USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 718 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 Single : A 426 SER OG : rot -159:sc= 0.0542 USER MOD Single : A 428 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 THR OG1 : rot 180:sc=0.000706 USER MOD Single : A 446 SER OG : rot 69:sc= 0.745 USER MOD Single : A 459 HIS : no HE2:sc= -5.41! C(o=-5.4!,f=-6.6!) USER MOD Single : A 460 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.124) USER MOD Single : A 463 SER OG : rot 180:sc= -0.0792 USER MOD Single : A 464 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0169) USER MOD Single : A 465 SER OG : rot 180:sc= 0 USER MOD Single : A 466 TYR OH : rot 118:sc= 0.872 USER MOD Single : A 470 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 472 TYR OH : rot 180:sc= -0.637 USER MOD Single : A 478 GLN : amide:sc= -0.256 X(o=-0.26,f=-0.26) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot -79:sc= 0.66 USER MOD Single : A 484 GLN : amide:sc= 0 X(o=0,f=-0.081) USER MOD Single : A 490 CYS SG : rot 57:sc= 0.214 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 TYR OH : rot 30:sc= -0.813 USER MOD Single : A 500 CYS SG : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 180:sc= 0.00964 USER MOD Single : A 503 SER OG : rot 100:sc= -0.775 USER MOD Single : A 505 THR OG1 : rot -140:sc= 0.00291 USER MOD Single : A 507 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 509 LYS NZ :NH3+ -129:sc= -0.203 (180deg=-6.04!) USER MOD Single : A 512 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD ----------------------------------------------------------------- ATOM 66 N SER A 426 -4.499 12.175 -3.507 1.00 0.00 N ATOM 67 CA SER A 426 -3.330 11.653 -2.809 1.00 0.00 C ATOM 68 C SER A 426 -2.881 10.327 -3.416 1.00 0.00 C ATOM 69 O SER A 426 -3.700 9.546 -3.901 1.00 0.00 O ATOM 70 CB SER A 426 -3.638 11.468 -1.322 1.00 0.00 C ATOM 71 OG SER A 426 -3.345 12.645 -0.590 1.00 0.00 O ATOM 0 HA SER A 426 -2.521 12.375 -2.918 1.00 0.00 H new ATOM 0 HB2 SER A 426 -4.689 11.209 -1.195 1.00 0.00 H new ATOM 0 HB3 SER A 426 -3.055 10.636 -0.927 1.00 0.00 H new ATOM 0 HG SER A 426 -3.224 12.420 0.356 1.00 0.00 H new ATOM 77 N ARG A 427 -1.576 10.081 -3.386 1.00 0.00 N ATOM 78 CA ARG A 427 -1.017 8.851 -3.934 1.00 0.00 C ATOM 79 C ARG A 427 -0.840 7.801 -2.842 1.00 0.00 C ATOM 80 O ARG A 427 -1.189 6.634 -3.025 1.00 0.00 O ATOM 81 CB ARG A 427 0.327 9.133 -4.609 1.00 0.00 C ATOM 82 CG ARG A 427 0.198 9.635 -6.038 1.00 0.00 C ATOM 83 CD ARG A 427 1.555 9.740 -6.716 1.00 0.00 C ATOM 84 NE ARG A 427 2.186 11.035 -6.480 1.00 0.00 N ATOM 85 CZ ARG A 427 2.903 11.316 -5.398 1.00 0.00 C ATOM 86 NH1 ARG A 427 3.079 10.398 -4.457 1.00 0.00 N ATOM 87 NH2 ARG A 427 3.447 12.518 -5.254 1.00 0.00 N ATOM 0 H ARG A 427 -0.885 10.717 -2.988 1.00 0.00 H new ATOM 0 HA ARG A 427 -1.714 8.463 -4.677 1.00 0.00 H new ATOM 0 HB2 ARG A 427 0.871 9.872 -4.021 1.00 0.00 H new ATOM 0 HB3 ARG A 427 0.924 8.221 -4.606 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -0.442 8.960 -6.606 1.00 0.00 H new ATOM 0 HG3 ARG A 427 -0.287 10.611 -6.040 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.206 8.947 -6.348 1.00 0.00 H new ATOM 0 HD3 ARG A 427 1.437 9.584 -7.788 1.00 0.00 H new ATOM 0 HE ARG A 427 2.070 11.764 -7.184 1.00 0.00 H new ATOM 0 HH11 ARG A 427 2.663 9.473 -4.563 1.00 0.00 H new ATOM 0 HH12 ARG A 427 3.630 10.617 -3.627 1.00 0.00 H new ATOM 0 HH21 ARG A 427 3.315 13.227 -5.975 1.00 0.00 H new ATOM 0 HH22 ARG A 427 3.997 12.732 -4.422 1.00 0.00 H new ATOM 101 N LYS A 428 -0.295 8.222 -1.706 1.00 0.00 N ATOM 102 CA LYS A 428 -0.072 7.319 -0.583 1.00 0.00 C ATOM 103 C LYS A 428 -1.347 6.558 -0.235 1.00 0.00 C ATOM 104 O LYS A 428 -2.410 7.154 -0.060 1.00 0.00 O ATOM 105 CB LYS A 428 0.417 8.101 0.638 1.00 0.00 C ATOM 106 CG LYS A 428 1.922 8.304 0.668 1.00 0.00 C ATOM 107 CD LYS A 428 2.372 8.951 1.968 1.00 0.00 C ATOM 108 CE LYS A 428 3.798 9.471 1.867 1.00 0.00 C ATOM 109 NZ LYS A 428 4.191 10.247 3.075 1.00 0.00 N ATOM 0 H LYS A 428 0.001 9.184 -1.538 1.00 0.00 H new ATOM 0 HA LYS A 428 0.692 6.598 -0.875 1.00 0.00 H new ATOM 0 HB2 LYS A 428 -0.073 9.075 0.655 1.00 0.00 H new ATOM 0 HB3 LYS A 428 0.112 7.574 1.542 1.00 0.00 H new ATOM 0 HG2 LYS A 428 2.422 7.343 0.547 1.00 0.00 H new ATOM 0 HG3 LYS A 428 2.223 8.928 -0.173 1.00 0.00 H new ATOM 0 HD2 LYS A 428 1.701 9.773 2.218 1.00 0.00 H new ATOM 0 HD3 LYS A 428 2.304 8.226 2.779 1.00 0.00 H new ATOM 0 HE2 LYS A 428 4.482 8.633 1.735 1.00 0.00 H new ATOM 0 HE3 LYS A 428 3.893 10.102 0.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 5.169 10.584 2.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 3.554 11.062 3.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 4.125 9.638 3.915 1.00 0.00 H new ATOM 123 N VAL A 429 -1.233 5.237 -0.134 1.00 0.00 N ATOM 124 CA VAL A 429 -2.377 4.394 0.196 1.00 0.00 C ATOM 125 C VAL A 429 -2.065 3.484 1.378 1.00 0.00 C ATOM 126 O VAL A 429 -1.101 2.719 1.350 1.00 0.00 O ATOM 127 CB VAL A 429 -2.802 3.529 -1.006 1.00 0.00 C ATOM 128 CG1 VAL A 429 -4.056 2.736 -0.675 1.00 0.00 C ATOM 129 CG2 VAL A 429 -3.018 4.397 -2.236 1.00 0.00 C ATOM 0 H VAL A 429 -0.361 4.728 -0.276 1.00 0.00 H new ATOM 0 HA VAL A 429 -3.197 5.062 0.461 1.00 0.00 H new ATOM 0 HB VAL A 429 -2.002 2.822 -1.225 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.342 2.131 -1.535 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.861 2.085 0.177 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.866 3.422 -0.429 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.318 3.770 -3.076 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.800 5.129 -2.032 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -2.091 4.915 -2.483 1.00 0.00 H new ATOM 139 N PHE A 430 -2.889 3.572 2.418 1.00 0.00 N ATOM 140 CA PHE A 430 -2.701 2.756 3.612 1.00 0.00 C ATOM 141 C PHE A 430 -3.370 1.394 3.451 1.00 0.00 C ATOM 142 O PHE A 430 -4.561 1.306 3.153 1.00 0.00 O ATOM 143 CB PHE A 430 -3.269 3.473 4.839 1.00 0.00 C ATOM 144 CG PHE A 430 -3.488 2.566 6.016 1.00 0.00 C ATOM 145 CD1 PHE A 430 -2.426 2.183 6.819 1.00 0.00 C ATOM 146 CD2 PHE A 430 -4.756 2.096 6.318 1.00 0.00 C ATOM 147 CE1 PHE A 430 -2.625 1.347 7.902 1.00 0.00 C ATOM 148 CE2 PHE A 430 -4.961 1.260 7.400 1.00 0.00 C ATOM 149 CZ PHE A 430 -3.894 0.886 8.194 1.00 0.00 C ATOM 0 H PHE A 430 -3.692 4.199 2.458 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.631 2.602 3.752 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.589 4.274 5.129 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -4.216 3.941 4.570 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.432 2.541 6.597 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -5.594 2.386 5.701 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -1.789 1.054 8.519 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -5.954 0.900 7.624 1.00 0.00 H new ATOM 0 HZ PHE A 430 -4.052 0.235 9.041 1.00 0.00 H new ATOM 159 N VAL A 431 -2.593 0.334 3.650 1.00 0.00 N ATOM 160 CA VAL A 431 -3.109 -1.025 3.528 1.00 0.00 C ATOM 161 C VAL A 431 -2.939 -1.797 4.831 1.00 0.00 C ATOM 162 O VAL A 431 -1.821 -2.103 5.242 1.00 0.00 O ATOM 163 CB VAL A 431 -2.404 -1.792 2.394 1.00 0.00 C ATOM 164 CG1 VAL A 431 -2.985 -3.191 2.254 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.514 -1.027 1.084 1.00 0.00 C ATOM 0 H VAL A 431 -1.605 0.390 3.896 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.171 -0.941 3.295 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.348 -1.886 2.645 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.475 -3.718 1.448 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -2.849 -3.737 3.188 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.049 -3.122 2.026 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -2.010 -1.584 0.294 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -3.565 -0.899 0.824 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -2.046 -0.049 1.193 1.00 0.00 H new ATOM 175 N GLY A 432 -4.058 -2.109 5.478 1.00 0.00 N ATOM 176 CA GLY A 432 -4.011 -2.843 6.729 1.00 0.00 C ATOM 177 C GLY A 432 -4.715 -4.183 6.641 1.00 0.00 C ATOM 178 O GLY A 432 -5.912 -4.247 6.366 1.00 0.00 O ATOM 0 H GLY A 432 -4.996 -1.867 5.158 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -2.971 -3.000 7.016 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.471 -2.245 7.515 1.00 0.00 H new ATOM 182 N GLY A 433 -3.968 -5.258 6.875 1.00 0.00 N ATOM 183 CA GLY A 433 -4.544 -6.589 6.815 1.00 0.00 C ATOM 184 C GLY A 433 -3.871 -7.465 5.777 1.00 0.00 C ATOM 185 O GLY A 433 -4.523 -8.284 5.127 1.00 0.00 O ATOM 0 H GLY A 433 -2.975 -5.231 7.105 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.462 -7.062 7.794 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.607 -6.512 6.587 1.00 0.00 H new ATOM 189 N LEU A 434 -2.563 -7.294 5.619 1.00 0.00 N ATOM 190 CA LEU A 434 -1.801 -8.075 4.651 1.00 0.00 C ATOM 191 C LEU A 434 -1.436 -9.442 5.221 1.00 0.00 C ATOM 192 O LEU A 434 -1.123 -9.586 6.404 1.00 0.00 O ATOM 193 CB LEU A 434 -0.532 -7.323 4.246 1.00 0.00 C ATOM 194 CG LEU A 434 -0.731 -6.112 3.335 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.514 -5.238 3.328 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.079 -6.559 1.922 1.00 0.00 C ATOM 0 H LEU A 434 -2.008 -6.622 6.149 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.425 -8.224 3.770 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.026 -6.991 5.152 1.00 0.00 H new ATOM 0 HB3 LEU A 434 0.137 -8.023 3.745 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.561 -5.522 3.723 1.00 0.00 H new ATOM 0 HD11 LEU A 434 0.353 -4.381 2.674 1.00 0.00 H new ATOM 0 HD12 LEU A 434 0.719 -4.889 4.340 1.00 0.00 H new ATOM 0 HD13 LEU A 434 1.363 -5.817 2.965 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.217 -5.684 1.287 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.270 -7.172 1.524 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -2.000 -7.142 1.941 1.00 0.00 H new ATOM 208 N PRO A 435 -1.473 -10.471 4.362 1.00 0.00 N ATOM 209 CA PRO A 435 -1.147 -11.845 4.757 1.00 0.00 C ATOM 210 C PRO A 435 0.150 -11.925 5.556 1.00 0.00 C ATOM 211 O PRO A 435 1.093 -11.166 5.333 1.00 0.00 O ATOM 212 CB PRO A 435 -0.997 -12.572 3.419 1.00 0.00 C ATOM 213 CG PRO A 435 -1.863 -11.812 2.475 1.00 0.00 C ATOM 214 CD PRO A 435 -1.837 -10.373 2.939 1.00 0.00 C ATOM 0 HA PRO A 435 -1.909 -12.275 5.408 1.00 0.00 H new ATOM 0 HB2 PRO A 435 0.041 -12.578 3.086 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -1.313 -13.612 3.496 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.493 -11.898 1.453 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -2.880 -12.204 2.480 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -1.110 -9.785 2.379 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -2.806 -9.892 2.806 1.00 0.00 H new ATOM 222 N PRO A 436 0.201 -12.868 6.509 1.00 0.00 N ATOM 223 CA PRO A 436 1.378 -13.071 7.359 1.00 0.00 C ATOM 224 C PRO A 436 2.478 -13.852 6.649 1.00 0.00 C ATOM 225 O PRO A 436 3.534 -14.116 7.224 1.00 0.00 O ATOM 226 CB PRO A 436 0.828 -13.875 8.540 1.00 0.00 C ATOM 227 CG PRO A 436 -0.335 -14.620 