117 -5.712 5.877 -3.123 1.00 0.28 H new ATOM 0 HB2 GLU A 117 -6.337 8.176 -2.375 1.00 0.31 H new ATOM 0 HB3 GLU A 117 -6.169 7.668 -0.706 1.00 0.31 H new ATOM 0 HG2 GLU A 117 -3.746 7.030 -1.292 1.00 0.39 H new ATOM 0 HG3 GLU A 117 -3.989 7.887 -2.802 1.00 0.39 H new ATOM 1807 N LEU A 118 -4.390 4.461 -1.560 1.00 0.29 N ATOM 1808 CA LEU A 118 -3.616 3.613 -0.678 1.00 0.28 C ATOM 1809 C LEU A 118 -2.361 4.334 -0.217 1.00 0.28 C ATOM 1810 O LEU A 118 -1.646 4.929 -1.017 1.00 0.32 O ATOM 1811 CB LEU A 118 -3.255 2.300 -1.380 1.00 0.35 C ATOM 1812 CG LEU A 118 -2.044 1.554 -0.813 1.00 0.40 C ATOM 1813 CD1 LEU A 118 -2.281 1.165 0.635 1.00 1.24 C ATOM 1814 CD2 LEU A 118 -1.736 0.324 -1.650 1.00 1.25 C ATOM 0 H LEU A 118 -4.036 4.513 -2.515 1.00 0.29 H new ATOM 0 HA LEU A 118 -4.221 3.380 0.198 1.00 0.28 H new ATOM 0 HB2 LEU A 118 -4.119 1.637 -1.337 1.00 0.35 H new ATOM 0 HB3 LEU A 118 -3.068 2.512 -2.433 1.00 0.35 H new ATOM 0 HG LEU A 118 -1.184 2.223 -0.851 1.00 0.40 H new ATOM 0 HD11 LEU A 118 -1.408 0.636 1.017 1.00 1.24 H new ATOM 0 HD12 LEU A 118 -2.451 2.063 1.230 1.00 1.24 H new ATOM 0 HD13 LEU A 118 -3.155 0.517 0.699 1.00 1.24 H new ATOM 0 HD21 LEU A 118 -0.872 -0.194 -1.232 1.00 1.25 H new ATOM 0 HD22 LEU A 118 -2.597 -0.344 -1.645 1.00 1.25 H new ATOM 0 HD23 LEU A 118 -1.517 0.626 -2.674 1.00 1.25 H new ATOM 1826 N GLN A 119 -2.112 4.286 1.075 1.00 0.26 N ATOM 1827 CA GLN A 119 -0.899 4.840 1.643 1.00 0.27 C ATOM 1828 C GLN A 119 -0.106 3.725 2.294 1.00 0.26 C ATOM 1829 O GLN A 119 -0.405 3.309 3.405 1.00 0.27 O ATOM 1830 CB GLN A 119 -1.237 5.899 2.686 1.00 0.30 C ATOM 1831 CG GLN A 119 -0.057 6.767 3.084 1.00 0.37 C ATOM 1832 CD GLN A 119 0.218 7.881 2.095 1.00 0.46 C ATOM 1833 OE1 GLN A 119 0.732 8.938 2.461 1.00 0.63 O ATOM 1834 NE2 GLN A 119 -0.152 7.670 0.847 1.00 0.51 N ATOM 0 H GLN A 119 -2.741 3.864 1.759 1.00 0.26 H new ATOM 0 HA GLN A 119 -0.312 5.304 0.851 1.00 0.27 H new ATOM 0 HB2 GLN A 119 -2.031 6.537 2.298 1.00 0.30 H new ATOM 0 HB3 GLN A 119 -1.630 5.407 3.576 1.00 0.30 H new ATOM 0 HG2 GLN A 119 -0.246 7.199 4.067 1.00 0.37 H new ATOM 0 HG3 GLN A 119 0.832 6.143 3.176 1.00 0.37 H new ATOM 0 HE21 GLN A 119 -0.575 6.780 0.584 1.00 0.51 H new ATOM 0 HE22 GLN A 119 -0.016 8.397 0.145 1.00 0.51 H new ATOM 1843 N ILE A 120 0.888 3.237 1.598 1.00 0.26 N ATOM 1844 CA ILE A 120 1.618 2.085 2.076 1.00 0.26 C ATOM 1845 C ILE A 120 3.091 2.436 2.311 1.00 0.23 C ATOM 1846 O ILE A 120 3.784 2.933 1.424 1.00 0.24 O ATOM 1847 CB ILE A 120 1.414 0.896 1.093 1.00 0.31 C ATOM 1848 CG1 ILE A 120 1.762 -0.461 1.729 1.00 0.45 C ATOM 1849 CG2 ILE A 120 2.179 1.109 -0.200 1.00 0.36 C ATOM 1850 CD1 ILE A 120 3.229 -0.681 2.010 1.00 0.81 C ATOM 0 H ILE A 120 1.211 3.613 0.706 1.00 0.26 H new ATOM 0 HA ILE A 120 1.229 1.771 3.045 1.00 0.26 H new ATOM 0 HB ILE A 120 0.351 0.868 0.855 1.00 0.31 H new ATOM 0 HG12 ILE A 120 1.211 -0.558 2.664 1.00 0.45 H new ATOM 0 HG13 ILE A 120 1.412 -1.254 1.069 1.00 0.45 H new ATOM 0 HG21 ILE A 120 2.015 0.260 -0.864 1.00 0.36 H new ATOM 0 HG22 ILE A 120 1.829 2.021 -0.684 1.00 0.36 H new ATOM 0 HG23 ILE