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 27:sc= 0.347 USER MOD Single : B 168 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 216 N SER A 56 -12.184 6.099 -16.911 1.00 0.00 N ATOM 217 CA SER A 56 -11.425 7.159 -16.258 1.00 0.00 C ATOM 218 C SER A 56 -11.641 8.495 -16.962 1.00 0.00 C ATOM 219 O SER A 56 -11.859 9.521 -16.318 1.00 0.00 O ATOM 220 CB SER A 56 -9.935 6.813 -16.242 1.00 0.00 C ATOM 221 OG SER A 56 -9.732 5.446 -15.929 1.00 0.00 O ATOM 0 HA SER A 56 -11.781 7.247 -15.232 1.00 0.00 H new ATOM 0 HB2 SER A 56 -9.496 7.036 -17.215 1.00 0.00 H new ATOM 0 HB3 SER A 56 -9.421 7.437 -15.510 1.00 0.00 H new ATOM 0 HG SER A 56 -10.518 4.928 -16.200 1.00 0.00 H new ATOM 227 N ALA A 57 -11.579 8.474 -18.290 1.00 0.00 N ATOM 228 CA ALA A 57 -11.769 9.682 -19.083 1.00 0.00 C ATOM 229 C ALA A 57 -13.193 10.211 -18.944 1.00 0.00 C ATOM 230 O ALA A 57 -13.402 11.392 -18.665 1.00 0.00 O ATOM 231 CB ALA A 57 -11.446 9.410 -20.544 1.00 0.00 C ATOM 0 H ALA A 57 -11.399 7.633 -18.839 1.00 0.00 H new ATOM 0 HA ALA A 57 -11.087 10.445 -18.707 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -11.592 10.321 -21.125 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -10.409 9.085 -20.633 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.105 8.629 -20.923 1.00 0.00 H new ATOM 237 N VAL A 58 -14.169 9.330 -19.141 1.00 0.00 N ATOM 238 CA VAL A 58 -15.573 9.709 -19.037 1.00 0.00 C ATOM 239 C VAL A 58 -15.861 10.390 -17.704 1.00 0.00 C ATOM 240 O VAL A 58 -16.544 11.413 -17.652 1.00 0.00 O ATOM 241 CB VAL A 58 -16.497 8.486 -19.187 1.00 0.00 C ATOM 242 CG1 VAL A 58 -17.955 8.900 -19.068 1.00 0.00 C ATOM 243 CG2 VAL A 58 -16.240 7.783 -20.511 1.00 0.00 C ATOM 0 H VAL A 58 -14.013 8.349 -19.373 1.00 0.00 H new ATOM 0 HA VAL A 58 -15.773 10.408 -19.849 1.00 0.00 H new ATOM 0 HB VAL A 58 -16.277 7.786 -18.381 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -18.592 8.023 -19.177 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -18.126 9.354 -18.092 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -18.194 9.621 -19.850 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -16.902 6.921 -20.600 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -16.431 8.473 -21.333 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -15.203 7.450 -20.551 1.00 0.00 H new ATOM 253 N VAL A 59 -15.335 9.816 -16.626 1.00 0.00 N ATOM 254 CA VAL A 59 -15.534 10.368 -15.292 1.00 0.00 C ATOM 255 C VAL A 59 -14.857 11.727 -15.153 1.00 0.00 C ATOM 256 O VAL A 59 -15.364 12.618 -14.473 1.00 0.00 O ATOM 257 CB VAL A 59 -14.989 9.422 -14.206 1.00 0.00 C ATOM 258 CG1 VAL A 59 -15.200 10.019 -12.822 1.00 0.00 C ATOM 259 CG2 VAL A 59 -15.648 8.055 -14.311 1.00 0.00 C ATOM 0 H VAL A 59 -14.768 8.969 -16.651 1.00 0.00 H new ATOM 0 HA VAL A 59 -16.609 10.485 -15.155 1.00 0.00 H new ATOM 0 HB VAL A 59 -13.918 9.297 -14.362 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -14.809 9.336 -12.068 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -14.678 10.973 -12.754 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -16.265 10.176 -12.652 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -15.251 7.399 -13.536 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -16.725 8.159 -14.181 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -15.441 7.625 -15.291 1.00 0.00 H new ATOM 269 N GLY A 60 -13.707 11.878 -15.803 1.00 0.00 N ATOM 270 CA GLY A 60 -12.978 13.132 -15.739 1.00 0.00 C ATOM 271 C GLY A 60 -13.759 14.287 -16.333 1.00 0.00 C ATOM 272 O GLY A 60 -13.834 15.364 -15.741 1.00 0.00 O ATOM 0 H GLY A 60 -13.267 11.155 -16.372 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.737 13.356 -14.700 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -12.032 13.026 -16.270 1.00 0.00 H new ATOM 276 N ILE A 61 -14.340 14.065 -17.507 1.00 0.00 N ATOM 277 CA ILE A 61 -15.117 15.097 -18.182 1.00 0.00 C ATOM 278 C ILE A 61 -16.430 15.361 -17.452 1.00 0.00 C ATOM 279 O ILE A 61 -16.836 16.510 -17.277 1.00 0.00 O ATOM 280 CB ILE A 61 -15.423 14.708 -19.640 1.00 0.00 C ATOM 281 CG1 ILE A 61 -14.167 14.846 -20.502 1.00 0.00 C ATOM 282 CG2 ILE A 61 -16.549 15.569 -20.193 1.00 0.00 C