USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 677 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 379 SER OG : rot 180:sc= 0 USER MOD Single : A 381 LYS NZ :NH3+ 157:sc= -0.0173 (180deg=-0.319) USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 HIS :FLIP no HD1:sc= -0.893 F(o=-1.6,f=-0.89) USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 391 GLN : amide:sc= -1.64 K(o=-1.6,f=-3.8!) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= -0.192 X(o=-0.19,f=-4.4e-05) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot 180:sc= 0 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 114:sc= -0.0758 USER MOD Single : A 415 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 417 THR OG1 : rot 88:sc= 1.06 USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 425 SER OG : rot -80:sc= 0.109 USER MOD Single : A 428 THR OG1 : rot 180:sc= 0 USER MOD Single : A 431 GLN : amide:sc= 0 X(o=0,f=0.028) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 444 LYS NZ :NH3+ -162:sc=-0.00461 (180deg=-0.178) USER MOD Single : A 446 GLN : amide:sc= -0.375 X(o=-0.37,f=-0.53) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ -160:sc= -0.625 (180deg=-0.773) USER MOD Single : A 455 LYS NZ :NH3+ -167:sc= -0.546 (180deg=-0.808) USER MOD ----------------------------------------------------------------- ATOM 112 N SER A 379 4.236 24.089 -4.142 1.00 0.00 N ATOM 113 CA SER A 379 4.133 23.075 -3.092 1.00 0.00 C ATOM 114 C SER A 379 3.007 22.091 -3.361 1.00 0.00 C ATOM 115 O SER A 379 3.095 20.920 -2.988 1.00 0.00 O ATOM 116 CB SER A 379 3.952 23.730 -1.722 1.00 0.00 C ATOM 117 OG SER A 379 4.882 23.215 -0.783 1.00 0.00 O ATOM 0 HA SER A 379 5.068 22.514 -3.093 1.00 0.00 H new ATOM 0 HB2 SER A 379 4.080 24.809 -1.811 1.00 0.00 H new ATOM 0 HB3 SER A 379 2.937 23.558 -1.365 1.00 0.00 H new ATOM 0 HG SER A 379 4.747 23.651 0.084 1.00 0.00 H new ATOM 123 N ILE A 380 1.967 22.550 -4.033 1.00 0.00 N ATOM 124 CA ILE A 380 0.854 21.688 -4.373 1.00 0.00 C ATOM 125 C ILE A 380 1.359 20.516 -5.209 1.00 0.00 C ATOM 126 O ILE A 380 0.794 19.425 -5.179 1.00 0.00 O ATOM 127 CB ILE A 380 -0.247 22.455 -5.138 1.00 0.00 C ATOM 128 CG1 ILE A 380 -1.034 23.338 -4.170 1.00 0.00 C ATOM 129 CG2 ILE A 380 -1.186 21.493 -5.859 1.00 0.00 C ATOM 130 CD1 ILE A 380 -0.189 24.388 -3.487 1.00 0.00 C ATOM 0 H ILE A 380 1.871 23.514 -4.353 1.00 0.00 H new ATOM 0 HA ILE A 380 0.412 21.318 -3.448 1.00 0.00 H new ATOM 0 HB ILE A 380 0.231 23.084 -5.889 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -1.841 23.830 -4.714 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -1.499 22.708 -3.412 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -1.951 22.060 -6.389 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -0.618 20.896 -6.572 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.661 20.835 -5.132 1.00 0.00 H new ATOM 0 HD11 ILE A 380 -0.813 24.977 -2.815 1.00 0.00 H new ATOM 0 HD12 ILE A 380 0.602 23.903 -2.915 1.00 0.00 H new ATOM 0 HD13 ILE A 380 0.255 25.043 -4.237 1.00 0.00 H new ATOM 142 N LYS A 381 2.430 20.762 -5.961 1.00 0.00 N ATOM 143 CA LYS A 381 3.015 19.737 -6.819 1.00 0.00 C ATOM 144 C LYS A 381 3.403 18.499 -6.016 1.00 0.00 C ATOM 145 O LYS A 381 3.313 17.376 -6.513 1.00 0.00 O ATOM 146 CB LYS A 381 4.244 20.293 -7.543 1.00 0.00 C ATOM 147 CG LYS A 381 3.921 20.940 -8.881 1.00 0.00 C ATOM 148 CD LYS A 381 3.051 22.174 -8.711 1.00 0.00 C ATOM 149 CE LYS A 381 3.484 23.294 -9.645 1.00 0.00 C ATOM 150 NZ LYS A 381 3.627 22.822 -11.049 1.00 0.00 N ATOM 0 H LYS A 381 2.909 21.662 -5.993 1.00 0.00 H new ATOM 0 HA LYS A 381 2.264 19.446 -7.553 1.00 0.00 H new ATOM 0 HB2 LYS A 381 4.732 21.027 -6.902 1.00 0.00 H new ATOM 0 HB3 LYS A 381 4.958 19.485 -7.702 1.00 0.00 H new ATOM 0 HG2 LYS A 381 4.847 21.214 -9.386 1.00 0.00 H new ATOM 0 HG3 LYS A 381 3.410 20.220 -9.520 1.00 0.00 H new ATOM 0 HD2 LYS A 381 2.010 21.917 -8.908 1.00 0.00 H new ATOM 0 HD3 LYS A 381 3.104 22.519 -7.678 1.00 0.00 H new ATOM 0 HE2 LYS A 381 2.753 24.102 -9.606 1.00 0.00 H new ATOM 0 HE3 LYS A 381 4.433 23.706 -9.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 3.535 23.630 -11.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 4.561 22.382 -11.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 2.885 22.124 -11.258 1.00 0.00 H new ATOM 164 N LYS A 382 3.829 18.703 -4.774 1.00 0.00 N ATOM 165 CA LYS A 382 4.221 17.591 -3.916 1.00 0.00 C ATOM 166 C LYS A 382 3.018 16.749 -3.542 1.00 0.00 C ATOM 167 O LYS A 382 3.093 15.521 -3.486 1.00 0.00 O ATOM 168 CB LYS A 382 4.928 18.099 -2.658 1.00 0.00 C ATOM 169 CG LYS A 382 6.389 18.453 -2.881 1.00 0.00 C ATOM 170 CD LYS A 382 6.930 19.322 -1.757 1.00 0.00 C ATOM 171 CE LYS A 382 8.352 18.932 -1.386 1.00 0.00 C ATOM 172 NZ LYS A 382 8.618 19.121 0.067 1.00 0.00 N ATOM 0 H LYS A 382 3.911 19.623 -4.341 1.00 0.00 H new ATOM 0 HA LYS A 382 4.918 16.966 -4.474 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.402 18.979 -2.286 1.00 0.00 H new ATOM 0 HB3 LYS A 382 4.862 17.337 -1.882 1.00 0.00 H new ATOM 0 HG2 LYS A 382 6.979 17.539 -2.952 1.00 0.00 H new ATOM 0 HG3 LYS A 382 6.497 18.977 -3.831 1.00 0.00 H new ATOM 0 HD2 LYS A 382 6.906 20.368 -2.061 1.00 0.00 H new ATOM 0 HD3 LYS A 382 6.286 19.230 -0.882 1.00 0.00 H new ATOM 0 HE2 LYS A 382 8.524 17.890 -1.654 1.00 0.00 H new ATOM 0 HE3 LYS A 382 9.055 19.531 -1.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 9.598 18.844 0.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 8.478 20.120 0.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 7.964 18.531 0.619 1.00 0.00 H new ATOM 186 N ILE A 383 1.906 17.415 -3.310 1.00 0.00 N ATOM 187 CA ILE A 383 0.667 16.732 -2.964 1.00 0.00 C ATOM 188 C ILE A 383 0.268 15.797 -4.097 1.00 0.00 C ATOM 189 O ILE A 383 -0.273 14.716 -3.872 1.00 0.00 O ATOM 190 CB ILE A 383 -0.479 17.728 -2.696 1.00 0.00 C ATOM 191 CG1 ILE A 383 -0.043 18.780 -1.674 1.00 0.00 C ATOM 192 CG2 ILE A 383 -1.719 16.992 -2.208 1.00 0.00 C ATOM 193 CD1 ILE A 383 0.424 18.191 -0.361 1.00 0.00 C ATOM 0 H ILE A 383 1.830 18.431 -3.354 1.00 0.00 H new ATOM 0 HA ILE A 383 0.842 16.165 -2.049 1.00 0.00 H new ATOM 0 HB ILE A 383 -0.724 18.234 -3.630 1.00 0.00 H new ATOM 0 HG12 ILE A 383 0.762 19.378 -2.101 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -0.876 19.457 -1.483 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -2.519 17.709 -2.023 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -2.040 16.278 -2.966 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -1.487 16.461 -1.285 1.00 0.00 H new ATOM 0 HD11 ILE A 383 0.717 18.995 0.314 1.00 0.00 H new ATOM 0 HD12 ILE A 383 -0.386 17.617 0.089 1.00 0.00 H new ATOM 0 HD13 ILE A 383 1.278 17.537 -0.539 1.00 0.00 H new ATOM 205 N ILE A 384 0.574 16.224 -5.318 1.00 0.00 N ATOM 206 CA ILE A 384 0.286 15.430 -6.509 1.00 0.00 C ATOM 207 C ILE A 384 1.277 14.288 -6.610 1.00 0.00 C ATOM 208 O ILE A 384 0.912 13.144 -6.884 1.00 0.00 O ATOM 209 CB ILE A 384 0.392 16.258 -7.811 1.00 0.00 C ATOM 210 CG1 ILE A 384 0.321 17.755 -7.525 1.00 0.00 C ATOM 211 CG2 ILE A 384 -0.696 15.855 -8.792 1.00 0.00 C ATOM 212 CD1 ILE A 384 -0.949 18.174 -6.813 1.00 0.00 C ATOM 0 H ILE A 384 1.023 17.119 -5.510 1.00 0.00 H new ATOM 0 HA ILE A 384 -0.737 15.068 -6.406 1.00 0.00 H new ATOM 0 HB ILE A 384 1.363 16.047 -8.259 1.00 0.00 H new ATOM 0 HG12 ILE A 384 1.180 18.042 -6.919 1.00 0.00 H new ATOM 0 HG13 ILE A 384 0.398 18.301 -8.465 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -0.604 16.449 -9.701 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -0.592 14.798 -9.037 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -1.674 16.029 -8.342 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -0.932 19.250 -6.642 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -1.812 17.918 -7.428 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -1.018 17.656 -5.857 1.00 0.00 H new ATOM 224 N HIS A 385 2.541 14.621 -6.382 1.00 0.00 N ATOM 225 CA HIS A 385 3.612 13.632 -6.440 1.00 0.00 C ATOM 226 C HIS A 385 3.363 12.513 -5.429 1.00 0.00 C ATOM 227 O HIS A 385 3.419 11.328 -5.765 1.00 0.00 O ATOM 228 CB HIS A 385 4.971 14.309 -6.192 1.00 0.00 C ATOM 229 CG HIS A 385 5.689 13.838 -4.961 1.00 0.00 C ATOM 230 ND1 HIS A 385 5.773 14.414 -3.736 1.00 0.00 N flip ATOM 231 CD2 HIS A 385 6.397 12.660 -4.953 1.00 0.00 C flip ATOM 232 CE1 HIS A 385 6.542 13.584 -2.961 1.00 0.00 C flip ATOM 233 NE2 HIS A 385 6.894 12.546 -3.734 1.00 0.00 N flip ATOM 0 H HIS A 385 2.850 15.566 -6.156 1.00 0.00 H new ATOM 0 HA HIS A 385 3.628 13.187 -7.435 1.00 0.00 H new ATOM 0 HB2 HIS A 385 5.611 14.137 -7.058 1.00 0.00 H new ATOM 0 HB3 HIS A 385 4.817 15.386 -6.117 1.00 0.00 H new ATOM 0 HD2 HIS A 385 6.522 11.970 -5.774 1.00 0.00 H new ATOM 0 HE1 HIS A 385 6.812 13.737 -1.927 1.00 0.00 H new ATOM 0 HE2 HIS A 385 7.473 11.767 -3.420 1.00 0.00 H new ATOM 241 N VAL A 386 3.075 12.900 -4.190 1.00 0.00 N ATOM 242 CA VAL A 386 2.808 11.934 -3.136 1.00 0.00 C ATOM 243 C VAL A 386 1.551 11.132 -3.450 1.00 0.00 C ATOM 244 O VAL A 386 1.524 9.912 -3.285 1.00 0.00 O ATOM 245 CB VAL A 386 2.649 12.620 -1.765 1.00 0.00 C ATOM 246 CG1 VAL A 386 1.436 13.538 -1.756 1.00 0.00 C ATOM 247 CG2 VAL A 386 2.552 11.580 -0.657 1.00 0.00 C ATOM 0 H VAL A 386 3.021 13.875 -3.894 1.00 0.00 H new ATOM 0 HA VAL A 386 3.665 11.263 -3.089 1.00 0.00 H new ATOM 0 HB VAL A 386 3.533 13.232 -1.583 1.00 0.00 H new ATOM 0 HG11 VAL A 386 1.345 14.011 -0.778 1.00 0.00 H new ATOM 0 HG12 VAL A 386 1.555 14.306 -2.520 1.00 0.00 H new ATOM 0 HG13 VAL A 386 0.538 12.956 -1.963 1.00 0.00 H new ATOM 0 HG21 VAL A 386 2.440 12.082 0.304 1.00 0.00 H new ATOM 0 HG22 VAL A 386 1.689 10.939 -0.834 1.00 0.00 H new