USER MOD reduce.3.24.130724 H: found=0, std=0, add=598, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 598 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 : A1787 SER OG : rot 180:sc= 0.0666 USER MOD Single : A1793 MET CE :methyl 176:sc= 0 (180deg=-0.0179) USER MOD Single : A1795 TYR OH : rot 180:sc= 0 USER MOD Single : A1800 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1806 THR OG1 : rot -42:sc= 0.0969 USER MOD Single : A1807 GLN : amide:sc= 0.784 K(o=0.78,f=0) USER MOD Single : A1811 TYR OH : rot 30:sc= 0 USER MOD Single : A1812 SER OG : rot 180:sc= 0 USER MOD Single : A1815 SER OG : rot 180:sc= 0 USER MOD Single : A1822 SER OG : rot 180:sc= 0 USER MOD Single : A1829 LYS NZ :NH3+ -179:sc= 2.15 (180deg=2.09) USER MOD Single : A1831 ASN : amide:sc= 1.69 K(o=1.7,f=-3.7!) USER MOD Single : A1832 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1834 SER OG : rot 180:sc= 0 USER MOD Single : A1837 ASN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : A1838 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1842 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1844 SER OG : rot 180:sc= 0 USER MOD Single : A1849 HIS : no HE2:sc= 0.986 K(o=0.99,f=-3.2!) USER MOD Single : A1850 CYS SG : rot 91:sc= 0.555 USER MOD Single : A1851 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1858 THR OG1 : rot -67:sc= 0.0582 USER MOD Single : A1859 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00184) USER MOD ----------------------------------------------------------------- ATOM 226 N LEU A1786 9.702 15.034 -33.777 1.00 0.00 N ATOM 227 CA LEU A1786 9.553 13.591 -33.522 1.00 0.00 C ATOM 228 C LEU A1786 10.296 13.138 -32.250 1.00 0.00 C ATOM 229 O LEU A1786 11.308 13.727 -31.859 1.00 0.00 O ATOM 230 CB LEU A1786 10.078 12.828 -34.756 1.00 0.00 C ATOM 231 CG LEU A1786 9.217 12.977 -36.025 1.00 0.00 C ATOM 232 CD1 LEU A1786 10.037 12.527 -37.234 1.00 0.00 C ATOM 233 CD2 LEU A1786 7.953 12.114 -35.959 1.00 0.00 C ATOM 0 HA LEU A1786 8.498 13.373 -33.353 1.00 0.00 H new ATOM 0 HB2 LEU A1786 11.088 13.174 -34.977 1.00 0.00 H new ATOM 0 HB3 LEU A1786 10.151 11.769 -34.507 1.00 0.00 H new ATOM 0 HG LEU A1786 8.921 14.023 -36.108 1.00 0.00 H new ATOM 0 HD11 LEU A1786 9.437 12.628 -38.138 1.00 0.00 H new ATOM 0 HD12 LEU A1786 10.930 13.147 -37.319 1.00 0.00 H new ATOM 0 HD13 LEU A1786 10.330 11.485 -37.108 1.00 0.00 H new ATOM 0 HD21 LEU A1786 7.373 12.247 -36.872 1.00 0.00 H new ATOM 0 HD22 LEU A1786 8.233 11.066 -35.857 1.00 0.00 H new ATOM 0 HD23 LEU A1786 7.352 12.414 -35.101 1.00 0.00 H new ATOM 245 N SER A1787 9.812 12.051 -31.639 1.00 0.00 N ATOM 246 CA SER A1787 10.402 11.375 -30.472 1.00 0.00 C ATOM 247 C SER A1787 10.208 9.845 -30.551 1.00 0.00 C ATOM 248 O SER A1787 9.632 9.321 -31.506 1.00 0.00 O ATOM 249 CB SER A1787 9.792 11.962 -29.189 1.00 0.00 C ATOM 250 OG SER A1787 10.544 11.586 -28.047 1.00 0.00 O ATOM 0 H SER A1787 8.957 11.595 -31.958 1.00 0.00 H new ATOM 0 HA SER A1787 11.478 11.549 -30.461 1.00 0.00 H new ATOM 0 HB2 SER A1787 9.757 13.049 -29.264 1.00 0.00 H new ATOM 0 HB3 SER A1787 8.764 11.617 -29.081 1.00 0.00 H new ATOM 0 HG SER A1787 10.136 11.974 -27.245 1.00 0.00 H new ATOM 256 N GLU A1788 10.689 9.110 -29.545 1.00 0.00 N ATOM 257 CA GLU A1788 10.631 7.644 -29.438 1.00 0.00 C ATOM 258 C GLU A1788 9.195 7.091 -29.537 1.00 0.00 C ATOM 259 O GLU A1788 8.970 6.041 -30.142 1.00 0.00 O ATOM 260 CB GLU A1788 11.308 7.226 -28.119 1.00 0.00 C ATOM 261 CG GLU A1788 11.472 5.708 -27.976 1.00 0.00 C ATOM 262 CD GLU A1788 12.237 5.359 -26.682 1.00 0.00 C ATOM 263 OE1 GLU A1788 11.591 5.177 -25.621 1.00 0.00 O ATOM 264 OE2 GLU A1788 13.491 5.259 -26.714 1.00 0.00 O ATOM 0 H GLU A1788 11.152 9.538 -28.743 1.00 0.00 H new ATOM 0 HA GLU A1788 11.164 7.212 -30.285 1.00 0.00 H new ATOM 0 HB2 GLU A1788 12.289 7.698 -28.056 1.00 0.00 H new ATOM 0 HB3 GLU A1788 10.720 7.601 -27.282 1.00 0.00 H new ATOM 0 HG2 GLU A1788 10.492 5.231 -27.964 1.00 0.00 H new ATOM 0 HG3 GLU A1788 12.008 5.313 -28.839 1.00 0.00 H new ATOM 271 N ASP A1789 8.207 7.810 -28.997 1.00 0.00 N ATOM 272 CA ASP A1789 6.784 7.449 -29.062 1.00 0.00 C ATOM 273 C ASP A1789 6.224 7.422 -30.497 1.00 0.00 C ATOM 274 O ASP A1789 5.334 6.625 -30.798 1.00 0.00 O ATOM 275 CB ASP A1789 5.966 8.428 -28.205 1.00 0.00 C ATOM 276 CG ASP A1789 6.268 8.280 -26.704 1.00 0.00 C ATOM 277 OD1 ASP A1789 5.731 7.339 -26.064 1.00 0.00 O ATOM 278 OD2 ASP A1789 7.041 9.101 -26.150 1.00 0.00 O ATOM 0 H ASP A1789 8.376 8.679 -28.491 1.00 0.00 H new ATOM 0 HA ASP A1789 6.699 6.434 -28.675 1.00 0.00 H new ATOM 0 HB2 ASP A1789 6.182 9.450 -28.518 1.00 0.00 H new ATOM 0 HB3 ASP A1789 4.903 8.259 -28.378 1.00 0.00 H new ATOM 283 N ASP A1790 6.747 8.250 -31.410 1.00 0.00 N ATOM 284 CA ASP A1790 6.358 8.249 -32.831 1.00 0.00 C ATOM 285 C ASP A1790 6.907 7.017 -33.568 1.00 0.00 C ATOM 286 O ASP A1790 6.210 6.423 -34.395 1.00 0.00 O ATOM 287 CB ASP A1790 6.843 9.530 -33.519 1.00 0.00 C ATOM 288 CG ASP A1790 6.276 10.794 -32.851 1.00 0.00 C ATOM 289 OD1 ASP A1790 5.072 11.092 -33.041 1.00 0.00 O ATOM 290 OD2 ASP A1790 7.039 11.489 -32.141 1.00 0.00 O ATOM 0 H ASP A1790 7.458 8.946 -31.184 1.00 0.00 H new ATOM 0 HA ASP A1790 5.270 8.209 -32.873 1.00 0.00 H new ATOM 0 HB2 ASP A1790 7.932 9.565 -33.494 1.00 0.00 H new ATOM 0 HB3 ASP A1790 6.549 9.512 -34.568 1.00 0.00 H new ATOM 295 N PHE A1791 8.133 6.591 -33.239 1.00 0.00 N ATOM 296 CA PHE A1791 8.721 5.351 -33.757 1.00 0.00 C ATOM 297 C PHE A1791 7.975 4.115 -33.216 1.00 0.00 C ATOM 298 O PHE A1791 7.653 3.204 -33.976 1.00 0.00 O ATOM 299 CB PHE A1791 10.228 5.293 -33.434 1.00 0.00 C ATOM 300 CG PHE A1791 11.041 6.552 -33.740 1.00 0.00 C ATOM 301 CD1 PHE A1791 10.737 7.381 -34.840 1.00 0.00 C ATOM 302 CD2 PHE A1791 12.122 6.890 -32.902 1.00 0.00 C ATOM 303 CE1 PHE A1791 11.481 8.555 -35.065 1.00 0.00 C ATOM 304 CE2 PHE A1791 12.874 8.057 -33.136 1.00 0.00 C ATOM 305 CZ PHE A1791 12.544 8.897 -34.215 1.00 0.00 C ATOM 0 H PHE A1791 8.747 7.100 -32.603 1.00 0.00 H new ATOM 0 HA PHE A1791 8.611 5.344 -34.841 1.00 0.00 H new ATOM 0 HB2 PHE A1791 10.341 5.063 -32.375 1.00 0.00 H new ATOM 0 HB3 PHE A1791 10.664 4.462 -33.989 1.00 0.00 H new ATOM 0 HD1 PHE A1791 9.933 7.115 -35.510 1.00 0.00 H new ATOM 0 HD2 PHE A1791 12.376 6.248 -32.072 1.00 0.00 H new ATOM 0 HE1 PHE A1791 11.232 9.197 -35.897 1.00 0.00 H new ATOM 0 HE2 PHE A1791 13.702 8.307 -32.489 1.00 0.00 H new ATOM 0 HZ PHE A1791 13.107 9.802 -34.389 1.00 0.00 H new ATOM 315 N ASP A1792 7.622 4.101 -31.923 1.00 0.00 N ATOM 316 CA ASP A1792 6.776 3.069 -31.313 1.00 0.00 C ATOM 317 C ASP A1792 5.393 2.979 -31.983 1.00 0.00 C ATOM 318 O ASP A1792 4.928 1.883 -32.302 1.00 0.00 O ATOM 319 CB ASP A1792 6.649 3.331 -29.806 1.00 0.00 C ATOM 320 CG ASP A1792 5.854 2.217 -29.099 1.00 0.00 C ATOM 321 OD1 ASP A1792 6.415 1.110 -28.912 1.00 0.00 O ATOM 322 OD2 ASP A1792 4.679 2.449 -28.724 1.00 0.00 O ATOM 0 H ASP A1792 7.922 4.818 -31.262 1.00 0.00 H new ATOM 0 HA ASP A1792 7.255 2.102 -31.468 1.00 0.00 H new ATOM 0 HB2 ASP A1792 7.643 3.405 -29.365 1.00 0.00 H new ATOM 0 HB3 ASP A1792 6.156 4.289 -29.644 1.00 0.00 H new ATOM 327 N MET A1793 4.754 4.121 -32.268 1.00 0.00 N ATOM 328 CA MET A1793 3.509 4.215 -33.050 1.00 0.00 C ATOM 329 C MET A1793 3.663 3.619 -34.457 1.00 0.00 C ATOM 330 O MET A1793 2.831 2.812 -34.874 1.00 0.00 O ATOM 331 CB MET A1793 3.040 5.679 -33.103 1.00 0.00 C ATOM 332 CG MET A1793 1.688 5.825 -33.811 1.00 0.00 C ATOM 333 SD MET A1793 1.057 7.524 -33.870 1.00 0.00 S ATOM 334 CE MET A1793 2.173 8.264 -35.098 1.00 0.00 C ATOM 0 H MET A1793 5.095 5.030 -31.954 1.00 0.00 H new ATOM 0 HA MET A1793 2.746 3.619 -32.550 1.00 0.00 H new ATOM 0 HB2 MET A1793 2.962 6.071 -32.089 1.00 0.00 H new ATOM 0 HB3 MET A1793 3.787 6.280 -33.621 1.00 0.00 H new ATOM 0 HG2 MET A1793 1.782 5.449 -34.830 1.00 0.00 H new ATOM 0 HG3 MET A1793 0.956 5.195 -33.305 1.00 0.00 H new ATOM 0 HE1 MET A1793 1.866 9.291 -35.296 1.00 0.00 H new ATOM 0 HE2 MET A1793 3.193 8.258 -34.713 1.00 0.00 H new ATOM 0 HE3 MET A1793 2.130 7.688 -36.022 1.00 0.00 H new ATOM 344 N PHE A1794 4.730 3.975 -35.186 1.00 0.00 N ATOM 345 CA PHE A1794 5.043 3.388 -36.497 1.00 0.00 C ATOM 346 C PHE A1794 5.122 1.854 -36.428 1.00 0.00 C ATOM 347 O PHE A1794 4.436 1.172 -37.189 1.00 0.00 O ATOM 348 CB PHE A1794 6.327 4.018 -37.060 1.00 0.00 C ATOM 349 CG PHE A1794 6.723 3.539 -38.448 1.00 0.00 C ATOM 350 CD1 PHE A1794 7.434 2.334 -38.604 1.00 0.00 C ATOM 351 CD2 PHE A1794 6.427 4.317 -39.584 1.00 0.00 C ATOM 352 CE1 PHE A1794 7.834 1.905 -39.884 1.00 0.00 C ATOM 353 CE2 PHE A1794 6.857 3.903 -40.857 1.00 0.00 C ATOM 354 CZ PHE A1794 7.552 2.690 -41.009 1.00 0.00 C ATOM 0 H PHE A1794 5.402 4.680 -34.883 1.00 0.00 H new ATOM 0 HA PHE A1794 4.229 3.616 -37.186 1.00 0.00 H new ATOM 0 HB2 PHE A1794 6.201 5.100 -37.088 1.00 0.00 H new ATOM 0 