USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=17 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 Set 1.1: A 503 SER OG : rot 180:sc= 0.339 USER MOD Set 1.2: A 505 THR OG1 : rot -114:sc= 0.715 USER MOD Set 2.1: A 496 LYS NZ :NH3+ 140:sc= -0.16 (180deg=-2.21) USER MOD Set 2.2: A 498 TYR OH : rot 180:sc= 0 USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 428 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 THR OG1 : rot 180:sc= 0.045 USER MOD Single : A 446 SER OG : rot 130:sc= -2.38! USER MOD Single : A 459 HIS : no HE2:sc= 0.0218 X(o=0.022,f=-0.2) USER MOD Single : A 460 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 463 SER OG : rot 99:sc= 0.76 USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 465 SER OG : rot 180:sc= 0 USER MOD Single : A 466 TYR OH : rot 180:sc= 0 USER MOD Single : A 470 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 472 TYR OH : rot 180:sc= 0 USER MOD Single : A 478 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot -78:sc= 0.318 USER MOD Single : A 484 GLN : amide:sc=-0.00411 X(o=-0.0041,f=-0.0041) USER MOD Single : A 490 CYS SG : rot 72:sc= -4.9! USER MOD Single : A 500 CYS SG : rot 33:sc= 0.0918 USER MOD Single : A 502 SER OG : rot 32:sc= 0.51 USER MOD Single : A 507 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 512 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD ----------------------------------------------------------------- ATOM 66 N SER A 426 -4.883 11.173 -2.772 1.00 0.00 N ATOM 67 CA SER A 426 -3.431 11.147 -2.639 1.00 0.00 C ATOM 68 C SER A 426 -2.860 9.840 -3.179 1.00 0.00 C ATOM 69 O SER A 426 -3.576 8.848 -3.321 1.00 0.00 O ATOM 70 CB SER A 426 -3.028 11.327 -1.175 1.00 0.00 C ATOM 71 OG SER A 426 -1.691 11.783 -1.066 1.00 0.00 O ATOM 0 HA SER A 426 -3.022 11.971 -3.224 1.00 0.00 H new ATOM 0 HB2 SER A 426 -3.699 12.040 -0.695 1.00 0.00 H new ATOM 0 HB3 SER A 426 -3.137 10.380 -0.646 1.00 0.00 H new ATOM 0 HG SER A 426 -1.459 11.892 -0.120 1.00 0.00 H new ATOM 77 N ARG A 427 -1.565 9.846 -3.478 1.00 0.00 N ATOM 78 CA ARG A 427 -0.896 8.661 -4.003 1.00 0.00 C ATOM 79 C ARG A 427 -0.632 7.649 -2.892 1.00 0.00 C ATOM 80 O ARG A 427 -0.787 6.443 -3.087 1.00 0.00 O ATOM 81 CB ARG A 427 0.421 9.050 -4.677 1.00 0.00 C ATOM 82 CG ARG A 427 0.260 10.090 -5.774 1.00 0.00 C ATOM 83 CD ARG A 427 1.608 10.573 -6.286 1.00 0.00 C ATOM 84 NE ARG A 427 2.187 11.597 -5.421 1.00 0.00 N ATOM 85 CZ ARG A 427 3.325 12.228 -5.688 1.00 0.00 C ATOM 86 NH1 ARG A 427 4.002 11.940 -6.791 1.00 0.00 N ATOM 87 NH2 ARG A 427 3.787 13.149 -4.852 1.00 0.00 N ATOM 0 H ARG A 427 -0.958 10.658 -3.366 1.00 0.00 H new ATOM 0 HA ARG A 427 -1.552 8.201 -4.742 1.00 0.00 H new ATOM 0 HB2 ARG A 427 1.106 9.434 -3.922 1.00 0.00 H new ATOM 0 HB3 ARG A 427 0.881 8.157 -5.100 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -0.313 9.665 -6.598 1.00 0.00 H new ATOM 0 HG3 ARG A 427 -0.310 10.937 -5.393 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.293 9.728 -6.356 1.00 0.00 H new ATOM 0 HD3 ARG A 427 1.491 10.973 -7.293 1.00 0.00 H new ATOM 0 HE ARG A 427 1.690 11.841 -4.564 1.00 0.00 H new ATOM 0 HH11 ARG A 427 3.649 11.233 -7.436 1.00 0.00 H new ATOM 0 HH12 ARG A 427 4.876 12.425 -6.995 1.00 0.00 H new ATOM 0 HH21 ARG A 427 3.268 13.373 -4.003 1.00 0.00 H new ATOM 0 HH22 ARG A 427 4.661 13.633 -5.058 1.00 0.00 H new ATOM 101 N LYS A 428 -0.232 8.147 -1.727 1.00 0.00 N ATOM 102 CA LYS A 428 0.053 7.288 -0.584 1.00 0.00 C ATOM 103 C LYS A 428 -1.201 6.543 -0.137 1.00 0.00 C ATOM 104 O LYS A 428 -2.105 7.130 0.458 1.00 0.00 O ATOM 105 CB LYS A 428 0.608 8.116 0.577 1.00 0.00 C ATOM 106 CG LYS A 428 1.031 7.280 1.772 1.00 0.00 C ATOM 107 CD LYS A 428 1.518 8.151 2.918 1.00 0.00 C ATOM 108 CE LYS A 428 2.977 8.543 2.740 1.00 0.00 C ATOM 109 NZ LYS A 428 3.436 9.473 3.808 1.00 0.00 N ATOM 0 H LYS A 428 -0.098 9.142 -1.549 1.00 0.00 H new ATOM 0 HA LYS A 428 0.800 6.555 -0.890 1.00 0.00 H new ATOM 0 HB2 LYS A 428 1.464 8.691 0.225 1.00 0.00 H new ATOM 0 HB3 LYS A 428 -0.149 8.833 0.895 1.00 0.00 H new ATOM 0 HG2 LYS A 428 0.191 6.672 2.108 1.00 0.00 H new ATOM 0 HG3 LYS A 428 1.823 6.593 1.474 1.00 0.00 H new ATOM 0 HD2 LYS A 428 0.904 9.049 2.980 1.00 0.00 H new ATOM 0 HD3 LYS A 428 1.396 7.616 3.860 1.00 0.00 H new ATOM 0 HE2 LYS A 428 3.597 7.647 2.748 1.00 0.00 H new ATOM 0 HE3 LYS A 428 3.110 9.014 1.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 4.435 9.716 3.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 2.861 10.339 3.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 3.333 9.014 4.736 1.00 0.00 H new ATOM 123 N VAL A 429 -1.248 5.246 -0.427 1.00 0.00 N ATOM 124 CA VAL A 429 -2.390 4.421 -0.052 1.00 0.00 C ATOM 125 C VAL A 429 -2.055 3.525 1.135 1.00 0.00 C ATOM 126 O VAL A 429 -1.062 2.797 1.117 1.00 0.00 O ATOM 127 CB VAL A 429 -2.858 3.542 -1.228 1.00 0.00 C ATOM 128 CG1 VAL A 429 -4.071 2.717 -0.829 1.00 0.00 C ATOM 129 CG2 VAL A 429 -3.164 4.401 -2.446 1.00 0.00 C ATOM 0 H VAL A 429 -0.509 4.745 -0.920 1.00 0.00 H new ATOM 0 HA VAL A 429 -3.194 5.102 0.226 1.00 0.00 H new ATOM 0 HB VAL A 429 -2.052 2.856 -1.489 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.387 2.103 -1.672 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.813 2.073 0.012 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.885 3.382 -0.540 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.493 3.764 -3.267 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.952 5.113 -2.201 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -2.266 4.942 -2.744 1.00 0.00 H new ATOM 139 N PHE A 430 -2.890 3.582 2.167 1.00 0.00 N ATOM 140 CA PHE A 430 -2.682 2.777 3.364 1.00 0.00 C ATOM 141 C PHE A 430 -3.370 1.421 3.233 1.00 0.00 C ATOM 142 O PHE A 430 -4.590 1.342 3.085 1.00 0.00 O ATOM 143 CB PHE A 430 -3.211 3.512 4.598 1.00 0.00 C ATOM 144 CG PHE A 430 -3.209 2.672 5.843 1.00 0.00 C ATOM 145 CD1 PHE A 430 -2.050 2.042 6.268 1.00 0.00 C ATOM 146 CD2 PHE A 430 -4.366 2.513 6.589 1.00 0.00 C ATOM 147 CE1 PHE A 430 -2.046 1.268 7.413 1.00 0.00 C ATOM 148 CE2 PHE A 430 -4.368 1.740 7.735 1.00 0.00 C ATOM 149 CZ PHE A 430 -3.206 1.118 8.148 1.00 0.00 C ATOM 0 H PHE A 430 -3.717 4.178 2.198 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.611 2.613 3.479 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.605 4.402 4.769 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -4.228 3.852 4.400 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.140 2.157 5.698 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -5.277 2.999 6.271 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -1.137 0.781 7.733 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -5.277 1.623 8.307 1.00 0.00 H new ATOM 0 HZ PHE A 430 -3.204 0.515 9.044 1.00 0.00 H new ATOM 159 N VAL A 431 -2.578 0.354 3.289 1.00 0.00 N ATOM 160 CA VAL A 431 -3.109 -0.999 3.177 1.00 0.00 C ATOM 161 C VAL A 431 -2.928 -1.769 4.480 1.00 0.00 C ATOM 162 O VAL A 431 -1.831 -1.825 5.033 1.00 0.00 O ATOM 163 CB VAL A 431 -2.428 -1.776 2.035 1.00 0.00 C ATOM 164 CG1 VAL A 431 -3.090 -3.132 1.843 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.465 -0.969 0.746 1.00 0.00 C ATOM 0 H VAL A 431 -1.566 0.401 3.411 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.173 -0.905 2.958 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.385 -1.942 2.303 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.596 -3.667 1.032 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -3.007 -3.711 2.763 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.142 -2.991 1.596 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -1.979 -1.533 -0.050 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -3.501 -0.770 0.471 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -1.941 -0.024 0.893 1.00 0.00 H new ATOM 175 N GLY A 432 -4.014 -2.364 4.965 1.00 0.00 N ATOM 176 CA GLY A 432 -3.954 -3.124 6.200 1.00 0.00 C ATOM 177 C GLY A 432 -4.631 -4.476 6.082 1.00 0.00 C ATOM 178 O GLY A 432 -5.592 -4.633 5.331 1.00 0.00 O ATOM 0 H GLY A 432 -4.934 -2.333 4.525 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -2.912 -3.267 6.485 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.427 -2.552 6.998 1.00 0.00 H new ATOM 182 N GLY A 433 -4.126 -5.456 6.826 1.00 0.00 N ATOM 183 CA GLY A 433 -4.700 -6.788 6.786 1.00 0.00 C ATOM 184 C GLY A 433 -3.960 -7.709 5.836 1.00 0.00 C ATOM 185 O GLY A 433 -4.504 -8.719 5.388 1.00 0.00 O ATOM 0 H GLY A 433 -3.330 -5.351 7.455 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.686 -7.217 7.788 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.745 -6.721 6.483 1.00 0.00 H new ATOM 189 N LEU A 434 -2.716 -7.361 5.526 1.00 0.00 N ATOM 190 CA LEU A 434 -1.899 -8.163 4.622 1.00 0.00 C ATOM 191 C LEU A 434 -1.378 -9.414 5.323 1.00 0.00 C ATOM 192 O LEU A 434 -1.023 -9.392 6.501 1.00 0.00 O ATOM 193 CB LEU A 434 -0.727 -7.336 4.092 1.00 0.00 C ATOM 194 CG LEU A 434 -1.089 -6.183 3.155 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.054 -5.182 3.074 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.438 -6.709 1.771 1.00 0.00 C ATOM 0 H LEU A 434 -2.251 -6.528 5.888 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.525 -8.472 3.785 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.182 -6.929 4.943 1.00 0.00 H new ATOM 0 HB3 LEU A 434 -0.045 -8.004 3.567 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.964 -5.673 3.559 1.00 0.00 H new ATOM 0 HD11 LEU A 434 -0.222 -4.369 2.403 1.00 0.00 H new ATOM 0 HD12 LEU A 434 0.257 -4.780 4.067 1.00 0.00 H new ATOM 0 HD13 LEU A 434 0.947 -5.679 2.694 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.693 -5.874 1.118 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.583 -7.244 1.359 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -2.289 -7.386 1.843 1.00 0.00 H new ATOM 208 N PRO A 435 -1.328 -10.531 4.581 1.00 0.00 N ATOM 209 CA PRO A 435 -0.849 -11.811 5.110 1.00 0.00 C ATOM 210 C PRO A 435 0.467 -11.670 5.867 1.00 0.00 C ATOM 211 O PRO A 435 1.312 -10.835 5.541 1.00 0.00 O ATOM 212 CB PRO A 435 -0.655 -12.664 3.854 1.00 0.00 C ATOM 213 CG PRO A 435 -1.619 -12.106 2.865 1.00 0.00 C ATOM 214 CD PRO A 435 -1.735 -10.629 3.170 1.00 0.00 C ATOM 0 HA PRO A 435 -1.546 -12.240 5.830 1.00 0.00 H new ATOM 0 HB2 PRO A 435 0.369 -12.601 3.487 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -0.858 -13.716 4.055 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.267 -12.266 1.846 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -2.589 -12.597 2.948 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -1.088 -10.035 2.525 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -2.753 -10.268 3.021 1.00 0.00 H new ATOM 222 N PRO A 436 0.649 -12.504 6.901 1.00 0.00 N ATOM 223 CA PRO A 436 1.862 -12.491 7.725 1.00 0.00 C ATOM 224 C PRO A 436 3.026 -13.210 7.052 1.00 0.00 C ATOM 225 O PRO A 436 4.102 -13.348 7.634 1.00 0.00 O ATOM 226 CB PRO A 436 1.436 -13.233 8.994 1.00 0.00 C ATOM 227 CG PRO A 436 0.352 -14.154 8.549 1.00 0.00 C ATOM 228 CD PRO A 436 -0.315 -13.524 7.346 1.00 0.00 C ATOM 0 HA PRO A 436 2.221 -11.478 7.908 1.00 0.00 H new ATOM 0 HB2 PRO A 