ATOM 283 CD1 ILE A 61 -13.209 13.683 -20.365 1.00 0.00 C ATOM 0 H ILE A 61 -14.287 13.180 -18.011 1.00 0.00 H new ATOM 0 HA ILE A 61 -14.511 16.003 -18.176 1.00 0.00 H new ATOM 0 HB ILE A 61 -15.744 13.666 -19.663 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -14.462 14.942 -21.547 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -13.650 15.766 -20.231 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -16.754 15.282 -21.224 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -17.446 15.425 -19.591 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -16.255 16.618 -20.160 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -12.342 13.849 -21.004 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -12.884 13.599 -19.328 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -13.710 12.762 -20.664 1.00 0.00 H new ATOM 295 N LEU A 62 -17.089 14.289 -17.026 1.00 0.00 N ATOM 296 CA LEU A 62 -18.356 14.404 -16.312 1.00 0.00 C ATOM 297 C LEU A 62 -18.162 15.096 -14.966 1.00 0.00 C ATOM 298 O LEU A 62 -19.026 15.848 -14.513 1.00 0.00 O ATOM 299 CB LEU A 62 -18.974 13.020 -16.103 1.00 0.00 C ATOM 300 CG LEU A 62 -19.934 12.542 -17.192 1.00 0.00 C ATOM 301 CD1 LEU A 62 -19.182 12.274 -18.486 1.00 0.00 C ATOM 302 CD2 LEU A 62 -20.679 11.295 -16.737 1.00 0.00 C ATOM 0 H LEU A 62 -16.767 13.331 -17.162 1.00 0.00 H new ATOM 0 HA LEU A 62 -19.032 15.009 -16.916 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -18.166 12.293 -16.014 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -19.507 13.022 -15.152 1.00 0.00 H new ATOM 0 HG LEU A 62 -20.665 13.330 -17.377 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -19.882 11.935 -19.250 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -18.696 13.190 -18.821 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -18.429 11.505 -18.316 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -21.358 10.969 -17.525 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -19.963 10.501 -16.523 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -21.250 11.521 -15.836 1.00 0.00 H new ATOM 314 N LEU A 63 -17.023 14.838 -14.334 1.00 0.00 N ATOM 315 CA LEU A 63 -16.714 15.438 -13.040 1.00 0.00 C ATOM 316 C LEU A 63 -16.500 16.942 -13.174 1.00 0.00 C ATOM 317 O LEU A 63 -17.032 17.728 -12.390 1.00 0.00 O ATOM 318 CB LEU A 63 -15.468 14.786 -12.438 1.00 0.00 C ATOM 319 CG LEU A 63 -15.712 13.565 -11.551 1.00 0.00 C ATOM 320 CD1 LEU A 63 -14.391 12.971 -11.086 1.00 0.00 C ATOM 321 CD2 LEU A 63 -16.580 13.937 -10.358 1.00 0.00 C ATOM 0 H LEU A 63 -16.298 14.218 -14.696 1.00 0.00 H new ATOM 0 HA LEU A 63 -17.562 15.268 -12.377 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -14.807 14.492 -13.253 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -14.937 15.536 -11.852 1.00 0.00 H new ATOM 0 HG LEU A 63 -16.239 12.813 -12.138 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -14.584 12.103 -10.456 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -13.804 12.667 -11.952 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -13.837 13.717 -10.516 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -16.743 13.056 -9.738 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -16.080 14.707 -9.770 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -17.540 14.316 -10.710 1.00 0.00 H new ATOM 333 N VAL A 64 -15.719 17.336 -14.175 1.00 0.00 N ATOM 334 CA VAL A 64 -15.437 18.747 -14.415 1.00 0.00 C ATOM 335 C VAL A 64 -16.717 19.520 -14.709 1.00 0.00 C ATOM 336 O VAL A 64 -16.876 20.664 -14.283 1.00 0.00 O ATOM 337 CB VAL A 64 -14.457 18.932 -15.588 1.00 0.00 C ATOM 338 CG1 VAL A 64 -14.225 20.410 -15.863 1.00 0.00 C ATOM 339 CG2 VAL A 64 -13.142 18.222 -15.301 1.00 0.00 C ATOM 0 H VAL A 64 -15.270 16.698 -14.833 1.00 0.00 H new ATOM 0 HA VAL A 64 -14.981 19.138 -13.506 1.00 0.00 H new ATOM 0 HB VAL A 64 -14.897 18.486 -16.480 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -13.530 20.520 -16.695 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -15.172 20.886 -16.116 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -13.806 20.884 -14.975 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -12.461 18.363 -16.141 