USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=18 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 118:sc= 0.866 USER MOD Single : A 428 LYS NZ :NH3+ -124:sc= 0.0338 (180deg=-0.685) USER MOD Single : A 444 THR OG1 : rot 180:sc= -0.0266 USER MOD Single : A 446 SER OG : rot 180:sc= 0 USER MOD Single : A 459 HIS : no HD1:sc= -0.124 X(o=-0.12,f=0) USER MOD Single : A 460 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 463 SER OG : rot 180:sc= 0 USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 465 SER OG : rot 180:sc= 0 USER MOD Single : A 466 TYR OH : rot 180:sc= 0 USER MOD Single : A 470 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 472 TYR OH : rot 165:sc= -0.389 USER MOD Single : A 478 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot -69:sc= -0.0201 USER MOD Single : A 484 GLN : amide:sc= -0.493 K(o=-0.49,f=-1.1) USER MOD Single : A 490 CYS SG : rot 57:sc= -1.46 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 TYR OH : rot 30:sc= 0 USER MOD Single : A 500 CYS SG : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 180:sc= 0 USER MOD Single : A 503 SER OG : rot 99:sc= -0.947 USER MOD Single : A 505 THR OG1 : rot 180:sc= 0.038 USER MOD Single : A 507 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.0021) USER MOD Single : A 509 LYS NZ :NH3+ -157:sc= -0.0748 (180deg=-0.414) USER MOD Single : A 512 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 66 N SER A 426 -2.327 13.245 -2.373 1.00 0.00 N ATOM 67 CA SER A 426 -1.296 12.271 -2.033 1.00 0.00 C ATOM 68 C SER A 426 -1.618 10.906 -2.634 1.00 0.00 C ATOM 69 O SER A 426 -2.667 10.325 -2.356 1.00 0.00 O ATOM 70 CB SER A 426 -1.159 12.152 -0.514 1.00 0.00 C ATOM 71 OG SER A 426 -2.422 11.962 0.100 1.00 0.00 O ATOM 0 HA SER A 426 -0.351 12.618 -2.450 1.00 0.00 H new ATOM 0 HB2 SER A 426 -0.503 11.316 -0.270 1.00 0.00 H new ATOM 0 HB3 SER A 426 -0.690 13.052 -0.117 1.00 0.00 H new ATOM 0 HG SER A 426 -2.435 11.097 0.560 1.00 0.00 H new ATOM 77 N ARG A 427 -0.708 10.401 -3.460 1.00 0.00 N ATOM 78 CA ARG A 427 -0.894 9.105 -4.102 1.00 0.00 C ATOM 79 C ARG A 427 -0.778 7.973 -3.086 1.00 0.00 C ATOM 80 O ARG A 427 -1.460 6.954 -3.195 1.00 0.00 O ATOM 81 CB ARG A 427 0.136 8.912 -5.217 1.00 0.00 C ATOM 82 CG ARG A 427 0.168 10.053 -6.221 1.00 0.00 C ATOM 83 CD ARG A 427 1.443 10.031 -7.049 1.00 0.00 C ATOM 84 NE ARG A 427 1.817 11.364 -7.513 1.00 0.00 N ATOM 85 CZ ARG A 427 2.969 11.635 -8.118 1.00 0.00 C ATOM 86 NH1 ARG A 427 3.853 10.670 -8.330 1.00 0.00 N ATOM 87 NH2 ARG A 427 3.237 12.873 -8.511 1.00 0.00 N ATOM 0 H ARG A 427 0.166 10.869 -3.701 1.00 0.00 H new ATOM 0 HA ARG A 427 -1.895 9.082 -4.533 1.00 0.00 H new ATOM 0 HB2 ARG A 427 1.125 8.803 -4.772 1.00 0.00 H new ATOM 0 HB3 ARG A 427 -0.081 7.982 -5.743 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -0.697 9.983 -6.881 1.00 0.00 H new ATOM 0 HG3 ARG A 427 0.091 11.004 -5.695 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.255 9.613 -6.453 1.00 0.00 H new ATOM 0 HD3 ARG A 427 1.306 9.373 -7.907 1.00 0.00 H new ATOM 0 HE ARG A 427 1.158 12.129 -7.365 1.00 0.00 H new ATOM 0 HH11 ARG A 427 3.650 9.717 -8.029 1.00 0.00 H new ATOM 0 HH12 ARG A 427 4.736 10.881 -8.795 1.00 0.00 H new ATOM 0 HH21 ARG A 427 2.559 13.618 -8.349 1.00 0.00 H new ATOM 0 HH22 ARG A 427 4.121 13.081 -8.975 1.00 0.00 H new ATOM 101 N LYS A 428 0.091 8.159 -2.098 1.00 0.00 N ATOM 102 CA LYS A 428 0.298 7.154 -1.061 1.00 0.00 C ATOM 103 C LYS A 428 -1.018 6.480 -0.687 1.00 0.00 C ATOM 104 O LYS A 428 -2.082 7.096 -0.746 1.00 0.00 O ATOM 105 CB LYS A 428 0.925 7.794 0.180 1.00 0.00 C ATOM 106 CG LYS A 428 1.123 6.823 1.331 1.00 0.00 C ATOM 107 CD LYS A 428 2.281 7.242 2.221 1.00 0.00 C ATOM 108 CE LYS A 428 1.953 8.504 3.004 1.00 0.00 C ATOM 109 NZ LYS A 428 2.308 9.735 2.245 1.00 0.00 N ATOM 0 H LYS A 428 0.664 8.997 -1.993 1.00 0.00 H new ATOM 0 HA LYS A 428 0.976 6.396 -1.454 1.00 0.00 H new ATOM 0 HB2 LYS A 428 1.889 8.224 -0.091 1.00 0.00 H new ATOM 0 HB3 LYS A 428 0.292 8.616 0.514 1.00 0.00 H new ATOM 0 HG2 LYS A 428 0.209 6.768 1.923 1.00 0.00 H new ATOM 0 HG3 LYS A 428 1.309 5.824 0.937 1.00 0.00 H new ATOM 0 HD2 LYS A 428 2.520 6.435 2.913 1.00 0.00 H new ATOM 0 HD3 LYS A 428 3.168 7.411 1.610 1.00 0.00 H new ATOM 0 HE2 LYS A 428 0.889 8.518 3.242 1.00 0.00 H new ATOM 0 HE3 LYS A 428 2.491 8.494 3.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 2.954 10.319 2.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 2.774 9.471 1.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 1.444 10.276 2.037 1.00 0.00 H new ATOM 123 N VAL A 429 -0.939 5.210 -0.301 1.00 0.00 N ATOM 124 CA VAL A 429 -2.123 4.453 0.085 1.00 0.00 C ATOM 125 C VAL A 429 -1.843 3.577 1.301 1.00 0.00 C ATOM 126 O VAL A 429 -0.879 2.812 1.319 1.00 0.00 O ATOM 127 CB VAL A 429 -2.622 3.564 -1.070 1.00 0.00 C ATOM 128 CG1 VAL A 429 -3.940 2.900 -0.702 1.00 0.00 C ATOM 129 CG2 VAL A 429 -2.765 4.380 -2.346 1.00 0.00 C ATOM 0 H VAL A 429 -0.067 4.684 -0.248 1.00 0.00 H new ATOM 0 HA VAL A 429 -2.896 5.180 0.335 1.00 0.00 H new ATOM 0 HB VAL A 429 -1.885 2.781 -1.247 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.277 2.276 -1.530 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.801 2.282 0.185 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.688 3.666 -0.497 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.118 3.737 -3.152 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.481 5.186 -2.184 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -1.798 4.803 -2.617 1.00 0.00 H new ATOM 139 N PHE A 430 -2.693 3.694 2.316 1.00 0.00 N ATOM 140 CA PHE A 430 -2.538 2.913 3.537 1.00 0.00 C ATOM 141 C PHE A 430 -3.226 1.558 3.407 1.00 0.00 C ATOM 142 O PHE A 430 -4.406 1.478 3.067 1.00 0.00 O ATOM 143 CB PHE A 430 -3.112 3.677 4.732 1.00 0.00 C ATOM 144 CG PHE A 430 -2.986 2.937 6.033 1.00 0.00 C ATOM 145 CD1 PHE A 430 -1.878 2.145 6.290 1.00 0.00 C ATOM 146 CD2 PHE A 430 -3.975 3.033 6.999 1.00 0.00 C ATOM 147 CE1 PHE A 430 -1.761 1.462 7.486 1.00 0.00 C ATOM 148 CE2 PHE A 430 -3.862 2.353 8.197 1.00 0.00 C ATOM 149 CZ PHE A 430 -2.753 1.567 8.441 1.00 0.00 C ATOM 0 H PHE A 430 -3.496 4.322 2.317 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.473 2.746 3.699 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.602 4.637 4.818 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -4.164 3.891 4.545 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.098 2.061 5.548 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -4.844 3.646 6.814 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -0.894 0.846 7.674 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -4.640 2.436 8.941 1.00 0.00 H new ATOM 0 HZ PHE A 430 -2.662 1.036 9.377 1.00 0.00 H new ATOM 159 N VAL A 431 -2.478 0.493 3.681 1.00 0.00 N ATOM 160 CA VAL A 431 -3.015 -0.860 3.596 1.00 0.00 C ATOM 161 C VAL A 431 -2.893 -1.585 4.932 1.00 0.00 C ATOM 162 O VAL A 431 -1.822 -1.618 5.537 1.00 0.00 O ATOM 163 CB VAL A 431 -2.295 -1.682 2.511 1.00 0.00 C ATOM 164 CG1 VAL A 431 -3.116 -2.907 2.136 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.018 -0.822 1.287 1.00 0.00 C ATOM 0 H VAL A 431 -1.499 0.541 3.964 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.068 -0.766 3.332 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.340 -2.022 2.912 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.591 -3.475 1.368 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -3.259 -3.533 3.017 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.087 -2.591 1.754 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -1.509 -1.419 0.530 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -2.960 -0.450 0.883 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -1.387 0.021 1.570 1.00 0.00 H new ATOM 175 N GLY A 432 -3.999 -2.166 5.387 1.00 0.00 N ATOM 176 CA GLY A 432 -3.994 -2.884 6.648 1.00 0.00 C ATOM 177 C GLY A 432 -4.746 -4.198 6.571 1.00 0.00 C ATOM 178 O GLY A 432 -5.953 -4.218 6.335 1.00 0.00 O ATOM 0 H GLY A 432 -4.898 -2.152 4.905 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -2.964 -3.076 6.949 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.441 -2.258 7.421 1.00 0.00 H new ATOM 182 N GLY A 433 -4.029 -5.301 6.768 1.00 0.00 N ATOM 183 CA GLY A 433 -4.653 -6.610 6.713 1.00 0.00 C ATOM 184 C GLY A 433 -3.874 -7.587 5.855 1.00 0.00 C ATOM 185 O GLY A 433 -4.310 -8.718 5.638 1.00 0.00 O ATOM 0 H GLY A 433 -3.028 -5.311 6.964 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.742 -7.009 7.723 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.664 -6.511 6.319 1.00 0.00 H new ATOM 189 N LEU A 434 -2.719 -7.151 5.365 1.00 0.00 N ATOM 190 CA LEU A 434 -1.878 -7.995 4.523 1.00 0.00 C ATOM 191 C LEU A 434 -1.652 -9.357 5.172 1.00 0.00 C ATOM 192 O LEU A 434 -1.513 -9.478 6.389 1.00 0.00 O ATOM 193 CB LEU A 434 -0.534 -7.312 4.264 1.00 0.00 C ATOM 194 CG LEU A 434 -0.600 -5.895 3.695 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.792 -5.289 3.607 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.269 -5.899 2.328 1.00 0.00 C ATOM 0 H LEU A 434 -2.343 -6.218 5.536 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.391 -8.146 3.573 1.00 0.00 H new ATOM 0 HB2 LEU A 434 0.021 -7.280 5.201 1.00 0.00 H new ATOM 0 HB3 LEU A 434 0.039 -7.932 3.575 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.199 -5.282 4.369 1.00 0.00 H new ATOM 0 HD11 LEU A 434 0.725 -4.280 3.200 1.00 0.00 H new ATOM 0 HD12 LEU A 434 1.235 -5.250 4.602 1.00 0.00 H new ATOM 0 HD13 LEU A 434 1.415 -5.902 2.956 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.307 -4.882 1.939 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.698 -6.528 1.645 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -2.282 -6.290 2.420 1.00 0.00 H new ATOM 208 N PRO A 435 -1.612 -10.409 4.340 1.00 0.00 N ATOM 209 CA PRO A 435 -1.400 -11.782 4.810 1.00 0.00 C ATOM 210 C PRO A 435 -0.237 -11.886 5.791 1.00 0.00 C ATOM 211 O PRO A 435 0.724 -11.119 5.735 1.00 0.00 O ATOM 212 CB PRO A 435 -1.087 -12.552 3.525 1.00 0.00 C ATOM 213 CG PRO A 435 -1.779 -11.790 2.448 1.00 0.00 C ATOM 214 CD PRO A 435 -1.770 -10.340 2.878 1.00 0.00 C ATOM 0 HA PRO A 435 -2.264 -12.165 5.353 1.00 0.00 H new ATOM 0 HB2 PRO A 435 -0.013 -12.603 3.346 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -1.450 -13.578 3.580 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.268 -11.915 1.494 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -2.799 -12.149 2.313 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -0.952 -9.790 2.413 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -2.694 -9.834 2.599 1.00 0.00 H new ATOM 222 N PRO A 436 -0.324 -12.858 6.712 1.00 0.00 N ATOM 223 CA PRO A 436 0.714 -13.085 7.722 1.00 0.00 C ATOM 224 C PRO A 436 1.924 -13.820 7.154 1.00 0.00 C ATOM 225 O PRO A 436 2.909 -14.046 7.856 1.00 0.00 O ATOM 226 CB PRO A 436 0.006 -13.949 8.768 1.00 0.00 C ATOM 227 CG PRO A 436 -1.045 -14.681 8.007 1.00 0.00 C ATOM 228 CD PRO A 436 -1.441 -13.809 6.837 1.00 0.00 C ATOM 0 HA PRO A 436 1.110 -12.150 8.118 1.00 0.00 H new ATOM 0 HB2 PRO A 436 0.701 -14.639 9.247 1.00 0.00 H new ATOM 0 HB3 