USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=31 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 137 SER OG : rot -150:sc= 0.684 USER MOD Set 1.2: A 139 LYS NZ :NH3+ -169:sc= 0.897 (180deg=0.0451) USER MOD Set 2.1: A 123 THR OG1 : rot 121:sc= 1.96 USER MOD Set 2.2: A 133 THR OG1 : rot -93:sc= 0.729 USER MOD Set 3.1: A 48 THR OG1 : rot 140:sc= -0.52 USER MOD Set 3.2: A 87 MET CE :methyl -171:sc= -0.461 (180deg=-0.855) USER MOD Set 4.1: A 51 TYR OH : rot 180:sc= 0.00476 USER MOD Set 4.2: A 53 HIS : no HE2:sc= 1.11 K(o=1.1,f=-3.7!) USER MOD Single : A 25 SER OG : rot 46:sc= -2.13! USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -171:sc= -0.0263 (180deg=-0.206) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 50:sc= 0.068! USER MOD Single : A 44 LYS NZ :NH3+ 163:sc= 1.25 (180deg=1.21) USER MOD Single : A 46 SER OG : rot 12:sc= 0.153 USER MOD Single : A 49 ASN : amide:sc= -4.15! C(o=-4.2!,f=-15!) USER MOD Single : A 52 SER OG : rot 60:sc= 0.0384 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 58 CYS SG : rot 180:sc= -8.3! USER MOD Single : A 61 SER OG : rot -61:sc= 0.835 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HE2:sc= -2.95 X(o=-3,f=-3.3!) USER MOD Single : A 66 SER OG : rot 99:sc= 0.884 USER MOD Single : A 73 LYS NZ :NH3+ -117:sc= 1.22 (180deg=0.363) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 18:sc= 0.736 USER MOD Single : A 83 LYS NZ :NH3+ -166:sc= -0.0365 (180deg=-0.271) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= 0.00296 USER MOD Single : A 103 ASN : amide:sc= 0.944 K(o=0.94,f=-0.0092) USER MOD Single : A 116 TYR OH : rot 150:sc= 0 USER MOD Single : A 119 GLN : amide:sc= -8.28! K(o=-8.3!,f=-1.9) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0282) USER MOD ----------------------------------------------------------------- ATOM 364 N GLY A 24 8.061 0.221 -3.676 1.00 0.54 N ATOM 365 CA GLY A 24 7.194 -0.648 -4.393 1.00 0.46 C ATOM 366 C GLY A 24 6.333 -1.498 -3.481 1.00 0.33 C ATOM 367 O GLY A 24 6.850 -2.121 -2.564 1.00 0.39 O ATOM 0 HA2 GLY A 24 6.551 -0.056 -5.045 1.00 0.46 H new ATOM 0 HA3 GLY A 24 7.788 -1.298 -5.035 1.00 0.46 H new ATOM 371 N SER A 25 5.023 -1.466 -3.711 1.00 0.28 N ATOM 372 CA SER A 25 4.064 -2.410 -3.117 1.00 0.30 C ATOM 373 C SER A 25 2.691 -2.194 -3.728 1.00 0.32 C ATOM 374 O SER A 25 1.666 -2.298 -3.058 1.00 0.39 O ATOM 375 CB SER A 25 3.954 -2.274 -1.600 1.00 0.37 C ATOM 376 OG SER A 25 5.011 -2.948 -0.942 1.00 1.20 O ATOM 0 H SER A 25 4.586 -0.777 -4.323 1.00 0.28 H new ATOM 0 HA SER A 25 4.436 -3.412 -3.332 1.00 0.30 H new ATOM 0 HB2 SER A 25 3.967 -1.219 -1.326 1.00 0.37 H new ATOM 0 HB3 SER A 25 2.999 -2.678 -1.265 1.00 0.37 H new ATOM 0 HG SER A 25 5.860 -2.732 -1.381 1.00 1.20 H new ATOM 382 N VAL A 26 2.680 -1.905 -5.008 1.00 0.28 N ATOM 383 CA VAL A 26 1.454 -1.556 -5.696 1.00 0.30 C ATOM 384 C VAL A 26 1.344 -2.298 -7.022 1.00 0.30 C ATOM 385 O VAL A 26 2.353 -2.633 -7.634 1.00 0.30 O ATOM 386 CB VAL A 26 1.387 -0.033 -5.937 1.00 0.33 C ATOM 387 CG1 VAL A 26 2.594 0.425 -6.732 1.00 0.93 C ATOM 388 CG2 VAL A 26 0.097 0.362 -6.636 1.00 0.88 C ATOM 0 H VAL A 26 3.511 -1.904 -5.600 1.00 0.28 H new ATOM 0 HA VAL A 26 0.617 -1.852 -5.064 1.00 0.30 H new ATOM 0 HB VAL A 26 1.398 0.464 -4.967 1.00 0.33 H new ATOM 0 HG11 VAL A 26 2.535 1.501 -6.895 1.00 0.93 H new ATOM 0 HG12 VAL A 26 3.504 0.191 -6.179 1.00 0.93 H new ATOM 0 HG13 VAL A 26 2.612 -0.088 -7.694 1.00 0.93 H new ATOM 0 HG21 VAL A 26 0.082 1.441 -6.790 1.00 0.88 H new ATOM 0 HG22 VAL A 26 0.036 -0.143 -7.600 1.00 0.88 H new ATOM 0 HG23 VAL A 26 -0.754 0.072 -6.020 1.00 0.88 H new ATOM 398 N THR A 27 0.119 -2.615 -7.405 1.00 0.33 N ATOM 399 CA THR A 27 -0.199 -3.037 -8.762 1.00 0.36 C ATOM 400 C THR A 27 -1.718 -3.005 -9.005 1.00 0.38 C ATOM 401 O THR A 27 -2.161 -2.651 -10.099 1.00 0.48 O ATOM 402 CB THR A 27 0.388 -4.429 -9.096 1.00 0.39 C ATOM 403 OG1 THR A 27 -0.155 -4.932 -10.322 1.00 0.47 O ATOM 404 CG2 THR A 27 0.130 -5.414 -7.977 1.00 0.39 C ATOM 0 H THR A 27 -0.688 -2.587 -6.782 1.00 0.33 H new ATOM 0 HA THR A 27 0.273 -2.324 -9.438 1.00 0.36 H new ATOM 0 HB THR A 27 1.465 -4.310 -9.211 1.00 0.39 H new ATOM 0 HG1 THR A 27 0.231 -5.812 -10.514 1.00 0.47 H new ATOM 0 HG21 THR A 27 0.554 -6.383 -8.240 1.00 0.39 H new ATOM 0 HG22 THR A 27 0.594 -5.052 -7.060 1.00 0.39 H new ATOM 0 HG23 THR A 27 -0.944 -5.517 -7.824 1.00 0.39 H new ATOM 412 N ASP A 28 -2.515 -3.342 -7.982 1.00 0.35 N ATOM 413 CA ASP A 28 -3.980 -3.327 -8.104 1.00 0.42 C ATOM 414 C ASP A 28 -4.626 -3.438 -6.733 1.00 0.35 C ATOM 415 O ASP A 28 -3.964 -3.789 -5.764 1.00 0.37 O ATOM 416 CB ASP A 28 -4.446 -4.504 -8.964 1.00 0.57 C ATOM 417 CG ASP A 28 -5.904 -4.420 -9.375 1.00 1.08 C ATOM 418 OD1 ASP A 28 -6.307 -3.404 -9.979 1.00 1.69 O ATOM 419 OD2 ASP A 28 -6.645 -5.390 -9.123 1.00 1.44 O ATOM 0 H ASP A 28 -2.172 -3.627 -7.065 1.00 0.35 H new ATOM 0 HA ASP A 28 -4.274 -2.387 -8.571 1.00 0.42 H new ATOM 0 HB2 ASP A 28 -3.828 -4.555 -9.860 1.00 0.57 H new ATOM 0 HB3 ASP A 28 -4.286 -5.431 -8.413 1.00 0.57 H new ATOM 424 N VAL A 29 -5.909 -3.130 -6.649 1.00 0.39 N ATOM 425 CA VAL A 29 -6.670 -3.353 -5.429 1.00 0.41 C ATOM 426 C VAL A 29 -8.087 -3.805 -5.773 1.00 0.37 C ATOM 427 O VAL A 29 -8.828 -3.092 -6.452 1.00 0.42 O ATOM 428 CB VAL A 29 -6.737 -2.094 -4.530 1.00 0.60 C ATOM 429 CG1 VAL A 29 -7.671 -2.340 -3.361 1.00 1.13 C ATOM 430 CG2 VAL A 29 -5.356 -1.696 -4.018 1.00 1.14 C ATOM 0 H VAL A 29 -6.448 -2.723 -7.413 1.00 0.39 H new ATOM 0 HA VAL A 29 -6.150 -4.130 -4.869 1.00 0.41 H new ATOM 0 HB VAL A 29 -7.120 -1.272 -5.135 1.00 0.60 H new ATOM 0 HG11 VAL A 29 -7.712 -1.449 -2.734 1.00 1.13 H new ATOM 0 HG12 VAL A 29 -8.670 -2.567 -3.735 1.00 1.13 H new ATOM 0 HG13 VAL A 29 -7.304 -3.181 -2.773 1.00 1.13 H new ATOM 0 HG21 VAL A 29 -5.442 -0.809 -3.391 1.00 1.14 H new ATOM 0 HG22 VAL A 29 -4.935 -2.514 -3.433 1.00 1.14 H new ATOM 0 HG23 VAL A 29 -4.703 -1.481 -4.863 1.00 1.14 H new ATOM 440 N ASP A 30 -8.448 -4.991 -5.307 1.00 0.37 N ATOM 441 CA ASP A 30 -9.774 -5.550 -5.541 1.00 0.38 C ATOM 442 C ASP A 30 -10.716 -5.192 -4.401 1.00 0.42 C ATOM 443 O ASP A 30 -10.579 -5.701 -3.288 1.00 0.54 O ATOM 444 CB ASP A 30 -9.714 -7.080 -5.662 1.00 0.51 C ATOM 445 CG ASP A 30 -8.997 -7.569 -6.904 1.00 1.00 C ATOM 446 OD1 ASP A 30 -7.770 -7.782 -6.844 1.00 1.83 O ATOM 447 OD2 ASP A 30 -9.666 -7.778 -7.942 1.00 1.16 O ATOM 0 H ASP A 30 -7.834 -5.592 -4.758 1.00 0.37 H new ATOM 0 HA ASP A 30 -10.144 -5.126 -6.474 1.00 0.38 H new ATOM 0 HB2 ASP A 30 -9.214 -7.485 -4.782 1.00 0.51 H new ATOM 0 HB3 ASP A 30 -10.730 -7.475 -5.661 1.00 0.51 H new ATOM 452 N LEU A 31 -11.675 -4.327 -4.672 1.00 0.47 N ATOM 453 CA LEU A 31 -12.658 -3.964 -3.668 1.00 0.57 C ATOM 454 C LEU A 31 -13.815 -4.952 -3.713 1.00 0.58 C ATOM 455 O LEU A 31 -14.491 -5.086 -4.735 1.00 0.67 O ATOM 456 CB LEU A 31 -13.156 -2.525 -3.886 1.00 0.71 C ATOM 457 CG LEU A 31 -14.010 -1.921 -2.755 1.00 0.85 C ATOM 458 CD1 LEU A 31 -15.466 -2.350 -2.875 1.00 0.94 C ATOM 459 CD2 LEU A 31 -13.456 -2.315 -1.388 1.00 0.86 C ATOM 0 H LEU A 31 -11.795 -3.865 -5.573 1.00 0.47 H new ATOM 0 HA LEU A 31 -12.194 -4.005 -2.683 1.00 0.57 H new ATOM 0 HB2 LEU A 31 -12.289 -1.883 -4.041 1.00 0.71 H new ATOM 0 HB3 LEU A 31 -13.740 -2.500 -4.806 1.00 0.71 H new ATOM 0 HG LEU A 31 -13.965 -0.836 -2.851 1.00 0.85 H new ATOM 0 HD11 LEU A 31 -16.044 -1.908 -2.063 1.00 0.94 H new ATOM 0 HD12 LEU A 31 -15.867 -2.013 -3.831 1.00 0.94 H new ATOM 0 HD13 LEU A 31 -15.531 -3.437 -2.817 1.00 0.94 H new ATOM 0 HD21 LEU A 31 -14.075 -1.877 -0.605 1.00 0.86 H new ATOM 0 HD22 LEU A 31 -13.463 -3.401 -1.292 1.00 0.86 H new ATOM 0 HD23 LEU A 31 -12.434 -1.949 -1.290 1.00 0.86 H new ATOM 471 N LYS A 32 -14.023 -5.658 -2.614 1.00 0.56 N ATOM 472 CA LYS A 32 -15.124 -6.595 -2.518 1.00 0.60 C ATOM 473 C LYS A 32 -15.987 -6.262 -1.305 1.00 0.82 C ATOM 474 O LYS A 32 -16.405 -5.116 -1.142 1.00 1.33 O ATOM 475 CB LYS A 32 -14.615 -8.044 -2.462 1.00 0.62 C ATOM 476 CG LYS A 32 -13.630 -8.324 -1.336 1.00 0.65 C ATOM 477 CD LYS A 32 -12.186 -8.162 -1.789 1.00 0.90 C ATOM 478 CE LYS A 32 -11.837 -9.094 -2.941 1.00 1.10 C ATOM 479 NZ LYS A 32 -12.134 -10.517 -2.621 1.00 1.32 N ATOM 0 H LYS A 32 -13.443 -5.598 -1.777 1.00 0.56 H new ATOM 0 HA LYS A 32 -15.739 -6.504 -3.414 1.00 0.60 H new ATOM 0 HB2 LYS A 32 -15.470 -8.712 -2.355 1.00 0.62 H new ATOM 0 HB3 LYS A 32 -14.139 -8.286 -3.412 1.00 0.62 H new ATOM 0 HG2 LYS A 32 -13.827 -7.647 -0.505 1.00 0.65 H new ATOM 0 HG3 LYS A 32 -13.782 -9.337 -0.965 1.00 0.65 H new ATOM 0 HD2 LYS A 32 -12.017 -7.130 -2.095 1.00 0.90 H new ATOM 0 HD3 LYS A 32 -11.519 -8.359 -0.950 1.00 0.90 H new ATOM 0 HE2 LYS A 32 -12.397 -8.798 -3.828 1.00 1.10 H new ATOM 0 HE3 LYS A 32 -10.779 -8.991 -3.182 1.00 1.10 H new ATOM 0 HZ1 LYS A 32 -11.743 -11.129 -3.366 1.00 1.32 H new ATOM 0 HZ2 LYS A 32 -11.703 -10.765 -1.708 1.00 1.32 H new ATOM 0 HZ3 LYS A 32 -13.164 -10.653 -2.566 1.00 1.32 H new ATOM 493 N ASP A 33 -16.209 -7.243 -0.433 1.00 0.60 N ATOM 494 CA ASP A 33 -17.159 -7.088 0.660 1.00 0.94 C ATOM 495 C ASP A 33 -17.249 -8.331 1.516 1.00 0.53 C ATOM 496 O ASP A 33 -16.608 -9.343 1.237 1.00 1.46 O ATOM 497 CB ASP A 33 -18.545 -6.728 0.131 1.00 2.08 C ATOM 498 CG ASP A 33 -19.144 -7.778 -0.791 1.00 2.37 C ATOM 499 OD1 ASP A 33 -19.506 -8.870 -0.302 1.00 2.32 O ATOM 500 OD2 ASP A 33 -19.229 -7.530 -2.015 1.00 2.85 O ATOM 0 H ASP A 33 -15.744 -8.150 -0.464 1.00 0.60 H new ATOM 0 HA ASP A 33 -16.789 -6.274 1.284 1.00 0.94 H new ATOM 0 HB2 ASP A 33 -19.217 -6.574 0.975 1.00 2.08 H new ATOM 0 HB3 ASP A 33 -18.484 -5.781 -0.404 1.00 2.08 H new ATOM 571 N SER A 38 -18.923 -5.911 7.816 1.00 0.54 N ATOM 572 CA SER A 38 -17.637 -5.388 7.399 1.00 0.48 C ATOM 573 C SER A 38 -17.447 -5.776 5.953 1.00 0.50 C ATOM 574 O SER A 38 -18.200 -6.587 5.458 1.00 0.94 O ATOM 575 CB SER A 38 -16.515 -5.962 8.274 1.00 0.55 C ATOM 576 OG SER A 38 -15.249 -5.438 7.911 1.00 0.76 O ATOM 0 HA SER A 38 -17.604 -4.304 7.508 1.00 0.48 H new ATOM 0 HB2 SER A 38 -16.717 -5.734 9.321 1.00 0.55 H new ATOM 0 HB3 SER A 38 -16.500 -7.048 8.181 1.00 0.55 H new ATOM 0 HG SER A 38 -14.558 -5.823 8.489 1.00 0.76 H new ATOM 582 N VAL A 39 -16.509 -5.191 5.248 1.00 0.33 N ATOM 583 CA VAL A 39 -16.216 -5.659 3.920 1.00 0.35 C ATOM 584 C VAL A 39 -14.740 -5.920 3.739 1.00 0.31 C ATOM 585 O VAL A 39 -13.941 -5.741 4.662 1.00 0.34 O ATOM 586 CB VAL A 39 -16.713 -4.715 2.830 1.00 0.43 C ATOM 587 CG1 VAL A 39 -18.234 -4.677 2.795 1.00 0.86 C ATOM 588 CG2 VAL A 39 -16.134 -3.332 2.978 1.00 0.86 C ATOM 0 H VAL A 39 -15.945 -4.403 5.567 1.00 0.33 H new ATOM 0 HA VAL A 39 -16.761 -6.597 3.812 1.00 0.35 H new ATOM 0 HB VAL A 39 -16.363 -5.107 1.875 1.00 0.43 H new ATOM 0 HG11 VAL A 39 -18.563 -3.997 2.009 1.00 0.86 H new ATOM 0 HG12 VAL A 39 -18.618 -5.677 2.594 1.00 0.86 H new ATOM 0 HG13 VAL A 39 -18.612 -4.330 3.757 1.00 0.86 H new ATOM 0 HG21 VAL A 39 -16.514 -2.692 2.182 1.00 0.86 H new ATOM 0 HG22 VAL A 39 -16.422 -2.919 3.945 1.00 0.86 H new ATOM 0 HG23 VAL A 39 -15.047 -3.384 2.915 1.00 0.86 H new ATOM 598 N GLU A 40 -14.379 -6.373 2.558 1.00 0.33 N ATOM 599 CA GLU A 40 -13.021 -6.793 2.307 1.00 0.36 C ATOM 600 C GLU A 40 -12.430 -6.070 1.118 1.00 0.38 C ATOM 601 O GLU A 40 -13.150 -5.659 0.210 1.00 0.50 O ATOM 602 CB GLU A 40 -12.987 -8.292 2.040 1.00 0.52 C ATOM 603 CG GLU A 40 -13.286 -9.138 3.259 1.00 0.62 C ATOM 604 CD GLU A 40 -13.263 -10.622 2.945 1.00 0.89 C ATOM 605 OE1 GLU A 40 -13.663 -11.008 1.827 1.00 1.16 O ATOM 606 OE2 GLU A 40 -12.848 -11.414 3.814 1.00 1.19 O ATOM 0 H GLU A 40 -15.007 -6.459 1.759 1.00 0.33 H new ATOM 0 HA GLU A 40 -12.430 -6.552 3.190 1.00 0.36 H new ATOM 0 HB2 GLU A 40 -13.710 -8.529 1.259 1.00 0.52 H new ATOM 0 HB3 GLU A 40 -12.003 -8.561 1.656 1.00 0.52 H new ATOM 0 HG2 GLU A 40 -12.555 -8.922 4.038 1.00 0.62 H new ATOM 0 HG3 GLU A 40 -14.264 -8.867 3.656 1.00 0.62 H new ATOM 613 N TYR A 41 -11.118 -5.906 1.125 1.00 0.37 N ATOM 614 CA TYR A 41 -10.428 -5.504 -0.098 1.00 0.56 C ATOM 615 C TYR A 41 -9.161 -6.318 -0.276 1.00 0.43 C ATOM 616 O TYR A 41 -8.315 -6.371 0.606 1.00 0.40 O ATOM 617 CB TYR A 41 -10.096 -4.000 -0.140 1.00 0.89 C ATOM 618 CG TYR A 41 -8.879 -3.598 0.659 1.00 0.86 C ATOM 619 CD1 TYR A 41 -7.608 -3.659 0.098 1.00 1.65 C ATOM 620 CD2 TYR A 41 -8.991 -3.184 1.969 1.00 1.30 C ATOM 621 CE1 TYR A 41 -6.490 -3.336 0.832 1.00 2.63 C ATOM 622 CE2 TYR A 41 -7.875 -2.846 2.703 1.00 2.04 C ATOM 623 CZ TYR A 41 -6.630 -2.926 2.134 1.00 2.72 C ATOM 624 OH TYR A 41 -5.518 -2.613 2.879 1.00 3.73 O ATOM 0 H TYR A 41 -10.518 -6.040 1.939 1.00 0.37 H new ATOM 0 HA TYR A 41 -11.115 -5.699 -0.921 1.00 0.56 H new ATOM 0 HB2 TYR A 41 -9.946 -3.704 -1.178 1.00 0.89 H new ATOM 0 HB3 TYR A 41 -10.956 -3.442 0.229 1.00 0.89 H new ATOM 0 HD1 TYR A 41 -7.497 -3.965 -0.932 1.00 1.65 H new ATOM 0 HD2 TYR A 41 -9.967 -3.124 