7.982 1.00 0.00 C ATOM 228 CD PRO A 436 -0.886 -13.808 6.829 1.00 0.00 C ATOM 0 HA PRO A 436 1.841 -12.127 7.647 1.00 0.00 H new ATOM 0 HB2 PRO A 436 1.580 -14.556 8.940 1.00 0.00 H new ATOM 0 HB3 PRO A 436 0.524 -13.221 9.357 1.00 0.00 H new ATOM 0 HG2 PRO A 436 -0.029 -15.609 7.642 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -1.098 -14.767 8.746 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -1.132 -14.440 5.976 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -1.799 -13.283 7.110 1.00 0.00 H new ATOM 236 N ASP A 437 2.224 -14.218 5.398 1.00 0.00 N ATOM 237 CA ASP A 437 3.195 -14.967 4.608 1.00 0.00 C ATOM 238 C ASP A 437 3.435 -14.294 3.261 1.00 0.00 C ATOM 239 O ASP A 437 3.739 -14.959 2.269 1.00 0.00 O ATOM 240 CB ASP A 437 2.712 -16.403 4.397 1.00 0.00 C ATOM 241 CG ASP A 437 3.055 -17.307 5.564 1.00 0.00 C ATOM 242 OD1 ASP A 437 2.361 -17.229 6.600 1.00 0.00 O ATOM 243 OD2 ASP A 437 4.017 -18.093 5.443 1.00 0.00 O ATOM 0 H ASP A 437 1.354 -14.008 4.909 1.00 0.00 H new ATOM 0 HA ASP A 437 4.137 -14.985 5.156 1.00 0.00 H new ATOM 0 HB2 ASP A 437 1.632 -16.402 4.247 1.00 0.00 H new ATOM 0 HB3 ASP A 437 3.159 -16.804 3.487 1.00 0.00 H new ATOM 248 N ILE A 438 3.296 -12.973 3.231 1.00 0.00 N ATOM 249 CA ILE A 438 3.498 -12.211 2.005 1.00 0.00 C ATOM 250 C ILE A 438 4.766 -11.368 2.085 1.00 0.00 C ATOM 251 O ILE A 438 5.097 -10.824 3.139 1.00 0.00 O ATOM 252 CB ILE A 438 2.300 -11.290 1.711 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.402 -10.720 0.295 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.231 -10.168 2.736 1.00 0.00 C ATOM 255 CD1 ILE A 438 1.094 -10.175 -0.233 1.00 0.00 C ATOM 0 H ILE A 438 3.044 -12.408 4.042 1.00 0.00 H new ATOM 0 HA ILE A 438 3.596 -12.935 1.196 1.00 0.00 H new ATOM 0 HB ILE A 438 1.384 -11.877 1.781 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.148 -9.925 0.285 1.00 0.00 H new ATOM 0 HG13 ILE A 438 2.759 -11.500 -0.377 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.379 -9.525 2.515 1.00 0.00 H new ATOM 0 HG22 ILE A 438 2.116 -10.593 3.733 1.00 0.00 H new ATOM 0 HG23 ILE A 438 3.149 -9.581 2.695 1.00 0.00 H new ATOM 0 HD11 ILE A 438 1.242 -9.788 -1.241 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.351 -10.972 -0.256 1.00 0.00 H new ATOM 0 HD13 ILE A 438 0.746 -9.372 0.417 1.00 0.00 H new ATOM 267 N ASP A 439 5.471 -11.262 0.964 1.00 0.00 N ATOM 268 CA ASP A 439 6.702 -10.482 0.905 1.00 0.00 C ATOM 269 C ASP A 439 6.499 -9.207 0.093 1.00 0.00 C ATOM 270 O ASP A 439 5.403 -8.943 -0.401 1.00 0.00 O ATOM 271 CB ASP A 439 7.830 -11.315 0.296 1.00 0.00 C ATOM 272 CG ASP A 439 7.412 -12.008 -0.986 1.00 0.00 C ATOM 273 OD1 ASP A 439 7.414 -11.348 -2.046 1.00 0.00 O ATOM 274 OD2 ASP A 439 7.082 -13.211 -0.929 1.00 0.00 O ATOM 0 H ASP A 439 5.211 -11.707 0.084 1.00 0.00 H new ATOM 0 HA ASP A 439 6.976 -10.203 1.923 1.00 0.00 H new ATOM 0 HB2 ASP A 439 8.686 -10.670 0.095 1.00 0.00 H new ATOM 0 HB3 ASP A 439 8.157 -12.062 1.019 1.00 0.00 H new ATOM 279 N GLU A 440 7.562 -8.420 -0.040 1.00 0.00 N ATOM 280 CA GLU A 440 7.499 -7.172 -0.791 1.00 0.00 C ATOM 281 C GLU A 440 6.910 -7.402 -2.180 1.00 0.00 C ATOM 282 O GLU A 440 5.795 -6.969 -2.473 1.00 0.00 O ATOM 283 CB GLU A 440 8.893 -6.552 -0.912 1.00 0.00 C ATOM 284 CG GLU A 440 8.877 -5.102 -1.365 1.00 0.00 C ATOM 285 CD GLU A 440 10.240 -4.445 -1.266 1.00 0.00 C ATOM 286 OE1 GLU A 440 11.237 -5.086 -1.661 1.00 0.00 O ATOM 287 OE2 GLU A 440 10.310 -3.291 -0.794 1.00 0.00 O ATOM 0 H GLU A 440 8.477 -8.625 0.362 1.00 0.00 H new ATOM 0 HA GLU A 440 6.850 -6.484 -0.249 1.00 0.00 H new ATOM 0 HB2 GLU A 440 9.395 -6.617 0.053 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.482 -7.138 -1.618 1.00 0.00 H new ATOM 0 HG2 GLU A 440 8.527 -5.051 -2.396 1.00 0.00 H new ATOM 0 HG3 GLU A 440 8.164 -4.544 -0.759 1.00 0.00 H new ATOM 294 N ASP A 441 7.668 -8.084 -3.031 1.00 0.00 N ATOM 295 CA ASP A 441 7.222 -8.373 -4.390 1.00 0.00 C ATOM 296 C ASP A 441 5.724 -8.657 -4.421 1.00 0.00 C ATOM 297 O ASP A 441 4.950 -7.891 -4.994 1.00 0.00 O ATOM 298 CB ASP A 441 7.992 -9.565 -4.959 1.00 0.00 C ATOM 299 CG ASP A 441 7.870 -9.666 -6.467 1.00 0.00 C ATOM 300 OD1 ASP A 441 7.865 -8.611 -7.133 1.00 0.00 O ATOM 301 OD2 ASP A 441 7.779 -10.801 -6.980 1.00 0.00 O ATOM 0 H ASP A 441 8.594 -8.447 -2.805 1.00 0.00 H new ATOM 0 HA ASP A 441 7.420 -7.496 -5.006 1.00 0.00 H new ATOM 0 HB2 ASP A 441 9.044 -9.477 -4.687 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.621 -10.484 -4.505 1.00 0.00 H new ATOM 306 N GLU A 442 5.323 -9.763 -3.803 1.00 0.00 N ATOM 307 CA GLU A 442 3.917 -10.149 -3.762 1.00 0.00 C ATOM 308 C GLU A 442 3.019 -8.919 -3.667 1.00 0.00 C ATOM 309 O GLU A 442 2.205 -8.662 -4.555 1.00 0.00 O ATOM 310 CB GLU A 442 3.655 -11.079 -2.577 1.00 0.00 C ATOM 311 CG GLU A 442 4.364 -12.419 -2.685 1.00 0.00 C ATOM 312 CD GLU A 442 3.612 -13.535 -1.986 1.00 0.00 C ATOM 313 OE1 GLU A 442 2.381 -13.629 -2.174 1.00 0.00 O ATOM 314 OE2 GLU A 442 4.254 -14.314 -1.252 1.00 0.00 O ATOM 0 H GLU A 442 5.952 -10.408 -3.324 1.00 0.00 H new ATOM 0 HA GLU A 442 3.684 -10.677 -4.686 1.00 0.00 H new ATOM 0 HB2 GLU A 442 3.972 -10.583 -1.660 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.582 -11.251 -2.492 1.00 0.00 H new ATOM 0 HG2 GLU A 442 4.491 -12.675 -3.737 1.00 0.00 H new ATOM 0 HG3 GLU A 442 5.362 -12.333 -2.255 1.00 0.00 H new ATOM 321 N ILE A 443 3.172 -8.164 -2.584 1.00 0.00 N ATOM 322 CA ILE A 443 2.375 -6.962 -2.373 1.00 0.00 C ATOM 323 C ILE A 443 2.339 -6.099 -3.629 1.00 0.00 C ATOM 324 O ILE A 443 1.285 -5.597 -4.022 1.00 0.00 O ATOM 325 CB ILE A 443 2.922 -6.123 -1.203 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.904 -6.940 0.091 1.00 0.00 C ATOM 327 CG2 ILE A 443 2.109 -4.847 -1.041 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.686 -6.304 1.218 1.00 0.00 C ATOM 0 H ILE A 443 3.840 -8.363 -1.840 1.00 0.00 H new ATOM 0 HA ILE A 443 1.364 -7.291 -2.132 1.00 0.00 H new ATOM 0 HB ILE A 443 3.954 -5.848 -1.423 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.871 -7.078 0.409 1.00 0.00 H new ATOM 0 HG13 ILE A 443 3.311 -7.931 -0.109 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.508 -4.265 -0.210 1.00 0.00 H new ATOM 0 HG22 ILE A 443 2.168 -4.259 -1.957 1.00 0.00 H new ATOM 0 HG23 ILE A 443 1.069 -5.102 -0.839 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.629 -6.938 2.103 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.728 -6.191 0.919 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.265 -5.325 1.445 1.00 0.00 H new ATOM 340 N THR A 444 3.498 -5.930 -4.259 1.00 0.00 N ATOM 341 CA THR A 444 3.599 -5.128 -5.471 1.00 0.00 C ATOM 342 C THR A 444 2.705 -5.684 -6.574 1.00 0.00 C ATOM 343 O THR A 444 1.807 -4.998 -7.063 1.00 0.00 O ATOM 344 CB THR A 444 5.050 -5.067 -5.985 1.00 0.00 C ATOM 345 OG1 THR A 444 5.949 -4.863 -4.889 1.00 0.00 O ATOM 346 CG2 THR A 444 5.218 -3.947 -7.000 1.00 0.00 C ATOM 0 H THR A 444 4.380 -6.338 -3.949 1.00 0.00 H new ATOM 0 HA THR A 444 3.270 -4.122 -5.212 1.00 0.00 H new ATOM 0 HB THR A 444 5.280 -6.015 -6.472 1.00 0.00 H new ATOM 0 HG1 THR A 444 6.870 -4.827 -5.223 1.00 0.00 H new ATOM 0 HG21 THR A 444 6.251 -3.924 -7.348 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.553 -4.120 -7.846 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.971 -2.993 -6.534 1.00 0.00 H new ATOM 354 N ALA A 445 2.957 -6.930 -6.962 1.00 0.00 N ATOM 355 CA ALA A 445 2.172 -7.578 -8.006 1.00 0.00 C ATOM 356 C ALA A 445 0.680 -7.494 -7.703 1.00 0.00 C ATOM 357 O ALA A 445 -0.149 -7.500 -8.613 1.00 0.00 O ATOM 358 CB ALA A 445 2.599 -9.030 -8.162 1.00 0.00 C ATOM 0 H ALA A 445 3.698 -7.511 -6.569 1.00 0.00 H new ATOM 0 HA ALA A 445 2.356 -7.053 -8.943 1.00 0.00 H new ATOM 0 HB1 ALA A 445 2.005 -9.502 -8.945 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.654 -9.072 -8.432 1.00 0.00 H new ATOM 0 HB3 ALA A 445 2.444 -9.558 -7.221 1.00 0.00 H new ATOM 364 N SER A 446 0.344 -7.415 -6.419 1.00 0.00 N ATOM 365 CA SER A 446 -1.049 -7.334 -5.997 1.00 0.00 C ATOM 366 C SER A 446 -1.656 -5.988 -6.381 1.00 0.00 C ATOM 367 O SER A 446 -2.869 -5.866 -6.551 1.00 0.00 O ATOM 368 CB SER A 446 -1.159 -7.543 -4.486 1.00 0.00 C ATOM 369 OG SER A 446 -0.660 -8.815 -4.109 1.00 0.00 O ATOM 0 H SER A 446 1.018 -7.405 -5.653 1.00 0.00 H new ATOM 0 HA SER A 446 -1.604 -8.122 -6.507 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.603 -6.762 -3.966 1.00 0.00 H new ATOM 0 HB3 SER A 446 -2.201 -7.452 -4.178 1.00 0.00 H new ATOM 0 HG SER A 446 0.311 -8.836 -4.236 1.00 0.00 H new ATOM 375 N PHE A 447 -0.802 -4.978 -6.515 1.00 0.00 N ATOM 376 CA PHE A 447 -1.252 -3.640 -6.878 1.00 0.00 C ATOM 377 C PHE A 447 -0.492 -3.121 -8.096 1.00 0.00 C ATOM 378 O PHE A 447 -0.348 -1.913 -8.282 1.00 0.00 O ATOM 379 CB PHE A 447 -1.067 -2.680 -5.701 1.00 0.00 C ATOM 380 CG PHE A 447 -1.938 -3.004 -4.521 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.672 -4.111 -3.731 1.00 0.00 C ATOM 382 CD2 PHE A 447 -3.021 -2.202 -4.201 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.471 -4.412 -2.644 1.00 0.00 C ATOM 384 CE2 PHE A 447 -3.824 -2.498 -3.115 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.548 -3.604 -2.336 1.00 0.00 C ATOM 0 H PHE A 447 0.205 -5.061 -6.378 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.311 -3.696 -7.130 1.00 0.00 H new ATOM 0 HB2 PHE A 447 -0.023 -2.699 -5.388 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.282 -1.664 -6.033 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.831 -4.746 -3.967 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.241 -1.335 -4.807 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -2.253 -5.278 -2.036 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -4.666 -1.865 -2.876 1.00 0.00 H new ATOM 0 HZ PHE A 447 -4.173 -3.837 -1.487 1.00 0.00 H new ATOM 395 N ARG A 448 -0.008 -4.044 -8.920 1.00 0.00 N ATOM 396 CA ARG A 448 0.739 -3.682 -10.119 1.00 0.00 C ATOM 397 C ARG A 448 -0.207 -3.358 -11.272 1.00 0.00 C ATOM 398 O ARG A 448 -0.068 -2.328 -11.931 1.00 0.00 O ATOM 399 CB ARG A 448 1.681 -4.818 -10.521 1.00 0.00 C ATOM 400 CG ARG A 448 3.063 -4.713 -9.897 1.00 0.00 C ATOM 401 CD ARG A 448 3.911 -3.661 -10.594 1.00 0.00 C ATOM 402 NE ARG A 448 5.334 -3.983 -10.542 1.00 0.00 N ATOM 403 CZ ARG A 448 6.254 -3.370 -11.279 1.00 0.00 C ATOM 404 NH1 ARG A 448 5.901 -2.408 -12.121 1.00 0.00 N ATOM 405 NH2 ARG A 448 7.530 -3.719 -11.176 1.00 0.00 N ATOM 0 H ARG A 448 -0.120 -5.048 -8.780 1.00 0.00 H new ATOM 0 HA ARG A 448 1.328 -2.793 -9.895 1.00 0.00 H new ATOM 0 HB2 ARG A 448 1.233 -5.769 -10.233 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.782 -4.828 -11.606 1.00 0.00 H new ATOM 0 HG2 ARG A 448 2.968 -4.464 -8.840 1.00 0.00 H new ATOM 0 HG3 ARG A 448 3.563 -5.680 -9.953 1.00 0.00 H new ATOM 0 HD2 ARG A 448 3.597 -3.573 -11.634 1.00 0.00 H new ATOM 0 HD3 ARG A 448 3.742 -2.691 -10.127 1.00 0.00 H new ATOM 0 HE ARG A 448 5.639 -4.719 -9.905 1.00 0.00 H new ATOM 0 HH11 ARG A 448 4.921 -2.137 -12.204 1.00 0.00 H new ATOM 0 HH12 ARG A 448 6.609 -1.939 -12.686 1.00 0.00 H new ATOM 0 HH21 ARG A 448 7.806 -4.459 -10.530 1.00 0.00 H new ATOM 0 HH22 ARG A 448 