USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 667 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 379 SER OG : rot 35:sc= 0 USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ -108:sc= 0 (180deg=-0.636) USER MOD Single : A 385 HIS : no HD1:sc= -0.103 X(o=-0.1,f=-0.02) USER MOD Single : A 389 LYS NZ :NH3+ -153:sc= -0.149 (180deg=-0.444) USER MOD Single : A 391 GLN : amide:sc= -0.167 X(o=-0.17,f=0) USER MOD Single : A 392 TYR OH : rot 180:sc= -0.316 USER MOD Single : A 395 GLN : amide:sc= -0.0596 X(o=-0.06,f=0) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0384) USER MOD Single : A 405 THR OG1 : rot 180:sc= -0.265 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 180:sc= 0 USER MOD Single : A 415 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 417 THR OG1 : rot -100:sc= 0.113 USER MOD Single : A 418 LYS NZ :NH3+ 165:sc=-0.00776 (180deg=-0.129) 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 431 GLN : amide:sc= 0.0207 K(o=0.021,f=-0.69) USER MOD Single : A 433 SER OG : rot 180:sc= -3.21! USER MOD Single : A 436 GLN : amide:sc= -0.0142 X(o=-0.014,f=-0.014) USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 444 LYS NZ :NH3+ -158:sc= 0.00499 (180deg=-0.102) USER MOD Single : A 446 GLN : amide:sc=0.000134 X(o=0.00013,f=0) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ 159:sc= -0.0179 (180deg=-0.189) USER MOD Single : A 455 LYS NZ :NH3+ 143:sc= 0.0235 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 43 N SER A 379 0.923 17.246 1.854 1.00 0.00 N ATOM 44 CA SER A 379 -0.032 16.356 1.200 1.00 0.00 C ATOM 45 C SER A 379 -0.171 15.040 1.966 1.00 0.00 C ATOM 46 O SER A 379 -0.820 14.107 1.495 1.00 0.00 O ATOM 47 CB SER A 379 0.402 16.078 -0.240 1.00 0.00 C ATOM 48 OG SER A 379 -0.093 17.069 -1.123 1.00 0.00 O ATOM 0 HA SER A 379 -1.003 16.852 1.192 1.00 0.00 H new ATOM 0 HB2 SER A 379 1.490 16.048 -0.296 1.00 0.00 H new ATOM 0 HB3 SER A 379 0.040 15.098 -0.549 1.00 0.00 H new ATOM 0 HG SER A 379 -0.097 17.938 -0.670 1.00 0.00 H new ATOM 54 N ILE A 380 0.449 14.970 3.145 1.00 0.00 N ATOM 55 CA ILE A 380 0.404 13.769 3.977 1.00 0.00 C ATOM 56 C ILE A 380 -0.999 13.167 4.032 1.00 0.00 C ATOM 57 O ILE A 380 -1.154 11.953 4.175 1.00 0.00 O ATOM 58 CB ILE A 380 0.881 14.068 5.412 1.00 0.00 C ATOM 59 CG1 ILE A 380 0.935 12.782 6.239 1.00 0.00 C ATOM 60 CG2 ILE A 380 -0.030 15.092 6.074 1.00 0.00 C ATOM 61 CD1 ILE A 380 2.093 12.735 7.211 1.00 0.00 C ATOM 0 H ILE A 380 0.991 15.736 3.546 1.00 0.00 H new ATOM 0 HA ILE A 380 1.076 13.046 3.515 1.00 0.00 H new ATOM 0 HB ILE A 380 1.887 14.485 5.361 1.00 0.00 H new ATOM 0 HG12 ILE A 380 0.002 12.677 6.793 1.00 0.00 H new ATOM 0 HG13 ILE A 380 1.003 11.929 5.564 1.00 0.00 H new ATOM 0 HG21 ILE A 380 0.322 15.291 7.086 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -0.018 16.017 5.497 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.047 14.702 6.113 1.00 0.00 H new ATOM 0 HD11 ILE A 380 2.067 11.795 7.762 1.00 0.00 H new ATOM 0 HD12 ILE A 380 3.032 12.808 6.662 1.00 0.00 H new ATOM 0 HD13 ILE A 380 2.015 13.568 7.910 1.00 0.00 H new ATOM 73 N LYS A 381 -2.018 14.017 3.914 1.00 0.00 N ATOM 74 CA LYS A 381 -3.407 13.561 3.950 1.00 0.00 C ATOM 75 C LYS A 381 -3.600 12.330 3.067 1.00 0.00 C ATOM 76 O LYS A 381 -4.013 11.270 3.539 1.00 0.00 O ATOM 77 CB LYS A 381 -4.344 14.682 3.497 1.00 0.00 C ATOM 78 CG LYS A 381 -4.908 15.502 4.645 1.00 0.00 C ATOM 79 CD LYS A 381 -6.036 14.769 5.352 1.00 0.00 C ATOM 80 CE LYS A 381 -7.016 15.739 5.994 1.00 0.00 C ATOM 81 NZ LYS A 381 -8.418 15.246 5.914 1.00 0.00 N ATOM 0 H LYS A 381 -1.908 15.024 3.793 1.00 0.00 H new ATOM 0 HA LYS A 381 -3.648 13.288 4.977 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -3.805 15.344 2.819 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -5.169 14.249 2.931 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -4.115 15.725 5.358 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -5.274 16.456 4.266 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -6.564 14.136 4.638 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -5.621 14.111 6.115 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -6.744 15.892 7.038 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -6.943 16.708 5.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -9.055 15.935 6.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -8.687 15.124 4.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -8.494 14.333 6.407 1.00 0.00 H new ATOM 95 N LYS A 382 -3.289 12.477 1.784 1.00 0.00 N ATOM 96 CA LYS A 382 -3.419 11.377 0.837 1.00 0.00 C ATOM 97 C LYS A 382 -2.526 10.212 1.253 1.00 0.00 C ATOM 98 O LYS A 382 -2.861 9.049 1.032 1.00 0.00 O ATOM 99 CB LYS A 382 -3.053 11.842 -0.574 1.00 0.00 C ATOM 100 CG LYS A 382 -3.962 11.278 -1.653 1.00 0.00 C ATOM 101 CD LYS A 382 -3.990 12.174 -2.881 1.00 0.00 C ATOM 102 CE LYS A 382 -5.384 12.254 -3.482 1.00 0.00 C ATOM 103 NZ LYS A 382 -5.535 11.357 -4.661 1.00 0.00 N ATOM 0 H LYS A 382 -2.945 13.347 1.376 1.00 0.00 H new ATOM 0 HA LYS A 382 -4.456 11.042 0.837 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -3.091 12.931 -0.610 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -2.024 11.552 -0.788 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -3.619 10.282 -1.935 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -4.972 11.168 -1.258 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -3.652 13.174 -2.610 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -3.293 11.792 -3.627 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -6.121 11.985 -2.725 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -5.592 13.282 -3.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -5.576 11.928 -5.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -4.723 10.709 -4.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -6.412 10.806 -4.568 1.00 0.00 H new ATOM 117 N ILE A 383 -1.390 10.536 1.866 1.00 0.00 N ATOM 118 CA ILE A 383 -0.451 9.521 2.323 1.00 0.00 C ATOM 119 C ILE A 383 -1.034 8.744 3.497 1.00 0.00 C ATOM 120 O ILE A 383 -0.827 7.537 3.620 1.00 0.00 O ATOM 121 CB ILE A 383 0.897 10.142 2.743 1.00 0.00 C ATOM 122 CG1 ILE A 383 1.353 11.183 1.719 1.00 0.00 C ATOM 123 CG2 ILE A 383 1.950 9.058 2.902 1.00 0.00 C ATOM 124 CD1 ILE A 383 1.451 10.641 0.310 1.00 0.00 C ATOM 0 H ILE A 383 -1.099 11.495 2.057 1.00 0.00 H new ATOM 0 HA ILE A 383 -0.275 8.844 1.487 1.00 0.00 H new ATOM 0 HB ILE A 383 0.763 10.641 3.703 1.00 0.00 H new ATOM 0 HG12 ILE A 383 0.656 12.021 1.730 1.00 0.00 H new ATOM 0 HG13 ILE A 383 2.326 11.573 2.018 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.896 9.511 3.199 1.00 0.00 H new ATOM 0 HG22 ILE A 383 1.631 8.350 3.667 1.00 0.00 H new ATOM 0 HG23 ILE A 383 2.079 8.535 1.955 1.00 0.00 H new ATOM 0 HD11 ILE A 383 1.780 11.433 -0.363 1.00 0.00 H new ATOM 0 HD12 ILE A 383 2.170 9.822 0.284 1.00 0.00 H new ATOM 0 HD13 ILE A 383 0.474 10.277 -0.008 1.00 0.00 H new ATOM 136 N ILE A 384 -1.773 9.443 4.354 1.00 0.00 N ATOM 137 CA ILE A 384 -2.397 8.816 5.510 1.00 0.00 C ATOM 138 C ILE A 384 -3.505 7.870 5.065 1.00 0.00 C ATOM 139 O ILE A 384 -3.591 6.735 5.531 1.00 0.00 O ATOM 140 CB ILE A 384 -2.981 9.864 6.478 1.00 0.00 C ATOM 141 CG1 ILE A 384 -1.908 10.876 6.880 1.00 0.00 C ATOM 142 CG2 ILE A 384 -3.562 9.185 7.712 1.00 0.00 C ATOM 143 CD1 ILE A 384 -2.434 12.287 7.035 1.00 0.00 C ATOM 0 H ILE A 384 -1.953 10.443 4.268 1.00 0.00 H new ATOM 0 HA ILE A 384 -1.622 8.256 6.034 1.00 0.00 H new ATOM 0 HB ILE A 384 -3.784 10.396 5.967 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -1.456 10.560 7.820 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -1.117 10.872 6.130 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -3.970 9.940 8.384 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -4.355 8.500 7.411 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -2.777 8.628 8.224 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -1.618 12.950 7.321 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -2.860 12.623 6.089 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -3.204 12.306 7.806 1.00 0.00 H new ATOM 155 N HIS A 385 -4.344 8.345 4.149 1.00 0.00 N ATOM 156 CA HIS A 385 -5.440 7.537 3.629 1.00 0.00 C ATOM 157 C HIS A 385 -4.898 6.281 2.951 1.00 0.00 C ATOM 158 O HIS A 385 -5.247 5.159 3.325 1.00 0.00 O ATOM 159 CB HIS A 385 -6.276 8.348 2.637 1.00 0.00 C ATOM 160 CG HIS A 385 -7.737 8.022 2.677 1.00 0.00 C ATOM 161 ND1 HIS A 385 -8.706 8.845 2.145 1.00 0.00 N ATOM 162 CD2 HIS A 385 -8.392 6.954 3.189 1.00 0.00 C ATOM 163 CE1 HIS A 385 -9.896 8.300 2.328 1.00 0.00 C ATOM 164 NE2 HIS A 385 -9.733 7.152 2.959 1.00 0.00 N ATOM 0 H HIS A 385 -4.285 9.283 3.753 1.00 0.00 H new ATOM 0 HA HIS A 385 -6.076 7.240 4.463 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -6.143 9.410 2.846 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -5.900 8.172 1.629 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -7.945 6.105 3.685 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -10.840 8.721 2.015 1.00 0.00 H new ATOM 0 HE2 HIS A 385 -10.481 6.515 3.232 1.00 0.00 H new ATOM 173 N VAL A 386 -4.032 6.480 1.961 1.00 0.00 N ATOM 174 CA VAL A 386 -3.432 5.365 1.240 1.00 0.00 C ATOM 175 C VAL A 386 -2.682 4.450 2.200 1.00 0.00 C ATOM 176 O VAL A 386 -2.672 3.230 2.033 1.00 0.00 O ATOM 177 CB VAL A 386 -2.465 5.853 0.147 1.00 0.00 C ATOM 178 CG1 VAL A 386 -3.223 6.572 -0.957 1.00 0.00 C ATOM 179 CG2 VAL A 386 -1.397 6.754 0.746 1.00 0.00 C ATOM 0 H VAL A 386 -3.732 7.401 1.642 1.00 0.00 H new ATOM 0 HA VAL A 386 -4.244 4.813 0.765 1.00 0.00 H new ATOM 0 HB VAL A 386 -1.973 4.985 -0.291 1.00 0.00 H new ATOM 0 HG11 VAL A 386 -2.521 6.909 -1.720 1.00 0.00 H new ATOM 0 HG12 VAL A 386 -3.946 5.891 -1.405 