USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 677 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 379 SER OG : rot 180:sc= 0 USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 HIS : no HD1:sc= -0.242 X(o=-0.24,f=-0.061) USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 391 GLN : amide:sc= -2.05 K(o=-2,f=-2.7!) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 403 LYS NZ :NH3+ 154:sc= 0.0025 (180deg=0) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot -15:sc= 0.157 USER MOD Single : A 407 LYS NZ :NH3+ -170:sc=-0.00625 (180deg=-0.107) 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 76:sc= 0.984 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 80:sc= -0.842 USER MOD Single : A 431 GLN : amide:sc= -0.164 X(o=-0.16,f=-0.01) USER MOD Single : A 433 SER OG : rot 180:sc=-0.00712 USER MOD Single : A 436 GLN : amide:sc= -0.0433 X(o=-0.043,f=0) USER MOD Single : A 439 LYS NZ :NH3+ 151:sc= -0.313 (180deg=-1.34!) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.317 X(o=-0.32,f=-0.012) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ 152:sc= -0.333 (180deg=-1.11) USER MOD Single : A 455 LYS NZ :NH3+ -165:sc= -0.916 (180deg=-1.23) USER MOD ----------------------------------------------------------------- ATOM 112 N SER A 379 4.308 23.921 -4.702 1.00 0.00 N ATOM 113 CA SER A 379 4.139 22.981 -3.597 1.00 0.00 C ATOM 114 C SER A 379 3.014 21.996 -3.862 1.00 0.00 C ATOM 115 O SER A 379 3.032 20.873 -3.357 1.00 0.00 O ATOM 116 CB SER A 379 3.893 23.726 -2.285 1.00 0.00 C ATOM 117 OG SER A 379 3.605 22.824 -1.231 1.00 0.00 O ATOM 0 HA SER A 379 5.065 22.413 -3.511 1.00 0.00 H new ATOM 0 HB2 SER A 379 4.771 24.319 -2.030 1.00 0.00 H new ATOM 0 HB3 SER A 379 3.063 24.422 -2.409 1.00 0.00 H new ATOM 0 HG SER A 379 3.453 23.326 -0.403 1.00 0.00 H new ATOM 123 N ILE A 380 2.056 22.399 -4.676 1.00 0.00 N ATOM 124 CA ILE A 380 0.952 21.525 -5.024 1.00 0.00 C ATOM 125 C ILE A 380 1.496 20.259 -5.678 1.00 0.00 C ATOM 126 O ILE A 380 0.903 19.185 -5.574 1.00 0.00 O ATOM 127 CB ILE A 380 -0.052 22.223 -5.965 1.00 0.00 C ATOM 128 CG1 ILE A 380 -0.738 23.373 -5.229 1.00 0.00 C ATOM 129 CG2 ILE A 380 -1.087 21.235 -6.488 1.00 0.00 C ATOM 130 CD1 ILE A 380 -1.589 22.921 -4.061 1.00 0.00 C ATOM 0 H ILE A 380 2.020 23.323 -5.107 1.00 0.00 H new ATOM 0 HA ILE A 380 0.417 21.268 -4.110 1.00 0.00 H new ATOM 0 HB ILE A 380 0.494 22.621 -6.820 1.00 0.00 H new ATOM 0 HG12 ILE A 380 0.021 24.067 -4.868 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -1.363 23.922 -5.933 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -1.783 21.752 -7.149 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -0.585 20.440 -7.040 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.635 20.804 -5.650 1.00 0.00 H new ATOM 0 HD11 ILE A 380 -2.045 23.789 -3.586 1.00 0.00 H new ATOM 0 HD12 ILE A 380 -2.371 22.250 -4.418 1.00 0.00 H new ATOM 0 HD13 ILE A 380 -0.965 22.397 -3.337 1.00 0.00 H new ATOM 142 N LYS A 381 2.636 20.401 -6.351 1.00 0.00 N ATOM 143 CA LYS A 381 3.273 19.276 -7.027 1.00 0.00 C ATOM 144 C LYS A 381 3.558 18.140 -6.049 1.00 0.00 C ATOM 145 O LYS A 381 3.506 16.966 -6.416 1.00 0.00 O ATOM 146 CB LYS A 381 4.575 19.728 -7.693 1.00 0.00 C ATOM 147 CG LYS A 381 4.370 20.769 -8.781 1.00 0.00 C ATOM 148 CD LYS A 381 5.680 21.444 -9.162 1.00 0.00 C ATOM 149 CE LYS A 381 6.106 21.080 -10.576 1.00 0.00 C ATOM 150 NZ LYS A 381 7.571 20.834 -10.670 1.00 0.00 N ATOM 0 H LYS A 381 3.137 21.285 -6.442 1.00 0.00 H new ATOM 0 HA LYS A 381 2.587 18.909 -7.791 1.00 0.00 H new ATOM 0 HB2 LYS A 381 5.241 20.136 -6.932 1.00 0.00 H new ATOM 0 HB3 LYS A 381 5.075 18.860 -8.122 1.00 0.00 H new ATOM 0 HG2 LYS A 381 3.934 20.296 -9.661 1.00 0.00 H new ATOM 0 HG3 LYS A 381 3.659 21.520 -8.438 1.00 0.00 H new ATOM 0 HD2 LYS A 381 5.570 22.525 -9.081 1.00 0.00 H new ATOM 0 HD3 LYS A 381 6.460 21.150 -8.459 1.00 0.00 H new ATOM 0 HE2 LYS A 381 5.567 20.189 -10.899 1.00 0.00 H new ATOM 0 HE3 LYS A 381 5.829 21.885 -11.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 7.820 20.589 -11.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 8.086 21.692 -10.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 7.832 20.049 -10.040 1.00 0.00 H new ATOM 164 N LYS A 382 3.860 18.493 -4.803 1.00 0.00 N ATOM 165 CA LYS A 382 4.152 17.496 -3.781 1.00 0.00 C ATOM 166 C LYS A 382 2.918 16.675 -3.460 1.00 0.00 C ATOM 167 O LYS A 382 2.994 15.464 -3.253 1.00 0.00 O ATOM 168 CB LYS A 382 4.694 18.159 -2.514 1.00 0.00 C ATOM 169 CG LYS A 382 5.900 19.052 -2.762 1.00 0.00 C ATOM 170 CD LYS A 382 7.027 18.755 -1.786 1.00 0.00 C ATOM 171 CE LYS A 382 7.950 19.951 -1.621 1.00 0.00 C ATOM 172 NZ LYS A 382 8.960 19.729 -0.549 1.00 0.00 N ATOM 0 H LYS A 382 3.909 19.459 -4.478 1.00 0.00 H new ATOM 0 HA LYS A 382 4.918 16.827 -4.174 1.00 0.00 H new ATOM 0 HB2 LYS A 382 3.902 18.752 -2.057 1.00 0.00 H new ATOM 0 HB3 LYS A 382 4.967 17.385 -1.797 1.00 0.00 H new ATOM 0 HG2 LYS A 382 6.255 18.910 -3.783 1.00 0.00 H new ATOM 0 HG3 LYS A 382 5.604 20.097 -2.670 1.00 0.00 H new ATOM 0 HD2 LYS A 382 6.608 18.481 -0.818 1.00 0.00 H new ATOM 0 HD3 LYS A 382 7.600 17.898 -2.140 1.00 0.00 H new ATOM 0 HE2 LYS A 382 8.459 20.150 -2.564 1.00 0.00 H new ATOM 0 HE3 LYS A 382 7.359 20.836 -1.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 9.570 20.567 -0.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 8.475 19.565 0.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 9.541 18.900 -0.786 1.00 0.00 H new ATOM 186 N ILE A 383 1.780 17.340 -3.445 1.00 0.00 N ATOM 187 CA ILE A 383 0.515 16.674 -3.177 1.00 0.00 C ATOM 188 C ILE A 383 0.273 15.609 -4.236 1.00 0.00 C ATOM 189 O ILE A 383 -0.252 14.532 -3.953 1.00 0.00 O ATOM 190 CB ILE A 383 -0.665 17.668 -3.174 1.00 0.00 C ATOM 191 CG1 ILE A 383 -0.390 18.819 -2.204 1.00 0.00 C ATOM 192 CG2 ILE A 383 -1.961 16.959 -2.806 1.00 0.00 C ATOM 193 CD1 ILE A 383 -1.121 20.095 -2.560 1.00 0.00 C ATOM 0 H ILE A 383 1.702 18.343 -3.615 1.00 0.00 H new ATOM 0 HA ILE A 383 0.576 16.221 -2.187 1.00 0.00 H new ATOM 0 HB ILE A 383 -0.772 18.079 -4.178 1.00 0.00 H new ATOM 0 HG12 ILE A 383 -0.678 18.513 -1.198 1.00 0.00 H new ATOM 0 HG13 ILE A 383 0.682 19.017 -2.182 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -2.782 17.676 -2.809 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -2.164 16.172 -3.532 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -1.866 16.520 -1.813 1.00 0.00 H new ATOM 0 HD11 ILE A 383 -0.880 20.868 -1.830 1.00 0.00 H new ATOM 0 HD12 ILE A 383 -0.815 20.425 -3.553 1.00 0.00 H new ATOM 0 HD13 ILE A 383 -2.196 19.913 -2.554 1.00 0.00 H new ATOM 205 N ILE A 384 0.695 15.921 -5.455 1.00 0.00 N ATOM 206 CA ILE A 384 0.568 14.998 -6.578 1.00 0.00 C ATOM 207 C ILE A 384 1.606 13.899 -6.453 1.00 0.00 C ATOM 208 O ILE A 384 1.315 12.717 -6.643 1.00 0.00 O ATOM 209 CB ILE A 384 0.788 15.698 -7.939 1.00 0.00 C ATOM 210 CG1 ILE A 384 0.659 17.215 -7.814 1.00 0.00 C ATOM 211 CG2 ILE A 384 -0.187 15.171 -8.977 1.00 0.00 C ATOM 212 CD1 ILE A 384 -0.672 17.665 -7.252 1.00 0.00 C ATOM 0 H ILE A 384 1.131 16.812 -5.693 1.00 0.00 H new ATOM 0 HA ILE A 384 -0.445 14.598 -6.547 1.00 0.00 H new ATOM 0 HB ILE A 384 1.803 15.472 -8.264 1.00 0.00 H new ATOM 0 HG12 ILE A 384 1.459 17.588 -7.174 1.00 0.00 H new ATOM 0 HG13 ILE A 384 0.800 17.666 -8.796 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -0.015 15.677 -9.927 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -0.038 14.099 -9.104 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -1.208 15.359 -8.645 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -0.692 18.753 -7.192 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -1.476 17.323 -7.903 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -0.807 17.244 -6.256 1.00 0.00 H new ATOM 224 N HIS A 385 2.823 14.313 -6.128 1.00 0.00 N ATOM 225 CA HIS A 385 3.935 13.381 -5.968 1.00 0.00 C ATOM 226 C HIS A 385 3.620 12.336 -4.902 1.00 0.00 C ATOM 227 O HIS A 385 3.785 11.136 -5.126 1.00 0.00 O ATOM 228 CB HIS A 385 5.211 14.137 -5.591 1.00 0.00 C ATOM 229 CG HIS A 385 5.994 14.618 -6.773 1.00 0.00 C ATOM 230 ND1 HIS A 385 6.702 15.795 -6.731 1.00 0.00 N ATOM 231 CD2 HIS A 385 6.151 14.050 -7.993 1.00 0.00 C ATOM 232 CE1 HIS A 385 7.270 15.919 -7.917 1.00 0.00 C ATOM 233 NE2 HIS A 385 6.965 14.885 -8.716 1.00 0.00 N ATOM 0 H HIS A 385 3.068 15.290 -5.969 1.00 0.00 H new ATOM 0 HA HIS A 385 4.088 12.871 -6.919 1.00 0.00 H new ATOM 0 HB2 HIS A 385 4.946 14.992 -4.969 1.00 0.00 H new ATOM 0 HB3 HIS A 385 5.844 13.487 -4.987 1.00 0.00 H new ATOM 0 HD2 HIS A 385 5.719 13.120 -8.331 1.00 0.00 H new ATOM 0 HE1 HIS A 385 7.900 16.747 -8.207 1.00 0.00 H new ATOM 0 HE2 HIS A 385 7.278 14.746 -9.677 1.00 0.00 H new ATOM 241 N VAL A 386 3.164 12.798 -3.742 1.00 0.00 N ATOM 242 CA VAL A 386 2.825 11.903 -2.644 1.00 0.00 C ATOM 243 C VAL A 386 1.582 11.083 -2.969 1.00 0.00 C ATOM 244 O VAL A 386 1.555 9.870 -2.761 1.00 0.00 O ATOM 245 CB VAL A 386 2.594 12.680 -1.334 1.00 0.00 C ATOM 246 CG1 VAL A 386 2.353 11.721 -0.176 1.00 0.00 C ATOM 247 CG2 VAL A 386 3.777 13.594 -1.041 1.00 0.00 C ATOM 0 H VAL A 386 3.021 13.787 -3.539 1.00 0.00 H new ATOM 0 HA VAL A 386 3.673 11.231 -2.509 1.00 0.00 H new ATOM 0 HB VAL A 386 1.704 13.299 -1.453 1.00 0.00 H new ATOM 0 HG11 VAL A 386 2.192 12.290 0.740 1.00 0.00 H new ATOM 0 HG12 VAL A 386 1.473 11.112 -0.385 1.00 0.00 H new ATOM 0 HG13 VAL A 386 3.221 11.073 -0.053 1.00 0.00 H new ATOM 0 HG21 VAL A 386 3.597 14.135 -0.112 1.00 0.00 H new ATOM 0 HG22 VAL A 386 4.683 12.996 -0.943 1.00 0.00 H new ATOM 0 HG23 VAL A 386 3.898 14.305 -1.858 1.00 0.00 H new ATOM 257 N LEU A 387 0.552 11.749 -3.485 1.00 