USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 688 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 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 385 HIS : no HE2:sc= -2.41 K(o=-2.4,f=-3!) USER MOD Set 2.1: A 379 SER OG : rot 101:sc= 0.707! USER MOD Set 2.2: A 428 THR OG1 : rot -30:sc= -4.45! USER MOD Set 3.1: A 376 THR OG1 : rot 133:sc= 0.961 USER MOD Set 3.2: A 431 GLN :FLIP amide:sc=-0.00226 F(o=-0.65,f=0.96) USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 389 LYS NZ :NH3+ -123:sc= -0.365 (180deg=-0.991) USER MOD Single : A 391 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= -0.129 K(o=-0.13,f=-0.99) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 LYS NZ :NH3+ -159:sc=-0.00437 (180deg=-0.181) USER MOD Single : A 405 THR OG1 : rot -170:sc= -0.155 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot -96:sc= 0.34 USER MOD Single : A 415 MET CE :methyl 154:sc= -0.339 (180deg=-1.43!) USER MOD Single : A 417 THR OG1 : rot -8:sc= 0.819 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 433 SER OG : rot 180:sc= 0.045 USER MOD Single : A 436 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 439 LYS NZ :NH3+ 151:sc= -0.0211 (180deg=-0.534) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 444 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.578) USER MOD Single : A 446 GLN : amide:sc=-0.00844 X(o=-0.0084,f=-0.2) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ 156:sc= -0.0247 (180deg=-0.417) USER MOD Single : A 455 LYS NZ :NH3+ -147:sc=-0.00455 (180deg=-0.604) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 376 -0.002 20.325 5.723 1.00 0.00 N ATOM 2 CA THR A 376 -0.457 20.208 4.342 1.00 0.00 C ATOM 3 C THR A 376 -1.213 18.900 4.128 1.00 0.00 C ATOM 4 O THR A 376 -0.634 17.900 3.708 1.00 0.00 O ATOM 5 CB THR A 376 0.735 20.285 3.386 1.00 0.00 C ATOM 6 OG1 THR A 376 1.482 21.467 3.609 1.00 0.00 O ATOM 7 CG2 THR A 376 0.334 20.263 1.927 1.00 0.00 C ATOM 0 HA THR A 376 -1.135 21.036 4.135 1.00 0.00 H new ATOM 0 HB THR A 376 1.331 19.397 3.596 1.00 0.00 H new ATOM 0 HG1 THR A 376 2.436 21.247 3.660 1.00 0.00 H new ATOM 0 HG21 THR A 376 1.226 20.320 1.304 1.00 0.00 H new ATOM 0 HG22 THR A 376 -0.201 19.338 1.711 1.00 0.00 H new ATOM 0 HG23 THR A 376 -0.313 21.114 1.714 1.00 0.00 H new ATOM 15 N PRO A 377 -2.527 18.891 4.415 1.00 0.00 N ATOM 16 CA PRO A 377 -3.364 17.698 4.253 1.00 0.00 C ATOM 17 C PRO A 377 -3.312 17.131 2.834 1.00 0.00 C ATOM 18 O PRO A 377 -3.175 15.922 2.650 1.00 0.00 O ATOM 19 CB PRO A 377 -4.776 18.193 4.583 1.00 0.00 C ATOM 20 CG PRO A 377 -4.574 19.416 5.408 1.00 0.00 C ATOM 21 CD PRO A 377 -3.297 20.042 4.922 1.00 0.00 C ATOM 0 HA PRO A 377 -3.027 16.883 4.894 1.00 0.00 H new ATOM 0 HB2 PRO A 377 -5.337 18.417 3.676 1.00 0.00 H new ATOM 0 HB3 PRO A 377 -5.341 17.438 5.129 1.00 0.00 H new ATOM 0 HG2 PRO A 377 -5.412 20.104 5.296 1.00 0.00 H new ATOM 0 HG3 PRO A 377 -4.506 19.165 6.467 1.00 0.00 H new ATOM 0 HD2 PRO A 377 -3.482 20.778 4.140 1.00 0.00 H new ATOM 0 HD3 PRO A 377 -2.770 20.556 5.726 1.00 0.00 H new ATOM 29 N PRO A 378 -3.420 17.990 1.806 1.00 0.00 N ATOM 30 CA PRO A 378 -3.384 17.547 0.408 1.00 0.00 C ATOM 31 C PRO A 378 -2.104 16.788 0.068 1.00 0.00 C ATOM 32 O PRO A 378 -2.053 16.054 -0.919 1.00 0.00 O ATOM 33 CB PRO A 378 -3.453 18.854 -0.390 1.00 0.00 C ATOM 34 CG PRO A 378 -4.053 19.845 0.545 1.00 0.00 C ATOM 35 CD PRO A 378 -3.587 19.450 1.917 1.00 0.00 C ATOM 0 HA PRO A 378 -4.195 16.853 0.187 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -2.462 19.170 -0.717 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -4.062 18.738 -1.286 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -3.732 20.857 0.300 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -5.141 19.832 0.483 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -2.652 19.944 2.183 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -4.316 19.715 2.682 1.00 0.00 H new ATOM 43 N SER A 379 -1.071 16.973 0.883 1.00 0.00 N ATOM 44 CA SER A 379 0.209 16.310 0.655 1.00 0.00 C ATOM 45 C SER A 379 0.412 15.127 1.602 1.00 0.00 C ATOM 46 O SER A 379 1.041 14.133 1.235 1.00 0.00 O ATOM 47 CB SER A 379 1.356 17.308 0.820 1.00 0.00 C ATOM 48 OG SER A 379 2.452 16.968 -0.013 1.00 0.00 O ATOM 0 H SER A 379 -1.094 17.575 1.706 1.00 0.00 H new ATOM 0 HA SER A 379 0.202 15.925 -0.365 1.00 0.00 H new ATOM 0 HB2 SER A 379 1.007 18.311 0.576 1.00 0.00 H new ATOM 0 HB3 SER A 379 1.679 17.327 1.861 1.00 0.00 H new ATOM 0 HG SER A 379 2.444 17.536 -0.812 1.00 0.00 H new ATOM 54 N ILE A 380 -0.109 15.240 2.821 1.00 0.00 N ATOM 55 CA ILE A 380 0.039 14.175 3.809 1.00 0.00 C ATOM 56 C ILE A 380 -1.196 13.277 3.872 1.00 0.00 C ATOM 57 O ILE A 380 -1.081 12.053 3.879 1.00 0.00 O ATOM 58 CB ILE A 380 0.326 14.746 5.214 1.00 0.00 C ATOM 59 CG1 ILE A 380 0.675 13.617 6.185 1.00 0.00 C ATOM 60 CG2 ILE A 380 -0.866 15.545 5.725 1.00 0.00 C ATOM 61 CD1 ILE A 380 2.159 13.484 6.448 1.00 0.00 C ATOM 0 H ILE A 380 -0.634 16.052 3.147 1.00 0.00 H new ATOM 0 HA ILE A 380 0.889 13.574 3.486 1.00 0.00 H new ATOM 0 HB ILE A 380 1.180 15.419 5.145 1.00 0.00 H new ATOM 0 HG12 ILE A 380 0.161 13.790 7.130 1.00 0.00 H new ATOM 0 HG13 ILE A 380 0.299 12.675 5.785 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -0.642 15.938 6.717 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -1.069 16.372 5.044 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.741 14.898 5.780 1.00 0.00 H new ATOM 0 HD11 ILE A 380 2.333 12.664 7.145 1.00 0.00 H new ATOM 0 HD12 ILE A 380 2.678 13.280 5.511 1.00 0.00 H new ATOM 0 HD13 ILE A 380 2.537 14.412 6.878 1.00 0.00 H new ATOM 73 N LYS A 381 -2.376 13.888 3.921 1.00 0.00 N ATOM 74 CA LYS A 381 -3.628 13.136 3.988 1.00 0.00 C ATOM 75 C LYS A 381 -3.653 12.012 2.953 1.00 0.00 C ATOM 76 O LYS A 381 -4.241 10.955 3.183 1.00 0.00 O ATOM 77 CB LYS A 381 -4.821 14.067 3.774 1.00 0.00 C ATOM 78 CG LYS A 381 -6.096 13.586 4.447 1.00 0.00 C ATOM 79 CD LYS A 381 -7.294 14.428 4.036 1.00 0.00 C ATOM 80 CE LYS A 381 -8.243 14.654 5.203 1.00 0.00 C ATOM 81 NZ LYS A 381 -9.363 13.674 5.207 1.00 0.00 N ATOM 0 H LYS A 381 -2.493 14.901 3.916 1.00 0.00 H new ATOM 0 HA LYS A 381 -3.696 12.690 4.980 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -4.571 15.058 4.154 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -5.002 14.172 2.704 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -6.276 12.543 4.185 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -5.975 13.627 5.530 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -6.951 15.389 3.654 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -7.826 13.933 3.223 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -7.691 14.578 6.140 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -8.646 15.665 5.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -9.986 13.863 6.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -9.906 13.764 4.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -8.980 12.710 5.281 1.00 0.00 H new ATOM 95 N LYS A 382 -3.013 12.250 1.814 1.00 0.00 N ATOM 96 CA LYS A 382 -2.961 11.259 0.745 1.00 0.00 C ATOM 97 C LYS A 382 -2.146 10.042 1.170 1.00 0.00 C ATOM 98 O LYS A 382 -2.659 8.921 1.210 1.00 0.00 O ATOM 99 CB LYS A 382 -2.360 11.875 -0.519 1.00 0.00 C ATOM 100 CG LYS A 382 -3.097 13.112 -1.004 1.00 0.00 C ATOM 101 CD LYS A 382 -2.876 13.346 -2.489 1.00 0.00 C ATOM 102 CE LYS A 382 -4.122 13.908 -3.156 1.00 0.00 C ATOM 103 NZ LYS A 382 -3.787 14.921 -4.194 1.00 0.00 N ATOM 0 H LYS A 382 -2.523 13.120 1.607 1.00 0.00 H new ATOM 0 HA LYS A 382 -3.980 10.934 0.534 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -1.319 12.135 -0.327 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -2.361 11.128 -1.313 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -4.163 13.002 -0.807 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -2.757 13.983 -0.443 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -2.044 14.036 -2.630 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -2.597 12.408 -2.969 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -4.688 13.095 -3.611 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -4.765 14.361 -2.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -4.663 15.280 -4.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -3.269 15.709 -3.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -3.194 14.483 -4.928 1.00 0.00 H new ATOM 117 N ILE A 383 -0.874 10.266 1.486 1.00 0.00 N ATOM 118 CA ILE A 383 0.006 9.183 1.905 1.00 0.00 C ATOM 119 C ILE A 383 -0.557 8.461 3.126 1.00 0.00 C ATOM 120 O ILE A 383 -0.419 7.243 3.258 1.00 0.00 O ATOM 121 CB ILE A 383 1.432 9.692 2.212 1.00 0.00 C ATOM 122 CG1 ILE A 383 2.391 8.512 2.376 1.00 0.00 C ATOM 123 CG2 ILE A 383 1.446 10.571 3.454 1.00 0.00 C ATOM 124 CD1 ILE A 383 2.693 7.798 1.077 1.00 0.00 C ATOM 0 H ILE A 383 -0.432 11.185 1.460 1.00 0.00 H new ATOM 0 HA ILE A 383 0.064 8.481 1.073 1.00 0.00 H new ATOM 0 HB ILE A 383 1.765 10.300 1.371 1.00 0.00 H new ATOM 0 HG12 ILE A 383 3.324 8.870 2.811 1.00 0.00 H new ATOM 0 HG13 ILE A 383 1.962 7.801 3.082 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.463 10.914 3.645 1.00 0.00 H new ATOM 0 HG22 ILE A 383 0.796 11.432 3.298 1.00 0.00 H new ATOM 0 HG23 ILE A 383 1.090 9.997 4.310 1.00 0.00 H new ATOM 0 HD11 ILE A 383 3.379 6.972 1.267 1.00 0.00 H new ATOM 0 HD12 ILE A 383 1.768 7.410 0.651 1.00 0.00 H new ATOM 0 HD13 ILE A 383 3.150 8.496 0.376 1.00 0.00 H new ATOM 136 N ILE A 384 -1.203 9.215 4.010 1.00 0.00 N ATOM 137 CA ILE A 384 -1.798 8.640 5.209 1.00 0.00 C ATOM 138 C ILE A 384 -2.934 7.692 4.839 1.00 0.00 C ATOM 139 O ILE A 384 -3.002 6.563 5.327 1.00 0.00 O ATOM 140 CB ILE A 384 -2.335 9.732 6.159 1.00 0.00 C ATOM 141 CG1 ILE A 384 -1.211 10.693 6.551 1.00 0.00 C ATOM 142 CG2 ILE A 384 -2.953 9.104 7.401 1.00 0.00 C ATOM 143 CD1 ILE A 384 -1.710 12.026 7.062 1.00 0.00 C ATOM 0 H ILE A 384 -1.327 10.223 3.918 1.00 0.00 H new ATOM 0 HA ILE A 384 -1.013 8.089 5.726 1.00 0.00 H new ATOM 0 HB ILE A 384 -3.109 10.294 5.637 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -0.595 