USER MOD reduce.3.24.130724 H: found=0, std=0, add=841, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 841 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 525 MET CE :methyl 174:sc= 0 (180deg=-0.0343) USER MOD Set 1.2: A 527 SER OG : rot 28:sc= 0.172 USER MOD Set 2.1: A 503 SER OG : rot 113:sc= 0.978 USER MOD Set 2.2: A 505 THR OG1 : rot -130:sc= -0.101 USER MOD Set 3.1: A 498 TYR OH : rot 180:sc= -0.0244 USER MOD Set 3.2: A 512 GLN : amide:sc= -0.018 K(o=-0.042,f=0.74) USER MOD Single : A 420 SER OG : rot 180:sc= 0 USER MOD Single : A 421 SER OG : rot 180:sc= -0.1 USER MOD Single : A 423 SER OG : rot 180:sc= 0 USER MOD Single : A 424 SER OG : rot 180:sc= 0 USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 428 LYS NZ :NH3+ -123:sc= -0.377 (180deg=-1.39!) USER MOD Single : A 444 THR OG1 : rot 180:sc= 0.0194 USER MOD Single : A 446 SER OG : rot 180:sc= 0 USER MOD Single : A 459 HIS : no HD1:sc= -0.586 X(o=-0.59,f=-0.6) USER MOD Single : A 460 LYS NZ :NH3+ 170:sc= -0.445 (180deg=-0.504) USER MOD Single : A 463 SER OG : rot 180:sc= 0 USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 465 SER OG : rot 180:sc= 0 USER MOD Single : A 466 TYR OH : rot 180:sc= 0 USER MOD Single : A 470 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 472 TYR OH : rot 180:sc= 0 USER MOD Single : A 478 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot 63:sc= 0.781 USER MOD Single : A 484 GLN : amide:sc= -0.352 X(o=-0.35,f=-0.35) USER MOD Single : A 490 CYS SG : rot 55:sc= -1.31 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 500 CYS SG : rot 28:sc= 0.129 USER MOD Single : A 502 SER OG : rot 180:sc= -0.129 USER MOD Single : A 507 LYS NZ :NH3+ -157:sc= -0.046 (180deg=-0.36) USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 517 ASN : amide:sc= -1.8 K(o=-1.8,f=-3.9!) USER MOD Single : A 519 SER OG : rot 180:sc= -0.311 USER MOD Single : A 521 SER OG : rot 180:sc= 0 USER MOD Single : A 530 SER OG : rot 180:sc= 0 USER MOD Single : A 531 SER OG : rot 37:sc= 0.434 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 419 -15.605 19.487 -18.014 1.00 0.00 N ATOM 2 CA GLY A 419 -16.139 18.697 -16.921 1.00 0.00 C ATOM 3 C GLY A 419 -15.160 18.562 -15.771 1.00 0.00 C ATOM 4 O GLY A 419 -14.767 19.557 -15.162 1.00 0.00 O ATOM 0 HA2 GLY A 419 -17.058 19.157 -16.559 1.00 0.00 H new ATOM 0 HA3 GLY A 419 -16.402 17.705 -17.288 1.00 0.00 H new ATOM 8 N SER A 420 -14.766 17.328 -15.472 1.00 0.00 N ATOM 9 CA SER A 420 -13.832 17.066 -14.384 1.00 0.00 C ATOM 10 C SER A 420 -12.739 16.099 -14.827 1.00 0.00 C ATOM 11 O SER A 420 -12.960 15.247 -15.688 1.00 0.00 O ATOM 12 CB SER A 420 -14.573 16.496 -13.173 1.00 0.00 C ATOM 13 OG SER A 420 -15.456 17.455 -12.617 1.00 0.00 O ATOM 0 H SER A 420 -15.079 16.494 -15.968 1.00 0.00 H new ATOM 0 HA SER A 420 -13.365 18.010 -14.104 1.00 0.00 H new ATOM 0 HB2 SER A 420 -15.134 15.610 -13.470 1.00 0.00 H new ATOM 0 HB3 SER A 420 -13.853 16.179 -12.418 1.00 0.00 H new ATOM 0 HG SER A 420 -15.918 17.065 -11.846 1.00 0.00 H new ATOM 19 N SER A 421 -11.558 16.236 -14.232 1.00 0.00 N ATOM 20 CA SER A 421 -10.429 15.377 -14.568 1.00 0.00 C ATOM 21 C SER A 421 -9.461 15.269 -13.393 1.00 0.00 C ATOM 22 O SER A 421 -9.488 16.087 -12.474 1.00 0.00 O ATOM 23 CB SER A 421 -9.697 15.919 -15.797 1.00 0.00 C ATOM 24 OG SER A 421 -10.571 16.020 -16.908 1.00 0.00 O ATOM 0 H SER A 421 -11.359 16.934 -13.515 1.00 0.00 H new ATOM 0 HA SER A 421 -10.815 14.382 -14.792 1.00 0.00 H new ATOM 0 HB2 SER A 421 -9.277 16.899 -15.571 1.00 0.00 H new ATOM 0 HB3 SER A 421 -8.862 15.264 -16.045 1.00 0.00 H new ATOM 0 HG SER A 421 -10.079 16.370 -17.680 1.00 0.00 H new ATOM 30 N GLY A 422 -8.606 14.251 -13.430 1.00 0.00 N ATOM 31 CA GLY A 422 -7.642 14.053 -12.364 1.00 0.00 C ATOM 32 C GLY A 422 -6.576 15.131 -12.338 1.00 0.00 C ATOM 33 O GLY A 422 -5.886 15.355 -13.332 1.00 0.00 O ATOM 0 H GLY A 422 -8.564 13.560 -14.179 1.00 0.00 H new ATOM 0 HA2 GLY A 422 -8.162 14.038 -11.406 1.00 0.00 H new ATOM 0 HA3 GLY A 422 -7.167 13.079 -12.484 1.00 0.00 H new ATOM 37 N SER A 423 -6.443 15.801 -11.198 1.00 0.00 N ATOM 38 CA SER A 423 -5.457 16.866 -11.048 1.00 0.00 C ATOM 39 C SER A 423 -4.561 16.610 -9.840 1.00 0.00 C ATOM 40 O SER A 423 -3.335 16.641 -9.945 1.00 0.00 O ATOM 41 CB SER A 423 -6.156 18.219 -10.902 1.00 0.00 C ATOM 42 OG SER A 423 -6.619 18.691 -12.156 1.00 0.00 O ATOM 0 H SER A 423 -7.005 15.626 -10.365 1.00 0.00 H new ATOM 0 HA SER A 423 -4.835 16.881 -11.943 1.00 0.00 H new ATOM 0 HB2 SER A 423 -6.995 18.126 -10.212 1.00 0.00 H new ATOM 0 HB3 SER A 423 -5.466 18.944 -10.469 1.00 0.00 H new ATOM 0 HG SER A 423 -7.063 19.556 -12.036 1.00 0.00 H new ATOM 48 N SER A 424 -5.183 16.357 -8.693 1.00 0.00 N ATOM 49 CA SER A 424 -4.443 16.100 -7.463 1.00 0.00 C ATOM 50 C SER A 424 -5.047 14.924 -6.701 1.00 0.00 C ATOM 51 O SER A 424 -6.175 14.998 -6.215 1.00 0.00 O ATOM 52 CB SER A 424 -4.437 17.347 -6.576 1.00 0.00 C ATOM 53 OG SER A 424 -3.698 18.397 -7.178 1.00 0.00 O ATOM 0 H SER A 424 -6.197 16.324 -8.590 1.00 0.00 H new ATOM 0 HA SER A 424 -3.417 15.849 -7.732 1.00 0.00 H new ATOM 0 HB2 SER A 424 -5.461 17.675 -6.397 1.00 0.00 H new ATOM 0 HB3 SER A 424 -4.005 17.104 -5.605 1.00 0.00 H new ATOM 0 HG SER A 424 -3.710 19.183 -6.593 1.00 0.00 H new ATOM 59 N GLY A 425 -4.287 13.838 -6.602 1.00 0.00 N ATOM 60 CA GLY A 425 -4.763 12.661 -5.899 1.00 0.00 C ATOM 61 C GLY A 425 -3.665 11.970 -5.115 1.00 0.00 C ATOM 62 O GLY A 425 -2.704 11.463 -5.694 1.00 0.00 O ATOM 0 H GLY A 425 -3.350 13.752 -6.996 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -5.565 12.947 -5.219 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -5.189 11.960 -6.617 1.00 0.00 H new ATOM 66 N SER A 426 -3.805 11.952 -3.794 1.00 0.00 N ATOM 67 CA SER A 426 -2.814 11.324 -2.928 1.00 0.00 C ATOM 68 C SER A 426 -2.242 10.068 -3.580 1.00 0.00 C ATOM 69 O SER A 426 -2.981 9.247 -4.124 1.00 0.00 O ATOM 70 CB SER A 426 -3.436 10.972 -1.576 1.00 0.00 C ATOM 71 OG SER A 426 -4.606 10.189 -1.741 1.00 0.00 O ATOM 0 H SER A 426 -4.596 12.365 -3.299 1.00 0.00 H new ATOM 0 HA SER A 426 -2.002 12.034 -2.772 1.00 0.00 H new ATOM 0 HB2 SER A 426 -2.712 10.427 -0.970 1.00 0.00 H new ATOM 0 HB3 SER A 426 -3.680 11.886 -1.035 1.00 0.00 H new ATOM 0 HG SER A 426 -4.984 9.976 -0.862 1.00 0.00 H new ATOM 77 N ARG A 427 -0.922 9.926 -3.519 1.00 0.00 N ATOM 78 CA ARG A 427 -0.250 8.772 -4.104 1.00 0.00 C ATOM 79 C ARG A 427 -0.094 7.655 -3.076 1.00 0.00 C ATOM 80 O ARG A 427 -0.372 6.490 -3.361 1.00 0.00 O ATOM 81 CB ARG A 427 1.122 9.175 -4.647 1.00 0.00 C ATOM 82 CG ARG A 427 1.060 10.242 -5.728 1.00 0.00 C ATOM 83 CD ARG A 427 2.332 10.266 -6.561 1.00 0.00 C ATOM 84 NE ARG A 427 3.376 11.077 -5.943 1.00 0.00 N ATOM 85 CZ ARG A 427 4.481 11.459 -6.574 1.00 0.00 C ATOM 86 NH1 ARG A 427 4.683 11.106 -7.836 1.00 0.00 N ATOM 87 NH2 ARG A 427 5.385 12.198 -5.944 1.00 0.00 N ATOM 0 H ARG A 427 -0.297 10.596 -3.070 1.00 0.00 H new ATOM 0 HA ARG A 427 -0.864 8.403 -4.926 1.00 0.00 H new ATOM 0 HB2 ARG A 427 1.736 9.539 -3.824 1.00 0.00 H new ATOM 0 HB3 ARG A 427 1.618 8.291 -5.048 1.00 0.00 H new ATOM 0 HG2 ARG A 427 0.203 10.056 -6.376 1.00 0.00 H new ATOM 0 HG3 ARG A 427 0.906 11.218 -5.269 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.696 9.248 -6.696 1.00 0.00 H new ATOM 0 HD3 ARG A 427 2.108 10.658 -7.553 1.00 0.00 H new ATOM 0 HE ARG A 427 3.250 11.367 -4.973 1.00 0.00 H new ATOM 0 HH11 ARG A 427 3.989 10.540 -8.325 1.00 0.00 H new ATOM 0 HH12 ARG A 427 5.532 11.401 -8.318 1.00 0.00 H new ATOM 0 HH21 ARG A 427 5.232 12.474 -4.974 1.00 0.00 H new ATOM 0 HH22 ARG A 427 6.233 12.491 -6.430 1.00 0.00 H new ATOM 101 N LYS A 428 0.352 8.019 -1.878 1.00 0.00 N ATOM 102 CA LYS A 428 0.545 7.050 -0.806 1.00 0.00 C ATOM 103 C LYS A 428 -0.787 6.444 -0.374 1.00 0.00 C ATOM 104 O LYS A 428 -1.759 7.161 -0.139 1.00 0.00 O ATOM 105 CB LYS A 428 1.229 7.712 0.392 1.00 0.00 C ATOM 106 CG LYS A 428 1.585 6.740 1.503 1.00 0.00 C ATOM 107 CD LYS A 428 2.032 7.469 2.759 1.00 0.00 C ATOM 108 CE LYS A 428 3.514 7.807 2.710 1.00 0.00 C ATOM 109 NZ LYS A 428 3.774 9.054 1.939 1.00 0.00 N ATOM 0 H LYS A 428 0.587 8.979 -1.625 1.00 0.00 H new ATOM 0 HA LYS A 428 1.183 6.251 -1.184 1.00 0.00 H new ATOM 0 HB2 LYS A 428 2.137 8.210 0.052 1.00 0.00 H new ATOM 0 HB3 LYS A 428 0.573 8.485 0.793 1.00 0.00 H new ATOM 0 HG2 LYS A 428 0.722 6.115 1.732 1.00 0.00 H new ATOM 0 HG3 LYS A 428 2.379 6.075 1.165 1.00 0.00 H new ATOM 0 HD2 LYS A 428 1.453 8.385 2.875 1.00 0.00 H new ATOM 0 HD3 LYS A 428 1.828 6.850 3.632 1.00 0.00 H new ATOM 0 HE2 LYS A 428 3.894 7.922 3.725 1.00 0.00 H new ATOM 0 HE3 LYS A 428 4.060 6.980 2.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 4.436 8.851 1.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 2.880 9.412 1.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 4.188 9.771 2.568 1.00 0.00 H new ATOM 123 N VAL A 429 -0.823 5.119 -0.270 1.00 0.00 N ATOM 124 CA VAL A 429 -2.035 4.418 0.137 1.00 0.00 C ATOM 125 C VAL A 429 -1.792 3.581 1.388 1.00 0.00 C ATOM 126 O VAL A 429 -0.806 2.849 1.477 1.00 0.00 O ATOM 127 CB VAL A 429 -2.557 3.502 -0.986 1.00 0.00 C ATOM 128 CG1 VAL A 429 -3.806 2.761 -0.534 1.00 0.00 C ATOM 129 CG2 VAL A 429 -2.832 4.308 -2.246 1.00 0.00 C ATOM 0 H VAL A 429 -0.027 4.510 -0.462 1.00 0.00 H new ATOM 0 HA VAL A 429 -2.784 5.180 0.353 1.00 0.00 H new ATOM 0 HB VAL A 429 -1.789 2.763 -1.215 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.160 2.119 -1.341 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.572 2.151 0.339 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.583 3.481 -0.276 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.200 3.645 -3.029 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.582 5.070 -2.034 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -1.912 4.787 -2.579 1.00 0.00 H new ATOM 139 N PHE A 430 -2.698 3.695 2.354 1.00 0.00 N ATOM 140 CA PHE A 430 -2.582 2.949 3.602 1.00 0.00 C ATOM 141 C PHE A 430 -3.366 1.642 3.529 1.00 0.00 C ATOM 142 O PHE A 430 -4.595 1.637 3.600 1.00 0.00 O ATOM 143 CB PHE A 430 -3.086 3.794 4.774 1.00 0.00 C ATOM 144 CG PHE A 430 -3.370 2.993 6.012 1.00 0.00 C ATOM 145 CD1 PHE A 430 -2.544 1.943 6.378 1.00 0.00 C ATOM 146 CD2 PHE A 430 -4.463 3.290 6.810 1.00 0.00 C ATOM 147 CE1 PHE A 430 -2.804 1.203 7.517 1.00 0.00 C ATOM 148 CE2 PHE A 430 -4.728 2.555 7.949 1.00 0.00 C ATOM 149 CZ PHE A 430 -3.897 1.511 8.304 1.00 0.00 C ATOM 0 H PHE A 430 -3.520 4.296 2.297 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.530 2.713 3.759 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.343 4.557 5.007 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -3.994 4.315 4.472 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.687 1.700 5.767 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -5.116 4.106 6.538 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -2.154 0.385 7.791 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -5.584 2.797 8.561 1.00 0.00 H new ATOM 0 HZ PHE A 430 -4.101 0.936 9.195 1.00 0.00 H new ATOM 159 N VAL A 431 -2.645 0.534 3.387 1.00 0.00 N ATOM 160 CA VAL A 431 -3.272 -0.780 3.305 1.00 0.00 C ATOM 161 C VAL A 431 -3.093 -1.556 4.604 1.00 0.00 C ATOM 162 O VAL A 431 -1.970 -1.805 5.041 1.00 0.00 O ATOM 163 CB VAL A 431 -2.691 -1.606 2.142 1.00 0.00 C ATOM 164 CG1 VAL A 431 -3.413 -2.940 2.022 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.777 -0.826 0.839 1.00 0.00 C ATOM 0 H VAL A 431 -1.627 0.520 3.326 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.335 -0.614 3.128 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.640 -1.805 2.351 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.989 -3.510 1.195 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -3.295 -3.502 2.948 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.473 -2.765 1.836 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -2.362 -1.425 0.028 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -3.820 -0.594 0.622 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -2.211 0.101 0.932 1.00 0.00 H new ATOM 175 N GLY A 432 -4.209 -1.937 5.219 1.00 0.00 N ATOM 176 CA GLY A 432 -4.154 -2.682 6.463 1.00 0.00 C ATOM 177 C GLY A 432 -4.749 -4.070 6.335 1.00 0.00 C ATOM 178 O GLY A 432 -5.654 -4.293 5.531 1.00 0.00 O ATOM 0 H GLY A 432 -5.150 -1.743 4.877 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -3.117 -2.763 6.788 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.689 -2.131 7.237 1.00 0.00 H new ATOM 182 N GLY A 433 -4.239 -5.007 7.128 1.00 0.00 N ATOM 183 CA GLY A 433 -4.738 -6.369 7.083 1.00 0.00 C ATOM 184 C GLY A 433 -4.029 -7.211 6.040 1.00 0.00 C ATOM 185 O GLY A 433 -4.647 -8.050 5.384 1.00 0.00 O ATOM 0 H GLY A 433 -3.489 -4.847 7.801 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.615 -6.830 8.063 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.807 -6.355 6.869 1.00 0.00 H new ATOM 189 N LEU A 434 -2.729 -6.987 5.885 1.00 0.00 N ATOM 190 CA LEU A 434 -1.935 -7.731 4.914 1.00 0.00 C ATOM 191 C LEU A 434 -1.500 -9.078 5.482 1.00 0.00 C ATOM 192 O LEU A 434 -1.168 -9.204 6.661 1.00 0.00 O ATOM 193 CB LEU A 434 -0.706 -6.919 4.500 1.00 0.00 C ATOM 194 CG LEU A 434 -0.971 -5.718 3.591 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.216 -4.767 3.604 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.271 -6.180 2.172 1.00 0.00 C ATOM 0 H LEU A 434 -2.202 -6.296 6.419 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.557 -7.911 4.037 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.209 -6.564 5.403 1.00 0.00 H new ATOM 0 HB3 LEU A 434 -0.008 -7.586 3.994 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.842 -5.184 3.970 1.00 0.00 H new ATOM 0 HD11 LEU A 434 0.010 -3.918 2.952 1.00 0.00 H new ATOM 0 HD12 LEU A 434 0.386 -4.411 4.620 1.00 0.00 H new ATOM 0 HD13 LEU A 434 1.105 -5.289 3.250 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.457 -5.313 1.539 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.419 -6.737 1.783 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -2.152 -6.821 2.177 1.00 0.00 H new ATOM 208 N PRO A 435 -1.498 -10.110 4.625 1.00 0.00 N ATOM 209 CA PRO A 435 -1.104 -11.466 5.020 1.00 0.00 C ATOM 210 C PRO A 435 0.204 -11.484 5.804 1.00 0.00 C ATOM 211 O PRO A 435 1.140 -10.738 5.514 1.00 0.00 O ATOM 212 CB PRO A 435 -0.934 -12.189 3.681 1.00 0.00 C ATOM 213 CG PRO A 435 -1.846 -11.473 2.746 1.00 0.00 C ATOM 214 CD PRO A 435 -1.882 -10.033 3.206 1.00 0.00 C ATOM 0 HA PRO A 435 -1.838 -11.928 5.680 1.00 0.00 H new ATOM 0 HB2 PRO A 435 0.099 -12.147 3.336 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -1.199 -13.243 3.764 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.485 -11.544 1.720 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -2.844 -11.912 2.764 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -1.189 -9.413 2.637 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -2.874 -9.598 3.083 1.00 0.00 H new ATOM 222 N PRO A 436 0.273 -12.355 6.821 1.00 0.00 N ATOM 223 CA PRO A 436 1.462 -12.492 7.667 1.00 0.00 C ATOM 224 C PRO A 436 2.547 -13.338 7.010 1.00 0.00 C ATOM 225 O PRO A 436 3.586 -13.610 7.612 1.00 0.00 O ATOM 226 CB PRO A 436 0.927 -13.188 8.921 1.00 0.00 C ATOM 227 CG PRO A 436 -0.248 -13.972 8.447 1.00 0.00 C ATOM 228 CD PRO A 436 -0.804 -13.275 7.223 1.00 0.00 C ATOM 0 HA PRO A 436 1.934 -11.530 7.865 1.00 0.00 H new ATOM 0 HB2 PRO A 436 1.682 -13.836 9.367 1.00 0.00 H new ATOM 0 HB3 PRO A 436 0.639 -12.464 9.683 1.00 0.00 H new ATOM 0 HG2 PRO A 436 0.046 -14.993 8.205 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -1.006 -14.035 9.228 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -1.039 -13.986 6.431 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -1.724 -12.737 7.452 1.00 0.00 H new ATOM 236 N ASP A 437 2.300 -13.750 5.771 1.00 0.00 N ATOM 237 CA ASP A 437 3.258 -14.564 5.031 1.00 0.00 C ATOM 238 C ASP A 437 3.455 -14.022 3.619 1.00 0.00 C ATOM 239 O ASP A 437 3.726 -14.778 2.686 1.00 0.00 O ATOM 240 CB ASP A 437 2.785 -16.018 4.971 1.00 0.00 C ATOM 241 CG ASP A 437 1.420 -16.156 4.325 1.00 0.00 C ATOM 242 OD1 ASP A 437 1.044 -15.265 3.536 1.00 0.00 O ATOM 243 OD2 ASP A 437 0.729 -17.157 4.609 1.00 0.00 O ATOM 0 H ASP A 437 1.445 -13.534 5.258 1.00 0.00 H new ATOM 0 HA ASP A 437 4.214 -14.522 5.554 1.00 0.00 H new ATOM 0 HB2 ASP A 437 3.510 -16.610 4.412 1.00 0.00 H new ATOM 0 HB3 ASP A 437 2.749 -16.427 5.981 1.00 0.00 H new ATOM 248 N ILE A 438 3.317 -12.709 3.470 1.00 0.00 N ATOM 249 CA ILE A 438 3.480 -12.066 2.172 1.00 0.00 C ATOM 250 C ILE A 438 4.745 -11.216 2.135 1.00 0.00 C ATOM 251 O ILE A 438 5.062 -10.515 3.096 1.00 0.00 O ATOM 252 CB ILE A 438 2.268 -11.180 1.826 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.418 -10.602 0.418 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.119 -10.065 2.850 1.00 0.00 C ATOM 255 CD1 ILE A 438 1.149 -9.972 -0.114 1.00 0.00 C ATOM 0 H ILE A 438 3.093 -12.069 4.232 1.00 0.00 H new ATOM 0 HA ILE A 438 3.559 -12.863 1.433 1.00 0.00 H new ATOM 0 HB ILE A 438 1.367 -11.793 1.852 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.211 -9.854 0.423 1.00 0.00 H new ATOM 0 HG13 ILE A 438 2.733 -11.395 -0.260 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.259 -9.447 2.593 1.00 0.00 H new ATOM 0 HG22 ILE A 438 1.972 -10.497 3.840 1.00 0.00 H new ATOM 0 HG23 ILE A 438 3.019 -9.450 2.852 1.00 0.00 H new ATOM 0 HD11 ILE A 438 1.328 -9.583 -1.116 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.359 -10.722 -0.152 1.00 0.00 H new ATOM 0 HD13 ILE A 438 0.845 -9.157 0.542 1.00 0.00 H new ATOM 267 N ASP A 439 5.462 -11.281 1.019 1.00 0.00 N ATOM 268 CA ASP A 439 6.692 -10.515 0.854 1.00 0.00 C ATOM 269 C ASP A 439 6.446 -9.267 0.013 1.00 0.00 C ATOM 270 O ASP A 439 5.382 -9.111 -0.586 1.00 0.00 O ATOM 271 CB ASP A 439 7.773 -11.379 0.203 1.00 0.00 C ATOM 272 CG ASP A 439 8.942 -10.558 -0.305 1.00 0.00 C ATOM 273 OD1 ASP A 439 9.571 -9.851 0.511 1.00 0.00 O ATOM 274 OD2 ASP A 439 9.229 -10.622 -1.518 1.00 0.00 O ATOM 0 H ASP A 439 5.213 -11.856 0.215 1.00 0.00 H new ATOM 0 HA ASP A 439 7.033 -10.204 1.842 1.00 0.00 H new ATOM 0 HB2 ASP A 439 8.134 -12.111 0.926 1.00 0.00 H new ATOM 0 HB3 ASP A 439 7.338 -11.937 -0.626 1.00 0.00 H new ATOM 279 N GLU A 440 7.436 -8.380 -0.026 1.00 0.00 N ATOM 280 CA GLU A 440 7.325 -7.145 -0.793 1.00 0.00 C ATOM 281 C GLU A 440 6.814 -7.424 -2.203 1.00 0.00 C ATOM 282 O GLU A 440 5.680 -7.086 -2.542 1.00 0.00 O ATOM 283 CB GLU A 440 8.679 -6.437 -0.860 1.00 0.00 C ATOM 284 CG GLU A 440 8.659 -5.162 -1.686 1.00 0.00 C ATOM 285 CD GLU A 440 10.040 -4.561 -1.865 1.00 0.00 C ATOM 286 OE1 GLU A 440 10.929 -5.265 -2.387 1.00 0.00 O ATOM 287 OE2 GLU A 440 10.231 -3.387 -1.483 1.00 0.00 O ATOM 0 H GLU A 440 8.323 -8.494 0.464 1.00 0.00 H new ATOM 0 HA GLU A 440 6.609 -6.497 -0.288 1.00 0.00 H new ATOM 0 HB2 GLU A 440 9.005 -6.199 0.152 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.417 -7.121 -1.280 1.00 0.00 H new ATOM 0 HG2 GLU A 440 8.230 -5.375 -2.665 1.00 0.00 H new ATOM 0 HG3 GLU A 440 8.009 -4.432 -1.204 1.00 0.00 H new ATOM 294 N ASP A 441 7.659 -8.042 -3.021 1.00 0.00 N ATOM 295 CA ASP A 441 7.294 -8.368 -4.394 1.00 0.00 C ATOM 296 C ASP A 441 5.813 -8.718 -4.495 1.00 0.00 C ATOM 297 O ASP A 441 5.086 -8.153 -5.310 1.00 0.00 O ATOM 298 CB ASP A 441 8.143 -9.532 -4.908 1.00 0.00 C ATOM 299 CG ASP A 441 8.026 -9.716 -6.408 1.00 0.00 C ATOM 300 OD1 ASP A 441 6.954 -9.396 -6.964 1.00 0.00 O ATOM 301 OD2 ASP A 441 9.007 -10.179 -7.027 1.00 0.00 O ATOM 0 H ASP A 441 8.602 -8.327 -2.757 1.00 0.00 H new ATOM 0 HA ASP A 441 7.484 -7.490 -5.012 1.00 0.00 H new ATOM 0 HB2 ASP A 441 9.187 -9.360 -4.646 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.836 -10.450 -4.407 1.00 0.00 H new ATOM 306 N GLU A 442 5.374 -9.656 -3.661 1.00 0.00 N ATOM 307 CA GLU A 442 3.980 -10.083 -3.658 1.00 0.00 C ATOM 308 C GLU A 442 3.042 -8.880 -3.611 1.00 0.00 C ATOM 309 O GLU A 442 2.274 -8.642 -4.543 1.00 0.00 O ATOM 310 CB GLU A 442 3.707 -11.003 -2.465 1.00 0.00 C ATOM 311 CG GLU A 442 4.502 -12.297 -2.501 1.00 0.00 C ATOM 312 CD GLU A 442 3.774 -13.408 -3.233 1.00 0.00 C ATOM 313 OE1 GLU A 442 2.526 -13.434 -3.184 1.00 0.00 O ATOM 314 OE2 GLU A 442 4.453 -14.252 -3.855 1.00 0.00 O ATOM 0 H GLU A 442 5.963 -10.134 -2.979 1.00 0.00 H new ATOM 0 HA GLU A 442 3.793 -10.632 -4.581 1.00 0.00 H new ATOM 0 HB2 GLU A 442 3.940 -10.469 -1.544 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.644 -11.240 -2.436 1.00 0.00 H new ATOM 0 HG2 GLU A 442 5.462 -12.116 -2.985 1.00 0.00 H new ATOM 0 HG3 GLU A 442 4.714 -12.617 -1.481 1.00 0.00 H new ATOM 321 N ILE A 443 3.112 -8.126 -2.519 1.00 0.00 N ATOM 322 CA ILE A 443 2.270 -6.947 -2.350 1.00 0.00 C ATOM 323 C ILE A 443 2.186 -6.142 -3.642 1.00 0.00 C ATOM 324 O ILE A 443 1.100 -5.766 -4.083 1.00 0.00 O ATOM 325 CB ILE A 443 2.796 -6.037 -1.224 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.722 -6.760 0.122 1.00 0.00 C ATOM 327 CG2 ILE A 443 2.003 -4.739 -1.179 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.624 -6.162 1.179 1.00 0.00 C ATOM 0 H ILE A 443 3.742 -8.310 -1.738 1.00 0.00 H new ATOM 0 HA ILE A 443 1.276 -7.304 -2.083 1.00 0.00 H new ATOM 0 HB ILE A 443 3.839 -5.796 -1.428 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.693 -6.740 0.480 1.00 0.00 H new ATOM 0 HG13 ILE A 443 2.989 -7.807 -0.022 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.386 -4.106 -0.378 1.00 0.00 H new ATOM 0 HG22 ILE A 443 2.102 -4.219 -2.132 1.00 0.00 H new ATOM 0 HG23 ILE A 443 0.952 -4.961 -0.995 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.520 -6.725 2.107 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.659 -6.207 0.841 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.343 -5.123 1.351 1.00 0.00 H new ATOM 340 N THR A 444 3.341 -5.882 -4.247 1.00 0.00 N ATOM 341 CA THR A 444 3.399 -5.123 -5.490 1.00 0.00 C ATOM 342 C THR A 444 2.496 -5.738 -6.553 1.00 0.00 C ATOM 343 O THR A 444 1.599 -5.077 -7.076 1.00 0.00 O ATOM 344 CB THR A 444 4.837 -5.047 -6.036 1.00 0.00 C ATOM 345 OG1 THR A 444 5.764 -4.886 -4.955 1.00 0.00 O ATOM 346 CG2 THR A 444 4.985 -3.891 -7.013 1.00 0.00 C ATOM 0 H THR A 444 4.249 -6.186 -3.896 1.00 0.00 H new ATOM 0 HA THR A 444 3.052 -4.116 -5.261 1.00 0.00 H new ATOM 0 HB THR A 444 5.051 -5.977 -6.563 1.00 0.00 H new ATOM 0 HG1 THR A 444 6.676 -4.840 -5.310 1.00 0.00 H new ATOM 0 HG21 THR A 444 6.009 -3.858 -7.385 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.300 -4.031 -7.849 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.753 -2.954 -6.506 1.00 0.00 H new ATOM 354 N ALA A 445 2.738 -7.006 -6.867 1.00 0.00 N ATOM 355 CA ALA A 445 1.945 -7.711 -7.866 1.00 0.00 C ATOM 356 C ALA A 445 0.452 -7.516 -7.618 1.00 0.00 C ATOM 357 O ALA A 445 -0.329 -7.375 -8.559 1.00 0.00 O ATOM 358 CB ALA A 445 2.292 -9.192 -7.867 1.00 0.00 C ATOM 0 H ALA A 445 3.478 -7.567 -6.444 1.00 0.00 H new ATOM 0 HA ALA A 445 2.183 -7.293 -8.844 1.00 0.00 H new ATOM 0 HB1 ALA A 445 1.692 -9.706 -8.618 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.350 -9.318 -8.099 1.00 0.00 H new ATOM 0 HB3 ALA A 445 2.083 -9.615 -6.884 1.00 0.00 H new ATOM 364 N SER A 446 0.064 -7.511 -6.347 1.00 0.00 N ATOM 365 CA SER A 446 -1.336 -7.339 -5.977 1.00 0.00 C ATOM 366 C SER A 446 -1.863 -5.990 -6.457 1.00 0.00 C ATOM 367 O SER A 446 -3.054 -5.836 -6.728 1.00 0.00 O ATOM 368 CB SER A 446 -1.502 -7.453 -4.460 1.00 0.00 C ATOM 369 OG SER A 446 -0.982 -8.681 -3.981 1.00 0.00 O ATOM 0 H SER A 446 0.699 -7.624 -5.557 1.00 0.00 H new ATOM 0 HA SER A 446 -1.913 -8.128 -6.459 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.991 -6.623 -3.972 1.00 0.00 H new ATOM 0 HB3 SER A 446 -2.558 -7.375 -4.200 1.00 0.00 H new ATOM 0 HG SER A 446 -1.099 -8.729 -3.009 1.00 0.00 H new ATOM 375 N PHE A 447 -0.966 -5.014 -6.561 1.00 0.00 N ATOM 376 CA PHE A 447 -1.339 -3.678 -7.008 1.00 0.00 C ATOM 377 C PHE A 447 -0.551 -3.280 -8.253 1.00 0.00 C ATOM 378 O PHE A 447 -0.295 -2.099 -8.488 1.00 0.00 O ATOM 379 CB PHE A 447 -1.101 -2.658 -5.892 1.00 0.00 C ATOM 380 CG PHE A 447 -1.941 -2.899 -4.671 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.622 -3.915 -3.784 1.00 0.00 C ATOM 382 CD2 PHE A 447 -3.049 -2.110 -4.409 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.394 -4.139 -2.659 1.00 0.00 C ATOM 384 CE2 PHE A 447 -3.824 -2.329 -3.286 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.496 -3.345 -2.410 1.00 0.00 C ATOM 0 H PHE A 447 0.024 -5.124 -6.342 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.399 -3.690 -7.260 1.00 0.00 H new ATOM 0 HB2 PHE A 447 -0.049 -2.680 -5.609 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.308 -1.658 -6.274 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.761 -4.539 -3.974 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.310 -1.314 -5.091 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -2.135 -4.934 -1.976 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -4.685 -1.706 -3.094 1.00 0.00 H new ATOM 0 HZ PHE A 447 -4.100 -3.518 -1.532 1.00 0.00 H new ATOM 395 N ARG A 448 -0.167 -4.275 -9.046 1.00 0.00 N ATOM 396 CA ARG A 448 0.594 -4.031 -10.265 1.00 0.00 C ATOM 397 C ARG A 448 -0.338 -3.848 -11.460 1.00 0.00 C ATOM 398 O ARG A 448 -0.015 -3.129 -12.406 1.00 0.00 O ATOM 399 CB ARG A 448 1.559 -5.188 -10.530 1.00 0.00 C ATOM 400 CG ARG A 448 2.934 -4.986 -9.914 1.00 0.00 C ATOM 401 CD ARG A 448 3.696 -3.867 -10.606 1.00 0.00 C ATOM 402 NE ARG A 448 4.426 -4.344 -11.777 1.00 0.00 N ATOM 403 CZ ARG A 448 3.905 -4.395 -12.998 1.00 0.00 C ATOM 404 NH1 ARG A 448 2.656 -4.001 -13.206 1.00 0.00 N ATOM 405 NH2 ARG A 448 4.633 -4.842 -14.013 1.00 0.00 N ATOM 0 H ARG A 448 -0.371 -5.258 -8.866 1.00 0.00 H new ATOM 0 HA ARG A 448 1.167 -3.114 -10.128 1.00 0.00 H new ATOM 0 HB2 ARG A 448 1.126 -6.108 -10.138 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.668 -5.320 -11.606 1.00 0.00 H new ATOM 0 HG2 ARG A 448 2.828 -4.754 -8.854 1.00 0.00 H new ATOM 0 HG3 ARG A 448 3.504 -5.912 -9.983 1.00 0.00 H new ATOM 0 HD2 ARG A 448 2.998 -3.086 -10.907 1.00 0.00 H new ATOM 0 HD3 ARG A 448 4.395 -3.416 -9.902 1.00 0.00 H new ATOM 0 HE ARG A 448 5.389 -4.655 -11.651 1.00 0.00 H new ATOM 0 HH11 ARG A 448 2.093 -3.658 -12.428 1.00 0.00 H new ATOM 0 HH12 ARG A 448 2.258 -4.041 -14.144 1.00 0.00 H new ATOM 0 HH21 ARG A 448 5.594 -5.147 -13.856 1.00 0.00 H new ATOM 0 HH22 ARG A 448 4.232 -4.881 -14.950 1.00 0.00 H new ATOM 419 N ARG A 449 -1.493 -4.503 -11.409 1.00 0.00 N ATOM 420 CA ARG A 449 -2.470 -4.414 -12.487 1.00 0.00 C ATOM 421 C ARG A 449 -2.988 -2.986 -12.635 1.00 0.00 C ATOM 422 O ARG A 449 -3.675 -2.661 -13.603 1.00 0.00 O ATOM 423 CB ARG A 449 -3.637 -5.367 -12.226 1.00 0.00 C ATOM 424 CG ARG A 449 -4.289 -5.174 -10.867 1.00 0.00 C ATOM 425 CD ARG A 449 -5.659 -5.831 -10.807 1.00 0.00 C ATOM 426 NE ARG A 449 -5.577 -7.233 -10.407 1.00 0.00 N ATOM 427 CZ ARG A 449 -6.628 -8.043 -10.344 1.00 0.00 C ATOM 428 NH1 ARG A 449 -7.835 -7.591 -10.654 1.00 0.00 N ATOM 429 NH2 ARG A 449 -6.473 -9.306 -9.971 1.00 0.00 N ATOM 0 H ARG A 449 -1.775 -5.101 -10.632 1.00 0.00 H new ATOM 0 HA ARG A 449 -1.976 -4.701 -13.416 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -4.389 -5.229 -13.003 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -3.281 -6.394 -12.306 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -3.648 -5.595 -10.092 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -4.386 -4.109 -10.657 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -6.290 -5.289 -10.102 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -6.138 -5.760 -11.784 1.00 0.00 H new ATOM 0 HE ARG A 449 -4.662 -7.611 -10.162 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -7.958 -6.620 -10.941 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -8.641 -8.214 -10.605 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -5.546 -9.657 -9.732 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -7.281 -9.926 -9.923 1.00 0.00 H new ATOM 443 N PHE A 450 -2.654 -2.138 -11.668 1.00 0.00 N ATOM 444 CA PHE A 450 -3.086 -0.745 -11.690 1.00 0.00 C ATOM 445 C PHE A 450 -2.001 0.152 -12.277 1.00 0.00 C ATOM 446 O PHE A 450 -2.292 1.180 -12.886 1.00 0.00 O ATOM 447 CB PHE A 450 -3.442 -0.278 -10.277 1.00 0.00 C ATOM 448 CG PHE A 450 -4.542 -1.077 -9.640 1.00 0.00 C ATOM 449 CD1 PHE A 450 -5.838 -1.005 -10.124 1.00 0.00 C ATOM 450 CD2 PHE A 450 -4.280 -1.901 -8.557 1.00 0.00 C ATOM 451 CE1 PHE A 450 -6.853 -1.740 -9.540 1.00 0.00 C ATOM 452 CE2 PHE A 450 -5.291 -2.638 -7.969 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.578 -2.558 -8.461 1.00 0.00 C ATOM 0 H PHE A 450 -2.086 -2.391 -10.860 1.00 0.00 H new ATOM 0 HA PHE A 450 -3.971 -0.675 -12.322 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.553 -0.335 -9.650 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -3.740 0.770 -10.314 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.058 -0.367 -10.967 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -3.275 -1.968 -8.168 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -7.859 -1.675 -9.927 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -5.074 -3.276 -7.125 1.00 0.00 H new ATOM 0 HZ PHE A 450 -7.369 -3.134 -8.003 1.00 0.00 H new ATOM 463 N GLY A 451 -0.746 -0.245 -12.087 1.00 0.00 N ATOM 464 CA GLY A 451 0.365 0.534 -12.603 1.00 0.00 C ATOM 465 C GLY A 451 1.623 0.368 -11.774 1.00 0.00 C ATOM 466 O GLY A 451 1.694 -0.470 -10.875 1.00 0.00 O ATOM 0 H GLY A 451 -0.479 -1.092 -11.585 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.569 0.234 -13.631 1.00 0.00 H new ATOM 0 HA3 GLY A 451 0.086 1.587 -12.628 1.00 0.00 H new ATOM 470 N PRO A 452 2.648 1.179 -12.077 1.00 0.00 N ATOM 471 CA PRO A 452 3.929 1.136 -11.367 1.00 0.00 C ATOM 472 C PRO A 452 3.850 1.787 -9.990 1.00 0.00 C ATOM 473 O PRO A 452 3.458 2.948 -9.862 1.00 0.00 O ATOM 474 CB PRO A 452 4.868 1.929 -12.280 1.00 0.00 C ATOM 475 CG PRO A 452 3.979 2.880 -13.004 1.00 0.00 C ATOM 476 CD PRO A 452 2.633 2.201 -13.138 1.00 0.00 C ATOM 0 HA PRO A 452 4.257 0.114 -11.180 1.00 0.00 H new ATOM 0 HB2 PRO A 452 5.627 2.458 -11.704 1.00 0.00 H new ATOM 0 HB3 PRO A 452 5.394 1.272 -12.973 1.00 0.00 H new ATOM 0 HG2 PRO A 452 3.887 3.817 -12.456 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.389 3.123 -13.984 1.00 0.00 H new ATOM 0 HD2 PRO A 452 1.814 2.907 -13.002 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.507 1.753 -14.124 1.00 0.00 H new ATOM 484 N LEU A 453 4.225 1.033 -8.962 1.00 0.00 N ATOM 485 CA LEU A 453 4.197 1.537 -7.593 1.00 0.00 C ATOM 486 C LEU A 453 5.326 0.930 -6.767 1.00 0.00 C ATOM 487 O LEU A 453 6.107 0.119 -7.264 1.00 0.00 O ATOM 488 CB LEU A 453 2.848 1.227 -6.942 1.00 0.00 C ATOM 489 CG LEU A 453 2.627 -0.225 -6.516 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.476 -0.322 -5.526 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.363 -1.103 -7.731 1.00 0.00 C ATOM 0 H LEU A 453 4.552 0.071 -9.050 1.00 0.00 H new ATOM 0 HA LEU A 453 4.337 2.617 -7.626 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.736 1.863 -6.064 1.00 0.00 H new ATOM 0 HB3 LEU A 453 2.058 1.504 -7.640 1.00 0.00 H new ATOM 0 HG LEU A 453 3.533 -0.581 -6.025 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.334 -1.363 -5.234 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.705 0.274 -4.643 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.564 0.053 -5.991 1.00 0.00 H new ATOM 0 HD21 LEU A 453 2.208 -2.133 -7.409 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.473 -0.747 -8.250 1.00 0.00 H new ATOM 0 HD23 LEU A 453 3.219 -1.058 -8.405 1.00 0.00 H new ATOM 503 N VAL A 454 5.404 1.327 -5.500 1.00 0.00 N ATOM 504 CA VAL A 454 6.435 0.819 -4.603 1.00 0.00 C ATOM 505 C VAL A 454 5.881 0.594 -3.200 1.00 0.00 C ATOM 506 O VAL A 454 5.114 1.408 -2.686 1.00 0.00 O ATOM 507 CB VAL A 454 7.632 1.785 -4.521 1.00 0.00 C ATOM 508 CG1 VAL A 454 7.190 3.141 -3.993 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.732 1.197 -3.649 1.00 0.00 C ATOM 0 H VAL A 454 4.766 1.998 -5.073 1.00 0.00 H new ATOM 0 HA VAL A 454 6.772 -0.132 -5.014 1.00 0.00 H new ATOM 0 HB VAL A 454 8.032 1.926 -5.525 1.00 0.00 H new ATOM 0 HG11 VAL A 454 8.049 3.809 -3.942 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.440 3.565 -4.661 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.764 3.022 -2.997 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.570 1.893 -3.602 1.00 0.00 H new ATOM 0 HG22 VAL A 454 8.347 1.025 -2.644 1.00 0.00 H new ATOM 0 HG23 VAL A 454 9.068 0.252 -4.076 1.00 0.00 H new ATOM 519 N VAL A 455 6.275 -0.516 -2.585 1.00 0.00 N ATOM 520 CA VAL A 455 5.819 -0.849 -1.241 1.00 0.00 C ATOM 521 C VAL A 455 6.781 -0.314 -0.186 1.00 0.00 C ATOM 522 O VAL A 455 7.999 -0.374 -0.355 1.00 0.00 O ATOM 523 CB VAL A 455 5.670 -2.371 -1.059 1.00 0.00 C ATOM 524 CG1 VAL A 455 4.931 -2.684 0.233 1.00 0.00 C ATOM 525 CG2 VAL A 455 4.954 -2.982 -2.254 1.00 0.00 C ATOM 0 H VAL A 455 6.910 -1.200 -2.996 1.00 0.00 H new ATOM 0 HA VAL A 455 4.844 -0.378 -1.112 1.00 0.00 H new ATOM 0 HB VAL A 455 6.665 -2.812 -0.996 1.00 0.00 H new ATOM 0 HG11 VAL A 455 4.835 -3.764 0.345 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.488 -2.280 1.078 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.939 -2.233 0.203 1.00 0.00 H new ATOM 0 HG21 VAL A 455 4.857 -4.058 -2.109 1.00 0.00 H new ATOM 0 HG22 VAL A 455 3.963 -2.538 -2.350 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.528 -2.788 -3.160 1.00 0.00 H new ATOM 535 N ASP A 456 6.227 0.209 0.902 1.00 0.00 N ATOM 536 CA ASP A 456 7.036 0.753 1.986 1.00 0.00 C ATOM 537 C ASP A 456 6.270 0.720 3.305 1.00 0.00 C ATOM 538 O ASP A 456 5.332 1.490 3.509 1.00 0.00 O ATOM 539 CB ASP A 456 7.460 2.187 1.664 1.00 0.00 C ATOM 540 CG ASP A 456 8.677 2.623 2.455 1.00 0.00 C ATOM 541 OD1 ASP A 456 9.722 1.946 2.358 1.00 0.00 O ATOM 542 OD2 ASP A 456 8.585 3.641 3.172 1.00 0.00 O ATOM 0 H ASP A 456 5.221 0.268 1.057 1.00 0.00 H new ATOM 0 HA ASP A 456 7.927 0.133 2.088 1.00 0.00 H new ATOM 0 HB2 ASP A 456 7.675 2.269 0.598 1.00 0.00 H new ATOM 0 HB3 ASP A 456 6.632 2.864 1.875 1.00 0.00 H new ATOM 547 N TRP A 457 6.677 -0.177 4.196 1.00 0.00 N ATOM 548 CA TRP A 457 6.028 -0.311 5.496 1.00 0.00 C ATOM 549 C TRP A 457 6.833 0.394 6.581 1.00 0.00 C ATOM 550 O TRP A 457 8.039 0.610 6.452 1.00 0.00 O ATOM 551 CB TRP A 457 5.854 -1.789 5.851 1.00 0.00 C ATOM 552 CG TRP A 457 7.061 -2.621 5.542 1.00 0.00 C ATOM 553 CD1 TRP A 457 7.957 -3.130 6.439 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.506 -3.038 4.247 1.00 0.00 C ATOM 555 NE1 TRP A 457 8.932 -3.839 5.778 1.00 0.00 N ATOM 556 CE2 TRP A 457 8.677 -3.798 4.433 1.00 0.00 C ATOM 557 CE3 TRP A 457 7.028 -2.845 2.948 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.376 -4.362 3.369 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.722 -3.406 1.892 1.00 0.00 C ATOM 560 CH2 TRP A 457 8.885 -4.157 2.108 1.00 0.00 C ATOM 0 H TRP A 457 7.452 -0.822 4.043 1.00 0.00 H new ATOM 0 HA TRP A 457 5.046 0.159 5.435 1.00 0.00 H new ATOM 0 HB2 TRP A 457 5.624 -1.875 6.913 1.00 0.00 H new ATOM 0 HB3 TRP A 457 4.998 -2.188 5.306 1.00 0.00 H new ATOM 0 HD1 TRP A 457 7.907 -2.995 7.509 1.00 0.00 H new ATOM 0 HE1 TRP A 457 9.718 -4.318 6.218 1.00 0.00 H new ATOM 0 HE3 TRP A 457 6.132 -2.268 2.772 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 10.273 -4.940 3.533 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 7.362 -3.263 0.884 1.00 0.00 H new ATOM 0 HH2 TRP A 457 9.405 -4.583 1.262 1.00 0.00 H new ATOM 571 N PRO A 458 6.155 0.761 7.678 1.00 0.00 N ATOM 572 CA PRO A 458 6.789 1.447 8.809 1.00 0.00 C ATOM 573 C PRO A 458 7.737 0.536 9.581 1.00 0.00 C ATOM 574 O PRO A 458 8.358 0.956 10.558 1.00 0.00 O ATOM 575 CB PRO A 458 5.603 1.852 9.688 1.00 0.00 C ATOM 576 CG PRO A 458 4.537 0.862 9.366 1.00 0.00 C ATOM 577 CD PRO A 458 4.717 0.535 7.900 1.00 0.00 C ATOM 0 HA PRO A 458 7.403 2.287 8.484 1.00 0.00 H new ATOM 0 HB2 PRO A 458 5.865 1.821 10.746 1.00 0.00 H new ATOM 0 HB3 PRO A 458 5.278 2.869 9.470 1.00 0.00 H new ATOM 0 HG2 PRO A 458 4.633 -0.032 9.982 1.00 0.00 H new ATOM 0 HG3 PRO A 458 3.547 1.276 9.557 1.00 0.00 H new ATOM 0 HD2 PRO A 458 4.432 -0.494 7.679 1.00 0.00 H new ATOM 0 HD3 PRO A 458 4.106 1.178 7.266 1.00 0.00 H new ATOM 585 N HIS A 459 7.845 -0.712 9.136 1.00 0.00 N ATOM 586 CA HIS A 459 8.720 -1.682 9.786 1.00 0.00 C ATOM 587 C HIS A 459 9.725 -2.257 8.793 1.00 0.00 C ATOM 588 O HIS A 459 10.071 -3.437 8.856 1.00 0.00 O ATOM 589 CB HIS A 459 7.895 -2.810 10.406 1.00 0.00 C ATOM 590 CG HIS A 459 7.336 -2.472 11.754 1.00 0.00 C ATOM 591 ND1 HIS A 459 7.485 -3.287 12.856 1.00 0.00 N ATOM 592 CD2 HIS A 459 6.627 -1.399 12.175 1.00 0.00 C ATOM 593 CE1 HIS A 459 6.890 -2.731 13.896 1.00 0.00 C ATOM 594 NE2 HIS A 459 6.362 -1.584 13.509 1.00 0.00 N ATOM 0 H HIS A 459 7.338 -1.075 8.329 1.00 0.00 H new ATOM 0 HA HIS A 459 9.269 -1.168 10.575 1.00 0.00 H new ATOM 0 HB2 HIS A 459 7.074 -3.061 9.734 1.00 0.00 H new ATOM 0 HB3 HIS A 459 8.519 -3.700 10.493 1.00 0.00 H new ATOM 0 HD2 HIS A 459 6.326 -0.554 11.573 1.00 0.00 H new ATOM 0 HE1 HIS A 459 6.843 -3.144 14.893 1.00 0.00 H new ATOM 0 HE2 HIS A 459 5.842 -0.940 14.105 1.00 0.00 H new ATOM 602 N LYS A 460 10.191 -1.416 7.875 1.00 0.00 N ATOM 603 CA LYS A 460 11.157 -1.840 6.868 1.00 0.00 C ATOM 604 C LYS A 460 12.583 -1.709 7.393 1.00 0.00 C ATOM 605 O LYS A 460 13.293 -2.703 7.542 1.00 0.00 O ATOM 606 CB LYS A 460 10.993 -1.009 5.593 1.00 0.00 C ATOM 607 CG LYS A 460 12.099 -1.232 4.576 1.00 0.00 C ATOM 608 CD LYS A 460 11.760 -2.365 3.623 1.00 0.00 C ATOM 609 CE LYS A 460 12.269 -3.701 4.142 1.00 0.00 C ATOM 610 NZ LYS A 460 12.503 -4.673 3.038 1.00 0.00 N ATOM 0 H LYS A 460 9.915 -0.436 7.808 1.00 0.00 H new ATOM 0 HA LYS A 460 10.968 -2.889 6.638 1.00 0.00 H new ATOM 0 HB2 LYS A 460 10.034 -1.249 5.133 1.00 0.00 H new ATOM 0 HB3 LYS A 460 10.963 0.048 5.859 1.00 0.00 H new ATOM 0 HG2 LYS A 460 12.263 -0.316 4.009 1.00 0.00 H new ATOM 0 HG3 LYS A 460 13.031 -1.458 5.094 1.00 0.00 H new ATOM 0 HD2 LYS A 460 10.680 -2.415 3.485 1.00 0.00 H new ATOM 0 HD3 LYS A 460 12.197 -2.163 2.645 1.00 0.00 H new ATOM 0 HE2 LYS A 460 13.197 -3.547 4.693 1.00 0.00 H new ATOM 0 HE3 LYS A 460 11.547 -4.117 4.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 13.005 -5.505 3.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 11.590 -4.970 2.