HB3 PHE A1794 7.147 3.810 -36.373 1.00 0.00 H new ATOM 0 HD1 PHE A1794 7.674 1.736 -37.737 1.00 0.00 H new ATOM 0 HD2 PHE A1794 5.868 5.235 -39.477 1.00 0.00 H new ATOM 0 HE1 PHE A1794 8.359 0.968 -39.999 1.00 0.00 H new ATOM 0 HE2 PHE A1794 6.653 4.518 -41.721 1.00 0.00 H new ATOM 0 HZ PHE A1794 7.867 2.365 -41.990 1.00 0.00 H new ATOM 364 N TYR A1795 5.907 1.297 -35.498 1.00 0.00 N ATOM 365 CA TYR A1795 6.051 -0.154 -35.329 1.00 0.00 C ATOM 366 C TYR A1795 4.749 -0.860 -34.906 1.00 0.00 C ATOM 367 O TYR A1795 4.481 -1.973 -35.363 1.00 0.00 O ATOM 368 CB TYR A1795 7.187 -0.468 -34.342 1.00 0.00 C ATOM 369 CG TYR A1795 8.577 -0.016 -34.782 1.00 0.00 C ATOM 370 CD1 TYR A1795 9.066 -0.330 -36.069 1.00 0.00 C ATOM 371 CD2 TYR A1795 9.397 0.701 -33.888 1.00 0.00 C ATOM 372 CE1 TYR A1795 10.341 0.117 -36.476 1.00 0.00 C ATOM 373 CE2 TYR A1795 10.673 1.141 -34.284 1.00 0.00 C ATOM 374 CZ TYR A1795 11.152 0.854 -35.582 1.00 0.00 C ATOM 375 OH TYR A1795 12.388 1.271 -35.961 1.00 0.00 O ATOM 0 H TYR A1795 6.462 1.842 -34.839 1.00 0.00 H new ATOM 0 HA TYR A1795 6.302 -0.554 -36.312 1.00 0.00 H new ATOM 0 HB2 TYR A1795 6.956 0.002 -33.386 1.00 0.00 H new ATOM 0 HB3 TYR A1795 7.210 -1.544 -34.171 1.00 0.00 H new ATOM 0 HD1 TYR A1795 8.461 -0.915 -36.745 1.00 0.00 H new ATOM 0 HD2 TYR A1795 9.043 0.914 -32.890 1.00 0.00 H new ATOM 0 HE1 TYR A1795 10.698 -0.104 -37.471 1.00 0.00 H new ATOM 0 HE2 TYR A1795 11.288 1.700 -33.594 1.00 0.00 H new ATOM 0 HH TYR A1795 12.807 1.764 -35.225 1.00 0.00 H new ATOM 385 N GLU A1796 3.910 -0.230 -34.074 1.00 0.00 N ATOM 386 CA GLU A1796 2.592 -0.759 -33.689 1.00 0.00 C ATOM 387 C GLU A1796 1.662 -0.954 -34.903 1.00 0.00 C ATOM 388 O GLU A1796 1.017 -1.998 -35.035 1.00 0.00 O ATOM 389 CB GLU A1796 1.957 0.161 -32.629 1.00 0.00 C ATOM 390 CG GLU A1796 0.614 -0.367 -32.111 1.00 0.00 C ATOM 391 CD GLU A1796 0.093 0.492 -30.942 1.00 0.00 C ATOM 392 OE1 GLU A1796 -0.536 1.551 -31.197 1.00 0.00 O ATOM 393 OE2 GLU A1796 0.298 0.108 -29.763 1.00 0.00 O ATOM 0 H GLU A1796 4.127 0.669 -33.644 1.00 0.00 H new ATOM 0 HA GLU A1796 2.735 -1.750 -33.258 1.00 0.00 H new ATOM 0 HB2 GLU A1796 2.646 0.272 -31.792 1.00 0.00 H new ATOM 0 HB3 GLU A1796 1.812 1.153 -33.056 1.00 0.00 H new ATOM 0 HG2 GLU A1796 -0.117 -0.367 -32.920 1.00 0.00 H new ATOM 0 HG3 GLU A1796 0.728 -1.401 -31.784 1.00 0.00 H new ATOM 400 N ILE A1797 1.605 0.028 -35.811 1.00 0.00 N ATOM 401 CA ILE A1797 0.842 -0.069 -37.070 1.00 0.00 C ATOM 402 C ILE A1797 1.525 -1.002 -38.087 1.00 0.00 C ATOM 403 O ILE A1797 0.840 -1.744 -38.789 1.00 0.00 O ATOM 404 CB ILE A1797 0.590 1.350 -37.647 1.00 0.00 C ATOM 405 CG1 ILE A1797 -0.132 2.291 -36.653 1.00 0.00 C ATOM 406 CG2 ILE A1797 -0.213 1.293 -38.957 1.00 0.00 C ATOM 407 CD1 ILE A1797 -1.509 1.826 -36.160 1.00 0.00 C ATOM 0 H ILE A1797 2.088 0.919 -35.696 1.00 0.00 H new ATOM 0 HA ILE A1797 -0.125 -0.522 -36.853 1.00 0.00 H new ATOM 0 HB ILE A1797 1.581 1.761 -37.841 1.00 0.00 H new ATOM 0 HG12 ILE A1797 0.513 2.433 -35.786 1.00 0.00 H new ATOM 0 HG13 ILE A1797 -0.249 3.266 -37.127 1.00 0.00 H new ATOM 0 HG21 ILE A1797 -0.370 2.304 -39.332 1.00 0.00 H new ATOM 0 HG22 ILE A1797 0.339 0.714 -39.697 1.00 0.00 H new ATOM 0 HG23 ILE A1797 -1.178 0.820 -38.772 1.00 0.00 H new ATOM 0 HD11 ILE A1797 -1.917 2.565 -35.470 1.00 0.00 H new ATOM 0 HD12 ILE A1797 -2.181 1.714 -37.011 1.00 0.00 H new ATOM 0 HD13 ILE A1797 -1.408 0.869 -35.649 1.00 0.00 H new ATOM 419 N TRP A1798 2.860 -1.026 -38.147 1.00 0.00 N ATOM 420 CA TRP A1798 3.653 -1.856 -39.066 1.00 0.00 C ATOM 421 C TRP A1798 3.295 -3.351 -39.001 1.00 0.00 C ATOM 422 O TRP A1798 3.044 -3.983 -40.026 1.00 0.00 O ATOM 423 CB TRP A1798 5.150 -1.648 -38.794 1.00 0.00 C ATOM 424 CG TRP A1798 6.065 -2.495 -39.627 1.00 0.00 C ATOM 425 CD1 TRP A1798 6.568 -3.699 -39.275 1.00 0.00 C ATOM 426 CD2 TRP A1798 6.526 -2.243 -40.985 1.00 0.00 C ATOM 427 NE1 TRP A1798 7.279 -4.224 -40.336 1.00 0.00 N ATOM 428 CE2 TRP A1798 7.251 -3.387 -41.429 1.00 0.00 C ATOM 429 CE3 TRP A1798 6.361 -1.189 -41.907 1.00 0.00 C ATOM 430 CZ2 TRP A1798 7.760 -3.495 -42.732 1.00 0.00 C ATOM 431 CZ3 TRP A1798 6.901 -1.270 -43.204 1.00 0.00 C ATOM 432 CH2 TRP A1798 7.598 -2.421 -43.618 1.00 0.00 C ATOM 0 H TRP A1798 3.440 -0.450 -37.538 1.00 0.00 H new ATOM 0 HA TRP A1798 3.410 -1.530 -40.077 1.00 0.00 H new ATOM 0 HB2 TRP A1798 5.393 -0.599 -38.964 1.00 0.00 H new ATOM 0 HB3 TRP A1798 5.346 -1.854 -37.742 1.00 0.00 H new ATOM 0 HD1 TRP A1798 6.435 -4.176 -38.315 1.00 0.00 H new ATOM 0 HE1 TRP A1798 7.765 -5.121 -40.313 1.00 0.00 H new ATOM 0 HE3 TRP A1798 5.812 -0.306 -41.613 1.00 0.00 H new ATOM 0 HZ2 TRP A1798 8.270 -4.393 -43.048 1.00 0.00 H new ATOM 0 HZ3 TRP A1798 6.780 -0.442 -43.887 1.00 0.00 H new ATOM 0 HH2 TRP A1798 8.007 -2.476 -44.616 1.00 0.00 H new ATOM 443 N GLU A1799 3.217 -3.919 -37.793 1.00 0.00 N ATOM 444 CA GLU A1799 2.945 -5.351 -37.579 1.00 0.00 C ATOM 445 C GLU A1799 1.556 -5.817 -38.067 1.00 0.00 C ATOM 446 O GLU A1799 1.344 -7.018 -38.254 1.00 0.00 O ATOM 447 CB GLU A1799 3.131 -5.721 -36.095 1.00 0.00 C ATOM 448 CG GLU A1799 4.601 -5.637 -35.657 1.00 0.00 C ATOM 449 CD GLU A1799 4.777 -6.140 -34.212 1.00 0.00 C ATOM 450 OE1 GLU A1799 4.460 -5.389 -33.255 1.00 0.00 O ATOM 451 OE2 GLU A1799 5.238 -7.292 -34.017 1.00 0.00 O ATOM 0 H GLU A1799 3.341 -3.396 -36.926 1.00 0.00 H new ATOM 0 HA GLU A1799 3.674 -5.878 -38.195 1.00 0.00 H new ATOM 0 HB2 GLU A1799 2.531 -5.053 -35.478 1.00 0.00 H new ATOM 0 HB3 GLU A1799 2.760 -6.732 -35.925 1.00 0.00 H new ATOM 0 HG2 GLU A1799 5.219 -6.231 -36.330 1.00 0.00 H new ATOM 0 HG3 GLU A1799 4.948 -4.606 -35.732 1.00 0.00 H new ATOM 458 N LYS A1800 0.624 -4.895 -38.342 1.00 0.00 N ATOM 459 CA LYS A1800 -0.678 -5.192 -38.975 1.00 0.00 C ATOM 460 C LYS A1800 -0.530 -5.598 -40.449 1.00 0.00 C ATOM 461 O LYS A1800 -1.340 -6.377 -40.959 1.00 0.00 O ATOM 462 CB LYS A1800 -1.614 -3.973 -38.850 1.00 0.00 C ATOM 463 CG LYS A1800 -1.784 -3.492 -37.396 1.00 0.00 C ATOM 464 CD LYS A1800 -2.829 -2.374 -37.285 1.00 0.00 C ATOM 465 CE LYS A1800 -2.975 -1.948 -35.820 1.00 0.00 C ATOM 466 NZ LYS A1800 -4.077 -0.958 -35.643 1.00 0.00 N ATOM 0 H LYS A1800 0.750 -3.905 -38.130 1.00 0.00 H new ATOM 0 HA LYS A1800 -1.111 -6.042 -38.448 1.00 0.00 H new ATOM 0 HB2 LYS A1800 -1.220 -3.156 -39.454 1.00 0.00 H new ATOM 0 HB3 LYS A1800 -2.591 -4.229 -39.259 1.00 0.00 H new ATOM 0 HG2 LYS A1800 -2.082 -4.332 -36.768 1.00 0.00 H new ATOM 0 HG3 LYS A1800 -0.827 -3.134 -37.017 1.00 0.00 H new ATOM 0 HD2 LYS A1800 -2.529 -1.521 -37.894 1.00 0.00 H new ATOM 0 HD3 LYS A1800 -3.788 -2.720 -37.671 1.00 0.00 H new ATOM 0 HE2 LYS A1800 -3.171 -2.825 -35.203 1.00 0.00 H new ATOM 0 HE3 LYS A1800 -2.037 -1.516 -35.471 1.00 0.00 H new ATOM 0 HZ1 LYS A1800 -4.147 -0.692 -34.640 1.00 0.00 H new ATOM 0 HZ2 LYS A1800 -3.878 -0.111 -36.213 1.00 0.00 H new ATOM 0 HZ3 LYS A1800 -4.976 -1.380 -35.953 1.00 0.00 H new ATOM 480 N PHE A1801 0.523 -5.109 -41.114 1.00 0.00 N ATOM 481 CA PHE A1801 0.893 -5.405 -42.506 1.00 0.00 C ATOM 482 C PHE A1801 2.076 -6.381 -42.620 1.00 0.00 C ATOM 483 O PHE A1801 2.223 -7.061 -43.635 1.00 0.00 O ATOM 484 CB PHE A1801 1.203 -4.089 -43.235 1.00 0.00 C ATOM 485 CG PHE A1801 0.029 -3.128 -43.234 1.00 0.00 C ATOM 486 CD1 PHE A1801 -0.156 -2.240 -42.155 1.00 0.00 C ATOM 487 CD2 PHE A1801 -0.924 -3.178 -44.268 1.00 0.00 C ATOM 488 CE1 PHE A1801 -1.292 -1.411 -42.109 1.00 0.00 C ATOM 489 CE2 PHE A1801 -2.050 -2.342 -44.232 1.00 0.00 C ATOM 490 CZ PHE A1801 -2.237 -1.461 -43.152 1.00 0.00 C ATOM 0 H PHE A1801 1.176 -4.461 -40.673 1.00 0.00 H new ATOM 0 HA PHE A1801 0.045 -5.904 -42.975 1.00 0.00 H new ATOM 0 HB2 PHE A1801 2.060 -3.610 -42.762 1.00 0.00 H new ATOM 0 HB3 PHE A1801 1.488 -4.307 -44.264 1.00 0.00 H new ATOM 0 HD1 PHE A1801 0.576 -2.196 -41.362 1.00 0.00 H new ATOM 0 HD2 PHE A1801 -0.788 -3.862 -45.092 1.00 0.00 H new ATOM 0 HE1 PHE A1801 -1.439 -0.739 -41.277 1.00 0.00 H new ATOM 0 HE2 PHE A1801 -2.773 -2.375 -45.034 1.00 0.00 H new ATOM 0 HZ PHE A1801 -3.107 -0.822 -43.122 1.00 0.00 H new ATOM 500 N ASP A1802 2.886 -6.502 -41.564 1.00 0.00 N ATOM 501 CA ASP A1802 3.999 -7.445 -41.420 1.00 0.00 C ATOM 502 C ASP A1802 3.823 -8.342 -40.168 1.00 0.00 C ATOM 503 O ASP A1802 4.508 -8.144 -39.156 1.00 0.00 O ATOM 504 CB ASP A1802 5.316 -6.656 -41.410 1.00 0.00 C ATOM 505 CG ASP A1802 6.568 -7.534 -41.241 1.00 0.00 C ATOM 506 OD1 ASP A1802 6.509 -8.758 -41.510 1.00 0.00 O ATOM 507 OD2 ASP A1802 7.622 -6.990 -40.831 1.00 0.00 O ATOM 0 H ASP A1802 2.776 -5.911 -40.740 1.00 0.00 H new ATOM 0 HA ASP A1802 4.017 -8.130 -42.268 1.00 0.00 H new ATOM 0 HB2 ASP A1802 5.400 -6.096 -42.342 1.00 0.00 H new ATOM 0 HB3 ASP A1802 5.285 -5.926 -40.601 1.00 0.00 H new ATOM 512 N PRO A1803 2.917 -9.342 -40.206 1.00 0.00 N ATOM 513 CA PRO A1803 2.709 -10.277 -39.098 1.00 0.00 C ATOM 514 C PRO