A 120 3.243 1.199 0.017 1.00 0.36 H new ATOM 0 HD11 ILE A 120 3.370 -1.665 2.457 1.00 0.81 H new ATOM 0 HD12 ILE A 120 3.791 -0.622 1.078 1.00 0.81 H new ATOM 0 HD13 ILE A 120 3.587 0.085 2.698 1.00 0.81 H new ATOM 1862 N GLY A 121 3.531 2.239 3.547 1.00 0.23 N ATOM 1863 CA GLY A 121 4.908 2.485 3.913 1.00 0.23 C ATOM 1864 C GLY A 121 5.770 1.262 3.715 1.00 0.22 C ATOM 1865 O GLY A 121 5.433 0.174 4.189 1.00 0.26 O ATOM 0 H GLY A 121 2.945 1.907 4.313 1.00 0.23 H new ATOM 0 HA2 GLY A 121 5.301 3.307 3.315 1.00 0.23 H new ATOM 0 HA3 GLY A 121 4.956 2.798 4.956 1.00 0.23 H new ATOM 1869 N LEU A 122 6.878 1.444 3.023 1.00 0.23 N ATOM 1870 CA LEU A 122 7.757 0.347 2.657 1.00 0.25 C ATOM 1871 C LEU A 122 8.955 0.286 3.574 1.00 0.23 C ATOM 1872 O LEU A 122 9.818 1.151 3.536 1.00 0.30 O ATOM 1873 CB LEU A 122 8.236 0.516 1.218 1.00 0.30 C ATOM 1874 CG LEU A 122 7.286 0.012 0.138 1.00 0.45 C ATOM 1875 CD1 LEU A 122 5.866 0.458 0.401 1.00 1.20 C ATOM 1876 CD2 LEU A 122 7.742 0.506 -1.212 1.00 1.00 C ATOM 0 H LEU A 122 7.196 2.357 2.698 1.00 0.23 H new ATOM 0 HA LEU A 122 7.193 -0.581 2.751 1.00 0.25 H new ATOM 0 HB2 LEU A 122 8.428 1.574 1.041 1.00 0.30 H new ATOM 0 HB3 LEU A 122 9.188 -0.003 1.109 1.00 0.30 H new ATOM 0 HG LEU A 122 7.302 -1.078 0.152 1.00 0.45 H new ATOM 0 HD11 LEU A 122 5.214 0.082 -0.388 1.00 1.20 H new ATOM 0 HD12 LEU A 122 5.534 0.067 1.363 1.00 1.20 H new ATOM 0 HD13 LEU A 122 5.824 1.547 0.418 1.00 1.20 H new ATOM 0 HD21 LEU A 122 7.060 0.144 -1.981 1.00 1.00 H new ATOM 0 HD22 LEU A 122 7.749 1.596 -1.217 1.00 1.00 H new ATOM 0 HD23 LEU A 122 8.747 0.136 -1.414 1.00 1.00 H new ATOM 1888 N THR A 123 8.982 -0.725 4.409 1.00 0.22 N ATOM 1889 CA THR A 123 10.111 -0.969 5.277 1.00 0.21 C ATOM 1890 C THR A 123 10.777 -2.281 4.895 1.00 0.23 C ATOM 1891 O THR A 123 10.332 -3.343 5.298 1.00 0.32 O ATOM 1892 CB THR A 123 9.659 -1.050 6.739 1.00 0.24 C ATOM 1893 OG1 THR A 123 9.022 0.173 7.140 1.00 0.26 O ATOM 1894 CG2 THR A 123 10.828 -1.366 7.664 1.00 0.26 C ATOM 0 H THR A 123 8.224 -1.401 4.507 1.00 0.22 H new ATOM 0 HA THR A 123 10.815 -0.145 5.164 1.00 0.21 H new ATOM 0 HB THR A 123 8.937 -1.863 6.818 1.00 0.24 H new ATOM 0 HG1 THR A 123 8.278 -0.029 7.745 1.00 0.26 H new ATOM 0 HG21 THR A 123 10.474 -1.417 8.694 1.00 0.26 H new ATOM 0 HG22 THR A 123 11.265 -2.324 7.383 1.00 0.26 H new ATOM 0 HG23 THR A 123 11.582 -0.584 7.578 1.00 0.26 H new ATOM 1902 N ILE A 124 11.822 -2.221 4.105 1.00 0.20 N ATOM 1903 CA ILE A 124 12.462 -3.439 3.643 1.00 0.21 C ATOM 1904 C ILE A 124 13.831 -3.624 4.278 1.00 0.24 C ATOM 1905 O ILE A 124 14.620 -2.682 4.374 1.00 0.32 O ATOM 1906 CB ILE A 124 12.570 -3.510 2.099 1.00 0.23 C ATOM 1907 CG1 ILE A 124 13.073 -2.186 1.494 1.00 0.25 C ATOM 1908 CG2 ILE A 124 11.223 -3.903 1.504 1.00 0.25 C ATOM 1909 CD1 ILE A 124 11.992 -1.151 1.233 1.00 0.98 C ATOM 0 H ILE A 124 12.246 -1.356 3.770 1.00 0.20 H new ATOM 0 HA ILE A 124 11.817 -4.258 3.961 1.00 0.21 H new ATOM 0 HB ILE A 124 13.308 -4.272 1.848 1.00 0.23 H new ATOM 0 HG12 ILE A 124 13.814 -1.754 2.167 1.00 0.25 H new ATOM 0 HG13 ILE A 124 13.583 -2.403 