10.226 7.319 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -0.569 10.861 5.686 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -3.326 9.889 8.059 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -3.778 8.454 7.108 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -2.199 8.519 7.927 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -0.860 12.657 7.321 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -2.302 12.514 6.288 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -2.328 11.869 7.946 1.00 0.00 H new ATOM 155 N HIS A 385 -3.819 8.155 3.958 1.00 0.00 N ATOM 156 CA HIS A 385 -4.945 7.344 3.510 1.00 0.00 C ATOM 157 C HIS A 385 -4.449 6.030 2.918 1.00 0.00 C ATOM 158 O HIS A 385 -4.869 4.949 3.336 1.00 0.00 O ATOM 159 CB HIS A 385 -5.770 8.107 2.472 1.00 0.00 C ATOM 160 CG HIS A 385 -6.587 9.218 3.058 1.00 0.00 C ATOM 161 ND1 HIS A 385 -7.270 10.137 2.288 1.00 0.00 N ATOM 162 CD2 HIS A 385 -6.829 9.557 4.347 1.00 0.00 C ATOM 163 CE1 HIS A 385 -7.896 10.992 3.078 1.00 0.00 C ATOM 164 NE2 HIS A 385 -7.646 10.660 4.331 1.00 0.00 N ATOM 0 H HIS A 385 -3.777 9.085 3.542 1.00 0.00 H new ATOM 0 HA HIS A 385 -5.577 7.126 4.371 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -5.099 8.519 1.718 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -6.433 7.409 1.962 1.00 0.00 H new ATOM 0 HD1 HIS A 385 -7.289 10.154 1.268 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -6.450 9.053 5.224 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -8.508 11.821 2.754 1.00 0.00 H new ATOM 173 N VAL A 386 -3.541 6.130 1.951 1.00 0.00 N ATOM 174 CA VAL A 386 -2.979 4.946 1.316 1.00 0.00 C ATOM 175 C VAL A 386 -2.286 4.066 2.349 1.00 0.00 C ATOM 176 O VAL A 386 -2.318 2.839 2.257 1.00 0.00 O ATOM 177 CB VAL A 386 -1.974 5.316 0.209 1.00 0.00 C ATOM 178 CG1 VAL A 386 -2.686 5.997 -0.950 1.00 0.00 C ATOM 179 CG2 VAL A 386 -0.872 6.204 0.762 1.00 0.00 C ATOM 0 H VAL A 386 -3.181 7.015 1.593 1.00 0.00 H new ATOM 0 HA VAL A 386 -3.807 4.400 0.863 1.00 0.00 H new ATOM 0 HB VAL A 386 -1.516 4.399 -0.162 1.00 0.00 H new ATOM 0 HG11 VAL A 386 -1.961 6.252 -1.723 1.00 0.00 H new ATOM 0 HG12 VAL A 386 -3.436 5.322 -1.363 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -3.172 6.906 -0.595 1.00 0.00 H new ATOM 0 HG21 VAL A 386 -0.172 6.454 -0.035 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -1.309 7.119 1.162 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -0.344 5.676 1.556 1.00 0.00 H new ATOM 189 N LEU A 387 -1.671 4.702 3.343 1.00 0.00 N ATOM 190 CA LEU A 387 -0.986 3.977 4.406 1.00 0.00 C ATOM 191 C LEU A 387 -1.962 3.050 5.122 1.00 0.00 C ATOM 192 O LEU A 387 -1.708 1.854 5.269 1.00 0.00 O ATOM 193 CB LEU A 387 -0.359 4.957 5.403 1.00 0.00 C ATOM 194 CG LEU A 387 1.160 4.845 5.551 1.00 0.00 C ATOM 195 CD1 LEU A 387 1.767 6.204 5.860 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.515 3.839 6.636 1.00 0.00 C ATOM 0 H LEU A 387 -1.634 5.717 3.433 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.191 3.377 3.963 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -0.605 5.973 5.094 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -0.817 4.801 6.380 1.00 0.00 H new ATOM 0 HG LEU A 387 1.575 4.492 4.607 1.00 0.00 H new ATOM 0 HD11 LEU A 387 2.848 6.105 5.962 1.00 0.00 H new ATOM 0 HD12 LEU A 387 1.541 6.896 5.049 1.00 0.00 H new ATOM 0 HD13 LEU A 387 1.348 6.586 6.791 1.00 0.00 H new ATOM 0 HD21 LEU A 387 2.599 3.771 6.729 1.00 0.00 H new ATOM 0 HD22 LEU A 387 1.089 4.163 7.586 1.00 0.00 H new ATOM 0 HD23 LEU A 387 1.112 2.861 6.372 1.00 0.00 H new ATOM 208 N GLU A 388 -3.091 3.609 5.550 1.00 0.00 N ATOM 209 CA GLU A 388 -4.116 2.830 6.232 1.00 0.00 C ATOM 210 C GLU A 388 -4.593 1.698 5.332 1.00 0.00 C ATOM 211 O GLU A 388 -4.716 0.549 5.766 1.00 0.00 O ATOM 212 CB GLU A 388 -5.293 3.726 6.628 1.00 0.00 C ATOM 213 CG GLU A 388 -5.369 4.007 8.119 1.00 0.00 C ATOM 214 CD GLU A 388 -4.349 5.035 8.571 1.00 0.00 C ATOM 215 OE1 GLU A 388 -4.597 6.242 8.375 1.00 0.00 O ATOM 216 OE2 GLU A 388 -3.301 4.630 9.117 1.00 0.00 O ATOM 0 H GLU A 388 -3.317 4.597 5.436 1.00 0.00 H new ATOM 0 HA GLU A 388 -3.687 2.404 7.139 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.215 4.672 6.092 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.222 3.254 6.308 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -6.370 4.360 8.368 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -5.212 3.079 8.669 1.00 0.00 H new ATOM 223 N LYS A 389 -4.843 2.027 4.067 1.00 0.00 N ATOM 224 CA LYS A 389 -5.287 1.036 3.096 1.00 0.00 C ATOM 225 C LYS A 389 -4.279 -0.105 3.016 1.00 0.00 C ATOM 226 O LYS A 389 -4.652 -1.277 2.945 1.00 0.00 O ATOM 227 CB LYS A 389 -5.466 1.678 1.719 1.00 0.00 C ATOM 228 CG LYS A 389 -6.725 1.228 0.996 1.00 0.00 C ATOM 229 CD LYS A 389 -6.627 -0.226 0.559 1.00 0.00 C ATOM 230 CE LYS A 389 -7.942 -0.962 0.768 1.00 0.00 C ATOM 231 NZ LYS A 389 -7.730 -2.337 1.296 1.00 0.00 N ATOM 0 H LYS A 389 -4.745 2.971 3.693 1.00 0.00 H new ATOM 0 HA LYS A 389 -6.249 0.638 3.420 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -5.491 2.762 1.833 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -4.599 1.442 1.102 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -7.587 1.355 1.651 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -6.891 1.861 0.124 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -6.346 -0.272 -0.493 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -5.837 -0.724 1.122 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -8.567 -0.399 1.461 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -8.483 -1.015 -0.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -8.169 -3.027 0.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -6.710 -2.529 1.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -8.163 -2.418 2.238 1.00 0.00 H new ATOM 245 N VAL A 390 -2.997 0.249 3.045 1.00 0.00 N ATOM 246 CA VAL A 390 -1.931 -0.741 2.996 1.00 0.00 C ATOM 247 C VAL A 390 -1.977 -1.623 4.236 1.00 0.00 C ATOM 248 O VAL A 390 -1.781 -2.836 4.156 1.00 0.00 O ATOM 249 CB VAL A 390 -0.544 -0.076 2.891 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.552 -1.129 2.796 1.00 0.00 C ATOM 251 CG2 VAL A 390 -0.492 0.867 1.696 1.00 0.00 C ATOM 0 H VAL A 390 -2.674 1.215 3.102 1.00 0.00 H new ATOM 0 HA VAL A 390 -2.088 -1.349 2.105 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.375 0.509 3.795 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.523 -0.638 2.723 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.530 -1.758 3.686 1.00 0.00 H new ATOM 0 HG13 VAL A 390 0.389 -1.745 1.912 1.00 0.00 H new ATOM 0 HG21 VAL A 390 0.494 1.327 1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -0.685 0.306 0.781 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -1.248 1.643 1.812 1.00 0.00 H new ATOM 261 N GLN A 391 -2.252 -1.006 5.383 1.00 0.00 N ATOM 262 CA GLN A 391 -2.343 -1.741 6.640 1.00 0.00 C ATOM 263 C GLN A 391 -3.398 -2.833 6.528 1.00 0.00 C ATOM 264 O GLN A 391 -3.128 -4.006 6.797 1.00 0.00 O ATOM 265 CB GLN A 391 -2.688 -0.791 7.791 1.00 0.00 C ATOM 266 CG GLN A 391 -2.421 -1.382 9.166 1.00 0.00 C ATOM 267 CD GLN A 391 -1.256 -0.716 9.873 1.00 0.00 C ATOM 268 OE1 GLN A 391 -0.118 -1.175 9.783 1.00 0.00 O ATOM 269 NE2 GLN A 391 -1.538 0.372 10.581 1.00 0.00 N ATOM 0 H GLN A 391 -2.415 -0.003 5.467 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.377 -2.200 6.847 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -2.110 0.126 7.680 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -3.740 -0.515 7.721 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -3.317 -1.284 9.779 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -2.218 -2.448 9.066 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -2.497 0.716 10.627 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -0.795 0.863 11.079 1.00 0.00 H new ATOM 278 N TYR A 392 -4.599 -2.443 6.106 1.00 0.00 N ATOM 279 CA TYR A 392 -5.689 -3.395 5.933 1.00 0.00 C ATOM 280 C TYR A 392 -5.265 -4.494 4.966 1.00 0.00 C ATOM 281 O TYR A 392 -5.472 -5.681 5.223 1.00 0.00 O ATOM 282 CB TYR A 392 -6.940 -2.687 5.411 1.00 0.00 C ATOM 283 CG TYR A 392 -7.255 -1.399 6.138 1.00 0.00 C ATOM 284 CD1 TYR A 392 -7.164 -1.321 7.523 1.00 0.00 C ATOM 285 CD2 TYR A 392 -7.644 -0.262 5.441 1.00 0.00 C ATOM 286 CE1 TYR A 392 -7.451 -0.146 8.191 1.00 0.00 C ATOM 287 CE2 TYR A 392 -7.932 0.916 6.102 1.00 0.00 C ATOM 288 CZ TYR A 392 -7.834 0.970 7.477 1.00 0.00 C ATOM 289 OH TYR A 392 -8.120 2.142 8.139 1.00 0.00 O ATOM 0 H TYR A 392 -4.839 -1.478 5.879 1.00 0.00 H new ATOM 0 HA TYR A 392 -5.924 -3.841 6.900 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -6.810 -2.473 4.350 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -7.792 -3.361 5.498 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -6.864 -2.193 8.086 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.723 -0.300 4.365 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -7.376 -0.102 9.267 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.233 1.791 5.545 1.00 0.00 H new ATOM 0 HH TYR A 392 -8.373 2.831 7.490 1.00 0.00 H new ATOM 299 N LEU A 393 -4.650 -4.086 3.859 1.00 0.00 N ATOM 300 CA LEU A 393 -4.173 -5.032 2.862 1.00 0.00 C ATOM 301 C LEU A 393 -3.108 -5.933 3.473 1.00 0.00 C ATOM 302 O LEU A 393 -3.014 -7.116 3.146 1.00 0.00 O ATOM 303 CB LEU A 393 -3.607 -4.290 1.648 1.00 0.00 C ATOM 304 CG LEU A 393 -4.561 -4.177 0.457 1.00 0.00 C ATOM 305 CD1 LEU A 393 -4.405 -2.827 -0.227 1.00 0.00 C ATOM 306 CD2 LEU A 393 -4.316 -5.308 -0.531 1.00 0.00 C ATOM 0 H LEU A 393 -4.472 -3.108 3.633 1.00 0.00 H new ATOM 0 HA LEU A 393 -5.010 -5.646 2.530 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -3.316 -3.286 1.958 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.700 -4.798 1.321 1.00 0.00 H new ATOM 0 HG LEU A 393 -5.583 -4.258 0.826 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -5.092 -2.765 -1.071 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -4.631 -2.031 0.483 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -3.381 -2.716 -0.583 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -5.003 -5.212 -1.372 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -3.289 -5.258 -0.894 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -4.480 -6.265 -0.036 1.00 0.00 H new ATOM 318 N GLU A 394 -2.318 -5.364 4.382 1.00 0.00 N ATOM 319 CA GLU A 394 -1.270 -6.113 5.061 1.00 0.00 C ATOM 320 C GLU A 394 -1.880 -7.277 5.828 1.00 0.00 C ATOM 321 O GLU A 394 -1.439 -8.420 5.706 1.00 0.00 O ATOM 322 CB GLU A 394 -0.494 -5.203 6.017 1.00 0.00 C ATOM 323 CG GLU A 394 0.953 -5.621 6.216 1.00 0.00 C ATOM 324 CD GLU A 394 1.790 -4.534 6.861 1.00 0.00 C ATOM 325 OE1 GLU A 394 1.525 -4.198 8.034 1.00 0.00 O ATOM 326 OE2 GLU A 394 2.711 -4.020 6.193 1.00 0.00 O ATOM 0 H GLU A 394 -2.386 -4.386 4.663 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.578 -6.501 4.314 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -0.519 -4.183 5.634 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -0.997 -5.193 6.984 1.00 0.00 H new ATOM 0 HG2 GLU A 394 0.987 -6.517 6.836 1.00 0.00 H new ATOM 0 HG3 GLU A 394 1.387 -5.885 5.252 1.00 0.00 H new ATOM 333 N GLN A 395 -2.919 -6.981 6.605 1.00 0.00 N ATOM 334 CA GLN A 395 -3.606 -8.010 7.370 1.00 0.00 C ATOM 335 C GLN A 395 -4.215 -9.036 6.423 1.00 0.00 C ATOM 336 O GLN A 395 -4.182 -10.241 6.681 1.00 0.00 O ATOM 337 CB GLN A 395 -4.697 -7.387 8.246 1.00 0.00 C ATOM 338 CG GLN A 395 -4.818 -8.031 9.617 1.00 0.00 C ATOM 339 CD GLN A 395 -5.268 -9.477 9.546 1.00 0.00 C ATOM 340 OE1 GLN A 395 -4.454 -10.386 9.378 1.00 0.00 O ATOM 341 NE2 GLN A 395 -6.573 -9.696 9.670 1.00 0.00 N ATOM 0 H GLN A 395 -3.300 -6.042 6.719 1.00 0.00 H new ATOM 0 HA GLN A 395 -2.885 -8.507 8.019 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -4.489 -6.324 8.370 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.654 -7.466 7.731 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -3.855 -7.979 10.125 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -5.527 -7.463 10.219 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -7.211 -8.912 9.808 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -6.937 -10.648 9.627 1.00 0.00 H new ATOM 350 N GLU A 396 -4.759 -8.545 5.311 1.00 0.00 N ATOM 351 CA GLU A 396 -5.364 -9.411 4.309 1.00 0.00 C ATOM 352 C GLU A 396 -4.335 -10.396 3.763 1.00 0.00 C ATOM 353 O GLU A 396 -4.529 -11.609 3.828 1.00 0.00 O ATOM 354 CB GLU A 396 -5.946 -8.576 3.166 1.00 0.00 C ATOM 355 CG GLU A 396 -6.923 -9.342 2.289 1.00 0.00 C ATOM 356 CD GLU A 396 -8.337 -9.317 2.835 1.00 0.00 C ATOM 357 OE1 GLU A 396 -8.500 -9.117 4.057 1.00 0.00 O ATOM 358 OE2 GLU A 396 -9.284 -9.497 2.039 1.00 0.00 O ATOM 0 H GLU A 396 -4.792 -7.551 5.084 1.00 0.00 H new ATOM 0 HA GLU A 396 -6.170 -9.973 4.782 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -6.451 -7.705 3.584 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -5.130 -8.204 2.547 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -6.917 -8.916 1.286 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -6.591 -10.376 2.198 1.00 0.00 H new ATOM 365 N VAL A 397 -3.234 -9.867 3.235 1.00 0.00 N ATOM 366 CA VAL A 397 -2.174 -10.707 2.691 1.00 0.00 C ATOM 367 C VAL A 397 -1.672 -11.683 3.751 1.00 0.00 C ATOM 368 O VAL A 397 -1.330 -12.825 3.447 1.00 0.00 O ATOM 369 CB VAL A 397 -0.990 -9.871 2.163 1.00 0.00 C ATOM 370 CG1 VAL A 397 -0.412 -8.997 3.262 1.00 0.00 C ATOM 371 CG2 VAL A 397 0.083 -10.773 1.572 1.00 0.00 C ATOM 0 H VAL A 397 -3.054 -8.865 3.173 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.600 -11.259 1.854 1.00 0.00 H new ATOM 0 HB VAL A 397 -1.361 -9.219 1.373 1.00 0.00 H new ATOM 0 HG11 VAL A 397 0.421 -8.417 2.865 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -1.182 -8.320 3.631 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -0.060 -9.626 4.080 1.00 0.00 H new ATOM 0 HG21 VAL A 397 0.909 -10.164 1.205 1.00 0.00 H new ATOM 0 HG22 VAL A 397 0.448 -11.455 2.340 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -0.338 -11.347 0.747 1.00 0.00 H new ATOM 381 N GLU A 398 -1.644 -11.226 5.000 1.00 0.00 N ATOM 382 CA GLU A 398 -1.201 -12.065 6.106 1.00 0.00 C ATOM 383 C GLU A 398 -2.130 -13.264 6.257 1.00 0.00 C ATOM 384 O GLU A 398 -1.679 -14.391 6.463 1.00 0.00 O ATOM 385 CB GLU A 398 -1.167 -11.261 7.406 1.00 0.00 C ATOM 386 CG GLU A 398 -0.037 -11.665 8.341 1.00 0.00 C ATOM 387 CD GLU A 398 0.285 -10.592 9.362 1.00 0.00 C ATOM 388 OE1 GLU A 398 -0.627 -10.206 10.126 1.00 0.00 O ATOM 389 OE2 GLU A 398 1.449 -10.138 9.401 1.00 0.00 O ATOM 0 H GLU A 398 -1.922 -10.282 5.270 1.00 0.00 H new ATOM 0 HA GLU A 398 -0.194 -12.421 5.891 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -1.068 -10.202 7.166 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -2.118 -11.383 7.924 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -0.310 -12.584 8.859 1.00 0.00 H new ATOM 0 HG3 GLU A 398 0.855 -11.883 7.754 1.00 0.00 H new ATOM 396 N GLU A 399 -3.430 -13.011 6.140 1.00 0.00 N ATOM 397 CA GLU A 399 -4.430 -14.067 6.250 1.00 0.00 C ATOM 398 C GLU A 399 -4.713 -14.705 4.887 1.00 0.00 C ATOM 399 O GLU A 399 -5.464 -15.674 4.793 1.00 0.00 O ATOM 400 CB GLU A 399 -5.726 -13.510 6.842 1.00 0.00 C ATOM 401 CG GLU A 399 -5.776 -13.567 8.360 1.00 0.00 C ATOM 402 CD GLU A 399 -6.093 -14.956 8.880 1.00 0.00 C ATOM 403 OE1 GLU A 399 -5.821 -15.937 8.156 1.00 0.00 O ATOM 404 OE2 GLU A 399 -6.612 -15.061 10.011 1.00 0.00 O ATOM 0 H GLU A 399 -3.816 -12.082 5.969 1.00 0.00 H new ATOM 0 HA GLU A 399 -4.033 -14.836 6.913 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -5.847 -12.475 6.522 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -6.570 -14.069 6.438 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -4.817 -13.242 8.764 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -6.529 -12.867 8.722 1.00 0.00 H new ATOM 411 N PHE A 400 -4.106 -14.151 3.835 1.00 0.00 N ATOM 412 CA PHE A 400 -4.286 -14.657 2.473 1.00 0.00 C ATOM 413 C PHE A 400 -4.264 -16.186 2.440 1.00 0.00 C ATOM 414 O PHE A 400 -3.502 -16.823 3.166 1.00 0.00 O ATOM 415 CB PHE A 400 -3.193 -14.091 1.560 1.00 0.00 C ATOM 416 CG PHE A 400 -3.186 -14.671 0.172 1.00 0.00 C ATOM 417 CD1 PHE A 400 -4.269 -14.494 -0.676 1.00 0.00 C ATOM 418 CD2 PHE A 400 -2.095 -15.395 -0.282 1.00 0.00 C ATOM 419 CE1 PHE A 400 -4.261 -15.027 -1.949 1.00 0.00 C ATOM 420 CE2 PHE A 400 -2.082 -15.929 -1.556 1.00 0.00 C ATOM 421 CZ PHE A 400 -3.167 -15.746 -2.391 1.00 0.00 C ATOM 0 H PHE A 400 -3.482 -13.347 3.902 1.00 0.00 H new ATOM 0 HA PHE A 400 -5.262 -14.330 2.114 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -3.318 -13.011 1.489 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -2.222 -14.270 2.021 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -5.127 -13.933 -0.337 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.245 -15.543 0.368 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -5.110 -14.882 -2.600 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -1.224 -16.489 -1.899 1.00 0.00 H new ATOM 0 HZ PHE A 400 -3.160 -16.164 -3.387 1.00 0.00 H new ATOM 431 N VAL A 401 -5.113 -16.763 1.594 1.00 0.00 N ATOM 432 CA VAL A 401 -5.205 -18.214 1.462 1.00 0.00 C ATOM 433 C VAL A 401 -3.827 -18.847 1.270 1.00 0.00 C ATOM 434 O VAL A 401 -3.482 -19.819 1.942 1.00 0.00 O ATOM 435 CB VAL A 401 -6.119 -18.607 0.282 1.00 0.00 C ATOM 436 CG1 VAL A 401 -5.656 -17.938 -1.001 1.00 0.00 C ATOM 437 CG2 VAL A 401 -6.172 -20.120 0.118 1.00 0.00 C ATOM 0 H VAL A 401 -5.749 -16.246 0.988 1.00 0.00 H new ATOM 0 HA VAL A 401 -5.637 -18.591 2.389 1.00 0.00 H new ATOM 0 HB VAL A 401 -7.128 -18.258 0.502 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -6.314 -18.228 -1.820 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -5.686 -16.855 -0.878 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -4.636 -18.250 -1.226 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -6.822 -20.373 -0.720 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -5.169 -20.501 -0.074 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -6.563 -20.571 1.030 1.00 0.00 H new ATOM 447 N GLY A 402 -3.043 -18.291 0.352 1.00 0.00 N ATOM 448 CA GLY A 402 -1.715 -18.817 0.097 1.00 0.00 C ATOM 449 C GLY A 402 -1.406 -18.925 -1.384 1.00 0.00 C ATOM 450 O GLY A 402 -0.286 -18.644 -1.812 1.00 0.00 O ATOM 0 H GLY A 402 -3.303 -17.487 -0.219 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -0.975 -18.173 0.573 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -1.623 -19.801 0.556 1.00 0.00 H new ATOM 454 N LYS A 403 -2.398 -19.336 -2.167 1.00 0.00 N ATOM 455 CA LYS A 403 -2.224 -19.480 -3.608 1.00 0.00 C ATOM 456 C LYS A 403 -3.038 -18.434 -4.360 1.00 0.00 C ATOM 457 O LYS A 403 -4.152 -18.094 -3.960 1.00 0.00 O ATOM 458 CB LYS A 403 -2.637 -20.883 -4.055 1.00 0.00 C ATOM 459 CG LYS A 403 -2.283 -21.190 -5.501 1.00 0.00 C ATOM 460 CD LYS A 403 -0.966 -21.945 -5.604 1.00 0.00 C ATOM 461 CE LYS A 403 -0.493 -22.044 -7.045 1.00 0.00 C ATOM 462 NZ LYS A 403 0.203 -23.333 -7.312 1.00 0.00 N ATOM 0 H LYS A 403 -3.330 -19.575 -1.828 1.00 0.00 H new ATOM 0 HA LYS A 403 -1.169 -19.329 -3.839 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -2.157 -21.617 -3.408 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -3.713 -20.996 -3.921 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -3.079 -21.781 -5.954 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -2.216 -20.260 -6.066 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -0.208 -21.440 -5.005 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -1.086 -22.946 -5.189 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -1.347 -21.947 -7.715 1.00 0.00 H new ATOM 0 HE3 LYS A 403 0.180 -21.215 -7.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 0.510 -23.362 -8.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 1.033 -23.415 -6.