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -3.745 7.432 -0.539 1.00 0.00 H new ATOM 0 HG21 VAL A 386 -0.722 7.090 -0.041 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -1.870 7.618 1.212 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -0.833 6.200 1.496 1.00 0.00 H new ATOM 189 N LEU A 387 -2.064 5.049 3.216 1.00 0.00 N ATOM 190 CA LEU A 387 -1.323 4.287 4.212 1.00 0.00 C ATOM 191 C LEU A 387 -2.248 3.305 4.920 1.00 0.00 C ATOM 192 O LEU A 387 -1.950 2.115 5.023 1.00 0.00 O ATOM 193 CB LEU A 387 -0.674 5.226 5.231 1.00 0.00 C ATOM 194 CG LEU A 387 0.747 5.674 4.884 1.00 0.00 C ATOM 195 CD1 LEU A 387 1.148 6.874 5.728 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.728 4.530 5.081 1.00 0.00 C ATOM 0 H LEU A 387 -2.063 6.057 3.369 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.537 3.728 3.704 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.302 6.111 5.339 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -0.655 4.729 6.201 1.00 0.00 H new ATOM 0 HG LEU A 387 0.770 5.969 3.835 1.00 0.00 H new ATOM 0 HD11 LEU A 387 2.162 7.179 5.468 1.00 0.00 H new ATOM 0 HD12 LEU A 387 0.461 7.698 5.538 1.00 0.00 H new ATOM 0 HD13 LEU A 387 1.110 6.605 6.784 1.00 0.00 H new ATOM 0 HD21 LEU A 387 2.734 4.866 4.830 1.00 0.00 H new ATOM 0 HD22 LEU A 387 1.703 4.205 6.121 1.00 0.00 H new ATOM 0 HD23 LEU A 387 1.451 3.698 4.434 1.00 0.00 H new ATOM 208 N GLU A 388 -3.385 3.810 5.393 1.00 0.00 N ATOM 209 CA GLU A 388 -4.365 2.976 6.074 1.00 0.00 C ATOM 210 C GLU A 388 -4.825 1.854 5.152 1.00 0.00 C ATOM 211 O GLU A 388 -4.914 0.694 5.561 1.00 0.00 O ATOM 212 CB GLU A 388 -5.564 3.815 6.521 1.00 0.00 C ATOM 213 CG GLU A 388 -5.226 4.837 7.594 1.00 0.00 C ATOM 214 CD GLU A 388 -6.223 5.978 7.648 1.00 0.00 C ATOM 215 OE1 GLU A 388 -7.269 5.822 8.313 1.00 0.00 O ATOM 216 OE2 GLU A 388 -5.958 7.027 7.025 1.00 0.00 O ATOM 0 H GLU A 388 -3.648 4.793 5.316 1.00 0.00 H new ATOM 0 HA GLU A 388 -3.898 2.541 6.958 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.977 4.333 5.655 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.342 3.150 6.896 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.193 4.342 8.565 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -4.230 5.238 7.407 1.00 0.00 H new ATOM 223 N LYS A 389 -5.098 2.208 3.899 1.00 0.00 N ATOM 224 CA LYS A 389 -5.530 1.231 2.908 1.00 0.00 C ATOM 225 C LYS A 389 -4.522 0.090 2.821 1.00 0.00 C ATOM 226 O LYS A 389 -4.891 -1.085 2.840 1.00 0.00 O ATOM 227 CB LYS A 389 -5.689 1.896 1.540 1.00 0.00 C ATOM 228 CG LYS A 389 -6.751 1.246 0.666 1.00 0.00 C ATOM 229 CD LYS A 389 -6.215 0.932 -0.722 1.00 0.00 C ATOM 230 CE LYS A 389 -7.219 0.133 -1.537 1.00 0.00 C ATOM 231 NZ LYS A 389 -8.315 0.991 -2.067 1.00 0.00 N ATOM 0 H LYS A 389 -5.027 3.163 3.548 1.00 0.00 H new ATOM 0 HA LYS A 389 -6.495 0.827 3.215 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -5.942 2.947 1.683 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -4.733 1.866 1.018 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -7.101 0.328 1.138 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -7.612 1.910 0.583 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -5.980 1.861 -1.241 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -5.285 0.370 -0.636 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -6.707 -0.355 -2.366 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -7.644 -0.656 -0.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -9.171 0.416 -2.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -8.514 1.756 -1.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -8.026 1.400 -2.978 1.00 0.00 H new ATOM 245 N VAL A 390 -3.244 0.448 2.743 1.00 0.00 N ATOM 246 CA VAL A 390 -2.178 -0.542 2.674 1.00 0.00 C ATOM 247 C VAL A 390 -2.165 -1.393 3.936 1.00 0.00 C ATOM 248 O VAL A 390 -1.942 -2.602 3.881 1.00 0.00 O ATOM 249 CB VAL A 390 -0.799 0.123 2.494 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.295 -0.928 2.376 1.00 0.00 C ATOM 251 CG2 VAL A 390 -0.801 1.035 1.278 1.00 0.00 C ATOM 0 H VAL A 390 -2.923 1.416 2.726 1.00 0.00 H new ATOM 0 HA VAL A 390 -2.373 -1.172 1.807 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.594 0.729 3.377 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.260 -0.436 2.250 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.314 -1.537 3.280 1.00 0.00 H new ATOM 0 HG13 VAL A 390 0.096 -1.565 1.514 1.00 0.00 H new ATOM 0 HG21 VAL A 390 0.181 1.496 1.167 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -1.031 0.452 0.386 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -1.554 1.812 1.408 1.00 0.00 H new ATOM 261 N GLN A 391 -2.422 -0.754 5.076 1.00 0.00 N ATOM 262 CA GLN A 391 -2.457 -1.456 6.353 1.00 0.00 C ATOM 263 C GLN A 391 -3.458 -2.602 6.292 1.00 0.00 C ATOM 264 O GLN A 391 -3.121 -3.755 6.570 1.00 0.00 O ATOM 265 CB GLN A 391 -2.829 -0.493 7.482 1.00 0.00 C ATOM 266 CG GLN A 391 -2.655 -1.087 8.871 1.00 0.00 C ATOM 267 CD GLN A 391 -2.075 -0.097 9.860 1.00 0.00 C ATOM 268 OE1 GLN A 391 -1.214 -0.441 10.670 1.00 0.00 O ATOM 269 NE2 GLN A 391 -2.545 1.144 9.800 1.00 0.00 N ATOM 0 H GLN A 391 -2.608 0.247 5.139 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.466 -1.862 6.555 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -2.215 0.404 7.400 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -3.866 -0.182 7.356 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -3.621 -1.436 9.236 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -2.003 -1.958 8.810 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -3.259 1.386 9.113 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -2.192 1.855 10.441 1.00 0.00 H new ATOM 278 N TYR A 392 -4.690 -2.279 5.905 1.00 0.00 N ATOM 279 CA TYR A 392 -5.736 -3.288 5.784 1.00 0.00 C ATOM 280 C TYR A 392 -5.302 -4.365 4.796 1.00 0.00 C ATOM 281 O TYR A 392 -5.457 -5.561 5.051 1.00 0.00 O ATOM 282 CB TYR A 392 -7.046 -2.650 5.322 1.00 0.00 C ATOM 283 CG TYR A 392 -7.368 -1.346 6.020 1.00 0.00 C ATOM 284 CD1 TYR A 392 -7.298 -1.241 7.403 1.00 0.00 C ATOM 285 CD2 TYR A 392 -7.739 -0.221 5.294 1.00 0.00 C ATOM 286 CE1 TYR A 392 -7.590 -0.051 8.044 1.00 0.00 C ATOM 287 CE2 TYR A 392 -8.032 0.971 5.927 1.00 0.00 C ATOM 288 CZ TYR A 392 -7.956 1.051 7.302 1.00 0.00 C ATOM 289 OH TYR A 392 -8.248 2.236 7.935 1.00 0.00 O ATOM 0 H TYR A 392 -4.986 -1.331 5.671 1.00 0.00 H new ATOM 0 HA TYR A 392 -5.899 -3.742 6.761 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -6.995 -2.474 4.248 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -7.862 -3.353 5.491 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -7.011 -2.103 7.987 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.799 -0.280 4.217 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -7.532 0.014 9.120 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.319 1.836 5.348 1.00 0.00 H new ATOM 0 HH TYR A 392 -8.487 2.913 7.268 1.00 0.00 H new ATOM 299 N LEU A 393 -4.740 -3.926 3.673 1.00 0.00 N ATOM 300 CA LEU A 393 -4.263 -4.845 2.650 1.00 0.00 C ATOM 301 C LEU A 393 -3.182 -5.752 3.228 1.00 0.00 C ATOM 302 O LEU A 393 -3.150 -6.951 2.954 1.00 0.00 O ATOM 303 CB LEU A 393 -3.719 -4.069 1.448 1.00 0.00 C ATOM 304 CG LEU A 393 -4.624 -4.071 0.215 1.00 0.00 C ATOM 305 CD1 LEU A 393 -4.596 -2.714 -0.473 1.00 0.00 C ATOM 306 CD2 LEU A 393 -4.204 -5.171 -0.748 1.00 0.00 C ATOM 0 H LEU A 393 -4.605 -2.940 3.451 1.00 0.00 H new ATOM 0 HA LEU A 393 -5.097 -5.461 2.314 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -3.544 -3.036 1.750 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.752 -4.488 1.171 1.00 0.00 H new ATOM 0 HG LEU A 393 -5.647 -4.267 0.537 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -5.246 -2.736 -1.348 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -4.945 -1.948 0.219 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -3.577 -2.485 -0.784 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -4.857 -5.160 -1.620 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -3.174 -5.004 -1.064 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -4.279 -6.138 -0.251 1.00 0.00 H new ATOM 318 N GLU A 394 -2.308 -5.170 4.046 1.00 0.00 N ATOM 319 CA GLU A 394 -1.236 -5.925 4.681 1.00 0.00 C ATOM 320 C GLU A 394 -1.821 -7.057 5.515 1.00 0.00 C ATOM 321 O GLU A 394 -1.410 -8.212 5.394 1.00 0.00 O ATOM 322 CB GLU A 394 -0.385 -5.009 5.564 1.00 0.00 C ATOM 323 CG GLU A 394 1.093 -5.365 5.560 1.00 0.00 C ATOM 324 CD GLU A 394 1.985 -4.150 5.725 1.00 0.00 C ATOM 325 OE1 GLU A 394 1.530 -3.032 5.406 1.00 0.00 O ATOM 326 OE2 GLU A 394 3.139 -4.318 6.172 1.00 0.00 O ATOM 0 H GLU A 394 -2.323 -4.178 4.283 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.599 -6.347 3.903 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -0.504 -3.979 5.226 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -0.759 -5.054 6.587 1.00 0.00 H new ATOM 0 HG2 GLU A 394 1.295 -6.072 6.365 1.00 0.00 H new ATOM 0 HG3 GLU A 394 1.339 -5.868 4.625 1.00 0.00 H new ATOM 333 N GLN A 395 -2.801 -6.719 6.350 1.00 0.00 N ATOM 334 CA GLN A 395 -3.460 -7.712 7.188 1.00 0.00 C ATOM 335 C GLN A 395 -4.037 -8.821 6.316 1.00 0.00 C ATOM 336 O GLN A 395 -3.895 -10.007 6.620 1.00 0.00 O ATOM 337 CB GLN A 395 -4.572 -7.063 8.017 1.00 0.00 C ATOM 338 CG GLN A 395 -4.057 -6.261 9.199 1.00 0.00 C ATOM 339 CD GLN A 395 -4.168 -7.018 10.509 1.00 0.00 C ATOM 340 OE1 GLN A 395 -5.001 -6.695 11.357 1.00 0.00 O ATOM 341 NE2 GLN A 395 -3.326 -8.030 10.682 1.00 0.00 N ATOM 0 H GLN A 395 -3.154 -5.769 6.463 1.00 0.00 H new ATOM 0 HA GLN A 395 -2.725 -8.138 7.871 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -5.160 -6.409 7.373 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.244 -7.840 8.381 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -3.015 -5.993 9.025 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -4.618 -5.329 9.273 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -2.652 -8.263 9.953 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -3.353 -8.575 11.544 1.00 0.00 H new ATOM 350 N GLU A 396 -4.671 -8.425 5.215 1.00 0.00 N ATOM 351 CA GLU A 396 -5.250 -9.381 4.283 1.00 0.00 C ATOM 352 C GLU A 396 -4.165 -10.305 3.743 1.00 0.00 C ATOM 353 O GLU A 396 -4.384 -11.503 3.566 1.00 0.00 O ATOM 354 CB GLU A 396 -5.942 -8.652 3.131 1.00 0.00 C ATOM 355 CG GLU A 396 -6.599 -9.587 2.127 1.00 0.00 C ATOM 356 CD GLU A 396 -7.587 -10.536 2.775 1.00 0.00 C ATOM 357 OE1 GLU A 396 -7.141 -11.479 3.462 1.00 0.00 O ATOM 358 OE2 GLU A 396 -8.807 -10.337 2.594 1.00 0.00 O ATOM 0 H GLU A 396 -4.795 -7.448 4.949 1.00 0.00 H new ATOM 0 HA GLU A 396 -5.993 -9.978 4.812 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -6.698 -7.981 3.539 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -5.211 -8.032 2.613 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -7.112 -8.997 1.368 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -5.829 -10.164 1.615 1.00 0.00 H new ATOM 365 N VAL A 397 -2.988 -9.738 3.495 1.00 0.00 N ATOM 366 CA VAL A 397 -1.859 -10.509 2.992 1.00 0.00 C ATOM 367 C VAL A 397 -1.478 -11.592 3.990 1.00 0.00 C ATOM 368 O VAL A 397 -1.338 -12.761 3.634 1.00 0.00 O ATOM 369 CB VAL A 397 -0.634 -9.612 2.724 1.00 0.00 C ATOM 370 CG1 VAL A 397 0.508 -10.426 2.133 1.00 0.00 C ATOM 371 CG2 VAL A 397 -1.007 -8.456 1.807 1.00 0.00 C ATOM 0 H VAL A 397 -2.793 -8.747 3.635 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.166 -10.963 2.050 1.00 0.00 H new ATOM 0 HB VAL A 397 -0.298 -9.197 3.674 1.00 0.00 H new ATOM 0 HG11 VAL A 397 1.363 -9.775 1.951 1.00 0.00 H new ATOM 0 HG12 VAL A 397 0.793 -11.213 2.831 1.00 0.00 H new ATOM 0 HG13 VAL A 397 0.187 -10.874 1.193 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -0.129 -7.834 1.630 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -1.372 -8.848 0.858 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -1.787 -7.857 2.276 1.00 0.00 H new ATOM 381 N GLU A 398 -1.323 -11.194 5.250 1.00 0.00 N ATOM 382 CA GLU A 398 -0.973 -12.132 6.309 1.00 0.00 C ATOM 383 C GLU A 398 -2.035 -13.219 6.421 1.00 0.00 C ATOM 384 O GLU A 398 -1.728 -14.381 6.689 1.00 0.00 O ATOM 385 CB GLU A 398 -0.826 -11.400 7.643 1.00 0.00 C ATOM 386 CG GLU A 398 0.577 -10.875 7.899 1.00 0.00 C ATOM 387 CD GLU A 398 0.955 -10.911 9.368 1.00 0.00 C ATOM 388 OE1 GLU A 398 0.119 -10.514 10.205 1.00 0.00 O ATOM 389 OE2 GLU A 398 2.088 -11.336 9.677 1.00 0.00 O ATOM 0 H GLU A 398 -1.434 -10.229 5.561 1.00 0.00 H new ATOM 0 HA GLU A 398 -0.019 -12.596 6.060 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -1.527 -10.566 7.669 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -1.105 -12.076 8.451 1.00 0.00 H new ATOM 0 HG2 GLU A 398 1.292 -11.468 7.329 1.00 0.00 H new ATOM 0 HG3 GLU A 398 0.650 -9.850 7.534 1.00 0.00 H new ATOM 396 N GLU A 399 -3.290 -12.830 6.205 1.00 0.00 N ATOM 397 CA GLU A 399 -4.406 -13.767 6.271 1.00 0.00 C ATOM 398 C GLU A 399 -4.567 -14.521 4.951 1.00 0.00 C ATOM 399 O GLU A 399 -5.264 -15.535 4.889 1.00 0.00 O ATOM 400 CB GLU A 399 -5.701 -13.025 6.610 1.00 0.00 C ATOM 401 CG GLU A 399 -5.956 -12.899 8.103 1.00 0.00 C ATOM 402 CD GLU A 399 -6.524 -14.169 8.707 1.00 0.00 C ATOM 403 OE1 GLU A 399 -6.255 -15.259 8.159 1.00 0.00 O ATOM 404 OE2 GLU A 399 -7.238 -14.073 9.726 1.00 0.00 O ATOM 0 H GLU A 399 -3.558 -11.871 5.983 1.00 0.00 H new ATOM 0 HA GLU A 399 -4.193 -14.492 7.057 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -5.665 -12.028 6.171 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -6.540 -13.546 6.149 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -5.023 -12.647 8.607 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -6.647 -12.075 8.282 1.00 0.00 H new ATOM 411 N PHE A 400 -3.919 -14.019 3.896 1.00 0.00 N ATOM 412 CA PHE A 400 -3.986 -14.641 2.574 1.00 0.00 C ATOM 413 C PHE A 400 -3.862 -16.159 2.669 1.00 0.00 C ATOM 414 O PHE A 400 -2.871 -16.681 3.180 1.00 0.00 O ATOM 415 CB PHE A 400 -2.879 -14.080 1.675 1.00 0.00 C ATOM 416 CG PHE A 400 -2.894 -14.627 0.275 1.00 0.00 C ATOM 417 CD1 PHE A 400 -3.777 -14.128 -0.671 1.00 0.00 C ATOM 418 CD2 PHE A 400 -2.022 -15.638 -0.099 1.00 0.00 C ATOM 419 CE1 PHE A 400 -3.789 -14.626 -1.955 1.00 0.00 C ATOM 420 CE2 PHE A 400 -2.032 -16.140 -1.386 1.00 0.00 C ATOM 421 CZ PHE A 400 -2.917 -15.634 -2.315 1.00 0.00 C ATOM 0 H PHE A 400 -3.340 -13.180 3.934 1.00 0.00 H new ATOM 0 HA PHE A 400 -4.958 -14.408 2.140 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -2.975 -12.995 1.631 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -1.912 -14.296 2.129 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -4.463 -13.340 -0.398 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.327 -16.038 0.624 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -4.482 -14.227 -2.681 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -1.348 -16.928 -1.664 1.00 0.00 H new ATOM 0 HZ PHE A 400 -2.928 -16.025 -3.322 1.00 0.00 H new ATOM 431 N VAL A 401 -4.882 -16.862 2.179 1.00 0.00 N ATOM 432 CA VAL A 401 -4.900 -18.322 2.209 1.00 0.00 C ATOM 433 C VAL A 401 -3.557 -18.908 1.777 1.00 0.00 C ATOM 434 O VAL A 401 -3.046 -19.841 2.398 1.00 0.00 O ATOM 435 CB VAL A 401 -6.010 -18.884 1.298 1.00 0.00 C ATOM 436 CG1 VAL A 401 -5.783 -18.463 -0.146 1.00 0.00 C ATOM 437 CG2 VAL A 401 -6.089 -20.400 1.415 1.00 0.00 C ATOM 0 H VAL A 401 -5.709 -16.441 1.755 1.00 0.00 H new ATOM 0 HA VAL A 401 -5.098 -18.612 3.241 1.00 0.00 H new ATOM 0 HB VAL A 401 -6.963 -18.470 1.627 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -6.577 -18.870 -0.773 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -5.789 -17.375 -0.213 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -4.820 -18.842 -0.488 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -6.879 -20.775 0.764 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -5.136 -20.838 1.118 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -6.309 -20.674 2.447 1.00 0.00 H new ATOM 447 N GLY A 402 -2.991 -18.349 0.714 1.00 0.00 N ATOM 448 CA GLY A 402 -1.712 -18.825 0.218 1.00 0.00 C ATOM 449 C GLY A 402 -1.804 -19.386 -1.186 1.00 0.00 C ATOM 450 O GLY A 402 -1.005 -20.240 -1.572 1.00 0.00 O ATOM 0 H GLY A 402 -3.394 -17.575 0.186 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -0.993 -18.005 0.231 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -1.330 -19.595 0.889 1.00 0.00 H new ATOM 454 N LYS A 403 -2.777 -18.909 -1.954 1.00 0.00 N ATOM 455 CA LYS A 403 -2.963 -19.372 -3.322 1.00 0.00 C ATOM 456 C LYS A 403 -3.473 -18.246 -4.217 1.00 0.00 C ATOM 457 O LYS A 403 -4.424 -17.545 -3.870 1.00 0.00 O ATOM 458 CB LYS A 403 -3.938 -20.551 -3.358 1.00 0.00 C ATOM 459 CG LYS A 403 -3.597 -21.590 -4.413 1.00 0.00 C ATOM 460 CD LYS A 403 -4.033 -22.981 -3.985 1.00 0.00 C ATOM 461 CE LYS A 403 -3.017 -24.034 -4.395 1.00 0.00 C ATOM 462 NZ LYS A 403 -3.672 -25.296 -4.840 1.00 0.00 N ATOM 0 H LYS A 403 -3.448 -18.203 -1.652 1.00 0.00 H new ATOM 0 HA LYS A 403 -1.995 -19.700 -3.700 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -3.952 -21.030 -2.379 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -4.944 -20.174 -3.543 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -4.083 -21.328 -5.353 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -2.523 -21.585 -4.597 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -4.167 -23.005 -2.904 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -5.000 -23.214 -4.431 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -2.395 -23.644 -5.201 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -2.355 -24.245 -3.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -2.944 -25.988 -5.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -4.245 -25.682 -4.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -4.284 -25.100 -5.657 1.00 0.00 H new ATOM 476 N LYS A 404 -2.832 -18.079 -5.370 1.00 0.00 N ATOM 477 CA LYS A 404 -3.211 -17.038 -6.318 1.00 0.00 C ATOM 478 C LYS A 404 -4.579 -17.317 -6.941 1.00 0.00 C ATOM 479 O LYS A 404 -5.153 -16.452 -7.604 1.00 0.00 O ATOM 480 CB LYS A 404 -2.155 -16.912 -7.418 1.00 0.00 C ATOM 481 CG LYS A 404 -1.921 -18.204 -8.185 1.00 0.00 C ATOM 482 CD LYS A 404 -2.778 -18.271 -9.438 1.00 0.00 C ATOM 483 CE LYS A 404 -2.026 -18.915 -10.592 1.00 0.00 C ATOM 484 NZ LYS A 404 -1.608 -20.309 -10.275 1.00 0.00 N ATOM 0 H LYS A 404 -2.045 -18.654 -5.671 1.00 0.00 H new ATOM 0 HA LYS A 404 -3.275 -16.099 -5.769 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -2.461 -16.134 -8.117 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -1.215 -16.588 -6.972 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -0.869 -18.281 -8.458 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -2.146 -19.055 -7.543 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -3.685 -18.840 -9.230 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -3.090 -17.266 -9.721 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -2.658 -18.919 -11.480 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -1.146 -18.318 -10.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -1.189 -20.747 -11.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -0.905 -20.295 -9.