0.555 1.00 0.25 H new ATOM 0 HG21 ILE A 124 11.305 -3.951 0.418 1.00 0.25 H new ATOM 0 HG22 ILE A 124 10.926 -4.878 1.889 1.00 0.25 H new ATOM 0 HG23 ILE A 124 10.473 -3.161 1.779 1.00 0.25 H new ATOM 0 HD11 ILE A 124 12.442 -0.254 0.807 1.00 0.98 H new ATOM 0 HD12 ILE A 124 11.261 -1.557 0.534 1.00 0.98 H new ATOM 0 HD13 ILE A 124 11.496 -0.898 2.170 1.00 0.98 H new ATOM 1921 N ASP A 125 14.085 -4.846 4.739 1.00 0.25 N ATOM 1922 CA ASP A 125 15.355 -5.197 5.353 1.00 0.30 C ATOM 1923 C ASP A 125 16.364 -5.426 4.250 1.00 0.30 C ATOM 1924 O ASP A 125 16.306 -6.441 3.555 1.00 0.31 O ATOM 1925 CB ASP A 125 15.188 -6.469 6.194 1.00 0.37 C ATOM 1926 CG ASP A 125 16.261 -6.647 7.243 1.00 0.91 C ATOM 1927 OD1 ASP A 125 17.423 -6.929 6.887 1.00 1.44 O ATOM 1928 OD2 ASP A 125 15.938 -6.515 8.445 1.00 1.52 O ATOM 0 H ASP A 125 13.417 -5.615 4.696 1.00 0.25 H new ATOM 0 HA ASP A 125 15.697 -4.395 6.008 1.00 0.30 H new ATOM 0 HB2 ASP A 125 14.214 -6.446 6.683 1.00 0.37 H new ATOM 0 HB3 ASP A 125 15.192 -7.335 5.532 1.00 0.37 H new ATOM 1933 N LEU A 126 17.274 -4.472 4.110 1.00 0.32 N ATOM 1934 CA LEU A 126 18.204 -4.425 2.988 1.00 0.33 C ATOM 1935 C LEU A 126 19.639 -4.587 3.471 1.00 0.37 C ATOM 1936 O LEU A 126 19.891 -4.573 4.668 1.00 0.55 O ATOM 1937 CB LEU A 126 18.051 -3.086 2.257 1.00 0.42 C ATOM 1938 CG LEU A 126 16.758 -2.915 1.456 1.00 0.38 C ATOM 1939 CD1 LEU A 126 16.437 -1.445 1.300 1.00 1.26 C ATOM 1940 CD2 LEU A 126 16.885 -3.563 0.086 1.00 1.28 C ATOM 0 H LEU A 126 17.389 -3.706 4.773 1.00 0.32 H new ATOM 0 HA LEU A 126 17.975 -5.245 2.307 1.00 0.33 H new ATOM 0 HB2 LEU A 126 18.112 -2.283 2.991 1.00 0.42 H new ATOM 0 HB3 LEU A 126 18.896 -2.963 1.580 1.00 0.42 H new ATOM 0 HG LEU A 126 15.950 -3.405 1.999 1.00 0.38 H new ATOM 0 HD11 LEU A 126 15.515 -1.332 0.729 1.00 1.26 H new ATOM 0 HD12 LEU A 126 16.311 -0.994 2.284 1.00 1.26 H new ATOM 0 HD13 LEU A 126 17.253 -0.948 0.774 1.00 1.26 H new ATOM 0 HD21 LEU A 126 15.955 -3.430 -0.467 1.00 1.28 H new ATOM 0 HD22 LEU A 126 17.703 -3.097 -0.463 1.00 1.28 H new ATOM 0 HD23 LEU A 126 17.088 -4.627 0.204 1.00 1.28 H new ATOM 1952 N PRO A 127 20.605 -4.762 2.557 1.00 0.43 N ATOM 1953 CA PRO A 127 22.021 -4.791 2.924 1.00 0.52 C ATOM 1954 C PRO A 127 22.627 -3.389 3.009 1.00 0.60 C ATOM 1955 O PRO A 127 23.628 -3.169 3.688 1.00 0.74 O ATOM 1956 CB PRO A 127 22.647 -5.571 1.772 1.00 0.60 C ATOM 1957 CG PRO A 127 21.811 -5.222 0.592 1.00 0.73 C ATOM 1958 CD PRO A 127 20.408 -5.014 1.112 1.00 0.55 C ATOM 0 HA PRO A 127 22.188 -5.231 3.907 1.00 0.52 H new ATOM 0 HB2 PRO A 127 23.688 -5.287 1.619 1.00 0.60 H new ATOM 0 HB3 PRO A 127 22.634 -6.644 1.965 1.00 0.60 H new ATOM 0 HG2 PRO A 127 22.183 -4.320 0.105 1.00 0.73 H new ATOM 0 HG3 PRO A 127 21.836 -6.019 -0.151 1.00 0.73 H new ATOM 0 HD2 PRO A 127 19.920 -4.172 0.621 1.00 0.55 H new ATOM 0 HD3 PRO A 127 19.783 -5.890 0.940 1.00 0.55 H new ATOM 1966 N VAL A 128 22.011 -2.446 2.304 1.00 0.60 N ATOM 1967 CA VAL A 128 22.540 -1.091 2.210 1.00 0.72 C ATOM 1968 C VAL A 128 22.310 -0.301 3.501 1.00 0.71 C ATOM 1969 O VAL A 128 23.257 0.172 4.124 