USER MOD reduce.3.24.130724 H: found=0, std=0, add=297, rem=0, adj=1 USER MOD reduce.3.24.130724 removed 299 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 56 SER OG : rot 36:sc= 0.0864 USER MOD Single : B 168 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 216 N SER A 56 -12.265 5.965 -17.187 1.00 0.00 N ATOM 217 CA SER A 56 -11.593 6.975 -16.379 1.00 0.00 C ATOM 218 C SER A 56 -11.905 8.377 -16.892 1.00 0.00 C ATOM 219 O SER A 56 -12.239 9.273 -16.118 1.00 0.00 O ATOM 220 CB SER A 56 -10.081 6.741 -16.388 1.00 0.00 C ATOM 221 OG SER A 56 -9.763 5.438 -15.932 1.00 0.00 O ATOM 0 HA SER A 56 -11.961 6.891 -15.356 1.00 0.00 H new ATOM 0 HB2 SER A 56 -9.694 6.881 -17.398 1.00 0.00 H new ATOM 0 HB3 SER A 56 -9.592 7.481 -15.754 1.00 0.00 H new ATOM 0 HG SER A 56 -10.451 4.809 -16.234 1.00 0.00 H new ATOM 227 N ALA A 57 -11.794 8.559 -18.204 1.00 0.00 N ATOM 228 CA ALA A 57 -12.066 9.851 -18.822 1.00 0.00 C ATOM 229 C ALA A 57 -13.528 10.247 -18.645 1.00 0.00 C ATOM 230 O ALA A 57 -13.832 11.358 -18.210 1.00 0.00 O ATOM 231 CB ALA A 57 -11.702 9.816 -20.299 1.00 0.00 C ATOM 0 H ALA A 57 -11.518 7.828 -18.859 1.00 0.00 H new ATOM 0 HA ALA A 57 -11.451 10.601 -18.325 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -11.910 10.787 -20.748 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -10.642 9.586 -20.407 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.293 9.050 -20.801 1.00 0.00 H new ATOM 237 N VAL A 58 -14.430 9.332 -18.986 1.00 0.00 N ATOM 238 CA VAL A 58 -15.860 9.586 -18.864 1.00 0.00 C ATOM 239 C VAL A 58 -16.217 10.053 -17.457 1.00 0.00 C ATOM 240 O VAL A 58 -17.080 10.913 -17.276 1.00 0.00 O ATOM 241 CB VAL A 58 -16.684 8.330 -19.200 1.00 0.00 C ATOM 242 CG1 VAL A 58 -18.172 8.616 -19.068 1.00 0.00 C ATOM 243 CG2 VAL A 58 -16.350 7.833 -20.599 1.00 0.00 C ATOM 0 H VAL A 58 -14.195 8.408 -19.349 1.00 0.00 H new ATOM 0 HA VAL A 58 -16.104 10.373 -19.578 1.00 0.00 H new ATOM 0 HB VAL A 58 -16.425 7.546 -18.489 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -18.738 7.716 -19.309 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -18.395 8.921 -18.046 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -18.451 9.416 -19.754 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -16.941 6.945 -20.820 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -16.579 8.612 -21.326 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -15.290 7.586 -20.654 1.00 0.00 H new ATOM 253 N VAL A 59 -15.547 9.481 -16.461 1.00 0.00 N ATOM 254 CA VAL A 59 -15.792 9.839 -15.070 1.00 0.00 C ATOM 255 C VAL A 59 -15.265 11.236 -14.761 1.00 0.00 C ATOM 256 O VAL A 59 -15.882 11.992 -14.011 1.00 0.00 O ATOM 257 CB VAL A 59 -15.138 8.831 -14.107 1.00 0.00 C ATOM 258 CG1 VAL A 59 -15.379 9.239 -12.661 1.00 0.00 C ATOM 259 CG2 VAL A 59 -15.663 7.427 -14.368 1.00 0.00 C ATOM 0 H VAL A 59 -14.830 8.767 -16.593 1.00 0.00 H new ATOM 0 HA VAL A 59 -16.872 9.821 -14.924 1.00 0.00 H new ATOM 0 HB VAL A 59 -14.063 8.831 -14.285 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -14.909 8.515 -11.995 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -14.950 10.225 -12.485 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -16.451 9.270 -12.465 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -15.190 6.728 -13.679 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -16.743 7.409 -14.220 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -15.433 7.137 -15.393 1.00 0.00 H new ATOM 269 N GLY A 60 -14.120 11.573 -15.345 1.00 0.00 N ATOM 270 CA GLY A 60 -13.528 12.879 -15.120 1.00 0.00 C ATOM 271 C GLY A 60 -14.410 14.008 -15.618 1.00 0.00 C ATOM 272 O GLY A 60 -14.611 15.001 -14.918 1.00 0.00 O ATOM 0 H GLY A 60 -13.591 10.965 -15.970 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -13.341 13.011 -14.054 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -12.562 12.928 -15.622 1.00 0.00 H new ATOM 276 N ILE A 61 -14.935 13.857 -16.829 1.00 0.00 N ATOM 277 CA ILE A 61 -15.799 14.872 -17.419 1.00 0.00 C ATOM 278 C ILE A 61 -17.151 14.919 -16.715 1.00 0.00 C ATOM 279 O ILE A 61 -17.684 15.996 -16.443 1.00 0.00 O ATOM 280 CB ILE A 61 -16.023 14.617 -18.921 1.00 0.00 C