0.00 N ATOM 258 CA LEU A 387 -0.688 11.069 -3.840 1.00 0.00 C ATOM 259 C LEU A 387 -0.436 10.034 -4.926 1.00 0.00 C ATOM 260 O LEU A 387 -1.029 8.955 -4.922 1.00 0.00 O ATOM 261 CB LEU A 387 -1.741 12.076 -4.307 1.00 0.00 C ATOM 262 CG LEU A 387 -3.167 11.527 -4.392 1.00 0.00 C ATOM 263 CD1 LEU A 387 -4.174 12.587 -3.972 1.00 0.00 C ATOM 264 CD2 LEU A 387 -3.463 11.037 -5.802 1.00 0.00 C ATOM 0 H LEU A 387 0.552 12.753 -3.665 1.00 0.00 H new ATOM 0 HA LEU A 387 -1.063 10.560 -2.952 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.735 12.927 -3.626 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.453 12.451 -5.289 1.00 0.00 H new ATOM 0 HG LEU A 387 -3.254 10.683 -3.708 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -5.182 12.178 -4.039 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -3.974 12.892 -2.945 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -4.089 13.451 -4.631 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -4.481 10.650 -5.846 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -3.359 11.864 -6.504 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -2.762 10.246 -6.067 1.00 0.00 H new ATOM 276 N GLU A 388 0.463 10.363 -5.842 1.00 0.00 N ATOM 277 CA GLU A 388 0.814 9.458 -6.924 1.00 0.00 C ATOM 278 C GLU A 388 1.435 8.190 -6.353 1.00 0.00 C ATOM 279 O GLU A 388 1.244 7.094 -6.881 1.00 0.00 O ATOM 280 CB GLU A 388 1.787 10.129 -7.894 1.00 0.00 C ATOM 281 CG GLU A 388 1.100 10.889 -9.017 1.00 0.00 C ATOM 282 CD GLU A 388 0.215 9.999 -9.867 1.00 0.00 C ATOM 283 OE1 GLU A 388 0.755 9.272 -10.728 1.00 0.00 O ATOM 284 OE2 GLU A 388 -1.018 10.028 -9.672 1.00 0.00 O ATOM 0 H GLU A 388 0.963 11.252 -5.857 1.00 0.00 H new ATOM 0 HA GLU A 388 -0.092 9.200 -7.472 1.00 0.00 H new ATOM 0 HB2 GLU A 388 2.425 10.817 -7.338 1.00 0.00 H new ATOM 0 HB3 GLU A 388 2.438 9.369 -8.326 1.00 0.00 H new ATOM 0 HG2 GLU A 388 0.499 11.693 -8.592 1.00 0.00 H new ATOM 0 HG3 GLU A 388 1.855 11.355 -9.650 1.00 0.00 H new ATOM 291 N LYS A 389 2.180 8.354 -5.265 1.00 0.00 N ATOM 292 CA LYS A 389 2.834 7.229 -4.606 1.00 0.00 C ATOM 293 C LYS A 389 1.808 6.331 -3.923 1.00 0.00 C ATOM 294 O LYS A 389 1.955 5.110 -3.900 1.00 0.00 O ATOM 295 CB LYS A 389 3.852 7.733 -3.581 1.00 0.00 C ATOM 296 CG LYS A 389 4.796 6.652 -3.078 1.00 0.00 C ATOM 297 CD LYS A 389 6.191 6.808 -3.667 1.00 0.00 C ATOM 298 CE LYS A 389 6.427 5.830 -4.807 1.00 0.00 C ATOM 299 NZ LYS A 389 7.601 6.218 -5.637 1.00 0.00 N ATOM 0 H LYS A 389 2.346 9.257 -4.820 1.00 0.00 H new ATOM 0 HA LYS A 389 3.354 6.645 -5.366 1.00 0.00 H new ATOM 0 HB2 LYS A 389 4.438 8.536 -4.028 1.00 0.00 H new ATOM 0 HB3 LYS A 389 3.319 8.162 -2.732 1.00 0.00 H new ATOM 0 HG2 LYS A 389 4.853 6.695 -1.990 1.00 0.00 H new ATOM 0 HG3 LYS A 389 4.398 5.671 -3.338 1.00 0.00 H new ATOM 0 HD2 LYS A 389 6.323 7.828 -4.028 1.00 0.00 H new ATOM 0 HD3 LYS A 389 6.936 6.647 -2.888 1.00 0.00 H new ATOM 0 HE2 LYS A 389 6.584 4.830 -4.401 1.00 0.00 H new ATOM 0 HE3 LYS A 389 5.538 5.783 -5.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 7.728 5.526 -6.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 7.441 7.161 -6.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 8.455 6.238 -5.043 1.00 0.00 H new ATOM 313 N VAL A 390 0.767 6.948 -3.369 1.00 0.00 N ATOM 314 CA VAL A 390 -0.285 6.204 -2.686 1.00 0.00 C ATOM 315 C VAL A 390 -1.073 5.344 -3.667 1.00 0.00 C ATOM 316 O VAL A 390 -1.323 4.166 -3.413 1.00 0.00 O ATOM 317 CB VAL A 390 -1.258 7.148 -1.953 1.00 0.00 C ATOM 318 CG1 VAL A 390 -2.188 6.356 -1.047 1.00 0.00 C ATOM 319 CG2 VAL A 390 -0.493 8.199 -1.160 1.00 0.00 C ATOM 0 H VAL A 390 0.631 7.959 -3.380 1.00 0.00 H new ATOM 0 HA VAL A 390 0.206 5.562 -1.954 1.00 0.00 H new ATOM 0 HB VAL A 390 -1.865 7.663 -2.698 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -2.868 7.039 -0.537 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -2.764 5.649 -1.645 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -1.600 5.811 -0.308 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -1.199 8.855 -0.650 1.00 0.00 H new ATOM 0 HG22 VAL A 390 0.143 7.708 -0.424 1.00 0.00 H new ATOM 0 HG23 VAL A 390 0.125 8.788 -1.838 1.00 0.00 H new ATOM 329 N GLN A 391 -1.459 5.940 -4.791 1.00 0.00 N ATOM 330 CA GLN A 391 -2.216 5.227 -5.811 1.00 0.00 C ATOM 331 C GLN A 391 -1.406 4.057 -6.362 1.00 0.00 C ATOM 332 O GLN A 391 -1.951 2.991 -6.647 1.00 0.00 O ATOM 333 CB GLN A 391 -2.607 6.177 -6.945 1.00 0.00 C ATOM 334 CG GLN A 391 -1.417 6.773 -7.677 1.00 0.00 C ATOM 335 CD GLN A 391 -1.815 7.498 -8.945 1.00 0.00 C ATOM 336 OE1 GLN A 391 -2.700 8.353 -8.935 1.00 0.00 O ATOM 337 NE2 GLN A 391 -1.158 7.157 -10.046 1.00 0.00 N ATOM 0 H GLN A 391 -1.260 6.914 -5.017 1.00 0.00 H new ATOM 0 HA GLN A 391 -3.124 4.835 -5.352 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -3.230 5.639 -7.660 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -3.214 6.985 -6.537 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -0.898 7.466 -7.015 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -0.712 5.979 -7.923 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -0.432 6.442 -10.006 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -1.379 7.610 -10.933 1.00 0.00 H new ATOM 346 N TYR A 392 -0.101 4.266 -6.504 1.00 0.00 N ATOM 347 CA TYR A 392 0.788 3.229 -7.016 1.00 0.00 C ATOM 348 C TYR A 392 0.992 2.130 -5.979 1.00 0.00 C ATOM 349 O TYR A 392 0.881 0.943 -6.286 1.00 0.00 O ATOM 350 CB TYR A 392 2.137 3.834 -7.411 1.00 0.00 C ATOM 351 CG TYR A 392 2.916 2.990 -8.394 1.00 0.00 C ATOM 352 CD1 TYR A 392 3.767 1.985 -7.951 1.00 0.00 C ATOM 353 CD2 TYR A 392 2.803 3.200 -9.763 1.00 0.00 C ATOM 354 CE1 TYR A 392 4.483 1.211 -8.847 1.00 0.00 C ATOM 355 CE2 TYR A 392 3.515 2.431 -10.663 1.00 0.00 C ATOM 356 CZ TYR A 392 4.353 1.439 -10.201 1.00 0.00 C ATOM 357 OH TYR A 392 5.064 0.671 -11.094 1.00 0.00 O ATOM 0 H TYR A 392 0.364 5.144 -6.272 1.00 0.00 H new ATOM 0 HA TYR A 392 0.324 2.789 -7.899 1.00 0.00 H new ATOM 0 HB2 TYR A 392 1.970 4.820 -7.844 1.00 0.00 H new ATOM 0 HB3 TYR A 392 2.738 3.978 -6.513 1.00 0.00 H new ATOM 0 HD1 TYR A 392 3.871 1.805 -6.891 1.00 0.00 H new ATOM 0 HD2 TYR A 392 2.148 3.977 -10.129 1.00 0.00 H new ATOM 0 HE1 TYR A 392 5.140 0.433 -8.488 1.00 0.00 H new ATOM 0 HE2 TYR A 392 3.415 2.606 -11.724 1.00 0.00 H new ATOM 0 HH TYR A 392 4.859 0.958 -12.008 1.00 0.00 H new ATOM 367 N LEU A 393 1.289 2.535 -4.747 1.00 0.00 N ATOM 368 CA LEU A 393 1.505 1.585 -3.663 1.00 0.00 C ATOM 369 C LEU A 393 0.253 0.748 -3.424 1.00 0.00 C ATOM 370 O LEU A 393 0.335 -0.454 -3.170 1.00 0.00 O ATOM 371 CB LEU A 393 1.899 2.322 -2.380 1.00 0.00 C ATOM 372 CG LEU A 393 3.396 2.327 -2.072 1.00 0.00 C ATOM 373 CD1 LEU A 393 3.721 3.368 -1.012 1.00 0.00 C ATOM 374 CD2 LEU A 393 3.852 0.946 -1.625 1.00 0.00 C ATOM 0 H LEU A 393 1.385 3.514 -4.476 1.00 0.00 H new ATOM 0 HA LEU A 393 2.318 0.918 -3.950 1.00 0.00 H new ATOM 0 HB2 LEU A 393 1.555 3.354 -2.451 1.00 0.00 H new ATOM 0 HB3 LEU A 393 1.372 1.867 -1.541 1.00 0.00 H new ATOM 0 HG LEU A 393 3.934 2.588 -2.983 1.00 0.00 H new ATOM 0 HD11 LEU A 393 4.791 3.356 -0.806 1.00 0.00 H new ATOM 0 HD12 LEU A 393 3.431 4.356 -1.371 1.00 0.00 H new ATOM 0 HD13 LEU A 393 3.173 3.139 -0.098 1.00 0.00 H new ATOM 0 HD21 LEU A 393 4.920 0.968 -1.410 1.00 0.00 H new ATOM 0 HD22 LEU A 393 3.307 0.656 -0.727 1.00 0.00 H new ATOM 0 HD23 LEU A 393 3.656 0.224 -2.418 1.00 0.00 H new ATOM 386 N GLU A 394 -0.905 1.393 -3.513 1.00 0.00 N ATOM 387 CA GLU A 394 -2.177 0.711 -3.312 1.00 0.00 C ATOM 388 C GLU A 394 -2.368 -0.392 -4.347 1.00 0.00 C ATOM 389 O GLU A 394 -2.847 -1.480 -4.030 1.00 0.00 O ATOM 390 CB GLU A 394 -3.332 1.712 -3.395 1.00 0.00 C ATOM 391 CG GLU A 394 -4.700 1.082 -3.200 1.00 0.00 C ATOM 392 CD GLU A 394 -5.757 2.095 -2.805 1.00 0.00 C ATOM 393 OE1 GLU A 394 -5.382 3.191 -2.338 1.00 0.00 O ATOM 394 OE2 GLU A 394 -6.958 1.793 -2.963 1.00 0.00 O ATOM 0 H GLU A 394 -0.988 2.388 -3.723 1.00 0.00 H new ATOM 0 HA GLU A 394 -2.169 0.258 -2.321 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -3.187 2.485 -2.640 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -3.304 2.206 -4.366 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -5.003 0.587 -4.123 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -4.635 0.312 -2.432 1.00 0.00 H new ATOM 401 N GLN A 395 -1.986 -0.103 -5.588 1.00 0.00 N ATOM 402 CA GLN A 395 -2.112 -1.073 -6.669 1.00 0.00 C ATOM 403 C GLN A 395 -1.245 -2.298 -6.399 1.00 0.00 C ATOM 404 O GLN A 395 -1.588 -3.413 -6.793 1.00 0.00 O ATOM 405 CB GLN A 395 -1.716 -0.436 -8.003 1.00 0.00 C ATOM 406 CG GLN A 395 -2.735 0.564 -8.524 1.00 0.00 C ATOM 407 CD GLN A 395 -3.493 0.049 -9.734 1.00 0.00 C ATOM 408 OE1 GLN A 395 -4.684 -0.252 -9.653 1.00 0.00 O ATOM 409 NE2 GLN A 395 -2.803 -0.054 -10.863 1.00 0.00 N ATOM 0 H GLN A 395 -1.588 0.793 -5.869 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.153 -1.390 -6.722 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -0.755 0.064 -7.886 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -1.578 -1.222 -8.745 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -3.443 0.802 -7.731 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -2.227 1.492 -8.786 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -1.817 0.207 -10.884 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -3.259 -0.394 -11.710 1.00 0.00 H new ATOM 418 N GLU A 396 -0.120 -2.083 -5.725 1.00 0.00 N ATOM 419 CA GLU A 396 0.797 -3.170 -5.400 1.00 0.00 C ATOM 420 C GLU A 396 0.181 -4.114 -4.372 1.00 0.00 C ATOM 421 O GLU A 396 0.325 -5.332 -4.470 1.00 0.00 O ATOM 422 CB GLU A 396 2.118 -2.611 -4.868 1.00 0.00 C ATOM 423 CG GLU A 396 