436 2.270 -13.784 9.429 1.00 0.00 H new ATOM 0 HB3 PRO A 436 1.079 -12.541 9.756 1.00 0.00 H new ATOM 0 HG2 PRO A 436 0.761 -15.131 8.293 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -0.371 -14.311 9.350 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -0.508 -14.260 6.565 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -1.275 -13.079 7.609 1.00 0.00 H new ATOM 236 N ASP A 437 2.804 -13.667 5.825 1.00 0.00 N ATOM 237 CA ASP A 437 3.836 -14.370 5.072 1.00 0.00 C ATOM 238 C ASP A 437 3.974 -13.793 3.667 1.00 0.00 C ATOM 239 O ASP A 437 4.469 -14.459 2.757 1.00 0.00 O ATOM 240 CB ASP A 437 3.512 -15.863 4.994 1.00 0.00 C ATOM 241 CG ASP A 437 2.334 -16.153 4.086 1.00 0.00 C ATOM 242 OD1 ASP A 437 1.222 -15.668 4.383 1.00 0.00 O ATOM 243 OD2 ASP A 437 2.523 -16.866 3.077 1.00 0.00 O ATOM 0 H ASP A 437 1.918 -13.563 5.330 1.00 0.00 H new ATOM 0 HA ASP A 437 4.784 -14.238 5.593 1.00 0.00 H new ATOM 0 HB2 ASP A 437 4.387 -16.403 4.633 1.00 0.00 H new ATOM 0 HB3 ASP A 437 3.297 -16.238 5.995 1.00 0.00 H new ATOM 248 N ILE A 438 3.531 -12.552 3.497 1.00 0.00 N ATOM 249 CA ILE A 438 3.604 -11.886 2.203 1.00 0.00 C ATOM 250 C ILE A 438 4.847 -11.008 2.106 1.00 0.00 C ATOM 251 O ILE A 438 5.139 -10.226 3.011 1.00 0.00 O ATOM 252 CB ILE A 438 2.357 -11.020 1.943 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.315 -10.572 0.481 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.346 -9.816 2.872 1.00 0.00 C ATOM 255 CD1 ILE A 438 0.946 -10.116 0.027 1.00 0.00 C ATOM 0 H ILE A 438 3.118 -11.988 4.239 1.00 0.00 H new ATOM 0 HA ILE A 438 3.655 -12.670 1.448 1.00 0.00 H new ATOM 0 HB ILE A 438 1.469 -11.619 2.145 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.026 -9.758 0.338 1.00 0.00 H new ATOM 0 HG13 ILE A 438 2.643 -11.396 -0.153 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.459 -9.214 2.676 1.00 0.00 H new ATOM 0 HG22 ILE A 438 2.333 -10.156 3.908 1.00 0.00 H new ATOM 0 HG23 ILE A 438 3.238 -9.215 2.699 1.00 0.00 H new ATOM 0 HD11 ILE A 438 0.992 -9.813 -1.019 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.235 -10.935 0.137 1.00 0.00 H new ATOM 0 HD13 ILE A 438 0.624 -9.271 0.636 1.00 0.00 H new ATOM 267 N ASP A 439 5.575 -11.142 1.003 1.00 0.00 N ATOM 268 CA ASP A 439 6.786 -10.359 0.786 1.00 0.00 C ATOM 269 C ASP A 439 6.507 -9.169 -0.128 1.00 0.00 C ATOM 270 O ASP A 439 5.383 -8.980 -0.590 1.00 0.00 O ATOM 271 CB ASP A 439 7.884 -11.235 0.182 1.00 0.00 C ATOM 272 CG ASP A 439 7.563 -11.672 -1.234 1.00 0.00 C ATOM 273 OD1 ASP A 439 7.192 -10.806 -2.053 1.00 0.00 O ATOM 274 OD2 ASP A 439 7.684 -12.881 -1.522 1.00 0.00 O ATOM 0 H ASP A 439 5.348 -11.786 0.245 1.00 0.00 H new ATOM 0 HA ASP A 439 7.123 -9.982 1.751 1.00 0.00 H new ATOM 0 HB2 ASP A 439 8.826 -10.686 0.185 1.00 0.00 H new ATOM 0 HB3 ASP A 439 8.027 -12.116 0.807 1.00 0.00 H new ATOM 279 N GLU A 440 7.539 -8.370 -0.383 1.00 0.00 N ATOM 280 CA GLU A 440 7.403 -7.198 -1.239 1.00 0.00 C ATOM 281 C GLU A 440 6.764 -7.571 -2.574 1.00 0.00 C ATOM 282 O GLU A 440 5.639 -7.168 -2.869 1.00 0.00 O ATOM 283 CB GLU A 440 8.770 -6.553 -1.479 1.00 0.00 C ATOM 284 CG GLU A 440 8.688 -5.133 -2.013 1.00 0.00 C ATOM 285 CD GLU A 440 10.050 -4.481 -2.149 1.00 0.00 C ATOM 286 OE1 GLU A 440 10.604 -4.041 -1.120 1.00 0.00 O ATOM 287 OE2 GLU A 440 10.562 -4.411 -3.286 1.00 0.00 O ATOM 0 H GLU A 440 8.477 -8.513 -0.009 1.00 0.00 H new ATOM 0 HA GLU A 440 6.755 -6.483 -0.732 1.00 0.00 H new ATOM 0 HB2 GLU A 440 9.329 -6.549 -0.544 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.332 -7.165 -2.184 1.00 0.00 H new ATOM 0 HG2 GLU A 440 8.195 -5.142 -2.985 1.00 0.00 H new ATOM 0 HG3 GLU A 440 8.067 -4.534 -1.347 1.00 0.00 H new ATOM 294 N ASP A 441 7.490 -8.341 -3.376 1.00 0.00 N ATOM 295 CA ASP A 441 6.995 -8.769 -4.679 1.00 0.00 C ATOM 296 C ASP A 441 5.487 -8.996 -4.640 1.00 0.00 C ATOM 297 O ASP A 441 4.730 -8.317 -5.332 1.00 0.00 O ATOM 298 CB ASP A 441 7.705 -10.049 -5.123 1.00 0.00 C ATOM 299 CG ASP A 441 7.348 -10.447 -6.542 1.00 0.00 C ATOM 300 OD1 ASP A 441 6.360 -11.190 -6.720 1.00 0.00 O ATOM 301 OD2 ASP A 441 8.057 -10.014 -7.475 1.00 0.00 O ATOM 0 H ASP A 441 8.424 -8.682 -3.147 1.00 0.00 H new ATOM 0 HA ASP A 441 7.206 -7.978 -5.398 1.00 0.00 H new ATOM 0 HB2 ASP A 441 8.783 -9.907 -5.049 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.443 -10.861 -4.444 1.00 0.00 H new ATOM 306 N GLU A 442 5.059 -9.957 -3.826 1.00 0.00 N ATOM 307 CA GLU A 442 3.642 -10.274 -3.699 1.00 0.00 C ATOM 308 C GLU A 442 2.800 -9.001 -3.667 1.00 0.00 C ATOM 309 O GLU A 442 2.002 -8.750 -4.570 1.00 0.00 O ATOM 310 CB GLU A 442 3.392 -11.096 -2.433 1.00 0.00 C ATOM 311 CG GLU A 442 4.112 -12.434 -2.424 1.00 0.00 C ATOM 312 CD GLU A 442 3.415 -13.466 -1.558 1.00 0.00 C ATOM 313 OE1 GLU A 442 2.166 -13.477 -1.539 1.00 0.00 O ATOM 314 OE2 GLU A 442 4.117 -14.261 -0.900 1.00 0.00 O ATOM 0 H GLU A 442 5.673 -10.528 -3.246 1.00 0.00 H new ATOM 0 HA GLU A 442 3.348 -10.861 -4.569 1.00 0.00 H new ATOM 0 HB2 GLU A 442 3.708 -10.517 -1.566 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.321 -11.269 -2.328 1.00 0.00 H new ATOM 0 HG2 GLU A 442 4.184 -12.810 -3.444 1.00 0.00 H new ATOM 0 HG3 GLU A 442 5.131 -12.292 -2.064 1.00 0.00 H new ATOM 321 N ILE A 443 2.985 -8.203 -2.620 1.00 0.00 N ATOM 322 CA ILE A 443 2.244 -6.957 -2.470 1.00 0.00 C ATOM 323 C ILE A 443 2.172 -6.198 -3.791 1.00 0.00 C ATOM 324 O ILE A 443 1.088 -5.937 -4.313 1.00 0.00 O ATOM 325 CB ILE A 443 2.881 -6.048 -1.403 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.911 -6.760 -0.048 1.00 0.00 C ATOM 327 CG2 ILE A 443 2.118 -4.736 -1.301 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.837 -6.109 0.956 1.00 0.00 C ATOM 0 H ILE A 443 3.641 -8.397 -1.864 1.00 0.00 H new ATOM 0 HA ILE A 443 1.237 -7.225 -2.152 1.00 0.00 H new ATOM 0 HB ILE A 443 3.906 -5.827 -1.700 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.902 -6.784 0.363 1.00 0.00 H new ATOM 0 HG13 ILE A 443 3.219 -7.795 -0.197 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.580 -4.104 -0.543 1.00 0.00 H new ATOM 0 HG22 ILE A 443 2.143 -4.225 -2.263 1.00 0.00 H new ATOM 0 HG23 ILE A 443 1.083 -4.937 -1.024 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.808 -6.666 1.892 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.855 -6.109 0.566 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.517 -5.083 1.134 1.00 0.00 H new ATOM 340 N THR A 444 3.336 -5.846 -4.329 1.00 0.00 N ATOM 341 CA THR A 444 3.406 -5.117 -5.589 1.00 0.00 C ATOM 342 C THR A 444 2.533 -5.773 -6.653 1.00 0.00 C ATOM 343 O THR A 444 1.650 -5.134 -7.224 1.00 0.00 O ATOM 344 CB THR A 444 4.854 -5.034 -6.110 1.00 0.00 C ATOM 345 OG1 THR A 444 5.766 -4.952 -5.009 1.00 0.00 O ATOM 346 CG2 THR A 444 5.034 -3.825 -7.015 1.00 0.00 C ATOM 0 H THR A 444 4.243 -6.054 -3.911 1.00 0.00 H new ATOM 0 HA THR A 444 3.039 -4.110 -5.392 1.00 0.00 H new ATOM 0 HB THR A 444 5.062 -5.935 -6.688 1.00 0.00 H new ATOM 0 HG1 THR A 444 6.684 -4.901 -5.348 1.00 0.00 H new ATOM 0 HG21 THR A 444 6.064 -3.787 -7.371 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.358 -3.904 -7.867 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.809 -2.916 -6.457 1.00 0.00 H new ATOM 354 N ALA A 445 2.785 -7.051 -6.913 1.00 0.00 N ATOM 355 CA ALA A 445 2.019 -7.794 -7.907 1.00 0.00 C ATOM 356 C ALA A 445 0.521 -7.674 -7.647 1.00 0.00 C ATOM 357 O ALA A 445 -0.280 -7.640 -8.581 1.00 0.00 O ATOM 358 CB ALA A 445 2.440 -9.256 -7.913 1.00 0.00 C ATOM 0 H ALA A 445 3.513 -7.594 -6.450 1.00 0.00 H new ATOM 0 HA ALA A 445 2.227 -7.363 -8.886 1.00 0.00 H new ATOM 0 HB1 ALA A 445 1.860 -9.799 -8.660 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.500 -9.328 -8.154 1.00 0.00 H new ATOM 0 HB3 ALA A 445 2.261 -9.690 -6.929 1.00 0.00 H new ATOM 364 N SER A 446 0.149 -7.611 -6.372 1.00 0.00 N ATOM 365 CA SER A 446 -1.253 -7.500 -5.990 1.00 0.00 C ATOM 366 C SER A 446 -1.818 -6.140 -6.387 1.00 0.00 C ATOM 367 O SER A 446 -3.031 -5.971 -6.513 1.00 0.00 O ATOM 368 CB SER A 446 -1.411 -7.710 -4.483 1.00 0.00 C ATOM 369 OG SER A 446 -2.694 -8.225 -4.171 1.00 0.00 O ATOM 0 H SER A 446 0.800 -7.635 -5.587 1.00 0.00 H new ATOM 0 HA SER A 446 -1.810 -8.274 -6.518 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.643 -8.397 -4.126 1.00 0.00 H new ATOM 0 HB3 SER A 446 -1.259 -6.764 -3.963 1.00 0.00 H new ATOM 0 HG SER A 446 -2.600 -9.008 -3.589 1.00 0.00 H new ATOM 375 N PHE A 447 -0.930 -5.171 -6.584 1.00 0.00 N ATOM 376 CA PHE A 447 -1.338 -3.825 -6.966 1.00 0.00 C ATOM 377 C PHE A 447 -0.705 -3.421 -8.294 1.00 0.00 C ATOM 378 O PHE A 447 -0.795 -2.266 -8.711 1.00 0.00 O ATOM 379 CB PHE A 447 -0.949 -2.823 -5.877 1.00 0.00 C ATOM 380 CG PHE A 447 -1.756 -2.963 -4.617 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.358 -3.836 -3.618 1.00 0.00 C ATOM 382 CD2 PHE A 447 -2.911 -2.221 -4.433 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.098 -3.968 -2.459 1.00 0.00 C ATOM 384 CE2 PHE A 447 -3.656 -2.348 -3.275 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.248 -3.222 -2.286 1.00 0.00 C ATOM 0 H PHE A 447 0.078 -5.294 -6.485 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.422 -3.821 -7.084 1.00 0.00 H new ATOM 0 HB2 PHE A 447 0.107 -2.950 -5.639 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.069 -1.812 -6.265 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.459 -4.420 -3.747 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.233 -1.535 -5.203 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -1.778 -4.654 -1.689 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -4.555 -1.765 -3.144 1.00 0.00 H new ATOM 0 HZ PHE A 447 -3.827 -3.322 -1.380 1.00 0.00 H new ATOM 395 N ARG A 448 -0.064 -4.380 -8.953 1.00 0.00 N ATOM 396 CA ARG A 448 0.586 -4.125 -10.233 1.00 0.00 C ATOM 397 C ARG A 448 -0.443 -4.023 -11.355 1.00 0.00 C ATOM 398 O ARG A 448 -0.103 -3.712 -12.496 1.00 0.00 O ATOM 399 CB ARG A 448 1.592 -5.233 -10.549 1.00 0.00 C ATOM 400 CG ARG A 448 2.988 -4.960 -10.013 1.00 0.00 C ATOM 401 CD ARG A 448 3.688 -3.872 -10.813 1.00 0.00 C ATOM 402 NE ARG A 448 3.780 -4.209 -12.231 1.00 0.00 N ATOM 403 CZ ARG A 448 4.396 -3.448 -13.128 1.00 0.00 C ATOM 404 NH1 ARG A 448 4.972 -2.313 -12.757 1.00 0.00 N ATOM 405 NH2 ARG A 448 4.438 -3.822 -14.401 1.00 0.00 N ATOM 0 H ARG A 448 0.019 -5.341 -8.622 1.00 0.00 H new ATOM 0 HA ARG A 448 1.114 -3.174 -10.160 1.00 0.00 H new ATOM 0 HB2 ARG A 448 1.229 -6.172 -10.131 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.646 -5.365 -11.630 1.00 0.00 H new ATOM 0 HG2 ARG A 448 2.925 -4.661 -8.967 1.00 0.00 H new ATOM 0 HG3 ARG A 448 3.578 -5.876 -10.048 1.00 0.00 H new ATOM 0 HD2 ARG A 448 3.147 -2.933 -10.698 1.00 0.00 H new ATOM 0 HD3 ARG A 448 4.689 -3.715 -10.412 1.00 0.00 H new ATOM 0 HE ARG A 448 3.348 -5.076 -12.550 1.00 0.00 H new ATOM 0 HH11 ARG A 448 4.943 -2.022 -11.780 1.00 0.00 H new ATOM 0 HH12 ARG A 448 5.444 -1.731 -13.449 1.00 0.00 H new ATOM 0 HH21 ARG A 448 3.997 -4.695 -14.691 1.00 0.00 H new ATOM 0 HH22 ARG A 448 4.911 -3.237 -15.089 1.00 0.00 H new ATOM 419 N ARG A 449 -1.702 -4.286 -11.021 1.00 0.00 N ATOM 420 CA ARG A 449 -2.781 -4.226 -12.000 1.00 0.00 C ATOM 421 C ARG A 449 -3.293 -2.797 -12.157 1.00 0.00 C ATOM 422 O ARG A 449 -4.286 -2.554 -12.843 1.00 0.00 O ATOM 423 CB ARG A 449 -3.928 -5.148 -11.584 1.00 0.00 C ATOM 424 CG ARG A 449 -4.513 -4.815 -10.221 1.00 0.00 C ATOM 425 CD ARG A 449 -5.983 -5.198 -10.137 1.00 0.00 C ATOM 426 NE ARG A 449 -6.854 -4.137 -10.635 1.00 0.00 N ATOM 427 CZ ARG A 449 -8.166 -4.276 -10.790 1.00 0.00 C ATOM 428 NH1 ARG A 449 -8.755 -5.425 -10.488 1.00 0.00 N ATOM 429 NH2 ARG A 449 -8.892 -3.264 -11.248 1.00 0.00 N ATOM 0 H ARG A 449 -2.000 -4.543 -10.080 1.00 0.00 H new ATOM 0 HA ARG A 449 -2.386 -4.560 -12.960 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -4.718 -5.092 -12.333 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -3.570 -6.178 -11.575 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -3.954 -5.340 -9.446 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -4.402 -3.748 -10.027 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -6.154 -6.108 -10.713 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -6.241 -5.423 -9.102 1.00 0.00 H new ATOM 0 HE ARG A 449 -6.432 -3.240 -10.877 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -8.200 -6.205 -10.136 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -9.763 -5.529 -10.608 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -8.443 -2.379 -11.481 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -9.899 -3.372 -11.367 1.00 0.00 H new ATOM 443 N PHE A 450 -2.609 -1.855 -11.517 1.00 0.00 N ATOM 444 CA PHE A 450 -2.995 -0.450 -11.584 1.00 0.00 C ATOM 445 C PHE A 450 -1.875 0.394 -12.184 1.00 0.00 C ATOM 446 O PHE A 450 -2.125 1.420 -12.815 1.00 0.00 O ATOM 447 CB PHE A 450 -3.351 0.070 -10.190 1.00 0.00 C ATOM 448 CG PHE A 450 -4.515 -0.643 -9.563 1.00 0.00 C ATOM 449 CD1 PHE A 450 -5.783 -0.543 -10.113 1.00 0.00 C ATOM 450 CD2 PHE A 450 -4.341 -1.412 -8.424 1.00 0.00 C ATOM 451 CE1 PHE A 450 -6.855 -1.197 -9.537 1.00 0.00 C ATOM 452 CE2 PHE A 450 -5.410 -2.069 -7.844 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.669 -1.962 -8.402 1.00 0.00 C ATOM 0 H PHE A 450 -1.784 -2.039 -10.946 1.00 0.00 H new ATOM 0 HA PHE A 450 -3.871 -0.370 -12.228 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.481 -0.030 -9.541 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -3.579 1.134 -10.255 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -5.935 0.052 -11.001 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -3.359 -1.499 -7.984 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -7.839 -1.110 -9.974 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -5.261 -2.665 -6.956 1.00 0.00 H new ATOM 0 HZ PHE A 450 -7.506 -2.475 -7.952 1.00 0.00 H new ATOM 463 N GLY A 451 -0.637 -0.046 -11.981 1.00 0.00 N ATOM 464 CA GLY A 451 0.504 0.680 -12.507 1.00 0.00 C ATOM 465 C GLY A 451 1.697 0.642 -11.572 1.00 0.00 C ATOM 466 O GLY A 451 1.581 0.291 -10.397 1.00 0.00 O ATOM 0 H GLY A 451 -0.404 -0.892 -11.462 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.788 0.256 -13.470 1.00 0.00 H new ATOM 0 HA3 GLY A 451 0.220 1.717 -12.686 1.00 0.00 H new ATOM 470 N PRO A 452 2.876 1.010 -12.095 1.00 0.00 N ATOM 471 CA PRO A 452 4.118 1.024 -11.316 1.00 0.00 C ATOM 472 C PRO A 452 3.936 1.668 -9.946 1.00 0.00 C ATOM 473 O PRO A 452 3.517 2.822 -9.843 1.00 0.00 O ATOM 474 CB PRO A 452 5.068 1.858 -12.178 1.00 0.00 C ATOM 475 CG PRO A 452 4.581 1.667 -13.573 1.00 0.00 C ATOM 476 CD PRO A 452 3.088 1.441 -13.487 1.00 0.00 C ATOM 0 HA PRO A 452 4.481 0.017 -11.110 1.00 0.00 H new ATOM 0 HB2 PRO A 452 5.043 2.909 -11.891 1.00 0.00 H new ATOM 0 HB3 PRO A 452 6.099 1.522 -12.069 1.00 0.00 H new ATOM 0 HG2 PRO A 452 4.805 2.541 -14.184 1.00 0.00 H new ATOM 0 HG3 PRO A 452 5.075 0.816 -14.042 1.00 0.00 H new ATOM 0 HD2 PRO A 452 2.532 2.351 -13.713 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.757 0.682 -14.195 1.00 0.00 H new ATOM 484 N LEU A 453 4.254 0.918 -8.898 1.00 0.00 N ATOM 485 CA LEU A 453 4.127 1.417 -7.533 1.00 0.00 C ATOM 486 C LEU A 453 5.290 0.943 -6.668 1.00 0.00 C ATOM 487 O LEU A 453 6.210 0.285 -7.154 1.00 0.00 O ATOM 488 CB LEU A 453 2.802 0.956 -6.922 1.00 0.00 C ATOM 489 CG LEU A 453 2.752 -0.496 -6.445 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.621 -0.691 -5.447 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.592 -1.440 -7.627 1.00 0.00 C ATOM 0 H LEU A 453 4.602 -0.038 -8.967 1.00 0.00 H new ATOM 0 HA LEU A 453 4.146 2.506 -7.568 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.570 1.603 -6.076 1.00 0.00 H new ATOM 0 HB3 LEU A 453 2.014 1.102 -7.661 1.00 0.00 H new ATOM 0 HG LEU A 453 3.693 -0.727 -5.946 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.601 -1.730 -5.119 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.779 -0.041 -4.586 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.671 -0.441 -5.920 1.00 0.00 H new ATOM 0 HD21 LEU A 453 2.558 -2.469 -7.269 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.667 -1.209 -8.155 1.00 0.00 H new ATOM 0 HD23 LEU A 453 3.436 -1.320 -8.306 1.00 0.00 H new ATOM 503 N VAL A 454 5.242 1.280 -5.383 1.00 0.00 N ATOM 504 CA VAL A 454 6.291 0.886 -4.450 1.00 0.00 C ATOM 505 C VAL A 454 5.724 0.651 -3.054 1.00 0.00 C ATOM 506 O VAL A 454 4.997 1.488 -2.519 1.00 0.00 O ATOM 507 CB VAL A 454 7.400 1.951 -4.369 1.00 0.00 C ATOM 508 CG1 VAL A 454 6.893 3.197 -3.658 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.627 1.390 -3.668 1.00 0.00 C ATOM 0 H VAL A 454 4.488 1.825 -4.964 1.00 0.00 H new ATOM 0 HA VAL A 454 6.718 -0.043 -4.828 1.00 0.00 H new ATOM 0 HB VAL A 454 7.685 2.231 -5.383 1.00 0.00 H new ATOM 0 HG11 VAL A 454 7.690 3.939 -3.610 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.046 3.610 -4.206 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.579 2.937 -2.647 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.401 2.156 -3.620 1.00 0.00 H new ATOM 0 HG22 VAL A 454 8.359 1.081 -2.658 1.00 0.00 H new ATOM 0 HG23 VAL A 454 9.002 0.530 -4.223 1.00 0.00 H new ATOM 519 N VAL A 455 6.062 -0.493 -2.469 1.00 0.00 N ATOM 520 CA VAL A 455 5.589 -0.839 -1.134 1.00 0.00 C ATOM 521 C VAL A 455 6.583 -0.395 -0.066 1.00 0.00 C ATOM 522 O VAL A 455 7.753 -0.775 -0.098 1.00 0.00 O ATOM 523 CB VAL A 455 5.348 -2.354 -0.998 1.00 0.00 C ATOM 524 CG1 VAL A 455 4.461 -2.648 0.202 1.00 0.00 C ATOM 525 CG2 VAL A 455 4.736 -2.912 -2.274 1.00 0.00 C ATOM 0 H VAL A 455 6.662 -1.197 -2.899 1.00 0.00 H new ATOM 0 HA VAL A 455 4.645 -0.315 -0.988 1.00 0.00 H new ATOM 0 HB VAL A 455 6.308 -2.845 -0.838 1.00 0.00 H new ATOM 0 HG11 VAL A 455 4.302 -3.723 0.282 1.00 0.00 H new ATOM 0 HG12 VAL A 455 4.944 -2.284 1.109 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.501 -2.147 0.076 1.00 0.00 H new ATOM 0 HG21 VAL A 455 4.572 -3.984 -2.161 1.00 0.00 H new ATOM 0 HG22 VAL A 455 3.784 -2.418 -2.467 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.413 -2.735 -3.110 1.00 0.00 H new ATOM 535 N ASP A 456 6.108 0.410 0.878 1.00 0.00 N ATOM 536 CA ASP A 456 6.955 0.905 1.957 1.00 0.00 C ATOM 537 C ASP A 456 6.258 0.756 3.306 1.00 0.00 C ATOM 538 O ASP A 456 5.398 1.561 3.663 1.00 0.00 O ATOM 539 CB ASP A 456 7.321 2.370 1.717 1.00 0.00 C ATOM 540 CG ASP A 456 8.304 2.542 0.575 1.00 0.00 C ATOM 541 OD1 ASP A 456 9.377 1.904 0.616 1.00 0.00 O ATOM 542 OD2 ASP A 456 8.001 3.314 -0.358 1.00 0.00 O ATOM 0 H ASP A 456 5.141 0.734 0.918 1.00 0.00 H new ATOM 0 HA ASP A 456 7.868 0.309 1.972 1.00 0.00 H new ATOM 0 HB2 ASP A 456 6.415 2.937 1.501 1.00 0.00 H new ATOM 0 HB3 ASP A 456 7.750 2.788 2.628 1.00 0.00 H new ATOM 547 N TRP A 457 6.635 -0.278 4.050 1.00 0.00 N ATOM 548 CA TRP A 457 6.045 -0.532 5.359 1.00 0.00 C ATOM 549 C TRP A 457 6.880 0.104 6.465 1.00 0.00 C ATOM 550 O TRP A 457 8.066 0.388 6.295 1.00 0.00 O ATOM 551 CB TRP A 457 5.918 -2.037 5.600 1.00 0.00 C ATOM 552 CG TRP A 457 7.139 -2.808 5.199 1.00 0.00 C ATOM 553 CD1 TRP A 457 8.209 -3.118 5.989 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.415 -3.365 3.909 1.00 0.00 C ATOM 555 NE1 TRP A 457 9.134 -3.833 5.268 1.00 0.00 N ATOM 556 CE2 TRP A 457 8.670 -3.999 3.990 1.00 0.00 C ATOM 557 CE3 TRP A 457 6.723 -3.392 2.695 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.246 -4.650 2.902 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.296 -4.038 1.617 1.00 0.00 C ATOM 560 CH2 TRP A 457 8.547 -4.661 1.725 1.00 0.00 C ATOM 0 H TRP A 457 7.346 -0.953 3.769 1.00 0.00 H new ATOM 0 HA TRP A 457 5.052 -0.083 5.376 1.00 0.00 H new ATOM 0 HB2 TRP A 457 5.717 -2.213 6.657 1.00 0.00 H new ATOM 0 HB3 TRP A 457 5.060 -2.415 5.045 1.00 0.00 H new ATOM 0 HD1 TRP A 457 8.313 -2.842 7.028 1.00 0.00 H new ATOM 0 HE1 TRP A 457 10.022 -4.184 5.626 1.00 0.00 H new ATOM 0 HE3 TRP A 457 5.758 -2.916 2.602 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 10.210 -5.129 2.984 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 6.771 -4.064 0.674 1.00 0.00 H new ATOM 0 HH2 TRP A 457 8.967 -5.159 0.864 1.00 0.00 H new ATOM 571 N PRO A 458 6.249 0.334 7.627 1.00 0.00 N ATOM 572 CA PRO A 458 6.917 0.938 8.784 1.00 0.00 C ATOM 573 C PRO A 458 8.286 0.322 9.050 1.00 0.00 C ATOM 574 O PRO A 458 8.398 -0.874 9.323 1.00 0.00 O ATOM 575 CB PRO A 458 5.961 0.638 9.941 1.00 0.00 C ATOM 576 CG PRO A 458 4.617 0.534 9.306 1.00 0.00 C ATOM 577 CD PRO A 458 4.837 0.020 7.900 1.00 0.00 C ATOM 0 HA PRO A 458 7.108 2.001 8.636 1.00 0.00 H new ATOM 0 HB2 PRO A 458 6.232 -0.288 10.448 1.00 0.00 H new ATOM 0 HB3 PRO A 458 5.985 1.430 10.690 1.00 0.00 H new ATOM 0 HG2 PRO A 458 3.975 -0.143 9.869 1.00 0.00 H new ATOM 0 HG3 PRO A 458 4.121 1.504 9.290 1.00 0.00 H new ATOM 0 HD2 PRO A 458 4.645 -1.051 7.831 1.00 0.00 H new ATOM 0 HD3 PRO A 458 4.173 0.509 7.187 1.00 0.00 H new ATOM 585 N HIS A 459 9.326 1.146 8.970 1.00 0.00 N ATOM 586 CA HIS A 459 10.689 0.681 9.203 1.00 0.00 C ATOM 587 C HIS A 459 11.073 -0.402 8.201 1.00 0.00 C ATOM 588 O HIS A 459 11.564 -1.466 8.578 1.00 0.00 O ATOM 589 CB HIS A 459 10.831 0.147 10.629 1.00 0.00 C ATOM 590 CG HIS A 459 10.684 1.203 11.681 1.00 0.00 C ATOM 591 ND1 HIS A 459 11.741 1.661 12.440 1.00 0.00 N ATOM 592 CD2 HIS A 459 9.597 1.892 12.099 1.00 0.00 C ATOM 593 CE1 HIS A 459 11.309 2.585 13.280 1.00 0.00 C ATOM 594 NE2 HIS A 459 10.012 2.744 13.093 1.00 0.00 N ATOM 0 H HIS A 459 9.251 2.138 8.746 1.00 0.00 H new ATOM 0 HA HIS A 459 11.363 1.528 9.071 1.00 0.00 H new ATOM 0 HB2 HIS A 459 10.081 -0.627 10.795 1.00 0.00 H new ATOM 0 HB3 HIS A 459 11.807 -0.327 10.735 1.00 0.00 H new ATOM 0 HD1 HIS A 459 12.705 1.337 12.365 1.00 0.00 H new ATOM 0 HD2 HIS A 459 8.590 1.791 11.721 1.00 0.00 H new ATOM 0 HE1 HIS A 459 11.914 3.119 13.997 1.00 0.00 H new ATOM 602 N LYS A 460 10.845 -0.126 6.921 1.00 0.00 N ATOM 603 CA LYS A 460 11.168 -1.076 5.863 1.00 0.00 C ATOM 604 C LYS A 460 12.629 -0.948 5.444 1.00 0.00 C ATOM 605 O LYS A 460 13.371 -1.929 5.440 1.00 0.00 O ATOM 606 CB LYS A 460 10.257 -0.852 4.654 1.00 0.00 C ATOM 607 CG LYS A 460 10.553 -1.781 3.489 1.00 0.00 C ATOM 608 CD LYS A 460 11.612 -1.199 2.568 1.00 0.00 C ATOM 609 CE LYS A 460 11.756 -2.021 1.296 1.00 0.00 C ATOM 610 NZ LYS A 460 12.516 -1.288 0.245 1.00 0.00 N ATOM 0 H LYS A 460 10.437 0.749 6.591 1.00 0.00 H new ATOM 0 HA LYS A 460 11.007 -2.082 6.250 1.00 0.00 H new ATOM 0 HB2 LYS A 460 9.220 -0.987 4.961 1.00 0.00 H new ATOM 0 HB3 LYS A 460 10.358 0.180 4.319 1.00 0.00 H new ATOM 0 HG2 LYS A 460 10.890 -2.746 3.868 1.00 0.00 H new ATOM 0 HG3 LYS A 460 9.638 -1.962 2.925 1.00 0.00 H new ATOM 0 HD2 LYS A 460 11.349 -0.173 2.312 1.00 0.00 H new ATOM 0 HD3 LYS A 460 12.569 -1.162 3.089 1.00 0.00 H new ATOM 0 HE2 LYS A 460 12.264 -2.958 1.525 1.00 0.00 H new ATOM 0 HE3 LYS A 460 10.767 -2.279 0.