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -2.437 -20.860 -9.974 1.00 0.00 H new ATOM 498 N THR A 405 -5.100 -18.523 -6.731 1.00 0.00 N ATOM 499 CA THR A 405 -6.397 -18.897 -7.280 1.00 0.00 C ATOM 500 C THR A 405 -7.529 -18.194 -6.534 1.00 0.00 C ATOM 501 O THR A 405 -8.618 -18.006 -7.076 1.00 0.00 O ATOM 502 CB THR A 405 -6.588 -20.412 -7.208 1.00 0.00 C ATOM 503 OG1 THR A 405 -5.350 -21.081 -7.370 1.00 0.00 O ATOM 504 CG2 THR A 405 -7.539 -20.945 -8.259 1.00 0.00 C ATOM 0 H THR A 405 -4.644 -19.255 -6.186 1.00 0.00 H new ATOM 0 HA THR A 405 -6.424 -18.584 -8.324 1.00 0.00 H new ATOM 0 HB THR A 405 -7.015 -20.604 -6.224 1.00 0.00 H new ATOM 0 HG1 THR A 405 -5.492 -22.049 -7.319 1.00 0.00 H new ATOM 0 HG21 THR A 405 -7.630 -22.026 -8.153 1.00 0.00 H new ATOM 0 HG22 THR A 405 -8.518 -20.484 -8.131 1.00 0.00 H new ATOM 0 HG23 THR A 405 -7.154 -20.709 -9.251 1.00 0.00 H new ATOM 512 N ASP A 406 -7.265 -17.808 -5.289 1.00 0.00 N ATOM 513 CA ASP A 406 -8.262 -17.126 -4.474 1.00 0.00 C ATOM 514 C ASP A 406 -8.441 -15.680 -4.928 1.00 0.00 C ATOM 515 O ASP A 406 -7.515 -15.064 -5.453 1.00 0.00 O ATOM 516 CB ASP A 406 -7.856 -17.161 -2.998 1.00 0.00 C ATOM 517 CG ASP A 406 -8.974 -16.711 -2.080 1.00 0.00 C ATOM 518 OD1 ASP A 406 -10.135 -17.103 -2.320 1.00 0.00 O ATOM 519 OD2 ASP A 406 -8.688 -15.965 -1.120 1.00 0.00 O ATOM 0 H ASP A 406 -6.369 -17.956 -4.824 1.00 0.00 H new ATOM 0 HA ASP A 406 -9.212 -17.647 -4.596 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -7.556 -18.174 -2.731 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -6.987 -16.521 -2.848 1.00 0.00 H new ATOM 524 N LYS A 407 -9.641 -15.144 -4.722 1.00 0.00 N ATOM 525 CA LYS A 407 -9.944 -13.771 -5.109 1.00 0.00 C ATOM 526 C LYS A 407 -9.109 -12.777 -4.304 1.00 0.00 C ATOM 527 O LYS A 407 -8.884 -11.646 -4.736 1.00 0.00 O ATOM 528 CB LYS A 407 -11.432 -13.482 -4.912 1.00 0.00 C ATOM 529 CG LYS A 407 -11.842 -12.077 -5.325 1.00 0.00 C ATOM 530 CD LYS A 407 -13.184 -11.690 -4.725 1.00 0.00 C ATOM 531 CE LYS A 407 -13.449 -10.200 -4.870 1.00 0.00 C ATOM 532 NZ LYS A 407 -14.883 -9.915 -5.147 1.00 0.00 N ATOM 0 H LYS A 407 -10.419 -15.641 -4.289 1.00 0.00 H new ATOM 0 HA LYS A 407 -9.693 -13.655 -6.163 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -12.012 -14.204 -5.487 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -11.686 -13.631 -3.863 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -11.080 -11.366 -5.005 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -11.897 -12.018 -6.412 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -13.979 -12.252 -5.216 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -13.205 -11.964 -3.670 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -13.147 -9.687 -3.957 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -12.837 -9.799 -5.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -15.021 -8.888 -5.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -15.165 -10.383 -6.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -15.466 -10.274 -4.364 1.00 0.00 H new ATOM 546 N ALA A 408 -8.657 -13.205 -3.127 1.00 0.00 N ATOM 547 CA ALA A 408 -7.850 -12.354 -2.260 1.00 0.00 C ATOM 548 C ALA A 408 -6.670 -11.749 -3.015 1.00 0.00 C ATOM 549 O ALA A 408 -6.484 -10.534 -3.023 1.00 0.00 O ATOM 550 CB ALA A 408 -7.357 -13.145 -1.057 1.00 0.00 C ATOM 0 H ALA A 408 -8.837 -14.137 -2.753 1.00 0.00 H new ATOM 0 HA ALA A 408 -8.480 -11.535 -1.914 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -6.756 -12.498 -0.418 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -8.211 -13.520 -0.493 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -6.750 -13.984 -1.397 1.00 0.00 H new ATOM 556 N TYR A 409 -5.874 -12.605 -3.651 1.00 0.00 N ATOM 557 CA TYR A 409 -4.713 -12.147 -4.406 1.00 0.00 C ATOM 558 C TYR A 409 -5.124 -11.149 -5.483 1.00 0.00 C ATOM 559 O TYR A 409 -4.441 -10.148 -5.708 1.00 0.00 O ATOM 560 CB TYR A 409 -3.986 -13.333 -5.038 1.00 0.00 C ATOM 561 CG TYR A 409 -2.539 -13.048 -5.363 1.00 0.00 C ATOM 562 CD1 TYR A 409 -1.699 -12.463 -4.423 1.00 0.00 C ATOM 563 CD2 TYR A 409 -2.011 -13.362 -6.609 1.00 0.00 C ATOM 564 CE1 TYR A 409 -0.374 -12.199 -4.714 1.00 0.00 C ATOM 565 CE2 TYR A 409 -0.686 -13.101 -6.908 1.00 0.00 C ATOM 566 CZ TYR A 409 0.128 -12.520 -5.958 1.00 0.00 C ATOM 567 OH TYR A 409 1.446 -12.260 -6.253 1.00 0.00 O ATOM 0 H TYR A 409 -6.012 -13.616 -3.658 1.00 0.00 H new ATOM 0 HA TYR A 409 -4.036 -11.647 -3.714 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.037 -14.184 -4.359 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -4.505 -13.623 -5.952 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -2.089 -12.210 -3.448 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -2.645 -13.817 -7.356 1.00 0.00 H new ATOM 0 HE1 TYR A 409 0.265 -11.744 -3.972 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.290 -13.351 -7.881 1.00 0.00 H new ATOM 0 HH TYR A 409 1.639 -12.548 -7.170 1.00 0.00 H new ATOM 577 N TRP A 410 -6.248 -11.419 -6.140 1.00 0.00 N ATOM 578 CA TRP A 410 -6.749 -10.532 -7.185 1.00 0.00 C ATOM 579 C TRP A 410 -6.948 -9.128 -6.631 1.00 0.00 C ATOM 580 O TRP A 410 -6.280 -8.182 -7.050 1.00 0.00 O ATOM 581 CB TRP A 410 -8.073 -11.056 -7.747 1.00 0.00 C ATOM 582 CG TRP A 410 -7.999 -12.465 -8.250 1.00 0.00 C ATOM 583 CD1 TRP A 410 -6.870 -13.184 -8.526 1.00 0.00 C ATOM 584 CD2 TRP A 410 -9.104 -13.325 -8.542 1.00 0.00 C ATOM 585 NE1 TRP A 410 -7.209 -14.440 -8.971 1.00 0.00 N ATOM 586 CE2 TRP A 410 -8.575 -14.550 -8.989 1.00 0.00 C ATOM 587 CE3 TRP A 410 -10.491 -13.178 -8.466 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -9.386 -15.620 -9.360 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -11.296 -14.240 -8.834 1.00 0.00 C ATOM 590 CH2 TRP A 410 -10.741 -15.447 -9.275 1.00 0.00 C ATOM 0 H TRP A 410 -6.827 -12.241 -5.969 1.00 0.00 H new ATOM 0 HA TRP A 410 -6.013 -10.501 -7.989 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -8.836 -10.997 -6.971 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -8.395 -10.406 -8.560 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -5.860 -12.819 -8.411 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -6.551 -15.171 -9.243 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -10.927 -12.250 -8.126 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -8.961 -16.552 -9.702 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -12.370 -14.137 -8.780 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -11.396 -16.259 -9.554 1.00 0.00 H new ATOM 601 N LEU A 411 -7.864 -9.003 -5.677 1.00 0.00 N ATOM 602 CA LEU A 411 -8.142 -7.717 -5.052 1.00 0.00 C ATOM 603 C LEU A 411 -6.897 -7.186 -4.354 1.00 0.00 C ATOM 604 O LEU A 411 -6.681 -5.978 -4.276 1.00 0.00 O ATOM 605 CB LEU A 411 -9.292 -7.848 -4.051 1.00 0.00 C ATOM 606 CG LEU A 411 -9.108 -8.932 -2.988 1.00 0.00 C ATOM 607 CD1 LEU A 411 -8.354 -8.382 -1.786 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.457 -9.494 -2.563 1.00 0.00 C ATOM 0 H LEU A 411 -8.426 -9.776 -5.320 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.434 -7.012 -5.830 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -9.428 -6.889 -3.550 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -10.210 -8.053 -4.601 1.00 0.00 H new ATOM 0 HG LEU A 411 -8.518 -9.741 -3.420 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -8.233 -9.169 -1.041 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -7.373 -8.029 -2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -8.915 -7.554 -1.352 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.308 -10.264 -1.806 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -11.071 -8.693 -2.150 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -10.959 -9.927 -3.428 1.00 0.00 H new ATOM 620 N LEU A 412 -6.074 -8.105 -3.852 1.00 0.00 N ATOM 621 CA LEU A 412 -4.841 -7.739 -3.165 1.00 0.00 C ATOM 622 C LEU A 412 -3.985 -6.827 -4.041 1.00 0.00 C ATOM 623 O LEU A 412 -3.798 -5.650 -3.735 1.00 0.00 O ATOM 624 CB LEU A 412 -4.050 -8.996 -2.795 1.00 0.00 C ATOM 625 CG LEU A 412 -4.385 -9.604 -1.431 1.00 0.00 C ATOM 626 CD1 LEU A 412 -3.852 -11.026 -1.333 1.00 0.00 C ATOM 627 CD2 LEU A 412 -3.818 -8.744 -0.313 1.00 0.00 C ATOM 0 H LEU A 412 -6.241 -9.110 -3.909 1.00 0.00 H new ATOM 0 HA LEU A 412 -5.104 -7.200 -2.255 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -4.221 -9.751 -3.562 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -2.987 -8.755 -2.815 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.469 -9.637 -1.326 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -4.100 -11.441 -0.356 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -4.304 -11.639 -2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -2.769 -11.018 -1.460 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -4.065 -9.190 0.650 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -2.735 -8.681 -0.416 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -4.247 -7.744 -0.370 1.00 0.00 H new ATOM 639 N GLU A 413 -3.472 -7.382 -5.134 1.00 0.00 N ATOM 640 CA GLU A 413 -2.637 -6.622 -6.057 1.00 0.00 C ATOM 641 C GLU A 413 -3.423 -5.477 -6.689 1.00 0.00 C ATOM 642 O GLU A 413 -2.876 -4.404 -6.944 1.00 0.00 O ATOM 643 CB GLU A 413 -2.082 -7.540 -7.147 1.00 0.00 C ATOM 644 CG GLU A 413 -0.643 -7.230 -7.529 1.00 0.00 C ATOM 645 CD GLU A 413 -0.536 -6.485 -8.844 1.00 0.00 C ATOM 646 OE1 GLU A 413 -1.235 -6.874 -9.805 1.00 0.00 O ATOM 647 OE2 GLU A 413 0.245 -5.515 -8.915 1.00 0.00 O ATOM 0 H GLU A 413 -3.620 -8.355 -5.402 1.00 0.00 H new ATOM 0 HA GLU A 413 -1.807 -6.197 -5.492 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -2.144 -8.574 -6.806 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -2.710 -7.458 -8.034 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -0.182 -6.635 -6.740 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -0.080 -8.161 -7.597 1.00 0.00 H new ATOM 654 N GLU A 414 -4.705 -5.714 -6.944 1.00 0.00 N ATOM 655 CA GLU A 414 -5.564 -4.703 -7.551 1.00 0.00 C ATOM 656 C GLU A 414 -5.694 -3.477 -6.650 1.00 0.00 C ATOM 657 O GLU A 414 -5.257 -2.383 -7.006 1.00 0.00 O ATOM 658 CB GLU A 414 -6.949 -5.287 -7.838 1.00 0.00 C ATOM 659 