ATOM 281 CG1 ILE A 61 -14.749 14.930 -19.709 1.00 0.00 C ATOM 282 CG2 ILE A 61 -17.187 15.452 -19.432 1.00 0.00 C ATOM 283 CD1 ILE A 61 -13.712 13.831 -19.644 1.00 0.00 C ATOM 0 H ILE A 61 -14.777 13.041 -17.421 1.00 0.00 H new ATOM 0 HA ILE A 61 -15.293 15.829 -17.293 1.00 0.00 H new ATOM 0 HB ILE A 61 -16.267 13.564 -19.064 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -15.011 15.109 -20.752 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -14.313 15.853 -19.327 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -17.333 15.261 -20.495 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -18.093 15.185 -18.888 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -16.971 16.509 -19.280 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -12.837 14.122 -20.225 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -13.421 13.667 -18.607 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -14.130 12.911 -20.054 1.00 0.00 H new ATOM 295 N LEU A 62 -17.700 13.746 -16.421 1.00 0.00 N ATOM 296 CA LEU A 62 -18.990 13.652 -15.747 1.00 0.00 C ATOM 297 C LEU A 62 -18.907 14.216 -14.332 1.00 0.00 C ATOM 298 O LEU A 62 -19.853 14.833 -13.841 1.00 0.00 O ATOM 299 CB LEU A 62 -19.460 12.197 -15.702 1.00 0.00 C ATOM 300 CG LEU A 62 -20.323 11.734 -16.876 1.00 0.00 C ATOM 301 CD1 LEU A 62 -20.642 10.252 -16.752 1.00 0.00 C ATOM 302 CD2 LEU A 62 -21.604 12.552 -16.951 1.00 0.00 C ATOM 0 H LEU A 62 -17.272 12.846 -16.639 1.00 0.00 H new ATOM 0 HA LEU A 62 -19.711 14.242 -16.312 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -18.582 11.554 -15.647 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -20.024 12.046 -14.781 1.00 0.00 H new ATOM 0 HG LEU A 62 -19.762 11.888 -17.798 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -21.257 9.940 -17.596 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -19.715 9.679 -16.748 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -21.183 10.073 -15.823 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -22.206 12.209 -17.792 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -22.169 12.429 -16.027 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -21.356 13.605 -17.088 1.00 0.00 H new ATOM 314 N LEU A 63 -17.769 14.001 -13.681 1.00 0.00 N ATOM 315 CA LEU A 63 -17.561 14.490 -12.323 1.00 0.00 C ATOM 316 C LEU A 63 -17.492 16.014 -12.296 1.00 0.00 C ATOM 317 O LEU A 63 -18.113 16.659 -11.452 1.00 0.00 O ATOM 318 CB LEU A 63 -16.276 13.900 -11.739 1.00 0.00 C ATOM 319 CG LEU A 63 -16.426 12.579 -10.984 1.00 0.00 C ATOM 320 CD1 LEU A 63 -15.062 12.015 -10.617 1.00 0.00 C ATOM 321 CD2 LEU A 63 -17.278 12.771 -9.738 1.00 0.00 C ATOM 0 H LEU A 63 -16.977 13.491 -14.072 1.00 0.00 H new ATOM 0 HA LEU A 63 -18.409 14.173 -11.716 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -15.566 13.752 -12.552 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -15.838 14.634 -11.063 1.00 0.00 H new ATOM 0 HG LEU A 63 -16.928 11.865 -11.637 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -15.189 11.075 -10.080 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -14.485 11.839 -11.525 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -14.533 12.726 -9.983 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -17.374 11.821 -9.213 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -16.804 13.501 -9.082 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -18.267 13.129 -10.025 1.00 0.00 H new ATOM 333 N VAL A 64 -16.734 16.583 -13.228 1.00 0.00 N ATOM 334 CA VAL A 64 -16.586 18.031 -13.314 1.00 0.00 C ATOM 335 C VAL A 64 -17.929 18.705 -13.571 1.00 0.00 C ATOM 336 O VAL A 64 -18.211 19.776 -13.033 1.00 0.00 O ATOM 337 CB VAL A 64 -15.602 18.429 -14.430 1.00 0.00 C ATOM 338 CG1 VAL A 64 -15.490 19.943 -14.528 1.00 0.00 C ATOM 339 CG2 VAL A 64 -14.239 17.800 -14.187 1.00 0.00 C ATOM 0 H VAL A 64 -16.213 16.063 -13.934 1.00 0.00 H new ATOM 0 HA VAL A 64 -16.191 18.367 -12.355 1.00 0.00 H new ATOM 0 HB VAL A 64 -15.985 18.055 -15.379 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -14.791 20.205 -15.322 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -16.469 20.366 -14.752 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -15.130 