USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=16 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 8:sc= 1.07 USER MOD Set 1.2: A 505 THR OG1 : rot -154:sc= -0.0411 USER MOD Set 2.1: A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 465 SER OG : rot 180:sc= 0 USER MOD Single : A 426 SER OG : rot 180:sc=0.000764 USER MOD Single : A 428 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 THR OG1 : rot 180:sc= -0.159 USER MOD Single : A 446 SER OG : rot 180:sc= 0 USER MOD Single : A 459 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 460 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.017) USER MOD Single : A 463 SER OG : rot 180:sc=-0.00641 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 USER MOD Single : A 478 GLN : amide:sc= -0.56 X(o=-0.56,f=-0.57) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot -71:sc= -0.21 USER MOD Single : A 484 GLN : amide:sc= -0.173 X(o=-0.17,f=0) USER MOD Single : A 490 CYS SG : rot 58:sc= -1.54 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 TYR OH : rot 180:sc= 0 USER MOD Single : A 500 CYS SG : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 37:sc= 0.219 USER MOD Single : A 507 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 509 LYS NZ :NH3+ 180:sc=-0.00339 (180deg=-0.00339) USER MOD Single : A 512 GLN : amide:sc= -0.572 K(o=-0.57,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 66 N SER A 426 -3.605 12.071 -1.698 1.00 0.00 N ATOM 67 CA SER A 426 -2.233 11.836 -2.132 1.00 0.00 C ATOM 68 C SER A 426 -2.108 10.490 -2.838 1.00 0.00 C ATOM 69 O SER A 426 -3.078 9.737 -2.938 1.00 0.00 O ATOM 70 CB SER A 426 -1.281 11.887 -0.935 1.00 0.00 C ATOM 71 OG SER A 426 0.032 12.232 -1.341 1.00 0.00 O ATOM 0 HA SER A 426 -1.962 12.622 -2.837 1.00 0.00 H new ATOM 0 HB2 SER A 426 -1.643 12.615 -0.209 1.00 0.00 H new ATOM 0 HB3 SER A 426 -1.268 10.918 -0.436 1.00 0.00 H new ATOM 0 HG SER A 426 0.620 12.259 -0.558 1.00 0.00 H new ATOM 77 N ARG A 427 -0.909 10.193 -3.327 1.00 0.00 N ATOM 78 CA ARG A 427 -0.657 8.939 -4.025 1.00 0.00 C ATOM 79 C ARG A 427 -0.465 7.794 -3.034 1.00 0.00 C ATOM 80 O ARG A 427 -0.825 6.650 -3.313 1.00 0.00 O ATOM 81 CB ARG A 427 0.579 9.066 -4.919 1.00 0.00 C ATOM 82 CG ARG A 427 0.403 10.051 -6.063 1.00 0.00 C ATOM 83 CD ARG A 427 1.380 9.770 -7.194 1.00 0.00 C ATOM 84 NE ARG A 427 1.725 10.982 -7.933 1.00 0.00 N ATOM 85 CZ ARG A 427 2.368 12.013 -7.396 1.00 0.00 C ATOM 86 NH1 ARG A 427 2.734 11.979 -6.122 1.00 0.00 N ATOM 87 NH2 ARG A 427 2.645 13.080 -8.134 1.00 0.00 N ATOM 0 H ARG A 427 -0.096 10.805 -3.252 1.00 0.00 H new ATOM 0 HA ARG A 427 -1.525 8.718 -4.646 1.00 0.00 H new ATOM 0 HB2 ARG A 427 1.428 9.377 -4.310 1.00 0.00 H new ATOM 0 HB3 ARG A 427 0.823 8.086 -5.329 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -0.618 9.994 -6.440 1.00 0.00 H new ATOM 0 HG3 ARG A 427 0.551 11.067 -5.696 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.287 9.323 -6.787 1.00 0.00 H new ATOM 0 HD3 ARG A 427 0.944 9.041 -7.877 1.00 0.00 H new ATOM 0 HE ARG A 427 1.457 11.040 -8.916 1.00 0.00 H new ATOM 0 HH11 ARG A 427 2.522 11.160 -5.552 1.00 0.00 H new ATOM 0 HH12 ARG A 427 3.228 12.772 -5.712 1.00 0.00 H new ATOM 0 HH21 ARG A 427 2.364 13.109 -9.114 1.00 0.00 H new ATOM 0 HH22 ARG A 427 3.139 13.871 -7.721 1.00 0.00 H new ATOM 101 N LYS A 428 0.105 8.110 -1.876 1.00 0.00 N ATOM 102 CA LYS A 428 0.344 7.110 -0.843 1.00 0.00 C ATOM 103 C LYS A 428 -0.962 6.458 -0.404 1.00 0.00 C ATOM 104 O LYS A 428 -1.977 7.133 -0.229 1.00 0.00 O ATOM 105 CB LYS A 428 1.039 7.749 0.362 1.00 0.00 C ATOM 106 CG LYS A 428 1.638 6.738 1.324 1.00 0.00 C ATOM 107 CD LYS A 428 2.806 7.329 2.097 1.00 0.00 C ATOM 108 CE LYS A 428 2.330 8.130 3.299 1.00 0.00 C ATOM 109 NZ LYS A 428 3.446 8.873 3.947 1.00 0.00 N ATOM 0 H LYS A 428 0.410 9.052 -1.630 1.00 0.00 H new ATOM 0 HA LYS A 428 0.991 6.339 -1.261 1.00 0.00 H new ATOM 0 HB2 LYS A 428 1.828 8.412 0.007 1.00 0.00 H new ATOM 0 HB3 LYS A 428 0.321 8.368 0.899 1.00 0.00 H new ATOM 0 HG2 LYS A 428 0.872 6.400 2.022 1.00 0.00 H new ATOM 0 HG3 LYS A 428 1.973 5.861 0.770 1.00 0.00 H new ATOM 0 HD2 LYS A 428 3.466 6.528 2.430 1.00 0.00 H new ATOM 0 HD3 LYS A 428 3.392 7.971 1.439 1.00 0.00 H new ATOM 0 HE2 LYS A 428 1.559 8.834 2.984 1.00 0.00 H new ATOM 0 HE3 LYS A 428 1.871 7.458 4.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 3.081 9.406 4.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 4.170 8.200 4.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 3.868 9.533 3.262 1.00 0.00 H new ATOM 123 N VAL A 429 -0.931 5.141 -0.225 1.00 0.00 N ATOM 124 CA VAL A 429 -2.112 4.398 0.196 1.00 0.00 C ATOM 125 C VAL A 429 -1.821 3.561 1.437 1.00 0.00 C ATOM 126 O VAL A 429 -0.765 2.937 1.544 1.00 0.00 O ATOM 127 CB VAL A 429 -2.623 3.473 -0.925 1.00 0.00 C ATOM 128 CG1 VAL A 429 -3.698 2.536 -0.395 1.00 0.00 C ATOM 129 CG2 VAL A 429 -3.148 4.294 -2.093 1.00 0.00 C ATOM 0 H VAL A 429 -0.100 4.567 -0.365 1.00 0.00 H new ATOM 0 HA VAL A 429 -2.882 5.133 0.429 1.00 0.00 H new ATOM 0 HB VAL A 429 -1.790 2.867 -1.281 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.047 1.890 -1.201 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.285 1.924 0.407 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.534 3.121 -0.011 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.505 3.625 -2.876 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.968 4.926 -1.754 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -2.347 4.919 -2.487 1.00 0.00 H new ATOM 139 N PHE A 430 -2.765 3.551 2.372 1.00 0.00 N ATOM 140 CA PHE A 430 -2.610 2.791 3.607 1.00 0.00 C ATOM 141 C PHE A 430 -3.335 1.452 3.516 1.00 0.00 C ATOM 142 O PHE A 430 -4.564 1.400 3.479 1.00 0.00 O ATOM 143 CB PHE A 430 -3.145 3.593 4.795 1.00 0.00 C ATOM 144 CG PHE A 430 -3.152 2.822 6.084 1.00 0.00 C ATOM 145 CD1 PHE A 430 -2.007 2.181 6.530 1.00 0.00 C ATOM 146 CD2 PHE A 430 -4.303 2.740 6.851 1.00 0.00 C ATOM 147 CE1 PHE A 430 -2.011 1.470 7.715 1.00 0.00 C ATOM 148 CE2 PHE A 430 -4.313 2.031 8.038 1.00 0.00 C ATOM 149 CZ PHE A 430 -3.165 1.396 8.471 1.00 0.00 C ATOM 0 H PHE A 430 -3.646 4.061 2.298 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.547 2.600 3.755 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.538 4.490 4.921 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -4.160 3.923 4.573 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.101 2.238 5.945 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -5.203 3.236 6.518 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -1.113 0.973 8.050 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -5.217 1.974 8.626 1.00 0.00 H new ATOM 0 HZ PHE A 430 -3.170 0.843 9.399 1.00 0.00 H new ATOM 159 N VAL A 431 -2.564 0.370 3.478 1.00 0.00 N ATOM 160 CA VAL A 431 -3.131 -0.971 3.392 1.00 0.00 C ATOM 161 C VAL A 431 -2.961 -1.726 4.705 1.00 0.00 C ATOM 162 O VAL A 431 -1.841 -1.953 5.161 1.00 0.00 O ATOM 163 CB VAL A 431 -2.481 -1.783 2.256 1.00 0.00 C ATOM 164 CG1 VAL A 431 -3.128 -3.155 2.143 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.576 -1.029 0.939 1.00 0.00 C ATOM 0 H VAL A 431 -1.545 0.396 3.505 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.194 -0.852 3.181 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.426 -1.923 2.491 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.656 -3.714 1.335 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -3.001 -3.695 3.081 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.191 -3.040 1.932 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -2.112 -1.618 0.148 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -3.624 -0.855 0.694 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -2.061 -0.073 1.029 1.00 0.00 H new ATOM 175 N GLY A 432 -4.080 -2.113 5.309 1.00 0.00 N ATOM 176 CA GLY A 432 -4.033 -2.839 6.564 1.00 0.00 C ATOM 177 C GLY A 432 -4.594 -4.243 6.444 1.00 0.00 C ATOM 178 O GLY A 432 -5.416 -4.517 5.571 1.00 0.00 O ATOM 0 H GLY A 432 -5.019 -1.936 4.951 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -3.001 -2.892 6.911 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.595 -2.290 7.319 1.00 0.00 H new ATOM 182 N GLY A 433 -4.147 -5.134 7.323 1.00 0.00 N ATOM 183 CA GLY A 433 -4.619 -6.506 7.293 1.00 0.00 C ATOM 184 C GLY A 433 -3.928 -7.334 6.227 1.00 0.00 C ATOM 185 O GLY A 433 -4.572 -8.106 5.515 1.00 0.00 O ATOM 0 H GLY A 433 -3.467 -4.931 8.055 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.455 -6.965 8.268 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.694 -6.513 7.114 1.00 0.00 H new ATOM 189 N LEU A 434 -2.614 -7.174 6.115 1.00 0.00 N ATOM 190 CA LEU A 434 -1.835 -7.911 5.127 1.00 0.00 C ATOM 191 C LEU A 434 -1.462 -9.294 5.650 1.00 0.00 C ATOM 192 O LEU A 434 -1.164 -9.479 6.830 1.00 0.00 O ATOM 193 CB LEU A 434 -0.570 -7.133 4.762 1.00 0.00 C ATOM 194 CG LEU A 434 -0.773 -5.888 3.898 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.480 -5.027 3.899 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.151 -6.281 2.477 1.00 0.00 C ATOM 0 H LEU A 434 -2.066 -6.540 6.697 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.449 -8.033 4.234 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.073 -6.833 5.685 1.00 0.00 H new ATOM 0 HB3 LEU A 434 0.109 -7.807 4.239 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.590 -5.304 4.322 1.00 0.00 H new ATOM 0 HD11 LEU A 434 0.316 -4.146 3.279 1.00 0.00 H new ATOM 0 HD12 LEU A 434 0.707 -4.716 4.919 1.00 0.00 H new ATOM 0 HD13 LEU A 434 1.316 -5.601 3.500 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.292 -5.382 1.876 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.355 -6.887 2.043 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -2.077 -6.856 2.493 1.00 0.00 H new ATOM 208 N PRO A 435 -1.476 -10.291 4.752 1.00 0.00 N ATOM 209 CA PRO A 435 -1.138 -11.674 5.099 1.00 0.00 C ATOM 210 C PRO A 435 0.152 -11.772 5.906 1.00 0.00 C ATOM 211 O PRO A 435 1.097 -11.009 5.705 1.00 0.00 O ATOM 212 CB PRO A 435 -0.969 -12.351 3.736 1.00 0.00 C ATOM 213 CG PRO A 435 -1.829 -11.561 2.811 1.00 0.00 C ATOM 214 CD PRO A 435 -1.821 -10.143 3.328 1.00 0.00 C ATOM 0 HA PRO A 435 -1.901 -12.134 5.727 1.00 0.00 H new ATOM 0 HB2 PRO A 435 0.073 -12.340 3.415 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -1.280 -13.395 3.771 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.446 -11.605 1.792 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -2.843 -11.960 2.788 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -1.091 -9.529 2.801 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -2.792 -9.665 3.199 1.00 0.00 H new ATOM 222 N PRO A 436 0.194 -12.731 6.842 1.00 0.00 N ATOM 223 CA PRO A 436 1.364 -12.952 7.698 1.00 0.00 C ATOM 224 C PRO A 436 2.458 -13.743 6.991 1.00 0.00 C ATOM 225 O PRO A 436 3.506 -14.028 7.572 1.00 0.00 O ATOM 226 CB PRO A 436 0.798 -13.753 8.873 1.00 0.00 C ATOM 227 CG PRO A 436 -0.371 -14.482 8.306 1.00 0.00 C ATOM 228 CD PRO A 436 -0.896 -13.676 7.136 1.00 0.00 C ATOM 0 HA PRO A 436 1.837 -12.015 7.992 1.00 0.00 H new ATOM 0 HB2 PRO A 436 1.539 -14.444 9.274 1.00 0.00 H new ATOM 0 HB3 PRO A 436 