USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=32 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 159:sc= 2.33 USER MOD Set 1.2: A 133 THR OG1 : rot -73:sc= 1.22 USER MOD Set 2.1: A 119 GLN : amide:sc= -4.53! K(o=-4.5!,f=1.3) USER MOD Set 2.2: A 137 SER OG : rot 178:sc= 0.0569 USER MOD Set 3.1: A 48 THR OG1 : rot 97:sc= -0.197 USER MOD Set 3.2: A 87 MET CE :methyl 174:sc= -0.837 (180deg=-0.457) USER MOD Single : A 25 SER OG : rot 51:sc= -1.34! USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -171:sc= 0.582 (180deg=0.394) USER MOD Single : A 38 SER OG : rot 180:sc= -0.0762 USER MOD Single : A 41 TYR OH : rot 54:sc= 0.258 USER MOD Single : A 44 LYS NZ :NH3+ -131:sc= 1.18 (180deg=-0.168!) USER MOD Single : A 46 SER OG : rot 180:sc= -0.322 USER MOD Single : A 49 ASN : amide:sc= -1.34 K(o=-1.3,f=-8.2!) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0.00872 USER MOD Single : A 53 HIS : no HE2:sc= 0.669 K(o=0.67,f=-2.4!) USER MOD Single : A 54 SER OG : rot -50:sc= 1.18 USER MOD Single : A 58 CYS SG : rot -158:sc= -8.47! USER MOD Single : A 61 SER OG : rot -140:sc= -1.26 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HE2:sc= -3.27! K(o=-3.3!,f=-1.2) USER MOD Single : A 66 SER OG : rot 11:sc= -0.539! USER MOD Single : A 73 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0374) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 55:sc= 1.09 USER MOD Single : A 83 LYS NZ :NH3+ -162:sc= -0.086 (180deg=-0.532) USER MOD Single : A 85 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.207) 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= 0.384 K(o=0.38,f=-0.76) USER MOD Single : A 116 TYR OH : rot 30:sc= -0.242 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ -128:sc= 0.871 (180deg=-1.39!) USER MOD Single : A 143 LYS NZ :NH3+ -170:sc= -0.0162 (180deg=-0.174) USER MOD ----------------------------------------------------------------- ATOM 364 N GLY A 24 8.705 0.003 -4.901 1.00 0.54 N ATOM 365 CA GLY A 24 7.273 -0.086 -4.693 1.00 0.46 C ATOM 366 C GLY A 24 6.795 -1.225 -3.835 1.00 0.33 C ATOM 367 O GLY A 24 7.578 -1.986 -3.276 1.00 0.39 O ATOM 0 HA2 GLY A 24 6.934 0.847 -4.243 1.00 0.46 H new ATOM 0 HA3 GLY A 24 6.790 -0.165 -5.667 1.00 0.46 H new ATOM 371 N SER A 25 5.476 -1.280 -3.732 1.00 0.28 N ATOM 372 CA SER A 25 4.724 -2.325 -3.059 1.00 0.30 C ATOM 373 C SER A 25 3.258 -2.124 -3.413 1.00 0.32 C ATOM 374 O SER A 25 2.351 -2.376 -2.625 1.00 0.39 O ATOM 375 CB SER A 25 4.899 -2.269 -1.548 1.00 0.37 C ATOM 376 OG SER A 25 6.170 -2.750 -1.148 1.00 1.20 O ATOM 0 H SER A 25 4.873 -0.563 -4.135 1.00 0.28 H new ATOM 0 HA SER A 25 5.087 -3.300 -3.385 1.00 0.30 H new ATOM 0 HB2 SER A 25 4.775 -1.242 -1.205 1.00 0.37 H new ATOM 0 HB3 SER A 25 4.119 -2.861 -1.069 1.00 0.37 H new ATOM 0 HG SER A 25 6.868 -2.300 -1.668 1.00 1.20 H new ATOM 382 N VAL A 26 3.053 -1.645 -4.619 1.00 0.28 N ATOM 383 CA VAL A 26 1.735 -1.284 -5.107 1.00 0.30 C ATOM 384 C VAL A 26 1.553 -1.847 -6.508 1.00 0.30 C ATOM 385 O VAL A 26 2.542 -2.129 -7.181 1.00 0.30 O ATOM 386 CB VAL A 26 1.562 0.257 -5.135 1.00 0.33 C ATOM 387 CG1 VAL A 26 1.663 0.841 -3.739 1.00 0.93 C ATOM 388 CG2 VAL A 26 2.604 0.874 -6.047 1.00 0.88 C ATOM 0 H VAL A 26 3.800 -1.493 -5.297 1.00 0.28 H new ATOM 0 HA VAL A 26 0.983 -1.700 -4.437 1.00 0.30 H new ATOM 0 HB VAL A 26 0.569 0.488 -5.521 1.00 0.33 H new ATOM 0 HG11 VAL A 26 1.538 1.923 -3.787 1.00 0.93 H new ATOM 0 HG12 VAL A 26 0.883 0.414 -3.108 1.00 0.93 H new ATOM 0 HG13 VAL A 26 2.640 0.607 -3.317 1.00 0.93 H new ATOM 0 HG21 VAL A 26 2.478 1.957 -6.063 1.00 0.88 H new ATOM 0 HG22 VAL A 26 3.600 0.630 -5.678 1.00 0.88 H new ATOM 0 HG23 VAL A 26 2.484 0.480 -7.056 1.00 0.88 H new ATOM 398 N THR A 27 0.313 -2.073 -6.914 1.00 0.33 N ATOM 399 CA THR A 27 0.003 -2.374 -8.308 1.00 0.36 C ATOM 400 C THR A 27 -1.508 -2.474 -8.557 1.00 0.38 C ATOM 401 O THR A 27 -2.007 -1.910 -9.529 1.00 0.48 O ATOM 402 CB THR A 27 0.712 -3.658 -8.806 1.00 0.39 C ATOM 403 OG1 THR A 27 0.227 -4.033 -10.103 1.00 0.47 O ATOM 404 CG2 THR A 27 0.533 -4.809 -7.830 1.00 0.39 C ATOM 0 H THR A 27 -0.499 -2.054 -6.297 1.00 0.33 H new ATOM 0 HA THR A 27 0.388 -1.533 -8.885 1.00 0.36 H new ATOM 0 HB THR A 27 1.777 -3.437 -8.876 1.00 0.39 H new ATOM 0 HG1 THR A 27 0.687 -4.845 -10.402 1.00 0.47 H new ATOM 0 HG21 THR A 27 1.044 -5.693 -8.212 1.00 0.39 H new ATOM 0 HG22 THR A 27 0.956 -4.535 -6.863 1.00 0.39 H new ATOM 0 HG23 THR A 27 -0.529 -5.025 -7.713 1.00 0.39 H new ATOM 412 N ASP A 28 -2.236 -3.172 -7.686 1.00 0.35 N ATOM 413 CA ASP A 28 -3.674 -3.368 -7.887 1.00 0.42 C ATOM 414 C ASP A 28 -4.375 -3.565 -6.553 1.00 0.35 C ATOM 415 O ASP A 28 -3.763 -4.012 -5.587 1.00 0.37 O ATOM 416 CB ASP A 28 -3.920 -4.600 -8.765 1.00 0.57 C ATOM 417 CG ASP A 28 -5.309 -4.640 -9.382 1.00 1.08 C ATOM 418 OD1 ASP A 28 -6.237 -5.171 -8.741 1.00 1.44 O ATOM 419 OD2 ASP A 28 -5.471 -4.164 -10.529 1.00 1.69 O ATOM 0 H ASP A 28 -1.861 -3.607 -6.843 1.00 0.35 H new ATOM 0 HA ASP A 28 -4.073 -2.480 -8.378 1.00 0.42 H new ATOM 0 HB2 ASP A 28 -3.177 -4.622 -9.562 1.00 0.57 H new ATOM 0 HB3 ASP A 28 -3.772 -5.498 -8.166 1.00 0.57 H new ATOM 424 N VAL A 29 -5.652 -3.228 -6.498 1.00 0.39 N ATOM 425 CA VAL A 29 -6.454 -3.455 -5.307 1.00 0.41 C ATOM 426 C VAL A 29 -7.856 -3.902 -5.706 1.00 0.37 C ATOM 427 O VAL A 29 -8.555 -3.209 -6.446 1.00 0.42 O ATOM 428 CB VAL A 29 -6.542 -2.205 -4.404 1.00 0.60 C ATOM 429 CG1 VAL A 29 -7.440 -2.480 -3.213 1.00 1.13 C ATOM 430 CG2 VAL A 29 -5.165 -1.778 -3.921 1.00 1.14 C ATOM 0 H VAL A 29 -6.159 -2.793 -7.269 1.00 0.39 H new ATOM 0 HA VAL A 29 -5.960 -4.237 -4.730 1.00 0.41 H new ATOM 0 HB VAL A 29 -6.965 -1.394 -4.996 1.00 0.60 H new ATOM 0 HG11 VAL A 29 -7.493 -1.591 -2.585 1.00 1.13 H new ATOM 0 HG12 VAL A 29 -8.440 -2.738 -3.563 1.00 1.13 H new ATOM 0 HG13 VAL A 29 -7.033 -3.309 -2.634 1.00 1.13 H new ATOM 0 HG21 VAL A 29 -5.259 -0.896 -3.288 1.00 1.14 H new ATOM 0 HG22 VAL A 29 -4.712 -2.588 -3.350 1.00 1.14 H new ATOM 0 HG23 VAL A 29 -4.535 -1.543 -4.779 1.00 1.14 H new ATOM 440 N ASP A 30 -8.252 -5.060 -5.210 1.00 0.37 N ATOM 441 CA ASP A 30 -9.499 -5.691 -5.611 1.00 0.38 C ATOM 442 C ASP A 30 -10.486 -5.746 -4.444 1.00 0.42 C ATOM 443 O ASP A 30 -10.292 -6.495 -3.489 1.00 0.54 O ATOM 444 CB ASP A 30 -9.188 -7.098 -6.121 1.00 0.51 C ATOM 445 CG ASP A 30 -10.388 -7.805 -6.711 1.00 1.00 C ATOM 446 OD1 ASP A 30 -10.841 -7.397 -7.797 1.00 1.16 O ATOM 447 OD2 ASP A 30 -10.853 -8.796 -6.115 1.00 1.83 O ATOM 0 H ASP A 30 -7.720 -5.590 -4.519 1.00 0.37 H new ATOM 0 HA ASP A 30 -9.966 -5.105 -6.402 1.00 0.38 H new ATOM 0 HB2 ASP A 30 -8.405 -7.037 -6.876 1.00 0.51 H new ATOM 0 HB3 ASP A 30 -8.793 -7.695 -5.299 1.00 0.51 H new ATOM 452 N LEU A 31 -11.531 -4.937 -4.520 1.00 0.47 N ATOM 453 CA LEU A 31 -12.527 -4.846 -3.454 1.00 0.57 C ATOM 454 C LEU A 31 -13.561 -5.966 -3.590 1.00 0.58 C ATOM 455 O LEU A 31 -13.973 -6.304 -4.699 1.00 0.67 O ATOM 456 CB LEU A 31 -13.198 -3.461 -3.501 1.00 0.71 C ATOM 457 CG LEU A 31 -14.089 -3.086 -2.306 1.00 0.85 C ATOM 458 CD1 LEU A 31 -15.428 -3.806 -2.362 1.00 0.94 C ATOM 459 CD2 LEU A 31 -13.382 -3.395 -0.996 1.00 0.86 C ATOM 0 H LEU A 31 -11.716 -4.326 -5.316 1.00 0.47 H new ATOM 0 HA LEU A 31 -12.037 -4.966 -2.488 1.00 0.57 H new ATOM 0 HB2 LEU A 31 -12.416 -2.707 -3.593 1.00 0.71 H new ATOM 0 HB3 LEU A 31 -13.802 -3.406 -4.407 1.00 0.71 H new ATOM 0 HG LEU A 31 -14.281 -2.014 -2.361 1.00 0.85 H new ATOM 0 HD11 LEU A 31 -16.032 -3.518 -1.502 1.00 0.94 H new ATOM 0 HD12 LEU A 31 -15.949 -3.534 -3.280 1.00 0.94 H new ATOM 0 HD13 LEU A 31 -15.263 -4.883 -2.344 1.00 0.94 H new ATOM 0 HD21 LEU A 31 -14.028 -3.123 -0.161 1.00 0.86 H new ATOM 0 HD22 LEU A 31 -13.155 -4.460 -0.947 1.00 0.86 H new ATOM 0 HD23 LEU A 31 -12.455 -2.824 -0.939 1.00 0.86 H new ATOM 471 N LYS A 32 -13.973 -6.551 -2.460 1.00 0.56 N ATOM 472 CA LYS A 32 -14.946 -7.636 -2.485 1.00 0.60 C ATOM 473 C LYS A 32 -15.997 -7.542 -1.379 1.00 0.82 C ATOM 474 O LYS A 32 -16.967 -6.810 -1.488 1.00 1.33 O ATOM 475 CB LYS A 32 -14.232 -8.984 -2.410 1.00 0.62 C ATOM 476 CG LYS A 32 -13.145 -9.057 -1.350 1.00 0.65 C ATOM 477 CD LYS A 32 -11.957 -9.851 -1.849 1.00 0.90 C ATOM 478 CE LYS A 32 -11.462 -9.315 -3.180 1.00 1.10 C ATOM 479 NZ LYS A 32 -10.750 -10.346 -3.979 1.00 1.32 N ATOM 0 H LYS A 32 -13.649 -6.291 -1.528 1.00 0.56 H new ATOM 0 HA LYS A 32 -15.481 -7.544 -3.430 1.00 0.60 H new ATOM 0 HB2 LYS A 32 -14.969 -9.762 -2.212 1.00 0.62 H new ATOM 0 HB3 LYS A 32 -13.791 -9.203 -3.382 1.00 0.62 H new ATOM 0 HG2 LYS A 32 -12.827 -8.050 -1.080 1.00 0.65 H new ATOM 0 HG3 LYS A 32 -13.543 -9.519 -0.447 1.00 0.65 H new ATOM 0 HD2 LYS A 32 -11.153 -9.808 -1.114 1.00 0.90 H new ATOM 0 HD3 LYS A 32 -12.235 -10.899 -1.956 1.00 0.90 H new ATOM 0 HE2 LYS A 32 -12.308 -8.936 -3.753 1.00 1.10 H new ATOM 0 HE3 LYS A 32 -10.794 -8.472 -3.003 1.00 1.10 H new ATOM 0 HZ1 LYS A 32 -10.301 -9.898 -4.803 1.00 1.32 H new ATOM 0 HZ2 LYS A 32 -10.021 -10.798 -3.391 1.00 1.32 H new ATOM 0 HZ3 LYS A 32 -11.429 -11.065 -4.302 1.00 1.32 H new ATOM 493 N ASP A 33 -15.730 -8.164 -0.259 1.00 0.60 N ATOM 494 CA ASP A 33 -16.797 -8.649 0.610 1.00 0.94 C ATOM 495 C ASP A 33 -17.194 -7.627 1.635 1.00 0.53 C ATOM 496 O ASP A 33 -16.726 -6.516 1.584 1.00 1.46 O ATOM 497 CB ASP A 33 -16.334 -9.887 1.341 1.00 2.08 C ATOM 498 CG ASP A 33 -17.454 -10.884 1.563 1.00 2.37 C ATOM 499 OD1 ASP A 33 -18.133 -10.795 2.606 1.00 2.32 O ATOM 500 OD2 ASP A 33 -17.653 -11.765 0.700 1.00 2.85 O ATOM 0 H ASP A 33 -14.787 -8.351 0.081 1.00 0.60 H new ATOM 0 HA ASP A 33 -17.656 -8.864 -0.025 1.00 0.94 H new ATOM 0 HB2 ASP A 33 -15.536 -10.363 0.772 1.00 2.08 H new ATOM 0 HB3 ASP A 33 -15.912 -9.600 2.304 1.00 2.08 H new ATOM 571 N SER A 38 -18.168 -5.856 7.737 1.00 0.54 N ATOM 572 CA SER A 38 -16.887 -5.377 7.234 1.00 0.48 C ATOM 573 C SER A 38 -16.651 -5.737 5.768 1.00 0.50 C ATOM 574 O SER A 38 -16.692 -6.912 5.376 1.00 0.94 O ATOM 575 CB SER A 38 -15.776 -5.970 8.080 1.00 0.55 C ATOM 576 OG SER A 38 -14.564 -5.247 7.939 1.00 0.76 O ATOM 0 HA SER A 38 -16.896 -4.289 7.299 1.00 0.48 H new ATOM 0 HB2 SER A 38 -16.078 -5.972 9.127 1.00 0.55 H new ATOM 0 HB3 SER A 38 -15.615 -7.009 7.792 1.00 0.55 H new ATOM 0 HG SER A 38 -13.872 -5.656 8.499 1.00 0.76 H new ATOM 582 N VAL A 39 -16.367 -4.714 4.973 1.00 0.33 N ATOM 583 CA VAL A 39 -16.032 -4.897 3.573 1.00 0.35 C ATOM 584 C VAL A 39 -14.600 -5.422 3.458 1.00 0.31 C ATOM 585 O VAL A 39 -13.767 -5.134 4.318 1.00 0.34 O ATOM 586 CB VAL A 39 -16.195 -3.575 2.780 1.00 0.43 C ATOM 587 CG1 VAL A 39 -15.876 -3.764 1.307 1.00 0.86 C ATOM 588 CG2 VAL A 39 -17.606 -3.040 2.942 1.00 0.86 C ATOM 0 H VAL A 39 -16.363 -3.741 5.281 1.00 0.33 H new ATOM 0 HA VAL A 39 -16.719 -5.624 3.140 1.00 0.35 H new ATOM 0 HB VAL A 39 -15.486 -2.854 3.186 1.00 0.43 H new ATOM 0 HG11 VAL A 39 -16.001 -2.816 0.783 1.00 0.86 H new ATOM 0 HG12 VAL A 39 -14.847 -4.105 1.199 1.00 0.86 H new ATOM 0 HG13 VAL A 39 -16.551 -4.506 0.881 1.00 0.86 H new ATOM 0 HG21 VAL A 39 -17.710 -2.111 2.381 1.00 0.86 H new ATOM 0 HG22 VAL A 39 -18.319 -3.773 2.565 1.00 0.86 H new ATOM 0 HG23 VAL A 39 -17.804 -2.851 3.997 1.00 0.86 H new ATOM 598 N GLU A 40 -14.295 -6.220 2.440 1.00 0.33 N ATOM 599 CA GLU A 40 -12.962 -6.789 2.358 1.00 0.36 C ATOM 600 C GLU A 40 -12.301 -6.448 1.039 1.00 0.38 C ATOM 601 O GLU A 40 -12.968 -6.389 0.013 1.00 0.50 O ATOM 602 CB GLU A 40 -13.033 -8.299 2.570 1.00 0.52 C ATOM 603 CG GLU A 40 -13.314 -8.673 4.016 1.00 0.62 C ATOM 604 CD GLU A 40 -13.334 -10.170 4.257 1.00 0.89 C ATOM 605 OE1 GLU A 40 -13.999 -10.893 3.481 1.00 1.16 O ATOM 606 OE2 GLU A 40 -12.689 -10.632 5.219 1.00 1.19 O ATOM 0 H GLU A 40 -14.931 -6.479 1.686 1.00 0.33 H new ATOM 0 HA GLU A 40 -12.346 -6.355 3.146 1.00 0.36 H new ATOM 0 HB2 GLU A 40 -13.813 -8.715 1.933 1.00 0.52 H new ATOM 0 HB3 GLU A 40 -12.091 -8.751 2.258 1.00 0.52 H new ATOM 0 HG2 GLU A 40 -12.556 -8.220 4.655 1.00 0.62 H new ATOM 0 HG3 GLU A 40 -14.275 -8.252 4.313 1.00 0.62 H new ATOM 613 N TYR A 41 -10.993 -6.193 1.058 1.00 0.37 N ATOM 614 CA TYR A 41 -10.294 -5.918 -0.210 1.00 0.56 C ATOM 615 C TYR A 41 -8.994 -6.693 -0.333 1.00 0.43 C ATOM 616 O TYR A 41 -8.165 -6.683 0.565 1.00 0.40 O ATOM 617 CB TYR A 41 -10.001 -4.424 -0.409 1.00 0.89 C ATOM 618 CG TYR A 41 -8.779 -3.924 0.329 1.00 0.86 C ATOM 619 CD1 TYR A 41 -7.527 -3.979 -0.243 1.00 1.65 C ATOM 620 CD2 TYR A 41 -8.894 -3.364 1.595 1.00 1.30 C ATOM 621 CE1 TYR A 41 -6.425 -3.485 0.420 1.00 2.63 C ATOM 622 CE2 TYR A 41 -7.792 -2.873 2.261 1.00 2.04 C ATOM 623 CZ TYR A 41 -6.519 -3.079 1.696 1.00 2.72 C ATOM 624 OH TYR A 41 -5.459 -2.422 2.311 1.00 3.73 O ATOM 0 H TYR A 41 -10.411 -6.169 1.895 1.00 0.37 H new ATOM 0 HA TYR A 41 -10.981 -6.249 -0.989 1.00 0.56 H new ATOM 0 HB2 TYR A 41 -9.872 -4.230 -1.474 1.00 0.89 H new ATOM 0 HB3 TYR A 41 -10.868 -3.849 -0.083 1.00 0.89 H new ATOM 0 HD1 TYR A 41 -7.408 -4.415 -1.224 1.00 1.65 H new ATOM 0 HD2 TYR A 41 -9.865 -3.312 2.066 1.00 1.30 H new ATOM 0 HE1 TYR A 41 -5.476 -3.424 -0.092 1.00 2.63 H new ATOM 0 HE2 TYR A 41 -7.902 -2.342 3.195 1.00 2.04 H new ATOM 0 HH TYR A 41 -5.194 -1.650 1.769 1.00 3.73 H new ATOM 634 N LEU A 42 -8.807 -7.329 -1.467 1.00 0.41 N ATOM 635 CA LEU A 42 -7.583 -8.055 -1.727 1.00 0.38 C ATOM 636 C LEU A 42 -6.631 -7.131 -2.468 1.00 0.34 C ATOM 637 O LEU A 42 -6.883 -6.761 -3.614 1.00 0.38 O ATOM 638 CB LEU A 42 -7.871 -9.310 -2.561 1.00 0.49 C ATOM 639 CG LEU A 42 -6.864 -10.461 -2.417 1.00 0.55 C ATOM 640 CD1 LEU A 42 -5.445 -9.997 -2.701 1.00 0.71 C ATOM 641 CD2 LEU A 42 -6.958 -11.082 -1.032 1.00 0.81 C ATOM 0 H LEU A 42 -9.488 -7.359 -2.226 1.00 0.41 H new ATOM 0 HA LEU A 42 -7.134 -8.377 -0.788 1.00 0.38 H new ATOM 0 HB2 LEU A 42 -8.859 -9.682 -2.291 1.00 0.49 H new ATOM 0 HB3 LEU A 42 -7.915 -9.022 -3.611 1.00 0.49 H new ATOM 0 HG LEU A 42 -7.118 -11.220 -3.157 1.00 0.55 H new ATOM 0 HD11 LEU A 42 -4.759 -10.836 -2.590 1.00 0.71 H new ATOM 0 HD12 LEU A 42 -5.385 -9.611 -3.719 1.00 0.71 H new ATOM 0 HD13 LEU A 42 -5.172 -9.210 -1.998 1.00 0.71 H new ATOM 0 HD21 LEU A 42 -6.237 -11.896 -0.948 1.00 0.81 H new ATOM 0 HD22 LEU A 42 -6.740 -10.325 -0.278 1.00 0.81 H new ATOM 0 HD23 LEU A 42 -7.964 -11.471 -0.875 1.00 0.81 H new ATOM 653 N ALA A 43 -5.549 -6.742 -1.823 1.00 0.33 N ATOM 654 CA ALA A 43 -4.614 -5.828 -2.452 1.00 0.36 C ATOM 655 C ALA A 43 -3.463 -6.583 -3.071 1.00 0.35 C ATOM 656 O ALA A 43 -2.716 -7.282 -2.383 1.00 0.37 O ATOM 657 CB ALA A 43 -4.092 -4.791 -1.475 1.00 0.42 C ATOM 0 H ALA A 43 -5.297 -7.038 -0.880 1.00 0.33 H new ATOM 0 HA ALA A 43 -5.158 -5.302 -3.237 1.00 0.36 H new ATOM 0 HB1 ALA A 43 -3.395 -4.127 -1.987 1.00 0.42 H new ATOM 0 HB2 ALA A 43 -4.926 -4.209 -1.082 1.00 0.42 H new ATOM 0 HB3 ALA A 43 -3.579 -5.291 -0.653 1.00 0.42 H new ATOM 663 N LYS A 44 -3.332 -6.449 -4.373 1.00 0.38 N ATOM 664 CA LYS A 44 -2.198 -7.005 -5.063 1.00 0.39 C ATOM 665 C LYS A 44 -1.051 -6.015 -4.980 1.00 0.36 C ATOM 666 O LYS A 44 -1.141 -4.883 -5.455 1.00 0.47 O ATOM 667 CB LYS A 44 -2.538 -7.341 -6.517 1.00 0.53 C ATOM 668 CG LYS A 44 -1.372 -7.949 -7.292 1.00 0.95 C ATOM 669 CD LYS A 44 -0.854 -9.227 -6.640 1.00 1.58 C ATOM 670 CE LYS A 44 -1.867 -10.358 -6.724 1.00 1.61 C ATOM 671 NZ LYS A 44 -1.384 -11.587 -6.038 1.00 2.63 N ATOM 0 H LYS A 44 -3.998 -5.960 -4.971 1.00 0.38 H new ATOM 0 HA LYS A 44 -1.907 -7.942 -4.588 1.00 0.39 H new ATOM 0 HB2 LYS A 44 -3.377 -8.037 -6.534 1.00 0.53 H new ATOM 0 HB3 LYS A 44 -2.866 -6.434 -7.024 1.00 0.53 H new ATOM 0 HG2 LYS A 44 -1.689 -8.166 -8.312 1.00 0.95 H new ATOM 0 HG3 LYS A 44 -0.562 -7.222 -7.357 1.00 0.95 H new ATOM 0 HD2 LYS A 44 0.072 -9.533 -7.126 1.00 1.58 H new ATOM 0 HD3 LYS A 44 -0.616 -9.030 -5.595 1.00 1.58 H new ATOM 0 HE2 LYS A 44 -2.807 -10.037 -6.275 1.00 1.61 H new ATOM 0 HE3 LYS A 44 -2.074 -10.583 -7.770 1.00 1.61 H new ATOM 0 HZ1 LYS A 44 -1.507 -12.406 -6.666 1.00 2.63 H new ATOM 0 HZ2 LYS A 44 -0.377 -11.480 -5.802 1.00 2.63 H new ATOM 0 HZ3 LYS A 44 -1.930 -11.735 -5.165 1.00 2.63 H new ATOM 685 N VAL A 45 0.003 -6.439 -4.333 1.00 0.31 N ATOM 686 CA VAL A 45 1.167 -5.610 -4.118 1.00 0.33 C ATOM 687 C VAL A 45 2.256 -5.974 -5.103 1.00 0.28 C ATOM 688 O VAL A 45 2.373 -7.124 -5.513 1.00 0.30 O ATOM 689 CB VAL A 45 1.687 -5.811 -2.680 1.00 0.44 C ATOM 690 CG1 VAL A 45 3.086 -5.255 -2.495 1.00 0.82 C ATOM 691 CG2 VAL A 45 0.729 -5.182 -1.686 1.00 0.51 C ATOM 0 H VAL A 45 0.081 -7.375 -3.936 1.00 0.31 H new ATOM 0 HA VAL A 45 0.889 -4.566 -4.264 1.00 0.33 H new ATOM 0 HB VAL A 45 1.742 -6.884 -2.497 1.00 0.44 H new ATOM 0 HG11 VAL A 45 3.410 -5.419 -1.467 1.00 0.82 H new ATOM 0 HG12 VAL A 45 3.771 -5.759 -3.177 1.00 0.82 H new ATOM 0 HG13 VAL A 45 3.084 -4.186 -2.708 1.00 0.82 H new ATOM 0 HG21 VAL A 45 1.106 -5.330 -0.674 1.00 0.51 H new ATOM 0 HG22 VAL A 45 0.643 -4.115 -1.889 1.00 0.51 H new ATOM 0 HG23 VAL A 45 -0.251 -5.649 -1.780 1.00 0.51 H new ATOM 701 N SER A 46 3.010 -4.990 -5.529 1.00 0.25 N ATOM 702 CA SER A 46 4.212 -5.255 -6.265 1.00 0.25 C ATOM 703 C SER A 46 5.375 -4.492 -5.655 1.00 0.24 C ATOM 704 O SER A 46 5.527 -3.288 -5.862 1.00 0.26 O ATOM 705 CB SER A 46 4.006 -4.921 -7.734 1.00 0.28 C ATOM 706 OG SER A 46 3.396 -6.003 -8.418 1.00 0.72 O ATOM 0 H SER A 46 2.809 -4.002 -5.377 1.00 0.25 H new ATOM 0 HA SER A 46 4.455 -6.316 -6.205 1.00 0.25 H new ATOM 0 HB2 SER A 46 3.384 -4.031 -7.825 1.00 0.28 H new ATOM 0 HB3 SER A 46 4.965 -4.688 -8.196 1.00 0.28 H new ATOM 0 HG SER A 46 3.271 -5.766 -9.361 1.00 0.72 H new ATOM 712 N VAL A 47 6.165 -5.213 -4.869 1.00 0.25 N ATOM 713 CA VAL A 47 7.291 -4.643 -4.153 1.00 0.28 C ATOM 714 C VAL A 47 8.502 -4.561 -5.064 1.00 0.28 C ATOM 715 O VAL A 47 8.953 -5.571 -5.609 1.00 0.30 O ATOM 716 CB VAL A 47 7.677 -5.477 -2.905 1.00 0.41 C ATOM 717 CG1 VAL A 47 8.789 -4.784 -2.127 1.00 1.14 C ATOM 718 CG2 VAL A 47 6.471 -5.731 -2.007 1.00 1.05 C ATOM 0 H VAL A 47 6.039 -6.213 -4.712 1.00 0.25 H new ATOM 0 HA VAL A 47 6.984 -3.650 -3.826 1.00 0.28 H new ATOM 0 HB VAL A 47 8.040 -6.445 -3.250 1.00 0.41 H new ATOM 0 HG11 VAL A 47 9.049 -5.382 -1.253 1.00 1.14 H new ATOM 0 HG12 VAL A 47 9.666 -4.674 -2.765 1.00 1.14 H new ATOM 0 HG13 VAL A 47 8.449 -3.800 -1.805 1.00 1.14 H new ATOM 0 HG21 VAL A 47 6.779 -6.318 -1.142 1.00 1.05 H new ATOM 0 HG22 VAL A 47 6.060 -4.779 -1.671 1.00 1.05 H new ATOM 0 HG23 VAL A 47 5.711 -6.278 -2.565 1.00 1.05 H new ATOM 728 N THR A 48 9.016 -3.361 -5.242 1.00 0.30 N ATOM 729 CA THR A 48 10.203 -3.172 -6.037 1.00 0.31 C ATOM 730 C THR A 48 11.391 -2.968 -5.117 1.00 0.34 C ATOM 731 O THR A 48 11.451 -1.970 -4.409 1.00 0.37 O ATOM 732 CB THR A 48 10.067 -1.970 -6.983 1.00 0.36 C ATOM 733 OG1 THR A 48 8.811 -2.037 -7.669 1.00 0.41 O ATOM 734 CG2 THR A 48 11.207 -1.951 -7.994 1.00 0.41 C ATOM 0 H THR A 48 8.628 -2.505 -4.845 1.00 0.30 H new ATOM 0 HA THR A 48 10.349 -4.061 -6.650 1.00 0.31 H new ATOM 0 HB THR A 48 10.112 -1.054 -6.393 1.00 0.36 H new ATOM 0 HG1 THR A 48 8.154 -1.478 -7.204 1.00 0.41 H new ATOM 0 HG21 THR A 48 11.093 -1.092 -8.655 1.00 0.41 H new ATOM 0 HG22 THR A 48 12.159 -1.880 -7.468 1.00 0.41 H new ATOM 0 HG23 THR A 48 11.186 -2.868 -8.583 1.00 0.41 H new ATOM 742 N ASN A 49 12.302 -3.937 -5.133 1.00 0.38 N ATOM 743 CA ASN A 49 13.511 -3.928 -4.304 1.00 0.44 C ATOM 744 C ASN A 49 14.640 -3.204 -5.036 1.00 0.42 C ATOM 745 O ASN A 49 14.910 -3.508 -6.189 1.00 0.46 O ATOM 746 CB ASN A 49 13.899 -5.384 -4.018 1.00 0.59 C ATOM 747 CG ASN A 49 15.319 -5.582 -3.516 1.00 0.73 C ATOM 748 OD1 ASN A 49 15.898 -4.731 -2.849 1.00 1.48 O ATOM 749 ND2 ASN A 49 15.884 -6.733 -3.844 1.00 0.76 N ATOM 0 H ASN A 49 12.224 -4.762 -5.728 1.00 0.38 H new ATOM 0 HA ASN A 49 13.328 -3.402 -3.367 1.00 0.44 H new ATOM 0 HB2 ASN A 49 13.208 -5.790 -3.279 1.00 0.59 H new ATOM 0 HB3 ASN A 49 13.768 -5.965 -4.931 1.00 0.59 H new ATOM 0 HD21 ASN A 49 16.836 -6.939 -3.540 1.00 0.76 H new ATOM 0 HD22 ASN A 49 15.368 -7.414 -4.400 1.00 0.76 H new ATOM 756 N PRO A 50 15.297 -2.226 -4.378 1.00 0.46 N ATOM 757 CA PRO A 50 16.349 -1.400 -4.991 1.00 0.51 C ATOM 758 C PRO A 50 17.757 -1.996 -4.896 1.00 0.53 C ATOM 759 O PRO A 50 18.746 -1.306 -5.156 1.00 0.65 O ATOM 760 CB PRO A 50 16.284 -0.128 -4.157 1.00 0.64 C ATOM 761 CG PRO A 50 15.906 -0.596 -2.793 1.00 0.73 C ATOM 762 CD PRO A 50 15.041 -1.819 -2.981 1.00 0.55 C ATOM 0 HA PRO A 50 16.181 -1.280 -6.061 1.00 0.51 H new ATOM 0 HB2 PRO A 50 17.243 0.390 -4.147 1.00 0.64 H new ATOM 0 HB3 PRO A 50 15.548 0.571 -4.555 1.00 0.64 H new ATOM 0 HG2 PRO A 50 16.793 -0.835 -2.206 1.00 0.73 H new ATOM 0 HG3 PRO A 50 15.366 0.181 -2.253 1.00 0.73 H new ATOM 0 HD2 PRO A 50 15.309 -2.609 -2.280 1.00 0.55 H new ATOM 0 HD3 PRO A 50 13.987 -1.592 -2.818 1.00 0.55 H new ATOM 770 N TYR A 51 17.859 -3.264 -4.544 1.00 0.53 N ATOM 771 CA TYR A 51 19.155 -3.887 -4.370 1.00 0.68 C ATOM 772 C TYR A 51 19.188 -5.196 -5.125 1.00 0.88 C ATOM 773 O TYR A 51 18.201 -5.926 -5.155 1.00 1.88 O ATOM 774 CB TYR A 51 19.461 -4.113 -2.888 1.00 0.74 C ATOM 775 CG TYR A 51 20.929 -4.355 -2.609 1.00 0.88 C ATOM 776 CD1 TYR A 51 21.828 -3.298 -2.587 1.00 1.22 C ATOM 777 CD2 TYR A 51 21.414 -5.634 -2.371 1.00 1.06 C ATOM 778 CE1 TYR A 51 23.170 -3.506 -2.336 1.00 1.63 C ATOM 779 CE2 TYR A 51 22.755 -5.851 -2.118 1.00 1.36 C ATOM 780 CZ TYR A 51 23.629 -4.783 -2.101 1.00 1.64 C ATOM 781 OH TYR A 51 24.966 -4.993 -1.852 1.00 2.08 O ATOM 0 H TYR A 51 17.063 -3.879 -4.374 1.00 0.53 H new ATOM 0 HA TYR A 51 19.922 -3.222 -4.768 1.00 0.68 H new ATOM 0 HB2 TYR A 51 19.129 -3.245 -2.319 1.00 0.74 H new ATOM 0 HB3 TYR A 51 18.885 -4.967 -2.532 1.00 0.74 H new ATOM 0 HD1 TYR A 51 21.472 -2.295 -2.769 1.00 1.22 H new ATOM 0 HD2 TYR A 51 20.733 -6.472 -2.384 1.00 1.06 H new ATOM 0 HE1 TYR A 51 23.856 -2.672 -2.324 1.00 1.63 H new ATOM 0 HE2 TYR A 51 23.117 -6.852 -1.934 1.00 1.36 H new ATOM 0 HH TYR A 51 25.125 -5.949 -1.706 1.00 2.08 H new ATOM 791 N SER A 52 20.328 -5.497 -5.717 1.00 0.69 N ATOM 792 CA SER A 52 20.463 -6.615 -6.637 1.00 0.66 C ATOM 793 C SER A 52 20.487 -7.974 -5.925 1.00 0.65 C ATOM 794 O SER A 52 21.100 -8.922 -6.408 1.00 0.77 O ATOM 795 CB SER A 52 21.742 -6.409 -7.437 1.00 0.80 C ATOM 796 OG SER A 52 22.855 -6.255 -6.570 1.00 1.51 O ATOM 0 H SER A 52 21.191 -4.972 -5.574 1.00 0.69 H new ATOM 0 HA SER A 52 19.591 -6.636 -7.290 1.00 0.66 H new ATOM 0 HB2 SER A 52 21.905 -7.260 -8.098 1.00 0.80 H new ATOM 0 HB3 SER A 52 21.643 -5.527 -8.070 1.00 0.80 H new ATOM 0 HG SER A 52 23.668 -6.125 -7.101 1.00 1.51 H new ATOM 802 N HIS A 53 19.795 -8.079 -4.800 1.00 0.58 N ATOM 803 CA HIS A 53 19.732 -9.330 -4.059 1.00 0.66 C ATOM 804 C HIS A 53 18.364 -9.505 -3.411 1.00 0.65 C ATOM 805 O HIS A 53 17.849 -8.581 -2.780 1.00 1.08 O ATOM 806 CB HIS A 53 20.829 -9.390 -2.988 1.00 0.74 C ATOM 807 CG HIS A 53 22.199 -9.623 -3.546 1.00 0.95 C ATOM 808 ND1 HIS A 53 23.106 -8.608 -3.779 1.00 1.06 N ATOM 809 CD2 HIS A 53 22.811 -10.766 -3.933 1.00 1.41 C ATOM 810 CE1 HIS A 53 24.210 -9.116 -4.289 1.00 1.43 C ATOM 811 NE2 HIS A 53 24.057 -10.423 -4.391 1.00 1.67 N ATOM 0 H HIS A 53 19.269 -7.313 -4.380 1.00 0.58 H new ATOM 0 HA HIS A 53 19.893 -10.143 -4.767 1.00 0.66 H new ATOM 0 HB2 HIS A 53 20.828 -8.456 -2.426 1.00 0.74 H new ATOM 0 HB3 HIS A 53 20.593 -10.186 -2.282 1.00 0.74 H new ATOM 0 HD1 HIS A 53 22.946 -7.619 -3.586 1.00 1.06 H new ATOM 0 HD2 HIS A 53 22.396 -11.762 -3.889 1.00 1.41 H new ATOM 0 HE1 HIS A 53 25.090 -8.558 -4.575 1.00 1.43 H new ATOM 820 N SER A 54 17.770 -10.671 -3.646 1.00 0.55 N ATOM 821 CA SER A 54 16.568 -11.126 -2.972 1.00 0.51 C ATOM 822 C SER A 54 16.567 -10.779 -1.490 1.00 0.47 C ATOM 823 O SER A 54 17.244 -11.429 -0.733 1.00 0.51 O ATOM 824 CB SER A 54 16.528 -12.649 -3.104 1.00 0.61 C ATOM 825 OG SER A 54 16.842 -13.045 -4.431 1.00 1.39 O ATOM 0 H SER A 54 18.124 -11.340 -4.329 1.00 0.55 H new ATOM 0 HA SER A 54 15.706 -10.637 -3.427 1.00 0.51 H new ATOM 0 HB2 SER A 54 17.236 -13.098 -2.408 1.00 0.61 H new ATOM 0 HB3 SER A 54 15.538 -13.017 -2.834 1.00 0.61 H new ATOM 0 HG SER A 54 16.291 -12.537 -5.063 1.00 1.39 H new ATOM 831 N ILE A 55 15.726 -9.859 -1.044 1.00 0.44 N ATOM 832 CA ILE A 55 15.788 -9.450 0.354 1.00 0.49 C ATOM 833 C ILE A 55 15.070 -10.515 1.132 1.00 0.58 C ATOM 834 O ILE A 55 14.611 -11.442 0.522 1.00 1.03 O ATOM 835 CB ILE A 55 15.169 -8.059 0.636 1.00 0.49 C ATOM 836 CG1 ILE A 55 13.905 -7.820 -0.187 1.00 0.47 C ATOM 837 CG2 ILE A 55 16.189 -6.964 0.383 1.00 0.48 C ATOM 838 CD1 ILE A 55 13.172 -6.551 0.192 1.00 0.56 C ATOM 0 H ILE A 55 15.014 -9.393 -1.606 1.00 0.44 H new ATOM 0 HA ILE A 55 16.833 -9.346 0.648 1.00 0.49 H new ATOM 0 HB ILE A 55 14.880 -8.035 1.687 1.00 0.49 H new ATOM 0 HG12 ILE A 55 14.171 -7.776 -1.243 1.00 0.47 H new ATOM 0 HG13 ILE A 55 13.233 -8.670 -0.063 1.00 0.47 H new ATOM 0 HG21 ILE A 55 15.738 -5.993 0.586 1.00 0.48 H new ATOM 0 HG22 ILE A 55 17.048 -7.109 1.038 1.00 0.48 H new ATOM 0 HG23 ILE A 55 16.514 -7.003 -0.657 1.00 0.48 H new ATOM 0 HD11 ILE A 55 12.284 -6.443 -0.432 1.00 0.56 H new ATOM 0 HD12 ILE A 55 12.876 -6.601 1.240 1.00 0.56 H new ATOM 0 HD13 ILE A 55 13.828 -5.693 0.041 1.00 0.56 H new ATOM 850 N PRO A 56 15.059 -10.511 2.453 1.00 0.35 N ATOM 851 CA PRO A 56 14.339 -11.527 3.193 1.00 0.34 C ATOM 852 C PRO A 56 12.907 -11.144 3.561 1.00 0.30 C ATOM 853 O PRO A 56 11.950 -11.789 3.139 1.00 0.32 O ATOM 854 CB PRO A 56 15.166 -11.688 4.455 1.00 0.37 C ATOM 855 CG PRO A 56 16.129 -10.534 4.499 1.00 0.35 C ATOM 856 CD PRO A 56 15.795 -9.627 3.343 1.00 0.35 C ATOM 0 HA PRO A 56 14.227 -12.430 2.593 1.00 0.34 H new ATOM 0 HB2 PRO A 56 14.526 -11.691 5.338 1.00 0.37 H new ATOM 0 HB3 PRO A 56 15.702 -12.637 4.447 1.00 0.37 H new ATOM 0 HG2 PRO A 56 16.044 -9.998 5.445 1.00 0.35 H new ATOM 0 HG3 PRO A 56 17.157 -10.888 4.425 1.00 0.35 H new ATOM 0 HD2 PRO A 56 15.193 -8.774 3.657 1.00 0.35 H new ATOM 0 HD3 PRO A 56 16.691 -9.227 2.868 1.00 0.35 H new ATOM 864 N ILE A 57 12.768 -10.106 4.361 1.00 0.29 N ATOM 865 CA ILE A 57 11.486 -9.798 4.989 1.00 0.30 C ATOM 866 C ILE A 57 11.168 -8.314 4.869 1.00 0.27 C ATOM 867 O ILE A 57 12.069 -7.486 4.737 1.00 0.30 O ATOM 868 CB ILE A 57 11.465 -10.261 6.483 1.00 0.38 C ATOM 869 CG1 ILE A 57 11.078 -11.744 6.591 1.00 0.58 C ATOM 870 CG2 ILE A 57 10.533 -9.419 7.347 1.00 0.38 C ATOM 871 CD1 ILE A 57 12.209 -12.709 6.317 1.00 1.23 C ATOM 0 H ILE A 57 13.521 -9.459 4.595 1.00 0.29 H new ATOM 0 HA ILE A 57 10.710 -10.352 4.461 1.00 0.30 H new ATOM 0 HB ILE A 57 12.477 -10.122 6.862 1.00 0.38 H new ATOM 0 HG12 ILE A 57 10.690 -11.933 7.592 1.00 0.58 H new ATOM 0 HG13 ILE A 57 10.267 -11.947 5.892 1.00 0.58 H new ATOM 0 HG21 ILE A 57 10.558 -9.785 8.373 1.00 0.38 H new ATOM 0 HG22 ILE A 57 10.857 -8.379 7.325 1.00 0.38 H new ATOM 0 HG23 ILE A 57 9.516 -9.490 6.961 1.00 0.38 H new ATOM 0 HD11 ILE A 57 11.846 -13.732 6.415 1.00 1.23 H new ATOM 0 HD12 ILE A 57 12.584 -12.553 5.305 1.00 1.23 H new ATOM 0 HD13 ILE A 57 13.014 -12.539 7.032 1.00 1.23 H new ATOM 883 N CYS A 58 9.884 -7.988 4.878 1.00 0.26 N ATOM 884 CA CYS A 58 9.447 -6.625 4.710 1.00 0.24 C ATOM 885 C CYS A 58 8.270 -6.300 5.620 1.00 0.23 C ATOM 886 O CYS A 58 7.780 -7.140 6.374 1.00 0.25 O ATOM 887 CB CYS A 58 9.036 -6.391 3.259 1.00 0.26 C ATOM 888 SG CYS A 58 10.240 -6.991 2.053 1.00 1.15 S ATOM 0 H CYS A 58 9.127 -8.660 5.001 1.00 0.26 H new ATOM 0 HA CYS A 58 10.279 -5.973 4.976 1.00 0.24 H new ATOM 0 HB2 CYS A 58 8.080 -6.882 3.079 1.00 0.26 H new ATOM 0 HB3 CYS A 58 8.881 -5.323 3.103 1.00 0.26 H new ATOM 0 HG CYS A 58 10.068 -6.371 0.923 1.00 1.15 H new ATOM 894 N GLU A 59 7.848 -5.064 5.521 1.00 0.25 N ATOM 895 CA GLU A 59 6.697 -4.573 6.240 1.00 0.27 C ATOM 896 C GLU A 59 5.802 -3.777 5.315 1.00 0.29 C ATOM 897 O GLU A 59 6.194 -2.737 4.786 1.00 0.32 O ATOM 898 CB GLU A 59 7.138 -3.715 7.424 1.00 0.32 C ATOM 899 CG GLU A 59 5.986 -3.092 8.200 1.00 0.39 C ATOM 900 CD GLU A 59 6.459 -2.223 9.348 1.00 0.67 C ATOM 901 OE1 GLU A 59 7.139 -1.208 9.096 1.00 1.04 O ATOM 902 OE2 GLU A 59 6.146 -2.547 10.510 1.00 1.36 O ATOM 0 H GLU A 59 8.298 -4.362 4.933 1.00 0.25 H new ATOM 0 HA GLU A 59 6.133 -5.425 6.621 1.00 0.27 H new ATOM 0 HB2 GLU A 59 7.731 -4.328 8.103 1.00 0.32 H new ATOM 0 HB3 GLU A 59 7.790 -2.920 7.061 1.00 0.32 H new ATOM 0 HG2 GLU A 59 5.378 -2.493 7.522 1.00 0.39 H new ATOM 0 HG3 GLU A 59 5.345 -3.883 8.588 1.00 0.39 H new ATOM 909 N ILE A 60 4.610 -4.295 5.114 1.00 0.32 N ATOM 910 CA ILE A 60 3.580 -3.546 4.438 1.00 0.34 C ATOM 911 C ILE A 60 2.647 -2.895 5.450 1.00 0.31 C ATOM 912 O ILE A 60 1.891 -3.549 6.171 1.00 0.36 O ATOM 913 CB ILE A 60 2.793 -4.374 3.382 1.00 0.48 C ATOM 914 CG1 ILE A 60 2.909 -5.885 3.614 1.00 0.33 C ATOM 915 CG2 ILE A 60 3.280 -4.030 1.983 1.00 0.99 C ATOM 916 CD1 ILE A 60 2.029 -6.411 4.721 1.00 1.05 C ATOM 0 H ILE A 60 4.333 -5.231 5.410 1.00 0.32 H new ATOM 0 HA ILE A 60 4.086 -2.765 3.869 1.00 0.34 H new ATOM 0 HB ILE A 60 1.741 -4.109 3.487 1.00 0.48 H new ATOM 0 HG12 ILE A 60 2.658 -6.403 2.689 1.00 0.33 H new ATOM 0 HG13 ILE A 60 3.947 -6.127 3.844 1.00 0.33 H new ATOM 0 HG21 ILE A 60 2.724 -4.614 1.250 1.00 0.99 H new ATOM 0 HG22 ILE A 60 3.124 -2.968 1.794 1.00 0.99 H new ATOM 0 HG23 ILE A 60 4.342 -4.261 1.900 1.00 0.99 H new ATOM 0 HD11 ILE A 60 2.172 -7.487 4.819 1.00 1.05 H new ATOM 0 HD12 ILE A 60 2.293 -5.923 5.659 1.00 1.05 H new ATOM 0 HD13 ILE A 60 0.985 -6.203 4.486 1.00 1.05 H new ATOM 928 N SER A 61 2.764 -1.584 5.495 1.00 0.26 N ATOM 929 CA SER A 61 1.973 -0.756 6.382 1.00 0.25 C ATOM 930 C SER A 61 1.047 0.095 5.549 1.00 0.24 C ATOM 931 O SER A 61 1.463 1.095 4.971 1.00 0.24 O ATOM 932 CB SER A 61 2.879 0.109 7.256 1.00 0.29 C ATOM 933 OG SER A 61 2.148 1.120 7.928 1.00 0.83 O ATOM 0 H SER A 61 3.416 -1.059 4.912 1.00 0.26 H new ATOM 0 HA SER A 61 1.382 -1.385 7.048 1.00 0.25 H new ATOM 0 HB2 SER A 61 3.388 -0.520 7.987 1.00 0.29 H new ATOM 0 HB3 SER A 61 3.651 0.568 6.638 1.00 0.29 H new ATOM 0 HG SER A 61 2.666 1.952 7.930 1.00 0.83 H new ATOM 939 N PHE A 62 -0.210 -0.282 5.489 1.00 0.24 N ATOM 940 CA PHE A 62 -1.112 0.293 4.520 1.00 0.25 C ATOM 941 C PHE A 62 -2.172 1.099 5.218 1.00 0.26 C ATOM 942 O PHE A 62 -2.729 0.684 6.224 1.00 0.30 O ATOM 943 CB PHE A 62 -1.746 -0.804 3.649 1.00 0.27 C ATOM 944 CG PHE A 62 -2.120 -2.042 4.422 1.00 0.29 C ATOM 945 CD1 PHE A 62 -3.372 -2.154 5.009 1.00 0.31 C ATOM 946 CD2 PHE A 62 -1.228 -3.096 4.553 1.00 0.34 C ATOM 947 CE1 PHE A 62 -3.726 -3.289 5.708 1.00 0.37 C ATOM 948 CE2 PHE A 62 -1.578 -4.233 5.255 1.00 0.40 C ATOM 949 CZ PHE A 62 -2.791 -4.323 5.861 1.00 0.40 C ATOM 0 H PHE A 62 -0.630 -0.983 6.099 1.00 0.24 H new ATOM 0 HA PHE A 62 -0.546 0.955 3.865 1.00 0.25 H new ATOM 0 HB2 PHE A 62 -2.637 -0.404 3.166 1.00 0.27 H new ATOM 0 HB3 PHE A 62 -1.049 -1.076 2.857 1.00 0.27 H new ATOM 0 HD1 PHE A 62 -4.078 -1.342 4.917 1.00 0.31 H new ATOM 0 HD2 PHE A 62 -0.249 -3.027 4.101 1.00 0.34 H new ATOM 0 HE1 PHE A 62 -4.714 -3.381 6.134 1.00 0.37 H new ATOM 0 HE2 PHE A 62 -0.883 -5.056 5.323 1.00 0.40 H new ATOM 0 HZ PHE A 62 -3.034 -5.189 6.459 1.00 0.40 H new ATOM 959 N THR A 63 -2.389 2.274 4.702 1.00 0.25 N ATOM 960 CA THR A 63 -3.461 3.121 5.147 1.00 0.27 C ATOM 961 C THR A 63 -4.289 3.515 3.944 1.00 0.25 C ATOM 962 O THR A 63 -3.877 4.342 3.138 1.00 0.27 O ATOM 963 CB THR A 63 -2.938 4.380 5.864 1.00 0.32 C ATOM 964 OG1 THR A 63 -2.013 4.008 6.898 1.00 0.36 O ATOM 965 CG2 THR A 63 -4.087 5.176 6.470 1.00 0.38 C ATOM 0 H THR A 63 -1.823 2.676 3.954 1.00 0.25 H new ATOM 0 HA THR A 63 -4.067 2.571 5.867 1.00 0.27 H new ATOM 0 HB THR A 63 -2.431 5.005 5.129 1.00 0.32 H new ATOM 0 HG1 THR A 63 -1.684 4.814 7.348 1.00 0.36 H new ATOM 0 HG21 THR A 63 -3.693 6.060 6.971 1.00 0.38 H new ATOM 0 HG22 THR A 63 -4.774 5.482 5.681 1.00 0.38 H new ATOM 0 HG23 THR A 63 -4.618 4.556 7.193 1.00 0.38 H new ATOM 973 N PHE A 64 -5.443 2.913 3.815 1.00 0.24 N ATOM 974 CA PHE A 64 -6.294 3.165 2.683 1.00 0.24 C ATOM 975 C PHE A 64 -7.322 4.223 3.027 1.00 0.22 C ATOM 976 O PHE A 64 -7.759 4.319 4.172 1.00 0.23 O ATOM 977 CB PHE A 64 -6.983 1.886 2.227 1.00 0.27 C ATOM 978 CG PHE A 64 -6.270 1.194 1.106 1.00 0.43 C ATOM 979 CD1 PHE A 64 -6.422 1.619 -0.208 1.00 0.58 C ATOM 980 CD2 PHE A 64 -5.458 0.111 1.362 1.00 0.65 C ATOM 981 CE1 PHE A 64 -5.772 0.973 -1.235 1.00 0.84 C ATOM 982 CE2 PHE A 64 -4.803 -0.538 0.336 1.00 0.90 C ATOM 983 CZ PHE A 64 -4.962 -0.107 -0.961 1.00 0.96 C ATOM 0 H PHE A 64 -5.816 2.241 4.485 1.00 0.24 H new ATOM 0 HA PHE A 64 -5.675 3.528 1.863 1.00 0.24 H new ATOM 0 HB2 PHE A 64 -7.063 1.204 3.073 1.00 0.27 H new ATOM 0 HB3 PHE A 64 -7.999 2.122 1.911 1.00 0.27 H new ATOM 0 HD1 PHE A 64 -7.057 2.465 -0.426 1.00 0.58 H new ATOM 0 HD2 PHE A 64 -5.333 -0.234 2.378 1.00 0.65 H new ATOM 0 HE1 PHE A 64 -5.897 1.312 -2.253 1.00 0.84 H new ATOM 0 HE2 PHE A 64 -4.166 -1.383 0.551 1.00 0.90 H new ATOM 0 HZ PHE A 64 -4.451 -0.616 -1.765 1.00 0.96 H new ATOM 993 N HIS A 65 -7.628 5.068 2.054 1.00 0.24 N ATOM 994 CA HIS A 65 -8.662 6.096 2.176 1.00 0.26 C ATOM 995 C HIS A 65 -9.524 6.009 0.937 1.00 0.24 C ATOM 996 O HIS A 65 -9.015 5.671 -0.116 1.00 0.36 O ATOM 997 CB HIS A 65 -8.091 7.524 2.227 1.00 0.42 C ATOM 998 CG HIS A 65 -6.962 7.787 3.182 1.00 0.51 C ATOM 999 ND1 HIS A 65 -6.621 9.059 3.573 1.00 1.02 N ATOM 1000 CD2 HIS A 65 -6.077 6.964 3.794 1.00 0.53 C ATOM 1001 CE1 HIS A 65 -5.581 9.011 4.378 1.00 1.29 C ATOM 1002 NE2 HIS A 65 -5.227 7.751 4.532 1.00 1.02 N ATOM 0 H HIS A 65 -7.163 5.063 1.146 1.00 0.24 H new ATOM 0 HA HIS A 65 -9.204 5.917 3.105 1.00 0.26 H new ATOM 0 HB2 HIS A 65 -7.752 7.786 1.225 1.00 0.42 H new ATOM 0 HB3 HIS A 65 -8.906 8.203 2.475 1.00 0.42 H new ATOM 0 HD1 HIS A 65 -7.101 9.911 3.283 1.00 1.02 H new ATOM 0 HD2 HIS A 65 -6.046 5.887 3.716 1.00 0.53 H new ATOM 0 HE1 HIS A 65 -5.098 9.862 4.836 1.00 1.29 H new ATOM 1011 N SER A 66 -10.812 6.260 1.029 1.00 0.22 N ATOM 1012 CA SER A 66 -11.597 6.312 -0.186 1.00 0.25 C ATOM 1013 C SER A 66 -11.918 7.750 -0.572 1.00 0.24 C ATOM 1014 O SER A 66 -11.128 8.388 -1.264 1.00 0.30 O ATOM 1015 CB SER A 66 -12.863 5.480 -0.072 1.00 0.38 C ATOM 1016 OG SER A 66 -13.516 5.378 -1.320 1.00 1.27 O ATOM 0 H SER A 66 -11.323 6.426 1.896 1.00 0.22 H new ATOM 0 HA SER A 66 -10.993 5.878 -0.982 1.00 0.25 H new ATOM 0 HB2 SER A 66 -12.616 4.484 0.296 1.00 0.38 H new ATOM 0 HB3 SER A 66 -13.535 5.932 0.658 1.00 0.38 H new ATOM 0 HG SER A 66 -12.929 5.722 -2.025 1.00 1.27 H new ATOM 1022 N ALA A 67 -13.056 8.273 -0.106 1.00 0.24 N ATOM 1023 CA ALA A 67 -13.470 9.622 -0.467 1.00 0.28 C ATOM 1024 C ALA A 67 -12.395 10.619 -0.082 1.00 0.30 C ATOM 1025 O ALA A 67 -11.745 11.211 -0.944 1.00 0.36 O ATOM 1026 CB ALA A 67 -14.786 9.972 0.209 1.00 0.32 C ATOM 0 H ALA A 67 -13.699 7.784 0.517 1.00 0.24 H new ATOM 0 HA ALA A 67 -13.616 9.666 -1.546 1.00 0.28 H new ATOM 0 HB1 ALA A 67 -15.081 10.983 -0.071 1.00 0.32 H new ATOM 0 HB2 ALA A 67 -15.556 9.268 -0.107 1.00 0.32 H new ATOM 0 HB3 ALA A 67 -14.666 9.916 1.291 1.00 0.32 H new ATOM 1032 N GLY A 68 -12.215 10.807 1.214 1.00 0.29 N ATOM 1033 CA GLY A 68 -11.103 11.596 1.701 1.00 0.32 C ATOM 1034 C GLY A 68 -10.976 11.418 3.192 1.00 0.34 C ATOM 1035 O GLY A 68 -10.310 12.189 3.884 1.00 0.39 O ATOM 0 H GLY A 68 -12.821 10.426 1.941 1.00 0.29 H new ATOM 0 HA2 GLY A 68 -10.181 11.288 1.207 1.00 0.32 H new ATOM 0 HA3 GLY A 68 -11.257 12.648 1.461 1.00 0.32 H new ATOM 1039 N ARG A 69 -11.642 10.385 3.680 1.00 0.36 N ATOM 1040 CA ARG A 69 -11.679 10.090 5.090 1.00 0.46 C ATOM 1041 C ARG A 69 -10.681 8.972 5.392 1.00 0.52 C ATOM 1042 O ARG A 69 -9.569 9.233 5.853 1.00 1.08 O ATOM 1043 CB ARG A 69 -13.126 9.729 5.471 1.00 0.48 C ATOM 1044 CG ARG A 69 -13.785 8.759 4.500 1.00 0.47 C ATOM 1045 CD ARG A 69 -15.299 8.876 4.504 1.00 0.58 C ATOM 1046 NE ARG A 69 -15.765 10.100 3.843 1.00 0.55 N ATOM 1047 CZ ARG A 69 -16.814 10.827 4.238 1.00 1.05 C ATOM 1048 NH1 ARG A 69 -17.382 10.613 5.416 1.00 1.97 N ATOM 1049 NH2 ARG A 69 -17.250 11.818 3.472 1.00 1.04 N ATOM 0 H ARG A 69 -12.171 9.731 3.103 1.00 0.36 H new ATOM 0 HA ARG A 69 -11.384 10.949 5.692 1.00 0.46 H new ATOM 0 HB2 ARG A 69 -13.132 9.292 6.469 1.00 0.48 H new ATOM 0 HB3 ARG A 69 -13.719 10.642 5.519 1.00 0.48 H new ATOM 0 HG2 ARG A 69 -13.411 8.947 3.493 1.00 0.47 H new ATOM 0 HG3 ARG A 69 -13.501 7.739 4.760 1.00 0.47 H new ATOM 0 HD2 ARG A 69 -15.729 8.009 4.003 1.00 0.58 H new ATOM 0 HD3 ARG A 69 -15.660 8.861 5.533 1.00 0.58 H new ATOM 0 HE ARG A 69 -15.251 10.419 3.022 1.00 0.55 H new ATOM 0 HH11 ARG A 69 -17.019 9.886 6.033 1.00 1.97 H new ATOM 0 HH12 ARG A 69 -18.182 11.175 5.706 1.00 1.97 H new ATOM 0 HH21 ARG A 69 -16.785 12.021 2.587 1.00 1.04 H new ATOM 0 HH22 ARG A 69 -18.050 12.377 3.768 1.00 1.04 H new ATOM 1063 N GLU A 70 -11.067 7.742 5.088 1.00 0.52 N ATOM 1064 CA GLU A 70 -10.188 6.600 5.150 1.00 0.52 C ATOM 1065 C GLU A 70 -10.908 5.416 4.534 1.00 0.67 C ATOM 1066 O GLU A 70 -11.993 5.566 3.968 1.00 1.28 O ATOM 1067 CB GLU A 70 -9.740 6.269 6.586 1.00 0.66 C ATOM 1068 CG GLU A 70 -10.865 5.969 7.568 1.00 1.35 C ATOM 1069 CD GLU A 70 -11.536 7.220 8.096 1.00 1.91 C ATOM 1070 OE1 GLU A 70 -10.961 7.873 8.996 1.00 2.12 O ATOM 1071 OE2 GLU A 70 -12.631 7.560 7.613 1.00 2.61 O ATOM 0 H GLU A 70 -12.015 7.513 4.788 1.00 0.52 H new ATOM 0 HA GLU A 70 -9.279 6.834 4.596 1.00 0.52 H new ATOM 0 HB2 GLU A 70 -9.072 5.408 6.551 1.00 0.66 H new ATOM 0 HB3 GLU A 70 -9.159 7.108 6.970 1.00 0.66 H new ATOM 0 HG2 GLU A 70 -11.610 5.342 7.078 1.00 1.35 H new ATOM 0 HG3 GLU A 70 -10.467 5.396 8.405 1.00 1.35 H new ATOM 1078 N ILE A 71 -10.255 4.286 4.566 1.00 0.28 N ATOM 1079 CA ILE A 71 -10.845 3.010 4.208 1.00 0.28 C ATOM 1080 C ILE A 71 -10.452 1.957 5.242 1.00 0.29 C ATOM 1081 O ILE A 71 -11.242 1.085 5.596 1.00 0.33 O ATOM 1082 CB ILE A 71 -10.388 2.582 2.792 1.00 0.31 C ATOM 1083 CG1 ILE A 71 -11.359 3.103 1.739 1.00 0.37 C ATOM 1084 CG2 ILE A 71 -10.234 1.080 2.676 1.00 0.30 C ATOM 1085 CD1 ILE A 71 -12.754 2.521 1.849 1.00 0.40 C ATOM 0 H ILE A 71 -9.277 4.218 4.847 1.00 0.28 H new ATOM 0 HA ILE A 71 -11.931 3.108 4.198 1.00 0.28 H new ATOM 0 HB ILE A 71 -9.407 3.023 2.618 1.00 0.31 H new ATOM 0 HG12 ILE A 71 -11.421 4.188 1.821 1.00 0.37 H new ATOM 0 HG13 ILE A 71 -10.960 2.881 0.749 1.00 0.37 H new ATOM 0 HG21 ILE A 71 -9.912 0.824 1.667 1.00 0.30 H new ATOM 0 HG22 ILE A 71 -9.489 0.734 3.393 1.00 0.30 H new ATOM 0 HG23 ILE A 71 -11.190 0.599 2.885 1.00 0.30 H new ATOM 0 HD11 ILE A 71 -13.386 2.940 1.066 1.00 0.40 H new ATOM 0 HD12 ILE A 71 -12.706 1.438 1.736 1.00 0.40 H new ATOM 0 HD13 ILE A 71 -13.174 2.766 2.824 1.00 0.40 H new ATOM 1097 N GLY A 72 -9.229 2.076 5.739 1.00 0.29 N ATOM 1098 CA GLY A 72 -8.710 1.134 6.710 1.00 0.36 C ATOM 1099 C GLY A 72 -7.201 1.199 