USER MOD reduce.3.24.130724 H: found=0, std=0, add=498, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 498 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 431 LYS NZ :NH3+ 131:sc= -1.24 (180deg=-1.78!) USER MOD Set 1.2: A 456 LYS NZ :NH3+ -152:sc= 0.992 (180deg=0.661) USER MOD Single : A 411 MET CE :methyl 146:sc= -1.53 (180deg=-3.5!) USER MOD Single : A 413 LYS NZ :NH3+ -155:sc= -0.421 (180deg=-0.931) USER MOD Single : A 415 GLN : amide:sc= -6.13! K(o=-6.1!,f=-2.3) USER MOD Single : A 417 GLN : amide:sc= -2.56! C(o=-2.6!,f=-2.1!) USER MOD Single : A 418 HIS : no HD1:sc= -0.457 X(o=-0.46,f=-0.24) USER MOD Single : A 420 TYR OH : rot 84:sc= -0.127 USER MOD Single : A 421 THR OG1 : rot 180:sc= 0 USER MOD Single : A 423 THR OG1 : rot 51:sc= 0.181 USER MOD Single : A 425 THR OG1 : rot -28:sc= 0.259 USER MOD Single : A 429 GLN : amide:sc= -0.263 X(o=-0.26,f=-0.048) USER MOD Single : A 442 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 443 ASN : amide:sc= -0.475 K(o=-0.47,f=0.98) USER MOD Single : A 447 GLN : amide:sc= -5.01! C(o=-5!,f=-6.7!) USER MOD Single : A 453 MET CE :methyl 145:sc= -2.25 (180deg=-4.4!) USER MOD Single : A 458 SER OG : rot 180:sc= 0 USER MOD Single : A 476 ASN : amide:sc= -1.35 K(o=-1.4,f=-0.39) USER MOD Single : A 478 THR OG1 : rot -87:sc= -0.749 USER MOD ----------------------------------------------------------------- ATOM 82 N PRO A 407 7.951 4.087 -10.545 1.00 0.00 N ATOM 83 CA PRO A 407 9.129 4.934 -10.474 1.00 0.00 C ATOM 84 C PRO A 407 9.530 5.432 -11.864 1.00 0.00 C ATOM 85 O PRO A 407 9.545 4.662 -12.823 1.00 0.00 O ATOM 86 CB PRO A 407 10.196 4.071 -9.821 1.00 0.00 C ATOM 87 CG PRO A 407 9.721 2.635 -9.974 1.00 0.00 C ATOM 88 CD PRO A 407 8.258 2.669 -10.382 1.00 0.00 C ATOM 0 HA PRO A 407 8.961 5.841 -9.894 1.00 0.00 H new ATOM 0 HB2 PRO A 407 11.164 4.216 -10.302 1.00 0.00 H new ATOM 0 HB3 PRO A 407 10.320 4.332 -8.770 1.00 0.00 H new ATOM 0 HG2 PRO A 407 10.315 2.115 -10.725 1.00 0.00 H new ATOM 0 HG3 PRO A 407 9.844 2.091 -9.038 1.00 0.00 H new ATOM 0 HD2 PRO A 407 8.092 2.119 -11.308 1.00 0.00 H new ATOM 0 HD3 PRO A 407 7.624 2.212 -9.622 1.00 0.00 H new ATOM 96 N PRO A 408 9.856 6.751 -11.931 1.00 0.00 N ATOM 97 CA PRO A 408 10.256 7.360 -13.187 1.00 0.00 C ATOM 98 C PRO A 408 11.683 6.954 -13.563 1.00 0.00 C ATOM 99 O PRO A 408 12.570 6.930 -12.712 1.00 0.00 O ATOM 100 CB PRO A 408 10.104 8.856 -12.965 1.00 0.00 C ATOM 101 CG PRO A 408 10.071 9.053 -11.459 1.00 0.00 C ATOM 102 CD PRO A 408 9.850 7.693 -10.816 1.00 0.00 C ATOM 0 HA PRO A 408 9.645 7.031 -14.027 1.00 0.00 H new ATOM 0 HB2 PRO A 408 10.934 9.403 -13.412 1.00 0.00 H new ATOM 0 HB3 PRO A 408 9.190 9.229 -13.428 1.00 0.00 H new ATOM 0 HG2 PRO A 408 11.006 9.493 -11.111 1.00 0.00 H new ATOM 0 HG3 PRO A 408 9.272 9.741 -11.181 1.00 0.00 H new ATOM 0 HD2 PRO A 408 10.637 7.462 -10.098 1.00 0.00 H new ATOM 0 HD3 PRO A 408 8.905 7.660 -10.275 1.00 0.00 H new ATOM 110 N GLY A 409 11.859 6.645 -14.840 1.00 0.00 N ATOM 111 CA GLY A 409 13.162 6.241 -15.339 1.00 0.00 C ATOM 112 C GLY A 409 13.355 4.729 -15.209 1.00 0.00 C ATOM 113 O GLY A 409 14.167 4.139 -15.920 1.00 0.00 O ATOM 0 H GLY A 409 11.121 6.666 -15.543 1.00 0.00 H new ATOM 0 HA2 GLY A 409 13.262 6.535 -16.384 1.00 0.00 H new ATOM 0 HA3 GLY A 409 13.944 6.760 -14.785 1.00 0.00 H new ATOM 117 N PHE A 410 12.594 4.144 -14.295 1.00 0.00 N ATOM 118 CA PHE A 410 12.670 2.712 -14.063 1.00 0.00 C ATOM 119 C PHE A 410 12.905 1.956 -15.372 1.00 0.00 C ATOM 120 O PHE A 410 12.505 2.417 -16.440 1.00 0.00 O ATOM 121 CB PHE A 410 11.326 2.282 -13.473 1.00 0.00 C ATOM 122 CG PHE A 410 11.028 0.789 -13.627 1.00 0.00 C ATOM 123 CD1 PHE A 410 11.637 -0.114 -12.812 1.00 0.00 C ATOM 124 CD2 PHE A 410 10.153 0.365 -14.578 1.00 0.00 C ATOM 125 CE1 PHE A 410 11.360 -1.499 -12.955 1.00 0.00 C ATOM 126 CE2 PHE A 410 9.876 -1.021 -14.721 1.00 0.00 C ATOM 127 CZ PHE A 410 10.486 -1.923 -13.906 1.00 0.00 C ATOM 0 H PHE A 410 11.922 4.636 -13.707 1.00 0.00 H new ATOM 0 HA PHE A 410 13.499 2.488 -13.392 1.00 0.00 H new ATOM 0 HB2 PHE A 410 11.307 2.538 -12.414 1.00 0.00 H new ATOM 0 HB3 PHE A 410 10.531 2.852 -13.953 1.00 0.00 H new ATOM 0 HD1 PHE A 410 12.331 0.223 -12.056 1.00 0.00 H new ATOM 0 HD2 PHE A 410 9.669 1.082 -15.224 1.00 0.00 H new ATOM 0 HE1 PHE A 410 11.844 -2.216 -12.308 1.00 0.00 H new ATOM 0 HE2 PHE A 410 9.182 -1.358 -15.476 1.00 0.00 H new ATOM 0 HZ PHE A 410 10.276 -2.977 -14.014 1.00 0.00 H new ATOM 137 N MET A 411 13.552 0.806 -15.247 1.00 0.00 N ATOM 138 CA MET A 411 13.844 -0.018 -16.407 1.00 0.00 C ATOM 139 C MET A 411 13.022 -1.309 -16.384 1.00 0.00 C ATOM 140 O MET A 411 12.093 -1.472 -17.173 1.00 0.00 O ATOM 141 CB MET A 411 15.335 -0.362 -16.427 1.00 0.00 C ATOM 142 CG MET A 411 16.188 0.903 -16.538 1.00 0.00 C ATOM 143 SD MET A 411 17.860 0.474 -16.990 1.00 0.00 S ATOM 144 CE MET A 411 18.763 1.430 -15.783 1.00 0.00 C ATOM 0 H MET A 411 13.882 0.426 -14.360 1.00 0.00 H new ATOM 0 HA MET A 411 13.579 0.543 -17.303 1.00 0.00 H new ATOM 0 HB2 MET A 411 15.599 -0.904 -15.519 1.00 0.00 H new ATOM 0 HB3 MET A 411 15.548 -1.023 -17.267 1.00 0.00 H new ATOM 0 HG2 MET A 411 15.762 1.575 -17.283 1.00 0.00 H new ATOM 0 HG3 MET A 411 16.185 1.438 -15.588 1.00 0.00 H new ATOM 0 HE1 MET A 411 19.666 0.892 -15.494 1.00 0.00 H new ATOM 0 HE2 MET A 411 19.037 2.393 -16.213 1.00 0.00 H new ATOM 0 HE3 MET A 411 18.139 1.589 -14.904 1.00 0.00 H new ATOM 154 N PHE A 412 13.394 -2.193 -15.470 1.00 0.00 N ATOM 155 CA PHE A 412 12.704 -3.464 -15.333 1.00 0.00 C ATOM 156 C PHE A 412 12.955 -4.079 -13.955 1.00 0.00 C ATOM 157 O PHE A 412 13.700 -3.523 -13.149 1.00 0.00 O ATOM 158 CB PHE A 412 13.268 -4.397 -16.406 1.00 0.00 C ATOM 159 CG PHE A 412 14.796 -4.473 -16.424 1.00 0.00 C ATOM 160 CD1 PHE A 412 15.441 -5.385 -15.649 1.00 0.00 C ATOM 161 CD2 PHE A 412 15.509 -3.628 -17.216 1.00 0.00 C ATOM 162 CE1 PHE A 412 16.859 -5.455 -15.666 1.00 0.00 C ATOM 163 CE2 PHE A 412 16.927 -3.698 -17.233 1.00 0.00 C ATOM 164 CZ PHE A 412 17.572 -4.610 -16.457 1.00 0.00 C ATOM 0 H PHE A 412 14.165 -2.054 -14.817 1.00 0.00 H new ATOM 0 HA PHE A 412 11.630 -3.318 -15.445 1.00 0.00 H new ATOM 0 HB2 PHE A 412 12.867 -5.398 -16.250 1.00 0.00 H new ATOM 0 HB3 PHE A 412 12.920 -4.063 -17.383 1.00 0.00 H new ATOM 0 HD1 PHE A 412 14.875 -6.056 -15.020 1.00 0.00 H new ATOM 0 HD2 PHE A 412 14.997 -2.904 -17.832 1.00 0.00 H new ATOM 0 HE1 PHE A 412 17.371 -6.180 -15.050 1.00 0.00 H new ATOM 0 HE2 PHE A 412 17.493 -3.027 -17.862 1.00 0.00 H new ATOM 0 HZ PHE A 412 18.651 -4.663 -16.469 1.00 0.00 H new ATOM 174 N LYS A 413 12.320 -5.219 -13.726 1.00 0.00 N ATOM 175 CA LYS A 413 12.465 -5.916 -12.459 1.00 0.00 C ATOM 176 C LYS A 413 13.559 -6.979 -12.590 1.00 0.00 C ATOM 177 O LYS A 413 13.742 -7.557 -13.659 1.00 0.00 O ATOM 178 CB LYS A 413 11.118 -6.474 -11.996 1.00 0.00 C ATOM 179 CG LYS A 413 10.699 -5.857 -10.660 1.00 0.00 C ATOM 180 CD LYS A 413 11.499 -6.459 -9.504 1.00 0.00 C ATOM 181 CE LYS A 413 11.454 -7.988 -9.543 1.00 0.00 C ATOM 182 NZ LYS A 413 10.071 -8.460 -9.778 1.00 0.00 N ATOM 0 H LYS A 413 11.704 -5.678 -14.397 1.00 0.00 H new ATOM 0 HA LYS A 413 12.782 -5.225 -11.678 1.00 0.00 H new ATOM 0 HB2 LYS A 413 10.357 -6.270 -12.749 1.00 0.00 H new ATOM 0 HB3 LYS A 413 11.184 -7.557 -11.896 1.00 0.00 H new ATOM 0 HG2 LYS A 413 10.852 -4.778 -10.690 1.00 0.00 H new ATOM 0 HG3 LYS A 413 9.634 -6.024 -10.496 1.00 0.00 H new ATOM 0 HD2 LYS A 413 12.534 -6.121 -9.558 1.00 0.00 H new ATOM 0 HD3 LYS A 413 11.097 -6.104 -8.555 1.00 0.00 H new ATOM 0 HE2 LYS A 413 12.109 -8.357 -10.332 1.00 0.00 H new ATOM 0 HE3 LYS A 413 11.828 -8.393 -8.