0.497 -13.098 9.691 1.00 0.00 H new ATOM 0 HG2 PRO A 436 -0.078 -15.480 7.981 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -1.146 -14.608 9.062 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -1.116 -14.312 6.279 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -1.819 -13.155 7.391 1.00 0.00 H new ATOM 236 N ASP A 437 2.210 -14.096 5.735 1.00 0.00 N ATOM 237 CA ASP A 437 3.175 -14.854 4.948 1.00 0.00 C ATOM 238 C ASP A 437 3.333 -14.253 3.554 1.00 0.00 C ATOM 239 O ASP A 437 3.500 -14.975 2.571 1.00 0.00 O ATOM 240 CB ASP A 437 2.742 -16.316 4.840 1.00 0.00 C ATOM 241 CG ASP A 437 2.495 -16.949 6.195 1.00 0.00 C ATOM 242 OD1 ASP A 437 3.436 -16.977 7.016 1.00 0.00 O ATOM 243 OD2 ASP A 437 1.362 -17.417 6.435 1.00 0.00 O ATOM 0 H ASP A 437 1.348 -13.869 5.239 1.00 0.00 H new ATOM 0 HA ASP A 437 4.138 -14.805 5.456 1.00 0.00 H new ATOM 0 HB2 ASP A 437 1.833 -16.379 4.242 1.00 0.00 H new ATOM 0 HB3 ASP A 437 3.511 -16.881 4.313 1.00 0.00 H new ATOM 248 N ILE A 438 3.277 -12.927 3.478 1.00 0.00 N ATOM 249 CA ILE A 438 3.413 -12.230 2.205 1.00 0.00 C ATOM 250 C ILE A 438 4.668 -11.364 2.184 1.00 0.00 C ATOM 251 O ILE A 438 4.962 -10.655 3.148 1.00 0.00 O ATOM 252 CB ILE A 438 2.187 -11.345 1.914 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.326 -10.678 0.544 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.019 -10.297 3.005 1.00 0.00 C ATOM 255 CD1 ILE A 438 1.029 -10.104 0.017 1.00 0.00 C ATOM 0 H ILE A 438 3.139 -12.315 4.282 1.00 0.00 H new ATOM 0 HA ILE A 438 3.490 -12.995 1.433 1.00 0.00 H new ATOM 0 HB ILE A 438 1.297 -11.975 1.902 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.066 -9.881 0.610 1.00 0.00 H new ATOM 0 HG13 ILE A 438 2.707 -11.408 -0.170 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.148 -9.679 2.785 1.00 0.00 H new ATOM 0 HG22 ILE A 438 1.880 -10.792 3.966 1.00 0.00 H new ATOM 0 HG23 ILE A 438 2.909 -9.669 3.046 1.00 0.00 H new ATOM 0 HD11 ILE A 438 1.203 -9.647 -0.957 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.292 -10.901 -0.082 1.00 0.00 H new ATOM 0 HD13 ILE A 438 0.657 -9.350 0.710 1.00 0.00 H new ATOM 267 N ASP A 439 5.404 -11.424 1.080 1.00 0.00 N ATOM 268 CA ASP A 439 6.626 -10.643 0.932 1.00 0.00 C ATOM 269 C ASP A 439 6.357 -9.353 0.162 1.00 0.00 C ATOM 270 O ASP A 439 5.260 -9.146 -0.355 1.00 0.00 O ATOM 271 CB ASP A 439 7.699 -11.465 0.215 1.00 0.00 C ATOM 272 CG ASP A 439 7.650 -12.933 0.591 1.00 0.00 C ATOM 273 OD1 ASP A 439 6.743 -13.640 0.104 1.00 0.00 O ATOM 274 OD2 ASP A 439 8.520 -13.374 1.371 1.00 0.00 O ATOM 0 H ASP A 439 5.175 -12.006 0.274 1.00 0.00 H new ATOM 0 HA ASP A 439 6.984 -10.383 1.928 1.00 0.00 H new ATOM 0 HB2 ASP A 439 7.570 -11.364 -0.863 1.00 0.00 H new ATOM 0 HB3 ASP A 439 8.683 -11.063 0.457 1.00 0.00 H new ATOM 279 N GLU A 440 7.366 -8.490 0.092 1.00 0.00 N ATOM 280 CA GLU A 440 7.236 -7.221 -0.613 1.00 0.00 C ATOM 281 C GLU A 440 6.733 -7.438 -2.037 1.00 0.00 C ATOM 282 O GLU A 440 5.598 -7.091 -2.365 1.00 0.00 O ATOM 283 CB GLU A 440 8.580 -6.488 -0.641 1.00 0.00 C ATOM 284 CG GLU A 440 8.565 -5.223 -1.482 1.00 0.00 C ATOM 285 CD GLU A 440 9.959 -4.745 -1.840 1.00 0.00 C ATOM 286 OE1 GLU A 440 10.649 -4.206 -0.949 1.00 0.00 O ATOM 287 OE2 GLU A 440 10.360 -4.909 -3.011 1.00 0.00 O ATOM 0 H GLU A 440 8.281 -8.647 0.514 1.00 0.00 H new ATOM 0 HA GLU A 440 6.508 -6.611 -0.078 1.00 0.00 H new ATOM 0 HB2 GLU A 440 8.867 -6.233 0.379 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.344 -7.162 -1.027 1.00 0.00 H new ATOM 0 HG2 GLU A 440 8.001 -5.406 -2.397 1.00 0.00 H new ATOM 0 HG3 GLU A 440 8.043 -4.436 -0.938 1.00 0.00 H new ATOM 294 N ASP A 441 7.585 -8.013 -2.878 1.00 0.00 N ATOM 295 CA ASP A 441 7.227 -8.277 -4.267 1.00 0.00 C ATOM 296 C ASP A 441 5.757 -8.667 -4.385 1.00 0.00 C ATOM 297 O ASP A 441 5.003 -8.056 -5.140 1.00 0.00 O ATOM 298 CB ASP A 441 8.110 -9.387 -4.840 1.00 0.00 C ATOM 299 CG ASP A 441 9.547 -8.943 -5.032 1.00 0.00 C ATOM 300 OD1 ASP A 441 9.985 -8.025 -4.308 1.00 0.00 O ATOM 301 OD2 ASP A 441 10.233 -9.514 -5.905 1.00 0.00 O ATOM 0 H ASP A 441 8.528 -8.305 -2.623 1.00 0.00 H new ATOM 0 HA ASP A 441 7.388 -7.363 -4.839 1.00 0.00 H new ATOM 0 HB2 ASP A 441 8.085 -10.248 -4.172 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.703 -9.714 -5.797 1.00 0.00 H new ATOM 306 N GLU A 442 5.359 -9.689 -3.633 1.00 0.00 N ATOM 307 CA GLU A 442 3.979 -10.161 -3.656 1.00 0.00 C ATOM 308 C GLU A 442 3.003 -8.990 -3.598 1.00 0.00 C ATOM 309 O GLU A 442 2.161 -8.826 -4.481 1.00 0.00 O ATOM 310 CB GLU A 442 3.723 -11.112 -2.485 1.00 0.00 C ATOM 311 CG GLU A 442 4.659 -12.308 -2.456 1.00 0.00 C ATOM 312 CD GLU A 442 4.323 -13.338 -3.517 1.00 0.00 C ATOM 313 OE1 GLU A 442 4.301 -12.972 -4.711 1.00 0.00 O ATOM 314 OE2 GLU A 442 4.083 -14.508 -3.154 1.00 0.00 O ATOM 0 H GLU A 442 5.971 -10.205 -3.001 1.00 0.00 H new ATOM 0 HA GLU A 442 3.820 -10.697 -4.592 1.00 0.00 H new ATOM 0 HB2 GLU A 442 3.824 -10.560 -1.551 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.694 -11.468 -2.535 1.00 0.00 H new ATOM 0 HG2 GLU A 442 5.684 -11.966 -2.599 1.00 0.00 H new ATOM 0 HG3 GLU A 442 4.613 -12.776 -1.473 1.00 0.00 H new ATOM 321 N ILE A 443 3.122 -8.179 -2.552 1.00 0.00 N ATOM 322 CA ILE A 443 2.250 -7.024 -2.378 1.00 0.00 C ATOM 323 C ILE A 443 2.180 -6.192 -3.654 1.00 0.00 C ATOM 324 O ILE A 443 1.103 -5.762 -4.070 1.00 0.00 O ATOM 325 CB ILE A 443 2.728 -6.127 -1.220 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.792 -6.929 0.081 1.00 0.00 C ATOM 327 CG2 ILE A 443 1.806 -4.927 -1.065 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.582 -6.244 1.174 1.00 0.00 C ATOM 0 H ILE A 443 3.814 -8.301 -1.812 1.00 0.00 H new ATOM 0 HA ILE A 443 1.258 -7.410 -2.143 1.00 0.00 H new ATOM 0 HB ILE A 443 3.729 -5.763 -1.450 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.778 -7.111 0.436 1.00 0.00 H new ATOM 0 HG13 ILE A 443 3.238 -7.902 -0.123 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.156 -4.303 -0.243 1.00 0.00 H new ATOM 0 HG22 ILE A 443 1.806 -4.346 -1.987 1.00 0.00 H new ATOM 0 HG23 ILE A 443 0.794 -5.271 -0.853 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.585 -6.869 2.067 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.607 -6.086 0.838 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.124 -5.283 1.406 1.00 0.00 H new ATOM 340 N THR A 444 3.335 -5.970 -4.274 1.00 0.00 N ATOM 341 CA THR A 444 3.405 -5.191 -5.504 1.00 0.00 C ATOM 342 C THR A 444 2.492 -5.773 -6.577 1.00 0.00 C ATOM 343 O THR A 444 1.635 -5.077 -7.121 1.00 0.00 O ATOM 344 CB THR A 444 4.844 -5.129 -6.049 1.00 0.00 C ATOM 345 OG1 THR A 444 5.740 -4.699 -5.018 1.00 0.00 O ATOM 346 CG2 THR A 444 4.934 -4.180 -7.234 1.00 0.00 C ATOM 0 H THR A 444 4.235 -6.319 -3.944 1.00 0.00 H new ATOM 0 HA THR A 444 3.074 -4.182 -5.258 1.00 0.00 H new ATOM 0 HB THR A 444 5.126 -6.128 -6.382 1.00 0.00 H new ATOM 0 HG1 THR A 444 6.653 -4.664 -5.372 1.00 0.00 H new ATOM 0 HG21 THR A 444 5.960 -4.153 -7.601 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.273 -4.526 -8.028 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.634 -3.180 -6.923 1.00 0.00 H new ATOM 354 N ALA A 445 2.680 -7.055 -6.876 1.00 0.00 N ATOM 355 CA ALA A 445 1.871 -7.731 -7.882 1.00 0.00 C ATOM 356 C ALA A 445 0.383 -7.529 -7.617 1.00 0.00 C ATOM 357 O ALA A 445 -0.390 -7.264 -8.537 1.00 0.00 O ATOM 358 CB ALA A 445 2.206 -9.215 -7.918 1.00 0.00 C ATOM 0 H ALA A 445 3.386 -7.645 -6.436 1.00 0.00 H new ATOM 0 HA ALA A 445 2.103 -7.293 -8.853 1.00 0.00 H new ATOM 0 HB1 ALA A 445 1.594 -9.708 -8.674 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.260 -9.344 -8.163 1.00 0.00 H new ATOM 0 HB3 ALA A 445 2.004 -9.657 -6.943 1.00 0.00 H new ATOM 364 N SER A 446 -0.011 -7.657 -6.354 1.00 0.00 N ATOM 365 CA SER A 446 -1.408 -7.492 -5.969 1.00 0.00 C ATOM 366 C SER A 446 -1.924 -6.114 -6.371 1.00 0.00 C ATOM 367 O SER A 446 -3.100 -5.949 -6.693 1.00 0.00 O ATOM 368 CB SER A 446 -1.569 -7.689 -4.460 1.00 0.00 C ATOM 369 OG SER A 446 -1.345 -9.040 -4.096 1.00 0.00 O ATOM 0 H SER A 446 0.617 -7.874 -5.580 1.00 0.00 H new ATOM 0 HA SER A 446 -1.995 -8.247 -6.492 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.868 -7.045 -3.929 1.00 0.00 H new ATOM 0 HB3 SER A 446 -2.572 -7.388 -4.156 1.00 0.00 H new ATOM 0 HG SER A 446 -1.452 -9.140 -3.127 1.00 0.00 H new ATOM 375 N PHE A 447 -1.034 -5.127 -6.350 1.00 0.00 N ATOM 376 CA PHE A 447 -1.398 -3.762 -6.712 1.00 0.00 C ATOM 377 C PHE A 447 -0.543 -3.260 -7.872 1.00 0.00 C ATOM 378 O PHE A 447 -0.193 -2.081 -7.934 1.00 0.00 O ATOM 379 CB PHE A 447 -1.239 -2.833 -5.507 1.00 0.00 C ATOM 380 CG PHE A 447 -2.190 -3.138 -4.385 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.906 -4.141 -3.472 1.00 0.00 C ATOM 382 CD2 PHE A 447 -3.367 -2.421 -4.242 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.780 -4.424 -2.440 1.00 0.00 C ATOM 384 CE2 PHE A 447 -4.244 -2.699 -3.211 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.950 -3.701 -2.308 1.00 0.00 C ATOM 0 H PHE A 447 -0.056 -5.247 -6.086 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.442 -3.762 -7.027 1.00 0.00 H new ATOM 0 HB2 PHE A 447 -0.217 -2.905 -5.136 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.389 -1.803 -5.830 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.992 -4.708 -3.568 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.602 -1.635 -4.945 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -2.549 -5.210 -1.737 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -5.158 -2.133 -3.112 1.00 0.00 H new ATOM 0 HZ PHE A 447 -4.633 -3.919 -1.500 1.00 0.00 H new ATOM 395 N ARG A 448 -0.210 -4.164 -8.788 1.00 0.00 N ATOM 396 CA ARG A 448 0.605 -3.814 -9.945 1.00 0.00 C ATOM 397 C ARG A 448 -0.267 -3.583 -11.175 1.00 0.00 C ATOM 398 O ARG A 448 -0.060 -2.628 -11.924 1.00 0.00 O ATOM 399 CB ARG A 448 1.625 -4.918 -10.229 1.00 0.00 C ATOM 400 CG ARG A 448 2.401 -4.713 -11.520 1.00 0.00 C ATOM 401 CD ARG A 448 3.527 -3.707 -11.338 1.00 0.00 C ATOM 402 NE ARG A 448 4.213 -3.420 -12.595 1.00 0.00 N ATOM 403 CZ ARG A 448 5.427 -2.887 -12.665 1.00 0.00 C ATOM 404 NH1 ARG A 448 6.087 -2.585 -11.555 1.00 0.00 N ATOM 405 NH2 ARG A 448 5.985 -2.655 -13.847 1.00 0.00 N ATOM 0 H ARG A 448 -0.492 -5.144 -8.751 1.00 0.00 H new ATOM 0 HA ARG A 448 1.135 -2.889 -9.718 1.00 0.00 H new ATOM 0 HB2 ARG A 448 2.328 -4.974 -9.398 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.107 -5.876 -10.274 1.00 0.00 H new ATOM 0 HG2 ARG A 448 2.813 -5.665 -11.854 1.00 0.00 H new ATOM 0 HG3 ARG A 448 1.725 -4.367 -12.302 1.00 0.00 H new ATOM 0 HD2 ARG A 448 3.124 -2.782 -10.926 1.00 0.00 H new ATOM 0 HD3 ARG A 448 4.244 -4.093 -10.613 1.00 0.00 H new ATOM 0 HE ARG A 448 3.733 -3.641 -13.467 1.00 0.00 H new ATOM 0 HH11 ARG A 448 5.662 -2.762 -10.645 1.00 0.00 H new ATOM 0 HH12 ARG A 448 7.020 -2.176 -11.612 1.00 0.00 H new ATOM 0 HH21 ARG A 448 5.481 -2.886 -14.703 1.00 0.00 H new ATOM 0 HH22 ARG A 448 6.918 -2.245 -13.899 1.00 0.00 H new ATOM 419 N ARG A 449 -1.243 -4.462 -11.376 1.00 0.00 N ATOM 420 CA ARG A 449 -2.146 -4.355 -12.516 1.00 0.00 C ATOM 421 C ARG A 449 -2.506 -2.898 -12.789 1.00 0.00 C ATOM 422 O ARG A 449 -2.512 -2.454 -13.937 1.00 0.00 O ATOM 423 CB ARG A 449 -3.417 -5.167 -12.264 1.00 0.00 C ATOM 424 CG ARG A 449 -4.189 -4.724 -11.032 1.00 0.00 C ATOM 425 CD ARG A 449 -5.490 -5.498 -10.882 1.00 0.00 C ATOM 426 NE ARG A 449 -5.268 -6.848 -10.370 1.00 0.00 N ATOM 427 CZ ARG A 449 -4.962 -7.885 -11.141 1.00 0.00 C ATOM 428 NH1 ARG A 449 -4.842 -7.728 -12.452 1.00 0.00 N ATOM 429 NH2 ARG A 449 -4.775 -9.082 -10.601 1.00 0.00 N ATOM 0 H ARG A 449 -1.429 -5.257 -10.764 1.00 0.00 H new ATOM 0 HA ARG A 449 -1.635 -4.755 -13.392 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -4.066 -5.090 -13.136 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -3.151 -6.219 -12.157 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -3.574 -4.869 -10.144 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -4.404 -3.658 -11.100 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -6.156 -4.960 -10.208 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -5.992 -5.555 -11.848 1.00 0.00 H new ATOM 0 HE ARG A 449 -5.353 -7.003 -9.365 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -4.985 -6.809 -12.871 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -4.607 -8.526 -13.042 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -4.866 -9.207 -9.593 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -4.540 -9.878 -11.194 1.00 0.00 H new ATOM 443 N PHE A 450 -2.805 -2.158 -11.726 1.00 0.00 N ATOM 444 CA PHE A 450 -3.168 -0.752 -11.851 1.00 0.00 C ATOM 445 C PHE A 450 -2.029 0.050 -12.475 1.00 0.00 C ATOM 446 O PHE A 450 -2.256 0.918 -13.317 1.00 0.00 O ATOM 447 CB PHE A 450 -3.523 -0.171 -10.480 1.00 0.00 C ATOM 448 CG PHE A 450 -4.671 -0.872 -9.812 1.00 0.00 C ATOM 449 CD1 PHE A 450 -5.979 -0.519 -10.102 1.00 0.00 C ATOM 450 CD2 PHE A 450 -4.442 -1.884 -8.894 1.00 0.00 C ATOM 451 CE1 PHE A 450 -7.037 -1.162 -9.487 1.00 0.00 C ATOM 452 CE2 PHE A 450 -5.496 -2.531 -8.277 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.795 -2.170 -8.575 1.00 0.00 C ATOM 0 H PHE A 450 -2.803 -2.509 -10.768 1.00 0.00 H new ATOM 0 HA PHE A 450 -4.038 -0.684 -12.504 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.648 -0.226 -9.833 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -3.769 0.885 -10.594 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.174 0.267 -10.816 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -3.428 -2.171 -8.658 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -8.052 -0.876 -9.720 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -5.304 -3.318 -7.563 1.00 0.00 H new ATOM 0 HZ PHE A 450 -7.620 -2.675 -8.096 1.00 0.00 H new ATOM 463 N GLY A 451 -0.804 -0.247 -12.055 1.00 0.00 N ATOM 464 CA GLY A 451 0.352 0.454 -12.582 1.00 0.00 C ATOM 465 C GLY A 451 1.594 0.242 -11.739 1.00 0.00 C ATOM 466 O GLY A 451 1.619 -0.588 -10.830 1.00 0.00 O ATOM 0 H GLY A 451 -0.591 -0.961 -11.359 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.545 0.115 -13.600 1.00 0.00 H new ATOM 0 HA3 GLY A 451 0.132 1.520 -12.637 1.00 0.00 H new ATOM 470 N PRO A 452 2.655 1.005 -12.040 1.00 0.00 N ATOM 471 CA PRO A 452 3.926 0.914 -11.315 1.00 0.00 C ATOM 472 C PRO A 452 3.864 1.589 -9.949 1.00 0.00 C ATOM 473 O PRO A 452 3.590 2.786 -9.849 1.00 0.00 O ATOM 474 CB PRO A 452 4.910 1.647 -12.230 1.00 0.00 C ATOM 475 CG PRO A 452 4.073 2.627 -12.978 1.00 0.00 C ATOM 476 CD PRO A 452 2.697 2.015 -13.110 1.00 0.00 C ATOM 0 HA PRO A 452 4.204 -0.119 -11.108 1.00 0.00 H new ATOM 0 HB2 PRO A 452 5.688 2.149 -11.654 1.00 0.00 H new ATOM 0 HB3 PRO A 452 5.411 0.956 -12.908 1.00 0.00 H new ATOM 0 HG2 PRO A 452 4.024 3.578 -12.447 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.501 2.831 -13.959 1.00 0.00 H new ATOM 0 HD2 PRO A 452 1.914 2.762 -12.985 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.553 1.563 -14.092 1.00 0.00 H new ATOM 484 N LEU A 453 4.121 0.816 -8.900 1.00 0.00 N ATOM 485 CA LEU A 453 4.094 1.341 -7.539 1.00 0.00 C ATOM 486 C LEU A 453 5.241 0.768 -6.712 1.00 0.00 C ATOM 487 O LEU A 453 6.063 0.003 -7.218 1.00 0.00 O ATOM 488 CB LEU A 453 2.757 1.015 -6.871 1.00 0.00 C ATOM 489 CG LEU A 453 2.571 -0.431 -6.411 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.387 -0.542 -5.464 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.387 -1.352 -7.608 1.00 0.00 C ATOM 0 H LEU A 453 4.350 -0.176 -8.965 1.00 0.00 H new ATOM 0 HA LEU A 453 4.212 2.423 -7.591 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.637 1.668 -6.007 1.00 0.00 H new ATOM 0 HB3 LEU A 453 1.956 1.259 -7.569 1.00 0.00 H new ATOM 0 HG LEU A 453 3.469 -0.740 -5.875 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.270 -1.578 -5.147 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.559 0.087 -4.591 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.481 -0.214 -5.974 1.00 0.00 H new ATOM 0 HD21 LEU A 453 2.256 -2.377 -7.262 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.506 -1.044 -8.172 1.00 0.00 H new ATOM 0 HD23 LEU A 453 3.267 -1.295 -8.249 1.00 0.00 H new ATOM 503 N VAL A 454 5.289 1.141 -5.437 1.00 0.00 N ATOM 504 CA VAL A 454 6.333 0.661 -4.539 1.00 0.00 C ATOM 505 C VAL A 454 5.771 0.364 -3.153 1.00 0.00 C ATOM 506 O VAL A 454 5.013 1.157 -2.595 1.00 0.00 O ATOM 507 CB VAL A 454 7.476 1.685 -4.409 1.00 0.00 C ATOM 508 CG1 VAL A 454 6.947 3.011 -3.882 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.576 1.144 -3.509 1.00 0.00 C ATOM 0 H VAL A 454 4.617 1.774 -5.003 1.00 0.00 H new ATOM 0 HA VAL A 454 6.727 -0.258 -4.973 1.00 0.00 H new ATOM 0 HB VAL A 454 7.900 1.858 -5.398 1.00 0.00 H new ATOM 0 HG11 VAL A 454 7.768 3.722 -3.797 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.198 3.403 -4.570 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.495 2.859 -2.902 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.375 1.881 -3.428 1.00 0.00 H new ATOM 0 HG22 VAL A 454 8.169 0.941 -2.519 1.00 0.00 H new ATOM 0 HG23 VAL A 454 8.973 0.222 -3.934 1.00 0.00 H new ATOM 519 N VAL A 455 6.149 -0.785 -2.602 1.00 0.00 N ATOM 520 CA VAL A 455 5.685 -1.188 -1.279 1.00 0.00 C ATOM 521 C VAL A 455 6.622 -0.679 -0.190 1.00 0.00 C ATOM 522 O VAL A 455 7.771 -1.110 -0.094 1.00 0.00 O ATOM 523 CB VAL A 455 5.569 -2.719 -1.167 1.00 0.00 C ATOM 524 CG1 VAL A 455 4.878 -3.109 0.130 1.00 0.00 C ATOM 525 CG2 VAL A 455 4.827 -3.286 -2.368 1.00 0.00 C ATOM 0 H VAL A 455 6.775 -1.453 -3.051 1.00 0.00 H new ATOM 0 HA VAL A 455 4.698 -0.746 -1.141 1.00 0.00 H new ATOM 0 HB VAL A 455 6.573 -3.142 -1.156 1.00 0.00 H new ATOM 0 HG11 VAL A 455 4.805 -4.195 0.191 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.455 -2.736 0.976 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.878 -2.676 0.154 1.00 0.00 H new ATOM 0 HG21 VAL A 455 4.754 -4.369 -2.272 1.00 0.00 H new ATOM 0 HG22 VAL A 455 3.826 -2.857 -2.413 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.369 -3.038 -3.281 1.00 0.00 H new ATOM 535 N ASP A 456 6.123 0.240 0.630 1.00 0.00 N ATOM 536 CA ASP A 456 6.915 0.808 1.715 1.00 0.00 C ATOM 537 C ASP A 456 6.163 0.721 3.039 1.00 0.00 C ATOM 538 O ASP A 456 5.240 1.496 3.292 1.00 0.00 O ATOM 539 CB ASP A 456 7.269 2.264 1.409 1.00 0.00 C ATOM 540 CG ASP A 456 6.044 3.106 1.108 1.00 0.00 C ATOM 541 OD1 ASP A 456 5.465 2.940 0.014 1.00 0.00 O ATOM 542 OD2 ASP A 456 5.666 3.932 1.965 1.00 0.00 O ATOM 0 H ASP A 456 5.174 0.607 0.564 1.00 0.00 H new ATOM 0 HA ASP A 456 7.835 0.230 1.802 1.00 0.00 H new ATOM 0 HB2 ASP A 456 7.801 2.692 2.259 1.00 0.00 H new ATOM 0 HB3 ASP A 456 7.948 2.299 0.557 1.00 0.00 H new ATOM 547 N TRP A 457 6.562 -0.227 3.879 1.00 0.00 N ATOM 548 CA TRP A 457 5.924 -0.415 5.178 1.00 0.00 C ATOM 549 C TRP A 457 6.745 0.235 6.286 1.00 0.00 C ATOM 550 O TRP A 457 7.954 0.430 6.163 1.00 0.00 O ATOM 551 CB TRP A 457 5.742 -1.906 5.468 1.00 0.00 C ATOM 552 CG TRP A 457 6.980 -2.714 5.222 1.00 0.00 C ATOM 553 CD1 TRP A 457 7.814 -3.244 6.165 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.524 -3.083 3.950 1.00 0.00 C ATOM 555 NE1 TRP A 457 8.844 -3.920 5.555 1.00 0.00 N ATOM 556 CE2 TRP A 457 8.688 -3.837 4.197 1.00 0.00 C ATOM 557 CE3 TRP A 457 7.140 -2.851 2.626 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.470 -4.357 3.169 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.917 -3.369 1.607 1.00 0.00 C ATOM 560 CH2 TRP A 457 9.071 -4.115 1.883 1.00 0.00 C ATOM 0 H TRP A 457 7.324 -0.877 3.685 1.00 0.00 H new ATOM 0 HA TRP A 457 4.945 0.064 5.148 1.00 0.00 H new ATOM 0 HB2 TRP A 457 5.435 -2.032 6.506 1.00 0.00 H new ATOM 0 HB3 TRP A 457 4.934 -2.294 4.847 1.00 0.00 H new ATOM 0 HD1 TRP A 457 7.683 -3.146 7.233 1.00 0.00 H new ATOM 0 HE1 TRP A 457 9.602 -4.405 6.036 1.00 0.00 H new ATOM 0 HE3 TRP A 457 6.252 -2.277 2.403 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 10.360 -4.931 3.379 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 7.630 -3.196 0.580 1.00 0.00 H new ATOM 0 HH2 TRP A 457 9.657 -4.506 1.064 1.00 0.00 H new ATOM 571 N PRO A 458 6.074 0.578 7.396 1.00 0.00 N ATOM 572 CA PRO A 458 6.723 1.210 8.549 1.00 0.00 C ATOM 573 C PRO A 458 7.591 0.233 9.334 1.00 0.00 C ATOM 574 O PRO A 458 7.371 -0.978 9.295 1.00 0.00 O ATOM 575 CB PRO A 458 5.544 1.684 9.403 1.00 0.00 C ATOM 576 CG PRO A 458 4.432 0.754 9.062 1.00 0.00 C ATOM 577 CD PRO A 458 4.632 0.374 7.612 1.00 0.00 C ATOM 0 HA PRO A 458 7.399 2.011 8.248 1.00 0.00 H new ATOM 0 HB2 PRO A 458 5.783 1.643 10.466 1.00 0.00 H new ATOM 0 HB3 PRO A 458 5.280 2.717 9.176 1.00 0.00 H new ATOM 0 HG2 PRO A 458 4.452 -0.128 9.702 1.00 0.00 H new ATOM 0 HG3 PRO A 458 3.464 1.233 9.209 1.00 0.00 H new ATOM 0 HD2 PRO A 458 4.341 -0.660 7.425 1.00 0.00 H new ATOM 0 HD3 PRO A 458 4.035 0.999 6.948 1.00 0.00 H new ATOM 585 N HIS A 459 8.578 0.766 10.047 1.00 0.00 N ATOM 586 CA HIS A 459 9.480 -0.060 10.842 1.00 0.00 C ATOM 587 C HIS A 459 10.303 -0.982 9.948 1.00 0.00 C ATOM 588 O HIS A 459 10.655 -2.094 10.342 1.00 0.00 O ATOM 589 CB HIS A 459 8.687 -0.886 11.856 1.00 0.00 C ATOM 590 CG HIS A 459 7.870 -0.055 12.798 1.00 0.00 C ATOM 591 ND1 HIS A 459 8.423 0.686 13.820 1.00 0.00 N ATOM 592 CD2 HIS A 459 6.534 0.150 12.866 1.00 0.00 C ATOM 593 CE1 HIS A 459 7.462 1.309 14.478 1.00 0.00 C ATOM 594 NE2 HIS A 459 6.306 1.001 13.919 1.00 0.00 N ATOM 0 H HIS A 459 8.774 1.766 10.091 1.00 0.00 H new ATOM 0 HA HIS A 459 10.162 0.601 11.377 1.00 0.00 H new ATOM 0 HB2 HIS A 459 8.027 -1.568 11.320 1.00 0.00 H new ATOM 0 HB3 HIS A 459 9.379 -1.500 12.433 1.00 0.00 H new ATOM 0 HD2 HIS A 459 5.786 -0.276 12.213 1.00 0.00 H new ATOM 0 HE1 HIS A 459 7.599 1.960 15.329 1.00 0.00 H new ATOM 0 HE2 HIS A 459 5.392 1.340 14.220 1.00 0.00 H new ATOM 602 N LYS A 460 10.606 -0.514 8.742 1.00 0.00 N ATOM 603 CA LYS A 460 11.387 -1.296 7.792 1.00 0.00 C ATOM 604 C LYS A 460 12.874 -1.231 8.127 1.00 0.00 C ATOM 605 O LYS A 460 13.555 -2.255 8.168 1.00 0.00 O ATOM 606 CB LYS A 460 11.152 -0.788 6.367 1.00 0.00 C ATOM 607 CG LYS A 460 12.146 -1.332 5.356 1.00 0.00 C ATOM 608 CD LYS A 460 11.896 -2.802 5.063 1.00 0.00 C ATOM 609 CE LYS A 460 12.727 -3.285 3.884 1.00 0.00 C ATOM 610 NZ LYS A 460 13.053 -4.734 3.992 1.00 0.00 N ATOM 0 H LYS A 460 10.322 0.404 8.399 1.00 0.00 H new ATOM 0 HA LYS A 460 11.062 -2.334 7.860 1.00 0.00 H new ATOM 0 HB2 LYS A 460 10.144 -1.060 6.055 1.00 0.00 H new ATOM 0 HB3 LYS A 460 11.204 0.301 6.365 1.00 0.00 H new ATOM 0 HG2 LYS A 460 12.076 -0.759 4.431 1.00 0.00 H new ATOM 0 HG3 LYS A 460 13.160 -1.203 5.735 1.00 0.00 H new ATOM 0 HD2 LYS A 460 12.135 -3.396 5.945 1.00 0.00 H new ATOM 0 HD3 LYS A 460 10.838 -2.957 4.852 1.00 0.00 H new ATOM 0 HE2 LYS A 460 12.183 -3.103 2.957 1.00 0.00 H new ATOM 0 HE3 LYS A 460 13.650 -2.708 3.