ATOM 0 HG23 VAL A 386 3.458 10.974 -0.647 1.00 0.00 H new ATOM 257 N LEU A 387 0.514 11.824 -3.912 1.00 0.00 N ATOM 258 CA LEU A 387 -0.743 11.173 -4.258 1.00 0.00 C ATOM 259 C LEU A 387 -0.524 10.152 -5.364 1.00 0.00 C ATOM 260 O LEU A 387 -1.161 9.099 -5.389 1.00 0.00 O ATOM 261 CB LEU A 387 -1.781 12.208 -4.692 1.00 0.00 C ATOM 262 CG LEU A 387 -3.227 11.708 -4.705 1.00 0.00 C ATOM 263 CD1 LEU A 387 -4.152 12.723 -4.050 1.00 0.00 C ATOM 264 CD2 LEU A 387 -3.678 11.415 -6.128 1.00 0.00 C ATOM 0 H LEU A 387 0.520 12.834 -4.055 1.00 0.00 H new ATOM 0 HA LEU A 387 -1.117 10.656 -3.374 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.716 13.068 -4.025 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.525 12.560 -5.691 1.00 0.00 H new ATOM 0 HG LEU A 387 -3.274 10.782 -4.131 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -5.175 12.348 -4.070 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -3.844 12.883 -3.017 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -4.101 13.666 -4.594 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -4.709 11.061 -6.117 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -3.613 12.325 -6.725 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -3.036 10.649 -6.563 1.00 0.00 H new ATOM 276 N GLU A 388 0.399 10.462 -6.266 1.00 0.00 N ATOM 277 CA GLU A 388 0.721 9.560 -7.362 1.00 0.00 C ATOM 278 C GLU A 388 1.280 8.260 -6.803 1.00 0.00 C ATOM 279 O GLU A 388 1.039 7.180 -7.339 1.00 0.00 O ATOM 280 CB GLU A 388 1.734 10.205 -8.310 1.00 0.00 C ATOM 281 CG GLU A 388 1.120 11.229 -9.251 1.00 0.00 C ATOM 282 CD GLU A 388 1.631 11.094 -10.673 1.00 0.00 C ATOM 283 OE1 GLU A 388 1.260 10.109 -11.345 1.00 0.00 O ATOM 284 OE2 GLU A 388 2.401 11.973 -11.113 1.00 0.00 O ATOM 0 H GLU A 388 0.936 11.329 -6.260 1.00 0.00 H new ATOM 0 HA GLU A 388 -0.188 9.350 -7.925 1.00 0.00 H new ATOM 0 HB2 GLU A 388 2.514 10.687 -7.721 1.00 0.00 H new ATOM 0 HB3 GLU A 388 2.215 9.425 -8.900 1.00 0.00 H new ATOM 0 HG2 GLU A 388 0.036 11.117 -9.246 1.00 0.00 H new ATOM 0 HG3 GLU A 388 1.339 12.232 -8.884 1.00 0.00 H new ATOM 291 N LYS A 389 2.023 8.380 -5.709 1.00 0.00 N ATOM 292 CA LYS A 389 2.613 7.219 -5.058 1.00 0.00 C ATOM 293 C LYS A 389 1.532 6.369 -4.396 1.00 0.00 C ATOM 294 O LYS A 389 1.631 5.143 -4.351 1.00 0.00 O ATOM 295 CB LYS A 389 3.644 7.660 -4.017 1.00 0.00 C ATOM 296 CG LYS A 389 4.851 6.740 -3.931 1.00 0.00 C ATOM 297 CD LYS A 389 5.326 6.575 -2.496 1.00 0.00 C ATOM 298 CE LYS A 389 6.545 7.435 -2.209 1.00 0.00 C ATOM 299 NZ LYS A 389 7.815 6.683 -2.403 1.00 0.00 N ATOM 0 H LYS A 389 2.230 9.270 -5.255 1.00 0.00 H new ATOM 0 HA LYS A 389 3.113 6.617 -5.817 1.00 0.00 H new ATOM 0 HB2 LYS A 389 3.982 8.668 -4.257 1.00 0.00 H new ATOM 0 HB3 LYS A 389 3.164 7.709 -3.040 1.00 0.00 H new ATOM 0 HG2 LYS A 389 4.596 5.765 -4.345 1.00 0.00 H new ATOM 0 HG3 LYS A 389 5.661 7.143 -4.539 1.00 0.00 H new ATOM 0 HD2 LYS A 389 4.521 6.844 -1.812 1.00 0.00 H new ATOM 0 HD3 LYS A 389 5.566 5.528 -2.310 1.00 0.00 H new ATOM 0 HE2 LYS A 389 6.536 8.307 -2.863 1.00 0.00 H new ATOM 0 HE3 LYS A 389 6.495 7.805 -1.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 8.622 7.306 -2.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 7.836 5.865 -1.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 7.876 6.352 -3.387 1.00 0.00 H new ATOM 313 N VAL A 390 0.499 7.033 -3.881 1.00 0.00 N ATOM 314 CA VAL A 390 -0.601 6.343 -3.216 1.00 0.00 C ATOM 315 C VAL A 390 -1.324 5.395 -4.169 1.00 0.00 C ATOM 316 O VAL A 390 -1.595 4.246 -3.824 1.00 0.00 O ATOM 317 CB VAL A 390 -1.625 7.341 -2.639 1.00 0.00 C ATOM 318 CG1 VAL A 390 -2.663 6.615 -1.797 1.00 0.00 C ATOM 319 CG2 VAL A 390 -0.926 8.416 -1.821 1.00 0.00 C ATOM 0 H VAL A 390 0.402 8.048 -3.912 1.00 0.00 H new ATOM 0 HA VAL A 390 -0.159 5.768 -2.403 1.00 0.00 H new ATOM 0 HB VAL A 390 -2.137 7.825 -3.471 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -3.377 7.336 -1.398 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -3.189 5.887 -2.415 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -2.168 6.101 -0.973 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -1.667 9.110 -1.423 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -0.384 7.952 -0.997 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -0.225 8.958 -2.456 1.00 0.00 H new ATOM 329 N GLN A 391 -1.638 5.881 -5.368 1.00 0.00 N ATOM 330 CA GLN A 391 -2.333 5.064 -6.357 1.00 0.00 C ATOM 331 C GLN A 391 -1.463 3.892 -6.799 1.00 0.00 C ATOM 332 O GLN A 391 -1.963 2.797 -7.057 1.00 0.00 O ATOM 333 CB GLN A 391 -2.749 5.915 -7.564 1.00 0.00 C ATOM 334 CG GLN A 391 -1.626 6.194 -8.551 1.00 0.00 C ATOM 335 CD GLN A 391 -1.708 7.581 -9.147 1.00 0.00 C ATOM 336 OE1 GLN A 391 -2.156 8.527 -8.498 1.00 0.00 O ATOM 337 NE2 GLN A 391 -1.276 7.706 -10.394 1.00 0.00 N ATOM 0 H GLN A 391 -1.424 6.830 -5.676 1.00 0.00 H new ATOM 0 HA GLN A 391 -3.234 4.662 -5.894 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -3.560 5.409 -8.088 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -3.145 6.865 -7.205 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -0.667 6.075 -8.047 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -1.659 5.456 -9.352 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -0.913 6.893 -10.892 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -1.307 8.615 -10.856 1.00 0.00 H new ATOM 346 N TYR A 392 -0.157 4.128 -6.880 1.00 0.00 N ATOM 347 CA TYR A 392 0.780 3.087 -7.283 1.00 0.00 C ATOM 348 C TYR A 392 0.905 2.025 -6.194 1.00 0.00 C ATOM 349 O TYR A 392 0.959 0.829 -6.482 1.00 0.00 O ATOM 350 CB TYR A 392 2.153 3.695 -7.583 1.00 0.00 C ATOM 351 CG TYR A 392 2.782 3.170 -8.854 1.00 0.00 C ATOM 352 CD1 TYR A 392 2.079 3.170 -10.051 1.00 0.00 C ATOM 353 CD2 TYR A 392 4.081 2.674 -8.855 1.00 0.00 C ATOM 354 CE1 TYR A 392 2.650 2.690 -11.214 1.00 0.00 C ATOM 355 CE2 TYR A 392 4.660 2.193 -10.014 1.00 0.00 C ATOM 356 CZ TYR A 392 3.940 2.204 -11.191 1.00 0.00 C ATOM 357 OH TYR A 392 4.513 1.725 -12.348 1.00 0.00 O ATOM 0 H TYR A 392 0.275 5.029 -6.672 1.00 0.00 H new ATOM 0 HA TYR A 392 0.398 2.614 -8.187 1.00 0.00 H new ATOM 0 HB2 TYR A 392 2.053 4.778 -7.657 1.00 0.00 H new ATOM 0 HB3 TYR A 392 2.821 3.493 -6.746 1.00 0.00 H new ATOM 0 HD1 TYR A 392 1.069 3.552 -10.074 1.00 0.00 H new ATOM 0 HD2 TYR A 392 4.647 2.664 -7.935 1.00 0.00 H new ATOM 0 HE1 TYR A 392 2.089 2.695 -12.137 1.00 0.00 H new ATOM 0 HE2 TYR A 392 5.670 1.811 -9.999 1.00 0.00 H new ATOM 0 HH TYR A 392 5.425 1.421 -12.160 1.00 0.00 H new ATOM 367 N LEU A 393 0.945 2.472 -4.944 1.00 0.00 N ATOM 368 CA LEU A 393 1.059 1.561 -3.810 1.00 0.00 C ATOM 369 C LEU A 393 -0.171 0.662 -3.717 1.00 0.00 C ATOM 370 O LEU A 393 -0.059 -0.535 -3.455 1.00 0.00 O ATOM 371 CB LEU A 393 1.235 2.352 -2.510 1.00 0.00 C ATOM 372 CG LEU A 393 2.649 2.333 -1.930 1.00 0.00 C ATOM 373 CD1 LEU A 393 3.485 3.455 -2.524 1.00 0.00 C ATOM 374 CD2 LEU A 393 2.602 2.444 -0.413 1.00 0.00 C ATOM 0 H LEU A 393 0.900 3.459 -4.690 1.00 0.00 H new ATOM 0 HA LEU A 393 1.936 0.932 -3.961 1.00 0.00 H new ATOM 0 HB2 LEU A 393 0.946 3.387 -2.690 1.00 0.00 H new ATOM 0 HB3 LEU A 393 0.547 1.954 -1.764 1.00 0.00 H new ATOM 0 HG LEU A 393 3.117 1.384 -2.191 1.00 0.00 H new ATOM 0 HD11 LEU A 393 4.488 3.425 -2.099 1.00 0.00 H new ATOM 0 HD12 LEU A 393 3.545 3.331 -3.605 1.00 0.00 H new ATOM 0 HD13 LEU A 393 3.022 4.415 -2.294 1.00 0.00 H new ATOM 0 HD21 LEU A 393 3.617 2.429 -0.015 1.00 0.00 H new ATOM 0 HD22 LEU A 393 2.116 3.378 -0.131 1.00 0.00 H new ATOM 0 HD23 LEU A 393 2.040 1.605 -0.004 1.00 0.00 H new ATOM 386 N GLU A 394 -1.343 1.250 -3.935 1.00 0.00 N ATOM 387 CA GLU A 394 -2.595 0.505 -3.879 1.00 0.00 C ATOM 388 C GLU A 394 -2.601 -0.616 -4.913 1.00 0.00 C ATOM 389 O GLU A 394 -3.098 -1.712 -4.653 1.00 0.00 O ATOM 390 CB GLU A 394 -3.781 1.440 -4.115 1.00 0.00 C ATOM 391 CG GLU A 394 -5.130 0.791 -3.845 1.00 0.00 C ATOM 392 CD GLU A 394 -6.060 0.857 -5.041 1.00 0.00 C ATOM 393 OE1 GLU A 394 -6.147 1.934 -5.667 1.00 0.00 O ATOM 394 OE2 GLU A 394 -6.703 -0.169 -5.350 1.00 0.00 O ATOM 0 H GLU A 394 -1.451 2.241 -4.152 1.00 0.00 H new ATOM 0 HA GLU A 394 -2.685 0.063 -2.887 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -3.675 2.317 -3.476 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -3.756 1.792 -5.146 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -4.978 -0.251 -3.565 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -5.602 1.284 -2.995 1.00 0.00 H new ATOM 401 N GLN A 395 -2.046 -0.333 -6.087 1.00 0.00 N ATOM 402 CA GLN A 395 -1.986 -1.318 -7.161 1.00 0.00 C ATOM 403 C GLN A 395 -1.117 -2.505 -6.760 1.00 0.00 C ATOM 404 O GLN A 395 -1.397 -3.645 -7.129 1.00 0.00 O ATOM 405 CB GLN A 395 -1.440 -0.676 -8.438 1.00 0.00 C ATOM 406 CG GLN A 395 -2.202 -1.073 -9.693 1.00 0.00 C ATOM 407 CD GLN A 395 -1.774 -0.277 -10.909 1.00 0.00 C ATOM 408 OE1 GLN A 395 -1.420 -0.844 -11.944 1.00 0.00 O ATOM 409 NE2 GLN A 395 -1.804 1.045 -10.793 1.00 0.00 N ATOM 0 H GLN A 395 -1.632 0.570 -6.319 1.00 0.00 H new ATOM 0 HA GLN A 395 -2.997 -1.679 -7.349 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -1.472 0.408 -8.332 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -0.393 -0.954 -8.556 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -2.049 -2.135 -9.886 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -3.270 -0.930 -9.526 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -2.104 1.473 -9.917 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -1.527 1.632 -11.580 1.00 0.00 H new ATOM 418 N GLU A 396 -0.060 -2.229 -6.002 1.00 0.00 N ATOM 419 CA GLU A 396 0.852 -3.273 -5.551 1.00 0.00 C ATOM 420 C GLU A 396 0.179 -4.184 -4.529 1.00 0.00 C ATOM 421 O GLU A 