3.063 -2.141 -5.961 1.00 0.00 C ATOM 424 CD GLU A 396 3.475 -3.260 -6.896 1.00 0.00 C ATOM 425 OE1 GLU A 396 2.703 -3.569 -7.828 1.00 0.00 O ATOM 426 OE2 GLU A 396 4.570 -3.827 -6.698 1.00 0.00 O ATOM 0 H GLU A 396 0.179 -1.166 -5.393 1.00 0.00 H new ATOM 0 HA GLU A 396 0.990 -3.732 -6.314 1.00 0.00 H new ATOM 0 HB2 GLU A 396 1.907 -1.777 -4.198 1.00 0.00 H new ATOM 0 HB3 GLU A 396 2.615 -3.378 -4.275 1.00 0.00 H new ATOM 0 HG2 GLU A 396 2.582 -1.350 -6.537 1.00 0.00 H new ATOM 0 HG3 GLU A 396 3.953 -1.707 -5.505 1.00 0.00 H new ATOM 433 N VAL A 397 -0.508 -3.545 -3.386 1.00 0.00 N ATOM 434 CA VAL A 397 -1.145 -4.342 -2.345 1.00 0.00 C ATOM 435 C VAL A 397 -2.179 -5.289 -2.945 1.00 0.00 C ATOM 436 O VAL A 397 -2.289 -6.443 -2.532 1.00 0.00 O ATOM 437 CB VAL A 397 -1.828 -3.452 -1.288 1.00 0.00 C ATOM 438 CG1 VAL A 397 -2.353 -4.297 -0.136 1.00 0.00 C ATOM 439 CG2 VAL A 397 -0.864 -2.388 -0.785 1.00 0.00 C ATOM 0 H VAL A 397 -0.638 -2.538 -3.287 1.00 0.00 H new ATOM 0 HA VAL A 397 -0.359 -4.920 -1.860 1.00 0.00 H new ATOM 0 HB VAL A 397 -2.676 -2.950 -1.754 1.00 0.00 H new ATOM 0 HG11 VAL A 397 -2.832 -3.651 0.600 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -3.079 -5.017 -0.514 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -1.525 -4.829 0.332 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -1.363 -1.769 -0.039 1.00 0.00 H new ATOM 0 HG22 VAL A 397 0.005 -2.868 -0.335 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -0.543 -1.764 -1.619 1.00 0.00 H new ATOM 449 N GLU A 398 -2.928 -4.796 -3.928 1.00 0.00 N ATOM 450 CA GLU A 398 -3.946 -5.605 -4.591 1.00 0.00 C ATOM 451 C GLU A 398 -3.325 -6.871 -5.167 1.00 0.00 C ATOM 452 O GLU A 398 -3.929 -7.944 -5.143 1.00 0.00 O ATOM 453 CB GLU A 398 -4.624 -4.802 -5.703 1.00 0.00 C ATOM 454 CG GLU A 398 -6.040 -5.260 -6.009 1.00 0.00 C ATOM 455 CD GLU A 398 -6.077 -6.583 -6.751 1.00 0.00 C ATOM 456 OE1 GLU A 398 -5.885 -6.576 -7.985 1.00 0.00 O ATOM 457 OE2 GLU A 398 -6.299 -7.624 -6.099 1.00 0.00 O ATOM 0 H GLU A 398 -2.849 -3.843 -4.282 1.00 0.00 H new ATOM 0 HA GLU A 398 -4.697 -5.886 -3.853 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -4.645 -3.750 -5.419 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -4.024 -4.875 -6.610 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -6.597 -5.355 -5.077 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -6.543 -4.499 -6.605 1.00 0.00 H new ATOM 464 N GLU A 399 -2.105 -6.735 -5.675 1.00 0.00 N ATOM 465 CA GLU A 399 -1.379 -7.861 -6.249 1.00 0.00 C ATOM 466 C GLU A 399 -0.679 -8.650 -5.153 1.00 0.00 C ATOM 467 O GLU A 399 -0.859 -9.862 -5.029 1.00 0.00 O ATOM 468 CB GLU A 399 -0.347 -7.360 -7.258 1.00 0.00 C ATOM 469 CG GLU A 399 0.068 -8.410 -8.273 1.00 0.00 C ATOM 470 CD GLU A 399 0.836 -7.823 -9.441 1.00 0.00 C ATOM 471 OE1 GLU A 399 0.188 -7.337 -10.393 1.00 0.00 O ATOM 472 OE2 GLU A 399 2.083 -7.851 -9.405 1.00 0.00 O ATOM 0 H GLU A 399 -1.596 -5.851 -5.701 1.00 0.00 H new ATOM 0 HA GLU A 399 -2.092 -8.511 -6.756 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -0.755 -6.498 -7.785 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.537 -7.016 -6.721 1.00 0.00 H new ATOM 0 HG2 GLU A 399 0.683 -9.163 -7.780 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.820 -8.919 -8.647 1.00 0.00 H new ATOM 479 N PHE A 400 0.122 -7.936 -4.366 1.00 0.00 N ATOM 480 CA PHE A 400 0.882 -8.510 -3.261 1.00 0.00 C ATOM 481 C PHE A 400 0.227 -9.745 -2.668 1.00 0.00 C ATOM 482 O PHE A 400 -0.788 -9.658 -1.975 1.00 0.00 O ATOM 483 CB PHE A 400 1.053 -7.468 -2.165 1.00 0.00 C ATOM 484 CG PHE A 400 1.970 -7.895 -1.067 1.00 0.00 C ATOM 485 CD1 PHE A 400 3.308 -8.111 -1.325 1.00 0.00 C ATOM 486 CD2 PHE A 400 1.496 -8.074 0.220 1.00 0.00 C ATOM 487 CE1 PHE A 400 4.168 -8.500 -0.315 1.00 0.00 C ATOM 488 CE2 PHE A 400 2.346 -8.463 1.236 1.00 0.00 C ATOM 489 CZ PHE A 400 3.686 -8.676 0.969 1.00 0.00 C ATOM 0 H PHE A 400 0.262 -6.932 -4.480 1.00 0.00 H new ATOM 0 HA PHE A 400 1.847 -8.814 -3.667 1.00 0.00 H new ATOM 0 HB2 PHE A 400 1.435 -6.548 -2.607 1.00 0.00 H new ATOM 0 HB3 PHE A 400 0.076 -7.236 -1.741 1.00 0.00 H new ATOM 0 HD1 PHE A 400 3.688 -7.975 -2.327 1.00 0.00 H new ATOM 0 HD2 PHE A 400 0.450 -7.908 0.432 1.00 0.00 H new ATOM 0 HE1 PHE A 400 5.214 -8.666 -0.528 1.00 0.00 H new ATOM 0 HE2 PHE A 400 1.965 -8.601 2.237 1.00 0.00 H new ATOM 0 HZ PHE A 400 4.354 -8.979 1.761 1.00 0.00 H new ATOM 499 N VAL A 401 0.840 -10.888 -2.914 1.00 0.00 N ATOM 500 CA VAL A 401 0.352 -12.143 -2.377 1.00 0.00 C ATOM 501 C VAL A 401 1.208 -12.547 -1.186 1.00 0.00 C ATOM 502 O VAL A 401 1.340 -13.730 -0.872 1.00 0.00 O ATOM 503 CB VAL A 401 0.384 -13.264 -3.431 1.00 0.00 C ATOM 504 CG1 VAL A 401 -0.327 -14.505 -2.913 1.00 0.00 C ATOM 505 CG2 VAL A 401 -0.238 -12.790 -4.736 1.00 0.00 C ATOM 0 H VAL A 401 1.681 -10.972 -3.485 1.00 0.00 H new ATOM 0 HA VAL A 401 -0.684 -11.999 -2.070 1.00 0.00 H new ATOM 0 HB VAL A 401 1.425 -13.524 -3.625 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -0.294 -15.287 -3.672 1.00 0.00 H new ATOM 0 HG12 VAL A 401 0.168 -14.857 -2.008 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -1.365 -14.262 -2.687 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -0.206 -13.597 -5.468 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -1.274 -12.500 -4.561 1.00 0.00 H new ATOM 0 HG23 VAL A 401 0.320 -11.934 -5.115 1.00 0.00 H new ATOM 515 N GLY A 402 1.804 -11.547 -0.532 1.00 0.00 N ATOM 516 CA GLY A 402 2.651 -11.806 0.601 1.00 0.00 C ATOM 517 C GLY A 402 1.959 -12.582 1.692 1.00 0.00 C ATOM 518 O GLY A 402 0.810 -13.000 1.550 1.00 0.00 O ATOM 0 H GLY A 402 1.708 -10.562 -0.777 1.00 0.00 H new ATOM 0 HA2 GLY A 402 3.530 -12.360 0.271 1.00 0.00 H new ATOM 0 HA3 GLY A 402 3.005 -10.858 1.006 1.00 0.00 H new ATOM 522 N LYS A 403 2.677 -12.765 2.781 1.00 0.00 N ATOM 523 CA LYS A 403 2.154 -13.499 3.934 1.00 0.00 C ATOM 524 C LYS A 403 2.438 -12.764 5.241 1.00 0.00 C ATOM 525 O LYS A 403 3.496 -12.164 5.405 1.00 0.00 O ATOM 526 CB LYS A 403 2.748 -14.907 3.986 1.00 0.00 C ATOM 527 CG LYS A 403 2.432 -15.743 2.757 1.00 0.00 C ATOM 528 CD LYS A 403 3.299 -15.345 1.572 1.00 0.00 C ATOM 529 CE LYS A 403 3.912 -16.559 0.889 1.00 0.00 C ATOM 530 NZ LYS A 403 5.398 -16.483 0.851 1.00 0.00 N ATOM 0 H LYS A 403 3.629 -12.417 2.900 1.00 0.00 H new ATOM 0 HA LYS A 403 1.073 -13.571 3.815 1.00 0.00 H new ATOM 0 HB2 LYS A 403 3.830 -14.833 4.097 1.00 0.00 H new ATOM 0 HB3 LYS A 403 2.371 -15.419 4.871 1.00 0.00 H new ATOM 0 HG2 LYS A 403 2.587 -16.798 2.984 1.00 0.00 H new ATOM 0 HG3 LYS A 403 1.380 -15.624 2.496 1.00 0.00 H new ATOM 0 HD2 LYS A 403 2.699 -14.788 0.853 1.00 0.00 H new ATOM 0 HD3 LYS A 403 4.092 -14.678 1.910 1.00 0.00 H new ATOM 0 HE2 LYS A 403 3.608 -17.464 1.415 1.00 0.00 H new ATOM 0 HE3 LYS A 403 3.526 -16.637 -0.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 5.794 -17.444 0.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 5.697 -15.944 0.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 5.743 -16.009 1.710 1.00 0.00 H new ATOM 544 N LYS A 404 1.495 -12.836 6.175 1.00 0.00 N ATOM 545 CA LYS A 404 1.650 -12.187 7.474 1.00 0.00 C ATOM 546 C LYS A 404 2.955 -12.603 8.150 1.00 0.00 C ATOM 547 O LYS A 404 3.503 -11.863 8.968 1.00 0.00 O ATOM 548 CB LYS A 404 0.463 -12.529 8.379 1.00 0.00 C ATOM 549 CG LYS A 404 -0.348 -11.314 8.803 1.00 0.00 C ATOM 550 CD LYS A 404 -0.657 -11.341 10.291 1.00 0.00 C ATOM 551 CE LYS A 404 -1.460 -12.573 10.672 1.00 0.00 C ATOM 552 NZ LYS A 404 -1.756 -12.615 12.131 1.00 0.00 N ATOM 0 H LYS A 404 0.615 -13.337 6.057 1.00 0.00 H new ATOM 0 HA LYS A 404 1.681 -11.110 7.309 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -0.191 -13.228 7.858 1.00 0.00 H new ATOM 0 HB3 LYS A 404 0.831 -13.039 9.269 1.00 0.00 H new ATOM 0 HG2 LYS A 404 0.203 -10.405 8.561 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -1.279 -11.282 8.238 1.00 0.00 H new ATOM 0 HD2 LYS A 404 0.274 -11.323 10.857 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -1.213 -10.444 10.564 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -2.395 -12.584 10.112 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -0.907 -13.469 10.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -2.305 -13.471 12.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -0.864 -12.630 12.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -2.306 -11.773 12.398 1.00 0.00 H new ATOM 566 N THR A 405 3.446 -13.791 7.808 1.00 0.00 N ATOM 567 CA THR A 405 4.684 -14.300 8.389 1.00 0.00 C ATOM 568 C THR A 405 5.888 -13.992 7.502 1.00 0.00 C ATOM 569 O THR A 405 7.032 -14.087 7.946 1.00 0.00 O ATOM 570 CB THR A 405 4.580 -15.810 8.616 1.00 0.00 C ATOM 571 OG1 THR A 405 5.783 -16.318 9.164 1.00 0.00 O ATOM 572 CG2 THR A 405 4.287 -16.587 7.351 1.00 0.00 C ATOM 0 H THR A 405 3.007 -14.417 7.133 1.00 0.00 H new ATOM 0 HA THR A 405 4.831 -13.798 9.345 1.00 0.00 H new ATOM 0 HB THR A 405 3.746 -15.942 9.305 1.00 0.00 H new ATOM 0 HG1 THR A 405 6.497 -15.655 9.056 1.00 0.00 H new ATOM 0 HG21 THR A 405 4.226 -17.650 7.583 1.00 0.00 H new ATOM 0 HG22 THR A 405 3.339 -16.253 6.930 1.00 0.00 H new ATOM 0 HG23 THR A 405 5.085 -16.418 6.627 1.00 0.00 H new ATOM 580 N ASP A 406 5.631 -13.626 6.250 1.00 0.00 N ATOM 581 CA ASP A 406 6.705 -13.311 5.317 1.00 0.00 C ATOM 582 C ASP A 406 7.271 -11.922 5.587 1.00 0.00 C ATOM 583 O ASP A 406 6.533 -10.994 5.918 1.00 0.00 O ATOM 584 CB ASP A 406 6.205 -13.394 3.874 1.00 0.00 C ATOM 585 CG ASP A 406 7.340 -13.420 2.868 1.00 0.00 C ATOM 586 OD1 ASP A 406 8.114 -12.442 2.822 1.00 0.00 O ATOM 587 OD2 ASP A 406 7.453 -14.419 2.126 1.00 0.00 O ATOM 0 H ASP A 406 4.692 -13.541 5.860 1.00 0.00 H new ATOM 0 HA ASP A 406 7.498 -14.045 5.461 1.00 0.00 H new ATOM 0 HB2 ASP A 406 5.597 -14.291 3.754 1.00 0.00 H new ATOM 0 HB3 ASP A 406 5.559 -12.541 3.667 1.00 0.00 H new ATOM 592 N LYS A 407 8.583 -11.787 5.442 1.00 0.00 N ATOM 593 CA LYS A 407 9.249 -10.510 5.666 1.00 0.00 C ATOM 594 C LYS A 407 8.737 -9.461 4.693 1.00 0.00 C ATOM 595 O LYS A 407 8.690 -8.273 5.009 1.00 0.00 O ATOM 596 CB LYS A 407 10.763 -10.672 5.523 1.00 0.00 C ATOM 597 CG LYS A 407 11.335 -11.784 6.386 1.00 0.00 C ATOM 598 CD LYS A 407 12.829 -11.611 6.606 1.00 0.00 C ATOM 599 CE LYS A 407 13.392 -12.715 7.486 1.00 0.00 C ATOM 600 NZ LYS A 407 12.876 -12.633 8.880 1.00 0.00 N ATOM 0 H LYS A 407 9.207 -12.546 5.170 1.00 0.00 H new ATOM 0 HA LYS A 407 9.025 -10.177 6.679 1.00 0.00 H new ATOM 0 HB2 LYS A 407 11.002 -10.873 4.479 1.00 0.00 H new ATOM 0 HB3 LYS A 407 11.248 -9.732 5.786 1.00 0.00 H new ATOM 0 HG2 LYS A 407 10.824 -11.797 7.349 1.00 0.00 H new ATOM 0 HG3 LYS A 407 11.146 -12.747 5.912 1.00 0.00 H new ATOM 0 HD2 LYS A 407 13.342 -11.613 5.644 1.00 0.00 H new ATOM 0 HD3 LYS A 407 13.020 -10.642 7.068 1.00 0.00 H new ATOM 0 HE2 LYS A 407 13.135 -13.685 7.060 1.00 0.00 H new ATOM 0 HE3 LYS A 407 14.480 -12.650 7.