2.427 1.00 1.30 H new ATOM 0 HE1 TYR A 41 -5.509 -3.405 0.386 1.00 2.63 H new ATOM 0 HE2 TYR A 41 -7.981 -2.518 3.727 1.00 2.04 H new ATOM 0 HH TYR A 41 -4.950 -1.994 2.375 1.00 3.73 H new ATOM 634 N LEU A 42 -9.042 -6.989 -1.395 1.00 0.41 N ATOM 635 CA LEU A 42 -7.806 -7.695 -1.689 1.00 0.38 C ATOM 636 C LEU A 42 -6.845 -6.727 -2.365 1.00 0.34 C ATOM 637 O LEU A 42 -7.072 -6.320 -3.502 1.00 0.38 O ATOM 638 CB LEU A 42 -8.070 -8.911 -2.592 1.00 0.49 C ATOM 639 CG LEU A 42 -7.000 -10.021 -2.561 1.00 0.55 C ATOM 640 CD1 LEU A 42 -5.627 -9.479 -2.929 1.00 0.71 C ATOM 641 CD2 LEU A 42 -6.952 -10.685 -1.193 1.00 0.81 C ATOM 0 H LEU A 42 -9.767 -7.065 -2.109 1.00 0.41 H new ATOM 0 HA LEU A 42 -7.369 -8.065 -0.762 1.00 0.38 H new ATOM 0 HB2 LEU A 42 -9.027 -9.348 -2.308 1.00 0.49 H new ATOM 0 HB3 LEU A 42 -8.172 -8.561 -3.619 1.00 0.49 H new ATOM 0 HG LEU A 42 -7.280 -10.767 -3.304 1.00 0.55 H new ATOM 0 HD11 LEU A 42 -4.896 -10.287 -2.897 1.00 0.71 H new ATOM 0 HD12 LEU A 42 -5.659 -9.058 -3.934 1.00 0.71 H new ATOM 0 HD13 LEU A 42 -5.340 -8.703 -2.220 1.00 0.71 H new ATOM 0 HD21 LEU A 42 -6.190 -11.465 -1.194 1.00 0.81 H new ATOM 0 HD22 LEU A 42 -6.708 -9.940 -0.435 1.00 0.81 H new ATOM 0 HD23 LEU A 42 -7.923 -11.126 -0.969 1.00 0.81 H new ATOM 653 N ALA A 43 -5.777 -6.354 -1.681 1.00 0.33 N ATOM 654 CA ALA A 43 -4.810 -5.452 -2.279 1.00 0.36 C ATOM 655 C ALA A 43 -3.732 -6.237 -2.985 1.00 0.35 C ATOM 656 O ALA A 43 -2.979 -7.000 -2.376 1.00 0.37 O ATOM 657 CB ALA A 43 -4.210 -4.495 -1.264 1.00 0.42 C ATOM 0 H ALA A 43 -5.560 -6.655 -0.731 1.00 0.33 H new ATOM 0 HA ALA A 43 -5.339 -4.841 -3.010 1.00 0.36 H new ATOM 0 HB1 ALA A 43 -3.493 -3.841 -1.760 1.00 0.42 H new ATOM 0 HB2 ALA A 43 -5.002 -3.893 -0.819 1.00 0.42 H new ATOM 0 HB3 ALA A 43 -3.704 -5.063 -0.483 1.00 0.42 H new ATOM 663 N LYS A 44 -3.697 -6.057 -4.279 1.00 0.38 N ATOM 664 CA LYS A 44 -2.750 -6.725 -5.131 1.00 0.39 C ATOM 665 C LYS A 44 -1.459 -5.925 -5.134 1.00 0.36 C ATOM 666 O LYS A 44 -1.431 -4.761 -5.539 1.00 0.47 O ATOM 667 CB LYS A 44 -3.357 -6.826 -6.521 1.00 0.53 C ATOM 668 CG LYS A 44 -2.680 -7.800 -7.460 1.00 0.95 C ATOM 669 CD LYS A 44 -3.488 -7.911 -8.743 1.00 1.58 C ATOM 670 CE LYS A 44 -4.904 -8.402 -8.452 1.00 1.61 C ATOM 671 NZ LYS A 44 -5.893 -7.942 -9.466 1.00 2.63 N ATOM 0 H LYS A 44 -4.333 -5.434 -4.777 1.00 0.38 H new ATOM 0 HA LYS A 44 -2.524 -7.731 -4.778 1.00 0.39 H new ATOM 0 HB2 LYS A 44 -4.404 -7.113 -6.421 1.00 0.53 H new ATOM 0 HB3 LYS A 44 -3.340 -5.837 -6.978 1.00 0.53 H new ATOM 0 HG2 LYS A 44 -1.668 -7.463 -7.683 1.00 0.95 H new ATOM 0 HG3 LYS A 44 -2.593 -8.778 -6.986 1.00 0.95 H new ATOM 0 HD2 LYS A 44 -3.529 -6.940 -9.237 1.00 1.58 H new ATOM 0 HD3 LYS A 44 -2.994 -8.598 -9.431 1.00 1.58 H new ATOM 0 HE2 LYS A 44 -4.906 -9.491 -8.417 1.00 1.61 H new ATOM 0 HE3 LYS A 44 -5.210 -8.051 -7.467 1.00 1.61 H new ATOM 0 HZ1 LYS A 44 -6.756 -8.519 -9.396 1.00 2.63 H new ATOM 0 HZ2 LYS A 44 -6.129 -6.944 -9.293 1.00 2.63 H new ATOM 0 HZ3 LYS A 44 -5.486 -8.041 -10.418 1.00 2.63 H new ATOM 685 N VAL A 45 -0.402 -6.541 -4.661 1.00 0.31 N ATOM 686 CA VAL A 45 0.829 -5.832 -4.395 1.00 0.33 C ATOM 687 C VAL A 45 1.923 -6.236 -5.343 1.00 0.28 C ATOM 688 O VAL A 45 2.002 -7.381 -5.779 1.00 0.30 O ATOM 689 CB VAL A 45 1.310 -6.133 -2.973 1.00 0.44 C ATOM 690 CG1 VAL A 45 2.534 -5.312 -2.608 1.00 0.82 C ATOM 691 CG2 VAL A 45 0.188 -5.895 -1.986 1.00 0.51 C ATOM 0 H VAL A 45 -0.369 -7.539 -4.451 1.00 0.31 H new ATOM 0 HA VAL A 45 0.618 -4.770 -4.522 1.00 0.33 H new ATOM 0 HB VAL A 45 1.603 -7.182 -2.931 1.00 0.44 H new ATOM 0 HG11 VAL A 45 2.845 -5.554 -1.592 1.00 0.82 H new ATOM 0 HG12 VAL A 45 3.345 -5.541 -3.300 1.00 0.82 H new ATOM 0 HG13 VAL A 45 2.292 -4.251 -2.670 1.00 0.82 H new ATOM 0 HG21 VAL A 45 0.539 -6.112 -0.977 1.00 0.51 H new ATOM 0 HG22 VAL A 45 -0.132 -4.855 -2.043 1.00 0.51 H new ATOM 0 HG23 VAL A 45 -0.652 -6.547 -2.226 1.00 0.51 H new ATOM 701 N SER A 46 2.743 -5.279 -5.687 1.00 0.25 N ATOM 702 CA SER A 46 4.009 -5.565 -6.282 1.00 0.25 C ATOM 703 C SER A 46 5.075 -4.724 -5.592 1.00 0.24 C ATOM 704 O SER A 46 5.231 -3.537 -5.882 1.00 0.26 O ATOM 705 CB SER A 46 3.932 -5.298 -7.775 1.00 0.28 C ATOM 706 OG SER A 46 3.202 -6.320 -8.429 1.00 0.72 O ATOM 0 H SER A 46 2.548 -4.286 -5.561 1.00 0.25 H new ATOM 0 HA SER A 46 4.277 -6.614 -6.154 1.00 0.25 H new ATOM 0 HB2 SER A 46 3.456 -4.334 -7.953 1.00 0.28 H new ATOM 0 HB3 SER A 46 4.938 -5.239 -8.191 1.00 0.28 H new ATOM 0 HG SER A 46 2.752 -6.879 -7.762 1.00 0.72 H new ATOM 712 N VAL A 47 5.764 -5.336 -4.633 1.00 0.25 N ATOM 713 CA VAL A 47 6.776 -4.642 -3.864 1.00 0.28 C ATOM 714 C VAL A 47 8.116 -4.679 -4.575 1.00 0.28 C ATOM 715 O VAL A 47 8.565 -5.723 -5.054 1.00 0.30 O ATOM 716 CB VAL A 47 6.892 -5.148 -2.391 1.00 0.41 C ATOM 717 CG1 VAL A 47 6.574 -6.624 -2.258 1.00 1.14 C ATOM 718 CG2 VAL A 47 8.273 -4.855 -1.805 1.00 1.05 C ATOM 0 H VAL A 47 5.635 -6.314 -4.374 1.00 0.25 H new ATOM 0 HA VAL A 47 6.452 -3.604 -3.793 1.00 0.28 H new ATOM 0 HB VAL A 47 6.145 -4.595 -1.822 1.00 0.41 H new ATOM 0 HG11 VAL A 47 6.670 -6.924 -1.215 1.00 1.14 H new ATOM 0 HG12 VAL A 47 5.555 -6.809 -2.597 1.00 1.14 H new ATOM 0 HG13 VAL A 47 7.269 -7.202 -2.867 1.00 1.14 H new ATOM 0 HG21 VAL A 47 8.318 -5.221 -0.779 1.00 1.05 H new ATOM 0 HG22 VAL A 47 9.035 -5.355 -2.402 1.00 1.05 H new ATOM 0 HG23 VAL A 47 8.452 -3.780 -1.815 1.00 1.05 H new ATOM 728 N THR A 48 8.732 -3.516 -4.651 1.00 0.30 N ATOM 729 CA THR A 48 9.958 -3.343 -5.390 1.00 0.31 C ATOM 730 C THR A 48 11.103 -3.079 -4.439 1.00 0.34 C ATOM 731 O THR A 48 11.106 -2.071 -3.717 1.00 0.37 O ATOM 732 CB THR A 48 9.858 -2.177 -6.394 1.00 0.36 C ATOM 733 OG1 THR A 48 8.692 -2.327 -7.213 1.00 0.41 O ATOM 734 CG2 THR A 48 11.099 -2.110 -7.275 1.00 0.41 C ATOM 0 H THR A 48 8.393 -2.666 -4.200 1.00 0.30 H new ATOM 0 HA THR A 48 10.137 -4.263 -5.947 1.00 0.31 H new ATOM 0 HB THR A 48 9.783 -1.249 -5.827 1.00 0.36 H new ATOM 0 HG1 THR A 48 8.271 -1.452 -7.347 1.00 0.41 H new ATOM 0 HG21 THR A 48 11.004 -1.280 -7.975 1.00 0.41 H new ATOM 0 HG22 THR A 48 11.980 -1.960 -6.651 1.00 0.41 H new ATOM 0 HG23 THR A 48 11.202 -3.042 -7.830 1.00 0.41 H new ATOM 742 N ASN A 49 12.038 -4.018 -4.428 1.00 0.38 N ATOM 743 CA ASN A 49 13.273 -3.896 -3.672 1.00 0.44 C ATOM 744 C ASN A 49 14.333 -3.268 -4.577 1.00 0.42 C ATOM 745 O ASN A 49 14.466 -3.682 -5.721 1.00 0.46 O ATOM 746 CB ASN A 49 13.704 -5.298 -3.213 1.00 0.59 C ATOM 747 CG ASN A 49 15.199 -5.461 -2.996 1.00 0.73 C ATOM 748 OD1 ASN A 49 15.876 -4.582 -2.471 1.00 1.48 O ATOM 749 ND2 ASN A 49 15.724 -6.600 -3.425 1.00 0.76 N ATOM 0 H ASN A 49 11.959 -4.892 -4.948 1.00 0.38 H new ATOM 0 HA ASN A 49 13.139 -3.264 -2.794 1.00 0.44 H new ATOM 0 HB2 ASN A 49 13.187 -5.536 -2.283 1.00 0.59 H new ATOM 0 HB3 ASN A 49 13.376 -6.026 -3.956 1.00 0.59 H new ATOM 0 HD21 ASN A 49 16.725 -6.770 -3.324 1.00 0.76 H new ATOM 0 HD22 ASN A 49 15.127 -7.306 -3.856 1.00 0.76 H new ATOM 756 N PRO A 50 15.075 -2.252 -4.099 1.00 0.46 N ATOM 757 CA PRO A 50 16.077 -1.538 -4.907 1.00 0.51 C ATOM 758 C PRO A 50 17.477 -2.156 -4.858 1.00 0.53 C ATOM 759 O PRO A 50 18.417 -1.626 -5.454 1.00 0.65 O ATOM 760 CB PRO A 50 16.105 -0.178 -4.226 1.00 0.64 C ATOM 761 CG PRO A 50 15.920 -0.505 -2.785 1.00 0.73 C ATOM 762 CD PRO A 50 14.975 -1.681 -2.743 1.00 0.55 C ATOM 0 HA PRO A 50 15.818 -1.543 -5.966 1.00 0.51 H new ATOM 0 HB2 PRO A 50 17.048 0.339 -4.402 1.00 0.64 H new ATOM 0 HB3 PRO A 50 15.311 0.472 -4.595 1.00 0.64 H new ATOM 0 HG2 PRO A 50 16.872 -0.753 -2.316 1.00 0.73 H new ATOM 0 HG3 PRO A 50 15.509 0.346 -2.242 1.00 0.73 H new ATOM 0 HD2 PRO A 50 15.267 -2.403 -1.981 1.00 0.55 H new ATOM 0 HD3 PRO A 50 13.956 -1.369 -2.513 1.00 0.55 H new ATOM 770 N TYR A 51 17.613 -3.273 -4.169 1.00 0.53 N ATOM 771 CA TYR A 51 18.908 -3.880 -3.941 1.00 0.68 C ATOM 772 C TYR A 51 19.019 -5.140 -4.772 1.00 0.88 C ATOM 773 O TYR A 51 18.117 -5.974 -4.766 1.00 1.88 O ATOM 774 CB TYR A 51 19.103 -4.185 -2.454 1.00 0.74 C ATOM 775 CG TYR A 51 20.412 -4.863 -2.147 1.00 0.88 C ATOM 776 CD1 TYR A 51 21.606 -4.150 -2.139 1.00 1.22 C ATOM 777 CD2 TYR A 51 20.456 -6.219 -1.872 1.00 1.06 C ATOM 778 CE1 TYR A 51 22.804 -4.776 -1.867 1.00 1.63 C ATOM 779 CE2 TYR A 51 21.648 -6.849 -1.597 1.00 1.36 C ATOM 780 CZ TYR A 51 22.818 -6.127 -1.597 1.00 1.64 C ATOM 781 OH TYR A 51 24.005 -6.762 -1.330 1.00 2.08 O ATOM 0 H TYR A 51 16.833 -3.782 -3.754 1.00 0.53 H new ATOM 0 HA TYR A 51 19.693 -3.186 -4.241 1.00 0.68 H new ATOM 0 HB2 TYR A 51 19.044 -3.254 -1.889 1.00 0.74 H new ATOM 0 HB3 TYR A 51 18.285 -4.819 -2.111 1.00 0.74 H new ATOM 0 HD1 TYR A 51 21.595 -3.091 -2.349 1.00 1.22 H new ATOM 0 HD2 TYR A 51 19.540 -6.792 -1.873 1.00 1.06 H new ATOM 0 HE1 TYR A 51 23.725 -4.211 -1.866 1.00 1.63 H new ATOM 0 HE2 TYR A 51 21.664 -7.907 -1.382 1.00 1.36 H new ATOM 0 HH TYR A 51 23.837 -7.712 -1.160 1.00 2.08 H new ATOM 791 N SER A 52 20.138 -5.288 -5.455 1.00 0.69 N ATOM 792 CA SER A 52 20.277 -6.270 -6.515 1.00 0.66 C ATOM 793 C SER A 52 20.474 -7.700 -6.001 1.00 0.65 C ATOM 794 O SER A 52 21.099 -8.525 -6.666 1.00 0.77 O ATOM 795 CB SER A 52 21.433 -5.837 -7.402 1.00 0.80 C ATOM 796 OG SER A 52 22.592 -5.564 -6.628 1.00 1.51 O ATOM 0 H SER A 52 20.977 -4.731 -5.291 1.00 0.69 H new ATOM 0 HA SER A 52 19.346 -6.303 -7.081 1.00 0.66 H new ATOM 0 HB2 SER A 52 21.652 -6.620 -8.128 1.00 0.80 H new ATOM 0 HB3 SER A 52 21.150 -4.948 -7.966 1.00 0.80 H new ATOM 0 HG SER A 52 22.852 -6.369 -6.133 1.00 1.51 H new ATOM 802 N HIS A 53 19.910 -7.998 -4.840 1.00 0.58 N ATOM 803 CA HIS A 53 19.884 -9.348 -4.305 1.00 0.66 C ATOM 804 C HIS A 53 18.587 -9.540 -3.537 1.00 0.65 C ATOM 805 O HIS A 53 18.088 -8.595 -2.924 1.00 1.08 O ATOM 806 CB HIS A 53 21.073 -9.618 -3.368 1.00 0.74 C ATOM 807 CG HIS A 53 22.424 -9.533 -4.018 1.00 0.95 C ATOM 808 ND1 HIS A 53 23.277 -8.463 -3.842 1.00 1.06 N ATOM 809 CD2 HIS A 53 23.075 -10.394 -4.839 1.00 1.41 C ATOM 810 CE1 HIS A 53 24.385 -8.667 -4.525 1.00 1.43 C ATOM 811 NE2 HIS A 53 24.291 -9.829 -5.137 1.00 1.67 N ATOM 0 H HIS A 53 19.457 -7.307 -4.242 1.00 0.58 H new ATOM 0 HA HIS A 53 19.954 -10.048 -5.138 1.00 0.66 H new ATOM 0 HB2 HIS A 53 21.037 -8.905 -2.545 1.00 0.74 H new ATOM 0 HB3 HIS A 53 20.957 -10.611 -2.935 1.00 0.74 H new ATOM 0 HD1 HIS A 53 23.080 -7.641 -3.271 1.00 1.06 H new ATOM 0 HD2 HIS A 53 22.706 -11.346 -5.192 1.00 1.41 H new ATOM 0 HE1 HIS A 53 25.228 -7.994 -4.575 1.00 1.43 H new ATOM 820 N SER A 54 18.024 -10.736 -3.637 1.00 0.55 N ATOM 821 CA SER A 54 16.885 -11.155 -2.832 1.00 0.51 C ATOM 822 C SER A 54 17.005 -10.700 -1.392 1.00 0.47 C ATOM 823 O SER A 54 17.704 -11.325 -0.631 1.00 0.51 O ATOM 824 CB SER A 54 16.817 -12.690 -2.834 1.00 0.61 C ATOM 825 OG SER A 54 15.774 -13.169 -1.999 1.00 1.39 O ATOM 0 H SER A 54 18.349 -11.451 -4.287 1.00 0.55 H new ATOM 0 HA SER A 54 15.992 -10.706 -3.266 1.00 0.51 H new ATOM 0 HB2 SER A 54 16.661 -13.046 -3.852 1.00 0.61 H new ATOM 0 HB3 SER A 54 17.770 -13.097 -2.496 1.00 0.61 H new ATOM 0 HG SER A 54 15.758 -14.149 -2.025 1.00 1.39 H new ATOM 831 N ILE A 55 16.249 -9.696 -0.978 1.00 0.44 N ATOM 832 CA ILE A 55 16.334 -9.263 0.409 1.00 0.49 C ATOM 833 C ILE A 55 15.599 -10.279 1.246 1.00 0.58 C ATOM 834 O ILE A 55 15.042 -11.198 0.693 1.00 1.03 O ATOM 835 CB ILE A 55 15.723 -7.866 0.654 1.00 0.49 C ATOM 836 CG1 ILE A 55 14.389 -7.691 -0.070 1.00 0.47 C ATOM 837 CG2 ILE A 55 16.700 -6.782 0.244 1.00 0.48 C ATOM 838 CD1 ILE A 55 13.650 -6.430 0.320 1.00 0.56 C ATOM 0 H ILE A 55 15.590 -9.179 -1.560 1.00 0.44 H new ATOM 0 HA ILE A 55 17.388 -9.188 0.677 1.00 0.49 H new ATOM 0 HB ILE A 55 15.525 -7.777 1.722 1.00 0.49 H new ATOM 0 HG12 ILE A 55 14.567 -7.680 -1.145 1.00 0.47 H new ATOM 0 HG13 ILE A 55 13.756 -8.553 0.139 1.00 0.47 H new ATOM 0 HG21 ILE A 55 16.254 -5.804 0.423 1.00 0.48 H new ATOM 0 HG22 ILE A 55 17.615 -6.876 0.829 1.00 0.48 H new ATOM 0 HG23 ILE A 55 16.935 -6.885 -0.815 1.00 0.48 H new ATOM 0 HD11 ILE A 55 12.712 -6.372 -0.233 1.00 0.56 H new ATOM 0 HD12 ILE A 55 13.440 -6.447 1.389 1.00 0.56 H new ATOM 0 HD13 ILE A 55 14.264 -5.561 0.085 1.00 0.56 H new ATOM 850 N PRO A 56 15.662 -10.227 2.570 1.00 0.35 N ATOM 851 CA PRO A 56 14.965 -11.197 3.382 1.00 0.34 C ATOM 852 C PRO A 56 13.539 -10.790 3.738 1.00 0.30 C ATOM 853 O PRO A 56 12.579 -11.464 3.370 1.00 0.32 O ATOM 854 CB PRO A 56 15.814 -11.282 4.641 1.00 0.37 C ATOM 855 CG PRO A 56 16.764 -10.114 4.610 1.00 0.35 C ATOM 856 CD PRO A 56 16.445 -9.299 3.384 1.00 0.35 C ATOM 0 HA PRO A 56 14.852 -12.141 2.848 1.00 0.34 H new ATOM 0 HB2 PRO A 56 15.187 -11.246 5.532 1.00 0.37 H new ATOM 0 HB3 PRO A 56 16.362 -12.224 4.674 1.00 0.37 H new ATOM 0 HG2 PRO A 56 16.656 -9.509 5.510 1.00 0.35 H new ATOM 0 HG3 PRO A 56 17.797 -10.461 4.581 1.00 0.35 H new ATOM 0 HD2 PRO A 56 15.878 -8.402 3.632 1.00 0.35 H new ATOM 0 HD3 PRO A 56 17.349 -8.973 2.869 1.00 0.35 H new ATOM 864 N ILE A 57 13.395 -9.696 4.465 1.00 0.29 N ATOM 865 CA ILE A 57 12.110 -9.377 5.069 1.00 0.30 C ATOM 866 C ILE A 57 11.711 -7.943 4.769 1.00 0.27 C ATOM 867 O ILE A 57 12.562 -7.105 4.476 1.00 0.30 O ATOM 868 CB ILE A 57 12.166 -9.626 6.599 1.00 0.38 C ATOM 869 CG1 ILE A 57 12.555 -11.086 6.878 1.00 0.58 C ATOM 870 CG2 ILE A 57 10.836 -9.295 7.271 1.00 0.38 C ATOM 871 CD1 ILE A 57 11.453 -12.086 6.594 1.00 1.23 C ATOM 0 H ILE A 57 14.138 -9.022 4.651 1.00 0.29 H new ATOM 0 HA ILE A 57 11.351 -10.030 4.637 1.00 0.30 H new ATOM 0 HB ILE A 57 12.922 -8.964 7.020 1.00 0.38 H new ATOM 0 HG12 ILE A 57 13.426 -11.340 6.274 1.00 0.58 H new ATOM 0 HG13 ILE A 57 12.854 -11.178 7.922 1.00 0.58 H new ATOM 0 HG21 ILE A 57 10.913 -9.482 8.342 1.00 0.38 H new ATOM 0 HG22 ILE A 57 10.594 -8.246 7.102 1.00 0.38 H new ATOM 0 HG23 ILE A 57 10.050 -9.921 6.849 1.00 0.38 H new ATOM 0 HD11 ILE A 57 11.808 -13.092 6.817 1.00 1.23 H new ATOM 0 HD12 ILE A 57 10.588 -11.861 7.217 1.00 1.23 H new ATOM 0 HD13 ILE A 57 11.169 -12.026 5.543 1.00 1.23 H new ATOM 883 N CYS A 58 10.414 -7.675 4.790 1.00 0.26 N ATOM 884 CA CYS A 58 9.915 -6.342 4.540 1.00 0.24 C ATOM 885 C CYS A 58 8.674 -6.064 5.363 1.00 0.23 C ATOM 886 O CYS A 58 8.237 -6.875 6.175 1.00 0.25 O ATOM 887 CB CYS A 58 9.568 -6.143 3.071 1.00 0.26 C ATOM 888 SG CYS A 58 10.736 -6.890 1.913 1.00 1.15 S ATOM 0 H CYS A 58 9.691 -8.369 4.979 1.00 0.26 H new ATOM 0 HA CYS A 58 10.711 -5.652 4.822 1.00 0.24 H new ATOM 0 HB2 CYS A 58 8.577 -6.559 2.886 1.00 0.26 H new ATOM 0 HB3 CYS A 58 9.508 -5.074 2.867 1.00 0.26 H new ATOM 0 HG CYS A 58 10.345 -6.662 0.694 1.00 1.15 H new ATOM 894 N GLU A 59 8.131 -4.897 5.128 1.00 0.25 N ATOM 895 CA GLU A 59 6.954 -4.462 5.829 1.00 0.27 C ATOM 896 C GLU A 59 5.992 -3.775 4.897 1.00 0.29 C ATOM 897 O GLU A 59 6.314 -2.755 4.291 1.00 0.32 O ATOM 898 CB GLU A 59 7.333 -3.533 6.976 1.00 0.32 C ATOM 899 CG GLU A 59 6.150 -3.035 7.785 1.00 0.39 C ATOM 900 CD GLU A 59 6.573 -2.074 8.871 1.00 0.67 C ATOM 901 OE1 GLU A 59 6.757 -0.875 8.571 1.00 1.04 O ATOM 902 OE2 GLU A 59 6.736 -2.513 10.025 1.00 1.36 O ATOM 0 H GLU A 59 8.491 -4.226 4.449 1.00 0.25 H new ATOM 0 HA GLU A 59 6.459 -5.343 6.238 1.00 0.27 H new ATOM 0 HB2 GLU A 59 8.020 -4.056 7.641 1.00 0.32 H new ATOM 0 HB3 GLU A 59 7.871 -2.675 6.572 1.00 0.32 H new ATOM 0 HG2 GLU A 59 5.439 -2.543 7.122 1.00 0.39 H new ATOM 0 HG3 GLU A 59 5.634 -3.884 8.233 1.00 0.39 H new ATOM 909 N ILE A 60 4.824 -4.358 4.778 1.00 0.32 N ATOM 910 CA ILE A 60 3.727 -3.672 4.156 1.00 0.34 C ATOM 911 C ILE A 60 2.848 -3.035 5.230 1.00 0.31 C ATOM 912 O ILE A 60 2.159 -3.706 5.998 1.00 0.36 O ATOM 913 CB ILE A 60 2.899 -4.579 3.203 1.00 0.48 C ATOM 914 CG1 ILE A 60 3.031 -6.071 3.545 1.00 0.33 C ATOM 915 CG2 ILE A 60 3.321 -4.344 1.761 1.00 0.99 C ATOM 916 CD1 ILE A 60 2.291 -6.498 4.788 1.00 1.05 C ATOM 0 H ILE A 60 4.613 -5.301 5.103 1.00 0.32 H new ATOM 0 HA ILE A 60 4.144 -2.891 3.521 1.00 0.34 H new ATOM 0 HB ILE A 60 1.852 -4.307 3.335 1.00 0.48 H new ATOM 0 HG12 ILE A 60 2.666 -6.657 2.702 1.00 0.33 H new ATOM 0 HG13 ILE A 60 4.087 -6.310 3.667 1.00 0.33 H new ATOM 0 HG21 ILE A 60 2.735 -4.984 1.101 1.00 0.99 H new ATOM 0 HG22 ILE A 60 3.152 -3.300 1.498 1.00 0.99 H new ATOM 0 HG23 ILE A 60 4.379 -4.579 1.649 1.00 0.99 H new ATOM 0 HD11 ILE A 60 2.440 -7.565 4.952 1.00 1.05 H new ATOM 0 HD12 ILE A 60 2.670 -5.943 5.646 1.00 1.05 H new ATOM 0 HD13 ILE A 60 1.227 -6.295 4.666 1.00 1.05 H new ATOM 928 N SER A 61 2.941 -1.720 5.284 1.00 0.26 N ATOM 929 CA SER A 61 2.151 -0.931 6.206 1.00 0.25 C ATOM 930 C SER A 61 1.185 -0.087 5.406 1.00 0.24 C ATOM 931 O SER A 61 1.563 0.930 4.827 1.00 0.24 O ATOM 932 CB SER A 61 3.045 -0.074 7.106 1.00 0.29 C ATOM 933 OG SER A 61 4.013 0.641 6.362 1.00 0.83 O ATOM 0 H SER A 61 3.564 -1.171 4.692 1.00 0.26 H new ATOM 0 HA SER A 61 1.588 -1.588 6.869 1.00 0.25 H new ATOM 0 HB2 SER A 61 2.428 0.627 7.668 1.00 0.29 H new ATOM 0 HB3 SER A 61 3.546 -0.712 7.834 1.00 0.29 H new ATOM 0 HG SER A 61 4.596 0.009 5.891 1.00 0.83 H new ATOM 939 N PHE A 62 -0.061 -0.507 5.370 1.00 0.24 N ATOM 940 CA PHE A 62 -1.002 0.021 4.415 1.00 0.25 C ATOM 941 C PHE A 62 -2.066 0.815 5.125 1.00 0.26 C ATOM 942 O PHE A 62 -2.681 0.352 6.078 1.00 0.30 O ATOM 943 CB PHE A 62 -1.629 -1.105 3.580 1.00 0.27 C ATOM 944 CG PHE A 62 -1.999 -2.329 4.380 1.00 0.29 C ATOM 945 CD1 PHE A 62 -3.247 -2.430 4.979 1.00 0.31 C ATOM 946 CD2 PHE A 62 -1.105 -3.377 4.530 1.00 0.34 C ATOM 947 CE1 PHE A 62 -3.593 -3.552 5.708 1.00 0.37 C ATOM 948 CE2 PHE A 62 -1.447 -4.501 5.257 1.00 0.40 C ATOM 949 CZ PHE A 62 -2.670 -4.583 5.866 1.00 0.40 C ATOM 0 H PHE A 62 -0.444 -1.216 5.995 1.00 0.24 H new ATOM 0 HA PHE A 62 -0.468 0.682 3.733 1.00 0.25 H new ATOM 0 HB2 PHE A 62 -2.522 -0.723 3.086 1.00 0.27 H new ATOM 0 HB3 PHE A 62 -0.930 -1.394 2.795 1.00 0.27 H new ATOM 0 HD1 PHE A 62 -3.956 -1.622 4.874 1.00 0.31 H new ATOM 0 HD2 PHE A 62 -0.129 -3.314 4.073 1.00 0.34 H new ATOM 0 HE1 PHE A 62 -4.574 -3.629 6.153 1.00 0.37 H new ATOM 0 HE2 PHE A 62 -0.746 -5.318 5.345 1.00 0.40 H new ATOM 0 HZ PHE A 62 -2.919 -5.445 6.467 1.00 0.40 H new ATOM 959 N THR A 63 -2.237 2.021 4.676 1.00 0.25 N ATOM 960 CA THR A 63 -3.275 2.880 5.179 1.00 0.27 C ATOM 961 C THR A 63 -4.175 3.268 4.025 1.00 0.25 C ATOM 962 O THR A 63 -3.806 4.084 3.182 1.00 0.27 O ATOM 963 CB THR A 63 -2.695 4.140 5.850 1.00 0.32 C ATOM 964 OG1 THR A 63 -1.676 3.769 6.790 1.00 0.36 O ATOM 965 CG2 THR A 63 -3.783 4.920 6.570 1.00 0.38 C ATOM 0 H THR A 63 -1.660 2.442 3.948 1.00 0.25 H new ATOM 0 HA THR A 63 -3.842 2.344 5.940 1.00 0.27 H new ATOM 0 HB THR A 63 -2.266 4.772 5.072 1.00 0.32 H new ATOM 0 HG1 THR A 63 -1.311 4.575 7.211 1.00 0.36 H new ATOM 0 HG21 THR A 63 -3.349 5.805 7.036 1.00 0.38 H new ATOM 0 HG22 THR A 63 -4.547 5.224 5.854 1.00 0.38 H new ATOM 0 HG23 THR A 63 -4.235 4.291 7.337 1.00 0.38 H new ATOM 973 N PHE A 64 -5.337 2.664 3.967 1.00 0.24 N ATOM 974 CA PHE A 64 -6.234 2.883 2.866 1.00 0.24 C ATOM 975 C PHE A 64 -7.278 3.920 3.221 1.00 0.22 C ATOM 976 O PHE A 64 -7.889 3.874 4.280 1.00 0.23 O ATOM 977 CB PHE A 64 -6.894 1.581 2.446 1.00 0.27 C ATOM 978 CG PHE A 64 -6.278 0.983 1.217 1.00 0.43 C ATOM 979 CD1 PHE A 64 -6.591 1.460 -0.050 1.00 0.58 C ATOM 980 CD2 PHE A 64 -5.403 -0.076 1.325 1.00 0.65 C ATOM 981 CE1 PHE A 64 -6.038 0.889 -1.170 1.00 0.84 C ATOM 982 CE2 PHE A 64 -4.843 -0.647 0.206 1.00 0.90 C ATOM 983 CZ PHE A 64 -5.164 -0.168 -1.041 1.00 0.96 C ATOM 0 H PHE A 64 -5.682 2.015 4.674 1.00 0.24 H new ATOM 0 HA PHE A 64 -5.653 3.260 2.024 1.00 0.24 H new ATOM 0 HB2 PHE A 64 -6.826 0.865 3.265 1.00 0.27 H new ATOM 0 HB3 PHE A 64 -7.954 1.759 2.265 1.00 0.27 H new ATOM 0 HD1 PHE A 64 -7.276 2.288 -0.155 1.00 0.58 H new ATOM 0 HD2 PHE A 64 -5.153 -0.463 2.302 1.00 0.65 H new ATOM 0 HE1 PHE A 64 -6.288 1.268 -2.150 1.00 0.84 H new ATOM 0 HE2 PHE A 64 -4.152 -1.471 0.307 1.00 0.90 H new ATOM 0 HZ PHE A 64 -4.731 -0.620 -1.921 1.00 0.96 H new ATOM 993 N HIS A 65 -7.423 4.883 2.338 1.00 0.24 N ATOM 994 CA HIS A 65 -8.428 5.924 2.454 1.00 0.26 C ATOM 995 C HIS A 65 -9.294 5.845 1.219 1.00 0.24 C ATOM 996 O HIS A 65 -8.807 5.479 0.164 1.00 0.36 O ATOM 997 CB HIS A 65 -7.792 7.318 2.526 1.00 0.42 C ATOM 998 CG HIS A 65 -6.834 7.539 3.662 1.00 0.51 C ATOM 999 ND1 HIS A 65 -6.610 8.779 4.214 1.00 1.02 N ATOM 1000 CD2 HIS A 65 -6.040 6.683 4.342 1.00 0.53 C ATOM 1001 CE1 HIS A 65 -5.728 8.674 5.184 1.00 1.29 C ATOM 1002 NE2 HIS A 65 -5.366 7.410 5.290 1.00 1.02 N ATOM 0 H HIS A 65 -6.839 4.969 1.506 1.00 0.24 H new ATOM 0 HA HIS A 65 -9.002 5.774 3.369 1.00 0.26 H new ATOM 0 HB2 HIS A 65 -7.266 7.506 1.590 1.00 0.42 H new ATOM 0 HB3 HIS A 65 -8.589 8.058 2.598 1.00 0.42 H new ATOM 0 HD1 HIS A 65 -7.058 9.646 3.917 1.00 1.02 H new ATOM 0 HD2 HIS A 65 -5.952 5.620 4.170 1.00 0.53 H new ATOM 0 HE1 HIS A 65 -5.361 9.487 5.792 1.00 1.29 H new ATOM 1011 N SER A 66 -10.574 6.114 1.329 1.00 0.22 N ATOM 1012 CA SER A 66 -11.398 6.117 0.137 1.00 0.25 C ATOM 1013 C SER A 66 -11.673 7.535 -0.327 1.00 0.24 C ATOM 1014 O SER A 66 -10.790 8.175 -0.892 1.00 0.30 O ATOM 1015 CB SER A 66 -12.694 5.358 0.361 1.00 0.38 C ATOM 1016 OG SER A 66 -13.470 5.290 -0.820 1.00 1.27 O ATOM 0 H SER A 66 -11.058 6.328 2.201 1.00 0.22 H new ATOM 0 HA SER A 66 -10.846 5.604 -0.650 1.00 0.25 H new ATOM 0 HB2 SER A 66 -12.470 4.349 0.708 1.00 0.38 H new ATOM 0 HB3 SER A 66 -13.270 5.845 1.148 1.00 0.38 H new ATOM 0 HG SER A 66 -13.336 4.420 -1.250 1.00 1.27 H new ATOM 1022 N ALA A 67 -12.879 8.036 -0.051 1.00 0.24 N ATOM 1023 CA ALA A 67 -13.281 9.340 -0.542 1.00 0.28 C ATOM 1024 C ALA A 67 -12.323 10.386 -0.009 1.00 0.30 C ATOM 1025 O ALA A 67 -11.739 11.162 -0.764 1.00 0.36 O ATOM 1026 CB ALA A 67 -14.707 9.650 -0.121 1.00 0.32 C ATOM 0 H ALA A 67 -13.585 7.556 0.507 1.00 0.24 H new ATOM 0 HA ALA A 67 -13.248 9.345 -1.631 1.00 0.28 H new ATOM 0 HB1 ALA A 67 -14.992 10.632 -0.498 1.00 0.32 H new ATOM 0 HB2 ALA A 67 -15.379 8.895 -0.529 1.00 0.32 H new ATOM 0 HB3 ALA A 67 -14.774 9.645 0.967 1.00 0.32 H new ATOM 1032 N GLY A 68 -12.165 10.409 1.307 1.00 0.29 N ATOM 1033 CA GLY A 68 -11.079 11.142 1.917 1.00 0.32 C ATOM 1034 C GLY A 68 -10.994 10.773 3.381 1.00 0.34 C ATOM 1035 O GLY A 68 -10.389 11.474 4.188 1.00 0.39 O ATOM 0 H GLY A 68 -12.777 9.928 1.966 1.00 0.29 H new ATOM 0 HA2 GLY A 68 -10.140 10.909 1.415 1.00 0.32 H new ATOM 0 HA3 GLY A 68 -11.241 12.214 1.808 1.00 0.32 H new ATOM 1039 N ARG A 69 -11.622 9.644 3.712 1.00 0.36 N ATOM 1040 CA ARG A 69 -11.741 9.189 5.082 1.00 0.46 C ATOM 1041 C ARG A 69 -10.798 8.010 5.313 1.00 0.52 C ATOM 1042 O ARG A 69 -9.755 7.933 4.676 1.00 1.08 O ATOM 1043 CB ARG A 69 -13.205 8.827 5.346 1.00 0.48 C ATOM 1044 CG ARG A 69 -13.824 7.982 4.245 1.00 0.47 C ATOM 1045 CD ARG A 69 -15.325 8.192 4.151 1.00 0.58 C ATOM 1046 NE ARG A 69 -15.682 9.505 3.595 1.00 0.55 N ATOM 1047 CZ ARG A 69 -16.575 10.338 4.138 1.00 1.05 C ATOM 1048 NH1 ARG A 69 -17.045 10.122 5.359 1.00 1.97 N ATOM 1049 NH2 ARG A 69 -16.963 11.425 3.478 1.00 1.04 N ATOM 0 H ARG A 69 -12.060 9.024 3.031 1.00 0.36 H new ATOM 0 HA ARG A 69 -11.452 9.972 5.783 1.00 0.46 H new ATOM 0 HB2 ARG A 69 -13.274 8.287 6.291 1.00 0.48 H new ATOM 0 HB3 ARG A 69 -13.784 9.744 5.460 1.00 0.48 H new ATOM 0 HG2 ARG A 69 -13.361 8.233 3.290 1.00 0.47 H new ATOM 0 HG3 ARG A 69 -13.615 6.929 4.434 1.00 0.47 H new ATOM 0 HD2 ARG A 69 -15.759 7.409 3.529 1.00 0.58 H new ATOM 0 HD3 ARG A 69 -15.764 8.091 5.143 1.00 0.58 H new ATOM 0 HE ARG A 69 -15.217 9.800 2.737 1.00 0.55 H new ATOM 0 HH11 ARG A 69 -16.725 9.314 5.893 1.00 1.97 H new ATOM 0 HH12 ARG A 69 -17.726 10.764 5.764 1.00 1.97 H new ATOM 0 HH21 ARG A 69 -16.579 11.625 2.554 1.00 1.04 H new ATOM 0 HH22 ARG A 69 -17.645 12.059 3.895 1.00 1.04 H new ATOM 1063 N GLU A 70 -11.167 7.074 6.170 1.00 0.52 N ATOM 1064 CA GLU A 70 -10.235 6.050 6.593 1.00 0.52 C ATOM 1065 C GLU A 70 -10.803 4.667 6.308 1.00 0.67 C ATOM 1066 O GLU A 70 -11.627 4.157 7.063 1.00 1.28 O ATOM 1067 CB GLU A 70 -9.930 6.194 8.085 1.00 0.66 C ATOM 1068 CG GLU A 70 -8.761 5.347 8.564 1.00 1.35 C ATOM 1069 CD GLU A 70 -7.420 5.986 8.268 1.00 1.91 C ATOM 1070 OE1 GLU A 70 -6.872 5.758 7.179 1.00 2.61 O ATOM 1071 OE2 GLU A 70 -6.907 6.719 9.142 1.00 2.12 O ATOM 0 H GLU A 70 -12.097 7.004 6.582 1.00 0.52 H new ATOM 0 HA GLU A 70 -9.309 6.171 6.031 1.00 0.52 H new ATOM 0 HB2 GLU A 70 -9.719 7.241 8.302 1.00 0.66 H new ATOM 0 HB3 GLU A 70 -10.819 5.923 8.655 1.00 0.66 H new ATOM 0 HG2 GLU A 70 -8.852 5.182 9.638 1.00 1.35 H new ATOM 0 HG3 GLU A 70 -8.806 4.368 8.087 1.00 1.35 H new ATOM 1078 N ILE A 71 -10.362 4.087 5.211 1.00 0.28 N ATOM 1079 CA ILE A 71 -10.800 2.763 4.797 1.00 0.28 C ATOM 1080 C ILE A 71 -10.220 1.701 5.726 1.00 0.29 C ATOM 1081 O ILE A 71 -10.895 0.737 6.091 1.00 0.33 O ATOM 1082 CB ILE A 71 -10.378 2.499 3.330 1.00 0.31 C ATOM 1083 CG1 ILE A 71 -11.381 3.120 2.366 1.00 0.37 C ATOM 1084 CG2 ILE A 71 -10.224 1.024 3.040 1.00 0.30 C ATOM 1085 CD1 ILE A 71 -12.739 2.453 2.390 1.00 0.40 C ATOM 0 H ILE A 71 -9.689 4.518 4.578 1.00 0.28 H new ATOM 0 HA ILE A 71 -11.887 2.713 4.858 1.00 0.28 H new ATOM 0 HB ILE A 71 -9.404 2.967 3.186 1.00 0.31 H new ATOM 0 HG12 ILE A 71 -11.500 4.176 2.609 1.00 0.37 H new ATOM 0 HG13 ILE A 71 -10.979 3.069 1.354 1.00 0.37 H new ATOM 0 HG21 ILE A 71 -9.927 0.887 2.000 1.00 0.30 H new ATOM 0 HG22 ILE A 71 -9.461 0.602 3.694 1.00 0.30 H new ATOM 0 HG23 ILE A 71 -11.173 0.517 3.217 1.00 0.30 H new ATOM 0 HD11 ILE A 71 -13.400 2.948 1.679 1.00 0.40 H new ATOM 0 HD12 ILE A 71 -12.634 1.403 2.117 1.00 0.40 H new ATOM 0 HD13 ILE A 71 -13.163 2.527 3.392 1.00 0.40 H new ATOM 1097 N GLY A 72 -8.976 1.901 6.121 1.00 0.29 N ATOM 1098 CA GLY A 72 -8.333 0.973 7.026 1.00 0.36 C ATOM 1099 C GLY A 72 -6.842 1.195 7.092 1.00 0.34 C ATOM 1100 O GLY A 72 -6.301 1.977 6.318 