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 Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 428 LYS NZ :NH3+ -170:sc= -2.12 (180deg=-2.51!) USER MOD Single : A 444 THR OG1 : rot 180:sc= 0 USER MOD Single : A 446 SER OG : rot 120:sc= -1.24 USER MOD Single : A 459 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-0.42) USER MOD Single : A 460 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 463 SER OG : rot 180:sc= 0 USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 465 SER OG : rot 180:sc= 0 USER MOD Single : A 466 TYR OH : rot 180:sc= 0 USER MOD Single : A 470 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 472 TYR OH : rot 180:sc= -0.159 USER MOD Single : A 478 GLN : amide:sc= -0.703 K(o=-0.7,f=-1.6) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot -49:sc= 0.402 USER MOD Single : A 484 GLN : amide:sc= -0.255 X(o=-0.25,f=-0.26) USER MOD Single : A 490 CYS SG : rot 52:sc= -0.4 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= 0.0625 USER MOD Single : A 503 SER OG : rot -110:sc= -0.64 USER MOD Single : A 505 THR OG1 : rot -140:sc= 0.812 USER MOD Single : A 507 LYS NZ :NH3+ 162:sc= -0.0218 (180deg=-0.312) USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 512 GLN : amide:sc= -0.904 K(o=-0.9,f=-0.39) USER MOD ----------------------------------------------------------------- ATOM 66 N SER A 426 -4.178 11.933 -2.008 1.00 0.00 N ATOM 67 CA SER A 426 -2.747 11.657 -2.065 1.00 0.00 C ATOM 68 C SER A 426 -2.486 10.247 -2.587 1.00 0.00 C ATOM 69 O SER A 426 -3.265 9.327 -2.338 1.00 0.00 O ATOM 70 CB SER A 426 -2.119 11.824 -0.679 1.00 0.00 C ATOM 71 OG SER A 426 -1.899 13.192 -0.381 1.00 0.00 O ATOM 0 HA SER A 426 -2.291 12.370 -2.752 1.00 0.00 H new ATOM 0 HB2 SER A 426 -2.772 11.385 0.075 1.00 0.00 H new ATOM 0 HB3 SER A 426 -1.174 11.283 -0.637 1.00 0.00 H new ATOM 0 HG SER A 426 -1.499 13.272 0.510 1.00 0.00 H new ATOM 77 N ARG A 427 -1.384 10.087 -3.312 1.00 0.00 N ATOM 78 CA ARG A 427 -1.019 8.790 -3.871 1.00 0.00 C ATOM 79 C ARG A 427 -0.902 7.738 -2.773 1.00 0.00 C ATOM 80 O ARG A 427 -1.593 6.719 -2.798 1.00 0.00 O ATOM 81 CB ARG A 427 0.302 8.894 -4.635 1.00 0.00 C ATOM 82 CG ARG A 427 0.229 9.794 -5.858 1.00 0.00 C ATOM 83 CD ARG A 427 1.611 10.066 -6.432 1.00 0.00 C ATOM 84 NE ARG A 427 2.358 11.030 -5.628 1.00 0.00 N ATOM 85 CZ ARG A 427 3.481 11.611 -6.034 1.00 0.00 C ATOM 86 NH1 ARG A 427 3.984 11.329 -7.227 1.00 0.00 N ATOM 87 NH2 ARG A 427 4.103 12.478 -5.245 1.00 0.00 N ATOM 0 H ARG A 427 -0.728 10.838 -3.526 1.00 0.00 H new ATOM 0 HA ARG A 427 -1.807 8.485 -4.560 1.00 0.00 H new ATOM 0 HB2 ARG A 427 1.072 9.271 -3.962 1.00 0.00 H new ATOM 0 HB3 ARG A 427 0.611 7.896 -4.946 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -0.397 9.327 -6.618 1.00 0.00 H new ATOM 0 HG3 ARG A 427 -0.247 10.737 -5.589 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.170 9.132 -6.490 1.00 0.00 H new ATOM 0 HD3 ARG A 427 1.513 10.442 -7.450 1.00 0.00 H new ATOM 0 HE ARG A 427 1.997 11.270 -4.705 1.00 0.00 H new ATOM 0 HH11 ARG A 427 3.508 10.664 -7.837 1.00 0.00 H new ATOM 0 HH12 ARG A 427 4.847 11.777 -7.536 1.00 0.00 H new ATOM 0 HH21 ARG A 427 3.719 12.698 -4.326 1.00 0.00 H new ATOM 0 HH22 ARG A 427 4.966 12.924 -5.557 1.00 0.00 H new ATOM 101 N LYS A 428 -0.024 7.991 -1.809 1.00 0.00 N ATOM 102 CA LYS A 428 0.184 7.067 -0.700 1.00 0.00 C ATOM 103 C LYS A 428 -1.126 6.397 -0.297 1.00 0.00 C ATOM 104 O LYS A 428 -2.132 7.068 -0.067 1.00 0.00 O ATOM 105 CB LYS A 428 0.782 7.805 0.500 1.00 0.00 C ATOM 106 CG LYS A 428 1.332 6.878 1.571 1.00 0.00 C ATOM 107 CD LYS A 428 2.125 7.644 2.617 1.00 0.00 C ATOM 108 CE LYS A 428 2.731 6.708 3.652 1.00 0.00 C ATOM 109 NZ LYS A 428 3.873 5.931 3.095 1.00 0.00 N ATOM 0 H LYS A 428 0.556 8.829 -1.773 1.00 0.00 H new ATOM 0 HA LYS A 428 0.880 6.295 -1.028 1.00 0.00 H new ATOM 0 HB2 LYS A 428 1.581 8.459 0.152 1.00 0.00 H new ATOM 0 HB3 LYS A 428 0.017 8.443 0.942 1.00 0.00 H new ATOM 0 HG2 LYS A 428 0.510 6.348 2.052 1.00 0.00 H new ATOM 0 HG3 LYS A 428 1.970 6.125 1.109 1.00 0.00 H new ATOM 0 HD2 LYS A 428 2.918 8.212 2.130 1.00 0.00 H new ATOM 0 HD3 LYS A 428 1.475 8.365 3.113 1.00 0.00 H new ATOM 0 HE2 LYS A 428 3.070 7.287 4.511 1.00 0.00 H new ATOM 0 HE3 LYS A 428 1.966 6.021 4.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 4.149 5.189 3.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 3.589 5.493 2.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 4.679 6.568 2.931 1.00 0.00 H new ATOM 123 N VAL A 429 -1.105 5.071 -0.213 1.00 0.00 N ATOM 124 CA VAL A 429 -2.290 4.310 0.165 1.00 0.00 C ATOM 125 C VAL A 429 -2.026 3.460 1.402 1.00 0.00 C ATOM 126 O VAL A 429 -0.964 2.851 1.535 1.00 0.00 O ATOM 127 CB VAL A 429 -2.760 3.397 -0.982 1.00 0.00 C ATOM 128 CG1 VAL A 429 -4.011 2.632 -0.578 1.00 0.00 C ATOM 129 CG2 VAL A 429 -3.007 4.210 -2.244 1.00 0.00 C ATOM 0 H VAL A 429 -0.280 4.501 -0.402 1.00 0.00 H new ATOM 0 HA VAL A 429 -3.074 5.034 0.387 1.00 0.00 H new ATOM 0 HB VAL A 429 -1.972 2.673 -1.192 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.328 1.992 -1.402 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.795 2.018 0.296 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.807 3.337 -0.339 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.339 3.548 -3.044 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.776 4.958 -2.050 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -2.084 4.707 -2.543 1.00 0.00 H new ATOM 139 N PHE A 430 -3.000 3.421 2.306 1.00 0.00 N ATOM 140 CA PHE A 430 -2.873 2.644 3.534 1.00 0.00 C ATOM 141 C PHE A 430 -3.581 1.299 3.402 1.00 0.00 C ATOM 142 O PHE A 430 -4.806 1.238 3.294 1.00 0.00 O ATOM 143 CB PHE A 430 -3.450 3.424 4.717 1.00 0.00 C ATOM 144 CG PHE A 430 -3.465 2.642 6.000 1.00 0.00 C ATOM 145 CD1 PHE A 430 -2.321 2.003 6.451 1.00 0.00 C ATOM 146 CD2 PHE A 430 -4.623 2.547 6.755 1.00 0.00 C ATOM 147 CE1 PHE A 430 -2.333 1.282 7.630 1.00 0.00 C ATOM 148 CE2 PHE A 430 -4.641 1.828 7.935 1.00 0.00 C ATOM 149 CZ PHE A 430 -3.494 1.196 8.374 1.00 0.00 C ATOM 0 H PHE A 430 -3.886 3.918 2.211 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.813 2.460 3.711 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.867 4.333 4.862 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -4.467 3.733 4.477 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.410 2.069 5.875 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -5.522 3.041 6.417 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -1.436 0.786 7.969 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -5.551 1.760 8.513 1.00 0.00 H new ATOM 0 HZ PHE A 430 -3.505 0.636 9.297 1.00 0.00 H new ATOM 159 N VAL A 431 -2.801 0.223 3.413 1.00 0.00 N ATOM 160 CA VAL A 431 -3.352 -1.122 3.296 1.00 0.00 C ATOM 161 C VAL A 431 -3.163 -1.908 4.588 1.00 0.00 C ATOM 162 O VAL A 431 -2.036 -2.171 5.007 1.00 0.00 O ATOM 163 CB VAL A 431 -2.700 -1.897 2.136 1.00 0.00 C ATOM 164 CG1 VAL A 431 -3.381 -3.243 1.943 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.748 -1.077 0.855 1.00 0.00 C ATOM 0 H VAL A 431 -1.785 0.256 3.502 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.417 -1.011 3.095 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.655 -2.079 2.385 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.907 -3.776 1.119 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -3.290 -3.831 2.856 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.436 -3.088 1.715 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -2.283 -1.639 0.045 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -3.786 -0.863 0.599 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -2.210 -0.141 1.002 1.00 0.00 H new ATOM 175 N GLY A 432 -4.274 -2.282 5.216 1.00 0.00 N ATOM 176 CA GLY A 432 -4.208 -3.035 6.454 1.00 0.00 C ATOM 177 C GLY A 432 -4.803 -4.423 6.321 1.00 0.00 C ATOM 178 O GLY A 432 -5.836 -4.604 5.676 1.00 0.00 O ATOM 0 H GLY A 432 -5.218 -2.077 4.889 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -3.168 -3.118 6.770 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.737 -2.490 7.236 1.00 0.00 H new ATOM 182 N GLY A 433 -4.150 -5.407 6.931 1.00 0.00 N ATOM 183 CA GLY A 433 -4.635 -6.773 6.864 1.00 0.00 C ATOM 184 C GLY A 433 -3.853 -7.618 5.877 1.00 0.00 C ATOM 185 O GLY A 433 -4.401 -8.532 5.260 1.00 0.00 O ATOM 0 H GLY A 433 -3.293 -5.283 7.471 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.574 -7.226 7.854 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.687 -6.768 6.580 1.00 0.00 H new ATOM 189 N LEU A 434 -2.569 -7.312 5.725 1.00 0.00 N ATOM 190 CA LEU A 434 -1.711 -8.048 4.804 1.00 0.00 C ATOM 191 C LEU A 434 -1.282 -9.382 5.408 1.00 0.00 C ATOM 192 O LEU A 434 -1.013 -9.492 6.605 1.00 0.00 O ATOM 193 CB LEU A 434 -0.477 -7.216 4.449 1.00 0.00 C ATOM 194 CG LEU A 434 -0.709 -6.049 3.489 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.522 -5.158 3.426 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.069 -6.563 2.103 1.00 0.00 C ATOM 0 H LEU A 434 -2.099 -6.559 6.228 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.281 -8.247 3.896 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.051 -6.822 5.372 1.00 0.00 H new ATOM 0 HB3 LEU A 434 0.269 -7.878 4.011 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.543 -5.455 3.863 1.00 0.00 H new ATOM 0 HD11 LEU A 434 0.339 -4.333 2.738 1.00 0.00 H new ATOM 0 HD12 LEU A 434 0.736 -4.762 4.419 1.00 0.00 H new ATOM 0 HD13 LEU A 434 1.375 -5.740 3.076 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.231 -5.719 1.433 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.255 -7.179 1.721 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -1.979 -7.160 2.161 1.00 0.00 H new ATOM 208 N PRO A 435 -1.214 -10.420 4.562 1.00 0.00 N ATOM 209 CA PRO A 435 -0.815 -11.765 4.990 1.00 0.00 C ATOM 210 C PRO A 435 0.446 -11.751 5.846 1.00 0.00 C ATOM 211 O PRO A 435 1.345 -10.931 5.656 1.00 0.00 O ATOM 212 CB PRO A 435 -0.557 -12.495 3.669 1.00 0.00 C ATOM 213 CG PRO A 435 -1.426 -11.802 2.677 1.00 0.00 C ATOM 214 CD PRO A 435 -1.520 -10.362 3.123 1.00 0.00 C ATOM 0 HA PRO A 435 -1.575 -12.237 5.613 1.00 0.00 H new ATOM 0 HB2 PRO A 435 0.493 -12.437 3.384 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -0.809 -13.553 3.745 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.003 -11.871 1.675 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -2.414 -12.262 2.638 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -0.811 -9.730 2.588 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -2.513 -9.951 2.941 1.00 0.00 H new ATOM 222 N PRO A 436 0.517 -12.679 6.812 1.00 0.00 N ATOM 223 CA PRO A 436 1.665 -12.794 7.717 1.00 0.00 C ATOM 224 C PRO A 436 2.839 -13.524 7.073 1.00 0.00 C ATOM 225 O PRO A 436 3.885 -13.706 7.696 1.00 0.00 O ATOM 226 CB PRO A 436 1.111 -13.603 8.892 1.00 0.00 C ATOM 227 CG PRO A 436 0.018 -14.427 8.303 1.00 0.00 C ATOM 228 CD PRO A 436 -0.518 -13.687 7.096 1.00 0.00 C ATOM 0 HA PRO A 436 2.059 -11.819 8.002 1.00 0.00 H new ATOM 0 HB2 PRO A 436 1.882 -14.230 9.339 1.00 0.00 H new ATOM 0 HB3 PRO A 436 0.734 -12.950 9.679 1.00 0.00 H new