USER MOD reduce.3.24.130724 H: found=0, std=0, add=299, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 301 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 21 CYS SG : rot 76:sc= 0.398 USER MOD Single : A 25 SER OG : rot 78:sc= 0.887 USER MOD Single : A 26 THR OG1 : rot 68:sc= 1.01 USER MOD Single : B 121 CYS SG : rot 78:sc= 0.442 USER MOD Single : B 125 SER OG : rot 75:sc= 0.77 USER MOD Single : B 126 THR OG1 : rot 68:sc= 0.614 USER MOD ----------------------------------------------------------------- ATOM 171 N VAL A 12 -14.539 2.832 -12.590 1.00 0.00 N ATOM 172 CA VAL A 12 -14.907 1.510 -12.097 1.00 0.00 C ATOM 173 C VAL A 12 -16.081 1.593 -11.127 1.00 0.00 C ATOM 174 O VAL A 12 -17.089 0.907 -11.297 1.00 0.00 O ATOM 175 CB VAL A 12 -13.721 0.824 -11.393 1.00 0.00 C ATOM 176 CG1 VAL A 12 -14.129 -0.546 -10.874 1.00 0.00 C ATOM 177 CG2 VAL A 12 -12.534 0.714 -12.337 1.00 0.00 C ATOM 0 HA VAL A 12 -15.197 0.917 -12.965 1.00 0.00 H new ATOM 0 HB VAL A 12 -13.423 1.435 -10.541 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -13.279 -1.016 -10.380 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.947 -0.437 -10.162 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -14.454 -1.169 -11.707 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -11.705 0.227 -11.824 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -12.817 0.125 -13.210 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -12.229 1.711 -12.655 1.00 0.00 H new ATOM 187 N ALA A 13 -15.943 2.437 -10.110 1.00 0.00 N ATOM 188 CA ALA A 13 -16.993 2.611 -9.114 1.00 0.00 C ATOM 189 C ALA A 13 -18.290 3.085 -9.761 1.00 0.00 C ATOM 190 O ALA A 13 -19.381 2.693 -9.347 1.00 0.00 O ATOM 191 CB ALA A 13 -16.546 3.595 -8.043 1.00 0.00 C ATOM 0 H ALA A 13 -15.114 3.011 -9.954 1.00 0.00 H new ATOM 0 HA ALA A 13 -17.182 1.644 -8.648 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -17.340 3.716 -7.306 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -15.649 3.216 -7.552 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -16.328 4.559 -8.503 1.00 0.00 H new ATOM 197 N VAL A 14 -18.164 3.930 -10.779 1.00 0.00 N ATOM 198 CA VAL A 14 -19.327 4.457 -11.484 1.00 0.00 C ATOM 199 C VAL A 14 -20.083 3.346 -12.203 1.00 0.00 C ATOM 200 O VAL A 14 -21.275 3.144 -11.975 1.00 0.00 O ATOM 201 CB VAL A 14 -18.922 5.534 -12.508 1.00 0.00 C ATOM 202 CG1 VAL A 14 -20.143 6.041 -13.260 1.00 0.00 C ATOM 203 CG2 VAL A 14 -18.197 6.679 -11.818 1.00 0.00 C ATOM 0 H VAL A 14 -17.268 4.265 -11.134 1.00 0.00 H new ATOM 0 HA VAL A 14 -19.976 4.907 -10.733 1.00 0.00 H new ATOM 0 HB VAL A 14 -18.240 5.086 -13.231 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -19.838 6.801 -13.979 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -20.616 5.212 -13.787 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -20.852 6.473 -12.554 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -17.918 7.431 -12.556 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -18.853 7.128 -11.073 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -17.299 6.300 -11.330 1.00 0.00 H new ATOM 213 N GLY A 15 -19.381 2.626 -13.073 1.00 0.00 N ATOM 214 CA GLY A 15 -20.003 1.543 -13.813 1.00 0.00 C ATOM 215 C GLY A 15 -20.565 0.468 -12.904 1.00 0.00 C ATOM 216 O GLY A 15 -21.743 0.121 -12.995 1.00 0.00 O ATOM 0 H GLY A 15 -18.393 2.773 -13.279 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -20.804 1.944 -14.434 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -19.270 1.099 -14.486 1.00 0.00 H new ATOM 220 N LEU A 16 -19.720 -0.063 -12.027 1.00 0.00 N ATOM 221 CA LEU A 16 -20.139 -1.107 -11.098 1.00 0.00 C ATOM 222 C LEU A 16 -21.383 -0.682 -10.325 1.00 0.00 C ATOM 223 O LEU A 16 -22.373 -1.410 -10.274 1.00 0.00 O ATOM 224 CB LEU A 16 -19.006 -1.434 -10.123 1.00 0.00 C ATOM 225 CG LEU A 16 -18.021 -2.513 -10.576 1.00 0.00 C ATOM 226 CD1 LEU A 16 -16.762 -2.479 -9.724 1.00 0.00 C ATOM 227 CD2 LEU A 16 -18.672 -3.888 -10.515 1.00 0.00 C ATOM 0 H LEU A 16 -18.742 0.212 -11.940 1.00 0.00 H new ATOM 0 HA LEU A 16 -20.381 -1.998 -11.677 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -18.447 -0.519 -9.927 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -19.447 -1.747 -9.177 1.00 0.00 H new ATOM 0 HG LEU A 16 -17.740 -2.311 -11.610 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -16.073 -3.254 -10.061 