8.235 -3.247 -11.743 1.00 0.00 H new ATOM 419 N ARG A 449 -1.168 -4.245 -11.509 1.00 0.00 N ATOM 420 CA ARG A 449 -2.135 -4.055 -12.583 1.00 0.00 C ATOM 421 C ARG A 449 -2.537 -2.588 -12.699 1.00 0.00 C ATOM 422 O ARG A 449 -2.725 -2.070 -13.800 1.00 0.00 O ATOM 423 CB ARG A 449 -3.375 -4.917 -12.340 1.00 0.00 C ATOM 424 CG ARG A 449 -3.891 -4.853 -10.911 1.00 0.00 C ATOM 425 CD ARG A 449 -4.585 -6.146 -10.511 1.00 0.00 C ATOM 426 NE ARG A 449 -5.816 -6.362 -11.266 1.00 0.00 N ATOM 427 CZ ARG A 449 -6.691 -7.322 -10.985 1.00 0.00 C ATOM 428 NH1 ARG A 449 -6.472 -8.147 -9.971 1.00 0.00 N ATOM 429 NH2 ARG A 449 -7.789 -7.455 -11.718 1.00 0.00 N ATOM 0 H ARG A 449 -1.297 -5.102 -10.972 1.00 0.00 H new ATOM 0 HA ARG A 449 -1.666 -4.361 -13.518 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -4.167 -4.599 -13.018 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -3.141 -5.953 -12.587 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -3.061 -4.659 -10.232 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -4.586 -4.020 -10.811 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -3.909 -6.985 -10.672 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -4.813 -6.121 -9.445 1.00 0.00 H new ATOM 0 HE ARG A 449 -6.015 -5.743 -12.052 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -5.630 -8.046 -9.404 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -7.145 -8.883 -9.758 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -7.962 -6.820 -12.498 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -8.460 -8.192 -11.502 1.00 0.00 H new ATOM 443 N PHE A 450 -2.668 -1.924 -11.556 1.00 0.00 N ATOM 444 CA PHE A 450 -3.050 -0.516 -11.529 1.00 0.00 C ATOM 445 C PHE A 450 -1.957 0.355 -12.141 1.00 0.00 C ATOM 446 O PHE A 450 -2.240 1.289 -12.890 1.00 0.00 O ATOM 447 CB PHE A 450 -3.329 -0.069 -10.092 1.00 0.00 C ATOM 448 CG PHE A 450 -4.284 -0.968 -9.360 1.00 0.00 C ATOM 449 CD1 PHE A 450 -5.643 -0.920 -9.624 1.00 0.00 C ATOM 450 CD2 PHE A 450 -3.822 -1.862 -8.407 1.00 0.00 C ATOM 451 CE1 PHE A 450 -6.523 -1.745 -8.951 1.00 0.00 C ATOM 452 CE2 PHE A 450 -4.697 -2.690 -7.731 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.050 -2.632 -8.004 1.00 0.00 C ATOM 0 H PHE A 450 -2.515 -2.337 -10.636 1.00 0.00 H new ATOM 0 HA PHE A 450 -3.958 -0.400 -12.121 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.388 -0.028 -9.543 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -3.734 0.943 -10.107 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.019 -0.230 -10.365 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -2.765 -1.912 -8.190 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -7.580 -1.696 -9.165 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -4.324 -3.382 -6.990 1.00 0.00 H new ATOM 0 HZ PHE A 450 -6.736 -3.279 -7.478 1.00 0.00 H new ATOM 463 N GLY A 451 -0.707 0.042 -11.815 1.00 0.00 N ATOM 464 CA GLY A 451 0.410 0.806 -12.341 1.00 0.00 C ATOM 465 C GLY A 451 1.627 0.748 -11.439 1.00 0.00 C ATOM 466 O GLY A 451 1.536 0.412 -10.258 1.00 0.00 O ATOM 0 H GLY A 451 -0.447 -0.726 -11.196 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.674 0.425 -13.328 1.00 0.00 H new ATOM 0 HA3 GLY A 451 0.107 1.845 -12.471 1.00 0.00 H new ATOM 470 N PRO A 452 2.800 1.079 -12.000 1.00 0.00 N ATOM 471 CA PRO A 452 4.063 1.069 -11.257 1.00 0.00 C ATOM 472 C PRO A 452 3.938 1.737 -9.891 1.00 0.00 C ATOM 473 O PRO A 452 3.548 2.901 -9.791 1.00 0.00 O ATOM 474 CB PRO A 452 5.010 1.867 -12.156 1.00 0.00 C ATOM 475 CG PRO A 452 4.479 1.671 -13.534 1.00 0.00 C ATOM 476 CD PRO A 452 2.983 1.488 -13.403 1.00 0.00 C ATOM 0 HA PRO A 452 4.404 0.055 -11.048 1.00 0.00 H new ATOM 0 HB2 PRO A 452 5.021 2.922 -11.882 1.00 0.00 H new ATOM 0 HB3 PRO A 452 6.035 1.505 -12.071 1.00 0.00 H new ATOM 0 HG2 PRO A 452 4.710 2.531 -14.163 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.935 0.800 -14.004 1.00 0.00 H new ATOM 0 HD2 PRO A 452 2.446 2.411 -13.624 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.611 0.730 -14.092 1.00 0.00 H new ATOM 484 N LEU A 453 4.270 0.993 -8.842 1.00 0.00 N ATOM 485 CA LEU A 453 4.195 1.514 -7.481 1.00 0.00 C ATOM 486 C LEU A 453 5.324 0.955 -6.621 1.00 0.00 C ATOM 487 O LEU A 453 6.194 0.236 -7.112 1.00 0.00 O ATOM 488 CB LEU A 453 2.843 1.167 -6.855 1.00 0.00 C ATOM 489 CG LEU A 453 2.697 -0.258 -6.320 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.504 -0.357 -5.382 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.559 -1.248 -7.468 1.00 0.00 C ATOM 0 H LEU A 453 4.594 0.028 -8.907 1.00 0.00 H new ATOM 0 HA LEU A 453 4.300 2.598 -7.527 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.655 1.862 -6.037 1.00 0.00 H new ATOM 0 HB3 LEU A 453 2.066 1.335 -7.601 1.00 0.00 H new ATOM 0 HG LEU A 453 3.597 -0.508 -5.758 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.416 -1.378 -5.011 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.644 0.323 -4.542 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.595 -0.087 -5.920 1.00 0.00 H new ATOM 0 HD21 LEU A 453 2.456 -2.257 -7.068 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.677 -1.000 -8.058 1.00 0.00 H new ATOM 0 HD23 LEU A 453 3.445 -1.197 -8.101 1.00 0.00 H new ATOM 503 N VAL A 454 5.303 1.290 -5.335 1.00 0.00 N ATOM 504 CA VAL A 454 6.323 0.820 -4.406 1.00 0.00 C ATOM 505 C VAL A 454 5.737 0.589 -3.017 1.00 0.00 C ATOM 506 O VAL A 454 4.829 1.301 -2.588 1.00 0.00 O ATOM 507 CB VAL A 454 7.489 1.821 -4.299 1.00 0.00 C ATOM 508 CG1 VAL A 454 6.965 3.227 -4.051 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.452 1.400 -3.199 1.00 0.00 C ATOM 0 H VAL A 454 4.590 1.885 -4.913 1.00 0.00 H new ATOM 0 HA VAL A 454 6.699 -0.124 -4.800 1.00 0.00 H new ATOM 0 HB VAL A 454 8.031 1.823 -5.244 1.00 0.00 H new ATOM 0 HG11 VAL A 454 7.803 3.920 -3.978 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.318 3.525 -4.876 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.398 3.245 -3.121 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.270 2.118 -3.137 1.00 0.00 H new ATOM 0 HG22 VAL A 454 7.924 1.368 -2.246 1.00 0.00 H new ATOM 0 HG23 VAL A 454 8.853 0.412 -3.425 1.00 0.00 H new ATOM 519 N VAL A 455 6.264 -0.412 -2.318 1.00 0.00 N ATOM 520 CA VAL A 455 5.794 -0.736 -0.976 1.00 0.00 C ATOM 521 C VAL A 455 6.780 -0.255 0.082 1.00 0.00 C ATOM 522 O VAL A 455 7.976 -0.538 0.006 1.00 0.00 O ATOM 523 CB VAL A 455 5.578 -2.252 -0.809 1.00 0.00 C ATOM 524 CG1 VAL A 455 4.736 -2.539 0.425 1.00 0.00 C ATOM 525 CG2 VAL A 455 4.931 -2.838 -2.054 1.00 0.00 C ATOM 0 H VAL A 455 7.016 -1.012 -2.658 1.00 0.00 H new ATOM 0 HA VAL A 455 4.842 -0.223 -0.841 1.00 0.00 H new ATOM 0 HB VAL A 455 6.550 -2.727 -0.675 1.00 0.00 H new ATOM 0 HG11 VAL A 455 4.594 -3.615 0.526 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.244 -2.155 1.310 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.766 -2.053 0.324 1.00 0.00 H new ATOM 0 HG21 VAL A 455 4.786 -3.910 -1.918 1.00 0.00 H new ATOM 0 HG22 VAL A 455 3.966 -2.360 -2.222 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.577 -2.665 -2.915 1.00 0.00 H new ATOM 535 N ASP A 456 6.270 0.474 1.069 1.00 0.00 N ATOM 536 CA ASP A 456 7.105 0.994 2.146 1.00 0.00 C ATOM 537 C ASP A 456 6.390 0.888 3.489 1.00 0.00 C ATOM 538 O ASP A 456 5.410 1.590 3.738 1.00 0.00 O ATOM 539 CB ASP A 456 7.483 2.450 1.869 1.00 0.00 C ATOM 540 CG ASP A 456 8.524 2.973 2.838 1.00 0.00 C ATOM 541 OD1 ASP A 456 9.642 2.416 2.865 1.00 0.00 O ATOM 542 OD2 ASP A 456 8.222 3.938 3.570 1.00 0.00 O ATOM 0 H ASP A 456 5.283 0.718 1.146 1.00 0.00 H new ATOM 0 HA ASP A 456 8.013 0.393 2.190 1.00 0.00 H new ATOM 0 HB2 ASP A 456 7.863 2.536 0.851 1.00 0.00 H new ATOM 0 HB3 ASP A 456 6.590 3.072 1.930 1.00 0.00 H new ATOM 547 N TRP A 457 6.885 0.005 4.348 1.00 0.00 N ATOM 548 CA TRP A 457 6.291 -0.195 5.666 1.00 0.00 C ATOM 549 C TRP A 457 7.075 0.558 6.735 1.00 0.00 C ATOM 550 O TRP A 457 8.300 0.671 6.677 1.00 0.00 O ATOM 551 CB TRP A 457 6.243 -1.685 6.006 1.00 0.00 C ATOM 552 CG TRP A 457 7.486 -2.425 5.613 1.00 0.00 C ATOM 553 CD1 TRP A 457 8.629 -2.556 6.349 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.710 -3.133 4.389 1.00 0.00 C ATOM 555 NE1 TRP A 457 9.551 -3.303 5.656 1.00 0.00 N ATOM 556 CE2 TRP A 457 9.011 -3.670 4.451 1.00 0.00 C ATOM 557 CE3 TRP A 457 6.939 -3.368 3.248 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.555 -4.424 3.415 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.480 -4.116 2.220 1.00 0.00 C ATOM 560 CH2 TRP A 457 8.778 -4.638 2.310 1.00 0.00 C ATOM 0 H TRP A 457 7.696 -0.584 4.157 1.00 0.00 H new ATOM 0 HA TRP A 457 5.274 0.197 5.643 1.00 0.00 H new ATOM 0 HB2 TRP A 457 6.084 -1.801 7.078 1.00 0.00 H new ATOM 0 HB3 TRP A 457 5.386 -2.137 5.506 1.00 0.00 H new ATOM 0 HD1 TRP A 457 8.785 -2.135 7.331 1.00 0.00 H new ATOM 0 HE1 TRP A 457 10.486 -3.545 5.985 1.00 0.00 H new ATOM 0 HE3 TRP A 457 5.937 -2.972 3.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 10.555 -4.826 3.481 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 6.893 -4.302 1.332 1.00 0.00 H new ATOM 0 HH2 TRP A 457 9.172 -5.221 1.491 1.00 0.00 H new ATOM 571 N PRO A 458 6.355 1.087 7.736 1.00 0.00 N ATOM 572 CA PRO A 458 6.964 1.838 8.838 1.00 0.00 C ATOM 573 C PRO A 458 8.200 1.144 9.399 1.00 0.00 C ATOM 574 O PRO A 458 8.215 -0.076 9.571 1.00 0.00 O ATOM 575 CB PRO A 458 5.853 1.886 9.890 1.00 0.00 C ATOM 576 CG PRO A 458 4.588 1.803 9.109 1.00 0.00 C ATOM 577 CD PRO A 458 4.892 0.992 7.869 1.00 0.00 C ATOM 0 HA PRO A 458 7.311 2.821 8.519 1.00 0.00 H new ATOM 0 HB2 PRO A 458 5.939 1.058 10.594 1.00 0.00 H new ATOM 0 HB3 PRO A 458 5.899 2.806 10.473 1.00 0.00 H new ATOM 0 HG2 PRO A 458 3.801 1.330 9.697 1.00 0.00 H new ATOM 0 HG3 PRO A 458 4.232 2.798 8.842 1.00 0.00 H new ATOM 0 HD2 PRO A 458 4.567 -0.043 7.978 1.00 0.00 H new ATOM 0 HD3 PRO A 458 4.384 1.395 6.993 1.00 0.00 H new ATOM 585 N HIS A 459 9.235 1.927 9.684 1.00 0.00 N ATOM 586 CA HIS A 459 10.477 1.387 10.227 1.00 0.00 C ATOM 587 C HIS A 459 11.118 0.408 9.248 1.00 0.00 C ATOM 588 O HIS A 459 11.584 -0.662 9.640 1.00 0.00 O ATOM 589 CB HIS A 459 10.213 0.692 11.563 1.00 0.00 C ATOM 590 CG HIS A 459 9.707 1.614 12.629 1.00 0.00 C ATOM 591 ND1 HIS A 459 10.037 1.477 13.961 1.00 0.00 N ATOM 592 CD2 HIS A 459 8.893 2.693 12.554 1.00 0.00 C ATOM 593 CE1 HIS A 459 9.445 2.431 14.659 1.00 0.00 C ATOM 594 NE2 HIS A 459 8.746 3.182 13.828 1.00 0.00 N ATOM 0 H HIS A 459 9.239 2.938 9.548 1.00 0.00 H new ATOM 0 HA HIS A 459 11.166 2.216 10.387 1.00 0.00 H new ATOM 0 HB2 HIS A 459 9.487 -0.106 11.410 1.00 0.00 H new ATOM 0 HB3 HIS A 459 11.135 0.223 11.907 1.00 0.00 H new ATOM 0 HD1 HIS A 459 10.643 0.753 14.347 1.00 0.00 H new ATOM 0 HD2 HIS A 459 8.443 3.094 11.658 1.00 0.00 H new ATOM 0 HE1 HIS A 459 9.520 2.572 15.727 1.00 0.00 H new ATOM 602 N LYS A 460 11.137 0.781 7.973 1.00 0.00 N ATOM 603 CA LYS A 460 11.720 -0.063 6.937 1.00 0.00 C ATOM 604 C LYS A 460 13.243 0.016 6.966 1.00 0.00 C ATOM 605 O LYS A 460 13.928 -1.003 6.877 1.00 0.00 O ATOM 606 CB LYS A 460 11.204 0.355 5.559 1.00 0.00 C ATOM 607 CG LYS A 460 11.925 -0.323 4.407 1.00 0.00 C ATOM 608 CD LYS A 460 11.319 -1.680 4.091 1.00 0.00 C ATOM 609 CE LYS A 460 11.709 -2.154 2.699 1.00 0.00 C ATOM 610 NZ LYS A 460 13.181 -2.091 2.484 1.00 0.00 N ATOM 0 H LYS A 460 10.755 1.663 7.632 1.00 0.00 H new ATOM 0 HA LYS A 460 11.422 -1.093 7.132 1.00 0.00 H new ATOM 0 HB2 LYS A 460 10.140 0.127 5.495 1.00 0.00 H new ATOM 0 HB3 LYS A 460 11.306 1.435 5.455 1.00 0.00 H new ATOM 0 HG2 LYS A 460 11.878 0.312 3.523 1.00 0.00 H new ATOM 0 HG3 LYS A 460 12.979 -0.444 4.657 1.00 0.00 H new ATOM 0 HD2 LYS A 460 11.650 -2.409 4.831 1.00 0.00 H new ATOM 0 HD3 LYS A 460 10.233 -1.621 4.166 1.00 0.00 H new ATOM 0 HE2 LYS A 460 11.364 -3.178 2.554 1.00 0.00 H new ATOM 0 HE3 LYS A 460 11.206 -1.540 1.