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -0.447 -24.123 -7.127 1.00 0.00 H new ATOM 476 N LYS A 404 -2.477 -17.924 -5.452 1.00 0.00 N ATOM 477 CA LYS A 404 -3.152 -16.913 -6.259 1.00 0.00 C ATOM 478 C LYS A 404 -4.312 -17.522 -7.041 1.00 0.00 C ATOM 479 O LYS A 404 -4.312 -17.527 -8.272 1.00 0.00 O ATOM 480 CB LYS A 404 -2.161 -16.253 -7.219 1.00 0.00 C ATOM 481 CG LYS A 404 -1.455 -17.238 -8.138 1.00 0.00 C ATOM 482 CD LYS A 404 -1.935 -17.107 -9.578 1.00 0.00 C ATOM 483 CE LYS A 404 -0.815 -16.658 -10.502 1.00 0.00 C ATOM 484 NZ LYS A 404 -0.253 -15.339 -10.097 1.00 0.00 N ATOM 0 H LYS A 404 -1.557 -18.194 -5.799 1.00 0.00 H new ATOM 0 HA LYS A 404 -3.554 -16.156 -5.586 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -2.690 -15.518 -7.826 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -1.414 -15.710 -6.640 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -0.379 -17.068 -8.096 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -1.631 -18.255 -7.786 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -2.328 -18.065 -9.920 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -2.755 -16.391 -9.625 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -0.022 -17.406 -10.501 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -1.191 -16.594 -11.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 0.232 -14.904 -10.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -1.023 -14.716 -9.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 0.425 -15.474 -9.320 1.00 0.00 H new ATOM 498 N THR A 405 -5.301 -18.036 -6.317 1.00 0.00 N ATOM 499 CA THR A 405 -6.470 -18.647 -6.941 1.00 0.00 C ATOM 500 C THR A 405 -7.762 -18.036 -6.406 1.00 0.00 C ATOM 501 O THR A 405 -8.762 -17.953 -7.118 1.00 0.00 O ATOM 502 CB THR A 405 -6.470 -20.158 -6.700 1.00 0.00 C ATOM 503 OG1 THR A 405 -5.145 -20.648 -6.592 1.00 0.00 O ATOM 504 CG2 THR A 405 -7.160 -20.939 -7.797 1.00 0.00 C ATOM 0 H THR A 405 -5.317 -18.042 -5.297 1.00 0.00 H new ATOM 0 HA THR A 405 -6.418 -18.454 -8.013 1.00 0.00 H new ATOM 0 HB THR A 405 -7.022 -20.303 -5.771 1.00 0.00 H new ATOM 0 HG1 THR A 405 -5.157 -21.628 -6.597 1.00 0.00 H new ATOM 0 HG21 THR A 405 -7.124 -22.003 -7.564 1.00 0.00 H new ATOM 0 HG22 THR A 405 -8.199 -20.619 -7.873 1.00 0.00 H new ATOM 0 HG23 THR A 405 -6.654 -20.758 -8.746 1.00 0.00 H new ATOM 512 N ASP A 406 -7.735 -17.609 -5.146 1.00 0.00 N ATOM 513 CA ASP A 406 -8.905 -17.006 -4.517 1.00 0.00 C ATOM 514 C ASP A 406 -9.029 -15.535 -4.899 1.00 0.00 C ATOM 515 O ASP A 406 -8.051 -14.902 -5.300 1.00 0.00 O ATOM 516 CB ASP A 406 -8.816 -17.151 -2.996 1.00 0.00 C ATOM 517 CG ASP A 406 -9.992 -16.509 -2.280 1.00 0.00 C ATOM 518 OD1 ASP A 406 -11.022 -17.192 -2.098 1.00 0.00 O ATOM 519 OD2 ASP A 406 -9.880 -15.324 -1.902 1.00 0.00 O ATOM 0 H ASP A 406 -6.916 -17.670 -4.541 1.00 0.00 H new ATOM 0 HA ASP A 406 -9.794 -17.527 -4.873 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -8.771 -18.209 -2.737 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -7.889 -16.697 -2.645 1.00 0.00 H new ATOM 524 N LYS A 407 -10.237 -14.994 -4.774 1.00 0.00 N ATOM 525 CA LYS A 407 -10.492 -13.596 -5.107 1.00 0.00 C ATOM 526 C LYS A 407 -9.596 -12.665 -4.296 1.00 0.00 C ATOM 527 O LYS A 407 -9.337 -11.528 -4.699 1.00 0.00 O ATOM 528 CB LYS A 407 -11.962 -13.251 -4.858 1.00 0.00 C ATOM 529 CG LYS A 407 -12.447 -13.624 -3.467 1.00 0.00 C ATOM 530 CD LYS A 407 -12.467 -12.417 -2.542 1.00 0.00 C ATOM 531 CE LYS A 407 -13.865 -11.829 -2.425 1.00 0.00 C ATOM 532 NZ LYS A 407 -14.240 -11.047 -3.635 1.00 0.00 N ATOM 0 H LYS A 407 -11.057 -15.504 -4.444 1.00 0.00 H new ATOM 0 HA LYS A 407 -10.265 -13.456 -6.164 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -12.106 -12.181 -5.009 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -12.577 -13.763 -5.598 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -13.448 -14.051 -3.532 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -11.799 -14.394 -3.049 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -12.109 -12.708 -1.554 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -11.782 -11.657 -2.918 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -14.586 -12.633 -2.274 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -13.916 -11.186 -1.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -15.199 -10.663 -3.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -13.567 -10.265 -3.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -14.216 -11.667 -4.470 1.00 0.00 H new ATOM 546 N ALA A 408 -9.121 -13.150 -3.152 1.00 0.00 N ATOM 547 CA ALA A 408 -8.252 -12.360 -2.289 1.00 0.00 C ATOM 548 C ALA A 408 -7.067 -11.796 -3.066 1.00 0.00 C ATOM 549 O ALA A 408 -6.933 -10.586 -3.217 1.00 0.00 O ATOM 550 CB ALA A 408 -7.766 -13.201 -1.117 1.00 0.00 C ATOM 0 H ALA A 408 -9.324 -14.086 -2.802 1.00 0.00 H new ATOM 0 HA ALA A 408 -8.831 -11.520 -1.905 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -7.118 -12.598 -0.481 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -8.622 -13.548 -0.538 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -7.209 -14.060 -1.492 1.00 0.00 H new ATOM 556 N TYR A 409 -6.213 -12.686 -3.562 1.00 0.00 N ATOM 557 CA TYR A 409 -5.038 -12.279 -4.329 1.00 0.00 C ATOM 558 C TYR A 409 -5.408 -11.250 -5.395 1.00 0.00 C ATOM 559 O TYR A 409 -4.669 -10.290 -5.629 1.00 0.00 O ATOM 560 CB TYR A 409 -4.387 -13.495 -4.982 1.00 0.00 C ATOM 561 CG TYR A 409 -2.952 -13.268 -5.401 1.00 0.00 C ATOM 562 CD1 TYR A 409 -1.912 -13.433 -4.496 1.00 0.00 C ATOM 563 CD2 TYR A 409 -2.639 -12.889 -6.700 1.00 0.00 C ATOM 564 CE1 TYR A 409 -0.599 -13.227 -4.874 1.00 0.00 C ATOM 565 CE2 TYR A 409 -1.329 -12.682 -7.086 1.00 0.00 C ATOM 566 CZ TYR A 409 -0.313 -12.852 -6.170 1.00 0.00 C ATOM 567 OH TYR A 409 0.993 -12.647 -6.550 1.00 0.00 O ATOM 0 H TYR A 409 -6.312 -13.695 -3.447 1.00 0.00 H new ATOM 0 HA TYR A 409 -4.328 -11.819 -3.641 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.424 -14.333 -4.286 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -4.970 -13.782 -5.857 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -2.133 -13.727 -3.481 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -3.433 -12.754 -7.420 1.00 0.00 H new ATOM 0 HE1 TYR A 409 0.199 -13.359 -4.158 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -1.102 -12.388 -8.100 1.00 0.00 H new ATOM 0 HH TYR A 409 1.207 -11.693 -6.484 1.00 0.00 H new ATOM 577 N TRP A 410 -6.558 -11.448 -6.033 1.00 0.00 N ATOM 578 CA TRP A 410 -7.024 -10.529 -7.065 1.00 0.00 C ATOM 579 C TRP A 410 -7.146 -9.120 -6.502 1.00 0.00 C ATOM 580 O TRP A 410 -6.423 -8.210 -6.912 1.00 0.00 O ATOM 581 CB TRP A 410 -8.378 -10.978 -7.619 1.00 0.00 C ATOM 582 CG TRP A 410 -8.376 -12.372 -8.168 1.00 0.00 C ATOM 583 CD1 TRP A 410 -7.288 -13.153 -8.435 1.00 0.00 C ATOM 584 CD2 TRP A 410 -9.525 -13.147 -8.522 1.00 0.00 C ATOM 585 NE1 TRP A 410 -7.692 -14.368 -8.932 1.00 0.00 N ATOM 586 CE2 TRP A 410 -9.060 -14.390 -8.995 1.00 0.00 C ATOM 587 CE3 TRP A 410 -10.902 -12.911 -8.483 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -9.927 -15.391 -9.427 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -11.760 -13.906 -8.911 1.00 0.00 C ATOM 590 CH2 TRP A 410 -11.269 -15.132 -9.378 1.00 0.00 C ATOM 0 H TRP A 410 -7.182 -12.234 -5.854 1.00 0.00 H new ATOM 0 HA TRP A 410 -6.294 -10.531 -7.874 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -9.124 -10.911 -6.827 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -8.685 -10.288 -8.405 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -6.261 -12.859 -8.278 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -7.074 -15.130 -9.209 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -11.288 -11.968 -8.125 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -9.553 -16.338 -9.788 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -12.826 -13.736 -8.885 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -11.965 -15.889 -9.707 1.00 0.00 H new ATOM 601 N LEU A 411 -8.060 -8.949 -5.553 1.00 0.00 N ATOM 602 CA LEU A 411 -8.269 -7.651 -4.925 1.00 0.00 C ATOM 603 C LEU A 411 -7.014 -7.206 -4.180 1.00 0.00 C ATOM 604 O LEU A 411 -6.786 -6.011 -3.987 1.00 0.00 O ATOM 605 CB LEU A 411 -9.464 -7.704 -3.970 1.00 0.00 C ATOM 606 CG LEU A 411 -9.403 -8.803 -2.907 1.00 0.00 C ATOM 607 CD1 LEU A 411 -8.601 -8.340 -1.699 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.808 -9.217 -2.492 1.00 0.00 C ATOM 0 H LEU A 411 -8.666 -9.691 -5.203 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.482 -6.923 -5.708 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -9.550 -6.740 -3.468 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -10.372 -7.840 -4.558 1.00 0.00 H new ATOM 0 HG LEU A 411 -8.900 -9.669 -3.336 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -8.570 -9.137 -0.956 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -7.585 -8.094 -2.009 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -9.072 -7.458 -1.266 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.748 -9.999 -1.735 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -11.335 -8.355 -2.082 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -11.348 -9.593 -3.361 1.00 0.00 H new ATOM 620 N LEU A 412 -6.196 -8.175 -3.771 1.00 0.00 N ATOM 621 CA LEU A 412 -4.958 -7.882 -3.060 1.00 0.00 C ATOM 622 C LEU A 412 -4.045 -7.011 -3.915 1.00 0.00 C ATOM 623 O LEU A 412 -3.804 -5.843 -3.602 1.00 0.00 O ATOM 624 CB LEU A 412 -4.232 -9.179 -2.690 1.00 0.00 C ATOM 625 CG LEU A 412 -4.694 -9.849 -1.391 1.00 0.00 C ATOM 626 CD1 LEU A 412 -3.810 -11.041 -1.063 1.00 0.00 C ATOM 627 CD2 LEU A 412 -4.689 -8.850 -0.246 1.00 0.00 C ATOM 0 H LEU A 412 -6.371 -9.169 -3.921 1.00 0.00 H new ATOM 0 HA LEU A 412 -5.211 -7.343 -2.147 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -4.355 -9.889 -3.508 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -3.166 -8.967 -2.609 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.714 -10.206 -1.531 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -4.153 -11.504 -0.138 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -3.863 -11.767 -1.874 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -2.779 -10.707 -0.942 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -5.020 -9.343 0.668 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -3.680 -8.463 -0.105 