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 9.962 -9.421 -9.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 9.401 -7.821 -9.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 9.876 -8.470 -10.800 1.00 0.00 H new ATOM 196 N VAL A 414 14.256 -7.203 -11.485 1.00 0.00 N ATOM 197 CA VAL A 414 15.326 -8.186 -11.463 1.00 0.00 C ATOM 198 C VAL A 414 15.140 -9.108 -10.256 1.00 0.00 C ATOM 199 O VAL A 414 14.351 -8.812 -9.360 1.00 0.00 O ATOM 200 CB VAL A 414 16.684 -7.481 -11.474 1.00 0.00 C ATOM 201 CG1 VAL A 414 16.716 -6.370 -12.524 1.00 0.00 C ATOM 202 CG2 VAL A 414 17.029 -6.935 -10.087 1.00 0.00 C ATOM 0 H VAL A 414 14.101 -6.721 -10.600 1.00 0.00 H new ATOM 0 HA VAL A 414 15.291 -8.809 -12.357 1.00 0.00 H new ATOM 0 HB VAL A 414 17.442 -8.217 -11.742 1.00 0.00 H new ATOM 0 HG11 VAL A 414 17.692 -5.885 -12.511 1.00 0.00 H new ATOM 0 HG12 VAL A 414 16.536 -6.797 -13.511 1.00 0.00 H new ATOM 0 HG13 VAL A 414 15.943 -5.635 -12.300 1.00 0.00 H new ATOM 0 HG21 VAL A 414 17.999 -6.439 -10.122 1.00 0.00 H new ATOM 0 HG22 VAL A 414 16.267 -6.220 -9.777 1.00 0.00 H new ATOM 0 HG23 VAL A 414 17.068 -7.757 -9.372 1.00 0.00 H new ATOM 212 N GLN A 415 15.880 -10.207 -10.272 1.00 0.00 N ATOM 213 CA GLN A 415 15.807 -11.174 -9.190 1.00 0.00 C ATOM 214 C GLN A 415 17.214 -11.583 -8.748 1.00 0.00 C ATOM 215 O GLN A 415 18.000 -12.083 -9.551 1.00 0.00 O ATOM 216 CB GLN A 415 14.984 -12.396 -9.601 1.00 0.00 C ATOM 217 CG GLN A 415 14.990 -13.457 -8.499 1.00 0.00 C ATOM 218 CD GLN A 415 13.839 -13.234 -7.517 1.00 0.00 C ATOM 219 OE1 GLN A 415 12.681 -13.139 -7.888 1.00 0.00 O ATOM 220 NE2 GLN A 415 14.221 -13.156 -6.245 1.00 0.00 N ATOM 0 H GLN A 415 16.533 -10.449 -11.017 1.00 0.00 H new ATOM 0 HA GLN A 415 15.303 -10.706 -8.344 1.00 0.00 H new ATOM 0 HB2 GLN A 415 13.959 -12.093 -9.814 1.00 0.00 H new ATOM 0 HB3 GLN A 415 15.389 -12.819 -10.520 1.00 0.00 H new ATOM 0 HG2 GLN A 415 14.906 -14.449 -8.944 1.00 0.00 H new ATOM 0 HG3 GLN A 415 15.940 -13.426 -7.965 1.00 0.00 H new ATOM 0 HE21 GLN A 415 15.208 -13.244 -6.003 1.00 0.00 H new ATOM 0 HE22 GLN A 415 13.527 -13.008 -5.512 1.00 0.00 H new ATOM 229 N ALA A 416 17.488 -11.356 -7.472 1.00 0.00 N ATOM 230 CA ALA A 416 18.786 -11.695 -6.913 1.00 0.00 C ATOM 231 C ALA A 416 18.936 -13.217 -6.869 1.00 0.00 C ATOM 232 O ALA A 416 17.948 -13.938 -6.732 1.00 0.00 O ATOM 233 CB ALA A 416 18.930 -11.055 -5.531 1.00 0.00 C ATOM 0 H ALA A 416 16.833 -10.941 -6.809 1.00 0.00 H new ATOM 0 HA ALA A 416 19.587 -11.303 -7.539 1.00 0.00 H new ATOM 0 HB1 ALA A 416 19.904 -11.309 -5.112 1.00 0.00 H new ATOM 0 HB2 ALA A 416 18.845 -9.972 -5.621 1.00 0.00 H new ATOM 0 HB3 ALA A 416 18.144 -11.427 -4.874 1.00 0.00 H new ATOM 239 N GLN A 417 20.178 -13.661 -6.989 1.00 0.00 N ATOM 240 CA GLN A 417 20.470 -15.084 -6.965 1.00 0.00 C ATOM 241 C GLN A 417 21.450 -15.406 -5.835 1.00 0.00 C ATOM 242 O GLN A 417 21.780 -16.569 -5.607 1.00 0.00 O ATOM 243 CB GLN A 417 21.015 -15.555 -8.314 1.00 0.00 C ATOM 244 CG GLN A 417 20.372 -14.780 -9.466 1.00 0.00 C ATOM 245 CD GLN A 417 20.735 -15.403 -10.816 1.00 0.00 C ATOM 246 OE1 GLN A 417 20.390 -16.533 -11.120 1.00 0.00 O ATOM 247 NE2 GLN A 417 21.447 -14.605 -11.606 1.00 0.00 N ATOM 0 H GLN A 417 20.994 -13.060 -7.103 1.00 0.00 H new ATOM 0 HA GLN A 417 19.541 -15.622 -6.778 1.00 0.00 H new ATOM 0 HB2 GLN A 417 22.096 -15.421 -8.340 1.00 0.00 H new ATOM 0 HB3 GLN A 417 20.823 -16.621 -8.436 1.00 0.00 H new ATOM 0 HG2 GLN A 417 19.289 -14.773 -9.344 1.00 0.00 H new ATOM 0 HG3 GLN A 417 20.703 -13.742 -9.440 1.00 0.00 H new ATOM 0 HE21 GLN A 417 21.702 -13.670 -11.289 1.00 0.00 H new ATOM 0 HE22 GLN A 417 21.738 -14.928 -12.529 1.00 0.00 H new ATOM 256 N HIS A 418 21.889 -14.355 -5.158 1.00 0.00 N ATOM 257 CA HIS A 418 22.824 -14.511 -4.057 1.00 0.00 C ATOM 258 C HIS A 418 22.505 -13.490 -2.963 1.00 0.00 C ATOM 259 O HIS A 418 21.707 -12.579 -3.174 1.00 0.00 O ATOM 260 CB HIS A 418 24.268 -14.416 -4.554 1.00 0.00 C ATOM 261 CG HIS A 418 24.673 -15.535 -5.484 1.00 0.00 C ATOM 262 ND1 HIS A 418 25.295 -16.689 -5.042 1.00 0.00 N ATOM 263 CD2 HIS A 418 24.536 -15.664 -6.835 1.00 0.00 C ATOM 264 CE1 HIS A 418 25.519 -17.470 -6.089 1.00 0.00 C ATOM 265 NE2 HIS A 418 25.049 -16.833 -7.199 1.00 0.00 N ATOM 0 H HIS A 418 21.614 -13.392 -5.351 1.00 0.00 H new ATOM 0 HA HIS A 418 22.715 -15.504 -3.621 1.00 0.00 H new ATOM 0 HB2 HIS A 418 24.403 -13.464 -5.068 1.00 0.00 H new ATOM 0 HB3 HIS A 418 24.938 -14.412 -3.694 1.00 0.00 H new ATOM 0 HD2 HIS A 418 24.086 -14.938 -7.496 1.00 0.00 H new ATOM 0 HE1 HIS A 418 25.991 -18.441 -6.067 1.00 0.00 H new ATOM 0 HE2 HIS A 418 25.086 -17.195 -8.152 1.00 0.00 H new ATOM 273 N ASP A 419 23.146 -13.677 -1.819 1.00 0.00 N ATOM 274 CA ASP A 419 22.941 -12.784 -0.692 1.00 0.00 C ATOM 275 C ASP A 419 24.187 -11.918 -0.499 1.00 0.00 C ATOM 276 O ASP A 419 25.179 -12.370 0.072 1.00 0.00 O ATOM 277 CB ASP A 419 22.707 -13.571 0.600 1.00 0.00 C ATOM 278 CG ASP A 419 23.820 -14.554 0.968 1.00 0.00 C ATOM 279 OD1 ASP A 419 24.040 -15.488 0.167 1.00 0.00 O ATOM 280 OD2 ASP A 419 24.426 -14.348 2.042 1.00 0.00 O ATOM 0 H ASP A 419 23.808 -14.434 -1.648 1.00 0.00 H new ATOM 0 HA ASP A 419 22.065 -12.170 -0.904 1.00 0.00 H new ATOM 0 HB2 ASP A 419 22.581 -12.864 1.420 1.00 0.00 H new ATOM 0 HB3 ASP A 419 21.771 -14.123 0.507 1.00 0.00 H new ATOM 285 N TYR A 420 24.096 -10.689 -0.985 1.00 0.00 N ATOM 286 CA TYR A 420 25.204 -9.756 -0.874 1.00 0.00 C ATOM 287 C TYR A 420 24.886 -8.644 0.128 1.00 0.00 C ATOM 288 O TYR A 420 24.121 -7.731 -0.175 1.00 0.00 O ATOM 289 CB TYR A 420 25.378 -9.139 -2.263 1.00 0.00 C ATOM 290 CG TYR A 420 25.890 -7.698 -2.245 1.00 0.00 C ATOM 291 CD1 TYR A 420 27.170 -7.426 -1.804 1.00 0.00 C ATOM 292 CD2 TYR A 420 25.073 -6.670 -2.668 1.00 0.00 C ATOM 293 CE1 TYR A 420 27.652 -6.069 -1.787 1.00 0.00 C ATOM 294 CE2 TYR A 420 25.555 -5.313 -2.651 1.00 0.00 C ATOM 295 CZ TYR A 420 26.821 -5.080 -2.211 1.00 0.00 C ATOM 296 OH TYR A 420 27.276 -3.798 -2.194 1.00 0.00 O ATOM 0 H TYR A 420 23.272 -10.318 -1.457 1.00 0.00 H new ATOM 0 HA TYR A 420 26.102 -10.267 -0.528 1.00 0.00 H new ATOM 0 HB2 TYR A 420 26.072 -9.753 -2.837 1.00 0.00 H new ATOM 0 HB3 TYR A 420 24.421 -9.167 -2.784 1.00 0.00 H new ATOM 0 HD1 TYR A 420 27.809 -8.231 -1.472 1.00 0.00 H new ATOM 0 HD2 TYR A 420 24.072 -6.883 -3.012 1.00 0.00 H new ATOM 0 HE1 TYR A 420 28.651 -5.842 -1.445 1.00 0.00 H new ATOM 0 HE2 TYR A 420 24.926 -4.499 -2.980 1.00 0.00 H new ATOM 0 HH TYR A 420 27.784 -3.620 -3.013 1.00 0.00 H new ATOM 306 N THR A 421 25.490 -8.759 1.302 1.00 0.00 N ATOM 307 CA THR A 421 25.281 -7.775 2.350 1.00 0.00 C ATOM 308 C THR A 421 26.060 -6.494 2.043 1.00 0.00 C ATOM 309 O THR A 421 27.290 -6.495 2.051 1.00 0.00 O ATOM 310 CB THR A 421 25.668 -8.416 3.685 1.00 0.00 C ATOM 311 OG1 THR A 421 24.567 -9.266 3.994 1.00 0.00 O ATOM 312 CG2 THR A 421 25.694 -7.407 4.834 1.00 0.00 C ATOM 0 H THR A 421 26.124 -9.519 1.550 1.00 0.00 H new ATOM 0 HA THR A 421 24.235 -7.476 2.408 1.00 0.00 H new ATOM 0 HB THR A 421 26.648 -8.884 3.592 1.00 0.00 H new ATOM 0 HG1 THR A 421 24.735 -9.723 4.845 1.00 0.00 H new ATOM 0 HG21 THR A 421 25.974 -7.914 5.757 1.00 0.00 H new ATOM 0 HG22 THR A 421 26.421 -6.625 4.615 1.00 0.00 H new ATOM 0 HG23 THR A 421 24.706 -6.962 4.950 1.00 0.00 H new ATOM 320 N ALA A 422 25.311 -5.433 1.780 1.00 0.00 N ATOM 