USER MOD reduce.3.24.130724 H: found=0, std=0, add=941, rem=0, adj=44 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 433 ASN :FLIP amide:sc= -0.624 F(o=-5.3!,f=-0.62) USER MOD Set 1.2: A 438 LYS NZ :NH3+ -176:sc= 0 (180deg=0) USER MOD Set 2.1: A 398 THR OG1 : rot -46:sc= 1.97 USER MOD Set 2.2: A 400 LYS NZ :NH3+ -111:sc= -4.48! (180deg=-8.42!) USER MOD Set 2.3: A 405 SER OG : rot 175:sc= 0.718! USER MOD Single : A 378 TYR OH : rot 180:sc= 0 USER MOD Single : A 380 LYS NZ :NH3+ -155:sc= -0.0202 (180deg=-0.347) USER MOD Single : A 383 LYS NZ :NH3+ 145:sc= -7.05! (180deg=-12.2!) USER MOD Single : A 385 LYS NZ :NH3+ -147:sc= 0.825 (180deg=-0.384) USER MOD Single : A 386 LYS NZ :NH3+ 174:sc= -0.333 (180deg=-0.414) USER MOD Single : A 388 THR OG1 : rot 180:sc= -0.699! USER MOD Single : A 390 LYS NZ :NH3+ -152:sc= -0.0899 (180deg=-0.656) USER MOD Single : A 392 TYR OH : rot 180:sc= -0.0554 USER MOD Single : A 393 LYS NZ :NH3+ -155:sc= -2.44 (180deg=-2.91!) USER MOD Single : A 394 GLN :FLIP amide:sc=-0.00429 F(o=-1.5!,f=-0.0043) USER MOD Single : A 395 TYR OH : rot 180:sc= -0.267 USER MOD Single : A 397 CYS SG : rot -75:sc= -0.498! USER MOD Single : A 402 THR OG1 : rot -5:sc= 0.35! USER MOD Single : A 403 SER OG : rot 180:sc= 0 USER MOD Single : A 406 CYS SG : rot 80:sc= 1.8 USER MOD Single : A 407 TYR OH : rot 180:sc= 0 USER MOD Single : A 408 LYS NZ :NH3+ 162:sc= -0.0741 (180deg=-0.607) USER MOD Single : A 409 SER OG : rot 180:sc= 0 USER MOD Single : A 419 HIS : no HD1:sc= -0.113 X(o=-0.11,f=0) USER MOD Single : A 420 GLN : amide:sc= -2.44! C(o=-2.4!,f=-5.9!) USER MOD Single : A 421 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 422 ASN : amide:sc= -1.23 K(o=-1.2,f=-9.1!) USER MOD Single : A 426 CYS SG : rot 180:sc= 0.182 USER MOD Single : A 429 THR OG1 : rot 180:sc= -0.195 USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 437 GLN :FLIP amide:sc= -5.32! C(o=-7.7!,f=-5.3!) USER MOD Single : A 440 ASN :FLIP amide:sc= -0.354 F(o=-1.1,f=-0.35) USER MOD Single : A 442 LYS NZ :NH3+ -124:sc= -2.98! (180deg=-5.44!) USER MOD Single : A 451 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 452 ASN :FLIP amide:sc= -2.19 F(o=-2.7!,f=-2.2) USER MOD Single : A 458 CYS SG : rot 180:sc= 0.794 USER MOD Single : A 460 ASN :FLIP amide:sc= -3.51! C(o=-4.4!,f=-3.5!) USER MOD Single : A 462 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 463 GLN : amide:sc= -0.194 K(o=-0.19,f=-3) USER MOD Single : A 464 TYR OH : rot 130:sc= -2.98! USER MOD Single : A 466 HIS : no HD1:sc= -1.17! C(o=-1.2!,f=-3.8!) USER MOD Single : A 468 MET CE :methyl -176:sc= -4.61! (180deg=-4.67!) USER MOD Single : A 471 CYS SG : rot 37:sc= -0.348 USER MOD Single : A 475 SER OG : rot 180:sc= 0 USER MOD Single : A 476 LYS NZ :NH3+ -137:sc= -2.28! (180deg=-5.04!) USER MOD Single : A 478 LYS NZ :NH3+ 142:sc= -0.366 (180deg=-1.17) USER MOD Single : A 479 THR OG1 : rot 180:sc= -0.113 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 180:sc= 0 USER MOD Single : A 485 TYR OH : rot 180:sc= 0 USER MOD Single : A 486 ASN : amide:sc= -0.0294 X(o=-0.029,f=-0.047) USER MOD Single : A 490 GLN :FLIP amide:sc= -0.0587 F(o=-2!,f=-0.059) USER MOD Single : A 491 ASN : amide:sc= -2.26! C(o=-2.3!,f=-6.4!) USER MOD Single : A 494 SER OG : rot 80:sc= 0.303 USER MOD ----------------------------------------------------------------- ATOM 119 N ILE A 372 1.498 -15.801 8.171 1.00 0.00 N ATOM 120 CA ILE A 372 2.952 -15.963 8.465 1.00 0.00 C ATOM 121 C ILE A 372 3.735 -14.781 7.863 1.00 0.00 C ATOM 122 O ILE A 372 4.608 -14.232 8.504 1.00 0.00 O ATOM 123 CB ILE A 372 3.467 -17.317 7.903 1.00 0.00 C ATOM 124 CG1 ILE A 372 2.282 -18.282 7.726 1.00 0.00 C ATOM 125 CG2 ILE A 372 4.481 -17.938 8.876 1.00 0.00 C ATOM 126 CD1 ILE A 372 2.793 -19.680 7.382 1.00 0.00 C ATOM 0 HA ILE A 372 3.105 -15.968 9.544 1.00 0.00 H new ATOM 0 HB ILE A 372 3.950 -17.142 6.941 1.00 0.00 H new ATOM 0 HG12 ILE A 372 1.691 -18.317 8.641 1.00 0.00 H new ATOM 0 HG13 ILE A 372 1.624 -17.922 6.935 1.00 0.00 H new ATOM 0 HG21 ILE A 372 4.837 -18.887 8.474 1.00 0.00 H new ATOM 0 HG22 ILE A 372 5.324 -17.259 9.005 1.00 0.00 H new ATOM 0 HG23 ILE A 372 4.002 -18.109 9.840 1.00 0.00 H new ATOM 0 HD11 ILE A 372 1.947 -20.356 7.259 1.00 0.00 H new ATOM 0 HD12 ILE A 372 3.364 -19.641 6.455 1.00 0.00 H new ATOM 0 HD13 ILE A 372 3.432 -20.042 8.187 1.00 0.00 H new ATOM 138 N PRO A 373 3.428 -14.375 6.650 1.00 0.00 N ATOM 139 CA PRO A 373 4.107 -13.240 5.984 1.00 0.00 C ATOM 140 C PRO A 373 3.272 -11.958 6.097 1.00 0.00 C ATOM 141 O PRO A 373 2.423 -11.693 5.268 1.00 0.00 O ATOM 142 CB PRO A 373 4.174 -13.723 4.535 1.00 0.00 C ATOM 143 CG PRO A 373 2.927 -14.557 4.343 1.00 0.00 C ATOM 144 CD PRO A 373 2.409 -14.937 5.751 1.00 0.00 C ATOM 0 HA PRO A 373 5.077 -12.990 6.413 1.00 0.00 H new ATOM 0 HB2 PRO A 373 4.199 -12.884 3.840 1.00 0.00 H new ATOM 0 HB3 PRO A 373 5.074 -14.311 4.356 1.00 0.00 H new ATOM 0 HG2 PRO A 373 2.171 -13.997 3.793 1.00 0.00 H new ATOM 0 HG3 PRO A 373 3.148 -15.451 3.760 1.00 0.00 H new ATOM 0 HD2 PRO A 373 1.424 -14.513 5.945 1.00 0.00 H new ATOM 0 HD3 PRO A 373 2.320 -16.017 5.869 1.00 0.00 H new ATOM 152 N GLU A 374 3.481 -11.180 7.132 1.00 0.00 N ATOM 153 CA GLU A 374 2.668 -9.934 7.322 1.00 0.00 C ATOM 154 C GLU A 374 3.474 -8.672 6.993 1.00 0.00 C ATOM 155 O GLU A 374 4.629 -8.529 7.346 1.00 0.00 O ATOM 156 CB GLU A 374 2.203 -9.861 8.777 1.00 0.00 C ATOM 157 CG GLU A 374 3.420 -9.816 9.703 1.00 0.00 C ATOM 158 CD GLU A 374 2.958 -9.910 11.159 1.00 0.00 C ATOM 159 OE1 GLU A 374 1.851 -9.480 11.437 1.00 0.00 O ATOM 160 OE2 GLU A 374 3.720 -10.410 11.970 1.00 0.00 O ATOM 0 H GLU A 374 4.180 -11.353 7.855 1.00 0.00 H new ATOM 0 HA GLU A 374 1.817 -9.979 6.642 1.00 0.00 H new ATOM 0 HB2 GLU A 374 1.586 -8.976 8.928 1.00 0.00 H new ATOM 0 HB3 GLU A 374 1.584 -10.726 9.015 1.00 0.00 H new ATOM 0 HG2 GLU A 374 4.097 -10.638 9.471 1.00 0.00 H new ATOM 0 HG3 GLU A 374 3.976 -8.892 9.546 1.00 0.00 H new ATOM 167 N LEU A 375 2.828 -7.744 6.343 1.00 0.00 N ATOM 168 CA LEU A 375 3.458 -6.438 5.986 1.00 0.00 C ATOM 169 C LEU A 375 2.333 -5.404 6.040 1.00 0.00 C ATOM 170 O LEU A 375 1.409 -5.450 5.253 1.00 0.00 O ATOM 171 CB LEU A 375 4.064 -6.518 4.561 1.00 0.00 C ATOM 172 CG LEU A 375 4.665 -5.160 4.076 1.00 0.00 C ATOM 173 CD1 LEU A 375 3.604 -4.304 3.361 1.00 0.00 C ATOM 174 CD2 LEU A 375 5.261 -4.347 5.233 1.00 0.00 C ATOM 0 H LEU A 375 1.860 -7.839 6.035 1.00 0.00 H new ATOM 0 HA LEU A 375 4.268 -6.174 6.667 1.00 0.00 H new ATOM 0 HB2 LEU A 375 4.843 -7.280 4.546 1.00 0.00 H new ATOM 0 HB3 LEU A 375 3.292 -6.838 3.861 1.00 0.00 H new ATOM 0 HG LEU A 375 5.463 -5.412 3.378 1.00 0.00 H new ATOM 0 HD11 LEU A 375 4.053 -3.366 3.035 1.00 0.00 H new ATOM 0 HD12 LEU A 375 3.224 -4.845 2.494 1.00 0.00 H new ATOM 0 HD13 LEU A 375 2.783 -4.095 4.047 1.00 0.00 H new ATOM 0 HD21 LEU A 375 5.667 -3.411 4.849 1.00 0.00 H new ATOM 0 HD22 LEU A 375 4.483 -4.131 5.965 1.00 0.00 H new ATOM 0 HD23 LEU A 375 6.057 -4.920 5.708 1.00 0.00 H new ATOM 186 N ALA A 376 2.376 -4.482 6.964 1.00 0.00 N ATOM 187 CA ALA A 376 1.272 -3.482 7.042 1.00 0.00 C ATOM 188 C ALA A 376 1.722 -2.239 7.815 1.00 0.00 C ATOM 189 O ALA A 376 2.672 -2.270 8.572 1.00 0.00 O ATOM 190 CB ALA A 376 0.074 -4.119 7.752 1.00 0.00 C ATOM 0 H ALA A 376 3.116 -4.378 7.659 1.00 0.00 H new ATOM 0 HA ALA A 376 0.995 -3.179 6.032 1.00 0.00 H new ATOM 0 HB1 ALA A 376 -0.739 -3.396 7.814 1.00 0.00 H new ATOM 0 HB2 ALA A 376 -0.259 -4.992 7.191 1.00 0.00 H new ATOM 0 HB3 ALA A 376 0.366 -4.423 8.757 1.00 0.00 H new ATOM 196 N ASP A 377 1.031 -1.148 7.627 1.00 0.00 N ATOM 197 CA ASP A 377 1.388 0.108 8.342 1.00 0.00 C ATOM 198 C ASP A 377 0.219 1.088 8.243 1.00 0.00 C ATOM 199 O ASP A 377 -0.703 0.896 7.475 1.00 0.00 O ATOM 200 CB ASP A 377 2.632 0.735 7.709 1.00 0.00 C ATOM 201 CG ASP A 377 3.206 1.796 8.650 1.00 0.00 C ATOM 202 OD1 ASP A 377 3.918 1.422 9.567 1.00 0.00 O ATOM 203 OD2 ASP A 377 2.924 2.963 8.437 1.00 0.00 O ATOM 0 H ASP A 377 0.228 -1.074 7.003 1.00 0.00 H new ATOM 0 HA ASP A 377 1.597 -0.118 9.388 1.00 0.00 H new ATOM 0 HB2 ASP A 377 3.379 -0.034 7.512 1.00 0.00 H new ATOM 0 HB3 ASP A 377 2.377 1.185 6.749 1.00 0.00 H new ATOM 208 N TYR A 378 0.256 2.143 9.006 1.00 0.00 N ATOM 209 CA TYR A 378 -0.845 3.148 8.951 1.00 0.00 C ATOM 210 C TYR A 378 -0.553 4.108 7.804 1.00 0.00 C ATOM 211 O TYR A 378 0.516 4.681 7.727 1.00 0.00 O ATOM 212 CB TYR A 378 -0.915 3.913 10.277 1.00 0.00 C ATOM 213 CG TYR A 378 0.481 4.144 10.804 1.00 0.00 C ATOM 214 CD1 TYR A 378 1.194 5.285 10.419 1.00 0.00 C ATOM 215 CD2 TYR A 378 1.059 3.220 11.682 1.00 0.00 C ATOM 216 CE1 TYR A 378 2.487 5.502 10.912 1.00 0.00 C ATOM 217 CE2 TYR A 378 2.352 3.436 12.174 1.00 0.00 C ATOM 218 CZ TYR A 378 3.066 4.578 11.790 1.00 0.00 C ATOM 219 OH TYR A 378 4.340 4.792 12.278 1.00 0.00 O ATOM 0 H TYR A 378 1.003 2.355 9.668 1.00 0.00 H new ATOM 0 HA TYR A 378 -1.803 2.654 8.789 1.00 0.00 H new ATOM 0 HB2 TYR A 378 -1.422 4.867 10.132 1.00 0.00 H new ATOM 0 HB3 TYR A 378 -1.500 3.349 11.003 1.00 0.00 H new ATOM 0 HD1 TYR A 378 0.747 5.998 9.742 1.00 0.00 H new ATOM 0 HD2 TYR A 378 0.508 2.340 11.980 1.00 0.00 H new ATOM 0 HE1 TYR A 378 3.037 6.382 10.615 1.00 0.00 H new ATOM 0 HE2 TYR A 378 2.799 2.722 12.850 1.00 0.00 H new ATOM 0 HH TYR A 378 4.590 4.056 12.875 1.00 0.00 H new ATOM 229 N ILE A 379 -1.469 4.267 6.886 1.00 0.00 N ATOM 230 CA ILE A 379 -1.195 5.162 5.736 1.00 0.00 C ATOM 231 C ILE A 379 -2.512 5.719 5.168 1.00 0.00 C ATOM 232 O ILE A 379 -3.503 5.023 5.069 1.00 0.00 O ATOM 233 CB ILE A 379 -0.421 4.326 4.709 1.00 0.00 C ATOM 234 CG1 ILE A 379 0.243 5.243 3.681 1.00 0.00 C ATOM 235 CG2 ILE A 379 -1.357 3.349 3.989 1.00 0.00 C ATOM 236 CD1 ILE A 379 1.201 4.468 2.747 1.00 0.00 C ATOM 0 H ILE A 379 -2.385 3.819 6.886 1.00 0.00 H new ATOM 0 HA ILE A 379 -0.603 6.030 6.026 1.00 0.00 H new ATOM 0 HB ILE A 379 0.343 3.757 5.239 1.00 0.00 H new ATOM 0 HG12 ILE A 379 -0.525 5.735 3.085 1.00 0.00 H new ATOM 0 HG13 ILE A 379 0.796 6.027 4.198 1.00 0.00 H new ATOM 0 HG21 ILE A 379 -0.788 2.766 3.265 1.00 0.00 H new ATOM 0 HG22 ILE A 379 -1.813 2.678 4.717 1.00 0.00 H new ATOM 0 HG23 ILE A 379 -2.138 3.907 3.472 1.00 0.00 H new ATOM 0 HD11 ILE A 379 1.650 5.158 2.033 1.00 0.00 H new ATOM 0 HD12 ILE A 379 1.985 3.997 3.340 1.00 0.00 H new ATOM 0 HD13 ILE A 379 0.643 3.701 2.209 1.00 0.00 H new ATOM 248 N LYS A 380 -2.529 6.982 4.808 1.00 0.00 N ATOM 249 CA LYS A 380 -3.778 7.603 4.264 1.00 0.00 C ATOM 250 C LYS A 380 -3.857 7.375 2.753 1.00 0.00 C ATOM 251 O LYS A 380 -2.867 7.102 2.102 1.00 0.00 O ATOM 252 CB LYS A 380 -3.787 9.122 4.539 1.00 0.00 C ATOM 253 CG LYS A 380 -3.153 9.438 5.904 1.00 0.00 C ATOM 254 CD LYS A 380 -3.985 8.811 7.062 1.00 0.00 C ATOM 255 CE LYS A 380 -4.296 9.864 8.138 1.00 0.00 C ATOM 256 NZ LYS A 380 -3.024 10.436 8.667 1.00 0.00 N ATOM 0 H LYS A 380 -1.728 7.611 4.868 1.00 0.00 H new ATOM 0 HA LYS A 380 -4.634 7.140 4.755 1.00 0.00 H new ATOM 0 HB2 LYS A 380 -3.241 9.641 3.751 1.00 0.00 H new ATOM 0 HB3 LYS A 380 -4.811 9.494 4.515 1.00 0.00 H new ATOM 0 HG2 LYS A 380 -2.134 9.053 5.934 1.00 0.00 H new ATOM 0 HG3 LYS A 380 -3.090 10.518 6.039 1.00 0.00 H new ATOM 0 HD2 LYS A 380 -4.915 8.401 6.668 1.00 0.00 H new ATOM 0 HD3 LYS A 380 -3.433 7.982 7.506 1.00 0.00 H new ATOM 0 HE2 LYS A 380 -4.914 10.657 7.716 1.00 0.00 H new ATOM 0 HE3 LYS A 380 -4.867 9.411 8.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 380 -3.180 10.799 9.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 380 -2.294 9.696 8.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 380 -2.710 11.213 8.051 1.00 0.00 H new ATOM 270 N VAL A 381 -5.035 7.494 2.191 1.00 0.00 N ATOM 271 CA VAL A 381 -5.203 7.297 0.718 1.00 0.00 C ATOM 272 C VAL A 381 -6.152 8.355 0.147 1.00 0.00 C ATOM 273 O VAL A 381 -7.097 8.777 0.788 1.00 0.00 O ATOM 274 CB VAL A 381 -5.774 5.904 0.448 1.00 0.00 C ATOM 275 CG1 VAL A 381 -7.081 5.722 1.226 1.00 0.00 C ATOM 276 CG2 VAL A 381 -6.038 5.747 -1.054 1.00 0.00 C ATOM 0 H VAL A 381 -5.893 7.721 2.694 1.00 0.00 H new ATOM 0 HA VAL A 381 -4.230 7.395 0.237 1.00 0.00 H new ATOM 0 HB VAL A 381 -5.059 5.148 0.772 1.00 0.00 H new ATOM 0 HG11 VAL A 381 -7.485 4.729 1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 381 -6.888 5.832 2.293 1.00 0.00 H new ATOM 0 HG13 VAL A 381 -7.802 6.475 0.908 1.00 0.00 H new ATOM 0 HG21 VAL A 381 -6.445 4.755 -1.250 1.00 0.00 H new ATOM 0 HG22 VAL A 381 -6.753 6.503 -1.379 1.00 0.00 H new ATOM 0 HG23 VAL A 381 -5.104 5.871 -1.602 1.00 0.00 H new ATOM 286 N PHE A 382 -5.905 8.768 -1.065 1.00 0.00 N ATOM 287 CA PHE A 382 -6.777 9.782 -1.728 1.00 0.00 C ATOM 288 C PHE A 382 -6.668 9.565 -3.247 1.00 0.00 C ATOM 289 O PHE A 382 -5.603 9.303 -3.760 1.00 0.00 O ATOM 290 CB PHE A 382 -6.321 11.206 -1.295 1.00 0.00 C ATOM 291 CG PHE A 382 -5.815 12.027 -2.467 1.00 0.00 C ATOM 292 CD1 PHE A 382 -6.711 12.777 -3.239 1.00 0.00 C ATOM 293 CD2 PHE A 382 -4.451 12.035 -2.772 1.00 0.00 C ATOM 294 CE1 PHE A 382 -6.239 13.536 -4.317 1.00 0.00 C ATOM 295 CE2 PHE A 382 -3.979 12.794 -3.849 1.00 0.00 C ATOM 296 CZ PHE A 382 -4.873 13.544 -4.622 1.00 0.00 C ATOM 0 H PHE A 382 -5.124 8.441 -1.634 1.00 0.00 H new ATOM 0 HA PHE A 382 -7.822 9.678 -1.436 1.00 0.00 H new ATOM 0 HB2 PHE A 382 -7.155 11.725 -0.823 1.00 0.00 H new ATOM 0 HB3 PHE A 382 -5.534 11.121 -0.546 1.00 0.00 H new ATOM 0 HD1 PHE A 382 -7.765 12.770 -3.003 1.00 0.00 H new ATOM 0 HD2 PHE A 382 -3.761 11.455 -2.177 1.00 0.00 H new ATOM 0 HE1 PHE A 382 -6.929 14.115 -4.913 1.00 0.00 H new ATOM 0 HE2 PHE A 382 -2.925 12.801 -4.084 1.00 0.00 H new ATOM 0 HZ PHE A 382 -4.509 14.129 -5.454 1.00 0.00 H new ATOM 306 N LYS A 383 -7.755 9.644 -3.971 1.00 0.00 N ATOM 307 CA LYS A 383 -7.679 9.410 -5.443 1.00 0.00 C ATOM 308 C LYS A 383 -8.807 10.207 -6.147 1.00 0.00 C ATOM 309 O LYS A 383 -9.553 10.898 -5.490 1.00 0.00 O ATOM 310 CB LYS A 383 -7.753 7.879 -5.658 1.00 0.00 C ATOM 311 CG LYS A 383 -9.189 7.320 -5.477 1.00 0.00 C ATOM 312 CD LYS A 383 -9.369 6.738 -4.067 1.00 0.00 C ATOM 313 CE LYS A 383 -8.715 5.349 -3.963 1.00 0.00 C ATOM 314 NZ LYS A 383 -7.279 5.497 -3.596 1.00 0.00 N ATOM 0 H LYS A 383 -8.684 9.859 -3.610 1.00 0.00 H new ATOM 0 HA LYS A 383 -6.749 9.768 -5.885 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -7.397 7.639 -6.660 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -7.083 7.384 -4.955 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -9.918 8.113 -5.645 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -9.381 6.548 -6.222 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -8.926 7.410 -3.332 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -10.431 6.664 -3.832 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -9.232 4.748 -3.215 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -8.805 4.822 -4.