USER MOD reduce.3.24.130724 H: found=0, std=0, add=841, rem=0, adj=26 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 470 LYS NZ :NH3+ 149:sc= -0.488 (180deg=-1.54) USER MOD Set 1.2: A 472 TYR OH : rot 180:sc= -0.0624 USER MOD Single : A 420 SER OG : rot 35:sc= 0.166 USER MOD Single : A 421 SER OG : rot 180:sc= 0 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 THR OG1 : rot 180:sc= -0.0119 USER MOD Single : A 446 SER OG : rot 180:sc= 0 USER MOD Single : A 459 HIS : no HD1:sc= -0.0807 X(o=-0.081,f=0) USER MOD Single : A 460 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 463 SER OG : rot -151:sc= 0.436 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 478 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.0008) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot -70:sc= -0.97 USER MOD Single : A 484 GLN : amide:sc= -1.14 K(o=-1.1,f=-0.58) USER MOD Single : A 490 CYS SG : rot 141:sc= -1.77 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 TYR OH : rot 180:sc= 0 USER MOD Single : A 500 CYS SG : rot 180:sc= -0.0142 USER MOD Single : A 502 SER OG : rot 180:sc= 0 USER MOD Single : A 503 SER OG : rot -90:sc= -0.201 USER MOD Single : A 505 THR OG1 : rot 180:sc= -0.53 USER MOD Single : A 507 LYS NZ :NH3+ -143:sc= -1.9 (180deg=-3.31!) USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 512 GLN : amide:sc=-0.00054 X(o=-0.00054,f=-0.16) USER MOD Single : A 517 ASN : amide:sc= -0.161 K(o=-0.16,f=-5.2!) USER MOD Single : A 519 SER OG : rot 180:sc= 0 USER MOD Single : A 521 SER OG : rot 180:sc= 0.00141 USER MOD Single : A 525 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 527 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 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 419 -23.257 17.283 -7.615 1.00 0.00 N ATOM 2 CA GLY A 419 -22.648 18.445 -6.996 1.00 0.00 C ATOM 3 C GLY A 419 -21.158 18.270 -6.775 1.00 0.00 C ATOM 4 O GLY A 419 -20.345 18.885 -7.465 1.00 0.00 O ATOM 0 HA2 GLY A 419 -22.819 19.319 -7.624 1.00 0.00 H new ATOM 0 HA3 GLY A 419 -23.134 18.640 -6.040 1.00 0.00 H new ATOM 8 N SER A 420 -20.799 17.431 -5.809 1.00 0.00 N ATOM 9 CA SER A 420 -19.397 17.181 -5.496 1.00 0.00 C ATOM 10 C SER A 420 -19.161 15.702 -5.204 1.00 0.00 C ATOM 11 O SER A 420 -19.825 15.112 -4.352 1.00 0.00 O ATOM 12 CB SER A 420 -18.963 18.024 -4.295 1.00 0.00 C ATOM 13 OG SER A 420 -19.802 17.791 -3.178 1.00 0.00 O ATOM 0 H SER A 420 -21.459 16.913 -5.230 1.00 0.00 H new ATOM 0 HA SER A 420 -18.801 17.462 -6.364 1.00 0.00 H new ATOM 0 HB2 SER A 420 -17.931 17.787 -4.034 1.00 0.00 H new ATOM 0 HB3 SER A 420 -18.990 19.081 -4.560 1.00 0.00 H new ATOM 0 HG SER A 420 -20.081 16.852 -3.169 1.00 0.00 H new ATOM 19 N SER A 421 -18.211 15.109 -5.919 1.00 0.00 N ATOM 20 CA SER A 421 -17.888 13.698 -5.741 1.00 0.00 C ATOM 21 C SER A 421 -16.531 13.369 -6.356 1.00 0.00 C ATOM 22 O SER A 421 -16.021 14.110 -7.194 1.00 0.00 O ATOM 23 CB SER A 421 -18.972 12.822 -6.372 1.00 0.00 C ATOM 24 OG SER A 421 -19.047 11.561 -5.730 1.00 0.00 O ATOM 0 H SER A 421 -17.651 15.584 -6.627 1.00 0.00 H new ATOM 0 HA SER A 421 -17.842 13.493 -4.671 1.00 0.00 H new ATOM 0 HB2 SER A 421 -19.936 13.326 -6.304 1.00 0.00 H new ATOM 0 HB3 SER A 421 -18.759 12.682 -7.432 1.00 0.00 H new ATOM 0 HG SER A 421 -19.748 11.021 -6.151 1.00 0.00 H new ATOM 30 N GLY A 422 -15.951 12.250 -5.931 1.00 0.00 N ATOM 31 CA GLY A 422 -14.659 11.842 -6.448 1.00 0.00 C ATOM 32 C GLY A 422 -13.537 12.753 -5.992 1.00 0.00 C ATOM 33 O GLY A 422 -13.259 13.772 -6.624 1.00 0.00 O ATOM 0 H GLY A 422 -16.354 11.619 -5.238 1.00 0.00 H new ATOM 0 HA2 GLY A 422 -14.448 10.822 -6.126 1.00 0.00 H new ATOM 0 HA3 GLY A 422 -14.694 11.832 -7.537 1.00 0.00 H new ATOM 37 N SER A 423 -12.891 12.388 -4.889 1.00 0.00 N ATOM 38 CA SER A 423 -11.797 13.183 -4.344 1.00 0.00 C ATOM 39 C SER A 423 -10.470 12.440 -4.471 1.00 0.00 C ATOM 40 O SER A 423 -10.443 11.227 -4.679 1.00 0.00 O ATOM 41 CB SER A 423 -12.066 13.523 -2.877 1.00 0.00 C ATOM 42 OG SER A 423 -13.328 14.147 -2.721 1.00 0.00 O ATOM 0 H SER A 423 -13.107 11.546 -4.355 1.00 0.00 H new ATOM 0 HA SER A 423 -11.732 14.108 -4.917 1.00 0.00 H new ATOM 0 HB2 SER A 423 -12.030 12.614 -2.277 1.00 0.00 H new ATOM 0 HB3 SER A 423 -11.282 14.182 -2.504 1.00 0.00 H new ATOM 0 HG SER A 423 -13.477 14.353 -1.774 1.00 0.00 H new ATOM 48 N SER A 424 -9.372 13.178 -4.345 1.00 0.00 N ATOM 49 CA SER A 424 -8.041 12.591 -4.449 1.00 0.00 C ATOM 50 C SER A 424 -7.062 13.295 -3.514 1.00 0.00 C ATOM 51 O SER A 424 -7.101 14.515 -3.361 1.00 0.00 O ATOM 52 CB SER A 424 -7.535 12.674 -5.891 1.00 0.00 C ATOM 53 OG SER A 424 -6.293 12.008 -6.035 1.00 0.00 O ATOM 0 H SER A 424 -9.378 14.183 -4.171 1.00 0.00 H new ATOM 0 HA SER A 424 -8.109 11.544 -4.155 1.00 0.00 H new ATOM 0 HB2 SER A 424 -8.269 12.230 -6.563 1.00 0.00 H new ATOM 0 HB3 SER A 424 -7.427 13.719 -6.182 1.00 0.00 H new ATOM 0 HG SER A 424 -5.992 12.074 -6.965 1.00 0.00 H new ATOM 59 N GLY A 425 -6.185 12.515 -2.890 1.00 0.00 N ATOM 60 CA GLY A 425 -5.208 13.080 -1.977 1.00 0.00 C ATOM 61 C GLY A 425 -3.782 12.797 -2.406 1.00 0.00 C ATOM 62 O GLY A 425 -3.397 13.091 -3.538 1.00 0.00 O ATOM 0 H GLY A 425 -6.133 11.502 -3.000 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -5.357 14.158 -1.911 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -5.371 12.674 -0.979 1.00 0.00 H new ATOM 66 N SER A 426 -2.995 12.225 -1.500 1.00 0.00 N ATOM 67 CA SER A 426 -1.602 11.907 -1.789 1.00 0.00 C ATOM 68 C SER A 426 -1.477 10.514 -2.397 1.00 0.00 C ATOM 69 O SER A 426 -2.165 9.580 -1.984 1.00 0.00 O ATOM 70 CB SER A 426 -0.762 11.996 -0.513 1.00 0.00 C ATOM 71 OG SER A 426 -0.261 13.308 -0.323 1.00 0.00 O ATOM 0 H SER A 426 -3.299 11.972 -0.560 1.00 0.00 H new ATOM 0 HA SER A 426 -1.232 12.634 -2.512 1.00 0.00 H new ATOM 0 HB2 SER A 426 -1.368 11.707 0.346 1.00 0.00 H new ATOM 0 HB3 SER A 426 0.068 11.291 -0.570 1.00 0.00 H new ATOM 0 HG SER A 426 0.271 13.339 0.500 1.00 0.00 H new ATOM 77 N ARG A 427 -0.594 10.382 -3.382 1.00 0.00 N ATOM 78 CA ARG A 427 -0.380 9.104 -4.049 1.00 0.00 C ATOM 79 C ARG A 427 -0.265 7.972 -3.032 1.00 0.00 C ATOM 80 O ARG A 427 -0.624 6.829 -3.315 1.00 0.00 O ATOM 81 CB ARG A 427 0.883 9.160 -4.910 1.00 0.00 C ATOM 82 CG ARG A 427 0.747 10.051 -6.134 1.00 0.00 C ATOM 83 CD ARG A 427 2.035 10.089 -6.942 1.00 0.00 C ATOM 84 NE ARG A 427 3.108 10.777 -6.230 1.00 0.00 N ATOM 85 CZ ARG A 427 3.911 10.181 -5.355 1.00 0.00 C ATOM 86 NH1 ARG A 427 3.762 8.891 -5.087 1.00 0.00 N ATOM 87 NH2 ARG A 427 4.865 10.874 -4.748 1.00 0.00 N ATOM 0 H ARG A 427 -0.016 11.144 -3.735 1.00 0.00 H new ATOM 0 HA ARG A 427 -1.240 8.908 -4.689 1.00 0.00 H new ATOM 0 HB2 ARG A 427 1.712 9.519 -4.300 1.00 0.00 H new ATOM 0 HB3 ARG A 427 1.138 8.150 -5.233 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -0.067 9.687 -6.761 1.00 0.00 H new ATOM 0 HG3 ARG A 427 0.482 11.061 -5.822 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.348 9.071 -7.173 1.00 0.00 H new ATOM 0 HD3 ARG A 427 1.852 10.590 -7.893 1.00 0.00 H new ATOM 0 HE ARG A 427 3.249 11.770 -6.414 1.00 0.00 H new ATOM 0 HH11 ARG A 427 3.030 8.355 -5.553 1.00 0.00 H new ATOM 0 HH12 ARG A 427 4.379 8.435 -4.415 1.00 0.00 H new ATOM 0 HH21 ARG A 427 4.983 11.866 -4.953 1.00 0.00 H new ATOM 0 HH22 ARG A 427 5.480 10.415 -4.077 1.00 0.00 H new ATOM 101 N LYS A 428 0.239 8.298 -1.846 1.00 0.00 N ATOM 102 CA LYS A 428 0.401 7.311 -0.786 1.00 0.00 C ATOM 103 C LYS A 428 -0.930 6.645 -0.454 1.00 0.00 C ATOM 104 O LYS A 428 -1.964 7.309 -0.369 1.00 0.00 O ATOM 105 CB LYS A 428 0.981 7.970 0.468 1.00 0.00 C ATOM 106 CG LYS A 428 1.631 6.987 1.427 1.00 0.00 C ATOM 107 CD LYS A 428 2.738 7.643 2.233 1.00 0.00 C ATOM 108 CE LYS A 428 3.367 6.667 3.216 1.00 0.00 C ATOM 109 NZ LYS A 428 4.510 5.930 2.611 1.00 0.00 N ATOM 0 H LYS A 428 0.542 9.239 -1.595 1.00 0.00 H new ATOM 0 HA LYS A 428 1.092 6.545 -1.139 1.00 0.00 H new ATOM 0 HB2 LYS A 428 1.719 8.714 0.169 1.00 0.00 H new ATOM 0 HB3 LYS A 428 0.185 8.502 0.990 1.00 0.00 H new ATOM 0 HG2 LYS A 428 0.877 6.585 2.103 1.00 0.00 H new ATOM 0 HG3 LYS A 428 2.038 6.145 0.866 1.00 0.00 H new ATOM 0 HD2 LYS A 428 3.504 8.025 1.558 1.00 0.00 H new ATOM 0 HD3 LYS A 428 2.336 8.499 2.775 1.00 0.00 H new ATOM 0 HE2 LYS A 428 3.710 7.209 4.097 1.00 0.00 H new ATOM 0 HE3 LYS A 428 2.614 5.955 3.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 4.911 5.275 3.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 4.178 5.392 1.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 5.241 6.607 2.312 1.00 0.00 H new ATOM 123 N VAL A 429 -0.899 5.330 -0.264 1.00 0.00 N ATOM 124 CA VAL A 429 -2.103 4.575 0.061 1.00 0.00 C ATOM 125 C VAL A 429 -1.868 3.655 1.254 1.00 0.00 C ATOM 126 O VAL A 429 -0.888 2.911 1.295 1.00 0.00 O ATOM 127 CB VAL A 429 -2.578 3.732 -1.137 1.00 0.00 C ATOM 128 CG1 VAL A 429 -3.874 3.009 -0.801 1.00 0.00 C ATOM 129 CG2 VAL A 429 -2.751 4.609 -2.369 1.00 0.00 C ATOM 0 H VAL A 429 -0.052 4.765 -0.330 1.00 0.00 H new ATOM 0 HA VAL A 429 -2.875 5.302 0.312 1.00 0.00 H new ATOM 0 HB VAL A 429 -1.818 2.982 -1.356 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.194 2.418 -1.659 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.713 2.351 0.053 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.645 3.739 -0.555 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.087 3.998 -3.207 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.491 5.382 -2.164 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -1.799 5.076 -2.620 1.00 0.00 H new ATOM 139 N PHE A 430 -2.775 3.710 2.224 1.00 0.00 N ATOM 140 CA PHE A 430 -2.668 2.881 3.419 1.00 0.00 C ATOM 141 C PHE A 430 -3.315 1.517 3.195 1.00 0.00 C ATOM 142 O PHE A 430 -4.388 1.417 2.601 1.00 0.00 O ATOM 143 CB PHE A 430 -3.325 3.581 4.611 1.00 0.00 C ATOM 144 CG PHE A 430 -3.560 2.672 5.784 1.00 0.00 C ATOM 145 CD1 PHE A 430 -2.498 2.213 6.545 1.00 0.00 C ATOM 146 CD2 PHE A 430 -4.844 2.278 6.124 1.00 0.00 C ATOM 147 CE1 PHE A 430 -2.712 1.376 7.625 1.00 0.00 C ATOM 148 CE2 PHE A 430 -5.065 1.442 7.203 1.00 0.00 C ATOM 149 CZ PHE A 430 -3.997 0.991 7.954 1.00 0.00 C ATOM 0 H PHE A 430 -3.592 4.320 2.206 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.610 2.730 3.633 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.695 4.413 4.926 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -4.278 4.005 4.293 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.491 2.512 6.292 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -5.682 2.628 5.539 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -1.875 1.024 8.210 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -6.071 1.142 7.458 1.00 0.00 H new ATOM 0 HZ PHE A 430 -4.167 0.338 8.797 1.00 0.00 H new ATOM 159 N VAL A 431 -2.654 0.469 3.676 1.00 0.00 N ATOM 160 CA VAL A 431 -3.163 -0.889 3.530 1.00 0.00 C ATOM 161 C VAL A 431 -3.053 -1.661 4.840 1.00 0.00 C ATOM 162 O VAL A 431 -1.968 -1.798 5.403 1.00 0.00 O ATOM 163 CB VAL A 431 -2.407 -1.657 2.429 1.00 0.00 C ATOM 164 CG1 VAL A 431 -3.125 -2.955 2.095 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.249 -0.790 1.189 1.00 0.00 C ATOM 0 H VAL A 431 -1.764 0.535 4.170 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.213 -0.805 3.248 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.413 -1.906 2.800 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.577 -3.484 1.315 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -3.181 -3.579 2.987 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.133 -2.733 1.743 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -1.713 -1.348 0.421 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -3.233 -0.509 0.813 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -1.688 0.109 1.443 1.00 0.00 H new ATOM 175 N GLY A 432 -4.186 -2.164 5.321 1.00 0.00 N ATOM 176 CA GLY A 432 -4.195 -2.918 6.562 1.00 0.00 C ATOM 177 C GLY A 432 -4.956 -4.223 6.442 1.00 0.00 C ATOM 178 O GLY A 432 -6.160 -4.227 6.192 1.00 0.00 O ATOM 0 H GLY A 432 -5.097 -2.063 4.874 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -3.169 -3.126 6.865 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.643 -2.311 7.349 1.00 0.00 H new ATOM 182 N GLY A 433 -4.250 -5.336 6.619 1.00 0.00 N ATOM 183 CA GLY A 433 -4.882 -6.639 6.524 1.00 0.00 C ATOM 184 C GLY A 433 -4.134 -7.580 5.601 1.00 0.00 C ATOM 185 O GLY A 433 -4.699 -8.557 5.108 1.00 0.00 O ATOM 0 H GLY A 433 -3.252 -5.358 6.826 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.944 -7.083 7.518 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.904 -6.518 6.164 1.00 0.00 H new ATOM 189 N LEU A 434 -2.860 -7.287 5.366 1.00 0.00 N ATOM 190 CA LEU A 434 -2.032 -8.114 4.494 1.00 0.00 C ATOM 191 C LEU A 434 -1.674 -9.432 5.174 1.00 0.00 C ATOM 192 O LEU A 434 -1.447 -9.493 6.383 1.00 0.00 O ATOM 193 CB LEU A 434 -0.757 -7.364 4.106 1.00 0.00 C ATOM 194 CG LEU A 434 -0.917 -6.270 3.050 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.289 -5.343 3.054 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.116 -6.884 1.672 1.00 0.00 C ATOM 0 H LEU A 434 -2.377 -6.483 5.767 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.604 -8.335 3.593 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.336 -6.914 5.005 1.00 0.00 H new ATOM 0 HB3 LEU A 434 -0.029 -8.089 3.742 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.802 -5.682 3.295 1.00 0.00 H new ATOM 0 HD11 LEU A 434 0.157 -4.571 2.296 1.00 0.00 H new ATOM 0 HD12 LEU A 434 0.386 -4.876 4.034 1.00 0.00 H new ATOM 0 HD13 LEU A 434 1.190 -5.917 2.835 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.228 -6.091 0.933 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.251 -7.497 1.418 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -2.012 -7.505 1.676 1.00 0.00 H new ATOM 208 N PRO A 435 -1.619 -10.512 4.381 1.00 0.00 N ATOM 209 CA PRO A 435 -1.286 -11.848 4.883 1.00 0.00 C ATOM 210 C PRO A 435 -0.074 -11.833 5.809 1.00 0.00 C ATOM 211 O PRO A 435 0.820 -10.996 5.687 1.00 0.00 O ATOM 212 CB PRO A 435 -0.977 -12.639 3.610 1.00 0.00 C ATOM 213 CG PRO A 435 -1.775 -11.970 2.545 1.00 0.00 C ATOM 214 CD PRO A 435 -1.879 -10.511 2.931 1.00 0.00 C ATOM 0 HA PRO A 435 -2.094 -12.273 5.479 1.00 0.00 H new ATOM 0 HB2 PRO A 435 0.088 -12.617 3.379 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -1.259 -13.687 3.717 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.293 -12.080 1.574 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -2.764 -12.420 2.463 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -1.151 -9.902 2.394 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -2.864 -10.106 2.702 1.00 0.00 H new ATOM 222 N PRO A 436 -0.042 -12.780 6.758 1.00 0.00 N ATOM 223 CA PRO A 436 1.056 -12.897 7.722 1.00 0.00 C ATOM 224 C PRO A 436 2.285 -13.573 7.123 1.00 0.00 C ATOM 225 O PRO A 436 3.308 -13.725 7.789 1.00 0.00 O ATOM 226 CB PRO A 436 0.460 -13.763 8.835 1.00 0.00 C ATOM 227 CG PRO A 436 -0.574 -14.594 8.156 1.00 0.00 C ATOM 228 CD PRO A 436 -1.074 -13.810 6.962 1.00 0.00 C ATOM 0 HA PRO A 436 1.405 -11.922 8.061 1.00 0.00 H new ATOM 0 HB2 PRO A 436 1.222 -14.385 9.304 1.00 0.00 H new ATOM 0 HB3 PRO A 436 0.021 -13.150 9.622 1.00 0.00 H new ATOM 0 HG2 PRO A 436 -0.152 -15.548 7.839 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -1.394 -14.819 8.838 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -1.183 -14.446 6.084 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -2.050 -13.365 7.156 1.00 0.00 H new ATOM 236 N ASP A 437 2.176 -13.975 5.861 1.00 0.00 N ATOM 237 CA ASP A 437 3.280 -14.633 5.171 1.00 0.00 C ATOM 238 C ASP A 437 3.473 -14.049 3.775 1.00 0.00 C ATOM 239 O ASP A 437 3.749 -14.776 2.820 1.00 0.00 O ATOM 240 CB ASP A 437 3.026 -16.138 5.077 1.00 0.00 C ATOM 241 CG ASP A 437 3.446 -16.876 6.333 1.00 0.00 C ATOM 242 OD1 ASP A 437 4.579 -16.647 6.804 1.00 0.00 O ATOM 243 OD2 ASP A 437 2.641 -17.682 6.845 1.00 0.00 O ATOM 0 H ASP A 437 1.335 -13.857 5.296 1.00 0.00 H new ATOM 0 HA ASP A 437 4.190 -14.461 5.746 1.00 0.00 H new ATOM 0 HB2 ASP A 437 1.966 -16.314 4.893 1.00 0.00 H new ATOM 0 HB3 ASP A 437 3.569 -16.542 4.223 1.00 0.00 H new ATOM 248 N ILE A 438 3.324 -12.733 3.664 1.00 0.00 N ATOM 249 CA ILE A 438 3.482 -12.053 2.385 1.00 0.00 C ATOM 250 C ILE A 438 4.729 -11.174 2.380 1.00 0.00 C ATOM 251 O ILE A 438 4.976 -10.425 3.325 1.00 0.00 O ATOM 252 CB ILE A 438 2.254 -11.184 2.054 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.387 -10.587 0.651 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.090 -10.082 3.090 1.00 0.00 C ATOM 255 CD1 ILE A 438 1.071 -10.135 0.059 1.00 0.00 C ATOM 0 H ILE A 438 3.094 -12.117 4.444 1.00 0.00 H new ATOM 0 HA ILE A 438 3.584 -12.828 1.626 1.00 0.00 H new ATOM 0 HB ILE A 438 1.365 -11.814 2.078 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.069 -9.738 0.690 1.00 0.00 H new ATOM 0 HG13 ILE A 438 2.837 -11.328 -0.009 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.218 -9.477 2.842 1.00 0.00 H new ATOM 0 HG22 ILE A 438 1.955 -10.527 4.076 1.00 0.00 H new ATOM 0 HG23 ILE A 438 2.980 -9.452 3.095 1.00 0.00 H new ATOM 0 HD11 ILE A 438 1.242 -9.723 -0.936 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.393 -10.985 -0.012 1.00 0.00 H new ATOM 0 HD13 ILE A 438 0.628 -9.370 0.697 1.00 0.00 H new ATOM 267 N ASP A 439 5.509 -11.271 1.309 1.00 0.00 N ATOM 268 CA ASP A 439 6.729 -10.483 1.179 1.00 0.00 C ATOM 269 C ASP A 439 6.452 -9.167 0.459 1.00 0.00 C ATOM 270 O ASP A 439 5.304 -8.845 0.154 1.00 0.00 O ATOM 271 CB ASP A 439 7.796 -11.276 0.424 1.00 0.00 C ATOM 272 CG ASP A 439 7.388 -11.584 -1.003 1.00 0.00 C ATOM 273 OD1 ASP A 439 6.590 -10.809 -1.573 1.00 0.00 O ATOM 274 OD2 ASP A 439 7.866 -12.599 -1.552 1.00 0.00 O ATOM 0 H ASP A 439 5.318 -11.887 0.519 1.00 0.00 H new ATOM 0 HA ASP A 439 7.095 -10.259 2.181 1.00 0.00 H new ATOM 0 HB2 ASP A 439 8.728 -10.711 0.418 1.00 0.00 H new ATOM 0 HB3 ASP A 439 7.992 -12.209 0.952 1.00 0.00 H new ATOM 279 N GLU A 440 7.511 -8.410 0.191 1.00 0.00 N ATOM 280 CA GLU A 440 7.381 -7.128 -0.491 1.00 0.00 C ATOM 281 C GLU A 440 6.819 -7.315 -1.898 1.00 0.00 C ATOM 282 O GLU A 440 5.708 -6.876 -2.198 1.00 0.00 O ATOM 283 CB GLU A 440 8.736 -6.421 -0.561 1.00 0.00 C ATOM 284 CG GLU A 440 8.675 -5.049 -1.212 1.00 0.00 C ATOM 285 CD GLU A 440 10.037 -4.393 -1.318 1.00 0.00 C ATOM 286 OE1 GLU A 440 10.932 -4.985 -1.958 1.00 0.00 O ATOM 287 OE2 GLU A 440 10.209 -3.288 -0.762 1.00 0.00 O ATOM 0 H GLU A 440 8.468 -8.662 0.436 1.00 0.00 H new ATOM 0 HA GLU A 440 6.687 -6.511 0.080 1.00 0.00 H new ATOM 0 HB2 GLU A 440 9.135 -6.317 0.448 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.434 -7.047 -1.117 1.00 0.00 H new ATOM 0 HG2 GLU A 440 8.242 -5.143 -2.208 1.00 0.00 H new ATOM 0 HG3 GLU A 440 8.010 -4.406 -0.635 1.00 0.00 H new ATOM 294 N ASP A 441 7.595 -7.968 -2.756 1.00 0.00 N ATOM 295 CA ASP A 441 7.176 -8.214 -4.131 1.00 0.00 C ATOM 296 C ASP A 441 5.685 -8.532 -4.196 1.00 0.00 C ATOM 297 O ASP A 441 4.903 -7.769 -4.763 1.00 0.00 O ATOM 298 CB ASP A 441 7.982 -9.365 -4.734 1.00 0.00 C ATOM 299 CG ASP A 441 8.392 -10.392 -3.696 1.00 0.00 C ATOM 300 OD1 ASP A 441 9.132 -10.025 -2.759 1.00 0.00 O ATOM 301 OD2 ASP A 441 7.971 -11.561 -3.820 1.00 0.00 O ATOM 0 H ASP A 441 8.517 -8.336 -2.524 1.00 0.00 H new ATOM 0 HA ASP A 441 7.362 -7.309 -4.709 1.00 0.00 H new ATOM 0 HB2 ASP A 441 7.390 -9.852 -5.509 1.00 0.00 H new ATOM 0 HB3 ASP A 441 8.874 -8.966 -5.218 1.00 0.00 H new ATOM 306 N GLU A 442 5.300 -9.663 -3.613 1.00 0.00 N ATOM 307 CA GLU A 442 3.904 -10.082 -3.608 1.00 0.00 C ATOM 308 C GLU A 442 2.975 -8.876 -3.500 1.00 0.00 C ATOM 309 O GLU A 442 2.111 -8.667 -4.353 1.00 0.00 O ATOM 310 CB GLU A 442 3.642 -11.046 -2.449 1.00 0.00 C ATOM 311 CG GLU A 442 4.231 -12.430 -2.664 1.00 0.00 C ATOM 312 CD GLU A 442 3.430 -13.519 -1.977 1.00 0.00 C ATOM 313 OE1 GLU A 442 2.541 -13.181 -1.168 1.00 0.00 O ATOM 314 OE2 GLU A 442 3.693 -14.709 -2.248 1.00 0.00 O ATOM 0 H GLU A 442 5.935 -10.305 -3.138 1.00 0.00 H new ATOM 0 HA GLU A 442 3.701 -10.593 -4.549 1.00 0.00 H new ATOM 0 HB2 GLU A 442 4.056 -10.622 -1.534 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.566 -11.137 -2.299 1.00 0.00 H new ATOM 0 HG2 GLU A 442 4.278 -12.638 -3.733 1.00 0.00 H new ATOM 0 HG3 GLU A 442 5.255 -12.447 -2.290 1.00 0.00 H new ATOM 321 N ILE A 443 3.158 -8.087 -2.447 1.00 0.00 N ATOM 322 CA ILE A 443 2.338 -6.903 -2.227 1.00 0.00 C ATOM 323 C ILE A 443 2.235 -6.063 -3.496 1.00 0.00 C ATOM 324 O ILE A 443 1.157 -5.583 -3.851 1.00 0.00 O ATOM 325 CB ILE A 443 2.902 -6.029 -1.092 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.885 -6.799 0.230 1.00 0.00 C ATOM 327 CG2 ILE A 443 2.105 -4.739 -0.969 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.772 -6.193 1.295 1.00 0.00 C ATOM 0 H ILE A 443 3.868 -8.247 -1.732 1.00 0.00 H new ATOM 0 HA ILE A 443 1.346 -7.255 -1.944 1.00 0.00 H new ATOM 0 HB ILE A 443 3.935 -5.773 -1.330 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.862 -6.842 0.603 1.00 0.00 H new ATOM 0 HG13 ILE A 443 3.201 -7.826 0.047 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.517 -4.133 -0.162 1.00 0.00 H new ATOM 0 HG22 ILE A 443 2.163 -4.185 -1.906 1.00 0.00 H new ATOM 0 HG23 ILE A 443 1.063 -4.974 -0.751 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.710 -6.791 2.204 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.803 -6.175 0.942 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.443 -5.176 1.507 1.00 0.00 H new ATOM 340 N THR A 444 3.362 -5.890 -4.178 1.00 0.00 N ATOM 341 CA THR A 444 3.400 -5.109 -5.408 1.00 0.00 C ATOM 342 C THR A 444 2.523 -5.737 -6.485 1.00 0.00 C ATOM 343 O THR A 444 1.615 -5.095 -7.012 1.00 0.00 O ATOM 344 CB THR A 444 4.837 -4.976 -5.946 1.00 0.00 C ATOM 345 OG1 THR A 444 5.743 -4.726 -4.865 1.00 0.00 O ATOM 346 CG2 THR A 444 4.932 -3.849 -6.964 1.00 0.00 C ATOM 0 H THR A 444 4.262 -6.281 -3.899 1.00 0.00 H new ATOM 0 HA THR A 444 3.018 -4.118 -5.164 1.00 0.00 H new ATOM 0 HB THR A 444 5.106 -5.911 -6.437 1.00 0.00 H new ATOM 0 HG1 THR A 444 6.655 -4.644 -5.215 1.00 0.00 H new ATOM 0 HG21 THR A 444 5.956 -3.774 -7.330 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.263 -4.056 -7.799 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.645 -2.909 -6.493 1.00 0.00 H new ATOM 354 N ALA A 445 2.800 -6.997 -6.807 1.00 0.00 N ATOM 355 CA ALA A 445 2.034 -7.712 -7.819 1.00 0.00 C ATOM 356 C ALA A 445 0.535 -7.552 -7.589 1.00 0.00 C ATOM 357 O ALA A 445 -0.236 -7.403 -8.537 1.00 0.00 O ATOM 358 CB ALA A 445 2.414 -9.186 -7.825 1.00 0.00 C ATOM 0 H ALA A 445 3.549 -7.543 -6.381 1.00 0.00 H new ATOM 0 HA ALA A 445 2.274 -7.282 -8.791 1.00 0.00 H new ATOM 0 HB1 ALA A 445 1.834 -9.708 -8.586 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.477 -9.287 -8.046 1.00 0.00 H new ATOM 0 HB3 ALA A 445 2.204 -9.620 -6.847 1.00 0.00 H new ATOM 364 N SER A 446 0.128 -7.584 -6.324 1.00 0.00 N ATOM 365 CA SER A 446 -1.280 -7.447 -5.970 1.00 0.00 C ATOM 366 C SER A 446 -1.818 -6.086 -6.401 1.00 0.00 C ATOM 367 O SER A 446 -3.010 -5.934 -6.671 1.00 0.00 O ATOM 368 CB SER A 446 -1.468 -7.628 -4.462 1.00 0.00 C ATOM 369 OG SER A 446 -1.418 -8.998 -4.103 1.00 0.00 O ATOM 0 H SER A 446 0.753 -7.704 -5.527 1.00 0.00 H new ATOM 0 HA SER A 446 -1.839 -8.222 -6.495 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.692 -7.080 -3.927 1.00 0.00 H new ATOM 0 HB3 SER A 446 -2.425 -7.204 -4.158 1.00 0.00 H new ATOM 0 HG SER A 446 -1.539 -9.087 -3.135 1.00 0.00 H new ATOM 375 N PHE A 447 -0.931 -5.099 -6.464 1.00 0.00 N ATOM 376 CA PHE A 447 -1.316 -3.750 -6.862 1.00 0.00 C ATOM 377 C PHE A 447 -0.528 -3.298 -8.088 1.00 0.00 C ATOM 378 O PHE A 447 -0.245 -2.112 -8.255 1.00 0.00 O ATOM 379 CB PHE A 447 -1.089 -2.771 -5.708 1.00 0.00 C ATOM 380 CG PHE A 447 -1.997 -3.008 -4.534 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.657 -3.926 -3.554 1.00 0.00 C ATOM 382 CD2 PHE A 447 -3.188 -2.312 -4.411 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.491 -4.146 -2.473 1.00 0.00 C ATOM 384 CE2 PHE A 447 -4.026 -2.528 -3.333 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.676 -3.446 -2.362 1.00 0.00 C ATOM 0 H PHE A 447 0.059 -5.208 -6.245 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.376 -3.762 -7.117 1.00 0.00 H new ATOM 0 HB2 PHE A 447 -0.053 -2.846 -5.377 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.235 -1.754 -6.071 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.731 -4.476 -3.635 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.465 -1.592 -5.166 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -2.216 -4.865 -1.716 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -4.953 -1.980 -3.250 1.00 0.00 H new ATOM 0 HZ PHE A 447 -4.328 -3.616 -1.518 1.00 0.00 H new ATOM 395 N ARG A 448 -0.176 -4.254 -8.943 1.00 0.00 N ATOM 396 CA ARG A 448 0.580 -3.956 -10.153 1.00 0.00 C ATOM 397 C ARG A 448 -0.355 -3.729 -11.337 1.00 0.00 C ATOM 398 O ARG A 448 -0.181 -2.783 -12.105 1.00 0.00 O ATOM 399 CB ARG A 448 1.551 -5.096 -10.466 1.00 0.00 C ATOM 400 CG ARG A 448 2.916 -4.929 -9.819 1.00 0.00 C ATOM 401 CD ARG A 448 3.769 -3.919 -10.570 1.00 0.00 C ATOM 402 NE ARG A 448 4.035 -4.340 -11.943 1.00 0.00 N ATOM 403 CZ ARG A 448 3.254 -4.030 -12.971 1.00 0.00 C ATOM 404 NH1 ARG A 448 2.163 -3.300 -12.783 1.00 0.00 N ATOM 405 NH2 ARG A 448 3.563 -4.451 -14.191 1.00 0.00 N ATOM 0 H ARG A 448 -0.403 -5.241 -8.819 1.00 0.00 H new ATOM 0 HA ARG A 448 1.147 -3.041 -9.981 1.00 0.00 H new ATOM 0 HB2 ARG A 448 1.113 -6.037 -10.132 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.677 -5.168 -11.546 1.00 0.00 H new ATOM 0 HG2 ARG A 448 2.793 -4.606 -8.785 1.00 0.00 H new ATOM 0 HG3 ARG A 448 3.428 -5.891 -9.793 1.00 0.00 H new ATOM 0 HD2 ARG A 448 3.264 -2.953 -10.579 1.00 0.00 H new ATOM 0 HD3 ARG A 448 4.714 -3.780 -10.044 1.00 0.00 H new ATOM 0 HE ARG A 448 4.866 -4.903 -12.122 1.00 0.00 H new ATOM 0 HH11 ARG A 448 1.922 -2.975 -11.847 1.00 0.00 H new ATOM 0 HH12 ARG A 448 1.565 -3.063 -13.575 1.00 0.00 H new ATOM 0 HH21 ARG A 448 4.401 -5.013 -14.339 1.00 0.00 H new ATOM 0 HH22 ARG A 448 2.962 -4.212 -14.980 1.00 0.00 H new ATOM 419 N ARG A 449 -1.345 -4.604 -11.478 1.00 0.00 N ATOM 420 CA ARG A 449 -2.307 -4.501 -12.569 1.00 0.00 C ATOM 421 C ARG A 449 -2.676 -3.044 -12.832 1.00 0.00 C ATOM 422 O ARG A 449 -2.694 -2.594 -13.978 1.00 0.00 O ATOM 423 CB ARG A 449 -3.566 -5.307 -12.246 1.00 0.00 C ATOM 424 CG ARG A 449 -4.327 -4.789 -11.036 1.00 0.00 C ATOM 425 CD ARG A 449 -5.240 -5.856 -10.453 1.00 0.00 C ATOM 426 NE ARG A 449 -4.549 -6.694 -9.477 1.00 0.00 N ATOM 427 CZ ARG A 449 -5.114 -7.729 -8.865 1.00 0.00 C ATOM 428 NH1 ARG A 449 -6.373 -8.052 -9.128 1.00 0.00 N ATOM 429 NH2 ARG A 449 -4.420 -8.444 -7.989 1.00 0.00 N ATOM 0 H ARG A 449 -1.502 -5.392 -10.850 1.00 0.00 H new ATOM 0 HA ARG A 449 -1.844 -4.909 -13.468 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -4.227 -5.295 -13.113 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -3.287 -6.346 -12.072 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -3.620 -4.458 -10.275 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -4.918 -3.919 -11.322 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -6.098 -5.379 -9.979 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -5.627 -6.481 -11.258 1.00 0.00 H new ATOM 0 HE ARG A 449 -3.579 -6.472 -9.253 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -6.910 -7.505 -9.801 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -6.805 -8.847 -8.657 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -3.451 -8.199 -7.784 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -4.855 -9.238 -7.520 1.00 0.00 H new ATOM 443 N PHE A 450 -2.970 -2.311 -11.763 1.00 0.00 N ATOM 444 CA PHE A 450 -3.341 -0.905 -11.878 1.00 0.00 C ATOM 445 C PHE A 450 -2.211 -0.095 -12.506 1.00 0.00 C ATOM 446 O PHE A 450 -2.445 0.763 -13.355 1.00 0.00 O ATOM 447 CB PHE A 450 -3.690 -0.334 -10.502 1.00 0.00 C ATOM 448 CG PHE A 450 -4.777 -1.093 -9.796 1.00 0.00 C ATOM 449 CD1 PHE A 450 -6.109 -0.770 -9.998 1.00 0.00 C ATOM 450 CD2 PHE A 450 -4.466 -2.130 -8.931 1.00 0.00 C ATOM 451 CE1 PHE A 450 -7.111 -1.467 -9.349 1.00 0.00 C ATOM 452 CE2 PHE A 450 -5.464 -2.831 -8.280 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.788 -2.499 -8.490 1.00 0.00 C ATOM 0 H PHE A 450 -2.959 -2.667 -10.807 1.00 0.00 H new ATOM 0 HA PHE A 450 -4.216 -0.837 -12.524 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.795 -0.334 -9.880 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -3.999 0.705 -10.616 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.367 0.035 -10.670 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -3.432 -2.394 -8.764 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -8.146 -1.205 -9.514 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -5.209 -3.637 -7.608 1.00 0.00 H new ATOM 0 HZ PHE A 450 -7.570 -3.046 -7.983 1.00 0.00 H new ATOM 463 N GLY A 451 -0.983 -0.373 -12.079 1.00 0.00 N ATOM 464 CA GLY A 451 0.166 0.338 -12.609 1.00 0.00 C ATOM 465 C GLY A 451 1.414 0.126 -11.775 1.00 0.00 C ATOM 466 O GLY A 451 1.426 -0.656 -10.825 1.00 0.00 O ATOM 0 H GLY A 451 -0.763 -1.078 -11.375 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.355 0.007 -13.630 1.00 0.00 H new ATOM 0 HA3 GLY A 451 -0.060 1.403 -12.656 1.00 0.00 H new ATOM 470 N PRO A 452 2.496 0.835 -12.132 1.00 0.00 N ATOM 471 CA PRO A 452 3.775 0.737 -11.423 1.00 0.00 C ATOM 472 C PRO A 452 3.763 1.490 -10.097 1.00 0.00 C ATOM 473 O PRO A 452 3.583 2.708 -10.065 1.00 0.00 O ATOM 474 CB PRO A 452 4.769 1.380 -12.393 1.00 0.00 C ATOM 475 CG PRO A 452 3.956 2.348 -13.182 1.00 0.00 C ATOM 476 CD PRO A 452 2.553 1.786 -13.254 1.00 0.00 C ATOM 0 HA PRO A 452 4.018 -0.293 -11.163 1.00 0.00 H new ATOM 0 HB2 PRO A 452 5.575 1.883 -11.858 1.00 0.00 H new ATOM 0 HB3 PRO A 452 5.232 0.633 -13.038 1.00 0.00 H new ATOM 0 HG2 PRO A 452 3.955 3.329 -12.707 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.372 2.478 -14.181 1.00 0.00 H new ATOM 0 HD2 PRO A 452 1.803 2.570 -13.152 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.369 1.291 -14.207 1.00 0.00 H new ATOM 484 N LEU A 453 3.955 0.758 -9.005 1.00 0.00 N ATOM 485 CA LEU A 453 3.966 1.357 -7.675 1.00 0.00 C ATOM 486 C LEU A 453 5.130 0.822 -6.846 1.00 0.00 C ATOM 487 O LEU A 453 5.875 -0.049 -7.294 1.00 0.00 O ATOM 488 CB LEU A 453 2.644 1.079 -6.957 1.00 0.00 C ATOM 489 CG LEU A 453 2.482 -0.322 -6.367 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.353 -0.346 -5.349 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.229 -1.340 -7.470 1.00 0.00 C ATOM 0 H LEU A 453 4.105 -0.251 -9.014 1.00 0.00 H new ATOM 0 HA LEU A 453 4.090 2.434 -7.790 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.531 1.806 -6.152 1.00 0.00 H new ATOM 0 HB3 LEU A 453 1.829 1.252 -7.660 1.00 0.00 H new ATOM 0 HG LEU A 453 3.408 -0.589 -5.858 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.253 -1.351 -4.940 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.575 0.353 -4.543 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.420 -0.057 -5.833 1.00 0.00 H new ATOM 0 HD21 LEU A 453 2.116 -2.331 -7.031 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.318 -1.075 -8.007 1.00 0.00 H new ATOM 0 HD23 LEU A 453 3.071 -1.343 -8.162 1.00 0.00 H new ATOM 503 N VAL A 454 5.278 1.349 -5.635 1.00 0.00 N ATOM 504 CA VAL A 454 6.349 0.923 -4.742 1.00 0.00 C ATOM 505 C VAL A 454 5.824 0.679 -3.331 1.00 0.00 C ATOM 506 O VAL A 454 5.069 1.487 -2.790 1.00 0.00 O ATOM 507 CB VAL A 454 7.481 1.966 -4.684 1.00 0.00 C ATOM 508 CG1 VAL A 454 6.954 3.297 -4.170 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.623 1.464 -3.814 1.00 0.00 C ATOM 0 H VAL A 454 4.670 2.072 -5.250 1.00 0.00 H new ATOM 0 HA VAL A 454 6.745 -0.009 -5.145 1.00 0.00 H new ATOM 0 HB VAL A 454 7.863 2.119 -5.693 1.00 0.00 H new ATOM 0 HG11 VAL A 454 7.768 4.022 -4.136 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.172 3.661 -4.837 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.544 3.164 -3.169 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.414 2.213 -3.784 1.00 0.00 H new ATOM 0 HG22 VAL A 454 8.258 1.282 -2.803 1.00 0.00 H new ATOM 0 HG23 VAL A 454 9.017 0.537 -4.230 1.00 0.00 H new ATOM 519 N VAL A 455 6.229 -0.440 -2.740 1.00 0.00 N ATOM 520 CA VAL A 455 5.802 -0.790 -1.391 1.00 0.00 C ATOM 521 C VAL A 455 6.769 -0.241 -0.348 1.00 0.00 C ATOM 522 O VAL A 455 7.982 -0.235 -0.554 1.00 0.00 O ATOM 523 CB VAL A 455 5.687 -2.316 -1.216 1.00 0.00 C ATOM 524 CG1 VAL A 455 4.930 -2.652 0.059 1.00 0.00 C ATOM 525 CG2 VAL A 455 5.012 -2.941 -2.428 1.00 0.00 C ATOM 0 H VAL A 455 6.853 -1.120 -3.175 1.00 0.00 H new ATOM 0 HA VAL A 455 4.820 -0.340 -1.244 1.00 0.00 H new ATOM 0 HB VAL A 455 6.691 -2.732 -1.133 1.00 0.00 H new ATOM 0 HG11 VAL A 455 4.859 -3.734 0.165 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.460 -2.237 0.917 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.928 -2.226 0.010 1.00 0.00 H new ATOM 0 HG21 VAL A 455 4.939 -4.019 -2.288 1.00 0.00 H new ATOM 0 HG22 VAL A 455 4.013 -2.522 -2.545 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.600 -2.730 -3.321 1.00 0.00 H new ATOM 535 N ASP A 456 6.223 0.218 0.773 1.00 0.00 N ATOM 536 CA ASP A 456 7.038 0.768 1.850 1.00 0.00 C ATOM 537 C ASP A 456 6.270 0.764 3.168 1.00 0.00 C ATOM 538 O ASP A 456 5.274 1.472 3.320 1.00 0.00 O ATOM 539 CB ASP A 456 7.481 2.192 1.508 1.00 0.00 C ATOM 540 CG ASP A 456 8.223 2.857 2.650 1.00 0.00 C ATOM 541 OD1 ASP A 456 7.558 3.320 3.600 1.00 0.00 O ATOM 542 OD2 ASP A 456 9.470 2.916 2.594 1.00 0.00 O ATOM 0 H ASP A 456 5.220 0.220 0.959 1.00 0.00 H new ATOM 0 HA ASP A 456 7.921 0.139 1.962 1.00 0.00 H new ATOM 0 HB2 ASP A 456 8.122 2.168 0.627 1.00 0.00 H new ATOM 0 HB3 ASP A 456 6.607 2.789 1.250 1.00 0.00 H new ATOM 547 N TRP A 457 6.739 -0.037 4.118 1.00 0.00 N ATOM 548 CA TRP A 457 6.095 -0.134 5.423 1.00 0.00 C ATOM 549 C TRP A 457 6.836 0.705 6.459 1.00 0.00 C ATOM 550 O TRP A 457 8.006 1.049 6.292 1.00 0.00 O ATOM 551 CB TRP A 457 6.036 -1.593 5.878 1.00 0.00 C ATOM 552 CG TRP A 457 7.280 -2.366 5.560 1.00 0.00 C ATOM 553 CD1 TRP A 457 8.263 -2.732 6.434 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.673 -2.865 4.278 1.00 0.00 C ATOM 555 NE1 TRP A 457 9.245 -3.429 5.772 1.00 0.00 N ATOM 556 CE2 TRP A 457 8.906 -3.525 4.448 1.00 0.00 C ATOM 557 CE3 TRP A 457 7.104 -2.822 3.002 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.577 -4.134 3.391 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.771 -3.426 1.954 1.00 0.00 C ATOM 560 CH2 TRP A 457 8.997 -4.075 2.153 1.00 0.00 C ATOM 0 H TRP A 457 7.563 -0.629 4.009 1.00 0.00 H new ATOM 0 HA TRP A 457 5.080 0.251 5.329 1.00 0.00 H new ATOM 0 HB2 TRP A 457 5.863 -1.624 6.954 1.00 0.00 H new ATOM 0 HB3 TRP A 457 5.184 -2.080 5.404 1.00 0.00 H new ATOM 0 HD1 TRP A 457 8.268 -2.507 7.490 1.00 0.00 H new ATOM 0 HE1 TRP A 457 10.089 -3.813 6.197 1.00 0.00 H new ATOM 0 HE3 TRP A 457 6.159 -2.325 2.838 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 10.522 -4.635 3.543 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 7.340 -3.398 0.964 1.00 0.00 H new ATOM 0 HH2 TRP A 457 9.494 -4.538 1.313 1.00 0.00 H new ATOM 571 N PRO A 458 6.141 1.043 7.555 1.00 0.00 N ATOM 572 CA PRO A 458 6.715 1.845 8.640 1.00 0.00 C ATOM 573 C PRO A 458 8.107 1.368 9.040 1.00 0.00 C ATOM 574 O PRO A 458 9.093 2.085 8.867 1.00 0.00 O ATOM 575 CB PRO A 458 5.728 1.641 9.792 1.00 0.00 C ATOM 576 CG PRO A 458 4.424 1.358 9.128 1.00 0.00 C ATOM 577 CD PRO A 458 4.742 0.668 7.820 1.00 0.00 C ATOM 0 HA PRO A 458 6.845 2.888 8.351 1.00 0.00 H new ATOM 0 HB2 PRO A 458 6.033 0.814 10.433 1.00 0.00 H new ATOM 0 HB3 PRO A 458 5.667 2.528 10.423 1.00 0.00 H new ATOM 0 HG2 PRO A 458 3.799 0.725 9.757 1.00 0.00 H new ATOM 0 HG3 PRO A 458 3.870 2.281 8.954 1.00 0.00 H new ATOM 0 HD2 PRO A 458 4.626 -0.413 7.900 1.00 0.00 H new ATOM 0 HD3 PRO A 458 4.080 1.002 7.021 1.00 0.00 H new ATOM 585 N HIS A 459 8.180 0.154 9.576 1.00 0.00 N ATOM 586 CA HIS A 459 9.452 -0.419 10.000 1.00 0.00 C ATOM 587 C HIS A 459 10.134 -1.144 8.843 1.00 0.00 C ATOM 588 O HIS A 459 10.290 -2.365 8.867 1.00 0.00 O ATOM 589 CB HIS A 459 9.238 -1.384 11.166 1.00 0.00 C ATOM 590 CG HIS A 459 8.895 -0.700 12.454 1.00 0.00 C ATOM 591 ND1 HIS A 459 9.009 -1.312 13.684 1.00 0.00 N ATOM 592 CD2 HIS A 459 8.441 0.551 12.698 1.00 0.00 C ATOM 593 CE1 HIS A 459 8.638 -0.467 14.629 1.00 0.00 C ATOM 594 NE2 HIS A 459 8.289 0.671 14.057 1.00 0.00 N ATOM 0 H HIS A 459 7.373 -0.452 9.727 1.00 0.00 H new ATOM 0 HA HIS A 459 10.098 0.396 10.327 1.00 0.00 H new ATOM 0 HB2 HIS A 459 8.439 -2.079 10.909 1.00 0.00 H new ATOM 0 HB3 HIS A 459 10.142 -1.976 11.308 1.00 0.00 H new ATOM 0 HD2 HIS A 459 8.236 1.313 11.961 1.00 0.00 H new ATOM 0 HE1 HIS A 459 8.623 -0.672 15.689 1.00 0.00 H new ATOM 0 HE2 HIS A 459 7.960 1.504 14.546 1.00 0.00 H new ATOM 602 N LYS A 460 10.538 -0.384 7.830 1.00 0.00 N ATOM 603 CA LYS A 460 11.203 -0.952 6.664 1.00 0.00 C ATOM 604 C LYS A 460 12.682 -0.581 6.647 1.00 0.00 C ATOM 605 O LYS A 460 13.546 -1.440 6.471 1.00 0.00 O ATOM 606 CB LYS A 460 10.529 -0.466 5.379 1.00 0.00 C ATOM 607 CG LYS A 460 11.264 -0.875 4.115 1.00 0.00 C ATOM 608 CD LYS A 460 10.357 -0.808 2.897 1.00 0.00 C ATOM 609 CE LYS A 460 11.138 -1.021 1.609 1.00 0.00 C ATOM 610 NZ LYS A 460 11.765 0.240 1.125 1.00 0.00 N ATOM 0 H LYS A 460 10.416 0.628 7.794 1.00 0.00 H new ATOM 0 HA LYS A 460 11.119 -2.037 6.722 1.00 0.00 H new ATOM 0 HB2 LYS A 460 9.513 -0.858 5.341 1.00 0.00 H new ATOM 0 HB3 LYS A 460 10.451 0.621 5.408 1.00 0.00 H new ATOM 0 HG2 LYS A 460 12.124 -0.222 3.966 1.00 0.00 H new ATOM 0 HG3 LYS A 460 11.649 -1.889 4.228 1.00 0.00 H new ATOM 0 HD2 LYS A 460 9.577 -1.565 2.980 1.00 0.00 H new ATOM 0 HD3 LYS A 460 9.859 0.161 2.866 1.00 0.00 H new ATOM 0 HE2 LYS A 460 11.911 -1.771 1.773 1.00 0.00 H new ATOM 0 HE3 LYS A 460 10.471 -1.413 0.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 12.288 0.053 0.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 11.025 0.948 0.