USER MOD reduce.3.24.130724 H: found=0, std=0, add=941, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 942 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 Set 1.1: A 393 LYS NZ :NH3+ -169:sc= -5.34! (180deg=-4.93!) USER MOD Set 1.2: A 408 LYS NZ :NH3+ -143:sc= -0.997 (180deg=0) USER MOD Single : A 378 TYR OH : rot 180:sc= 0 USER MOD Single : A 380 LYS NZ :NH3+ -154:sc= -0.284 (180deg=-1.47!) USER MOD Single : A 383 LYS NZ :NH3+ -162:sc= -0.657 (180deg=-1.47!) USER MOD Single : A 385 LYS NZ :NH3+ 157:sc= -0.859 (180deg=-1.67!) USER MOD Single : A 386 LYS NZ :NH3+ 180:sc= -0.0047 (180deg=-0.0047) USER MOD Single : A 388 THR OG1 : rot 180:sc= 0 USER MOD Single : A 390 LYS NZ :NH3+ -166:sc= -0.0118 (180deg=-0.217) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 394 GLN :FLIP amide:sc= -0.0179 F(o=-1.8!,f=-0.018) USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 397 CYS SG : rot -102:sc= -0.655! USER MOD Single : A 398 THR OG1 : rot 180:sc= 0 USER MOD Single : A 400 LYS NZ :NH3+ -112:sc= -0.565 (180deg=-3.86!) USER MOD Single : A 402 THR OG1 : rot -41:sc= 0.846 USER MOD Single : A 403 SER OG : rot 180:sc= 0 USER MOD Single : A 405 SER OG : rot 108:sc= 0.195 USER MOD Single : A 406 CYS SG : rot 68:sc= 1.52 USER MOD Single : A 407 TYR OH : rot 180:sc= 0 USER MOD Single : A 409 SER OG : rot 180:sc= 0 USER MOD Single : A 419 HIS : no HD1:sc= 0.195 K(o=0.2,f=-2.5!) USER MOD Single : A 420 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 421 MET CE :methyl 171:sc= 0 (180deg=-0.147) USER MOD Single : A 422 ASN : amide:sc= 0.0983 K(o=0.098,f=-5.4!) USER MOD Single : A 426 CYS SG : rot 180:sc= -1.36 USER MOD Single : A 429 THR OG1 : rot 180:sc= -0.226 USER MOD Single : A 433 ASN : amide:sc=-0.00683 K(o=-0.0068,f=-0.93) USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 437 GLN :FLIP amide:sc= -0.419 F(o=-2.2,f=-0.42) USER MOD Single : A 438 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 440 ASN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 442 LYS NZ :NH3+ -129:sc= -0.327 (180deg=-2.3!) USER MOD Single : A 451 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 452 ASN :FLIP amide:sc= -1.31 F(o=-2.4!,f=-1.3) USER MOD Single : A 458 CYS SG : rot 180:sc= 0.202 USER MOD Single : A 460 ASN : amide:sc= -1.17! C(o=-1.2!,f=-7.6!) USER MOD Single : A 462 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 463 GLN :FLIP amide:sc= 0.0356 F(o=-2.1!,f=0.036) USER MOD Single : A 464 TYR OH : rot 165:sc= -0.208 USER MOD Single : A 466 HIS : no HD1:sc= -0.765 K(o=-0.77,f=-1.6!) USER MOD Single : A 468 MET CE :methyl 152:sc= -1.49 (180deg=-4.22!) USER MOD Single : A 471 CYS SG : rot -28:sc= -3.7! USER MOD Single : A 475 SER OG : rot 98:sc= 0.927 USER MOD Single : A 476 LYS NZ :NH3+ -139:sc= -1.29 (180deg=-3.65!) USER MOD Single : A 478 LYS NZ :NH3+ -139:sc= -0.0866 (180deg=-0.193) USER MOD Single : A 479 THR OG1 : rot 135:sc= 1.6 USER MOD Single : A 480 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 483 SER OG : rot 180:sc= 0 USER MOD Single : A 484 SER OG : rot 120:sc= -0.0095 USER MOD Single : A 485 TYR OH : rot 180:sc= 0 USER MOD Single : A 486 ASN : amide:sc= -0.067 K(o=-0.067,f=-1.1) USER MOD Single : A 490 GLN : amide:sc= -0.474 K(o=-0.47,f=-3.6!) USER MOD Single : A 491 ASN : amide:sc= -2.24 K(o=-2.2,f=-2.9!) USER MOD Single : A 494 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 119 N ILE A 372 3.203 -16.062 7.248 1.00 0.00 N ATOM 120 CA ILE A 372 4.690 -16.163 7.291 1.00 0.00 C ATOM 121 C ILE A 372 5.306 -14.838 6.813 1.00 0.00 C ATOM 122 O ILE A 372 6.264 -14.359 7.388 1.00 0.00 O ATOM 123 CB ILE A 372 5.181 -17.342 6.411 1.00 0.00 C ATOM 124 CG1 ILE A 372 4.051 -18.372 6.263 1.00 0.00 C ATOM 125 CG2 ILE A 372 6.400 -18.010 7.063 1.00 0.00 C ATOM 126 CD1 ILE A 372 4.570 -19.628 5.566 1.00 0.00 C ATOM 0 HA ILE A 372 5.007 -16.354 8.316 1.00 0.00 H new ATOM 0 HB ILE A 372 5.464 -16.963 5.429 1.00 0.00 H new ATOM 0 HG12 ILE A 372 3.653 -18.630 7.245 1.00 0.00 H new ATOM 0 HG13 ILE A 372 3.230 -17.942 5.689 1.00 0.00 H new ATOM 0 HG21 ILE A 372 6.739 -18.837 6.439 1.00 0.00 H new ATOM 0 HG22 ILE A 372 7.203 -17.280 7.166 1.00 0.00 H new ATOM 0 HG23 ILE A 372 6.125 -18.388 8.048 1.00 0.00 H new ATOM 0 HD11 ILE A 372 3.760 -20.350 5.467 1.00 0.00 H new ATOM 0 HD12 ILE A 372 4.946 -19.366 4.577 1.00 0.00 H new ATOM 0 HD13 ILE A 372 5.376 -20.065 6.156 1.00 0.00 H new ATOM 138 N PRO A 373 4.765 -14.243 5.775 1.00 0.00 N ATOM 139 CA PRO A 373 5.267 -12.965 5.226 1.00 0.00 C ATOM 140 C PRO A 373 4.419 -11.777 5.696 1.00 0.00 C ATOM 141 O PRO A 373 3.436 -11.428 5.072 1.00 0.00 O ATOM 142 CB PRO A 373 5.094 -13.189 3.724 1.00 0.00 C ATOM 143 CG PRO A 373 3.847 -14.036 3.603 1.00 0.00 C ATOM 144 CD PRO A 373 3.616 -14.703 4.982 1.00 0.00 C ATOM 0 HA PRO A 373 6.285 -12.726 5.535 1.00 0.00 H new ATOM 0 HB2 PRO A 373 4.984 -12.244 3.193 1.00 0.00 H new ATOM 0 HB3 PRO A 373 5.960 -13.695 3.297 1.00 0.00 H new ATOM 0 HG2 PRO A 373 2.990 -13.423 3.323 1.00 0.00 H new ATOM 0 HG3 PRO A 373 3.967 -14.790 2.825 1.00 0.00 H new ATOM 0 HD2 PRO A 373 2.670 -14.392 5.426 1.00 0.00 H new ATOM 0 HD3 PRO A 373 3.590 -15.790 4.904 1.00 0.00 H new ATOM 152 N GLU A 374 4.771 -11.163 6.799 1.00 0.00 N ATOM 153 CA GLU A 374 3.957 -10.015 7.310 1.00 0.00 C ATOM 154 C GLU A 374 4.547 -8.672 6.853 1.00 0.00 C ATOM 155 O GLU A 374 5.690 -8.351 7.114 1.00 0.00 O ATOM 156 CB GLU A 374 3.899 -10.074 8.845 1.00 0.00 C ATOM 157 CG GLU A 374 5.219 -9.586 9.451 1.00 0.00 C ATOM 158 CD GLU A 374 5.300 -10.015 10.918 1.00 0.00 C ATOM 159 OE1 GLU A 374 4.995 -11.163 11.197 1.00 0.00 O ATOM 160 OE2 GLU A 374 5.665 -9.188 11.737 1.00 0.00 O ATOM 0 H GLU A 374 5.583 -11.405 7.366 1.00 0.00 H new ATOM 0 HA GLU A 374 2.949 -10.093 6.902 1.00 0.00 H new ATOM 0 HB2 GLU A 374 3.076 -9.458 9.208 1.00 0.00 H new ATOM 0 HB3 GLU A 374 3.699 -11.096 9.168 1.00 0.00 H new ATOM 0 HG2 GLU A 374 6.061 -9.998 8.894 1.00 0.00 H new ATOM 0 HG3 GLU A 374 5.287 -8.501 9.375 1.00 0.00 H new ATOM 167 N LEU A 375 3.746 -7.882 6.191 1.00 0.00 N ATOM 168 CA LEU A 375 4.188 -6.533 5.724 1.00 0.00 C ATOM 169 C LEU A 375 2.950 -5.635 5.757 1.00 0.00 C ATOM 170 O LEU A 375 2.034 -5.804 4.978 1.00 0.00 O ATOM 171 CB LEU A 375 4.766 -6.637 4.288 1.00 0.00 C ATOM 172 CG LEU A 375 5.220 -5.262 3.703 1.00 0.00 C ATOM 173 CD1 LEU A 375 4.074 -4.580 2.940 1.00 0.00 C ATOM 174 CD2 LEU A 375 5.732 -4.311 4.798 1.00 0.00 C ATOM 0 H LEU A 375 2.784 -8.118 5.949 1.00 0.00 H new ATOM 0 HA LEU A 375 4.974 -6.123 6.358 1.00 0.00 H new ATOM 0 HB2 LEU A 375 5.616 -7.319 4.295 1.00 0.00 H new ATOM 0 HB3 LEU A 375 4.013 -7.072 3.631 1.00 0.00 H new ATOM 0 HG LEU A 375 6.039 -5.474 3.016 1.00 0.00 H new ATOM 0 HD11 LEU A 375 4.418 -3.625 2.544 1.00 0.00 H new ATOM 0 HD12 LEU A 375 3.753 -5.220 2.118 1.00 0.00 H new ATOM 0 HD13 LEU A 375 3.236 -4.411 3.617 1.00 0.00 H new ATOM 0 HD21 LEU A 375 6.037 -3.367 4.347 1.00 0.00 H new ATOM 0 HD22 LEU A 375 4.937 -4.127 5.521 1.00 0.00 H new ATOM 0 HD23 LEU A 375 6.585 -4.764 5.304 1.00 0.00 H new ATOM 186 N ALA A 376 2.898 -4.695 6.663 1.00 0.00 N ATOM 187 CA ALA A 376 1.698 -3.813 6.747 1.00 0.00 C ATOM 188 C ALA A 376 2.083 -2.461 7.350 1.00 0.00 C ATOM 189 O ALA A 376 3.142 -2.300 7.924 1.00 0.00 O ATOM 190 CB ALA A 376 0.637 -4.489 7.623 1.00 0.00 C ATOM 0 H ALA A 376 3.631 -4.500 7.345 1.00 0.00 H new ATOM 0 HA ALA A 376 1.297 -3.650 5.747 1.00 0.00 H new ATOM 0 HB1 ALA A 376 -0.243 -3.849 7.688 1.00 0.00 H new ATOM 0 HB2 ALA A 376 0.358 -5.446 7.183 1.00 0.00 H new ATOM 0 HB3 ALA A 376 1.041 -4.653 8.622 1.00 0.00 H new ATOM 196 N ASP A 377 1.227 -1.486 7.216 1.00 0.00 N ATOM 197 CA ASP A 377 1.532 -0.139 7.771 1.00 0.00 C ATOM 198 C ASP A 377 0.242 0.687 7.844 1.00 0.00 C ATOM 199 O ASP A 377 -0.775 0.327 7.284 1.00 0.00 O ATOM 200 CB ASP A 377 2.546 0.562 6.863 1.00 0.00 C ATOM 201 CG ASP A 377 1.924 0.781 5.491 1.00 0.00 C ATOM 202 OD1 ASP A 377 0.868 0.221 5.248 1.00 0.00 O ATOM 203 OD2 ASP A 377 2.512 1.505 4.704 1.00 0.00 O ATOM 0 H ASP A 377 0.326 -1.565 6.744 1.00 0.00 H new ATOM 0 HA ASP A 377 1.951 -0.239 8.772 1.00 0.00 H new ATOM 0 HB2 ASP A 377 2.842 1.517 7.298 1.00 0.00 H new ATOM 0 HB3 ASP A 377 3.450 -0.041 6.774 1.00 0.00 H new ATOM 208 N TYR A 378 0.286 1.800 8.524 1.00 0.00 N ATOM 209 CA TYR A 378 -0.916 2.681 8.643 1.00 0.00 C ATOM 210 C TYR A 378 -0.879 3.642 7.459 1.00 0.00 C ATOM 211 O TYR A 378 0.173 4.126 7.094 1.00 0.00 O ATOM 212 CB TYR A 378 -0.878 3.460 9.987 1.00 0.00 C ATOM 213 CG TYR A 378 0.457 3.248 10.675 1.00 0.00 C ATOM 214 CD1 TYR A 378 0.802 1.973 11.141 1.00 0.00 C ATOM 215 CD2 TYR A 378 1.348 4.317 10.841 1.00 0.00 C ATOM 216 CE1 TYR A 378 2.033 1.766 11.774 1.00 0.00 C ATOM 217 CE2 TYR A 378 2.580 4.109 11.475 1.00 0.00 C ATOM 218 CZ TYR A 378 2.923 2.833 11.940 1.00 0.00 C ATOM 219 OH TYR A 378 4.137 2.627 12.565 1.00 0.00 O ATOM 0 H TYR A 378 1.115 2.143 9.010 1.00 0.00 H new ATOM 0 HA TYR A 378 -1.836 2.096 8.633 1.00 0.00 H new ATOM 0 HB2 TYR A 378 -1.037 4.523 9.805 1.00 0.00 H new ATOM 0 HB3 TYR A 378 -1.687 3.123 10.635 1.00 0.00 H new ATOM 0 HD1 TYR A 378 0.117 1.148 11.012 1.00 0.00 H new ATOM 0 HD2 TYR A 378 1.085 5.301 10.480 1.00 0.00 H new ATOM 0 HE1 TYR A 378 2.296 0.782 12.134 1.00 0.00 H new ATOM 0 HE2 TYR A 378 3.266 4.933 11.605 1.00 0.00 H new ATOM 0 HH TYR A 378 4.635 3.470 12.598 1.00 0.00 H new ATOM 229 N ILE A 379 -1.991 3.893 6.819 1.00 0.00 N ATOM 230 CA ILE A 379 -1.953 4.785 5.624 1.00 0.00 C ATOM 231 C ILE A 379 -3.242 5.602 5.497 1.00 0.00 C ATOM 232 O ILE A 379 -4.330 5.125 5.746 1.00 0.00 O ATOM 233 CB ILE A 379 -1.730 3.860 4.393 1.00 0.00 C ATOM 234 CG1 ILE A 379 -0.274 3.976 3.916 1.00 0.00 C ATOM 235 CG2 ILE A 379 -2.667 4.215 3.223 1.00 0.00 C ATOM 236 CD1 ILE A 379 0.121 2.752 3.080 1.00 0.00 C ATOM 0 H ILE A 379 -2.910 3.526 7.067 1.00 0.00 H new ATOM 0 HA ILE A 379 -1.149 5.517 5.705 1.00 0.00 H new ATOM 0 HB ILE A 379 -1.952 2.841 4.709 1.00 0.00 H new ATOM 0 HG12 ILE A 379 -0.151 4.883 3.323 1.00 0.00 H new ATOM 0 HG13 ILE A 379 0.390 4.065 4.776 1.00 0.00 H new ATOM 0 HG21 ILE A 379 -2.475 3.543 2.386 1.00 0.00 H new ATOM 0 HG22 ILE A 379 -3.704 4.110 3.542 1.00 0.00 H new ATOM 0 HG23 ILE A 379 -2.486 5.244 2.911 1.00 0.00 H new ATOM 0 HD11 ILE A 379 1.155 2.854 2.752 1.00 0.00 H new ATOM 0 HD12 ILE A 379 0.019 1.850 3.684 1.00 0.00 H new ATOM 0 HD13 ILE A 379 -0.530 2.681 2.209 1.00 0.00 H new ATOM 248 N LYS A 380 -3.100 6.837 5.067 1.00 0.00 N ATOM 249 CA LYS A 380 -4.278 7.737 4.859 1.00 0.00 C ATOM 250 C LYS A 380 -4.307 8.093 3.377 1.00 0.00 C ATOM 251 O LYS A 380 -3.365 8.636 2.850 1.00 0.00 O ATOM 252 CB LYS A 380 -4.173 9.026 5.728 1.00 0.00 C ATOM 253 CG LYS A 380 -2.816 9.106 6.447 1.00 0.00 C ATOM 254 CD LYS A 380 -2.798 8.156 7.663 1.00 0.00 C ATOM 255 CE LYS A 380 -3.434 8.825 8.893 1.00 0.00 C ATOM 256 NZ LYS A 380 -2.769 10.131 9.172 1.00 0.00 N ATOM 0 H LYS A 380 -2.200 7.264 4.848 1.00 0.00 H new ATOM 0 HA LYS A 380 -5.195 7.232 5.162 1.00 0.00 H new ATOM 0 HB2 LYS A 380 -4.305 9.905 5.097 1.00 0.00 H new ATOM 0 HB3 LYS A 380 -4.978 9.038 6.463 1.00 0.00 H new ATOM 0 HG2 LYS A 380 -2.015 8.840 5.757 1.00 0.00 H new ATOM 0 HG3 LYS A 380 -2.629 10.129 6.773 1.00 0.00 H new ATOM 0 HD2 LYS A 380 -3.338 7.241 7.422 1.00 0.00 H new ATOM 0 HD3 LYS A 380 -1.771 7.870 7.890 1.00 0.00 H new ATOM 0 HE2 LYS A 380 -4.499 8.981 8.721 1.00 0.00 H new ATOM 0 HE3 LYS A 380 -3.343 8.170 9.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 380 -2.864 10.360 10.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 380 -1.761 10.067 8.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 380 -3.218 10.878 8.604 1.00 0.00 H new ATOM 270 N VAL A 381 -5.365 7.758 2.695 1.00 0.00 N ATOM 271 CA VAL A 381 -5.438 8.049 1.233 1.00 0.00 C ATOM 272 C VAL A 381 -6.829 8.562 0.869 1.00 0.00 C ATOM 273 O VAL A 381 -7.820 8.168 1.450 1.00 0.00 O ATOM 274 CB VAL A 381 -5.156 6.747 0.471 1.00 0.00 C ATOM 275 CG1 VAL A 381 -5.979 5.608 1.086 1.00 0.00 C ATOM 276 CG2 VAL A 381 -5.524 6.909 -1.011 1.00 0.00 C ATOM 0 H VAL A 381 -6.185 7.294 3.086 1.00 0.00 H new ATOM 0 HA VAL A 381 -4.706 8.812 0.969 1.00 0.00 H new ATOM 0 HB VAL A 381 -4.094 6.513 0.546 1.00 0.00 H new ATOM 0 HG11 VAL A 381 -5.780 4.682 0.546 1.00 0.00 H new ATOM 0 HG12 VAL A 381 -5.703 5.484 2.133 1.00 0.00 H new ATOM 0 HG13 VAL A 381 -7.040 5.847 1.017 1.00 0.00 H new ATOM 0 HG21 VAL A 381 -5.319 5.979 -1.541 1.00 0.00 H new ATOM 0 HG22 VAL A 381 -6.583 7.151 -1.099 1.00 0.00 H new ATOM 0 HG23 VAL A 381 -4.931 7.713 -1.447 1.00 0.00 H new ATOM 286 N PHE A 382 -6.903 9.406 -0.128 1.00 0.00 N ATOM 287 CA PHE A 382 -8.224 9.926 -0.599 1.00 0.00 C ATOM 288 C PHE A 382 -8.484 9.295 -1.971 1.00 0.00 C ATOM 289 O PHE A 382 -7.580 8.766 -2.586 1.00 0.00 O ATOM 290 CB PHE A 382 -8.200 11.466 -0.688 1.00 0.00 C ATOM 291 CG PHE A 382 -6.781 11.977 -0.869 1.00 0.00 C ATOM 292 CD1 PHE A 382 -5.950 11.437 -1.858 1.00 0.00 C ATOM 293 CD2 PHE A 382 -6.302 13.007 -0.049 1.00 0.00 C ATOM 294 CE1 PHE A 382 -4.647 11.922 -2.021 1.00 0.00 C ATOM 295 CE2 PHE A 382 -5.002 13.492 -0.213 1.00 0.00 C ATOM 296 CZ PHE A 382 -4.173 12.949 -1.198 1.00 0.00 C ATOM 0 H PHE A 382 -6.097 9.761 -0.642 1.00 0.00 H new ATOM 0 HA PHE A 382 -9.020 9.665 0.098 1.00 0.00 H new ATOM 0 HB2 PHE A 382 -8.819 11.796 -1.523 1.00 0.00 H new ATOM 0 HB3 PHE A 382 -8.632 11.893 0.217 1.00 0.00 H new ATOM 0 HD1 PHE A 382 -6.315 10.645 -2.496 1.00 0.00 H new ATOM 0 HD2 PHE A 382 -6.941 13.428 0.713 1.00 0.00 H new ATOM 0 HE1 PHE A 382 -4.007 11.503 -2.783 1.00 0.00 H new ATOM 0 HE2 PHE A 382 -4.638 14.287 0.422 1.00 0.00 H new ATOM 0 HZ PHE A 382 -3.167 13.322 -1.324 1.00 0.00 H new ATOM 306 N LYS A 383 -9.707 9.284 -2.444 1.00 0.00 N ATOM 307 CA LYS A 383 -9.992 8.630 -3.757 1.00 0.00 C ATOM 308 C LYS A 383 -10.958 9.483 -4.605 1.00 0.00 C ATOM 309 O LYS A 383 -12.069 9.733 -4.181 1.00 0.00 O ATOM 310 CB LYS A 383 -10.676 7.283 -3.494 1.00 0.00 C ATOM 311 CG LYS A 383 -9.908 6.461 -2.427 1.00 0.00 C ATOM 312 CD LYS A 383 -9.879 4.973 -2.819 1.00 0.00 C ATOM 313 CE LYS A 383 -9.556 4.098 -1.588 1.00 0.00 C ATOM 314 NZ LYS A 383 -8.880 4.915 -0.538 1.00 0.00 N ATOM 0 H LYS A 383 -10.515 9.698 -1.979 1.00 0.00 H new ATOM 0 HA LYS A 383 -9.050 8.510 -4.292 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -11.700 7.452 -3.159 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -10.734 6.714 -4.422 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -8.890 6.839 -2.330 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -10.385 6.579 -1.454 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -10.842 4.682 -3.237 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -9.132 4.809 -3.596 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -10.474 3.667 -1.189 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -8.915 3.267 -1.