1.00 0.49 O ATOM 0 H GLY A 72 -8.398 2.690 5.832 1.00 0.29 H new ATOM 0 HA2 GLY A 72 -8.761 1.082 8.023 1.00 0.36 H new ATOM 0 HA3 GLY A 72 -8.534 -0.048 6.703 1.00 0.36 H new ATOM 1104 N LYS A 73 -6.172 0.519 8.012 1.00 0.36 N ATOM 1105 CA LYS A 73 -4.723 0.623 8.121 1.00 0.35 C ATOM 1106 C LYS A 73 -4.161 -0.577 8.866 1.00 0.39 C ATOM 1107 O LYS A 73 -4.859 -1.211 9.661 1.00 0.47 O ATOM 1108 CB LYS A 73 -4.307 1.909 8.841 1.00 0.44 C ATOM 1109 CG LYS A 73 -4.570 1.881 10.337 1.00 0.61 C ATOM 1110 CD LYS A 73 -5.483 3.018 10.768 1.00 0.68 C ATOM 1111 CE LYS A 73 -4.768 4.358 10.700 1.00 1.26 C ATOM 1112 NZ LYS A 73 -5.645 5.482 11.124 1.00 1.81 N ATOM 0 H LYS A 73 -6.605 -0.106 8.692 1.00 0.36 H new ATOM 0 HA LYS A 73 -4.319 0.647 7.109 1.00 0.35 H new ATOM 0 HB2 LYS A 73 -3.245 2.083 8.671 1.00 0.44 H new ATOM 0 HB3 LYS A 73 -4.843 2.751 8.402 1.00 0.44 H new ATOM 0 HG2 LYS A 73 -5.023 0.928 10.609 1.00 0.61 H new ATOM 0 HG3 LYS A 73 -3.624 1.950 10.874 1.00 0.61 H new ATOM 0 HD2 LYS A 73 -6.365 3.041 10.128 1.00 0.68 H new ATOM 0 HD3 LYS A 73 -5.832 2.841 11.785 1.00 0.68 H new ATOM 0 HE2 LYS A 73 -3.883 4.329 11.336 1.00 1.26 H new ATOM 0 HE3 LYS A 73 -4.422 4.533 9.681 1.00 1.26 H new ATOM 0 HZ1 LYS A 73 -5.786 6.133 10.325 1.00 1.81 H new ATOM 0 HZ2 LYS A 73 -6.565 5.107 11.432 1.00 1.81 H new ATOM 0 HZ3 LYS A 73 -5.198 5.993 11.912 1.00 1.81 H new ATOM 1126 N GLY A 74 -2.907 -0.888 8.603 1.00 0.39 N ATOM 1127 CA GLY A 74 -2.241 -1.951 9.313 1.00 0.43 C ATOM 1128 C GLY A 74 -0.850 -2.177 8.786 1.00 0.34 C ATOM 1129 O GLY A 74 -0.557 -1.852 7.639 1.00 0.32 O ATOM 0 H GLY A 74 -2.333 -0.418 7.903 1.00 0.39 H new ATOM 0 HA2 GLY A 74 -2.194 -1.708 10.375 1.00 0.43 H new ATOM 0 HA3 GLY A 74 -2.820 -2.870 9.222 1.00 0.43 H new ATOM 1133 N LYS A 75 0.007 -2.728 9.617 1.00 0.37 N ATOM 1134 CA LYS A 75 1.366 -3.029 9.204 1.00 0.37 C ATOM 1135 C LYS A 75 1.740 -4.447 9.585 1.00 0.39 C ATOM 1136 O LYS A 75 1.472 -4.895 10.700 1.00 0.50 O ATOM 1137 CB LYS A 75 2.374 -2.036 9.786 1.00 0.56 C ATOM 1138 CG LYS A 75 2.276 -1.853 11.284 1.00 0.84 C ATOM 1139 CD LYS A 75 3.380 -0.935 11.801 1.00 0.90 C ATOM 1140 CE LYS A 75 3.318 0.442 11.155 1.00 1.17 C ATOM 1141 NZ LYS A 75 4.445 1.314 11.581 1.00 1.72 N ATOM 0 H LYS A 75 -0.209 -2.978 10.582 1.00 0.37 H new ATOM 0 HA LYS A 75 1.402 -2.935 8.119 1.00 0.37 H new ATOM 0 HB2 LYS A 75 3.381 -2.372 9.538 1.00 0.56 H new ATOM 0 HB3 LYS A 75 2.233 -1.069 9.304 1.00 0.56 H new ATOM 0 HG2 LYS A 75 1.302 -1.435 11.539 1.00 0.84 H new ATOM 0 HG3 LYS A 75 2.345 -2.823 11.777 1.00 0.84 H new ATOM 0 HD2 LYS A 75 3.292 -0.833 12.883 1.00 0.90 H new ATOM 0 HD3 LYS A 75 4.352 -1.387 11.602 1.00 0.90 H new ATOM 0 HE2 LYS A 75 3.335 0.334 10.071 1.00 1.17 H new ATOM 0 HE3 LYS A 75 2.373 0.920 11.413 1.00 1.17 H new ATOM 0 HZ1 LYS A 75 4.362 2.241 11.116 1.00 1.72 H new ATOM 0 HZ2 LYS A 75 4.416 1.440 12.613 1.00 1.72 H new ATOM 0 HZ3 LYS A 75 5.347 0.872 11.312 1.00 1.72 H new ATOM 1155 N ILE A 76 2.355 -5.152 8.651 1.00 0.35 N ATOM 1156 CA ILE A 76 2.732 -6.538 8.866 1.00 0.39 C ATOM 1157 C ILE A 76 4.108 -6.803 8.261 1.00 0.34 C ATOM 1158 O ILE A 76 4.331 -6.551 7.076 1.00 0.35 O ATOM 1159 CB ILE A 76 1.707 -7.517 8.234 1.00 0.45 C ATOM 1160 CG1 ILE A 76 0.316 -7.317 8.849 1.00 0.51 C ATOM 1161 CG2 ILE A 76 2.161 -8.961 8.410 1.00 0.56 C ATOM 1162 CD1 ILE A 76 -0.769 -8.150 8.197 1.00 0.73 C ATOM 0 H ILE A 76 2.605 -4.785 7.733 1.00 0.35 H new ATOM 0 HA ILE A 76 2.753 -6.708 9.943 1.00 0.39 H new ATOM 0 HB ILE A 76 1.647 -7.302 7.167 1.00 0.45 H new ATOM 0 HG12 ILE A 76 0.360 -7.562 9.910 1.00 0.51 H new ATOM 0 HG13 ILE A 76 0.045 -6.264 8.776 1.00 0.51 H new ATOM 0 HG21 ILE A 76 1.428 -9.630 7.960 1.00 0.56 H new ATOM 0 HG22 ILE A 76 3.127 -9.101 7.924 1.00 0.56 H new ATOM 0 HG23 ILE A 76 2.254 -9.186 9.472 1.00 0.56 H new ATOM 0 HD11 ILE A 76 -1.723 -7.953 8.687 1.00 0.73 H new ATOM 0 HD12 ILE A 76 -0.843 -7.889 7.141 1.00 0.73 H new ATOM 0 HD13 ILE A 76 -0.523 -9.208 8.293 1.00 0.73 H new ATOM 1174 N PRO A 77 5.065 -7.269 9.071 1.00 0.34 N ATOM 1175 CA PRO A 77 6.368 -7.702 8.569 1.00 0.32 C ATOM 1176 C PRO A 77 6.241 -8.983 7.749 1.00 0.33 C ATOM 1177 O PRO A 77 5.987 -10.057 8.294 1.00 0.44 O ATOM 1178 CB PRO A 77 7.194 -7.950 9.839 1.00 0.40 C ATOM 1179 CG PRO A 77 6.412 -7.335 10.954 1.00 0.57 C ATOM 1180 CD PRO A 77 4.973 -7.385 10.528 1.00 0.42 C ATOM 0 HA PRO A 77 6.824 -6.966 7.907 1.00 0.32 H new ATOM 0 HB2 PRO A 77 7.344 -9.017 10.007 1.00 0.40 H new ATOM 0 HB3 PRO A 77 8.183 -7.498 9.758 1.00 0.40 H new ATOM 0 HG2 PRO A 77 6.563 -7.883 11.884 1.00 0.57 H new ATOM 0 HG3 PRO A 77 6.730 -6.308 11.133 1.00 0.57 H new ATOM 0 HD2 PRO A 77 4.493 -8.316 10.831 1.00 0.42 H new ATOM 0 HD3 PRO A 77 4.393 -6.571 10.963 1.00 0.42 H new ATOM 1188 N ASP A 78 6.404 -8.865 6.439 1.00 0.30 N ATOM 1189 CA ASP A 78 6.200 -9.995 5.539 1.00 0.35 C ATOM 1190 C ASP A 78 7.519 -10.365 4.880 1.00 0.32 C ATOM 1191 O ASP A 78 8.328 -9.485 4.582 1.00 0.28 O ATOM 1192 CB ASP A 78 5.145 -9.645 4.477 1.00 0.39 C ATOM 1193 CG ASP A 78 4.748 -10.832 3.615 1.00 0.52 C ATOM 1194 OD1 ASP A 78 4.067 -11.747 4.123 1.00 0.79 O ATOM 1195 OD2 ASP A 78 5.121 -10.860 2.421 1.00 0.52 O ATOM 0 H ASP A 78 6.677 -7.999 5.974 1.00 0.30 H new ATOM 0 HA ASP A 78 5.838 -10.850 6.111 1.00 0.35 H new ATOM 0 HB2 ASP A 78 4.258 -9.250 4.972 1.00 0.39 H new ATOM 0 HB3 ASP A 78 5.532 -8.852 3.837 1.00 0.39 H new ATOM 1200 N PRO A 79 7.783 -11.669 4.692 1.00 0.39 N ATOM 1201 CA PRO A 79 8.987 -12.138 4.006 1.00 0.40 C ATOM 1202 C PRO A 79 9.070 -11.635 2.566 1.00 0.38 C ATOM 1203 O PRO A 79 8.607 -12.293 1.631 1.00 0.47 O ATOM 1204 CB PRO A 79 8.868 -13.668 4.038 1.00 0.52 C ATOM 1205 CG PRO A 79 7.432 -13.943 4.328 1.00 0.58 C ATOM 1206 CD PRO A 79 6.947 -12.788 5.156 1.00 0.49 C ATOM 0 HA PRO A 79 9.891 -11.767 4.490 1.00 0.40 H new ATOM 0 HB2 PRO A 79 9.168 -14.106 3.086 1.00 0.52 H new ATOM 0 HB3 PRO A 79 9.514 -14.097 4.804 1.00 0.52 H new ATOM 0 HG2 PRO A 79 6.858 -14.030 3.406 1.00 0.58 H new ATOM 0 HG3 PRO A 79 7.316 -14.884 4.866 1.00 0.58 H new ATOM 0 HD2 PRO A 79 5.887 -12.593 4.994 1.00 0.49 H new ATOM 0 HD3 PRO A 79 7.078 -12.974 6.222 1.00 0.49 H new ATOM 1214 N GLY A 80 9.646 -10.452 2.402 1.00 0.34 N ATOM 1215 CA GLY A 80 9.813 -9.873 1.086 1.00 0.40 C ATOM 1216 C GLY A 80 11.112 -10.297 0.445 1.00 0.35 C ATOM 1217 O GLY A 80 11.732 -9.537 -0.293 1.00 0.40 O ATOM 0 H GLY A 80 10.004 -9.879 3.166 1.00 0.34 H new ATOM 0 HA2 GLY A 80 8.980 -10.172 0.450 1.00 0.40 H new ATOM 0 HA3 GLY A 80 9.783 -8.786 1.161 1.00 0.40 H new ATOM 1221 N SER A 81 11.514 -11.518 0.732 1.00 0.34 N ATOM 1222 CA SER A 81 12.691 -12.102 0.142 1.00 0.36 C ATOM 1223 C SER A 81 12.406 -12.396 -1.331 1.00 0.37 C ATOM 1224 O SER A 81 11.499 -13.178 -1.635 1.00 0.43 O ATOM 1225 CB SER A 81 13.043 -13.370 0.926 1.00 0.41 C ATOM 1226 OG SER A 81 12.066 -14.383 0.735 1.00 0.62 O ATOM 0 H SER A 81 11.028 -12.133 1.385 1.00 0.34 H new ATOM 0 HA SER A 81 13.544 -11.425 0.188 1.00 0.36 H new ATOM 0 HB2 SER A 81 14.018 -13.738 0.608 1.00 0.41 H new ATOM 0 HB3 SER A 81 13.122 -13.134 1.987 1.00 0.41 H new ATOM 0 HG SER A 81 11.536 -14.180 -0.064 1.00 0.62 H new ATOM 1232 N LEU A 82 13.147 -11.774 -2.257 1.00 0.37 N ATOM 1233 CA LEU A 82 12.602 -11.666 -3.626 1.00 0.39 C ATOM 1234 C LEU A 82 13.655 -11.683 -4.738 1.00 0.49 C ATOM 1235 O LEU A 82 14.765 -12.148 -4.554 1.00 0.82 O ATOM 1236 CB LEU A 82 11.735 -10.395 -3.748 1.00 0.36 C ATOM 1237 CG LEU A 82 12.478 -9.086 -4.042 1.00 0.52 C ATOM 1238 CD1 LEU A 82 11.502 -7.927 -4.153 1.00 1.10 C ATOM 1239 CD2 LEU A 82 13.514 -8.802 -2.976 1.00 1.08 C ATOM 0 H LEU A 82 14.067 -11.360 -2.106 1.00 0.37 H new ATOM 0 HA LEU A 82 12.001 -12.564 -3.773 1.00 0.39 H new ATOM 0 HB2 LEU A 82 11.002 -10.556 -4.539 1.00 0.36 H new ATOM 0 HB3 LEU A 82 11.179 -10.271 -2.819 1.00 0.36 H new ATOM 0 HG LEU A 82 12.991 -9.199 -4.997 1.00 0.52 H new ATOM 0 HD11 LEU A 82 12.050 -7.008 -4.362 1.00 1.10 H new ATOM 0 HD12 LEU A 82 10.797 -8.121 -4.962 1.00 1.10 H new ATOM 0 HD13 LEU A 82 10.957 -7.819 -3.215 1.00 1.10 H new ATOM 0 HD21 LEU A 82 14.027 -7.869 -3.207 1.00 1.08 H new ATOM 0 HD22 LEU A 82 13.024 -8.716 -2.006 1.00 1.08 H new ATOM 0 HD23 LEU A 82 14.238 -9.616 -2.946 1.00 1.08 H new ATOM 1251 N LYS A 83 13.253 -11.180 -5.907 1.00 0.40 N ATOM 1252 CA LYS A 83 14.075 -11.192 -7.114 1.00 0.46 C ATOM 1253 C LYS A 83 15.466 -10.592 -6.890 1.00 0.47 C ATOM 1254 O LYS A 83 16.397 -11.294 -6.485 1.00 0.63 O ATOM 1255 CB LYS A 83 13.355 -10.428 -8.229 1.00 0.52 C ATOM 1256 CG LYS A 83 11.926 -10.904 -8.455 1.00 0.58 C ATOM 1257 CD LYS A 83 11.323 -10.311 -9.715 1.00 0.68 C ATOM 1258 CE LYS A 83 9.915 -10.834 -9.957 1.00 1.08 C ATOM 1259 NZ LYS A 83 9.884 -12.312 -10.132 1.00 1.84 N ATOM 0 H LYS A 83 12.338 -10.749 -6.041 1.00 0.40 H new ATOM 0 HA LYS A 83 14.220 -12.234 -7.398 1.00 0.46 H new ATOM 0 HB2 LYS A 83 13.343 -9.366 -7.984 1.00 0.52 H new ATOM 0 HB3 LYS A 83 13.918 -10.535 -9.156 1.00 0.52 H new ATOM 0 HG2 LYS A 83 11.913 -11.992 -8.524 1.00 0.58 H new ATOM 0 HG3 LYS A 83 11.313 -10.631 -7.596 1.00 0.58 H new ATOM 0 HD2 LYS A 83 11.300 -9.224 -9.632 1.00 0.68 H new ATOM 0 HD3 LYS A 83 11.954 -10.552 -10.570 1.00 0.68 H new ATOM 0 HE2 LYS A 83 9.277 -10.556 -9.118 1.00 1.08 H new ATOM 0 HE3 LYS A 83 9.500 -10.356 -10.845 1.00 1.08 H new ATOM 0 HZ1 LYS A 83 8.964 -12.596 -10.524 1.00 1.84 H new ATOM 0 HZ2 LYS A 83 10.642 -12.600 -10.783 1.00 1.84 H new ATOM 0 HZ3 LYS A 83 10.025 -12.774 -9.211 1.00 1.84 H new ATOM 1273 N ALA A 84 15.587 -9.288 -7.142 1.00 0.47 N ATOM 1274 CA ALA A 84 16.858 -8.584 -7.101 1.00 0.50 C ATOM 1275 C ALA A 84 16.654 -7.235 -7.743 1.00 0.58 C ATOM 1276 O ALA A 84 16.512 -7.160 -8.964 1.00 0.99 O ATOM 1277 CB ALA A 84 17.955 -9.339 -7.845 1.00 0.56 C ATOM 0 H ALA A 84 14.796 -8.691 -7.382 1.00 0.47 H new ATOM 0 HA ALA A 84 17.178 -8.491 -6.063 1.00 0.50 H new ATOM 0 HB1 ALA A 84 18.887 -8.776 -7.788 1.00 0.56 H new ATOM 0 HB2 ALA A 84 18.095 -10.319 -7.390 1.00 0.56 H new ATOM 0 HB3 ALA A 84 17.668 -9.462 -8.889 1.00 0.56 H new ATOM 1283 N LYS A 85 16.607 -6.191 -6.914 1.00 0.49 N ATOM 1284 CA LYS A 85 16.321 -4.826 -7.360 1.00 0.54 C ATOM 1285 C LYS A 85 15.200 -4.812 -8.401 1.00 0.53 C ATOM 1286 O LYS A 85 15.303 -4.182 -9.456 1.00 0.61 O ATOM 1287 CB LYS A 85 17.582 -4.130 -7.877 1.00 0.65 C ATOM 1288 CG LYS A 85 18.324 -4.915 -8.924 1.00 1.07 C ATOM 1289 CD LYS A 85 19.237 -4.030 -9.739 1.00 1.25 C ATOM 1290 CE LYS A 85 20.151 -4.856 -10.619 1.00 1.60 C ATOM 1291 NZ LYS A 85 21.053 -4.000 -11.430 1.00 1.84 N ATOM 0 H LYS A 85 16.767 -6.269 -5.910 1.00 0.49 H new ATOM 0 HA LYS A 85 15.974 -4.259 -6.496 1.00 0.54 H new ATOM 0 HB2 LYS A 85 17.306 -3.160 -8.291 1.00 0.65 H new ATOM 0 HB3 LYS A 85 18.251 -3.940 -7.037 1.00 0.65 H new ATOM 0 HG2 LYS A 85 18.910 -5.699 -8.445 1.00 1.07 H new ATOM 0 HG3 LYS A 85 17.610 -5.408 -9.584 1.00 1.07 H new ATOM 0 HD2 LYS A 85 18.641 -3.358 -10.357 1.00 1.25 H new ATOM 0 HD3 LYS A 85 19.834 -3.406 -9.073 1.00 1.25 H new ATOM 0 HE2 LYS A 85 20.746 -5.526 -9.998 1.00 1.60 H new ATOM 0 HE3 LYS A 85 19.552 -5.482 -11.280 1.00 1.60 H new ATOM 0 HZ1 LYS A 85 21.664 -4.600 -12.020 1.00 1.84 H new ATOM 0 HZ2 LYS A 85 20.485 -3.378 -12.040 1.00 1.84 H new ATOM 0 HZ3 LYS A 85 21.643 -3.421 -10.799 1.00 1.84 H new ATOM 1305 N ASP A 86 14.113 -5.496 -8.066 1.00 0.48 N ATOM 1306 CA ASP A 86 13.022 -5.720 -9.003 1.00 0.46 C ATOM 1307 C ASP A 86 11.694 -5.734 -8.254 1.00 0.40 C ATOM 1308 O ASP A 86 11.653 -5.470 -7.052 1.00 0.38 O ATOM 1309 CB ASP A 86 13.234 -7.048 -9.746 1.00 0.49 C ATOM 1310 CG ASP A 86 12.516 -7.106 -11.086 1.00 0.53 C ATOM 1311 OD1 ASP A 86 11.320 -7.464 -11.117 1.00 0.55 O ATOM 1312 OD2 ASP A 86 13.151 -6.802 -12.115 1.00 0.64 O ATOM 0 H ASP A 86 13.964 -5.908 -7.145 1.00 0.48 H new ATOM 0 HA ASP A 86 13.003 -4.912 -9.734 1.00 0.46 H new ATOM 0 HB2 ASP A 86 14.301 -7.201 -9.906 1.00 0.49 H new ATOM 0 HB3 ASP A 86 12.885 -7.868 -9.118 1.00 0.49 H new ATOM 1317 N MET A 87 10.628 -6.083 -8.953 1.00 0.39 N ATOM 1318 CA MET A 87 9.283 -5.956 -8.418 1.00 0.35 C ATOM 1319 C MET A 87 8.650 -7.328 -8.213 1.00 0.34 C ATOM 1320 O MET A 87 8.467 -8.088 -9.164 1.00 0.37 O ATOM 1321 CB MET A 87 8.430 -5.111 -9.368 1.00 0.35 C ATOM 1322 CG MET A 87 7.099 -4.683 -8.781 1.00 0.35 C ATOM 1323 SD MET A 87 6.102 -3.723 -9.939 1.00 0.41 S ATOM 1324 CE MET A 87 7.210 -2.361 -10.294 1.00 1.35 C ATOM 0 H MET A 87 10.669 -6.460 -9.900 1.00 0.39 H new ATOM 0 HA MET A 87 9.336 -5.462 -7.448 1.00 0.35 H new ATOM 0 HB2 MET A 87 8.993 -4.222 -9.653 1.00 0.35 H new ATOM 0 HB3 MET A 87 8.248 -5.679 -10.280 1.00 0.35 H new ATOM 0 HG2 MET A 87 6.541 -5.568 -8.474 1.00 0.35 H new ATOM 0 HG3 MET A 87 7.276 -4.091 -7.883 1.00 0.35 H new ATOM 0 HE1 MET A 87 6.680 -1.601 -10.868 1.00 1.35 H new ATOM 0 HE2 MET A 87 7.565 -1.928 -9.359 1.00 1.35 H new ATOM 0 HE3 MET A 87 8.060 -2.724 -10.872 1.00 1.35 H new ATOM 1334 N THR A 88 8.326 -7.640 -6.969 1.00 0.31 N ATOM 1335 CA THR A 88 7.730 -8.920 -6.623 1.00 0.30 C ATOM 1336 C THR A 88 6.253 -8.738 -6.279 1.00 0.27 C ATOM 1337 O THR A 88 5.865 -7.735 -5.692 1.00 0.27 O ATOM 1338 CB THR A 88 8.453 -9.583 -5.428 1.00 0.32 C ATOM 1339 OG1 THR A 88 8.070 -10.962 -5.317 1.00 0.77 O ATOM 1340 CG2 THR A 88 8.116 -8.873 -4.127 1.00 0.54 C ATOM 0 H THR A 88 8.468 -7.017 -6.174 1.00 0.31 H new ATOM 0 HA THR A 88 7.832 -9.572 -7.491 1.00 0.30 H new ATOM 0 HB THR A 88 9.526 -9.510 -5.608 1.00 0.32 H new ATOM 0 HG1 THR A 88 8.536 -11.371 -4.558 1.00 0.77 H new ATOM 0 HG21 THR A 88 8.637 -9.359 -3.302 1.00 0.54 H new ATOM 0 HG22 THR A 88 8.428 -7.831 -4.190 1.00 0.54 H new ATOM 0 HG23 THR A 88 7.041 -8.920 -3.955 1.00 0.54 H new ATOM 1348 N ALA A 89 5.434 -9.695 -6.655 1.00 0.27 N ATOM 1349 CA ALA A 89 4.024 -9.638 -6.354 1.00 0.28 C ATOM 1350 C ALA A 89 3.790 -10.089 -4.921 1.00 0.29 C ATOM 1351 O ALA A 89 4.383 -11.063 -4.450 1.00 0.48 O ATOM 1352 CB ALA A 89 3.225 -10.483 -7.332 1.00 0.31 C ATOM 0 H ALA A 89 5.724 -10.525 -7.172 1.00 0.27 H new ATOM 0 HA ALA A 89 3.681 -8.609 -6.458 1.00 0.28 H new ATOM 0 HB1 ALA A 89 2.165 -10.423 -7.083 1.00 0.31 H new ATOM 0 HB2 ALA A 89 3.382 -10.113 -8.345 1.00 0.31 H new ATOM 0 HB3 ALA A 89 3.554 -11.520 -7.270 1.00 0.31 H new ATOM 1358 N LEU A 90 2.942 -9.361 -4.234 1.00 0.27 N ATOM 1359 CA LEU A 90 2.660 -9.608 -2.839 1.00 0.30 C ATOM 1360 C LEU A 90 1.145 -9.575 -2.642 1.00 0.29 C ATOM 1361 O LEU A 90 0.413 -9.189 -3.560 1.00 0.32 O ATOM 1362 CB LEU A 90 3.389 -8.554 -1.993 1.00 0.35 C ATOM 1363 CG LEU A 90 3.252 -8.671 -0.474 1.00 0.40 C ATOM 1364 CD1 LEU A 90 4.606 -8.504 0.189 1.00 0.77 C ATOM 1365 CD2 LEU A 90 2.291 -7.618 0.049 1.00 0.72 C ATOM 0 H LEU A 90 2.425 -8.576 -4.629 1.00 0.27 H new ATOM 0 HA LEU A 90 3.018 -10.587 -2.521 1.00 0.30 H new ATOM 0 HB2 LEU A 90 4.449 -8.593 -2.242 1.00 0.35 H new ATOM 0 HB3 LEU A 90 3.028 -7.570 -2.292 1.00 0.35 H new ATOM 0 HG LEU A 90 2.859 -9.660 -0.236 1.00 0.40 H new ATOM 0 HD11 LEU A 90 4.495 -8.589 1.270 1.00 0.77 H new ATOM 0 HD12 LEU A 90 5.284 -9.279 -0.168 1.00 0.77 H new ATOM 0 HD13 LEU A 90 5.013 -7.524 -0.058 1.00 0.77 H new ATOM 0 HD21 LEU A 90 2.202 -7.712 1.131 1.00 0.72 H new ATOM 0 HD22 LEU A 90 2.668 -6.626 -0.199 1.00 0.72 H new ATOM 0 HD23 LEU A 90 1.312 -7.759 -0.409 1.00 0.72 H new ATOM 1377 N ASP A 91 0.668 -9.968 -1.473 1.00 0.35 N ATOM 1378 CA ASP A 91 -0.764 -10.097 -1.253 1.00 0.43 C ATOM 1379 C ASP A 91 -1.160 -9.484 0.088 1.00 0.43 C ATOM 1380 O ASP A 91 -0.613 -9.848 1.130 1.00 0.52 O ATOM 1381 CB ASP A 91 -1.154 -11.578 -1.307 1.00 0.63 C ATOM 1382 CG ASP A 91 -2.648 -11.812 -1.206 1.00 1.07 C ATOM 1383 OD1 ASP A 91 -3.352 -11.637 -2.223 1.00 1.67 O ATOM 1384 OD2 ASP A 91 -3.127 -12.139 -0.102 1.00 1.81 O ATOM 0 H ASP A 91 1.246 -10.202 -0.666 1.00 0.35 H new ATOM 0 HA ASP A 91 -1.297 -9.558 -2.036 1.00 0.43 H new ATOM 0 HB2 ASP A 91 -0.789 -12.008 -2.239 1.00 0.63 H new ATOM 0 HB3 ASP A 91 -0.655 -12.107 -0.495 1.00 0.63 H new ATOM 1389 N ILE A 92 -2.084 -8.535 0.059 1.00 0.39 N ATOM 1390 CA ILE A 92 -2.526 -7.861 1.277 1.00 0.38 C ATOM 1391 C ILE A 92 -3.905 -8.349 1.701 1.00 0.38 C ATOM 1392 O ILE A 92 -4.786 -8.553 0.860 1.00 0.54 O ATOM 1393 CB ILE A 92 -2.560 -6.325 1.087 1.00 0.43 C ATOM 1394 CG1 ILE A 92 -1.146 -5.768 0.926 1.00 0.52 C ATOM 1395 CG2 ILE A 92 -3.274 -5.624 2.237 1.00 0.52 C ATOM 1396 CD1 ILE A 92 -0.227 -6.093 2.079 1.00 0.65 C ATOM 0 H ILE A 92 -2.544 -8.212 -0.793 1.00 0.39 H new ATOM 0 HA ILE A 92 -1.806 -8.103 2.059 1.00 0.38 H new ATOM 0 HB ILE A 92 -3.125 -6.127 0.176 1.00 0.43 H new ATOM 0 HG12 ILE A 92 -0.713 -6.162 0.007 1.00 0.52 H new ATOM 0 HG13 ILE A 92 -1.203 -4.685 0.813 1.00 0.52 H new ATOM 0 HG21 ILE A 92 -3.275 -4.548 2.063 1.00 0.52 H new ATOM 0 HG22 ILE A 92 -4.302 -5.982 2.300 1.00 0.52 H new ATOM 0 HG23 ILE A 92 -2.757 -5.840 3.172 1.00 0.52 H new ATOM 0 HD11 ILE A 92 0.757 -5.664 1.892 1.00 0.65 H new ATOM 0 HD12 ILE A 92 -0.636 -5.675 2.999 1.00 0.65 H new ATOM 0 HD13 ILE A 92 -0.138 -7.175 2.180 1.00 0.65 H new ATOM 1408 N PRO A 93 -4.086 -8.565 3.019 1.00 0.41 N ATOM 1409 CA PRO A 93 -5.380 -8.922 3.612 1.00 0.55 C ATOM 1410 C PRO A 93 -6.501 -7.979 3.185 1.00 0.61 C ATOM 1411 O PRO A 93 -6.262 -6.896 2.650 1.00 1.07 O ATOM 1412 CB PRO A 93 -5.128 -8.816 5.115 1.00 0.67 C ATOM 1413 CG PRO A 93 -3.667 -9.057 5.270 1.00 0.70 C ATOM 1414 CD PRO A 93 -3.021 -8.498 4.033 1.00 0.52 C ATOM 0 HA PRO A 93 -5.711 -9.910 3.293 1.00 0.55 H new ATOM 0 HB2 PRO A 93 -5.410 -7.834 5.496 1.00 0.67 H new ATOM 0 HB3 PRO A 93 -5.712 -9.552 5.668 1.00 0.67 H new ATOM 0 HG2 PRO A 93 -3.284 -8.568 6.165 1.00 0.70 H new ATOM 0 HG3 PRO A 93 -3.456 -10.121 5.373 1.00 0.70 H new ATOM 0 HD2 PRO A 93 -2.680 -7.474 4.188 1.00 0.52 H new ATOM 0 HD3 PRO A 93 -2.150 -9.083 3.737 1.00 0.52 H new ATOM 1422 N VAL A 94 -7.723 -8.372 3.479 1.00 0.38 N ATOM 1423 CA VAL A 94 -8.879 -7.733 2.896 1.00 0.34 C ATOM 1424 C VAL A 94 -9.655 -6.936 3.935 1.00 0.34 C ATOM 1425 O VAL A 94 -10.641 -7.407 4.474 1.00 0.36 O ATOM 1426 CB VAL A 94 -9.796 -8.823 2.293 1.00 0.36 C ATOM 1427 CG1 VAL A 94 -9.230 -9.346 0.990 1.00 0.42 C ATOM 1428 CG2 VAL A 94 -9.953 -9.980 3.270 1.00 0.46 C ATOM 0 H VAL A 94 -7.939 -9.134 4.121 1.00 0.38 H new ATOM 0 HA VAL A 94 -8.544 -7.041 2.123 1.00 0.34 H new ATOM 0 HB VAL A 94 -10.769 -8.371 2.100 1.00 0.36 H new ATOM 0 HG11 VAL A 94 -9.893 -10.111 0.586 1.00 0.42 H new ATOM 0 HG12 VAL A 94 -9.144 -8.527 0.276 1.00 0.42 H new ATOM 0 HG13 VAL A 94 -8.245 -9.777 1.168 1.00 0.42 H new ATOM 0 HG21 VAL A 94 -10.601 -10.740 2.833 1.00 0.46 H new ATOM 0 HG22 VAL A 94 -8.975 -10.414 3.480 1.00 0.46 H new ATOM 0 HG23 VAL A 94 -10.395 -9.616 4.197 1.00 0.46 H new ATOM 1438 N VAL A 95 -9.299 -5.680 4.119 1.00 0.35 N ATOM 1439 CA VAL A 95 -9.774 -4.970 5.297 1.00 0.35 C ATOM 1440 C VAL A 95 -10.434 -3.621 5.008 1.00 0.36 C ATOM 1441 O VAL A 95 -9.763 -2.617 4.795 1.00 0.44 O ATOM 1442 CB VAL A 95 -8.609 -4.771 6.292 1.00 0.42 C ATOM 1443 CG1 VAL A 95 -7.418 -4.112 5.602 1.00 0.48 C ATOM 1444 CG2 VAL A 95 -9.052 -3.951 7.493 1.00 0.45 C ATOM 0 H VAL A 95 -8.702 -5.141 3.492 1.00 0.35 H new ATOM 0 HA VAL A 95 -10.555 -5.599 5.724 1.00 0.35 H new ATOM 0 HB VAL A 95 -8.300 -5.753 6.649 1.00 0.42 H new ATOM 0 HG11 VAL A 95 -6.608 -3.981 6.320 1.00 0.48 H new ATOM 0 HG12 VAL A 95 -7.077 -4.744 4.782 1.00 0.48 H new ATOM 0 HG13 VAL A 95 -7.717 -3.140 5.210 1.00 0.48 H new ATOM 0 HG21 VAL A 95 -8.213 -3.826 8.178 1.00 0.45 H new ATOM 0 HG22 VAL A 95 -9.396 -2.972 7.158 1.00 0.45 H new ATOM 0 HG23 VAL A 95 -9.865 -4.466 8.005 1.00 0.45 H new ATOM 1454 N VAL A 96 -11.750 -3.584 5.020 1.00 0.34 N ATOM 1455 CA VAL A 96 -12.434 -2.315 5.132 1.00 0.34 C ATOM 1456 C VAL A 96 -13.746 -2.490 5.878 1.00 0.36 C ATOM 1457 O VAL A 96 -14.622 -3.221 5.439 1.00 0.47 O ATOM 1458 CB VAL A 96 -12.642 -1.637 3.753 1.00 0.45 C ATOM 1459 CG1 VAL A 96 -12.934 -2.659 2.668 1.00 1.02 C ATOM 1460 CG2 VAL A 96 -13.746 -0.588 3.817 1.00 1.07 C ATOM 0 H VAL A 96 -12.357 -4.401 4.955 1.00 0.34 H new ATOM 0 HA VAL A 96 -11.799 -1.642 5.708 1.00 0.34 H new ATOM 0 HB VAL A 96 -11.710 -1.134 3.495 1.00 0.45 H new ATOM 0 HG11 VAL A 96 -13.074 -2.148 1.715 1.00 1.02 H new ATOM 0 HG12 VAL A 96 -12.098 -3.353 2.588 1.00 1.02 H new ATOM 0 HG13 VAL A 96 -13.840 -3.210 2.921 1.00 1.02 H new ATOM 0 HG21 VAL A 96 -13.869 -0.129 2.836 1.00 1.07 H new ATOM 0 HG22 VAL A 96 -14.681 -1.062 4.116 1.00 1.07 H new ATOM 0 HG23 VAL A 96 -13.478 0.178 4.545 1.00 1.07 H new ATOM 1470 N PRO A 97 -13.877 -1.873 7.055 1.00 0.34 N ATOM 1471 CA PRO A 97 -15.141 -1.870 7.773 1.00 0.36 C ATOM 1472 C PRO A 97 -16.233 -1.302 6.886 1.00 0.33 C ATOM 1473 O PRO A 97 -16.062 -0.228 6.309 1.00 0.34 O ATOM 1474 CB PRO A 97 -14.884 -0.961 8.978 1.00 0.41 C ATOM 1475 CG PRO A 97 -13.402 -0.946 9.145 1.00 0.48 C ATOM 1476 CD PRO A 97 -12.819 -1.144 7.771 1.00 0.36 C ATOM 0 HA PRO A 97 -15.468 -2.865 8.073 1.00 0.36 H new ATOM 0 HB2 PRO A 97 -15.271 0.043 8.804 1.00 0.41 H new ATOM 0 HB3 PRO A 97 -15.378 -1.343 9.872 1.00 0.41 H new ATOM 0 HG2 PRO A 97 -13.069 -0.002 9.576 1.00 0.48 H new ATOM 0 HG3 PRO A 97 -13.079 -1.737 9.822 1.00 0.48 H new ATOM 0 HD2 PRO A 97 -12.590 -0.193 7.290 1.00 0.36 H new ATOM 0 HD3 PRO A 97 -11.891 -1.715 7.806 1.00 0.36 H new ATOM 1484 N TYR A 98 -17.341 -2.022 6.755 1.00 0.35 N ATOM 1485 CA TYR A 98 -18.403 -1.603 5.849 1.00 0.37 C ATOM 1486 C TYR A 98 -18.879 -0.199 6.212 1.00 0.36 C ATOM 1487 O TYR A 98 -19.324 0.557 5.358 1.00 0.39 O ATOM 1488 CB TYR A 98 -19.574 -2.600 5.822 1.00 0.47 C ATOM 1489 CG TYR A 98 -20.605 -2.241 4.770 1.00 0.60 C ATOM 1490 CD1 TYR A 98 -20.240 -1.952 3.463 1.00 1.04 C ATOM 1491 CD2 TYR A 98 -21.958 -2.240 5.089 1.00 0.90 C ATOM 1492 CE1 TYR A 98 -21.197 -1.676 2.502 1.00 1.23 C ATOM 1493 CE2 TYR A 98 -22.916 -1.955 4.141 1.00 1.06 C ATOM 1494 CZ TYR A 98 -22.452 -1.490 2.834 1.00 1.08 C ATOM 1495 OH TYR A 98 -23.495 -1.419 1.902 1.00 1.31 O ATOM 0 H TYR A 98 -17.526 -2.889 7.259 1.00 0.35 H new ATOM 0 HA TYR A 98 -17.990 -1.584 4.840 1.00 0.37 H new ATOM 0 HB2 TYR A 98 -19.192 -3.602 5.627 1.00 0.47 H new ATOM 0 HB3 TYR A 98 -20.050 -2.625 6.802 1.00 0.47 H new ATOM 0 HD1 TYR A 98 -19.195 -1.942 3.192 1.00 1.04 H new ATOM 0 HD2 TYR A 98 -22.264 -2.467 6.100 1.00 0.90 H new ATOM 0 HE1 TYR A 98 -20.906 -1.613 1.464 1.00 1.23 H new ATOM 0 HE2 TYR A 98 -23.968 -2.070 4.354 1.00 1.06 H new ATOM 0 HH TYR A 98 -24.344 -1.277 2.371 1.00 1.31 H new ATOM 1505 N SER A 99 -18.743 0.140 7.489 1.00 0.37 N ATOM 1506 CA SER A 99 -19.064 1.467 7.994 1.00 0.41 C ATOM 1507 C SER A 99 -18.363 2.566 7.195 1.00 0.38 C ATOM 1508 O SER A 99 -18.871 3.681 7.066 1.00 0.39 O ATOM 1509 CB SER A 99 -18.621 1.543 9.448 1.00 0.50 C ATOM 1510 OG SER A 99 -19.171 0.470 10.191 1.00 1.20 O ATOM 0 H SER A 99 -18.405 -0.502 8.206 1.00 0.37 H new ATOM 0 HA SER A 99 -20.138 1.625 7.899 1.00 0.41 H new ATOM 0 HB2 SER A 99 -17.533 1.512 9.505 1.00 0.50 H new ATOM 0 HB3 SER A 99 -18.936 2.492 9.881 1.00 0.50 H new ATOM 0 HG SER A 99 -18.875 0.532 11.123 1.00 1.20 H new ATOM 1516 N ILE A 100 -17.194 2.253 6.666 1.00 0.36 N ATOM 1517 CA ILE A 100 -16.417 3.229 5.930 1.00 0.37 C ATOM 1518 C ILE A 100 -16.963 3.418 4.518 1.00 0.34 C ATOM 1519 O ILE A 100 -17.238 4.546 4.108 1.00 0.36 O ATOM 1520 CB ILE A 100 -14.937 2.836 5.882 1.00 0.41 C ATOM 1521 CG1 ILE A 100 -14.456 2.467 7.293 1.00 0.45 C ATOM 1522 CG2 ILE A 100 -14.124 3.981 5.308 1.00 0.48 C ATOM 1523 CD1 ILE A 100 -14.665 3.562 8.322 1.00 0.51 C ATOM 0 H ILE A 100 -16.764 1.331 6.733 1.00 0.36 H new ATOM 0 HA ILE A 100 -16.501 4.179 6.458 1.00 0.37 H new ATOM 0 HB ILE A 100 -14.805 1.967 5.237 1.00 0.41 H new ATOM 0 HG12 ILE A 100 -14.980 1.569 7.621 1.00 0.45 H new ATOM 0 HG13 ILE A 100 -13.395 2.220 7.251 1.00 0.45 H new ATOM 0 HG21 ILE A 100 -13.072 3.699 5.275 1.00 0.48 H new ATOM 0 HG22 ILE A 100 -14.472 4.204 4.299 1.00 0.48 H new ATOM 0 HG23 ILE A 100 -14.244 4.863 5.937 1.00 0.48 H new ATOM 0 HD11 ILE A 100 -14.300 3.224 9.292 1.00 0.51 H new ATOM 0 HD12 ILE A 100 -14.118 4.455 8.019 1.00 0.51 H new ATOM 0 HD13 ILE A 100 -15.727 3.795 8.395 1.00 0.51 H new ATOM 1535 N LEU A 101 -17.094 2.309 3.776 1.00 0.33 N ATOM 1536 CA LEU A 101 -17.797 2.315 2.477 1.00 0.34 C ATOM 1537 C LEU A 101 -19.162 2.977 2.620 1.00 0.34 C ATOM 1538 O LEU A 101 -19.662 3.620 1.705 1.00 0.36 O ATOM 1539 CB LEU A 101 -17.975 0.899 1.917 1.00 0.35 C ATOM 1540 CG LEU A 101 -16.701 0.194 1.445 1.00 0.41 C ATOM 1541 CD1 LEU A 101 -17.057 -1.071 0.682 1.00 0.89 C ATOM 1542 CD2 LEU A 101 -15.858 1.112 0.574 1.00 1.00 C ATOM 0 H LEU A 101 -16.725 1.398 4.048 1.00 0.33 H new ATOM 0 HA LEU A 101 -17.181 2.882 1.778 1.00 0.34 H new ATOM 0 HB2 LEU A 101 -18.443 0.283 2.685 1.00 0.35 H new ATOM 0 HB3 LEU A 101 -18.671 0.947 1.079 1.00 0.35 H new ATOM 0 HG LEU A 101 -16.114 -0.072 2.324 1.00 0.41 H new ATOM 0 HD11 LEU A 101 -16.144 -1.565 0.351 1.00 0.89 H new ATOM 0 HD12 LEU A 101 -17.617 -1.743 1.332 1.00 0.89 H new ATOM 0 HD13 LEU A 101 -17.666 -0.814 -0.185 1.00 0.89 H new ATOM 0 HD21 LEU A 101 -14.959 0.585 0.253 1.00 1.00 H new ATOM 0 HD22 LEU A 101 -16.434 1.413 -0.301 1.00 1.00 H new ATOM 0 HD23 LEU A 101 -15.575 1.997 1.145 1.00 1.00 H new ATOM 1554 N PHE A 102 -19.676 2.871 3.825 1.00 0.34 N ATOM 1555 CA PHE A 102 -20.982 3.405 4.160 1.00 0.36 C ATOM 1556 C PHE A 102 -20.904 4.933 4.131 1.00 0.35 C ATOM 1557 O PHE A 102 -21.793 5.615 3.642 1.00 0.36 O ATOM 1558 CB PHE A 102 -21.434 2.900 5.536 1.00 0.42 C ATOM 1559 CG PHE A 102 -22.911 3.024 5.779 1.00 0.57 C ATOM 1560 CD1 PHE A 102 -23.462 4.228 6.173 1.00 0.80 C ATOM 1561 CD2 PHE A 102 -23.745 1.931 5.614 1.00 0.74 C ATOM 1562 CE1 PHE A 102 -24.820 4.346 6.400 1.00 0.96 