321 CA ALA A 422 25.916 -4.149 1.470 1.00 0.00 C ATOM 322 C ALA A 422 25.599 -3.158 2.592 1.00 0.00 C ATOM 323 O ALA A 422 24.435 -2.851 2.843 1.00 0.00 O ATOM 324 CB ALA A 422 25.419 -3.666 0.107 1.00 0.00 C ATOM 0 H ALA A 422 24.291 -5.436 1.775 1.00 0.00 H new ATOM 0 HA ALA A 422 27.000 -4.240 1.407 1.00 0.00 H new ATOM 0 HB1 ALA A 422 25.873 -2.703 -0.125 1.00 0.00 H new ATOM 0 HB2 ALA A 422 25.695 -4.391 -0.659 1.00 0.00 H new ATOM 0 HB3 ALA A 422 24.335 -3.559 0.132 1.00 0.00 H new ATOM 330 N THR A 423 26.656 -2.684 3.236 1.00 0.00 N ATOM 331 CA THR A 423 26.504 -1.734 4.324 1.00 0.00 C ATOM 332 C THR A 423 27.182 -0.408 3.973 1.00 0.00 C ATOM 333 O THR A 423 28.384 -0.247 4.178 1.00 0.00 O ATOM 334 CB THR A 423 27.057 -2.380 5.596 1.00 0.00 C ATOM 335 OG1 THR A 423 28.283 -2.974 5.179 1.00 0.00 O ATOM 336 CG2 THR A 423 26.210 -3.564 6.067 1.00 0.00 C ATOM 0 H THR A 423 27.620 -2.940 3.025 1.00 0.00 H new ATOM 0 HA THR A 423 25.455 -1.492 4.494 1.00 0.00 H new ATOM 0 HB THR A 423 27.110 -1.634 6.389 1.00 0.00 H new ATOM 0 HG1 THR A 423 28.818 -2.312 4.693 1.00 0.00 H new ATOM 0 HG21 THR A 423 26.646 -3.986 6.973 1.00 0.00 H new ATOM 0 HG22 THR A 423 25.195 -3.225 6.277 1.00 0.00 H new ATOM 0 HG23 THR A 423 26.184 -4.326 5.288 1.00 0.00 H new ATOM 344 N ASP A 424 26.381 0.508 3.448 1.00 0.00 N ATOM 345 CA ASP A 424 26.888 1.815 3.066 1.00 0.00 C ATOM 346 C ASP A 424 25.848 2.882 3.413 1.00 0.00 C ATOM 347 O ASP A 424 24.818 2.579 4.013 1.00 0.00 O ATOM 348 CB ASP A 424 27.153 1.885 1.561 1.00 0.00 C ATOM 349 CG ASP A 424 28.382 2.701 1.157 1.00 0.00 C ATOM 350 OD1 ASP A 424 29.492 2.130 1.232 1.00 0.00 O ATOM 351 OD2 ASP A 424 28.185 3.877 0.783 1.00 0.00 O ATOM 0 H ASP A 424 25.385 0.371 3.278 1.00 0.00 H new ATOM 0 HA ASP A 424 27.820 1.985 3.604 1.00 0.00 H new ATOM 0 HB2 ASP A 424 27.268 0.870 1.180 1.00 0.00 H new ATOM 0 HB3 ASP A 424 26.276 2.311 1.073 1.00 0.00 H new ATOM 356 N THR A 425 26.154 4.110 3.020 1.00 0.00 N ATOM 357 CA THR A 425 25.258 5.224 3.282 1.00 0.00 C ATOM 358 C THR A 425 24.165 5.292 2.214 1.00 0.00 C ATOM 359 O THR A 425 23.199 6.041 2.356 1.00 0.00 O ATOM 360 CB THR A 425 26.101 6.498 3.371 1.00 0.00 C ATOM 361 OG1 THR A 425 25.189 7.486 3.841 1.00 0.00 O ATOM 362 CG2 THR A 425 26.531 7.012 1.995 1.00 0.00 C ATOM 0 H THR A 425 27.009 4.358 2.522 1.00 0.00 H new ATOM 0 HA THR A 425 24.735 5.096 4.230 1.00 0.00 H new ATOM 0 HB THR A 425 26.985 6.307 3.980 1.00 0.00 H new ATOM 0 HG1 THR A 425 24.280 7.253 3.559 1.00 0.00 H new ATOM 0 HG21 THR A 425 27.126 7.917 2.114 1.00 0.00 H new ATOM 0 HG22 THR A 425 27.126 6.250 1.492 1.00 0.00 H new ATOM 0 HG23 THR A 425 25.647 7.235 1.398 1.00 0.00 H new ATOM 370 N ASP A 426 24.353 4.500 1.169 1.00 0.00 N ATOM 371 CA ASP A 426 23.395 4.461 0.077 1.00 0.00 C ATOM 372 C ASP A 426 23.590 3.170 -0.720 1.00 0.00 C ATOM 373 O ASP A 426 23.539 3.182 -1.949 1.00 0.00 O ATOM 374 CB ASP A 426 23.598 5.641 -0.876 1.00 0.00 C ATOM 375 CG ASP A 426 24.723 5.461 -1.897 1.00 0.00 C ATOM 376 OD1 ASP A 426 25.666 4.707 -1.575 1.00 0.00 O ATOM 377 OD2 ASP A 426 24.615 6.083 -2.976 1.00 0.00 O ATOM 0 H ASP A 426 25.155 3.880 1.055 1.00 0.00 H new ATOM 0 HA ASP A 426 22.394 4.511 0.504 1.00 0.00 H new ATOM 0 HB2 ASP A 426 22.666 5.820 -1.412 1.00 0.00 H new ATOM 0 HB3 ASP A 426 23.803 6.534 -0.286 1.00 0.00 H new ATOM 382 N GLU A 427 23.809 2.088 0.011 1.00 0.00 N ATOM 383 CA GLU A 427 24.011 0.791 -0.612 1.00 0.00 C ATOM 384 C GLU A 427 22.677 0.055 -0.753 1.00 0.00 C ATOM 385 O GLU A 427 21.664 0.490 -0.206 1.00 0.00 O ATOM 386 CB GLU A 427 25.019 -0.046 0.178 1.00 0.00 C ATOM 387 CG GLU A 427 26.276 -0.319 -0.651 1.00 0.00 C ATOM 388 CD GLU A 427 25.913 -0.856 -2.037 1.00 0.00 C ATOM 389 OE1 GLU A 427 25.047 -1.756 -2.088 1.00 0.00 O ATOM 390 OE2 GLU A 427 26.509 -0.354 -3.014 1.00 0.00 O ATOM 0 H GLU A 427 23.851 2.082 1.030 1.00 0.00 H new ATOM 0 HA GLU A 427 24.422 0.949 -1.609 1.00 0.00 H new ATOM 0 HB2 GLU A 427 25.291 0.476 1.095 1.00 0.00 H new ATOM 0 HB3 GLU A 427 24.561 -0.990 0.472 1.00 0.00 H new ATOM 0 HG2 GLU A 427 26.855 0.599 -0.753 1.00 0.00 H new ATOM 0 HG3 GLU A 427 26.909 -1.039 -0.132 1.00 0.00 H new ATOM 397 N LEU A 428 22.720 -1.046 -1.488 1.00 0.00 N ATOM 398 CA LEU A 428 21.527 -1.846 -1.707 1.00 0.00 C ATOM 399 C LEU A 428 21.815 -3.299 -1.326 1.00 0.00 C ATOM 400 O LEU A 428 22.666 -3.947 -1.934 1.00 0.00 O ATOM 401 CB LEU A 428 21.023 -1.675 -3.142 1.00 0.00 C ATOM 402 CG LEU A 428 19.503 -1.641 -3.319 1.00 0.00 C ATOM 403 CD1 LEU A 428 18.855 -2.895 -2.730 1.00 0.00 C ATOM 404 CD2 LEU A 428 18.911 -0.359 -2.731 1.00 0.00 C ATOM 0 H LEU A 428 23.562 -1.403 -1.939 1.00 0.00 H new ATOM 0 HA LEU A 428 20.716 -1.503 -1.065 1.00 0.00 H new ATOM 0 HB2 LEU A 428 21.437 -0.750 -3.544 1.00 0.00 H new ATOM 0 HB3 LEU A 428 21.421 -2.491 -3.746 1.00 0.00 H new ATOM 0 HG LEU A 428 19.283 -1.636 -4.387 1.00 0.00 H new ATOM 0 HD11 LEU A 428 17.775 -2.846 -2.869 1.00 0.00 H new ATOM 0 HD12 LEU A 428 19.246 -3.778 -3.235 1.00 0.00 H new ATOM 0 HD13 LEU A 428 19.082 -2.956 -1.666 1.00 0.00 H new ATOM 0 HD21 LEU A 428 17.830 -0.360 -2.870 1.00 0.00 H new ATOM 0 HD22 LEU A 428 19.140 -0.307 -1.667 1.00 0.00 H new ATOM 0 HD23 LEU A 428 19.341 0.506 -3.237 1.00 0.00 H new ATOM 416 N GLN A 429 21.090 -3.770 -0.322 1.00 0.00 N ATOM 417 CA GLN A 429 21.258 -5.135 0.147 1.00 0.00 C ATOM 418 C GLN A 429 20.410 -6.092 -0.692 1.00 0.00 C ATOM 419 O GLN A 429 19.261 -5.792 -1.012 1.00 0.00 O ATOM 420 CB GLN A 429 20.909 -5.251 1.632 1.00 0.00 C ATOM 421 CG GLN A 429 21.608 -6.454 2.268 1.00 0.00 C ATOM 422 CD GLN A 429 21.884 -6.207 3.752 1.00 0.00 C ATOM 423 OE1 GLN A 429 21.452 -6.946 4.621 1.00 0.00 O ATOM 424 NE2 GLN A 429 22.625 -5.129 3.993 1.00 0.00 N ATOM 0 H GLN A 429 20.385 -3.230 0.180 1.00 0.00 H new ATOM 0 HA GLN A 429 22.306 -5.412 0.031 1.00 0.00 H new ATOM 0 HB2 GLN A 429 21.204 -4.339 2.151 1.00 0.00 H new ATOM 0 HB3 GLN A 429 19.830 -5.350 1.749 1.00 0.00 H new ATOM 0 HG2 GLN A 429 20.987 -7.342 2.153 1.00 0.00 H new ATOM 0 HG3 GLN A 429 22.546 -6.651 1.748 1.00 0.00 H new ATOM 0 HE21 GLN A 429 22.955 -4.553 3.218 1.00 0.00 H new ATOM 0 HE22 GLN A 429 22.864 -4.878 4.952 1.00 0.00 H new ATOM 433 N LEU A 430 21.009 -7.226 -1.025 1.00 0.00 N ATOM 434 CA LEU A 430 20.323 -8.229 -1.821 1.00 0.00 C ATOM 435 C LEU A 430 20.439 -9.589 -1.130 1.00 0.00 C ATOM 436 O LEU A 430 21.492 -9.929 -0.592 1.00 0.00 O ATOM 437 CB LEU A 430 20.848 -8.224 -3.259 1.00 0.00 C ATOM 438 CG LEU A 430 20.187 -7.225 -4.210 1.00 0.00 C ATOM 439 CD1 LEU A 430 18.733 -7.610 -4.486 1.00 0.00 C ATOM 440 CD2 LEU A 430 20.310 -5.796 -3.677 1.00 0.00 C ATOM 0 H LEU A 430 21.962 -7.472 -0.758 1.00 0.00 H new ATOM 0 HA LEU A 430 19.261 -7.996 -1.893 1.00 0.00 H new ATOM 0 HB2 LEU A 430 21.918 -8.018 -3.233 1.00 0.00 H new ATOM 0 HB3 LEU A 430 20.726 -9.225 -3.673 1.00 0.00 H new ATOM 0 HG LEU A 430 20.716 -7.260 -5.163 1.00 0.00 H new ATOM 0 HD11 LEU A 430 18.287 -6.883 -5.165 1.00 0.00 H new ATOM 0 HD12 LEU A 430 18.699 -8.600 -4.941 1.00 0.00 H new ATOM 0 HD13 LEU A 430 18.176 -7.622 -3.549 1.00 0.00 H new ATOM 0 HD21 LEU A 430 19.832 -5.106 -4.372 1.00 0.00 H new ATOM 0 HD22 LEU A 430 19.823 -5.727 -2.704 1.00 0.00 H new ATOM 0 HD23 LEU A 430 21.363 -5.535 -3.574 1.00 0.00 H new ATOM 452 N LYS A 431 19.342 -10.331 -1.166 1.00 0.00 N ATOM 453 CA LYS A 431 19.307 -11.646 -0.549 1.00 0.00 C ATOM 454 C LYS A 431 18.987 -12.696 -1.615 1.00 0.00 C ATOM 455 O LYS A 431 18.051 -12.528 -2.395 1.00 0.00 O ATOM 456 CB LYS A 431 18.338 -11.657 0.635 1.00 0.00 C ATOM 457 CG LYS A 431 16.900 -11.418 0.170 1.00 0.00 C ATOM 458 CD LYS A 431 16.559 -9.927 0.187 1.00 0.00 C ATOM 459 CE LYS A 431 17.009 -9.276 1.496 1.00 0.00 C ATOM 460 NZ LYS A 431 18.314 -8.601 1.318 1.00 0.00 N ATOM 0 H LYS A 431 18.470 -10.046 -1.613 1.00 0.00 H new ATOM 0 HA LYS A 431 20.283 -11.898 -0.135 1.00 0.00 H new ATOM 0 HB2 LYS A 431 18.402 -12.614 1.153 1.00 0.00 H new ATOM 0 HB3 LYS A 431 18.625 -10.887 1.351 1.00 0.00 H new ATOM 0 HG2 LYS A 431 16.769 -11.813 -0.837 1.00 0.00 H new ATOM 0 HG3 LYS A 431 16.210 -11.960 0.817 1.00 0.00 H new ATOM 0 HD2 LYS A 431 17.042 -9.430 -0.655 1.00 0.00 H new ATOM 0 HD3 LYS A 431 15.484 -9.795 0.062 1.00 0.00 H new ATOM 0 HE2 LYS A 431 16.262 -8.554 1.826 1.00 0.00 H new ATOM 0 HE3 LYS A 431 17.088 -10.032 2.