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 12.421 0.601 1.847 1.00 0.00 H new ATOM 624 N ALA A 461 12.967 0.704 6.831 1.00 0.00 N ATOM 625 CA ALA A 461 14.342 1.189 6.840 1.00 0.00 C ATOM 626 C ALA A 461 15.179 0.444 7.874 1.00 0.00 C ATOM 627 O ALA A 461 16.189 -0.174 7.539 1.00 0.00 O ATOM 628 CB ALA A 461 14.372 2.685 7.112 1.00 0.00 C ATOM 0 H ALA A 461 12.264 1.428 6.976 1.00 0.00 H new ATOM 0 HA ALA A 461 14.774 1.001 5.857 1.00 0.00 H new ATOM 0 HB1 ALA A 461 15.405 3.033 7.116 1.00 0.00 H new ATOM 0 HB2 ALA A 461 13.816 3.208 6.334 1.00 0.00 H new ATOM 0 HB3 ALA A 461 13.917 2.888 8.082 1.00 0.00 H new ATOM 634 N GLU A 462 14.753 0.507 9.132 1.00 0.00 N ATOM 635 CA GLU A 462 15.466 -0.160 10.214 1.00 0.00 C ATOM 636 C GLU A 462 15.426 -1.676 10.039 1.00 0.00 C ATOM 637 O GLU A 462 16.461 -2.319 9.866 1.00 0.00 O ATOM 638 CB GLU A 462 14.862 0.224 11.566 1.00 0.00 C ATOM 639 CG GLU A 462 15.294 1.595 12.059 1.00 0.00 C ATOM 640 CD GLU A 462 14.456 2.715 11.474 1.00 0.00 C ATOM 641 OE1 GLU A 462 14.662 3.055 10.290 1.00 0.00 O ATOM 642 OE2 GLU A 462 13.594 3.253 12.201 1.00 0.00 O ATOM 0 H GLU A 462 13.918 1.013 9.426 1.00 0.00 H new ATOM 0 HA GLU A 462 16.506 0.165 10.183 1.00 0.00 H new ATOM 0 HB2 GLU A 462 13.775 0.201 11.488 1.00 0.00 H new ATOM 0 HB3 GLU A 462 15.144 -0.525 12.306 1.00 0.00 H new ATOM 0 HG2 GLU A 462 15.225 1.624 13.146 1.00 0.00 H new ATOM 0 HG3 GLU A 462 16.341 1.757 11.801 1.00 0.00 H new ATOM 649 N SER A 463 14.223 -2.239 10.085 1.00 0.00 N ATOM 650 CA SER A 463 14.046 -3.679 9.936 1.00 0.00 C ATOM 651 C SER A 463 15.067 -4.253 8.957 1.00 0.00 C ATOM 652 O SER A 463 15.511 -3.570 8.034 1.00 0.00 O ATOM 653 CB SER A 463 12.629 -3.993 9.455 1.00 0.00 C ATOM 654 OG SER A 463 12.423 -3.526 8.133 1.00 0.00 O ATOM 0 H SER A 463 13.356 -1.720 10.224 1.00 0.00 H new ATOM 0 HA SER A 463 14.202 -4.142 10.910 1.00 0.00 H new ATOM 0 HB2 SER A 463 12.458 -5.069 9.494 1.00 0.00 H new ATOM 0 HB3 SER A 463 11.904 -3.530 10.124 1.00 0.00 H new ATOM 0 HG SER A 463 11.475 -3.314 8.005 1.00 0.00 H new ATOM 660 N LYS A 464 15.435 -5.512 9.167 1.00 0.00 N ATOM 661 CA LYS A 464 16.402 -6.181 8.304 1.00 0.00 C ATOM 662 C LYS A 464 15.716 -7.214 7.417 1.00 0.00 C ATOM 663 O LYS A 464 15.776 -7.131 6.190 1.00 0.00 O ATOM 664 CB LYS A 464 17.487 -6.855 9.147 1.00 0.00 C ATOM 665 CG LYS A 464 18.374 -5.875 9.894 1.00 0.00 C ATOM 666 CD LYS A 464 19.761 -6.448 10.132 1.00 0.00 C ATOM 667 CE LYS A 464 20.705 -6.117 8.986 1.00 0.00 C ATOM 668 NZ LYS A 464 22.048 -6.730 9.179 1.00 0.00 N ATOM 0 H LYS A 464 15.078 -6.090 9.928 1.00 0.00 H new ATOM 0 HA LYS A 464 16.863 -5.429 7.664 1.00 0.00 H new ATOM 0 HB2 LYS A 464 17.014 -7.524 9.866 1.00 0.00 H new ATOM 0 HB3 LYS A 464 18.108 -7.472 8.498 1.00 0.00 H new ATOM 0 HG2 LYS A 464 18.455 -4.949 9.325 1.00 0.00 H new ATOM 0 HG3 LYS A 464 17.915 -5.623 10.850 1.00 0.00 H new ATOM 0 HD2 LYS A 464 20.165 -6.051 11.064 1.00 0.00 H new ATOM 0 HD3 LYS A 464 19.694 -7.530 10.249 1.00 0.00 H new ATOM 0 HE2 LYS A 464 20.276 -6.470 8.048 1.00 0.00 H new ATOM 0 HE3 LYS A 464 20.808 -5.035 8.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 22.662 -6.481 8.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 22.469 -6.374 10.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 21.953 -7.764 9.234 1.00 0.00 H new ATOM 682 N SER A 465 15.063 -8.187 8.046 1.00 0.00 N ATOM 683 CA SER A 465 14.368 -9.239 7.313 1.00 0.00 C ATOM 684 C SER A 465 13.389 -8.642 6.306 1.00 0.00 C ATOM 685 O SER A 465 13.031 -7.468 6.392 1.00 0.00 O ATOM 686 CB SER A 465 13.623 -10.158 8.282 1.00 0.00 C ATOM 687 OG SER A 465 12.638 -9.443 9.009 1.00 0.00 O ATOM 0 H SER A 465 15.001 -8.268 9.061 1.00 0.00 H new ATOM 0 HA SER A 465 15.112 -9.822 6.770 1.00 0.00 H new ATOM 0 HB2 SER A 465 13.152 -10.970 7.728 1.00 0.00 H new ATOM 0 HB3 SER A 465 14.332 -10.613 8.974 1.00 0.00 H new ATOM 0 HG SER A 465 12.175 -10.053 9.620 1.00 0.00 H new ATOM 693 N TYR A 466 12.960 -9.461 5.352 1.00 0.00 N ATOM 694 CA TYR A 466 12.024 -9.016 4.326 1.00 0.00 C ATOM 695 C TYR A 466 10.591 -9.379 4.701 1.00 0.00 C ATOM 696 O TYR A 466 9.781 -9.728 3.842 1.00 0.00 O ATOM 697 CB TYR A 466 12.383 -9.637 2.975 1.00 0.00 C ATOM 698 CG TYR A 466 12.733 -11.105 3.057 1.00 0.00 C ATOM 699 CD1 TYR A 466 11.738 -12.076 3.086 1.00 0.00 C ATOM 700 CD2 TYR A 466 14.057 -11.523 3.107 1.00 0.00 C ATOM 701 CE1 TYR A 466 12.053 -13.419 3.162 1.00 0.00 C ATOM 702 CE2 TYR A 466 14.381 -12.863 3.182 1.00 0.00 C ATOM 703 CZ TYR A 466 13.376 -13.808 3.209 1.00 0.00 C ATOM 704 OH TYR A 466 13.694 -15.144 3.285 1.00 0.00 O ATOM 0 H TYR A 466 13.245 -10.437 5.268 1.00 0.00 H new ATOM 0 HA TYR A 466 12.096 -7.931 4.250 1.00 0.00 H new ATOM 0 HB2 TYR A 466 11.543 -9.510 2.292 1.00 0.00 H new ATOM 0 HB3 TYR A 466 13.226 -9.094 2.548 1.00 0.00 H new ATOM 0 HD1 TYR A 466 10.701 -11.775 3.048 1.00 0.00 H new ATOM 0 HD2 TYR A 466 14.847 -10.787 3.087 1.00 0.00 H new ATOM 0 HE1 TYR A 466 11.268 -14.160 3.185 1.00 0.00 H new ATOM 0 HE2 TYR A 466 15.416 -13.170 3.219 1.00 0.00 H new ATOM 0 HH TYR A 466 14.668 -15.248 3.309 1.00 0.00 H new ATOM 714 N PHE A 467 10.284 -9.293 5.991 1.00 0.00 N ATOM 715 CA PHE A 467 8.949 -9.612 6.482 1.00 0.00 C ATOM 716 C PHE A 467 8.288 -8.383 7.100 1.00 0.00 C ATOM 717 O PHE A 467 8.456 -8.085 8.282 1.00 0.00 O ATOM 718 CB PHE A 467 9.018 -10.740 7.514 1.00 0.00 C ATOM 719 CG PHE A 467 9.326 -12.082 6.914 1.00 0.00 C ATOM 720 CD1 PHE A 467 8.557 -12.586 5.878 1.00 0.00 C ATOM 721 CD2 PHE A 467 10.386 -12.840 7.387 1.00 0.00 C ATOM 722 CE1 PHE A 467 8.838 -13.821 5.325 1.00 0.00 C ATOM 723 CE2 PHE A 467 10.673 -14.076 6.838 1.00 0.00 C ATOM 724 CZ PHE A 467 9.898 -14.567 5.805 1.00 0.00 C ATOM 0 H PHE A 467 10.942 -9.005 6.715 1.00 0.00 H new ATOM 0 HA PHE A 467 8.347 -9.940 5.635 1.00 0.00 H new ATOM 0 HB2 PHE A 467 9.780 -10.498 8.255 1.00 0.00 H new ATOM 0 HB3 PHE A 467 8.067 -10.797 8.043 1.00 0.00 H new ATOM 0 HD1 PHE A 467 7.728 -12.007 5.498 1.00 0.00 H new ATOM 0 HD2 PHE A 467 10.995 -12.460 8.194 1.00 0.00 H new ATOM 0 HE1 PHE A 467 8.230 -14.203 4.518 1.00 0.00 H new ATOM 0 HE2 PHE A 467 11.502 -14.657 7.216 1.00 0.00 H new ATOM 0 HZ PHE A 467 10.120 -15.532 5.373 1.00 0.00 H new ATOM 734 N PRO A 468 7.518 -7.652 6.281 1.00 0.00 N ATOM 735 CA PRO A 468 6.816 -6.444 6.724 1.00 0.00 C ATOM 736 C PRO A 468 6.121 -6.636 8.067 1.00 0.00 C ATOM 737 O PRO A 468 5.983 -7.752 8.568 1.00 0.00 O ATOM 738 CB PRO A 468 5.784 -6.207 5.618 1.00 0.00 C ATOM 739 CG PRO A 468 6.393 -6.808 4.397 1.00 0.00 C ATOM 740 CD PRO A 468 7.272 -7.949 4.860 1.00 0.00 C ATOM 0 HA PRO A 468 7.500 -5.609 6.875 1.00 0.00 H new ATOM 0 HB2 PRO A 468 4.831 -6.678 5.858 1.00 0.00 H new ATOM 0 HB3 PRO A 468 5.588 -5.144 5.480 1.00 0.00 H new ATOM 0 HG2 PRO A 468 5.620 -7.167 3.717 1.00 0.00 H new ATOM 0 HG3 PRO A 468 6.978 -6.067 3.852 1.00 0.00 H new ATOM 0 HD2 PRO A 468 6.777 -8.912 4.733 1.00 0.00 H new ATOM 0 HD3 PRO A 468 8.202 -7.992 4.294 1.00 0.00 H new ATOM 748 N PRO A 469 5.673 -5.523 8.667 1.00 0.00 N ATOM 749 CA PRO A 469 4.984 -5.544 9.961 1.00 0.00 C ATOM 750 C PRO A 469 3.917 -6.631 10.033 1.00 0.00 C ATOM 751 O PRO A 469 3.667 -7.335 9.054 1.00 0.00 O ATOM 752 CB PRO A 469 4.341 -4.158 10.043 1.00 0.00 C ATOM 753 CG PRO A 469 5.218 -3.284 9.214 1.00 0.00 C ATOM 754 CD PRO A 469 5.803 -4.159 8.129 1.00 0.00 C ATOM 0 HA PRO A 469 5.667 -5.762 10.782 1.00 0.00 H new ATOM 0 HB2 PRO A 469 3.320 -4.172 9.660 1.00 0.00 H new ATOM 0 HB3 PRO A 469 4.291 -3.805 11.073 1.00 0.00 H new ATOM 0 HG2 PRO A 469 4.648 -2.462 8.782 1.00 0.00 H new ATOM 0 HG3 PRO A 469 6.007 -2.841 9.821 1.00 0.00 H new ATOM 0 HD2 PRO A 469 5.262 -4.047 7.190 1.00 0.00 H new ATOM 0 HD3 PRO A 469 6.844 -3.906 7.929 1.00 0.00 H new ATOM 762 N LYS A 470 3.290 -6.763 11.197 1.00 0.00 N ATOM 763 CA LYS A 470 2.248 -7.764 11.396 1.00 0.00 C ATOM 764 C LYS A 470 1.324 -7.835 10.185 1.00 0.00 C ATOM 765 O LYS A 470 1.141 -8.898 9.593 1.00 0.00 O ATOM 766 CB LYS A 470 1.437 -7.441 12.652 1.00 0.00 C ATOM 767 CG LYS A 470 1.993 -8.074 13.916 1.00 0.00 C ATOM 768 CD LYS A 470 1.501 -7.358 15.162 1.00 0.00 C ATOM 769 CE LYS A 470 2.438 -6.228 15.561 1.00 0.00 C ATOM 770 NZ LYS A 470 2.224 -5.010 14.731 1.00 0.00 N ATOM 0 H LYS A 470 3.485 -6.189 12.017 1.00 0.00 H new ATOM 0 HA LYS A 470 2.729 -8.734 11.521 1.00 0.00 H new ATOM 0 HB2 LYS A 470 1.401 -6.359 12.783 1.00 0.00 H new ATOM 0 HB3 LYS A 470 0.411 -7.779 12.508 1.00 0.00 H new ATOM 0 HG2 LYS A 470 1.699 -9.123 13.958 1.00 0.00 H new ATOM 0 HG3 LYS A 470 3.082 -8.049 13.887 1.00 0.00 H new ATOM 0 HD2 LYS A 470 0.503 -6.959 14.983 1.00 0.00 H new ATOM 0 HD3 LYS A 470 1.417 -8.070 15.983 1.00 0.00 H new ATOM 0 HE2 LYS A 470 2.284 -5.983 16.612 1.00 0.00 H new ATOM 0 HE3 LYS A 470 3.471 -6.560 15.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 2.438 -4.163 15.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 2.850 -5.041 13.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 1.234 -4.974 14.416 1.00 0.00 H new ATOM 784 N GLY A 471 0.744 -6.695 9.821 1.00 0.00 N ATOM 785 CA GLY A 471 -0.154 -6.651 8.681 1.00 0.00 C ATOM 786 C GLY A 471 -0.598 -5.241 8.347 1.00 0.00 C ATOM 787 O GLY A 471 -1.759 -4.884 8.549 1.00 0.00 O ATOM 0 H GLY A 471 0.880 -5.802 10.295 1.00 0.00 H new ATOM 0 HA2 GLY A 471 0.343 -7.087 7.814 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -1.030 -7.265 8.889 1.00 0.00 H new ATOM 791 N TYR A 472 0.328 -4.435 7.838 1.00 0.00 N ATOM 792 CA TYR A 472 0.026 -3.055 7.480 1.00 0.00 C ATOM 793 C TYR A 472 1.222 -2.395 6.800 1.00 0.00 C ATOM 794 O TYR A 472 2.352 -2.485 7.281 1.00 0.00 O ATOM 795 CB TYR A 472 -0.371 -2.258 8.724 1.00 0.00 C ATOM 796 CG TYR A 472 0.639 -2.345 9.846 1.00 0.00 C ATOM 797 CD1 TYR A 472 0.595 -3.383 10.768 1.00 0.00 C ATOM 798 CD2 TYR A 472 1.638 -1.388 9.983 1.00 0.00 C ATOM 799 CE1 TYR A 472 1.515 -3.465 11.795 1.00 0.00 C ATOM 800 CE2 TYR A 472 2.563 -1.463 11.007 1.00 0.00 C ATOM 801 CZ TYR A 472 2.497 -2.503 11.910 1.00 0.00 C ATOM 802 OH TYR A 472 3.416 -2.582 12.931 1.00 0.00 O ATOM 0 H TYR A 472 1.294 -4.714 7.664 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.809 -3.062 6.780 1.00 0.00 H new ATOM 0 HB2 TYR A 472 -0.506 -1.212 8.448 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -1.334 -2.619 9.085 1.00 0.00 H new ATOM 0 HD1 TYR A 472 -0.172 -4.139 10.680 1.00 0.00 H new ATOM 0 HD2 TYR A 472 1.692 -0.572 9.277 1.00 0.00 H new ATOM 0 HE1 TYR A 472 1.466 -4.278 12.504 1.00 0.00 H new ATOM 0 HE2 TYR A 472 3.333 -0.711 11.099 1.00 0.00 H new ATOM 0 HH TYR A 472 4.040 -1.829 12.869 1.00 0.00 H new ATOM 812 N ALA A 473 0.964 -1.730 5.678 1.00 0.00 N ATOM 813 CA ALA A 473 2.018 -1.052 4.933 1.00 0.00 C ATOM 814 C ALA A 473 1.451 0.094 4.102 1.00 0.00 C ATOM 815 O ALA A 473 0.244 0.337 4.102 1.00 0.00 O ATOM 816 CB ALA A 473 2.753 -2.041 4.040 1.00 0.00 C ATOM 0 H ALA A 473 0.035 -1.647 5.266 1.00 0.00 H new ATOM 0 HA ALA A 473 2.724 -0.633 5.650 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.537 -1.521 3.490 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.198 -2.824 4.654 1.00 0.00 H new ATOM 0 HB3 ALA A 473 2.051 -2.487 3.336 1.00 0.00 H new ATOM 822 N PHE A 474 2.330 0.797 3.394 1.00 0.00 N ATOM 823 CA PHE A 474 1.917 1.919 2.560 1.00 0.00 C ATOM 824 C PHE A 474 2.337 1.701 1.109 1.00 0.00 C ATOM 825 O PHE A 474 3.368 1.085 0.835 1.00 0.00 O ATOM 826 CB PHE A 474 2.521 3.223 3.087 1.00 0.00 C ATOM 827 CG PHE A 474 1.802 3.775 4.284 1.00 0.00 C ATOM 828 CD1 PHE A 474 0.700 4.600 4.128 1.00 0.00 C ATOM 829 CD2 PHE A 474 2.228 3.468 5.567 1.00 0.00 C ATOM 830 CE1 PHE A 474 0.037 5.110 5.229 1.00 0.00 C ATOM 831 CE2 PHE A 474 1.569 3.975 6.671 1.00 0.00 C ATOM 832 CZ PHE A 474 0.472 4.796 6.502 1.00 0.00 C ATOM 0 H PHE A 474 3.332 0.609 3.382 1.00 0.00 H new ATOM 0 HA PHE A 474 0.830 1.988 2.599 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.565 3.051 3.348 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.509 3.967 2.291 1.00 0.00 H new ATOM 0 HD1 PHE A 474 0.355 4.848 3.135 1.00 0.00 H new ATOM 0 HD2 PHE A 474 3.085 2.825 5.705 1.00 0.00 H new ATOM 0 HE1 PHE A 474 -0.820 5.753 5.094 1.00 0.00 H new ATOM 0 HE2 PHE A 474 1.912 3.729 7.665 1.00 0.00 H new ATOM 0 HZ PHE A 474 -0.045 5.192 7.363 1.00 0.00 H new ATOM 842 N LEU A 475 1.531 2.210 0.184 1.00 0.00 N ATOM 843 CA LEU A 475 1.817 2.071 -1.240 1.00 0.00 C ATOM 844 C LEU A 475 1.915 3.437 -1.911 1.00 0.00 C ATOM 845 O LEU A 475 1.040 4.288 -1.743 1.00 0.00 O ATOM 846 CB LEU A 475 0.732 1.234 -1.919 1.00 0.00 C ATOM 847 CG LEU A 475 0.432 -0.123 -1.280 1.00 0.00 C ATOM 848 CD1 LEU A 475 -0.681 -0.834 -2.033 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.687 -0.983 -1.242 1.00 0.00 C ATOM 0 H LEU A 475 0.675 2.723 0.394 1.00 0.00 H new ATOM 0 HA LEU A 475 2.777 1.565 -1.345 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.189 1.816 -1.937 1.00 0.00 H new ATOM 0 HB3 LEU A 475 1.025 1.068 -2.956 1.00 0.00 H new ATOM 0 HG LEU A 475 0.099 0.045 -0.256 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -0.880 -1.797 -1.564 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.584 -0.225 -2.008 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.378 -0.991 -3.068 1.00 0.00 H new ATOM 0 HD21 LEU A 475 1.455 -1.945 -0.784 1.00 0.00 H new ATOM 0 HD22 LEU A 475 2.050 -1.142 -2.257 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.456 -0.479 -0.657 1.00 0.00 H new ATOM 861 N LEU A 476 2.984 3.640 -2.674 1.00 0.00 N ATOM 862 CA LEU A 476 3.196 4.903 -3.373 1.00 0.00 C ATOM 863 C LEU A 476 3.127 4.706 -4.884 1.00 0.00 C ATOM 864 O LEU A 476 4.146 4.485 -5.539 1.00 0.00 O ATOM 865 CB LEU A 476 4.549 5.502 -2.987 1.00 0.00 C ATOM 866 CG LEU A 476 4.706 5.916 -1.523 1.00 0.00 C ATOM 867 CD1 LEU A 476 6.176 6.084 -1.171 1.00 0.00 C ATOM 868 CD2 LEU A 476 3.939 7.201 -1.247 1.00 0.00 C ATOM 0 H LEU A 476 3.717 2.947 -2.824 1.00 0.00 H new ATOM 0 HA LEU A 476 2.404 5.591 -3.077 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.326 4.776 -3.224 1.00 0.00 H new ATOM 0 HB3 LEU A 476 4.729 6.376 -3.612 1.00 0.00 H new ATOM 0 HG LEU A 476 4.291 5.127 -0.895 1.00 0.00 H new ATOM 0 HD11 LEU A 476 6.268 6.379 -0.126 