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 13.077 -4.224 2.296 1.00 0.00 H new ATOM 624 N ALA A 461 12.995 -0.477 7.673 1.00 0.00 N ATOM 625 CA ALA A 461 14.335 -0.217 8.185 1.00 0.00 C ATOM 626 C ALA A 461 14.607 -1.029 9.447 1.00 0.00 C ATOM 627 O ALA A 461 15.571 -1.791 9.509 1.00 0.00 O ATOM 628 CB ALA A 461 14.515 1.268 8.461 1.00 0.00 C ATOM 0 H ALA A 461 12.420 0.357 7.554 1.00 0.00 H new ATOM 0 HA ALA A 461 15.054 -0.524 7.425 1.00 0.00 H new ATOM 0 HB1 ALA A 461 15.520 1.448 8.843 1.00 0.00 H new ATOM 0 HB2 ALA A 461 14.372 1.830 7.538 1.00 0.00 H new ATOM 0 HB3 ALA A 461 13.783 1.592 9.200 1.00 0.00 H new ATOM 634 N GLU A 462 13.752 -0.859 10.451 1.00 0.00 N ATOM 635 CA GLU A 462 13.903 -1.575 11.712 1.00 0.00 C ATOM 636 C GLU A 462 14.111 -3.067 11.468 1.00 0.00 C ATOM 637 O GLU A 462 15.108 -3.645 11.900 1.00 0.00 O ATOM 638 CB GLU A 462 12.675 -1.358 12.598 1.00 0.00 C ATOM 639 CG GLU A 462 12.586 0.042 13.181 1.00 0.00 C ATOM 640 CD GLU A 462 13.817 0.421 13.982 1.00 0.00 C ATOM 641 OE1 GLU A 462 13.951 -0.062 15.126 1.00 0.00 O ATOM 642 OE2 GLU A 462 14.645 1.199 13.465 1.00 0.00 O ATOM 0 H GLU A 462 12.948 -0.232 10.415 1.00 0.00 H new ATOM 0 HA GLU A 462 14.783 -1.181 12.221 1.00 0.00 H new ATOM 0 HB2 GLU A 462 11.776 -1.557 12.014 1.00 0.00 H new ATOM 0 HB3 GLU A 462 12.693 -2.082 13.413 1.00 0.00 H new ATOM 0 HG2 GLU A 462 12.448 0.760 12.372 1.00 0.00 H new ATOM 0 HG3 GLU A 462 11.706 0.110 13.821 1.00 0.00 H new ATOM 649 N SER A 463 13.160 -3.685 10.774 1.00 0.00 N ATOM 650 CA SER A 463 13.235 -5.111 10.476 1.00 0.00 C ATOM 651 C SER A 463 14.084 -5.362 9.234 1.00 0.00 C ATOM 652 O SER A 463 13.609 -5.233 8.106 1.00 0.00 O ATOM 653 CB SER A 463 11.832 -5.686 10.274 1.00 0.00 C ATOM 654 OG SER A 463 11.889 -7.060 9.933 1.00 0.00 O ATOM 0 H SER A 463 12.329 -3.221 10.408 1.00 0.00 H new ATOM 0 HA SER A 463 13.705 -5.610 11.323 1.00 0.00 H new ATOM 0 HB2 SER A 463 11.248 -5.558 11.186 1.00 0.00 H new ATOM 0 HB3 SER A 463 11.319 -5.134 9.487 1.00 0.00 H new ATOM 0 HG SER A 463 10.980 -7.405 9.811 1.00 0.00 H new ATOM 660 N LYS A 464 15.345 -5.723 9.449 1.00 0.00 N ATOM 661 CA LYS A 464 16.263 -5.994 8.349 1.00 0.00 C ATOM 662 C LYS A 464 15.642 -6.965 7.350 1.00 0.00 C ATOM 663 O LYS A 464 15.779 -6.796 6.139 1.00 0.00 O ATOM 664 CB LYS A 464 17.577 -6.567 8.884 1.00 0.00 C ATOM 665 CG LYS A 464 18.724 -6.486 7.891 1.00 0.00 C ATOM 666 CD LYS A 464 18.788 -7.724 7.012 1.00 0.00 C ATOM 667 CE LYS A 464 19.866 -7.595 5.946 1.00 0.00 C ATOM 668 NZ LYS A 464 21.213 -7.944 6.475 1.00 0.00 N ATOM 0 H LYS A 464 15.755 -5.835 10.376 1.00 0.00 H new ATOM 0 HA LYS A 464 16.466 -5.053 7.837 1.00 0.00 H new ATOM 0 HB2 LYS A 464 17.855 -6.031 9.792 1.00 0.00 H new ATOM 0 HB3 LYS A 464 17.422 -7.609 9.164 1.00 0.00 H new ATOM 0 HG2 LYS A 464 18.604 -5.601 7.266 1.00 0.00 H new ATOM 0 HG3 LYS A 464 19.665 -6.371 8.429 1.00 0.00 H new ATOM 0 HD2 LYS A 464 18.988 -8.600 7.629 1.00 0.00 H new ATOM 0 HD3 LYS A 464 17.821 -7.884 6.536 1.00 0.00 H new ATOM 0 HE2 LYS A 464 19.626 -8.246 5.106 1.00 0.00 H new ATOM 0 HE3 LYS A 464 19.879 -6.574 5.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 21.920 -7.844 5.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 21.453 -7.306 7.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 21.208 -8.926 6.816 1.00 0.00 H new ATOM 682 N SER A 465 14.958 -7.982 7.866 1.00 0.00 N ATOM 683 CA SER A 465 14.318 -8.981 7.019 1.00 0.00 C ATOM 684 C SER A 465 13.374 -8.321 6.019 1.00 0.00 C ATOM 685 O SER A 465 12.949 -7.181 6.208 1.00 0.00 O ATOM 686 CB SER A 465 13.549 -9.989 7.875 1.00 0.00 C ATOM 687 OG SER A 465 14.427 -10.720 8.714 1.00 0.00 O ATOM 0 H SER A 465 14.833 -8.135 8.867 1.00 0.00 H new ATOM 0 HA SER A 465 15.097 -9.505 6.465 1.00 0.00 H new ATOM 0 HB2 SER A 465 12.811 -9.466 8.483 1.00 0.00 H new ATOM 0 HB3 SER A 465 13.001 -10.676 7.230 1.00 0.00 H new ATOM 0 HG SER A 465 13.911 -11.356 9.252 1.00 0.00 H new ATOM 693 N TYR A 466 13.050 -9.046 4.954 1.00 0.00 N ATOM 694 CA TYR A 466 12.158 -8.532 3.922 1.00 0.00 C ATOM 695 C TYR A 466 10.703 -8.858 4.247 1.00 0.00 C ATOM 696 O TYR A 466 9.878 -9.030 3.349 1.00 0.00 O ATOM 697 CB TYR A 466 12.531 -9.116 2.558 1.00 0.00 C ATOM 698 CG TYR A 466 13.084 -10.521 2.632 1.00 0.00 C ATOM 699 CD1 TYR A 466 12.236 -11.622 2.648 1.00 0.00 C ATOM 700 CD2 TYR A 466 14.453 -10.748 2.688 1.00 0.00 C ATOM 701 CE1 TYR A 466 12.737 -12.908 2.717 1.00 0.00 C ATOM 702 CE2 TYR A 466 14.963 -12.030 2.755 1.00 0.00 C ATOM 703 CZ TYR A 466 14.101 -13.107 2.769 1.00 0.00 C ATOM 704 OH TYR A 466 14.604 -14.386 2.837 1.00 0.00 O ATOM 0 H TYR A 466 13.392 -9.992 4.783 1.00 0.00 H new ATOM 0 HA TYR A 466 12.270 -7.448 3.888 1.00 0.00 H new ATOM 0 HB2 TYR A 466 11.649 -9.115 1.918 1.00 0.00 H new ATOM 0 HB3 TYR A 466 13.269 -8.469 2.084 1.00 0.00 H new ATOM 0 HD1 TYR A 466 11.168 -11.470 2.606 1.00 0.00 H new ATOM 0 HD2 TYR A 466 15.131 -9.907 2.679 1.00 0.00 H new ATOM 0 HE1 TYR A 466 12.064 -13.753 2.730 1.00 0.00 H new ATOM 0 HE2 TYR A 466 16.031 -12.188 2.796 1.00 0.00 H new ATOM 0 HH TYR A 466 15.583 -14.351 2.866 1.00 0.00 H new ATOM 714 N PHE A 467 10.396 -8.941 5.537 1.00 0.00 N ATOM 715 CA PHE A 467 9.042 -9.247 5.982 1.00 0.00 C ATOM 716 C PHE A 467 8.332 -7.987 6.471 1.00 0.00 C ATOM 717 O PHE A 467 8.928 -7.114 7.102 1.00 0.00 O ATOM 718 CB PHE A 467 9.073 -10.293 7.098 1.00 0.00 C ATOM 719 CG PHE A 467 9.261 -11.697 6.598 1.00 0.00 C ATOM 720 CD1 PHE A 467 8.412 -12.224 5.638 1.00 0.00 C ATOM 721 CD2 PHE A 467 10.286 -12.489 7.088 1.00 0.00 C ATOM 722 CE1 PHE A 467 8.582 -13.516 5.177 1.00 0.00 C ATOM 723 CE2 PHE A 467 10.462 -13.782 6.630 1.00 0.00 C ATOM 724 CZ PHE A 467 9.609 -14.295 5.673 1.00 0.00 C ATOM 0 H PHE A 467 11.067 -8.801 6.293 1.00 0.00 H new ATOM 0 HA PHE A 467 8.490 -9.648 5.132 1.00 0.00 H new ATOM 0 HB2 PHE A 467 9.880 -10.051 7.790 1.00 0.00 H new ATOM 0 HB3 PHE A 467 8.142 -10.238 7.662 1.00 0.00 H new ATOM 0 HD1 PHE A 467 7.608 -11.618 5.246 1.00 0.00 H new ATOM 0 HD2 PHE A 467 10.956 -12.092 7.837 1.00 0.00 H new ATOM 0 HE1 PHE A 467 7.913 -13.916 4.430 1.00 0.00 H new ATOM 0 HE2 PHE A 467 11.265 -14.389 7.020 1.00 0.00 H new ATOM 0 HZ PHE A 467 9.745 -15.304 5.313 1.00 0.00 H new ATOM 734 N PRO A 468 7.029 -7.889 6.172 1.00 0.00 N ATOM 735 CA PRO A 468 6.209 -6.741 6.570 1.00 0.00 C ATOM 736 C PRO A 468 5.776 -6.817 8.030 1.00 0.00 C ATOM 737 O PRO A 468 5.934 -7.839 8.697 1.00 0.00 O ATOM 738 CB PRO A 468 4.993 -6.835 5.646 1.00 0.00 C ATOM 739 CG PRO A 468 4.871 -8.285 5.327 1.00 0.00 C ATOM 740 CD PRO A 468 6.254 -8.892 5.422 1.00 0.00 C ATOM 0 HA PRO A 468 6.755 -5.801 6.484 1.00 0.00 H new ATOM 0 HB2 PRO A 468 4.094 -6.460 6.135 1.00 0.00 H new ATOM 0 HB3 PRO A 468 5.135 -6.242 4.743 1.00 0.00 H new ATOM 0 HG2 PRO A 468 4.189 -8.774 6.023 1.00 0.00 H new ATOM 0 HG3 PRO A 468 4.460 -8.424 4.327 1.00 0.00 H new ATOM 0 HD2 PRO A 468 6.235 -9.851 5.939 1.00 0.00 H new ATOM 0 HD3 PRO A 468 6.681 -9.071 4.435 1.00 0.00 H new ATOM 748 N PRO A 469 5.215 -5.710 8.541 1.00 0.00 N ATOM 749 CA PRO A 469 4.747 -5.627 9.927 1.00 0.00 C ATOM 750 C PRO A 469 3.486 -6.452 10.163 1.00 0.00 C ATOM 751 O PRO A 469 2.978 -7.104 9.251 1.00 0.00 O ATOM 752 CB PRO A 469 4.454 -4.136 10.114 1.00 0.00 C ATOM 753 CG PRO A 469 4.140 -3.638 8.746 1.00 0.00 C ATOM 754 CD PRO A 469 4.996 -4.455 7.803 1.00 0.00 C ATOM 0 HA PRO A 469 5.481 -6.022 10.630 1.00 0.00 H new ATOM 0 HB2 PRO A 469 3.617 -3.979 10.794 1.00 0.00 H new ATOM 0 HB3 PRO A 469 5.312 -3.614 10.538 1.00 0.00 H new ATOM 0 HG2 PRO A 469 3.081 -3.761 8.519 1.00 0.00 H new ATOM 0 HG3 PRO A 469 4.364 -2.575 8.656 1.00 0.00 H new ATOM 0 HD2 PRO A 469 4.492 -4.631 6.853 1.00 0.00 H new ATOM 0 HD3 PRO A 469 5.936 -3.953 7.577 1.00 0.00 H new ATOM 762 N LYS A 470 2.984 -6.418 11.393 1.00 0.00 N ATOM 763 CA LYS A 470 1.781 -7.161 11.750 1.00 0.00 C ATOM 764 C LYS A 470 0.811 -7.222 10.574 1.00 0.00 C ATOM 765 O LYS A 470 0.475 -8.301 10.090 1.00 0.00 O ATOM 766 CB LYS A 470 1.097 -6.514 12.956 1.00 0.00 C ATOM 767 CG LYS A 470 1.719 -6.900 14.287 1.00 0.00 C ATOM 768 CD LYS A 470 0.925 -6.342 15.457 1.00 0.00 C ATOM 769 CE LYS A 470 1.298 -4.895 15.743 1.00 0.00 C ATOM 770 NZ LYS A 470 0.976 -4.507 17.144 1.00 0.00 N ATOM 0 H LYS A 470 3.392 -5.883 12.160 1.00 0.00 H new ATOM 0 HA LYS A 470 2.075 -8.178 12.009 1.00 0.00 H new ATOM 0 HB2 LYS A 470 1.136 -5.430 12.847 1.00 0.00 H new ATOM 0 HB3 LYS A 470 0.044 -6.796 12.961 1.00 0.00 H new ATOM 0 HG2 LYS A 470 1.769 -7.986 14.365 1.00 0.00 H new ATOM 0 HG3 LYS A 470 2.743 -6.530 14.332 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -0.141 -6.408 15.239 1.00 0.00 H new ATOM 0 HD3 LYS A 470 1.107 -6.948 16.344 1.00 0.00 H new ATOM 0 HE2 LYS A 470 2.363 -4.752 15.562 1.00 0.00 H new ATOM 0 HE3 LYS A 470 0.766 -4.240 15.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 1.245 -3.514 17.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -0.045 -4.619 17.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 1.503 -5.116 17.803 1.00 0.00 H new ATOM 784 N GLY A 471 0.365 -6.054 10.119 1.00 0.00 N ATOM 785 CA GLY A 471 -0.561 -5.998 9.003 1.00 0.00 C ATOM 786 C GLY A 471 -0.873 -4.577 8.580 1.00 0.00 C ATOM 787 O GLY A 471 -1.971 -4.076 8.826 1.00 0.00 O ATOM 0 H GLY A 471 0.629 -5.147 10.503 1.00 0.00 H new ATOM 0 HA2 GLY A 471 -0.139 -6.541 8.157 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -1.487 -6.504 9.277 1.00 0.00 H new ATOM 791 N TYR A 472 0.093 -3.924 7.944 1.00 0.00 N ATOM 792 CA TYR A 472 -0.083 -2.550 7.490 1.00 0.00 C ATOM 793 C TYR A 472 1.126 -2.083 6.685 1.00 0.00 C ATOM 794 O TYR A 472 2.269 -2.234 7.116 1.00 0.00 O ATOM 795 CB TYR A 472 -0.304 -1.620 8.684 1.00 0.00 C ATOM 796 CG TYR A 472 0.567 -1.948 9.876 1.00 0.00 C ATOM 797 CD1 TYR A 472 1.898 -1.551 9.918 1.00 0.00 C ATOM 798 CD2 TYR A 472 0.060 -2.654 10.959 1.00 0.00 C ATOM 799 CE1 TYR A 472 2.698 -1.849 11.004 1.00 0.00 C ATOM 800 CE2 TYR A 472 0.852 -2.955 12.050 1.00 0.00 C ATOM 801 CZ TYR A 472 2.170 -2.550 12.068 1.00 0.00 C ATOM 802 OH TYR A 472 2.963 -2.849 13.152 1.00 0.00 O ATOM 0 H TYR A 472 1.007 -4.324 7.731 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.961 -2.518 6.845 1.00 0.00 H new ATOM 0 HB2 TYR A 472 -0.110 -0.593 8.375 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -1.351 -1.670 8.984 1.00 0.00 H new ATOM 0 HD1 TYR A 472 2.314 -1.000 9.087 1.00 0.00 H new ATOM 0 HD2 TYR A 472 -0.972 -2.973 10.948 1.00 0.00 H new ATOM 0 HE1 TYR A 472 3.731 -1.535 11.020 1.00 0.00 H new ATOM 0 HE2 TYR A 472 0.441 -3.504 12.884 1.00 0.00 H new ATOM 0 HH TYR A 472 2.438 -3.345 13.814 1.00 0.00 H new ATOM 812 N ALA A 473 0.864 -1.515 5.512 1.00 0.00 N ATOM 813 CA ALA A 473 1.929 -1.024 4.647 1.00 0.00 C ATOM 814 C ALA A 473 1.465 0.181 3.835 1.00 0.00 C ATOM 815 O ALA A 473 0.266 0.437 3.715 1.00 0.00 O ATOM 816 CB ALA A 473 2.412 -2.131 3.722 1.00 0.00 C ATOM 0 H ALA A 473 -0.076 -1.384 5.140 1.00 0.00 H new ATOM 0 HA ALA A 473 2.758 -0.707 5.279 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.207 -1.749 3.082 1.00 0.00 H new ATOM 0 HB2 ALA A 473 2.792 -2.962 4.316 1.00 0.00 H new ATOM 0 HB3 ALA A 473 1.583 -2.476 3.104 1.00 0.00 H new ATOM 822 N PHE A 474 2.421 0.918 3.278 1.00 0.00 N ATOM 823 CA PHE A 474 2.109 2.096 2.479 1.00 0.00 C ATOM 824 C PHE A 474 2.520 1.891 1.024 1.00 0.00 C ATOM 825 O PHE A 474 3.679 1.594 0.730 1.00 0.00 O ATOM 826 CB PHE A 474 2.815 3.328 3.050 1.00 0.00 C ATOM 827 CG PHE A 474 2.282 3.757 4.387 1.00 0.00 C ATOM 828 CD1 PHE A 474 0.989 4.242 4.509 1.00 0.00 C ATOM 829 CD2 PHE A 474 3.073 3.676 5.522 1.00 0.00 C ATOM 830 CE1 PHE A 474 0.497 4.639 5.738 1.00 0.00 C ATOM 831 CE2 PHE A 474 2.585 4.071 6.754 1.00 0.00 C ATOM 832 CZ PHE A 474 1.295 4.552 6.862 1.00 0.00 C ATOM 0 H PHE A 474 3.418 0.720 3.366 1.00 0.00 H new ATOM 0 HA PHE A 474 1.031 2.253 2.516 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.880 3.116 3.143 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.715 4.154 2.346 1.00 0.00 H new ATOM 0 HD1 PHE A 474 0.359 4.310 3.634 1.00 0.00 H new ATOM 0 HD2 PHE A 474 4.082 3.300 5.443 1.00 0.00 H new ATOM 0 HE1 PHE A 474 -0.511 5.017 5.819 1.00 0.00 H new ATOM 0 HE2 PHE A 474 3.212 4.003 7.631 1.00 0.00 H new ATOM 0 HZ PHE A 474 0.911 4.860 7.823 1.00 0.00 H new ATOM 842 N LEU A 475 1.562 2.049 0.117 1.00 0.00 N ATOM 843 CA LEU A 475 1.823 1.880 -1.309 1.00 0.00 C ATOM 844 C LEU A 475 1.910 3.232 -2.010 1.00 0.00 C ATOM 845 O LEU A 475 0.929 3.974 -2.077 1.00 0.00 O ATOM 846 CB LEU A 475 0.725 1.030 -1.951 1.00 0.00 C ATOM 847 CG LEU A 475 0.368 -0.266 -1.222 1.00 0.00 C ATOM 848 CD1 LEU A 475 -0.740 -1.004 -1.959 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.596 -1.152 -1.076 1.00 0.00 C ATOM 0 H LEU A 475 0.598 2.294 0.343 1.00 0.00 H new ATOM 0 HA LEU A 475 2.780 1.371 -1.421 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.176 1.638 -2.033 1.00 0.00 H new ATOM 0 HB3 LEU A 475 1.034 0.779 -2.966 1.00 0.00 H new ATOM 0 HG LEU A 475 0.008 -0.013 -0.225 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -0.981 -1.924 -1.426 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.626 -0.372 -2.011 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.407 -1.246 -2.968 1.00 0.00 H new ATOM 0 HD21 LEU A 475 1.323 -2.070 -0.555 1.00 0.00 H new ATOM 0 HD22 LEU A 475 1.987 -1.398 -2.063 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.360 -0.624 -0.505 1.00 0.00 H new ATOM 861 N LEU A 476 3.090 3.546 -2.533 1.00 0.00 N ATOM 862 CA LEU A 476 3.306 4.808 -3.232 1.00 0.00 C ATOM 863 C LEU A 476 3.163 4.627 -4.740 1.00 0.00 C ATOM 864 O LEU A 476 4.113 4.242 -5.422 1.00 0.00 O ATOM 865 CB LEU A 476 4.692 5.365 -2.903 1.00 0.00 C ATOM 866 CG LEU A 476 4.919 5.786 -1.451 1.00 0.00 C ATOM 867 CD1 LEU A 476 6.392 6.074 -1.202 1.00 0.00 C ATOM 868 CD2 LEU A 476 4.071 7.002 -1.109 1.00 0.00 C ATOM 0 H LEU A 476 3.912 2.944 -2.486 1.00 0.00 H new ATOM 0 HA LEU A 476 2.548 5.515 -2.896 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.435 4.611 -3.162 1.00 0.00 H new ATOM 0 HB3 LEU A 476 4.876 6.228 -3.543 1.00 0.00 H new ATOM 0 HG LEU A 476 4.616 4.963 -0.803 1.00 0.00 H new ATOM 0 HD11 LEU A 476 6.534 6.372 -0.163 