USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=15 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 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 454 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0269) USER MOD Set 2.1: A 376 THR OG1 : rot 10:sc= 0.711 USER MOD Set 2.2: A 431 GLN : amide:sc= -2.4 K(o=-1.7,f=-2.4!) USER MOD Single : A 379 SER OG : rot -82:sc= -3.06! USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ -166:sc= -0.0101 (180deg=-0.207) USER MOD Single : A 385 HIS : no HD1:sc= -0.0453 X(o=-0.045,f=-0.011) USER MOD Single : A 389 LYS NZ :NH3+ 154:sc= -0.193 (180deg=-0.49) 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= -0.253 K(o=-0.25,f=-1.1) USER MOD Single : A 403 LYS NZ :NH3+ 148:sc= -1.83 (180deg=-3.12) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot -160:sc= -0.3 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 90:sc= 0.254 USER MOD Single : A 415 MET CE :methyl 156:sc= -0.139 (180deg=-0.847) USER MOD Single : A 417 THR OG1 : rot 3:sc= 0.843 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 180:sc= 0 USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= -0.0249 X(o=-0.025,f=0) USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 87:sc= 0.126 USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -1.3 K(o=-1.3,f=-3.2!) USER MOD Single : A 455 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 376 -0.006 20.993 6.513 1.00 0.00 N ATOM 2 CA THR A 376 -0.010 20.473 5.151 1.00 0.00 C ATOM 3 C THR A 376 -1.074 19.388 4.988 1.00 0.00 C ATOM 4 O THR A 376 -0.757 18.230 4.711 1.00 0.00 O ATOM 5 CB THR A 376 1.373 19.923 4.793 1.00 0.00 C ATOM 6 OG1 THR A 376 2.363 20.459 5.653 1.00 0.00 O ATOM 7 CG2 THR A 376 1.786 20.230 3.370 1.00 0.00 C ATOM 0 HA THR A 376 -0.251 21.290 4.470 1.00 0.00 H new ATOM 0 HB THR A 376 1.294 18.842 4.907 1.00 0.00 H new ATOM 0 HG1 THR A 376 1.931 20.939 6.390 1.00 0.00 H new ATOM 0 HG21 THR A 376 2.775 19.813 3.180 1.00 0.00 H new ATOM 0 HG22 THR A 376 1.067 19.789 2.679 1.00 0.00 H new ATOM 0 HG23 THR A 376 1.813 21.310 3.224 1.00 0.00 H new ATOM 15 N PRO A 377 -2.356 19.753 5.161 1.00 0.00 N ATOM 16 CA PRO A 377 -3.475 18.811 5.038 1.00 0.00 C ATOM 17 C PRO A 377 -3.475 18.043 3.712 1.00 0.00 C ATOM 18 O PRO A 377 -3.636 16.824 3.702 1.00 0.00 O ATOM 19 CB PRO A 377 -4.712 19.707 5.131 1.00 0.00 C ATOM 20 CG PRO A 377 -4.257 20.910 5.879 1.00 0.00 C ATOM 21 CD PRO A 377 -2.817 21.114 5.498 1.00 0.00 C ATOM 0 HA PRO A 377 -3.426 18.038 5.805 1.00 0.00 H new ATOM 0 HB2 PRO A 377 -5.082 19.974 4.141 1.00 0.00 H new ATOM 0 HB3 PRO A 377 -5.527 19.203 5.651 1.00 0.00 H new ATOM 0 HG2 PRO A 377 -4.857 21.782 5.618 1.00 0.00 H new ATOM 0 HG3 PRO A 377 -4.359 20.763 6.954 1.00 0.00 H new ATOM 0 HD2 PRO A 377 -2.718 21.793 4.651 1.00 0.00 H new ATOM 0 HD3 PRO A 377 -2.241 21.542 6.319 1.00 0.00 H new ATOM 29 N PRO A 378 -3.304 18.740 2.572 1.00 0.00 N ATOM 30 CA PRO A 378 -3.302 18.092 1.255 1.00 0.00 C ATOM 31 C PRO A 378 -2.088 17.193 1.041 1.00 0.00 C ATOM 32 O PRO A 378 -2.117 16.288 0.207 1.00 0.00 O ATOM 33 CB PRO A 378 -3.278 19.267 0.273 1.00 0.00 C ATOM 34 CG PRO A 378 -2.688 20.397 1.039 1.00 0.00 C ATOM 35 CD PRO A 378 -3.113 20.201 2.468 1.00 0.00 C ATOM 0 HA PRO A 378 -4.162 17.434 1.132 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -2.680 19.033 -0.608 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -4.281 19.509 -0.077 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -1.601 20.401 0.953 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -3.041 21.354 0.655 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -2.355 20.558 3.165 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -4.032 20.743 2.692 1.00 0.00 H new ATOM 43 N SER A 379 -1.025 17.442 1.797 1.00 0.00 N ATOM 44 CA SER A 379 0.192 16.647 1.681 1.00 0.00 C ATOM 45 C SER A 379 0.199 15.505 2.694 1.00 0.00 C ATOM 46 O SER A 379 0.824 14.470 2.470 1.00 0.00 O ATOM 47 CB SER A 379 1.426 17.529 1.882 1.00 0.00 C ATOM 48 OG SER A 379 1.336 18.714 1.111 1.00 0.00 O ATOM 0 H SER A 379 -0.981 18.185 2.494 1.00 0.00 H new ATOM 0 HA SER A 379 0.219 16.219 0.679 1.00 0.00 H new ATOM 0 HB2 SER A 379 1.527 17.784 2.937 1.00 0.00 H new ATOM 0 HB3 SER A 379 2.322 16.976 1.601 1.00 0.00 H new ATOM 0 HG SER A 379 1.616 18.527 0.191 1.00 0.00 H new ATOM 54 N ILE A 380 -0.496 15.704 3.810 1.00 0.00 N ATOM 55 CA ILE A 380 -0.562 14.689 4.856 1.00 0.00 C ATOM 56 C ILE A 380 -1.798 13.807 4.697 1.00 0.00 C ATOM 57 O ILE A 380 -1.754 12.605 4.962 1.00 0.00 O ATOM 58 CB ILE A 380 -0.569 15.329 6.259 1.00 0.00 C ATOM 59 CG1 ILE A 380 -0.425 14.251 7.335 1.00 0.00 C ATOM 60 CG2 ILE A 380 -1.840 16.140 6.475 1.00 0.00 C ATOM 61 CD1 ILE A 380 0.418 14.682 8.514 1.00 0.00 C ATOM 0 H ILE A 380 -1.020 16.556 4.013 1.00 0.00 H new ATOM 0 HA ILE A 380 0.330 14.071 4.753 1.00 0.00 H new ATOM 0 HB ILE A 380 0.281 16.007 6.334 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -1.416 13.970 7.691 1.00 0.00 H new ATOM 0 HG13 ILE A 380 0.018 13.361 6.889 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -1.824 16.583 7.471 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -1.898 16.931 5.727 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -2.708 15.488 6.382 1.00 0.00 H new ATOM 0 HD11 ILE A 380 0.476 13.868 9.237 1.00 0.00 H new ATOM 0 HD12 ILE A 380 1.421 14.935 8.171 1.00 0.00 H new ATOM 0 HD13 ILE A 380 -0.035 15.554 8.986 1.00 0.00 H new ATOM 73 N LYS A 381 -2.901 14.407 4.264 1.00 0.00 N ATOM 74 CA LYS A 381 -4.146 13.671 4.071 1.00 0.00 C ATOM 75 C LYS A 381 -3.945 12.496 3.116 1.00 0.00 C ATOM 76 O LYS A 381 -4.484 11.409 3.331 1.00 0.00 O ATOM 77 CB LYS A 381 -5.236 14.600 3.532 1.00 0.00 C ATOM 78 CG LYS A 381 -6.590 13.928 3.386 1.00 0.00 C ATOM 79 CD LYS A 381 -7.291 13.785 4.728 1.00 0.00 C ATOM 80 CE LYS A 381 -7.099 12.395 5.311 1.00 0.00 C ATOM 81 NZ LYS A 381 -6.971 12.426 6.795 1.00 0.00 N ATOM 0 H LYS A 381 -2.959 15.400 4.040 1.00 0.00 H new ATOM 0 HA LYS A 381 -4.458 13.279 5.039 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -5.335 15.456 4.199 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -4.925 14.987 2.561 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -7.215 14.510 2.709 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -6.462 12.944 2.935 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -6.903 14.529 5.423 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -8.355 13.986 4.607 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -7.944 11.765 5.033 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -6.207 11.941 4.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -6.842 11.458 7.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -6.150 13.006 7.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -7.832 12.836 7.209 1.00 0.00 H new ATOM 95 N LYS A 382 -3.168 12.726 2.064 1.00 0.00 N ATOM 96 CA LYS A 382 -2.897 11.688 1.075 1.00 0.00 C ATOM 97 C LYS A 382 -2.168 10.506 1.707 1.00 0.00 C ATOM 98 O LYS A 382 -2.636 9.369 1.639 1.00 0.00 O ATOM 99 CB LYS A 382 -2.068 12.259 -0.079 1.00 0.00 C ATOM 100 CG LYS A 382 -2.896 12.618 -1.302 1.00 0.00 C ATOM 101 CD LYS A 382 -3.393 14.052 -1.237 1.00 0.00 C ATOM 102 CE LYS A 382 -4.370 14.355 -2.360 1.00 0.00 C ATOM 103 NZ LYS A 382 -3.829 13.952 -3.688 1.00 0.00 N ATOM 0 H LYS A 382 -2.715 13.620 1.874 1.00 0.00 H new ATOM 0 HA LYS A 382 -3.852 11.333 0.687 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -1.542 13.149 0.268 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -1.309 11.531 -0.365 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -2.296 12.480 -2.202 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -3.746 11.940 -1.379 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -3.876 14.227 -0.276 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -2.545 14.735 -1.297 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -5.309 13.832 -2.176 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -4.595 15.421 -2.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -4.404 14.381 -4.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -2.845 14.277 -3.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -3.860 12.916 -3.776 1.00 0.00 H new ATOM 117 N ILE A 383 -1.019 10.778 2.322 1.00 0.00 N ATOM 118 CA ILE A 383 -0.232 9.730 2.962 1.00 0.00 C ATOM 119 C ILE A 383 -1.067 8.962 3.980 1.00 0.00 C ATOM 120 O ILE A 383 -0.934 7.745 4.113 1.00 0.00 O ATOM 121 CB ILE A 383 1.020 10.300 3.656 1.00 0.00 C ATOM 122 CG1 ILE A 383 0.633 11.407 4.634 1.00 0.00 C ATOM 123 CG2 ILE A 383 2.008 10.820 2.622 1.00 0.00 C ATOM 124 CD1 ILE A 383 1.781 11.881 5.498 1.00 0.00 C ATOM 0 H ILE A 383 -0.615 11.712 2.390 1.00 0.00 H new ATOM 0 HA ILE A 383 0.088 9.050 2.172 1.00 0.00 H new ATOM 0 HB ILE A 383 1.499 9.499 4.219 1.00 0.00 H new ATOM 0 HG12 ILE A 383 0.238 12.254 4.073 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -0.170 11.048 5.277 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.887 11.219 3.128 1.00 0.00 H new ATOM 0 HG22 ILE A 383 2.307 10.005 1.963 1.00 0.00 H new ATOM 0 HG23 ILE A 383 1.538 11.608 2.034 1.00 0.00 H new ATOM 0 HD11 ILE A 383 1.432 12.667 6.167 1.00 0.00 H new ATOM 0 HD12 ILE A 383 2.162 11.046 6.086 1.00 0.00 H new ATOM 0 HD13 ILE A 383 2.577 12.271 4.864 1.00 0.00 H new ATOM 136 N ILE A 384 -1.935 9.675 4.693 1.00 0.00 N ATOM 137 CA ILE A 384 -2.797 9.046 5.688 1.00 0.00 C ATOM 138 C ILE A 384 -3.746 8.053 5.023 1.00 0.00 C ATOM 139 O ILE A 384 -3.854 6.901 5.448 1.00 0.00 O ATOM 140 CB ILE A 384 -3.617 10.095 6.471 1.00 0.00 C ATOM 141 CG1 ILE A 384 -2.686 11.037 7.234 1.00 0.00 C ATOM 142 CG2 ILE A 384 -4.583 9.414 7.433 1.00 0.00 C ATOM 143 CD1 ILE A 384 -3.297 12.392 7.516 1.00 0.00 C ATOM 0 H ILE A 384 -2.059 10.683 4.601 1.00 0.00 H new ATOM 0 HA ILE A 384 -2.151 8.518 6.390 1.00 0.00 H new ATOM 0 HB ILE A 384 -4.197 10.679 5.756 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -2.404 10.571 8.178 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -1.770 11.173 6.660 