20.343 -13.580 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -13.556 18.092 -14.985 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -13.846 18.142 -13.230 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -14.337 16.714 -14.172 1.00 0.00 H new ATOM 349 N VAL A 65 -18.756 18.071 -14.396 1.00 0.00 N ATOM 350 CA VAL A 65 -20.071 18.609 -14.723 1.00 0.00 C ATOM 351 C VAL A 65 -20.958 18.682 -13.486 1.00 0.00 C ATOM 352 O VAL A 65 -21.525 19.730 -13.176 1.00 0.00 O ATOM 353 CB VAL A 65 -20.774 17.757 -15.797 1.00 0.00 C ATOM 354 CG1 VAL A 65 -22.164 18.303 -16.086 1.00 0.00 C ATOM 355 CG2 VAL A 65 -19.939 17.704 -17.067 1.00 0.00 C ATOM 0 H VAL A 65 -18.538 17.184 -14.850 1.00 0.00 H new ATOM 0 HA VAL A 65 -19.914 19.615 -15.113 1.00 0.00 H new ATOM 0 HB VAL A 65 -20.880 16.741 -15.417 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -22.645 17.689 -16.847 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -22.760 18.283 -15.173 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -22.084 19.329 -16.445 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -20.451 17.098 -17.814 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -19.799 18.714 -17.453 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -18.967 17.262 -16.846 1.00 0.00 H new ATOM 365 N VAL A 66 -21.073 17.562 -12.780 1.00 0.00 N ATOM 366 CA VAL A 66 -21.891 17.498 -11.574 1.00 0.00 C ATOM 367 C VAL A 66 -21.368 18.451 -10.506 1.00 0.00 C ATOM 368 O VAL A 66 -22.112 19.281 -9.981 1.00 0.00 O ATOM 369 CB VAL A 66 -21.931 16.070 -10.998 1.00 0.00 C ATOM 370 CG1 VAL A 66 -22.810 16.020 -9.758 1.00 0.00 C ATOM 371 CG2 VAL A 66 -22.421 15.086 -12.049 1.00 0.00 C ATOM 0 H VAL A 66 -20.610 16.686 -13.022 1.00 0.00 H new ATOM 0 HA VAL A 66 -22.900 17.794 -11.859 1.00 0.00 H new ATOM 0 HB VAL A 66 -20.920 15.784 -10.709 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -22.827 15.004 -9.365 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -22.411 16.696 -9.001 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -23.824 16.325 -10.018 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -22.443 14.082 -11.625 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -23.424 15.366 -12.370 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -21.747 15.103 -12.906 1.00 0.00 H new ATOM 381 N LEU A 67 -20.084 18.328 -10.187 1.00 0.00 N ATOM 382 CA LEU A 67 -19.460 19.179 -9.180 1.00 0.00 C ATOM 383 C LEU A 67 -19.545 20.648 -9.581 1.00 0.00 C ATOM 384 O LEU A 67 -19.659 21.529 -8.730 1.00 0.00 O ATOM 385 CB LEU A 67 -17.998 18.777 -8.979 1.00 0.00 C ATOM 386 CG LEU A 67 -17.734 17.718 -7.908 1.00 0.00 C ATOM 387 CD1 LEU A 67 -16.805 16.639 -8.441 1.00 0.00 C ATOM 388 CD2 LEU A 67 -17.148 18.359 -6.658 1.00 0.00 C ATOM 0 H LEU A 67 -19.455 17.647 -10.611 1.00 0.00 H new ATOM 0 HA LEU A 67 -19.999 19.046 -8.242 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -17.609 18.409 -9.929 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -17.428 19.671 -8.726 1.00 0.00 H new ATOM 0 HG LEU A 67 -18.683 17.252 -7.643 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -16.629 15.894 -7.665 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -17.263 16.160 -9.306 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -15.856 17.088 -8.735 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -16.966 17.591 -5.906 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -16.208 18.851 -6.908 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -17.849 19.094 -6.263 1.00 0.00 H new ATOM 400 N GLY A 68 -19.490 20.905 -10.885 1.00 0.00 N ATOM 401 CA GLY A 68 -19.564 22.269 -11.376 1.00 0.00 C ATOM 402 C GLY A 68 -20.893 22.927 -11.062 1.00 0.00 C ATOM 403 O GLY A 68 -20.934 24.052 -10.563 1.00 0.00 O ATOM 0 H GLY A 68 -19.396 20.193 -11.609 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -18.758 22.855 -10.934 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -19.406 22.273 -12.454 1.00 0.00 H new ATOM 407 N VAL A 69 -21.983 22.225 -11.355 1.00 0.00 N ATOM 408 CA VAL A 69 -23.320 22.748 -11.102 1.00 0.00 C ATOM 409 C VAL A 69 -23.651 22.711 -9.614 1.00 0.00 C ATOM 410 O VAL A 69 -24.361 23.578 -9.103 