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -12.695 18.636 -14.397 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -13.327 17.157 -15.159 1.00 0.00 H new ATOM 349 N VAL A 65 -17.629 18.888 -15.441 1.00 0.00 N ATOM 350 CA VAL A 65 -18.897 19.516 -15.792 1.00 0.00 C ATOM 351 C VAL A 65 -19.728 19.809 -14.548 1.00 0.00 C ATOM 352 O VAL A 65 -20.171 20.938 -14.335 1.00 0.00 O ATOM 353 CB VAL A 65 -19.718 18.629 -16.747 1.00 0.00 C ATOM 354 CG1 VAL A 65 -21.058 19.277 -17.059 1.00 0.00 C ATOM 355 CG2 VAL A 65 -18.937 18.357 -18.024 1.00 0.00 C ATOM 0 H VAL A 65 -17.513 17.941 -15.802 1.00 0.00 H new ATOM 0 HA VAL A 65 -18.657 20.453 -16.295 1.00 0.00 H new ATOM 0 HB VAL A 65 -19.909 17.675 -16.255 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -21.624 18.636 -17.735 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -21.619 19.415 -16.135 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -20.893 20.245 -17.531 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -19.532 17.729 -18.687 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -18.713 19.301 -18.522 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -18.006 17.846 -17.779 1.00 0.00 H new ATOM 365 N VAL A 66 -19.936 18.784 -13.727 1.00 0.00 N ATOM 366 CA VAL A 66 -20.713 18.932 -12.502 1.00 0.00 C ATOM 367 C VAL A 66 -20.067 19.941 -11.559 1.00 0.00 C ATOM 368 O VAL A 66 -20.712 20.890 -11.112 1.00 0.00 O ATOM 369 CB VAL A 66 -20.866 17.585 -11.769 1.00 0.00 C ATOM 370 CG1 VAL A 66 -21.700 17.755 -10.509 1.00 0.00 C ATOM 371 CG2 VAL A 66 -21.482 16.544 -12.690 1.00 0.00 C ATOM 0 H VAL A 66 -19.577 17.843 -13.888 1.00 0.00 H new ATOM 0 HA VAL A 66 -21.699 19.293 -12.794 1.00 0.00 H new ATOM 0 HB VAL A 66 -19.876 17.236 -11.476 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -21.797 16.794 -10.005 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -21.212 18.466 -9.843 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -22.689 18.127 -10.775 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -21.582 15.599 -12.156 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -22.465 16.883 -13.016 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -20.840 16.402 -13.560 1.00 0.00 H new ATOM 381 N LEU A 67 -18.790 19.730 -11.261 1.00 0.00 N ATOM 382 CA LEU A 67 -18.055 20.622 -10.372 1.00 0.00 C ATOM 383 C LEU A 67 -18.018 22.041 -10.932 1.00 0.00 C ATOM 384 O LEU A 67 -18.028 23.016 -10.182 1.00 0.00 O ATOM 385 CB LEU A 67 -16.630 20.107 -10.164 1.00 0.00 C ATOM 386 CG LEU A 67 -16.427 19.149 -8.989 1.00 0.00 C ATOM 387 CD1 LEU A 67 -15.213 18.264 -9.224 1.00 0.00 C ATOM 388 CD2 LEU A 67 -16.280 19.925 -7.688 1.00 0.00 C ATOM 0 H LEU A 67 -18.242 18.949 -11.622 1.00 0.00 H new ATOM 0 HA LEU A 67 -18.571 20.643 -9.412 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -16.310 19.604 -11.076 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -15.972 20.965 -10.025 1.00 0.00 H new ATOM 0 HG LEU A 67 -17.306 18.510 -8.911 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -15.085 17.590 -8.377 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -15.358 17.681 -10.134 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -14.324 18.886 -9.330 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -16.136 19.228 -6.863 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -15.418 20.589 -7.756 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -17.180 20.515 -7.512 1.00 0.00 H new ATOM 400 N GLY A 68 -17.977 22.148 -12.256 1.00 0.00 N ATOM 401 CA GLY A 68 -17.942 23.451 -12.895 1.00 0.00 C ATOM 402 C GLY A 68 -19.191 24.264 -12.622 1.00 0.00 C ATOM 403 O GLY A 68 -19.111 25.438 -12.261 1.00 0.00 O ATOM 0 H GLY A 68 -17.967 21.356 -12.898 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -17.070 24.002 -12.543 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.824 23.322 -13.971 1.00 0.00 H new ATOM 407 N VAL A 69 -20.352 23.640 -12.797 1.00 0.00 N ATOM 408 CA VAL A 69 -21.625 24.313 -12.569 1.00 0.00 C ATOM 409 C VAL A 69 -21.903 24.470 -11.078 1.00 0.00 C ATOM 410 O VAL A 69 -22.513 25.449 -10.649 1.00 0.00 O ATOM 411 CB VAL A 69 -22.791 23.546 -13.220 1.00 0.00 C ATOM 412 