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 13.547 -5.044 3.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 13.666 -4.891 4.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 12.175 -5.280 4.103 1.00 0.00 H new ATOM 624 N ALA A 461 13.370 -0.022 8.368 1.00 0.00 N ATOM 625 CA ALA A 461 14.775 0.175 8.703 1.00 0.00 C ATOM 626 C ALA A 461 15.246 -0.859 9.720 1.00 0.00 C ATOM 627 O ALA A 461 16.112 -1.683 9.425 1.00 0.00 O ATOM 628 CB ALA A 461 14.998 1.582 9.236 1.00 0.00 C ATOM 0 H ALA A 461 12.819 0.836 8.337 1.00 0.00 H new ATOM 0 HA ALA A 461 15.362 0.046 7.794 1.00 0.00 H new ATOM 0 HB1 ALA A 461 16.051 1.715 9.482 1.00 0.00 H new ATOM 0 HB2 ALA A 461 14.708 2.309 8.477 1.00 0.00 H new ATOM 0 HB3 ALA A 461 14.395 1.732 10.131 1.00 0.00 H new ATOM 634 N GLU A 462 14.672 -0.809 10.917 1.00 0.00 N ATOM 635 CA GLU A 462 15.036 -1.741 11.978 1.00 0.00 C ATOM 636 C GLU A 462 14.830 -3.185 11.528 1.00 0.00 C ATOM 637 O GLU A 462 15.702 -4.034 11.712 1.00 0.00 O ATOM 638 CB GLU A 462 14.211 -1.465 13.236 1.00 0.00 C ATOM 639 CG GLU A 462 14.511 -0.121 13.878 1.00 0.00 C ATOM 640 CD GLU A 462 13.332 0.430 14.657 1.00 0.00 C ATOM 641 OE1 GLU A 462 12.203 0.403 14.123 1.00 0.00 O ATOM 642 OE2 GLU A 462 13.538 0.888 15.801 1.00 0.00 O ATOM 0 H GLU A 462 13.953 -0.134 11.177 1.00 0.00 H new ATOM 0 HA GLU A 462 16.092 -1.596 12.206 1.00 0.00 H new ATOM 0 HB2 GLU A 462 13.152 -1.509 12.982 1.00 0.00 H new ATOM 0 HB3 GLU A 462 14.398 -2.255 13.963 1.00 0.00 H new ATOM 0 HG2 GLU A 462 15.366 -0.224 14.546 1.00 0.00 H new ATOM 0 HG3 GLU A 462 14.795 0.592 13.104 1.00 0.00 H new ATOM 649 N SER A 463 13.670 -3.455 10.938 1.00 0.00 N ATOM 650 CA SER A 463 13.346 -4.796 10.466 1.00 0.00 C ATOM 651 C SER A 463 14.207 -5.171 9.263 1.00 0.00 C ATOM 652 O SER A 463 13.775 -5.058 8.116 1.00 0.00 O ATOM 653 CB SER A 463 11.865 -4.885 10.094 1.00 0.00 C ATOM 654 OG SER A 463 11.582 -6.094 9.412 1.00 0.00 O ATOM 0 H SER A 463 12.939 -2.763 10.775 1.00 0.00 H new ATOM 0 HA SER A 463 13.553 -5.498 11.273 1.00 0.00 H new ATOM 0 HB2 SER A 463 11.256 -4.821 10.996 1.00 0.00 H new ATOM 0 HB3 SER A 463 11.593 -4.037 9.465 1.00 0.00 H new ATOM 0 HG SER A 463 10.629 -6.127 9.187 1.00 0.00 H new ATOM 660 N LYS A 464 15.429 -5.617 9.535 1.00 0.00 N ATOM 661 CA LYS A 464 16.353 -6.011 8.478 1.00 0.00 C ATOM 662 C LYS A 464 15.757 -7.123 7.621 1.00 0.00 C ATOM 663 O LYS A 464 16.059 -7.233 6.432 1.00 0.00 O ATOM 664 CB LYS A 464 17.682 -6.473 9.080 1.00 0.00 C ATOM 665 CG LYS A 464 17.526 -7.528 10.161 1.00 0.00 C ATOM 666 CD LYS A 464 17.560 -8.932 9.579 1.00 0.00 C ATOM 667 CE LYS A 464 18.031 -9.949 10.607 1.00 0.00 C ATOM 668 NZ LYS A 464 17.651 -11.338 10.227 1.00 0.00 N ATOM 0 H LYS A 464 15.802 -5.715 10.479 1.00 0.00 H new ATOM 0 HA LYS A 464 16.531 -5.143 7.843 1.00 0.00 H new ATOM 0 HB2 LYS A 464 18.313 -6.870 8.285 1.00 0.00 H new ATOM 0 HB3 LYS A 464 18.201 -5.611 9.498 1.00 0.00 H new ATOM 0 HG2 LYS A 464 18.324 -7.418 10.896 1.00 0.00 H new ATOM 0 HG3 LYS A 464 16.584 -7.374 10.688 1.00 0.00 H new ATOM 0 HD2 LYS A 464 16.566 -9.205 9.225 1.00 0.00 H new ATOM 0 HD3 LYS A 464 18.223 -8.953 8.714 1.00 0.00 H new ATOM 0 HE2 LYS A 464 19.114 -9.885 10.712 1.00 0.00 H new ATOM 0 HE3 LYS A 464 17.602 -9.708 11.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 17.990 -12.001 10.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 16.616 -11.406 10.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 18.081 -11.577 9.311 1.00 0.00 H new ATOM 682 N SER A 465 14.908 -7.944 8.231 1.00 0.00 N ATOM 683 CA SER A 465 14.272 -9.049 7.524 1.00 0.00 C ATOM 684 C SER A 465 13.374 -8.532 6.404 1.00 0.00 C ATOM 685 O SER A 465 12.667 -7.537 6.569 1.00 0.00 O ATOM 686 CB SER A 465 13.454 -9.901 8.496 1.00 0.00 C ATOM 687 OG SER A 465 14.299 -10.665 9.339 1.00 0.00 O ATOM 0 H SER A 465 14.645 -7.865 9.213 1.00 0.00 H new ATOM 0 HA SER A 465 15.056 -9.665 7.083 1.00 0.00 H new ATOM 0 HB2 SER A 465 12.817 -9.257 9.102 1.00 0.00 H new ATOM 0 HB3 SER A 465 12.796 -10.566 7.937 1.00 0.00 H new ATOM 0 HG SER A 465 13.753 -11.200 9.952 1.00 0.00 H new ATOM 693 N TYR A 466 13.407 -9.215 5.265 1.00 0.00 N ATOM 694 CA TYR A 466 12.598 -8.824 4.116 1.00 0.00 C ATOM 695 C TYR A 466 11.171 -9.345 4.252 1.00 0.00 C ATOM 696 O TYR A 466 10.585 -9.842 3.289 1.00 0.00 O ATOM 697 CB TYR A 466 13.224 -9.349 2.823 1.00 0.00 C ATOM 698 CG TYR A 466 13.490 -10.838 2.840 1.00 0.00 C ATOM 699 CD1 TYR A 466 14.692 -11.344 3.318 1.00 0.00 C ATOM 700 CD2 TYR A 466 12.538 -11.738 2.378 1.00 0.00 C ATOM 701 CE1 TYR A 466 14.939 -12.703 3.335 1.00 0.00 C ATOM 702 CE2 TYR A 466 12.776 -13.099 2.393 1.00 0.00 C ATOM 703 CZ TYR A 466 13.978 -13.576 2.871 1.00 0.00 C ATOM 704 OH TYR A 466 14.220 -14.931 2.888 1.00 0.00 O ATOM 0 H TYR A 466 13.985 -10.042 5.113 1.00 0.00 H new ATOM 0 HA TYR A 466 12.566 -7.735 4.080 1.00 0.00 H new ATOM 0 HB2 TYR A 466 12.563 -9.116 1.988 1.00 0.00 H new ATOM 0 HB3 TYR A 466 14.162 -8.823 2.643 1.00 0.00 H new ATOM 0 HD1 TYR A 466 15.447 -10.663 3.683 1.00 0.00 H new ATOM 0 HD2 TYR A 466 11.596 -11.368 2.001 1.00 0.00 H new ATOM 0 HE1 TYR A 466 15.879 -13.079 3.710 1.00 0.00 H new ATOM 0 HE2 TYR A 466 12.024 -13.786 2.032 1.00 0.00 H new ATOM 0 HH TYR A 466 13.442 -15.407 2.528 1.00 0.00 H new ATOM 714 N PHE A 467 10.617 -9.229 5.454 1.00 0.00 N ATOM 715 CA PHE A 467 9.259 -9.688 5.718 1.00 0.00 C ATOM 716 C PHE A 467 8.419 -8.575 6.339 1.00 0.00 C ATOM 717 O PHE A 467 8.692 -8.098 7.440 1.00 0.00 O ATOM 718 CB PHE A 467 9.280 -10.904 6.646 1.00 0.00 C ATOM 719 CG PHE A 467 9.482 -12.206 5.924 1.00 0.00 C ATOM 720 CD1 PHE A 467 8.498 -12.709 5.088 1.00 0.00 C ATOM 721 CD2 PHE A 467 10.656 -12.925 6.080 1.00 0.00 C ATOM 722 CE1 PHE A 467 8.681 -13.907 4.423 1.00 0.00 C ATOM 723 CE2 PHE A 467 10.844 -14.124 5.417 1.00 0.00 C ATOM 724 CZ PHE A 467 9.856 -14.614 4.587 1.00 0.00 C ATOM 0 H PHE A 467 11.088 -8.821 6.261 1.00 0.00 H new ATOM 0 HA PHE A 467 8.808 -9.973 4.767 1.00 0.00 H new ATOM 0 HB2 PHE A 467 10.076 -10.777 7.380 1.00 0.00 H new ATOM 0 HB3 PHE A 467 8.341 -10.946 7.198 1.00 0.00 H new ATOM 0 HD1 PHE A 467 7.578 -12.159 4.955 1.00 0.00 H new ATOM 0 HD2 PHE A 467 11.433 -12.545 6.727 1.00 0.00 H new ATOM 0 HE1 PHE A 467 7.906 -14.290 3.776 1.00 0.00 H new ATOM 0 HE2 PHE A 467 11.763 -14.676 5.549 1.00 0.00 H new ATOM 0 HZ PHE A 467 10.002 -15.549 4.067 1.00 0.00 H new ATOM 734 N PRO A 468 7.373 -8.150 5.615 1.00 0.00 N ATOM 735 CA PRO A 468 6.472 -7.089 6.074 1.00 0.00 C ATOM 736 C PRO A 468 6.077 -7.256 7.537 1.00 0.00 C ATOM 737 O PRO A 468 6.329 -8.289 8.159 1.00 0.00 O ATOM 738 CB PRO A 468 5.248 -7.247 5.168 1.00 0.00 C ATOM 739 CG PRO A 468 5.780 -7.848 3.914 1.00 0.00 C ATOM 740 CD PRO A 468 6.988 -8.674 4.293 1.00 0.00 C ATOM 0 HA PRO A 468 6.938 -6.105 6.017 1.00 0.00 H new ATOM 0 HB2 PRO A 468 4.496 -7.889 5.627 1.00 0.00 H new ATOM 0 HB3 PRO A 468 4.771 -6.286 4.975 1.00 0.00 H new ATOM 0 HG2 PRO A 468 5.024 -8.469 3.434 1.00 0.00 H new ATOM 0 HG3 PRO A 468 6.054 -7.071 3.201 1.00 0.00 H new ATOM 0 HD2 PRO A 468 6.748 -9.736 4.338 1.00 0.00 H new ATOM 0 HD3 PRO A 468 7.794 -8.560 3.568 1.00 0.00 H new ATOM 748 N PRO A 469 5.442 -6.219 8.102 1.00 0.00 N ATOM 749 CA PRO A 469 4.998 -6.228 9.499 1.00 0.00 C ATOM 750 C PRO A 469 3.731 -7.052 9.699 1.00 0.00 C ATOM 751 O PRO A 469 3.190 -7.620 8.750 1.00 0.00 O ATOM 752 CB PRO A 469 4.727 -4.750 9.795 1.00 0.00 C ATOM 753 CG PRO A 469 4.374 -4.158 8.474 1.00 0.00 C ATOM 754 CD PRO A 469 5.108 -4.957 7.420 1.00 0.00 C ATOM 0 HA PRO A 469 5.738 -6.680 10.159 1.00 0.00 H new ATOM 0 HB2 PRO A 469 3.914 -4.632 10.512 1.00 0.00 H new ATOM 0 HB3 PRO A 469 5.603 -4.265 10.225 1.00 0.00 H new ATOM 0 HG2 PRO A 469 3.297 -4.199 8.309 1.00 0.00 H new ATOM 0 HG3 PRO A 469 4.663 -3.108 8.433 1.00 0.00 H new ATOM 0 HD2 PRO A 469 4.484 -5.130 6.543 1.00 0.00 H new ATOM 0 HD3 PRO A 469 6.004 -4.439 7.077 1.00 0.00 H new ATOM 762 N LYS A 470 3.261 -7.114 10.941 1.00 0.00 N ATOM 763 CA LYS A 470 2.056 -7.868 11.266 1.00 0.00 C ATOM 764 C LYS A 470 1.054 -7.816 10.117 1.00 0.00 C ATOM 765 O LYS A 470 0.614 -8.851 9.617 1.00 0.00 O ATOM 766 CB LYS A 470 1.414 -7.317 12.541 1.00 0.00 C ATOM 767 CG LYS A 470 2.060 -7.827 13.817 1.00 0.00 C ATOM 768 CD LYS A 470 3.248 -6.970 14.222 1.00 0.00 C ATOM 769 CE LYS A 470 3.501 -7.039 15.720 1.00 0.00 C ATOM 770 NZ LYS A 470 4.203 -8.294 16.107 1.00 0.00 N ATOM 0 H LYS A 470 3.697 -6.651 11.739 1.00 0.00 H new ATOM 0 HA LYS A 470 2.341 -8.907 11.429 1.00 0.00 H new ATOM 0 HB2 LYS A 470 1.471 -6.229 12.525 1.00 0.00 H new ATOM 0 HB3 LYS A 470 0.356 -7.581 12.549 1.00 0.00 H new ATOM 0 HG2 LYS A 470 1.324 -7.833 14.621 1.00 0.00 H new ATOM 0 HG3 LYS A 470 2.385 -8.857 13.674 1.00 0.00 H new ATOM 0 HD2 LYS A 470 4.137 -7.302 13.686 1.00 0.00 H new ATOM 0 HD3 LYS A 470 3.068 -5.935 13.930 1.00 0.00 H new ATOM 0 HE2 LYS A 470 4.097 -6.180 16.027 1.00 0.00 H new ATOM 0 HE3 LYS A 470 2.552 -6.975 16.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 4.357 -8.303 17.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 3.623 -9.114 15.