USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=11 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 Set 1.1: A 379 SER OG : rot 180:sc= -0.217 USER MOD Set 1.2: A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 HIS : no HD1:sc= -0.044 X(o=-0.044,f=0) USER MOD Single : A 389 LYS NZ :NH3+ 148:sc= -0.33 (180deg=-1.52!) USER MOD Single : A 391 GLN : amide:sc= -0.162 X(o=-0.16,f=-0.16) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= -0.169 X(o=-0.17,f=-0.016) 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 180:sc= 0 USER MOD Single : A 415 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 417 THR OG1 : rot 56:sc= 1.14 USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 428 THR OG1 : rot 46:sc= -0.382 USER MOD Single : A 431 GLN : amide:sc= -0.0568 K(o=-0.057,f=-1.7) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= -0.147 X(o=-0.15,f=-0.009) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.34 X(o=-0.34,f=-0.028) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ -158:sc= 0.0532 (180deg=0) USER MOD Single : A 455 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 112 N SER A 379 5.934 23.228 -5.116 1.00 0.00 N ATOM 113 CA SER A 379 5.895 22.243 -4.038 1.00 0.00 C ATOM 114 C SER A 379 4.630 21.404 -4.094 1.00 0.00 C ATOM 115 O SER A 379 4.615 20.262 -3.635 1.00 0.00 O ATOM 116 CB SER A 379 6.020 22.925 -2.676 1.00 0.00 C ATOM 117 OG SER A 379 6.646 22.072 -1.734 1.00 0.00 O ATOM 0 HA SER A 379 6.746 21.576 -4.175 1.00 0.00 H new ATOM 0 HB2 SER A 379 6.596 23.845 -2.778 1.00 0.00 H new ATOM 0 HB3 SER A 379 5.031 23.207 -2.315 1.00 0.00 H new ATOM 0 HG SER A 379 6.715 22.532 -0.872 1.00 0.00 H new ATOM 123 N ILE A 380 3.582 21.953 -4.683 1.00 0.00 N ATOM 124 CA ILE A 380 2.334 21.229 -4.822 1.00 0.00 C ATOM 125 C ILE A 380 2.577 19.945 -5.608 1.00 0.00 C ATOM 126 O ILE A 380 1.890 18.942 -5.416 1.00 0.00 O ATOM 127 CB ILE A 380 1.253 22.082 -5.517 1.00 0.00 C ATOM 128 CG1 ILE A 380 0.917 23.297 -4.652 1.00 0.00 C ATOM 129 CG2 ILE A 380 0.002 21.257 -5.785 1.00 0.00 C ATOM 130 CD1 ILE A 380 0.368 22.931 -3.290 1.00 0.00 C ATOM 0 H ILE A 380 3.572 22.896 -5.072 1.00 0.00 H new ATOM 0 HA ILE A 380 1.968 20.988 -3.824 1.00 0.00 H new ATOM 0 HB ILE A 380 1.642 22.425 -6.476 1.00 0.00 H new ATOM 0 HG12 ILE A 380 1.815 23.902 -4.523 1.00 0.00 H new ATOM 0 HG13 ILE A 380 0.188 23.916 -5.175 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -0.746 21.880 -6.276 1.00 0.00 H new ATOM 0 HG22 ILE A 380 0.253 20.415 -6.430 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -0.398 20.885 -4.842 1.00 0.00 H new ATOM 0 HD11 ILE A 380 0.151 23.840 -2.729 1.00 0.00 H new ATOM 0 HD12 ILE A 380 -0.547 22.352 -3.410 1.00 0.00 H new ATOM 0 HD13 ILE A 380 1.104 22.337 -2.748 1.00 0.00 H new ATOM 142 N LYS A 381 3.570 19.991 -6.497 1.00 0.00 N ATOM 143 CA LYS A 381 3.916 18.839 -7.319 1.00 0.00 C ATOM 144 C LYS A 381 4.241 17.630 -6.447 1.00 0.00 C ATOM 145 O LYS A 381 3.968 16.490 -6.823 1.00 0.00 O ATOM 146 CB LYS A 381 5.110 19.167 -8.218 1.00 0.00 C ATOM 147 CG LYS A 381 4.784 20.156 -9.325 1.00 0.00 C ATOM 148 CD LYS A 381 5.528 19.818 -10.609 1.00 0.00 C ATOM 149 CE LYS A 381 6.025 21.072 -11.309 1.00 0.00 C ATOM 150 NZ LYS A 381 7.060 20.761 -12.335 1.00 0.00 N ATOM 0 H LYS A 381 4.147 20.816 -6.664 1.00 0.00 H new ATOM 0 HA LYS A 381 3.056 18.597 -7.943 1.00 0.00 H new ATOM 0 HB2 LYS A 381 5.915 19.573 -7.605 1.00 0.00 H new ATOM 0 HB3 LYS A 381 5.483 18.245 -8.664 1.00 0.00 H new ATOM 0 HG2 LYS A 381 3.710 20.153 -9.513 1.00 0.00 H new ATOM 0 HG3 LYS A 381 5.048 21.164 -9.004 1.00 0.00 H new ATOM 0 HD2 LYS A 381 6.373 19.168 -10.381 1.00 0.00 H new ATOM 0 HD3 LYS A 381 4.870 19.263 -11.277 1.00 0.00 H new ATOM 0 HE2 LYS A 381 5.185 21.581 -11.783 1.00 0.00 H new ATOM 0 HE3 LYS A 381 6.439 21.760 -10.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 7.374 21.642 -12.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 7.872 20.298 -11.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 6.657 20.125 -13.053 1.00 0.00 H new ATOM 164 N LYS A 382 4.820 17.885 -5.277 1.00 0.00 N ATOM 165 CA LYS A 382 5.173 16.812 -4.356 1.00 0.00 C ATOM 166 C LYS A 382 3.927 16.130 -3.825 1.00 0.00 C ATOM 167 O LYS A 382 3.886 14.910 -3.667 1.00 0.00 O ATOM 168 CB LYS A 382 6.021 17.346 -3.201 1.00 0.00 C ATOM 169 CG LYS A 382 7.517 17.189 -3.421 1.00 0.00 C ATOM 170 CD LYS A 382 8.315 17.899 -2.340 1.00 0.00 C ATOM 171 CE LYS A 382 8.261 19.409 -2.509 1.00 0.00 C ATOM 172 NZ LYS A 382 9.369 20.090 -1.781 1.00 0.00 N ATOM 0 H LYS A 382 5.053 18.821 -4.946 1.00 0.00 H new ATOM 0 HA LYS A 382 5.762 16.077 -4.904 1.00 0.00 H new ATOM 0 HB2 LYS A 382 5.793 18.401 -3.052 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.740 16.826 -2.285 1.00 0.00 H new ATOM 0 HG2 LYS A 382 7.776 16.130 -3.430 1.00 0.00 H new ATOM 0 HG3 LYS A 382 7.787 17.591 -4.398 1.00 0.00 H new ATOM 0 HD2 LYS A 382 7.924 17.627 -1.360 1.00 0.00 H new ATOM 0 HD3 LYS A 382 9.352 17.565 -2.373 1.00 0.00 H new ATOM 0 HE2 LYS A 382 8.316 19.658 -3.569 1.00 0.00 H new ATOM 0 HE3 LYS A 382 7.304 19.781 -2.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 9.296 21.118 -1.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 9.302 19.874 -0.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 10.283 19.754 -2.147 1.00 0.00 H new ATOM 186 N ILE A 383 2.907 16.926 -3.576 1.00 0.00 N ATOM 187 CA ILE A 383 1.637 16.408 -3.086 1.00 0.00 C ATOM 188 C ILE A 383 1.063 15.432 -4.103 1.00 0.00 C ATOM 189 O ILE A 383 0.453 14.424 -3.748 1.00 0.00 O ATOM 190 CB ILE A 383 0.620 17.539 -2.829 1.00 0.00 C ATOM 191 CG1 ILE A 383 1.215 18.587 -1.887 1.00 0.00 C ATOM 192 CG2 ILE A 383 -0.669 16.973 -2.252 1.00 0.00 C ATOM 193 CD1 ILE A 383 0.427 19.877 -1.844 1.00 0.00 C ATOM 0 H ILE A 383 2.929 17.938 -3.704 1.00 0.00 H new ATOM 0 HA ILE A 383 1.823 15.902 -2.139 1.00 0.00 H new ATOM 0 HB ILE A 383 0.389 18.021 -3.779 1.00 0.00 H new ATOM 0 HG12 ILE A 383 1.270 18.170 -0.881 1.00 0.00 H new ATOM 0 HG13 ILE A 383 2.237 18.805 -2.198 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -1.376 17.784 -2.076 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -1.101 16.261 -2.955 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -0.455 16.468 -1.310 1.00 0.00 H new ATOM 0 HD11 ILE A 383 0.906 20.573 -1.156 1.00 0.00 H new ATOM 0 HD12 ILE A 383 0.394 20.316 -2.841 1.00 0.00 H new ATOM 0 HD13 ILE A 383 -0.588 19.672 -1.504 1.00 0.00 H new ATOM 205 N ILE A 384 1.302 15.734 -5.374 1.00 0.00 N ATOM 206 CA ILE A 384 0.850 14.882 -6.469 1.00 0.00 C ATOM 207 C ILE A 384 1.733 13.653 -6.542 1.00 0.00 C ATOM 208 O ILE A 384 1.259 12.527 -6.689 1.00 0.00 O ATOM 209 CB ILE A 384 0.920 15.592 -7.843 1.00 0.00 C ATOM 210 CG1 ILE A 384 1.005 17.107 -7.684 1.00 0.00 C ATOM 211 CG2 ILE A 384 -0.278 15.215 -8.698 1.00 0.00 C ATOM 212 CD1 ILE A 384 -0.171 17.708 -6.944 1.00 0.00 C ATOM 0 H ILE A 384 1.809 16.567 -5.673 1.00 0.00 H new ATOM 0 HA ILE A 384 -0.189 14.626 -6.264 1.00 0.00 H new ATOM 0 HB ILE A 384 1.829 15.258 -8.344 1.00 0.00 H new ATOM 0 HG12 ILE A 384 1.923 17.357 -7.153 1.00 0.00 H new ATOM 0 HG13 ILE A 384 1.074 17.564 -8.671 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -0.213 15.723 -9.660 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -0.287 14.137 -8.857 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -1.195 15.514 -8.191 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -0.041 18.788 -6.870 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -1.092 17.490 -7.485 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -0.229 17.280 -5.943 1.00 0.00 H new ATOM 224 N HIS A 385 3.033 13.895 -6.431 1.00 0.00 N ATOM 225 CA HIS A 385 4.022 12.824 -6.475 1.00 0.00 C ATOM 226 C HIS A 385 3.728 11.783 -5.396 1.00 0.00 C ATOM 227 O HIS A 385 3.896 10.584 -5.615 1.00 0.00 O ATOM 228 CB HIS A 385 5.433 13.407 -6.312 1.00 0.00 C ATOM 229 CG HIS A 385 6.393 12.513 -5.587 1.00 0.00 C ATOM 230 ND1 HIS A 385 7.159 11.588 -6.254 1.00 0.00 N ATOM 231 CD2 HIS A 385 6.669 12.447 -4.264 1.00 0.00 C ATOM 232 CE1 HIS A 385 7.880 10.983 -5.328 1.00 0.00 C ATOM 233 NE2 HIS A 385 7.618 11.470 -4.105 1.00 0.00 N ATOM 0 H HIS A 385 3.429 14.827 -6.309 1.00 0.00 H new ATOM 0 HA HIS A 385 3.966 12.327 -7.443 1.00 0.00 H new ATOM 0 HB2 HIS A 385 5.837 13.629 -7.300 1.00 0.00 H new ATOM 0 HB3 HIS A 385 5.362 14.354 -5.776 1.00 0.00 H new ATOM 0 HD2 HIS A 385 6.227 13.048 -3.483 1.00 0.00 H new ATOM 0 HE1 HIS A 385 8.591 10.195 -5.529 1.00 0.00 H new ATOM 0 HE2 HIS A 385 8.043 11.171 -3.227 1.00 0.00 H new ATOM 241 N VAL A 386 3.278 12.251 -4.235 1.00 0.00 N ATOM 242 CA VAL A 386 2.949 11.358 -3.131 1.00 0.00 C ATOM 243 C VAL A 386 1.647 10.617 -3.414 1.00 0.00 C ATOM 244 O VAL A 386 1.528 9.423 -3.139 1.00 0.00 O ATOM 245 CB VAL A 386 2.819 12.125 -1.797 1.00 0.00 C ATOM 246 CG1 VAL A 386 2.463 11.176 -0.661 1.00 0.00 C ATOM 247 CG2 VAL A 386 4.104 12.879 -1.486 1.00 0.00 C ATOM 0 H VAL A 386 3.134 13.241 -4.036 1.00 0.00 H new ATOM 0 HA VAL A 386 3.767 10.643 -3.040 1.00 0.00 H new ATOM 0 HB VAL A 386 2.012 12.851 -1.898 1.00 0.00 H new ATOM 0 HG11 VAL A 386 2.377 11.738 0.269 1.00 0.00 H new ATOM 0 HG12 VAL A 386 1.513 10.687 -0.879 1.00 0.00 H new ATOM 0 HG13 VAL A 386 3.244 10.422 -0.558 1.00 0.00 H new ATOM 0 HG21 VAL A 386 3.993 13.413 -0.542 1.00 0.00 H new ATOM 0 HG22 VAL A 386 4.931 12.173 -1.408 1.00 0.00 H new ATOM 0 HG23 VAL A 386 4.310 13.592 -2.284 1.00 0.00 H new ATOM 257 N LEU A 387 0.675 11.332 -3.974 1.00 0.00 N ATOM 258 CA LEU A 387 -0.614 10.736 -4.301 1.00 0.00 C ATOM 259 C LEU A 387 -0.457 9.719 -5.422 1.00 0.00 C ATOM 260 O LEU A 387 -1.088 8.664 -5.414 1.00 0.00 O ATOM 261 CB LEU A 387 -1.621 11.818 -4.699 1.00 0.00 C ATOM 262 CG LEU A 387 -3.088 11.379 -4.667 1.00 0.00 C ATOM 263 CD1 LEU A 387 -3.932 12.384 -3.900 1.00 0.00 C ATOM 264 CD2 LEU A 387 -3.623 11.201 -6.081 1.00 0.00 C ATOM 0 H LEU A 387 0.756 12.321 -4.210 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.992 10.223 -3.416 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.498 12.671 -4.032 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.382 12.163 -5.705 1.00 0.00 H new ATOM 0 HG LEU A 387 -3.147 10.420 -4.153 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -4.971 12.054 -3.889 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -3.565 12.461 -2.877 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -3.866 13.359 -4.384 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -4.667 10.889 -6.039 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -3.548 12.146 -6.620 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -3.038 10.441 -6.598 1.00 0.00 H new ATOM 276 N GLU A 388 0.411 10.026 -6.374 1.00 0.00 N ATOM 277 CA GLU A 388 0.667 9.115 -7.476 1.00 0.00 C ATOM 278 C GLU A 388 1.261 7.824 -6.927 1.00 0.00 C ATOM 279 O GLU A 388 0.995 6.732 -7.430 1.00 0.00 O ATOM 280 CB GLU A 388 1.623 9.749 -8.490 1.00 0.00 C ATOM 281 CG GLU A 388 0.918 10.368 -9.685 1.00 0.00 C ATOM 282 CD GLU A 388 1.717 11.493 -10.314 1.00 0.00 C ATOM 283 OE1 GLU A 388 2.931 11.305 -10.539 1.00 0.00 O ATOM 284 OE2 GLU A 388 1.129 12.562 -10.582 1.00 0.00 O ATOM 0 H GLU A 388 0.946 10.894 -6.405 1.00 0.00 H new ATOM 0 HA GLU A 388 -0.271 8.898 -7.987 1.00 0.00 H new ATOM 0 HB2 GLU A 388 2.214 10.516 -7.990 1.00 0.00 H new ATOM 0 HB3 GLU A 388 2.321 8.990 -8.843 1.00 0.00 H new ATOM 0 HG2 GLU A 388 0.733 9.597 -10.433 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -0.054 10.749 -9.372 1.00 0.00 H new ATOM 291 N LYS A 389 2.064 7.970 -5.878 1.00 0.00 N ATOM 292 CA LYS A 389 2.702 6.833 -5.229 1.00 0.00 C ATOM 293 C LYS A 389 1.681 5.992 -4.466 1.00 0.00 C ATOM 294 O LYS A 389 1.701 4.763 -4.536 1.00 0.00 O ATOM 295 CB LYS A 389 3.800 7.318 -4.280 1.00 0.00 C ATOM 296 CG LYS A 389 5.170 6.736 -4.586 1.00 0.00 C ATOM 297 CD LYS A 389 5.490 5.558 -3.679 1.00 0.00 C ATOM 298 CE LYS A 389 5.284 4.233 -4.394 1.00 0.00 C ATOM 299 NZ LYS A 389 5.975 4.199 -5.713 1.00 0.00 N ATOM 0 H LYS A 389 2.289 8.872 -5.458 1.00 0.00 H new ATOM 0 HA LYS A 389 3.148 6.206 -6.001 1.00 0.00 H new ATOM 0 HB2 LYS A 389 3.857 8.405 -4.330 1.00 0.00 H new ATOM 0 HB3 LYS A 389 3.525 7.060 -3.257 1.00 0.00 H new ATOM 0 HG2 LYS A 389 5.206 6.415 -5.627 1.00 0.00 H new ATOM 0 HG3 LYS A 389 5.930 7.508 -4.464 1.00 0.00 H new ATOM 0 HD2 LYS A 389 6.522 5.631 -3.336 1.00 0.00 H new ATOM 0 HD3 LYS A 389 4.856 5.597 -2.793 1.00 0.00 H new ATOM 0 HE2 LYS A 389 5.656 3.422 -3.769 1.00 0.00 H new ATOM 0 HE3 LYS A 389 4.217 4.061 -4.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 6.286 3.228 -5.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 5.320 4.517 -6.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 6.802 4.829 -5.688 1.00 0.00 H new ATOM 313 N VAL A 390 0.797 6.662 -3.730 1.00 0.00 N ATOM 314 CA VAL A 390 -0.219 5.970 -2.944 1.00 0.00 C ATOM 315 C VAL A 390 -1.175 5.181 -3.838 1.00 0.00 C ATOM 316 O VAL A 390 -1.548 4.053 -3.517 1.00 0.00 O ATOM 317 CB VAL A 390 -1.015 6.949 -2.044 1.00 0.00 C ATOM 318 CG1 VAL A 390 -2.125 7.663 -2.808 1.00 0.00 C ATOM 319 CG2 VAL A 390 -1.584 6.214 -0.840 1.00 0.00 C ATOM 0 H VAL A 390 0.764 7.679 -3.662 1.00 0.00 H new ATOM 0 HA VAL A 390 0.308 5.268 -2.298 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.319 7.714 -1.701 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -2.654 8.338 -2.135 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -1.692 8.235 -3.629 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -2.823 6.927 -3.207 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.141 6.914 -0.216 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -2.250 5.421 -1.179 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -0.769 5.780 -0.260 1.00 0.00 H new ATOM 329 N GLN A 391 -1.564 5.776 -4.962 1.00 0.00 N ATOM 330 CA GLN A 391 -2.469 5.113 -5.893 1.00 0.00 C ATOM 331 C GLN A 391 -1.822 3.855 -6.459 1.00 0.00 C ATOM 332 O GLN A 391 -2.482 2.834 -6.650 1.00 0.00 O ATOM 333 CB GLN A 391 -2.866 6.063 -7.026 1.00 0.00 C ATOM 334 CG GLN A 391 -1.690 6.563 -7.847 1.00 0.00 C ATOM 335 CD GLN A 391 -2.122 7.232 -9.134 1.00 0.00 C ATOM 336 OE1 GLN A 391 -2.903 8.183 -9.124 1.00 0.00 O ATOM 337 NE2 GLN A 391 -1.614 6.734 -10.254 1.00 0.00 N ATOM 0 H GLN A 391 -1.269 6.709 -5.248 1.00 0.00 H new ATOM 0 HA GLN A 391 -3.370 4.827 -5.351 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -3.567 5.553 -7.686 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -3.392 6.919 -6.603 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -1.110 7.268 -7.252 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -1.032 5.726 -8.080 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -0.970 5.944 -10.215 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -1.868 7.141 -11.154 1.00 0.00 H new ATOM 346 N TYR A 392 -0.520 3.935 -6.717 1.00 0.00 N ATOM 347 CA TYR A 392 0.224 2.802 -7.250 1.00 0.00 C ATOM 348 C TYR A 392 0.413 1.737 -6.176 1.00 0.00 C ATOM 349 O TYR A 392 0.309 0.539 -6.448 1.00 0.00 O ATOM 350 CB TYR A 392 1.586 3.262 -7.778 1.00 0.00 C ATOM 351 CG TYR A 392 1.641 3.390 -9.284 1.00 0.00 C ATOM 352 CD1 TYR A 392 1.890 2.283 -10.086 1.00 0.00 C ATOM 353 CD2 TYR A 392 1.442 4.617 -9.904 1.00 0.00 C ATOM 354 CE1 TYR A 392 1.942 2.396 -11.462 1.00 0.00 C ATOM 355 CE2 TYR A 392 1.491 4.738 -11.279 1.00 0.00 C ATOM 356 CZ TYR A 392 1.742 3.626 -12.053 1.00 0.00 C ATOM 357 OH TYR A 392 1.793 3.742 -13.424 1.00 0.00 O ATOM 0 H TYR A 392 0.040 4.774 -6.565 1.00 0.00 H new ATOM 0 HA TYR A 392 -0.346 2.371 -8.073 1.00 0.00 H new ATOM 0 HB2 TYR A 392 1.833 4.225 -7.331 1.00 0.00 H new ATOM 0 HB3 TYR A 392 2.349 2.555 -7.454 1.00 0.00 H new ATOM 0 HD1 TYR A 392 2.045 1.318 -9.626 1.00 0.00 H new ATOM 0 HD2 TYR A 392 1.246 5.491 -9.301 1.00 0.00 H new ATOM 0 HE1 TYR A 392 2.138 1.526 -12.071 1.00 0.00 H new ATOM 0 HE2 TYR A 392 1.333 5.699 -11.745 1.00 0.00 H new ATOM 0 HH TYR A 392 1.630 4.674 -13.680 1.00 0.00 H new ATOM 367 N LEU A 393 0.684 2.183 -4.953 1.00 0.00 N ATOM 368 CA LEU A 393 0.879 1.271 -3.832 1.00 0.00 C ATOM 369 C LEU A 393 -0.388 0.466 -3.570 1.00 0.00 C ATOM 370 O LEU A 393 -0.332 -0.740 -3.326 1.00 0.00 O ATOM 371 CB LEU A 393 1.276 2.051 -2.577 1.00 0.00 C ATOM 372 CG LEU A 393 2.478 1.487 -1.818 1.00 0.00 C ATOM 373 CD1 LEU A 393 3.094 2.551 -0.923 1.00 0.00 C ATOM 374 CD2 LEU A 393 2.066 0.273 -0.998 1.00 0.00 C ATOM 0 H LEU A 393 0.773 3.170 -4.714 1.00 0.00 H new ATOM 0 HA LEU A 393 1.683 0.580 -4.086 1.00 0.00 H new ATOM 0 HB2 LEU A 393 1.495 3.080 -2.861 1.00 0.00 H new ATOM 0 HB3 LEU A 393 0.421 2.082 -1.902 1.00 0.00 H new ATOM 0 HG LEU A 393 3.228 1.175 -2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 393 3.948 2.130 -0.392 1.00 0.00 H new ATOM 0 HD12 LEU A 393 3.425 3.392 -1.532 1.00 0.00 H new ATOM 0 HD13 LEU A 393 2.352 2.895 -0.203 1.00 0.00 H new ATOM 0 HD21 LEU A 393 2.933 -0.117 -0.464 1.00 0.00 H new ATOM 0 HD22 LEU A 393 1.298 0.562 -0.281 1.00 0.00 H new ATOM 0 HD23 LEU A 393 1.672 -0.497 -1.661 1.00 0.00 H new ATOM 386 N GLU A 394 -1.533 1.142 -3.627 1.00 0.00 N ATOM 387 CA GLU A 394 -2.817 0.491 -3.402 1.00 0.00 C ATOM 388 C GLU A 394 -3.037 -0.631 -4.411 1.00 0.00 C ATOM 389 O GLU A 394 -3.462 -1.729 -4.051 1.00 0.00 O ATOM 390 CB GLU A 394 -3.955 1.510 -3.497 1.00 0.00 C ATOM 391 CG GLU A 394 -5.254 1.032 -2.869 1.00 0.00 C ATOM 392 CD GLU A 394 -6.335 0.763 -3.897 1.00 0.00 C ATOM 393 OE1 GLU A 394 -6.961 1.736 -4.370 1.00 0.00 O ATOM 394 OE2 GLU A 394 -6.558 -0.420 -4.230 1.00 0.00 O ATOM 0 H GLU A 394 -1.596 2.140 -3.827 1.00 0.00 H new ATOM 0 HA GLU A 394 -2.809 0.061 -2.400 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -3.645 2.435 -3.011 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -4.134 1.746 -4.546 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -5.065 0.122 -2.300 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -5.609 1.782 -2.162 1.00 0.00 H new ATOM 401 N GLN A 395 -2.739 -0.346 -5.674 1.00 0.00 N ATOM 402 CA GLN A 395 -2.899 -1.334 -6.735 1.00 0.00 C ATOM 403 C GLN A 395 -1.994 -2.537 -6.491 1.00 0.00 C ATOM 404 O GLN A 395 -2.358 -3.673 -6.791 1.00 0.00 O ATOM 405 CB GLN A 395 -2.582 -0.709 -8.095 1.00 0.00 C ATOM 406 CG GLN A 395 -3.199 -1.455 -9.266 1.00 0.00 C ATOM 407 CD GLN A 395 -2.444 -1.232 -10.562 1.00 0.00 C ATOM 408 OE1 GLN A 395 -3.012 -0.782 -11.556 1.00 0.00 O ATOM 409 NE2 GLN A 395 -1.154 -1.549 -10.556 1.00 0.00 N ATOM 0 H GLN A 395 -2.386 0.558 -5.988 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.935 -1.672 -6.733 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -2.937 0.321 -8.104 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -1.500 -0.674 -8.226 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -3.221 -2.521 -9.042 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -4.233 -1.134 -9.392 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -0.724 -1.919 -9.709 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -0.594 -1.422 -11.399 1.00 0.00 H new ATOM 418 N GLU A 396 -0.810 -2.276 -5.942 1.00 0.00 N ATOM 419 CA GLU A 396 0.149 -3.335 -5.654 1.00 0.00 C ATOM 420 C GLU A 396 -0.347 -4.221 -4.515 1.00 0.00 C ATOM 421 O GLU A 396 -0.235 -5.446 -4.576 1.00 0.00 O ATOM 422 CB GLU A 396 1.512 -2.734 -5.296 1.00 0.00 C ATOM 423 CG GLU A 396 2.585 -2.999 -6.339 1.00 0.00 C