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -8.401 4.285 0.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -8.180 5.542 -0.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -9.587 5.488 -0.035 1.00 0.00 H new ATOM 328 N PRO A 384 -10.598 9.876 -5.818 1.00 0.00 N ATOM 329 CA PRO A 384 -11.541 10.625 -6.682 1.00 0.00 C ATOM 330 C PRO A 384 -12.792 9.768 -6.828 1.00 0.00 C ATOM 331 O PRO A 384 -13.906 10.226 -6.666 1.00 0.00 O ATOM 332 CB PRO A 384 -10.807 10.784 -8.025 1.00 0.00 C ATOM 333 CG PRO A 384 -9.361 10.600 -7.699 1.00 0.00 C ATOM 334 CD PRO A 384 -9.314 9.659 -6.493 1.00 0.00 C ATOM 0 HA PRO A 384 -11.836 11.599 -6.292 1.00 0.00 H new ATOM 0 HB2 PRO A 384 -11.146 10.044 -8.750 1.00 0.00 H new ATOM 0 HB3 PRO A 384 -10.991 11.765 -8.462 1.00 0.00 H new ATOM 0 HG2 PRO A 384 -8.822 10.175 -8.546 1.00 0.00 H new ATOM 0 HG3 PRO A 384 -8.889 11.555 -7.467 1.00 0.00 H new ATOM 0 HD2 PRO A 384 -9.197 8.620 -6.802 1.00 0.00 H new ATOM 0 HD3 PRO A 384 -8.475 9.893 -5.838 1.00 0.00 H new ATOM 342 N LYS A 385 -12.595 8.488 -7.072 1.00 0.00 N ATOM 343 CA LYS A 385 -13.729 7.560 -7.159 1.00 0.00 C ATOM 344 C LYS A 385 -14.523 7.753 -8.445 1.00 0.00 C ATOM 345 O LYS A 385 -14.809 8.846 -8.891 1.00 0.00 O ATOM 346 CB LYS A 385 -14.630 7.745 -5.920 1.00 0.00 C ATOM 347 CG LYS A 385 -15.013 6.375 -5.343 1.00 0.00 C ATOM 348 CD LYS A 385 -13.817 5.768 -4.566 1.00 0.00 C ATOM 349 CE LYS A 385 -13.748 4.248 -4.778 1.00 0.00 C ATOM 350 NZ LYS A 385 -13.688 3.952 -6.238 1.00 0.00 N ATOM 0 H LYS A 385 -11.679 8.061 -7.213 1.00 0.00 H new ATOM 0 HA LYS A 385 -13.343 6.541 -7.180 1.00 0.00 H new ATOM 0 HB2 LYS A 385 -14.109 8.334 -5.165 1.00 0.00 H new ATOM 0 HB3 LYS A 385 -15.529 8.299 -6.192 1.00 0.00 H new ATOM 0 HG2 LYS A 385 -15.872 6.479 -4.680 1.00 0.00 H new ATOM 0 HG3 LYS A 385 -15.311 5.704 -6.148 1.00 0.00 H new ATOM 0 HD2 LYS A 385 -12.888 6.229 -4.900 1.00 0.00 H new ATOM 0 HD3 LYS A 385 -13.918 5.988 -3.503 1.00 0.00 H new ATOM 0 HE2 LYS A 385 -12.870 3.840 -4.277 1.00 0.00 H new ATOM 0 HE3 LYS A 385 -14.620 3.768 -4.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 385 -13.261 3.015 -6.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 385 -14.650 3.960 -6.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 385 -13.111 4.674 -6.715 1.00 0.00 H new ATOM 364 N LYS A 386 -14.878 6.649 -9.005 1.00 0.00 N ATOM 365 CA LYS A 386 -15.678 6.602 -10.259 1.00 0.00 C ATOM 366 C LYS A 386 -16.934 7.469 -10.068 1.00 0.00 C ATOM 367 O LYS A 386 -17.251 8.306 -10.890 1.00 0.00 O ATOM 368 CB LYS A 386 -16.060 5.118 -10.547 1.00 0.00 C ATOM 369 CG LYS A 386 -15.225 4.196 -9.640 1.00 0.00 C ATOM 370 CD LYS A 386 -15.364 2.731 -10.038 1.00 0.00 C ATOM 371 CE LYS A 386 -14.575 1.868 -9.032 1.00 0.00 C ATOM 372 NZ LYS A 386 -14.059 0.655 -9.728 1.00 0.00 N ATOM 0 H LYS A 386 -14.639 5.730 -8.633 1.00 0.00 H new ATOM 0 HA LYS A 386 -15.111 6.988 -11.106 1.00 0.00 H new ATOM 0 HB2 LYS A 386 -17.123 4.962 -10.365 1.00 0.00 H new ATOM 0 HB3 LYS A 386 -15.878 4.880 -11.595 1.00 0.00 H new ATOM 0 HG2 LYS A 386 -14.176 4.488 -9.692 1.00 0.00 H new ATOM 0 HG3 LYS A 386 -15.541 4.323 -8.604 1.00 0.00 H new ATOM 0 HD2 LYS A 386 -16.414 2.439 -10.044 1.00 0.00 H new ATOM 0 HD3 LYS A 386 -14.984 2.576 -11.048 1.00 0.00 H new ATOM 0 HE2 LYS A 386 -13.748 2.441 -8.613 1.00 0.00 H new ATOM 0 HE3 LYS A 386 -15.217 1.579 -8.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 386 -13.526 0.069 -9.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 386 -14.857 0.107 -10.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 386 -13.434 0.942 -10.508 1.00 0.00 H new ATOM 386 N LEU A 387 -17.642 7.274 -8.976 1.00 0.00 N ATOM 387 CA LEU A 387 -18.873 8.086 -8.702 1.00 0.00 C ATOM 388 C LEU A 387 -18.527 9.169 -7.660 1.00 0.00 C ATOM 389 O LEU A 387 -18.337 10.313 -8.008 1.00 0.00 O ATOM 390 CB LEU A 387 -19.996 7.147 -8.180 1.00 0.00 C ATOM 391 CG LEU A 387 -21.338 7.450 -8.886 1.00 0.00 C ATOM 392 CD1 LEU A 387 -21.365 6.790 -10.270 1.00 0.00 C ATOM 393 CD2 LEU A 387 -22.498 6.897 -8.051 1.00 0.00 C ATOM 0 H LEU A 387 -17.417 6.583 -8.260 1.00 0.00 H new ATOM 0 HA LEU A 387 -19.227 8.572 -9.611 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -19.716 6.108 -8.352 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -20.110 7.273 -7.103 1.00 0.00 H new ATOM 0 HG LEU A 387 -21.440 8.530 -8.994 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -22.314 7.009 -10.759 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -20.546 7.180 -10.875 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -21.254 5.711 -10.161 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -23.442 7.113 -8.552 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -22.384 5.819 -7.939 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -22.494 7.366 -7.067 1.00 0.00 H new ATOM 405 N THR A 388 -18.438 8.793 -6.395 1.00 0.00 N ATOM 406 CA THR A 388 -18.093 9.757 -5.283 1.00 0.00 C ATOM 407 C THR A 388 -18.762 9.288 -3.984 1.00 0.00 C ATOM 408 O THR A 388 -19.972 9.239 -3.892 1.00 0.00 O ATOM 409 CB THR A 388 -18.591 11.188 -5.578 1.00 0.00 C ATOM 410 OG1 THR A 388 -18.544 11.939 -4.372 1.00 0.00 O ATOM 411 CG2 THR A 388 -20.044 11.179 -6.100 1.00 0.00 C ATOM 0 H THR A 388 -18.594 7.835 -6.080 1.00 0.00 H new ATOM 0 HA THR A 388 -17.007 9.775 -5.195 1.00 0.00 H new ATOM 0 HB THR A 388 -17.952 11.629 -6.343 1.00 0.00 H new ATOM 0 HG1 THR A 388 -18.856 12.852 -4.543 1.00 0.00 H new ATOM 0 HG21 THR A 388 -20.366 12.201 -6.298 1.00 0.00 H new ATOM 0 HG22 THR A 388 -20.096 10.597 -7.020 1.00 0.00 H new ATOM 0 HG23 THR A 388 -20.697 10.732 -5.350 1.00 0.00 H new ATOM 419 N LEU A 389 -17.986 8.961 -2.972 1.00 0.00 N ATOM 420 CA LEU A 389 -18.575 8.509 -1.664 1.00 0.00 C ATOM 421 C LEU A 389 -17.918 9.301 -0.523 1.00 0.00 C ATOM 422 O LEU A 389 -18.493 10.239 -0.006 1.00 0.00 O ATOM 423 CB LEU A 389 -18.354 7.000 -1.449 1.00 0.00 C ATOM 424 CG LEU A 389 -18.436 6.228 -2.773 1.00 0.00 C ATOM 425 CD1 LEU A 389 -17.873 4.817 -2.573 1.00 0.00 C ATOM 426 CD2 LEU A 389 -19.898 6.127 -3.231 1.00 0.00 C ATOM 0 H LEU A 389 -16.967 8.988 -2.996 1.00 0.00 H new ATOM 0 HA LEU A 389 -19.649 8.692 -1.678 1.00 0.00 H new ATOM 0 HB2 LEU A 389 -17.379 6.835 -0.990 1.00 0.00 H new ATOM 0 HB3 LEU A 389 -19.102 6.616 -0.755 1.00 0.00 H new ATOM 0 HG LEU A 389 -17.857 6.755 -3.531 1.00 0.00 H new ATOM 0 HD11 LEU A 389 -17.930 4.266 -3.512 1.00 0.00 H new ATOM 0 HD12 LEU A 389 -16.833 4.882 -2.253 1.00 0.00 H new ATOM 0 HD13 LEU A 389 -18.455 4.298 -1.812 1.00 0.00 H new ATOM 0 HD21 LEU A 389 -19.948 5.578 -4.171 1.00 0.00 H new ATOM 0 HD22 LEU A 389 -20.481 5.603 -2.474 1.00 0.00 H new ATOM 0 HD23 LEU A 389 -20.305 7.128 -3.374 1.00 0.00 H new ATOM 438 N LYS A 390 -16.714 8.938 -0.137 1.00 0.00 N ATOM 439 CA LYS A 390 -16.001 9.679 0.965 1.00 0.00 C ATOM 440 C LYS A 390 -14.604 10.088 0.469 1.00 0.00 C ATOM 441 O LYS A 390 -14.347 11.243 0.191 1.00 0.00 O ATOM 442 CB LYS A 390 -15.854 8.792 2.232 1.00 0.00 C ATOM 443 CG LYS A 390 -17.076 7.851 2.417 1.00 0.00 C ATOM 444 CD LYS A 390 -16.705 6.417 2.010 1.00 0.00 C ATOM 445 CE LYS A 390 -17.938 5.515 2.074 1.00 0.00 C ATOM 446 NZ LYS A 390 -18.421 5.419 3.482 1.00 0.00 N ATOM 0 H LYS A 390 -16.191 8.159 -0.537 1.00 0.00 H new ATOM 0 HA LYS A 390 -16.587 10.560 1.228 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -14.944 8.197 2.156 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -15.747 9.427 3.111 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -17.404 7.869 3.456 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -17.911 8.204 1.813 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -16.294 6.412 1.001 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -15.929 6.032 2.672 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -18.726 5.915 1.436 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -17.694 4.523 1.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -19.098 4.634 3.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -17.614 5.248 4.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -18.888 6.309 3.750 1.00 0.00 H new ATOM 460 N GLY A 391 -13.699 9.144 0.368 1.00 0.00 N ATOM 461 CA GLY A 391 -12.311 9.454 -0.092 1.00 0.00 C ATOM 462 C GLY A 391 -11.382 9.459 1.116 1.00 0.00 C ATOM 463 O GLY A 391 -10.799 8.451 1.459 1.00 0.00 O ATOM 0 H GLY A 391 -13.866 8.162 0.587 1.00 0.00 H new ATOM 0 HA2 GLY A 391 -11.980 8.713 -0.819 1.00 0.00 H new ATOM 0 HA3 GLY A 391 -12.286 10.423 -0.591 1.00 0.00 H new ATOM 467 N TYR A 392 -11.240 10.581 1.772 1.00 0.00 N ATOM 468 CA TYR A 392 -10.346 10.637 2.966 1.00 0.00 C ATOM 469 C TYR A 392 -10.642 9.434 3.865 1.00 0.00 C ATOM 470 O TYR A 392 -11.667 9.363 4.512 1.00 0.00 O ATOM 471 CB TYR A 392 -10.598 11.954 3.736 1.00 0.00 C ATOM 472 CG TYR A 392 -9.453 12.912 3.512 1.00 0.00 C ATOM 473 CD1 TYR A 392 -8.304 12.815 4.305 1.00 0.00 C ATOM 474 CD2 TYR A 392 -9.534 13.881 2.508 1.00 0.00 C ATOM 475 CE1 TYR A 392 -7.234 13.688 4.093 1.00 0.00 C ATOM 476 CE2 TYR A 392 -8.462 14.754 2.293 1.00 0.00 C ATOM 477 CZ TYR A 392 -7.311 14.656 3.087 1.00 0.00 C ATOM 478 OH TYR A 392 -6.245 15.503 2.871 1.00 0.00 O ATOM 0 H TYR A 392 -11.703 11.458 1.534 1.00 0.00 H new ATOM 0 HA TYR A 392 -9.302 10.606 2.654 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -11.532 12.407 3.402 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -10.707 11.747 4.801 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -8.244 12.066 5.080 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -10.423 13.956 1.899 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -6.348 13.615 4.706 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.521 15.502 1.516 1.00 0.00 H new ATOM 0 HH TYR A 392 -6.458 16.116 2.136 1.00 0.00 H new ATOM 488 N LYS A 393 -9.752 8.487 3.894 1.00 0.00 N ATOM 489 CA LYS A 393 -9.982 7.278 4.739 1.00 0.00 C ATOM 490 C LYS A 393 -8.657 6.608 5.096 1.00 0.00 C ATOM 491 O LYS A 393 -7.762 6.477 4.284 1.00 0.00 O ATOM 492 CB LYS A 393 -10.864 6.288 3.961 1.00 0.00 C ATOM 493 CG LYS A 393 -11.112 4.972 4.763 1.00 0.00 C ATOM 494 CD LYS A 393 -10.859 3.739 3.877 1.00 0.00 C ATOM 495 CE LYS A 393 -11.969 3.628 2.832 1.00 0.00 C ATOM 496 NZ LYS A 393 -13.292 3.559 3.515 1.00 0.00 N ATOM 0 H LYS A 393 -8.876 8.493 3.372 1.00 0.00 H new ATOM 0 HA LYS A 393 -10.476 7.579 5.663 1.00 0.00 H new ATOM 0 HB2 LYS A 393 -11.820 6.758 3.730 1.00 0.00 H new ATOM 0 HB3 LYS A 393 -10.389 6.049 3.010 1.00 0.00 H new ATOM 0 HG2 LYS A 393 -10.456 4.941 5.633 1.00 0.00 H new ATOM 0 HG3 LYS A 393 -12.136 4.955 5.135 1.00 0.00 H new ATOM 0 HD2 LYS A 393 -9.889 3.823 3.386 1.00 0.00 H new ATOM 0 HD3 LYS A 393 -10.829 2.838 4.489 1.00 0.00 H new ATOM 0 HE2 LYS A 393 -11.939 4.487 2.162 1.00 0.00 H new ATOM 0 HE3 LYS A 393 -11.818 2.740 2.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 393 -14.025 3.298 2.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 393 -13.256 2.844 4.