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.698 5.140 -1.330 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.616 6.853 -1.805 1.00 0.00 H new ATOM 0 HD21 LEU A 476 4.062 7.481 -0.201 1.00 0.00 H new ATOM 0 HD22 LEU A 476 4.324 7.998 -1.883 1.00 0.00 H new ATOM 0 HD23 LEU A 476 2.881 7.046 -1.459 1.00 0.00 H new ATOM 880 N PHE A 477 1.919 4.791 -5.432 1.00 0.00 N ATOM 881 CA PHE A 477 1.717 4.623 -6.867 1.00 0.00 C ATOM 882 C PHE A 477 2.466 5.697 -7.650 1.00 0.00 C ATOM 883 O PHE A 477 2.322 6.889 -7.382 1.00 0.00 O ATOM 884 CB PHE A 477 0.225 4.679 -7.203 1.00 0.00 C ATOM 885 CG PHE A 477 -0.522 3.433 -6.821 1.00 0.00 C ATOM 886 CD1 PHE A 477 -0.942 3.234 -5.516 1.00 0.00 C ATOM 887 CD2 PHE A 477 -0.803 2.460 -7.767 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.630 2.089 -5.162 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.491 1.313 -7.419 1.00 0.00 C ATOM 890 CZ PHE A 477 -1.904 1.127 -6.114 1.00 0.00 C ATOM 0 H PHE A 477 1.066 4.975 -4.905 1.00 0.00 H new ATOM 0 HA PHE A 477 2.111 3.648 -7.153 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.222 5.532 -6.693 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.108 4.850 -8.273 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -0.729 3.982 -4.767 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -0.481 2.600 -8.788 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -1.953 1.947 -4.141 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -1.705 0.563 -8.166 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.440 0.231 -5.839 1.00 0.00 H new ATOM 900 N GLN A 478 3.267 5.264 -8.619 1.00 0.00 N ATOM 901 CA GLN A 478 4.040 6.188 -9.441 1.00 0.00 C ATOM 902 C GLN A 478 3.205 7.404 -9.825 1.00 0.00 C ATOM 903 O GLN A 478 3.545 8.536 -9.482 1.00 0.00 O ATOM 904 CB GLN A 478 4.545 5.482 -10.701 1.00 0.00 C ATOM 905 CG GLN A 478 5.868 4.760 -10.504 1.00 0.00 C ATOM 906 CD GLN A 478 7.064 5.677 -10.669 1.00 0.00 C ATOM 907 OE1 GLN A 478 7.861 5.849 -9.746 1.00 0.00 O ATOM 908 NE2 GLN A 478 7.196 6.273 -11.848 1.00 0.00 N ATOM 0 H GLN A 478 3.397 4.280 -8.854 1.00 0.00 H new ATOM 0 HA GLN A 478 4.895 6.528 -8.856 1.00 0.00 H new ATOM 0 HB2 GLN A 478 3.794 4.764 -11.031 1.00 0.00 H new ATOM 0 HB3 GLN A 478 4.656 6.216 -11.499 1.00 0.00 H new ATOM 0 HG2 GLN A 478 5.890 4.316 -9.509 1.00 0.00 H new ATOM 0 HG3 GLN A 478 5.941 3.942 -11.220 1.00 0.00 H new ATOM 0 HE21 GLN A 478 6.512 6.102 -12.585 1.00 0.00 H new ATOM 0 HE22 GLN A 478 7.981 6.902 -12.017 1.00 0.00 H new ATOM 917 N GLU A 479 2.110 7.163 -10.540 1.00 0.00 N ATOM 918 CA GLU A 479 1.227 8.240 -10.971 1.00 0.00 C ATOM 919 C GLU A 479 -0.009 8.320 -10.081 1.00 0.00 C ATOM 920 O GLU A 479 -0.344 7.366 -9.380 1.00 0.00 O ATOM 921 CB GLU A 479 0.807 8.032 -12.428 1.00 0.00 C ATOM 922 CG GLU A 479 1.785 8.618 -13.433 1.00 0.00 C ATOM 923 CD GLU A 479 1.420 8.283 -14.866 1.00 0.00 C ATOM 924 OE1 GLU A 479 1.184 7.091 -15.154 1.00 0.00 O ATOM 925 OE2 GLU A 479 1.369 9.212 -15.699 1.00 0.00 O ATOM 0 H GLU A 479 1.814 6.232 -10.833 1.00 0.00 H new ATOM 0 HA GLU A 479 1.774 9.179 -10.888 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.700 6.964 -12.618 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.173 8.483 -12.583 1.00 0.00 H new ATOM 0 HG2 GLU A 479 1.817 9.701 -13.314 1.00 0.00 H new ATOM 0 HG3 GLU A 479 2.786 8.244 -13.220 1.00 0.00 H new ATOM 932 N GLU A 480 -0.682 9.466 -10.114 1.00 0.00 N ATOM 933 CA GLU A 480 -1.881 9.671 -9.309 1.00 0.00 C ATOM 934 C GLU A 480 -3.078 8.951 -9.922 1.00 0.00 C ATOM 935 O GLU A 480 -3.851 8.300 -9.220 1.00 0.00 O ATOM 936 CB GLU A 480 -2.183 11.165 -9.176 1.00 0.00 C ATOM 937 CG GLU A 480 -1.331 11.868 -8.133 1.00 0.00 C ATOM 938 CD GLU A 480 -1.894 11.733 -6.732 1.00 0.00 C ATOM 939 OE1 GLU A 480 -2.439 10.655 -6.414 1.00 0.00 O ATOM 940 OE2 GLU A 480 -1.790 12.704 -5.954 1.00 0.00 O ATOM 0 H GLU A 480 -0.418 10.266 -10.689 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.698 9.255 -8.318 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -2.029 11.645 -10.142 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -3.235 11.293 -8.920 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -0.322 11.456 -8.156 1.00 0.00 H new ATOM 0 HG3 GLU A 480 -1.250 12.925 -8.388 1.00 0.00 H new ATOM 947 N SER A 481 -3.225 9.075 -11.238 1.00 0.00 N ATOM 948 CA SER A 481 -4.331 8.440 -11.946 1.00 0.00 C ATOM 949 C SER A 481 -4.602 7.045 -11.392 1.00 0.00 C ATOM 950 O SER A 481 -5.735 6.712 -11.044 1.00 0.00 O ATOM 951 CB SER A 481 -4.024 8.356 -13.443 1.00 0.00 C ATOM 952 OG SER A 481 -5.168 7.953 -14.176 1.00 0.00 O ATOM 0 H SER A 481 -2.593 9.609 -11.835 1.00 0.00 H new ATOM 0 HA SER A 481 -5.222 9.050 -11.798 1.00 0.00 H new ATOM 0 HB2 SER A 481 -3.681 9.326 -13.802 1.00 0.00 H new ATOM 0 HB3 SER A 481 -3.212 7.649 -13.612 1.00 0.00 H new ATOM 0 HG SER A 481 -4.947 7.909 -15.130 1.00 0.00 H new ATOM 958 N SER A 482 -3.552 6.233 -11.312 1.00 0.00 N ATOM 959 CA SER A 482 -3.676 4.872 -10.804 1.00 0.00 C ATOM 960 C SER A 482 -4.489 4.845 -9.513 1.00 0.00 C ATOM 961 O SER A 482 -5.449 4.086 -9.385 1.00 0.00 O ATOM 962 CB SER A 482 -2.292 4.267 -10.561 1.00 0.00 C ATOM 963 OG SER A 482 -1.460 5.167 -9.850 1.00 0.00 O ATOM 0 H SER A 482 -2.607 6.494 -11.592 1.00 0.00 H new ATOM 0 HA SER A 482 -4.198 4.278 -11.554 1.00 0.00 H new ATOM 0 HB2 SER A 482 -2.391 3.338 -10.000 1.00 0.00 H new ATOM 0 HB3 SER A 482 -1.829 4.015 -11.515 1.00 0.00 H new ATOM 0 HG SER A 482 -1.225 5.922 -10.429 1.00 0.00 H new ATOM 969 N VAL A 483 -4.096 5.682 -8.557 1.00 0.00 N ATOM 970 CA VAL A 483 -4.787 5.757 -7.275 1.00 0.00 C ATOM 971 C VAL A 483 -6.298 5.666 -7.459 1.00 0.00 C ATOM 972 O VAL A 483 -6.971 4.898 -6.773 1.00 0.00 O ATOM 973 CB VAL A 483 -4.449 7.062 -6.531 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.292 7.193 -5.272 1.00 0.00 C ATOM 975 CG2 VAL A 483 -2.966 7.116 -6.197 1.00 0.00 C ATOM 0 H VAL A 483 -3.303 6.317 -8.646 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.445 4.910 -6.681 1.00 0.00 H new ATOM 0 HB VAL A 483 -4.682 7.903 -7.184 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -5.039 8.121 -4.760 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.348 7.203 -5.541 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -5.094 6.349 -4.612 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -2.745 8.045 -5.671 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -2.705 6.269 -5.562 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.384 7.073 -7.118 1.00 0.00 H new ATOM 985 N GLN A 484 -6.823 6.455 -8.391 1.00 0.00 N ATOM 986 CA GLN A 484 -8.255 6.464 -8.665 1.00 0.00 C ATOM 987 C GLN A 484 -8.744 5.071 -9.051 1.00 0.00 C ATOM 988 O GLN A 484 -9.606 4.499 -8.385 1.00 0.00 O ATOM 989 CB GLN A 484 -8.576 7.458 -9.783 1.00 0.00 C ATOM 990 CG GLN A 484 -10.038 7.873 -9.826 1.00 0.00 C ATOM 991 CD GLN A 484 -10.547 8.356 -8.483 1.00 0.00 C ATOM 992 OE1 GLN A 484 -10.505 9.550 -8.183 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.034 7.430 -7.666 1.00 0.00 N ATOM 0 H GLN A 484 -6.279 7.096 -8.969 1.00 0.00 H new ATOM 0 HA GLN A 484 -8.771 6.772 -7.756 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -7.958 8.347 -9.656 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -8.304 7.015 -10.741 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -10.165 8.664 -10.565 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.642 7.028 -10.157 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -11.050 6.452 -7.955 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -11.393 7.697 -6.749 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.188 4.533 -10.131 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.566 3.207 -10.605 1.00 0.00 C ATOM 1004 C ALA A 485 -8.664 2.218 -9.448 1.00 0.00 C ATOM 1005 O ALA A 485 -9.534 1.346 -9.435 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.569 2.713 -11.642 1.00 0.00 C ATOM 0 H ALA A 485 -7.474 4.995 -10.695 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.549 3.281 -11.070 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -7.864 1.722 -11.987 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.552 3.401 -12.487 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.576 2.661 -11.196 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.766 2.359 -8.479 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.751 1.477 -7.317 1.00 0.00 C ATOM 1014 C LEU A 486 -8.987 1.695 -6.451 1.00 0.00 C ATOM 1015 O LEU A 486 -9.772 0.772 -6.228 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.486 1.713 -6.489 1.00 0.00 C ATOM 1017 CG LEU A 486 -6.282 0.781 -5.295 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.828 -0.594 -5.761 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -5.275 1.375 -4.321 1.00 0.00 C ATOM 0 H LEU A 486 -7.039 3.075 -8.475 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.758 0.447 -7.674 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.622 1.621 -7.148 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -6.501 2.740 -6.124 1.00 0.00 H new ATOM 0 HG LEU A 486 -7.236 0.670 -4.779 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.688 -1.243 -4.897 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.584 -1.023 -6.419 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -4.886 -0.502 -6.302 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -5.142 0.698 -3.477 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.320 1.517 -4.827 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -5.641 2.337 -3.961 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.156 2.921 -5.968 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.299 3.261 -5.129 1.00 0.00 C ATOM 1033 C ILE A 487 -11.581 2.636 -5.669 1.00 0.00 C ATOM 1034 O ILE A 487 -12.295 1.939 -4.948 1.00 0.00 O ATOM 1035 CB ILE A 487 -10.488 4.786 -5.027 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.258 5.432 -4.385 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -11.741 5.112 -4.228 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.224 6.938 -4.525 1.00 0.00 C ATOM 0 H ILE A 487 -8.516 3.696 -6.143 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.093 2.862 -4.136 1.00 0.00 H new ATOM 0 HB ILE A 487 -10.606 5.191 -6.032 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.232 5.173 -3.327 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.359 5.013 -4.838 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -11.861 6.194 -4.165 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -12.611 4.679 -4.722 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -11.650 4.698 -3.224 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -8.325 7.328 -4.047 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -9.218 7.205 -5.582 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -10.104 7.368 -4.047 1.00 0.00 H new ATOM 1050 N ASP A 488 -11.866 2.890 -6.941 1.00 0.00 N ATOM 1051 CA ASP A 488 -13.061 2.350 -7.579 1.00 0.00 C ATOM 1052 C ASP A 488 -13.102 0.830 -7.458 1.00 0.00 C ATOM 1053 O ASP A 488 -14.159 0.244 -7.224 1.00 0.00 O ATOM 1054 CB ASP A 488 -13.108 2.758 -9.052 1.00 0.00 C ATOM 1055 CG ASP A 488 -14.510 2.698 -9.626 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -15.154 1.635 -9.508 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -14.963 3.714 -10.193 1.00 0.00 O ATOM 0 H ASP A 488 -11.286 3.466 -7.551 1.00 0.00 H new ATOM 0 HA ASP A 488 -13.932 2.761 -7.069 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -12.718 3.770 -9.158 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -12.454 2.103 -9.628 1.00 0.00 H new ATOM 1062 N ALA A 489 -11.945 0.197 -7.619 1.00 0.00 N ATOM 1063 CA ALA A 489 -11.849 -1.255 -7.526 1.00 0.00 C ATOM 1064 C ALA A 489 -12.090 -1.731 -6.098 1.00 0.00 C ATOM 1065 O ALA A 489 -12.758 -2.741 -5.875 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.488 -1.726 -8.019 1.00 0.00 C ATOM 0 H ALA A 489 -11.061 0.667 -7.814 1.00 0.00 H new ATOM 0 HA ALA A 489 -12.623 -1.687 -8.160 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -10.430 -2.812 -7.944 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.354 -1.426 -9.058 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -9.705 -1.278 -7.408 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.542 -0.999 -5.135 1.00 0.00 N ATOM 1073 CA CYS A 490 -11.696 -1.348 -3.727 1.00 0.00 C ATOM 1074 C CYS A 490 -13.163 -1.301 -3.313 1.00 0.00 C ATOM 1075 O CYS A 490 -13.798 -0.246 -3.355 1.00 0.00 O ATOM 1076 CB CYS A 490 -10.876 -0.399 -2.852 1.00 0.00 C ATOM 1077 SG CYS A 490 -9.109 -0.383 -3.235 1.00 0.00 S ATOM 0 H CYS A 490 -10.987 -0.160 -5.303 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.330 -2.365 -3.588 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -11.270 0.611 -2.962 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -11.008 -0.680 -1.807 1.00 0.00 H new ATOM 0 HG CYS A 490 -8.658 0.833 -3.150 1.00 0.00 H new ATOM 1083 N LEU A 491 -13.697 -2.451 -2.915 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.091 -2.542 -2.494 1.00 0.00 C ATOM 1085 C LEU A 491 -15.402 -1.514 -1.411 1.00 0.00 C