USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 667 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 389 LYS NZ :NH3+ -153:sc= -0.0143 (180deg=-0.0191) USER MOD Set 1.2: A 415 MET CE :methyl 151:sc= 0 (180deg=0) USER MOD Single : A 379 SER OG : rot 22:sc= 0.677 USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 HIS :FLIP no HE2:sc= 0.0551 F(o=-0.59,f=0.055) USER MOD Single : A 391 GLN : amide:sc= 0 X(o=0,f=-0.038) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= -3.03 K(o=-3,f=-5.4!) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 LYS NZ :NH3+ -152:sc= -0.0934 (180deg=-1.53!) 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 -125:sc= 0.566 USER MOD Single : A 417 THR OG1 : rot -102:sc= -0.382 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 -169:sc= -0.948 USER MOD Single : A 431 GLN : amide:sc= -2.27 K(o=-2.3,f=-11!) USER MOD Single : A 433 SER OG : rot 180:sc= -0.101 USER MOD Single : A 436 GLN : amide:sc= -0.522 X(o=-0.52,f=-0.92) 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= -0.194 X(o=-0.19,f=-0.027) USER MOD Single : A 451 LYS NZ :NH3+ 136:sc= -1.06 (180deg=-3.41!) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 455 LYS NZ :NH3+ -163:sc= -0.0255 (180deg=-0.225) USER MOD ----------------------------------------------------------------- ATOM 43 N SER A 379 -1.725 17.057 1.380 1.00 0.00 N ATOM 44 CA SER A 379 -0.670 16.070 1.167 1.00 0.00 C ATOM 45 C SER A 379 -0.682 15.001 2.257 1.00 0.00 C ATOM 46 O SER A 379 -0.265 13.865 2.027 1.00 0.00 O ATOM 47 CB SER A 379 0.697 16.753 1.124 1.00 0.00 C ATOM 48 OG SER A 379 0.573 18.121 0.774 1.00 0.00 O ATOM 0 HA SER A 379 -0.859 15.584 0.210 1.00 0.00 H new ATOM 0 HB2 SER A 379 1.181 16.666 2.097 1.00 0.00 H new ATOM 0 HB3 SER A 379 1.338 16.246 0.402 1.00 0.00 H new ATOM 0 HG SER A 379 -0.337 18.427 0.968 1.00 0.00 H new ATOM 54 N ILE A 380 -1.157 15.369 3.442 1.00 0.00 N ATOM 55 CA ILE A 380 -1.216 14.437 4.562 1.00 0.00 C ATOM 56 C ILE A 380 -2.356 13.438 4.390 1.00 0.00 C ATOM 57 O ILE A 380 -2.256 12.288 4.815 1.00 0.00 O ATOM 58 CB ILE A 380 -1.386 15.179 5.904 1.00 0.00 C ATOM 59 CG1 ILE A 380 -1.259 14.201 7.074 1.00 0.00 C ATOM 60 CG2 ILE A 380 -2.724 15.903 5.950 1.00 0.00 C ATOM 61 CD1 ILE A 380 -0.027 14.430 7.921 1.00 0.00 C ATOM 0 H ILE A 380 -1.506 16.304 3.652 1.00 0.00 H new ATOM 0 HA ILE A 380 -0.269 13.898 4.575 1.00 0.00 H new ATOM 0 HB ILE A 380 -0.594 15.923 5.991 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -2.144 14.284 7.704 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -1.239 13.183 6.686 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -2.825 16.420 6.904 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -2.774 16.628 5.137 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -3.533 15.180 5.842 1.00 0.00 H new ATOM 0 HD11 ILE A 380 -0.002 13.701 8.731 1.00 0.00 H new ATOM 0 HD12 ILE A 380 0.865 14.318 7.304 1.00 0.00 H new ATOM 0 HD13 ILE A 380 -0.055 15.436 8.339 1.00 0.00 H new ATOM 73 N LYS A 381 -3.439 13.883 3.764 1.00 0.00 N ATOM 74 CA LYS A 381 -4.595 13.021 3.538 1.00 0.00 C ATOM 75 C LYS A 381 -4.232 11.867 2.610 1.00 0.00 C ATOM 76 O LYS A 381 -4.698 10.741 2.788 1.00 0.00 O ATOM 77 CB LYS A 381 -5.750 13.826 2.943 1.00 0.00 C ATOM 78 CG LYS A 381 -7.118 13.381 3.435 1.00 0.00 C ATOM 79 CD LYS A 381 -7.608 14.251 4.579 1.00 0.00 C ATOM 80 CE LYS A 381 -7.993 15.640 4.099 1.00 0.00 C ATOM 81 NZ LYS A 381 -9.415 15.703 3.660 1.00 0.00 N ATOM 0 H LYS A 381 -3.542 14.832 3.405 1.00 0.00 H new ATOM 0 HA LYS A 381 -4.908 12.611 4.498 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -5.611 14.879 3.186 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -5.719 13.742 1.857 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -7.833 13.423 2.613 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -7.068 12.342 3.762 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -8.468 13.778 5.054 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -6.828 14.330 5.337 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -7.829 16.360 4.901 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -7.345 15.931 3.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -9.637 16.667 3.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -9.567 15.035 2.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -10.035 15.451 4.456 1.00 0.00 H new ATOM 95 N LYS A 382 -3.394 12.155 1.619 1.00 0.00 N ATOM 96 CA LYS A 382 -2.966 11.145 0.658 1.00 0.00 C ATOM 97 C LYS A 382 -2.106 10.078 1.332 1.00 0.00 C ATOM 98 O LYS A 382 -2.445 8.894 1.311 1.00 0.00 O ATOM 99 CB LYS A 382 -2.190 11.800 -0.488 1.00 0.00 C ATOM 100 CG LYS A 382 -2.813 11.569 -1.854 1.00 0.00 C ATOM 101 CD LYS A 382 -4.086 12.383 -2.029 1.00 0.00 C ATOM 102 CE LYS A 382 -4.783 12.052 -3.340 1.00 0.00 C ATOM 103 NZ LYS A 382 -5.354 13.266 -3.986 1.00 0.00 N ATOM 0 H LYS A 382 -2.997 13.081 1.461 1.00 0.00 H new ATOM 0 HA LYS A 382 -3.856 10.662 0.255 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -2.124 12.872 -0.305 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -1.171 11.414 -0.493 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -2.098 11.838 -2.632 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -3.037 10.510 -1.979 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -4.762 12.187 -1.197 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -3.846 13.446 -2.001 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -4.074 11.579 -4.019 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -5.579 11.330 -3.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -5.820 12.999 -4.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -6.050 13.704 -3.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -4.591 13.945 -4.185 1.00 0.00 H new ATOM 117 N ILE A 383 -0.995 10.501 1.924 1.00 0.00 N ATOM 118 CA ILE A 383 -0.091 9.575 2.597 1.00 0.00 C ATOM 119 C ILE A 383 -0.821 8.775 3.673 1.00 0.00 C ATOM 120 O ILE A 383 -0.609 7.569 3.810 1.00 0.00 O ATOM 121 CB ILE A 383 1.110 10.309 3.230 1.00 0.00 C ATOM 122 CG1 ILE A 383 0.632 11.474 4.098 1.00 0.00 C ATOM 123 CG2 ILE A 383 2.058 10.801 2.148 1.00 0.00 C ATOM 124 CD1 ILE A 383 0.690 11.184 5.583 1.00 0.00 C ATOM 0 H ILE A 383 -0.699 11.477 1.952 1.00 0.00 H new ATOM 0 HA ILE A 383 0.282 8.891 1.835 1.00 0.00 H new ATOM 0 HB ILE A 383 1.648 9.607 3.868 1.00 0.00 H new ATOM 0 HG12 ILE A 383 1.242 12.351 3.883 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -0.393 11.724 3.824 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.900 11.317 2.609 1.00 0.00 H new ATOM 0 HG22 ILE A 383 2.424 9.952 1.571 1.00 0.00 H new ATOM 0 HG23 ILE A 383 1.530 11.488 1.487 1.00 0.00 H new ATOM 0 HD11 ILE A 383 0.337 12.053 6.138 1.00 0.00 H new ATOM 0 HD12 ILE A 383 0.057 10.326 5.811 1.00 0.00 H new ATOM 0 HD13 ILE A 383 1.718 10.963 5.871 1.00 0.00 H new ATOM 136 N ILE A 384 -1.690 9.445 4.427 1.00 0.00 N ATOM 137 CA ILE A 384 -2.453 8.778 5.476 1.00 0.00 C ATOM 138 C ILE A 384 -3.334 7.686 4.877 1.00 0.00 C ATOM 139 O ILE A 384 -3.313 6.540 5.326 1.00 0.00 O ATOM 140 CB ILE A 384 -3.330 9.776 6.267 1.00 0.00 C ATOM 141 CG1 ILE A 384 -2.452 10.717 7.092 1.00 0.00 C ATOM 142 CG2 ILE A 384 -4.311 9.040 7.171 1.00 0.00 C ATOM 143 CD1 ILE A 384 -3.180 11.953 7.575 1.00 0.00 C ATOM 0 H ILE A 384 -1.882 10.442 4.331 1.00 0.00 H new ATOM 0 HA ILE A 384 -1.737 8.333 6.167 1.00 0.00 H new ATOM 0 HB ILE A 384 -3.903 10.366 5.552 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -2.062 10.175 7.953 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -1.595 11.021 6.491 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -4.916 9.764 7.717 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -4.960 8.408 6.565 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -3.760 8.421 7.879 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -2.497 12.575 8.153 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -3.547 12.517 6.718 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -4.021 11.658 8.202 1.00 0.00 H new ATOM 155 N HIS A 385 -4.101 8.048 3.852 1.00 0.00 N ATOM 156 CA HIS A 385 -4.982 7.094 3.185 1.00 0.00 C ATOM 157 C HIS A 385 -4.183 5.895 2.688 1.00 0.00 C ATOM 158 O HIS A 385 -4.641 4.755 2.762 1.00 0.00 O ATOM 159 CB HIS A 385 -5.703 7.764 2.014 1.00 0.00 C ATOM 160 CG HIS A 385 -6.901 7.004 1.537 1.00 0.00 C ATOM 161 ND1 HIS A 385 -7.050 5.699 1.209 1.00 0.00 N flip ATOM 162 CD2 HIS A 385 -8.137 7.588 1.346 1.00 0.00 C flip ATOM 163 CE1 HIS A 385 -8.358 5.520 0.832 1.00 0.00 C flip ATOM 164 NE2 HIS A 385 -8.992 6.673 0.923 1.00 0.00 N flip ATOM 0 H HIS A 385 -4.130 8.992 3.466 1.00 0.00 H new ATOM 0 HA HIS A 385 -5.725 6.749 3.904 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -6.013 8.765 2.313 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -5.004 7.881 1.186 1.00 0.00 H new ATOM 0 HD1 HIS A 385 -6.325 4.982 1.237 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -8.369 8.629 1.516 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -8.797 4.586 0.513 1.00 0.00 H new ATOM 173 N VAL A 386 -2.980 6.163 2.190 1.00 0.00 N ATOM 174 CA VAL A 386 -2.109 5.108 1.691 1.00 0.00 C ATOM 175 C VAL A 386 -1.691 4.178 2.822 1.00 0.00 C ATOM 176 O VAL A 386 -1.674 2.956 2.662 1.00 0.00 O ATOM 177 CB VAL A 386 -0.847 5.688 1.024 1.00 0.00 C ATOM 178 CG1 VAL A 386 -0.052 4.591 0.333 1.00 0.00 C ATOM 179 CG2 VAL A 386 -1.218 6.793 0.044 1.00 0.00 C ATOM 0 H VAL A 386 -2.587 7.102 2.122 1.00 0.00 H new ATOM 0 HA VAL A 386 -2.675 4.548 0.946 1.00 0.00 H new ATOM 0 HB VAL A 386 -0.217 6.122 1.800 1.00 0.00 H new ATOM 0 HG11 VAL A 386 0.835 5.022 -0.131 1.00 0.00 H new ATOM 0 HG12 VAL A 386 0.249 3.843 1.066 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -0.670 