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 18.261 -7.636 1.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 19.052 -9.134 1.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 18.547 -8.558 0.305 1.00 0.00 H new ATOM 474 N ALA A 432 19.782 -13.756 -1.614 1.00 0.00 N ATOM 475 CA ALA A 432 19.595 -14.833 -2.571 1.00 0.00 C ATOM 476 C ALA A 432 18.099 -15.095 -2.751 1.00 0.00 C ATOM 477 O ALA A 432 17.486 -15.795 -1.946 1.00 0.00 O ATOM 478 CB ALA A 432 20.352 -16.075 -2.096 1.00 0.00 C ATOM 0 H ALA A 432 20.557 -13.892 -0.965 1.00 0.00 H new ATOM 0 HA ALA A 432 20.000 -14.557 -3.544 1.00 0.00 H new ATOM 0 HB1 ALA A 432 20.212 -16.883 -2.814 1.00 0.00 H new ATOM 0 HB2 ALA A 432 21.414 -15.844 -2.012 1.00 0.00 H new ATOM 0 HB3 ALA A 432 19.970 -16.384 -1.123 1.00 0.00 H new ATOM 484 N GLY A 433 17.554 -14.520 -3.813 1.00 0.00 N ATOM 485 CA GLY A 433 16.140 -14.683 -4.109 1.00 0.00 C ATOM 486 C GLY A 433 15.347 -13.441 -3.698 1.00 0.00 C ATOM 487 O GLY A 433 14.317 -13.549 -3.034 1.00 0.00 O ATOM 0 H GLY A 433 18.065 -13.941 -4.479 1.00 0.00 H new ATOM 0 HA2 GLY A 433 16.007 -14.867 -5.175 1.00 0.00 H new ATOM 0 HA3 GLY A 433 15.753 -15.556 -3.584 1.00 0.00 H new ATOM 491 N ASP A 434 15.857 -12.290 -4.110 1.00 0.00 N ATOM 492 CA ASP A 434 15.209 -11.028 -3.793 1.00 0.00 C ATOM 493 C ASP A 434 14.697 -10.385 -5.084 1.00 0.00 C ATOM 494 O ASP A 434 15.060 -10.809 -6.180 1.00 0.00 O ATOM 495 CB ASP A 434 16.190 -10.055 -3.137 1.00 0.00 C ATOM 496 CG ASP A 434 15.542 -8.866 -2.424 1.00 0.00 C ATOM 497 OD1 ASP A 434 14.309 -8.927 -2.225 1.00 0.00 O ATOM 498 OD2 ASP A 434 16.294 -7.924 -2.094 1.00 0.00 O ATOM 0 H ASP A 434 16.711 -12.204 -4.661 1.00 0.00 H new ATOM 0 HA ASP A 434 14.390 -11.233 -3.104 1.00 0.00 H new ATOM 0 HB2 ASP A 434 16.797 -10.604 -2.417 1.00 0.00 H new ATOM 0 HB3 ASP A 434 16.868 -9.675 -3.901 1.00 0.00 H new ATOM 503 N VAL A 435 13.861 -9.372 -4.910 1.00 0.00 N ATOM 504 CA VAL A 435 13.295 -8.666 -6.047 1.00 0.00 C ATOM 505 C VAL A 435 13.778 -7.214 -6.033 1.00 0.00 C ATOM 506 O VAL A 435 13.562 -6.494 -5.059 1.00 0.00 O ATOM 507 CB VAL A 435 11.770 -8.788 -6.033 1.00 0.00 C ATOM 508 CG1 VAL A 435 11.320 -10.111 -6.657 1.00 0.00 C ATOM 509 CG2 VAL A 435 11.221 -8.637 -4.613 1.00 0.00 C ATOM 0 H VAL A 435 13.562 -9.023 -3.999 1.00 0.00 H new ATOM 0 HA VAL A 435 13.635 -9.113 -6.981 1.00 0.00 H new ATOM 0 HB VAL A 435 11.363 -7.977 -6.637 1.00 0.00 H new ATOM 0 HG11 VAL A 435 10.232 -10.172 -6.634 1.00 0.00 H new ATOM 0 HG12 VAL A 435 11.665 -10.162 -7.690 1.00 0.00 H new ATOM 0 HG13 VAL A 435 11.742 -10.942 -6.092 1.00 0.00 H new ATOM 0 HG21 VAL A 435 10.135 -8.728 -4.631 1.00 0.00 H new ATOM 0 HG22 VAL A 435 11.640 -9.416 -3.976 1.00 0.00 H new ATOM 0 HG23 VAL A 435 11.497 -7.659 -4.218 1.00 0.00 H new ATOM 519 N VAL A 436 14.424 -6.828 -7.123 1.00 0.00 N ATOM 520 CA VAL A 436 14.939 -5.475 -7.248 1.00 0.00 C ATOM 521 C VAL A 436 14.609 -4.935 -8.641 1.00 0.00 C ATOM 522 O VAL A 436 14.669 -5.669 -9.626 1.00 0.00 O ATOM 523 CB VAL A 436 16.438 -5.456 -6.939 1.00 0.00 C ATOM 524 CG1 VAL A 436 17.121 -4.264 -7.612 1.00 0.00 C ATOM 525 CG2 VAL A 436 16.685 -5.449 -5.429 1.00 0.00 C ATOM 0 H VAL A 436 14.603 -7.428 -7.928 1.00 0.00 H new ATOM 0 HA VAL A 436 14.462 -4.816 -6.523 1.00 0.00 H new ATOM 0 HB VAL A 436 16.877 -6.367 -7.346 1.00 0.00 H new ATOM 0 HG11 VAL A 436 18.185 -4.274 -7.377 1.00 0.00 H new ATOM 0 HG12 VAL A 436 16.988 -4.330 -8.692 1.00 0.00 H new ATOM 0 HG13 VAL A 436 16.677 -3.337 -7.248 1.00 0.00 H new ATOM 0 HG21 VAL A 436 17.758 -5.436 -5.236 1.00 0.00 H new ATOM 0 HG22 VAL A 436 16.226 -4.564 -4.989 1.00 0.00 H new ATOM 0 HG23 VAL A 436 16.248 -6.343 -4.985 1.00 0.00 H new ATOM 535 N LEU A 437 14.269 -3.655 -8.679 1.00 0.00 N ATOM 536 CA LEU A 437 13.929 -3.008 -9.935 1.00 0.00 C ATOM 537 C LEU A 437 15.084 -2.101 -10.364 1.00 0.00 C ATOM 538 O LEU A 437 15.594 -1.317 -9.564 1.00 0.00 O ATOM 539 CB LEU A 437 12.588 -2.281 -9.818 1.00 0.00 C ATOM 540 CG LEU A 437 12.037 -2.113 -8.400 1.00 0.00 C ATOM 541 CD1 LEU A 437 10.906 -1.084 -8.370 1.00 0.00 C ATOM 542 CD2 LEU A 437 11.604 -3.460 -7.817 1.00 0.00 C ATOM 0 H LEU A 437 14.222 -3.049 -7.860 1.00 0.00 H new ATOM 0 HA LEU A 437 13.795 -3.750 -10.722 1.00 0.00 H new ATOM 0 HB2 LEU A 437 12.693 -1.292 -10.265 1.00 0.00 H new ATOM 0 HB3 LEU A 437 11.851 -2.822 -10.411 1.00 0.00 H new ATOM 0 HG LEU A 437 12.836 -1.730 -7.765 1.00 0.00 H new ATOM 0 HD11 LEU A 437 10.532 -0.984 -7.351 1.00 0.00 H new ATOM 0 HD12 LEU A 437 11.281 -0.121 -8.715 1.00 0.00 H new ATOM 0 HD13 LEU A 437 10.097 -1.413 -9.022 1.00 0.00 H new ATOM 0 HD21 LEU A 437 11.216 -3.312 -6.809 1.00 0.00 H new ATOM 0 HD22 LEU A 437 10.826 -3.895 -8.445 1.00 0.00 H new ATOM 0 HD23 LEU A 437 12.460 -4.133 -7.781 1.00 0.00 H new ATOM 554 N VAL A 438 15.464 -2.237 -11.626 1.00 0.00 N ATOM 555 CA VAL A 438 16.549 -1.440 -12.172 1.00 0.00 C ATOM 556 C VAL A 438 16.033 -0.035 -12.493 1.00 0.00 C ATOM 557 O VAL A 438 15.116 0.124 -13.297 1.00 0.00 O ATOM 558 CB VAL A 438 17.157 -2.145 -13.386 1.00 0.00 C ATOM 559 CG1 VAL A 438 18.392 -1.396 -13.893 1.00 0.00 C ATOM 560 CG2 VAL A 438 17.494 -3.602 -13.062 1.00 0.00 C ATOM 0 H VAL A 438 15.039 -2.888 -12.287 1.00 0.00 H new ATOM 0 HA VAL A 438 17.350 -1.333 -11.440 1.00 0.00 H new ATOM 0 HB VAL A 438 16.413 -2.143 -14.183 1.00 0.00 H new ATOM 0 HG11 VAL A 438 18.805 -1.918 -14.756 1.00 0.00 H new ATOM 0 HG12 VAL A 438 18.110 -0.383 -14.182 1.00 0.00 H new ATOM 0 HG13 VAL A 438 19.141 -1.353 -13.103 1.00 0.00 H new ATOM 0 HG21 VAL A 438 17.925 -4.080 -13.942 1.00 0.00 H new ATOM 0 HG22 VAL A 438 18.212 -3.636 -12.243 1.00 0.00 H new ATOM 0 HG23 VAL A 438 16.586 -4.129 -12.770 1.00 0.00 H new ATOM 570 N ILE A 439 16.645 0.947 -11.847 1.00 0.00 N ATOM 571 CA ILE A 439 16.259 2.332 -12.054 1.00 0.00 C ATOM 572 C ILE A 439 17.501 3.158 -12.394 1.00 0.00 C ATOM 573 O ILE A 439 18.610 2.813 -11.989 1.00 0.00 O ATOM 574 CB ILE A 439 15.482 2.858 -10.845 1.00 0.00 C ATOM 575 CG1 ILE A 439 16.394 2.992 -9.624 1.00 0.00 C ATOM 576 CG2 ILE A 439 14.261 1.984 -10.555 1.00 0.00 C ATOM 577 CD1 ILE A 439 16.318 1.743 -8.743 1.00 0.00 C ATOM 0 H ILE A 439 17.405 0.811 -11.180 1.00 0.00 H new ATOM 0 HA ILE A 439 15.579 2.415 -12.902 1.00 0.00 H new ATOM 0 HB ILE A 439 15.114 3.856 -11.083 1.00 0.00 H new ATOM 0 HG12 ILE A 439 17.422 3.150 -9.949 1.00 0.00 H new ATOM 0 HG13 ILE A 439 16.105 3.869 -9.044 1.00 0.00 H new ATOM 0 HG21 ILE A 439 13.727 2.380 -9.691 1.00 0.00 H new ATOM 0 HG22 ILE A 439 13.600 1.984 -11.422 1.00 0.00 H new ATOM 0 HG23 ILE A 439 14.585 0.965 -10.345 1.00 0.00 H new ATOM 0 HD11 ILE A 439 16.976 1.864 -7.882 