1.00 0.00 O ATOM 411 CB VAL A 69 -24.389 21.954 -11.875 1.00 0.00 C ATOM 412 CG1 VAL A 69 -25.780 22.486 -11.562 1.00 0.00 C ATOM 413 CG2 VAL A 69 -24.113 22.006 -13.370 1.00 0.00 C ATOM 0 H VAL A 69 -21.966 21.292 -11.768 1.00 0.00 H new ATOM 0 HA VAL A 69 -23.327 23.782 -11.447 1.00 0.00 H new ATOM 0 HB VAL A 69 -24.345 20.913 -11.556 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -26.522 21.913 -12.117 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -25.974 22.392 -10.493 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -25.842 23.535 -11.851 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -24.878 21.440 -13.901 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -24.129 23.042 -13.707 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -23.134 21.573 -13.574 1.00 0.00 H new ATOM 423 N VAL A 70 -23.132 21.702 -8.923 1.00 0.00 N ATOM 424 CA VAL A 70 -23.372 21.551 -7.492 1.00 0.00 C ATOM 425 C VAL A 70 -22.643 22.629 -6.697 1.00 0.00 C ATOM 426 O VAL A 70 -23.240 23.313 -5.866 1.00 0.00 O ATOM 427 CB VAL A 70 -22.923 20.166 -6.991 1.00 0.00 C ATOM 428 CG1 VAL A 70 -22.996 20.099 -5.473 1.00 0.00 C ATOM 429 CG2 VAL A 70 -23.769 19.071 -7.622 1.00 0.00 C ATOM 0 H VAL A 70 -22.542 20.976 -9.330 1.00 0.00 H new ATOM 0 HA VAL A 70 -24.446 21.653 -7.338 1.00 0.00 H new ATOM 0 HB VAL A 70 -21.886 20.009 -7.289 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -22.675 19.113 -5.136 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -22.344 20.859 -5.043 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -24.022 20.277 -5.150 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -23.438 18.099 -7.257 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -24.815 19.221 -7.356 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -23.661 19.107 -8.706 1.00 0.00 H new ATOM 439 N PHE A 71 -21.348 22.775 -6.959 1.00 0.00 N ATOM 440 CA PHE A 71 -20.537 23.770 -6.267 1.00 0.00 C ATOM 441 C PHE A 71 -21.039 25.181 -6.560 1.00 0.00 C ATOM 442 O PHE A 71 -21.186 26.000 -5.653 1.00 0.00 O ATOM 443 CB PHE A 71 -19.070 23.642 -6.685 1.00 0.00 C ATOM 444 CG PHE A 71 -18.106 24.147 -5.649 1.00 0.00 C ATOM 445 CD1 PHE A 71 -18.129 23.644 -4.358 1.00 0.00 C ATOM 446 CD2 PHE A 71 -17.177 25.125 -5.967 1.00 0.00 C ATOM 447 CE1 PHE A 71 -17.243 24.107 -3.404 1.00 0.00 C ATOM 448 CE2 PHE A 71 -16.288 25.590 -5.017 1.00 0.00 C ATOM 449 CZ PHE A 71 -16.322 25.082 -3.733 1.00 0.00 C ATOM 0 H PHE A 71 -20.838 22.218 -7.645 1.00 0.00 H new ATOM 0 HA PHE A 71 -20.621 23.589 -5.195 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -18.850 22.595 -6.895 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -18.915 24.193 -7.613 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -18.847 22.882 -4.095 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -17.148 25.528 -6.969 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -17.271 23.706 -2.401 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -15.567 26.350 -5.278 1.00 0.00 H new ATOM 0 HZ PHE A 71 -15.630 25.446 -2.988 1.00 0.00 H new ATOM 459 N GLY A 72 -21.301 25.457 -7.834 1.00 0.00 N ATOM 460 CA GLY A 72 -21.783 26.769 -8.224 1.00 0.00 C ATOM 461 C GLY A 72 -23.063 27.153 -7.509 1.00 0.00 C ATOM 462 O GLY A 72 -23.174 28.253 -6.967 1.00 0.00 O ATOM 0 H GLY A 72 -21.188 24.796 -8.602 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -21.015 27.513 -8.012 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -21.953 26.785 -9.301 1.00 0.00 H new ATOM 466 N ILE A 73 -24.034 26.245 -7.509 1.00 0.00 N ATOM 467 CA ILE A 73 -25.313 26.495 -6.856 1.00 0.00 C ATOM 468 C ILE A 73 -25.164 26.497 -5.339 1.00 0.00 C ATOM 469 O ILE A 73 -25.956 27.115 -4.627 1.00 0.00 O ATOM 470 CB ILE A 73 -26.364 25.443 -7.257 1.00 0.00 C ATOM 471 CG1 ILE A 73 -26.564 25.441 -8.773 1.00 0.00 C ATOM 472 CG2 ILE A 73 -27.681 25.712 -6.544 1.00 0.00 C ATOM 473 CD1 ILE A 73 -27.256 24.199 -9.290 1.00 0.00 C ATOM 0 H ILE A 73 -23.959 25.330 -7.954 1.00 0.00 H new ATOM 0 HA ILE A 73 -25.650 27.478 -7.186 1.00 0.00 H new ATOM 0 HB ILE A 73 -26.004 24.459 -6.956 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -27.148 26.317 -9.055 