4.121 -0.432 1.00 0.00 H new ATOM 0 HG21 VAL A 386 -0.313 7.190 -0.417 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -1.872 6.389 -0.729 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -1.735 7.592 0.575 1.00 0.00 H new ATOM 189 N LEU A 387 -1.363 4.763 3.970 1.00 0.00 N ATOM 190 CA LEU A 387 -0.954 3.987 5.135 1.00 0.00 C ATOM 191 C LEU A 387 -2.065 3.034 5.557 1.00 0.00 C ATOM 192 O LEU A 387 -1.835 1.839 5.744 1.00 0.00 O ATOM 193 CB LEU A 387 -0.594 4.917 6.295 1.00 0.00 C ATOM 194 CG LEU A 387 0.834 5.468 6.267 1.00 0.00 C ATOM 195 CD1 LEU A 387 0.913 6.786 7.021 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.805 4.456 6.851 1.00 0.00 C ATOM 0 H LEU A 387 -1.373 5.772 4.118 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.074 3.402 4.866 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.290 5.756 6.297 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -0.741 4.378 7.231 1.00 0.00 H new ATOM 0 HG LEU A 387 1.113 5.652 5.229 1.00 0.00 H new ATOM 0 HD11 LEU A 387 1.936 7.162 6.990 1.00 0.00 H new ATOM 0 HD12 LEU A 387 0.245 7.512 6.556 1.00 0.00 H new ATOM 0 HD13 LEU A 387 0.615 6.630 8.058 1.00 0.00 H new ATOM 0 HD21 LEU A 387 2.816 4.864 6.823 1.00 0.00 H new ATOM 0 HD22 LEU A 387 1.529 4.240 7.883 1.00 0.00 H new ATOM 0 HD23 LEU A 387 1.768 3.537 6.266 1.00 0.00 H new ATOM 208 N GLU A 388 -3.275 3.568 5.694 1.00 0.00 N ATOM 209 CA GLU A 388 -4.426 2.762 6.084 1.00 0.00 C ATOM 210 C GLU A 388 -4.662 1.648 5.070 1.00 0.00 C ATOM 211 O GLU A 388 -4.902 0.496 5.438 1.00 0.00 O ATOM 212 CB GLU A 388 -5.674 3.638 6.202 1.00 0.00 C ATOM 213 CG GLU A 388 -5.898 4.194 7.600 1.00 0.00 C ATOM 214 CD GLU A 388 -5.969 5.708 7.623 1.00 0.00 C ATOM 215 OE1 GLU A 388 -6.932 6.267 7.057 1.00 0.00 O ATOM 216 OE2 GLU A 388 -5.060 6.338 8.205 1.00 0.00 O ATOM 0 H GLU A 388 -3.483 4.555 5.541 1.00 0.00 H new ATOM 0 HA GLU A 388 -4.220 2.313 7.056 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.593 4.467 5.499 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.546 3.054 5.908 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -6.823 3.785 8.005 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -5.090 3.862 8.252 1.00 0.00 H new ATOM 223 N LYS A 389 -4.583 1.998 3.789 1.00 0.00 N ATOM 224 CA LYS A 389 -4.777 1.030 2.717 1.00 0.00 C ATOM 225 C LYS A 389 -3.806 -0.134 2.870 1.00 0.00 C ATOM 226 O LYS A 389 -4.195 -1.299 2.771 1.00 0.00 O ATOM 227 CB LYS A 389 -4.590 1.699 1.353 1.00 0.00 C ATOM 228 CG LYS A 389 -5.711 1.399 0.369 1.00 0.00 C ATOM 229 CD LYS A 389 -5.919 -0.099 0.195 1.00 0.00 C ATOM 230 CE LYS A 389 -7.238 -0.554 0.798 1.00 0.00 C ATOM 231 NZ LYS A 389 -8.405 -0.079 0.006 1.00 0.00 N ATOM 0 H LYS A 389 -4.386 2.946 3.469 1.00 0.00 H new ATOM 0 HA LYS A 389 -5.795 0.645 2.780 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -4.520 2.778 1.493 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -3.643 1.371 0.924 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -6.636 1.857 0.720 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -5.479 1.849 -0.596 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -5.898 -0.349 -0.866 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -5.097 -0.638 0.666 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -7.256 -1.642 0.853 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -7.317 -0.182 1.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -9.234 0.008 0.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -8.187 0.848 -0.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -8.611 -0.761 -0.752 1.00 0.00 H new ATOM 245 N VAL A 390 -2.540 0.188 3.124 1.00 0.00 N ATOM 246 CA VAL A 390 -1.518 -0.834 3.305 1.00 0.00 C ATOM 247 C VAL A 390 -1.823 -1.676 4.537 1.00 0.00 C ATOM 248 O VAL A 390 -1.624 -2.889 4.536 1.00 0.00 O ATOM 249 CB VAL A 390 -0.114 -0.216 3.443 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.939 -1.305 3.582 1.00 0.00 C ATOM 251 CG2 VAL A 390 0.193 0.681 2.253 1.00 0.00 C ATOM 0 H VAL A 390 -2.200 1.146 3.209 1.00 0.00 H new ATOM 0 HA VAL A 390 -1.529 -1.465 2.416 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.094 0.394 4.346 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.924 -0.848 3.678 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.728 -1.904 4.468 1.00 0.00 H new ATOM 0 HG13 VAL A 390 0.920 -1.944 2.699 1.00 0.00 H new ATOM 0 HG21 VAL A 390 1.189 1.109 2.367 1.00 0.00 H new ATOM 0 HG22 VAL A 390 0.153 0.094 1.335 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -0.543 1.483 2.203 1.00 0.00 H new ATOM 261 N GLN A 391 -2.319 -1.024 5.585 1.00 0.00 N ATOM 262 CA GLN A 391 -2.666 -1.721 6.819 1.00 0.00 C ATOM 263 C GLN A 391 -3.655 -2.840 6.523 1.00 0.00 C ATOM 264 O GLN A 391 -3.381 -4.015 6.784 1.00 0.00 O ATOM 265 CB GLN A 391 -3.267 -0.746 7.833 1.00 0.00 C ATOM 266 CG GLN A 391 -2.889 -1.053 9.273 1.00 0.00 C ATOM 267 CD GLN A 391 -1.672 -0.275 9.735 1.00 0.00 C ATOM 268 OE1 GLN A 391 -1.695 0.954 9.798 1.00 0.00 O ATOM 269 NE2 GLN A 391 -0.601 -0.989 10.061 1.00 0.00 N ATOM 0 H GLN A 391 -2.489 -0.018 5.604 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.759 -2.150 7.244 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -2.941 0.265 7.589 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -4.353 -0.762 7.740 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -3.732 -0.821 9.923 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -2.693 -2.120 9.374 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -0.626 -2.006 9.994 1.00 0.00 H new ATOM 0 HE22 GLN A 391 0.247 -0.520 10.379 1.00 0.00 H new ATOM 278 N TYR A 392 -4.799 -2.472 5.954 1.00 0.00 N ATOM 279 CA TYR A 392 -5.819 -3.448 5.598 1.00 0.00 C ATOM 280 C TYR A 392 -5.247 -4.461 4.613 1.00 0.00 C ATOM 281 O TYR A 392 -5.470 -5.665 4.741 1.00 0.00 O ATOM 282 CB TYR A 392 -7.039 -2.751 4.991 1.00 0.00 C ATOM 283 CG TYR A 392 -7.473 -1.519 5.753 1.00 0.00 C ATOM 284 CD1 TYR A 392 -7.768 -1.586 7.108 1.00 0.00 C ATOM 285 CD2 TYR A 392 -7.588 -0.290 5.115 1.00 0.00 C ATOM 286 CE1 TYR A 392 -8.165 -0.462 7.808 1.00 0.00 C ATOM 287 CE2 TYR A 392 -7.984 0.839 5.809 1.00 0.00 C ATOM 288 CZ TYR A 392 -8.271 0.747 7.154 1.00 0.00 C ATOM 289 OH TYR A 392 -8.667 1.867 7.848 1.00 0.00 O ATOM 0 H TYR A 392 -5.041 -1.507 5.731 1.00 0.00 H new ATOM 0 HA TYR A 392 -6.134 -3.970 6.501 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -6.813 -2.471 3.962 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -7.869 -3.456 4.954 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -7.686 -2.531 7.623 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.365 -0.215 4.061 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -8.391 -0.531 8.862 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.068 1.788 5.300 1.00 0.00 H new ATOM 0 HH TYR A 392 -8.690 2.637 7.242 1.00 0.00 H new ATOM 299 N LEU A 393 -4.491 -3.958 3.640 1.00 0.00 N ATOM 300 CA LEU A 393 -3.862 -4.810 2.638 1.00 0.00 C ATOM 301 C LEU A 393 -2.999 -5.868 3.314 1.00 0.00 C ATOM 302 O LEU A 393 -3.266 -7.065 3.206 1.00 0.00 O ATOM 303 CB LEU A 393 -3.010 -3.966 1.687 1.00 0.00 C ATOM 304 CG LEU A 393 -3.686 -3.598 0.365 1.00 0.00 C ATOM 305 CD1 LEU A 393 -3.306 -2.185 -0.055 1.00 0.00 C ATOM 306 CD2 LEU A 393 -3.313 -4.598 -0.719 1.00 0.00 C ATOM 0 H LEU A 393 -4.300 -2.963 3.525 1.00 0.00 H new ATOM 0 HA LEU A 393 -4.643 -5.308 2.063 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -2.723 -3.047 2.199 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.091 -4.509 1.468 1.00 0.00 H new ATOM 0 HG LEU A 393 -4.766 -3.633 0.508 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -3.796 -1.941 -0.997 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -3.624 -1.479 0.713 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -2.225 -2.121 -0.181 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -3.802 -4.322 -1.653 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -2.232 -4.595 -0.861 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -3.637 -5.595 -0.421 1.00 0.00 H new ATOM 318 N GLU A 394 -1.968 -5.412 4.025 1.00 0.00 N ATOM 319 CA GLU A 394 -1.067 -6.310 4.740 1.00 0.00 C ATOM 320 C GLU A 394 -1.861 -7.357 5.514 1.00 0.00 C ATOM 321 O GLU A 394 -1.542 -8.546 5.482 1.00 0.00 O ATOM 322 CB GLU A 394 -0.176 -5.518 5.700 1.00 0.00 C ATOM 323 CG GLU A 394 0.936 -6.347 6.321 1.00 0.00 C ATOM 324 CD GLU A 394 0.626 -6.766 7.745 1.00 0.00 C ATOM 325 OE1 GLU A 394 0.757 -5.922 8.654 1.00 0.00 O ATOM 326 OE2 GLU A 394 0.251 -7.941 7.948 1.00 0.00 O ATOM 0 H GLU A 394 -1.737 -4.423 4.120 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.437 -6.816 4.009 1.00 0.00 H new ATOM 0 HB2 GLU A 394 0.265 -4.678 5.164 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -0.794 -5.100 6.495 1.00 0.00 H new ATOM 0 HG2 GLU A 394 1.104 -7.236 5.713 1.00 0.00 H new ATOM 0 HG3 GLU A 394 1.862 -5.773 6.309 1.00 0.00 H new ATOM 333 N GLN A 395 -2.913 -6.908 6.196 1.00 0.00 N ATOM 334 CA GLN A 395 -3.765 -7.812 6.959 1.00 0.00 C ATOM 335 C GLN A 395 -4.296 -8.916 6.052 1.00 0.00 C ATOM 336 O GLN A 395 -4.252 -10.099 6.397 1.00 0.00 O ATOM 337 CB GLN A 395 -4.928 -7.045 7.590 1.00 0.00 C ATOM 338 CG GLN A 395 -5.313 -7.550 8.970 1.00 0.00 C ATOM 339 CD GLN A 395 -6.505 -8.486 8.936 1.00 0.00 C ATOM 340 OE1 GLN A 395 -6.890 -8.983 7.877 1.00 0.00 O ATOM 341 NE2 GLN A 395 -7.097 -8.733 10.100 1.00 0.00 N ATOM 0 H GLN A 395 -3.193 -5.928 6.235 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.173 -8.261 7.756 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -4.661 -5.990 7.660 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.795 -7.112 6.933 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -4.462 -8.067 9.414 