1.00 0.00 H new ATOM 0 HD12 ILE A 439 15.293 1.602 -8.400 1.00 0.00 H new ATOM 0 HD13 ILE A 439 16.631 0.872 -9.319 1.00 0.00 H new ATOM 589 N PRO A 440 17.267 4.262 -13.153 1.00 0.00 N ATOM 590 CA PRO A 440 18.354 5.140 -13.552 1.00 0.00 C ATOM 591 C PRO A 440 18.820 6.003 -12.378 1.00 0.00 C ATOM 592 O PRO A 440 18.057 6.816 -11.860 1.00 0.00 O ATOM 593 CB PRO A 440 17.797 5.957 -14.706 1.00 0.00 C ATOM 594 CG PRO A 440 16.285 5.838 -14.609 1.00 0.00 C ATOM 595 CD PRO A 440 15.967 4.702 -13.651 1.00 0.00 C ATOM 0 HA PRO A 440 19.244 4.593 -13.863 1.00 0.00 H new ATOM 0 HB2 PRO A 440 18.112 6.998 -14.635 1.00 0.00 H new ATOM 0 HB3 PRO A 440 18.158 5.579 -15.662 1.00 0.00 H new ATOM 0 HG2 PRO A 440 15.851 6.772 -14.251 1.00 0.00 H new ATOM 0 HG3 PRO A 440 15.854 5.641 -15.591 1.00 0.00 H new ATOM 0 HD2 PRO A 440 15.324 5.038 -12.837 1.00 0.00 H new ATOM 0 HD3 PRO A 440 15.442 3.892 -14.158 1.00 0.00 H new ATOM 603 N PHE A 441 20.072 5.798 -11.994 1.00 0.00 N ATOM 604 CA PHE A 441 20.648 6.548 -10.891 1.00 0.00 C ATOM 605 C PHE A 441 20.660 8.048 -11.195 1.00 0.00 C ATOM 606 O PHE A 441 20.149 8.480 -12.226 1.00 0.00 O ATOM 607 CB PHE A 441 22.090 6.062 -10.725 1.00 0.00 C ATOM 608 CG PHE A 441 22.795 5.745 -12.045 1.00 0.00 C ATOM 609 CD1 PHE A 441 22.474 6.437 -13.171 1.00 0.00 C ATOM 610 CD2 PHE A 441 23.744 4.772 -12.092 1.00 0.00 C ATOM 611 CE1 PHE A 441 23.129 6.142 -14.396 1.00 0.00 C ATOM 612 CE2 PHE A 441 24.399 4.478 -13.318 1.00 0.00 C ATOM 613 CZ PHE A 441 24.078 5.169 -14.444 1.00 0.00 C ATOM 0 H PHE A 441 20.703 5.124 -12.427 1.00 0.00 H new ATOM 0 HA PHE A 441 20.059 6.392 -9.987 1.00 0.00 H new ATOM 0 HB2 PHE A 441 22.661 6.824 -10.194 1.00 0.00 H new ATOM 0 HB3 PHE A 441 22.092 5.169 -10.100 1.00 0.00 H new ATOM 0 HD1 PHE A 441 21.721 7.211 -13.134 1.00 0.00 H new ATOM 0 HD2 PHE A 441 24.000 4.223 -11.198 1.00 0.00 H new ATOM 0 HE1 PHE A 441 22.873 6.691 -15.290 1.00 0.00 H new ATOM 0 HE2 PHE A 441 25.152 3.705 -13.356 1.00 0.00 H new ATOM 0 HZ PHE A 441 24.576 4.945 -15.376 1.00 0.00 H new ATOM 623 N GLN A 442 21.250 8.800 -10.277 1.00 0.00 N ATOM 624 CA GLN A 442 21.335 10.242 -10.433 1.00 0.00 C ATOM 625 C GLN A 442 22.495 10.608 -11.362 1.00 0.00 C ATOM 626 O GLN A 442 22.516 11.695 -11.936 1.00 0.00 O ATOM 627 CB GLN A 442 21.480 10.933 -9.076 1.00 0.00 C ATOM 628 CG GLN A 442 22.808 10.563 -8.412 1.00 0.00 C ATOM 629 CD GLN A 442 22.936 11.223 -7.038 1.00 0.00 C ATOM 630 OE1 GLN A 442 23.628 12.211 -6.857 1.00 0.00 O ATOM 631 NE2 GLN A 442 22.232 10.623 -6.082 1.00 0.00 N ATOM 0 H GLN A 442 21.674 8.438 -9.423 1.00 0.00 H new ATOM 0 HA GLN A 442 20.408 10.594 -10.885 1.00 0.00 H new ATOM 0 HB2 GLN A 442 21.423 12.014 -9.206 1.00 0.00 H new ATOM 0 HB3 GLN A 442 20.652 10.646 -8.427 1.00 0.00 H new ATOM 0 HG2 GLN A 442 22.877 9.480 -8.307 1.00 0.00 H new ATOM 0 HG3 GLN A 442 23.636 10.875 -9.048 1.00 0.00 H new ATOM 0 HE21 GLN A 442 21.673 9.799 -6.302 1.00 0.00 H new ATOM 0 HE22 GLN A 442 22.251 10.987 -5.129 1.00 0.00 H new ATOM 640 N ASN A 443 23.431 9.678 -11.481 1.00 0.00 N ATOM 641 CA ASN A 443 24.591 9.889 -12.330 1.00 0.00 C ATOM 642 C ASN A 443 25.352 8.570 -12.484 1.00 0.00 C ATOM 643 O ASN A 443 25.367 7.748 -11.569 1.00 0.00 O ATOM 644 CB ASN A 443 25.544 10.916 -11.716 1.00 0.00 C ATOM 645 CG ASN A 443 25.745 12.108 -12.654 1.00 0.00 C ATOM 646 OD1 ASN A 443 24.823 12.841 -12.974 1.00 0.00 O ATOM 647 ND2 ASN A 443 26.997 12.260 -13.076 1.00 0.00 N ATOM 0 H ASN A 443 23.410 8.777 -11.004 1.00 0.00 H new ATOM 0 HA ASN A 443 24.240 10.255 -13.295 1.00 0.00 H new ATOM 0 HB2 ASN A 443 25.146 11.262 -10.762 1.00 0.00 H new ATOM 0 HB3 ASN A 443 26.505 10.446 -11.508 1.00 0.00 H new ATOM 0 HD21 ASN A 443 27.233 13.026 -13.706 1.00 0.00 H new ATOM 0 HD22 ASN A 443 27.721 11.610 -12.769 1.00 0.00 H new ATOM 654 N PRO A 444 25.981 8.405 -13.678 1.00 0.00 N ATOM 655 CA PRO A 444 26.742 7.200 -13.963 1.00 0.00 C ATOM 656 C PRO A 444 28.080 7.208 -13.220 1.00 0.00 C ATOM 657 O PRO A 444 28.714 6.166 -13.065 1.00 0.00 O ATOM 658 CB PRO A 444 26.902 7.184 -15.474 1.00 0.00 C ATOM 659 CG PRO A 444 26.632 8.606 -15.937 1.00 0.00 C ATOM 660 CD PRO A 444 25.985 9.357 -14.785 1.00 0.00 C ATOM 0 HA PRO A 444 26.241 6.295 -13.619 1.00 0.00 H new ATOM 0 HB2 PRO A 444 27.905 6.865 -15.757 1.00 0.00 H new ATOM 0 HB3 PRO A 444 26.204 6.485 -15.933 1.00 0.00 H new ATOM 0 HG2 PRO A 444 27.560 9.093 -16.236 1.00 0.00 H new ATOM 0 HG3 PRO A 444 25.977 8.606 -16.808 1.00 0.00 H new ATOM 0 HD2 PRO A 444 26.548 10.256 -14.532 1.00 0.00 H new ATOM 0 HD3 PRO A 444 24.973 9.675 -15.038 1.00 0.00 H new ATOM 668 N GLU A 445 28.469 8.396 -12.780 1.00 0.00 N ATOM 669 CA GLU A 445 29.719 8.554 -12.058 1.00 0.00 C ATOM 670 C GLU A 445 29.605 7.943 -10.659 1.00 0.00 C ATOM 671 O GLU A 445 30.615 7.630 -10.030 1.00 0.00 O ATOM 672 CB GLU A 445 30.127 10.026 -11.981 1.00 0.00 C ATOM 673 CG GLU A 445 30.390 10.596 -13.377 1.00 0.00 C ATOM 674 CD GLU A 445 31.889 10.775 -13.622 1.00 0.00 C ATOM 675 OE1 GLU A 445 32.597 9.745 -13.591 1.00 0.00 O ATOM 676 OE2 GLU A 445 32.294 11.938 -13.835 1.00 0.00 O ATOM 0 H GLU A 445 27.940 9.258 -12.910 1.00 0.00 H new ATOM 0 HA GLU A 445 30.499 8.023 -12.603 1.00 0.00 H new ATOM 0 HB2 GLU A 445 29.340 10.600 -11.492 1.00 0.00 H new ATOM 0 HB3 GLU A 445 31.023 10.127 -11.368 1.00 0.00 H new ATOM 0 HG2 GLU A 445 29.972 9.929 -14.131 1.00 0.00 H new ATOM 0 HG3 GLU A 445 29.883 11.555 -13.484 1.00 0.00 H new ATOM 683 N GLU A 446 28.366 7.792 -10.214 1.00 0.00 N ATOM 684 CA GLU A 446 28.107 7.224 -8.902 1.00 0.00 C ATOM 685 C GLU A 446 27.924 5.709 -9.006 1.00 0.00 C ATOM 686 O GLU A 446 27.719 5.034 -7.998 1.00 0.00 O ATOM 687 CB GLU A 446 26.887 7.880 -8.252 1.00 0.00 C ATOM 688 CG GLU A 446 25.588 7.289 -8.803 1.00 0.00 C ATOM 689 CD GLU A 446 24.877 6.445 -7.743 1.00 0.00 C ATOM 690 OE1 GLU A 446 25.600 5.789 -6.962 1.00 0.00 O ATOM 691 OE2 GLU A 446 23.628 6.474 -7.738 1.00 0.00 O ATOM 0 H GLU A 446 27.531 8.053 -10.738 1.00 0.00 H new ATOM 0 HA GLU A 446 28.969 7.423 -8.265 1.00 0.00 H new ATOM 0 HB2 GLU A 446 26.926 7.738 -7.172 1.00 0.00 H new ATOM 0 HB3 GLU A 446 26.908 8.955 -8.433 1.00 0.00 H new ATOM 0 HG2 GLU A 446 24.930 8.093 -9.134 1.00 0.00 H new ATOM 0 HG3 GLU A 446 25.806 6.674 -9.677 1.00 0.00 H new ATOM 698 N GLN A 447 28.006 5.218 -10.234 1.00 0.00 N ATOM 699 CA GLN A 447 27.852 3.794 -10.482 1.00 0.00 C ATOM 700 C GLN A 447 29.223 3.121 -10.574 1.00 0.00 C ATOM 701 O GLN A 447 30.209 3.759 -10.939 1.00 0.00 O ATOM 702 CB GLN A 447 27.033 3.545 -11.749 1.00 0.00 C ATOM 703 CG GLN A 447 26.179 2.283 -11.610 1.00 0.00 C ATOM 704 CD GLN A 447 26.081 1.537 -12.943 1.00 0.00 C ATOM 705 OE1 GLN A 447 25.034 1.459 -13.564 1.00 0.00 O ATOM 706 NE2 GLN A 447 27.227 0.995 -13.345 1.00 0.00 N ATOM 0 H GLN A 447 28.177 5.780 -11.068 1.00 0.00 H new ATOM 0 HA GLN A 447 27.309 3.355 -9.645 1.00 0.00 H new ATOM 0 HB2 GLN A 447 26.391 4.403 -11.946 1.00 0.00 H new ATOM 0 HB3 GLN A 447 27.701 3.444 -12.604 1.00 0.00 H new ATOM 0 HG2 GLN A 447 26.612 1.628 -10.854 1.00 0.00 H new ATOM 0 HG3 GLN A 447 25.180 2.552 -11.265 1.00 0.00 H new ATOM 0 HE21 GLN A 447 28.067 1.098 -12.776 1.00 0.00 H new ATOM 0 HE22 GLN A 447 27.266 0.476 -14.222 1.00 0.00 H new ATOM 715 N ASP A 448 29.241 1.839 -10.237 1.00 0.00 N ATOM 716 CA ASP A 448 30.474 1.072 -10.276 1.00 0.00 C ATOM 717 C ASP A 448 30.446 0.133 -11.484 1.00 0.00 C ATOM 718 O ASP A 448 29.416 -0.010 -12.140 1.00 0.00 O ATOM 719 CB ASP A 448 30.632 0.218 -9.017 1.00 0.00 C ATOM 720 CG ASP A 448 32.069 -0.198 -8.694 1.00 0.00 C ATOM 721 OD1 ASP A 448 32.757 0.608 -8.031 1.00 0.00 O ATOM 722 OD2 ASP A 448 32.446 -1.312 -9.117 1.00 0.00 O ATOM 0 H ASP A 448 28.421 1.313 -9.936 1.00 0.00 H new ATOM 0 HA ASP A 448 31.306 1.773 -10.342 1.00 0.00 H new ATOM 0 HB2 ASP A 448 30.230 0.771 -8.168 1.00 0.00 H new ATOM 0 HB3 ASP A 448 30.026 -0.681 -9.127 1.00 0.00 H new ATOM 727 N GLU A 449 31.591 -0.484 -11.740 1.00 0.00 N ATOM 728 CA GLU A 449 31.711 -1.405 -12.857 1.00 0.00 C ATOM 729 C GLU A 449 31.158 -2.779 -12.473 1.00 0.00 C ATOM 730 O GLU A 449 31.835 -3.562 -11.809 1.00 0.00 O ATOM 731 CB GLU A 449 33.163 -1.511 -13.327 1.00 0.00 C ATOM 732 CG GLU A 449 33.237 -1.654 -14.849 1.00 0.00 C ATOM 733 CD GLU A 449 34.355 -0.785 -15.428 1.00 0.00 C ATOM 734 OE1 GLU A 449 34.298 0.442 -15.196 1.00 0.00 O ATOM 735 OE2 GLU A 449 35.242 -1.366 -16.089 1.00 0.00 O ATOM 0 H GLU A 449 32.443 -0.364 -11.193 1.00 0.00 H new ATOM 0 HA GLU A 449 31.122 -1.016 -13.688 1.00 0.00 H new ATOM 0 HB2 GLU A 449 33.716 -0.625 -13.014 1.00 0.00 H new ATOM 0 HB3 GLU A 449 33.641 -2.369 -12.854 1.00 0.00 H new ATOM 0 HG2 GLU A 449 33.410 -2.698 -15.112 1.00 0.00 H new ATOM 0 HG3 GLU A 449 32.283 -1.368 -15.291 1.00 0.00 H new ATOM 742 N GLY A 450 29.932 -3.031 -12.908 1.00 0.00 N ATOM 743 CA GLY A 450 29.280 -4.297 -12.619 1.00 0.00 C ATOM 744 C GLY A 450 28.148 -4.111 -11.606 1.00 0.00 C ATOM 745 O GLY A 450 27.467 -5.071 -11.248 1.00 0.00 O ATOM 0 H GLY A 450 29.373 -2.380 -13.459 1.00 0.00 H new ATOM 0 HA2 GLY A 450 28.883 -4.724 -13.540 1.00 0.00 H new ATOM 0 HA3 GLY A 450 30.010 -5.006 -12.228 1.00 0.00 H new ATOM 749 N TRP A 451 27.983 -2.871 -11.172 1.00 0.00 N ATOM 750 CA TRP A 451 26.946 -2.547 -10.207 1.00 0.00 C ATOM 751 C TRP A 451 26.131 -1.377 -10.763 1.00 0.00 C ATOM 752 O TRP A 451 26.678 -0.493 -11.420 1.00 0.00 O ATOM 753 CB TRP A 451 27.548 -2.256 -8.831 1.00 0.00 C ATOM 754 CG TRP A 451 28.765 -3.118 -8.490 1.00 0.00 C ATOM 755 CD1 TRP A 451 29.874 -3.305 -9.219 1.00 0.00 C ATOM 756 CD2 TRP A 451 28.954 -3.906 -7.296 1.00 0.00 C ATOM 757 NE1 TRP A 451 30.759 -4.153 -8.585 1.00 0.00 N ATOM 758 CE2 TRP A 451 30.182 -4.530 -7.378 1.00 0.00 C ATOM 759 CE3 TRP A 451 28.114 -4.086 -6.183 1.00 0.00 C ATOM 760 CZ2 TRP A 451 30.681 -5.376 -6.380 1.00 0.00 C ATOM 761 CZ3 TRP A 451 28.627 -4.934 -5.194 1.00 0.00 C ATOM 762 CH2 TRP A 451 29.861 -5.570 -5.262 1.00 0.00 C ATOM 0 H TRP A 451 28.550 -2.078 -11.471 1.00 0.00 H new ATOM 0 HA TRP A 451 26.279 -3.396 -10.058 1.00 0.00 H new ATOM 0 HB2 TRP A 451 27.835 -1.206 -8.786 1.00 0.00 H new ATOM 0 HB3 TRP A 451 26.782 -2.410 -8.071 1.00 0.00 H new ATOM 0 HD1 TRP A 451 30.053 -2.849 -10.182 1.00 0.00 H new ATOM 0 HE1 TRP A 451 31.669 -4.449 -8.937 1.00 0.00 H new ATOM 0 HE3 TRP A 451 27.149 -3.608 -6.098 1.00 0.00 H new ATOM 0 HZ2 TRP A 451 31.646 -5.853 -6.468 1.00 0.00 H new ATOM 0 HZ3 TRP A 451 28.021 -5.106 -4.317 1.00 0.00 H new ATOM 0 HH2 TRP A 451 30.186 -6.211 -4.456 1.00 0.00 H new ATOM 773 N LEU A 452 24.838 -1.410 -10.478 1.00 0.00 N ATOM 774 CA LEU A 452 23.943 -0.364 -10.941 1.00 0.00 C ATOM 775 C LEU A 452 22.999 0.034 -9.805 1.00 0.00 C ATOM 776 O LEU A 452 22.979 -0.609 -8.756 1.00 0.00 O ATOM 777 CB LEU A 452 23.219 -0.802 -12.216 1.00 0.00 C ATOM 778 CG LEU A 452 23.306 -2.291 -12.558 1.00 0.00 C ATOM 779 CD1 LEU A 452 22.758 -3.149 -11.416 1.00 0.00 C ATOM 780 CD2 LEU A 452 22.608 -2.590 -13.886 1.00 0.00 C ATOM 0 H LEU A 452 24.389 -2.145 -9.932 1.00 0.00 H new ATOM 0 HA LEU A 452 24.509 0.527 -11.213 1.00 0.00 H new ATOM 0 HB2 LEU A 452 22.167 -0.531 -12.124 1.00 0.00 H new ATOM 0 HB3 LEU A 452 23.623 -0.233 -13.053 1.00 0.00 H new ATOM 0 HG LEU A 452 24.357 -2.552 -12.681 1.00 0.00 H new ATOM 0 HD11 LEU A 452 22.832 -4.203 -11.685 1.00 0.00 H new ATOM 0 HD12 LEU A 452 23.337 -2.964 -10.512 1.00 0.00 H new ATOM 0 HD13 LEU A 452 21.714 -2.892 -11.237 1.00 0.00 H new ATOM 0 HD21 LEU A 452 22.684 -3.655 -14.106 1.00 0.00 H new ATOM 0 HD22 LEU A 452 21.557 -2.308 -13.816 1.00 0.00 H new ATOM 0 HD23 LEU A 452 23.084 -2.020 -14.684 1.00 0.00 H new ATOM 792 N MET A 453 22.240 1.092 -10.051 1.00 0.00 N ATOM 793 CA MET A 453 21.296 1.583 -9.062 1.00 0.00 C ATOM 794 C MET A 453 19.932 0.909 -9.223 1.00 0.00 C ATOM 795 O MET A 453 19.253 1.106 -10.229 1.00 0.00 O ATOM 796 CB MET A 453 21.138 3.097 -9.214 1.00 0.00 C ATOM 797 CG MET A 453 19.935 3.606 -8.418 1.00 0.00 C ATOM 798 SD MET A 453 20.374 5.088 -7.525 1.00 0.00 S ATOM 799 CE MET A 453 21.549 4.412 -6.363 1.00 0.00 C ATOM 0 H MET A 453 22.260 1.623 -10.922 1.00 0.00 H new ATOM 0 HA MET A 453 21.682 1.347 -8.071 1.00 0.00 H new ATOM 0 HB2 MET A 453 22.044 3.597 -8.870 1.00 0.00 H new ATOM 0 HB3 MET A 453 21.015 3.349 -10.267 1.00 0.00 H new ATOM 0 HG2 MET A 453 19.103 3.811 -9.092 1.00 0.00 H new ATOM 0 HG3 MET A 453 19.599 2.838 -7.721 1.00 0.00 H new ATOM 0 HE1 MET A 453 22.338 5.141 -6.178 1.00 0.00 H new ATOM 0 HE2 MET A 453 21.042 4.180 -5.426 1.00 0.00 H new ATOM 0 HE3 MET A 453 21.985 3.502 -6.775 1.00 0.00 H new ATOM 809 N GLY A 454 19.572 0.127 -8.216 1.00 0.00 N ATOM 810 CA GLY A 454 18.301 -0.578 -8.233 1.00 0.00 C ATOM 811 C GLY A 454 17.546 -0.379 -6.917 1.00 0.00 C ATOM 812 O GLY A 454 18.090 0.175 -5.963 1.00 0.00 O ATOM 0 H GLY A 454 20.138 -0.034 -7.383 1.00 0.00 H new ATOM 0 HA2 GLY A 454 17.693 -0.219 -9.063 1.00 0.00 H new ATOM 0 HA3 GLY A 454 18.473 -1.641 -8.401 1.00 0.00 H new ATOM 816 N VAL A 455 16.305 -0.843 -6.908 1.00 0.00 N ATOM 817 CA VAL A 455 15.470 -0.723 -5.725 1.00 0.00 C ATOM 818 C VAL A 455 14.713 -2.034 -5.505 1.00 0.00 C ATOM 819 O VAL A 455 14.289 -2.678 -6.464 1.00 0.00 O ATOM 820 CB VAL A 455 14.543 0.487 -5.859 1.00 0.00 C ATOM 821 CG1 VAL A 455 13.723 0.409 -7.148 1.00 0.00 C ATOM 822 CG2 VAL A 455 13.633 0.619 -4.637 1.00 0.00 C ATOM 0 H VAL A 455 15.858 -1.303 -7.701 1.00 0.00 H new ATOM 0 HA VAL A 455 16.084 -0.549 -4.841 1.00 0.00 H new ATOM 0 HB VAL A 455 15.165 1.381 -5.911 1.00 0.00 H new ATOM 0 HG11 VAL A 455 13.073 1.281 -7.219 1.00 0.00 H new ATOM 0 HG12 VAL A 455 14.395 0.387 -8.006 1.00 0.00 H new ATOM 0 HG13 VAL A 455 13.116 -0.497 -7.139 1.00 0.00 H new ATOM 0 HG21 VAL A 455 12.985 1.487 -4.758 1.00 0.00 H new ATOM 0 HG22 VAL A 455 13.023 -0.279 -4.539 1.00 0.00 H new ATOM 0 HG23 VAL A 455 14.242 0.743 -3.742 1.00 0.00 H new ATOM 832 N LYS A 456 14.566 -2.390 -4.238 1.00 0.00 N ATOM 833 CA LYS A 456 13.868 -3.613 -3.880 1.00 0.00 C ATOM 834 C LYS A 456 12.361 -3.399 -4.037 1.00 0.00 C ATOM 835 O LYS A 456 11.891 -2.262 -4.059 1.00 0.00 O ATOM 836 CB LYS A 456 14.281 -4.077 -2.482 1.00 0.00 C ATOM 837 CG LYS A 456 15.113 -5.359 -2.554 1.00 0.00 C ATOM 838 CD LYS A 456 16.594 -5.066 -2.306 1.00 0.00 C ATOM 839 CE LYS A 456 16.832 -4.627 -0.859 1.00 0.00 C ATOM 840 NZ LYS A 456 16.980 -5.807 0.022 1.00 0.00 N ATOM 0 H LYS A 456 14.918 -1.853 -3.446 1.00 0.00 H new ATOM 0 HA LYS A 456 14.148 -4.423 -4.554 1.00 0.00 H new ATOM 0 HB2 LYS A 456 14.856 -3.293 -1.990 1.00 0.00 H new ATOM 0 HB3 LYS A 456 13.392 -4.249 -1.875 1.00 0.00 H new ATOM 0 HG2 LYS A 456 14.751 -6.074 -1.815 1.00 0.00 H new ATOM 0 HG3 LYS A 456 14.989 -5.823 -3.533 1.00 0.00 H new ATOM 0 HD2 LYS A 456 17.185 -5.956 -2.522 1.00 0.00 H new ATOM 0 HD3 LYS A 456 16.933 -4.285 -2.987 1.00 0.00 H new ATOM 0 HE2 LYS A 456 17.728 -4.009 -0.803 1.00 0.00 H new ATOM 0 HE3 LYS A 456 15.999 -4.013 -0.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 456 16.672 -5.562 0.