PRO A 436 -0.431 -13.337 9.557 1.00 0.00 H new ATOM 0 HG2 PRO A 436 -0.668 -15.643 7.659 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -1.907 -14.887 8.642 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -1.571 -14.395 5.927 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -2.384 -13.295 7.022 1.00 0.00 H new ATOM 236 N ASP A 437 1.842 -14.189 5.881 1.00 0.00 N ATOM 237 CA ASP A 437 2.932 -14.897 5.219 1.00 0.00 C ATOM 238 C ASP A 437 3.224 -14.288 3.851 1.00 0.00 C ATOM 239 O ASP A 437 3.489 -15.004 2.886 1.00 0.00 O ATOM 240 CB ASP A 437 2.588 -16.380 5.068 1.00 0.00 C ATOM 241 CG ASP A 437 2.676 -17.131 6.381 1.00 0.00 C ATOM 242 OD1 ASP A 437 3.740 -17.066 7.031 1.00 0.00 O ATOM 243 OD2 ASP A 437 1.682 -17.786 6.759 1.00 0.00 O ATOM 0 H ASP A 437 1.033 -14.010 5.287 1.00 0.00 H new ATOM 0 HA ASP A 437 3.824 -14.800 5.838 1.00 0.00 H new ATOM 0 HB2 ASP A 437 1.580 -16.477 4.664 1.00 0.00 H new ATOM 0 HB3 ASP A 437 3.266 -16.836 4.346 1.00 0.00 H new ATOM 248 N ILE A 438 3.172 -12.962 3.776 1.00 0.00 N ATOM 249 CA ILE A 438 3.430 -12.257 2.527 1.00 0.00 C ATOM 250 C ILE A 438 4.722 -11.450 2.608 1.00 0.00 C ATOM 251 O ILE A 438 5.205 -11.141 3.698 1.00 0.00 O ATOM 252 CB ILE A 438 2.270 -11.313 2.163 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.542 -10.629 0.821 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.066 -10.278 3.259 1.00 0.00 C ATOM 255 CD1 ILE A 438 1.310 -10.010 0.198 1.00 0.00 C ATOM 0 H ILE A 438 2.953 -12.355 4.566 1.00 0.00 H new ATOM 0 HA ILE A 438 3.526 -13.016 1.751 1.00 0.00 H new ATOM 0 HB ILE A 438 1.357 -11.902 2.071 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.296 -9.854 0.963 1.00 0.00 H new ATOM 0 HG13 ILE A 438 2.962 -11.359 0.129 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.242 -9.618 2.987 1.00 0.00 H new ATOM 0 HG22 ILE A 438 1.833 -10.782 4.197 1.00 0.00 H new ATOM 0 HG23 ILE A 438 2.977 -9.691 3.379 1.00 0.00 H new ATOM 0 HD11 ILE A 438 1.577 -9.543 -0.750 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.562 -10.784 0.024 1.00 0.00 H new ATOM 0 HD13 ILE A 438 0.902 -9.256 0.871 1.00 0.00 H new ATOM 267 N ASP A 439 5.275 -11.111 1.449 1.00 0.00 N ATOM 268 CA ASP A 439 6.509 -10.337 1.389 1.00 0.00 C ATOM 269 C ASP A 439 6.304 -9.049 0.598 1.00 0.00 C ATOM 270 O ASP A 439 5.195 -8.750 0.158 1.00 0.00 O ATOM 271 CB ASP A 439 7.626 -11.167 0.754 1.00 0.00 C ATOM 272 CG ASP A 439 7.347 -11.499 -0.699 1.00 0.00 C ATOM 273 OD1 ASP A 439 7.353 -10.568 -1.532 1.00 0.00 O ATOM 274 OD2 ASP A 439 7.124 -12.689 -1.003 1.00 0.00 O ATOM 0 H ASP A 439 4.888 -11.360 0.539 1.00 0.00 H new ATOM 0 HA ASP A 439 6.795 -10.075 2.408 1.00 0.00 H new ATOM 0 HB2 ASP A 439 8.566 -10.620 0.824 1.00 0.00 H new ATOM 0 HB3 ASP A 439 7.752 -12.092 1.317 1.00 0.00 H new ATOM 279 N GLU A 440 7.382 -8.290 0.424 1.00 0.00 N ATOM 280 CA GLU A 440 7.318 -7.032 -0.312 1.00 0.00 C ATOM 281 C GLU A 440 6.813 -7.259 -1.734 1.00 0.00 C ATOM 282 O GLU A 440 5.674 -6.925 -2.060 1.00 0.00 O ATOM 283 CB GLU A 440 8.696 -6.367 -0.348 1.00 0.00 C ATOM 284 CG GLU A 440 8.694 -5.001 -1.013 1.00 0.00 C ATOM 285 CD GLU A 440 9.995 -4.250 -0.805 1.00 0.00 C ATOM 286 OE1 GLU A 440 11.036 -4.911 -0.605 1.00 0.00 O ATOM 287 OE2 GLU A 440 9.973 -3.002 -0.843 1.00 0.00 O ATOM 0 H GLU A 440 8.308 -8.524 0.782 1.00 0.00 H new ATOM 0 HA GLU A 440 6.618 -6.374 0.203 1.00 0.00 H new ATOM 0 HB2 GLU A 440 9.068 -6.265 0.672 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.391 -7.019 -0.877 1.00 0.00 H new ATOM 0 HG2 GLU A 440 8.515 -5.121 -2.081 1.00 0.00 H new ATOM 0 HG3 GLU A 440 7.869 -4.409 -0.616 1.00 0.00 H new ATOM 294 N ASP A 441 7.669 -7.827 -2.576 1.00 0.00 N ATOM 295 CA ASP A 441 7.310 -8.099 -3.963 1.00 0.00 C ATOM 296 C ASP A 441 5.844 -8.504 -4.076 1.00 0.00 C ATOM 297 O ASP A 441 5.058 -7.840 -4.752 1.00 0.00 O ATOM 298 CB ASP A 441 8.202 -9.202 -4.536 1.00 0.00 C ATOM 299 CG ASP A 441 8.150 -9.261 -6.050 1.00 0.00 C ATOM 300 OD1 ASP A 441 7.130 -8.826 -6.626 1.00 0.00 O ATOM 301 OD2 ASP A 441 9.128 -9.742 -6.658 1.00 0.00 O ATOM 0 H ASP A 441 8.616 -8.108 -2.323 1.00 0.00 H new ATOM 0 HA ASP A 441 7.461 -7.185 -4.537 1.00 0.00 H new ATOM 0 HB2 ASP A 441 9.231 -9.035 -4.217 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.893 -10.164 -4.127 1.00 0.00 H new ATOM 306 N GLU A 442 5.483 -9.596 -3.410 1.00 0.00 N ATOM 307 CA GLU A 442 4.111 -10.089 -3.438 1.00 0.00 C ATOM 308 C GLU A 442 3.117 -8.933 -3.388 1.00 0.00 C ATOM 309 O GLU A 442 2.228 -8.828 -4.234 1.00 0.00 O ATOM 310 CB GLU A 442 3.863 -11.041 -2.266 1.00 0.00 C ATOM 311 CG GLU A 442 4.740 -12.282 -2.294 1.00 0.00 C ATOM 312 CD GLU A 442 4.148 -13.395 -3.137 1.00 0.00 C ATOM 313 OE1 GLU A 442 3.259 -14.113 -2.634 1.00 0.00 O ATOM 314 OE2 GLU A 442 4.575 -13.547 -4.301 1.00 0.00 O ATOM 0 H GLU A 442 6.121 -10.156 -2.845 1.00 0.00 H new ATOM 0 HA GLU A 442 3.966 -10.630 -4.373 1.00 0.00 H new ATOM 0 HB2 GLU A 442 4.034 -10.506 -1.332 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.816 -11.346 -2.271 1.00 0.00 H new ATOM 0 HG2 GLU A 442 5.723 -12.019 -2.684 1.00 0.00 H new ATOM 0 HG3 GLU A 442 4.887 -12.642 -1.276 1.00 0.00 H new ATOM 321 N ILE A 443 3.273 -8.069 -2.391 1.00 0.00 N ATOM 322 CA ILE A 443 2.390 -6.920 -2.231 1.00 0.00 C ATOM 323 C ILE A 443 2.336 -6.085 -3.506 1.00 0.00 C ATOM 324 O ILE A 443 1.271 -5.623 -3.915 1.00 0.00 O ATOM 325 CB ILE A 443 2.839 -6.024 -1.062 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.782 -6.800 0.256 1.00 0.00 C ATOM 327 CG2 ILE A 443 1.970 -4.777 -0.986 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.617 -6.184 1.356 1.00 0.00 C ATOM 0 H ILE A 443 4.002 -8.143 -1.682 1.00 0.00 H new ATOM 0 HA ILE A 443 1.397 -7.313 -2.016 1.00 0.00 H new ATOM 0 HB ILE A 443 3.870 -5.715 -1.236 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.746 -6.860 0.588 1.00 0.00 H new ATOM 0 HG13 ILE A 443 3.121 -7.821 0.082 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.300 -4.154 -0.155 1.00 0.00 H new ATOM 0 HG22 ILE A 443 2.056 -4.216 -1.917 1.00 0.00 H new ATOM 0 HG23 ILE A 443 0.931 -5.067 -0.832 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.529 -6.786 2.260 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.661 -6.148 1.044 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.264 -5.173 1.558 1.00 0.00 H new ATOM 340 N THR A 444 3.494 -5.897 -4.132 1.00 0.00 N ATOM 341 CA THR A 444 3.580 -5.118 -5.361 1.00 0.00 C ATOM 342 C THR A 444 2.701 -5.717 -6.453 1.00 0.00 C ATOM 343 O THR A 444 1.791 -5.061 -6.959 1.00 0.00 O ATOM 344 CB THR A 444 5.030 -5.036 -5.873 1.00 0.00 C ATOM 345 OG1 THR A 444 5.891 -4.561 -4.832 1.00 0.00 O ATOM 346 CG2 THR A 444 5.127 -4.112 -7.078 1.00 0.00 C ATOM 0 H THR A 444 4.385 -6.274 -3.808 1.00 0.00 H new ATOM 0 HA THR A 444 3.228 -4.114 -5.125 1.00 0.00 H new ATOM 0 HB THR A 444 5.342 -6.036 -6.175 1.00 0.00 H new ATOM 0 HG1 THR A 444 6.811 -4.513 -5.165 1.00 0.00 H new ATOM 0 HG21 THR A 444 6.160 -4.070 -7.422 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.493 -4.491 -7.879 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.797 -3.112 -6.797 1.00 0.00 H new ATOM 354 N ALA A 445 2.978 -6.966 -6.812 1.00 0.00 N ATOM 355 CA ALA A 445 2.210 -7.653 -7.843 1.00 0.00 C ATOM 356 C ALA A 445 0.712 -7.524 -7.589 1.00 0.00 C ATOM 357 O ALA A 445 -0.070 -7.321 -8.518 1.00 0.00 O ATOM 358 CB ALA A 445 2.612 -9.119 -7.911 1.00 0.00 C ATOM 0 H ALA A 445 3.729 -7.523 -6.404 1.00 0.00 H new ATOM 0 HA ALA A 445 2.431 -7.182 -8.801 1.00 0.00 H new ATOM 0 HB1 ALA A 445 2.031 -9.620 -8.685 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.673 -9.195 -8.148 1.00 0.00 H new ATOM 0 HB3 ALA A 445 2.420 -9.594 -6.949 1.00 0.00 H new ATOM 364 N SER A 446 0.318 -7.645 -6.325 1.00 0.00 N ATOM 365 CA SER A 446 -1.087 -7.546 -5.949 1.00 0.00 C ATOM 366 C SER A 446 -1.663 -6.191 -6.349 1.00 0.00 C ATOM 367 O SER A 446 -2.862 -6.061 -6.596 1.00 0.00 O ATOM 368 CB SER A 446 -1.251 -7.758 -4.443 1.00 0.00 C ATOM 369 OG SER A 446 -1.122 -9.128 -4.104 1.00 0.00 O ATOM 0 H SER A 446 0.953 -7.812 -5.544 1.00 0.00 H new ATOM 0 HA SER A 446 -1.634 -8.325 -6.480 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.502 -7.175 -3.907 1.00 0.00 H new ATOM 0 HB3 SER A 446 -2.227 -7.392 -4.125 1.00 0.00 H new ATOM 0 HG SER A 446 -1.229 -9.237 -3.136 1.00 0.00 H new ATOM 375 N PHE A 447 -0.798 -5.183 -6.411 1.00 0.00 N ATOM 376 CA PHE A 447 -1.219 -3.836 -6.779 1.00 0.00 C ATOM 377 C PHE A 447 -0.467 -3.351 -8.015 1.00 0.00 C ATOM 378 O PHE A 447 -0.425 -2.153 -8.298 1.00 0.00 O ATOM 379 CB PHE A 447 -0.988 -2.870 -5.615 1.00 0.00 C ATOM 380 CG PHE A 447 -1.928 -3.085 -4.463 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.654 -4.041 -3.498 1.00 0.00 C ATOM 382 CD2 PHE A 447 -3.084 -2.330 -4.344 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.518 -4.241 -2.438 1.00 0.00 C ATOM 384 CE2 PHE A 447 -3.950 -2.525 -3.286 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.666 -3.481 -2.330 1.00 0.00 C ATOM 0 H PHE A 447 0.198 -5.274 -6.211 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.284 -3.865 -7.011 1.00 0.00 H new ATOM 0 HB2 PHE A 447 0.038 -2.978 -5.262 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.095 -1.847 -5.975 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.756 -4.636 -3.575 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.310 -1.580 -5.088 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -2.295 -4.992 -1.694 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -4.848 -1.931 -3.206 1.00 0.00 H new ATOM 0 HZ PHE A 447 -4.340 -3.634 -1.500 1.00 0.00 H new ATOM 395 N ARG A 448 0.126 -4.289 -8.746 1.00 0.00 N ATOM 396 CA ARG A 448 0.878 -3.957 -9.950 1.00 0.00 C ATOM 397 C ARG A 448 -0.061 -3.710 -11.127 1.00 0.00 C ATOM 398 O ARG A 448 0.104 -2.745 -11.874 1.00 0.00 O ATOM 399 CB ARG A 448 1.857 -5.082 -10.292 1.00 0.00 C ATOM 400 CG ARG A 448 2.668 -4.823 -11.550 1.00 0.00 C ATOM 401 CD ARG A 448 3.634 -3.664 -11.361 1.00 0.00 C ATOM 402 NE ARG A 448 4.503 -3.480 -12.521 1.00 0.00 N ATOM 403 CZ ARG A 448 5.542 -4.261 -12.792 1.00 0.00 C ATOM 404 NH1 ARG A 448 5.841 -5.274 -11.991 1.00 0.00 N ATOM 405 NH2 ARG A 448 6.285 -4.030 -13.867 1.00 0.00 N ATOM 0 H ARG A 448 0.100 -5.285 -8.526 1.00 0.00 H new ATOM 0 HA ARG A 448 1.439 -3.043 -9.757 1.00 0.00 H new ATOM 0 HB2 ARG A 448 2.539 -5.226 -9.454 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.301 -6.011 -10.414 1.00 0.00 H new ATOM 0 HG2 ARG A 448 3.224 -5.722 -11.817 1.00 0.00 H new ATOM 0 HG3 ARG A 448 1.995 -4.606 -12.380 1.00 0.00 H new ATOM 0 HD2 ARG A 448 3.071 -2.748 -11.181 1.00 0.00 H new ATOM 0 HD3 ARG A 448 4.244 -3.842 -10.476 1.00 0.00 H new ATOM 0 HE ARG A 448 4.300 -2.709 -13.158 1.00 0.00 H new ATOM 0 HH11 ARG A 448 5.272 -5.455 -11.164 1.00 0.00 H new ATOM 0 HH12 ARG A 448 6.640 -5.872 -12.202 1.00 0.00 H new ATOM 0 HH21 ARG A 448 6.058 -3.252 -14.486 1.00 0.00 H new ATOM 0 HH22 ARG A 448 7.083 -4.631 -14.074 1.00 0.00 H new ATOM 419 N ARG A 449 -1.045 -4.589 -11.287 1.00 0.00 N ATOM 420 CA ARG A 449 -2.009 -4.468 -12.374 1.00 0.00 C ATOM 421 C ARG A 449 -2.404 -3.010 -12.590 1.00 0.00 C ATOM 422 O ARG A 449 -2.362 -2.504 -13.711 1.00 0.00 O ATOM 423 CB ARG A 449 -3.254 -5.306 -12.076 1.00 0.00 C ATOM 424 CG ARG A 449 -3.995 -4.870 -10.822 1.00 0.00 C ATOM 425 CD ARG A 449 -5.085 -5.862 -10.447 1.00 0.00 C ATOM 426 NE ARG A 449 -6.327 -5.612 -11.175 1.00 0.00 N ATOM 427 CZ ARG A 449 -7.256 -6.538 -11.383 1.00 0.00 C ATOM 428 NH1 ARG A 449 -7.085 -7.769 -10.922 1.00 0.00 N ATOM 429 NH2 ARG A 449 -8.359 -6.233 -12.054 1.00 0.00 N ATOM 0 H ARG A 449 -1.196 -5.393 -10.677 1.00 0.00 H new ATOM 0 HA ARG A 449 -1.540 -4.839 -13.285 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -3.932 -5.249 -12.927 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -2.962 -6.351 -11.971 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -3.290 -4.773 -9.996 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -4.436 -3.886 -10.982 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -4.740 -6.875 -10.655 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -5.275 -5.804 -9.375 1.00 0.00 H new ATOM 0 HE ARG A 449 -6.489 -4.675 -11.544 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -6.238 -8.007 -10.406 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -7.800 -8.478 -11.083 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -8.494 -5.287 -12.410 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -9.072 -6.945 -12.213 1.00 0.00 H new ATOM 443 N PHE A 450 -2.787 -2.339 -11.508 1.00 0.00 N ATOM 444 CA PHE A 450 -3.191 -0.940 -11.579 1.00 0.00 C ATOM 445 C PHE A 450 -2.101 -0.092 -12.228 1.00 0.00 C ATOM 446 O PHE A 450 -2.388 0.819 -13.005 1.00 0.00 O ATOM 447 CB PHE A 450 -3.503 -0.405 -10.180 1.00 0.00 C ATOM 448 CG PHE A 450 -4.507 -1.236 -9.431 1.00 0.00 C ATOM 449 CD1 PHE A 450 -5.865 -1.041 -9.621 1.00 0.00 C ATOM 450 CD2 PHE A 450 -4.091 -2.210 -8.539 1.00 0.00 C ATOM 451 CE1 PHE A 450 -6.791 -1.803 -8.932 1.00 0.00 C ATOM 452 CE2 PHE A 450 -5.012 -2.976 -7.848 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.363 -2.772 -8.046 1.00 0.00 C ATOM 0 H PHE A 450 -2.826 -2.742 -10.572 1.00 0.00 H new ATOM 0 HA PHE A 450 -4.090 -0.878 -12.193 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.579 -0.358 -9.603 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -3.878 0.615 -10.265 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.204 -0.286 -10.315 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -3.035 -2.373 -8.381 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -7.847 -1.640 -9.087 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -4.675 -3.732 -7.155 1.00 0.00 H new ATOM 0 HZ PHE A 450 -7.084 -3.370 -7.509 1.00 0.00 H new ATOM 463 N GLY A 451 -0.849 -0.398 -11.903 1.00 0.00 N ATOM 464 CA GLY A 451 0.265 0.346 -12.462 1.00 0.00 C ATOM 465 C GLY A 451 1.487 0.320 -11.566 1.00 0.00 C ATOM 466 O GLY A 451 1.404 0.017 -10.375 1.00 0.00 O ATOM 0 H GLY A 451 -0.586 -1.147 -11.263 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.523 -0.070 -13.436 1.00 0.00 H new ATOM 0 HA3 GLY A 451 -0.039 1.380 -12.627 1.00 0.00 H new ATOM 470 N PRO A 452 2.655 0.643 -12.141 1.00 0.00 N ATOM 471 CA PRO A 452 3.922 0.661 -11.405 1.00 0.00 C ATOM 472 C PRO A 452 3.798 1.361 -10.056 1.00 0.00 C ATOM 473 O PRO A 452 3.375 2.516 -9.980 1.00 0.00 O ATOM 474 CB PRO A 452 4.858 1.444 -12.329 1.00 0.00 C ATOM 475 CG PRO A 452 4.322 1.209 -13.699 1.00 0.00 C ATOM 476 CD PRO A 452 2.828 1.015 -13.556 1.00 0.00 C ATOM 0 HA PRO A 452 4.273 -0.345 -11.173 1.00 0.00 H new ATOM 0 HB2 PRO A 452 4.861 2.506 -12.082 1.00 0.00 H new ATOM 0 HB3 PRO A 452 5.886 1.093 -12.241 1.00 0.00 H new ATOM 0 HG2 PRO A 452 4.541 2.055 -14.350 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.785 0.331 -14.150 1.00 0.00 H new ATOM 0 HD2 PRO A 452 2.281 1.926 -13.800 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.460 0.235 -14.222 1.00 0.00 H new ATOM 484 N LEU A 453 4.170 0.657 -8.993 1.00 0.00 N ATOM 485 CA LEU A 453 4.101 1.211 -7.645 1.00 0.00 C ATOM 486 C LEU A 453 5.243 0.687 -6.781 1.00 0.00 C ATOM 487 O LEU A 453 6.039 -0.142 -7.223 1.00 0.00 O ATOM 488 CB LEU A 453 2.758 0.867 -6.999 1.00 0.00 C ATOM 489 CG LEU A 453 2.599 -0.571 -6.506 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.462 -0.669 -5.501 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.361 -1.513 -7.677 1.00 0.00 C ATOM 0 H LEU A 453 4.523 -0.299 -9.038 1.00 0.00 H new ATOM 0 HA LEU A 453 4.195 2.294 -7.719 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.601 1.539 -6.155 1.00 0.00 H new ATOM 0 HB3 LEU A 453 1.967 1.072 -7.721 1.00 0.00 H new ATOM 0 HG LEU A 453 3.522 -0.868 -6.008 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.364 -1.700 -5.162 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.674 -0.025 -4.648 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.532 -0.352 -5.972 1.00 0.00 H new ATOM 0 HD21 LEU A 453 2.250 -2.532 -7.307 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.453 -1.217 -8.203 1.00 0.00 H new ATOM 0 HD23 LEU A 453 3.209 -1.465 -8.361 1.00 0.00 H new ATOM 503 N VAL A 454 5.316 1.173 -5.546 1.00 0.00 N ATOM 504 CA VAL A 454 6.359 0.751 -4.618 1.00 0.00 C ATOM 505 C VAL A 454 5.797 0.549 -3.215 1.00 0.00 C ATOM 506 O VAL A 454 4.982 1.341 -2.741 1.00 0.00 O ATOM 507 CB VAL A 454 7.505 1.777 -4.558 1.00 0.00 C ATOM 508 CG1 VAL A 454 6.993 3.122 -4.064 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.630 1.267 -3.670 1.00 0.00 C ATOM 0 H VAL A 454 4.665 1.860 -5.165 1.00 0.00 H new ATOM 0 HA VAL A 454 6.749 -0.196 -4.989 1.00 0.00 H new ATOM 0 HB VAL A 454 7.900 1.913 -5.565 1.00 0.00 H new ATOM 0 HG11 VAL A 454 7.817 3.834 -4.028 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.224 3.490 -4.743 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.570 3.006 -3.066 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.432 2.005 -3.639 1.00 0.00 H new ATOM 0 HG22 VAL A 454 8.251 1.101 -2.662 1.00 0.00 H new ATOM 0 HG23 VAL A 454 9.015 0.330 -4.072 1.00 0.00 H new ATOM 519 N VAL A 455 6.238 -0.517 -2.555 1.00 0.00 N ATOM 520 CA VAL A 455 5.781 -0.822 -1.204 1.00 0.00 C ATOM 521 C VAL A 455 6.770 -0.315 -0.161 1.00 0.00 C ATOM 522 O VAL A 455 7.980 -0.500 -0.296 1.00 0.00 O ATOM 523 CB VAL A 455 5.579 -2.337 -1.010 1.00 0.00 C ATOM 524 CG1 VAL A 455 4.804 -2.612 0.270 1.00 0.00 C ATOM 525 CG2 VAL A 455 4.868 -2.938 -2.213 1.00 0.00 C ATOM 0 H VAL A 455 6.911 -1.184 -2.933 1.00 0.00 H new ATOM 0 HA VAL A 455 4.826 -0.314 -1.071 1.00 0.00 H new ATOM 0 HB VAL A 455 6.558 -2.809 -0.923 1.00 0.00 H new ATOM 0 HG11 VAL A 455 4.671 -3.687 0.391 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.357 -2.217 1.122 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.828 -2.129 0.215 1.00 0.00 H new ATOM 0 HG21 VAL A 455 4.734 -4.009 -2.059 1.00 0.00 H new ATOM 0 HG22 VAL A 455 3.894 -2.464 -2.334 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.466 -2.773 -3.109 1.00 0.00 H new ATOM 535 N ASP A 456 6.248 0.326 0.878 1.00 0.00 N ATOM 536 CA ASP A 456 7.085 0.860 1.947 1.00 0.00 C ATOM 537 C ASP A 456 6.280 1.038 3.230 1.00 0.00 C ATOM 538 O ASP A 456 5.377 1.872 3.297 1.00 0.00 O ATOM 539 CB ASP A 456 7.698 2.196 1.524 1.00 0.00 C ATOM 540 CG ASP A 456 8.407 2.895 2.668 1.00 0.00 C ATOM 541 OD1 ASP A 456 9.481 2.411 3.084 1.00 0.00 O ATOM 542 OD2 ASP A 456 7.889 3.926 3.145 1.00 0.00 O ATOM 0 H ASP A 456 5.249 0.489 1.004 1.00 0.00 H new ATOM 0 HA ASP A 456 7.886 0.146 2.139 1.00 0.00 H new ATOM 0 HB2 ASP A 456 8.404 2.027 0.711 1.00 0.00 H new ATOM 0 HB3 ASP A 456 6.914 2.846 1.135 1.00 0.00 H new ATOM 547 N TRP A 457 6.613 0.249 4.245 1.00 0.00 N ATOM 548 CA TRP A 457 5.920 0.320 5.527 1.00 0.00 C ATOM 549 C TRP A 457 6.721 1.136 6.535 1.00 0.00 C ATOM 550 O TRP A 457 7.937 1.291 6.417 1.00 0.00 O ATOM 551 CB TRP A 457 5.671 -1.087 6.073 1.00 0.00 C ATOM 552 CG TRP A 457 6.833 -2.014 5.880 1.00 0.00 C ATOM 553 CD1 TRP A 457 7.715 -2.433 6.835 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.240 -2.634 4.655 1.00 0.00 C ATOM 555 NE1 TRP A 457 8.646 -3.276 6.277 1.00 0.00 N ATOM 556 CE2 TRP A 457 8.376 -3.416 4.942 1.00 0.00 C ATOM 557 CE3 TRP A 457 6.754 -2.606 3.345 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.032 -4.161 3.966 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.407 -3.346 2.377 1.00 0.00 C ATOM 560 CH2 TRP A 457 8.535 -4.116 2.691 1.00 0.00 C ATOM 0 H TRP A 457 7.358 -0.447 4.206 1.00 0.00 H new ATOM 0 HA TRP A 457 4.962 0.815 5.367 1.00 0.00 H new ATOM 0 HB2 TRP A 457 5.441 -1.021 7.136 1.00 0.00 H new ATOM 0 HB3 TRP A 457 4.794 -1.509 5.583 1.00 0.00 H new ATOM 0 HD1 TRP A 457 7.685 -2.144 7.875 1.00 0.00 H new ATOM 0 HE1 TRP A 457 9.414 -3.725 6.777 1.00 0.00 H new ATOM 0 HE3 TRP A 457 5.884 -2.017 3.094 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 9.902 -4.754 4.206 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 7.041 -3.330 1.361 1.00 0.00 H new ATOM 0 HH2 TRP A 457 9.022 -4.685 1.912 1.00 0.00 H new ATOM 571 N PRO A 458 6.027 1.670 7.551 1.00 0.00 N ATOM 572 CA PRO A 458 6.655 2.478 8.600 1.00 0.00 C ATOM 573 C PRO A 458 7.939 1.847 9.127 1.00 0.00 C ATOM 574 O PRO A 458 8.811 2.538 9.656 1.00 0.00 O ATOM 575 CB PRO A 458 5.591 2.523 9.699 1.00 0.00 C ATOM 576 CG PRO A 458 4.296 2.368 8.978 1.00 0.00 C ATOM 577 CD PRO A 458 4.576 1.525 7.754 1.00 0.00 C ATOM 0 HA PRO A 458 6.951 3.461 8.234 1.00 0.00 H new ATOM 0 HB2 PRO A 458 5.738 1.724 10.425 1.00 0.00 H new ATOM 0 HB3 PRO A 458 5.628 3.464 10.248 1.00 0.00 H new ATOM 0 HG2 PRO A 458 3.553 1.889 9.616 1.00 0.00 H new ATOM 0 HG3 PRO A 458 3.893 3.340 8.694 1.00 0.00 H new ATOM 0 HD2 PRO A 458 4.297 0.484 7.913 1.00 0.00 H new ATOM 0 HD3 PRO A 458 4.014 1.877 6.889 1.00 0.00 H new ATOM 585 N HIS A 459 8.050 0.531 8.981 1.00 0.00 N ATOM 586 CA HIS A 459 9.229 -0.193 9.442 1.00 0.00 C ATOM 587 C HIS A 459 9.929 -0.889 8.278 1.00 0.00 C ATOM 588 O HIS A 459 10.147 -2.101 8.305 1.00 0.00 O ATOM 589 CB HIS A 459 8.839 -1.220 10.505 1.00 0.00 C ATOM 590 CG HIS A 459 8.705 -0.638 11.879 1.00 0.00 C ATOM 591 ND1 HIS A 459 9.088 -1.309 13.021 1.00 0.00 N ATOM 592 CD2 HIS A 459 8.227 0.560 12.290 1.00 0.00 C ATOM 593 CE1 HIS A 459 8.850 -0.549 14.076 1.00 0.00 C ATOM 594 NE2 HIS A 459 8.328 0.590 13.659 1.00 0.00 N ATOM 0 H HIS A 459 7.338 -0.056 8.547 1.00 0.00 H new ATOM 0 HA HIS A 459 9.920 0.528 9.880 1.00 0.00 H new ATOM 0 HB2 HIS A 459 7.894 -1.683 10.222 1.00 0.00 H new ATOM 0 HB3 HIS A 459 9.588 -2.012 10.526 1.00 0.00 H new ATOM 0 HD2 HIS A 459 7.839 1.346 11.659 1.00 0.00 H new ATOM 0 HE1 HIS A 459 9.049 -0.814 15.104 1.00 0.00 H new ATOM 0 HE2 HIS A 459 8.046 1.366 14.257 1.00 0.00 H new ATOM 602 N LYS A 460 10.278 -0.115 7.256 1.00 0.00 N ATOM 603 CA LYS A 460 10.954 -0.656 6.083 1.00 0.00 C ATOM 604 C LYS A 460 12.401 -0.178 6.020 1.00 0.00 C ATOM 605 O LYS A 460 13.314 -0.964 5.769 1.00 0.00 O ATOM 606 CB LYS A 460 10.214 -0.244 4.808 1.00 0.00 C ATOM 607 CG LYS A 460 10.395 -1.219 3.657 1.00 0.00 C ATOM 608 CD LYS A 460 11.642 -0.901 2.849 1.00 0.00 C ATOM 609 CE LYS A 460 12.043 -2.070 1.962 1.00 0.00 C ATOM 610 NZ LYS A 460 13.012 -1.659 0.907 1.00 0.00 N ATOM 0 H LYS A 460 10.104 0.889 7.216 1.00 0.00 H new ATOM 0 HA LYS A 460 10.952 -1.743 6.162 1.00 0.00 H new ATOM 0 HB2 LYS A 460 9.151 -0.150 5.029 1.00 0.00 H new ATOM 0 HB3 LYS A 460 10.563 0.741 4.497 1.00 0.00 H new ATOM 0 HG2 LYS A 460 10.462 -2.235 4.046 1.00 0.00 H new ATOM 0 HG3 LYS A 460 9.520 -1.183 3.008 1.00 0.00 H new ATOM 0 HD2 LYS A 460 11.463 -0.020 2.233 1.00 0.00 H new ATOM 0 HD3 LYS A 460 12.462 -0.657 3.524 1.00 0.00 H new ATOM 0 HE2 LYS A 460 12.485 -2.856 2.575 1.00 0.00 H new ATOM 0 HE3 LYS A 460 11.154 -2.492 1.