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 13.423 -2.576 1.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 13.482 -1.097 2.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 13.668 -2.556 3.277 1.00 0.00 H new ATOM 624 N ALA A 461 13.767 1.231 7.093 1.00 0.00 N ATOM 625 CA ALA A 461 15.209 1.441 7.137 1.00 0.00 C ATOM 626 C ALA A 461 15.794 0.954 8.458 1.00 0.00 C ATOM 627 O ALA A 461 16.665 0.085 8.478 1.00 0.00 O ATOM 628 CB ALA A 461 15.534 2.911 6.923 1.00 0.00 C ATOM 0 H ALA A 461 13.214 2.085 7.167 1.00 0.00 H new ATOM 0 HA ALA A 461 15.661 0.860 6.334 1.00 0.00 H new ATOM 0 HB1 ALA A 461 16.614 3.054 6.958 1.00 0.00 H new ATOM 0 HB2 ALA A 461 15.157 3.229 5.951 1.00 0.00 H new ATOM 0 HB3 ALA A 461 15.064 3.505 7.706 1.00 0.00 H new ATOM 634 N GLU A 462 15.309 1.520 9.559 1.00 0.00 N ATOM 635 CA GLU A 462 15.787 1.144 10.884 1.00 0.00 C ATOM 636 C GLU A 462 15.779 -0.373 11.055 1.00 0.00 C ATOM 637 O GLU A 462 16.536 -0.922 11.856 1.00 0.00 O ATOM 638 CB GLU A 462 14.922 1.794 11.966 1.00 0.00 C ATOM 639 CG GLU A 462 13.489 2.046 11.530 1.00 0.00 C ATOM 640 CD GLU A 462 12.566 2.337 12.698 1.00 0.00 C ATOM 641 OE1 GLU A 462 12.641 1.606 13.708 1.00 0.00 O ATOM 642 OE2 GLU A 462 11.770 3.293 12.601 1.00 0.00 O ATOM 0 H GLU A 462 14.586 2.240 9.559 1.00 0.00 H new ATOM 0 HA GLU A 462 16.812 1.499 10.986 1.00 0.00 H new ATOM 0 HB2 GLU A 462 14.917 1.154 12.848 1.00 0.00 H new ATOM 0 HB3 GLU A 462 15.375 2.741 12.261 1.00 0.00 H new ATOM 0 HG2 GLU A 462 13.467 2.886 10.836 1.00 0.00 H new ATOM 0 HG3 GLU A 462 13.120 1.175 10.988 1.00 0.00 H new ATOM 649 N SER A 463 14.918 -1.043 10.297 1.00 0.00 N ATOM 650 CA SER A 463 14.807 -2.496 10.367 1.00 0.00 C ATOM 651 C SER A 463 15.689 -3.159 9.313 1.00 0.00 C ATOM 652 O SER A 463 16.070 -2.534 8.323 1.00 0.00 O ATOM 653 CB SER A 463 13.352 -2.927 10.176 1.00 0.00 C ATOM 654 OG SER A 463 13.241 -4.339 10.127 1.00 0.00 O ATOM 0 H SER A 463 14.287 -0.604 9.627 1.00 0.00 H new ATOM 0 HA SER A 463 15.146 -2.815 11.353 1.00 0.00 H new ATOM 0 HB2 SER A 463 12.744 -2.539 10.994 1.00 0.00 H new ATOM 0 HB3 SER A 463 12.960 -2.496 9.255 1.00 0.00 H new ATOM 0 HG SER A 463 12.301 -4.589 10.006 1.00 0.00 H new ATOM 660 N LYS A 464 16.010 -4.429 9.534 1.00 0.00 N ATOM 661 CA LYS A 464 16.846 -5.180 8.605 1.00 0.00 C ATOM 662 C LYS A 464 16.007 -6.152 7.782 1.00 0.00 C ATOM 663 O LYS A 464 15.936 -6.044 6.558 1.00 0.00 O ATOM 664 CB LYS A 464 17.931 -5.944 9.366 1.00 0.00 C ATOM 665 CG LYS A 464 19.041 -6.474 8.475 1.00 0.00 C ATOM 666 CD LYS A 464 20.066 -5.398 8.161 1.00 0.00 C ATOM 667 CE LYS A 464 21.364 -5.998 7.644 1.00 0.00 C ATOM 668 NZ LYS A 464 21.164 -6.737 6.367 1.00 0.00 N ATOM 0 H LYS A 464 15.704 -4.960 10.349 1.00 0.00 H new ATOM 0 HA LYS A 464 17.319 -4.470 7.926 1.00 0.00 H new ATOM 0 HB2 LYS A 464 18.364 -5.287 10.120 1.00 0.00 H new ATOM 0 HB3 LYS A 464 17.472 -6.779 9.896 1.00 0.00 H new ATOM 0 HG2 LYS A 464 19.533 -7.314 8.966 1.00 0.00 H new ATOM 0 HG3 LYS A 464 18.614 -6.853 7.546 1.00 0.00 H new ATOM 0 HD2 LYS A 464 19.659 -4.713 7.417 1.00 0.00 H new ATOM 0 HD3 LYS A 464 20.267 -4.812 9.058 1.00 0.00 H new ATOM 0 HE2 LYS A 464 22.096 -5.205 7.493 1.00 0.00 H new ATOM 0 HE3 LYS A 464 21.776 -6.674 8.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 22.086 -7.044 5.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 20.565 -7.570 6.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 20.701 -6.114 5.674 1.00 0.00 H new ATOM 682 N SER A 465 15.371 -7.101 8.463 1.00 0.00 N ATOM 683 CA SER A 465 14.538 -8.094 7.794 1.00 0.00 C ATOM 684 C SER A 465 13.574 -7.426 6.819 1.00 0.00 C ATOM 685 O SER A 465 13.374 -6.212 6.859 1.00 0.00 O ATOM 686 CB SER A 465 13.755 -8.911 8.824 1.00 0.00 C ATOM 687 OG SER A 465 14.623 -9.719 9.600 1.00 0.00 O ATOM 0 H SER A 465 15.417 -7.203 9.477 1.00 0.00 H new ATOM 0 HA SER A 465 15.191 -8.761 7.232 1.00 0.00 H new ATOM 0 HB2 SER A 465 13.197 -8.240 9.477 1.00 0.00 H new ATOM 0 HB3 SER A 465 13.025 -9.540 8.315 1.00 0.00 H new ATOM 0 HG SER A 465 14.099 -10.230 10.252 1.00 0.00 H new ATOM 693 N TYR A 466 12.979 -8.228 5.943 1.00 0.00 N ATOM 694 CA TYR A 466 12.037 -7.716 4.955 1.00 0.00 C ATOM 695 C TYR A 466 10.599 -7.886 5.433 1.00 0.00 C ATOM 696 O TYR A 466 9.800 -6.950 5.381 1.00 0.00 O ATOM 697 CB TYR A 466 12.229 -8.433 3.617 1.00 0.00 C ATOM 698 CG TYR A 466 12.214 -9.940 3.730 1.00 0.00 C ATOM 699 CD1 TYR A 466 13.319 -10.632 4.209 1.00 0.00 C ATOM 700 CD2 TYR A 466 11.093 -10.673 3.359 1.00 0.00 C ATOM 701 CE1 TYR A 466 13.310 -12.010 4.313 1.00 0.00 C ATOM 702 CE2 TYR A 466 11.074 -12.050 3.461 1.00 0.00 C ATOM 703 CZ TYR A 466 12.185 -12.714 3.939 1.00 0.00 C ATOM 704 OH TYR A 466 12.170 -14.086 4.042 1.00 0.00 O ATOM 0 H TYR A 466 13.132 -9.235 5.897 1.00 0.00 H new ATOM 0 HA TYR A 466 12.233 -6.652 4.822 1.00 0.00 H new ATOM 0 HB2 TYR A 466 11.442 -8.121 2.931 1.00 0.00 H new ATOM 0 HB3 TYR A 466 13.177 -8.119 3.179 1.00 0.00 H new ATOM 0 HD1 TYR A 466 14.201 -10.083 4.505 1.00 0.00 H new ATOM 0 HD2 TYR A 466 10.222 -10.157 2.984 1.00 0.00 H new ATOM 0 HE1 TYR A 466 14.179 -12.532 4.685 1.00 0.00 H new ATOM 0 HE2 TYR A 466 10.194 -12.604 3.168 1.00 0.00 H new ATOM 0 HH TYR A 466 11.477 -14.359 4.679 1.00 0.00 H new ATOM 714 N PHE A 467 10.276 -9.087 5.901 1.00 0.00 N ATOM 715 CA PHE A 467 8.934 -9.382 6.389 1.00 0.00 C ATOM 716 C PHE A 467 8.315 -8.155 7.054 1.00 0.00 C ATOM 717 O PHE A 467 8.556 -7.865 8.226 1.00 0.00 O ATOM 718 CB PHE A 467 8.973 -10.547 7.380 1.00 0.00 C ATOM 719 CG PHE A 467 8.875 -11.895 6.724 1.00 0.00 C ATOM 720 CD1 PHE A 467 7.725 -12.269 6.048 1.00 0.00 C ATOM 721 CD2 PHE A 467 9.933 -12.788 6.784 1.00 0.00 C ATOM 722 CE1 PHE A 467 7.632 -13.509 5.445 1.00 0.00 C ATOM 723 CE2 PHE A 467 9.846 -14.029 6.182 1.00 0.00 C ATOM 724 CZ PHE A 467 8.694 -14.389 5.510 1.00 0.00 C ATOM 0 H PHE A 467 10.925 -9.872 5.953 1.00 0.00 H new ATOM 0 HA PHE A 467 8.317 -9.661 5.535 1.00 0.00 H new ATOM 0 HB2 PHE A 467 9.900 -10.496 7.952 1.00 0.00 H new ATOM 0 HB3 PHE A 467 8.154 -10.437 8.090 1.00 0.00 H new ATOM 0 HD1 PHE A 467 6.892 -11.584 5.992 1.00 0.00 H new ATOM 0 HD2 PHE A 467 10.836 -12.511 7.307 1.00 0.00 H new ATOM 0 HE1 PHE A 467 6.729 -13.790 4.923 1.00 0.00 H new ATOM 0 HE2 PHE A 467 10.677 -14.716 6.237 1.00 0.00 H new ATOM 0 HZ PHE A 467 8.624 -15.357 5.036 1.00 0.00 H new ATOM 734 N PRO A 468 7.499 -7.416 6.288 1.00 0.00 N ATOM 735 CA PRO A 468 6.829 -6.209 6.781 1.00 0.00 C ATOM 736 C PRO A 468 6.249 -6.398 8.178 1.00 0.00 C ATOM 737 O PRO A 468 6.085 -7.517 8.663 1.00 0.00 O ATOM 738 CB PRO A 468 5.708 -5.985 5.762 1.00 0.00 C ATOM 739 CG PRO A 468 6.218 -6.588 4.499 1.00 0.00 C ATOM 740 CD PRO A 468 7.167 -7.703 4.882 1.00 0.00 C ATOM 0 HA PRO A 468 7.517 -5.368 6.871 1.00 0.00 H new ATOM 0 HB2 PRO A 468 4.781 -6.461 6.082 1.00 0.00 H new ATOM 0 HB3 PRO A 468 5.494 -4.924 5.636 1.00 0.00 H new ATOM 0 HG2 PRO A 468 5.395 -6.974 3.898 1.00 0.00 H new ATOM 0 HG3 PRO A 468 6.730 -5.839 3.895 1.00 0.00 H new ATOM 0 HD2 PRO A 468 6.699 -8.681 4.773 1.00 0.00 H new ATOM 0 HD3 PRO A 468 8.057 -7.704 4.253 1.00 0.00 H new ATOM 748 N PRO A 469 5.929 -5.277 8.843 1.00 0.00 N ATOM 749 CA PRO A 469 5.361 -5.293 10.194 1.00 0.00 C ATOM 750 C PRO A 469 4.232 -6.309 10.337 1.00 0.00 C ATOM 751 O PRO A 469 3.859 -6.977 9.372 1.00 0.00 O ATOM 752 CB PRO A 469 4.826 -3.870 10.371 1.00 0.00 C ATOM 753 CG PRO A 469 5.681 -3.031 9.485 1.00 0.00 C ATOM 754 CD PRO A 469 6.097 -3.909 8.326 1.00 0.00 C ATOM 0 HA PRO A 469 6.099 -5.582 10.943 1.00 0.00 H new ATOM 0 HB2 PRO A 469 3.776 -3.804 10.086 1.00 0.00 H new ATOM 0 HB3 PRO A 469 4.896 -3.547 11.410 1.00 0.00 H new ATOM 0 HG2 PRO A 469 5.133 -2.158 9.132 1.00 0.00 H new ATOM 0 HG3 PRO A 469 6.554 -2.663 10.025 1.00 0.00 H new ATOM 0 HD2 PRO A 469 5.475 -3.734 7.448 1.00 0.00 H new ATOM 0 HD3 PRO A 469 7.128 -3.717 8.029 1.00 0.00 H new ATOM 762 N LYS A 470 3.692 -6.420 11.545 1.00 0.00 N ATOM 763 CA LYS A 470 2.604 -7.352 11.814 1.00 0.00 C ATOM 764 C LYS A 470 1.687 -7.483 10.602 1.00 0.00 C ATOM 765 O LYS A 470 1.402 -8.589 10.144 1.00 0.00 O ATOM 766 CB LYS A 470 1.797 -6.890 13.030 1.00 0.00 C ATOM 767 CG LYS A 470 2.371 -7.359 14.355 1.00 0.00 C ATOM 768 CD LYS A 470 3.717 -6.715 14.639 1.00 0.00 C ATOM 769 CE LYS A 470 4.310 -7.215 15.948 1.00 0.00 C ATOM 770 NZ LYS A 470 5.626 -6.581 16.239 1.00 0.00 N ATOM 0 H LYS A 470 3.990 -5.876 12.354 1.00 0.00 H new ATOM 0 HA LYS A 470 3.040 -8.328 12.025 1.00 0.00 H new ATOM 0 HB2 LYS A 470 1.748 -5.801 13.030 1.00 0.00 H new ATOM 0 HB3 LYS A 470 0.774 -7.256 12.937 1.00 0.00 H new ATOM 0 HG2 LYS A 470 1.675 -7.119 15.159 1.00 0.00 H new ATOM 0 HG3 LYS A 470 2.481 -8.443 14.341 1.00 0.00 H new ATOM 0 HD2 LYS A 470 4.404 -6.931 13.821 1.00 0.00 H new ATOM 0 HD3 LYS A 470 3.602 -5.632 14.681 1.00 0.00 H new ATOM 0 HE2 LYS A 470 3.618 -7.006 16.764 1.00 0.00 H new ATOM 0 HE3 LYS A 470 4.431 -8.297 15.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 5.997 -6.948 17.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 6.294 -6.802 15.