396 0.367 -5.401 -4.550 1.00 0.00 O ATOM 422 CB GLU A 396 2.112 -2.652 -4.945 1.00 0.00 C ATOM 423 CG GLU A 396 3.013 -1.980 -5.968 1.00 0.00 C ATOM 424 CD GLU A 396 4.408 -1.720 -5.435 1.00 0.00 C ATOM 425 OE1 GLU A 396 4.537 -0.947 -4.462 1.00 0.00 O ATOM 426 OE2 GLU A 396 5.371 -2.290 -5.990 1.00 0.00 O ATOM 0 H GLU A 396 0.186 -1.290 -5.687 1.00 0.00 H new ATOM 0 HA GLU A 396 1.130 -3.874 -6.417 1.00 0.00 H new ATOM 0 HB2 GLU A 396 1.820 -1.919 -4.193 1.00 0.00 H new ATOM 0 HB3 GLU A 396 2.678 -3.428 -4.430 1.00 0.00 H new ATOM 0 HG2 GLU A 396 3.079 -2.608 -6.857 1.00 0.00 H new ATOM 0 HG3 GLU A 396 2.564 -1.036 -6.277 1.00 0.00 H new ATOM 433 N VAL A 397 -0.607 -3.591 -3.637 1.00 0.00 N ATOM 434 CA VAL A 397 -1.308 -4.352 -2.609 1.00 0.00 C ATOM 435 C VAL A 397 -2.263 -5.364 -3.233 1.00 0.00 C ATOM 436 O VAL A 397 -2.316 -6.522 -2.817 1.00 0.00 O ATOM 437 CB VAL A 397 -2.101 -3.427 -1.666 1.00 0.00 C ATOM 438 CG1 VAL A 397 -2.679 -4.217 -0.501 1.00 0.00 C ATOM 439 CG2 VAL A 397 -1.219 -2.291 -1.165 1.00 0.00 C ATOM 0 H VAL A 397 -0.775 -2.585 -3.605 1.00 0.00 H new ATOM 0 HA VAL A 397 -0.549 -4.879 -2.032 1.00 0.00 H new ATOM 0 HB VAL A 397 -2.930 -2.993 -2.226 1.00 0.00 H new ATOM 0 HG11 VAL A 397 -3.235 -3.546 0.153 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -3.347 -4.990 -0.881 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -1.869 -4.682 0.061 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -1.796 -1.648 -0.500 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -0.368 -2.703 -0.623 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -0.861 -1.708 -2.013 1.00 0.00 H new ATOM 449 N GLU A 398 -3.014 -4.922 -4.239 1.00 0.00 N ATOM 450 CA GLU A 398 -3.966 -5.793 -4.925 1.00 0.00 C ATOM 451 C GLU A 398 -3.265 -7.036 -5.462 1.00 0.00 C ATOM 452 O GLU A 398 -3.795 -8.145 -5.386 1.00 0.00 O ATOM 453 CB GLU A 398 -4.645 -5.038 -6.071 1.00 0.00 C ATOM 454 CG GLU A 398 -6.135 -5.318 -6.185 1.00 0.00 C ATOM 455 CD GLU A 398 -6.451 -6.369 -7.231 1.00 0.00 C ATOM 456 OE1 GLU A 398 -5.858 -6.311 -8.329 1.00 0.00 O ATOM 457 OE2 GLU A 398 -7.292 -7.249 -6.952 1.00 0.00 O ATOM 0 H GLU A 398 -2.982 -3.967 -4.597 1.00 0.00 H new ATOM 0 HA GLU A 398 -4.725 -6.104 -4.207 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -4.495 -3.968 -5.929 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -4.160 -5.307 -7.010 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -6.514 -5.647 -5.218 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -6.657 -4.394 -6.434 1.00 0.00 H new ATOM 464 N GLU A 399 -2.064 -6.840 -5.995 1.00 0.00 N ATOM 465 CA GLU A 399 -1.274 -7.940 -6.535 1.00 0.00 C ATOM 466 C GLU A 399 -0.613 -8.719 -5.407 1.00 0.00 C ATOM 467 O GLU A 399 -0.757 -9.938 -5.308 1.00 0.00 O ATOM 468 CB GLU A 399 -0.201 -7.397 -7.479 1.00 0.00 C ATOM 469 CG GLU A 399 0.314 -8.426 -8.471 1.00 0.00 C ATOM 470 CD GLU A 399 1.024 -7.793 -9.651 1.00 0.00 C ATOM 471 OE1 GLU A 399 2.065 -7.137 -9.436 1.00 0.00 O ATOM 472 OE2 GLU A 399 0.539 -7.953 -10.791 1.00 0.00 O ATOM 0 H GLU A 399 -1.615 -5.927 -6.065 1.00 0.00 H new ATOM 0 HA GLU A 399 -1.937 -8.607 -7.086 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -0.608 -6.548 -8.028 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.636 -7.024 -6.888 1.00 0.00 H new ATOM 0 HG2 GLU A 399 0.998 -9.106 -7.962 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.521 -9.026 -8.833 1.00 0.00 H new ATOM 479 N PHE A 400 0.114 -7.987 -4.566 1.00 0.00 N ATOM 480 CA PHE A 400 0.829 -8.544 -3.419 1.00 0.00 C ATOM 481 C PHE A 400 0.260 -9.873 -2.948 1.00 0.00 C ATOM 482 O PHE A 400 -0.914 -9.974 -2.589 1.00 0.00 O ATOM 483 CB PHE A 400 0.792 -7.552 -2.263 1.00 0.00 C ATOM 484 CG PHE A 400 1.700 -7.902 -1.130 1.00 0.00 C ATOM 485 CD1 PHE A 400 3.065 -7.972 -1.331 1.00 0.00 C ATOM 486 CD2 PHE A 400 1.193 -8.144 0.133 1.00 0.00 C ATOM 487 CE1 PHE A 400 3.915 -8.282 -0.289 1.00 0.00 C ATOM 488 CE2 PHE A 400 2.035 -8.453 1.181 1.00 0.00 C ATOM 489 CZ PHE A 400 3.401 -8.522 0.971 1.00 0.00 C ATOM 0 H PHE A 400 0.225 -6.978 -4.663 1.00 0.00 H new ATOM 0 HA PHE A 400 1.853 -8.726 -3.746 1.00 0.00 H new ATOM 0 HB2 PHE A 400 1.060 -6.564 -2.637 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -0.229 -7.485 -1.889 1.00 0.00 H new ATOM 0 HD1 PHE A 400 3.471 -7.782 -2.314 1.00 0.00 H new ATOM 0 HD2 PHE A 400 0.127 -8.091 0.301 1.00 0.00 H new ATOM 0 HE1 PHE A 400 4.980 -8.337 -0.458 1.00 0.00 H new ATOM 0 HE2 PHE A 400 1.629 -8.641 2.164 1.00 0.00 H new ATOM 0 HZ PHE A 400 4.063 -8.763 1.789 1.00 0.00 H new ATOM 499 N VAL A 401 1.119 -10.876 -2.920 1.00 0.00 N ATOM 500 CA VAL A 401 0.739 -12.196 -2.459 1.00 0.00 C ATOM 501 C VAL A 401 1.570 -12.565 -1.237 1.00 0.00 C ATOM 502 O VAL A 401 1.772 -13.743 -0.940 1.00 0.00 O ATOM 503 CB VAL A 401 0.935 -13.260 -3.560 1.00 0.00 C ATOM 504 CG1 VAL A 401 2.400 -13.355 -3.967 1.00 0.00 C ATOM 505 CG2 VAL A 401 0.412 -14.612 -3.098 1.00 0.00 C ATOM 0 H VAL A 401 2.093 -10.798 -3.214 1.00 0.00 H new ATOM 0 HA VAL A 401 -0.319 -12.173 -2.200 1.00 0.00 H new ATOM 0 HB VAL A 401 0.362 -12.954 -4.435 1.00 0.00 H new ATOM 0 HG11 VAL A 401 2.514 -14.111 -4.744 1.00 0.00 H new ATOM 0 HG12 VAL A 401 2.735 -12.390 -4.348 1.00 0.00 H new ATOM 0 HG13 VAL A 401 3.001 -13.632 -3.101 1.00 0.00 H new ATOM 0 HG21 VAL A 401 0.559 -15.348 -3.888 1.00 0.00 H new ATOM 0 HG22 VAL A 401 0.952 -14.925 -2.205 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -0.651 -14.532 -2.870 1.00 0.00 H new ATOM 515 N GLY A 402 2.065 -11.544 -0.535 1.00 0.00 N ATOM 516 CA GLY A 402 2.878 -11.784 0.633 1.00 0.00 C ATOM 517 C GLY A 402 2.145 -12.539 1.715 1.00 0.00 C ATOM 518 O GLY A 402 1.049 -13.057 1.501 1.00 0.00 O ATOM 0 H GLY A 402 1.914 -10.561 -0.760 1.00 0.00 H new ATOM 0 HA2 GLY A 402 3.765 -12.346 0.342 1.00 0.00 H new ATOM 0 HA3 GLY A 402 3.222 -10.830 1.032 1.00 0.00 H new ATOM 522 N LYS A 403 2.764 -12.593 2.882 1.00 0.00 N ATOM 523 CA LYS A 403 2.182 -13.286 4.033 1.00 0.00 C ATOM 524 C LYS A 403 2.280 -12.435 5.296 1.00 0.00 C ATOM 525 O LYS A 403 3.261 -11.731 5.503 1.00 0.00 O ATOM 526 CB LYS A 403 2.876 -14.631 4.250 1.00 0.00 C ATOM 527 CG LYS A 403 2.279 -15.759 3.427 1.00 0.00 C ATOM 528 CD LYS A 403 2.824 -15.757 2.008 1.00 0.00 C ATOM 529 CE LYS A 403 3.908 -16.808 1.827 1.00 0.00 C ATOM 530 NZ LYS A 403 4.808 -16.487 0.684 1.00 0.00 N ATOM 0 H LYS A 403 3.672 -12.166 3.064 1.00 0.00 H new ATOM 0 HA LYS A 403 1.127 -13.460 3.822 1.00 0.00 H new ATOM 0 HB2 LYS A 403 3.933 -14.530 4.002 1.00 0.00 H new ATOM 0 HB3 LYS A 403 2.820 -14.894 5.306 1.00 0.00 H new ATOM 0 HG2 LYS A 403 2.500 -16.715 3.902 1.00 0.00 H new ATOM 0 HG3 LYS A 403 1.194 -15.659 3.402 1.00 0.00 H new ATOM 0 HD2 LYS A 403 2.012 -15.945 1.305 1.00 0.00 H new ATOM 0 HD3 LYS A 403 3.228 -14.772 1.773 1.00 0.00 H new ATOM 0 HE2 LYS A 403 4.496 -16.884 2.742 1.00 0.00 H new ATOM 0 HE3 LYS A 403 3.446 -17.782 1.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 5.533 -17.227 0.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 4.251 -16.439 -0.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 5.269 -15.570 0.852 1.00 0.00 H new ATOM 544 N LYS A 404 1.257 -12.514 6.138 1.00 0.00 N ATOM 545 CA LYS A 404 1.208 -11.750 7.383 1.00 0.00 C ATOM 546 C LYS A 404 2.488 -11.900 8.206 1.00 0.00 C ATOM 547 O LYS A 404 2.842 -11.007 8.975 1.00 0.00 O ATOM 548 CB LYS A 404 0.001 -12.184 8.218 1.00 0.00 C ATOM 549 CG LYS A 404 -1.147 -11.189 8.189 1.00 0.00 C ATOM 550 CD LYS A 404 -1.074 -10.222 9.360 1.00 0.00 C ATOM 551 CE LYS A 404 -1.694 -10.816 10.615 1.00 0.00 C ATOM 552 NZ LYS A 404 -0.868 -10.547 11.823 1.00 0.00 N ATOM 0 H LYS A 404 0.441 -13.105 5.980 1.00 0.00 H new ATOM 0 HA LYS A 404 1.113 -10.698 7.113 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -0.355 -13.148 7.854 1.00 0.00 H new ATOM 0 HB3 LYS A 404 0.318 -12.331 9.251 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -1.123 -10.631 7.253 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -2.096 -11.725 8.217 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -0.033 -9.963 9.555 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -1.589 -9.297 9.102 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -2.692 -10.401 10.758 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -1.811 -11.892 10.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -1.325 -10.968 12.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 0.076 -10.964 11.