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 13.261 -2.483 0.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 12.582 -0.927 0.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 13.871 -1.279 1.354 1.00 0.00 H new ATOM 624 N ALA A 461 12.603 1.115 6.249 1.00 0.00 N ATOM 625 CA ALA A 461 13.939 1.697 6.222 1.00 0.00 C ATOM 626 C ALA A 461 14.625 1.560 7.577 1.00 0.00 C ATOM 627 O ALA A 461 15.661 0.906 7.696 1.00 0.00 O ATOM 628 CB ALA A 461 13.871 3.159 5.808 1.00 0.00 C ATOM 0 H ALA A 461 11.858 1.780 6.456 1.00 0.00 H new ATOM 0 HA ALA A 461 14.531 1.151 5.487 1.00 0.00 H new ATOM 0 HB1 ALA A 461 14.876 3.580 5.792 1.00 0.00 H new ATOM 0 HB2 ALA A 461 13.430 3.236 4.814 1.00 0.00 H new ATOM 0 HB3 ALA A 461 13.258 3.711 6.520 1.00 0.00 H new ATOM 634 N GLU A 462 14.041 2.182 8.597 1.00 0.00 N ATOM 635 CA GLU A 462 14.598 2.131 9.943 1.00 0.00 C ATOM 636 C GLU A 462 15.044 0.714 10.293 1.00 0.00 C ATOM 637 O GLU A 462 16.167 0.500 10.751 1.00 0.00 O ATOM 638 CB GLU A 462 13.569 2.620 10.964 1.00 0.00 C ATOM 639 CG GLU A 462 13.496 4.134 11.077 1.00 0.00 C ATOM 640 CD GLU A 462 12.880 4.592 12.385 1.00 0.00 C ATOM 641 OE1 GLU A 462 13.409 4.220 13.453 1.00 0.00 O ATOM 642 OE2 GLU A 462 11.868 5.323 12.339 1.00 0.00 O ATOM 0 H GLU A 462 13.182 2.727 8.516 1.00 0.00 H new ATOM 0 HA GLU A 462 15.469 2.786 9.974 1.00 0.00 H new ATOM 0 HB2 GLU A 462 12.586 2.237 10.689 1.00 0.00 H new ATOM 0 HB3 GLU A 462 13.812 2.202 11.941 1.00 0.00 H new ATOM 0 HG2 GLU A 462 14.499 4.550 10.987 1.00 0.00 H new ATOM 0 HG3 GLU A 462 12.911 4.529 10.246 1.00 0.00 H new ATOM 649 N SER A 463 14.156 -0.251 10.075 1.00 0.00 N ATOM 650 CA SER A 463 14.456 -1.647 10.371 1.00 0.00 C ATOM 651 C SER A 463 14.902 -2.385 9.113 1.00 0.00 C ATOM 652 O SER A 463 15.053 -1.787 8.048 1.00 0.00 O ATOM 653 CB SER A 463 13.230 -2.336 10.974 1.00 0.00 C ATOM 654 OG SER A 463 12.888 -1.766 12.225 1.00 0.00 O ATOM 0 H SER A 463 13.223 -0.092 9.695 1.00 0.00 H new ATOM 0 HA SER A 463 15.271 -1.673 11.094 1.00 0.00 H new ATOM 0 HB2 SER A 463 12.387 -2.249 10.289 1.00 0.00 H new ATOM 0 HB3 SER A 463 13.432 -3.400 11.099 1.00 0.00 H new ATOM 0 HG SER A 463 12.101 -2.223 12.588 1.00 0.00 H new ATOM 660 N LYS A 464 15.111 -3.691 9.244 1.00 0.00 N ATOM 661 CA LYS A 464 15.539 -4.514 8.119 1.00 0.00 C ATOM 662 C LYS A 464 14.465 -5.534 7.752 1.00 0.00 C ATOM 663 O LYS A 464 14.080 -5.652 6.589 1.00 0.00 O ATOM 664 CB LYS A 464 16.846 -5.234 8.456 1.00 0.00 C ATOM 665 CG LYS A 464 18.041 -4.304 8.569 1.00 0.00 C ATOM 666 CD LYS A 464 19.348 -5.078 8.627 1.00 0.00 C ATOM 667 CE LYS A 464 19.547 -5.732 9.986 1.00 0.00 C ATOM 668 NZ LYS A 464 20.029 -4.759 11.005 1.00 0.00 N ATOM 0 H LYS A 464 14.991 -4.202 10.118 1.00 0.00 H new ATOM 0 HA LYS A 464 15.702 -3.859 7.263 1.00 0.00 H new ATOM 0 HB2 LYS A 464 16.723 -5.770 9.397 1.00 0.00 H new ATOM 0 HB3 LYS A 464 17.048 -5.980 7.688 1.00 0.00 H new ATOM 0 HG2 LYS A 464 18.057 -3.625 7.716 1.00 0.00 H new ATOM 0 HG3 LYS A 464 17.941 -3.689 9.464 1.00 0.00 H new ATOM 0 HD2 LYS A 464 19.355 -5.842 7.850 1.00 0.00 H new ATOM 0 HD3 LYS A 464 20.180 -4.405 8.420 1.00 0.00 H new ATOM 0 HE2 LYS A 464 18.606 -6.171 10.319 1.00 0.00 H new ATOM 0 HE3 LYS A 464 20.264 -6.548 9.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 20.152 -5.244 11.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 20.939 -4.359 10.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 19.333 -3.994 11.111 1.00 0.00 H new ATOM 682 N SER A 465 13.985 -6.267 8.751 1.00 0.00 N ATOM 683 CA SER A 465 12.957 -7.278 8.532 1.00 0.00 C ATOM 684 C SER A 465 11.962 -6.820 7.469 1.00 0.00 C ATOM 685 O SER A 465 11.451 -5.702 7.523 1.00 0.00 O ATOM 686 CB SER A 465 12.221 -7.578 9.839 1.00 0.00 C ATOM 687 OG SER A 465 12.964 -8.472 10.649 1.00 0.00 O ATOM 0 H SER A 465 14.291 -6.180 9.720 1.00 0.00 H new ATOM 0 HA SER A 465 13.445 -8.187 8.181 1.00 0.00 H new ATOM 0 HB2 SER A 465 12.046 -6.650 10.383 1.00 0.00 H new ATOM 0 HB3 SER A 465 11.244 -8.008 9.619 1.00 0.00 H new ATOM 0 HG SER A 465 12.473 -8.646 11.479 1.00 0.00 H new ATOM 693 N TYR A 466 11.694 -7.693 6.505 1.00 0.00 N ATOM 694 CA TYR A 466 10.764 -7.379 5.427 1.00 0.00 C ATOM 695 C TYR A 466 9.387 -7.976 5.705 1.00 0.00 C ATOM 696 O TYR A 466 8.738 -8.514 4.807 1.00 0.00 O ATOM 697 CB TYR A 466 11.299 -7.903 4.094 1.00 0.00 C ATOM 698 CG TYR A 466 11.824 -9.319 4.166 1.00 0.00 C ATOM 699 CD1 TYR A 466 10.958 -10.405 4.131 1.00 0.00 C ATOM 700 CD2 TYR A 466 13.187 -9.572 4.271 1.00 0.00 C ATOM 701 CE1 TYR A 466 11.433 -11.700 4.198 1.00 0.00 C ATOM 702 CE2 TYR A 466 13.670 -10.864 4.337 1.00 0.00 C ATOM 703 CZ TYR A 466 12.790 -11.925 4.300 1.00 0.00 C ATOM 704 OH TYR A 466 13.268 -13.213 4.367 1.00 0.00 O ATOM 0 H TYR A 466 12.107 -8.624 6.448 1.00 0.00 H new ATOM 0 HA TYR A 466 10.666 -6.295 5.370 1.00 0.00 H new ATOM 0 HB2 TYR A 466 10.504 -7.857 3.350 1.00 0.00 H new ATOM 0 HB3 TYR A 466 12.097 -7.246 3.749 1.00 0.00 H new ATOM 0 HD1 TYR A 466 9.895 -10.233 4.050 1.00 0.00 H new ATOM 0 HD2 TYR A 466 13.880 -8.744 4.301 1.00 0.00 H new ATOM 0 HE1 TYR A 466 10.745 -12.532 4.171 1.00 0.00 H new ATOM 0 HE2 TYR A 466 14.732 -11.043 4.417 1.00 0.00 H new ATOM 0 HH TYR A 466 14.246 -13.196 4.435 1.00 0.00 H new ATOM 714 N PHE A 467 8.948 -7.876 6.955 1.00 0.00 N ATOM 715 CA PHE A 467 7.648 -8.405 7.353 1.00 0.00 C ATOM 716 C PHE A 467 6.787 -7.315 7.985 1.00 0.00 C ATOM 717 O PHE A 467 6.819 -7.087 9.194 1.00 0.00 O ATOM 718 CB PHE A 467 7.826 -9.564 8.336 1.00 0.00 C ATOM 719 CG PHE A 467 8.239 -10.850 7.678 1.00 0.00 C ATOM 720 CD1 PHE A 467 7.345 -11.560 6.892 1.00 0.00 C ATOM 721 CD2 PHE A 467 9.521 -11.349 7.845 1.00 0.00 C ATOM 722 CE1 PHE A 467 7.722 -12.744 6.287 1.00 0.00 C ATOM 723 CE2 PHE A 467 9.904 -12.532 7.241 1.00 0.00 C ATOM 724 CZ PHE A 467 9.004 -13.229 6.461 1.00 0.00 C ATOM 0 H PHE A 467 9.473 -7.434 7.710 1.00 0.00 H new ATOM 0 HA PHE A 467 7.142 -8.769 6.459 1.00 0.00 H new ATOM 0 HB2 PHE A 467 8.575 -9.288 9.079 1.00 0.00 H new ATOM 0 HB3 PHE A 467 6.890 -9.723 8.871 1.00 0.00 H new ATOM 0 HD1 PHE A 467 6.343 -11.184 6.751 1.00 0.00 H new ATOM 0 HD2 PHE A 467 10.229 -10.807 8.454 1.00 0.00 H new ATOM 0 HE1 PHE A 467 7.015 -13.289 5.679 1.00 0.00 H new ATOM 0 HE2 PHE A 467 10.906 -12.910 7.379 1.00 0.00 H new ATOM 0 HZ PHE A 467 9.301 -14.153 5.987 1.00 0.00 H new ATOM 734 N PRO A 468 5.998 -6.626 7.147 1.00 0.00 N ATOM 735 CA PRO A 468 5.113 -5.548 7.600 1.00 0.00 C ATOM 736 C PRO A 468 4.333 -5.928 8.854 1.00 0.00 C ATOM 737 O PRO A 468 3.359 -6.680 8.804 1.00 0.00 O ATOM 738 CB PRO A 468 4.162 -5.350 6.417 1.00 0.00 C ATOM 739 CG PRO A 468 4.947 -5.776 5.225 1.00 0.00 C ATOM 740 CD PRO A 468 5.909 -6.845 5.694 1.00 0.00 C ATOM 0 HA PRO A 468 5.669 -4.651 7.872 1.00 0.00 H new ATOM 0 HB2 PRO A 468 3.258 -5.949 6.531 1.00 0.00 H new ATOM 0 HB3 PRO A 468 3.846 -4.310 6.332 1.00 0.00 H new ATOM 0 HG2 PRO A 468 4.289 -6.163 4.447 1.00 0.00 H new ATOM 0 HG3 PRO A 468 5.487 -4.932 4.796 1.00 0.00 H new ATOM 0 HD2 PRO A 468 5.540 -7.844 5.462 1.00 0.00 H new ATOM 0 HD3 PRO A 468 6.883 -6.745 5.214 1.00 0.00 H new ATOM 748 N PRO A 469 4.767 -5.397 10.006 1.00 0.00 N ATOM 749 CA PRO A 469 4.122 -5.665 11.295 1.00 0.00 C ATOM 750 C PRO A 469 2.601 -5.608 11.205 1.00 0.00 C ATOM 751 O PRO A 469 2.043 -4.826 10.435 1.00 0.00 O ATOM 752 CB PRO A 469 4.647 -4.544 12.195 1.00 0.00 C ATOM 753 CG PRO A 469 5.975 -4.188 11.621 1.00 0.00 C ATOM 754 CD PRO A 469 5.922 -4.492 10.140 1.00 0.00 C ATOM 0 HA PRO A 469 4.347 -6.666 11.663 1.00 0.00 H new ATOM 0 HB2 PRO A 469 3.973 -3.687 12.194 1.00 0.00 H new ATOM 0 HB3 PRO A 469 4.739 -4.877 13.229 1.00 0.00 H new ATOM 0 HG2 PRO A 469 6.196 -3.134 11.789 1.00 0.00 H new ATOM 0 HG3 PRO A 469 6.768 -4.761 12.103 1.00 0.00 H new ATOM 0 HD2 PRO A 469 5.790 -3.585 9.550 1.00 0.00 H new ATOM 0 HD3 PRO A 469 6.842 -4.964 9.796 1.00 0.00 H new ATOM 762 N LYS A 470 1.934 -6.442 11.996 1.00 0.00 N ATOM 763 CA LYS A 470 0.477 -6.485 12.007 1.00 0.00 C ATOM 764 C LYS A 470 -0.082 -6.379 10.592 1.00 0.00 C ATOM 765 O LYS A 470 -1.205 -5.918 10.390 1.00 0.00 O ATOM 766 CB LYS A 470 -0.081 -5.353 12.873 1.00 0.00 C ATOM 767 CG LYS A 470 0.534 -5.289 14.261 1.00 0.00 C ATOM 768 CD LYS A 470 -0.241 -6.137 15.255 1.00 0.00 C ATOM 769 CE LYS A 470 0.534 -6.327 16.549 1.00 0.00 C ATOM 770 NZ LYS A 470 1.550 -7.410 16.434 1.00 0.00 N ATOM 0 H LYS A 470 2.380 -7.097 12.638 1.00 0.00 H new ATOM 0 HA LYS A 470 0.171 -7.442 12.429 1.00 0.00 H new ATOM 0 HB2 LYS A 470 0.087 -4.403 12.366 1.00 0.00 H new ATOM 0 HB3 LYS A 470 -1.160 -5.477 12.968 1.00 0.00 H new ATOM 0 HG2 LYS A 470 1.568 -5.632 14.218 1.00 0.00 H new ATOM 0 HG3 LYS A 470 0.555 -4.254 14.603 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -1.199 -5.663 15.470 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -0.458 -7.110 14.814 1.00 0.00 H new ATOM 0 HE2 LYS A 470 1.028 -5.393 16.817 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -0.159 -6.564 17.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 2.057 -7.508 17.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 1.077 -8.307 16.