USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 688 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 387 SER OG : rot 15:sc= 0.218 USER MOD Set 1.2: A 390 HIS : no HD1:sc= -1.9! X(o=-1.7!,f=-1.7) USER MOD Set 2.1: A 367 LYS NZ :NH3+ 168:sc= 0.581 (180deg=-0.367) USER MOD Set 2.2: A 397 THR OG1 : rot 79:sc= 1.83 USER MOD Single : A 338 SER OG : rot 180:sc= 0 USER MOD Single : A 339 HIS : no HD1:sc= -0.199 X(o=-0.2,f=-0.0021) USER MOD Single : A 344 GLN : amide:sc= -2! C(o=-2!,f=-5.8!) USER MOD Single : A 347 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 350 GLN :FLIP amide:sc= -0.186 F(o=-1.1,f=-0.19) USER MOD Single : A 351 GLN : amide:sc= -0.236 K(o=-0.24,f=-2.3!) USER MOD Single : A 357 SER OG : rot -80:sc= 1.19 USER MOD Single : A 361 GLN : amide:sc= 0.553 K(o=0.55,f=0) USER MOD Single : A 362 LYS NZ :NH3+ 167:sc= 1.21 (180deg=0.935) USER MOD Single : A 364 MET CE :methyl -150:sc= -0.451 (180deg=-1.31) USER MOD Single : A 366 GLN : amide:sc= -0.676 X(o=-0.68,f=-0.87) USER MOD Single : A 371 ASN : amide:sc=-0.00259 K(o=-0.0026,f=-0.97) USER MOD Single : A 372 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 MET CE :methyl -163:sc= -0.0725 (180deg=-0.501) USER MOD Single : A 374 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 377 TYR OH : rot 180:sc= 0 USER MOD Single : A 379 LYS NZ :NH3+ -167:sc= -0.0721 (180deg=-0.31) USER MOD Single : A 380 ASN : amide:sc= -0.0172 X(o=-0.017,f=-0.017) USER MOD Single : A 382 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 383 MET CE :methyl 180:sc= -0.0731 (180deg=-0.0731) USER MOD Single : A 388 SER OG : rot 60:sc= 1.2 USER MOD Single : A 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 396 THR OG1 : rot 98:sc= 1.28 USER MOD Single : A 398 SER OG : rot 78:sc= 1.28 USER MOD Single : A 399 ASN : amide:sc= 1.22 K(o=1.2,f=-0.89) USER MOD Single : A 405 MET CE :methyl 151:sc= -1.26 (180deg=-3.37!) USER MOD Single : A 408 HIS : no HD1:sc= 0 X(o=0,f=-0.007) USER MOD Single : A 409 LYS NZ :NH3+ 157:sc= 1.26 (180deg=1.11) USER MOD Single : A 410 ASN : amide:sc= 0.987 K(o=0.99,f=-2.6!) USER MOD Single : A 415 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 195 N PHE A 337 -14.415 -4.344 5.084 1.00 0.00 N ATOM 196 CA PHE A 337 -15.241 -3.156 5.330 1.00 0.00 C ATOM 197 C PHE A 337 -16.694 -3.406 4.929 1.00 0.00 C ATOM 198 O PHE A 337 -17.501 -2.482 4.879 1.00 0.00 O ATOM 199 CB PHE A 337 -14.702 -1.924 4.585 1.00 0.00 C ATOM 200 CG PHE A 337 -13.354 -1.450 5.054 1.00 0.00 C ATOM 201 CD1 PHE A 337 -13.236 -0.687 6.205 1.00 0.00 C ATOM 202 CD2 PHE A 337 -12.210 -1.752 4.336 1.00 0.00 C ATOM 203 CE1 PHE A 337 -12.001 -0.237 6.633 1.00 0.00 C ATOM 204 CE2 PHE A 337 -10.972 -1.303 4.757 1.00 0.00 C ATOM 205 CZ PHE A 337 -10.868 -0.546 5.907 1.00 0.00 C ATOM 0 HA PHE A 337 -15.197 -2.955 6.400 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -14.641 -2.156 3.522 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -15.417 -1.109 4.693 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -14.120 -0.441 6.775 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -12.285 -2.345 3.437 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -11.923 0.355 7.533 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -10.087 -1.544 4.187 1.00 0.00 H new ATOM 0 HZ PHE A 337 -9.901 -0.196 6.238 1.00 0.00 H new ATOM 215 N SER A 338 -17.027 -4.665 4.687 1.00 0.00 N ATOM 216 CA SER A 338 -18.336 -5.038 4.169 1.00 0.00 C ATOM 217 C SER A 338 -19.433 -4.873 5.221 1.00 0.00 C ATOM 218 O SER A 338 -20.619 -4.838 4.892 1.00 0.00 O ATOM 219 CB SER A 338 -18.287 -6.479 3.668 1.00 0.00 C ATOM 220 OG SER A 338 -17.174 -6.667 2.809 1.00 0.00 O ATOM 0 H SER A 338 -16.401 -5.455 4.843 1.00 0.00 H new ATOM 0 HA SER A 338 -18.582 -4.369 3.344 1.00 0.00 H new ATOM 0 HB2 SER A 338 -18.221 -7.163 4.514 1.00 0.00 H new ATOM 0 HB3 SER A 338 -19.209 -6.717 3.137 1.00 0.00 H new ATOM 0 HG SER A 338 -17.155 -7.596 2.497 1.00 0.00 H new ATOM 226 N HIS A 339 -19.041 -4.759 6.487 1.00 0.00 N ATOM 227 CA HIS A 339 -20.007 -4.536 7.561 1.00 0.00 C ATOM 228 C HIS A 339 -20.389 -3.059 7.635 1.00 0.00 C ATOM 229 O HIS A 339 -21.141 -2.641 8.515 1.00 0.00 O ATOM 230 CB HIS A 339 -19.466 -5.025 8.918 1.00 0.00 C ATOM 231 CG HIS A 339 -18.272 -4.275 9.438 1.00 0.00 C ATOM 232 ND1 HIS A 339 -17.000 -4.803 9.456 1.00 0.00 N ATOM 233 CD2 HIS A 339 -18.166 -3.037 9.978 1.00 0.00 C ATOM 234 CE1 HIS A 339 -16.168 -3.925 9.982 1.00 0.00 C ATOM 235 NE2 HIS A 339 -16.849 -2.845 10.305 1.00 0.00 N ATOM 0 H HIS A 339 -18.070 -4.817 6.794 1.00 0.00 H new ATOM 0 HA HIS A 339 -20.900 -5.118 7.333 1.00 0.00 H new ATOM 0 HB2 HIS A 339 -20.266 -4.959 9.655 1.00 0.00 H new ATOM 0 HB3 HIS A 339 -19.202 -6.079 8.828 1.00 0.00 H new ATOM 0 HD2 HIS A 339 -18.971 -2.332 10.124 1.00 0.00 H new ATOM 0 HE1 HIS A 339 -15.107 -4.068 10.124 1.00 0.00 H new ATOM 0 HE2 HIS A 339 -16.460 -2.003 10.729 1.00 0.00 H new ATOM 244 N LEU A 340 -19.849 -2.274 6.715 1.00 0.00 N ATOM 245 CA LEU A 340 -20.148 -0.856 6.643 1.00 0.00 C ATOM 246 C LEU A 340 -21.135 -0.584 5.516 1.00 0.00 C ATOM 247 O LEU A 340 -20.983 -1.109 4.408 1.00 0.00 O ATOM 248 CB LEU A 340 -18.868 -0.050 6.401 1.00 0.00 C ATOM 249 CG LEU A 340 -17.781 -0.197 7.463 1.00 0.00 C ATOM 250 CD1 LEU A 340 -16.563 0.627 7.085 1.00 0.00 C ATOM 251 CD2 LEU A 340 -18.299 0.229 8.826 1.00 0.00 C ATOM 0 H LEU A 340 -19.196 -2.601 6.003 1.00 0.00 H new ATOM 0 HA LEU A 340 -20.588 -0.551 7.592 1.00 0.00 H new ATOM 0 HB2 LEU A 340 -18.451 -0.345 5.438 1.00 0.00 H new ATOM 0 HB3 LEU A 340 -19.134 1.004 6.323 1.00 0.00 H new ATOM 0 HG LEU A 340 -17.495 -1.247 7.517 1.00 0.00 H new ATOM 0 HD11 LEU A 340 -15.795 0.514 7.850 1.00 0.00 H new ATOM 0 HD12 LEU A 340 -16.174 0.283 6.127 1.00 0.00 H new ATOM 0 HD13 LEU A 340 -16.844 1.677 7.006 1.00 0.00 H new ATOM 0 HD21 LEU A 340 -17.508 0.116 9.567 1.00 0.00 H new ATOM 0 HD22 LEU A 340 -18.613 1.272 8.786 1.00 0.00 H new ATOM 0 HD23 LEU A 340 -19.148 -0.395 9.104 1.00 0.00 H new ATOM 263 N PRO A 341 -22.173 0.223 5.793 1.00 0.00 N ATOM 264 CA PRO A 341 -23.122 0.675 4.770 1.00 0.00 C ATOM 265 C PRO A 341 -22.400 1.369 3.620 1.00 0.00 C ATOM 266 O PRO A 341 -21.348 1.966 3.833 1.00 0.00 O ATOM 267 CB PRO A 341 -24.012 1.667 5.520 1.00 0.00 C ATOM 268 CG PRO A 341 -23.906 1.270 6.949 1.00 0.00 C ATOM 269 CD PRO A 341 -22.510 0.748 7.127 1.00 0.00 C ATOM 0 HA PRO A 341 -23.679 -0.148 4.321 1.00 0.00 H new ATOM 0 HB2 PRO A 341 -23.675 2.693 5.369 1.00 0.00 H new ATOM 0 HB3 PRO A 341 -25.043 1.615 5.171 1.00 0.00 H new ATOM 0 HG2 PRO A 341 -24.092 2.120 7.606 1.00 0.00 H new ATOM 0 HG3 PRO A 341 -24.643 0.507 7.198 1.00 0.00 H new ATOM 0 HD2 PRO A 341 -21.822 1.535 7.435 1.00 0.00 H new ATOM 0 HD3 PRO A 341 -22.465 -0.030 7.889 1.00 0.00 H new ATOM 277 N PRO A 342 -22.964 1.310 2.398 1.00 0.00 N ATOM 278 CA PRO A 342 -22.329 1.836 1.179 1.00 0.00 C ATOM 279 C PRO A 342 -21.603 3.168 1.378 1.00 0.00 C ATOM 280 O PRO A 342 -20.411 3.283 1.091 1.00 0.00 O ATOM 281 CB PRO A 342 -23.513 2.008 0.234 1.00 0.00 C ATOM 282 CG PRO A 342 -24.452 0.920 0.619 1.00 0.00 C ATOM 283 CD PRO A 342 -24.285 0.719 2.104 1.00 0.00 C ATOM 0 HA PRO A 342 -21.547 1.168 0.818 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -23.973 2.989 0.348 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -23.206 1.919 -0.808 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -25.480 1.190 0.377 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -24.227 0.002 0.075 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -25.078 1.214 2.665 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -24.318 -0.338 2.370 1.00 0.00 H new ATOM 291 N GLU A 343 -22.318 4.163 1.885 1.00 0.00 N ATOM 292 CA GLU A 343 -21.754 5.494 2.071 1.00 0.00 C ATOM 293 C GLU A 343 -20.586 5.469 3.057 1.00 0.00 C ATOM 294 O GLU A 343 -19.524 6.030 2.789 1.00 0.00 O ATOM 295 CB GLU A 343 -22.833 6.453 2.569 1.00 0.00 C ATOM 296 CG GLU A 343 -22.339 7.872 2.788 1.00 0.00 C ATOM 297 CD GLU A 343 -23.403 8.762 3.388 1.00 0.00 C ATOM 298 OE1 GLU A 343 -23.707 8.600 4.592 1.00 0.00 O ATOM 299 OE2 GLU A 343 -23.943 9.624 2.665 1.00 0.00 O ATOM 0 H GLU A 343 -23.292 4.074 2.176 1.00 0.00 H new ATOM 0 HA GLU A 343 -21.378 5.838 1.108 1.00 0.00 H new ATOM 0 HB2 GLU A 343 -23.651 6.470 1.849 1.00 0.00 H new ATOM 0 HB3 GLU A 343 -23.241 6.072 3.505 1.00 0.00 H new ATOM 0 HG2 GLU A 343 -21.470 7.855 3.445 1.00 0.00 H new ATOM 0 HG3 GLU A 343 -22.011 8.291 1.837 1.00 0.00 H new ATOM 306 N GLN A 344 -20.782 4.798 4.182 1.00 0.00 N ATOM 307 CA GLN A 344 -19.771 4.752 5.231 1.00 0.00 C ATOM 308 C GLN A 344 -18.577 3.902 4.804 1.00 0.00 C ATOM 309 O GLN A 344 -17.432 4.219 5.127 1.00 0.00 O ATOM 310 CB GLN A 344 -20.379 4.203 6.521 1.00 0.00 C ATOM 311 CG GLN A 344 -19.420 4.195 7.698 1.00 0.00 C ATOM 312 CD GLN A 344 -20.092 3.766 8.983 1.00 0.00 C ATOM 313 OE1 GLN A 344 -20.145 2.582 9.306 1.00 0.00 O ATOM 314 NE2 GLN A 344 -20.608 4.723 9.732 1.00 0.00 N ATOM 0 H GLN A 344 -21.633 4.277 4.393 1.00 0.00 H new ATOM 0 HA GLN A 344 -19.416 5.767 5.409 1.00 0.00 H new ATOM 0 HB2 GLN A 344 -21.254 4.799 6.781 1.00 0.00 H new ATOM 0 HB3 GLN A 344 -20.728 3.186 6.342 1.00 0.00 H new ATOM 0 HG2 GLN A 344 -18.590 3.522 7.483 1.00 0.00 H new ATOM 0 HG3 GLN A 344 -18.998 5.192 7.827 1.00 0.00 H new ATOM 0 HE21 GLN A 344 -20.545 5.696 9.432 1.00 0.00 H new ATOM 0 HE22 GLN A 344 -21.070 4.490 10.611 1.00 0.00 H new ATOM 323 N ARG A 345 -18.850 2.831 4.068 1.00 0.00 N ATOM 324 CA ARG A 345 -17.799 1.939 3.601 1.00 0.00 C ATOM 325 C ARG A 345 -16.831 2.691 2.701 1.00 0.00 C ATOM 326 O ARG A 345 -15.627 2.704 2.948 1.00 0.00 O ATOM 327 CB ARG A 345 -18.396 0.738 2.857 1.00 0.00 C ATOM 328 CG ARG A 345 -17.367 -0.323 2.493 1.00 0.00 C ATOM 329 CD ARG A 345 -18.021 -1.551 1.878 1.00 0.00 C ATOM 330 NE ARG A 345 -17.045 -2.597 1.560 1.00 0.00 N ATOM 331 CZ ARG A 345 -17.227 -3.535 0.628 1.00 0.00 C ATOM 332 NH1 