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -0.777 -9.520 11.960 1.00 0.00 H new ATOM 566 N THR A 405 3.169 -13.030 8.059 1.00 0.00 N ATOM 567 CA THR A 405 4.395 -13.276 8.813 1.00 0.00 C ATOM 568 C THR A 405 5.625 -13.318 7.907 1.00 0.00 C ATOM 569 O THR A 405 6.703 -13.727 8.338 1.00 0.00 O ATOM 570 CB THR A 405 4.279 -14.586 9.592 1.00 0.00 C ATOM 571 OG1 THR A 405 3.436 -15.499 8.912 1.00 0.00 O ATOM 572 CG2 THR A 405 3.727 -14.405 10.989 1.00 0.00 C ATOM 0 H THR A 405 2.897 -13.786 7.430 1.00 0.00 H new ATOM 0 HA THR A 405 4.523 -12.446 9.508 1.00 0.00 H new ATOM 0 HB THR A 405 5.297 -14.968 9.668 1.00 0.00 H new ATOM 0 HG1 THR A 405 3.375 -16.332 9.425 1.00 0.00 H new ATOM 0 HG21 THR A 405 3.671 -15.373 11.486 1.00 0.00 H new ATOM 0 HG22 THR A 405 4.382 -13.743 11.556 1.00 0.00 H new ATOM 0 HG23 THR A 405 2.730 -13.968 10.933 1.00 0.00 H new ATOM 580 N ASP A 406 5.467 -12.894 6.656 1.00 0.00 N ATOM 581 CA ASP A 406 6.584 -12.890 5.716 1.00 0.00 C ATOM 582 C ASP A 406 7.286 -11.535 5.708 1.00 0.00 C ATOM 583 O ASP A 406 6.685 -10.511 6.030 1.00 0.00 O ATOM 584 CB ASP A 406 6.098 -13.238 4.306 1.00 0.00 C ATOM 585 CG ASP A 406 7.213 -13.195 3.279 1.00 0.00 C ATOM 586 OD1 ASP A 406 8.035 -14.135 3.255 1.00 0.00 O ATOM 587 OD2 ASP A 406 7.265 -12.222 2.498 1.00 0.00 O ATOM 0 H ASP A 406 4.586 -12.552 6.272 1.00 0.00 H new ATOM 0 HA ASP A 406 7.299 -13.646 6.040 1.00 0.00 H new ATOM 0 HB2 ASP A 406 5.654 -14.234 4.314 1.00 0.00 H new ATOM 0 HB3 ASP A 406 5.313 -12.541 4.014 1.00 0.00 H new ATOM 592 N LYS A 407 8.563 -11.539 5.335 1.00 0.00 N ATOM 593 CA LYS A 407 9.347 -10.310 5.282 1.00 0.00 C ATOM 594 C LYS A 407 8.739 -9.330 4.286 1.00 0.00 C ATOM 595 O LYS A 407 8.806 -8.115 4.474 1.00 0.00 O ATOM 596 CB LYS A 407 10.795 -10.619 4.898 1.00 0.00 C ATOM 597 CG LYS A 407 11.599 -11.261 6.016 1.00 0.00 C ATOM 598 CD LYS A 407 11.634 -12.776 5.880 1.00 0.00 C ATOM 599 CE LYS A 407 11.425 -13.462 7.221 1.00 0.00 C ATOM 600 NZ LYS A 407 12.017 -14.827 7.244 1.00 0.00 N ATOM 0 H LYS A 407 9.076 -12.379 5.065 1.00 0.00 H new ATOM 0 HA LYS A 407 9.335 -9.853 6.271 1.00 0.00 H new ATOM 0 HB2 LYS A 407 10.799 -11.282 4.033 1.00 0.00 H new ATOM 0 HB3 LYS A 407 11.286 -9.695 4.594 1.00 0.00 H new ATOM 0 HG2 LYS A 407 12.616 -10.870 6.004 1.00 0.00 H new ATOM 0 HG3 LYS A 407 11.165 -10.991 6.979 1.00 0.00 H new ATOM 0 HD2 LYS A 407 10.861 -13.097 5.182 1.00 0.00 H new ATOM 0 HD3 LYS A 407 12.592 -13.082 5.459 1.00 0.00 H new ATOM 0 HE2 LYS A 407 11.872 -12.859 8.011 1.00 0.00 H new ATOM 0 HE3 LYS A 407 10.358 -13.525 7.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 11.853 -15.261 8.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 11.572 -15.411 6.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 13.040 -14.765 7.066 1.00 0.00 H new ATOM 614 N ALA A 408 8.143 -9.869 3.228 1.00 0.00 N ATOM 615 CA ALA A 408 7.519 -9.046 2.202 1.00 0.00 C ATOM 616 C ALA A 408 6.359 -8.243 2.780 1.00 0.00 C ATOM 617 O ALA A 408 6.238 -7.049 2.524 1.00 0.00 O ATOM 618 CB ALA A 408 7.040 -9.915 1.047 1.00 0.00 C ATOM 0 H ALA A 408 8.080 -10.873 3.060 1.00 0.00 H new ATOM 0 HA ALA A 408 8.264 -8.344 1.827 1.00 0.00 H new ATOM 0 HB1 ALA A 408 6.575 -9.287 0.287 1.00 0.00 H new ATOM 0 HB2 ALA A 408 7.889 -10.443 0.612 1.00 0.00 H new ATOM 0 HB3 ALA A 408 6.312 -10.639 1.414 1.00 0.00 H new ATOM 624 N TYR A 409 5.512 -8.907 3.563 1.00 0.00 N ATOM 625 CA TYR A 409 4.362 -8.249 4.180 1.00 0.00 C ATOM 626 C TYR A 409 4.815 -7.136 5.106 1.00 0.00 C ATOM 627 O TYR A 409 4.263 -6.036 5.090 1.00 0.00 O ATOM 628 CB TYR A 409 3.538 -9.268 4.964 1.00 0.00 C ATOM 629 CG TYR A 409 2.494 -8.663 5.879 1.00 0.00 C ATOM 630 CD1 TYR A 409 2.835 -8.182 7.140 1.00 0.00 C ATOM 631 CD2 TYR A 409 1.166 -8.578 5.482 1.00 0.00 C ATOM 632 CE1 TYR A 409 1.881 -7.635 7.976 1.00 0.00 C ATOM 633 CE2 TYR A 409 0.206 -8.032 6.313 1.00 0.00 C ATOM 634 CZ TYR A 409 0.569 -7.563 7.558 1.00 0.00 C ATOM 635 OH TYR A 409 -0.385 -7.019 8.388 1.00 0.00 O ATOM 0 H TYR A 409 5.600 -9.899 3.785 1.00 0.00 H new ATOM 0 HA TYR A 409 3.748 -7.817 3.390 1.00 0.00 H new ATOM 0 HB2 TYR A 409 3.042 -9.935 4.259 1.00 0.00 H new ATOM 0 HB3 TYR A 409 4.214 -9.881 5.560 1.00 0.00 H new ATOM 0 HD1 TYR A 409 3.862 -8.237 7.470 1.00 0.00 H new ATOM 0 HD2 TYR A 409 0.879 -8.945 4.508 1.00 0.00 H new ATOM 0 HE1 TYR A 409 2.161 -7.266 8.951 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.823 -7.973 5.989 1.00 0.00 H new ATOM 0 HH TYR A 409 -0.729 -6.191 7.992 1.00 0.00 H new ATOM 645 N TRP A 410 5.829 -7.425 5.908 1.00 0.00 N ATOM 646 CA TRP A 410 6.357 -6.441 6.833 1.00 0.00 C ATOM 647 C TRP A 410 6.836 -5.224 6.060 1.00 0.00 C ATOM 648 O TRP A 410 6.480 -4.090 6.373 1.00 0.00 O ATOM 649 CB TRP A 410 7.497 -7.052 7.641 1.00 0.00 C ATOM 650 CG TRP A 410 7.277 -6.934 9.107 1.00 0.00 C ATOM 651 CD1 TRP A 410 6.749 -7.875 9.939 1.00 0.00 C ATOM 652 CD2 TRP A 410 7.566 -5.795 9.908 1.00 0.00 C ATOM 653 NE1 TRP A 410 6.691 -7.385 11.218 1.00 0.00 N ATOM 654 CE2 TRP A 410 7.193 -6.106 11.227 1.00 0.00 C ATOM 655 CE3 TRP A 410 8.109 -4.542 9.630 1.00 0.00 C ATOM 656 CZ2 TRP A 410 7.347 -5.201 12.274 1.00 0.00 C ATOM 657 CZ3 TRP A 410 8.263 -3.641 10.668 1.00 0.00 C ATOM 658 CH2 TRP A 410 7.884 -3.976 11.976 1.00 0.00 C ATOM 0 H TRP A 410 6.299 -8.330 5.935 1.00 0.00 H new ATOM 0 HA TRP A 410 5.574 -6.129 7.524 1.00 0.00 H new ATOM 0 HB2 TRP A 410 7.604 -8.104 7.376 1.00 0.00 H new ATOM 0 HB3 TRP A 410 8.432 -6.559 7.375 1.00 0.00 H new ATOM 0 HD1 TRP A 410 6.425 -8.860 9.636 1.00 0.00 H new ATOM 0 HE1 TRP A 410 6.334 -7.888 12.030 1.00 0.00 H new ATOM 0 HE3 TRP A 410 8.404 -4.280 8.625 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 7.054 -5.455 13.282 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 8.681 -2.665 10.468 1.00 0.00 H new ATOM 0 HH2 TRP A 410 8.018 -3.252 12.766 1.00 0.00 H new ATOM 669 N LEU A 411 7.612 -5.492 5.023 1.00 0.00 N ATOM 670 CA LEU A 411 8.130 -4.467 4.141 1.00 0.00 C ATOM 671 C LEU A 411 6.971 -3.802 3.402 1.00 0.00 C ATOM 672 O LEU A 411 6.966 -2.588 3.198 1.00 0.00 O ATOM 673 CB LEU A 411 9.126 -5.098 3.155 1.00 0.00 C ATOM 674 CG LEU A 411 9.326 -4.363 1.825 1.00 0.00 C ATOM 675 CD1 LEU A 411 10.409 -3.304 1.957 1.00 0.00 C ATOM 676 CD2 LEU A 411 9.678 -5.357 0.726 1.00 0.00 C ATOM 0 H LEU A 411 7.901 -6.437 4.770 1.00 0.00 H new ATOM 0 HA LEU A 411 8.653 -3.704 4.718 1.00 0.00 H new ATOM 0 HB2 LEU A 411 10.094 -5.177 3.650 1.00 0.00 H new ATOM 0 HB3 LEU A 411 8.795 -6.114 2.938 1.00 0.00 H new ATOM 0 HG LEU A 411 8.395 -3.864 1.558 1.00 0.00 H new ATOM 0 HD11 LEU A 411 10.537 -2.793 1.003 1.00 0.00 H new ATOM 0 HD12 LEU A 411 10.120 -2.581 2.720 1.00 0.00 H new ATOM 0 HD13 LEU A 411 11.348 -3.778 2.243 1.00 0.00 H new ATOM 0 HD21 LEU A 411 9.818 -4.825 -0.215 1.00 0.00 H new ATOM 0 HD22 LEU A 411 10.598 -5.879 0.988 1.00 0.00 H new ATOM 0 HD23 LEU A 411 8.870 -6.080 0.617 1.00 0.00 H new ATOM 688 N LEU A 412 5.976 -4.609 3.014 1.00 0.00 N ATOM 689 CA LEU A 412 4.809 -4.086 2.315 1.00 0.00 C ATOM 690 C LEU A 412 4.096 -3.081 3.210 1.00 0.00 C ATOM 691 O LEU A 412 3.779 -1.968 2.791 1.00 0.00 O ATOM 692 CB LEU A 412 3.852 -5.220 1.939 1.00 0.00 C ATOM 693 CG LEU A 412 3.086 -5.008 0.631 1.00 0.00 C ATOM 694 CD1 LEU A 412 2.218 -3.762 0.716 1.00 0.00 C ATOM 695 CD2 LEU A 412 4.052 -4.909 -0.541 1.00 0.00 C ATOM 0 H LEU A 412 5.960 -5.616 3.173 1.00 0.00 H new ATOM 0 HA LEU A 412 5.136 -3.595 1.398 1.00 0.00 H new ATOM 0 HB2 LEU A 412 4.421 -6.147 1.864 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.133 -5.352 2.747 1.00 0.00 H new ATOM 0 HG LEU A 412 2.435 -5.867 0.469 1.00 0.00 H new ATOM 0 HD11 LEU A 412 1.681 -3.628 -0.223 1.00 0.00 H new ATOM 0 HD12 LEU A 412 1.502 -3.872 1.531 1.00 0.00 H new ATOM 0 HD13 LEU A 412 2.848 -2.892 0.901 1.00 0.00 H new ATOM 0 HD21 LEU A 412 3.491 -4.758 -1.463 1.00 0.00 H new ATOM 0 HD22 LEU A 412 4.727 -4.068 -0.386 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.630 -5.830 -0.615 1.00 0.00 H new ATOM 707 N GLU A 413 3.893 -3.480 4.460 1.00 0.00 N ATOM 708 CA GLU A 413 3.269 -2.621 5.455 1.00 0.00 C ATOM 709 C GLU A 413 4.227 -1.495 5.831 1.00 0.00 C ATOM 710 O GLU A 413 3.810 -0.383 6.156 1.00 0.00 O ATOM 711 CB GLU A 413 2.886 -3.428 6.697 1.00 0.00 C ATOM 712 CG GLU A 413 1.510 -3.084 7.246 1.00 0.00 C ATOM 713 CD GLU A 413 0.829 -4.270 7.898 1.00 0.00 C ATOM 714 OE1 GLU A 413 1.386 -4.811 8.877 1.00 0.00 O ATOM 715 OE2 GLU A 413 -0.261 -4.660 7.430 1.00 0.00 O ATOM 0 H GLU A 413 4.155 -4.402 4.809 1.00 0.00 H new ATOM 0 HA GLU A 413 2.360 -2.193 5.033 1.00 0.00 H new ATOM 0 HB2 GLU A 413 2.916 -4.490 6.453 1.00 0.00 H new ATOM 0 HB3 GLU A 413 3.631 -3.258 7.474 1.00 0.00 H new ATOM 0 HG2 GLU A 413 1.605 -2.279 7.974 1.00 0.00 H new ATOM 0 HG3 GLU A 413 0.883 -2.710 6.437 1.00 0.00 H new ATOM 722 N GLU A 414 5.518 -1.814 5.790 1.00 0.00 N ATOM 723 CA GLU A 414 6.568 -0.865 6.129 1.00 0.00 C ATOM 724 C GLU A 414 6.577 0.306 5.152 1.00 0.00 C ATOM 725 O GLU A 414 6.768 1.456 5.550 1.00 0.00 O ATOM 726 CB GLU A 414 7.929 -1.573 6.120 1.00 0.00 C ATOM 727 CG GLU A 414 8.615 -1.591 7.476 1.00 0.00 C ATOM 728 CD GLU A 414 10.044 -2.092 7.399 1.00 0.00 C ATOM 729 OE1 GLU A 414 10.266 -3.164 6.798 1.00 0.00 O ATOM 730 OE2 GLU A 414 10.941 -1.412 7.939 1.00 0.00 O ATOM 0 H GLU A 414 5.862 -2.736 5.521 1.00 0.00 H new ATOM 0 HA GLU A 414 6.373 -0.473 7.127 1.00 0.00 H new ATOM 0 HB2 GLU A 414 7.793 -2.599 5.777 1.00 0.00 H new ATOM 0 HB3 GLU A 414 8.581 -1.080 5.399 1.00 0.00 H new ATOM 0 HG2 GLU A 414 8.609 -0.585 7.896 1.00 0.00 H new ATOM 0 HG3 GLU A 414 8.048 -2.225 8.158 1.00 0.00 H new ATOM 737 N MET A 415 6.360 0.012 3.875 1.00 0.00 N ATOM 738 CA MET A 415 6.333 1.043 2.851 1.00 0.00 C ATOM 739 C MET A 415 5.095 1.919 3.019 1.00 0.00 C ATOM 740 O MET A 415 5.164 3.143 2.900 1.00 0.00 O ATOM 741 CB MET A 415 6.350 0.402 1.462 1.00 0.00 C ATOM 742 CG MET A 415 6.244 1.405 0.328 1.00 0.00 C ATOM 743 SD MET A 415 5.493 0.703 -1.153 1.00 0.00 S ATOM 744 CE MET A 415 6.699 1.161 -2.396 1.00 0.00 C ATOM 0 H MET A 415 6.200 -0.933 3.527 1.00 0.00 H new ATOM 0 HA MET A 415 7.218 1.671 2.957 1.00 0.00 H new ATOM 0 HB2 MET A 415 7.271 -0.169 1.346 1.00 0.00 H new ATOM 0 HB3 MET A 415 5.525 -0.306 1.388 1.00 0.00 H new ATOM 0 HG2 MET A 415 5.655 2.260 0.659 1.00 0.00 H new ATOM 0 HG3 MET A 415 7.239 1.778 0.084 1.00 0.00 H new ATOM 0 HE1 MET A 415 6.374 0.796 -3.370 1.00 0.00 H new ATOM 0 HE2 MET A 415 6.794 2.246 -2.429 1.00 0.00 H new ATOM 0 HE3 MET A 415 7.664 0.720 -2.147 1.00 0.00 H new ATOM 754 N LEU A 416 3.965 1.281 3.304 1.00 0.00 N ATOM 755 CA LEU A 416 2.710 1.998 3.500 1.00 0.00 C ATOM 756 C LEU A 416 2.823 2.963 4.674 1.00 0.00 C ATOM 757 O LEU A 416 2.329 4.090 4.617 1.00 0.00 O ATOM 758 CB LEU A 416 1.566 1.011 3.739 1.00 0.00 C ATOM 759 CG LEU A 416 0.178 1.527 3.359 1.00 0.00 C ATOM 760 CD1 LEU A 416 -0.257 2.631 4.308 1.00 0.00 C ATOM 761 CD2 LEU A 416 