ATOM 424 CD GLU A 396 3.197 -1.725 -6.888 1.00 0.00 C ATOM 425 OE1 GLU A 396 3.418 -0.784 -6.096 1.00 0.00 O ATOM 426 OE2 GLU A 396 3.454 -1.667 -8.108 1.00 0.00 O ATOM 0 H GLU A 396 -0.493 -1.340 -5.688 1.00 0.00 H new ATOM 0 HA GLU A 396 0.256 -3.950 -6.548 1.00 0.00 H new ATOM 0 HB2 GLU A 396 1.402 -1.658 -5.165 1.00 0.00 H new ATOM 0 HB3 GLU A 396 1.839 -3.140 -4.339 1.00 0.00 H new ATOM 0 HG2 GLU A 396 3.370 -3.613 -5.898 1.00 0.00 H new ATOM 0 HG3 GLU A 396 2.154 -3.573 -7.159 1.00 0.00 H new ATOM 433 N VAL A 397 -0.899 -3.596 -3.479 1.00 0.00 N ATOM 434 CA VAL A 397 -1.413 -4.335 -2.333 1.00 0.00 C ATOM 435 C VAL A 397 -2.526 -5.283 -2.760 1.00 0.00 C ATOM 436 O VAL A 397 -2.689 -6.362 -2.193 1.00 0.00 O ATOM 437 CB VAL A 397 -1.947 -3.389 -1.239 1.00 0.00 C ATOM 438 CG1 VAL A 397 -2.231 -4.159 0.042 1.00 0.00 C ATOM 439 CG2 VAL A 397 -0.964 -2.255 -0.983 1.00 0.00 C ATOM 0 H VAL A 397 -1.001 -2.583 -3.410 1.00 0.00 H new ATOM 0 HA VAL A 397 -0.581 -4.907 -1.923 1.00 0.00 H new ATOM 0 HB VAL A 397 -2.883 -2.953 -1.588 1.00 0.00 H new ATOM 0 HG11 VAL A 397 -2.607 -3.474 0.802 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -2.977 -4.929 -0.154 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -1.312 -4.626 0.397 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -1.359 -1.599 -0.208 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -0.009 -2.668 -0.657 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -0.818 -1.686 -1.901 1.00 0.00 H new ATOM 449 N GLU A 398 -3.284 -4.875 -3.775 1.00 0.00 N ATOM 450 CA GLU A 398 -4.373 -5.696 -4.290 1.00 0.00 C ATOM 451 C GLU A 398 -3.825 -7.017 -4.815 1.00 0.00 C ATOM 452 O GLU A 398 -4.453 -8.067 -4.674 1.00 0.00 O ATOM 453 CB GLU A 398 -5.119 -4.957 -5.401 1.00 0.00 C ATOM 454 CG GLU A 398 -6.347 -5.696 -5.907 1.00 0.00 C ATOM 455 CD GLU A 398 -7.524 -5.588 -4.957 1.00 0.00 C ATOM 456 OE1 GLU A 398 -8.221 -4.552 -4.990 1.00 0.00 O ATOM 457 OE2 GLU A 398 -7.748 -6.539 -4.179 1.00 0.00 O ATOM 0 H GLU A 398 -3.163 -3.983 -4.255 1.00 0.00 H new ATOM 0 HA GLU A 398 -5.072 -5.899 -3.479 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -5.421 -3.976 -5.034 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -4.437 -4.789 -6.235 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -6.632 -5.296 -6.880 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -6.099 -6.747 -6.055 1.00 0.00 H new ATOM 464 N GLU A 399 -2.639 -6.951 -5.410 1.00 0.00 N ATOM 465 CA GLU A 399 -1.981 -8.134 -5.947 1.00 0.00 C ATOM 466 C GLU A 399 -1.067 -8.746 -4.892 1.00 0.00 C ATOM 467 O GLU A 399 -1.340 -9.827 -4.372 1.00 0.00 O ATOM 468 CB GLU A 399 -1.172 -7.771 -7.194 1.00 0.00 C ATOM 469 CG GLU A 399 -1.189 -8.852 -8.263 1.00 0.00 C ATOM 470 CD GLU A 399 -1.282 -8.283 -9.666 1.00 0.00 C ATOM 471 OE1 GLU A 399 -0.485 -7.378 -9.993 1.00 0.00 O ATOM 472 OE2 GLU A 399 -2.151 -8.742 -10.436 1.00 0.00 O ATOM 0 H GLU A 399 -2.113 -6.086 -5.532 1.00 0.00 H new ATOM 0 HA GLU A 399 -2.742 -8.863 -6.224 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -1.566 -6.847 -7.617 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -0.140 -7.574 -6.904 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -0.285 -9.455 -8.179 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -2.034 -9.518 -8.088 1.00 0.00 H new ATOM 479 N PHE A 400 0.010 -8.029 -4.574 1.00 0.00 N ATOM 480 CA PHE A 400 0.978 -8.464 -3.571 1.00 0.00 C ATOM 481 C PHE A 400 1.355 -9.933 -3.719 1.00 0.00 C ATOM 482 O PHE A 400 2.373 -10.268 -4.323 1.00 0.00 O ATOM 483 CB PHE A 400 0.446 -8.167 -2.163 1.00 0.00 C ATOM 484 CG PHE A 400 1.487 -8.288 -1.087 1.00 0.00 C ATOM 485 CD1 PHE A 400 2.780 -7.840 -1.303 1.00 0.00 C ATOM 486 CD2 PHE A 400 1.170 -8.841 0.142 1.00 0.00 C ATOM 487 CE1 PHE A 400 3.738 -7.942 -0.313 1.00 0.00 C ATOM 488 CE2 PHE A 400 2.123 -8.944 1.137 1.00 0.00 C ATOM 489 CZ PHE A 400 3.410 -8.495 0.909 1.00 0.00 C ATOM 0 H PHE A 400 0.235 -7.132 -5.004 1.00 0.00 H new ATOM 0 HA PHE A 400 1.894 -7.896 -3.732 1.00 0.00 H new ATOM 0 HB2 PHE A 400 0.033 -7.158 -2.145 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -0.374 -8.851 -1.942 1.00 0.00 H new ATOM 0 HD1 PHE A 400 3.042 -7.406 -2.257 1.00 0.00 H new ATOM 0 HD2 PHE A 400 0.167 -9.196 0.325 1.00 0.00 H new ATOM 0 HE1 PHE A 400 4.743 -7.590 -0.495 1.00 0.00 H new ATOM 0 HE2 PHE A 400 1.862 -9.375 2.092 1.00 0.00 H new ATOM 0 HZ PHE A 400 4.157 -8.576 1.685 1.00 0.00 H new ATOM 499 N VAL A 401 0.538 -10.792 -3.149 1.00 0.00 N ATOM 500 CA VAL A 401 0.766 -12.233 -3.187 1.00 0.00 C ATOM 501 C VAL A 401 1.828 -12.633 -2.168 1.00 0.00 C ATOM 502 O VAL A 401 2.540 -13.620 -2.351 1.00 0.00 O ATOM 503 CB VAL A 401 1.201 -12.717 -4.586 1.00 0.00 C ATOM 504 CG1 VAL A 401 1.091 -14.231 -4.686 1.00 0.00 C ATOM 505 CG2 VAL A 401 0.371 -12.043 -5.669 1.00 0.00 C ATOM 0 H VAL A 401 -0.305 -10.518 -2.644 1.00 0.00 H new ATOM 0 HA VAL A 401 -0.184 -12.708 -2.941 1.00 0.00 H new ATOM 0 HB VAL A 401 2.245 -12.440 -4.736 1.00 0.00 H new ATOM 0 HG11 VAL A 401 1.402 -14.554 -5.680 1.00 0.00 H new ATOM 0 HG12 VAL A 401 1.734 -14.693 -3.937 1.00 0.00 H new ATOM 0 HG13 VAL A 401 0.058 -14.533 -4.513 1.00 0.00 H new ATOM 0 HG21 VAL A 401 0.693 -12.398 -6.648 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -0.682 -12.285 -5.524 1.00 0.00 H new ATOM 0 HG23 VAL A 401 0.506 -10.963 -5.612 1.00 0.00 H new ATOM 515 N GLY A 402 1.926 -11.855 -1.093 1.00 0.00 N ATOM 516 CA GLY A 402 2.901 -12.136 -0.058 1.00 0.00 C ATOM 517 C GLY A 402 2.299 -12.874 1.121 1.00 0.00 C ATOM 518 O GLY A 402 1.333 -13.623 0.966 1.00 0.00 O ATOM 0 H GLY A 402 1.345 -11.034 -0.922 1.00 0.00 H new ATOM 0 HA2 GLY A 402 3.712 -12.730 -0.479 1.00 0.00 H new ATOM 0 HA3 GLY A 402 3.339 -11.200 0.288 1.00 0.00 H new ATOM 522 N LYS A 403 2.868 -12.662 2.303 1.00 0.00 N ATOM 523 CA LYS A 403 2.380 -13.313 3.514 1.00 0.00 C ATOM 524 C LYS A 403 2.252 -12.307 4.648 1.00 0.00 C ATOM 525 O LYS A 403 2.695 -11.174 4.524 1.00 0.00 O ATOM 526 CB LYS A 403 3.318 -14.449 3.925 1.00 0.00 C ATOM 527 CG LYS A 403 3.258 -15.652 3.001 1.00 0.00 C ATOM 528 CD LYS A 403 3.999 -15.393 1.697 1.00 0.00 C ATOM 529 CE LYS A 403 4.864 -16.578 1.300 1.00 0.00 C ATOM 530 NZ LYS A 403 6.161 -16.147 0.712 1.00 0.00 N ATOM 0 H LYS A 403 3.667 -12.045 2.448 1.00 0.00 H new ATOM 0 HA LYS A 403 1.395 -13.729 3.304 1.00 0.00 H new ATOM 0 HB2 LYS A 403 4.341 -14.073 3.952 1.00 0.00 H new ATOM 0 HB3 LYS A 403 3.069 -14.766 4.937 1.00 0.00 H new ATOM 0 HG2 LYS A 403 3.692 -16.518 3.501 1.00 0.00 H new ATOM 0 HG3 LYS A 403 2.217 -15.896 2.787 1.00 0.00 H new ATOM 0 HD2 LYS A 403 3.280 -15.185 0.905 1.00 0.00 H new ATOM 0 HD3 LYS A 403 4.623 -14.505 1.802 1.00 0.00 H new ATOM 0 HE2 LYS A 403 5.051 -17.200 2.175 1.00 0.00 H new ATOM 0 HE3 LYS A 403 4.326 -17.195 0.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 6.721 -16.985 0.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 5.984 -15.575 -0.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 6.686 -15.580 1.408 1.00 0.00 H new ATOM 544 N LYS A 404 1.647 -12.727 5.753 1.00 0.00 N ATOM 545 CA LYS A 404 1.473 -11.854 6.906 1.00 0.00 C ATOM 546 C LYS A 404 2.650 -11.979 7.876 1.00 0.00 C ATOM 547 O LYS A 404 2.771 -11.196 8.818 1.00 0.00 O ATOM 548 CB LYS A 404 0.167 -12.185 7.630 1.00 0.00 C ATOM 549 CG LYS A 404 0.083 -13.628 8.105 1.00 0.00 C ATOM 550 CD LYS A 404 0.081 -13.718 9.623 1.00 0.00 C ATOM 551 CE LYS A 404 -1.327 -13.890 10.169 1.00 0.00 C ATOM 552 NZ LYS A 404 -1.419 -13.498 11.603 1.00 0.00 N ATOM 0 H LYS A 404 1.269 -13.667 5.874 1.00 0.00 H new ATOM 0 HA LYS A 404 1.433 -10.826 6.545 1.00 0.00 H new ATOM 0 HB2 LYS A 404 0.059 -11.522 8.488 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -0.670 -11.982 6.963 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -0.823 -14.089 7.711 1.00 0.00 H new ATOM 0 HG3 LYS A 404 0.927 -14.192 7.708 1.00 0.00 H new ATOM 0 HD2 LYS A 404 0.700 -14.557 9.940 1.00 0.00 H new ATOM 0 HD3 LYS A 404 0.527 -12.816 10.043 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -2.020 -13.286 9.583 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -1.635 -14.929 10.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -2.395 -13.630 11.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -0.777 -14.091 12.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -1.149 -12.499 11.708 1.00 0.00 H new ATOM 566 N THR A 405 3.510 -12.972 7.651 1.00 0.00 N ATOM 567 CA THR A 405 4.664 -13.192 8.517 1.00 0.00 C ATOM 568 C THR A 405 5.987 -12.986 7.775 1.00 0.00 C ATOM 569 O THR A 405 7.039 -12.859 8.401 1.00 0.00 O ATOM 570 CB THR A 405 4.618 -14.602 9.106 1.00 0.00 C ATOM 571 OG1 THR A 405 4.436 -15.566 8.086 1.00 0.00 O ATOM 572 CG2 THR A 405 3.510 -14.791 10.120 1.00 0.00 C ATOM 0 H THR A 405 3.429 -13.634 6.879 1.00 0.00 H new ATOM 0 HA THR A 405 4.614 -12.455 9.319 1.00 0.00 H new ATOM 0 HB THR A 405 5.576 -14.736 9.609 1.00 0.00 H new ATOM 0 HG1 THR A 405 4.411 -16.462 8.483 1.00 0.00 H new ATOM 0 HG21 THR A 405 3.534 -15.813 10.499 1.00 0.00 H new ATOM 0 HG22 THR A 405 3.651 -14.095 10.947 1.00 0.00 H new ATOM 0 HG23 THR A 405 2.547 -14.602 9.646 1.00 0.00 H new ATOM 580 N ASP A 406 5.937 -12.964 6.445 1.00 0.00 N ATOM 581 CA ASP A 406 7.146 -12.784 5.644 1.00 0.00 C ATOM 582 C ASP A 406 7.809 -11.439 5.933 1.00 0.00 C ATOM 583 O ASP A 406 7.187 -10.535 6.486 1.00 0.00 O ATOM 584 CB ASP A 406 6.816 -12.892 4.153 1.00 0.00 C ATOM 585 CG ASP A 406 8.057 -12.902 3.284 1.00 0.00 C ATOM 586 OD1 ASP A 406 8.585 -14.001 3.015 1.00 0.00 O ATOM 587 OD2 ASP A 406 8.502 -11.810 2.871 1.00 0.00 O ATOM 0 H ASP A 406 5.080 -13.068 5.902 1.00 0.00 H new ATOM 0 HA ASP A 406 7.846 -13.574 5.916 1.00 0.00 H new ATOM 0 HB2 ASP A 406 6.245 -13.803 3.976 1.00 0.00 H new ATOM 0 HB3 ASP A 406 6.180 -12.055 3.863 1.00 0.00 H new ATOM 592 N LYS A 407 9.078 -11.315 5.553 1.00 0.00 N ATOM 593 CA LYS A 407 9.823 -10.076 5.766 1.00 0.00 C ATOM 594 C LYS A 407 9.326 -8.987 4.835 1.00 0.00 C ATOM 595 O LYS A 407 9.216 -7.824 5.224 1.00 0.00 O ATOM 596 CB LYS A 407 11.321 -10.306 5.558 1.00 0.00 C ATOM 597 CG LYS A 407 11.664 -10.901 4.201 1.00 0.00 C ATOM 598 CD LYS A 407 12.008 -9.819 3.190 1.00 0.00 C ATOM 599 CE LYS A 407 13.466 -9.400 3.296 1.00 0.00 C ATOM 600 NZ LYS A 407 13.812 -8.338 2.311 1.00 0.00 N ATOM 0 H LYS A 407 9.611 -12.055 5.097 1.00 0.00 H new ATOM 0 HA LYS A 407 9.660 -9.754 6.795 1.00 0.00 H new ATOM 0 HB2 LYS A 407 11.845 -9.357 5.672 1.00 0.00 H new ATOM 0 HB3 LYS A 407 11.690 -10.970 6.340 1.00 0.00 H new ATOM 0 HG2 LYS A 407 12.506 -11.585 4.305 1.00 0.00 H new ATOM 0 HG3 LYS A 407 10.821 -11.487 3.836 1.00 0.00 H new ATOM 0 HD2 LYS A 407 11.805 -10.183 2.183 1.00 0.00 H new ATOM 0 HD3 LYS A 407 11.367 -8.952 3.351 1.00 0.00 H new ATOM 0 HE2 LYS A 407 13.668 -9.039 4.305 1.00 0.00 H new ATOM 0 HE3 LYS A 407 14.106 -10.268 3.