ATOM 1086 O LEU A 491 -14.546 -0.711 -1.041 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.399 -3.949 -1.981 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.076 -5.098 -2.937 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.021 -6.419 -2.186 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -16.104 -5.163 -4.058 1.00 0.00 C ATOM 0 H LEU A 491 -13.186 -3.333 -2.875 1.00 0.00 H new ATOM 0 HA LEU A 491 -15.720 -2.332 -3.359 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -14.845 -4.106 -1.056 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.459 -3.999 -1.730 1.00 0.00 H new ATOM 0 HG LEU A 491 -14.096 -4.914 -3.378 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -14.790 -7.224 -2.883 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -14.248 -6.370 -1.419 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -15.986 -6.611 -1.717 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -15.859 -5.986 -4.729 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -17.095 -5.323 -3.634 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -16.095 -4.226 -4.615 1.00 0.00 H new ATOM 1102 N GLU A 492 -16.631 -1.547 -0.905 1.00 0.00 N ATOM 1103 CA GLU A 492 -17.052 -0.619 0.137 1.00 0.00 C ATOM 1104 C GLU A 492 -18.000 -1.299 1.121 1.00 0.00 C ATOM 1105 O GLU A 492 -18.853 -2.094 0.727 1.00 0.00 O ATOM 1106 CB GLU A 492 -17.734 0.603 -0.483 1.00 0.00 C ATOM 1107 CG GLU A 492 -17.852 1.782 0.468 1.00 0.00 C ATOM 1108 CD GLU A 492 -18.987 2.718 0.100 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -19.948 2.258 -0.551 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -18.914 3.910 0.465 1.00 0.00 O ATOM 0 H GLU A 492 -17.352 -2.206 -1.200 1.00 0.00 H new ATOM 0 HA GLU A 492 -16.164 -0.295 0.680 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -17.173 0.913 -1.365 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -18.730 0.319 -0.822 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -18.005 1.412 1.482 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -16.914 2.338 0.470 1.00 0.00 H new ATOM 1117 N GLU A 493 -17.842 -0.981 2.402 1.00 0.00 N ATOM 1118 CA GLU A 493 -18.682 -1.563 3.442 1.00 0.00 C ATOM 1119 C GLU A 493 -19.397 -0.474 4.237 1.00 0.00 C ATOM 1120 O GLU A 493 -20.596 -0.252 4.067 1.00 0.00 O ATOM 1121 CB GLU A 493 -17.842 -2.428 4.383 1.00 0.00 C ATOM 1122 CG GLU A 493 -18.659 -3.138 5.449 1.00 0.00 C ATOM 1123 CD GLU A 493 -19.550 -4.223 4.875 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -19.036 -5.078 4.125 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -20.762 -4.215 5.177 1.00 0.00 O ATOM 0 H GLU A 493 -17.141 -0.324 2.744 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.433 -2.188 2.959 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -17.303 -3.171 3.795 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -17.094 -1.801 4.868 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -17.986 -3.578 6.185 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -19.274 -2.409 5.976 1.00 0.00 H new ATOM 1132 N ASP A 494 -18.652 0.202 5.105 1.00 0.00 N ATOM 1133 CA ASP A 494 -19.213 1.269 5.926 1.00 0.00 C ATOM 1134 C ASP A 494 -18.379 2.541 5.808 1.00 0.00 C ATOM 1135 O ASP A 494 -17.686 2.930 6.747 1.00 0.00 O ATOM 1136 CB ASP A 494 -19.290 0.828 7.389 1.00 0.00 C ATOM 1137 CG ASP A 494 -20.354 1.579 8.164 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -21.551 1.408 7.849 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -19.991 2.338 9.087 1.00 0.00 O ATOM 0 H ASP A 494 -17.658 0.030 5.258 1.00 0.00 H new ATOM 0 HA ASP A 494 -20.219 1.482 5.565 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -19.499 -0.241 7.433 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -18.321 0.983 7.864 1.00 0.00 H new ATOM 1144 N GLY A 495 -18.451 3.185 4.647 1.00 0.00 N ATOM 1145 CA GLY A 495 -17.698 4.405 4.427 1.00 0.00 C ATOM 1146 C GLY A 495 -16.261 4.135 4.027 1.00 0.00 C ATOM 1147 O GLY A 495 -15.629 4.956 3.361 1.00 0.00 O ATOM 0 H GLY A 495 -19.018 2.883 3.855 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -18.184 4.993 3.649 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -17.712 5.006 5.336 1.00 0.00 H new ATOM 1151 N LYS A 496 -15.742 2.982 4.434 1.00 0.00 N ATOM 1152 CA LYS A 496 -14.370 2.605 4.115 1.00 0.00 C ATOM 1153 C LYS A 496 -14.336 1.585 2.981 1.00 0.00 C ATOM 1154 O LYS A 496 -15.318 0.884 2.733 1.00 0.00 O ATOM 1155 CB LYS A 496 -13.676 2.031 5.352 1.00 0.00 C ATOM 1156 CG LYS A 496 -13.429 3.059 6.442 1.00 0.00 C ATOM 1157 CD LYS A 496 -13.235 2.399 7.797 1.00 0.00 C ATOM 1158 CE LYS A 496 -13.704 3.300 8.929 1.00 0.00 C ATOM 1159 NZ LYS A 496 -13.824 2.559 10.215 1.00 0.00 N ATOM 0 H LYS A 496 -16.251 2.292 4.986 1.00 0.00 H new ATOM 0 HA LYS A 496 -13.840 3.501 3.791 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -14.285 1.223 5.758 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -12.723 1.594 5.054 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -12.547 3.649 6.194 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -14.271 3.750 6.490 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -13.786 1.459 7.827 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -12.182 2.156 7.937 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -13.003 4.126 9.050 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -14.669 3.736 8.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -14.146 3.208 10.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -14.512 1.786 10.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -12.898 2.164 10.476 1.00 0.00 H new ATOM 1173 N LEU A 497 -13.200 1.506 2.296 1.00 0.00 N ATOM 1174 CA LEU A 497 -13.038 0.570 1.189 1.00 0.00 C ATOM 1175 C LEU A 497 -12.290 -0.681 1.639 1.00 0.00 C ATOM 1176 O LEU A 497 -11.657 -0.692 2.695 1.00 0.00 O ATOM 1177 CB LEU A 497 -12.288 1.239 0.036 1.00 0.00 C ATOM 1178 CG LEU A 497 -12.838 2.587 -0.430 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -11.786 3.349 -1.221 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -14.096 2.391 -1.264 1.00 0.00 C ATOM 0 H LEU A 497 -12.378 2.079 2.488 1.00 0.00 H new ATOM 0 HA LEU A 497 -14.030 0.275 0.847 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -11.249 1.377 0.336 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -12.286 0.557 -0.814 1.00 0.00 H new ATOM 0 HG LEU A 497 -13.098 3.175 0.450 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -12.196 4.306 -1.544 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -10.913 3.522 -0.592 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -11.494 2.766 -2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -14.473 3.361 -1.587 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -13.862 1.783 -2.138 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -14.855 1.888 -0.665 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.366 -1.732 0.831 1.00 0.00 N ATOM 1193 CA TYR A 498 -11.697 -2.989 1.145 1.00 0.00 C ATOM 1194 C TYR A 498 -11.418 -3.790 -0.123 1.00 0.00 C ATOM 1195 O TYR A 498 -12.341 -4.209 -0.822 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.549 -3.818 2.108 1.00 0.00 C ATOM 1197 CG TYR A 498 -12.810 -3.131 3.430 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -11.875 -3.178 4.456 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -13.992 -2.435 3.652 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -12.110 -2.553 5.666 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -14.235 -1.805 4.857 1.00 0.00 C ATOM 1202 CZ TYR A 498 -13.291 -1.868 5.861 1.00 0.00 C ATOM 1203 OH TYR A 498 -13.528 -1.242 7.064 1.00 0.00 O ATOM 0 H TYR A 498 -12.885 -1.739 -0.047 1.00 0.00 H new ATOM 0 HA TYR A 498 -10.745 -2.755 1.622 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.503 -4.046 1.632 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -12.050 -4.769 2.294 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -10.948 -3.712 4.306 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -14.734 -2.386 2.869 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -11.373 -2.601 6.454 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -15.158 -1.266 5.012 1.00 0.00 H new ATOM 0 HH TYR A 498 -14.404 -0.804 7.038 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.138 -4.000 -0.412 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.735 -4.751 -1.596 1.00 0.00 C ATOM 1215 C LEU A 499 -9.234 -6.141 -1.214 1.00 0.00 C ATOM 1216 O LEU A 499 -8.364 -6.283 -0.354 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.645 -3.995 -2.357 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.311 -4.524 -3.752 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.392 -4.130 -4.746 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -6.953 -4.009 -4.207 1.00 0.00 C ATOM 0 H LEU A 499 -9.362 -3.661 0.157 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.607 -4.863 -2.240 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.950 -2.953 -2.449 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.735 -4.009 -1.757 1.00 0.00 H new ATOM 0 HG LEU A 499 -8.268 -5.612 -3.706 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -9.137 -4.515 -5.733 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.347 -4.548 -4.429 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.468 -3.044 -4.789 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.732 -4.396 -5.202 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -6.968 -2.919 -4.236 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -6.185 -4.342 -3.509 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.788 -7.161 -1.859 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.397 -8.540 -1.588 1.00 0.00 C ATOM 1234 C CYS A 500 -8.107 -8.893 -2.322 1.00 0.00 C ATOM 1235 O CYS A 500 -8.031 -8.798 -3.547 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.513 -9.500 -2.002 1.00 0.00 C ATOM 1237 SG CYS A 500 -12.177 -8.911 -1.609 1.00 0.00 S ATOM 0 H CYS A 500 -10.509 -7.060 -2.573 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.223 -8.638 -0.516 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.446 -9.677 -3.075 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -10.353 -10.460 -1.510 1.00 0.00 H new ATOM 0 HG CYS A 500 -13.052 -9.790 -1.999 1.00 0.00 H new ATOM 1243 N VAL A 501 -7.094 -9.300 -1.564 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.806 -9.667 -2.142 1.00 0.00 C ATOM 1245 C VAL A 501 -5.504 -11.144 -1.917 1.00 0.00 C ATOM 1246 O VAL A 501 -5.475 -11.617 -0.781 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.663 -8.824 -1.546 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -4.841 -7.356 -1.900 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.593 -9.013 -0.038 1.00 0.00 C ATOM 0 H VAL A 501 -7.140 -9.384 -0.549 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.872 -9.471 -3.212 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.721 -9.164 -1.976 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -4.024 -6.776 -1.470 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -4.837 -7.240 -2.984 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -5.790 -6.998 -1.500 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -3.780 -8.410 0.367 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.535 -8.700 0.412 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.413 -10.064 0.189 1.00 0.00 H new ATOM 1259 N SER A 502 -5.280 -11.869 -3.008 1.00 0.00 N ATOM 1260 CA SER A 502 -4.983 -13.295 -2.931 1.00 0.00 C ATOM 1261 C SER A 502 -3.478 -13.533 -2.849 1.00 0.00 C ATOM 1262 O SER A 502 -2.682 -12.705 -3.293 1.00 0.00 O ATOM 1263 CB SER A 502 -5.560 -14.024 -4.146 1.00 0.00 C ATOM 1264 OG SER A 502 -5.119 -13.430 -5.355 1.00 0.00 O ATOM 0 H SER A 502 -5.298 -11.493 -3.956 1.00 0.00 H new ATOM 0 HA SER A 502 -5.446 -13.689 -2.026 1.00 0.00 H new ATOM 0 HB2 SER A 502 -5.260 -15.072 -4.121 1.00 0.00 H new ATOM 0 HB3 SER A 502 -6.649 -14.003 -4.103 1.00 0.00 H new ATOM 0 HG SER A 502 -5.500 -13.915 -6.116 1.00 0.00 H new ATOM 1270 N SER A 503 -3.095 -14.670 -2.277 1.00 0.00 N ATOM 1271 CA SER A 503 -1.686 -15.017 -2.132 1.00 0.00 C ATOM 1272 C SER A 503 -1.486 -16.527 -2.223 1.00 0.00 C ATOM 1273 O SER A 503 -2.395 -17.316 -1.966 1.00 0.00 O ATOM 1274 CB SER A 503 -1.147 -14.499 -0.797 1.00 0.00 C ATOM 1275 OG SER A 503 -1.452 -13.126 -0.622 1.00 0.00 O ATOM 0 H SER A 503 -3.741 -15.367 -1.906 1.00 0.00 H new ATOM 0 HA SER A 503 -1.135 -14.546 -2.946 1.00 0.00 H new ATOM 0 HB2 SER A 503 -1.576 -15.077 0.021 1.00 0.00 H new ATOM 0 HB3 SER A 503 -0.067 -14.643 -0.757 1.00 0.00 H new ATOM 0 HG SER A 503 -0.726 -12.580 -0.990 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.267 -16.939 -2.599 1.00 0.00 N ATOM 1282 CA PRO A 504 0.083 -18.356 -2.733 1.00 0.00 C ATOM 1283 C PRO A 504 -0.415 -19.190 -1.557 1.00 0.00 C ATOM 1284 O PRO A 504 -0.898 -20.309 -1.736 1.00 0.00 O ATOM 1285 CB PRO A 504 1.614 -18.342 -2.768 1.00 0.00 C ATOM 1286 CG PRO A 504 1.967 -17.008 -3.329 1.00 0.00 C ATOM 1287 CD PRO A 504 0.865 -16.054 -2.921 1.00 0.00 C ATOM 0 HA PRO A 504 -0.373 -18.807 -3.615 1.00 0.00 H new ATOM 0 HB2 PRO A 504 2.034 -18.476 -1.771 1.00 0.00 H new ATOM 0 HB3 PRO A 504 2.003 -19.149 -3.389 1.00 0.00 H new ATOM 0 HG2 PRO A 504 2.931 -16.671 -2.947 1.00 0.00 H new ATOM 0 HG3 PRO A 504 2.054 -17.056 -4.414 1.00 0.00 H new ATOM 0 HD2 PRO A 504 1.157 -15.450 -2.062 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.616 -15.363 -3.726 1.00 0.00 H new ATOM 1295 N THR A 505 -0.295 -18.638 -0.354 1.00 0.00 N ATOM 1296 CA THR A 505 -0.733 -19.331 0.852 1.00 0.00 C ATOM 1297 C THR A 505 -2.133 -18.889 1.263 1.00 0.00 C ATOM 1298 O THR A 505 -3.030 -19.715 1.433 1.00 0.00 O ATOM 1299 CB THR A 505 0.236 -19.086 2.024 1.00 0.00 C ATOM 1300 OG1 THR A 505 0.139 -17.726 2.463 1.00 0.00 O ATOM 1301 CG2 THR A 505 1.669 -19.391 1.615 1.00 0.00 C ATOM 0 H THR A 505 0.102 -17.713 -0.188 1.00 0.00 H new ATOM 0 HA THR A 505 -0.746 -20.395 0.618 1.00 0.00 H new ATOM 0 HB THR A 505 -0.041 -19.752 2.841 1.00 0.00 H new ATOM 0 HG1 THR A 505 0.757 -17.578 3.209 1.00 0.00 H new ATOM 0 HG21 THR A 505 2.335 -19.211 2.459 1.00 0.00 H new ATOM 0 HG22 THR A 505 1.746 -20.434 1.309 1.00 0.00 H new ATOM 0 HG23 THR A 505 1.955 -18.747 0.783 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.313 -17.582 1.420 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.605 -17.031 1.809 1.00 0.00 C ATOM 1311 C ILE A 506 -4.445 -16.683 0.586 1.00 0.00 C ATOM 1312 O ILE A 506 -3.918 -16.263 -0.445 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.440 -15.771 2.680 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.595 -16.085 3.916 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -4.801 -15.227 3.086 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -3.211 -17.132 4.819 1.00 0.00 C ATOM 0 H ILE A 506 -1.581 -16.885 1.284 1.00 0.00 H new ATOM 0 HA ILE A 506 -4.114 -17.800 2.389 1.00 0.00 H new ATOM 0 HB ILE A 506 -2.925 -15.008 2.096 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -1.611 -16.426 3.596 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.445 -15.168 4.486 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.668 -14.337 3.701 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.371 -14.970 2.193 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.340 -15.984 3.655 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -2.558 -17.304 5.675 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -4.183 -16.784 5.169 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -3.336 -18.062 4.265 1.00 0.00 H new ATOM 1328 N LYS A 507 -5.757 -16.860 0.706 1.00 0.00 N ATOM 1329 CA LYS A 507 -6.673 -16.562 -0.389 1.00 0.00 C ATOM 1330 C LYS A 507 -7.173 -15.123 -0.304 1.00 0.00 C ATOM 1331 O LYS A 507 -6.895 -14.416 0.664 1.00 0.00 O ATOM 1332 CB LYS A 507 -7.860 -17.528 -0.364 1.00 0.00 C ATOM 1333 CG LYS A 507 -7.593 -18.838 -1.083 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.046 -18.782 -2.533 1.00 0.00 C ATOM 1335 CE LYS A 507 -6.918 -18.342 -3.453 1.00 0.00 C ATOM 1336 NZ LYS A 507 -6.947 -16.875 -3.705 1.00 0.00 N ATOM 0 H LYS A 507 -6.210 -17.208 1.551 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.131 -16.685 -1.327 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.124 -17.739 0.672 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -8.723 -17.042 -0.820 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -6.528 -19.066 -1.042 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -8.112 -19.648 -0.570 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -8.406 -19.764 -2.841 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -8.884 -18.091 -2.627 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -5.960 -18.615 -3.010 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -6.994 -18.875 -4.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -6.670 -16.686 -4.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -7.908 -16.513 -3.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -6.283 -16.399 -3.061 1.00 0.00 H new ATOM 1350 N ASP A 508 -7.912 -14.698 -1.322 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.452 -13.344 -1.362 1.00 0.00 C ATOM 1352 C ASP A 508 -8.815 -12.863 0.040 1.00 0.00 C ATOM 1353 O ASP A 508 -9.764 -13.355 0.651 1.00 0.00 O ATOM 1354 CB ASP A 508 -9.683 -13.290 -2.268 1.00 0.00 C ATOM 1355 CG ASP A 508 -10.880 -13.997 -1.662 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -10.726 -15.158 -1.230 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -11.970 -13.389 -1.620 1.00 0.00 O ATOM 0 H ASP A 508 -8.151 -15.271 -2.131 1.00 0.00 H new ATOM 0 HA ASP A 508 -7.684 -12.684 -1.766 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -9.941 -12.249 -2.464 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -9.444 -13.746 -3.229 1.00 0.00 H new ATOM 1362 N LYS A 509 -8.053 -11.899 0.545 1.00 0.00 N ATOM 1363 CA LYS A 509 -8.293 -11.350 1.874 1.00 0.00 C ATOM 1364 C LYS A 509 -8.437 -9.833 1.818 1.00 0.00 C ATOM 1365 O LYS A 509 -7.475 -9.102 1.584 1.00 0.00 O ATOM 1366 CB LYS A 509 -7.151 -11.730 2.819 1.00 0.00 C ATOM 1367 CG LYS A 509 -7.461 -11.472 4.283 1.00 0.00 C ATOM 1368 CD LYS A 509 -8.104 -12.684 4.938 1.00 0.00 C ATOM 1369 CE LYS A 509 -7.069 -13.741 5.291 1.00 0.00 C ATOM 1370 NZ LYS A 509 -7.694 -14.949 5.897 1.00 0.00 N ATOM 0 H LYS A 509 -7.263 -11.481 0.053 1.00 0.00 H new ATOM 0 HA LYS A 509 -9.224 -11.772 2.251 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.917 -12.786 2.687 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -6.259 -11.169 2.541 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -6.542 -11.216 4.811 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -8.128 -10.614 4.369 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -8.632 -12.374 5.840 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -8.847 -13.111 4.265 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -6.521 -14.027 4.393 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -6.343 -13.320 5.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -6.956 -15.645 6.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -8.195 -14.681 6.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -8.368 -15.366 5.224 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.668 -9.346 2.040 1.00 0.00 N ATOM 1385 CA PRO A 510 -9.966 -7.911 2.022 1.00 0.00 C ATOM 1386 C PRO A 510 -8.995 -7.106 2.879 1.00 0.00 C ATOM 1387 O PRO A 510 -8.762 -7.432 4.043 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.380 -7.836 2.602 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.992 -9.155 2.281 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.862 -10.159 2.325 1.00 0.00 C ATOM 0 HA PRO A 510 -9.878 -7.489 1.021 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.358 -7.661 3.678 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -11.947 -7.018 2.158 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -12.769 -9.410 3.001 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.462 -9.139 1.297 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -10.794 -10.644 3.299 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -10.997 -10.948 1.585 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.431 -6.053 2.296 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.486 -5.200 3.007 1.00 0.00 C ATOM 1400 C VAL A 511 -7.997 -3.766 3.093 1.00 0.00 C ATOM 1401 O VAL A 511 -8.474 -3.207 2.106 1.00 0.00 O ATOM 1402 CB VAL A 511 -6.106 -5.202 2.324 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.325 -6.452 2.700 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -6.258 -5.091 0.815 1.00 0.00 C ATOM 0 H VAL A 511 -8.612 -5.770 1.333 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.386 -5.607 4.013 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.546 -4.335 2.674 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.353 -6.435 2.208 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -5.184 -6.482 3.780 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -5.878 -7.336 2.382 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -5.273 -5.094 0.349 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.837 -5.937 0.444 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.773 -4.163 0.569 1.00 0.00 H new ATOM 1414 N GLN A 512 -7.893 -3.177 4.279 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.345 -1.807 4.494 1.00 0.00 C ATOM 1416 C GLN A 512 -7.502 -0.823 3.688 1.00 0.00 C ATOM 1417 O GLN A 512 -6.386 -0.482 4.080 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.280 -1.453 5.981 1.00 0.00 C ATOM 1419 CG GLN A 512 -9.257 -0.363 6.389 1.00 0.00 C ATOM 1420 CD GLN A 512 -9.568 -0.384 7.873 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -9.932 -1.421 8.428 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -9.426 0.764 8.525 1.00 0.00 N ATOM 0 H GLN A 512 -7.500 -3.626 5.106 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.379 -1.735 4.155 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -8.482 -2.349 6.569 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -7.267 -1.132 6.226 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -8.843 0.609 6.122 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -10.183 -0.481 5.826 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -9.122 1.600 8.026 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -9.621 0.810 9.525 1.00 0.00 H new ATOM 1431 N ILE A 513 -8.044 -0.373 2.562 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.342 0.572 1.702 1.00 0.00 C ATOM 1433 C ILE A 513 -7.808 2.001 1.960 1.00 0.00 C ATOM 1434 O ILE A 513 -8.945 2.359 1.652 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.548 0.238 0.213 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -7.047 -1.176 -0.089 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.832 1.257 -0.662 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -5.541 -1.275 -0.194 1.00 0.00 C ATOM 0 H ILE A 513 -8.966 -0.647 2.224 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.282 0.489 1.941 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.614 0.281 -0.010 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -7.393 -1.850 0.694 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.491 -1.518 -1.024 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -6.987 1.008 -1.712 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -7.231 2.252 -0.463 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.765 1.242 -0.439 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -5.258 -2.305 -0.409 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -5.189 -0.627 -0.996 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.089 -0.964 0.748 1.00 0.00 H new ATOM 1450 N ARG A 514 -6.921 2.814 2.525 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.241 4.205 2.823 1.00 0.00 C ATOM 1452 C ARG A 514 -6.208 5.144 2.210 1.00 0.00 C ATOM 1453 O ARG A 514 -5.171 5.440 2.804 1.00 0.00 O ATOM 1454 CB ARG A 514 -7.308 4.421 4.336 1.00 0.00 C ATOM 1455 CG ARG A 514 -8.167 3.398 5.061 1.00 0.00 C ATOM 1456 CD ARG A 514 -9.648 3.634 4.809 1.00 0.00 C ATOM 1457 NE ARG A 514 -10.129 4.844 5.470 1.00 0.00 N ATOM 1458 CZ ARG A 514 -11.288 5.427 5.183 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -12.080 4.914 4.252 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -11.657 6.526 5.829 1.00 0.00 N ATOM 0 H ARG A 514 -5.976 2.533 2.785 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.214 4.430 2.387 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -6.298 4.389 4.744 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -7.700 5.418 4.535 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -7.896 2.395 4.731 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -7.967 3.447 6.131 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -9.825 3.712 3.736 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -10.218 2.776 5.165 1.00 0.00 H new ATOM 0 HE ARG A 514 -9.543 5.265 6.191 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -11.800 4.069 3.753 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -12.969 5.364 4.034 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -11.051 6.924 6.546 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -12.547 6.973 5.608 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.495 5.625 0.991 1.00 0.00 N ATOM 1475 CA PRO A 515 -5.603 6.538 0.270 1.00 0.00 C ATOM 1476 C PRO A 515 -5.110 7.682 1.150 1.00 0.00 C ATOM 1477 O PRO A 515 -5.685 8.770 1.149 1.00 0.00 O ATOM 1478 CB PRO A 515 -6.484 7.075 -0.861 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.483 5.998 -1.107 1.00 0.00 C ATOM 1480 CD PRO A 515 -7.713 5.315 0.223 1.00 0.00 C ATOM 0 HA PRO A 515 -4.700 6.036 -0.076 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -6.970 8.008 -0.575 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -5.897 7.282 -1.756 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.413 6.413 -1.496 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -7.115 5.289 -1.849 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.606 5.695 0.719 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -7.848 4.240 0.103 