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -5.364 -8.026 -0.479 1.00 0.00 H new ATOM 639 N GLU A 413 -3.540 -7.588 -5.003 1.00 0.00 N ATOM 640 CA GLU A 413 -2.655 -6.869 -5.911 1.00 0.00 C ATOM 641 C GLU A 413 -3.376 -5.688 -6.549 1.00 0.00 C ATOM 642 O GLU A 413 -2.793 -4.619 -6.735 1.00 0.00 O ATOM 643 CB GLU A 413 -2.132 -7.811 -6.997 1.00 0.00 C ATOM 644 CG GLU A 413 -0.690 -7.541 -7.392 1.00 0.00 C ATOM 645 CD GLU A 413 -0.340 -8.118 -8.750 1.00 0.00 C ATOM 646 OE1 GLU A 413 -0.455 -9.351 -8.918 1.00 0.00 O ATOM 647 OE2 GLU A 413 0.050 -7.338 -9.644 1.00 0.00 O ATOM 0 H GLU A 413 -3.730 -8.552 -5.276 1.00 0.00 H new ATOM 0 HA GLU A 413 -1.812 -6.488 -5.334 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -2.218 -8.840 -6.646 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -2.765 -7.721 -7.880 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -0.515 -6.465 -7.402 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -0.025 -7.965 -6.639 1.00 0.00 H new ATOM 654 N GLU A 414 -4.648 -5.885 -6.881 1.00 0.00 N ATOM 655 CA GLU A 414 -5.449 -4.833 -7.498 1.00 0.00 C ATOM 656 C GLU A 414 -5.523 -3.608 -6.593 1.00 0.00 C ATOM 657 O GLU A 414 -5.184 -2.498 -7.005 1.00 0.00 O ATOM 658 CB GLU A 414 -6.858 -5.346 -7.800 1.00 0.00 C ATOM 659 CG GLU A 414 -6.951 -6.138 -9.094 1.00 0.00 C ATOM 660 CD GLU A 414 -8.204 -5.817 -9.884 1.00 0.00 C ATOM 661 OE1 GLU A 414 -9.278 -6.357 -9.543 1.00 0.00 O ATOM 662 OE2 GLU A 414 -8.112 -5.026 -10.848 1.00 0.00 O ATOM 0 H GLU A 414 -5.146 -6.763 -6.733 1.00 0.00 H new ATOM 0 HA GLU A 414 -4.969 -4.544 -8.433 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -7.192 -5.974 -6.974 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -7.541 -4.498 -7.852 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -6.075 -5.928 -9.708 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -6.933 -7.204 -8.866 1.00 0.00 H new ATOM 669 N MET A 415 -5.964 -3.817 -5.357 1.00 0.00 N ATOM 670 CA MET A 415 -6.079 -2.728 -4.393 1.00 0.00 C ATOM 671 C MET A 415 -4.720 -2.078 -4.149 1.00 0.00 C ATOM 672 O MET A 415 -4.610 -0.853 -4.093 1.00 0.00 O ATOM 673 CB MET A 415 -6.657 -3.242 -3.074 1.00 0.00 C ATOM 674 CG MET A 415 -7.291 -2.154 -2.223 1.00 0.00 C ATOM 675 SD MET A 415 -9.002 -1.818 -2.685 1.00 0.00 S ATOM 676 CE MET A 415 -9.755 -3.414 -2.374 1.00 0.00 C ATOM 0 H MET A 415 -6.247 -4.729 -4.999 1.00 0.00 H new ATOM 0 HA MET A 415 -6.754 -1.978 -4.806 1.00 0.00 H new ATOM 0 HB2 MET A 415 -7.404 -4.006 -3.288 1.00 0.00 H new ATOM 0 HB3 MET A 415 -5.864 -3.723 -2.502 1.00 0.00 H new ATOM 0 HG2 MET A 415 -7.253 -2.450 -1.175 1.00 0.00 H new ATOM 0 HG3 MET A 415 -6.707 -1.238 -2.317 1.00 0.00 H new ATOM 0 HE1 MET A 415 -10.815 -3.280 -2.159 1.00 0.00 H new ATOM 0 HE2 MET A 415 -9.640 -4.048 -3.253 1.00 0.00 H new ATOM 0 HE3 MET A 415 -9.268 -3.886 -1.520 1.00 0.00 H new ATOM 686 N LEU A 416 -3.690 -2.906 -4.007 1.00 0.00 N ATOM 687 CA LEU A 416 -2.339 -2.408 -3.772 1.00 0.00 C ATOM 688 C LEU A 416 -1.893 -1.492 -4.908 1.00 0.00 C ATOM 689 O LEU A 416 -1.403 -0.387 -4.672 1.00 0.00 O ATOM 690 CB LEU A 416 -1.359 -3.575 -3.630 1.00 0.00 C ATOM 691 CG LEU A 416 -1.598 -4.479 -2.420 1.00 0.00 C ATOM 692 CD1 LEU A 416 -1.136 -5.901 -2.713 1.00 0.00 C ATOM 693 CD2 LEU A 416 -0.886 -3.926 -1.194 1.00 0.00 C ATOM 0 H LEU A 416 -3.764 -3.922 -4.050 1.00 0.00 H new ATOM 0 HA LEU A 416 -2.346 -1.834 -2.845 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -1.408 -4.183 -4.533 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -0.347 -3.174 -3.570 1.00 0.00 H new ATOM 0 HG LEU A 416 -2.668 -4.504 -2.215 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -1.314 -6.529 -1.840 1.00 0.00 H new ATOM 0 HD12 LEU A 416 -1.691 -6.296 -3.564 1.00 0.00 H new ATOM 0 HD13 LEU A 416 -0.071 -5.897 -2.945 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -1.067 -4.581 -0.342 1.00 0.00 H new ATOM 0 HD22 LEU A 416 0.185 -3.871 -1.389 1.00 0.00 H new ATOM 0 HD23 LEU A 416 -1.266 -2.929 -0.972 1.00 0.00 H new ATOM 705 N THR A 417 -2.067 -1.959 -6.140 1.00 0.00 N ATOM 706 CA THR A 417 -1.685 -1.182 -7.313 1.00 0.00 C ATOM 707 C THR A 417 -2.443 0.140 -7.360 1.00 0.00 C ATOM 708 O THR A 417 -1.866 1.189 -7.648 1.00 0.00 O ATOM 709 CB THR A 417 -1.948 -1.982 -8.589 1.00 0.00 C ATOM 710 OG1 THR A 417 -3.260 -2.516 -8.584 1.00 0.00 O ATOM 711 CG2 THR A 417 -0.985 -3.132 -8.785 1.00 0.00 C ATOM 0 H THR A 417 -2.470 -2.872 -6.352 1.00 0.00 H new ATOM 0 HA THR A 417 -0.619 -0.966 -7.243 1.00 0.00 H new ATOM 0 HB THR A 417 -1.812 -1.274 -9.406 1.00 0.00 H new ATOM 0 HG1 THR A 417 -3.669 -2.371 -7.705 1.00 0.00 H new ATOM 0 HG21 THR A 417 -1.228 -3.657 -9.709 1.00 0.00 H new ATOM 0 HG22 THR A 417 0.033 -2.748 -8.843 1.00 0.00 H new ATOM 0 HG23 THR A 417 -1.065 -3.821 -7.944 1.00 0.00 H new ATOM 719 N LYS A 418 -3.741 0.082 -7.076 1.00 0.00 N ATOM 720 CA LYS A 418 -4.580 1.277 -7.084 1.00 0.00 C ATOM 721 C LYS A 418 -4.044 2.325 -6.114 1.00 0.00 C ATOM 722 O LYS A 418 -3.786 3.466 -6.499 1.00 0.00 O ATOM 723 CB LYS A 418 -6.020 0.914 -6.717 1.00 0.00 C ATOM 724 CG LYS A 418 -6.668 -0.060 -7.687 1.00 0.00 C ATOM 725 CD LYS A 418 -7.395 0.668 -8.807 1.00 0.00 C ATOM 726 CE LYS A 418 -6.490 0.889 -10.009 1.00 0.00 C ATOM 727 NZ LYS A 418 -7.221 0.713 -11.294 1.00 0.00 N ATOM 0 H LYS A 418 -4.234 -0.778 -6.838 1.00 0.00 H new ATOM 0 HA LYS A 418 -4.563 1.698 -8.089 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -6.033 0.481 -5.717 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -6.617 1.825 -6.677 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -5.906 -0.714 -8.111 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -7.371 -0.697 -7.150 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -8.269 0.091 -9.110 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -7.758 1.629 -8.442 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -6.068 1.893 -9.966 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -5.655 0.190 -9.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -6.569 0.872 -12.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -7.602 -0.253 -11.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -8.003 1.397 -11.345 1.00 0.00 H new ATOM 741 N GLU A 419 -3.878 1.932 -4.857 1.00 0.00 N ATOM 742 CA GLU A 419 -3.372 2.838 -3.832 1.00 0.00 C ATOM 743 C GLU A 419 -1.990 3.363 -4.206 1.00 0.00 C ATOM 744 O GLU A 419 -1.665 4.521 -3.949 1.00 0.00 O ATOM 745 CB GLU A 419 -3.311 2.128 -2.478 1.00 0.00 C ATOM 746 CG GLU A 419 -2.413 0.903 -2.473 1.00 0.00 C ATOM 747 CD GLU A 419 -2.176 0.358 -1.078 1.00 0.00 C ATOM 748 OE1 GLU A 419 -3.086 0.483 -0.231 1.00 0.00 O ATOM 749 OE2 GLU A 419 -1.082 -0.193 -0.833 1.00 0.00 O ATOM 0 H GLU A 419 -4.086 0.991 -4.522 1.00 0.00 H new ATOM 0 HA GLU A 419 -4.056 3.684 -3.760 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -2.956 2.831 -1.724 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -4.319 1.831 -2.188 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -2.862 0.126 -3.091 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -1.455 1.158 -2.927 1.00 0.00 H new ATOM 756 N LEU A 420 -1.181 2.503 -4.818 1.00 0.00 N ATOM 757 CA LEU A 420 0.165 2.882 -5.231 1.00 0.00 C ATOM 758 C LEU A 420 0.123 4.043 -6.218 1.00 0.00 C ATOM 759 O LEU A 420 0.777 5.066 -6.017 1.00 0.00 O ATOM 760 CB LEU A 420 0.883 1.686 -5.861 1.00 0.00 C ATOM 761 CG LEU A 420 2.408 1.707 -5.733 1.00 0.00 C ATOM 762 CD1 LEU A 420 2.942 0.302 -5.495 1.00 0.00 C ATOM 763 CD2 LEU A 420 3.039 2.315 -6.976 1.00 0.00 C ATOM 0 H LEU A 420 -1.435 1.540 -5.038 1.00 0.00 H new ATOM 0 HA LEU A 420 0.715 3.201 -4.346 1.00 0.00 H new ATOM 0 HB2 LEU A 420 0.507 0.772 -5.401 1.00 0.00 H new ATOM 0 HB3 LEU A 420 0.623 1.641 -6.918 1.00 0.00 H new ATOM 0 HG LEU A 420 2.674 2.326 -4.876 1.00 0.00 H new ATOM 0 HD11 LEU A 420 4.028 0.336 -5.406 1.00 0.00 H new ATOM 0 HD12 LEU A 420 2.515 -0.099 -4.576 1.00 0.00 H new ATOM 0 HD13 LEU A 420 2.666 -0.339 -6.332 1.00 0.00 H new ATOM 0 HD21 LEU A 420 4.124 2.322 -6.867 1.00 0.00 H new ATOM 0 HD22 LEU A 420 2.766 1.723 -7.849 1.00 0.00 H new ATOM 0 HD23 LEU A 420 2.681 3.337 -7.103 1.00 0.00 H new ATOM 775 N LEU A 421 -0.652 3.879 -7.285 1.00 0.00 N ATOM 776 CA LEU A 421 -0.781 4.916 -8.302 1.00 0.00 C ATOM 777 C LEU A 421 -1.428 6.169 -7.721 1.00 0.00 C ATOM 778 O LEU A 421 -1.104 7.288 -8.117 1.00 0.00 O ATOM 779 CB LEU A 421 -1.608 4.402 -9.483 1.00 0.00 C ATOM 780 CG LEU A 421 -1.021 3.187 -10.203 1.00 0.00 C ATOM 781 CD1 LEU A 421 -2.070 2.536 -11.091 1.00 0.00 C ATOM 782 CD2 LEU A 421 0.196 3.590 -11.020 1.00 0.00 C ATOM 0 H LEU A 421 -1.200 3.038 -7.468 1.00 0.00 H new ATOM 0 HA LEU A 421 0.219 5.173 -8.652 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -2.605 4.146 -9.125 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -1.726 5.211 -10.204 1.00 0.00 H new ATOM 0 HG LEU A 421 -0.707 2.460 -9.454 1.00 0.00 H new ATOM 0 HD11 LEU A 421 -1.635 1.673 -11.596 1.00 0.00 H new ATOM 0 HD12 LEU A 421 -2.913 2.212 -10.481 1.00 0.00 H new ATOM 0 HD13 LEU A 421 -2.415 3.255 -11.834 1.00 0.00 H new ATOM 0 HD21 LEU A 421 0.601 2.714 -11.526 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -0.094 4.335 -11.761 1.00 0.00 H new ATOM 0 HD23 LEU A 421 0.954 4.011 -10.360 1.00 0.00 H new ATOM 794 N GLU A 422 -2.345 5.972 -6.778 1.00 0.00 N ATOM 795 CA GLU A 422 -3.038 7.086 -6.141 1.00 0.00 C ATOM 796 C GLU A 422 -2.053 7.999 -5.417 1.00 0.00 C ATOM 797 O GLU A 422 -1.943 9.183 -5.732 1.00 0.00 O ATOM 798 CB GLU A 422 -4.087 6.566 -5.157 1.00 0.00 C ATOM 799 CG GLU A 422 -5.362 7.395 -5.133 1.00 0.00 C ATOM 800 CD GLU A 422 -6.601 6.551 -4.915 1.00 0.00 C ATOM 801 OE1 GLU A 422 -6.578 5.355 -5.275 1.00 0.00 O ATOM 802 OE2 GLU A 422 -7.598 7.085 -4.385 1.00 0.00 O ATOM 0 H GLU A 422 -2.625 5.052 -6.439 1.00 0.00 H new ATOM 0 HA GLU A 422 -3.535 7.664 -6.920 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -4.337 5.537 -5.415 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -3.656 6.547 -4.156 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -5.291 8.141 -4.342 