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 12.592 -1.881 -0.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 12.018 -0.406 0.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 13.468 -1.064 0.598 1.00 0.00 H new ATOM 624 N ALA A 461 13.034 0.268 5.092 1.00 0.00 N ATOM 625 CA ALA A 461 14.407 0.524 4.674 1.00 0.00 C ATOM 626 C ALA A 461 15.394 0.163 5.780 1.00 0.00 C ATOM 627 O ALA A 461 16.432 -0.445 5.522 1.00 0.00 O ATOM 628 CB ALA A 461 14.573 1.982 4.272 1.00 0.00 C ATOM 0 H ALA A 461 12.431 1.091 5.088 1.00 0.00 H new ATOM 0 HA ALA A 461 14.621 -0.106 3.811 1.00 0.00 H new ATOM 0 HB1 ALA A 461 15.603 2.159 3.962 1.00 0.00 H new ATOM 0 HB2 ALA A 461 13.901 2.210 3.445 1.00 0.00 H new ATOM 0 HB3 ALA A 461 14.334 2.623 5.121 1.00 0.00 H new ATOM 634 N GLU A 462 15.062 0.541 7.010 1.00 0.00 N ATOM 635 CA GLU A 462 15.921 0.258 8.154 1.00 0.00 C ATOM 636 C GLU A 462 16.090 -1.247 8.347 1.00 0.00 C ATOM 637 O GLU A 462 17.197 -1.733 8.580 1.00 0.00 O ATOM 638 CB GLU A 462 15.341 0.884 9.423 1.00 0.00 C ATOM 639 CG GLU A 462 15.381 2.403 9.426 1.00 0.00 C ATOM 640 CD GLU A 462 14.379 3.012 10.387 1.00 0.00 C ATOM 641 OE1 GLU A 462 14.427 2.673 11.588 1.00 0.00 O ATOM 642 OE2 GLU A 462 13.546 3.827 9.938 1.00 0.00 O ATOM 0 H GLU A 462 14.205 1.044 7.240 1.00 0.00 H new ATOM 0 HA GLU A 462 16.900 0.695 7.958 1.00 0.00 H new ATOM 0 HB2 GLU A 462 14.308 0.556 9.540 1.00 0.00 H new ATOM 0 HB3 GLU A 462 15.893 0.513 10.286 1.00 0.00 H new ATOM 0 HG2 GLU A 462 16.384 2.736 9.694 1.00 0.00 H new ATOM 0 HG3 GLU A 462 15.182 2.770 8.419 1.00 0.00 H new ATOM 649 N SER A 463 14.984 -1.978 8.249 1.00 0.00 N ATOM 650 CA SER A 463 15.009 -3.426 8.418 1.00 0.00 C ATOM 651 C SER A 463 15.810 -4.089 7.302 1.00 0.00 C ATOM 652 O SER A 463 15.689 -3.724 6.133 1.00 0.00 O ATOM 653 CB SER A 463 13.583 -3.982 8.438 1.00 0.00 C ATOM 654 OG SER A 463 12.939 -3.692 9.666 1.00 0.00 O ATOM 0 H SER A 463 14.060 -1.592 8.054 1.00 0.00 H new ATOM 0 HA SER A 463 15.492 -3.649 9.369 1.00 0.00 H new ATOM 0 HB2 SER A 463 13.011 -3.555 7.614 1.00 0.00 H new ATOM 0 HB3 SER A 463 13.608 -5.061 8.283 1.00 0.00 H new ATOM 0 HG SER A 463 12.363 -2.907 9.556 1.00 0.00 H new ATOM 660 N LYS A 464 16.630 -5.067 7.672 1.00 0.00 N ATOM 661 CA LYS A 464 17.452 -5.785 6.705 1.00 0.00 C ATOM 662 C LYS A 464 16.663 -6.916 6.053 1.00 0.00 C ATOM 663 O LYS A 464 16.783 -7.157 4.852 1.00 0.00 O ATOM 664 CB LYS A 464 18.703 -6.347 7.385 1.00 0.00 C ATOM 665 CG LYS A 464 19.773 -6.803 6.408 1.00 0.00 C ATOM 666 CD LYS A 464 20.478 -5.623 5.761 1.00 0.00 C ATOM 667 CE LYS A 464 21.565 -5.060 6.664 1.00 0.00 C ATOM 668 NZ LYS A 464 22.405 -4.053 5.958 1.00 0.00 N ATOM 0 H LYS A 464 16.743 -5.381 8.636 1.00 0.00 H new ATOM 0 HA LYS A 464 17.753 -5.082 5.929 1.00 0.00 H new ATOM 0 HB2 LYS A 464 19.123 -5.585 8.041 1.00 0.00 H new ATOM 0 HB3 LYS A 464 18.417 -7.188 8.016 1.00 0.00 H new ATOM 0 HG2 LYS A 464 20.503 -7.422 6.930 1.00 0.00 H new ATOM 0 HG3 LYS A 464 19.320 -7.425 5.636 1.00 0.00 H new ATOM 0 HD2 LYS A 464 20.916 -5.935 4.813 1.00 0.00 H new ATOM 0 HD3 LYS A 464 19.751 -4.843 5.535 1.00 0.00 H new ATOM 0 HE2 LYS A 464 21.108 -4.601 7.541 1.00 0.00 H new ATOM 0 HE3 LYS A 464 22.197 -5.873 7.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 23.134 -3.693 6.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 22.862 -4.497 5.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 21.807 -3.265 5.638 1.00 0.00 H new ATOM 682 N SER A 465 15.856 -7.605 6.852 1.00 0.00 N ATOM 683 CA SER A 465 15.049 -8.712 6.353 1.00 0.00 C ATOM 684 C SER A 465 13.902 -8.201 5.487 1.00 0.00 C ATOM 685 O SER A 465 13.280 -7.184 5.796 1.00 0.00 O ATOM 686 CB SER A 465 14.495 -9.534 7.519 1.00 0.00 C ATOM 687 OG SER A 465 13.664 -10.584 7.054 1.00 0.00 O ATOM 0 H SER A 465 15.743 -7.416 7.848 1.00 0.00 H new ATOM 0 HA SER A 465 15.689 -9.348 5.741 1.00 0.00 H new ATOM 0 HB2 SER A 465 15.319 -9.948 8.100 1.00 0.00 H new ATOM 0 HB3 SER A 465 13.928 -8.886 8.188 1.00 0.00 H new ATOM 0 HG SER A 465 13.324 -11.095 7.818 1.00 0.00 H new ATOM 693 N TYR A 466 13.627 -8.913 4.400 1.00 0.00 N ATOM 694 CA TYR A 466 12.557 -8.532 3.486 1.00 0.00 C ATOM 695 C TYR A 466 11.231 -9.155 3.909 1.00 0.00 C ATOM 696 O TYR A 466 10.462 -9.635 3.075 1.00 0.00 O ATOM 697 CB TYR A 466 12.901 -8.959 2.058 1.00 0.00 C ATOM 698 CG TYR A 466 13.268 -10.420 1.934 1.00 0.00 C ATOM 699 CD1 TYR A 466 14.567 -10.853 2.168 1.00 0.00 C ATOM 700 CD2 TYR A 466 12.314 -11.369 1.585 1.00 0.00 C ATOM 701 CE1 TYR A 466 14.906 -12.188 2.055 1.00 0.00 C ATOM 702 CE2 TYR A 466 12.644 -12.706 1.472 1.00 0.00 C ATOM 703 CZ TYR A 466 13.941 -13.110 1.708 1.00 0.00 C ATOM 704 OH TYR A 466 14.275 -14.440 1.596 1.00 0.00 O ATOM 0 H TYR A 466 14.131 -9.758 4.130 1.00 0.00 H new ATOM 0 HA TYR A 466 12.455 -7.447 3.519 1.00 0.00 H new ATOM 0 HB2 TYR A 466 12.049 -8.751 1.411 1.00 0.00 H new ATOM 0 HB3 TYR A 466 13.732 -8.353 1.697 1.00 0.00 H new ATOM 0 HD1 TYR A 466 15.325 -10.134 2.443 1.00 0.00 H new ATOM 0 HD2 TYR A 466 11.297 -11.056 1.399 1.00 0.00 H new ATOM 0 HE1 TYR A 466 15.921 -12.508 2.237 1.00 0.00 H new ATOM 0 HE2 TYR A 466 11.890 -13.430 1.200 1.00 0.00 H new ATOM 0 HH TYR A 466 13.481 -14.957 1.346 1.00 0.00 H new ATOM 714 N PHE A 467 10.969 -9.144 5.212 1.00 0.00 N ATOM 715 CA PHE A 467 9.736 -9.708 5.749 1.00 0.00 C ATOM 716 C PHE A 467 8.876 -8.623 6.392 1.00 0.00 C ATOM 717 O PHE A 467 9.052 -8.266 7.557 1.00 0.00 O ATOM 718 CB PHE A 467 10.052 -10.799 6.774 1.00 0.00 C ATOM 719 CG PHE A 467 9.003 -11.870 6.853 1.00 0.00 C ATOM 720 CD1 PHE A 467 8.486 -12.439 5.700 1.00 0.00 C ATOM 721 CD2 PHE A 467 8.533 -12.308 8.081 1.00 0.00 C ATOM 722 CE1 PHE A 467 7.520 -13.425 5.770 1.00 0.00 C ATOM 723 CE2 PHE A 467 7.567 -13.294 8.156 1.00 0.00 C ATOM 724 CZ PHE A 467 7.060 -13.853 6.999 1.00 0.00 C ATOM 0 H PHE A 467 11.594 -8.751 5.915 1.00 0.00 H new ATOM 0 HA PHE A 467 9.177 -10.147 4.923 1.00 0.00 H new ATOM 0 HB2 PHE A 467 11.009 -11.257 6.522 1.00 0.00 H new ATOM 0 HB3 PHE A 467 10.167 -10.341 7.756 1.00 0.00 H new ATOM 0 HD1 PHE A 467 8.842 -12.108 4.736 1.00 0.00 H new ATOM 0 HD2 PHE A 467 8.926 -11.874 8.989 1.00 0.00 H new ATOM 0 HE1 PHE A 467 7.125 -13.860 4.864 1.00 0.00 H new ATOM 0 HE2 PHE A 467 7.209 -13.627 9.119 1.00 0.00 H new ATOM 0 HZ PHE A 467 6.305 -14.623 7.056 1.00 0.00 H new ATOM 734 N PRO A 468 7.924 -8.085 5.616 1.00 0.00 N ATOM 735 CA PRO A 468 7.018 -7.034 6.088 1.00 0.00 C ATOM 736 C PRO A 468 6.492 -7.310 7.492 1.00 0.00 C ATOM 737 O PRO A 468 6.617 -8.414 8.022 1.00 0.00 O ATOM 738 CB PRO A 468 5.874 -7.069 5.071 1.00 0.00 C ATOM 739 CG PRO A 468 6.497 -7.579 3.818 1.00 0.00 C ATOM 740 CD PRO A 468 7.658 -8.463 4.217 1.00 0.00 C ATOM 0 HA PRO A 468 7.516 -6.067 6.157 1.00 0.00 H new ATOM 0 HB2 PRO A 468 5.067 -7.721 5.405 1.00 0.00 H new ATOM 0 HB3 PRO A 468 5.444 -6.078 4.925 1.00 0.00 H new ATOM 0 HG2 PRO A 468 5.771 -8.141 3.230 1.00 0.00 H new ATOM 0 HG3 PRO A 468 6.840 -6.752 3.196 1.00 0.00 H new ATOM 0 HD2 PRO A 468 7.405 -9.520 4.129 1.00 0.00 H new ATOM 0 HD3 PRO A 468 8.528 -8.290 3.584 1.00 0.00 H new ATOM 748 N PRO A 469 5.888 -6.284 8.110 1.00 0.00 N ATOM 749 CA PRO A 469 5.329 -6.392 9.461 1.00 0.00 C ATOM 750 C PRO A 469 4.046 -7.216 9.494 1.00 0.00 C ATOM 751 O PRO A 469 3.645 -7.799 8.487 1.00 0.00 O ATOM 752 CB PRO A 469 5.041 -4.938 9.844 1.00 0.00 C ATOM 753 CG PRO A 469 4.818 -4.242 8.546 1.00 0.00 C ATOM 754 CD PRO A 469 5.704 -4.940 7.538 1.00 0.00 C ATOM 0 HA PRO A 469 6.010 -6.900 10.144 1.00 0.00 H new ATOM 0 HB2 PRO A 469 4.165 -4.864 10.488 1.00 0.00 H new ATOM 0 HB3 PRO A 469 5.876 -4.499 10.390 1.00 0.00 H new ATOM 0 HG2 PRO A 469 3.771 -4.298 8.249 1.00 0.00 H new ATOM 0 HG3 PRO A 469 5.072 -3.185 8.622 1.00 0.00 H new ATOM 0 HD2 PRO A 469 5.235 -4.984 6.555 1.00 0.00 H new ATOM 0 HD3 PRO A 469 6.656 -4.423 7.415 1.00 0.00 H new ATOM 762 N LYS A 470 3.406 -7.260 10.657 1.00 0.00 N ATOM 763 CA LYS A 470 2.167 -8.011 10.822 1.00 0.00 C ATOM 764 C LYS A 470 1.354 -8.007 9.531 1.00 0.00 C ATOM 765 O LYS A 470 1.219 -9.034 8.868 1.00 0.00 O ATOM 766 CB LYS A 470 1.336 -7.420 11.963 1.00 0.00 C ATOM 767 CG LYS A 470 0.476 -8.444 12.683 1.00 0.00 C ATOM 768 CD LYS A 470 1.216 -9.068 13.854 1.00 0.00 C ATOM 769 CE LYS A 470 2.007 -10.294 13.424 1.00 0.00 C ATOM 770 NZ LYS A 470 2.525 -11.057 14.593 1.00 0.00 N ATOM 0 H LYS A 470 3.725 -6.784 11.501 1.00 0.00 H new ATOM 0 HA LYS A 470 2.425 -9.042 11.066 1.00 0.00 H new ATOM 0 HB2 LYS A 470 2.006 -6.950 12.683 1.00 0.00 H new ATOM 0 HB3 LYS A 470 0.694 -6.634 11.565 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -0.437 -7.967 13.040 1.00 0.00 H new ATOM 0 HG3 LYS A 470 0.175 -9.224 11.984 1.00 0.00 H new ATOM 0 HD2 LYS A 470 1.891 -8.333 14.292 1.00 0.00 H new ATOM 0 HD3 LYS A 470 0.503 -9.347 14.629 1.00 0.00 H new ATOM 0 HE2 LYS A 470 1.372 -10.942 12.819 1.00 0.00 H new ATOM 0 HE3 LYS A 470 2.841 -9.986 12.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 3.058 -11.885 14.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 3.151 -10.447 15.