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -5.541 -6.700 9.613 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -6.745 -8.300 10.953 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -7.904 -9.356 10.140 1.00 0.00 H new ATOM 350 N GLU A 396 -4.775 -8.520 4.876 1.00 0.00 N ATOM 351 CA GLU A 396 -5.294 -9.474 3.905 1.00 0.00 C ATOM 352 C GLU A 396 -4.191 -10.437 3.485 1.00 0.00 C ATOM 353 O GLU A 396 -4.432 -11.624 3.282 1.00 0.00 O ATOM 354 CB GLU A 396 -5.852 -8.754 2.675 1.00 0.00 C ATOM 355 CG GLU A 396 -6.585 -7.464 2.999 1.00 0.00 C ATOM 356 CD GLU A 396 -7.840 -7.281 2.168 1.00 0.00 C ATOM 357 OE1 GLU A 396 -8.507 -8.295 1.869 1.00 0.00 O ATOM 358 OE2 GLU A 396 -8.157 -6.125 1.817 1.00 0.00 O ATOM 0 H GLU A 396 -4.814 -7.546 4.574 1.00 0.00 H new ATOM 0 HA GLU A 396 -6.105 -10.033 4.373 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -5.032 -8.533 1.992 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -6.532 -9.425 2.150 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -6.850 -7.457 4.056 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -5.917 -6.619 2.832 1.00 0.00 H new ATOM 365 N VAL A 397 -2.973 -9.912 3.371 1.00 0.00 N ATOM 366 CA VAL A 397 -1.825 -10.726 2.991 1.00 0.00 C ATOM 367 C VAL A 397 -1.617 -11.848 4.000 1.00 0.00 C ATOM 368 O VAL A 397 -1.442 -13.009 3.629 1.00 0.00 O ATOM 369 CB VAL A 397 -0.537 -9.884 2.896 1.00 0.00 C ATOM 370 CG1 VAL A 397 0.641 -10.746 2.466 1.00 0.00 C ATOM 371 CG2 VAL A 397 -0.728 -8.718 1.939 1.00 0.00 C ATOM 0 H VAL A 397 -2.758 -8.929 3.536 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.036 -11.146 2.007 1.00 0.00 H new ATOM 0 HB VAL A 397 -0.320 -9.482 3.885 1.00 0.00 H new ATOM 0 HG11 VAL A 397 1.539 -10.131 2.406 1.00 0.00 H new ATOM 0 HG12 VAL A 397 0.795 -11.542 3.195 1.00 0.00 H new ATOM 0 HG13 VAL A 397 0.434 -11.183 1.489 1.00 0.00 H new ATOM 0 HG21 VAL A 397 0.192 -8.136 1.886 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -0.975 -9.098 0.948 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -1.539 -8.083 2.296 1.00 0.00 H new ATOM 381 N GLU A 398 -1.646 -11.493 5.280 1.00 0.00 N ATOM 382 CA GLU A 398 -1.471 -12.469 6.347 1.00 0.00 C ATOM 383 C GLU A 398 -2.590 -13.505 6.306 1.00 0.00 C ATOM 384 O GLU A 398 -2.349 -14.701 6.470 1.00 0.00 O ATOM 385 CB GLU A 398 -1.449 -11.774 7.710 1.00 0.00 C ATOM 386 CG GLU A 398 -0.170 -10.998 7.977 1.00 0.00 C ATOM 387 CD GLU A 398 0.786 -11.748 8.884 1.00 0.00 C ATOM 388 OE1 GLU A 398 0.900 -12.983 8.737 1.00 0.00 O ATOM 389 OE2 GLU A 398 1.423 -11.099 9.741 1.00 0.00 O ATOM 0 H GLU A 398 -1.789 -10.536 5.603 1.00 0.00 H new ATOM 0 HA GLU A 398 -0.517 -12.975 6.198 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -2.297 -11.093 7.775 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -1.580 -12.522 8.492 1.00 0.00 H new ATOM 0 HG2 GLU A 398 0.325 -10.784 7.030 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -0.419 -10.039 8.431 1.00 0.00 H new ATOM 396 N GLU A 399 -3.812 -13.034 6.082 1.00 0.00 N ATOM 397 CA GLU A 399 -4.971 -13.918 6.012 1.00 0.00 C ATOM 398 C GLU A 399 -5.056 -14.613 4.651 1.00 0.00 C ATOM 399 O GLU A 399 -5.833 -15.551 4.473 1.00 0.00 O ATOM 400 CB GLU A 399 -6.256 -13.129 6.275 1.00 0.00 C ATOM 401 CG GLU A 399 -6.676 -13.122 7.734 1.00 0.00 C ATOM 402 CD GLU A 399 -7.192 -11.770 8.186 1.00 0.00 C ATOM 403 OE1 GLU A 399 -8.148 -11.261 7.564 1.00 0.00 O ATOM 404 OE2 GLU A 399 -6.639 -11.219 9.161 1.00 0.00 O ATOM 0 H GLU A 399 -4.026 -12.046 5.946 1.00 0.00 H new ATOM 0 HA GLU A 399 -4.855 -14.683 6.780 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -6.116 -12.101 5.941 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -7.062 -13.552 5.675 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -7.451 -13.873 7.889 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -5.827 -13.408 8.354 1.00 0.00 H new ATOM 411 N PHE A 400 -4.255 -14.144 3.692 1.00 0.00 N ATOM 412 CA PHE A 400 -4.241 -14.719 2.348 1.00 0.00 C ATOM 413 C PHE A 400 -4.192 -16.243 2.399 1.00 0.00 C ATOM 414 O PHE A 400 -3.294 -16.827 3.007 1.00 0.00 O ATOM 415 CB PHE A 400 -3.043 -14.181 1.558 1.00 0.00 C ATOM 416 CG PHE A 400 -2.954 -14.708 0.152 1.00 0.00 C ATOM 417 CD1 PHE A 400 -3.791 -14.222 -0.843 1.00 0.00 C ATOM 418 CD2 PHE A 400 -2.032 -15.690 -0.176 1.00 0.00 C ATOM 419 CE1 PHE A 400 -3.708 -14.708 -2.132 1.00 0.00 C ATOM 420 CE2 PHE A 400 -1.946 -16.178 -1.465 1.00 0.00 C ATOM 421 CZ PHE A 400 -2.785 -15.686 -2.445 1.00 0.00 C ATOM 0 H PHE A 400 -3.607 -13.367 3.823 1.00 0.00 H new ATOM 0 HA PHE A 400 -5.164 -14.427 1.846 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -3.101 -13.093 1.525 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -2.126 -14.435 2.090 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -4.514 -13.456 -0.606 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.373 -16.078 0.586 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -4.366 -14.323 -2.897 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -1.223 -16.944 -1.706 1.00 0.00 H new ATOM 0 HZ PHE A 400 -2.719 -16.065 -3.454 1.00 0.00 H new ATOM 431 N VAL A 401 -5.172 -16.882 1.761 1.00 0.00 N ATOM 432 CA VAL A 401 -5.254 -18.340 1.730 1.00 0.00 C ATOM 433 C VAL A 401 -3.896 -18.969 1.422 1.00 0.00 C ATOM 434 O VAL A 401 -3.502 -19.957 2.041 1.00 0.00 O ATOM 435 CB VAL A 401 -6.282 -18.815 0.686 1.00 0.00 C ATOM 436 CG1 VAL A 401 -5.913 -18.303 -0.699 1.00 0.00 C ATOM 437 CG2 VAL A 401 -6.396 -20.332 0.691 1.00 0.00 C ATOM 0 H VAL A 401 -5.923 -16.410 1.257 1.00 0.00 H new ATOM 0 HA VAL A 401 -5.574 -18.661 2.721 1.00 0.00 H new ATOM 0 HB VAL A 401 -7.256 -18.404 0.953 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -6.651 -18.649 -1.423 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -5.895 -17.213 -0.691 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -4.928 -18.680 -0.976 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -7.128 -20.644 -0.054 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -5.427 -20.770 0.454 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -6.715 -20.670 1.677 1.00 0.00 H new ATOM 447 N GLY A 402 -3.186 -18.386 0.462 1.00 0.00 N ATOM 448 CA GLY A 402 -1.880 -18.899 0.089 1.00 0.00 C ATOM 449 C GLY A 402 -1.834 -19.400 -1.342 1.00 0.00 C ATOM 450 O GLY A 402 -0.939 -20.161 -1.709 1.00 0.00 O ATOM 0 H GLY A 402 -3.491 -17.568 -0.065 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -1.135 -18.114 0.219 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -1.607 -19.711 0.763 1.00 0.00 H new ATOM 454 N LYS A 403 -2.798 -18.975 -2.152 1.00 0.00 N ATOM 455 CA LYS A 403 -2.857 -19.389 -3.548 1.00 0.00 C ATOM 456 C LYS A 403 -3.455 -18.289 -4.417 1.00 0.00 C ATOM 457 O LYS A 403 -4.310 -17.524 -3.968 1.00 0.00 O ATOM 458 CB LYS A 403 -3.679 -20.671 -3.690 1.00 0.00 C ATOM 459 CG LYS A 403 -3.162 -21.610 -4.766 1.00 0.00 C ATOM 460 CD LYS A 403 -1.760 -22.103 -4.450 1.00 0.00 C ATOM 461 CE LYS A 403 -1.554 -23.536 -4.915 1.00 0.00 C ATOM 462 NZ LYS A 403 -1.019 -23.598 -6.303 1.00 0.00 N ATOM 0 H LYS A 403 -3.548 -18.345 -1.866 1.00 0.00 H new ATOM 0 HA LYS A 403 -1.839 -19.581 -3.886 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -3.686 -21.196 -2.735 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -4.712 -20.407 -3.916 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -3.835 -22.462 -4.861 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -3.160 -21.097 -5.728 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -1.028 -21.455 -4.932 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -1.584 -22.039 -3.376 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -0.866 -24.042 -4.238 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -2.501 -24.073 -4.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -0.893 -24.592 -6.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -1.687 -23.138 -6.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -0.103 -23.108 -6.344 1.00 0.00 H new ATOM 476 N LYS A 404 -3.001 -18.212 -5.663 1.00 0.00 N ATOM 477 CA LYS A 404 -3.491 -17.204 -6.598 1.00 0.00 C ATOM 478 C LYS A 404 -4.771 -17.671 -7.287 1.00 0.00 C ATOM 479 O LYS A 404 -4.856 -17.687 -8.515 1.00 0.00 O ATOM 480 CB LYS A 404 -2.418 -16.887 -7.642 1.00 0.00 C ATOM 481 CG LYS A 404 -2.663 -15.589 -8.393 1.00 0.00 C ATOM 482 CD LYS A 404 -2.368 -15.733 -9.879 1.00 0.00 C ATOM 483 CE LYS A 404 -1.388 -14.675 -10.361 1.00 0.00 C ATOM 484 NZ LYS A 404 -1.760 -13.316 -9.884 1.00 0.00 N ATOM 0 H LYS A 404 -2.293 -18.836 -6.050 1.00 0.00 H new ATOM 0 HA LYS A 404 -3.718 -16.300 -6.033 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -1.448 -16.834 -7.148 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -2.367 -17.707 -8.358 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -3.699 -15.280 -8.256 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -2.037 -14.802 -7.973 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -1.959 -16.724 -10.075 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -3.297 -15.654 -10.444 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -0.386 -14.921 -10.010 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -1.354 -14.681 -11.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -1.413 -12.604 -10.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -2.795 -13.246 -9.