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.977 5.177 -1.405 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.721 6.879 -1.859 1.00 0.00 H new ATOM 0 HD21 LEU A 476 4.246 7.287 -0.072 1.00 0.00 H new ATOM 0 HD22 LEU A 476 4.342 7.830 -1.764 1.00 0.00 H new ATOM 0 HD23 LEU A 476 3.017 6.761 -1.246 1.00 0.00 H new ATOM 880 N PHE A 477 1.970 4.908 -5.254 1.00 0.00 N ATOM 881 CA PHE A 477 1.703 4.777 -6.682 1.00 0.00 C ATOM 882 C PHE A 477 2.363 5.909 -7.464 1.00 0.00 C ATOM 883 O PHE A 477 2.014 7.077 -7.298 1.00 0.00 O ATOM 884 CB PHE A 477 0.195 4.774 -6.941 1.00 0.00 C ATOM 885 CG PHE A 477 -0.501 3.551 -6.416 1.00 0.00 C ATOM 886 CD1 PHE A 477 -0.866 3.464 -5.083 1.00 0.00 C ATOM 887 CD2 PHE A 477 -0.789 2.487 -7.256 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.507 2.340 -4.596 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.430 1.361 -6.776 1.00 0.00 C ATOM 890 CZ PHE A 477 -1.788 1.287 -5.444 1.00 0.00 C ATOM 0 H PHE A 477 1.173 5.228 -4.703 1.00 0.00 H new ATOM 0 HA PHE A 477 2.125 3.831 -7.021 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.246 5.659 -6.482 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.019 4.850 -8.014 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -0.647 4.284 -4.416 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -0.509 2.539 -8.298 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -1.787 2.286 -3.554 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -1.651 0.540 -7.442 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.287 0.407 -5.066 1.00 0.00 H new ATOM 900 N GLN A 478 3.318 5.552 -8.317 1.00 0.00 N ATOM 901 CA GLN A 478 4.027 6.538 -9.125 1.00 0.00 C ATOM 902 C GLN A 478 3.048 7.461 -9.841 1.00 0.00 C ATOM 903 O GLN A 478 3.190 8.683 -9.800 1.00 0.00 O ATOM 904 CB GLN A 478 4.927 5.839 -10.145 1.00 0.00 C ATOM 905 CG GLN A 478 5.706 6.800 -11.029 1.00 0.00 C ATOM 906 CD GLN A 478 6.889 7.422 -10.314 1.00 0.00 C ATOM 907 OE1 GLN A 478 6.724 8.283 -9.449 1.00 0.00 O ATOM 908 NE2 GLN A 478 8.092 6.989 -10.672 1.00 0.00 N ATOM 0 H GLN A 478 3.618 4.589 -8.466 1.00 0.00 H new ATOM 0 HA GLN A 478 4.644 7.141 -8.459 1.00 0.00 H new ATOM 0 HB2 GLN A 478 5.629 5.195 -9.616 1.00 0.00 H new ATOM 0 HB3 GLN A 478 4.315 5.194 -10.775 1.00 0.00 H new ATOM 0 HG2 GLN A 478 6.059 6.269 -11.913 1.00 0.00 H new ATOM 0 HG3 GLN A 478 5.040 7.590 -11.376 1.00 0.00 H new ATOM 0 HE21 GLN A 478 8.183 6.274 -11.394 1.00 0.00 H new ATOM 0 HE22 GLN A 478 8.925 7.371 -10.225 1.00 0.00 H new ATOM 917 N GLU A 479 2.055 6.869 -10.497 1.00 0.00 N ATOM 918 CA GLU A 479 1.053 7.640 -11.223 1.00 0.00 C ATOM 919 C GLU A 479 -0.152 7.939 -10.336 1.00 0.00 C ATOM 920 O GLU A 479 -0.866 7.030 -9.915 1.00 0.00 O ATOM 921 CB GLU A 479 0.603 6.883 -12.475 1.00 0.00 C ATOM 922 CG GLU A 479 1.434 7.197 -13.707 1.00 0.00 C ATOM 923 CD GLU A 479 2.925 7.097 -13.447 1.00 0.00 C ATOM 924 OE1 GLU A 479 3.444 5.962 -13.399 1.00 0.00 O ATOM 925 OE2 GLU A 479 3.572 8.153 -13.291 1.00 0.00 O ATOM 0 H GLU A 479 1.923 5.859 -10.541 1.00 0.00 H new ATOM 0 HA GLU A 479 1.506 8.585 -11.522 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.650 5.812 -12.278 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.440 7.124 -12.680 1.00 0.00 H new ATOM 0 HG2 GLU A 479 1.162 6.510 -14.509 1.00 0.00 H new ATOM 0 HG3 GLU A 479 1.196 8.202 -14.054 1.00 0.00 H new ATOM 932 N GLU A 480 -0.370 9.220 -10.056 1.00 0.00 N ATOM 933 CA GLU A 480 -1.487 9.639 -9.217 1.00 0.00 C ATOM 934 C GLU A 480 -2.789 8.992 -9.682 1.00 0.00 C ATOM 935 O GLU A 480 -3.597 8.544 -8.869 1.00 0.00 O ATOM 936 CB GLU A 480 -1.627 11.163 -9.238 1.00 0.00 C ATOM 937 CG GLU A 480 -0.691 11.873 -8.275 1.00 0.00 C ATOM 938 CD GLU A 480 -0.909 13.373 -8.248 1.00 0.00 C ATOM 939 OE1 GLU A 480 -0.964 13.985 -9.336 1.00 0.00 O ATOM 940 OE2 GLU A 480 -1.026 13.936 -7.139 1.00 0.00 O ATOM 0 H GLU A 480 0.212 9.985 -10.398 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.283 9.314 -8.197 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -1.436 11.523 -10.249 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -2.656 11.428 -8.994 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -0.834 11.471 -7.272 1.00 0.00 H new ATOM 0 HG3 GLU A 480 0.341 11.665 -8.557 1.00 0.00 H new ATOM 947 N SER A 481 -2.984 8.947 -10.996 1.00 0.00 N ATOM 948 CA SER A 481 -4.189 8.359 -11.570 1.00 0.00 C ATOM 949 C SER A 481 -4.380 6.926 -11.082 1.00 0.00 C ATOM 950 O SER A 481 -5.443 6.567 -10.577 1.00 0.00 O ATOM 951 CB SER A 481 -4.116 8.384 -13.098 1.00 0.00 C ATOM 952 OG SER A 481 -5.060 7.495 -13.668 1.00 0.00 O ATOM 0 H SER A 481 -2.323 9.310 -11.683 1.00 0.00 H new ATOM 0 HA SER A 481 -5.044 8.952 -11.244 1.00 0.00 H new ATOM 0 HB2 SER A 481 -4.302 9.396 -13.458 1.00 0.00 H new ATOM 0 HB3 SER A 481 -3.112 8.110 -13.422 1.00 0.00 H new ATOM 0 HG SER A 481 -4.994 7.531 -14.645 1.00 0.00 H new ATOM 958 N SER A 482 -3.341 6.112 -11.237 1.00 0.00 N ATOM 959 CA SER A 482 -3.394 4.717 -10.816 1.00 0.00 C ATOM 960 C SER A 482 -4.209 4.566 -9.535 1.00 0.00 C ATOM 961 O SER A 482 -5.015 3.646 -9.404 1.00 0.00 O ATOM 962 CB SER A 482 -1.980 4.173 -10.602 1.00 0.00 C ATOM 963 OG SER A 482 -1.959 2.759 -10.689 1.00 0.00 O ATOM 0 H SER A 482 -2.453 6.394 -11.651 1.00 0.00 H new ATOM 0 HA SER A 482 -3.881 4.143 -11.605 1.00 0.00 H new ATOM 0 HB2 SER A 482 -1.307 4.596 -11.348 1.00 0.00 H new ATOM 0 HB3 SER A 482 -1.611 4.486 -9.625 1.00 0.00 H new ATOM 0 HG SER A 482 -2.221 2.483 -11.592 1.00 0.00 H new ATOM 969 N VAL A 483 -3.991 5.478 -8.593 1.00 0.00 N ATOM 970 CA VAL A 483 -4.705 5.449 -7.322 1.00 0.00 C ATOM 971 C VAL A 483 -6.214 5.412 -7.540 1.00 0.00 C ATOM 972 O VAL A 483 -6.885 4.461 -7.139 1.00 0.00 O ATOM 973 CB VAL A 483 -4.353 6.670 -6.452 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.142 6.645 -5.152 1.00 0.00 C ATOM 975 CG2 VAL A 483 -2.858 6.714 -6.177 1.00 0.00 C ATOM 0 H VAL A 483 -3.326 6.246 -8.686 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.393 4.542 -6.805 1.00 0.00 H new ATOM 0 HB VAL A 483 -4.626 7.574 -6.997 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -4.880 7.515 -4.551 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.209 6.665 -5.374 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -4.903 5.737 -4.599 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -2.627 7.583 -5.561 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -2.558 5.807 -5.652 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.316 6.784 -7.120 1.00 0.00 H new ATOM 985 N GLN A 484 -6.740 6.452 -8.178 1.00 0.00 N ATOM 986 CA GLN A 484 -8.170 6.539 -8.449 1.00 0.00 C ATOM 987 C GLN A 484 -8.724 5.186 -8.883 1.00 0.00 C ATOM 988 O GLN A 484 -9.739 4.723 -8.362 1.00 0.00 O ATOM 989 CB GLN A 484 -8.443 7.586 -9.530 1.00 0.00 C ATOM 990 CG GLN A 484 -9.898 8.019 -9.603 1.00 0.00 C ATOM 991 CD GLN A 484 -10.455 8.425 -8.252 1.00 0.00 C ATOM 992 OE1 GLN A 484 -10.015 9.410 -7.657 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.427 7.667 -7.760 1.00 0.00 N ATOM 0 H GLN A 484 -6.197 7.246 -8.517 1.00 0.00 H new ATOM 0 HA GLN A 484 -8.672 6.839 -7.529 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -7.821 8.461 -9.342 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -8.143 7.184 -10.498 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -9.990 8.855 -10.296 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.496 7.203 -10.008 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -11.761 6.860 -8.287 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -11.840 7.891 -6.855 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.051 4.556 -9.840 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.476 3.255 -10.343 1.00 0.00 C ATOM 1004 C ALA A 485 -8.709 2.274 -9.200 1.00 0.00 C ATOM 1005 O ALA A 485 -9.728 1.583 -9.158 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.443 2.702 -11.314 1.00 0.00 C ATOM 0 H ALA A 485 -7.209 4.925 -10.283 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.420 3.388 -10.871 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -7.773 1.730 -11.682 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.329 3.388 -12.153 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.486 2.591 -10.803 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.759 2.216 -8.273 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.860 1.318 -7.128 1.00 0.00 C ATOM 1014 C LEU A 486 -9.191 1.504 -6.406 1.00 0.00 C ATOM 1015 O LEU A 486 -9.971 0.561 -6.270 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.702 1.563 -6.158 1.00 0.00 C ATOM 1017 CG LEU A 486 -6.451 0.467 -5.122 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.742 -0.718 -5.760 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -5.640 1.012 -3.956 1.00 0.00 C ATOM 0 H LEU A 486 -6.910 2.781 -8.292 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.807 0.293 -7.496 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.790 1.701 -6.739 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -6.888 2.498 -5.630 1.00 0.00 H new ATOM 0 HG LEU A 486 -7.414 0.126 -4.741 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.572 -1.488 -5.008 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.360 -1.124 -6.561 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -4.786 -0.393 -6.169 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -5.471 0.218 -3.228 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.681 1.381 -4.321 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -6.186 1.828 -3.483 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.444 2.725 -5.948 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.682 3.035 -5.244 1.00 0.00 C ATOM 1033 C ILE A 487 -11.887 2.435 -5.960 1.00 0.00 C ATOM 1034 O ILE A 487 -12.758 1.832 -5.332 1.00 0.00 O ATOM 1035 CB ILE A 487 -10.886 4.555 -5.106 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.726 5.179 -4.326 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -12.212 4.852 -4.422 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.703 6.690 -4.384 1.00 0.00 C ATOM 0 H ILE A 487 -8.808 3.516 -6.052 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.597 2.596 -4.250 1.00 0.00 H new ATOM 0 HB ILE A 487 -10.907 4.996 -6.103 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.788 4.864 -3.284 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.785 4.794 -4.720 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -12.341 5.931 -4.332 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -13.028 4.437 -5.014 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -12.218 4.402 -3.429 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -8.855 7.063 -3.810 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -9.609 7.013 -5.421 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -10.628 7.084 -3.963 1.00 0.00 H new ATOM 1050 N ASP A 488 -11.929 2.602 -7.277 1.00 0.00 N ATOM 1051 CA ASP A 488 -13.026 2.073 -8.080 1.00 0.00 C ATOM 1052 C ASP A 488 -13.244 0.591 -7.794 1.00 0.00 C ATOM 1053 O ASP A 488 -14.365 0.159 -7.529 1.00 0.00 O ATOM 1054 CB ASP A 488 -12.743 2.282 -9.569 1.00 0.00 C ATOM 1055 CG ASP A 488 -13.878 1.796 -10.448 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -14.903 2.505 -10.539 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -13.743 0.708 -11.045 1.00 0.00 O ATOM 0 H ASP A 488 -11.217 3.099 -7.811 1.00 0.00 H new ATOM 0 HA ASP A 488 -13.934 2.613 -7.811 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -12.569 3.341 -9.758 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -11.827 1.756 -9.839 1.00 0.00 H new ATOM 1062 N ALA A 489 -12.165 -0.183 -7.851 1.00 0.00 N ATOM 1063 CA ALA A 489 -12.239 -1.616 -7.596 1.00 0.00 C ATOM 1064 C ALA A 489 -12.557 -1.898 -6.132 1.00 0.00 C ATOM 1065 O ALA A 489 -13.391 -2.750 -5.821 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.934 -2.290 -7.995 1.00 0.00 C ATOM 0 H ALA A 489 -11.230 0.159 -8.072 1.00 0.00 H new ATOM 0 HA ALA A 489 -13.048 -2.027 -8.201 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -11.003 -3.360 -7.799 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.750 -2.126 -9.057 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -10.114 -1.867 -7.415 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.887 -1.181 -5.237 1.00 0.00 N ATOM 1073 CA CYS A 490 -12.098 -1.356 -3.805 1.00 0.00 C ATOM 1074 C CYS A 490 -13.586 -1.352 -3.469 1.00 0.00 C ATOM 1075 O CYS A 490 -14.291 -0.378 -3.738 1.00 0.00 O ATOM 1076 CB CYS A 490 -11.384 -0.251 -3.024 1.00 0.00 C ATOM 1077 SG CYS A 490 -9.601 -0.177 -3.313 1.00 0.00 S ATOM 0 H CYS A 490 -11.193 -0.473 -5.478 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.682 -2.322 -3.518 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -11.825 0.710 -3.290 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -11.563 -0.400 -1.959 1.00 0.00 H new ATOM 0 HG CYS A 490 -9.372 -0.058 -4.587 1.00 0.00 H new ATOM 1083 N LEU A 491 -14.058 -2.446 -2.883 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.463 -2.571 -2.512 1.00 0.00 C ATOM 1085 C LEU A 491 -15.873 -1.460 -1.550 1.00 0.00 C ATOM 1086 O LEU A 491 -15.025 -0.822 -0.927 