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 2.227 -7.172 15.681 1.00 0.00 H new ATOM 784 N GLY A 471 0.709 -6.810 9.614 1.00 0.00 N ATOM 785 CA GLY A 471 0.275 -6.756 8.230 1.00 0.00 C ATOM 786 C GLY A 471 -0.251 -5.389 7.841 1.00 0.00 C ATOM 787 O GLY A 471 -1.447 -5.122 7.955 1.00 0.00 O ATOM 0 H GLY A 471 1.643 -7.196 9.755 1.00 0.00 H new ATOM 0 HA2 GLY A 471 1.110 -7.019 7.580 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -0.503 -7.501 8.067 1.00 0.00 H new ATOM 791 N TYR A 472 0.644 -4.521 7.382 1.00 0.00 N ATOM 792 CA TYR A 472 0.263 -3.173 6.978 1.00 0.00 C ATOM 793 C TYR A 472 1.453 -2.427 6.383 1.00 0.00 C ATOM 794 O TYR A 472 2.583 -2.562 6.852 1.00 0.00 O ATOM 795 CB TYR A 472 -0.293 -2.398 8.174 1.00 0.00 C ATOM 796 CG TYR A 472 0.733 -2.130 9.252 1.00 0.00 C ATOM 797 CD1 TYR A 472 1.818 -1.295 9.014 1.00 0.00 C ATOM 798 CD2 TYR A 472 0.619 -2.713 10.508 1.00 0.00 C ATOM 799 CE1 TYR A 472 2.758 -1.048 9.996 1.00 0.00 C ATOM 800 CE2 TYR A 472 1.553 -2.471 11.496 1.00 0.00 C ATOM 801 CZ TYR A 472 2.621 -1.638 11.235 1.00 0.00 C ATOM 802 OH TYR A 472 3.555 -1.395 12.216 1.00 0.00 O ATOM 0 H TYR A 472 1.638 -4.727 7.281 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.511 -3.254 6.215 1.00 0.00 H new ATOM 0 HB2 TYR A 472 -0.697 -1.448 7.824 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -1.123 -2.958 8.605 1.00 0.00 H new ATOM 0 HD1 TYR A 472 1.928 -0.831 8.045 1.00 0.00 H new ATOM 0 HD2 TYR A 472 -0.215 -3.367 10.715 1.00 0.00 H new ATOM 0 HE1 TYR A 472 3.595 -0.396 9.794 1.00 0.00 H new ATOM 0 HE2 TYR A 472 1.448 -2.931 12.467 1.00 0.00 H new ATOM 0 HH TYR A 472 3.200 -1.680 13.084 1.00 0.00 H new ATOM 812 N ALA A 473 1.190 -1.638 5.346 1.00 0.00 N ATOM 813 CA ALA A 473 2.237 -0.868 4.687 1.00 0.00 C ATOM 814 C ALA A 473 1.643 0.245 3.830 1.00 0.00 C ATOM 815 O ALA A 473 0.424 0.353 3.692 1.00 0.00 O ATOM 816 CB ALA A 473 3.110 -1.781 3.838 1.00 0.00 C ATOM 0 H ALA A 473 0.260 -1.516 4.944 1.00 0.00 H new ATOM 0 HA ALA A 473 2.854 -0.408 5.458 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.888 -1.192 3.352 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.571 -2.537 4.473 1.00 0.00 H new ATOM 0 HB3 ALA A 473 2.497 -2.269 3.080 1.00 0.00 H new ATOM 822 N PHE A 474 2.511 1.072 3.257 1.00 0.00 N ATOM 823 CA PHE A 474 2.072 2.178 2.415 1.00 0.00 C ATOM 824 C PHE A 474 2.492 1.958 0.964 1.00 0.00 C ATOM 825 O PHE A 474 3.620 1.546 0.688 1.00 0.00 O ATOM 826 CB PHE A 474 2.649 3.499 2.929 1.00 0.00 C ATOM 827 CG PHE A 474 1.977 4.001 4.175 1.00 0.00 C ATOM 828 CD1 PHE A 474 0.748 4.638 4.107 1.00 0.00 C ATOM 829 CD2 PHE A 474 2.573 3.836 5.415 1.00 0.00 C ATOM 830 CE1 PHE A 474 0.128 5.102 5.252 1.00 0.00 C ATOM 831 CE2 PHE A 474 1.958 4.297 6.563 1.00 0.00 C ATOM 832 CZ PHE A 474 0.733 4.930 6.482 1.00 0.00 C ATOM 0 H PHE A 474 3.523 0.997 3.361 1.00 0.00 H new ATOM 0 HA PHE A 474 0.984 2.223 2.457 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.713 3.369 3.127 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.559 4.254 2.148 1.00 0.00 H new ATOM 0 HD1 PHE A 474 0.269 4.773 3.148 1.00 0.00 H new ATOM 0 HD2 PHE A 474 3.530 3.341 5.485 1.00 0.00 H new ATOM 0 HE1 PHE A 474 -0.829 5.599 5.185 1.00 0.00 H new ATOM 0 HE2 PHE A 474 2.435 4.163 7.523 1.00 0.00 H new ATOM 0 HZ PHE A 474 0.249 5.290 7.378 1.00 0.00 H new ATOM 842 N LEU A 475 1.578 2.234 0.042 1.00 0.00 N ATOM 843 CA LEU A 475 1.851 2.066 -1.381 1.00 0.00 C ATOM 844 C LEU A 475 1.957 3.419 -2.079 1.00 0.00 C ATOM 845 O LEU A 475 1.073 4.267 -1.949 1.00 0.00 O ATOM 846 CB LEU A 475 0.754 1.226 -2.036 1.00 0.00 C ATOM 847 CG LEU A 475 0.246 0.034 -1.224 1.00 0.00 C ATOM 848 CD1 LEU A 475 -1.073 -0.472 -1.786 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.283 -1.080 -1.206 1.00 0.00 C ATOM 0 H LEU A 475 0.640 2.575 0.254 1.00 0.00 H new ATOM 0 HA LEU A 475 2.805 1.549 -1.484 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.092 1.877 -2.256 1.00 0.00 H new ATOM 0 HB3 LEU A 475 1.128 0.857 -2.991 1.00 0.00 H new ATOM 0 HG LEU A 475 0.078 0.363 -0.199 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -1.419 -1.320 -1.195 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.815 0.325 -1.746 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.932 -0.784 -2.821 1.00 0.00 H new ATOM 0 HD21 LEU A 475 0.904 -1.920 -0.624 1.00 0.00 H new ATOM 0 HD22 LEU A 475 1.484 -1.407 -2.226 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.205 -0.712 -0.755 1.00 0.00 H new ATOM 861 N LEU A 476 3.042 3.613 -2.821 1.00 0.00 N ATOM 862 CA LEU A 476 3.262 4.862 -3.542 1.00 0.00 C ATOM 863 C LEU A 476 3.257 4.628 -5.049 1.00 0.00 C ATOM 864 O LEU A 476 4.296 4.348 -5.648 1.00 0.00 O ATOM 865 CB LEU A 476 4.589 5.492 -3.116 1.00 0.00 C ATOM 866 CG LEU A 476 4.843 5.568 -1.610 1.00 0.00 C ATOM 867 CD1 LEU A 476 6.300 5.901 -1.331 1.00 0.00 C ATOM 868 CD2 LEU A 476 3.926 6.597 -0.965 1.00 0.00 C ATOM 0 H LEU A 476 3.783 2.922 -2.939 1.00 0.00 H new ATOM 0 HA LEU A 476 2.448 5.544 -3.296 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.400 4.926 -3.573 1.00 0.00 H new ATOM 0 HB3 LEU A 476 4.636 6.502 -3.524 1.00 0.00 H new ATOM 0 HG LEU A 476 4.624 4.593 -1.175 1.00 0.00 H new ATOM 0 HD11 LEU A 476 6.462 5.951 -0.254 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.938 5.128 -1.759 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.546 6.863 -1.780 1.00 0.00 H new ATOM 0 HD21 LEU A 476 4.121 6.637 0.107 1.00 0.00 H new ATOM 0 HD22 LEU A 476 4.112 7.577 -1.405 1.00 0.00 H new ATOM 0 HD23 LEU A 476 2.887 6.315 -1.134 1.00 0.00 H new ATOM 880 N PHE A 477 2.082 4.748 -5.658 1.00 0.00 N ATOM 881 CA PHE A 477 1.943 4.552 -7.096 1.00 0.00 C ATOM 882 C PHE A 477 2.642 5.667 -7.868 1.00 0.00 C ATOM 883 O PHE A 477 2.475 6.847 -7.561 1.00 0.00 O ATOM 884 CB PHE A 477 0.463 4.498 -7.484 1.00 0.00 C ATOM 885 CG PHE A 477 -0.245 3.274 -6.977 1.00 0.00 C ATOM 886 CD1 PHE A 477 -0.656 3.192 -5.657 1.00 0.00 C ATOM 887 CD2 PHE A 477 -0.499 2.205 -7.821 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.309 2.068 -5.187 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.151 1.078 -7.358 1.00 0.00 C ATOM 890 CZ PHE A 477 -1.555 1.009 -6.039 1.00 0.00 C ATOM 0 H PHE A 477 1.212 4.980 -5.178 1.00 0.00 H new ATOM 0 HA PHE A 477 2.415 3.604 -7.355 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.039 5.385 -7.097 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.379 4.533 -8.570 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -0.464 4.017 -4.986 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -0.184 2.253 -8.853 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -1.626 2.018 -4.156 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -1.344 0.252 -8.027 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.063 0.128 -5.674 1.00 0.00 H new ATOM 900 N GLN A 478 3.426 5.283 -8.870 1.00 0.00 N ATOM 901 CA GLN A 478 4.152 6.250 -9.685 1.00 0.00 C ATOM 902 C GLN A 478 3.230 7.374 -10.146 1.00 0.00 C ATOM 903 O GLN A 478 3.563 8.552 -10.018 1.00 0.00 O ATOM 904 CB GLN A 478 4.778 5.559 -10.898 1.00 0.00 C ATOM 905 CG GLN A 478 6.056 4.802 -10.574 1.00 0.00 C ATOM 906 CD GLN A 478 7.293 5.671 -10.686 1.00 0.00 C ATOM 907 OE1 GLN A 478 7.620 6.170 -11.763 1.00 0.00 O ATOM 908 NE2 GLN A 478 7.989 5.858 -9.570 1.00 0.00 N ATOM 0 H GLN A 478 3.575 4.310 -9.137 1.00 0.00 H new ATOM 0 HA GLN A 478 4.944 6.681 -9.073 1.00 0.00 H new ATOM 0 HB2 GLN A 478 4.053 4.866 -11.325 1.00 0.00 H new ATOM 0 HB3 GLN A 478 4.992 6.307 -11.662 1.00 0.00 H new ATOM 0 HG2 GLN A 478 5.989 4.400 -9.563 1.00 0.00 H new ATOM 0 HG3 GLN A 478 6.151 3.952 -11.249 1.00 0.00 H new ATOM 0 HE21 GLN A 478 7.682 5.425 -8.699 1.00 0.00 H new ATOM 0 HE22 GLN A 478 8.831 6.434 -9.584 1.00 0.00 H new ATOM 917 N GLU A 479 2.072 7.002 -10.681 1.00 0.00 N ATOM 918 CA GLU A 479 1.104 7.980 -11.161 1.00 0.00 C ATOM 919 C GLU A 479 -0.099 8.060 -10.226 1.00 0.00 C ATOM 920 O GLU A 479 -0.434 7.091 -9.545 1.00 0.00 O ATOM 921 CB GLU A 479 0.641 7.622 -12.575 1.00 0.00 C ATOM 922 CG GLU A 479 1.536 8.181 -13.669 1.00 0.00 C ATOM 923 CD GLU A 479 1.286 9.653 -13.932 1.00 0.00 C ATOM 924 OE1 GLU A 479 0.105 10.061 -13.939 1.00 0.00 O ATOM 925 OE2 GLU A 479 2.269 10.397 -14.130 1.00 0.00 O ATOM 0 H GLU A 479 1.782 6.031 -10.793 1.00 0.00 H new ATOM 0 HA GLU A 479 1.592 8.955 -11.182 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.599 6.537 -12.671 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.373 7.994 -12.721 1.00 0.00 H new ATOM 0 HG2 GLU A 479 2.579 8.038 -13.388 1.00 0.00 H new ATOM 0 HG3 GLU A 479 1.374 7.619 -14.589 1.00 0.00 H new ATOM 932 N GLU A 480 -0.745 9.222 -10.199 1.00 0.00 N ATOM 933 CA GLU A 480 -1.909 9.428 -9.346 1.00 0.00 C ATOM 934 C GLU A 480 -3.128 8.697 -9.903 1.00 0.00 C ATOM 935 O GLU A 480 -3.894 8.088 -9.157 1.00 0.00 O ATOM 936 CB GLU A 480 -2.214 10.922 -9.213 1.00 0.00 C ATOM 937 CG GLU A 480 -0.989 11.767 -8.905 1.00 0.00 C ATOM 938 CD GLU A 480 -1.135 13.200 -9.381 1.00 0.00 C ATOM 939 OE1 GLU A 480 -1.201 13.414 -10.609 1.00 0.00 O ATOM 940 OE2 GLU A 480 -1.184 14.107 -8.523 1.00 0.00 O ATOM 0 H GLU A 480 -0.482 10.034 -10.758 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.681 9.022 -8.361 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -2.666 11.276 -10.140 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -2.952 11.065 -8.423 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -0.809 11.762 -7.830 1.00 0.00 H new ATOM 0 HG3 GLU A 480 -0.115 11.318 -9.377 1.00 0.00 H new ATOM 947 N SER A 481 -3.300 8.764 -11.219 1.00 0.00 N ATOM 948 CA SER A 481 -4.427 8.113 -11.877 1.00 0.00 C ATOM 949 C SER A 481 -4.688 6.737 -11.271 1.00 0.00 C ATOM 950 O SER A 481 -5.775 6.469 -10.758 1.00 0.00 O ATOM 951 CB SER A 481 -4.161 7.980 -13.377 1.00 0.00 C ATOM 952 OG SER A 481 -4.353 9.217 -14.041 1.00 0.00 O ATOM 0 H SER A 481 -2.673 9.263 -11.851 1.00 0.00 H new ATOM 0 HA SER A 481 -5.312 8.731 -11.726 1.00 0.00 H new ATOM 0 HB2 SER A 481 -3.141 7.631 -13.539 1.00 0.00 H new ATOM 0 HB3 SER A 481 -4.826 7.228 -13.802 1.00 0.00 H new ATOM 0 HG SER A 481 -4.175 9.106 -14.998 1.00 0.00 H new ATOM 958 N SER A 482 -3.684 5.868 -11.335 1.00 0.00 N ATOM 959 CA SER A 482 -3.806 4.519 -10.797 1.00 0.00 C ATOM 960 C SER A 482 -4.592 4.524 -9.490 1.00 0.00 C ATOM 961 O SER A 482 -5.513 3.728 -9.303 1.00 0.00 O ATOM 962 CB SER A 482 -2.420 3.911 -10.569 1.00 0.00 C ATOM 963 OG SER A 482 -1.592 4.793 -9.832 1.00 0.00 O ATOM 0 H SER A 482 -2.777 6.075 -11.754 1.00 0.00 H new ATOM 0 HA SER A 482 -4.347 3.912 -11.524 1.00 0.00 H new ATOM 0 HB2 SER A 482 -2.517 2.966 -10.034 1.00 0.00 H new ATOM 0 HB3 SER A 482 -1.955 3.687 -11.529 1.00 0.00 H new ATOM 0 HG SER A 482 -1.374 5.574 -10.383 1.00 0.00 H new ATOM 969 N VAL A 483 -4.222 5.426 -8.587 1.00 0.00 N ATOM 970 CA VAL A 483 -4.892 5.537 -7.297 1.00 0.00 C ATOM 971 C VAL A 483 -6.407 5.473 -7.458 1.00 0.00 C ATOM 972 O VAL A 483 -7.070 4.635 -6.848 1.00 0.00 O ATOM 973 CB VAL A 483 -4.518 6.848 -6.581 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.227 6.944 -5.238 1.00 0.00 C ATOM 975 CG2 VAL A 483 -3.010 6.947 -6.405 1.00 0.00 C ATOM 0 H VAL A 483 -3.461 6.091 -8.725 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.557 4.694 -6.693 1.00 0.00 H new ATOM 0 HB VAL A 483 -4.845 7.685 -7.198 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -4.951 7.877 -4.747 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.306 6.922 -5.394 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -4.933 6.102 -4.611 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -2.763 7.880 -5.897 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -2.657 6.105 -5.809 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.528 6.927 -7.382 1.00 0.00 H new ATOM 985 N GLN A 484 -6.947 6.364 -8.283 1.00 0.00 N ATOM 986 CA GLN A 484 -8.385 6.409 -8.524 1.00 0.00 C ATOM 987 C GLN A 484 -8.923 5.024 -8.866 1.00 0.00 C ATOM 988 O GLN A 484 -9.866 4.541 -8.240 1.00 0.00 O ATOM 989 CB GLN A 484 -8.703 7.387 -9.656 1.00 0.00 C ATOM 990 CG GLN A 484 -10.088 8.006 -9.553 1.00 0.00 C ATOM 991 CD GLN A 484 -10.353 8.620 -8.192 1.00 0.00 C ATOM 992 OE1 GLN A 484 -9.438 9.107 -7.529 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.612 8.599 -7.769 1.00 0.00 N ATOM 0 H GLN A 484 -6.411 7.064 -8.796 1.00 0.00 H new ATOM 0 HA GLN A 484 -8.871 6.752 -7.610 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -7.958 8.182 -9.658 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -8.617 6.867 -10.610 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -10.197 8.772 -10.321 