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 14.814 -8.080 2.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 13.644 -8.691 1.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 13.220 -7.500 2.481 1.00 0.00 H new ATOM 614 N ALA A 408 9.007 -9.372 3.610 1.00 0.00 N ATOM 615 CA ALA A 408 8.497 -8.429 2.634 1.00 0.00 C ATOM 616 C ALA A 408 7.173 -7.856 3.119 1.00 0.00 C ATOM 617 O ALA A 408 6.807 -6.731 2.784 1.00 0.00 O ATOM 618 CB ALA A 408 8.325 -9.102 1.280 1.00 0.00 C ATOM 0 H ALA A 408 9.093 -10.330 3.270 1.00 0.00 H new ATOM 0 HA ALA A 408 9.214 -7.616 2.518 1.00 0.00 H new ATOM 0 HB1 ALA A 408 7.941 -8.379 0.560 1.00 0.00 H new ATOM 0 HB2 ALA A 408 9.288 -9.480 0.937 1.00 0.00 H new ATOM 0 HB3 ALA A 408 7.622 -9.930 1.372 1.00 0.00 H new ATOM 624 N TYR A 409 6.454 -8.655 3.904 1.00 0.00 N ATOM 625 CA TYR A 409 5.162 -8.251 4.436 1.00 0.00 C ATOM 626 C TYR A 409 5.258 -6.968 5.248 1.00 0.00 C ATOM 627 O TYR A 409 4.448 -6.060 5.059 1.00 0.00 O ATOM 628 CB TYR A 409 4.597 -9.374 5.299 1.00 0.00 C ATOM 629 CG TYR A 409 3.340 -9.010 6.056 1.00 0.00 C ATOM 630 CD1 TYR A 409 2.145 -8.767 5.391 1.00 0.00 C ATOM 631 CD2 TYR A 409 3.351 -8.922 7.442 1.00 0.00 C ATOM 632 CE1 TYR A 409 0.996 -8.445 6.085 1.00 0.00 C ATOM 633 CE2 TYR A 409 2.205 -8.601 8.144 1.00 0.00 C ATOM 634 CZ TYR A 409 1.031 -8.364 7.462 1.00 0.00 C ATOM 635 OH TYR A 409 -0.113 -8.044 8.157 1.00 0.00 O ATOM 0 H TYR A 409 6.749 -9.590 4.185 1.00 0.00 H new ATOM 0 HA TYR A 409 4.497 -8.055 3.595 1.00 0.00 H new ATOM 0 HB2 TYR A 409 4.387 -10.234 4.663 1.00 0.00 H new ATOM 0 HB3 TYR A 409 5.359 -9.685 6.013 1.00 0.00 H new ATOM 0 HD1 TYR A 409 2.114 -8.831 4.313 1.00 0.00 H new ATOM 0 HD2 TYR A 409 4.269 -9.107 7.979 1.00 0.00 H new ATOM 0 HE1 TYR A 409 0.075 -8.258 5.553 1.00 0.00 H new ATOM 0 HE2 TYR A 409 2.229 -8.536 9.222 1.00 0.00 H new ATOM 0 HH TYR A 409 0.081 -8.029 9.117 1.00 0.00 H new ATOM 645 N TRP A 410 6.256 -6.859 6.126 1.00 0.00 N ATOM 646 CA TRP A 410 6.392 -5.628 6.883 1.00 0.00 C ATOM 647 C TRP A 410 6.900 -4.540 5.954 1.00 0.00 C ATOM 648 O TRP A 410 6.580 -3.369 6.122 1.00 0.00 O ATOM 649 CB TRP A 410 7.279 -5.748 8.132 1.00 0.00 C ATOM 650 CG TRP A 410 8.281 -6.849 8.146 1.00 0.00 C ATOM 651 CD1 TRP A 410 8.078 -8.135 8.551 1.00 0.00 C ATOM 652 CD2 TRP A 410 9.662 -6.739 7.808 1.00 0.00 C ATOM 653 NE1 TRP A 410 9.254 -8.836 8.481 1.00 0.00 N ATOM 654 CE2 TRP A 410 10.242 -8.001 8.019 1.00 0.00 C ATOM 655 CE3 TRP A 410 10.462 -5.695 7.337 1.00 0.00 C ATOM 656 CZ2 TRP A 410 11.592 -8.249 7.780 1.00 0.00 C ATOM 657 CZ3 TRP A 410 11.802 -5.941 7.099 1.00 0.00 C ATOM 658 CH2 TRP A 410 12.354 -7.209 7.321 1.00 0.00 C ATOM 0 H TRP A 410 6.952 -7.578 6.321 1.00 0.00 H new ATOM 0 HA TRP A 410 5.405 -5.375 7.270 1.00 0.00 H new ATOM 0 HB2 TRP A 410 7.810 -4.805 8.262 1.00 0.00 H new ATOM 0 HB3 TRP A 410 6.629 -5.870 8.999 1.00 0.00 H new ATOM 0 HD1 TRP A 410 7.132 -8.541 8.878 1.00 0.00 H new ATOM 0 HE1 TRP A 410 9.376 -9.817 8.731 1.00 0.00 H new ATOM 0 HE3 TRP A 410 10.042 -4.715 7.162 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 12.021 -9.225 7.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 12.433 -5.143 6.736 1.00 0.00 H new ATOM 0 HH2 TRP A 410 13.404 -7.370 7.126 1.00 0.00 H new ATOM 669 N LEU A 411 7.664 -4.959 4.945 1.00 0.00 N ATOM 670 CA LEU A 411 8.190 -4.054 3.944 1.00 0.00 C ATOM 671 C LEU A 411 7.039 -3.463 3.144 1.00 0.00 C ATOM 672 O LEU A 411 7.045 -2.275 2.818 1.00 0.00 O ATOM 673 CB LEU A 411 9.154 -4.795 3.013 1.00 0.00 C ATOM 674 CG LEU A 411 10.611 -4.344 3.099 1.00 0.00 C ATOM 675 CD1 LEU A 411 10.721 -2.843 2.882 1.00 0.00 C ATOM 676 CD2 LEU A 411 11.211 -4.737 4.441 1.00 0.00 C ATOM 0 H LEU A 411 7.930 -5.934 4.806 1.00 0.00 H new ATOM 0 HA LEU A 411 8.737 -3.251 4.438 1.00 0.00 H new ATOM 0 HB2 LEU A 411 9.105 -5.860 3.238 1.00 0.00 H new ATOM 0 HB3 LEU A 411 8.811 -4.670 1.986 1.00 0.00 H new ATOM 0 HG LEU A 411 11.173 -4.845 2.311 1.00 0.00 H new ATOM 0 HD11 LEU A 411 11.766 -2.542 2.947 1.00 0.00 H new ATOM 0 HD12 LEU A 411 10.331 -2.588 1.897 1.00 0.00 H new ATOM 0 HD13 LEU A 411 10.145 -2.322 3.646 1.00 0.00 H new ATOM 0 HD21 LEU A 411 12.249 -4.408 4.486 1.00 0.00 H new ATOM 0 HD22 LEU A 411 10.646 -4.265 5.245 1.00 0.00 H new ATOM 0 HD23 LEU A 411 11.168 -5.820 4.556 1.00 0.00 H new ATOM 688 N LEU A 412 6.032 -4.293 2.843 1.00 0.00 N ATOM 689 CA LEU A 412 4.874 -3.815 2.103 1.00 0.00 C ATOM 690 C LEU A 412 4.186 -2.725 2.909 1.00 0.00 C ATOM 691 O LEU A 412 3.878 -1.648 2.397 1.00 0.00 O ATOM 692 CB LEU A 412 3.894 -4.953 1.813 1.00 0.00 C ATOM 693 CG LEU A 412 2.996 -4.718 0.597 1.00 0.00 C ATOM 694 CD1 LEU A 412 3.774 -4.939 -0.691 1.00 0.00 C ATOM 695 CD2 LEU A 412 1.775 -5.622 0.648 1.00 0.00 C ATOM 0 H LEU A 412 6.001 -5.280 3.098 1.00 0.00 H new ATOM 0 HA LEU A 412 5.209 -3.414 1.146 1.00 0.00 H new ATOM 0 HB2 LEU A 412 4.459 -5.873 1.660 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.265 -5.107 2.690 1.00 0.00 H new ATOM 0 HG LEU A 412 2.654 -3.683 0.618 1.00 0.00 H new ATOM 0 HD11 LEU A 412 3.119 -4.767 -1.545 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.614 -4.245 -0.732 1.00 0.00 H new ATOM 0 HD13 LEU A 412 4.147 -5.963 -0.720 1.00 0.00 H new ATOM 0 HD21 LEU A 412 1.150 -5.439 -0.226 1.00 0.00 H new ATOM 0 HD22 LEU A 412 2.094 -6.664 0.654 1.00 0.00 H new ATOM 0 HD23 LEU A 412 1.204 -5.412 1.553 1.00 0.00 H new ATOM 707 N GLU A 413 3.990 -3.008 4.193 1.00 0.00 N ATOM 708 CA GLU A 413 3.386 -2.056 5.114 1.00 0.00 C ATOM 709 C GLU A 413 4.356 -0.911 5.378 1.00 0.00 C ATOM 710 O GLU A 413 3.953 0.229 5.610 1.00 0.00 O ATOM 711 CB GLU A 413 3.014 -2.745 6.428 1.00 0.00 C ATOM 712 CG GLU A 413 2.129 -1.899 7.329 1.00 0.00 C ATOM 713 CD GLU A 413 1.961 -2.500 8.711 1.00 0.00 C ATOM 714 OE1 GLU A 413 1.471 -3.645 8.805 1.00 0.00 O ATOM 715 OE2 GLU A 413 2.320 -1.825 9.699 1.00 0.00 O ATOM 0 H GLU A 413 4.244 -3.898 4.621 1.00 0.00 H new ATOM 0 HA GLU A 413 2.476 -1.659 4.664 1.00 0.00 H new ATOM 0 HB2 GLU A 413 2.502 -3.681 6.205 1.00 0.00 H new ATOM 0 HB3 GLU A 413 3.927 -3.001 6.966 1.00 0.00 H new ATOM 0 HG2 GLU A 413 2.558 -0.901 7.420 1.00 0.00 H new ATOM 0 HG3 GLU A 413 1.149 -1.784 6.865 1.00 0.00 H new ATOM 722 N GLU A 414 5.646 -1.235 5.354 1.00 0.00 N ATOM 723 CA GLU A 414 6.694 -0.258 5.599 1.00 0.00 C ATOM 724 C GLU A 414 6.703 0.823 4.519 1.00 0.00 C ATOM 725 O GLU A 414 6.904 2.002 4.812 1.00 0.00 O ATOM 726 CB GLU A 414 8.056 -0.962 5.652 1.00 0.00 C ATOM 727 CG GLU A 414 8.734 -0.871 7.009 1.00 0.00 C ATOM 728 CD GLU A 414 10.157 -0.357 6.918 1.00 0.00 C ATOM 729 OE1 GLU A 414 10.336 0.863 6.717 1.00 0.00 O ATOM 730 OE2 GLU A 414 11.093 -1.174 7.048 1.00 0.00 O ATOM 0 H GLU A 414 5.989 -2.177 5.165 1.00 0.00 H new ATOM 0 HA GLU A 414 6.497 0.224 6.556 1.00 0.00 H new ATOM 0 HB2 GLU A 414 7.924 -2.012 5.391 1.00 0.00 H new ATOM 0 HB3 GLU A 414 8.711 -0.526 4.898 1.00 0.00 H new ATOM 0 HG2 GLU A 414 8.155 -0.213 7.657 1.00 0.00 H new ATOM 0 HG3 GLU A 414 8.737 -1.856 7.476 1.00 0.00 H new ATOM 737 N MET A 415 6.487 0.417 3.270 1.00 0.00 N ATOM 738 CA MET A 415 6.477 1.357 2.156 1.00 0.00 C ATOM 739 C MET A 415 5.252 2.270 2.211 1.00 0.00 C ATOM 740 O MET A 415 5.362 3.483 2.017 1.00 0.00 O ATOM 741 CB MET A 415 6.507 0.591 0.830 1.00 0.00 C ATOM 742 CG MET A 415 6.334 1.475 -0.392 1.00 0.00 C ATOM 743 SD MET A 415 6.137 0.528 -1.913 1.00 0.00 S ATOM 744 CE MET A 415 7.846 0.195 -2.328 1.00 0.00 C ATOM 0 H MET A 415 6.317 -0.554 3.006 1.00 0.00 H new ATOM 0 HA MET A 415 7.365 1.985 2.231 1.00 0.00 H new ATOM 0 HB2 MET A 415 7.455 0.058 0.750 1.00 0.00 H new ATOM 0 HB3 MET A 415 5.718 -0.161 0.838 1.00 0.00 H new ATOM 0 HG2 MET A 415 5.463 2.115 -0.252 1.00 0.00 H new ATOM 0 HG3 MET A 415 7.200 2.131 -0.487 1.00 0.00 H new ATOM 0 HE1 MET A 415 7.890 -0.386 -3.249 1.00 0.00 H new ATOM 0 HE2 MET A 415 8.377 1.137 -2.467 1.00 0.00 H new ATOM 0 HE3 MET A 415 8.313 -0.369 -1.521 1.00 0.00 H new ATOM 754 N LEU A 416 4.085 1.688 2.478 1.00 0.00 N ATOM 755 CA LEU A 416 2.853 2.466 2.553 1.00 0.00 C ATOM 756 C LEU A 416 2.865 3.376 3.774 1.00 0.00 C ATOM 757 O LEU A 416 2.412 4.519 3.712 1.00 0.00 O ATOM 758 CB LEU A 416 1.627 1.545 2.578 1.00 0.00 C ATOM 759 CG LEU A 416 1.469 0.692 3.839 1.00 0.00 C ATOM 760 CD1 LEU A 416 0.895 1.517 4.983 1.00 0.00 C ATOM 761 CD2 LEU A 416 0.585 -0.514 3.553 1.00 0.00 C ATOM 0 H LEU A 416 3.968 0.689 2.645 1.00 0.00 H new ATOM 0 HA LEU A 416 2.792 3.090 1.661 1.00 0.00 H new