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.724 -3.936 -1.874 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.375 -5.154 -2.729 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.311 -6.408 -1.871 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -16.387 -5.326 -3.852 1.00 0.00 C ATOM 0 H LEU A 491 -13.488 -3.260 -2.654 1.00 0.00 H new ATOM 0 HA LEU A 491 -16.062 -2.481 -3.418 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -15.157 -3.995 -0.945 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.779 -3.994 -1.608 1.00 0.00 H new ATOM 0 HG LEU A 491 -14.393 -4.992 -3.174 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -15.061 -7.265 -2.497 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -14.547 -6.285 -1.103 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -16.278 -6.574 -1.397 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -16.122 -6.198 -4.450 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -17.381 -5.465 -3.428 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -16.384 -4.438 -4.484 1.00 0.00 H new ATOM 1102 N GLU A 492 -17.178 -1.237 -1.433 1.00 0.00 N ATOM 1103 CA GLU A 492 -17.699 -0.204 -0.545 1.00 0.00 C ATOM 1104 C GLU A 492 -18.515 -0.821 0.587 1.00 0.00 C ATOM 1105 O GLU A 492 -19.496 -1.524 0.346 1.00 0.00 O ATOM 1106 CB GLU A 492 -18.562 0.786 -1.330 1.00 0.00 C ATOM 1107 CG GLU A 492 -18.816 2.090 -0.591 1.00 0.00 C ATOM 1108 CD GLU A 492 -20.085 2.782 -1.050 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -20.099 3.302 -2.185 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -21.063 2.804 -0.274 1.00 0.00 O ATOM 0 H GLU A 492 -17.893 -1.757 -1.941 1.00 0.00 H new ATOM 0 HA GLU A 492 -16.852 0.328 -0.111 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -18.075 1.005 -2.280 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -19.518 0.317 -1.562 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -18.882 1.890 0.479 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -17.968 2.759 -0.739 1.00 0.00 H new ATOM 1117 N GLU A 493 -18.102 -0.553 1.822 1.00 0.00 N ATOM 1118 CA GLU A 493 -18.794 -1.083 2.990 1.00 0.00 C ATOM 1119 C GLU A 493 -18.996 0.004 4.042 1.00 0.00 C ATOM 1120 O GLU A 493 -18.098 0.292 4.834 1.00 0.00 O ATOM 1121 CB GLU A 493 -18.007 -2.249 3.591 1.00 0.00 C ATOM 1122 CG GLU A 493 -18.875 -3.253 4.330 1.00 0.00 C ATOM 1123 CD GLU A 493 -20.155 -3.578 3.585 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -21.132 -2.812 3.722 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -20.180 -4.598 2.864 1.00 0.00 O ATOM 0 H GLU A 493 -17.292 0.028 2.039 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.772 -1.441 2.669 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -17.470 -2.763 2.794 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -17.258 -1.855 4.277 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -18.308 -4.171 4.488 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -19.123 -2.858 5.315 1.00 0.00 H new ATOM 1132 N ASP A 494 -20.181 0.605 4.044 1.00 0.00 N ATOM 1133 CA ASP A 494 -20.503 1.660 4.998 1.00 0.00 C ATOM 1134 C ASP A 494 -19.620 2.883 4.773 1.00 0.00 C ATOM 1135 O ASP A 494 -19.159 3.512 5.724 1.00 0.00 O ATOM 1136 CB ASP A 494 -20.334 1.150 6.430 1.00 0.00 C ATOM 1137 CG ASP A 494 -21.239 1.870 7.410 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -22.444 1.543 7.456 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -20.743 2.759 8.133 1.00 0.00 O ATOM 0 H ASP A 494 -20.935 0.379 3.395 1.00 0.00 H new ATOM 0 HA ASP A 494 -21.542 1.951 4.844 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -20.548 0.082 6.460 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -19.296 1.276 6.738 1.00 0.00 H new ATOM 1144 N GLY A 495 -19.387 3.215 3.506 1.00 0.00 N ATOM 1145 CA GLY A 495 -18.559 4.361 3.179 1.00 0.00 C ATOM 1146 C GLY A 495 -17.096 3.995 3.031 1.00 0.00 C ATOM 1147 O GLY A 495 -16.402 4.520 2.160 1.00 0.00 O ATOM 0 H GLY A 495 -19.757 2.710 2.701 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -18.914 4.809 2.251 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -18.665 5.116 3.958 1.00 0.00 H new ATOM 1151 N LYS A 496 -16.623 3.094 3.885 1.00 0.00 N ATOM 1152 CA LYS A 496 -15.233 2.658 3.847 1.00 0.00 C ATOM 1153 C LYS A 496 -14.947 1.859 2.580 1.00 0.00 C ATOM 1154 O LYS A 496 -15.867 1.468 1.860 1.00 0.00 O ATOM 1155 CB LYS A 496 -14.908 1.812 5.080 1.00 0.00 C ATOM 1156 CG LYS A 496 -14.469 2.631 6.282 1.00 0.00 C ATOM 1157 CD LYS A 496 -14.850 1.954 7.588 1.00 0.00 C ATOM 1158 CE LYS A 496 -16.318 2.169 7.920 1.00 0.00 C ATOM 1159 NZ LYS A 496 -16.623 1.822 9.336 1.00 0.00 N ATOM 0 H LYS A 496 -17.183 2.651 4.613 1.00 0.00 H new ATOM 0 HA LYS A 496 -14.601 3.546 3.846 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -15.787 1.227 5.351 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -14.120 1.103 4.826 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -13.389 2.778 6.249 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -14.926 3.619 6.237 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -14.644 0.886 7.519 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -14.232 2.346 8.396 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -16.583 3.210 7.736 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -16.933 1.561 7.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -17.633 1.982 9.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -16.394 0.822 9.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -16.055 2.419 9.970 1.00 0.00 H new ATOM 1173 N LEU A 497 -13.668 1.618 2.313 1.00 0.00 N ATOM 1174 CA LEU A 497 -13.262 0.863 1.133 1.00 0.00 C ATOM 1175 C LEU A 497 -12.471 -0.380 1.527 1.00 0.00 C ATOM 1176 O LEU A 497 -11.846 -0.421 2.587 1.00 0.00 O ATOM 1177 CB LEU A 497 -12.421 1.743 0.205 1.00 0.00 C ATOM 1178 CG LEU A 497 -13.147 2.926 -0.437 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -12.162 3.816 -1.180 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -14.238 2.435 -1.377 1.00 0.00 C ATOM 0 H LEU A 497 -12.895 1.935 2.898 1.00 0.00 H new ATOM 0 HA LEU A 497 -14.163 0.546 0.607 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -11.573 2.127 0.771 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -12.016 1.116 -0.590 1.00 0.00 H new ATOM 0 HG LEU A 497 -13.613 3.514 0.353 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -12.696 4.653 -1.631 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -11.416 4.195 -0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -11.667 3.238 -1.961 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -14.744 3.290 -1.825 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -13.794 1.824 -2.163 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -14.959 1.839 -0.818 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.503 -1.392 0.667 1.00 0.00 N ATOM 1193 CA TYR A 498 -11.789 -2.637 0.925 1.00 0.00 C ATOM 1194 C TYR A 498 -11.447 -3.349 -0.380 1.00 0.00 C ATOM 1195 O TYR A 498 -12.274 -3.438 -1.288 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.629 -3.555 1.815 1.00 0.00 C ATOM 1197 CG TYR A 498 -12.855 -3.008 3.206 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -13.944 -2.190 3.484 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -11.980 -3.308 4.243 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -14.154 -1.687 4.753 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -12.183 -2.811 5.516 1.00 0.00 C ATOM 1202 CZ TYR A 498 -13.271 -2.001 5.766 1.00 0.00 C ATOM 1203 OH TYR A 498 -13.477 -1.503 7.032 1.00 0.00 O ATOM 0 H TYR A 498 -13.016 -1.375 -0.215 1.00 0.00 H new ATOM 0 HA TYR A 498 -10.859 -2.394 1.439 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.595 -3.724 1.339 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -12.136 -4.524 1.890 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -14.638 -1.944 2.694 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -11.126 -3.941 4.050 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -15.004 -1.052 4.951 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -11.494 -3.055 6.311 1.00 0.00 H new ATOM 0 HH TYR A 498 -12.766 -1.819 7.628 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.222 -3.856 -0.465 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.768 -4.563 -1.658 1.00 0.00 C ATOM 1215 C LEU A 499 -9.372 -5.997 -1.324 1.00 0.00 C ATOM 1216 O LEU A 499 -8.733 -6.253 -0.303 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.583 -3.828 -2.290 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.256 -4.202 -3.736 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.331 -3.683 -4.678 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -6.890 -3.659 -4.131 1.00 0.00 C ATOM 0 H LEU A 499 -9.526 -3.791 0.277 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.593 -4.591 -2.370 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.781 -2.757 -2.249 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.699 -4.012 -1.679 1.00 0.00 H new ATOM 0 HG LEU A 499 -8.229 -5.289 -3.813 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -9.081 -3.959 -5.702 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.293 -4.120 -4.409 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.391 -2.598 -4.599 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.674 -3.935 -5.163 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -6.889 -2.573 -4.038 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -6.128 -4.080 -3.476 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.753 -6.928 -2.192 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.436 -8.337 -1.990 1.00 0.00 C ATOM 1234 C CYS A 500 -8.101 -8.693 -2.635 1.00 0.00 C ATOM 1235 O CYS A 500 -7.861 -8.382 -3.802 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.545 -9.218 -2.566 1.00 0.00 C ATOM 1237 SG CYS A 500 -10.785 -9.032 -4.348 1.00 0.00 S ATOM 0 H CYS A 500 -10.282 -6.732 -3.042 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.359 -8.516 -0.918 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.316 -10.261 -2.348 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -11.481 -8.984 -2.058 1.00 0.00 H new ATOM 0 HG CYS A 500 -9.664 -8.675 -4.902 1.00 0.00 H new ATOM 1243 N VAL A 501 -7.233 -9.345 -1.867 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.921 -9.742 -2.364 1.00 0.00 C ATOM 1245 C VAL A 501 -5.577 -11.163 -1.931 1.00 0.00 C ATOM 1246 O VAL A 501 -5.366 -11.428 -0.748 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.820 -8.785 -1.869 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -5.031 -7.390 -2.437 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.788 -8.752 -0.348 1.00 0.00 C ATOM 0 H VAL A 501 -7.415 -9.609 -0.899 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.968 -9.698 -3.452 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.856 -9.153 -2.222 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -4.244 -6.728 -2.077 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -5.000 -7.432 -3.526 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -6.001 -7.009 -2.116 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -4.005 -8.071 -0.015 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.751 -8.409 0.029 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.585 -9.753 0.033 1.00 0.00 H new ATOM 1259 N SER A 502 -5.521 -12.073 -2.898 1.00 0.00 N ATOM 1260 CA SER A 502 -5.205 -13.468 -2.616 1.00 0.00 C ATOM 1261 C SER A 502 -3.723 -13.748 -2.849 1.00 0.00 C ATOM 1262 O SER A 502 -3.141 -13.290 -3.831 1.00 0.00 O ATOM 1263 CB SER A 502 -6.053 -14.392 -3.493 1.00 0.00 C ATOM 1264 OG SER A 502 -6.306 -15.624 -2.840 1.00 0.00 O ATOM 0 H SER A 502 -5.690 -11.869 -3.883 1.00 0.00 H new ATOM 0 HA SER A 502 -5.433 -13.661 -1.568 1.00 0.00 H new ATOM 0 HB2 SER A 502 -6.997 -13.904 -3.734 1.00 0.00 H new ATOM 0 HB3 SER A 502 -5.539 -14.576 -4.437 1.00 0.00 H new ATOM 0 HG SER A 502 -6.851 -16.196 -3.420 1.00 0.00 H new ATOM 1270 N SER A 503 -3.120 -14.503 -1.936 1.00 0.00 N ATOM 1271 CA SER A 503 -1.705 -14.840 -2.038 1.00 0.00 C ATOM 1272 C SER A 503 -1.517 -16.345 -2.204 1.00 0.00 C ATOM 1273 O SER A 503 -2.360 -17.150 -1.807 1.00 0.00 O ATOM 1274 CB SER A 503 -0.952 -14.354 -0.798 1.00 0.00 C ATOM 1275 OG SER A 503 -1.134 -15.244 0.290 1.00 0.00 O ATOM 0 H SER A 503 -3.589 -14.893 -1.118 1.00 0.00 H new ATOM 0 HA SER A 503 -1.300 -14.341 -2.918 1.00 0.00 H new ATOM 0 HB2 SER A 503 0.110 -14.265 -1.025 1.00 0.00 H new ATOM 0 HB3 SER A 503 -1.303 -13.360 -0.522 1.00 0.00 H new ATOM 0 HG SER A 503 -0.283 -15.681 0.501 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.383 -16.736 -2.804 1.00 0.00 N ATOM 1282 CA PRO A 504 -0.055 -18.146 -3.037 1.00 0.00 C ATOM 1283 C PRO A 504 -0.338 -19.015 -1.816 1.00 0.00 C ATOM 1284 O PRO A 504 -0.480 -20.234 -1.928 1.00 0.00 O ATOM 1285 CB PRO A 504 1.445 -18.117 -3.337 1.00 0.00 C ATOM 1286 CG PRO A 504 1.690 -16.764 -3.912 1.00 0.00 C ATOM 1287 CD PRO A 504 0.667 -15.832 -3.302 1.00 0.00 C ATOM 0 HA PRO A 504 -0.655 -18.577 -3.839 1.00 0.00 H new ATOM 0 HB2 PRO A 504 2.033 -18.275 -2.433 1.00 0.00 H new ATOM 0 HB3 PRO A 504 1.724 -18.902 -4.040 1.00 0.00 H new ATOM 0 HG2 PRO A 