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -16.285 -1.503 -9.818 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -17.024 -2.655 -8.681 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -17.957 -4.644 -10.841 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -18.982 -4.099 -9.491 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -19.544 -3.907 -11.169 1.00 0.00 H new ATOM 239 N ALA A 17 -21.324 0.503 -9.726 1.00 0.00 N ATOM 240 CA ALA A 17 -22.448 1.027 -8.959 1.00 0.00 C ATOM 241 C ALA A 17 -23.735 0.990 -9.775 1.00 0.00 C ATOM 242 O ALA A 17 -24.753 0.464 -9.325 1.00 0.00 O ATOM 243 CB ALA A 17 -22.154 2.447 -8.496 1.00 0.00 C ATOM 0 H ALA A 17 -20.511 1.118 -9.757 1.00 0.00 H new ATOM 0 HA ALA A 17 -22.586 0.392 -8.084 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -23.001 2.826 -7.925 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -21.263 2.448 -7.868 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -21.987 3.085 -9.364 1.00 0.00 H new ATOM 249 N VAL A 18 -23.683 1.553 -10.979 1.00 0.00 N ATOM 250 CA VAL A 18 -24.845 1.584 -11.859 1.00 0.00 C ATOM 251 C VAL A 18 -25.454 0.195 -12.014 1.00 0.00 C ATOM 252 O VAL A 18 -26.666 0.018 -11.881 1.00 0.00 O ATOM 253 CB VAL A 18 -24.480 2.131 -13.251 1.00 0.00 C ATOM 254 CG1 VAL A 18 -25.696 2.120 -14.165 1.00 0.00 C ATOM 255 CG2 VAL A 18 -23.901 3.533 -13.138 1.00 0.00 C ATOM 0 H VAL A 18 -22.849 1.993 -11.367 1.00 0.00 H new ATOM 0 HA VAL A 18 -25.575 2.248 -11.396 1.00 0.00 H new ATOM 0 HB VAL A 18 -23.720 1.483 -13.688 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -25.419 2.510 -15.144 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -26.062 1.099 -14.272 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -26.480 2.743 -13.735 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -23.649 3.904 -14.132 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -24.636 4.194 -12.680 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -23.002 3.507 -12.522 1.00 0.00 H new ATOM 265 N PHE A 19 -24.607 -0.788 -12.295 1.00 0.00 N ATOM 266 CA PHE A 19 -25.061 -2.163 -12.469 1.00 0.00 C ATOM 267 C PHE A 19 -25.778 -2.661 -11.217 1.00 0.00 C ATOM 268 O PHE A 19 -26.914 -3.130 -11.285 1.00 0.00 O ATOM 269 CB PHE A 19 -23.877 -3.078 -12.790 1.00 0.00 C ATOM 270 CG PHE A 19 -24.210 -4.169 -13.767 1.00 0.00 C ATOM 271 CD1 PHE A 19 -24.284 -3.904 -15.125 1.00 0.00 C ATOM 272 CD2 PHE A 19 -24.451 -5.461 -13.326 1.00 0.00 C ATOM 273 CE1 PHE A 19 -24.590 -4.906 -16.026 1.00 0.00 C ATOM 274 CE2 PHE A 19 -24.757 -6.467 -14.223 1.00 0.00 C ATOM 275 CZ PHE A 19 -24.828 -6.189 -15.574 1.00 0.00 C ATOM 0 H PHE A 19 -23.601 -0.659 -12.407 1.00 0.00 H new ATOM 0 HA PHE A 19 -25.763 -2.184 -13.302 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -23.062 -2.477 -13.193 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -23.514 -3.527 -11.866 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -24.100 -2.902 -15.484 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -24.399 -5.684 -12.271 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -24.643 -4.686 -17.082 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -24.941 -7.470 -13.868 1.00 0.00 H new ATOM 0 HZ PHE A 19 -25.069 -6.974 -16.276 1.00 0.00 H new ATOM 285 N ALA A 20 -25.105 -2.557 -10.076 1.00 0.00 N ATOM 286 CA ALA A 20 -25.677 -2.995 -8.809 1.00 0.00 C ATOM 287 C ALA A 20 -26.976 -2.256 -8.509 1.00 0.00 C ATOM 288 O ALA A 20 -27.929 -2.841 -7.991 1.00 0.00 O ATOM 289 CB ALA A 20 -24.678 -2.790 -7.680 1.00 0.00 C ATOM 0 H ALA A 20 -24.163 -2.173 -10.003 1.00 0.00 H new ATOM 0 HA ALA A 20 -25.904 -4.058 -8.889 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -25.119 -3.121 -6.740 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -23.777 -3.369 -7.882 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -24.422 -1.733 -7.608 1.00 0.00 H new ATOM 295 N CYS A 21 -27.009 -0.969 -8.836 1.00 0.00 N ATOM 296 CA CYS A 21 -28.192 -0.150 -8.599 1.00 0.00 C ATOM 297 C CYS A 21 -29.404 -0.721 -9.329 1.00 0.00 C ATOM 298 O CYS A 21 -30.509 -0.755 -8.787 1.00 0.00 O ATOM 299 CB CYS A 21 -27.941 1.289 -9.053 1.00 0.00 C ATOM 300 SG CYS A 21 -26.860 2.232 -7.951 1.00 0.00 S ATOM 0 H CYS A 21 -26.230 -0.470 -9.266 1.00 0.00 H new ATOM 0 HA CYS A 21 -28.399 -0.156 -7.529 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -27.501 1.273 -10.050 