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.839 7.242 -9.755 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -12.339 8.185 -8.352 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -11.852 8.997 -6.861 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.317 4.389 -9.864 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.734 3.059 -10.289 1.00 0.00 C ATOM 1004 C ALA A 485 -8.892 2.125 -9.094 1.00 0.00 C ATOM 1005 O ALA A 485 -9.841 1.344 -9.024 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.734 2.484 -11.282 1.00 0.00 C ATOM 0 H ALA A 485 -7.535 4.775 -10.393 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.704 3.149 -10.778 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -8.058 1.490 -11.591 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.674 3.134 -12.155 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.753 2.416 -10.812 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.956 2.211 -8.155 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.991 1.373 -6.961 1.00 0.00 C ATOM 1014 C LEU A 486 -9.301 1.560 -6.203 1.00 0.00 C ATOM 1015 O LEU A 486 -10.037 0.600 -5.971 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.809 1.702 -6.048 1.00 0.00 C ATOM 1017 CG LEU A 486 -6.440 0.636 -5.016 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.752 -0.542 -5.688 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -5.552 1.228 -3.931 1.00 0.00 C ATOM 0 H LEU A 486 -7.164 2.852 -8.197 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.920 0.332 -7.276 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.936 1.892 -6.672 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -7.031 2.629 -5.519 1.00 0.00 H new ATOM 0 HG LEU A 486 -7.357 0.276 -4.550 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.497 -1.291 -4.938 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.422 -0.982 -6.426 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -4.843 -0.199 -6.182 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -5.300 0.455 -3.205 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.638 1.616 -4.380 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -6.082 2.038 -3.429 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.586 2.800 -5.821 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.809 3.112 -5.092 1.00 0.00 C ATOM 1033 C ILE A 487 -12.016 2.429 -5.725 1.00 0.00 C ATOM 1034 O ILE A 487 -12.775 1.735 -5.048 1.00 0.00 O ATOM 1035 CB ILE A 487 -11.061 4.631 -5.040 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.893 5.341 -4.353 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -12.367 4.926 -4.317 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.832 6.824 -4.644 1.00 0.00 C ATOM 0 H ILE A 487 -8.987 3.605 -6.004 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.675 2.739 -4.077 1.00 0.00 H new ATOM 0 HB ILE A 487 -11.140 5.007 -6.060 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.971 5.193 -3.276 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.959 4.878 -4.671 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -12.532 6.003 -4.288 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -13.191 4.447 -4.845 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -12.315 4.540 -3.299 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -8.980 7.262 -4.125 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -9.722 6.980 -5.717 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -10.750 7.300 -4.300 1.00 0.00 H new ATOM 1050 N ASP A 488 -12.186 2.628 -7.027 1.00 0.00 N ATOM 1051 CA ASP A 488 -13.299 2.029 -7.754 1.00 0.00 C ATOM 1052 C ASP A 488 -13.420 0.542 -7.434 1.00 0.00 C ATOM 1053 O ASP A 488 -14.502 0.052 -7.112 1.00 0.00 O ATOM 1054 CB ASP A 488 -13.119 2.226 -9.260 1.00 0.00 C ATOM 1055 CG ASP A 488 -14.425 2.108 -10.020 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -15.483 2.425 -9.436 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -14.390 1.698 -11.199 1.00 0.00 O ATOM 0 H ASP A 488 -11.567 3.200 -7.601 1.00 0.00 H new ATOM 0 HA ASP A 488 -14.216 2.526 -7.438 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -12.682 3.207 -9.445 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -12.414 1.486 -9.638 1.00 0.00 H new ATOM 1062 N ALA A 489 -12.301 -0.170 -7.525 1.00 0.00 N ATOM 1063 CA ALA A 489 -12.281 -1.600 -7.244 1.00 0.00 C ATOM 1064 C ALA A 489 -12.538 -1.873 -5.766 1.00 0.00 C ATOM 1065 O ALA A 489 -13.234 -2.826 -5.413 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.951 -2.203 -7.671 1.00 0.00 C ATOM 0 H ALA A 489 -11.397 0.220 -7.791 1.00 0.00 H new ATOM 0 HA ALA A 489 -13.081 -2.069 -7.817 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -10.950 -3.271 -7.455 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.808 -2.049 -8.741 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -10.141 -1.722 -7.124 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.973 -1.033 -4.907 1.00 0.00 N ATOM 1073 CA CYS A 490 -12.140 -1.185 -3.466 1.00 0.00 C ATOM 1074 C CYS A 490 -13.610 -1.072 -3.074 1.00 0.00 C ATOM 1075 O CYS A 490 -14.263 -0.067 -3.356 1.00 0.00 O ATOM 1076 CB CYS A 490 -11.319 -0.130 -2.723 1.00 0.00 C ATOM 1077 SG CYS A 490 -9.552 -0.167 -3.103 1.00 0.00 S ATOM 0 H CYS A 490 -11.395 -0.239 -5.183 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.783 -2.176 -3.186 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -11.711 0.858 -2.966 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -11.452 -0.271 -1.650 1.00 0.00 H new ATOM 0 HG CYS A 490 -9.381 -0.032 -4.385 1.00 0.00 H new ATOM 1083 N LEU A 491 -14.124 -2.110 -2.424 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.518 -2.129 -1.995 1.00 0.00 C ATOM 1085 C LEU A 491 -15.799 -1.001 -1.007 1.00 0.00 C ATOM 1086 O LEU A 491 -14.879 -0.443 -0.410 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.858 -3.477 -1.357 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.806 -4.691 -2.286 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.887 -5.980 -1.484 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -16.929 -4.626 -3.311 1.00 0.00 C ATOM 0 H LEU A 491 -13.597 -2.949 -2.183 1.00 0.00 H new ATOM 0 HA LEU A 491 -16.145 -1.982 -2.875 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -15.170 -3.648 -0.529 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.859 -3.413 -0.931 1.00 0.00 H new ATOM 0 HG LEU A 491 -14.855 -4.678 -2.818 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -15.849 -6.833 -2.161 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -15.048 -6.030 -0.790 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -16.822 -6.003 -0.925 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -16.877 -5.497 -3.964 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -17.890 -4.614 -2.797 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -16.825 -3.719 -3.907 1.00 0.00 H new ATOM 1102 N GLU A 492 -17.076 -0.673 -0.838 1.00 0.00 N ATOM 1103 CA GLU A 492 -17.477 0.388 0.079 1.00 0.00 C ATOM 1104 C GLU A 492 -18.307 -0.173 1.230 1.00 0.00 C ATOM 1105 O GLU A 492 -19.387 -0.724 1.018 1.00 0.00 O ATOM 1106 CB GLU A 492 -18.275 1.461 -0.664 1.00 0.00 C ATOM 1107 CG GLU A 492 -18.288 2.807 0.040 1.00 0.00 C ATOM 1108 CD GLU A 492 -19.318 3.758 -0.537 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -19.352 3.914 -1.776 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -20.090 4.345 0.249 1.00 0.00 O ATOM 0 H GLU A 492 -17.850 -1.126 -1.324 1.00 0.00 H new ATOM 0 HA GLU A 492 -16.573 0.838 0.491 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -17.856 1.587 -1.662 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -19.301 1.116 -0.790 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -18.492 2.656 1.100 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -17.299 3.260 -0.033 1.00 0.00 H new ATOM 1117 N GLU A 493 -17.794 -0.030 2.448 1.00 0.00 N ATOM 1118 CA GLU A 493 -18.487 -0.524 3.632 1.00 0.00 C ATOM 1119 C GLU A 493 -18.588 0.565 4.696 1.00 0.00 C ATOM 1120 O GLU A 493 -17.724 0.680 5.566 1.00 0.00 O ATOM 1121 CB GLU A 493 -17.762 -1.745 4.202 1.00 0.00 C ATOM 1122 CG GLU A 493 -18.665 -2.669 5.003 1.00 0.00 C ATOM 1123 CD GLU A 493 -19.404 -1.946 6.111 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -18.752 -1.194 6.866 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -20.634 -2.131 6.224 1.00 0.00 O ATOM 0 H GLU A 493 -16.901 0.424 2.641 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.495 -0.815 3.338 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -17.316 -2.308 3.382 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -16.945 -1.407 4.839 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -19.388 -3.135 4.333 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -18.067 -3.472 5.434 1.00 0.00 H new ATOM 1132 N ASP A 494 -19.649 1.361 4.621 1.00 0.00 N ATOM 1133 CA ASP A 494 -19.865 2.440 5.578 1.00 0.00 C ATOM 1134 C ASP A 494 -18.795 3.518 5.431 1.00 0.00 C ATOM 1135 O ASP A 494 -18.235 3.990 6.419 1.00 0.00 O ATOM 1136 CB ASP A 494 -19.861 1.892 7.006 1.00 0.00 C ATOM 1137 CG ASP A 494 -20.505 2.846 7.993 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -21.751 2.872 8.068 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -19.761 3.567 8.691 1.00 0.00 O ATOM 0 H ASP A 494 -20.373 1.279 3.907 1.00 0.00 H new ATOM 0 HA ASP A 494 -20.837 2.887 5.371 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -20.390 0.939 7.028 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -18.834 1.694 7.313 1.00 0.00 H new ATOM 1144 N GLY A 495 -18.517 3.904 4.189 1.00 0.00 N ATOM 1145 CA GLY A 495 -17.515 4.922 3.935 1.00 0.00 C ATOM 1146 C GLY A 495 -16.126 4.340 3.767 1.00 0.00 C ATOM 1147 O GLY A 495 -15.365 4.770 2.899 1.00 0.00 O ATOM 0 H GLY A 495 -18.968 3.529 3.354 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -17.784 5.476 3.036 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -17.509 5.635 4.759 1.00 0.00 H new ATOM 1151 N LYS A 496 -15.792 3.360 4.599 1.00 0.00 N ATOM 1152 CA LYS A 496 -14.485 2.717 4.540 1.00 0.00 C ATOM 1153 C LYS A 496 -14.342 1.892 3.265 1.00 0.00 C ATOM 1154 O LYS A 496 -15.309 1.300 2.784 1.00 0.00 O ATOM 1155 CB LYS A 496 -14.277 1.823 5.764 1.00 0.00 C ATOM 1156 CG LYS A 496 -14.152 2.595 7.067 1.00 0.00 C ATOM 1157 CD LYS A 496 -14.243 1.674 8.272 1.00 0.00 C ATOM 1158 CE LYS A 496 -14.839 2.387 9.475 1.00 0.00 C ATOM 1159 NZ LYS A 496 -16.327 2.409 9.426 1.00 0.00 N ATOM 0 H LYS A 496 -16.409 2.993 5.323 1.00 0.00 H new ATOM 0 HA LYS A 496 -13.724 3.498 4.535 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -15.113 1.128 5.842 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -13.378 1.225 5.618 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -13.201 3.127 7.086 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -14.939 3.347 7.122 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -14.854 0.806 8.023 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -13.249 1.303 8.523 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -14.513 1.891 10.389 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -14.462 3.409 9.