0.168 2.022 1.921 1.00 0.00 C ATOM 0 H LEU A 416 3.892 0.269 3.404 1.00 0.00 H new ATOM 0 HA LEU A 416 2.497 2.571 2.598 1.00 0.00 H new ATOM 0 HB2 LEU A 416 1.767 0.101 3.173 1.00 0.00 H new ATOM 0 HB3 LEU A 416 1.558 0.735 4.793 1.00 0.00 H new ATOM 0 HG LEU A 416 -0.531 0.703 3.442 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -1.247 2.987 4.023 1.00 0.00 H new ATOM 0 HD12 LEU A 416 -0.290 2.243 5.326 1.00 0.00 H new ATOM 0 HD13 LEU A 416 0.454 3.456 4.257 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.828 2.385 1.668 1.00 0.00 H new ATOM 0 HD22 LEU A 416 0.889 2.832 1.810 1.00 0.00 H new ATOM 0 HD23 LEU A 416 0.436 1.204 1.253 1.00 0.00 H new ATOM 773 N THR A 417 3.485 2.515 5.738 1.00 0.00 N ATOM 774 CA THR A 417 3.671 3.340 6.925 1.00 0.00 C ATOM 775 C THR A 417 4.521 4.563 6.596 1.00 0.00 C ATOM 776 O THR A 417 4.335 5.636 7.169 1.00 0.00 O ATOM 777 CB THR A 417 4.335 2.528 8.037 1.00 0.00 C ATOM 778 OG1 THR A 417 3.823 1.207 8.068 1.00 0.00 O ATOM 779 CG2 THR A 417 4.143 3.127 9.414 1.00 0.00 C ATOM 0 H THR A 417 3.901 1.586 5.801 1.00 0.00 H new ATOM 0 HA THR A 417 2.692 3.675 7.268 1.00 0.00 H new ATOM 0 HB THR A 417 5.399 2.534 7.802 1.00 0.00 H new ATOM 0 HG1 THR A 417 4.340 0.641 7.458 1.00 0.00 H new ATOM 0 HG21 THR A 417 4.639 2.501 10.156 1.00 0.00 H new ATOM 0 HG22 THR A 417 4.573 4.128 9.438 1.00 0.00 H new ATOM 0 HG23 THR A 417 3.078 3.184 9.641 1.00 0.00 H new ATOM 787 N LYS A 418 5.455 4.391 5.667 1.00 0.00 N ATOM 788 CA LYS A 418 6.333 5.479 5.257 1.00 0.00 C ATOM 789 C LYS A 418 5.582 6.502 4.404 1.00 0.00 C ATOM 790 O LYS A 418 5.983 7.661 4.307 1.00 0.00 O ATOM 791 CB LYS A 418 7.530 4.929 4.477 1.00 0.00 C ATOM 792 CG LYS A 418 8.568 5.985 4.133 1.00 0.00 C ATOM 793 CD LYS A 418 9.868 5.759 4.889 1.00 0.00 C ATOM 794 CE LYS A 418 10.861 4.957 4.063 1.00 0.00 C ATOM 795 NZ LYS A 418 11.988 4.445 4.892 1.00 0.00 N ATOM 0 H LYS A 418 5.623 3.508 5.184 1.00 0.00 H new ATOM 0 HA LYS A 418 6.690 5.979 6.157 1.00 0.00 H new ATOM 0 HB2 LYS A 418 8.005 4.142 5.063 1.00 0.00 H new ATOM 0 HB3 LYS A 418 7.173 4.469 3.556 1.00 0.00 H new ATOM 0 HG2 LYS A 418 8.763 5.969 3.061 1.00 0.00 H new ATOM 0 HG3 LYS A 418 8.175 6.973 4.371 1.00 0.00 H new ATOM 0 HD2 LYS A 418 10.307 6.720 5.155 1.00 0.00 H new ATOM 0 HD3 LYS A 418 9.661 5.234 5.822 1.00 0.00 H new ATOM 0 HE2 LYS A 418 10.348 4.119 3.591 1.00 0.00 H new ATOM 0 HE3 LYS A 418 11.255 5.582 3.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 12.643 3.904 4.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 12.494 5.245 5.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 11.615 3.828 5.642 1.00 0.00 H new ATOM 809 N GLU A 419 4.498 6.062 3.777 1.00 0.00 N ATOM 810 CA GLU A 419 3.698 6.925 2.933 1.00 0.00 C ATOM 811 C GLU A 419 2.892 7.920 3.771 1.00 0.00 C ATOM 812 O GLU A 419 2.843 9.111 3.464 1.00 0.00 O ATOM 813 CB GLU A 419 2.771 6.057 2.074 1.00 0.00 C ATOM 814 CG GLU A 419 1.614 6.816 1.461 1.00 0.00 C ATOM 815 CD GLU A 419 1.666 6.842 -0.054 1.00 0.00 C ATOM 816 OE1 GLU A 419 1.408 5.790 -0.676 1.00 0.00 O ATOM 817 OE2 GLU A 419 1.966 7.915 -0.619 1.00 0.00 O ATOM 0 H GLU A 419 4.155 5.104 3.842 1.00 0.00 H new ATOM 0 HA GLU A 419 4.355 7.506 2.286 1.00 0.00 H new ATOM 0 HB2 GLU A 419 3.355 5.598 1.276 1.00 0.00 H new ATOM 0 HB3 GLU A 419 2.377 5.247 2.687 1.00 0.00 H new ATOM 0 HG2 GLU A 419 0.677 6.360 1.780 1.00 0.00 H new ATOM 0 HG3 GLU A 419 1.616 7.839 1.838 1.00 0.00 H new ATOM 824 N LEU A 420 2.248 7.414 4.817 1.00 0.00 N ATOM 825 CA LEU A 420 1.423 8.248 5.689 1.00 0.00 C ATOM 826 C LEU A 420 2.246 9.292 6.437 1.00 0.00 C ATOM 827 O LEU A 420 1.897 10.472 6.447 1.00 0.00 O ATOM 828 CB LEU A 420 0.655 7.388 6.696 1.00 0.00 C ATOM 829 CG LEU A 420 1.456 6.260 7.352 1.00 0.00 C ATOM 830 CD1 LEU A 420 1.975 6.694 8.716 1.00 0.00 C ATOM 831 CD2 LEU A 420 0.604 5.005 7.478 1.00 0.00 C ATOM 0 H LEU A 420 2.280 6.430 5.083 1.00 0.00 H new ATOM 0 HA LEU A 420 0.718 8.772 5.044 1.00 0.00 H new ATOM 0 HB2 LEU A 420 0.268 8.038 7.481 1.00 0.00 H new ATOM 0 HB3 LEU A 420 -0.206 6.951 6.191 1.00 0.00 H new ATOM 0 HG LEU A 420 2.312 6.032 6.717 1.00 0.00 H new ATOM 0 HD11 LEU A 420 2.542 5.879 9.166 1.00 0.00 H new ATOM 0 HD12 LEU A 420 2.621 7.564 8.599 1.00 0.00 H new ATOM 0 HD13 LEU A 420 1.134 6.950 9.360 1.00 0.00 H new ATOM 0 HD21 LEU A 420 1.189 4.214 7.946 1.00 0.00 H new ATOM 0 HD22 LEU A 420 -0.272 5.220 8.090 1.00 0.00 H new ATOM 0 HD23 LEU A 420 0.284 4.682 6.488 1.00 0.00 H new ATOM 843 N LEU A 421 3.325 8.857 7.076 1.00 0.00 N ATOM 844 CA LEU A 421 4.166 9.775 7.836 1.00 0.00 C ATOM 845 C LEU A 421 4.821 10.810 6.921 1.00 0.00 C ATOM 846 O LEU A 421 5.063 11.945 7.331 1.00 0.00 O ATOM 847 CB LEU A 421 5.203 9.002 8.679 1.00 0.00 C ATOM 848 CG LEU A 421 6.638 8.938 8.138 1.00 0.00 C ATOM 849 CD1 LEU A 421 6.655 8.391 6.724 1.00 0.00 C ATOM 850 CD2 LEU A 421 7.306 10.306 8.200 1.00 0.00 C ATOM 0 H LEU A 421 3.636 7.886 7.084 1.00 0.00 H new ATOM 0 HA LEU A 421 3.531 10.324 8.531 1.00 0.00 H new ATOM 0 HB2 LEU A 421 5.236 9.452 9.671 1.00 0.00 H new ATOM 0 HB3 LEU A 421 4.843 7.981 8.804 1.00 0.00 H new ATOM 0 HG LEU A 421 7.208 8.258 8.772 1.00 0.00 H new ATOM 0 HD11 LEU A 421 7.682 8.354 6.360 1.00 0.00 H new ATOM 0 HD12 LEU A 421 6.232 7.387 6.717 1.00 0.00 H new ATOM 0 HD13 LEU A 421 6.064 9.038 6.076 1.00 0.00 H new ATOM 0 HD21 LEU A 421 8.322 10.233 7.811 1.00 0.00 H new ATOM 0 HD22 LEU A 421 6.737 11.016 7.599 1.00 0.00 H new ATOM 0 HD23 LEU A 421 7.337 10.649 9.234 1.00 0.00 H new ATOM 862 N GLU A 422 5.102 10.419 5.682 1.00 0.00 N ATOM 863 CA GLU A 422 5.725 11.323 4.723 1.00 0.00 C ATOM 864 C GLU A 422 4.801 12.496 4.410 1.00 0.00 C ATOM 865 O GLU A 422 5.251 13.632 4.261 1.00 0.00 O ATOM 866 CB GLU A 422 6.074 10.581 3.432 1.00 0.00 C ATOM 867 CG GLU A 422 6.880 11.417 2.450 1.00 0.00 C ATOM 868 CD GLU A 422 8.369 11.373 2.732 1.00 0.00 C ATOM 869 OE1 GLU A 422 8.746 11.162 3.904 1.00 0.00 O ATOM 870 OE2 GLU A 422 9.159 11.550 1.781 1.00 0.00 O ATOM 0 H GLU A 422 4.909 9.485 5.320 1.00 0.00 H new ATOM 0 HA GLU A 422 6.643 11.707 5.169 1.00 0.00 H new ATOM 0 HB2 GLU A 422 6.638 9.682 3.680 1.00 0.00 H new ATOM 0 HB3 GLU A 422 5.153 10.256 2.949 1.00 0.00 H new ATOM 0 HG2 GLU A 422 6.695 11.060 1.437 1.00 0.00 H new ATOM 0 HG3 GLU A 422 6.537 12.451 2.491 1.00 0.00 H new ATOM 877 N LEU A 423 3.508 12.210 4.310 1.00 0.00 N ATOM 878 CA LEU A 423 2.518 13.239 4.013 1.00 0.00 C ATOM 879 C LEU A 423 2.279 14.133 5.224 1.00 0.00 C ATOM 880 O LEU A 423 1.976 15.318 5.084 1.00 0.00 O ATOM 881 CB LEU A 423 1.204 12.596 3.569 1.00 0.00 C ATOM 882 CG LEU A 423 1.163 12.169 2.099 1.00 0.00 C ATOM 883 CD1 LEU A 423 1.040 10.656 1.979 1.00 0.00 C ATOM 884 CD2 LEU A 423 0.016 12.859 1.374 1.00 0.00 C ATOM 0 H LEU A 423 3.120 11.274 4.430 1.00 0.00 H new ATOM 0 HA LEU A 423 2.905 13.857 3.202 1.00 0.00 H new ATOM 0 HB2 LEU A 423 1.015 11.722 4.192 1.00 0.00 H new ATOM 0 HB3 LEU A 423 0.392 13.299 3.751 1.00 0.00 H new ATOM 0 HG LEU A 423 2.099 12.472 1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 423 1.013 10.376 0.926 1.00 0.00 H new ATOM 0 HD12 LEU A 423 1.896 10.182 2.459 1.00 0.00 H new ATOM 0 HD13 LEU A 423 0.123 10.326 2.466 1.00 0.00 H new ATOM 0 HD21 LEU A 423 0.003 12.543 0.331 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -0.928 12.589 1.847 1.00 0.00 H new ATOM 0 HD23 LEU A 423 0.151 13.939 1.424 1.00 0.00 H new ATOM 896 N ASP A 424 2.417 13.560 6.415 1.00 0.00 N ATOM 897 CA ASP A 424 2.216 14.308 7.651 1.00 0.00 C ATOM 898 C ASP A 424 3.388 15.248 7.917 1.00 0.00 C ATOM 899 O ASP A 424 3.229 16.289 8.556 1.00 0.00 O ATOM 900 CB ASP A 424 2.038 13.349 8.830 1.00 0.00 C ATOM 901 CG ASP A 424 1.390 14.018 10.026 1.00 0.00 C ATOM 902 OD1 ASP A 424 0.523 14.892 9.819 1.00 0.00 O ATOM 903 OD2 ASP A 424 1.749 13.666 11.170 1.00 0.00 O ATOM 0 H ASP A 424 2.667 12.580 6.551 1.00 0.00 H new ATOM 0 HA ASP A 424 1.312 14.907 7.539 1.00 0.00 H new ATOM 0 HB2 ASP A 424 1.428 12.501 8.517 1.00 0.00 H new ATOM 0 HB3 ASP A 424 3.010 12.952 9.122 1.00 0.00 H new ATOM 908 N SER A 425 4.565 14.876 7.425 1.00 0.00 N ATOM 909 CA SER A 425 5.763 15.686 7.611 1.00 0.00 C ATOM 910 C SER A 425 6.045 16.535 6.375 1.00 0.00 C ATOM 911 O SER A 425 7.196 16.700 5.972 1.00 0.00 O ATOM 912 CB SER A 425 6.967 14.792 7.915 1.00 0.00 C ATOM 913 OG SER A 425 7.336 14.031 6.779 1.00 0.00 O ATOM 0 H SER A 425 4.715 14.018 6.894 1.00 0.00 H new ATOM 0 HA SER A 425 5.591 16.353 8.456 1.00 0.00 H new ATOM 0 HB2 SER A 425 7.809 15.406 8.234 1.00 0.00 H new ATOM 0 HB3 SER A 425 6.728 14.124 8.742 1.00 0.00 H new ATOM 0 HG SER A 425 6.745 13.253 6.700 1.00 0.00 H new ATOM 919 N VAL A 426 4.987 17.074 5.779 1.00 0.00 N ATOM 920 CA VAL A 426 5.122 17.908 4.589 1.00 0.00 C ATOM 921 C VAL A 426 5.024 19.387 4.941 1.00 0.00 C ATOM 922 O VAL A 426 4.170 19.793 5.729 1.00 0.00 O ATOM 923 CB VAL A 426 4.049 17.568 3.538 1.00 0.00 C ATOM 924 CG1 VAL A 426 4.310 18.320 2.242 1.00 0.00 C ATOM 925 CG2 VAL A 426 4.000 16.068 3.291 1.00 0.00 C ATOM 0 H VAL A 426 4.027 16.949 6.100 1.00 0.00 H new ATOM 0 HA VAL A 426 6.107 17.702 4.169 1.00 0.00 H new ATOM 0 HB VAL A 426 3.079 17.882 3.923 1.00 0.00 H new ATOM 0 HG11 VAL A 426 3.541 18.066 1.513 1.00 0.00 H new ATOM 0 HG12 VAL A 426 4.288 19.393 2.433 1.00 0.00 H new ATOM 0 HG13 VAL A 426 5.288 18.041 1.850 1.00 0.00 H new ATOM 0 HG21 VAL A 426 3.236 15.847 2.546 1.00 0.00 H new ATOM 0 HG22 VAL A 426 4.970 15.727 2.929 1.00 0.00 H new ATOM 0 HG23 VAL A 426 3.759 15.554 4.221 1.00 0.00 H new ATOM 935 N GLU A 427 5.903 20.191 4.351 1.00 0.00 N ATOM 936 CA GLU A 427 5.915 21.627 4.602 1.00 0.00 C ATOM 937 C GLU A 427 4.597 22.265 4.175 1.00 0.00 