ARG A 345 -18.351 -3.561 -0.085 1.00 0.00 N ATOM 333 NH2 ARG A 345 -16.290 -4.452 0.423 1.00 0.00 N ATOM 0 H ARG A 345 -19.791 2.560 3.782 1.00 0.00 H new ATOM 0 HA ARG A 345 -17.254 1.567 4.469 1.00 0.00 H new ATOM 0 HB2 ARG A 345 -19.170 0.285 3.477 1.00 0.00 H new ATOM 0 HB3 ARG A 345 -18.882 1.089 1.947 1.00 0.00 H new ATOM 0 HG2 ARG A 345 -16.645 0.095 1.791 1.00 0.00 H new ATOM 0 HG3 ARG A 345 -16.813 -0.614 3.385 1.00 0.00 H new ATOM 0 HD2 ARG A 345 -18.765 -1.948 2.568 1.00 0.00 H new ATOM 0 HD3 ARG A 345 -18.551 -1.262 0.970 1.00 0.00 H new ATOM 0 HE ARG A 345 -16.170 -2.609 2.085 1.00 0.00 H new ATOM 0 HH11 ARG A 345 -19.076 -2.863 0.080 1.00 0.00 H new ATOM 0 HH12 ARG A 345 -18.487 -4.279 -0.797 1.00 0.00 H new ATOM 0 HH21 ARG A 345 -15.434 -4.439 0.977 1.00 0.00 H new ATOM 0 HH22 ARG A 345 -16.426 -5.170 -0.288 1.00 0.00 H new ATOM 347 N ARG A 346 -17.365 3.355 1.680 1.00 0.00 N ATOM 348 CA ARG A 346 -16.531 4.096 0.739 1.00 0.00 C ATOM 349 C ARG A 346 -15.891 5.305 1.410 1.00 0.00 C ATOM 350 O ARG A 346 -14.823 5.754 1.000 1.00 0.00 O ATOM 351 CB ARG A 346 -17.336 4.524 -0.493 1.00 0.00 C ATOM 352 CG ARG A 346 -18.512 5.434 -0.185 1.00 0.00 C ATOM 353 CD ARG A 346 -19.273 5.805 -1.446 1.00 0.00 C ATOM 354 NE ARG A 346 -20.450 6.619 -1.151 1.00 0.00 N ATOM 355 CZ ARG A 346 -21.466 6.796 -1.996 1.00 0.00 C ATOM 356 NH1 ARG A 346 -21.427 6.259 -3.210 1.00 0.00 N ATOM 357 NH2 ARG A 346 -22.513 7.526 -1.631 1.00 0.00 N ATOM 0 H ARG A 346 -18.365 3.395 1.484 1.00 0.00 H new ATOM 0 HA ARG A 346 -15.734 3.430 0.408 1.00 0.00 H new ATOM 0 HB2 ARG A 346 -16.670 5.034 -1.189 1.00 0.00 H new ATOM 0 HB3 ARG A 346 -17.705 3.632 -1.000 1.00 0.00 H new ATOM 0 HG2 ARG A 346 -19.185 4.937 0.514 1.00 0.00 H new ATOM 0 HG3 ARG A 346 -18.154 6.339 0.305 1.00 0.00 H new ATOM 0 HD2 ARG A 346 -18.614 6.351 -2.121 1.00 0.00 H new ATOM 0 HD3 ARG A 346 -19.580 4.897 -1.965 1.00 0.00 H new ATOM 0 HE ARG A 346 -20.497 7.080 -0.243 1.00 0.00 H new ATOM 0 HH11 ARG A 346 -20.618 5.709 -3.499 1.00 0.00 H new ATOM 0 HH12 ARG A 346 -22.206 6.397 -3.854 1.00 0.00 H new ATOM 0 HH21 ARG A 346 -22.540 7.951 -0.704 1.00 0.00 H new ATOM 0 HH22 ARG A 346 -23.290 7.662 -2.277 1.00 0.00 H new ATOM 371 N LYS A 347 -16.536 5.813 2.452 1.00 0.00 N ATOM 372 CA LYS A 347 -15.982 6.916 3.225 1.00 0.00 C ATOM 373 C LYS A 347 -14.698 6.464 3.916 1.00 0.00 C ATOM 374 O LYS A 347 -13.697 7.180 3.932 1.00 0.00 O ATOM 375 CB LYS A 347 -17.006 7.409 4.252 1.00 0.00 C ATOM 376 CG LYS A 347 -16.558 8.624 5.049 1.00 0.00 C ATOM 377 CD LYS A 347 -17.653 9.092 5.996 1.00 0.00 C ATOM 378 CE LYS A 347 -17.216 10.305 6.802 1.00 0.00 C ATOM 379 NZ LYS A 347 -18.288 10.773 7.723 1.00 0.00 N ATOM 0 H LYS A 347 -17.442 5.479 2.781 1.00 0.00 H new ATOM 0 HA LYS A 347 -15.747 7.743 2.555 1.00 0.00 H new ATOM 0 HB2 LYS A 347 -17.934 7.651 3.735 1.00 0.00 H new ATOM 0 HB3 LYS A 347 -17.229 6.597 4.944 1.00 0.00 H new ATOM 0 HG2 LYS A 347 -15.661 8.379 5.618 1.00 0.00 H new ATOM 0 HG3 LYS A 347 -16.292 9.432 4.367 1.00 0.00 H new ATOM 0 HD2 LYS A 347 -18.548 9.337 5.425 1.00 0.00 H new ATOM 0 HD3 LYS A 347 -17.920 8.281 6.674 1.00 0.00 H new ATOM 0 HE2 LYS A 347 -16.325 10.056 7.378 1.00 0.00 H new ATOM 0 HE3 LYS A 347 -16.942 11.113 6.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 347 -17.952 11.601 8.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 347 -19.130 11.034 7.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 347 -18.532 10.011 8.387 1.00 0.00 H new ATOM 393 N ARG A 348 -14.730 5.255 4.465 1.00 0.00 N ATOM 394 CA ARG A 348 -13.555 4.672 5.093 1.00 0.00 C ATOM 395 C ARG A 348 -12.526 4.270 4.042 1.00 0.00 C ATOM 396 O ARG A 348 -11.323 4.328 4.288 1.00 0.00 O ATOM 397 CB ARG A 348 -13.940 3.459 5.945 1.00 0.00 C ATOM 398 CG ARG A 348 -14.744 3.814 7.186 1.00 0.00 C ATOM 399 CD ARG A 348 -13.939 4.678 8.144 1.00 0.00 C ATOM 400 NE ARG A 348 -14.683 4.991 9.361 1.00 0.00 N ATOM 401 CZ ARG A 348 -14.155 5.603 10.420 1.00 0.00 C ATOM 402 NH1 ARG A 348 -12.876 5.965 10.420 1.00 0.00 N ATOM 403 NH2 ARG A 348 -14.910 5.853 11.481 1.00 0.00 N ATOM 0 H ARG A 348 -15.559 4.661 4.487 1.00 0.00 H new ATOM 0 HA ARG A 348 -13.112 5.426 5.744 1.00 0.00 H new ATOM 0 HB2 ARG A 348 -14.518 2.766 5.334 1.00 0.00 H new ATOM 0 HB3 ARG A 348 -13.033 2.936 6.248 1.00 0.00 H new ATOM 0 HG2 ARG A 348 -15.652 4.342 6.894 1.00 0.00 H new ATOM 0 HG3 ARG A 348 -15.055 2.900 7.693 1.00 0.00 H new ATOM 0 HD2 ARG A 348 -13.015 4.162 8.407 1.00 0.00 H new ATOM 0 HD3 ARG A 348 -13.656 5.605 7.645 1.00 0.00 H new ATOM 0 HE ARG A 348 -15.667 4.725 9.403 1.00 0.00 H new ATOM 0 HH11 ARG A 348 -12.292 5.775 9.606 1.00 0.00 H new ATOM 0 HH12 ARG A 348 -12.478 6.433 11.234 1.00 0.00 H new ATOM 0 HH21 ARG A 348 -15.892 5.577 11.485 1.00 0.00 H new ATOM 0 HH22 ARG A 348 -14.509 6.321 12.293 1.00 0.00 H new ATOM 417 N LEU A 349 -13.004 3.870 2.868 1.00 0.00 N ATOM 418 CA LEU A 349 -12.119 3.480 1.773 1.00 0.00 C ATOM 419 C LEU A 349 -11.308 4.675 1.278 1.00 0.00 C ATOM 420 O LEU A 349 -10.119 4.553 0.997 1.00 0.00 O ATOM 421 CB LEU A 349 -12.914 2.880 0.609 1.00 0.00 C ATOM 422 CG LEU A 349 -13.749 1.642 0.946 1.00 0.00 C ATOM 423 CD1 LEU A 349 -14.457 1.119 -0.292 1.00 0.00 C ATOM 424 CD2 LEU A 349 -12.883 0.553 1.556 1.00 0.00 C ATOM 0 H LEU A 349 -13.998 3.807 2.649 1.00 0.00 H new ATOM 0 HA LEU A 349 -11.436 2.723 2.158 1.00 0.00 H new ATOM 0 HB2 LEU A 349 -13.579 3.648 0.213 1.00 0.00 H new ATOM 0 HB3 LEU A 349 -12.217 2.620 -0.188 1.00 0.00 H new ATOM 0 HG LEU A 349 -14.501 1.934 1.679 1.00 0.00 H new ATOM 0 HD11 LEU A 349 -15.045 0.239 -0.031 1.00 0.00 H new ATOM 0 HD12 LEU A 349 -15.116 1.891 -0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 349 -13.718 0.851 -1.047 1.00 0.00 H new ATOM 0 HD21 LEU A 349 -13.500 -0.316 1.787 1.00 0.00 H new ATOM 0 HD22 LEU A 349 -12.105 0.268 0.848 1.00 0.00 H new ATOM 0 HD23 LEU A 349 -12.423 0.924 2.472 1.00 0.00 H new ATOM 436 N GLN A 350 -11.954 5.834 1.187 1.00 0.00 N ATOM 437 CA GLN A 350 -11.290 7.043 0.709 1.00 0.00 C ATOM 438 C GLN A 350 -10.122 7.433 1.609 1.00 0.00 C ATOM 439 O GLN A 350 -9.038 7.768 1.123 1.00 0.00 O ATOM 440 CB GLN A 350 -12.282 8.201 0.605 1.00 0.00 C ATOM 441 CG GLN A 350 -13.249 8.074 -0.560 1.00 0.00 C ATOM 442 CD GLN A 350 -12.551 8.136 -1.906 1.00 0.00 C ATOM 443 OE1 GLN A 350 -12.151 6.985 -2.422 1.00 0.00 O flip ATOM 444 NE2 GLN A 350 -12.375 9.211 -2.479 1.00 0.00 N flip ATOM 0 H GLN A 350 -12.935 5.962 1.437 1.00 0.00 H new ATOM 0 HA GLN A 350 -10.895 6.827 -0.284 1.00 0.00 H new ATOM 0 HB2 GLN A 350 -12.851 8.265 1.533 1.00 0.00 H new ATOM 0 HB3 GLN A 350 -11.728 9.135 0.506 1.00 0.00 H new ATOM 0 HG2 GLN A 350 -13.789 7.131 -0.478 1.00 0.00 H new ATOM 0 HG3 GLN A 350 -13.990 8.872 -0.502 1.00 0.00 H new ATOM 0 HE21 GLN A 350 -12.698 10.077 -2.048 1.00 0.00 H new ATOM 0 HE22 GLN A 350 -11.906 9.235 -3.384 1.00 0.00 H new ATOM 453 N GLN A 351 -10.333 7.384 2.919 1.00 0.00 N ATOM 454 CA GLN A 351 -9.270 7.705 3.862 1.00 0.00 C ATOM 455 C GLN A 351 -8.274 6.554 3.966 1.00 0.00 C ATOM 456 O GLN A 351 -7.125 6.749 4.369 1.00 0.00 O ATOM 457 CB GLN A 351 -9.831 8.052 5.236 1.00 0.00 C ATOM 458 CG GLN A 351 -10.605 6.920 5.848 1.00 0.00 C ATOM 459 CD GLN A 351 -10.777 7.055 7.348 1.00 0.00 C ATOM 460 OE1 GLN A 351 -10.897 6.060 8.065 1.00 0.00 O ATOM 461 NE2 GLN A 351 -10.775 8.281 7.838 1.00 0.00 N ATOM 0 H GLN A 351 -11.222 7.128 3.349 1.00 0.00 H new ATOM 0 HA GLN A 351 -8.747 8.583 3.483 1.00 0.00 H new ATOM 0 HB2 GLN A 351 -9.011 8.327 5.900 1.00 0.00 H new ATOM 0 HB3 GLN A 351 -10.478 8.925 5.150 1.00 0.00 H new ATOM 0 HG2 GLN A 351 -11.588 6.866 5.380 1.00 0.00 H new ATOM 0 HG3 GLN A 351 -10.096 5.981 5.630 1.00 0.00 H new ATOM 0 HE21 GLN A 351 -10.673 9.080 7.212 1.00 0.00 H new ATOM 0 HE22 GLN A 351 -10.875 8.429 8.842 1.00 0.00 H new ATOM 470 N ARG A 352 -8.712 5.357 3.590 1.00 0.00 N ATOM 471 CA ARG A 352 -7.842 4.198 3.582 1.00 0.00 C ATOM 472 C ARG A 352 -6.865 4.295 2.414 1.00 0.00 C ATOM 473 O ARG A 352 -5.674 4.031 2.565 1.00 0.00 O ATOM 474 CB ARG A 352 -8.671 2.915 3.489 1.00 0.00 C ATOM 475 CG ARG A 352 -7.850 1.649 3.631 1.00 0.00 C ATOM 476 CD ARG A 352 -7.142 1.599 4.974 1.00 0.00 C ATOM 477 NE ARG A 352 -6.408 0.353 5.167 1.00 0.00 N ATOM 478 CZ ARG A 352 -5.237 0.266 5.791 1.00 0.00 C ATOM 479 NH1 ARG A 352 -4.679 1.347 6.328 1.00 0.00 N ATOM 480 NH2 ARG A 352 -4.638 -0.913 5.898 1.00 0.00 N ATOM 0 H ARG A 352 -9.668 5.169 3.287 1.00 0.00 H new ATOM 0 HA ARG A 352 -7.274 4.170 4.512 1.00 0.00 H new ATOM 0 HB2 ARG A 352 -9.437 2.930 4.265 1.00 0.00 H new ATOM 0 HB3 ARG A 352 -9.189 2.896 2.530 1.00 0.00 H new ATOM 0 HG2 ARG A 352 -8.498 0.779 3.526 1.00 0.00 H new ATOM 0 HG3 ARG A 352 -7.115 1.597 2.828 1.00 0.00 H new ATOM 0 HD2 ARG A 352 -6.453 2.440 5.050 1.00 0.00 H new ATOM 0 HD3 ARG A 352 -7.875 1.714 5.773 1.00 0.00 H new ATOM 0 HE ARG A 352 -6.819 -0.505 4.800 1.00 0.00 H new ATOM 0 HH11 ARG A 352 -5.149 2.250 6.263 1.00 0.00 H new ATOM 0 HH12 ARG A 352 -3.781 1.273 6.805 1.00 0.00 H new ATOM 0 HH21 ARG A 352 -5.076 -1.745 5.503 1.00 0.00 H new ATOM 0 HH22 ARG A 352 -3.740 -0.987 6.375 1.00 0.00 H new ATOM 494 N ILE A 353 -7.377 4.694 1.252 1.00 0.00 N ATOM 495 CA ILE A 353 -6.532 4.953 0.093 1.00 0.00 C ATOM 496 C ILE A 353 -5.578 6.099 0.398 1.00 0.00 C ATOM 497 O ILE A 353 -4.401 6.047 0.052 1.00 0.00 O ATOM 498 CB ILE A 353 -7.365 5.300 -1.162 1.00 0.00 C ATOM 499 CG1 ILE A 353 -8.265 4.126 -1.545 1.00 0.00 C ATOM 500 CG2 ILE A 353 -6.453 5.671 -2.326 1.00 0.00 C ATOM 501 CD1 ILE A 353 -9.129 4.392 -2.760 1.00 0.00 C ATOM 0 H ILE A 353 -8.373 4.844 1.090 1.00 0.00 H new ATOM 0 HA ILE A 353 -5.972 4.042 -0.116 1.00 0.00 H new ATOM 0 HB ILE A 353 -7.994 6.160 -0.930 1.00 0.00 H new ATOM 0 HG12 ILE A 353 -7.644 3.251 -1.736 1.00 0.00 H new ATOM 0 HG13 ILE A 353 -8.908 3.882 -0.699 1.00 0.00 H new ATOM 0 HG21 ILE A 353 -7.058 5.912 -3.200 1.00 0.00 H new ATOM 