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -1.333 -13.146 -8.951 1.00 0.00 H new ATOM 498 N THR A 405 -5.763 -18.051 -6.489 1.00 0.00 N ATOM 499 CA THR A 405 -7.037 -18.519 -7.023 1.00 0.00 C ATOM 500 C THR A 405 -8.209 -17.753 -6.412 1.00 0.00 C ATOM 501 O THR A 405 -9.238 -17.557 -7.062 1.00 0.00 O ATOM 502 CB THR A 405 -7.203 -20.018 -6.761 1.00 0.00 C ATOM 503 OG1 THR A 405 -6.009 -20.714 -7.069 1.00 0.00 O ATOM 504 CG2 THR A 405 -8.322 -20.644 -7.564 1.00 0.00 C ATOM 0 H THR A 405 -5.710 -18.044 -5.470 1.00 0.00 H new ATOM 0 HA THR A 405 -7.035 -18.339 -8.098 1.00 0.00 H new ATOM 0 HB THR A 405 -7.447 -20.103 -5.702 1.00 0.00 H new ATOM 0 HG1 THR A 405 -6.133 -21.670 -6.894 1.00 0.00 H new ATOM 0 HG21 THR A 405 -8.386 -21.707 -7.332 1.00 0.00 H new ATOM 0 HG22 THR A 405 -9.266 -20.160 -7.312 1.00 0.00 H new ATOM 0 HG23 THR A 405 -8.122 -20.517 -8.628 1.00 0.00 H new ATOM 512 N ASP A 406 -8.052 -17.323 -5.165 1.00 0.00 N ATOM 513 CA ASP A 406 -9.099 -16.580 -4.474 1.00 0.00 C ATOM 514 C ASP A 406 -9.100 -15.115 -4.899 1.00 0.00 C ATOM 515 O ASP A 406 -8.233 -14.677 -5.653 1.00 0.00 O ATOM 516 CB ASP A 406 -8.915 -16.686 -2.960 1.00 0.00 C ATOM 517 CG ASP A 406 -10.232 -16.635 -2.210 1.00 0.00 C ATOM 518 OD1 ASP A 406 -10.774 -15.524 -2.036 1.00 0.00 O ATOM 519 OD2 ASP A 406 -10.721 -17.708 -1.799 1.00 0.00 O ATOM 0 H ASP A 406 -7.209 -17.476 -4.612 1.00 0.00 H new ATOM 0 HA ASP A 406 -10.059 -17.017 -4.747 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -8.402 -17.618 -2.724 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -8.274 -15.874 -2.617 1.00 0.00 H new ATOM 524 N LYS A 407 -10.082 -14.364 -4.409 1.00 0.00 N ATOM 525 CA LYS A 407 -10.197 -12.947 -4.738 1.00 0.00 C ATOM 526 C LYS A 407 -9.196 -12.110 -3.943 1.00 0.00 C ATOM 527 O LYS A 407 -8.929 -10.958 -4.288 1.00 0.00 O ATOM 528 CB LYS A 407 -11.620 -12.452 -4.469 1.00 0.00 C ATOM 529 CG LYS A 407 -12.153 -12.844 -3.101 1.00 0.00 C ATOM 530 CD LYS A 407 -13.179 -13.961 -3.200 1.00 0.00 C ATOM 531 CE LYS A 407 -14.432 -13.504 -3.928 1.00 0.00 C ATOM 532 NZ LYS A 407 -15.524 -13.142 -2.983 1.00 0.00 N ATOM 0 H LYS A 407 -10.809 -14.712 -3.784 1.00 0.00 H new ATOM 0 HA LYS A 407 -9.972 -12.832 -5.798 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -11.641 -11.366 -4.560 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -12.285 -12.849 -5.236 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -11.327 -13.163 -2.466 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -12.605 -11.975 -2.623 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -12.743 -14.812 -3.724 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -13.443 -14.304 -2.199 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -14.194 -12.644 -4.554 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -14.775 -14.297 -4.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -16.360 -12.836 -3.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -15.769 -13.969 -2.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -15.206 -12.368 -2.366 1.00 0.00 H new ATOM 546 N ALA A 408 -8.647 -12.693 -2.880 1.00 0.00 N ATOM 547 CA ALA A 408 -7.678 -11.997 -2.040 1.00 0.00 C ATOM 548 C ALA A 408 -6.562 -11.377 -2.875 1.00 0.00 C ATOM 549 O ALA A 408 -6.432 -10.155 -2.943 1.00 0.00 O ATOM 550 CB ALA A 408 -7.098 -12.952 -1.008 1.00 0.00 C ATOM 0 H ALA A 408 -8.857 -13.645 -2.581 1.00 0.00 H new ATOM 0 HA ALA A 408 -8.197 -11.189 -1.525 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -6.376 -12.422 -0.387 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -7.900 -13.341 -0.381 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -6.601 -13.779 -1.516 1.00 0.00 H new ATOM 556 N TYR A 409 -5.757 -12.224 -3.507 1.00 0.00 N ATOM 557 CA TYR A 409 -4.647 -11.757 -4.333 1.00 0.00 C ATOM 558 C TYR A 409 -5.102 -10.680 -5.317 1.00 0.00 C ATOM 559 O TYR A 409 -4.405 -9.686 -5.528 1.00 0.00 O ATOM 560 CB TYR A 409 -4.017 -12.925 -5.091 1.00 0.00 C ATOM 561 CG TYR A 409 -2.510 -12.848 -5.170 1.00 0.00 C ATOM 562 CD1 TYR A 409 -1.743 -12.715 -4.020 1.00 0.00 C ATOM 563 CD2 TYR A 409 -1.854 -12.905 -6.393 1.00 0.00 C ATOM 564 CE1 TYR A 409 -0.364 -12.641 -4.086 1.00 0.00 C ATOM 565 CE2 TYR A 409 -0.477 -12.834 -6.468 1.00 0.00 C ATOM 566 CZ TYR A 409 0.265 -12.701 -5.312 1.00 0.00 C ATOM 567 OH TYR A 409 1.636 -12.630 -5.383 1.00 0.00 O ATOM 0 H TYR A 409 -5.852 -13.239 -3.464 1.00 0.00 H new ATOM 0 HA TYR A 409 -3.901 -11.319 -3.670 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.300 -13.859 -4.605 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -4.425 -12.955 -6.101 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -2.232 -12.669 -3.058 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -2.431 -13.007 -7.301 1.00 0.00 H new ATOM 0 HE1 TYR A 409 0.218 -12.537 -3.182 1.00 0.00 H new ATOM 0 HE2 TYR A 409 0.017 -12.882 -7.427 1.00 0.00 H new ATOM 0 HH TYR A 409 1.895 -11.899 -5.982 1.00 0.00 H new ATOM 577 N TRP A 410 -6.276 -10.879 -5.911 1.00 0.00 N ATOM 578 CA TRP A 410 -6.816 -9.913 -6.864 1.00 0.00 C ATOM 579 C TRP A 410 -6.876 -8.526 -6.238 1.00 0.00 C ATOM 580 O TRP A 410 -6.179 -7.607 -6.670 1.00 0.00 O ATOM 581 CB TRP A 410 -8.217 -10.328 -7.319 1.00 0.00 C ATOM 582 CG TRP A 410 -8.280 -11.696 -7.923 1.00 0.00 C ATOM 583 CD1 TRP A 410 -7.230 -12.467 -8.335 1.00 0.00 C ATOM 584 CD2 TRP A 410 -9.463 -12.455 -8.183 1.00 0.00 C ATOM 585 NE1 TRP A 410 -7.691 -13.661 -8.836 1.00 0.00 N ATOM 586 CE2 TRP A 410 -9.059 -13.678 -8.752 1.00 0.00 C ATOM 587 CE3 TRP A 410 -10.826 -12.218 -7.988 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -9.974 -14.659 -9.129 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -11.731 -13.194 -8.359 1.00 0.00 C ATOM 590 CH2 TRP A 410 -11.302 -14.401 -8.924 1.00 0.00 C ATOM 0 H TRP A 410 -6.868 -11.694 -5.751 1.00 0.00 H new ATOM 0 HA TRP A 410 -6.155 -9.888 -7.730 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -8.892 -10.288 -6.464 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -8.581 -9.603 -8.047 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -6.190 -12.180 -8.276 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -7.110 -14.412 -9.209 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -11.166 -11.289 -7.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -9.647 -15.590 -9.568 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -12.787 -13.023 -8.211 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -12.034 -15.144 -9.204 1.00 0.00 H new ATOM 601 N LEU A 411 -7.710 -8.385 -5.212 1.00 0.00 N ATOM 602 CA LEU A 411 -7.851 -7.111 -4.523 1.00 0.00 C ATOM 603 C LEU A 411 -6.538 -6.712 -3.868 1.00 0.00 C ATOM 604 O LEU A 411 -6.234 -5.530 -3.737 1.00 0.00 O ATOM 605 CB LEU A 411 -8.956 -7.184 -3.469 1.00 0.00 C ATOM 606 CG LEU A 411 -8.833 -8.335 -2.472 1.00 0.00 C ATOM 607 CD1 LEU A 411 -7.847 -7.983 -1.366 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.194 -8.672 -1.887 1.00 0.00 C ATOM 0 H LEU A 411 -8.295 -9.134 -4.842 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.122 -6.356 -5.261 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -8.969 -6.245 -2.915 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -9.916 -7.267 -3.978 1.00 0.00 H new ATOM 0 HG LEU A 411 -8.455 -9.211 -2.999 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -7.773 -8.815 -0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -6.867 -7.787 -1.801 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -8.194 -7.095 -0.838 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.092 -9.494 -1.178 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -10.596 -7.798 -1.374 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -10.872 -8.966 -2.688 1.00 0.00 H new ATOM 620 N LEU A 412 -5.757 -7.707 -3.461 1.00 0.00 N ATOM 621 CA LEU A 412 -4.470 -7.454 -2.826 1.00 0.00 C ATOM 622 C LEU A 412 -3.614 -6.546 -3.703 1.00 0.00 C ATOM 623 O LEU A 412 -3.401 -5.374 -3.383 1.00 0.00 O ATOM 624 CB LEU A 412 -3.735 -8.773 -2.572 1.00 0.00 C ATOM 625 CG LEU A 412 -4.113 -9.498 -1.278 1.00 0.00 C ATOM 626 CD1 LEU A 412 -3.504 -10.893 -1.246 1.00 0.00 C ATOM 627 CD2 LEU A 412 -3.670 -8.688 -0.070 1.00 0.00 C ATOM 0 H LEU A 412 -5.993 -8.694 -3.560 1.00 0.00 H new ATOM 0 HA LEU A 412 -4.648 -6.958 -1.872 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -3.924 -9.442 -3.412 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -2.663 -8.575 -2.557 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.197 -9.602 -1.244 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -3.785 -11.391 -0.318 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -3.873 -11.470 -2.094 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -2.418 -10.817 -1.303 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -3.946 -9.216 0.843 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -2.589 -8.553 -0.099 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -4.158 -7.713 -0.087 1.00 0.00 H new ATOM 639 N GLU A 413 -3.131 -7.094 -4.813 1.00 0.00 N ATOM 640 CA GLU A 413 -2.299 -6.339 -5.743 1.00 0.00 C ATOM 641 C GLU A 413 -3.054 -5.139 -6.304 1.00 0.00 C ATOM 642 O GLU A 413 -2.511 -4.038 -6.386 1.00 0.00 O ATOM 643 CB GLU A 413 -1.832 -7.242 -6.886 1.00 0.00 C ATOM 644 CG GLU A 413 -0.640 -8.114 -6.525 1.00 0.00 C ATOM 645 CD GLU A 413 -0.672 -9.462 -7.218 1.00 0.00 C ATOM 646 OE1 GLU A 413 -1.782 -9.942 -7.530 1.00 0.00 O ATOM 647 OE2 GLU A 413 0.413 -10.038 -7.448 1.00 0.00 O ATOM 0 H GLU A 413 -3.302 -8.060 -5.091 1.00 0.00 H new ATOM 0 HA GLU A 413 -1.430 -5.972 -5.197 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -2.659 -7.881 -7.194 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -1.572 -6.622 -7.744 1.00 0.00 H new ATOM 0 HG2 GLU A 413 0.280 -7.594 -6.792 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -0.619 -8.265 -5.446 1.00 0.00 H new ATOM 654 N GLU A 414 -4.305 -5.361 -6.695 1.00 0.00 N ATOM 655 CA GLU A 414 -5.132 -4.297 -7.255 1.00 0.00 C ATOM 656 C GLU A 414 -5.254 -3.122 -6.288 1.00 0.00 C ATOM 657 O GLU A 414 -5.147 -1.963 -6.686 1.00 0.00 O ATOM 658 CB GLU A 414 -6.523 -4.833 -7.599 1.00 0.00 C ATOM 659 CG GLU A 414 -6.555 -5.670 -8.868 1.00 0.00 C ATOM 660 CD GLU A 414 -6.431 -4.830 -10.124 1.00 0.00 C ATOM 661 OE1 GLU A 414 -7.463 -4.297 -10.584 1.00 0.00 O ATOM 662 OE2 GLU A 414 -5.304 -4.703 -10.646 1.00 0.00 O ATOM 0 H GLU A 414 -4.768 -6.268 -6.635 1.00 0.00 H new ATOM 0 HA GLU A 414 -4.647 -3.941 -8.164 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -6.887 -5.435 -6.767 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -7.210 -3.994 -7.710 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -5.743 -6.397 -8.840 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -7.487 -6.234 -8.903 1.00 0.00 H new ATOM 669 N MET A 415 -5.484 -3.430 -5.015 1.00 0.00 N ATOM 670 CA MET A 415 -5.626 -2.398 -3.994 1.00 0.00 C ATOM 671 C MET A 415 -4.325 -1.624 -3.808 1.00 0.00 C ATOM 672 O MET A 415 -4.303 -0.398 -3.921 1.00 0.00 O ATOM 673 CB MET A 415 -6.062 -3.020 -2.665 1.00 0.00 C ATOM 674 CG MET A 415 -7.541 -3.368 -2.613 1.00 0.00 C ATOM 675 SD MET A 415 -7.992 -4.265 -1.116 1.00 0.00 S ATOM 676 CE MET A 415 -9.618 -3.587 -0.790 1.00 0.00 C ATOM 0 H MET A 415 -5.576 -4.384 -4.667 1.00 0.00 H new ATOM 0 HA MET A 415 -6.393 -1.699 -4.328 1.00 0.00 H new ATOM 0 HB2 MET A 415 -5.478 -3.923 -2.487 1.00 0.00 H new ATOM 0 HB3 MET A 415 -5.832 -2.327 -1.856 1.00 0.00 H new ATOM 0 HG2 MET A 415 -8.128 -2.452 -2.673 1.00 0.00 H new ATOM 0 HG3 MET A 415 -7.799 -3.970 -3.484 1.00 0.00 H new ATOM 0 HE1 MET A 415 -10.225 -4.330 -0.272 1.00 0.00 H new ATOM 0 HE2 MET A 415 -9.523 -2.698 -0.167 1.00 0.00 H new ATOM 0 HE3 MET A 415 -10.097 -3.320 -1.732 1.00 0.00 H new ATOM 686 N LEU A 416 -3.240 -2.339 -3.520 1.00 0.00 N ATOM 687 CA LEU A 416 -1.945 -1.695 -3.318 1.00 0.00 C ATOM 688 C LEU A 416 -1.520 -0.913 -4.560 1.00 0.00 C ATOM 689 O LEU A 416 -1.012 0.204 -4.452 1.00 0.00 O ATOM 690 CB LEU A 416 -0.871 -2.723 -2.946 1.00 0.00 C ATOM 691 CG LEU A 416 -0.884 -4.021 -3.758 1.00 0.00 C ATOM 692 CD1 LEU A 416 0.217 -4.007 -4.809 1.00 0.00 C ATOM 693 CD2 LEU A 416 -0.728 -5.224 -2.837 1.00 0.00 C ATOM 0 H LEU A 416 -3.231 -3.354 -3.422 1.00 0.00 H new ATOM 0 HA LEU A 416 -2.053 -0.994 -2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 416 0.107 -2.256 -3.058 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -0.985 -2.975 -1.892 1.00 0.00 H new ATOM 0 HG LEU A 416 -1.844 -4.098 -4.269 1.00 0.00 H new ATOM 0 HD11 LEU A 416 0.191 -4.938 -5.375 1.00 0.00 H new ATOM 0 HD12 LEU A 416 0.064 -3.166 -5.485 1.00 0.00 H new ATOM 0 HD13 LEU A 416 1.186 -3.907 -4.320 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.739 -6.139 -3.429 1.00 0.00 H new ATOM 0 HD22 LEU A 416 0.218 -5.151 -2.300 1.00 0.00 H new ATOM 0 HD23 LEU A 416 -1.551 -5.244 -2.122 1.00 0.00 H new ATOM 705 N THR A 417 -1.737 -1.495 -5.736 1.00 0.00 N ATOM 706 CA THR A 417 -1.377 -0.834 -6.987 1.00 0.00 C ATOM 707 C THR A 417 -2.121 0.491 -7.127 1.00 0.00 C ATOM 708 O THR A 417 -1.514 1.534 -7.374 1.00 0.00 O ATOM 709 CB THR A 417 -1.687 -1.732 -8.188 1.00 0.00 C ATOM 710 OG1 THR A 417 -3.007 -2.239 -8.109 1.00 0.00 O ATOM 711 CG2 THR A 417 -0.744 -2.908 -8.315 1.00 0.00 C ATOM 0 H THR A 417 -2.158 -2.417 -5.849 1.00 0.00 H new ATOM 0 HA THR A 417 -0.305 -0.638 -6.965 1.00 0.00 H new ATOM 0 HB THR A 417 -1.564 -1.096 -9.064 1.00 0.00 H new ATOM 0 HG1 THR A 417 -2.983 -3.168 -7.797 1.00 0.00 H new ATOM 0 HG21 THR A 417 -1.020 -3.503 -9.186 1.00 0.00 H new ATOM 0 HG22 THR A 417 0.277 -2.545 -8.432 1.00 0.00 H new ATOM 0 HG23 THR A 417 -0.809 -3.525 -7.419 1.00 0.00 H new ATOM 719 N LYS A 418 -3.440 0.440 -6.963 1.00 0.00 N ATOM 720 CA LYS A 418 -4.269 1.637 -7.064 1.00 0.00 C ATOM 721 C LYS A 418 -3.785 2.710 -6.097 1.00 0.00 C ATOM 722 O LYS A 418 -3.652 3.878 -6.463 1.00 0.00 O ATOM 723 CB LYS A 418 -5.732 1.294 -6.776 1.00 0.00 C ATOM 724 CG LYS A 418 -6.720 2.248 -7.427 1.00 0.00 C ATOM 725 CD LYS A 418 -7.962 1.518 -7.913 1.00 0.00 C ATOM 726 CE LYS A 418 -7.686 0.736 -9.189 1.00 0.00 C ATOM 727 NZ LYS A 418 -8.866 0.721 -10.096 1.00 0.00 N ATOM 0 H LYS A 418 -3.957 -0.416 -6.760 1.00 0.00 H new ATOM 0 HA LYS A 418 -4.189 2.024 -8.080 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -5.934 0.281 -7.124 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -5.892 1.298 -5.698 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -7.007 3.020 -6.713 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -6.241 2.752 -8.266 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -8.313 0.838 -7.137 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -8.761 2.237 -8.091 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -6.835 1.176 -9.708 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -7.410 -0.287 -8.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -8.638 0.179 -10.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -9.672 0.278 -9.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -9.114 1.696 -10.359 1.00 0.00 H new ATOM 741 N GLU A 419 -3.513 2.303 -4.860 1.00 0.00 N ATOM 742 CA GLU A 419 -3.034 3.229 -3.841 1.00 0.00 C ATOM 743 C GLU A 419 -1.714 3.857 -4.272 1.00 0.00 C ATOM 744 O GLU A 419 -1.476 5.044 -4.045 1.00 0.00 O ATOM 745 CB GLU A 419 -2.860 2.507 -2.504 1.00 0.00 C ATOM 746 CG GLU A 419 -2.807 3.445 -1.310 1.00 0.00 C ATOM 747 CD GLU A 419 -4.045 4.313 -1.194 1.00 0.00 C ATOM 748 OE1 GLU A 419 -4.141 5.312 -1.939 1.00 0.00 O ATOM 749 OE2 GLU A 419 -4.917 3.995 -0.359 1.00 0.00 O ATOM 0 H GLU A 419 -3.616 1.340 -4.541 1.00 0.00 H new ATOM 0 HA GLU A 419 -3.775 4.019 -3.719 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -3.684 1.806 -2.369 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -1.943 1.919 -2.535 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -2.692 2.860 -0.398 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -1.927 4.083 -1.393 1.00 0.00 H new ATOM 756 N LEU A 420 -0.863 3.054 -4.903 1.00 0.00 N ATOM 757 CA LEU A 420 0.432 3.533 -5.374 1.00 0.00 C ATOM 758 C LEU A 420 0.249 4.642 -6.403 1.00 0.00 C ATOM 759 O LEU A 420 0.834 5.719 -6.284 1.00 0.00 O ATOM 760 CB LEU A 420 1.234 2.377 -5.982 1.00 0.00 C ATOM 761 CG LEU A 420 2.506 2.002 -5.219 1.00 0.00 C ATOM 762 CD1 LEU A 420 2.203 0.951 -4.159 1.00 0.00 C ATOM 763 CD2 LEU A 420 3.574 1.501 -6.181 1.00 0.00 C ATOM 0 H LEU A 420 -1.046 2.070 -5.100 1.00 0.00 H new ATOM 0 HA LEU A 420 0.982 3.936 -4.524 1.00 0.00 H new ATOM 0 HB2 LEU A 420 0.591 1.499 -6.040 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.506 2.641 -7.004 1.00 0.00 H new ATOM 0 HG LEU A 420 2.884 2.893 -4.718 1.00 0.00 H new ATOM 0 HD11 LEU A 420 3.119 0.697 -3.626 1.00 0.00 H new ATOM 0 HD12 LEU A 420 1.471 1.346 -3.454 1.00 0.00 H new ATOM 0 HD13 LEU A 420 1.801 0.058 -4.637 1.00 0.00 H new ATOM 0 HD21 LEU A 420 4.472 1.238 -5.623 1.00 0.00 H new ATOM 0 HD22 LEU A 420 3.205 0.622 -6.709 1.00 0.00 H new ATOM 0 HD23 LEU A 420 3.811 2.284 -6.902 1.00 0.00 H new ATOM 775 N LEU A 421 -0.572 4.370 -7.416 1.00 0.00 N ATOM 776 CA LEU A 421 -0.838 5.345 -8.467 1.00 0.00 C ATOM 777 C LEU A 421 -1.388 6.639 -7.878 1.00 0.00 C ATOM 778 O LEU A 421 -0.947 7.732 -8.232 1.00 0.00 O ATOM 779 CB LEU A 421 -1.828 4.773 -9.484 1.00 0.00 C ATOM 780 CG LEU A 421 -2.127 5.681 -10.678 1.00 0.00 C ATOM 781 CD1 LEU A 421 -1.057 5.524 -11.749 1.00 0.00 C ATOM 782 CD2 LEU A 421 -3.502 5.372 -11.250 1.00 0.00 C ATOM 0 H LEU A 421 -1.063 3.483 -7.529 1.00 0.00 H new ATOM 0 HA LEU A 421 0.103 5.566 -8.971 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -1.437 3.826 -9.856 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -2.764 4.552 -8.972 1.00 0.00 H new ATOM 0 HG LEU A 421 -2.121 6.715 -10.334 1.00 0.00 H new ATOM 0 HD11 LEU A 421 -1.286 6.177 -12.591 1.00 0.00 H new ATOM 0 HD12 LEU A 421 -0.085 5.793 -11.335 1.00 0.00 H new ATOM 0 HD13 LEU A 421 -1.032 4.489 -12.090 1.00 0.00 H new ATOM 0 HD21 LEU A 421 -3.699 6.027 -12.099 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -3.534 4.333 -11.578 1.00 0.00 H new ATOM 0 HD23 LEU A 421 -4.260 5.534 -10.483 1.00 0.00 H new ATOM 794 N GLU A 422 -2.352 6.506 -6.971 1.00 0.00 N ATOM 795 CA GLU A 422 -2.960 7.665 -6.328 1.00 0.00 C ATOM 796 C GLU A 422 -1.989 8.307 -5.340 1.00 0.00 C ATOM 797 O GLU A 422 -2.057 9.507 -5.077 1.00 0.00 O ATOM 798 CB GLU A 422 -4.246 7.258 -5.606 1.00 0.00 C ATOM 799 CG GLU A 422 -5.277 6.615 -6.519 1.00 0.00 C ATOM 800 CD GLU A 422 -6.389 7.570 -6.904 1.00 0.00 C ATOM 801 OE1 GLU A 422 -6.184 8.798 -6.795 1.00 0.00 O ATOM 802 OE2 GLU A 422 -7.468 7.091 -7.316 1.00 0.00 O ATOM 0 H GLU A 422 -2.728 5.608 -6.666 1.00 0.00 H new ATOM 0 HA GLU A 422 -3.202 8.395 -7.101 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -3.998 6.562 -4.804 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -4.685 8.139 -5.139 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -4.783 6.255 -7.422 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -5.706 5.745 -6.021 1.00 0.00 H new ATOM 809 N LEU A 423 -1.083 7.497 -4.797 1.00 0.00 N ATOM 810 CA LEU A 423 -0.099 7.984 -3.840 1.00 0.00 C ATOM 811 C LEU A 423 0.856 8.975 -4.498 1.00 0.00 C ATOM 812 O LEU A 423 1.051 10.085 -4.007 1.00 0.00 O ATOM 813 CB LEU A 423 0.690 6.813 -3.250 1.00 0.00 C ATOM 814 CG LEU A 423 1.848 7.204 -2.328 1.00 0.00 C ATOM 815 CD1 LEU A 423 1.324 7.903 -1.083 1.00 0.00 C ATOM 816 CD2 LEU A 423 2.666 5.979 -1.952 1.00 0.00 C ATOM 0 H LEU A 423 -1.012 6.501 -5.005 1.00 0.00 H new ATOM 0 HA LEU A 423 -0.630 8.497 -3.038 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.002 6.177 -2.693 1.00 0.00 H new ATOM 0 HB3 LEU A 423 1.086 6.213 -4.070 1.00 0.00 H new ATOM 0 HG LEU A 423 2.497 7.898 -2.863 1.00 0.00 H new ATOM 0 HD11 LEU A 423 2.160 8.174 -0.439 1.00 0.00 H new ATOM 0 HD12 LEU A 423 0.782 8.803 -1.372 1.00 0.00 H new ATOM 0 HD13 LEU A 423 0.653 7.233 -0.545 1.00 0.00 H new ATOM 0 HD21 LEU A 423 3.485 6.275 -1.296 1.00 0.00 H new ATOM 0 HD22 LEU A 423 2.029 5.261 -1.435 1.00 0.00 H new ATOM 0 HD23 LEU A 423 3.071 5.521 -2.854 1.00 0.00 H new ATOM 828 N ASP A 424 1.451 8.563 -5.614 1.00 0.00 N ATOM 829 CA ASP A 424 2.388 9.413 -6.342 1.00 0.00 C ATOM 830 C ASP A 424 1.748 10.746 -6.726 1.00 0.00 C ATOM 831 O ASP A 424 2.446 11.728 -6.980 1.00 0.00 O ATOM 832 CB ASP A 424 2.888 8.696 -7.596 1.00 0.00 C ATOM 833 CG ASP A 424 1.766 8.367 -8.560 1.00 0.00 C ATOM 834 OD1 ASP A 424 1.007 9.288 -8.927 1.00 0.00 O ATOM 835 OD2 ASP A 424 1.646 7.185 -8.950 1.00 0.00 O ATOM 0 H ASP A 424 1.301 7.646 -6.034 1.00 0.00 H new ATOM 0 HA ASP A 424 3.232 9.619 -5.683 1.00 0.00 H new ATOM 0 HB2 ASP A 424 3.624 9.322 -8.100 1.00 0.00 H new ATOM 0 HB3 ASP A 424 3.396 7.776 -7.307 1.00 0.00 H new ATOM 840 N SER A 425 0.419 10.776 -6.773 1.00 0.00 N ATOM 841 CA SER A 425 -0.305 11.990 -7.132 1.00 0.00 C ATOM 842 C SER A 425 -0.237 13.031 -6.017 1.00 0.00 C ATOM 843 O SER A 425 -0.451 14.219 -6.255 1.00 0.00 O ATOM 844 CB SER A 425 -1.767 11.661 -7.447 1.00 0.00 C ATOM 845 OG SER A 425 -1.957 11.463 -8.838 1.00 0.00 O ATOM 0 H SER A 425 -0.177 9.974 -6.567 1.00 0.00 H new ATOM 0 HA SER A 425 0.171 12.410 -8.018 1.00 0.00 H new ATOM 0 HB2 SER A 425 -2.066 10.764 -6.905 1.00 0.00 H new ATOM 0 HB3 SER A 425 -2.408 12.472 -7.101 1.00 0.00 H new ATOM 0 HG SER A 425 -2.898 11.253 -9.013 1.00 0.00 H new ATOM 851 N VAL A 426 0.062 12.584 -4.799 1.00 0.00 N ATOM 852 CA VAL A 426 0.153 13.486 -3.655 1.00 0.00 C ATOM 853 C VAL A 426 1.167 14.599 -3.911 1.00 0.00 C ATOM 854 O VAL A 426 2.289 14.341 -4.344 1.00 0.00 O ATOM 855 CB VAL A 426 0.539 12.733 -2.367 1.00 0.00 C ATOM 856 CG1 VAL A 426 1.944 12.156 -2.476 1.00 0.00 C ATOM 857 CG2 VAL A 426 0.425 13.651 -1.160 1.00 0.00 C ATOM 0 H VAL A 426 0.245 11.605 -4.580 1.00 0.00 H new ATOM 0 HA VAL A 426 -0.836 13.924 -3.521 1.00 0.00 H new ATOM 0 HB VAL A 426 -0.156 11.903 -2.235 1.00 0.00 H new ATOM 0 HG11 VAL A 426 2.194 11.629 -1.555 1.00 0.00 H new ATOM 0 HG12 VAL A 426 1.988 11.461 -3.315 1.00 0.00 H new ATOM 0 HG13 VAL A 426 2.658 12.964 -2.637 1.00 0.00 H new ATOM 0 HG21 VAL A 426 0.701 13.103 -0.259 1.00 0.00 H new ATOM 0 HG22 VAL A 426 1.093 14.503 -1.286 1.00 0.00 H new ATOM 0 HG23 VAL A 426 -0.602 14.006 -1.069 1.00 0.00 H new ATOM 867 N GLU A 427 0.763 15.836 -3.638 1.00 0.00 N ATOM 868 CA GLU A 427 1.636 16.987 -3.837 1.00 0.00 C ATOM 869 C GLU A 427 2.115 17.544 -2.501 1.00 0.00 C ATOM 870 O GLU A 427 1.553 18.508 -1.981 1.00 0.00 O ATOM 871 CB GLU A 427 0.906 18.076 -4.625 1.00 0.00 C ATOM 872 CG GLU A 427 1.831 18.953 -5.452 1.00 0.00 C ATOM 873 CD GLU A 427 1.074 19.922 -6.341 1.00 0.00 C ATOM 874 OE1 GLU A 427 0.056 19.511 -6.935 1.00 0.00 O ATOM 875 OE2 GLU A 427 1.501 21.091 -6.440 1.00 0.00 O ATOM 0 H GLU A 427 -0.163 16.067 -3.278 1.00 0.00 H new ATOM 0 HA GLU A 427 2.506 16.658 -4.405 1.00 0.00 H new ATOM 0 HB2 GLU A 427 0.177 17.607 -5.286 1.00 0.00 H new ATOM 0 HB3 GLU A 427 0.349 18.704 -3.930 1.00 0.00 H new ATOM 0 HG2 GLU A 427 2.487 19.513 -4.786 1.00 0.00 H new ATOM 0 HG3 GLU A 427 2.469 18.321 -6.070 1.00 0.00 H new ATOM 882 N THR A 428 3.159 16.932 -1.949 1.00 0.00 N ATOM 883 CA THR A 428 3.714 17.367 -0.672 1.00 0.00 C ATOM 884 C THR A 428 4.306 18.769 -0.784 1.00 0.00 C ATOM 885 O THR A 428 4.010 19.644 0.031 1.00 0.00 O ATOM 886 CB THR A 428 4.783 16.384 -0.191 1.00 0.00 C ATOM 887 OG1 THR A 428 5.366 16.832 1.021 1.00 0.00 O ATOM 888 CG2 THR A 428 5.902 16.175 -1.188 1.00 0.00 C ATOM 0 H THR A 428 3.637 16.134 -2.366 1.00 0.00 H new ATOM 0 HA THR A 428 2.903 17.392 0.056 1.00 0.00 H new ATOM 0 HB THR A 428 4.261 15.437 -0.054 1.00 0.00 H new ATOM 0 HG1 THR A 428 6.158 16.292 1.222 1.00 0.00 H new ATOM 0 HG21 THR A 428 6.624 15.467 -0.782 1.00 0.00 H new ATOM 0 HG22 THR A 428 5.492 15.782 -2.118 1.00 0.00 H new ATOM 0 HG23 THR A 428 6.397 17.126 -1.383 1.00 0.00 H new ATOM 896 N GLY A 429 5.144 18.977 -1.793 1.00 0.00 N ATOM 897 CA GLY A 429 5.763 20.276 -1.989 1.00 0.00 C ATOM 898 C GLY A 429 7.120 20.381 -1.319 1.00 0.00 C ATOM 899 O GLY A 429 7.974 21.154 -1.751 1.00 0.00 O ATOM 0 H GLY A 429 5.406 18.270 -2.479 1.00 0.00 H new ATOM 0 HA2 GLY A 429 5.873 20.465 -3.057 1.00 0.00 H new ATOM 0 HA3 GLY A 429 5.106 21.051 -1.595 1.00 0.00 H new ATOM 903 N GLY A 430 7.318 19.605 -0.257 1.00 0.00 N ATOM 904 CA GLY A 430 8.581 19.632 0.456 1.00 0.00 C ATOM 905 C GLY A 430 8.398 19.549 1.960 1.00 0.00 C ATOM 906 O GLY A 430 9.028 20.295 2.710 1.00 0.00 O ATOM 0 H GLY A 430 6.626 18.958 0.122 1.00 0.00 H new ATOM 0 HA2 GLY A 430 9.202 18.801 0.122 1.00 0.00 H new ATOM 0 HA3 GLY A 430 9.116 20.549 0.208 1.00 0.00 H new ATOM 910 N GLN A 431 7.533 18.641 2.399 1.00 0.00 N ATOM 911 CA GLN A 431 7.266 18.465 3.822 1.00 0.00 C ATOM 912 C GLN A 431 7.990 17.234 4.361 1.00 0.00 C ATOM 913 O GLN A 431 8.018 16.184 3.717 1.00 0.00 O ATOM 914 CB GLN A 431 5.760 18.336 4.066 1.00 0.00 C ATOM 915 CG GLN A 431 5.112 19.619 4.560 1.00 0.00 C ATOM 916 CD GLN A 431 5.210 20.747 3.552 1.00 0.00 C ATOM 917 OE1 GLN A 431 5.873 20.622 2.523 1.00 0.00 O ATOM 918 NE2 GLN A 431 4.544 21.860 3.842 1.00 0.00 N ATOM 0 H GLN A 431 7.005 18.016 1.790 1.00 0.00 H new ATOM 0 HA GLN A 431 7.638 19.343 4.350 1.00 0.00 H new ATOM 0 HB2 GLN A 431 5.275 18.027 3.140 1.00 0.00 H new ATOM 0 HB3 GLN A 431 5.585 17.546 4.796 1.00 0.00 H new ATOM 0 HG2 GLN A 431 4.063 19.428 4.785 1.00 0.00 H new ATOM 0 HG3 GLN A 431 5.587 19.927 5.491 1.00 0.00 H new ATOM 0 HE21 GLN A 431 4.006 21.922 4.706 1.00 0.00 H new ATOM 0 HE22 GLN A 431 4.571 22.652 3.200 1.00 0.00 H new ATOM 927 N ASP A 432 8.574 17.370 5.548 1.00 0.00 N ATOM 928 CA ASP A 432 9.296 16.268 6.175 1.00 0.00 C ATOM 929 C ASP A 432 8.345 15.137 6.552 1.00 0.00 C ATOM 930 O ASP A 432 8.643 13.964 6.330 1.00 0.00 O ATOM 931 CB ASP A 432 10.040 16.760 7.418 1.00 0.00 C ATOM 932 CG ASP A 432 11.105 15.784 7.879 1.00 0.00 C ATOM 933 OD1 ASP A 432 12.248 15.875 7.384 1.00 0.00 O ATOM 934 OD2 ASP A 432 10.795 14.928 8.734 1.00 0.00 O ATOM 0 H ASP A 432 8.561 18.231 6.094 1.00 0.00 H new ATOM 0 HA ASP A 432 10.019 15.885 5.455 1.00 0.00 H new ATOM 0 HB2 ASP A 432 10.502 17.723 7.204 1.00 0.00 H new ATOM 0 HB3 ASP A 432 9.326 16.922 8.225 1.00 0.00 H new ATOM 939 N SER A 433 7.200 15.498 7.122 1.00 0.00 N ATOM 940 CA SER A 433 6.206 14.511 7.528 1.00 0.00 C ATOM 941 C SER A 433 5.683 13.740 6.322 1.00 0.00 C ATOM 942 O SER A 433 5.746 12.509 6.284 1.00 0.00 O ATOM 943 CB SER A 433 5.046 15.196 8.253 1.00 0.00 C ATOM 944 OG SER A 433 4.457 16.198 7.442 1.00 0.00 O ATOM 0 H SER A 433 6.938 16.465 7.313 1.00 0.00 H new ATOM 0 HA SER A 433 6.685 13.806 8.207 1.00 0.00 H new ATOM 0 HB2 SER A 433 4.294 14.455 8.524 1.00 0.00 H new ATOM 0 HB3 SER A 433 5.405 15.640 9.182 1.00 0.00 H new ATOM 0 HG SER A 433 3.717 16.619 7.928 1.00 0.00 H new ATOM 950 N VAL A 434 5.170 14.470 5.336 1.00 0.00 N ATOM 951 CA VAL A 434 4.640 13.853 4.126 1.00 0.00 C ATOM 952 C VAL A 434 5.709 13.027 3.421 1.00 0.00 C ATOM 953 O VAL A 434 5.433 11.941 2.911 1.00 0.00 O ATOM 954 CB VAL A 434 4.091 14.909 3.149 1.00 0.00 C ATOM 955 CG1 VAL A 434 3.354 14.239 1.999 1.00 0.00 C ATOM 956 CG2 VAL A 434 3.182 15.893 3.873 1.00 0.00 C ATOM 0 H VAL A 434 5.110 15.488 5.352 1.00 0.00 H new ATOM 0 HA VAL A 434 3.824 13.200 4.434 1.00 0.00 H new ATOM 0 HB VAL A 434 4.933 15.466 2.738 1.00 0.00 H new ATOM 0 HG11 VAL A 434 2.973 15.000 1.318 1.00 0.00 H new ATOM 0 HG12 VAL A 434 4.038 13.582 1.462 1.00 0.00 H new ATOM 0 HG13 VAL A 434 2.522 13.654 2.392 1.00 0.00 H new ATOM 0 HG21 VAL A 434 2.805 16.630 3.164 1.00 0.00 H new ATOM 0 HG22 VAL A 434 2.344 15.355 4.317 1.00 0.00 H new ATOM 0 HG23 VAL A 434 3.745 16.399 4.657 1.00 0.00 H new ATOM 966 N ARG A 435 6.934 13.544 3.402 1.00 0.00 N ATOM 967 CA ARG A 435 8.047 12.849 2.764 1.00 0.00 C ATOM 968 C ARG A 435 8.271 11.488 3.414 1.00 0.00 C ATOM 969 O ARG A 435 8.343 10.465 2.732 1.00 0.00 O ATOM 970 CB ARG A 435 9.323 13.690 2.858 1.00 0.00 C ATOM 971 CG ARG A 435 9.485 14.677 1.713 1.00 0.00 C ATOM 972 CD ARG A 435 10.654 14.306 0.813 1.00 0.00 C ATOM 973 NE ARG A 435 11.932 14.380 1.517 1.00 0.00 N ATOM 974 CZ ARG A 435 13.112 14.451 0.905 1.00 0.00 C ATOM 975 NH1 ARG A 435 13.183 14.458 -0.420 1.00 0.00 N ATOM 976 NH2 ARG A 435 14.227 14.515 1.622 1.00 0.00 N ATOM 0 H ARG A 435 7.181 14.441 3.821 1.00 0.00 H new ATOM 0 HA ARG A 435 7.800 12.698 1.713 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.319 14.237 3.801 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.186 13.025 2.879 1.00 0.00 H new ATOM 0 HG2 ARG A 435 8.568 14.706 1.125 1.00 0.00 H new ATOM 0 HG3 ARG A 435 9.638 15.679 2.115 1.00 0.00 H new ATOM 0 HD2 ARG A 435 10.510 13.296 0.429 1.00 0.00 H new ATOM 0 HD3 ARG A 435 10.675 14.974 -0.048 1.00 0.00 H new ATOM 0 HE ARG A 435 11.919 14.377 2.537 1.00 0.00 H new ATOM 0 HH11 ARG A 435 12.330 14.409 -0.977 1.00 0.00 H new ATOM 0 HH12 ARG A 435 14.091 14.513 -0.882 1.00 0.00 H new ATOM 0 HH21 ARG A 435 14.179 14.510 2.641 1.00 0.00 H new ATOM 0 HH22 ARG A 435 15.132 14.569 1.154 1.00 0.00 H new ATOM 990 N GLN A 436 8.370 11.482 4.741 1.00 0.00 N ATOM 991 CA GLN A 436 8.576 10.246 5.486 1.00 0.00 C ATOM 992 C GLN A 436 7.445 9.263 5.210 1.00 0.00 C ATOM 993 O GLN A 436 7.682 8.078 4.973 1.00 0.00 O ATOM 994 CB GLN A 436 8.664 10.536 6.986 1.00 0.00 C ATOM 995 CG GLN A 436 9.967 11.199 7.401 1.00 0.00 C ATOM 996 CD GLN A 436 11.186 10.406 6.973 1.00 0.00 C ATOM 997 OE1 GLN A 436 11.663 10.539 5.847 1.00 0.00 O ATOM 998 NE2 GLN A 436 11.696 9.573 7.873 1.00 0.00 N ATOM 0 H GLN A 436 8.311 12.319 5.321 1.00 0.00 H new ATOM 0 HA GLN A 436 9.515 9.800 5.159 1.00 0.00 H new