USER MOD reduce.3.24.130724 H: found=0, std=0, add=630, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 631 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 31 SER OG : rot -108:sc= 0.375 USER MOD Set 1.2: A 32 THR OG1 : rot 180:sc= 0.0204 USER MOD Single : A 15 TYR OH : rot 180:sc= -0.0471 USER MOD Single : A 17 CYS SG : rot 180:sc= -0.649 USER MOD Single : A 21 TYR OH : rot 44:sc= -1.78! USER MOD Single : A 25 MET CE :methyl -140:sc= 0 (180deg=-0.45) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.00977 USER MOD Single : A 27 THR OG1 : rot 170:sc= 0.447 USER MOD Single : A 28 LYS NZ :NH3+ 160:sc= -1.56 (180deg=-2.59!) USER MOD Single : A 30 THR OG1 : rot -160:sc= -0.321 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -64:sc= 1.13 USER MOD Single : A 40 TYR OH : rot 15:sc= -0.497 USER MOD Single : A 41 GLN : amide:sc= -0.115 K(o=-0.12,f=-0.65) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 179:sc= 0.107 (180deg=0.0612) USER MOD Single : A 50 ASN : amide:sc= -1.27! C(o=-1.3!,f=-11!) USER MOD Single : A 51 THR OG1 : rot 27:sc= -1.69! USER MOD Single : A 52 SER OG : rot -160:sc= -0.329 USER MOD Single : A 53 LYS NZ :NH3+ -108:sc= -0.897 (180deg=-3.16!) USER MOD Single : A 54 ASN : amide:sc= -0.575 K(o=-0.58,f=-1.3) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 170:sc= 0 USER MOD Single : A 61 ASN : amide:sc= 0.602 K(o=0.6,f=-0.0028) USER MOD Single : A 63 SER OG : rot -80:sc= 0.371 USER MOD Single : A 64 MET CE :methyl -175:sc= -0.674 (180deg=-0.829) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.298 K(o=-0.3,f=-8.2!) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -1.57 K(o=-1.6,f=-3.7!) USER MOD Single : A 77 GLN : amide:sc= -0.988 K(o=-0.99,f=-0.0011) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -1.89 K(o=-1.9,f=-0.3) USER MOD Single : A 84 LYS NZ :NH3+ -174:sc= -0.802 (180deg=-0.82) USER MOD Single : A 87 GLN : amide:sc= -0.241 K(o=-0.24,f=-1.6) USER MOD Single : A 88 THR OG1 : rot 35:sc= 0.263 USER MOD ----------------------------------------------------------------- ATOM 220 N TYR A 15 -4.669 -26.104 1.529 1.00 0.00 N ATOM 221 CA TYR A 15 -5.924 -26.244 2.261 1.00 0.00 C ATOM 222 C TYR A 15 -7.043 -26.610 1.285 1.00 0.00 C ATOM 223 O TYR A 15 -7.210 -25.943 0.261 1.00 0.00 O ATOM 224 CB TYR A 15 -6.277 -24.945 3.006 1.00 0.00 C ATOM 225 CG TYR A 15 -5.372 -24.644 4.191 1.00 0.00 C ATOM 226 CD1 TYR A 15 -5.569 -25.275 5.416 1.00 0.00 C ATOM 227 CD2 TYR A 15 -4.330 -23.728 4.089 1.00 0.00 C ATOM 228 CE1 TYR A 15 -4.757 -24.999 6.501 1.00 0.00 C ATOM 229 CE2 TYR A 15 -3.514 -23.451 5.169 1.00 0.00 C ATOM 230 CZ TYR A 15 -3.732 -24.088 6.373 1.00 0.00 C ATOM 231 OH TYR A 15 -2.920 -23.815 7.451 1.00 0.00 O ATOM 0 HA TYR A 15 -5.810 -27.036 3.001 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -6.229 -24.112 2.305 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -7.307 -25.008 3.356 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -6.370 -25.992 5.521 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -4.156 -23.225 3.149 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -4.926 -25.496 7.445 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -2.708 -22.738 5.071 1.00 0.00 H new ATOM 0 HH TYR A 15 -2.246 -23.152 7.193 1.00 0.00 H new ATOM 241 N PRO A 16 -7.829 -27.673 1.568 1.00 0.00 N ATOM 242 CA PRO A 16 -7.686 -28.493 2.782 1.00 0.00 C ATOM 243 C PRO A 16 -6.530 -29.489 2.698 1.00 0.00 C ATOM 244 O PRO A 16 -6.019 -29.777 1.611 1.00 0.00 O ATOM 245 CB PRO A 16 -9.023 -29.235 