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -5.151 10.170 7.975 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -5.268 8.779 6.872 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -4.022 8.805 8.142 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -2.581 13.008 8.060 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -3.553 12.879 6.575 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -4.198 12.267 8.117 1.00 0.00 H new ATOM 155 N HIS A 385 -4.426 8.506 3.972 1.00 0.00 N ATOM 156 CA HIS A 385 -5.360 7.655 3.243 1.00 0.00 C ATOM 157 C HIS A 385 -4.667 6.382 2.767 1.00 0.00 C ATOM 158 O HIS A 385 -5.121 5.271 3.051 1.00 0.00 O ATOM 159 CB HIS A 385 -5.945 8.410 2.048 1.00 0.00 C ATOM 160 CG HIS A 385 -7.357 8.028 1.731 1.00 0.00 C ATOM 161 ND1 HIS A 385 -7.753 7.565 0.494 1.00 0.00 N ATOM 162 CD2 HIS A 385 -8.472 8.043 2.501 1.00 0.00 C ATOM 163 CE1 HIS A 385 -9.050 7.310 0.516 1.00 0.00 C ATOM 164 NE2 HIS A 385 -9.509 7.592 1.720 1.00 0.00 N ATOM 0 H HIS A 385 -4.347 9.455 3.608 1.00 0.00 H new ATOM 0 HA HIS A 385 -6.170 7.379 3.918 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -5.904 9.480 2.249 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -5.322 8.226 1.172 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -8.534 8.351 3.534 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -9.634 6.935 -0.311 1.00 0.00 H new ATOM 0 HE2 HIS A 385 -10.478 7.491 2.023 1.00 0.00 H new ATOM 173 N VAL A 386 -3.561 6.551 2.050 1.00 0.00 N ATOM 174 CA VAL A 386 -2.801 5.415 1.544 1.00 0.00 C ATOM 175 C VAL A 386 -2.329 4.532 2.692 1.00 0.00 C ATOM 176 O VAL A 386 -2.261 3.309 2.561 1.00 0.00 O ATOM 177 CB VAL A 386 -1.579 5.870 0.723 1.00 0.00 C ATOM 178 CG1 VAL A 386 -2.023 6.569 -0.552 1.00 0.00 C ATOM 179 CG2 VAL A 386 -0.687 6.777 1.554 1.00 0.00 C ATOM 0 H VAL A 386 -3.172 7.462 1.807 1.00 0.00 H new ATOM 0 HA VAL A 386 -3.467 4.848 0.893 1.00 0.00 H new ATOM 0 HB VAL A 386 -1.002 4.988 0.444 1.00 0.00 H new ATOM 0 HG11 VAL A 386 -1.147 6.883 -1.119 1.00 0.00 H new ATOM 0 HG12 VAL A 386 -2.618 5.883 -1.155 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -2.623 7.443 -0.298 1.00 0.00 H new ATOM 0 HG21 VAL A 386 0.171 7.089 0.958 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -1.251 7.656 1.865 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -0.340 6.238 2.435 1.00 0.00 H new ATOM 189 N LEU A 387 -2.013 5.159 3.821 1.00 0.00 N ATOM 190 CA LEU A 387 -1.560 4.429 4.998 1.00 0.00 C ATOM 191 C LEU A 387 -2.630 3.445 5.455 1.00 0.00 C ATOM 192 O LEU A 387 -2.354 2.263 5.663 1.00 0.00 O ATOM 193 CB LEU A 387 -1.217 5.402 6.131 1.00 0.00 C ATOM 194 CG LEU A 387 0.250 5.401 6.564 1.00 0.00 C ATOM 195 CD1 LEU A 387 0.599 4.101 7.269 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.159 5.618 5.363 1.00 0.00 C ATOM 0 H LEU A 387 -2.063 6.170 3.945 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.662 3.871 4.734 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.487 6.410 5.817 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.835 5.161 6.996 1.00 0.00 H new ATOM 0 HG LEU A 387 0.402 6.222 7.265 1.00 0.00 H new ATOM 0 HD11 LEU A 387 1.647 4.120 7.569 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -0.029 3.986 8.152 1.00 0.00 H new ATOM 0 HD13 LEU A 387 0.431 3.263 6.592 1.00 0.00 H new ATOM 0 HD21 LEU A 387 2.199 5.615 5.689 1.00 0.00 H new ATOM 0 HD22 LEU A 387 1.003 4.818 4.639 1.00 0.00 H new ATOM 0 HD23 LEU A 387 0.927 6.577 4.900 1.00 0.00 H new ATOM 208 N GLU A 388 -3.856 3.938 5.596 1.00 0.00 N ATOM 209 CA GLU A 388 -4.971 3.099 6.014 1.00 0.00 C ATOM 210 C GLU A 388 -5.205 1.988 4.997 1.00 0.00 C ATOM 211 O GLU A 388 -5.398 0.825 5.360 1.00 0.00 O ATOM 212 CB GLU A 388 -6.240 3.941 6.176 1.00 0.00 C ATOM 213 CG GLU A 388 -6.598 4.226 7.625 1.00 0.00 C ATOM 214 CD GLU A 388 -5.901 5.458 8.166 1.00 0.00 C ATOM 215 OE1 GLU A 388 -4.669 5.572 7.985 1.00 0.00 O ATOM 216 OE2 GLU A 388 -6.585 6.310 8.769 1.00 0.00 O ATOM 0 H GLU A 388 -4.102 4.913 5.427 1.00 0.00 H new ATOM 0 HA GLU A 388 -4.725 2.649 6.976 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -6.109 4.887 5.650 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -7.073 3.424 5.699 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -7.677 4.357 7.710 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.332 3.364 8.237 1.00 0.00 H new ATOM 223 N LYS A 389 -5.177 2.355 3.719 1.00 0.00 N ATOM 224 CA LYS A 389 -5.375 1.391 2.643 1.00 0.00 C ATOM 225 C LYS A 389 -4.358 0.258 2.744 1.00 0.00 C ATOM 226 O LYS A 389 -4.723 -0.917 2.794 1.00 0.00 O ATOM 227 CB LYS A 389 -5.264 2.082 1.282 1.00 0.00 C ATOM 228 CG LYS A 389 -6.454 1.826 0.372 1.00 0.00 C ATOM 229 CD LYS A 389 -6.644 0.342 0.107 1.00 0.00 C ATOM 230 CE LYS A 389 -8.116 -0.029 0.055 1.00 0.00 C ATOM 231 NZ LYS A 389 -8.759 0.055 1.395 1.00 0.00 N ATOM 0 H LYS A 389 -5.019 3.312 3.404 1.00 0.00 H new ATOM 0 HA LYS A 389 -6.375 0.968 2.740 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -5.159 3.156 1.436 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -4.356 1.742 0.784 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -7.356 2.234 0.828 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -6.310 2.350 -0.573 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -6.167 0.076 -0.836 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -6.149 -0.235 0.889 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -8.633 0.635 -0.638 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -8.221 -1.041 -0.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -9.777 0.234 1.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -8.620 -0.841 1.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -8.330 0.832 1.938 1.00 0.00 H new ATOM 245 N VAL A 390 -3.079 0.622 2.785 1.00 0.00 N ATOM 246 CA VAL A 390 -2.013 -0.365 2.893 1.00 0.00 C ATOM 247 C VAL A 390 -2.151 -1.158 4.187 1.00 0.00 C ATOM 248 O VAL A 390 -1.826 -2.344 4.236 1.00 0.00 O ATOM 249 CB VAL A 390 -0.621 0.296 2.833 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.480 -0.720 3.118 1.00 0.00 C ATOM 251 CG2 VAL A 390 -0.407 0.949 1.477 1.00 0.00 C ATOM 0 H VAL A 390 -2.758 1.589 2.745 1.00 0.00 H new ATOM 0 HA VAL A 390 -2.106 -1.041 2.043 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.575 1.066 3.604 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.451 -0.227 3.069 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.337 -1.142 4.113 1.00 0.00 H new ATOM 0 HG13 VAL A 390 0.440 -1.517 2.376 1.00 0.00 H new ATOM 0 HG21 VAL A 390 0.579 1.412 1.448 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -0.477 0.194 0.694 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -1.170 1.710 1.315 1.00 0.00 H new ATOM 261 N GLN A 391 -2.654 -0.502 5.230 1.00 0.00 N ATOM 262 CA GLN A 391 -2.852 -1.161 6.515 1.00 0.00 C ATOM 263 C GLN A 391 -3.773 -2.362 6.340 1.00 0.00 C ATOM 264 O GLN A 391 -3.413 -3.493 6.674 1.00 0.00 O ATOM 265 CB GLN A 391 -3.445 -0.183 7.533 1.00 0.00 C ATOM 266 CG GLN A 391 -2.418 0.381 8.503 1.00 0.00 C ATOM 267 CD GLN A 391 -3.001 0.653 9.875 1.00 0.00 C ATOM 268 OE1 GLN A 391 -3.269 1.799 10.233 1.00 0.00 O ATOM 269 NE2 GLN A 391 -3.198 -0.404 10.653 1.00 0.00 N ATOM 0 H GLN A 391 -2.930 0.480 5.210 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.887 -1.502 6.889 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -3.920 0.641 7.000 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -4.227 -0.690 8.098 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -1.589 -0.320 8.597 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -2.009 1.306 8.096 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -2.961 -1.337 10.315 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -3.586 -0.283 11.589 1.00 0.00 H new ATOM 278 N TYR A 392 -4.957 -2.110 5.787 1.00 0.00 N ATOM 279 CA TYR A 392 -5.919 -3.175 5.538 1.00 0.00 C ATOM 280 C TYR A 392 -5.300 -4.219 4.620 1.00 0.00 C ATOM 281 O TYR A 392 -5.476 -5.422 4.815 1.00 0.00 O ATOM 282 CB TYR A 392 -7.195 -2.611 4.910 1.00 0.00 C ATOM 283 CG TYR A 392 -7.680 -1.334 5.560 1.00 0.00 C ATOM 284 CD1 TYR A 392 -7.886 -1.264 6.930 1.00 0.00 C ATOM 285 CD2 TYR A 392 -7.931 -0.199 4.799 1.00 0.00 C ATOM 286 CE1 TYR A 392 -8.329 -0.099 7.528 1.00 0.00 C ATOM 287 CE2 TYR A 392 -8.374 0.970 5.389 1.00 0.00 C ATOM 288 CZ TYR A 392 -8.571 1.015 6.751 1.00 0.00 C ATOM 289 OH TYR A 392 -9.013 2.177 7.342 1.00 0.00 O ATOM 0 H TYR A 392 -5.270 -1.181 5.505 1.00 0.00 H new ATOM 0 HA TYR A 392 -6.182 -3.641 6.488 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -7.016 -2.424 3.851 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -7.983 -3.362 4.973 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -7.697 -2.135 7.540 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.778 -0.231 3.730 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -8.485 -0.061 8.596 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.565 1.844 4.784 1.00 0.00 H new ATOM 0 HH TYR A 392 -9.134 2.867 6.657 1.00 0.00 H new ATOM 299 N LEU A 393 -4.556 -3.744 3.623 1.00 0.00 N ATOM 300 CA LEU A 393 -3.887 -4.626 2.678 1.00 0.00 C ATOM 301 C LEU A 393 -2.900 -5.526 3.412 1.00 0.00 C ATOM 302 O LEU A 393 -2.874 -6.739 3.203 1.00 0.00 O ATOM 303 CB LEU A 393 -3.159 -3.807 1.609 1.00 0.00 C ATOM 304 CG LEU A 393 -3.838 -3.783 0.238 1.00 0.00 C ATOM 305 CD1 LEU A 393 -3.675 -2.422 -0.419 1.00 0.00 C ATOM 306 CD2 LEU A 393 -3.271 -4.879 -0.652 1.00 0.00 C ATOM 0 H LEU A 393 -4.403 -2.750 3.451 1.00 0.00 H new ATOM 0 HA LEU A 393 -4.637 -5.248 2.189 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -3.057 -2.782 1.965 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.151 -4.205 1.492 1.00 0.00 H new ATOM 0 HG LEU A 393 -4.903 -3.967 0.378 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -4.165 -2.427 -1.393 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -4.128 -1.657 0.212 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -2.615 -2.205 -0.548 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -3.764 -4.850 -1.624 