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -28.898 1.805 -9.135 1.00 0.00 H new ATOM 0 HG CYS A 21 -25.627 1.863 -8.132 1.00 0.00 H new ATOM 306 N LEU A 22 -29.189 -1.169 -10.561 1.00 0.00 N ATOM 307 CA LEU A 22 -30.264 -1.738 -11.367 1.00 0.00 C ATOM 308 C LEU A 22 -30.752 -3.054 -10.771 1.00 0.00 C ATOM 309 O LEU A 22 -31.954 -3.314 -10.714 1.00 0.00 O ATOM 310 CB LEU A 22 -29.788 -1.960 -12.803 1.00 0.00 C ATOM 311 CG LEU A 22 -30.019 -0.801 -13.774 1.00 0.00 C ATOM 312 CD1 LEU A 22 -29.460 -1.135 -15.147 1.00 0.00 C ATOM 313 CD2 LEU A 22 -31.502 -0.470 -13.866 1.00 0.00 C ATOM 0 H LEU A 22 -28.280 -1.149 -11.024 1.00 0.00 H new ATOM 0 HA LEU A 22 -31.095 -1.032 -11.372 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -28.721 -2.182 -12.781 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -30.289 -2.844 -13.198 1.00 0.00 H new ATOM 0 HG LEU A 22 -29.494 0.076 -13.394 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -29.634 -0.299 -15.824 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -28.389 -1.322 -15.068 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -29.956 -2.025 -15.535 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -31.648 0.357 -14.561 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -32.048 -1.344 -14.221 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -31.873 -0.186 -12.881 1.00 0.00 H new ATOM 325 N PHE A 23 -29.812 -3.881 -10.326 1.00 0.00 N ATOM 326 CA PHE A 23 -30.146 -5.171 -9.734 1.00 0.00 C ATOM 327 C PHE A 23 -31.076 -4.995 -8.537 1.00 0.00 C ATOM 328 O PHE A 23 -32.060 -5.721 -8.389 1.00 0.00 O ATOM 329 CB PHE A 23 -28.874 -5.903 -9.301 1.00 0.00 C ATOM 330 CG PHE A 23 -29.128 -7.283 -8.766 1.00 0.00 C ATOM 331 CD1 PHE A 23 -30.200 -8.031 -9.225 1.00 0.00 C ATOM 332 CD2 PHE A 23 -28.295 -7.832 -7.805 1.00 0.00 C ATOM 333 CE1 PHE A 23 -30.437 -9.302 -8.735 1.00 0.00 C ATOM 334 CE2 PHE A 23 -28.527 -9.102 -7.312 1.00 0.00 C ATOM 335 CZ PHE A 23 -29.600 -9.837 -7.776 1.00 0.00 C ATOM 0 H PHE A 23 -28.813 -3.681 -10.364 1.00 0.00 H new ATOM 0 HA PHE A 23 -30.660 -5.766 -10.489 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -28.196 -5.971 -10.152 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -28.368 -5.313 -8.537 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -30.858 -7.617 -9.974 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -27.455 -7.261 -7.437 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -31.275 -9.875 -9.102 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -27.869 -9.520 -6.564 1.00 0.00 H new ATOM 0 HZ PHE A 23 -29.784 -10.829 -7.389 1.00 0.00 H new ATOM 345 N LEU A 24 -30.758 -4.026 -7.686 1.00 0.00 N ATOM 346 CA LEU A 24 -31.565 -3.753 -6.501 1.00 0.00 C ATOM 347 C LEU A 24 -32.922 -3.173 -6.887 1.00 0.00 C ATOM 348 O LEU A 24 -33.927 -3.426 -6.224 1.00 0.00 O ATOM 349 CB LEU A 24 -30.830 -2.786 -5.571 1.00 0.00 C ATOM 350 CG LEU A 24 -29.924 -3.425 -4.518 1.00 0.00 C ATOM 351 CD1 LEU A 24 -29.140 -2.358 -3.770 1.00 0.00 C ATOM 352 CD2 LEU A 24 -30.744 -4.265 -3.549 1.00 0.00 C ATOM 0 H LEU A 24 -29.948 -3.416 -7.794 1.00 0.00 H new ATOM 0 HA LEU A 24 -31.729 -4.696 -5.979 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -30.226 -2.115 -6.182 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -31.571 -2.172 -5.059 1.00 0.00 H new ATOM 0 HG LEU A 24 -29.215 -4.079 -5.025 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -28.501 -2.832 -3.025 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -28.524 -1.799 -4.474 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -29.833 -1.678 -3.274 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -30.083 -4.712 -2.806 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -31.477 -3.632 -3.049 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -31.260 -5.053 -4.097 1.00 0.00 H new ATOM 364 N SER A 25 -32.942 -2.396 -7.965 1.00 0.00 N ATOM 365 CA SER A 25 -34.175 -1.778 -8.440 1.00 0.00 C ATOM 366 C SER A 25 -35.115 -2.825 -9.029 1.00 0.00 C ATOM 367 O SER A 25 -36.333 -2.746 -8.866 1.00 0.00 O ATOM 368 CB SER A 25 -33.864 -0.708 -9.488 1.00 0.00 C ATOM 369 OG SER A 25 -33.126 0.361 -8.921 1.00 0.00 O ATOM 0 H SER A 25 -32.118 -2.179 -8.526 1.00 0.00 H new ATOM 0 HA SER A 25 -34.669 -1.309 -7.589 1.00 0.00 H new ATOM 0 HB2 SER A 25 -33.298 -1.151 -10.308 1.00 0.00 H new ATOM 0 HB3 SER A 25 -34.794 -0.328 -9.912 1.00 0.00 H new ATOM 0 HG SER A 25 -32.188 0.094 -8.820 1.00 0.00 H new ATOM 375 N THR A 26 -34.540 -3.808 -9.716 1.00 0.00 N ATOM 376 CA THR A 26 -35.325 -4.871 -10.331 1.00 0.00 C ATOM 377 C THR A 26 -35.975 -5.757 -9.274 1.00 0.00 C ATOM 378 O THR A 26 -37.178 -6.018 -9.322 1.00 0.00 O ATOM 379 CB THR A 26 -34.458 -5.746 -11.255 1.00 0.00 C ATOM 380 OG1 THR A 26 -33.740 -4.921 -12.179 1.00 0.00 O ATOM 381 CG2 THR A 26 -35.317 -6.742 -12.020 1.00 0.00 C ATOM 0 H THR A 26 -33.534 -3.890 -9.860 1.00 0.00 H new ATOM 0 HA THR A 26 -36.102 -4.388 -10.924 1.00 0.00 H new ATOM 0 HB THR A 26 -33.751 -6.299 -10.636 1.00 0.00 H new ATOM 0 HG1 THR A 26 -33.068 -4.397 -11.696 1.00 0.00 H new ATOM 0 HG21 THR A 26 -34.683 -7.349 -12.666 1.00 0.00 H new ATOM 0 HG22 THR A 26 -35.840 -7.388 -11.315 1.00 0.00 H new ATOM 0 HG23 THR A 26 -36.044 -6.204 -12.628 1.00 0.00 H new ATOM 389 N LEU A 27 -35.173 -6.217 -8.320 1.00 0.00 N ATOM 390 CA LEU A 27 -35.670 -7.074 -7.250 1.00 0.00 C ATOM 391 C LEU A 27 -36.698 -6.338 -6.396 1.00 0.00 C ATOM 392 O LEU A 27 -37.688 -6.924 -5.954 1.00 0.00 O ATOM 393 CB LEU A 27 -34.512 -7.553 -6.373 1.00 0.00 C ATOM 394 CG LEU A 27 -33.316 -8.155 -7.112 1.00 0.00 C ATOM 395 CD1 LEU A 27 -32.030 -7.902 -6.340 1.00 0.00 C ATOM 396 CD2 LEU A 27 -33.522 -9.646 -7.334 1.00 0.00 C ATOM 0 H LEU A 27 -34.176 -6.011 -8.266 1.00 0.00 H new ATOM 0 HA LEU A 27 -36.154 -7.938 -7.706 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -34.160 -6.710 -5.779 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -34.895 -8.297 -5.675 1.00 0.00 H new ATOM 0 HG LEU A 27 -33.233 -7.671 -8.085 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -31.190 -8.337 -6.881 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -31.875 -6.828 -6.232 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -32.102 -8.359 -5.353 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -32.661 -10.058 -7.861 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -33.631 -10.146 -6.371 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -34.422 -9.804 -7.929 1.00 0.00 H new ATOM 408 N LEU A 28 -36.459 -5.051 -6.170 1.00 0.00 N ATOM 409 CA LEU A 28 -37.365 -4.234 -5.371 1.00 0.00 C ATOM 410 C LEU A 28 -38.747 -4.166 -6.013 1.00 0.00 C ATOM 411 O LEU A 28 -39.766 -4.317 -5.337 1.00 0.00 O ATOM 412 CB LEU A 28 -36.798 -2.822 -5.205 1.00 0.00 C ATOM 413 CG LEU A 28 -35.879 -2.606 -4.002 1.00 0.00 C ATOM 414 CD1 LEU A 28 -34.962 -1.415 -4.239 1.00 0.00 C ATOM 415 CD2 LEU A 28 -36.697 -2.407 -2.735 1.00 0.00 C ATOM 0 H LEU A 28 -35.646 -4.551 -6.529 1.00 0.00 H new ATOM 0 HA LEU A 28 -37.463 -4.698 -4.390 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -36.246 -2.565 -6.109 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -37.632 -2.124 -5.130 1.00 0.00 H new ATOM 0 HG LEU A 28 -35.262 -3.495 -3.876 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -34.315 -1.276 -3.373 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -34.351 -1.597 -5.123 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -35.562 -0.518 -4.391 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -36.027 -2.255 -1.889 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -37.340 -1.534 -2.850 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -37.312 -3.289 -2.556 1.00 0.00 H new ATOM 427 N LEU A 29 -38.775 -3.941 -7.322 1.00 0.00 N ATOM 428 CA LEU A 29 -40.032 -3.857 -8.057 1.00 0.00 C ATOM 429 C LEU A 29 -40.712 -5.220 -8.133 1.00 0.00 C ATOM 430 O LEU A 29 -41.933 -5.324 -8.019 1.00 0.00 O ATOM 431 CB LEU A 29 -39.786 -3.318 -9.467 1.00 0.00 C ATOM 432 CG LEU A 29 -39.786 -1.796 -9.613 1.00 0.00 C ATOM 433 CD1 LEU A 29 -39.054 -1.381 -10.880 1.00 0.00 C ATOM 434 CD2 LEU A 29 -41.210 -1.260 -9.618 1.00 0.00 C ATOM 0 H LEU A 29 -37.942 -3.813 -7.896 1.00 0.00 H new ATOM 0 HA LEU A 29 -40.691 -3.173 -7.523 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -38.825 -3.697 -9.817 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -40.550 -3.726 -10.129 1.00 0.00 H new ATOM 0 HG LEU A 29 -39.262 -1.369 -8.758 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -39.064 -0.295 -10.967 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -38.023 -1.732 -10.836 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -39.549 -1.819 -11.746 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -41.190 -0.175 -9.723 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -41.760 -1.695 -10.453 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -41.702 -1.525 -8.682 1.00 0.00 H new ATOM 446 N VAL A 30 -39.912 -6.264 -8.323 1.00 0.00 N ATOM 447 CA VAL A 30 -40.435 -7.622 -8.410 1.00 0.00 C ATOM 448 C VAL A 30 -41.267 -7.971 -7.181 1.00 0.00 C ATOM 449 O VAL A 30 -42.375 -8.497 -7.296 1.00 0.00 O ATOM 450 CB VAL A 30 -39.300 -8.653 -8.557 1.00 0.00 C ATOM 451 CG1 VAL A 30 -39.778 -10.037 -8.145 1.00 0.00 C ATOM 452 CG2 VAL A 30 -38.773 -8.665 -9.985 1.00 0.00 C ATOM 0 H VAL A 30 -38.899 -6.195 -8.420 1.00 0.00 H new ATOM 0 HA VAL A 30 -41.068 -7.660 -9.297 1.00 0.00 H new ATOM 0 HB VAL A 30 -38.484 -8.365 -7.895 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -38.962 -10.752 -8.256 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -40.103 -10.015 -7.105 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -40.612 -10.338 -8.779 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -37.972 -9.399 -10.071 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -39.580 -8.927 -10.669 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -38.389 -7.677 -10.239 1.00 0.00 H new ATOM 462 N LEU A 31 -40.727 -7.674 -6.005 1.00 0.00 N ATOM 463 CA LEU A 31 -41.419 -7.955 -4.752 1.00 0.00 C ATOM 464 C LEU A 31 -42.646 -7.062 -4.596 1.00 0.00 C ATOM 465 O LEU A 31 -43.738 -7.539 -4.288 1.00 0.00 O ATOM 466 CB LEU A 31 -40.473 -7.754 -3.567 1.00 0.00 C ATOM 467 CG LEU A 31 -39.435 -8.853 -3.342 1.00 0.00 C ATOM 468 CD1 LEU A 31 -38.256 -8.319 -2.544 1.00 0.00 C ATOM 469 CD2 LEU A 31 -40.064 -10.045 -2.635 1.00 0.00 C ATOM 0 H LEU A 31 -39.812 -7.238 -5.892 1.00 0.00 H new ATOM 0 HA LEU A 31 -41.749 -8.994 -4.773 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -39.948 -6.809 -3.704 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -41.072 -7.658 -2.662 1.00 0.00 H new ATOM 0 HG LEU A 31 -39.069 -9.184 -4.314 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -37.528 -9.116 -2.394 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -37.789 -7.499 -3.089 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -38.605 -7.959 -1.576 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -39.310 -10.817 -2.483 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -40.459 -9.729 -1.669 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -40.874 -10.444 -3.245 1.00 0.00 H new ATOM 789 N VAL B 112 -13.886 -2.743 -2.567 1.00 0.00 N ATOM 790 CA VAL B 112 -14.972 -2.181 -3.361 1.00 0.00 C ATOM 791 C VAL B 112 -15.211 -3.002 -4.624 1.00 0.00 C ATOM 792 O VAL B 112 -16.332 -3.431 -4.895 1.00 0.00 O ATOM 793 CB VAL B 112 -14.681 -0.722 -3.758 1.00 0.00 C ATOM 794 CG1 VAL B 112 -15.817 -0.159 -4.598 1.00 0.00 C ATOM 795 CG2 VAL B 112 -14.450 0.131 -2.519 1.00 0.00 C ATOM 0 HA VAL B 112 -15.866 -2.208 -2.738 1.00 0.00 H new ATOM 0 HB VAL B 112 -13.773 -0.702 -4.360 1.00 0.00 H new ATOM 0 HG11 VAL B 112 -15.593 0.873 -4.869 1.00 0.00 H new ATOM 0 HG12 VAL B 112 -15.930 -0.755 -5.503 1.00 0.00 H new ATOM 0 HG13 VAL B 112 -16.744 -0.191 -4.025 1.00 0.00 H new ATOM 0 HG21 VAL B 112 -14.246 1.159 -2.818 1.00 0.00 H new ATOM 0 HG22 VAL B 112 -15.339 0.106 -1.889 1.00 0.00 H new ATOM 0 HG23 VAL B 112 -13.599 -0.260 -1.961 1.00 0.00 H new ATOM 805 N ALA B 113 -14.149 -3.216 -5.393 1.00 0.00 N ATOM 806 CA ALA B 113 -14.242 -3.987 -6.627 1.00 0.00 C ATOM 807 C ALA B 113 -14.764 -5.394 -6.356 1.00 0.00 C ATOM 808 O ALA B 113 -15.527 -5.947 -7.149 1.00 0.00 O ATOM 809 CB ALA B 113 -12.886 -4.048 -7.315 1.00 0.00 C ATOM 0 H ALA B 113 -13.214 -2.866 -5.184 1.00 0.00 H new ATOM 0 HA ALA B 113 -14.949 -3.486 -7.288 1.00 0.00 H new ATOM 0 HB1 ALA B 113 -12.970 -4.627 -8.235 1.00 0.00 H new ATOM 0 HB2 ALA B 113 -12.552 -3.038 -7.551 1.00 0.00 H new ATOM 0 HB3 ALA B 113 -12.163 -4.523 -6.652 1.00 0.00 H new ATOM 815 N VAL B 114 -14.348 -5.969 -5.232 1.00 0.00 N ATOM 816 CA VAL B 114 -14.774 -7.312 -4.857 1.00 0.00 C ATOM 817 C VAL B 114 -16.275 -7.359 -4.594 1.00 0.00 C ATOM 818 O VAL B 114 -16.999 -8.141 -5.208 1.00 0.00 O ATOM 819 CB VAL B 114 -14.028 -7.808 -3.603 1.00 0.00 C ATOM 820 CG1 VAL B 114 -14.520 -9.189 -3.201 1.00 0.00 C ATOM 821 CG2 VAL B 114 -12.527 -7.817 -3.846 1.00 0.00 C ATOM 0 H VAL B 114 -13.716 -5.526 -4.565 1.00 0.00 H new ATOM 0 HA VAL B 114 -14.534 -7.966 -5.696 1.00 0.00 