ATOM 0 HB2 LEU A 416 0.732 2.157 2.460 1.00 0.00 H new ATOM 0 HB3 LEU A 416 1.676 0.881 1.715 1.00 0.00 H new ATOM 0 HG LEU A 416 2.455 0.338 4.140 1.00 0.00 H new ATOM 0 HD11 LEU A 416 0.792 0.889 5.868 1.00 0.00 H new ATOM 0 HD12 LEU A 416 1.564 2.348 5.204 1.00 0.00 H new ATOM 0 HD13 LEU A 416 -0.083 1.905 4.697 1.00 0.00 H new ATOM 0 HD21 LEU A 416 0.481 -1.112 4.458 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -0.398 -0.175 3.227 1.00 0.00 H new ATOM 0 HD23 LEU A 416 1.038 -1.120 2.768 1.00 0.00 H new ATOM 773 N THR A 417 3.399 2.869 4.881 1.00 0.00 N ATOM 774 CA THR A 417 3.482 3.649 6.109 1.00 0.00 C ATOM 775 C THR A 417 4.400 4.849 5.909 1.00 0.00 C ATOM 776 O THR A 417 4.206 5.902 6.518 1.00 0.00 O ATOM 777 CB THR A 417 3.994 2.780 7.260 1.00 0.00 C ATOM 778 OG1 THR A 417 3.144 1.665 7.464 1.00 0.00 O ATOM 779 CG2 THR A 417 4.094 3.525 8.575 1.00 0.00 C ATOM 0 H THR A 417 3.779 1.925 4.952 1.00 0.00 H new ATOM 0 HA THR A 417 2.484 4.007 6.361 1.00 0.00 H new ATOM 0 HB THR A 417 4.994 2.466 6.961 1.00 0.00 H new ATOM 0 HG1 THR A 417 3.060 1.160 6.628 1.00 0.00 H new ATOM 0 HG21 THR A 417 4.463 2.851 9.348 1.00 0.00 H new ATOM 0 HG22 THR A 417 4.782 4.364 8.467 1.00 0.00 H new ATOM 0 HG23 THR A 417 3.109 3.897 8.858 1.00 0.00 H new ATOM 787 N LYS A 418 5.395 4.685 5.042 1.00 0.00 N ATOM 788 CA LYS A 418 6.339 5.757 4.750 1.00 0.00 C ATOM 789 C LYS A 418 5.629 6.911 4.051 1.00 0.00 C ATOM 790 O LYS A 418 5.859 8.075 4.362 1.00 0.00 O ATOM 791 CB LYS A 418 7.487 5.236 3.881 1.00 0.00 C ATOM 792 CG LYS A 418 8.854 5.377 4.532 1.00 0.00 C ATOM 793 CD LYS A 418 9.423 4.026 4.937 1.00 0.00 C ATOM 794 CE LYS A 418 9.961 3.265 3.736 1.00 0.00 C ATOM 795 NZ LYS A 418 11.358 3.663 3.407 1.00 0.00 N ATOM 0 H LYS A 418 5.568 3.820 4.530 1.00 0.00 H new ATOM 0 HA LYS A 418 6.753 6.120 5.691 1.00 0.00 H new ATOM 0 HB2 LYS A 418 7.310 4.185 3.651 1.00 0.00 H new ATOM 0 HB3 LYS A 418 7.488 5.774 2.933 1.00 0.00 H new ATOM 0 HG2 LYS A 418 9.538 5.868 3.840 1.00 0.00 H new ATOM 0 HG3 LYS A 418 8.775 6.017 5.411 1.00 0.00 H new ATOM 0 HD2 LYS A 418 10.221 4.170 5.665 1.00 0.00 H new ATOM 0 HD3 LYS A 418 8.648 3.435 5.426 1.00 0.00 H new ATOM 0 HE2 LYS A 418 9.927 2.195 3.939 1.00 0.00 H new ATOM 0 HE3 LYS A 418 9.319 3.446 2.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 11.688 3.122 2.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 11.387 4.679 3.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 11.976 3.466 4.220 1.00 0.00 H new ATOM 809 N GLU A 419 4.756 6.578 3.109 1.00 0.00 N ATOM 810 CA GLU A 419 3.999 7.594 2.387 1.00 0.00 C ATOM 811 C GLU A 419 2.934 8.196 3.296 1.00 0.00 C ATOM 812 O GLU A 419 2.636 9.389 3.230 1.00 0.00 O ATOM 813 CB GLU A 419 3.339 7.003 1.135 1.00 0.00 C ATOM 814 CG GLU A 419 4.132 5.877 0.488 1.00 0.00 C ATOM 815 CD GLU A 419 5.597 6.221 0.304 1.00 0.00 C ATOM 816 OE1 GLU A 419 5.898 7.125 -0.504 1.00 0.00 O ATOM 817 OE2 GLU A 419 6.444 5.588 0.968 1.00 0.00 O ATOM 0 H GLU A 419 4.555 5.618 2.828 1.00 0.00 H new ATOM 0 HA GLU A 419 4.692 8.375 2.074 1.00 0.00 H new ATOM 0 HB2 GLU A 419 2.350 6.630 1.400 1.00 0.00 H new ATOM 0 HB3 GLU A 419 3.195 7.798 0.404 1.00 0.00 H new ATOM 0 HG2 GLU A 419 4.048 4.980 1.102 1.00 0.00 H new ATOM 0 HG3 GLU A 419 3.694 5.641 -0.482 1.00 0.00 H new ATOM 824 N LEU A 420 2.358 7.343 4.137 1.00 0.00 N ATOM 825 CA LEU A 420 1.310 7.748 5.067 1.00 0.00 C ATOM 826 C LEU A 420 1.842 8.686 6.149 1.00 0.00 C ATOM 827 O LEU A 420 1.249 9.732 6.418 1.00 0.00 O ATOM 828 CB LEU A 420 0.680 6.502 5.706 1.00 0.00 C ATOM 829 CG LEU A 420 -0.008 6.723 7.058 1.00 0.00 C ATOM 830 CD1 LEU A 420 -1.335 5.980 7.112 1.00 0.00 C ATOM 831 CD2 LEU A 420 0.897 6.281 8.197 1.00 0.00 C ATOM 0 H LEU A 420 2.604 6.355 4.193 1.00 0.00 H new ATOM 0 HA LEU A 420 0.553 8.296 4.506 1.00 0.00 H new ATOM 0 HB2 LEU A 420 -0.051 6.090 5.010 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.458 5.749 5.834 1.00 0.00 H new ATOM 0 HG LEU A 420 -0.207 7.789 7.170 1.00 0.00 H new ATOM 0 HD11 LEU A 420 -1.808 6.149 8.079 1.00 0.00 H new ATOM 0 HD12 LEU A 420 -1.989 6.345 6.320 1.00 0.00 H new ATOM 0 HD13 LEU A 420 -1.160 4.913 6.976 1.00 0.00 H new ATOM 0 HD21 LEU A 420 0.391 6.446 9.148 1.00 0.00 H new ATOM 0 HD22 LEU A 420 1.128 5.221 8.088 1.00 0.00 H new ATOM 0 HD23 LEU A 420 1.821 6.859 8.173 1.00 0.00 H new ATOM 843 N LEU A 421 2.946 8.304 6.781 1.00 0.00 N ATOM 844 CA LEU A 421 3.525 9.116 7.846 1.00 0.00 C ATOM 845 C LEU A 421 4.127 10.411 7.295 1.00 0.00 C ATOM 846 O LEU A 421 4.133 11.435 7.977 1.00 0.00 O ATOM 847 CB LEU A 421 4.549 8.296 8.663 1.00 0.00 C ATOM 848 CG LEU A 421 6.036 8.574 8.406 1.00 0.00 C ATOM 849 CD1 LEU A 421 6.366 8.395 6.937 1.00 0.00 C ATOM 850 CD2 LEU A 421 6.424 9.966 8.889 1.00 0.00 C ATOM 0 H LEU A 421 3.455 7.444 6.577 1.00 0.00 H new ATOM 0 HA LEU A 421 2.726 9.408 8.527 1.00 0.00 H new ATOM 0 HB2 LEU A 421 4.351 8.467 9.721 1.00 0.00 H new ATOM 0 HB3 LEU A 421 4.365 7.239 8.471 1.00 0.00 H new ATOM 0 HG LEU A 421 6.620 7.851 8.976 1.00 0.00 H new ATOM 0 HD11 LEU A 421 7.425 8.597 6.775 1.00 0.00 H new ATOM 0 HD12 LEU A 421 6.141 7.372 6.636 1.00 0.00 H new ATOM 0 HD13 LEU A 421 5.770 9.088 6.343 1.00 0.00 H new ATOM 0 HD21 LEU A 421 7.483 10.137 8.695 1.00 0.00 H new ATOM 0 HD22 LEU A 421 5.833 10.713 8.359 1.00 0.00 H new ATOM 0 HD23 LEU A 421 6.234 10.046 9.959 1.00 0.00 H new ATOM 862 N GLU A 422 4.633 10.364 6.066 1.00 0.00 N ATOM 863 CA GLU A 422 5.230 11.545 5.448 1.00 0.00 C ATOM 864 C GLU A 422 4.204 12.664 5.317 1.00 0.00 C ATOM 865 O GLU A 422 4.482 13.817 5.647 1.00 0.00 O ATOM 866 CB GLU A 422 5.795 11.199 4.068 1.00 0.00 C ATOM 867 CG GLU A 422 7.269 11.536 3.914 1.00 0.00 C ATOM 868 CD GLU A 422 7.626 11.957 2.502 1.00 0.00 C ATOM 869 OE1 GLU A 422 7.576 11.099 1.596 1.00 0.00 O ATOM 870 OE2 GLU A 422 7.958 13.145 2.302 1.00 0.00 O ATOM 0 H GLU A 422 4.642 9.528 5.482 1.00 0.00 H new ATOM 0 HA GLU A 422 6.042 11.887 6.090 1.00 0.00 H new ATOM 0 HB2 GLU A 422 5.653 10.134 3.882 1.00 0.00 H new ATOM 0 HB3 GLU A 422 5.227 11.734 3.307 1.00 0.00 H new ATOM 0 HG2 GLU A 422 7.529 12.338 4.605 1.00 0.00 H new ATOM 0 HG3 GLU A 422 7.867 10.669 4.193 1.00 0.00 H new ATOM 877 N LEU A 423 3.019 12.316 4.829 1.00 0.00 N ATOM 878 CA LEU A 423 1.950 13.290 4.650 1.00 0.00 C ATOM 879 C LEU A 423 1.405 13.759 5.995 1.00 0.00 C ATOM 880 O LEU A 423 0.957 14.897 6.133 1.00 0.00 O ATOM 881 CB LEU A 423 0.821 12.691 3.809 1.00 0.00 C ATOM 882 CG LEU A 423 0.988 12.854 2.298 1.00 0.00 C ATOM 883 CD1 LEU A 423 0.319 11.706 1.559 1.00 0.00 C ATOM 884 CD2 LEU A 423 0.418 14.188 1.840 1.00 0.00 C ATOM 0 H LEU A 423 2.775 11.366 4.550 1.00 0.00 H new ATOM 0 HA LEU A 423 2.365 14.153 4.128 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.741 11.628 4.039 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -0.120 13.153 4.108 1.00 0.00 H new ATOM 0 HG LEU A 423 2.053 12.836 2.066 1.00 0.00 H new ATOM 0 HD11 LEU A 423 0.449 11.840 0.485 1.00 0.00 H new ATOM 0 HD12 LEU A 423 0.773 10.763 1.865 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -0.745 11.691 1.797 1.00 0.00 H new ATOM 0 HD21 LEU A 423 0.545 14.287 0.762 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -0.643 14.234 2.086 1.00 0.00 H new ATOM 0 HD23 LEU A 423 0.943 15.000 2.344 1.00 0.00 H new ATOM 896 N ASP A 424 1.445 12.874 6.986 1.00 0.00 N ATOM 897 CA ASP A 424 0.954 13.199 8.322 1.00 0.00 C ATOM 898 C ASP A 424 2.005 13.957 9.134 1.00 0.00 C ATOM 899 O ASP A 424 1.770 14.306 10.291 1.00 0.00 O ATOM 900 CB ASP A 424 0.548 11.923 9.061 1.00 0.00 C ATOM 901 CG ASP A 424 -0.354 12.204 10.246 1.00 0.00 C ATOM 902 OD1 ASP A 424 -1.342 12.950 10.076 1.00 0.00 O ATOM 903 OD2 ASP A 424 -0.075 11.678 11.344 1.00 0.00 O ATOM 0 H ASP A 424 1.812 11.927 6.890 1.00 0.00 H new ATOM 0 HA ASP A 424 0.083 13.844 8.208 1.00 0.00 H new ATOM 0 HB2 ASP A 424 0.037 11.253 8.370 1.00 0.00 H new ATOM 0 HB3 ASP A 424 1.443 11.405 9.404 1.00 0.00 H new ATOM 908 N SER A 425 3.163 14.210 8.528 1.00 0.00 N ATOM 909 CA SER A 425 4.238 14.924 9.207 1.00 0.00 C ATOM 910 C SER A 425 4.209 16.409 8.862 1.00 0.00 C ATOM 911 O SER A 425 4.387 17.262 9.732 1.00 0.00 O ATOM 912 CB SER A 425 5.594 14.328 8.828 1.00 0.00 C ATOM 913 OG SER A 425 6.477 14.321 9.937 1.00 0.00 O ATOM 0 H SER A 425 3.379 13.931 7.571 1.00 0.00 H new ATOM 0 HA SER A 425 4.089 14.816 10.281 1.00 0.00 H new ATOM 0 HB2 SER A 425 5.458 13.311 8.461 1.00 0.00 H new ATOM 0 HB3 SER A 425 6.033 14.904 8.013 1.00 0.00 H new ATOM 0 HG SER A 425 7.336 13.933 9.669 1.00 0.00 H new ATOM 919 N VAL A 426 3.987 16.712 7.587 1.00 0.00 N ATOM 920 CA VAL A 426 3.936 18.096 7.128 1.00 0.00 C ATOM 921 C VAL A 426 2.727 18.824 7.704 1.00 0.00 C ATOM 922 O VAL A 426 1.620 18.285 7.735 1.00 0.00 O ATOM 923 CB VAL A 426 3.886 18.176 5.591 1.00 0.00 C ATOM 924 CG1 VAL A 426 4.036 19.617 5.125 1.00 0.00 C ATOM 925 CG2 VAL A 426 4.961 17.294 4.974 1.00 0.00 C ATOM 0 H VAL A 426 3.840 16.019 6.854 1.00 0.00 H new ATOM 0 HA VAL A 426 4.847 18.579 7.480 1.00 0.00 H new ATOM 0 HB VAL A 426 2.914 17.810 5.259 1.00 0.00 H new ATOM 0 HG11 VAL A 426 3.998 19.653 4.036 1.00 0.00 H new ATOM 0 HG12 VAL A 426 3.226 20.219 5.536 1.00 0.00 H new ATOM 0 HG13 VAL A 426 4.992 20.013 5.468 1.00 0.00 H new ATOM 0 HG21 VAL A 426 4.910 17.364 3.887 1.00 0.00 H new ATOM 0 HG22 VAL A 426 5.942 17.626 5.313 1.00 0.00 H new ATOM 0 HG23 VAL A 426 4.802 16.260 5.279 1.00 0.00 H new ATOM 935 N GLU A 427 2.945 20.053 8.160 1.00 0.00 N ATOM 936 CA GLU A 427 1.874 20.858 8.736 1.00 0.00 C ATOM 937 C GLU A 427 1.557 22.057 7.847 1.00 0.00 C ATOM 938 O GLU A 427 2.154 22.230 6.785 1.00 0.00 O ATOM 939 CB