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -5.457 7.937 -6.074 1.00 0.00 H new ATOM 809 N LEU A 423 -1.339 7.440 -4.445 1.00 0.00 N ATOM 810 CA LEU A 423 -0.363 8.204 -3.677 1.00 0.00 C ATOM 811 C LEU A 423 0.783 8.674 -4.566 1.00 0.00 C ATOM 812 O LEU A 423 1.367 9.734 -4.336 1.00 0.00 O ATOM 813 CB LEU A 423 0.183 7.362 -2.523 1.00 0.00 C ATOM 814 CG LEU A 423 0.962 6.115 -2.943 1.00 0.00 C ATOM 815 CD1 LEU A 423 2.446 6.426 -3.058 1.00 0.00 C ATOM 816 CD2 LEU A 423 0.729 4.982 -1.956 1.00 0.00 C ATOM 0 H LEU A 423 -1.418 6.461 -4.171 1.00 0.00 H new ATOM 0 HA LEU A 423 -0.866 9.081 -3.270 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.833 7.989 -1.912 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -0.651 7.055 -1.891 1.00 0.00 H new ATOM 0 HG LEU A 423 0.601 5.798 -3.921 1.00 0.00 H new ATOM 0 HD11 LEU A 423 2.984 5.527 -3.358 1.00 0.00 H new ATOM 0 HD12 LEU A 423 2.598 7.205 -3.805 1.00 0.00 H new ATOM 0 HD13 LEU A 423 2.822 6.769 -2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 423 1.291 4.103 -2.272 1.00 0.00 H new ATOM 0 HD22 LEU A 423 1.062 5.289 -0.964 1.00 0.00 H new ATOM 0 HD23 LEU A 423 -0.333 4.740 -1.924 1.00 0.00 H new ATOM 828 N ASP A 424 1.101 7.879 -5.583 1.00 0.00 N ATOM 829 CA ASP A 424 2.179 8.212 -6.510 1.00 0.00 C ATOM 830 C ASP A 424 1.978 9.601 -7.112 1.00 0.00 C ATOM 831 O ASP A 424 2.935 10.249 -7.532 1.00 0.00 O ATOM 832 CB ASP A 424 2.261 7.169 -7.626 1.00 0.00 C ATOM 833 CG ASP A 424 3.202 6.031 -7.286 1.00 0.00 C ATOM 834 OD1 ASP A 424 4.030 6.200 -6.367 1.00 0.00 O ATOM 835 OD2 ASP A 424 3.111 4.969 -7.937 1.00 0.00 O ATOM 0 H ASP A 424 0.628 6.999 -5.787 1.00 0.00 H new ATOM 0 HA ASP A 424 3.114 8.212 -5.950 1.00 0.00 H new ATOM 0 HB2 ASP A 424 1.266 6.768 -7.819 1.00 0.00 H new ATOM 0 HB3 ASP A 424 2.595 7.650 -8.545 1.00 0.00 H new ATOM 840 N SER A 425 0.726 10.051 -7.152 1.00 0.00 N ATOM 841 CA SER A 425 0.404 11.362 -7.703 1.00 0.00 C ATOM 842 C SER A 425 0.282 12.407 -6.598 1.00 0.00 C ATOM 843 O SER A 425 -0.576 13.289 -6.656 1.00 0.00 O ATOM 844 CB SER A 425 -0.898 11.294 -8.504 1.00 0.00 C ATOM 845 OG SER A 425 -1.156 9.974 -8.948 1.00 0.00 O ATOM 0 H SER A 425 -0.080 9.527 -6.810 1.00 0.00 H new ATOM 0 HA SER A 425 1.217 11.658 -8.366 1.00 0.00 H new ATOM 0 HB2 SER A 425 -1.727 11.642 -7.887 1.00 0.00 H new ATOM 0 HB3 SER A 425 -0.836 11.964 -9.362 1.00 0.00 H new ATOM 0 HG SER A 425 -1.994 9.958 -9.456 1.00 0.00 H new ATOM 851 N VAL A 426 1.143 12.302 -5.591 1.00 0.00 N ATOM 852 CA VAL A 426 1.129 13.238 -4.474 1.00 0.00 C ATOM 853 C VAL A 426 2.006 14.453 -4.765 1.00 0.00 C ATOM 854 O VAL A 426 3.094 14.326 -5.326 1.00 0.00 O ATOM 855 CB VAL A 426 1.609 12.567 -3.171 1.00 0.00 C ATOM 856 CG1 VAL A 426 3.048 12.092 -3.307 1.00 0.00 C ATOM 857 CG2 VAL A 426 1.461 13.519 -1.993 1.00 0.00 C ATOM 0 H VAL A 426 1.859 11.578 -5.526 1.00 0.00 H new ATOM 0 HA VAL A 426 0.096 13.562 -4.345 1.00 0.00 H new ATOM 0 HB VAL A 426 0.983 11.695 -2.984 1.00 0.00 H new ATOM 0 HG11 VAL A 426 3.366 11.622 -2.376 1.00 0.00 H new ATOM 0 HG12 VAL A 426 3.117 11.370 -4.120 1.00 0.00 H new ATOM 0 HG13 VAL A 426 3.693 12.944 -3.522 1.00 0.00 H new ATOM 0 HG21 VAL A 426 1.805 13.028 -1.083 1.00 0.00 H new ATOM 0 HG22 VAL A 426 2.059 14.413 -2.171 1.00 0.00 H new ATOM 0 HG23 VAL A 426 0.414 13.799 -1.881 1.00 0.00 H new ATOM 867 N GLU A 427 1.524 15.630 -4.380 1.00 0.00 N ATOM 868 CA GLU A 427 2.264 16.867 -4.600 1.00 0.00 C ATOM 869 C GLU A 427 3.059 17.255 -3.358 1.00 0.00 C ATOM 870 O GLU A 427 2.524 17.858 -2.428 1.00 0.00 O ATOM 871 CB GLU A 427 1.310 18.000 -4.983 1.00 0.00 C ATOM 872 CG GLU A 427 0.076 18.084 -4.099 1.00 0.00 C ATOM 873 CD GLU A 427 -0.734 19.340 -4.347 1.00 0.00 C ATOM 874 OE1 GLU A 427 -1.449 19.394 -5.370 1.00 0.00 O ATOM 875 OE2 GLU A 427 -0.655 20.271 -3.518 1.00 0.00 O ATOM 0 H GLU A 427 0.625 15.753 -3.914 1.00 0.00 H new ATOM 0 HA GLU A 427 2.963 16.699 -5.419 1.00 0.00 H new ATOM 0 HB2 GLU A 427 1.847 18.947 -4.934 1.00 0.00 H new ATOM 0 HB3 GLU A 427 0.996 17.865 -6.018 1.00 0.00 H new ATOM 0 HG2 GLU A 427 -0.552 17.211 -4.274 1.00 0.00 H new ATOM 0 HG3 GLU A 427 0.380 18.053 -3.053 1.00 0.00 H new ATOM 882 N THR A 428 4.341 16.902 -3.348 1.00 0.00 N ATOM 883 CA THR A 428 5.211 17.212 -2.220 1.00 0.00 C ATOM 884 C THR A 428 6.558 17.737 -2.700 1.00 0.00 C ATOM 885 O THR A 428 7.447 16.962 -3.055 1.00 0.00 O ATOM 886 CB THR A 428 5.414 15.969 -1.351 1.00 0.00 C ATOM 887 OG1 THR A 428 4.168 15.432 -0.944 1.00 0.00 O ATOM 888 CG2 THR A 428 6.226 16.240 -0.103 1.00 0.00 C ATOM 0 H THR A 428 4.800 16.401 -4.109 1.00 0.00 H new ATOM 0 HA THR A 428 4.731 17.989 -1.625 1.00 0.00 H new ATOM 0 HB THR A 428 5.961 15.264 -1.977 1.00 0.00 H new ATOM 0 HG1 THR A 428 3.508 16.153 -0.874 1.00 0.00 H new ATOM 0 HG21 THR A 428 6.333 15.318 0.469 1.00 0.00 H new ATOM 0 HG22 THR A 428 7.212 16.610 -0.384 1.00 0.00 H new ATOM 0 HG23 THR A 428 5.718 16.988 0.506 1.00 0.00 H new ATOM 896 N GLY A 429 6.704 19.058 -2.710 1.00 0.00 N ATOM 897 CA GLY A 429 7.946 19.665 -3.150 1.00 0.00 C ATOM 898 C GLY A 429 8.744 20.252 -2.002 1.00 0.00 C ATOM 899 O GLY A 429 9.496 21.211 -2.185 1.00 0.00 O ATOM 0 H GLY A 429 5.983 19.719 -2.421 1.00 0.00 H new ATOM 0 HA2 GLY A 429 8.550 18.917 -3.663 1.00 0.00 H new ATOM 0 HA3 GLY A 429 7.727 20.449 -3.874 1.00 0.00 H new ATOM 903 N GLY A 430 8.582 19.677 -0.814 1.00 0.00 N ATOM 904 CA GLY A 430 9.299 20.161 0.349 1.00 0.00 C ATOM 905 C GLY A 430 8.488 20.042 1.624 1.00 0.00 C ATOM 906 O GLY A 430 8.189 21.044 2.273 1.00 0.00 O ATOM 0 H GLY A 430 7.966 18.884 -0.637 1.00 0.00 H new ATOM 0 HA2 GLY A 430 10.227 19.600 0.459 1.00 0.00 H new ATOM 0 HA3 GLY A 430 9.574 21.204 0.194 1.00 0.00 H new ATOM 910 N GLN A 431 8.130 18.814 1.983 1.00 0.00 N ATOM 911 CA GLN A 431 7.348 18.566 3.187 1.00 0.00 C ATOM 912 C GLN A 431 7.950 17.427 4.003 1.00 0.00 C ATOM 913 O GLN A 431 8.009 16.286 3.544 1.00 0.00 O ATOM 914 CB GLN A 431 5.899 18.237 2.821 1.00 0.00 C ATOM 915 CG GLN A 431 4.908 18.537 3.934 1.00 0.00 C ATOM 916 CD GLN A 431 4.990 19.973 4.416 1.00 0.00 C ATOM 917 OE1 GLN A 431 4.253 20.860 3.757 1.00 0.00 O flip ATOM 918 NE2 GLN A 431 5.705 20.280 5.368 1.00 0.00 N flip ATOM 0 H GLN A 431 8.370 17.974 1.456 1.00 0.00 H new ATOM 0 HA GLN A 431 7.366 19.471 3.794 1.00 0.00 H new ATOM 0 HB2 GLN A 431 5.619 18.805 1.934 1.00 0.00 H new ATOM 0 HB3 GLN A 431 5.830 17.181 2.559 1.00 0.00 H new ATOM 0 HG2 GLN A 431 3.897 18.333 3.580 1.00 0.00 H new ATOM 0 HG3 GLN A 431 5.094 17.865 4.772 1.00 0.00 H new ATOM 0 HE21 GLN A 431 6.254 19.565 5.845 1.00 0.00 H new ATOM 0 HE22 GLN A 431 5.749 21.250 5.681 1.00 0.00 H new ATOM 927 N ASP A 432 8.398 17.743 5.214 1.00 0.00 N ATOM 928 CA ASP A 432 8.997 16.747 6.093 1.00 0.00 C ATOM 929 C ASP A 432 7.998 15.642 6.429 1.00 0.00 C ATOM 930 O ASP A 432 8.345 14.461 6.437 1.00 0.00 O ATOM 931 CB ASP A 432 9.497 17.406 7.379 1.00 0.00 C ATOM 932 CG ASP A 432 10.937 17.866 7.273 1.00 0.00 C ATOM 933 OD1 ASP A 432 11.776 17.079 6.784 1.00 0.00 O ATOM 934 OD2 ASP A 432 11.227 19.012 7.676 1.00 0.00 O ATOM 0 H ASP A 432 8.357 18.683 5.609 1.00 0.00 H new ATOM 0 HA ASP A 432 9.842 16.300 5.569 1.00 0.00 H new ATOM 0 HB2 ASP A 432 8.863 18.260 7.616 1.00 0.00 H new ATOM 0 HB3 ASP A 432 9.404 16.701 8.205 1.00 0.00 H new ATOM 939 N SER A 433 6.759 16.036 6.706 1.00 0.00 N ATOM 940 CA SER A 433 5.711 15.080 7.044 1.00 0.00 C ATOM 941 C SER A 433 5.507 14.075 5.915 1.00 0.00 C ATOM 942 O SER A 433 5.598 12.864 6.122 1.00 0.00 O ATOM 943 CB SER A 433 4.399 15.809 7.337 1.00 0.00 C ATOM 944 OG SER A 433 4.642 17.111 7.842 1.00 0.00 O ATOM 0 H SER A 433 6.457 17.010 6.703 1.00 0.00 H new ATOM 0 HA SER A 433 6.023 14.538 7.937 1.00 0.00 H new ATOM 0 HB2 SER A 433 3.804 15.874 6.426 1.00 0.00 H new ATOM 0 HB3 SER A 433 3.815 15.238 8.059 1.00 0.00 H new ATOM 0 HG SER A 433 3.788 17.558 8.020 1.00 0.00 H new ATOM 950 N VAL A 434 5.229 14.586 4.721 1.00 0.00 N ATOM 951 CA VAL A 434 5.012 13.734 3.558 1.00 0.00 C ATOM 952 C VAL A 434 6.232 12.865 3.277 1.00 0.00 C ATOM 953 O VAL A 434 6.104 11.699 2.910 1.00 0.00 O ATOM 954 CB VAL A 434 4.683 14.565 2.303 1.00 0.00 C ATOM 955 CG1 VAL A 434 4.329 13.657 1.133 1.00 0.00 C ATOM 956 CG2 VAL A 434 3.554 15.542 2.593 1.00 0.00 C ATOM 0 H VAL A 434 5.149 15.585 4.533 1.00 0.00 H new ATOM 0 HA VAL A 434 4.161 13.094 3.791 1.00 0.00 H new ATOM 0 HB VAL A 434 5.568 15.139 2.028 1.00 0.00 H new ATOM 0 HG11 VAL A 434 4.100 14.264 0.257 1.00 0.00 H new ATOM 0 HG12 VAL A 434 5.173 13.004 0.911 1.00 0.00 H new ATOM 0 HG13 VAL A 434 3.460 13.052 1.392 1.00 0.00 H new ATOM 0 HG21 VAL A 434 3.334 16.121 1.696 1.00 0.00 H new ATOM 0 HG22 VAL A 434 2.664 14.990 2.896 1.00 0.00 H new ATOM 0 HG23 VAL A 434 3.853 16.216 3.396 1.00 0.00 H new ATOM 966 N ARG A 435 7.418 13.441 3.451 1.00 0.00 N ATOM 967 CA ARG A 435 8.661 12.714 3.216 1.00 0.00 C ATOM 968 C ARG A 435 8.739 11.474 4.103 1.00 0.00 C ATOM 969 O ARG A 435 8.942 10.360 3.616 1.00 0.00 O ATOM 970 CB ARG A 435 9.865 13.621 3.473 1.00 0.00 C ATOM 971 CG ARG A 435 10.974 13.466 2.442 1.00 0.00 C ATOM 972 CD ARG A 435 12.288 13.060 3.088 1.00 0.00 C ATOM 973 NE ARG A 435 12.508 11.617 3.024 1.00 0.00 N ATOM 974 CZ ARG A 435 12.872 10.972 1.917 1.00 0.00 C ATOM 975 NH1 ARG A 435 13.055 11.637 0.783 1.00 0.00 N ATOM 976 NH2 ARG A 435 13.051 9.658 1.945 1.00 0.00 N ATOM 0 H ARG A 435 7.544 14.407 3.753 1.00 0.00 H new ATOM 0 HA ARG A 435 8.676 12.394 2.174 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.532 14.659 3.483 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.267 13.405 4.463 1.00 0.00 H new ATOM 0 HG2 ARG A 435 10.684 12.717 1.705 1.00 0.00 H new ATOM 0 HG3 ARG A 435 11.107 14.406 1.906 1.00 0.00 H new ATOM 0 HD2 ARG A 435 13.110 13.574 2.591 1.00 0.00 H new ATOM 0 HD3 ARG A 435 12.294 13.382 4.129 1.00 0.00 H new ATOM 0 HE ARG A 435 12.375 11.072 3.876 1.00 0.00 H new ATOM 0 HH11 ARG A 435 12.917 12.647 0.756 1.00 0.00 H new ATOM 0 HH12 ARG A 435 13.334 11.138 -0.062 1.00 0.00 H new ATOM 0 HH21 ARG A 435 12.910 9.142 2.814 1.00 