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 5.120 -8.343 15.619 1.00 0.00 H new ATOM 784 N GLY A 471 0.700 -6.604 9.700 1.00 0.00 N ATOM 785 CA GLY A 471 -0.246 -6.441 8.612 1.00 0.00 C ATOM 786 C GLY A 471 -0.602 -4.988 8.367 1.00 0.00 C ATOM 787 O GLY A 471 -1.711 -4.553 8.679 1.00 0.00 O ATOM 0 H GLY A 471 1.052 -5.732 10.096 1.00 0.00 H new ATOM 0 HA2 GLY A 471 0.175 -6.867 7.701 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -1.153 -7.002 8.836 1.00 0.00 H new ATOM 791 N TYR A 472 0.339 -4.235 7.809 1.00 0.00 N ATOM 792 CA TYR A 472 0.120 -2.822 7.527 1.00 0.00 C ATOM 793 C TYR A 472 1.305 -2.227 6.772 1.00 0.00 C ATOM 794 O TYR A 472 2.437 -2.252 7.254 1.00 0.00 O ATOM 795 CB TYR A 472 -0.111 -2.050 8.827 1.00 0.00 C ATOM 796 CG TYR A 472 0.886 -2.383 9.914 1.00 0.00 C ATOM 797 CD1 TYR A 472 2.152 -1.810 9.921 1.00 0.00 C ATOM 798 CD2 TYR A 472 0.563 -3.270 10.932 1.00 0.00 C ATOM 799 CE1 TYR A 472 3.067 -2.111 10.911 1.00 0.00 C ATOM 800 CE2 TYR A 472 1.471 -3.576 11.927 1.00 0.00 C ATOM 801 CZ TYR A 472 2.721 -2.995 11.913 1.00 0.00 C ATOM 802 OH TYR A 472 3.629 -3.298 12.901 1.00 0.00 O ATOM 0 H TYR A 472 1.261 -4.580 7.543 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.767 -2.736 6.900 1.00 0.00 H new ATOM 0 HB2 TYR A 472 -0.065 -0.981 8.618 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -1.117 -2.260 9.191 1.00 0.00 H new ATOM 0 HD1 TYR A 472 2.425 -1.117 9.139 1.00 0.00 H new ATOM 0 HD2 TYR A 472 -0.415 -3.729 10.946 1.00 0.00 H new ATOM 0 HE1 TYR A 472 4.047 -1.657 10.901 1.00 0.00 H new ATOM 0 HE2 TYR A 472 1.203 -4.267 12.712 1.00 0.00 H new ATOM 0 HH TYR A 472 3.167 -3.735 13.647 1.00 0.00 H new ATOM 812 N ALA A 473 1.035 -1.690 5.587 1.00 0.00 N ATOM 813 CA ALA A 473 2.077 -1.086 4.766 1.00 0.00 C ATOM 814 C ALA A 473 1.542 0.118 3.999 1.00 0.00 C ATOM 815 O ALA A 473 0.340 0.384 4.000 1.00 0.00 O ATOM 816 CB ALA A 473 2.653 -2.114 3.804 1.00 0.00 C ATOM 0 H ALA A 473 0.103 -1.661 5.174 1.00 0.00 H new ATOM 0 HA ALA A 473 2.871 -0.739 5.427 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.430 -1.649 3.197 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.081 -2.942 4.369 1.00 0.00 H new ATOM 0 HB3 ALA A 473 1.861 -2.489 3.155 1.00 0.00 H new ATOM 822 N PHE A 474 2.442 0.844 3.344 1.00 0.00 N ATOM 823 CA PHE A 474 2.060 2.022 2.573 1.00 0.00 C ATOM 824 C PHE A 474 2.472 1.872 1.112 1.00 0.00 C ATOM 825 O PHE A 474 3.626 1.566 0.808 1.00 0.00 O ATOM 826 CB PHE A 474 2.700 3.277 3.169 1.00 0.00 C ATOM 827 CG PHE A 474 2.200 3.610 4.546 1.00 0.00 C ATOM 828 CD1 PHE A 474 2.428 2.749 5.607 1.00 0.00 C ATOM 829 CD2 PHE A 474 1.500 4.783 4.778 1.00 0.00 C ATOM 830 CE1 PHE A 474 1.968 3.052 6.875 1.00 0.00 C ATOM 831 CE2 PHE A 474 1.039 5.092 6.044 1.00 0.00 C ATOM 832 CZ PHE A 474 1.272 4.225 7.093 1.00 0.00 C ATOM 0 H PHE A 474 3.441 0.638 3.332 1.00 0.00 H new ATOM 0 HA PHE A 474 0.975 2.119 2.618 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.781 3.141 3.207 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.508 4.122 2.508 1.00 0.00 H new ATOM 0 HD1 PHE A 474 2.971 1.830 5.442 1.00 0.00 H new ATOM 0 HD2 PHE A 474 1.312 5.463 3.961 1.00 0.00 H new ATOM 0 HE1 PHE A 474 2.153 2.373 7.694 1.00 0.00 H new ATOM 0 HE2 PHE A 474 0.497 6.011 6.212 1.00 0.00 H new ATOM 0 HZ PHE A 474 0.911 4.464 8.082 1.00 0.00 H new ATOM 842 N LEU A 475 1.521 2.089 0.210 1.00 0.00 N ATOM 843 CA LEU A 475 1.783 1.978 -1.221 1.00 0.00 C ATOM 844 C LEU A 475 1.906 3.358 -1.860 1.00 0.00 C ATOM 845 O LEU A 475 1.018 4.200 -1.721 1.00 0.00 O ATOM 846 CB LEU A 475 0.668 1.185 -1.904 1.00 0.00 C ATOM 847 CG LEU A 475 0.343 -0.178 -1.293 1.00 0.00 C ATOM 848 CD1 LEU A 475 -0.930 -0.747 -1.901 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.505 -1.141 -1.488 1.00 0.00 C ATOM 0 H LEU A 475 0.561 2.343 0.444 1.00 0.00 H new ATOM 0 HA LEU A 475 2.728 1.451 -1.353 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.239 1.790 -1.895 1.00 0.00 H new ATOM 0 HB3 LEU A 475 0.942 1.037 -2.948 1.00 0.00 H new ATOM 0 HG LEU A 475 0.182 -0.045 -0.223 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -1.145 -1.717 -1.453 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.760 -0.067 -1.709 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.798 -0.865 -2.977 1.00 0.00 H new ATOM 0 HD21 LEU A 475 1.256 -2.106 -1.047 1.00 0.00 H new ATOM 0 HD22 LEU A 475 1.697 -1.268 -2.553 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.395 -0.740 -1.004 1.00 0.00 H new ATOM 861 N LEU A 476 3.011 3.582 -2.563 1.00 0.00 N ATOM 862 CA LEU A 476 3.250 4.859 -3.227 1.00 0.00 C ATOM 863 C LEU A 476 3.134 4.715 -4.741 1.00 0.00 C ATOM 864 O LEU A 476 4.134 4.543 -5.437 1.00 0.00 O ATOM 865 CB LEU A 476 4.634 5.396 -2.859 1.00 0.00 C ATOM 866 CG LEU A 476 4.843 5.759 -1.388 1.00 0.00 C ATOM 867 CD1 LEU A 476 6.325 5.917 -1.083 1.00 0.00 C ATOM 868 CD2 LEU A 476 4.087 7.033 -1.040 1.00 0.00 C ATOM 0 H LEU A 476 3.756 2.896 -2.688 1.00 0.00 H new ATOM 0 HA LEU A 476 2.491 5.565 -2.888 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.377 4.649 -3.138 1.00 0.00 H new ATOM 0 HB3 LEU A 476 4.830 6.282 -3.463 1.00 0.00 H new ATOM 0 HG LEU A 476 4.450 4.948 -0.774 1.00 0.00 H new ATOM 0 HD11 LEU A 476 6.455 6.175 -0.032 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.842 4.980 -1.293 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.742 6.709 -1.705 1.00 0.00 H new ATOM 0 HD21 LEU A 476 4.247 7.276 0.010 1.00 0.00 H new ATOM 0 HD22 LEU A 476 4.449 7.852 -1.661 1.00 0.00 H new ATOM 0 HD23 LEU A 476 3.022 6.885 -1.220 1.00 0.00 H new ATOM 880 N PHE A 477 1.906 4.790 -5.245 1.00 0.00 N ATOM 881 CA PHE A 477 1.659 4.670 -6.677 1.00 0.00 C ATOM 882 C PHE A 477 2.412 5.748 -7.451 1.00 0.00 C ATOM 883 O PHE A 477 2.289 6.937 -7.158 1.00 0.00 O ATOM 884 CB PHE A 477 0.160 4.771 -6.967 1.00 0.00 C ATOM 885 CG PHE A 477 -0.603 3.525 -6.620 1.00 0.00 C ATOM 886 CD1 PHE A 477 -0.750 2.506 -7.547 1.00 0.00 C ATOM 887 CD2 PHE A 477 -1.173 3.373 -5.366 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.452 1.358 -7.230 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.876 2.227 -5.043 1.00 0.00 C ATOM 890 CZ PHE A 477 -2.015 1.218 -5.976 1.00 0.00 C ATOM 0 H PHE A 477 1.067 4.933 -4.683 1.00 0.00 H new ATOM 0 HA PHE A 477 2.020 3.695 -7.003 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.255 5.609 -6.407 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.017 4.992 -8.025 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -0.311 2.610 -8.528 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -1.067 4.159 -4.633 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -1.560 0.571 -7.962 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -2.316 2.121 -4.062 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.563 0.321 -5.726 1.00 0.00 H new ATOM 900 N GLN A 478 3.193 5.322 -8.439 1.00 0.00 N ATOM 901 CA GLN A 478 3.967 6.251 -9.255 1.00 0.00 C ATOM 902 C GLN A 478 3.120 7.450 -9.667 1.00 0.00 C ATOM 903 O GLN A 478 3.413 8.585 -9.294 1.00 0.00 O ATOM 904 CB GLN A 478 4.508 5.542 -10.498 1.00 0.00 C ATOM 905 CG GLN A 478 5.766 4.730 -10.236 1.00 0.00 C ATOM 906 CD GLN A 478 6.822 5.516 -9.485 1.00 0.00 C ATOM 907 OE1 GLN A 478 7.102 6.670 -9.811 1.00 0.00 O ATOM 908 NE2 GLN A 478 7.416 4.894 -8.473 1.00 0.00 N ATOM 0 H GLN A 478 3.307 4.341 -8.694 1.00 0.00 H new ATOM 0 HA GLN A 478 4.804 6.610 -8.657 1.00 0.00 H new ATOM 0 HB2 GLN A 478 3.736 4.883 -10.895 1.00 0.00 H new ATOM 0 HB3 GLN A 478 4.719 6.285 -11.267 1.00 0.00 H new ATOM 0 HG2 GLN A 478 5.506 3.839 -9.664 1.00 0.00 H new ATOM 0 HG3 GLN A 478 6.179 4.390 -11.186 1.00 0.00 H new ATOM 0 HE21 GLN A 478 7.153 3.937 -8.237 1.00 0.00 H new ATOM 0 HE22 GLN A 478 8.135 5.373 -7.931 1.00 0.00 H new ATOM 917 N GLU A 479 2.069 7.189 -10.439 1.00 0.00 N ATOM 918 CA GLU A 479 1.181 8.249 -10.902 1.00 0.00 C ATOM 919 C GLU A 479 -0.073 8.325 -10.036 1.00 0.00 C ATOM 920 O GLU A 479 -0.405 7.379 -9.322 1.00 0.00 O ATOM 921 CB GLU A 479 0.792 8.016 -12.363 1.00 0.00 C ATOM 922 CG GLU A 479 1.792 8.583 -13.357 1.00 0.00 C ATOM 923 CD GLU A 479 1.668 10.085 -13.517 1.00 0.00 C ATOM 924 OE1 GLU A 479 0.629 10.542 -14.038 1.00 0.00 O ATOM 925 OE2 GLU A 479 2.610 10.804 -13.122 1.00 0.00 O ATOM 0 H GLU A 479 1.812 6.254 -10.756 1.00 0.00 H new ATOM 0 HA GLU A 479 1.714 9.196 -10.822 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.688 6.945 -12.536 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.184 8.465 -12.546 1.00 0.00 H new ATOM 0 HG2 GLU A 479 2.802 8.339 -13.030 1.00 0.00 H new ATOM 0 HG3 GLU A 479 1.646 8.105 -14.326 1.00 0.00 H new ATOM 932 N GLU A 480 -0.765 9.458 -10.105 1.00 0.00 N ATOM 933 CA GLU A 480 -1.982 9.658 -9.327 1.00 0.00 C ATOM 934 C GLU A 480 -3.155 8.905 -9.948 1.00 0.00 C ATOM 935 O GLU A 480 -3.915 8.234 -9.250 1.00 0.00 O ATOM 936 CB GLU A 480 -2.312 11.148 -9.229 1.00 0.00 C ATOM 937 CG GLU A 480 -1.435 11.903 -8.245 1.00 0.00 C ATOM 938 CD GLU A 480 -1.270 13.365 -8.611 1.00 0.00 C ATOM 939 OE1 GLU A 480 -2.161 13.907 -9.300 1.00 0.00 O ATOM 940 OE2 GLU A 480 -0.253 13.967 -8.211 1.00 0.00 O ATOM 0 H GLU A 480 -0.504 10.251 -10.691 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.811 9.265 -8.325 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -2.209 11.600 -10.216 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -3.355 11.262 -8.934 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -1.868 11.829 -7.248 1.00 0.00 H new ATOM 0 HG3 GLU A 480 -0.454 11.430 -8.202 1.00 0.00 H new ATOM 947 N SER A 481 -3.296 9.023 -11.264 1.00 0.00 N ATOM 948 CA SER A 481 -4.378 8.358 -11.980 1.00 0.00 C ATOM 949 C SER A 481 -4.690 7.002 -11.355 1.00 0.00 C ATOM 950 O SER A 481 -5.835 6.716 -11.005 1.00 0.00 O ATOM 951 CB SER A 481 -4.010 8.181 -13.454 1.00 0.00 C ATOM 952 OG SER A 481 -4.390 9.314 -14.215 1.00 0.00 O ATOM 0 H SER A 481 -2.674 9.573 -11.856 1.00 0.00 H new ATOM 0 HA SER A 481 -5.267 8.985 -11.908 1.00 0.00 H new ATOM 0 HB2 SER A 481 -2.936 8.020 -13.547 1.00 0.00 H new ATOM 0 HB3 SER A 481 -4.501 7.292 -13.850 1.00 0.00 H new ATOM 0 HG SER A 481 -4.142 9.176 -15.153 1.00 0.00 H new ATOM 958 N SER A 482 -3.663 6.170 -11.219 1.00 0.00 N ATOM 959 CA SER A 482 -3.826 4.841 -10.640 1.00 0.00 C ATOM 960 C SER A 482 -4.707 4.896 -9.396 1.00 0.00 C ATOM 961 O SER A 482 -5.645 4.112 -9.250 1.00 0.00 O ATOM 962 CB SER A 482 -2.463 4.244 -10.288 1.00 0.00 C ATOM 963 OG SER A 482 -1.696 5.146 -9.509 1.00 0.00 O ATOM 0 H SER A 482 -2.709 6.392 -11.502 1.00 0.00 H new ATOM 0 HA SER A 482 -4.312 4.206 -11.381 1.00 0.00 H new ATOM 0 HB2 SER A 482 -2.601 3.312 -9.740 1.00 0.00 H new ATOM 0 HB3 SER A 482 -1.923 3.999 -11.202 1.00 0.00 H new ATOM 0 HG SER A 482 -1.402 5.894 -10.069 1.00 0.00 H new ATOM 969 N VAL A 483 -4.397 5.828 -8.500 1.00 0.00 N ATOM 970 CA VAL A 483 -5.160 5.986 -7.267 1.00 0.00 C ATOM 971 C VAL A 483 -6.658 5.874 -7.530 1.00 0.00 C ATOM 972 O VAL A 483 -7.367 5.150 -6.831 1.00 0.00 O ATOM 973 CB VAL A 483 -4.868 7.342 -6.597 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.753 7.536 -5.376 1.00 0.00 C ATOM 975 CG2 VAL A 483 -3.397 7.445 -6.222 1.00 0.00 C ATOM 0 H VAL A 483 -3.623 6.485 -8.605 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.850 5.184 -6.597 1.00 0.00 H new ATOM 0 HB VAL A 483 -5.094 8.136 -7.309 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -5.532 8.499 -4.916 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.800 7.509 -5.678 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -5.562 6.739 -4.658 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -3.209 8.409 -5.750 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -3.142 6.645 -5.527 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.785 7.355 -7.120 1.00 0.00 H new ATOM 985 N GLN A 484 -7.132 6.594 -8.541 1.00 0.00 N ATOM 986 CA GLN A 484 -8.546 6.575 -8.895 1.00 0.00 C ATOM 987 C GLN A 484 -8.983 5.176 -9.315 1.00 0.00 C ATOM 988 O GLN A 484 -9.950 4.631 -8.784 1.00 0.00 O ATOM 989 CB GLN A 484 -8.824 7.569 -10.024 1.00 0.00 C ATOM 990 CG GLN A 484 -10.277 7.591 -10.471 1.00 0.00 C ATOM 991 CD GLN A 484 -11.171 8.352 -9.512 1.00 0.00 C ATOM 992 OE1 GLN A 484 -11.527 9.505 -9.759 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.540 7.710 -8.410 1.00 0.00 N ATOM 0 H GLN A 484 -6.558 7.198 -9.129 1.00 0.00 H new ATOM 0 HA GLN A 484 -9.119 6.866 -8.015 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -8.538 8.568 -9.696 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -8.193 7.322 -10.878 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -10.342 8.045 -11.460 