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 393 -13.519 4.487 3.927 1.00 0.00 H new ATOM 510 N GLN A 394 -8.561 6.146 6.310 1.00 0.00 N ATOM 511 CA GLN A 394 -7.337 5.429 6.760 1.00 0.00 C ATOM 512 C GLN A 394 -7.472 3.972 6.327 1.00 0.00 C ATOM 513 O GLN A 394 -8.476 3.342 6.599 1.00 0.00 O ATOM 514 CB GLN A 394 -7.224 5.507 8.283 1.00 0.00 C ATOM 515 CG GLN A 394 -6.977 6.956 8.708 1.00 0.00 C ATOM 516 CD GLN A 394 -6.597 6.990 10.189 1.00 0.00 C ATOM 517 OE1 GLN A 394 -6.528 5.871 10.856 1.00 0.00 O flip ATOM 518 NE2 GLN A 394 -6.359 8.044 10.744 1.00 0.00 N flip ATOM 0 H GLN A 394 -9.289 6.236 7.019 1.00 0.00 H new ATOM 0 HA GLN A 394 -6.445 5.879 6.323 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -8.138 5.133 8.745 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -6.409 4.872 8.630 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -6.180 7.393 8.106 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -7.871 7.555 8.536 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -6.413 8.919 10.222 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -6.105 8.054 11.732 1.00 0.00 H new ATOM 527 N TYR A 395 -6.499 3.428 5.628 1.00 0.00 N ATOM 528 CA TYR A 395 -6.625 2.009 5.160 1.00 0.00 C ATOM 529 C TYR A 395 -5.311 1.263 5.382 1.00 0.00 C ATOM 530 O TYR A 395 -4.255 1.713 4.977 1.00 0.00 O ATOM 531 CB TYR A 395 -6.987 2.034 3.671 1.00 0.00 C ATOM 532 CG TYR A 395 -6.814 0.671 3.026 1.00 0.00 C ATOM 533 CD1 TYR A 395 -7.317 -0.483 3.645 1.00 0.00 C ATOM 534 CD2 TYR A 395 -6.166 0.568 1.786 1.00 0.00 C ATOM 535 CE1 TYR A 395 -7.167 -1.728 3.029 1.00 0.00 C ATOM 536 CE2 TYR A 395 -6.022 -0.679 1.171 1.00 0.00 C ATOM 537 CZ TYR A 395 -6.521 -1.827 1.793 1.00 0.00 C ATOM 538 OH TYR A 395 -6.388 -3.054 1.182 1.00 0.00 O ATOM 0 H TYR A 395 -5.634 3.900 5.365 1.00 0.00 H new ATOM 0 HA TYR A 395 -7.401 1.490 5.723 1.00 0.00 H new ATOM 0 HB2 TYR A 395 -8.019 2.363 3.553 1.00 0.00 H new ATOM 0 HB3 TYR A 395 -6.360 2.762 3.157 1.00 0.00 H new ATOM 0 HD1 TYR A 395 -7.820 -0.409 4.598 1.00 0.00 H new ATOM 0 HD2 TYR A 395 -5.778 1.454 1.306 1.00 0.00 H new ATOM 0 HE1 TYR A 395 -7.551 -2.616 3.509 1.00 0.00 H new ATOM 0 HE2 TYR A 395 -5.525 -0.755 0.215 1.00 0.00 H new ATOM 0 HH TYR A 395 -5.916 -2.946 0.330 1.00 0.00 H new ATOM 548 N TRP A 396 -5.375 0.121 6.031 1.00 0.00 N ATOM 549 CA TRP A 396 -4.141 -0.684 6.291 1.00 0.00 C ATOM 550 C TRP A 396 -4.292 -2.084 5.699 1.00 0.00 C ATOM 551 O TRP A 396 -5.044 -2.900 6.195 1.00 0.00 O ATOM 552 CB TRP A 396 -3.889 -0.806 7.795 1.00 0.00 C ATOM 553 CG TRP A 396 -5.113 -1.277 8.515 1.00 0.00 C ATOM 554 CD1 TRP A 396 -6.290 -0.615 8.588 1.00 0.00 C ATOM 555 CD2 TRP A 396 -5.281 -2.499 9.288 1.00 0.00 C ATOM 556 NE1 TRP A 396 -7.169 -1.357 9.359 1.00 0.00 N ATOM 557 CE2 TRP A 396 -6.594 -2.527 9.810 1.00 0.00 C ATOM 558 CE3 TRP A 396 -4.427 -3.577 9.581 1.00 0.00 C ATOM 559 CZ2 TRP A 396 -7.045 -3.587 10.597 1.00 0.00 C ATOM 560 CZ3 TRP A 396 -4.877 -4.646 10.373 1.00 0.00 C ATOM 561 CH2 TRP A 396 -6.184 -4.651 10.880 1.00 0.00 C ATOM 0 H TRP A 396 -6.237 -0.288 6.393 1.00 0.00 H new ATOM 0 HA TRP A 396 -3.298 -0.175 5.823 1.00 0.00 H new ATOM 0 HB2 TRP A 396 -3.069 -1.502 7.973 1.00 0.00 H new ATOM 0 HB3 TRP A 396 -3.579 0.160 8.194 1.00 0.00 H new ATOM 0 HD1 TRP A 396 -6.508 0.335 8.122 1.00 0.00 H new ATOM 0 HE1 TRP A 396 -8.126 -1.073 9.568 1.00 0.00 H new ATOM 0 HE3 TRP A 396 -3.419 -3.583 9.195 1.00 0.00 H new ATOM 0 HZ2 TRP A 396 -8.053 -3.585 10.985 1.00 0.00 H new ATOM 0 HZ3 TRP A 396 -4.213 -5.469 10.593 1.00 0.00 H new ATOM 0 HH2 TRP A 396 -6.525 -5.476 11.488 1.00 0.00 H new ATOM 572 N CYS A 397 -3.563 -2.379 4.656 1.00 0.00 N ATOM 573 CA CYS A 397 -3.640 -3.737 4.049 1.00 0.00 C ATOM 574 C CYS A 397 -2.568 -4.613 4.705 1.00 0.00 C ATOM 575 O CYS A 397 -1.667 -4.116 5.350 1.00 0.00 O ATOM 576 CB CYS A 397 -3.407 -3.630 2.531 1.00 0.00 C ATOM 577 SG CYS A 397 -1.633 -3.654 2.146 1.00 0.00 S ATOM 0 H CYS A 397 -2.917 -1.736 4.198 1.00 0.00 H new ATOM 0 HA CYS A 397 -4.621 -4.182 4.212 1.00 0.00 H new ATOM 0 HB2 CYS A 397 -3.905 -4.456 2.023 1.00 0.00 H new ATOM 0 HB3 CYS A 397 -3.853 -2.709 2.154 1.00 0.00 H new ATOM 0 HG CYS A 397 -1.225 -2.444 1.902 1.00 0.00 H new ATOM 583 N THR A 398 -2.653 -5.907 4.553 1.00 0.00 N ATOM 584 CA THR A 398 -1.631 -6.803 5.177 1.00 0.00 C ATOM 585 C THR A 398 -1.365 -7.991 4.255 1.00 0.00 C ATOM 586 O THR A 398 -2.278 -8.628 3.769 1.00 0.00 O ATOM 587 CB THR A 398 -2.152 -7.315 6.526 1.00 0.00 C ATOM 588 OG1 THR A 398 -1.545 -8.566 6.821 1.00 0.00 O ATOM 589 CG2 THR A 398 -3.668 -7.493 6.458 1.00 0.00 C ATOM 0 H THR A 398 -3.384 -6.384 4.025 1.00 0.00 H new ATOM 0 HA THR A 398 -0.707 -6.245 5.331 1.00 0.00 H new ATOM 0 HB THR A 398 -1.907 -6.594 7.305 1.00 0.00 H new ATOM 0 HG1 THR A 398 -1.875 -8.895 7.683 1.00 0.00 H new ATOM 0 HG21 THR A 398 -4.035 -7.857 7.418 1.00 0.00 H new ATOM 0 HG22 THR A 398 -4.137 -6.536 6.229 1.00 0.00 H new ATOM 0 HG23 THR A 398 -3.915 -8.213 5.678 1.00 0.00 H new ATOM 597 N PHE A 399 -0.117 -8.298 4.011 1.00 0.00 N ATOM 598 CA PHE A 399 0.213 -9.451 3.122 1.00 0.00 C ATOM 599 C PHE A 399 0.324 -10.713 3.985 1.00 0.00 C ATOM 600 O PHE A 399 0.921 -10.707 5.043 1.00 0.00 O ATOM 601 CB PHE A 399 1.548 -9.153 2.398 1.00 0.00 C ATOM 602 CG PHE A 399 1.411 -9.377 0.903 1.00 0.00 C ATOM 603 CD1 PHE A 399 0.893 -10.585 0.423 1.00 0.00 C ATOM 604 CD2 PHE A 399 1.800 -8.375 0.002 1.00 0.00 C ATOM 605 CE1 PHE A 399 0.762 -10.793 -0.955 1.00 0.00 C ATOM 606 CE2 PHE A 399 1.668 -8.584 -1.375 1.00 0.00 C ATOM 607 CZ PHE A 399 1.150 -9.792 -1.854 1.00 0.00 C ATOM 0 H PHE A 399 0.688 -7.799 4.390 1.00 0.00 H new ATOM 0 HA PHE A 399 -0.563 -9.605 2.372 1.00 0.00 H new ATOM 0 HB2 PHE A 399 1.849 -8.123 2.590 1.00 0.00 H new ATOM 0 HB3 PHE A 399 2.334 -9.795 2.796 1.00 0.00 H new ATOM 0 HD1 PHE A 399 0.594 -11.357 1.116 1.00 0.00 H new ATOM 0 HD2 PHE A 399 2.201 -7.443 0.371 1.00 0.00 H new ATOM 0 HE1 PHE A 399 0.362 -11.725 -1.325 1.00 0.00 H new ATOM 0 HE2 PHE A 399 1.966 -7.812 -2.069 1.00 0.00 H new ATOM 0 HZ PHE A 399 1.049 -9.953 -2.917 1.00 0.00 H new ATOM 617 N LYS A 400 -0.267 -11.790 3.542 1.00 0.00 N ATOM 618 CA LYS A 400 -0.226 -13.056 4.331 1.00 0.00 C ATOM 619 C LYS A 400 -0.103 -14.232 3.359 1.00 0.00 C ATOM 620 O LYS A 400 -0.785 -14.302 2.357 1.00 0.00 O ATOM 621 CB LYS A 400 -1.520 -13.118 5.195 1.00 0.00 C ATOM 622 CG LYS A 400 -2.077 -14.556 5.389 1.00 0.00 C ATOM 623 CD LYS A 400 -3.172 -14.865 4.343 1.00 0.00 C ATOM 624 CE LYS A 400 -4.436 -14.011 4.593 1.00 0.00 C ATOM 625 NZ LYS A 400 -4.404 -12.804 3.717 1.00 0.00 N ATOM 0 H LYS A 400 -0.780 -11.848 2.662 1.00 0.00 H new ATOM 0 HA LYS A 400 0.632 -13.100 5.002 1.00 0.00 H new ATOM 0 HB2 LYS A 400 -1.314 -12.683 6.173 1.00 0.00 H new ATOM 0 HB3 LYS A 400 -2.288 -12.501 4.728 1.00 0.00 H new ATOM 0 HG2 LYS A 400 -1.267 -15.280 5.299 1.00 0.00 H new ATOM 0 HG3 LYS A 400 -2.487 -14.660 6.393 1.00 0.00 H new ATOM 0 HD2 LYS A 400 -2.789 -14.669 3.342 1.00 0.00 H new ATOM 0 HD3 LYS A 400 -3.430 -15.923 4.384 1.00 0.00 H new ATOM 0 HE2 LYS A 400 -5.331 -14.598 4.388 1.00 0.00 H new ATOM 0 HE3 LYS A 400 -4.484 -13.712 5.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 400 -4.279 -11.953 4.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 400 -3.613 -12.883 3.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 400 -5.298 -12.733 3.191 1.00 0.00 H new ATOM 639 N ASP A 401 0.781 -15.150 3.644 1.00 0.00 N ATOM 640 CA ASP A 401 0.955 -16.318 2.743 1.00 0.00 C ATOM 641 C ASP A 401 1.166 -15.827 1.307 1.00 0.00 C ATOM 642 O ASP A 401 2.267 -15.505 0.906 1.00 0.00 O ATOM 643 CB ASP A 401 -0.304 -17.192 2.822 1.00 0.00 C ATOM 644 CG ASP A 401 -0.235 -18.092 4.059 1.00 0.00 C ATOM 645 OD1 ASP A 401 0.216 -17.616 5.088 1.00 0.00 O ATOM 646 OD2 ASP A 401 -0.636 -19.239 3.956 1.00 0.00 O ATOM 0 H ASP A 401 1.389 -15.139 4.463 1.00 0.00 H new ATOM 0 HA ASP A 401 1.824 -16.902 3.046 1.00 0.00 H new ATOM 0 HB2 ASP A 401 -1.192 -16.562 2.868 1.00 0.00 H new ATOM 0 HB3 ASP A 401 -0.392 -17.801 1.922 1.00 0.00 H new ATOM 651 N THR A 402 0.118 -15.770 0.529 1.00 0.00 N ATOM 652 CA THR A 402 0.253 -15.304 -0.884 1.00 0.00 C ATOM 653 C THR A 402 -1.020 -14.563 -1.296 1.00 0.00 C ATOM 654 O THR A 402 -1.322 -14.432 -2.466 1.00 0.00 O ATOM 655 CB THR A 402 0.457 -16.513 -1.800 1.00 0.00 C ATOM 656 OG1 THR A 402 0.688 -16.066 -3.129 1.00 0.00 O ATOM 657 CG2 THR A 402 -0.791 -17.397 -1.767 1.00 0.00 C ATOM 0 H THR A 402 -0.828 -16.026 0.811 1.00 0.00 H new ATOM 0 HA THR A 402 1.109 -14.634 -0.969 1.00 0.00 H new ATOM 0 HB THR A 402 1.316 -17.088 -1.456 1.00 0.00 H new ATOM 0 HG1 THR A 402 0.083 -15.323 -3.334 1.00 0.00 H new ATOM 0 HG21 THR A 402 -0.645 -18.258 -2.420 1.00 0.00 H new ATOM 0 HG22 THR A 402 -0.967 -17.740 -0.748 1.00 0.00 H new ATOM 0 HG23 THR A 402 -1.652 -16.824 -2.110 1.00 0.00 H new ATOM 665 N SER A 403 -1.770 -14.076 -0.339 1.00 0.00 N ATOM 666 CA SER A 403 -3.030 -13.337 -0.656 1.00 0.00 C ATOM 667 C SER A 403 -3.133 -12.107 0.255 1.00 0.00 C ATOM 668 O SER A 403 -2.753 -12.140 1.409 1.00 0.00 O ATOM 669 CB SER A 403 -4.233 -14.269 -0.423 1.00 0.00 C ATOM 670 OG SER A 403 -3.881 -15.254 0.539 1.00 0.00 O ATOM 0 H SER A 403 -1.561 -14.160 0.656 1.00 0.00 H new ATOM 0 HA SER A 403 -3.024 -13.013 -1.697 1.00 0.00 H new ATOM 0 HB2 SER A 403 -5.092 -13.694 -0.075 1.00 0.00 H new ATOM 0 HB3 SER A 403 -4.526 -14.745 -1.359 1.00 0.00 H new ATOM 0 HG SER A 403 -4.644 -15.849 0.692 1.00 0.00 H new ATOM 676 N ILE A 404 -3.642 -11.021 -0.264 1.00 0.00 N ATOM 677 CA ILE A 404 -3.777 -9.780 0.543 1.00 0.00 C ATOM 678 C ILE A 404 -5.165 -9.756 1.199 1.00 0.00 C ATOM 679 O ILE A 404 -6.095 -10.394 0.747 1.00 0.00 O ATOM 680 CB ILE A 404 -3.599 -8.568 -0.407 1.00 0.00 C ATOM 681 CG1 ILE A 404 -2.102 -8.231 -0.562 1.00 0.00 C ATOM 682 CG2 ILE A 404 -4.371 -7.336 0.090 1.00 0.00 C ATOM 683 CD1 ILE A 404 -1.580 -7.414 0.629 1.00 0.00 C ATOM 0 H ILE A 404 -3.973 -10.944 -1.226 1.00 0.00 H new ATOM 0 HA ILE A 404 -3.023 -9.740 1.329 1.00 0.00 H new ATOM 0 HB ILE A 404 -4.010 -8.845 -1.378 1.00 0.00 H new ATOM 0 HG12 ILE A 404 -1.528 -9.153 -0.651 1.00 0.00 H new ATOM 0 HG13 ILE A 404 -1.948 -7.670 -1.484 1.00 0.00 H new ATOM 0 HG21 ILE A 404 -4.221 -6.508 -0.603 1.00 0.00 H new ATOM 0 HG22 ILE A 404 -5.434 -7.572 0.149 1.00 0.00 H new ATOM 0 HG23 ILE A 404 -4.007 -7.053 1.078 1.00 0.00 H new ATOM 0 HD11 ILE A 404 -0.522 -7.195 0.485 1.00 0.00 H new ATOM 0 HD12 ILE A 404 -2.137 -6.480 0.701 1.00 0.00 H new ATOM 0 HD13 ILE A 404 -1.710 -7.986 1.548 1.00 0.00 H new ATOM 695 N SER A 405 -5.299 -9.003 2.258 1.00 0.00 N ATOM 696 CA SER A 405 -6.610 -8.890 2.969 1.00 0.00 C ATOM 697 C SER A 405 -6.866 -7.417 3.282 1.00 0.00 C ATOM 698 O SER A 405 -6.058 -6.756 3.903 1.00 0.00 O ATOM 699 CB SER A 405 -6.561 -9.694 4.272 1.00 0.00 C ATOM 700 OG SER A 405 -6.111 -8.855 5.328 1.00 0.00 O ATOM 0 H SER A 405 -4.545 -8.452 2.668 1.00 0.00 H new ATOM 0 HA SER A 405 -7.410 -9.283 2.342 1.00 0.00 H new ATOM 0 HB2 SER A 405 -7.549 -10.091 4.504 1.00 0.00 H new ATOM 0 HB3 SER A 405 -5.892 -10.547 4.161 1.00 0.00 H new ATOM 0 HG SER A 405 -6.862 -8.646 5.922 1.00 0.00 H new ATOM 706 N CYS A 406 -7.975 -6.889 2.840 1.00 0.00 N ATOM 707 CA CYS A 406 -8.269 -5.450 3.093 1.00 0.00 C ATOM 708 C CYS A 406 -8.929 -5.268 4.462 1.00 0.00 C ATOM 709 O CYS A 406 -9.842 -5.983 4.822 1.00 0.00 O ATOM 710 CB CYS A 406 -9.211 -4.936 1.996 1.00 0.00 C ATOM 711 SG CYS A 406 -9.923 -3.344 2.485 1.00 0.00 S ATOM 0 H CYS A 406 -8.690 -7.392 2.315 1.00 0.00 H new ATOM 0 HA CYS A 406 -7.336 -4.887 3.082 1.00 0.00 H new ATOM 0 HB2 CYS A 406 -8.665 -4.827 1.059 1.00 0.00 H new ATOM 0 HB3 CYS A 406 -10.006 -5.660 1.820 1.00 0.00 H new ATOM 0 HG CYS A 406 -8.991 -2.438 2.499 1.00 0.00 H new ATOM 717 N TYR A 407 -8.483 -4.299 5.225 1.00 0.00 N ATOM 718 CA TYR A 407 -9.102 -4.042 6.556 1.00 0.00 C ATOM 719 C TYR A 407 -8.990 -2.540 6.842 1.00 0.00 C ATOM 720 O TYR A 407 -7.927 -1.961 6.741 1.00 0.00 O ATOM 721 CB TYR A 407 -8.366 -4.850 7.636 1.00 0.00 C ATOM 722 CG TYR A 407 -8.941 -6.251 7.713 1.00 0.00 C ATOM 723 CD1 TYR A 407 -10.234 -6.447 8.215 1.00 0.00 C ATOM 724 CD2 TYR A 407 -8.184 -7.351 7.286 1.00 0.00 C ATOM 725 CE1 TYR A 407 -10.769 -7.739 8.292 1.00 0.00 C ATOM 726 CE2 TYR A 407 -8.721 -8.643 7.363 1.00 0.00 C ATOM 727 CZ TYR A 407 -10.013 -8.836 7.865 1.00 0.00 C ATOM 728 OH TYR A 407 -10.540 -10.110 7.942 1.00 0.00 O ATOM 0 H TYR A 407 -7.714 -3.675 4.979 1.00 0.00 H new ATOM 0 HA TYR A 407 -10.149 -4.346 6.560 1.00 0.00 H new ATOM 0 HB2 TYR A 407 -7.302 -4.896 7.406 1.00 0.00 H new ATOM 0 HB3 TYR A 407 -8.462 -4.354 8.602 1.00 0.00 H new ATOM 0 HD1 TYR A 407 -10.819 -5.601 8.543 1.00 0.00 H new ATOM 0 HD2 TYR A 407 -7.187 -7.203 6.898 1.00 0.00 H new ATOM 0 HE1 TYR A 407 -11.765 -7.889 8.681 1.00 0.00 H new ATOM 0 HE2 TYR A 407 -8.137 -9.490 7.035 1.00 0.00 H new ATOM 0 HH TYR A 407 -9.885 -10.756 7.604 1.00 0.00 H new ATOM 738 N LYS A 408 -10.078 -1.899 7.186 1.00 0.00 N ATOM 739 CA LYS A 408 -10.026 -0.430 7.463 1.00 0.00 C ATOM 740 C LYS A 408 -9.803 -0.205 8.956 1.00 0.00 C ATOM 741 O LYS A 408 -8.917 0.527 9.335 1.00 0.00 O ATOM 742 CB LYS A 408 -11.343 0.218 7.031 1.00 0.00 C ATOM 743 CG LYS A 408 -11.514 0.048 5.519 1.00 0.00 C ATOM 744 CD LYS A 408 -12.874 0.617 5.078 1.00 0.00 C ATOM 745 CE LYS A 408 -13.288 0.009 3.732 1.00 0.00 C ATOM 746 NZ LYS A 408 -14.250 0.919 3.047 1.00 0.00 N ATOM 0 H LYS A 408 -10.998 -2.327 7.287 1.00 0.00 H new ATOM 0 HA LYS A 408 -9.206 0.020 6.904 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -12.179 -0.242 7.558 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -11.345 1.276 7.293 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -10.708 0.560 4.993 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -11.448 -1.007 5.253 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -13.630 0.399 5.832 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -12.813 1.702 4.992 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -12.409 -0.146 3.106 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -13.744 -0.968 3.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -14.968 0.354 2.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -14.714 1.527 3.