1.00 0.82 O ATOM 1970 CB VAL A 128 21.904 -0.330 1.027 1.00 0.83 C ATOM 1971 CG1 VAL A 128 22.585 1.014 0.822 1.00 1.12 C ATOM 1972 CG2 VAL A 128 21.968 -1.169 -0.244 1.00 1.02 C ATOM 0 H VAL A 128 21.144 -2.596 1.789 1.00 0.60 H new ATOM 0 HA VAL A 128 23.614 -1.183 2.046 1.00 0.72 H new ATOM 0 HB VAL A 128 20.856 -0.145 1.262 1.00 0.83 H new ATOM 0 HG11 VAL A 128 22.121 1.533 -0.017 1.00 1.12 H new ATOM 0 HG12 VAL A 128 22.480 1.616 1.724 1.00 1.12 H new ATOM 0 HG13 VAL A 128 23.643 0.857 0.611 1.00 1.12 H new ATOM 0 HG21 VAL A 128 21.515 -0.617 -1.068 1.00 1.02 H new ATOM 0 HG22 VAL A 128 23.009 -1.389 -0.483 1.00 1.02 H new ATOM 0 HG23 VAL A 128 21.426 -2.102 -0.092 1.00 1.02 H new ATOM 1982 N VAL A 129 21.047 -0.176 3.905 1.00 0.62 N ATOM 1983 CA VAL A 129 20.688 0.595 5.099 1.00 0.63 C ATOM 1984 C VAL A 129 20.290 -0.352 6.224 1.00 0.55 C ATOM 1985 O VAL A 129 19.969 0.059 7.336 1.00 0.55 O ATOM 1986 CB VAL A 129 19.496 1.538 4.828 1.00 0.69 C ATOM 1987 CG1 VAL A 129 19.626 2.819 5.637 1.00 1.35 C ATOM 1988 CG2 VAL A 129 19.354 1.834 3.343 1.00 1.26 C ATOM 0 H VAL A 129 20.253 -0.598 3.424 1.00 0.62 H new ATOM 0 HA VAL A 129 21.559 1.188 5.377 1.00 0.63 H new ATOM 0 HB VAL A 129 18.586 1.030 5.148 1.00 0.69 H new ATOM 0 HG11 VAL A 129 18.775 3.468 5.430 1.00 1.35 H new ATOM 0 HG12 VAL A 129 19.648 2.578 6.700 1.00 1.35 H new ATOM 0 HG13 VAL A 129 20.548 3.331 5.362 1.00 1.35 H new ATOM 0 HG21 VAL A 129 18.506 2.500 3.184 1.00 1.26 H new ATOM 0 HG22 VAL A 129 20.264 2.311 2.978 1.00 1.26 H new ATOM 0 HG23 VAL A 129 19.190 0.903 2.800 1.00 1.26 H new ATOM 1998 N GLY A 130 20.317 -1.627 5.892 1.00 0.53 N ATOM 1999 CA GLY A 130 19.799 -2.663 6.785 1.00 0.55 C ATOM 2000 C GLY A 130 18.285 -2.665 6.827 1.00 0.58 C ATOM 2001 O GLY A 130 17.654 -3.689 7.057 1.00 1.05 O ATOM 0 H GLY A 130 20.691 -1.978 5.011 1.00 0.53 H new ATOM 0 HA2 GLY A 130 20.155 -3.639 6.454 1.00 0.55 H new ATOM 0 HA3 GLY A 130 20.190 -2.505 7.790 1.00 0.55 H new ATOM 2005 N GLU A 131 17.719 -1.501 6.591 1.00 0.49 N ATOM 2006 CA GLU A 131 16.294 -1.299 6.533 1.00 0.46 C ATOM 2007 C GLU A 131 16.055 0.057 5.896 1.00 0.49 C ATOM 2008 O GLU A 131 16.788 1.010 6.167 1.00 0.75 O ATOM 2009 CB GLU A 131 15.667 -1.336 7.933 1.00 0.59 C ATOM 2010 CG GLU A 131 15.951 -0.091 8.766 1.00 0.73 C ATOM 2011 CD GLU A 131 15.207 -0.074 10.085 1.00 0.93 C ATOM 2012 OE1 GLU A 131 15.456 -0.966 10.926 1.00 1.01 O ATOM 2013 OE2 GLU A 131 14.366 0.821 10.288 1.00 1.16 O ATOM 0 H GLU A 131 18.255 -0.648 6.430 1.00 0.49 H new ATOM 0 HA GLU A 131 15.832 -2.096 5.951 1.00 0.46 H new ATOM 0 HB2 GLU A 131 14.588 -1.458 7.835 1.00 0.59 H new ATOM 0 HB3 GLU A 131 16.040 -2.211 8.465 1.00 0.59 H new ATOM 0 HG2 GLU A 131 17.022 -0.027 8.959 1.00 0.73 H new ATOM 0 HG3 GLU A 131 15.678 0.794 8.191 1.00 0.73 H new ATOM 2020 N PHE A 132 15.085 0.145 5.022 1.00 0.39 N ATOM 2021 CA PHE A 132 14.721 1.426 4.456 1.00 0.48 C ATOM 2022 C PHE A 132 13.218 1.576 4.525 1.00 0.35 C ATOM 2023 O PHE A 132 12.488 0.666 4.138 1.00 0.33 O ATOM 2024 CB PHE A 132 15.223 1.545 3.015 1.00 0.69 C ATOM 2025 CG PHE A 132 15.347 