504 2.702 -16.427 -3.687 1.00 0.00 H new ATOM 0 HG3 PRO A 504 1.595 -16.783 -4.998 1.00 0.00 H new ATOM 0 HD2 PRO A 504 1.098 -15.238 -2.496 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.275 -15.132 -4.039 1.00 0.00 H new ATOM 1295 N THR A 505 -0.418 -18.382 -0.650 1.00 0.00 N ATOM 1296 CA THR A 505 -0.682 -19.098 0.591 1.00 0.00 C ATOM 1297 C THR A 505 -2.064 -18.759 1.138 1.00 0.00 C ATOM 1298 O THR A 505 -2.901 -19.642 1.329 1.00 0.00 O ATOM 1299 CB THR A 505 0.375 -18.774 1.663 1.00 0.00 C ATOM 1300 OG1 THR A 505 0.583 -17.359 1.734 1.00 0.00 O ATOM 1301 CG2 THR A 505 1.691 -19.470 1.353 1.00 0.00 C ATOM 0 H THR A 505 -0.304 -17.374 -0.540 1.00 0.00 H new ATOM 0 HA THR A 505 -0.637 -20.162 0.357 1.00 0.00 H new ATOM 0 HB THR A 505 0.009 -19.136 2.624 1.00 0.00 H new ATOM 0 HG1 THR A 505 1.543 -17.167 1.693 1.00 0.00 H new ATOM 0 HG21 THR A 505 2.422 -19.226 2.124 1.00 0.00 H new ATOM 0 HG22 THR A 505 1.535 -20.549 1.329 1.00 0.00 H new ATOM 0 HG23 THR A 505 2.060 -19.135 0.384 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.298 -17.475 1.387 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.580 -17.019 1.910 1.00 0.00 C ATOM 1311 C ILE A 506 -4.600 -16.847 0.791 1.00 0.00 C ATOM 1312 O ILE A 506 -4.239 -16.615 -0.364 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.437 -15.687 2.670 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.421 -15.828 3.805 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -4.786 -15.239 3.212 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -2.856 -16.789 4.889 1.00 0.00 C ATOM 0 H ILE A 506 -1.616 -16.732 1.235 1.00 0.00 H new ATOM 0 HA ILE A 506 -3.929 -17.786 2.602 1.00 0.00 H new ATOM 0 HB ILE A 506 -3.075 -14.928 1.977 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -1.471 -16.166 3.391 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.245 -14.848 4.249 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.668 -14.296 3.747 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.483 -15.103 2.385 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.174 -15.996 3.893 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -2.088 -16.839 5.661 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -3.791 -16.442 5.330 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -3.004 -17.780 4.459 1.00 0.00 H new ATOM 1328 N LYS A 507 -5.878 -16.958 1.139 1.00 0.00 N ATOM 1329 CA LYS A 507 -6.953 -16.812 0.165 1.00 0.00 C ATOM 1330 C LYS A 507 -7.412 -15.360 0.077 1.00 0.00 C ATOM 1331 O LYS A 507 -6.980 -14.513 0.859 1.00 0.00 O ATOM 1332 CB LYS A 507 -8.134 -17.710 0.539 1.00 0.00 C ATOM 1333 CG LYS A 507 -8.059 -19.099 -0.070 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.248 -19.057 -1.577 1.00 0.00 C ATOM 1335 CE LYS A 507 -7.498 -20.188 -2.265 1.00 0.00 C ATOM 1336 NZ LYS A 507 -6.023 -20.009 -2.177 1.00 0.00 N ATOM 0 H LYS A 507 -6.194 -17.149 2.090 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.570 -17.114 -0.810 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.181 -17.800 1.624 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -9.059 -17.231 0.218 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -7.094 -19.549 0.164 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -8.824 -19.735 0.376 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -9.310 -19.126 -1.814 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -7.897 -18.099 -1.962 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -7.776 -21.138 -1.809 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -7.796 -20.237 -3.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -5.563 -20.537 -2.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -5.790 -18.999 -2.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -5.684 -20.366 -1.261 1.00 0.00 H new ATOM 1350 N ASP A 508 -8.291 -15.080 -0.879 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.811 -13.730 -1.068 1.00 0.00 C ATOM 1352 C ASP A 508 -8.948 -13.009 0.269 1.00 0.00 C ATOM 1353 O ASP A 508 -9.862 -13.286 1.046 1.00 0.00 O ATOM 1354 CB ASP A 508 -10.166 -13.778 -1.777 1.00 0.00 C ATOM 1355 CG ASP A 508 -10.147 -14.671 -3.002 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -9.067 -14.820 -3.610 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -11.213 -15.219 -3.353 1.00 0.00 O ATOM 0 H ASP A 508 -8.658 -15.769 -1.535 1.00 0.00 H new ATOM 0 HA ASP A 508 -8.104 -13.178 -1.688 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -10.924 -14.137 -1.081 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -10.455 -12.769 -2.071 1.00 0.00 H new ATOM 1362 N LYS A 509 -8.032 -12.083 0.532 1.00 0.00 N ATOM 1363 CA LYS A 509 -8.049 -11.320 1.775 1.00 0.00 C ATOM 1364 C LYS A 509 -8.443 -9.869 1.517 1.00 0.00 C ATOM 1365 O LYS A 509 -7.722 -9.111 0.868 1.00 0.00 O ATOM 1366 CB LYS A 509 -6.677 -11.376 2.450 1.00 0.00 C ATOM 1367 CG LYS A 509 -6.701 -10.961 3.911 1.00 0.00 C ATOM 1368 CD LYS A 509 -6.982 -12.144 4.822 1.00 0.00 C ATOM 1369 CE LYS A 509 -6.416 -11.921 6.216 1.00 0.00 C ATOM 1370 NZ LYS A 509 -7.128 -12.735 7.240 1.00 0.00 N ATOM 0 H LYS A 509 -7.268 -11.843 -0.099 1.00 0.00 H new ATOM 0 HA LYS A 509 -8.791 -11.767 2.437 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.286 -12.391 2.376 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -5.988 -10.728 1.908 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -5.744 -10.514 4.179 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -7.463 -10.196 4.061 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -8.058 -12.307 4.887 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -6.548 -13.047 4.392 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -5.356 -12.175 6.223 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -6.492 -10.865 6.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -6.713 -12.555 8.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -8.135 -12.475 7.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -7.034 -13.744 7.008 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.613 -9.471 2.039 1.00 0.00 N ATOM 1385 CA PRO A 510 -10.127 -8.107 1.880 1.00 0.00 C ATOM 1386 C PRO A 510 -9.431 -7.114 2.805 1.00 0.00 C ATOM 1387 O PRO A 510 -9.831 -6.936 3.955 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.605 -8.240 2.254 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.655 -9.391 3.199 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.523 -10.321 2.825 1.00 0.00 C ATOM 0 HA PRO A 510 -9.960 -7.723 0.874 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.979 -7.328 2.720 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -12.221 -8.424 1.374 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -11.549 -9.049 4.229 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.614 -9.904 3.131 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -10.029 -10.725 3.709 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -10.879 -11.171 2.243 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.387 -6.468 2.294 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.637 -5.491 3.073 1.00 0.00 C ATOM 1400 C VAL A 511 -8.357 -4.148 3.112 1.00 0.00 C ATOM 1401 O VAL A 511 -9.234 -3.880 2.291 1.00 0.00 O ATOM 1402 CB VAL A 511 -6.221 -5.286 2.502 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.372 -6.528 2.719 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -6.290 -4.928 1.025 1.00 0.00 C ATOM 0 H VAL A 511 -8.042 -6.604 1.344 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.559 -5.887 4.086 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.751 -4.458 3.032 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.376 -6.364 2.309 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -5.296 -6.735 3.787 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -5.835 -7.378 2.217 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -5.281 -4.787 0.637 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.779 -5.734 0.478 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.859 -4.007 0.900 1.00 0.00 H new ATOM 1414 N GLN A 512 -7.981 -3.308 4.071 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.592 -1.993 4.216 1.00 0.00 C ATOM 1416 C GLN A 512 -7.730 -0.917 3.563 1.00 0.00 C ATOM 1417 O GLN A 512 -6.751 -0.453 4.147 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.802 -1.665 5.696 1.00 0.00 C ATOM 1419 CG GLN A 512 -9.804 -0.548 5.935 1.00 0.00 C ATOM 1420 CD GLN A 512 -10.070 -0.308 7.408 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -9.230 -0.602 8.259 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -11.245 0.228 7.718 1.00 0.00 N ATOM 0 H GLN A 512 -7.257 -3.515 4.759 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.559 -2.013 3.714 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -9.140 -2.562 6.214 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -7.845 -1.384 6.137 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -9.432 0.371 5.482 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -10.741 -0.793 5.436 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -11.912 0.456 6.981 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -11.480 0.411 8.693 1.00 0.00 H new ATOM 1431 N ILE A 513 -8.102 -0.526 2.348 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.363 0.496 1.617 1.00 0.00 C ATOM 1433 C ILE A 513 -7.771 1.896 2.063 1.00 0.00 C ATOM 1434 O ILE A 513 -8.947 2.258 2.008 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.582 0.369 0.097 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -7.188 -1.029 -0.382 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.785 1.433 -0.643 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -5.823 -1.470 0.097 1.00 0.00 C ATOM 0 H ILE A 513 -8.909 -0.901 1.850 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.307 0.341 1.839 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.640 0.521 -0.117 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -7.934 -1.746 -0.038 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.206 -1.049 -1.472 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -6.950 1.331 -1.716 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -7.109 2.422 -0.319 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.724 1.310 -0.425 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -5.610 -2.470 -0.281 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -5.067 -0.775 -0.269 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.806 -1.483 1.187 1.00 0.00 H new ATOM 1450 N ARG A 514 -6.793 2.679 2.504 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.050 4.040 2.959 1.00 0.00 C ATOM 1452 C ARG A 514 -6.090 5.025 2.299 1.00 0.00 C ATOM 1453 O ARG A 514 -5.001 5.301 2.803 1.00 0.00 O ATOM 1454 CB ARG A 514 -6.918 4.125 4.481 1.00 0.00 C ATOM 1455 CG ARG A 514 -6.899 5.549 5.012 1.00 0.00 C ATOM 1456 CD ARG A 514 -8.307 6.075 5.245 1.00 0.00 C ATOM 1457 NE ARG A 514 -8.795 5.758 6.585 1.00 0.00 N ATOM 1458 CZ ARG A 514 -10.072 5.840 6.941 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -10.985 6.226 6.060 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -10.438 5.534 8.179 1.00 0.00 N ATOM 0 H ARG A 514 -5.815 2.395 2.556 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.068 4.305 2.674 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -7.747 3.586 4.940 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -6.002 3.620 4.787 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -6.337 5.583 5.946 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -6.380 6.196 4.304 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -8.319 7.155 5.101 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -8.981 5.647 4.503 1.00 0.00 H new ATOM 0 HE ARG A 514 -8.118 5.457 7.286 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -10.707 6.461 5.107 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -11.965 6.288 6.335 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -9.738 5.235 8.859 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -11.419 5.597 8.451 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.501 5.568 1.143 1.00 0.00 N ATOM 1475 CA PRO A 515 -5.692 6.530 0.389 1.00 0.00 C ATOM 1476 C PRO A 515 -5.143 7.645 1.273 1.00 0.00 C ATOM 1477 O PRO A 515 -5.799 8.665 1.481 1.00 0.00 O ATOM 1478 CB PRO A 515 -6.679 7.098 -0.635 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.680 6.013 -0.837 1.00 0.00 C ATOM 1480 CD PRO A 515 -7.787 5.285 0.484 1.00 0.00 C ATOM 0 HA PRO A 515 -4.814 6.062 -0.057 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -7.151 8.009 -0.267 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -6.178 7.353 -1.569 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.645 6.424 -1.134 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -7.365 5.335 -1.630 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.628 5.648 1.074 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -7.937 4.215 0.341 1.00 0.00 H new ATOM 1488 N TRP A 516 -3.936 7.442 1.790 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.298 8.431 2.651 1.00 0.00 C ATOM 1490 C TRP A 516 -3.462 9.836 2.082 1.00 0.00 C ATOM 1491 O TRP A 516 -2.651 10.287 1.275 1.00 0.00 O ATOM 