6.748 1.00 0.34 C ATOM 1100 O GLY A 72 -6.605 1.878 5.917 1.00 0.49 O ATOM 0 H GLY A 72 -8.579 2.819 5.482 1.00 0.29 H new ATOM 0 HA2 GLY A 72 -9.115 1.358 7.697 1.00 0.36 H new ATOM 0 HA3 GLY A 72 -9.031 0.124 6.455 1.00 0.36 H new ATOM 1104 N LYS A 73 -6.571 0.521 7.694 1.00 0.36 N ATOM 1105 CA LYS A 73 -5.118 0.554 7.786 1.00 0.35 C ATOM 1106 C LYS A 73 -4.602 -0.619 8.611 1.00 0.39 C ATOM 1107 O LYS A 73 -5.375 -1.290 9.296 1.00 0.47 O ATOM 1108 CB LYS A 73 -4.633 1.879 8.396 1.00 0.44 C ATOM 1109 CG LYS A 73 -4.691 1.936 9.915 1.00 0.61 C ATOM 1110 CD LYS A 73 -6.107 2.106 10.442 1.00 0.68 C ATOM 1111 CE LYS A 73 -6.119 2.193 11.959 1.00 1.26 C ATOM 1112 NZ LYS A 73 -5.779 0.892 12.602 1.00 1.81 N ATOM 0 H LYS A 73 -7.034 -0.051 8.400 1.00 0.36 H new ATOM 0 HA LYS A 73 -4.721 0.473 6.774 1.00 0.35 H new ATOM 0 HB2 LYS A 73 -3.605 2.056 8.078 1.00 0.44 H new ATOM 0 HB3 LYS A 73 -5.236 2.692 7.992 1.00 0.44 H new ATOM 0 HG2 LYS A 73 -4.262 1.022 10.325 1.00 0.61 H new ATOM 0 HG3 LYS A 73 -4.075 2.763 10.267 1.00 0.61 H new ATOM 0 HD2 LYS A 73 -6.550 3.008 10.019 1.00 0.68 H new ATOM 0 HD3 LYS A 73 -6.722 1.267 10.118 1.00 0.68 H new ATOM 0 HE2 LYS A 73 -5.408 2.953 12.283 1.00 1.26 H new ATOM 0 HE3 LYS A 73 -7.105 2.515 12.295 1.00 1.26 H new ATOM 0 HZ1 LYS A 73 -5.899 0.972 13.632 1.00 1.81 H new ATOM 0 HZ2 LYS A 73 -6.409 0.149 12.237 1.00 1.81 H new ATOM 0 HZ3 LYS A 73 -4.792 0.646 12.386 1.00 1.81 H new ATOM 1126 N GLY A 74 -3.301 -0.865 8.534 1.00 0.39 N ATOM 1127 CA GLY A 74 -2.689 -1.918 9.313 1.00 0.43 C ATOM 1128 C GLY A 74 -1.230 -2.082 8.965 1.00 0.34 C ATOM 1129 O GLY A 74 -0.769 -1.550 7.954 1.00 0.32 O ATOM 0 H GLY A 74 -2.655 -0.347 7.939 1.00 0.39 H new ATOM 0 HA2 GLY A 74 -2.788 -1.692 10.375 1.00 0.43 H new ATOM 0 HA3 GLY A 74 -3.215 -2.856 9.136 1.00 0.43 H new ATOM 1133 N LYS A 75 -0.502 -2.805 9.798 1.00 0.37 N ATOM 1134 CA LYS A 75 0.904 -3.064 9.559 1.00 0.37 C ATOM 1135 C LYS A 75 1.182 -4.549 9.676 1.00 0.39 C ATOM 1136 O LYS A 75 0.794 -5.180 10.659 1.00 0.50 O ATOM 1137 CB LYS A 75 1.779 -2.307 10.558 1.00 0.56 C ATOM 1138 CG LYS A 75 1.634 -0.801 10.486 1.00 0.84 C ATOM 1139 CD LYS A 75 2.667 -0.116 11.357 1.00 0.90 C ATOM 1140 CE LYS A 75 2.609 1.390 11.198 1.00 1.17 C ATOM 1141 NZ LYS A 75 3.708 2.066 11.933 1.00 1.72 N ATOM 0 H LYS A 75 -0.867 -3.226 10.653 1.00 0.37 H new ATOM 0 HA LYS A 75 1.145 -2.720 8.553 1.00 0.37 H new ATOM 0 HB2 LYS A 75 1.531 -2.638 11.566 1.00 0.56 H new ATOM 0 HB3 LYS A 75 2.822 -2.570 10.384 1.00 0.56 H new ATOM 0 HG2 LYS A 75 1.746 -0.470 9.454 1.00 0.84 H new ATOM 0 HG3 LYS A 75 0.633 -0.512 10.807 1.00 0.84 H new ATOM 0 HD2 LYS A 75 2.499 -0.380 12.401 1.00 0.90 H new ATOM 0 HD3 LYS A 75 3.663 -0.474 11.094 1.00 0.90 H new ATOM 0 HE2 LYS A 75 2.668 1.646 10.140 1.00 1.17 H new ATOM 0 HE3 LYS A 75 1.649 1.757 11.562 1.00 1.17 H new ATOM 0 HZ1 LYS A 75 3.634 3.095 11.799 1.00 1.72 H new ATOM 0 HZ2 LYS A 75 3.637 1.842 12.946 1.00 1.72 H new ATOM 0 HZ3 LYS A 75 4.624 1.735 11.569 1.00 1.72 H new ATOM 1155 N ILE A 76 1.846 -5.111 8.681 1.00 0.35 N ATOM 1156 CA ILE A 76 2.144 -6.534 8.691 1.00 0.39 C ATOM 1157 C ILE A 76 3.559 -6.793 8.181 1.00 0.34 C ATOM 1158 O ILE A 76 3.915 -6.383 7.079 1.00 0.35 O ATOM 1159 CB ILE A 76 1.144 -7.343 7.825 1.00 0.45 C ATOM 1160 CG1 ILE A 76 -0.296 -7.121 8.300 1.00 0.51 C ATOM 1161 CG2 ILE A 76 1.486 -8.825 7.863 1.00 0.56 C ATOM 1162 CD1 ILE A 76 -1.334 -7.811 7.440 1.00 0.73 C ATOM 0 H ILE A 76 2.187 -4.609 7.861 1.00 0.35 H new ATOM 0 HA ILE A 76 2.055 -6.865 9.726 1.00 0.39 H new ATOM 0 HB ILE A 76 1.224 -6.989 6.797 1.00 0.45 H new ATOM 0 HG12 ILE A 76 -0.390 -7.479 9.325 1.00 0.51 H new ATOM 0 HG13 ILE A 76 -0.503 -6.051 8.316 1.00 0.51 H new ATOM 0 HG21 ILE A 76 0.775 -9.378 7.250 1.00 0.56 H new ATOM 0 HG22 ILE A 76 2.493 -8.976 7.475 1.00 0.56 H new ATOM 0 HG23 ILE A 76 1.435 -9.184 8.891 1.00 0.56 H new ATOM 0 HD11 ILE A 76 -2.329 -7.609 7.837 1.00 0.73 H new ATOM 0 HD12 ILE A 76 -1.268 -7.436 6.419 1.00 0.73 H new ATOM 0 HD13 ILE A 76 -1.154 -8.886 7.444 1.00 0.73 H new ATOM 1174 N PRO A 77 4.401 -7.428 9.002 1.00 0.34 N ATOM 1175 CA PRO A 77 5.696 -7.934 8.557 1.00 0.32 C ATOM 1176 C PRO A 77 5.522 -9.181 7.693 1.00 0.33 C ATOM 1177 O PRO A 77 5.042 -10.216 8.163 1.00 0.44 O ATOM 1178 CB PRO A 77 6.436 -8.273 9.862 1.00 0.40 C ATOM 1179 CG PRO A 77 5.586 -7.724 10.964 1.00 0.57 C ATOM 1180 CD PRO A 77 4.185 -7.674 10.428 1.00 0.42 C ATOM 0 HA PRO A 77 6.238 -7.214 7.944 1.00 0.32 H new ATOM 0 HB2 PRO A 77 6.568 -9.350 9.969 1.00 0.40 H new ATOM 0 HB3 PRO A 77 7.430 -7.827 9.875 1.00 0.40 H new ATOM 0 HG2 PRO A 77 5.641 -8.356 11.850 1.00 0.57 H new ATOM 0 HG3 PRO A 77 5.925 -6.731 11.259 1.00 0.57 H new ATOM 0 HD2 PRO A 77 3.650 -8.608 10.602 1.00 0.42 H new ATOM 0 HD3 PRO A 77 3.601 -6.880 10.893 1.00 0.42 H new ATOM 1188 N ASP A 78 5.899 -9.077 6.429 1.00 0.30 N ATOM 1189 CA ASP A 78 5.688 -10.154 5.476 1.00 0.35 C ATOM 1190 C ASP A 78 7.015 -10.522 4.828 1.00 0.32 C ATOM 1191 O ASP A 78 7.839 -9.645 4.585 1.00 0.28 O ATOM 1192 CB ASP A 78 4.678 -9.709 4.413 1.00 0.39 C ATOM 1193 CG ASP A 78 4.324 -10.807 3.430 1.00 0.52 C ATOM 1194 OD1 ASP A 78 5.005 -10.925 2.396 1.00 0.52 O ATOM 1195 OD2 ASP A 78 3.359 -11.555 3.689 1.00 0.79 O ATOM 0 H ASP A 78 6.355 -8.253 6.038 1.00 0.30 H new ATOM 0 HA ASP A 78 5.291 -11.029 5.990 1.00 0.35 H new ATOM 0 HB2 ASP A 78 3.769 -9.365 4.906 1.00 0.39 H new ATOM 0 HB3 ASP A 78 5.086 -8.859 3.867 1.00 0.39 H new ATOM 1200 N PRO A 79 7.270 -11.816 4.580 1.00 0.39 N ATOM 1201 CA PRO A 79 8.493 -12.265 3.910 1.00 0.40 C ATOM 1202 C PRO A 79 8.584 -11.748 2.476 1.00 0.38 C ATOM 1203 O PRO A 79 8.227 -12.446 1.526 1.00 0.47 O ATOM 1204 CB PRO A 79 8.394 -13.794 3.931 1.00 0.52 C ATOM 1205 CG PRO A 79 7.355 -14.107 4.954 1.00 0.58 C ATOM 1206 CD PRO A 79 6.403 -12.948 4.941 1.00 0.49 C ATOM 0 HA PRO A 79 9.387 -11.890 4.408 1.00 0.40 H new ATOM 0 HB2 PRO A 79 8.113 -14.183 2.953 1.00 0.52 H new ATOM 0 HB3 PRO A 79 9.351 -14.247 4.191 1.00 0.52 H new ATOM 0 HG2 PRO A 79 6.840 -15.038 4.716 1.00 0.58 H new ATOM 0 HG3 PRO A 79 7.803 -14.234 5.940 1.00 0.58 H new ATOM 0 HD2 PRO A 79 5.602 -13.091 4.216 1.00 0.49 H new ATOM 0 HD3 PRO A 79 5.931 -12.802 5.913 1.00 0.49 H new ATOM 1214 N GLY A 80 9.051 -10.513 2.338 1.00 0.34 N ATOM 1215 CA GLY A 80 9.179 -9.897 1.036 1.00 0.40 C ATOM 1216 C GLY A 80 10.511 -10.202 0.390 1.00 0.35 C ATOM 1217 O GLY A 80 11.146 -9.329 -0.196 1.00 0.40 O ATOM 0 H GLY A 80 9.346 -9.923 3.116 1.00 0.34 H new ATOM 0 HA2 GLY A 80 8.375 -10.247 0.389 1.00 0.40 H new ATOM 0 HA3 GLY A 80 9.063 -8.818 1.133 1.00 0.40 H new ATOM 1221 N SER A 81 10.937 -11.443 0.512 1.00 0.34 N ATOM 1222 CA SER A 81 12.132 -11.911 -0.146 1.00 0.36 C ATOM 1223 C SER A 81 11.831 -12.058 -1.630 1.00 0.37 C ATOM 1224 O SER A 81 10.791 -12.610 -1.991 1.00 0.43 O ATOM 1225 CB SER A 81 12.549 -13.244 0.459 1.00 0.41 C ATOM 1226 OG SER A 81 13.702 -13.773 -0.173 1.00 0.62 O ATOM 0 H SER A 81 10.462 -12.152 1.071 1.00 0.34 H new ATOM 0 HA SER A 81 12.952 -11.205 -0.013 1.00 0.36 H new ATOM 0 HB2 SER A 81 12.746 -13.114 1.523 1.00 0.41 H new ATOM 0 HB3 SER A 81 11.728 -13.955 0.371 1.00 0.41 H new ATOM 0 HG SER A 81 14.425 -13.112 -0.140 1.00 0.62 H new ATOM 1232 N LEU A 82 12.707 -11.570 -2.503 1.00 0.37 N ATOM 1233 CA LEU A 82 12.268 -11.380 -3.900 1.00 0.39 C ATOM 1234 C LEU A 82 13.385 -11.458 -4.933 1.00 0.49 C ATOM 1235 O LEU A 82 14.415 -12.064 -4.706 1.00 0.82 O ATOM 1236 CB LEU A 82 11.517 -10.045 -4.047 1.00 0.36 C ATOM 1237 CG LEU A 82 12.003 -8.897 -3.165 1.00 0.52 C ATOM 1238 CD1 LEU A 82 13.493 -8.690 -3.323 1.00 1.10 C ATOM 1239 CD2 LEU A 82 11.248 -7.618 -3.498 1.00 1.08 C ATOM 0 H LEU A 82 13.671 -11.309 -2.297 1.00 0.37 H new ATOM 0 HA LEU A 82 11.606 -12.220 -4.111 1.00 0.39 H new ATOM 0 HB2 LEU A 82 11.582 -9.728 -5.088 1.00 0.36 H new ATOM 0 HB3 LEU A 82 10.463 -10.220 -3.832 1.00 0.36 H new ATOM 0 HG LEU A 82 11.806 -9.157 -2.125 1.00 0.52 H new ATOM 0 HD11 LEU A 82 13.816 -7.867 -2.685 1.00 1.10 H new ATOM 0 HD12 LEU A 82 14.019 -9.600 -3.035 1.00 1.10 H new ATOM 0 HD13 LEU A 82 13.719 -8.453 -4.363 1.00 1.10 H new ATOM 0 HD21 LEU A 82 11.605 -6.808 -2.861 1.00 1.08 H new ATOM 0 HD22 LEU A 82 11.415 -7.358 -4.543 1.00 1.08 H new ATOM 0 HD23 LEU A 82 10.182 -7.770 -3.328 1.00 1.08 H new ATOM 1251 N LYS A 83 13.143 -10.843 -6.084 1.00 0.40 N ATOM 1252 CA LYS A 83 14.047 -10.939 -7.221 1.00 0.46 C ATOM 1253 C LYS A 83 15.413 -10.323 -6.925 1.00 0.47 C ATOM 1254 O LYS A 83 16.262 -10.950 -6.292 1.00 0.63 O ATOM 1255 CB LYS A 83 13.423 -10.264 -8.443 1.00 0.52 C ATOM 1256 CG LYS A 83 12.055 -10.814 -8.802 1.00 0.58 C ATOM 1257 CD LYS A 83 11.507 -10.182 -10.065 1.00 0.68 C ATOM 1258 CE LYS A 83 10.187 -10.818 -10.466 1.00 1.08 C ATOM 1259 NZ LYS A 83 10.317 -12.287 -10.666 1.00 1.84 N ATOM 0 H LYS A 83 12.319 -10.267 -6.254 1.00 0.40 H new ATOM 0 HA LYS A 83 14.204 -11.998 -7.425 1.00 0.46 H new ATOM 0 HB2 LYS A 83 13.338 -9.194 -8.254 1.00 0.52 H new ATOM 0 HB3 LYS A 83 14.090 -10.385 -9.296 1.00 0.52 H new ATOM 0 HG2 LYS A 83 12.121 -11.894 -8.935 1.00 0.58 H new ATOM 0 HG3 LYS A 83 11.364 -10.636 -7.978 1.00 0.58 H new ATOM 0 HD2 LYS A 83 11.366 -9.112 -9.909 1.00 0.68 H new ATOM 0 HD3 LYS A 83 12.229 -10.294 -10.874 1.00 0.68 H new ATOM 0 HE2 LYS A 83 9.441 -10.621 -9.697 1.00 1.08 H new ATOM 0 HE3 LYS A 83 9.826 -10.357 -11.385 1.00 1.08 H new ATOM 0 HZ1 LYS A 83 9.508 -12.635 -11.220 1.00 1.84 H new ATOM 0 HZ2 LYS A 83 11.200 -12.491 -11.177 1.00 1.84 H new ATOM 0 HZ3 LYS A 83 10.334 -12.763 -9.742 1.00 1.84 H new ATOM 1273 N ALA A 84 15.591 -9.078 -7.354 1.00 0.47 N ATOM 1274 CA ALA A 84 16.879 -8.410 -7.316 1.00 0.50 C ATOM 1275 C ALA A 84 16.784 -7.124 -8.110 1.00 0.58 C ATOM 1276 O ALA A 84 16.718 -7.160 -9.337 1.00 0.99 O ATOM 1277 CB ALA A 84 17.981 -9.291 -7.893 1.00 0.56 C ATOM 0 H ALA A 84 14.840 -8.505 -7.739 1.00 0.47 H new ATOM 0 HA ALA A 84 17.133 -8.199 -6.277 1.00 0.50 H new ATOM 0 HB1 ALA A 84 18.932 -8.760 -7.849 1.00 0.56 H new ATOM 0 HB2 ALA A 84 18.052 -10.211 -7.313 1.00 0.56 H new ATOM 0 HB3 ALA A 84 17.748 -9.533 -8.930 1.00 0.56 H new ATOM 1283 N LYS A 85 16.746 -6.009 -7.392 1.00 0.49 N ATOM 1284 CA LYS A 85 16.605 -4.676 -7.976 1.00 0.54 C ATOM 1285 C LYS A 85 15.494 -4.644 -9.032 1.00 0.53 C ATOM 1286 O LYS A 85 15.632 -4.057 -10.109 1.00 0.61 O ATOM 1287 CB LYS A 85 17.956 -4.171 -8.512 1.00 0.65 C ATOM 1288 CG LYS A 85 18.440 -4.841 -9.788 1.00 1.07 C ATOM 1289 CD LYS A 85 19.956 -4.793 -9.906 1.00 1.25 C ATOM 1290 CE LYS A 85 20.520 -3.422 -9.559 1.00 1.60 C ATOM 1291 NZ LYS A 85 19.931 -2.332 -10.382 1.00 1.84 N ATOM 0 H LYS A 85 16.813 -6.002 -6.374 1.00 0.49 H new ATOM 0 HA LYS A 85 16.298 -3.984 -7.192 1.00 0.54 H new ATOM 0 HB2 LYS A 85 17.879 -3.099 -8.691 1.00 0.65 H new ATOM 0 HB3 LYS A 85 18.711 -4.312 -7.738 1.00 0.65 H new ATOM 0 HG2 LYS A 85 18.106 -5.878 -9.804 1.00 1.07 H new ATOM 0 HG3 LYS A 85 17.992 -4.348 -10.651 1.00 1.07 H new ATOM 0 HD2 LYS A 85 20.393 -5.541 -9.245 1.00 1.25 H new ATOM 0 HD3 LYS A 85 20.248 -5.057 -10.923 1.00 1.25 H new ATOM 0 HE2 LYS A 85 20.337 -3.215 -8.505 1.00 1.60 H new ATOM 0 HE3 LYS A 85 21.601 -3.433 -9.698 1.00 1.60 H new ATOM 0 HZ1 LYS A 85 20.681 -1.672 -10.672 1.00 1.84 H new ATOM 0 HZ2 LYS A 85 19.482 -2.739 -11.227 1.00 1.84 H new ATOM 0 HZ3 LYS A 85 19.218 -1.822 -9.823 1.00 1.84 H new ATOM 1305 N ASP A 86 14.362 -5.233 -8.666 1.00 0.48 N ATOM 1306 CA ASP A 86 13.249 -5.419 -9.587 1.00 0.46 C ATOM 1307 C ASP A 86 11.943 -5.509 -8.799 1.00 0.40 C ATOM 1308 O ASP A 86 11.933 -5.297 -7.585 1.00 0.38 O ATOM 1309 CB ASP A 86 13.465 -6.688 -10.425 1.00 0.49 C ATOM 1310 CG ASP A 86 12.677 -6.682 -11.724 1.00 0.53 C ATOM 1311 OD1 ASP A 86 13.191 -6.155 -12.733 1.00 0.64 O ATOM 1312 OD2 ASP A 86 11.549 -7.214 -11.748 1.00 0.55 O ATOM 0 H ASP A 86 14.191 -5.593 -7.727 1.00 0.48 H new ATOM 0 HA ASP A 86 13.193 -4.567 -10.265 1.00 0.46 H new ATOM 0 HB2 ASP A 86 14.526 -6.792 -10.651 1.00 0.49 H new ATOM 0 HB3 ASP A 86 13.178 -7.559 -9.836 1.00 0.49 H new ATOM 1317 N MET A 87 10.863 -5.868 -9.477 1.00 0.39 N ATOM 1318 CA MET A 87 9.535 -5.811 -8.880 1.00 0.35 C ATOM 1319 C MET A 87 8.967 -7.212 -8.679 1.00 0.34 C ATOM 1320 O MET A 87 9.006 -8.044 -9.583 1.00 0.37 O ATOM 1321 CB MET A 87 8.594 -4.975 -9.751 1.00 0.35 C ATOM 1322 CG MET A 87 7.275 -4.649 -9.072 1.00 0.35 C ATOM 1323 SD MET A 87 6.142 -3.733 -10.138 1.00 0.41 S ATOM 1324 CE MET A 87 7.061 -2.216 -10.387 1.00 1.35 C ATOM 0 H MET A 87 10.879 -6.202 -10.441 1.00 0.39 H new ATOM 0 HA MET A 87 9.622 -5.336 -7.903 1.00 0.35 H new ATOM 0 HB2 MET A 87 9.093 -4.045 -10.024 1.00 0.35 H new ATOM 0 HB3 MET A 87 8.394 -5.513 -10.677 1.00 0.35 H new ATOM 0 HG2 MET A 87 6.797 -5.576 -8.754 1.00 0.35 H new ATOM 0 HG3 MET A 87 7.470 -4.066 -8.172 1.00 0.35 H new ATOM 0 HE1 MET A 87 6.540 -1.590 -11.111 1.00 1.35 H new ATOM 0 HE2 MET A 87 7.146 -1.682 -9.440 1.00 1.35 H new ATOM 0 HE3 MET A 87 8.057 -2.451 -10.761 1.00 1.35 H new ATOM 1334 N THR A 88 8.447 -7.457 -7.488 1.00 0.31 N ATOM 1335 CA THR A 88 7.898 -8.754 -7.120 1.00 0.30 C ATOM 1336 C THR A 88 6.441 -8.601 -6.680 1.00 0.27 C ATOM 1337 O THR A 88 6.067 -7.574 -6.121 1.00 0.27 O ATOM 1338 CB THR A 88 8.711 -9.409 -5.982 1.00 0.32 C ATOM 1339 OG1 THR A 88 8.650 -10.837 -6.103 1.00 0.77 O ATOM 1340 CG2 THR A 88 8.181 -8.984 -4.613 1.00 0.54 C ATOM 0 H THR A 88 8.393 -6.760 -6.745 1.00 0.31 H new ATOM 0 HA THR A 88 7.954 -9.398 -7.997 1.00 0.30 H new ATOM 0 HB THR A 88 9.746 -9.078 -6.066 1.00 0.32 H new ATOM 0 HG1 THR A 88 9.168 -11.249 -5.380 1.00 0.77 H new ATOM 0 HG21 THR A 88 8.772 -9.460 -3.830 1.00 0.54 H new ATOM 0 HG22 THR A 88 8.254 -7.901 -4.515 1.00 0.54 H new ATOM 0 HG23 THR A 88 7.139 -9.288 -4.516 1.00 0.54 H new ATOM 1348 N ALA A 89 5.613 -9.593 -6.954 1.00 0.27 N ATOM 1349 CA ALA A 89 4.217 -9.522 -6.557 1.00 0.28 C ATOM 1350 C ALA A 89 4.033 -10.045 -5.129 1.00 0.29 C ATOM 1351 O ALA A 89 4.617 -11.058 -4.739 1.00 0.48 O ATOM 1352 CB ALA A 89 3.336 -10.274 -7.537 1.00 0.31 C ATOM 0 H ALA A 89 5.878 -10.448 -7.444 1.00 0.27 H new ATOM 0 HA ALA A 89 3.910 -8.476 -6.572 1.00 0.28 H new ATOM 0 HB1 ALA A 89 2.296 -10.206 -7.218 1.00 0.31 H new ATOM 0 HB2 ALA A 89 3.440 -9.836 -8.530 1.00 0.31 H new ATOM 0 HB3 ALA A 89 3.638 -11.321 -7.569 1.00 0.31 H new ATOM 1358 N LEU A 90 3.225 -9.328 -4.362 1.00 0.27 N ATOM 1359 CA LEU A 90 2.982 -9.620 -2.953 1.00 0.30 C ATOM 1360 C LEU A 90 1.486 -9.454 -2.676 1.00 0.29 C ATOM 1361 O LEU A 90 0.765 -8.921 -3.521 1.00 0.32 O ATOM 1362 CB LEU A 90 3.846 -8.673 -2.098 1.00 0.35 C ATOM 1363 CG LEU A 90 3.719 -8.787 -0.575 1.00 0.40 C ATOM 1364 CD1 LEU A 90 5.077 -8.599 0.073 1.00 0.77 C ATOM 1365 CD2 LEU A 90 2.751 -7.742 -0.039 1.00 0.72 C ATOM 0 H LEU A 90 2.712 -8.515 -4.704 1.00 0.27 H new ATOM 0 HA LEU A 90 3.259 -10.643 -2.699 1.00 0.30 H new ATOM 0 HB2 LEU A 90 4.890 -8.839 -2.363 1.00 0.35 H new ATOM 0 HB3 LEU A 90 3.604 -7.648 -2.381 1.00 0.35 H new ATOM 0 HG LEU A 90 3.335 -9.779 -0.335 1.00 0.40 H new ATOM 0 HD11 LEU A 90 4.978 -8.681 1.155 1.00 0.77 H new ATOM 0 HD12 LEU A 90 5.762 -9.366 -0.288 1.00 0.77 H new ATOM 0 HD13 LEU A 90 5.468 -7.614 -0.182 1.00 0.77 H new ATOM 0 HD21 LEU A 90 2.674 -7.839 1.044 1.00 0.72 H new ATOM 0 HD22 LEU A 90 3.116 -6.746 -0.289 1.00 0.72 H new ATOM 0 HD23 LEU A 90 1.769 -7.892 -0.487 1.00 0.72 H new ATOM 1377 N ASP A 91 1.005 -9.896 -1.518 1.00 0.35 N ATOM 1378 CA ASP A 91 -0.432 -9.879 -1.257 1.00 0.43 C ATOM 1379 C ASP A 91 -0.776 -9.290 0.105 1.00 0.43 C ATOM 1380 O ASP A 91 -0.077 -9.513 1.095 1.00 0.52 O ATOM 1381 CB ASP A 91 -1.026 -11.289 -1.365 1.00 0.63 C ATOM 1382 CG ASP A 91 -1.125 -11.776 -2.796 1.00 1.07 C ATOM 1383 OD1 ASP A 91 -2.096 -11.409 -3.488 1.00 1.67 O ATOM 1384 OD2 ASP A 91 -0.244 -12.539 -3.235 1.00 1.81 O ATOM 0 H ASP A 91 1.576 -10.264 -0.757 1.00 0.35 H new ATOM 0 HA ASP A 91 -0.870 -9.235 -2.020 1.00 0.43 H new ATOM 0 HB2 ASP A 91 -0.411 -11.982 -0.792 1.00 0.63 H new ATOM 0 HB3 ASP A 91 -2.018 -11.296 -0.914 1.00 0.63 H new ATOM 1389 N ILE A 92 -1.859 -8.524 0.123 1.00 0.39 N ATOM 1390 CA ILE A 92 -2.446 -7.998 1.350 1.00 0.38 C ATOM 1391 C ILE A 92 -3.784 -8.694 1.573 1.00 0.38 C ATOM 1392 O ILE A 92 -4.460 -9.000 0.592 1.00 0.54 O ATOM 1393 CB ILE A 92 -2.680 -6.469 1.242 1.00 0.43 C ATOM 1394 CG1 ILE A 92 -1.386 -5.744 0.860 1.00 0.52 C ATOM 1395 CG2 ILE A 92 -3.241 -5.893 2.534 1.00 0.52 C ATOM 1396 CD1 ILE A 92 -0.229 -6.008 1.799 1.00 0.65 C ATOM 0 H ILE A 92 -2.360 -8.247 -0.721 1.00 0.39 H new ATOM 0 HA ILE A 92 -1.765 -8.182 2.181 1.00 0.38 H new ATOM 0 HB ILE A 92 -3.417 -6.311 0.455 1.00 0.43 H new ATOM 0 HG12 ILE A 92 -1.098 -6.044 -0.147 1.00 0.52 H new ATOM 0 HG13 ILE A 92 -1.578 -4.672 0.830 1.00 0.52 H new ATOM 0 HG21 ILE A 92 -3.391 -4.820 2.419 1.00 0.52 H new ATOM 0 HG22 ILE A 92 -4.194 -6.370 2.762 1.00 0.52 H new ATOM 0 HG23 ILE A 92 -2.540 -6.076 3.348 1.00 0.52 H new ATOM 0 HD11 ILE A 92 0.649 -5.458 1.459 1.00 0.65 H new ATOM 0 HD12 ILE A 92 -0.494 -5.681 2.804 1.00 0.65 H new ATOM 0 HD13 ILE A 92 -0.007 -7.075 1.811 1.00 0.65 H new ATOM 1408 N PRO A 93 -4.156 -8.989 2.844 1.00 0.41 N ATOM 1409 CA PRO A 93 -5.459 -9.597 3.201 1.00 0.55 C ATOM 1410 C PRO A 93 -6.677 -8.889 2.577 1.00 0.61 C ATOM 1411 O PRO A 93 -6.798 -8.809 1.364 1.00 1.07 O ATOM 1412 CB PRO A 93 -5.488 -9.468 4.725 1.00 0.67 C ATOM 1413 CG PRO A 93 -4.058 -9.498 5.131 1.00 0.70 C ATOM 1414 CD PRO A 93 -3.304 -8.796 4.035 1.00 0.52 C ATOM 0 HA PRO A 93 -5.534 -10.618 2.826 1.00 0.55 H new ATOM 0 HB2 PRO A 93 -5.969 -8.540 5.035 1.00 0.67 H new ATOM 0 HB3 PRO A 93 -6.047 -10.285 5.181 1.00 0.67 H new ATOM 0 HG2 PRO A 93 -3.913 -8.997 6.088 1.00 0.70 H new ATOM 0 HG3 PRO A 93 -3.708 -10.523 5.252 1.00 0.70 H new ATOM 0 HD2 PRO A 93 -3.163 -7.739 4.260 1.00 0.52 H new ATOM 0 HD3 PRO A 93 -2.313 -9.226 3.892 1.00 0.52 H new ATOM 1422 N VAL A 94 -7.600 -8.400 3.412 1.00 0.38 N ATOM 1423 CA VAL A 94 -8.820 -7.767 2.912 1.00 0.34 C ATOM 1424 C VAL A 94 -9.438 -6.817 3.948 1.00 0.34 C ATOM 1425 O VAL A 94 -10.365 -7.200 4.635 1.00 0.36 O ATOM 1426 CB VAL A 94 -9.883 -8.857 2.569 1.00 0.36 C ATOM 1427 CG1 VAL A 94 -9.666 -9.470 1.195 1.00 0.42 C ATOM 1428 CG2 VAL A 94 -9.871 -9.961 3.622 1.00 0.46 C ATOM 0 H VAL A 94 -7.525 -8.431 4.429 1.00 0.38 H new ATOM 0 HA VAL A 94 -8.542 -7.197 2.025 1.00 0.34 H new ATOM 0 HB VAL A 94 -10.852 -8.358 2.562 1.00 0.36 H new ATOM 0 HG11 VAL A 94 -10.432 -10.222 1.007 1.00 0.42 H new ATOM 0 HG12 VAL A 94 -9.728 -8.691 0.435 1.00 0.42 H new ATOM 0 HG13 VAL A 94 -8.682 -9.937 1.156 1.00 0.42 H new ATOM 0 HG21 VAL A 94 -10.618 -10.714 3.369 1.00 0.46 H new ATOM 0 HG22 VAL A 94 -8.885 -10.424 3.652 1.00 0.46 H new ATOM 0 HG23 VAL A 94 -10.102 -9.535 4.598 1.00 0.46 H new ATOM 1438 N VAL A 95 -9.051 -5.540 3.973 1.00 0.35 N ATOM 1439 CA VAL A 95 -9.449 -4.698 5.113 1.00 0.35 C ATOM 1440 C VAL A 95 -10.143 -3.375 4.746 1.00 0.36 C ATOM 1441 O VAL A 95 -9.511 -2.394 4.367 1.00 0.44 O ATOM 1442 CB VAL A 95 -8.241 -4.394 6.033 1.00 0.42 C ATOM 1443 CG1 VAL A 95 -7.151 -3.608 5.305 1.00 0.48 C ATOM 1444 CG2 VAL A 95 -8.711 -3.651 7.268 1.00 0.45 C ATOM 0 H VAL A 95 -8.490 -5.079 3.257 1.00 0.35 H new ATOM 0 HA VAL A 95 -10.194 -5.300 5.634 1.00 0.35 H new ATOM 0 HB VAL A 95 -7.798 -5.344 6.334 1.00 0.42 H new ATOM 0 HG11 VAL A 95 -6.323 -3.417 5.988 1.00 0.48 H new ATOM 0 HG12 VAL A 95 -6.793 -4.186 4.453 1.00 0.48 H new ATOM 0 HG13 VAL A 95 -7.559 -2.660 4.954 1.00 0.48 H new ATOM 0 HG21 VAL A 95 -7.858 -3.439 7.912 1.00 0.45 H new ATOM 0 HG22 VAL A 95 -9.183 -2.714 6.971 1.00 0.45 H new ATOM 0 HG23 VAL A 95 -9.431 -4.264 7.810 1.00 0.45 H new ATOM 1454 N VAL A 96 -11.452 -3.343 4.871 1.00 0.34 N ATOM 1455 CA VAL A 96 -12.170 -2.079 4.880 1.00 0.34 C ATOM 1456 C VAL A 96 -13.447 -2.196 5.707 1.00 0.36 C ATOM 1457 O VAL A 96 -14.455 -2.720 5.241 1.00 0.47 O ATOM 1458 CB VAL A 96 -12.456 -1.543 3.453 1.00 0.45 C ATOM 1459 CG1 VAL A 96 -12.862 -2.657 2.508 1.00 1.02 C ATOM 1460 CG2 VAL A 96 -13.516 -0.451 3.489 1.00 1.07 C ATOM 0 H VAL A 96 -12.041 -4.170 4.967 1.00 0.34 H new ATOM 0 HA VAL A 96 -11.522 -1.341 5.352 1.00 0.34 H new ATOM 0 HB VAL A 96 -11.530 -1.112 3.072 1.00 0.45 H new ATOM 0 HG11 VAL A 96 -13.054 -2.243 1.518 1.00 1.02 H new ATOM 0 HG12 VAL A 96 -12.059 -3.391 2.444 1.00 1.02 H new ATOM 0 HG13 VAL A 96 -13.766 -3.139 2.881 1.00 1.02 H new ATOM 0 HG21 VAL A 96 -13.701 -0.090 2.477 1.00 1.07 H new ATOM 0 HG22 VAL A 96 -14.440 -0.854 3.905 1.00 1.07 H new ATOM 0 HG23 VAL A 96 -13.168 0.374 4.111 1.00 1.07 H new ATOM 1470 N PRO A 97 -13.413 -1.741 6.968 1.00 0.34 N ATOM 1471 CA PRO A 97 -14.586 -1.777 7.837 1.00 0.36 C ATOM 1472 C PRO A 97 -15.791 -1.125 7.172 1.00 0.33 C ATOM 1473 O PRO A 97 -15.681 -0.038 6.595 1.00 0.34 O ATOM 1474 CB PRO A 97 -14.149 -0.988 9.073 1.00 0.41 C ATOM 1475 CG PRO A 97 -12.662 -1.083 9.081 1.00 0.48 C ATOM 1476 CD PRO A 97 -12.238 -1.162 7.640 1.00 0.36 C ATOM 0 HA PRO A 97 -14.899 -2.794 8.072 1.00 0.36 H new ATOM 0 HB2 PRO A 97 -14.479 0.049 9.017 1.00 0.41 H new ATOM 0 HB3 PRO A 97 -14.577 -1.409 9.983 1.00 0.41 H new ATOM 0 HG2 PRO A 97 -12.219 -0.215 9.570 1.00 0.48 H new ATOM 0 HG3 PRO A 97 -12.331 -1.963 9.633 1.00 0.48 H new ATOM 0 HD2 PRO A 97 -11.991 -0.179 7.240 1.00 0.36 H new ATOM 0 HD3 PRO A 97 -11.355 -1.788 7.515 1.00 0.36 H new ATOM 1484 N TYR A 98 -16.937 -1.792 7.253 1.00 0.35 N ATOM 1485 CA TYR A 98 -18.138 -1.351 6.552 1.00 0.37 C ATOM 1486 C TYR A 98 -18.519 0.074 6.951 1.00 0.36 C ATOM 1487 O TYR A 98 -18.999 0.840 6.125 1.00 0.39 O ATOM 1488 CB TYR A 98 -19.294 -2.338 6.814 1.00 0.47 C ATOM 1489 CG TYR A 98 -20.632 -1.918 6.232 1.00 0.60 C ATOM 1490 CD1 TYR A 98 -20.697 -1.272 5.005 1.00 1.04 C ATOM 1491 CD2 TYR A 98 -21.827 -2.183 6.897 1.00 0.90 C ATOM 1492 CE1 TYR A 98 -21.910 -0.905 4.453 1.00 1.23 C ATOM 1493 CE2 TYR A 98 -23.042 -1.815 6.353 1.00 1.06 C ATOM 1494 CZ TYR A 98 -23.091 -1.120 5.205 1.00 1.08 C ATOM 1495 OH TYR A 98 -24.289 -0.830 4.577 1.00 1.31 O ATOM 0 H TYR A 98 -17.060 -2.644 7.800 1.00 0.35 H new ATOM 0 HA TYR A 98 -17.932 -1.340 5.482 1.00 0.37 H new ATOM 0 HB2 TYR A 98 -19.024 -3.310 6.403 1.00 0.47 H new ATOM 0 HB3 TYR A 98 -19.406 -2.467 7.890 1.00 0.47 H new ATOM 0 HD1 TYR A 98 -19.784 -1.052 4.472 1.00 1.04 H new ATOM 0 HD2 TYR A 98 -21.803 -2.684 7.853 1.00 0.90 H new ATOM 0 HE1 TYR A 98 -21.956 -0.463 3.469 1.00 1.23 H new ATOM 0 HE2 TYR A 98 -23.959 -2.088 6.854 1.00 1.06 H new ATOM 0 HH TYR A 98 -25.032 -1.017 5.188 1.00 1.31 H new ATOM 1505 N SER A 99 -18.259 0.439 8.198 1.00 0.37 N ATOM 1506 CA SER A 99 -18.586 1.774 8.685 1.00 0.41 C ATOM 1507 C SER A 99 -17.903 2.867 7.859 1.00 0.38 C ATOM 1508 O SER A 99 -18.455 3.949 7.676 1.00 0.39 O ATOM 1509 CB SER A 99 -18.186 1.913 10.154 1.00 0.50 C ATOM 1510 OG SER A 99 -18.791 0.901 10.944 1.00 1.20 O ATOM 0 H SER A 99 -17.823 -0.169 8.891 1.00 0.37 H new ATOM 0 HA SER A 99 -19.664 1.902 8.584 1.00 0.41 H new ATOM 0 HB2 SER A 99 -17.102 1.852 10.247 1.00 0.50 H new ATOM 0 HB3 SER A 99 -18.483 2.894 10.524 1.00 0.50 H new ATOM 0 HG SER A 99 -18.519 1.010 11.879 1.00 1.20 H new ATOM 1516 N ILE A 100 -16.717 2.583 7.337 1.00 0.36 N ATOM 1517 CA ILE A 100 -15.953 3.607 6.636 1.00 0.37 C ATOM 1518 C ILE A 100 -16.518 3.839 5.239 1.00 0.34 C ATOM 1519 O ILE A 100 -16.873 4.963 4.876 1.00 0.36 O ATOM 1520 CB ILE A 100 -14.471 3.221 6.503 1.00 0.41 C ATOM 1521 CG1 ILE A 100 -13.950 2.562 7.786 1.00 0.45 C ATOM 1522 CG2 ILE A 100 -13.662 4.459 6.178 1.00 0.48 C ATOM 1523 CD1 ILE A 100 -14.093 3.421 9.025 1.00 0.51 C ATOM 0 H ILE A 100 -16.269 1.668 7.384 1.00 0.36 H new ATOM 0 HA ILE A 100 -16.032 4.518 7.229 1.00 0.37 H new ATOM 0 HB ILE A 100 -14.369 2.494 5.697 1.00 0.41 H new ATOM 0 HG12 ILE A 100 -14.484 1.625 7.943 1.00 0.45 H new ATOM 0 HG13 ILE A 100 -12.898 2.310 7.651 1.00 0.45 H new ATOM 0 HG21 ILE A 100 -12.610 4.191 6.082 1.00 0.48 H new ATOM 0 HG22 ILE A 100 -14.014 4.888 5.240 1.00 0.48 H new ATOM 0 HG23 ILE A 100 -13.779 5.190 6.978 1.00 0.48 H new ATOM 0 HD11 ILE A 100 -13.701 2.883 9.888 1.00 0.51 H new ATOM 0 HD12 ILE A 100 -13.535 4.348 8.892 1.00 0.51 H new ATOM 0 HD13 ILE A 100 -15.146 3.652 9.188 1.00 0.51 H new ATOM 1535 N LEU A 101 -16.583 2.754 4.470 1.00 0.33 N ATOM 1536 CA LEU A 101 -17.260 2.733 3.167 1.00 0.34 C ATOM 1537 C LEU A 101 -18.673 3.290 3.289 1.00 0.34 C ATOM 1538 O LEU A 101 -19.200 3.910 2.373 1.00 0.36 O ATOM 1539 CB LEU A 101 -17.290 1.307 2.613 1.00 0.35 C ATOM 1540 CG LEU A 101 -16.472 1.099 1.339 1.00 0.41 C ATOM 1541 CD1 LEU A 101 -16.235 -0.375 1.087 1.00 0.89 C ATOM 1542 CD2 LEU A 101 -17.183 1.713 0.145 1.00 1.00 C ATOM 0 H LEU A 101 -16.167 1.860 4.730 1.00 0.33 H new ATOM 0 HA LEU A 101 -16.704 3.365 2.474 1.00 0.34 H new ATOM 0 HB2 LEU A 101 -16.922 0.626 3.380 1.00 0.35 H new ATOM 0 HB3 LEU A 101 -18.325 1.031 2.413 1.00 0.35 H new ATOM 0 HG LEU A 101 -15.509 1.592 1.474 1.00 0.41 H new ATOM 0 HD11 LEU A 101 -15.651 -0.499 0.175 1.00 0.89 H new ATOM 0 HD12 LEU A 101 -15.691 -0.805 1.928 1.00 0.89 H new ATOM 0 HD13 LEU A 101 -17.193 -0.884 0.976 1.00 0.89 H new ATOM 0 HD21 LEU A 101 -16.587 1.556 -0.754 1.00 1.00 H new ATOM 0 HD22 LEU A 101 -18.158 1.242 0.021 1.00 1.00 H new ATOM 0 HD23 LEU A 101 -17.315 2.782 0.310 1.00 1.00 H new ATOM 1554 N PHE A 102 -19.210 3.133 4.476 1.00 0.34 N ATOM 1555 CA PHE A 102 -20.558 3.574 4.769 1.00 0.36 C ATOM 1556 C PHE A 102 -20.610 5.092 4.670 1.00 0.35 C ATOM 1557 O PHE A 102 -21.569 5.663 4.169 1.00 0.36 O ATOM 1558 CB PHE A 102 -20.998 3.104 6.155 1.00 0.42 C ATOM 1559 CG PHE A 102 -22.448 3.349 6.446 1.00 0.57 C ATOM 1560 CD1 PHE A 102 -23.421 2.515 5.927 1.00 0.74 C ATOM 1561 CD2 PHE A 102 -22.838 4.420 7.233 1.00 0.80 