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -6.996 4.709 -2.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -6.698 5.488 -4.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -7.140 6.397 -3.094 1.00 0.00 H new ATOM 328 N PRO A 384 -8.921 10.152 -7.464 1.00 0.00 N ATOM 329 CA PRO A 384 -9.966 10.927 -8.217 1.00 0.00 C ATOM 330 C PRO A 384 -11.398 10.617 -7.762 1.00 0.00 C ATOM 331 O PRO A 384 -12.320 11.320 -8.111 1.00 0.00 O ATOM 332 CB PRO A 384 -9.745 10.515 -9.682 1.00 0.00 C ATOM 333 CG PRO A 384 -8.328 10.058 -9.726 1.00 0.00 C ATOM 334 CD PRO A 384 -8.095 9.365 -8.390 1.00 0.00 C ATOM 0 HA PRO A 384 -9.863 11.999 -8.048 1.00 0.00 H new ATOM 0 HB2 PRO A 384 -10.429 9.720 -9.979 1.00 0.00 H new ATOM 0 HB3 PRO A 384 -9.915 11.351 -10.360 1.00 0.00 H new ATOM 0 HG2 PRO A 384 -8.159 9.376 -10.559 1.00 0.00 H new ATOM 0 HG3 PRO A 384 -7.646 10.898 -9.859 1.00 0.00 H new ATOM 0 HD2 PRO A 384 -8.403 8.320 -8.418 1.00 0.00 H new ATOM 0 HD3 PRO A 384 -7.043 9.380 -8.105 1.00 0.00 H new ATOM 342 N LYS A 385 -11.574 9.576 -6.987 1.00 0.00 N ATOM 343 CA LYS A 385 -12.914 9.199 -6.478 1.00 0.00 C ATOM 344 C LYS A 385 -13.793 8.685 -7.607 1.00 0.00 C ATOM 345 O LYS A 385 -14.060 9.355 -8.585 1.00 0.00 O ATOM 346 CB LYS A 385 -13.569 10.388 -5.794 1.00 0.00 C ATOM 347 CG LYS A 385 -12.604 11.026 -4.788 1.00 0.00 C ATOM 348 CD LYS A 385 -12.058 9.950 -3.843 1.00 0.00 C ATOM 349 CE LYS A 385 -11.485 10.595 -2.588 1.00 0.00 C ATOM 350 NZ LYS A 385 -10.554 11.695 -2.970 1.00 0.00 N ATOM 0 H LYS A 385 -10.820 8.960 -6.682 1.00 0.00 H new ATOM 0 HA LYS A 385 -12.794 8.398 -5.749 1.00 0.00 H new ATOM 0 HB2 LYS A 385 -13.867 11.125 -6.539 1.00 0.00 H new ATOM 0 HB3 LYS A 385 -14.477 10.067 -5.283 1.00 0.00 H new ATOM 0 HG2 LYS A 385 -11.783 11.512 -5.315 1.00 0.00 H new ATOM 0 HG3 LYS A 385 -13.118 11.799 -4.217 1.00 0.00 H new ATOM 0 HD2 LYS A 385 -12.853 9.255 -3.573 1.00 0.00 H new ATOM 0 HD3 LYS A 385 -11.286 9.370 -4.348 1.00 0.00 H new ATOM 0 HE2 LYS A 385 -12.291 10.987 -1.968 1.00 0.00 H new ATOM 0 HE3 LYS A 385 -10.958 9.850 -1.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 385 -9.786 11.758 -2.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 385 -10.153 11.500 -3.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 385 -11.073 12.596 -2.996 1.00 0.00 H new ATOM 364 N LYS A 386 -14.216 7.469 -7.458 1.00 0.00 N ATOM 365 CA LYS A 386 -15.059 6.794 -8.457 1.00 0.00 C ATOM 366 C LYS A 386 -16.510 6.780 -7.967 1.00 0.00 C ATOM 367 O LYS A 386 -17.377 7.427 -8.522 1.00 0.00 O ATOM 368 CB LYS A 386 -14.486 5.382 -8.542 1.00 0.00 C ATOM 369 CG LYS A 386 -15.358 4.441 -9.362 1.00 0.00 C ATOM 370 CD LYS A 386 -14.903 2.989 -9.128 1.00 0.00 C ATOM 371 CE LYS A 386 -13.380 2.860 -9.302 1.00 0.00 C ATOM 372 NZ LYS A 386 -12.984 3.457 -10.609 1.00 0.00 N ATOM 0 H LYS A 386 -13.998 6.894 -6.644 1.00 0.00 H new ATOM 0 HA LYS A 386 -15.060 7.285 -9.430 1.00 0.00 H new ATOM 0 HB2 LYS A 386 -13.490 5.425 -8.983 1.00 0.00 H new ATOM 0 HB3 LYS A 386 -14.372 4.980 -7.535 1.00 0.00 H new ATOM 0 HG2 LYS A 386 -16.404 4.556 -9.078 1.00 0.00 H new ATOM 0 HG3 LYS A 386 -15.286 4.690 -10.421 1.00 0.00 H new ATOM 0 HD2 LYS A 386 -15.187 2.671 -8.125 1.00 0.00 H new ATOM 0 HD3 LYS A 386 -15.411 2.326 -9.829 1.00 0.00 H new ATOM 0 HE2 LYS A 386 -12.864 3.367 -8.486 1.00 0.00 H new ATOM 0 HE3 LYS A 386 -13.085 1.811 -9.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 386 -11.947 3.465 -10.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 386 -13.386 2.892 -11.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 386 -13.343 4.431 -10.669 1.00 0.00 H new ATOM 386 N LEU A 387 -16.774 6.022 -6.941 1.00 0.00 N ATOM 387 CA LEU A 387 -18.163 5.919 -6.402 1.00 0.00 C ATOM 388 C LEU A 387 -18.674 7.290 -5.918 1.00 0.00 C ATOM 389 O LEU A 387 -19.723 7.739 -6.334 1.00 0.00 O ATOM 390 CB LEU A 387 -18.177 4.898 -5.238 1.00 0.00 C ATOM 391 CG LEU A 387 -19.473 4.055 -5.269 1.00 0.00 C ATOM 392 CD1 LEU A 387 -19.312 2.884 -6.246 1.00 0.00 C ATOM 393 CD2 LEU A 387 -19.767 3.499 -3.872 1.00 0.00 C ATOM 0 H LEU A 387 -16.080 5.462 -6.445 1.00 0.00 H new ATOM 0 HA LEU A 387 -18.828 5.582 -7.197 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -17.309 4.243 -5.311 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -18.101 5.423 -4.286 1.00 0.00 H new ATOM 0 HG LEU A 387 -20.296 4.692 -5.592 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -20.229 2.295 -6.262 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -19.110 3.269 -7.246 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -18.482 2.254 -5.926 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -20.681 2.906 -3.901 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -18.937 2.871 -3.549 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -19.892 4.324 -3.171 1.00 0.00 H new ATOM 405 N THR A 388 -17.963 7.963 -5.043 1.00 0.00 N ATOM 406 CA THR A 388 -18.452 9.284 -4.561 1.00 0.00 C ATOM 407 C THR A 388 -17.262 10.073 -4.037 1.00 0.00 C ATOM 408 O THR A 388 -16.607 10.769 -4.782 1.00 0.00 O ATOM 409 CB THR A 388 -19.484 9.084 -3.441 1.00 0.00 C ATOM 410 OG1 THR A 388 -19.422 10.181 -2.542 1.00 0.00 O ATOM 411 CG2 THR A 388 -19.189 7.789 -2.683 1.00 0.00 C ATOM 0 H THR A 388 -17.075 7.654 -4.648 1.00 0.00 H new ATOM 0 HA THR A 388 -18.930 9.827 -5.377 1.00 0.00 H new ATOM 0 HB THR A 388 -20.480 9.022 -3.879 1.00 0.00 H new ATOM 0 HG1 THR A 388 -20.081 10.056 -1.828 1.00 0.00 H new ATOM 0 HG21 THR A 388 -19.926 7.655 -1.891 1.00 0.00 H new ATOM 0 HG22 THR A 388 -19.239 6.945 -3.371 1.00 0.00 H new ATOM 0 HG23 THR A 388 -18.192 7.842 -2.246 1.00 0.00 H new ATOM 419 N LEU A 389 -16.960 9.976 -2.768 1.00 0.00 N ATOM 420 CA LEU A 389 -15.802 10.727 -2.242 1.00 0.00 C ATOM 421 C LEU A 389 -15.337 10.149 -0.895 1.00 0.00 C ATOM 422 O LEU A 389 -15.873 9.179 -0.404 1.00 0.00 O ATOM 423 CB LEU A 389 -16.210 12.197 -2.065 1.00 0.00 C ATOM 424 CG LEU A 389 -15.014 13.123 -2.391 1.00 0.00 C ATOM 425 CD1 LEU A 389 -15.078 13.556 -3.859 1.00 0.00 C ATOM 426 CD2 LEU A 389 -15.042 14.364 -1.492 1.00 0.00 C ATOM 0 H LEU A 389 -17.466 9.412 -2.085 1.00 0.00 H new ATOM 0 HA LEU A 389 -14.974 10.646 -2.946 1.00 0.00 H new ATOM 0 HB2 LEU A 389 -17.050 12.431 -2.719 1.00 0.00 H new ATOM 0 HB3 LEU A 389 -16.545 12.369 -1.042 1.00 0.00 H new ATOM 0 HG LEU A 389 -14.089 12.575 -2.212 1.00 0.00 H new ATOM 0 HD11 LEU A 389 -14.234 14.208 -4.083 1.00 0.00 H new ATOM 0 HD12 LEU A 389 -15.037 12.675 -4.500 1.00 0.00 H new ATOM 0 HD13 LEU A 389 -16.009 14.093 -4.040 1.00 0.00 H new ATOM 0 HD21 LEU A 389 -14.195 15.007 -1.732 1.00 0.00 H new ATOM 0 HD22 LEU A 389 -15.970 14.911 -1.656 1.00 0.00 H new ATOM 0 HD23 LEU A 389 -14.981 14.058 -0.448 1.00 0.00 H new ATOM 438 N LYS A 390 -14.342 10.772 -0.312 1.00 0.00 N ATOM 439 CA LYS A 390 -13.782 10.334 1.012 1.00 0.00 C ATOM 440 C LYS A 390 -12.388 10.969 1.161 1.00 0.00 C ATOM 441 O LYS A 390 -12.126 11.711 2.086 1.00 0.00 O ATOM 442 CB LYS A 390 -13.677 8.783 1.095 1.00 0.00 C ATOM 443 CG LYS A 390 -14.796 8.211 1.990 1.00 0.00 C ATOM 444 CD LYS A 390 -15.051 6.741 1.637 1.00 0.00 C ATOM 445 CE LYS A 390 -15.862 6.082 2.756 1.00 0.00 C ATOM 446 NZ LYS A 390 -15.024 5.977 3.983 1.00 0.00 N ATOM 0 H LYS A 390 -13.880 11.590 -0.708 1.00 0.00 H new ATOM 0 HA LYS A 390 -14.443 10.656 1.817 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -13.748 8.354 0.095 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -12.703 8.500 1.495 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -14.514 8.298 3.039 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -15.710 8.789 1.857 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -15.590 6.671 0.692 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -14.104 6.218 1.503 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -16.757 6.668 2.964 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -16.194 5.092 2.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -15.340 5.165 4.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -14.028 5.844 3.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -15.118 6.848 4.543 1.00 0.00 H new ATOM 460 N GLY A 391 -11.506 10.691 0.239 1.00 0.00 N ATOM 461 CA GLY A 391 -10.134 11.285 0.294 1.00 0.00 C ATOM 462 C GLY A 391 -9.461 10.956 1.626 1.00 0.00 C ATOM 463 O GLY A 391 -9.279 9.806 1.975 1.00 0.00 O ATOM 0 H GLY A 391 -11.676 10.074 -0.556 1.00 0.00 H new ATOM 0 HA2 GLY A 391 -9.532 10.901 -0.529 1.00 0.00 H new ATOM 0 HA3 GLY A 391 -10.194 12.366 0.167 1.00 0.00 H new ATOM 467 N TYR A 392 -9.080 11.966 2.365 1.00 0.00 N ATOM 468 CA TYR A 392 -8.404 11.738 3.676 1.00 0.00 C ATOM 469 C TYR A 392 -9.124 10.627 4.444 1.00 0.00 C ATOM 470 O TYR A 392 -10.070 10.865 5.167 1.00 0.00 O ATOM 471 CB TYR A 392 -8.435 13.038 4.497 1.00 0.00 C ATOM 472 CG TYR A 392 -7.261 13.922 4.120 1.00 0.00 C ATOM 473 CD1 TYR A 392 -7.119 14.373 2.802 1.00 0.00 C ATOM 474 CD2 TYR A 392 -6.316 14.287 5.089 1.00 0.00 C ATOM 475 CE1 TYR A 392 -6.035 15.187 2.453 1.00 0.00 C ATOM 476 CE2 TYR A 392 -5.234 15.102 4.738 1.00 0.00 C ATOM 477 CZ TYR A 392 -5.093 15.551 3.421 1.00 0.00 C ATOM 478 OH TYR A 392 -4.024 16.353 3.078 1.00 0.00 O ATOM 0 H TYR A 392 -9.210 12.946 2.114 1.00 0.00 H new ATOM 0 HA TYR A 392 -7.370 11.440 3.504 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -9.371 13.568 4.318 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -8.398 12.806 5.561 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -7.846 14.093 2.054 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -6.423 13.939 6.106 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -5.926 15.534 1.436 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -4.507 15.385 5.485 1.00 0.00 H new ATOM 0 HH TYR A 392 -3.467 16.511 3.868 1.00 0.00 H new ATOM 488 N LYS A 393 -8.673 9.414 4.289 1.00 0.00 N ATOM 489 CA LYS A 393 -9.310 8.270 5.004 1.00 0.00 C ATOM 490 C LYS A 393 -8.216 7.299 5.446 1.00 0.00 C ATOM 491 O LYS A 393 -7.324 6.956 4.695 1.00 0.00 O ATOM 492 CB LYS A 393 -10.317 7.591 4.060 1.00 0.00 C ATOM 493 CG LYS A 393 -10.654 6.146 4.514 1.00 0.00 C ATOM 494 CD LYS A 393 -9.819 5.127 3.717 1.00 0.00 C ATOM 495 CE LYS A 393 -10.417 4.927 2.310 1.00 0.00 C ATOM 496 NZ LYS A 393 -11.291 3.722 2.318 1.00 0.00 N ATOM 0 H LYS A 393 -7.884 9.163 3.693 1.00 0.00 H new ATOM 0 HA LYS A 393 -9.847 8.611 5.889 1.00 0.00 H new ATOM 0 HB2 LYS A 393 -11.232 8.182 4.020 1.00 0.00 H new ATOM 0 HB3 LYS A 393 -9.909 7.568 3.050 1.00 0.00 H new ATOM 0 HG2 LYS A 393 -10.454 6.036 5.580 1.00 0.00 H new ATOM 0 HG3 LYS A 393 -11.716 5.950 4.368 1.00 0.00 H new ATOM 0 HD2 LYS A 393 -8.789 5.475 3.636 1.00 0.00 H new ATOM 0 HD3 LYS A 393 -9.793 4.175 4.247 1.00 0.00 H new ATOM 0 HE2 LYS A 393 -10.991 5.806 2.017 1.00 0.00 H new ATOM 0 HE3 LYS A 393 -9.620 4.808 1.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 393 -11.354 3.333 1.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 393 -10.889 3.006 2.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 393 -12.242 3.985 2.648 1.00 0.00 H new ATOM 510 N GLN A 394 -8.278 6.870 6.675 1.00 0.00 N ATOM 511 CA GLN A 394 -7.244 5.932 7.198 1.00 0.00 C ATOM 512 C GLN A 394 -7.417 4.568 6.536 1.00 0.00 C ATOM 513 O GLN A 394 -8.449 3.942 6.650 1.00 0.00 O ATOM 514 CB GLN A 394 -7.401 5.786 8.713 1.00 0.00 C ATOM 515 CG GLN A 394 -7.529 7.171 9.351 1.00 0.00 C ATOM 516 CD GLN A 394 -7.497 7.034 10.875 1.00 0.00 C ATOM 517 OE1 GLN A 394 -7.250 5.868 11.408 1.00 0.00 O flip ATOM 518 NE2 GLN A 394 -7.697 7.997 11.588 1.00 0.00 N flip ATOM 0 H GLN A 394 -9.003 7.129 7.344 1.00 0.00 H new ATOM 0 HA GLN A 394 -6.252 6.325 6.974 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -8.282 5.186 8.941 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -6.541 5.261 9.129 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -6.716 7.815 9.016 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -8.460 7.644 9.037 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -7.890 8.908 11.172 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -7.672 7.894 12.603 1.00 0.00 H new ATOM 527 N TYR A 395 -6.412 4.107 5.837 1.00 0.00 N ATOM 528 CA TYR A 395 -6.504 2.783 5.151 1.00 0.00 C ATOM 529 C TYR A 395 -5.195 2.024 5.368 1.00 0.00 C ATOM 530 O TYR A 395 -4.156 2.409 4.871 1.00 0.00 O ATOM 531 CB TYR A 395 -6.767 3.037 3.659 1.00 0.00 C ATOM 532 CG TYR A 395 -6.341 1.868 2.787 1.00 0.00 C ATOM 533 CD1 TYR A 395 -6.949 0.617 2.941 1.00 0.00 C ATOM 534 CD2 TYR A 395 -5.363 2.051 1.797 1.00 0.00 C ATOM 535 CE1 TYR A 395 -6.579 -0.448 2.109 1.00 0.00 C ATOM 536 CE2 TYR A 395 -4.991 0.984 0.972 1.00 0.00 C ATOM 537 CZ TYR A 395 -5.602 -0.264 1.126 1.00 0.00 C ATOM 538 OH TYR A 395 -5.240 -1.316 0.307 1.00 0.00 O ATOM 0 H TYR A 395 -5.525 4.595 5.711 1.00 0.00 H new ATOM 0 HA TYR A 395 -7.317 2.179 5.554 1.00 0.00 H new ATOM 0 HB2 TYR A 395 -7.829 3.231 3.508 1.00 0.00 H new ATOM 0 HB3 TYR A 395 -6.232 3.934 3.346 1.00 0.00 H new ATOM 0 HD1 TYR A 395 -7.703 0.473 3.701 1.00 0.00 H new ATOM 0 HD2 TYR A 395 -4.897 3.017 1.672 1.00 0.00 H new ATOM 0 HE1 TYR A 395 -7.049 -1.413 2.227 1.00 0.00 H new ATOM 0 HE2 TYR A 395 -4.232 1.124 0.216 1.00 0.00 H new ATOM 0 HH TYR A 395 -4.549 -1.019 -0.321 1.00 0.00 H new ATOM 548 N TRP A 396 -5.243 0.950 6.121 1.00 0.00 N ATOM 549 CA TRP A 396 -4.001 0.143 6.389 1.00 0.00 C ATOM 550 C TRP A 396 -4.161 -1.249 5.761 1.00 0.00 C ATOM 551 O TRP A 396 -4.831 -2.110 6.293 1.00 0.00 O ATOM 552 CB TRP A 396 -3.761 0.018 7.914 1.00 0.00 C ATOM 553 CG TRP A 396 -5.033 0.234 8.675 1.00 0.00 C ATOM 554 CD1 TRP A 396 -6.230 -0.327 8.385 1.00 0.00 C ATOM 555 CD2 TRP A 396 -5.245 1.058 9.859 1.00 0.00 C ATOM 556 NE1 TRP A 396 -7.162 0.103 9.315 1.00 0.00 N ATOM 557 CE2 TRP A 396 -6.601 0.956 10.243 1.00 0.00 C ATOM 558 CE3 TRP A 396 -4.397 1.876 10.629 1.00 0.00 C ATOM 559 CZ2 TRP A 396 -7.098 1.641 11.352 1.00 0.00 C ATOM 560 CZ3 TRP A 396 -4.896 2.567 11.745 1.00 0.00 C ATOM 561 CH2 TRP A 396 -6.244 2.448 12.106 1.00 0.00 C ATOM 0 H TRP A 396 -6.090 0.594 6.564 1.00 0.00 H new ATOM 0 HA TRP A 396 -3.140 0.645 5.947 1.00 0.00 H new ATOM 0 HB2 TRP A 396 -3.359 -0.969 8.143 1.00 0.00 H new ATOM 0 HB3 TRP A 396 -3.015 0.748 8.230 1.00 0.00 H new ATOM 0 HD1 TRP A 396 -6.426 -1.000 7.563 1.00 0.00 H new ATOM 0 HE1 TRP A 396 -8.143 -0.177 9.314 1.00 0.00 H new ATOM 0 HE3 TRP A 396 -3.356 1.973 10.