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.640 6.567 -10.565 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -11.222 6.755 -8.245 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -12.142 8.172 -7.728 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.263 4.599 -10.272 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.576 3.262 -10.762 1.00 0.00 C ATOM 1004 C ALA A 485 -8.659 2.262 -9.614 1.00 0.00 C ATOM 1005 O ALA A 485 -9.516 1.378 -9.608 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.536 2.816 -11.779 1.00 0.00 C ATOM 0 H ALA A 485 -7.459 5.036 -10.723 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.551 3.299 -11.248 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -7.782 1.816 -12.136 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.528 3.510 -12.619 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.552 2.802 -11.311 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.762 2.406 -8.644 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.733 1.514 -7.490 1.00 0.00 C ATOM 1014 C LEU A 486 -9.020 1.632 -6.679 1.00 0.00 C ATOM 1015 O LEU A 486 -9.699 0.636 -6.428 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.528 1.833 -6.605 1.00 0.00 C ATOM 1017 CG LEU A 486 -6.292 0.888 -5.426 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.606 -0.386 -5.892 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -5.468 1.576 -4.347 1.00 0.00 C ATOM 0 H LEU A 486 -7.045 3.132 -8.634 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.647 0.490 -7.854 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.634 1.833 -7.229 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -6.646 2.844 -6.216 1.00 0.00 H new ATOM 0 HG LEU A 486 -7.259 0.620 -5.001 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.446 -1.046 -5.039 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.234 -0.889 -6.628 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -4.645 -0.138 -6.344 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -5.310 0.889 -3.516 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.504 1.874 -4.760 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -5.999 2.459 -3.991 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.348 2.854 -6.275 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.555 3.101 -5.495 1.00 0.00 C ATOM 1033 C ILE A 487 -11.778 2.481 -6.163 1.00 0.00 C ATOM 1034 O ILE A 487 -12.473 1.658 -5.566 1.00 0.00 O ATOM 1035 CB ILE A 487 -10.800 4.609 -5.300 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.593 5.261 -4.623 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -12.062 4.839 -4.482 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.538 6.762 -4.802 1.00 0.00 C ATOM 0 H ILE A 487 -8.796 3.688 -6.474 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.402 2.637 -4.521 1.00 0.00 H new ATOM 0 HB ILE A 487 -10.936 5.070 -6.279 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.616 5.031 -3.558 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.680 4.822 -5.025 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -12.222 5.909 -4.353 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -12.916 4.405 -5.001 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -11.953 4.368 -3.505 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -8.657 7.157 -4.296 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -9.484 7.000 -5.864 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -10.434 7.212 -4.375 1.00 0.00 H new ATOM 1050 N ASP A 488 -12.033 2.879 -7.404 1.00 0.00 N ATOM 1051 CA ASP A 488 -13.170 2.360 -8.155 1.00 0.00 C ATOM 1052 C ASP A 488 -13.256 0.842 -8.031 1.00 0.00 C ATOM 1053 O ASP A 488 -14.345 0.278 -7.924 1.00 0.00 O ATOM 1054 CB ASP A 488 -13.060 2.758 -9.628 1.00 0.00 C ATOM 1055 CG ASP A 488 -14.402 2.742 -10.333 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -15.401 3.174 -9.719 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -14.454 2.299 -11.499 1.00 0.00 O ATOM 0 H ASP A 488 -11.468 3.560 -7.912 1.00 0.00 H new ATOM 0 HA ASP A 488 -14.078 2.793 -7.736 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -12.626 3.755 -9.701 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -12.378 2.076 -10.136 1.00 0.00 H new ATOM 1062 N ALA A 489 -12.100 0.185 -8.047 1.00 0.00 N ATOM 1063 CA ALA A 489 -12.045 -1.267 -7.935 1.00 0.00 C ATOM 1064 C ALA A 489 -12.288 -1.717 -6.498 1.00 0.00 C ATOM 1065 O ALA A 489 -12.957 -2.723 -6.258 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.703 -1.784 -8.432 1.00 0.00 C ATOM 0 H ALA A 489 -11.189 0.636 -8.136 1.00 0.00 H new ATOM 0 HA ALA A 489 -12.836 -1.685 -8.557 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -10.676 -2.870 -8.343 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.569 -1.502 -9.476 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -9.902 -1.350 -7.833 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.742 -0.967 -5.548 1.00 0.00 N ATOM 1073 CA CYS A 490 -11.899 -1.289 -4.135 1.00 0.00 C ATOM 1074 C CYS A 490 -13.351 -1.126 -3.697 1.00 0.00 C ATOM 1075 O CYS A 490 -13.881 -0.015 -3.671 1.00 0.00 O ATOM 1076 CB CYS A 490 -10.993 -0.398 -3.283 1.00 0.00 C ATOM 1077 SG CYS A 490 -9.231 -0.574 -3.647 1.00 0.00 S ATOM 0 H CYS A 490 -11.186 -0.131 -5.731 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.611 -2.330 -3.992 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -11.281 0.643 -3.431 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -11.160 -0.628 -2.231 1.00 0.00 H new ATOM 0 HG CYS A 490 -9.020 -0.317 -4.904 1.00 0.00 H new ATOM 1083 N LEU A 491 -13.989 -2.240 -3.356 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.381 -2.221 -2.921 1.00 0.00 C ATOM 1085 C LEU A 491 -15.587 -1.212 -1.797 1.00 0.00 C ATOM 1086 O LEU A 491 -14.655 -0.512 -1.400 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.810 -3.614 -2.457 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.553 -4.758 -3.438 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.605 -6.098 -2.722 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -16.563 -4.720 -4.577 1.00 0.00 C ATOM 0 H LEU A 491 -13.565 -3.167 -3.372 1.00 0.00 H new ATOM 0 HA LEU A 491 -15.997 -1.922 -3.769 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -15.293 -3.839 -1.524 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.876 -3.588 -2.232 1.00 0.00 H new ATOM 0 HG LEU A 491 -14.555 -4.633 -3.858 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -15.420 -6.900 -3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -14.844 -6.124 -1.942 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -16.589 -6.233 -2.273 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -16.365 -5.541 -5.266 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -17.571 -4.819 -4.173 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -16.477 -3.772 -5.108 1.00 0.00 H new ATOM 1102 N GLU A 492 -16.812 -1.144 -1.286 1.00 0.00 N ATOM 1103 CA GLU A 492 -17.139 -0.221 -0.205 1.00 0.00 C ATOM 1104 C GLU A 492 -18.169 -0.832 0.740 1.00 0.00 C ATOM 1105 O GLU A 492 -19.086 -1.529 0.307 1.00 0.00 O ATOM 1106 CB GLU A 492 -17.670 1.097 -0.773 1.00 0.00 C ATOM 1107 CG GLU A 492 -17.657 2.241 0.227 1.00 0.00 C ATOM 1108 CD GLU A 492 -17.530 3.597 -0.439 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -18.505 4.035 -1.085 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -16.456 4.221 -0.313 1.00 0.00 O ATOM 0 H GLU A 492 -17.594 -1.717 -1.603 1.00 0.00 H new ATOM 0 HA GLU A 492 -16.227 -0.024 0.358 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -17.071 1.377 -1.640 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -18.690 0.946 -1.126 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -18.574 2.214 0.816 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -16.828 2.102 0.921 1.00 0.00 H new ATOM 1117 N GLU A 493 -18.009 -0.565 2.033 1.00 0.00 N ATOM 1118 CA GLU A 493 -18.925 -1.090 3.039 1.00 0.00 C ATOM 1119 C GLU A 493 -19.574 0.043 3.828 1.00 0.00 C ATOM 1120 O GLU A 493 -20.755 0.342 3.649 1.00 0.00 O ATOM 1121 CB GLU A 493 -18.185 -2.032 3.992 1.00 0.00 C ATOM 1122 CG GLU A 493 -19.101 -2.757 4.963 1.00 0.00 C ATOM 1123 CD GLU A 493 -18.504 -4.056 5.469 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -17.789 -4.722 4.690 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -18.750 -4.406 6.642 1.00 0.00 O ATOM 0 H GLU A 493 -17.255 0.011 2.408 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.709 -1.647 2.525 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -17.634 -2.768 3.407 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -17.450 -1.459 4.558 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -19.315 -2.105 5.810 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -20.052 -2.965 4.473 1.00 0.00 H new ATOM 1132 N ASP A 494 -18.794 0.670 4.702 1.00 0.00 N ATOM 1133 CA ASP A 494 -19.291 1.771 5.519 1.00 0.00 C ATOM 1134 C ASP A 494 -18.399 3.000 5.376 1.00 0.00 C ATOM 1135 O ASP A 494 -17.679 3.369 6.303 1.00 0.00 O ATOM 1136 CB ASP A 494 -19.368 1.350 6.987 1.00 0.00 C ATOM 1137 CG ASP A 494 -19.916 2.448 7.877 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -21.003 2.978 7.565 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -19.257 2.779 8.885 1.00 0.00 O ATOM 0 H ASP A 494 -17.815 0.434 4.863 1.00 0.00 H new ATOM 0 HA ASP A 494 -20.291 2.028 5.169 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -19.999 0.466 7.076 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -18.374 1.068 7.334 1.00 0.00 H new ATOM 1144 N GLY A 495 -18.450 3.629 4.206 1.00 0.00 N ATOM 1145 CA GLY A 495 -17.641 4.809 3.962 1.00 0.00 C ATOM 1146 C GLY A 495 -16.221 4.465 3.559 1.00 0.00 C ATOM 1147 O GLY A 495 -15.577 5.215 2.825 1.00 0.00 O ATOM 0 H GLY A 495 -19.037 3.343 3.423 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -18.104 5.407 3.177 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -17.621 5.425 4.861 1.00 0.00 H new ATOM 1151 N LYS A 496 -15.730 3.328 4.040 1.00 0.00 N ATOM 1152 CA LYS A 496 -14.376 2.886 3.726 1.00 0.00 C ATOM 1153 C LYS A 496 -14.389 1.850 2.606 1.00 0.00 C ATOM 1154 O LYS A 496 -15.398 1.183 2.375 1.00 0.00 O ATOM 1155 CB LYS A 496 -13.709 2.297 4.971 1.00 0.00 C ATOM 1156 CG LYS A 496 -13.253 3.346 5.970 1.00 0.00 C ATOM 1157 CD LYS A 496 -12.964 2.733 7.330 1.00 0.00 C ATOM 1158 CE LYS A 496 -13.227 3.722 8.455 1.00 0.00 C ATOM 1159 NZ LYS A 496 -12.190 4.790 8.508 1.00 0.00 N ATOM 0 H LYS A 496 -16.249 2.696 4.649 1.00 0.00 H new ATOM 0 HA LYS A 496 -13.806 3.752 3.390 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -14.408 1.620 5.462 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -12.849 1.701 4.665 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -12.357 3.841 5.595 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -14.022 4.112 6.071 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -13.584 1.848 7.470 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -11.925 2.404 7.369 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -14.209 4.175 8.318 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -13.251 3.191 9.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -12.405 5.444 9.