CG1 VAL A 69 -24.113 24.242 -12.935 1.00 0.00 C ATOM 413 CG2 VAL A 69 -22.564 23.404 -14.717 1.00 0.00 C ATOM 0 H VAL A 69 -20.437 22.669 -13.096 1.00 0.00 H new ATOM 0 HA VAL A 69 -21.549 25.299 -13.028 1.00 0.00 H new ATOM 0 HB VAL A 69 -22.834 22.547 -12.786 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -24.925 23.686 -13.403 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -24.276 24.286 -11.858 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -24.086 25.254 -13.339 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -23.397 22.860 -15.161 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -22.494 24.393 -15.170 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -21.638 22.857 -14.894 1.00 0.00 H new ATOM 423 N VAL A 70 -21.451 23.498 -10.291 1.00 0.00 N ATOM 424 CA VAL A 70 -21.651 23.528 -8.847 1.00 0.00 C ATOM 425 C VAL A 70 -20.799 24.613 -8.198 1.00 0.00 C ATOM 426 O VAL A 70 -21.284 25.387 -7.372 1.00 0.00 O ATOM 427 CB VAL A 70 -21.310 22.170 -8.205 1.00 0.00 C ATOM 428 CG1 VAL A 70 -21.333 22.276 -6.688 1.00 0.00 C ATOM 429 CG2 VAL A 70 -22.273 21.097 -8.688 1.00 0.00 C ATOM 0 H VAL A 70 -20.944 22.680 -10.630 1.00 0.00 H new ATOM 0 HA VAL A 70 -22.705 23.747 -8.677 1.00 0.00 H new ATOM 0 HB VAL A 70 -20.303 21.886 -8.510 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -21.090 21.307 -6.252 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -20.600 23.014 -6.364 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -22.326 22.583 -6.360 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -22.018 20.144 -8.225 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -23.292 21.372 -8.414 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -22.201 21.004 -9.772 1.00 0.00 H new ATOM 439 N PHE A 71 -19.526 24.665 -8.577 1.00 0.00 N ATOM 440 CA PHE A 71 -18.606 25.656 -8.032 1.00 0.00 C ATOM 441 C PHE A 71 -19.028 27.067 -8.429 1.00 0.00 C ATOM 442 O PHE A 71 -19.104 27.964 -7.589 1.00 0.00 O ATOM 443 CB PHE A 71 -17.181 25.381 -8.518 1.00 0.00 C ATOM 444 CG PHE A 71 -16.121 25.959 -7.624 1.00 0.00 C ATOM 445 CD1 PHE A 71 -15.954 25.487 -6.332 1.00 0.00 C ATOM 446 CD2 PHE A 71 -15.293 26.973 -8.076 1.00 0.00 C ATOM 447 CE1 PHE A 71 -14.979 26.016 -5.507 1.00 0.00 C ATOM 448 CE2 PHE A 71 -14.316 27.506 -7.255 1.00 0.00 C ATOM 449 CZ PHE A 71 -14.160 27.027 -5.969 1.00 0.00 C ATOM 0 H PHE A 71 -19.108 24.032 -9.259 1.00 0.00 H new ATOM 0 HA PHE A 71 -18.633 25.581 -6.945 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -17.033 24.304 -8.594 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -17.062 25.791 -9.521 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -16.593 24.697 -5.965 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -15.412 27.352 -9.080 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -14.858 25.639 -4.502 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -13.676 28.296 -7.619 1.00 0.00 H new ATOM 0 HZ PHE A 71 -13.399 27.443 -5.326 1.00 0.00 H new ATOM 459 N GLY A 72 -19.301 27.257 -9.716 1.00 0.00 N ATOM 460 CA GLY A 72 -19.711 28.561 -10.203 1.00 0.00 C ATOM 461 C GLY A 72 -20.939 29.087 -9.487 1.00 0.00 C ATOM 462 O GLY A 72 -20.971 30.243 -9.062 1.00 0.00 O ATOM 0 H GLY A 72 -19.246 26.531 -10.430 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -18.890 29.267 -10.077 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -19.916 28.498 -11.272 1.00 0.00 H new ATOM 466 N ILE A 73 -21.953 28.239 -9.353 1.00 0.00 N ATOM 467 CA ILE A 73 -23.189 28.626 -8.684 1.00 0.00 C ATOM 468 C ILE A 73 -22.983 28.752 -7.179 1.00 0.00 C ATOM 469 O ILE A 73 -23.696 29.495 -6.503 1.00 0.00 O ATOM 470 CB ILE A 73 -24.317 27.613 -8.954 1.00 0.00 C ATOM 471 CG1 ILE A 73 -24.578 27.495 -10.457 1.00 0.00 C ATOM 472 CG2 ILE A 73 -25.585 28.024 -8.221 1.00 0.00 C ATOM 473 CD1 ILE A 73 -25.399 26.282 -10.835 1.00 0.00 C ATOM 0 H ILE A 73 -21.943 27.279 -9.699 1.00 0.00 H new ATOM 0 HA ILE A 73 -23.478 29.595 -9.091 1.00 0.00 H new ATOM 0 HB ILE A 73 -24.005 26.637 -8.581 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -25.092 28.393 -10.800 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -23.623 27.455 -10.981 