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -13.739 1.511 2.361 1.00 0.00 H new ATOM 760 N SER A 409 -10.600 -0.857 9.780 1.00 0.00 N ATOM 761 CA SER A 409 -10.494 -0.757 11.286 1.00 0.00 C ATOM 762 C SER A 409 -11.915 -0.744 11.876 1.00 0.00 C ATOM 763 O SER A 409 -12.810 -1.375 11.352 1.00 0.00 O ATOM 764 CB SER A 409 -9.731 0.502 11.732 1.00 0.00 C ATOM 765 OG SER A 409 -9.914 0.701 13.125 1.00 0.00 O ATOM 0 H SER A 409 -11.346 -1.476 9.462 1.00 0.00 H new ATOM 0 HA SER A 409 -9.932 -1.617 11.650 1.00 0.00 H new ATOM 0 HB2 SER A 409 -8.670 0.396 11.506 1.00 0.00 H new ATOM 0 HB3 SER A 409 -10.089 1.371 11.180 1.00 0.00 H new ATOM 0 HG SER A 409 -9.426 1.502 13.408 1.00 0.00 H new ATOM 866 N PRO A 417 -14.942 -4.501 4.481 1.00 0.00 N ATOM 867 CA PRO A 417 -13.719 -4.234 3.672 1.00 0.00 C ATOM 868 C PRO A 417 -13.964 -4.415 2.171 1.00 0.00 C ATOM 869 O PRO A 417 -14.965 -4.966 1.759 1.00 0.00 O ATOM 870 CB PRO A 417 -12.716 -5.268 4.186 1.00 0.00 C ATOM 871 CG PRO A 417 -13.097 -5.493 5.618 1.00 0.00 C ATOM 872 CD PRO A 417 -14.613 -5.241 5.718 1.00 0.00 C ATOM 0 HA PRO A 417 -13.376 -3.205 3.779 1.00 0.00 H new ATOM 0 HB2 PRO A 417 -12.772 -6.193 3.612 1.00 0.00 H new ATOM 0 HB3 PRO A 417 -11.693 -4.902 4.102 1.00 0.00 H new ATOM 0 HG2 PRO A 417 -12.852 -6.509 5.928 1.00 0.00 H new ATOM 0 HG3 PRO A 417 -12.548 -4.818 6.275 1.00 0.00 H new ATOM 0 HD2 PRO A 417 -15.169 -6.177 5.782 1.00 0.00 H new ATOM 0 HD3 PRO A 417 -14.862 -4.661 6.607 1.00 0.00 H new ATOM 880 N ALA A 418 -13.059 -3.960 1.351 1.00 0.00 N ATOM 881 CA ALA A 418 -13.254 -4.116 -0.114 1.00 0.00 C ATOM 882 C ALA A 418 -13.294 -5.604 -0.461 1.00 0.00 C ATOM 883 O ALA A 418 -14.286 -6.108 -0.947 1.00 0.00 O ATOM 884 CB ALA A 418 -12.097 -3.448 -0.857 1.00 0.00 C ATOM 0 H ALA A 418 -12.198 -3.490 1.631 1.00 0.00 H new ATOM 0 HA ALA A 418 -14.192 -3.646 -0.411 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -12.240 -3.563 -1.931 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -12.067 -2.388 -0.606 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -11.158 -3.917 -0.564 1.00 0.00 H new ATOM 890 N HIS A 419 -12.229 -6.319 -0.211 1.00 0.00 N ATOM 891 CA HIS A 419 -12.232 -7.775 -0.530 1.00 0.00 C ATOM 892 C HIS A 419 -10.932 -8.423 -0.028 1.00 0.00 C ATOM 893 O HIS A 419 -10.057 -7.769 0.503 1.00 0.00 O ATOM 894 CB HIS A 419 -12.366 -7.963 -2.063 1.00 0.00 C ATOM 895 CG HIS A 419 -13.468 -8.947 -2.384 1.00 0.00 C ATOM 896 ND1 HIS A 419 -13.465 -10.247 -1.898 1.00 0.00 N ATOM 897 CD2 HIS A 419 -14.614 -8.828 -3.132 1.00 0.00 C ATOM 898 CE1 HIS A 419 -14.577 -10.853 -2.355 1.00 0.00 C ATOM 899 NE2 HIS A 419 -15.308 -10.032 -3.110 1.00 0.00 N ATOM 0 H HIS A 419 -11.365 -5.961 0.197 1.00 0.00 H new ATOM 0 HA HIS A 419 -13.075 -8.255 -0.034 1.00 0.00 H new ATOM 0 HB2 HIS A 419 -12.579 -7.004 -2.535 1.00 0.00 H new ATOM 0 HB3 HIS A 419 -11.422 -8.319 -2.475 1.00 0.00 H new ATOM 0 HD2 HIS A 419 -14.927 -7.937 -3.656 1.00 0.00 H new ATOM 0 HE1 HIS A 419 -14.844 -11.877 -2.137 1.00 0.00 H new ATOM 0 HE2 HIS A 419 -16.191 -10.243 -3.574 1.00 0.00 H new ATOM 908 N GLN A 420 -10.811 -9.711 -0.221 1.00 0.00 N ATOM 909 CA GLN A 420 -9.585 -10.453 0.204 1.00 0.00 C ATOM 910 C GLN A 420 -9.068 -11.228 -1.008 1.00 0.00 C ATOM 911 O GLN A 420 -9.710 -12.144 -1.482 1.00 0.00 O ATOM 912 CB GLN A 420 -9.957 -11.436 1.317 1.00 0.00 C ATOM 913 CG GLN A 420 -8.713 -12.179 1.818 1.00 0.00 C ATOM 914 CD GLN A 420 -9.136 -13.252 2.826 1.00 0.00 C ATOM 915 OE1 GLN A 420 -9.892 -14.145 2.498 1.00 0.00 O ATOM 916 NE2 GLN A 420 -8.678 -13.202 4.048 1.00 0.00 N ATOM 0 H GLN A 420 -11.524 -10.291 -0.664 1.00 0.00 H new ATOM 0 HA GLN A 420 -8.823 -9.767 0.572 1.00 0.00 H new ATOM 0 HB2 GLN A 420 -10.424 -10.899 2.143 1.00 0.00 H new ATOM 0 HB3 GLN A 420 -10.691 -12.152 0.947 1.00 0.00 H new ATOM 0 HG2 GLN A 420 -8.187 -12.638 0.980 1.00 0.00 H new ATOM 0 HG3 GLN A 420 -8.020 -11.479 2.284 1.00 0.00 H new ATOM 0 HE21 GLN A 420 -8.043 -12.453 4.325 1.00 0.00 H new ATOM 0 HE22 GLN A 420 -8.955 -13.912 4.726 1.00 0.00 H new ATOM 925 N MET A 421 -7.928 -10.871 -1.533 1.00 0.00 N ATOM 926 CA MET A 421 -7.424 -11.605 -2.726 1.00 0.00 C ATOM 927 C MET A 421 -5.979 -11.196 -3.023 1.00 0.00 C ATOM 928 O MET A 421 -5.464 -10.253 -2.466 1.00 0.00 O ATOM 929 CB MET A 421 -8.319 -11.271 -3.931 1.00 0.00 C ATOM 930 CG MET A 421 -8.838 -9.833 -3.816 1.00 0.00 C ATOM 931 SD MET A 421 -9.351 -9.243 -5.449 1.00 0.00 S ATOM 932 CE MET A 421 -10.849 -10.248 -5.600 1.00 0.00 C ATOM 0 H MET A 421 -7.333 -10.115 -1.194 1.00 0.00 H new ATOM 0 HA MET A 421 -7.450 -12.677 -2.533 1.00 0.00 H new ATOM 0 HB2 MET A 421 -7.756 -11.390 -4.857 1.00 0.00 H new ATOM 0 HB3 MET A 421 -9.157 -11.966 -3.976 1.00 0.00 H new ATOM 0 HG2 MET A 421 -9.678 -9.793 -3.123 1.00 0.00 H new ATOM 0 HG3 MET A 421 -8.060 -9.186 -3.412 1.00 0.00 H new ATOM 0 HE1 MET A 421 -11.417 -9.926 -6.473 1.00 0.00 H new ATOM 0 HE2 MET A 421 -10.574 -11.297 -5.712 1.00 0.00 H new ATOM 0 HE3 MET A 421 -11.460 -10.127 -4.705 1.00 0.00 H new ATOM 942 N ASN A 422 -5.326 -11.908 -3.905 1.00 0.00 N ATOM 943 CA ASN A 422 -3.916 -11.575 -4.249 1.00 0.00 C ATOM 944 C ASN A 422 -3.888 -10.489 -5.326 1.00 0.00 C ATOM 945 O ASN A 422 -4.146 -10.744 -6.486 1.00 0.00 O ATOM 946 CB ASN A 422 -3.223 -12.828 -4.783 1.00 0.00 C ATOM 947 CG ASN A 422 -4.091 -13.464 -5.870 1.00 0.00 C ATOM 948 OD1 ASN A 422 -5.235 -13.798 -5.633 1.00 0.00 O ATOM 949 ND2 ASN A 422 -3.592 -13.649 -7.063 1.00 0.00 N ATOM 0 H ASN A 422 -5.713 -12.710 -4.403 1.00 0.00 H new ATOM 0 HA ASN A 422 -3.402 -11.214 -3.359 1.00 0.00 H new ATOM 0 HB2 ASN A 422 -2.244 -12.571 -5.188 1.00 0.00 H new ATOM 0 HB3 ASN A 422 -3.057 -13.538 -3.973 1.00 0.00 H new ATOM 0 HD21 ASN A 422 -4.163 -14.073 -7.794 1.00 0.00 H new ATOM 0 HD22 ASN A 422 -2.632 -13.369 -7.263 1.00 0.00 H new ATOM 956 N LEU A 423 -3.567 -9.281 -4.955 1.00 0.00 N ATOM 957 CA LEU A 423 -3.508 -8.180 -5.956 1.00 0.00 C ATOM 958 C LEU A 423 -2.186 -8.271 -6.724 1.00 0.00 C ATOM 959 O LEU A 423 -1.859 -7.405 -7.511 1.00 0.00 O ATOM 960 CB LEU A 423 -3.604 -6.826 -5.240 1.00 0.00 C ATOM 961 CG LEU A 423 -5.068 -6.515 -4.879 1.00 0.00 C ATOM 962 CD1 LEU A 423 -5.903 -6.245 -6.149 1.00 0.00 C ATOM 963 CD2 LEU A 423 -5.667 -7.699 -4.108 1.00 0.00 C ATOM 0 H LEU A 423 -3.342 -9.008 -3.998 1.00 0.00 H new ATOM 0 HA LEU A 423 -4.341 -8.271 -6.653 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -2.995 -6.841 -4.336 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -3.205 -6.039 -5.880 1.00 0.00 H new ATOM 0 HG LEU A 423 -5.090 -5.620 -4.257 1.00 0.00 H new ATOM 0 HD11 LEU A 423 -6.933 -6.028 -5.868 1.00 0.00 H new ATOM 0 HD12 LEU A 423 -5.486 -5.392 -6.684 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -5.880 -7.124 -6.793 1.00 0.00 H new ATOM 0 HD21 LEU A 423 -6.704 -7.480 -3.852 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -5.628 -8.594 -4.729 1.00 0.00 H new ATOM 0 HD23 LEU A 423 -5.095 -7.865 -3.195 1.00 0.00 H new ATOM 975 N ARG A 424 -1.425 -9.317 -6.482 1.00 0.00 N ATOM 976 CA ARG A 424 -0.107 -9.506 -7.169 1.00 0.00 C ATOM 977 C ARG A 424 -0.161 -8.960 -8.599 1.00 0.00 C ATOM 978 O ARG A 424 -1.136 -9.122 -9.305 1.00 0.00 O ATOM 979 CB ARG A 424 0.231 -11.007 -7.185 1.00 0.00 C ATOM 980 CG ARG A 424 1.403 -11.296 -8.150 1.00 0.00 C ATOM 981 CD ARG A 424 0.928 -11.377 -9.625 1.00 0.00 C ATOM 982 NE ARG A 424 1.485 -12.610 -10.252 1.00 0.00 N ATOM 983 CZ ARG A 424 0.948 -13.090 -11.342 1.00 0.00 C ATOM 984 NH1 ARG A 424 -0.075 -12.489 -11.886 1.00 0.00 N ATOM 985 NH2 ARG A 424 1.431 -14.172 -11.887 1.00 0.00 N ATOM 0 H ARG A 424 -1.668 -10.059 -5.826 1.00 0.00 H new ATOM 0 HA ARG A 424 0.666 -8.958 -6.629 1.00 0.00 H new ATOM 0 HB2 ARG A 424 0.493 -11.336 -6.179 1.00 0.00 H new ATOM 0 HB3 ARG A 424 -0.646 -11.578 -7.489 1.00 0.00 H new ATOM 0 HG2 ARG A 424 2.155 -10.513 -8.053 1.00 0.00 H new ATOM 0 HG3 ARG A 424 1.881 -12.235 -7.870 1.00 0.00 H new ATOM 0 HD2 ARG A 424 -0.161 -11.392 -9.669 1.00 0.00 H new ATOM 0 HD3 ARG A 424 1.257 -10.495 -10.174 1.00 0.00 H new ATOM 0 HE ARG A 424 2.286 -13.079 -9.829 1.00 0.00 H new ATOM 0 HH11 ARG A 424 -0.456 -11.644 -11.460 1.00 0.00 H new ATOM 0 HH12 ARG A 424 -0.494 -12.864 -12.737 1.00 0.00 H new ATOM 0 HH21 ARG A 424 2.229 -14.645 -11.462 1.00 0.00 H new ATOM 0 HH22 ARG A 424 1.011 -14.546 -12.738 1.00 0.00 H new ATOM 999 N GLY A 425 0.888 -8.307 -9.020 1.00 0.00 N ATOM 1000 CA GLY A 425 0.928 -7.731 -10.398 1.00 0.00 C ATOM 1001 C GLY A 425 0.673 -6.225 -10.326 1.00 0.00 C ATOM 1002 O GLY A 425 0.357 -5.593 -11.315 1.00 0.00 O ATOM 0 H GLY A 425 1.728 -8.146 -8.464 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.897 -7.925 -10.857 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.176 -8.209 -11.026 1.00 0.00 H new ATOM 1006 N CYS A 426 0.809 -5.639 -9.164 1.00 0.00 N ATOM 1007 CA CYS A 426 0.575 -4.179 -9.042 1.00 0.00 C ATOM 1008 C CYS A 426 1.734 -3.432 -9.694 1.00 0.00 C ATOM 1009 O CYS A 426 2.763 -4.005 -9.992 1.00 0.00 O ATOM 1010 CB CYS A 426 0.484 -3.797 -7.564 1.00 0.00 C ATOM 1011 SG CYS A 426 2.010 -4.278 -6.720 1.00 0.00 S ATOM 0 H CYS A 426 1.072 -6.112 -8.299 1.00 0.00 H new ATOM 0 HA CYS A 426 -0.358 -3.913 -9.539 1.00 0.00 H new ATOM 0 HB2 CYS A 426 0.324 -2.723 -7.464 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -0.371 -4.291 -7.102 1.00 0.00 H new ATOM 0 HG CYS A 426 1.933 -3.951 -5.464 1.00 0.00 H new ATOM 1017 N GLU A 427 1.574 -2.153 -9.916 1.00 0.00 N ATOM 1018 CA GLU A 427 2.660 -1.347 -10.548 1.00 0.00 C ATOM 1019 C GLU A 427 3.299 -0.461 -9.481 1.00 0.00 C ATOM 1020 O GLU A 427 2.627 0.068 -8.618 1.00 0.00 O ATOM 1021 CB GLU A 427 2.058 -0.475 -11.661 1.00 0.00 C ATOM 1022 CG GLU A 427 3.141 -0.114 -12.685 1.00 0.00 C ATOM 1023 CD GLU A 427 2.589 0.911 -13.676 1.00 0.00 C ATOM 1024 OE1 GLU A 427 1.587 0.614 -14.306 1.00 0.00 O ATOM 1025 OE2 GLU A 427 3.176 1.975 -13.789 1.00 0.00 O ATOM 0 H GLU A 427 0.730 -1.629 -9.684 1.00 0.00 H new ATOM 0 HA GLU A 427 3.417 -2.003 -10.978 1.00 0.00 H new ATOM 0 HB2 GLU A 427 1.244 -1.008 -12.152 1.00 0.00 H new ATOM 0 HB3 GLU A 427 1.632 0.433 -11.234 1.00 0.00 H new ATOM 0 HG2 GLU A 427 4.016 0.291 -12.177 1.00 0.00 H new ATOM 0 HG3 GLU A 427 3.467 -1.009 -13.215 1.00 0.00 H new ATOM 1032 N VAL A 428 4.595 -0.307 -9.532 1.00 0.00 N ATOM 1033 CA VAL A 428 5.312 0.534 -8.522 1.00 0.00 C ATOM 1034 C VAL A 428 5.943 1.752 -9.205 1.00 0.00 C ATOM 1035 O VAL A 428 6.629 1.635 -10.200 1.00 0.00 O ATOM 1036 CB VAL A 428 6.401 -0.322 -7.853 1.00 0.00 C ATOM 1037 CG1 VAL A 428 5.852 -1.732 -7.596 1.00 0.00 C ATOM 1038 CG2 VAL A 428 7.641 -0.422 -8.759 1.00 0.00 C ATOM 0 H VAL A 428 5.197 -0.732 -10.238 1.00 0.00 H new ATOM 0 HA VAL A 428 4.608 0.889 -7.769 1.00 0.00 H new ATOM 0 HB VAL A 428 6.687 0.148 -6.912 1.00 0.00 H new ATOM 0 HG11 VAL A 428 6.622 -2.341 -7.122 1.00 0.00 H new ATOM 0 HG12 VAL A 428 4.983 -1.670 -6.941 1.00 0.00 H new ATOM 0 HG13 VAL A 428 5.561 -2.187 -8.543 1.00 0.00 H new ATOM 0 HG21 VAL A 428 8.401 -1.031 -8.270 1.00 0.00 H new ATOM 0 HG22 VAL A 428 7.363 -0.882 -9.707 1.00 0.00 H new ATOM 0 HG23 VAL A 428 8.039 0.576 -8.943 1.00 0.00 H new ATOM 1048 N THR A 429 5.723 2.917 -8.665 1.00 0.00 N ATOM 1049 CA THR A 429 6.309 4.152 -9.258 1.00 0.00 C ATOM 1050 C THR A 429 6.517 5.183 -8.133 1.00 0.00 C ATOM 1051 O THR A 429 5.579 5.833 -7.718 1.00 0.00 O ATOM 1052 CB THR A 429 5.338 4.719 -10.297 1.00 0.00 C ATOM 1053 OG1 THR A 429 4.865 3.666 -11.124 1.00 0.00 O ATOM 1054 CG2 THR A 429 6.058 5.756 -11.155 1.00 0.00 C ATOM 0 H THR A 429 5.157 3.069 -7.830 1.00 0.00 H new ATOM 0 HA THR A 429 7.261 3.927 -9.738 1.00 0.00 H new ATOM 0 HB THR A 429 4.496 5.190 -9.790 1.00 0.00 H new ATOM 0 HG1 THR A 429 4.242 4.027 -11.789 1.00 0.00 H new ATOM 0 HG21 THR A 429 5.367 6.160 -11.895 1.00 0.00 H new ATOM 0 HG22 THR A 429 6.422 6.564 -10.520 1.00 0.00 H new ATOM 0 HG23 THR A 429 6.900 5.286 -11.664 1.00 0.00 H new ATOM 1062 N PRO A 430 7.720 5.324 -7.615 1.00 0.00 N ATOM 1063 CA PRO A 430 7.999 6.279 -6.504 1.00 0.00 C ATOM 1064 C PRO A 430 8.263 7.710 -6.987 1.00 0.00 C ATOM 1065 O PRO A 430 8.834 7.932 -8.037 1.00 0.00 O ATOM 1066 CB PRO A 430 9.254 5.685 -5.864 1.00 0.00 C ATOM 1067 CG PRO A 430 10.007 5.088 -7.010 1.00 0.00 C ATOM 1068 CD PRO A 430 8.948 4.607 -8.019 1.00 0.00 C ATOM 0 HA PRO A 430 7.150 6.380 -5.828 1.00 0.00 H new ATOM 0 HB2 PRO A 430 9.842 6.450 -5.357 1.00 0.00 H new ATOM 0 HB3 PRO A 430 9.001 4.931 -5.118 1.00 0.00 H new ATOM 0 HG2 PRO A 430 10.671 5.823 -7.464 1.00 0.00 H new ATOM 0 HG3 PRO A 430 10.631 4.259 -6.676 1.00 0.00 H new ATOM 0 HD2 PRO A 430 9.233 4.849 -9.043 1.00 0.00 H new ATOM 0 HD3 PRO A 430 8.813 3.526 -7.972 1.00 0.00 H new ATOM 1076 N ASP A 431 7.862 8.681 -6.211 1.00 0.00 N ATOM 1077 CA ASP A 431 8.095 10.101 -6.595 1.00 0.00 C ATOM 1078 C ASP A 431 8.136 10.940 -5.321 1.00 0.00 C ATOM 1079 O ASP A 431 7.149 11.064 -4.624 1.00 0.00 O ATOM 1080 CB ASP A 431 6.959 10.587 -7.500 1.00 0.00 C ATOM 1081 CG ASP A 431 7.155 10.027 -8.911 1.00 0.00 C ATOM 1082 OD1 ASP A 431 6.708 8.918 -9.155 1.00 0.00 O ATOM 1083 OD2 ASP A 431 7.751 10.716 -9.723 1.00 0.00 O ATOM 0 H ASP A 431 7.380 8.549 -5.322 1.00 0.00 H new ATOM 0 HA ASP A 431 9.036 10.194 -7.137 1.00 0.00 H new ATOM 0 HB2 ASP A 431 5.998 10.265 -7.100 1.00 0.00 H new ATOM 0 HB3 ASP A 431 6.943 11.677 -7.529 1.00 0.00 H new ATOM 1088 N VAL A 432 9.276 11.500 -4.995 1.00 0.00 N ATOM 1089 CA VAL A 432 9.387 12.314 -3.744 1.00 0.00 C ATOM 1090 C VAL A 432 10.142 13.616 -4.007 1.00 0.00 C ATOM 1091 O VAL A 432 11.183 13.636 -4.634 1.00 0.00 O ATOM 1092 CB VAL A 432 10.128 11.496 -2.677 1.00 0.00 C ATOM 1093 CG1 VAL A 432 11.489 11.049 -3.197 1.00 0.00 C ATOM 1094 CG2 VAL A 432 10.323 12.345 -1.405 1.00 0.00 C ATOM 0 H VAL A 432 10.134 11.428 -5.541 1.00 0.00 H new ATOM 0 HA VAL A 432 8.384 12.563 -3.396 1.00 0.00 H new ATOM 0 HB VAL A 432 9.530 10.616 -2.442 1.00 0.00 H new ATOM 0 HG11 VAL A 432 12.000 10.470 -2.428 1.00 0.00 H new ATOM 0 HG12 VAL A 432 11.354 10.432 -4.085 1.00 0.00 H new ATOM 0 HG13 VAL A 432 12.087 11.924 -3.450 1.00 0.00 H new ATOM 0 HG21 VAL A 432 10.849 11.758 -0.653 1.00 0.00 H new ATOM 0 HG22 VAL A 432 10.907 13.233 -1.646 1.00 0.00 H new ATOM 0 HG23 VAL A 432 9.350 12.645 -1.015 1.00 0.00 H new ATOM 1104 N ASN A 433 9.621 14.707 -3.505 1.00 0.00 N ATOM 1105 CA ASN A 433 10.291 16.026 -3.685 1.00 0.00 C ATOM 1106 C ASN A 433 11.084 16.330 -2.418 1.00 0.00 C ATOM 1107 O ASN A 433 10.553 16.311 -1.326 1.00 0.00 O ATOM 1108 CB ASN A 433 9.235 17.113 -3.892 1.00 0.00 C ATOM 1109 CG ASN A 433 8.449 16.832 -5.174 1.00 0.00 C ATOM 1110 OD1 ASN A 433 8.985 16.299 -6.126 1.00 0.00 O ATOM 1111 ND2 ASN A 433 7.190 17.171 -5.239 1.00 0.00 N ATOM 0 H ASN A 433 8.751 14.738 -2.973 1.00 0.00 H new ATOM 0 HA ASN A 433 10.950 16.000 -4.553 1.00 0.00 H new ATOM 0 HB2 ASN A 433 8.558 17.143 -3.038 1.00 0.00 H new ATOM 0 HB3 ASN A 433 9.713 18.091 -3.954 1.00 0.00 