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 13.407 -13.291 9.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 12.992 -11.663 9.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 11.868 -12.888 8.893 1.00 0.00 H new ATOM 614 N ALA A 408 8.341 -9.913 3.515 1.00 0.00 N ATOM 615 CA ALA A 408 7.818 -9.022 2.497 1.00 0.00 C ATOM 616 C ALA A 408 6.534 -8.354 2.973 1.00 0.00 C ATOM 617 O ALA A 408 6.208 -7.248 2.544 1.00 0.00 O ATOM 618 CB ALA A 408 7.572 -9.786 1.205 1.00 0.00 C ATOM 0 H ALA A 408 8.373 -10.895 3.241 1.00 0.00 H new ATOM 0 HA ALA A 408 8.557 -8.244 2.308 1.00 0.00 H new ATOM 0 HB1 ALA A 408 7.180 -9.106 0.449 1.00 0.00 H new ATOM 0 HB2 ALA A 408 8.509 -10.217 0.853 1.00 0.00 H new ATOM 0 HB3 ALA A 408 6.851 -10.583 1.385 1.00 0.00 H new ATOM 624 N TYR A 409 5.792 -9.040 3.841 1.00 0.00 N ATOM 625 CA TYR A 409 4.529 -8.509 4.340 1.00 0.00 C ATOM 626 C TYR A 409 4.725 -7.287 5.234 1.00 0.00 C ATOM 627 O TYR A 409 4.030 -6.285 5.053 1.00 0.00 O ATOM 628 CB TYR A 409 3.763 -9.602 5.087 1.00 0.00 C ATOM 629 CG TYR A 409 2.681 -9.087 6.011 1.00 0.00 C ATOM 630 CD1 TYR A 409 1.431 -8.733 5.520 1.00 0.00 C ATOM 631 CD2 TYR A 409 2.913 -8.958 7.374 1.00 0.00 C ATOM 632 CE1 TYR A 409 0.441 -8.264 6.361 1.00 0.00 C ATOM 633 CE2 TYR A 409 1.927 -8.489 8.222 1.00 0.00 C ATOM 634 CZ TYR A 409 0.693 -8.144 7.711 1.00 0.00 C ATOM 635 OH TYR A 409 -0.290 -7.676 8.552 1.00 0.00 O ATOM 0 H TYR A 409 6.043 -9.957 4.210 1.00 0.00 H new ATOM 0 HA TYR A 409 3.948 -8.181 3.478 1.00 0.00 H new ATOM 0 HB2 TYR A 409 3.311 -10.275 4.358 1.00 0.00 H new ATOM 0 HB3 TYR A 409 4.471 -10.192 5.669 1.00 0.00 H new ATOM 0 HD1 TYR A 409 1.230 -8.826 4.463 1.00 0.00 H new ATOM 0 HD2 TYR A 409 3.878 -9.228 7.777 1.00 0.00 H new ATOM 0 HE1 TYR A 409 -0.526 -7.993 5.963 1.00 0.00 H new ATOM 0 HE2 TYR A 409 2.122 -8.393 9.280 1.00 0.00 H new ATOM 0 HH TYR A 409 0.049 -7.653 9.471 1.00 0.00 H new ATOM 645 N TRP A 410 5.676 -7.325 6.172 1.00 0.00 N ATOM 646 CA TRP A 410 5.893 -6.146 7.001 1.00 0.00 C ATOM 647 C TRP A 410 6.569 -5.072 6.168 1.00 0.00 C ATOM 648 O TRP A 410 6.360 -3.880 6.383 1.00 0.00 O ATOM 649 CB TRP A 410 6.665 -6.417 8.304 1.00 0.00 C ATOM 650 CG TRP A 410 7.701 -7.492 8.271 1.00 0.00 C ATOM 651 CD1 TRP A 410 7.509 -8.820 8.513 1.00 0.00 C ATOM 652 CD2 TRP A 410 9.106 -7.318 8.054 1.00 0.00 C ATOM 653 NE1 TRP A 410 8.706 -9.485 8.457 1.00 0.00 N ATOM 654 CE2 TRP A 410 9.702 -8.586 8.166 1.00 0.00 C ATOM 655 CE3 TRP A 410 9.915 -6.216 7.765 1.00 0.00 C ATOM 656 CZ2 TRP A 410 11.072 -8.782 8.006 1.00 0.00 C ATOM 657 CZ3 TRP A 410 11.274 -6.411 7.604 1.00 0.00 C ATOM 658 CH2 TRP A 410 11.840 -7.686 7.724 1.00 0.00 C ATOM 0 H TRP A 410 6.281 -8.122 6.368 1.00 0.00 H new ATOM 0 HA TRP A 410 4.913 -5.805 7.333 1.00 0.00 H new ATOM 0 HB2 TRP A 410 7.150 -5.490 8.609 1.00 0.00 H new ATOM 0 HB3 TRP A 410 5.942 -6.668 9.080 1.00 0.00 H new ATOM 0 HD1 TRP A 410 6.554 -9.280 8.719 1.00 0.00 H new ATOM 0 HE1 TRP A 410 8.836 -10.485 8.607 1.00 0.00 H new ATOM 0 HE3 TRP A 410 9.486 -5.229 7.669 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 11.512 -9.764 8.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 11.909 -5.566 7.382 1.00 0.00 H new ATOM 0 HH2 TRP A 410 12.905 -7.806 7.591 1.00 0.00 H new ATOM 669 N LEU A 411 7.347 -5.517 5.184 1.00 0.00 N ATOM 670 CA LEU A 411 8.027 -4.631 4.267 1.00 0.00 C ATOM 671 C LEU A 411 6.999 -3.964 3.361 1.00 0.00 C ATOM 672 O LEU A 411 7.089 -2.771 3.083 1.00 0.00 O ATOM 673 CB LEU A 411 9.045 -5.415 3.434 1.00 0.00 C ATOM 674 CG LEU A 411 9.701 -4.625 2.302 1.00 0.00 C ATOM 675 CD1 LEU A 411 10.948 -3.913 2.800 1.00 0.00 C ATOM 676 CD2 LEU A 411 10.037 -5.544 1.137 1.00 0.00 C ATOM 0 H LEU A 411 7.518 -6.507 5.007 1.00 0.00 H new ATOM 0 HA LEU A 411 8.562 -3.865 4.828 1.00 0.00 H new ATOM 0 HB2 LEU A 411 9.826 -5.786 4.098 1.00 0.00 H new ATOM 0 HB3 LEU A 411 8.548 -6.287 3.008 1.00 0.00 H new ATOM 0 HG LEU A 411 8.995 -3.872 1.953 1.00 0.00 H new ATOM 0 HD11 LEU A 411 11.401 -3.356 1.980 1.00 0.00 H new ATOM 0 HD12 LEU A 411 10.679 -3.225 3.601 1.00 0.00 H new ATOM 0 HD13 LEU A 411 11.660 -4.647 3.177 1.00 0.00 H new ATOM 0 HD21 LEU A 411 10.503 -4.965 0.340 1.00 0.00 H new ATOM 0 HD22 LEU A 411 10.725 -6.320 1.472 1.00 0.00 H new ATOM 0 HD23 LEU A 411 9.123 -6.006 0.763 1.00 0.00 H new ATOM 688 N LEU A 412 6.000 -4.741 2.923 1.00 0.00 N ATOM 689 CA LEU A 412 4.946 -4.204 2.070 1.00 0.00 C ATOM 690 C LEU A 412 4.235 -3.077 2.806 1.00 0.00 C ATOM 691 O LEU A 412 4.034 -1.985 2.273 1.00 0.00 O ATOM 692 CB LEU A 412 3.940 -5.293 1.690 1.00 0.00 C ATOM 693 CG LEU A 412 3.275 -5.105 0.325 1.00 0.00 C ATOM 694 CD1 LEU A 412 2.663 -3.718 0.212 1.00 0.00 C ATOM 695 CD2 LEU A 412 4.280 -5.339 -0.792 1.00 0.00 C ATOM 0 H LEU A 412 5.904 -5.732 3.145 1.00 0.00 H new ATOM 0 HA LEU A 412 5.395 -3.824 1.152 1.00 0.00 H new ATOM 0 HB2 LEU A 412 4.448 -6.257 1.701 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.164 -5.333 2.454 1.00 0.00 H new ATOM 0 HG LEU A 412 2.475 -5.839 0.229 1.00 0.00 H new ATOM 0 HD11 LEU A 412 2.195 -3.605 -0.766 1.00 0.00 H new ATOM 0 HD12 LEU A 412 1.912 -3.587 0.991 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.443 -2.966 0.330 1.00 0.00 H new ATOM 0 HD21 LEU A 412 3.791 -5.201 -1.756 1.00 0.00 H new ATOM 0 HD22 LEU A 412 5.101 -4.629 -0.697 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.669 -6.355 -0.724 1.00 0.00 H new ATOM 707 N GLU A 413 3.901 -3.354 4.061 1.00 0.00 N ATOM 708 CA GLU A 413 3.258 -2.381 4.928 1.00 0.00 C ATOM 709 C GLU A 413 4.251 -1.284 5.286 1.00 0.00 C ATOM 710 O GLU A 413 3.878 -0.131 5.502 1.00 0.00 O ATOM 711 CB GLU A 413 2.737 -3.056 6.199 1.00 0.00 C ATOM 712 CG GLU A 413 1.358 -3.676 6.038 1.00 0.00 C ATOM 713 CD GLU A 413 0.355 -3.135 7.037 1.00 0.00 C ATOM 714 OE1 GLU A 413 0.363 -3.600 8.197 1.00 0.00 O ATOM 715 OE2 GLU A 413 -0.439 -2.247 6.661 1.00 0.00 O ATOM 0 H GLU A 413 4.069 -4.258 4.503 1.00 0.00 H new ATOM 0 HA GLU A 413 2.410 -1.943 4.401 1.00 0.00 H new ATOM 0 HB2 GLU A 413 3.441 -3.830 6.504 1.00 0.00 H new ATOM 0 HB3 GLU A 413 2.704 -2.321 7.003 1.00 0.00 H new ATOM 0 HG2 GLU A 413 0.995 -3.489 5.027 1.00 0.00 H new ATOM 0 HG3 GLU A 413 1.434 -4.757 6.154 1.00 0.00 H new ATOM 722 N GLU A 414 5.523 -1.671 5.360 1.00 0.00 N ATOM 723 CA GLU A 414 6.594 -0.750 5.708 1.00 0.00 C ATOM 724 C GLU A 414 6.729 0.354 4.661 1.00 0.00 C ATOM 725 O GLU A 414 6.944 1.517 5.005 1.00 0.00 O ATOM 726 CB GLU A 414 7.912 -1.522 5.841 1.00 0.00 C ATOM 727 CG GLU A 414 8.533 -1.429 7.225 1.00 0.00 C ATOM 728 CD GLU A 414 7.611 -1.943 8.314 1.00 0.00 C ATOM 729 OE1 GLU A 414 7.516 -3.177 8.477 1.00 0.00 O ATOM 730 OE2 GLU A 414 6.983 -1.110 9.001 1.00 0.00 O ATOM 0 H GLU A 414 5.835 -2.626 5.181 1.00 0.00 H new ATOM 0 HA GLU A 414 6.353 -0.279 6.661 1.00 0.00 H new ATOM 0 HB2 GLU A 414 7.735 -2.570 5.601 1.00 0.00 H new ATOM 0 HB3 GLU A 414 8.622 -1.142 5.107 1.00 0.00 H new ATOM 0 HG2 GLU A 414 9.462 -1.999 7.241 1.00 0.00 H new ATOM 0 HG3 GLU A 414 8.792 -0.391 7.434 1.00 0.00 H new ATOM 737 N MET A 415 6.584 -0.001 3.387 1.00 0.00 N ATOM 738 CA MET A 415 6.673 0.987 2.316 1.00 0.00 C ATOM 739 C MET A 415 5.467 1.914 2.365 1.00 0.00 C ATOM 740 O MET A 415 5.582 3.123 2.157 1.00 0.00 O ATOM 741 CB MET A 415 6.743 0.306 0.947 1.00 0.00 C ATOM 742 CG MET A 415 7.838 -0.737 0.837 1.00 0.00 C ATOM 743 SD MET A 415 9.464 -0.092 1.279 1.00 0.00 S ATOM 744 CE MET A 415 10.433 -0.623 -0.129 1.00 0.00 C ATOM 0 H MET A 415 6.406 -0.955 3.073 1.00 0.00 H new ATOM 0 HA MET A 415 7.585 1.566 2.461 1.00 0.00 H new ATOM 0 HB2 MET A 415 5.783 -0.165 0.737 1.00 0.00 H new ATOM 0 HB3 MET A 415 6.900 1.066 0.181 1.00 0.00 H new ATOM 0 HG2 MET A 415 7.598 -1.579 1.486 1.00 0.00 H new ATOM 0 HG3 MET A 415 7.869 -1.119 -0.183 1.00 0.00 H new ATOM 0 HE1 MET A 415 11.466 -0.298 -0.003 1.00 0.00 H new ATOM 0 HE2 MET A 415 10.401 -1.710 -0.204 1.00 0.00 H new ATOM 0 HE3 MET A 415 10.023 -0.185 -1.039 1.00 0.00 H new ATOM 754 N LEU A 416 4.307 1.330 2.646 1.00 0.00 N ATOM 755 CA LEU A 416 3.066 2.090 2.728 1.00 0.00 C ATOM 756 C LEU A 416 3.150 3.153 3.821 1.00 0.00 C ATOM 757 O LEU A 416 2.720 4.288 3.628 1.00 0.00 O ATOM 758 CB LEU A 416 1.885 1.152 2.998 1.00 0.00 C ATOM 759 CG LEU A 416 0.657 1.381 2.113 1.00 0.00 C ATOM 760 CD1 LEU A 416 0.286 2.857 2.077 1.00 0.00 C ATOM 761 CD2 LEU A 416 0.910 0.858 0.706 1.00 0.00 C ATOM 0 H LEU A 416 4.201 0.331 2.821 1.00 0.00 H new ATOM 0 HA LEU