C ATOM 938 O GLU A 427 4.040 21.924 3.131 1.00 0.00 O ATOM 939 CB GLU A 427 7.079 22.285 3.858 1.00 0.00 C ATOM 940 CG GLU A 427 8.421 21.622 4.119 1.00 0.00 C ATOM 941 CD GLU A 427 8.751 21.539 5.596 1.00 0.00 C ATOM 942 OE1 GLU A 427 8.303 20.574 6.251 1.00 0.00 O ATOM 943 OE2 GLU A 427 9.460 22.436 6.097 1.00 0.00 O ATOM 0 H GLU A 427 6.616 19.872 3.696 1.00 0.00 H new ATOM 0 HA GLU A 427 6.042 21.783 5.673 1.00 0.00 H new ATOM 0 HB2 GLU A 427 6.874 22.262 2.788 1.00 0.00 H new ATOM 0 HB3 GLU A 427 7.139 23.334 4.149 1.00 0.00 H new ATOM 0 HG2 GLU A 427 8.415 20.618 3.695 1.00 0.00 H new ATOM 0 HG3 GLU A 427 9.204 22.180 3.606 1.00 0.00 H new ATOM 950 N THR A 428 4.102 23.190 4.991 1.00 0.00 N ATOM 951 CA THR A 428 2.849 23.876 4.698 1.00 0.00 C ATOM 952 C THR A 428 2.813 25.249 5.358 1.00 0.00 C ATOM 953 O THR A 428 3.601 25.536 6.260 1.00 0.00 O ATOM 954 CB THR A 428 1.662 23.036 5.175 1.00 0.00 C ATOM 955 OG1 THR A 428 1.948 22.427 6.421 1.00 0.00 O ATOM 956 CG2 THR A 428 1.276 21.941 4.205 1.00 0.00 C ATOM 0 H THR A 428 4.549 23.482 5.860 1.00 0.00 H new ATOM 0 HA THR A 428 2.781 24.011 3.619 1.00 0.00 H new ATOM 0 HB THR A 428 0.829 23.734 5.259 1.00 0.00 H new ATOM 0 HG1 THR A 428 1.177 21.896 6.710 1.00 0.00 H new ATOM 0 HG21 THR A 428 0.428 21.384 4.604 1.00 0.00 H new ATOM 0 HG22 THR A 428 1.001 22.383 3.247 1.00 0.00 H new ATOM 0 HG23 THR A 428 2.120 21.266 4.064 1.00 0.00 H new ATOM 964 N GLY A 429 1.895 26.096 4.904 1.00 0.00 N ATOM 965 CA GLY A 429 1.775 27.429 5.462 1.00 0.00 C ATOM 966 C GLY A 429 0.577 28.181 4.916 1.00 0.00 C ATOM 967 O GLY A 429 0.635 28.744 3.822 1.00 0.00 O ATOM 0 H GLY A 429 1.232 25.882 4.159 1.00 0.00 H new ATOM 0 HA2 GLY A 429 1.693 27.359 6.547 1.00 0.00 H new ATOM 0 HA3 GLY A 429 2.683 27.993 5.247 1.00 0.00 H new ATOM 971 N GLY A 430 -0.511 28.190 5.678 1.00 0.00 N ATOM 972 CA GLY A 430 -1.712 28.881 5.248 1.00 0.00 C ATOM 973 C GLY A 430 -2.341 28.243 4.026 1.00 0.00 C ATOM 974 O GLY A 430 -2.653 28.926 3.051 1.00 0.00 O ATOM 0 H GLY A 430 -0.583 27.731 6.586 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -2.435 28.888 6.063 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -1.470 29.921 5.028 1.00 0.00 H new ATOM 978 N GLN A 431 -2.529 26.928 4.078 1.00 0.00 N ATOM 979 CA GLN A 431 -3.126 26.196 2.968 1.00 0.00 C ATOM 980 C GLN A 431 -3.935 25.006 3.472 1.00 0.00 C ATOM 981 O GLN A 431 -3.421 23.891 3.575 1.00 0.00 O ATOM 982 CB GLN A 431 -2.039 25.717 2.003 1.00 0.00 C ATOM 983 CG GLN A 431 -1.678 26.739 0.938 1.00 0.00 C ATOM 984 CD GLN A 431 -0.187 26.802 0.673 1.00 0.00 C ATOM 985 OE1 GLN A 431 0.614 26.961 1.594 1.00 0.00 O ATOM 986 NE2 GLN A 431 0.195 26.679 -0.593 1.00 0.00 N ATOM 0 H GLN A 431 -2.276 26.348 4.878 1.00 0.00 H new ATOM 0 HA GLN A 431 -3.799 26.872 2.441 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -1.144 25.466 2.572 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -2.374 24.801 1.517 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -2.198 26.493 0.012 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -2.030 27.723 1.249 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -0.502 26.549 -1.326 1.00 0.00 H new ATOM 0 HE22 GLN A 431 1.186 26.715 -0.833 1.00 0.00 H new ATOM 995 N ASP A 432 -5.203 25.249 3.788 1.00 0.00 N ATOM 996 CA ASP A 432 -6.083 24.197 4.283 1.00 0.00 C ATOM 997 C ASP A 432 -6.307 23.128 3.218 1.00 0.00 C ATOM 998 O ASP A 432 -6.447 21.946 3.531 1.00 0.00 O ATOM 999 CB ASP A 432 -7.424 24.789 4.718 1.00 0.00 C ATOM 1000 CG ASP A 432 -8.163 23.892 5.692 1.00 0.00 C ATOM 1001 OD1 ASP A 432 -7.503 23.301 6.572 1.00 0.00 O ATOM 1002 OD2 ASP A 432 -9.401 23.780 5.574 1.00 0.00 O ATOM 0 H ASP A 432 -5.644 26.165 3.710 1.00 0.00 H new ATOM 0 HA ASP A 432 -5.603 23.731 5.143 1.00 0.00 H new ATOM 0 HB2 ASP A 432 -7.256 25.762 5.180 1.00 0.00 H new ATOM 0 HB3 ASP A 432 -8.046 24.957 3.839 1.00 0.00 H new ATOM 1007 N SER A 433 -6.337 23.551 1.959 1.00 0.00 N ATOM 1008 CA SER A 433 -6.543 22.628 0.849 1.00 0.00 C ATOM 1009 C SER A 433 -5.437 21.580 0.800 1.00 0.00 C ATOM 1010 O SER A 433 -5.702 20.390 0.622 1.00 0.00 O ATOM 1011 CB SER A 433 -6.595 23.393 -0.475 1.00 0.00 C ATOM 1012 OG SER A 433 -7.468 24.505 -0.388 1.00 0.00 O ATOM 0 H SER A 433 -6.221 24.526 1.682 1.00 0.00 H new ATOM 0 HA SER A 433 -7.494 22.119 1.005 1.00 0.00 H new ATOM 0 HB2 SER A 433 -5.594 23.733 -0.742 1.00 0.00 H new ATOM 0 HB3 SER A 433 -6.928 22.727 -1.271 1.00 0.00 H new ATOM 0 HG SER A 433 -7.482 24.978 -1.246 1.00 0.00 H new ATOM 1018 N VAL A 434 -4.196 22.028 0.961 1.00 0.00 N ATOM 1019 CA VAL A 434 -3.049 21.129 0.936 1.00 0.00 C ATOM 1020 C VAL A 434 -3.073 20.181 2.132 1.00 0.00 C ATOM 1021 O VAL A 434 -2.686 19.018 2.022 1.00 0.00 O ATOM 1022 CB VAL A 434 -1.720 21.909 0.940 1.00 0.00 C ATOM 1023 CG1 VAL A 434 -0.542 20.964 0.766 1.00 0.00 C ATOM 1024 CG2 VAL A 434 -1.722 22.974 -0.147 1.00 0.00 C ATOM 0 H VAL A 434 -3.959 23.009 1.110 1.00 0.00 H new ATOM 0 HA VAL A 434 -3.118 20.553 0.013 1.00 0.00 H new ATOM 0 HB VAL A 434 -1.617 22.406 1.905 1.00 0.00 H new ATOM 0 HG11 VAL A 434 0.386 21.535 0.772 1.00 0.00 H new ATOM 0 HG12 VAL A 434 -0.530 20.243 1.584 1.00 0.00 H new ATOM 0 HG13 VAL A 434 -0.637 20.435 -0.182 1.00 0.00 H new ATOM 0 HG21 VAL A 434 -0.776 23.514 -0.129 1.00 0.00 H new ATOM 0 HG22 VAL A 434 -1.851 22.500 -1.120 1.00 0.00 H new ATOM 0 HG23 VAL A 434 -2.541 23.671 0.028 1.00 0.00 H new ATOM 1034 N ARG A 435 -3.528 20.689 3.273 1.00 0.00 N ATOM 1035 CA ARG A 435 -3.603 19.889 4.489 1.00 0.00 C ATOM 1036 C ARG A 435 -4.649 18.788 4.351 1.00 0.00 C ATOM 1037 O ARG A 435 -4.447 17.664 4.813 1.00 0.00 O ATOM 1038 CB ARG A 435 -3.930 20.780 5.690 1.00 0.00 C ATOM 1039 CG ARG A 435 -2.844 20.791 6.752 1.00 0.00 C ATOM 1040 CD ARG A 435 -2.949 22.019 7.643 1.00 0.00 C ATOM 1041 NE ARG A 435 -2.066 21.929 8.804 1.00 0.00 N ATOM 1042 CZ ARG A 435 -2.345 21.218 9.894 1.00 0.00 C ATOM 1043 NH1 ARG A 435 -3.480 20.534 9.977 1.00 0.00 N ATOM 1044 NH2 ARG A 435 -1.486 21.190 10.905 1.00 0.00 N ATOM 0 H ARG A 435 -3.850 21.651 3.380 1.00 0.00 H new ATOM 0 HA ARG A 435 -2.632 19.421 4.650 1.00 0.00 H new ATOM 0 HB2 ARG A 435 -4.096 21.799 5.341 1.00 0.00 H new ATOM 0 HB3 ARG A 435 -4.863 20.441 6.140 1.00 0.00 H new ATOM 0 HG2 ARG A 435 -2.920 19.890 7.361 1.00 0.00 H new ATOM 0 HG3 ARG A 435 -1.865 20.770 6.273 1.00 0.00 H new ATOM 0 HD2 ARG A 435 -2.699 22.909 7.065 1.00 0.00 H new ATOM 0 HD3 ARG A 435 -3.979 22.136 7.979 1.00 0.00 H new ATOM 0 HE ARG A 435 -1.184 22.441 8.777 1.00 0.00 H new ATOM 0 HH11 ARG A 435 -4.144 20.552 9.203 1.00 0.00 H new ATOM 0 HH12 ARG A 435 -3.688 19.991 10.815 1.00 0.00 H new ATOM 0 HH21 ARG A 435 -0.612 21.713 10.847 1.00 0.00 H new ATOM 0 HH22 ARG A 435 -1.699 20.645 11.741 1.00 0.00 H new ATOM 1058 N GLN A 436 -5.768 19.117 3.714 1.00 0.00 N ATOM 1059 CA GLN A 436 -6.846 18.157 3.514 1.00 0.00 C ATOM 1060 C GLN A 436 -6.432 17.070 2.529 1.00 0.00 C ATOM 1061 O GLN A 436 -6.856 15.919 2.643 1.00 0.00 O ATOM 1062 CB GLN A 436 -8.104 18.867 3.010 1.00 0.00 C ATOM 1063 CG GLN A 436 -9.395 18.155 3.379 1.00 0.00 C ATOM 1064 CD GLN A 436 -10.627 18.985 3.075 1.00 0.00 C ATOM 1065 OE1 GLN A 436 -11.395 19.327 3.974 1.00 0.00 O ATOM 1066 NE2 GLN A 436 -10.822 19.312 1.803 1.00 0.00 N ATOM 0 H GLN A 436 -5.951 20.043 3.327 1.00 0.00 H new ATOM 0 HA GLN A 436 -7.062 17.688 4.474 1.00 0.00 H new ATOM 0 HB2 GLN A 436 -8.128 19.878 3.417 1.00 0.00 H new ATOM 0 HB3 GLN A 436 -8.048 18.961 1.925 1.00 0.00 H new ATOM 0 HG2 GLN A 436 -9.454 17.212 2.835 1.00 0.00 H new ATOM 0 HG3 GLN A 436 -9.380 17.910 4.441 1.00 0.00 H new ATOM 0 HE21 GLN A 436 -10.159 19.007 1.091 1.00 0.00 H new ATOM 0 HE22 GLN A 436 -11.635 19.869 1.538 1.00 0.00 H new ATOM 1075 N ALA A 437 -5.603 17.441 1.558 1.00 0.00 N ATOM 1076 CA ALA A 437 -5.135 16.496 0.551 1.00 0.00 C ATOM 1077 C ALA A 437 -4.139 15.505 1.144 1.00 0.00 C ATOM 1078 O ALA A 437 -4.224 14.301 0.898 1.00 0.00 O ATOM 1079 CB ALA A 437 -4.509 17.240 -0.619 1.00 0.00 C ATOM 0 H ALA A 437 -5.242 18.389 1.448 1.00 0.00 H new ATOM 0 HA ALA A 437 -5.996 15.932 0.192 1.00 0.00 H new ATOM 0 HB1 ALA A 437 -4.164 16.523 -1.364 1.00 0.00 H new ATOM 0 HB2 ALA A 437 -5.250 17.901 -1.068 1.00 0.00 H new ATOM 0 HB3 ALA A 437 -3.664 17.830 -0.265 1.00 0.00 H new ATOM 1085 N ARG A 438 -3.194 16.016 1.927 1.00 0.00 N ATOM 1086 CA ARG A 438 -2.185 15.169 2.552 1.00 0.00 C ATOM 1087 C ARG A 438 -2.824 14.230 3.569 1.00 0.00 C ATOM 1088 O ARG A 438 -2.489 13.047 3.633 1.00 0.00 O ATOM 1089 CB ARG A 438 -1.109 16.025 3.226 1.00 0.00 C ATOM 1090 CG ARG A 438 -1.639 16.899 4.351 1.00 0.00 C ATOM 1091 CD ARG A 438 -0.528 17.719 4.989 1.00 0.00 C ATOM 1092 NE ARG A 438 -0.276 17.318 6.371 1.00 0.00 N ATOM 1093 CZ ARG A 438 0.408 18.054 7.244 1.00 0.00 C ATOM 1094 NH1 ARG A 438 0.908 19.230 6.884 1.00 0.00 N ATOM 1095 NH2 ARG A 438 0.594 17.614 8.481 1.00 0.00 N ATOM 0 H ARG A 438 -3.106 17.009 2.143 1.00 0.00 H new ATOM 0 HA ARG A 438 -1.716 14.568 1.773 1.00 0.00 H new ATOM 0 HB2 ARG A 438 -0.332 15.371 3.621 1.00 0.00 H new ATOM 0 HB3 ARG A 438 -0.639 16.660 2.475 1.00 0.00 H new ATOM 0 HG2 ARG A 438 -2.409 17.566 3.963 1.00 0.00 H new ATOM 0 HG3 ARG A 438 -2.112 16.273 5.108 1.00 0.00 H new ATOM 0 HD2 ARG A 438 0.386 17.606 4.406 1.00 0.00 H new ATOM 0 HD3 ARG A 438 -0.795 18.775 4.961 1.00 0.00 H new ATOM 0 HE ARG A 438 -0.646 16.421 6.685 1.00 0.00 H new ATOM 0 HH11 ARG A 438 0.769 19.574 5.934 1.00 0.00 H new ATOM 0 HH12 ARG A 438 1.431 19.789 7.558 1.00 0.00 H new ATOM 0 HH21 ARG A 438 0.213 16.711 8.764 1.00 0.00 H new ATOM 0 HH22 ARG A 438 1.118 18.178 9.150 1.00 0.00 H new ATOM 1109 N LYS A 439 -3.751 14.762 4.357 1.00 0.00 N ATOM 1110 CA LYS A 439 -4.442 13.968 5.365 1.00 0.00 C ATOM 1111 C LYS A 439 -5.235 12.842 4.709 1.00 0.00 C ATOM 1112 O LYS A 439 -5.401 11.767 5.287 1.00 0.00 O ATOM 1113 CB LYS A 439 -5.376 14.856 6.194 1.00 0.00 C ATOM 1114 CG LYS A 439 -5.071 14.837 7.682 1.00 0.00 C ATOM 1115 CD LYS A 439 -5.418 16.163 8.339 1.00 0.00 C ATOM 1116 CE LYS A 439 -4.835 16.260 9.739 1.00 0.00 C ATOM 1117 NZ LYS A 439 -5.223 17.529 10.415 1.00 0.00 N ATOM 0 H LYS A 439 -4.041 15.739 4.317 1.00 0.00 H new ATOM 0 HA LYS A 439 -3.696 13.528 6.026 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -5.306 15.881 5.830 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -6.405 14.532 6.038 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -5.634 14.035 8.160 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -4.014 14.620 7.835 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -5.040 16.983 7.728 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -6.501 16.274 8.386 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -5.176 15.413 10.334 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -3.748 16.195 9.