CG GLU A 414 -7.715 -4.537 -8.915 1.00 0.00 C ATOM 660 CD GLU A 414 -9.211 -4.767 -8.834 1.00 0.00 C ATOM 661 OE1 GLU A 414 -9.673 -5.832 -9.297 1.00 0.00 O ATOM 662 OE2 GLU A 414 -9.921 -3.884 -8.308 1.00 0.00 O ATOM 0 H GLU A 414 -5.173 -6.597 -6.740 1.00 0.00 H new ATOM 0 HA GLU A 414 -5.104 -4.392 -8.489 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -6.839 -6.328 -8.141 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -7.534 -5.282 -6.918 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -7.510 -3.470 -8.825 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -7.356 -4.849 -9.896 1.00 0.00 H new ATOM 669 N MET A 415 -6.301 -3.667 -5.482 1.00 0.00 N ATOM 670 CA MET A 415 -6.491 -2.577 -4.533 1.00 0.00 C ATOM 671 C MET A 415 -5.160 -1.918 -4.177 1.00 0.00 C ATOM 672 O MET A 415 -5.060 -0.692 -4.120 1.00 0.00 O ATOM 673 CB MET A 415 -7.179 -3.091 -3.265 1.00 0.00 C ATOM 674 CG MET A 415 -8.402 -2.282 -2.864 1.00 0.00 C ATOM 675 SD MET A 415 -9.942 -3.019 -3.447 1.00 0.00 S ATOM 676 CE MET A 415 -10.891 -3.062 -1.929 1.00 0.00 C ATOM 0 H MET A 415 -6.669 -4.566 -5.171 1.00 0.00 H new ATOM 0 HA MET A 415 -7.126 -1.827 -5.005 1.00 0.00 H new ATOM 0 HB2 MET A 415 -7.475 -4.129 -3.418 1.00 0.00 H new ATOM 0 HB3 MET A 415 -6.462 -3.081 -2.444 1.00 0.00 H new ATOM 0 HG2 MET A 415 -8.434 -2.193 -1.778 1.00 0.00 H new ATOM 0 HG3 MET A 415 -8.312 -1.272 -3.264 1.00 0.00 H new ATOM 0 HE1 MET A 415 -11.873 -3.493 -2.126 1.00 0.00 H new ATOM 0 HE2 MET A 415 -10.369 -3.670 -1.190 1.00 0.00 H new ATOM 0 HE3 MET A 415 -11.010 -2.049 -1.546 1.00 0.00 H new ATOM 686 N LEU A 416 -4.141 -2.738 -3.941 1.00 0.00 N ATOM 687 CA LEU A 416 -2.820 -2.229 -3.592 1.00 0.00 C ATOM 688 C LEU A 416 -2.266 -1.339 -4.700 1.00 0.00 C ATOM 689 O LEU A 416 -1.863 -0.202 -4.452 1.00 0.00 O ATOM 690 CB LEU A 416 -1.858 -3.386 -3.319 1.00 0.00 C ATOM 691 CG LEU A 416 -0.640 -3.029 -2.464 1.00 0.00 C ATOM 692 CD1 LEU A 416 -1.070 -2.335 -1.180 1.00 0.00 C ATOM 693 CD2 LEU A 416 0.175 -4.277 -2.150 1.00 0.00 C ATOM 0 H LEU A 416 -4.204 -3.755 -3.985 1.00 0.00 H new ATOM 0 HA LEU A 416 -2.919 -1.629 -2.687 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -2.408 -4.186 -2.824 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -1.510 -3.781 -4.273 1.00 0.00 H new ATOM 0 HG LEU A 416 -0.013 -2.341 -3.031 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -0.189 -2.090 -0.586 1.00 0.00 H new ATOM 0 HD12 LEU A 416 -1.610 -1.420 -1.424 1.00 0.00 H new ATOM 0 HD13 LEU A 416 -1.720 -2.998 -0.608 1.00 0.00 H new ATOM 0 HD21 LEU A 416 1.037 -4.005 -1.541 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -0.445 -4.988 -1.604 1.00 0.00 H new ATOM 0 HD23 LEU A 416 0.516 -4.732 -3.080 1.00 0.00 H new ATOM 705 N THR A 417 -2.253 -1.858 -5.926 1.00 0.00 N ATOM 706 CA THR A 417 -1.751 -1.101 -7.068 1.00 0.00 C ATOM 707 C THR A 417 -2.457 0.246 -7.176 1.00 0.00 C ATOM 708 O THR A 417 -1.817 1.284 -7.344 1.00 0.00 O ATOM 709 CB THR A 417 -1.939 -1.896 -8.362 1.00 0.00 C ATOM 710 OG1 THR A 417 -3.241 -2.449 -8.426 1.00 0.00 O ATOM 711 CG2 THR A 417 -0.949 -3.031 -8.517 1.00 0.00 C ATOM 0 H THR A 417 -2.583 -2.796 -6.153 1.00 0.00 H new ATOM 0 HA THR A 417 -0.686 -0.924 -6.915 1.00 0.00 H new ATOM 0 HB THR A 417 -1.774 -1.180 -9.167 1.00 0.00 H new ATOM 0 HG1 THR A 417 -3.209 -3.392 -8.161 1.00 0.00 H new ATOM 0 HG21 THR A 417 -1.138 -3.553 -9.455 1.00 0.00 H new ATOM 0 HG22 THR A 417 0.065 -2.631 -8.522 1.00 0.00 H new ATOM 0 HG23 THR A 417 -1.060 -3.727 -7.686 1.00 0.00 H new ATOM 719 N LYS A 418 -3.783 0.222 -7.065 1.00 0.00 N ATOM 720 CA LYS A 418 -4.576 1.444 -7.139 1.00 0.00 C ATOM 721 C LYS A 418 -4.144 2.424 -6.054 1.00 0.00 C ATOM 722 O LYS A 418 -4.010 3.623 -6.302 1.00 0.00 O ATOM 723 CB LYS A 418 -6.064 1.123 -6.993 1.00 0.00 C ATOM 724 CG LYS A 418 -6.976 2.249 -7.451 1.00 0.00 C ATOM 725 CD LYS A 418 -7.234 2.184 -8.950 1.00 0.00 C ATOM 726 CE LYS A 418 -7.809 3.489 -9.473 1.00 0.00 C ATOM 727 NZ LYS A 418 -6.788 4.571 -9.510 1.00 0.00 N ATOM 0 H LYS A 418 -4.329 -0.628 -6.924 1.00 0.00 H new ATOM 0 HA LYS A 418 -4.410 1.904 -8.113 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -6.292 0.225 -7.568 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -6.278 0.895 -5.949 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -7.923 2.192 -6.915 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -6.525 3.209 -7.200 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -6.303 1.961 -9.471 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -7.924 1.368 -9.166 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -8.209 3.333 -10.475 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -8.642 3.798 -8.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -7.135 5.356 -10.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -6.610 4.913 -8.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -5.904 4.201 -9.914 1.00 0.00 H new ATOM 741 N GLU A 419 -3.918 1.902 -4.852 1.00 0.00 N ATOM 742 CA GLU A 419 -3.492 2.726 -3.727 1.00 0.00 C ATOM 743 C GLU A 419 -2.185 3.444 -4.053 1.00 0.00 C ATOM 744 O GLU A 419 -2.058 4.648 -3.839 1.00 0.00 O ATOM 745 CB GLU A 419 -3.319 1.863 -2.473 1.00 0.00 C ATOM 746 CG GLU A 419 -2.740 2.614 -1.285 1.00 0.00 C ATOM 747 CD GLU A 419 -1.223 2.581 -1.256 1.00 0.00 C ATOM 748 OE1 GLU A 419 -0.626 1.912 -2.126 1.00 0.00 O ATOM 749 OE2 GLU A 419 -0.632 3.222 -0.361 1.00 0.00 O ATOM 0 H GLU A 419 -4.023 0.911 -4.633 1.00 0.00 H new ATOM 0 HA GLU A 419 -4.262 3.474 -3.538 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -4.287 1.449 -2.192 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -2.669 1.021 -2.710 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -3.077 3.650 -1.316 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -3.127 2.181 -0.363 1.00 0.00 H new ATOM 756 N LEU A 420 -1.220 2.694 -4.577 1.00 0.00 N ATOM 757 CA LEU A 420 0.076 3.258 -4.938 1.00 0.00 C ATOM 758 C LEU A 420 -0.090 4.379 -5.958 1.00 0.00 C ATOM 759 O LEU A 420 0.405 5.490 -5.762 1.00 0.00 O ATOM 760 CB LEU A 420 0.991 2.169 -5.501 1.00 0.00 C ATOM 761 CG LEU A 420 1.921 1.511 -4.479 1.00 0.00 C ATOM 762 CD1 LEU A 420 2.148 0.048 -4.829 1.00 0.00 C ATOM 763 CD2 LEU A 420 3.245 2.256 -4.409 1.00 0.00 C ATOM 0 H LEU A 420 -1.311 1.695 -4.761 1.00 0.00 H new ATOM 0 HA LEU A 420 0.531 3.672 -4.038 1.00 0.00 H new ATOM 0 HB2 LEU A 420 0.372 1.396 -5.957 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.598 2.601 -6.296 1.00 0.00 H new ATOM 0 HG LEU A 420 1.447 1.559 -3.499 1.00 0.00 H new ATOM 0 HD11 LEU A 420 2.812 -0.404 -4.092 1.00 0.00 H new ATOM 0 HD12 LEU A 420 1.194 -0.478 -4.829 1.00 0.00 H new ATOM 0 HD13 LEU A 420 2.602 -0.023 -5.817 1.00 0.00 H new ATOM 0 HD21 LEU A 420 3.895 1.775 -3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 420 3.725 2.238 -5.388 1.00 0.00 H new ATOM 0 HD23 LEU A 420 3.066 3.289 -4.111 1.00 0.00 H new ATOM 775 N LEU A 421 -0.793 4.082 -7.046 1.00 0.00 N ATOM 776 CA LEU A 421 -1.028 5.065 -8.095 1.00 0.00 C ATOM 777 C LEU A 421 -1.777 6.276 -7.548 1.00 0.00 C ATOM 778 O LEU A 421 -1.619 7.392 -8.042 1.00 0.00 O ATOM 779 CB LEU A 421 -1.820 4.438 -9.243 1.00 0.00 C ATOM 780 CG LEU A 421 -1.068 3.372 -10.043 1.00 0.00 C ATOM 781 CD1 LEU A 421 -2.021 2.279 -10.505 1.00 0.00 C ATOM 782 CD2 LEU A 421 -0.360 4.000 -11.234 1.00 0.00 C ATOM 0 H LEU A 421 -1.210 3.168 -7.223 1.00 0.00 H new ATOM 0 HA LEU A 421 -0.060 5.397 -8.470 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -2.728 3.992 -8.837 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -2.131 5.230 -9.925 1.00 0.00 H new ATOM 0 HG LEU A 421 -0.317 2.922 -9.394 1.00 0.00 H new ATOM 0 HD11 LEU A 421 -1.468 1.530 -11.072 1.00 0.00 H new ATOM 0 HD12 LEU A 421 -2.483 1.809 -9.637 1.00 0.00 H new ATOM 0 HD13 LEU A 421 -2.795 2.714 -11.137 1.00 0.00 H new ATOM 0 HD21 LEU A 421 0.170 3.227 -11.791 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -1.094 4.477 -11.883 1.00 0.00 H new ATOM 0 HD23 LEU A 421 0.352 4.746 -10.882 1.00 0.00 H new ATOM 794 N GLU A 422 -2.596 6.047 -6.526 1.00 0.00 N ATOM 795 CA GLU A 422 -3.372 7.117 -5.912 1.00 0.00 C ATOM 796 C GLU A 422 -2.493 7.997 -5.028 1.00 0.00 C ATOM 797 O GLU A 422 -2.671 9.214 -4.976 1.00 0.00 O ATOM 798 CB GLU A 422 -4.523 6.536 -5.089 1.00 0.00 C ATOM 799 CG GLU A 422 -5.612 7.545 -4.766 1.00 0.00 C ATOM 800 CD GLU A 422 -6.221 7.326 -3.395 1.00 0.00 C ATOM 801 OE1 GLU A 422 -5.453 7.200 -2.418 1.00 0.00 O ATOM 802 OE2 GLU A 422 -7.466 7.282 -3.298 1.00 0.00 O ATOM 0 H GLU A 422 -2.739 5.129 -6.106 1.00 0.00 H new ATOM 0 HA GLU A 422 -3.781 7.734 -6.712 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -4.963 5.701 -5.635 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -4.125 6.133 -4.158 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -5.197 8.551 -4.819 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -6.395 7.483 -5.522 1.00 0.00 H new ATOM 809 N LEU A 423 -1.545 7.375 -4.334 1.00 0.00 N ATOM 810 CA LEU A 423 -0.644 8.107 -3.450 1.00 0.00 C ATOM 811 C LEU A 423 0.434 8.842 -4.250 1.00 0.00 C ATOM 812 O LEU A 423 0.957 9.864 -3.808 1.00 0.00 O ATOM 813 CB LEU A 423 -0.006 7.155 -2.427 1.00 0.00 C ATOM 814 CG LEU A 423 1.378 6.605 -2.797 1.00 0.00 C ATOM 815 CD1 LEU A 423 2.472 7.478 -2.199 1.00 0.00 C ATOM 816 CD2 LEU A 423 1.524 5.166 -2.322 1.00 0.00 C ATOM 0 H LEU A 423 -1.381 6.369 -4.366 1.00 0.00 H new ATOM 0 HA LEU A 423 -1.228 8.853 -2.912 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.075 7.678 -1.474 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -0.681 6.313 -2.273 1.00 0.00 H new ATOM 0 HG LEU A 423 1.478 6.620 -3.882 1.00 0.00 H new ATOM 0 HD11 LEU A 423 3.448 7.075 -2.470 1.00 0.00 H new ATOM 0 HD12 LEU A 423 2.379 8.493 -2.584 1.00 0.00 H