0 HG22 ILE A 353 -5.849 6.536 -2.053 1.00 0.00 H new ATOM 0 HG23 ILE A 353 -5.799 4.830 -2.558 1.00 0.00 H new ATOM 0 HD11 ILE A 353 -9.740 3.514 -2.971 1.00 0.00 H new ATOM 0 HD12 ILE A 353 -9.777 5.247 -2.566 1.00 0.00 H new ATOM 0 HD13 ILE A 353 -8.493 4.606 -3.619 1.00 0.00 H new ATOM 513 N ASP A 354 -6.097 7.126 1.061 1.00 0.00 N ATOM 514 CA ASP A 354 -5.282 8.256 1.504 1.00 0.00 C ATOM 515 C ASP A 354 -4.118 7.770 2.362 1.00 0.00 C ATOM 516 O ASP A 354 -2.979 8.204 2.191 1.00 0.00 O ATOM 517 CB ASP A 354 -6.141 9.248 2.292 1.00 0.00 C ATOM 518 CG ASP A 354 -5.330 10.377 2.894 1.00 0.00 C ATOM 519 OD1 ASP A 354 -4.796 11.207 2.131 1.00 0.00 O ATOM 520 OD2 ASP A 354 -5.227 10.443 4.139 1.00 0.00 O ATOM 0 H ASP A 354 -7.084 7.201 1.306 1.00 0.00 H new ATOM 0 HA ASP A 354 -4.878 8.759 0.625 1.00 0.00 H new ATOM 0 HB2 ASP A 354 -6.903 9.665 1.634 1.00 0.00 H new ATOM 0 HB3 ASP A 354 -6.663 8.717 3.088 1.00 0.00 H new ATOM 525 N GLU A 355 -4.420 6.845 3.264 1.00 0.00 N ATOM 526 CA GLU A 355 -3.413 6.238 4.122 1.00 0.00 C ATOM 527 C GLU A 355 -2.378 5.483 3.289 1.00 0.00 C ATOM 528 O GLU A 355 -1.183 5.766 3.353 1.00 0.00 O ATOM 529 CB GLU A 355 -4.090 5.271 5.098 1.00 0.00 C ATOM 530 CG GLU A 355 -3.173 4.732 6.185 1.00 0.00 C ATOM 531 CD GLU A 355 -2.744 5.801 7.167 1.00 0.00 C ATOM 532 OE1 GLU A 355 -3.533 6.123 8.084 1.00 0.00 O ATOM 533 OE2 GLU A 355 -1.616 6.320 7.034 1.00 0.00 O ATOM 0 H GLU A 355 -5.366 6.496 3.420 1.00 0.00 H new ATOM 0 HA GLU A 355 -2.904 7.027 4.676 1.00 0.00 H new ATOM 0 HB2 GLU A 355 -4.932 5.779 5.569 1.00 0.00 H new ATOM 0 HB3 GLU A 355 -4.498 4.432 4.535 1.00 0.00 H new ATOM 0 HG2 GLU A 355 -3.684 3.933 6.723 1.00 0.00 H new ATOM 0 HG3 GLU A 355 -2.289 4.291 5.724 1.00 0.00 H new ATOM 540 N LEU A 356 -2.859 4.543 2.487 1.00 0.00 N ATOM 541 CA LEU A 356 -1.993 3.644 1.733 1.00 0.00 C ATOM 542 C LEU A 356 -1.166 4.380 0.679 1.00 0.00 C ATOM 543 O LEU A 356 -0.014 4.026 0.440 1.00 0.00 O ATOM 544 CB LEU A 356 -2.830 2.547 1.078 1.00 0.00 C ATOM 545 CG LEU A 356 -3.610 1.664 2.057 1.00 0.00 C ATOM 546 CD1 LEU A 356 -4.545 0.732 1.307 1.00 0.00 C ATOM 547 CD2 LEU A 356 -2.660 0.866 2.938 1.00 0.00 C ATOM 0 H LEU A 356 -3.855 4.382 2.340 1.00 0.00 H new ATOM 0 HA LEU A 356 -1.290 3.199 2.437 1.00 0.00 H new ATOM 0 HB2 LEU A 356 -3.535 3.010 0.388 1.00 0.00 H new ATOM 0 HB3 LEU A 356 -2.172 1.913 0.484 1.00 0.00 H new ATOM 0 HG LEU A 356 -4.208 2.313 2.697 1.00 0.00 H new ATOM 0 HD11 LEU A 356 -5.090 0.113 2.019 1.00 0.00 H new ATOM 0 HD12 LEU A 356 -5.252 1.320 0.721 1.00 0.00 H new ATOM 0 HD13 LEU A 356 -3.965 0.093 0.641 1.00 0.00 H new ATOM 0 HD21 LEU A 356 -3.235 0.246 3.625 1.00 0.00 H new ATOM 0 HD22 LEU A 356 -2.033 0.230 2.314 1.00 0.00 H new ATOM 0 HD23 LEU A 356 -2.030 1.550 3.507 1.00 0.00 H new ATOM 559 N SER A 357 -1.741 5.401 0.056 1.00 0.00 N ATOM 560 CA SER A 357 -1.031 6.159 -0.969 1.00 0.00 C ATOM 561 C SER A 357 0.178 6.879 -0.375 1.00 0.00 C ATOM 562 O SER A 357 1.279 6.825 -0.927 1.00 0.00 O ATOM 563 CB SER A 357 -1.973 7.160 -1.645 1.00 0.00 C ATOM 564 OG SER A 357 -2.640 7.963 -0.686 1.00 0.00 O ATOM 0 H SER A 357 -2.691 5.723 0.240 1.00 0.00 H new ATOM 0 HA SER A 357 -0.672 5.458 -1.722 1.00 0.00 H new ATOM 0 HB2 SER A 357 -1.406 7.796 -2.324 1.00 0.00 H new ATOM 0 HB3 SER A 357 -2.706 6.624 -2.248 1.00 0.00 H new ATOM 0 HG SER A 357 -3.389 7.461 -0.303 1.00 0.00 H new ATOM 570 N ARG A 358 -0.022 7.536 0.763 1.00 0.00 N ATOM 571 CA ARG A 358 1.069 8.227 1.437 1.00 0.00 C ATOM 572 C ARG A 358 2.008 7.222 2.094 1.00 0.00 C ATOM 573 O ARG A 358 3.189 7.501 2.295 1.00 0.00 O ATOM 574 CB ARG A 358 0.535 9.210 2.476 1.00 0.00 C ATOM 575 CG ARG A 358 1.625 10.028 3.150 1.00 0.00 C ATOM 576 CD ARG A 358 2.388 10.892 2.155 1.00 0.00 C ATOM 577 NE ARG A 358 3.548 11.541 2.770 1.00 0.00 N ATOM 578 CZ ARG A 358 4.360 12.386 2.131 1.00 0.00 C ATOM 579 NH1 ARG A 358 4.126 12.717 0.868 1.00 0.00 N ATOM 580 NH2 ARG A 358 5.407 12.904 2.760 1.00 0.00 N ATOM 0 H ARG A 358 -0.924 7.604 1.235 1.00 0.00 H new ATOM 0 HA ARG A 358 1.625 8.792 0.689 1.00 0.00 H new ATOM 0 HB2 ARG A 358 -0.172 9.886 1.996 1.00 0.00 H new ATOM 0 HB3 ARG A 358 -0.018 8.659 3.237 1.00 0.00 H new ATOM 0 HG2 ARG A 358 1.180 10.664 3.916 1.00 0.00 H new ATOM 0 HG3 ARG A 358 2.320 9.358 3.656 1.00 0.00 H new ATOM 0 HD2 ARG A 358 2.718 10.276 1.318 1.00 0.00 H new ATOM 0 HD3 ARG A 358 1.721 11.652 1.748 1.00 0.00 H new ATOM 0 HE ARG A 358 3.748 11.334 3.749 1.00 0.00 H new ATOM 0 HH11 ARG A 358 3.321 12.325 0.379 1.00 0.00 H new ATOM 0 HH12 ARG A 358 4.751 13.363 0.386 1.00 0.00 H new ATOM 0 HH21 ARG A 358 5.592 12.657 3.732 1.00 0.00 H new ATOM 0 HH22 ARG A 358 6.027 13.550 2.271 1.00 0.00 H new ATOM 594 N GLU A 359 1.480 6.054 2.428 1.00 0.00 N ATOM 595 CA GLU A 359 2.295 4.989 2.984 1.00 0.00 C ATOM 596 C GLU A 359 3.241 4.474 1.910 1.00 0.00 C ATOM 597 O GLU A 359 4.440 4.313 2.136 1.00 0.00 O ATOM 598 CB GLU A 359 1.417 3.848 3.496 1.00 0.00 C ATOM 599 CG GLU A 359 2.126 2.945 4.486 1.00 0.00 C ATOM 600 CD GLU A 359 2.413 3.653 5.791 1.00 0.00 C ATOM 601 OE1 GLU A 359 3.333 4.496 5.832 1.00 0.00 O ATOM 602 OE2 GLU A 359 1.710 3.378 6.783 1.00 0.00 O ATOM 0 H GLU A 359 0.492 5.822 2.323 1.00 0.00 H new ATOM 0 HA GLU A 359 2.868 5.381 3.824 1.00 0.00 H new ATOM 0 HB2 GLU A 359 0.528 4.266 3.968 1.00 0.00 H new ATOM 0 HB3 GLU A 359 1.077 3.252 2.649 1.00 0.00 H new ATOM 0 HG2 GLU A 359 1.513 2.065 4.678 1.00 0.00 H new ATOM 0 HG3 GLU A 359 3.061 2.593 4.051 1.00 0.00 H new ATOM 609 N LEU A 360 2.682 4.245 0.730 1.00 0.00 N ATOM 610 CA LEU A 360 3.452 3.827 -0.428 1.00 0.00 C ATOM 611 C LEU A 360 4.497 4.880 -0.771 1.00 0.00 C ATOM 612 O LEU A 360 5.614 4.553 -1.166 1.00 0.00 O ATOM 613 CB LEU A 360 2.521 3.603 -1.619 1.00 0.00 C ATOM 614 CG LEU A 360 3.196 3.105 -2.895 1.00 0.00 C ATOM 615 CD1 LEU A 360 3.707 1.686 -2.719 1.00 0.00 C ATOM 616 CD2 LEU A 360 2.236 3.191 -4.067 1.00 0.00 C ATOM 0 H LEU A 360 1.683 4.344 0.551 1.00 0.00 H new ATOM 0 HA LEU A 360 3.961 2.892 -0.195 1.00 0.00 H new ATOM 0 HB2 LEU A 360 1.755 2.884 -1.329 1.00 0.00 H new ATOM 0 HB3 LEU A 360 2.011 4.540 -1.841 1.00 0.00 H new ATOM 0 HG LEU A 360 4.053 3.746 -3.103 1.00 0.00 H new ATOM 0 HD11 LEU A 360 4.184 1.354 -3.641 1.00 0.00 H new ATOM 0 HD12 LEU A 360 4.432 1.659 -1.906 1.00 0.00 H new ATOM 0 HD13 LEU A 360 2.873 1.025 -2.484 1.00 0.00 H new ATOM 0 HD21 LEU A 360 2.731 2.833 -4.970 1.00 0.00 H new ATOM 0 HD22 LEU A 360 1.359 2.576 -3.865 1.00 0.00 H new ATOM 0 HD23 LEU A 360 1.927 4.227 -4.209 1.00 0.00 H new ATOM 628 N GLN A 361 4.121 6.144 -0.606 1.00 0.00 N ATOM 629 CA GLN A 361 5.030 7.259 -0.839 1.00 0.00 C ATOM 630 C GLN A 361 6.291 7.116 0.008 1.00 0.00 C ATOM 631 O GLN A 361 7.399 7.334 -0.481 1.00 0.00 O ATOM 632 CB GLN A 361 4.333 8.587 -0.526 1.00 0.00 C ATOM 633 CG GLN A 361 5.230 9.810 -0.675 1.00 0.00 C ATOM 634 CD GLN A 361 5.718 10.016 -2.097 1.00 0.00 C ATOM 635 OE1 GLN A 361 5.072 10.697 -2.893 1.00 0.00 O ATOM 636 NE2 GLN A 361 6.865 9.441 -2.416 1.00 0.00 N ATOM 0 H GLN A 361 3.186 6.422 -0.310 1.00 0.00 H new ATOM 0 HA GLN A 361 5.318 7.250 -1.890 1.00 0.00 H new ATOM 0 HB2 GLN A 361 3.473 8.698 -1.186 1.00 0.00 H new ATOM 0 HB3 GLN A 361 3.950 8.553 0.494 1.00 0.00 H new ATOM 0 HG2 GLN A 361 4.684 10.696 -0.352 1.00 0.00 H new ATOM 0 HG3 GLN A 361 6.090 9.706 -0.013 1.00 0.00 H new ATOM 0 HE21 GLN A 361 7.367 8.885 -1.724 1.00 0.00 H new ATOM 0 HE22 GLN A 361 7.248 9.553 -3.355 1.00 0.00 H new ATOM 645 N LYS A 362 6.118 6.733 1.271 1.00 0.00 N ATOM 646 CA LYS A 362 7.250 6.561 2.173 1.00 0.00 C ATOM 647 C LYS A 362 8.149 5.432 1.685 1.00 0.00 C ATOM 648 O LYS A 362 9.362 5.594 1.577 1.00 0.00 O ATOM 649 CB LYS A 362 6.786 6.243 3.598 1.00 0.00 C ATOM 650 CG LYS A 362 5.754 7.198 4.155 1.00 0.00 C ATOM 651 CD LYS A 362 5.576 6.970 5.643 1.00 0.00 C ATOM 652 CE LYS A 362 4.420 7.769 6.197 1.00 0.00 C ATOM 653 NZ LYS A 362 3.112 7.248 5.720 1.00 0.00 N ATOM 0 H LYS A 362 5.209 6.537 1.690 1.00 0.00 H new ATOM 0 HA LYS A 362 7.803 7.500 2.183 1.00 0.00 H new ATOM 0 HB2 LYS A 362 6.374 5.234 3.615 1.00 0.00 H new ATOM 0 HB3 LYS A 362 7.654 6.243 4.257 1.00 0.00 H new ATOM 0 HG2 LYS A 362 6.064 8.227 3.972 1.00 0.00 H new ATOM 0 HG3 LYS A 362 4.803 7.056 3.642 1.00 0.00 H new ATOM 0 HD2 LYS A 362 5.408 5.909 5.831 1.00 0.00 H new ATOM 0 HD3 LYS A 362 6.492 7.246 6.165 1.00 0.00 H new ATOM 0 HE2 LYS A 362 4.447 7.741 7.286 1.00 0.00 H new ATOM 0 HE3 LYS A 362 4.525 8.813 5.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 362 2.345 7.669 6.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 362 2.984 7.497 4.