A 416 2.911 2.590 1.772 1.00 0.00 H new ATOM 0 HB2 LEU A 416 2.221 0.123 2.867 1.00 0.00 H new ATOM 0 HB3 LEU A 416 1.587 1.260 4.041 1.00 0.00 H new ATOM 0 HG LEU A 416 -0.181 0.830 2.541 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -0.589 2.997 1.442 1.00 0.00 H new ATOM 0 HD12 LEU A 416 0.061 3.200 3.087 1.00 0.00 H new ATOM 0 HD13 LEU A 416 1.121 3.432 1.676 1.00 0.00 H new ATOM 0 HD21 LEU A 416 0.027 1.029 0.090 1.00 0.00 H new ATOM 0 HD22 LEU A 416 1.762 1.380 0.271 1.00 0.00 H new ATOM 0 HD23 LEU A 416 1.122 -0.210 0.748 1.00 0.00 H new ATOM 773 N THR A 417 3.709 2.779 4.967 1.00 0.00 N ATOM 774 CA THR A 417 3.849 3.707 6.084 1.00 0.00 C ATOM 775 C THR A 417 4.814 4.833 5.731 1.00 0.00 C ATOM 776 O THR A 417 4.654 5.967 6.185 1.00 0.00 O ATOM 777 CB THR A 417 4.340 2.970 7.331 1.00 0.00 C ATOM 778 OG1 THR A 417 3.703 1.710 7.452 1.00 0.00 O ATOM 779 CG2 THR A 417 4.094 3.734 8.613 1.00 0.00 C ATOM 0 H THR A 417 4.072 1.843 5.147 1.00 0.00 H new ATOM 0 HA THR A 417 2.870 4.140 6.291 1.00 0.00 H new ATOM 0 HB THR A 417 5.416 2.857 7.195 1.00 0.00 H new ATOM 0 HG1 THR A 417 4.096 1.082 6.810 1.00 0.00 H new ATOM 0 HG21 THR A 417 4.466 3.155 9.459 1.00 0.00 H new ATOM 0 HG22 THR A 417 4.614 4.691 8.572 1.00 0.00 H new ATOM 0 HG23 THR A 417 3.025 3.907 8.734 1.00 0.00 H new ATOM 787 N LYS A 418 5.815 4.515 4.914 1.00 0.00 N ATOM 788 CA LYS A 418 6.805 5.503 4.497 1.00 0.00 C ATOM 789 C LYS A 418 6.129 6.675 3.794 1.00 0.00 C ATOM 790 O LYS A 418 6.404 7.835 4.100 1.00 0.00 O ATOM 791 CB LYS A 418 7.843 4.860 3.574 1.00 0.00 C ATOM 792 CG LYS A 418 9.278 5.173 3.967 1.00 0.00 C ATOM 793 CD LYS A 418 10.161 5.371 2.746 1.00 0.00 C ATOM 794 CE LYS A 418 10.486 4.047 2.074 1.00 0.00 C ATOM 795 NZ LYS A 418 11.686 3.400 2.675 1.00 0.00 N ATOM 0 H LYS A 418 5.962 3.582 4.528 1.00 0.00 H new ATOM 0 HA LYS A 418 7.312 5.878 5.386 1.00 0.00 H new ATOM 0 HB2 LYS A 418 7.701 3.779 3.577 1.00 0.00 H new ATOM 0 HB3 LYS A 418 7.671 5.201 2.553 1.00 0.00 H new ATOM 0 HG2 LYS A 418 9.300 6.072 4.582 1.00 0.00 H new ATOM 0 HG3 LYS A 418 9.675 4.361 4.576 1.00 0.00 H new ATOM 0 HD2 LYS A 418 9.659 6.028 2.035 1.00 0.00 H new ATOM 0 HD3 LYS A 418 11.086 5.867 3.041 1.00 0.00 H new ATOM 0 HE2 LYS A 418 9.631 3.377 2.160 1.00 0.00 H new ATOM 0 HE3 LYS A 418 10.657 4.212 1.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 11.875 2.500 2.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 12.508 4.029 2.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 11.514 3.219 3.685 1.00 0.00 H new ATOM 809 N GLU A 419 5.232 6.367 2.861 1.00 0.00 N ATOM 810 CA GLU A 419 4.513 7.407 2.136 1.00 0.00 C ATOM 811 C GLU A 419 3.648 8.207 3.104 1.00 0.00 C ATOM 812 O GLU A 419 3.479 9.418 2.953 1.00 0.00 O ATOM 813 CB GLU A 419 3.663 6.805 1.007 1.00 0.00 C ATOM 814 CG GLU A 419 2.411 6.082 1.480 1.00 0.00 C ATOM 815 CD GLU A 419 1.140 6.696 0.926 1.00 0.00 C ATOM 816 OE1 GLU A 419 0.900 7.895 1.181 1.00 0.00 O ATOM 817 OE2 GLU A 419 0.385 5.978 0.238 1.00 0.00 O ATOM 0 H GLU A 419 4.988 5.414 2.592 1.00 0.00 H new ATOM 0 HA GLU A 419 5.238 8.079 1.677 1.00 0.00 H new ATOM 0 HB2 GLU A 419 3.371 7.603 0.324 1.00 0.00 H new ATOM 0 HB3 GLU A 419 4.278 6.107 0.438 1.00 0.00 H new ATOM 0 HG2 GLU A 419 2.465 5.035 1.181 1.00 0.00 H new ATOM 0 HG3 GLU A 419 2.375 6.101 2.569 1.00 0.00 H new ATOM 824 N LEU A 420 3.120 7.519 4.113 1.00 0.00 N ATOM 825 CA LEU A 420 2.291 8.155 5.128 1.00 0.00 C ATOM 826 C LEU A 420 3.142 9.080 5.988 1.00 0.00 C ATOM 827 O LEU A 420 2.732 10.183 6.339 1.00 0.00 O ATOM 828 CB LEU A 420 1.629 7.091 6.009 1.00 0.00 C ATOM 829 CG LEU A 420 0.267 7.472 6.594 1.00 0.00 C ATOM 830 CD1 LEU A 420 -0.143 6.487 7.678 1.00 0.00 C ATOM 831 CD2 LEU A 420 0.294 8.891 7.146 1.00 0.00 C ATOM 0 H LEU A 420 3.254 6.517 4.248 1.00 0.00 H new ATOM 0 HA LEU A 420 1.515 8.739 4.634 1.00 0.00 H new ATOM 0 HB2 LEU A 420 1.510 6.181 5.421 1.00 0.00 H new ATOM 0 HB3 LEU A 420 2.304 6.854 6.831 1.00 0.00 H new ATOM 0 HG LEU A 420 -0.471 7.431 5.793 1.00 0.00 H new ATOM 0 HD11 LEU A 420 -1.114 6.774 8.082 1.00 0.00 H new ATOM 0 HD12 LEU A 420 -0.209 5.485 7.253 1.00 0.00 H new ATOM 0 HD13 LEU A 420 0.599 6.495 8.476 1.00 0.00 H new ATOM 0 HD21 LEU A 420 -0.684 9.140 7.557 1.00 0.00 H new ATOM 0 HD22 LEU A 420 1.046 8.961 7.932 1.00 0.00 H new ATOM 0 HD23 LEU A 420 0.540 9.588 6.345 1.00 0.00 H new ATOM 843 N LEU A 421 4.337 8.609 6.321 1.00 0.00 N ATOM 844 CA LEU A 421 5.269 9.372 7.137 1.00 0.00 C ATOM 845 C LEU A 421 5.840 10.562 6.364 1.00 0.00 C ATOM 846 O LEU A 421 6.154 11.599 6.948 1.00 0.00 O ATOM 847 CB LEU A 421 6.399 8.460 7.621 1.00 0.00 C ATOM 848 CG LEU A 421 6.233 7.924 9.045 1.00 0.00 C ATOM 849 CD1 LEU A 421 4.865 7.281 9.219 1.00 0.00 C ATOM 850 CD2 LEU A 421 7.336 6.928 9.371 1.00 0.00 C ATOM 0 H LEU A 421 4.685 7.694 6.035 1.00 0.00 H new ATOM 0 HA LEU A 421 4.728 9.765 7.998 1.00 0.00 H new ATOM 0 HB2 LEU A 421 6.481 7.615 6.938 1.00 0.00 H new ATOM 0 HB3 LEU A 421 7.339 9.009 7.563 1.00 0.00 H new ATOM 0 HG LEU A 421 6.309 8.762 9.738 1.00 0.00 H new ATOM 0 HD11 LEU A 421 4.766 6.906 10.238 1.00 0.00 H new ATOM 0 HD12 LEU A 421 4.088 8.021 9.028 1.00 0.00 H new ATOM 0 HD13 LEU A 421 4.759 6.454 8.516 1.00 0.00 H new ATOM 0 HD21 LEU A 421 7.203 6.557 10.387 1.00 0.00 H new ATOM 0 HD22 LEU A 421 7.291 6.093 8.671 1.00 0.00 H new ATOM 0 HD23 LEU A 421 8.306 7.419 9.288 1.00 0.00 H new ATOM 862 N GLU A 422 5.986 10.399 5.051 1.00 0.00 N ATOM 863 CA GLU A 422 6.536 11.455 4.202 1.00 0.00 C ATOM 864 C GLU A 422 5.575 12.633 4.062 1.00 0.00 C ATOM 865 O GLU A 422 5.979 13.790 4.180 1.00 0.00 O ATOM 866 CB GLU A 422 6.874 10.897 2.817 1.00 0.00 C ATOM 867 CG GLU A 422 8.232 11.341 2.297 1.00 0.00 C ATOM 868 CD GLU A 422 9.074 10.183 1.796 1.00 0.00 C ATOM 869 OE1 GLU A 422 8.539 9.344 1.042 1.00 0.00 O ATOM 870 OE2 GLU A 422 10.267 10.118 2.158 1.00 0.00 O ATOM 0 H GLU A 422 5.732 9.547 4.552 1.00 0.00 H new ATOM 0 HA GLU A 422 7.444 11.819 4.683 1.00 0.00 H new ATOM 0 HB2 GLU A 422 6.848 9.808 2.857 1.00 0.00 H new ATOM 0 HB3 GLU A 422 6.104 11.209 2.111 1.00 0.00 H new ATOM 0 HG2 GLU A 422 8.090 12.058 1.489 1.00 0.00 H new ATOM 0 HG3 GLU A 422 8.769 11.859 3.092 1.00 0.00 H new ATOM 877 N LEU A 423 4.306 12.339 3.796 1.00 0.00 N ATOM 878 CA LEU A 423 3.302 13.385 3.628 1.00 0.00 C ATOM 879 C LEU A 423 3.195 14.255 4.877 1.00 0.00 C ATOM 880 O LEU A 423 2.880 15.442 4.792 1.00 0.00 O ATOM 881 CB LEU A 423 1.938 12.774 3.288 1.00 0.00 C ATOM 882 CG LEU A 423 1.216 12.095 4.451 1.00 0.00 C ATOM 883 CD1 LEU A 423 0.468 13.121 5.291 1.00 0.00 C ATOM 884 CD2 LEU A 423 0.263 11.027 3.933 1.00 0.00 C ATOM 0 H LEU A 423 3.949 11.389 3.692 1.00 0.00 H new ATOM 0 HA LEU A 423 3.619 14.019 2.800 1.00 0.00 H new ATOM 0 HB2 LEU A 423 1.295 13.560 2.893 1.00 0.00 H new ATOM 0 HB3 LEU A 423 2.075 12.043 2.491 1.00 0.00 H new ATOM 0 HG LEU A 423 1.960 11.614 5.085 1.00 0.00 H new ATOM 0 HD11 LEU A 423 -0.039 12.617 6.114 1.00 0.00 H new ATOM 0 HD12 LEU A 423 1.174 13.848 5.691 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -0.267 13.633 4.670 1.00 0.00 H new ATOM 0 HD21 LEU A 423 -0.244 10.553 4.774 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -0.476 11.486 3.276 1.00 0.00 H new ATOM 0 HD23 LEU A 423 0.825 10.276 3.378 1.00 0.00 H new ATOM 896 N ASP A 424 3.456 13.659 6.037 1.00 0.00 N ATOM 897 CA ASP A 424 3.384 14.384 7.302 1.00 0.00 C ATOM 898 C ASP A 424 4.739 14.980 7.680 1.00 0.00 C ATOM 899 O ASP A 424 5.065 15.099 8.861 1.00 0.00 O ATOM 900 CB ASP A 424 2.897 13.455 8.416 1.00 0.00 C ATOM 901 CG ASP A 424 2.169 14.203 9.515 1.00 0.00 C ATOM 902 OD1 ASP A 424 2.825 14.985 10.235 1.00 0.00 O ATOM 903 OD2 ASP A 424 0.944 14.009 9.656 1.00 0.00 O ATOM 0 H ASP A 424 3.719 12.678 6.127 1.00 0.00 H new ATOM 0 HA ASP A 424 2.675 15.203 7.177 1.00 0.00 H new ATOM 0 HB2 ASP A 424 2.234 12.701 7.992 1.00 0.00 H new ATOM 0 HB3 ASP A 424 3.749 12.926 8.843 1.00 0.00 H new ATOM 908 N SER A 425 5.526 15.352 6.674 1.00 0.00 N ATOM 909 CA SER A 425 6.844 15.935 6.910 1.00 0.00 C ATOM 910 C SER A 425 6.949 17.340 6.314 1.00 0.00 C ATOM 911 O SER A 425 7.842 18.108 6.672 1.00 0.00 O ATOM 912 CB SER A 425 7.931 15.033 6.321 1.00 0.00 C ATOM 913 OG SER A 425 8.768 14.511 7.340 1.00 0.00 O ATOM 0 H SER A 425 5.275 15.261 5.690 1.00 0.00 H new ATOM 0 HA SER A 425 6.986 16.016 7.988 1.00 0.00 H new ATOM 0 HB2 SER A 425 7.469 14.214 5.770 1.00 0.00 H new ATOM 0 HB3 SER A 425 8.530 15.599 5.608 1.00 0.00 H new ATOM 0 HG SER A 425 9.453 13.937 6.938 1.00 0.00 H new ATOM 919 N VAL A 426 6.037 17.670 5.401 1.00 0.00 N ATOM 920 CA VAL A 426 6.037 18.980 4.758 1.00 0.00 C ATOM 921 C VAL A 426 5.716 20.089 5.755 1.00 0.00 C ATOM 922 O VAL A 426 4.826 19.944 6.595 1.00 0.00 O ATOM 923 CB VAL A 426 5.018 19.035 3.604 1.00 0.00 C ATOM 924 CG1 VAL A 426 5.397 18.049 2.509 1.00 0.00 C ATOM 925 CG2 VAL A 426 3.613 18.760 4.117 1.00 0.00 C ATOM 0 H VAL A 426 5.290 17.048 5.091 1.00 0.00 H new ATOM 0 HA VAL A 426 7.040 19.135 4.361 1.00 0.00 H new ATOM 0 HB VAL A 426 5.033 20.038 3.178 1.00 0.00 H new ATOM 0 HG11 VAL A 426 4.666 18.102 1.702 1.00 0.00 H new ATOM 0 HG12 VAL A 426 6.384 18.298 2.121 1.00 0.00 H new ATOM 0 HG13 VAL A 426 5.413 17.039 2.918 1.00 0.00 H new ATOM 0 HG21 VAL A 426 2.908 18.803 3.287 1.00 0.00 H new ATOM 0 HG22 VAL A 426 3.579 17.770 4.571 1.00 0.00 H new ATOM 0 HG23 VAL A 426 3.344 19.510 4.861 1.00 0.00 H new ATOM 935 N GLU A 427 6.445 21.197 5.656 1.00 0.00 N ATOM 936 CA GLU A 427 6.236 22.332 6.548 1.00 0.00 C ATOM 937 C GLU A 427 5.167 23.270 5.993 1.00 0.00 C ATOM 938 O GLU A 427 5.477 24.239 5.301 1.00 0.00 O ATOM 939 CB GLU A 427 7.545 23.097 6.751 