0.00 H new ATOM 0 HH22 ARG A 435 13.330 9.163 1.098 1.00 0.00 H new ATOM 990 N GLN A 436 8.568 11.673 5.408 1.00 0.00 N ATOM 991 CA GLN A 436 8.610 10.568 6.358 1.00 0.00 C ATOM 992 C GLN A 436 7.556 9.523 6.010 1.00 0.00 C ATOM 993 O GLN A 436 7.865 8.342 5.844 1.00 0.00 O ATOM 994 CB GLN A 436 8.389 11.083 7.781 1.00 0.00 C ATOM 995 CG GLN A 436 9.197 10.336 8.830 1.00 0.00 C ATOM 996 CD GLN A 436 8.807 10.717 10.247 1.00 0.00 C ATOM 997 OE1 GLN A 436 7.931 11.556 10.456 1.00 0.00 O ATOM 998 NE2 GLN A 436 9.457 10.099 11.225 1.00 0.00 N ATOM 0 H GLN A 436 8.400 12.587 5.829 1.00 0.00 H new ATOM 0 HA GLN A 436 9.594 10.102 6.301 1.00 0.00 H new ATOM 0 HB2 GLN A 436 8.648 12.141 7.820 1.00 0.00 H new ATOM 0 HB3 GLN A 436 7.330 11.005 8.026 1.00 0.00 H new ATOM 0 HG2 GLN A 436 9.058 9.263 8.695 1.00 0.00 H new ATOM 0 HG3 GLN A 436 10.257 10.541 8.681 1.00 0.00 H new ATOM 0 HE21 GLN A 436 10.176 9.410 11.004 1.00 0.00 H new ATOM 0 HE22 GLN A 436 9.238 10.313 12.198 1.00 0.00 H new ATOM 1007 N ALA A 437 6.309 9.970 5.891 1.00 0.00 N ATOM 1008 CA ALA A 437 5.212 9.076 5.552 1.00 0.00 C ATOM 1009 C ALA A 437 5.450 8.420 4.198 1.00 0.00 C ATOM 1010 O ALA A 437 5.034 7.285 3.965 1.00 0.00 O ATOM 1011 CB ALA A 437 3.893 9.835 5.552 1.00 0.00 C ATOM 0 H ALA A 437 6.036 10.944 6.024 1.00 0.00 H new ATOM 0 HA ALA A 437 5.162 8.291 6.307 1.00 0.00 H new ATOM 0 HB1 ALA A 437 3.081 9.154 5.297 1.00 0.00 H new ATOM 0 HB2 ALA A 437 3.716 10.256 6.542 1.00 0.00 H new ATOM 0 HB3 ALA A 437 3.936 10.639 4.818 1.00 0.00 H new ATOM 1017 N ARG A 438 6.126 9.141 3.309 1.00 0.00 N ATOM 1018 CA ARG A 438 6.428 8.628 1.980 1.00 0.00 C ATOM 1019 C ARG A 438 7.315 7.393 2.074 1.00 0.00 C ATOM 1020 O ARG A 438 6.973 6.332 1.558 1.00 0.00 O ATOM 1021 CB ARG A 438 7.110 9.702 1.131 1.00 0.00 C ATOM 1022 CG ARG A 438 7.468 9.237 -0.272 1.00 0.00 C ATOM 1023 CD ARG A 438 7.861 10.403 -1.163 1.00 0.00 C ATOM 1024 NE ARG A 438 8.831 10.010 -2.183 1.00 0.00 N ATOM 1025 CZ ARG A 438 8.530 9.259 -3.240 1.00 0.00 C ATOM 1026 NH1 ARG A 438 7.291 8.816 -3.420 1.00 0.00 N ATOM 1027 NH2 ARG A 438 9.472 8.947 -4.121 1.00 0.00 N ATOM 0 H ARG A 438 6.475 10.083 3.486 1.00 0.00 H new ATOM 0 HA ARG A 438 5.490 8.349 1.501 1.00 0.00 H new ATOM 0 HB2 ARG A 438 6.452 10.568 1.060 1.00 0.00 H new ATOM 0 HB3 ARG A 438 8.017 10.031 1.638 1.00 0.00 H new ATOM 0 HG2 ARG A 438 8.291 8.524 -0.221 1.00 0.00 H new ATOM 0 HG3 ARG A 438 6.619 8.713 -0.710 1.00 0.00 H new ATOM 0 HD2 ARG A 438 6.971 10.807 -1.646 1.00 0.00 H new ATOM 0 HD3 ARG A 438 8.281 11.201 -0.551 1.00 0.00 H new ATOM 0 HE ARG A 438 9.794 10.330 -2.079 1.00 0.00 H new ATOM 0 HH11 ARG A 438 6.562 9.051 -2.746 1.00 0.00 H new ATOM 0 HH12 ARG A 438 7.068 8.241 -4.232 1.00 0.00 H new ATOM 0 HH21 ARG A 438 10.426 9.283 -3.988 1.00 0.00 H new ATOM 0 HH22 ARG A 438 9.242 8.372 -4.931 1.00 0.00 H new ATOM 1041 N LYS A 439 8.456 7.539 2.743 1.00 0.00 N ATOM 1042 CA LYS A 439 9.387 6.428 2.909 1.00 0.00 C ATOM 1043 C LYS A 439 8.719 5.285 3.667 1.00 0.00 C ATOM 1044 O LYS A 439 8.939 4.109 3.364 1.00 0.00 O ATOM 1045 CB LYS A 439 10.642 6.889 3.654 1.00 0.00 C ATOM 1046 CG LYS A 439 10.348 7.566 4.982 1.00 0.00 C ATOM 1047 CD LYS A 439 11.625 7.840 5.761 1.00 0.00 C ATOM 1048 CE LYS A 439 12.071 6.617 6.546 1.00 0.00 C ATOM 1049 NZ LYS A 439 13.138 5.860 5.835 1.00 0.00 N ATOM 0 H LYS A 439 8.757 8.412 3.177 1.00 0.00 H new ATOM 0 HA LYS A 439 9.678 6.072 1.921 1.00 0.00 H new ATOM 0 HB2 LYS A 439 11.287 6.028 3.830 1.00 0.00 H new ATOM 0 HB3 LYS A 439 11.198 7.579 3.019 1.00 0.00 H new ATOM 0 HG2 LYS A 439 9.820 8.503 4.805 1.00 0.00 H new ATOM 0 HG3 LYS A 439 9.687 6.935 5.575 1.00 0.00 H new ATOM 0 HD2 LYS A 439 12.415 8.140 5.073 1.00 0.00 H new ATOM 0 HD3 LYS A 439 11.464 8.674 6.444 1.00 0.00 H new ATOM 0 HE2 LYS A 439 12.437 6.927 7.525 1.00 0.00 H new ATOM 0 HE3 LYS A 439 11.215 5.964 6.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 13.742 5.376 6.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 12.703 5.156 5.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 13.715 6.518 5.273 1.00 0.00 H new ATOM 1063 N GLU A 440 7.890 5.633 4.644 1.00 0.00 N ATOM 1064 CA GLU A 440 7.179 4.632 5.427 1.00 0.00 C ATOM 1065 C GLU A 440 6.162 3.907 4.552 1.00 0.00 C ATOM 1066 O GLU A 440 6.083 2.677 4.557 1.00 0.00 O ATOM 1067 CB GLU A 440 6.477 5.287 6.619 1.00 0.00 C ATOM 1068 CG GLU A 440 5.698 4.307 7.482 1.00 0.00 C ATOM 1069 CD GLU A 440 5.431 4.840 8.875 1.00 0.00 C ATOM 1070 OE1 GLU A 440 6.370 5.389 9.490 1.00 0.00 O ATOM 1071 OE2 GLU A 440 4.284 4.708 9.351 1.00 0.00 O ATOM 0 H GLU A 440 7.695 6.598 4.912 1.00 0.00 H new ATOM 0 HA GLU A 440 7.901 3.907 5.804 1.00 0.00 H new ATOM 0 HB2 GLU A 440 7.221 5.790 7.237 1.00 0.00 H new ATOM 0 HB3 GLU A 440 5.796 6.055 6.252 1.00 0.00 H new ATOM 0 HG2 GLU A 440 4.749 4.077 6.997 1.00 0.00 H new ATOM 0 HG3 GLU A 440 6.254 3.372 7.555 1.00 0.00 H new ATOM 1078 N ALA A 441 5.389 4.681 3.796 1.00 0.00 N ATOM 1079 CA ALA A 441 4.380 4.122 2.908 1.00 0.00 C ATOM 1080 C ALA A 441 5.029 3.342 1.770 1.00 0.00 C ATOM 1081 O ALA A 441 4.685 2.186 1.524 1.00 0.00 O ATOM 1082 CB ALA A 441 3.491 5.225 2.355 1.00 0.00 C ATOM 0 H ALA A 441 5.444 5.699 3.782 1.00 0.00 H new ATOM 0 HA ALA A 441 3.764 3.432 3.485 1.00 0.00 H new ATOM 0 HB1 ALA A 441 2.742 4.791 1.693 1.00 0.00 H new ATOM 0 HB2 ALA A 441 2.994 5.739 3.178 1.00 0.00 H new ATOM 0 HB3 ALA A 441 4.099 5.937 1.797 1.00 0.00 H new ATOM 1088 N VAL A 442 5.975 3.977 1.082 1.00 0.00 N ATOM 1089 CA VAL A 442 6.675 3.335 -0.027 1.00 0.00 C ATOM 1090 C VAL A 442 7.267 1.999 0.411 1.00 0.00 C ATOM 1091 O VAL A 442 7.145 0.993 -0.287 1.00 0.00 O ATOM 1092 CB VAL A 442 7.799 4.233 -0.588 1.00 0.00 C ATOM 1093 CG1 VAL A 442 7.237 5.565 -1.056 1.00 0.00 C ATOM 1094 CG2 VAL A 442 8.884 4.441 0.448 1.00 0.00 C ATOM 0 H VAL A 442 6.274 4.933 1.273 1.00 0.00 H new ATOM 0 HA VAL A 442 5.941 3.167 -0.815 1.00 0.00 H new ATOM 0 HB VAL A 442 8.242 3.730 -1.448 1.00 0.00 H new ATOM 0 HG11 VAL A 442 8.045 6.183 -1.448 1.00 0.00 H new ATOM 0 HG12 VAL A 442 6.499 5.393 -1.839 1.00 0.00 H new ATOM 0 HG13 VAL A 442 6.764 6.075 -0.217 1.00 0.00 H new ATOM 0 HG21 VAL A 442 9.666 5.076 0.033 1.00 0.00 H new ATOM 0 HG22 VAL A 442 8.458 4.919 1.330 1.00 0.00 H new ATOM 0 HG23 VAL A 442 9.310 3.477 0.728 1.00 0.00 H new ATOM 1104 N CYS A 443 7.900 1.993 1.582 1.00 0.00 N ATOM 1105 CA CYS A 443 8.496 0.778 2.118 1.00 0.00 C ATOM 1106 C CYS A 443 7.419 -0.266 2.390 1.00 0.00 C ATOM 1107 O CYS A 443 7.569 -1.434 2.040 1.00 0.00 O ATOM 1108 CB CYS A 443 9.267 1.083 3.404 1.00 0.00 C ATOM 1109 SG CYS A 443 10.102 -0.351 4.122 1.00 0.00 S ATOM 0 H CYS A 443 8.012 2.816 2.175 1.00 0.00 H new ATOM 0 HA CYS A 443 9.192 0.381 1.379 1.00 0.00 H new ATOM 0 HB2 CYS A 443 10.008 1.855 3.196 1.00 0.00 H new ATOM 0 HB3 CYS A 443 8.576 1.494 4.140 1.00 0.00 H new ATOM 0 HG CYS A 443 10.727 0.008 5.204 1.00 0.00 H new ATOM 1115 N LYS A 444 6.330 0.172 3.017 1.00 0.00 N ATOM 1116 CA LYS A 444 5.218 -0.713 3.340 1.00 0.00 C ATOM 1117 C LYS A 444 4.587 -1.283 2.072 1.00 0.00 C ATOM 1118 O LYS A 444 4.503 -2.500 1.906 1.00 0.00 O ATOM 1119 CB LYS A 444 4.165 0.036 4.160 1.00 0.00 C ATOM 1120 CG LYS A 444 3.990 -0.510 5.569 1.00 0.00 C ATOM 1121 CD LYS A 444 5.170 -0.147 6.456 1.00 0.00 C ATOM 1122 CE LYS A 444 4.773 -0.107 7.923 1.00 0.00 C ATOM 1123 NZ LYS A 444 5.485 0.969 8.663 1.00 0.00 N ATOM 0 H LYS A 444 6.195 1.139 3.312 1.00 0.00 H new ATOM 0 HA LYS A 444 5.606 -1.542 3.932 1.00 0.00 H new ATOM 0 HB2 LYS A 444 4.443 1.088 4.219 1.00 0.00 H new ATOM 0 HB3 LYS A 444 3.209 -0.012 3.639 1.00 0.00 H new ATOM 0 HG2 LYS A 444 3.072 -0.114 6.003 1.00 0.00 H new ATOM 0 HG3 LYS A 444 3.882 -1.594 5.530 1.00 0.00 H new ATOM 0 HD2 LYS A 444 5.970 -0.874 6.314 1.00 0.00 H new ATOM 0 HD3 LYS A 444 5.565 0.824 6.158 1.00 0.00 H new ATOM 0 HE2 LYS A 444 3.697 0.048 8.003 1.00 0.00 H new ATOM 0 HE3 LYS A 444 4.991 -1.070 8.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 5.491 0.746 9.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 6.464 1.039 8.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 4.999 1.876 8.510 1.00 0.00 H new ATOM 1137 N ILE A 445 4.144 -0.401 1.176 1.00 0.00 N ATOM 1138 CA ILE A 445 3.525 -0.834 -0.073 1.00 0.00 C ATOM 1139 C ILE A 445 4.425 -1.822 -0.808 1.00 0.00 C ATOM 1140 O ILE A 445 3.964 -2.857 -1.290 1.00 0.00 O ATOM 1141 CB ILE A 445 3.199 0.358 -0.999 1.00 0.00 C ATOM 1142 CG1 ILE A 445 4.480 1.084 -1.424 1.00 0.00 C ATOM 1143 CG2 ILE A 445 2.243 1.317 -0.306 1.00 0.00 C ATOM 1144 CD1 ILE A 445 4.227 2.264 -2.339 1.00 0.00 C ATOM 0 H ILE A 445 4.202 0.611 1.292 1.00 0.00 H new ATOM 0 HA ILE A 445 2.588 -1.325 0.191 1.00 0.00 H new ATOM 0 HB ILE A 445 2.716 -0.026 -1.897 1.00 0.00 H new ATOM 0 HG12 ILE A 445 5.005 1.430 -0.534 1.00 0.00 H new ATOM 0 HG13 ILE A 445 5.139 0.377 -1.928 1.00 0.00 H new ATOM 0 HG21 ILE A 445 2.021 2.153 -0.970 1.00 0.00 H new ATOM 0 HG22 ILE A 445 1.319 0.795 -0.059 1.00 0.00 H new ATOM 0 HG23 ILE A 445 2.703 1.692 0.608 1.00 0.00 H new ATOM 0 HD11 ILE A 445 5.176 2.732 -2.601 1.00 0.00 H new ATOM 0 HD12 ILE A 445 3.729 1.921 -3.246 1.00 0.00 H new ATOM 0 HD13 ILE A 445 3.593 2.990 -1.830 1.00 0.00 H new ATOM 1156 N GLN A 446 5.713 -1.507 -0.871 1.00 0.00 N ATOM 1157 CA GLN A 446 6.678 -2.381 -1.523 1.00 0.00 C ATOM 1158 C GLN A 446 6.895 -3.630 -0.680 1.00 0.00 C ATOM 1159 O GLN A 446 7.144 -4.716 -1.202 1.00 0.00 O ATOM 1160 CB GLN A 446 8.005 -1.652 -1.736 1.00 0.00 C ATOM 1161 CG GLN A 446 7.940 -0.563 -2.795 1.00 0.00 C ATOM 1162 CD GLN A 446 8.332 -1.064 -4.171 1.00 0.00 C ATOM 1163 OE1 GLN A 446 9.404 -1.641 -4.352 1.00 0.00 O ATOM 1164 NE2 GLN A 446 7.463 -0.844 -5.151 1.00 0.00 N ATOM 0 H GLN A 446 6.112 -0.654 -0.479 1.00 0.00 H new ATOM 0 HA GLN A 446 6.285 -2.671 -2.497 1.00 0.00 H new ATOM 0 HB2 GLN A 446 8.322 -1.210 -0.792 1.00 0.00 H new ATOM 0 HB3 GLN A 446 8.767 -2.378 -2.020 1.00 0.00 H new ATOM 0 HG2 GLN A 446 6.928 -0.159 -2.834 1.00 0.00 H new ATOM 0 HG3 GLN A 446 8.599 0.256 -2.509 1.00 0.00 H new ATOM 