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -25.593 25.535 -9.259 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -28.414 24.960 -6.838 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -27.527 25.667 -5.466 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -28.047 26.702 -6.817 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -27.364 24.267 -10.373 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -26.662 23.320 -9.039 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -28.241 24.114 -8.832 1.00 0.00 H new ATOM 967 N ALA B 153 -9.584 8.346 -13.380 1.00 0.00 N ATOM 968 CA ALA B 153 -10.551 9.433 -13.298 1.00 0.00 C ATOM 969 C ALA B 153 -10.079 10.517 -12.335 1.00 0.00 C ATOM 970 O ALA B 153 -10.132 11.707 -12.649 1.00 0.00 O ATOM 971 CB ALA B 153 -11.910 8.899 -12.869 1.00 0.00 C ATOM 0 HA ALA B 153 -10.644 9.879 -14.288 1.00 0.00 H new ATOM 0 HB1 ALA B 153 -12.623 9.722 -12.812 1.00 0.00 H new ATOM 0 HB2 ALA B 153 -12.259 8.166 -13.597 1.00 0.00 H new ATOM 0 HB3 ALA B 153 -11.823 8.426 -11.891 1.00 0.00 H new ATOM 977 N LEU B 154 -9.618 10.099 -11.161 1.00 0.00 N ATOM 978 CA LEU B 154 -9.136 11.035 -10.151 1.00 0.00 C ATOM 979 C LEU B 154 -7.906 11.786 -10.648 1.00 0.00 C ATOM 980 O LEU B 154 -7.879 13.018 -10.657 1.00 0.00 O ATOM 981 CB LEU B 154 -8.806 10.291 -8.856 1.00 0.00 C ATOM 982 CG LEU B 154 -8.911 11.109 -7.568 1.00 0.00 C ATOM 983 CD1 LEU B 154 -9.260 10.209 -6.392 1.00 0.00 C ATOM 984 CD2 LEU B 154 -7.612 11.856 -7.303 1.00 0.00 C ATOM 0 H LEU B 154 -9.568 9.118 -10.885 1.00 0.00 H new ATOM 0 HA LEU B 154 -9.926 11.760 -9.955 1.00 0.00 H new ATOM 0 HB2 LEU B 154 -9.473 9.433 -8.773 1.00 0.00 H new ATOM 0 HB3 LEU B 154 -7.791 9.900 -8.933 1.00 0.00 H new ATOM 0 HG LEU B 154 -9.709 11.841 -7.689 1.00 0.00 H new ATOM 0 HD11 LEU B 154 -9.331 10.808 -5.484 1.00 0.00 H new ATOM 0 HD12 LEU B 154 -10.216 9.720 -6.579 1.00 0.00 H new ATOM 0 HD13 LEU B 154 -8.484 9.454 -6.269 1.00 0.00 H new ATOM 0 HD21 LEU B 154 -7.705 12.433 -6.383 1.00 0.00 H new ATOM 0 HD22 LEU B 154 -6.795 11.141 -7.202 1.00 0.00 H new ATOM 0 HD23 LEU B 154 -7.404 12.530 -8.134 1.00 0.00 H new ATOM 996 N LEU B 155 -6.889 11.038 -11.062 1.00 0.00 N ATOM 997 CA LEU B 155 -5.655 11.634 -11.563 1.00 0.00 C ATOM 998 C LEU B 155 -5.949 12.659 -12.654 1.00 0.00 C ATOM 999 O LEU B 155 -5.559 13.823 -12.548 1.00 0.00 O ATOM 1000 CB LEU B 155 -4.725 10.548 -12.106 1.00 0.00 C ATOM 1001 CG LEU B 155 -3.249 10.927 -12.227 1.00 0.00 C ATOM 1002 CD1 LEU B 155 -2.400 10.069 -11.302 1.00 0.00 C ATOM 1003 CD2 LEU B 155 -2.779 10.788 -13.668 1.00 0.00 C ATOM 0 H LEU B 155 -6.894 10.018 -11.061 1.00 0.00 H new ATOM 0 HA LEU B 155 -5.164 12.144 -10.734 1.00 0.00 H new ATOM 0 HB2 LEU B 155 -4.803 9.674 -11.459 1.00 0.00 H new ATOM 0 HB3 LEU B 155 -5.084 10.249 -13.091 1.00 0.00 H new ATOM 0 HG LEU B 155 -3.135 11.969 -11.928 1.00 0.00 H new ATOM 0 HD11 LEU B 155 -1.352 10.353 -11.402 1.00 0.00 H new ATOM 0 HD12 LEU B 155 -2.720 10.219 -10.271 1.00 0.00 H new ATOM 0 HD13 LEU B 155 -2.518 9.019 -11.569 1.00 0.00 H new ATOM 0 HD21 LEU B 155 -1.726 11.062 -13.735 1.00 0.00 H new ATOM 0 HD22 LEU B 155 -2.907 9.756 -13.995 1.00 0.00 H new ATOM 0 HD23 LEU B 155 -3.367 11.446 -14.308 1.00 0.00 H new ATOM 1015 N LEU B 156 -6.640 12.221 -13.700 1.00 0.00 N ATOM 1016 CA LEU B 156 -6.989 13.101 -14.810 1.00 0.00 C ATOM 1017 C LEU B 156 -7.674 14.367 -14.306 1.00 0.00 C ATOM 1018 O LEU B 156 -7.346 15.475 -14.732 1.00 0.00 O ATOM 1019 CB LEU B 156 -7.902 12.372 -15.797 1.00 0.00 C ATOM 1020 CG LEU B 156 -7.201 11.563 -16.889 1.00 0.00 C ATOM 1021 CD1 LEU B 156 -8.213 10.762 -17.693 1.00 0.00 C ATOM 1022 CD2 LEU B 156 -6.399 12.481 -17.800 1.00 0.00 C ATOM 0 H LEU B 156 -6.970 11.261 -13.803 1.00 0.00 H new ATOM 0 HA LEU B 156 -6.068 13.386 -15.319 1.00 0.00 H new ATOM 0 HB2 LEU B 156 -8.549 11.700 -15.234 1.00 0.00 H new ATOM 0 HB3 LEU B 156 -8.547 13.108 -16.276 1.00 0.00 H new ATOM 0 HG LEU B 156 -6.513 10.865 -16.413 1.00 0.00 H new ATOM 0 HD11 LEU B 156 -7.696 10.193 -18.465 1.00 0.00 H new ATOM 0 HD12 LEU B 156 -8.743 10.077 -17.031 1.00 0.00 H new ATOM 0 HD13 LEU B 156 -8.927 11.441 -18.160 1.00 0.00 H new ATOM 0 HD21 