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -4.806 17.557 11.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -4.876 18.338 9.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -6.259 17.580 10.490 1.00 0.00 H new ATOM 1131 N GLU A 440 -5.718 13.097 3.498 1.00 0.00 N ATOM 1132 CA GLU A 440 -6.491 12.107 2.758 1.00 0.00 C ATOM 1133 C GLU A 440 -5.613 10.931 2.347 1.00 0.00 C ATOM 1134 O GLU A 440 -6.052 9.780 2.360 1.00 0.00 O ATOM 1135 CB GLU A 440 -7.123 12.744 1.519 1.00 0.00 C ATOM 1136 CG GLU A 440 -8.423 13.476 1.808 1.00 0.00 C ATOM 1137 CD GLU A 440 -9.604 12.535 1.951 1.00 0.00 C ATOM 1138 OE1 GLU A 440 -9.673 11.549 1.188 1.00 0.00 O ATOM 1139 OE2 GLU A 440 -10.458 12.783 2.829 1.00 0.00 O ATOM 0 H GLU A 440 -5.588 13.982 3.008 1.00 0.00 H new ATOM 0 HA GLU A 440 -7.282 11.737 3.411 1.00 0.00 H new ATOM 0 HB2 GLU A 440 -6.413 13.443 1.077 1.00 0.00 H new ATOM 0 HB3 GLU A 440 -7.310 11.968 0.777 1.00 0.00 H new ATOM 0 HG2 GLU A 440 -8.313 14.056 2.724 1.00 0.00 H new ATOM 0 HG3 GLU A 440 -8.623 14.184 1.004 1.00 0.00 H new ATOM 1146 N ALA A 441 -4.368 11.225 1.983 1.00 0.00 N ATOM 1147 CA ALA A 441 -3.431 10.187 1.571 1.00 0.00 C ATOM 1148 C ALA A 441 -3.176 9.203 2.708 1.00 0.00 C ATOM 1149 O ALA A 441 -3.195 7.990 2.505 1.00 0.00 O ATOM 1150 CB ALA A 441 -2.125 10.809 1.106 1.00 0.00 C ATOM 0 H ALA A 441 -3.986 12.171 1.965 1.00 0.00 H new ATOM 0 HA ALA A 441 -3.873 9.639 0.739 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -1.435 10.022 0.802 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -2.317 11.470 0.261 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -1.684 11.382 1.922 1.00 0.00 H new ATOM 1156 N VAL A 442 -2.947 9.735 3.905 1.00 0.00 N ATOM 1157 CA VAL A 442 -2.700 8.905 5.079 1.00 0.00 C ATOM 1158 C VAL A 442 -3.955 8.120 5.452 1.00 0.00 C ATOM 1159 O VAL A 442 -3.877 6.971 5.885 1.00 0.00 O ATOM 1160 CB VAL A 442 -2.266 9.761 6.286 1.00 0.00 C ATOM 1161 CG1 VAL A 442 -1.996 8.885 7.501 1.00 0.00 C ATOM 1162 CG2 VAL A 442 -1.043 10.598 5.936 1.00 0.00 C ATOM 0 H VAL A 442 -2.927 10.738 4.087 1.00 0.00 H new ATOM 0 HA VAL A 442 -1.896 8.214 4.827 1.00 0.00 H new ATOM 0 HB VAL A 442 -3.082 10.439 6.536 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -1.691 9.511 8.340 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.902 8.340 7.765 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.201 8.176 7.269 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -0.752 11.195 6.800 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -0.220 9.940 5.655 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -1.281 11.258 5.102 1.00 0.00 H new ATOM 1172 N CYS A 443 -5.114 8.747 5.276 1.00 0.00 N ATOM 1173 CA CYS A 443 -6.384 8.102 5.583 1.00 0.00 C ATOM 1174 C CYS A 443 -6.690 7.004 4.567 1.00 0.00 C ATOM 1175 O CYS A 443 -7.067 5.888 4.932 1.00 0.00 O ATOM 1176 CB CYS A 443 -7.515 9.132 5.595 1.00 0.00 C ATOM 1177 SG CYS A 443 -7.651 10.058 7.143 1.00 0.00 S ATOM 0 H CYS A 443 -5.199 9.700 4.923 1.00 0.00 H new ATOM 0 HA CYS A 443 -6.306 7.650 6.572 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -7.361 9.834 4.776 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -8.459 8.622 5.405 1.00 0.00 H new ATOM 0 HG CYS A 443 -8.633 10.906 7.057 1.00 0.00 H new ATOM 1183 N LYS A 444 -6.521 7.330 3.287 1.00 0.00 N ATOM 1184 CA LYS A 444 -6.776 6.379 2.213 1.00 0.00 C ATOM 1185 C LYS A 444 -5.801 5.209 2.280 1.00 0.00 C ATOM 1186 O LYS A 444 -6.196 4.050 2.149 1.00 0.00 O ATOM 1187 CB LYS A 444 -6.668 7.070 0.852 1.00 0.00 C ATOM 1188 CG LYS A 444 -7.496 6.405 -0.237 1.00 0.00 C ATOM 1189 CD LYS A 444 -8.533 7.357 -0.819 1.00 0.00 C ATOM 1190 CE LYS A 444 -8.164 7.790 -2.229 1.00 0.00 C ATOM 1191 NZ LYS A 444 -6.809 8.403 -2.287 1.00 0.00 N ATOM 0 H LYS A 444 -6.208 8.248 2.971 1.00 0.00 H new ATOM 0 HA LYS A 444 -7.788 5.994 2.337 1.00 0.00 H new ATOM 0 HB2 LYS A 444 -6.985 8.108 0.955 1.00 0.00 H new ATOM 0 HB3 LYS A 444 -5.623 7.085 0.544 1.00 0.00 H new ATOM 0 HG2 LYS A 444 -6.837 6.055 -1.032 1.00 0.00 H new ATOM 0 HG3 LYS A 444 -7.997 5.527 0.172 1.00 0.00 H new ATOM 0 HD2 LYS A 444 -9.509 6.871 -0.830 1.00 0.00 H new ATOM 0 HD3 LYS A 444 -8.622 8.235 -0.179 1.00 0.00 H new ATOM 0 HE2 LYS A 444 -8.201 6.927 -2.894 1.00 0.00 H new ATOM 0 HE3 LYS A 444 -8.901 8.505 -2.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 -6.713 8.950 -3.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 -6.678 9.034 -1.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 -6.088 7.654 -2.265 1.00 0.00 H new ATOM 1205 N ILE A 445 -4.527 5.517 2.496 1.00 0.00 N ATOM 1206 CA ILE A 445 -3.506 4.485 2.589 1.00 0.00 C ATOM 1207 C ILE A 445 -3.777 3.581 3.781 1.00 0.00 C ATOM 1208 O ILE A 445 -3.470 2.389 3.760 1.00 0.00 O ATOM 1209 CB ILE A 445 -2.093 5.092 2.714 1.00 0.00 C ATOM 1210 CG1 ILE A 445 -2.016 6.005 3.929 1.00 0.00 C ATOM 1211 CG2 ILE A 445 -1.726 5.851 1.447 1.00 0.00 C ATOM 1212 CD1 ILE A 445 -1.594 5.294 5.198 1.00 0.00 C ATOM 0 H ILE A 445 -4.180 6.469 2.609 1.00 0.00 H new ATOM 0 HA ILE A 445 -3.547 3.901 1.669 1.00 0.00 H new ATOM 0 HB ILE A 445 -1.376 4.282 2.846 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -1.312 6.811 3.723 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -2.991 6.466 4.088 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -0.726 6.273 1.552 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -1.745 5.170 0.596 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -2.444 6.655 1.284 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -1.561 6.008 6.021 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -2.311 4.506 5.429 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -0.606 4.856 5.058 1.00 0.00 H new ATOM 1224 N GLN A 446 -4.367 4.161 4.818 1.00 0.00 N ATOM 1225 CA GLN A 446 -4.703 3.431 6.023 1.00 0.00 C ATOM 1226 C GLN A 446 -5.645 2.277 5.705 1.00 0.00 C ATOM 1227 O GLN A 446 -5.427 1.144 6.134 1.00 0.00 O ATOM 1228 CB GLN A 446 -5.359 4.387 7.010 1.00 0.00 C ATOM 1229 CG GLN A 446 -5.432 3.864 8.425 1.00 0.00 C ATOM 1230 CD GLN A 446 -4.140 3.216 8.887 1.00 0.00 C ATOM 1231 OE1 GLN A 446 -3.930 2.018 8.699 1.00 0.00 O ATOM 1232 NE2 GLN A 446 -3.265 4.010 9.495 1.00 0.00 N ATOM 0 H GLN A 446 -4.624 5.148 4.843 1.00 0.00 H new ATOM 0 HA GLN A 446 -3.795 3.015 6.459 1.00 0.00 H new ATOM 0 HB2 GLN A 446 -4.806 5.327 7.010 1.00 0.00 H new ATOM 0 HB3 GLN A 446 -6.368 4.611 6.665 1.00 0.00 H new ATOM 0 HG2 GLN A 446 -5.680 4.685 9.097 1.00 0.00 H new ATOM 0 HG3 GLN A 446 -6.242 3.138 8.496 1.00 0.00 H new ATOM 0 HE21 GLN A 446 -3.481 4.998 9.630 1.00 0.00 H new ATOM 0 HE22 GLN A 446 -2.378 3.632 9.827 1.00 0.00 H new ATOM 1241 N ALA A 447 -6.686 2.573 4.935 1.00 0.00 N ATOM 1242 CA ALA A 447 -7.657 1.559 4.543 1.00 0.00 C ATOM 1243 C ALA A 447 -6.973 0.446 3.759 1.00 0.00 C ATOM 1244 O ALA A 447 -7.306 -0.730 3.906 1.00 0.00 O ATOM 1245 CB ALA A 447 -8.774 2.183 3.720 1.00 0.00 C ATOM 0 H ALA A 447 -6.879 3.506 4.570 1.00 0.00 H new ATOM 0 HA ALA A 447 -8.093 1.129 5.444 1.00 0.00 H new ATOM 0 HB1 ALA A 447 -9.490 1.412 3.435 1.00 0.00 H new ATOM 0 HB2 ALA A 447 -9.279 2.947 4.312 1.00 0.00 H new ATOM 0 HB3 ALA A 447 -8.354 2.637 2.823 1.00 0.00 H new ATOM 1251 N ILE A 448 -6.004 0.829 2.932 1.00 0.00 N ATOM 1252 CA ILE A 448 -5.256 -0.131 2.130 1.00 0.00 C ATOM 1253 C ILE A 448 -4.366 -0.992 3.017 1.00 0.00 C ATOM 1254 O ILE A 448 -4.183 -2.184 2.764 1.00 0.00 O ATOM 1255 CB ILE A 448 -4.381 0.573 1.075 1.00 0.00 C ATOM 1256 CG1 ILE A 448 -5.213 1.579 0.280 1.00 0.00 C ATOM 1257 CG2 ILE A 448 -3.745 -0.449 0.144 1.00 0.00 C ATOM 1258 CD1 ILE A 448 -4.396 2.413 -0.683 1.00 0.00 C ATOM 0 H ILE A 448 -5.719 1.800 2.801 1.00 0.00 H new ATOM 0 HA ILE A 448 -5.985 -0.759 1.619 1.00 0.00 H new ATOM 0 HB ILE A 448 -3.585 1.112 1.588 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -5.981 1.043 -0.278 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -5.728 2.242 0.975 1.00 0.00 H new ATOM 0 HG21 ILE A 448 -3.130 0.065 -0.595 1.00 0.00 H new ATOM 0 HG22 ILE A 448 -3.122 -1.131 0.723 1.00 0.00 H new ATOM 0 HG23 ILE A 448 -4.526 -1.014 -0.364 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -5.052 3.104 -1.212 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -3.645 2.977 -0.129 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -3.902 1.759 -1.402 1.00 0.00 H new ATOM 1270 N LEU A 449 -3.816 -0.379 4.061 1.00 0.00 N ATOM 1271 CA LEU A 449 -2.944 -1.087 4.993 1.00 0.00 C ATOM 1272 C LEU A 449 -3.667 -2.282 5.604 1.00 0.00 C ATOM 1273 O LEU A 449 -3.128 -3.389 