H new ATOM 0 HB VAL B 114 -14.236 -7.122 -2.782 1.00 0.00 H new ATOM 0 HG11 VAL B 114 -13.982 -9.523 -2.314 1.00 0.00 H new ATOM 0 HG12 VAL B 114 -15.587 -9.146 -2.983 1.00 0.00 H new ATOM 0 HG13 VAL B 114 -14.344 -9.890 -4.017 1.00 0.00 H new ATOM 0 HG21 VAL B 114 -12.016 -8.170 -2.950 1.00 0.00 H new ATOM 0 HG22 VAL B 114 -12.297 -8.480 -4.680 1.00 0.00 H new ATOM 0 HG23 VAL B 114 -12.191 -6.807 -4.082 1.00 0.00 H new ATOM 831 N GLY B 115 -16.736 -6.515 -3.676 1.00 0.00 N ATOM 832 CA GLY B 115 -18.149 -6.476 -3.348 1.00 0.00 C ATOM 833 C GLY B 115 -19.012 -6.117 -4.542 1.00 0.00 C ATOM 834 O GLY B 115 -19.943 -6.847 -4.886 1.00 0.00 O ATOM 0 H GLY B 115 -16.156 -5.858 -3.154 1.00 0.00 H new ATOM 0 HA2 GLY B 115 -18.456 -7.448 -2.961 1.00 0.00 H new ATOM 0 HA3 GLY B 115 -18.314 -5.749 -2.553 1.00 0.00 H new ATOM 838 N LEU B 116 -18.705 -4.990 -5.174 1.00 0.00 N ATOM 839 CA LEU B 116 -19.460 -4.535 -6.336 1.00 0.00 C ATOM 840 C LEU B 116 -19.550 -5.633 -7.392 1.00 0.00 C ATOM 841 O LEU B 116 -20.636 -5.960 -7.870 1.00 0.00 O ATOM 842 CB LEU B 116 -18.809 -3.288 -6.936 1.00 0.00 C ATOM 843 CG LEU B 116 -19.307 -1.946 -6.399 1.00 0.00 C ATOM 844 CD1 LEU B 116 -18.347 -0.829 -6.776 1.00 0.00 C ATOM 845 CD2 LEU B 116 -20.705 -1.648 -6.921 1.00 0.00 C ATOM 0 H LEU B 116 -17.939 -4.374 -4.902 1.00 0.00 H new ATOM 0 HA LEU B 116 -20.470 -4.288 -6.008 1.00 0.00 H new ATOM 0 HB2 LEU B 116 -17.734 -3.347 -6.768 1.00 0.00 H new ATOM 0 HB3 LEU B 116 -18.964 -3.305 -8.015 1.00 0.00 H new ATOM 0 HG LEU B 116 -19.351 -2.007 -5.312 1.00 0.00 H new ATOM 0 HD11 LEU B 116 -18.719 0.118 -6.385 1.00 0.00 H new ATOM 0 HD12 LEU B 116 -17.364 -1.036 -6.353 1.00 0.00 H new ATOM 0 HD13 LEU B 116 -18.269 -0.767 -7.861 1.00 0.00 H new ATOM 0 HD21 LEU B 116 -21.043 -0.689 -6.528 1.00 0.00 H new ATOM 0 HD22 LEU B 116 -20.686 -1.608 -8.010 1.00 0.00 H new ATOM 0 HD23 LEU B 116 -21.389 -2.433 -6.599 1.00 0.00 H new ATOM 857 N ALA B 117 -18.402 -6.199 -7.748 1.00 0.00 N ATOM 858 CA ALA B 117 -18.352 -7.263 -8.744 1.00 0.00 C ATOM 859 C ALA B 117 -19.335 -8.379 -8.404 1.00 0.00 C ATOM 860 O ALA B 117 -20.158 -8.768 -9.232 1.00 0.00 O ATOM 861 CB ALA B 117 -16.939 -7.816 -8.854 1.00 0.00 C ATOM 0 H ALA B 117 -17.494 -5.939 -7.362 1.00 0.00 H new ATOM 0 HA ALA B 117 -18.641 -6.841 -9.707 1.00 0.00 H new ATOM 0 HB1 ALA B 117 -16.916 -8.610 -9.601 1.00 0.00 H new ATOM 0 HB2 ALA B 117 -16.258 -7.018 -9.151 1.00 0.00 H new ATOM 0 HB3 ALA B 117 -16.629 -8.217 -7.889 1.00 0.00 H new ATOM 867 N VAL B 118 -19.242 -8.891 -7.181 1.00 0.00 N ATOM 868 CA VAL B 118 -20.123 -9.962 -6.732 1.00 0.00 C ATOM 869 C VAL B 118 -21.585 -9.616 -6.990 1.00 0.00 C ATOM 870 O VAL B 118 -22.339 -10.423 -7.534 1.00 0.00 O ATOM 871 CB VAL B 118 -19.933 -10.253 -5.231 1.00 0.00 C ATOM 872 CG1 VAL B 118 -20.884 -11.349 -4.775 1.00 0.00 C ATOM 873 CG2 VAL B 118 -18.489 -10.634 -4.942 1.00 0.00 C ATOM 0 H VAL B 118 -18.565 -8.581 -6.484 1.00 0.00 H new ATOM 0 HA VAL B 118 -19.857 -10.851 -7.304 1.00 0.00 H new ATOM 0 HB VAL B 118 -20.165 -9.348 -4.670 1.00 0.00 H new ATOM 0 HG11 VAL B 118 -20.735 -11.541 -3.712 1.00 0.00 H new ATOM 0 HG12 VAL B 118 -21.913 -11.032 -4.946 1.00 0.00 H new ATOM 0 HG13 VAL B 118 -20.686 -12.260 -5.339 1.00 0.00 H new ATOM 0 HG21 VAL B 118 -18.372 -10.836 -3.877 1.00 0.00 H new ATOM 0 HG22 VAL B 118 -18.227 -11.526 -5.512 1.00 0.00 H new ATOM 0 HG23 VAL B 118 -17.832 -9.813 -5.230 1.00 0.00 H new ATOM 883 N PHE B 119 -21.980 -8.410 -6.596 1.00 0.00 N ATOM 884 CA PHE B 119 -23.353 -7.956 -6.784 1.00 0.00 C ATOM 885 C PHE B 119 -23.741 -7.993 -8.259 1.00 0.00 C ATOM 886 O PHE B 119 -24.752 -8.587 -8.631 1.00 0.00 O ATOM 887 CB PHE B 119 -23.524 -6.538 -6.236 1.00 0.00 C ATOM 888 CG PHE B 119 -24.872 -6.290 -5.621 1.00 0.00 C ATOM 889 CD1 PHE B 119 -25.166 -6.759 -4.351 1.00 0.00 C ATOM 890 CD2 PHE B 119 -25.845 -5.589 -6.315 1.00 0.00 C ATOM 891 CE1 PHE B 119 -26.405 -6.533 -3.783 1.00 0.00 C ATOM 892 CE2 PHE B 119 -27.086 -5.360 -5.751 1.00 0.00 C ATOM 893 CZ PHE B 119 -27.367 -5.833 -4.484 1.00 0.00 C ATOM 0 H PHE B 119 -21.369 -7.729 -6.145 1.00 0.00 H new ATOM 0 HA PHE B 119 -24.010 -8.631 -6.236 1.00 0.00 H new ATOM 0 HB2 PHE B 119 -22.753 -6.351 -5.489 1.00 0.00 H new ATOM 0 HB3 PHE B 119 -23.365 -5.824 -7.044 1.00 0.00 H new ATOM 0 HD1 PHE B 119 -24.418 -7.308 -3.798 1.00 0.00 H new ATOM 0 