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -11.256 4.360 8.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -12.184 5.313 7.609 1.00 0.00 H new ATOM 1173 N LEU A 497 -13.262 1.721 1.914 1.00 0.00 N ATOM 1174 CA LEU A 497 -13.143 0.766 0.818 1.00 0.00 C ATOM 1175 C LEU A 497 -12.521 -0.541 1.300 1.00 0.00 C ATOM 1176 O LEU A 497 -12.071 -0.642 2.442 1.00 0.00 O ATOM 1177 CB LEU A 497 -12.300 1.359 -0.312 1.00 0.00 C ATOM 1178 CG LEU A 497 -12.714 2.747 -0.801 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -11.594 3.385 -1.608 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -13.988 2.663 -1.628 1.00 0.00 C ATOM 0 H LEU A 497 -12.418 2.266 2.092 1.00 0.00 H new ATOM 0 HA LEU A 497 -14.144 0.554 0.443 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -11.264 1.408 0.022 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -12.330 0.673 -1.159 1.00 0.00 H new ATOM 0 HG LEU A 497 -12.910 3.374 0.069 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -11.907 4.372 -1.948 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -10.705 3.481 -0.984 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -11.366 2.760 -2.471 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -14.268 3.660 -1.968 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -13.819 2.020 -2.492 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -14.791 2.249 -1.018 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.497 -1.538 0.423 1.00 0.00 N ATOM 1193 CA TYR A 498 -11.930 -2.839 0.759 1.00 0.00 C ATOM 1194 C TYR A 498 -11.595 -3.629 -0.502 1.00 0.00 C ATOM 1195 O TYR A 498 -12.473 -3.934 -1.310 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.906 -3.634 1.628 1.00 0.00 C ATOM 1197 CG TYR A 498 -13.219 -2.970 2.950 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -12.377 -3.124 4.044 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -14.357 -2.188 3.104 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -12.660 -2.519 5.254 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -14.647 -1.579 4.309 1.00 0.00 C ATOM 1202 CZ TYR A 498 -13.796 -1.748 5.381 1.00 0.00 C ATOM 1203 OH TYR A 498 -14.080 -1.143 6.584 1.00 0.00 O ATOM 0 H TYR A 498 -12.864 -1.470 -0.526 1.00 0.00 H new ATOM 0 HA TYR A 498 -11.009 -2.673 1.317 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.834 -3.781 1.076 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -12.488 -4.623 1.818 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -11.486 -3.727 3.947 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -15.026 -2.054 2.267 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -11.995 -2.649 6.095 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -15.535 -0.974 4.411 1.00 0.00 H new ATOM 0 HH TYR A 498 -14.915 -0.635 6.506 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.318 -3.957 -0.664 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.863 -4.713 -1.826 1.00 0.00 C ATOM 1215 C LEU A 499 -9.453 -6.128 -1.429 1.00 0.00 C ATOM 1216 O LEU A 499 -8.880 -6.341 -0.360 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.689 -3.998 -2.497 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.270 -4.535 -3.866 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.374 -4.314 -4.887 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -6.977 -3.876 -4.324 1.00 0.00 C ATOM 0 H LEU A 499 -9.579 -3.711 -0.005 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.691 -4.779 -2.532 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.945 -2.944 -2.605 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.829 -4.050 -1.830 1.00 0.00 H new ATOM 0 HG LEU A 499 -8.096 -5.607 -3.777 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -9.057 -4.703 -5.855 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.277 -4.833 -4.565 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.581 -3.247 -4.974 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.694 -4.270 -5.300 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -7.124 -2.798 -4.396 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -6.186 -4.087 -3.604 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.748 -7.089 -2.297 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.409 -8.484 -2.038 1.00 0.00 C ATOM 1234 C CYS A 500 -8.082 -8.851 -2.694 1.00 0.00 C ATOM 1235 O CYS A 500 -7.895 -8.656 -3.895 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.517 -9.404 -2.551 1.00 0.00 C ATOM 1237 SG CYS A 500 -12.153 -9.037 -1.875 1.00 0.00 S ATOM 0 H CYS A 500 -10.221 -6.928 -3.186 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.310 -8.614 -0.960 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.560 -9.332 -3.638 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -10.259 -10.435 -2.310 1.00 0.00 H new ATOM 0 HG CYS A 500 -13.023 -9.867 -2.370 1.00 0.00 H new ATOM 1243 N VAL A 501 -7.160 -9.383 -1.896 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.850 -9.778 -2.399 1.00 0.00 C ATOM 1245 C VAL A 501 -5.595 -11.262 -2.164 1.00 0.00 C ATOM 1246 O VAL A 501 -5.604 -11.732 -1.027 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.725 -8.964 -1.732 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -4.892 -7.481 -2.027 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.700 -9.219 -0.233 1.00 0.00 C ATOM 0 H VAL A 501 -7.297 -9.550 -0.899 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.849 -9.578 -3.470 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.771 -9.287 -2.148 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -4.088 -6.922 -1.548 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -4.855 -7.318 -3.104 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -5.852 -7.139 -1.641 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -3.899 -8.636 0.222 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.655 -8.925 0.202 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.528 -10.279 -0.047 1.00 0.00 H new ATOM 1259 N SER A 502 -5.368 -11.997 -3.249 1.00 0.00 N ATOM 1260 CA SER A 502 -5.114 -13.430 -3.162 1.00 0.00 C ATOM 1261 C SER A 502 -3.616 -13.719 -3.199 1.00 0.00 C ATOM 1262 O SER A 502 -2.913 -13.291 -4.114 1.00 0.00 O ATOM 1263 CB SER A 502 -5.815 -14.164 -4.306 1.00 0.00 C ATOM 1264 OG SER A 502 -5.414 -13.650 -5.564 1.00 0.00 O ATOM 0 H SER A 502 -5.355 -11.623 -4.198 1.00 0.00 H new ATOM 0 HA SER A 502 -5.512 -13.788 -2.213 1.00 0.00 H new ATOM 0 HB2 SER A 502 -5.585 -15.228 -4.254 1.00 0.00 H new ATOM 0 HB3 SER A 502 -6.895 -14.066 -4.197 1.00 0.00 H new ATOM 0 HG SER A 502 -4.461 -13.422 -5.535 1.00 0.00 H new ATOM 1270 N SER A 503 -3.136 -14.449 -2.198 1.00 0.00 N ATOM 1271 CA SER A 503 -1.722 -14.794 -2.112 1.00 0.00 C ATOM 1272 C SER A 503 -1.533 -16.307 -2.058 1.00 0.00 C ATOM 1273 O SER A 503 -2.329 -17.036 -1.465 1.00 0.00 O ATOM 1274 CB SER A 503 -1.091 -14.145 -0.879 1.00 0.00 C ATOM 1275 OG SER A 503 -1.865 -14.395 0.282 1.00 0.00 O ATOM 0 H SER A 503 -3.706 -14.813 -1.435 1.00 0.00 H new ATOM 0 HA SER A 503 -1.227 -14.416 -3.006 1.00 0.00 H new ATOM 0 HB2 SER A 503 -0.082 -14.532 -0.737 1.00 0.00 H new ATOM 0 HB3 SER A 503 -1.002 -13.070 -1.036 1.00 0.00 H new ATOM 0 HG SER A 503 -2.576 -15.036 0.070 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.454 -16.791 -2.691 1.00 0.00 N ATOM 1282 CA PRO A 504 -0.135 -18.221 -2.729 1.00 0.00 C ATOM 1283 C PRO A 504 -0.271 -18.882 -1.362 1.00 0.00 C ATOM 1284 O PRO A 504 -0.400 -20.103 -1.261 1.00 0.00 O ATOM 1285 CB PRO A 504 1.324 -18.246 -3.192 1.00 0.00 C ATOM 1286 CG PRO A 504 1.487 -17.003 -3.997 1.00 0.00 C ATOM 1287 CD PRO A 504 0.536 -15.980 -3.418 1.00 0.00 C ATOM 0 HA PRO A 504 -0.813 -18.773 -3.380 1.00 0.00 H new ATOM 0 HB2 PRO A 504 2.008 -18.261 -2.344 1.00 0.00 H new ATOM 0 HB3 PRO A 504 1.535 -19.134 -3.788 1.00 0.00 H new ATOM 0 HG2 PRO A 504 2.515 -16.645 -3.951 1.00 0.00 H new ATOM 0 HG3 PRO A 504 1.261 -17.190 -5.047 1.00 0.00 H new ATOM 0 HD2 PRO A 504 1.051 -15.287 -2.753 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.067 -15.383 -4.200 1.00 0.00 H new ATOM 1295 N THR A 505 -0.242 -18.069 -0.311 1.00 0.00 N ATOM 1296 CA THR A 505 -0.362 -18.575 1.051 1.00 0.00 C ATOM 1297 C THR A 505 -1.752 -18.308 1.616 1.00 0.00 C ATOM 1298 O THR A 505 -2.458 -19.235 2.016 1.00 0.00 O ATOM 1299 CB THR A 505 0.689 -17.940 1.981 1.00 0.00 C ATOM 1300 OG1 THR A 505 0.653 -16.514 1.858 1.00 0.00 O ATOM 1301 CG2 THR A 505 2.083 -18.448 1.648 1.00 0.00 C ATOM 0 H THR A 505 -0.136 -17.057 -0.377 1.00 0.00 H new ATOM 0 HA THR A 505 -0.192 -19.651 1.005 1.00 0.00 H new ATOM 0 HB THR A 505 0.453 -18.222 3.007 1.00 0.00 H new ATOM 0 HG1 THR A 505 1.531 -16.144 2.088 1.00 0.00 H new ATOM 0 HG21 THR A 505 2.808 -17.986 2.318 1.00 0.00 H new ATOM 0 HG22 THR A 505 2.115 -19.531 1.770 1.00 0.00 H new ATOM 0 HG23 THR A 505 2.327 -18.192 0.617 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.140 -17.038 1.647 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.447 -16.651 2.162 1.00 0.00 C ATOM 1311 C ILE A 506 -4.434 -16.401 1.026 1.00 0.00 C ATOM 1312 O ILE A 506 -4.065 -15.887 -0.030 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.356 -15.385 3.035 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.434 -15.630 4.231 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -4.741 -14.965 3.505 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -2.901 -16.749 5.135 1.00 0.00 C ATOM 0 H ILE A 506 -1.568 -16.259 1.321 1.00 0.00 H new ATOM 0 HA ILE A 506 -3.803 -17.480 2.774 1.00 0.00 H new ATOM 0 HB ILE A 506 -2.936 -14.577 2.435 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -1.433 -15.862 3.866 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.356 -14.712 4.813 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.660 -14.069 4.121 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.371 -14.755 2.640 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.186 -15.769 4.091 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -2.199 -16.866 5.961 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -3.889 -16.510 5.529 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -2.952 -17.678 4.567 1.00 0.00 H new ATOM 1328 N LYS A 507 -5.691 -16.765 1.251 1.00 0.00 N ATOM 1329 CA LYS A 507 -6.734 -16.579 0.249 1.00 0.00 C ATOM 1330 C LYS A 507 -7.099 -15.104 0.112 1.00 0.00 C ATOM 1331 O LYS A 507 -6.661 -14.270 0.905 1.00 0.00 O ATOM 1332 CB LYS A 507 -7.977 -17.391 0.619 1.00 0.00 C ATOM 1333 CG LYS A 507 -7.979 -18.796 0.043 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.322 -18.792 -1.437 1.00 0.00 C ATOM 1335 CE LYS A 507 -9.825 -18.728 -1.661 1.00 0.00 C ATOM 1336 NZ LYS A 507 -10.173 -18.788 -3.108 1.00 0.00 N ATOM 0 H LYS A 507 -6.013 -17.191 2.120 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.350 -16.931 -0.709 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.051 -17.452 1.705 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -8.864 -16.862 0.269 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -6.999 -19.251 0.189 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -8.700 -19.410 0.583 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -7.845 -17.939 -1.920 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -7.921 -19.690 -1.907 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -10.306 -19.554 -1.137 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -10.217 -17.807 -1.