2.965 2.534 1.00 1.02 C ATOM 2026 CD1 PHE A 132 16.062 3.899 3.265 1.00 1.22 C ATOM 2027 CD2 PHE A 132 14.734 3.367 1.360 1.00 1.31 C ATOM 2028 CE1 PHE A 132 16.163 5.206 2.832 1.00 1.66 C ATOM 2029 CE2 PHE A 132 14.831 4.672 0.921 1.00 1.74 C ATOM 2030 CZ PHE A 132 15.608 5.581 1.636 1.00 1.91 C ATOM 0 H PHE A 132 14.535 -0.646 4.687 1.00 0.39 H new ATOM 0 HA PHE A 132 15.190 2.227 5.027 1.00 0.48 H new ATOM 0 HB2 PHE A 132 16.195 1.058 2.937 1.00 0.69 H new ATOM 0 HB3 PHE A 132 14.542 1.006 2.357 1.00 0.69 H new ATOM 0 HD1 PHE A 132 16.546 3.602 4.184 1.00 1.22 H new ATOM 0 HD2 PHE A 132 14.172 2.650 0.780 1.00 1.31 H new ATOM 0 HE1 PHE A 132 16.681 5.935 3.437 1.00 1.66 H new ATOM 0 HE2 PHE A 132 14.308 4.986 0.030 1.00 1.74 H new ATOM 0 HZ PHE A 132 15.772 6.576 1.250 1.00 1.91 H new ATOM 2040 N THR A 133 12.757 2.691 5.068 1.00 0.37 N ATOM 2041 CA THR A 133 11.335 2.900 5.235 1.00 0.32 C ATOM 2042 C THR A 133 10.864 4.155 4.492 1.00 0.31 C ATOM 2043 O THR A 133 11.079 5.293 4.918 1.00 0.36 O ATOM 2044 CB THR A 133 10.942 2.925 6.738 1.00 0.44 C ATOM 2045 OG1 THR A 133 9.517 2.975 6.879 1.00 1.19 O ATOM 2046 CG2 THR A 133 11.580 4.091 7.485 1.00 1.17 C ATOM 0 H THR A 133 13.344 3.457 5.397 1.00 0.37 H new ATOM 0 HA THR A 133 10.817 2.053 4.785 1.00 0.32 H new ATOM 0 HB THR A 133 11.321 2.005 7.183 1.00 0.44 H new ATOM 0 HG1 THR A 133 9.168 2.067 6.997 1.00 1.19 H new ATOM 0 HG21 THR A 133 11.274 4.064 8.531 1.00 1.17 H new ATOM 0 HG22 THR A 133 12.665 4.013 7.422 1.00 1.17 H new ATOM 0 HG23 THR A 133 11.257 5.031 7.037 1.00 1.17 H new ATOM 2054 N ILE A 134 10.270 3.928 3.333 1.00 0.28 N ATOM 2055 CA ILE A 134 9.703 4.995 2.530 1.00 0.31 C ATOM 2056 C ILE A 134 8.259 4.670 2.186 1.00 0.28 C ATOM 2057 O ILE A 134 7.947 3.548 1.811 1.00 0.26 O ATOM 2058 CB ILE A 134 10.518 5.234 1.236 1.00 0.36 C ATOM 2059 CG1 ILE A 134 10.794 3.917 0.496 1.00 0.41 C ATOM 2060 CG2 ILE A 134 11.816 5.951 1.555 1.00 0.41 C ATOM 2061 CD1 ILE A 134 9.777 3.599 -0.581 1.00 0.50 C ATOM 0 H ILE A 134 10.168 2.999 2.923 1.00 0.28 H new ATOM 0 HA ILE A 134 9.741 5.912 3.117 1.00 0.31 H new ATOM 0 HB ILE A 134 9.923 5.865 0.576 1.00 0.36 H new ATOM 0 HG12 ILE A 134 11.785 3.965 0.045 1.00 0.41 H new ATOM 0 HG13 ILE A 134 10.812 3.101 1.219 1.00 0.41 H new ATOM 0 HG21 ILE A 134 12.378 6.112 0.635 1.00 0.41 H new ATOM 0 HG22 ILE A 134 11.596 6.913 2.019 1.00 0.41 H new ATOM 0 HG23 ILE A 134 12.408 5.344 2.240 1.00 0.41 H new ATOM 0 HD11 ILE A 134 10.037 2.655 -1.060 1.00 0.50 H new ATOM 0 HD12 ILE A 134 8.786 3.518 -0.134 1.00 0.50 H new ATOM 0 HD13 ILE A 134 9.775 4.395 -1.326 1.00 0.50 H new ATOM 2073 N PRO A 135 7.341 5.616 2.354 1.00 0.30 N ATOM 2074 CA PRO A 135 5.952 5.406 2.001 1.00 0.29 C ATOM 2075 C PRO A 135 5.679 5.703 0.531 1.00 0.28 C ATOM 2076 O PRO A 135 6.458 6.386 -0.137 1.00 0.31 O ATOM 2077 CB PRO A 135 5.193 6.387 2.911 1.00 0.35 C ATOM 2078 CG PRO A 135 6.240 7.196 3.627 1.00 0.45 C ATOM 2079 CD PRO A 135 7.549 6.943 2.929 1.00 0.39 C ATOM 0 HA PRO A 135 5.648 4.368 2.138 1.00 0.29 H new ATOM 0 HB2 PRO A 135 4.537 7.031 2.326 1.00 0.35 H new