A1803 3.878 -11.268 -38.917 1.00 0.00 C ATOM 515 O PRO A1803 4.035 -11.862 -37.845 1.00 0.00 O ATOM 516 CB PRO A1803 1.396 -10.995 -39.425 1.00 0.00 C ATOM 517 CG PRO A1803 1.367 -10.981 -40.955 1.00 0.00 C ATOM 518 CD PRO A1803 1.995 -9.635 -41.296 1.00 0.00 C ATOM 0 HA PRO A1803 2.662 -9.749 -38.146 1.00 0.00 H new ATOM 0 HB2 PRO A1803 1.383 -12.011 -39.030 1.00 0.00 H new ATOM 0 HB3 PRO A1803 0.536 -10.477 -39.000 1.00 0.00 H new ATOM 0 HG2 PRO A1803 1.935 -11.810 -41.377 1.00 0.00 H new ATOM 0 HG3 PRO A1803 0.351 -11.062 -41.340 1.00 0.00 H new ATOM 0 HD2 PRO A1803 2.519 -9.678 -42.251 1.00 0.00 H new ATOM 0 HD3 PRO A1803 1.234 -8.859 -41.384 1.00 0.00 H new ATOM 526 N GLU A1804 4.739 -11.413 -39.930 1.00 0.00 N ATOM 527 CA GLU A1804 5.971 -12.208 -39.895 1.00 0.00 C ATOM 528 C GLU A1804 7.137 -11.502 -39.169 1.00 0.00 C ATOM 529 O GLU A1804 8.150 -12.143 -38.866 1.00 0.00 O ATOM 530 CB GLU A1804 6.412 -12.525 -41.340 1.00 0.00 C ATOM 531 CG GLU A1804 5.432 -13.426 -42.107 1.00 0.00 C ATOM 532 CD GLU A1804 5.347 -14.834 -41.490 1.00 0.00 C ATOM 533 OE1 GLU A1804 6.257 -15.667 -41.729 1.00 0.00 O ATOM 534 OE2 GLU A1804 4.362 -15.127 -40.772 1.00 0.00 O ATOM 0 H GLU A1804 4.591 -10.962 -40.833 1.00 0.00 H new ATOM 0 HA GLU A1804 5.742 -13.115 -39.335 1.00 0.00 H new ATOM 0 HB2 GLU A1804 6.533 -11.589 -41.886 1.00 0.00 H new ATOM 0 HB3 GLU A1804 7.389 -13.007 -41.314 1.00 0.00 H new ATOM 0 HG2 GLU A1804 4.442 -12.969 -42.107 1.00 0.00 H new ATOM 0 HG3 GLU A1804 5.748 -13.504 -43.147 1.00 0.00 H new ATOM 541 N ALA A1805 7.021 -10.196 -38.898 1.00 0.00 N ATOM 542 CA ALA A1805 8.092 -9.296 -38.452 1.00 0.00 C ATOM 543 C ALA A1805 9.351 -9.333 -39.358 1.00 0.00 C ATOM 544 O ALA A1805 10.465 -9.032 -38.912 1.00 0.00 O ATOM 545 CB ALA A1805 8.375 -9.541 -36.957 1.00 0.00 C ATOM 0 H ALA A1805 6.128 -9.712 -38.989 1.00 0.00 H new ATOM 0 HA ALA A1805 7.748 -8.267 -38.559 1.00 0.00 H new ATOM 0 HB1 ALA A1805 9.170 -8.874 -36.623 1.00 0.00 H new ATOM 0 HB2 ALA A1805 7.472 -9.347 -36.379 1.00 0.00 H new ATOM 0 HB3 ALA A1805 8.684 -10.576 -36.810 1.00 0.00 H new ATOM 551 N THR A1806 9.191 -9.712 -40.632 1.00 0.00 N ATOM 552 CA THR A1806 10.280 -9.842 -41.616 1.00 0.00 C ATOM 553 C THR A1806 10.901 -8.503 -42.043 1.00 0.00 C ATOM 554 O THR A1806 11.938 -8.499 -42.703 1.00 0.00 O ATOM 555 CB THR A1806 9.811 -10.653 -42.844 1.00 0.00 C ATOM 556 OG1 THR A1806 10.922 -11.199 -43.526 1.00 0.00 O ATOM 557 CG2 THR A1806 8.958 -9.878 -43.854 1.00 0.00 C ATOM 0 H THR A1806 8.277 -9.944 -41.020 1.00 0.00 H new ATOM 0 HA THR A1806 11.078 -10.385 -41.110 1.00 0.00 H new ATOM 0 HB THR A1806 9.169 -11.429 -42.427 1.00 0.00 H new ATOM 0 HG1 THR A1806 11.635 -10.529 -43.579 1.00 0.00 H new ATOM 0 HG21 THR A1806 8.681 -10.536 -44.677 1.00 0.00 H new ATOM 0 HG22 THR A1806 8.056 -9.511 -43.363 1.00 0.00 H new ATOM 0 HG23 THR A1806 9.529 -9.034 -44.241 1.00 0.00 H new ATOM 565 N GLN A1807 10.297 -7.373 -41.654 1.00 0.00 N ATOM 566 CA GLN A1807 10.711 -5.993 -41.949 1.00 0.00 C ATOM 567 C GLN A1807 10.650 -5.648 -43.450 1.00 0.00 C ATOM 568 O GLN A1807 11.349 -4.745 -43.914 1.00 0.00 O ATOM 569 CB GLN A1807 12.043 -5.660 -41.243 1.00 0.00 C ATOM 570 CG GLN A1807 11.891 -5.661 -39.709 1.00 0.00 C ATOM 571 CD GLN A1807 13.086 -6.306 -39.011 1.00 0.00 C ATOM 572 OE1 GLN A1807 14.155 -5.723 -38.870 1.00 0.00 O ATOM 573 NE2 GLN A1807 12.958 -7.531 -38.539 1.00 0.00 N ATOM 0 H GLN A1807 9.450 -7.399 -41.087 1.00 0.00 H new ATOM 0 HA GLN A1807 9.974 -5.314 -41.519 1.00 0.00 H new ATOM 0 HB2 GLN A1807 12.801 -6.387 -41.534 1.00 0.00 H new ATOM 0 HB3 GLN A1807 12.396 -4.683 -41.573 1.00 0.00 H new ATOM 0 HG2 GLN A1807 11.776 -4.636 -39.356 1.00 0.00 H new ATOM 0 HG3 GLN A1807 10.981 -6.196 -39.436 1.00 0.00 H new ATOM 0 HE21 GLN A1807 12.075 -8.030 -38.648 1.00 0.00 H new ATOM 0 HE22 GLN A1807 13.742 -7.979 -38.065 1.00 0.00 H new ATOM 582 N PHE A1808 9.753 -6.310 -44.191 1.00 0.00 N ATOM 583 CA PHE A1808 9.389 -6.016 -45.581 1.00 0.00 C ATOM 584 C PHE A1808 7.858 -6.047 -45.764 1.00 0.00 C ATOM 585 O PHE A1808 7.182 -6.890 -45.165 1.00 0.00 O ATOM 586 CB PHE A1808 10.046 -7.045 -46.524 1.00 0.00 C ATOM 587 CG PHE A1808 11.558 -7.153 -46.431 1.00 0.00 C ATOM 588 CD1 PHE A1808 12.373 -6.080 -46.844 1.00 0.00 C ATOM 589 CD2 PHE A1808 12.160 -8.327 -45.932 1.00 0.00 C ATOM 590 CE1 PHE A1808 13.774 -6.167 -46.720 1.00 0.00 C ATOM 591 CE2 PHE A1808 13.559 -8.413 -45.821 1.00 0.00 C ATOM 592 CZ PHE A1808 14.364 -7.329 -46.202 1.00 0.00 C ATOM 0 H PHE A1808 9.236 -7.106 -43.817 1.00 0.00 H new ATOM 0 HA PHE A1808 9.748 -5.016 -45.826 1.00 0.00 H new ATOM 0 HB2 PHE A1808 9.617 -8.025 -46.317 1.00 0.00 H new ATOM 0 HB3 PHE A1808 9.781 -6.791 -47.550 1.00 0.00 H new ATOM 0 HD1 PHE A1808 11.923 -5.189 -47.256 1.00 0.00 H new ATOM 0 HD2 PHE A1808 11.544 -9.163 -45.634 1.00 0.00 H new ATOM 0 HE1 PHE A1808 14.395 -5.337 -47.024 1.00 0.00 H new ATOM 0 HE2 PHE A1808 14.015 -9.316 -45.442 1.00 0.00 H new ATOM 0 HZ PHE A1808 15.437 -7.389 -46.096 1.00 0.00 H new ATOM 602 N ILE A1809 7.318 -5.180 -46.632 1.00 0.00 N ATOM 603 CA ILE A1809 5.928 -5.242 -47.143 1.00 0.00 C ATOM 604 C ILE A1809 5.891 -5.020 -48.659 1.00 0.00 C ATOM 605 O ILE A1809 6.847 -4.497 -49.231 1.00 0.00 O ATOM 606 CB ILE A1809 4.980 -4.252 -46.420 1.00 0.00 C ATOM 607 CG1 ILE A1809 5.382 -2.769 -46.625 1.00 0.00 C ATOM 608 CG2 ILE A1809 4.849 -4.636 -44.934 1.00 0.00 C ATOM 609 CD1 ILE A1809 4.420 -1.762 -45.981 1.00 0.00 C ATOM 0 H ILE A1809 7.844 -4.393 -47.012 1.00 0.00 H new ATOM 0 HA ILE A1809 5.561 -6.245 -46.927 1.00 0.00 H new ATOM 0 HB ILE A1809 3.995 -4.338 -46.879 1.00 0.00 H new ATOM 0 HG12 ILE A1809 6.380 -2.615 -46.215 1.00 0.00 H new ATOM 0 HG13 ILE A1809 5.442 -2.565 -47.694 1.00 0.00 H new ATOM 0 HG21 ILE A1809 4.181 -3.934 -44.434 1.00 0.00 H new ATOM 0 HG22 ILE A1809 4.443 -5.644 -44.853 1.00 0.00 H new ATOM 0 HG23 ILE A1809 5.831 -4.601 -44.461 1.00 0.00 H new ATOM 0 HD11 ILE A1809 4.773 -0.749 -46.171 1.00 0.00 H new ATOM 0 HD12 ILE A1809 3.425 -1.885 -46.408 1.00 0.00 H new ATOM 0 HD13 ILE A1809 4.378 -1.936 -44.906 1.00 0.00 H new ATOM 621 N GLU A1810 4.793 -5.388 -49.322 1.00 0.00 N ATOM 622 CA GLU A1810 4.566 -5.141 -50.758 1.00 0.00 C ATOM 623 C GLU A1810 4.097 -3.697 -51.038 1.00 0.00 C ATOM 624 O GLU A1810 3.402 -3.083 -50.220 1.00 0.00 O ATOM 625 CB GLU A1810 3.520 -6.123 -51.308 1.00 0.00 C ATOM 626 CG GLU A1810 4.015 -7.577 -51.316 1.00 0.00 C ATOM 627 CD GLU A1810 2.929 -8.531 -51.857 1.00 0.00 C ATOM 628 OE1 GLU A1810 2.051 -8.969 -51.077 1.00 0.00 O ATOM 629 OE2 GLU A1810 2.968 -8.879 -53.062 1.00 0.00 O ATOM 0 H GLU A1810 4.018 -5.876 -48.872 1.00 0.00 H new ATOM 0 HA GLU A1810 5.523 -5.289 -51.259 1.00 0.00 H new ATOM 0 HB2 GLU A1810 2.614 -6.056 -50.706 1.00 0.00 H new ATOM 0 HB3 GLU A1810 3.251 -5.830 -52.323 1.00 0.00 H new ATOM 0 HG2 GLU A1810 4.912 -7.656 -51.931 1.00 0.00 H new ATOM 0 HG3 GLU A1810 4.294 -7.875 -50.305 1.00 0.00 H new ATOM 636 N TYR A1811 4.407 -3.162 -52.222 1.00 0.00 N ATOM 637 CA TYR A1811 3.968 -1.815 -52.627 1.00 0.00 C ATOM 638 C TYR A1811 2.437 -1.673 -52.673 1.00 0.00 C ATOM 639 O TYR A1811 1.889 -0.619 -52.338 1.00 0.00 O ATOM 640 CB TYR A1811 4.572 -1.437 -53.991 1.00 0.00 C ATOM 641 CG TYR A1811 4.610 0.061 -54.234 1.00 0.00 C ATOM 642 CD1 TYR A1811 5.616 0.848 -53.642 1.00 0.00 C ATOM 643 CD2 TYR A1811 3.609 0.676 -55.006 1.00 0.00 C ATOM 644 CE1 TYR A1811 5.624 2.247 -53.817 1.00 0.00 C ATOM 645 CE2 TYR A1811 3.607 2.073 -55.185 1.00 0.00 C ATOM 646 CZ TYR A1811 4.614 2.866 -54.588 1.00 0.00 C ATOM 647 OH TYR A1811 4.607 4.218 -54.735 1.00 0.00 O ATOM 0 H TYR A1811 4.966 -3.643 -52.926 1.00 0.00 H new ATOM 0 HA TYR A1811 4.331 -1.128 -51.863 1.00 0.00 H new ATOM 0 HB2 TYR A1811 5.585 -1.835 -54.055 1.00 0.00 H new ATOM 0 HB3 TYR A1811 3.992 -1.912 -54.782 1.00 0.00 H new ATOM 0 HD1 TYR A1811 6.387 0.377 -53.050 1.00 0.00 H new ATOM 0 HD2 TYR A1811 2.838 0.074 -55.464 1.00 0.00 H new ATOM 0 HE1 TYR A1811 6.400 2.845 -53.363 1.00 0.00 H new ATOM 0 HE2 TYR A1811 2.835 2.539 -55.779 1.00 0.00 H new ATOM 0 HH TYR A1811 5.526 4.556 -54.693 1.00 0.00 H new ATOM 657 N SER A1812 1.733 -2.758 -53.020 1.00 0.00 N ATOM 658 CA SER A1812 0.266 -2.869 -53.053 1.00 0.00 C ATOM 659 C SER A1812 -0.430 -2.705 -51.692 1.00 0.00 C ATOM 660 O SER A1812 -1.637 -2.452 -51.658 1.00 0.00 O ATOM 661 CB SER A1812 -0.134 -4.211 -53.677 1.00 0.00 C ATOM 662 OG SER A1812 0.451 -5.289 -52.958 1.00 0.00 O ATOM 0 H SER A1812 2.192 -3.625 -53.299 1.00 0.00 H new ATOM 0 HA SER A1812 -0.077 -2.030 -53.659 1.00 0.00 H new ATOM 0 HB2 SER A1812 -1.219 -4.311 -53.674 1.00 0.00 H new ATOM 0 HB3 SER A1812 0.186 -4.244 -54.718 1.00 0.00 H new ATOM 0 HG SER A1812 0.185 -6.138 -53.368 1.00 0.00 H new ATOM 668 N VAL A1813 0.309 -2.799 -50.576 1.00 0.00 N ATOM 669 CA VAL A1813 -0.195 -2.548 -49.209 