C ATOM 1563 CE2 PHE A 102 -25.104 2.041 5.838 1.00 0.90 C ATOM 1564 CZ PHE A 102 -25.642 3.250 6.231 1.00 0.94 C ATOM 0 H PHE A 102 -19.202 2.412 4.603 1.00 0.34 H new ATOM 0 HA PHE A 102 -21.720 3.067 3.433 1.00 0.36 H new ATOM 0 HB2 PHE A 102 -21.146 1.854 5.640 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -20.902 3.455 6.308 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -22.823 5.088 6.305 1.00 0.80 H new ATOM 0 HD2 PHE A 102 -23.329 0.983 5.307 1.00 0.74 H new ATOM 0 HE1 PHE A 102 -25.237 5.293 6.709 1.00 0.96 H new ATOM 0 HE2 PHE A 102 -25.745 1.182 5.706 1.00 0.90 H new ATOM 0 HZ PHE A 102 -26.704 3.338 6.406 1.00 0.94 H new ATOM 1574 N ASN A 103 -19.807 5.464 4.647 1.00 0.36 N ATOM 1575 CA ASN A 103 -19.578 6.905 4.655 1.00 0.38 C ATOM 1576 C ASN A 103 -19.206 7.443 3.272 1.00 0.36 C ATOM 1577 O ASN A 103 -19.850 8.361 2.775 1.00 0.38 O ATOM 1578 CB ASN A 103 -18.485 7.259 5.653 1.00 0.43 C ATOM 1579 CG ASN A 103 -19.011 7.450 7.063 1.00 0.49 C ATOM 1580 OD1 ASN A 103 -19.398 8.553 7.445 1.00 0.82 O ATOM 1581 ND2 ASN A 103 -19.034 6.385 7.846 1.00 0.49 N ATOM 0 H ASN A 103 -19.056 4.918 5.069 1.00 0.36 H new ATOM 0 HA ASN A 103 -20.516 7.375 4.951 1.00 0.38 H new ATOM 0 HB2 ASN A 103 -17.733 6.470 5.655 1.00 0.43 H new ATOM 0 HB3 ASN A 103 -17.987 8.173 5.330 1.00 0.43 H new ATOM 0 HD21 ASN A 103 -19.381 6.462 8.802 1.00 0.49 H new ATOM 0 HD22 ASN A 103 -18.705 5.486 7.494 1.00 0.49 H new ATOM 1588 N LEU A 104 -18.147 6.905 2.664 1.00 0.36 N ATOM 1589 CA LEU A 104 -17.739 7.345 1.329 1.00 0.39 C ATOM 1590 C LEU A 104 -18.855 7.208 0.286 1.00 0.37 C ATOM 1591 O LEU A 104 -19.251 8.203 -0.315 1.00 0.40 O ATOM 1592 CB LEU A 104 -16.497 6.571 0.883 1.00 0.45 C ATOM 1593 CG LEU A 104 -16.609 5.051 0.968 1.00 0.51 C ATOM 1594 CD1 LEU A 104 -16.740 4.430 -0.413 1.00 0.55 C ATOM 1595 CD2 LEU A 104 -15.417 4.479 1.702 1.00 0.65 C ATOM 0 H LEU A 104 -17.563 6.173 3.069 1.00 0.36 H new ATOM 0 HA LEU A 104 -17.508 8.408 1.400 1.00 0.39 H new ATOM 0 HB2 LEU A 104 -16.269 6.845 -0.147 1.00 0.45 H new ATOM 0 HB3 LEU A 104 -15.652 6.891 1.492 1.00 0.45 H new ATOM 0 HG LEU A 104 -17.513 4.807 1.526 1.00 0.51 H new ATOM 0 HD11 LEU A 104 -16.818 3.347 -0.319 1.00 0.55 H new ATOM 0 HD12 LEU A 104 -17.634 4.817 -0.903 1.00 0.55 H new ATOM 0 HD13 LEU A 104 -15.863 4.680 -1.009 1.00 0.55 H new ATOM 0 HD21 LEU A 104 -15.509 3.394 1.756 1.00 0.65 H new ATOM 0 HD22 LEU A 104 -14.502 4.740 1.169 1.00 0.65 H new ATOM 0 HD23 LEU A 104 -15.379 4.890 2.711 1.00 0.65 H new ATOM 1607 N ALA A 105 -19.400 6.002 0.118 1.00 0.35 N ATOM 1608 CA ALA A 105 -20.426 5.741 -0.902 1.00 0.38 C ATOM 1609 C ALA A 105 -21.672 6.553 -0.609 1.00 0.37 C ATOM 1610 O ALA A 105 -22.505 6.787 -1.468 1.00 0.39 O ATOM 1611 CB ALA A 105 -20.754 4.260 -0.986 1.00 0.43 C ATOM 0 H ALA A 105 -19.149 5.186 0.676 1.00 0.35 H new ATOM 0 HA ALA A 105 -20.030 6.046 -1.871 1.00 0.38 H new ATOM 0 HB1 ALA A 105 -21.516 4.099 -1.749 1.00 0.43 H new ATOM 0 HB2 ALA A 105 -19.855 3.702 -1.248 1.00 0.43 H new ATOM 0 HB3 ALA A 105 -21.127 3.915 -0.022 1.00 0.43 H new ATOM 1617 N ARG A 106 -21.790 6.934 0.636 1.00 0.36 N ATOM 1618 CA ARG A 106 -22.851 7.827 1.042 1.00 0.40 C ATOM 1619 C ARG A 106 -22.729 9.156 0.306 1.00 0.38 C ATOM 1620 O ARG A 106 -23.664 9.605 -0.341 1.00 0.40 O ATOM 1621 CB ARG A 106 -22.782 8.065 2.531 1.00 0.48 C ATOM 1622 CG ARG A 106 -23.728 9.120 3.047 1.00 0.53 C ATOM 1623 CD ARG A 106 -23.413 9.414 4.499 1.00 0.73 C ATOM 1624 NE ARG A 106 -22.761 8.266 5.123 1.00 0.91 N ATOM 1625 CZ ARG A 106 -22.844 7.954 6.406 1.00 1.38 C ATOM 1626 NH1 ARG A 106 -23.600 8.670 7.230 1.00 1.52 N ATOM 1627 NH2 ARG A 106 -22.180 6.898 6.854 1.00 1.81 N ATOM 0 H ARG A 106 -21.166 6.642 1.388 1.00 0.36 H new ATOM 0 HA ARG A 106 -23.808 7.369 0.794 1.00 0.40 H new ATOM 0 HB2 ARG A 106 -22.991 7.127 3.045 1.00 0.48 H new ATOM 0 HB3 ARG A 106 -21.763 8.351 2.792 1.00 0.48 H new ATOM 0 HG2 ARG A 106 -23.635 10.029 2.452 1.00 0.53 H new ATOM 0 HG3 ARG A 106 -24.759 8.779 2.949 1.00 0.53 H new ATOM 0 HD2 ARG A 106 -22.766 10.289 4.567 1.00 0.73 H new ATOM 0 HD3 ARG A 106 -24.331 9.654 5.035 1.00 0.73 H new ATOM 0 HE ARG A 106 -22.200 7.659 4.525 1.00 0.91 H new ATOM 0 HH11 ARG A 106 -24.124 9.470 6.876 1.00 1.52 H new ATOM 0 HH12 ARG A 106 -23.656 8.420 8.217 1.00 1.52 H new ATOM 0 HH21 ARG A 106 -21.616 6.340 6.213 1.00 1.81 H new ATOM 0 HH22 ARG A 106 -22.233 6.643 7.840 1.00 1.81 H new ATOM 1641 N ASP A 107 -21.559 9.766 0.399 1.00 0.37 N ATOM 1642 CA ASP A 107 -21.360 11.121 -0.106 1.00 0.41 C ATOM 1643 C ASP A 107 -21.017 11.125 -1.600 1.00 0.38 C ATOM 1644 O ASP A 107 -21.659 11.791 -2.422 1.00 0.41 O ATOM 1645 CB ASP A 107 -20.256 11.793 0.720 1.00 0.46 C ATOM 1646 CG ASP A 107 -20.004 13.236 0.340 1.00 0.57 C ATOM 1647 OD1 ASP A 107 -20.909 14.072 0.543 1.00 0.80 O ATOM 1648 OD2 ASP A 107 -18.910 13.540 -0.181 1.00 0.68 O ATOM 0 H ASP A 107 -20.730 9.347 0.819 1.00 0.37 H new ATOM 0 HA ASP A 107 -22.289 11.682 -0.002 1.00 0.41 H new ATOM 0 HB2 ASP A 107 -20.525 11.746 1.775 1.00 0.46 H new ATOM 0 HB3 ASP A 107 -19.331 11.229 0.601 1.00 0.46 H new ATOM 1653 N VAL A 108 -20.023 10.349 -1.969 1.00 0.34 N ATOM 1654 CA VAL A 108 -19.604 10.292 -3.357 1.00 0.33 C ATOM 1655 C VAL A 108 -20.522 9.391 -4.157 1.00 0.32 C ATOM 1656 O VAL A 108 -20.714 9.582 -5.345 1.00 0.37 O ATOM 1657 CB VAL A 108 -18.173 9.769 -3.480 1.00 0.32 C ATOM 1658 CG1 VAL A 108 -17.203 10.676 -2.763 1.00 0.77 C ATOM 1659 CG2 VAL A 108 -18.074 8.382 -2.926 1.00 0.88 C ATOM 0 H VAL A 108 -19.491 9.752 -1.336 1.00 0.34 H new ATOM 0 HA VAL A 108 -19.651 11.307 -3.751 1.00 0.33 H new ATOM 0 HB VAL A 108 -17.913 9.750 -4.538 1.00 0.32 H new ATOM 0 HG11 VAL A 108 -16.192 10.282 -2.866 1.00 0.77 H new ATOM 0 HG12 VAL A 108 -17.249 11.674 -3.198 1.00 0.77 H new ATOM 0 HG13 VAL A 108 -17.466 10.728 -1.707 1.00 0.77 H new ATOM 0 HG21 VAL A 108 -17.049 8.024 -3.021 1.00 0.88 H new ATOM 0 HG22 VAL A 108 -18.360 8.389 -1.874 1.00 0.88 H new ATOM 0 HG23 VAL A 108 -18.742 7.721 -3.479 1.00 0.88 H new ATOM 1669 N GLY A 109 -21.050 8.388 -3.481 1.00 0.29 N ATOM 1670 CA GLY A 109 -22.051 7.520 -4.066 1.00 0.30 C ATOM 1671 C GLY A 109 -23.410 8.181 -4.100 1.00 0.33 C ATOM 1672 O GLY A 109 -24.326 7.715 -4.782 1.00 0.38 O ATOM 0 H GLY A 109 -20.799 8.154 -2.520 1.00 0.29 H new ATOM 0 HA2 GLY A 109 -21.752 7.250 -5.079 1.00 0.30 H new ATOM 0 HA3 GLY A 109 -22.110 6.594 -3.493 1.00 0.30 H new ATOM 1676 N VAL A 110 -23.535 9.244 -3.309 1.00 0.37 N ATOM 1677 CA VAL A 110 -24.610 10.207 -3.515 1.00 0.46 C ATOM 1678 C VAL A 110 -24.601 10.554 -5.003 1.00 0.47 C ATOM 1679 O VAL A 110 -25.652 10.667 -5.641 1.00 0.54 O ATOM 1680 CB VAL A 110 -24.477 11.483 -2.634 1.00 0.56 C ATOM 1681 CG1 VAL A 110 -24.401 12.759 -3.467 1.00 1.09 C ATOM 1682 CG2 VAL A 110 -25.635 11.565 -1.648 1.00 0.78 C ATOM 0 H VAL A 110 -22.913 9.458 -2.529 1.00 0.37 H new ATOM 0 HA VAL A 110 -25.558 9.765 -3.210 1.00 0.46 H new ATOM 0 HB VAL A 110 -23.538 11.400 -2.086 1.00 0.56 H new ATOM 0 HG11 VAL A 110 -24.309 13.620 -2.805 1.00 1.09 H new ATOM 0 HG12 VAL A 110 -23.533 12.713 -4.125 1.00 1.09 H new ATOM 0 HG13 VAL A 110 -25.306 12.857 -4.066 1.00 1.09 H new ATOM 0 HG21 VAL A 110 -25.530 12.462 -1.038 1.00 0.78 H new ATOM 0 HG22 VAL A 110 -26.577 11.606 -2.195 1.00 0.78 H new ATOM 0 HG23 VAL A 110 -25.628 10.685 -1.004 1.00 0.78 H new ATOM 1692 N ASP A 111 -23.391 10.744 -5.545 1.00 0.45 N ATOM 1693 CA ASP A 111 -23.197 10.641 -6.999 1.00 0.52 C ATOM 1694 C ASP A 111 -23.198 9.170 -7.433 1.00 0.59 C ATOM 1695 O ASP A 111 -24.245 8.632 -7.799 1.00 1.05 O ATOM 1696 CB ASP A 111 -21.900 11.323 -7.454 1.00 0.60 C ATOM 1697 CG ASP A 111 -21.875 12.802 -7.144 1.00 1.30 C ATOM 1698 OD1 ASP A 111 -22.658 13.554 -7.757 1.00 1.86 O ATOM 1699 OD2 ASP A 111 -21.077 13.220 -6.275 1.00 1.87 O ATOM 0 H ASP A 111 -22.549 10.965 -5.014 1.00 0.45 H new ATOM 0 HA ASP A 111 -24.028 11.160 -7.476 1.00 0.52 H new ATOM 0 HB2 ASP A 111 -21.052 10.840 -6.968 1.00 0.60 H new ATOM 0 HB3 ASP A 111 -21.777 11.179 -8.527 1.00 0.60 H new ATOM 1704 N TRP A 112 -22.025 8.523 -7.373 1.00 0.43 N ATOM 1705 CA TRP A 112 -21.892 7.084 -7.666 1.00 0.45 C ATOM 1706 C TRP A 112 -20.429 6.626 -7.599 1.00 0.42 C ATOM 1707 O TRP A 112 -20.131 5.542 -7.115 1.00 0.43 O ATOM 1708 CB TRP A 112 -22.464 6.721 -9.049 1.00 0.57 C ATOM 1709 CG TRP A 112 -21.732 7.347 -10.198 1.00 0.64 C ATOM 1710 CD1 TRP A 112 -21.720 8.661 -10.572 1.00 0.72 C ATOM 1711 CD2 TRP A 112 -20.903 6.661 -11.122 1.00 0.78 C ATOM 1712 NE1 TRP A 112 -20.912 8.825 -11.674 1.00 0.83 N ATOM 1713 CE2 TRP A 112 -20.401 7.604 -12.032 1.00 0.86 C ATOM 1714 CE3 TRP A 112 -20.543 5.330 -11.254 1.00 0.96 C ATOM 1715 CZ2 TRP A 112 -19.542 7.249 -13.068 1.00 1.04 C ATOM 1716 CZ3 TRP A 112 -19.693 4.969 -12.278 1.00 1.16 C ATOM 1717 CH2 TRP A 112 -19.199 5.928 -13.177 1.00 1.17 C ATOM 0 H TRP A 112 -21.146 8.976 -7.122 1.00 0.43 H new ATOM 0 HA TRP A 112 -22.468 6.567 -6.898 1.00 0.45 H new ATOM 0 HB2 TRP A 112 -22.443 5.637 -9.166 1.00 0.57 H new ATOM 0 HB3 TRP A 112 -23.510 7.026 -9.089 1.00 0.57 H new ATOM 0 HD1 TRP A 112 -22.263 9.452 -10.077 1.00 0.72 H new ATOM 0 HE1 TRP A 112 -20.724 9.709 -12.147 1.00 0.83 H new ATOM 0 HE3 TRP A 112 -20.921 4.588 -10.567 1.00 0.96 H new ATOM 0 HZ2 TRP A 112 -19.161 7.987 -13.759 1.00 1.04 H new ATOM 0 HZ3 TRP A 112 -19.403 3.935 -12.390 1.00 1.16 H new ATOM 0 HH2 TRP A 112 -18.535 5.617 -13.970 1.00 1.17 H new ATOM 1728 N ASP A 113 -19.532 7.451 -8.100 1.00 0.42 N ATOM 1729 CA ASP A 113 -18.132 7.056 -8.218 1.00 0.42 C ATOM 1730 C ASP A 113 -17.328 7.487 -7.005 1.00 0.40 C ATOM 1731 O ASP A 113 -17.449 8.615 -6.523 1.00 0.50 O ATOM 1732 CB ASP A 113 -17.509 7.625 -9.497 1.00 0.51 C ATOM 1733 CG ASP A 113 -17.362 9.133 -9.475 1.00 1.26 C ATOM 1734 OD1 ASP A 113 -18.396 9.834 -9.503 1.00 2.15 O ATOM 1735 OD2 ASP A 113 -16.216 9.623 -9.404 1.00 1.61 O ATOM 0 H ASP A 113 -19.739 8.393 -8.431 1.00 0.42 H new ATOM 0 HA ASP A 113 -18.105 5.968 -8.271 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -16.528 7.174 -9.646 1.00 0.51 H new ATOM 0 HB3 ASP A 113 -18.124 7.340 -10.350 1.00 0.51 H new ATOM 1740 N ILE A 114 -16.528 6.560 -6.487 1.00 0.32 N ATOM 1741 CA ILE A 114 -15.701 6.834 -5.330 1.00 0.32 C ATOM 1742 C ILE A 114 -14.237 6.687 -5.704 1.00 0.32 C ATOM 1743 O ILE A 114 -13.875 5.892 -6.575 1.00 0.33 O ATOM 1744 CB ILE A 114 -15.979 5.896 -4.114 1.00 0.31 C ATOM 1745 CG1 ILE A 114 -17.470 5.569 -3.940 1.00 0.39 C ATOM 1746 CG2 ILE A 114 -15.444 6.536 -2.845 1.00 0.33 C ATOM 1747 CD1 ILE A 114 -17.999 4.558 -4.928 1.00 0.38 C ATOM 0 H ILE A 114 -16.439 5.613 -6.855 1.00 0.32 H new ATOM 0 HA ILE A 114 -15.948 7.851 -5.025 1.00 0.32 H new ATOM 0 HB ILE A 114 -15.467 4.954 -4.311 1.00 0.31 H new ATOM 0 HG12 ILE A 114 -17.633 5.193 -2.930 1.00 0.39 H new ATOM 0 HG13 ILE A 114 -18.046 6.489 -4.035 1.00 0.39 H new ATOM 0 HG21 ILE A 114 -15.639 5.880 -1.997 1.00 0.33 H new ATOM 0 HG22 ILE A 114 -14.370 6.694 -2.942 1.00 0.33 H new ATOM 0 HG23 ILE A 114 -15.939 7.494 -2.684 1.00 0.33 H new ATOM 0 HD11 ILE A 114 -19.058 4.383 -4.738 1.00 0.38 H new ATOM 0 HD12 ILE A 114 -17.871 4.938 -5.941 1.00 0.38 H new ATOM 0 HD13 ILE A 114 -17.451 3.622 -4.819 1.00 0.38 H new ATOM 1759 N ASP A 115 -13.411 7.452 -5.036 1.00 0.35 N ATOM 1760 CA ASP A 115 -11.978 7.383 -5.195 1.00 0.38 C ATOM 1761 C ASP A 115 -11.393 6.671 -3.985 1.00 0.34 C ATOM 1762 O ASP A 115 -12.032 6.608 -2.938 1.00 0.31 O ATOM 1763 CB ASP A 115 -11.391 8.789 -5.338 1.00 0.46 C ATOM 1764 CG ASP A 115 -11.697 9.671 -4.149 1.00 1.27 C ATOM 1765 OD1 ASP A 115 -12.887 10.001 -3.938 1.00 2.11 O ATOM 1766 OD2 ASP A 115 -10.748 10.058 -3.439 1.00 1.36 O ATOM 0 H ASP A 115 -13.717 8.149 -4.358 1.00 0.35 H new ATOM 0 HA ASP A 115 -11.728 6.828 -6.099 1.00 0.38 H new ATOM 0 HB2 ASP A 115 -10.311 8.717 -5.463 1.00 0.46 H new ATOM 0 HB3 ASP A 115 -11.786 9.253 -6.241 1.00 0.46 H new ATOM 1771 N TYR A 116 -10.231 6.066 -4.146 1.00 0.37 N ATOM 1772 CA TYR A 116 -9.542 5.422 -3.035 1.00 0.37 C ATOM 1773 C TYR A 116 -8.078 5.818 -3.081 1.00 0.40 C ATOM 1774 O TYR A 116 -7.584 6.197 -4.132 1.00 0.62 O ATOM 1775 CB TYR A 116 -9.656 3.891 -3.094 1.00 0.38 C ATOM 1776 CG TYR A 116 -11.068 3.360 -2.986 1.00 0.37 C ATOM 1777 CD1 TYR A 116 -11.940 3.439 -4.061 1.00 0.37 C ATOM 1778 CD2 TYR A 116 -11.528 2.781 -1.809 1.00 0.40 C ATOM 1779 CE1 TYR A 116 -13.230 2.957 -3.969 1.00 0.39 C ATOM 1780 CE2 TYR A 116 -12.815 2.296 -1.711 1.00 0.42 C ATOM 1781 CZ TYR A 116 -13.659 2.383 -2.779 1.00 0.41 C ATOM 1782 OH TYR A 116 -14.947 1.904 -2.698 1.00 0.45 O ATOM 0 H TYR A 116 -9.740 6.005 -5.038 1.00 0.37 H new ATOM 0 HA TYR A 116 -10.009 5.750 -2.106 1.00 0.37 H new ATOM 0 HB2 TYR A 116 -9.222 3.543 -4.031 1.00 0.38 H new ATOM 0 HB3 TYR A 116 -9.059 3.464 -2.288 1.00 0.38 H new ATOM 0 HD1 TYR A 116 -11.604 