1.00 0.00 H new ATOM 1488 N TRP A 516 -4.042 7.428 1.898 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.472 8.438 2.782 1.00 0.00 C ATOM 1490 C TRP A 516 -3.602 9.830 2.174 1.00 0.00 C ATOM 1491 O TRP A 516 -2.842 10.200 1.280 1.00 0.00 O ATOM 1492 CB TRP A 516 -2.001 8.126 3.064 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.366 9.081 4.030 1.00 0.00 C ATOM 1494 CD1 TRP A 516 -0.357 9.962 3.767 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -1.697 9.247 5.413 1.00 0.00 C ATOM 1496 NE1 TRP A 516 -0.040 10.667 4.903 1.00 0.00 N ATOM 1497 CE2 TRP A 516 -0.848 10.248 5.926 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -2.628 8.651 6.266 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 -0.905 10.661 7.255 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -2.683 9.062 7.585 1.00 0.00 C ATOM 1501 CH2 TRP A 516 -1.826 10.060 8.068 1.00 0.00 C ATOM 0 H TRP A 516 -3.554 6.532 1.910 1.00 0.00 H new ATOM 0 HA TRP A 516 -4.027 8.419 3.720 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -1.921 7.113 3.459 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.446 8.147 2.126 1.00 0.00 H new ATOM 0 HD1 TRP A 516 0.122 10.087 2.807 1.00 0.00 H new ATOM 0 HE1 TRP A 516 0.680 11.386 4.973 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -3.294 7.882 5.902 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 -0.245 11.429 7.630 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -3.398 8.606 8.254 1.00 0.00 H new ATOM 0 HH2 TRP A 516 -1.894 10.361 9.103 1.00 0.00 H new ATOM 1512 N ASN A 517 -4.569 10.598 2.665 1.00 0.00 N ATOM 1513 CA ASN A 517 -4.798 11.950 2.169 1.00 0.00 C ATOM 1514 C ASN A 517 -4.171 12.984 3.099 1.00 0.00 C ATOM 1515 O ASN A 517 -4.590 13.137 4.248 1.00 0.00 O ATOM 1516 CB ASN A 517 -6.298 12.217 2.028 1.00 0.00 C ATOM 1517 CG ASN A 517 -7.017 12.197 3.363 1.00 0.00 C ATOM 1518 OD1 ASN A 517 -6.742 11.353 4.216 1.00 0.00 O ATOM 1519 ND2 ASN A 517 -7.943 13.130 3.551 1.00 0.00 N ATOM 0 H ASN A 517 -5.207 10.307 3.406 1.00 0.00 H new ATOM 0 HA ASN A 517 -4.327 12.035 1.190 1.00 0.00 H new ATOM 0 HB2 ASN A 517 -6.449 13.186 1.552 1.00 0.00 H new ATOM 0 HB3 ASN A 517 -6.738 11.467 1.370 1.00 0.00 H new ATOM 0 HD21 ASN A 517 -8.459 13.167 4.430 1.00 0.00 H new ATOM 0 HD22 ASN A 517 -8.138 13.810 2.816 1.00 0.00 H new ATOM 1526 N LEU A 518 -3.167 13.693 2.596 1.00 0.00 N ATOM 1527 CA LEU A 518 -2.482 14.714 3.381 1.00 0.00 C ATOM 1528 C LEU A 518 -2.103 15.907 2.510 1.00 0.00 C ATOM 1529 O LEU A 518 -1.906 15.770 1.302 1.00 0.00 O ATOM 1530 CB LEU A 518 -1.229 14.127 4.035 1.00 0.00 C ATOM 1531 CG LEU A 518 -0.244 15.138 4.623 1.00 0.00 C ATOM 1532 CD1 LEU A 518 -0.804 15.751 5.897 1.00 0.00 C ATOM 1533 CD2 LEU A 518 1.100 14.477 4.893 1.00 0.00 C ATOM 0 H LEU A 518 -2.809 13.580 1.648 1.00 0.00 H new ATOM 0 HA LEU A 518 -3.164 15.058 4.159 1.00 0.00 H new ATOM 0 HB2 LEU A 518 -1.541 13.450 4.830 1.00 0.00 H new ATOM 0 HB3 LEU A 518 -0.703 13.527 3.293 1.00 0.00 H new ATOM 0 HG LEU A 518 -0.095 15.936 3.896 1.00 0.00 H new ATOM 0 HD11 LEU A 518 -0.089 16.468 6.301 1.00 0.00 H new ATOM 0 HD12 LEU A 518 -1.742 16.260 5.674 1.00 0.00 H new ATOM 0 HD13 LEU A 518 -0.983 14.965 6.631 1.00 0.00 H new ATOM 0 HD21 LEU A 518 1.789 15.211 5.311 1.00 0.00 H new ATOM 0 HD22 LEU A 518 0.967 13.659 5.601 1.00 0.00 H new ATOM 0 HD23 LEU A 518 1.508 14.087 3.960 1.00 0.00 H new ATOM 1545 N SER A 519 -2.000 17.078 3.131 1.00 0.00 N ATOM 1546 CA SER A 519 -1.645 18.296 2.412 1.00 0.00 C ATOM 1547 C SER A 519 -0.297 18.832 2.883 1.00 0.00 C ATOM 1548 O SER A 519 -0.136 19.204 4.046 1.00 0.00 O ATOM 1549 CB SER A 519 -2.726 19.361 2.608 1.00 0.00 C ATOM 1550 OG SER A 519 -2.749 20.270 1.521 1.00 0.00 O ATOM 0 H SER A 519 -2.157 17.209 4.130 1.00 0.00 H new ATOM 0 HA SER A 519 -1.570 18.054 1.352 1.00 0.00 H new ATOM 0 HB2 SER A 519 -3.700 18.881 2.706 1.00 0.00 H new ATOM 0 HB3 SER A 519 -2.543 19.903 3.536 1.00 0.00 H new ATOM 0 HG SER A 519 -3.449 20.940 1.669 1.00 0.00 H new ATOM 1556 N ASP A 520 0.669 18.868 1.972 1.00 0.00 N ATOM 1557 CA ASP A 520 2.004 19.359 2.292 1.00 0.00 C ATOM 1558 C ASP A 520 2.246 20.727 1.660 1.00 0.00 C ATOM 1559 O ASP A 520 2.778 21.632 2.302 1.00 0.00 O ATOM 1560 CB ASP A 520 3.064 18.367 1.811 1.00 0.00 C ATOM 1561 CG ASP A 520 2.700 17.726 0.486 1.00 0.00 C ATOM 1562 OD1 ASP A 520 2.963 18.346 -0.565 1.00 0.00 O ATOM 1563 OD2 ASP A 520 2.152 16.605 0.501 1.00 0.00 O ATOM 0 H ASP A 520 0.552 18.563 1.006 1.00 0.00 H new ATOM 0 HA ASP A 520 2.077 19.461 3.375 1.00 0.00 H new ATOM 0 HB2 ASP A 520 4.020 18.881 1.712 1.00 0.00 H new ATOM 0 HB3 ASP A 520 3.197 17.589 2.563 1.00 0.00 H new ATOM 1568 N SER A 521 1.853 20.868 0.398 1.00 0.00 N ATOM 1569 CA SER A 521 2.031 22.123 -0.322 1.00 0.00 C ATOM 1570 C SER A 521 0.935 23.120 0.043 1.00 0.00 C ATOM 1571 O SER A 521 0.003 22.793 0.778 1.00 0.00 O ATOM 1572 CB SER A 521 2.028 21.875 -1.831 1.00 0.00 C ATOM 1573 OG SER A 521 2.671 22.930 -2.524 1.00 0.00 O ATOM 0 H SER A 521 1.409 20.129 -0.147 1.00 0.00 H new ATOM 0 HA SER A 521 2.993 22.545 -0.032 1.00 0.00 H new ATOM 0 HB2 SER A 521 2.532 20.933 -2.049 1.00 0.00 H new ATOM 0 HB3 SER A 521 1.002 21.777 -2.184 1.00 0.00 H new ATOM 0 HG SER A 521 2.657 22.746 -3.486 1.00 0.00 H new ATOM 1579 N ASP A 522 1.055 24.337 -0.475 1.00 0.00 N ATOM 1580 CA ASP A 522 0.074 25.382 -0.205 1.00 0.00 C ATOM 1581 C ASP A 522 0.278 26.572 -1.138 1.00 0.00 C ATOM 1582 O ASP A 522 1.395 27.066 -1.296 1.00 0.00 O ATOM 1583 CB ASP A 522 0.171 25.838 1.251 1.00 0.00 C ATOM 1584 CG ASP A 522 -0.305 27.264 1.445 1.00 0.00 C ATOM 1585 OD1 ASP A 522 -1.435 27.577 1.013 1.00 0.00 O ATOM 1586 OD2 ASP A 522 0.452 28.068 2.028 1.00 0.00 O ATOM 0 H ASP A 522 1.821 24.624 -1.084 1.00 0.00 H new ATOM 0 HA ASP A 522 -0.919 24.969 -0.383 1.00 0.00 H new ATOM 0 HB2 ASP A 522 -0.422 25.172 1.877 1.00 0.00 H new ATOM 0 HB3 ASP A 522 1.205 25.754 1.587 1.00 0.00 H new ATOM 1591 N PHE A 523 -0.807 27.028 -1.754 1.00 0.00 N ATOM 1592 CA PHE A 523 -0.747 28.158 -2.673 1.00 0.00 C ATOM 1593 C PHE A 523 0.172 29.250 -2.133 1.00 0.00 C ATOM 1594 O PHE A 523 0.229 29.488 -0.926 1.00 0.00 O ATOM 1595 CB PHE A 523 -2.149 28.726 -2.909 1.00 0.00 C ATOM 1596 CG PHE A 523 -2.251 29.576 -4.143 1.00 0.00 C ATOM 1597 CD1 PHE A 523 -2.152 29.006 -5.403 1.00 0.00 C ATOM 1598 CD2 PHE A 523 -2.447 30.944 -4.044 1.00 0.00 C ATOM 1599 CE1 PHE A 523 -2.245 29.786 -6.540 1.00 0.00 C ATOM 1600 CE2 PHE A 523 -2.542 31.729 -5.178 1.00 0.00 C ATOM 1601 CZ PHE A 523 -2.442 31.149 -6.428 1.00 0.00 C ATOM 0 H PHE A 523 -1.739 26.632 -1.633 1.00 0.00 H new ATOM 0 HA PHE A 523 -0.342 27.803 -3.621 1.00 0.00 H new ATOM 0 HB2 PHE A 523 -2.858 27.902 -2.986 1.00 0.00 H new ATOM 0 HB3 PHE A 523 -2.442 29.320 -2.043 1.00 0.00 H new ATOM 0 HD1 PHE A 523 -2.001 27.941 -5.497 1.00 0.00 H new ATOM 0 HD2 PHE A 523 -2.527 31.403 -3.069 1.00 0.00 H new ATOM 0 HE1 PHE A 523 -2.164 29.330 -7.516 1.00 0.00 H new ATOM 0 HE2 PHE A 523 -2.694 32.794 -5.087 1.00 0.00 H new ATOM 0 HZ PHE A 523 -2.518 31.760 -7.316 1.00 0.00 H new ATOM 1611 N VAL A 524 0.890 29.911 -3.035 1.00 0.00 N ATOM 1612 CA VAL A 524 1.806 30.978 -2.651 1.00 0.00 C ATOM 1613 C VAL A 524 1.367 32.316 -3.233 1.00 0.00 C ATOM 1614 O VAL A 524 1.158 32.441 -4.440 1.00 0.00 O ATOM 1615 CB VAL A 524 3.244 30.677 -3.113 1.00 0.00 C ATOM 1616 CG1 VAL A 524 4.175 31.822 -2.744 1.00 0.00 C ATOM 1617 CG2 VAL A 524 3.733 29.367 -2.513 1.00 0.00 C ATOM 0 H VAL A 524 0.855 29.726 -4.037 1.00 0.00 H new ATOM 0 HA VAL A 524 1.786 31.035 -1.563 1.00 0.00 H new ATOM 0 HB VAL A 524 3.244 30.576 -4.198 1.00 0.00 H new ATOM 0 HG11 VAL A 524 5.186 31.591 -3.079 1.00 0.00 H new ATOM 0 HG12 VAL A 524 3.834 32.738 -3.226 1.00 0.00 H new ATOM 0 HG13 VAL A 524 4.173 31.959 -1.663 1.00 0.00 H new ATOM 0 HG21 VAL A 524 4.751 29.170 -2.850 1.00 0.00 H new ATOM 0 HG22 VAL A 524 3.718 29.437 -1.425 1.00 0.00 H new ATOM 0 HG23 VAL A 524 3.081 28.554 -2.833 1.00 0.00 H new ATOM 1627 N MET A 525 1.228 33.315 -2.368 1.00 0.00 N ATOM 1628 CA MET A 525 0.815 34.646 -2.798 1.00 0.00 C ATOM 1629 C MET A 525 2.010 35.453 -3.296 1.00 0.00 C ATOM 1630 O MET A 525 2.666 36.151 -2.522 1.00 0.00 O ATOM 1631 CB MET A 525 0.129 35.387 -1.648 1.00 0.00 C ATOM 1632 CG MET A 525 -0.882 36.424 -2.110 1.00 0.00 C ATOM 1633 SD MET A 525 -1.214 37.677 -0.856 1.00 0.00 S ATOM 1634 CE MET A 525 -2.718 38.407 -1.498 1.00 0.00 C ATOM 0 H MET A 525 1.395 33.228 -1.366 1.00 0.00 H new ATOM 0 HA MET A 525 0.109 34.531 -3.620 1.00 0.00 H new ATOM 0 HB2 MET A 525 -0.373 34.662 -1.008 1.00 0.00 H new ATOM 0 HB3 MET A 525 0.888 35.878 -1.039 1.00 0.00 H new ATOM 0 HG2 MET A 525 -0.512 36.909 -3.014 1.00 0.00 H new ATOM 0 HG3 MET A 525 -1.814 35.925 -2.375 1.00 0.00 H new ATOM 0 HE1 MET A 525 -3.050 39.202 -0.830 1.00 0.00 H new ATOM 0 HE2 MET A 525 -2.528 38.821 -2.488 1.00 0.00 H new ATOM 0 HE3 MET A 525 -3.493 37.643 -1.567 1.00 0.00 H new ATOM 1644 N ASP A 526 2.288 35.351 -4.591 1.00 0.00 N ATOM 1645 CA ASP A 526 3.405 36.072 -5.192 1.00 0.00 C ATOM 1646 C ASP A 526 2.942 36.882 -6.398 1.00 0.00 C ATOM 1647 O ASP A 526 1.901 36.595 -6.990 1.00 0.00 O ATOM 1648 CB ASP A 526 4.504 35.094 -5.610 1.00 0.00 C ATOM 1649 CG ASP A 526 5.600 35.765 -6.415 1.00 0.00 C ATOM 1650 OD1 ASP A 526 6.474 36.415 -5.803 1.00 0.00 O ATOM 1651 OD2 ASP A 526 5.584 35.641 -7.657 1.00 0.00 O ATOM 0 H ASP A 526 1.756 34.777 -5.245 1.00 0.00 H new ATOM 0 HA ASP A 526 3.805 36.760 -4.447 1.00 0.00 H new ATOM 0 HB2 ASP A 526 4.938 34.638 -4.720 1.00 0.00 H new ATOM 0 HB3 ASP A 526 4.065 34.289 -6.199 1.00 0.00 H new ATOM 1656 N SER A 527 3.721 37.897 -6.757 1.00 0.00 N ATOM 1657 CA SER A 527 3.388 38.753 -7.890 1.00 0.00 C ATOM 1658 C SER A 527 3.308 37.941 -9.179 1.00 0.00 C ATOM 1659 O SER A 527 3.935 36.890 -9.304 1.00 0.00 O ATOM 1660 CB SER A 527 4.428 39.865 -8.039 1.00 0.00 C ATOM 1661 OG SER A 527 4.133 40.957 -7.185 1.00 0.00 O ATOM 0 H SER A 527 4.587 38.147 -6.280 1.00 0.00 H new ATOM 0 HA SER A 527 2.412 39.200 -7.701 1.00 0.00 H new ATOM 0 HB2 SER A 527 5.419 39.474 -7.806 1.00 0.00 H new ATOM 0 HB3 SER A 527 4.455 40.206 -9.074 1.00 0.00 H new ATOM 0 HG SER A 527 4.813 41.653 -7.298 1.00 0.00 H new ATOM 1667 N GLY A 528 2.531 38.438 -10.137 1.00 0.00 N ATOM 1668 CA GLY A 528 2.382 37.746 -11.404 1.00 0.00 C ATOM 1669 C GLY A 528 3.149 38.419 -12.525 1.00 0.00 C ATOM 1670 O GLY A 528 2.681 39.379 -13.138 1.00 0.00 O ATOM 0 H GLY A 528 2.003 39.307 -10.058 1.00 0.00 H new ATOM 0 HA2 GLY A 528 2.729 36.718 -11.296 1.00 0.00 H new ATOM 0 HA3 GLY A 528 1.325 37.700 -11.667 1.00 0.00 H new ATOM 1674 N PRO A 529 4.358 37.911 -12.807 1.00 0.00 N ATOM 1675 CA PRO A 529 5.218 38.455 -13.863 1.00 0.00 C ATOM 1676 C PRO A 529 4.735 38.074 -15.258 1.00 0.00 C ATOM 1677 O PRO A 529 4.991 36.968 -15.734 1.00 0.00 O ATOM 1678 CB PRO A 529 6.579 37.816 -13.576 1.00 0.00 C ATOM 1679 CG PRO A 529 6.258 36.533 -12.890 1.00 0.00 C ATOM 1680 CD PRO A 529 4.979 36.768 -12.118 1.00 0.00 C ATOM 0 HA PRO A 529 5.233 39.545 -13.855 1.00 0.00 H new ATOM 0 HB2 PRO A 529 7.138 37.644 -14.496 1.00 0.00 H new ATOM 0 HB3 PRO A 529 7.193 38.459 -12.946 1.00 0.00 H new ATOM 0 HG2 PRO A 529 6.132 35.727 -13.613 1.00 0.00 H new ATOM 0 HG3 PRO A 529 7.066 36.238 -12.221 1.00 0.00 H new ATOM 0 HD2 PRO A 529 4.333 35.890 -12.137 1.00 0.00 H new ATOM 0 HD3 PRO A 529 5.180 36.993 -11.071 1.00 0.00 H new ATOM 1688 N SER A 530 4.034 38.997 -15.909 1.00 0.00 N ATOM 1689 CA SER A 530 3.512 38.757 -17.249 1.00 0.00 C ATOM 1690 C SER A 530 4.607 38.233 -18.173 1.00 0.00 C ATOM 1691 O SER A 530 5.792 38.479 -17.951 1.00 0.00 O ATOM 1692 CB SER A 530 2.914 40.042 -17.824 1.00 0.00 C ATOM 1693 OG SER A 530 3.915 41.025 -18.025 1.00 0.00 O ATOM 0 H SER A 530 3.815 39.918 -15.530 1.00 0.00 H new ATOM 0 HA SER A 530 2.730 38.001 -17.178 1.00 0.00 H new ATOM 0 HB2 SER A 530 2.418 39.825 -18.770 1.00 0.00 H new ATOM 0 HB3 SER A 530 2.152 40.427 -17.146 1.00 0.00 H new ATOM 0 HG SER A 530 3.508 41.836 -18.395 1.00 0.00 H new ATOM 1699 N SER A 531 4.201 37.509 -19.211 1.00 0.00 N ATOM 1700 CA SER A 531 5.146 36.947 -20.168 1.00 0.00 C ATOM 1701 C SER A 531 6.144 38.004 -20.630 1.00 0.00 C ATOM 1702 O SER A 531 5.760 39.069 -21.112 1.00 0.00 O ATOM 1703 CB SER A 531 4.402 36.370 -21.374 1.00 0.00 C ATOM 1704 OG SER A 531 5.308 35.956 -22.382 1.00 0.00 O ATOM 0 H SER A 531 3.223 37.298 -19.411 1.00 0.00 H new ATOM 0 HA SER A 531 5.694 36.146 -19.672 1.00 0.00 H new ATOM 0 HB2 SER A 531 3.793 35.523 -21.058 1.00 0.00 H new ATOM 0 HB3 SER A 531 3.721 37.119 -21.778 1.00 0.00 H new ATOM 0 HG SER A 531 4.808 35.590 -23.141 1.00 0.00 H new ATOM 1710 N GLY A 532 7.430 37.701 -20.479 1.00 0.00 N ATOM 1711 CA GLY A 532 8.465 38.635 -20.885 1.00 0.00 C ATOM 1712 C GLY A 532 9.207 38.174 -22.124 1.00 0.00 C ATOM 1713 O GLY A 532 9.688 37.042 -22.183 1.00 0.00 O ATOM 0 H GLY A 532 7.774 36.826 -20.083 1.00 0.00 H new ATOM 0 HA2 GLY A 532 8.016 39.610 -21.075 1.00 0.00 H new ATOM 0 HA3 GLY A 532 9.174 38.765 -20.068 1.00 0.00 H new TER 1717 GLY A 532