ATOM 0 HB3 PRO A 135 4.563 5.851 3.621 1.00 0.35 H new ATOM 0 HG2 PRO A 135 5.990 8.257 3.604 1.00 0.45 H new ATOM 0 HG3 PRO A 135 6.300 6.906 4.676 1.00 0.45 H new ATOM 0 HD2 PRO A 135 7.753 7.691 2.163 1.00 0.39 H new ATOM 0 HD3 PRO A 135 8.390 6.959 3.622 1.00 0.39 H new ATOM 2087 N ILE A 136 4.564 5.193 0.042 1.00 0.26 N ATOM 2088 CA ILE A 136 4.162 5.390 -1.332 1.00 0.27 C ATOM 2089 C ILE A 136 2.646 5.233 -1.410 1.00 0.26 C ATOM 2090 O ILE A 136 2.021 4.752 -0.465 1.00 0.26 O ATOM 2091 CB ILE A 136 4.902 4.407 -2.284 1.00 0.28 C ATOM 2092 CG1 ILE A 136 4.680 4.785 -3.763 1.00 0.44 C ATOM 2093 CG2 ILE A 136 4.487 2.968 -2.008 1.00 0.33 C ATOM 2094 CD1 ILE A 136 3.696 3.905 -4.506 1.00 0.32 C ATOM 0 H ILE A 136 3.913 4.630 0.590 1.00 0.26 H new ATOM 0 HA ILE A 136 4.437 6.391 -1.663 1.00 0.27 H new ATOM 0 HB ILE A 136 5.971 4.488 -2.086 1.00 0.28 H new ATOM 0 HG12 ILE A 136 4.330 5.816 -3.811 1.00 0.44 H new ATOM 0 HG13 ILE A 136 5.639 4.749 -4.280 1.00 0.44 H new ATOM 0 HG21 ILE A 136 5.018 2.300 -2.686 1.00 0.33 H new ATOM 0 HG22 ILE A 136 4.733 2.710 -0.978 1.00 0.33 H new ATOM 0 HG23 ILE A 136 3.413 2.863 -2.162 1.00 0.33 H new ATOM 0 HD11 ILE A 136 3.607 4.249 -5.537 1.00 0.32 H new ATOM 0 HD12 ILE A 136 4.051 2.874 -4.497 1.00 0.32 H new ATOM 0 HD13 ILE A 136 2.722 3.958 -4.020 1.00 0.32 H new ATOM 2106 N SER A 137 2.057 5.639 -2.515 1.00 0.28 N ATOM 2107 CA SER A 137 0.615 5.728 -2.596 1.00 0.30 C ATOM 2108 C SER A 137 0.107 5.138 -3.896 1.00 0.30 C ATOM 2109 O SER A 137 0.786 5.206 -4.921 1.00 0.32 O ATOM 2110 CB SER A 137 0.184 7.188 -2.490 1.00 0.34 C ATOM 2111 OG SER A 137 1.038 7.917 -1.622 1.00 0.88 O ATOM 0 H SER A 137 2.551 5.911 -3.365 1.00 0.28 H new ATOM 0 HA SER A 137 0.188 5.158 -1.771 1.00 0.30 H new ATOM 0 HB2 SER A 137 0.193 7.645 -3.480 1.00 0.34 H new ATOM 0 HB3 SER A 137 -0.841 7.241 -2.124 1.00 0.34 H new ATOM 0 HG SER A 137 0.841 8.874 -1.697 1.00 0.88 H new ATOM 2117 N SER A 138 -1.084 4.563 -3.858 1.00 0.31 N ATOM 2118 CA SER A 138 -1.723 4.063 -5.056 1.00 0.34 C ATOM 2119 C SER A 138 -3.212 4.359 -4.960 1.00 0.34 C ATOM 2120 O SER A 138 -3.941 3.711 -4.215 1.00 0.35 O ATOM 2121 CB SER A 138 -1.469 2.558 -5.219 1.00 0.40 C ATOM 2122 OG SER A 138 -1.988 2.068 -6.448 1.00 0.96 O ATOM 0 H SER A 138 -1.627 4.432 -3.004 1.00 0.31 H new ATOM 0 HA SER A 138 -1.307 4.556 -5.935 1.00 0.34 H new ATOM 0 HB2 SER A 138 -0.398 2.363 -5.173 1.00 0.40 H new ATOM 0 HB3 SER A 138 -1.928 2.019 -4.390 1.00 0.40 H new ATOM 0 HG SER A 138 -1.807 1.107 -6.520 1.00 0.96 H new ATOM 2128 N LYS A 139 -3.649 5.369 -5.684 1.00 0.36 N ATOM 2129 CA LYS A 139 -5.029 5.816 -5.606 1.00 0.38 C ATOM 2130 C LYS A 139 -5.785 5.437 -6.866 1.00 0.41 C ATOM 2131 O LYS A 139 -5.202 5.396 -7.951 1.00 0.47 O ATOM 2132 CB LYS A 139 -5.077 7.328 -5.383 1.00 0.44 C ATOM 2133 CG LYS A 139 -4.343 8.142 -6.440 1.00 0.57 C ATOM 2134 CD LYS A 139 -3.288 9.039 -5.817 1.00 0.92 C ATOM 2135 CE LYS A 139 -3.878 9.891 -4.707 1.00 1.35 C ATOM 2136 NZ LYS A 139 -2.839 10.669 -3.984 1.00 1.76 N ATOM 0 H LYS A 139 -3.069 5.898 -6.335 1.00 0.36 H new ATOM 0 HA LYS A 