1.00 0.00 C ATOM 670 C VAL A1813 0.510 -1.381 -48.503 1.00 0.00 C ATOM 671 O VAL A1813 -0.024 -0.861 -47.523 1.00 0.00 O ATOM 672 CB VAL A1813 -0.167 -3.814 -48.330 1.00 0.00 C ATOM 673 CG1 VAL A1813 -1.041 -4.927 -48.922 1.00 0.00 C ATOM 674 CG2 VAL A1813 1.244 -4.360 -48.074 1.00 0.00 C ATOM 0 H VAL A1813 1.296 -3.057 -50.595 1.00 0.00 H new ATOM 0 HA VAL A1813 -1.236 -2.254 -49.343 1.00 0.00 H new ATOM 0 HB VAL A1813 -0.571 -3.497 -47.368 1.00 0.00 H new ATOM 0 HG11 VAL A1813 -0.998 -5.805 -48.277 1.00 0.00 H new ATOM 0 HG12 VAL A1813 -2.072 -4.580 -48.995 1.00 0.00 H new ATOM 0 HG13 VAL A1813 -0.675 -5.188 -49.915 1.00 0.00 H new ATOM 0 HG21 VAL A1813 1.182 -5.250 -47.448 1.00 0.00 H new ATOM 0 HG22 VAL A1813 1.713 -4.616 -49.024 1.00 0.00 H new ATOM 0 HG23 VAL A1813 1.841 -3.602 -47.567 1.00 0.00 H new ATOM 684 N LEU A1814 1.657 -0.907 -49.002 1.00 0.00 N ATOM 685 CA LEU A1814 2.365 0.272 -48.489 1.00 0.00 C ATOM 686 C LEU A1814 1.472 1.523 -48.520 1.00 0.00 C ATOM 687 O LEU A1814 1.433 2.269 -47.541 1.00 0.00 O ATOM 688 CB LEU A1814 3.663 0.443 -49.292 1.00 0.00 C ATOM 689 CG LEU A1814 4.725 1.349 -48.631 1.00 0.00 C ATOM 690 CD1 LEU A1814 6.089 1.007 -49.222 1.00 0.00 C ATOM 691 CD2 LEU A1814 4.514 2.840 -48.864 1.00 0.00 C ATOM 0 H LEU A1814 2.131 -1.343 -49.793 1.00 0.00 H new ATOM 0 HA LEU A1814 2.621 0.129 -47.439 1.00 0.00 H new ATOM 0 HB2 LEU A1814 4.101 -0.541 -49.460 1.00 0.00 H new ATOM 0 HB3 LEU A1814 3.415 0.853 -50.271 1.00 0.00 H new ATOM 0 HG LEU A1814 4.650 1.163 -47.560 1.00 0.00 H new ATOM 0 HD11 LEU A1814 6.852 1.638 -48.766 1.00 0.00 H new ATOM 0 HD12 LEU A1814 6.319 -0.040 -49.025 1.00 0.00 H new ATOM 0 HD13 LEU A1814 6.072 1.178 -50.298 1.00 0.00 H new ATOM 0 HD21 LEU A1814 5.304 3.402 -48.365 1.00 0.00 H new ATOM 0 HD22 LEU A1814 4.540 3.048 -49.934 1.00 0.00 H new ATOM 0 HD23 LEU A1814 3.547 3.138 -48.460 1.00 0.00 H new ATOM 703 N SER A1815 0.696 1.723 -49.589 1.00 0.00 N ATOM 704 CA SER A1815 -0.271 2.822 -49.714 1.00 0.00 C ATOM 705 C SER A1815 -1.432 2.764 -48.708 1.00 0.00 C ATOM 706 O SER A1815 -1.952 3.816 -48.324 1.00 0.00 O ATOM 707 CB SER A1815 -0.809 2.889 -51.144 1.00 0.00 C ATOM 708 OG SER A1815 -1.375 1.643 -51.531 1.00 0.00 O ATOM 0 H SER A1815 0.721 1.115 -50.408 1.00 0.00 H new ATOM 0 HA SER A1815 0.279 3.732 -49.474 1.00 0.00 H new ATOM 0 HB2 SER A1815 -1.562 3.674 -51.217 1.00 0.00 H new ATOM 0 HB3 SER A1815 -0.003 3.155 -51.828 1.00 0.00 H new ATOM 0 HG SER A1815 -1.714 1.709 -52.448 1.00 0.00 H new ATOM 714 N ASP A1816 -1.815 1.579 -48.233 1.00 0.00 N ATOM 715 CA ASP A1816 -2.805 1.416 -47.158 1.00 0.00 C ATOM 716 C ASP A1816 -2.175 1.550 -45.760 1.00 0.00 C ATOM 717 O ASP A1816 -2.784 2.150 -44.875 1.00 0.00 O ATOM 718 CB ASP A1816 -3.535 0.076 -47.314 1.00 0.00 C ATOM 719 CG ASP A1816 -4.820 0.032 -46.472 1.00 0.00 C ATOM 720 OD1 ASP A1816 -5.680 0.935 -46.638 1.00 0.00 O ATOM 721 OD2 ASP A1816 -4.993 -0.916 -45.672 1.00 0.00 O ATOM 0 H ASP A1816 -1.446 0.695 -48.584 1.00 0.00 H new ATOM 0 HA ASP A1816 -3.531 2.224 -47.248 1.00 0.00 H new ATOM 0 HB2 ASP A1816 -3.781 -0.085 -48.364 1.00 0.00 H new ATOM 0 HB3 ASP A1816 -2.874 -0.737 -47.013 1.00 0.00 H new ATOM 726 N PHE A1817 -0.933 1.082 -45.578 1.00 0.00 N ATOM 727 CA PHE A1817 -0.118 1.310 -44.376 1.00 0.00 C ATOM 728 C PHE A1817 0.137 2.809 -44.132 1.00 0.00 C ATOM 729 O PHE A1817 -0.057 3.302 -43.018 1.00 0.00 O ATOM 730 CB PHE A1817 1.197 0.525 -44.505 1.00 0.00 C ATOM 731 CG PHE A1817 2.243 0.920 -43.483 1.00 0.00 C ATOM 732 CD1 PHE A1817 2.017 0.675 -42.115 1.00 0.00 C ATOM 733 CD2 PHE A1817 3.409 1.599 -43.885 1.00 0.00 C ATOM 734 CE1 PHE A1817 2.934 1.128 -41.153 1.00 0.00 C ATOM 735 CE2 PHE A1817 4.342 2.025 -42.920 1.00 0.00 C ATOM 736 CZ PHE A1817 4.100 1.798 -41.555 1.00 0.00 C ATOM 0 H PHE A1817 -0.454 0.519 -46.281 1.00 0.00 H new ATOM 0 HA PHE A1817 -0.665 0.950 -43.505 1.00 0.00 H new ATOM 0 HB2 PHE A1817 0.986 -0.540 -44.404 1.00 0.00 H new ATOM 0 HB3 PHE A1817 1.603 0.676 -45.505 1.00 0.00 H new ATOM 0 HD1 PHE A1817 1.134 0.136 -41.804 1.00 0.00 H new ATOM 0 HD2 PHE A1817 3.588 1.793 -44.932 1.00 0.00 H new ATOM 0 HE1 PHE A1817 2.742 0.961 -40.103 1.00 0.00 H new ATOM 0 HE2 PHE A1817 5.246 2.528 -43.230 1.00 0.00 H new ATOM 0 HZ PHE A1817 4.810 2.139 -40.816 1.00 0.00 H new ATOM 746 N ALA A1818 0.496 3.550 -45.184 1.00 0.00 N ATOM 747 CA ALA A1818 0.680 5.005 -45.172 1.00 0.00 C ATOM 748 C ALA A1818 -0.562 5.776 -44.674 1.00 0.00 C ATOM 749 O ALA A1818 -0.433 6.847 -44.073 1.00 0.00 O ATOM 750 CB ALA A1818 1.068 5.437 -46.590 1.00 0.00 C ATOM 0 H ALA A1818 0.673 3.139 -46.101 1.00 0.00 H new ATOM 0 HA ALA A1818 1.468 5.251 -44.460 1.00 0.00 H new ATOM 0 HB1 ALA A1818 1.212 6.517 -46.615 1.00 0.00 H new ATOM 0 HB2 ALA A1818 1.994 4.940 -46.881 1.00 0.00 H new ATOM 0 HB3 ALA A1818 0.274 5.161 -47.284 1.00 0.00 H new ATOM 756 N ASP A1819 -1.753 5.208 -44.880 1.00 0.00 N ATOM 757 CA ASP A1819 -3.054 5.718 -44.425 1.00 0.00 C ATOM 758 C ASP A1819 -3.561 5.074 -43.112 1.00 0.00 C ATOM 759 O ASP A1819 -4.577 5.506 -42.568 1.00 0.00 O ATOM 760 CB ASP A1819 -4.055 5.563 -45.581 1.00 0.00 C ATOM 761 CG ASP A1819 -5.410 6.231 -45.312 1.00 0.00 C ATOM 762 OD1 ASP A1819 -5.442 7.471 -45.109 1.00 0.00 O ATOM 763 OD2 ASP A1819 -6.444 5.518 -45.352 1.00 0.00 O ATOM 0 H ASP A1819 -1.843 4.333 -45.396 1.00 0.00 H new ATOM 0 HA ASP A1819 -2.940 6.770 -44.165 1.00 0.00 H new ATOM 0 HB2 ASP A1819 -3.622 5.990 -46.486 1.00 0.00 H new ATOM 0 HB3 ASP A1819 -4.214 4.502 -45.774 1.00 0.00 H new ATOM 768 N ALA A1820 -2.873 4.066 -42.565 1.00 0.00 N ATOM 769 CA ALA A1820 -3.251 3.405 -41.305 1.00 0.00 C ATOM 770 C ALA A1820 -2.639 4.093 -40.069 1.00 0.00 C ATOM 771 O ALA A1820 -3.141 3.942 -38.955 1.00 0.00 O ATOM 772 CB ALA A1820 -2.833 1.934 -41.384 1.00 0.00 C ATOM 0 H ALA A1820 -2.028 3.680 -42.987 1.00 0.00 H new ATOM 0 HA ALA A1820 -4.331 3.481 -41.182 1.00 0.00 H new ATOM 0 HB1 ALA A1820 -3.106 1.428 -40.458 1.00 0.00 H new ATOM 0 HB2 ALA A1820 -3.341 1.456 -42.222 1.00 0.00 H new ATOM 0 HB3 ALA A1820 -1.755 1.869 -41.529 1.00 0.00 H new ATOM 778 N LEU A1821 -1.561 4.853 -40.273 1.00 0.00 N ATOM 779 CA LEU A1821 -0.859 5.650 -39.261 1.00 0.00 C ATOM 780 C LEU A1821 -1.706 6.839 -38.764 1.00 0.00 C ATOM 781 O LEU A1821 -2.623 7.309 -39.447 1.00 0.00 O ATOM 782 CB LEU A1821 0.454 6.154 -39.894 1.00 0.00 C ATOM 783 CG LEU A1821 1.460 5.020 -40.169 1.00 0.00 C ATOM 784 CD1 LEU A1821 2.286 5.365 -41.399 1.00 0.00 C ATOM 785 CD2 LEU A1821 2.399 4.799 -38.981 1.00 0.00 C ATOM 0 H LEU A1821 -1.131 4.934 -41.194 1.00 0.00 H new ATOM 0 HA LEU A1821 -0.661 5.028 -38.388 1.00 0.00 H new ATOM 0 HB2 LEU A1821 0.228 6.667 -40.829 1.00 0.00 H new ATOM 0 HB3 LEU A1821 0.913 6.888 -39.231 1.00 0.00 H new ATOM 0 HG LEU A1821 0.895 4.102 -40.333 1.00 0.00 H new ATOM 0 HD11 LEU A1821 2.998 4.564 -41.595 1.00 0.00 H new ATOM 0 HD12 LEU A1821 1.627 5.483 -42.259 1.00 0.00 H new ATOM 0 HD13 LEU A1821 2.826 6.296 -41.225 1.00 0.00 H new ATOM 0 HD21 LEU A1821 3.094 3.992 -39.212 1.00 0.00 H new ATOM 0 HD22 LEU A1821 2.958 5.714 -38.784 1.00 0.00 H new ATOM 0 HD23 LEU A1821 1.815 4.534 -38.100 1.00 0.00 H new ATOM 797 N SER A1822 -1.348 7.380 -37.599 1.00 0.00 N ATOM 798 CA SER A1822 -1.812 8.701 -37.158 1.00 0.00 C ATOM 799 C SER A1822 -0.843 9.798 -37.624 1.00 0.00 C ATOM 800 O SER A1822 0.306 9.533 -38.002 1.00 0.00 O ATOM 801 CB SER A1822 -1.980 8.720 -35.639 1.00 0.00 C ATOM 802 OG SER A1822 -2.833 9.789 -35.256 1.00 0.00 O ATOM 0 H SER A1822 -0.729 6.917 -36.933 1.00 0.00 H new ATOM 0 HA SER A1822 -2.783 8.902 -37.611 1.00 0.00 H new ATOM 0 HB2 SER A1822 -2.397 7.772 -35.300 1.00 0.00 H new ATOM 0 HB3 SER A1822 -1.008 8.830 -35.159 1.00 0.00 H new ATOM 0 HG SER A1822 -2.936 9.792 -34.281 1.00 0.00 H new ATOM 808 N GLU A1823 -1.299 11.049 -37.616 1.00 0.00 N ATOM 809 CA GLU A1823 -0.452 12.222 -37.868 1.00 0.00 C ATOM 810 C GLU A1823 0.676 12.337 -36.805 1.00 0.00 C ATOM 811 O GLU A1823 0.492 11.903 -35.660 1.00 0.00 O ATOM 812 CB GLU A1823 -1.333 13.484 -37.878 1.00 0.00 C ATOM 813 CG GLU A1823 -2.235 13.537 -39.122 1.00 0.00 C ATOM 814 CD GLU A1823 -3.088 14.818 -39.128 1.00 0.00 C ATOM 815 OE1 GLU A1823 -2.629 15.858 -39.665 1.00 0.00 O ATOM 816 OE2 GLU A1823 -4.225 14.799 -38.594 1.00 0.00 O ATOM 0 H GLU A1823 -2.275 11.283 -37.433 1.00 0.00 H new ATOM 0 HA GLU A1823 0.032 12.113 -38.839 1.00 0.00 H new ATOM 0 HB2 GLU A1823 -1.950 13.504 -36.980 1.00 0.00 H new ATOM 0 HB3 GLU A1823 -0.699 14.371 -37.850 1.00 0.00 H new ATOM 0 HG2 GLU A1823 -1.622 13.499 -40.022 1.00 0.00 H new ATOM 0 HG3 GLU A1823 -2.885 12.662 -39.142 1.00 0.00 H new ATOM 823 N PRO A1824 1.835 12.943 -37.134 1.00 0.00 N ATOM 824 CA PRO A1824 2.182 13.552 -38.424 1.00 0.00 C ATOM 825 C PRO A1824 2.728 12.568 -39.484 1.00 0.00 C ATOM 826 O PRO A1824 2.811 12.941 -40.650 1.00 0.00 