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -11.206 -18.742 -3.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -9.735 -17.985 -3.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -9.821 -19.679 -3.513 1.00 0.00 H new ATOM 1350 N ASP A 508 -7.904 -14.790 -0.897 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.330 -13.416 -1.136 1.00 0.00 C ATOM 1352 C ASP A 508 -8.709 -12.729 0.173 1.00 0.00 C ATOM 1353 O ASP A 508 -9.796 -12.948 0.709 1.00 0.00 O ATOM 1354 CB ASP A 508 -9.515 -13.388 -2.103 1.00 0.00 C ATOM 1355 CG ASP A 508 -9.084 -13.524 -3.550 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -8.606 -12.523 -4.123 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -9.226 -14.631 -4.110 1.00 0.00 O ATOM 0 H ASP A 508 -8.275 -15.468 -1.563 1.00 0.00 H new ATOM 0 HA ASP A 508 -7.495 -12.875 -1.581 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -10.203 -14.196 -1.854 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -10.062 -12.454 -1.976 1.00 0.00 H new ATOM 1362 N LYS A 509 -7.806 -11.899 0.683 1.00 0.00 N ATOM 1363 CA LYS A 509 -8.044 -11.179 1.928 1.00 0.00 C ATOM 1364 C LYS A 509 -8.477 -9.743 1.653 1.00 0.00 C ATOM 1365 O LYS A 509 -7.874 -9.031 0.850 1.00 0.00 O ATOM 1366 CB LYS A 509 -6.782 -11.186 2.794 1.00 0.00 C ATOM 1367 CG LYS A 509 -7.061 -11.017 4.278 1.00 0.00 C ATOM 1368 CD LYS A 509 -7.694 -12.265 4.871 1.00 0.00 C ATOM 1369 CE LYS A 509 -7.936 -12.111 6.364 1.00 0.00 C ATOM 1370 NZ LYS A 509 -9.141 -11.283 6.649 1.00 0.00 N ATOM 0 H LYS A 509 -6.901 -11.708 0.253 1.00 0.00 H new ATOM 0 HA LYS A 509 -8.848 -11.685 2.463 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.249 -12.124 2.638 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -6.121 -10.385 2.464 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -6.131 -10.796 4.801 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -7.723 -10.164 4.430 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -8.639 -12.470 4.367 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -7.046 -13.123 4.693 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -8.057 -13.096 6.816 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -7.063 -11.653 6.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -9.271 -11.202 7.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -9.015 -10.335 6.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -9.979 -11.733 6.228 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.546 -9.305 2.334 1.00 0.00 N ATOM 1385 CA PRO A 510 -10.082 -7.950 2.180 1.00 0.00 C ATOM 1386 C PRO A 510 -9.275 -6.916 2.959 1.00 0.00 C ATOM 1387 O PRO A 510 -9.618 -6.569 4.089 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.499 -8.062 2.749 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.420 -9.166 3.746 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.314 -10.100 3.307 1.00 0.00 C ATOM 0 HA PRO A 510 -10.050 -7.614 1.144 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.813 -7.129 3.216 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -12.223 -8.286 1.966 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -11.215 -8.770 4.740 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.370 -9.698 3.805 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -9.694 -10.409 4.149 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -10.713 -11.008 2.855 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.202 -6.426 2.346 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.347 -5.431 2.982 1.00 0.00 C ATOM 1400 C VAL A 511 -7.988 -4.048 2.939 1.00 0.00 C ATOM 1401 O VAL A 511 -8.624 -3.679 1.952 1.00 0.00 O ATOM 1402 CB VAL A 511 -5.965 -5.364 2.305 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.199 -6.660 2.526 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -6.112 -5.068 0.820 1.00 0.00 C ATOM 0 H VAL A 511 -7.904 -6.702 1.410 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.221 -5.739 4.020 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.397 -4.552 2.759 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.225 -6.594 2.041 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -5.061 -6.824 3.595 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -5.761 -7.492 2.101 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -5.126 -5.024 0.358 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.699 -5.856 0.348 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.617 -4.111 0.688 1.00 0.00 H new ATOM 1414 N GLN A 512 -7.817 -3.289 4.016 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.380 -1.947 4.102 1.00 0.00 C ATOM 1416 C GLN A 512 -7.507 -0.942 3.356 1.00 0.00 C ATOM 1417 O GLN A 512 -6.366 -0.689 3.744 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.528 -1.525 5.565 1.00 0.00 C ATOM 1419 CG GLN A 512 -9.247 -0.198 5.745 1.00 0.00 C ATOM 1420 CD GLN A 512 -9.516 0.127 7.202 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -9.586 -0.767 8.046 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -9.669 1.410 7.504 1.00 0.00 N ATOM 0 H GLN A 512 -7.293 -3.580 4.841 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.365 -1.963 3.635 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -9.072 -2.300 6.105 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -7.538 -1.457 6.017 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -8.648 0.598 5.304 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -10.192 -0.224 5.202 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -9.603 2.118 6.772 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -9.853 1.689 8.468 1.00 0.00 H new ATOM 1431 N ILE A 513 -8.051 -0.374 2.285 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.322 0.603 1.486 1.00 0.00 C ATOM 1433 C ILE A 513 -7.763 2.024 1.820 1.00 0.00 C ATOM 1434 O ILE A 513 -8.857 2.449 1.448 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.518 0.357 -0.021 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -7.109 -1.072 -0.384 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.715 1.364 -0.831 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -5.642 -1.359 -0.152 1.00 0.00 C ATOM 0 H ILE A 513 -8.994 -0.574 1.951 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.266 0.486 1.730 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.574 0.486 -0.261 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -7.705 -1.772 0.202 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.345 -1.253 -1.433 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -6.864 1.177 -1.894 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -7.048 2.373 -0.590 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.657 1.264 -0.590 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -5.424 -2.390 -0.431 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -5.039 -0.684 -0.759 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.404 -1.210 0.901 1.00 0.00 H new ATOM 1450 N ARG A 514 -6.903 2.756 2.521 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.203 4.130 2.903 1.00 0.00 C ATOM 1452 C ARG A 514 -6.131 5.085 2.386 1.00 0.00 C ATOM 1453 O ARG A 514 -5.101 5.306 3.024 1.00 0.00 O ATOM 1454 CB ARG A 514 -7.313 4.246 4.425 1.00 0.00 C ATOM 1455 CG ARG A 514 -7.344 5.681 4.926 1.00 0.00 C ATOM 1456 CD ARG A 514 -7.952 5.772 6.317 1.00 0.00 C ATOM 1457 NE ARG A 514 -7.010 5.360 7.354 1.00 0.00 N ATOM 1458 CZ ARG A 514 -6.100 6.169 7.885 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -6.011 7.428 7.479 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -5.278 5.720 8.824 1.00 0.00 N ATOM 0 H ARG A 514 -5.993 2.420 2.836 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.157 4.405 2.454 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -8.217 3.735 4.755 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -6.470 3.729 4.882 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -6.331 6.084 4.943 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -7.920 6.297 4.235 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -8.274 6.796 6.506 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -8.842 5.144 6.365 1.00 0.00 H new ATOM 0 HE ARG A 514 -7.053 4.398 7.689 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -6.642 7.777 6.758 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -5.312 8.048 7.888 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -5.344 4.752 9.139 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -4.580 6.342 9.231 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.376 5.666 1.202 1.00 0.00 N ATOM 1475 CA PRO A 515 -5.444 6.606 0.573 1.00 0.00 C ATOM 1476 C PRO A 515 -4.912 7.641 1.558 1.00 0.00 C ATOM 1477 O PRO A 515 -5.503 8.706 1.734 1.00 0.00 O ATOM 1478 CB PRO A 515 -6.296 7.282 -0.505 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.332 6.272 -0.858 1.00 0.00 C ATOM 1480 CD PRO A 515 -7.583 5.449 0.386 1.00 0.00 C ATOM 0 HA PRO A 515 -4.559 6.103 0.183 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -6.749 8.201 -0.133 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -5.695 7.552 -1.373 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.249 6.759 -1.191 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -6.991 5.639 -1.678 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.482 5.777 0.907 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -7.720 4.394 0.147 1.00 0.00 H new ATOM 1488 N TRP A 516 -3.793 7.321 2.197 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.180 8.224 3.165 1.00 0.00 C ATOM 1490 C TRP A 516 -2.982 9.612 2.565 1.00 0.00 C ATOM 1491 O TRP A 516 -2.318 9.766 1.541 1.00 0.00 O ATOM 1492 CB TRP A 516 -1.838 7.664 3.639 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.259 8.413 4.801 1.00 0.00 C ATOM 1494 CD1 TRP A 516 -0.496 9.544 4.748 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -1.393 8.081 6.187 1.00 0.00 C ATOM 1496 NE1 TRP A 516 -0.148 9.936 6.018 1.00 0.00 N ATOM 1497 CE2 TRP A 516 -0.687 9.056 6.919 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -2.043 7.058 6.881 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 -0.614 9.034 8.309 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -1.969 7.037 8.261 1.00 0.00 C ATOM 1501 CH2 TRP A 516 -1.259 8.020 8.963 1.00 0.00 C ATOM 0 H TRP A 516 -3.291 6.443 2.063 1.00 0.00 H new ATOM 0 HA TRP A 516 -3.851 8.310 4.019 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -1.967 6.618 3.918 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.130 7.688 2.811 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -0.208 10.055 3.841 1.00 0.00 H new ATOM 0 HE1 TRP A 516 0.420 10.750 6.252 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -2.594 6.297 6.349 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 -0.067 9.791 8.852 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -2.467 6.250 8.807 1.00 0.00 H new ATOM 0 HH2 TRP A 516 -1.220 7.976 10.041 1.00 0.00 H new