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 5.507 -5.550 16.308 1.00 0.00 H new ATOM 784 N GLY A 471 1.228 -6.346 10.087 1.00 0.00 N ATOM 785 CA GLY A 471 0.349 -6.357 8.932 1.00 0.00 C ATOM 786 C GLY A 471 -0.146 -4.971 8.568 1.00 0.00 C ATOM 787 O GLY A 471 -1.320 -4.653 8.760 1.00 0.00 O ATOM 0 H GLY A 471 1.449 -5.418 10.449 1.00 0.00 H new ATOM 0 HA2 GLY A 471 0.878 -6.786 8.081 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -0.505 -7.003 9.135 1.00 0.00 H new ATOM 791 N TYR A 472 0.751 -4.144 8.043 1.00 0.00 N ATOM 792 CA TYR A 472 0.399 -2.783 7.654 1.00 0.00 C ATOM 793 C TYR A 472 1.538 -2.127 6.879 1.00 0.00 C ATOM 794 O TYR A 472 2.674 -2.075 7.348 1.00 0.00 O ATOM 795 CB TYR A 472 0.063 -1.948 8.891 1.00 0.00 C ATOM 796 CG TYR A 472 1.118 -2.014 9.972 1.00 0.00 C ATOM 797 CD1 TYR A 472 2.214 -1.160 9.952 1.00 0.00 C ATOM 798 CD2 TYR A 472 1.020 -2.930 11.012 1.00 0.00 C ATOM 799 CE1 TYR A 472 3.181 -1.217 10.937 1.00 0.00 C ATOM 800 CE2 TYR A 472 1.981 -2.993 12.002 1.00 0.00 C ATOM 801 CZ TYR A 472 3.060 -2.135 11.960 1.00 0.00 C ATOM 802 OH TYR A 472 4.021 -2.195 12.943 1.00 0.00 O ATOM 0 H TYR A 472 1.726 -4.392 7.877 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.477 -2.832 7.007 1.00 0.00 H new ATOM 0 HB2 TYR A 472 -0.073 -0.909 8.591 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -0.887 -2.289 9.302 1.00 0.00 H new ATOM 0 HD1 TYR A 472 2.311 -0.440 9.153 1.00 0.00 H new ATOM 0 HD2 TYR A 472 0.177 -3.605 11.047 1.00 0.00 H new ATOM 0 HE1 TYR A 472 4.027 -0.547 10.906 1.00 0.00 H new ATOM 0 HE2 TYR A 472 1.888 -3.710 12.804 1.00 0.00 H new ATOM 0 HH TYR A 472 3.786 -2.894 13.588 1.00 0.00 H new ATOM 812 N ALA A 473 1.223 -1.626 5.689 1.00 0.00 N ATOM 813 CA ALA A 473 2.217 -0.970 4.849 1.00 0.00 C ATOM 814 C ALA A 473 1.573 0.094 3.966 1.00 0.00 C ATOM 815 O ALA A 473 0.361 0.086 3.750 1.00 0.00 O ATOM 816 CB ALA A 473 2.946 -1.997 3.995 1.00 0.00 C ATOM 0 H ALA A 473 0.287 -1.662 5.285 1.00 0.00 H new ATOM 0 HA ALA A 473 2.939 -0.476 5.500 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.686 -1.493 3.372 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.446 -2.718 4.641 1.00 0.00 H new ATOM 0 HB3 ALA A 473 2.229 -2.516 3.359 1.00 0.00 H new ATOM 822 N PHE A 474 2.392 1.008 3.457 1.00 0.00 N ATOM 823 CA PHE A 474 1.902 2.080 2.598 1.00 0.00 C ATOM 824 C PHE A 474 2.331 1.856 1.151 1.00 0.00 C ATOM 825 O PHE A 474 3.443 1.398 0.884 1.00 0.00 O ATOM 826 CB PHE A 474 2.419 3.434 3.091 1.00 0.00 C ATOM 827 CG PHE A 474 1.657 3.973 4.268 1.00 0.00 C ATOM 828 CD1 PHE A 474 1.452 3.193 5.394 1.00 0.00 C ATOM 829 CD2 PHE A 474 1.145 5.261 4.247 1.00 0.00 C ATOM 830 CE1 PHE A 474 0.751 3.687 6.479 1.00 0.00 C ATOM 831 CE2 PHE A 474 0.444 5.760 5.329 1.00 0.00 C ATOM 832 CZ PHE A 474 0.246 4.971 6.445 1.00 0.00 C ATOM 0 H PHE A 474 3.398 1.028 3.624 1.00 0.00 H new ATOM 0 HA PHE A 474 0.813 2.077 2.641 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.470 3.336 3.363 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.367 4.154 2.274 1.00 0.00 H new ATOM 0 HD1 PHE A 474 1.844 2.187 5.425 1.00 0.00 H new ATOM 0 HD2 PHE A 474 1.295 5.881 3.376 1.00 0.00 H new ATOM 0 HE1 PHE A 474 0.599 3.069 7.352 1.00 0.00 H new ATOM 0 HE2 PHE A 474 0.052 6.766 5.302 1.00 0.00 H new ATOM 0 HZ PHE A 474 -0.303 5.358 7.290 1.00 0.00 H new ATOM 842 N LEU A 475 1.441 2.183 0.220 1.00 0.00 N ATOM 843 CA LEU A 475 1.726 2.018 -1.202 1.00 0.00 C ATOM 844 C LEU A 475 1.843 3.371 -1.895 1.00 0.00 C ATOM 845 O LEU A 475 1.045 4.277 -1.649 1.00 0.00 O ATOM 846 CB LEU A 475 0.630 1.184 -1.868 1.00 0.00 C ATOM 847 CG LEU A 475 0.388 -0.204 -1.273 1.00 0.00 C ATOM 848 CD1 LEU A 475 -0.811 -0.866 -1.934 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.629 -1.072 -1.422 1.00 0.00 C ATOM 0 H LEU A 475 0.517 2.564 0.424 1.00 0.00 H new ATOM 0 HA LEU A 475 2.679 1.498 -1.298 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.304 1.745 -1.823 1.00 0.00 H new ATOM 0 HB3 LEU A 475 0.880 1.067 -2.922 1.00 0.00 H new ATOM 0 HG LEU A 475 0.174 -0.091 -0.210 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -0.968 -1.853 -1.498 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.698 -0.253 -1.775 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.627 -0.967 -3.004 1.00 0.00 H new ATOM 0 HD21 LEU A 475 1.439 -2.056 -0.993 1.00 0.00 H new ATOM 0 HD22 LEU A 475 1.874 -1.178 -2.479 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.465 -0.605 -0.901 1.00 0.00 H new ATOM 861 N LEU A 476 2.840 3.501 -2.763 1.00 0.00 N ATOM 862 CA LEU A 476 3.060 4.744 -3.494 1.00 0.00 C ATOM 863 C LEU A 476 2.948 4.518 -4.999 1.00 0.00 C ATOM 864 O LEU A 476 3.805 3.876 -5.606 1.00 0.00 O ATOM 865 CB LEU A 476 4.435 5.322 -3.155 1.00 0.00 C ATOM 866 CG LEU A 476 4.538 6.071 -1.825 1.00 0.00 C ATOM 867 CD1 LEU A 476 5.994 6.342 -1.478 1.00 0.00 C ATOM 868 CD2 LEU A 476 3.750 7.371 -1.883 1.00 0.00 C ATOM 0 H LEU A 476 3.509 2.761 -2.978 1.00 0.00 H new ATOM 0 HA LEU A 476 2.290 5.454 -3.193 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.158 4.506 -3.147 1.00 0.00 H new ATOM 0 HB3 LEU A 476 4.729 6.001 -3.955 1.00 0.00 H new ATOM 0 HG LEU A 476 4.109 5.445 -1.042 1.00 0.00 H new ATOM 0 HD11 LEU A 476 6.049 6.875 -0.529 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.530 5.397 -1.394 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.448 6.948 -2.262 1.00 0.00 H new ATOM 0 HD21 LEU A 476 3.834 7.891 -0.929 1.00 0.00 H new ATOM 0 HD22 LEU A 476 4.149 8.003 -2.677 1.00 0.00 H new ATOM 0 HD23 LEU A 476 2.702 7.152 -2.085 1.00 0.00 H new ATOM 880 N PHE A 477 1.887 5.052 -5.595 1.00 0.00 N ATOM 881 CA PHE A 477 1.664 4.909 -7.029 1.00 0.00 C ATOM 882 C PHE A 477 2.290 6.071 -7.795 1.00 0.00 C ATOM 883 O PHE A 477 1.878 7.221 -7.643 1.00 0.00 O ATOM 884 CB PHE A 477 0.165 4.834 -7.328 1.00 0.00 C ATOM 885 CG PHE A 477 -0.481 3.569 -6.840 1.00 0.00 C ATOM 886 CD1 PHE A 477 -0.411 2.406 -7.590 1.00 0.00 C ATOM 887 CD2 PHE A 477 -1.158 3.543 -5.631 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.006 1.241 -7.144 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.754 2.381 -5.180 1.00 0.00 C ATOM 890 CZ PHE A 477 -1.677 1.228 -5.937 1.00 0.00 C ATOM 0 H PHE A 477 1.169 5.587 -5.108 1.00 0.00 H new ATOM 0 HA PHE A 477 2.139 3.984 -7.355 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.332 5.688 -6.867 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.013 4.919 -8.404 1.00 0.00 H new ATOM 0 HD1 PHE A 477 0.114 2.410 -8.534 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -1.220 4.441 -5.035 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -0.946 0.342 -7.739 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -2.280 2.374 -4.237 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.141 0.318 -5.586 1.00 0.00 H new ATOM 900 N GLN A 478 3.286 5.761 -8.618 1.00 0.00 N ATOM 901 CA GLN A 478 3.970 6.779 -9.406 1.00 0.00 C ATOM 902 C GLN A 478 2.967 7.657 -10.149 1.00 0.00 C ATOM 903 O GLN A 478 3.029 8.883 -10.076 1.00 0.00 O ATOM 904 CB GLN A 478 4.928 6.125 -10.403 1.00 0.00 C ATOM 905 CG GLN A 478 5.958 7.084 -10.977 1.00 0.00 C ATOM 906 CD GLN A 478 6.798 7.749 -9.905 1.00 0.00 C ATOM 907 OE1 GLN A 478 6.813 8.975 -9.782 1.00 0.00 O ATOM 908 NE2 GLN A 478 7.503 6.943 -9.120 1.00 0.00 N ATOM 0 H GLN A 478 3.637 4.813 -8.756 1.00 0.00 H new ATOM 0 HA GLN A 478 4.541 7.408 -8.723 1.00 0.00 H new ATOM 0 HB2 GLN A 478 5.445 5.302 -9.910 1.00 0.00 H new ATOM 0 HB3 GLN A 478 4.350 5.694 -11.220 1.00 0.00 H new ATOM 0 HG2 GLN A 478 6.611 6.542 -11.661 1.00 0.00 H new ATOM 0 HG3 GLN A 478 5.449 7.850 -11.562 1.00 0.00 H new ATOM 0 HE21 GLN A 478 7.461 5.933 -9.257 1.00 0.00 H new ATOM 0 HE22 GLN A 478 8.086 7.334 -8.380 1.00 0.00 H new ATOM 917 N GLU A 479 2.045 7.019 -10.863 1.00 0.00 N ATOM 918 CA GLU A 479 1.030 7.743 -11.619 1.00 0.00 C ATOM 919 C GLU A 479 -0.235 7.934 -10.788 1.00 0.00 C ATOM 920 O GLU A 479 -0.946 6.975 -10.492 1.00 0.00 O ATOM 921 CB GLU A 479 0.696 6.995 -12.912 1.00 0.00 C ATOM 922 CG GLU A 479 1.654 7.293 -14.053 1.00 0.00 C ATOM 923 CD GLU A 479 3.011 6.646 -13.859 1.00 0.00 C ATOM 924 OE1 GLU A 479 3.084 5.619 -13.152 1.00 0.00 O ATOM 925 OE2 GLU A 479 4.001 7.168 -14.414 1.00 0.00 O ATOM 0 H GLU A 479 1.980 6.004 -10.934 1.00 0.00 H new ATOM 0 HA GLU A 479 1.431 8.725 -11.869 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.703 5.923 -12.714 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.316 7.256 -13.221 1.00 0.00 H new ATOM 0 HG2 GLU A 479 1.219 6.942 -14.989 1.00 0.00 H new ATOM 0 HG3 GLU A 479 1.780 8.372 -14.145 1.00 0.00 H new ATOM 932 N GLU A 480 -0.508 9.181 -10.414 1.00 0.00 N ATOM 933 CA GLU A 480 -1.686 9.498 -9.616 1.00 0.00 C ATOM 934 C GLU A 480 -2.919 8.782 -10.158 1.00 0.00 C ATOM 935 O GLU A 480 -3.721 8.241 -9.396 1.00 0.00 O ATOM 936 CB GLU A 480 -1.927 11.009 -9.599 1.00 0.00 C ATOM 937 CG GLU A 480 -0.951 11.771 -8.718 1.00 0.00 C ATOM 938 CD GLU A 480 -1.094 13.274 -8.853 1.00 0.00 C ATOM 939 OE1 GLU A 480 -0.909 13.790 -9.974 1.00 0.00 O ATOM 940 OE2 GLU A 480 -1.393 13.934 -7.836 1.00 0.00 O ATOM 0 H GLU A 480 0.071 9.987 -10.651 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.506 9.155 -8.597 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -1.858 11.391 -10.618 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -2.943 11.203 -9.254 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -1.109 11.487 -7.678 1.00 0.00 H new ATOM 0 HG3 GLU A 480 0.068 11.482 -8.977 1.00 0.00 H new ATOM 947 N SER A 481 -3.065 8.783 -11.479 1.00 0.00 N ATOM 948 CA SER A 481 -4.202 8.137 -12.124 1.00 0.00 C ATOM 949 C SER A 481 -4.463 6.763 -11.516 1.00 0.00 C ATOM 950 O SER A 481 -5.602 6.417 -11.201 1.00 0.00 O ATOM 951 CB SER A 481 -3.955 8.004 -13.628 1.00 0.00 C ATOM 952 OG SER A 481 -5.168 7.784 -14.327 1.00 0.00 O ATOM 0 H SER A 481 -2.410 9.224 -12.124 1.00 0.00 H new ATOM 0 HA SER A 481 -5.082 8.760 -11.962 1.00 0.00 H new ATOM 0 HB2 SER A 481 -3.475 8.908 -14.002 1.00 0.00 H new ATOM 0 HB3 SER A 481 -3.269 7.178 -13.815 1.00 0.00 H new ATOM 0 HG SER A 481 -4.983 7.704 -15.286 1.00 0.00 H new ATOM 958 N SER A 482 -3.399 5.983 -11.354 1.00 0.00 N ATOM 959 CA SER A 482 -3.512 4.644 -10.788 1.00 0.00 C ATOM 960 C SER A 482 -4.366 4.659 -9.524 1.00 0.00 C ATOM 961 O SER A 482 -5.194 3.773 -9.309 1.00 0.00 O ATOM 962 CB SER A 482 -2.125 4.081 -10.473 1.00 0.00 C ATOM 963 OG SER A 482 -1.401 3.815 -11.661 1.00 0.00 O ATOM 0 H SER A 482 -2.449 6.255 -11.607 1.00 0.00 H new ATOM 0 HA SER A 482 -3.997 4.005 -11.526 1.00 0.00 H new ATOM 0 HB2 SER A 482 -1.572 4.791 -9.858 1.00 0.00 H new ATOM 0 HB3 SER A 482 -2.225 3.165 -9.891 1.00 0.00 H new ATOM 0 HG SER A 482 -1.703 2.966 -12.045 1.00 0.00 H new ATOM 969 N VAL A 483 -4.159 5.673 -8.689 1.00 0.00 N ATOM 970 CA VAL A 483 -4.909 5.806 -7.446 1.00 0.00 C ATOM 971 C VAL A 483 -6.405 5.635 -7.687 1.00 0.00 C ATOM 972 O VAL A 483 -7.081 4.907 -6.960 1.00 0.00 O ATOM 973 CB VAL A 483 -4.660 7.174 -6.784 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.580 7.363 -5.587 1.00 0.00 C ATOM 975 CG2 VAL A 483 -3.202 7.308 -6.372 1.00 0.00 C ATOM 0 H VAL A 483 -3.478 6.414 -8.851 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.559 5.019 -6.778 1.00 0.00 H new ATOM 0 HB VAL A 483 -4.882 7.956 -7.510 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -5.390 8.335 -5.132 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.618 7.313 -5.915 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -5.392 6.577 -4.856 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -3.044 8.280 -5.906 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -2.951 6.520 -5.662 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.566 7.220 -7.252 1.00 0.00 H new ATOM 985 N GLN A 484 -6.915 6.310 -8.712 1.00 0.00 N ATOM 986 CA GLN A 484 -8.332 6.232 -9.048 1.00 0.00 C ATOM 987 C GLN A 484 -8.758 4.787 -9.281 1.00 0.00 C ATOM 988 O GLN A 484 -9.534 4.226 -8.509 1.00 0.00 O ATOM 989 CB GLN A 484 -8.629 7.072 -10.292 1.00 0.00 C ATOM 990 CG GLN A 484 -10.109 7.158 -10.627 1.00 0.00 C ATOM 991 CD GLN A 484 -10.857 8.118 -9.724 1.00 0.00 C ATOM 992 OE1 GLN A 484 -10.483 9.284 -9.592 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.922 7.633 -9.096 1.00 0.00 N ATOM 0 H GLN A 484 -6.369 6.917 -9.324 1.00 0.00 H new ATOM 0 HA GLN A 484 -8.902 6.627 -8.207 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -8.240 8.079 -10.142 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -8.096 6.648 -11.143 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -10.225 