0 HE21 GLN A 446 6.586 -0.362 -4.956 1.00 0.00 H new ATOM 0 HE22 GLN A 446 7.673 -1.158 -6.099 1.00 0.00 H new ATOM 1173 N ALA A 447 6.780 -3.462 0.635 1.00 0.00 N ATOM 1174 CA ALA A 447 6.944 -4.564 1.571 1.00 0.00 C ATOM 1175 C ALA A 447 5.807 -5.566 1.420 1.00 0.00 C ATOM 1176 O ALA A 447 6.031 -6.774 1.339 1.00 0.00 O ATOM 1177 CB ALA A 447 7.006 -4.034 2.996 1.00 0.00 C ATOM 0 H ALA A 447 6.572 -2.566 1.076 1.00 0.00 H new ATOM 0 HA ALA A 447 7.880 -5.076 1.349 1.00 0.00 H new ATOM 0 HB1 ALA A 447 7.129 -4.866 3.689 1.00 0.00 H new ATOM 0 HB2 ALA A 447 7.851 -3.352 3.094 1.00 0.00 H new ATOM 0 HB3 ALA A 447 6.083 -3.503 3.227 1.00 0.00 H new ATOM 1183 N ILE A 448 4.582 -5.050 1.376 1.00 0.00 N ATOM 1184 CA ILE A 448 3.401 -5.889 1.224 1.00 0.00 C ATOM 1185 C ILE A 448 3.367 -6.528 -0.161 1.00 0.00 C ATOM 1186 O ILE A 448 2.984 -7.688 -0.312 1.00 0.00 O ATOM 1187 CB ILE A 448 2.107 -5.079 1.448 1.00 0.00 C ATOM 1188 CG1 ILE A 448 0.878 -5.984 1.342 1.00 0.00 C ATOM 1189 CG2 ILE A 448 2.015 -3.935 0.451 1.00 0.00 C ATOM 1190 CD1 ILE A 448 -0.371 -5.377 1.942 1.00 0.00 C ATOM 0 H ILE A 448 4.383 -4.052 1.444 1.00 0.00 H new ATOM 0 HA ILE A 448 3.459 -6.672 1.980 1.00 0.00 H new ATOM 0 HB ILE A 448 2.136 -4.659 2.453 1.00 0.00 H new ATOM 0 HG12 ILE A 448 0.694 -6.212 0.292 1.00 0.00 H new ATOM 0 HG13 ILE A 448 1.089 -6.930 1.841 1.00 0.00 H new ATOM 0 HG21 ILE A 448 1.096 -3.375 0.624 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.872 -3.274 0.576 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.010 -4.335 -0.563 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -1.203 -6.073 1.832 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.205 -5.175 3.000 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.606 -4.446 1.427 1.00 0.00 H new ATOM 1202 N LEU A 449 3.775 -5.761 -1.167 1.00 0.00 N ATOM 1203 CA LEU A 449 3.799 -6.253 -2.540 1.00 0.00 C ATOM 1204 C LEU A 449 4.752 -7.437 -2.668 1.00 0.00 C ATOM 1205 O LEU A 449 4.386 -8.487 -3.196 1.00 0.00 O ATOM 1206 CB LEU A 449 4.216 -5.135 -3.498 1.00 0.00 C ATOM 1207 CG LEU A 449 3.121 -4.662 -4.456 1.00 0.00 C ATOM 1208 CD1 LEU A 449 1.899 -4.194 -3.681 1.00 0.00 C ATOM 1209 CD2 LEU A 449 3.644 -3.550 -5.354 1.00 0.00 C ATOM 0 H LEU A 449 4.093 -4.798 -1.058 1.00 0.00 H new ATOM 0 HA LEU A 449 2.795 -6.585 -2.804 1.00 0.00 H new ATOM 0 HB2 LEU A 449 4.557 -4.282 -2.911 1.00 0.00 H new ATOM 0 HB3 LEU A 449 5.068 -5.479 -4.085 1.00 0.00 H new ATOM 0 HG LEU A 449 2.826 -5.502 -5.085 1.00 0.00 H new ATOM 0 HD11 LEU A 449 1.131 -3.861 -4.379 1.00 0.00 H new ATOM 0 HD12 LEU A 449 1.512 -5.017 -3.081 1.00 0.00 H new ATOM 0 HD13 LEU A 449 2.177 -3.368 -3.027 1.00 0.00 H new ATOM 0 HD21 LEU A 449 2.852 -3.225 -6.029 1.00 0.00 H new ATOM 0 HD22 LEU A 449 3.966 -2.708 -4.741 1.00 0.00 H new ATOM 0 HD23 LEU A 449 4.489 -3.919 -5.936 1.00 0.00 H new ATOM 1221 N GLU A 450 5.975 -7.260 -2.178 1.00 0.00 N ATOM 1222 CA GLU A 450 6.981 -8.313 -2.235 1.00 0.00 C ATOM 1223 C GLU A 450 6.545 -9.520 -1.410 1.00 0.00 C ATOM 1224 O GLU A 450 6.701 -10.665 -1.835 1.00 0.00 O ATOM 1225 CB GLU A 450 8.326 -7.793 -1.727 1.00 0.00 C ATOM 1226 CG GLU A 450 9.523 -8.491 -2.351 1.00 0.00 C ATOM 1227 CD GLU A 450 9.940 -7.869 -3.669 1.00 0.00 C ATOM 1228 OE1 GLU A 450 9.189 -8.012 -4.657 1.00 0.00 O ATOM 1229 OE2 GLU A 450 11.017 -7.238 -3.712 1.00 0.00 O ATOM 0 H GLU A 450 6.293 -6.397 -1.737 1.00 0.00 H new ATOM 0 HA GLU A 450 7.091 -8.622 -3.274 1.00 0.00 H new ATOM 0 HB2 GLU A 450 8.393 -6.724 -1.930 1.00 0.00 H new ATOM 0 HB3 GLU A 450 8.368 -7.915 -0.645 1.00 0.00 H new ATOM 0 HG2 GLU A 450 10.362 -8.456 -1.656 1.00 0.00 H new ATOM 0 HG3 GLU A 450 9.284 -9.542 -2.510 1.00 0.00 H new ATOM 1236 N LYS A 451 5.995 -9.254 -0.228 1.00 0.00 N ATOM 1237 CA LYS A 451 5.534 -10.319 0.655 1.00 0.00 C ATOM 1238 C LYS A 451 4.449 -11.152 -0.019 1.00 0.00 C ATOM 1239 O LYS A 451 4.411 -12.374 0.126 1.00 0.00 O ATOM 1240 CB LYS A 451 5.003 -9.729 1.963 1.00 0.00 C ATOM 1241 CG LYS A 451 5.133 -10.669 3.150 1.00 0.00 C ATOM 1242 CD LYS A 451 5.446 -9.912 4.430 1.00 0.00 C ATOM 1243 CE LYS A 451 4.176 -9.489 5.153 1.00 0.00 C ATOM 1244 NZ LYS A 451 4.463 -8.941 6.507 1.00 0.00 N ATOM 0 H LYS A 451 5.858 -8.312 0.139 1.00 0.00 H new ATOM 0 HA LYS A 451 6.381 -10.969 0.875 1.00 0.00 H new ATOM 0 HB2 LYS A 451 5.540 -8.806 2.180 1.00 0.00 H new ATOM 0 HB3 LYS A 451 3.954 -9.464 1.833 1.00 0.00 H new ATOM 0 HG2 LYS A 451 4.206 -11.229 3.275 1.00 0.00 H new ATOM 0 HG3 LYS A 451 5.921 -11.396 2.955 1.00 0.00 H new ATOM 0 HD2 LYS A 451 6.048 -10.540 5.087 1.00 0.00 H new ATOM 0 HD3 LYS A 451 6.043 -9.031 4.196 1.00 0.00 H new ATOM 0 HE2 LYS A 451 3.654 -8.737 4.560 1.00 0.00 H new ATOM 0 HE3 LYS A 451 3.507 -10.345 5.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 3.572 -8.665 6.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 4.938 -9.666 7.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 5.080 -8.109 6.421 1.00 0.00 H new ATOM 1258 N LEU A 452 3.568 -10.482 -0.754 1.00 0.00 N ATOM 1259 CA LEU A 452 2.480 -11.160 -1.451 1.00 0.00 C ATOM 1260 C LEU A 452 3.006 -11.946 -2.647 1.00 0.00 C ATOM 1261 O LEU A 452 2.632 -13.100 -2.858 1.00 0.00 O ATOM 1262 CB LEU A 452 1.430 -10.145 -1.911 1.00 0.00 C ATOM 1263 CG LEU A 452 -0.018 -10.518 -1.581 1.00 0.00 C ATOM 1264 CD1 LEU A 452 -0.766 -9.315 -1.025 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.727 -11.068 -2.810 1.00 0.00 C ATOM 0 H LEU A 452 3.586 -9.470 -0.883 1.00 0.00 H new ATOM 0 HA LEU A 452 2.017 -11.860 -0.756 1.00 0.00 H new ATOM 0 HB2 LEU A 452 1.654 -9.181 -1.455 1.00 0.00 H new ATOM 0 HB3 LEU A 452 1.519 -10.016 -2.990 1.00 0.00 H new ATOM 0 HG LEU A 452 -0.004 -11.297 -0.819 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -1.793 -9.599 -0.796 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -0.274 -8.969 -0.116 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.767 -8.514 -1.764 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -1.754 -11.326 -2.552 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -0.729 -10.314 -3.597 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -0.206 -11.958 -3.162 1.00 0.00 H new ATOM 1277 N GLU A 453 3.877 -11.314 -3.426 1.00 0.00 N ATOM 1278 CA GLU A 453 4.455 -11.954 -4.603 1.00 0.00 C ATOM 1279 C GLU A 453 5.302 -13.159 -4.207 1.00 0.00 C ATOM 1280 O GLU A 453 5.416 -14.125 -4.962 1.00 0.00 O ATOM 1281 CB GLU A 453 5.306 -10.951 -5.388 1.00 0.00 C ATOM 1282 CG GLU A 453 5.034 -10.963 -6.883 1.00 0.00 C ATOM 1283 CD GLU A 453 3.875 -10.067 -7.272 1.00 0.00 C ATOM 1284 OE1 GLU A 453 2.744 -10.323 -6.809 1.00 0.00 O ATOM 1285 OE2 GLU A 453 4.097 -9.107 -8.039 1.00 0.00 O ATOM 0 H GLU A 453 4.198 -10.360 -3.264 1.00 0.00 H new ATOM 0 HA GLU A 453 3.638 -12.301 -5.236 1.00 0.00 H new ATOM 0 HB2 GLU A 453 5.121 -9.949 -5.001 1.00 0.00 H new ATOM 0 HB3 GLU A 453 6.360 -11.169 -5.217 1.00 0.00 H new ATOM 0 HG2 GLU A 453 5.930 -10.643 -7.414 1.00 0.00 H new ATOM 0 HG3 GLU A 453 4.822 -11.984 -7.202 1.00 0.00 H new ATOM 1292 N LYS A 454 5.896 -13.097 -3.020 1.00 0.00 N ATOM 1293 CA LYS A 454 6.732 -14.184 -2.524 1.00 0.00 C ATOM 1294 C LYS A 454 5.880 -15.306 -1.942 1.00 0.00 C ATOM 1295 O LYS A 454 6.000 -16.463 -2.345 1.00 0.00 O ATOM 1296 CB LYS A 454 7.705 -13.664 -1.465 1.00 0.00 C ATOM 1297 CG LYS A 454 9.002 -14.455 -1.389 1.00 0.00 C ATOM 1298 CD LYS A 454 9.520 -14.537 0.038 1.00 0.00 C ATOM 1299 CE LYS A 454 10.173 -15.880 0.317 1.00 0.00 C ATOM 1300 NZ LYS A 454 11.096 -16.289 -0.778 1.00 0.00 N ATOM 0 H LYS A 454 5.814 -12.305 -2.383 1.00 0.00 H new ATOM 0 HA LYS A 454 7.300 -14.584 -3.364 1.00 0.00 H new ATOM 0 HB2 LYS A 454 7.937 -12.621 -1.678 1.00 0.00 H new ATOM 0 HB3 LYS A 454 7.216 -13.689 -0.491 1.00 0.00 H new ATOM 0 HG2 LYS A 454 8.840 -15.461 -1.777 1.00 0.00 H new ATOM 0 HG3 LYS A 454 9.754 -13.986 -2.024 1.00 0.00 H new ATOM 0 HD2 LYS A 454 10.241 -13.738 0.211 1.00 0.00 H new ATOM 0 HD3 LYS A 454 8.697 -14.380 0.735 1.00 0.00 H new ATOM 0 HE2 LYS A 454 10.725 -15.827 1.256 1.00 0.00 H new ATOM 0 HE3 LYS A 454 9.401 -16.639 0.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 11.803 -16.954 -0.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 10.553 -16.750 -1.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 11.577 -15.449 -1.158 1.00 0.00 H new ATOM 1314 N LYS A 455 5.022 -14.957 -0.988 1.00 0.00 N ATOM 1315 CA LYS A 455 4.150 -15.937 -0.350 1.00 0.00 C ATOM 1316 C LYS A 455 3.124 -16.481 -1.339 1.00 0.00 C ATOM 1317 O LYS A 455 2.754 -17.652 -1.282 1.00 0.00 O ATOM 1318 CB LYS A 455 3.437 -15.311 0.850 1.00 0.00 C ATOM 1319 CG LYS A 455 3.360 -16.229 2.059 1.00 0.00 C ATOM 1320 CD LYS A 455 2.025 -16.954 2.124 1.00 0.00 C ATOM 1321 CE LYS A 455 1.091 -16.317 3.139 1.00 0.00 C ATOM 1322 NZ LYS A 455 0.055 -15.470 2.484 1.00 0.00 N ATOM 0 H LYS A 455 4.912 -14.004 -0.640 1.00 0.00 H new ATOM 0 HA LYS A 455 4.769 -16.766 -0.005 1.00 0.00 H new ATOM 0 HB2 LYS A 455 3.955 -14.395 1.132 1.00 0.00 H new ATOM 0 HB3 LYS A 455 2.427 -15.028 0.555 1.00 0.00 H new ATOM 0 HG2 LYS A 455 4.169 -16.958 2.016 1.00 0.00 H new ATOM 0 HG3 LYS A 455 3.504 -15.647 2.969 1.00 0.00 H new ATOM 0 HD2 LYS A 455 1.556 -16.943 1.140 1.00 0.00 H new ATOM 0 HD3 LYS A 455 2.190 -17.999 2.386 1.00 0.00 H new ATOM 0 HE2 LYS A 455 0.605 -17.097 3.725 1.00 0.00 H new ATOM 0 HE3 LYS A 455 1.670 -15.710 3.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -0.177 -14.666 3.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 0.419 -15.116 1.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -0.801 -16.036 2.316 1.00 0.00 H new ATOM 1336 N GLY A 456 2.671 -15.621 -2.246 1.00 0.00 N ATOM 1337 CA GLY A 456 1.693 -16.032 -3.235 1.00 0.00 C ATOM 1338 C GLY A 456 2.286 -16.145 -4.626 1.00 0.00 C ATOM 1339 O GLY A 456 3.528 -16.204 -4.739 1.00 0.00 O ATOM 1340 OXT GLY A 456 1.508 -16.173 -5.603 1.00 0.00 O ATOM 0 H GLY A 456 2.964 -14.646 -2.313 1.00 0.00 H new ATOM 0 HA2 GLY A 456 1.270 -16.994 -2.945 1.00 0.00 H new ATOM 0 HA3 GLY A 456 0.873 -15.314 -3.250 1.00 0.00 H new TER 1344 GLY A 456