O ATOM 827 CB PRO A1824 3.226 14.609 -38.050 1.00 0.00 C ATOM 828 CG PRO A1824 3.997 13.930 -36.917 1.00 0.00 C ATOM 829 CD PRO A1824 2.887 13.215 -36.157 1.00 0.00 C ATOM 0 HA PRO A1824 1.293 13.954 -38.911 1.00 0.00 H new ATOM 0 HB2 PRO A1824 3.874 14.854 -38.891 1.00 0.00 H new ATOM 0 HB3 PRO A1824 2.762 15.540 -37.724 1.00 0.00 H new ATOM 0 HG2 PRO A1824 4.746 13.234 -37.294 1.00 0.00 H new ATOM 0 HG3 PRO A1824 4.520 14.652 -36.290 1.00 0.00 H new ATOM 0 HD2 PRO A1824 3.253 12.290 -35.712 1.00 0.00 H new ATOM 0 HD3 PRO A1824 2.511 13.834 -35.342 1.00 0.00 H new ATOM 837 N LEU A1825 3.074 11.323 -39.122 1.00 0.00 N ATOM 838 CA LEU A1825 3.663 10.325 -40.042 1.00 0.00 C ATOM 839 C LEU A1825 2.721 9.929 -41.198 1.00 0.00 C ATOM 840 O LEU A1825 3.186 9.639 -42.301 1.00 0.00 O ATOM 841 CB LEU A1825 4.075 9.070 -39.252 1.00 0.00 C ATOM 842 CG LEU A1825 5.270 9.262 -38.298 1.00 0.00 C ATOM 843 CD1 LEU A1825 5.425 8.034 -37.403 1.00 0.00 C ATOM 844 CD2 LEU A1825 6.592 9.441 -39.053 1.00 0.00 C ATOM 0 H LEU A1825 2.953 10.972 -38.172 1.00 0.00 H new ATOM 0 HA LEU A1825 4.536 10.793 -40.497 1.00 0.00 H new ATOM 0 HB2 LEU A1825 3.218 8.727 -38.672 1.00 0.00 H new ATOM 0 HB3 LEU A1825 4.319 8.278 -39.960 1.00 0.00 H new ATOM 0 HG LEU A1825 5.061 10.160 -37.717 1.00 0.00 H new ATOM 0 HD11 LEU A1825 6.272 8.178 -36.732 1.00 0.00 H new ATOM 0 HD12 LEU A1825 4.517 7.894 -36.817 1.00 0.00 H new ATOM 0 HD13 LEU A1825 5.597 7.153 -38.021 1.00 0.00 H new ATOM 0 HD21 LEU A1825 7.404 9.573 -38.338 1.00 0.00 H new ATOM 0 HD22 LEU A1825 6.785 8.559 -39.663 1.00 0.00 H new ATOM 0 HD23 LEU A1825 6.528 10.319 -39.695 1.00 0.00 H new ATOM 856 N ARG A1826 1.410 9.946 -40.946 1.00 0.00 N ATOM 857 CA ARG A1826 0.293 9.714 -41.881 1.00 0.00 C ATOM 858 C ARG A1826 0.462 10.418 -43.234 1.00 0.00 C ATOM 859 O ARG A1826 0.690 11.629 -43.282 1.00 0.00 O ATOM 860 CB ARG A1826 -0.979 10.184 -41.149 1.00 0.00 C ATOM 861 CG ARG A1826 -2.308 10.172 -41.912 1.00 0.00 C ATOM 862 CD ARG A1826 -2.650 8.783 -42.460 1.00 0.00 C ATOM 863 NE ARG A1826 -4.074 8.648 -42.817 1.00 0.00 N ATOM 864 CZ ARG A1826 -5.105 8.461 -42.011 1.00 0.00 C ATOM 865 NH1 ARG A1826 -5.002 8.386 -40.713 1.00 0.00 N ATOM 866 NH2 ARG A1826 -6.282 8.312 -42.543 1.00 0.00 N ATOM 0 H ARG A1826 1.068 10.138 -40.005 1.00 0.00 H new ATOM 0 HA ARG A1826 0.245 8.657 -42.142 1.00 0.00 H new ATOM 0 HB2 ARG A1826 -1.100 9.562 -40.262 1.00 0.00 H new ATOM 0 HB3 ARG A1826 -0.805 11.203 -40.802 1.00 0.00 H new ATOM 0 HG2 ARG A1826 -3.107 10.506 -41.251 1.00 0.00 H new ATOM 0 HG3 ARG A1826 -2.258 10.883 -42.736 1.00 0.00 H new ATOM 0 HD2 ARG A1826 -2.038 8.583 -43.340 1.00 0.00 H new ATOM 0 HD3 ARG A1826 -2.393 8.030 -41.715 1.00 0.00 H new ATOM 0 HE ARG A1826 -4.291 8.706 -43.812 1.00 0.00 H new ATOM 0 HH11 ARG A1826 -4.088 8.473 -40.268 1.00 0.00 H new ATOM 0 HH12 ARG A1826 -5.835 8.240 -40.143 1.00 0.00 H new ATOM 0 HH21 ARG A1826 -6.391 8.341 -43.557 1.00 0.00 H new ATOM 0 HH22 ARG A1826 -7.096 8.166 -41.947 1.00 0.00 H new ATOM 880 N ILE A1827 0.275 9.680 -44.329 1.00 0.00 N ATOM 881 CA ILE A1827 0.081 10.208 -45.692 1.00 0.00 C ATOM 882 C ILE A1827 -1.321 9.793 -46.148 1.00 0.00 C ATOM 883 O ILE A1827 -1.515 8.713 -46.712 1.00 0.00 O ATOM 884 CB ILE A1827 1.192 9.769 -46.679 1.00 0.00 C ATOM 885 CG1 ILE A1827 2.622 9.969 -46.128 1.00 0.00 C ATOM 886 CG2 ILE A1827 1.055 10.581 -47.976 1.00 0.00 C ATOM 887 CD1 ILE A1827 3.195 8.705 -45.471 1.00 0.00 C ATOM 0 H ILE A1827 0.253 8.661 -44.296 1.00 0.00 H new ATOM 0 HA ILE A1827 0.161 11.295 -45.680 1.00 0.00 H new ATOM 0 HB ILE A1827 1.057 8.701 -46.848 1.00 0.00 H new ATOM 0 HG12 ILE A1827 3.279 10.278 -46.941 1.00 0.00 H new ATOM 0 HG13 ILE A1827 2.614 10.779 -45.399 1.00 0.00 H new ATOM 0 HG21 ILE A1827 1.833 10.280 -48.678 1.00 0.00 H new ATOM 0 HG22 ILE A1827 0.076 10.397 -48.418 1.00 0.00 H new ATOM 0 HG23 ILE A1827 1.159 11.643 -47.753 1.00 0.00 H new ATOM 0 HD11 ILE A1827 4.201 8.910 -45.104 1.00 0.00 H new ATOM 0 HD12 ILE A1827 2.558 8.408 -44.638 1.00 0.00 H new ATOM 0 HD13 ILE A1827 3.233 7.899 -46.204 1.00 0.00 H new ATOM 899 N ALA A1828 -2.322 10.620 -45.834 1.00 0.00 N ATOM 900 CA ALA A1828 -3.731 10.324 -46.097 1.00 0.00 C ATOM 901 C ALA A1828 -4.049 10.190 -47.597 1.00 0.00 C ATOM 902 O ALA A1828 -3.443 10.858 -48.442 1.00 0.00 O ATOM 903 CB ALA A1828 -4.591 11.405 -45.426 1.00 0.00 C ATOM 0 H ALA A1828 -2.174 11.524 -45.385 1.00 0.00 H new ATOM 0 HA ALA A1828 -3.965 9.348 -45.671 1.00 0.00 H new ATOM 0 HB1 ALA A1828 -5.645 11.199 -45.613 1.00 0.00 H new ATOM 0 HB2 ALA A1828 -4.405 11.403 -44.352 1.00 0.00 H new ATOM 0 HB3 ALA A1828 -4.334 12.381 -45.837 1.00 0.00 H new ATOM 909 N LYS A1829 -5.011 9.326 -47.943 1.00 0.00 N ATOM 910 CA LYS A1829 -5.427 9.051 -49.335 1.00 0.00 C ATOM 911 C LYS A1829 -6.073 10.284 -50.016 1.00 0.00 C ATOM 912 O LYS A1829 -6.739 11.073 -49.333 1.00 0.00 O ATOM 913 CB LYS A1829 -6.413 7.868 -49.343 1.00 0.00 C ATOM 914 CG LYS A1829 -5.701 6.537 -49.063 1.00 0.00 C ATOM 915 CD LYS A1829 -6.724 5.435 -48.748 1.00 0.00 C ATOM 916 CE LYS A1829 -6.014 4.137 -48.344 1.00 0.00 C ATOM 917 NZ LYS A1829 -6.760 3.434 -47.271 1.00 0.00 N ATOM 0 H LYS A1829 -5.535 8.785 -47.255 1.00 0.00 H new ATOM 0 HA LYS A1829 -4.533 8.805 -49.908 1.00 0.00 H new ATOM 0 HB2 LYS A1829 -7.186 8.033 -48.592 1.00 0.00 H new ATOM 0 HB3 LYS A1829 -6.913 7.817 -50.310 1.00 0.00 H new ATOM 0 HG2 LYS A1829 -5.102 6.249 -49.927 1.00 0.00 H new ATOM 0 HG3 LYS A1829 -5.014 6.654 -48.225 1.00 0.00 H new ATOM 0 HD2 LYS A1829 -7.382 5.762 -47.943 1.00 0.00 H new ATOM 0 HD3 LYS A1829 -7.353 5.255 -49.620 1.00 0.00 H new ATOM 0 HE2 LYS A1829 -5.919 3.485 -49.212 1.00 0.00 H new ATOM 0 HE3 LYS A1829 -5.004 4.362 -48.002 1.00 0.00 H new ATOM 0 HZ1 LYS A1829 -6.250 2.568 -47.004 1.00 0.00 H new ATOM 0 HZ2 LYS A1829 -6.844 4.056 -46.442 1.00 0.00 H new ATOM 0 HZ3 LYS A1829 -7.709 3.185 -47.614 1.00 0.00 H new ATOM 931 N PRO A1830 -5.961 10.422 -51.354 1.00 0.00 N ATOM 932 CA PRO A1830 -5.118 9.621 -52.249 1.00 0.00 C ATOM 933 C PRO A1830 -3.622 9.942 -52.060 1.00 0.00 C ATOM 934 O PRO A1830 -3.230 11.114 -52.040 1.00 0.00 O ATOM 935 CB PRO A1830 -5.600 9.974 -53.660 1.00 0.00 C ATOM 936 CG PRO A1830 -6.102 11.413 -53.533 1.00 0.00 C ATOM 937 CD PRO A1830 -6.661 11.458 -52.106 1.00 0.00 C ATOM 0 HA PRO A1830 -5.206 8.554 -52.045 1.00 0.00 H new ATOM 0 HB2 PRO A1830 -4.793 9.896 -54.388 1.00 0.00 H new ATOM 0 HB3 PRO A1830 -6.393 9.303 -53.990 1.00 0.00 H new ATOM 0 HG2 PRO A1830 -5.298 12.135 -53.674 1.00 0.00 H new ATOM 0 HG3 PRO A1830 -6.868 11.640 -54.274 1.00 0.00 H new ATOM 0 HD2 PRO A1830 -6.501 12.438 -51.657 1.00 0.00 H new ATOM 0 HD3 PRO A1830 -7.736 11.279 -52.105 1.00 0.00 H new ATOM 945 N ASN A1831 -2.789 8.905 -51.929 1.00 0.00 N ATOM 946 CA ASN A1831 -1.351 9.008 -51.618 1.00 0.00 C ATOM 947 C ASN A1831 -0.428 8.320 -52.642 1.00 0.00 C ATOM 948 O ASN A1831 0.792 8.377 -52.489 1.00 0.00 O ATOM 949 CB ASN A1831 -1.095 8.501 -50.186 1.00 0.00 C ATOM 950 CG ASN A1831 -1.516 7.057 -49.947 1.00 0.00 C ATOM 951 OD1 ASN A1831 -1.648 6.251 -50.856 1.00 0.00 O ATOM 952 ND2 ASN A1831 -1.748 6.686 -48.713 1.00 0.00 N ATOM 0 H ASN A1831 -3.101 7.940 -52.039 1.00 0.00 H new ATOM 0 HA ASN A1831 -1.089 10.064 -51.686 1.00 0.00 H new ATOM 0 HB2 ASN A1831 -0.033 8.599 -49.963 1.00 0.00 H new ATOM 0 HB3 ASN A1831 -1.628 9.143 -49.485 1.00 0.00 H new ATOM 0 HD21 ASN A1831 -2.037 5.728 -48.514 1.00 0.00 H new ATOM 0 HD22 ASN A1831 -1.639 7.355 -47.950 1.00 0.00 H new ATOM 959 N GLN A1832 -0.958 7.704 -53.709 1.00 0.00 N ATOM 960 CA GLN A1832 -0.136 7.017 -54.718 1.00 0.00 C ATOM 961 C GLN A1832 0.920 7.940 -55.355 1.00 0.00 C ATOM 962 O GLN A1832 2.075 7.542 -55.509 1.00 0.00 O ATOM 963 CB GLN A1832 -1.021 6.313 -55.765 1.00 0.00 C ATOM 964 CG GLN A1832 -1.906 7.242 -56.623 1.00 0.00 C ATOM 965 CD GLN A1832 -2.775 6.443 -57.590 1.00 0.00 C ATOM 966 OE1 GLN A1832 -2.386 6.125 -58.710 1.00 0.00 O ATOM 967 NE2 GLN A1832 -3.981 6.080 -57.204 1.00 0.00 N ATOM 0 H GLN A1832 -1.960 7.667 -53.897 1.00 0.00 H new ATOM 0 HA GLN A1832 0.432 6.244 -54.201 1.00 0.00 H new ATOM 0 HB2 GLN A1832 -0.378 5.737 -56.430 1.00 0.00 H new ATOM 0 HB3 GLN A1832 -1.665 5.601 -55.250 1.00 0.00 H new ATOM 0 HG2 GLN A1832 -2.541 7.845 -55.973 1.00 0.00 H new ATOM 0 HG3 GLN A1832 -1.276 7.933 -57.183 1.00 0.00 H new ATOM 0 HE21 GLN A1832 -4.318 6.337 -56.276 1.00 0.00 H new ATOM 0 HE22 GLN A1832 -4.577 5.542 -57.833 1.00 0.00 H new ATOM 976 N ILE A1833 0.565 9.197 -55.650 1.00 0.00 N ATOM 977 CA ILE A1833 1.479 10.213 -56.204 1.00 0.00 C ATOM 978 C ILE A1833 2.509 10.646 -55.152 1.00 0.00 C ATOM 979 O ILE A1833 3.702 10.722 -55.454 1.00 0.00 O ATOM 980 CB ILE A1833 0.685 11.422 -56.754 1.00 0.00 C ATOM 981 CG1 ILE A1833 -0.406 11.025 -57.777 1.00 0.00 C ATOM 982 CG2 ILE A1833 1.630 12.460 -57.385 1.00 0.00 