ATOM 0 HG2 PRO A 436 0.393 -15.409 8.014 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -0.774 -14.590 9.034 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -0.666 -14.357 6.249 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -1.481 -13.222 7.307 1.00 0.00 H new ATOM 236 N ASP A 437 2.658 -13.940 5.825 1.00 0.00 N ATOM 237 CA ASP A 437 3.703 -14.650 5.096 1.00 0.00 C ATOM 238 C ASP A 437 3.843 -14.105 3.678 1.00 0.00 C ATOM 239 O ASP A 437 4.057 -14.862 2.731 1.00 0.00 O ATOM 240 CB ASP A 437 3.397 -16.148 5.053 1.00 0.00 C ATOM 241 CG ASP A 437 2.181 -16.466 4.205 1.00 0.00 C ATOM 242 OD1 ASP A 437 1.051 -16.211 4.671 1.00 0.00 O ATOM 243 OD2 ASP A 437 2.360 -16.971 3.077 1.00 0.00 O ATOM 0 H ASP A 437 1.797 -13.798 5.296 1.00 0.00 H new ATOM 0 HA ASP A 437 4.646 -14.495 5.620 1.00 0.00 H new ATOM 0 HB2 ASP A 437 4.262 -16.681 4.658 1.00 0.00 H new ATOM 0 HB3 ASP A 437 3.234 -16.512 6.067 1.00 0.00 H new ATOM 248 N ILE A 438 3.719 -12.789 3.541 1.00 0.00 N ATOM 249 CA ILE A 438 3.832 -12.144 2.238 1.00 0.00 C ATOM 250 C ILE A 438 5.075 -11.264 2.167 1.00 0.00 C ATOM 251 O ILE A 438 5.428 -10.590 3.135 1.00 0.00 O ATOM 252 CB ILE A 438 2.591 -11.288 1.925 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.735 -10.624 0.554 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.384 -10.240 3.008 1.00 0.00 C ATOM 255 CD1 ILE A 438 1.441 -10.046 0.024 1.00 0.00 C ATOM 0 H ILE A 438 3.541 -12.149 4.315 1.00 0.00 H new ATOM 0 HA ILE A 438 3.911 -12.939 1.497 1.00 0.00 H new ATOM 0 HB ILE A 438 1.716 -11.937 1.903 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.478 -9.829 0.620 1.00 0.00 H new ATOM 0 HG13 ILE A 438 3.115 -11.357 -0.158 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.503 -9.643 2.773 1.00 0.00 H new ATOM 0 HG22 ILE A 438 2.242 -10.733 3.969 1.00 0.00 H new ATOM 0 HG23 ILE A 438 3.259 -9.592 3.059 1.00 0.00 H new ATOM 0 HD11 ILE A 438 1.618 -9.592 -0.951 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.701 -10.840 -0.075 1.00 0.00 H new ATOM 0 HD13 ILE A 438 1.071 -9.289 0.715 1.00 0.00 H new ATOM 267 N ASP A 439 5.733 -11.272 1.013 1.00 0.00 N ATOM 268 CA ASP A 439 6.936 -10.471 0.813 1.00 0.00 C ATOM 269 C ASP A 439 6.620 -9.205 0.023 1.00 0.00 C ATOM 270 O ASP A 439 5.463 -8.934 -0.296 1.00 0.00 O ATOM 271 CB ASP A 439 8.003 -11.289 0.084 1.00 0.00 C ATOM 272 CG ASP A 439 7.470 -11.946 -1.174 1.00 0.00 C ATOM 273 OD1 ASP A 439 7.444 -11.276 -2.228 1.00 0.00 O ATOM 274 OD2 ASP A 439 7.080 -13.130 -1.105 1.00 0.00 O ATOM 0 H ASP A 439 5.454 -11.824 0.202 1.00 0.00 H new ATOM 0 HA ASP A 439 7.317 -10.181 1.792 1.00 0.00 H new ATOM 0 HB2 ASP A 439 8.840 -10.640 -0.175 1.00 0.00 H new ATOM 0 HB3 ASP A 439 8.390 -12.056 0.755 1.00 0.00 H new ATOM 279 N GLU A 440 7.657 -8.433 -0.287 1.00 0.00 N ATOM 280 CA GLU A 440 7.489 -7.194 -1.037 1.00 0.00 C ATOM 281 C GLU A 440 6.869 -7.466 -2.405 1.00 0.00 C ATOM 282 O GLU A 440 5.715 -7.118 -2.656 1.00 0.00 O ATOM 283 CB GLU A 440 8.836 -6.488 -1.207 1.00 0.00 C ATOM 284 CG GLU A 440 8.717 -5.073 -1.749 1.00 0.00 C ATOM 285 CD GLU A 440 9.873 -4.188 -1.327 1.00 0.00 C ATOM 286 OE1 GLU A 440 9.960 -3.857 -0.126 1.00 0.00 O ATOM 287 OE2 GLU A 440 10.692 -3.826 -2.198 1.00 0.00 O ATOM 0 H GLU A 440 8.621 -8.644 -0.031 1.00 0.00 H new ATOM 0 HA GLU A 440 6.816 -6.547 -0.474 1.00 0.00 H new ATOM 0 HB2 GLU A 440 9.345 -6.458 -0.244 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.462 -7.074 -1.880 1.00 0.00 H new ATOM 0 HG2 GLU A 440 8.669 -5.108 -2.837 1.00 0.00 H new ATOM 0 HG3 GLU A 440 7.782 -4.633 -1.403 1.00 0.00 H new ATOM 294 N ASP A 441 7.644 -8.091 -3.285 1.00 0.00 N ATOM 295 CA ASP A 441 7.172 -8.411 -4.627 1.00 0.00 C ATOM 296 C ASP A 441 5.683 -8.744 -4.615 1.00 0.00 C ATOM 297 O ASP A 441 4.885 -8.086 -5.281 1.00 0.00 O ATOM 298 CB ASP A 441 7.965 -9.584 -5.204 1.00 0.00 C ATOM 299 CG ASP A 441 9.446 -9.489 -4.895 1.00 0.00 C ATOM 300 OD1 ASP A 441 9.840 -9.839 -3.763 1.00 0.00 O ATOM 301 OD2 ASP A 441 10.212 -9.064 -5.785 1.00 0.00 O ATOM 0 H ASP A 441 8.601 -8.386 -3.093 1.00 0.00 H new ATOM 0 HA ASP A 441 7.325 -7.535 -5.257 1.00 0.00 H new ATOM 0 HB2 ASP A 441 7.572 -10.518 -4.801 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.824 -9.618 -6.284 1.00 0.00 H new ATOM 306 N GLU A 442 5.318 -9.771 -3.853 1.00 0.00 N ATOM 307 CA GLU A 442 3.925 -10.192 -3.756 1.00 0.00 C ATOM 308 C GLU A 442 2.996 -8.984 -3.670 1.00 0.00 C ATOM 309 O GLU A 442 2.135 -8.788 -4.528 1.00 0.00 O ATOM 310 CB GLU A 442 3.725 -11.091 -2.535 1.00 0.00 C ATOM 311 CG GLU A 442 4.341 -12.472 -2.688 1.00 0.00 C ATOM 312 CD GLU A 442 3.592 -13.535 -1.908 1.00 0.00 C ATOM 313 OE1 GLU A 442 2.346 -13.557 -1.983 1.00 0.00 O ATOM 314 OE2 GLU A 442 4.252 -14.344 -1.222 1.00 0.00 O ATOM 0 H GLU A 442 5.967 -10.326 -3.295 1.00 0.00 H new ATOM 0 HA GLU A 442 3.679 -10.754 -4.657 1.00 0.00 H new ATOM 0 HB2 GLU A 442 4.158 -10.604 -1.661 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.657 -11.198 -2.344 1.00 0.00 H new ATOM 0 HG2 GLU A 442 4.356 -12.744 -3.743 1.00 0.00 H new ATOM 0 HG3 GLU A 442 5.377 -12.443 -2.352 1.00 0.00 H new ATOM 321 N ILE A 443 3.178 -8.178 -2.629 1.00 0.00 N ATOM 322 CA ILE A 443 2.358 -6.990 -2.431 1.00 0.00 C ATOM 323 C ILE A 443 2.282 -6.156 -3.705 1.00 0.00 C ATOM 324 O ILE A 443 1.201 -5.742 -4.127 1.00 0.00 O ATOM 325 CB ILE A 443 2.903 -6.113 -1.289 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.881 -6.887 0.032 1.00 0.00 C ATOM 327 CG2 ILE A 443 2.092 -4.831 -1.171 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.621 -6.190 1.152 1.00 0.00 C ATOM 0 H ILE A 443 3.886 -8.327 -1.910 1.00 0.00 H new ATOM 0 HA ILE A 443 1.359 -7.337 -2.166 1.00 0.00 H new ATOM 0 HB ILE A 443 3.935 -5.847 -1.516 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.846 -7.045 0.334 1.00 0.00 H new ATOM 0 HG13 ILE A 443 3.321 -7.872 -0.126 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.490 -4.222 -0.359 1.00 0.00 H new ATOM 0 HG22 ILE A 443 2.154 -4.274 -2.106 1.00 0.00 H new ATOM 0 HG23 ILE A 443 1.051 -5.077 -0.963 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.564 -6.795 2.057 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.665 -6.056 0.870 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.167 -5.216 1.337 1.00 0.00 H new ATOM 340 N THR A 444 3.437 -5.913 -4.317 1.00 0.00 N ATOM 341 CA THR A 444 3.502 -5.129 -5.544 1.00 0.00 C ATOM 342 C THR A 444 2.550 -5.679 -6.599 1.00 0.00 C ATOM 343 O THR A 444 1.695 -4.959 -7.113 1.00 0.00 O ATOM 344 CB THR A 444 4.931 -5.104 -6.119 1.00 0.00 C ATOM 345 OG1 THR A 444 5.872 -4.807 -5.082 1.00 0.00 O ATOM 346 CG2 THR A 444 5.049 -4.071 -7.230 1.00 0.00 C ATOM 0 H THR A 444 4.340 -6.248 -3.983 1.00 0.00 H new ATOM 0 HA THR A 444 3.205 -4.113 -5.286 1.00 0.00 H new ATOM 0 HB THR A 444 5.149 -6.088 -6.535 1.00 0.00 H new ATOM 0 HG1 THR A 444 6.778 -4.795 -5.456 1.00 0.00 H new ATOM 0 HG21 THR A 444 6.067 -4.071 -7.621 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.353 -4.317 -8.031 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.812 -3.083 -6.835 1.00 0.00 H new ATOM 354 N ALA A 445 2.704 -6.960 -6.918 1.00 0.00 N ATOM 355 CA ALA A 445 1.856 -7.608 -7.911 1.00 0.00 C ATOM 356 C ALA A 445 0.380 -7.403 -7.589 1.00 0.00 C ATOM 357 O ALA A 445 -0.439 -7.205 -8.486 1.00 0.00 O ATOM 358 CB ALA A 445 2.180 -9.092 -7.994 1.00 0.00 C ATOM 0 H ALA A 445 3.409 -7.570 -6.503 1.00 0.00 H new ATOM 0 HA ALA A 445 2.056 -7.150 -8.879 1.00 0.00 H new ATOM 0 HB1 ALA A 445 1.539 -9.563 -8.739 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.224 -9.221 -8.279 1.00 0.00 H new ATOM 0 HB3 ALA A 445 2.009 -9.557 -7.023 1.00 0.00 H new ATOM 364 N SER A 446 0.047 -7.454 -6.303 1.00 0.00 N ATOM 365 CA SER A 446 -1.333 -7.279 -5.863 1.00 0.00 C ATOM 366 C SER A 446 -1.864 -5.909 -6.274 1.00 0.00 C ATOM 367 O SER A 446 -3.039 -5.761 -6.610 1.00 0.00 O ATOM 368 CB SER A 446 -1.431 -7.443 -4.346 1.00 0.00 C ATOM 369 OG SER A 446 -2.705 -7.934 -3.967 1.00 0.00 O ATOM 0 H SER A 446 0.713 -7.615 -5.548 1.00 0.00 H new ATOM 0 HA SER A 446 -1.942 -8.044 -6.344 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.656 -8.128 -4.000 1.00 0.00 H new ATOM 0 HB3 SER A 446 -1.248 -6.484 -3.861 1.00 0.00 H new ATOM 0 HG SER A 446 -2.600 -8.790 -3.501 1.00 0.00 H new ATOM 375 N PHE A 447 -0.989 -4.909 -6.245 1.00 0.00 N ATOM 376 CA PHE A 447 -1.369 -3.550 -6.613 1.00 0.00 C ATOM 377 C PHE A 447 -0.522 -3.045 -7.777 1.00 0.00 C ATOM 378 O PHE A 447 -0.213 -1.857 -7.865 1.00 0.00 O ATOM 379 CB PHE A 447 -1.217 -2.613 -5.413 1.00 0.00 C ATOM 380 CG PHE A 447 -2.110 -2.967 -4.259 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.723 -3.924 -3.334 1.00 0.00 C ATOM 382 CD2 PHE A 447 -3.337 -2.343 -4.098 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.544 -4.252 -2.271 1.00 0.00 C ATOM 384 CE2 PHE A 447 -4.162 -2.667 -3.037 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.764 -3.622 -2.122 1.00 0.00 C ATOM 0 H PHE A 447 -0.012 -5.014 -5.971 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.413 -3.563 -6.925 1.00 0.00 H new ATOM 0 HB2 PHE A 447 -0.180 -2.630 -5.078 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.433 -1.593 -5.729 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.770 -4.419 -3.445 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.652 -1.595 -4.810 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -2.232 -5.000 -1.558 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -5.116 -2.174 -2.924 1.00 0.00 H new ATOM 0 HZ PHE A 447 -4.406 -3.876 -1.291 1.00 0.00 H new ATOM 395 N ARG A 448 -0.150 -3.957 -8.669 1.00 0.00 N ATOM 396 CA ARG A 448 0.663 -3.606 -9.828 1.00 0.00 C ATOM 397 C ARG A 448 -0.210 -3.401 -11.062 1.00 0.00 C ATOM 398 O ARG A 448 0.004 -2.470 -11.839 1.00 0.00 O ATOM 399 CB ARG A 448 1.701 -4.696 -10.099 1.00 0.00 C ATOM 400 CG ARG A 448 2.497 -4.476 -11.375 1.00 0.00 C ATOM 401 CD ARG A 448 3.536 -3.379 -11.201 1.00 0.00 C ATOM 402 NE ARG A 448 4.363 -3.214 -12.394 1.00 0.00 N ATOM 403 CZ ARG A 448 5.504 -2.536 -12.408 1.00 0.00 C ATOM 404 NH1 ARG A 448 5.953 -1.962 -11.300 1.00 0.00 N ATOM 405 NH2 ARG A 448 6.200 -2.430 -13.533 1.00 0.00 N ATOM 0 H ARG A 448 -0.398 -4.945 -8.612 1.00 0.00 H new ATOM 0 HA ARG A 448 1.178 -2.671 -9.609 1.00 0.00 H new ATOM 0 HB2 ARG A 448 2.390 -4.748 -9.256 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.196 -5.660 -10.158 1.00 0.00 H new ATOM 0 HG2 ARG A 448 2.991 -5.404 -11.662 1.00 0.00 H new ATOM 0 HG3 ARG A 448 1.819 -4.212 -12.187 1.00 0.00 H new ATOM 0 HD2 ARG A 448 3.035 -2.438 -10.974 1.00 0.00 H new ATOM 0 HD3 ARG A 448 4.173 -3.615 -10.348 1.00 0.00 H new ATOM 0 HE ARG A 448 4.046 -3.643 -13.263 1.00 0.00 H new ATOM 0 HH11 ARG A 448 5.421 -2.041 -10.433 1.00 0.00 H new ATOM 0 HH12 ARG A 448 6.830 -1.442 -11.315 1.00 0.00 H new ATOM 0 HH21 ARG A 448 5.858 -2.870 -14.388 1.00 0.00 H new ATOM 0 HH22 ARG A 448 7.077 -1.909 -13.543 1.00 0.00 H new ATOM 419 N ARG A 449 -1.194 -4.277 -11.237 1.00 0.00 N ATOM 420 CA ARG A 449 -2.098 -4.194 -12.377 1.00 0.00 C ATOM 421 C ARG A 449 -2.623 -2.772 -12.553 1.00 0.00 C ATOM 