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 362 3.091 6.214 5.825 1.00 0.00 H new ATOM 667 N GLU A 363 7.536 4.296 1.377 1.00 0.00 N ATOM 668 CA GLU A 363 8.278 3.112 0.965 1.00 0.00 C ATOM 669 C GLU A 363 8.972 3.332 -0.380 1.00 0.00 C ATOM 670 O GLU A 363 10.125 2.943 -0.558 1.00 0.00 O ATOM 671 CB GLU A 363 7.350 1.898 0.887 1.00 0.00 C ATOM 672 CG GLU A 363 6.590 1.624 2.179 1.00 0.00 C ATOM 673 CD GLU A 363 7.498 1.509 3.389 1.00 0.00 C ATOM 674 OE1 GLU A 363 8.268 0.528 3.476 1.00 0.00 O ATOM 675 OE2 GLU A 363 7.436 2.394 4.268 1.00 0.00 O ATOM 0 H GLU A 363 6.524 4.170 1.405 1.00 0.00 H new ATOM 0 HA GLU A 363 9.045 2.923 1.716 1.00 0.00 H new ATOM 0 HB2 GLU A 363 6.634 2.051 0.080 1.00 0.00 H new ATOM 0 HB3 GLU A 363 7.939 1.018 0.628 1.00 0.00 H new ATOM 0 HG2 GLU A 363 5.870 2.425 2.347 1.00 0.00 H new ATOM 0 HG3 GLU A 363 6.021 0.701 2.070 1.00 0.00 H new ATOM 682 N MET A 364 8.275 3.960 -1.324 1.00 0.00 N ATOM 683 CA MET A 364 8.862 4.245 -2.632 1.00 0.00 C ATOM 684 C MET A 364 10.045 5.194 -2.491 1.00 0.00 C ATOM 685 O MET A 364 11.101 4.978 -3.090 1.00 0.00 O ATOM 686 CB MET A 364 7.827 4.839 -3.593 1.00 0.00 C ATOM 687 CG MET A 364 6.751 3.852 -4.024 1.00 0.00 C ATOM 688 SD MET A 364 5.674 4.504 -5.320 1.00 0.00 S ATOM 689 CE MET A 364 4.978 5.945 -4.514 1.00 0.00 C ATOM 0 H MET A 364 7.313 4.279 -1.211 1.00 0.00 H new ATOM 0 HA MET A 364 9.210 3.300 -3.049 1.00 0.00 H new ATOM 0 HB2 MET A 364 7.351 5.695 -3.115 1.00 0.00 H new ATOM 0 HB3 MET A 364 8.340 5.213 -4.479 1.00 0.00 H new ATOM 0 HG2 MET A 364 7.226 2.938 -4.380 1.00 0.00 H new ATOM 0 HG3 MET A 364 6.146 3.581 -3.159 1.00 0.00 H new ATOM 0 HE1 MET A 364 3.978 6.133 -4.905 1.00 0.00 H new ATOM 0 HE2 MET A 364 4.920 5.769 -3.440 1.00 0.00 H new ATOM 0 HE3 MET A 364 5.612 6.811 -4.706 1.00 0.00 H new ATOM 699 N ASP A 365 9.867 6.234 -1.681 1.00 0.00 N ATOM 700 CA ASP A 365 10.936 7.190 -1.408 1.00 0.00 C ATOM 701 C ASP A 365 12.104 6.476 -0.738 1.00 0.00 C ATOM 702 O ASP A 365 13.266 6.667 -1.107 1.00 0.00 O ATOM 703 CB ASP A 365 10.421 8.314 -0.500 1.00 0.00 C ATOM 704 CG ASP A 365 11.421 9.442 -0.310 1.00 0.00 C ATOM 705 OD1 ASP A 365 12.453 9.236 0.359 1.00 0.00 O ATOM 706 OD2 ASP A 365 11.164 10.557 -0.816 1.00 0.00 O ATOM 0 H ASP A 365 8.990 6.436 -1.201 1.00 0.00 H new ATOM 0 HA ASP A 365 11.272 7.625 -2.349 1.00 0.00 H new ATOM 0 HB2 ASP A 365 9.502 8.720 -0.923 1.00 0.00 H new ATOM 0 HB3 ASP A 365 10.166 7.896 0.474 1.00 0.00 H new ATOM 711 N GLN A 366 11.773 5.631 0.233 1.00 0.00 N ATOM 712 CA GLN A 366 12.770 4.885 0.984 1.00 0.00 C ATOM 713 C GLN A 366 13.561 3.948 0.076 1.00 0.00 C ATOM 714 O GLN A 366 14.778 3.867 0.188 1.00 0.00 O ATOM 715 CB GLN A 366 12.108 4.088 2.112 1.00 0.00 C ATOM 716 CG GLN A 366 13.100 3.439 3.067 1.00 0.00 C ATOM 717 CD GLN A 366 14.010 4.451 3.738 1.00 0.00 C ATOM 718 OE1 GLN A 366 13.626 5.600 3.962 1.00 0.00 O ATOM 719 NE2 GLN A 366 15.223 4.034 4.060 1.00 0.00 N ATOM 0 H GLN A 366 10.811 5.446 0.518 1.00 0.00 H new ATOM 0 HA GLN A 366 13.464 5.605 1.418 1.00 0.00 H new ATOM 0 HB2 GLN A 366 11.453 4.751 2.678 1.00 0.00 H new ATOM 0 HB3 GLN A 366 11.477 3.313 1.676 1.00 0.00 H new ATOM 0 HG2 GLN A 366 12.554 2.884 3.830 1.00 0.00 H new ATOM 0 HG3 GLN A 366 13.706 2.717 2.520 1.00 0.00 H new ATOM 0 HE21 GLN A 366 15.503 3.074 3.858 1.00 0.00 H new ATOM 0 HE22 GLN A 366 15.879 4.672 4.511 1.00 0.00 H new ATOM 728 N LYS A 367 12.878 3.247 -0.828 1.00 0.00 N ATOM 729 CA LYS A 367 13.563 2.333 -1.737 1.00 0.00 C ATOM 730 C LYS A 367 14.512 3.088 -2.651 1.00 0.00 C ATOM 731 O LYS A 367 15.638 2.652 -2.879 1.00 0.00 O ATOM 732 CB LYS A 367 12.581 1.514 -2.582 1.00 0.00 C ATOM 733 CG LYS A 367 13.285 0.624 -3.595 1.00 0.00 C ATOM 734 CD LYS A 367 12.350 -0.385 -4.234 1.00 0.00 C ATOM 735 CE LYS A 367 13.082 -1.223 -5.270 1.00 0.00 C ATOM 736 NZ LYS A 367 12.290 -2.403 -5.701 1.00 0.00 N ATOM 0 H LYS A 367 11.866 3.293 -0.949 1.00 0.00 H new ATOM 0 HA LYS A 367 14.132 1.642 -1.115 1.00 0.00 H new ATOM 0 HB2 LYS A 367 11.968 0.897 -1.925 1.00 0.00 H new ATOM 0 HB3 LYS A 367 11.905 2.190 -3.105 1.00 0.00 H new ATOM 0 HG2 LYS A 367 13.729 1.246 -4.373 1.00 0.00 H new ATOM 0 HG3 LYS A 367 14.102 0.096 -3.103 1.00 0.00 H new ATOM 0 HD2 LYS A 367 11.930 -1.034 -3.466 1.00 0.00 H new ATOM 0 HD3 LYS A 367 11.515 0.134 -4.704 1.00 0.00 H new ATOM 0 HE2 LYS A 367 13.311 -0.605 -6.138 1.00 0.00 H new ATOM 0 HE3 LYS A 367 14.034 -1.558 -4.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 367 12.729 -2.827 -6.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 367 12.265 -3.104 -4.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 367 11.320 -2.105 -5.929 1.00 0.00 H new ATOM 750 N ASP A 368 14.062 4.225 -3.161 1.00 0.00 N ATOM 751 CA ASP A 368 14.890 5.035 -4.043 1.00 0.00 C ATOM 752 C ASP A 368 16.118 5.527 -3.286 1.00 0.00 C ATOM 753 O ASP A 368 17.218 5.604 -3.835 1.00 0.00 O ATOM 754 CB ASP A 368 14.094 6.218 -4.594 1.00 0.00 C ATOM 755 CG ASP A 368 14.734 6.811 -5.831 1.00 0.00 C ATOM 756 OD1 ASP A 368 15.598 7.703 -5.698 1.00 0.00 O ATOM 757 OD2 ASP A 368 14.373 6.384 -6.951 1.00 0.00 O ATOM 0 H ASP A 368 13.133 4.606 -2.981 1.00 0.00 H new ATOM 0 HA ASP A 368 15.212 4.422 -4.885 1.00 0.00 H new ATOM 0 HB2 ASP A 368 13.081 5.893 -4.831 1.00 0.00 H new ATOM 0 HB3 ASP A 368 14.011 6.987 -3.826 1.00 0.00 H new ATOM 762 N ALA A 369 15.921 5.828 -2.007 1.00 0.00 N ATOM 763 CA ALA A 369 17.017 6.217 -1.133 1.00 0.00 C ATOM 764 C ALA A 369 17.935 5.030 -0.874 1.00 0.00 C ATOM 765 O ALA A 369 19.153 5.164 -0.902 1.00 0.00 O ATOM 766 CB ALA A 369 16.484 6.763 0.182 1.00 0.00 C ATOM 0 H ALA A 369 15.008 5.809 -1.553 1.00 0.00 H new ATOM 0 HA ALA A 369 17.589 7.002 -1.628 1.00 0.00 H new ATOM 0 HB1 ALA A 369 17.319 7.049 0.822 1.00 0.00 H new ATOM 0 HB2 ALA A 369 15.861 7.636 -0.012 1.00 0.00 H new ATOM 0 HB3 ALA A 369 15.890 5.997 0.680 1.00 0.00 H new ATOM 772 N LEU A 370 17.332 3.868 -0.633 1.00 0.00 N ATOM 773 CA LEU A 370 18.076 2.641 -0.368 1.00 0.00 C ATOM 774 C LEU A 370 18.921 2.231 -1.571 1.00 0.00 C ATOM 775 O LEU A 370 20.050 1.766 -1.414 1.00 0.00 O ATOM 776 CB LEU A 370 17.121 1.503 0.017 1.00 0.00 C ATOM 777 CG LEU A 370 16.433 1.649 1.375 1.00 0.00 C ATOM 778 CD1 LEU A 370 15.520 0.464 1.627 1.00 0.00 C ATOM 779 CD2 LEU A 370 17.460 1.776 2.492 1.00 0.00 C ATOM 0 H LEU A 370 16.319 3.752 -0.616 1.00 0.00 H new ATOM 0 HA LEU A 370 18.748 2.838 0.467 1.00 0.00 H new ATOM 0 HB2 LEU A 370 16.353 1.421 -0.752 1.00 0.00 H new ATOM 0 HB3 LEU A 370 17.679 0.567 0.011 1.00 0.00 H new ATOM 0 HG LEU A 370 15.833 2.559 1.362 1.00 0.00 H new ATOM 0 HD11 LEU A 370 15.035 0.578 2.597 1.00 0.00 H new ATOM 0 HD12 LEU A 370 14.762 0.416 0.845 1.00 0.00 H new ATOM 0 HD13 LEU A 370 16.106 -0.455 1.620 1.00 0.00 H new ATOM 0 HD21 LEU A 370 16.947 1.879 3.448 1.00 0.00 H new ATOM 0 HD22 LEU A 370 18.089 0.886 2.511 1.00 0.00 H new ATOM 0 HD23 LEU A 370 18.081 2.655 2.317 1.00 0.00 H new ATOM 791 N ASN A 371 18.370 2.404 -2.767 1.00 0.00 N ATOM 792 CA ASN A 371 19.101 2.114 -3.999 1.00 0.00 C ATOM 793 C ASN A 371 20.379 2.936 -4.067 1.00 0.00 C ATOM 794 O ASN A 371 21.464 2.410 -4.329 1.00 0.00 O ATOM 795 CB ASN A 371 18.242 2.415 -5.231 1.00 0.00 C ATOM 796 CG ASN A 371 17.091 1.444 -5.411 1.00 0.00 C ATOM 797 OD1 ASN A 371 17.172 0.282 -5.015 1.00 0.00 O ATOM 798 ND2 ASN A 371 16.013 1.915 -6.019 1.00 0.00 N ATOM 0 H ASN A 371 17.419 2.744 -2.912 1.00 0.00 H new ATOM 0 HA ASN A 371 19.351 1.053 -3.992 1.00 0.00 H new ATOM 0 HB2 ASN A 371 17.845 3.427 -5.150 1.00 0.00 H new ATOM 0 HB3 ASN A 371 18.872 2.390 -6.120 1.00 0.00 H new ATOM 0 HD21 ASN A 371 15.209 1.307 -6.174 1.00 0.00 H new ATOM 0 HD22 ASN A 371 15.987 2.885 -6.332 1.00 0.00 H new ATOM 805 N LYS A 372 20.238 4.230 -3.816 1.00 0.00 N ATOM 806 CA LYS A 372 21.366 5.146 -3.826 1.00 0.00 C ATOM 807 C LYS A 372 22.291 4.870 -2.646 1.00 0.00 C ATOM 808 O LYS A 372 23.512 4.878 -2.789 1.00 0.00 O ATOM 809 CB LYS A 372 20.853 6.584 -3.784 1.00 0.00 C ATOM 810 CG LYS A 372 21.947 7.637 -3.724 1.00 0.00 C ATOM 811 CD LYS A 372 21.375 9.041 -3.840 1.00 0.00 C ATOM 812 CE LYS A 372 20.324 9.313 -2.771 1.00 0.00 C ATOM 813 NZ LYS A 372 19.666 10.633 -2.959 1.00 0.00 N ATOM 0 H LYS A 372 19.344 4.671 -3.601 1.00 0.00 H new ATOM 0 HA LYS A 372 21.939 4.999 -4.742 1.00 0.00 H new ATOM 0 HB2 LYS A 372 20.239 6.764 -4.667 1.00 0.00 H new ATOM 0 HB3 LYS A 372 20.205 6.701 -2.916 1.00 0.00 H new ATOM 0 HG2 LYS A 372 22.494 7.542 -2.786 1.00 0.00 H new ATOM 0 HG3 LYS A 372 22.662 7.467 -4.529 1.00 0.00 H new ATOM 0 HD2 LYS A 372 22.180 9.770 -3.752 1.00 0.00 H new ATOM 0 HD3 LYS A 372 20.932 9.173 -4.827 1.00 0.00 H new ATOM 0 HE2 LYS A 372 19.570 8.526 -2.795 1.00 0.00 H new ATOM 0 HE3 LYS A 372 20.791 9.278 -1.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 372 18.958 10.778 -2.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 372 20.381 11.387 -2.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 372 19.198 10.659 -3.887 1.00 0.00 H new ATOM 827 N MET A 373 21.691 4.614 -1.488 1.00 0.00 N ATOM 828 CA MET A 373 22.432 4.287 -0.275 1.00 0.00 C ATOM 829 C MET A 373 23.344 3.090 -0.516 1.00 0.00 C ATOM 830 O MET A 373 24.538 3.140 -0.225 1.00 0.00 O ATOM 831 CB MET A 373 21.455 3.976 0.863 1.00 0.00 C ATOM 832 CG MET A 373 22.126 3.665 2.192 1.00 0.00 C ATOM 833 SD MET A 373 20.950 3.161 3.466 1.00 0.00 S ATOM 834 CE MET A 373 19.939 4.633 3.595 1.00 0.00 C ATOM 0 H MET A 373 20.679 4.627 -1.364 1.00 0.00 H new ATOM 0 HA MET A 373 23.046 5.144 0.002 1.00 0.00 H new ATOM 0 HB2 MET A 373 20.787 4.827 0.996 1.00 0.00 H new ATOM 0 HB3 MET A 373 20.836 3.127 0.574 1.00 0.00 H new ATOM 0 HG2 MET A 373 22.860 2.872 2.047 1.00 0.00 H new ATOM 0 HG3 MET A 373 22.671 4.545 2.534 1.00 0.00 H new ATOM 0 HE1 MET A 373 19.372 4.605 4.526 1.00 0.00 H new ATOM 0 HE2 MET A 373 20.579 5.516 3.586 1.00 0.00 H new ATOM 0 HE3 MET A 373 19.250 4.676 2.752 1.00 0.00 H new ATOM 844 N LYS A 374 22.773 2.026 -1.067 1.00 0.00 N ATOM 845 CA LYS A 374 23.527 0.819 -1.375 1.00 0.00 C ATOM 846 C LYS A 374 24.683 1.137 -2.313 1.00 0.00 C ATOM 847 O LYS A 374 25.805 0.684 -2.104 1.00 0.00 O ATOM 848 CB LYS A 374 22.619 -0.230 -2.017 1.00 0.00 C ATOM 849 CG LYS A 374 23.293 -1.580 -2.212 1.00 0.00 C ATOM 850 CD LYS A 374 22.489 -2.483 -3.135 1.00 0.00 C ATOM 851 CE LYS A 374 22.517 -1.976 -4.570 1.00 0.00 C ATOM 852 NZ LYS A 374 21.772 -2.871 -5.493 1.00 0.00 N ATOM 0 H LYS A 374 21.784 1.976 -1.311 1.00 0.00 H new ATOM 0 HA LYS A 374 23.926 0.421 -0.442 1.00 0.00 H new ATOM 0 HB2 LYS A 374 21.733 -0.362 -1.395 1.00 0.00 H new ATOM 0 HB3 LYS A 374 22.278 0.140 -2.984 1.00 0.00 H new ATOM 0 HG2 LYS A 374 24.290 -1.432 -2.626 1.00 0.00 H new ATOM 0 HG3 LYS A 374 23.418 -2.067 -1.245 1.00 0.00 H new ATOM 0 HD2 LYS A 374 22.891 -3.495 -3.097 1.00 0.00 H new ATOM 0 HD3 LYS A 374 21.458 -2.537 -2.786 1.00 0.00 H new ATOM 0 HE2 LYS A 374 22.086 -0.976 -4.609 1.00 0.00 H new ATOM 0 HE3 LYS A 374 23.551 -1.891 -4.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 374 21.817 -2.488 -6.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 374 22.198 -3.819 -5.