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 1.728 -11.373 15.182 1.00 0.00 H new ATOM 784 N GLY A 471 0.814 -6.844 9.181 1.00 0.00 N ATOM 785 CA GLY A 471 0.022 -6.728 7.970 1.00 0.00 C ATOM 786 C GLY A 471 -0.405 -5.301 7.690 1.00 0.00 C ATOM 787 O GLY A 471 -1.598 -4.998 7.654 1.00 0.00 O ATOM 0 H GLY A 471 0.911 -5.980 9.714 1.00 0.00 H new ATOM 0 HA2 GLY A 471 0.599 -7.104 7.125 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -0.863 -7.358 8.057 1.00 0.00 H new ATOM 791 N TYR A 472 0.571 -4.422 7.492 1.00 0.00 N ATOM 792 CA TYR A 472 0.290 -3.017 7.218 1.00 0.00 C ATOM 793 C TYR A 472 1.450 -2.367 6.470 1.00 0.00 C ATOM 794 O TYR A 472 2.590 -2.383 6.933 1.00 0.00 O ATOM 795 CB TYR A 472 0.024 -2.265 8.523 1.00 0.00 C ATOM 796 CG TYR A 472 0.933 -2.680 9.658 1.00 0.00 C ATOM 797 CD1 TYR A 472 2.196 -2.119 9.803 1.00 0.00 C ATOM 798 CD2 TYR A 472 0.530 -3.633 10.584 1.00 0.00 C ATOM 799 CE1 TYR A 472 3.031 -2.495 10.837 1.00 0.00 C ATOM 800 CE2 TYR A 472 1.357 -4.015 11.623 1.00 0.00 C ATOM 801 CZ TYR A 472 2.606 -3.443 11.745 1.00 0.00 C ATOM 802 OH TYR A 472 3.433 -3.821 12.778 1.00 0.00 O ATOM 0 H TYR A 472 1.563 -4.657 7.516 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.599 -2.965 6.589 1.00 0.00 H new ATOM 0 HB2 TYR A 472 0.142 -1.196 8.347 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -1.012 -2.427 8.821 1.00 0.00 H new ATOM 0 HD1 TYR A 472 2.531 -1.376 9.095 1.00 0.00 H new ATOM 0 HD2 TYR A 472 -0.447 -4.084 10.491 1.00 0.00 H new ATOM 0 HE1 TYR A 472 4.010 -2.050 10.934 1.00 0.00 H new ATOM 0 HE2 TYR A 472 1.027 -4.757 12.335 1.00 0.00 H new ATOM 0 HH TYR A 472 2.983 -4.496 13.327 1.00 0.00 H new ATOM 812 N ALA A 473 1.148 -1.793 5.310 1.00 0.00 N ATOM 813 CA ALA A 473 2.163 -1.133 4.497 1.00 0.00 C ATOM 814 C ALA A 473 1.605 0.120 3.832 1.00 0.00 C ATOM 815 O ALA A 473 0.390 0.311 3.765 1.00 0.00 O ATOM 816 CB ALA A 473 2.705 -2.093 3.448 1.00 0.00 C ATOM 0 H ALA A 473 0.209 -1.772 4.912 1.00 0.00 H new ATOM 0 HA ALA A 473 2.979 -0.831 5.154 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.462 -1.587 2.848 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.151 -2.957 3.941 1.00 0.00 H new ATOM 0 HB3 ALA A 473 1.891 -2.423 2.802 1.00 0.00 H new ATOM 822 N PHE A 474 2.499 0.973 3.342 1.00 0.00 N ATOM 823 CA PHE A 474 2.095 2.209 2.683 1.00 0.00 C ATOM 824 C PHE A 474 2.533 2.216 1.222 1.00 0.00 C ATOM 825 O PHE A 474 3.725 2.290 0.919 1.00 0.00 O ATOM 826 CB PHE A 474 2.689 3.417 3.411 1.00 0.00 C ATOM 827 CG PHE A 474 2.130 3.621 4.790 1.00 0.00 C ATOM 828 CD1 PHE A 474 2.466 2.761 5.822 1.00 0.00 C ATOM 829 CD2 PHE A 474 1.268 4.674 5.053 1.00 0.00 C ATOM 830 CE1 PHE A 474 1.954 2.946 7.093 1.00 0.00 C ATOM 831 CE2 PHE A 474 0.752 4.864 6.321 1.00 0.00 C ATOM 832 CZ PHE A 474 1.095 3.999 7.342 1.00 0.00 C ATOM 0 H PHE A 474 3.508 0.831 3.389 1.00 0.00 H new ATOM 0 HA PHE A 474 1.007 2.271 2.717 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.770 3.294 3.480 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.508 4.313 2.818 1.00 0.00 H new ATOM 0 HD1 PHE A 474 3.136 1.936 5.632 1.00 0.00 H new ATOM 0 HD2 PHE A 474 0.997 5.353 4.259 1.00 0.00 H new ATOM 0 HE1 PHE A 474 2.225 2.269 7.889 1.00 0.00 H new ATOM 0 HE2 PHE A 474 0.081 5.688 6.513 1.00 0.00 H new ATOM 0 HZ PHE A 474 0.692 4.146 8.333 1.00 0.00 H new ATOM 842 N LEU A 475 1.561 2.136 0.319 1.00 0.00 N ATOM 843 CA LEU A 475 1.845 2.131 -1.112 1.00 0.00 C ATOM 844 C LEU A 475 1.999 3.554 -1.641 1.00 0.00 C ATOM 845 O LEU A 475 1.226 4.446 -1.288 1.00 0.00 O ATOM 846 CB LEU A 475 0.730 1.410 -1.871 1.00 0.00 C ATOM 847 CG LEU A 475 0.400 -0.005 -1.394 1.00 0.00 C ATOM 848 CD1 LEU A 475 -0.669 -0.630 -2.277 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.653 -0.868 -1.377 1.00 0.00 C ATOM 0 H LEU A 475 0.570 2.074 0.552 1.00 0.00 H new ATOM 0 HA LEU A 475 2.784 1.601 -1.269 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.175 2.014 -1.807 1.00 0.00 H new ATOM 0 HB3 LEU A 475 1.007 1.362 -2.924 1.00 0.00 H new ATOM 0 HG LEU A 475 0.012 0.056 -0.377 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -0.891 -1.637 -1.923 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.574 -0.024 -2.237 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.309 -0.678 -3.305 1.00 0.00 H new ATOM 0 HD21 LEU A 475 1.399 -1.871 -1.035 1.00 0.00 H new ATOM 0 HD22 LEU A 475 2.071 -0.922 -2.382 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.388 -0.430 -0.702 1.00 0.00 H new ATOM 861 N LEU A 476 2.998 3.759 -2.492 1.00 0.00 N ATOM 862 CA LEU A 476 3.252 5.073 -3.072 1.00 0.00 C ATOM 863 C LEU A 476 3.271 5.000 -4.596 1.00 0.00 C ATOM 864 O LEU A 476 4.336 5.007 -5.215 1.00 0.00 O ATOM 865 CB LEU A 476 4.581 5.631 -2.560 1.00 0.00 C ATOM 866 CG LEU A 476 4.586 6.132 -1.115 1.00 0.00 C ATOM 867 CD1 LEU A 476 6.012 6.295 -0.612 1.00 0.00 C ATOM 868 CD2 LEU A 476 3.826 7.446 -1.004 1.00 0.00 C ATOM 0 H LEU A 476 3.646 3.032 -2.796 1.00 0.00 H new ATOM 0 HA LEU A 476 2.445 5.739 -2.768 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.340 4.854 -2.657 1.00 0.00 H new ATOM 0 HB3 LEU A 476 4.881 6.453 -3.210 1.00 0.00 H new ATOM 0 HG LEU A 476 4.085 5.391 -0.492 1.00 0.00 H new ATOM 0 HD11 LEU A 476 5.996 6.652 0.418 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.525 5.334 -0.655 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.538 7.016 -1.238 1.00 0.00 H new ATOM 0 HD21 LEU A 476 3.840 7.788 0.031 1.00 0.00 H new ATOM 0 HD22 LEU A 476 4.299 8.195 -1.640 1.00 0.00 H new ATOM 0 HD23 LEU A 476 2.794 7.298 -1.324 1.00 0.00 H new ATOM 880 N PHE A 477 2.087 4.932 -5.195 1.00 0.00 N ATOM 881 CA PHE A 477 1.968 4.860 -6.646 1.00 0.00 C ATOM 882 C PHE A 477 2.719 6.010 -7.312 1.00 0.00 C ATOM 883 O PHE A 477 2.671 7.148 -6.845 1.00 0.00 O ATOM 884 CB PHE A 477 0.495 4.891 -7.060 1.00 0.00 C ATOM 885 CG PHE A 477 -0.262 3.652 -6.674 1.00 0.00 C ATOM 886 CD1 PHE A 477 -0.313 2.561 -7.527 1.00 0.00 C ATOM 887 CD2 PHE A 477 -0.922 3.579 -5.458 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.010 1.421 -7.174 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.620 2.441 -5.100 1.00 0.00 C ATOM 890 CZ PHE A 477 -1.663 1.360 -5.959 1.00 0.00 C ATOM 0 H PHE A 477 1.196 4.925 -4.698 1.00 0.00 H new ATOM 0 HA PHE A 477 2.412 3.921 -6.975 1.00 0.00 H new ATOM 0 HB2 PHE A 477 0.016 5.757 -6.604 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.432 5.024 -8.140 1.00 0.00 H new ATOM 0 HD1 PHE A 477 0.197 2.602 -8.478 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -0.891 4.421 -4.782 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -1.044 0.578 -7.848 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -2.131 2.397 -4.150 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.206 0.469 -5.681 1.00 0.00 H new ATOM 900 N GLN A 478 3.411 5.703 -8.404 1.00 0.00 N ATOM 901 CA GLN A 478 4.174 6.710 -9.132 1.00 0.00 C ATOM 902 C GLN A 478 3.251 7.779 -9.709 1.00 0.00 C ATOM 903 O GLN A 478 3.459 8.972 -9.493 1.00 0.00 O ATOM 904 CB GLN A 478 4.980 6.055 -10.256 1.00 0.00 C ATOM 905 CG GLN A 478 5.834 7.036 -11.043 1.00 0.00 C ATOM 906 CD GLN A 478 6.748 6.348 -12.037 1.00 0.00 C ATOM 907 OE1 GLN A 478 7.823 5.867 -11.680 1.00 0.00 O ATOM 908 NE2 GLN A 478 6.323 6.296 -13.294 1.00 0.00 N ATOM 0 H GLN A 478 3.459 4.766 -8.804 1.00 0.00 H new ATOM 0 HA GLN A 478 4.860 7.187 -8.432 1.00 0.00 H new ATOM 0 HB2 GLN A 478 5.624 5.286 -9.830 1.00 0.00 H new ATOM 0 HB3 GLN A 478 4.294 5.554 -10.939 1.00 0.00 H new ATOM 0 HG2 GLN A 478 5.185 7.732 -11.574 1.00 0.00 H new ATOM 0 HG3 GLN A 478 6.435 7.625 -10.350 1.00 0.00 H new ATOM 0 HE21 GLN A 478 5.425 6.708 -13.546 1.00 0.00 H new ATOM 0 HE22 GLN A 478 6.895 5.844 -14.007 1.00 0.00 H new ATOM 917 N GLU A 479 2.233 7.342 -10.443 1.00 0.00 N ATOM 918 CA GLU A 479 1.280 8.263 -11.052 1.00 0.00 C ATOM 919 C GLU A 479 0.032 8.405 -10.185 1.00 0.00 C ATOM 920 O GLU A 479 -0.338 7.485 -9.457 1.00 0.00 O ATOM 921 CB GLU A 479 0.891 7.779 -12.450 1.00 0.00 C ATOM 922 CG GLU A 479 1.816 8.278 -13.547 1.00 0.00 C ATOM 923 CD GLU A 479 1.167 8.248 -14.917 1.00 0.00 C ATOM 924 OE1 GLU A 479 0.164 8.965 -15.115 1.00 0.00 O ATOM 925 OE2 GLU A 479 1.663 7.506 -15.791 1.00 0.00 O ATOM 0 H GLU A 479 2.047 6.357 -10.630 1.00 0.00 H new ATOM 0 HA GLU A 479 1.758 9.239 -11.134 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.885 6.689 -12.459 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.126 8.105 -12.668 1.00 0.00 H new ATOM 0 HG2 GLU A 479 2.127 9.297 -13.319 1.00 0.00 H new ATOM 0 HG3 GLU A 479 2.718 7.666 -13.563 1.00 0.00 H new ATOM 932 N GLU A 480 -0.611 9.566 -10.270 1.00 0.00 N ATOM 933 CA GLU A 480 -1.816 9.829 -9.493 1.00 0.00 C ATOM 934 C GLU A 480 -3.011 9.075 -10.070 1.00 0.00 C ATOM 935 O GLU A 480 -3.840 8.546 -9.330 1.00 0.00 O ATOM 936 CB GLU A 480 -2.112 11.330 -9.462 1.00 0.00 C ATOM 937 CG GLU A 480 -1.429 12.062 -8.319 1.00 0.00 C ATOM 938 CD GLU A 480 -1.634 13.563 -8.383 1.00 0.00 C ATOM 939 OE1 GLU A 480 -1.108 14.195 -9.323 1.00 0.00 O ATOM 940 OE2 GLU A 480 -2.320 14.106 -7.492 1.00 0.00 O ATOM 0 H GLU A 480 -0.318 10.338 -10.869 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.645 9.479 -8.475 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -1.796 11.773 -10.406 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -3.189 11.478 -9.385 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -1.813 11.687 -7.371 1.00 0.00 H new ATOM 0 HG3 GLU A 480 -0.361 11.844 -8.339 1.00 0.00 H new ATOM 947 N SER A 481 -3.092 9.032 -11.396 1.00 0.00 N ATOM 948 CA SER A 481 -4.188 8.348 -12.073 1.00 0.00 C ATOM 949 C SER A 481 -4.461 6.992 -11.429 1.00 0.00 C ATOM 950 O SER A 481 -5.598 6.680 -11.073 1.00 0.00 O ATOM 951 CB SER A 481 -3.863 8.165 -13.556 1.00 0.00 C ATOM 952 OG SER A 481 -3.778 9.415 -14.218 1.00 0.00 O ATOM 0 H SER A 481 -2.412 9.462 -12.023 1.00 0.00 H new ATOM 0 HA SER A 481 -5.083 8.963 -11.978 1.00 0.00 H new ATOM 0 HB2 SER A 481 -2.919 7.629 -13.661 1.00 0.00 H new ATOM 0 HB3 SER A 481 -4.632 7.552 -14.027 1.00 0.00 H new ATOM 0 HG SER A 481 -3.568 9.270 -15.164 1.00 0.00 H new ATOM 958 N SER A 482 -3.411 6.190 -11.283 1.00 0.00 N ATOM 959 CA SER A 482 -3.538 4.866 -10.686 1.00 0.00 C ATOM 960 C SER A 482 -4.398 4.917 -9.428 1.00 0.00 C ATOM 961 O SER A 482 -5.227 4.038 -9.191 1.00 0.00 O ATOM 962 CB SER A 482 -2.156 4.301 -10.351 1.00 0.00 C ATOM 963 OG SER A 482 -1.554 5.021 -9.290 1.00 0.00 O ATOM 0 H SER A 482 -2.463 6.434 -11.570 1.00 0.00 H new ATOM 0 HA SER A 482 -4.025 4.213 -11.410 1.00 0.00 H new ATOM 0 HB2 SER A 482 -2.246 3.250 -10.076 1.00 0.00 H new ATOM 0 HB3 SER A 482 -1.518 4.346 -11.233 1.00 0.00 H new ATOM 0 HG SER A 482 -1.197 5.868 -9.630 1.00 0.00 H new ATOM 969 N VAL A 483 -4.196 5.955 -8.622 1.00 0.00 N ATOM 970 CA VAL A 483 -4.953 6.123 -7.387 1.00 0.00 C ATOM 971 C VAL A 483 -6.449 5.966 -7.634 1.00 0.00 C ATOM 972 O VAL A 483 -7.097 5.103 -7.043 1.00 0.00 O ATOM 973 CB VAL A 483 -4.691 7.502 -6.752 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.525 7.677 -5.492 1.00 0.00 C ATOM 975 CG2 VAL A 483 -3.210 7.676 -6.449 1.00 0.00 C ATOM 0 H VAL A 483 -3.514 6.692 -8.802 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.617 5.345 -6.701 1.00 0.00 H new ATOM 0 HB VAL A 483 -4.986 8.273 -7.464 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -5.327 8.657 -5.057 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.583 7.598 -5.742 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -5.264 6.901 -4.772 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -3.043 8.655 -6.001 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -2.887 6.900 -5.755 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.638 7.598 -7.373 1.00 0.00 H new ATOM 985 N GLN A 484 -6.990 6.805 -8.511 1.00 0.00 N ATOM 986 CA GLN A 484 -8.411 6.758 -8.836 1.00 0.00 C ATOM 987 C GLN A 484 -8.860 5.327 -9.108 1.00 0.00 C ATOM 988 O GLN A 484 -9.747 4.805 -8.433 1.00 0.00 O ATOM 989 CB GLN A 484 -8.707 7.638 -10.052 1.00 0.00 C ATOM 990 CG GLN A 484 -10.173 7.648 -10.453 1.00 0.00 C ATOM 991 CD GLN A 484 -11.050 8.361 -9.443 1.00 0.00 C ATOM 992 OE1 GLN A 484 -10.897 9.560 -9.208 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.976 7.625 -8.840 1.00 0.00 N ATOM 0 H GLN A 484 -6.467 7.525 -9.009 1.00 0.00 H new ATOM 0 HA GLN A 484 -8.967 7.137 -7.978 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -8.391 8.659 -9.837 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -8.111 7.290 -10.895 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -10.277 8.132 -11.424 