3.885 -4.986 1.00 0.37 H new ATOM 0 HD2 TYR A 116 -10.867 2.710 -0.958 1.00 0.40 H new ATOM 0 HE1 TYR A 116 -13.899 3.025 -4.814 1.00 0.39 H new ATOM 0 HE2 TYR A 116 -13.155 1.847 -0.789 1.00 0.42 H new ATOM 0 HH TYR A 116 -14.978 1.152 -2.070 1.00 0.45 H new ATOM 1792 N GLU A 117 -7.399 5.739 -1.950 1.00 0.27 N ATOM 1793 CA GLU A 117 -5.982 6.034 -1.872 1.00 0.28 C ATOM 1794 C GLU A 117 -5.320 5.094 -0.882 1.00 0.28 C ATOM 1795 O GLU A 117 -5.782 4.930 0.244 1.00 0.31 O ATOM 1796 CB GLU A 117 -5.722 7.479 -1.438 1.00 0.31 C ATOM 1797 CG GLU A 117 -4.238 7.795 -1.302 1.00 0.39 C ATOM 1798 CD GLU A 117 -3.970 9.102 -0.593 1.00 0.51 C ATOM 1799 OE1 GLU A 117 -4.252 9.194 0.618 1.00 0.80 O ATOM 1800 OE2 GLU A 117 -3.459 10.034 -1.240 1.00 0.66 O ATOM 0 H GLU A 117 -7.817 5.468 -1.060 1.00 0.27 H new ATOM 0 HA GLU A 117 -5.562 5.898 -2.869 1.00 0.28 H new ATOM 0 HB2 GLU A 117 -6.169 8.158 -2.164 1.00 0.31 H new ATOM 0 HB3 GLU A 117 -6.217 7.662 -0.484 1.00 0.31 H new ATOM 0 HG2 GLU A 117 -3.750 6.987 -0.757 1.00 0.39 H new ATOM 0 HG3 GLU A 117 -3.788 7.828 -2.294 1.00 0.39 H new ATOM 1807 N LEU A 118 -4.250 4.475 -1.313 1.00 0.29 N ATOM 1808 CA LEU A 118 -3.479 3.594 -0.469 1.00 0.28 C ATOM 1809 C LEU A 118 -2.213 4.298 -0.028 1.00 0.28 C ATOM 1810 O LEU A 118 -1.549 4.946 -0.824 1.00 0.32 O ATOM 1811 CB LEU A 118 -3.191 2.298 -1.252 1.00 0.35 C ATOM 1812 CG LEU A 118 -2.097 1.344 -0.743 1.00 0.40 C ATOM 1813 CD1 LEU A 118 -0.720 1.815 -1.177 1.00 1.24 C ATOM 1814 CD2 LEU A 118 -2.167 1.180 0.769 1.00 1.25 C ATOM 0 H LEU A 118 -3.887 4.567 -2.262 1.00 0.29 H new ATOM 0 HA LEU A 118 -4.030 3.330 0.434 1.00 0.28 H new ATOM 0 HB2 LEU A 118 -4.121 1.733 -1.305 1.00 0.35 H new ATOM 0 HB3 LEU A 118 -2.931 2.581 -2.272 1.00 0.35 H new ATOM 0 HG LEU A 118 -2.275 0.366 -1.190 1.00 0.40 H new ATOM 0 HD11 LEU A 118 0.035 1.123 -0.804 1.00 1.24 H new ATOM 0 HD12 LEU A 118 -0.674 1.851 -2.265 1.00 1.24 H new ATOM 0 HD13 LEU A 118 -0.532 2.810 -0.773 1.00 1.24 H new ATOM 0 HD21 LEU A 118 -1.381 0.500 1.098 1.00 1.25 H new ATOM 0 HD22 LEU A 118 -2.031 2.150 1.247 1.00 1.25 H new ATOM 0 HD23 LEU A 118 -3.139 0.772 1.046 1.00 1.25 H new ATOM 1826 N GLN A 119 -1.914 4.201 1.246 1.00 0.26 N ATOM 1827 CA GLN A 119 -0.658 4.694 1.774 1.00 0.27 C ATOM 1828 C GLN A 119 0.137 3.526 2.332 1.00 0.26 C ATOM 1829 O GLN A 119 -0.140 3.047 3.424 1.00 0.27 O ATOM 1830 CB GLN A 119 -0.895 5.727 2.874 1.00 0.30 C ATOM 1831 CG GLN A 119 0.360 6.495 3.258 1.00 0.37 C ATOM 1832 CD GLN A 119 0.722 7.582 2.263 1.00 0.46 C ATOM 1833 OE1 GLN A 119 1.320 8.592 2.624 1.00 0.63 O ATOM 1834 NE2 GLN A 119 0.365 7.390 1.006 1.00 0.51 N ATOM 0 H GLN A 119 -2.528 3.781 1.944 1.00 0.26 H new ATOM 0 HA GLN A 119 -0.103 5.176 0.969 1.00 0.27 H new ATOM 0 HB2 GLN A 119 -1.657 6.432 2.542 1.00 0.30 H new ATOM 0 HB3 GLN A 119 -1.289 5.224 3.757 1.00 0.30 H new ATOM 0 HG2 GLN A 119 0.217 6.944 4.241 1.00 0.37 H new ATOM 0 HG3 GLN A 119 1.193 5.798 3.344 1.00 0.37 H new ATOM 0 HE21 GLN A 119 -0.131 6.539 0.741 1.00 0.51 H new ATOM 0 HE22 GLN A 119 0.585 8.093 0.300 1.00 0.51 H new ATOM 1843 N ILE A 120 1.102 3.054 1.572 1.00 0.26 N ATOM 1844 CA ILE A 120 1.867 1.888 1.973 1.00 0.26 C ATOM 1845 C ILE A 120 3.298 2.279 2.333 1.00 0.23 C ATOM 1846 O ILE A 120 4.036 2.830 1.515 1.00 0.24 O ATOM 1847 CB ILE A 120 1.843 0.795 0.870 1.00 0.31 C ATOM 1848 CG1 ILE A 120 2.511 -0.489 1.347 1.00 0.45 C ATOM 1849 CG2 ILE A 120 2.491 1.273 -0.414 1.00 0.36 C ATOM 1850 CD1 ILE A 120 1.641 -1.305 2.269 1.00 0.81 C ATOM 0 H ILE A 120 1.376 3.456 0.676 1.00 0.26 H new ATOM 0 HA ILE A 120 1.399 1.466 2.863 1.00 0.26 H new ATOM 0 HB ILE A 120 0.794 0.585 0.660 1.00 0.31 H new ATOM 0 HG12 ILE A 120 2.779 -1.094 0.481 1.00 0.45 H new ATOM 0 HG13 ILE A 120 3.439 -0.239 1.861 1.00 0.45 H new ATOM 0 HG21 ILE A 120 2.453 0.478 -1.159 1.00 0.36 H new ATOM 0 HG22 ILE A 120 1.957 2.146 -0.788 1.00 0.36 H new ATOM 0 HG23 ILE A 120 3.530 1.539 -0.220 1.00 0.36 H new ATOM 0 HD11 ILE A 120 2.176 -2.205 2.572 1.00 0.81 H new ATOM 0 HD12 ILE A 120 1.394 -0.716 3.152 1.00 0.81 H new ATOM 0 HD13 ILE A 120 0.724 -1.585 1.751 1.00 0.81 H new ATOM 1862 N GLY A 121 3.663 2.053 3.584 1.00 0.23 N ATOM 1863 CA GLY A 121 5.014 2.303 4.021 1.00 0.23 C ATOM 1864 C GLY A 121 5.881 1.091 3.813 1.00 0.22 C ATOM 1865 O GLY A 121 5.554 0.003 4.294 1.00 0.26 O ATOM 0 H GLY A 121 3.040 1.698 4.309 1.00 0.23 H new ATOM 0 HA2 GLY A 121 5.427 3.149 3.471 1.00 0.23 H new ATOM 0 HA3 GLY A 121 5.014 2.578 5.076 1.00 0.23 H new ATOM 1869 N LEU A 122 6.970 1.259 3.097 1.00 0.23 N ATOM 1870 CA LEU A 122 7.836 0.147 2.788 1.00 0.25 C ATOM 1871 C LEU A 122 9.052 0.117 3.675 1.00 0.23 C ATOM 1872 O LEU A 122 10.026 0.834 3.455 1.00 0.30 O ATOM 1873 CB LEU A 122 8.256 0.165 1.329 1.00 0.30 C ATOM 1874 CG LEU A 122 7.438 -0.758 0.439 1.00 0.45 C ATOM 1875 CD1 LEU A 122 7.539 -2.196 0.926 1.00 1.20 C ATOM 1876 CD2 LEU A 122 5.994 -0.307 0.413 1.00 1.00 C ATOM 0 H LEU A 122 7.276 2.155 2.718 1.00 0.23 H new ATOM 0 HA LEU A 122 7.260 -0.760 2.975 1.00 0.25 H new ATOM 0 HB2 LEU A 122 8.175 1.184 0.951 1.00 0.30 H new ATOM 0 HB3 LEU A 122 9.306 -0.118 1.260 1.00 0.30 H new ATOM 0 HG LEU A 122 7.837 -0.712 -0.574 1.00 0.45 H new ATOM 0 HD11 LEU A 122 6.948 -2.842 0.277 1.00 1.20 H new ATOM 0 HD12 LEU A 122 8.581 -2.515 0.904 1.00 1.20 H new ATOM 0 HD13 LEU A 122 7.161 -2.262 1.946 1.00 1.20 H new ATOM 0 HD21 LEU A 122 5.416 -0.974 -0.227 1.00 1.00 H new ATOM 0 HD22 LEU A 122 5.587 -0.331 1.424 1.00 1.00 H new ATOM 0 HD23 LEU A 122 5.937 0.709 0.023 1.00 1.00 H new ATOM 1888 N THR A 123 8.959 -0.704 4.689 1.00 0.22 N ATOM 1889 CA THR A 123 10.088 -1.033 5.521 1.00 0.21 C ATOM 1890 C THR A 123 10.702 -2.327 5.028 1.00 0.23 C ATOM 1891 O THR A 123 10.256 -3.410 5.380 1.00 0.32 O ATOM 1892 CB THR A 123 9.656 -1.228 6.976 1.00 0.24 C ATOM 1893 OG1 THR A 123 9.068 -0.024 7.485 1.00 0.26 O ATOM 1894 CG2 THR A 123 10.832 -1.646 7.847 1.00 0.26 C ATOM 0 H THR A 123 8.092 -1.166 4.963 1.00 0.22 H new ATOM 0 HA THR A 123 10.806 -0.214 5.469 1.00 0.21 H new ATOM 0 HB THR A 123 8.914 -2.026 7.003 1.00 0.24 H new ATOM 0 HG1 THR A 123 8.150 -0.206 7.775 1.00 0.26 H new ATOM 0 HG21 THR A 123 10.495 -1.777 8.875 1.00 0.26 H new ATOM 0 HG22 THR A 123 11.243 -2.586 7.477 1.00 0.26 H new ATOM 0 HG23 THR A 123 11.602 -0.875 7.813 1.00 0.26 H new ATOM 1902 N ILE A 124 11.700 -2.225 4.202 1.00 0.20 N ATOM 1903 CA ILE A 124 12.334 -3.407 3.674 1.00 0.21 C ATOM 1904 C ILE A 124 13.692 -3.583 4.312 1.00 0.24 C ATOM 1905 O ILE A 124 14.372 -2.602 4.593 1.00 0.32 O ATOM 1906 CB ILE A 124 12.440 -3.337 2.137 1.00 0.23 C ATOM 1907 CG1 ILE A 124 13.009 -1.986 1.695 1.00 0.25 C ATOM 1908 CG2 ILE A 124 11.066 -3.564 1.520 1.00 0.25 C ATOM 1909 CD1 ILE A 124 13.110 -1.826 0.194 1.00 0.98 C ATOM 0 H ILE A 124 12.095 -1.342 3.877 1.00 0.20 H new ATOM 0 HA ILE A 124 11.722 -4.276 3.915 1.00 0.21 H new ATOM 0 HB ILE A 124 13.119 -4.117 1.794 1.00 0.23 H new ATOM 0 HG12 ILE A 124 12.381 -1.190 2.094 1.00 0.25 H new ATOM 0 HG13 ILE A 124 14.000 -1.859 2.132 1.00 0.25 H new ATOM 0 HG21 ILE A 124 11.142 -3.514 0.434 1.00 0.25 H new ATOM 0 HG22 ILE A 124 10.693 -4.545 1.813 1.00 0.25 H new ATOM 0 HG23 ILE A 124 10.378 -2.795 1.871 1.00 0.25 H new ATOM 0 HD11 ILE A 124 13.521 -0.844 -0.040 1.00 0.98 H new ATOM 0 HD12 ILE A 124 13.763 -2.599 -0.211 1.00 0.98 H new ATOM 0 HD13 ILE A 124 12.119 -1.919 -0.249 1.00 0.98 H new ATOM 1921 N ASP A 125 14.061 -4.819 4.598 1.00 0.25 N ATOM 1922 CA ASP A 125 15.347 -5.090 5.205 1.00 0.30 C ATOM 1923 C ASP A 125 16.391 -5.275 4.126 1.00 0.30 C ATOM 1924 O ASP A 125 16.414 -6.308 3.449 1.00 0.31 O ATOM 1925 CB ASP A 125 15.279 -6.335 6.098 1.00 0.37 C ATOM 1926 CG ASP A 125 14.634 -6.063 7.446 1.00 0.91 C ATOM 1927 OD1 ASP A 125 13.389 -5.959 7.500 1.00 1.52 O ATOM 1928 OD2 ASP A 125 15.359 -5.952 8.457 1.00 1.44 O ATOM 0 H ASP A 125 13.490 -5.645 4.420 1.00 0.25 H new ATOM 0 HA ASP A 125 15.623 -4.241 5.831 1.00 0.30 H new ATOM 0 HB2 ASP A 125 14.717 -7.115 5.583 1.00 0.37 H new ATOM 0 HB3 ASP A 125 16.287 -6.719 6.254 1.00 0.37 H new ATOM 1933 N LEU A 126 17.245 -4.260 3.980 1.00 0.32 N ATOM 1934 CA LEU A 126 18.308 -4.259 2.981 1.00 0.33 C ATOM 1935 C LEU A 126 19.632 -4.558 3.649 1.00 0.37 C ATOM 1936 O LEU A 126 19.887 -4.076 4.733 1.00 0.55 O ATOM 1937 CB LEU A 126 18.446 -2.901 2.270 1.00 0.42 C ATOM 1938 CG LEU A 126 17.199 -2.333 1.592 1.00 0.38 C ATOM 1939 CD1 LEU A 126 16.463 -3.399 0.799 1.00 1.26 C ATOM 1940 CD2 LEU A 126 16.289 -1.677 2.604 1.00 1.28 C ATOM 0 H LEU A 126 17.217 -3.417 4.553 1.00 0.32 H new ATOM 0 HA LEU A 126 18.046 -5.018 2.244 1.00 0.33 H new ATOM 0 HB2 LEU A 126 18.794 -2.171 3.001 1.00 0.42 H new ATOM 0 HB3 LEU A 126 19.227 -2.993 1.516 1.00 0.42 H new ATOM 0 HG LEU A 126 17.523 -1.569 0.885 1.00 0.38 H new ATOM 0 HD11 LEU A 126 15.582 -2.961 0.330 1.00 1.26 H new ATOM 0 HD12 LEU A 126 17.122 -3.800 0.029 1.00 1.26 H new ATOM 0 HD13 LEU A 126 16.156 -4.203 1.468 1.00 1.26 H new ATOM 0 HD21 LEU A 126 15.409 -1.280 2.098 1.00 1.28 H new ATOM 0 HD22 LEU A 126 15.980 -2.413 3.347 1.00 1.28 H new ATOM 0 HD23 LEU A 126 16.821 -0.864 3.098 1.00 1.28 H new ATOM 1952 N PRO A 127 20.505 -5.327 3.008 1.00 0.43 N ATOM 1953 CA PRO A 127 21.809 -5.674 3.585 1.00 0.52 C ATOM 1954 C PRO A 127 22.682 -4.456 3.936 1.00 0.60 C ATOM 1955 O PRO A 127 23.552 -4.548 4.800 1.00 0.74 O ATOM 1956 CB PRO A 127 22.473 -6.500 2.482 1.00 0.60 C ATOM 1957 CG PRO A 127 21.344 -7.036 1.675 1.00 0.73 C ATOM 1958 CD PRO A 127 20.286 -5.971 1.699 1.00 0.55 C ATOM 0 HA PRO A 127 21.688 -6.196 4.534 1.00 0.52 H new ATOM 0 HB2 PRO A 127 23.137 -5.886 1.874 1.00 0.60 H new ATOM 0 HB3 PRO A 127 23.077 -7.305 2.900 1.00 0.60 H new ATOM 0 HG2 PRO A 127 21.660 -7.251 0.654 1.00 0.73 H new ATOM 0 HG3 PRO A 127 20.970 -7.969 2.096 1.00 0.73 H new ATOM 0 HD2 PRO A 127 20.402 -5.266 0.876 1.00 0.55 H new ATOM 0 HD3 PRO A 127 19.284 -6.393 1.618 1.00 0.55 H new ATOM 1966 N VAL A 128 22.460 -3.324 3.267 1.00 0.60 N ATOM 1967 CA VAL A 128 23.330 -2.160 3.434 1.00 0.72 C ATOM 1968 C VAL A 128 23.046 -1.420 4.743 1.00 0.71 C ATOM 1969 O VAL A 128 23.926 -1.267 5.587 1.00 0.82 O ATOM 1970 CB VAL A 128 23.194 -1.173 2.254 1.00 0.83 C ATOM 1971 CG1 VAL A 128 24.228 -0.062 2.368 1.00 1.12 C ATOM 1972 CG2 VAL A 128 23.330 -1.900 0.924 1.00 1.02 C ATOM 0 H VAL A 128 21.692 -3.189 2.610 1.00 0.60 H new ATOM 0 HA VAL A 128 24.350 -2.544 3.461 1.00 0.72 H new ATOM 0 HB VAL A 128 22.201 -0.725 2.295 1.00 0.83 H new ATOM 0 HG11 VAL A 128 24.118 0.625 1.529 1.00 1.12 H new ATOM 0 HG12 VAL A 128 24.079 0.480 3.302 1.00 1.12 H new ATOM 0 HG13 VAL A 128 25.229 -0.494 2.355 1.00 1.12 H new ATOM 0 HG21 VAL A 128 23.231 -1.185 0.107 1.00 1.02 H new ATOM 0 HG22 VAL A 128 24.307 -2.380 0.870 1.00 1.02 H new ATOM 0 HG23 VAL A 128 22.549 -2.656 0.841 1.00 1.02 H new ATOM 1982 N VAL A 129 21.806 -0.978 4.905 1.00 0.62 N ATOM 1983 CA VAL A 129 21.404 -0.209 6.083 1.00 0.63 C ATOM 1984 C VAL A 129 20.629 -1.081 7.058 1.00 0.55 C ATOM 1985 O VAL A 129 20.162 -0.635 8.103 1.00 0.55 O ATOM 1986 CB VAL A 129 20.538 0.998 5.694 1.00 0.69 C ATOM 1987 CG1 VAL A 129 21.416 2.205 5.425 1.00 1.35 C ATOM 1988 CG2 VAL A 129 19.674 0.677 4.480 1.00 1.26 C ATOM 0 H VAL A 129 21.055 -1.138 4.234 1.00 0.62 H new ATOM 0 HA VAL A 129 22.317 0.149 6.560 1.00 0.63 H new ATOM 0 HB VAL A 129 19.873 1.230 6.526 1.00 0.69 H new ATOM 0 HG11 VAL A 129 20.792 3.055 5.150 1.00 1.35 H new ATOM 0 HG12 VAL A 129 21.985 2.448 6.322 1.00 1.35 H new ATOM 0 HG13 VAL A 129 22.103 1.981 4.609 1.00 1.35 H new ATOM 0 HG21 VAL A 129 19.070 1.547 4.223 1.00 1.26 H new ATOM 0 HG22 VAL A 129 20.314 0.418 3.636 1.00 1.26 H new ATOM 0 HG23 VAL A 129 19.020 -0.164 4.711 1.00 1.26 H new ATOM 1998 N GLY A 130 20.491 -2.323 6.664 1.00 0.53 N ATOM 1999 CA GLY A 130 19.726 -3.291 7.433 1.00 0.55 C ATOM 2000 C GLY A 130 18.250 -3.208 7.113 1.00 0.58 C ATOM 2001 O GLY A 130 17.576 -4.224 6.993 1.00 1.05 O ATOM 0 H GLY A 130 20.900 -2.696 5.808 1.00 0.53 H new ATOM 0 HA2 GLY A 130 20.090 -4.296 7.220 1.00 0.55 H new ATOM 0 HA3 GLY A 130 19.879 -3.115 8.498 1.00 0.55 H new ATOM 2005 N GLU A 131 17.765 -1.988 6.944 1.00 0.49 N ATOM 2006 CA GLU A 131 16.390 -1.734 6.564 1.00 0.46 C ATOM 2007 C GLU A 131 16.243 -0.277 6.155 1.00 0.49 C ATOM 2008 O GLU A 131 17.045 0.568 6.554 1.00 0.75 O ATOM 2009 CB GLU A 131 15.418 -2.048 7.709 1.00 0.59 C ATOM 2010 CG GLU A 131 15.440 -1.028 8.837 1.00 0.73 C ATOM 2011 CD GLU A 131 14.329 -1.248 9.843 1.00 0.93 C ATOM 2012 OE1 GLU A 131 14.217 -2.369 10.376 1.00 1.01 O ATOM 2013 OE2 GLU A 131 13.555 -0.301 10.099 1.00 1.16 O ATOM 0 H GLU A 131 18.321 -1.142 7.068 1.00 0.49 H new ATOM 0 HA GLU A 131 16.143 -2.388 5.728 1.00 0.46 H new ATOM 0 HB2 GLU A 131 14.407 -2.108 7.307 1.00 0.59 H new ATOM 0 HB3 GLU A 131 15.658 -3.030 8.116 1.00 0.59 H new