1.00 0.00 C ATOM 940 CG GLU A 427 8.439 22.501 7.825 1.00 0.00 C ATOM 941 CD GLU A 427 9.476 23.485 8.332 1.00 0.00 C ATOM 942 OE1 GLU A 427 9.189 24.700 8.335 1.00 0.00 O ATOM 943 OE2 GLU A 427 10.573 23.038 8.728 1.00 0.00 O ATOM 0 H GLU A 427 7.185 21.333 4.967 1.00 0.00 H new ATOM 0 HA GLU A 427 5.895 21.948 7.509 1.00 0.00 H new ATOM 0 HB2 GLU A 427 8.091 23.122 5.808 1.00 0.00 H new ATOM 0 HB3 GLU A 427 7.315 24.130 7.013 1.00 0.00 H new ATOM 0 HG2 GLU A 427 7.824 22.165 8.660 1.00 0.00 H new ATOM 0 HG3 GLU A 427 8.943 21.621 7.426 1.00 0.00 H new ATOM 950 N THR A 428 3.909 22.974 6.304 1.00 0.00 N ATOM 951 CA THR A 428 2.794 23.793 5.839 1.00 0.00 C ATOM 952 C THR A 428 2.573 24.983 6.766 1.00 0.00 C ATOM 953 O THR A 428 2.525 24.831 7.986 1.00 0.00 O ATOM 954 CB THR A 428 1.518 22.954 5.755 1.00 0.00 C ATOM 955 OG1 THR A 428 1.405 22.100 6.880 1.00 0.00 O ATOM 956 CG2 THR A 428 1.451 22.088 4.514 1.00 0.00 C ATOM 0 H THR A 428 3.636 22.174 6.875 1.00 0.00 H new ATOM 0 HA THR A 428 3.039 24.168 4.845 1.00 0.00 H new ATOM 0 HB THR A 428 0.701 23.674 5.721 1.00 0.00 H new ATOM 0 HG1 THR A 428 1.063 22.609 7.644 1.00 0.00 H new ATOM 0 HG21 THR A 428 0.521 21.519 4.517 1.00 0.00 H new ATOM 0 HG22 THR A 428 1.487 22.720 3.627 1.00 0.00 H new ATOM 0 HG23 THR A 428 2.297 21.400 4.504 1.00 0.00 H new ATOM 964 N GLY A 429 2.439 26.168 6.179 1.00 0.00 N ATOM 965 CA GLY A 429 2.223 27.366 6.970 1.00 0.00 C ATOM 966 C GLY A 429 0.752 27.692 7.141 1.00 0.00 C ATOM 967 O GLY A 429 0.177 27.455 8.204 1.00 0.00 O ATOM 0 H GLY A 429 2.476 26.320 5.171 1.00 0.00 H new ATOM 0 HA2 GLY A 429 2.680 27.237 7.951 1.00 0.00 H new ATOM 0 HA3 GLY A 429 2.725 28.208 6.493 1.00 0.00 H new ATOM 971 N GLY A 430 0.143 28.234 6.093 1.00 0.00 N ATOM 972 CA GLY A 430 -1.265 28.584 6.151 1.00 0.00 C ATOM 973 C GLY A 430 -2.037 28.076 4.949 1.00 0.00 C ATOM 974 O GLY A 430 -2.846 28.802 4.372 1.00 0.00 O ATOM 0 H GLY A 430 0.599 28.438 5.203 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -1.702 28.172 7.061 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -1.365 29.668 6.212 1.00 0.00 H new ATOM 978 N GLN A 431 -1.785 26.827 4.572 1.00 0.00 N ATOM 979 CA GLN A 431 -2.463 26.222 3.431 1.00 0.00 C ATOM 980 C GLN A 431 -3.492 25.195 3.892 1.00 0.00 C ATOM 981 O GLN A 431 -3.169 24.024 4.091 1.00 0.00 O ATOM 982 CB GLN A 431 -1.444 25.560 2.501 1.00 0.00 C ATOM 983 CG GLN A 431 -0.406 26.525 1.952 1.00 0.00 C ATOM 984 CD GLN A 431 0.972 25.902 1.849 1.00 0.00 C ATOM 985 OE1 GLN A 431 1.566 25.852 0.771 1.00 0.00 O ATOM 986 NE2 GLN A 431 1.488 25.420 2.973 1.00 0.00 N ATOM 0 H GLN A 431 -1.117 26.214 5.039 1.00 0.00 H new ATOM 0 HA GLN A 431 -2.983 27.010 2.887 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -0.936 24.762 3.042 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -1.972 25.095 1.669 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -0.720 26.868 0.966 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -0.356 27.404 2.595 1.00 0.00 H new ATOM 0 HE21 GLN A 431 0.961 25.483 3.844 1.00 0.00 H new ATOM 0 HE22 GLN A 431 2.412 24.987 2.966 1.00 0.00 H new ATOM 995 N ASP A 432 -4.732 25.643 4.061 1.00 0.00 N ATOM 996 CA ASP A 432 -5.809 24.764 4.501 1.00 0.00 C ATOM 997 C ASP A 432 -6.140 23.727 3.431 1.00 0.00 C ATOM 998 O ASP A 432 -6.385 22.561 3.740 1.00 0.00 O ATOM 999 CB ASP A 432 -7.056 25.582 4.838 1.00 0.00 C ATOM 1000 CG ASP A 432 -7.990 24.850 5.783 1.00 0.00 C ATOM 1001 OD1 ASP A 432 -7.752 24.899 7.008 1.00 0.00 O ATOM 1002 OD2 ASP A 432 -8.958 24.228 5.298 1.00 0.00 O ATOM 0 H ASP A 432 -5.016 26.609 3.900 1.00 0.00 H new ATOM 0 HA ASP A 432 -5.473 24.240 5.396 1.00 0.00 H new ATOM 0 HB2 ASP A 432 -6.756 26.528 5.289 1.00 0.00 H new ATOM 0 HB3 ASP A 432 -7.589 25.822 3.918 1.00 0.00 H new ATOM 1007 N SER A 433 -6.144 24.159 2.175 1.00 0.00 N ATOM 1008 CA SER A 433 -6.445 23.266 1.061 1.00 0.00 C ATOM 1009 C SER A 433 -5.467 22.097 1.023 1.00 0.00 C ATOM 1010 O SER A 433 -5.865 20.945 0.844 1.00 0.00 O ATOM 1011 CB SER A 433 -6.395 24.034 -0.262 1.00 0.00 C ATOM 1012 OG SER A 433 -5.123 24.626 -0.461 1.00 0.00 O ATOM 0 H SER A 433 -5.943 25.121 1.902 1.00 0.00 H new ATOM 0 HA SER A 433 -7.450 22.870 1.205 1.00 0.00 H new ATOM 0 HB2 SER A 433 -6.618 23.358 -1.087 1.00 0.00 H new ATOM 0 HB3 SER A 433 -7.164 24.807 -0.267 1.00 0.00 H new ATOM 0 HG SER A 433 -5.117 25.109 -1.314 1.00 0.00 H new ATOM 1018 N VAL A 434 -4.185 22.402 1.195 1.00 0.00 N ATOM 1019 CA VAL A 434 -3.150 21.377 1.183 1.00 0.00 C ATOM 1020 C VAL A 434 -3.324 20.412 2.350 1.00 0.00 C ATOM 1021 O VAL A 434 -3.138 19.204 2.203 1.00 0.00 O ATOM 1022 CB VAL A 434 -1.741 21.999 1.247 1.00 0.00 C ATOM 1023 CG1 VAL A 434 -0.672 20.923 1.133 1.00 0.00 C ATOM 1024 CG2 VAL A 434 -1.570 23.045 0.155 1.00 0.00 C ATOM 0 H VAL A 434 -3.839 23.350 1.344 1.00 0.00 H new ATOM 0 HA VAL A 434 -3.253 20.832 0.245 1.00 0.00 H new ATOM 0 HB VAL A 434 -1.626 22.490 2.213 1.00 0.00 H new ATOM 0 HG11 VAL A 434 0.315 21.384 1.180 1.00 0.00 H new ATOM 0 HG12 VAL A 434 -0.781 20.214 1.953 1.00 0.00 H new ATOM 0 HG13 VAL A 434 -0.783 20.399 0.183 1.00 0.00 H new ATOM 0 HG21 VAL A 434 -0.570 23.474 0.215 1.00 0.00 H new ATOM 0 HG22 VAL A 434 -1.707 22.578 -0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 434 -2.311 23.833 0.287 1.00 0.00 H new ATOM 1034 N ARG A 435 -3.682 20.953 3.511 1.00 0.00 N ATOM 1035 CA ARG A 435 -3.882 20.141 4.705 1.00 0.00 C ATOM 1036 C ARG A 435 -4.961 19.088 4.473 1.00 0.00 C ATOM 1037 O ARG A 435 -4.810 17.933 4.871 1.00 0.00 O ATOM 1038 CB ARG A 435 -4.265 21.026 5.893 1.00 0.00 C ATOM 1039 CG ARG A 435 -4.021 20.369 7.243 1.00 0.00 C ATOM 1040 CD ARG A 435 -2.574 20.518 7.684 1.00 0.00 C ATOM 1041 NE ARG A 435 -1.966 19.230 8.011 1.00 0.00 N ATOM 1042 CZ ARG A 435 -0.653 19.026 8.079 1.00 0.00 C ATOM 1043 NH1 ARG A 435 0.194 20.021 7.843 1.00 0.00 N ATOM 1044 NH2 ARG A 435 -0.184 17.823 8.383 1.00 0.00 N ATOM 0 H ARG A 435 -3.839 21.951 3.649 1.00 0.00 H new ATOM 0 HA ARG A 435 -2.944 19.632 4.928 1.00 0.00 H new ATOM 0 HB2 ARG A 435 -3.697 21.955 5.842 1.00 0.00 H new ATOM 0 HB3 ARG A 435 -5.319 21.292 5.813 1.00 0.00 H new ATOM 0 HG2 ARG A 435 -4.677 20.816 7.990 1.00 0.00 H new ATOM 0 HG3 ARG A 435 -4.277 19.311 7.185 1.00 0.00 H new ATOM 0 HD2 ARG A 435 -2.001 20.998 6.891 1.00 0.00 H new ATOM 0 HD3 ARG A 435 -2.526 21.173 8.554 1.00 0.00 H new ATOM 0 HE ARG A 435 -2.585 18.441 8.198 1.00 0.00 H new ATOM 0 HH11 ARG A 435 -0.161 20.948 7.608 1.00 0.00 H new ATOM 0 HH12 ARG A 435 1.200 19.858 7.897 1.00 0.00 H new ATOM 0 HH21 ARG A 435 -0.830 17.055 8.565 1.00 0.00 H new ATOM 0 HH22 ARG A 435 0.823 17.666 8.435 1.00 0.00 H new ATOM 1058 N GLN A 436 -6.047 19.494 3.826 1.00 0.00 N ATOM 1059 CA GLN A 436 -7.150 18.585 3.540 1.00 0.00 C ATOM 1060 C GLN A 436 -6.689 17.449 2.632 1.00 0.00 C ATOM 1061 O GLN A 436 -7.127 16.307 2.777 1.00 0.00 O ATOM 1062 CB GLN A 436 -8.308 19.340 2.885 1.00 0.00 C ATOM 1063 CG GLN A 436 -9.591 18.529 2.798 1.00 0.00 C ATOM 1064 CD GLN A 436 -10.127 18.431 1.383 1.00 0.00 C ATOM 1065 OE1 GLN A 436 -11.133 19.055 1.042 1.00 0.00 O ATOM 1066 NE2 GLN A 436 -9.456 17.646 0.549 1.00 0.00 N ATOM 0 H GLN A 436 -6.187 20.447 3.490 1.00 0.00 H new ATOM 0 HA GLN A 436 -7.494 18.160 4.483 1.00 0.00 H new ATOM 0 HB2 GLN A 436 -8.502 20.252 3.450 1.00 0.00 H new ATOM 0 HB3 GLN A 436 -8.011 19.644 1.881 1.00 0.00 H new ATOM 0 HG2 GLN A 436 -9.409 17.526 3.183 1.00 0.00 H new ATOM 0 HG3 GLN A 436 -10.347 18.984 3.438 1.00 0.00 H new ATOM 0 HE21 GLN A 436 -8.627 17.147 0.873 1.00 0.00 H new ATOM 0 HE22 GLN A 436 -9.769 17.542 -0.416 1.00 0.00 H new ATOM 1075 N ALA A 437 -5.801 17.770 1.697 1.00 0.00 N ATOM 1076 CA ALA A 437 -5.277 16.778 0.767 1.00 0.00 C ATOM 1077 C ALA A 437 -4.530 15.671 1.504 1.00 0.00 C ATOM 1078 O ALA A 437 -4.650 14.496 1.161 1.00 0.00 O ATOM 1079 CB ALA A 437 -4.366 17.444 -0.253 1.00 0.00 C ATOM 0 H ALA A 437 -5.429 18.710 1.564 1.00 0.00 H new ATOM 0 HA ALA A 437 -6.120 16.324 0.246 1.00 0.00 H new ATOM 0 HB1 ALA A 437 -3.981 16.693 -0.942 1.00 0.00 H new ATOM 0 HB2 ALA A 437 -4.929 18.192 -0.810 1.00 0.00 H new ATOM 0 HB3 ALA A 437 -3.534 17.925 0.261 1.00 0.00 H new ATOM 1085 N ARG A 438 -3.759 16.054 2.518 1.00 0.00 N ATOM 1086 CA ARG A 438 -2.993 15.088 3.299 1.00 0.00 C ATOM 1087 C ARG A 438 -3.919 14.173 4.093 1.00 0.00 C ATOM 1088 O ARG A 438 -3.719 12.958 4.133 1.00 0.00 O ATOM 1089 CB ARG A 438 -2.028 15.807 4.248 1.00 0.00 C ATOM 1090 CG ARG A 438 -1.289 16.973 3.607 1.00 0.00 C ATOM 1091 CD ARG A 438 -0.637 16.576 2.290 1.00 0.00 C ATOM 1092 NE ARG A 438 0.821 16.642 2.358 1.00 0.00 N ATOM 1093 CZ ARG A 438 1.633 15.865 1.643 1.00 0.00 C ATOM 1094 NH1 ARG A 438 1.138 14.965 0.802 1.00 0.00 N ATOM 1095 NH2 ARG A 438 2.947 15.990 1.769 1.00 0.00 N ATOM 0 H ARG A 438 -3.648 17.023 2.817 1.00 0.00 H new ATOM 0 HA ARG A 438 -2.416 14.478 2.604 1.00 0.00 H new ATOM 0 HB2 ARG A 438 -2.586 16.173 5.110 1.00 0.00 H new ATOM 0 HB3 ARG A 438 -1.299 15.089 4.622 1.00 0.00 H new ATOM 0 HG2 ARG A 438 -1.985 17.794 3.435 1.00 0.00 H new ATOM 0 HG3 ARG A 438 -0.526 17.341 4.293 1.00 0.00 H new ATOM 0 HD2 ARG A 438 -0.942 15.563 2.026 1.00 0.00 H new ATOM 0 HD3 ARG A 438 -0.993 17.234 1.497 1.00 0.00 H new ATOM 0 HE ARG A 438 1.242 17.323 2.990 1.00 0.00 H new ATOM 0 HH11 ARG A 438 0.128 14.864 0.699 1.00 0.00 H new ATOM 0 HH12 ARG A 438 1.767 14.374 0.259 1.00 0.00 H new ATOM 0 HH21 ARG A 438 3.334 16.680 2.413 1.00 0.00 H new ATOM 0 HH22 ARG A 438 3.571 15.396 1.222 1.00 0.00 H new ATOM 1109 N LYS A 439 -4.934 14.758 4.721 1.00 0.00 N ATOM 1110 CA LYS A 439 -5.890 13.987 5.507 1.00 0.00 C ATOM 1111 C LYS A 439 -6.524 12.890 4.657 1.00 0.00 C ATOM 1112 O LYS A 439 -6.806 11.796 5.144 1.00 0.00 O ATOM 1113 CB LYS A 439 -6.979 14.902 6.073 1.00 0.00 C ATOM 1114 CG LYS A 439 -6.464 15.899 7.098 1.00 0.00 C ATOM 1115 CD LYS A 439 -7.582 16.395 8.004 1.00 0.00 C ATOM 1116 CE LYS A 439 -7.500 15.766 9.385 1.00 0.00 C ATOM 1117 NZ LYS A 439 -6.151 15.933 9.991 1.00 0.00 N ATOM 0 H LYS A 439 -5.115 15.762 4.701 1.00 0.00 H new ATOM 0 HA LYS A 439 -5.353 13.523 6.334 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -7.447 15.446 5.253 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -7.754 14.289 6.532 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -5.685 15.433 7.701 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -6.007 16.746 6.586 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -7.525 17.480 8.093 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -8.547 16.162 7.554 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -8.249 16.219 10.035 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -7.738 14.705 9.