C ATOM 1562 CE1 PHE A 102 -24.757 2.741 6.187 1.00 0.90 C ATOM 1563 CE2 PHE A 102 -24.174 4.654 7.497 1.00 0.96 C ATOM 1564 CZ PHE A 102 -25.132 3.796 6.999 1.00 0.94 C ATOM 0 H PHE A 102 -18.730 2.698 5.264 1.00 0.34 H new ATOM 0 HA PHE A 102 -21.247 3.138 4.045 1.00 0.36 H new ATOM 0 HB2 PHE A 102 -20.794 2.037 6.248 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -20.395 3.611 6.908 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -23.132 1.677 5.311 1.00 0.74 H new ATOM 0 HD2 PHE A 102 -22.089 5.080 7.645 1.00 0.80 H new ATOM 0 HE1 PHE A 102 -25.509 2.095 5.757 1.00 0.90 H new ATOM 0 HE2 PHE A 102 -24.467 5.506 8.092 1.00 0.96 H new ATOM 0 HZ PHE A 102 -26.173 3.948 7.243 1.00 0.94 H new ATOM 1574 N ASN A 103 -19.551 5.740 5.135 1.00 0.36 N ATOM 1575 CA ASN A 103 -19.450 7.193 5.069 1.00 0.38 C ATOM 1576 C ASN A 103 -19.154 7.676 3.651 1.00 0.36 C ATOM 1577 O ASN A 103 -19.907 8.467 3.085 1.00 0.38 O ATOM 1578 CB ASN A 103 -18.341 7.680 5.996 1.00 0.43 C ATOM 1579 CG ASN A 103 -18.729 7.688 7.463 1.00 0.49 C ATOM 1580 OD1 ASN A 103 -19.249 8.680 7.970 1.00 0.82 O ATOM 1581 ND2 ASN A 103 -18.469 6.596 8.162 1.00 0.49 N ATOM 0 H ASN A 103 -18.747 5.282 5.563 1.00 0.36 H new ATOM 0 HA ASN A 103 -20.412 7.601 5.380 1.00 0.38 H new ATOM 0 HB2 ASN A 103 -17.465 7.044 5.865 1.00 0.43 H new ATOM 0 HB3 ASN A 103 -18.050 8.688 5.701 1.00 0.43 H new ATOM 0 HD21 ASN A 103 -18.701 6.559 9.155 1.00 0.49 H new ATOM 0 HD22 ASN A 103 -18.037 5.791 7.709 1.00 0.49 H new ATOM 1588 N LEU A 104 -18.050 7.202 3.083 1.00 0.36 N ATOM 1589 CA LEU A 104 -17.625 7.625 1.749 1.00 0.39 C ATOM 1590 C LEU A 104 -18.629 7.265 0.641 1.00 0.37 C ATOM 1591 O LEU A 104 -19.013 8.130 -0.140 1.00 0.40 O ATOM 1592 CB LEU A 104 -16.246 7.046 1.449 1.00 0.45 C ATOM 1593 CG LEU A 104 -16.112 5.549 1.677 1.00 0.51 C ATOM 1594 CD1 LEU A 104 -16.112 4.811 0.354 1.00 0.55 C ATOM 1595 CD2 LEU A 104 -14.859 5.249 2.477 1.00 0.65 C ATOM 0 H LEU A 104 -17.431 6.523 3.525 1.00 0.36 H new ATOM 0 HA LEU A 104 -17.577 8.714 1.755 1.00 0.39 H new ATOM 0 HB2 LEU A 104 -15.996 7.264 0.411 1.00 0.45 H new ATOM 0 HB3 LEU A 104 -15.511 7.560 2.069 1.00 0.45 H new ATOM 0 HG LEU A 104 -16.969 5.201 2.253 1.00 0.51 H new ATOM 0 HD11 LEU A 104 -16.015 3.740 0.535 1.00 0.55 H new ATOM 0 HD12 LEU A 104 -17.046 5.007 -0.172 1.00 0.55 H new ATOM 0 HD13 LEU A 104 -15.274 5.154 -0.254 1.00 0.55 H new ATOM 0 HD21 LEU A 104 -14.776 4.173 2.633 1.00 0.65 H new ATOM 0 HD22 LEU A 104 -13.985 5.605 1.932 1.00 0.65 H new ATOM 0 HD23 LEU A 104 -14.914 5.752 3.442 1.00 0.65 H new ATOM 1607 N ALA A 105 -19.055 6.006 0.569 1.00 0.35 N ATOM 1608 CA ALA A 105 -19.995 5.568 -0.472 1.00 0.38 C ATOM 1609 C ALA A 105 -21.357 6.217 -0.269 1.00 0.37 C ATOM 1610 O ALA A 105 -22.154 6.342 -1.187 1.00 0.39 O ATOM 1611 CB ALA A 105 -20.122 4.057 -0.490 1.00 0.43 C ATOM 0 H ALA A 105 -18.768 5.270 1.214 1.00 0.35 H new ATOM 0 HA ALA A 105 -19.601 5.885 -1.438 1.00 0.38 H new ATOM 0 HB1 ALA A 105 -20.824 3.760 -1.270 1.00 0.43 H new ATOM 0 HB2 ALA A 105 -19.147 3.612 -0.691 1.00 0.43 H new ATOM 0 HB3 ALA A 105 -20.487 3.711 0.477 1.00 0.43 H new ATOM 1617 N ARG A 106 -21.612 6.592 0.960 1.00 0.36 N ATOM 1618 CA ARG A 106 -22.791 7.383 1.264 1.00 0.40 C ATOM 1619 C ARG A 106 -22.762 8.691 0.484 1.00 0.38 C ATOM 1620 O ARG A 106 -23.719 9.039 -0.198 1.00 0.40 O ATOM 1621 CB ARG A 106 -22.867 7.694 2.739 1.00 0.48 C ATOM 1622 CG ARG A 106 -23.910 8.731 3.102 1.00 0.53 C ATOM 1623 CD ARG A 106 -23.654 9.260 4.496 1.00 0.73 C ATOM 1624 NE ARG A 106 -22.848 8.315 5.260 1.00 0.91 N ATOM 1625 CZ ARG A 106 -22.520 8.467 6.534 1.00 1.38 C ATOM 1626 NH1 ARG A 106 -22.888 9.557 7.199 1.00 1.52 N ATOM 1627 NH2 ARG A 106 -21.794 7.533 7.126 1.00 1.81 N ATOM 0 H ARG A 106 -21.027 6.367 1.765 1.00 0.36 H new ATOM 0 HA ARG A 106 -23.666 6.800 0.977 1.00 0.40 H new ATOM 0 HB2 ARG A 106 -23.081 6.774 3.282 1.00 0.48 H new ATOM 0 HB3 ARG A 106 -21.891 8.043 3.076 1.00 0.48 H new ATOM 0 HG2 ARG A 106 -23.885 9.550 2.383 1.00 0.53 H new ATOM 0 HG3 ARG A 106 -24.906 8.291 3.049 1.00 0.53 H new ATOM 0 HD2 ARG A 106 -23.142 10.221 4.439 1.00 0.73 H new ATOM 0 HD3 ARG A 106 -24.602 9.434 5.005 1.00 0.73 H new ATOM 0 HE ARG A 106 -22.514 7.479 4.780 1.00 0.91 H new ATOM 0 HH11 ARG A 106 -23.427 10.284 6.728 1.00 1.52 H new ATOM 0 HH12 ARG A 106 -22.632 9.667 8.180 1.00 1.52 H new ATOM 0 HH21 ARG A 106 -21.495 6.711 6.602 1.00 1.81 H new ATOM 0 HH22 ARG A 106 -21.533 7.635 8.107 1.00 1.81 H new ATOM 1641 N ASP A 107 -21.654 9.404 0.595 1.00 0.37 N ATOM 1642 CA ASP A 107 -21.531 10.736 0.012 1.00 0.41 C ATOM 1643 C ASP A 107 -21.164 10.679 -1.471 1.00 0.38 C ATOM 1644 O ASP A 107 -21.829 11.274 -2.326 1.00 0.41 O ATOM 1645 CB ASP A 107 -20.475 11.520 0.794 1.00 0.46 C ATOM 1646 CG ASP A 107 -20.249 12.922 0.263 1.00 0.57 C ATOM 1647 OD1 ASP A 107 -21.007 13.836 0.641 1.00 0.80 O ATOM 1648 OD2 ASP A 107 -19.327 13.106 -0.561 1.00 0.68 O ATOM 0 H ASP A 107 -20.820 9.083 1.086 1.00 0.37 H new ATOM 0 HA ASP A 107 -22.497 11.236 0.080 1.00 0.41 H new ATOM 0 HB2 ASP A 107 -20.778 11.580 1.839 1.00 0.46 H new ATOM 0 HB3 ASP A 107 -19.533 10.973 0.766 1.00 0.46 H new ATOM 1653 N VAL A 108 -20.126 9.936 -1.791 1.00 0.34 N ATOM 1654 CA VAL A 108 -19.641 9.894 -3.156 1.00 0.33 C ATOM 1655 C VAL A 108 -20.388 8.833 -3.953 1.00 0.32 C ATOM 1656 O VAL A 108 -20.490 8.926 -5.163 1.00 0.37 O ATOM 1657 CB VAL A 108 -18.124 9.637 -3.211 1.00 0.32 C ATOM 1658 CG1 VAL A 108 -17.559 10.063 -4.554 1.00 0.77 C ATOM 1659 CG2 VAL A 108 -17.412 10.364 -2.083 1.00 0.88 C ATOM 0 H VAL A 108 -19.605 9.357 -1.132 1.00 0.34 H new ATOM 0 HA VAL A 108 -19.828 10.870 -3.604 1.00 0.33 H new ATOM 0 HB VAL A 108 -17.957 8.567 -3.088 1.00 0.32 H new ATOM 0 HG11 VAL A 108 -16.486 9.874 -4.574 1.00 0.77 H new ATOM 0 HG12 VAL A 108 -18.042 9.495 -5.349 1.00 0.77 H new ATOM 0 HG13 VAL A 108 -17.743 11.127 -4.705 1.00 0.77 H new ATOM 0 HG21 VAL A 108 -16.341 10.168 -2.142 1.00 0.88 H new ATOM 0 HG22 VAL A 108 -17.590 11.436 -2.172 1.00 0.88 H new ATOM 0 HG23 VAL A 108 -17.793 10.011 -1.125 1.00 0.88 H new ATOM 1669 N GLY A 109 -20.876 7.808 -3.266 1.00 0.29 N ATOM 1670 CA GLY A 109 -21.780 6.850 -3.896 1.00 0.30 C ATOM 1671 C GLY A 109 -23.172 7.427 -4.076 1.00 0.33 C ATOM 1672 O GLY A 109 -23.979 6.921 -4.858 1.00 0.38 O ATOM 0 H GLY A 109 -20.666 7.618 -2.286 1.00 0.29 H new ATOM 0 HA2 GLY A 109 -21.380 6.556 -4.866 1.00 0.30 H new ATOM 0 HA3 GLY A 109 -21.836 5.948 -3.287 1.00 0.30 H new ATOM 1676 N VAL A 110 -23.446 8.462 -3.288 1.00 0.37 N ATOM 1677 CA VAL A 110 -24.575 9.342 -3.572 1.00 0.46 C ATOM 1678 C VAL A 110 -24.484 9.715 -5.052 1.00 0.47 C ATOM 1679 O VAL A 110 -25.474 9.666 -5.787 1.00 0.54 O ATOM 1680 CB VAL A 110 -24.609 10.605 -2.674 1.00 0.56 C ATOM 1681 CG1 VAL A 110 -24.635 11.893 -3.488 1.00 1.09 C ATOM 1682 CG2 VAL A 110 -25.808 10.554 -1.739 1.00 0.78 C ATOM 0 H VAL A 110 -22.909 8.710 -2.457 1.00 0.37 H new ATOM 0 HA VAL A 110 -25.505 8.819 -3.349 1.00 0.46 H new ATOM 0 HB VAL A 110 -23.690 10.609 -2.088 1.00 0.56 H new ATOM 0 HG11 VAL A 110 -24.658 12.749 -2.814 1.00 1.09 H new ATOM 0 HG12 VAL A 110 -23.743 11.947 -4.112 1.00 1.09 H new ATOM 0 HG13 VAL A 110 -25.522 11.905 -4.121 1.00 1.09 H new ATOM 0 HG21 VAL A 110 -25.820 11.447 -1.114 1.00 0.78 H new ATOM 0 HG22 VAL A 110 -26.725 10.509 -2.326 1.00 0.78 H new ATOM 0 HG23 VAL A 110 -25.739 9.669 -1.106 1.00 0.78 H new ATOM 1692 N ASP A 111 -23.273 10.085 -5.478 1.00 0.45 N ATOM 1693 CA ASP A 111 -22.927 10.060 -6.901 1.00 0.52 C ATOM 1694 C ASP A 111 -22.897 8.600 -7.386 1.00 0.59 C ATOM 1695 O ASP A 111 -23.930 8.076 -7.805 1.00 1.05 O ATOM 1696 CB ASP A 111 -21.586 10.787 -7.145 1.00 0.60 C ATOM 1697 CG ASP A 111 -20.998 10.592 -8.526 1.00 1.30 C ATOM 1698 OD1 ASP A 111 -21.469 11.251 -9.476 1.00 1.86 O ATOM 1699 OD2 ASP A 111 -20.090 9.746 -8.672 1.00 1.87 O ATOM 0 H ASP A 111 -22.523 10.402 -4.864 1.00 0.45 H new ATOM 0 HA ASP A 111 -23.682 10.594 -7.478 1.00 0.52 H new ATOM 0 HB2 ASP A 111 -21.732 11.854 -6.975 1.00 0.60 H new ATOM 0 HB3 ASP A 111 -20.863 10.442 -6.406 1.00 0.60 H new ATOM 1704 N TRP A 112 -21.729 7.952 -7.305 1.00 0.43 N ATOM 1705 CA TRP A 112 -21.572 6.517 -7.623 1.00 0.45 C ATOM 1706 C TRP A 112 -20.094 6.107 -7.618 1.00 0.42 C ATOM 1707 O TRP A 112 -19.729 5.068 -7.070 1.00 0.43 O ATOM 1708 CB TRP A 112 -22.192 6.143 -8.989 1.00 0.57 C ATOM 1709 CG TRP A 112 -21.738 7.007 -10.121 1.00 0.64 C ATOM 1710 CD1 TRP A 112 -22.079 8.303 -10.361 1.00 0.72 C ATOM 1711 CD2 TRP A 112 -20.872 6.620 -11.174 1.00 0.78 C ATOM 1712 NE1 TRP A 112 -21.428 8.766 -11.468 1.00 0.83 N ATOM 1713 CE2 TRP A 112 -20.688 7.738 -12.003 1.00 0.86 C ATOM 1714 CE3 TRP A 112 -20.227 5.429 -11.478 1.00 0.96 C ATOM 1715 CZ2 TRP A 112 -19.869 7.694 -13.129 1.00 1.04 C ATOM 1716 CZ3 TRP A 112 -19.418 5.381 -12.596 1.00 1.16 C ATOM 1717 CH2 TRP A 112 -19.243 6.506 -13.411 1.00 1.17 C ATOM 0 H TRP A 112 -20.861 8.404 -7.017 1.00 0.43 H new ATOM 0 HA TRP A 112 -22.107 5.976 -6.843 1.00 0.45 H new ATOM 0 HB2 TRP A 112 -21.946 5.106 -9.216 1.00 0.57 H new ATOM 0 HB3 TRP A 112 -23.278 6.204 -8.912 1.00 0.57 H new ATOM 0 HD1 TRP A 112 -22.766 8.882 -9.762 1.00 0.72 H new ATOM 0 HE1 TRP A 112 -21.482 9.716 -11.837 1.00 0.83 H new ATOM 0 HE3 TRP A 112 -20.355 4.558 -10.853 1.00 0.96 H new ATOM 0 HZ2 TRP A 112 -19.732 8.562 -13.756 1.00 1.04 H new ATOM 0 HZ3 TRP A 112 -18.912 4.460 -12.846 1.00 1.16 H new ATOM 0 HH2 TRP A 112 -18.603 6.437 -14.278 1.00 1.17 H new ATOM 1728 N ASP A 113 -19.261 6.916 -8.254 1.00 0.42 N ATOM 1729 CA ASP A 113 -17.844 6.587 -8.426 1.00 0.42 C ATOM 1730 C ASP A 113 -16.988 7.252 -7.353 1.00 0.40 C ATOM 1731 O ASP A 113 -17.074 8.462 -7.151 1.00 0.50 O ATOM 1732 CB ASP A 113 -17.390 7.035 -9.820 1.00 0.51 C ATOM 1733 CG ASP A 113 -16.017 6.522 -10.207 1.00 1.26 C ATOM 1734 OD1 ASP A 113 -15.925 5.399 -10.751 1.00 2.15 O ATOM 1735 OD2 ASP A 113 -15.021 7.220 -9.922 1.00 1.61 O ATOM 0 H ASP A 113 -19.537 7.809 -8.663 1.00 0.42 H new ATOM 0 HA ASP A 113 -17.720 5.509 -8.326 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -18.117 6.693 -10.557 1.00 0.51 H new ATOM 0 HB3 ASP A 113 -17.385 8.124 -9.858 1.00 0.51 H new ATOM 1740 N ILE A 114 -16.164 6.465 -6.657 1.00 0.32 N ATOM 1741 CA ILE A 114 -15.319 7.000 -5.593 1.00 0.32 C ATOM 1742 C ILE A 114 -13.857 6.643 -5.867 1.00 0.32 C ATOM 1743 O ILE A 114 -13.567 5.707 -6.612 1.00 0.33 O ATOM 1744 CB ILE A 114 -15.722 6.494 -4.167 1.00 0.31 C ATOM 1745 CG1 ILE A 114 -17.240 6.508 -3.975 1.00 0.39 C ATOM 1746 CG2 ILE A 114 -15.063 7.346 -3.095 1.00 0.33 C ATOM 1747 CD1 ILE A 114 -17.921 5.280 -4.527 1.00 0.38 C ATOM 0 H ILE A 114 -16.066 5.462 -6.812 1.00 0.32 H new ATOM 0 HA ILE A 114 -15.459 8.081 -5.596 1.00 0.32 H new ATOM 0 HB ILE A 114 -15.375 5.465 -4.075 1.00 0.31 H new ATOM 0 HG12 ILE A 114 -17.464 6.593 -2.912 1.00 0.39 H new ATOM 0 HG13 ILE A 114 -17.653 7.393 -4.459 1.00 0.39 H new ATOM 0 HG21 ILE A 114 -15.354 6.981 -2.110 1.00 0.33 H new ATOM 0 HG22 ILE A 114 -13.980 7.287 -3.199 1.00 0.33 H new ATOM 0 HG23 ILE A 114 -15.382 8.382 -3.206 1.00 0.33 H new ATOM 0 HD11 ILE A 114 -18.995 5.353 -4.358 1.00 0.38 H new ATOM 0 HD12 ILE A 114 -17.726 5.206 -5.597 1.00 0.38 H new ATOM 0 HD13 ILE A 114 -17.534 4.393 -4.025 1.00 0.38 H new ATOM 1759 N ASP A 115 -12.951 7.400 -5.268 1.00 0.35 N ATOM 1760 CA ASP A 115 -11.517 7.169 -5.404 1.00 0.38 C ATOM 1761 C ASP A 115 -11.045 6.380 -4.199 1.00 0.34 C ATOM 1762 O ASP A 115 -11.706 6.389 -3.162 1.00 0.31 O ATOM 1763 CB ASP A 115 -10.753 8.496 -5.489 1.00 0.46 C ATOM 1764 CG ASP A 115 -9.255 8.323 -5.722 1.00 1.27 C ATOM 1765 OD1 ASP A 115 -8.840 8.177 -6.886 1.00 2.11 O ATOM 1766 OD2 ASP A 115 -8.489 8.297 -4.739 1.00 1.36 O ATOM 0 H ASP A 115 -13.187 8.194 -4.672 1.00 0.35 H new ATOM 0 HA ASP A 115 -11.326 6.614 -6.323 1.00 0.38 H new ATOM 0 HB2 ASP A 115 -11.171 9.096 -6.297 1.00 0.46 H new ATOM 0 HB3 ASP A 115 -10.907 9.054 -4.566 1.00 0.46 H new ATOM 1771 N TYR A 116 -9.955 5.656 -4.341 1.00 0.37 N ATOM 1772 CA TYR A 116 -9.408 4.885 -3.242 1.00 0.37 C ATOM 1773 C TYR A 116 -7.911 5.063 -3.207 1.00 0.40 C ATOM 1774 O TYR A 116 -7.229 4.736 -4.168 1.00 0.62 O ATOM 1775 CB TYR A 116 -9.725 3.407 -3.399 1.00 0.38 C ATOM 1776 CG TYR A 116 -11.182 3.076 -3.198 1.00 0.37 C ATOM 1777 CD1 TYR A 116 -12.125 3.371 -4.169 1.00 0.37 C ATOM 1778 CD2 TYR A 116 -11.613 2.477 -2.026 1.00 0.40 C ATOM 1779 CE1 TYR A 116 -13.459 3.080 -3.979 1.00 0.39 C ATOM 1780 CE2 TYR A 116 -12.943 2.179 -1.826 1.00 0.42 C ATOM 1781 CZ TYR A 116 -13.865 2.483 -2.806 1.00 0.41 C ATOM 1782 OH TYR A 116 -15.195 2.188 -2.613 1.00 0.45 O ATOM 0 H TYR A 116 -9.427 5.584 -5.211 1.00 0.37 H new ATOM 0 HA TYR A 116 -9.858 5.242 -2.315 1.00 0.37 H new ATOM 0 HB2 TYR A 116 -9.422 3.083 -4.395 1.00 0.38 H new ATOM 0 HB3 TYR A 116 -9.130 2.839 -2.684 1.00 0.38 H new