2.856 1.00 0.00 C ATOM 246 CG PRO A 16 -9.450 -29.376 1.435 1.00 0.00 C ATOM 247 CD PRO A 16 -8.934 -28.152 0.714 1.00 0.00 C ATOM 0 HA PRO A 16 -7.461 -27.883 3.657 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -8.911 -30.208 3.335 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -9.756 -28.675 3.437 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -9.043 -30.287 0.995 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -10.535 -29.443 1.360 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -8.585 -28.397 -0.289 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -9.711 -27.396 0.605 1.00 0.00 H new ATOM 255 N CYS A 17 -6.131 -30.011 3.854 1.00 0.00 N ATOM 256 CA CYS A 17 -5.042 -30.982 3.940 1.00 0.00 C ATOM 257 C CYS A 17 -5.013 -31.627 5.326 1.00 0.00 C ATOM 258 O CYS A 17 -5.653 -31.139 6.260 1.00 0.00 O ATOM 259 CB CYS A 17 -3.695 -30.304 3.645 1.00 0.00 C ATOM 260 SG CYS A 17 -2.280 -31.434 3.606 1.00 0.00 S ATOM 0 H CYS A 17 -6.550 -29.775 4.754 1.00 0.00 H new ATOM 0 HA CYS A 17 -5.213 -31.759 3.195 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -3.762 -29.793 2.685 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -3.513 -29.540 4.401 1.00 0.00 H new ATOM 0 HG CYS A 17 -1.196 -30.764 3.348 1.00 0.00 H new ATOM 266 N LEU A 18 -4.277 -32.731 5.446 1.00 0.00 N ATOM 267 CA LEU A 18 -4.116 -33.434 6.717 1.00 0.00 C ATOM 268 C LEU A 18 -3.006 -32.792 7.544 1.00 0.00 C ATOM 269 O LEU A 18 -1.822 -32.932 7.226 1.00 0.00 O ATOM 270 CB LEU A 18 -3.800 -34.914 6.464 1.00 0.00 C ATOM 271 CG LEU A 18 -4.936 -35.721 5.816 1.00 0.00 C ATOM 272 CD1 LEU A 18 -4.430 -37.079 5.335 1.00 0.00 C ATOM 273 CD2 LEU A 18 -6.095 -35.898 6.798 1.00 0.00 C ATOM 0 H LEU A 18 -3.777 -33.162 4.668 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.049 -33.363 7.276 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.919 -34.977 5.825 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -3.539 -35.381 7.413 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.298 -35.166 4.950 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.251 -37.633 4.880 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.639 -36.933 4.599 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -4.038 -37.642 6.182 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.890 -36.472 6.322 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.744 -36.429 7.683 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -6.478 -34.920 7.089 1.00 0.00 H new ATOM 285 N TRP A 19 -3.395 -32.083 8.593 1.00 0.00 N ATOM 286 CA TRP A 19 -2.446 -31.398 9.469 1.00 0.00 C ATOM 287 C TRP A 19 -2.146 -32.261 10.697 1.00 0.00 C ATOM 288 O TRP A 19 -3.031 -32.956 11.206 1.00 0.00 O ATOM 289 CB TRP A 19 -3.015 -30.033 9.894 1.00 0.00 C ATOM 290 CG TRP A 19 -1.995 -29.123 10.516 1.00 0.00 C ATOM 291 CD1 TRP A 19 -1.589 -29.108 11.820 1.00 0.00 C ATOM 292 CD2 TRP A 19 -1.254 -28.085 9.856 1.00 0.00 C ATOM 293 NE1 TRP A 19 -0.635 -28.139 12.008 1.00 0.00 N ATOM 294 CE2 TRP A 19 -0.414 -27.495 10.819 1.00 0.00 C ATOM 295 CE3 TRP A 19 -1.220 -27.602 8.544 1.00 0.00 C ATOM 296 CZ2 TRP A 19 0.453 -26.449 10.511 1.00 0.00 C ATOM 297 CZ3 TRP A 19 -0.359 -26.562 8.239 1.00 0.00 C ATOM 298 CH2 TRP A 19 0.466 -25.995 9.220 1.00 0.00 C ATOM 0 H TRP A 19 -4.371 -31.964 8.863 1.00 0.00 H new ATOM 0 HA TRP A 19 -1.515 -31.234 8.927 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -3.445 -29.541 9.022 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -3.828 -30.192 10.603 