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.521 6.622 -10.570 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -12.067 6.635 -9.066 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -12.596 8.050 -8.151 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.242 4.696 -10.102 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.577 3.324 -10.462 1.00 0.00 C ATOM 1004 C ALA A 485 -8.712 2.448 -9.221 1.00 0.00 C ATOM 1005 O ALA A 485 -9.660 1.672 -9.097 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.526 2.753 -11.402 1.00 0.00 C ATOM 0 H ALA A 485 -7.507 5.114 -10.672 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.539 3.334 -10.974 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -7.789 1.728 -11.662 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.481 3.357 -12.308 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.553 2.764 -10.910 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.758 2.577 -8.306 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.770 1.796 -7.073 1.00 0.00 C ATOM 1014 C LEU A 486 -9.104 1.940 -6.350 1.00 0.00 C ATOM 1015 O LEU A 486 -9.692 0.952 -5.908 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.628 2.238 -6.156 1.00 0.00 C ATOM 1017 CG LEU A 486 -6.279 1.284 -5.013 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.569 0.049 -5.546 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -5.419 1.989 -3.974 1.00 0.00 C ATOM 0 H LEU A 486 -6.967 3.214 -8.394 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.632 0.747 -7.335 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.736 2.386 -6.765 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -6.886 3.207 -5.728 1.00 0.00 H new ATOM 0 HG LEU A 486 -7.205 0.967 -4.534 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.329 -0.618 -4.718 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.219 -0.468 -6.252 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -4.650 0.347 -6.050 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -5.180 1.295 -3.168 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.496 2.336 -4.440 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -5.964 2.842 -3.569 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.579 3.176 -6.235 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.846 3.449 -5.568 1.00 0.00 C ATOM 1033 C ILE A 487 -12.017 2.876 -6.358 1.00 0.00 C ATOM 1034 O ILE A 487 -13.089 2.627 -5.807 1.00 0.00 O ATOM 1035 CB ILE A 487 -11.064 4.960 -5.371 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.870 5.580 -4.643 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -12.351 5.213 -4.599 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.963 7.083 -4.499 1.00 0.00 C ATOM 0 H ILE A 487 -9.105 4.004 -6.595 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.799 2.967 -4.591 1.00 0.00 H new ATOM 0 HB ILE A 487 -11.152 5.430 -6.351 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.787 5.133 -3.652 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.956 5.331 -5.183 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -12.492 6.286 -4.468 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -13.195 4.802 -5.153 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -12.290 4.733 -3.622 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -9.083 7.453 -3.974 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -10.015 7.541 -5.487 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -10.858 7.340 -3.933 1.00 0.00 H new ATOM 1050 N ASP A 488 -11.804 2.667 -7.653 1.00 0.00 N ATOM 1051 CA ASP A 488 -12.842 2.120 -8.520 1.00 0.00 C ATOM 1052 C ASP A 488 -12.899 0.600 -8.407 1.00 0.00 C ATOM 1053 O ASP A 488 -13.969 0.000 -8.503 1.00 0.00 O ATOM 1054 CB ASP A 488 -12.589 2.527 -9.972 1.00 0.00 C ATOM 1055 CG ASP A 488 -13.256 3.841 -10.330 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -14.257 4.195 -9.673 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -12.778 4.514 -11.267 1.00 0.00 O ATOM 0 H ASP A 488 -10.923 2.868 -8.125 1.00 0.00 H new ATOM 0 HA ASP A 488 -13.801 2.526 -8.199 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -11.515 2.610 -10.141 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -12.957 1.744 -10.635 1.00 0.00 H new ATOM 1062 N ALA A 489 -11.739 -0.017 -8.204 1.00 0.00 N ATOM 1063 CA ALA A 489 -11.657 -1.467 -8.077 1.00 0.00 C ATOM 1064 C ALA A 489 -11.899 -1.907 -6.637 1.00 0.00 C ATOM 1065 O ALA A 489 -12.408 -3.001 -6.389 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.304 -1.964 -8.562 1.00 0.00 C ATOM 0 H ALA A 489 -10.844 0.465 -8.124 1.00 0.00 H new ATOM 0 HA ALA A 489 -12.437 -1.906 -8.699 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -10.257 -3.048 -8.461 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.170 -1.691 -9.609 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -9.514 -1.510 -7.964 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.531 -1.049 -5.692 1.00 0.00 N ATOM 1073 CA CYS A 490 -11.707 -1.350 -4.275 1.00 0.00 C ATOM 1074 C CYS A 490 -13.129 -1.035 -3.825 1.00 0.00 C ATOM 1075 O CYS A 490 -13.568 0.115 -3.874 1.00 0.00 O ATOM 1076 CB CYS A 490 -10.705 -0.555 -3.436 1.00 0.00 C ATOM 1077 SG CYS A 490 -8.976 -0.862 -3.863 1.00 0.00 S ATOM 0 H CYS A 490 -11.109 -0.140 -5.881 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.527 -2.415 -4.130 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -10.913 0.509 -3.552 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -10.856 -0.796 -2.384 1.00 0.00 H new ATOM 0 HG CYS A 490 -8.709 -0.314 -5.011 1.00 0.00 H new ATOM 1083 N LEU A 491 -13.847 -2.064 -3.387 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.222 -1.898 -2.929 1.00 0.00 C ATOM 1085 C LEU A 491 -15.308 -0.838 -1.836 1.00 0.00 C ATOM 1086 O LEU A 491 -14.296 -0.266 -1.433 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.771 -3.228 -2.410 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.685 -4.412 -3.374 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.876 -5.723 -2.627 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -16.718 -4.273 -4.482 1.00 0.00 C ATOM 0 H LEU A 491 -13.500 -3.022 -3.339 1.00 0.00 H new ATOM 0 HA LEU A 491 -15.824 -1.569 -3.776 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -15.234 -3.488 -1.498 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.816 -3.084 -2.135 1.00 0.00 H new ATOM 0 HG LEU A 491 -14.694 -4.416 -3.827 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -15.812 -6.554 -3.329 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -15.099 -5.827 -1.870 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -16.854 -5.729 -2.146 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -16.642 -5.124 -5.159 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -17.717 -4.243 -4.047 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -16.536 -3.352 -5.036 1.00 0.00 H new ATOM 1102 N GLU A 492 -16.522 -0.583 -1.360 1.00 0.00 N ATOM 1103 CA GLU A 492 -16.739 0.408 -0.312 1.00 0.00 C ATOM 1104 C GLU A 492 -17.868 -0.023 0.619 1.00 0.00 C ATOM 1105 O GLU A 492 -18.885 -0.555 0.173 1.00 0.00 O ATOM 1106 CB GLU A 492 -17.062 1.771 -0.927 1.00 0.00 C ATOM 1107 CG GLU A 492 -17.018 2.915 0.071 1.00 0.00 C ATOM 1108 CD GLU A 492 -17.737 4.153 -0.428 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -18.590 4.021 -1.331 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -17.447 5.255 0.084 1.00 0.00 O ATOM 0 H GLU A 492 -17.370 -1.048 -1.683 1.00 0.00 H new ATOM 0 HA GLU A 492 -15.822 0.489 0.271 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -16.355 1.974 -1.731 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -18.054 1.731 -1.377 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -17.469 2.591 1.009 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -15.979 3.165 0.286 1.00 0.00 H new ATOM 1117 N GLU A 493 -17.681 0.210 1.914 1.00 0.00 N ATOM 1118 CA GLU A 493 -18.683 -0.156 2.908 1.00 0.00 C ATOM 1119 C GLU A 493 -19.241 1.085 3.601 1.00 0.00 C ATOM 1120 O GLU A 493 -20.379 1.485 3.358 1.00 0.00 O ATOM 1121 CB GLU A 493 -18.082 -1.106 3.946 1.00 0.00 C ATOM 1122 CG GLU A 493 -19.107 -1.686 4.907 1.00 0.00 C ATOM 1123 CD GLU A 493 -18.482 -2.592 5.949 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -18.252 -3.780 5.640 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -18.223 -2.114 7.073 1.00 0.00 O ATOM 0 H GLU A 493 -16.845 0.650 2.299 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.500 -0.662 2.393 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -17.578 -1.923 3.430 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -17.322 -0.573 4.517 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -19.632 -0.872 5.407 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -19.852 -2.247 4.343 1.00 0.00 H new ATOM 1132 N ASP A 494 -18.430 1.687 4.464 1.00 0.00 N ATOM 1133 CA ASP A 494 -18.841 2.883 5.192 1.00 0.00 C ATOM 1134 C ASP A 494 -17.794 3.984 5.062 1.00 0.00 C ATOM 1135 O ASP A 494 -17.105 4.316 6.025 1.00 0.00 O ATOM 1136 CB ASP A 494 -19.072 2.553 6.667 1.00 0.00 C ATOM 1137 CG ASP A 494 -20.084 3.477 7.315 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -19.708 4.613 7.671 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -21.253 3.064 7.467 1.00 0.00 O ATOM 0 H ASP A 494 -17.485 1.367 4.677 1.00 0.00 H new ATOM 0 HA ASP A 494 -19.774 3.241 4.757 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -19.416 1.522 6.756 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -18.126 2.621 7.204 1.00 0.00 H new ATOM 1144 N GLY A 495 -17.680 4.547 3.863 1.00 0.00 N ATOM 1145 CA GLY A 495 -16.714 5.605 3.628 1.00 0.00 C ATOM 1146 C GLY A 495 -15.323 5.069 3.351 1.00 0.00 C ATOM 1147 O GLY A 495 -14.498 5.748 2.740 1.00 0.00 O ATOM 0 H GLY A 495 -18.239 4.289 3.050 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -17.042 6.211 2.783 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -16.681 6.262 4.497 1.00 0.00 H new ATOM 1151 N LYS A 496 -15.061 3.847 3.802 1.00 0.00 N ATOM 1152 CA LYS A 496 -13.761 3.219 3.601 1.00 0.00 C ATOM 1153 C LYS A 496 -13.823 2.189 2.477 1.00 0.00 C ATOM 1154 O LYS A 496 -14.878 1.616 2.204 1.00 0.00 O ATOM 1155 CB LYS A 496 -13.287 2.551 4.894 1.00 0.00 C ATOM 1156 CG LYS A 496 -12.900 3.538 5.981 1.00 0.00 C ATOM 1157 CD LYS A 496 -13.111 2.952 7.367 1.00 0.00 C ATOM 1158 CE LYS A 496 -14.528 3.195 7.865 1.00 0.00 C ATOM 1159 NZ LYS A 496 -15.475 2.158 7.368 1.00 0.00 N ATOM 0 H LYS A 496 -15.733 3.271 4.310 1.00 0.00 H new ATOM 0 HA LYS A 496 -13.050 3.996 3.320 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -14.078 1.902 5.269 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -12.431 1.914 4.671 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -11.855 3.822 5.860 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -13.492 4.447 5.875 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -12.911 1.881 7.345 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -12.399 3.395 8.063 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -14.534 3.200 8.955 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -14.864 4.180 7.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -16.139 1.903 8.