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 456 16.395 -6.587 -0.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 456 17.977 -6.102 0.042 1.00 0.00 H new ATOM 854 N GLU A 457 11.645 -4.509 -4.141 1.00 0.00 N ATOM 855 CA GLU A 457 10.201 -4.457 -4.294 1.00 0.00 C ATOM 856 C GLU A 457 9.568 -3.724 -3.110 1.00 0.00 C ATOM 857 O GLU A 457 8.645 -2.930 -3.288 1.00 0.00 O ATOM 858 CB GLU A 457 9.615 -5.862 -4.447 1.00 0.00 C ATOM 859 CG GLU A 457 8.110 -5.862 -4.170 1.00 0.00 C ATOM 860 CD GLU A 457 7.409 -6.978 -4.947 1.00 0.00 C ATOM 861 OE1 GLU A 457 7.706 -8.154 -4.642 1.00 0.00 O ATOM 862 OE2 GLU A 457 6.593 -6.631 -5.827 1.00 0.00 O ATOM 0 H GLU A 457 12.038 -5.450 -4.122 1.00 0.00 H new ATOM 0 HA GLU A 457 9.971 -3.903 -5.204 1.00 0.00 H new ATOM 0 HB2 GLU A 457 9.803 -6.230 -5.456 1.00 0.00 H new ATOM 0 HB3 GLU A 457 10.115 -6.545 -3.760 1.00 0.00 H new ATOM 0 HG2 GLU A 457 7.933 -5.991 -3.102 1.00 0.00 H new ATOM 0 HG3 GLU A 457 7.685 -4.898 -4.449 1.00 0.00 H new ATOM 869 N SER A 458 10.088 -4.017 -1.927 1.00 0.00 N ATOM 870 CA SER A 458 9.584 -3.396 -0.714 1.00 0.00 C ATOM 871 C SER A 458 9.770 -1.879 -0.787 1.00 0.00 C ATOM 872 O SER A 458 8.906 -1.123 -0.345 1.00 0.00 O ATOM 873 CB SER A 458 10.286 -3.958 0.524 1.00 0.00 C ATOM 874 OG SER A 458 9.360 -4.316 1.546 1.00 0.00 O ATOM 0 H SER A 458 10.853 -4.676 -1.783 1.00 0.00 H new ATOM 0 HA SER A 458 8.521 -3.622 -0.630 1.00 0.00 H new ATOM 0 HB2 SER A 458 10.872 -4.833 0.243 1.00 0.00 H new ATOM 0 HB3 SER A 458 10.985 -3.217 0.912 1.00 0.00 H new ATOM 0 HG SER A 458 9.847 -4.672 2.318 1.00 0.00 H new ATOM 880 N ASP A 459 10.902 -1.480 -1.347 1.00 0.00 N ATOM 881 CA ASP A 459 11.211 -0.067 -1.484 1.00 0.00 C ATOM 882 C ASP A 459 10.243 0.569 -2.484 1.00 0.00 C ATOM 883 O ASP A 459 9.903 1.745 -2.362 1.00 0.00 O ATOM 884 CB ASP A 459 12.634 0.138 -2.008 1.00 0.00 C ATOM 885 CG ASP A 459 13.731 0.077 -0.943 1.00 0.00 C ATOM 886 OD1 ASP A 459 13.999 -1.047 -0.467 1.00 0.00 O ATOM 887 OD2 ASP A 459 14.276 1.157 -0.627 1.00 0.00 O ATOM 0 H ASP A 459 11.616 -2.110 -1.711 1.00 0.00 H new ATOM 0 HA ASP A 459 11.119 0.394 -0.501 1.00 0.00 H new ATOM 0 HB2 ASP A 459 12.840 -0.620 -2.763 1.00 0.00 H new ATOM 0 HB3 ASP A 459 12.686 1.106 -2.506 1.00 0.00 H new ATOM 892 N TRP A 460 9.828 -0.237 -3.450 1.00 0.00 N ATOM 893 CA TRP A 460 8.906 0.232 -4.470 1.00 0.00 C ATOM 894 C TRP A 460 7.716 0.888 -3.767 1.00 0.00 C ATOM 895 O TRP A 460 7.302 1.987 -4.133 1.00 0.00 O ATOM 896 CB TRP A 460 8.494 -0.908 -5.403 1.00 0.00 C ATOM 897 CG TRP A 460 7.811 -0.443 -6.691 1.00 0.00 C ATOM 898 CD1 TRP A 460 7.114 0.683 -6.895 1.00 0.00 C ATOM 899 CD2 TRP A 460 7.788 -1.143 -7.953 1.00 0.00 C ATOM 900 NE1 TRP A 460 6.645 0.760 -8.191 1.00 0.00 N ATOM 901 CE2 TRP A 460 7.068 -0.386 -8.855 1.00 0.00 C ATOM 902 CE3 TRP A 460 8.356 -2.375 -8.321 1.00 0.00 C ATOM 903 CZ2 TRP A 460 6.850 -0.775 -10.181 1.00 0.00 C ATOM 904 CZ3 TRP A 460 8.129 -2.751 -9.650 1.00 0.00 C ATOM 905 CH2 TRP A 460 7.407 -2.000 -10.570 1.00 0.00 C ATOM 0 H TRP A 460 10.113 -1.211 -3.548 1.00 0.00 H new ATOM 0 HA TRP A 460 9.384 0.973 -5.110 1.00 0.00 H new ATOM 0 HB2 TRP A 460 9.379 -1.489 -5.663 1.00 0.00 H new ATOM 0 HB3 TRP A 460 7.820 -1.576 -4.867 1.00 0.00 H new ATOM 0 HD1 TRP A 460 6.941 1.436 -6.140 1.00 0.00 H new ATOM 0 HE1 TRP A 460 6.090 1.518 -8.588 1.00 0.00 H new ATOM 0 HE3 TRP A 460 8.923 -2.984 -7.632 1.00 0.00 H new ATOM 0 HZ2 TRP A 460 6.283 -0.164 -10.868 1.00 0.00 H new ATOM 0 HZ3 TRP A 460 8.544 -3.691 -9.984 1.00 0.00 H new ATOM 0 HH2 TRP A 460 7.276 -2.359 -11.580 1.00 0.00 H new ATOM 1075 N ARG A 470 17.149 4.747 -2.534 1.00 0.00 N ATOM 1076 CA ARG A 470 17.900 4.197 -3.649 1.00 0.00 C ATOM 1077 C ARG A 470 19.216 3.592 -3.156 1.00 0.00 C ATOM 1078 O ARG A 470 19.727 3.981 -2.107 1.00 0.00 O ATOM 1079 CB ARG A 470 18.202 5.273 -4.694 1.00 0.00 C ATOM 1080 CG ARG A 470 16.914 5.941 -5.181 1.00 0.00 C ATOM 1081 CD ARG A 470 16.816 5.895 -6.707 1.00 0.00 C ATOM 1082 NE ARG A 470 17.576 7.020 -7.297 1.00 0.00 N ATOM 1083 CZ ARG A 470 17.456 7.423 -8.569 1.00 0.00 C ATOM 1084 NH1 ARG A 470 16.605 6.796 -9.393 1.00 0.00 N ATOM 1085 NH2 ARG A 470 18.186 8.453 -9.018 1.00 0.00 N ATOM 0 HA ARG A 470 17.289 3.421 -4.109 1.00 0.00 H new ATOM 0 HB2 ARG A 470 18.866 6.024 -4.266 1.00 0.00 H new ATOM 0 HB3 ARG A 470 18.727 4.827 -5.539 1.00 0.00 H new ATOM 0 HG2 ARG A 470 16.052 5.439 -4.742 1.00 0.00 H new ATOM 0 HG3 ARG A 470 16.887 6.977 -4.842 1.00 0.00 H new ATOM 0 HD2 ARG A 470 17.208 4.947 -7.076 1.00 0.00 H new ATOM 0 HD3 ARG A 470 15.772 5.950 -7.014 1.00 0.00 H new ATOM 0 HE ARG A 470 18.232 7.520 -6.697 1.00 0.00 H new ATOM 0 HH11 ARG A 470 16.049 6.012 -9.052 1.00 0.00 H new ATOM 0 HH12 ARG A 470 16.514 7.103 -10.361 1.00 0.00 H new ATOM 0 HH21 ARG A 470 18.834 8.931 -8.391 1.00 0.00 H new ATOM 0 HH22 ARG A 470 18.094 8.759 -9.987 1.00 0.00 H new ATOM 1099 N GLY A 471 19.726 2.650 -3.936 1.00 0.00 N ATOM 1100 CA GLY A 471 20.972 1.987 -3.591 1.00 0.00 C ATOM 1101 C GLY A 471 21.643 1.400 -4.835 1.00 0.00 C ATOM 1102 O GLY A 471 21.130 1.537 -5.944 1.00 0.00 O ATOM 0 H GLY A 471 19.299 2.330 -4.805 1.00 0.00 H new ATOM 0 HA2 GLY A 471 21.645 2.697 -3.111 1.00 0.00 H new ATOM 0 HA3 GLY A 471 20.778 1.194 -2.869 1.00 0.00 H new ATOM 1106 N VAL A 472 22.780 0.759 -4.608 1.00 0.00 N ATOM 1107 CA VAL A 472 23.526 0.150 -5.696 1.00 0.00 C ATOM 1108 C VAL A 472 23.679 -1.348 -5.428 1.00 0.00 C ATOM 1109 O VAL A 472 23.662 -1.782 -4.277 1.00 0.00 O ATOM 1110 CB VAL A 472 24.867 0.866 -5.875 1.00 0.00 C ATOM 1111 CG1 VAL A 472 25.902 -0.062 -6.515 1.00 0.00 C ATOM 1112 CG2 VAL A 472 24.699 2.147 -6.694 1.00 0.00 C ATOM 0 H VAL A 472 23.203 0.648 -3.686 1.00 0.00 H new ATOM 0 HA VAL A 472 22.987 0.258 -6.637 1.00 0.00 H new ATOM 0 HB VAL A 472 25.233 1.146 -4.887 1.00 0.00 H new ATOM 0 HG11 VAL A 472 26.846 0.471 -6.631 1.00 0.00 H new ATOM 0 HG12 VAL A 472 26.053 -0.933 -5.877 1.00 0.00 H new ATOM 0 HG13 VAL A 472 25.545 -0.386 -7.493 1.00 0.00 H new ATOM 0 HG21 VAL A 472 25.666 2.636 -6.806 1.00 0.00 H new ATOM 0 HG22 VAL A 472 24.301 1.900 -7.678 1.00 0.00 H new ATOM 0 HG23 VAL A 472 24.010 2.819 -6.182 1.00 0.00 H new ATOM 1122 N PHE A 473 23.825 -2.098 -6.511 1.00 0.00 N ATOM 1123 CA PHE A 473 23.982 -3.539 -6.407 1.00 0.00 C ATOM 1124 C PHE A 473 24.603 -4.116 -7.681 1.00 0.00 C ATOM 1125 O PHE A 473 24.421 -3.570 -8.767 1.00 0.00 O ATOM 1126 CB PHE A 473 22.582 -4.129 -6.225 1.00 0.00 C ATOM 1127 CG PHE A 473 21.739 -4.138 -7.502 1.00 0.00 C ATOM 1128 CD1 PHE A 473 21.243 -2.973 -7.998 1.00 0.00 C ATOM 1129 CD2 PHE A 473 21.487 -5.311 -8.142 1.00 0.00 C ATOM 1130 CE1 PHE A 473 20.461 -2.981 -9.183 1.00 0.00 C ATOM 1131 CE2 PHE A 473 20.705 -5.320 -9.327 1.00 0.00 C ATOM 1132 CZ PHE A 473 20.209 -4.155 -9.823 1.00 0.00 C ATOM 0 H PHE A 473 23.838 -1.735 -7.464 1.00 0.00 H new ATOM 0 HA PHE A 473 24.639 -3.783 -5.572 1.00 0.00 H new ATOM 0 HB2 PHE A 473 22.675 -5.150 -5.856 1.00 0.00 H new ATOM 0 HB3 PHE A 473 22.056 -3.560 -5.459 1.00 0.00 H new ATOM 0 HD1 PHE A 473 21.444 -2.041 -7.490 1.00 0.00 H new ATOM 0 HD2 PHE A 473 21.882 -6.236 -7.749 1.00 0.00 H new ATOM 0 HE1 PHE A 473 20.066 -2.056 -9.576 1.00 0.00 H new ATOM 0 HE2 PHE A 473 20.504 -6.252 -9.834 1.00 0.00 H new ATOM 0 HZ PHE A 473 19.615 -4.162 -10.725 1.00 0.00 H new ATOM 1142 N PRO A 474 25.343 -5.243 -7.499 1.00 0.00 N ATOM 1143 CA PRO A 474 25.993 -5.900 -8.621 1.00 0.00 C ATOM 1144 C PRO A 474 24.977 -6.663 -9.473 1.00 0.00 C ATOM 1145 