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -1.964 -29.764 12.592 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -0.166 -27.932 12.890 1.00 0.00 H new ATOM 0 HE3 TRP A 19 -1.854 -28.032 7.783 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 1.092 -26.012 11.264 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 -0.322 -26.181 7.229 1.00 0.00 H new ATOM 0 HH2 TRP A 19 1.126 -25.183 8.952 1.00 0.00 H new ATOM 309 N ASP A 20 -0.896 -32.222 11.158 1.00 0.00 N ATOM 310 CA ASP A 20 -0.469 -32.998 12.328 1.00 0.00 C ATOM 311 C ASP A 20 -0.469 -32.132 13.586 1.00 0.00 C ATOM 312 O ASP A 20 -0.025 -30.983 13.563 1.00 0.00 O ATOM 313 CB ASP A 20 0.936 -33.590 12.119 1.00 0.00 C ATOM 314 CG ASP A 20 0.968 -34.733 11.115 1.00 0.00 C ATOM 315 OD1 ASP A 20 1.111 -34.467 9.900 1.00 0.00 O ATOM 316 OD2 ASP A 20 0.879 -35.907 11.536 1.00 0.00 O ATOM 0 H ASP A 20 -0.156 -31.659 10.738 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.182 -33.813 12.453 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.608 -32.801 11.781 1.00 0.00 H new ATOM 0 HB3 ASP A 20 1.318 -33.946 13.076 1.00 0.00 H new ATOM 321 N TYR A 21 -0.966 -32.698 14.681 1.00 0.00 N ATOM 322 CA TYR A 21 -0.998 -32.018 15.974 1.00 0.00 C ATOM 323 C TYR A 21 -0.282 -32.859 17.028 1.00 0.00 C ATOM 324 O TYR A 21 -0.673 -33.998 17.295 1.00 0.00 O ATOM 325 CB TYR A 21 -2.446 -31.767 16.419 1.00 0.00 C ATOM 326 CG TYR A 21 -3.241 -30.884 15.477 1.00 0.00 C ATOM 327 CD1 TYR A 21 -3.967 -31.430 14.425 1.00 0.00 C ATOM 328 CD2 TYR A 21 -3.270 -29.501 15.644 1.00 0.00 C ATOM 329 CE1 TYR A 21 -4.696 -30.630 13.569 1.00 0.00 C ATOM 330 CE2 TYR A 21 -4.000 -28.696 14.791 1.00 0.00 C ATOM 331 CZ TYR A 21 -4.709 -29.267 13.756 1.00 0.00 C ATOM 332 OH TYR A 21 -5.442 -28.473 12.908 1.00 0.00 O ATOM 0 H TYR A 21 -1.358 -33.640 14.699 1.00 0.00 H new ATOM 0 HA TYR A 21 -0.490 -31.060 15.867 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -2.955 -32.726 16.517 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.436 -31.308 17.408 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -3.960 -32.499 14.275 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -2.713 -29.051 16.453 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -5.254 -31.072 12.756 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -4.015 -27.626 14.934 1.00 0.00 H new ATOM 0 HH TYR A 21 -6.320 -28.881 12.755 1.00 0.00 H new ATOM 342 N ARG A 22 0.766 -32.299 17.617 1.00 0.00 N ATOM 343 CA ARG A 22 1.486 -32.969 18.693 1.00 0.00 C ATOM 344 C ARG A 22 0.758 -32.728 20.014 1.00 0.00 C ATOM 345 O ARG A 22 0.750 -31.609 20.534 1.00 0.00 O ATOM 346 CB ARG A 22 2.926 -32.445 18.771 1.00 0.00 C ATOM 347 CG ARG A 22 3.787 -33.094 19.854 1.00 0.00 C ATOM 348 CD ARG A 22 4.109 -34.553 19.543 1.00 0.00 C ATOM 349 NE ARG A 22 5.109 -35.096 20.469 1.00 0.00 N ATOM 350 CZ ARG A 22 6.072 -35.955 20.121 1.00 0.00 C ATOM 351 NH1 ARG A 22 6.157 -36.402 18.872 1.00 0.00 N ATOM 352 NH2 ARG A 22 6.955 -36.361 21.028 1.00 0.00 N ATOM 0 H ARG A 22 1.137 -31.382 17.368 1.00 0.00 H new ATOM 0 HA ARG A 22 1.522 -34.040 18.495 1.00 0.00 H new ATOM 0 HB2 ARG A 22 3.406 -32.598 17.805 1.00 0.00 H new ATOM 0 HB3 ARG A 22 2.897 -31.369 18.946 1.00 0.00 H new ATOM 0 HG2 ARG A 22 4.716 -32.534 19.960 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.268 -33.035 20.811 1.00 0.00 H new ATOM 0 HD2 ARG A 22 3.197 -35.148 19.602 1.00 0.00 H new ATOM 0 HD3 ARG A 22 4.477 -34.635 18.520 1.00 0.00 H new ATOM 0 HE ARG A 22 5.066 -34.798 21.444 1.00 0.00 H new ATOM 