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -6.237 15.962 11.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -5.545 15.134 9.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -5.727 16.821 9.654 1.00 0.00 H new ATOM 1131 N GLU A 440 -6.737 13.194 3.381 1.00 0.00 N ATOM 1132 CA GLU A 440 -7.330 12.237 2.455 1.00 0.00 C ATOM 1133 C GLU A 440 -6.332 11.139 2.100 1.00 0.00 C ATOM 1134 O GLU A 440 -6.713 9.995 1.856 1.00 0.00 O ATOM 1135 CB GLU A 440 -7.797 12.950 1.184 1.00 0.00 C ATOM 1136 CG GLU A 440 -8.449 12.026 0.169 1.00 0.00 C ATOM 1137 CD GLU A 440 -9.953 11.944 0.338 1.00 0.00 C ATOM 1138 OE1 GLU A 440 -10.642 12.930 0.004 1.00 0.00 O ATOM 1139 OE2 GLU A 440 -10.443 10.893 0.804 1.00 0.00 O ATOM 0 H GLU A 440 -6.507 14.096 2.965 1.00 0.00 H new ATOM 0 HA GLU A 440 -8.190 11.778 2.942 1.00 0.00 H new ATOM 0 HB2 GLU A 440 -8.505 13.733 1.457 1.00 0.00 H new ATOM 0 HB3 GLU A 440 -6.942 13.441 0.719 1.00 0.00 H new ATOM 0 HG2 GLU A 440 -8.219 12.377 -0.837 1.00 0.00 H new ATOM 0 HG3 GLU A 440 -8.021 11.028 0.264 1.00 0.00 H new ATOM 1146 N ALA A 441 -5.052 11.499 2.074 1.00 0.00 N ATOM 1147 CA ALA A 441 -3.996 10.547 1.750 1.00 0.00 C ATOM 1148 C ALA A 441 -3.834 9.511 2.856 1.00 0.00 C ATOM 1149 O ALA A 441 -3.714 8.316 2.588 1.00 0.00 O ATOM 1150 CB ALA A 441 -2.684 11.277 1.511 1.00 0.00 C ATOM 0 H ALA A 441 -4.722 12.443 2.273 1.00 0.00 H new ATOM 0 HA ALA A 441 -4.279 10.024 0.837 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -1.904 10.554 1.270 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -2.801 11.974 0.681 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -2.404 11.826 2.410 1.00 0.00 H new ATOM 1156 N VAL A 442 -3.836 9.977 4.101 1.00 0.00 N ATOM 1157 CA VAL A 442 -3.692 9.091 5.249 1.00 0.00 C ATOM 1158 C VAL A 442 -4.860 8.113 5.326 1.00 0.00 C ATOM 1159 O VAL A 442 -4.680 6.937 5.648 1.00 0.00 O ATOM 1160 CB VAL A 442 -3.613 9.887 6.566 1.00 0.00 C ATOM 1161 CG1 VAL A 442 -3.358 8.957 7.743 1.00 0.00 C ATOM 1162 CG2 VAL A 442 -2.532 10.955 6.480 1.00 0.00 C ATOM 0 H VAL A 442 -3.936 10.964 4.340 1.00 0.00 H new ATOM 0 HA VAL A 442 -2.762 8.538 5.115 1.00 0.00 H new ATOM 0 HB VAL A 442 -4.571 10.381 6.726 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -3.306 9.540 8.663 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -4.170 8.233 7.818 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -2.415 8.431 7.593 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -2.491 11.507 7.419 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -1.568 10.482 6.294 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -2.763 11.641 5.665 1.00 0.00 H new ATOM 1172 N CYS A 443 -6.056 8.605 5.021 1.00 0.00 N ATOM 1173 CA CYS A 443 -7.253 7.773 5.048 1.00 0.00 C ATOM 1174 C CYS A 443 -7.126 6.622 4.057 1.00 0.00 C ATOM 1175 O CYS A 443 -7.545 5.498 4.335 1.00 0.00 O ATOM 1176 CB CYS A 443 -8.490 8.613 4.723 1.00 0.00 C ATOM 1177 SG CYS A 443 -9.944 8.202 5.717 1.00 0.00 S ATOM 0 H CYS A 443 -6.222 9.575 4.752 1.00 0.00 H new ATOM 0 HA CYS A 443 -7.362 7.358 6.050 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -8.249 9.666 4.869 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -8.736 8.485 3.669 1.00 0.00 H new ATOM 0 HG CYS A 443 -10.937 8.967 5.371 1.00 0.00 H new ATOM 1183 N LYS A 444 -6.536 6.909 2.902 1.00 0.00 N ATOM 1184 CA LYS A 444 -6.344 5.896 1.874 1.00 0.00 C ATOM 1185 C LYS A 444 -5.414 4.799 2.378 1.00 0.00 C ATOM 1186 O LYS A 444 -5.590 3.626 2.054 1.00 0.00 O ATOM 1187 CB LYS A 444 -5.772 6.525 0.603 1.00 0.00 C ATOM 1188 CG LYS A 444 -6.193 5.812 -0.672 1.00 0.00 C ATOM 1189 CD LYS A 444 -6.885 6.757 -1.642 1.00 0.00 C ATOM 1190 CE LYS A 444 -6.846 6.222 -3.063 1.00 0.00 C ATOM 1191 NZ LYS A 444 -5.563 6.546 -3.744 1.00 0.00 N ATOM 0 H LYS A 444 -6.183 7.834 2.655 1.00 0.00 H new ATOM 0 HA LYS A 444 -7.313 5.456 1.640 1.00 0.00 H new ATOM 0 HB2 LYS A 444 -6.089 7.566 0.549 1.00 0.00 H new ATOM 0 HB3 LYS A 444 -4.684 6.526 0.666 1.00 0.00 H new ATOM 0 HG2 LYS A 444 -5.317 5.376 -1.151 1.00 0.00 H new ATOM 0 HG3 LYS A 444 -6.864 4.989 -0.424 1.00 0.00 H new ATOM 0 HD2 LYS A 444 -7.921 6.901 -1.335 1.00 0.00 H new ATOM 0 HD3 LYS A 444 -6.403 7.734 -1.606 1.00 0.00 H new ATOM 0 HE2 LYS A 444 -6.986 5.141 -3.048 1.00 0.00 H new ATOM 0 HE3 LYS A 444 -7.675 6.643 -3.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 -5.577 6.163 -4.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 -5.441 7.578 -3.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 -4.773 6.123 -3.216 1.00 0.00 H new ATOM 1205 N ILE A 445 -4.428 5.190 3.180 1.00 0.00 N ATOM 1206 CA ILE A 445 -3.473 4.236 3.735 1.00 0.00 C ATOM 1207 C ILE A 445 -4.164 3.279 4.692 1.00 0.00 C ATOM 1208 O ILE A 445 -3.770 2.120 4.825 1.00 0.00 O ATOM 1209 CB ILE A 445 -2.316 4.941 4.478 1.00 0.00 C ATOM 1210 CG1 ILE A 445 -1.908 6.235 3.764 1.00 0.00 C ATOM 1211 CG2 ILE A 445 -1.122 4.005 4.610 1.00 0.00 C ATOM 1212 CD1 ILE A 445 -1.820 6.107 2.258 1.00 0.00 C ATOM 0 H ILE A 445 -4.269 6.158 3.460 1.00 0.00 H new ATOM 0 HA ILE A 445 -3.058 3.682 2.893 1.00 0.00 H new ATOM 0 HB ILE A 445 -2.666 5.204 5.476 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -2.627 7.016 4.010 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -0.941 6.560 4.148 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -0.315 4.516 5.135 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -1.416 3.118 5.171 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -0.779 3.710 3.618 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -1.526 7.065 1.828 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -1.079 5.351 2.000 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -2.792 5.814 1.860 1.00 0.00 H new ATOM 1224 N GLN A 446 -5.201 3.773 5.351 1.00 0.00 N ATOM 1225 CA GLN A 446 -5.965 2.979 6.293 1.00 0.00 C ATOM 1226 C GLN A 446 -6.693 1.848 5.570 1.00 0.00 C ATOM 1227 O GLN A 446 -6.694 0.705 6.025 1.00 0.00 O ATOM 1228 CB GLN A 446 -6.957 3.884 7.021 1.00 0.00 C ATOM 1229 CG GLN A 446 -7.975 3.145 7.864 1.00 0.00 C ATOM 1230 CD GLN A 446 -7.737 3.324 9.350 1.00 0.00 C ATOM 1231 OE1 GLN A 446 -8.675 3.510 10.124 1.00 0.00 O ATOM 1232 NE2 GLN A 446 -6.473 3.271 9.753 1.00 0.00 N ATOM 0 H GLN A 446 -5.533 4.732 5.247 1.00 0.00 H new ATOM 0 HA GLN A 446 -5.290 2.529 7.021 1.00 0.00 H new ATOM 0 HB2 GLN A 446 -6.402 4.570 7.661 1.00 0.00 H new ATOM 0 HB3 GLN A 446 -7.484 4.491 6.285 1.00 0.00 H new ATOM 0 HG2 GLN A 446 -8.975 3.499 7.614 1.00 0.00 H new ATOM 0 HG3 GLN A 446 -7.943 2.083 7.619 1.00 0.00 H new ATOM 0 HE21 GLN A 446 -5.728 3.115 9.075 1.00 0.00 H new ATOM 0 HE22 GLN A 446 -6.247 3.387 10.741 1.00 0.00 H new ATOM 1241 N ALA A 447 -7.305 2.177 4.436 1.00 0.00 N ATOM 1242 CA ALA A 447 -8.030 1.190 3.644 1.00 0.00 C ATOM 1243 C ALA A 447 -7.081 0.128 3.100 1.00 0.00 C ATOM 1244 O ALA A 447 -7.416 -1.055 3.049 1.00 0.00 O ATOM 1245 CB ALA A 447 -8.774 1.872 2.505 1.00 0.00 C ATOM 0 H ALA A 447 -7.313 3.119 4.046 1.00 0.00 H new ATOM 0 HA ALA A 447 -8.756 0.697 4.291 1.00 0.00 H new ATOM 0 HB1 ALA A 447 -9.311 1.124 1.922 1.00 0.00 H new ATOM 0 HB2 ALA A 447 -9.484 2.592 2.913 1.00 0.00 H new ATOM 0 HB3 ALA A 447 -8.061 2.390 1.863 1.00 0.00 H new ATOM 1251 N ILE A 448 -5.890 0.563 2.699 1.00 0.00 N ATOM 1252 CA ILE A 448 -4.880 -0.339 2.161 1.00 0.00 C ATOM 1253 C ILE A 448 -4.241 -1.162 3.271 1.00 0.00 C ATOM 1254 O ILE A 448 -3.911 -2.333 3.083 1.00 0.00 O ATOM 1255 CB ILE A 448 -3.778 0.429 1.409 1.00 0.00 C ATOM 1256 CG1 ILE A 448 -4.403 1.405 0.414 1.00 0.00 C ATOM 1257 CG2 ILE A 448 -2.842 -0.538 0.699 1.00 0.00 C ATOM 1258 CD1 ILE A 448 -3.494 2.553 0.037 1.00 0.00 C ATOM 0 H ILE A 448 -5.601 1.540 2.737 1.00 0.00 H new ATOM 0 HA ILE A 448 -5.388 -1.002 1.461 1.00 0.00 H new ATOM 0 HB ILE A 448 -3.193 0.998 2.132 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -4.681 0.861 -0.489 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -5.322 1.806 0.840 1.00 0.00 H new ATOM 0 HG21 ILE A 448 -2.070 0.023 0.173 1.00 0.00 H new ATOM 0 HG22 ILE A 448 -2.376 -1.197 1.431 1.00 0.00 H new ATOM 0 HG23 ILE A 448 -3.409 -1.134 -0.017 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -4.005 3.204 -0.672 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -3.236 3.121 0.931 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -2.585 2.162 -0.420 1.00 0.00 H new ATOM 1270 N LEU A 449 -4.065 -0.536 4.430 1.00 0.00 N ATOM 1271 CA LEU A 449 -3.459 -1.206 5.577 1.00 0.00 C ATOM 1272 C LEU A 449 -4.243 -2.462 5.943 1.00 0.00 C ATOM 1273 O LEU A 449 -3.673 -3.548 6.062 1.00 0.00 O ATOM 1274 CB LEU A 449 -3.402 -0.253 6.775 1.00 0.00 C ATOM 