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -2.200 -4.724 -0.783 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -3.443 -5.850 -0.187 1.00 0.00 H new ATOM 318 N GLU A 394 -2.098 -4.921 4.285 1.00 0.00 N ATOM 319 CA GLU A 394 -1.118 -5.665 5.067 1.00 0.00 C ATOM 320 C GLU A 394 -1.807 -6.773 5.854 1.00 0.00 C ATOM 321 O GLU A 394 -1.324 -7.904 5.913 1.00 0.00 O ATOM 322 CB GLU A 394 -0.373 -4.728 6.022 1.00 0.00 C ATOM 323 CG GLU A 394 0.836 -5.368 6.681 1.00 0.00 C ATOM 324 CD GLU A 394 1.812 -4.344 7.227 1.00 0.00 C ATOM 325 OE1 GLU A 394 2.213 -3.441 6.465 1.00 0.00 O ATOM 326 OE2 GLU A 394 2.174 -4.446 8.419 1.00 0.00 O ATOM 0 H GLU A 394 -2.109 -3.918 4.468 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.396 -6.112 4.384 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -0.051 -3.843 5.472 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -1.062 -4.389 6.796 1.00 0.00 H new ATOM 0 HG2 GLU A 394 0.503 -6.016 7.492 1.00 0.00 H new ATOM 0 HG3 GLU A 394 1.347 -6.002 5.956 1.00 0.00 H new ATOM 333 N GLN A 395 -2.947 -6.440 6.452 1.00 0.00 N ATOM 334 CA GLN A 395 -3.710 -7.413 7.221 1.00 0.00 C ATOM 335 C GLN A 395 -4.166 -8.555 6.321 1.00 0.00 C ATOM 336 O GLN A 395 -4.094 -9.728 6.696 1.00 0.00 O ATOM 337 CB GLN A 395 -4.921 -6.745 7.877 1.00 0.00 C ATOM 338 CG GLN A 395 -4.592 -6.034 9.180 1.00 0.00 C ATOM 339 CD GLN A 395 -5.105 -4.608 9.214 1.00 0.00 C ATOM 340 OE1 GLN A 395 -6.227 -4.330 8.790 1.00 0.00 O ATOM 341 NE2 GLN A 395 -4.285 -3.696 9.723 1.00 0.00 N ATOM 0 H GLN A 395 -3.360 -5.508 6.418 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.068 -7.816 8.004 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -5.351 -6.027 7.179 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.683 -7.500 8.067 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -5.023 -6.591 10.012 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -3.512 -6.031 9.325 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -3.364 -3.972 10.063 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -4.577 -2.720 9.774 1.00 0.00 H new ATOM 350 N GLU A 396 -4.628 -8.204 5.123 1.00 0.00 N ATOM 351 CA GLU A 396 -5.088 -9.196 4.159 1.00 0.00 C ATOM 352 C GLU A 396 -3.961 -10.158 3.801 1.00 0.00 C ATOM 353 O GLU A 396 -4.096 -11.369 3.960 1.00 0.00 O ATOM 354 CB GLU A 396 -5.610 -8.515 2.894 1.00 0.00 C ATOM 355 CG GLU A 396 -6.539 -7.346 3.171 1.00 0.00 C ATOM 356 CD GLU A 396 -7.822 -7.415 2.364 1.00 0.00 C ATOM 357 OE1 GLU A 396 -8.478 -8.477 2.381 1.00 0.00 O ATOM 358 OE2 GLU A 396 -8.169 -6.405 1.717 1.00 0.00 O ATOM 0 H GLU A 396 -4.693 -7.239 4.798 1.00 0.00 H new ATOM 0 HA GLU A 396 -5.901 -9.760 4.616 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -4.763 -8.163 2.305 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -6.137 -9.251 2.287 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -6.783 -7.325 4.233 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -6.021 -6.414 2.944 1.00 0.00 H new ATOM 365 N VAL A 397 -2.847 -9.611 3.320 1.00 0.00 N ATOM 366 CA VAL A 397 -1.699 -10.428 2.945 1.00 0.00 C ATOM 367 C VAL A 397 -1.260 -11.313 4.107 1.00 0.00 C ATOM 368 O VAL A 397 -0.894 -12.473 3.913 1.00 0.00 O ATOM 369 CB VAL A 397 -0.505 -9.565 2.495 1.00 0.00 C ATOM 370 CG1 VAL A 397 -0.812 -8.874 1.177 1.00 0.00 C ATOM 371 CG2 VAL A 397 -0.146 -8.546 3.565 1.00 0.00 C ATOM 0 H VAL A 397 -2.716 -8.609 3.182 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.016 -11.050 2.108 1.00 0.00 H new ATOM 0 HB VAL A 397 0.354 -10.219 2.346 1.00 0.00 H new ATOM 0 HG11 VAL A 397 0.043 -8.269 0.875 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -1.014 -9.623 0.412 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -1.685 -8.233 1.297 1.00 0.00 H new ATOM 0 HG21 VAL A 397 0.700 -7.947 3.228 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -1.001 -7.896 3.750 1.00 0.00 H new ATOM 0 HG23 VAL A 397 0.121 -9.064 4.486 1.00 0.00 H new ATOM 381 N GLU A 398 -1.309 -10.762 5.316 1.00 0.00 N ATOM 382 CA GLU A 398 -0.925 -11.506 6.508 1.00 0.00 C ATOM 383 C GLU A 398 -1.826 -12.722 6.691 1.00 0.00 C ATOM 384 O GLU A 398 -1.352 -13.824 6.969 1.00 0.00 O ATOM 385 CB GLU A 398 -1.000 -10.608 7.745 1.00 0.00 C ATOM 386 CG GLU A 398 0.175 -9.653 7.876 1.00 0.00 C ATOM 387 CD GLU A 398 0.008 -8.677 9.023 1.00 0.00 C ATOM 388 OE1 GLU A 398 0.386 -9.029 10.161 1.00 0.00 O ATOM 389 OE2 GLU A 398 -0.502 -7.561 8.785 1.00 0.00 O ATOM 0 H GLU A 398 -1.611 -9.804 5.495 1.00 0.00 H new ATOM 0 HA GLU A 398 0.103 -11.847 6.383 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -1.924 -10.031 7.709 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -1.049 -11.234 8.636 1.00 0.00 H new ATOM 0 HG2 GLU A 398 1.090 -10.227 8.022 1.00 0.00 H new ATOM 0 HG3 GLU A 398 0.292 -9.098 6.945 1.00 0.00 H new ATOM 396 N GLU A 399 -3.129 -12.514 6.530 1.00 0.00 N ATOM 397 CA GLU A 399 -4.100 -13.594 6.672 1.00 0.00 C ATOM 398 C GLU A 399 -4.293 -14.345 5.354 1.00 0.00 C ATOM 399 O GLU A 399 -5.020 -15.339 5.300 1.00 0.00 O ATOM 400 CB GLU A 399 -5.441 -13.038 7.155 1.00 0.00 C ATOM 401 CG GLU A 399 -6.165 -13.957 8.126 1.00 0.00 C ATOM 402 CD GLU A 399 -7.352 -13.286 8.789 1.00 0.00 C ATOM 403 OE1 GLU A 399 -7.392 -12.037 8.811 1.00 0.00 O ATOM 404 OE2 GLU A 399 -8.242 -14.007 9.286 1.00 0.00 O ATOM 0 H GLU A 399 -3.537 -11.608 6.301 1.00 0.00 H new ATOM 0 HA GLU A 399 -3.713 -14.296 7.410 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -5.274 -12.074 7.636 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -6.082 -12.857 6.292 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -6.505 -14.846 7.594 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -5.467 -14.292 8.893 1.00 0.00 H new ATOM 411 N PHE A 400 -3.644 -13.866 4.293 1.00 0.00 N ATOM 412 CA PHE A 400 -3.748 -14.492 2.976 1.00 0.00 C ATOM 413 C PHE A 400 -3.569 -16.006 3.073 1.00 0.00 C ATOM 414 O PHE A 400 -2.559 -16.490 3.582 1.00 0.00 O ATOM 415 CB PHE A 400 -2.703 -13.898 2.026 1.00 0.00 C ATOM 416 CG PHE A 400 -2.759 -14.460 0.633 1.00 0.00 C ATOM 417 CD1 PHE A 400 -3.697 -14.003 -0.280 1.00 0.00 C ATOM 418 CD2 PHE A 400 -1.870 -15.447 0.234 1.00 0.00 C ATOM 419 CE1 PHE A 400 -3.748 -14.521 -1.558 1.00 0.00 C ATOM 420 CE2 PHE A 400 -1.916 -15.967 -1.045 1.00 0.00 C ATOM 421 CZ PHE A 400 -2.857 -15.503 -1.941 1.00 0.00 C ATOM 0 H PHE A 400 -3.040 -13.045 4.321 1.00 0.00 H new ATOM 0 HA PHE A 400 -4.744 -14.291 2.582 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -2.842 -12.818 1.978 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -1.709 -14.073 2.439 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -4.396 -13.233 0.012 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.132 -15.814 0.932 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -4.485 -14.158 -2.259 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -1.217 -16.735 -1.343 1.00 0.00 H new ATOM 0 HZ PHE A 400 -2.896 -15.908 -2.941 1.00 0.00 H new ATOM 431 N VAL A 401 -4.563 -16.746 2.584 1.00 0.00 N ATOM 432 CA VAL A 401 -4.527 -18.205 2.613 1.00 0.00 C ATOM 433 C VAL A 401 -3.167 -18.741 2.168 1.00 0.00 C ATOM 434 O VAL A 401 -2.603 -19.633 2.800 1.00 0.00 O ATOM 435 CB VAL A 401 -5.627 -18.806 1.716 1.00 0.00 C ATOM 436 CG1 VAL A 401 -5.457 -18.337 0.278 1.00 0.00 C ATOM 437 CG2 VAL A 401 -5.620 -20.326 1.796 1.00 0.00 C ATOM 0 H VAL A 401 -5.406 -16.356 2.162 1.00 0.00 H new ATOM 0 HA VAL A 401 -4.703 -18.504 3.646 1.00 0.00 H new ATOM 0 HB VAL A 401 -6.594 -18.456 2.077 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -6.242 -18.771 -0.341 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -5.524 -17.250 0.240 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -4.483 -18.654 -0.095 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -6.405 -20.728 1.155 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -4.652 -20.703 1.465 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -5.798 -20.637 2.825 1.00 0.00 H new ATOM 447 N GLY A 402 -2.647 -18.185 1.080 1.00 0.00 N ATOM 448 CA GLY A 402 -1.358 -18.613 0.570 1.00 0.00 C ATOM 449 C GLY A 402 -1.446 -19.194 -0.829 1.00 0.00 C ATOM 450 O GLY A 402 -0.559 -19.934 -1.255 1.00 0.00 O ATOM 0 H GLY A 402 -3.096 -17.444 0.541 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -0.674 -17.764 0.564 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -0.935 -19.359 1.243 1.00 0.00 H new ATOM 454 N LYS A 403 -2.516 -18.862 -1.546 1.00 0.00 N ATOM 455 CA LYS A 403 -2.708 -19.359 -2.901 1.00 0.00 C ATOM 456 C LYS A 403 -3.458 -18.340 -3.754 1.00 0.00 C ATOM 457 O LYS A 403 -4.291 -17.587 -3.249 1.00 0.00 O ATOM 458 CB LYS A 403 -3.469 -20.686 -2.879 1.00 0.00 C ATOM 459 CG LYS A 403 -4.790 -20.615 -2.129 1.00 0.00 C ATOM 460 CD LYS A 403 -5.791 -21.624 -2.669 1.00 0.00 C ATOM 461 CE LYS A 403 -5.883 -22.852 -1.779 1.00 0.00 C ATOM 462 NZ LYS A 403 -6.257 -22.499 -0.381 1.00 0.00 N ATOM 0 H LYS A 403 -3.261 -18.252 -1.210 1.00 0.00 H new ATOM 0 HA LYS A 403 -1.725 -19.522 -3.344 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -3.659 -21.004 -3.904 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -2.840 -21.449 -2.420 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -4.619 -20.802 -1.069 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -5.204 -19.610 -2.212 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -6.773 -21.157 -2.748 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -5.499 -21.924 -3.675 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -6.620 -23.543 -2.189 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -4.925 -23.372 -1.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -6.817 -23.271 0.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -5.395 -22.354 0.