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -26.373 27.298 -8.422 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -25.390 28.061 -7.149 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -25.902 29.008 -8.566 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -25.544 26.263 -11.915 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -24.877 25.378 -10.523 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -26.369 26.330 -10.339 1.00 0.00 H new ATOM 967 N ALA B 153 -9.552 8.373 -13.264 1.00 0.00 N ATOM 968 CA ALA B 153 -10.572 9.411 -13.179 1.00 0.00 C ATOM 969 C ALA B 153 -10.164 10.503 -12.197 1.00 0.00 C ATOM 970 O ALA B 153 -10.288 11.693 -12.490 1.00 0.00 O ATOM 971 CB ALA B 153 -11.908 8.806 -12.773 1.00 0.00 C ATOM 0 HA ALA B 153 -10.675 9.865 -14.164 1.00 0.00 H new ATOM 0 HB1 ALA B 153 -12.660 9.592 -12.713 1.00 0.00 H new ATOM 0 HB2 ALA B 153 -12.213 8.067 -13.514 1.00 0.00 H new ATOM 0 HB3 ALA B 153 -11.809 8.324 -11.800 1.00 0.00 H new ATOM 977 N LEU B 154 -9.677 10.093 -11.032 1.00 0.00 N ATOM 978 CA LEU B 154 -9.250 11.037 -10.005 1.00 0.00 C ATOM 979 C LEU B 154 -8.003 11.795 -10.447 1.00 0.00 C ATOM 980 O LEU B 154 -7.953 13.024 -10.377 1.00 0.00 O ATOM 981 CB LEU B 154 -8.976 10.303 -8.691 1.00 0.00 C ATOM 982 CG LEU B 154 -9.032 11.155 -7.422 1.00 0.00 C ATOM 983 CD1 LEU B 154 -10.467 11.542 -7.101 1.00 0.00 C ATOM 984 CD2 LEU B 154 -8.403 10.412 -6.253 1.00 0.00 C ATOM 0 H LEU B 154 -9.568 9.112 -10.774 1.00 0.00 H new ATOM 0 HA LEU B 154 -10.054 11.756 -9.851 1.00 0.00 H new ATOM 0 HB2 LEU B 154 -9.699 9.493 -8.593 1.00 0.00 H new ATOM 0 HB3 LEU B 154 -7.989 9.844 -8.753 1.00 0.00 H new ATOM 0 HG LEU B 154 -8.462 12.068 -7.595 1.00 0.00 H new ATOM 0 HD11 LEU B 154 -10.487 12.148 -6.195 1.00 0.00 H new ATOM 0 HD12 LEU B 154 -10.883 12.115 -7.930 1.00 0.00 H new ATOM 0 HD13 LEU B 154 -11.061 10.641 -6.948 1.00 0.00 H new ATOM 0 HD21 LEU B 154 -8.452 11.033 -5.359 1.00 0.00 H new ATOM 0 HD22 LEU B 154 -8.945 9.482 -6.079 1.00 0.00 H new ATOM 0 HD23 LEU B 154 -7.361 10.188 -6.483 1.00 0.00 H new ATOM 996 N LEU B 155 -6.998 11.056 -10.904 1.00 0.00 N ATOM 997 CA LEU B 155 -5.751 11.658 -11.360 1.00 0.00 C ATOM 998 C LEU B 155 -6.008 12.662 -12.479 1.00 0.00 C ATOM 999 O LEU B 155 -5.586 13.817 -12.401 1.00 0.00 O ATOM 1000 CB LEU B 155 -4.785 10.574 -11.844 1.00 0.00 C ATOM 1001 CG LEU B 155 -3.316 10.984 -11.951 1.00 0.00 C ATOM 1002 CD1 LEU B 155 -2.634 10.884 -10.595 1.00 0.00 C ATOM 1003 CD2 LEU B 155 -2.595 10.121 -12.977 1.00 0.00 C ATOM 0 H LEU B 155 -7.023 10.038 -10.968 1.00 0.00 H new ATOM 0 HA LEU B 155 -5.303 12.186 -10.519 1.00 0.00 H new ATOM 0 HB2 LEU B 155 -4.856 9.723 -11.166 1.00 0.00 H new ATOM 0 HB3 LEU B 155 -5.118 10.230 -12.823 1.00 0.00 H new ATOM 0 HG LEU B 155 -3.271 12.022 -12.282 1.00 0.00 H new ATOM 0 HD11 LEU B 155 -1.589 11.180 -10.691 1.00 0.00 H new ATOM 0 HD12 LEU B 155 -3.135 11.544 -9.886 1.00 0.00 H new ATOM 0 HD13 LEU B 155 -2.689 9.857 -10.235 1.00 0.00 H new ATOM 0 HD21 LEU B 155 -1.551 10.427 -13.040 1.00 0.00 H new ATOM 0 HD22 LEU B 155 -2.649 9.075 -12.675 1.00 0.00 H new ATOM 0 HD23 LEU B 155 -3.068 10.242 -13.951 1.00 0.00 H new ATOM 1015 N LEU B 156 -6.704 12.216 -13.519 1.00 0.00 N ATOM 1016 CA LEU B 156 -7.020 13.076 -14.654 1.00 0.00 C ATOM 1017 C LEU B 156 -7.697 14.362 -14.191 1.00 0.00 C ATOM 1018 O LEU B 156 -7.345 15.456 -14.634 1.00 0.00 O ATOM 1019 CB LEU B 156 -7.925 12.337 -15.642 1.00 0.00 C ATOM 1020 CG LEU B 156 -7.216 11.457 -16.672 1.00 0.00 C ATOM 1021 CD1 LEU B 156 -8.230 10.696 -17.512 1.00 0.00 C ATOM 1022 CD2 LEU B 156 -6.310 12.298 -17.559 1.00 0.00 C ATOM 0 H LEU B 156 -7.060 11.264 -13.600 1.00 0.00 H new ATOM 0 HA LEU B 156 -6.086 13.338 -15.151 1.00 0.00 H new ATOM 0 HB2 LEU B 156 -8.616 11.713 -15.075 1.00 0.00 H new ATOM 0 HB3 LEU B 156 -8.526 13.074 -16.175 1.00 0.00 H new ATOM 0 HG LEU B 156 -6.599 10.733 -16.140 1.00 0.00 H new ATOM 0 HD11 LEU B 156 -7.707 10.075 -18.239 1.00 0.00 H new ATOM 0 HD12 LEU B 156 -8.837 10.063 -16.865 1.00 0.00 H new ATOM 0 HD13 LEU B 156 -8.874 11.404 -18.035 1.00 0.00 H new ATOM 0 HD21 LEU B 156 -5.814 11.655 -18.286 1.00 