422 O ARG A 449 -3.019 -2.376 -13.649 1.00 0.00 O ATOM 423 CB ARG A 449 -3.269 -5.162 -12.199 1.00 0.00 C ATOM 424 CG ARG A 449 -3.899 -5.109 -10.817 1.00 0.00 C ATOM 425 CD ARG A 449 -5.331 -5.618 -10.837 1.00 0.00 C ATOM 426 NE ARG A 449 -5.402 -7.062 -10.634 1.00 0.00 N ATOM 427 CZ ARG A 449 -5.270 -7.950 -11.613 1.00 0.00 C ATOM 428 NH1 ARG A 449 -5.061 -7.542 -12.858 1.00 0.00 N ATOM 429 NH2 ARG A 449 -5.346 -9.248 -11.349 1.00 0.00 N ATOM 0 H ARG A 449 -1.385 -5.053 -10.603 1.00 0.00 H new ATOM 0 HA ARG A 449 -1.539 -4.470 -13.271 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -4.031 -4.938 -12.945 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -2.923 -6.177 -12.392 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -3.309 -5.708 -10.124 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -3.881 -4.084 -10.447 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -5.906 -5.114 -10.060 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -5.793 -5.363 -11.791 1.00 0.00 H new ATOM 0 HE ARG A 449 -5.562 -7.408 -9.688 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -5.001 -6.545 -13.065 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -4.960 -8.225 -13.608 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -5.506 -9.565 -10.393 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -5.244 -9.928 -12.102 1.00 0.00 H new ATOM 443 N PHE A 450 -2.622 -2.008 -11.465 1.00 0.00 N ATOM 444 CA PHE A 450 -3.098 -0.630 -11.498 1.00 0.00 C ATOM 445 C PHE A 450 -2.048 0.295 -12.106 1.00 0.00 C ATOM 446 O PHE A 450 -2.376 1.234 -12.829 1.00 0.00 O ATOM 447 CB PHE A 450 -3.455 -0.158 -10.087 1.00 0.00 C ATOM 448 CG PHE A 450 -4.517 -0.990 -9.426 1.00 0.00 C ATOM 449 CD1 PHE A 450 -5.859 -0.704 -9.618 1.00 0.00 C ATOM 450 CD2 PHE A 450 -4.173 -2.058 -8.614 1.00 0.00 C ATOM 451 CE1 PHE A 450 -6.838 -1.467 -9.011 1.00 0.00 C ATOM 452 CE2 PHE A 450 -5.147 -2.826 -8.005 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.482 -2.530 -8.204 1.00 0.00 C ATOM 0 H PHE A 450 -2.297 -2.320 -10.550 1.00 0.00 H new ATOM 0 HA PHE A 450 -3.991 -0.595 -12.122 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.557 -0.173 -9.470 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -3.793 0.877 -10.134 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.143 0.125 -10.249 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -3.131 -2.293 -8.455 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -7.881 -1.232 -9.167 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -4.865 -3.656 -7.374 1.00 0.00 H new ATOM 0 HZ PHE A 450 -7.246 -3.129 -7.730 1.00 0.00 H new ATOM 463 N GLY A 451 -0.782 0.021 -11.806 1.00 0.00 N ATOM 464 CA GLY A 451 0.298 0.837 -12.329 1.00 0.00 C ATOM 465 C GLY A 451 1.542 0.776 -11.466 1.00 0.00 C ATOM 466 O GLY A 451 1.485 0.451 -10.280 1.00 0.00 O ATOM 0 H GLY A 451 -0.485 -0.752 -11.210 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.543 0.506 -13.338 1.00 0.00 H new ATOM 0 HA3 GLY A 451 -0.037 1.871 -12.405 1.00 0.00 H new ATOM 470 N PRO A 452 2.699 1.094 -12.065 1.00 0.00 N ATOM 471 CA PRO A 452 3.985 1.080 -11.361 1.00 0.00 C ATOM 472 C PRO A 452 3.905 1.753 -9.995 1.00 0.00 C ATOM 473 O PRO A 452 3.589 2.939 -9.893 1.00 0.00 O ATOM 474 CB PRO A 452 4.908 1.869 -12.293 1.00 0.00 C ATOM 475 CG PRO A 452 4.333 1.670 -13.653 1.00 0.00 C ATOM 476 CD PRO A 452 2.842 1.491 -13.476 1.00 0.00 C ATOM 0 HA PRO A 452 4.328 0.065 -11.158 1.00 0.00 H new ATOM 0 HB2 PRO A 452 4.933 2.925 -12.024 1.00 0.00 H new ATOM 0 HB3 PRO A 452 5.933 1.502 -12.239 1.00 0.00 H new ATOM 0 HG2 PRO A 452 4.546 2.527 -14.292 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.773 0.796 -14.134 1.00 0.00 H new ATOM 0 HD2 PRO A 452 2.301 2.413 -13.689 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.448 0.728 -14.148 1.00 0.00 H new ATOM 484 N LEU A 453 4.193 0.990 -8.947 1.00 0.00 N ATOM 485 CA LEU A 453 4.155 1.513 -7.585 1.00 0.00 C ATOM 486 C LEU A 453 5.333 0.993 -6.768 1.00 0.00 C ATOM 487 O LEU A 453 6.190 0.274 -7.283 1.00 0.00 O ATOM 488 CB LEU A 453 2.839 1.127 -6.907 1.00 0.00 C ATOM 489 CG LEU A 453 2.760 -0.297 -6.357 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.604 -0.428 -5.377 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.614 -1.300 -7.493 1.00 0.00 C ATOM 0 H LEU A 453 4.456 0.007 -9.014 1.00 0.00 H new ATOM 0 HA LEU A 453 4.225 2.599 -7.637 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.658 1.822 -6.087 1.00 0.00 H new ATOM 0 HB3 LEU A 453 2.030 1.263 -7.625 1.00 0.00 H new ATOM 0 HG LEU A 453 3.687 -0.512 -5.825 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.564 -1.448 -4.996 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.750 0.264 -4.547 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.668 -0.193 -5.884 1.00 0.00 H new ATOM 0 HD21 LEU A 453 2.559 -2.309 -7.083 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.703 -1.086 -8.053 1.00 0.00 H new ATOM 0 HD23 LEU A 453 3.475 -1.225 -8.158 1.00 0.00 H new ATOM 503 N VAL A 454 5.368 1.358 -5.491 1.00 0.00 N ATOM 504 CA VAL A 454 6.439 0.926 -4.601 1.00 0.00 C ATOM 505 C VAL A 454 5.902 0.598 -3.213 1.00 0.00 C ATOM 506 O VAL A 454 5.112 1.353 -2.646 1.00 0.00 O ATOM 507 CB VAL A 454 7.533 2.003 -4.475 1.00 0.00 C ATOM 508 CG1 VAL A 454 6.951 3.292 -3.914 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.676 1.502 -3.605 1.00 0.00 C ATOM 0 H VAL A 454 4.667 1.952 -5.049 1.00 0.00 H new ATOM 0 HA VAL A 454 6.873 0.028 -5.041 1.00 0.00 H new ATOM 0 HB VAL A 454 7.928 2.213 -5.469 1.00 0.00 H new ATOM 0 HG11 VAL A 454 7.738 4.041 -3.832 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.169 3.658 -4.580 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.528 3.101 -2.928 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.440 2.276 -3.527 1.00 0.00 H new ATOM 0 HG22 VAL A 454 8.299 1.263 -2.611 1.00 0.00 H new ATOM 0 HG23 VAL A 454 9.110 0.608 -4.053 1.00 0.00 H new ATOM 519 N VAL A 455 6.335 -0.535 -2.669 1.00 0.00 N ATOM 520 CA VAL A 455 5.899 -0.963 -1.345 1.00 0.00 C ATOM 521 C VAL A 455 6.787 -0.372 -0.256 1.00 0.00 C ATOM 522 O VAL A 455 7.986 -0.647 -0.201 1.00 0.00 O ATOM 523 CB VAL A 455 5.907 -2.499 -1.221 1.00 0.00 C ATOM 524 CG1 VAL A 455 5.365 -2.928 0.134 1.00 0.00 C ATOM 525 CG2 VAL A 455 5.103 -3.128 -2.350 1.00 0.00 C ATOM 0 H VAL A 455 6.987 -1.173 -3.125 1.00 0.00 H new ATOM 0 HA VAL A 455 4.879 -0.600 -1.215 1.00 0.00 H new ATOM 0 HB VAL A 455 6.937 -2.848 -1.300 1.00 0.00 H new ATOM 0 HG11 VAL A 455 5.378 -4.016 0.203 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.986 -2.506 0.924 1.00 0.00 H new ATOM 0 HG13 VAL A 455 4.342 -2.570 0.247 1.00 0.00 H new ATOM 0 HG21 VAL A 455 5.119 -4.213 -2.247 1.00 0.00 H new ATOM 0 HG22 VAL A 455 4.073 -2.774 -2.304 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.540 -2.848 -3.308 1.00 0.00 H new ATOM 535 N ASP A 456 6.190 0.441 0.609 1.00 0.00 N ATOM 536 CA ASP A 456 6.926 1.070 1.699 1.00 0.00 C ATOM 537 C ASP A 456 6.155 0.959 3.011 1.00 0.00 C ATOM 538 O ASP A 456 5.204 1.704 3.248 1.00 0.00 O ATOM 539 CB ASP A 456 7.199 2.540 1.377 1.00 0.00 C ATOM 540 CG ASP A 456 8.349 3.107 2.186 1.00 0.00 C ATOM 541 OD1 ASP A 456 8.270 3.076 3.431 1.00 0.00 O ATOM 542 OD2 ASP A 456 9.329 3.582 1.573 1.00 0.00 O ATOM 0 H ASP A 456 5.199 0.680 0.576 1.00 0.00 H new ATOM 0 HA ASP A 456 7.876 0.548 1.811 1.00 0.00 H new ATOM 0 HB2 ASP A 456 7.422 2.641 0.315 1.00 0.00 H new ATOM 0 HB3 ASP A 456 6.300 3.124 1.571 1.00 0.00 H new ATOM 547 N TRP A 457 6.572 0.025 3.858 1.00 0.00 N ATOM 548 CA TRP A 457 5.919 -0.184 5.146 1.00 0.00 C ATOM 549 C TRP A 457 6.704 0.485 6.269 1.00 0.00 C ATOM 550 O TRP A 457 7.910 0.709 6.168 1.00 0.00 O ATOM 551 CB TRP A 457 5.773 -1.680 5.430 1.00 0.00 C ATOM 552 CG TRP A 457 7.038 -2.453 5.206 1.00 0.00 C ATOM 553 CD1 TRP A 457 8.142 -2.467 6.009 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.328 -3.321 4.106 1.00 0.00 C ATOM 555 NE1 TRP A 457 9.102 -3.293 5.474 1.00 0.00 N ATOM 556 CE2 TRP A 457 8.626 -3.830 4.307 1.00 0.00 C ATOM 557 CE3 TRP A 457 6.617 -3.721 2.971 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.225 -4.715 3.415 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.213 -4.599 2.087 1.00 0.00 C ATOM 560 CH2 TRP A 457 8.506 -5.089 2.313 1.00 0.00 C ATOM 0 H TRP A 457 7.358 -0.599 3.677 1.00 0.00 H new ATOM 0 HA TRP A 457 4.928 0.268 5.101 1.00 0.00 H new ATOM 0 HB2 TRP A 457 5.450 -1.817 6.462 1.00 0.00 H new ATOM 0 HB3 TRP A 457 4.988 -2.089 4.793 1.00 0.00 H new ATOM 0 HD1 TRP A 457 8.246 -1.911 6.929 1.00 0.00 H new ATOM 0 HE1 TRP A 457 10.020 -3.476 5.880 1.00 0.00 H new ATOM 0 HE3 TRP A 457 5.619 -3.350 2.789 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 10.222 -5.093 3.587 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 6.673 -4.913 1.206 1.00 0.00 H new ATOM 0 HH2 TRP A 457 8.944 -5.775 1.603 1.00 0.00 H new ATOM 571 N PRO A 458 6.005 0.814 7.366 1.00 0.00 N ATOM 572 CA PRO A 458 6.618 1.462 8.530 1.00 0.00 C ATOM 573 C PRO A 458 7.540 0.522 9.298 1.00 0.00 C ATOM 574 O PRO A 458 7.319 -0.689 9.334 1.00 0.00 O ATOM 575 CB PRO A 458 5.415 1.854 9.391 1.00 0.00 C ATOM 576 CG PRO A 458 4.351 0.878 9.023 1.00 0.00 C ATOM 577 CD PRO A 458 4.564 0.577 7.555 1.00 0.00 C ATOM 0 HA PRO A 458 7.247 2.305 8.244 1.00 0.00 H new ATOM 0 HB2 PRO A 458 5.653 1.798 10.453 1.00 0.00 H new ATOM 0 HB3 PRO A 458 5.100 2.878 9.189 1.00 0.00 H new ATOM 0 HG2 PRO A 458 4.426 -0.028 9.624 1.00 0.00 H new ATOM 0 HG3 PRO A 458 3.359 1.295 9.198 1.00 0.00 H new ATOM 0 HD2 PRO A 458 4.290 -0.449 7.311 1.00 0.00 H new ATOM 0 HD3 PRO A 458 3.963 1.227 6.920 1.00 0.00 H new ATOM 585 N HIS A 459 8.575 1.086 9.912 1.00 0.00 N ATOM 586 CA HIS A 459 9.531 0.298 10.682 1.00 0.00 C ATOM 587 C HIS A 459 10.306 -0.653 9.774 1.00 0.00 C ATOM 588 O HIS A 459 10.358 -1.858 10.019 1.00 0.00 O ATOM 589 CB HIS A 459 8.809 -0.495 11.772 1.00 0.00 C ATOM 590 CG HIS A 459 8.006 0.361 12.703 1.00 0.00 C ATOM 591 ND1 HIS A 459 7.709 -0.009 13.998 1.00 0.00 N ATOM 592 CD2 HIS A 459 7.439 1.576 12.521 1.00 0.00 C ATOM 593 CE1 HIS A 459 6.993 0.941 14.571 1.00 0.00 C ATOM 594 NE2 HIS A 459 6.815 1.914 13.696 1.00 0.00 N ATOM 0 H HIS A 459 8.773 2.086 9.891 1.00 0.00 H new ATOM 0 HA HIS A 459 10.238 0.984 11.149 1.00 0.00 H new ATOM 0 HB2 HIS A 459 8.149 -1.225 11.302 1.00 0.00 H new ATOM 0 HB3 HIS A 459 9.544 -1.055 12.350 1.00 0.00 H new ATOM 0 HD2 HIS A 459 7.471 2.169 11.619 1.00 0.00 H new ATOM 0 HE1 HIS A 459 6.617 0.925 15.583 1.00 0.00 H new ATOM 0 HE2 HIS A 459 6.298 2.777 13.866 1.00 0.00 H new ATOM 602 N LYS A 460 10.908 -0.102 8.725 1.00 0.00 N ATOM 603 CA LYS A 460 11.681 -0.899 7.781 1.00 0.00 C ATOM 604 C LYS A 460 13.176 -0.776 8.060 1.00 0.00 C ATOM 605 O LYS A 460 13.852 -1.770 8.323 1.00 0.00 O ATOM 606 CB LYS A 460 11.382 -0.459 6.346 1.00 0.00 C ATOM 607 CG LYS A 460 11.959 -1.389 5.292 1.00 0.00 C ATOM 608 CD LYS A 460 12.189 -0.665 3.976 1.00 0.00 C ATOM 609 CE LYS A 460 12.076 -1.613 2.791 1.00 0.00 C ATOM 610 NZ LYS A 460 12.746 -1.067 1.579 1.00 0.00 N ATOM 0 H LYS A 460 10.875 0.894 8.508 1.00 0.00 H new ATOM 0 HA LYS A 460 11.391 -1.943 7.903 1.00 0.00 H new ATOM 0 HB2 LYS A 460 10.302 -0.397 6.212 1.00 0.00 H new ATOM 0 HB3 LYS A 460 11.781 0.544 6.192 1.00 0.00 H new ATOM 0 HG2 LYS A 460 12.901 -1.805 5.649 1.00 0.00 H new ATOM 0 HG3 LYS A 460 11.280 -2.227 5.134 1.00 0.00 H new ATOM 0 HD2 LYS A 460 11.461 0.140 3.870 1.00 0.00 H new ATOM 0 HD3 LYS A 460 13.176 -0.203 3.981 1.00 0.00 H new ATOM 0 HE2 LYS A 460 12.521 -2.574 3.051 1.00 0.00 H new ATOM 0 HE3 LYS A 460 11.024 -1.798 2.