ATOM 0 HB2 GLN A 436 7.831 11.178 7.273 1.00 0.00 H new ATOM 0 HB3 GLN A 436 8.550 9.602 7.536 1.00 0.00 H new ATOM 0 HG2 GLN A 436 10.017 12.198 6.967 1.00 0.00 H new ATOM 0 HG3 GLN A 436 9.979 11.321 8.484 1.00 0.00 H new ATOM 0 HE21 GLN A 436 11.268 9.494 8.795 1.00 0.00 H new ATOM 0 HE22 GLN A 436 12.516 9.012 7.642 1.00 0.00 H new ATOM 1007 N ALA A 437 6.215 9.767 5.232 1.00 0.00 N ATOM 1008 CA ALA A 437 5.047 8.935 4.975 1.00 0.00 C ATOM 1009 C ALA A 437 5.111 8.339 3.574 1.00 0.00 C ATOM 1010 O ALA A 437 4.695 7.202 3.351 1.00 0.00 O ATOM 1011 CB ALA A 437 3.772 9.745 5.151 1.00 0.00 C ATOM 0 H ALA A 437 6.003 10.746 5.425 1.00 0.00 H new ATOM 0 HA ALA A 437 5.041 8.117 5.695 1.00 0.00 H new ATOM 0 HB1 ALA A 437 2.908 9.110 4.956 1.00 0.00 H new ATOM 0 HB2 ALA A 437 3.720 10.125 6.171 1.00 0.00 H new ATOM 0 HB3 ALA A 437 3.773 10.582 4.452 1.00 0.00 H new ATOM 1017 N ARG A 438 5.641 9.115 2.633 1.00 0.00 N ATOM 1018 CA ARG A 438 5.768 8.665 1.252 1.00 0.00 C ATOM 1019 C ARG A 438 6.737 7.493 1.159 1.00 0.00 C ATOM 1020 O ARG A 438 6.393 6.428 0.646 1.00 0.00 O ATOM 1021 CB ARG A 438 6.247 9.811 0.360 1.00 0.00 C ATOM 1022 CG ARG A 438 6.298 9.452 -1.116 1.00 0.00 C ATOM 1023 CD ARG A 438 5.065 9.949 -1.854 1.00 0.00 C ATOM 1024 NE ARG A 438 5.253 9.936 -3.303 1.00 0.00 N ATOM 1025 CZ ARG A 438 6.069 10.765 -3.952 1.00 0.00 C ATOM 1026 NH1 ARG A 438 6.771 11.672 -3.285 1.00 0.00 N ATOM 1027 NH2 ARG A 438 6.181 10.686 -5.270 1.00 0.00 N ATOM 0 H ARG A 438 5.989 10.059 2.802 1.00 0.00 H new ATOM 0 HA ARG A 438 4.787 8.337 0.908 1.00 0.00 H new ATOM 0 HB2 ARG A 438 5.585 10.666 0.495 1.00 0.00 H new ATOM 0 HB3 ARG A 438 7.240 10.122 0.684 1.00 0.00 H new ATOM 0 HG2 ARG A 438 7.192 9.885 -1.566 1.00 0.00 H new ATOM 0 HG3 ARG A 438 6.378 8.370 -1.226 1.00 0.00 H new ATOM 0 HD2 ARG A 438 4.210 9.325 -1.594 1.00 0.00 H new ATOM 0 HD3 ARG A 438 4.831 10.962 -1.528 1.00 0.00 H new ATOM 0 HE ARG A 438 4.729 9.252 -3.849 1.00 0.00 H new ATOM 0 HH11 ARG A 438 6.687 11.737 -2.271 1.00 0.00 H new ATOM 0 HH12 ARG A 438 7.394 12.304 -3.787 1.00 0.00 H new ATOM 0 HH21 ARG A 438 5.643 9.991 -5.787 1.00 0.00 H new ATOM 0 HH22 ARG A 438 6.806 11.320 -5.768 1.00 0.00 H new ATOM 1041 N LYS A 439 7.950 7.692 1.668 1.00 0.00 N ATOM 1042 CA LYS A 439 8.965 6.646 1.648 1.00 0.00 C ATOM 1043 C LYS A 439 8.476 5.412 2.398 1.00 0.00 C ATOM 1044 O LYS A 439 8.535 4.294 1.886 1.00 0.00 O ATOM 1045 CB LYS A 439 10.268 7.155 2.271 1.00 0.00 C ATOM 1046 CG LYS A 439 11.060 8.077 1.358 1.00 0.00 C ATOM 1047 CD LYS A 439 12.211 7.343 0.689 1.00 0.00 C ATOM 1048 CE LYS A 439 12.655 8.046 -0.585 1.00 0.00 C ATOM 1049 NZ LYS A 439 12.108 7.386 -1.803 1.00 0.00 N ATOM 0 H LYS A 439 8.252 8.566 2.098 1.00 0.00 H new ATOM 0 HA LYS A 439 9.154 6.372 0.610 1.00 0.00 H new ATOM 0 HB2 LYS A 439 10.036 7.684 3.195 1.00 0.00 H new ATOM 0 HB3 LYS A 439 10.890 6.301 2.540 1.00 0.00 H new ATOM 0 HG2 LYS A 439 10.400 8.492 0.596 1.00 0.00 H new ATOM 0 HG3 LYS A 439 11.448 8.916 1.935 1.00 0.00 H new ATOM 0 HD2 LYS A 439 13.051 7.275 1.380 1.00 0.00 H new ATOM 0 HD3 LYS A 439 11.907 6.323 0.456 1.00 0.00 H new ATOM 0 HE2 LYS A 439 12.329 9.086 -0.558 1.00 0.00 H new ATOM 0 HE3 LYS A 439 13.744 8.054 -0.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 12.434 7.895 -2.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 12.439 6.401 -1.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 11.069 7.401 -1.769 1.00 0.00 H new ATOM 1063 N GLU A 440 7.982 5.627 3.614 1.00 0.00 N ATOM 1064 CA GLU A 440 7.468 4.537 4.433 1.00 0.00 C ATOM 1065 C GLU A 440 6.346 3.806 3.706 1.00 0.00 C ATOM 1066 O GLU A 440 6.216 2.586 3.805 1.00 0.00 O ATOM 1067 CB GLU A 440 6.963 5.073 5.776 1.00 0.00 C ATOM 1068 CG GLU A 440 6.372 4.000 6.677 1.00 0.00 C ATOM 1069 CD GLU A 440 6.786 4.163 8.126 1.00 0.00 C ATOM 1070 OE1 GLU A 440 6.846 5.316 8.600 1.00 0.00 O ATOM 1071 OE2 GLU A 440 7.049 3.136 8.787 1.00 0.00 O ATOM 0 H GLU A 440 7.927 6.546 4.053 1.00 0.00 H new ATOM 0 HA GLU A 440 8.280 3.833 4.618 1.00 0.00 H new ATOM 0 HB2 GLU A 440 7.788 5.559 6.297 1.00 0.00 H new ATOM 0 HB3 GLU A 440 6.208 5.837 5.592 1.00 0.00 H new ATOM 0 HG2 GLU A 440 5.285 4.031 6.608 1.00 0.00 H new ATOM 0 HG3 GLU A 440 6.686 3.019 6.321 1.00 0.00 H new ATOM 1078 N ALA A 441 5.544 4.563 2.963 1.00 0.00 N ATOM 1079 CA ALA A 441 4.439 3.989 2.207 1.00 0.00 C ATOM 1080 C ALA A 441 4.960 3.078 1.103 1.00 0.00 C ATOM 1081 O ALA A 441 4.447 1.979 0.897 1.00 0.00 O ATOM 1082 CB ALA A 441 3.570 5.092 1.621 1.00 0.00 C ATOM 0 H ALA A 441 5.640 5.574 2.869 1.00 0.00 H new ATOM 0 HA ALA A 441 3.831 3.391 2.886 1.00 0.00 H new ATOM 0 HB1 ALA A 441 2.748 4.648 1.059 1.00 0.00 H new ATOM 0 HB2 ALA A 441 3.168 5.706 2.427 1.00 0.00 H new ATOM 0 HB3 ALA A 441 4.170 5.714 0.957 1.00 0.00 H new ATOM 1088 N VAL A 442 5.991 3.541 0.399 1.00 0.00 N ATOM 1089 CA VAL A 442 6.590 2.764 -0.678 1.00 0.00 C ATOM 1090 C VAL A 442 7.160 1.456 -0.144 1.00 0.00 C ATOM 1091 O VAL A 442 6.990 0.397 -0.748 1.00 0.00 O ATOM 1092 CB VAL A 442 7.709 3.551 -1.388 1.00 0.00 C ATOM 1093 CG1 VAL A 442 8.220 2.783 -2.598 1.00 0.00 C ATOM 1094 CG2 VAL A 442 7.217 4.933 -1.795 1.00 0.00 C ATOM 0 H VAL A 442 6.427 4.450 0.557 1.00 0.00 H new ATOM 0 HA VAL A 442 5.801 2.552 -1.399 1.00 0.00 H new ATOM 0 HB VAL A 442 8.537 3.676 -0.690 1.00 0.00 H new ATOM 0 HG11 VAL A 442 9.009 3.355 -3.085 1.00 0.00 H new ATOM 0 HG12 VAL A 442 8.616 1.819 -2.277 1.00 0.00 H new ATOM 0 HG13 VAL A 442 7.401 2.623 -3.300 1.00 0.00 H new ATOM 0 HG21 VAL A 442 8.021 5.473 -2.295 1.00 0.00 H new ATOM 0 HG22 VAL A 442 6.371 4.832 -2.474 1.00 0.00 H new ATOM 0 HG23 VAL A 442 6.906 5.485 -0.908 1.00 0.00 H new ATOM 1104 N CYS A 443 7.834 1.535 1.000 1.00 0.00 N ATOM 1105 CA CYS A 443 8.420 0.354 1.619 1.00 0.00 C ATOM 1106 C CYS A 443 7.327 -0.621 2.047 1.00 0.00 C ATOM 1107 O CYS A 443 7.450 -1.830 1.857 1.00 0.00 O ATOM 1108 CB CYS A 443 9.267 0.752 2.829 1.00 0.00 C ATOM 1109 SG CYS A 443 10.758 -0.248 3.045 1.00 0.00 S ATOM 0 H CYS A 443 7.987 2.402 1.514 1.00 0.00 H new ATOM 0 HA CYS A 443 9.061 -0.136 0.886 1.00 0.00 H new ATOM 0 HB2 CYS A 443 9.555 1.798 2.729 1.00 0.00 H new ATOM 0 HB3 CYS A 443 8.656 0.674 3.728 1.00 0.00 H new ATOM 0 HG CYS A 443 11.409 0.165 4.092 1.00 0.00 H new ATOM 1115 N LYS A 444 6.257 -0.080 2.622 1.00 0.00 N ATOM 1116 CA LYS A 444 5.134 -0.888 3.077 1.00 0.00 C ATOM 1117 C LYS A 444 4.453 -1.588 1.905 1.00 0.00 C ATOM 1118 O LYS A 444 4.402 -2.817 1.852 1.00 0.00 O ATOM 1119 CB LYS A 444 4.124 -0.016 3.827 1.00 0.00 C ATOM 1120 CG LYS A 444 3.498 -0.704 5.028 1.00 0.00 C ATOM 1121 CD LYS A 444 4.417 -0.661 6.240 1.00 0.00 C ATOM 1122 CE LYS A 444 5.050 -2.016 6.509 1.00 0.00 C ATOM 1123 NZ LYS A 444 6.104 -1.938 7.559 1.00 0.00 N ATOM 0 H LYS A 444 6.146 0.921 2.784 1.00 0.00 H new ATOM 0 HA LYS A 444 5.518 -1.651 3.754 1.00 0.00 H new ATOM 0 HB2 LYS A 444 4.620 0.896 4.159 1.00 0.00 H new ATOM 0 HB3 LYS A 444 3.334 0.284 3.138 1.00 0.00 H new ATOM 0 HG2 LYS A 444 2.551 -0.222 5.271 1.00 0.00 H new ATOM 0 HG3 LYS A 444 3.273 -1.741 4.778 1.00 0.00 H new ATOM 0 HD2 LYS A 444 5.199 0.081 6.079 1.00 0.00 H new ATOM 0 HD3 LYS A 444 3.851 -0.343 7.116 1.00 0.00 H new ATOM 0 HE2 LYS A 444 4.279 -2.721 6.820 1.00 0.00 H new ATOM 0 HE3 LYS A 444 5.484 -2.404 5.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 6.511 -2.883 7.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 6.852 -1.284 7.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 5.685 -1.593 8.446 1.00 0.00 H new ATOM 1137 N ILE A 445 3.938 -0.803 0.960 1.00 0.00 N ATOM 1138 CA ILE A 445 3.269 -1.364 -0.211 1.00 0.00 C ATOM 1139 C ILE A 445 4.156 -2.407 -0.881 1.00 0.00 C ATOM 1140 O ILE A 445 3.703 -3.500 -1.219 1.00 0.00 O ATOM 1141 CB ILE A 445 2.896 -0.273 -1.237 1.00 0.00 C ATOM 1142 CG1 ILE A 445 4.120 0.572 -1.588 1.00 0.00 C ATOM 1143 CG2 ILE A 445 1.778 0.603 -0.691 1.00 0.00 C ATOM 1144 CD1 ILE A 445 4.848 0.096 -2.827 1.00 0.00 C ATOM 0 H ILE A 445 3.971 0.216 0.982 1.00 0.00 H new ATOM 0 HA ILE A 445 2.349 -1.833 0.138 1.00 0.00 H new ATOM 0 HB ILE A 445 2.543 -0.757 -2.148 1.00 0.00 H new ATOM 0 HG12 ILE A 445 3.808 1.606 -1.735 1.00 0.00 H new ATOM 0 HG13 ILE A 445 4.811 0.564 -0.745 1.00 0.00 H new ATOM 0 HG21 ILE A 445 1.524 1.368 -1.424 1.00 0.00 H new ATOM 0 HG22 ILE A 445 0.900 -0.011 -0.489 1.00 0.00 H new ATOM 0 HG23 ILE A 445 2.107 1.080 0.232 1.00 0.00 H new ATOM 0 HD11 ILE A 445 5.705 0.742 -3.016 1.00 0.00 H new ATOM 0 HD12 ILE A 445 5.191 -0.928 -2.677 1.00 0.00 H new ATOM 0 HD13 ILE A 445 4.172 0.130 -3.682 1.00 0.00 H new ATOM 1156 N GLN A 446 5.431 -2.069 -1.042 1.00 0.00 N ATOM 1157 CA GLN A 446 6.388 -2.987 -1.642 1.00 0.00 C ATOM 1158 C GLN A 446 6.635 -4.160 -0.702 1.00 0.00 C ATOM 1159 O GLN A 446 6.928 -5.274 -1.136 1.00 0.00 O ATOM 1160 CB GLN A 446 7.707 -2.269 -1.940 1.00 0.00 C ATOM 1161 CG GLN A 446 8.483 -2.880 -3.095 1.00 0.00 C ATOM 1162 CD GLN A 446 8.216 -2.177 -4.412 1.00 0.00 C ATOM 1163 OE1 GLN A 446 8.526 -0.997 -4.573 1.00 0.00 O ATOM 1164 NE2 GLN A 446 7.639 -2.903 -5.363 1.00 0.00 N ATOM 0 H GLN A 446 5.823 -1.169 -0.766 1.00 0.00 H new ATOM 0 HA GLN A 446 5.976 -3.358 -2.581 1.00 0.00 H new ATOM 0 HB2 GLN A 446 7.499 -1.223 -2.166 1.00 0.00 H new ATOM 0 HB3 GLN A 446 8.330 -2.285 -1.046 1.00 0.00 H new ATOM 0 HG2 GLN A 446 9.550 -2.838 -2.874 1.00 0.00 H new ATOM 0 HG3 GLN A 446 8.218 -3.933 -3.189 1.00 0.00 H new ATOM 0 HE21 GLN A 446 7.399 -3.878 -5.185 1.00 0.00 H new ATOM 0 HE22 GLN A 446 7.436 -2.485 -6.271 1.00 0.00 H new ATOM 1173 N ALA A 447 6.505 -3.894 0.596 1.00 0.00 N ATOM 1174 CA ALA A 447 6.706 -4.911 1.618 1.00 0.00 C ATOM 1175 C ALA A 447 5.595 -5.955 1.585 1.00 0.00 C ATOM 1176 O