0.00 H new ATOM 0 HD22 LEU B 156 -6.906 13.045 -18.083 1.00 0.00 H new ATOM 0 HD23 LEU B 156 -5.561 12.797 -16.945 1.00 0.00 H new ATOM 1034 N LEU B 157 -8.669 14.223 -13.295 1.00 0.00 N ATOM 1035 CA LEU B 157 -9.394 15.375 -12.769 1.00 0.00 C ATOM 1036 C LEU B 157 -8.432 16.400 -12.177 1.00 0.00 C ATOM 1037 O LEU B 157 -8.544 17.598 -12.442 1.00 0.00 O ATOM 1038 CB LEU B 157 -10.398 14.927 -11.706 1.00 0.00 C ATOM 1039 CG LEU B 157 -11.582 15.864 -11.464 1.00 0.00 C ATOM 1040 CD1 LEU B 157 -12.488 15.905 -12.685 1.00 0.00 C ATOM 1041 CD2 LEU B 157 -12.364 15.430 -10.233 1.00 0.00 C ATOM 0 H LEU B 157 -8.973 13.325 -12.918 1.00 0.00 H new ATOM 0 HA LEU B 157 -9.931 15.843 -13.594 1.00 0.00 H new ATOM 0 HB2 LEU B 157 -10.786 13.949 -11.991 1.00 0.00 H new ATOM 0 HB3 LEU B 157 -9.865 14.796 -10.764 1.00 0.00 H new ATOM 0 HG LEU B 157 -11.195 16.868 -11.289 1.00 0.00 H new ATOM 0 HD11 LEU B 157 -13.325 16.577 -12.495 1.00 0.00 H new ATOM 0 HD12 LEU B 157 -11.923 16.264 -13.545 1.00 0.00 H new ATOM 0 HD13 LEU B 157 -12.866 14.904 -12.891 1.00 0.00 H new ATOM 0 HD21 LEU B 157 -13.203 16.109 -10.077 1.00 0.00 H new ATOM 0 HD22 LEU B 157 -12.739 14.417 -10.379 1.00 0.00 H new ATOM 0 HD23 LEU B 157 -11.711 15.453 -9.360 1.00 0.00 H new ATOM 1053 N LEU B 158 -7.486 15.922 -11.376 1.00 0.00 N ATOM 1054 CA LEU B 158 -6.502 16.797 -10.747 1.00 0.00 C ATOM 1055 C LEU B 158 -5.558 17.390 -11.788 1.00 0.00 C ATOM 1056 O LEU B 158 -5.194 18.564 -11.713 1.00 0.00 O ATOM 1057 CB LEU B 158 -5.702 16.025 -9.697 1.00 0.00 C ATOM 1058 CG LEU B 158 -5.051 16.866 -8.598 1.00 0.00 C ATOM 1059 CD1 LEU B 158 -5.214 16.193 -7.244 1.00 0.00 C ATOM 1060 CD2 LEU B 158 -3.579 17.098 -8.906 1.00 0.00 C ATOM 0 H LEU B 158 -7.379 14.934 -11.147 1.00 0.00 H new ATOM 0 HA LEU B 158 -7.036 17.613 -10.260 1.00 0.00 H new ATOM 0 HB2 LEU B 158 -6.364 15.298 -9.227 1.00 0.00 H new ATOM 0 HB3 LEU B 158 -4.921 15.461 -10.207 1.00 0.00 H new ATOM 0 HG LEU B 158 -5.552 17.834 -8.563 1.00 0.00 H new ATOM 0 HD11 LEU B 158 -4.745 16.806 -6.474 1.00 0.00 H new ATOM 0 HD12 LEU B 158 -6.275 16.078 -7.020 1.00 0.00 H new ATOM 0 HD13 LEU B 158 -4.740 15.212 -7.266 1.00 0.00 H new ATOM 0 HD21 LEU B 158 -3.132 17.698 -8.114 1.00 0.00 H new ATOM 0 HD22 LEU B 158 -3.065 16.139 -8.969 1.00 0.00 H new ATOM 0 HD23 LEU B 158 -3.485 17.623 -9.856 1.00 0.00 H new ATOM 1072 N VAL B 159 -5.166 16.572 -12.759 1.00 0.00 N ATOM 1073 CA VAL B 159 -4.267 17.016 -13.817 1.00 0.00 C ATOM 1074 C VAL B 159 -4.908 18.113 -14.658 1.00 0.00 C ATOM 1075 O VAL B 159 -4.293 19.146 -14.925 1.00 0.00 O ATOM 1076 CB VAL B 159 -3.862 15.849 -14.737 1.00 0.00 C ATOM 1077 CG1 VAL B 159 -2.939 16.336 -15.843 1.00 0.00 C ATOM 1078 CG2 VAL B 159 -3.203 14.739 -13.931 1.00 0.00 C ATOM 0 H VAL B 159 -5.457 15.597 -12.835 1.00 0.00 H new ATOM 0 HA VAL B 159 -3.375 17.410 -13.329 1.00 0.00 H new ATOM 0 HB VAL B 159 -4.762 15.445 -15.200 1.00 0.00 H new ATOM 0 HG11 VAL B 159 -2.664 15.497 -16.483 1.00 0.00 H new ATOM 0 HG12 VAL B 159 -3.451 17.093 -16.437 1.00 0.00 H new ATOM 0 HG13 VAL B 159 -2.040 16.767 -15.403 1.00 0.00 H new ATOM 0 HG21 VAL B 159 -2.923 13.923 -14.597 1.00 0.00 H new ATOM 0 HG22 VAL B 159 -2.311 15.127 -13.438 1.00 0.00 H new ATOM 0 HG23 VAL B 159 -3.902 14.371 -13.180 1.00 0.00 H new ATOM 1088 N VAL B 160 -6.149 17.883 -15.075 1.00 0.00 N ATOM 1089 CA VAL B 160 -6.876 18.853 -15.886 1.00 0.00 C ATOM 1090 C VAL B 160 -7.128 20.140 -15.108 1.00 0.00 C ATOM 1091 O VAL B 160 -6.893 21.238 -15.612 1.00 0.00 O ATOM 1092 CB VAL B 160 -8.224 18.284 -16.367 1.00 0.00 C ATOM 1093 CG1 VAL B 160 -8.902 19.254 -17.323 1.00 0.00 C ATOM 1094 CG2 VAL B 160 -8.025 16.927 -17.024 1.00 0.00 C ATOM 0 H VAL B 160 -6.672 17.033 -14.865 1.00 0.00 H new ATOM 0 HA VAL B 160 -6.253 19.072 -16.753 1.00 0.00 H new ATOM 0 HB VAL B 160 -8.873 18.151 -15.501 1.00 0.00 H new ATOM 0 HG11 VAL B 160 -9.853 18.835 -17.652 1.00 0.00 H new ATOM 0 HG12 VAL B 160 -9.080 20.202 -16.815 1.00 0.00 H new ATOM 0 HG13 VAL B 160 -8.260 19.421 -18.188 1.00 0.00 H new ATOM 0 HG21 VAL B 160 -8.988 16.540 -17.358 1.00 0.00 H new ATOM 0 HG22 VAL B 160 -7.359 17.032 -17.881 1.00 0.00 