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -16.005 2.533 6.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -14.943 1.314 7.075 1.00 0.00 H new ATOM 1173 N LEU A 497 -12.686 1.956 1.831 1.00 0.00 N ATOM 1174 CA LEU A 497 -12.610 0.993 0.737 1.00 0.00 C ATOM 1175 C LEU A 497 -12.108 -0.358 1.236 1.00 0.00 C ATOM 1176 O LEU A 497 -11.671 -0.486 2.380 1.00 0.00 O ATOM 1177 CB LEU A 497 -11.690 1.517 -0.367 1.00 0.00 C ATOM 1178 CG LEU A 497 -11.988 2.927 -0.876 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -10.817 3.460 -1.688 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -13.263 2.936 -1.707 1.00 0.00 C ATOM 0 H LEU A 497 -11.804 2.421 2.046 1.00 0.00 H new ATOM 0 HA LEU A 497 -13.613 0.860 0.332 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -10.664 1.495 0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -11.741 0.829 -1.211 1.00 0.00 H new ATOM 0 HG LEU A 497 -12.134 3.580 -0.015 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -11.047 4.465 -2.042 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -9.925 3.491 -1.063 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -10.639 2.806 -2.542 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -13.459 3.948 -2.061 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -13.145 2.269 -2.561 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -14.099 2.597 -1.095 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.171 -1.363 0.369 1.00 0.00 N ATOM 1193 CA TYR A 498 -11.723 -2.705 0.721 1.00 0.00 C ATOM 1194 C TYR A 498 -11.358 -3.502 -0.527 1.00 0.00 C ATOM 1195 O TYR A 498 -12.200 -3.743 -1.393 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.810 -3.438 1.509 1.00 0.00 C ATOM 1197 CG TYR A 498 -13.064 -2.853 2.880 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -12.233 -3.155 3.951 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -14.136 -1.996 3.103 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -12.462 -2.623 5.205 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -14.372 -1.458 4.353 1.00 0.00 C ATOM 1202 CZ TYR A 498 -13.533 -1.775 5.401 1.00 0.00 C ATOM 1203 OH TYR A 498 -13.763 -1.242 6.648 1.00 0.00 O ATOM 0 H TYR A 498 -12.528 -1.273 -0.582 1.00 0.00 H new ATOM 0 HA TYR A 498 -10.833 -2.612 1.343 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.738 -3.417 0.937 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -12.525 -4.485 1.617 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -11.393 -3.817 3.801 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -14.795 -1.747 2.285 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -11.807 -2.869 6.027 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -15.209 -0.793 4.509 1.00 0.00 H new ATOM 0 HH TYR A 498 -14.555 -0.665 6.616 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.097 -3.910 -0.612 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.618 -4.682 -1.754 1.00 0.00 C ATOM 1215 C LEU A 499 -9.308 -6.120 -1.348 1.00 0.00 C ATOM 1216 O LEU A 499 -8.825 -6.373 -0.244 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.370 -4.028 -2.349 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.007 -4.447 -3.774 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.199 -4.269 -4.702 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -6.813 -3.649 -4.277 1.00 0.00 C ATOM 0 H LEU A 499 -9.388 -3.719 0.096 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.406 -4.698 -2.507 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.508 -2.947 -2.334 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.523 -4.250 -1.700 1.00 0.00 H new ATOM 0 HG LEU A 499 -7.735 -5.502 -3.764 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -8.922 -4.572 -5.712 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.027 -4.885 -4.352 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.503 -3.222 -4.708 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.569 -3.961 -5.293 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -7.057 -2.587 -4.272 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -5.956 -3.827 -3.627 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.587 -7.056 -2.248 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.337 -8.468 -1.984 1.00 0.00 C ATOM 1234 C CYS A 500 -8.000 -8.903 -2.575 1.00 0.00 C ATOM 1235 O CYS A 500 -7.714 -8.648 -3.745 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.466 -9.324 -2.561 1.00 0.00 C ATOM 1237 SG CYS A 500 -10.724 -9.105 -4.338 1.00 0.00 S ATOM 0 H CYS A 500 -9.986 -6.863 -3.166 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.300 -8.609 -0.904 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.249 -10.374 -2.363 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -11.392 -9.085 -2.038 1.00 0.00 H new ATOM 0 HG CYS A 500 -9.586 -8.854 -4.914 1.00 0.00 H new ATOM 1243 N VAL A 501 -7.184 -9.561 -1.758 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.876 -10.031 -2.199 1.00 0.00 C ATOM 1245 C VAL A 501 -5.702 -11.519 -1.913 1.00 0.00 C ATOM 1246 O VAL A 501 -5.883 -11.969 -0.782 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.739 -9.251 -1.514 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -4.637 -7.844 -2.084 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.952 -9.211 -0.008 1.00 0.00 C ATOM 0 H VAL A 501 -7.406 -9.781 -0.787 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.825 -9.862 -3.275 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.799 -9.766 -1.711 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -3.828 -7.308 -1.588 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -4.434 -7.899 -3.153 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -5.576 -7.316 -1.920 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -4.139 -8.656 0.460 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.900 -8.721 0.212 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.970 -10.228 0.384 1.00 0.00 H new ATOM 1259 N SER A 502 -5.347 -12.277 -2.945 1.00 0.00 N ATOM 1260 CA SER A 502 -5.151 -13.715 -2.806 1.00 0.00 C ATOM 1261 C SER A 502 -3.669 -14.071 -2.878 1.00 0.00 C ATOM 1262 O SER A 502 -3.004 -13.805 -3.879 1.00 0.00 O ATOM 1263 CB SER A 502 -5.920 -14.464 -3.896 1.00 0.00 C ATOM 1264 OG SER A 502 -5.416 -14.152 -5.183 1.00 0.00 O ATOM 0 H SER A 502 -5.189 -11.919 -3.887 1.00 0.00 H new ATOM 0 HA SER A 502 -5.532 -14.016 -1.830 1.00 0.00 H new ATOM 0 HB2 SER A 502 -5.847 -15.538 -3.724 1.00 0.00 H new ATOM 0 HB3 SER A 502 -6.977 -14.204 -3.843 1.00 0.00 H new ATOM 0 HG SER A 502 -4.454 -13.975 -5.123 1.00 0.00 H new ATOM 1270 N SER A 503 -3.159 -14.673 -1.809 1.00 0.00 N ATOM 1271 CA SER A 503 -1.755 -15.062 -1.748 1.00 0.00 C ATOM 1272 C SER A 503 -1.609 -16.580 -1.808 1.00 0.00 C ATOM 1273 O SER A 503 -2.535 -17.331 -1.502 1.00 0.00 O ATOM 1274 CB SER A 503 -1.111 -14.527 -0.468 1.00 0.00 C ATOM 1275 OG SER A 503 -1.272 -15.439 0.604 1.00 0.00 O ATOM 0 H SER A 503 -3.697 -14.902 -0.973 1.00 0.00 H new ATOM 0 HA SER A 503 -1.246 -14.631 -2.610 1.00 0.00 H new ATOM 0 HB2 SER A 503 -0.050 -14.346 -0.639 1.00 0.00 H new ATOM 0 HB3 SER A 503 -1.559 -13.569 -0.205 1.00 0.00 H new ATOM 0 HG SER A 503 -0.850 -15.074 1.410 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.416 -17.043 -2.212 1.00 0.00 N ATOM 1282 CA PRO A 504 -0.119 -18.474 -2.322 1.00 0.00 C ATOM 1283 C PRO A 504 -0.566 -19.255 -1.091 1.00 0.00 C ATOM 1284 O PRO A 504 -0.815 -20.459 -1.163 1.00 0.00 O ATOM 1285 CB PRO A 504 1.406 -18.510 -2.454 1.00 0.00 C ATOM 1286 CG PRO A 504 1.764 -17.203 -3.072 1.00 0.00 C ATOM 1287 CD PRO A 504 0.733 -16.205 -2.592 1.00 0.00 C ATOM 0 HA PRO A 504 -0.644 -18.937 -3.158 1.00 0.00 H new ATOM 0 HB2 PRO A 504 1.885 -18.633 -1.482 1.00 0.00 H new ATOM 0 HB3 PRO A 504 1.730 -19.344 -3.076 1.00 0.00 H new ATOM 0 HG2 PRO A 504 2.768 -16.896 -2.777 1.00 0.00 H new ATOM 0 HG3 PRO A 504 1.759 -17.274 -4.160 1.00 0.00 H new ATOM 0 HD2 PRO A 504 1.102 -15.624 -1.746 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.469 -15.495 -3.375 1.00 0.00 H new ATOM 1295 N THR A 505 -0.666 -18.563 0.040 1.00 0.00 N ATOM 1296 CA THR A 505 -1.082 -19.191 1.287 1.00 0.00 C ATOM 1297 C THR A 505 -2.480 -18.738 1.691 1.00 0.00 C ATOM 1298 O THR A 505 -3.421 -19.532 1.700 1.00 0.00 O ATOM 1299 CB THR A 505 -0.100 -18.874 2.431 1.00 0.00 C ATOM 1300 OG1 THR A 505 -0.042 -17.460 2.648 1.00 0.00 O ATOM 1301 CG2 THR A 505 1.291 -19.401 2.112 1.00 0.00 C ATOM 0 H THR A 505 -0.464 -17.566 0.117 1.00 0.00 H new ATOM 0 HA THR A 505 -1.089 -20.267 1.112 1.00 0.00 H new ATOM 0 HB THR A 505 -0.459 -19.366 3.335 1.00 0.00 H new ATOM 0 HG1 THR A 505 0.852 -17.130 2.419 1.00 0.00 H new ATOM 0 HG21 THR A 505 1.967 -19.165 2.934 1.00 0.00 H new ATOM 0 HG22 THR A 505 1.248 -20.482 1.976 1.00 0.00 H new ATOM 0 HG23 THR A 505 1.656 -18.934 1.197 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.608 -17.458 2.025 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.893 -16.900 2.429 1.00 0.00 C ATOM 1311 C ILE A 506 -4.821 -16.734 1.231 1.00 0.00 C ATOM 1312 O ILE A 506 -4.370 -16.502 0.109 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.720 -15.536 3.123 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.692 -15.640 4.251 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -5.055 -15.042 3.659 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -3.108 -16.578 5.363 1.00 0.00 C ATOM 0 H ILE A 506 -1.838 -16.789 2.024 1.00 0.00 H new ATOM 0 HA ILE A 506 -4.336 -17.604 3.134 1.00 0.00 H new ATOM 0 HB ILE A 506 -3.356 -14.816 2.391 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -1.743 -15.979 3.836 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.521 -14.648 4.668 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.917 -14.077 4.147 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.760 -14.934 2.835 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.446 -15.760 4.380 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -2.332 -16.602 6.128 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -4.041 -16.228 5.804 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -3.251 -17.580 4.959 1.00 0.00 H new ATOM 1328 N LYS A 507 -6.122 -16.853 1.476 1.00 0.00 N ATOM 1329 CA LYS A 507 -7.116 -16.713 0.419 1.00 0.00 C ATOM 1330 C LYS A 507 -7.594 -15.269 0.308 1.00 0.00 C ATOM 1331 O LYS A 507 -7.271 -14.432 1.152 1.00 0.00 O ATOM 1332 CB LYS A 507 -8.307 -17.636 0.685 1.00 0.00 C ATOM 1333 CG LYS A 507 -8.151 -19.021 0.079 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.567 -19.040 -1.382 1.00 0.00 C ATOM 1335 CE LYS A 507 -8.552 -20.452 -1.947 1.00 0.00 C ATOM 1336 NZ LYS A 507 -8.548 -20.453 -3.436 1.00 0.00 N ATOM 0 H LYS A 507 -6.512 -17.046 2.398 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.648 -16.996 -0.524 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.447 -17.733 1.762 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -9.210 -17.174 0.287 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -7.113 -19.343 0.167 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -8.755 -19.735 0.640 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -9.567 -18.617 -1.482 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -7.894 -18.408 -1.961 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -7.672 -20.980 -1.581 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -9.424 -20.997 -1.