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 12.647 -1.742 0.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 12.305 -0.163 1.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 13.755 -0.915 1.779 1.00 0.00 H new ATOM 624 N ALA A 461 13.684 0.451 8.003 1.00 0.00 N ATOM 625 CA ALA A 461 15.098 0.704 8.254 1.00 0.00 C ATOM 626 C ALA A 461 15.632 -0.207 9.354 1.00 0.00 C ATOM 627 O ALA A 461 16.596 -0.943 9.149 1.00 0.00 O ATOM 628 CB ALA A 461 15.315 2.164 8.623 1.00 0.00 C ATOM 0 H ALA A 461 13.138 1.285 7.785 1.00 0.00 H new ATOM 0 HA ALA A 461 15.649 0.486 7.339 1.00 0.00 H new ATOM 0 HB1 ALA A 461 16.375 2.339 8.808 1.00 0.00 H new ATOM 0 HB2 ALA A 461 14.980 2.800 7.804 1.00 0.00 H new ATOM 0 HB3 ALA A 461 14.746 2.400 9.522 1.00 0.00 H new ATOM 634 N GLU A 462 14.999 -0.151 10.522 1.00 0.00 N ATOM 635 CA GLU A 462 15.413 -0.971 11.654 1.00 0.00 C ATOM 636 C GLU A 462 15.323 -2.455 11.313 1.00 0.00 C ATOM 637 O GLU A 462 16.271 -3.211 11.527 1.00 0.00 O ATOM 638 CB GLU A 462 14.547 -0.664 12.878 1.00 0.00 C ATOM 639 CG GLU A 462 14.865 0.671 13.530 1.00 0.00 C ATOM 640 CD GLU A 462 16.353 0.885 13.726 1.00 0.00 C ATOM 641 OE1 GLU A 462 17.019 1.335 12.771 1.00 0.00 O ATOM 642 OE2 GLU A 462 16.851 0.601 14.835 1.00 0.00 O ATOM 0 H GLU A 462 14.199 0.453 10.709 1.00 0.00 H new ATOM 0 HA GLU A 462 16.451 -0.731 11.883 1.00 0.00 H new ATOM 0 HB2 GLU A 462 13.498 -0.673 12.582 1.00 0.00 H new ATOM 0 HB3 GLU A 462 14.678 -1.458 13.613 1.00 0.00 H new ATOM 0 HG2 GLU A 462 14.464 1.476 12.915 1.00 0.00 H new ATOM 0 HG3 GLU A 462 14.363 0.728 14.496 1.00 0.00 H new ATOM 649 N SER A 463 14.176 -2.866 10.782 1.00 0.00 N ATOM 650 CA SER A 463 13.960 -4.261 10.415 1.00 0.00 C ATOM 651 C SER A 463 14.613 -4.577 9.073 1.00 0.00 C ATOM 652 O SER A 463 13.964 -4.536 8.028 1.00 0.00 O ATOM 653 CB SER A 463 12.462 -4.567 10.350 1.00 0.00 C ATOM 654 OG SER A 463 11.902 -4.648 11.649 1.00 0.00 O ATOM 0 H SER A 463 13.382 -2.253 10.596 1.00 0.00 H new ATOM 0 HA SER A 463 14.419 -4.887 11.180 1.00 0.00 H new ATOM 0 HB2 SER A 463 11.953 -3.790 9.779 1.00 0.00 H new ATOM 0 HB3 SER A 463 12.302 -5.507 9.822 1.00 0.00 H new ATOM 0 HG SER A 463 10.944 -4.843 11.581 1.00 0.00 H new ATOM 660 N LYS A 464 15.903 -4.893 9.110 1.00 0.00 N ATOM 661 CA LYS A 464 16.648 -5.218 7.899 1.00 0.00 C ATOM 662 C LYS A 464 16.138 -6.515 7.279 1.00 0.00 C ATOM 663 O LYS A 464 16.754 -7.570 7.430 1.00 0.00 O ATOM 664 CB LYS A 464 18.141 -5.341 8.211 1.00 0.00 C ATOM 665 CG LYS A 464 19.016 -5.417 6.972 1.00 0.00 C ATOM 666 CD LYS A 464 20.492 -5.432 7.333 1.00 0.00 C ATOM 667 CE LYS A 464 20.927 -6.797 7.845 1.00 0.00 C ATOM 668 NZ LYS A 464 22.410 -6.916 7.918 1.00 0.00 N ATOM 0 H LYS A 464 16.455 -4.931 9.967 1.00 0.00 H new ATOM 0 HA LYS A 464 16.499 -4.410 7.183 1.00 0.00 H new ATOM 0 HB2 LYS A 464 18.450 -4.486 8.812 1.00 0.00 H new ATOM 0 HB3 LYS A 464 18.305 -6.232 8.817 1.00 0.00 H new ATOM 0 HG2 LYS A 464 18.770 -6.315 6.406 1.00 0.00 H new ATOM 0 HG3 LYS A 464 18.807 -4.565 6.325 1.00 0.00 H new ATOM 0 HD2 LYS A 464 21.084 -5.165 6.458 1.00 0.00 H new ATOM 0 HD3 LYS A 464 20.689 -4.677 8.094 1.00 0.00 H new ATOM 0 HE2 LYS A 464 20.500 -6.967 8.833 1.00 0.00 H new ATOM 0 HE3 LYS A 464 20.532 -7.573 7.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 22.666 -7.860 8.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 22.816 -6.779 6.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 22.785 -6.192 8.563 1.00 0.00 H new ATOM 682 N SER A 465 15.011 -6.428 6.580 1.00 0.00 N ATOM 683 CA SER A 465 14.417 -7.596 5.939 1.00 0.00 C ATOM 684 C SER A 465 13.291 -7.184 4.995 1.00 0.00 C ATOM 685 O SER A 465 12.727 -6.097 5.121 1.00 0.00 O ATOM 686 CB SER A 465 13.885 -8.568 6.994 1.00 0.00 C ATOM 687 OG SER A 465 13.899 -9.900 6.513 1.00 0.00 O ATOM 0 H SER A 465 14.491 -5.561 6.443 1.00 0.00 H new ATOM 0 HA SER A 465 15.192 -8.093 5.356 1.00 0.00 H new ATOM 0 HB2 SER A 465 14.492 -8.498 7.897 1.00 0.00 H new ATOM 0 HB3 SER A 465 12.868 -8.289 7.271 1.00 0.00 H new ATOM 0 HG SER A 465 13.556 -10.502 7.206 1.00 0.00 H new ATOM 693 N TYR A 466 12.970 -8.060 4.050 1.00 0.00 N ATOM 694 CA TYR A 466 11.914 -7.788 3.083 1.00 0.00 C ATOM 695 C TYR A 466 10.559 -8.252 3.611 1.00 0.00 C ATOM 696 O TYR A 466 9.736 -8.781 2.863 1.00 0.00 O ATOM 697 CB TYR A 466 12.220 -8.480 1.754 1.00 0.00 C ATOM 698 CG TYR A 466 12.414 -9.974 1.880 1.00 0.00 C ATOM 699 CD1 TYR A 466 13.661 -10.510 2.176 1.00 0.00 C ATOM 700 CD2 TYR A 466 11.350 -10.850 1.703 1.00 0.00 C ATOM 701 CE1 TYR A 466 13.843 -11.875 2.291 1.00 0.00 C ATOM 702 CE2 TYR A 466 11.523 -12.216 1.818 1.00 0.00 C ATOM 703 CZ TYR A 466 12.771 -12.724 2.111 1.00 0.00 C ATOM 704 OH TYR A 466 12.948 -14.083 2.227 1.00 0.00 O ATOM 0 H TYR A 466 13.426 -8.965 3.933 1.00 0.00 H new ATOM 0 HA TYR A 466 11.872 -6.711 2.923 1.00 0.00 H new ATOM 0 HB2 TYR A 466 11.405 -8.285 1.057 1.00 0.00 H new ATOM 0 HB3 TYR A 466 13.120 -8.040 1.324 1.00 0.00 H new ATOM 0 HD1 TYR A 466 14.503 -9.848 2.319 1.00 0.00 H new ATOM 0 HD2 TYR A 466 10.371 -10.456 1.472 1.00 0.00 H new ATOM 0 HE1 TYR A 466 14.820 -12.275 2.521 1.00 0.00 H new ATOM 0 HE2 TYR A 466 10.685 -12.883 1.679 1.00 0.00 H new ATOM 0 HH TYR A 466 12.094 -14.538 2.072 1.00 0.00 H new ATOM 714 N PHE A 467 10.335 -8.049 4.905 1.00 0.00 N ATOM 715 CA PHE A 467 9.081 -8.446 5.535 1.00 0.00 C ATOM 716 C PHE A 467 8.382 -7.243 6.160 1.00 0.00 C ATOM 717 O PHE A 467 8.961 -6.500 6.953 1.00 0.00 O ATOM 718 CB PHE A 467 9.337 -9.514 6.601 1.00 0.00 C ATOM 719 CG PHE A 467 9.269 -10.918 6.072 1.00 0.00 C ATOM 720 CD1 PHE A 467 10.195 -11.368 5.145 1.00 0.00 C ATOM 721 CD2 PHE A 467 8.279 -11.787 6.502 1.00 0.00 C ATOM 722 CE1 PHE A 467 10.135 -12.660 4.656 1.00 0.00 C ATOM 723 CE2 PHE A 467 8.215 -13.080 6.018 1.00 0.00 C ATOM 724 CZ PHE A 467 9.143 -13.516 5.093 1.00 0.00 C ATOM 0 H PHE A 467 11.005 -7.612 5.538 1.00 0.00 H new ATOM 0 HA PHE A 467 8.431 -8.861 4.765 1.00 0.00 H new ATOM 0 HB2 PHE A 467 10.320 -9.348 7.042 1.00 0.00 H new ATOM 0 HB3 PHE A 467 8.606 -9.400 7.401 1.00 0.00 H new ATOM 0 HD1 PHE A 467 10.972 -10.702 4.800 1.00 0.00 H new ATOM 0 HD2 PHE A 467 7.549 -11.450 7.223 1.00 0.00 H new ATOM 0 HE1 PHE A 467 10.863 -12.999 3.934 1.00 0.00 H new ATOM 0 HE2 PHE A 467 7.440 -13.749 6.363 1.00 0.00 H new ATOM 0 HZ PHE A 467 9.093 -14.525 4.712 1.00 0.00 H new ATOM 734 N PRO A 468 7.106 -7.045 5.797 1.00 0.00 N ATOM 735 CA PRO A 468 6.300 -5.934 6.310 1.00 0.00 C ATOM 736 C PRO A 468 5.788 -6.193 7.723 1.00 0.00 C ATOM 737 O PRO A 468 5.726 -7.332 8.187 1.00 0.00 O ATOM 738 CB PRO A 468 5.132 -5.858 5.324 1.00 0.00 C ATOM 739 CG PRO A 468 4.986 -7.246 4.802 1.00 0.00 C ATOM 740 CD PRO A 468 6.353 -7.892 4.856 1.00 0.00 C ATOM 0 HA PRO A 468 6.876 -5.012 6.381 1.00 0.00 H new ATOM 0 HB2 PRO A 468 4.219 -5.522 5.816 1.00 0.00 H new ATOM 0 HB3 PRO A 468 5.338 -5.152 4.519 1.00 0.00 H new ATOM 0 HG2 PRO A 468 4.271 -7.809 5.402 1.00 0.00 H new ATOM 0 HG3 PRO A 468 4.606 -7.235 3.780 1.00 0.00 H new ATOM 0 HD2 PRO A 468 6.295 -8.923 5.205 1.00 0.00 H new ATOM 0 HD3 PRO A 468 6.824 -7.914 3.873 1.00 0.00 H new ATOM 748 N PRO A 469 5.413 -5.114 8.425 1.00 0.00 N ATOM 749 CA PRO A 469 4.899 -5.200 9.795 1.00 0.00 C ATOM 750 C PRO A 469 3.852 -6.297 9.954 1.00 0.00 C ATOM 751 O PRO A 469 3.494 -6.973 8.989 1.00 0.00 O ATOM 752 CB PRO A 469 4.269 -3.823 10.024 1.00 0.00 C ATOM 753 CG PRO A 469 5.028 -2.906 9.128 1.00 0.00 C ATOM 754 CD PRO A 469 5.460 -3.726 7.934 1.00 0.00 C ATOM 0 HA PRO A 469 5.683 -5.450 10.509 1.00 0.00 H new ATOM 0 HB2 PRO A 469 3.207 -3.828 9.778 1.00 0.00 H new ATOM 0 HB3 PRO A 469 4.353 -3.517 11.067 1.00 0.00 H new ATOM 0 HG2 PRO A 469 4.406 -2.067 8.817 1.00 0.00 H new ATOM 0 HG3 PRO A 469 5.892 -2.488 9.644 1.00 0.00 H new ATOM 0 HD2 PRO A 469 4.792 -3.579 7.085 1.00 0.00 H new ATOM 0 HD3 PRO A 469 6.462 -3.453 7.602 1.00 0.00 H new ATOM 762 N LYS A 470 3.363 -6.469 11.177 1.00 0.00 N ATOM 763 CA LYS A 470 2.355 -7.483 11.463 1.00 0.00 C ATOM 764 C LYS A 470 1.410 -7.660 10.279 1.00 0.00 C ATOM 765 O LYS A 470 1.158 -8.780 9.835 1.00 0.00 O ATOM 766 CB LYS A 470 1.558 -7.102 12.713 1.00 0.00 C ATOM 767 CG LYS A 470 2.252 -7.472 14.012 1.00 0.00 C ATOM 768 CD LYS A 470 1.438 -7.040 15.221 1.00 0.00 C ATOM 769 CE LYS A 470 2.170 -7.337 16.521 1.00 0.00 C ATOM 770 NZ LYS A 470 1.344 -6.998 17.713 1.00 0.00 N ATOM 0 H LYS A 470 3.649 -5.919 11.987 1.00 0.00 H new ATOM 0 HA LYS A 470 2.867 -8.428 11.641 1.00 0.00 H new ATOM 0 HB2 LYS A 470 1.373 -6.028 12.703 1.00 0.00 H new ATOM 0 HB3 LYS A 470 0.586 -7.593 12.678 1.00 0.00 H new ATOM 0 HG2 LYS A 470 2.412 -8.550 14.046 1.00 0.00 H new ATOM 0 HG3 LYS A 470 3.235 -7.002 14.047 1.00 0.00 H new ATOM 0 HD2 LYS A 470 1.227 -5.972 15.157 1.00 0.00 H new ATOM 0 HD3 LYS A 470 0.477 -7.555 15.217 1.00 0.00 H new ATOM 0 HE2 LYS A 470 2.438 -8.393 16.554 1.00 0.00 H new ATOM 0 HE3 LYS A 470 3.101 -6.771 16.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 1.878 -7.215 18.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 1.109 -5.985 17.