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -16.695 2.904 10.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -16.639 2.905 8.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -16.688 1.434 9.414 1.00 0.00 H new ATOM 1173 N LEU A 497 -13.130 1.855 2.722 1.00 0.00 N ATOM 1174 CA LEU A 497 -12.860 1.101 1.503 1.00 0.00 C ATOM 1175 C LEU A 497 -12.072 -0.169 1.812 1.00 0.00 C ATOM 1176 O LEU A 497 -11.283 -0.208 2.756 1.00 0.00 O ATOM 1177 CB LEU A 497 -12.085 1.965 0.506 1.00 0.00 C ATOM 1178 CG LEU A 497 -12.892 3.047 -0.212 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -11.967 3.994 -0.960 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -13.898 2.418 -1.165 1.00 0.00 C ATOM 0 H LEU A 497 -12.319 2.339 3.107 1.00 0.00 H new ATOM 0 HA LEU A 497 -13.815 0.816 1.062 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -11.261 2.445 1.035 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -11.643 1.310 -0.245 1.00 0.00 H new ATOM 0 HG LEU A 497 -13.440 3.621 0.535 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -12.559 4.757 -1.465 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -11.286 4.470 -0.255 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -11.392 3.434 -1.697 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -14.463 3.203 -1.667 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -13.371 1.819 -1.907 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -14.582 1.781 -0.604 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.291 -1.204 1.009 1.00 0.00 N ATOM 1193 CA TYR A 498 -11.602 -2.476 1.197 1.00 0.00 C ATOM 1194 C TYR A 498 -11.368 -3.171 -0.141 1.00 0.00 C ATOM 1195 O TYR A 498 -12.275 -3.274 -0.968 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.411 -3.386 2.122 1.00 0.00 C ATOM 1197 CG TYR A 498 -12.605 -2.820 3.511 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -11.638 -2.992 4.493 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -13.754 -2.113 3.840 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -11.811 -2.477 5.763 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -13.935 -1.593 5.107 1.00 0.00 C ATOM 1202 CZ TYR A 498 -12.961 -1.778 6.065 1.00 0.00 C ATOM 1203 OH TYR A 498 -13.137 -1.262 7.329 1.00 0.00 O ATOM 0 H TYR A 498 -12.940 -1.188 0.222 1.00 0.00 H new ATOM 0 HA TYR A 498 -10.634 -2.272 1.655 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.388 -3.570 1.674 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -11.909 -4.351 2.199 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -10.736 -3.538 4.260 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -14.520 -1.967 3.092 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -11.050 -2.621 6.515 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -14.834 -1.045 5.346 1.00 0.00 H new ATOM 0 HH TYR A 498 -12.264 -1.043 7.717 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.145 -3.646 -0.347 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.789 -4.333 -1.584 1.00 0.00 C ATOM 1215 C LEU A 499 -9.409 -5.785 -1.310 1.00 0.00 C ATOM 1216 O LEU A 499 -9.049 -6.142 -0.188 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.631 -3.612 -2.275 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.357 -4.018 -3.724 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.550 -3.685 -4.606 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -7.101 -3.332 -4.242 1.00 0.00 C ATOM 0 H LEU A 499 -9.383 -3.568 0.326 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.659 -4.322 -2.241 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.830 -2.541 -2.250 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.725 -3.782 -1.694 1.00 0.00 H new ATOM 0 HG LEU A 499 -8.197 -5.096 -3.755 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -9.337 -3.981 -5.633 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.428 -4.223 -4.248 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.741 -2.613 -4.570 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.922 -3.633 -5.274 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -7.232 -2.251 -4.196 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -6.249 -3.621 -3.627 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.488 -6.616 -2.343 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.151 -8.029 -2.215 1.00 0.00 C ATOM 1234 C CYS A 500 -7.777 -8.317 -2.813 1.00 0.00 C ATOM 1235 O CYS A 500 -7.478 -7.906 -3.935 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.210 -8.892 -2.902 1.00 0.00 C ATOM 1237 SG CYS A 500 -11.872 -8.708 -2.214 1.00 0.00 S ATOM 0 H CYS A 500 -9.782 -6.336 -3.278 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.124 -8.276 -1.154 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.237 -8.640 -3.962 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -9.913 -9.938 -2.831 1.00 0.00 H new ATOM 0 HG CYS A 500 -12.697 -9.475 -2.862 1.00 0.00 H new ATOM 1243 N VAL A 501 -6.944 -9.024 -2.056 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.602 -9.366 -2.511 1.00 0.00 C ATOM 1245 C VAL A 501 -5.311 -10.848 -2.300 1.00 0.00 C ATOM 1246 O VAL A 501 -5.117 -11.298 -1.171 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.532 -8.535 -1.778 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -4.527 -7.102 -2.288 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.766 -8.573 -0.275 1.00 0.00 C ATOM 0 H VAL A 501 -7.175 -9.371 -1.125 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.562 -9.139 -3.576 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.554 -8.972 -1.982 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -3.765 -6.530 -1.759 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -4.308 -7.097 -3.356 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -5.504 -6.651 -2.115 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -4.001 -7.981 0.227 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.750 -8.162 -0.049 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.715 -9.604 0.075 1.00 0.00 H new ATOM 1259 N SER A 502 -5.282 -11.601 -3.394 1.00 0.00 N ATOM 1260 CA SER A 502 -5.018 -13.034 -3.329 1.00 0.00 C ATOM 1261 C SER A 502 -3.524 -13.304 -3.175 1.00 0.00 C ATOM 1262 O SER A 502 -2.693 -12.618 -3.770 1.00 0.00 O ATOM 1263 CB SER A 502 -5.547 -13.729 -4.586 1.00 0.00 C ATOM 1264 OG SER A 502 -4.807 -13.343 -5.731 1.00 0.00 O ATOM 0 H SER A 502 -5.438 -11.243 -4.336 1.00 0.00 H new ATOM 0 HA SER A 502 -5.534 -13.435 -2.457 1.00 0.00 H new ATOM 0 HB2 SER A 502 -5.489 -14.810 -4.459 1.00 0.00 H new ATOM 0 HB3 SER A 502 -6.599 -13.480 -4.728 1.00 0.00 H new ATOM 0 HG SER A 502 -5.163 -13.802 -6.521 1.00 0.00 H new ATOM 1270 N SER A 503 -3.191 -14.310 -2.372 1.00 0.00 N ATOM 1271 CA SER A 503 -1.798 -14.670 -2.135 1.00 0.00 C ATOM 1272 C SER A 503 -1.583 -16.167 -2.337 1.00 0.00 C ATOM 1273 O SER A 503 -2.481 -16.983 -2.131 1.00 0.00 O ATOM 1274 CB SER A 503 -1.379 -14.269 -0.720 1.00 0.00 C ATOM 1275 OG SER A 503 -1.615 -12.890 -0.489 1.00 0.00 O ATOM 0 H SER A 503 -3.867 -14.890 -1.875 1.00 0.00 H new ATOM 0 HA SER A 503 -1.181 -14.131 -2.854 1.00 0.00 H new ATOM 0 HB2 SER A 503 -1.932 -14.863 0.008 1.00 0.00 H new ATOM 0 HB3 SER A 503 -0.322 -14.490 -0.574 1.00 0.00 H new ATOM 0 HG SER A 503 -2.457 -12.780 0.000 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.361 -16.538 -2.749 1.00 0.00 N ATOM 1282 CA PRO A 504 0.003 -17.937 -2.987 1.00 0.00 C ATOM 1283 C PRO A 504 -0.466 -18.857 -1.864 1.00 0.00 C ATOM 1284 O PRO A 504 -0.694 -20.048 -2.078 1.00 0.00 O ATOM 1285 CB PRO A 504 1.532 -17.901 -3.045 1.00 0.00 C ATOM 1286 CG PRO A 504 1.861 -16.526 -3.514 1.00 0.00 C ATOM 1287 CD PRO A 504 0.759 -15.619 -3.013 1.00 0.00 C ATOM 0 HA PRO A 504 -0.462 -18.331 -3.891 1.00 0.00 H new ATOM 0 HB2 PRO A 504 1.970 -18.101 -2.067 1.00 0.00 H new ATOM 0 HB3 PRO A 504 1.920 -18.656 -3.729 1.00 0.00 H new ATOM 0 HG2 PRO A 504 2.829 -16.207 -3.128 1.00 0.00 H new ATOM 0 HG3 PRO A 504 1.924 -16.493 -4.602 1.00 0.00 H new ATOM 0 HD2 PRO A 504 1.059 -15.085 -2.111 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.492 -14.866 -3.755 1.00 0.00 H new ATOM 1295 N THR A 505 -0.607 -18.297 -0.667 1.00 0.00 N ATOM 1296 CA THR A 505 -1.048 -19.067 0.489 1.00 0.00 C ATOM 1297 C THR A 505 -2.456 -18.666 0.913 1.00 0.00 C ATOM 1298 O THR A 505 -3.387 -19.469 0.846 1.00 0.00 O ATOM 1299 CB THR A 505 -0.093 -18.884 1.684 1.00 0.00 C ATOM 1300 OG1 THR A 505 0.159 -17.491 1.900 1.00 0.00 O ATOM 1301 CG2 THR A 505 1.222 -19.610 1.442 1.00 0.00 C ATOM 0 H THR A 505 -0.422 -17.313 -0.473 1.00 0.00 H new ATOM 0 HA THR A 505 -1.047 -20.115 0.189 1.00 0.00 H new ATOM 0 HB THR A 505 -0.567 -19.309 2.568 1.00 0.00 H new ATOM 0 HG1 THR A 505 0.765 -17.383 2.662 1.00 0.00 H new ATOM 0 HG21 THR A 505 1.880 -19.466 2.299 1.00 0.00 H new ATOM 0 HG22 THR A 505 1.030 -20.674 1.306 1.00 0.00 H new ATOM 0 HG23 THR A 505 1.699 -19.210 0.547 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.605 -17.419 1.348 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.901 -16.912 1.781 1.00 0.00 C ATOM 1311 C ILE A 506 -4.780 -16.558 0.586 1.00 0.00 C ATOM 1312 O ILE A 506 -4.289 -16.106 -0.449 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.748 -15.668 2.677 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.906 -16.002 3.910 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -5.115 -15.141 3.089 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -3.637 -16.843 4.933 1.00 0.00 C ATOM 0 H ILE A 506 -1.845 -16.742 1.410 1.00 0.00 H new ATOM 0 HA ILE A 506 -4.375 -17.708 2.355 1.00 0.00 H new ATOM 0 HB ILE A 506 -3.236 -14.890 2.110 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -2.007 -16.530 3.593 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.581 -15.074 4.380 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.991 -14.262 3.722 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.684 -14.870 2.199 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.651 -15.913 3.641 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -2.979 -17.040 5.779 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -4.522 -16.308 5.279 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -3.938 -17.787 4.479 1.00 0.00 H new ATOM 1328 N LYS A 507 -6.084 -16.765 0.736 1.00 0.00 N ATOM 1329 CA LYS A 507 -7.034 -16.466 -0.329 1.00 0.00 C ATOM 1330 C LYS A 507 -7.358 -14.976 -0.366 1.00 0.00 C ATOM 1331 O LYS A 507 -7.019 -14.234 0.556 1.00 0.00 O ATOM 1332 CB LYS A 507 -8.319 -17.274 -0.136 1.00 0.00 C ATOM 1333 CG LYS A 507 -8.296 -18.627 -0.825 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.633 -18.507 -2.302 1.00 0.00 C ATOM 1335 CE LYS A 507 -8.414 -19.823 -3.033 1.00 0.00 C ATOM 1336 NZ LYS A 507 -9.386 -20.865 -2.602 1.00 0.00 N ATOM 0 H LYS A 507 -6.507 -17.139 1.585 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.577 -16.744 -1.279 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.489 -17.422 0.931 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -9.162 -16.697 -0.516 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -7.310 -19.077 -0.711 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -9.009 -19.295 -0.341 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -9.671 -18.195 -2.415 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -8.016 -17.731 -2.755 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -8.507 -19.662 -4.107 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -7.399 -20.175 -2.