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -8.538 -21.434 -3.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -9.401 -19.971 -3.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -7.703 -19.955 -3.781 1.00 0.00 H new ATOM 1350 N ASP A 508 -8.365 -14.983 -0.735 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.889 -13.640 -0.954 1.00 0.00 C ATOM 1352 C ASP A 508 -9.190 -12.952 0.374 1.00 0.00 C ATOM 1353 O ASP A 508 -10.164 -13.282 1.050 1.00 0.00 O ATOM 1354 CB ASP A 508 -10.154 -13.697 -1.811 1.00 0.00 C ATOM 1355 CG ASP A 508 -9.847 -13.875 -3.285 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -9.177 -12.993 -3.862 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -10.277 -14.896 -3.863 1.00 0.00 O ATOM 0 H ASP A 508 -8.641 -15.664 -1.443 1.00 0.00 H new ATOM 0 HA ASP A 508 -8.130 -13.061 -1.479 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -10.782 -14.520 -1.472 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -10.726 -12.780 -1.670 1.00 0.00 H new ATOM 1362 N LYS A 509 -8.347 -11.993 0.742 1.00 0.00 N ATOM 1363 CA LYS A 509 -8.521 -11.257 1.988 1.00 0.00 C ATOM 1364 C LYS A 509 -8.816 -9.786 1.714 1.00 0.00 C ATOM 1365 O LYS A 509 -8.154 -9.136 0.904 1.00 0.00 O ATOM 1366 CB LYS A 509 -7.269 -11.384 2.859 1.00 0.00 C ATOM 1367 CG LYS A 509 -7.461 -10.877 4.278 1.00 0.00 C ATOM 1368 CD LYS A 509 -8.106 -11.930 5.164 1.00 0.00 C ATOM 1369 CE LYS A 509 -7.121 -13.030 5.529 1.00 0.00 C ATOM 1370 NZ LYS A 509 -7.739 -14.056 6.415 1.00 0.00 N ATOM 0 H LYS A 509 -7.536 -11.707 0.194 1.00 0.00 H new ATOM 0 HA LYS A 509 -9.370 -11.687 2.519 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.966 -12.430 2.894 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -6.454 -10.831 2.392 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -6.496 -10.590 4.696 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -8.082 -9.981 4.264 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -8.483 -11.461 6.073 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -8.964 -12.364 4.650 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -6.756 -13.508 4.620 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -6.256 -12.592 6.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -7.036 -14.788 6.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -8.064 -13.605 7.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -8.549 -14.492 5.929 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.830 -9.246 2.405 1.00 0.00 N ATOM 1385 CA PRO A 510 -10.234 -7.844 2.254 1.00 0.00 C ATOM 1386 C PRO A 510 -9.311 -6.891 3.006 1.00 0.00 C ATOM 1387 O PRO A 510 -9.534 -6.592 4.180 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.641 -7.813 2.856 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.648 -8.914 3.859 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.662 -9.961 3.387 1.00 0.00 C ATOM 0 HA PRO A 510 -10.194 -7.518 1.215 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.851 -6.851 3.323 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -12.402 -7.969 2.092 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -11.368 -8.539 4.843 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.646 -9.341 3.953 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -10.063 -10.347 4.212 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -11.170 -10.813 2.935 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.274 -6.417 2.324 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.318 -5.497 2.928 1.00 0.00 C ATOM 1400 C VAL A 511 -7.897 -4.090 3.026 1.00 0.00 C ATOM 1401 O VAL A 511 -8.463 -3.573 2.063 1.00 0.00 O ATOM 1402 CB VAL A 511 -6.004 -5.445 2.125 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.142 -6.659 2.433 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -6.295 -5.351 0.634 1.00 0.00 C ATOM 0 H VAL A 511 -8.074 -6.655 1.352 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.108 -5.871 3.930 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.452 -4.553 2.421 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.218 -6.605 1.857 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -4.906 -6.677 3.497 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -5.683 -7.567 2.166 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -5.356 -5.315 0.082 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.868 -6.223 0.319 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.870 -4.447 0.432 1.00 0.00 H new ATOM 1414 N GLN A 512 -7.750 -3.476 4.195 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.259 -2.127 4.419 1.00 0.00 C ATOM 1416 C GLN A 512 -7.467 -1.106 3.609 1.00 0.00 C ATOM 1417 O GLN A 512 -6.324 -0.789 3.939 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.196 -1.776 5.906 1.00 0.00 C ATOM 1419 CG GLN A 512 -9.122 -0.637 6.302 1.00 0.00 C ATOM 1420 CD GLN A 512 -9.185 -0.431 7.803 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -8.189 -0.600 8.506 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -10.359 -0.062 8.301 1.00 0.00 N ATOM 0 H GLN A 512 -7.283 -3.890 5.002 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.298 -2.098 4.090 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -8.450 -2.660 6.491 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -7.172 -1.507 6.164 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -8.783 0.284 5.827 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -10.124 -0.841 5.925 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -11.158 0.067 7.681 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -10.462 0.093 9.304 1.00 0.00 H new ATOM 1431 N ILE A 513 -8.083 -0.594 2.549 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.435 0.393 1.693 1.00 0.00 C ATOM 1433 C ILE A 513 -7.939 1.799 1.997 1.00 0.00 C ATOM 1434 O ILE A 513 -9.087 2.135 1.705 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.672 0.086 0.202 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -7.478 -1.407 -0.071 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.734 0.914 -0.664 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -6.073 -1.895 0.203 1.00 0.00 C ATOM 0 H ILE A 513 -9.029 -0.846 2.262 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.366 0.340 1.902 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.699 0.352 -0.050 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -8.177 -1.974 0.544 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.729 -1.613 -1.112 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -6.913 0.686 -1.715 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -6.915 1.974 -0.486 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.701 0.676 -0.412 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -6.010 -2.962 -0.012 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -5.370 -1.355 -0.431 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.825 -1.721 1.250 1.00 0.00 H new ATOM 1450 N ARG A 514 -7.073 2.618 2.583 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.430 3.990 2.926 1.00 0.00 C ATOM 1452 C ARG A 514 -6.409 4.974 2.362 1.00 0.00 C ATOM 1453 O ARG A 514 -5.381 5.261 2.976 1.00 0.00 O ATOM 1454 CB ARG A 514 -7.523 4.150 4.445 1.00 0.00 C ATOM 1455 CG ARG A 514 -8.639 3.334 5.076 1.00 0.00 C ATOM 1456 CD ARG A 514 -8.464 3.222 6.582 1.00 0.00 C ATOM 1457 NE ARG A 514 -9.043 4.362 7.287 1.00 0.00 N ATOM 1458 CZ ARG A 514 -8.708 4.709 8.525 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -7.801 4.007 9.190 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -9.279 5.760 9.098 1.00 0.00 N ATOM 0 H ARG A 514 -6.119 2.356 2.831 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.402 4.208 2.484 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -6.573 3.857 4.892 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -7.675 5.203 4.682 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -9.600 3.797 4.854 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -8.656 2.337 4.635 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -8.932 2.303 6.934 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -7.403 3.150 6.819 1.00 0.00 H new ATOM 0 HE ARG A 514 -9.743 4.923 6.802 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -7.359 3.199 8.751 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -7.545 4.275 10.140 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -9.976 6.303 8.588 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -9.021 6.025 10.048 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.699 5.505 1.165 1.00 0.00 N ATOM 1475 CA PRO A 515 -5.819 6.465 0.491 1.00 0.00 C ATOM 1476 C PRO A 515 -5.309 7.547 1.438 1.00 0.00 C ATOM 1477 O PRO A 515 -5.892 8.627 1.532 1.00 0.00 O ATOM 1478 CB PRO A 515 -6.720 7.078 -0.584 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.720 6.017 -0.890 1.00 0.00 C ATOM 1480 CD PRO A 515 -7.907 5.209 0.376 1.00 0.00 C ATOM 0 HA PRO A 515 -4.923 5.988 0.094 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -7.204 7.986 -0.224 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -6.148 7.351 -1.471 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.664 6.457 -1.210 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -7.372 5.382 -1.705 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.813 5.502 0.907 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -7.993 4.144 0.161 1.00 0.00 H new ATOM 1488 N TRP A 516 -4.219 7.249 2.135 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.630 8.197 3.074 1.00 0.00 C ATOM 1490 C TRP A 516 -3.298 9.514 2.382 1.00 0.00 C ATOM 1491 O TRP A 516 -2.673 9.529 1.322 1.00 0.00 O ATOM 1492 CB TRP A 516 -2.368 7.606 3.704 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.950 8.304 4.963 1.00 0.00 C ATOM 1494 CD1 TRP A 516 -1.075 9.347 5.069 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -2.387 8.007 6.293 1.00 0.00 C ATOM 1496 NE1 TRP A 516 -0.942 9.717 6.386 1.00 0.00 N ATOM 1497 CE2 TRP A 516 -1.737 8.911 7.157 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -3.266 7.068 6.839 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 -1.939 8.900 8.535 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -3.465 7.058 8.207 1.00 0.00 C ATOM 1501 CH2 TRP A 516 -2.805 7.969 9.042 1.00 0.00 C ATOM 0 H TRP A 516 -3.725 6.359 2.068 1.00 0.00 H new ATOM 0 HA TRP A 516 -4.361 8.394 3.858 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -2.538 6.552 3.921 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.553 7.655 2.982 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -0.563 9.813 4.240 1.00 0.00 H new ATOM 0 HE1 TRP A 516 -0.348 10.470 6.733 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -3.781 6.363 6.204 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 -1.431 9.601 9.180 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -4.141 6.335 8.640 1.00 0.00 H new ATOM 0 HH2 TRP A 516 -2.983 7.936 10.107 1.00 0.00 H new