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 374 20.779 -2.932 -5.191 1.00 0.00 H new ATOM 866 N ASP A 375 24.399 1.938 -3.336 1.00 0.00 N ATOM 867 CA ASP A 375 25.406 2.319 -4.323 1.00 0.00 C ATOM 868 C ASP A 375 26.566 3.059 -3.662 1.00 0.00 C ATOM 869 O ASP A 375 27.729 2.870 -4.030 1.00 0.00 O ATOM 870 CB ASP A 375 24.781 3.194 -5.411 1.00 0.00 C ATOM 871 CG ASP A 375 25.759 3.523 -6.521 1.00 0.00 C ATOM 872 OD1 ASP A 375 25.991 2.652 -7.388 1.00 0.00 O ATOM 873 OD2 ASP A 375 26.292 4.655 -6.535 1.00 0.00 O ATOM 0 H ASP A 375 23.476 2.338 -3.504 1.00 0.00 H new ATOM 0 HA ASP A 375 25.793 1.407 -4.778 1.00 0.00 H new ATOM 0 HB2 ASP A 375 23.916 2.682 -5.833 1.00 0.00 H new ATOM 0 HB3 ASP A 375 24.417 4.120 -4.965 1.00 0.00 H new ATOM 878 N VAL A 376 26.246 3.898 -2.683 1.00 0.00 N ATOM 879 CA VAL A 376 27.272 4.604 -1.928 1.00 0.00 C ATOM 880 C VAL A 376 28.120 3.615 -1.139 1.00 0.00 C ATOM 881 O VAL A 376 29.339 3.699 -1.149 1.00 0.00 O ATOM 882 CB VAL A 376 26.679 5.655 -0.962 1.00 0.00 C ATOM 883 CG1 VAL A 376 27.789 6.346 -0.178 1.00 0.00 C ATOM 884 CG2 VAL A 376 25.849 6.681 -1.724 1.00 0.00 C ATOM 0 H VAL A 376 25.289 4.104 -2.395 1.00 0.00 H new ATOM 0 HA VAL A 376 27.890 5.132 -2.654 1.00 0.00 H new ATOM 0 HB VAL A 376 26.025 5.140 -0.258 1.00 0.00 H new ATOM 0 HG11 VAL A 376 27.353 7.083 0.497 1.00 0.00 H new ATOM 0 HG12 VAL A 376 28.341 5.605 0.401 1.00 0.00 H new ATOM 0 HG13 VAL A 376 28.467 6.845 -0.870 1.00 0.00 H new ATOM 0 HG21 VAL A 376 25.441 7.411 -1.025 1.00 0.00 H new ATOM 0 HG22 VAL A 376 26.479 7.190 -2.453 1.00 0.00 H new ATOM 0 HG23 VAL A 376 25.032 6.177 -2.240 1.00 0.00 H new ATOM 894 N TYR A 377 27.464 2.663 -0.484 1.00 0.00 N ATOM 895 CA TYR A 377 28.159 1.646 0.305 1.00 0.00 C ATOM 896 C TYR A 377 29.056 0.765 -0.569 1.00 0.00 C ATOM 897 O TYR A 377 30.118 0.321 -0.133 1.00 0.00 O ATOM 898 CB TYR A 377 27.153 0.767 1.050 1.00 0.00 C ATOM 899 CG TYR A 377 26.606 1.369 2.329 1.00 0.00 C ATOM 900 CD1 TYR A 377 25.946 2.592 2.332 1.00 0.00 C ATOM 901 CD2 TYR A 377 26.742 0.698 3.536 1.00 0.00 C ATOM 902 CE1 TYR A 377 25.441 3.129 3.503 1.00 0.00 C ATOM 903 CE2 TYR A 377 26.238 1.224 4.707 1.00 0.00 C ATOM 904 CZ TYR A 377 25.587 2.439 4.688 1.00 0.00 C ATOM 905 OH TYR A 377 25.084 2.965 5.858 1.00 0.00 O ATOM 0 H TYR A 377 26.448 2.572 -0.483 1.00 0.00 H new ATOM 0 HA TYR A 377 28.789 2.170 1.023 1.00 0.00 H new ATOM 0 HB2 TYR A 377 26.319 0.548 0.383 1.00 0.00 H new ATOM 0 HB3 TYR A 377 27.629 -0.184 1.288 1.00 0.00 H new ATOM 0 HD1 TYR A 377 25.825 3.132 1.405 1.00 0.00 H new ATOM 0 HD2 TYR A 377 27.252 -0.254 3.559 1.00 0.00 H new ATOM 0 HE1 TYR A 377 24.935 4.083 3.489 1.00 0.00 H new ATOM 0 HE2 TYR A 377 26.353 0.686 5.636 1.00 0.00 H new ATOM 0 HH TYR A 377 25.271 2.352 6.599 1.00 0.00 H new ATOM 915 N GLU A 378 28.617 0.499 -1.793 1.00 0.00 N ATOM 916 CA GLU A 378 29.385 -0.333 -2.715 1.00 0.00 C ATOM 917 C GLU A 378 30.640 0.384 -3.185 1.00 0.00 C ATOM 918 O GLU A 378 31.747 -0.143 -3.066 1.00 0.00 O ATOM 919 CB GLU A 378 28.539 -0.729 -3.928 1.00 0.00 C ATOM 920 CG GLU A 378 27.304 -1.539 -3.580 1.00 0.00 C ATOM 921 CD GLU A 378 26.433 -1.816 -4.785 1.00 0.00 C ATOM 922 OE1 GLU A 378 26.087 -0.857 -5.503 1.00 0.00 O ATOM 923 OE2 GLU A 378 26.075 -2.990 -5.015 1.00 0.00 O ATOM 0 H GLU A 378 27.735 0.846 -2.171 1.00 0.00 H new ATOM 0 HA GLU A 378 29.676 -1.234 -2.174 1.00 0.00 H new ATOM 0 HB2 GLU A 378 28.232 0.175 -4.455 1.00 0.00 H new ATOM 0 HB3 GLU A 378 29.157 -1.305 -4.617 1.00 0.00 H new ATOM 0 HG2 GLU A 378 27.608 -2.484 -3.131 1.00 0.00 H new ATOM 0 HG3 GLU A 378 26.722 -1.003 -2.830 1.00 0.00 H new ATOM 930 N LYS A 379 30.469 1.589 -3.705 1.00 0.00 N ATOM 931 CA LYS A 379 31.587 2.340 -4.256 1.00 0.00 C ATOM 932 C LYS A 379 32.402 2.994 -3.148 1.00 0.00 C ATOM 933 O LYS A 379 33.566 3.342 -3.345 1.00 0.00 O ATOM 934 CB LYS A 379 31.085 3.393 -5.246 1.00 0.00 C ATOM 935 CG LYS A 379 30.245 2.807 -6.368 1.00 0.00 C ATOM 936 CD LYS A 379 29.944 3.835 -7.445 1.00 0.00 C ATOM 937 CE LYS A 379 29.103 3.240 -8.563 1.00 0.00 C ATOM 938 NZ LYS A 379 29.731 2.024 -9.149 1.00 0.00 N ATOM 0 H LYS A 379 29.570 2.067 -3.757 1.00 0.00 H new ATOM 0 HA LYS A 379 32.236 1.644 -4.787 1.00 0.00 H new ATOM 0 HB2 LYS A 379 30.495 4.135 -4.709 1.00 0.00 H new ATOM 0 HB3 LYS A 379 31.940 3.915 -5.676 1.00 0.00 H new ATOM 0 HG2 LYS A 379 30.770 1.960 -6.811 1.00 0.00 H new ATOM 0 HG3 LYS A 379 29.310 2.424 -5.960 1.00 0.00 H new ATOM 0 HD2 LYS A 379 29.418 4.682 -7.004 1.00 0.00 H new ATOM 0 HD3 LYS A 379 30.878 4.218 -7.855 1.00 0.00 H new ATOM 0 HE2 LYS A 379 28.115 2.988 -8.178 1.00 0.00 H new ATOM 0 HE3 LYS A 379 28.960 3.986 -9.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 379 29.250 1.779 -10.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 379 30.736 2.210 -9.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 379 29.646 1.232 -8.480 1.00 0.00 H new ATOM 952 N ASN A 380 31.788 3.161 -1.986 1.00 0.00 N ATOM 953 CA ASN A 380 32.462 3.752 -0.837 1.00 0.00 C ATOM 954 C ASN A 380 32.128 2.982 0.439 1.00 0.00 C ATOM 955 O ASN A 380 31.190 3.333 1.160 1.00 0.00 O ATOM 956 CB ASN A 380 32.070 5.225 -0.661 1.00 0.00 C ATOM 957 CG ASN A 380 32.448 6.089 -1.847 1.00 0.00 C ATOM 958 OD1 ASN A 380 33.551 6.635 -1.909 1.00 0.00 O ATOM 959 ND2 ASN A 380 31.529 6.234 -2.790 1.00 0.00 N ATOM 0 H ASN A 380 30.819 2.894 -1.813 1.00 0.00 H new ATOM 0 HA ASN A 380 33.535 3.694 -1.022 1.00 0.00 H new ATOM 0 HB2 ASN A 380 30.994 5.291 -0.500 1.00 0.00 H new ATOM 0 HB3 ASN A 380 32.551 5.618 0.235 1.00 0.00 H new ATOM 0 HD21 ASN A 380 31.722 6.815 -3.606 1.00 0.00 H new ATOM 0 HD22 ASN A 380 30.628 5.764 -2.700 1.00 0.00 H new ATOM 966 N PRO A 381 32.886 1.904 0.718 1.00 0.00 N ATOM 967 CA PRO A 381 32.780 1.130 1.970 1.00 0.00 C ATOM 968 C PRO A 381 32.905 1.980 3.244 1.00 0.00 C ATOM 969 O PRO A 381 32.772 1.461 4.352 1.00 0.00 O ATOM 970 CB PRO A 381 33.961 0.163 1.889 1.00 0.00 C ATOM 971 CG PRO A 381 34.246 0.011 0.437 1.00 0.00 C ATOM 972 CD PRO A 381 33.864 1.311 -0.212 1.00 0.00 C ATOM 0 HA PRO A 381 31.800 0.659 2.047 1.00 0.00 H new ATOM 0 HB2 PRO A 381 34.828 0.556 2.421 1.00 0.00 H new ATOM 0 HB3 PRO A 381 33.715 -0.797 2.344 1.00 0.00 H new ATOM 0 HG2 PRO A 381 35.300 -0.211 0.270 1.00 0.00 H new ATOM 0 HG3 PRO A 381 33.675 -0.816 0.014 1.00 0.00 H new ATOM 0 HD2 PRO A 381 34.730 1.959 -0.346 1.00 0.00 H new ATOM 0 HD3 PRO A 381 33.429 1.151 -1.199 1.00 0.00 H new ATOM 980 N GLN A 382 33.164 3.274 3.077 1.00 0.00 N ATOM 981 CA GLN A 382 33.308 4.211 4.193 1.00 0.00 C ATOM 982 C GLN A 382 32.104 4.183 5.139 1.00 0.00 C ATOM 983 O GLN A 382 32.234 4.497 6.323 1.00 0.00 O ATOM 984 CB GLN A 382 33.488 5.632 3.659 1.00 0.00 C ATOM 985 CG GLN A 382 32.259 6.157 2.952 1.00 0.00 C ATOM 986 CD GLN A 382 32.404 7.591 2.488 1.00 0.00 C ATOM 987 OE1 GLN A 382 33.117 8.386 3.099 1.00 0.00 O ATOM 988 NE2 GLN A 382 31.717 7.936 1.411 1.00 0.00 N ATOM 0 H GLN A 382 33.281 3.706 2.161 1.00 0.00 H new ATOM 0 HA GLN A 382 34.186 3.900 4.759 1.00 0.00 H new ATOM 0 HB2 GLN A 382 33.736 6.297 4.487 1.00 0.00 H new ATOM 0 HB3 GLN A 382 34.333 5.651 2.970 1.00 0.00 H new ATOM 0 HG2 GLN A 382 32.045 5.523 2.091 1.00 0.00 H new ATOM 0 HG3 GLN A 382 31.403 6.084 3.623 1.00 0.00 H new ATOM 0 HE21 GLN A 382 31.137 7.246 0.933 1.00 0.00 H new ATOM 0 HE22 GLN A 382 31.767 8.892 1.059 1.00 0.00 H new ATOM 997 N MET A 383 30.935 3.823 4.616 1.00 0.00 N ATOM 998 CA MET A 383 29.713 3.848 5.411 1.00 0.00 C ATOM 999 C MET A 383 29.380 2.470 5.976 1.00 0.00 C ATOM 1000 O MET A 383 28.516 2.341 6.846 1.00 0.00 O ATOM 1001 CB MET A 383 28.535 4.366 4.582 1.00 0.00 C ATOM 1002 CG MET A 383 28.678 5.815 4.146 1.00 0.00 C ATOM 1003 SD MET A 383 27.189 6.449 3.352 1.00 0.00 S ATOM 1004 CE MET A 383 27.663 8.151 3.051 1.00 0.00 C ATOM 0 H MET A 383 30.809 3.513 3.652 1.00 0.00 H new ATOM 0 HA MET A 383 29.887 4.526 6.246 1.00 0.00 H new ATOM 0 HB2 MET A 383 28.423 3.740 3.697 1.00 0.00 H new ATOM 0 HB3 MET A 383 27.620 4.261 5.164 1.00 0.00 H new ATOM 0 HG2 MET A 383 28.913 6.431 5.014 1.00 0.00 H new ATOM 0 HG3 MET A 383 29.518 5.902 3.457 1.00 0.00 H new ATOM 0 HE1 MET A 383 26.842 8.676 2.562 1.00 0.00 H new ATOM 0 HE2 MET A 383 27.892 8.638 3.999 1.00 0.00 H new ATOM 0 HE3 MET A 383 28.543 8.175 2.408 1.00 0.00 H new ATOM 1014 N GLY A 384 30.063 1.444 5.490 1.00 0.00 N ATOM 1015 CA GLY A 384 29.809 0.101 5.969 1.00 0.00 C ATOM 1016 C GLY A 384 29.681 -0.908 4.848 1.00 0.00 C ATOM 1017 O GLY A 384 30.367 -0.805 3.827 1.00 0.00 O ATOM 0 H GLY A 384 30.786 1.517 4.775 1.00 0.00 H new ATOM 0 HA2 GLY A 384 30.618 -0.202 6.633 1.00 0.00 H new ATOM 0 HA3 GLY A 384 28.893 0.098 6.560 1.00 0.00 H new ATOM 1021 N ASP A 385 28.798 -1.877 5.037 1.00 0.00 N ATOM 1022 CA ASP A 385 28.613 -2.962 4.081 1.00 0.00 C ATOM 1023 C ASP A 385 27.300 -2.814 3.320 1.00 0.00 C ATOM 1024 O ASP A 385 26.231 -2.694 3.920 1.00 0.00 O ATOM 1025 CB ASP A 385 28.646 -4.309 4.805 1.00 0.00 C ATOM 1026 CG ASP A 385 28.188 -5.455 3.929 1.00 0.00 C ATOM 1027 OD1 ASP A 385 28.908 -5.812 2.976 1.00 0.00 O ATOM 1028 OD2 ASP A 385 27.102 -6.009 4.195 1.00 0.00 O ATOM 0 H ASP A 385 28.190 -1.935 5.854 1.00 0.00 H new ATOM 0 HA ASP A 385 29.429 -2.917 3.360 1.00 0.00 H new ATOM 0 HB2 ASP A 385 29.660 -4.505 5.152 1.00 0.00 H new ATOM 0 HB3 ASP A 385 28.011 -4.257 5.689 1.00 0.00 H new ATOM 1033 N PRO A 386 27.369 -2.825 1.978 1.00 0.00 N ATOM 1034 CA PRO A 386 26.190 -2.674 1.116 1.00 0.00 C ATOM 1035 C PRO A 386 25.270 -3.891 1.150 1.00 0.00 C ATOM 1036 O PRO A 386 24.071 -3.783 0.890 1.00 0.00 O ATOM 1037 CB PRO A 386 26.790 -2.502 -0.280 1.00 0.00 C ATOM 1038 CG PRO A 386 28.117 -3.175 -0.212 1.00 0.00 C ATOM 1039 CD PRO A 386 28.612 -2.976 1.193 1.00 0.00 C ATOM 0 HA PRO A 386 25.564 -1.841 1.437 1.00 0.00 H new ATOM 0 HB2 PRO A 386 26.155 -2.956 -1.041 1.00 0.00 H new ATOM 0 HB3 PRO A 386 26.894 -1.448 -0.538 1.00 0.00 H new ATOM 0 HG2 PRO A 386 28.029 -4.236 -0.448 1.00 0.00 H new ATOM 0 HG3 PRO A 386 28.810 -2.744 -0.934 