O PRO A 474 24.350 -7.610 -8.999 1.00 0.00 O ATOM 1146 CB PRO A 474 27.041 -6.805 -7.993 1.00 0.00 C ATOM 1147 CG PRO A 474 26.630 -6.972 -6.539 1.00 0.00 C ATOM 1148 CD PRO A 474 25.581 -5.918 -6.227 1.00 0.00 C ATOM 0 HA PRO A 474 26.457 -5.195 -9.311 1.00 0.00 H new ATOM 0 HB2 PRO A 474 27.080 -7.769 -8.501 1.00 0.00 H new ATOM 0 HB3 PRO A 474 28.035 -6.364 -8.070 1.00 0.00 H new ATOM 0 HG2 PRO A 474 26.230 -7.971 -6.368 1.00 0.00 H new ATOM 0 HG3 PRO A 474 27.493 -6.858 -5.883 1.00 0.00 H new ATOM 0 HD2 PRO A 474 24.667 -6.371 -5.842 1.00 0.00 H new ATOM 0 HD3 PRO A 474 25.935 -5.220 -5.468 1.00 0.00 H new ATOM 1156 N GLU A 475 24.845 -6.223 -10.715 1.00 0.00 N ATOM 1157 CA GLU A 475 23.915 -6.853 -11.638 1.00 0.00 C ATOM 1158 C GLU A 475 24.385 -8.268 -11.980 1.00 0.00 C ATOM 1159 O GLU A 475 23.568 -9.164 -12.185 1.00 0.00 O ATOM 1160 CB GLU A 475 23.744 -6.010 -12.903 1.00 0.00 C ATOM 1161 CG GLU A 475 23.133 -6.839 -14.035 1.00 0.00 C ATOM 1162 CD GLU A 475 22.083 -6.032 -14.801 1.00 0.00 C ATOM 1163 OE1 GLU A 475 20.906 -6.093 -14.385 1.00 0.00 O ATOM 1164 OE2 GLU A 475 22.482 -5.372 -15.785 1.00 0.00 O ATOM 0 H GLU A 475 25.366 -5.438 -11.105 1.00 0.00 H new ATOM 0 HA GLU A 475 22.941 -6.922 -11.153 1.00 0.00 H new ATOM 0 HB2 GLU A 475 23.106 -5.153 -12.690 1.00 0.00 H new ATOM 0 HB3 GLU A 475 24.711 -5.617 -13.216 1.00 0.00 H new ATOM 0 HG2 GLU A 475 23.918 -7.162 -14.718 1.00 0.00 H new ATOM 0 HG3 GLU A 475 22.676 -7.740 -13.625 1.00 0.00 H new ATOM 1171 N ASN A 476 25.700 -8.425 -12.032 1.00 0.00 N ATOM 1172 CA ASN A 476 26.288 -9.716 -12.347 1.00 0.00 C ATOM 1173 C ASN A 476 25.984 -10.699 -11.215 1.00 0.00 C ATOM 1174 O ASN A 476 26.213 -11.900 -11.352 1.00 0.00 O ATOM 1175 CB ASN A 476 27.807 -9.609 -12.486 1.00 0.00 C ATOM 1176 CG ASN A 476 28.414 -8.844 -11.307 1.00 0.00 C ATOM 1177 OD1 ASN A 476 28.797 -7.691 -11.414 1.00 0.00 O ATOM 1178 ND2 ASN A 476 28.479 -9.548 -10.181 1.00 0.00 N ATOM 0 H ASN A 476 26.375 -7.679 -11.861 1.00 0.00 H new ATOM 0 HA ASN A 476 25.863 -10.060 -13.290 1.00 0.00 H new ATOM 0 HB2 ASN A 476 28.242 -10.607 -12.539 1.00 0.00 H new ATOM 0 HB3 ASN A 476 28.056 -9.103 -13.419 1.00 0.00 H new ATOM 0 HD21 ASN A 476 28.868 -9.126 -9.338 1.00 0.00 H new ATOM 0 HD22 ASN A 476 28.140 -10.510 -10.161 1.00 0.00 H new ATOM 1185 N PHE A 477 25.472 -10.153 -10.121 1.00 0.00 N ATOM 1186 CA PHE A 477 25.134 -10.967 -8.966 1.00 0.00 C ATOM 1187 C PHE A 477 23.622 -11.179 -8.867 1.00 0.00 C ATOM 1188 O PHE A 477 23.141 -11.822 -7.936 1.00 0.00 O ATOM 1189 CB PHE A 477 25.613 -10.207 -7.728 1.00 0.00 C ATOM 1190 CG PHE A 477 24.656 -10.292 -6.537 1.00 0.00 C ATOM 1191 CD1 PHE A 477 23.555 -9.494 -6.492 1.00 0.00 C ATOM 1192 CD2 PHE A 477 24.906 -11.164 -5.524 1.00 0.00 C ATOM 1193 CE1 PHE A 477 22.666 -9.573 -5.387 1.00 0.00 C ATOM 1194 CE2 PHE A 477 24.017 -11.243 -4.419 1.00 0.00 C ATOM 1195 CZ PHE A 477 22.916 -10.445 -4.374 1.00 0.00 C ATOM 0 H PHE A 477 25.283 -9.157 -10.011 1.00 0.00 H new ATOM 0 HA PHE A 477 25.606 -11.946 -9.050 1.00 0.00 H new ATOM 0 HB2 PHE A 477 26.585 -10.597 -7.428 1.00 0.00 H new ATOM 0 HB3 PHE A 477 25.758 -9.159 -7.991 1.00 0.00 H new ATOM 0 HD1 PHE A 477 23.357 -8.801 -7.296 1.00 0.00 H new ATOM 0 HD2 PHE A 477 25.781 -11.797 -5.560 1.00 0.00 H new ATOM 0 HE1 PHE A 477 21.791 -8.940 -5.351 1.00 0.00 H new ATOM 0 HE2 PHE A 477 24.215 -11.936 -3.615 1.00 0.00 H new ATOM 0 HZ PHE A 477 22.240 -10.504 -3.533 1.00 0.00 H new ATOM 1205 N THR A 478 22.915 -10.625 -9.841 1.00 0.00 N ATOM 1206 CA THR A 478 21.467 -10.745 -9.876 1.00 0.00 C ATOM 1207 C THR A 478 21.008 -11.267 -11.239 1.00 0.00 C ATOM 1208 O THR A 478 21.828 -11.522 -12.119 1.00 0.00 O ATOM 1209 CB THR A 478 20.871 -9.383 -9.514 1.00 0.00 C ATOM 1210 OG1 THR A 478 21.784 -8.444 -10.076 1.00 0.00 O ATOM 1211 CG2 THR A 478 20.925 -9.101 -8.011 1.00 0.00 C ATOM 0 H THR A 478 23.318 -10.092 -10.612 1.00 0.00 H new ATOM 0 HA THR A 478 21.113 -11.475 -9.148 1.00 0.00 H new ATOM 0 HB THR A 478 19.837 -9.337 -9.855 1.00 0.00 H new ATOM 0 HG1 THR A 478 22.504 -8.264 -9.436 1.00 0.00 H new ATOM 0 HG21 THR A 478 20.490 -8.122 -7.809 1.00 0.00 H new ATOM 0 HG22 THR A 478 20.362 -9.866 -7.477 1.00 0.00 H new ATOM 0 HG23 THR A 478 21.962 -9.113 -7.676 1.00 0.00 H new ATOM 1219 N GLU A 479 19.697 -11.410 -11.371 1.00 0.00 N ATOM 1220 CA GLU A 479 19.119 -11.896 -12.612 1.00 0.00 C ATOM 1221 C GLU A 479 18.019 -10.947 -13.092 1.00 0.00 C ATOM 1222 O GLU A 479 17.327 -10.331 -12.283 1.00 0.00 O ATOM 1223 CB GLU A 479 18.581 -13.319 -12.445 1.00 0.00 C ATOM 1224 CG GLU A 479 18.690 -14.103 -13.755 1.00 0.00 C ATOM 1225 CD GLU A 479 17.897 -15.409 -13.679 1.00 0.00 C ATOM 1226 OE1 GLU A 479 16.715 -15.333 -13.281 1.00 0.00 O ATOM 1227 OE2 GLU A 479 18.492 -16.454 -14.021 1.00 0.00 O ATOM 0 H GLU A 479 19.019 -11.198 -10.639 1.00 0.00 H new ATOM 0 HA GLU A 479 19.903 -11.925 -13.369 1.00 0.00 H new ATOM 0 HB2 GLU A 479 19.138 -13.833 -11.662 1.00 0.00 H new ATOM 0 HB3 GLU A 479 17.540 -13.283 -12.124 1.00 0.00 H new ATOM 0 HG2 GLU A 479 18.318 -13.495 -14.579 1.00 0.00 H new ATOM 0 HG3 GLU A 479 19.737 -14.321 -13.967 1.00 0.00 H new ATOM 1234 N ARG A 480 17.891 -10.859 -14.408 1.00 0.00 N ATOM 1235 CA ARG A 480 16.887 -9.995 -15.006 1.00 0.00 C ATOM 1236 C ARG A 480 15.540 -10.716 -15.075 1.00 0.00 C ATOM 1237 O ARG A 480 15.473 -11.878 -15.474 1.00 0.00 O ATOM 1238 CB ARG A 480 17.300 -9.565 -16.416 1.00 0.00 C ATOM 1239 CG ARG A 480 18.627 -8.804 -16.390 1.00 0.00 C ATOM 1240 CD ARG A 480 18.631 -7.674 -17.421 1.00 0.00 C ATOM 1241 NE ARG A 480 19.846 -7.758 -18.261 1.00 0.00 N ATOM 1242 CZ ARG A 480 20.055 -7.018 -19.358 1.00 0.00 C ATOM 1243 NH1 ARG A 480 19.130 -6.133 -19.754 1.00 0.00 N ATOM 1244 NH2 ARG A 480 21.188 -7.162 -20.058 1.00 0.00 N ATOM 0 H ARG A 480 18.466 -11.372 -15.077 1.00 0.00 H new ATOM 0 HA ARG A 480 16.797 -9.108 -14.379 1.00 0.00 H new ATOM 0 HB2 ARG A 480 17.393 -10.443 -17.055 1.00 0.00 H new ATOM 0 HB3 ARG A 480 16.524 -8.935 -16.850 1.00 0.00 H new ATOM 0 HG2 ARG A 480 18.795 -8.393 -15.394 1.00 0.00 H new ATOM 0 HG3 ARG A 480 19.448 -9.491 -16.595 1.00 0.00 H new ATOM 0 HD2 ARG A 480 17.741 -7.739 -18.047 1.00 0.00 H new ATOM 0 HD3 ARG A 480 18.595 -6.709 -16.915 1.00 0.00 H new ATOM 0 HE ARG A 480 20.571 -8.422 -17.987 1.00 0.00 H new ATOM 0 HH11 ARG A 480 18.268 -6.023 -19.220 1.00 0.00 H new ATOM 0 HH12 ARG A 480 19.288 -5.569 -20.589 1.00 0.00 H new ATOM 0 HH21 ARG A 480 21.892 -7.835 -19.756 1.00 0.00 H new ATOM 0 HH22 ARG A 480 21.347 -6.598 -20.893 1.00 0.00 H new ATOM 1258 N VAL A 481 14.499 -9.998 -14.679 1.00 0.00 N ATOM 1259 CA VAL A 481 13.157 -10.555 -14.690 1.00 0.00 C ATOM 1260 C VAL A 481 12.294 -9.773 -15.682 1.00 0.00 C ATOM 1261 O VAL A 481 12.306 -8.543 -15.687 1.00 0.00 O ATOM 1262 CB VAL A 481 12.582 -10.561 -13.272 1.00 0.00 C ATOM 1263 CG1 VAL A 481 11.129 -11.041 -13.273 1.00 0.00 C ATOM 1264 CG2 VAL A 481 13.440 -11.414 -12.336 1.00 0.00 C ATOM 0 H VAL A 481 14.558 -9.035 -14.348 1.00 0.00 H new ATOM 0 HA VAL A 481 13.176 -11.593 -15.023 1.00 0.00 H new ATOM 0 HB VAL A 481 12.597 -9.537 -12.899 1.00 0.00 H new ATOM 0 HG11 VAL A 481 10.744 -11.036 -12.253 1.00 0.00 H new ATOM 0 HG12 VAL A 481 10.527 -10.376 -13.892 1.00 0.00 H new ATOM 0 HG13 VAL A 481 11.080 -12.053 -13.674 1.00 0.00 H new ATOM 0 HG21 VAL A 481 13.009 -11.401 -11.335 1.00 0.00 H new ATOM 0 HG22 VAL A 481 13.471 -12.439 -12.704 1.00 0.00 H new ATOM 0 HG23 VAL A 481 14.452 -11.010 -12.301 1.00 0.00 H new