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 396 -8.138 1.547 11.626 1.00 0.00 H new ATOM 0 HZ3 TRP A 396 -4.237 3.193 12.328 1.00 0.00 H new ATOM 0 HH2 TRP A 396 -6.622 2.980 12.967 1.00 0.00 H new ATOM 572 N CYS A 397 -3.549 -1.473 4.628 1.00 0.00 N ATOM 573 CA CYS A 397 -3.672 -2.803 3.968 1.00 0.00 C ATOM 574 C CYS A 397 -2.718 -3.803 4.619 1.00 0.00 C ATOM 575 O CYS A 397 -1.655 -3.448 5.090 1.00 0.00 O ATOM 576 CB CYS A 397 -3.336 -2.668 2.474 1.00 0.00 C ATOM 577 SG CYS A 397 -1.540 -2.707 2.218 1.00 0.00 S ATOM 0 H CYS A 397 -2.971 -0.794 4.133 1.00 0.00 H new ATOM 0 HA CYS A 397 -4.695 -3.163 4.081 1.00 0.00 H new ATOM 0 HB2 CYS A 397 -3.806 -3.477 1.915 1.00 0.00 H new ATOM 0 HB3 CYS A 397 -3.744 -1.734 2.087 1.00 0.00 H new ATOM 0 HG CYS A 397 -1.026 -1.568 2.576 1.00 0.00 H new ATOM 583 N THR A 398 -3.086 -5.056 4.618 1.00 0.00 N ATOM 584 CA THR A 398 -2.214 -6.119 5.202 1.00 0.00 C ATOM 585 C THR A 398 -2.038 -7.214 4.153 1.00 0.00 C ATOM 586 O THR A 398 -2.978 -7.591 3.481 1.00 0.00 O ATOM 587 CB THR A 398 -2.882 -6.709 6.446 1.00 0.00 C ATOM 588 OG1 THR A 398 -3.853 -7.668 6.053 1.00 0.00 O ATOM 589 CG2 THR A 398 -3.558 -5.594 7.241 1.00 0.00 C ATOM 0 H THR A 398 -3.967 -5.394 4.232 1.00 0.00 H new ATOM 0 HA THR A 398 -1.248 -5.701 5.485 1.00 0.00 H new ATOM 0 HB THR A 398 -2.128 -7.191 7.068 1.00 0.00 H new ATOM 0 HG1 THR A 398 -4.395 -7.304 5.322 1.00 0.00 H new ATOM 0 HG21 THR A 398 -4.033 -6.015 8.127 1.00 0.00 H new ATOM 0 HG22 THR A 398 -2.812 -4.860 7.544 1.00 0.00 H new ATOM 0 HG23 THR A 398 -4.312 -5.110 6.620 1.00 0.00 H new ATOM 597 N PHE A 399 -0.848 -7.722 3.988 1.00 0.00 N ATOM 598 CA PHE A 399 -0.638 -8.785 2.958 1.00 0.00 C ATOM 599 C PHE A 399 -0.888 -10.160 3.583 1.00 0.00 C ATOM 600 O PHE A 399 -0.070 -10.689 4.309 1.00 0.00 O ATOM 601 CB PHE A 399 0.797 -8.708 2.431 1.00 0.00 C ATOM 602 CG PHE A 399 0.914 -7.565 1.445 1.00 0.00 C ATOM 603 CD1 PHE A 399 0.863 -6.242 1.901 1.00 0.00 C ATOM 604 CD2 PHE A 399 1.070 -7.827 0.077 1.00 0.00 C ATOM 605 CE1 PHE A 399 0.968 -5.183 0.991 1.00 0.00 C ATOM 606 CE2 PHE A 399 1.175 -6.767 -0.833 1.00 0.00 C ATOM 607 CZ PHE A 399 1.124 -5.446 -0.375 1.00 0.00 C ATOM 0 H PHE A 399 -0.017 -7.452 4.515 1.00 0.00 H new ATOM 0 HA PHE A 399 -1.333 -8.635 2.132 1.00 0.00 H new ATOM 0 HB2 PHE A 399 1.492 -8.561 3.258 1.00 0.00 H new ATOM 0 HB3 PHE A 399 1.069 -9.647 1.949 1.00 0.00 H new ATOM 0 HD1 PHE A 399 0.743 -6.038 2.955 1.00 0.00 H new ATOM 0 HD2 PHE A 399 1.109 -8.847 -0.276 1.00 0.00 H new ATOM 0 HE1 PHE A 399 0.929 -4.163 1.343 1.00 0.00 H new ATOM 0 HE2 PHE A 399 1.295 -6.969 -1.887 1.00 0.00 H new ATOM 0 HZ PHE A 399 1.205 -4.628 -1.076 1.00 0.00 H new ATOM 617 N LYS A 400 -2.025 -10.736 3.298 1.00 0.00 N ATOM 618 CA LYS A 400 -2.365 -12.069 3.852 1.00 0.00 C ATOM 619 C LYS A 400 -1.400 -13.116 3.314 1.00 0.00 C ATOM 620 O LYS A 400 -0.492 -12.826 2.559 1.00 0.00 O ATOM 621 CB LYS A 400 -3.793 -12.441 3.389 1.00 0.00 C ATOM 622 CG LYS A 400 -4.534 -13.298 4.447 1.00 0.00 C ATOM 623 CD LYS A 400 -5.518 -12.437 5.246 1.00 0.00 C ATOM 624 CE LYS A 400 -4.760 -11.428 6.112 1.00 0.00 C ATOM 625 NZ LYS A 400 -4.256 -10.314 5.259 1.00 0.00 N ATOM 0 H LYS A 400 -2.740 -10.329 2.695 1.00 0.00 H new ATOM 0 HA LYS A 400 -2.301 -12.038 4.940 1.00 0.00 H new ATOM 0 HB2 LYS A 400 -4.361 -11.531 3.195 1.00 0.00 H new ATOM 0 HB3 LYS A 400 -3.739 -12.990 2.449 1.00 0.00 H new ATOM 0 HG2 LYS A 400 -5.069 -14.110 3.955 1.00 0.00 H new ATOM 0 HG3 LYS A 400 -3.812 -13.756 5.123 1.00 0.00 H new ATOM 0 HD2 LYS A 400 -6.188 -11.911 4.565 1.00 0.00 H new ATOM 0 HD3 LYS A 400 -6.139 -13.073 5.876 1.00 0.00 H new ATOM 0 HE2 LYS A 400 -5.416 -11.036 6.889 1.00 0.00 H new ATOM 0 HE3 LYS A 400 -3.927 -11.919 6.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 400 -3.219 -10.364 5.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 400 -4.661 -10.397 4.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 400 -4.536 -9.403 5.676 1.00 0.00 H new ATOM 639 N ASP A 401 -1.649 -14.343 3.669 1.00 0.00 N ATOM 640 CA ASP A 401 -0.836 -15.482 3.169 1.00 0.00 C ATOM 641 C ASP A 401 -0.537 -15.258 1.684 1.00 0.00 C ATOM 642 O ASP A 401 0.560 -15.468 1.208 1.00 0.00 O ATOM 643 CB ASP A 401 -1.699 -16.729 3.315 1.00 0.00 C ATOM 644 CG ASP A 401 -1.651 -17.230 4.761 1.00 0.00 C ATOM 645 OD1 ASP A 401 -0.574 -17.592 5.207 1.00 0.00 O ATOM 646 OD2 ASP A 401 -2.692 -17.244 5.397 1.00 0.00 O ATOM 0 H ASP A 401 -2.403 -14.610 4.302 1.00 0.00 H new ATOM 0 HA ASP A 401 0.101 -15.578 3.717 1.00 0.00 H new ATOM 0 HB2 ASP A 401 -2.728 -16.505 3.033 1.00 0.00 H new ATOM 0 HB3 ASP A 401 -1.345 -17.508 2.639 1.00 0.00 H new ATOM 651 N THR A 402 -1.531 -14.820 0.965 1.00 0.00 N ATOM 652 CA THR A 402 -1.363 -14.556 -0.484 1.00 0.00 C ATOM 653 C THR A 402 -2.464 -13.594 -0.936 1.00 0.00 C ATOM 654 O THR A 402 -2.430 -13.074 -2.034 1.00 0.00 O ATOM 655 CB THR A 402 -1.470 -15.871 -1.263 1.00 0.00 C ATOM 656 OG1 THR A 402 -1.764 -15.592 -2.625 1.00 0.00 O ATOM 657 CG2 THR A 402 -2.582 -16.733 -0.666 1.00 0.00 C ATOM 0 H THR A 402 -2.465 -14.632 1.328 1.00 0.00 H new ATOM 0 HA THR A 402 -0.385 -14.114 -0.672 1.00 0.00 H new ATOM 0 HB THR A 402 -0.524 -16.408 -1.198 1.00 0.00 H new ATOM 0 HG1 THR A 402 -1.903 -14.629 -2.739 1.00 0.00 H new ATOM 0 HG21 THR A 402 -2.656 -17.668 -1.222 1.00 0.00 H new ATOM 0 HG22 THR A 402 -2.354 -16.949 0.378 1.00 0.00 H new ATOM 0 HG23 THR A 402 -3.530 -16.198 -0.728 1.00 0.00 H new ATOM 665 N SER A 403 -3.442 -13.345 -0.089 1.00 0.00 N ATOM 666 CA SER A 403 -4.551 -12.406 -0.464 1.00 0.00 C ATOM 667 C SER A 403 -4.363 -11.081 0.275 1.00 0.00 C ATOM 668 O SER A 403 -3.483 -10.945 1.102 1.00 0.00 O ATOM 669 CB SER A 403 -5.895 -13.019 -0.067 1.00 0.00 C ATOM 670 OG SER A 403 -5.940 -14.372 -0.499 1.00 0.00 O ATOM 0 H SER A 403 -3.518 -13.752 0.843 1.00 0.00 H new ATOM 0 HA SER A 403 -4.533 -12.233 -1.540 1.00 0.00 H new ATOM 0 HB2 SER A 403 -6.027 -12.966 1.014 1.00 0.00 H new ATOM 0 HB3 SER A 403 -6.712 -12.454 -0.516 1.00 0.00 H new ATOM 0 HG SER A 403 -6.799 -14.768 -0.245 1.00 0.00 H new ATOM 676 N ILE A 404 -5.180 -10.101 -0.028 1.00 0.00 N ATOM 677 CA ILE A 404 -5.060 -8.763 0.639 1.00 0.00 C ATOM 678 C ILE A 404 -6.316 -8.471 1.462 1.00 0.00 C ATOM 679 O ILE A 404 -7.331 -9.129 1.336 1.00 0.00 O ATOM 680 CB ILE A 404 -4.914 -7.675 -0.433 1.00 0.00 C ATOM 681 CG1 ILE A 404 -3.752 -8.016 -1.377 1.00 0.00 C ATOM 682 CG2 ILE A 404 -4.657 -6.315 0.231 1.00 0.00 C ATOM 683 CD1 ILE A 404 -2.465 -8.270 -0.583 1.00 0.00 C ATOM 0 H ILE A 404 -5.931 -10.170 -0.714 1.00 0.00 H new ATOM 0 HA ILE A 404 -4.189 -8.772 1.294 1.00 0.00 H new ATOM 0 HB ILE A 404 -5.838 -7.625 -1.009 1.00 0.00 H new ATOM 0 HG12 ILE A 404 -4.002 -8.899 -1.966 1.00 0.00 H new ATOM 0 HG13 ILE A 404 -3.596 -7.198 -2.080 1.00 0.00 H new ATOM 0 HG21 ILE A 404 -4.555 -5.549 -0.537 1.00 0.00 H new ATOM 0 HG22 ILE A 404 -5.493 -6.065 0.884 1.00 0.00 H new ATOM 0 HG23 ILE A 404 -3.740 -6.364 0.819 1.00 0.00 H new ATOM 0 HD11 ILE A 404 -1.654 -8.510 -1.271 1.00 0.00 H new ATOM 0 HD12 ILE A 404 -2.206 -7.377 -0.014 1.00 0.00 H new ATOM 0 HD13 ILE A 404 -2.619 -9.104 0.102 1.00 0.00 H new ATOM 695 N SER A 405 -6.248 -7.467 2.293 1.00 0.00 N ATOM 696 CA SER A 405 -7.420 -7.076 3.135 1.00 0.00 C ATOM 697 C SER A 405 -7.453 -5.547 3.216 1.00 0.00 C ATOM 698 O SER A 405 -6.465 -4.894 2.946 1.00 0.00 O ATOM 699 CB SER A 405 -7.265 -7.671 4.535 1.00 0.00 C ATOM 700 OG SER A 405 -5.900 -7.613 4.920 1.00 0.00 O ATOM 0 H SER A 405 -5.417 -6.891 2.428 1.00 0.00 H new ATOM 0 HA SER A 405 -8.347 -7.449 2.700 1.00 0.00 H new ATOM 0 HB2 SER A 405 -7.879 -7.120 5.247 1.00 0.00 H new ATOM 0 HB3 SER A 405 -7.614 -8.704 4.545 1.00 0.00 H new ATOM 0 HG SER A 405 -5.808 -7.921 5.846 1.00 0.00 H new ATOM 706 N CYS A 406 -8.574 -4.963 3.562 1.00 0.00 N ATOM 707 CA CYS A 406 -8.642 -3.466 3.629 1.00 0.00 C ATOM 708 C CYS A 406 -9.502 -3.011 4.809 1.00 0.00 C ATOM 709 O CYS A 406 -10.712 -2.993 4.733 1.00 0.00 O ATOM 710 CB CYS A 406 -9.273 -2.957 2.332 1.00 0.00 C ATOM 711 SG CYS A 406 -9.718 -1.209 2.499 1.00 0.00 S ATOM 0 H CYS A 406 -9.438 -5.450 3.799 1.00 0.00 H new ATOM 0 HA CYS A 406 -7.636 -3.068 3.760 1.00 0.00 H new ATOM 0 HB2 CYS A 406 -8.575 -3.085 1.505 1.00 0.00 H new ATOM 0 HB3 CYS A 406 -10.160 -3.545 2.095 1.00 0.00 H new ATOM 0 HG CYS A 406 -8.659 -0.474 2.333 1.00 0.00 H new ATOM 717 N TYR A 407 -8.886 -2.593 5.885 1.00 0.00 N ATOM 718 CA TYR A 407 -9.671 -2.097 7.059 1.00 0.00 C ATOM 719 C TYR A 407 -9.560 -0.569 7.108 1.00 0.00 C ATOM 720 O TYR A 407 -8.479 -0.019 7.065 1.00 0.00 O ATOM 721 CB TYR A 407 -9.092 -2.690 8.348 1.00 0.00 C ATOM 722 CG TYR A 407 -9.402 -4.167 8.406 1.00 0.00 C ATOM 723 CD1 TYR A 407 -10.607 -4.608 8.967 1.00 0.00 C ATOM 724 CD2 TYR A 407 -8.485 -5.094 7.899 1.00 0.00 C ATOM 725 CE1 TYR A 407 -10.895 -5.977 9.020 1.00 0.00 C ATOM 726 CE2 TYR A 407 -8.772 -6.464 7.953 1.00 0.00 C ATOM 727 CZ TYR A 407 -9.977 -6.905 8.513 1.00 0.00 C ATOM 728 OH TYR A 407 -10.260 -8.255 8.565 1.00 0.00 O ATOM 0 H TYR A 407 -7.873 -2.573 6.003 1.00 0.00 H new ATOM 0 HA TYR A 407 -10.715 -2.395 6.964 1.00 0.00 H new ATOM 0 HB2 TYR A 407 -8.014 -2.532 8.381 1.00 0.00 H new ATOM 0 HB3 TYR A 407 -9.515 -2.184 9.216 1.00 0.00 H new ATOM 0 HD1 TYR A 407 -11.314 -3.892 9.359 1.00 0.00 H new ATOM 0 HD2 TYR A 407 -7.556 -4.753 7.466 1.00 0.00 H new ATOM 0 HE1 TYR A 407 -11.825 -6.317 9.452 1.00 0.00 H new ATOM 0 HE2 TYR A 407 -8.064 -7.180 7.563 1.00 0.00 H new ATOM 0 HH TYR A 407 -9.519 -8.760 8.170 1.00 0.00 H new ATOM 738 N LYS A 408 -10.664 0.126 7.188 1.00 0.00 N ATOM 739 CA LYS A 408 -10.610 1.622 7.231 1.00 0.00 C ATOM 740 C LYS A 408 -10.694 2.106 8.674 1.00 0.00 C ATOM 741 O LYS A 408 -10.264 3.193 9.003 1.00 0.00 O ATOM 742 CB LYS A 408 -11.798 2.199 6.464 1.00 0.00 C ATOM 743 CG LYS A 408 -11.781 1.678 5.028 1.00 0.00 C ATOM 744 CD LYS A 408 -13.076 2.089 4.308 1.00 0.00 C ATOM 745 CE LYS A 408 -13.300 1.175 3.106 1.00 0.00 C ATOM 746 NZ LYS A 408 -14.478 1.654 2.328 1.00 0.00 N ATOM 0 H LYS A 408 -11.601 -0.275 7.226 1.00 0.00 H new ATOM 0 HA LYS A 408 -9.672 1.950 6.782 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -12.731 1.918 6.953 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -11.752 3.288 6.467 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -10.917 2.077 4.497 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -11.682 0.592 5.027 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -13.922 2.023 4.992 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -13.010 3.127 3.982 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -12.413 1.165 2.473 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -13.464 0.151 3.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -14.454 1.242 1.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -15.353 1.363 2.