GLU A 427 2.263 21.336 10.136 1.00 0.00 C ATOM 940 CG GLU A 427 3.644 21.967 10.202 1.00 0.00 C ATOM 941 CD GLU A 427 3.840 22.812 11.445 1.00 0.00 C ATOM 942 OE1 GLU A 427 3.185 23.871 11.552 1.00 0.00 O ATOM 943 OE2 GLU A 427 4.648 22.416 12.311 1.00 0.00 O ATOM 0 H GLU A 427 3.855 20.514 8.142 1.00 0.00 H new ATOM 0 HA GLU A 427 0.983 20.235 8.807 1.00 0.00 H new ATOM 0 HB2 GLU A 427 1.525 22.060 10.482 1.00 0.00 H new ATOM 0 HB3 GLU A 427 2.226 20.490 10.823 1.00 0.00 H new ATOM 0 HG2 GLU A 427 4.400 21.182 10.178 1.00 0.00 H new ATOM 0 HG3 GLU A 427 3.799 22.586 9.318 1.00 0.00 H new ATOM 950 N THR A 428 0.614 22.883 8.290 1.00 0.00 N ATOM 951 CA THR A 428 0.218 24.065 7.534 1.00 0.00 C ATOM 952 C THR A 428 0.012 25.260 8.462 1.00 0.00 C ATOM 953 O THR A 428 -0.167 25.097 9.669 1.00 0.00 O ATOM 954 CB THR A 428 -1.064 23.789 6.748 1.00 0.00 C ATOM 955 OG1 THR A 428 -1.436 24.922 5.982 1.00 0.00 O ATOM 956 CG2 THR A 428 -2.240 23.423 7.627 1.00 0.00 C ATOM 0 H THR A 428 0.111 22.755 9.168 1.00 0.00 H new ATOM 0 HA THR A 428 1.020 24.303 6.835 1.00 0.00 H new ATOM 0 HB THR A 428 -0.832 22.938 6.108 1.00 0.00 H new ATOM 0 HG1 THR A 428 -0.649 25.276 5.518 1.00 0.00 H new ATOM 0 HG21 THR A 428 -3.116 23.240 7.005 1.00 0.00 H new ATOM 0 HG22 THR A 428 -2.004 22.523 8.194 1.00 0.00 H new ATOM 0 HG23 THR A 428 -2.448 24.242 8.316 1.00 0.00 H new ATOM 964 N GLY A 429 0.038 26.458 7.890 1.00 0.00 N ATOM 965 CA GLY A 429 -0.147 27.663 8.679 1.00 0.00 C ATOM 966 C GLY A 429 -1.242 28.554 8.128 1.00 0.00 C ATOM 967 O GLY A 429 -1.082 29.772 8.054 1.00 0.00 O ATOM 0 H GLY A 429 0.184 26.617 6.893 1.00 0.00 H new ATOM 0 HA2 GLY A 429 -0.389 27.388 9.706 1.00 0.00 H new ATOM 0 HA3 GLY A 429 0.789 28.220 8.711 1.00 0.00 H new ATOM 971 N GLY A 430 -2.357 27.946 7.738 1.00 0.00 N ATOM 972 CA GLY A 430 -3.466 28.707 7.195 1.00 0.00 C ATOM 973 C GLY A 430 -4.078 28.048 5.974 1.00 0.00 C ATOM 974 O GLY A 430 -5.267 28.216 5.700 1.00 0.00 O ATOM 0 H GLY A 430 -2.512 26.939 7.788 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -4.231 28.826 7.962 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -3.122 29.707 6.930 1.00 0.00 H new ATOM 978 N GLN A 431 -3.265 27.295 5.242 1.00 0.00 N ATOM 979 CA GLN A 431 -3.732 26.607 4.044 1.00 0.00 C ATOM 980 C GLN A 431 -4.536 25.364 4.409 1.00 0.00 C ATOM 981 O GLN A 431 -3.973 24.299 4.661 1.00 0.00 O ATOM 982 CB GLN A 431 -2.547 26.219 3.158 1.00 0.00 C ATOM 983 CG GLN A 431 -1.910 27.400 2.443 1.00 0.00 C ATOM 984 CD GLN A 431 -0.683 27.005 1.645 1.00 0.00 C ATOM 985 OE1 GLN A 431 -0.679 25.985 0.955 1.00 0.00 O ATOM 986 NE2 GLN A 431 0.367 27.812 1.734 1.00 0.00 N ATOM 0 H GLN A 431 -2.279 27.145 5.457 1.00 0.00 H new ATOM 0 HA GLN A 431 -4.380 27.289 3.494 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -1.792 25.726 3.770 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -2.881 25.493 2.417 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -2.642 27.854 1.776 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -1.634 28.158 3.176 1.00 0.00 H new ATOM 0 HE21 GLN A 431 0.320 28.647 2.318 1.00 0.00 H new ATOM 0 HE22 GLN A 431 1.221 27.597 1.219 1.00 0.00 H new ATOM 995 N ASP A 432 -5.858 25.506 4.437 1.00 0.00 N ATOM 996 CA ASP A 432 -6.739 24.394 4.771 1.00 0.00 C ATOM 997 C ASP A 432 -6.693 23.317 3.691 1.00 0.00 C ATOM 998 O ASP A 432 -6.880 22.134 3.972 1.00 0.00 O ATOM 999 CB ASP A 432 -8.175 24.892 4.955 1.00 0.00 C ATOM 1000 CG ASP A 432 -8.787 24.422 6.259 1.00 0.00 C ATOM 1001 OD1 ASP A 432 -8.286 23.428 6.827 1.00 0.00 O ATOM 1002 OD2 ASP A 432 -9.767 25.048 6.715 1.00 0.00 O ATOM 0 H ASP A 432 -6.342 26.380 4.232 1.00 0.00 H new ATOM 0 HA ASP A 432 -6.392 23.956 5.707 1.00 0.00 H new ATOM 0 HB2 ASP A 432 -8.186 25.982 4.924 1.00 0.00 H new ATOM 0 HB3 ASP A 432 -8.787 24.543 4.123 1.00 0.00 H new ATOM 1007 N SER A 433 -6.444 23.736 2.454 1.00 0.00 N ATOM 1008 CA SER A 433 -6.373 22.808 1.331 1.00 0.00 C ATOM 1009 C SER A 433 -5.295 21.755 1.561 1.00 0.00 C ATOM 1010 O SER A 433 -5.502 20.571 1.295 1.00 0.00 O ATOM 1011 CB SER A 433 -6.095 23.568 0.031 1.00 0.00 C ATOM 1012 OG SER A 433 -6.990 23.172 -0.993 1.00 0.00 O ATOM 0 H SER A 433 -6.288 24.713 2.204 1.00 0.00 H new ATOM 0 HA SER A 433 -7.335 22.302 1.249 1.00 0.00 H new ATOM 0 HB2 SER A 433 -6.189 24.640 0.206 1.00 0.00 H new ATOM 0 HB3 SER A 433 -5.069 23.386 -0.288 1.00 0.00 H new ATOM 0 HG SER A 433 -6.793 23.673 -1.812 1.00 0.00 H new ATOM 1018 N VAL A 434 -4.142 22.193 2.058 1.00 0.00 N ATOM 1019 CA VAL A 434 -3.031 21.287 2.324 1.00 0.00 C ATOM 1020 C VAL A 434 -3.406 20.258 3.385 1.00 0.00 C ATOM 1021 O VAL A 434 -2.982 19.104 3.323 1.00 0.00 O ATOM 1022 CB VAL A 434 -1.778 22.054 2.788 1.00 0.00 C ATOM 1023 CG1 VAL A 434 -0.590 21.113 2.916 1.00 0.00 C ATOM 1024 CG2 VAL A 434 -1.463 23.195 1.831 1.00 0.00 C ATOM 0 H VAL A 434 -3.953 23.170 2.284 1.00 0.00 H new ATOM 0 HA VAL A 434 -2.807 20.776 1.388 1.00 0.00 H new ATOM 0 HB VAL A 434 -1.981 22.480 3.770 1.00 0.00 H new ATOM 0 HG11 VAL A 434 0.285 21.674 3.245 1.00 0.00 H new ATOM 0 HG12 VAL A 434 -0.818 20.336 3.646 1.00 0.00 H new ATOM 0 HG13 VAL A 434 -0.384 20.653 1.949 1.00 0.00 H new ATOM 0 HG21 VAL A 434 -0.575 23.725 2.176 1.00 0.00 H new ATOM 0 HG22 VAL A 434 -1.282 22.794 0.834 1.00 0.00 H new ATOM 0 HG23 VAL A 434 -2.306 23.885 1.797 1.00 0.00 H new ATOM 1034 N ARG A 435 -4.203 20.683 4.360 1.00 0.00 N ATOM 1035 CA ARG A 435 -4.634 19.799 5.435 1.00 0.00 C ATOM 1036 C ARG A 435 -5.525 18.683 4.896 1.00 0.00 C ATOM 1037 O ARG A 435 -5.378 17.521 5.272 1.00 0.00 O ATOM 1038 CB ARG A 435 -5.382 20.594 6.510 1.00 0.00 C ATOM 1039 CG ARG A 435 -4.657 20.639 7.845 1.00 0.00 C ATOM 1040 CD ARG A 435 -5.189 21.755 8.730 1.00 0.00 C ATOM 1041 NE ARG A 435 -4.499 21.808 10.018 1.00 0.00 N ATOM 1042 CZ ARG A 435 -4.815 22.658 10.993 1.00 0.00 C ATOM 1043 NH1 ARG A 435 -5.809 23.524 10.833 1.00 0.00 N ATOM 1044 NH2 ARG A 435 -4.138 22.640 12.133 1.00 0.00 N ATOM 0 H ARG A 435 -4.563 21.635 4.427 1.00 0.00 H new ATOM 0 HA ARG A 435 -3.747 19.348 5.880 1.00 0.00 H new ATOM 0 HB2 ARG A 435 -5.537 21.613 6.155 1.00 0.00 H new ATOM 0 HB3 ARG A 435 -6.368 20.154 6.656 1.00 0.00 H new ATOM 0 HG2 ARG A 435 -4.772 19.683 8.355 1.00 0.00 H new ATOM 0 HG3 ARG A 435 -3.590 20.784 7.676 1.00 0.00 H new ATOM 0 HD2 ARG A 435 -5.074 22.710 8.218 1.00 0.00 H new ATOM 0 HD3 ARG A 435 -6.256 21.609 8.896 1.00 0.00 H new ATOM 0 HE ARG A 435 -3.731 21.156 10.179 1.00 0.00 H new ATOM 0 HH11 ARG A 435 -6.335 23.541 9.959 1.00 0.00 H new ATOM 0 HH12 ARG A 435 -6.046 24.173 11.584 1.00 0.00 H new ATOM 0 HH21 ARG A 435 -3.375 21.975 12.263 1.00 0.00 H new ATOM 0 HH22 ARG A 435 -4.380 23.291 12.880 1.00 0.00 H new ATOM 1058 N GLN A 436 -6.452 19.044 4.016 1.00 0.00 N ATOM 1059 CA GLN A 436 -7.365 18.073 3.426 1.00 0.00 C ATOM 1060 C GLN A 436 -6.629 17.130 2.480 1.00 0.00 C ATOM 1061 O GLN A 436 -6.989 15.960 2.348 1.00 0.00 O ATOM 1062 CB GLN A 436 -8.491 18.790 2.676 1.00 0.00 C ATOM 1063 CG GLN A 436 -9.724 17.928 2.461 1.00 0.00 C ATOM 1064 CD GLN A 436 -10.457 18.267 1.178 1.00 0.00 C ATOM 1065 OE1 GLN A 436 -11.633 18.629 1.198 1.00 0.00 O ATOM 1066 NE2 GLN A 436 -9.763 18.151 0.052 1.00 0.00 N ATOM 0 H GLN A 436 -6.591 20.002 3.696 1.00 0.00 H new ATOM 0 HA GLN A 436 -7.793 17.481 4.235 1.00 0.00 H new ATOM 0 HB2 GLN A 436 -8.775 19.684 3.232 1.00 0.00 H new ATOM 0 HB3 GLN A 436 -8.117 19.123 1.708 1.00 0.00 H new ATOM 0 HG2 GLN A 436 -9.430 16.879 2.440 1.00 0.00 H new ATOM 0 HG3 GLN A 436 -10.401 18.053 3.306 1.00 0.00 H new ATOM 0 HE21 GLN A 436 -8.790 17.847 0.082 1.00 0.00 H new ATOM 0 HE22 GLN A 436 -10.203 18.366 -0.843 1.00 0.00 H new ATOM 1075 N ALA A 437 -5.599 17.648 1.818 1.00 0.00 N ATOM 1076 CA ALA A 437 -4.816 16.854 0.878 1.00 0.00 C ATOM 1077 C ALA A 437 -4.006 15.780 1.596 1.00 0.00 C ATOM 1078 O ALA A 437 -3.966 14.628 1.163 1.00 0.00 O ATOM 1079 CB ALA A 437 -3.897 17.756 0.068 1.00 0.00 C ATOM 0 H ALA A 437 -5.287 18.614 1.915 1.00 0.00 H new ATOM 0 HA ALA A 437 -5.509 16.352 0.203 1.00 0.00 H new ATOM 0 HB1 ALA A 437 -3.317 17.152 -0.630 1.00 0.00 H new ATOM 0 HB2 ALA A 437 -4.494 18.480 -0.487 1.00 0.00 H new ATOM 0 HB3 ALA A 437 -3.220 18.283 0.740 1.00 0.00 H new ATOM 1085 N ARG A 438 -3.357 16.162 2.691 1.00 0.00 N ATOM 1086 CA ARG A 438 -2.545 15.226 3.462 1.00 0.00 C ATOM 1087 C ARG A 438 -3.421 14.244 4.233 1.00 0.00 C ATOM 1088 O ARG A 438 -3.153 13.042 4.251 1.00 0.00 O ATOM 1089 CB ARG A 438 -1.631 15.982 4.429 1.00 0.00 C ATOM 1090 CG ARG A 438 -2.382 16.859 5.416 1.00 0.00 C ATOM 1091 CD ARG A 438 -1.488 17.948 5.984 1.00 0.00 C ATOM 1092 NE ARG A 438 -1.963 18.423 7.282 1.00 0.00 N ATOM 1093 CZ ARG A 438 -1.978 17.675 8.384 1.00 0.00 C ATOM 1094 NH1 ARG A 438 -1.546 16.421 8.348 1.00 0.00 N ATOM 1095 NH2 ARG A 438 -2.427 18.185 9.522 1.00 0.00 N ATOM 0 H ARG A 438 -3.377 17.111 3.064 1.00 0.00 H new ATOM 0 HA ARG A 438 -1.931 14.660 2.761 1.00 0.00 H new ATOM 0 HB2 ARG A 438 -1.027 15.263 4.982 1.00 0.00 H new ATOM 0 HB3 ARG A 438 -0.943 16.602 3.855 1.00 0.00 H new ATOM 0 HG2 ARG A 438 -3.241 17.313 4.921 1.00 0.00 H new ATOM 0 HG3 ARG A 438 -2.770 16.245 6.228 1.00 0.00 H new ATOM 0 HD2 ARG A 438 -0.472 17.566 6.087 1.00 0.00 H new ATOM 0 HD3 ARG A 438 -1.445 18.784 5.285 1.00 0.00 H new ATOM 0 HE ARG A 438 -2.303 19.383 7.348 1.00 0.00 H new ATOM 0 HH11 ARG A 438 -1.200 16.026 7.474 1.00 0.00 H new ATOM 0 HH12 ARG A 438 -1.560 15.852 9.195 1.00 0.00 H new ATOM 0 HH21 ARG A 438 -2.760 19.149 9.553 1.00 0.00 H new ATOM 0 HH22 ARG A 438 -2.439 17.614 10.367 1.00 0.00 H new ATOM 1109 N LYS A 439 -4.469 14.759 4.867 1.00 0.00 N ATOM 1110 CA LYS A 439 -5.381 13.919 5.637 1.00 0.00 C ATOM 1111 C LYS A 439 -6.082 12.910 4.734 1.00 0.00 C ATOM 1112 O LYS A 439 -6.356 11.781 5.142 1.00 0.00 O ATOM 1113 CB LYS A 439 -6.417 14.781 6.361 1.00 0.00 C ATOM 1114 CG LYS A 439 -6.761 14.276 7.753 1.00 0.00 C ATOM 1115 CD LYS A 439 -6.556 15.353 8.807 1.00 0.00 C ATOM 1116 CE LYS A 439 -6.918 14.851 10.195 1.00 0.00 C ATOM 1117 NZ LYS A 439 -6.040 15.438 11.244 1.00 0.00 N ATOM 0 H LYS A 439 -4.708 15.751 4.864 1.00 0.00 H new ATOM 0 HA LYS A 439 -4.795 13.373 6.377 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -6.040 15.801 6.436 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -7.327 14.821 5.762 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -7.798 13.940 7.773 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -6.141 13.411 7.990 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -5.516 15.680 8.797 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -7.166 16.223 8.563 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -7.957 15.099 10.411 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -6.837 13.764 10.