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -6.820 -21.625 -0.383 1.00 0.00 H new ATOM 476 N LYS A 404 -3.154 -18.322 -5.047 1.00 0.00 N ATOM 477 CA LYS A 404 -3.797 -17.394 -5.972 1.00 0.00 C ATOM 478 C LYS A 404 -5.127 -17.954 -6.477 1.00 0.00 C ATOM 479 O LYS A 404 -5.347 -18.065 -7.682 1.00 0.00 O ATOM 480 CB LYS A 404 -2.872 -17.099 -7.154 1.00 0.00 C ATOM 481 CG LYS A 404 -3.183 -15.790 -7.858 1.00 0.00 C ATOM 482 CD LYS A 404 -3.636 -16.018 -9.292 1.00 0.00 C ATOM 483 CE LYS A 404 -4.254 -14.764 -9.888 1.00 0.00 C ATOM 484 NZ LYS A 404 -5.216 -15.082 -10.979 1.00 0.00 N ATOM 0 H LYS A 404 -2.466 -18.939 -5.479 1.00 0.00 H new ATOM 0 HA LYS A 404 -3.998 -16.467 -5.435 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -1.841 -17.076 -6.801 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -2.944 -17.915 -7.873 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -3.961 -15.258 -7.311 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -2.298 -15.154 -7.852 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -2.785 -16.329 -9.898 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -4.361 -16.831 -9.320 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -4.766 -14.204 -9.105 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -3.465 -14.120 -10.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -5.615 -14.200 -11.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -4.723 -15.594 -11.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -5.983 -15.675 -10.603 1.00 0.00 H new ATOM 498 N THR A 405 -6.008 -18.305 -5.546 1.00 0.00 N ATOM 499 CA THR A 405 -7.313 -18.854 -5.898 1.00 0.00 C ATOM 500 C THR A 405 -8.444 -18.025 -5.291 1.00 0.00 C ATOM 501 O THR A 405 -9.529 -17.927 -5.863 1.00 0.00 O ATOM 502 CB THR A 405 -7.423 -20.305 -5.429 1.00 0.00 C ATOM 503 OG1 THR A 405 -6.251 -21.028 -5.757 1.00 0.00 O ATOM 504 CG2 THR A 405 -8.601 -21.042 -6.031 1.00 0.00 C ATOM 0 H THR A 405 -5.843 -18.219 -4.543 1.00 0.00 H new ATOM 0 HA THR A 405 -7.408 -18.819 -6.983 1.00 0.00 H new ATOM 0 HB THR A 405 -7.564 -20.249 -4.350 1.00 0.00 H new ATOM 0 HG1 THR A 405 -6.446 -21.988 -5.748 1.00 0.00 H new ATOM 0 HG21 THR A 405 -8.620 -22.065 -5.656 1.00 0.00 H new ATOM 0 HG22 THR A 405 -9.526 -20.537 -5.754 1.00 0.00 H new ATOM 0 HG23 THR A 405 -8.506 -21.055 -7.117 1.00 0.00 H new ATOM 512 N ASP A 406 -8.184 -17.431 -4.129 1.00 0.00 N ATOM 513 CA ASP A 406 -9.183 -16.614 -3.449 1.00 0.00 C ATOM 514 C ASP A 406 -9.180 -15.187 -3.989 1.00 0.00 C ATOM 515 O ASP A 406 -8.263 -14.785 -4.705 1.00 0.00 O ATOM 516 CB ASP A 406 -8.919 -16.601 -1.942 1.00 0.00 C ATOM 517 CG ASP A 406 -10.142 -16.195 -1.141 1.00 0.00 C ATOM 518 OD1 ASP A 406 -11.195 -15.926 -1.758 1.00 0.00 O ATOM 519 OD2 ASP A 406 -10.046 -16.145 0.104 1.00 0.00 O ATOM 0 H ASP A 406 -7.291 -17.500 -3.640 1.00 0.00 H new ATOM 0 HA ASP A 406 -10.163 -17.052 -3.637 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -8.594 -17.592 -1.625 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -8.102 -15.913 -1.726 1.00 0.00 H new ATOM 524 N LYS A 407 -10.214 -14.428 -3.640 1.00 0.00 N ATOM 525 CA LYS A 407 -10.335 -13.045 -4.088 1.00 0.00 C ATOM 526 C LYS A 407 -9.305 -12.149 -3.402 1.00 0.00 C ATOM 527 O LYS A 407 -9.023 -11.042 -3.866 1.00 0.00 O ATOM 528 CB LYS A 407 -11.746 -12.520 -3.815 1.00 0.00 C ATOM 529 CG LYS A 407 -12.841 -13.376 -4.428 1.00 0.00 C ATOM 530 CD LYS A 407 -13.428 -14.343 -3.413 1.00 0.00 C ATOM 531 CE LYS A 407 -14.861 -14.713 -3.760 1.00 0.00 C ATOM 532 NZ LYS A 407 -14.939 -15.521 -5.009 1.00 0.00 N ATOM 0 H LYS A 407 -10.981 -14.748 -3.048 1.00 0.00 H new ATOM 0 HA LYS A 407 -10.145 -13.024 -5.161 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -11.901 -12.462 -2.738 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -11.829 -11.505 -4.204 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -13.630 -12.734 -4.818 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -12.437 -13.934 -5.273 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -12.818 -15.245 -3.373 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -13.397 -13.893 -2.421 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -15.301 -15.275 -2.936 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -15.452 -13.805 -3.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -15.933 -15.753 -5.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -14.543 -14.975 -5.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -14.396 -16.400 -4.888 1.00 0.00 H new ATOM 546 N ALA A 408 -8.744 -12.631 -2.295 1.00 0.00 N ATOM 547 CA ALA A 408 -7.748 -11.872 -1.548 1.00 0.00 C ATOM 548 C ALA A 408 -6.615 -11.403 -2.456 1.00 0.00 C ATOM 549 O ALA A 408 -6.398 -10.204 -2.627 1.00 0.00 O ATOM 550 CB ALA A 408 -7.196 -12.708 -0.405 1.00 0.00 C ATOM 0 H ALA A 408 -8.963 -13.544 -1.897 1.00 0.00 H new ATOM 0 HA ALA A 408 -8.237 -10.989 -1.137 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -6.454 -12.129 0.144 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -8.008 -12.987 0.267 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -6.730 -13.609 -0.805 1.00 0.00 H new ATOM 556 N TYR A 409 -5.894 -12.355 -3.040 1.00 0.00 N ATOM 557 CA TYR A 409 -4.784 -12.032 -3.930 1.00 0.00 C ATOM 558 C TYR A 409 -5.210 -11.032 -4.999 1.00 0.00 C ATOM 559 O TYR A 409 -4.458 -10.120 -5.346 1.00 0.00 O ATOM 560 CB TYR A 409 -4.242 -13.300 -4.587 1.00 0.00 C ATOM 561 CG TYR A 409 -2.755 -13.251 -4.859 1.00 0.00 C ATOM 562 CD1 TYR A 409 -1.845 -13.103 -3.820 1.00 0.00 C ATOM 563 CD2 TYR A 409 -2.261 -13.354 -6.154 1.00 0.00 C ATOM 564 CE1 TYR A 409 -0.485 -13.057 -4.062 1.00 0.00 C ATOM 565 CE2 TYR A 409 -0.903 -13.309 -6.404 1.00 0.00 C ATOM 566 CZ TYR A 409 -0.019 -13.160 -5.356 1.00 0.00 C ATOM 567 OH TYR A 409 1.333 -13.115 -5.601 1.00 0.00 O ATOM 0 H TYR A 409 -6.058 -13.354 -2.914 1.00 0.00 H new ATOM 0 HA TYR A 409 -3.996 -11.577 -3.330 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.458 -14.153 -3.944 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -4.770 -13.467 -5.526 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -2.206 -13.022 -2.805 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -2.950 -13.471 -6.978 1.00 0.00 H new ATOM 0 HE1 TYR A 409 0.209 -12.941 -3.243 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.535 -13.390 -7.416 1.00 0.00 H new ATOM 0 HH TYR A 409 1.703 -14.022 -5.563 1.00 0.00 H new ATOM 577 N TRP A 410 -6.427 -11.198 -5.512 1.00 0.00 N ATOM 578 CA TRP A 410 -6.952 -10.298 -6.533 1.00 0.00 C ATOM 579 C TRP A 410 -6.934 -8.860 -6.030 1.00 0.00 C ATOM 580 O TRP A 410 -6.211 -8.014 -6.557 1.00 0.00 O ATOM 581 CB TRP A 410 -8.381 -10.685 -6.915 1.00 0.00 C ATOM 582 CG TRP A 410 -8.516 -12.091 -7.415 1.00 0.00 C ATOM 583 CD1 TRP A 410 -7.510 -12.934 -7.791 1.00 0.00 C ATOM 584 CD2 TRP A 410 -9.736 -12.813 -7.596 1.00 0.00 C ATOM 585 NE1 TRP A 410 -8.034 -14.139 -8.195 1.00 0.00 N ATOM 586 CE2 TRP A 410 -9.399 -14.091 -8.083 1.00 0.00 C ATOM 587 CE3 TRP A 410 -11.084 -12.504 -7.390 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -10.360 -15.056 -8.369 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -12.037 -13.463 -7.674 1.00 0.00 C ATOM 590 CH2 TRP A 410 -11.671 -14.726 -8.159 1.00 0.00 C ATOM 0 H TRP A 410 -7.065 -11.945 -5.238 1.00 0.00 H new ATOM 0 HA TRP A 410 -6.316 -10.381 -7.414 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -9.027 -10.555 -6.046 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -8.739 -10.000 -7.684 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -6.458 -12.690 -7.774 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -7.494 -14.939 -8.525 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -11.375 -11.534 -7.016 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -10.081 -16.030 -8.743 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -13.081 -13.236 -7.520 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -12.440 -15.454 -8.371 1.00 0.00 H new ATOM 601 N LEU A 411 -7.732 -8.595 -5.002 1.00 0.00 N ATOM 602 CA LEU A 411 -7.804 -7.262 -4.419 1.00 0.00 C ATOM 603 C LEU A 411 -6.450 -6.852 -3.850 1.00 0.00 C ATOM 604 O LEU A 411 -6.123 -5.668 -3.797 1.00 0.00 O ATOM 605 CB LEU A 411 -8.874 -7.210 -3.327 1.00 0.00 C ATOM 606 CG LEU A 411 -8.769 -8.295 -2.254 1.00 0.00 C ATOM 607 CD1 LEU A 411 -7.888 -7.830 -1.106 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.151 -8.674 -1.745 1.00 0.00 C ATOM 0 H LEU A 411 -8.337 -9.285 -4.556 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.077 -6.560 -5.207 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -8.826 -6.236 -2.841 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -9.854 -7.283 -3.798 1.00 0.00 H new ATOM 0 HG LEU A 411 -8.311 -9.177 -2.701 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -7.826 -8.616 -0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -6.889 -7.607 -1.481 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -8.316 -6.933 -0.659 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.058 -9.447 -0.982 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -10.634 -7.796 -1.315 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -10.753 -9.051 -2.572 1.00 0.00 H new ATOM 620 N LEU A 412 -5.664 -7.841 -3.434 1.00 0.00 N ATOM 621 CA LEU A 412 -4.341 -7.579 -2.877 1.00 0.00 C ATOM 622 C LEU A 412 -3.475 -6.828 -3.884 1.00 0.00 C ATOM 623 O LEU A 412 -3.176 -5.647 -3.704 1.00 0.00 O ATOM 624 CB LEU A 412 -3.658 -8.893 -2.485 1.00 0.00 C ATOM 625 CG LEU A 412 -4.070 -9.470 -1.126 1.00 0.00 C ATOM 626 CD1 LEU A 412 -3.582 -10.903 -0.983 1.00 0.00 C ATOM 627 CD2 LEU A 412 -3.532 -8.603 0.000 1.00 0.00 C ATOM 0 H LEU A 412 -5.919 -8.828 -3.472 1.00 0.00 H new ATOM 0 HA LEU A 412 -4.462 -6.962 -1.987 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -3.869 -9.636 -3.255 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -2.580 -8.735 -2.481 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.158 -9.475 -1.067 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -3.884 -11.295 -0.012 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -4.016 -11.516 -1.773 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -2.495 -10.927 -1.062 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -3.832 -9.025 0.959 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -2.444 -8.568 -0.056 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -3.933 -7.594 -0.094 1.00 0.00 H new ATOM 639 N GLU A 413 -3.078 -7.523 -4.947 1.00 0.00 N ATOM 640 CA GLU A 413 -2.247 -6.927 -5.986 1.00 0.00 C ATOM 641 C GLU A 413 -2.954 -5.746 -6.642 1.00 0.00 C ATOM 642 O GLU A 413 -2.362 -4.684 -6.832 1.00 0.00 O ATOM 643 CB GLU A 413 -1.891 -7.973 -7.043 1.00 0.00 C ATOM 644 CG GLU A 413 -0.538 -7.741 -7.697 1.00 0.00 C ATOM 645 CD GLU A 413 -0.555 -8.023 -9.187 1.00 0.00 C ATOM 646 OE1 GLU A 413 -1.387 -7.420 -9.896 1.00 0.00 O ATOM 647 OE2 GLU A 413 0.265 -8.848 -9.644 1.00 0.00 O ATOM 0 H GLU A 413 -3.319 -8.500 -5.110 1.00 0.00 H new ATOM 0 HA GLU A 413 -1.332 -6.563 -5.519 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -1.898 -8.961 -6.582 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -2.662 -7.976 -7.813 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -0.230 -6.709 -7.530 1.00 0.00 H new ATOM 0 HG3 GLU A 413 0.207 -8.377 -7.219 1.00 0.00 H new ATOM 654 N GLU A 414 -4.224 -5.936 -6.987 1.00 0.00 N ATOM 655 CA GLU A 414 -5.012 -4.884 -7.623 1.00 0.00 C ATOM 656 C GLU A 414 -4.997 -3.609 -6.785 1.00 0.00 C ATOM 657 O GLU A 414 -4.561 -2.555 -7.248 1.00 0.00 O ATOM 658 CB GLU A 414 -6.453 -5.352 -7.835 1.00 0.00 C ATOM 659 CG GLU A 414 -7.179 -4.606 -8.942 1.00 0.00 C ATOM 660 CD GLU A 414 -7.264 -3.115 -8.681 1.00 0.00 C ATOM 661 OE1 GLU A 414 -8.018 -2.712 -7.771 1.00 0.00 O ATOM 662 OE2 GLU A 414 -6.575 -2.349 -9.388 1.00 0.00 O ATOM 0 H GLU A 414 -4.730 -6.809 -6.837 1.00 0.00 H new ATOM 0 HA GLU A 414 -4.563 -4.666 -8.592 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -6.450 -6.417 -8.068 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -7.006 -5.231 -6.904 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -6.665 -4.777 -9.888 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -8.186 -5.011 -9.048 1.00 0.00 H new ATOM 669 N MET A 415 -5.470 -3.715 -5.548 1.00 0.00 N ATOM 670 CA MET A 415 -5.507 -2.571 -4.643 1.00 0.00 C ATOM 671 C MET A 415 -4.112 -1.978 -4.472 1.00 0.00 C ATOM 672 O MET A 415 -3.954 -0.762 -4.360 1.00 0.00 O ATOM 673 CB MET A 415 -6.071 -2.984 -3.283 1.00 0.00 C ATOM 674 CG MET A 415 -6.495 -1.808 -2.418 1.00 0.00 C ATOM 675 SD MET A 415 -8.023 -1.041 -2.991 1.00 0.00 S ATOM 676 CE MET A 415 -9.199 -2.356 -2.679 1.00 0.00 C ATOM 0 H MET A 415 -5.833 -4.581 -5.149 1.00 0.00 H new ATOM 0 HA MET A 415 -6.158 -1.812 -5.078 1.00 0.00 H new ATOM 0 HB2 MET A 415 -6.929 -3.638 -3.438 1.00 0.00 H new ATOM 0 HB3 MET A 415 -5.320 -3.565 -2.749 1.00 0.00 H new ATOM 0 HG2 MET A 415 -6.626 -2.146 -1.390 1.00 0.00 H new ATOM 0 HG3 MET A 415 -5.700 -1.063 -2.409 1.00 0.00 H new ATOM 0 HE1 MET A 415 -10.197 -1.933 -2.567 1.00 0.00 H new ATOM 0 HE2 MET A 415 -9.193 -3.055 -3.515 1.00 0.00 H new ATOM 0 HE3 MET A 415 -8.923 -2.881 -1.765 1.00 0.00 H new ATOM 686 N LEU A 416 -3.105 -2.845 -4.457 1.00 0.00 N ATOM 687 CA LEU A 416 -1.722 -2.406 -4.303 1.00 0.00 C ATOM 688 C LEU A 416 -1.333 -1.442 -5.417 1.00 0.00 C ATOM 689 O LEU A 416 -0.895 -0.321 -5.156 1.00 0.00 O ATOM 690 CB LEU A 416 -0.779 -3.610 -4.305 1.00 0.00 C ATOM 691 CG LEU A 416 0.522 -3.410 -3.530 1.00 0.00 C ATOM 692 CD1 LEU A 416 1.265 -2.185 -4.040 1.00 0.00 C ATOM 693 CD2 LEU A 416 0.236 -3.283 -2.041 1.00 0.00 C ATOM 0 H LEU A 416 -3.220 -3.854 -4.549 1.00 0.00 H new ATOM 0 HA LEU A 416 -1.636 -1.887 -3.348 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -1.306 -4.467 -3.886 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -0.535 -3.860 -5.337 1.00 0.00 H new ATOM 0 HG LEU A 416 1.156 -4.282 -3.686 1.00 0.00 H new ATOM 0 HD11 LEU A 416 2.189 -2.059 -3.476 1.00 0.00 H new ATOM 0 HD12 LEU A 416 1.500 -2.315 -5.096 1.00 0.00 H new ATOM 0 HD13 LEU A 416 0.639 -1.301 -3.914 1.00 0.00 H new ATOM 0 HD21 LEU A 416 1.172 -3.141 -1.501 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -0.416 -2.427 -1.867 1.00 0.00 H new ATOM 0 HD23 LEU A 416 -0.253 -4.190 -1.686 1.00 0.00 H new ATOM 705 N THR A 417 -1.496 -1.883 -6.659 1.00 0.00 N ATOM 706 CA THR A 417 -1.163 -1.059 -7.815 1.00 0.00 C ATOM 707 C THR A 417 -1.961 0.241 -7.802 1.00 0.00 C ATOM 708 O THR A 417 -1.412 1.321 -8.023 1.00 0.00 O ATOM 709 CB THR A 417 -1.434 -1.824 -9.111 1.00 0.00 C ATOM 710 OG1 THR A 417 -2.670 -2.515 -9.036 1.00 0.00 O ATOM 711 CG2 THR A 417 -0.361 -2.838 -9.443 1.00 0.00 C ATOM 0 H THR A 417 -1.857 -2.808 -6.892 1.00 0.00 H new ATOM 0 HA THR A 417 -0.102 -0.815 -7.762 1.00 0.00 H new ATOM 0 HB THR A 417 -1.451 -1.067 -9.895 1.00 0.00 H new ATOM 0 HG1 THR A 417 -3.104 -2.318 -8.179 1.00 0.00 H new ATOM 0 HG21 THR A 417 -0.615 -3.345 -10.374 1.00 0.00 H new ATOM 0 HG22 THR A 417 0.597 -2.330 -9.556 1.00 0.00 H new ATOM 0 HG23 THR A 417 -0.291 -3.570 -8.639 1.00 0.00 H new ATOM 719 N LYS A 418 -3.259 0.129 -7.539 1.00 0.00 N ATOM 720 CA LYS A 418 -4.132 1.296 -7.495 1.00 0.00 C ATOM 721 C LYS A 418 -3.662 2.286 -6.434 1.00 0.00 C ATOM 722 O LYS A 418 -3.505 3.477 -6.705 1.00 0.00 O ATOM 723 CB LYS A 418 -5.573 0.871 -7.210 1.00 0.00 C ATOM 724 CG LYS A 418 -6.249 0.186 -8.386 1.00 0.00 C ATOM 725 CD LYS A 418 -6.916 1.193 -9.308 1.00 0.00 C ATOM 726 CE LYS A 418 -6.777 0.790 -10.767 1.00 0.00 C ATOM 727 NZ LYS A 418 -7.385 1.795 -11.682 1.00 0.00 N ATOM 0 H LYS A 418 -3.729 -0.757 -7.353 1.00 0.00 H new ATOM 0 HA LYS A 418 -4.091 1.786 -8.468 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -5.581 0.197 -6.354 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -6.153 1.750 -6.929 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -5.512 -0.389 -8.946 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -6.993 -0.521 -8.018 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -7.972 1.278 -9.052 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -6.471 2.177 -9.157 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -5.722 0.669 -11.011 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -7.253 -0.178 -10.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -7.269 1.483 -12.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -8.398 1.893 -11.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -6.914 2.713 -11.552 1.00 0.00 H new ATOM 741 N GLU A 419 -3.436 1.783 -5.223 1.00 0.00 N ATOM 742 CA GLU A 419 -2.981 2.623 -4.119 1.00 0.00 C ATOM 743 C GLU A 419 -1.650 3.286 -4.455 1.00 0.00 C ATOM 744 O GLU A 419 -1.441 4.464 -4.161 1.00 0.00 O ATOM 745 CB GLU A 419 -2.846 1.789 -2.842 1.00 0.00 C ATOM 746 CG GLU A 419 -3.952 2.045 -1.831 1.00 0.00 C ATOM 747 CD GLU A 419 -3.755 3.340 -1.068 1.00 0.00 C ATOM 748 OE1 GLU A 419 -2.587 3.724 -0.843 1.00 0.00 O ATOM 749 OE2 GLU A 419 -4.766 3.971 -0.696 1.00 0.00 O ATOM 0 H GLU A 419 -3.560 0.800 -4.982 1.00 0.00 H new ATOM 0 HA GLU A 419 -3.723 3.405 -3.956 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -2.844 0.732 -3.107 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -1.883 2.003 -2.378 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -4.912 2.074 -2.347 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -3.994 1.215 -1.126 1.00 0.00 H new ATOM 756 N LEU A 420 -0.753 2.524 -5.073 1.00 0.00 N ATOM 757 CA LEU A 420 0.559 3.039 -5.448 1.00 0.00 C ATOM 758 C LEU A 420 0.425 4.228 -6.394 1.00 0.00 C ATOM 759 O LEU A 420 0.996 5.292 -6.156 1.00 0.00 O ATOM 760 CB LEU A 420 1.393 1.939 -6.107 1.00 0.00 C ATOM 761 CG LEU A 420 2.895 2.010 -5.826 1.00 0.00 C ATOM 762 CD1 LEU A 420 3.628 0.899 -6.562 1.00 0.00 C ATOM 763 CD2 LEU A 420 3.447 3.370 -6.225 1.00 0.00 C ATOM 0 H LEU A 420 -0.911 1.548 -5.325 1.00 0.00 H new ATOM 0 HA LEU A 420 1.064 3.373 -4.542 1.00 0.00 H new ATOM 0 HB2 LEU A 420 1.021 0.971 -5.771 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.238 1.983 -7.185 1.00 0.00 H new ATOM 0 HG LEU A 420 3.053 1.875 -4.756 1.00 0.00 H new ATOM 0 HD11 LEU A 420 4.695 0.965 -6.351 1.00 0.00 H new ATOM 0 HD12 LEU A 420 3.251 -0.068 -6.229 1.00 0.00 H new ATOM 0 HD13 LEU A 420 3.464 1.003 -7.635 1.00 0.00 H new ATOM 0 HD21 LEU A 420 4.517 3.403 -6.018 1.00 0.00 H new ATOM 0 HD22 LEU A 420 3.278 3.533 -7.289 1.00 0.00 H new ATOM 0 HD23 LEU A 420 2.943 4.149 -5.654 1.00 0.00 H new ATOM 775 N LEU A 421 -0.338 4.040 -7.466 1.00 0.00 N ATOM 776 CA LEU A 421 -0.549 5.098 -8.448 1.00 0.00 C ATOM 777 C LEU A 421 -1.205 6.315 -7.802 1.00 0.00 C ATOM 778 O LEU A 421 -0.868 7.456 -8.120 1.00 0.00 O ATOM 779 CB LEU A 421 -1.418 4.588 -9.600 1.00 0.00 C ATOM 780 CG LEU A 421 -0.650 3.929 -10.747 1.00 0.00 C ATOM 781 CD1 LEU A 421 -0.439 2.449 -10.467 1.00 0.00 C ATOM 782 CD2 LEU A 421 -1.388 4.124 -12.062 1.00 0.00 C ATOM 0 H LEU A 421 -0.820 3.166 -7.677 1.00 0.00 H new ATOM 0 HA LEU A 421 0.424 5.396 -8.840 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -2.136 3.870 -9.203 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -1.992 5.424 -10.000 1.00 0.00 H new ATOM 0 HG LEU A 421 0.327 4.406 -10.827 1.00 0.00 H new ATOM 0 HD11 LEU A 421 0.109 1.997 -11.294 1.00 0.00 H new ATOM 0 HD12 LEU A 421 0.131 2.331 -9.546 1.00 0.00 H new ATOM 0 HD13 LEU A 421 -1.406 1.957 -10.361 1.00 0.00 H new ATOM 0 HD21 LEU A 421 -0.828 3.649 -12.867 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -2.378 3.673 -11.994 1.00 0.00 H new ATOM 0 HD23 LEU A 421 -1.488 5.190 -12.269 1.00 0.00 H new ATOM 794 N GLU A 422 -2.140 6.063 -6.892 1.00 0.00 N ATOM 795 CA GLU A 422 -2.843 7.139 -6.202 1.00 0.00 C ATOM 796 C GLU A 422 -1.913 7.866 -5.236 1.00 0.00 C ATOM 797 O GLU A 422 -1.982 9.087 -5.092 1.00 0.00 O ATOM 798 CB GLU A 422 -4.051 6.583 -5.444 1.00 0.00 C ATOM 799 CG GLU A 422 -5.097 5.949 -6.346 1.00 0.00 C ATOM 800 CD GLU A 422 -6.006 6.977 -6.992 1.00 0.00 C ATOM 801 OE1 GLU A 422 -6.358 7.966 -6.317 1.00 0.00 O ATOM 802 OE2 GLU A 422 -6.366 6.791 -8.175 1.00 0.00 O ATOM 0 H GLU A 422 -2.428 5.125 -6.615 1.00 0.00 H new ATOM 0 HA GLU A 422 -3.188 7.852 -6.951 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -3.707 5.841 -4.723 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -4.515 7.389 -4.875 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -4.599 5.370 -7.123 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -5.699 