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -14.450 2.691 2.258 1.00 0.00 H new ATOM 760 N SER A 409 -11.262 1.315 9.535 1.00 0.00 N ATOM 761 CA SER A 409 -11.394 1.744 10.958 1.00 0.00 C ATOM 762 C SER A 409 -12.196 0.705 11.749 1.00 0.00 C ATOM 763 O SER A 409 -12.557 -0.339 11.243 1.00 0.00 O ATOM 764 CB SER A 409 -12.114 3.100 10.999 1.00 0.00 C ATOM 765 OG SER A 409 -12.859 3.215 12.205 1.00 0.00 O ATOM 0 H SER A 409 -11.641 0.393 9.320 1.00 0.00 H new ATOM 0 HA SER A 409 -10.405 1.834 11.408 1.00 0.00 H new ATOM 0 HB2 SER A 409 -11.387 3.910 10.931 1.00 0.00 H new ATOM 0 HB3 SER A 409 -12.778 3.195 10.140 1.00 0.00 H new ATOM 0 HG SER A 409 -13.315 4.082 12.227 1.00 0.00 H new ATOM 866 N PRO A 417 -14.279 -5.638 5.531 1.00 0.00 N ATOM 867 CA PRO A 417 -13.388 -4.850 4.636 1.00 0.00 C ATOM 868 C PRO A 417 -14.054 -4.547 3.286 1.00 0.00 C ATOM 869 O PRO A 417 -14.345 -5.434 2.509 1.00 0.00 O ATOM 870 CB PRO A 417 -12.160 -5.753 4.459 1.00 0.00 C ATOM 871 CG PRO A 417 -12.105 -6.613 5.695 1.00 0.00 C ATOM 872 CD PRO A 417 -13.515 -6.617 6.326 1.00 0.00 C ATOM 0 HA PRO A 417 -13.142 -3.874 5.053 1.00 0.00 H new ATOM 0 HB2 PRO A 417 -12.249 -6.364 3.561 1.00 0.00 H new ATOM 0 HB3 PRO A 417 -11.251 -5.161 4.353 1.00 0.00 H new ATOM 0 HG2 PRO A 417 -11.796 -7.627 5.442 1.00 0.00 H new ATOM 0 HG3 PRO A 417 -11.371 -6.223 6.400 1.00 0.00 H new ATOM 0 HD2 PRO A 417 -13.968 -7.607 6.278 1.00 0.00 H new ATOM 0 HD3 PRO A 417 -13.480 -6.333 7.378 1.00 0.00 H new ATOM 880 N ALA A 418 -14.308 -3.297 3.018 1.00 0.00 N ATOM 881 CA ALA A 418 -14.969 -2.917 1.737 1.00 0.00 C ATOM 882 C ALA A 418 -14.204 -3.500 0.546 1.00 0.00 C ATOM 883 O ALA A 418 -14.727 -3.593 -0.547 1.00 0.00 O ATOM 884 CB ALA A 418 -14.992 -1.393 1.620 1.00 0.00 C ATOM 0 H ALA A 418 -14.085 -2.516 3.635 1.00 0.00 H new ATOM 0 HA ALA A 418 -15.985 -3.312 1.732 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -15.474 -1.107 0.685 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -15.547 -0.972 2.458 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -13.971 -1.012 1.633 1.00 0.00 H new ATOM 890 N HIS A 419 -12.965 -3.876 0.737 1.00 0.00 N ATOM 891 CA HIS A 419 -12.162 -4.433 -0.400 1.00 0.00 C ATOM 892 C HIS A 419 -11.272 -5.580 0.104 1.00 0.00 C ATOM 893 O HIS A 419 -10.399 -5.391 0.920 1.00 0.00 O ATOM 894 CB HIS A 419 -11.287 -3.296 -0.971 1.00 0.00 C ATOM 895 CG HIS A 419 -11.050 -3.493 -2.448 1.00 0.00 C ATOM 896 ND1 HIS A 419 -9.780 -3.441 -3.005 1.00 0.00 N ATOM 897 CD2 HIS A 419 -11.910 -3.727 -3.494 1.00 0.00 C ATOM 898 CE1 HIS A 419 -9.910 -3.638 -4.331 1.00 0.00 C ATOM 899 NE2 HIS A 419 -11.185 -3.817 -4.678 1.00 0.00 N ATOM 0 H HIS A 419 -12.473 -3.823 1.629 1.00 0.00 H new ATOM 0 HA HIS A 419 -12.822 -4.824 -1.175 1.00 0.00 H new ATOM 0 HB2 HIS A 419 -11.774 -2.336 -0.801 1.00 0.00 H new ATOM 0 HB3 HIS A 419 -10.332 -3.267 -0.446 1.00 0.00 H new ATOM 0 HD2 HIS A 419 -12.982 -3.826 -3.410 1.00 0.00 H new ATOM 0 HE1 HIS A 419 -9.084 -3.650 -5.027 1.00 0.00 H new ATOM 0 HE2 HIS A 419 -11.552 -3.985 -5.615 1.00 0.00 H new ATOM 908 N GLN A 420 -11.471 -6.770 -0.387 1.00 0.00 N ATOM 909 CA GLN A 420 -10.617 -7.910 0.063 1.00 0.00 C ATOM 910 C GLN A 420 -10.427 -8.870 -1.112 1.00 0.00 C ATOM 911 O GLN A 420 -11.348 -9.525 -1.555 1.00 0.00 O ATOM 912 CB GLN A 420 -11.284 -8.634 1.257 1.00 0.00 C ATOM 913 CG GLN A 420 -12.807 -8.427 1.234 1.00 0.00 C ATOM 914 CD GLN A 420 -13.395 -9.026 -0.043 1.00 0.00 C ATOM 915 OE1 GLN A 420 -13.676 -8.317 -0.988 1.00 0.00 O ATOM 916 NE2 GLN A 420 -13.594 -10.314 -0.112 1.00 0.00 N ATOM 0 H GLN A 420 -12.184 -7.005 -1.078 1.00 0.00 H new ATOM 0 HA GLN A 420 -9.645 -7.542 0.393 1.00 0.00 H new ATOM 0 HB2 GLN A 420 -11.056 -9.699 1.217 1.00 0.00 H new ATOM 0 HB3 GLN A 420 -10.874 -8.255 2.193 1.00 0.00 H new ATOM 0 HG2 GLN A 420 -13.260 -8.896 2.108 1.00 0.00 H new ATOM 0 HG3 GLN A 420 -13.039 -7.363 1.287 1.00 0.00 H new ATOM 0 HE21 GLN A 420 -13.358 -10.910 0.682 1.00 0.00 H new ATOM 0 HE22 GLN A 420 -13.985 -10.725 -0.960 1.00 0.00 H new ATOM 925 N MET A 421 -9.236 -8.948 -1.628 1.00 0.00 N ATOM 926 CA MET A 421 -8.993 -9.856 -2.779 1.00 0.00 C ATOM 927 C MET A 421 -7.491 -9.930 -3.078 1.00 0.00 C ATOM 928 O MET A 421 -6.709 -9.136 -2.594 1.00 0.00 O ATOM 929 CB MET A 421 -9.743 -9.311 -4.006 1.00 0.00 C ATOM 930 CG MET A 421 -9.779 -7.774 -3.966 1.00 0.00 C ATOM 931 SD MET A 421 -9.874 -7.130 -5.657 1.00 0.00 S ATOM 932 CE MET A 421 -11.675 -7.189 -5.830 1.00 0.00 C ATOM 0 H MET A 421 -8.423 -8.425 -1.304 1.00 0.00 H new ATOM 0 HA MET A 421 -9.352 -10.857 -2.541 1.00 0.00 H new ATOM 0 HB2 MET A 421 -9.253 -9.647 -4.920 1.00 0.00 H new ATOM 0 HB3 MET A 421 -10.759 -9.706 -4.025 1.00 0.00 H new ATOM 0 HG2 MET A 421 -10.638 -7.434 -3.387 1.00 0.00 H new ATOM 0 HG3 MET A 421 -8.888 -7.391 -3.469 1.00 0.00 H new ATOM 0 HE1 MET A 421 -11.958 -6.828 -6.819 1.00 0.00 H new ATOM 0 HE2 MET A 421 -12.019 -8.216 -5.706 1.00 0.00 H new ATOM 0 HE3 MET A 421 -12.134 -6.558 -5.069 1.00 0.00 H new ATOM 942 N ASN A 422 -7.090 -10.880 -3.883 1.00 0.00 N ATOM 943 CA ASN A 422 -5.650 -11.021 -4.237 1.00 0.00 C ATOM 944 C ASN A 422 -5.370 -10.235 -5.520 1.00 0.00 C ATOM 945 O ASN A 422 -5.665 -10.686 -6.608 1.00 0.00 O ATOM 946 CB ASN A 422 -5.340 -12.500 -4.473 1.00 0.00 C ATOM 947 CG ASN A 422 -6.341 -13.079 -5.475 1.00 0.00 C ATOM 948 OD1 ASN A 422 -7.259 -12.402 -5.893 1.00 0.00 O ATOM 949 ND2 ASN A 422 -6.200 -14.311 -5.881 1.00 0.00 N ATOM 0 H ASN A 422 -7.706 -11.570 -4.313 1.00 0.00 H new ATOM 0 HA ASN A 422 -5.028 -10.637 -3.429 1.00 0.00 H new ATOM 0 HB2 ASN A 422 -4.324 -12.613 -4.851 1.00 0.00 H new ATOM 0 HB3 ASN A 422 -5.393 -13.048 -3.532 1.00 0.00 H new ATOM 0 HD21 ASN A 422 -6.861 -14.706 -6.550 1.00 0.00 H new ATOM 0 HD22 ASN A 422 -5.429 -14.879 -5.530 1.00 0.00 H new ATOM 956 N LEU A 423 -4.806 -9.063 -5.406 1.00 0.00 N ATOM 957 CA LEU A 423 -4.515 -8.259 -6.629 1.00 0.00 C ATOM 958 C LEU A 423 -3.268 -8.819 -7.314 1.00 0.00 C ATOM 959 O LEU A 423 -3.300 -9.202 -8.467 1.00 0.00 O ATOM 960 CB LEU A 423 -4.258 -6.796 -6.241 1.00 0.00 C ATOM 961 CG LEU A 423 -5.572 -6.089 -5.872 1.00 0.00 C ATOM 962 CD1 LEU A 423 -6.489 -5.960 -7.104 1.00 0.00 C ATOM 963 CD2 LEU A 423 -6.288 -6.876 -4.769 1.00 0.00 C ATOM 0 H LEU A 423 -4.535 -8.629 -4.524 1.00 0.00 H new ATOM 0 HA LEU A 423 -5.368 -8.311 -7.305 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -3.569 -6.755 -5.398 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -3.780 -6.274 -7.070 1.00 0.00 H new ATOM 0 HG LEU A 423 -5.339 -5.087 -5.512 1.00 0.00 H new ATOM 0 HD11 LEU A 423 -7.413 -5.457 -6.819 1.00 0.00 H new ATOM 0 HD12 LEU A 423 -5.983 -5.380 -7.875 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -6.721 -6.952 -7.490 1.00 0.00 H new ATOM 0 HD21 LEU A 423 -7.219 -6.373 -4.509 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -6.507 -7.883 -5.124 1.00 0.00 H new ATOM 0 HD23 LEU A 423 -5.648 -6.933 -3.888 1.00 0.00 H new ATOM 975 N ARG A 424 -2.172 -8.873 -6.606 1.00 0.00 N ATOM 976 CA ARG A 424 -0.916 -9.407 -7.206 1.00 0.00 C ATOM 977 C ARG A 424 -0.581 -8.635 -8.490 1.00 0.00 C ATOM 978 O ARG A 424 -1.417 -7.971 -9.070 1.00 0.00 O ATOM 979 CB ARG A 424 -1.099 -10.895 -7.535 1.00 0.00 C ATOM 980 CG ARG A 424 0.272 -11.560 -7.715 1.00 0.00 C ATOM 981 CD ARG A 424 0.095 -13.048 -8.034 1.00 0.00 C ATOM 982 NE ARG A 424 1.336 -13.562 -8.682 1.00 0.00 N ATOM 983 CZ ARG A 424 1.551 -14.847 -8.762 1.00 0.00 C ATOM 984 NH1 ARG A 424 0.686 -15.687 -8.262 1.00 0.00 N ATOM 985 NH2 ARG A 424 2.635 -15.292 -9.339 1.00 0.00 N ATOM 0 H ARG A 424 -2.093 -8.569 -5.635 1.00 0.00 H new ATOM 0 HA ARG A 424 -0.099 -9.288 -6.494 1.00 0.00 H new ATOM 0 HB2 ARG A 424 -1.651 -11.389 -6.735 1.00 0.00 H new ATOM 0 HB3 ARG A 424 -1.689 -11.006 -8.445 1.00 0.00 H new ATOM 0 HG2 ARG A 424 0.820 -11.070 -8.520 1.00 0.00 H new ATOM 0 HG3 ARG A 424 0.864 -11.442 -6.808 1.00 0.00 H new ATOM 0 HD2 ARG A 424 -0.110 -13.606 -7.120 1.00 0.00 H new ATOM 0 HD3 ARG A 424 -0.760 -13.191 -8.694 1.00 0.00 H new ATOM 0 HE ARG A 424 2.019 -12.907 -9.064 1.00 0.00 H new ATOM 0 HH11 ARG A 424 -0.159 -15.339 -7.808 1.00 0.00 H new ATOM 0 HH12 ARG A 424 0.855 -16.691 -8.325 1.00 0.00 H new ATOM 0 HH21 ARG A 424 3.313 -14.636 -9.727 1.00 0.00 H new ATOM 0 HH22 ARG A 424 2.804 -16.296 -9.402 1.00 0.00 H new ATOM 999 N GLY A 425 0.636 -8.732 -8.943 1.00 0.00 N ATOM 1000 CA GLY A 425 1.036 -8.029 -10.195 1.00 0.00 C ATOM 1001 C GLY A 425 0.688 -6.537 -10.131 1.00 0.00 C ATOM 1002 O GLY A 425 0.362 -5.934 -11.133 1.00 0.00 O ATOM 0 H GLY A 425 1.378 -9.272 -8.497 1.00 0.00 H new ATOM 0 HA2 GLY A 425 2.108 -8.148 -10.355 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.533 -8.486 -11.048 1.00 0.00 H new ATOM 1006 N CYS A 426 0.771 -5.922 -8.980 1.00 0.00 N ATOM 1007 CA CYS A 426 0.462 -4.466 -8.905 1.00 0.00 C ATOM 1008 C CYS A 426 1.687 -3.694 -9.389 1.00 0.00 C ATOM 1009 O CYS A 426 2.804 -4.155 -9.269 1.00 0.00 O ATOM 1010 CB CYS A 426 0.138 -4.073 -7.460 1.00 0.00 C ATOM 1011 SG CYS A 426 1.291 -4.894 -6.332 1.00 0.00 S ATOM 0 H CYS A 426 1.037 -6.360 -8.098 1.00 0.00 H new ATOM 0 HA CYS A 426 -0.402 -4.234 -9.528 1.00 0.00 H new ATOM 0 HB2 CYS A 426 0.207 -2.992 -7.343 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -0.886 -4.355 -7.217 1.00 0.00 H new ATOM 0 HG CYS A 426 1.015 -4.556 -5.107 1.00 0.00 H new ATOM 1017 N GLU A 427 1.499 -2.526 -9.937 1.00 0.00 N ATOM 1018 CA GLU A 427 2.667 -1.754 -10.419 1.00 0.00 C ATOM 1019 C GLU A 427 3.356 -1.101 -9.226 1.00 0.00 C ATOM 1020 O GLU A 427 2.765 -0.906 -8.182 1.00 0.00 O ATOM 1021 CB GLU A 427 2.195 -0.675 -11.384 1.00 0.00 C ATOM 1022 CG GLU A 427 3.402 0.085 -11.936 1.00 0.00 C ATOM 1023 CD GLU A 427 2.969 0.931 -13.133 1.00 0.00 C ATOM 1024 OE1 GLU A 427 2.191 0.437 -13.933 1.00 0.00 O ATOM 1025 OE2 GLU A 427 3.422 2.059 -13.231 1.00 0.00 O ATOM 0 H GLU A 427 0.592 -2.079 -10.069 1.00 0.00 H new ATOM 0 HA GLU A 427 3.364 -2.418 -10.930 1.00 0.00 H new ATOM 0 HB2 GLU A 427 1.632 -1.125 -12.201 1.00 0.00 H new ATOM 0 HB3 GLU A 427 1.521 0.014 -10.874 1.00 0.00 H new ATOM 0 HG2 GLU A 427 3.828 0.723 -11.162 1.00 0.00 H new ATOM 0 HG3 GLU A 427 4.181 -0.616 -12.236 1.00 0.00 H new ATOM 1032 N VAL A 428 4.600 -0.757 -9.376 1.00 0.00 N ATOM 1033 CA VAL A 428 5.349 -0.106 -8.256 1.00 0.00 C ATOM 1034 C VAL A 428 6.340 0.913 -8.828 1.00 0.00 C ATOM 1035 O VAL A 428 7.215 0.584 -9.604 1.00 0.00 O ATOM 1036 CB VAL A 428 6.096 -1.174 -7.435 1.00 0.00 C ATOM 1037 CG1 VAL A 428 6.838 -2.140 -8.365 1.00 0.00 C ATOM 1038 CG2 VAL A 428 7.105 -0.502 -6.494 1.00 0.00 C ATOM 0 H VAL A 428 5.140 -0.897 -10.230 1.00 0.00 H new ATOM 0 HA VAL A 428 4.647 0.410 -7.601 1.00 0.00 H new ATOM 0 HB VAL A 428 5.365 -1.731 -6.849 1.00 0.00 H new ATOM 0 HG11 VAL A 428 7.361 -2.889 -7.770 1.00 0.00 H new ATOM 0 HG12 VAL A 428 6.122 -2.634 -9.022 1.00 0.00 H new ATOM 0 HG13 VAL A 428 7.559 -1.585 -8.965 1.00 0.00 H new ATOM 0 HG21 VAL A 428 7.629 -1.265 -5.917 1.00 0.00 H new ATOM 0 HG22 VAL A 428 7.826 0.068 -7.080 1.00 0.00 H new ATOM 0 HG23 VAL A 428 6.578 0.169 -5.815 1.00 0.00 H new ATOM 1048 N THR A 429 6.200 2.151 -8.442 1.00 0.00 N ATOM 1049 CA THR A 429 7.122 3.210 -8.943 1.00 0.00 C ATOM 1050 C THR A 429 7.160 4.360 -7.918 1.00 0.00 C ATOM 1051 O THR A 429 6.257 5.173 -7.877 1.00 0.00 O ATOM 1052 CB THR A 429 6.602 3.734 -10.285 1.00 0.00 C ATOM 1053 OG1 THR A 429 6.589 2.671 -11.227 1.00 0.00 O ATOM 1054 CG2 THR A 429 7.515 4.851 -10.789 1.00 0.00 C ATOM 0 H THR A 429 5.481 2.477 -7.796 1.00 0.00 H new ATOM 0 HA THR A 429 8.125 2.804 -9.077 1.00 0.00 H new ATOM 0 HB THR A 429 5.593 4.125 -10.158 1.00 0.00 H new ATOM 0 HG1 THR A 429 6.255 3.001 -12.088 1.00 0.00 H new ATOM 0 HG21 THR A 429 7.143 5.222 -11.744 1.00 0.00 H new ATOM 0 HG22 THR A 429 7.529 5.665 -10.064 1.00 0.00 H new ATOM 0 HG23 THR A 429 8.526 4.464 -10.919 1.00 0.00 H new ATOM 1062 N PRO A 430 8.173 4.433 -7.081 1.00 0.00 N ATOM 1063 CA PRO A 430 8.268 5.502 -6.047 1.00 0.00 C ATOM 1064 C PRO A 430 8.836 6.814 -6.603 1.00 0.00 C ATOM 1065 O PRO A 430 9.698 6.820 -7.458 1.00 0.00 O ATOM 1066 CB PRO A 430 9.213 4.892 -5.009 1.00 0.00 C ATOM 1067 CG PRO A 430 10.140 4.028 -5.805 1.00 0.00 C ATOM 1068 CD PRO A 430 9.335 3.522 -7.015 1.00 0.00 C ATOM 0 HA PRO A 430 7.292 5.777 -5.648 1.00 0.00 H new ATOM 0 HB2 PRO A 430 9.758 5.665 -4.467 1.00 0.00 H new ATOM 0 HB3 PRO A 430 8.665 4.309 -4.268 1.00 0.00 H new ATOM 0 HG2 PRO A 430 11.014 4.593 -6.129 1.00 0.00 H new ATOM 0 HG3 PRO A 430 10.504 3.194 -5.205 1.00 0.00 H new ATOM 0 HD2 PRO A 430 9.925 3.561 -7.931 1.00 0.00 H new ATOM 0 HD3 PRO A 430 9.023 2.486 -6.881 1.00 0.00 H new ATOM 1076 N ASP A 431 8.356 7.926 -6.113 1.00 0.00 N ATOM 1077 CA ASP A 431 8.858 9.245 -6.596 1.00 0.00 C ATOM 1078 C ASP A 431 8.613 10.299 -5.517 1.00 0.00 C ATOM 1079 O ASP A 431 7.500 10.746 -5.321 1.00 0.00 O ATOM 1080 CB ASP A 431 8.113 9.646 -7.872 1.00 0.00 C ATOM 1081 CG ASP A 431 8.053 8.452 -8.826 1.00 0.00 C ATOM 1082 OD1 ASP A 431 7.142 7.653 -8.688 1.00 0.00 O ATOM 1083 OD2 ASP A 431 8.921 8.358 -9.679 1.00 0.00 O ATOM 0 H ASP A 431 7.634 7.977 -5.395 1.00 0.00 H new ATOM 0 HA ASP A 431 9.924 9.172 -6.809 1.00 0.00 H new ATOM 0 HB2 ASP A 431 7.105 9.980 -7.627 1.00 0.00 H new ATOM 0 HB3 ASP A 431 8.618 10.484 -8.353 1.00 0.00 H new ATOM 1088 N VAL A 432 9.644 10.692 -4.806 1.00 0.00 N ATOM 1089 CA VAL A 432 9.481 11.714 -3.724 1.00 0.00 C ATOM 1090 C VAL A 432 10.529 12.819 -3.882 1.00 0.00 C ATOM 1091 O VAL A 432 11.709 12.564 -4.009 1.00 0.00 O ATOM 1092 CB VAL A 432 9.652 11.032 -2.358 1.00 0.00 C ATOM 1093 CG1 VAL A 432 10.900 10.146 -2.361 1.00 0.00 C ATOM 1094 CG2 VAL A 432 9.785 12.091 -1.252 1.00 0.00 C ATOM 0 H VAL A 432 10.596 10.347 -4.930 1.00 0.00 H new ATOM 0 HA VAL A 432 8.488 12.158 -3.793 1.00 0.00 H new ATOM 0 HB VAL A 432 8.773 10.416 -2.167 1.00 0.00 H new ATOM 0 HG11 VAL A 432 11.010 9.669 -1.387 1.00 0.00 H new ATOM 0 HG12 VAL A 432 10.801 9.381 -3.131 1.00 0.00 H new ATOM 0 HG13 VAL A 432 11.779 10.757 -2.567 1.00 0.00 H new ATOM 0 HG21 VAL A 432 9.906 11.597 -0.288 1.00 0.00 H new ATOM 0 HG22 VAL A 432 10.655 12.717 -1.450 1.00 0.00 H new ATOM 0 HG23 VAL A 432 8.889 12.711 -1.232 1.00 0.00 H new ATOM 1104 N ASN A 433 10.097 14.052 -3.848 1.00 0.00 N ATOM 1105 CA ASN A 433 11.052 15.193 -3.963 1.00 0.00 C ATOM 1106 C ASN A 433 11.428 15.630 -2.548 1.00 0.00 C ATOM 1107 O ASN A 433 10.575 15.945 -1.742 1.00 0.00 O ATOM 1108 CB ASN A 433 10.382 16.351 -4.705 1.00 0.00 C ATOM 1109 CG ASN A 433 10.001 15.900 -6.117 1.00 0.00 C ATOM 1110 OD1 ASN A 433 10.025 14.629 -6.413 1.00 0.00 O flip ATOM 1111 ND2 ASN A 433 9.676 16.713 -6.961 1.00 0.00 N flip ATOM 0 H ASN A 433 9.118 14.319 -3.745 1.00 0.00 H new ATOM 0 HA ASN A 433 11.942 14.895 -4.517 1.00 0.00 H new ATOM 0 HB2 ASN A 433 9.494 16.678 -4.164 1.00 0.00 H new ATOM 0 HB3 ASN A 433 11.058 17.205 -4.754 1.00 0.00 H new ATOM 0 HD21 ASN A 433 9.657 17.707 -6.731 