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 0.467 -7.557 17.698 1.00 0.00 H new ATOM 784 N GLY A 471 0.890 -6.547 9.770 1.00 0.00 N ATOM 785 CA GLY A 471 -0.020 -6.602 8.642 1.00 0.00 C ATOM 786 C GLY A 471 -0.514 -5.229 8.228 1.00 0.00 C ATOM 787 O GLY A 471 -1.690 -4.908 8.399 1.00 0.00 O ATOM 0 H GLY A 471 1.083 -5.608 10.119 1.00 0.00 H new ATOM 0 HA2 GLY A 471 0.481 -7.074 7.797 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -0.873 -7.230 8.898 1.00 0.00 H new ATOM 791 N TYR A 472 0.387 -4.418 7.684 1.00 0.00 N ATOM 792 CA TYR A 472 0.037 -3.071 7.249 1.00 0.00 C ATOM 793 C TYR A 472 1.218 -2.399 6.555 1.00 0.00 C ATOM 794 O TYR A 472 2.343 -2.428 7.052 1.00 0.00 O ATOM 795 CB TYR A 472 -0.414 -2.227 8.443 1.00 0.00 C ATOM 796 CG TYR A 472 0.577 -2.215 9.585 1.00 0.00 C ATOM 797 CD1 TYR A 472 0.657 -3.281 10.473 1.00 0.00 C ATOM 798 CD2 TYR A 472 1.435 -1.138 9.775 1.00 0.00 C ATOM 799 CE1 TYR A 472 1.561 -3.273 11.518 1.00 0.00 C ATOM 800 CE2 TYR A 472 2.342 -1.123 10.816 1.00 0.00 C ATOM 801 CZ TYR A 472 2.401 -2.193 11.685 1.00 0.00 C ATOM 802 OH TYR A 472 3.304 -2.182 12.724 1.00 0.00 O ATOM 0 H TYR A 472 1.364 -4.670 7.534 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.784 -3.149 6.537 1.00 0.00 H new ATOM 0 HB2 TYR A 472 -0.584 -1.203 8.110 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -1.369 -2.607 8.806 1.00 0.00 H new ATOM 0 HD1 TYR A 472 0.002 -4.130 10.344 1.00 0.00 H new ATOM 0 HD2 TYR A 472 1.391 -0.299 9.097 1.00 0.00 H new ATOM 0 HE1 TYR A 472 1.609 -4.109 12.200 1.00 0.00 H new ATOM 0 HE2 TYR A 472 3.002 -0.278 10.949 1.00 0.00 H new ATOM 0 HH TYR A 472 3.821 -1.350 12.699 1.00 0.00 H new ATOM 812 N ALA A 473 0.951 -1.794 5.402 1.00 0.00 N ATOM 813 CA ALA A 473 1.990 -1.112 4.639 1.00 0.00 C ATOM 814 C ALA A 473 1.424 0.095 3.899 1.00 0.00 C ATOM 815 O ALA A 473 0.211 0.301 3.863 1.00 0.00 O ATOM 816 CB ALA A 473 2.644 -2.076 3.660 1.00 0.00 C ATOM 0 H ALA A 473 0.025 -1.762 4.976 1.00 0.00 H new ATOM 0 HA ALA A 473 2.745 -0.754 5.339 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.418 -1.554 3.097 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.092 -2.904 4.209 1.00 0.00 H new ATOM 0 HB3 ALA A 473 1.892 -2.461 2.972 1.00 0.00 H new ATOM 822 N PHE A 474 2.310 0.890 3.310 1.00 0.00 N ATOM 823 CA PHE A 474 1.899 2.079 2.571 1.00 0.00 C ATOM 824 C PHE A 474 2.353 1.999 1.116 1.00 0.00 C ATOM 825 O PHE A 474 3.547 1.902 0.831 1.00 0.00 O ATOM 826 CB PHE A 474 2.472 3.337 3.227 1.00 0.00 C ATOM 827 CG PHE A 474 1.876 3.635 4.573 1.00 0.00 C ATOM 828 CD1 PHE A 474 0.615 4.200 4.678 1.00 0.00 C ATOM 829 CD2 PHE A 474 2.576 3.349 5.734 1.00 0.00 C ATOM 830 CE1 PHE A 474 0.065 4.475 5.916 1.00 0.00 C ATOM 831 CE2 PHE A 474 2.031 3.622 6.975 1.00 0.00 C ATOM 832 CZ PHE A 474 0.773 4.185 7.065 1.00 0.00 C ATOM 0 H PHE A 474 3.318 0.733 3.330 1.00 0.00 H new ATOM 0 HA PHE A 474 0.810 2.131 2.592 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.551 3.223 3.333 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.305 4.189 2.568 1.00 0.00 H new ATOM 0 HD1 PHE A 474 0.056 4.428 3.783 1.00 0.00 H new ATOM 0 HD2 PHE A 474 3.559 2.907 5.669 1.00 0.00 H new ATOM 0 HE1 PHE A 474 -0.918 4.917 5.984 1.00 0.00 H new ATOM 0 HE2 PHE A 474 2.588 3.395 7.872 1.00 0.00 H new ATOM 0 HZ PHE A 474 0.344 4.398 8.033 1.00 0.00 H new ATOM 842 N LEU A 475 1.392 2.040 0.200 1.00 0.00 N ATOM 843 CA LEU A 475 1.691 1.972 -1.226 1.00 0.00 C ATOM 844 C LEU A 475 1.843 3.370 -1.818 1.00 0.00 C ATOM 845 O LEU A 475 0.952 4.211 -1.688 1.00 0.00 O ATOM 846 CB LEU A 475 0.587 1.211 -1.963 1.00 0.00 C ATOM 847 CG LEU A 475 0.310 -0.211 -1.474 1.00 0.00 C ATOM 848 CD1 LEU A 475 -0.912 -0.787 -2.171 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.524 -1.099 -1.702 1.00 0.00 C ATOM 0 H LEU A 475 0.399 2.120 0.419 1.00 0.00 H new ATOM 0 HA LEU A 475 2.635 1.441 -1.349 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.336 1.786 -1.887 1.00 0.00 H new ATOM 0 HB3 LEU A 475 0.848 1.166 -3.020 1.00 0.00 H new ATOM 0 HG LEU A 475 0.108 -0.173 -0.404 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -1.093 -1.799 -1.810 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.781 -0.164 -1.956 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.740 -0.811 -3.247 1.00 0.00 H new ATOM 0 HD21 LEU A 475 1.309 -2.107 -1.348 1.00 0.00 H new ATOM 0 HD22 LEU A 475 1.757 -1.130 -2.766 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.377 -0.697 -1.155 1.00 0.00 H new ATOM 861 N LEU A 476 2.975 3.610 -2.469 1.00 0.00 N ATOM 862 CA LEU A 476 3.243 4.906 -3.084 1.00 0.00 C ATOM 863 C LEU A 476 3.219 4.802 -4.606 1.00 0.00 C ATOM 864 O LEU A 476 4.266 4.783 -5.254 1.00 0.00 O ATOM 865 CB LEU A 476 4.599 5.442 -2.619 1.00 0.00 C ATOM 866 CG LEU A 476 4.694 5.839 -1.146 1.00 0.00 C ATOM 867 CD1 LEU A 476 6.148 5.952 -0.716 1.00 0.00 C ATOM 868 CD2 LEU A 476 3.960 7.149 -0.898 1.00 0.00 C ATOM 0 H LEU A 476 3.722 2.925 -2.585 1.00 0.00 H new ATOM 0 HA LEU A 476 2.460 5.597 -2.773 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.355 4.683 -2.820 1.00 0.00 H new ATOM 0 HB3 LEU A 476 4.851 6.312 -3.226 1.00 0.00 H new ATOM 0 HG LEU A 476 4.219 5.060 -0.549 1.00 0.00 H new ATOM 0 HD11 LEU A 476 6.195 6.235 0.335 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.644 4.992 -0.856 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.648 6.710 -1.319 1.00 0.00 H new ATOM 0 HD21 LEU A 476 4.038 7.416 0.156 1.00 0.00 H new ATOM 0 HD22 LEU A 476 4.406 7.936 -1.506 1.00 0.00 H new ATOM 0 HD23 LEU A 476 2.910 7.034 -1.166 1.00 0.00 H new ATOM 880 N PHE A 477 2.018 4.738 -5.170 1.00 0.00 N ATOM 881 CA PHE A 477 1.857 4.638 -6.616 1.00 0.00 C ATOM 882 C PHE A 477 2.639 5.738 -7.328 1.00 0.00 C ATOM 883 O PHE A 477 2.815 6.833 -6.794 1.00 0.00 O ATOM 884 CB PHE A 477 0.377 4.723 -6.993 1.00 0.00 C ATOM 885 CG PHE A 477 -0.400 3.482 -6.656 1.00 0.00 C ATOM 886 CD1 PHE A 477 -0.992 3.336 -5.412 1.00 0.00 C ATOM 887 CD2 PHE A 477 -0.538 2.462 -7.584 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.708 2.196 -5.099 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.253 1.320 -7.277 1.00 0.00 C ATOM 890 CZ PHE A 477 -1.838 1.186 -6.032 1.00 0.00 C ATOM 0 H PHE A 477 1.142 4.754 -4.648 1.00 0.00 H new ATOM 0 HA PHE A 477 2.251 3.673 -6.934 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.072 5.574 -6.480 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.293 4.915 -8.063 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -0.893 4.122 -4.678 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -0.082 2.561 -8.558 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -2.165 2.095 -4.126 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -1.355 0.533 -8.009 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.396 0.293 -5.789 1.00 0.00 H new ATOM 900 N GLN A 478 3.106 5.437 -8.535 1.00 0.00 N ATOM 901 CA GLN A 478 3.871 6.400 -9.320 1.00 0.00 C ATOM 902 C GLN A 478 2.953 7.448 -9.939 1.00 0.00 C ATOM 903 O GLN A 478 3.060 8.636 -9.637 1.00 0.00 O ATOM 904 CB GLN A 478 4.660 5.683 -10.417 1.00 0.00 C ATOM 905 CG GLN A 478 5.965 5.075 -9.929 1.00 0.00 C ATOM 906 CD GLN A 478 6.821 6.065 -9.166 1.00 0.00 C ATOM 907 OE1 GLN A 478 6.752 7.273 -9.399 1.00 0.00 O ATOM 908 NE2 GLN A 478 7.636 5.559 -8.248 1.00 0.00 N ATOM 0 H GLN A 478 2.969 4.535 -8.991 1.00 0.00 H new ATOM 0 HA GLN A 478 4.569 6.904 -8.651 1.00 0.00 H new ATOM 0 HB2 GLN A 478 4.039 4.895 -10.844 1.00 0.00 H new ATOM 0 HB3 GLN A 478 4.875 6.389 -11.219 1.00 0.00 H new ATOM 0 HG2 GLN A 478 5.746 4.221 -9.288 1.00 0.00 H new ATOM 0 HG3 GLN A 478 6.527 4.697 -10.783 1.00 0.00 H new ATOM 0 HE21 GLN A 478 7.661 4.552 -8.088 1.00 0.00 H new ATOM 0 HE22 GLN A 478 8.237 6.177 -7.703 1.00 0.00 H new ATOM 917 N GLU A 479 2.051 7.000 -10.807 1.00 0.00 N ATOM 918 CA GLU A 479 1.115 7.901 -11.469 1.00 0.00 C ATOM 919 C GLU A 479 -0.167 8.049 -10.655 1.00 0.00 C ATOM 920 O GLU A 479 -0.913 7.088 -10.474 1.00 0.00 O ATOM 921 CB GLU A 479 0.785 7.387 -12.872 1.00 0.00 C ATOM 922 CG GLU A 479 1.751 7.872 -13.941 1.00 0.00 C ATOM 923 CD GLU A 479 3.099 7.182 -13.864 1.00 0.00 C ATOM 924 OE1 GLU A 479 3.140 5.942 -13.998 1.00 0.00 O ATOM 925 OE2 GLU A 479 4.113 7.885 -13.670 1.00 0.00 O ATOM 0 H GLU A 479 1.949 6.019 -11.068 1.00 0.00 H new ATOM 0 HA GLU A 479 1.588 8.880 -11.550 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.787 6.297 -12.860 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.225 7.701 -13.137 1.00 0.00 H new ATOM 0 HG2 GLU A 479 1.315 7.700 -14.925 1.00 0.00 H new ATOM 0 HG3 GLU A 479 1.891 8.948 -13.838 1.00 0.00 H new ATOM 932 N GLU A 480 -0.414 9.260 -10.167 1.00 0.00 N ATOM 933 CA GLU A 480 -1.605 9.534 -9.370 1.00 0.00 C ATOM 934 C GLU A 480 -2.839 8.893 -9.999 1.00 0.00 C ATOM 935 O GLU A 480 -3.721 8.400 -9.297 1.00 0.00 O ATOM 936 CB GLU A 480 -1.816 11.043 -9.230 1.00 0.00 C ATOM 937 CG GLU A 480 -0.704 11.745 -8.468 1.00 0.00 C ATOM 938 CD GLU A 480 -0.639 13.230 -8.768 1.00 0.00 C ATOM 939 OE1 GLU A 480 -0.178 13.593 -9.869 1.00 0.00 O ATOM 940 OE2 GLU A 480 -1.050 14.028 -7.899 1.00 0.00 O ATOM 0 H GLU A 480 0.194 10.067 -10.309 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.456 9.102 -8.380 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -1.898 11.484 -10.224 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -2.763 11.223 -8.722 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -0.854 11.600 -7.398 1.00 0.00 H new ATOM 0 HG3 GLU A 480 0.251 11.285 -8.721 1.00 0.00 H new ATOM 947 N SER A 481 -2.892 8.904 -11.327 1.00 0.00 N ATOM 948 CA SER A 481 -4.019 8.328 -12.051 1.00 0.00 C ATOM 949 C SER A 481 -4.289 6.899 -11.589 1.00 0.00 C ATOM 950 O SER A 481 -5.439 6.501 -11.406 1.00 0.00 O ATOM 951 CB SER A 481 -3.748 8.346 -13.557 1.00 0.00 C ATOM 952 OG SER A 481 -3.507 9.665 -14.016 1.00 0.00 O ATOM 0 H SER A 481 -2.168 9.305 -11.923 1.00 0.00 H new ATOM 0 HA SER A 481 -4.901 8.932 -11.840 1.00 0.00 H new ATOM 0 HB2 SER A 481 -2.887 7.716 -13.782 1.00 0.00 H new ATOM 0 HB3 SER A 481 -4.601 7.923 -14.088 1.00 0.00 H new ATOM 0 HG SER A 481 -3.335 9.649 -14.981 1.00 0.00 H new ATOM 958 N SER A 482 -3.220 6.133 -11.402 1.00 0.00 N ATOM 959 CA SER A 482 -3.340 4.747 -10.965 1.00 0.00 C ATOM 960 C SER A 482 -4.124 4.655 -9.660 1.00 0.00 C ATOM 961 O SER A 482 -4.761 3.640 -9.375 1.00 0.00 O ATOM 962 CB SER A 482 -1.953 4.125 -10.785 1.00 0.00 C ATOM 963 OG SER A 482 -1.303 4.651 -9.642 1.00 0.00 O ATOM 0 H SER A 482 -2.261 6.448 -11.546 1.00 0.00 H new ATOM 0 HA SER A 482 -3.881 4.195 -11.733 1.00 0.00 H new ATOM 0 HB2 SER A 482 -2.046 3.043 -10.689 1.00 0.00 H new ATOM 0 HB3 SER A 482 -1.348 4.315 -11.671 1.00 0.00 H new ATOM 0 HG SER A 482 -1.350 5.630 -9.660 1.00 0.00 H new ATOM 969 N VAL A 483 -4.073 5.722 -8.869 1.00 0.00 N ATOM 970 CA VAL A 483 -4.779 5.764 -7.594 1.00 0.00 C ATOM 971 C VAL A 483 -6.287 5.679 -7.798 1.00 0.00 C ATOM 972 O VAL A 483 -6.965 4.873 -7.161 1.00 0.00 O ATOM 973 CB VAL A 483 -4.449 7.049 -6.812 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.223 7.091 -5.503 1.00 0.00 C ATOM 975 CG2 VAL A 483 -2.953 7.150 -6.560 1.00 0.00 C ATOM 0 H VAL A 483 -3.550 6.569 -9.089 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.444 4.901 -7.018 1.00 0.00 H new ATOM 0 HB VAL A 483 -4.751 7.907 -7.413 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -4.977 8.006 -4.964 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.293 7.069 -5.712 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -4.955 6.228 -4.894 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -2.738 8.064 -6.006 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -2.623 6.288 -5.980 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.424 7.170 -7.513 1.00 0.00 H new ATOM 985 N GLN A 484 -6.806 6.515 -8.691 1.00 0.00 N ATOM 986 CA GLN A 484 -8.236 6.534 -8.979 1.00 0.00 C ATOM 987 C GLN A 484 -8.747 5.131 -9.291 1.00 0.00 C ATOM 988 O GLN A 484 -9.682 4.646 -8.656 1.00 0.00 O ATOM 989 CB GLN A 484 -8.529 7.469 -10.154 1.00 0.00 C ATOM 990 CG GLN A 484 -10.009 7.751 -10.353 1.00 0.00 C ATOM 991 CD GLN A 484 -10.711 8.122 -9.062 1.00 0.00 C ATOM 992 OE1 GLN A 484 -10.630 9.262 -8.603 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.406 7.160 -8.467 1.00 0.00 N ATOM 0 H GLN A 484 -6.258 7.188 -9.228 1.00 0.00 H new ATOM 0 HA GLN A 484 -8.754 6.901 -8.093 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -8.006 8.412 -9.996 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -8.126 7.030 -11.066 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -10.127 8.562 -11.072 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.488 