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -6.319 15.071 12.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -5.051 15.181 11.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -6.136 16.474 11.237 1.00 0.00 H new ATOM 1131 N GLU A 440 -6.367 13.324 3.503 1.00 0.00 N ATOM 1132 CA GLU A 440 -7.035 12.455 2.541 1.00 0.00 C ATOM 1133 C GLU A 440 -6.083 11.377 2.033 1.00 0.00 C ATOM 1134 O GLU A 440 -6.473 10.224 1.853 1.00 0.00 O ATOM 1135 CB GLU A 440 -7.569 13.276 1.365 1.00 0.00 C ATOM 1136 CG GLU A 440 -8.299 12.443 0.324 1.00 0.00 C ATOM 1137 CD GLU A 440 -9.662 11.980 0.799 1.00 0.00 C ATOM 1138 OE1 GLU A 440 -9.751 11.460 1.931 1.00 0.00 O ATOM 1139 OE2 GLU A 440 -10.642 12.138 0.040 1.00 0.00 O ATOM 0 H GLU A 440 -6.146 14.255 3.149 1.00 0.00 H new ATOM 0 HA GLU A 440 -7.871 11.970 3.045 1.00 0.00 H new ATOM 0 HB2 GLU A 440 -8.245 14.042 1.745 1.00 0.00 H new ATOM 0 HB3 GLU A 440 -6.738 13.793 0.886 1.00 0.00 H new ATOM 0 HG2 GLU A 440 -8.416 13.029 -0.588 1.00 0.00 H new ATOM 0 HG3 GLU A 440 -7.693 11.574 0.069 1.00 0.00 H new ATOM 1146 N ALA A 441 -4.831 11.762 1.802 1.00 0.00 N ATOM 1147 CA ALA A 441 -3.823 10.828 1.315 1.00 0.00 C ATOM 1148 C ALA A 441 -3.430 9.830 2.399 1.00 0.00 C ATOM 1149 O ALA A 441 -3.340 8.630 2.146 1.00 0.00 O ATOM 1150 CB ALA A 441 -2.599 11.584 0.819 1.00 0.00 C ATOM 0 H ALA A 441 -4.491 12.713 1.944 1.00 0.00 H new ATOM 0 HA ALA A 441 -4.252 10.269 0.483 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -1.854 10.874 0.458 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -2.888 12.251 0.007 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -2.177 12.169 1.636 1.00 0.00 H new ATOM 1156 N VAL A 442 -3.199 10.336 3.607 1.00 0.00 N ATOM 1157 CA VAL A 442 -2.816 9.490 4.733 1.00 0.00 C ATOM 1158 C VAL A 442 -3.923 8.494 5.069 1.00 0.00 C ATOM 1159 O VAL A 442 -3.667 7.306 5.270 1.00 0.00 O ATOM 1160 CB VAL A 442 -2.505 10.335 5.985 1.00 0.00 C ATOM 1161 CG1 VAL A 442 -2.030 9.451 7.130 1.00 0.00 C ATOM 1162 CG2 VAL A 442 -1.470 11.403 5.662 1.00 0.00 C ATOM 0 H VAL A 442 -3.270 11.328 3.831 1.00 0.00 H new ATOM 0 HA VAL A 442 -1.919 8.947 4.436 1.00 0.00 H new ATOM 0 HB VAL A 442 -3.423 10.831 6.301 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -1.817 10.069 8.002 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.807 8.728 7.378 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.125 8.922 6.830 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -1.262 11.990 6.556 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -0.551 10.927 5.318 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -1.854 12.057 4.880 1.00 0.00 H new ATOM 1172 N CYS A 443 -5.158 8.988 5.126 1.00 0.00 N ATOM 1173 CA CYS A 443 -6.307 8.144 5.436 1.00 0.00 C ATOM 1174 C CYS A 443 -6.467 7.042 4.395 1.00 0.00 C ATOM 1175 O CYS A 443 -6.859 5.919 4.716 1.00 0.00 O ATOM 1176 CB CYS A 443 -7.581 8.987 5.505 1.00 0.00 C ATOM 1177 SG CYS A 443 -8.979 8.149 6.287 1.00 0.00 S ATOM 0 H CYS A 443 -5.387 9.968 4.961 1.00 0.00 H new ATOM 0 HA CYS A 443 -6.135 7.679 6.407 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -7.368 9.904 6.054 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -7.866 9.279 4.494 1.00 0.00 H new ATOM 0 HG CYS A 443 -10.009 8.943 6.300 1.00 0.00 H new ATOM 1183 N LYS A 444 -6.157 7.367 3.145 1.00 0.00 N ATOM 1184 CA LYS A 444 -6.266 6.401 2.059 1.00 0.00 C ATOM 1185 C LYS A 444 -5.307 5.237 2.280 1.00 0.00 C ATOM 1186 O LYS A 444 -5.648 4.081 2.026 1.00 0.00 O ATOM 1187 CB LYS A 444 -5.973 7.072 0.716 1.00 0.00 C ATOM 1188 CG LYS A 444 -6.641 6.385 -0.463 1.00 0.00 C ATOM 1189 CD LYS A 444 -6.436 7.165 -1.753 1.00 0.00 C ATOM 1190 CE LYS A 444 -7.659 7.995 -2.106 1.00 0.00 C ATOM 1191 NZ LYS A 444 -7.325 9.438 -2.264 1.00 0.00 N ATOM 0 H LYS A 444 -5.829 8.290 2.859 1.00 0.00 H new ATOM 0 HA LYS A 444 -7.286 6.016 2.045 1.00 0.00 H new ATOM 0 HB2 LYS A 444 -6.304 8.110 0.757 1.00 0.00 H new ATOM 0 HB3 LYS A 444 -4.895 7.088 0.554 1.00 0.00 H new ATOM 0 HG2 LYS A 444 -6.236 5.379 -0.577 1.00 0.00 H new ATOM 0 HG3 LYS A 444 -7.708 6.279 -0.267 1.00 0.00 H new ATOM 0 HD2 LYS A 444 -5.570 7.818 -1.650 1.00 0.00 H new ATOM 0 HD3 LYS A 444 -6.218 6.473 -2.566 1.00 0.00 H new ATOM 0 HE2 LYS A 444 -8.097 7.620 -3.031 1.00 0.00 H new ATOM 0 HE3 LYS A 444 -8.413 7.880 -1.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 -8.186 9.969 -2.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 -6.931 9.803 -1.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 -6.625 9.551 -3.025 1.00 0.00 H new ATOM 1205 N ILE A 445 -4.106 5.547 2.760 1.00 0.00 N ATOM 1206 CA ILE A 445 -3.101 4.522 3.016 1.00 0.00 C ATOM 1207 C ILE A 445 -3.550 3.590 4.132 1.00 0.00 C ATOM 1208 O ILE A 445 -3.215 2.407 4.142 1.00 0.00 O ATOM 1209 CB ILE A 445 -1.732 5.126 3.392 1.00 0.00 C ATOM 1210 CG1 ILE A 445 -1.469 6.407 2.585 1.00 0.00 C ATOM 1211 CG2 ILE A 445 -0.633 4.097 3.166 1.00 0.00 C ATOM 1212 CD1 ILE A 445 -0.002 6.762 2.437 1.00 0.00 C ATOM 0 H ILE A 445 -3.806 6.497 2.979 1.00 0.00 H new ATOM 0 HA ILE A 445 -2.989 3.963 2.087 1.00 0.00 H new ATOM 0 HB ILE A 445 -1.739 5.395 4.448 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -1.905 6.293 1.593 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -1.985 7.238 3.066 1.00 0.00 H new ATOM 0 HG21 ILE A 445 0.331 4.530 3.433 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -0.822 3.221 3.786 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -0.620 3.803 2.117 1.00 0.00 H new ATOM 0 HD11 ILE A 445 0.094 7.678 1.855 1.00 0.00 H new ATOM 0 HD12 ILE A 445 0.438 6.911 3.423 1.00 0.00 H new ATOM 0 HD13 ILE A 445 0.519 5.952 1.927 1.00 0.00 H new ATOM 1224 N GLN A 446 -4.317 4.135 5.065 1.00 0.00 N ATOM 1225 CA GLN A 446 -4.824 3.364 6.182 1.00 0.00 C ATOM 1226 C GLN A 446 -5.744 2.255 5.680 1.00 0.00 C ATOM 1227 O GLN A 446 -5.658 1.111 6.128 1.00 0.00 O ATOM 1228 CB GLN A 446 -5.565 4.296 7.140 1.00 0.00 C ATOM 1229 CG GLN A 446 -6.349 3.581 8.221 1.00 0.00 C ATOM 1230 CD GLN A 446 -5.722 3.735 9.592 1.00 0.00 C ATOM 1231 OE1 GLN A 446 -6.418 3.943 10.587 1.00 0.00 O ATOM 1232 NE2 GLN A 446 -4.399 3.634 9.650 1.00 0.00 N ATOM 0 H GLN A 446 -4.601 5.115 5.067 1.00 0.00 H new ATOM 0 HA GLN A 446 -3.995 2.897 6.714 1.00 0.00 H new ATOM 0 HB2 GLN A 446 -4.843 4.963 7.611 1.00 0.00 H new ATOM 0 HB3 GLN A 446 -6.248 4.921 6.565 1.00 0.00 H new ATOM 0 HG2 GLN A 446 -7.367 3.971 8.245 1.00 0.00 H new ATOM 0 HG3 GLN A 446 -6.419 2.522 7.974 1.00 0.00 H new ATOM 0 HE21 GLN A 446 -3.863 3.461 8.800 1.00 0.00 H new ATOM 0 HE22 GLN A 446 -3.919 3.729 10.545 1.00 0.00 H new ATOM 1241 N ALA A 447 -6.615 2.600 4.737 1.00 0.00 N ATOM 1242 CA ALA A 447 -7.541 1.632 4.164 1.00 0.00 C ATOM 1243 C ALA A 447 -6.780 0.502 3.478 1.00 0.00 C ATOM 1244 O ALA A 447 -7.170 -0.662 3.556 1.00 0.00 O ATOM 1245 CB ALA A 447 -8.478 2.314 3.180 1.00 0.00 C ATOM 0 H ALA A 447 -6.698 3.542 4.354 1.00 0.00 H new ATOM 0 HA ALA A 447 -8.136 1.205 4.972 1.00 0.00 H new ATOM 0 HB1 ALA A 447 -9.164 1.578 2.760 1.00 0.00 H new ATOM 0 HB2 ALA A 447 -9.047 3.087 3.696 1.00 0.00 H new ATOM 0 HB3 ALA A 447 -7.896 2.767 2.377 1.00 0.00 H new ATOM 1251 N ILE A 448 -5.684 0.858 2.815 1.00 0.00 N ATOM 1252 CA ILE A 448 -4.853 -0.119 2.121 1.00 0.00 C ATOM 1253 C ILE A 448 -4.167 -1.049 3.113 1.00 0.00 C ATOM 1254 O ILE A 448 -3.991 -2.237 2.849 1.00 0.00 O ATOM 1255 CB ILE A 448 -3.780 0.564 1.252 1.00 0.00 C ATOM 1256 CG1 ILE A 448 -4.420 1.621 0.355 1.00 0.00 C ATOM 1257 CG2 ILE A 448 -3.034 -0.466 0.418 1.00 0.00 C ATOM 1258 CD1 ILE A 448 -3.415 2.478 -0.384 1.00 0.00 C ATOM 0 H ILE A 448 -5.350 1.819 2.744 1.00 0.00 H new ATOM 0 HA ILE A 448 -5.515 -0.696 1.475 1.00 0.00 H new ATOM 0 HB ILE A 448 -3.062 1.056 1.908 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -5.066 1.127 -0.370 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -5.056 2.264 0.963 1.00 0.00 H new ATOM 0 HG21 ILE A 448 -2.280 0.035 -0.189 1.00 0.00 H new ATOM 0 HG22 ILE A 448 -2.549 -1.186 1.077 1.00 0.00 H new ATOM 0 HG23 ILE A 448 -3.737 -0.986 -0.232 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -3.942 3.206 -1.001 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -2.784 3.001 0.335 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -2.794 1.845 -1.019 1.00 0.00 H new ATOM 1270 N LEU A 449 -3.776 -0.493 4.254 1.00 0.00 N ATOM 1271 CA LEU A 449 -3.099 -1.266 5.289 1.00 0.00 C ATOM 1272 C LEU A 449 -3.953 -2.451 5.729 1.00 0.00 C ATOM 1273 O LEU A 449 -3.466 -3.579 5.815 1.00 0.00 O ATOM 1274 CB LEU A 449 -2.779 -0.378 6.493 1.00 0.00 C ATOM 1275 CG LEU A 449 -1.487 -0.733 7.232 1.00 0.00 C ATOM 1276 CD1 LEU A 449 -1.234 0.248 8.365 1.00 0.00 C ATOM 1277 CD2 LEU A 449 -1.551 -2.158 7.760 1.00 0.00 C ATOM 0 H LEU A 449 -3.916 0.490 4.486 1.00 0.00 H new ATOM 0 HA LEU A 449 -2.167 -1.647 4.871 1.00 0.00 H new ATOM 0 HB2 LEU A 449 -2.715 0.657 6.156 1.00 0.00 H new ATOM 0 HB3 LEU A 449 -3.609 -0.433 7.197 1.00 0.00 H new ATOM 0 HG LEU A 449 -0.657 -0.664 6.529 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -0.311 -0.020 8.879 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -1.144 1.256 7.960 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -2.065 0.213 9.069 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -0.624 -2.394 8.283 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -2.391 -2.254 8.449 1.00 0.00 H new ATOM 0 HD23 LEU A 449 -1.684 -2.849 6.927 1.00 0.00 H new ATOM 1289 N GLU A 450 -5.230 -2.197 5.995 1.00 0.00 N ATOM 1290 CA GLU A 450 -6.140 -3.259 6.412 1.00 0.00 C ATOM 1291 C GLU A 450 -6.267 -4.301 5.312 1.00 0.00 C ATOM 1292 O GLU A 450 -6.257 -5.503 5.578 1.00 0.00 O ATOM 1293 CB GLU A 450 -7.515 -2.686 6.765 1.00 0.00 C ATOM 1294 CG GLU A 450 -8.128 -3.301 8.013 1.00 0.00 C ATOM 1295 CD GLU A 450 -9.328 -4.175 7.704 1.00 0.00 C ATOM 1296 OE1 GLU A 450 -10.418 -3.619 7.450 1.00 0.00 O ATOM 1297 OE2 GLU A 450 -9.179 -5.415 7.716 1.00 0.00 O ATOM 0 H GLU A 450 -5.656 -1.273 5.930 1.00 0.00 H new ATOM 0 HA GLU A 450 -5.730 -3.736 7.303 1.00 0.00 H new ATOM 0 HB2 GLU A 450 -7.425 -1.609 6.907 1.00 0.00 H new ATOM 0 HB3 GLU A 450 -8.191 -2.841 5.924 1.00 0.00 H new ATOM 0 HG2 GLU A 450 -7.374 -3.895 8.529 1.00 0.00 H new ATOM 0 HG3 GLU A 450 -8.429 -2.506 8.695 1.00 0.00 H new ATOM 1304 N LYS A 451 -6.355 -3.837 4.069 1.00 0.00 N ATOM 1305 CA LYS A 451 -6.446 -4.743 2.932 1.00 0.00 C ATOM 1306 C LYS A 451 -5.233 -5.665 2.929 1.00 0.00 C ATOM 1307 O LYS A 451 -5.302 -6.812 2.489 1.00 0.00 O ATOM 1308 CB LYS A 451 -6.519 -3.956 1.622 1.00 0.00 C ATOM 1309 CG LYS A 451 -7.458 -4.569 0.595 1.00 0.00 C ATOM 1310 CD LYS A 451 -8.349 -3.515 -0.045 1.00 0.00 C ATOM 1311 CE LYS A 451 -9.666 -3.370 0.702 1.00 0.00 C ATOM 1312 NZ LYS A 451 -10.333 -2.072 0.402 1.00 0.00 N ATOM 0 H LYS A 451 -6.365 -2.846 3.826 1.00 0.00 H new ATOM 0 HA LYS A 451 -7.355 -5.338 3.019 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.844 -2.938 1.837 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -5.519 -3.888 1.193 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -6.876 -5.072 -0.177 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.077 -5.328 1.074 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -7.829 -2.557 -0.058 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -8.546 -3.785 -1.083 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -10.330 -4.191 0.431 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -9.486 -3.447 1.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -11.227 -2.011 0.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -9.710 -1.288 0.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -10.528 -2.009 -0.618 1.00 0.00 H new ATOM 1326 N LEU A 452 -4.122 -5.144 3.447 1.00 0.00 N ATOM 1327 CA LEU A 452 -2.884 -5.898 3.538 1.00 0.00 C ATOM 1328 C LEU A 452 -3.033 -7.045 4.530 1.00 0.00 C ATOM 1329 O LEU A 452 -2.518 -8.141 4.308 1.00 0.00 O ATOM 1330 CB LEU A 452 -1.742 -4.973 3.972 1.00 0.00 C ATOM 1331 CG LEU A 452 -0.522 -4.967 3.049 1.00 0.00 C ATOM 1332 CD1 LEU A 452 -0.141 -3.540 2.678 1.00 0.00 C ATOM 1333 CD2 LEU A 452 0.653 -5.683 3.705 1.00 0.00 C ATOM 0 H LEU A 452 -4.060 -4.193 3.812 1.00 0.00 H new ATOM 0 HA LEU A 452 -2.653 -6.314 2.557 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -2.127 -3.956 4.045 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -1.420 -5.264 4.972 1.00 0.00 H new ATOM 0 HG LEU A 452 -0.780 -5.503 2.136 1.00 0.00 H new ATOM 0 HD11 LEU A 452 0.729 -3.555 2.021 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -0.975 -3.062 2.165 1.00 0.00 H new ATOM 0 HD13 LEU A 452 0.097 -2.980 3.582 1.00 0.00 H new ATOM 0 HD21 LEU A 452 1.510 -5.667 3.032 1.00 0.00 H new ATOM 0 HD22 LEU A 452 0.913 -5.178 4.636 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.377 -6.716 3.917 1.00 0.00 H new ATOM 1345 N GLU A 453 -3.746 -6.786 5.626 1.00 0.00 N ATOM 1346 CA GLU A 453 -3.963 -7.803 6.650 1.00 0.00 C ATOM 1347 C GLU A 453 -4.608 -9.050 6.048 1.00 0.00 C ATOM 1348 O GLU A 453 -4.397 -10.164 6.529 1.00 0.00 O ATOM 1349 CB GLU A 453 -4.842 -7.246 7.773 1.00 0.00 C ATOM 1350 CG GLU A 453 -4.129 -7.151 9.112 1.00 0.00 C ATOM 1351 CD GLU A 453 -4.150 -8.458 9.879 1.00 0.00 C ATOM 1352 OE1 GLU A 453 -3.259 -9.301 9.641 1.00 0.00 O ATOM 1353 OE2 GLU A 453 -5.058 -8.639 10.718 1.00 0.00 O ATOM 0 H GLU A 453 -4.180 -5.885 5.825 1.00 0.00 H new ATOM 0 HA GLU A 453 -2.994 -8.082 7.064 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -5.197 -6.255 7.488 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -5.722 -7.880 7.883 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -3.095 -6.847 8.948 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -4.598 -6.373 9.715 1.00 0.00 H new ATOM 1360 N LYS A 454 -5.396 -8.855 4.996 1.00 0.00 N ATOM 1361 CA LYS A 454 -6.073 -9.962 4.330 1.00 0.00 C ATOM 1362 C LYS A 454 -5.213 -10.551 3.215 1.00 0.00 C ATOM 1363 O LYS A 454 -5.427 -11.687 2.792 1.00 0.00 O ATOM 1364 CB LYS A 454 -7.416 -9.499 3.764 1.00 0.00 C ATOM 1365 CG LYS A 454 -8.471 -9.245 4.828 1.00 0.00 C ATOM 1366 CD LYS A 454 -9.544 -8.289 4.333 1.00 0.00 C ATOM 1367 CE LYS A 454 -8.983 -6.897 4.092 1.00 0.00 C ATOM 1368 NZ LYS A 454 -9.928 -5.833 4.531 1.00 0.00 N ATOM 0 H LYS A 454 -5.582 -7.940 4.586 1.00 0.00 H new ATOM 0 HA LYS A 454 -6.245 -10.741 5.072 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -7.263 -8.585 3.191 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -7.787 -10.253 3.069 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -8.930 -10.190 5.119 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -7.998 -8.833 5.719 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -9.976 -8.673 3.409 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -10.350 -8.236 5.064 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -8.040 -6.788 4.627 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.764 -6.773 3.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.706 -4.946 4.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -10.902 -6.120 4.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -9.836 -5.689 5.557 1.00 0.00 H new ATOM 1382 N LYS A 455 -4.240 -9.778 2.742 1.00 0.00 N ATOM 1383 CA LYS A 455 -3.354 -10.237 1.676 1.00 0.00 C ATOM 1384 C LYS A 455 -2.224 -11.097 2.236 1.00 0.00 C ATOM 1385 O LYS A 455 -1.602 -11.870 1.507 1.00 0.00 O ATOM 1386 CB LYS A 455 -2.770 -9.043 0.915 1.00 0.00 C ATOM 1387 CG LYS A 455 -3.403 -8.825 -0.451 1.00 0.00 C ATOM 1388 CD LYS A 455 -4.630 -7.934 -0.362 1.00 0.00 C ATOM 1389 CE LYS A 455 -5.896 -8.749 -0.155 1.00 0.00 C ATOM 1390 NZ LYS A 455 -6.577 -9.055 -1.444 1.00 0.00 N ATOM 0 H LYS A 455 -4.045 -8.835 3.078 1.00 0.00 H new ATOM 0 HA LYS A 455 -3.943 -10.844 0.989 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -2.899 -8.142 1.514 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -1.697 -9.191 0.790 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -2.673 -8.374 -1.123 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -3.681 -9.787 -0.882 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -4.511 -7.230 0.461 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -4.720 -7.345 -1.275 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -5.649 -9.680 0.355 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -6.578 -8.201 0.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -7.436 -9.612 -1.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -6.836 -8.167 -1.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -5.936 -9.600 -2.055 1.00 0.00 H new ATOM 1404 N GLY A 456 -1.961 -10.959 3.532 1.00 0.00 N ATOM 1405 CA GLY A 456 -0.906 -11.732 4.158 1.00 0.00 C ATOM 1406 C GLY A 456 -1.294 -13.183 4.362 1.00 0.00 C ATOM 1407 O GLY A 456 -0.930 -14.048 3.566 1.00 0.00 O ATOM 0 H GLY A 456 -2.459 -10.326 4.158 1.00 0.00 H new ATOM 0 HA2 GLY A 456 -0.009 -11.682 3.541 1.00 0.00 H new ATOM 0 HA3 GLY A 456 -0.656 -11.287 5.121 1.00 0.00 H new ATOM 1411 N LEU A 457 -2.037 -13.449 5.432 1.00 0.00 N ATOM 1412 CA LEU A 457 -2.476 -14.804 5.738 1.00 0.00 C ATOM 1413 C LEU A 457 -1.281 -15.734 5.934 1.00 0.00 C ATOM 1414 O LEU A 457 -0.136 -15.239 5.894 1.00 0.00 O ATOM 1415 CB LEU A 457 -3.379 -15.335 4.620 1.00 0.00 C ATOM 1416 CG LEU A 457 -4.771 -15.783 5.070 1.00 0.00 C ATOM 1417 CD1 LEU A 457 -5.768 -14.642 4.934 1.00 0.00 C ATOM 1418 CD2 LEU A 457 -5.228 -16.991 4.265 1.00 0.00 C ATOM 1419 OXT LEU A 457 -1.503 -16.948 6.125 1.00 0.00 O ATOM 0 H LEU A 457 -2.347 -12.744 6.101 1.00 0.00 H new ATOM 0 HA LEU A 457 -3.043 -14.775 6.668 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -3.491 -14.558 3.864 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -2.880 -16.177 4.140 1.00 0.00 H new ATOM 0 HG LEU A 457 -4.718 -16.070 6.120 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -6.753 -14.979 5.258 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -5.449 -13.804 5.554 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -5.818 -14.325 3.892 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -6.220 -17.296 4.598 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -5.265 -16.731 3.207 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -4.527 -17.813 4.412 1.00 0.00 H new