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -9.215 -21.741 -3.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -9.269 -21.050 -1.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -10.355 -20.533 -2.784 1.00 0.00 H new ATOM 1350 N ASP A 508 -8.017 -14.545 -1.436 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.390 -13.143 -1.592 1.00 0.00 C ATOM 1352 C ASP A 508 -8.735 -12.520 -0.243 1.00 0.00 C ATOM 1353 O ASP A 508 -9.836 -12.707 0.276 1.00 0.00 O ATOM 1354 CB ASP A 508 -9.577 -13.012 -2.547 1.00 0.00 C ATOM 1355 CG ASP A 508 -9.164 -13.123 -4.002 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -8.631 -14.184 -4.388 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -9.375 -12.149 -4.754 1.00 0.00 O ATOM 0 H ASP A 508 -8.304 -15.146 -2.208 1.00 0.00 H new ATOM 0 HA ASP A 508 -7.537 -12.610 -2.011 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -10.309 -13.787 -2.320 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -10.067 -12.052 -2.384 1.00 0.00 H new ATOM 1362 N LYS A 509 -7.787 -11.779 0.321 1.00 0.00 N ATOM 1363 CA LYS A 509 -7.990 -11.128 1.610 1.00 0.00 C ATOM 1364 C LYS A 509 -8.442 -9.683 1.423 1.00 0.00 C ATOM 1365 O LYS A 509 -7.880 -8.929 0.628 1.00 0.00 O ATOM 1366 CB LYS A 509 -6.701 -11.168 2.433 1.00 0.00 C ATOM 1367 CG LYS A 509 -6.921 -10.943 3.919 1.00 0.00 C ATOM 1368 CD LYS A 509 -7.540 -12.162 4.582 1.00 0.00 C ATOM 1369 CE LYS A 509 -7.180 -12.238 6.058 1.00 0.00 C ATOM 1370 NZ LYS A 509 -5.731 -12.511 6.262 1.00 0.00 N ATOM 0 H LYS A 509 -6.870 -11.614 -0.095 1.00 0.00 H new ATOM 0 HA LYS A 509 -8.771 -11.669 2.144 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.217 -12.134 2.288 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -6.016 -10.408 2.057 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -5.969 -10.711 4.398 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -7.570 -10.079 4.065 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -8.624 -12.126 4.472 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -7.198 -13.065 4.076 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -7.445 -11.300 6.545 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -7.768 -13.022 6.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -5.586 -12.933 7.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -5.396 -13.170 5.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -5.197 -11.621 6.197 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.479 -9.284 2.175 1.00 0.00 N ATOM 1385 CA PRO A 510 -10.027 -7.926 2.111 1.00 0.00 C ATOM 1386 C PRO A 510 -9.197 -6.928 2.912 1.00 0.00 C ATOM 1387 O PRO A 510 -9.547 -6.577 4.038 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.421 -8.077 2.726 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.300 -9.231 3.661 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.196 -10.129 3.144 1.00 0.00 C ATOM 0 HA PRO A 510 -10.035 -7.537 1.093 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.722 -7.171 3.252 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -12.173 -8.265 1.960 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -11.071 -8.884 4.669 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.242 -9.777 3.718 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -9.540 -10.459 3.949 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -10.598 -11.026 2.672 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.095 -6.474 2.322 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.216 -5.515 2.980 1.00 0.00 C ATOM 1400 C VAL A 511 -7.880 -4.147 3.091 1.00 0.00 C ATOM 1401 O VAL A 511 -8.719 -3.786 2.266 1.00 0.00 O ATOM 1402 CB VAL A 511 -5.882 -5.367 2.225 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.077 -6.655 2.305 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -6.131 -4.973 0.777 1.00 0.00 C ATOM 0 H VAL A 511 -7.790 -6.755 1.390 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.018 -5.901 3.980 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.302 -4.575 2.699 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.138 -6.531 1.766 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -4.868 -6.889 3.349 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -5.648 -7.469 1.858 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -5.178 -4.873 0.258 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.731 -5.741 0.289 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.663 -4.022 0.745 1.00 0.00 H new ATOM 1414 N GLN A 512 -7.498 -3.391 4.114 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.056 -2.062 4.332 1.00 0.00 C ATOM 1416 C GLN A 512 -7.268 -1.007 3.563 1.00 0.00 C ATOM 1417 O GLN A 512 -6.174 -0.616 3.971 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.060 -1.725 5.825 1.00 0.00 C ATOM 1419 CG GLN A 512 -8.893 -0.502 6.170 1.00 0.00 C ATOM 1420 CD GLN A 512 -8.785 -0.116 7.632 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -7.880 -0.562 8.339 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -9.709 0.718 8.095 1.00 0.00 N ATOM 0 H GLN A 512 -6.804 -3.676 4.805 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.082 -2.062 3.964 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -8.440 -2.582 6.381 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -7.034 -1.560 6.155 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -8.573 0.337 5.552 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -9.937 -0.698 5.926 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -10.441 1.063 7.475 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -9.686 1.013 9.071 1.00 0.00 H new ATOM 1431 N ILE A 513 -7.830 -0.551 2.449 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.180 0.459 1.624 1.00 0.00 C ATOM 1433 C ILE A 513 -7.703 1.854 1.948 1.00 0.00 C ATOM 1434 O ILE A 513 -8.834 2.200 1.606 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.390 0.180 0.123 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -6.879 -1.216 -0.235 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.688 1.238 -0.715 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -5.371 -1.334 -0.204 1.00 0.00 C ATOM 0 H ILE A 513 -8.734 -0.865 2.097 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.114 0.412 1.849 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.457 0.222 -0.094 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -7.306 -1.940 0.459 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.236 -1.480 -1.230 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -6.845 1.028 -1.773 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -7.095 2.221 -0.476 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.620 1.225 -0.497 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -5.080 -2.351 -0.468 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -4.937 -0.635 -0.919 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.008 -1.101 0.797 1.00 0.00 H new ATOM 1450 N ARG A 514 -6.871 2.653 2.609 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.249 4.011 2.979 1.00 0.00 C ATOM 1452 C ARG A 514 -6.255 5.024 2.419 1.00 0.00 C ATOM 1453 O ARG A 514 -5.228 5.326 3.028 1.00 0.00 O ATOM 1454 CB ARG A 514 -7.326 4.145 4.501 1.00 0.00 C ATOM 1455 CG ARG A 514 -7.389 5.585 4.984 1.00 0.00 C ATOM 1456 CD ARG A 514 -7.966 5.677 6.388 1.00 0.00 C ATOM 1457 NE ARG A 514 -7.004 5.256 7.403 1.00 0.00 N ATOM 1458 CZ ARG A 514 -7.321 5.051 8.677 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -8.569 5.229 9.089 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -6.390 4.668 9.541 1.00 0.00 N ATOM 0 H ARG A 514 -5.931 2.383 2.899 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.231 4.217 2.552 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -8.206 3.612 4.860 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -6.456 3.660 4.944 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -6.389 6.018 4.971 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -8.000 6.173 4.299 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -8.276 6.703 6.586 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -8.859 5.055 6.455 1.00 0.00 H new ATOM 0 HE ARG A 514 -6.035 5.111 7.118 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -9.287 5.524 8.428 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -8.811 5.071 10.067 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -5.429 4.530 9.228 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -6.635 4.511 10.519 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.565 5.562 1.229 1.00 0.00 N ATOM 1475 CA PRO A 515 -5.712 6.548 0.560 1.00 0.00 C ATOM 1476 C PRO A 515 -5.247 7.650 1.507 1.00 0.00 C ATOM 1477 O PRO A 515 -5.999 8.575 1.815 1.00 0.00 O ATOM 1478 CB PRO A 515 -6.622 7.126 -0.526 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.586 6.032 -0.833 1.00 0.00 C ATOM 1480 CD PRO A 515 -7.772 5.248 0.447 1.00 0.00 C ATOM 0 HA PRO A 515 -4.797 6.100 0.174 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -7.137 8.021 -0.176 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -6.052 7.411 -1.410 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.536 6.439 -1.180 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -7.204 5.391 -1.628 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.679 5.549 0.972 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -7.856 4.179 0.253 1.00 0.00 H new ATOM 1488 N TRP A 516 -4.005 7.545 1.965 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.440 8.533 2.876 1.00 0.00 C ATOM 1490 C TRP A 516 -3.963 9.930 2.557 1.00 0.00 C ATOM 1491 O TRP A 516 -3.799 10.423 1.442 1.00 0.00 O ATOM 1492 CB TRP A 516 -1.913 8.517 2.797 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.256 9.405 3.810 1.00 0.00 C ATOM 1494 CD1 TRP A 516 -0.567 10.559 3.564 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -1.224 9.211 5.228 1.00 0.00 C ATOM 1496 NE1 TRP A 516 -0.109 11.093 4.744 1.00 0.00 N ATOM 1497 CE2 TRP A 516 -0.500 10.286 5.779 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -1.739 8.236 6.086 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 -0.278 10.410 7.148 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -1.518 8.360 7.444 1.00 0.00 C ATOM 1501 CH2 TRP A 516 -0.794 9.440 7.965 1.00 0.00 C ATOM 0 H TRP A 516 -3.370 6.785 1.720 1.00 0.00 H new ATOM 0 HA TRP A 516 -3.747 8.273 3.889 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -1.560 7.495 2.937 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.605 8.827 1.798 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -0.406 10.988 2.586 1.00 0.00 H new ATOM 0 HE1 TRP A 516 0.434 11.952 4.835 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -2.300 7.400 5.695 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 0.281 11.241 7.551 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -1.910 7.611 8.116 1.00 0.00 H new ATOM 0 HH2 TRP A 516 -0.640 9.509 9.032 1.00 0.00 H new