139 -5.510 5.322 -4.761 1.00 0.38 H new ATOM 0 HB2 LYS A 139 -6.119 7.646 -5.355 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -4.649 7.553 -4.406 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -3.873 7.469 -7.157 1.00 0.57 H new ATOM 0 HG3 LYS A 139 -5.058 8.750 -6.994 1.00 0.57 H new ATOM 0 HD2 LYS A 139 -2.477 8.429 -5.419 1.00 0.92 H new ATOM 0 HD3 LYS A 139 -2.856 9.683 -6.583 1.00 0.92 H new ATOM 0 HE2 LYS A 139 -4.614 10.575 -5.129 1.00 1.35 H new ATOM 0 HE3 LYS A 139 -4.406 9.250 -4.001 1.00 1.35 H new ATOM 0 HZ1 LYS A 139 -3.013 10.612 -2.960 1.00 1.76 H new ATOM 0 HZ2 LYS A 139 -1.900 10.277 -4.198 1.00 1.76 H new ATOM 0 HZ3 LYS A 139 -2.876 11.663 -4.287 1.00 1.76 H new ATOM 2150 N GLY A 140 -7.074 5.149 -6.733 1.00 0.42 N ATOM 2151 CA GLY A 140 -7.867 4.772 -7.876 1.00 0.50 C ATOM 2152 C GLY A 140 -9.344 4.990 -7.618 1.00 0.46 C ATOM 2153 O GLY A 140 -9.850 4.676 -6.543 1.00 0.47 O ATOM 0 H GLY A 140 -7.581 5.171 -5.848 1.00 0.42 H new ATOM 0 HA2 GLY A 140 -7.558 5.354 -8.744 1.00 0.50 H new ATOM 0 HA3 GLY A 140 -7.688 3.724 -8.115 1.00 0.50 H new ATOM 2157 N GLU A 141 -10.014 5.552 -8.598 1.00 0.44 N ATOM 2158 CA GLU A 141 -11.444 5.825 -8.497 1.00 0.42 C ATOM 2159 C GLU A 141 -12.213 4.808 -9.322 1.00 0.43 C ATOM 2160 O GLU A 141 -11.886 4.592 -10.491 1.00 0.48 O ATOM 2161 CB GLU A 141 -11.777 7.241 -8.977 1.00 0.45 C ATOM 2162 CG GLU A 141 -10.630 8.229 -8.851 1.00 0.52 C ATOM 2163 CD GLU A 141 -9.725 8.216 -10.067 1.00 1.24 C ATOM 2164 OE1 GLU A 141 -10.140 8.717 -11.133 1.00 1.51 O ATOM 2165 OE2 GLU A 141 -8.586 7.719 -9.956 1.00 2.10 O ATOM 0 H GLU A 141 -9.595 5.834 -9.484 1.00 0.44 H new ATOM 0 HA GLU A 141 -11.734 5.748 -7.449 1.00 0.42 H new ATOM 0 HB2 GLU A 141 -12.088 7.195 -10.021 1.00 0.45 H new ATOM 0 HB3 GLU A 141 -12.628 7.615 -8.407 1.00 0.45 H new ATOM 0 HG2 GLU A 141 -11.031 9.233 -8.710 1.00 0.52 H new ATOM 0 HG3 GLU A 141 -10.045 7.992 -7.962 1.00 0.52 H new ATOM 2172 N ILE A 142 -13.231 4.184 -8.732 1.00 0.42 N ATOM 2173 CA ILE A 142 -13.989 3.143 -9.414 1.00 0.47 C ATOM 2174 C ILE A 142 -15.464 3.300 -9.048 1.00 0.46 C ATOM 2175 O ILE A 142 -15.817 4.157 -8.231 1.00 0.42 O ATOM 2176 CB ILE A 142 -13.511 1.689 -9.092 1.00 0.54 C ATOM 2177 CG1 ILE A 142 -14.109 1.153 -7.780 1.00 0.76 C ATOM 2178 CG2 ILE A 142 -11.991 1.603 -9.046 1.00 0.60 C ATOM 2179 CD1 ILE A 142 -13.615 1.845 -6.535 1.00 0.67 C ATOM 0 H ILE A 142 -13.548 4.383 -7.783 1.00 0.42 H new ATOM 0 HA ILE A 142 -13.826 3.275 -10.484 1.00 0.47 H new ATOM 0 HB ILE A 142 -13.875 1.060 -9.904 1.00 0.54 H new ATOM 0 HG12 ILE A 142 -15.194 1.247 -7.826 1.00 0.76 H new ATOM 0 HG13 ILE A 142 -13.884 0.089 -7.702 1.00 0.76 H new ATOM 0 HG21 ILE A 142 -11.691 0.580 -8.820 1.00 0.60 H new ATOM 0 HG22 ILE A 142 -11.581 1.896 -10.012 1.00 0.60 H new ATOM 0 HG23 ILE A 142 -11.612 2.271 -8.273 1.00 0.60 H new ATOM 0 HD11 ILE A 142 -14.090 1.402 -5.660 1.00 0.67 H new ATOM 0 HD12 ILE A 142 -12.534 1.729 -6.459 1.00 0.67 H new ATOM 0 HD13 ILE A 142 -13.864 2.905 -6.585 1.00 0.67 H new ATOM 2191 N LYS A 143 -16.321 2.501 -9.662 1.00 0.53 N ATOM 2192 