ATOM 0 HG2 GLU A 131 16.402 -1.077 9.347 1.00 0.73 H new ATOM 0 HG3 GLU A 131 15.352 -0.026 8.417 1.00 0.73 H new ATOM 2020 N PHE A 132 15.249 0.004 5.336 1.00 0.39 N ATOM 2021 CA PHE A 132 14.927 1.375 4.980 1.00 0.48 C ATOM 2022 C PHE A 132 13.417 1.519 4.855 1.00 0.35 C ATOM 2023 O PHE A 132 12.745 0.603 4.376 1.00 0.33 O ATOM 2024 CB PHE A 132 15.622 1.755 3.669 1.00 0.69 C ATOM 2025 CG PHE A 132 15.849 3.233 3.503 1.00 1.02 C ATOM 2026 CD1 PHE A 132 16.856 3.881 4.200 1.00 1.22 C ATOM 2027 CD2 PHE A 132 15.044 3.975 2.652 1.00 1.31 C ATOM 2028 CE1 PHE A 132 17.055 5.240 4.051 1.00 1.66 C ATOM 2029 CE2 PHE A 132 15.239 5.335 2.500 1.00 1.74 C ATOM 2030 CZ PHE A 132 16.295 5.959 3.189 1.00 1.91 C ATOM 0 H PHE A 132 14.649 -0.698 4.903 1.00 0.39 H new ATOM 0 HA PHE A 132 15.283 2.050 5.758 1.00 0.48 H new ATOM 0 HB2 PHE A 132 16.582 1.242 3.617 1.00 0.69 H new ATOM 0 HB3 PHE A 132 15.022 1.394 2.834 1.00 0.69 H new ATOM 0 HD1 PHE A 132 17.492 3.318 4.867 1.00 1.22 H new ATOM 0 HD2 PHE A 132 14.255 3.484 2.101 1.00 1.31 H new ATOM 0 HE1 PHE A 132 17.823 5.734 4.627 1.00 1.66 H new ATOM 0 HE2 PHE A 132 14.588 5.912 1.860 1.00 1.74 H new ATOM 0 HZ PHE A 132 16.500 7.008 3.032 1.00 1.91 H new ATOM 2040 N THR A 133 12.885 2.652 5.295 1.00 0.37 N ATOM 2041 CA THR A 133 11.439 2.847 5.330 1.00 0.32 C ATOM 2042 C THR A 133 11.013 4.070 4.523 1.00 0.31 C ATOM 2043 O THR A 133 11.266 5.209 4.919 1.00 0.36 O ATOM 2044 CB THR A 133 10.927 3.002 6.779 1.00 0.44 C ATOM 2045 OG1 THR A 133 11.291 1.855 7.560 1.00 1.19 O ATOM 2046 CG2 THR A 133 9.413 3.179 6.811 1.00 1.17 C ATOM 0 H THR A 133 13.429 3.447 5.631 1.00 0.37 H new ATOM 0 HA THR A 133 10.998 1.956 4.883 1.00 0.32 H new ATOM 0 HB THR A 133 11.391 3.893 7.203 1.00 0.44 H new ATOM 0 HG1 THR A 133 10.563 1.200 7.538 1.00 1.19 H new ATOM 0 HG21 THR A 133 9.081 3.286 7.844 1.00 1.17 H new ATOM 0 HG22 THR A 133 9.139 4.071 6.248 1.00 1.17 H new ATOM 0 HG23 THR A 133 8.935 2.307 6.364 1.00 1.17 H new ATOM 2054 N ILE A 134 10.391 3.828 3.380 1.00 0.28 N ATOM 2055 CA ILE A 134 9.798 4.900 2.588 1.00 0.31 C ATOM 2056 C ILE A 134 8.346 4.566 2.262 1.00 0.28 C ATOM 2057 O ILE A 134 8.015 3.412 2.014 1.00 0.26 O ATOM 2058 CB ILE A 134 10.577 5.155 1.276 1.00 0.36 C ATOM 2059 CG1 ILE A 134 10.636 3.887 0.423 1.00 0.41 C ATOM 2060 CG2 ILE A 134 11.976 5.671 1.566 1.00 0.41 C ATOM 2061 CD1 ILE A 134 9.553 3.825 -0.632 1.00 0.50 C ATOM 0 H ILE A 134 10.282 2.897 2.977 1.00 0.28 H new ATOM 0 HA ILE A 134 9.846 5.810 3.186 1.00 0.31 H new ATOM 0 HB ILE A 134 10.043 5.921 0.713 1.00 0.36 H new ATOM 0 HG12 ILE A 134 11.610 3.829 -0.062 1.00 0.41 H new ATOM 0 HG13 ILE A 134 10.551 3.016 1.073 1.00 0.41 H new ATOM 0 HG21 ILE A 134 12.503 5.842 0.627 1.00 0.41 H new ATOM 0 HG22 ILE A 134 11.911 6.607 2.121 1.00 0.41 H new ATOM 0 HG23 ILE A 134 12.520 4.935 2.158 1.00 0.41 H new ATOM 0 HD11 ILE A 134 9.652 2.901 -1.201 1.00 0.50 H new ATOM 0 HD12 ILE A 134 8.575 3.852 -0.151 1.00 0.50 H new ATOM 0 HD13 ILE A 134 9.651 4.677 -1.304 1.00 0.50 H new ATOM 2073 N PRO A 135 7.452 5.551 2.286 1.00 0.30 N ATOM 2074 CA PRO A 135 6.062 5.338 1.932 1.00 0.29 C ATOM 2075 C PRO A 135 5.777 5.609 0.456 1.00 0.28 C ATOM 2076 O PRO A 135 6.589 6.208 -0.253 1.00 0.31 O ATOM 2077 CB PRO A 135 5.343 6.346 2.821 1.00 0.35 C ATOM 2078 CG PRO A 135 6.311 7.481 2.987 1.00 0.45 C ATOM 2079 CD PRO A 135 7.697 6.941 2.697 1.00 0.39 C ATOM 0 HA PRO A 135 5.747 4.305 2.078 1.00 0.29 H new ATOM 0 HB2 PRO A 135 4.414 6.684 2.362 1.00 0.35 H new ATOM 0 HB3 PRO A 135 5.082 5.907 3.784 1.00 0.35 H new ATOM 0 HG2 PRO A 135 6.067 8.296 2.306 1.00 0.45 H new ATOM 0 HG3 PRO A 135 6.260 7.884 3.998 1.00 0.45 H new ATOM 0 HD2 PRO A 135 8.191 7.510 1.910 1.00 0.39 H new ATOM 0 HD3 PRO A 135 8.338 6.991 3.577 1.00 0.39 H new ATOM 2087 N ILE A 136 4.617 5.157 0.004 1.00 0.26 N ATOM 2088 CA ILE A 136 4.180 5.345 -1.363 1.00 0.27 C ATOM 2089 C ILE A 136 2.657 5.188 -1.391 1.00 0.26 C ATOM 2090 O ILE A 136 2.073 4.591 -0.483 1.00 0.26 O ATOM 2091 CB ILE A 136 4.921 4.366 -2.339 1.00 0.28 C ATOM 2092 CG1 ILE A 136 4.404 4.463 -3.791 1.00 0.44 C ATOM 2093 CG2 ILE A 136 4.860 2.935 -1.835 1.00 0.33 C ATOM 2094 CD1 ILE A 136 3.280 3.500 -4.132 1.00 0.32 C ATOM 0 H ILE A 136 3.951 4.646 0.583 1.00 0.26 H new ATOM 0 HA ILE A 136 4.437 6.343 -1.717 1.00 0.27 H new ATOM 0 HB ILE A 136 5.964 4.681 -2.356 1.00 0.28 H new ATOM 0 HG12 ILE A 136 4.059 5.481 -3.972 1.00 0.44 H new ATOM 0 HG13 ILE A 136 5.237 4.283 -4.471 1.00 0.44 H new ATOM 0 HG21 ILE A 136 5.382 2.281 -2.533 1.00 0.33 H new ATOM 0 HG22 ILE A 136 5.335 2.874 -0.856 1.00 0.33 H new ATOM 0 HG23 ILE A 136 3.819 2.622 -1.754 1.00 0.33 H new ATOM 0 HD11 ILE A 136 2.983 3.641 -5.171 1.00 0.32 H new ATOM 0 HD12 ILE A 136 3.623 2.475 -3.988 1.00 0.32 H new ATOM 0 HD13 ILE A 136 2.427 3.692 -3.481 1.00 0.32 H new ATOM 2106 N SER A 137 2.016 5.737 -2.401 1.00 0.28 N ATOM 2107 CA SER A 137 0.566 5.809 -2.401 1.00 0.30 C ATOM 2108 C SER A 137 -0.026 5.333 -3.720 1.00 0.30 C ATOM 2109 O SER A 137 0.624 5.423 -4.762 1.00 0.32 O ATOM 2110 CB SER A 137 0.110 7.234 -2.086 1.00 0.34 C ATOM 2111 OG SER A 137 0.384 8.127 -3.152 1.00 0.88 O ATOM 0 H SER A 137 2.467 6.136 -3.224 1.00 0.28 H new ATOM 0 HA SER A 137 0.199 5.139 -1.624 1.00 0.30 H new ATOM 0 HB2 SER A 137 -0.960 7.235 -1.878 1.00 0.34 H new ATOM 0 HB3 SER A 137 0.610 7.583 -1.183 1.00 0.34 H new ATOM 0 HG SER A 137 0.540 9.026 -2.794 1.00 0.88 H new ATOM 2117 N SER A 138 -1.256 4.819 -3.681 1.00 0.31 N ATOM 2118 CA SER A 138 -1.938 4.407 -4.891 1.00 0.34 C ATOM 2119 C SER A 138 -3.397 4.821 -4.797 1.00 0.34 C ATOM 2120 O SER A 138 -4.143 4.293 -3.977 1.00 0.35 O ATOM 2121 CB SER A 138 -1.837 2.892 -5.077 1.00 0.40 C ATOM 2122 OG SER A 138 -2.418 2.484 -6.307 1.00 0.96 O ATOM 0 H SER A 138 -1.792 4.682 -2.824 1.00 0.31 H new ATOM 0 HA SER A 138 -1.469 4.887 -5.750 1.00 0.34 H new ATOM 0 HB2 SER A 138 -0.790 2.589 -5.048 1.00 0.40 H new ATOM 0 HB3 SER A 138 -2.338 2.388 -4.251 1.00 0.40 H new ATOM 0 HG SER A 138 -2.338 1.512 -6.400 1.00 0.96 H new ATOM 2128 N LYS A 139 -3.794 5.783 -5.601 1.00 0.36 N ATOM 2129 CA LYS A 139 -5.164 6.257 -5.573 1.00 0.38 C ATOM 2130 C LYS A 139 -5.874 5.911 -6.869 1.00 0.41 C ATOM 2131 O LYS A 139 -5.277 5.979 -7.943 1.00 0.47 O ATOM 2132 CB LYS A 139 -5.225 7.771 -5.314 1.00 0.44 C ATOM 2133 CG LYS A 139 -4.333 8.606 -6.220 1.00 0.57 C ATOM 2134 CD LYS A 139 -2.966 8.859 -5.602 1.00 0.92 C ATOM 2135 CE LYS A 139 -3.086 9.646 -4.312 1.00 1.35 C ATOM 2136 NZ LYS A 139 -1.759 9.962 -3.719 1.00 1.76 N ATOM 0 H LYS A 139 -3.193 6.251 -6.279 1.00 0.36 H new ATOM 0 HA LYS A 139 -5.674 5.755 -4.751 1.00 0.38 H new ATOM 0 HB2 LYS A 139 -6.256 8.105 -5.433 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -4.946 7.960 -4.277 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -4.210 8.097 -7.176 1.00 0.57 H new ATOM 0 HG3 LYS A 139 -4.819 9.560 -6.427 1.00 0.57 H new ATOM 0 HD2 LYS A 139 -2.471 7.908 -5.406 1.00 0.92 H new ATOM 0 HD3 LYS A 139 -2.340 9.405 -6.308 1.00 0.92 H new ATOM 0 HE2 LYS A 139 -3.626 10.573 -4.503 1.00 1.35 H new ATOM 0 HE3 LYS A 139 -3.676 9.076 -3.594 1.00 1.35 H new ATOM 0 HZ1 LYS A 139 -1.888 10.332 -2.756 1.00 1.76 H new ATOM 0 HZ2 LYS A 139 -1.180 9.099 -3.683 1.00 1.76 H new ATOM 0 HZ3 LYS A 139 -1.279 10.677 -4.303 1.00 1.76 H new ATOM 2150 N GLY A 140 -7.140 5.523 -6.777 1.00 0.42 N ATOM 2151 CA GLY A 140 -7.890 5.157 -7.955 1.00 0.50 C ATOM 2152 C GLY A 140 -9.389 5.302 -7.743 1.00 0.46 C ATOM 2153 O GLY A 140 -9.910 4.976 -6.680 1.00 0.47 O ATOM 0 H GLY A 140 -7.659 5.456 -5.902 1.00 0.42 H new ATOM 0 HA2 GLY A 140 -7.580 5.783 -8.792 1.00 0.50 H new ATOM 0 HA3 GLY A 140 -7.660 4.127 -8.226 1.00 0.50 H new ATOM 2157 N GLU A 141 -10.062 5.811 -8.757 1.00 0.44 N ATOM 2158 CA GLU A 141 -11.511 5.992 -8.712 1.00 0.42 C ATOM 2159 C GLU A 141 -12.195 4.844 -9.439 1.00 0.43 C ATOM 2160 O GLU A 141 -11.844 4.542 -10.582 1.00 0.48 O ATOM 2161 CB GLU A 141 -11.922 7.314 -9.359 1.00 0.45 C ATOM 2162 CG GLU A 141 -11.102 8.510 -8.912 1.00 0.52 C ATOM 2163 CD GLU A 141 -11.520 9.784 -9.611 1.00 1.24 C ATOM 2164 OE1 GLU A 141 -11.288 9.908 -10.830 1.00 1.51 O ATOM 2165 OE2 GLU A 141 -12.072 10.682 -8.940 1.00 2.10 O ATOM 0 H GLU A 141 -9.630 6.110 -9.631 1.00 0.44 H new ATOM 0 HA GLU A 141 -11.818 6.007 -7.666 1.00 0.42 H new ATOM 0 HB2 GLU A 141 -11.840 7.216 -10.441 1.00 0.45 H new ATOM 0 HB3 GLU A 141 -12.972 7.504 -9.135 1.00 0.45 H new ATOM 0 HG2 GLU A 141 -11.207 8.638 -7.835 1.00 0.52 H new ATOM 0 HG3 GLU A 141 -10.047 8.319 -9.109 1.00 0.52 H new ATOM 2172 N ILE A 142 -13.174 4.209 -8.801 1.00 0.42 N ATOM 2173 CA ILE A 142 -13.856 3.060 -9.381 1.00 0.47 C ATOM 2174 C ILE A 142 -15.356 3.149 -9.086 1.00 0.46 C ATOM 2175 O ILE A 142 -15.791 4.051 -8.364 1.00 0.42 O ATOM 2176 CB ILE A 142 -13.267 1.716 -8.875 1.00 0.54 C ATOM 2177 CG1 ILE A 142 -13.086 1.717 -7.355 1.00 0.76 C ATOM 2178 CG2 ILE A 142 -11.941 1.422 -9.559 1.00 0.60 C ATOM 2179 CD1 ILE A 142 -14.246 1.111 -6.596 1.00 0.67 C ATOM 0 H ILE A 142 -13.513 4.474 -7.876 1.00 0.42 H new ATOM 0 HA ILE A 142 -13.701 3.082 -10.460 1.00 0.47 H new ATOM 0 HB ILE A 142 -13.979 0.931 -9.128 1.00 0.54 H new ATOM 0 HG12 ILE A 142 -12.177 1.169 -7.107 1.00 0.76 H new ATOM 0 HG13 ILE A 142 -12.941 2.743 -7.017 1.00 0.76 H new ATOM 0 HG21 ILE A 142 -11.544 0.476 -9.191 1.00 0.60 H new ATOM 0 HG22 ILE A 142 -12.094 1.357 -10.636 1.00 0.60 H new ATOM 0 HG23 ILE A 142 -11.234 2.222 -9.340 1.00 0.60 H new ATOM 0 HD11 ILE A 142 -14.041 1.149 -5.526 1.00 0.67 H new ATOM 0 HD12 ILE A 142 -15.155 1.673 -6.811 1.00 0.67 H new ATOM 0 HD13 ILE A 142 -14.379 0.074 -6.903 1.00 0.67 H new ATOM 2191 N LYS A 143 -16.142 2.240 -9.661 1.00 0.53 N ATOM 2192 CA LYS A 143 -17.605 2.328 -9.599 1.00 0.57 C ATOM 2193 C LYS A 143 -18.152 2.165 -8.178 1.00 0.54 C ATOM 2194 O LYS A 143 -17.426 1.821 -7.243 1.00 0.57 O ATOM 2195 CB LYS A 143 -18.245 1.270 -10.504 1.00 0.70 C ATOM 2196 CG LYS A 143 -17.790 1.334 -11.955 1.00 1.44 C ATOM 2197 CD LYS A 143 -18.557 0.348 -12.830 1.00 2.04 C ATOM 2198 CE LYS A 143 -18.467 -1.080 -12.306 1.00 2.74 C ATOM 2199 NZ LYS A 143 -17.064 -1.567 -12.238 1.00 3.53 N ATOM 0 H LYS A 143 -15.792 1.432 -10.176 1.00 0.53 H new ATOM 0 HA LYS A 143 -17.865 3.329 -9.944 1.00 0.57 H new ATOM 0 HB2 LYS A 143 -18.016 0.281 -10.106 1.00 0.70 H new ATOM 0 HB3 LYS A 143 -19.328 1.385 -10.469 1.00 0.70 H new ATOM 0 HG2 LYS A 143 -17.931 2.345 -12.336 1.00 1.44 H new ATOM 0 HG3 LYS A 143 -16.723 1.118 -12.012 1.00 1.44 H new ATOM 0 HD2 LYS A 143 -19.603 0.649 -12.881 1.00 2.04 H new ATOM 0 HD3 LYS A 143 -18.164 0.385 -13.846 1.00 2.04 H new ATOM 0 HE2 LYS A 143 -18.915 -1.130 -11.314 1.00 2.74 H new ATOM 0 HE3 LYS A 143 -19.047 -1.739 -12.952 1.00 2.74 H new ATOM 0 HZ1 LYS A 143 -17.056 -2.564 -11.941 1.00 3.53 H new ATOM 0 HZ2 LYS A 143 -16.621 -1.482 -13.175 1.00 3.53 H new ATOM 0 HZ3 LYS A 143 -16.532 -0.997 -11.550 1.00 3.53 H new ATOM 2213 N LEU A 144 -19.456 2.397 -8.049 1.00 0.60 N ATOM 2214 CA LEU A 144 -20.171 2.282 -6.780 1.00 0.66 C ATOM 2215 C LEU A 144 -20.084 0.837 -6.261 1.00 0.60 C ATOM 2216 O LEU A 144 -20.413 -0.105 -6.983 1.00 0.63 O ATOM 2217 CB LEU A 144 -21.635 2.719 -7.012 1.00 0.83 C ATOM 2218 CG LEU A 144 -22.457 3.161 -5.783 1.00 0.69 C ATOM 2219 CD1 LEU A 144 -22.828 1.982 -4.913 1.00 1.21 C ATOM 2220 CD2 LEU A 144 -21.711 4.204 -4.962 1.00 1.23 C ATOM 0 H LEU A 144 -20.052 2.673 -8.830 1.00 0.60 H new ATOM 0 HA LEU A 144 -19.724 2.925 -6.022 1.00 0.66 H new ATOM 0 HB2 LEU A 144 -21.630 3.543 -7.725 1.00 0.83 H new ATOM 0 HB3 LEU A 144 -22.161 1.890 -7.486 1.00 0.83 H new ATOM 0 HG LEU A 144 -23.375 3.612 -6.159 1.00 0.69 H new ATOM 0 HD11 LEU A 144 -23.406 2.329 -4.057 1.00 1.21 H new ATOM 0 HD12 LEU A 144 -23.424 1.276 -5.491 1.00 1.21 H new ATOM 0 HD13 LEU A 144 -21.921 1.489 -4.563 1.00 1.21 H new ATOM 0 HD21 LEU A 144 -22.318 4.494 -4.104 1.00 1.23 H new ATOM 0 HD22 LEU A 144 -20.767 3.786 -4.614 1.00 1.23 H new ATOM 0 HD23 LEU A 144 -21.514 5.080 -5.580 1.00 1.23 H new ATOM 2232 N PRO A 145 -19.628 0.653 -5.005 1.00 0.61 N ATOM 2233 CA PRO A 145 -19.391 -0.671 -4.411 1.00 0.64 C ATOM 2234 C PRO A 145 -20.677 -1.398 -4.031 1.00 0.66 C ATOM 2235 O PRO A 145 -21.775 -0.862 -4.192 1.00 0.65 O ATOM 2236 CB PRO A 145 -18.580 -0.349 -3.156 1.00 0.71 C ATOM 2237 CG PRO A 145 -19.030 1.013 -2.763 1.00 0.69 C ATOM 2238 CD PRO A 145 -19.315 1.734 -4.050 1.00 0.67 C ATOM 0 HA PRO A 145 -18.892 -1.339 -5.113 1.00 0.64 H new ATOM 0 HB2 PRO A 145 -18.769 -1.074 -2.364 1.00 0.71 H new ATOM 0 HB3 PRO A 145 -17.509 -0.370 -3.359 1.00 0.71 H new ATOM 0 HG2 PRO A 145 -19.920 0.965 -2.135 1.00 0.69 H new ATOM 0 HG3 PRO A 145 -18.261 1.528 -2.187 1.00 0.69 H new ATOM 0 HD2 PRO A 145 -20.150 2.426 -3.943 1.00 0.67 H new ATOM 0 HD3 PRO A 145 -18.456 2.320 -4.378 1.00 0.67 H new