7.475 -11.663 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.554 6.166 -10.545 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -12.197 6.660 -9.234 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -12.465 8.233 -8.476 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.244 4.189 -10.351 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.570 2.809 -10.686 1.00 0.00 C ATOM 1004 C ALA A 485 -8.665 1.948 -9.431 1.00 0.00 C ATOM 1005 O ALA A 485 -9.515 1.061 -9.336 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.533 2.238 -11.642 1.00 0.00 C ATOM 0 H ALA A 485 -7.600 4.640 -11.001 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.543 2.801 -11.176 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -7.790 1.206 -11.883 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.516 2.831 -12.556 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.550 2.267 -11.172 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.788 2.213 -8.469 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.773 1.462 -7.218 1.00 0.00 C ATOM 1014 C LEU A 486 -9.072 1.665 -6.445 1.00 0.00 C ATOM 1015 O LEU A 486 -9.805 0.711 -6.183 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.582 1.890 -6.358 1.00 0.00 C ATOM 1017 CG LEU A 486 -6.189 0.932 -5.233 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.472 -0.286 -5.794 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -5.316 1.643 -4.209 1.00 0.00 C ATOM 0 H LEU A 486 -7.078 2.942 -8.531 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.678 0.403 -7.459 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.719 2.027 -7.010 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -6.807 2.862 -5.919 1.00 0.00 H new ATOM 0 HG LEU A 486 -7.098 0.594 -4.735 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.200 -0.956 -4.978 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.130 -0.808 -6.488 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -4.571 0.032 -6.318 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -5.045 0.947 -3.415 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.411 2.010 -4.694 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -5.865 2.483 -3.783 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.352 2.913 -6.086 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.565 3.241 -5.346 1.00 0.00 C ATOM 1033 C ILE A 487 -11.782 2.553 -5.954 1.00 0.00 C ATOM 1034 O ILE A 487 -12.525 1.857 -5.262 1.00 0.00 O ATOM 1035 CB ILE A 487 -10.811 4.761 -5.314 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.616 5.479 -4.682 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -12.088 5.074 -4.550 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.695 6.986 -4.785 1.00 0.00 C ATOM 0 H ILE A 487 -8.756 3.714 -6.295 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.420 2.883 -4.327 1.00 0.00 H new ATOM 0 HB ILE A 487 -10.926 5.118 -6.337 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.547 5.198 -3.631 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.700 5.137 -5.164 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -12.249 6.152 -4.536 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -12.933 4.588 -5.038 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -11.999 4.707 -3.527 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -8.816 7.429 -4.317 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -9.733 7.277 -5.835 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -10.593 7.339 -4.278 1.00 0.00 H new ATOM 1050 N ASP A 488 -11.979 2.751 -7.253 1.00 0.00 N ATOM 1051 CA ASP A 488 -13.105 2.148 -7.956 1.00 0.00 C ATOM 1052 C ASP A 488 -13.193 0.654 -7.660 1.00 0.00 C ATOM 1053 O ASP A 488 -14.271 0.128 -7.385 1.00 0.00 O ATOM 1054 CB ASP A 488 -12.974 2.375 -9.463 1.00 0.00 C ATOM 1055 CG ASP A 488 -14.305 2.272 -10.182 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -15.318 2.749 -9.628 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -14.334 1.715 -11.299 1.00 0.00 O ATOM 0 H ASP A 488 -11.373 3.324 -7.840 1.00 0.00 H new ATOM 0 HA ASP A 488 -14.019 2.625 -7.603 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -12.542 3.360 -9.643 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -12.282 1.643 -9.879 1.00 0.00 H new ATOM 1062 N ALA A 489 -12.052 -0.025 -7.721 1.00 0.00 N ATOM 1063 CA ALA A 489 -12.000 -1.457 -7.459 1.00 0.00 C ATOM 1064 C ALA A 489 -12.313 -1.760 -5.997 1.00 0.00 C ATOM 1065 O ALA A 489 -13.081 -2.673 -5.693 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.634 -2.013 -7.834 1.00 0.00 C ATOM 0 H ALA A 489 -11.151 0.395 -7.950 1.00 0.00 H new ATOM 0 HA ALA A 489 -12.759 -1.941 -8.074 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -10.609 -3.084 -7.633 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.449 -1.838 -8.894 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -9.864 -1.515 -7.244 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.713 -0.989 -5.097 1.00 0.00 N ATOM 1073 CA CYS A 490 -11.927 -1.176 -3.666 1.00 0.00 C ATOM 1074 C CYS A 490 -13.406 -1.048 -3.317 1.00 0.00 C ATOM 1075 O CYS A 490 -14.031 -0.020 -3.581 1.00 0.00 O ATOM 1076 CB CYS A 490 -11.112 -0.155 -2.870 1.00 0.00 C ATOM 1077 SG CYS A 490 -9.354 -0.125 -3.290 1.00 0.00 S ATOM 0 H CYS A 490 -11.075 -0.229 -5.332 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.595 -2.180 -3.402 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -11.531 0.837 -3.036 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -11.217 -0.372 -1.807 1.00 0.00 H new ATOM 0 HG CYS A 490 -9.215 0.112 -4.561 1.00 0.00 H new ATOM 1083 N LEU A 491 -13.961 -2.099 -2.723 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.368 -2.106 -2.338 1.00 0.00 C ATOM 1085 C LEU A 491 -15.640 -1.072 -1.250 1.00 0.00 C ATOM 1086 O LEU A 491 -14.736 -0.683 -0.511 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.777 -3.496 -1.849 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.561 -4.645 -2.836 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.598 -5.983 -2.113 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -16.607 -4.603 -3.939 1.00 0.00 C ATOM 0 H LEU A 491 -13.458 -2.957 -2.498 1.00 0.00 H new ATOM 0 HA LEU A 491 -15.960 -1.848 -3.216 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -15.221 -3.717 -0.938 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.833 -3.468 -1.580 1.00 0.00 H new ATOM 0 HG LEU A 491 -14.577 -4.529 -3.291 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -15.443 -6.789 -2.831 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -14.811 -6.011 -1.360 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -16.567 -6.109 -1.630 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -16.438 -5.427 -4.632 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -17.601 -4.695 -3.501 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -16.532 -3.657 -4.475 1.00 0.00 H new ATOM 1102 N GLU A 492 -16.892 -0.633 -1.158 1.00 0.00 N ATOM 1103 CA GLU A 492 -17.282 0.355 -0.159 1.00 0.00 C ATOM 1104 C GLU A 492 -18.114 -0.288 0.947 1.00 0.00 C ATOM 1105 O GLU A 492 -19.084 -0.995 0.675 1.00 0.00 O ATOM 1106 CB GLU A 492 -18.073 1.490 -0.813 1.00 0.00 C ATOM 1107 CG GLU A 492 -18.029 2.792 -0.031 1.00 0.00 C ATOM 1108 CD GLU A 492 -19.119 3.760 -0.449 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -20.308 3.391 -0.358 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -18.781 4.887 -0.868 1.00 0.00 O ATOM 0 H GLU A 492 -17.652 -0.946 -1.762 1.00 0.00 H new ATOM 0 HA GLU A 492 -16.374 0.763 0.284 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -17.681 1.664 -1.815 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -19.112 1.179 -0.927 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -18.128 2.576 1.033 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -17.056 3.263 -0.171 1.00 0.00 H new ATOM 1117 N GLU A 493 -17.726 -0.038 2.193 1.00 0.00 N ATOM 1118 CA GLU A 493 -18.436 -0.594 3.340 1.00 0.00 C ATOM 1119 C GLU A 493 -18.387 0.363 4.527 1.00 0.00 C ATOM 1120 O GLU A 493 -17.347 0.523 5.167 1.00 0.00 O ATOM 1121 CB GLU A 493 -17.834 -1.944 3.734 1.00 0.00 C ATOM 1122 CG GLU A 493 -18.468 -3.126 3.019 1.00 0.00 C ATOM 1123 CD GLU A 493 -17.724 -4.424 3.266 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -17.102 -4.557 4.341 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -17.766 -5.308 2.384 1.00 0.00 O ATOM 0 H GLU A 493 -16.925 0.545 2.435 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.478 -0.738 3.055 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -16.765 -1.932 3.520 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -17.942 -2.080 4.810 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -19.501 -3.235 3.350 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -18.496 -2.926 1.948 1.00 0.00 H new ATOM 1132 N ASP A 494 -19.518 0.999 4.814 1.00 0.00 N ATOM 1133 CA ASP A 494 -19.605 1.940 5.924 1.00 0.00 C ATOM 1134 C ASP A 494 -18.659 3.118 5.713 1.00 0.00 C ATOM 1135 O ASP A 494 -17.903 3.489 6.610 1.00 0.00 O ATOM 1136 CB ASP A 494 -19.279 1.238 7.243 1.00 0.00 C ATOM 1137 CG ASP A 494 -19.661 2.070 8.452 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -20.809 2.560 8.496 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -18.812 2.231 9.353 1.00 0.00 O ATOM 0 H ASP A 494 -20.387 0.880 4.293 1.00 0.00 H new ATOM 0 HA ASP A 494 -20.626 2.320 5.967 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -19.803 0.283 7.282 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -18.212 1.017 7.280 1.00 0.00 H new ATOM 1144 N GLY A 495 -18.706 3.702 4.520 1.00 0.00 N ATOM 1145 CA GLY A 495 -17.847 4.831 4.212 1.00 0.00 C ATOM 1146 C GLY A 495 -16.375 4.470 4.260 1.00 0.00 C ATOM 1147 O GLY A 495 -15.530 5.315 4.558 1.00 0.00 O ATOM 0 H GLY A 495 -19.323 3.414 3.761 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -18.093 5.211 3.220 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -18.044 5.637 4.919 1.00 0.00 H new ATOM 1151 N LYS A 496 -16.067 3.212 3.967 1.00 0.00 N ATOM 1152 CA LYS A 496 -14.687 2.739 3.979 1.00 0.00 C ATOM 1153 C LYS A 496 -14.374 1.946 2.714 1.00 0.00 C ATOM 1154 O LYS A 496 -15.273 1.402 2.071 1.00 0.00 O ATOM 1155 CB LYS A 496 -14.434 1.872 5.214 1.00 0.00 C ATOM 1156 CG LYS A 496 -14.688 2.593 6.526 1.00 0.00 C ATOM 1157 CD LYS A 496 -14.584 1.648 7.711 1.00 0.00 C ATOM 1158 CE LYS A 496 -15.343 2.181 8.917 1.00 0.00 C ATOM 1159 NZ LYS A 496 -15.384 1.191 10.028 1.00 0.00 N ATOM 0 H LYS A 496 -16.754 2.501 3.718 1.00 0.00 H new ATOM 0 HA LYS A 496 -14.031 3.609 4.014 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -15.072 0.989 5.165 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -13.402 1.521 5.196 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -13.969 3.404 6.642 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -15.679 3.046 6.507 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -14.979 0.671 7.434 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -13.536 1.506 7.973 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -14.871 3.099 9.266 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -16.360 2.438 8.