1.00 0.00 H new ATOM 0 HD22 ASN A 433 9.423 16.401 -7.899 1.00 0.00 H new ATOM 1118 N ILE A 434 12.690 15.622 -2.223 1.00 0.00 N ATOM 1119 CA ILE A 434 13.094 16.005 -0.842 1.00 0.00 C ATOM 1120 C ILE A 434 13.014 17.521 -0.664 1.00 0.00 C ATOM 1121 O ILE A 434 12.582 18.005 0.361 1.00 0.00 O ATOM 1122 CB ILE A 434 14.526 15.539 -0.566 1.00 0.00 C ATOM 1123 CG1 ILE A 434 14.657 14.028 -0.858 1.00 0.00 C ATOM 1124 CG2 ILE A 434 14.859 15.799 0.906 1.00 0.00 C ATOM 1125 CD1 ILE A 434 14.793 13.757 -2.368 1.00 0.00 C ATOM 0 H ILE A 434 13.455 15.369 -2.849 1.00 0.00 H new ATOM 0 HA ILE A 434 12.412 15.526 -0.139 1.00 0.00 H new ATOM 0 HB ILE A 434 15.214 16.087 -1.209 1.00 0.00 H new ATOM 0 HG12 ILE A 434 15.526 13.629 -0.335 1.00 0.00 H new ATOM 0 HG13 ILE A 434 13.784 13.504 -0.470 1.00 0.00 H new ATOM 0 HG21 ILE A 434 15.878 15.470 1.112 1.00 0.00 H new ATOM 0 HG22 ILE A 434 14.772 16.865 1.116 1.00 0.00 H new ATOM 0 HG23 ILE A 434 14.164 15.247 1.539 1.00 0.00 H new ATOM 0 HD11 ILE A 434 14.883 12.684 -2.538 1.00 0.00 H new ATOM 0 HD12 ILE A 434 13.911 14.134 -2.886 1.00 0.00 H new ATOM 0 HD13 ILE A 434 15.681 14.261 -2.750 1.00 0.00 H new ATOM 1137 N SER A 435 13.427 18.278 -1.645 1.00 0.00 N ATOM 1138 CA SER A 435 13.370 19.765 -1.514 1.00 0.00 C ATOM 1139 C SER A 435 12.003 20.175 -0.959 1.00 0.00 C ATOM 1140 O SER A 435 11.879 21.137 -0.229 1.00 0.00 O ATOM 1141 CB SER A 435 13.567 20.400 -2.893 1.00 0.00 C ATOM 1142 OG SER A 435 13.840 21.787 -2.740 1.00 0.00 O ATOM 0 H SER A 435 13.801 17.933 -2.529 1.00 0.00 H new ATOM 0 HA SER A 435 14.155 20.103 -0.837 1.00 0.00 H new ATOM 0 HB2 SER A 435 14.389 19.912 -3.416 1.00 0.00 H new ATOM 0 HB3 SER A 435 12.674 20.259 -3.501 1.00 0.00 H new ATOM 0 HG SER A 435 13.968 22.194 -3.622 1.00 0.00 H new ATOM 1148 N GLY A 436 10.981 19.431 -1.298 1.00 0.00 N ATOM 1149 CA GLY A 436 9.603 19.728 -0.803 1.00 0.00 C ATOM 1150 C GLY A 436 9.074 18.506 -0.061 1.00 0.00 C ATOM 1151 O GLY A 436 7.900 18.421 0.231 1.00 0.00 O ATOM 0 H GLY A 436 11.045 18.616 -1.908 1.00 0.00 H new ATOM 0 HA2 GLY A 436 9.618 20.594 -0.141 1.00 0.00 H new ATOM 0 HA3 GLY A 436 8.947 19.976 -1.638 1.00 0.00 H new ATOM 1155 N GLN A 437 9.945 17.561 0.234 1.00 0.00 N ATOM 1156 CA GLN A 437 9.555 16.310 0.964 1.00 0.00 C ATOM 1157 C GLN A 437 8.122 15.926 0.589 1.00 0.00 C ATOM 1158 O GLN A 437 7.176 16.163 1.313 1.00 0.00 O ATOM 1159 CB GLN A 437 9.722 16.509 2.496 1.00 0.00 C ATOM 1160 CG GLN A 437 10.273 17.917 2.802 1.00 0.00 C ATOM 1161 CD GLN A 437 9.144 18.952 2.771 1.00 0.00 C ATOM 1162 OE1 GLN A 437 7.915 18.563 2.566 1.00 0.00 O flip ATOM 1163 NE2 GLN A 437 9.385 20.131 2.936 1.00 0.00 N flip ATOM 0 H GLN A 437 10.934 17.610 -0.009 1.00 0.00 H new ATOM 0 HA GLN A 437 10.211 15.490 0.671 1.00 0.00 H new ATOM 0 HB2 GLN A 437 8.762 16.372 2.993 1.00 0.00 H new ATOM 0 HB3 GLN A 437 10.398 15.753 2.895 1.00 0.00 H new ATOM 0 HG2 GLN A 437 10.752 17.922 3.781 1.00 0.00 H new ATOM 0 HG3 GLN A 437 11.037 18.182 2.072 1.00 0.00 H new ATOM 0 HE21 GLN A 437 10.344 20.438 3.096 1.00 0.00 H new ATOM 0 HE22 GLN A 437 8.628 20.814 2.914 1.00 0.00 H new ATOM 1172 N LYS A 438 7.978 15.359 -0.571 1.00 0.00 N ATOM 1173 CA LYS A 438 6.636 14.960 -1.084 1.00 0.00 C ATOM 1174 C LYS A 438 6.575 13.445 -1.206 1.00 0.00 C ATOM 1175 O LYS A 438 6.882 12.889 -2.240 1.00 0.00 O ATOM 1176 CB LYS A 438 6.444 15.555 -2.476 1.00 0.00 C ATOM 1177 CG LYS A 438 6.707 17.064 -2.444 1.00 0.00 C ATOM 1178 CD LYS A 438 6.741 17.619 -3.883 1.00 0.00 C ATOM 1179 CE LYS A 438 7.574 18.901 -3.934 1.00 0.00 C ATOM 1180 NZ LYS A 438 7.675 19.366 -5.347 1.00 0.00 N ATOM 0 H LYS A 438 8.751 15.149 -1.203 1.00 0.00 H new ATOM 0 HA LYS A 438 5.864 15.316 -0.402 1.00 0.00 H new ATOM 0 HB2 LYS A 438 7.122 15.075 -3.182 1.00 0.00 H new ATOM 0 HB3 LYS A 438 5.430 15.362 -2.826 1.00 0.00 H new ATOM 0 HG2 LYS A 438 5.929 17.566 -1.869 1.00 0.00 H new ATOM 0 HG3 LYS A 438 7.654 17.267 -1.944 1.00 0.00 H new ATOM 0 HD2 LYS A 438 7.164 16.875 -4.558 1.00 0.00 H new ATOM 0 HD3 LYS A 438 5.727 17.822 -4.227 1.00 0.00 H new ATOM 0 HE2 LYS A 438 7.113 19.673 -3.317 1.00 0.00 H new ATOM 0 HE3 LYS A 438 8.569 18.719 -3.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 438 8.296 20.199 -5.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 438 8.070 18.605 -5.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 438 6.729 19.619 -5.698 1.00 0.00 H new ATOM 1194 N PHE A 439 6.179 12.767 -0.175 1.00 0.00 N ATOM 1195 CA PHE A 439 6.109 11.286 -0.271 1.00 0.00 C ATOM 1196 C PHE A 439 4.879 10.898 -1.092 1.00 0.00 C ATOM 1197 O PHE A 439 3.772 10.894 -0.593 1.00 0.00 O ATOM 1198 CB PHE A 439 5.973 10.667 1.116 1.00 0.00 C ATOM 1199 CG PHE A 439 7.133 11.059 2.001 1.00 0.00 C ATOM 1200 CD1 PHE A 439 8.413 10.550 1.748 1.00 0.00 C ATOM 1201 CD2 PHE A 439 6.922 11.909 3.092 1.00 0.00 C ATOM 1202 CE1 PHE A 439 9.477 10.896 2.587 1.00 0.00 C ATOM 1203 CE2 PHE A 439 7.988 12.259 3.921 1.00 0.00 C ATOM 1204 CZ PHE A 439 9.261 11.753 3.671 1.00 0.00 C ATOM 0 H PHE A 439 5.903 13.165 0.722 1.00 0.00 H new ATOM 0 HA PHE A 439 7.022 10.922 -0.742 1.00 0.00 H new ATOM 0 HB2 PHE A 439 5.038 10.991 1.572 1.00 0.00 H new ATOM 0 HB3 PHE A 439 5.927 9.581 1.031 1.00 0.00 H new ATOM 0 HD1 PHE A 439 8.578 9.892 0.907 1.00 0.00 H new ATOM 0 HD2 PHE A 439 5.933 12.294 3.293 1.00 0.00 H new ATOM 0 HE1 PHE A 439 10.465 10.502 2.398 1.00 0.00 H new ATOM 0 HE2 PHE A 439 7.826 12.923 4.757 1.00 0.00 H new ATOM 0 HZ PHE A 439 10.084 12.023 4.316 1.00 0.00 H new ATOM 1214 N ASN A 440 5.065 10.567 -2.347 1.00 0.00 N ATOM 1215 CA ASN A 440 3.908 10.170 -3.212 1.00 0.00 C ATOM 1216 C ASN A 440 4.235 8.831 -3.886 1.00 0.00 C ATOM 1217 O ASN A 440 4.938 8.779 -4.876 1.00 0.00 O ATOM 1218 CB ASN A 440 3.686 11.272 -4.274 1.00 0.00 C ATOM 1219 CG ASN A 440 2.186 11.524 -4.486 1.00 0.00 C ATOM 1220 OD1 ASN A 440 1.665 11.337 -5.667 1.00 0.00 O flip ATOM 1221 ND2 ASN A 440 1.486 11.899 -3.567 1.00 0.00 N flip ATOM 0 H ASN A 440 5.973 10.555 -2.812 1.00 0.00 H new ATOM 0 HA ASN A 440 3.000 10.057 -2.620 1.00 0.00 H new ATOM 0 HB2 ASN A 440 4.174 12.194 -3.957 1.00 0.00 H new ATOM 0 HB3 ASN A 440 4.147 10.975 -5.216 1.00 0.00 H new ATOM 0 HD21 ASN A 440 1.893 12.045 -2.643 1.00 0.00 H new ATOM 0 HD22 ASN A 440 0.492 12.067 -3.719 1.00 0.00 H new ATOM 1228 N ILE A 441 3.730 7.749 -3.355 1.00 0.00 N ATOM 1229 CA ILE A 441 4.000 6.421 -3.945 1.00 0.00 C ATOM 1230 C ILE A 441 3.001 6.198 -5.088 1.00 0.00 C ATOM 1231 O ILE A 441 1.799 6.241 -4.899 1.00 0.00 O ATOM 1232 CB ILE A 441 3.868 5.348 -2.827 1.00 0.00 C ATOM 1233 CG1 ILE A 441 3.315 4.014 -3.371 1.00 0.00 C ATOM 1234 CG2 ILE A 441 2.929 5.860 -1.735 1.00 0.00 C ATOM 1235 CD1 ILE A 441 4.132 3.536 -4.579 1.00 0.00 C ATOM 0 H ILE A 441 3.135 7.737 -2.527 1.00 0.00 H new ATOM 0 HA ILE A 441 5.008 6.352 -4.354 1.00 0.00 H new ATOM 0 HB ILE A 441 4.865 5.168 -2.426 1.00 0.00 H new ATOM 0 HG12 ILE A 441 3.341 3.258 -2.587 1.00 0.00 H new ATOM 0 HG13 ILE A 441 2.271 4.139 -3.659 1.00 0.00 H new ATOM 0 HG21 ILE A 441 2.837 5.107 -0.952 1.00 0.00 H new ATOM 0 HG22 ILE A 441 3.332 6.779 -1.310 1.00 0.00 H new ATOM 0 HG23 ILE A 441 1.947 6.059 -2.164 1.00 0.00 H new ATOM 0 HD11 ILE A 441 3.723 2.594 -4.945 1.00 0.00 H new ATOM 0 HD12 ILE A 441 4.084 4.284 -5.370 1.00 0.00 H new ATOM 0 HD13 ILE A 441 5.170 3.390 -4.281 1.00 0.00 H new ATOM 1247 N LYS A 442 3.499 5.991 -6.277 1.00 0.00 N ATOM 1248 CA LYS A 442 2.614 5.795 -7.454 1.00 0.00 C ATOM 1249 C LYS A 442 2.209 4.318 -7.555 1.00 0.00 C ATOM 1250 O LYS A 442 2.875 3.522 -8.186 1.00 0.00 O ATOM 1251 CB LYS A 442 3.404 6.231 -8.708 1.00 0.00 C ATOM 1252 CG LYS A 442 2.473 6.754 -9.812 1.00 0.00 C ATOM 1253 CD LYS A 442 1.847 5.582 -10.563 1.00 0.00 C ATOM 1254 CE LYS A 442 0.874 6.115 -11.617 1.00 0.00 C ATOM 1255 NZ LYS A 442 0.614 5.057 -12.631 1.00 0.00 N ATOM 0 H LYS A 442 4.497 5.949 -6.482 1.00 0.00 H new ATOM 0 HA LYS A 442 1.703 6.387 -7.362 1.00 0.00 H new ATOM 0 HB2 LYS A 442 4.119 7.008 -8.436 1.00 0.00 H new ATOM 0 HB3 LYS A 442 3.980 5.387 -9.087 1.00 0.00 H new ATOM 0 HG2 LYS A 442 1.692 7.377 -9.376 1.00 0.00 H new ATOM 0 HG3 LYS A 442 3.033 7.383 -10.504 1.00 0.00 H new ATOM 0 HD2 LYS A 442 2.624 4.984 -11.039 1.00 0.00 H new ATOM 0 HD3 LYS A 442 1.323 4.928 -9.866 1.00 0.00 H new ATOM 0 HE2 LYS A 442 -0.060 6.419 -11.145 1.00 0.00 H new ATOM 0 HE3 LYS A 442 1.291 7.000 -12.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 0.844 5.420 -13.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 1.205 4.226 -12.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 -0.389 4.784 -12.599 1.00 0.00 H new ATOM 1269 N LEU A 443 1.111 3.949 -6.944 1.00 0.00 N ATOM 1270 CA LEU A 443 0.647 2.530 -7.008 1.00 0.00 C ATOM 1271 C LEU A 443 -0.396 2.417 -8.127 1.00 0.00 C ATOM 1272 O LEU A 443 -1.397 3.107 -8.112 1.00 0.00 O ATOM 1273 CB LEU A 443 0.021 2.146 -5.651 1.00 0.00 C ATOM 1274 CG LEU A 443 0.348 0.681 -5.279 1.00 0.00 C ATOM 1275 CD1 LEU A 443 -0.105 -0.274 -6.404 1.00 0.00 C ATOM 1276 CD2 LEU A 443 1.862 0.511 -5.014 1.00 0.00 C ATOM 0 H LEU A 443 0.514 4.573 -6.401 1.00 0.00 H new ATOM 0 HA LEU A 443 1.479 1.857 -7.215 1.00 0.00 H new ATOM 0 HB2 LEU A 443 0.394 2.813 -4.874 1.00 0.00 H new ATOM 0 HB3 LEU A 443 -1.060 2.280 -5.695 1.00 0.00 H new ATOM 0 HG LEU A 443 -0.194 0.431 -4.367 1.00 0.00 H new ATOM 0 HD11 LEU A 443 0.132 -1.301 -6.127 1.00 0.00 H new ATOM 0 HD12 LEU A 443 -1.181 -0.177 -6.552 1.00 0.00 H new ATOM 0 HD13 LEU A 443 0.413 -0.019 -7.328 1.00 0.00 H new ATOM 0 HD21 LEU A 443 2.072 -0.527 -4.754 1.00 0.00 H new ATOM 0 HD22 LEU A 443 2.421 0.780 -5.910 1.00 0.00 H new ATOM 0 HD23 LEU A 443 2.162 1.159 -4.191 1.00 0.00 H new ATOM 1288 N LEU A 444 -0.175 1.563 -9.097 1.00 0.00 N ATOM 1289 CA LEU A 444 -1.164 1.418 -10.216 1.00 0.00 C ATOM 1290 C LEU A 444 -1.406 -0.070 -10.487 1.00 0.00 C ATOM 1291 O LEU A 444 -0.531 -0.894 -10.309 1.00 0.00 O ATOM 1292 CB LEU A 444 -0.617 2.113 -11.476 1.00 0.00 C ATOM 1293 CG LEU A 444 -1.648 2.042 -12.610 1.00 0.00 C ATOM 1294 CD1 LEU A 444 -2.914 2.815 -12.213 1.00 0.00 C ATOM 1295 CD2 LEU A 444 -1.044 2.646 -13.886 1.00 0.00 C ATOM 0 H LEU A 444 0.645 0.960 -9.164 1.00 0.00 H new ATOM 0 HA LEU A 444 -2.109 1.885 -9.940 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -0.382 3.154 -11.253 1.00 0.00 H new ATOM 0 HB3 LEU A 444 0.312 1.636 -11.789 1.00 0.00 H new ATOM 0 HG LEU A 444 -1.914 1.001 -12.794 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -3.642 2.761 -13.022 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -3.341 2.376 -11.311 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -2.659 3.858 -12.023 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -1.775 2.597 -14.693 1.00 0.00 H new ATOM 0 HD22 LEU A 444 -0.774 3.686 -13.704 1.00 0.00 H new ATOM 0 HD23 LEU A 444 -0.153 2.084 -14.168 1.00 0.00 H new ATOM 1307 N ILE A 445 -2.602 -0.430 -10.894 1.00 0.00 N ATOM 1308 CA ILE A 445 -2.904 -1.879 -11.150 1.00 0.00 C ATOM 1309 C ILE A 445 -3.899 -2.018 -12.322 1.00 0.00 C ATOM 1310 O ILE A 445 -4.916 -1.356 -12.335 1.00 0.00 O ATOM 1311 CB ILE A 445 -3.557 -2.481 -9.897 1.00 0.00 C ATOM 1312 CG1 ILE A 445 -2.723 -2.126 -8.659 1.00 0.00 C ATOM 1313 CG2 ILE A 445 -3.646 -4.005 -10.044 1.00 0.00 C ATOM 1314 CD1 ILE A 445 -3.307 -2.816 -7.424 1.00 0.00 C ATOM 0 H ILE A 445 -3.378 0.211 -11.059 1.00 0.00 H new ATOM 0 HA ILE A 445 -1.975 -2.395 -11.393 1.00 0.00 H new ATOM 0 HB ILE A 445 -4.561 -2.073 -9.781 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -1.688 -2.437 -8.805 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -2.714 -1.046 -8.513 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -4.110 -4.430 -9.154 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -4.247 -4.252 -10.919 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -2.644 -4.418 -10.164 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -2.711 -2.560 -6.548 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -4.334 -2.484 -7.273 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -3.293 -3.896 -7.570 1.00 0.00 H new ATOM 1326 N PRO A 446 -3.645 -2.889 -13.286 1.00 0.00 N ATOM 1327 CA PRO A 446 -4.586 -3.101 -14.431 1.00 0.00 C ATOM 1328 C PRO A 446 -5.820 -3.904 -13.991 1.00 0.00 C ATOM 1329 O PRO A 446 -5.701 -4.898 -13.303 1.00 0.00 O ATOM 1330 CB PRO A 446 -3.751 -3.897 -15.443 1.00 0.00 C ATOM 1331 CG PRO A 446 -2.768 -4.653 -14.611 1.00 0.00 C ATOM 1332 CD PRO A 446 -2.452 -3.758 -13.408 1.00 0.00 C ATOM 0 HA PRO A 446 -4.970 -2.166 -14.838 1.00 0.00 H new ATOM 0 HB2 PRO A 446 -4.376 -4.571 -16.029 1.00 0.00 H new ATOM 0 HB3 PRO A 446 -3.247 -3.236 -16.148 1.00 0.00 H new ATOM 0 HG2 PRO A 446 -3.183 -5.608 -14.288 1.00 0.00 H new ATOM 0 HG3 PRO A 446 -1.865 -4.875 -15.180 1.00 0.00 H new ATOM 0 HD2 PRO A 446 -2.292 -4.346 -12.504 1.00 0.00 H new ATOM 0 HD3 PRO A 446 -1.547 -3.173 -13.572 1.00 0.00 H new ATOM 1340 N VAL A 447 -7.004 -3.483 -14.370 1.00 0.00 N ATOM 1341 CA VAL A 447 -8.235 -4.233 -13.950 1.00 0.00 C ATOM 1342 C VAL A 447 -9.291 -4.209 -15.058 1.00 0.00 C ATOM 1343 O VAL A 447 -9.043 -3.778 -16.167 1.00 0.00 O ATOM 1344 CB VAL A 447 -8.812 -3.593 -12.686 1.00 0.00 C ATOM 1345 CG1 VAL A 447 -7.743 -3.593 -11.594 1.00 0.00 C ATOM 1346 CG2 VAL A 447 -9.232 -2.150 -12.984 1.00 0.00 C ATOM 0 H VAL A 447 -7.172 -2.659 -14.947 1.00 0.00 H new ATOM 0 HA VAL A 447 -7.961 -5.269 -13.753 1.00 0.00 H new ATOM 0 HB VAL A 447 -9.682 -4.160 -12.354 1.00 0.00 H new ATOM 0 HG11 VAL A 447 -8.147 -3.138 -10.689 1.00 0.00 H new ATOM 0 HG12 VAL A 447 -7.441 -4.618 -11.381 1.00 0.00 H new ATOM 0 HG13 VAL A 447 -6.878 -3.022 -11.932 1.00 0.00 H new ATOM 0 HG21 VAL A 447 -9.643 -1.697 -12.082 1.00 0.00 H new ATOM 0 HG22 VAL A 447 -8.364 -1.579 -13.314 1.00 0.00 H new ATOM 0 HG23 VAL A 447 -9.989 -2.146 -13.769 1.00 0.00 H new ATOM 1356 N ALA A 448 -10.470 -4.688 -14.757 1.00 0.00 N ATOM 1357 CA ALA A 448 -11.560 -4.721 -15.772 1.00 0.00 C ATOM 1358 C ALA A 448 -11.856 -3.305 -16.273 1.00 0.00 C ATOM 1359 O ALA A 448 -11.913 -3.061 -17.462 1.00 0.00 O ATOM 1360 CB ALA A 448 -12.822 -5.310 -15.139 1.00 0.00 C ATOM 0 H ALA A 448 -10.725 -5.061 -13.842 1.00 0.00 H new ATOM 0 HA ALA A 448 -11.246 -5.337 -16.614 1.00 0.00 H new ATOM 0 HB1 ALA A 448 -13.622 -5.336 -15.879 1.00 0.00 H new ATOM 0 HB2 ALA A 448 -12.616 -6.322 -14.792 1.00 0.00 H new ATOM 0 HB3 ALA A 448 -13.128 -4.692 -14.295 1.00 0.00 H new ATOM 1366 N GLU A 449 -12.043 -2.368 -15.384 1.00 0.00 N ATOM 1367 CA GLU A 449 -12.330 -0.977 -15.835 1.00 0.00 C ATOM 1368 C GLU A 449 -11.152 -0.491 -16.666 1.00 0.00 C ATOM 1369 O GLU A 449 -11.303 0.259 -17.610 1.00 0.00 O ATOM 1370 CB GLU A 449 -12.519 -0.065 -14.615 1.00 0.00 C ATOM 1371 CG GLU A 449 -13.326 -0.804 -13.542 1.00 0.00 C ATOM 1372 CD GLU A 449 -13.956 0.206 -12.577 1.00 0.00 C ATOM 1373 OE1 GLU A 449 -13.236 1.061 -12.088 1.00 0.00 O ATOM 1374 OE2 GLU A 449 -15.150 0.107 -12.344 1.00 0.00 O ATOM 0 H GLU A 449 -12.010 -2.503 -14.374 1.00 0.00 H new ATOM 0 HA GLU A 449 -13.242 -0.956 -16.431 1.00 0.00 H new ATOM 0 HB2 GLU A 449 -11.549 0.231 -14.216 1.00 0.00 H new ATOM 0 HB3 GLU A 449 -13.035 0.849 -14.908 1.00 0.00 H new ATOM 0 HG2 GLU A 449 -14.104 -1.407 -14.010 1.00 0.00 H new ATOM 0 HG3 GLU A 449 -12.678 -1.489 -12.994 1.00 0.00 H new ATOM 1381 N GLY A 450 -9.974 -0.920 -16.315 1.00 0.00 N ATOM 1382 CA GLY A 450 -8.762 -0.501 -17.071 1.00 0.00 C ATOM 1383 C GLY A 450 -7.578 -0.454 -16.113 1.00 0.00 C ATOM 1384 O GLY A 450 -6.756 -1.346 -16.079 1.00 0.00 O ATOM 0 H GLY A 450 -9.797 -1.548 -15.531 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -8.563 -1.200 -17.883 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -8.920 0.478 -17.525 1.00 0.00 H new ATOM 1388 N MET A 451 -7.494 0.579 -15.319 1.00 0.00 N ATOM 1389 CA MET A 451 -6.372 0.687 -14.345 1.00 0.00 C ATOM 1390 C MET A 451 -6.871 1.373 -13.075 1.00 0.00 C ATOM 1391 O MET A 451 -7.528 2.394 -13.123 1.00 0.00 O ATOM 1392 CB MET A 451 -5.234 1.508 -14.956 1.00 0.00 C ATOM 1393 CG MET A 451 -4.915 0.989 -16.360 1.00 0.00 C ATOM 1394 SD MET A 451 -3.389 1.762 -16.952 1.00 0.00 S ATOM 1395 CE MET A 451 -4.145 3.253 -17.648 1.00 0.00 C ATOM 0 H MET A 451 -8.156 1.355 -15.303 1.00 0.00 H new ATOM 0 HA MET A 451 -6.005 -0.310 -14.103 1.00 0.00 H new ATOM 0 HB2 MET A 451 -5.517 2.560 -15.003 1.00 0.00 H new ATOM 0 HB3 MET A 451 -4.348 1.444 -14.325 1.00 0.00 H new ATOM 0 HG2 MET A 451 -4.804 -0.095 -16.343 1.00 0.00 H new ATOM 0 HG3 MET A 451 -5.737 1.214 -17.039 1.00 0.00 H new ATOM 0 HE1 MET A 451 -3.370 3.888 -18.077 1.00 0.00 H new ATOM 0 HE2 MET A 451 -4.855 2.972 -18.426 1.00 0.00 H new ATOM 0 HE3 MET A 451 -4.666 3.798 -16.861 1.00 0.00 H new ATOM 1405 N ASN A 452 -6.562 0.817 -11.935 1.00 0.00 N ATOM 1406 CA ASN A 452 -7.016 1.431 -10.653 1.00 0.00 C ATOM 1407 C ASN A 452 -5.980 2.460 -10.202 1.00 0.00 C ATOM 1408 O ASN A 452 -4.905 2.123 -9.750 1.00 0.00 O ATOM 1409 CB ASN A 452 -7.159 0.329 -9.584 1.00 0.00 C ATOM 1410 CG ASN A 452 -8.606 -0.178 -9.542 1.00 0.00 C ATOM 1411 OD1 ASN A 452 -8.835 -1.453 -9.401 1.00 0.00 O flip ATOM 1412 ND2 ASN A 452 -9.535 0.599 -9.638 1.00 0.00 N flip ATOM 0 H ASN A 452 -6.014 -0.037 -11.835 1.00 0.00 H new ATOM 0 HA ASN A 452 -7.979 1.921 -10.793 1.00 0.00 H new ATOM 0 HB2 ASN A 452 -6.483 -0.496 -9.808 1.00 0.00 H new ATOM 0 HB3 ASN A 452 -6.873 0.719 -8.607 1.00 0.00 H new ATOM 0 HD21 ASN A 452 -9.356 1.597 -9.748 1.00 0.00 H new ATOM 0 HD22 ASN A 452 -10.494 0.253 -9.608 1.00 0.00 H new ATOM 1419 N GLU A 453 -6.309 3.712 -10.314 1.00 0.00 N ATOM 1420 CA GLU A 453 -5.359 4.774 -9.891 1.00 0.00 C ATOM 1421 C GLU A 453 -5.362 4.837 -8.362 1.00 0.00 C ATOM 1422 O GLU A 453 -6.395 5.003 -7.744 1.00 0.00 O ATOM 1423 CB GLU A 453 -5.806 6.121 -10.518 1.00 0.00 C ATOM 1424 CG GLU A 453 -5.641 7.296 -9.535 1.00 0.00 C ATOM 1425 CD GLU A 453 -5.697 8.619 -10.301 1.00 0.00 C ATOM 1426 OE1 GLU A 453 -6.078 8.595 -11.459 1.00 0.00 O ATOM 1427 OE2 GLU A 453 -5.355 9.634 -9.716 1.00 0.00 O ATOM 0 H GLU A 453 -7.199 4.048 -10.682 1.00 0.00 H new ATOM 0 HA GLU A 453 -4.345 4.561 -10.230 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -5.221 6.315 -11.417 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -6.849 6.049 -10.826 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -6.429 7.267 -8.782 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -4.692 7.210 -9.006 1.00 0.00 H new ATOM 1434 N ILE A 454 -4.211 4.697 -7.750 1.00 0.00 N ATOM 1435 CA ILE A 454 -4.135 4.736 -6.259 1.00 0.00 C ATOM 1436 C ILE A 454 -2.963 5.622 -5.821 1.00 0.00 C ATOM 1437 O ILE A 454 -1.824 5.392 -6.177 1.00 0.00 O ATOM 1438 CB ILE A 454 -3.930 3.304 -5.749 1.00 0.00 C ATOM 1439 CG1 ILE A 454 -5.215 2.478 -5.953 1.00 0.00 C ATOM 1440 CG2 ILE A 454 -3.539 3.312 -4.267 1.00 0.00 C ATOM 1441 CD1 ILE A 454 -6.405 3.080 -5.186 1.00 0.00 C ATOM 0 H ILE A 454 -3.318 4.557 -8.223 1.00 0.00 H new ATOM 0 HA ILE A 454 -5.055 5.150 -5.846 1.00 0.00 H new ATOM 0 HB ILE A 454 -3.121 2.847 -6.319 1.00 0.00 H new ATOM 0 HG12 ILE A 454 -5.453 2.431 -7.016 1.00 0.00 H new ATOM 0 HG13 ILE A 454 -5.047 1.454 -5.619 1.00 0.00 H new ATOM 0 HG21 ILE A 454 -3.398 2.288 -3.922 1.00 0.00 H new ATOM 0 HG22 ILE A 454 -2.611 3.869 -4.139 1.00 0.00 H new ATOM 0 HG23 ILE A 454 -4.330 3.785 -3.685 1.00 0.00 H new ATOM 0 HD11 ILE A 454 -7.293 2.470 -5.354 1.00 0.00 H new ATOM 0 HD12 ILE A 454 -6.177 3.103 -4.120 1.00 0.00 H new ATOM 0 HD13 ILE A 454 -6.590 4.095 -5.539 1.00 0.00 H new ATOM 1453 N TRP A 455 -3.249 6.622 -5.027 1.00 0.00 N ATOM 1454 CA TRP A 455 -2.186 7.544 -4.513 1.00 0.00 C ATOM 1455 C TRP A 455 -2.214 7.487 -2.986 1.00 0.00 C ATOM 1456 O TRP A 455 -3.262 7.603 -2.383 1.00 0.00 O ATOM 1457 CB TRP A 455 -2.478 8.975 -4.967 1.00 0.00 C ATOM 1458 CG TRP A 455 -2.512 9.044 -6.460 1.00 0.00 C ATOM 1459 CD1 TRP A 455 -3.626 8.950 -7.223 1.00 0.00 C ATOM 1460 CD2 TRP A 455 -1.402 9.231 -7.379 1.00 0.00 C ATOM 1461 NE1 TRP A 455 -3.264 9.067 -8.554 1.00 0.00 N ATOM 1462 CE2 TRP A 455 -1.903 9.241 -8.700 1.00 0.00 C ATOM 1463 CE3 TRP A 455 -0.022 9.389 -7.191 1.00 0.00 C ATOM 1464 CZ2 TRP A 455 -1.061 9.406 -9.800 1.00 0.00 C ATOM 1465 CZ3 TRP A 455 0.831 9.555 -8.293 1.00 0.00 C ATOM 1466 CH2 TRP A 455 0.312 9.564 -9.596 1.00 0.00 C ATOM 0 H TRP A 455 -4.191 6.844 -4.706 1.00 0.00 H new ATOM 0 HA TRP A 455 -1.210 7.244 -4.894 1.00 0.00 H new ATOM 0 HB2 TRP A 455 -3.432 9.307 -4.558 1.00 0.00 H new ATOM 0 HB3 TRP A 455 -1.714 9.650 -4.581 1.00 0.00 H new ATOM 0 HD1 TRP A 455 -4.631 8.807 -6.854 1.00 0.00 H new ATOM 0 HE1 TRP A 455 -3.923 9.029 -9.332 1.00 0.00 H new ATOM 0 HE3 TRP A 455 0.388 9.383 -6.192 1.00 0.00 H new ATOM 0 HZ2 TRP A 455 -1.467 9.412 -10.801 1.00 0.00 H new ATOM 0 HZ3 TRP A 455 1.893 9.676 -8.137 1.00 0.00 H new ATOM 0 HH2 TRP A 455 0.973 9.693 -10.440 1.00 0.00 H new ATOM 1477 N LEU A 456 -1.082 7.275 -2.351 1.00 0.00 N ATOM 1478 CA LEU A 456 -1.057 7.172 -0.853 1.00 0.00 C ATOM 1479 C LEU A 456 -0.198 8.290 -0.243 1.00 0.00 C ATOM 1480 O LEU A 456 0.887 8.578 -0.707 1.00 0.00 O ATOM 1481 CB LEU A 456 -0.477 5.804 -0.445 1.00 0.00 C ATOM 1482 CG LEU A 456 -0.883 4.708 -1.445 1.00 0.00 C ATOM 1483 CD1 LEU A 456 -0.148 3.420 -1.084 1.00 0.00 C ATOM 1484 CD2 LEU A 456 -2.396 4.468 -1.367 1.00 0.00 C ATOM 0 H LEU A 456 -0.175 7.169 -2.805 1.00 0.00 H new ATOM 0 HA LEU A 456 -2.076 7.273 -0.481 1.00 0.00 H new ATOM 0 HB2 LEU A 456 0.610 5.868 -0.392 1.00 0.00 H new ATOM 0 HB3 LEU A 456 -0.829 5.539 0.552 1.00 0.00 H new ATOM 0 HG LEU A 456 -0.623 5.019 -2.457 1.00 0.00 H new ATOM 0 HD11 LEU A 456 -0.426 2.633 -1.785 1.00 0.00 H new ATOM 0 HD12 LEU A 456 0.928 3.588 -1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 456 -0.420 3.117 -0.073 1.00 0.00 H new ATOM 0 HD21 LEU A 456 -2.678 3.691 -2.077 1.00 0.00 H new ATOM 0 HD22 LEU A 456 -2.663 4.152 -0.358 1.00 0.00 H new ATOM 0 HD23 LEU A 456 -2.924 5.390 -1.610 1.00 0.00 H new ATOM 1496 N ARG A 457 -0.678 8.913 0.808 1.00 0.00 N ATOM 1497 CA ARG A 457 0.105 10.003 1.464 1.00 0.00 C ATOM 1498 C ARG A 457 1.114 9.394 2.452 1.00 0.00 C ATOM 1499 O ARG A 457 0.967 8.272 2.895 1.00 0.00 O ATOM 1500 CB ARG A 457 -0.859 10.927 2.227 1.00 0.00 C ATOM 1501 CG ARG A 457 -0.199 12.298 2.484 1.00 0.00 C ATOM 1502 CD ARG A 457 -0.793 12.938 3.749 1.00 0.00 C ATOM 1503 NE ARG A 457 -2.215 12.520 3.897 1.00 0.00 N ATOM 1504 CZ ARG A 457 -3.132 13.025 3.116 1.00 0.00 C ATOM 1505 NH1 ARG A 457 -2.805 13.901 2.204 1.00 0.00 N ATOM 1506 NH2 ARG A 457 -4.375 12.654 3.248 1.00 0.00 N ATOM 0 H ARG A 457 -1.580 8.711 1.239 1.00 0.00 H new ATOM 0 HA ARG A 457 0.642 10.572 0.705 1.00 0.00 H new ATOM 0 HB2 ARG A 457 -1.776 11.060 1.653 1.00 0.00 H new ATOM 0 HB3 ARG A 457 -1.139 10.468 3.175 1.00 0.00 H new ATOM 0 HG2 ARG A 457 0.878 12.177 2.599 1.00 0.00 H new ATOM 0 HG3 ARG A 457 -0.356 12.953 1.627 1.00 0.00 H new ATOM 0 HD2 ARG A 457 -0.221 12.635 4.626 1.00 0.00 H new ATOM 0 HD3 ARG A 457 -0.727 14.024 3.685 1.00 0.00 H new ATOM 0 HE ARG A 457 -2.473 11.838 4.610 1.00 0.00 H new ATOM 0 HH11 ARG A 457 -1.833 14.191 2.101 1.00 0.00 H new ATOM 0 HH12 ARG A 457 -3.522 14.295 1.595 1.00 0.00 H new ATOM 0 HH21 ARG A 457 -4.630 11.970 3.961 1.00 0.00 H new ATOM 0 HH22 ARG A 457 -5.092 13.048 2.639 1.00 0.00 H new ATOM 1520 N CYS A 458 2.137 10.136 2.794 1.00 0.00 N ATOM 1521 CA CYS A 458 3.171 9.634 3.752 1.00 0.00 C ATOM 1522 C CYS A 458 3.779 10.846 4.474 1.00 0.00 C ATOM 1523 O CYS A 458 3.435 11.975 4.184 1.00 0.00 O ATOM 1524 CB CYS A 458 4.246 8.837 2.988 1.00 0.00 C ATOM 1525 SG CYS A 458 4.227 7.099 3.508 1.00 0.00 S ATOM 0 H CYS A 458 2.302 11.080 2.446 1.00 0.00 H new ATOM 0 HA CYS A 458 2.727 8.963 4.488 1.00 0.00 H new ATOM 0 HB2 CYS A 458 4.065 8.905 1.915 1.00 0.00 H new ATOM 0 HB3 CYS A 458 5.229 9.269 3.174 1.00 0.00 H new ATOM 0 HG CYS A 458 5.137 6.440 2.854 1.00 0.00 H new ATOM 1531 N ASP A 459 4.650 10.632 5.433 1.00 0.00 N ATOM 1532 CA ASP A 459 5.230 11.786 6.184 1.00 0.00 C ATOM 1533 C ASP A 459 6.700 11.535 6.534 1.00 0.00 C ATOM 1534 O ASP A 459 7.312 12.332 7.218 1.00 0.00 O ATOM 1535 CB ASP A 459 4.426 11.979 7.474 1.00 0.00 C ATOM 1536 CG ASP A 459 4.635 13.397 8.012 1.00 0.00 C ATOM 1537 OD1 ASP A 459 4.220 14.330 7.345 1.00 0.00 O ATOM 1538 OD2 ASP A 459 5.208 13.524 9.081 1.00 0.00 O ATOM 0 H ASP A 459 4.981 9.713 5.725 1.00 0.00 H new ATOM 0 HA ASP A 459 5.179 12.678 5.559 1.00 0.00 H new ATOM 0 HB2 ASP A 459 3.367 11.806 7.282 1.00 0.00 H new ATOM 0 HB3 ASP A 459 4.738 11.248 8.220 1.00 0.00 H new ATOM 1543 N ASN A 460 7.293 10.463 6.071 1.00 0.00 N ATOM 1544 CA ASN A 460 8.736 10.232 6.404 1.00 0.00 C ATOM 1545 C ASN A 460 9.372 9.277 5.396 1.00 0.00 C ATOM 1546 O ASN A 460 8.703 8.487 4.760 1.00 0.00 O ATOM 1547 CB ASN A 460 8.862 9.614 7.802 1.00 0.00 C ATOM 1548 CG ASN A 460 8.226 10.535 8.845 1.00 0.00 C ATOM 1549 OD1 ASN A 460 6.964 10.392 9.142 1.00 0.00 O flip ATOM 1550 ND2 ASN A 460 8.887 11.392 9.398 1.00 0.00 N flip ATOM 0 H ASN A 460 6.853 9.750 5.489 1.00 0.00 H new ATOM 0 HA ASN A 460 9.247 11.194 6.372 1.00 0.00 H new ATOM 0 HB2 ASN A 460 8.375 8.639 7.822 1.00 0.00 H new ATOM 0 HB3 ASN A 460 9.913 9.451 8.042 1.00 0.00 H new ATOM 0 HD21 ASN A 460 9.874 11.504 9.166 1.00 0.00 H new ATOM 0 HD22 ASN A 460 8.455 11.999 10.094 1.00 0.00 H new ATOM 1557 N GLU A 461 10.671 9.329 5.271 1.00 0.00 N ATOM 1558 CA GLU A 461 11.365 8.407 4.335 1.00 0.00 C ATOM 1559 C GLU A 461 11.311 7.009 4.948 1.00 0.00 C ATOM 1560 O GLU A 461 11.350 6.007 4.261 1.00 0.00 O ATOM 1561 CB GLU A 461 12.826 8.849 4.153 1.00 0.00 C ATOM 1562 CG GLU A 461 13.327 9.498 5.442 1.00 0.00 C ATOM 1563 CD GLU A 461 14.850 9.635 5.387 1.00 0.00 C ATOM 1564 OE1 GLU A 461 15.318 10.598 4.799 1.00 0.00 O ATOM 1565 OE2 GLU A 461 15.523 8.777 5.934 1.00 0.00 O ATOM 0 H GLU A 461 11.279 9.972 5.778 1.00 0.00 H new ATOM 0 HA GLU A 461 10.885 8.415 3.357 1.00 0.00 H new ATOM 0 HB2 GLU A 461 13.448 7.990 3.900 1.00 0.00 H new ATOM 0 HB3 GLU A 461 12.903 9.553 3.325 1.00 0.00 H new ATOM 0 HG2 GLU A 461 12.868 10.478 5.570 1.00 0.00 H new ATOM 0 HG3 GLU A 461 13.036 8.895 6.302 1.00 0.00 H new ATOM 1572 N LYS A 462 11.204 6.947 6.248 1.00 0.00 N ATOM 1573 CA LYS A 462 11.124 5.633 6.935 1.00 0.00 C ATOM 1574 C LYS A 462 9.834 4.944 6.503 1.00 0.00 C ATOM 1575 O LYS A 462 9.833 3.798 6.103 1.00 0.00 O ATOM 1576 CB LYS A 462 11.109 5.856 8.451 1.00 0.00 C ATOM 1577 CG LYS A 462 12.423 6.524 8.894 1.00 0.00 C ATOM 1578 CD LYS A 462 12.190 7.319 10.183 1.00 0.00 C ATOM 1579 CE LYS A 462 13.519 7.904 10.666 1.00 0.00 C ATOM 1580 NZ LYS A 462 13.266 8.916 11.731 1.00 0.00 N ATOM 0 H LYS A 462 11.169 7.758 6.865 1.00 0.00 H new ATOM 0 HA LYS A 462 11.982 5.014 6.675 1.00 0.00 H new ATOM 0 HB2 LYS A 462 10.261 6.483 8.727 1.00 0.00 H new ATOM 0 HB3 LYS A 462 10.983 4.904 8.966 1.00 0.00 H new ATOM 0 HG2 LYS A 462 13.190 5.767 9.056 1.00 0.00 H new ATOM 0 HG3 LYS A 462 12.789 7.185 8.109 1.00 0.00 H new ATOM 0 HD2 LYS A 462 11.471 8.119 10.005 1.00 0.00 H new ATOM 0 HD3 LYS A 462 11.764 6.672 10.950 1.00 0.00 H new ATOM 0 HE2 LYS A 462 14.159 7.110 11.051 1.00 0.00 H new ATOM 0 HE3 LYS A 462 14.049 8.364 9.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 462 14.171 9.311 12.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 462 12.672 9.680 11.