6.871 -10.783 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -11.447 6.229 -8.882 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -11.899 7.352 -7.595 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.127 4.486 -10.274 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.518 3.139 -10.669 1.00 0.00 C ATOM 1004 C ALA A 485 -8.677 2.234 -9.452 1.00 0.00 C ATOM 1005 O ALA A 485 -9.659 1.498 -9.336 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.496 2.554 -11.633 1.00 0.00 C ATOM 0 H ALA A 485 -7.352 4.875 -10.811 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.483 3.201 -11.172 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -7.801 1.548 -11.920 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.434 3.181 -12.522 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.520 2.513 -11.149 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.708 2.293 -8.546 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.740 1.478 -7.336 1.00 0.00 C ATOM 1014 C LEU A 486 -9.028 1.715 -6.554 1.00 0.00 C ATOM 1015 O LEU A 486 -9.819 0.794 -6.347 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.530 1.790 -6.454 1.00 0.00 C ATOM 1017 CG LEU A 486 -6.295 0.844 -5.277 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.841 -0.521 -5.771 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -5.273 1.432 -4.315 1.00 0.00 C ATOM 0 H LEU A 486 -6.890 2.897 -8.626 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.704 0.430 -7.633 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.638 1.786 -7.081 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -6.641 2.802 -6.064 1.00 0.00 H new ATOM 0 HG LEU A 486 -7.237 0.719 -4.743 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.679 -1.181 -4.919 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.607 -0.947 -6.419 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -4.911 -0.415 -6.330 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -5.119 0.745 -3.483 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.329 1.588 -4.837 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -5.638 2.386 -3.934 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.233 2.956 -6.124 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.426 3.314 -5.368 1.00 0.00 C ATOM 1033 C ILE A 487 -11.672 2.676 -5.972 1.00 0.00 C ATOM 1034 O ILE A 487 -12.380 1.920 -5.306 1.00 0.00 O ATOM 1035 CB ILE A 487 -10.621 4.841 -5.314 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.417 5.507 -4.644 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -11.904 5.186 -4.573 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.360 7.004 -4.855 1.00 0.00 C ATOM 0 H ILE A 487 -8.588 3.730 -6.287 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.282 2.937 -4.355 1.00 0.00 H new ATOM 0 HB ILE A 487 -10.701 5.218 -6.333 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.446 5.300 -3.574 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.502 5.059 -5.031 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -12.027 6.269 -4.544 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -12.754 4.738 -5.088 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -11.852 4.799 -3.555 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -8.482 7.409 -4.353 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -9.299 7.219 -5.922 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -10.258 7.464 -4.443 1.00 0.00 H new ATOM 1050 N ASP A 488 -11.933 2.983 -7.238 1.00 0.00 N ATOM 1051 CA ASP A 488 -13.093 2.437 -7.934 1.00 0.00 C ATOM 1052 C ASP A 488 -13.157 0.921 -7.776 1.00 0.00 C ATOM 1053 O ASP A 488 -14.225 0.355 -7.548 1.00 0.00 O ATOM 1054 CB ASP A 488 -13.044 2.806 -9.417 1.00 0.00 C ATOM 1055 CG ASP A 488 -14.418 2.812 -10.057 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -15.219 1.904 -9.751 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -14.693 3.724 -10.866 1.00 0.00 O ATOM 0 H ASP A 488 -11.357 3.607 -7.803 1.00 0.00 H new ATOM 0 HA ASP A 488 -13.990 2.869 -7.490 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -12.590 3.791 -9.529 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -12.404 2.098 -9.944 1.00 0.00 H new ATOM 1062 N ALA A 489 -12.005 0.269 -7.900 1.00 0.00 N ATOM 1063 CA ALA A 489 -11.930 -1.181 -7.770 1.00 0.00 C ATOM 1064 C ALA A 489 -12.215 -1.619 -6.337 1.00 0.00 C ATOM 1065 O ALA A 489 -12.845 -2.652 -6.108 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.564 -1.681 -8.215 1.00 0.00 C ATOM 0 H ALA A 489 -11.111 0.722 -8.090 1.00 0.00 H new ATOM 0 HA ALA A 489 -12.692 -1.619 -8.415 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -10.522 -2.765 -8.112 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.399 -1.408 -9.257 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -9.791 -1.228 -7.594 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.746 -0.829 -5.378 1.00 0.00 N ATOM 1073 CA CYS A 490 -11.949 -1.137 -3.967 1.00 0.00 C ATOM 1074 C CYS A 490 -13.427 -1.049 -3.598 1.00 0.00 C ATOM 1075 O CYS A 490 -14.020 0.030 -3.621 1.00 0.00 O ATOM 1076 CB CYS A 490 -11.136 -0.182 -3.093 1.00 0.00 C ATOM 1077 SG CYS A 490 -9.376 -0.124 -3.503 1.00 0.00 S ATOM 0 H CYS A 490 -11.223 0.029 -5.551 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.609 -2.158 -3.791 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -11.553 0.821 -3.185 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -11.246 -0.479 -2.050 1.00 0.00 H new ATOM 0 HG CYS A 490 -9.234 0.092 -4.777 1.00 0.00 H new ATOM 1083 N LEU A 491 -14.016 -2.191 -3.261 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.425 -2.244 -2.889 1.00 0.00 C ATOM 1085 C LEU A 491 -15.722 -1.285 -1.741 1.00 0.00 C ATOM 1086 O LEU A 491 -14.840 -0.559 -1.283 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.815 -3.669 -2.492 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.477 -4.765 -3.504 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.452 -6.127 -2.828 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -16.475 -4.755 -4.653 1.00 0.00 C ATOM 0 H LEU A 491 -13.540 -3.093 -3.238 1.00 0.00 H new ATOM 0 HA LEU A 491 -16.015 -1.940 -3.754 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -15.324 -3.909 -1.549 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.889 -3.692 -2.307 1.00 0.00 H new ATOM 0 HG LEU A 491 -14.485 -4.566 -3.909 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -15.210 -6.894 -3.564 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -14.698 -6.129 -2.041 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -16.430 -6.336 -2.394 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -16.220 -5.541 -5.364 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -17.479 -4.929 -4.265 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -16.443 -3.788 -5.155 1.00 0.00 H new ATOM 1102 N GLU A 492 -16.969 -1.289 -1.281 1.00 0.00 N ATOM 1103 CA GLU A 492 -17.381 -0.419 -0.185 1.00 0.00 C ATOM 1104 C GLU A 492 -18.408 -1.114 0.705 1.00 0.00 C ATOM 1105 O GLU A 492 -19.310 -1.793 0.215 1.00 0.00 O ATOM 1106 CB GLU A 492 -17.964 0.886 -0.731 1.00 0.00 C ATOM 1107 CG GLU A 492 -18.190 1.944 0.335 1.00 0.00 C ATOM 1108 CD GLU A 492 -18.267 3.345 -0.241 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -18.833 3.504 -1.343 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -17.759 4.282 0.410 1.00 0.00 O ATOM 0 H GLU A 492 -17.711 -1.884 -1.650 1.00 0.00 H new ATOM 0 HA GLU A 492 -16.500 -0.192 0.415 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -17.291 1.285 -1.490 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -18.912 0.672 -1.225 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -19.114 1.724 0.870 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -17.381 1.899 1.064 1.00 0.00 H new ATOM 1117 N GLU A 493 -18.262 -0.940 2.015 1.00 0.00 N ATOM 1118 CA GLU A 493 -19.175 -1.551 2.973 1.00 0.00 C ATOM 1119 C GLU A 493 -19.911 -0.485 3.780 1.00 0.00 C ATOM 1120 O GLU A 493 -21.094 -0.229 3.556 1.00 0.00 O ATOM 1121 CB GLU A 493 -18.412 -2.484 3.915 1.00 0.00 C ATOM 1122 CG GLU A 493 -19.309 -3.245 4.877 1.00 0.00 C ATOM 1123 CD GLU A 493 -19.913 -4.488 4.252 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -19.311 -5.025 3.299 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -20.987 -4.923 4.717 1.00 0.00 O ATOM 0 H GLU A 493 -17.520 -0.381 2.437 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.910 -2.132 2.416 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -17.841 -3.198 3.322 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -17.693 -1.899 4.488 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -18.733 -3.529 5.758 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -20.110 -2.589 5.218 1.00 0.00 H new ATOM 1132 N ASP A 494 -19.202 0.132 4.719 1.00 0.00 N ATOM 1133 CA ASP A 494 -19.786 1.170 5.559 1.00 0.00 C ATOM 1134 C ASP A 494 -18.962 2.452 5.491 1.00 0.00 C ATOM 1135 O ASP A 494 -18.298 2.828 6.456 1.00 0.00 O ATOM 1136 CB ASP A 494 -19.883 0.689 7.008 1.00 0.00 C ATOM 1137 CG ASP A 494 -20.330 1.786 7.954 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -21.052 2.700 7.504 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -19.959 1.730 9.145 1.00 0.00 O ATOM 0 H ASP A 494 -18.222 -0.069 4.917 1.00 0.00 H new ATOM 0 HA ASP A 494 -20.788 1.383 5.186 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -20.584 -0.144 7.065 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -18.912 0.311 7.328 1.00 0.00 H new ATOM 1144 N GLY A 495 -19.009 3.119 4.341 1.00 0.00 N ATOM 1145 CA GLY A 495 -18.261 4.351 4.168 1.00 0.00 C ATOM 1146 C GLY A 495 -16.810 4.103 3.806 1.00 0.00 C ATOM 1147 O GLY A 495 -16.184 4.916 3.125 1.00 0.00 O ATOM 0 H GLY A 495 -19.551 2.828 3.527 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -18.730 4.950 3.387 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -18.308 4.933 5.088 1.00 0.00 H new ATOM 1151 N LYS A 496 -16.273 2.977 4.262 1.00 0.00 N ATOM 1152 CA LYS A 496 -14.886 2.622 3.983 1.00 0.00 C ATOM 1153 C LYS A 496 -14.798 1.648 2.813 1.00 0.00 C ATOM 1154 O LYS A 496 -15.746 0.914 2.530 1.00 0.00 O ATOM 1155 CB LYS A 496 -14.236 2.005 5.224 1.00 0.00 C ATOM 1156 CG LYS A 496 -13.922 3.017 6.313 1.00 0.00 C ATOM 1157 CD LYS A 496 -13.779 2.349 7.670 1.00 0.00 C ATOM 1158 CE LYS A 496 -14.192 3.283 8.797 1.00 0.00 C ATOM 1159 NZ LYS A 496 -13.140 4.296 9.090 1.00 0.00 N ATOM 0 H LYS A 496 -16.777 2.294 4.827 1.00 0.00 H new ATOM 0 HA LYS A 496 -14.351 3.533 3.715 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -14.900 1.241 5.630 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -13.314 1.503 4.930 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -13.000 3.544 6.067 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -14.714 3.764 6.356 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -14.392 1.448 7.700 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -12.745 2.036 7.816 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -15.119 3.789 8.528 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -14.396 2.700 9.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -13.459 4.914 9.