1.00 0.00 H new ATOM 0 HD2 PRO A 386 29.202 -3.826 1.535 1.00 0.00 H new ATOM 0 HD3 PRO A 386 29.247 -2.094 1.274 1.00 0.00 H new ATOM 1047 N SER A 387 25.829 -5.046 1.485 1.00 0.00 N ATOM 1048 CA SER A 387 25.061 -6.278 1.515 1.00 0.00 C ATOM 1049 C SER A 387 24.088 -6.261 2.692 1.00 0.00 C ATOM 1050 O SER A 387 23.014 -6.862 2.642 1.00 0.00 O ATOM 1051 CB SER A 387 25.998 -7.487 1.598 1.00 0.00 C ATOM 1052 OG SER A 387 25.313 -8.690 1.296 1.00 0.00 O ATOM 0 H SER A 387 26.811 -5.153 1.739 1.00 0.00 H new ATOM 0 HA SER A 387 24.484 -6.359 0.594 1.00 0.00 H new ATOM 0 HB2 SER A 387 26.828 -7.355 0.904 1.00 0.00 H new ATOM 0 HB3 SER A 387 26.426 -7.551 2.599 1.00 0.00 H new ATOM 0 HG SER A 387 24.458 -8.480 0.866 1.00 0.00 H new ATOM 1058 N SER A 388 24.459 -5.533 3.736 1.00 0.00 N ATOM 1059 CA SER A 388 23.620 -5.384 4.918 1.00 0.00 C ATOM 1060 C SER A 388 22.393 -4.525 4.612 1.00 0.00 C ATOM 1061 O SER A 388 21.442 -4.472 5.391 1.00 0.00 O ATOM 1062 CB SER A 388 24.437 -4.767 6.054 1.00 0.00 C ATOM 1063 OG SER A 388 25.610 -5.530 6.305 1.00 0.00 O ATOM 0 H SER A 388 25.345 -5.031 3.788 1.00 0.00 H new ATOM 0 HA SER A 388 23.269 -6.369 5.225 1.00 0.00 H new ATOM 0 HB2 SER A 388 24.711 -3.744 5.796 1.00 0.00 H new ATOM 0 HB3 SER A 388 23.830 -4.716 6.958 1.00 0.00 H new ATOM 0 HG SER A 388 26.165 -5.553 5.497 1.00 0.00 H new ATOM 1069 N LEU A 389 22.415 -3.855 3.468 1.00 0.00 N ATOM 1070 CA LEU A 389 21.301 -3.015 3.059 1.00 0.00 C ATOM 1071 C LEU A 389 20.343 -3.784 2.158 1.00 0.00 C ATOM 1072 O LEU A 389 19.308 -3.262 1.745 1.00 0.00 O ATOM 1073 CB LEU A 389 21.812 -1.772 2.337 1.00 0.00 C ATOM 1074 CG LEU A 389 22.725 -0.872 3.169 1.00 0.00 C ATOM 1075 CD1 LEU A 389 23.236 0.276 2.323 1.00 0.00 C ATOM 1076 CD2 LEU A 389 21.994 -0.349 4.396 1.00 0.00 C ATOM 0 H LEU A 389 23.192 -3.878 2.808 1.00 0.00 H new ATOM 0 HA LEU A 389 20.761 -2.709 3.955 1.00 0.00 H new ATOM 0 HB2 LEU A 389 22.352 -2.085 1.443 1.00 0.00 H new ATOM 0 HB3 LEU A 389 20.956 -1.186 2.003 1.00 0.00 H new ATOM 0 HG LEU A 389 23.576 -1.461 3.509 1.00 0.00 H new ATOM 0 HD11 LEU A 389 23.885 0.911 2.926 1.00 0.00 H new ATOM 0 HD12 LEU A 389 23.798 -0.118 1.476 1.00 0.00 H new ATOM 0 HD13 LEU A 389 22.393 0.862 1.958 1.00 0.00 H new ATOM 0 HD21 LEU A 389 22.663 0.289 4.973 1.00 0.00 H new ATOM 0 HD22 LEU A 389 21.123 0.227 4.083 1.00 0.00 H new ATOM 0 HD23 LEU A 389 21.671 -1.188 5.012 1.00 0.00 H new ATOM 1088 N HIS A 390 20.686 -5.032 1.862 1.00 0.00 N ATOM 1089 CA HIS A 390 19.836 -5.871 1.024 1.00 0.00 C ATOM 1090 C HIS A 390 18.505 -6.189 1.721 1.00 0.00 C ATOM 1091 O HIS A 390 17.448 -6.030 1.114 1.00 0.00 O ATOM 1092 CB HIS A 390 20.557 -7.158 0.606 1.00 0.00 C ATOM 1093 CG HIS A 390 21.714 -6.930 -0.323 1.00 0.00 C ATOM 1094 ND1 HIS A 390 22.729 -7.845 -0.502 1.00 0.00 N ATOM 1095 CD2 HIS A 390 22.007 -5.886 -1.139 1.00 0.00 C ATOM 1096 CE1 HIS A 390 23.594 -7.377 -1.382 1.00 0.00 C ATOM 1097 NE2 HIS A 390 23.180 -6.191 -1.781 1.00 0.00 N ATOM 0 H HIS A 390 21.541 -5.484 2.187 1.00 0.00 H new ATOM 0 HA HIS A 390 19.613 -5.306 0.119 1.00 0.00 H new ATOM 0 HB2 HIS A 390 20.916 -7.669 1.499 1.00 0.00 H new ATOM 0 HB3 HIS A 390 19.842 -7.824 0.124 1.00 0.00 H new ATOM 0 HD2 HIS A 390 21.425 -4.984 -1.260 1.00 0.00 H new ATOM 0 HE1 HIS A 390 24.489 -7.880 -1.718 1.00 0.00 H new ATOM 0 HE2 HIS A 390 23.656 -5.595 -2.459 1.00 0.00 H new ATOM 1106 N PRO A 391 18.516 -6.634 3.006 1.00 0.00 N ATOM 1107 CA PRO A 391 17.275 -6.849 3.766 1.00 0.00 C ATOM 1108 C PRO A 391 16.432 -5.578 3.861 1.00 0.00 C ATOM 1109 O PRO A 391 15.203 -5.640 3.951 1.00 0.00 O ATOM 1110 CB PRO A 391 17.756 -7.278 5.161 1.00 0.00 C ATOM 1111 CG PRO A 391 19.197 -6.905 5.215 1.00 0.00 C ATOM 1112 CD PRO A 391 19.700 -6.996 3.806 1.00 0.00 C ATOM 0 HA PRO A 391 16.634 -7.589 3.286 1.00 0.00 H new ATOM 0 HB2 PRO A 391 17.190 -6.773 5.944 1.00 0.00 H new ATOM 0 HB3 PRO A 391 17.622 -8.349 5.311 1.00 0.00 H new ATOM 0 HG2 PRO A 391 19.325 -5.897 5.611 1.00 0.00 H new ATOM 0 HG3 PRO A 391 19.750 -7.577 5.871 1.00 0.00 H new ATOM 0 HD2 PRO A 391 20.531 -6.313 3.629 1.00 0.00 H new ATOM 0 HD3 PRO A 391 20.056 -7.999 3.569 1.00 0.00 H new ATOM 1120 N LYS A 392 17.103 -4.430 3.832 1.00 0.00 N ATOM 1121 CA LYS A 392 16.426 -3.138 3.825 1.00 0.00 C ATOM 1122 C LYS A 392 15.605 -2.983 2.554 1.00 0.00 C ATOM 1123 O LYS A 392 14.402 -2.720 2.606 1.00 0.00 O ATOM 1124 CB LYS A 392 17.446 -2.000 3.922 1.00 0.00 C ATOM 1125 CG LYS A 392 18.112 -1.880 5.280 1.00 0.00 C ATOM 1126 CD LYS A 392 17.130 -1.391 6.329 1.00 0.00 C ATOM 1127 CE LYS A 392 17.807 -1.157 7.667 1.00 0.00 C ATOM 1128 NZ LYS A 392 16.857 -0.630 8.682 1.00 0.00 N ATOM 0 H LYS A 392 18.121 -4.369 3.813 1.00 0.00 H new ATOM 0 HA LYS A 392 15.762 -3.092 4.688 1.00 0.00 H new ATOM 0 HB2 LYS A 392 18.215 -2.150 3.164 1.00 0.00 H new ATOM 0 HB3 LYS A 392 16.948 -1.059 3.689 1.00 0.00 H new ATOM 0 HG2 LYS A 392 18.515 -2.848 5.578 1.00 0.00 H new ATOM 0 HG3 LYS A 392 18.954 -1.191 5.216 1.00 0.00 H new ATOM 0 HD2 LYS A 392 16.666 -0.465 5.989 1.00 0.00 H new ATOM 0 HD3 LYS A 392 16.331 -2.123 6.449 1.00 0.00 H new ATOM 0 HE2 LYS A 392 18.239 -2.092 8.024 1.00 0.00 H new ATOM 0 HE3 LYS A 392 18.630 -0.454 7.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 17.357 -0.483 9.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 16.464 0.275 8.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 16.085 -1.312 8.822 1.00 0.00 H new ATOM 1142 N ILE A 393 16.262 -3.160 1.415 1.00 0.00 N ATOM 1143 CA ILE A 393 15.598 -3.062 0.123 1.00 0.00 C ATOM 1144 C ILE A 393 14.533 -4.146 -0.009 1.00 0.00 C ATOM 1145 O ILE A 393 13.475 -3.924 -0.602 1.00 0.00 O ATOM 1146 CB ILE A 393 16.612 -3.182 -1.038 1.00 0.00 C ATOM 1147 CG1 ILE A 393 17.703 -2.114 -0.900 1.00 0.00 C ATOM 1148 CG2 ILE A 393 15.909 -3.053 -2.383 1.00 0.00 C ATOM 1149 CD1 ILE A 393 18.798 -2.217 -1.942 1.00 0.00 C ATOM 0 H ILE A 393 17.258 -3.373 1.361 1.00 0.00 H new ATOM 0 HA ILE A 393 15.124 -2.082 0.066 1.00 0.00 H new ATOM 0 HB ILE A 393 17.077 -4.167 -0.990 1.00 0.00 H new ATOM 0 HG12 ILE A 393 17.243 -1.128 -0.967 1.00 0.00 H new ATOM 0 HG13 ILE A 393 18.150 -2.191 0.091 1.00 0.00 H new ATOM 0 HG21 ILE A 393 16.641 -3.140 -3.186 1.00 0.00 H new ATOM 0 HG22 ILE A 393 15.165 -3.844 -2.482 1.00 0.00 H new ATOM 0 HG23 ILE A 393 15.417 -2.082 -2.445 1.00 0.00 H new ATOM 0 HD11 ILE A 393 19.532 -1.428 -1.778 1.00 0.00 H new ATOM 0 HD12 ILE A 393 19.286 -3.188 -1.862 1.00 0.00 H new ATOM 0 HD13 ILE A 393 18.365 -2.109 -2.937 1.00 0.00 H new ATOM 1161 N ALA A 394 14.816 -5.309 0.568 1.00 0.00 N ATOM 1162 CA ALA A 394 13.900 -6.442 0.532 1.00 0.00 C ATOM 1163 C ALA A 394 12.533 -6.085 1.114 1.00 0.00 C ATOM 1164 O ALA A 394 11.518 -6.178 0.422 1.00 0.00 O ATOM 1165 CB ALA A 394 14.498 -7.625 1.276 1.00 0.00 C ATOM 0 H ALA A 394 15.684 -5.492 1.072 1.00 0.00 H new ATOM 0 HA ALA A 394 13.751 -6.714 -0.513 1.00 0.00 H new ATOM 0 HB1 ALA A 394 13.804 -8.465 1.242 1.00 0.00 H new ATOM 0 HB2 ALA A 394 15.439 -7.912 0.806 1.00 0.00 H new ATOM 0 HB3 ALA A 394 14.681 -7.347 2.314 1.00 0.00 H new ATOM 1171 N GLU A 395 12.504 -5.656 2.373 1.00 0.00 N ATOM 1172 CA GLU A 395 11.238 -5.348 3.033 1.00 0.00 C ATOM 1173 C GLU A 395 10.585 -4.120 2.410 1.00 0.00 C ATOM 1174 O GLU A 395 9.370 -4.078 2.230 1.00 0.00 O ATOM 1175 CB GLU A 395 11.432 -5.137 4.538 1.00 0.00 C ATOM 1176 CG GLU A 395 12.389 -4.012 4.893 1.00 0.00 C ATOM 1177 CD GLU A 395 12.413 -3.720 6.377 1.00 0.00 C ATOM 1178 OE1 GLU A 395 13.193 -4.368 7.103 1.00 0.00 O ATOM 1179 OE2 GLU A 395 11.652 -2.837 6.826 1.00 0.00 O ATOM 0 H GLU A 395 13.332 -5.515 2.951 1.00 0.00 H new ATOM 0 HA GLU A 395 10.578 -6.204 2.891 1.00 0.00 H new ATOM 0 HB2 GLU A 395 10.463 -4.931 4.992 1.00 0.00 H new ATOM 0 HB3 GLU A 395 11.800 -6.064 4.979 1.00 0.00 H new ATOM 0 HG2 GLU A 395 13.393 -4.275 4.561 1.00 0.00 H new ATOM 0 HG3 GLU A 395 12.101 -3.110 4.353 1.00 0.00 H new ATOM 1186 N THR A 396 11.404 -3.139 2.060 1.00 0.00 N ATOM 1187 CA THR A 396 10.923 -1.905 1.467 1.00 0.00 C ATOM 1188 C THR A 396 10.204 -2.190 0.147 1.00 0.00 C ATOM 1189 O THR A 396 9.109 -1.682 -0.095 1.00 0.00 O ATOM 1190 CB THR A 396 12.100 -0.932 1.263 1.00 0.00 C ATOM 1191 OG1 THR A 396 12.712 -0.667 2.532 1.00 0.00 O ATOM 1192 CG2 THR A 396 11.661 0.380 0.641 1.00 0.00 C ATOM 0 H THR A 396 12.416 -3.178 2.179 1.00 0.00 H new ATOM 0 HA THR A 396 10.204 -1.439 2.141 1.00 0.00 H new ATOM 0 HB THR A 396 12.806 -1.403 0.579 1.00 0.00 H new ATOM 0 HG1 THR A 396 13.496 -1.244 2.644 1.00 0.00 H new ATOM 0 HG21 THR A 396 12.526 1.032 0.518 1.00 0.00 H new ATOM 0 HG22 THR A 396 11.209 0.188 -0.332 1.00 0.00 H new ATOM 0 HG23 THR A 396 10.932 0.864 1.290 1.00 0.00 H new ATOM 1200 N THR A 397 10.802 -3.041 -0.681 1.00 0.00 N ATOM 1201 CA THR A 397 10.180 -3.459 -1.930 1.00 0.00 C ATOM 1202 C THR A 397 8.903 -4.255 -1.661 1.00 0.00 C ATOM 1203 O THR A 397 7.882 -4.054 -2.317 1.00 0.00 O ATOM 1204 CB THR A 397 11.148 -4.315 -2.770 1.00 0.00 C ATOM 1205 OG1 THR A 397 12.336 -3.565 -3.059 1.00 0.00 O ATOM 1206 CG2 THR A 397 10.501 -4.765 -4.070 1.00 0.00 C ATOM 0 H THR A 397 11.718 -3.455 -0.508 1.00 0.00 H new ATOM 0 HA THR A 397 9.929 -2.557 -2.488 1.00 0.00 H new ATOM 0 HB THR A 397 11.404 -5.202 -2.190 1.00 0.00 H new ATOM 0 HG1 THR A 397 12.927 -3.574 -2.277 1.00 0.00 H new ATOM 0 HG21 THR A 397 11.209 -5.367 -4.640 1.00 0.00 H new ATOM 0 HG22 THR A 397 9.615 -5.360 -3.849 1.00 0.00 H new ATOM 0 HG23 THR A 397 10.214 -3.891 -4.655 1.00 0.00 H new ATOM 1214 N SER A 398 8.967 -5.140 -0.671 1.00 0.00 N ATOM 1215 CA SER A 398 7.838 -5.995 -0.328 1.00 0.00 C ATOM 1216 C SER A 398 6.626 -5.163 0.091 1.00 0.00 C ATOM 1217 O SER A 398 5.484 -5.508 -0.225 1.00 0.00 O ATOM 1218 CB SER A 398 8.237 -6.961 0.790 1.00 0.00 C ATOM 1219 OG SER A 398 9.379 -7.719 0.419 1.00 0.00 O ATOM 0 H SER A 398 9.793 -5.283 -0.090 1.00 0.00 H new ATOM 0 HA SER A 398 7.559 -6.569 -1.212 1.00 