C ATOM 983 CD1 ILE A1833 0.073 10.230 -59.001 1.00 0.00 C ATOM 0 H ILE A1833 -0.383 9.546 -55.509 1.00 0.00 H new ATOM 0 HA ILE A1833 2.024 9.771 -57.038 1.00 0.00 H new ATOM 0 HB ILE A1833 0.178 11.859 -55.894 1.00 0.00 H new ATOM 0 HG12 ILE A1833 -1.163 10.436 -57.260 1.00 0.00 H new ATOM 0 HG13 ILE A1833 -0.894 11.934 -58.128 1.00 0.00 H new ATOM 0 HG21 ILE A1833 1.047 13.300 -57.764 1.00 0.00 H new ATOM 0 HG22 ILE A1833 2.333 12.817 -56.632 1.00 0.00 H new ATOM 0 HG23 ILE A1833 2.180 12.000 -58.206 1.00 0.00 H new ATOM 0 HD11 ILE A1833 -0.777 10.009 -59.646 1.00 0.00 H new ATOM 0 HD12 ILE A1833 0.805 10.819 -59.554 1.00 0.00 H new ATOM 0 HD13 ILE A1833 0.532 9.297 -58.672 1.00 0.00 H new ATOM 995 N SER A1834 2.066 10.875 -53.912 1.00 0.00 N ATOM 996 CA SER A1834 2.907 11.196 -52.750 1.00 0.00 C ATOM 997 C SER A1834 4.008 10.149 -52.530 1.00 0.00 C ATOM 998 O SER A1834 5.178 10.504 -52.374 1.00 0.00 O ATOM 999 CB SER A1834 2.029 11.315 -51.496 1.00 0.00 C ATOM 1000 OG SER A1834 0.993 12.262 -51.702 1.00 0.00 O ATOM 0 H SER A1834 1.074 10.841 -53.679 1.00 0.00 H new ATOM 0 HA SER A1834 3.401 12.148 -52.946 1.00 0.00 H new ATOM 0 HB2 SER A1834 1.598 10.344 -51.253 1.00 0.00 H new ATOM 0 HB3 SER A1834 2.640 11.615 -50.645 1.00 0.00 H new ATOM 0 HG SER A1834 0.442 12.325 -50.894 1.00 0.00 H new ATOM 1006 N LEU A1835 3.652 8.860 -52.571 1.00 0.00 N ATOM 1007 CA LEU A1835 4.559 7.719 -52.414 1.00 0.00 C ATOM 1008 C LEU A1835 5.475 7.499 -53.631 1.00 0.00 C ATOM 1009 O LEU A1835 6.656 7.207 -53.443 1.00 0.00 O ATOM 1010 CB LEU A1835 3.715 6.468 -52.108 1.00 0.00 C ATOM 1011 CG LEU A1835 2.966 6.539 -50.763 1.00 0.00 C ATOM 1012 CD1 LEU A1835 1.953 5.404 -50.656 1.00 0.00 C ATOM 1013 CD2 LEU A1835 3.905 6.443 -49.561 1.00 0.00 C ATOM 0 H LEU A1835 2.685 8.572 -52.721 1.00 0.00 H new ATOM 0 HA LEU A1835 5.236 7.929 -51.586 1.00 0.00 H new ATOM 0 HB2 LEU A1835 2.991 6.324 -52.910 1.00 0.00 H new ATOM 0 HB3 LEU A1835 4.366 5.593 -52.106 1.00 0.00 H new ATOM 0 HG LEU A1835 2.470 7.509 -50.745 1.00 0.00 H new ATOM 0 HD11 LEU A1835 1.433 5.469 -49.700 1.00 0.00 H new ATOM 0 HD12 LEU A1835 1.230 5.483 -51.468 1.00 0.00 H new ATOM 0 HD13 LEU A1835 2.470 4.447 -50.723 1.00 0.00 H new ATOM 0 HD21 LEU A1835 3.324 6.498 -48.640 1.00 0.00 H new ATOM 0 HD22 LEU A1835 4.443 5.496 -49.594 1.00 0.00 H new ATOM 0 HD23 LEU A1835 4.618 7.267 -49.590 1.00 0.00 H new ATOM 1025 N ILE A1836 4.994 7.702 -54.865 1.00 0.00 N ATOM 1026 CA ILE A1836 5.819 7.705 -56.093 1.00 0.00 C ATOM 1027 C ILE A1836 6.937 8.759 -56.019 1.00 0.00 C ATOM 1028 O ILE A1836 8.054 8.512 -56.481 1.00 0.00 O ATOM 1029 CB ILE A1836 4.915 7.883 -57.349 1.00 0.00 C ATOM 1030 CG1 ILE A1836 4.210 6.540 -57.660 1.00 0.00 C ATOM 1031 CG2 ILE A1836 5.690 8.354 -58.594 1.00 0.00 C ATOM 1032 CD1 ILE A1836 3.030 6.662 -58.641 1.00 0.00 C ATOM 0 H ILE A1836 4.005 7.872 -55.047 1.00 0.00 H new ATOM 0 HA ILE A1836 6.317 6.739 -56.180 1.00 0.00 H new ATOM 0 HB ILE A1836 4.190 8.663 -57.115 1.00 0.00 H new ATOM 0 HG12 ILE A1836 4.941 5.845 -58.073 1.00 0.00 H new ATOM 0 HG13 ILE A1836 3.850 6.107 -56.727 1.00 0.00 H new ATOM 0 HG21 ILE A1836 5.002 8.458 -59.433 1.00 0.00 H new ATOM 0 HG22 ILE A1836 6.159 9.316 -58.388 1.00 0.00 H new ATOM 0 HG23 ILE A1836 6.458 7.622 -58.843 1.00 0.00 H new ATOM 0 HD11 ILE A1836 2.591 5.678 -58.806 1.00 0.00 H new ATOM 0 HD12 ILE A1836 2.277 7.330 -58.223 1.00 0.00 H new ATOM 0 HD13 ILE A1836 3.386 7.064 -59.590 1.00 0.00 H new ATOM 1044 N ASN A1837 6.663 9.927 -55.427 1.00 0.00 N ATOM 1045 CA ASN A1837 7.642 11.008 -55.240 1.00 0.00 C ATOM 1046 C ASN A1837 8.664 10.767 -54.101 1.00 0.00 C ATOM 1047 O ASN A1837 9.655 11.499 -54.025 1.00 0.00 O ATOM 1048 CB ASN A1837 6.879 12.334 -55.055 1.00 0.00 C ATOM 1049 CG ASN A1837 6.456 12.936 -56.384 1.00 0.00 C ATOM 1050 OD1 ASN A1837 7.171 13.719 -56.995 1.00 0.00 O ATOM 1051 ND2 ASN A1837 5.294 12.590 -56.889 1.00 0.00 N ATOM 0 H ASN A1837 5.740 10.153 -55.058 1.00 0.00 H new ATOM 0 HA ASN A1837 8.260 11.045 -56.137 1.00 0.00 H new ATOM 0 HB2 ASN A1837 5.997 12.162 -54.438 1.00 0.00 H new ATOM 0 HB3 ASN A1837 7.510 13.044 -54.520 1.00 0.00 H new ATOM 0 HD21 ASN A1837 4.993 12.973 -57.785 1.00 0.00 H new ATOM 0 HD22 ASN A1837 4.693 11.938 -56.385 1.00 0.00 H new ATOM 1058 N MET A1838 8.478 9.765 -53.231 1.00 0.00 N ATOM 1059 CA MET A1838 9.478 9.366 -52.233 1.00 0.00 C ATOM 1060 C MET A1838 10.634 8.557 -52.851 1.00 0.00 C ATOM 1061 O MET A1838 10.554 8.040 -53.967 1.00 0.00 O ATOM 1062 CB MET A1838 8.818 8.559 -51.100 1.00 0.00 C ATOM 1063 CG MET A1838 7.830 9.377 -50.260 1.00 0.00 C ATOM 1064 SD MET A1838 7.137 8.437 -48.873 1.00 0.00 S ATOM 1065 CE MET A1838 6.107 9.722 -48.110 1.00 0.00 C ATOM 0 H MET A1838 7.625 9.206 -53.200 1.00 0.00 H new ATOM 0 HA MET A1838 9.902 10.284 -51.826 1.00 0.00 H new ATOM 0 HB2 MET A1838 8.296 7.704 -51.530 1.00 0.00 H new ATOM 0 HB3 MET A1838 9.595 8.162 -50.447 1.00 0.00 H new ATOM 0 HG2 MET A1838 8.335 10.263 -49.876 1.00 0.00 H new ATOM 0 HG3 MET A1838 7.018 9.724 -50.899 1.00 0.00 H new ATOM 0 HE1 MET A1838 5.603 9.312 -47.234 1.00 0.00 H new ATOM 0 HE2 MET A1838 6.735 10.560 -47.808 1.00 0.00 H new ATOM 0 HE3 MET A1838 5.363 10.066 -48.828 1.00 0.00 H new ATOM 1075 N ASP A1839 11.716 8.419 -52.086 1.00 0.00 N ATOM 1076 CA ASP A1839 12.958 7.709 -52.452 1.00 0.00 C ATOM 1077 C ASP A1839 12.897 6.175 -52.219 1.00 0.00 C ATOM 1078 O ASP A1839 13.921 5.488 -52.268 1.00 0.00 O ATOM 1079 CB ASP A1839 14.121 8.369 -51.685 1.00 0.00 C ATOM 1080 CG ASP A1839 15.510 7.986 -52.230 1.00 0.00 C ATOM 1081 OD1 ASP A1839 15.747 8.117 -53.457 1.00 0.00 O ATOM 1082 OD2 ASP A1839 16.393 7.593 -51.428 1.00 0.00 O ATOM 0 H ASP A1839 11.761 8.816 -51.147 1.00 0.00 H new ATOM 0 HA ASP A1839 13.109 7.804 -53.527 1.00 0.00 H new ATOM 0 HB2 ASP A1839 14.007 9.452 -51.730 1.00 0.00 H new ATOM 0 HB3 ASP A1839 14.061 8.085 -50.634 1.00 0.00 H new ATOM 1087 N LEU A1840 11.704 5.630 -51.938 1.00 0.00 N ATOM 1088 CA LEU A1840 11.446 4.231 -51.564 1.00 0.00 C ATOM 1089 C LEU A1840 12.108 3.211 -52.529 1.00 0.00 C ATOM 1090 O LEU A1840 11.804 3.235 -53.729 1.00 0.00 O ATOM 1091 CB LEU A1840 9.926 3.979 -51.485 1.00 0.00 C ATOM 1092 CG LEU A1840 9.180 4.791 -50.406 1.00 0.00 C ATOM 1093 CD1 LEU A1840 7.676 4.585 -50.555 1.00 0.00 C ATOM 1094 CD2 LEU A1840 9.576 4.383 -48.984 1.00 0.00 C ATOM 0 H LEU A1840 10.847 6.183 -51.967 1.00 0.00 H new ATOM 0 HA LEU A1840 11.901 4.076 -50.586 1.00 0.00 H new ATOM 0 HB2 LEU A1840 9.486 4.205 -52.456 1.00 0.00 H new ATOM 0 HB3 LEU A1840 9.759 2.918 -51.299 1.00 0.00 H new ATOM 0 HG LEU A1840 9.455 5.835 -50.554 1.00 0.00 H new ATOM 0 HD11 LEU A1840 7.153 5.160 -49.791 1.00 0.00 H new ATOM 0 HD12 LEU A1840 7.359 4.920 -51.543 1.00 0.00 H new ATOM 0 HD13 LEU A1840 7.440 3.527 -50.438 1.00 0.00 H new ATOM 0 HD21 LEU A1840 9.021 4.986 -48.265 1.00 0.00 H new ATOM 0 HD22 LEU A1840 9.344 3.329 -48.830 1.00 0.00 H new ATOM 0 HD23 LEU A1840 10.645 4.543 -48.844 1.00 0.00 H new ATOM 1106 N PRO A1841 12.991 2.312 -52.042 1.00 0.00 N ATOM 1107 CA PRO A1841 13.621 1.260 -52.849 1.00 0.00 C ATOM 1108 C PRO A1841 12.648 0.102 -53.165 1.00 0.00 C ATOM 1109 O PRO A1841 11.518 0.083 -52.679 1.00 0.00 O ATOM 1110 CB PRO A1841 14.812 0.798 -52.006 1.00 0.00 C ATOM 1111 CG PRO A1841 14.293 0.937 -50.578 1.00 0.00 C ATOM 1112 CD PRO A1841 13.444 2.202 -50.659 1.00 0.00 C ATOM 0 HA PRO A1841 13.928 1.626 -53.829 1.00 0.00 H new ATOM 0 HB2 PRO A1841 15.095 -0.230 -52.235 1.00 0.00 H new ATOM 0 HB3 PRO A1841 15.693 1.417 -52.178 1.00 0.00 H new ATOM 0 HG2 PRO A1841 13.704 0.072 -50.274 1.00 0.00 H new ATOM 0 HG3 PRO A1841 15.106 1.039 -49.859 1.00 0.00 H new ATOM 0 HD2 PRO A1841 12.596 2.144 -49.977 1.00 0.00 H new ATOM 0 HD3 PRO A1841 14.025 3.078 -50.371 1.00 0.00 H new ATOM 1120 N MET A1842 13.099 -0.895 -53.935 1.00 0.00 N ATOM 1121 CA MET A1842 12.409 -2.180 -54.125 1.00 0.00 C ATOM 1122 C MET A1842 13.398 -3.354 -54.024 1.00 0.00 C ATOM 1123 O MET A1842 14.185 -3.598 -54.947 1.00 0.00 O ATOM 1124 CB MET A1842 11.605 -2.214 -55.439 1.00 0.00 C ATOM 1125 CG MET A1842 10.320 -1.387 -55.336 1.00 0.00 C ATOM 1126 SD MET A1842 9.246 -1.489 -56.788 1.00 0.00 S ATOM 1127 CE MET A1842 7.852 -0.500 -56.180 1.00 0.00 C ATOM 0 H MET A1842 13.974 -0.831 -54.456 1.00 0.00 H new ATOM 0 HA MET A1842 11.685 -2.289 -53.318 1.00 0.00 H new ATOM 0 HB2 MET A1842 12.221 -1.831 -56.253 1.00 0.00 H new ATOM 0 HB3 MET A1842 11.355 -3.246 -55.687 1.00 0.00 H new ATOM 0 HG2 MET A1842 9.760 -1.717 -54.461 1.00 0.00 H new ATOM 0 HG3 MET A1842 10.587 -0.343 -55.169 1.00 0.00 H new ATOM 0 HE1 MET A1842 7.080 -0.449 -56.948 1.00 0.00 H new ATOM 0 HE2 MET A1842 7.442 -0.963 -55.283 1.00 0.00 H new ATOM 0 HE3 MET A1842 8.196 0.507 -55.944 1.00 0.00 H new ATOM 1137 N VAL A1843 13.385 -4.068 -52.892 1.00 0.00 N ATOM 1138 CA VAL A1843 