ATOM 0 HD1 TYR A 116 -11.810 3.837 -5.091 1.00 0.37 H new ATOM 0 HD2 TYR A 116 -10.894 2.239 -1.256 1.00 0.40 H new ATOM 0 HE1 TYR A 116 -14.182 3.319 -4.745 1.00 0.39 H new ATOM 0 HE2 TYR A 116 -13.262 1.710 -0.907 1.00 0.42 H new ATOM 0 HH TYR A 116 -15.618 2.004 -3.478 1.00 0.45 H new ATOM 1792 N GLU A 117 -7.401 5.542 -2.102 1.00 0.27 N ATOM 1793 CA GLU A 117 -6.002 5.866 -2.005 1.00 0.28 C ATOM 1794 C GLU A 117 -5.321 4.936 -1.038 1.00 0.28 C ATOM 1795 O GLU A 117 -5.816 4.704 0.065 1.00 0.31 O ATOM 1796 CB GLU A 117 -5.788 7.305 -1.529 1.00 0.31 C ATOM 1797 CG GLU A 117 -4.314 7.686 -1.400 1.00 0.39 C ATOM 1798 CD GLU A 117 -4.065 8.719 -0.315 1.00 0.51 C ATOM 1799 OE1 GLU A 117 -4.217 8.384 0.881 1.00 0.80 O ATOM 1800 OE2 GLU A 117 -3.708 9.869 -0.655 1.00 0.66 O ATOM 0 H GLU A 117 -7.937 5.717 -1.252 1.00 0.27 H new ATOM 0 HA GLU A 117 -5.575 5.757 -3.002 1.00 0.28 H new ATOM 0 HB2 GLU A 117 -6.273 7.987 -2.227 1.00 0.31 H new ATOM 0 HB3 GLU A 117 -6.276 7.437 -0.563 1.00 0.31 H new ATOM 0 HG2 GLU A 117 -3.730 6.791 -1.184 1.00 0.39 H new ATOM 0 HG3 GLU A 117 -3.959 8.076 -2.354 1.00 0.39 H new ATOM 1807 N LEU A 118 -4.196 4.403 -1.443 1.00 0.29 N ATOM 1808 CA LEU A 118 -3.378 3.634 -0.550 1.00 0.28 C ATOM 1809 C LEU A 118 -2.211 4.461 -0.077 1.00 0.28 C ATOM 1810 O LEU A 118 -1.508 5.070 -0.872 1.00 0.32 O ATOM 1811 CB LEU A 118 -2.876 2.364 -1.228 1.00 0.35 C ATOM 1812 CG LEU A 118 -1.747 1.641 -0.497 1.00 0.40 C ATOM 1813 CD1 LEU A 118 -2.160 1.362 0.934 1.00 1.24 C ATOM 1814 CD2 LEU A 118 -1.376 0.353 -1.217 1.00 1.25 C ATOM 0 H LEU A 118 -3.828 4.490 -2.390 1.00 0.29 H new ATOM 0 HA LEU A 118 -3.986 3.347 0.308 1.00 0.28 H new ATOM 0 HB2 LEU A 118 -3.714 1.676 -1.341 1.00 0.35 H new ATOM 0 HB3 LEU A 118 -2.534 2.617 -2.231 1.00 0.35 H new ATOM 0 HG LEU A 118 -0.865 2.281 -0.488 1.00 0.40 H new ATOM 0 HD11 LEU A 118 -1.352 0.846 1.452 1.00 1.24 H new ATOM 0 HD12 LEU A 118 -2.374 2.303 1.441 1.00 1.24 H new ATOM 0 HD13 LEU A 118 -3.052 0.736 0.940 1.00 1.24 H new ATOM 0 HD21 LEU A 118 -0.570 -0.145 -0.679 1.00 1.25 H new ATOM 0 HD22 LEU A 118 -2.245 -0.304 -1.259 1.00 1.25 H new ATOM 0 HD23 LEU A 118 -1.047 0.584 -2.230 1.00 1.25 H new ATOM 1826 N GLN A 119 -2.029 4.500 1.218 1.00 0.26 N ATOM 1827 CA GLN A 119 -0.825 5.053 1.790 1.00 0.27 C ATOM 1828 C GLN A 119 -0.038 3.919 2.407 1.00 0.26 C ATOM 1829 O GLN A 119 -0.342 3.462 3.503 1.00 0.27 O ATOM 1830 CB GLN A 119 -1.149 6.096 2.852 1.00 0.30 C ATOM 1831 CG GLN A 119 0.019 7.019 3.155 1.00 0.37 C ATOM 1832 CD GLN A 119 0.207 8.095 2.100 1.00 0.46 C ATOM 1833 OE1 GLN A 119 0.711 9.180 2.389 1.00 0.63 O ATOM 1834 NE2 GLN A 119 -0.211 7.811 0.876 1.00 0.51 N ATOM 0 H GLN A 119 -2.703 4.154 1.901 1.00 0.26 H new ATOM 0 HA GLN A 119 -0.246 5.547 1.010 1.00 0.27 H new ATOM 0 HB2 GLN A 119 -1.999 6.692 2.520 1.00 0.30 H new ATOM 0 HB3 GLN A 119 -1.453 5.591 3.769 1.00 0.30 H new ATOM 0 HG2 GLN A 119 -0.139 7.491 4.125 1.00 0.37 H new ATOM 0 HG3 GLN A 119 0.932 6.429 3.232 1.00 0.37 H new ATOM 0 HE21 GLN A 119 -0.624 6.900 0.677 1.00 0.51 H new ATOM 0 HE22 GLN A 119 -0.120 8.504 0.133 1.00 0.51 H new ATOM 1843 N ILE A 120 0.953 3.450 1.691 1.00 0.26 N ATOM 1844 CA ILE A 120 1.663 2.261 2.100 1.00 0.26 C ATOM 1845 C ILE A 120 3.101 2.586 2.485 1.00 0.23 C ATOM 1846 O ILE A 120 3.877 3.109 1.682 1.00 0.24 O ATOM 1847 CB ILE A 120 1.595 1.188 0.983 1.00 0.31 C ATOM 1848 CG1 ILE A 120 2.326 -0.094 1.382 1.00 0.45 C ATOM 1849 CG2 ILE A 120 2.130 1.720 -0.332 1.00 0.36 C ATOM 1850 CD1 ILE A 120 1.571 -0.937 2.378 1.00 0.81 C ATOM 0 H ILE A 120 1.287 3.871 0.824 1.00 0.26 H new ATOM 0 HA ILE A 120 1.180 1.853 2.988 1.00 0.26 H new ATOM 0 HB ILE A 120 0.542 0.942 0.846 1.00 0.31 H new ATOM 0 HG12 ILE A 120 2.516 -0.687 0.487 1.00 0.45 H new ATOM 0 HG13 ILE A 120 3.297 0.168 1.803 1.00 0.45 H new ATOM 0 HG21 ILE A 120 2.067 0.941 -1.092 1.00 0.36 H new ATOM 0 HG22 ILE A 120 1.538 2.580 -0.644 1.00 0.36 H new ATOM 0 HG23 ILE A 120 3.170 2.021 -0.206 1.00 0.36 H new ATOM 0 HD11 ILE A 120 2.151 -1.829 2.613 1.00 0.81 H new ATOM 0 HD12 ILE A 120 1.404 -0.362 3.289 1.00 0.81 H new ATOM 0 HD13 ILE A 120 0.611 -1.230 1.953 1.00 0.81 H new ATOM 1862 N GLY A 121 3.428 2.333 3.743 1.00 0.23 N ATOM 1863 CA GLY A 121 4.779 2.500 4.217 1.00 0.23 C ATOM 1864 C GLY A 121 5.612 1.284 3.918 1.00 0.22 C ATOM 1865 O GLY A 121 5.283 0.181 4.356 1.00 0.26 O ATOM 0 H GLY A 121 2.768 2.010 4.451 1.00 0.23 H new ATOM 0 HA2 GLY A 121 5.227 3.376 3.747 1.00 0.23 H new ATOM 0 HA3 GLY A 121 4.771 2.684 5.291 1.00 0.23 H new ATOM 1869 N LEU A 122 6.675 1.476 3.165 1.00 0.23 N ATOM 1870 CA LEU A 122 7.502 0.374 2.721 1.00 0.25 C ATOM 1871 C LEU A 122 8.712 0.211 3.605 1.00 0.23 C ATOM 1872 O LEU A 122 9.695 0.938 3.477 1.00 0.30 O ATOM 1873 CB LEU A 122 7.946 0.578 1.278 1.00 0.30 C ATOM 1874 CG LEU A 122 6.985 0.054 0.215 1.00 0.45 C ATOM 1875 CD1 LEU A 122 5.547 0.393 0.547 1.00 1.20 C ATOM 1876 CD2 LEU A 122 7.355 0.626 -1.130 1.00 1.00 C ATOM 0 H LEU A 122 6.988 2.393 2.846 1.00 0.23 H new ATOM 0 HA LEU A 122 6.900 -0.532 2.783 1.00 0.25 H new ATOM 0 HB2 LEU A 122 8.099 1.644 1.111 1.00 0.30 H new ATOM 0 HB3 LEU A 122 8.912 0.092 1.141 1.00 0.30 H new ATOM 0 HG LEU A 122 7.070 -1.032 0.188 1.00 0.45 H new ATOM 0 HD11 LEU A 122 4.892 0.004 -0.233 1.00 1.20 H new ATOM 0 HD12 LEU A 122 5.279 -0.056 1.504 1.00 1.20 H new ATOM 0 HD13 LEU A 122 5.433 1.475 0.609 1.00 1.20 H new ATOM 0 HD21 LEU A 122 6.667 0.250 -1.887 1.00 1.00 H new ATOM 0 HD22 LEU A 122 7.294 1.714 -1.092 1.00 1.00 H new ATOM 0 HD23 LEU A 122 8.372 0.329 -1.385 1.00 1.00 H new ATOM 1888 N THR A 123 8.610 -0.716 4.524 1.00 0.22 N ATOM 1889 CA THR A 123 9.744 -1.141 5.302 1.00 0.21 C ATOM 1890 C THR A 123 10.266 -2.437 4.717 1.00 0.23 C ATOM 1891 O THR A 123 9.528 -3.400 4.600 1.00 0.32 O ATOM 1892 CB THR A 123 9.364 -1.373 6.770 1.00 0.24 C ATOM 1893 OG1 THR A 123 8.820 -0.177 7.342 1.00 0.26 O ATOM 1894 CG2 THR A 123 10.566 -1.831 7.584 1.00 0.26 C ATOM 0 H THR A 123 7.740 -1.196 4.753 1.00 0.22 H new ATOM 0 HA THR A 123 10.503 -0.359 5.269 1.00 0.21 H new ATOM 0 HB THR A 123 8.609 -2.159 6.796 1.00 0.24 H new ATOM 0 HG1 THR A 123 8.285 -0.406 8.130 1.00 0.26 H new ATOM 0 HG21 THR A 123 10.266 -1.987 8.620 1.00 0.26 H new ATOM 0 HG22 THR A 123 10.950 -2.765 7.173 1.00 0.26 H new ATOM 0 HG23 THR A 123 11.345 -1.069 7.543 1.00 0.26 H new ATOM 1902 N ILE A 124 11.508 -2.454 4.304 1.00 0.20 N ATOM 1903 CA ILE A 124 12.087 -3.667 3.760 1.00 0.21 C ATOM 1904 C ILE A 124 13.457 -3.913 4.361 1.00 0.24 C ATOM 1905 O ILE A 124 14.279 -2.998 4.452 1.00 0.32 O ATOM 1906 CB ILE A 124 12.156 -3.627 2.215 1.00 0.23 C ATOM 1907 CG1 ILE A 124 12.764 -2.309 1.728 1.00 0.25 C ATOM 1908 CG2 ILE A 124 10.765 -3.818 1.627 1.00 0.25 C ATOM 1909 CD1 ILE A 124 12.849 -2.196 0.219 1.00 0.98 C ATOM 0 H ILE A 124 12.137 -1.652 4.331 1.00 0.20 H new ATOM 0 HA ILE A 124 11.435 -4.498 4.030 1.00 0.21 H new ATOM 0 HB ILE A 124 12.799 -4.440 1.878 1.00 0.23 H new ATOM 0 HG12 ILE A 124 12.168 -1.481 2.112 1.00 0.25 H new ATOM 0 HG13 ILE A 124 13.764 -2.204 2.148 1.00 0.25 H new ATOM 0 HG21 ILE A 124 10.823 -3.788 0.539 1.00 0.25 H new ATOM 0 HG22 ILE A 124 10.365 -4.782 1.943 1.00 0.25 H new ATOM 0 HG23 ILE A 124 10.109 -3.021 1.977 1.00 0.25 H new ATOM 0 HD11 ILE A 124 13.290 -1.236 -0.050 1.00 0.98 H new ATOM 0 HD12 ILE A 124 13.469 -3.002 -0.172 1.00 0.98 H new ATOM 0 HD13 ILE A 124 11.849 -2.268 -0.208 1.00 0.98 H new ATOM 1921 N ASP A 125 13.683 -5.147 4.796 1.00 0.25 N ATOM 1922 CA ASP A 125 14.931 -5.516 5.435 1.00 0.30 C ATOM 1923 C ASP A 125 15.967 -5.729 4.358 1.00 0.30 C ATOM 1924 O ASP A 125 15.922 -6.729 3.634 1.00 0.31 O ATOM 1925 CB ASP A 125 14.740 -6.789 6.266 1.00 0.37 C ATOM 1926 CG ASP A 125 15.859 -7.032 7.256 1.00 0.91 C ATOM 1927 OD1 ASP A 125 16.925 -7.536 6.837 1.00 1.44 O ATOM 1928 OD2 ASP A 125 15.697 -6.698 8.449 1.00 1.52 O ATOM 0 H ASP A 125 13.011 -5.910 4.715 1.00 0.25 H new ATOM 0 HA ASP A 125 15.261 -4.725 6.109 1.00 0.30 H new ATOM 0 HB2 ASP A 125 13.795 -6.724 6.805 1.00 0.37 H new ATOM 0 HB3 ASP A 125 14.666 -7.645 5.595 1.00 0.37 H new ATOM 1933 N LEU A 126 16.883 -4.776 4.272 1.00 0.32 N ATOM 1934 CA LEU A 126 17.835 -4.682 3.174 1.00 0.33 C ATOM 1935 C LEU A 126 19.253 -4.875 3.674 1.00 0.37 C ATOM 1936 O LEU A 126 19.516 -4.734 4.856 1.00 0.55 O ATOM 1937 CB LEU A 126 17.728 -3.303 2.518 1.00 0.42 C ATOM 1938 CG LEU A 126 16.432 -3.022 1.761 1.00 0.38 C ATOM 1939 CD1 LEU A 126 16.125 -1.537 1.797 1.00 1.26 C ATOM 1940 CD2 LEU A 126 16.545 -3.494 0.321 1.00 1.28 C ATOM 0 H LEU A 126 16.988 -4.039 4.969 1.00 0.32 H new ATOM 0 HA LEU A 126 17.601 -5.464 2.451 1.00 0.33 H new ATOM 0 HB2 LEU A 126 17.846 -2.544 3.292 1.00 0.42 H new ATOM 0 HB3 LEU A 126 18.562 -3.185 1.827 1.00 0.42 H new ATOM 0 HG LEU A 126 15.621 -3.567 2.243 1.00 0.38 H new ATOM 0 HD11 LEU A 126 15.199 -1.344 1.255 1.00 1.26 H new ATOM 0 HD12 LEU A 126 16.014 -1.213 2.832 1.00 1.26 H new ATOM 0 HD13 LEU A 126 16.941 -0.985 1.330 1.00 1.26 H new ATOM 0 HD21 LEU A 126 15.613 -3.286 -0.204 1.00 1.28 H new ATOM 0 HD22 LEU A 126 17.364 -2.969 -0.171 1.00 1.28 H new ATOM 0 HD23 LEU A 126 16.740 -4.566 0.304 1.00 1.28 H new ATOM 1952 N PRO A 127 20.192 -5.205 2.787 1.00 0.43 N ATOM 1953 CA PRO A 127 21.606 -5.266 3.147 1.00 0.52 C ATOM 1954 C PRO A 127 22.217 -3.874 3.324 1.00 0.60 C ATOM 1955 O PRO A 127 23.210 -3.708 4.024 1.00 0.74 O ATOM 1956 CB PRO A 127 22.258 -5.988 1.962 1.00 0.60 C ATOM 1957 CG PRO A 127 21.129 -6.521 1.139 1.00 0.73 C ATOM 1958 CD PRO A 127 19.965 -5.611 1.395 1.00 0.55 C ATOM 0 HA PRO A 127 21.758 -5.773 4.100 1.00 0.52 H new ATOM 0 HB2 PRO A 127 22.877 -5.305 1.381 1.00 0.60 H new ATOM 0 HB3 PRO A 127 22.907 -6.794 2.304 1.00 0.60 H new ATOM 0 HG2 PRO A 127 21.389 -6.533 0.081 1.00 0.73 H new ATOM 0 HG3 PRO A 127 20.891 -7.547 1.420 1.00 0.73 H new ATOM 0 HD2 PRO A 127 19.958 -4.757 0.717 1.00 0.55 H new ATOM 0 HD3 PRO A 127 19.011 -6.124 1.270 1.00 0.55 H new ATOM 1966 N VAL A 128 21.606 -2.876 2.685 1.00 0.60 N ATOM 1967 CA VAL A 128 22.140 -1.513 2.689 1.00 0.72 C ATOM 1968 C VAL A 128 21.922 -0.814 4.031 1.00 0.71 C ATOM 1969 O VAL A 128 22.871 -0.375 4.672 1.00 0.82 O ATOM 1970 CB VAL A 128 21.493 -0.660 1.577 1.00 0.83 C ATOM 1971 CG1 VAL A 128 22.169 0.699 1.471 1.00 1.12 C ATOM 1972 CG2 VAL A 128 21.540 -1.388 0.245 1.00 1.02 C ATOM 0 H VAL A 128 20.740 -2.986 2.157 1.00 0.60 H new ATOM 0 HA VAL A 128 23.211 -1.604 2.510 1.00 0.72 H new ATOM 0 HB VAL A 128 20.448 -0.498 1.841 1.00 0.83 H new ATOM 0 HG11 VAL A 128 21.695 1.281 0.680 1.00 1.12 H new ATOM 0 HG12 VAL A 128 22.072 1.228 2.419 1.00 1.12 H new ATOM 0 HG13 VAL A 128 23.225 0.563 1.238 1.00 1.12 H new ATOM 0 HG21 VAL A 128 21.079 -0.769 -0.524 1.00 1.02 H new ATOM 0 HG22 VAL A 128 22.577 -1.588 -0.024 1.00 1.02 H new ATOM 0 HG23 VAL A 128 20.998 -2.330 0.326 1.00 1.02 H new ATOM 1982 N VAL A 129 20.664 -0.719 4.450 1.00 0.62 N ATOM 1983 CA VAL A 129 20.310 0.014 5.667 1.00 0.63 C ATOM 1984 C VAL A 129 19.889 -0.961 6.754 1.00 0.55 C ATOM 1985 O VAL A 129 19.497 -0.581 7.853 1.00 0.55 O ATOM 1986 CB VAL A 129 19.141 0.986 5.421 1.00 0.69 C ATOM 1987 CG1 VAL A 129 19.356 2.284 6.178 1.00 1.35 C ATOM 1988 CG2 VAL A 129 18.939 1.243 3.936 1.00 1.26 C ATOM 0 H VAL A 129 19.870 -1.140 3.967 1.00 0.62 H new ATOM 0 HA VAL A 129 21.190 0.580 5.972 1.00 0.63 H new ATOM 0 HB VAL A 129 18.231 0.520 5.798 1.00 0.69 H new ATOM 0 HG11 VAL A 129 18.519 2.957 5.991 1.00 1.35 H new ATOM 0 HG12 VAL A 129 19.423 2.076 7.246 1.00 1.35 H new ATOM 0 HG13 VAL A 129 20.281 2.753 5.841 1.00 1.35 H new ATOM 0 HG21 VAL A 129 18.107 1.933 3.796 1.00 1.26 H new ATOM 0 HG22 VAL A 129 19.846 1.678 3.515 1.00 1.26 H new ATOM 0 HG23 VAL A 129 18.720 0.303 3.431 1.00 1.26 H new ATOM 1998 N GLY A 130 19.967 -2.224 6.401 1.00 0.53 N ATOM 1999 CA GLY A 130 19.434 -3.290 7.241 1.00 0.55 C ATOM 2000 C GLY A 130 17.916 -3.331 7.200 1.00 0.58 C ATOM 2001 O GLY A 130 17.308 -4.390 7.295 1.00 1.05 O ATOM 0 H GLY A 130 20.396 -2.547 5.534 1.00 0.53 H new ATOM 0 HA2 GLY A 130 19.833 -4.249 6.910 1.00 0.55 H new ATOM 0 HA3 GLY A 130 19.767 -3.144 8.269 1.00 0.55 H new ATOM 2005 N GLU A 131 17.329 -2.160 7.047 1.00 0.49 N ATOM 2006 CA GLU A 131 15.897 -1.976 6.925 1.00 0.46 C ATOM 2007 C GLU A 131 15.648 -0.501 6.660 1.00 0.49 C ATOM 2008 O GLU A 131 16.399 0.350 7.135 1.00 0.75 O ATOM 2009 CB GLU A 131 15.166 -2.420 8.196 1.00 0.59 C ATOM 2010 CG GLU A 131 15.398 -1.513 9.395 1.00 0.73 C ATOM 2011 CD GLU A 131 14.705 -2.013 10.644 1.00 0.93 C ATOM 2012 OE1 GLU A 131 15.139 -3.044 11.199 1.00 1.01 O ATOM 2013 OE2 GLU A 131 13.722 -1.382 11.080 1.00 1.16 O ATOM 0 H GLU A 131 17.851 -1.285 7.003 1.00 0.49 H new ATOM 0 HA GLU A 131 15.514 -2.588 6.109 1.00 0.46 H new ATOM 0 HB2 GLU A 131 14.097 -2.466 7.990 1.00 0.59 H new ATOM 0 HB3 GLU A 131 15.485 -3.431 8.451 1.00 