H new ATOM 0 HD21 ASN A 433 6.656 16.989 -6.089 1.00 0.00 H new ATOM 0 HD22 ASN A 433 6.740 17.618 -4.440 1.00 0.00 H new ATOM 1118 N ILE A 434 12.351 16.593 -2.542 1.00 0.00 N ATOM 1119 CA ILE A 434 13.163 16.874 -1.329 1.00 0.00 C ATOM 1120 C ILE A 434 12.855 18.285 -0.820 1.00 0.00 C ATOM 1121 O ILE A 434 13.142 18.618 0.312 1.00 0.00 O ATOM 1122 CB ILE A 434 14.660 16.745 -1.671 1.00 0.00 C ATOM 1123 CG1 ILE A 434 15.043 15.262 -1.750 1.00 0.00 C ATOM 1124 CG2 ILE A 434 15.517 17.425 -0.593 1.00 0.00 C ATOM 1125 CD1 ILE A 434 14.090 14.524 -2.695 1.00 0.00 C ATOM 0 H ILE A 434 12.859 16.626 -3.426 1.00 0.00 H new ATOM 0 HA ILE A 434 12.915 16.156 -0.548 1.00 0.00 H new ATOM 0 HB ILE A 434 14.840 17.230 -2.631 1.00 0.00 H new ATOM 0 HG12 ILE A 434 16.069 15.161 -2.104 1.00 0.00 H new ATOM 0 HG13 ILE A 434 15.003 14.814 -0.757 1.00 0.00 H new ATOM 0 HG21 ILE A 434 16.572 17.325 -0.850 1.00 0.00 H new ATOM 0 HG22 ILE A 434 15.257 18.482 -0.534 1.00 0.00 H new ATOM 0 HG23 ILE A 434 15.332 16.952 0.371 1.00 0.00 H new ATOM 0 HD11 ILE A 434 14.370 13.472 -2.745 1.00 0.00 H new ATOM 0 HD12 ILE A 434 13.069 14.611 -2.323 1.00 0.00 H new ATOM 0 HD13 ILE A 434 14.152 14.963 -3.691 1.00 0.00 H new ATOM 1137 N SER A 435 12.281 19.118 -1.640 1.00 0.00 N ATOM 1138 CA SER A 435 11.972 20.500 -1.183 1.00 0.00 C ATOM 1139 C SER A 435 11.234 20.444 0.158 1.00 0.00 C ATOM 1140 O SER A 435 11.616 21.096 1.109 1.00 0.00 O ATOM 1141 CB SER A 435 11.089 21.194 -2.222 1.00 0.00 C ATOM 1142 OG SER A 435 11.863 21.486 -3.378 1.00 0.00 O ATOM 0 H SER A 435 12.014 18.904 -2.601 1.00 0.00 H new ATOM 0 HA SER A 435 12.900 21.058 -1.062 1.00 0.00 H new ATOM 0 HB2 SER A 435 10.247 20.554 -2.486 1.00 0.00 H new ATOM 0 HB3 SER A 435 10.673 22.112 -1.807 1.00 0.00 H new ATOM 0 HG SER A 435 11.299 21.929 -4.046 1.00 0.00 H new ATOM 1148 N GLY A 436 10.180 19.665 0.239 1.00 0.00 N ATOM 1149 CA GLY A 436 9.400 19.552 1.516 1.00 0.00 C ATOM 1150 C GLY A 436 9.399 18.101 2.008 1.00 0.00 C ATOM 1151 O GLY A 436 8.556 17.708 2.789 1.00 0.00 O ATOM 0 H GLY A 436 9.824 19.098 -0.530 1.00 0.00 H new ATOM 0 HA2 GLY A 436 9.836 20.201 2.276 1.00 0.00 H new ATOM 0 HA3 GLY A 436 8.376 19.890 1.357 1.00 0.00 H new ATOM 1155 N GLN A 437 10.323 17.292 1.556 1.00 0.00 N ATOM 1156 CA GLN A 437 10.342 15.868 2.007 1.00 0.00 C ATOM 1157 C GLN A 437 8.937 15.282 1.837 1.00 0.00 C ATOM 1158 O GLN A 437 8.252 14.989 2.797 1.00 0.00 O ATOM 1159 CB GLN A 437 10.749 15.801 3.481 1.00 0.00 C ATOM 1160 CG GLN A 437 12.072 16.545 3.687 1.00 0.00 C ATOM 1161 CD GLN A 437 13.208 15.760 3.031 1.00 0.00 C ATOM 1162 OE1 GLN A 437 13.452 15.929 1.762 1.00 0.00 O flip ATOM 1163 NE2 GLN A 437 13.882 14.987 3.681 1.00 0.00 N flip ATOM 0 H GLN A 437 11.059 17.553 0.900 1.00 0.00 H new ATOM 0 HA GLN A 437 11.058 15.300 1.414 1.00 0.00 H new ATOM 0 HB2 GLN A 437 9.971 16.244 4.103 1.00 0.00 H new ATOM 0 HB3 GLN A 437 10.853 14.762 3.792 1.00 0.00 H new ATOM 0 HG2 GLN A 437 12.010 17.544 3.256 1.00 0.00 H new ATOM 0 HG3 GLN A 437 12.269 16.669 4.752 1.00 0.00 H new ATOM 0 HE21 GLN A 437 13.691 14.855 4.674 1.00 0.00 H new ATOM 0 HE22 GLN A 437 14.639 14.470 3.234 1.00 0.00 H new ATOM 1172 N LYS A 438 8.499 15.139 0.613 1.00 0.00 N ATOM 1173 CA LYS A 438 7.127 14.607 0.341 1.00 0.00 C ATOM 1174 C LYS A 438 7.220 13.198 -0.228 1.00 0.00 C ATOM 1175 O LYS A 438 7.072 12.994 -1.417 1.00 0.00 O ATOM 1176 CB LYS A 438 6.459 15.498 -0.700 1.00 0.00 C ATOM 1177 CG LYS A 438 6.559 16.964 -0.267 1.00 0.00 C ATOM 1178 CD LYS A 438 6.038 17.884 -1.390 1.00 0.00 C ATOM 1179 CE LYS A 438 6.718 19.253 -1.299 1.00 0.00 C ATOM 1180 NZ LYS A 438 6.063 20.195 -2.250 1.00 0.00 N ATOM 0 H LYS A 438 9.039 15.371 -0.221 1.00 0.00 H new ATOM 0 HA LYS A 438 6.555 14.592 1.269 1.00 0.00 H new ATOM 0 HB2 LYS A 438 6.938 15.362 -1.670 1.00 0.00 H new ATOM 0 HB3 LYS A 438 5.413 15.214 -0.818 1.00 0.00 H new ATOM 0 HG2 LYS A 438 5.980 17.123 0.642 1.00 0.00 H new ATOM 0 HG3 LYS A 438 7.594 17.213 -0.033 1.00 0.00 H new ATOM 0 HD2 LYS A 438 6.236 17.434 -2.363 1.00 0.00 H new ATOM 0 HD3 LYS A 438 4.957 17.999 -1.306 1.00 0.00 H new ATOM 0 HE2 LYS A 438 6.649 19.639 -0.282 1.00 0.00 H new ATOM 0 HE3 LYS A 438 7.778 19.161 -1.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 438 6.524 21.125 -2.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 438 6.151 19.827 -3.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 438 5.057 20.291 -2.006 1.00 0.00 H new ATOM 1194 N PHE A 439 7.470 12.219 0.590 1.00 0.00 N ATOM 1195 CA PHE A 439 7.571 10.832 0.050 1.00 0.00 C ATOM 1196 C PHE A 439 6.160 10.310 -0.236 1.00 0.00 C ATOM 1197 O PHE A 439 5.483 9.819 0.639 1.00 0.00 O ATOM 1198 CB PHE A 439 8.317 9.900 1.041 1.00 0.00 C ATOM 1199 CG PHE A 439 8.964 10.705 2.133 1.00 0.00 C ATOM 1200 CD1 PHE A 439 8.167 11.228 3.144 1.00 0.00 C ATOM 1201 CD2 PHE A 439 10.348 10.926 2.135 1.00 0.00 C ATOM 1202 CE1 PHE A 439 8.738 11.979 4.169 1.00 0.00 C ATOM 1203 CE2 PHE A 439 10.925 11.681 3.164 1.00 0.00 C ATOM 1204 CZ PHE A 439 10.115 12.208 4.181 1.00 0.00 C ATOM 0 H PHE A 439 7.608 12.312 1.596 1.00 0.00 H new ATOM 0 HA PHE A 439 8.148 10.845 -0.874 1.00 0.00 H new ATOM 0 HB2 PHE A 439 7.618 9.185 1.474 1.00 0.00 H new ATOM 0 HB3 PHE A 439 9.074 9.324 0.508 1.00 0.00 H new ATOM 0 HD1 PHE A 439 7.102 11.052 3.135 1.00 0.00 H new ATOM 0 HD2 PHE A 439 10.965 10.517 1.349 1.00 0.00 H new ATOM 0 HE1 PHE A 439 8.116 12.384 4.954 1.00 0.00 H new ATOM 0 HE2 PHE A 439 11.991 11.857 3.174 1.00 0.00 H new ATOM 0 HZ PHE A 439 10.558 12.792 4.975 1.00 0.00 H new ATOM 1214 N ASN A 440 5.717 10.425 -1.468 1.00 0.00 N ATOM 1215 CA ASN A 440 4.340 9.959 -1.838 1.00 0.00 C ATOM 1216 C ASN A 440 4.401 8.676 -2.679 1.00 0.00 C ATOM 1217 O ASN A 440 4.926 8.662 -3.774 1.00 0.00 O ATOM 1218 CB ASN A 440 3.654 11.064 -2.654 1.00 0.00 C ATOM 1219 CG ASN A 440 2.133 10.893 -2.591 1.00 0.00 C ATOM 1220 OD1 ASN A 440 1.575 10.067 -3.285 1.00 0.00 O ATOM 1221 ND2 ASN A 440 1.438 11.645 -1.783 1.00 0.00 N ATOM 0 H ASN A 440 6.254 10.824 -2.238 1.00 0.00 H new ATOM 0 HA ASN A 440 3.781 9.746 -0.927 1.00 0.00 H new ATOM 0 HB2 ASN A 440 3.935 12.043 -2.265 1.00 0.00 H new ATOM 0 HB3 ASN A 440 3.990 11.025 -3.690 1.00 0.00 H new ATOM 0 HD21 ASN A 440 0.425 11.540 -1.733 1.00 0.00 H new ATOM 0 HD22 ASN A 440 1.908 12.338 -1.201 1.00 0.00 H new ATOM 1228 N ILE A 441 3.846 7.603 -2.176 1.00 0.00 N ATOM 1229 CA ILE A 441 3.845 6.322 -2.948 1.00 0.00 C ATOM 1230 C ILE A 441 2.743 6.382 -4.019 1.00 0.00 C ATOM 1231 O ILE A 441 1.622 6.759 -3.743 1.00 0.00 O ATOM 1232 CB ILE A 441 3.578 5.111 -2.004 1.00 0.00 C ATOM 1233 CG1 ILE A 441 3.866 5.476 -0.541 1.00 0.00 C ATOM 1234 CG2 ILE A 441 4.464 3.921 -2.398 1.00 0.00 C ATOM 1235 CD1 ILE A 441 5.344 5.811 -0.359 1.00 0.00 C ATOM 0 H ILE A 441 3.393 7.558 -1.263 1.00 0.00 H new ATOM 0 HA ILE A 441 4.821 6.192 -3.416 1.00 0.00 H new ATOM 0 HB ILE A 441 2.527 4.842 -2.106 1.00 0.00 H new ATOM 0 HG12 ILE A 441 3.254 6.328 -0.244 1.00 0.00 H new ATOM 0 HG13 ILE A 441 3.592 4.645 0.109 1.00 0.00 H new ATOM 0 HG21 ILE A 441 4.266 3.083 -1.730 1.00 0.00 H new ATOM 0 HG22 ILE A 441 4.243 3.627 -3.424 1.00 0.00 H new ATOM 0 HG23 ILE A 441 5.513 4.207 -2.321 1.00 0.00 H new ATOM 0 HD11 ILE A 441 5.533 6.068 0.683 1.00 0.00 H new ATOM 0 HD12 ILE A 441 5.949 4.948 -0.636 1.00 0.00 H new ATOM 0 HD13 ILE A 441 5.606 6.657 -0.994 1.00 0.00 H new ATOM 1247 N LYS A 442 3.055 5.996 -5.232 1.00 0.00 N ATOM 1248 CA LYS A 442 2.046 6.004 -6.332 1.00 0.00 C ATOM 1249 C LYS A 442 1.805 4.556 -6.767 1.00 0.00 C ATOM 1250 O LYS A 442 2.605 3.977 -7.474 1.00 0.00 O ATOM 1251 CB LYS A 442 2.619 6.824 -7.502 1.00 0.00 C ATOM 1252 CG LYS A 442 1.501 7.366 -8.414 1.00 0.00 C ATOM 1253 CD LYS A 442 1.115 6.319 -9.476 1.00 0.00 C ATOM 1254 CE LYS A 442 -0.138 6.775 -10.256 1.00 0.00 C ATOM 1255 NZ LYS A 442 -1.205 5.745 -10.109 1.00 0.00 N ATOM 0 H LYS A 442 3.981 5.671 -5.509 1.00 0.00 H new ATOM 0 HA LYS A 442 1.104 6.446 -6.007 1.00 0.00 H new ATOM 0 HB2 LYS A 442 3.206 7.655 -7.112 1.00 0.00 H new ATOM 0 HB3 LYS A 442 3.297 6.201 -8.086 1.00 0.00 H new ATOM 0 HG2 LYS A 442 0.628 7.624 -7.815 1.00 0.00 H new ATOM 0 HG3 LYS A 442 1.834 8.282 -8.902 1.00 0.00 H new ATOM 0 HD2 LYS A 442 1.945 6.169 -10.166 1.00 0.00 H new ATOM 0 HD3 LYS A 442 0.922 5.360 -8.996 1.00 0.00 H new ATOM 0 HE2 LYS A 442 -0.488 7.735 -9.878 1.00 0.00 H new ATOM 0 HE3 LYS A 442 0.105 6.917 -11.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 -1.572 5.489 -11.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 -0.810 4.900 -9.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 -1.978 6.126 -9.527 1.00 0.00 H new ATOM 1269 N LEU A 443 0.711 3.963 -6.351 1.00 0.00 N ATOM 1270 CA LEU A 443 0.424 2.542 -6.743 1.00 0.00 C ATOM 1271 C LEU A 443 -0.593 2.530 -7.889 1.00 0.00 C ATOM 1272 O LEU A 443 -1.535 3.295 -7.914 1.00 0.00 O ATOM 1273 CB LEU A 443 -0.150 1.780 -5.514 1.00 0.00 C ATOM 1274 CG LEU A 443 0.853 0.751 -4.942 1.00 0.00 C ATOM 1275 CD1 LEU A 443 0.883 -0.506 -5.828 1.00 0.00 C ATOM 1276 CD2 LEU A 443 2.269 1.357 -4.827 1.00 0.00 C ATOM 0 H LEU A 443 0.005 4.399 -5.758 1.00 0.00 H new ATOM 0 HA LEU A 443 1.341 2.053 -7.073 1.00 0.00 H new ATOM 0 HB2 LEU A 443 -0.416 2.496 -4.737 1.00 0.00 H new ATOM 0 HB3 LEU A 443 -1.068 1.268 -5.803 1.00 0.00 H new ATOM 0 HG LEU A 443 0.522 0.475 -3.941 1.00 0.00 H new ATOM 0 HD11 LEU A 443 1.592 -1.224 -5.417 1.00 0.00 H new ATOM 0 HD12 LEU A 443 -0.110 -0.954 -5.858 1.00 0.00 H new ATOM 0 HD13 LEU A 443 1.188 -0.232 -6.838 1.00 0.00 H new ATOM 0 HD21 LEU A 443 2.952 0.611 -4.422 1.00 0.00 H new ATOM 0 HD22 LEU A 443 2.613 1.667 -5.814 1.00 0.00 H new ATOM 0 HD23 LEU A 443 2.242 2.222 -4.164 1.00 0.00 H new ATOM 1288 N LEU A 444 -0.404 1.650 -8.831 1.00 0.00 N ATOM 1289 CA LEU A 444 -1.349 1.545 -9.979 1.00 0.00 C ATOM 1290 C LEU A 444 -1.527 0.057 -10.291 1.00 0.00 C ATOM 1291 O LEU A 444 -0.611 -0.728 -10.135 1.00 0.00 O ATOM 1292 CB LEU A 444 -0.758 2.328 -11.175 1.00 0.00 C ATOM 1293 CG LEU A 444 -1.183 1.748 -12.542 1.00 0.00 C ATOM 1294 CD1 LEU A 444 -2.706 1.875 -12.754 1.00 0.00 C ATOM 1295 CD2 LEU A 444 -0.449 2.517 -13.649 1.00 0.00 C ATOM 0 H LEU A 444 0.374 0.991 -8.856 1.00 0.00 H new ATOM 0 HA LEU A 444 -2.325 1.974 -9.755 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -1.075 3.369 -11.113 1.00 0.00 H new ATOM 0 HB3 LEU A 444 0.330 2.321 -11.105 1.00 0.00 H new ATOM 0 HG LEU A 444 -0.925 0.689 -12.571 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -2.974 1.458 -13.725 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -3.229 1.330 -11.968 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -2.992 2.926 -12.719 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -0.738 2.119 -14.622 1.00 0.00 H new ATOM 0 HD22 LEU A 444 -0.714 3.573 -13.595 1.00 0.00 H new ATOM 0 HD23 LEU A 444 0.627 2.406 -13.517 1.00 0.00 H new ATOM 1307 N ILE A 445 -2.697 -0.344 -10.715 1.00 0.00 N ATOM 1308 CA ILE A 445 -2.933 -1.790 -11.019 1.00 0.00 C ATOM 1309 C ILE A 445 -3.864 -1.912 -12.241 1.00 0.00 C ATOM 1310 O ILE A 445 -4.940 -1.348 -12.244 1.00 0.00 O ATOM 1311 CB ILE A 445 -3.611 -2.437 -9.810 1.00 0.00 C ATOM 1312 CG1 ILE A 445 -2.874 -2.010 -8.536 1.00 0.00 C ATOM 1313 CG2 ILE A 445 -3.581 -3.964 -9.947 1.00 0.00 C ATOM 1314 CD1 ILE A 445 -3.435 -2.767 -7.329 1.00 0.00 C ATOM 0 H ILE A 445 -3.501 0.266 -10.864 1.00 0.00 H new ATOM 0 HA ILE A 445 -1.985 -2.284 -11.233 1.00 0.00 H new ATOM 0 HB ILE A 445 -4.650 -2.113 -9.757 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -1.808 -2.211 -8.638 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -2.983 -0.936 -8.385 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -4.066 -4.417 -9.082 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -4.109 -4.258 -10.854 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -2.547 -4.304 -10.003 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -2.906 -2.458 -6.428 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -4.497 -2.544 -7.221 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -3.303 -3.839 -7.478 1.00 0.00 H new ATOM 1326 N PRO A 446 -3.480 -2.637 -13.273 1.00 0.00 N ATOM 1327 CA PRO A 446 -4.339 -2.797 -14.481 1.00 0.00 C ATOM 1328 C PRO A 446 -5.467 -3.807 -14.250 1.00 0.00 C ATOM 1329 O PRO A 446 -5.262 -4.864 -13.686 1.00 0.00 O ATOM 1330 CB PRO A 446 -3.360 -3.301 -15.545 1.00 0.00 C ATOM 1331 CG PRO A 446 -2.346 -4.083 -14.776 1.00 0.00 C ATOM 1332 CD PRO A 446 -2.207 -3.377 -13.420 1.00 0.00 C ATOM 0 HA PRO A 446 -4.842 -1.871 -14.761 1.00 0.00 H new ATOM 0 HB2 PRO A 446 -3.863 -3.923 -16.285 1.00 0.00 H new ATOM 0 HB3 PRO A 446 -2.898 -2.474 -16.084 1.00 0.00 H new ATOM 0 HG2 PRO A 446 -2.667 -5.117 -14.647 1.00 0.00 H new ATOM 0 HG3 PRO A 446 -1.392 -4.109 -15.302 1.00 0.00 H new ATOM 0 HD2 PRO A 446 -2.065 -4.092 -12.610 1.00 0.00 H new ATOM 0 HD3 PRO A 446 -1.350 -2.704 -13.406 1.00 0.00 H new ATOM 1340 N VAL A 447 -6.660 -3.486 -14.679 1.00 0.00 N ATOM 1341 CA VAL A 447 -7.810 -4.421 -14.483 1.00 0.00 C ATOM 1342 C VAL A 447 -8.726 -4.378 -15.708 1.00 0.00 C ATOM 1343 O VAL A 447 -8.496 -3.640 -16.646 1.00 0.00 O ATOM 1344 CB VAL A 447 -8.592 -4.000 -13.237 1.00 0.00 C ATOM 1345 CG1 VAL A 447 -7.626 -3.855 -12.061 1.00 0.00 C ATOM 1346 CG2 VAL A 447 -9.288 -2.659 -13.491 1.00 0.00 C ATOM 0 H VAL A 447 -6.889 -2.615 -15.158 1.00 0.00 H new ATOM 0 HA VAL A 447 -7.437 -5.437 -14.355 1.00 0.00 H new ATOM 0 HB VAL A 447 -9.342 -4.757 -13.007 1.00 0.00 H new ATOM 0 HG11 VAL A 447 -8.179 -3.555 -11.171 1.00 0.00 H new ATOM 0 HG12 VAL A 447 -7.131 -4.809 -11.877 1.00 0.00 H new ATOM 0 HG13 VAL A 447 -6.878 -3.098 -12.296 1.00 0.00 H new ATOM 0 HG21 VAL A 447 -9.844 -2.363 -12.601 1.00 0.00 H new ATOM 0 HG22 VAL