HD2 PHE B 119 -25.632 -5.218 -7.307 1.00 0.00 H new ATOM 0 HE1 PHE B 119 -26.621 -6.903 -2.792 1.00 0.00 H new ATOM 0 HE2 PHE B 119 -27.836 -4.811 -6.301 1.00 0.00 H new ATOM 0 HZ PHE B 119 -28.337 -5.656 -4.043 1.00 0.00 H new ATOM 903 N ALA B 120 -22.929 -7.353 -9.095 1.00 0.00 N ATOM 904 CA ALA B 120 -23.186 -7.313 -10.529 1.00 0.00 C ATOM 905 C ALA B 120 -23.222 -8.719 -11.119 1.00 0.00 C ATOM 906 O ALA B 120 -24.032 -9.012 -11.999 1.00 0.00 O ATOM 907 CB ALA B 120 -22.130 -6.472 -11.230 1.00 0.00 C ATOM 0 H ALA B 120 -22.088 -6.855 -8.803 1.00 0.00 H new ATOM 0 HA ALA B 120 -24.163 -6.856 -10.686 1.00 0.00 H new ATOM 0 HB1 ALA B 120 -22.334 -6.450 -12.301 1.00 0.00 H new ATOM 0 HB2 ALA B 120 -22.153 -5.456 -10.836 1.00 0.00 H new ATOM 0 HB3 ALA B 120 -21.145 -6.906 -11.057 1.00 0.00 H new ATOM 913 N CYS B 121 -22.341 -9.584 -10.630 1.00 0.00 N ATOM 914 CA CYS B 121 -22.271 -10.959 -11.110 1.00 0.00 C ATOM 915 C CYS B 121 -23.607 -11.671 -10.918 1.00 0.00 C ATOM 916 O CYS B 121 -24.076 -12.385 -11.805 1.00 0.00 O ATOM 917 CB CYS B 121 -21.164 -11.721 -10.381 1.00 0.00 C ATOM 918 SG CYS B 121 -19.492 -11.265 -10.895 1.00 0.00 S ATOM 0 H CYS B 121 -21.665 -9.357 -9.901 1.00 0.00 H new ATOM 0 HA CYS B 121 -22.043 -10.934 -12.176 1.00 0.00 H new ATOM 0 HB2 CYS B 121 -21.263 -11.547 -9.309 1.00 0.00 H new ATOM 0 HB3 CYS B 121 -21.304 -12.789 -10.545 1.00 0.00 H new ATOM 0 HG CYS B 121 -19.157 -10.141 -10.334 1.00 0.00 H new ATOM 924 N LEU B 122 -24.214 -11.472 -9.753 1.00 0.00 N ATOM 925 CA LEU B 122 -25.496 -12.095 -9.443 1.00 0.00 C ATOM 926 C LEU B 122 -26.598 -11.556 -10.349 1.00 0.00 C ATOM 927 O LEU B 122 -27.444 -12.309 -10.831 1.00 0.00 O ATOM 928 CB LEU B 122 -25.861 -11.854 -7.977 1.00 0.00 C ATOM 929 CG LEU B 122 -25.521 -12.985 -7.005 1.00 0.00 C ATOM 930 CD1 LEU B 122 -25.914 -12.605 -5.586 1.00 0.00 C ATOM 931 CD2 LEU B 122 -26.211 -14.274 -7.425 1.00 0.00 C ATOM 0 H LEU B 122 -23.839 -10.885 -9.008 1.00 0.00 H new ATOM 0 HA LEU B 122 -25.402 -13.167 -9.616 1.00 0.00 H new ATOM 0 HB2 LEU B 122 -25.354 -10.949 -7.641 1.00 0.00 H new ATOM 0 HB3 LEU B 122 -26.932 -11.660 -7.917 1.00 0.00 H new ATOM 0 HG LEU B 122 -24.444 -13.149 -7.030 1.00 0.00 H new ATOM 0 HD11 LEU B 122 -25.665 -13.422 -4.908 1.00 0.00 H new ATOM 0 HD12 LEU B 122 -25.373 -11.707 -5.287 1.00 0.00 H new ATOM 0 HD13 LEU B 122 -26.986 -12.414 -5.544 1.00 0.00 H new ATOM 0 HD21 LEU B 122 -25.958 -15.068 -6.722 1.00 0.00 H new ATOM 0 HD22 LEU B 122 -27.291 -14.124 -7.430 1.00 0.00 H new ATOM 0 HD23 LEU B 122 -25.880 -14.555 -8.425 1.00 0.00 H new ATOM 943 N PHE B 123 -26.581 -10.247 -10.577 1.00 0.00 N ATOM 944 CA PHE B 123 -27.578 -9.606 -11.427 1.00 0.00 C ATOM 945 C PHE B 123 -27.583 -10.225 -12.821 1.00 0.00 C ATOM 946 O PHE B 123 -28.642 -10.502 -13.386 1.00 0.00 O ATOM 947 CB PHE B 123 -27.306 -8.103 -11.524 1.00 0.00 C ATOM 948 CG PHE B 123 -28.337 -7.358 -12.322 1.00 0.00 C ATOM 949 CD1 PHE B 123 -29.654 -7.787 -12.350 1.00 0.00 C ATOM 950 CD2 PHE B 123 -27.989 -6.228 -13.045 1.00 0.00 C ATOM 951 CE1 PHE B 123 -30.606 -7.103 -13.083 1.00 0.00 C ATOM 952 CE2 PHE B 123 -28.936 -5.540 -13.780 1.00 0.00 C ATOM 953 CZ PHE B 123 -30.246 -5.979 -13.800 1.00 0.00 C ATOM 0 H PHE B 123 -25.888 -9.609 -10.185 1.00 0.00 H new ATOM 0 HA PHE B 123 -28.558 -9.762 -10.976 1.00 0.00 H new ATOM 0 HB2 PHE B 123 -27.264 -7.684 -10.519 1.00 0.00 H new ATOM 0 HB3 PHE B 123 -26.326 -7.948 -11.976 1.00 0.00 H new ATOM 0 HD1 PHE B 123 -29.941 -8.666 -11.792 1.00 0.00 H new ATOM 0 HD2 PHE B 123 -26.966 -5.881 -13.034 1.00 0.00 H new ATOM 0 HE1 PHE B 123 -31.630 -7.447 -13.095 1.00 0.00 H new ATOM 0 HE2 PHE B 123 -28.652 -4.660 -14.338 1.00 0.00 H new ATOM 0 HZ PHE B 123 -30.987 -5.444 -14.375 1.00 0.00 H new ATOM 963 N LEU B 124 -26.393 -10.439 -13.371 1.00 0.00 N ATOM 964 CA LEU B 124 -26.258 -11.025 -14.700 1.00 0.00 C ATOM 965 C LEU B 124 -26.683 -12.490 -14.695 1.00 0.00 C ATOM 966 O LEU B 124 -27.227 -12.992 -15.679 1.00 0.00 O ATOM 967 CB LEU B 124 -24.814 -10.902 -15.189 1.00 0.00 C ATOM 968 CG LEU B 124 -24.485 -9.652 -16.006 1.00 0.00 C ATOM 969 CD1 LEU B 124 -22.994 -9.578 -16.291 1.00 0.00 C ATOM 970 CD2 LEU B 124 -25.280 -9.639 -17.304 1.00 0.00 C ATOM 0 H LEU B 124 -25.507 -10.215 -12.917 1.00 0.00 H new ATOM 0 HA LEU B 124 -26.912 -10.479 -15.379 1.00 0.00 H new ATOM 0 HB2 LEU B 124 -24.155 -10.928 -14.322 1.00 0.00 H new ATOM 0 HB3 LEU B 124 -24.581 -11.778 -15.794 1.00 0.00 H new ATOM 0 HG LEU B 124 -24.766 -8.775 -15.422 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -22.779 -8.682 -16.873 1.00 0.00 H new ATOM 0 HD12 LEU B 124 -22.445 -9.540 -15.350 1.00 0.00 H new ATOM 0 HD13 LEU B 124 -22.687 -10.459 -16.854 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -25.033 -8.742 -17.873 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -25.031 -10.522 -17.892 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -26.346 -9.643 -17.078 1.00 0.00 H new ATOM 982 N SER B 125 -26.433 -13.169 -13.581 1.00 0.00 N ATOM 983 CA SER B 125 -26.788 -14.577 -13.448 1.00 0.00 C ATOM 984 C SER B 125 -28.303 -14.755 -13.419 1.00 0.00 C ATOM 985 O SER B 125 -28.837 -15.726 -13.956 1.00 0.00 O ATOM 986 CB SER B 125 -26.170 -15.163 -12.177 1.00 0.00 C ATOM 987 OG SER B 125 -24.755 -15.159 -12.249 1.00 0.00 O ATOM 0 H SER B 125 -25.986 -12.767 -12.757 1.00 0.00 H new ATOM 0 HA SER B 125 -26.394 -15.109 -14.314 1.00 0.00 H new ATOM 0 HB2 SER B 125 -26.495 -14.586 -11.311 1.00 0.00 H new ATOM 0 HB3 SER B 125 -26.527 -16.183 -12.032 1.00 0.00 H new ATOM 0 HG SER B 125 -24.423 -14.247 -12.110 1.00 0.00 H new ATOM 993 N THR B 126 -28.992 -13.809 -12.788 1.00 0.00 N ATOM 994 CA THR B 126 -30.445 -13.861 -12.687 1.00 0.00 C ATOM 995 C THR B 126 -31.099 -13.594 -14.038 1.00 0.00 C ATOM 996 O THR B 126 -31.977 -14.342 -14.472 1.00 0.00 O ATOM 997 CB THR B 126 -30.973 -12.838 -11.663 1.00 0.00 C ATOM 998 OG1 THR B 126 -30.282 -12.990 -10.418 1.00 0.00 O ATOM 999 CG2 THR B 126 -32.468 -13.015 -11.444 1.00 0.00 C ATOM 0 H THR B 126 -28.567 -12.998 -12.339 1.00 0.00 H new ATOM 0 HA THR B 126 -30.704 -14.866 -12.353 1.00 0.00 H new ATOM 0 HB THR B 126 -30.795 -11.837 -12.057 1.00 0.00 H new ATOM 0 HG1 THR B 126 -29.346 -12.723 -10.529 1.00 0.00 H new ATOM 0 HG21 THR B 126 -32.819 -12.282 -10.717 1.00 0.00 H new ATOM 0 HG22 THR B 126 -32.994 -12.870 -12.388 1.00 0.00 H new ATOM 0 HG23 THR B 126 -32.664 -14.020 -11.070 1.00 0.00 H new ATOM 1007 N LEU B 127 -30.667 -12.526 -14.699 1.00 0.00 N ATOM 1008 CA LEU B 127 -31.211 -12.162 -16.003 1.00 0.00 C ATOM 1009 C LEU B 127 -30.901 -13.235 -17.041 1.00 0.00 C ATOM 1010 O LEU B 127 -31.707 -13.500 -17.935 1.00 0.00 O ATOM 1011 CB LEU B 127 -30.642 -10.816 -16.457 1.00 0.00 C ATOM 1012 CG LEU B 127 -30.712 -9.679 -15.437 1.00 0.00 C ATOM 1013 CD1 LEU B 127 -29.551 -8.716 -15.631 1.00 0.00 C ATOM 1014 CD2 LEU B 127 -32.040 -8.946 -15.546 1.00 0.00 C ATOM 0 H LEU B 127 -29.942 -11.897 -14.354 1.00 0.00 H new ATOM 0 HA LEU B 127 -32.294 -12.078 -15.907 1.00 0.00 H new ATOM 0 HB2 LEU B 127 -29.599 -10.961 -16.738 1.00 0.00 H new ATOM 0 HB3 LEU B 127 -31.174 -10.504 -17.356 1.00 0.00 H new ATOM 0 HG LEU B 127 -30.638 -10.108 -14.438 1.00 0.00 H new ATOM 0 HD11 LEU B 127 -29.617 -7.913 -14.896 1.00 0.00 H new ATOM 0 HD12 LEU B 127 -28.610 -9.250 -15.501 1.00 0.00 H new ATOM 0 HD13 LEU B 127 -29.593 -8.293 -16.635 1.00 0.00 H new ATOM 0 HD21 LEU B 127 -32.072 -8.140 -14.813 1.00 0.00 H new ATOM 0 HD22 LEU B 127 -32.144 -8.529 -16.548 1.00 0.00 H new ATOM 0 HD23 LEU B 127 -32.857 -9.642 -15.356 1.00 0.00 H new ATOM 1026 N LEU B 128 -29.731 -13.850 -16.917 1.00 0.00 N ATOM 1027 CA LEU B 128 -29.315 -14.897 -17.844 1.00 0.00 C ATOM 1028 C LEU B 128 -30.167 -16.150 -17.669 1.00 0.00 C ATOM 1029 O LEU B 128 -30.521 -16.814 -18.644 1.00 0.00 O ATOM 1030 CB LEU B 128 -27.838 -15.237 -17.631 1.00 0.00 C ATOM 1031 CG LEU B 128 -26.835 -14.396 -18.422 1.00 0.00 C ATOM 1032 CD1 LEU B 128 -25.476 -14.407 -17.740 1.00 0.00 C ATOM 1033 CD2 LEU B 128 -26.721 -14.906 -19.851 1.00 0.00 C ATOM 0 H LEU B 128 -29.053 -13.642 -16.184 1.00 0.00 H new ATOM 0 HA LEU B 128 -29.453 -14.525 -18.859 1.00 0.00 H new ATOM 0 HB2 LEU B 128 -27.611 -15.134 -16.570 1.00 0.00 H new ATOM 0 HB3 LEU B 128 -27.686 -16.285 -17.889 1.00 0.00 H new ATOM 0 HG LEU B 128 -27.195 -13.368 -18.453 1.00 0.00 H new ATOM 0 HD11 LEU B 128 -24.775 -13.804 -18.316 1.00 0.00 H new ATOM 0 HD12 LEU B 128 -25.570 -13.994 -16.736 1.00 0.00 H new ATOM 0 HD13 LEU B 128 -25.108 -15.431 -17.678 1.00 0.00 H new ATOM 0 HD21 LEU B 128 -26.003 -14.296 -20.399 1.00 0.00 H new ATOM 0 HD22 LEU B 128 -26.384 -15.942 -19.842 1.00 0.00 H new ATOM 0 HD23 LEU B 128 -27.694 -14.846 -20.338 1.00 0.00 H new