1275 CG LEU A 449 -1.994 0.196 7.179 1.00 0.00 C ATOM 1276 CD1 LEU A 449 -1.943 1.706 7.357 1.00 0.00 C ATOM 1277 CD2 LEU A 449 -1.556 -0.506 8.456 1.00 0.00 C ATOM 0 H LEU A 449 -4.333 0.433 4.601 1.00 0.00 H new ATOM 0 HA LEU A 449 -2.444 -1.499 5.308 1.00 0.00 H new ATOM 0 HB2 LEU A 449 -3.997 0.631 6.546 1.00 0.00 H new ATOM 0 HB3 LEU A 449 -3.871 -0.740 7.630 1.00 0.00 H new ATOM 0 HG LEU A 449 -1.305 -0.079 6.380 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -0.935 2.005 7.644 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -2.213 2.192 6.419 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -2.645 2.005 8.135 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -0.554 -0.175 8.728 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -2.249 -0.263 9.261 1.00 0.00 H new ATOM 0 HD23 LEU A 449 -1.551 -1.584 8.295 1.00 0.00 H new ATOM 1289 N GLU A 450 -5.553 -2.315 6.108 1.00 0.00 N ATOM 1290 CA GLU A 450 -6.403 -3.448 6.444 1.00 0.00 C ATOM 1291 C GLU A 450 -6.420 -4.447 5.297 1.00 0.00 C ATOM 1292 O GLU A 450 -6.485 -5.657 5.515 1.00 0.00 O ATOM 1293 CB GLU A 450 -7.825 -2.981 6.760 1.00 0.00 C ATOM 1294 CG GLU A 450 -8.488 -2.229 5.619 1.00 0.00 C ATOM 1295 CD GLU A 450 -9.716 -1.458 6.063 1.00 0.00 C ATOM 1296 OE1 GLU A 450 -9.557 -0.469 6.810 1.00 0.00 O ATOM 1297 OE2 GLU A 450 -10.835 -1.843 5.665 1.00 0.00 O ATOM 0 H GLU A 450 -6.046 -1.427 6.015 1.00 0.00 H new ATOM 0 HA GLU A 450 -5.996 -3.934 7.331 1.00 0.00 H new ATOM 0 HB2 GLU A 450 -8.435 -3.848 7.015 1.00 0.00 H new ATOM 0 HB3 GLU A 450 -7.800 -2.339 7.641 1.00 0.00 H new ATOM 0 HG2 GLU A 450 -7.769 -1.538 5.179 1.00 0.00 H new ATOM 0 HG3 GLU A 450 -8.770 -2.936 4.839 1.00 0.00 H new ATOM 1304 N LYS A 451 -6.340 -3.935 4.073 1.00 0.00 N ATOM 1305 CA LYS A 451 -6.325 -4.788 2.894 1.00 0.00 C ATOM 1306 C LYS A 451 -5.132 -5.734 2.955 1.00 0.00 C ATOM 1307 O LYS A 451 -5.194 -6.864 2.472 1.00 0.00 O ATOM 1308 CB LYS A 451 -6.260 -3.943 1.619 1.00 0.00 C ATOM 1309 CG LYS A 451 -6.855 -4.633 0.402 1.00 0.00 C ATOM 1310 CD LYS A 451 -8.249 -4.112 0.090 1.00 0.00 C ATOM 1311 CE LYS A 451 -9.309 -4.814 0.925 1.00 0.00 C ATOM 1312 NZ LYS A 451 -10.215 -3.845 1.601 1.00 0.00 N ATOM 0 H LYS A 451 -6.285 -2.936 3.874 1.00 0.00 H new ATOM 0 HA LYS A 451 -7.245 -5.372 2.874 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.787 -3.004 1.788 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -5.220 -3.692 1.412 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -6.206 -4.476 -0.460 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -6.898 -5.708 0.577 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -8.288 -3.039 0.279 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -8.464 -4.257 -0.969 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -9.895 -5.475 0.286 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -8.825 -5.441 1.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -10.923 -4.363 2.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -9.659 -3.231 2.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -10.697 -3.263 0.886 1.00 0.00 H new ATOM 1326 N LEU A 452 -4.050 -5.261 3.568 1.00 0.00 N ATOM 1327 CA LEU A 452 -2.842 -6.059 3.715 1.00 0.00 C ATOM 1328 C LEU A 452 -3.047 -7.147 4.761 1.00 0.00 C ATOM 1329 O LEU A 452 -2.543 -8.261 4.620 1.00 0.00 O ATOM 1330 CB LEU A 452 -1.660 -5.174 4.119 1.00 0.00 C ATOM 1331 CG LEU A 452 -0.967 -4.445 2.965 1.00 0.00 C ATOM 1332 CD1 LEU A 452 -1.196 -2.942 3.060 1.00 0.00 C ATOM 1333 CD2 LEU A 452 0.524 -4.761 2.953 1.00 0.00 C ATOM 0 H LEU A 452 -3.988 -4.326 3.971 1.00 0.00 H new ATOM 0 HA LEU A 452 -2.624 -6.525 2.754 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -2.011 -4.433 4.837 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -0.923 -5.792 4.632 1.00 0.00 H new ATOM 0 HG LEU A 452 -1.401 -4.796 2.029 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -0.695 -2.444 2.230 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -2.265 -2.733 3.016 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.793 -2.571 4.002 1.00 0.00 H new ATOM 0 HD21 LEU A 452 1.001 -4.234 2.126 1.00 0.00 H new ATOM 0 HD22 LEU A 452 0.971 -4.440 3.894 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.667 -5.835 2.830 1.00 0.00 H new ATOM 1345 N GLU A 453 -3.793 -6.816 5.814 1.00 0.00 N ATOM 1346 CA GLU A 453 -4.064 -7.768 6.888 1.00 0.00 C ATOM 1347 C GLU A 453 -4.705 -9.041 6.341 1.00 0.00 C ATOM 1348 O GLU A 453 -4.523 -10.125 6.894 1.00 0.00 O ATOM 1349 CB GLU A 453 -4.976 -7.135 7.940 1.00 0.00 C ATOM 1350 CG GLU A 453 -4.220 -6.494 9.094 1.00 0.00 C ATOM 1351 CD GLU A 453 -4.298 -7.313 10.367 1.00 0.00 C ATOM 1352 OE1 GLU A 453 -5.422 -7.682 10.769 1.00 0.00 O ATOM 1353 OE2 GLU A 453 -3.235 -7.585 10.964 1.00 0.00 O ATOM 0 H GLU A 453 -4.219 -5.899 5.945 1.00 0.00 H new ATOM 0 HA GLU A 453 -3.114 -8.033 7.352 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -5.600 -6.380 7.461 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -5.646 -7.899 8.335 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -3.175 -6.365 8.812 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -4.624 -5.499 9.281 1.00 0.00 H new ATOM 1360 N LYS A 454 -5.454 -8.903 5.251 1.00 0.00 N ATOM 1361 CA LYS A 454 -6.117 -10.046 4.633 1.00 0.00 C ATOM 1362 C LYS A 454 -5.291 -10.612 3.481 1.00 0.00 C ATOM 1363 O LYS A 454 -5.553 -11.714 3.000 1.00 0.00 O ATOM 1364 CB LYS A 454 -7.511 -9.649 4.139 1.00 0.00 C ATOM 1365 CG LYS A 454 -8.624 -10.522 4.694 1.00 0.00 C ATOM 1366 CD LYS A 454 -8.877 -11.732 3.809 1.00 0.00 C ATOM 1367 CE LYS A 454 -8.059 -12.932 4.260 1.00 0.00 C ATOM 1368 NZ LYS A 454 -8.581 -13.516 5.527 1.00 0.00 N ATOM 0 H LYS A 454 -5.617 -8.014 4.779 1.00 0.00 H new ATOM 0 HA LYS A 454 -6.216 -10.824 5.390 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -7.703 -8.612 4.414 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -7.530 -9.699 3.050 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -8.361 -10.853 5.699 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -9.539 -9.936 4.781 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -9.937 -11.984 3.830 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -8.628 -11.488 2.776 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -8.069 -13.692 3.479 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -7.021 -12.632 4.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -8.354 -14.530 5.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -8.141 -13.035 6.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -9.613 -13.391 5.568 1.00 0.00 H new ATOM 1382 N LYS A 455 -4.293 -9.854 3.043 1.00 0.00 N ATOM 1383 CA LYS A 455 -3.430 -10.283 1.952 1.00 0.00 C ATOM 1384 C LYS A 455 -2.342 -11.218 2.456 1.00 0.00 C ATOM 1385 O LYS A 455 -1.821 -12.049 1.712 1.00 0.00 O ATOM 1386 CB LYS A 455 -2.782 -9.069 1.304 1.00 0.00 C ATOM 1387 CG LYS A 455 -3.723 -8.281 0.426 1.00 0.00 C ATOM 1388 CD LYS A 455 -3.767 -8.854 -0.968 1.00 0.00 C ATOM 1389 CE LYS A 455 -5.172 -8.791 -1.540 1.00 0.00 C ATOM 1390 NZ LYS A 455 -5.338 -7.657 -2.490 1.00 0.00 N ATOM 0 H LYS A 455 -4.062 -8.938 3.428 1.00 0.00 H new ATOM 0 HA LYS A 455 -4.041 -10.815 1.223 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -2.393 -8.415 2.084 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -1.930 -9.397 0.708 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -4.723 -8.290 0.859 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -3.403 -7.240 0.385 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -3.083 -8.302 -1.613 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -3.424 -9.888 -0.950 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -5.398 -9.727 -2.050 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -5.890 -8.690 -0.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -6.351 -7.492 -2.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -4.911 -6.800 -2.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -4.869 -7.886 -3.389 1.00 0.00 H new ATOM 1404 N GLY A 456 -2.003 -11.070 3.727 1.00 0.00 N ATOM 1405 CA GLY A 456 -0.976 -11.899 4.327 1.00 0.00 C ATOM 1406 C GLY A 456 -1.519 -13.217 4.843 1.00 0.00 C ATOM 1407 O GLY A 456 -1.691 -14.167 4.079 1.00 0.00 O ATOM 0 H GLY A 456 -2.423 -10.387 4.358 1.00 0.00 H new ATOM 0 HA2 GLY A 456 -0.196 -12.095 3.591 1.00 0.00 H new ATOM 0 HA3 GLY A 456 -0.510 -11.356 5.149 1.00 0.00 H new ATOM 1411 N LEU A 457 -1.790 -13.275 6.143 1.00 0.00 N ATOM 1412 CA LEU A 457 -2.315 -14.486 6.762 1.00 0.00 C ATOM 1413 C LEU A 457 -1.353 -15.655 6.570 1.00 0.00 C ATOM 1414 O LEU A 457 -0.543 -15.910 7.486 1.00 0.00 O ATOM 1415 CB LEU A 457 -3.684 -14.831 6.170 1.00 0.00 C ATOM 1416 CG LEU A 457 -4.721 -15.333 7.180 1.00 0.00 C ATOM 1417 CD1 LEU A 457 -5.794 -14.281 7.415 1.00 0.00 C ATOM 1418 CD2 LEU A 457 -5.347 -16.635 6.702 1.00 0.00 C ATOM 1419 OXT LEU A 457 -1.417 -16.304 5.505 1.00 0.00 O ATOM 0 H LEU A 457 -1.654 -12.497 6.788 1.00 0.00 H new ATOM 0 HA LEU A 457 -2.425 -14.303 7.831 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -4.082 -13.946 5.674 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -3.549 -15.593 5.402 1.00 0.00 H new ATOM 0 HG LEU A 457 -4.213 -15.522 8.126 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -6.521 -14.657 8.135 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -5.334 -13.373 7.804 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -6.297 -14.058 6.474 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -6.081 -16.976 7.433 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -5.839 -16.472 5.743 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -4.571 -17.392 6.588 1.00 0.00 H new