CA LYS A 143 -17.761 2.633 -9.470 1.00 0.57 C ATOM 2193 C LYS A 143 -18.200 2.237 -8.055 1.00 0.54 C ATOM 2194 O LYS A 143 -17.412 1.704 -7.273 1.00 0.57 O ATOM 2195 CB LYS A 143 -18.520 1.805 -10.514 1.00 0.70 C ATOM 2196 CG LYS A 143 -18.503 2.405 -11.916 1.00 1.44 C ATOM 2197 CD LYS A 143 -17.127 2.347 -12.567 1.00 2.04 C ATOM 2198 CE LYS A 143 -16.731 0.925 -12.930 1.00 2.74 C ATOM 2199 NZ LYS A 143 -17.660 0.327 -13.923 1.00 3.53 N ATOM 0 H LYS A 143 -16.047 1.753 -10.299 1.00 0.53 H new ATOM 0 HA LYS A 143 -18.005 3.687 -9.601 1.00 0.57 H new ATOM 0 HB2 LYS A 143 -18.088 0.805 -10.553 1.00 0.70 H new ATOM 0 HB3 LYS A 143 -19.555 1.693 -10.191 1.00 0.70 H new ATOM 0 HG2 LYS A 143 -19.219 1.873 -12.543 1.00 1.44 H new ATOM 0 HG3 LYS A 143 -18.833 3.443 -11.866 1.00 1.44 H new ATOM 0 HD2 LYS A 143 -17.124 2.965 -13.465 1.00 2.04 H new ATOM 0 HD3 LYS A 143 -16.386 2.768 -11.888 1.00 2.04 H new ATOM 0 HE2 LYS A 143 -15.718 0.922 -13.333 1.00 2.74 H new ATOM 0 HE3 LYS A 143 -16.718 0.311 -12.030 1.00 2.74 H new ATOM 0 HZ1 LYS A 143 -17.214 -0.506 -14.357 1.00 3.53 H new ATOM 0 HZ2 LYS A 143 -18.539 0.041 -13.447 1.00 3.53 H new ATOM 0 HZ3 LYS A 143 -17.877 1.027 -14.661 1.00 3.53 H new ATOM 2213 N LEU A 144 -19.473 2.499 -7.761 1.00 0.60 N ATOM 2214 CA LEU A 144 -20.065 2.263 -6.440 1.00 0.66 C ATOM 2215 C LEU A 144 -19.889 0.794 -6.022 1.00 0.60 C ATOM 2216 O LEU A 144 -20.207 -0.115 -6.790 1.00 0.63 O ATOM 2217 CB LEU A 144 -21.559 2.655 -6.504 1.00 0.83 C ATOM 2218 CG LEU A 144 -22.258 3.055 -5.187 1.00 0.69 C ATOM 2219 CD1 LEU A 144 -22.433 1.869 -4.271 1.00 1.21 C ATOM 2220 CD2 LEU A 144 -21.512 4.171 -4.468 1.00 1.23 C ATOM 0 H LEU A 144 -20.131 2.885 -8.438 1.00 0.60 H new ATOM 0 HA LEU A 144 -19.562 2.870 -5.688 1.00 0.66 H new ATOM 0 HB2 LEU A 144 -21.657 3.488 -7.201 1.00 0.83 H new ATOM 0 HB3 LEU A 144 -22.107 1.815 -6.932 1.00 0.83 H new ATOM 0 HG LEU A 144 -23.246 3.428 -5.457 1.00 0.69 H new ATOM 0 HD11 LEU A 144 -22.928 2.188 -3.354 1.00 1.21 H new ATOM 0 HD12 LEU A 144 -23.041 1.112 -4.767 1.00 1.21 H new ATOM 0 HD13 LEU A 144 -21.457 1.449 -4.029 1.00 1.21 H new ATOM 0 HD21 LEU A 144 -22.036 4.424 -3.546 1.00 1.23 H new ATOM 0 HD22 LEU A 144 -20.501 3.839 -4.232 1.00 1.23 H new ATOM 0 HD23 LEU A 144 -21.465 5.050 -5.111 1.00 1.23 H new ATOM 2232 N PRO A 145 -19.361 0.554 -4.802 1.00 0.61 N ATOM 2233 CA PRO A 145 -19.084 -0.799 -4.286 1.00 0.64 C ATOM 2234 C PRO A 145 -20.340 -1.651 -4.113 1.00 0.66 C ATOM 2235 O PRO A 145 -21.455 -1.176 -4.304 1.00 0.65 O ATOM 2236 CB PRO A 145 -18.432 -0.543 -2.920 1.00 0.71 C ATOM 2237 CG PRO A 145 -18.865 0.827 -2.537 1.00 0.69 C ATOM 2238 CD PRO A 145 -18.987 1.589 -3.824 1.00 0.67 C ATOM 0 HA PRO A 145 -18.460 -1.360 -4.982 1.00 0.64 H new ATOM 0 HB2 PRO A 145 -18.756 -1.279 -2.184 1.00 0.71 H new ATOM 0 HB3 PRO A 145 -17.346 -0.611 -2.982 1.00 0.71 H new ATOM 0 HG2 PRO A 145 -19.816 0.803 -2.005 1.00 0.69 H new ATOM 0 HG3 PRO A 145 -18.139 1.295 -1.872 1.00 0.69 H new ATOM 0 HD2 PRO A 145 -19.744 2.371 -3.757 1.00 0.67 H new ATOM 0 HD3 PRO A 145 -18.049 2.075 -4.093 1.00 0.67 H new