LEU B 156 -5.907 11.889 -18.571 1.00 0.00 H new ATOM 0 HD22 LEU B 156 -7.068 13.203 -18.269 1.00 0.00 H new ATOM 0 HD23 LEU B 156 -5.647 13.010 -17.214 1.00 0.00 H new ATOM 1034 N LEU B 157 -8.626 14.196 -13.395 1.00 0.00 N ATOM 1035 CA LEU B 157 -9.357 15.326 -12.830 1.00 0.00 C ATOM 1036 C LEU B 157 -8.397 16.352 -12.237 1.00 0.00 C ATOM 1037 O LEU B 157 -8.524 17.552 -12.485 1.00 0.00 O ATOM 1038 CB LEU B 157 -10.332 14.842 -11.756 1.00 0.00 C ATOM 1039 CG LEU B 157 -11.504 15.773 -11.445 1.00 0.00 C ATOM 1040 CD1 LEU B 157 -12.703 14.977 -10.953 1.00 0.00 C ATOM 1041 CD2 LEU B 157 -11.097 16.818 -10.416 1.00 0.00 C ATOM 0 H LEU B 157 -8.910 13.286 -13.032 1.00 0.00 H new ATOM 0 HA LEU B 157 -9.919 15.803 -13.633 1.00 0.00 H new ATOM 0 HB2 LEU B 157 -10.733 13.877 -12.066 1.00 0.00 H new ATOM 0 HB3 LEU B 157 -9.773 14.674 -10.835 1.00 0.00 H new ATOM 0 HG LEU B 157 -11.787 16.287 -12.363 1.00 0.00 H new ATOM 0 HD11 LEU B 157 -13.527 15.657 -10.737 1.00 0.00 H new ATOM 0 HD12 LEU B 157 -13.010 14.268 -11.722 1.00 0.00 H new ATOM 0 HD13 LEU B 157 -12.433 14.435 -10.047 1.00 0.00 H new ATOM 0 HD21 LEU B 157 -11.944 17.472 -10.207 1.00 0.00 H new ATOM 0 HD22 LEU B 157 -10.786 16.322 -9.497 1.00 0.00 H new ATOM 0 HD23 LEU B 157 -10.269 17.410 -10.806 1.00 0.00 H new ATOM 1053 N LEU B 158 -7.438 15.873 -11.453 1.00 0.00 N ATOM 1054 CA LEU B 158 -6.454 16.749 -10.825 1.00 0.00 C ATOM 1055 C LEU B 158 -5.531 17.368 -11.869 1.00 0.00 C ATOM 1056 O LEU B 158 -5.168 18.541 -11.776 1.00 0.00 O ATOM 1057 CB LEU B 158 -5.632 15.971 -9.797 1.00 0.00 C ATOM 1058 CG LEU B 158 -5.062 16.787 -8.636 1.00 0.00 C ATOM 1059 CD1 LEU B 158 -6.125 17.017 -7.573 1.00 0.00 C ATOM 1060 CD2 LEU B 158 -3.849 16.089 -8.038 1.00 0.00 C ATOM 0 H LEU B 158 -7.320 14.883 -11.237 1.00 0.00 H new ATOM 0 HA LEU B 158 -6.990 17.552 -10.319 1.00 0.00 H new ATOM 0 HB2 LEU B 158 -6.258 15.179 -9.385 1.00 0.00 H new ATOM 0 HB3 LEU B 158 -4.804 15.486 -10.315 1.00 0.00 H new ATOM 0 HG LEU B 158 -4.745 17.757 -9.020 1.00 0.00 H new ATOM 0 HD11 LEU B 158 -5.701 17.599 -6.755 1.00 0.00 H new ATOM 0 HD12 LEU B 158 -6.964 17.560 -8.009 1.00 0.00 H new ATOM 0 HD13 LEU B 158 -6.473 16.057 -7.193 1.00 0.00 H new ATOM 0 HD21 LEU B 158 -3.457 16.684 -7.213 1.00 0.00 H new ATOM 0 HD22 LEU B 158 -4.140 15.105 -7.669 1.00 0.00 H new ATOM 0 HD23 LEU B 158 -3.080 15.977 -8.802 1.00 0.00 H new ATOM 1072 N VAL B 159 -5.155 16.572 -12.865 1.00 0.00 N ATOM 1073 CA VAL B 159 -4.276 17.042 -13.930 1.00 0.00 C ATOM 1074 C VAL B 159 -4.937 18.153 -14.738 1.00 0.00 C ATOM 1075 O VAL B 159 -4.332 19.194 -14.994 1.00 0.00 O ATOM 1076 CB VAL B 159 -3.882 15.895 -14.880 1.00 0.00 C ATOM 1077 CG1 VAL B 159 -2.926 16.395 -15.952 1.00 0.00 C ATOM 1078 CG2 VAL B 159 -3.267 14.744 -14.099 1.00 0.00 C ATOM 0 H VAL B 159 -5.445 15.599 -12.957 1.00 0.00 H new ATOM 0 HA VAL B 159 -3.378 17.431 -13.451 1.00 0.00 H new ATOM 0 HB VAL B 159 -4.782 15.528 -15.373 1.00 0.00 H new ATOM 0 HG11 VAL B 159 -2.658 15.571 -16.614 1.00 0.00 H new ATOM 0 HG12 VAL B 159 -3.408 17.183 -16.530 1.00 0.00 H new ATOM 0 HG13 VAL B 159 -2.025 16.789 -15.481 1.00 0.00 H new ATOM 0 HG21 VAL B 159 -2.995 13.943 -14.786 1.00 0.00 H new ATOM 0 HG22 VAL B 159 -2.376 15.093 -13.577 1.00 0.00 H new ATOM 0 HG23 VAL B 159 -3.989 14.370 -13.373 1.00 0.00 H new ATOM 1088 N VAL B 160 -6.185 17.925 -15.136 1.00 0.00 N ATOM 1089 CA VAL B 160 -6.930 18.907 -15.914 1.00 0.00 C ATOM 1090 C VAL B 160 -7.170 20.179 -15.109 1.00 0.00 C ATOM 1091 O VAL B 160 -6.944 21.286 -15.595 1.00 0.00 O ATOM 1092 CB VAL B 160 -8.286 18.344 -16.379 1.00 0.00 C ATOM 1093 CG1 VAL B 160 -8.986 19.329 -17.302 1.00 0.00 C ATOM 1094 CG2 VAL B 160 -8.096 17.000 -17.067 1.00 0.00 C ATOM 0 H VAL B 160 -6.701 17.069 -14.932 1.00 0.00 H new ATOM 0 HA VAL B 160 -6.324 19.143 -16.789 1.00 0.00 H new ATOM 0 HB VAL B 160 -8.917 18.193 -15.503 1.00 0.00 H new ATOM 0 HG11 VAL B 160 -9.942 18.913 -17.620 1.00 0.00 H new ATOM 0 HG12 VAL B 160 -9.156 20.266 -16.772 1.00 0.00 H new ATOM 0 HG13 VAL B 160 -8.362 19.514 -18.176 1.00 0.00 H new ATOM 0 HG21 VAL B 160 -9.064 16.616 -17.389 1.00 0.00 H new ATOM 0 HG22 VAL B 160 -7.448 