14.353 -5.135 -52.549 1.00 0.00 C ATOM 1139 C VAL A1843 14.190 -6.418 -53.384 1.00 0.00 C ATOM 1140 O VAL A1843 15.158 -7.158 -53.568 1.00 0.00 O ATOM 1141 CB VAL A1843 14.337 -5.474 -51.042 1.00 0.00 C ATOM 1142 CG1 VAL A1843 14.590 -4.222 -50.192 1.00 0.00 C ATOM 1143 CG2 VAL A1843 13.043 -6.132 -50.550 1.00 0.00 C ATOM 0 H VAL A1843 12.685 -3.921 -52.165 1.00 0.00 H new ATOM 0 HA VAL A1843 15.326 -4.715 -52.804 1.00 0.00 H new ATOM 0 HB VAL A1843 15.140 -6.201 -50.921 1.00 0.00 H new ATOM 0 HG11 VAL A1843 14.573 -4.490 -49.136 1.00 0.00 H new ATOM 0 HG12 VAL A1843 15.563 -3.802 -50.444 1.00 0.00 H new ATOM 0 HG13 VAL A1843 13.813 -3.484 -50.391 1.00 0.00 H new ATOM 0 HG21 VAL A1843 13.121 -6.334 -49.482 1.00 0.00 H new ATOM 0 HG22 VAL A1843 12.202 -5.462 -50.732 1.00 0.00 H new ATOM 0 HG23 VAL A1843 12.884 -7.068 -51.086 1.00 0.00 H new ATOM 1153 N SER A1844 12.988 -6.668 -53.918 1.00 0.00 N ATOM 1154 CA SER A1844 12.610 -7.850 -54.724 1.00 0.00 C ATOM 1155 C SER A1844 11.895 -7.491 -56.042 1.00 0.00 C ATOM 1156 O SER A1844 11.421 -8.369 -56.763 1.00 0.00 O ATOM 1157 CB SER A1844 11.734 -8.802 -53.896 1.00 0.00 C ATOM 1158 OG SER A1844 12.391 -9.228 -52.706 1.00 0.00 O ATOM 0 H SER A1844 12.208 -6.022 -53.797 1.00 0.00 H new ATOM 0 HA SER A1844 13.543 -8.343 -54.998 1.00 0.00 H new ATOM 0 HB2 SER A1844 10.800 -8.303 -53.637 1.00 0.00 H new ATOM 0 HB3 SER A1844 11.474 -9.672 -54.498 1.00 0.00 H new ATOM 0 HG SER A1844 11.802 -9.831 -52.205 1.00 0.00 H new ATOM 1164 N GLY A1845 11.782 -6.194 -56.364 1.00 0.00 N ATOM 1165 CA GLY A1845 11.035 -5.646 -57.508 1.00 0.00 C ATOM 1166 C GLY A1845 9.559 -5.343 -57.213 1.00 0.00 C ATOM 1167 O GLY A1845 8.873 -4.757 -58.053 1.00 0.00 O ATOM 0 H GLY A1845 12.229 -5.464 -55.809 1.00 0.00 H new ATOM 0 HA2 GLY A1845 11.523 -4.729 -57.840 1.00 0.00 H new ATOM 0 HA3 GLY A1845 11.090 -6.354 -58.335 1.00 0.00 H new ATOM 1171 N ASP A1846 9.063 -5.725 -56.030 1.00 0.00 N ATOM 1172 CA ASP A1846 7.688 -5.479 -55.557 1.00 0.00 C ATOM 1173 C ASP A1846 7.545 -5.246 -54.035 1.00 0.00 C ATOM 1174 O ASP A1846 6.446 -4.944 -53.558 1.00 0.00 O ATOM 1175 CB ASP A1846 6.771 -6.621 -56.039 1.00 0.00 C ATOM 1176 CG ASP A1846 7.173 -8.034 -55.575 1.00 0.00 C ATOM 1177 OD1 ASP A1846 7.848 -8.193 -54.530 1.00 0.00 O ATOM 1178 OD2 ASP A1846 6.787 -9.013 -56.255 1.00 0.00 O ATOM 0 H ASP A1846 9.626 -6.233 -55.348 1.00 0.00 H new ATOM 0 HA ASP A1846 7.381 -4.530 -55.997 1.00 0.00 H new ATOM 0 HB2 ASP A1846 5.757 -6.419 -55.695 1.00 0.00 H new ATOM 0 HB3 ASP A1846 6.746 -6.608 -57.129 1.00 0.00 H new ATOM 1183 N ARG A1847 8.647 -5.336 -53.270 1.00 0.00 N ATOM 1184 CA ARG A1847 8.695 -5.241 -51.792 1.00 0.00 C ATOM 1185 C ARG A1847 9.704 -4.210 -51.310 1.00 0.00 C ATOM 1186 O ARG A1847 10.689 -3.949 -51.996 1.00 0.00 O ATOM 1187 CB ARG A1847 9.020 -6.622 -51.192 1.00 0.00 C ATOM 1188 CG ARG A1847 7.802 -7.554 -51.194 1.00 0.00 C ATOM 1189 CD ARG A1847 8.241 -9.016 -51.060 1.00 0.00 C ATOM 1190 NE ARG A1847 7.091 -9.916 -50.861 1.00 0.00 N ATOM 1191 CZ ARG A1847 6.246 -10.358 -51.773 1.00 0.00 C ATOM 1192 NH1 ARG A1847 6.309 -10.011 -53.028 1.00 0.00 N ATOM 1193 NH2 ARG A1847 5.286 -11.163 -51.427 1.00 0.00 N ATOM 0 H ARG A1847 9.570 -5.483 -53.678 1.00 0.00 H new ATOM 0 HA ARG A1847 7.713 -4.911 -51.453 1.00 0.00 H new ATOM 0 HB2 ARG A1847 9.829 -7.082 -51.760 1.00 0.00 H new ATOM 0 HB3 ARG A1847 9.379 -6.497 -50.170 1.00 0.00 H new ATOM 0 HG2 ARG A1847 7.136 -7.292 -50.372 1.00 0.00 H new ATOM 0 HG3 ARG A1847 7.237 -7.421 -52.117 1.00 0.00 H new ATOM 0 HD2 ARG A1847 8.786 -9.315 -51.955 1.00 0.00 H new ATOM 0 HD3 ARG A1847 8.929 -9.114 -50.220 1.00 0.00 H new ATOM 0 HE ARG A1847 6.929 -10.235 -49.906 1.00 0.00 H new ATOM 0 HH11 ARG A1847 7.036 -9.369 -53.344 1.00 0.00 H new ATOM 0 HH12 ARG A1847 5.631 -10.381 -53.694 1.00 0.00 H new ATOM 0 HH21 ARG A1847 5.188 -11.451 -50.453 1.00 0.00 H new ATOM 0 HH22 ARG A1847 4.631 -11.507 -52.129 1.00 0.00 H new ATOM 1207 N ILE A1848 9.475 -3.639 -50.126 1.00 0.00 N ATOM 1208 CA ILE A1848 10.162 -2.445 -49.609 1.00 0.00 C ATOM 1209 C ILE A1848 10.490 -2.610 -48.115 1.00 0.00 C ATOM 1210 O ILE A1848 9.663 -3.092 -47.338 1.00 0.00 O ATOM 1211 CB ILE A1848 9.293 -1.186 -49.862 1.00 0.00 C ATOM 1212 CG1 ILE A1848 8.786 -1.052 -51.318 1.00 0.00 C ATOM 1213 CG2 ILE A1848 10.108 0.076 -49.525 1.00 0.00 C ATOM 1214 CD1 ILE A1848 7.408 -1.685 -51.551 1.00 0.00 C ATOM 0 H ILE A1848 8.782 -4.006 -49.474 1.00 0.00 H new ATOM 0 HA ILE A1848 11.107 -2.321 -50.139 1.00 0.00 H new ATOM 0 HB ILE A1848 8.418 -1.294 -49.221 1.00 0.00 H new ATOM 0 HG12 ILE A1848 8.740 0.005 -51.582 1.00 0.00 H new ATOM 0 HG13 ILE A1848 9.508 -1.517 -51.989 1.00 0.00 H new ATOM 0 HG21 ILE A1848 9.498 0.961 -49.703 1.00 0.00 H new ATOM 0 HG22 ILE A1848 10.408 0.046 -48.478 1.00 0.00 H new ATOM 0 HG23 ILE A1848 10.996 0.115 -50.156 1.00 0.00 H new ATOM 0 HD11 ILE A1848 7.118 -1.552 -52.593 1.00 0.00 H new ATOM 0 HD12 ILE A1848 7.453 -2.749 -51.320 1.00 0.00 H new ATOM 0 HD13 ILE A1848 6.673 -1.204 -50.906 1.00 0.00 H new ATOM 1226 N HIS A1849 11.705 -2.231 -47.719 1.00 0.00 N ATOM 1227 CA HIS A1849 12.263 -2.383 -46.369 1.00 0.00 C ATOM 1228 C HIS A1849 11.719 -1.372 -45.339 1.00 0.00 C ATOM 1229 O HIS A1849 11.636 -0.171 -45.596 1.00 0.00 O ATOM 1230 CB HIS A1849 13.791 -2.268 -46.491 1.00 0.00 C ATOM 1231 CG HIS A1849 14.540 -2.411 -45.191 1.00 0.00 C ATOM 1232 ND1 HIS A1849 15.479 -1.522 -44.730 1.00 0.00 N ATOM 1233 CD2 HIS A1849 14.464 -3.451 -44.303 1.00 0.00 C ATOM 1234 CE1 HIS A1849 15.971 -2.008 -43.582 1.00 0.00 C ATOM 1235 NE2 HIS A1849 15.370 -3.170 -43.274 1.00 0.00 N ATOM 0 H HIS A1849 12.362 -1.787 -48.361 1.00 0.00 H new ATOM 0 HA HIS A1849 11.958 -3.356 -45.983 1.00 0.00 H new ATOM 0 HB2 HIS A1849 14.145 -3.031 -47.184 1.00 0.00 H new ATOM 0 HB3 HIS A1849 14.035 -1.301 -46.930 1.00 0.00 H new ATOM 0 HD1 HIS A1849 15.753 -0.649 -45.180 1.00 0.00 H new ATOM 0 HD2 HIS A1849 13.828 -4.320 -44.382 1.00 0.00 H new ATOM 0 HE1 HIS A1849 16.740 -1.534 -42.990 1.00 0.00 H new ATOM 1243 N CYS A1850 11.426 -1.861 -44.128 1.00 0.00 N ATOM 1244 CA CYS A1850 10.869 -1.133 -42.982 1.00 0.00 C ATOM 1245 C CYS A1850 11.594 0.185 -42.670 1.00 0.00 C ATOM 1246 O CYS A1850 10.963 1.244 -42.631 1.00 0.00 O ATOM 1247 CB CYS A1850 10.881 -2.088 -41.778 1.00 0.00 C ATOM 1248 SG CYS A1850 10.039 -1.347 -40.353 1.00 0.00 S ATOM 0 H CYS A1850 11.583 -2.845 -43.908 1.00 0.00 H new ATOM 0 HA CYS A1850 9.852 -0.826 -43.225 1.00 0.00 H new ATOM 0 HB2 CYS A1850 10.392 -3.024 -42.047 1.00 0.00 H new ATOM 0 HB3 CYS A1850 11.910 -2.330 -41.512 1.00 0.00 H new ATOM 0 HG CYS A1850 8.780 -1.671 -40.376 1.00 0.00 H new ATOM 1254 N MET A1851 12.914 0.147 -42.454 1.00 0.00 N ATOM 1255 CA MET A1851 13.688 1.331 -42.058 1.00 0.00 C ATOM 1256 C MET A1851 13.699 2.418 -43.142 1.00 0.00 C ATOM 1257 O MET A1851 13.655 3.605 -42.825 1.00 0.00 O ATOM 1258 CB MET A1851 15.126 0.934 -41.687 1.00 0.00 C ATOM 1259 CG MET A1851 15.927 2.100 -41.094 1.00 0.00 C ATOM 1260 SD MET A1851 15.239 2.801 -39.566 1.00 0.00 S ATOM 1261 CE MET A1851 15.822 4.510 -39.713 1.00 0.00 C ATOM 0 H MET A1851 13.474 -0.700 -42.548 1.00 0.00 H new ATOM 0 HA MET A1851 13.193 1.755 -41.184 1.00 0.00 H new ATOM 0 HB2 MET A1851 15.099 0.115 -40.969 1.00 0.00 H new ATOM 0 HB3 MET A1851 15.637 0.562 -42.575 1.00 0.00 H new ATOM 0 HG2 MET A1851 16.943 1.760 -40.895 1.00 0.00 H new ATOM 0 HG3 MET A1851 15.996 2.891 -41.841 1.00 0.00 H new ATOM 0 HE1 MET A1851 15.486 5.085 -38.850 1.00 0.00 H new ATOM 0 HE2 MET A1851 16.911 4.521 -39.754 1.00 0.00 H new ATOM 0 HE3 MET A1851 15.421 4.954 -40.624 1.00 0.00 H new ATOM 1271 N ASP A1852 13.737 2.038 -44.422 1.00 0.00 N ATOM 1272 CA ASP A1852 13.691 2.984 -45.549 1.00 0.00 C ATOM 1273 C ASP A1852 12.319 3.672 -45.668 1.00 0.00 C ATOM 1274 O ASP A1852 12.252 4.874 -45.934 1.00 0.00 O ATOM 1275 CB ASP A1852 14.066 2.267 -46.846 1.00 0.00 C ATOM 1276 CG ASP A1852 15.550 1.868 -46.846 1.00 0.00 C ATOM 1277 OD1 ASP A1852 15.893 0.799 -46.286 1.00 0.00 O ATOM 1278 OD2 ASP A1852 16.376 2.636 -47.391 1.00 0.00 O ATOM 0 H ASP A1852 13.801 1.062 -44.711 1.00 0.00 H new ATOM 0 HA ASP A1852 14.420 3.772 -45.359 1.00 0.00 H new ATOM 0 HB2 ASP A1852 13.447 1.378 -46.966 1.00 0.00 H new ATOM 0 HB3 ASP A1852 13.860 2.916 -47.697 1.00 0.00 H new ATOM 1283 N ILE A1853 11.232 2.941 -45.392 1.00 0.00 N ATOM 1284 CA ILE A1853 9.868 3.500 -45.292 1.00 0.00 C ATOM 1285 C ILE A1853 9.765 4.474 -44.115 1.00 0.00 C ATOM 1286 O ILE A1853 9.292 5.598 -44.295 1.00 0.00 O ATOM 1287 CB ILE A1853 8.803 2.383 -45.200 1.00 0.00 C ATOM 1288 CG1 ILE A1853 8.856 1.479 -46.453 1.00 0.00 C ATOM 1289 CG2 ILE A1853 7.390 2.988 -45.094 1.00 0.00 C ATOM 1290 CD1 ILE A1853 8.175 0.125 -46.246 1.00 0.00 C ATOM 0 H ILE A1853 11.269 1.935 -45.229 1.00 0.00 H new ATOM 0 HA ILE A1853 9.667 