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 462 12.778 8.464 12.531 1.00 0.00 H new ATOM 1594 N GLN A 463 8.732 5.644 6.560 1.00 0.00 N ATOM 1595 CA GLN A 463 7.452 5.026 6.127 1.00 0.00 C ATOM 1596 C GLN A 463 7.600 4.624 4.661 1.00 0.00 C ATOM 1597 O GLN A 463 7.400 3.483 4.294 1.00 0.00 O ATOM 1598 CB GLN A 463 6.298 6.038 6.282 1.00 0.00 C ATOM 1599 CG GLN A 463 4.958 5.305 6.498 1.00 0.00 C ATOM 1600 CD GLN A 463 4.876 4.054 5.615 1.00 0.00 C ATOM 1601 OE1 GLN A 463 5.241 2.973 6.036 1.00 0.00 O ATOM 1602 NE2 GLN A 463 4.407 4.157 4.401 1.00 0.00 N ATOM 0 H GLN A 463 8.666 6.608 6.885 1.00 0.00 H new ATOM 0 HA GLN A 463 7.225 4.154 6.740 1.00 0.00 H new ATOM 0 HB2 GLN A 463 6.497 6.699 7.126 1.00 0.00 H new ATOM 0 HB3 GLN A 463 6.236 6.666 5.393 1.00 0.00 H new ATOM 0 HG2 GLN A 463 4.857 5.024 7.546 1.00 0.00 H new ATOM 0 HG3 GLN A 463 4.130 5.975 6.266 1.00 0.00 H new ATOM 0 HE21 GLN A 463 4.101 5.064 4.048 1.00 0.00 H new ATOM 0 HE22 GLN A 463 4.347 3.331 3.806 1.00 0.00 H new ATOM 1611 N TYR A 464 7.957 5.564 3.821 1.00 0.00 N ATOM 1612 CA TYR A 464 8.134 5.262 2.375 1.00 0.00 C ATOM 1613 C TYR A 464 8.874 3.924 2.193 1.00 0.00 C ATOM 1614 O TYR A 464 8.383 3.013 1.578 1.00 0.00 O ATOM 1615 CB TYR A 464 8.968 6.415 1.752 1.00 0.00 C ATOM 1616 CG TYR A 464 8.359 6.892 0.452 1.00 0.00 C ATOM 1617 CD1 TYR A 464 7.038 7.339 0.436 1.00 0.00 C ATOM 1618 CD2 TYR A 464 9.116 6.895 -0.729 1.00 0.00 C ATOM 1619 CE1 TYR A 464 6.465 7.789 -0.754 1.00 0.00 C ATOM 1620 CE2 TYR A 464 8.542 7.345 -1.923 1.00 0.00 C ATOM 1621 CZ TYR A 464 7.217 7.792 -1.936 1.00 0.00 C ATOM 1622 OH TYR A 464 6.652 8.233 -3.115 1.00 0.00 O ATOM 0 H TYR A 464 8.134 6.534 4.082 1.00 0.00 H new ATOM 0 HA TYR A 464 7.163 5.180 1.886 1.00 0.00 H new ATOM 0 HB2 TYR A 464 9.027 7.246 2.455 1.00 0.00 H new ATOM 0 HB3 TYR A 464 9.988 6.075 1.575 1.00 0.00 H new ATOM 0 HD1 TYR A 464 6.457 7.337 1.347 1.00 0.00 H new ATOM 0 HD2 TYR A 464 10.140 6.551 -0.717 1.00 0.00 H new ATOM 0 HE1 TYR A 464 5.442 8.135 -0.764 1.00 0.00 H new ATOM 0 HE2 TYR A 464 9.122 7.347 -2.834 1.00 0.00 H new ATOM 0 HH TYR A 464 7.246 8.887 -3.538 1.00 0.00 H new ATOM 1632 N ALA A 465 10.060 3.821 2.706 1.00 0.00 N ATOM 1633 CA ALA A 465 10.855 2.570 2.534 1.00 0.00 C ATOM 1634 C ALA A 465 10.030 1.294 2.781 1.00 0.00 C ATOM 1635 O ALA A 465 10.412 0.227 2.347 1.00 0.00 O ATOM 1636 CB ALA A 465 12.031 2.598 3.512 1.00 0.00 C ATOM 0 H ALA A 465 10.523 4.554 3.244 1.00 0.00 H new ATOM 0 HA ALA A 465 11.194 2.539 1.499 1.00 0.00 H new ATOM 0 HB1 ALA A 465 12.621 1.689 3.397 1.00 0.00 H new ATOM 0 HB2 ALA A 465 12.657 3.466 3.304 1.00 0.00 H new ATOM 0 HB3 ALA A 465 11.654 2.659 4.533 1.00 0.00 H new ATOM 1642 N HIS A 466 8.941 1.361 3.502 1.00 0.00 N ATOM 1643 CA HIS A 466 8.175 0.101 3.795 1.00 0.00 C ATOM 1644 C HIS A 466 7.201 -0.306 2.670 1.00 0.00 C ATOM 1645 O HIS A 466 7.325 -1.371 2.099 1.00 0.00 O ATOM 1646 CB HIS A 466 7.384 0.300 5.090 1.00 0.00 C ATOM 1647 CG HIS A 466 8.341 0.501 6.232 1.00 0.00 C ATOM 1648 ND1 HIS A 466 9.650 0.921 6.035 1.00 0.00 N ATOM 1649 CD2 HIS A 466 8.197 0.342 7.588 1.00 0.00 C ATOM 1650 CE1 HIS A 466 10.237 0.997 7.245 1.00 0.00 C ATOM 1651 NE2 HIS A 466 9.394 0.655 8.221 1.00 0.00 N ATOM 0 H HIS A 466 8.549 2.216 3.897 1.00 0.00 H new ATOM 0 HA HIS A 466 8.905 -0.704 3.884 1.00 0.00 H new ATOM 0 HB2 HIS A 466 6.724 1.163 4.998 1.00 0.00 H new ATOM 0 HB3 HIS A 466 6.751 -0.567 5.280 1.00 0.00 H new ATOM 0 HD2 HIS A 466 7.293 0.023 8.086 1.00 0.00 H new ATOM 0 HE1 HIS A 466 11.262 1.297 7.405 1.00 0.00 H new ATOM 0 HE2 HIS A 466 9.588 0.629 9.222 1.00 0.00 H new ATOM 1660 N TRP A 467 6.205 0.489 2.387 1.00 0.00 N ATOM 1661 CA TRP A 467 5.197 0.094 1.348 1.00 0.00 C ATOM 1662 C TRP A 467 5.831 -0.104 -0.042 1.00 0.00 C ATOM 1663 O TRP A 467 5.737 -1.172 -0.609 1.00 0.00 O ATOM 1664 CB TRP A 467 4.090 1.167 1.278 1.00 0.00 C ATOM 1665 CG TRP A 467 3.040 0.886 2.313 1.00 0.00 C ATOM 1666 CD1 TRP A 467 3.271 0.764 3.640 1.00 0.00 C ATOM 1667 CD2 TRP A 467 1.608 0.681 2.126 1.00 0.00 C ATOM 1668 NE1 TRP A 467 2.073 0.498 4.280 1.00 0.00 N ATOM 1669 CE2 TRP A 467 1.019 0.438 3.390 1.00 0.00 C ATOM 1670 CE3 TRP A 467 0.772 0.683 0.995 1.00 0.00 C ATOM 1671 CZ2 TRP A 467 -0.350 0.204 3.527 1.00 0.00 C ATOM 1672 CZ3 TRP A 467 -0.607 0.450 1.129 1.00 0.00 C ATOM 1673 CH2 TRP A 467 -1.166 0.211 2.393 1.00 0.00 C ATOM 0 H TRP A 467 6.041 1.395 2.827 1.00 0.00 H new ATOM 0 HA TRP A 467 4.774 -0.866 1.643 1.00 0.00 H new ATOM 0 HB2 TRP A 467 4.519 2.156 1.442 1.00 0.00 H new ATOM 0 HB3 TRP A 467 3.641 1.175 0.285 1.00 0.00 H new ATOM 0 HD1 TRP A 467 4.233 0.859 4.122 1.00 0.00 H new ATOM 0 HE1 TRP A 467 1.980 0.363 5.287 1.00 0.00 H new ATOM 0 HE3 TRP A 467 1.193 0.865 0.017 1.00 0.00 H new ATOM 0 HZ2 TRP A 467 -0.775 0.019 4.502 1.00 0.00 H new ATOM 0 HZ3 TRP A 467 -1.240 0.455 0.254 1.00 0.00 H new ATOM 0 HH2 TRP A 467 -2.227 0.032 2.490 1.00 0.00 H new ATOM 1684 N MET A 468 6.454 0.891 -0.614 1.00 0.00 N ATOM 1685 CA MET A 468 7.043 0.687 -1.976 1.00 0.00 C ATOM 1686 C MET A 468 7.903 -0.577 -1.964 1.00 0.00 C ATOM 1687 O MET A 468 7.727 -1.458 -2.783 1.00 0.00 O ATOM 1688 CB MET A 468 7.897 1.898 -2.413 1.00 0.00 C ATOM 1689 CG MET A 468 8.662 2.504 -1.213 1.00 0.00 C ATOM 1690 SD MET A 468 8.047 4.179 -0.848 1.00 0.00 S ATOM 1691 CE MET A 468 6.338 3.800 -0.365 1.00 0.00 C ATOM 0 H MET A 468 6.581 1.819 -0.210 1.00 0.00 H new ATOM 0 HA MET A 468 6.228 0.582 -2.692 1.00 0.00 H new ATOM 0 HB2 MET A 468 8.606 1.588 -3.181 1.00 0.00 H new ATOM 0 HB3 MET A 468 7.255 2.657 -2.859 1.00 0.00 H new ATOM 0 HG2 MET A 468 8.541 1.867 -0.337 1.00 0.00 H new ATOM 0 HG3 MET A 468 9.728 2.542 -1.435 1.00 0.00 H new ATOM 0 HE1 MET A 468 5.799 4.728 -0.177 1.00 0.00 H new ATOM 0 HE2 MET A 468 5.846 3.251 -1.168 1.00 0.00 H new ATOM 0 HE3 MET A 468 6.342 3.193 0.541 1.00 0.00 H new ATOM 1701 N ALA A 469 8.819 -0.693 -1.039 1.00 0.00 N ATOM 1702 CA ALA A 469 9.652 -1.924 -0.998 1.00 0.00 C ATOM 1703 C ALA A 469 8.715 -3.128 -0.939 1.00 0.00 C ATOM 1704 O ALA A 469 8.947 -4.144 -1.559 1.00 0.00 O ATOM 1705 CB ALA A 469 10.544 -1.914 0.245 1.00 0.00 C ATOM 0 H ALA A 469 9.023 0.002 -0.321 1.00 0.00 H new ATOM 0 HA ALA A 469 10.287 -1.973 -1.883 1.00 0.00 H new ATOM 0 HB1 ALA A 469 11.150 -2.820 0.265 1.00 0.00 H new ATOM 0 HB2 ALA A 469 11.197 -1.041 0.217 1.00 0.00 H new ATOM 0 HB3 ALA A 469 9.922 -1.874 1.139 1.00 0.00 H new ATOM 1711 N ALA A 470 7.647 -3.013 -0.193 1.00 0.00 N ATOM 1712 CA ALA A 470 6.688 -4.141 -0.087 1.00 0.00 C ATOM 1713 C ALA A 470 5.980 -4.355 -1.422 1.00 0.00 C ATOM 1714 O ALA A 470 5.630 -5.459 -1.783 1.00 0.00 O ATOM 1715 CB ALA A 470 5.644 -3.820 0.971 1.00 0.00 C ATOM 0 H ALA A 470 7.401 -2.183 0.347 1.00 0.00 H new ATOM 0 HA ALA A 470 7.236 -5.043 0.185 1.00 0.00 H new ATOM 0 HB1 ALA A 470 4.939 -4.648 1.050 1.00 0.00 H new ATOM 0 HB2 ALA A 470 6.135 -3.669 1.932 1.00 0.00 H new ATOM 0 HB3 ALA A 470 5.109 -2.913 0.690 1.00 0.00 H new ATOM 1721 N CYS A 471 5.754 -3.303 -2.151 1.00 0.00 N ATOM 1722 CA CYS A 471 5.060 -3.444 -3.453 1.00 0.00 C ATOM 1723 C CYS A 471 5.989 -4.146 -4.447 1.00 0.00 C ATOM 1724 O CYS A 471 5.554 -4.717 -5.430 1.00 0.00 O ATOM 1725 CB CYS A 471 4.695 -2.056 -3.981 1.00 0.00 C ATOM 1726 SG CYS A 471 3.982 -1.072 -2.641 1.00 0.00 S ATOM 0 H CYS A 471 6.021 -2.351 -1.900 1.00 0.00 H new ATOM 0 HA CYS A 471 4.153 -4.035 -3.327 1.00 0.00 H new ATOM 0 HB2 CYS A 471 5.581 -1.561 -4.378 1.00 0.00 H new ATOM 0 HB3 CYS A 471 3.983 -2.143 -4.802 1.00 0.00 H new ATOM 0 HG CYS A 471 4.594 -1.347 -1.527 1.00 0.00 H new ATOM 1732 N ARG A 472 7.272 -4.103 -4.206 1.00 0.00 N ATOM 1733 CA ARG A 472 8.216 -4.756 -5.152 1.00 0.00 C ATOM 1734 C ARG A 472 8.083 -6.280 -5.072 1.00 0.00 C ATOM 1735 O ARG A 472 7.704 -6.918 -6.039 1.00 0.00 O ATOM 1736 CB ARG A 472 9.651 -4.336 -4.821 1.00 0.00 C ATOM 1737 CG ARG A 472 9.822 -2.825 -5.041 1.00 0.00 C ATOM 1738 CD ARG A 472 11.307 -2.482 -5.212 1.00 0.00 C ATOM 1739 NE ARG A 472 11.699 -2.717 -6.630 1.00 0.00 N ATOM 1740 CZ ARG A 472 11.348 -1.863 -7.553 1.00 0.00 C ATOM 1741 NH1 ARG A 472 10.672 -0.794 -7.231 1.00 0.00 N ATOM 1742 NH2 ARG A 472 11.675 -2.077 -8.797 1.00 0.00 N ATOM 0 H ARG A 472 7.703 -3.647 -3.401 1.00 0.00 H new ATOM 0 HA ARG A 472 7.974 -4.440 -6.167 1.00 0.00 H new ATOM 0 HB2 ARG A 472 9.883 -4.589 -3.787 1.00 0.00 H new ATOM 0 HB3 ARG A 472 10.353 -4.885 -5.449 1.00 0.00 H new ATOM 0 HG2 ARG A 472 9.265 -2.513 -5.924 1.00 0.00 H new ATOM 0 HG3 ARG A 472 9.409 -2.277 -4.194 1.00 0.00 H new ATOM 0 HD2 ARG A 472 11.487 -1.442 -4.939 1.00 0.00 H new ATOM 0 HD3 ARG A 472 11.914 -3.096 -4.547 1.00 0.00 H new ATOM 0 HE ARG A 472 12.241 -3.544 -6.879 1.00 0.00 H new ATOM 0 HH11 ARG A 472 10.418 -0.625 -6.258 1.00 0.00 H new ATOM 0 HH12 ARG A 472 10.398 -0.127 -7.953 1.00 0.00 H new ATOM 0 HH21 ARG A 472 12.205 -2.911 -9.049 1.00 0.00 H new ATOM 0 HH22 ARG A 472 11.401 -1.410 -9.518 1.00 0.00 H new ATOM 1756 N LEU A 473 8.374 -6.899 -3.953 1.00 0.00 N ATOM 1757 CA LEU A 473 8.224 -8.380 -3.931 1.00 0.00 C ATOM 1758 C LEU A 473 6.735 -8.706 -4.072 1.00 0.00 C ATOM 1759 O LEU A 473 6.365 -9.747 -4.573 1.00 0.00 O ATOM 1760 CB LEU A 473 8.832 -9.059 -2.667 1.00 0.00 C ATOM 1761 CG LEU A 473 9.013 -8.093 -1.487 1.00 0.00 C ATOM 1762 CD1 LEU A 473 10.210 -7.148 -1.725 1.00 0.00 C ATOM 1763 CD2 LEU A 473 7.721 -7.308 -1.214 1.00 0.00 C ATOM 0 H LEU A 473 8.696 -6.462 -3.089 1.00 0.00 H new ATOM 0 HA LEU A 473 8.794 -8.790 -4.765 1.00 0.00 H new ATOM 0 HB2 LEU A 473 8.186 -9.881 -2.359 1.00 0.00 H new ATOM 0 HB3 LEU A 473 9.799 -9.492 -2.925 1.00 0.00 H new ATOM 0 HG LEU A 473 9.232 -8.683 -0.597 1.00 0.00 H new ATOM 0 HD11 LEU A 473 10.316 -6.474 -0.875 1.00 0.00 H new ATOM 0 HD12 LEU A 473 11.121 -7.736 -1.838 1.00 0.00 H new ATOM 0 HD13 LEU A 473 10.039 -6.566 -2.630 1.00 0.00 H new ATOM 0 HD21 LEU A 473 7.877 -6.632 -0.374 1.00 0.00 H new ATOM 0 HD22 LEU A 473 7.452 -6.731 -2.099 1.00 0.00 H new ATOM 0 HD23 LEU A 473 6.916 -8.003 -0.975 1.00 0.00 H new ATOM 1775 N ALA A 474 5.864 -7.812 -3.674 1.00 0.00 N ATOM 1776 CA ALA A 474 4.403 -8.090 -3.845 1.00 0.00 C ATOM 1777 C ALA A 474 4.195 -8.612 -5.268 1.00 0.00 C ATOM 1778 O ALA A 474 3.232 -9.285 -5.573 1.00 0.00 O ATOM 1779 CB ALA A 474 3.595 -6.807 -3.654 1.00 0.00 C ATOM 0 H ALA A 474 6.095 -6.916 -3.245 1.00 0.00 H new ATOM 0 HA ALA A 474 4.071 -8.820 -3.107 1.00 0.00 H new ATOM 0 HB1 ALA A 474 2.534 -7.023 -3.781 1.00 0.00 H new ATOM 0 HB2 ALA A 474 3.768 -6.414 -2.652 1.00 0.00 H new ATOM 0 HB3 ALA A 474 3.906 -6.068 -4.392 1.00 0.00 H new ATOM 1785 N SER A 475 5.131 -8.306 -6.130 1.00 0.00 N ATOM 1786 CA SER A 475 5.054 -8.779 -7.536 1.00 0.00 C ATOM 1787 C SER A 475 5.579 -10.221 -7.630 1.00 0.00 C ATOM 1788 O SER A 475 5.081 -11.010 -8.407 1.00 0.00 O ATOM 1789 CB SER A 475 5.905 -7.871 -8.425 1.00 0.00 C ATOM 1790 OG SER A 475 5.647 -8.175 -9.789 1.00 0.00 O ATOM 0 H SER A 475 5.953 -7.742 -5.912 1.00 0.00 H new ATOM 0 HA SER A 475 4.016 -8.751 -7.868 1.00 0.00 H new ATOM 0 HB2 SER A 475 5.674 -6.825 -8.223 1.00 0.00 H new ATOM 0 HB3 SER A 475 6.963 -8.012 -8.203 1.00 0.00 H new ATOM 0 HG SER A 475 6.190 -7.594 -10.362 1.00 0.00 H new ATOM 1796 N LYS A 476 6.585 -10.584 -6.858 1.00 0.00 N ATOM 1797 CA LYS A 476 7.100 -11.984 -6.956 1.00 0.00 C ATOM 1798 C LYS A 476 6.026 -12.967 -6.481 1.00 0.00 C ATOM 1799 O LYS A 476 6.261 -14.155 -6.377 1.00 0.00 O ATOM 1800 CB LYS A 476 8.409 -12.163 -6.152 1.00 0.00 C ATOM 1801 CG LYS A 476 8.198 -11.991 -4.634 1.00 0.00 C ATOM 1802 CD LYS A 476 9.345 -12.660 -3.862 1.00 0.00 C ATOM 1803 CE LYS A 476 10.692 -12.150 -4.390 1.00 0.00 C ATOM 1804 NZ LYS A 476 11.076 -12.925 -5.603 1.00 0.00 N ATOM 0 H LYS A 476 7.058 -9.984 -6.182 1.00 0.00 H new ATOM 0 HA LYS A 476 7.333 -12.193 -8.000 1.00 0.00 H new ATOM 0 HB2 LYS A 476 8.820 -13.153 -6.349 1.00 0.00 H new ATOM 0 HB3 LYS A 476 9.146 -11.438 -6.498 1.00 0.00 H new ATOM 0 HG2 LYS A 476 8.150 -10.931 -4.383 1.00 0.00 H new ATOM 0 HG3 LYS A 476 7.245 -12.431 -4.339 1.00 0.00 H new ATOM 0 HD2 LYS A 476 9.255 -12.443 -2.798 1.00 0.00 H new ATOM 0 HD3 LYS A 476 9.287 -13.743 -3.972 1.00 0.00 H new ATOM 0 HE2 LYS A 476 10.622 -11.089 -4.630 1.00 0.00 H new ATOM 0 HE3 LYS A 476 11.458 -12.253 -3.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 12.087 -13.165 -5.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 10.514 -13.799 -5.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 10.895 -12.353 -6.452 1.00 0.00 H new ATOM 1818 N GLY A 477 4.835 -12.486 -6.221 1.00 0.00 N ATOM 1819 CA GLY A 477 3.730 -13.396 -5.786 1.00 0.00 C ATOM 1820 C GLY A 477 3.620 -13.439 -4.260 1.00 0.00 C ATOM 1821 O GLY A 477 2.560 -13.694 -3.722 1.00 0.00 O ATOM 0 H GLY A 477 4.580 -11.501 -6.291 1.00 0.00 H new ATOM 0 HA2 GLY A 477 2.786 -13.056 -6.212 1.00 0.00 H new ATOM 0 HA3 GLY A 477 3.910 -14.400 -6.169 1.00 0.00 H new ATOM 1825 N LYS A 478 4.701 -13.216 -3.554 1.00 0.00 N ATOM 1826 CA LYS A 478 4.655 -13.271 -2.057 1.00 0.00 C ATOM 1827 C LYS A 478 5.417 -12.076 -1.470 1.00 0.00 C ATOM 1828 O LYS A 478 6.306 -11.522 -2.085 1.00 0.00 O ATOM 1829 CB LYS A 478 5.289 -14.603 -1.612 1.00 0.00 C ATOM 1830 CG LYS A 478 5.303 -14.751 -0.060 1.00 0.00 C ATOM 1831 CD LYS A 478 6.684 -15.187 0.470 1.00 0.00 C ATOM 1832 CE LYS A 478 7.825 -14.277 -0.044 1.00 0.00 C ATOM 1833 NZ LYS A 478 8.610 -15.005 -1.082 1.00 0.00 N ATOM 0 H LYS A 478 5.616 -12.998 -3.949 1.00 0.00 H new ATOM 0 HA LYS A 478 3.627 -13.218 -1.699 1.00 0.00 H new ATOM 0 HB2 LYS A 478 4.735 -15.433 -2.051 1.00 0.00 H new ATOM 0 HB3 LYS A 478 6.309 -14.664 -1.992 1.00 0.00 H new ATOM 0 HG2 LYS A 478 5.024 -13.802 0.397 1.00 0.00 H new ATOM 0 HG3 LYS A 478 4.553 -15.482 0.241 1.00 0.00 H new ATOM 0 HD2 LYS A 478 6.674 -15.172 1.560 1.00 0.00 H new ATOM 0 HD3 LYS A 478 6.879 -16.216 0.167 1.00 0.00 H new ATOM 0 HE2 LYS A 478 7.412 -13.359 -0.462 1.00 0.00 H new ATOM 0 HE3 LYS A 478 8.474 -13.988 0.