1492 CB TRP A 516 -1.813 8.107 2.822 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.165 8.862 3.943 1.00 0.00 C ATOM 1494 CD1 TRP A 516 -0.162 9.783 3.839 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -1.475 8.758 5.337 1.00 0.00 C ATOM 1496 NE1 TRP A 516 0.170 10.258 5.085 1.00 0.00 N ATOM 1497 CE2 TRP A 516 -0.621 9.646 6.020 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -2.391 8.004 6.074 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 -0.657 9.797 7.404 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -2.426 8.155 7.448 1.00 0.00 C ATOM 1501 CH2 TRP A 516 -1.564 9.046 8.101 1.00 0.00 C ATOM 0 H TRP A 516 -3.380 6.602 1.628 1.00 0.00 H new ATOM 0 HA TRP A 516 -3.785 8.395 3.625 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -1.700 7.038 3.001 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.290 8.332 1.892 1.00 0.00 H new ATOM 0 HD1 TRP A 516 0.302 10.092 2.914 1.00 0.00 H new ATOM 0 HE1 TRP A 516 0.889 10.954 5.281 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -3.060 7.315 5.580 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 0.007 10.482 7.909 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -3.130 7.576 8.028 1.00 0.00 H new ATOM 0 HH2 TRP A 516 -1.616 9.142 9.175 1.00 0.00 H new ATOM 1512 N ASN A 517 -4.517 10.523 2.508 1.00 0.00 N ATOM 1513 CA ASN A 517 -4.787 11.877 2.040 1.00 0.00 C ATOM 1514 C ASN A 517 -4.171 12.910 2.978 1.00 0.00 C ATOM 1515 O ASN A 517 -4.478 12.944 4.171 1.00 0.00 O ATOM 1516 CB ASN A 517 -6.296 12.109 1.927 1.00 0.00 C ATOM 1517 CG ASN A 517 -6.665 13.576 2.038 1.00 0.00 C ATOM 1518 OD1 ASN A 517 -6.796 14.272 1.031 1.00 0.00 O ATOM 1519 ND2 ASN A 517 -6.834 14.052 3.266 1.00 0.00 N ATOM 0 H ASN A 517 -5.199 10.164 3.176 1.00 0.00 H new ATOM 0 HA ASN A 517 -4.334 11.991 1.055 1.00 0.00 H new ATOM 0 HB2 ASN A 517 -6.650 11.719 0.973 1.00 0.00 H new ATOM 0 HB3 ASN A 517 -6.807 11.548 2.710 1.00 0.00 H new ATOM 0 HD21 ASN A 517 -7.083 15.032 3.403 1.00 0.00 H new ATOM 0 HD22 ASN A 517 -6.715 13.438 4.072 1.00 0.00 H new ATOM 1526 N LEU A 518 -3.301 13.752 2.432 1.00 0.00 N ATOM 1527 CA LEU A 518 -2.641 14.788 3.220 1.00 0.00 C ATOM 1528 C LEU A 518 -3.343 16.131 3.050 1.00 0.00 C ATOM 1529 O LEU A 518 -3.111 17.066 3.817 1.00 0.00 O ATOM 1530 CB LEU A 518 -1.173 14.912 2.809 1.00 0.00 C ATOM 1531 CG LEU A 518 -0.901 15.677 1.513 1.00 0.00 C ATOM 1532 CD1 LEU A 518 -0.752 17.164 1.792 1.00 0.00 C ATOM 1533 CD2 LEU A 518 0.343 15.134 0.824 1.00 0.00 C ATOM 0 H LEU A 518 -3.036 13.738 1.447 1.00 0.00 H new ATOM 0 HA LEU A 518 -2.695 14.501 4.270 1.00 0.00 H new ATOM 0 HB2 LEU A 518 -0.630 15.402 3.617 1.00 0.00 H new ATOM 0 HB3 LEU A 518 -0.758 13.909 2.709 1.00 0.00 H new ATOM 0 HG LEU A 518 -1.752 15.537 0.846 1.00 0.00 H new ATOM 0 HD11 LEU A 518 -0.559 17.692 0.858 1.00 0.00 H new ATOM 0 HD12 LEU A 518 -1.670 17.544 2.240 1.00 0.00 H new ATOM 0 HD13 LEU A 518 0.080 17.324 2.478 1.00 0.00 H new ATOM 0 HD21 LEU A 518 0.521 15.690 -0.096 1.00 0.00 H new ATOM 0 HD22 LEU A 518 1.202 15.243 1.486 1.00 0.00 H new ATOM 0 HD23 LEU A 518 0.198 14.080 0.588 1.00 0.00 H new ATOM 1545 N SER A 519 -4.205 16.220 2.042 1.00 0.00 N ATOM 1546 CA SER A 519 -4.940 17.449 1.770 1.00 0.00 C ATOM 1547 C SER A 519 -6.263 17.148 1.073 1.00 0.00 C ATOM 1548 O SER A 519 -6.291 16.516 0.017 1.00 0.00 O ATOM 1549 CB SER A 519 -4.099 18.392 0.908 1.00 0.00 C ATOM 1550 OG SER A 519 -3.279 19.223 1.712 1.00 0.00 O ATOM 0 H SER A 519 -4.411 15.455 1.400 1.00 0.00 H new ATOM 0 HA SER A 519 -5.153 17.933 2.723 1.00 0.00 H new ATOM 0 HB2 SER A 519 -3.477 17.810 0.228 1.00 0.00 H new ATOM 0 HB3 SER A 519 -4.754 19.008 0.292 1.00 0.00 H new ATOM 0 HG SER A 519 -2.750 19.815 1.137 1.00 0.00 H new ATOM 1556 N ASP A 520 -7.358 17.605 1.671 1.00 0.00 N ATOM 1557 CA ASP A 520 -8.685 17.387 1.108 1.00 0.00 C ATOM 1558 C ASP A 520 -9.019 18.455 0.072 1.00 0.00 C ATOM 1559 O ASP A 520 -10.144 18.951 0.017 1.00 0.00 O ATOM 1560 CB ASP A 520 -9.739 17.387 2.217 1.00 0.00 C ATOM 1561 CG ASP A 520 -9.598 18.573 3.150 1.00 0.00 C ATOM 1562 OD1 ASP A 520 -9.705 19.722 2.671 1.00 0.00 O ATOM 1563 OD2 ASP A 520 -9.380 18.353 4.359 1.00 0.00 O ATOM 0 H ASP A 520 -7.352 18.129 2.546 1.00 0.00 H new ATOM 0 HA ASP A 520 -8.688 16.415 0.614 1.00 0.00 H new ATOM 0 HB2 ASP A 520 -10.733 17.397 1.770 1.00 0.00 H new ATOM 0 HB3 ASP A 520 -9.657 16.465 2.792 1.00 0.00 H new ATOM 1568 N SER A 521 -8.032 18.806 -0.747 1.00 0.00 N ATOM 1569 CA SER A 521 -8.220 19.820 -1.779 1.00 0.00 C ATOM 1570 C SER A 521 -9.351 19.430 -2.725 1.00 0.00 C ATOM 1571 O SER A 521 -9.947 18.361 -2.589 1.00 0.00 O ATOM 1572 CB SER A 521 -6.925 20.019 -2.569 1.00 0.00 C ATOM 1573 OG SER A 521 -6.559 18.835 -3.255 1.00 0.00 O ATOM 0 H SER A 521 -7.095 18.404 -0.716 1.00 0.00 H new ATOM 0 HA SER A 521 -8.487 20.756 -1.289 1.00 0.00 H new ATOM 0 HB2 SER A 521 -7.053 20.832 -3.283 1.00 0.00 H new ATOM 0 HB3 SER A 521 -6.123 20.313 -1.891 1.00 0.00 H new ATOM 0 HG SER A 521 -5.729 18.989 -3.753 1.00 0.00 H new ATOM 1579 N ASP A 522 -9.641 20.304 -3.682 1.00 0.00 N ATOM 1580 CA ASP A 522 -10.700 20.052 -4.652 1.00 0.00 C ATOM 1581 C ASP A 522 -10.587 21.003 -5.840 1.00 0.00 C ATOM 1582 O ASP A 522 -10.455 22.215 -5.667 1.00 0.00 O ATOM 1583 CB ASP A 522 -12.072 20.200 -3.992 1.00 0.00 C ATOM 1584 CG ASP A 522 -13.122 19.316 -4.635 1.00 0.00 C ATOM 1585 OD1 ASP A 522 -13.610 19.673 -5.727 1.00 0.00 O ATOM 1586 OD2 ASP A 522 -13.457 18.267 -4.045 1.00 0.00 O ATOM 0 H ASP A 522 -9.158 21.193 -3.807 1.00 0.00 H new ATOM 0 HA ASP A 522 -10.590 19.031 -5.016 1.00 0.00 H new ATOM 0 HB2 ASP A 522 -11.991 19.952 -2.934 1.00 0.00 H new ATOM 0 HB3 ASP A 522 -12.391 21.241 -4.053 1.00 0.00 H new ATOM 1591 N PHE A 523 -10.639 20.446 -7.045 1.00 0.00 N ATOM 1592 CA PHE A 523 -10.540 21.245 -8.261 1.00 0.00 C ATOM 1593 C PHE A 523 -11.813 21.127 -9.094 1.00 0.00 C ATOM 1594 O PHE A 523 -12.445 20.071 -9.137 1.00 0.00 O ATOM 1595 CB PHE A 523 -9.332 20.803 -9.090 1.00 0.00 C ATOM 1596 CG PHE A 523 -8.065 21.525 -8.734 1.00 0.00 C ATOM 1597 CD1 PHE A 523 -7.303 21.121 -7.649 1.00 0.00 C ATOM 1598 CD2 PHE A 523 -7.634 22.608 -9.484 1.00 0.00 C ATOM 1599 CE1 PHE A 523 -6.137 21.785 -7.318 1.00 0.00 C ATOM 1600 CE2 PHE A 523 -6.468 23.275 -9.158 1.00 0.00 C ATOM 1601 CZ PHE A 523 -5.718 22.862 -8.074 1.00 0.00 C ATOM 0 H PHE A 523 -10.749 19.445 -7.206 1.00 0.00 H new ATOM 0 HA PHE A 523 -10.411 22.288 -7.971 1.00 0.00 H new ATOM 0 HB2 PHE A 523 -9.181 19.732 -8.955 1.00 0.00 H new ATOM 0 HB3 PHE A 523 -9.548 20.964 -10.146 1.00 0.00 H new ATOM 0 HD1 PHE A 523 -7.624 20.278 -7.055 1.00 0.00 H new ATOM 0 HD2 PHE A 523 -8.216 22.935 -10.333 1.00 0.00 H new ATOM 0 HE1 PHE A 523 -5.554 21.462 -6.468 1.00 0.00 H new ATOM 0 HE2 PHE A 523 -6.144 24.118 -9.750 1.00 0.00 H new ATOM 0 HZ PHE A 523 -4.806 23.380 -7.818 1.00 0.00 H new ATOM 1611 N VAL A 524 -12.185 22.219 -9.754 1.00 0.00 N ATOM 1612 CA VAL A 524 -13.382 22.239 -10.586 1.00 0.00 C ATOM 1613 C VAL A 524 -13.196 23.150 -11.795 1.00 0.00 C ATOM 1614 O VAL A 524 -12.644 24.244 -11.681 1.00 0.00 O ATOM 1615 CB VAL A 524 -14.613 22.709 -9.788 1.00 0.00 C ATOM 1616 CG1 VAL A 524 -14.421 24.138 -9.304 1.00 0.00 C ATOM 1617 CG2 VAL A 524 -15.873 22.588 -10.632 1.00 0.00 C ATOM 0 H VAL A 524 -11.674 23.102 -9.729 1.00 0.00 H new ATOM 0 HA VAL A 524 -13.548 21.217 -10.926 1.00 0.00 H new ATOM 0 HB VAL A 524 -14.725 22.067 -8.915 1.00 0.00 H new ATOM 0 HG11 VAL A 524 -15.300 24.453 -8.742 1.00 0.00 H new ATOM 0 HG12 VAL A 524 -13.542 24.189 -8.661 1.00 0.00 H new ATOM 0 HG13 VAL A 524 -14.283 24.797 -10.161 1.00 0.00 H new ATOM 0 HG21 VAL A 524 -16.733 22.924 -10.053 1.00 0.00 H new ATOM 0 HG22 VAL A 524 -15.773 23.205 -11.525 1.00 0.00 H new ATOM 0 HG23 VAL A 524 -16.017 21.548 -10.924 1.00 0.00 H new ATOM 1627 N MET A 525 -13.661 22.690 -12.952 1.00 0.00 N ATOM 1628 CA MET A 525 -13.547 23.465 -14.182 1.00 0.00 C ATOM 1629 C MET A 525 -14.919 23.700 -14.806 1.00 0.00 C ATOM 1630 O MET A 525 -15.660 22.754 -15.072 1.00 0.00 O ATOM 1631 CB MET A 525 -12.636 22.746 -15.180 1.00 0.00 C ATOM 1632 CG MET A 525 -11.931 23.686 -16.145 1.00 0.00 C ATOM 1633 SD MET A 525 -10.822 22.819 -17.272 1.00 0.00 S ATOM 1634 CE MET A 525 -11.997 22.103 -18.419 1.00 0.00 C ATOM 0 H MET A 525 -14.120 21.786 -13.063 1.00 0.00 H new ATOM 0 HA MET A 525 -13.110 24.432 -13.934 1.00 0.00 H new ATOM 0 HB2 MET A 525 -11.888 22.175 -14.630 1.00 0.00 H new ATOM 0 HB3 MET A 525 -13.228 22.030 -15.750 1.00 0.00 H new ATOM 0 HG2 MET A 525 -12.676 24.233 -16.723 1.00 0.00 H new ATOM 0 HG3 MET A 525 -11.363 24.424 -15.578 1.00 0.00 H new ATOM 0 HE1 MET A 525 -11.460 21.624 -19.238 1.00 0.00 H new ATOM 0 HE2 MET A 525 -12.606 21.362 -17.901 1.00 0.00 H new ATOM 0 HE3 MET A 525 -12.641 22.887 -18.817 1.00 0.00 H new ATOM 1644 N ASP A 526 -15.250 24.966 -15.036 1.00 0.00 N ATOM 1645 CA ASP A 526 -16.533 25.324 -15.629 1.00 0.00 C ATOM 1646 C ASP A 526 -16.399 25.525 -17.135 1.00 0.00 C ATOM 1647 O ASP A 526 -15.621 26.363 -17.593 1.00 0.00 O ATOM 1648 CB ASP A 526 -17.082 26.596 -14.979 1.00 0.00 C ATOM 1649 CG ASP A 526 -18.585 26.720 -15.128 1.00 0.00 C ATOM 1650 OD1 ASP A 526 -19.042 27.122 -16.219 1.00 0.00 O ATOM 1651 OD2 ASP A 526 -19.306 26.415 -14.155 1.00 0.00 O ATOM 0 H ASP A 526 -14.648 25.761 -14.821 1.00 0.00 H new ATOM 0 HA ASP A 526 -17.229 24.504 -15.451 1.00 0.00 H new ATOM 0 HB2 ASP A 526 -16.823 26.600 -13.920 1.00 0.00 H new ATOM 0 HB3 ASP A 526 -16.602 27.466 -15.428 1.00 0.00 H new ATOM 1656 N SER A 527 -17.160 24.750 -17.901 1.00 0.00 N ATOM 1657 CA SER A 527 -17.122 24.839 -19.356 1.00 0.00 C ATOM 1658 C SER A 527 -18.473 24.466 -19.958 1.00 0.00 C ATOM 1659 O SER A 527 -19.050 23.432 -19.625 1.00 0.00 O ATOM 1660 CB SER A 527 -16.031 23.924 -19.916 1.00 0.00 C ATOM 1661 OG SER A 527 -14.781 24.589 -19.959 1.00 0.00 O ATOM 0 H SER A 527 -17.811 24.053 -17.538 1.00 0.00 H new ATOM 0 HA SER A 527 -16.895 25.870 -19.627 1.00 0.00 H new ATOM 0 HB2 SER A 527 -15.950 23.030 -19.298 1.00 0.00 H new ATOM 0 HB3 SER A 527 -16.306 23.595 -20.918 1.00 0.00 H new ATOM 0 HG SER A 527 -14.751 25.274 -19.259 1.00 0.00 H new ATOM 1667 N GLY A 528 -18.973 25.318 -20.849 1.00 0.00 N ATOM 1668 CA GLY A 528 -20.252 25.062 -21.484 1.00 0.00 C ATOM 1669 C GLY A 528 -20.132 24.134 -22.677 1.00 0.00 C ATOM 1670 O GLY A 528 -19.136 23.430 -22.844 1.00 0.00 O ATOM 0 H GLY A 528 -18.514 26.181 -21.142 1.00 0.00 H new ATOM 0 HA2 GLY A 528 -20.935 24.625 -20.755 1.00 0.00 H new ATOM 0 HA3 GLY A 528 -20.690 26.007 -21.805 1.00 0.00 H new ATOM 1674 N PRO A 529 -21.166 24.125 -23.531 1.00 0.00 N ATOM 1675 CA PRO A 529 -21.196 23.280 -24.728 1.00 0.00 C ATOM 1676 C PRO A 529 -20.331 23.838 -25.853 1.00 0.00 C ATOM 1677 O PRO A 529 -20.417 25.019 -26.188 1.00 0.00 O ATOM 1678 CB PRO A 529 -22.672 23.290 -25.133 1.00 0.00 C ATOM 1679 CG PRO A 529 -23.196 24.588 -24.621 1.00 0.00 C ATOM 1680 CD PRO A 529 -22.386 24.938 -23.393 1.00 0.00 C ATOM 0 HA PRO A 529 -20.800 22.283 -24.533 1.00 0.00 H new ATOM 0 HB2 PRO A 529 -22.786 23.216 -26.214 1.00 0.00 H new ATOM 0 HB3 PRO A 529 -23.208 22.447 -24.697 1.00 0.00 H new ATOM 0 HG2 PRO A 529 -23.104 25.367 -25.378 1.00 0.00 H new ATOM 0 HG3 PRO A 529 -24.255 24.506 -24.374 1.00 0.00 H new ATOM 0 HD2 PRO A 529 -22.155 26.003 -23.357 1.00 0.00 H new ATOM 0 HD3 PRO A 529 -22.925 24.697 -22.477 1.00 0.00 H new ATOM 1688 N SER A 530 -19.498 22.980 -26.434 1.00 0.00 N ATOM 1689 CA SER A 530 -18.614 23.389 -27.520 1.00 0.00 C ATOM 1690 C SER A 530 -18.406 22.246 -28.509 1.00 0.00 C ATOM 1691 O SER A 530 -18.812 21.112 -28.259 1.00 0.00 O ATOM 1692 CB SER A 530 -17.265 23.848 -26.962 1.00 0.00 C ATOM 1693 OG SER A 530 -17.405 25.038 -26.205 1.00 0.00 O ATOM 0 H SER A 530 -19.417 21.998 -26.171 1.00 0.00 H new ATOM 0 HA SER A 530 -19.084 24.221 -28.045 1.00 0.00 H new ATOM 0 HB2 SER A 530 -16.841 23.063 -26.336 1.00 0.00 H new ATOM 0 HB3 SER A 530 -16.566 24.015 -27.782 1.00 0.00 H new ATOM 0 HG SER A 530 -16.530 25.310 -25.858 1.00 0.00 H new ATOM 1699 N SER A 531 -17.769 22.556 -29.635 1.00 0.00 N ATOM 1700 CA SER A 531 -17.509 21.557 -30.665 1.00 0.00 C ATOM 1701 C SER A 531 -16.024 21.506 -31.010 1.00 0.00 C ATOM 1702 O SER A 531 -15.462 22.471 -31.527 1.00 0.00 O ATOM 1703 CB SER A 531 -18.326 21.866 -31.921 1.00 0.00 C ATOM 1704 OG SER A 531 -18.070 23.179 -32.387 1.00 0.00 O ATOM 0 H SER A 531 -17.424 23.490 -29.856 1.00 0.00 H new ATOM 0 HA SER A 531 -17.807 20.583 -30.276 1.00 0.00 H new ATOM 0 HB2 SER A 531 -18.083 21.146 -32.702 1.00 0.00 H new ATOM 0 HB3 SER A 531 -19.388 21.755 -31.704 1.00 0.00 H new ATOM 0 HG SER A 531 -17.122 23.392 -32.260 1.00 0.00 H new ATOM 1710 N GLY A 532 -15.394 20.372 -30.719 1.00 0.00 N ATOM 1711 CA GLY A 532 -13.979 20.215 -31.005 1.00 0.00 C ATOM 1712 C GLY A 532 -13.573 20.882 -32.304 1.00 0.00 C ATOM 1713 O GLY A 532 -14.263 20.758 -33.316 1.00 0.00 O ATOM 0 H GLY A 532 -15.837 19.559 -30.291 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -13.397 20.637 -30.186 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -13.737 19.153 -31.054 1.00 0.00 H new TER 1717 GLY A 532