4.059 -46.206 1.00 0.00 H new ATOM 0 HB ILE A1853 9.019 1.793 -44.309 1.00 0.00 H new ATOM 0 HG12 ILE A1853 8.379 1.995 -47.286 1.00 0.00 H new ATOM 0 HG13 ILE A1853 9.897 1.316 -46.732 1.00 0.00 H new ATOM 0 HG21 ILE A1853 6.655 2.186 -45.030 1.00 0.00 H new ATOM 0 HG22 ILE A1853 7.327 3.610 -44.201 1.00 0.00 H new ATOM 0 HG23 ILE A1853 7.188 3.596 -45.975 1.00 0.00 H new ATOM 0 HD11 ILE A1853 8.247 -0.462 -47.162 1.00 0.00 H new ATOM 0 HD12 ILE A1853 8.667 -0.409 -45.433 1.00 0.00 H new ATOM 0 HD13 ILE A1853 7.126 0.280 -45.996 1.00 0.00 H new ATOM 1302 N LEU A1854 10.257 4.084 -42.930 1.00 0.00 N ATOM 1303 CA LEU A1854 10.329 4.959 -41.760 1.00 0.00 C ATOM 1304 C LEU A1854 11.103 6.249 -42.082 1.00 0.00 C ATOM 1305 O LEU A1854 10.583 7.339 -41.859 1.00 0.00 O ATOM 1306 CB LEU A1854 10.922 4.192 -40.559 1.00 0.00 C ATOM 1307 CG LEU A1854 11.100 5.041 -39.283 1.00 0.00 C ATOM 1308 CD1 LEU A1854 9.786 5.626 -38.755 1.00 0.00 C ATOM 1309 CD2 LEU A1854 11.698 4.186 -38.166 1.00 0.00 C ATOM 0 H LEU A1854 10.618 3.145 -42.760 1.00 0.00 H new ATOM 0 HA LEU A1854 9.321 5.268 -41.482 1.00 0.00 H new ATOM 0 HB2 LEU A1854 10.275 3.345 -40.330 1.00 0.00 H new ATOM 0 HB3 LEU A1854 11.891 3.784 -40.847 1.00 0.00 H new ATOM 0 HG LEU A1854 11.758 5.864 -39.564 1.00 0.00 H new ATOM 0 HD11 LEU A1854 9.983 6.211 -37.857 1.00 0.00 H new ATOM 0 HD12 LEU A1854 9.342 6.267 -39.516 1.00 0.00 H new ATOM 0 HD13 LEU A1854 9.097 4.816 -38.516 1.00 0.00 H new ATOM 0 HD21 LEU A1854 11.820 4.793 -37.269 1.00 0.00 H new ATOM 0 HD22 LEU A1854 11.032 3.351 -37.951 1.00 0.00 H new ATOM 0 HD23 LEU A1854 12.669 3.804 -38.481 1.00 0.00 H new ATOM 1321 N PHE A1855 12.308 6.137 -42.649 1.00 0.00 N ATOM 1322 CA PHE A1855 13.163 7.260 -43.055 1.00 0.00 C ATOM 1323 C PHE A1855 12.479 8.215 -44.053 1.00 0.00 C ATOM 1324 O PHE A1855 12.554 9.437 -43.899 1.00 0.00 O ATOM 1325 CB PHE A1855 14.466 6.675 -43.622 1.00 0.00 C ATOM 1326 CG PHE A1855 15.555 7.670 -43.983 1.00 0.00 C ATOM 1327 CD1 PHE A1855 16.217 8.392 -42.971 1.00 0.00 C ATOM 1328 CD2 PHE A1855 15.968 7.810 -45.320 1.00 0.00 C ATOM 1329 CE1 PHE A1855 17.304 9.226 -43.297 1.00 0.00 C ATOM 1330 CE2 PHE A1855 17.057 8.639 -45.642 1.00 0.00 C ATOM 1331 CZ PHE A1855 17.730 9.343 -44.631 1.00 0.00 C ATOM 0 H PHE A1855 12.731 5.230 -42.846 1.00 0.00 H new ATOM 0 HA PHE A1855 13.373 7.880 -42.183 1.00 0.00 H new ATOM 0 HB2 PHE A1855 14.872 5.975 -42.892 1.00 0.00 H new ATOM 0 HB3 PHE A1855 14.221 6.098 -44.514 1.00 0.00 H new ATOM 0 HD1 PHE A1855 15.891 8.306 -41.945 1.00 0.00 H new ATOM 0 HD2 PHE A1855 15.447 7.279 -46.102 1.00 0.00 H new ATOM 0 HE1 PHE A1855 17.812 9.777 -42.519 1.00 0.00 H new ATOM 0 HE2 PHE A1855 17.376 8.734 -46.669 1.00 0.00 H new ATOM 0 HZ PHE A1855 18.572 9.972 -44.878 1.00 0.00 H new ATOM 1341 N ALA A1856 11.759 7.687 -45.049 1.00 0.00 N ATOM 1342 CA ALA A1856 10.935 8.486 -45.957 1.00 0.00 C ATOM 1343 C ALA A1856 9.770 9.199 -45.230 1.00 0.00 C ATOM 1344 O ALA A1856 9.537 10.393 -45.451 1.00 0.00 O ATOM 1345 CB ALA A1856 10.428 7.587 -47.091 1.00 0.00 C ATOM 0 H ALA A1856 11.733 6.687 -45.247 1.00 0.00 H new ATOM 0 HA ALA A1856 11.552 9.282 -46.373 1.00 0.00 H new ATOM 0 HB1 ALA A1856 9.813 8.174 -47.773 1.00 0.00 H new ATOM 0 HB2 ALA A1856 11.277 7.172 -47.634 1.00 0.00 H new ATOM 0 HB3 ALA A1856 9.833 6.775 -46.673 1.00 0.00 H new ATOM 1351 N PHE A1857 9.043 8.500 -44.348 1.00 0.00 N ATOM 1352 CA PHE A1857 7.882 9.056 -43.634 1.00 0.00 C ATOM 1353 C PHE A1857 8.295 10.099 -42.579 1.00 0.00 C ATOM 1354 O PHE A1857 7.599 11.099 -42.425 1.00 0.00 O ATOM 1355 CB PHE A1857 7.032 7.932 -43.014 1.00 0.00 C ATOM 1356 CG PHE A1857 6.233 7.031 -43.963 1.00 0.00 C ATOM 1357 CD1 PHE A1857 6.444 7.004 -45.362 1.00 0.00 C ATOM 1358 CD2 PHE A1857 5.245 6.187 -43.414 1.00 0.00 C ATOM 1359 CE1 PHE A1857 5.700 6.137 -46.182 1.00 0.00 C ATOM 1360 CE2 PHE A1857 4.500 5.317 -44.235 1.00 0.00 C ATOM 1361 CZ PHE A1857 4.732 5.293 -45.620 1.00 0.00 C ATOM 0 H PHE A1857 9.243 7.529 -44.108 1.00 0.00 H new ATOM 0 HA PHE A1857 7.268 9.579 -44.367 1.00 0.00 H new ATOM 0 HB2 PHE A1857 7.695 7.296 -42.428 1.00 0.00 H new ATOM 0 HB3 PHE A1857 6.330 8.389 -42.317 1.00 0.00 H new ATOM 0 HD1 PHE A1857 7.183 7.655 -45.804 1.00 0.00 H new ATOM 0 HD2 PHE A1857 5.057 6.208 -42.351 1.00 0.00 H new ATOM 0 HE1 PHE A1857 5.875 6.121 -47.248 1.00 0.00 H new ATOM 0 HE2 PHE A1857 3.752 4.670 -43.800 1.00 0.00 H new ATOM 0 HZ PHE A1857 4.165 4.625 -46.251 1.00 0.00 H new ATOM 1371 N THR A1858 9.435 9.944 -41.892 1.00 0.00 N ATOM 1372 CA THR A1858 9.986 10.986 -41.002 1.00 0.00 C ATOM 1373 C THR A1858 10.477 12.215 -41.774 1.00 0.00 C ATOM 1374 O THR A1858 10.204 13.333 -41.348 1.00 0.00 O ATOM 1375 CB THR A1858 11.102 10.474 -40.082 1.00 0.00 C ATOM 1376 OG1 THR A1858 12.173 9.923 -40.814 1.00 0.00 O ATOM 1377 CG2 THR A1858 10.600 9.415 -39.098 1.00 0.00 C ATOM 0 H THR A1858 10.003 9.098 -41.934 1.00 0.00 H new ATOM 0 HA THR A1858 9.147 11.281 -40.372 1.00 0.00 H new ATOM 0 HB THR A1858 11.446 11.347 -39.527 1.00 0.00 H new ATOM 0 HG1 THR A1858 11.877 9.102 -41.260 1.00 0.00 H new ATOM 0 HG21 THR A1858 11.425 9.083 -38.468 1.00 0.00 H new ATOM 0 HG22 THR A1858 9.816 9.842 -38.473 1.00 0.00 H new ATOM 0 HG23 THR A1858 10.201 8.565 -39.651 1.00 0.00 H new ATOM 1385 N LYS A1859 11.099 12.054 -42.952 1.00 0.00 N ATOM 1386 CA LYS A1859 11.410 13.169 -43.877 1.00 0.00 C ATOM 1387 C LYS A1859 10.170 13.963 -44.302 1.00 0.00 C ATOM 1388 O LYS A1859 10.217 15.195 -44.328 1.00 0.00 O ATOM 1389 CB LYS A1859 12.180 12.648 -45.104 1.00 0.00 C ATOM 1390 CG LYS A1859 13.663 12.470 -44.761 1.00 0.00 C ATOM 1391 CD LYS A1859 14.456 11.925 -45.957 1.00 0.00 C ATOM 1392 CE LYS A1859 15.952 11.865 -45.630 1.00 0.00 C ATOM 1393 NZ LYS A1859 16.602 13.203 -45.643 1.00 0.00 N ATOM 0 H LYS A1859 11.404 11.144 -43.297 1.00 0.00 H new ATOM 0 HA LYS A1859 12.042 13.867 -43.328 1.00 0.00 H new ATOM 0 HB2 LYS A1859 11.758 11.698 -45.431 1.00 0.00 H new ATOM 0 HB3 LYS A1859 12.072 13.347 -45.934 1.00 0.00 H new ATOM 0 HG2 LYS A1859 14.083 13.427 -44.450 1.00 0.00 H new ATOM 0 HG3 LYS A1859 13.763 11.789 -43.916 1.00 0.00 H new ATOM 0 HD2 LYS A1859 14.095 10.930 -46.217 1.00 0.00 H new ATOM 0 HD3 LYS A1859 14.294 12.560 -46.828 1.00 0.00 H new ATOM 0 HE2 LYS A1859 16.086 11.411 -44.648 1.00 0.00 H new ATOM 0 HE3 LYS A1859 16.451 11.217 -46.351 1.00 0.00 H new ATOM 0 HZ1 LYS A1859 17.615 13.099 -45.432 1.00 0.00 H new ATOM 0 HZ2 LYS A1859 16.486 13.636 -46.582 1.00 0.00 H new ATOM 0 HZ3 LYS A1859 16.160 13.811 -44.924 1.00 0.00 H new ATOM 1407 N ARG A1860 9.043 13.280 -44.535 1.00 0.00 N ATOM 1408 CA ARG A1860 7.704 13.862 -44.760 1.00 0.00 C ATOM 1409 C ARG A1860 7.168 14.670 -43.565 1.00 0.00 C ATOM 1410 O ARG A1860 6.329 15.550 -43.768 1.00 0.00 O ATOM 1411 CB ARG A1860 6.769 12.735 -45.263 1.00 0.00 C ATOM 1412 CG ARG A1860 5.252 12.978 -45.208 1.00 0.00 C ATOM 1413 CD ARG A1860 4.649 12.656 -43.824 1.00 0.00 C ATOM 1414 NE ARG A1860 3.233 13.040 -43.717 1.00 0.00 N ATOM 1415 CZ ARG A1860 2.721 14.248 -43.563 1.00 0.00 C ATOM 1416 NH1 ARG A1860 3.437 15.343 -43.571 1.00 0.00 N ATOM 1417 NH2 ARG A1860 1.434 14.364 -43.402 1.00 0.00 N ATOM 0 H ARG A1860 9.033 12.261 -44.575 1.00 0.00 H new ATOM 0 HA ARG A1860 7.763 14.627 -45.534 1.00 0.00 H new ATOM 0 HB2 ARG A1860 7.035 12.517 -46.297 1.00 0.00 H new ATOM 0 HB3 ARG A1860 6.985 11.838 -44.683 1.00 0.00 H new ATOM 0 HG2 ARG A1860 5.045 14.019 -45.457 1.00 0.00 H new ATOM 0 HG3 ARG A1860 4.762 12.366 -45.965 1.00 0.00 H new ATOM 0 HD2 ARG A1860 4.747 11.588 -43.629 1.00 0.00 H new ATOM 0 HD3 ARG A1860 5.221 13.174 -43.054 1.00 0.00 H new ATOM 0 HE ARG A1860 2.560 12.275 -43.768 1.00 0.00 H new ATOM 0 HH11 ARG A1860 4.447 15.291 -43.701 1.00 0.00 H new ATOM 0 HH12 ARG A1860 2.985 16.249 -43.447 1.00 0.00 H new ATOM 0 HH21 ARG A1860 0.844 13.532 -43.397 1.00 0.00 H new ATOM 0 HH22 ARG A1860 1.016 15.287 -43.281 1.00 0.00 H new ATOM 1431 N VAL A1861 7.628 14.417 -42.337 1.00 0.00 N ATOM 1432 CA VAL A1861 7.322 15.231 -41.136 1.00 0.00 C ATOM 1433 C VAL A1861 8.291 16.413 -41.000 1.00 0.00 C ATOM 1434 O VAL A1861 7.860 17.540 -40.748 1.00 0.00 O ATOM 1435 CB VAL A1861 7.332 14.372 -39.851 1.00 0.00 C ATOM 1436 CG1 VAL A1861 7.020 15.202 -38.599 1.00 0.00 C ATOM 1437 CG2 VAL A1861 6.288 13.252 -39.943 1.00 0.00 C ATOM 0 H VAL A1861 8.238 13.625 -42.135 1.00 0.00 H new ATOM 0 HA VAL A1861 6.316 15.629 -41.267 1.00 0.00 H new ATOM 0 HB VAL A1861 8.337 13.958 -39.766 1.00 0.00 H new ATOM 0 HG11 VAL A1861 7.038 14.557 -37.721 1.00 0.00 H new ATOM 0 HG12 VAL A1861 7.768 15.987 -38.488 1.00 0.00 H new ATOM 0 HG13 VAL A1861 6.032 15.652 -38.698 1.00 0.00 H new ATOM 0 HG21 VAL A1861 6.310 12.658 -39.029 1.00 0.00 H new ATOM 0 HG22 VAL A1861 5.297 13.688 -40.069 1.00 0.00 H new ATOM 0 HG23 VAL A1861 6.514 12.613 -40.797 1.00 0.00 H new