new ATOM 0 HD13 LEU A 423 2.374 7.492 -1.114 1.00 0.00 H new ATOM 0 HD21 LEU A 423 2.511 4.792 -2.593 1.00 0.00 H new ATOM 0 HD22 LEU A 423 1.405 5.126 -1.239 1.00 0.00 H new ATOM 0 HD23 LEU A 423 0.760 4.548 -2.793 1.00 0.00 H new ATOM 828 N ASP A 424 0.757 8.312 -5.426 1.00 0.00 N ATOM 829 CA ASP A 424 1.771 8.917 -6.285 1.00 0.00 C ATOM 830 C ASP A 424 1.426 10.370 -6.612 1.00 0.00 C ATOM 831 O ASP A 424 2.300 11.155 -6.980 1.00 0.00 O ATOM 832 CB ASP A 424 1.914 8.114 -7.579 1.00 0.00 C ATOM 833 CG ASP A 424 3.328 8.151 -8.128 1.00 0.00 C ATOM 834 OD1 ASP A 424 4.215 7.507 -7.528 1.00 0.00 O ATOM 835 OD2 ASP A 424 3.547 8.823 -9.158 1.00 0.00 O ATOM 0 H ASP A 424 0.332 7.466 -5.806 1.00 0.00 H new ATOM 0 HA ASP A 424 2.718 8.904 -5.745 1.00 0.00 H new ATOM 0 HB2 ASP A 424 1.625 7.079 -7.395 1.00 0.00 H new ATOM 0 HB3 ASP A 424 1.226 8.509 -8.327 1.00 0.00 H new ATOM 840 N SER A 425 0.150 10.722 -6.478 1.00 0.00 N ATOM 841 CA SER A 425 -0.302 12.080 -6.764 1.00 0.00 C ATOM 842 C SER A 425 0.172 13.060 -5.693 1.00 0.00 C ATOM 843 O SER A 425 0.190 14.270 -5.914 1.00 0.00 O ATOM 844 CB SER A 425 -1.827 12.118 -6.866 1.00 0.00 C ATOM 845 OG SER A 425 -2.292 11.280 -7.908 1.00 0.00 O ATOM 0 H SER A 425 -0.588 10.087 -6.174 1.00 0.00 H new ATOM 0 HA SER A 425 0.131 12.383 -7.717 1.00 0.00 H new ATOM 0 HB2 SER A 425 -2.265 11.802 -5.919 1.00 0.00 H new ATOM 0 HB3 SER A 425 -2.157 13.142 -7.044 1.00 0.00 H new ATOM 0 HG SER A 425 -3.270 11.322 -7.950 1.00 0.00 H new ATOM 851 N VAL A 426 0.554 12.533 -4.532 1.00 0.00 N ATOM 852 CA VAL A 426 1.026 13.369 -3.433 1.00 0.00 C ATOM 853 C VAL A 426 2.199 14.244 -3.866 1.00 0.00 C ATOM 854 O VAL A 426 3.077 13.801 -4.605 1.00 0.00 O ATOM 855 CB VAL A 426 1.451 12.513 -2.223 1.00 0.00 C ATOM 856 CG1 VAL A 426 2.641 11.632 -2.577 1.00 0.00 C ATOM 857 CG2 VAL A 426 1.771 13.398 -1.025 1.00 0.00 C ATOM 0 H VAL A 426 0.546 11.533 -4.329 1.00 0.00 H new ATOM 0 HA VAL A 426 0.194 14.010 -3.142 1.00 0.00 H new ATOM 0 HB VAL A 426 0.617 11.864 -1.954 1.00 0.00 H new ATOM 0 HG11 VAL A 426 2.924 11.037 -1.709 1.00 0.00 H new ATOM 0 HG12 VAL A 426 2.371 10.969 -3.399 1.00 0.00 H new ATOM 0 HG13 VAL A 426 3.481 12.258 -2.877 1.00 0.00 H new ATOM 0 HG21 VAL A 426 2.069 12.775 -0.182 1.00 0.00 H new ATOM 0 HG22 VAL A 426 2.585 14.076 -1.281 1.00 0.00 H new ATOM 0 HG23 VAL A 426 0.888 13.977 -0.754 1.00 0.00 H new ATOM 867 N GLU A 427 2.205 15.490 -3.399 1.00 0.00 N ATOM 868 CA GLU A 427 3.271 16.426 -3.738 1.00 0.00 C ATOM 869 C GLU A 427 4.164 16.693 -2.531 1.00 0.00 C ATOM 870 O GLU A 427 3.697 17.152 -1.489 1.00 0.00 O ATOM 871 CB GLU A 427 2.678 17.741 -4.249 1.00 0.00 C ATOM 872 CG GLU A 427 2.499 17.781 -5.759 1.00 0.00 C ATOM 873 CD GLU A 427 1.185 17.170 -6.206 1.00 0.00 C ATOM 874 OE1 GLU A 427 0.129 17.581 -5.681 1.00 0.00 O ATOM 875 OE2 GLU A 427 1.214 16.279 -7.083 1.00 0.00 O ATOM 0 H GLU A 427 1.485 15.873 -2.786 1.00 0.00 H new ATOM 0 HA GLU A 427 3.878 15.978 -4.525 1.00 0.00 H new ATOM 0 HB2 GLU A 427 1.711 17.904 -3.772 1.00 0.00 H new ATOM 0 HB3 GLU A 427 3.325 18.564 -3.946 1.00 0.00 H new ATOM 0 HG2 GLU A 427 2.549 18.815 -6.100 1.00 0.00 H new ATOM 0 HG3 GLU A 427 3.323 17.248 -6.233 1.00 0.00 H new ATOM 882 N THR A 428 5.452 16.399 -2.678 1.00 0.00 N ATOM 883 CA THR A 428 6.411 16.607 -1.598 1.00 0.00 C ATOM 884 C THR A 428 7.555 17.508 -2.051 1.00 0.00 C ATOM 885 O THR A 428 8.463 17.068 -2.756 1.00 0.00 O ATOM 886 CB THR A 428 6.965 15.266 -1.113 1.00 0.00 C ATOM 887 OG1 THR A 428 7.998 15.463 -0.165 1.00 0.00 O ATOM 888 CG2 THR A 428 7.524 14.410 -2.230 1.00 0.00 C ATOM 0 H THR A 428 5.856 16.017 -3.533 1.00 0.00 H new ATOM 0 HA THR A 428 5.891 17.097 -0.775 1.00 0.00 H new ATOM 0 HB THR A 428 6.116 14.747 -0.669 1.00 0.00 H new ATOM 0 HG1 THR A 428 8.338 14.594 0.134 1.00 0.00 H new ATOM 0 HG21 THR A 428 7.900 13.474 -1.818 1.00 0.00 H new ATOM 0 HG22 THR A 428 6.737 14.197 -2.954 1.00 0.00 H new ATOM 0 HG23 THR A 428 8.337 14.942 -2.724 1.00 0.00 H new ATOM 896 N GLY A 429 7.505 18.771 -1.641 1.00 0.00 N ATOM 897 CA GLY A 429 8.544 19.714 -2.014 1.00 0.00 C ATOM 898 C GLY A 429 9.453 20.061 -0.853 1.00 0.00 C ATOM 899 O GLY A 429 10.012 21.159 -0.800 1.00 0.00 O ATOM 0 H GLY A 429 6.764 19.159 -1.057 1.00 0.00 H new ATOM 0 HA2 GLY A 429 9.139 19.293 -2.824 1.00 0.00 H new ATOM 0 HA3 GLY A 429 8.084 20.625 -2.396 1.00 0.00 H new ATOM 903 N GLY A 430 9.605 19.127 0.079 1.00 0.00 N ATOM 904 CA GLY A 430 10.455 19.358 1.232 1.00 0.00 C ATOM 905 C GLY A 430 9.682 19.331 2.536 1.00 0.00 C ATOM 906 O GLY A 430 9.995 20.075 3.466 1.00 0.00 O ATOM 0 H GLY A 430 9.154 18.212 0.057 1.00 0.00 H new ATOM 0 HA2 GLY A 430 11.237 18.599 1.261 1.00 0.00 H new ATOM 0 HA3 GLY A 430 10.951 20.323 1.127 1.00 0.00 H new ATOM 910 N GLN A 431 8.670 18.473 2.603 1.00 0.00 N ATOM 911 CA GLN A 431 7.848 18.352 3.802 1.00 0.00 C ATOM 912 C GLN A 431 8.203 17.089 4.580 1.00 0.00 C ATOM 913 O GLN A 431 8.142 15.981 4.047 1.00 0.00 O ATOM 914 CB GLN A 431 6.364 18.337 3.429 1.00 0.00 C ATOM 915 CG GLN A 431 5.751 19.722 3.319 1.00 0.00 C ATOM 916 CD GLN A 431 6.067 20.397 2.000 1.00 0.00 C ATOM 917 OE1 GLN A 431 5.788 19.855 0.929 1.00 0.00 O ATOM 918 NE2 GLN A 431 6.654 21.586 2.066 1.00 0.00 N ATOM 0 H GLN A 431 8.399 17.851 1.841 1.00 0.00 H new ATOM 0 HA GLN A 431 8.046 19.215 4.437 1.00 0.00 H new ATOM 0 HB2 GLN A 431 6.242 17.818 2.478 1.00 0.00 H new ATOM 0 HB3 GLN A 431 5.816 17.764 4.177 1.00 0.00 H new ATOM 0 HG2 GLN A 431 4.670 19.647 3.434 1.00 0.00 H new ATOM 0 HG3 GLN A 431 6.116 20.343 4.137 1.00 0.00 H new ATOM 0 HE21 GLN A 431 6.868 22.000 2.974 1.00 0.00 H new ATOM 0 HE22 GLN A 431 6.891 22.086 1.209 1.00 0.00 H new ATOM 927 N ASP A 432 8.576 17.264 5.843 1.00 0.00 N ATOM 928 CA ASP A 432 8.943 16.139 6.696 1.00 0.00 C ATOM 929 C ASP A 432 7.799 15.132 6.796 1.00 0.00 C ATOM 930 O ASP A 432 8.027 13.922 6.840 1.00 0.00 O ATOM 931 CB ASP A 432 9.322 16.634 8.093 1.00 0.00 C ATOM 932 CG ASP A 432 10.461 15.838 8.699 1.00 0.00 C ATOM 933 OD1 ASP A 432 10.223 14.687 9.121 1.00 0.00 O ATOM 934 OD2 ASP A 432 11.592 16.365 8.751 1.00 0.00 O ATOM 0 H ASP A 432 8.632 18.175 6.299 1.00 0.00 H new ATOM 0 HA ASP A 432 9.802 15.642 6.246 1.00 0.00 H new ATOM 0 HB2 ASP A 432 9.606 17.685 8.039 1.00 0.00 H new ATOM 0 HB3 ASP A 432 8.451 16.572 8.746 1.00 0.00 H new ATOM 939 N SER A 433 6.571 15.639 6.829 1.00 0.00 N ATOM 940 CA SER A 433 5.392 14.784 6.925 1.00 0.00 C ATOM 941 C SER A 433 5.361 13.767 5.788 1.00 0.00 C ATOM 942 O SER A 433 5.536 12.568 6.009 1.00 0.00 O ATOM 943 CB SER A 433 4.119 15.632 6.902 1.00 0.00 C ATOM 944 OG SER A 433 3.182 15.172 7.860 1.00 0.00 O ATOM 0 H SER A 433 6.366 16.637 6.791 1.00 0.00 H new ATOM 0 HA SER A 433 5.443 14.242 7.870 1.00 0.00 H new ATOM 0 HB2 SER A 433 4.369 16.674 7.104 1.00 0.00 H new ATOM 0 HB3 SER A 433 3.674 15.598 5.908 1.00 0.00 H new ATOM 0 HG SER A 433 2.378 15.732 7.826 1.00 0.00 H new ATOM 950 N VAL A 434 5.141 14.252 4.571 1.00 0.00 N ATOM 951 CA VAL A 434 5.092 13.382 3.402 1.00 0.00 C ATOM 952 C VAL A 434 6.432 12.684 3.185 1.00 0.00 C ATOM 953 O VAL A 434 6.491 11.622 2.569 1.00 0.00 O ATOM 954 CB VAL A 434 4.703 14.167 2.131 1.00 0.00 C ATOM 955 CG1 VAL A 434 4.805 13.286 0.893 1.00 0.00 C ATOM 956 CG2 VAL A 434 3.298 14.731 2.271 1.00 0.00 C ATOM 0 H VAL A 434 4.994 15.241 4.369 1.00 0.00 H new ATOM 0 HA VAL A 434 4.326 12.630 3.592 1.00 0.00 H new ATOM 0 HB VAL A 434 5.402 14.995 2.013 1.00 0.00 H new ATOM 0 HG11 VAL A 434 4.526 13.863 0.012 1.00 0.00 H new ATOM 0 HG12 VAL A 434 5.829 12.929 0.784 1.00 0.00 H new ATOM 0 HG13 VAL A 434 4.133 12.434 0.996 1.00 0.00 H new ATOM 0 HG21 VAL A 434 3.036 15.282 1.368 1.00 0.00 H new ATOM 0 HG22 VAL A 434 2.591 13.914 2.416 1.00 0.00 H new ATOM 0 HG23 VAL A 434 3.259 15.401 3.130 1.00 0.00 H new ATOM 966 N ARG A 435 7.504 13.279 3.698 1.00 0.00 N ATOM 967 CA ARG A 435 8.834 12.696 3.559 1.00 0.00 C ATOM 968 C ARG A 435 8.882 11.325 4.225 1.00 0.00 C ATOM 969 O ARG A 435 9.089 10.306 3.562 1.00 0.00 O ATOM 970 CB ARG A 435 9.888 13.619 4.175 1.00 0.00 C ATOM 971 CG ARG A 435 10.659 14.432 3.147 1.00 0.00 C ATOM 972 CD ARG A 435 11.888 13.685 2.653 1.00 0.00 C ATOM 973 NE ARG A 435 11.812 13.393 1.222 1.00 0.00 N ATOM 974 CZ ARG A 435 12.043 14.292 0.269 1.00 0.00 C ATOM 975 NH1 ARG A 435 12.365 15.539 0.586 1.00 0.00 N ATOM 976 NH2 ARG A 435 11.953 13.942 -1.008 1.00 0.00 N ATOM 0 H ARG A 435 7.479 14.160 4.211 1.00 0.00 H new ATOM 0 HA ARG A 435 9.052 12.578 2.497 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.400 14.300 4.873 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.591 13.019 4.753 1.00 0.00 H new ATOM 0 HG2 ARG A 435 10.009 14.664 2.303 1.00 0.00 H new ATOM 0 HG3 ARG A 435 10.962 15.382 3.586 1.00 0.00 H new ATOM 0 HD2 ARG A 435 12.779 14.279 2.855 1.00 0.00 H new ATOM 0 HD3 ARG A 435 11.994 12.753 3.208 1.00 0.00 H new ATOM 0 HE ARG A 435 11.568 12.444 0.938 1.00 0.00 H new ATOM 0 HH11 ARG A 435 12.437 15.814 1.566 1.00 0.00 H new ATOM 0 HH12 ARG A 435 12.541 16.223 -0.150 1.00 0.00 H new ATOM 0 HH21 ARG A 435 11.707 12.984 -1.258 1.00 0.00 H new ATOM 0 HH22 ARG A 435 12.130 14.631 -1.739 1.00 0.00 H new ATOM 990 N GLN A 436 8.677 11.305 5.540 1.00 0.00 N ATOM 991 CA GLN A 436 8.687 10.058 6.293 1.00 0.00 C ATOM 992 C GLN A 436 7.544 9.157 5.842 1.00 0.00 C ATOM 993 O GLN A 436 7.710 7.945 5.703 1.00 0.00 O ATOM 994 CB GLN A 436 8.570 10.339 7.793 1.00 0.00 C ATOM 995 CG GLN A 436 9.687 11.217 8.335 1.00 0.00 C ATOM 996 CD GLN A 436 11.029 10.512 8.346 1.00 0.00 C ATOM 997 OE1 GLN A 436 11.864 10.728 7.467 1.00 0.00 O ATOM 998 NE2 GLN A 436 11.243 9.660 9.342 1.00 0.00 N ATOM 0 H GLN A 436 8.503 12.137 6.103 1.00 0.00 H new ATOM 0 HA GLN A 436 9.632 9.550 6.103 1.00 