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -12.262 3.814 9.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -12.963 4.869 8.240 1.00 0.00 H new ATOM 1173 N LEU A 497 -13.655 1.645 2.136 1.00 0.00 N ATOM 1174 CA LEU A 497 -13.443 0.759 0.997 1.00 0.00 C ATOM 1175 C LEU A 497 -12.733 -0.521 1.427 1.00 0.00 C ATOM 1176 O LEU A 497 -12.265 -0.632 2.560 1.00 0.00 O ATOM 1177 CB LEU A 497 -12.626 1.471 -0.083 1.00 0.00 C ATOM 1178 CG LEU A 497 -13.182 2.809 -0.572 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -12.113 3.589 -1.322 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -14.402 2.589 -1.455 1.00 0.00 C ATOM 0 H LEU A 497 -12.861 2.246 2.356 1.00 0.00 H new ATOM 0 HA LEU A 497 -14.418 0.492 0.590 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -11.620 1.637 0.301 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -12.534 0.804 -0.940 1.00 0.00 H new ATOM 0 HG LEU A 497 -13.487 3.393 0.296 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -12.527 4.538 -1.662 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -11.268 3.778 -0.659 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -11.777 3.010 -2.182 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -14.784 3.552 -1.794 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -14.122 1.986 -2.318 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -15.175 2.072 -0.886 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.654 -1.482 0.514 1.00 0.00 N ATOM 1193 CA TYR A 498 -12.000 -2.754 0.798 1.00 0.00 C ATOM 1194 C TYR A 498 -11.603 -3.463 -0.493 1.00 0.00 C ATOM 1195 O TYR A 498 -12.391 -3.551 -1.435 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.924 -3.653 1.623 1.00 0.00 C ATOM 1197 CG TYR A 498 -13.297 -3.067 2.966 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -12.458 -3.210 4.065 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -14.487 -2.371 3.137 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -12.795 -2.677 5.294 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -14.831 -1.834 4.362 1.00 0.00 C ATOM 1202 CZ TYR A 498 -13.983 -1.990 5.438 1.00 0.00 C ATOM 1203 OH TYR A 498 -14.321 -1.457 6.660 1.00 0.00 O ATOM 0 H TYR A 498 -13.035 -1.405 -0.429 1.00 0.00 H new ATOM 0 HA TYR A 498 -11.096 -2.549 1.371 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.834 -3.844 1.054 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -12.437 -4.616 1.779 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -11.527 -3.747 3.956 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -15.155 -2.248 2.297 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -12.132 -2.797 6.138 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -15.760 -1.295 4.477 1.00 0.00 H new ATOM 0 HH TYR A 498 -15.187 -1.004 6.591 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.375 -3.969 -0.528 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.870 -4.672 -1.703 1.00 0.00 C ATOM 1215 C LEU A 499 -9.472 -6.102 -1.352 1.00 0.00 C ATOM 1216 O LEU A 499 -8.923 -6.359 -0.280 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.671 -3.926 -2.291 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.260 -4.329 -3.708 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.380 -4.032 -4.693 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -6.983 -3.610 -4.117 1.00 0.00 C ATOM 0 H LEU A 499 -9.711 -3.906 0.243 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.667 -4.708 -2.446 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.895 -2.859 -2.289 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.817 -4.074 -1.630 1.00 0.00 H new ATOM 0 HG LEU A 499 -8.069 -5.402 -3.719 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -9.070 -4.325 -5.696 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.271 -4.592 -4.410 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.603 -2.965 -4.680 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.705 -3.909 -5.128 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -7.147 -2.533 -4.089 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -6.181 -3.873 -3.428 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.751 -7.028 -2.263 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.421 -8.433 -2.050 1.00 0.00 C ATOM 1234 C CYS A 500 -8.052 -8.764 -2.635 1.00 0.00 C ATOM 1235 O CYS A 500 -7.769 -8.458 -3.794 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.488 -9.330 -2.679 1.00 0.00 C ATOM 1237 SG CYS A 500 -12.155 -9.057 -2.034 1.00 0.00 S ATOM 0 H CYS A 500 -10.204 -6.832 -3.155 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.391 -8.615 -0.976 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.496 -9.167 -3.757 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -10.213 -10.372 -2.517 1.00 0.00 H new ATOM 0 HG CYS A 500 -12.987 -9.860 -2.628 1.00 0.00 H new ATOM 1243 N VAL A 501 -7.203 -9.389 -1.825 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.863 -9.761 -2.262 1.00 0.00 C ATOM 1245 C VAL A 501 -5.598 -11.243 -2.020 1.00 0.00 C ATOM 1246 O VAL A 501 -5.549 -11.697 -0.877 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.786 -8.933 -1.536 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -4.834 -7.482 -1.988 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.960 -9.038 -0.029 1.00 0.00 C ATOM 0 H VAL A 501 -7.420 -9.648 -0.863 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.810 -9.555 -3.331 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.807 -9.336 -1.794 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -4.066 -6.912 -1.465 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -4.656 -7.429 -3.062 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -5.814 -7.063 -1.762 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -4.191 -8.447 0.468 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.944 -8.662 0.251 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.870 -10.081 0.276 1.00 0.00 H new ATOM 1259 N SER A 502 -5.426 -11.993 -3.105 1.00 0.00 N ATOM 1260 CA SER A 502 -5.169 -13.425 -3.011 1.00 0.00 C ATOM 1261 C SER A 502 -3.671 -13.704 -2.933 1.00 0.00 C ATOM 1262 O SER A 502 -2.892 -13.198 -3.741 1.00 0.00 O ATOM 1263 CB SER A 502 -5.773 -14.153 -4.213 1.00 0.00 C ATOM 1264 OG SER A 502 -5.372 -13.547 -5.430 1.00 0.00 O ATOM 0 H SER A 502 -5.460 -11.632 -4.058 1.00 0.00 H new ATOM 0 HA SER A 502 -5.638 -13.794 -2.099 1.00 0.00 H new ATOM 0 HB2 SER A 502 -5.462 -15.198 -4.203 1.00 0.00 H new ATOM 0 HB3 SER A 502 -6.860 -14.143 -4.139 1.00 0.00 H new ATOM 0 HG SER A 502 -4.443 -13.245 -5.355 1.00 0.00 H new ATOM 1270 N SER A 503 -3.276 -14.513 -1.956 1.00 0.00 N ATOM 1271 CA SER A 503 -1.872 -14.857 -1.769 1.00 0.00 C ATOM 1272 C SER A 503 -1.652 -16.357 -1.946 1.00 0.00 C ATOM 1273 O SER A 503 -2.570 -17.165 -1.808 1.00 0.00 O ATOM 1274 CB SER A 503 -1.398 -14.421 -0.381 1.00 0.00 C ATOM 1275 OG SER A 503 -1.269 -13.012 -0.305 1.00 0.00 O ATOM 0 H SER A 503 -3.909 -14.943 -1.281 1.00 0.00 H new ATOM 0 HA SER A 503 -1.291 -14.330 -2.526 1.00 0.00 H new ATOM 0 HB2 SER A 503 -2.106 -14.766 0.373 1.00 0.00 H new ATOM 0 HB3 SER A 503 -0.440 -14.890 -0.157 1.00 0.00 H new ATOM 0 HG SER A 503 -0.320 -12.773 -0.248 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.404 -16.738 -2.260 1.00 0.00 N ATOM 1282 CA PRO A 504 -0.033 -18.141 -2.462 1.00 0.00 C ATOM 1283 C PRO A 504 -0.609 -19.054 -1.385 1.00 0.00 C ATOM 1284 O PRO A 504 -0.709 -20.268 -1.573 1.00 0.00 O ATOM 1285 CB PRO A 504 1.496 -18.119 -2.383 1.00 0.00 C ATOM 1286 CG PRO A 504 1.877 -16.748 -2.825 1.00 0.00 C ATOM 1287 CD PRO A 504 0.739 -15.828 -2.440 1.00 0.00 C ATOM 0 HA PRO A 504 -0.419 -18.533 -3.403 1.00 0.00 H new ATOM 0 HB2 PRO A 504 1.843 -18.319 -1.369 1.00 0.00 H new ATOM 0 HB3 PRO A 504 1.937 -18.880 -3.027 1.00 0.00 H new ATOM 0 HG2 PRO A 504 2.806 -16.433 -2.349 1.00 0.00 H new ATOM 0 HG3 PRO A 504 2.046 -16.723 -3.901 1.00 0.00 H new ATOM 0 HD2 PRO A 504 0.961 -15.279 -1.525 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.543 -15.088 -3.216 1.00 0.00 H new ATOM 1295 N THR A 505 -0.986 -18.465 -0.255 1.00 0.00 N ATOM 1296 CA THR A 505 -1.551 -19.225 0.852 1.00 0.00 C ATOM 1297 C THR A 505 -2.836 -18.582 1.362 1.00 0.00 C ATOM 1298 O THR A 505 -3.919 -19.157 1.243 1.00 0.00 O ATOM 1299 CB THR A 505 -0.553 -19.345 2.019 1.00 0.00 C ATOM 1300 OG1 THR A 505 -0.052 -18.050 2.370 1.00 0.00 O ATOM 1301 CG2 THR A 505 0.605 -20.259 1.648 1.00 0.00 C ATOM 0 H THR A 505 -0.910 -17.463 -0.082 1.00 0.00 H new ATOM 0 HA THR A 505 -1.773 -20.221 0.470 1.00 0.00 H new ATOM 0 HB THR A 505 -1.076 -19.775 2.873 1.00 0.00 H new ATOM 0 HG1 THR A 505 0.904 -18.114 2.575 1.00 0.00 H new ATOM 0 HG21 THR A 505 1.297 -20.329 2.487 1.00 0.00 H new ATOM 0 HG22 THR A 505 0.223 -21.252 1.409 1.00 0.00 H new ATOM 0 HG23 THR A 505 1.126 -19.853 0.781 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.709 -17.387 1.929 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.861 -16.666 2.455 1.00 0.00 C ATOM 1311 C ILE A 506 -4.828 -16.285 1.339 1.00 0.00 C ATOM 1312 O ILE A 506 -4.586 -15.339 0.588 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.433 -15.391 3.205 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.444 -15.737 4.320 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -4.650 -14.676 3.773 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -3.003 -16.695 5.348 1.00 0.00 C ATOM 0 H ILE A 506 -1.820 -16.898 2.036 1.00 0.00 H new ATOM 0 HA ILE A 506 -4.361 -17.338 3.153 1.00 0.00 H new ATOM 0 HB ILE A 506 -2.939 -14.722 2.501 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -1.549 -16.174 3.878 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.137 -14.818 4.820 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.331 -13.777 4.300 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.322 -14.401 2.960 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.170 -15.337 4.466 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -2.247 -16.895 6.108 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -3.881 -16.253 5.818 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -3.284 -17.629 4.861 1.00 0.00 H new ATOM 1328 N LYS A 507 -5.926 -17.026 1.236 1.00 0.00 N ATOM 1329 CA LYS A 507 -6.932 -16.765 0.214 1.00 0.00 C ATOM 1330 C LYS A 507 -7.268 -15.279 0.147 1.00 0.00 C ATOM 1331 O LYS A 507 -6.836 -14.497 0.994 1.00 0.00 O ATOM 1332 CB LYS A 507 -8.201 -17.573 0.500 1.00 0.00 C ATOM 1333 CG LYS A 507 -8.174 -18.975 -0.084 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.562 -18.975 -1.553 1.00 0.00 C ATOM 1335 CE LYS A 507 -8.861 -20.381 -2.050 1.00 0.00 C ATOM 1336 NZ LYS A 507 -10.096 -20.937 -1.430 1.00 0.00 N ATOM 0 H LYS A 507 -6.142 -17.813 1.848 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.523 -17.070 -0.749 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.343 -17.640 1.579 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -9.061 -17.037 0.098 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -7.176 -19.398 0.030 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -8.857 -19.616 0.474 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -9.437 -18.342 -1.699 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -7.754 -18.543 -2.144 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -8.973 -20.367 -3.134 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -8.017 -21.033 -1.