5.251 -5.764 1.00 0.00 H new ATOM 809 N LEU A 423 -1.042 7.108 -4.577 1.00 0.00 N ATOM 810 CA LEU A 423 -0.098 7.680 -3.625 1.00 0.00 C ATOM 811 C LEU A 423 0.935 8.548 -4.336 1.00 0.00 C ATOM 812 O LEU A 423 1.346 9.589 -3.823 1.00 0.00 O ATOM 813 CB LEU A 423 0.605 6.569 -2.841 1.00 0.00 C ATOM 814 CG LEU A 423 1.708 7.041 -1.892 1.00 0.00 C ATOM 815 CD1 LEU A 423 1.769 6.155 -0.657 1.00 0.00 C ATOM 816 CD2 LEU A 423 3.052 7.057 -2.606 1.00 0.00 C ATOM 0 H LEU A 423 -0.971 6.096 -4.685 1.00 0.00 H new ATOM 0 HA LEU A 423 -0.657 8.308 -2.931 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -0.142 6.025 -2.263 1.00 0.00 H new ATOM 0 HB3 LEU A 423 1.036 5.862 -3.550 1.00 0.00 H new ATOM 0 HG LEU A 423 1.475 8.056 -1.572 1.00 0.00 H new ATOM 0 HD11 LEU A 423 2.560 6.508 0.005 1.00 0.00 H new ATOM 0 HD12 LEU A 423 0.814 6.194 -0.134 1.00 0.00 H new ATOM 0 HD13 LEU A 423 1.977 5.128 -0.956 1.00 0.00 H new ATOM 0 HD21 LEU A 423 3.826 7.395 -1.917 1.00 0.00 H new ATOM 0 HD22 LEU A 423 3.291 6.052 -2.955 1.00 0.00 H new ATOM 0 HD23 LEU A 423 3.003 7.735 -3.458 1.00 0.00 H new ATOM 828 N ASP A 424 1.350 8.112 -5.521 1.00 0.00 N ATOM 829 CA ASP A 424 2.337 8.846 -6.305 1.00 0.00 C ATOM 830 C ASP A 424 1.862 10.267 -6.602 1.00 0.00 C ATOM 831 O ASP A 424 2.668 11.148 -6.902 1.00 0.00 O ATOM 832 CB ASP A 424 2.628 8.110 -7.615 1.00 0.00 C ATOM 833 CG ASP A 424 3.785 7.139 -7.486 1.00 0.00 C ATOM 834 OD1 ASP A 424 4.872 7.565 -7.042 1.00 0.00 O ATOM 835 OD2 ASP A 424 3.605 5.953 -7.833 1.00 0.00 O ATOM 0 H ASP A 424 1.018 7.253 -5.960 1.00 0.00 H new ATOM 0 HA ASP A 424 3.252 8.908 -5.716 1.00 0.00 H new ATOM 0 HB2 ASP A 424 1.736 7.569 -7.931 1.00 0.00 H new ATOM 0 HB3 ASP A 424 2.852 8.837 -8.395 1.00 0.00 H new ATOM 840 N SER A 425 0.552 10.483 -6.524 1.00 0.00 N ATOM 841 CA SER A 425 -0.022 11.797 -6.790 1.00 0.00 C ATOM 842 C SER A 425 -0.213 12.590 -5.500 1.00 0.00 C ATOM 843 O SER A 425 -1.202 13.308 -5.343 1.00 0.00 O ATOM 844 CB SER A 425 -1.360 11.653 -7.517 1.00 0.00 C ATOM 845 OG SER A 425 -1.173 11.559 -8.918 1.00 0.00 O ATOM 0 H SER A 425 -0.131 9.766 -6.279 1.00 0.00 H new ATOM 0 HA SER A 425 0.675 12.344 -7.425 1.00 0.00 H new ATOM 0 HB2 SER A 425 -1.879 10.765 -7.156 1.00 0.00 H new ATOM 0 HB3 SER A 425 -1.995 12.509 -7.289 1.00 0.00 H new ATOM 0 HG SER A 425 -2.043 11.466 -9.359 1.00 0.00 H new ATOM 851 N VAL A 426 0.736 12.460 -4.578 1.00 0.00 N ATOM 852 CA VAL A 426 0.664 13.169 -3.305 1.00 0.00 C ATOM 853 C VAL A 426 1.626 14.353 -3.282 1.00 0.00 C ATOM 854 O VAL A 426 2.838 14.185 -3.426 1.00 0.00 O ATOM 855 CB VAL A 426 0.977 12.240 -2.116 1.00 0.00 C ATOM 856 CG1 VAL A 426 2.400 11.708 -2.199 1.00 0.00 C ATOM 857 CG2 VAL A 426 0.750 12.965 -0.797 1.00 0.00 C ATOM 0 H VAL A 426 1.562 11.872 -4.688 1.00 0.00 H new ATOM 0 HA VAL A 426 -0.359 13.531 -3.205 1.00 0.00 H new ATOM 0 HB VAL A 426 0.297 11.389 -2.163 1.00 0.00 H new ATOM 0 HG11 VAL A 426 2.595 11.055 -1.348 1.00 0.00 H new ATOM 0 HG12 VAL A 426 2.525 11.145 -3.124 1.00 0.00 H new ATOM 0 HG13 VAL A 426 3.102 12.542 -2.184 1.00 0.00 H new ATOM 0 HG21 VAL A 426 0.976 12.293 0.031 1.00 0.00 H new ATOM 0 HG22 VAL A 426 1.401 13.837 -0.745 1.00 0.00 H new ATOM 0 HG23 VAL A 426 -0.290 13.284 -0.732 1.00 0.00 H new ATOM 867 N GLU A 427 1.080 15.551 -3.101 1.00 0.00 N ATOM 868 CA GLU A 427 1.891 16.762 -3.059 1.00 0.00 C ATOM 869 C GLU A 427 2.787 16.775 -1.824 1.00 0.00 C ATOM 870 O GLU A 427 2.373 16.358 -0.742 1.00 0.00 O ATOM 871 CB GLU A 427 0.995 18.002 -3.064 1.00 0.00 C ATOM 872 CG GLU A 427 -0.149 17.929 -2.066 1.00 0.00 C ATOM 873 CD GLU A 427 -1.465 17.545 -2.712 1.00 0.00 C ATOM 874 OE1 GLU A 427 -1.571 16.405 -3.211 1.00 0.00 O ATOM 875 OE2 GLU A 427 -2.389 18.385 -2.722 1.00 0.00 O ATOM 0 H GLU A 427 0.079 15.709 -2.981 1.00 0.00 H new ATOM 0 HA GLU A 427 2.524 16.775 -3.946 1.00 0.00 H new ATOM 0 HB2 GLU A 427 1.602 18.880 -2.844 1.00 0.00 H new ATOM 0 HB3 GLU A 427 0.585 18.140 -4.065 1.00 0.00 H new ATOM 0 HG2 GLU A 427 0.096 17.203 -1.291 1.00 0.00 H new ATOM 0 HG3 GLU A 427 -0.259 18.895 -1.574 1.00 0.00 H new ATOM 882 N THR A 428 4.014 17.254 -1.994 1.00 0.00 N ATOM 883 CA THR A 428 4.967 17.320 -0.892 1.00 0.00 C ATOM 884 C THR A 428 6.109 18.277 -1.216 1.00 0.00 C ATOM 885 O THR A 428 7.139 17.873 -1.755 1.00 0.00 O ATOM 886 CB THR A 428 5.525 15.928 -0.591 1.00 0.00 C ATOM 887 OG1 THR A 428 6.572 16.003 0.359 1.00 0.00 O ATOM 888 CG2 THR A 428 6.063 15.221 -1.816 1.00 0.00 C ATOM 0 H THR A 428 4.372 17.602 -2.883 1.00 0.00 H new ATOM 0 HA THR A 428 4.442 17.694 -0.013 1.00 0.00 H new ATOM 0 HB THR A 428 4.682 15.356 -0.204 1.00 0.00 H new ATOM 0 HG1 THR A 428 6.915 15.103 0.540 1.00 0.00 H new ATOM 0 HG21 THR A 428 6.443 14.240 -1.532 1.00 0.00 H new ATOM 0 HG22 THR A 428 5.264 15.103 -2.548 1.00 0.00 H new ATOM 0 HG23 THR A 428 6.870 15.811 -2.251 1.00 0.00 H new ATOM 896 N GLY A 429 5.920 19.550 -0.881 1.00 0.00 N ATOM 897 CA GLY A 429 6.943 20.545 -1.142 1.00 0.00 C ATOM 898 C GLY A 429 7.864 20.752 0.044 1.00 0.00 C ATOM 899 O GLY A 429 7.776 21.765 0.738 1.00 0.00 O ATOM 0 H GLY A 429 5.077 19.909 -0.434 1.00 0.00 H new ATOM 0 HA2 GLY A 429 7.532 20.239 -2.007 1.00 0.00 H new ATOM 0 HA3 GLY A 429 6.468 21.492 -1.399 1.00 0.00 H new ATOM 903 N GLY A 430 8.749 19.788 0.279 1.00 0.00 N ATOM 904 CA GLY A 430 9.675 19.888 1.391 1.00 0.00 C ATOM 905 C GLY A 430 9.022 19.563 2.719 1.00 0.00 C ATOM 906 O GLY A 430 9.313 20.196 3.733 1.00 0.00 O ATOM 0 H GLY A 430 8.841 18.940 -0.281 1.00 0.00 H new ATOM 0 HA2 GLY A 430 10.512 19.209 1.225 1.00 0.00 H new ATOM 0 HA3 GLY A 430 10.085 20.897 1.429 1.00 0.00 H new ATOM 910 N GLN A 431 8.133 18.574 2.712 1.00 0.00 N ATOM 911 CA GLN A 431 7.435 18.165 3.925 1.00 0.00 C ATOM 912 C GLN A 431 8.115 16.959 4.565 1.00 0.00 C ATOM 913 O GLN A 431 8.276 15.916 3.932 1.00 0.00 O ATOM 914 CB GLN A 431 5.973 17.835 3.608 1.00 0.00 C ATOM 915 CG GLN A 431 4.978 18.701 4.362 1.00 0.00 C ATOM 916 CD GLN A 431 5.208 18.684 5.861 1.00 0.00 C ATOM 917 OE1 GLN A 431 6.106 19.355 6.370 1.00 0.00 O ATOM 918 NE2 GLN A 431 4.395 17.914 6.575 1.00 0.00 N ATOM 0 H GLN A 431 7.880 18.042 1.880 1.00 0.00 H new ATOM 0 HA GLN A 431 7.469 18.994 4.632 1.00 0.00 H new ATOM 0 HB2 GLN A 431 5.806 17.953 2.537 1.00 0.00 H new ATOM 0 HB3 GLN A 431 5.785 16.788 3.847 1.00 0.00 H new ATOM 0 HG2 GLN A 431 5.047 19.727 3.999 1.00 0.00 H new ATOM 0 HG3 GLN A 431 3.967 18.355 4.149 1.00 0.00 H new ATOM 0 HE21 GLN A 431 3.664 17.375 6.110 1.00 0.00 H new ATOM 0 HE22 GLN A 431 4.501 17.862 7.588 1.00 0.00 H new ATOM 927 N ASP A 432 8.510 17.110 5.824 1.00 0.00 N ATOM 928 CA ASP A 432 9.171 16.033 6.552 1.00 0.00 C ATOM 929 C ASP A 432 8.189 14.912 6.873 1.00 0.00 C ATOM 930 O ASP A 432 8.509 13.731 6.725 1.00 0.00 O ATOM 931 CB ASP A 432 9.792 16.567 7.843 1.00 0.00 C ATOM 932 CG ASP A 432 11.112 15.896 8.171 1.00 0.00 C ATOM 933 OD1 ASP A 432 11.998 15.869 7.291 1.00 0.00 O ATOM 934 OD2 ASP A 432 11.260 15.399 9.306 1.00 0.00 O ATOM 0 H ASP A 432 8.384 17.967 6.362 1.00 0.00 H new ATOM 0 HA ASP A 432 9.960 15.630 5.917 1.00 0.00 H new ATOM 0 HB2 ASP A 432 9.947 17.642 7.751 1.00 0.00 H new ATOM 0 HB3 ASP A 432 9.096 16.415 8.668 1.00 0.00 H new ATOM 939 N SER A 433 6.991 15.287 7.312 1.00 0.00 N ATOM 940 CA SER A 433 5.963 14.311 7.652 1.00 0.00 C ATOM 941 C SER A 433 5.501 13.555 6.412 1.00 0.00 C ATOM 942 O SER A 433 5.339 12.335 6.439 1.00 0.00 O ATOM 943 CB SER A 433 4.771 15.005 8.314 1.00 0.00 C ATOM 944 OG SER A 433 5.077 15.387 9.645 1.00 0.00 O ATOM 0 H SER A 433 6.709 16.259 7.440 1.00 0.00 H new ATOM 0 HA SER A 433 6.393 13.596 8.353 1.00 0.00 H new ATOM 0 HB2 SER A 433 4.491 15.885 7.735 1.00 0.00 H new ATOM 0 HB3 SER A 433 3.910 14.336 8.313 1.00 0.00 H new ATOM 0 HG SER A 433 4.300 15.830 10.045 1.00 0.00 H new ATOM 950 N VAL A 434 5.293 14.289 5.322 1.00 0.00 N ATOM 951 CA VAL A 434 4.851 13.685 4.072 1.00 0.00 C ATOM 952 C VAL A 434 5.939 12.793 3.487 1.00 0.00 C ATOM 953 O VAL A 434 5.661 11.697 2.998 1.00 0.00 O ATOM 954 CB VAL A 434 4.458 14.751 3.032 1.00 0.00 C ATOM 955 CG1 VAL A 434 3.819 14.098 1.817 1.00 0.00 C ATOM 956 CG2 VAL A 434 3.521 15.782 3.645 1.00 0.00 C ATOM 0 H VAL A 434 5.423 15.300 5.281 1.00 0.00 H new ATOM 0 HA VAL A 434 3.972 13.084 4.304 1.00 0.00 H new ATOM 0 HB VAL A 434 5.363 15.266 2.709 1.00 0.00 H new ATOM 0 HG11 VAL A 434 3.547 14.865 1.092 1.00 0.00 H new ATOM 0 HG12 VAL A 434 4.526 13.404 1.363 1.00 0.00 H new ATOM 0 HG13 VAL A 434 2.925 13.556 2.124 1.00 0.00 H new ATOM 0 HG21 VAL A 434 3.256 16.525 2.893 1.00 0.00 H new ATOM 0 HG22 VAL A 434 2.617 15.287 4.000 1.00 0.00 H new ATOM 0 HG23 VAL A 434 4.018 16.273 4.482 1.00 0.00 H new ATOM 966 N ARG A 435 7.181 13.265 3.543 1.00 0.00 N ATOM 967 CA ARG A 435 8.311 12.505 3.024 1.00 0.00 C ATOM 968 C ARG A 435 8.444 11.177 3.762 1.00 0.00 C ATOM 969 O ARG A 435 8.516 10.113 3.141 1.00 0.00 O ATOM 970 CB ARG A 435 9.603 13.311 3.159 1.00 0.00 C ATOM 971 CG ARG A 435 9.935 14.140 1.929 1.00 0.00 C ATOM 972 CD ARG A 435 11.202 14.956 2.132 1.00 0.00 C ATOM 973 NE ARG A 435 11.008 16.036 3.096 1.00 0.00 N ATOM 974 CZ ARG A 435 11.809 17.093 3.196 1.00 0.00 C ATOM 975 NH1 ARG A 435 12.860 17.217 2.395 1.00 0.00 N ATOM 976 NH2 ARG A 435 11.560 18.031 4.101 1.00 0.00 N ATOM 0 H ARG A 435 7.429 14.170 3.943 1.00 0.00 H new ATOM 0 HA ARG A 435 8.132 12.303 1.968 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.520 13.973 4.021 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.428 12.628 3.360 1.00 0.00 H new ATOM 0 HG2 ARG A 435 10.058 13.483 1.068 1.00 0.00 H new ATOM 0 HG3 ARG A 435 9.103 14.808 1.704 1.00 0.00 H new ATOM 0 HD2 ARG A 435 12.003 14.302 2.476 1.00 0.00 H new ATOM 0 HD3 ARG A 435 11.520 15.375 1.177 1.00 0.00 H new ATOM 0 HE ARG A 435 10.211 15.976 3.730 1.00 0.00 H new ATOM 0 HH11 ARG A 435 13.057 16.499 1.698 1.00 0.00 H new ATOM 0 HH12 ARG A 435 13.470 18.030 2.477 1.00 0.00 H new ATOM 0 HH21 ARG A 435 10.754 17.941 4.720 1.00 0.00 H new ATOM 0 HH22 ARG A 435 12.174 18.842 4.178 