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -15.910 1.592 10.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -15.857 0.324 9.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -14.414 0.965 10.328 1.00 0.00 H new ATOM 1173 N LEU A 497 -13.094 1.882 2.364 1.00 0.00 N ATOM 1174 CA LEU A 497 -12.662 1.153 1.176 1.00 0.00 C ATOM 1175 C LEU A 497 -11.997 -0.166 1.559 1.00 0.00 C ATOM 1176 O LEU A 497 -11.255 -0.237 2.540 1.00 0.00 O ATOM 1177 CB LEU A 497 -11.694 2.006 0.355 1.00 0.00 C ATOM 1178 CG LEU A 497 -12.322 3.132 -0.466 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -11.259 3.864 -1.271 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -13.405 2.583 -1.384 1.00 0.00 C ATOM 0 H LEU A 497 -12.338 2.326 2.885 1.00 0.00 H new ATOM 0 HA LEU A 497 -13.543 0.933 0.574 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -10.961 2.443 1.033 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -11.148 1.350 -0.323 1.00 0.00 H new ATOM 0 HG LEU A 497 -12.781 3.843 0.221 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -11.725 4.662 -1.849 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -10.520 4.291 -0.594 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -10.769 3.164 -1.948 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -13.841 3.399 -1.961 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -12.969 1.851 -2.064 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -14.181 2.106 -0.786 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.265 -1.206 0.778 1.00 0.00 N ATOM 1193 CA TYR A 498 -11.693 -2.523 1.035 1.00 0.00 C ATOM 1194 C TYR A 498 -11.392 -3.250 -0.271 1.00 0.00 C ATOM 1195 O TYR A 498 -12.259 -3.384 -1.136 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.647 -3.359 1.889 1.00 0.00 C ATOM 1197 CG TYR A 498 -12.918 -2.764 3.253 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -11.948 -2.785 4.247 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -14.145 -2.180 3.546 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -12.192 -2.244 5.495 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -14.397 -1.635 4.790 1.00 0.00 C ATOM 1202 CZ TYR A 498 -13.418 -1.670 5.761 1.00 0.00 C ATOM 1203 OH TYR A 498 -13.664 -1.128 7.002 1.00 0.00 O ATOM 0 H TYR A 498 -12.875 -1.163 -0.039 1.00 0.00 H new ATOM 0 HA TYR A 498 -10.757 -2.385 1.577 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.592 -3.473 1.357 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -12.229 -4.358 2.014 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -10.987 -3.232 4.041 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -14.914 -2.152 2.788 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -11.428 -2.270 6.257 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -15.355 -1.184 5.001 1.00 0.00 H new ATOM 0 HH TYR A 498 -12.826 -0.795 7.386 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.156 -3.719 -0.408 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.739 -4.435 -1.609 1.00 0.00 C ATOM 1215 C LEU A 499 -9.396 -5.886 -1.287 1.00 0.00 C ATOM 1216 O LEU A 499 -8.942 -6.197 -0.185 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.531 -3.743 -2.245 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.106 -4.263 -3.618 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.188 -3.988 -4.651 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -6.788 -3.632 -4.043 1.00 0.00 C ATOM 0 H LEU A 499 -9.426 -3.616 0.297 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.570 -4.425 -2.315 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.752 -2.679 -2.334 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.684 -3.837 -1.565 1.00 0.00 H new ATOM 0 HG LEU A 499 -7.964 -5.341 -3.549 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -8.868 -4.365 -5.622 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.110 -4.487 -4.354 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.362 -2.914 -4.718 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.501 -4.014 -5.023 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -6.903 -2.549 -4.095 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -6.015 -3.880 -3.316 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.615 -6.769 -2.255 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.328 -8.187 -2.075 1.00 0.00 C ATOM 1234 C CYS A 500 -7.978 -8.551 -2.685 1.00 0.00 C ATOM 1235 O CYS A 500 -7.677 -8.178 -3.818 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.432 -9.036 -2.706 1.00 0.00 C ATOM 1237 SG CYS A 500 -12.037 -8.891 -1.885 1.00 0.00 S ATOM 0 H CYS A 500 -9.990 -6.528 -3.172 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.289 -8.391 -1.005 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.544 -8.749 -3.751 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -10.123 -10.081 -2.694 1.00 0.00 H new ATOM 0 HG CYS A 500 -12.905 -9.644 -2.493 1.00 0.00 H new ATOM 1243 N VAL A 501 -7.168 -9.281 -1.924 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.850 -9.695 -2.389 1.00 0.00 C ATOM 1245 C VAL A 501 -5.592 -11.164 -2.074 1.00 0.00 C ATOM 1246 O VAL A 501 -5.530 -11.558 -0.909 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.737 -8.841 -1.753 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -4.952 -7.367 -2.060 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.677 -9.078 -0.251 1.00 0.00 C ATOM 0 H VAL A 501 -7.402 -9.598 -0.983 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.836 -9.551 -3.469 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.782 -9.141 -2.184 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -4.156 -6.780 -1.602 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -4.941 -7.215 -3.139 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -5.914 -7.048 -1.659 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -3.885 -8.467 0.182 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.632 -8.807 0.199 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.470 -10.130 -0.057 1.00 0.00 H new ATOM 1259 N SER A 502 -5.442 -11.970 -3.120 1.00 0.00 N ATOM 1260 CA SER A 502 -5.194 -13.398 -2.955 1.00 0.00 C ATOM 1261 C SER A 502 -3.710 -13.669 -2.730 1.00 0.00 C ATOM 1262 O SER A 502 -2.854 -12.899 -3.166 1.00 0.00 O ATOM 1263 CB SER A 502 -5.684 -14.167 -4.182 1.00 0.00 C ATOM 1264 OG SER A 502 -5.192 -13.587 -5.378 1.00 0.00 O ATOM 0 H SER A 502 -5.488 -11.659 -4.090 1.00 0.00 H new ATOM 0 HA SER A 502 -5.745 -13.738 -2.078 1.00 0.00 H new ATOM 0 HB2 SER A 502 -5.359 -15.206 -4.118 1.00 0.00 H new ATOM 0 HB3 SER A 502 -6.774 -14.174 -4.199 1.00 0.00 H new ATOM 0 HG SER A 502 -5.518 -14.098 -6.148 1.00 0.00 H new ATOM 1270 N SER A 503 -3.412 -14.769 -2.046 1.00 0.00 N ATOM 1271 CA SER A 503 -2.032 -15.141 -1.760 1.00 0.00 C ATOM 1272 C SER A 503 -1.845 -16.652 -1.856 1.00 0.00 C ATOM 1273 O SER A 503 -2.761 -17.434 -1.600 1.00 0.00 O ATOM 1274 CB SER A 503 -1.629 -14.654 -0.367 1.00 0.00 C ATOM 1275 OG SER A 503 -2.253 -13.420 -0.057 1.00 0.00 O ATOM 0 H SER A 503 -4.108 -15.418 -1.680 1.00 0.00 H new ATOM 0 HA SER A 503 -1.392 -14.665 -2.503 1.00 0.00 H new ATOM 0 HB2 SER A 503 -1.905 -15.401 0.377 1.00 0.00 H new ATOM 0 HB3 SER A 503 -0.546 -14.540 -0.318 1.00 0.00 H new ATOM 0 HG SER A 503 -3.031 -13.582 0.517 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.630 -17.075 -2.235 1.00 0.00 N ATOM 1282 CA PRO A 504 -0.293 -18.494 -2.374 1.00 0.00 C ATOM 1283 C PRO A 504 -0.779 -19.324 -1.191 1.00 0.00 C ATOM 1284 O PRO A 504 -1.205 -20.468 -1.354 1.00 0.00 O ATOM 1285 CB PRO A 504 1.237 -18.492 -2.433 1.00 0.00 C ATOM 1286 CG PRO A 504 1.592 -17.159 -2.996 1.00 0.00 C ATOM 1287 CD PRO A 504 0.509 -16.198 -2.557 1.00 0.00 C ATOM 0 HA PRO A 504 -0.766 -18.941 -3.248 1.00 0.00 H new ATOM 0 HB2 PRO A 504 1.672 -18.632 -1.443 1.00 0.00 H new ATOM 0 HB3 PRO A 504 1.610 -19.300 -3.062 1.00 0.00 H new ATOM 0 HG2 PRO A 504 2.568 -16.834 -2.634 1.00 0.00 H new ATOM 0 HG3 PRO A 504 1.653 -17.202 -4.083 1.00 0.00 H new ATOM 0 HD2 PRO A 504 0.820 -15.613 -1.692 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.258 -15.490 -3.347 1.00 0.00 H new ATOM 1295 N THR A 505 -0.714 -18.741 0.002 1.00 0.00 N ATOM 1296 CA THR A 505 -1.147 -19.427 1.213 1.00 0.00 C ATOM 1297 C THR A 505 -2.504 -18.914 1.679 1.00 0.00 C ATOM 1298 O THR A 505 -3.390 -19.698 2.023 1.00 0.00 O ATOM 1299 CB THR A 505 -0.126 -19.253 2.353 1.00 0.00 C ATOM 1300 OG1 THR A 505 0.324 -17.895 2.405 1.00 0.00 O ATOM 1301 CG2 THR A 505 1.065 -20.179 2.158 1.00 0.00 C ATOM 0 H THR A 505 -0.365 -17.795 0.155 1.00 0.00 H new ATOM 0 HA THR A 505 -1.227 -20.486 0.966 1.00 0.00 H new ATOM 0 HB THR A 505 -0.616 -19.509 3.292 1.00 0.00 H new ATOM 0 HG1 THR A 505 1.286 -17.876 2.592 1.00 0.00 H new ATOM 0 HG21 THR A 505 1.773 -20.039 2.975 1.00 0.00 H new ATOM 0 HG22 THR A 505 0.723 -21.214 2.148 1.00 0.00 H new ATOM 0 HG23 THR A 505 1.554 -19.949 1.211 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.662 -17.595 1.688 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.913 -16.978 2.111 1.00 0.00 C ATOM 1311 C ILE A 506 -4.831 -16.723 0.920 1.00 0.00 C ATOM 1312 O ILE A 506 -4.373 -16.359 -0.164 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.665 -15.649 2.848 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.859 -15.891 4.126 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -4.986 -14.967 3.170 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -3.666 -16.526 5.237 1.00 0.00 C ATOM 0 H ILE A 506 -1.939 -16.933 1.407 1.00 0.00 H new ATOM 0 HA ILE A 506 -4.394 -17.678 2.794 1.00 0.00 H new ATOM 0 HB ILE A 506 -3.089 -14.992 2.197 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -2.008 -16.532 3.894 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.456 -14.941 4.477 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.794 -14.029 3.691 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.526 -14.764 2.245 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.586 -15.618 3.805 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -3.032 -16.668 6.112 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -4.502 -15.876 5.497 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -4.047 -17.491 4.904 1.00 0.00 H new ATOM 1328 N LYS A 507 -6.129 -16.913 1.129 1.00 0.00 N ATOM 1329 CA LYS A 507 -7.113 -16.701 0.074 1.00 0.00 C ATOM 1330 C LYS A 507 -7.531 -15.236 0.007 1.00 0.00 C ATOM 1331 O LYS A 507 -7.158 -14.434 0.864 1.00 0.00 O ATOM 1332 CB LYS A 507 -8.341 -17.583 0.309 1.00 0.00 C ATOM 1333 CG LYS A 507 -8.241 -18.951 -0.342 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.469 -18.873 -1.842 1.00 0.00 C ATOM 1335 CE LYS A 507 -8.741 -20.246 -2.437 1.00 0.00 C ATOM 1336 NZ LYS A 507 -8.916 -20.186 -3.915 1.00 0.00 N ATOM 0 H LYS A 507 -6.524 -17.214 2.020 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.655 -16.974 -0.877 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.487 -17.710 1.382 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -9.224 -17.071 -0.074 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -7.258 -19.378 -0.144 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -8.975 -19.622 0.104 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -9.311 -18.212 -2.049 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -7.594 -18.434 -2.322 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -7.916 -20.916 -2.196 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -9.637 -20.668 -1.