0.00 H new ATOM 0 HB2 GLN A 436 7.612 10.820 7.991 1.00 0.00 H new ATOM 0 HB3 GLN A 436 8.569 9.392 8.333 1.00 0.00 H new ATOM 0 HG2 GLN A 436 9.760 12.120 7.730 1.00 0.00 H new ATOM 0 HG3 GLN A 436 9.438 11.532 9.348 1.00 0.00 H new ATOM 0 HE21 GLN A 436 10.523 9.511 10.049 1.00 0.00 H new ATOM 0 HE22 GLN A 436 12.127 9.154 9.400 1.00 0.00 H new ATOM 1007 N ALA A 437 6.382 9.762 5.608 1.00 0.00 N ATOM 1008 CA ALA A 437 5.211 9.020 5.163 1.00 0.00 C ATOM 1009 C ALA A 437 5.468 8.363 3.811 1.00 0.00 C ATOM 1010 O ALA A 437 5.061 7.227 3.574 1.00 0.00 O ATOM 1011 CB ALA A 437 4.002 9.941 5.085 1.00 0.00 C ATOM 0 H ALA A 437 6.229 10.764 5.720 1.00 0.00 H new ATOM 0 HA ALA A 437 5.006 8.234 5.890 1.00 0.00 H new ATOM 0 HB1 ALA A 437 3.133 9.374 4.751 1.00 0.00 H new ATOM 0 HB2 ALA A 437 3.803 10.364 6.070 1.00 0.00 H new ATOM 0 HB3 ALA A 437 4.203 10.746 4.378 1.00 0.00 H new ATOM 1017 N ARG A 438 6.152 9.087 2.931 1.00 0.00 N ATOM 1018 CA ARG A 438 6.473 8.576 1.604 1.00 0.00 C ATOM 1019 C ARG A 438 7.417 7.385 1.704 1.00 0.00 C ATOM 1020 O ARG A 438 7.119 6.300 1.206 1.00 0.00 O ATOM 1021 CB ARG A 438 7.104 9.674 0.746 1.00 0.00 C ATOM 1022 CG ARG A 438 7.484 9.216 -0.653 1.00 0.00 C ATOM 1023 CD ARG A 438 6.368 9.484 -1.650 1.00 0.00 C ATOM 1024 NE ARG A 438 6.541 8.722 -2.885 1.00 0.00 N ATOM 1025 CZ ARG A 438 5.844 8.944 -3.997 1.00 0.00 C ATOM 1026 NH1 ARG A 438 4.926 9.902 -4.033 1.00 0.00 N ATOM 1027 NH2 ARG A 438 6.066 8.205 -5.076 1.00 0.00 N ATOM 0 H ARG A 438 6.495 10.030 3.114 1.00 0.00 H new ATOM 0 HA ARG A 438 5.547 8.250 1.131 1.00 0.00 H new ATOM 0 HB2 ARG A 438 6.406 10.508 0.668 1.00 0.00 H new ATOM 0 HB3 ARG A 438 7.995 10.049 1.250 1.00 0.00 H new ATOM 0 HG2 ARG A 438 8.390 9.732 -0.972 1.00 0.00 H new ATOM 0 HG3 ARG A 438 7.712 8.150 -0.639 1.00 0.00 H new ATOM 0 HD2 ARG A 438 5.409 9.229 -1.198 1.00 0.00 H new ATOM 0 HD3 ARG A 438 6.338 10.549 -1.882 1.00 0.00 H new ATOM 0 HE ARG A 438 7.237 7.976 -2.895 1.00 0.00 H new ATOM 0 HH11 ARG A 438 4.752 10.473 -3.206 1.00 0.00 H new ATOM 0 HH12 ARG A 438 4.395 10.068 -4.888 1.00 0.00 H new ATOM 0 HH21 ARG A 438 6.770 7.467 -5.053 1.00 0.00 H new ATOM 0 HH22 ARG A 438 5.532 8.374 -5.929 1.00 0.00 H new ATOM 1041 N LYS A 439 8.557 7.591 2.359 1.00 0.00 N ATOM 1042 CA LYS A 439 9.541 6.527 2.530 1.00 0.00 C ATOM 1043 C LYS A 439 8.897 5.306 3.179 1.00 0.00 C ATOM 1044 O LYS A 439 9.025 4.185 2.684 1.00 0.00 O ATOM 1045 CB LYS A 439 10.712 7.017 3.384 1.00 0.00 C ATOM 1046 CG LYS A 439 12.059 6.475 2.936 1.00 0.00 C ATOM 1047 CD LYS A 439 13.172 6.893 3.884 1.00 0.00 C ATOM 1048 CE LYS A 439 14.451 7.222 3.130 1.00 0.00 C ATOM 1049 NZ LYS A 439 15.196 8.344 3.766 1.00 0.00 N ATOM 0 H LYS A 439 8.821 8.482 2.779 1.00 0.00 H new ATOM 0 HA LYS A 439 9.917 6.244 1.547 1.00 0.00 H new ATOM 0 HB2 LYS A 439 10.740 8.106 3.356 1.00 0.00 H new ATOM 0 HB3 LYS A 439 10.540 6.729 4.421 1.00 0.00 H new ATOM 0 HG2 LYS A 439 12.015 5.387 2.882 1.00 0.00 H new ATOM 0 HG3 LYS A 439 12.281 6.835 1.931 1.00 0.00 H new ATOM 0 HD2 LYS A 439 12.854 7.762 4.460 1.00 0.00 H new ATOM 0 HD3 LYS A 439 13.365 6.091 4.597 1.00 0.00 H new ATOM 0 HE2 LYS A 439 15.088 6.338 3.092 1.00 0.00 H new ATOM 0 HE3 LYS A 439 14.208 7.484 2.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 16.061 8.538 3.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 14.598 9.195 3.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 15.450 8.084 4.740 1.00 0.00 H new ATOM 1063 N GLU A 440 8.194 5.536 4.282 1.00 0.00 N ATOM 1064 CA GLU A 440 7.517 4.462 4.996 1.00 0.00 C ATOM 1065 C GLU A 440 6.430 3.844 4.122 1.00 0.00 C ATOM 1066 O GLU A 440 6.201 2.636 4.158 1.00 0.00 O ATOM 1067 CB GLU A 440 6.908 4.994 6.297 1.00 0.00 C ATOM 1068 CG GLU A 440 6.109 3.955 7.069 1.00 0.00 C ATOM 1069 CD GLU A 440 6.990 2.919 7.738 1.00 0.00 C ATOM 1070 OE1 GLU A 440 7.946 2.445 7.088 1.00 0.00 O ATOM 1071 OE2 GLU A 440 6.726 2.583 8.911 1.00 0.00 O ATOM 0 H GLU A 440 8.078 6.459 4.701 1.00 0.00 H new ATOM 0 HA GLU A 440 8.249 3.691 5.238 1.00 0.00 H new ATOM 0 HB2 GLU A 440 7.708 5.371 6.934 1.00 0.00 H new ATOM 0 HB3 GLU A 440 6.260 5.839 6.065 1.00 0.00 H new ATOM 0 HG2 GLU A 440 5.505 4.456 7.826 1.00 0.00 H new ATOM 0 HG3 GLU A 440 5.419 3.455 6.390 1.00 0.00 H new ATOM 1078 N ALA A 441 5.768 4.685 3.332 1.00 0.00 N ATOM 1079 CA ALA A 441 4.708 4.225 2.443 1.00 0.00 C ATOM 1080 C ALA A 441 5.271 3.336 1.341 1.00 0.00 C ATOM 1081 O ALA A 441 4.781 2.231 1.113 1.00 0.00 O ATOM 1082 CB ALA A 441 3.970 5.412 1.844 1.00 0.00 C ATOM 0 H ALA A 441 5.948 5.688 3.290 1.00 0.00 H new ATOM 0 HA ALA A 441 4.003 3.634 3.028 1.00 0.00 H new ATOM 0 HB1 ALA A 441 3.181 5.054 1.182 1.00 0.00 H new ATOM 0 HB2 ALA A 441 3.530 6.008 2.644 1.00 0.00 H new ATOM 0 HB3 ALA A 441 4.669 6.026 1.276 1.00 0.00 H new ATOM 1088 N VAL A 442 6.307 3.824 0.663 1.00 0.00 N ATOM 1089 CA VAL A 442 6.937 3.067 -0.412 1.00 0.00 C ATOM 1090 C VAL A 442 7.476 1.739 0.107 1.00 0.00 C ATOM 1091 O VAL A 442 7.360 0.707 -0.556 1.00 0.00 O ATOM 1092 CB VAL A 442 8.088 3.857 -1.068 1.00 0.00 C ATOM 1093 CG1 VAL A 442 8.498 3.205 -2.381 1.00 0.00 C ATOM 1094 CG2 VAL A 442 7.691 5.311 -1.285 1.00 0.00 C ATOM 0 H VAL A 442 6.726 4.737 0.839 1.00 0.00 H new ATOM 0 HA VAL A 442 6.169 2.883 -1.163 1.00 0.00 H new ATOM 0 HB VAL A 442 8.945 3.840 -0.394 1.00 0.00 H new ATOM 0 HG11 VAL A 442 9.311 3.774 -2.832 1.00 0.00 H new ATOM 0 HG12 VAL A 442 8.831 2.184 -2.192 1.00 0.00 H new ATOM 0 HG13 VAL A 442 7.646 3.189 -3.061 1.00 0.00 H new ATOM 0 HG21 VAL A 442 8.518 5.849 -1.749 1.00 0.00 H new ATOM 0 HG22 VAL A 442 6.818 5.357 -1.936 1.00 0.00 H new ATOM 0 HG23 VAL A 442 7.452 5.770 -0.326 1.00 0.00 H new ATOM 1104 N CYS A 443 8.058 1.769 1.301 1.00 0.00 N ATOM 1105 CA CYS A 443 8.602 0.565 1.912 1.00 0.00 C ATOM 1106 C CYS A 443 7.487 -0.431 2.206 1.00 0.00 C ATOM 1107 O CYS A 443 7.614 -1.622 1.926 1.00 0.00 O ATOM 1108 CB CYS A 443 9.349 0.913 3.201 1.00 0.00 C ATOM 1109 SG CYS A 443 10.110 -0.511 4.020 1.00 0.00 S ATOM 0 H CYS A 443 8.164 2.613 1.863 1.00 0.00 H new ATOM 0 HA CYS A 443 9.303 0.110 1.213 1.00 0.00 H new ATOM 0 HB2 CYS A 443 10.124 1.645 2.973 1.00 0.00 H new ATOM 0 HB3 CYS A 443 8.655 1.389 3.894 1.00 0.00 H new ATOM 0 HG CYS A 443 10.719 -0.117 5.098 1.00 0.00 H new ATOM 1115 N LYS A 444 6.392 0.072 2.768 1.00 0.00 N ATOM 1116 CA LYS A 444 5.243 -0.763 3.100 1.00 0.00 C ATOM 1117 C LYS A 444 4.641 -1.381 1.844 1.00 0.00 C ATOM 1118 O LYS A 444 4.591 -2.602 1.707 1.00 0.00 O ATOM 1119 CB LYS A 444 4.186 0.059 3.837 1.00 0.00 C ATOM 1120 CG LYS A 444 3.469 -0.713 4.933 1.00 0.00 C ATOM 1121 CD LYS A 444 4.053 -0.409 6.304 1.00 0.00 C ATOM 1122 CE LYS A 444 2.966 -0.300 7.360 1.00 0.00 C ATOM 1123 NZ LYS A 444 2.817 -1.564 8.135 1.00 0.00 N ATOM 0 H LYS A 444 6.276 1.058 3.004 1.00 0.00 H new ATOM 0 HA LYS A 444 5.584 -1.568 3.751 1.00 0.00 H new ATOM 0 HB2 LYS A 444 4.661 0.937 4.274 1.00 0.00 H new ATOM 0 HB3 LYS A 444 3.451 0.419 3.117 1.00 0.00 H new ATOM 0 HG2 LYS A 444 2.409 -0.460 4.924 1.00 0.00 H new ATOM 0 HG3 LYS A 444 3.543 -1.782 4.734 1.00 0.00 H new ATOM 0 HD2 LYS A 444 4.756 -1.194 6.583 1.00 0.00 H new ATOM 0 HD3 LYS A 444 4.616 0.523 6.262 1.00 0.00 H new ATOM 0 HE2 LYS A 444 3.202 0.518 8.041 1.00 0.00 H new ATOM 0 HE3 LYS A 444 2.018 -0.053 6.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 1.870 -1.599 8.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 2.939 -2.378 7.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 3.538 -1.599 8.884 1.00 0.00 H new ATOM 1137 N ILE A 445 4.185 -0.531 0.922 1.00 0.00 N ATOM 1138 CA ILE A 445 3.589 -1.010 -0.324 1.00 0.00 C ATOM 1139 C ILE A 445 4.489 -2.043 -0.991 1.00 0.00 C ATOM 1140 O ILE A 445 4.032 -3.116 -1.389 1.00 0.00 O ATOM 1141 CB ILE A 445 3.320 0.144 -1.311 1.00 0.00 C ATOM 1142 CG1 ILE A 445 4.563 1.022 -1.468 1.00 0.00 C ATOM 1143 CG2 ILE A 445 2.135 0.975 -0.842 1.00 0.00 C ATOM 1144 CD1 ILE A 445 5.372 0.706 -2.707 1.00 0.00 C ATOM 0 H ILE A 445 4.217 0.484 1.014 1.00 0.00 H new ATOM 0 HA ILE A 445 2.636 -1.470 -0.063 1.00 0.00 H new ATOM 0 HB ILE A 445 3.081 -0.284 -2.284 1.00 0.00 H new ATOM 0 HG12 ILE A 445 4.258 2.068 -1.500 1.00 0.00 H new ATOM 0 HG13 ILE A 445 5.197 0.902 -0.589 1.00 0.00 H new ATOM 0 HG21 ILE A 445 1.957 1.786 -1.548 1.00 0.00 H new ATOM 0 HG22 ILE A 445 1.248 0.344 -0.783 1.00 0.00 H new ATOM 0 HG23 ILE A 445 2.350 1.392 0.142 1.00 0.00 H new ATOM 0 HD11 ILE A 445 6.238 1.366 -2.754 1.00 0.00 H new ATOM 0 HD12 ILE A 445 5.707 -0.330 -2.668 1.00 0.00 H new ATOM 0 HD13 ILE A 445 4.754 0.854 -3.593 1.00 0.00 H new ATOM 1156 N GLN A 446 5.775 -1.725 -1.094 1.00 0.00 N ATOM 1157 CA GLN A 446 6.738 -2.640 -1.692 1.00 0.00 C ATOM 1158 C GLN A 446 6.927 -3.855 -0.789 1.00 0.00 C ATOM 1159 O GLN A 446 7.190 -4.961 -1.259 1.00 0.00 O ATOM 1160 CB GLN A 446 8.078 -1.939 -1.917 1.00 0.00 C ATOM 1161 CG GLN A 446 9.139 -2.835 -2.534 1.00 0.00 C ATOM 1162 CD GLN A 446 8.885 -3.113 -4.003 1.00 0.00 C ATOM 1163 OE1 GLN A 446 9.274 -2.331 -4.872 1.00 0.00 O ATOM 1164 NE2 GLN A 446 8.229 -4.232 -4.289 1.00 0.00 N ATOM 0 H GLN A 446 6.173 -0.843 -0.772 1.00 0.00 H new ATOM 0 HA GLN A 446 6.355 -2.968 -2.658 1.00 0.00 H new ATOM 0 HB2 GLN A 446 7.922 -1.076 -2.564 1.00 0.00 H new ATOM 0 HB3 GLN A 446 8.445 -1.560 -0.963 1.00 0.00 H new ATOM 0 HG2 GLN A 446 10.116 -2.366 -2.420 1.00 0.00 H new ATOM 0 HG3 GLN A 446 9.173 -3.779 -1.990 1.00 0.00 H new ATOM 0 HE21 GLN A 446 7.925 -4.851 -3.538 1.00 0.00 H new ATOM 0 HE22 GLN A 446 8.029 -4.472 -5.260 1.00 0.00 H new ATOM 1173 N ALA A 447 6.778 -3.633 0.515 1.00 0.00 N ATOM 1174 CA ALA A 447 6.917 -4.697 1.497 1.00 0.00 C ATOM 1175 C ALA A 447 5.765 -5.690 1.383 1.00 0.00 C ATOM 1176 O ALA A 447 5.974 -6.902 1.371 1.00 