A 447 -8.541 -1.899 -13.722 1.00 0.00 H new ATOM 0 HG23 VAL A 447 -9.975 -2.759 -14.331 1.00 0.00 H new ATOM 1356 N ALA A 448 -9.759 -5.172 -15.706 1.00 0.00 N ATOM 1357 CA ALA A 448 -10.692 -5.193 -16.866 1.00 0.00 C ATOM 1358 C ALA A 448 -11.379 -3.832 -17.005 1.00 0.00 C ATOM 1359 O ALA A 448 -11.550 -3.323 -18.095 1.00 0.00 O ATOM 1360 CB ALA A 448 -11.747 -6.276 -16.643 1.00 0.00 C ATOM 0 H ALA A 448 -9.998 -5.810 -14.947 1.00 0.00 H new ATOM 0 HA ALA A 448 -10.132 -5.405 -17.777 1.00 0.00 H new ATOM 0 HB1 ALA A 448 -12.433 -6.296 -17.490 1.00 0.00 H new ATOM 0 HB2 ALA A 448 -11.259 -7.246 -16.549 1.00 0.00 H new ATOM 0 HB3 ALA A 448 -12.303 -6.060 -15.731 1.00 0.00 H new ATOM 1366 N GLU A 449 -11.779 -3.238 -15.912 1.00 0.00 N ATOM 1367 CA GLU A 449 -12.457 -1.912 -15.992 1.00 0.00 C ATOM 1368 C GLU A 449 -11.503 -0.894 -16.614 1.00 0.00 C ATOM 1369 O GLU A 449 -11.910 0.001 -17.326 1.00 0.00 O ATOM 1370 CB GLU A 449 -12.864 -1.457 -14.582 1.00 0.00 C ATOM 1371 CG GLU A 449 -13.287 -2.676 -13.749 1.00 0.00 C ATOM 1372 CD GLU A 449 -14.173 -2.226 -12.585 1.00 0.00 C ATOM 1373 OE1 GLU A 449 -13.759 -1.336 -11.860 1.00 0.00 O ATOM 1374 OE2 GLU A 449 -15.251 -2.779 -12.440 1.00 0.00 O ATOM 0 H GLU A 449 -11.666 -3.613 -14.970 1.00 0.00 H new ATOM 0 HA GLU A 449 -13.351 -1.993 -16.611 1.00 0.00 H new ATOM 0 HB2 GLU A 449 -12.031 -0.946 -14.099 1.00 0.00 H new ATOM 0 HB3 GLU A 449 -13.685 -0.743 -14.642 1.00 0.00 H new ATOM 0 HG2 GLU A 449 -13.827 -3.386 -14.375 1.00 0.00 H new ATOM 0 HG3 GLU A 449 -12.405 -3.192 -13.369 1.00 0.00 H new ATOM 1381 N GLY A 450 -10.235 -1.028 -16.350 1.00 0.00 N ATOM 1382 CA GLY A 450 -9.248 -0.072 -16.925 1.00 0.00 C ATOM 1383 C GLY A 450 -7.976 -0.079 -16.079 1.00 0.00 C ATOM 1384 O GLY A 450 -7.093 -0.890 -16.274 1.00 0.00 O ATOM 0 H GLY A 450 -9.838 -1.759 -15.760 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -9.015 -0.349 -17.953 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -9.672 0.932 -16.954 1.00 0.00 H new ATOM 1388 N MET A 451 -7.872 0.826 -15.144 1.00 0.00 N ATOM 1389 CA MET A 451 -6.665 0.890 -14.288 1.00 0.00 C ATOM 1390 C MET A 451 -7.062 1.447 -12.922 1.00 0.00 C ATOM 1391 O MET A 451 -7.676 2.492 -12.826 1.00 0.00 O ATOM 1392 CB MET A 451 -5.657 1.836 -14.942 1.00 0.00 C ATOM 1393 CG MET A 451 -5.045 1.174 -16.177 1.00 0.00 C ATOM 1394 SD MET A 451 -3.635 2.152 -16.749 1.00 0.00 S ATOM 1395 CE MET A 451 -3.152 1.075 -18.122 1.00 0.00 C ATOM 0 H MET A 451 -8.582 1.529 -14.939 1.00 0.00 H new ATOM 0 HA MET A 451 -6.227 -0.101 -14.171 1.00 0.00 H new ATOM 0 HB2 MET A 451 -6.149 2.767 -15.224 1.00 0.00 H new ATOM 0 HB3 MET A 451 -4.872 2.093 -14.230 1.00 0.00 H new ATOM 0 HG2 MET A 451 -4.725 0.160 -15.938 1.00 0.00 H new ATOM 0 HG3 MET A 451 -5.791 1.095 -16.968 1.00 0.00 H new ATOM 0 HE1 MET A 451 -2.282 1.496 -18.626 1.00 0.00 H new ATOM 0 HE2 MET A 451 -2.905 0.085 -17.738 1.00 0.00 H new ATOM 0 HE3 MET A 451 -3.978 0.994 -18.829 1.00 0.00 H new ATOM 1405 N ASN A 452 -6.709 0.777 -11.860 1.00 0.00 N ATOM 1406 CA ASN A 452 -7.065 1.302 -10.509 1.00 0.00 C ATOM 1407 C ASN A 452 -5.964 2.268 -10.086 1.00 0.00 C ATOM 1408 O ASN A 452 -4.920 1.876 -9.604 1.00 0.00 O ATOM 1409 CB ASN A 452 -7.164 0.145 -9.507 1.00 0.00 C ATOM 1410 CG ASN A 452 -8.529 -0.534 -9.639 1.00 0.00 C ATOM 1411 OD1 ASN A 452 -8.589 -1.820 -9.855 1.00 0.00 O flip ATOM 1412 ND2 ASN A 452 -9.554 0.112 -9.546 1.00 0.00 N flip ATOM 0 H ASN A 452 -6.194 -0.103 -11.867 1.00 0.00 H new ATOM 0 HA ASN A 452 -8.029 1.810 -10.536 1.00 0.00 H new ATOM 0 HB2 ASN A 452 -6.368 -0.577 -9.690 1.00 0.00 H new ATOM 0 HB3 ASN A 452 -7.029 0.518 -8.492 1.00 0.00 H new ATOM 0 HD21 ASN A 452 -9.510 1.117 -9.377 1.00 0.00 H new ATOM 0 HD22 ASN A 452 -10.458 -0.351 -9.637 1.00 0.00 H new ATOM 1419 N GLU A 453 -6.184 3.533 -10.304 1.00 0.00 N ATOM 1420 CA GLU A 453 -5.152 4.549 -9.964 1.00 0.00 C ATOM 1421 C GLU A 453 -5.132 4.797 -8.444 1.00 0.00 C ATOM 1422 O GLU A 453 -6.083 5.290 -7.872 1.00 0.00 O ATOM 1423 CB GLU A 453 -5.454 5.835 -10.774 1.00 0.00 C ATOM 1424 CG GLU A 453 -6.307 6.834 -9.981 1.00 0.00 C ATOM 1425 CD GLU A 453 -6.706 7.994 -10.895 1.00 0.00 C ATOM 1426 OE1 GLU A 453 -5.941 8.940 -10.986 1.00 0.00 O ATOM 1427 OE2 GLU A 453 -7.769 7.916 -11.489 1.00 0.00 O ATOM 0 H GLU A 453 -7.042 3.910 -10.707 1.00 0.00 H new ATOM 0 HA GLU A 453 -4.155 4.198 -10.232 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -4.516 6.309 -11.062 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -5.972 5.569 -11.695 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -7.197 6.341 -9.591 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -5.747 7.207 -9.123 1.00 0.00 H new ATOM 1434 N ILE A 454 -4.046 4.437 -7.787 1.00 0.00 N ATOM 1435 CA ILE A 454 -3.948 4.628 -6.292 1.00 0.00 C ATOM 1436 C ILE A 454 -2.835 5.629 -5.933 1.00 0.00 C ATOM 1437 O ILE A 454 -1.850 5.778 -6.628 1.00 0.00 O ATOM 1438 CB ILE A 454 -3.649 3.284 -5.613 1.00 0.00 C ATOM 1439 CG1 ILE A 454 -4.706 2.238 -6.008 1.00 0.00 C ATOM 1440 CG2 ILE A 454 -3.656 3.468 -4.095 1.00 0.00 C ATOM 1441 CD1 ILE A 454 -6.121 2.766 -5.740 1.00 0.00 C ATOM 0 H ILE A 454 -3.223 4.019 -8.220 1.00 0.00 H new ATOM 0 HA ILE A 454 -4.902 5.021 -5.940 1.00 0.00 H new ATOM 0 HB ILE A 454 -2.669 2.935 -5.938 1.00 0.00 H new ATOM 0 HG12 ILE A 454 -4.600 1.988 -7.064 1.00 0.00 H new ATOM 0 HG13 ILE A 454 -4.543 1.319 -5.445 1.00 0.00 H new ATOM 0 HG21 ILE A 454 -3.444 2.514 -3.612 1.00 0.00 H new ATOM 0 HG22 ILE A 454 -2.894 4.195 -3.813 1.00 0.00 H new ATOM 0 HG23 ILE A 454 -4.635 3.826 -3.776 1.00 0.00 H new ATOM 0 HD11 ILE A 454 -6.852 2.010 -6.027 1.00 0.00 H new ATOM 0 HD12 ILE A 454 -6.230 2.992 -4.679 1.00 0.00 H new ATOM 0 HD13 ILE A 454 -6.288 3.672 -6.323 1.00 0.00 H new ATOM 1453 N TRP A 455 -3.015 6.307 -4.828 1.00 0.00 N ATOM 1454 CA TRP A 455 -2.018 7.322 -4.336 1.00 0.00 C ATOM 1455 C TRP A 455 -2.047 7.318 -2.795 1.00 0.00 C ATOM 1456 O TRP A 455 -3.068 7.583 -2.199 1.00 0.00 O ATOM 1457 CB TRP A 455 -2.375 8.746 -4.860 1.00 0.00 C ATOM 1458 CG TRP A 455 -3.512 8.660 -5.819 1.00 0.00 C ATOM 1459 CD1 TRP A 455 -3.502 9.131 -7.083 1.00 0.00 C ATOM 1460 CD2 TRP A 455 -4.821 8.065 -5.610 1.00 0.00 C ATOM 1461 NE1 TRP A 455 -4.719 8.846 -7.669 1.00 0.00 N ATOM 1462 CE2 TRP A 455 -5.567 8.190 -6.796 1.00 0.00 C ATOM 1463 CE3 TRP A 455 -5.422 7.429 -4.513 1.00 0.00 C ATOM 1464 CZ2 TRP A 455 -6.866 7.695 -6.894 1.00 0.00 C ATOM 1465 CZ3 TRP A 455 -6.724 6.930 -4.606 1.00 0.00 C ATOM 1466 CH2 TRP A 455 -7.448 7.061 -5.794 1.00 0.00 C ATOM 0 H TRP A 455 -3.832 6.200 -4.227 1.00 0.00 H new ATOM 0 HA TRP A 455 -1.025 7.064 -4.704 1.00 0.00 H new ATOM 0 HB2 TRP A 455 -2.640 9.395 -4.025 1.00 0.00 H new ATOM 0 HB3 TRP A 455 -1.508 9.192 -5.348 1.00 0.00 H new ATOM 0 HD1 TRP A 455 -2.679 9.645 -7.557 1.00 0.00 H new ATOM 0 HE1 TRP A 455 -4.963 9.090 -8.629 1.00 0.00 H new ATOM 0 HE3 TRP A 455 -4.873 7.324 -3.589 1.00 0.00 H new ATOM 0 HZ2 TRP A 455 -7.420 7.801 -7.815 1.00 0.00 H new ATOM 0 HZ3 TRP A 455 -7.173 6.440 -3.755 1.00 0.00 H new ATOM 0 HH2 TRP A 455 -8.454 6.673 -5.861 1.00 0.00 H new ATOM 1477 N LEU A 456 -0.954 7.038 -2.142 1.00 0.00 N ATOM 1478 CA LEU A 456 -0.961 7.037 -0.640 1.00 0.00 C ATOM 1479 C LEU A 456 -0.384 8.363 -0.127 1.00 0.00 C ATOM 1480 O LEU A 456 0.331 9.045 -0.834 1.00 0.00 O ATOM 1481 CB LEU A 456 -0.108 5.865 -0.134 1.00 0.00 C ATOM 1482 CG LEU A 456 -0.326 4.640 -1.033 1.00 0.00 C ATOM 1483 CD1 LEU A 456 0.486 3.455 -0.502 1.00 0.00 C ATOM 1484 CD2 LEU A 456 -1.813 4.274 -1.045 1.00 0.00 C ATOM 0 H LEU A 456 -0.058 6.810 -2.574 1.00 0.00 H new ATOM 0 HA LEU A 456 -1.982 6.926 -0.274 1.00 0.00 H new ATOM 0 HB2 LEU A 456 0.946 6.144 -0.132 1.00 0.00 H new ATOM 0 HB3 LEU A 456 -0.376 5.625 0.895 1.00 0.00 H new ATOM 0 HG LEU A 456 0.001 4.875 -2.046 1.00 0.00 H new ATOM 0 HD11 LEU A 456 0.327 2.588 -1.144 1.00 0.00 H new ATOM 0 HD12 LEU A 456 1.545 3.713 -0.496 1.00 0.00 H new ATOM 0 HD13 LEU A 456 0.164 3.219 0.512 1.00 0.00 H new ATOM 0 HD21 LEU A 456 -1.968 3.404 -1.683 1.00 0.00 H new ATOM 0 HD22 LEU A 456 -2.139 4.043 -0.031 1.00 0.00 H new ATOM 0 HD23 LEU A 456 -2.391 5.114 -1.429 1.00 0.00 H new ATOM 1496 N ARG A 457 -0.689 8.747 1.093 1.00 0.00 N ATOM 1497 CA ARG A 457 -0.145 10.040 1.615 1.00 0.00 C ATOM 1498 C ARG A 457 1.284 9.833 2.127 1.00 0.00 C ATOM 1499 O ARG A 457 1.696 8.736 2.447 1.00 0.00 O ATOM 1500 CB ARG A 457 -1.030 10.561 2.754 1.00 0.00 C ATOM 1501 CG ARG A 457 -0.735 12.043 3.008 1.00 0.00 C ATOM 1502 CD ARG A 457 -1.414 12.485 4.303 1.00 0.00 C ATOM 1503 NE ARG A 457 -2.805 11.948 4.354 1.00 0.00 N ATOM 1504 CZ ARG A 457 -3.699 12.363 3.500 1.00 0.00 C ATOM 1505 NH1 ARG A 457 -3.389 13.276 2.624 1.00 0.00 N ATOM 1506 NH2 ARG A 457 -4.912 11.883 3.533 1.00 0.00 N ATOM 0 H ARG A 457 -1.283 8.228 1.740 1.00 0.00 H new ATOM 0 HA ARG A 457 -0.136 10.772 0.807 1.00 0.00 H new ATOM 0 HB2 ARG A 457 -2.081 10.429 2.499 1.00 0.00 H new ATOM 0 HB3 ARG A 457 -0.848 9.984 3.661 1.00 0.00 H new ATOM 0 HG2 ARG A 457 0.341 12.204 3.076 1.00 0.00 H new ATOM 0 HG3 ARG A 457 -1.095 12.644 2.173 1.00 0.00 H new ATOM 0 HD2 ARG A 457 -0.845 12.129 5.162 1.00 0.00 H new ATOM 0 HD3 ARG A 457 -1.432 13.573 4.362 1.00 0.00 H new ATOM 0 HE ARG A 457 -3.057 11.255 5.058 1.00 0.00 H new ATOM 0 HH11 ARG A 457 -2.447 13.666 2.606 1.00 0.00 H new ATOM 0 HH12 ARG A 457 -4.088 13.600 1.956 1.00 0.00 H new ATOM 0 HH21 ARG A 457 -5.164 11.181 4.228 1.00 0.00 H new ATOM 0 HH22 ARG A 457 -5.608 12.210 2.863 1.00 0.00 H new ATOM 1520 N CYS A 458 2.040 10.893 2.186 1.00 0.00 N ATOM 1521 CA CYS A 458 3.455 10.810 2.651 1.00 0.00 C ATOM 1522 C CYS A 458 3.513 10.864 4.179 1.00 0.00 C ATOM 1523 O CYS A 458 2.533 11.160 4.834 1.00 0.00 O ATOM 1524 CB CYS A 458 4.221 12.002 2.075 1.00 0.00 C ATOM 1525 SG CYS A 458 3.243 13.505 2.316 1.00 0.00 S ATOM 0 H CYS A 458 1.733 11.831 1.927 1.00 0.00 H new ATOM 0 HA CYS A 458 3.897 9.872 2.316 1.00 0.00 H new ATOM 0 HB2 CYS A 458 5.189 12.100 2.566 1.00 0.00 H new ATOM 0 HB3 CYS A 458 4.417 11.846 1.014 1.00 0.00 H new ATOM 0 HG CYS A 458 3.888 14.525 1.831 1.00 0.00 H new ATOM 1531 N ASP A 459 4.656 10.577 4.760 1.00 0.00 N ATOM 1532 CA ASP A 459 4.750 10.613 6.243 1.00 0.00 C ATOM 1533 C ASP A 459 6.217 10.530 6.706 1.00 0.00 C ATOM 1534 O ASP A 459 6.565 11.075 7.731 1.00 0.00 O ATOM 1535 CB ASP A 459 3.948 9.429 6.811 1.00 0.00 C ATOM 1536 CG ASP A 459 3.292 9.817 8.144 1.00 0.00 C ATOM 1537 OD1 ASP A 459 3.978 10.391 8.974 1.00 0.00 O ATOM 1538 OD2 ASP A 459 2.117 9.536 8.306 1.00 0.00 O ATOM 0 H ASP A 459 5.515 10.323 4.272 1.00 0.00 H new ATOM 0 HA ASP A 459 4.341 11.555 6.608 1.00 0.00 H new ATOM 0 HB2 ASP A 459 3.183 9.124 6.097 1.00 0.00 H new ATOM 0 HB3 ASP A 459 4.606 8.573 6.958 1.00 0.00 H new ATOM 1543 N ASN A 460 7.078 9.853 5.978 1.00 0.00 N ATOM 1544 CA ASN A 460 8.507 9.753 6.430 1.00 0.00 C ATOM 1545 C ASN A 460 9.279 8.779 5.527 1.00 0.00 C ATOM 1546 O ASN A 460 8.705 7.912 4.899 1.00 0.00 O ATOM 1547 CB ASN A 460 8.551 9.238 7.883 1.00 0.00 C ATOM 1548 CG ASN A 460 7.379 8.284 8.123 1.00 0.00 C ATOM 1549 OD1 ASN A 460 7.326 7.213 7.552 1.00 0.00 O ATOM 1550 ND2 ASN A 460 6.430 8.632 8.948 1.00 0.00 N ATOM 0 H ASN A 460 6.859 9.373 5.105 1.00 0.00 H new ATOM 0 HA ASN A 460 8.967 10.739 6.371 1.00 0.00 H new ATOM 0 HB2 ASN A 460 9.495 8.726 8.070 1.00 0.00 H new ATOM 0 HB3 ASN A 460 8.500 10.076 8.579 1.00 0.00 H new ATOM 0 HD21 ASN A 460 5.643 8.005 9.114 1.00 0.00 H new ATOM 0 HD22 ASN A 460 6.475 9.531 9.427 1.00 0.00 H new ATOM 1557 N GLU A 461 10.583 8.904 5.477 1.00 0.00 N ATOM 1558 CA GLU A 461 11.390 7.972 4.638 1.00 0.00 C ATOM 1559 C GLU A 461 11.081 6.543 5.070 1.00 0.00 C ATOM 1560 O GLU A 461 11.224 5.605 4.312 1.00 0.00 O ATOM 1561 CB GLU A 461 12.885 8.251 4.829 1.00 0.00 C ATOM 1562 CG GLU A 461 13.190 8.406 6.318 1.00 0.00 C ATOM 1563 CD GLU A 461 14.680 8.695 6.509 1.00 0.00 C ATOM 1564 OE1 GLU A 461 15.465 8.209 5.711 1.00 0.00 O ATOM 1565 OE2 GLU A 461 15.012 9.399 7.449 1.00 0.00 O ATOM 0 H GLU A 461 11.120 9.610 5.981 1.00 0.00 H new ATOM 0 HA GLU A 461 11.139 8.113 3.587 1.00 0.00 H new ATOM 0 HB2 GLU A 461 13.474 7.435 4.410 1.00 0.00 H new ATOM 0 HB3 GLU A 461 13.168 9.157 4.293 1.00 0.00 H new ATOM 0 HG2 GLU A 461 12.595 9.217 6.739 1.00 0.00 H new ATOM 0 HG3 GLU A 461 12.914 7.497 6.853 1.00 0.00 H new ATOM 1572 N LYS A 462 10.645 6.375 6.288 1.00 0.00 N ATOM 1573 CA LYS A 462 10.309 5.014 6.776 1.00 0.00 C ATOM 1574 C LYS A 462 9.132 4.483 5.962 1.00 0.00 C ATOM 1575 O LYS A 462 9.180 3.402 5.408 1.00 0.00 O ATOM 1576 CB LYS A 462 9.911 5.094 8.249 1.00 0.00 C ATOM 1577 CG LYS A 462 11.029 5.763 9.048 1.00 0.00 C ATOM 1578 CD LYS A 462 10.550 5.996 10.482 1.00 0.00 C ATOM 1579 CE LYS A 462 11.559 6.871 11.230 1.00 0.00 C ATOM 1580 NZ LYS A 462 11.352 6.717 12.697 1.00 0.00 N ATOM 0 H LYS A 462 10.508 7.125 6.965 1.00 0.00 H new ATOM 0 HA LYS A 462 11.168 4.351 6.667 1.00 0.00 H new ATOM 0 HB2 LYS A 462 8.986 5.660 8.356 1.00 0.00 H new ATOM 0 HB3 LYS A 462 9.720 4.094 8.639 1.00 0.00 H new ATOM 0 HG2 LYS A 462 11.920 5.135 9.047 1.00 0.00 H new ATOM 0 HG3 LYS A 462 11.306 6.710 8.586 1.00 0.00 H new ATOM 0 HD2 LYS A 462 9.572 6.478 10.475 1.00 0.00 H new ATOM 0 HD3 LYS A 462 10.432 5.042 10.995 1.00 0.00 H new ATOM 0 HE2 LYS A 462 12.576 6.583 10.962 1.00 0.00 H new ATOM 0 HE3 LYS A 462 11.437 7.915 10.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 462 12.036 7.310 13.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 462 10.386 7.011 12.