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -9.099 -21.142 -4.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -9.719 -19.567 -4.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -8.051 -19.808 -4.352 1.00 0.00 H new ATOM 1350 N ASP A 508 -8.308 -14.893 -1.015 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.779 -13.524 -1.192 1.00 0.00 C ATOM 1352 C ASP A 508 -9.031 -12.858 0.157 1.00 0.00 C ATOM 1353 O ASP A 508 -10.065 -13.079 0.788 1.00 0.00 O ATOM 1354 CB ASP A 508 -10.058 -13.507 -2.030 1.00 0.00 C ATOM 1355 CG ASP A 508 -11.219 -14.186 -1.329 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -11.008 -15.272 -0.750 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -12.338 -13.632 -1.360 1.00 0.00 O ATOM 0 H ASP A 508 -8.625 -15.544 -1.733 1.00 0.00 H new ATOM 0 HA ASP A 508 -8.004 -12.963 -1.715 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -10.327 -12.475 -2.256 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -9.872 -14.004 -2.982 1.00 0.00 H new ATOM 1362 N LYS A 509 -8.078 -12.041 0.594 1.00 0.00 N ATOM 1363 CA LYS A 509 -8.195 -11.341 1.868 1.00 0.00 C ATOM 1364 C LYS A 509 -8.493 -9.862 1.651 1.00 0.00 C ATOM 1365 O LYS A 509 -7.789 -9.163 0.921 1.00 0.00 O ATOM 1366 CB LYS A 509 -6.907 -11.499 2.680 1.00 0.00 C ATOM 1367 CG LYS A 509 -7.126 -11.453 4.183 1.00 0.00 C ATOM 1368 CD LYS A 509 -7.425 -12.832 4.746 1.00 0.00 C ATOM 1369 CE LYS A 509 -8.808 -13.314 4.335 1.00 0.00 C ATOM 1370 NZ LYS A 509 -8.780 -14.036 3.033 1.00 0.00 N ATOM 0 H LYS A 509 -7.216 -11.847 0.084 1.00 0.00 H new ATOM 0 HA LYS A 509 -9.023 -11.783 2.422 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.437 -12.447 2.419 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -6.211 -10.709 2.398 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -6.239 -11.045 4.668 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -7.952 -10.779 4.411 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -6.673 -13.540 4.397 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -7.356 -12.805 5.833 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -9.207 -13.972 5.107 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -9.483 -12.461 4.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -9.502 -13.638 2.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -7.842 -13.930 2.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -8.976 -15.045 3.191 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.560 -9.370 2.298 1.00 0.00 N ATOM 1385 CA PRO A 510 -9.974 -7.968 2.192 1.00 0.00 C ATOM 1386 C PRO A 510 -9.122 -7.045 3.057 1.00 0.00 C ATOM 1387 O PRO A 510 -9.260 -7.022 4.280 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.420 -7.986 2.693 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.481 -9.140 3.634 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.444 -10.146 3.184 1.00 0.00 C ATOM 0 HA PRO A 510 -9.865 -7.587 1.177 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.677 -7.053 3.194 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -12.123 -8.109 1.869 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -11.282 -8.814 4.655 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.476 -9.586 3.630 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -9.897 -10.562 4.030 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -10.902 -10.984 2.658 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.241 -6.285 2.414 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.368 -5.359 3.125 1.00 0.00 C ATOM 1400 C VAL A 511 -7.991 -3.970 3.208 1.00 0.00 C ATOM 1401 O VAL A 511 -8.822 -3.602 2.378 1.00 0.00 O ATOM 1402 CB VAL A 511 -5.990 -5.252 2.443 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.212 -6.549 2.604 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -6.150 -4.895 0.973 1.00 0.00 C ATOM 0 H VAL A 511 -8.113 -6.293 1.402 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.238 -5.756 4.132 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.425 -4.456 2.927 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.242 -6.454 2.116 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -5.066 -6.757 3.664 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -5.770 -7.367 2.147 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -5.167 -4.823 0.507 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.734 -5.668 0.472 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.664 -3.938 0.885 1.00 0.00 H new ATOM 1414 N GLN A 512 -7.583 -3.204 4.214 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.102 -1.855 4.406 1.00 0.00 C ATOM 1416 C GLN A 512 -7.303 -0.844 3.590 1.00 0.00 C ATOM 1417 O GLN A 512 -6.196 -0.461 3.970 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.064 -1.477 5.887 1.00 0.00 C ATOM 1419 CG GLN A 512 -9.041 -0.373 6.258 1.00 0.00 C ATOM 1420 CD GLN A 512 -9.204 -0.217 7.758 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -8.352 -0.650 8.535 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -10.302 0.404 8.173 1.00 0.00 N ATOM 0 H GLN A 512 -6.895 -3.494 4.909 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.136 -1.838 4.061 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -8.284 -2.361 6.485 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -7.054 -1.160 6.147 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -8.696 0.570 5.834 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -10.012 -0.587 5.811 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -10.982 0.747 7.494 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -10.466 0.538 9.171 1.00 0.00 H new ATOM 1431 N ILE A 513 -7.871 -0.415 2.468 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.212 0.552 1.600 1.00 0.00 C ATOM 1433 C ILE A 513 -7.726 1.964 1.859 1.00 0.00 C ATOM 1434 O ILE A 513 -8.793 2.345 1.377 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.419 0.208 0.113 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -6.963 -1.226 -0.169 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.665 1.192 -0.769 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -5.513 -1.478 0.180 1.00 0.00 C ATOM 0 H ILE A 513 -8.786 -0.722 2.139 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.148 0.507 1.830 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.482 0.284 -0.118 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -7.590 -1.916 0.396 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.118 -1.447 -1.225 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -6.821 0.935 -1.817 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -7.032 2.202 -0.584 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.601 1.145 -0.539 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -5.259 -2.514 -0.046 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -4.877 -0.813 -0.404 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.356 -1.289 1.242 1.00 0.00 H new ATOM 1450 N ARG A 514 -6.960 2.737 2.622 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.338 4.107 2.945 1.00 0.00 C ATOM 1452 C ARG A 514 -6.348 5.100 2.344 1.00 0.00 C ATOM 1453 O ARG A 514 -5.340 5.456 2.954 1.00 0.00 O ATOM 1454 CB ARG A 514 -7.408 4.295 4.462 1.00 0.00 C ATOM 1455 CG ARG A 514 -8.489 3.462 5.130 1.00 0.00 C ATOM 1456 CD ARG A 514 -8.386 3.527 6.646 1.00 0.00 C ATOM 1457 NE ARG A 514 -8.861 4.804 7.172 1.00 0.00 N ATOM 1458 CZ ARG A 514 -8.905 5.094 8.468 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -8.505 4.202 9.364 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -9.350 6.277 8.869 1.00 0.00 N ATOM 0 H ARG A 514 -6.074 2.437 3.028 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.322 4.297 2.516 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -6.442 4.037 4.896 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -7.585 5.348 4.681 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -9.470 3.818 4.815 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -8.405 2.426 4.803 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -8.967 2.716 7.084 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -7.349 3.374 6.946 1.00 0.00 H new ATOM 0 HE ARG A 514 -9.176 5.512 6.508 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -8.163 3.291 9.059 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -8.540 4.427 10.358 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -9.659 6.965 8.182 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -9.383 6.499 9.864 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.641 5.559 1.118 1.00 0.00 N ATOM 1475 CA PRO A 515 -5.789 6.517 0.407 1.00 0.00 C ATOM 1476 C PRO A 515 -5.348 7.673 1.298 1.00 0.00 C ATOM 1477 O PRO A 515 -6.044 8.682 1.411 1.00 0.00 O ATOM 1478 CB PRO A 515 -6.691 7.025 -0.721 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.638 5.905 -0.982 1.00 0.00 C ATOM 1480 CD PRO A 515 -7.826 5.178 0.331 1.00 0.00 C ATOM 0 HA PRO A 515 -4.864 6.059 0.058 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -7.221 7.931 -0.427 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -6.112 7.269 -1.611 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.590 6.283 -1.355 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -7.242 5.233 -1.743 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.749 5.480 0.826 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -7.880 4.099 0.186 1.00 0.00 H new ATOM 1488 N TRP A 516 -4.189 7.520 1.928 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.656 8.552 2.809 1.00 0.00 C ATOM 1490 C TRP A 516 -3.900 9.941 2.230 1.00 0.00 C ATOM 1491 O TRP A 516 -3.285 10.326 1.236 1.00 0.00 O ATOM 1492 CB TRP A 516 -2.159 8.336 3.034 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.558 9.306 4.007 1.00 0.00 C ATOM 1494 CD1 TRP A 516 -0.596 10.239 3.745 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -1.878 9.435 5.396 1.00 0.00 C ATOM 1496 NE1 TRP A 516 -0.299 10.941 4.888 1.00 0.00 N ATOM 1497 CE2 TRP A 516 -1.072 10.468 5.914 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -2.768 8.782 6.252 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 -1.131 10.859 7.250 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -2.825 9.170 7.577 1.00 0.00 C ATOM 1501 CH2 TRP A 516 -2.012 10.201 8.065 1.00 0.00 C ATOM 0 H TRP A 516 -3.600 6.691 1.845 1.00 0.00 H new ATOM 0 HA TRP A 516 -4.174 8.481 3.765 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -1.996 7.321 3.396 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.639 8.421 2.080 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -0.136 10.401 2.781 1.00 0.00 H new ATOM 0 HE1 TRP A 516 0.386 11.693 4.960 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -3.401 7.988 5.885 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 -0.504 11.653 7.629 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -3.508 8.670 8.248 1.00 0.00 H new ATOM 0 HH2 TRP A 516 -2.082 10.482 9.105 1.00 0.00 H new