0.00 H new ATOM 0 HB2 SER A 398 8.447 -6.402 1.702 1.00 0.00 H new ATOM 0 HB3 SER A 398 7.406 -7.631 1.011 1.00 0.00 H new ATOM 0 HG SER A 398 10.183 -7.166 0.513 1.00 0.00 H new ATOM 1225 N ASN A 399 6.881 -4.062 0.792 1.00 0.00 N ATOM 1226 CA ASN A 399 5.814 -3.160 1.207 1.00 0.00 C ATOM 1227 C ASN A 399 5.216 -2.461 -0.001 1.00 0.00 C ATOM 1228 O ASN A 399 4.000 -2.325 -0.110 1.00 0.00 O ATOM 1229 CB ASN A 399 6.324 -2.119 2.207 1.00 0.00 C ATOM 1230 CG ASN A 399 6.831 -2.740 3.491 1.00 0.00 C ATOM 1231 OD1 ASN A 399 6.408 -3.830 3.880 1.00 0.00 O ATOM 1232 ND2 ASN A 399 7.725 -2.043 4.167 1.00 0.00 N ATOM 0 H ASN A 399 7.815 -3.774 1.083 1.00 0.00 H new ATOM 0 HA ASN A 399 5.045 -3.757 1.696 1.00 0.00 H new ATOM 0 HB2 ASN A 399 7.126 -1.541 1.747 1.00 0.00 H new ATOM 0 HB3 ASN A 399 5.520 -1.420 2.439 1.00 0.00 H new ATOM 0 HD21 ASN A 399 8.093 -2.403 5.048 1.00 0.00 H new ATOM 0 HD22 ASN A 399 8.048 -1.144 3.809 1.00 0.00 H new ATOM 1239 N ILE A 400 6.083 -2.037 -0.913 1.00 0.00 N ATOM 1240 CA ILE A 400 5.654 -1.392 -2.147 1.00 0.00 C ATOM 1241 C ILE A 400 4.715 -2.304 -2.934 1.00 0.00 C ATOM 1242 O ILE A 400 3.650 -1.876 -3.383 1.00 0.00 O ATOM 1243 CB ILE A 400 6.871 -1.007 -3.020 1.00 0.00 C ATOM 1244 CG1 ILE A 400 7.743 0.010 -2.279 1.00 0.00 C ATOM 1245 CG2 ILE A 400 6.422 -0.447 -4.362 1.00 0.00 C ATOM 1246 CD1 ILE A 400 9.041 0.334 -2.983 1.00 0.00 C ATOM 0 H ILE A 400 7.094 -2.130 -0.819 1.00 0.00 H new ATOM 0 HA ILE A 400 5.117 -0.482 -1.879 1.00 0.00 H new ATOM 0 HB ILE A 400 7.458 -1.905 -3.211 1.00 0.00 H new ATOM 0 HG12 ILE A 400 7.175 0.930 -2.144 1.00 0.00 H new ATOM 0 HG13 ILE A 400 7.967 -0.375 -1.284 1.00 0.00 H new ATOM 0 HG21 ILE A 400 7.296 -0.184 -4.957 1.00 0.00 H new ATOM 0 HG22 ILE A 400 5.835 -1.198 -4.891 1.00 0.00 H new ATOM 0 HG23 ILE A 400 5.813 0.442 -4.200 1.00 0.00 H new ATOM 0 HD11 ILE A 400 9.602 1.061 -2.396 1.00 0.00 H new ATOM 0 HD12 ILE A 400 9.631 -0.575 -3.094 1.00 0.00 H new ATOM 0 HD13 ILE A 400 8.827 0.750 -3.967 1.00 0.00 H new ATOM 1258 N GLU A 401 5.106 -3.569 -3.069 1.00 0.00 N ATOM 1259 CA GLU A 401 4.285 -4.560 -3.759 1.00 0.00 C ATOM 1260 C GLU A 401 2.918 -4.693 -3.096 1.00 0.00 C ATOM 1261 O GLU A 401 1.888 -4.746 -3.774 1.00 0.00 O ATOM 1262 CB GLU A 401 4.976 -5.926 -3.766 1.00 0.00 C ATOM 1263 CG GLU A 401 6.310 -5.941 -4.490 1.00 0.00 C ATOM 1264 CD GLU A 401 6.933 -7.321 -4.511 1.00 0.00 C ATOM 1265 OE1 GLU A 401 7.653 -7.669 -3.556 1.00 0.00 O ATOM 1266 OE2 GLU A 401 6.695 -8.074 -5.480 1.00 0.00 O ATOM 0 H GLU A 401 5.988 -3.932 -2.709 1.00 0.00 H new ATOM 0 HA GLU A 401 4.152 -4.218 -4.785 1.00 0.00 H new ATOM 0 HB2 GLU A 401 5.130 -6.249 -2.736 1.00 0.00 H new ATOM 0 HB3 GLU A 401 4.313 -6.654 -4.233 1.00 0.00 H new ATOM 0 HG2 GLU A 401 6.170 -5.591 -5.513 1.00 0.00 H new ATOM 0 HG3 GLU A 401 6.993 -5.243 -4.005 1.00 0.00 H new ATOM 1273 N ARG A 402 2.912 -4.735 -1.769 1.00 0.00 N ATOM 1274 CA ARG A 402 1.678 -4.913 -1.017 1.00 0.00 C ATOM 1275 C ARG A 402 0.786 -3.681 -1.109 1.00 0.00 C ATOM 1276 O ARG A 402 -0.383 -3.779 -1.473 1.00 0.00 O ATOM 1277 CB ARG A 402 1.977 -5.230 0.450 1.00 0.00 C ATOM 1278 CG ARG A 402 0.723 -5.310 1.306 1.00 0.00 C ATOM 1279 CD ARG A 402 1.036 -5.612 2.761 1.00 0.00 C ATOM 1280 NE ARG A 402 -0.159 -5.498 3.595 1.00 0.00 N ATOM 1281 CZ ARG A 402 -0.403 -6.243 4.670 1.00 0.00 C ATOM 1282 NH1 ARG A 402 0.450 -7.192 5.043 1.00 0.00 N ATOM 1283 NH2 ARG A 402 -1.509 -6.041 5.375 1.00 0.00 N ATOM 0 H ARG A 402 3.749 -4.648 -1.192 1.00 0.00 H new ATOM 0 HA ARG A 402 1.146 -5.754 -1.461 1.00 0.00 H new ATOM 0 HB2 ARG A 402 2.513 -6.177 0.510 1.00 0.00 H new ATOM 0 HB3 ARG A 402 2.639 -4.464 0.854 1.00 0.00 H new ATOM 0 HG2 ARG A 402 0.181 -4.366 1.242 1.00 0.00 H new ATOM 0 HG3 ARG A 402 0.065 -6.083 0.910 1.00 0.00 H new ATOM 0 HD2 ARG A 402 1.447 -6.618 2.846 1.00 0.00 H new ATOM 0 HD3 ARG A 402 1.801 -4.924 3.121 1.00 0.00 H new ATOM 0 HE ARG A 402 -0.854 -4.799 3.335 1.00 0.00 H new ATOM 0 HH11 ARG A 402 1.300 -7.354 4.504 1.00 0.00 H new ATOM 0 HH12 ARG A 402 0.254 -7.758 5.869 1.00 0.00 H new ATOM 0 HH21 ARG A 402 -2.169 -5.316 5.092 1.00 0.00 H new ATOM 0 HH22 ARG A 402 -1.699 -6.610 6.200 1.00 0.00 H new ATOM 1297 N LEU A 403 1.343 -2.524 -0.792 1.00 0.00 N ATOM 1298 CA LEU A 403 0.568 -1.291 -0.741 1.00 0.00 C ATOM 1299 C LEU A 403 -0.082 -0.984 -2.087 1.00 0.00 C ATOM 1300 O LEU A 403 -1.215 -0.511 -2.135 1.00 0.00 O ATOM 1301 CB LEU A 403 1.456 -0.132 -0.290 1.00 0.00 C ATOM 1302 CG LEU A 403 2.008 -0.270 1.131 1.00 0.00 C ATOM 1303 CD1 LEU A 403 3.007 0.831 1.427 1.00 0.00 C ATOM 1304 CD2 LEU A 403 0.879 -0.243 2.150 1.00 0.00 C ATOM 0 H LEU A 403 2.331 -2.411 -0.565 1.00 0.00 H new ATOM 0 HA LEU A 403 -0.234 -1.424 -0.015 1.00 0.00 H new ATOM 0 HB2 LEU A 403 2.292 -0.040 -0.983 1.00 0.00 H new ATOM 0 HB3 LEU A 403 0.884 0.794 -0.356 1.00 0.00 H new ATOM 0 HG LEU A 403 2.519 -1.230 1.204 1.00 0.00 H new ATOM 0 HD11 LEU A 403 3.387 0.714 2.442 1.00 0.00 H new ATOM 0 HD12 LEU A 403 3.835 0.771 0.720 1.00 0.00 H new ATOM 0 HD13 LEU A 403 2.519 1.801 1.332 1.00 0.00 H new ATOM 0 HD21 LEU A 403 1.292 -0.342 3.154 1.00 0.00 H new ATOM 0 HD22 LEU A 403 0.340 0.701 2.071 1.00 0.00 H new ATOM 0 HD23 LEU A 403 0.194 -1.069 1.956 1.00 0.00 H new ATOM 1316 N ARG A 404 0.619 -1.282 -3.176 1.00 0.00 N ATOM 1317 CA ARG A 404 0.088 -1.034 -4.513 1.00 0.00 C ATOM 1318 C ARG A 404 -1.131 -1.905 -4.812 1.00 0.00 C ATOM 1319 O ARG A 404 -2.092 -1.441 -5.432 1.00 0.00 O ATOM 1320 CB ARG A 404 1.167 -1.239 -5.578 1.00 0.00 C ATOM 1321 CG ARG A 404 2.147 -0.084 -5.657 1.00 0.00 C ATOM 1322 CD ARG A 404 3.191 -0.290 -6.742 1.00 0.00 C ATOM 1323 NE ARG A 404 3.983 0.921 -6.957 1.00 0.00 N ATOM 1324 CZ ARG A 404 5.207 0.938 -7.481 1.00 0.00 C ATOM 1325 NH1 ARG A 404 5.808 -0.193 -7.833 1.00 0.00 N ATOM 1326 NH2 ARG A 404 5.833 2.096 -7.643 1.00 0.00 N ATOM 0 H ARG A 404 1.552 -1.694 -3.160 1.00 0.00 H new ATOM 0 HA ARG A 404 -0.235 0.007 -4.542 1.00 0.00 H new ATOM 0 HB2 ARG A 404 1.713 -2.158 -5.363 1.00 0.00 H new ATOM 0 HB3 ARG A 404 0.691 -1.372 -6.549 1.00 0.00 H new ATOM 0 HG2 ARG A 404 1.602 0.840 -5.850 1.00 0.00 H new ATOM 0 HG3 ARG A 404 2.644 0.035 -4.694 1.00 0.00 H new ATOM 0 HD2 ARG A 404 3.850 -1.113 -6.464 1.00 0.00 H new ATOM 0 HD3 ARG A 404 2.700 -0.575 -7.672 1.00 0.00 H new ATOM 0 HE ARG A 404 3.569 1.813 -6.687 1.00 0.00 H new ATOM 0 HH11 ARG A 404 5.332 -1.086 -7.703 1.00 0.00 H new ATOM 0 HH12 ARG A 404 6.746 -0.169 -8.234 1.00 0.00 H new ATOM 0 HH21 ARG A 404 5.377 2.965 -7.367 1.00 0.00 H new ATOM 0 HH22 ARG A 404 6.771 2.117 -8.044 1.00 0.00 H new ATOM 1340 N MET A 405 -1.113 -3.157 -4.365 1.00 0.00 N ATOM 1341 CA MET A 405 -2.249 -4.042 -4.599 1.00 0.00 C ATOM 1342 C MET A 405 -3.371 -3.751 -3.605 1.00 0.00 C ATOM 1343 O MET A 405 -4.542 -4.007 -3.887 1.00 0.00 O ATOM 1344 CB MET A 405 -1.849 -5.527 -4.544 1.00 0.00 C ATOM 1345 CG MET A 405 -1.271 -5.981 -3.215 1.00 0.00 C ATOM 1346 SD MET A 405 -1.034 -7.768 -3.136 1.00 0.00 S ATOM 1347 CE MET A 405 -0.177 -7.931 -1.573 1.00 0.00 C ATOM 0 H MET A 405 -0.340 -3.576 -3.848 1.00 0.00 H new ATOM 0 HA MET A 405 -2.611 -3.842 -5.608 1.00 0.00 H new ATOM 0 HB2 MET A 405 -2.726 -6.134 -4.769 1.00 0.00 H new ATOM 0 HB3 MET A 405 -1.117 -5.721 -5.328 1.00 0.00 H new ATOM 0 HG2 MET A 405 -0.315 -5.484 -3.050 1.00 0.00 H new ATOM 0 HG3 MET A 405 -1.936 -5.670 -2.409 1.00 0.00 H new ATOM 0 HE1 MET A 405 -0.403 -8.903 -1.134 1.00 0.00 H new ATOM 0 HE2 MET A 405 0.897 -7.848 -1.737 1.00 0.00 H new ATOM 0 HE3 MET A 405 -0.503 -7.142 -0.895 1.00 0.00 H new ATOM 1357 N GLU A 406 -3.020 -3.191 -2.452 1.00 0.00 N ATOM 1358 CA GLU A 406 -4.019 -2.844 -1.451 1.00 0.00 C ATOM 1359 C GLU A 406 -4.749 -1.566 -1.830 1.00 0.00 C ATOM 1360 O GLU A 406 -5.919 -1.392 -1.493 1.00 0.00 O ATOM 1361 CB GLU A 406 -3.403 -2.727 -0.061 1.00 0.00 C ATOM 1362 CG GLU A 406 -2.827 -4.039 0.431 1.00 0.00 C ATOM 1363 CD GLU A 406 -2.900 -4.186 1.931 1.00 0.00 C ATOM 1364 OE1 GLU A 406 -1.959 -3.760 2.628 1.00 0.00 O ATOM 1365 OE2 GLU A 406 -3.904 -4.744 2.416 1.00 0.00 O ATOM 0 H GLU A 406 -2.059 -2.970 -2.190 1.00 0.00 H new ATOM 0 HA GLU A 406 -4.747 -3.655 -1.421 1.00 0.00 H new ATOM 0 HB2 GLU A 406 -2.617 -1.972 -0.078 1.00 0.00 H new ATOM 0 HB3 GLU A 406 -4.162 -2.381 0.641 1.00 0.00 H new ATOM 0 HG2 GLU A 406 -3.364 -4.864 -0.037 1.00 0.00 H new ATOM 0 HG3 GLU A 406 -1.787 -4.115 0.114 1.00 0.00 H new ATOM 1372 N ILE A 407 -4.067 -0.675 -2.534 1.00 0.00 N ATOM 1373 CA ILE A 407 -4.737 0.471 -3.127 1.00 0.00 C ATOM 1374 C ILE A 407 -5.811 -0.030 -4.084 1.00 0.00 C ATOM 1375 O ILE A 407 -6.953 0.428 -4.053 1.00 0.00 O ATOM 1376 CB ILE A 407 -3.751 1.396 -3.880 1.00 0.00 C ATOM 1377 CG1 ILE A 407 -2.758 2.025 -2.897 1.00 0.00 C ATOM 1378 CG2 ILE A 407 -4.505 2.478 -4.644 1.00 0.00 C ATOM 1379 CD1 ILE A 407 -1.700 2.883 -3.560 1.00 0.00 C ATOM 0 H ILE A 407 -3.063 -0.722 -2.707 1.00 0.00 H new ATOM 0 HA ILE A 407 -5.183 1.060 -2.325 1.00 0.00 H new ATOM 0 HB ILE A 407 -3.195 0.796 -4.600 1.00 0.00 H new ATOM 0 HG12 ILE A 407 -3.308 2.633 -2.179 1.00 0.00 H new ATOM 0 HG13 ILE A 407 -2.268 1.232 -2.333 1.00 0.00 H new ATOM 0 HG21 ILE A 407 -3.793 3.117 -5.166 1.00 0.00 H new ATOM 0 HG22 ILE A 407 -5.174 2.013 -5.368 1.00 0.00 H new ATOM 0 HG23 ILE A 407 -5.087 3.078 -3.945 1.00 0.00 H new ATOM 0 HD11 ILE A 407 -1.035 3.293 -2.800 1.00 0.00 H new ATOM 0 HD12 ILE A 407 -1.123 2.275 -4.257 1.00 0.00 H new ATOM 0 HD13 ILE A 407 -2.180 3.699 -4.101 1.00 0.00 H new ATOM 1391 N HIS A 408 -5.445 -1.024 -4.892 1.00 0.00 N ATOM 1392 CA HIS A 408 -6.375 -1.624 -5.841 1.00 0.00 C ATOM 1393 C HIS A 408 -7.523 -2.321 -5.115 1.00 0.00 C ATOM 1394 O HIS A 408 -8.646 -2.345 -5.612 1.00 0.00 O ATOM 1395 CB HIS A 408 -5.659 -2.620 -6.755 1.00 0.00 C ATOM 1396 CG HIS A 408 -6.558 -3.204 -7.802 1.00 0.00 C ATOM 1397 ND1 HIS A 408 -6.752 -4.558 -7.964 1.00 0.00 N ATOM 1398 CD2 HIS A 408 -7.325 -2.603 -8.739 1.00 0.00 C ATOM 1399 CE1 HIS A 408 -7.597 -4.762 -8.957 1.00 0.00 C ATOM 1400 NE2 HIS A 408 -7.958 -3.593 -9.443 1.00 0.00 N ATOM 0 H HIS A 408 -4.509 -1.430 -4.907 1.00 0.00 H new ATOM 0 HA HIS A 408 -6.784 -0.820 -6.452 1.00 0.00 H new ATOM 0 HB2 HIS A 408 -4.821 -2.121 -7.241 1.00 0.00 H new ATOM 0 HB3 HIS A 408 -5.243 -3.426 -6.150 1.00 0.00 H new ATOM 0 HD2 HIS A 408 -7.421 -1.540 -8.902 1.00 0.00 H new ATOM 0 HE1 HIS A 408 -7.935 -5.725 -9.311 1.00 0.00 H new ATOM 0 HE2 HIS A 408 -8.605 -3.448 -10.218 1.00 0.00 H new ATOM 1409 N LYS A 409 -7.232 -2.903 -3.953 1.00 0.00 N ATOM 1410 CA LYS A 409 -8.264 -3.521 -3.122 1.00 0.00 C ATOM 1411 C LYS A 409 -9.392 -2.536 -2.852 1.00 0.00 C ATOM 1412 O LYS A 409 -10.563 -2.831 -3.081 1.00 0.00 O ATOM 1413 CB LYS A 409 -7.680 -3.983 -1.783 1.00 0.00 C ATOM 1414 CG LYS A 409 -7.035 -5.360 -1.805 1.00 0.00 C ATOM 1415 CD LYS A 409 -6.309 -5.658 -0.493 1.00 0.00 C ATOM 1416 CE LYS A 409 -7.122 -5.222 0.719 1.00 0.00 C ATOM 1417 NZ LYS A 409 -6.406 -5.472 1.997 1.00 0.00 N ATOM 0 H LYS A 409 -6.290 -2.960 -3.565 1.00 0.00 H new ATOM 0 HA LYS A 409 -8.652 -4.383 -3.664 1.00 0.00 H new ATOM 0 HB2 LYS A 409 -6.937 -3.255 -1.457 1.00 0.00 H new ATOM 0 HB3 LYS A 409 -8.475 -3.982 -1.037 1.00 0.00 H new ATOM 0 HG2 LYS A 409 -7.798 -6.118 -1.980 1.00 0.00 H new ATOM 0 HG3 LYS A 409 -6.330 -5.420 -2.634 1.00 0.00 H new ATOM 0 HD2 LYS A 409 -6.103 -6.726 -0.427 1.00 0.00 H new ATOM 0 HD3 LYS A 409 -5.346 -5.147 -0.487 1.00 0.00 H new ATOM 0 HE2 LYS A 409 -7.353 -4.160 0.636 1.00 0.00 H new ATOM 0 HE3 LYS A 409 -8.073 -5.755 0.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 409 -6.780 -4.840 2.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 409 -6.546 -6.461 2.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 409 -5.390 -5.289 1.867 1.00 0.00 H new ATOM 1431 N ASN A 410 -9.016 -1.356 -2.383 1.00 0.00 N ATOM 1432 CA ASN A 410 -9.982 -0.323 -2.035 1.00 0.00 C ATOM 1433 C ASN A 410 -10.690 0.197 -3.278 1.00 0.00 C ATOM 1434 O ASN A 410 -11.878 0.509 -3.236 1.00 0.00 O ATOM 1435 CB ASN A 410 -9.294 0.820 -1.286 1.00 0.00 C ATOM 1436 CG ASN A 410 -8.852 0.414 0.110 1.00 0.00 C ATOM 1437 OD1 ASN A 410 -9.590 0.581 1.076 1.00 0.00 O ATOM 1438 ND2 ASN A 410 -7.647 -0.126 0.223 1.00 0.00 N ATOM 0 H ASN A 410 -8.043 -1.088 -2.234 1.00 0.00 H new ATOM 0 HA ASN A 410 -10.733 -0.763 -1.379 1.00 0.00 H new ATOM 0 HB2 ASN A 410 -8.427 1.154 -1.856 1.00 0.00 H new ATOM 0 HB3 ASN A 410 -9.976 1.668 -1.216 1.00 0.00 H new ATOM 0 HD21 ASN A 410 -7.303 -0.420 1.137 1.00 0.00 H new ATOM 0 HD22 ASN A 410 -7.063 -0.248 -0.604 1.00 0.00 H new ATOM 1445 N GLU A 411 -9.960 0.275 -4.388 1.00 0.00 N ATOM 1446 CA GLU A 411 -10.549 0.676 -5.663 1.00 0.00 C ATOM 1447 C GLU A 411 -11.597 -0.342 -6.106 1.00 0.00 C ATOM 1448 O GLU A 411 -12.660 0.024 -6.610 1.00 0.00 O ATOM 1449 CB GLU A 411 -9.472 0.803 -6.742 1.00 0.00 C ATOM 1450 CG GLU A 411 -8.377 1.802 -6.408 1.00 0.00 C ATOM 1451 CD GLU A 411 -7.321 1.881 -7.488 1.00 0.00 C ATOM 1452 OE1 GLU A 411 -6.898 0.817 -7.990 1.00 0.00 O ATOM 1453 OE2 GLU A 411 -6.923 3.005 -7.858 1.00 0.00 O ATOM 0 H GLU A 411 -8.962 0.066 -4.431 1.00 0.00 H new ATOM 0 HA GLU A 411 -11.025 1.647 -5.524 1.00 0.00 H new ATOM 0 HB2 GLU A 411 -9.020 -0.175 -6.906 1.00 0.00 H new ATOM 0 HB3 GLU A 411 -9.944 1.097 -7.679 1.00 0.00 H new ATOM 0 HG2 GLU A 411 -8.820 2.788 -6.263 1.00 0.00 H new ATOM 0 HG3 GLU A 411 -7.908 1.522 -5.465 1.00 0.00 H new ATOM 1460 N ALA A 412 -11.283 -1.619 -5.913 1.00 0.00 N ATOM 1461 CA ALA A 412 -12.199 -2.702 -6.239 1.00 0.00 C ATOM 1462 C ALA A 412 -13.450 -2.615 -5.384 1.00 0.00 C ATOM 1463 O ALA A 412 -14.569 -2.731 -5.885 1.00 0.00 O ATOM 1464 CB ALA A 412 -11.524 -4.048 -6.033 1.00 0.00 C ATOM 0 H ALA A 412 -10.391 -1.929 -5.528 1.00 0.00 H new ATOM 0 HA ALA A 412 -12.482 -2.606 -7.287 1.00 0.00 H new ATOM 0 HB1 ALA A 412 -12.223 -4.847 -6.281 1.00 0.00 H new ATOM 0 HB2 ALA A 412 -10.648 -4.118 -6.678 1.00 0.00 H new ATOM 0 HB3 ALA A 412 -11.217 -4.145 -4.992 1.00 0.00 H new ATOM 1470 N TRP A 413 -13.251 -2.404 -4.090 1.00 0.00 N ATOM 1471 CA TRP A 413 -14.361 -2.231 -3.174 1.00 0.00 C ATOM 1472 C TRP A 413 -15.195 -1.021 -3.581 1.00 0.00 C ATOM 1473 O TRP A 413 -16.411 -1.113 -3.683 1.00 0.00 O ATOM 1474 CB TRP A 413 -13.863 -2.105 -1.731 1.00 0.00 C ATOM 1475 CG TRP A 413 -13.270 -3.380 -1.201 1.00 0.00 C ATOM 1476 CD1 TRP A 413 -13.626 -4.648 -1.557 1.00 0.00 C ATOM 1477 CD2 TRP A 413 -12.234 -3.517 -0.217 1.00 0.00 C ATOM 1478 NE1 TRP A 413 -12.876 -5.563 -0.866 1.00 0.00 N ATOM 1479 CE2 TRP A 413 -12.014 -4.896 -0.035 1.00 0.00 C ATOM 1480 CE3 TRP A 413 -11.469 -2.612 0.525 1.00 0.00 C ATOM 1481 CZ2 TRP A 413 -11.063 -5.389 0.857 1.00 0.00 C ATOM 1482 CZ3 TRP A 413 -10.525 -3.103 1.410 1.00 0.00 C ATOM 1483 CH2 TRP A 413 -10.330 -4.481 1.569 1.00 0.00 C ATOM 0 H TRP A 413 -12.330 -2.349 -3.655 1.00 0.00 H new ATOM 0 HA TRP A 413 -14.997 -3.115 -3.225 1.00 0.00 H new ATOM 0 HB2 TRP A 413 -13.115 -1.314 -1.678 1.00 0.00 H new ATOM 0 HB3 TRP A 413 -14.692 -1.803 -1.091 1.00 0.00 H new ATOM 0 HD1 TRP A 413 -14.389 -4.895 -2.280 1.00 0.00 H new ATOM 0 HE1 TRP A 413 -12.948 -6.577 -0.956 1.00 0.00 H new ATOM 0 HE3 TRP A 413 -11.612 -1.548 0.410 1.00 0.00 H new ATOM 0 HZ2 TRP A 413 -10.911 -6.451 0.981 1.00 0.00 H new ATOM 0 HZ3 TRP A 413 -9.929 -2.412 1.988 1.00 0.00 H new ATOM 0 HH2 TRP A 413 -9.586 -4.833 2.268 1.00 0.00 H new ATOM 1494 N LEU A 414 -14.533 0.101 -3.853 1.00 0.00 N ATOM 1495 CA LEU A 414 -15.221 1.303 -4.327 1.00 0.00 C ATOM 1496 C LEU A 414 -16.035 1.015 -5.585 1.00 0.00 C ATOM 1497 O LEU A 414 -17.139 1.534 -5.747 1.00 0.00 O ATOM 1498 CB LEU A 414 -14.218 2.421 -4.625 1.00 0.00 C ATOM 1499 CG LEU A 414 -13.617 3.113 -3.403 1.00 0.00 C ATOM 1500 CD1 LEU A 414 -12.480 4.027 -3.822 1.00 0.00 C ATOM 1501 CD2 LEU A 414 -14.680 3.909 -2.665 1.00 0.00 C ATOM 0 H LEU A 414 -13.523 0.205 -3.754 1.00 0.00 H new ATOM 0 HA LEU A 414 -15.896 1.622 -3.533 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -13.405 2.006 -5.221 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -14.712 3.173 -5.240 1.00 0.00 H new ATOM 0 HG LEU A 414 -13.226 2.348 -2.732 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -12.061 4.514 -2.941 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -11.705 3.441 -4.316 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -12.856 4.784 -4.510 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -14.234 4.395 -1.797 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -15.096 4.665 -3.331 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -15.474 3.238 -2.337 1.00 0.00 H new ATOM 1513 N SER A 415 -15.488 0.171 -6.456 1.00 0.00 N ATOM 1514 CA SER A 415 -16.131 -0.162 -7.720 1.00 0.00 C ATOM 1515 C SER A 415 -17.513 -0.765 -7.480 1.00 0.00 C ATOM 1516 O SER A 415 -18.473 -0.432 -8.178 1.00 0.00 O ATOM 1517 CB SER A 415 -15.253 -1.134 -8.520 1.00 0.00 C ATOM 1518 OG SER A 415 -15.736 -1.309 -9.842 1.00 0.00 O ATOM 0 H SER A 415 -14.594 -0.297 -6.306 1.00 0.00 H new ATOM 0 HA SER A 415 -16.255 0.754 -8.297 1.00 0.00 H new ATOM 0 HB2 SER A 415 -14.230 -0.758 -8.553 1.00 0.00 H new ATOM 0 HB3 SER A 415 -15.222 -2.098 -8.013 1.00 0.00 H new ATOM 0 HG SER A 415 -15.153 -1.932 -10.323 1.00 0.00 H new ATOM 1524 N GLU A 416 -17.619 -1.636 -6.483 1.00 0.00 N ATOM 1525 CA GLU A 416 -18.902 -2.241 -6.159 1.00 0.00 C ATOM 1526 C GLU A 416 -19.703 -1.357 -5.210 1.00 0.00 C ATOM 1527 O GLU A 416 -20.914 -1.248 -5.350 1.00 0.00 O ATOM 1528 CB GLU A 416 -18.739 -3.641 -5.563 1.00 0.00 C ATOM 1529 CG GLU A 416 -17.826 -3.706 -4.352 1.00 0.00 C ATOM 1530 CD GLU A 416 -18.075 -4.935 -3.507 1.00 0.00 C ATOM 1531 OE1 GLU A 416 -17.468 -5.988 -3.788 1.00 0.00 O ATOM 1532 OE2 GLU A 416 -18.888 -4.852 -2.557 1.00 0.00 O ATOM 0 H GLU A 416 -16.842 -1.935 -5.893 1.00 0.00 H new ATOM 0 HA GLU A 416 -19.451 -2.337 -7.096 1.00 0.00 H new ATOM 0 HB2 GLU A 416 -19.722 -4.020 -5.282 1.00 0.00 H new ATOM 0 HB3 GLU A 416 -18.349 -4.307 -6.333 1.00 0.00 H new ATOM 0 HG2 GLU A 416 -16.787 -3.700 -4.683 1.00 0.00 H new ATOM 0 HG3 GLU A 416 -17.971 -2.814 -3.743 1.00 0.00 H new ATOM 1539 N VAL A 417 -19.031 -0.717 -4.253 1.00 0.00 N ATOM 1540 CA VAL A 417 -19.719 0.126 -3.274 1.00 0.00 C ATOM 1541 C VAL A 417 -20.484 1.247 -3.955 1.00 0.00 C ATOM 1542 O VAL A 417 -21.669 1.457 -3.698 1.00 0.00 O ATOM 1543 CB VAL A 417 -18.752 0.755 -2.246 1.00 0.00 C ATOM 1544 CG1 VAL A 417 -19.501 1.708 -1.335 1.00 0.00 C ATOM 1545 CG2 VAL A 417 -18.054 -0.306 -1.417 1.00 0.00 C ATOM 0 H VAL A 417 -18.019 -0.765 -4.135 1.00 0.00 H new ATOM 0 HA VAL A 417 -20.407 -0.536 -2.748 1.00 0.00 H new ATOM 0 HB VAL A 417 -17.993 1.306 -2.801 1.00 0.00 H new ATOM 0 HG11 VAL A 417 -18.808 2.144 -0.616 1.00 0.00 H new ATOM 0 HG12 VAL A 417 -19.953 2.501 -1.931 1.00 0.00 H new ATOM 0 HG13 VAL A 417 -20.282 1.165 -0.803 1.00 0.00 H new ATOM 0 HG21 VAL A 417 -17.382 0.173 -0.705 1.00 0.00 H new ATOM 0 HG22 VAL A 417 -18.797 -0.893 -0.877 1.00 0.00 H new ATOM 0 HG23 VAL A 417 -17.481 -0.961 -2.073 1.00 0.00 H new ATOM 1555 N GLU A 418 -19.806 1.943 -4.845 1.00 0.00 N ATOM 1556 CA GLU A 418 -20.404 3.063 -5.549 1.00 0.00 C ATOM 1557 C GLU A 418 -21.245 2.557 -6.715 1.00 0.00 C ATOM 1558 O GLU A 418 -21.791 3.336 -7.496 1.00 0.00 O ATOM 1559 CB GLU A 418 -19.313 4.024 -6.025 1.00 0.00 C ATOM 1560 CG GLU A 418 -18.397 4.486 -4.899 1.00 0.00 C ATOM 1561 CD GLU A 418 -17.422 5.563 -5.326 1.00 0.00 C ATOM 1562 OE1 GLU A 418 -16.495 5.265 -6.109 1.00 0.00 O ATOM 1563 OE2 GLU A 418 -17.574 6.714 -4.870 1.00 0.00 O ATOM 0 H GLU A 418 -18.837 1.753 -5.100 1.00 0.00 H new ATOM 0 HA GLU A 418 -21.061 3.608 -4.871 1.00 0.00 H new ATOM 0 HB2 GLU A 418 -18.716 3.535 -6.795 1.00 0.00 H new ATOM 0 HB3 GLU A 418 -19.779 4.894 -6.488 1.00 0.00 H new ATOM 0 HG2 GLU A 418 -19.005 4.861 -4.076 1.00 0.00 H new ATOM 0 HG3 GLU A 418 -17.839 3.630 -4.519 1.00 0.00 H new