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 462 11.489 5.721 12.964 1.00 0.00 H new ATOM 1594 N GLN A 463 8.074 5.242 5.886 1.00 0.00 N ATOM 1595 CA GLN A 463 6.889 4.790 5.107 1.00 0.00 C ATOM 1596 C GLN A 463 7.338 4.318 3.722 1.00 0.00 C ATOM 1597 O GLN A 463 6.948 3.263 3.265 1.00 0.00 O ATOM 1598 CB GLN A 463 5.895 5.945 4.958 1.00 0.00 C ATOM 1599 CG GLN A 463 4.690 5.472 4.145 1.00 0.00 C ATOM 1600 CD GLN A 463 3.580 6.525 4.207 1.00 0.00 C ATOM 1601 OE1 GLN A 463 2.910 6.687 5.316 1.00 0.00 O flip ATOM 1602 NE2 GLN A 463 3.321 7.208 3.235 1.00 0.00 N flip ATOM 0 H GLN A 463 7.979 6.155 6.330 1.00 0.00 H new ATOM 0 HA GLN A 463 6.405 3.967 5.633 1.00 0.00 H new ATOM 0 HB2 GLN A 463 5.573 6.292 5.940 1.00 0.00 H new ATOM 0 HB3 GLN A 463 6.373 6.790 4.463 1.00 0.00 H new ATOM 0 HG2 GLN A 463 4.983 5.299 3.109 1.00 0.00 H new ATOM 0 HG3 GLN A 463 4.326 4.522 4.536 1.00 0.00 H new ATOM 0 HE21 GLN A 463 3.844 7.081 2.369 1.00 0.00 H new ATOM 0 HE22 GLN A 463 2.580 7.908 3.286 1.00 0.00 H new ATOM 1611 N TYR A 464 8.151 5.086 3.041 1.00 0.00 N ATOM 1612 CA TYR A 464 8.606 4.659 1.685 1.00 0.00 C ATOM 1613 C TYR A 464 9.058 3.188 1.724 1.00 0.00 C ATOM 1614 O TYR A 464 8.536 2.350 1.020 1.00 0.00 O ATOM 1615 CB TYR A 464 9.788 5.564 1.240 1.00 0.00 C ATOM 1616 CG TYR A 464 9.469 6.270 -0.064 1.00 0.00 C ATOM 1617 CD1 TYR A 464 8.300 7.019 -0.169 1.00 0.00 C ATOM 1618 CD2 TYR A 464 10.348 6.191 -1.153 1.00 0.00 C ATOM 1619 CE1 TYR A 464 8.000 7.690 -1.354 1.00 0.00 C ATOM 1620 CE2 TYR A 464 10.047 6.860 -2.346 1.00 0.00 C ATOM 1621 CZ TYR A 464 8.873 7.613 -2.446 1.00 0.00 C ATOM 1622 OH TYR A 464 8.577 8.279 -3.618 1.00 0.00 O ATOM 0 H TYR A 464 8.516 5.982 3.363 1.00 0.00 H new ATOM 0 HA TYR A 464 7.784 4.754 0.975 1.00 0.00 H new ATOM 0 HB2 TYR A 464 9.999 6.301 2.015 1.00 0.00 H new ATOM 0 HB3 TYR A 464 10.688 4.961 1.121 1.00 0.00 H new ATOM 0 HD1 TYR A 464 7.623 7.081 0.670 1.00 0.00 H new ATOM 0 HD2 TYR A 464 11.257 5.614 -1.072 1.00 0.00 H new ATOM 0 HE1 TYR A 464 7.092 8.270 -1.430 1.00 0.00 H new ATOM 0 HE2 TYR A 464 10.721 6.794 -3.188 1.00 0.00 H new ATOM 0 HH TYR A 464 9.378 8.324 -4.180 1.00 0.00 H new ATOM 1632 N ALA A 465 10.036 2.882 2.528 1.00 0.00 N ATOM 1633 CA ALA A 465 10.552 1.480 2.594 1.00 0.00 C ATOM 1634 C ALA A 465 9.440 0.479 2.928 1.00 0.00 C ATOM 1635 O ALA A 465 9.545 -0.690 2.617 1.00 0.00 O ATOM 1636 CB ALA A 465 11.640 1.395 3.666 1.00 0.00 C ATOM 0 H ALA A 465 10.505 3.543 3.147 1.00 0.00 H new ATOM 0 HA ALA A 465 10.955 1.223 1.614 1.00 0.00 H new ATOM 0 HB1 ALA A 465 12.020 0.375 3.719 1.00 0.00 H new ATOM 0 HB2 ALA A 465 12.455 2.073 3.412 1.00 0.00 H new ATOM 0 HB3 ALA A 465 11.222 1.677 4.632 1.00 0.00 H new ATOM 1642 N HIS A 466 8.391 0.904 3.572 1.00 0.00 N ATOM 1643 CA HIS A 466 7.311 -0.063 3.929 1.00 0.00 C ATOM 1644 C HIS A 466 6.619 -0.596 2.669 1.00 0.00 C ATOM 1645 O HIS A 466 6.609 -1.784 2.417 1.00 0.00 O ATOM 1646 CB HIS A 466 6.281 0.625 4.825 1.00 0.00 C ATOM 1647 CG HIS A 466 6.949 1.070 6.096 1.00 0.00 C ATOM 1648 ND1 HIS A 466 8.280 0.780 6.371 1.00 0.00 N ATOM 1649 CD2 HIS A 466 6.487 1.778 7.177 1.00 0.00 C ATOM 1650 CE1 HIS A 466 8.568 1.308 7.576 1.00 0.00 C ATOM 1651 NE2 HIS A 466 7.511 1.925 8.107 1.00 0.00 N ATOM 0 H HIS A 466 8.232 1.868 3.865 1.00 0.00 H new ATOM 0 HA HIS A 466 7.760 -0.902 4.460 1.00 0.00 H new ATOM 0 HB2 HIS A 466 5.847 1.482 4.309 1.00 0.00 H new ATOM 0 HB3 HIS A 466 5.463 -0.059 5.050 1.00 0.00 H new ATOM 0 HD2 HIS A 466 5.484 2.162 7.288 1.00 0.00 H new ATOM 0 HE1 HIS A 466 9.535 1.240 8.053 1.00 0.00 H new ATOM 0 HE2 HIS A 466 7.464 2.404 9.006 1.00 0.00 H new ATOM 1660 N TRP A 467 6.017 0.263 1.890 1.00 0.00 N ATOM 1661 CA TRP A 467 5.296 -0.205 0.660 1.00 0.00 C ATOM 1662 C TRP A 467 6.189 -0.093 -0.582 1.00 0.00 C ATOM 1663 O TRP A 467 6.243 -0.998 -1.391 1.00 0.00 O ATOM 1664 CB TRP A 467 4.045 0.661 0.448 1.00 0.00 C ATOM 1665 CG TRP A 467 2.938 0.185 1.331 1.00 0.00 C ATOM 1666 CD1 TRP A 467 3.045 -0.037 2.659 1.00 0.00 C ATOM 1667 CD2 TRP A 467 1.565 -0.137 0.970 1.00 0.00 C ATOM 1668 NE1 TRP A 467 1.822 -0.465 3.138 1.00 0.00 N ATOM 1669 CE2 TRP A 467 0.878 -0.543 2.136 1.00 0.00 C ATOM 1670 CE3 TRP A 467 0.856 -0.112 -0.244 1.00 0.00 C ATOM 1671 CZ2 TRP A 467 -0.466 -0.911 2.102 1.00 0.00 C ATOM 1672 CZ3 TRP A 467 -0.498 -0.485 -0.284 1.00 0.00 C ATOM 1673 CH2 TRP A 467 -1.158 -0.882 0.888 1.00 0.00 C ATOM 0 H TRP A 467 5.991 1.270 2.049 1.00 0.00 H new ATOM 0 HA TRP A 467 5.022 -1.251 0.801 1.00 0.00 H new ATOM 0 HB2 TRP A 467 4.273 1.704 0.667 1.00 0.00 H new ATOM 0 HB3 TRP A 467 3.734 0.616 -0.596 1.00 0.00 H new ATOM 0 HD1 TRP A 467 3.939 0.098 3.249 1.00 0.00 H new ATOM 0 HE1 TRP A 467 1.639 -0.695 4.115 1.00 0.00 H new ATOM 0 HE3 TRP A 467 1.355 0.196 -1.151 1.00 0.00 H new ATOM 0 HZ2 TRP A 467 -0.969 -1.216 3.007 1.00 0.00 H new ATOM 0 HZ3 TRP A 467 -1.033 -0.466 -1.222 1.00 0.00 H new ATOM 0 HH2 TRP A 467 -2.200 -1.165 0.853 1.00 0.00 H new ATOM 1684 N MET A 468 6.853 1.017 -0.768 1.00 0.00 N ATOM 1685 CA MET A 468 7.697 1.180 -1.990 1.00 0.00 C ATOM 1686 C MET A 468 8.529 -0.091 -2.233 1.00 0.00 C ATOM 1687 O MET A 468 8.711 -0.513 -3.358 1.00 0.00 O ATOM 1688 CB MET A 468 8.582 2.442 -1.845 1.00 0.00 C ATOM 1689 CG MET A 468 9.989 2.103 -1.326 1.00 0.00 C ATOM 1690 SD MET A 468 11.008 1.462 -2.684 1.00 0.00 S ATOM 1691 CE MET A 468 11.075 2.965 -3.694 1.00 0.00 C ATOM 0 H MET A 468 6.849 1.814 -0.131 1.00 0.00 H new ATOM 0 HA MET A 468 7.062 1.319 -2.865 1.00 0.00 H new ATOM 0 HB2 MET A 468 8.662 2.941 -2.811 1.00 0.00 H new ATOM 0 HB3 MET A 468 8.103 3.144 -1.162 1.00 0.00 H new ATOM 0 HG2 MET A 468 10.453 2.992 -0.899 1.00 0.00 H new ATOM 0 HG3 MET A 468 9.924 1.363 -0.528 1.00 0.00 H new ATOM 0 HE1 MET A 468 11.997 2.972 -4.275 1.00 0.00 H new ATOM 0 HE2 MET A 468 10.220 2.988 -4.369 1.00 0.00 H new ATOM 0 HE3 MET A 468 11.049 3.841 -3.045 1.00 0.00 H new ATOM 1701 N ALA A 469 9.017 -0.715 -1.194 1.00 0.00 N ATOM 1702 CA ALA A 469 9.810 -1.962 -1.382 1.00 0.00 C ATOM 1703 C ALA A 469 8.845 -3.139 -1.527 1.00 0.00 C ATOM 1704 O ALA A 469 8.955 -3.939 -2.433 1.00 0.00 O ATOM 1705 CB ALA A 469 10.712 -2.187 -0.163 1.00 0.00 C ATOM 0 H ALA A 469 8.901 -0.415 -0.226 1.00 0.00 H new ATOM 0 HA ALA A 469 10.431 -1.876 -2.274 1.00 0.00 H new ATOM 0 HB1 ALA A 469 11.291 -3.100 -0.303 1.00 0.00 H new ATOM 0 HB2 ALA A 469 11.390 -1.341 -0.051 1.00 0.00 H new ATOM 0 HB3 ALA A 469 10.097 -2.281 0.732 1.00 0.00 H new ATOM 1711 N ALA A 470 7.898 -3.243 -0.634 1.00 0.00 N ATOM 1712 CA ALA A 470 6.917 -4.361 -0.700 1.00 0.00 C ATOM 1713 C ALA A 470 6.223 -4.369 -2.062 1.00 0.00 C ATOM 1714 O ALA A 470 6.161 -5.382 -2.732 1.00 0.00 O ATOM 1715 CB ALA A 470 5.883 -4.182 0.405 1.00 0.00 C ATOM 0 H ALA A 470 7.762 -2.596 0.143 1.00 0.00 H new ATOM 0 HA ALA A 470 7.437 -5.309 -0.566 1.00 0.00 H new ATOM 0 HB1 ALA A 470 5.161 -4.997 0.363 1.00 0.00 H new ATOM 0 HB2 ALA A 470 6.382 -4.188 1.374 1.00 0.00 H new ATOM 0 HB3 ALA A 470 5.366 -3.232 0.269 1.00 0.00 H new ATOM 1721 N CYS A 471 5.697 -3.251 -2.481 1.00 0.00 N ATOM 1722 CA CYS A 471 5.008 -3.205 -3.800 1.00 0.00 C ATOM 1723 C CYS A 471 5.917 -3.835 -4.858 1.00 0.00 C ATOM 1724 O CYS A 471 5.460 -4.472 -5.787 1.00 0.00 O ATOM 1725 CB CYS A 471 4.700 -1.754 -4.170 1.00 0.00 C ATOM 1726 SG CYS A 471 6.249 -0.852 -4.417 1.00 0.00 S ATOM 0 H CYS A 471 5.715 -2.370 -1.968 1.00 0.00 H new ATOM 0 HA CYS A 471 4.071 -3.760 -3.748 1.00 0.00 H new ATOM 0 HB2 CYS A 471 4.098 -1.719 -5.078 1.00 0.00 H new ATOM 0 HB3 CYS A 471 4.114 -1.283 -3.381 1.00 0.00 H new ATOM 0 HG CYS A 471 7.184 -1.389 -3.691 1.00 0.00 H new ATOM 1732 N ARG A 472 7.204 -3.679 -4.710 1.00 0.00 N ATOM 1733 CA ARG A 472 8.146 -4.288 -5.689 1.00 0.00 C ATOM 1734 C ARG A 472 8.103 -5.805 -5.499 1.00 0.00 C ATOM 1735 O ARG A 472 7.908 -6.568 -6.431 1.00 0.00 O ATOM 1736 CB ARG A 472 9.565 -3.768 -5.419 1.00 0.00 C ATOM 1737 CG ARG A 472 10.448 -3.953 -6.667 1.00 0.00 C ATOM 1738 CD ARG A 472 11.800 -3.233 -6.479 1.00 0.00 C ATOM 1739 NE ARG A 472 12.888 -4.046 -7.099 1.00 0.00 N ATOM 1740 CZ ARG A 472 12.894 -4.271 -8.385 1.00 0.00 C ATOM 1741 NH1 ARG A 472 11.952 -3.776 -9.141 1.00 0.00 N ATOM 1742 NH2 ARG A 472 13.846 -4.989 -8.918 1.00 0.00 N ATOM 0 H ARG A 472 7.643 -3.156 -3.953 1.00 0.00 H new ATOM 0 HA ARG A 472 7.865 -4.028 -6.710 1.00 0.00 H new ATOM 0 HB2 ARG A 472 9.527 -2.714 -5.145 1.00 0.00 H new ATOM 0 HB3 ARG A 472 10.001 -4.302 -4.574 1.00 0.00 H new ATOM 0 HG2 ARG A 472 10.616 -5.015 -6.848 1.00 0.00 H new ATOM 0 HG3 ARG A 472 9.937 -3.557 -7.544 1.00 0.00 H new ATOM 0 HD2 ARG A 472 11.764 -2.244 -6.937 1.00 0.00 H new ATOM 0 HD3 ARG A 472 12.001 -3.086 -5.418 1.00 0.00 H new ATOM 0 HE ARG A 472 13.631 -4.428 -6.514 1.00 0.00 H new ATOM 0 HH11 ARG A 472 11.209 -3.212 -8.727 1.00 0.00 H new ATOM 0 HH12 ARG A 472 11.958 -3.953 -10.146 1.00 0.00 H new ATOM 0 HH21 ARG A 472 14.585 -5.374 -8.329 1.00 0.00 H new ATOM 0 HH22 ARG A 472 13.851 -5.165 -9.923 1.00 0.00 H new ATOM 1756 N LEU A 473 8.267 -6.250 -4.283 1.00 0.00 N ATOM 1757 CA LEU A 473 8.215 -7.716 -4.028 1.00 0.00 C ATOM 1758 C LEU A 473 6.931 -8.261 -4.645 1.00 0.00 C ATOM 1759 O LEU A 473 6.852 -9.404 -5.044 1.00 0.00 O ATOM 1760 CB LEU A 473 8.216 -8.011 -2.526 1.00 0.00 C ATOM 1761 CG LEU A 473 9.332 -7.230 -1.827 1.00 0.00 C ATOM 1762 CD1 LEU A 473 9.482 -7.737 -0.391 1.00 0.00 C ATOM 1763 CD2 LEU A 473 10.656 -7.424 -2.578 1.00 0.00 C ATOM 0 H LEU A 473 8.433 -5.667 -3.462 1.00 0.00 H new ATOM 0 HA LEU A 473 9.092 -8.189 -4.469 1.00 0.00 H new ATOM 0 HB2 LEU A 473 7.251 -7.742 -2.096 1.00 0.00 H new ATOM 0 HB3 LEU A 473 8.352 -9.080 -2.359 1.00 0.00 H new ATOM 0 HG LEU A 473 9.078 -6.170 -1.819 1.00 0.00 H new ATOM 0 HD11 LEU A 473 10.276 -7.183 0.109 1.00 0.00 H new ATOM 0 HD12 LEU A 473 8.544 -7.592 0.146 1.00 0.00 H new ATOM 0 HD13 LEU A 473 9.733 -8.798 -0.404 1.00 0.00 H new ATOM 0 HD21 LEU A 473 11.445 -6.865 -2.075 1.00 0.00 H new ATOM 0 HD22 LEU A 473 10.914 -8.483 -2.593 1.00 0.00 H new ATOM 0 HD23 LEU A 473 10.551 -7.062 -3.601 1.00 0.00 H new ATOM 1775 N ALA A 474 5.926 -7.436 -4.745 1.00 0.00 N ATOM 1776 CA ALA A 474 4.655 -7.892 -5.363 1.00 0.00 C ATOM 1777 C ALA A 474 4.994 -8.486 -6.729 1.00 0.00 C ATOM 1778 O ALA A 474 4.444 -9.484 -7.149 1.00 0.00 O ATOM 1779 CB ALA A 474 3.711 -6.689 -5.516 1.00 0.00 C ATOM 0 H ALA A 474 5.932 -6.467 -4.425 1.00 0.00 H new ATOM 0 HA ALA A 474 4.160 -8.641 -4.746 1.00 0.00 H new ATOM 0 HB1 ALA A 474 2.775 -7.016 -5.969 1.00 0.00 H new ATOM 0 HB2 ALA A 474 3.508 -6.259 -4.535 1.00 0.00 H new ATOM 0 HB3 ALA A 474 4.179 -5.938 -6.152 1.00 0.00 H new ATOM 1785 N SER A 475 5.922 -7.874 -7.412 1.00 0.00 N ATOM 1786 CA SER A 475 6.340 -8.383 -8.740 1.00 0.00 C ATOM 1787 C SER A 475 6.607 -9.887 -8.641 1.00 0.00 C ATOM 1788 O SER A 475 6.056 -10.672 -9.387 1.00 0.00 O ATOM 1789 CB SER A 475 7.613 -7.651 -9.170 1.00 0.00 C ATOM 1790 OG SER A 475 7.535 -6.296 -8.753 1.00 0.00 O ATOM 0 H SER A 475 6.411 -7.035 -7.100 1.00 0.00 H new ATOM 0 HA SER A 475 5.555 -8.209 -9.476 1.00 0.00 H new ATOM 0 HB2 SER A 475 8.488 -8.130 -8.731 1.00 0.00 H new ATOM 0 HB3 SER A 475 7.730 -7.705 -10.252 1.00 0.00 H new ATOM 0 HG SER A 475 8.028 -6.183 -7.914 1.00 0.00 H new ATOM 1796 N LYS A 476 7.440 -10.300 -7.717 1.00 0.00 N ATOM 1797 CA LYS A 476 7.714 -11.760 -7.581 1.00 0.00 C ATOM 1798 C LYS A 476 6.525 -12.422 -6.884 1.00 0.00 C ATOM 1799 O LYS A 476 6.572 -13.576 -6.508 1.00 0.00 O ATOM 1800 CB LYS A 476 8.997 -11.992 -6.769 1.00 0.00 C ATOM 1801 CG LYS A 476 8.957 -11.190 -5.463 1.00 0.00 C ATOM 1802 CD LYS A 476 10.171 -11.546 -4.572 1.00 0.00 C ATOM 1803 CE LYS A 476 11.409 -10.742 -4.997 1.00 0.00 C ATOM 1804 NZ LYS A 476 11.932 -11.268 -6.290 1.00 0.00 N ATOM 0 H LYS A 476 7.935 -9.697 -7.060 1.00 0.00 H new ATOM 0 HA LYS A 476 7.854 -12.197 -8.570 1.00 0.00 H new ATOM 0 HB2 LYS A 476 9.108 -13.054 -6.548 1.00 0.00 H new ATOM 0 HB3 LYS A 476 9.866 -11.697 -7.358 1.00 0.00 H new ATOM 0 HG2 LYS A 476 8.961 -10.123 -5.684 1.00 0.00 H new ATOM 0 HG3 LYS A 476 8.031 -11.401 -4.928 1.00 0.00 H new ATOM 0 HD2 LYS A 476 9.936 -11.337 -3.528 1.00 0.00 H new ATOM 0 HD3 LYS A 476 10.381 -12.613 -4.644 1.00 0.00 H new ATOM 0 HE2 LYS A 476 11.152 -9.688 -5.100 1.00 0.00 H new ATOM 0 HE3 LYS A 476 12.179 -10.809 -4.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 12.971 -11.297 -6.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 11.564 -12.228 -6.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 11.626 -10.647 -7.066 1.00 0.00 H new ATOM 1818 N GLY A 477 5.451 -11.694 -6.722 1.00 0.00 N ATOM 1819 CA GLY A 477 4.243 -12.268 -6.064 1.00 0.00 C ATOM 1820 C GLY A 477 4.503 -12.461 -4.570 1.00 0.00 C ATOM 1821 O GLY A 477 3.615 -12.313 -3.754 1.00 0.00 O ATOM 0 H GLY A 477 5.360 -10.722 -7.019 1.00 0.00 H new ATOM 0 HA2 GLY A 477 3.390 -11.606 -6.210 1.00 0.00 H new ATOM 0 HA3 GLY A 477 3.988 -13.223 -6.523 1.00 0.00 H new ATOM 1825 N LYS A 478 5.709 -12.793 -4.201 1.00 0.00 N ATOM 1826 CA LYS A 478 6.016 -12.998 -2.757 1.00 0.00 C ATOM 1827 C LYS A 478 6.268 -11.639 -2.101 1.00 0.00 C ATOM 1828 O LYS A 478 6.636 -10.677 -2.745 1.00 0.00 O ATOM 1829 CB LYS A 478 7.264 -13.901 -2.629 1.00 0.00 C ATOM 1830 CG LYS A 478 7.893 -13.847 -1.214 1.00 0.00 C ATOM 1831 CD LYS A 478 6.949 -14.463 -0.159 1.00 0.00 C ATOM 1832 CE LYS A 478 6.767 -15.972 -0.404 1.00 0.00 C ATOM 1833 NZ LYS A 478 5.437 -16.213 -1.030 1.00 0.00 N ATOM 0 H LYS A 478 6.495 -12.931 -4.836 1.00 0.00 H new ATOM 0 HA LYS A 478 5.177 -13.482 -2.256 1.00 0.00 H new ATOM 0 HB2 LYS A 478 6.989 -14.930 -2.862 1.00 0.00 H new ATOM 0 HB3 LYS A 478 8.007 -13.595 -3.365 1.00 0.00 H new ATOM 0 HG2 LYS A 478 8.842 -14.384 -1.214 1.00 0.00 H new ATOM 0 HG3 LYS A 478 8.112 -12.812 -0.950 1.00 0.00 H new ATOM 0 HD2 LYS A 478 7.355 -14.298 0.839 1.00 0.00 H new ATOM 0 HD3 LYS A 478 5.980 -13.964 -0.196 1.00 0.00 H new ATOM 0 HE2 LYS A 478 7.560 -16.345 -1.053 1.00 0.00 H new ATOM 0 HE3 LYS A 478 6.843 -16.517 0.