0.59 H new ATOM 0 HG2 GLU A 131 16.468 -1.434 9.585 1.00 0.73 H new ATOM 0 HG3 GLU A 131 15.040 -0.510 9.162 1.00 0.73 H new ATOM 2020 N PHE A 132 14.634 -0.187 5.885 1.00 0.39 N ATOM 2021 CA PHE A 132 14.348 1.201 5.576 1.00 0.48 C ATOM 2022 C PHE A 132 12.861 1.382 5.327 1.00 0.35 C ATOM 2023 O PHE A 132 12.206 0.478 4.814 1.00 0.33 O ATOM 2024 CB PHE A 132 15.159 1.643 4.354 1.00 0.69 C ATOM 2025 CG PHE A 132 15.251 3.134 4.190 1.00 1.02 C ATOM 2026 CD1 PHE A 132 15.779 3.921 5.197 1.00 1.22 C ATOM 2027 CD2 PHE A 132 14.817 3.745 3.027 1.00 1.31 C ATOM 2028 CE1 PHE A 132 15.871 5.292 5.049 1.00 1.66 C ATOM 2029 CE2 PHE A 132 14.909 5.115 2.872 1.00 1.74 C ATOM 2030 CZ PHE A 132 15.436 5.889 3.883 1.00 1.91 C ATOM 0 H PHE A 132 13.999 -0.863 5.460 1.00 0.39 H new ATOM 0 HA PHE A 132 14.634 1.823 6.424 1.00 0.48 H new ATOM 0 HB2 PHE A 132 16.166 1.233 4.431 1.00 0.69 H new ATOM 0 HB3 PHE A 132 14.709 1.216 3.458 1.00 0.69 H new ATOM 0 HD1 PHE A 132 16.124 3.459 6.110 1.00 1.22 H new ATOM 0 HD2 PHE A 132 14.402 3.144 2.231 1.00 1.31 H new ATOM 0 HE1 PHE A 132 16.283 5.895 5.845 1.00 1.66 H new ATOM 0 HE2 PHE A 132 14.568 5.579 1.958 1.00 1.74 H new ATOM 0 HZ PHE A 132 15.508 6.960 3.763 1.00 1.91 H new ATOM 2040 N THR A 133 12.333 2.540 5.705 1.00 0.37 N ATOM 2041 CA THR A 133 10.915 2.813 5.559 1.00 0.32 C ATOM 2042 C THR A 133 10.676 4.042 4.686 1.00 0.31 C ATOM 2043 O THR A 133 10.996 5.167 5.075 1.00 0.36 O ATOM 2044 CB THR A 133 10.246 3.026 6.932 1.00 0.44 C ATOM 2045 OG1 THR A 133 10.523 1.907 7.783 1.00 1.19 O ATOM 2046 CG2 THR A 133 8.740 3.189 6.786 1.00 1.17 C ATOM 0 H THR A 133 12.870 3.304 6.115 1.00 0.37 H new ATOM 0 HA THR A 133 10.470 1.943 5.076 1.00 0.32 H new ATOM 0 HB THR A 133 10.652 3.937 7.372 1.00 0.44 H new ATOM 0 HG1 THR A 133 9.999 1.133 7.487 1.00 1.19 H new ATOM 0 HG21 THR A 133 8.293 3.338 7.769 1.00 1.17 H new ATOM 0 HG22 THR A 133 8.527 4.053 6.156 1.00 1.17 H new ATOM 0 HG23 THR A 133 8.320 2.294 6.328 1.00 1.17 H new ATOM 2054 N ILE A 134 10.144 3.810 3.496 1.00 0.28 N ATOM 2055 CA ILE A 134 9.708 4.887 2.619 1.00 0.31 C ATOM 2056 C ILE A 134 8.260 4.654 2.216 1.00 0.28 C ATOM 2057 O ILE A 134 7.876 3.536 1.904 1.00 0.26 O ATOM 2058 CB ILE A 134 10.604 5.021 1.359 1.00 0.36 C ATOM 2059 CG1 ILE A 134 10.900 3.653 0.725 1.00 0.41 C ATOM 2060 CG2 ILE A 134 11.895 5.741 1.698 1.00 0.41 C ATOM 2061 CD1 ILE A 134 9.881 3.229 -0.309 1.00 0.50 C ATOM 0 H ILE A 134 10.003 2.876 3.112 1.00 0.28 H new ATOM 0 HA ILE A 134 9.795 5.824 3.170 1.00 0.31 H new ATOM 0 HB ILE A 134 10.055 5.612 0.626 1.00 0.36 H new ATOM 0 HG12 ILE A 134 11.885 3.684 0.260 1.00 0.41 H new ATOM 0 HG13 ILE A 134 10.942 2.899 1.511 1.00 0.41 H new ATOM 0 HG21 ILE A 134 12.510 5.826 0.802 1.00 0.41 H new ATOM 0 HG22 ILE A 134 11.667 6.737 2.077 1.00 0.41 H new ATOM 0 HG23 ILE A 134 12.437 5.178 2.458 1.00 0.41 H new ATOM 0 HD11 ILE A 134 10.156 2.254 -0.712 1.00 0.50 H new ATOM 0 HD12 ILE A 134 8.897 3.165 0.155 1.00 0.50 H new ATOM 0 HD13 ILE A 134 9.855 3.961 -1.116 1.00 0.50 H new ATOM 2073 N PRO A 135 7.417 5.679 2.277 1.00 0.30 N ATOM 2074 CA PRO A 135 6.021 5.541 1.928 1.00 0.29 C ATOM 2075 C PRO A 135 5.733 5.846 0.460 1.00 0.28 C ATOM 2076 O PRO A 135 6.534 6.477 -0.237 1.00 0.31 O ATOM 2077 CB PRO A 135 5.341 6.560 2.841 1.00 0.35 C ATOM 2078 CG PRO A 135 6.393 7.572 3.193 1.00 0.45 C ATOM 2079 CD PRO A 135 7.729 7.037 2.727 1.00 0.39 C ATOM 0 HA PRO A 135 5.668 4.518 2.058 1.00 0.29 H new ATOM 0 HB2 PRO A 135 4.498 7.033 2.337 1.00 0.35 H new ATOM 0 HB3 PRO A 135 4.948 6.079 3.737 1.00 0.35 H new ATOM 0 HG2 PRO A 135 6.177 8.528 2.716 1.00 0.45 H new ATOM 0 HG3 PRO A 135 6.407 7.749 4.268 1.00 0.45 H new ATOM 0 HD2 PRO A 135 8.144 7.641 1.920 1.00 0.39 H new ATOM 0 HD3 PRO A 135 8.463 7.034 3.533 1.00 0.39 H new ATOM 2087 N ILE A 136 4.572 5.389 0.010 1.00 0.26 N ATOM 2088 CA ILE A 136 4.123 5.594 -1.353 1.00 0.27 C ATOM 2089 C ILE A 136 2.594 5.447 -1.383 1.00 0.26 C ATOM 2090 O ILE A 136 1.992 5.003 -0.404 1.00 0.26 O ATOM 2091 CB ILE A 136 4.849 4.628 -2.340 1.00 0.28 C ATOM 2092 CG1 ILE A 136 4.516 4.957 -3.810 1.00 0.44 C ATOM 2093 CG2 ILE A 136 4.539 3.177 -2.015 1.00 0.33 C ATOM 2094 CD1 ILE A 136 3.485 4.048 -4.451 1.00 0.32 C ATOM 0 H ILE A 136 3.915 4.863 0.586 1.00 0.26 H new ATOM 0 HA ILE A 136 4.381 6.598 -1.691 1.00 0.27 H new ATOM 0 HB ILE A 136 5.921 4.777 -2.211 1.00 0.28 H new ATOM 0 HG12 ILE A 136 4.157 5.985 -3.864 1.00 0.44 H new ATOM 0 HG13 ILE A 136 5.435 4.909 -4.395 1.00 0.44 H new ATOM 0 HG21 ILE A 136 5.059 2.527 -2.719 1.00 0.33 H new ATOM 0 HG22 ILE A 136 4.871 2.952 -1.001 1.00 0.33 H new ATOM 0 HG23 ILE A 136 3.465 3.009 -2.091 1.00 0.33 H new ATOM 0 HD11 ILE A 136 3.318 4.358 -5.483 1.00 0.32 H new ATOM 0 HD12 ILE A 136 3.846 3.020 -4.435 1.00 0.32 H new ATOM 0 HD13 ILE A 136 2.549 4.112 -3.897 1.00 0.32 H new ATOM 2106 N SER A 137 1.975 5.841 -2.479 1.00 0.28 N ATOM 2107 CA SER A 137 0.530 5.994 -2.527 1.00 0.30 C ATOM 2108 C SER A 137 -0.023 5.444 -3.826 1.00 0.30 C ATOM 2109 O SER A 137 0.667 5.446 -4.846 1.00 0.32 O ATOM 2110 CB SER A 137 0.170 7.472 -2.390 1.00 0.34 C ATOM 2111 OG SER A 137 1.085 8.141 -1.536 1.00 0.88 O ATOM 0 H SER A 137 2.451 6.062 -3.353 1.00 0.28 H new ATOM 0 HA SER A 137 0.089 5.434 -1.703 1.00 0.30 H new ATOM 0 HB2 SER A 137 0.173 7.943 -3.373 1.00 0.34 H new ATOM 0 HB3 SER A 137 -0.841 7.569 -1.993 1.00 0.34 H new ATOM 0 HG SER A 137 0.854 9.092 -1.490 1.00 0.88 H new ATOM 2117 N SER A 138 -1.255 4.958 -3.798 1.00 0.31 N ATOM 2118 CA SER A 138 -1.885 4.481 -5.005 1.00 0.34 C ATOM 2119 C SER A 138 -3.384 4.713 -4.924 1.00 0.34 C ATOM 2120 O SER A 138 -4.093 4.001 -4.215 1.00 0.35 O ATOM 2121 CB SER A 138 -1.589 2.995 -5.204 1.00 0.40 C ATOM 2122 OG SER A 138 -1.991 2.557 -6.494 1.00 0.96 O ATOM 0 H SER A 138 -1.828 4.887 -2.957 1.00 0.31 H new ATOM 0 HA SER A 138 -1.485 5.030 -5.858 1.00 0.34 H new ATOM 0 HB2 SER A 138 -0.522 2.814 -5.072 1.00 0.40 H new ATOM 0 HB3 SER A 138 -2.108 2.413 -4.442 1.00 0.40 H new ATOM 0 HG SER A 138 -1.788 1.603 -6.594 1.00 0.96 H new ATOM 2128 N LYS A 139 -3.845 5.744 -5.609 1.00 0.36 N ATOM 2129 CA LYS A 139 -5.260 6.061 -5.653 1.00 0.38 C ATOM 2130 C LYS A 139 -5.894 5.539 -6.932 1.00 0.41 C ATOM 2131 O LYS A 139 -5.248 5.521 -7.982 1.00 0.47 O ATOM 2132 CB LYS A 139 -5.420 7.561 -5.544 1.00 0.44 C ATOM 2133 CG LYS A 139 -4.398 8.119 -4.604 1.00 0.57 C ATOM 2134 CD LYS A 139 -4.312 9.611 -4.651 1.00 0.92 C ATOM 2135 CE LYS A 139 -5.509 10.270 -3.984 1.00 1.35 C ATOM 2136 NZ LYS A 139 -6.711 10.323 -4.860 1.00 1.76 N ATOM 0 H LYS A 139 -3.255 6.380 -6.146 1.00 0.36 H new ATOM 0 HA LYS A 139 -5.770 5.577 -4.820 1.00 0.38 H new ATOM 0 HB2 LYS A 139 -5.310 8.019 -6.527 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -6.422 7.803 -5.190 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -4.638 7.807 -3.588 1.00 0.57 H new ATOM 0 HG3 LYS A 139 -3.422 7.697 -4.845 1.00 0.57 H new ATOM 0 HD2 LYS A 139 -3.396 9.937 -4.158 1.00 0.92 H new ATOM 0 HD3 LYS A 139 -4.249 9.938 -5.689 1.00 0.92 H new ATOM 0 HE2 LYS A 139 -5.755 9.725 -3.073 1.00 1.35 H new ATOM 0 HE3 LYS A 139 -5.239 11.283 -3.686 1.00 1.35 H new ATOM 0 HZ1 LYS A 139 -7.072 11.298 -4.895 1.00 1.76 H new ATOM 0 HZ2 LYS A 139 -6.455 10.014 -5.819 1.00 1.76 H new ATOM 0 HZ3 LYS A 139 -7.447 9.695 -4.478 1.00 1.76 H new ATOM 2150 N GLY A 140 -7.138 5.090 -6.849 1.00 0.42 N ATOM 2151 CA GLY A 140 -7.826 4.585 -8.010 1.00 0.50 C ATOM 2152 C GLY A 140 -9.328 4.761 -7.886 1.00 0.46 C ATOM 2153 O GLY A 140 -9.919 4.410 -6.868 1.00 0.47 O ATOM 0 H GLY A 140 -7.684 5.068 -5.988 1.00 0.42 H new ATOM 0 HA2 GLY A 140 -7.470 5.104 -8.900 1.00 0.50 H new ATOM 0 HA3 GLY A 140 -7.592 3.529 -8.142 1.00 0.50 H new ATOM 2157 N GLU A 141 -9.928 5.315 -8.921 1.00 0.44 N ATOM 2158 CA GLU A 141 -11.364 5.576 -8.932 1.00 0.42 C ATOM 2159 C GLU A 141 -12.077 4.474 -9.691 1.00 0.43 C ATOM 2160 O GLU A 141 -11.750 4.216 -10.853 1.00 0.48 O ATOM 2161 CB GLU A 141 -11.671 6.915 -9.597 1.00 0.45 C ATOM 2162 CG GLU A 141 -10.710 8.023 -9.219 1.00 0.52 C ATOM 2163 CD GLU A 141 -10.989 9.311 -9.957 1.00 1.24 C ATOM 2164 OE1 GLU A 141 -11.403 9.251 -11.132 1.00 1.51 O ATOM 2165 OE2 GLU A 141 -10.802 10.397 -9.367 1.00 2.10 O ATOM 0 H GLU A 141 -9.444 5.597 -9.774 1.00 0.44 H new ATOM 0 HA GLU A 141 -11.711 5.607 -7.899 1.00 0.42 H new ATOM 0 HB2 GLU A 141 -11.652 6.785 -10.679 1.00 0.45 H new ATOM 0 HB3 GLU A 141 -12.683 7.219 -9.330 1.00 0.45 H new ATOM 0 HG2 GLU A 141 -10.773 8.203 -8.146 1.00 0.52 H new ATOM 0 HG3 GLU A 141 -9.690 7.702 -9.429 1.00 0.52 H new ATOM 2172 N ILE A 142 -13.061 3.833 -9.066 1.00 0.42 N ATOM 2173 CA ILE A 142 -13.777 2.726 -9.689 1.00 0.47 C ATOM 2174 C ILE A 142 -15.203 2.734 -9.156 1.00 0.46 C ATOM 2175 O ILE A 142 -15.520 3.510 -8.249 1.00 0.42 O ATOM 2176 CB ILE A 142 -13.149 1.321 -9.425 1.00 0.54 C ATOM 2177 CG1 ILE A 142 -13.375 0.850 -7.978 1.00 0.76 C ATOM 2178 CG2 ILE A 142 -11.663 1.298 -9.763 1.00 0.60 C ATOM 2179 CD1 ILE A 142 -12.627 1.638 -6.927 1.00 0.67 C ATOM 0 H ILE A 142 -13.381 4.063 -8.125 1.00 0.42 H new ATOM 0 HA ILE A 142 -13.727 2.880 -10.767 1.00 0.47 H new ATOM 0 HB ILE A 142 -13.662 0.624 -10.087 1.00 0.54 H new ATOM 0 HG12 ILE A 142 -14.441 0.900 -7.758 1.00 0.76 H new ATOM 0 HG13 ILE A 142 -13.082 -0.197 -7.903 1.00 0.76 H new ATOM 0 HG21 ILE A 142 -11.261 0.304 -9.567 1.00 0.60 H new ATOM 0 HG22 ILE A 142 -11.526 1.544 -10.816 1.00 0.60 H new ATOM 0 HG23 ILE A 142 -11.139 2.030 -9.148 1.00 0.60 H new ATOM 0 HD11 ILE A 142 -12.850 1.232 -5.940 1.00 0.67 H new ATOM 0 HD12 ILE A 142 -11.555 1.569 -7.114 1.00 0.67 H new ATOM 0 HD13 ILE A 142 -12.936 2.683 -6.967 1.00 0.67 H new ATOM 2191 N LYS A 143 -16.057 1.895 -9.713 1.00 0.53 N ATOM 2192 CA LYS A 143 -17.434 1.815 -9.253 1.00 0.57 C ATOM 2193 C LYS A 143 -17.476 1.248 -7.838 1.00 0.54 C ATOM 2194 O LYS A 143 -16.699 0.352 -7.500 1.00 0.57 O ATOM 2195 CB LYS A 143 -18.262 0.955 -10.210 1.00 0.70 C ATOM 2196 CG LYS A 143 -18.104 1.382 -11.657 1.00 1.44 C ATOM 2197 CD LYS A 143 -18.963 0.562 -12.601 1.00 2.04 C ATOM 2198 CE LYS A 143 -18.608 0.856 -14.051 1.00 2.74 C ATOM 2199 NZ LYS A 143 -18.647 2.313 -14.355 1.00 3.53 N ATOM 0 H LYS A 143 -15.825 1.263 -10.479 1.00 0.53 H new ATOM 0 HA LYS A 143 -17.865 2.816 -9.237 1.00 0.57 H new ATOM 0 HB2 LYS A 143 -17.963 -0.088 -10.107 1.00 0.70 H new ATOM 0 HB3 LYS A 143 -19.314 1.014 -9.930 1.00 0.70 H new ATOM 0 HG2 LYS A 143 -18.368 2.435 -11.753 1.00 1.44 H new ATOM 0 HG3 LYS A 143 -17.058 1.288 -11.948 1.00 1.44 H new ATOM 0 HD2 LYS A 143 -18.824 -0.500 -12.396 1.00 2.04 H new ATOM 0 HD3 LYS A 143 -20.016 0.785 -12.428 1.00 2.04 H new ATOM 0 HE2 LYS A 143 -17.612 0.468 -14.265 1.00 2.74 H new ATOM 0 HE3 LYS A 143 -19.302 0.331 -14.707 1.00 2.74 H new ATOM 0 HZ1 LYS A 143 -18.567 2.456 -15.382 1.00 3.53 H new ATOM 0 HZ2 LYS A 143 -19.546 2.714 -14.019 1.00 3.53 H new ATOM 0 HZ3 LYS A 143 -17.856 2.789 -13.877 1.00 3.53 H new ATOM 2213 N LEU A 144 -18.366 1.788 -7.012 1.00 0.60 N ATOM 2214 CA LEU A 144 -18.458 1.382 -5.614 1.00 0.66 C ATOM 2215 C LEU A 144 -18.786 -0.115 -5.482 1.00 0.60 C ATOM 2216 O LEU A 144 -19.210 -0.749 -6.455 1.00 0.63 O ATOM 2217 CB LEU A 144 -19.469 2.280 -4.869 1.00 0.83 C ATOM 2218 CG LEU A 144 -20.868 2.430 -5.487 1.00 0.69 C ATOM 2219 CD1 LEU A 144 -21.685 1.160 -5.331 1.00 1.21 C ATOM 2220 CD2 LEU A 144 -21.599 3.602 -4.846 1.00 1.23 C ATOM 0 H LEU A 144 -19.034 2.508 -7.287 1.00 0.60 H new ATOM 0 HA LEU A 144 -17.485 1.519 -5.142 1.00 0.66 H new ATOM 0 HB2 LEU A 144 -19.587 1.889 -3.859 1.00 0.83 H new ATOM 0 HB3 LEU A 144 -19.033 3.275 -4.777 1.00 0.83 H new ATOM 0 HG LEU A 144 -20.744 2.619 -6.553 1.00 0.69 H new ATOM 0 HD11 LEU A 144 -22.668 1.302 -5.779 1.00 1.21 H new ATOM 0 HD12 LEU A 144 -21.175 0.336 -5.829 1.00 1.21 H new ATOM 0 HD13 LEU A 144 -21.799 0.929 -4.272 1.00 1.21 H new ATOM 0 HD21 LEU A 144 -22.589 3.700 -5.291 1.00 1.23 H new ATOM 0 HD22 LEU A 144 -21.698 3.427 -3.775 1.00 1.23 H new ATOM 0 HD23 LEU A 144 -21.034 4.519 -5.013 1.00 1.23 H new ATOM 2232 N PRO A 145 -18.575 -0.700 -4.280 1.00 0.61 N ATOM 2233 CA PRO A 145 -18.732 -2.146 -4.040 1.00 0.64 C ATOM 2234 C PRO A 145 -20.111 -2.687 -4.414 1.00 0.66 C ATOM 2235 O PRO A 145 -21.028 -1.931 -4.736 1.00 0.65 O ATOM 2236 CB PRO A 145 -18.511 -2.295 -2.529 1.00 0.71 C ATOM 2237 CG PRO A 145 -18.658 -0.922 -1.974 1.00 0.69 C ATOM 2238 CD PRO A 145 -18.171 0.000 -3.049 1.00 0.67 C ATOM 0 HA PRO A 145 -18.035 -2.712 -4.657 1.00 0.64 H new ATOM 0 HB2 PRO A 145 -19.239 -2.977 -2.090 1.00 0.71 H new ATOM 0 HB3 PRO A 145 -17.523 -2.703 -2.314 1.00 0.71 H new ATOM 0 HG2 PRO A 145 -19.696 -0.712 -1.718 1.00 0.69 H new ATOM 0 HG3 PRO A 145 -18.074 -0.803 -1.061 1.00 0.69 H new ATOM 0 HD2 PRO A 145 -18.629 0.987 -2.975 1.00 0.67 H new ATOM 0 HD3 PRO A 145 -17.092 0.145 -3.001 1.00 0.67 H new