1.00 0.00 H new ATOM 990 N GLN A 436 8.468 11.244 5.089 1.00 0.00 N ATOM 991 CA GLN A 436 8.586 10.047 5.913 1.00 0.00 C ATOM 992 C GLN A 436 7.440 9.083 5.620 1.00 0.00 C ATOM 993 O GLN A 436 7.661 7.907 5.331 1.00 0.00 O ATOM 994 CB GLN A 436 8.593 10.421 7.397 1.00 0.00 C ATOM 995 CG GLN A 436 9.826 9.934 8.140 1.00 0.00 C ATOM 996 CD GLN A 436 9.669 8.520 8.667 1.00 0.00 C ATOM 997 OE1 GLN A 436 10.353 7.600 8.220 1.00 0.00 O ATOM 998 NE2 GLN A 436 8.762 8.342 9.620 1.00 0.00 N ATOM 0 H GLN A 436 8.407 12.115 5.617 1.00 0.00 H new ATOM 0 HA GLN A 436 9.527 9.554 5.671 1.00 0.00 H new ATOM 0 HB2 GLN A 436 8.527 11.505 7.490 1.00 0.00 H new ATOM 0 HB3 GLN A 436 7.705 10.005 7.872 1.00 0.00 H new ATOM 0 HG2 GLN A 436 10.687 9.976 7.473 1.00 0.00 H new ATOM 0 HG3 GLN A 436 10.034 10.607 8.972 1.00 0.00 H new ATOM 0 HE21 GLN A 436 8.218 9.135 9.960 1.00 0.00 H new ATOM 0 HE22 GLN A 436 8.610 7.413 10.012 1.00 0.00 H new ATOM 1007 N ALA A 437 6.214 9.593 5.688 1.00 0.00 N ATOM 1008 CA ALA A 437 5.035 8.779 5.421 1.00 0.00 C ATOM 1009 C ALA A 437 5.084 8.208 4.010 1.00 0.00 C ATOM 1010 O ALA A 437 4.638 7.085 3.767 1.00 0.00 O ATOM 1011 CB ALA A 437 3.770 9.600 5.619 1.00 0.00 C ATOM 0 H ALA A 437 6.012 10.564 5.925 1.00 0.00 H new ATOM 0 HA ALA A 437 5.024 7.948 6.126 1.00 0.00 H new ATOM 0 HB1 ALA A 437 2.898 8.979 5.416 1.00 0.00 H new ATOM 0 HB2 ALA A 437 3.727 9.961 6.647 1.00 0.00 H new ATOM 0 HB3 ALA A 437 3.777 10.450 4.936 1.00 0.00 H new ATOM 1017 N ARG A 438 5.636 8.985 3.083 1.00 0.00 N ATOM 1018 CA ARG A 438 5.752 8.553 1.696 1.00 0.00 C ATOM 1019 C ARG A 438 6.610 7.297 1.600 1.00 0.00 C ATOM 1020 O ARG A 438 6.167 6.270 1.086 1.00 0.00 O ATOM 1021 CB ARG A 438 6.357 9.667 0.839 1.00 0.00 C ATOM 1022 CG ARG A 438 6.249 9.409 -0.657 1.00 0.00 C ATOM 1023 CD ARG A 438 7.264 10.227 -1.436 1.00 0.00 C ATOM 1024 NE ARG A 438 7.796 9.492 -2.582 1.00 0.00 N ATOM 1025 CZ ARG A 438 8.411 10.069 -3.612 1.00 0.00 C ATOM 1026 NH1 ARG A 438 8.574 11.385 -3.646 1.00 0.00 N ATOM 1027 NH2 ARG A 438 8.865 9.325 -4.612 1.00 0.00 N ATOM 0 H ARG A 438 6.009 9.916 3.268 1.00 0.00 H new ATOM 0 HA ARG A 438 4.754 8.325 1.323 1.00 0.00 H new ATOM 0 HB2 ARG A 438 5.858 10.607 1.074 1.00 0.00 H new ATOM 0 HB3 ARG A 438 7.407 9.788 1.104 1.00 0.00 H new ATOM 0 HG2 ARG A 438 6.404 8.349 -0.857 1.00 0.00 H new ATOM 0 HG3 ARG A 438 5.243 9.654 -0.998 1.00 0.00 H new ATOM 0 HD2 ARG A 438 6.798 11.149 -1.782 1.00 0.00 H new ATOM 0 HD3 ARG A 438 8.083 10.512 -0.776 1.00 0.00 H new ATOM 0 HE ARG A 438 7.690 8.478 -2.593 1.00 0.00 H new ATOM 0 HH11 ARG A 438 8.227 11.962 -2.880 1.00 0.00 H new ATOM 0 HH12 ARG A 438 9.046 11.820 -4.439 1.00 0.00 H new ATOM 0 HH21 ARG A 438 8.743 8.313 -4.591 1.00 0.00 H new ATOM 0 HH22 ARG A 438 9.336 9.765 -5.402 1.00 0.00 H new ATOM 1041 N LYS A 439 7.836 7.384 2.107 1.00 0.00 N ATOM 1042 CA LYS A 439 8.753 6.248 2.088 1.00 0.00 C ATOM 1043 C LYS A 439 8.159 5.072 2.854 1.00 0.00 C ATOM 1044 O LYS A 439 8.359 3.913 2.490 1.00 0.00 O ATOM 1045 CB LYS A 439 10.100 6.643 2.696 1.00 0.00 C ATOM 1046 CG LYS A 439 10.780 7.795 1.974 1.00 0.00 C ATOM 1047 CD LYS A 439 10.966 7.494 0.495 1.00 0.00 C ATOM 1048 CE LYS A 439 11.791 8.570 -0.192 1.00 0.00 C ATOM 1049 NZ LYS A 439 11.317 8.832 -1.579 1.00 0.00 N ATOM 0 H LYS A 439 8.217 8.227 2.535 1.00 0.00 H new ATOM 0 HA LYS A 439 8.909 5.948 1.052 1.00 0.00 H new ATOM 0 HB2 LYS A 439 9.951 6.917 3.740 1.00 0.00 H new ATOM 0 HB3 LYS A 439 10.762 5.777 2.685 1.00 0.00 H new ATOM 0 HG2 LYS A 439 10.185 8.701 2.090 1.00 0.00 H new ATOM 0 HG3 LYS A 439 11.750 7.991 2.431 1.00 0.00 H new ATOM 0 HD2 LYS A 439 11.456 6.528 0.378 1.00 0.00 H new ATOM 0 HD3 LYS A 439 9.992 7.417 0.013 1.00 0.00 H new ATOM 0 HE2 LYS A 439 11.742 9.491 0.389 1.00 0.00 H new ATOM 0 HE3 LYS A 439 12.837 8.265 -0.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 11.905 9.572 -2.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 11.388 7.960 -2.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 10.327 9.148 -1.553 1.00 0.00 H new ATOM 1063 N GLU A 440 7.416 5.380 3.913 1.00 0.00 N ATOM 1064 CA GLU A 440 6.781 4.349 4.725 1.00 0.00 C ATOM 1065 C GLU A 440 5.760 3.576 3.898 1.00 0.00 C ATOM 1066 O GLU A 440 5.702 2.346 3.952 1.00 0.00 O ATOM 1067 CB GLU A 440 6.103 4.975 5.945 1.00 0.00 C ATOM 1068 CG GLU A 440 5.398 3.966 6.837 1.00 0.00 C ATOM 1069 CD GLU A 440 6.358 3.204 7.728 1.00 0.00 C ATOM 1070 OE1 GLU A 440 7.160 2.408 7.194 1.00 0.00 O ATOM 1071 OE2 GLU A 440 6.311 3.403 8.960 1.00 0.00 O ATOM 0 H GLU A 440 7.239 6.334 4.228 1.00 0.00 H new ATOM 0 HA GLU A 440 7.550 3.657 5.068 1.00 0.00 H new ATOM 0 HB2 GLU A 440 6.852 5.506 6.533 1.00 0.00 H new ATOM 0 HB3 GLU A 440 5.379 5.716 5.607 1.00 0.00 H new ATOM 0 HG2 GLU A 440 4.666 4.484 7.457 1.00 0.00 H new ATOM 0 HG3 GLU A 440 4.847 3.260 6.216 1.00 0.00 H new ATOM 1078 N ALA A 441 4.959 4.305 3.126 1.00 0.00 N ATOM 1079 CA ALA A 441 3.943 3.691 2.281 1.00 0.00 C ATOM 1080 C ALA A 441 4.589 2.835 1.197 1.00 0.00 C ATOM 1081 O ALA A 441 4.296 1.646 1.075 1.00 0.00 O ATOM 1082 CB ALA A 441 3.058 4.759 1.658 1.00 0.00 C ATOM 0 H ALA A 441 4.995 5.323 3.069 1.00 0.00 H new ATOM 0 HA ALA A 441 3.324 3.044 2.903 1.00 0.00 H new ATOM 0 HB1 ALA A 441 2.304 4.285 1.029 1.00 0.00 H new ATOM 0 HB2 ALA A 441 2.567 5.330 2.446 1.00 0.00 H new ATOM 0 HB3 ALA A 441 3.668 5.428 1.051 1.00 0.00 H new ATOM 1088 N VAL A 442 5.474 3.449 0.416 1.00 0.00 N ATOM 1089 CA VAL A 442 6.171 2.744 -0.657 1.00 0.00 C ATOM 1090 C VAL A 442 6.807 1.457 -0.140 1.00 0.00 C ATOM 1091 O VAL A 442 6.742 0.412 -0.790 1.00 0.00 O ATOM 1092 CB VAL A 442 7.265 3.625 -1.288 1.00 0.00 C ATOM 1093 CG1 VAL A 442 6.646 4.748 -2.104 1.00 0.00 C ATOM 1094 CG2 VAL A 442 8.179 4.179 -0.215 1.00 0.00 C ATOM 0 H VAL A 442 5.726 4.433 0.506 1.00 0.00 H new ATOM 0 HA VAL A 442 5.427 2.502 -1.416 1.00 0.00 H new ATOM 0 HB VAL A 442 7.860 3.008 -1.961 1.00 0.00 H new ATOM 0 HG11 VAL A 442 7.436 5.358 -2.541 1.00 0.00 H new ATOM 0 HG12 VAL A 442 6.033 4.324 -2.899 1.00 0.00 H new ATOM 0 HG13 VAL A 442 6.024 5.368 -1.458 1.00 0.00 H new ATOM 0 HG21 VAL A 442 8.947 4.800 -0.676 1.00 0.00 H new ATOM 0 HG22 VAL A 442 7.597 4.781 0.483 1.00 0.00 H new ATOM 0 HG23 VAL A 442 8.651 3.356 0.321 1.00 0.00 H new ATOM 1104 N CYS A 443 7.415 1.539 1.040 1.00 0.00 N ATOM 1105 CA CYS A 443 8.054 0.379 1.649 1.00 0.00 C ATOM 1106 C CYS A 443 7.011 -0.662 2.042 1.00 0.00 C ATOM 1107 O CYS A 443 7.215 -1.860 1.857 1.00 0.00 O ATOM 1108 CB CYS A 443 8.863 0.800 2.876 1.00 0.00 C ATOM 1109 SG CYS A 443 10.448 1.578 2.485 1.00 0.00 S ATOM 0 H CYS A 443 7.478 2.395 1.592 1.00 0.00 H new ATOM 0 HA CYS A 443 8.730 -0.064 0.917 1.00 0.00 H new ATOM 0 HB2 CYS A 443 8.267 1.493 3.470 1.00 0.00 H new ATOM 0 HB3 CYS A 443 9.045 -0.077 3.497 1.00 0.00 H new ATOM 0 HG CYS A 443 10.271 2.852 2.298 1.00 0.00 H new ATOM 1115 N LYS A 444 5.892 -0.190 2.584 1.00 0.00 N ATOM 1116 CA LYS A 444 4.810 -1.072 3.005 1.00 0.00 C ATOM 1117 C LYS A 444 4.160 -1.746 1.802 1.00 0.00 C ATOM 1118 O LYS A 444 4.059 -2.971 1.747 1.00 0.00 O ATOM 1119 CB LYS A 444 3.762 -0.284 3.794 1.00 0.00 C ATOM 1120 CG LYS A 444 3.225 -1.033 5.004 1.00 0.00 C ATOM 1121 CD LYS A 444 2.708 -0.075 6.066 1.00 0.00 C ATOM 1122 CE LYS A 444 3.087 -0.536 7.463 1.00 0.00 C ATOM 1123 NZ LYS A 444 2.339 0.206 8.516 1.00 0.00 N ATOM 0 H LYS A 444 5.711 0.801 2.742 1.00 0.00 H new ATOM 0 HA LYS A 444 5.231 -1.846 3.647 1.00 0.00 H new ATOM 0 HB2 LYS A 444 4.200 0.658 4.124 1.00 0.00 H new ATOM 0 HB3 LYS A 444 2.932 -0.035 3.133 1.00 0.00 H new ATOM 0 HG2 LYS A 444 2.422 -1.701 4.693 1.00 0.00 H new ATOM 0 HG3 LYS A 444 4.013 -1.656 5.427 1.00 0.00 H new ATOM 0 HD2 LYS A 444 3.114 0.921 5.888 1.00 0.00 H new ATOM 0 HD3 LYS A 444 1.624 0.004 5.989 1.00 0.00 H new ATOM 0 HE2 LYS A 444 2.887 -1.603 7.560 1.00 0.00 H new ATOM 0 HE3 LYS A 444 4.158 -0.398 7.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 2.627 -0.139 9.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 2.549 1.222 8.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 1.318 0.054 8.389 1.00 0.00 H new ATOM 1137 N ILE A 445 3.719 -0.944 0.834 1.00 0.00 N ATOM 1138 CA ILE A 445 3.085 -1.482 -0.364 1.00 0.00 C ATOM 1139 C ILE A 445 3.992 -2.503 -1.041 1.00 0.00 C ATOM 1140 O ILE A 445 3.575 -3.626 -1.326 1.00 0.00 O ATOM 1141 CB ILE A 445 2.714 -0.374 -1.373 1.00 0.00 C ATOM 1142 CG1 ILE A 445 3.902 0.557 -1.620 1.00 0.00 C ATOM 1143 CG2 ILE A 445 1.512 0.414 -0.876 1.00 0.00 C ATOM 1144 CD1 ILE A 445 4.655 0.250 -2.897 1.00 0.00 C ATOM 0 H ILE A 445 3.789 0.073 0.857 1.00 0.00 H new ATOM 0 HA ILE A 445 2.164 -1.968 -0.042 1.00 0.00 H new ATOM 0 HB ILE A 445 2.452 -0.847 -2.319 1.00 0.00 H new ATOM 0 HG12 ILE A 445 3.545 1.586 -1.657 1.00 0.00 H new ATOM 0 HG13 ILE A 445 4.589 0.488 -0.777 1.00 0.00 H new ATOM 0 HG21 ILE A 445 1.263 1.191 -1.598 1.00 0.00 H new ATOM 0 HG22 ILE A 445 0.661 -0.257 -0.757 1.00 0.00 H new ATOM 0 HG23 ILE A 445 1.749 0.873 0.084 1.00 0.00 H new ATOM 0 HD11 ILE A 445 5.484 0.949 -3.008 1.00 0.00 H new ATOM 0 HD12 ILE A 445 5.042 -0.768 -2.855 1.00 0.00 H new ATOM 0 HD13 ILE A 445 3.982 0.348 -3.749 1.00 0.00 H new ATOM 1156 N GLN A 446 5.244 -2.118 -1.279 1.00 0.00 N ATOM 1157 CA GLN A 446 6.204 -3.017 -1.900 1.00 0.00 C ATOM 1158 C GLN A 446 6.517 -4.178 -0.961 1.00 0.00 C ATOM 1159 O GLN A 446 6.846 -5.279 -1.403 1.00 0.00 O ATOM 1160 CB GLN A 446 7.489 -2.268 -2.267 1.00 0.00 C ATOM 1161 CG GLN A 446 8.306 -1.825 -1.063 1.00 0.00 C ATOM 1162 CD GLN A 446 9.234 -2.911 -0.557 1.00 0.00 C ATOM 1163 OE1 GLN A 446 9.622 -3.810 -1.304 1.00 0.00 O ATOM 1164 NE2 GLN A 446 9.595 -2.836 0.719 1.00 0.00 N ATOM 0 H GLN A 446 5.612 -1.194 -1.052 1.00 0.00 H new ATOM 0 HA GLN A 446 5.766 -3.412 -2.817 1.00 0.00 H new ATOM 0 HB2 GLN A 446 8.105 -2.910 -2.896 1.00 0.00 H new ATOM 0 HB3 GLN A 446 7.231 -1.392 -2.861 1.00 0.00 H new ATOM 0 HG2 GLN A 446 8.893 -0.946 -1.330 1.00 0.00 H new ATOM 0 HG3 GLN A 446 7.631 -1.526 -0.261 1.00 0.00 H new ATOM 0 HE21 GLN A 