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 478 5.003 -17.059 -0.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 478 4.822 -15.390 -0.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 478 5.556 -16.359 -2.053 1.00 0.00 H new ATOM 1847 N THR A 479 6.097 -11.578 -0.812 1.00 0.00 N ATOM 1848 CA THR A 479 6.343 -10.319 -0.053 1.00 0.00 C ATOM 1849 C THR A 479 7.057 -10.699 1.239 1.00 0.00 C ATOM 1850 O THR A 479 7.031 -11.847 1.638 1.00 0.00 O ATOM 1851 CB THR A 479 5.018 -9.630 0.274 1.00 0.00 C ATOM 1852 OG1 THR A 479 4.418 -9.161 -0.926 1.00 0.00 O ATOM 1853 CG2 THR A 479 5.280 -8.451 1.214 1.00 0.00 C ATOM 0 H THR A 479 5.790 -12.364 -0.239 1.00 0.00 H new ATOM 0 HA THR A 479 6.946 -9.630 -0.644 1.00 0.00 H new ATOM 0 HB THR A 479 4.346 -10.339 0.758 1.00 0.00 H new ATOM 0 HG1 THR A 479 3.466 -9.393 -0.928 1.00 0.00 H new ATOM 0 HG21 THR A 479 4.337 -7.957 1.450 1.00 0.00 H new ATOM 0 HG22 THR A 479 5.739 -8.814 2.134 1.00 0.00 H new ATOM 0 HG23 THR A 479 5.950 -7.741 0.729 1.00 0.00 H new ATOM 1861 N MET A 480 7.689 -9.761 1.903 1.00 0.00 N ATOM 1862 CA MET A 480 8.400 -10.083 3.166 1.00 0.00 C ATOM 1863 C MET A 480 9.139 -11.416 3.003 1.00 0.00 C ATOM 1864 O MET A 480 9.186 -12.239 3.894 1.00 0.00 O ATOM 1865 CB MET A 480 7.356 -10.168 4.273 1.00 0.00 C ATOM 1866 CG MET A 480 7.988 -10.245 5.664 1.00 0.00 C ATOM 1867 SD MET A 480 9.191 -8.914 5.927 1.00 0.00 S ATOM 1868 CE MET A 480 10.153 -9.735 7.222 1.00 0.00 C ATOM 0 H MET A 480 7.739 -8.783 1.617 1.00 0.00 H new ATOM 0 HA MET A 480 9.136 -9.318 3.415 1.00 0.00 H new ATOM 0 HB2 MET A 480 6.703 -9.297 4.221 1.00 0.00 H new ATOM 0 HB3 MET A 480 6.730 -11.046 4.112 1.00 0.00 H new ATOM 0 HG2 MET A 480 7.207 -10.185 6.422 1.00 0.00 H new ATOM 0 HG3 MET A 480 8.480 -11.210 5.788 1.00 0.00 H new ATOM 0 HE1 MET A 480 10.965 -9.082 7.541 1.00 0.00 H new ATOM 0 HE2 MET A 480 9.507 -9.953 8.073 1.00 0.00 H new ATOM 0 HE3 MET A 480 10.567 -10.665 6.833 1.00 0.00 H new ATOM 1878 N ALA A 481 9.703 -11.635 1.851 1.00 0.00 N ATOM 1879 CA ALA A 481 10.424 -12.913 1.616 1.00 0.00 C ATOM 1880 C ALA A 481 11.501 -13.068 2.683 1.00 0.00 C ATOM 1881 O ALA A 481 11.487 -14.009 3.445 1.00 0.00 O ATOM 1882 CB ALA A 481 11.077 -12.891 0.232 1.00 0.00 C ATOM 0 H ALA A 481 9.696 -10.986 1.064 1.00 0.00 H new ATOM 0 HA ALA A 481 9.724 -13.747 1.666 1.00 0.00 H new ATOM 0 HB1 ALA A 481 11.605 -13.830 0.064 1.00 0.00 H new ATOM 0 HB2 ALA A 481 10.309 -12.765 -0.531 1.00 0.00 H new ATOM 0 HB3 ALA A 481 11.783 -12.063 0.176 1.00 0.00 H new ATOM 1888 N ASP A 482 12.415 -12.132 2.742 1.00 0.00 N ATOM 1889 CA ASP A 482 13.517 -12.174 3.766 1.00 0.00 C ATOM 1890 C ASP A 482 14.687 -11.301 3.275 1.00 0.00 C ATOM 1891 O ASP A 482 14.656 -10.092 3.385 1.00 0.00 O ATOM 1892 CB ASP A 482 14.004 -13.632 3.991 1.00 0.00 C ATOM 1893 CG ASP A 482 13.297 -14.249 5.208 1.00 0.00 C ATOM 1894 OD1 ASP A 482 13.213 -13.577 6.222 1.00 0.00 O ATOM 1895 OD2 ASP A 482 12.855 -15.381 5.101 1.00 0.00 O ATOM 0 H ASP A 482 12.449 -11.327 2.117 1.00 0.00 H new ATOM 0 HA ASP A 482 13.139 -11.792 4.714 1.00 0.00 H new ATOM 0 HB2 ASP A 482 13.803 -14.231 3.103 1.00 0.00 H new ATOM 0 HB3 ASP A 482 15.083 -13.643 4.145 1.00 0.00 H new ATOM 1900 N SER A 483 15.718 -11.909 2.745 1.00 0.00 N ATOM 1901 CA SER A 483 16.888 -11.124 2.261 1.00 0.00 C ATOM 1902 C SER A 483 16.428 -10.093 1.234 1.00 0.00 C ATOM 1903 O SER A 483 16.797 -8.937 1.294 1.00 0.00 O ATOM 1904 CB SER A 483 17.901 -12.068 1.614 1.00 0.00 C ATOM 1905 OG SER A 483 19.091 -11.350 1.319 1.00 0.00 O ATOM 0 H SER A 483 15.798 -12.919 2.627 1.00 0.00 H new ATOM 0 HA SER A 483 17.351 -10.611 3.104 1.00 0.00 H new ATOM 0 HB2 SER A 483 18.121 -12.899 2.284 1.00 0.00 H new ATOM 0 HB3 SER A 483 17.485 -12.496 0.702 1.00 0.00 H new ATOM 0 HG SER A 483 19.743 -11.953 0.905 1.00 0.00 H new ATOM 1911 N SER A 484 15.622 -10.494 0.291 1.00 0.00 N ATOM 1912 CA SER A 484 15.144 -9.522 -0.729 1.00 0.00 C ATOM 1913 C SER A 484 14.592 -8.283 -0.020 1.00 0.00 C ATOM 1914 O SER A 484 15.043 -7.176 -0.236 1.00 0.00 O ATOM 1915 CB SER A 484 14.037 -10.162 -1.568 1.00 0.00 C ATOM 1916 OG SER A 484 13.345 -9.145 -2.282 1.00 0.00 O ATOM 0 H SER A 484 15.276 -11.447 0.183 1.00 0.00 H new ATOM 0 HA SER A 484 15.971 -9.238 -1.379 1.00 0.00 H new ATOM 0 HB2 SER A 484 14.463 -10.886 -2.263 1.00 0.00 H new ATOM 0 HB3 SER A 484 13.346 -10.707 -0.925 1.00 0.00 H new ATOM 0 HG SER A 484 13.421 -9.311 -3.245 1.00 0.00 H new ATOM 1922 N TYR A 485 13.620 -8.470 0.828 1.00 0.00 N ATOM 1923 CA TYR A 485 13.025 -7.317 1.561 1.00 0.00 C ATOM 1924 C TYR A 485 14.125 -6.525 2.278 1.00 0.00 C ATOM 1925 O TYR A 485 13.970 -5.360 2.561 1.00 0.00 O ATOM 1926 CB TYR A 485 12.009 -7.849 2.584 1.00 0.00 C ATOM 1927 CG TYR A 485 11.583 -6.743 3.530 1.00 0.00 C ATOM 1928 CD1 TYR A 485 10.998 -5.576 3.024 1.00 0.00 C ATOM 1929 CD2 TYR A 485 11.777 -6.884 4.912 1.00 0.00 C ATOM 1930 CE1 TYR A 485 10.606 -4.553 3.896 1.00 0.00 C ATOM 1931 CE2 TYR A 485 11.384 -5.861 5.782 1.00 0.00 C ATOM 1932 CZ TYR A 485 10.800 -4.695 5.274 1.00 0.00 C ATOM 1933 OH TYR A 485 10.415 -3.686 6.133 1.00 0.00 O ATOM 0 H TYR A 485 13.209 -9.378 1.047 1.00 0.00 H new ATOM 0 HA TYR A 485 12.524 -6.654 0.856 1.00 0.00 H new ATOM 0 HB2 TYR A 485 11.137 -8.249 2.066 1.00 0.00 H new ATOM 0 HB3 TYR A 485 12.449 -8.671 3.149 1.00 0.00 H new ATOM 0 HD1 TYR A 485 10.849 -5.465 1.960 1.00 0.00 H new ATOM 0 HD2 TYR A 485 12.230 -7.782 5.305 1.00 0.00 H new ATOM 0 HE1 TYR A 485 10.154 -3.654 3.504 1.00 0.00 H new ATOM 0 HE2 TYR A 485 11.531 -5.971 6.846 1.00 0.00 H new ATOM 0 HH TYR A 485 10.620 -3.946 7.055 1.00 0.00 H new ATOM 1943 N ASN A 486 15.228 -7.145 2.591 1.00 0.00 N ATOM 1944 CA ASN A 486 16.318 -6.410 3.304 1.00 0.00 C ATOM 1945 C ASN A 486 17.197 -5.638 2.313 1.00 0.00 C ATOM 1946 O ASN A 486 17.613 -4.529 2.569 1.00 0.00 O ATOM 1947 CB ASN A 486 17.187 -7.410 4.061 1.00 0.00 C ATOM 1948 CG ASN A 486 16.356 -8.083 5.155 1.00 0.00 C ATOM 1949 OD1 ASN A 486 15.455 -7.482 5.705 1.00 0.00 O ATOM 1950 ND2 ASN A 486 16.619 -9.316 5.495 1.00 0.00 N ATOM 0 H ASN A 486 15.425 -8.125 2.387 1.00 0.00 H new ATOM 0 HA ASN A 486 15.862 -5.701 3.995 1.00 0.00 H new ATOM 0 HB2 ASN A 486 17.579 -8.160 3.374 1.00 0.00 H new ATOM 0 HB3 ASN A 486 18.045 -6.902 4.502 1.00 0.00 H new ATOM 0 HD21 ASN A 486 16.068 -9.773 6.222 1.00 0.00 H new ATOM 0 HD22 ASN A 486 17.375 -9.822 5.034 1.00 0.00 H new ATOM 1957 N LEU A 487 17.510 -6.231 1.199 1.00 0.00 N ATOM 1958 CA LEU A 487 18.393 -5.547 0.208 1.00 0.00 C ATOM 1959 C LEU A 487 17.619 -4.456 -0.549 1.00 0.00 C ATOM 1960 O LEU A 487 18.206 -3.554 -1.113 1.00 0.00 O ATOM 1961 CB LEU A 487 18.935 -6.599 -0.779 1.00 0.00 C ATOM 1962 CG LEU A 487 20.224 -7.222 -0.227 1.00 0.00 C ATOM 1963 CD1 LEU A 487 19.933 -7.899 1.114 1.00 0.00 C ATOM 1964 CD2 LEU A 487 20.752 -8.263 -1.219 1.00 0.00 C ATOM 0 H LEU A 487 17.194 -7.162 0.927 1.00 0.00 H new ATOM 0 HA LEU A 487 19.221 -5.067 0.731 1.00 0.00 H new ATOM 0 HB2 LEU A 487 18.187 -7.375 -0.943 1.00 0.00 H new ATOM 0 HB3 LEU A 487 19.130 -6.136 -1.746 1.00 0.00 H new ATOM 0 HG LEU A 487 20.971 -6.441 -0.084 1.00 0.00 H new ATOM 0 HD11 LEU A 487 20.849 -8.341 1.505 1.00 0.00 H new ATOM 0 HD12 LEU A 487 19.557 -7.159 1.821 1.00 0.00 H new ATOM 0 HD13 LEU A 487 19.185 -8.679 0.973 1.00 0.00 H new ATOM 0 HD21 LEU A 487 21.668 -8.706 -0.828 1.00 0.00 H new ATOM 0 HD22 LEU A 487 20.003 -9.042 -1.361 1.00 0.00 H new ATOM 0 HD23 LEU A 487 20.961 -7.782 -2.174 1.00 0.00 H new ATOM 1976 N GLU A 488 16.319 -4.531 -0.584 1.00 0.00 N ATOM 1977 CA GLU A 488 15.538 -3.496 -1.325 1.00 0.00 C ATOM 1978 C GLU A 488 15.456 -2.206 -0.504 1.00 0.00 C ATOM 1979 O GLU A 488 15.619 -1.120 -1.022 1.00 0.00 O ATOM 1980 CB GLU A 488 14.119 -4.012 -1.586 1.00 0.00 C ATOM 1981 CG GLU A 488 14.158 -5.429 -2.224 1.00 0.00 C ATOM 1982 CD GLU A 488 13.654 -5.385 -3.673 1.00 0.00 C ATOM 1983 OE1 GLU A 488 12.450 -5.327 -3.859 1.00 0.00 O ATOM 1984 OE2 GLU A 488 14.483 -5.408 -4.568 1.00 0.00 O ATOM 0 H GLU A 488 15.763 -5.259 -0.135 1.00 0.00 H new ATOM 0 HA GLU A 488 16.039 -3.290 -2.271 1.00 0.00 H new ATOM 0 HB2 GLU A 488 13.561 -4.044 -0.650 1.00 0.00 H new ATOM 0 HB3 GLU A 488 13.593 -3.324 -2.248 1.00 0.00 H new ATOM 0 HG2 GLU A 488 15.177 -5.816 -2.200 1.00 0.00 H new ATOM 0 HG3 GLU A 488 13.542 -6.113 -1.640 1.00 0.00 H new ATOM 1991 N VAL A 489 15.194 -2.311 0.768 1.00 0.00 N ATOM 1992 CA VAL A 489 15.091 -1.078 1.608 1.00 0.00 C ATOM 1993 C VAL A 489 16.479 -0.474 1.753 1.00 0.00 C ATOM 1994 O VAL A 489 16.657 0.723 1.832 1.00 0.00 O ATOM 1995 CB VAL A 489 14.526 -1.427 2.990 1.00 0.00 C ATOM 1996 CG1 VAL A 489 13.304 -2.313 2.810 1.00 0.00 C ATOM 1997 CG2 VAL A 489 15.571 -2.185 3.815 1.00 0.00 C ATOM 0 H VAL A 489 15.047 -3.190 1.264 1.00 0.00 H new ATOM 0 HA VAL A 489 14.421 -0.362 1.132 1.00 0.00 H new ATOM 0 HB VAL A 489 14.259 -0.507 3.511 1.00 0.00 H new ATOM 0 HG11 VAL A 489 12.893 -2.568 3.787 1.00 0.00 H new ATOM 0 HG12 VAL A 489 12.552 -1.781 2.227 1.00 0.00 H new ATOM 0 HG13 VAL A 489 13.590 -3.226 2.287 1.00 0.00 H new ATOM 0 HG21 VAL A 489 15.157 -2.426 4.794 1.00 0.00 H new ATOM 0 HG22 VAL A 489 15.844 -3.106 3.299 1.00 0.00 H new ATOM 0 HG23 VAL A 489 16.457 -1.563 3.940 1.00 0.00 H new ATOM 2007 N GLN A 490 17.462 -1.308 1.783 1.00 0.00 N ATOM 2008 CA GLN A 490 18.853 -0.802 1.912 1.00 0.00 C ATOM 2009 C GLN A 490 19.212 -0.040 0.636 1.00 0.00 C ATOM 2010 O GLN A 490 20.148 0.736 0.600 1.00 0.00 O ATOM 2011 CB GLN A 490 19.812 -1.983 2.089 1.00 0.00 C ATOM 2012 CG GLN A 490 19.598 -2.623 3.466 1.00 0.00 C ATOM 2013 CD GLN A 490 20.279 -1.776 4.543 1.00 0.00 C ATOM 2014 OE1 GLN A 490 20.641 -0.642 4.302 1.00 0.00 O ATOM 2015 NE2 GLN A 490 20.469 -2.283 5.729 1.00 0.00 N ATOM 0 H GLN A 490 17.370 -2.322 1.724 1.00 0.00 H new ATOM 0 HA GLN A 490 18.934 -0.144 2.777 1.00 0.00 H new ATOM 0 HB2 GLN A 490 19.644 -2.721 1.305 1.00 0.00 H new ATOM 0 HB3 GLN A 490 20.843 -1.644 1.992 1.00 0.00 H new ATOM 0 HG2 GLN A 490 18.532 -2.707 3.676 1.00 0.00 H new ATOM 0 HG3 GLN A 490 20.005 -3.634 3.474 1.00 0.00 H new ATOM 0 HE21 GLN A 490 20.165 -3.235 5.931 1.00 0.00 H new ATOM 0 HE22 GLN A 490 20.922 -1.727 6.455 1.00 0.00 H new ATOM 2024 N ASN A 491 18.475 -0.269 -0.421 1.00 0.00 N ATOM 2025 CA ASN A 491 18.780 0.423 -1.710 1.00 0.00 C ATOM 2026 C ASN A 491 18.177 1.834 -1.738 1.00 0.00 C ATOM 2027 O ASN A 491 18.827 2.776 -2.135 1.00 0.00 O ATOM 2028 CB ASN A 491 18.209 -0.389 -2.877 1.00 0.00 C ATOM 2029 CG ASN A 491 18.982 -1.702 -3.018 1.00 0.00 C ATOM 2030 OD1 ASN A 491 20.135 -1.785 -2.645 1.00 0.00 O ATOM 2031 ND2 ASN A 491 18.390 -2.739 -3.545 1.00 0.00 N ATOM 0 H ASN A 491 17.677 -0.904 -0.447 1.00 0.00 H new ATOM 0 HA ASN A 491 19.863 0.505 -1.802 1.00 0.00 H new ATOM 0 HB2 ASN A 491 17.152 -0.594 -2.707 1.00 0.00 H new ATOM 0 HB3 ASN A 491 18.278 0.186 -3.801 1.00 0.00 H new ATOM 0 HD21 ASN A 491 18.896 -3.619 -3.644 1.00 0.00 H new ATOM 0 HD22 ASN A 491 17.422 -2.669 -3.858 1.00 0.00 H new ATOM 2038 N ILE A 492 16.943 1.999 -1.342 1.00 0.00 N ATOM 2039 CA ILE A 492 16.334 3.364 -1.383 1.00 0.00 C ATOM 2040 C ILE A 492 17.073 4.284 -0.403 1.00 0.00 C ATOM 2041 O ILE A 492 17.484 5.366 -0.763 1.00 0.00 O ATOM 2042 CB ILE A 492 14.826 3.280 -1.019 1.00 0.00 C ATOM 2043 CG1 ILE A 492 14.513 1.878 -0.487 1.00 0.00 C ATOM 2044 CG2 ILE A 492 13.958 3.545 -2.254 1.00 0.00 C ATOM 2045 CD1 ILE A 492 13.118 1.820 0.136 1.00 0.00 C ATOM 0 H ILE A 492 16.334 1.258 -0.995 1.00 0.00 H new ATOM 0 HA ILE A 492 16.425 3.774 -2.389 1.00 0.00 H new ATOM 0 HB ILE A 492 14.607 4.033 -0.261 1.00 0.00 H new ATOM 0 HG12 ILE A 492 14.581 1.155 -1.299 1.00 0.00 H new ATOM 0 HG13 ILE A 492 15.258 1.594 0.256 1.00 0.00 H new ATOM 0 HG21 ILE A 492 12.905 3.482 -1.979 1.00 0.00 H new ATOM 0 HG22 ILE A 492 14.172 4.541 -2.643 1.00 0.00 H new ATOM 0 HG23 ILE A 492 14.178 2.801 -3.020 1.00 0.00 H new ATOM 0 HD11 ILE A 492 12.926 0.812 0.504 1.00 0.00 H new ATOM 0 HD12 ILE A 492 13.060 2.526 0.964 1.00 0.00 H new ATOM 0 HD13 ILE A 492 12.373 2.080 -0.616 1.00 0.00 H new ATOM 2057 N LEU A 493 17.230 3.867 0.829 1.00 0.00 N ATOM 2058 CA LEU A 493 17.928 4.717 1.844 1.00 0.00 C ATOM 2059 C LEU A 493 19.124 5.445 1.205 1.00 0.00 C ATOM 2060 O LEU A 493 19.308 6.634 1.391 1.00 0.00 O ATOM 2061 CB LEU A 493 18.421 3.814 3.004 1.00 0.00 C ATOM 2062 CG LEU A 493 17.418 3.784 4.181 1.00 0.00 C ATOM 2063 CD1 LEU A 493 17.211 5.196 4.769 1.00 0.00 C ATOM 2064 CD2 LEU A 493 16.073 3.200 3.717 1.00 0.00 C ATOM 0 H LEU A 493 16.902 2.967 1.178 1.00 0.00 H new ATOM 0 HA LEU A 493 17.233 5.465 2.225 1.00 0.00 H new ATOM 0 HB2 LEU A 493 18.576 2.801 2.634 1.00 0.00 H new ATOM 0 HB3 LEU A 493 19.386 4.175 3.359 1.00 0.00 H new ATOM 0 HG LEU A 493 17.831 3.148 4.963 1.00 0.00 H new ATOM 0 HD11 LEU A 493 16.501 5.146 5.595 1.00 0.00 H new ATOM 0 HD12 LEU A 493 18.163 5.582 5.132 1.00 0.00 H new ATOM 0 HD13 LEU A 493 16.822 5.859 3.996 1.00 0.00 H new ATOM 0 HD21 LEU A 493 15.375 3.184 4.554 1.00 0.00 H new ATOM 0 HD22 LEU A 493 15.665 3.817 2.916 1.00 0.00 H new ATOM 0 HD23 LEU A 493 16.224 2.184 3.351 1.00 0.00 H new ATOM 2076 N SER A 494 19.938 4.745 0.468 1.00 0.00 N ATOM 2077 CA SER A 494 21.121 5.406 -0.157 1.00 0.00 C ATOM 2078 C SER A 494 20.692 6.259 -1.357 1.00 0.00 C ATOM 2079 O SER A 494 21.289 7.277 -1.647 1.00 0.00 O ATOM 2080 CB SER A 494 22.108 4.336 -0.621 1.00 0.00 C ATOM 2081 OG SER A 494 22.603 3.632 0.511 1.00 0.00 O ATOM 0 H SER A 494 19.839 3.749 0.271 1.00 0.00 H new ATOM 0 HA SER A 494 21.593 6.055 0.581 1.00 0.00 H new ATOM 0 HB2 SER A 494 21.618 3.646 -1.307 1.00 0.00 H new ATOM 0 HB3 SER A 494 22.932 4.796 -1.166 1.00 0.00 H new ATOM 0 HG SER A 494 23.235 2.943 0.217 1.00 0.00 H new