5.652 1.00 0.00 O ATOM 1274 CB LEU A 449 -2.468 -0.142 6.098 1.00 0.00 C ATOM 1275 CG LEU A 449 -1.250 -0.629 6.887 1.00 0.00 C ATOM 1276 CD1 LEU A 449 -0.425 0.550 7.380 1.00 0.00 C ATOM 1277 CD2 LEU A 449 -1.687 -1.501 8.055 1.00 0.00 C ATOM 0 H LEU A 449 -3.959 0.606 4.283 1.00 0.00 H new ATOM 0 HA LEU A 449 -2.077 -1.450 4.441 1.00 0.00 H new ATOM 0 HB2 LEU A 449 -2.230 0.824 5.652 1.00 0.00 H new ATOM 0 HB3 LEU A 449 -3.291 0.022 6.794 1.00 0.00 H new ATOM 0 HG LEU A 449 -0.627 -1.228 6.223 1.00 0.00 H new ATOM 0 HD11 LEU A 449 0.436 0.183 7.939 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -0.082 1.136 6.527 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -1.037 1.177 8.028 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -0.809 -1.839 8.605 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -2.331 -0.924 8.718 1.00 0.00 H new ATOM 0 HD23 LEU A 449 -2.234 -2.365 7.679 1.00 0.00 H new ATOM 1289 N GLU A 450 -4.893 -2.057 6.064 1.00 0.00 N ATOM 1290 CA GLU A 450 -5.688 -3.123 6.659 1.00 0.00 C ATOM 1291 C GLU A 450 -5.965 -4.211 5.630 1.00 0.00 C ATOM 1292 O GLU A 450 -5.946 -5.399 5.947 1.00 0.00 O ATOM 1293 CB GLU A 450 -7.002 -2.569 7.214 1.00 0.00 C ATOM 1294 CG GLU A 450 -7.255 -2.941 8.667 1.00 0.00 C ATOM 1295 CD GLU A 450 -8.701 -3.315 8.929 1.00 0.00 C ATOM 1296 OE1 GLU A 450 -9.349 -3.857 8.010 1.00 0.00 O ATOM 1297 OE2 GLU A 450 -9.184 -3.065 10.053 1.00 0.00 O ATOM 0 H GLU A 450 -5.356 -1.149 6.036 1.00 0.00 H new ATOM 0 HA GLU A 450 -5.122 -3.557 7.484 1.00 0.00 H new ATOM 0 HB2 GLU A 450 -6.996 -1.483 7.122 1.00 0.00 H new ATOM 0 HB3 GLU A 450 -7.828 -2.937 6.605 1.00 0.00 H new ATOM 0 HG2 GLU A 450 -6.612 -3.777 8.942 1.00 0.00 H new ATOM 0 HG3 GLU A 450 -6.979 -2.103 9.306 1.00 0.00 H new ATOM 1304 N LYS A 451 -6.200 -3.796 4.389 1.00 0.00 N ATOM 1305 CA LYS A 451 -6.456 -4.741 3.311 1.00 0.00 C ATOM 1306 C LYS A 451 -5.281 -5.702 3.177 1.00 0.00 C ATOM 1307 O LYS A 451 -5.446 -6.859 2.789 1.00 0.00 O ATOM 1308 CB LYS A 451 -6.685 -4.001 1.991 1.00 0.00 C ATOM 1309 CG LYS A 451 -8.098 -3.464 1.831 1.00 0.00 C ATOM 1310 CD LYS A 451 -8.988 -4.447 1.085 1.00 0.00 C ATOM 1311 CE LYS A 451 -9.960 -5.145 2.023 1.00 0.00 C ATOM 1312 NZ LYS A 451 -11.332 -4.576 1.925 1.00 0.00 N ATOM 0 H LYS A 451 -6.218 -2.816 4.107 1.00 0.00 H new ATOM 0 HA LYS A 451 -7.356 -5.308 3.548 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -5.980 -3.172 1.922 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -6.466 -4.676 1.163 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -8.524 -3.259 2.813 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.069 -2.517 1.292 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -9.544 -3.919 0.310 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -8.369 -5.190 0.583 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -9.991 -6.209 1.788 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -9.602 -5.055 3.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -11.964 -5.079 2.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -11.308 -3.567 2.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -11.684 -4.684 0.952 1.00 0.00 H new ATOM 1326 N LEU A 452 -4.091 -5.212 3.518 1.00 0.00 N ATOM 1327 CA LEU A 452 -2.882 -6.016 3.457 1.00 0.00 C ATOM 1328 C LEU A 452 -2.868 -7.036 4.589 1.00 0.00 C ATOM 1329 O LEU A 452 -2.420 -8.168 4.411 1.00 0.00 O ATOM 1330 CB LEU A 452 -1.644 -5.121 3.541 1.00 0.00 C ATOM 1331 CG LEU A 452 -0.311 -5.854 3.417 1.00 0.00 C ATOM 1332 CD1 LEU A 452 0.155 -5.869 1.969 1.00 0.00 C ATOM 1333 CD2 LEU A 452 0.739 -5.209 4.310 1.00 0.00 C ATOM 0 H LEU A 452 -3.943 -4.256 3.841 1.00 0.00 H new ATOM 0 HA LEU A 452 -2.867 -6.547 2.505 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -1.703 -4.369 2.754 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -1.662 -4.589 4.492 1.00 0.00 H new ATOM 0 HG LEU A 452 -0.453 -6.884 3.744 1.00 0.00 H new ATOM 0 HD11 LEU A 452 1.107 -6.395 1.899 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -0.587 -6.377 1.353 1.00 0.00 H new ATOM 0 HD13 LEU A 452 0.280 -4.845 1.616 1.00 0.00 H new ATOM 0 HD21 LEU A 452 1.682 -5.745 4.208 1.00 0.00 H new ATOM 0 HD22 LEU A 452 0.879 -4.169 4.015 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.409 -5.250 5.348 1.00 0.00 H new ATOM 1345 N GLU A 453 -3.375 -6.631 5.752 1.00 0.00 N ATOM 1346 CA GLU A 453 -3.431 -7.520 6.906 1.00 0.00 C ATOM 1347 C GLU A 453 -4.210 -8.788 6.566 1.00 0.00 C ATOM 1348 O GLU A 453 -3.947 -9.858 7.117 1.00 0.00 O ATOM 1349 CB GLU A 453 -4.078 -6.812 8.097 1.00 0.00 C ATOM 1350 CG GLU A 453 -3.140 -5.859 8.821 1.00 0.00 C ATOM 1351 CD GLU A 453 -3.848 -5.035 9.878 1.00 0.00 C ATOM 1352 OE1 GLU A 453 -4.881 -5.502 10.401 1.00 0.00 O ATOM 1353 OE2 GLU A 453 -3.369 -3.922 10.184 1.00 0.00 O ATOM 0 H GLU A 453 -3.751 -5.697 5.918 1.00 0.00 H new ATOM 0 HA GLU A 453 -2.411 -7.796 7.174 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -4.949 -6.257 7.750 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -4.438 -7.561 8.803 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -2.337 -6.430 9.288 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -2.676 -5.191 8.096 1.00 0.00 H new ATOM 1360 N LYS A 454 -5.168 -8.658 5.652 1.00 0.00 N ATOM 1361 CA LYS A 454 -5.986 -9.791 5.233 1.00 0.00 C ATOM 1362 C LYS A 454 -5.394 -10.478 4.003 1.00 0.00 C ATOM 1363 O LYS A 454 -5.802 -11.584 3.646 1.00 0.00 O ATOM 1364 CB LYS A 454 -7.416 -9.333 4.937 1.00 0.00 C ATOM 1365 CG LYS A 454 -8.140 -8.776 6.151 1.00 0.00 C ATOM 1366 CD LYS A 454 -9.436 -8.086 5.759 1.00 0.00 C ATOM 1367 CE LYS A 454 -9.179 -6.703 5.184 1.00 0.00 C ATOM 1368 NZ LYS A 454 -8.856 -5.711 6.246 1.00 0.00 N ATOM 0 H LYS A 454 -5.396 -7.779 5.188 1.00 0.00 H new ATOM 0 HA LYS A 454 -6.002 -10.511 6.051 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -7.391 -8.571 4.158 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -7.984 -10.175 4.541 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -8.354 -9.584 6.851 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -7.492 -8.069 6.669 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -9.965 -8.694 5.025 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -10.084 -8.004 6.632 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -8.355 -6.753 4.472 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -10.058 -6.370 4.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.019 -4.750 5.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -9.464 -5.877 7.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -7.859 -5.812 6.524 1.00 0.00 H new ATOM 1382 N LYS A 455 -4.425 -9.827 3.364 1.00 0.00 N ATOM 1383 CA LYS A 455 -3.780 -10.390 2.184 1.00 0.00 C ATOM 1384 C LYS A 455 -2.688 -11.372 2.594 1.00 0.00 C ATOM 1385 O LYS A 455 -2.343 -12.284 1.843 1.00 0.00 O ATOM 1386 CB LYS A 455 -3.179 -9.277 1.319 1.00 0.00 C ATOM 1387 CG LYS A 455 -3.820 -9.164 -0.055 1.00 0.00 C ATOM 1388 CD LYS A 455 -4.533 -7.834 -0.234 1.00 0.00 C ATOM 1389 CE LYS A 455 -6.032 -7.975 -0.025 1.00 0.00 C ATOM 1390 NZ LYS A 455 -6.788 -6.847 -0.635 1.00 0.00 N ATOM 0 H LYS A 455 -4.071 -8.912 3.644 1.00 0.00 H new ATOM 0 HA LYS A 455 -4.534 -10.920 1.602 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -3.285 -8.325 1.840 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -2.111 -9.458 1.199 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -3.055 -9.273 -0.824 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -4.530 -9.979 -0.194 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -4.133 -7.107 0.472 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -4.338 -7.447 -1.234 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -6.372 -8.916 -0.458 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -6.247 -8.020 1.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -7.769 -6.859 -0.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -6.339 -5.946 -0.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -6.785 -6.947 -1.670 1.00 0.00 H new ATOM 1404 N GLY A 456 -2.150 -11.178 3.794 1.00 0.00 N ATOM 1405 CA GLY A 456 -1.106 -12.054 4.286 1.00 0.00 C ATOM 1406 C GLY A 456 -1.645 -13.389 4.757 1.00 0.00 C ATOM 1407 O GLY A 456 -1.418 -14.418 4.120 1.00 0.00 O ATOM 0 H GLY A 456 -2.419 -10.430 4.433 1.00 0.00 H new ATOM 0 HA2 GLY A 456 -0.373 -12.220 3.497 1.00 0.00 H new ATOM 0 HA3 GLY A 456 -0.584 -11.566 5.109 1.00 0.00 H new ATOM 1411 N LEU A 457 -2.364 -13.373 5.875 1.00 0.00 N ATOM 1412 CA LEU A 457 -2.938 -14.593 6.431 1.00 0.00 C ATOM 1413 C LEU A 457 -1.845 -15.589 6.804 1.00 0.00 C ATOM 1414 O LEU A 457 -1.586 -15.758 8.014 1.00 0.00 O ATOM 1415 CB LEU A 457 -3.907 -15.228 5.431 1.00 0.00 C ATOM 1416 CG LEU A 457 -5.163 -15.849 6.051 1.00 0.00 C ATOM 1417 CD1 LEU A 457 -6.412 -15.369 5.327 1.00 0.00 C ATOM 1418 CD2 LEU A 457 -5.078 -17.368 6.019 1.00 0.00 C ATOM 1419 OXT LEU A 457 -1.257 -16.192 5.882 1.00 0.00 O ATOM 0 H LEU A 457 -2.563 -12.530 6.413 1.00 0.00 H new ATOM 0 HA LEU A 457 -3.485 -14.328 7.336 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -4.213 -14.468 4.712 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -3.376 -15.999 4.873 1.00 0.00 H new ATOM 0 HG LEU A 457 -5.226 -15.529 7.091 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -7.293 -15.821 5.782 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -6.482 -14.284 5.402 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -6.358 -15.657 4.277 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -5.978 -17.792 6.463 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -4.989 -17.706 4.986 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -4.205 -17.696 6.584 1.00 0.00 H new