H new ATOM 0 HG23 VAL B 160 -7.585 16.236 -16.305 1.00 0.00 H new ATOM 1104 N ALA B 161 -7.608 19.997 -13.877 1.00 0.00 N ATOM 1105 CA ALA B 161 -7.891 21.148 -13.029 1.00 0.00 C ATOM 1106 C ALA B 161 -6.656 22.028 -12.869 1.00 0.00 C ATOM 1107 O ALA B 161 -6.759 23.254 -12.802 1.00 0.00 O ATOM 1108 CB ALA B 161 -8.394 20.690 -11.668 1.00 0.00 C ATOM 0 H ALA B 161 -7.809 19.095 -13.445 1.00 0.00 H new ATOM 0 HA ALA B 161 -8.668 21.741 -13.511 1.00 0.00 H new ATOM 0 HB1 ALA B 161 -8.601 21.560 -11.045 1.00 0.00 H new ATOM 0 HB2 ALA B 161 -9.307 20.108 -11.794 1.00 0.00 H new ATOM 0 HB3 ALA B 161 -7.634 20.073 -11.188 1.00 0.00 H new ATOM 1114 N LEU B 162 -5.489 21.397 -12.809 1.00 0.00 N ATOM 1115 CA LEU B 162 -4.233 22.124 -12.657 1.00 0.00 C ATOM 1116 C LEU B 162 -3.854 22.833 -13.953 1.00 0.00 C ATOM 1117 O LEU B 162 -3.352 23.956 -13.934 1.00 0.00 O ATOM 1118 CB LEU B 162 -3.115 21.167 -12.240 1.00 0.00 C ATOM 1119 CG LEU B 162 -1.999 21.770 -11.386 1.00 0.00 C ATOM 1120 CD1 LEU B 162 -2.322 21.628 -9.907 1.00 0.00 C ATOM 1121 CD2 LEU B 162 -0.665 21.111 -11.709 1.00 0.00 C ATOM 0 H LEU B 162 -5.386 20.384 -12.863 1.00 0.00 H new ATOM 0 HA LEU B 162 -4.368 22.876 -11.880 1.00 0.00 H new ATOM 0 HB2 LEU B 162 -3.560 20.339 -11.689 1.00 0.00 H new ATOM 0 HB3 LEU B 162 -2.669 20.747 -13.141 1.00 0.00 H new ATOM 0 HG LEU B 162 -1.923 22.832 -11.619 1.00 0.00 H new ATOM 0 HD11 LEU B 162 -1.516 22.063 -9.315 1.00 0.00 H new ATOM 0 HD12 LEU B 162 -3.255 22.147 -9.687 1.00 0.00 H new ATOM 0 HD13 LEU B 162 -2.427 20.572 -9.657 1.00 0.00 H new ATOM 0 HD21 LEU B 162 0.118 21.552 -11.092 1.00 0.00 H new ATOM 0 HD22 LEU B 162 -0.728 20.042 -11.505 1.00 0.00 H new ATOM 0 HD23 LEU B 162 -0.428 21.266 -12.762 1.00 0.00 H new ATOM 1133 N GLY B 163 -4.099 22.169 -15.079 1.00 0.00 N ATOM 1134 CA GLY B 163 -3.779 22.752 -16.368 1.00 0.00 C ATOM 1135 C GLY B 163 -4.719 23.880 -16.744 1.00 0.00 C ATOM 1136 O GLY B 163 -4.290 24.903 -17.278 1.00 0.00 O ATOM 0 H GLY B 163 -4.513 21.238 -15.121 1.00 0.00 H new ATOM 0 HA2 GLY B 163 -2.756 23.127 -16.350 1.00 0.00 H new ATOM 0 HA3 GLY B 163 -3.821 21.978 -17.134 1.00 0.00 H new ATOM 1140 N ILE B 164 -6.005 23.694 -16.466 1.00 0.00 N ATOM 1141 CA ILE B 164 -7.008 24.704 -16.780 1.00 0.00 C ATOM 1142 C ILE B 164 -6.916 25.886 -15.821 1.00 0.00 C ATOM 1143 O ILE B 164 -7.076 27.038 -16.221 1.00 0.00 O ATOM 1144 CB ILE B 164 -8.432 24.120 -16.722 1.00 0.00 C ATOM 1145 CG1 ILE B 164 -8.576 22.970 -17.721 1.00 0.00 C ATOM 1146 CG2 ILE B 164 -9.461 25.205 -17.003 1.00 0.00 C ATOM 1147 CD1 ILE B 164 -9.965 22.371 -17.757 1.00 0.00 C ATOM 0 H ILE B 164 -6.377 22.853 -16.024 1.00 0.00 H new ATOM 0 HA ILE B 164 -6.805 25.046 -17.795 1.00 0.00 H new ATOM 0 HB ILE B 164 -8.609 23.730 -15.720 1.00 0.00 H new ATOM 0 HG12 ILE B 164 -8.319 23.330 -18.717 1.00 0.00 H new ATOM 0 HG13 ILE B 164 -7.859 22.189 -17.469 1.00 0.00 H new ATOM 0 HG21 ILE B 164 -10.462 24.777 -16.959 1.00 0.00 H new ATOM 0 HG22 ILE B 164 -9.370 25.994 -16.257 1.00 0.00 H new ATOM 0 HG23 ILE B 164 -9.288 25.622 -17.995 1.00 0.00 H new ATOM 0 HD11 ILE B 164 -9.993 21.562 -18.487 1.00 0.00 H new ATOM 0 HD12 ILE B 164 -10.218 21.980 -16.772 1.00 0.00 H new ATOM 0 HD13 ILE B 164 -10.685 23.139 -18.039 1.00 0.00 H new ATOM 1159 N GLY B 165 -6.655 25.592 -14.550 1.00 0.00 N ATOM 1160 CA GLY B 165 -6.545 26.640 -13.554 1.00 0.00 C ATOM 1161 C GLY B 165 -5.333 27.525 -13.775 1.00 0.00 C ATOM 1162 O GLY B 165 -5.410 28.745 -13.622 1.00 0.00 O ATOM 0 H GLY B 165 -6.518 24.646 -14.194 1.00 0.00 H new ATOM 0 HA2 GLY B 165 -7.447 27.252 -13.574 1.00 0.00 H new ATOM 0 HA3 GLY B 165 -6.487 26.190 -12.563 1.00 0.00 H new ATOM 1166 N LEU B 166 -4.212 26.910 -14.133 1.00 0.00 N ATOM 1167 CA LEU B 166 -2.977 27.649 -14.374 1.00 0.00 C ATOM 1168 C LEU B 166 -3.078 28.475 -15.652 1.00 0.00 C ATOM 1169 O LEU B 166 -2.628 29.620 -15.701 1.00 0.00 O ATOM 1170 CB LEU B 166 -1.793 26.686 -14.468 1.00 0.00 C ATOM 1171 CG LEU B 166 -1.072 26.378 -13.155 1.00 0.00 C ATOM 1172 CD1 LEU B 166 -0.117 25.208 -13.331 1.00 0.00 C ATOM 1173 CD2 LEU B 166 -0.327 27.606 -12.654 1.00 0.00 C ATOM 0 H LEU B 166 -4.132 25.901 -14.263 1.00 0.00 H new ATOM 0 HA LEU B 166 -2.819 28.328 -13.536 1.00 0.00 H new ATOM 0 HB2 LEU B 166 -2.147 25.747 -14.894 1.00 0.00 H new ATOM 0 HB3 LEU B 166 -1.068 27.100 -15.169 1.00 0.00 H new ATOM 0 HG LEU B 166 -1.818 26.102 -12.410 1.00 0.00 H new ATOM 0 HD11 LEU B 166 0.387 25.004 -12.386 1.00 0.00 H new ATOM 0 HD12 LEU B 166 -0.676 24.326 -13.642 1.00 0.00 H new ATOM 0 HD13 LEU B 166 0.624 25.455 -14.091 1.00 0.00 H new ATOM 0 HD21 LEU B 166 0.180 27.368 -11.719 1.00 0.00 H new ATOM 0 HD22 LEU B 166 0.409 27.914 -13.397 1.00 0.00 H new ATOM 0 HD23 LEU B 166 -1.035 28.418 -12.486 1.00 0.00 H new ATOM 1185 N PHE B 167 -3.673 27.887 -16.685 1.00 0.00 N ATOM 1186 CA PHE B 167 -3.835 28.569 -17.964 1.00 0.00 C ATOM 1187 C PHE B 167 -4.809 29.737 -17.838 1.00 0.00 C ATOM 1188 O PHE B 167 -4.621 30.785 -18.455 1.00 0.00 O ATOM 1189 CB PHE B 167 -4.329 27.589 -19.030 1.00 0.00 C ATOM 1190 CG PHE B 167 -3.869 27.931 -20.418 1.00 0.00 C ATOM 1191 CD1 PHE B 167 -4.288 29.100 -21.033 1.00 0.00 C ATOM 1192 CD2 PHE B 167 -3.018 27.083 -21.108 1.00 0.00 C ATOM 1193 CE1 PHE B 167 -3.866 29.418 -22.310 1.00 0.00 C ATOM 1194 CE2 PHE B 167 -2.592 27.396 -22.386 1.00 0.00 C ATOM 1195 CZ PHE B 167 -3.018 28.564 -22.988 1.00 0.00 C ATOM 0 H PHE B 167 -4.051 26.940 -16.661 1.00 0.00 H new ATOM 0 HA PHE B 167 -2.863 28.961 -18.264 1.00 0.00 H new ATOM 0 HB2 PHE B 167 -3.984 26.586 -18.778 1.00 0.00 H new ATOM 0 HB3 PHE B 167 -5.419 27.565 -19.013 1.00 0.00 H new ATOM 0 HD1 PHE B 167 -4.952 29.771 -20.508 1.00 0.00 H new ATOM 0 HD2 PHE B 167 -2.684 26.167 -20.643 1.00 0.00 H new ATOM 0 HE1 PHE B 167 -4.199 30.333 -22.777 1.00 0.00 H new ATOM 0 HE2 PHE B 167 -1.927 26.728 -22.913 1.00 0.00 H new ATOM 0 HZ PHE B 167 -2.689 28.809 -23.987 1.00 0.00 H new ATOM 1205 N MET B 168 -5.852 29.546 -17.036 1.00 0.00 N ATOM 1206 CA MET B 168 -6.856 30.583 -16.829 1.00 0.00 C ATOM 1207 C MET B 168 -6.327 31.676 -15.907 1.00 0.00 C ATOM 1208 O MET B 168 -6.776 32.821 -15.964 1.00 0.00 O ATOM 1209 CB MET B 168 -8.132 29.976 -16.241 1.00 0.00 C ATOM 1210 CG MET B 168 -9.135 29.532 -17.294 1.00 0.00 C ATOM 1211 SD MET B 168 -10.734 30.345 -17.116 1.00 0.00 S ATOM 1212 CE MET B 168 -11.836 29.053 -17.686 1.00 0.00 C ATOM 0 H MET B 168 -6.024 28.683 -16.519 1.00 0.00 H new ATOM 0 HA MET B 168 -7.086 31.029 -17.796 1.00 0.00 H new ATOM 0 HB2 MET B 168 -7.865 29.120 -15.621 1.00 0.00 H new ATOM 0 HB3 MET B 168 -8.605 30.708 -15.587 1.00 0.00 H new ATOM 0 HG2 MET B 168 -8.733 29.743 -18.285 1.00 0.00 H new ATOM 0 HG3 MET B 168 -9.271 28.453 -17.228 1.00 0.00 H new ATOM 0 HE1 MET B 168 -12.866 29.405 -17.636 1.00 0.00 H new ATOM 0 HE2 MET B 168 -11.591 28.794 -18.716 1.00 0.00 H new ATOM 0 HE3 MET B 168 -11.722 28.172 -17.054 1.00 0.00 H new ATOM 1222 N ARG B 169 -5.370 31.315 -15.057 1.00 0.00 N ATOM 1223 CA ARG B 169 -4.781 32.266 -14.122 1.00 0.00 C ATOM 1224 C ARG B 169 -3.697 33.096 -14.801 1.00 0.00 C ATOM 1225 O ARG B 169 -3.261 34.119 -14.272 1.00 0.00 O ATOM 1226 CB ARG B 169 -4.195 31.530 -12.916 1.00 0.00 C ATOM 1227 CG ARG B 169 -5.114 31.514 -11.706 1.00 0.00 C ATOM 1228 CD ARG B 169 -5.130 32.861 -11.000 1.00 0.00 C ATOM 1229 NE ARG B 169 -6.363 33.070 -10.246 1.00 0.00 N ATOM 1230 CZ ARG B 169 -6.644 32.444 -9.108 1.00 0.00 C ATOM 1231 NH1 ARG B 169 -5.783 31.574 -8.597 1.00 0.00 N ATOM 1232 NH2 ARG B 169 -7.787 32.687 -8.480 1.00 0.00 N ATOM 0 H ARG B 169 -4.987 30.372 -14.997 1.00 0.00 H new ATOM 0 HA ARG B 169 -5.569 32.938 -13.782 1.00 0.00 H new ATOM 0 HB2 ARG B 169 -3.968 30.503 -13.203 1.00 0.00 H new ATOM 0 HB3 ARG B 169 -3.251 31.999 -12.638 1.00 0.00 H new ATOM 0 HG2 ARG B 169 -6.125 31.254 -12.019 1.00 0.00 H new ATOM 0 HG3 ARG B 169 -4.788 30.741 -11.010 1.00 0.00 H new ATOM 0 HD2 ARG B 169 -4.277 32.926 -10.325 1.00 0.00 H new ATOM 0 HD3 ARG B 169 -5.016 33.657 -11.736 1.00 0.00 H new ATOM 0 HE ARG B 169 -7.046 33.733 -10.613 1.00 0.00 H new ATOM 0 HH11 ARG B 169 -4.904 31.385 -9.078 1.00 0.00 H new ATOM 0 HH12 ARG B 169 -6.000 31.094 -7.723 1.00 0.00 H new ATOM 0 HH21 ARG B 169 -8.451 33.355 -8.871 1.00 0.00 H new ATOM 0 HH22 ARG B 169 -8.001 32.206 -7.607 1.00 0.00 H new