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 478 8.888 -14.343 -1.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 478 9.462 -15.414 -0.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 478 8.028 -15.766 -1.487 1.00 0.00 H new ATOM 1847 N THR A 479 5.070 -11.691 -0.269 1.00 0.00 N ATOM 1848 CA THR A 479 5.754 -10.546 0.408 1.00 0.00 C ATOM 1849 C THR A 479 6.765 -11.103 1.409 1.00 0.00 C ATOM 1850 O THR A 479 6.967 -12.296 1.498 1.00 0.00 O ATOM 1851 CB THR A 479 4.721 -9.692 1.152 1.00 0.00 C ATOM 1852 OG1 THR A 479 5.366 -8.557 1.712 1.00 0.00 O ATOM 1853 CG2 THR A 479 4.074 -10.515 2.268 1.00 0.00 C ATOM 0 H THR A 479 4.330 -12.128 0.281 1.00 0.00 H new ATOM 0 HA THR A 479 6.260 -9.928 -0.334 1.00 0.00 H new ATOM 0 HB THR A 479 3.949 -9.368 0.454 1.00 0.00 H new ATOM 0 HG1 THR A 479 4.708 -8.008 2.187 1.00 0.00 H new ATOM 0 HG21 THR A 479 3.341 -9.903 2.793 1.00 0.00 H new ATOM 0 HG22 THR A 479 3.579 -11.385 1.838 1.00 0.00 H new ATOM 0 HG23 THR A 479 4.841 -10.844 2.969 1.00 0.00 H new ATOM 1861 N MET A 480 7.411 -10.261 2.165 1.00 0.00 N ATOM 1862 CA MET A 480 8.411 -10.779 3.140 1.00 0.00 C ATOM 1863 C MET A 480 9.396 -11.668 2.375 1.00 0.00 C ATOM 1864 O MET A 480 9.670 -12.790 2.750 1.00 0.00 O ATOM 1865 CB MET A 480 7.698 -11.592 4.242 1.00 0.00 C ATOM 1866 CG MET A 480 7.283 -10.670 5.394 1.00 0.00 C ATOM 1867 SD MET A 480 8.712 -10.380 6.469 1.00 0.00 S ATOM 1868 CE MET A 480 7.795 -9.930 7.963 1.00 0.00 C ATOM 0 H MET A 480 7.293 -9.248 2.152 1.00 0.00 H new ATOM 0 HA MET A 480 8.942 -9.956 3.617 1.00 0.00 H new ATOM 0 HB2 MET A 480 6.820 -12.087 3.828 1.00 0.00 H new ATOM 0 HB3 MET A 480 8.360 -12.374 4.613 1.00 0.00 H new ATOM 0 HG2 MET A 480 6.910 -9.724 5.002 1.00 0.00 H new ATOM 0 HG3 MET A 480 6.471 -11.122 5.963 1.00 0.00 H new ATOM 0 HE1 MET A 480 8.496 -9.707 8.767 1.00 0.00 H new ATOM 0 HE2 MET A 480 7.182 -9.052 7.763 1.00 0.00 H new ATOM 0 HE3 MET A 480 7.154 -10.760 8.260 1.00 0.00 H new ATOM 1878 N ALA A 481 9.920 -11.169 1.291 1.00 0.00 N ATOM 1879 CA ALA A 481 10.881 -11.985 0.486 1.00 0.00 C ATOM 1880 C ALA A 481 12.048 -12.402 1.374 1.00 0.00 C ATOM 1881 O ALA A 481 12.831 -13.265 1.032 1.00 0.00 O ATOM 1882 CB ALA A 481 11.406 -11.162 -0.688 1.00 0.00 C ATOM 0 H ALA A 481 9.728 -10.236 0.926 1.00 0.00 H new ATOM 0 HA ALA A 481 10.372 -12.869 0.103 1.00 0.00 H new ATOM 0 HB1 ALA A 481 12.105 -11.763 -1.270 1.00 0.00 H new ATOM 0 HB2 ALA A 481 10.573 -10.860 -1.322 1.00 0.00 H new ATOM 0 HB3 ALA A 481 11.916 -10.275 -0.312 1.00 0.00 H new ATOM 1888 N ASP A 482 12.150 -11.799 2.521 1.00 0.00 N ATOM 1889 CA ASP A 482 13.244 -12.148 3.473 1.00 0.00 C ATOM 1890 C ASP A 482 14.614 -12.016 2.798 1.00 0.00 C ATOM 1891 O ASP A 482 15.289 -11.015 2.934 1.00 0.00 O ATOM 1892 CB ASP A 482 13.049 -13.589 3.957 1.00 0.00 C ATOM 1893 CG ASP A 482 14.111 -13.931 5.003 1.00 0.00 C ATOM 1894 OD1 ASP A 482 13.893 -13.623 6.163 1.00 0.00 O ATOM 1895 OD2 ASP A 482 15.123 -14.500 4.628 1.00 0.00 O ATOM 0 H ASP A 482 11.516 -11.070 2.847 1.00 0.00 H new ATOM 0 HA ASP A 482 13.207 -11.461 4.318 1.00 0.00 H new ATOM 0 HB2 ASP A 482 12.053 -13.708 4.384 1.00 0.00 H new ATOM 0 HB3 ASP A 482 13.119 -14.278 3.115 1.00 0.00 H new ATOM 1900 N SER A 483 15.039 -13.026 2.091 1.00 0.00 N ATOM 1901 CA SER A 483 16.375 -12.967 1.430 1.00 0.00 C ATOM 1902 C SER A 483 16.469 -11.739 0.520 1.00 0.00 C ATOM 1903 O SER A 483 17.346 -10.911 0.670 1.00 0.00 O ATOM 1904 CB SER A 483 16.581 -14.233 0.598 1.00 0.00 C ATOM 1905 OG SER A 483 17.644 -14.024 -0.321 1.00 0.00 O ATOM 0 H SER A 483 14.519 -13.891 1.942 1.00 0.00 H new ATOM 0 HA SER A 483 17.146 -12.895 2.197 1.00 0.00 H new ATOM 0 HB2 SER A 483 16.809 -15.077 1.249 1.00 0.00 H new ATOM 0 HB3 SER A 483 15.665 -14.482 0.062 1.00 0.00 H new ATOM 0 HG SER A 483 17.779 -14.835 -0.855 1.00 0.00 H new ATOM 1911 N SER A 484 15.584 -11.620 -0.430 1.00 0.00 N ATOM 1912 CA SER A 484 15.635 -10.453 -1.357 1.00 0.00 C ATOM 1913 C SER A 484 15.069 -9.204 -0.663 1.00 0.00 C ATOM 1914 O SER A 484 15.479 -8.096 -0.934 1.00 0.00 O ATOM 1915 CB SER A 484 14.824 -10.790 -2.622 1.00 0.00 C ATOM 1916 OG SER A 484 15.609 -10.498 -3.771 1.00 0.00 O ATOM 0 H SER A 484 14.827 -12.280 -0.605 1.00 0.00 H new ATOM 0 HA SER A 484 16.667 -10.243 -1.637 1.00 0.00 H new ATOM 0 HB2 SER A 484 14.541 -11.843 -2.618 1.00 0.00 H new ATOM 0 HB3 SER A 484 13.900 -10.212 -2.641 1.00 0.00 H new ATOM 0 HG SER A 484 15.098 -10.712 -4.579 1.00 0.00 H new ATOM 1922 N TYR A 485 14.125 -9.385 0.218 1.00 0.00 N ATOM 1923 CA TYR A 485 13.506 -8.225 0.930 1.00 0.00 C ATOM 1924 C TYR A 485 14.573 -7.209 1.365 1.00 0.00 C ATOM 1925 O TYR A 485 14.474 -6.033 1.078 1.00 0.00 O ATOM 1926 CB TYR A 485 12.758 -8.754 2.163 1.00 0.00 C ATOM 1927 CG TYR A 485 12.323 -7.609 3.050 1.00 0.00 C ATOM 1928 CD1 TYR A 485 11.110 -6.953 2.807 1.00 0.00 C ATOM 1929 CD2 TYR A 485 13.133 -7.209 4.120 1.00 0.00 C ATOM 1930 CE1 TYR A 485 10.707 -5.899 3.635 1.00 0.00 C ATOM 1931 CE2 TYR A 485 12.730 -6.154 4.947 1.00 0.00 C ATOM 1932 CZ TYR A 485 11.518 -5.499 4.704 1.00 0.00 C ATOM 1933 OH TYR A 485 11.120 -4.461 5.521 1.00 0.00 O ATOM 0 H TYR A 485 13.750 -10.297 0.480 1.00 0.00 H new ATOM 0 HA TYR A 485 12.818 -7.717 0.255 1.00 0.00 H new ATOM 0 HB2 TYR A 485 11.887 -9.329 1.848 1.00 0.00 H new ATOM 0 HB3 TYR A 485 13.402 -9.432 2.723 1.00 0.00 H new ATOM 0 HD1 TYR A 485 10.486 -7.260 1.981 1.00 0.00 H new ATOM 0 HD2 TYR A 485 14.069 -7.715 4.307 1.00 0.00 H new ATOM 0 HE1 TYR A 485 9.770 -5.394 3.449 1.00 0.00 H new ATOM 0 HE2 TYR A 485 13.355 -5.846 5.772 1.00 0.00 H new ATOM 0 HH TYR A 485 11.797 -4.312 6.214 1.00 0.00 H new ATOM 1943 N ASN A 486 15.566 -7.647 2.080 1.00 0.00 N ATOM 1944 CA ASN A 486 16.621 -6.708 2.571 1.00 0.00 C ATOM 1945 C ASN A 486 17.247 -5.902 1.426 1.00 0.00 C ATOM 1946 O ASN A 486 17.551 -4.737 1.573 1.00 0.00 O ATOM 1947 CB ASN A 486 17.720 -7.518 3.249 1.00 0.00 C ATOM 1948 CG ASN A 486 17.139 -8.274 4.445 1.00 0.00 C ATOM 1949 OD1 ASN A 486 16.535 -7.682 5.318 1.00 0.00 O ATOM 1950 ND2 ASN A 486 17.295 -9.568 4.522 1.00 0.00 N ATOM 0 H ASN A 486 15.698 -8.622 2.350 1.00 0.00 H new ATOM 0 HA ASN A 486 16.154 -6.009 3.265 1.00 0.00 H new ATOM 0 HB2 ASN A 486 18.157 -8.221 2.540 1.00 0.00 H new ATOM 0 HB3 ASN A 486 18.522 -6.857 3.579 1.00 0.00 H new ATOM 0 HD21 ASN A 486 16.910 -10.082 5.315 1.00 0.00 H new ATOM 0 HD22 ASN A 486 17.802 -10.065 3.790 1.00 0.00 H new ATOM 1957 N LEU A 487 17.478 -6.516 0.305 1.00 0.00 N ATOM 1958 CA LEU A 487 18.123 -5.784 -0.828 1.00 0.00 C ATOM 1959 C LEU A 487 17.202 -4.656 -1.323 1.00 0.00 C ATOM 1960 O LEU A 487 17.653 -3.696 -1.914 1.00 0.00 O ATOM 1961 CB LEU A 487 18.429 -6.793 -1.968 1.00 0.00 C ATOM 1962 CG LEU A 487 19.919 -6.753 -2.357 1.00 0.00 C ATOM 1963 CD1 LEU A 487 20.757 -7.479 -1.298 1.00 0.00 C ATOM 1964 CD2 LEU A 487 20.112 -7.453 -3.705 1.00 0.00 C ATOM 0 H LEU A 487 17.251 -7.493 0.118 1.00 0.00 H new ATOM 0 HA LEU A 487 19.056 -5.329 -0.494 1.00 0.00 H new ATOM 0 HB2 LEU A 487 18.160 -7.800 -1.649 1.00 0.00 H new ATOM 0 HB3 LEU A 487 17.816 -6.560 -2.839 1.00 0.00 H new ATOM 0 HG LEU A 487 20.239 -5.713 -2.425 1.00 0.00 H new ATOM 0 HD11 LEU A 487 21.809 -7.446 -1.581 1.00 0.00 H new ATOM 0 HD12 LEU A 487 20.625 -6.991 -0.332 1.00 0.00 H new ATOM 0 HD13 LEU A 487 20.433 -8.517 -1.227 1.00 0.00 H new ATOM 0 HD21 LEU A 487 21.166 -7.425 -3.982 1.00 0.00 H new ATOM 0 HD22 LEU A 487 19.784 -8.490 -3.627 1.00 0.00 H new ATOM 0 HD23 LEU A 487 19.523 -6.943 -4.467 1.00 0.00 H new ATOM 1976 N GLU A 488 15.923 -4.759 -1.092 1.00 0.00 N ATOM 1977 CA GLU A 488 14.999 -3.686 -1.558 1.00 0.00 C ATOM 1978 C GLU A 488 15.065 -2.493 -0.603 1.00 0.00 C ATOM 1979 O GLU A 488 15.382 -1.390 -0.987 1.00 0.00 O ATOM 1980 CB GLU A 488 13.567 -4.226 -1.586 1.00 0.00 C ATOM 1981 CG GLU A 488 13.578 -5.666 -2.080 1.00 0.00 C ATOM 1982 CD GLU A 488 14.260 -5.735 -3.448 1.00 0.00 C ATOM 1983 OE1 GLU A 488 14.179 -4.761 -4.177 1.00 0.00 O ATOM 1984 OE2 GLU A 488 14.851 -6.761 -3.743 1.00 0.00 O ATOM 0 H GLU A 488 15.478 -5.536 -0.603 1.00 0.00 H new ATOM 0 HA GLU A 488 15.296 -3.368 -2.557 1.00 0.00 H new ATOM 0 HB2 GLU A 488 13.128 -4.175 -0.590 1.00 0.00 H new ATOM 0 HB3 GLU A 488 12.948 -3.611 -2.239 1.00 0.00 H new ATOM 0 HG2 GLU A 488 14.104 -6.301 -1.368 1.00 0.00 H new ATOM 0 HG3 GLU A 488 12.558 -6.044 -2.151 1.00 0.00 H new ATOM 1991 N VAL A 489 14.754 -2.708 0.638 1.00 0.00 N ATOM 1992 CA VAL A 489 14.786 -1.576 1.612 1.00 0.00 C ATOM 1993 C VAL A 489 16.149 -0.886 1.539 1.00 0.00 C ATOM 1994 O VAL A 489 16.259 0.318 1.652 1.00 0.00 O ATOM 1995 CB VAL A 489 14.528 -2.100 3.036 1.00 0.00 C ATOM 1996 CG1 VAL A 489 13.484 -3.209 2.976 1.00 0.00 C ATOM 1997 CG2 VAL A 489 15.816 -2.666 3.655 1.00 0.00 C ATOM 0 H VAL A 489 14.480 -3.611 1.025 1.00 0.00 H new ATOM 0 HA VAL A 489 14.006 -0.857 1.362 1.00 0.00 H new ATOM 0 HB VAL A 489 14.177 -1.272 3.652 1.00 0.00 H new ATOM 0 HG11 VAL A 489 13.295 -3.586 3.981 1.00 0.00 H new ATOM 0 HG12 VAL A 489 12.558 -2.815 2.557 1.00 0.00 H new ATOM 0 HG13 VAL A 489 13.851 -4.020 2.347 1.00 0.00 H new ATOM 0 HG21 VAL A 489 15.607 -3.030 4.661 1.00 0.00 H new ATOM 0 HG22 VAL A 489 16.184 -3.488 3.041 1.00 0.00 H new ATOM 0 HG23 VAL A 489 16.572 -1.882 3.702 1.00 0.00 H new ATOM 2007 N GLN A 490 17.184 -1.651 1.350 1.00 0.00 N ATOM 2008 CA GLN A 490 18.545 -1.059 1.269 1.00 0.00 C ATOM 2009 C GLN A 490 18.624 -0.149 0.048 1.00 0.00 C ATOM 2010 O GLN A 490 19.507 0.678 -0.068 1.00 0.00 O ATOM 2011 CB GLN A 490 19.585 -2.178 1.131 1.00 0.00 C ATOM 2012 CG GLN A 490 19.658 -3.001 2.429 1.00 0.00 C ATOM 2013 CD GLN A 490 20.604 -2.331 3.426 1.00 0.00 C ATOM 2014 OE1 GLN A 490 21.001 -1.111 3.207 1.00 0.00 O flip ATOM 2015 NE2 GLN A 490 20.984 -2.927 4.414 1.00 0.00 N flip ATOM 0 H GLN A 490 17.146 -2.665 1.248 1.00 0.00 H new ATOM 0 HA GLN A 490 18.746 -0.485 2.173 1.00 0.00 H new ATOM 0 HB2 GLN A 490 19.323 -2.827 0.295 1.00 0.00 H new ATOM 0 HB3 GLN A 490 20.562 -1.750 0.908 1.00 0.00 H new ATOM 0 HG2 GLN A 490 18.664 -3.094 2.866 1.00 0.00 H new ATOM 0 HG3 GLN A 490 20.005 -4.011 2.209 1.00 0.00 H new ATOM 0 HE21 GLN A 490 20.672 -3.883 4.584 1.00 0.00 H new ATOM 0 HE22 GLN A 490 21.615 -2.471 5.073 1.00 0.00 H new ATOM 2024 N ASN A 491 17.714 -0.303 -0.876 1.00 0.00 N ATOM 2025 CA ASN A 491 17.759 0.552 -2.103 1.00 0.00 C ATOM 2026 C ASN A 491 17.132 1.921 -1.823 1.00 0.00 C ATOM 2027 O ASN A 491 17.752 2.942 -2.027 1.00 0.00 O ATOM 2028 CB ASN A 491 17.009 -0.138 -3.245 1.00 0.00 C ATOM 2029 CG ASN A 491 17.735 -1.433 -3.620 1.00 0.00 C ATOM 2030 OD1 ASN A 491 18.672 -1.831 -2.956 1.00 0.00 O ATOM 2031 ND2 ASN A 491 17.343 -2.111 -4.665 1.00 0.00 N ATOM 0 H ASN A 491 16.948 -0.976 -0.838 1.00 0.00 H new ATOM 0 HA ASN A 491 18.800 0.696 -2.391 1.00 0.00 H new ATOM 0 HB2 ASN A 491 15.985 -0.357 -2.943 1.00 0.00 H new ATOM 0 HB3 ASN A 491 16.952 0.523 -4.109 1.00 0.00 H new ATOM 0 HD21 ASN A 491 17.823 -2.973 -4.923 1.00 0.00 H new ATOM 0 HD22 ASN A 491 16.557 -1.778 -5.223 1.00 0.00 H new ATOM 2038 N ILE A 492 15.912 1.959 -1.365 1.00 0.00 N ATOM 2039 CA ILE A 492 15.262 3.277 -1.092 1.00 0.00 C ATOM 2040 C ILE A 492 16.214 4.182 -0.309 1.00 0.00 C ATOM 2041 O ILE A 492 16.506 5.286 -0.720 1.00 0.00 O ATOM 2042 CB ILE A 492 13.977 3.059 -0.290 1.00 0.00 C ATOM 2043 CG1 ILE A 492 13.191 1.881 -0.885 1.00 0.00 C ATOM 2044 CG2 ILE A 492 13.122 4.329 -0.348 1.00 0.00 C ATOM 2045 CD1 ILE A 492 13.062 2.047 -2.402 1.00 0.00 C ATOM 0 H ILE A 492 15.337 1.140 -1.168 1.00 0.00 H new ATOM 0 HA ILE A 492 15.020 3.757 -2.040 1.00 0.00 H new ATOM 0 HB ILE A 492 14.228 2.836 0.747 1.00 0.00 H new ATOM 0 HG12 ILE A 492 13.697 0.943 -0.656 1.00 0.00 H new ATOM 0 HG13 ILE A 492 12.201 1.828 -0.432 1.00 0.00 H new ATOM 0 HG21 ILE A 492 12.206 4.177 0.222 1.00 0.00 H new ATOM 0 HG22 ILE A 492 13.680 5.163 0.077 1.00 0.00 H new ATOM 0 HG23 ILE A 492 12.871 4.552 -1.385 1.00 0.00 H new ATOM 0 HD11 ILE A 492 12.503 1.207 -2.814 1.00 0.00 H new ATOM 0 HD12 ILE A 492 12.536 2.976 -2.623 1.00 0.00 H new ATOM 0 HD13 ILE A 492 14.055 2.077 -2.850 1.00 0.00 H new ATOM 2057 N LEU A 493 16.705 3.731 0.811 1.00 0.00 N ATOM 2058 CA LEU A 493 17.642 4.576 1.607 1.00 0.00 C ATOM 2059 C LEU A 493 18.708 5.168 0.675 1.00 0.00 C ATOM 2060 O LEU A 493 19.191 6.263 0.882 1.00 0.00 O ATOM 2061 CB LEU A 493 18.319 3.706 2.680 1.00 0.00 C ATOM 2062 CG LEU A 493 17.431 3.602 3.934 1.00 0.00 C ATOM 2063 CD1 LEU A 493 17.365 4.953 4.676 1.00 0.00 C ATOM 2064 CD2 LEU A 493 16.019 3.161 3.527 1.00 0.00 C ATOM 0 H LEU A 493 16.499 2.815 1.210 1.00 0.00 H new ATOM 0 HA LEU A 493 17.093 5.385 2.088 1.00 0.00 H new ATOM 0 HB2 LEU A 493 18.511 2.710 2.280 1.00 0.00 H new ATOM 0 HB3 LEU A 493 19.285 4.134 2.947 1.00 0.00 H new ATOM 0 HG LEU A 493 17.866 2.864 4.608 1.00 0.00 H new ATOM 0 HD11 LEU A 493 16.732 4.853 5.558 1.00 0.00 H new ATOM 0 HD12 LEU A 493 18.368 5.250 4.981 1.00 0.00 H new ATOM 0 HD13 LEU A 493 16.948 5.712 4.014 1.00 0.00 H new ATOM 0 HD21 LEU A 493 15.391 3.087 4.415 1.00 0.00 H new ATOM 0 HD22 LEU A 493 15.593 3.893 2.841 1.00 0.00 H new ATOM 0 HD23 LEU A 493 16.069 2.189 3.036 1.00 0.00 H new ATOM 2076 N SER A 494 19.078 4.446 -0.345 1.00 0.00 N ATOM 2077 CA SER A 494 20.114 4.957 -1.286 1.00 0.00 C ATOM 2078 C SER A 494 19.586 6.173 -2.058 1.00 0.00 C ATOM 2079 O SER A 494 20.349 6.946 -2.597 1.00 0.00 O ATOM 2080 CB SER A 494 20.496 3.850 -2.270 1.00 0.00 C ATOM 2081 OG SER A 494 20.664 2.630 -1.557 1.00 0.00 O ATOM 0 H SER A 494 18.707 3.522 -0.568 1.00 0.00 H new ATOM 0 HA SER A 494 20.991 5.261 -0.714 1.00 0.00 H new ATOM 0 HB2 SER A 494 19.722 3.738 -3.029 1.00 0.00 H new ATOM 0 HB3 SER A 494 21.417 4.111 -2.790 1.00 0.00 H new ATOM 0 HG SER A 494 19.786 2.232 -1.379 1.00 0.00 H new