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -10.437 -21.741 -1.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -9.885 -21.258 -0.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -10.830 -20.201 -1.397 1.00 0.00 H new ATOM 1350 N ASP A 508 -8.040 -14.896 -0.864 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.436 -13.504 -1.039 1.00 0.00 C ATOM 1352 C ASP A 508 -8.825 -12.877 0.296 1.00 0.00 C ATOM 1353 O ASP A 508 -9.854 -13.220 0.879 1.00 0.00 O ATOM 1354 CB ASP A 508 -9.602 -13.403 -2.023 1.00 0.00 C ATOM 1355 CG ASP A 508 -10.811 -14.198 -1.572 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -10.627 -15.193 -0.840 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -11.942 -13.827 -1.950 1.00 0.00 O ATOM 0 H ASP A 508 -8.404 -15.530 -1.575 1.00 0.00 H new ATOM 0 HA ASP A 508 -7.583 -12.958 -1.441 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -9.883 -12.357 -2.143 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -9.280 -13.760 -3.001 1.00 0.00 H new ATOM 1362 N LYS A 509 -7.995 -11.957 0.776 1.00 0.00 N ATOM 1363 CA LYS A 509 -8.251 -11.281 2.043 1.00 0.00 C ATOM 1364 C LYS A 509 -8.666 -9.832 1.812 1.00 0.00 C ATOM 1365 O LYS A 509 -8.060 -9.105 1.024 1.00 0.00 O ATOM 1366 CB LYS A 509 -7.006 -11.331 2.932 1.00 0.00 C ATOM 1367 CG LYS A 509 -7.247 -10.831 4.345 1.00 0.00 C ATOM 1368 CD LYS A 509 -7.873 -11.906 5.218 1.00 0.00 C ATOM 1369 CE LYS A 509 -6.814 -12.791 5.857 1.00 0.00 C ATOM 1370 NZ LYS A 509 -7.420 -13.875 6.680 1.00 0.00 N ATOM 0 H LYS A 509 -7.139 -11.662 0.307 1.00 0.00 H new ATOM 0 HA LYS A 509 -9.069 -11.799 2.544 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.642 -12.358 2.976 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -6.218 -10.733 2.474 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -6.303 -10.509 4.784 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -7.900 -9.958 4.317 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -8.476 -11.439 5.996 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -8.546 -12.518 4.617 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -6.191 -13.231 5.079 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -6.161 -12.182 6.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -6.666 -14.456 7.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -7.995 -13.455 7.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -8.023 -14.472 6.079 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.723 -9.399 2.515 1.00 0.00 N ATOM 1385 CA PRO A 510 -10.241 -8.032 2.405 1.00 0.00 C ATOM 1386 C PRO A 510 -9.421 -7.034 3.217 1.00 0.00 C ATOM 1387 O PRO A 510 -9.681 -6.820 4.401 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.659 -8.144 2.970 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.596 -9.279 3.931 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.493 -10.210 3.473 1.00 0.00 C ATOM 0 HA PRO A 510 -10.204 -7.663 1.380 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.961 -7.222 3.466 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -12.386 -8.334 2.180 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -11.396 -8.916 4.939 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.550 -9.805 3.965 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -9.874 -10.538 4.308 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -10.896 -11.107 3.004 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.430 -6.427 2.572 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.573 -5.450 3.234 1.00 0.00 C ATOM 1400 C VAL A 511 -8.200 -4.060 3.205 1.00 0.00 C ATOM 1401 O VAL A 511 -8.902 -3.706 2.259 1.00 0.00 O ATOM 1402 CB VAL A 511 -6.182 -5.388 2.577 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.474 -6.729 2.697 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -6.299 -4.966 1.120 1.00 0.00 C ATOM 0 H VAL A 511 -8.201 -6.594 1.592 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.463 -5.774 4.269 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.585 -4.641 3.101 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.493 -6.666 2.227 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -5.356 -6.985 3.750 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -6.065 -7.498 2.200 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -5.306 -4.927 0.672 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.913 -5.687 0.581 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.762 -3.981 1.063 1.00 0.00 H new ATOM 1414 N GLN A 512 -7.939 -3.278 4.248 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.478 -1.926 4.341 1.00 0.00 C ATOM 1416 C GLN A 512 -7.646 -0.950 3.515 1.00 0.00 C ATOM 1417 O GLN A 512 -6.521 -0.613 3.884 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.519 -1.471 5.801 1.00 0.00 C ATOM 1419 CG GLN A 512 -9.426 -0.275 6.040 1.00 0.00 C ATOM 1420 CD GLN A 512 -9.744 -0.067 7.507 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -8.913 -0.329 8.377 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -10.952 0.406 7.790 1.00 0.00 N ATOM 0 H GLN A 512 -7.359 -3.557 5.039 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.492 -1.938 3.942 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -8.855 -2.301 6.422 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -7.508 -1.220 6.123 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -8.949 0.622 5.645 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -10.355 -0.412 5.487 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -11.609 0.609 7.037 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -11.223 0.566 8.760 1.00 0.00 H new ATOM 1431 N ILE A 513 -8.207 -0.501 2.398 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.518 0.436 1.520 1.00 0.00 C ATOM 1433 C ILE A 513 -7.955 1.871 1.796 1.00 0.00 C ATOM 1434 O ILE A 513 -9.004 2.312 1.326 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.772 0.110 0.037 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -7.487 -1.368 -0.239 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.913 0.995 -0.855 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -6.035 -1.749 -0.052 1.00 0.00 C ATOM 0 H ILE A 513 -9.138 -0.771 2.079 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.453 0.337 1.727 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.820 0.308 -0.188 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -8.102 -1.978 0.422 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.787 -1.603 -1.260 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -7.104 0.752 -1.900 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -7.159 2.041 -0.674 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.860 0.826 -0.630 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -5.907 -2.810 -0.265 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -5.415 -1.165 -0.733 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.735 -1.546 0.976 1.00 0.00 H new ATOM 1450 N ARG A 514 -7.144 2.595 2.560 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.447 3.980 2.898 1.00 0.00 C ATOM 1452 C ARG A 514 -6.375 4.920 2.352 1.00 0.00 C ATOM 1453 O ARG A 514 -5.346 5.160 2.983 1.00 0.00 O ATOM 1454 CB ARG A 514 -7.560 4.145 4.414 1.00 0.00 C ATOM 1455 CG ARG A 514 -7.585 5.595 4.870 1.00 0.00 C ATOM 1456 CD ARG A 514 -8.391 5.763 6.148 1.00 0.00 C ATOM 1457 NE ARG A 514 -8.195 7.080 6.749 1.00 0.00 N ATOM 1458 CZ ARG A 514 -9.076 7.656 7.559 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -10.206 7.035 7.865 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -8.826 8.857 8.067 1.00 0.00 N ATOM 0 H ARG A 514 -6.272 2.245 2.957 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.401 4.239 2.439 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -8.468 3.649 4.758 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -6.720 3.638 4.889 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -6.565 5.944 5.033 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -8.013 6.217 4.084 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -9.449 5.617 5.931 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -8.103 4.992 6.862 1.00 0.00 H new ATOM 0 HE ARG A 514 -7.335 7.585 6.535 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -10.401 6.112 7.478 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -10.880 7.480 8.487 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -7.957 9.338 7.835 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -9.503 9.299 8.689 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.621 5.464 1.151 1.00 0.00 N ATOM 1475 CA PRO A 515 -5.689 6.385 0.494 1.00 0.00 C ATOM 1476 C PRO A 515 -5.155 7.448 1.448 1.00 0.00 C ATOM 1477 O PRO A 515 -5.715 8.539 1.553 1.00 0.00 O ATOM 1478 CB PRO A 515 -6.541 7.030 -0.602 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.578 6.010 -0.925 1.00 0.00 C ATOM 1480 CD PRO A 515 -7.827 5.222 0.342 1.00 0.00 C ATOM 0 HA PRO A 515 -4.805 5.870 0.118 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -6.994 7.959 -0.256 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -5.940 7.275 -1.478 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.495 6.487 -1.270 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -7.239 5.355 -1.727 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.727 5.563 0.854 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -7.962 4.161 0.133 1.00 0.00 H new ATOM 1488 N TRP A 516 -4.070 7.123 2.141 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.461 8.051 3.087 1.00 0.00 C ATOM 1490 C TRP A 516 -3.555 9.485 2.580 1.00 0.00 C ATOM 1491 O TRP A 516 -3.406 9.742 1.386 1.00 0.00 O ATOM 1492 CB TRP A 516 -1.997 7.677 3.328 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.356 8.469 4.428 1.00 0.00 C ATOM 1494 CD1 TRP A 516 -0.600 9.598 4.291 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -1.412 8.189 5.830 1.00 0.00 C ATOM 1496 NE1 TRP A 516 -0.183 10.037 5.525 1.00 0.00 N ATOM 1497 CE2 TRP A 516 -0.669 9.190 6.485 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -2.020 7.191 6.597 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 -0.518 9.220 7.869 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -1.869 7.222 7.971 1.00 0.00 C ATOM 1501 CH2 TRP A 516 -1.124 8.231 8.595 1.00 0.00 C ATOM 0 H TRP A 516 -3.594 6.224 2.066 1.00 0.00 H new ATOM 0 HA TRP A 516 -4.007 7.982 4.028 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -1.935 6.616 3.570 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.434 7.827 2.406 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -0.364 10.076 3.351 1.00 0.00 H new ATOM 0 HE1 TRP A 516 0.395 10.860 5.698 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -2.597 6.410 6.125 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 0.057 9.996 8.352 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -2.333 6.455 8.573 1.00 0.00 H new ATOM 0 HH2 TRP A 516 -1.026 8.228 9.671 1.00 0.00 H new