ALA A 447 5.860 -7.157 1.543 1.00 0.00 O ATOM 1177 CB ALA A 447 6.785 -4.260 2.991 1.00 0.00 C ATOM 0 H ALA A 447 6.259 -2.975 0.964 1.00 0.00 H new ATOM 0 HA ALA A 447 7.647 -5.421 1.412 1.00 0.00 H new ATOM 0 HB1 ALA A 447 6.935 -5.028 3.750 1.00 0.00 H new ATOM 0 HB2 ALA A 447 7.619 -3.559 3.014 1.00 0.00 H new ATOM 0 HB3 ALA A 447 5.857 -3.726 3.194 1.00 0.00 H new ATOM 1183 N ILE A 448 4.347 -5.492 1.612 1.00 0.00 N ATOM 1184 CA ILE A 448 3.201 -6.395 1.593 1.00 0.00 C ATOM 1185 C ILE A 448 3.104 -7.150 0.271 1.00 0.00 C ATOM 1186 O ILE A 448 2.879 -8.361 0.256 1.00 0.00 O ATOM 1187 CB ILE A 448 1.873 -5.652 1.856 1.00 0.00 C ATOM 1188 CG1 ILE A 448 1.678 -4.504 0.862 1.00 0.00 C ATOM 1189 CG2 ILE A 448 1.837 -5.129 3.283 1.00 0.00 C ATOM 1190 CD1 ILE A 448 0.966 -4.914 -0.406 1.00 0.00 C ATOM 0 H ILE A 448 4.105 -4.502 1.647 1.00 0.00 H new ATOM 0 HA ILE A 448 3.364 -7.109 2.400 1.00 0.00 H new ATOM 0 HB ILE A 448 1.055 -6.359 1.719 1.00 0.00 H new ATOM 0 HG12 ILE A 448 1.111 -3.708 1.346 1.00 0.00 H new ATOM 0 HG13 ILE A 448 2.652 -4.089 0.603 1.00 0.00 H new ATOM 0 HG21 ILE A 448 0.896 -4.607 3.456 1.00 0.00 H new ATOM 0 HG22 ILE A 448 1.922 -5.964 3.979 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.667 -4.440 3.439 1.00 0.00 H new ATOM 0 HD11 ILE A 448 0.864 -4.049 -1.062 1.00 0.00 H new ATOM 0 HD12 ILE A 448 1.542 -5.688 -0.913 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.023 -5.301 -0.159 1.00 0.00 H new ATOM 1202 N LEU A 449 3.278 -6.440 -0.842 1.00 0.00 N ATOM 1203 CA LEU A 449 3.206 -7.073 -2.154 1.00 0.00 C ATOM 1204 C LEU A 449 4.366 -8.045 -2.344 1.00 0.00 C ATOM 1205 O LEU A 449 4.193 -9.131 -2.898 1.00 0.00 O ATOM 1206 CB LEU A 449 3.199 -6.022 -3.268 1.00 0.00 C ATOM 1207 CG LEU A 449 4.480 -5.200 -3.407 1.00 0.00 C ATOM 1208 CD1 LEU A 449 5.545 -5.988 -4.157 1.00 0.00 C ATOM 1209 CD2 LEU A 449 4.186 -3.885 -4.116 1.00 0.00 C ATOM 0 H LEU A 449 3.468 -5.438 -0.861 1.00 0.00 H new ATOM 0 HA LEU A 449 2.272 -7.633 -2.209 1.00 0.00 H new ATOM 0 HB2 LEU A 449 3.006 -6.524 -4.216 1.00 0.00 H new ATOM 0 HB3 LEU A 449 2.367 -5.339 -3.094 1.00 0.00 H new ATOM 0 HG LEU A 449 4.861 -4.980 -2.410 1.00 0.00 H new ATOM 0 HD11 LEU A 449 6.449 -5.385 -4.245 1.00 0.00 H new ATOM 0 HD12 LEU A 449 5.772 -6.904 -3.611 1.00 0.00 H new ATOM 0 HD13 LEU A 449 5.178 -6.240 -5.152 1.00 0.00 H new ATOM 0 HD21 LEU A 449 5.106 -3.308 -4.209 1.00 0.00 H new ATOM 0 HD22 LEU A 449 3.783 -4.089 -5.108 1.00 0.00 H new ATOM 0 HD23 LEU A 449 3.458 -3.315 -3.539 1.00 0.00 H new ATOM 1221 N GLU A 450 5.546 -7.659 -1.867 1.00 0.00 N ATOM 1222 CA GLU A 450 6.724 -8.512 -1.975 1.00 0.00 C ATOM 1223 C GLU A 450 6.496 -9.813 -1.213 1.00 0.00 C ATOM 1224 O GLU A 450 6.728 -10.903 -1.738 1.00 0.00 O ATOM 1225 CB GLU A 450 7.961 -7.793 -1.433 1.00 0.00 C ATOM 1226 CG GLU A 450 9.223 -8.640 -1.465 1.00 0.00 C ATOM 1227 CD GLU A 450 10.190 -8.206 -2.550 1.00 0.00 C ATOM 1228 OE1 GLU A 450 9.858 -8.372 -3.743 1.00 0.00 O ATOM 1229 OE2 GLU A 450 11.279 -7.699 -2.207 1.00 0.00 O ATOM 0 H GLU A 450 5.711 -6.765 -1.404 1.00 0.00 H new ATOM 0 HA GLU A 450 6.893 -8.741 -3.027 1.00 0.00 H new ATOM 0 HB2 GLU A 450 8.128 -6.887 -2.015 1.00 0.00 H new ATOM 0 HB3 GLU A 450 7.769 -7.482 -0.406 1.00 0.00 H new ATOM 0 HG2 GLU A 450 9.720 -8.582 -0.496 1.00 0.00 H new ATOM 0 HG3 GLU A 450 8.952 -9.684 -1.622 1.00 0.00 H new ATOM 1236 N LYS A 451 6.024 -9.687 0.024 1.00 0.00 N ATOM 1237 CA LYS A 451 5.748 -10.851 0.856 1.00 0.00 C ATOM 1238 C LYS A 451 4.675 -11.717 0.208 1.00 0.00 C ATOM 1239 O LYS A 451 4.737 -12.945 0.257 1.00 0.00 O ATOM 1240 CB LYS A 451 5.296 -10.412 2.250 1.00 0.00 C ATOM 1241 CG LYS A 451 5.599 -11.433 3.336 1.00 0.00 C ATOM 1242 CD LYS A 451 4.328 -12.024 3.921 1.00 0.00 C ATOM 1243 CE LYS A 451 3.935 -13.311 3.215 1.00 0.00 C ATOM 1244 NZ LYS A 451 5.065 -14.280 3.154 1.00 0.00 N ATOM 0 H LYS A 451 5.825 -8.792 0.471 1.00 0.00 H new ATOM 0 HA LYS A 451 6.663 -11.435 0.952 1.00 0.00 H new ATOM 0 HB2 LYS A 451 5.784 -9.470 2.502 1.00 0.00 H new ATOM 0 HB3 LYS A 451 4.223 -10.220 2.232 1.00 0.00 H new ATOM 0 HG2 LYS A 451 6.215 -12.232 2.923 1.00 0.00 H new ATOM 0 HG3 LYS A 451 6.179 -10.960 4.129 1.00 0.00 H new ATOM 0 HD2 LYS A 451 4.472 -12.220 4.983 1.00 0.00 H new ATOM 0 HD3 LYS A 451 3.517 -11.300 3.838 1.00 0.00 H new ATOM 0 HE2 LYS A 451 3.093 -13.768 3.735 1.00 0.00 H new ATOM 0 HE3 LYS A 451 3.598 -13.082 2.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 4.720 -15.231 3.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 5.464 -14.288 2.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 5.801 -13.998 3.832 1.00 0.00 H new ATOM 1258 N LEU A 452 3.694 -11.063 -0.409 1.00 0.00 N ATOM 1259 CA LEU A 452 2.608 -11.767 -1.077 1.00 0.00 C ATOM 1260 C LEU A 452 3.153 -12.678 -2.172 1.00 0.00 C ATOM 1261 O LEU A 452 2.857 -13.873 -2.206 1.00 0.00 O ATOM 1262 CB LEU A 452 1.615 -10.767 -1.675 1.00 0.00 C ATOM 1263 CG LEU A 452 0.271 -10.676 -0.953 1.00 0.00 C ATOM 1264 CD1 LEU A 452 -0.660 -9.723 -1.683 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.363 -12.055 -0.822 1.00 0.00 C ATOM 0 H LEU A 452 3.631 -10.046 -0.459 1.00 0.00 H new ATOM 0 HA LEU A 452 2.092 -12.380 -0.338 1.00 0.00 H new ATOM 0 HB2 LEU A 452 2.076 -9.779 -1.678 1.00 0.00 H new ATOM 0 HB3 LEU A 452 1.433 -11.037 -2.715 1.00 0.00 H new ATOM 0 HG LEU A 452 0.444 -10.286 0.050 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -1.613 -9.670 -1.156 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -0.210 -8.731 -1.720 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.827 -10.083 -2.698 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -1.319 -11.968 -0.305 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -0.524 -12.477 -1.814 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.299 -12.707 -0.253 1.00 0.00 H new ATOM 1277 N GLU A 453 3.953 -12.104 -3.065 1.00 0.00 N ATOM 1278 CA GLU A 453 4.543 -12.864 -4.160 1.00 0.00 C ATOM 1279 C GLU A 453 5.442 -13.971 -3.624 1.00 0.00 C ATOM 1280 O GLU A 453 5.481 -15.074 -4.172 1.00 0.00 O ATOM 1281 CB GLU A 453 5.343 -11.939 -5.079 1.00 0.00 C ATOM 1282 CG GLU A 453 5.255 -12.317 -6.549 1.00 0.00 C ATOM 1283 CD GLU A 453 4.251 -11.470 -7.308 1.00 0.00 C ATOM 1284 OE1 GLU A 453 3.278 -11.001 -6.683 1.00 0.00 O ATOM 1285 OE2 GLU A 453 4.440 -11.279 -8.527 1.00 0.00 O ATOM 0 H GLU A 453 4.207 -11.116 -3.052 1.00 0.00 H new ATOM 0 HA GLU A 453 3.735 -13.320 -4.733 1.00 0.00 H new ATOM 0 HB2 GLU A 453 4.985 -10.917 -4.953 1.00 0.00 H new ATOM 0 HB3 GLU A 453 6.389 -11.951 -4.771 1.00 0.00 H new ATOM 0 HG2 GLU A 453 6.238 -12.208 -7.008 1.00 0.00 H new ATOM 0 HG3 GLU A 453 4.977 -13.368 -6.635 1.00 0.00 H new ATOM 1292 N LYS A 454 6.166 -13.670 -2.550 1.00 0.00 N ATOM 1293 CA LYS A 454 7.066 -14.641 -1.939 1.00 0.00 C ATOM 1294 C LYS A 454 6.290 -15.835 -1.391 1.00 0.00 C ATOM 1295 O LYS A 454 6.751 -16.974 -1.464 1.00 0.00 O ATOM 1296 CB LYS A 454 7.871 -13.983 -0.815 1.00 0.00 C ATOM 1297 CG LYS A 454 9.211 -13.431 -1.272 1.00 0.00 C ATOM 1298 CD LYS A 454 10.275 -13.592 -0.198 1.00 0.00 C ATOM 1299 CE LYS A 454 11.280 -12.452 -0.234 1.00 0.00 C ATOM 1300 NZ LYS A 454 10.889 -11.338 0.673 1.00 0.00 N ATOM 0 H LYS A 454 6.147 -12.762 -2.086 1.00 0.00 H new ATOM 0 HA LYS A 454 7.751 -14.998 -2.708 1.00 0.00 H new ATOM 0 HB2 LYS A 454 7.282 -13.174 -0.383 1.00 0.00 H new ATOM 0 HB3 LYS A 454 8.039 -14.713 -0.023 1.00 0.00 H new ATOM 0 HG2 LYS A 454 9.527 -13.946 -2.179 1.00 0.00 H new ATOM 0 HG3 LYS A 454 9.104 -12.376 -1.525 1.00 0.00 H new ATOM 0 HD2 LYS A 454 9.801 -13.629 0.783 1.00 0.00 H new ATOM 0 HD3 LYS A 454 10.794 -14.540 -0.338 1.00 0.00 H new ATOM 0 HE2 LYS A 454 12.263 -12.826 0.053 1.00 0.00 H new ATOM 0 HE3 LYS A 454 11.367 -12.077 -1.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 11.600 -10.581 0.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 9.962 -10.964 0.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 10.831 -11.690 1.650 1.00 0.00 H new ATOM 1314 N LYS A 455 5.110 -15.566 -0.840 1.00 0.00 N ATOM 1315 CA LYS A 455 4.270 -16.619 -0.278 1.00 0.00 C ATOM 1316 C LYS A 455 3.401 -17.260 -1.357 1.00 0.00 C ATOM 1317 O LYS A 455 3.134 -18.461 -1.319 1.00 0.00 O ATOM 1318 CB LYS A 455 3.387 -16.055 0.836 1.00 0.00 C ATOM 1319 CG LYS A 455 3.239 -16.988 2.027 1.00 0.00 C ATOM 1320 CD LYS A 455 2.070 -17.942 1.844 1.00 0.00 C ATOM 1321 CE LYS A 455 2.139 -19.101 2.825 1.00 0.00 C ATOM 1322 NZ LYS A 455 3.247 -20.041 2.498 1.00 0.00 N ATOM 0 H LYS A 455 4.714 -14.629 -0.771 1.00 0.00 H new ATOM 0 HA LYS A 455 4.923 -17.386 0.138 1.00 0.00 H new ATOM 0 HB2 LYS A 455 3.807 -15.108 1.177 1.00 0.00 H new ATOM 0 HB3 LYS A 455 2.399 -15.838 0.430 1.00 0.00 H new ATOM 0 HG2 LYS A 455 4.158 -17.558 2.160 1.00 0.00 H new ATOM 0 HG3 LYS A 455 3.093 -16.402 2.934 1.00 0.00 H new ATOM 0 HD2 LYS A 455 1.133 -17.402 1.982 1.00 0.00 H new ATOM 0 HD3 LYS A 455 2.069 -18.327 0.824 1.00 0.00 H new ATOM 0 HE2 LYS A 455 2.277 -18.714 3.835 1.00 0.00 H new ATOM 0 HE3 LYS A 455 1.192 -19.640 2.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 3.093 -20.944 2.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 3.271 -20.206 1.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 4.152 -19.630 2.804 1.00 0.00 H new ATOM 1336 N GLY A 456 2.963 -16.451 -2.316 1.00 0.00 N ATOM 1337 CA GLY A 456 2.127 -16.957 -3.391 1.00 0.00 C ATOM 1338 C GLY A 456 2.826 -18.017 -4.218 1.00 0.00 C ATOM 1339 O GLY A 456 2.265 -18.424 -5.257 1.00 0.00 O ATOM 1340 OXT GLY A 456 3.935 -18.439 -3.829 1.00 0.00 O ATOM 0 H GLY A 456 3.172 -15.454 -2.369 1.00 0.00 H new ATOM 0 HA2 GLY A 456 1.212 -17.374 -2.970 1.00 0.00 H new ATOM 0 HA3 GLY A 456 1.833 -16.131 -4.038 1.00 0.00 H new