17.124 -17.934 1.00 0.00 H new ATOM 0 HG23 VAL B 160 -7.640 16.296 -16.371 1.00 0.00 H new ATOM 1104 N ALA B 161 -7.629 20.012 -13.873 1.00 0.00 N ATOM 1105 CA ALA B 161 -7.898 21.146 -12.998 1.00 0.00 C ATOM 1106 C ALA B 161 -6.663 22.028 -12.846 1.00 0.00 C ATOM 1107 O ALA B 161 -6.767 23.252 -12.764 1.00 0.00 O ATOM 1108 CB ALA B 161 -8.373 20.662 -11.636 1.00 0.00 C ATOM 0 H ALA B 161 -7.822 19.102 -13.455 1.00 0.00 H new ATOM 0 HA ALA B 161 -8.686 21.745 -13.454 1.00 0.00 H new ATOM 0 HB1 ALA B 161 -8.570 21.520 -10.993 1.00 0.00 H new ATOM 0 HB2 ALA B 161 -9.287 20.080 -11.755 1.00 0.00 H new ATOM 0 HB3 ALA B 161 -7.603 20.038 -11.183 1.00 0.00 H new ATOM 1114 N LEU B 162 -5.493 21.398 -12.810 1.00 0.00 N ATOM 1115 CA LEU B 162 -4.237 22.125 -12.668 1.00 0.00 C ATOM 1116 C LEU B 162 -3.877 22.849 -13.962 1.00 0.00 C ATOM 1117 O LEU B 162 -3.371 23.970 -13.938 1.00 0.00 O ATOM 1118 CB LEU B 162 -3.111 21.167 -12.276 1.00 0.00 C ATOM 1119 CG LEU B 162 -1.986 21.762 -11.429 1.00 0.00 C ATOM 1120 CD1 LEU B 162 -2.092 21.284 -9.990 1.00 0.00 C ATOM 1121 CD2 LEU B 162 -0.629 21.401 -12.015 1.00 0.00 C ATOM 0 H LEU B 162 -5.389 20.386 -12.877 1.00 0.00 H new ATOM 0 HA LEU B 162 -4.364 22.868 -11.881 1.00 0.00 H new ATOM 0 HB2 LEU B 162 -3.547 20.331 -11.729 1.00 0.00 H new ATOM 0 HB3 LEU B 162 -2.675 20.759 -13.188 1.00 0.00 H new ATOM 0 HG LEU B 162 -2.085 22.847 -11.438 1.00 0.00 H new ATOM 0 HD11 LEU B 162 -1.283 21.718 -9.402 1.00 0.00 H new ATOM 0 HD12 LEU B 162 -3.050 21.594 -9.573 1.00 0.00 H new ATOM 0 HD13 LEU B 162 -2.019 20.197 -9.961 1.00 0.00 H new ATOM 0 HD21 LEU B 162 0.160 21.833 -11.399 1.00 0.00 H new ATOM 0 HD22 LEU B 162 -0.519 20.317 -12.037 1.00 0.00 H new ATOM 0 HD23 LEU B 162 -0.554 21.794 -13.029 1.00 0.00 H new ATOM 1133 N GLY B 163 -4.145 22.200 -15.091 1.00 0.00 N ATOM 1134 CA GLY B 163 -3.844 22.797 -16.379 1.00 0.00 C ATOM 1135 C GLY B 163 -4.783 23.937 -16.723 1.00 0.00 C ATOM 1136 O GLY B 163 -4.355 24.964 -17.250 1.00 0.00 O ATOM 0 H GLY B 163 -4.565 21.272 -15.137 1.00 0.00 H new ATOM 0 HA2 GLY B 163 -2.818 23.164 -16.375 1.00 0.00 H new ATOM 0 HA3 GLY B 163 -3.906 22.033 -17.154 1.00 0.00 H new ATOM 1140 N ILE B 164 -6.065 23.755 -16.425 1.00 0.00 N ATOM 1141 CA ILE B 164 -7.066 24.776 -16.707 1.00 0.00 C ATOM 1142 C ILE B 164 -6.956 25.939 -15.727 1.00 0.00 C ATOM 1143 O ILE B 164 -7.106 27.100 -16.105 1.00 0.00 O ATOM 1144 CB ILE B 164 -8.492 24.199 -16.644 1.00 0.00 C ATOM 1145 CG1 ILE B 164 -8.649 23.058 -17.651 1.00 0.00 C ATOM 1146 CG2 ILE B 164 -9.518 25.291 -16.909 1.00 0.00 C ATOM 1147 CD1 ILE B 164 -10.034 22.448 -17.662 1.00 0.00 C ATOM 0 H ILE B 164 -6.435 22.910 -15.989 1.00 0.00 H new ATOM 0 HA ILE B 164 -6.873 25.136 -17.718 1.00 0.00 H new ATOM 0 HB ILE B 164 -8.663 23.802 -15.643 1.00 0.00 H new ATOM 0 HG12 ILE B 164 -8.417 23.430 -18.649 1.00 0.00 H new ATOM 0 HG13 ILE B 164 -7.920 22.280 -17.423 1.00 0.00 H new ATOM 0 HG21 ILE B 164 -10.521 24.867 -16.861 1.00 0.00 H new ATOM 0 HG22 ILE B 164 -9.419 26.074 -16.157 1.00 0.00 H new ATOM 0 HG23 ILE B 164 -9.350 25.715 -17.899 1.00 0.00 H new ATOM 0 HD11 ILE B 164 -10.072 21.646 -18.399 1.00 0.00 H new ATOM 0 HD12 ILE B 164 -10.262 22.045 -16.675 1.00 0.00 H new ATOM 0 HD13 ILE B 164 -10.766 23.213 -17.920 1.00 0.00 H new ATOM 1159 N GLY B 165 -6.692 25.618 -14.464 1.00 0.00 N ATOM 1160 CA GLY B 165 -6.564 26.647 -13.448 1.00 0.00 C ATOM 1161 C GLY B 165 -5.340 27.517 -13.655 1.00 0.00 C ATOM 1162 O GLY B 165 -5.386 28.728 -13.435 1.00 0.00 O ATOM 0 H GLY B 165 -6.564 24.664 -14.126 1.00 0.00 H new ATOM 0 HA2 GLY B 165 -7.456 27.273 -13.455 1.00 0.00 H new ATOM 0 HA3 GLY B 165 -6.511 26.178 -12.465 1.00 0.00 H new ATOM 1166 N LEU B 166 -4.242 26.900 -14.076 1.00 0.00 N ATOM 1167 CA LEU B 166 -2.999 27.625 -14.311 1.00 0.00 C ATOM 1168 C LEU B 166 -3.097 28.481 -15.569 1.00 0.00 C ATOM 1169 O LEU B 166 -2.648 29.628 -15.590 1.00 0.00 O ATOM 1170 CB LEU B 166 -1.830 26.647 -14.436 1.00 0.00 C ATOM 1171 CG LEU B 166 -1.104 26.299 -13.136 1.00 0.00 C ATOM 1172 CD1 LEU B 166 -0.062 25.217 -13.379 1.00 0.00 C ATOM 1173 CD2 LEU B 166 -0.457 27.539 -12.537 1.00 0.00 C ATOM 0 H LEU B 166 -4.187 25.899 -14.262 1.00 0.00 H new ATOM 0 HA LEU B 166 -2.825 28.282 -13.459 1.00 0.00 H new ATOM 0 HB2 LEU B 166 -2.201 25.723 -14.880 1.00 0.00 H new ATOM 0 HB3 LEU B 166 -1.104 27.066 -15.133 1.00 0.00 H new ATOM 0 HG LEU B 166 -1.837 25.917 -12.425 1.00 0.00 H new ATOM 0 HD11 LEU B 166 0.444 24.983 -12.443 1.00 0.00 H new ATOM 0 HD12 LEU B 166 -0.550 24.321 -13.762 1.00 0.00 H new ATOM 0 HD13 LEU B 166 0.668 25.571 -14.107 1.00 0.00 H new ATOM 0 HD21 LEU B 166 0.055 27.272 -11.613 1.00 0.00 H new ATOM 0 HD22 LEU B 166 0.263 27.951 -13.244 1.00 0.00 H new ATOM 0 HD23 LEU B 166 -1.224 28.283 -12.325 1.00 0.00 H new ATOM 1185 N PHE B 167 -3.690 27.918 -16.617 1.00 0.00 N ATOM 1186 CA PHE B 167 -3.849 28.630 -17.880 1.00 0.00 C ATOM 1187 C PHE B 167 -4.792 29.818 -17.719 1.00 0.00 C ATOM 1188 O PHE B 167 -4.578 30.878 -18.307 1.00 0.00 O ATOM 1189 CB PHE B 167 -4.380 27.684 -18.959 1.00 0.00 C ATOM 1190 CG PHE B 167 -3.930 28.044 -20.346 1.00 0.00 C ATOM 1191 CD1 PHE B 167 -2.597 27.930 -20.708 1.00 0.00 C ATOM 1192 CD2 PHE B 167 -4.839 28.498 -21.288 1.00 0.00 C ATOM 1193 CE1 PHE B 167 -2.180 28.260 -21.983 1.00 0.00 C ATOM 1194 CE2 PHE B 167 -4.428 28.829 -22.565 1.00 0.00 C ATOM 1195 CZ PHE B 167 -3.096 28.711 -22.913 1.00 0.00 C ATOM 0 H PHE B 167 -4.068 26.971 -16.617 1.00 0.00 H new ATOM 0 HA PHE B 167 -2.871 29.004 -18.184 1.00 0.00 H new ATOM 0 HB2 PHE B 167 -4.055 26.668 -18.732 1.00 0.00 H new ATOM 0 HB3 PHE B 167 -5.470 27.685 -18.927 1.00 0.00 H new ATOM 0 HD1 PHE B 167 -1.876 27.579 -19.985 1.00 0.00 H new ATOM 0 HD2 PHE B 167 -5.881 28.594 -21.021 1.00 0.00 H new ATOM 0 HE1 PHE B 167 -1.138 28.165 -22.252 1.00 0.00 H new ATOM 0 HE2 PHE B 167 -5.147 29.180 -23.290 1.00 0.00 H new ATOM 0 HZ PHE B 167 -2.772 28.971 -23.910 1.00 0.00 H new ATOM 1205 N MET B 168 -5.837 29.632 -16.919 1.00 0.00 N ATOM 1206 CA MET B 168 -6.813 30.689 -16.680 1.00 0.00 C ATOM 1207 C MET B 168 -6.266 31.723 -15.701 1.00 0.00 C ATOM 1208 O MET B 168 -6.672 32.885 -15.721 1.00 0.00 O ATOM 1209 CB MET B 168 -8.116 30.097 -16.140 1.00 0.00 C ATOM 1210 CG MET B 168 -9.116 29.735 -17.226 1.00 0.00 C ATOM 1211 SD MET B 168 -10.660 30.654 -17.083 1.00 0.00 S ATOM 1212 CE MET B 168 -11.857 29.329 -17.224 1.00 0.00 C ATOM 0 H MET B 168 -6.030 28.760 -16.426 1.00 0.00 H new ATOM 0 HA MET B 168 -7.014 31.185 -17.630 1.00 0.00 H new ATOM 0 HB2 MET B 168 -7.886 29.205 -15.558 1.00 0.00 H new ATOM 0 HB3 MET B 168 -8.576 30.813 -15.459 1.00 0.00 H new ATOM 0 HG2 MET B 168 -8.672 29.928 -18.202 1.00 0.00 H new ATOM 0 HG3 MET B 168 -9.328 28.667 -17.178 1.00 0.00 H new ATOM 0 HE1 MET B 168 -12.864 29.740 -17.154 1.00 0.00 H new ATOM 0 HE2 MET B 168 -11.735 28.829 -18.185 1.00 0.00 H new ATOM 0 HE3 MET B 168 -11.701 28.611 -16.419 1.00 0.00 H new ATOM 1222 N ARG B 169 -5.345 31.292 -14.845 1.00 0.00 N ATOM 1223 CA ARG B 169 -4.744 32.181 -13.858 1.00 0.00 C ATOM 1224 C ARG B 169 -4.026 33.343 -14.537 1.00 0.00 C ATOM 1225 O ARG B 169 -3.874 34.417 -13.956 1.00 0.00 O ATOM 1226 CB ARG B 169 -3.764 31.407 -12.974 1.00 0.00 C ATOM 1227 CG ARG B 169 -4.217 31.279 -11.529 1.00 0.00 C ATOM 1228 CD ARG B 169 -3.757 29.965 -10.916 1.00 0.00 C ATOM 1229 NE ARG B 169 -3.070 30.167 -9.643 1.00 0.00 N ATOM 1230 CZ ARG B 169 -2.352 29.227 -9.039 1.00 0.00 C ATOM 1231 NH1 ARG B 169 -2.226 28.028 -9.589 1.00 0.00 N ATOM 1232 NH2 ARG B 169 -1.756 29.487 -7.882 1.00 0.00 N ATOM 0 H ARG B 169 -4.999 30.333 -14.815 1.00 0.00 H new ATOM 0 HA ARG B 169 -5.543 32.585 -13.236 1.00 0.00 H new ATOM 0 HB2 ARG B 169 -3.622 30.410 -13.391 1.00 0.00 H new ATOM 0 HB3 ARG B 169 -2.794 31.904 -12.999 1.00 0.00 H new ATOM 0 HG2 ARG B 169 -3.821 32.112 -10.947 1.00 0.00 H new ATOM 0 HG3 ARG B 169 -5.304 31.344 -11.480 1.00 0.00 H new ATOM 0 HD2 ARG B 169 -4.618 29.314 -10.764 1.00 0.00 H new ATOM 0 HD3 ARG B 169 -3.090 29.454 -11.611 1.00 0.00 H new ATOM 0 HE ARG B 169 -3.146 31.079 -9.193 1.00 0.00 H new ATOM 0 HH11 ARG B 169 -2.681 27.825 -10.479 1.00 0.00 H new ATOM 0 HH12 ARG B 169 -1.674 27.308 -9.122 1.00 0.00 H new ATOM 0 HH21 ARG B 169 -1.849 30.409 -7.456 1.00 0.00 H new ATOM 0 HH22 ARG B 169 -1.205 28.765 -7.419 1.00 0.00 H new