0.00 O ATOM 1177 CB ALA A 447 6.976 -4.109 2.900 1.00 0.00 C ATOM 0 H ALA A 447 6.560 -2.720 0.914 1.00 0.00 H new ATOM 0 HA ALA A 447 7.847 -5.231 1.300 1.00 0.00 H new ATOM 0 HB1 ALA A 447 7.080 -4.914 3.628 1.00 0.00 H new ATOM 0 HB2 ALA A 447 7.831 -3.437 2.977 1.00 0.00 H new ATOM 0 HB3 ALA A 447 6.059 -3.554 3.101 1.00 0.00 H new ATOM 1183 N ILE A 448 4.549 -5.161 1.294 1.00 0.00 N ATOM 1184 CA ILE A 448 3.357 -5.991 1.174 1.00 0.00 C ATOM 1185 C ILE A 448 3.344 -6.729 -0.162 1.00 0.00 C ATOM 1186 O ILE A 448 2.958 -7.896 -0.233 1.00 0.00 O ATOM 1187 CB ILE A 448 2.072 -5.145 1.309 1.00 0.00 C ATOM 1188 CG1 ILE A 448 0.825 -6.020 1.153 1.00 0.00 C ATOM 1189 CG2 ILE A 448 2.064 -4.022 0.285 1.00 0.00 C ATOM 1190 CD1 ILE A 448 -0.463 -5.283 1.443 1.00 0.00 C ATOM 0 H ILE A 448 4.364 -4.158 1.303 1.00 0.00 H new ATOM 0 HA ILE A 448 3.383 -6.719 1.985 1.00 0.00 H new ATOM 0 HB ILE A 448 2.058 -4.706 2.306 1.00 0.00 H new ATOM 0 HG12 ILE A 448 0.790 -6.413 0.137 1.00 0.00 H new ATOM 0 HG13 ILE A 448 0.904 -6.876 1.823 1.00 0.00 H new ATOM 0 HG21 ILE A 448 1.151 -3.436 0.395 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.929 -3.379 0.444 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.105 -4.445 -0.719 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -1.307 -5.961 1.314 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.448 -4.914 2.468 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.564 -4.443 0.756 1.00 0.00 H new ATOM 1202 N LEU A 449 3.775 -6.042 -1.215 1.00 0.00 N ATOM 1203 CA LEU A 449 3.817 -6.636 -2.546 1.00 0.00 C ATOM 1204 C LEU A 449 4.804 -7.797 -2.587 1.00 0.00 C ATOM 1205 O LEU A 449 4.465 -8.900 -3.019 1.00 0.00 O ATOM 1206 CB LEU A 449 4.201 -5.581 -3.587 1.00 0.00 C ATOM 1207 CG LEU A 449 3.325 -5.559 -4.841 1.00 0.00 C ATOM 1208 CD1 LEU A 449 1.898 -5.167 -4.487 1.00 0.00 C ATOM 1209 CD2 LEU A 449 3.900 -4.605 -5.876 1.00 0.00 C ATOM 0 H LEU A 449 4.099 -5.076 -1.173 1.00 0.00 H new ATOM 0 HA LEU A 449 2.824 -7.018 -2.781 1.00 0.00 H new ATOM 0 HB2 LEU A 449 4.161 -4.598 -3.117 1.00 0.00 H new ATOM 0 HB3 LEU A 449 5.235 -5.749 -3.888 1.00 0.00 H new ATOM 0 HG LEU A 449 3.310 -6.561 -5.269 1.00 0.00 H new ATOM 0 HD11 LEU A 449 1.289 -5.156 -5.391 1.00 0.00 H new ATOM 0 HD12 LEU A 449 1.487 -5.888 -3.781 1.00 0.00 H new ATOM 0 HD13 LEU A 449 1.895 -4.175 -4.035 1.00 0.00 H new ATOM 0 HD21 LEU A 449 3.264 -4.602 -6.761 1.00 0.00 H new ATOM 0 HD22 LEU A 449 3.945 -3.599 -5.458 1.00 0.00 H new ATOM 0 HD23 LEU A 449 4.904 -4.929 -6.151 1.00 0.00 H new ATOM 1221 N GLU A 450 6.026 -7.544 -2.127 1.00 0.00 N ATOM 1222 CA GLU A 450 7.061 -8.571 -2.106 1.00 0.00 C ATOM 1223 C GLU A 450 6.636 -9.744 -1.229 1.00 0.00 C ATOM 1224 O GLU A 450 6.836 -10.904 -1.587 1.00 0.00 O ATOM 1225 CB GLU A 450 8.379 -7.987 -1.596 1.00 0.00 C ATOM 1226 CG GLU A 450 9.603 -8.782 -2.021 1.00 0.00 C ATOM 1227 CD GLU A 450 10.165 -9.631 -0.898 1.00 0.00 C ATOM 1228 OE1 GLU A 450 9.543 -10.661 -0.563 1.00 0.00 O ATOM 1229 OE2 GLU A 450 11.229 -9.265 -0.354 1.00 0.00 O ATOM 0 H GLU A 450 6.323 -6.638 -1.764 1.00 0.00 H new ATOM 0 HA GLU A 450 7.205 -8.932 -3.124 1.00 0.00 H new ATOM 0 HB2 GLU A 450 8.477 -6.964 -1.958 1.00 0.00 H new ATOM 0 HB3 GLU A 450 8.348 -7.938 -0.508 1.00 0.00 H new ATOM 0 HG2 GLU A 450 9.340 -9.425 -2.861 1.00 0.00 H new ATOM 0 HG3 GLU A 450 10.373 -8.096 -2.373 1.00 0.00 H new ATOM 1236 N LYS A 451 6.045 -9.431 -0.079 1.00 0.00 N ATOM 1237 CA LYS A 451 5.587 -10.459 0.848 1.00 0.00 C ATOM 1238 C LYS A 451 4.550 -11.360 0.186 1.00 0.00 C ATOM 1239 O LYS A 451 4.609 -12.583 0.304 1.00 0.00 O ATOM 1240 CB LYS A 451 4.994 -9.816 2.104 1.00 0.00 C ATOM 1241 CG LYS A 451 5.114 -10.685 3.345 1.00 0.00 C ATOM 1242 CD LYS A 451 6.330 -10.306 4.176 1.00 0.00 C ATOM 1243 CE LYS A 451 6.033 -10.385 5.665 1.00 0.00 C ATOM 1244 NZ LYS A 451 5.340 -9.162 6.159 1.00 0.00 N ATOM 0 H LYS A 451 5.873 -8.475 0.232 1.00 0.00 H new ATOM 0 HA LYS A 451 6.445 -11.068 1.132 1.00 0.00 H new ATOM 0 HB2 LYS A 451 5.494 -8.865 2.286 1.00 0.00 H new ATOM 0 HB3 LYS A 451 3.942 -9.594 1.926 1.00 0.00 H new ATOM 0 HG2 LYS A 451 4.213 -10.584 3.950 1.00 0.00 H new ATOM 0 HG3 LYS A 451 5.185 -11.732 3.051 1.00 0.00 H new ATOM 0 HD2 LYS A 451 7.159 -10.970 3.933 1.00 0.00 H new ATOM 0 HD3 LYS A 451 6.646 -9.295 3.920 1.00 0.00 H new ATOM 0 HE2 LYS A 451 5.414 -11.259 5.866 1.00 0.00 H new ATOM 0 HE3 LYS A 451 6.965 -10.521 6.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 5.155 -9.255 7.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 5.941 -8.330 5.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 4.439 -9.045 5.653 1.00 0.00 H new ATOM 1258 N LEU A 452 3.601 -10.746 -0.514 1.00 0.00 N ATOM 1259 CA LEU A 452 2.553 -11.493 -1.198 1.00 0.00 C ATOM 1260 C LEU A 452 3.147 -12.387 -2.281 1.00 0.00 C ATOM 1261 O LEU A 452 2.772 -13.551 -2.414 1.00 0.00 O ATOM 1262 CB LEU A 452 1.526 -10.535 -1.811 1.00 0.00 C ATOM 1263 CG LEU A 452 0.087 -10.727 -1.328 1.00 0.00 C ATOM 1264 CD1 LEU A 452 -0.867 -9.866 -2.139 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.314 -12.193 -1.409 1.00 0.00 C ATOM 0 H LEU A 452 3.537 -9.734 -0.622 1.00 0.00 H new ATOM 0 HA LEU A 452 2.051 -12.124 -0.464 1.00 0.00 H new ATOM 0 HB2 LEU A 452 1.832 -9.512 -1.593 1.00 0.00 H new ATOM 0 HB3 LEU A 452 1.547 -10.650 -2.895 1.00 0.00 H new ATOM 0 HG LEU A 452 0.030 -10.414 -0.285 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -1.886 -10.016 -1.781 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -0.594 -8.817 -2.028 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.807 -10.147 -3.190 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -1.340 -12.309 -1.061 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -0.240 -12.534 -2.442 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.351 -12.787 -0.782 1.00 0.00 H new ATOM 1277 N GLU A 453 4.078 -11.834 -3.051 1.00 0.00 N ATOM 1278 CA GLU A 453 4.728 -12.581 -4.121 1.00 0.00 C ATOM 1279 C GLU A 453 5.467 -13.793 -3.566 1.00 0.00 C ATOM 1280 O GLU A 453 5.447 -14.872 -4.157 1.00 0.00 O ATOM 1281 CB GLU A 453 5.702 -11.680 -4.883 1.00 0.00 C ATOM 1282 CG GLU A 453 5.072 -10.964 -6.065 1.00 0.00 C ATOM 1283 CD GLU A 453 5.366 -11.649 -7.386 1.00 0.00 C ATOM 1284 OE1 GLU A 453 5.176 -12.882 -7.471 1.00 0.00 O ATOM 1285 OE2 GLU A 453 5.786 -10.955 -8.335 1.00 0.00 O ATOM 0 H GLU A 453 4.399 -10.871 -2.954 1.00 0.00 H new ATOM 0 HA GLU A 453 3.956 -12.931 -4.807 1.00 0.00 H new ATOM 0 HB2 GLU A 453 6.111 -10.939 -4.196 1.00 0.00 H new ATOM 0 HB3 GLU A 453 6.539 -12.282 -5.238 1.00 0.00 H new ATOM 0 HG2 GLU A 453 3.993 -10.911 -5.920 1.00 0.00 H new ATOM 0 HG3 GLU A 453 5.440 -9.939 -6.102 1.00 0.00 H new ATOM 1292 N LYS A 454 6.120 -13.607 -2.421 1.00 0.00 N ATOM 1293 CA LYS A 454 6.866 -14.684 -1.783 1.00 0.00 C ATOM 1294 C LYS A 454 5.922 -15.676 -1.110 1.00 0.00 C ATOM 1295 O LYS A 454 6.225 -16.866 -1.011 1.00 0.00 O ATOM 1296 CB LYS A 454 7.846 -14.116 -0.756 1.00 0.00 C ATOM 1297 CG LYS A 454 9.199 -13.749 -1.342 1.00 0.00 C ATOM 1298 CD LYS A 454 10.175 -14.912 -1.262 1.00 0.00 C ATOM 1299 CE LYS A 454 10.260 -15.658 -2.585 1.00 0.00 C ATOM 1300 NZ LYS A 454 10.941 -14.851 -3.634 1.00 0.00 N ATOM 0 H LYS A 454 6.146 -12.720 -1.918 1.00 0.00 H new ATOM 0 HA LYS A 454 7.426 -15.211 -2.555 1.00 0.00 H new ATOM 0 HB2 LYS A 454 7.406 -13.230 -0.298 1.00 0.00 H new ATOM 0 HB3 LYS A 454 7.990 -14.848 0.039 1.00 0.00 H new ATOM 0 HG2 LYS A 454 9.076 -13.447 -2.382 1.00 0.00 H new ATOM 0 HG3 LYS A 454 9.608 -12.892 -0.807 1.00 0.00 H new ATOM 0 HD2 LYS A 454 11.163 -14.542 -0.987 1.00 0.00 H new ATOM 0 HD3 LYS A 454 9.862 -15.598 -0.475 1.00 0.00 H new ATOM 0 HE2 LYS A 454 10.799 -16.594 -2.440 1.00 0.00 H new ATOM 0 HE3 LYS A 454 9.256 -15.917 -2.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 11.296 -15.481 -4.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 10.266 -14.174 -4.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 11.737 -14.333 -3.211 1.00 0.00 H new ATOM 1314 N LYS A 455 4.780 -15.178 -0.647 1.00 0.00 N ATOM 1315 CA LYS A 455 3.793 -16.021 0.017 1.00 0.00 C ATOM 1316 C LYS A 455 2.695 -16.449 -0.953 1.00 0.00 C ATOM 1317 O LYS A 455 1.574 -16.751 -0.541 1.00 0.00 O ATOM 1318 CB LYS A 455 3.178 -15.280 1.206 1.00 0.00 C ATOM 1319 CG LYS A 455 2.462 -16.194 2.188 1.00 0.00 C ATOM 1320 CD LYS A 455 0.973 -15.890 2.254 1.00 0.00 C ATOM 1321 CE LYS A 455 0.418 -16.128 3.648 1.00 0.00 C ATOM 1322 NZ LYS A 455 0.123 -17.566 3.891 1.00 0.00 N ATOM 0 H LYS A 455 4.516 -14.196 -0.719 1.00 0.00 H new ATOM 0 HA LYS A 455 4.301 -16.916 0.376 1.00 0.00 H new ATOM 0 HB2 LYS A 455 3.964 -14.739 1.733 1.00 0.00 H new ATOM 0 HB3 LYS A 455 2.473 -14.536 0.835 1.00 0.00 H new ATOM 0 HG2 LYS A 455 2.609 -17.233 1.892 1.00 0.00 H new ATOM 0 HG3 LYS A 455 2.901 -16.080 3.179 1.00 0.00 H new ATOM 0 HD2 LYS A 455 0.799 -14.854 1.964 1.00 0.00 H new ATOM 0 HD3 LYS A 455 0.441 -16.516 1.537 1.00 0.00 H new ATOM 0 HE2 LYS A 455 1.135 -15.774 4.389 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -0.492 -15.543 3.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 0.356 -17.807 4.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -0.887 -17.747 3.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 0.693 -18.151 3.247 1.00 0.00 H new ATOM 1336 N GLY A 456 3.021 -16.472 -2.242 1.00 0.00 N ATOM 1337 CA GLY A 456 2.050 -16.865 -3.246 1.00 0.00 C ATOM 1338 C GLY A 456 2.464 -18.117 -3.996 1.00 0.00 C ATOM 1339 O GLY A 456 2.863 -17.999 -5.174 1.00 0.00 O ATOM 1340 OXT GLY A 456 2.389 -19.215 -3.405 1.00 0.00 O ATOM 0 H GLY A 456 3.940 -16.225 -2.609 1.00 0.00 H new ATOM 0 HA2 GLY A 456 1.086 -17.034 -2.767 1.00 0.00 H new ATOM 0 HA3 GLY A 456 1.915 -16.048 -3.955 1.00 0.00 H new