446 9.250 -2.074 1.303 1.00 0.00 H new ATOM 0 HE22 GLN A 446 10.217 -3.540 1.115 1.00 0.00 H new ATOM 1173 N ALA A 447 6.398 -3.922 0.341 1.00 0.00 N ATOM 1174 CA ALA A 447 6.655 -4.941 1.347 1.00 0.00 C ATOM 1175 C ALA A 447 5.668 -6.096 1.210 1.00 0.00 C ATOM 1176 O ALA A 447 6.061 -7.239 0.972 1.00 0.00 O ATOM 1177 CB ALA A 447 6.578 -4.338 2.744 1.00 0.00 C ATOM 0 H ALA A 447 6.125 -3.015 0.720 1.00 0.00 H new ATOM 0 HA ALA A 447 7.661 -5.331 1.191 1.00 0.00 H new ATOM 0 HB1 ALA A 447 6.772 -5.113 3.486 1.00 0.00 H new ATOM 0 HB2 ALA A 447 7.322 -3.548 2.841 1.00 0.00 H new ATOM 0 HB3 ALA A 447 5.584 -3.922 2.906 1.00 0.00 H new ATOM 1183 N ILE A 448 4.381 -5.790 1.355 1.00 0.00 N ATOM 1184 CA ILE A 448 3.343 -6.805 1.240 1.00 0.00 C ATOM 1185 C ILE A 448 3.280 -7.355 -0.182 1.00 0.00 C ATOM 1186 O ILE A 448 2.942 -8.521 -0.391 1.00 0.00 O ATOM 1187 CB ILE A 448 1.956 -6.258 1.646 1.00 0.00 C ATOM 1188 CG1 ILE A 448 1.520 -5.121 0.717 1.00 0.00 C ATOM 1189 CG2 ILE A 448 1.980 -5.787 3.092 1.00 0.00 C ATOM 1190 CD1 ILE A 448 0.187 -5.370 0.048 1.00 0.00 C ATOM 0 H ILE A 448 4.035 -4.851 1.552 1.00 0.00 H new ATOM 0 HA ILE A 448 3.606 -7.609 1.927 1.00 0.00 H new ATOM 0 HB ILE A 448 1.229 -7.065 1.552 1.00 0.00 H new ATOM 0 HG12 ILE A 448 1.463 -4.195 1.290 1.00 0.00 H new ATOM 0 HG13 ILE A 448 2.281 -4.976 -0.049 1.00 0.00 H new ATOM 0 HG21 ILE A 448 0.997 -5.404 3.366 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.238 -6.623 3.743 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.722 -4.997 3.205 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -0.061 -4.526 -0.595 1.00 0.00 H new ATOM 0 HD12 ILE A 448 0.245 -6.278 -0.552 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.586 -5.486 0.808 1.00 0.00 H new ATOM 1202 N LEU A 449 3.618 -6.513 -1.155 1.00 0.00 N ATOM 1203 CA LEU A 449 3.610 -6.929 -2.553 1.00 0.00 C ATOM 1204 C LEU A 449 4.655 -8.012 -2.787 1.00 0.00 C ATOM 1205 O LEU A 449 4.352 -9.083 -3.314 1.00 0.00 O ATOM 1206 CB LEU A 449 3.881 -5.733 -3.468 1.00 0.00 C ATOM 1207 CG LEU A 449 3.590 -5.974 -4.951 1.00 0.00 C ATOM 1208 CD1 LEU A 449 3.101 -4.696 -5.615 1.00 0.00 C ATOM 1209 CD2 LEU A 449 4.830 -6.502 -5.657 1.00 0.00 C ATOM 0 H LEU A 449 3.899 -5.545 -1.002 1.00 0.00 H new ATOM 0 HA LEU A 449 2.625 -7.332 -2.787 1.00 0.00 H new ATOM 0 HB2 LEU A 449 3.279 -4.890 -3.127 1.00 0.00 H new ATOM 0 HB3 LEU A 449 4.926 -5.442 -3.361 1.00 0.00 H new ATOM 0 HG LEU A 449 2.803 -6.724 -5.030 1.00 0.00 H new ATOM 0 HD11 LEU A 449 2.900 -4.888 -6.669 1.00 0.00 H new ATOM 0 HD12 LEU A 449 2.187 -4.359 -5.126 1.00 0.00 H new ATOM 0 HD13 LEU A 449 3.866 -3.924 -5.526 1.00 0.00 H new ATOM 0 HD21 LEU A 449 4.606 -6.668 -6.711 1.00 0.00 H new ATOM 0 HD22 LEU A 449 5.637 -5.775 -5.568 1.00 0.00 H new ATOM 0 HD23 LEU A 449 5.137 -7.442 -5.199 1.00 0.00 H new ATOM 1221 N GLU A 450 5.890 -7.729 -2.377 1.00 0.00 N ATOM 1222 CA GLU A 450 6.981 -8.683 -2.527 1.00 0.00 C ATOM 1223 C GLU A 450 6.676 -9.960 -1.757 1.00 0.00 C ATOM 1224 O GLU A 450 6.878 -11.066 -2.259 1.00 0.00 O ATOM 1225 CB GLU A 450 8.294 -8.072 -2.033 1.00 0.00 C ATOM 1226 CG GLU A 450 9.505 -8.490 -2.852 1.00 0.00 C ATOM 1227 CD GLU A 450 9.718 -9.990 -2.855 1.00 0.00 C ATOM 1228 OE1 GLU A 450 9.039 -10.684 -3.642 1.00 0.00 O ATOM 1229 OE2 GLU A 450 10.561 -10.473 -2.069 1.00 0.00 O ATOM 0 H GLU A 450 6.157 -6.847 -1.939 1.00 0.00 H new ATOM 0 HA GLU A 450 7.084 -8.927 -3.584 1.00 0.00 H new ATOM 0 HB2 GLU A 450 8.210 -6.985 -2.053 1.00 0.00 H new ATOM 0 HB3 GLU A 450 8.451 -8.361 -0.994 1.00 0.00 H new ATOM 0 HG2 GLU A 450 9.383 -8.142 -3.878 1.00 0.00 H new ATOM 0 HG3 GLU A 450 10.394 -8.001 -2.454 1.00 0.00 H new ATOM 1236 N LYS A 451 6.177 -9.800 -0.534 1.00 0.00 N ATOM 1237 CA LYS A 451 5.831 -10.940 0.305 1.00 0.00 C ATOM 1238 C LYS A 451 4.781 -11.805 -0.381 1.00 0.00 C ATOM 1239 O LYS A 451 4.821 -13.033 -0.305 1.00 0.00 O ATOM 1240 CB LYS A 451 5.313 -10.465 1.664 1.00 0.00 C ATOM 1241 CG LYS A 451 5.649 -11.408 2.808 1.00 0.00 C ATOM 1242 CD LYS A 451 6.829 -10.899 3.621 1.00 0.00 C ATOM 1243 CE LYS A 451 8.102 -10.861 2.793 1.00 0.00 C ATOM 1244 NZ LYS A 451 9.321 -10.926 3.646 1.00 0.00 N ATOM 0 H LYS A 451 6.004 -8.892 -0.104 1.00 0.00 H new ATOM 0 HA LYS A 451 6.729 -11.537 0.462 1.00 0.00 H new ATOM 0 HB2 LYS A 451 5.732 -9.482 1.880 1.00 0.00 H new ATOM 0 HB3 LYS A 451 4.231 -10.345 1.609 1.00 0.00 H new ATOM 0 HG2 LYS A 451 4.780 -11.519 3.456 1.00 0.00 H new ATOM 0 HG3 LYS A 451 5.879 -12.397 2.411 1.00 0.00 H new ATOM 0 HD2 LYS A 451 6.609 -9.900 3.997 1.00 0.00 H new ATOM 0 HD3 LYS A 451 6.978 -11.541 4.489 1.00 0.00 H new ATOM 0 HE2 LYS A 451 8.104 -11.696 2.092 1.00 0.00 H new ATOM 0 HE3 LYS A 451 8.122 -9.947 2.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 10.168 -10.898 3.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 9.332 -10.116 4.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 9.315 -11.810 4.193 1.00 0.00 H new ATOM 1258 N LEU A 452 3.842 -11.151 -1.062 1.00 0.00 N ATOM 1259 CA LEU A 452 2.784 -11.854 -1.773 1.00 0.00 C ATOM 1260 C LEU A 452 3.358 -12.671 -2.924 1.00 0.00 C ATOM 1261 O LEU A 452 3.044 -13.852 -3.078 1.00 0.00 O ATOM 1262 CB LEU A 452 1.753 -10.858 -2.310 1.00 0.00 C ATOM 1263 CG LEU A 452 0.651 -10.472 -1.325 1.00 0.00 C ATOM 1264 CD1 LEU A 452 0.080 -9.107 -1.675 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.446 -11.524 -1.311 1.00 0.00 C ATOM 0 H LEU A 452 3.795 -10.135 -1.135 1.00 0.00 H new ATOM 0 HA LEU A 452 2.296 -12.532 -1.072 1.00 0.00 H new ATOM 0 HB2 LEU A 452 2.274 -9.953 -2.622 1.00 0.00 H new ATOM 0 HB3 LEU A 452 1.290 -11.283 -3.201 1.00 0.00 H new ATOM 0 HG LEU A 452 1.085 -10.418 -0.326 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -0.704 -8.847 -0.964 1.00 0.00 H new ATOM 0 HD12 LEU A 452 0.872 -8.359 -1.632 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.338 -9.135 -2.681 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -1.222 -11.231 -0.603 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -0.878 -11.612 -2.308 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -0.026 -12.484 -1.012 1.00 0.00 H new ATOM 1277 N GLU A 453 4.202 -12.035 -3.728 1.00 0.00 N ATOM 1278 CA GLU A 453 4.824 -12.701 -4.866 1.00 0.00 C ATOM 1279 C GLU A 453 5.636 -13.910 -4.412 1.00 0.00 C ATOM 1280 O GLU A 453 5.631 -14.954 -5.065 1.00 0.00 O ATOM 1281 CB GLU A 453 5.724 -11.726 -5.626 1.00 0.00 C ATOM 1282 CG GLU A 453 5.803 -12.007 -7.119 1.00 0.00 C ATOM 1283 CD GLU A 453 6.111 -10.764 -7.930 1.00 0.00 C ATOM 1284 OE1 GLU A 453 5.718 -9.660 -7.497 1.00 0.00 O ATOM 1285 OE2 GLU A 453 6.747 -10.895 -8.997 1.00 0.00 O ATOM 0 H GLU A 453 4.471 -11.058 -3.613 1.00 0.00 H new ATOM 0 HA GLU A 453 4.031 -13.046 -5.530 1.00 0.00 H new ATOM 0 HB2 GLU A 453 5.356 -10.711 -5.475 1.00 0.00 H new ATOM 0 HB3 GLU A 453 6.728 -11.767 -5.204 1.00 0.00 H new ATOM 0 HG2 GLU A 453 6.572 -12.757 -7.304 1.00 0.00 H new ATOM 0 HG3 GLU A 453 4.857 -12.431 -7.456 1.00 0.00 H new ATOM 1292 N LYS A 454 6.331 -13.764 -3.289 1.00 0.00 N ATOM 1293 CA LYS A 454 7.149 -14.844 -2.748 1.00 0.00 C ATOM 1294 C LYS A 454 6.273 -15.960 -2.187 1.00 0.00 C ATOM 1295 O LYS A 454 6.601 -17.140 -2.304 1.00 0.00 O ATOM 1296 CB LYS A 454 8.079 -14.311 -1.656 1.00 0.00 C ATOM 1297 CG LYS A 454 9.484 -14.007 -2.152 1.00 0.00 C ATOM 1298 CD LYS A 454 10.536 -14.438 -1.142 1.00 0.00 C ATOM 1299 CE LYS A 454 10.673 -13.429 -0.014 1.00 0.00 C ATOM 1300 NZ LYS A 454 9.796 -13.763 1.142 1.00 0.00 N ATOM 0 H LYS A 454 6.344 -12.908 -2.735 1.00 0.00 H new ATOM 0 HA LYS A 454 7.751 -15.252 -3.560 1.00 0.00 H new ATOM 0 HB2 LYS A 454 7.647 -13.404 -1.233 1.00 0.00 H new ATOM 0 HB3 LYS A 454 8.137 -15.043 -0.850 1.00 0.00 H new ATOM 0 HG2 LYS A 454 9.656 -14.519 -3.099 1.00 0.00 H new ATOM 0 HG3 LYS A 454 9.580 -12.939 -2.345 1.00 0.00 H new ATOM 0 HD2 LYS A 454 10.269 -15.411 -0.730 1.00 0.00 H new ATOM 0 HD3 LYS A 454 11.496 -14.557 -1.644 1.00 0.00 H new ATOM 0 HE2 LYS A 454 11.711 -13.393 0.317 1.00 0.00 H new ATOM 0 HE3 LYS A 454 10.422 -12.435 -0.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 9.981 -13.100 1.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 8.799 -13.689 0.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 9.994 -14.734 1.459 1.00 0.00 H new ATOM 1314 N LYS A 455 5.154 -15.579 -1.578 1.00 0.00 N ATOM 1315 CA LYS A 455 4.232 -16.548 -0.998 1.00 0.00 C ATOM 1316 C LYS A 455 3.379 -17.205 -2.079 1.00 0.00 C ATOM 1317 O LYS A 455 3.036 -18.383 -1.981 1.00 0.00 O ATOM 1318 CB LYS A 455 3.330 -15.870 0.036 1.00 0.00 C ATOM 1319 CG LYS A 455 2.582 -16.849 0.926 1.00 0.00 C ATOM 1320 CD LYS A 455 1.790 -16.127 2.005 1.00 0.00 C ATOM 1321 CE LYS A 455 2.533 -16.121 3.331 1.00 0.00 C ATOM 1322 NZ LYS A 455 2.347 -14.840 4.066 1.00 0.00 N ATOM 0 H LYS A 455 4.865 -14.606 -1.474 1.00 0.00 H new ATOM 0 HA LYS A 455 4.822 -17.322 -0.506 1.00 0.00 H new ATOM 0 HB2 LYS A 455 3.937 -15.214 0.661 1.00 0.00 H new ATOM 0 HB3 LYS A 455 2.608 -15.238 -0.482 1.00 0.00 H new ATOM 0 HG2 LYS A 455 1.906 -17.452 0.319 1.00 0.00 H new ATOM 0 HG3 LYS A 455 3.291 -17.535 1.390 1.00 0.00 H new ATOM 0 HD2 LYS A 455 1.596 -15.101 1.691 1.00 0.00 H new ATOM 0 HD3 LYS A 455 0.821 -16.610 2.132 1.00 0.00 H new ATOM 0 HE2 LYS A 455 2.181 -16.948 3.948 1.00 0.00 H new ATOM 0 HE3 LYS A 455 3.596 -16.286 3.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 2.869 -14.876 4.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 2.706 -14.053 3.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 1.336 -14.694 4.259 1.00 0.00 H new ATOM 1336 N GLY A 456 3.041 -16.436 -3.108 1.00 0.00 N ATOM 1337 CA GLY A 456 2.232 -16.959 -4.192 1.00 0.00 C ATOM 1338 C GLY A 456 2.809 -16.633 -5.556 1.00 0.00 C ATOM 1339 O GLY A 456 3.238 -15.478 -5.758 1.00 0.00 O ATOM 1340 OXT GLY A 456 2.830 -17.533 -6.422 1.00 0.00 O ATOM 0 H GLY A 456 3.313 -15.458 -3.210 1.00 0.00 H new ATOM 0 HA2 GLY A 456 2.145 -18.040 -4.087 1.00 0.00 H new ATOM 0 HA3 GLY A 456 1.225 -16.549 -4.120 1.00 0.00 H new TER 1344 GLY A 456