0 HH11 ARG A 22 5.485 -36.090 18.172 1.00 0.00 H new ATOM 0 HH12 ARG A 22 6.895 -37.057 18.614 1.00 0.00 H new ATOM 0 HH21 ARG A 22 6.896 -36.017 21.986 1.00 0.00 H new ATOM 0 HH22 ARG A 22 7.691 -37.017 20.765 1.00 0.00 H new ATOM 366 N VAL A 23 0.140 -33.777 20.543 1.00 0.00 N ATOM 367 CA VAL A 23 -0.655 -33.678 21.762 1.00 0.00 C ATOM 368 C VAL A 23 0.057 -34.378 22.914 1.00 0.00 C ATOM 369 O VAL A 23 0.087 -35.606 22.980 1.00 0.00 O ATOM 370 CB VAL A 23 -2.059 -34.310 21.572 1.00 0.00 C ATOM 371 CG1 VAL A 23 -2.937 -34.074 22.802 1.00 0.00 C ATOM 372 CG2 VAL A 23 -2.728 -33.775 20.307 1.00 0.00 C ATOM 0 H VAL A 23 0.175 -34.715 20.143 1.00 0.00 H new ATOM 0 HA VAL A 23 -0.776 -32.619 21.991 1.00 0.00 H new ATOM 0 HB VAL A 23 -1.933 -35.386 21.456 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.916 -34.527 22.643 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -2.467 -34.524 23.676 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -3.055 -33.003 22.965 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.711 -34.232 20.194 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -2.837 -32.693 20.383 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.114 -34.018 19.440 1.00 0.00 H new ATOM 382 N ILE A 24 0.647 -33.596 23.809 1.00 0.00 N ATOM 383 CA ILE A 24 1.380 -34.149 24.942 1.00 0.00 C ATOM 384 C ILE A 24 0.531 -34.084 26.212 1.00 0.00 C ATOM 385 O ILE A 24 0.381 -33.020 26.820 1.00 0.00 O ATOM 386 CB ILE A 24 2.716 -33.398 25.165 1.00 0.00 C ATOM 387 CG1 ILE A 24 3.555 -33.417 23.873 1.00 0.00 C ATOM 388 CG2 ILE A 24 3.495 -34.016 26.329 1.00 0.00 C ATOM 389 CD1 ILE A 24 4.859 -32.656 23.975 1.00 0.00 C ATOM 0 H ILE A 24 0.633 -32.577 23.773 1.00 0.00 H new ATOM 0 HA ILE A 24 1.604 -35.191 24.715 1.00 0.00 H new ATOM 0 HB ILE A 24 2.496 -32.361 25.421 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.770 -34.452 23.607 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.963 -32.995 23.061 1.00 0.00 H new ATOM 0 HG21 ILE A 24 4.430 -33.474 26.469 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.899 -33.953 27.240 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.711 -35.061 26.108 1.00 0.00 H new ATOM 0 HD11 ILE A 24 5.391 -32.717 23.026 1.00 0.00 H new ATOM 0 HD12 ILE A 24 4.653 -31.612 24.209 1.00 0.00 H new ATOM 0 HD13 ILE A 24 5.473 -33.091 24.764 1.00 0.00 H new ATOM 401 N MET A 25 -0.040 -35.226 26.597 1.00 0.00 N ATOM 402 CA MET A 25 -0.890 -35.309 27.786 1.00 0.00 C ATOM 403 C MET A 25 -0.223 -36.155 28.867 1.00 0.00 C ATOM 404 O MET A 25 0.637 -36.985 28.575 1.00 0.00 O ATOM 405 CB MET A 25 -2.272 -35.902 27.441 1.00 0.00 C ATOM 406 CG MET A 25 -3.060 -35.087 26.420 1.00 0.00 C ATOM 407 SD MET A 25 -4.839 -35.402 26.475 1.00 0.00 S ATOM 408 CE MET A 25 -4.918 -37.125 26.001 1.00 0.00 C ATOM 0 H MET A 25 0.071 -36.110 26.100 1.00 0.00 H new ATOM 0 HA MET A 25 -1.030 -34.296 28.162 1.00 0.00 H new ATOM 0 HB2 MET A 25 -2.136 -36.913 27.057 1.00 0.00 H new ATOM 0 HB3 MET A 25 -2.859 -35.985 28.356 1.00 0.00 H new ATOM 0 HG2 MET A 25 -2.880 -34.026 26.595 1.00 0.00 H new ATOM 0 HG3 MET A 25 -2.689 -35.313 25.420 1.00 0.00 H new ATOM 0 HE1 MET A 25 -5.769 -37.281 25.338 1.00 0.00 H new ATOM 0 HE2 MET A 25 -3.999 -37.403 25.484 1.00 0.00 H new ATOM 0 HE3 MET A 25 -5.034 -37.742 26.892 1.00 0.00 H new ATOM 418 N THR A 26 -0.629 -35.944 30.114 1.00 0.00 N ATOM 419 CA THR A 26 -0.100 -36.700 31.248 1.00 0.00 C ATOM 420 C THR A 26 -1.005 -37.888 31.571 1.00 0.00 C ATOM 421 O THR A 26 -1.113 -38.311 32.724 1.00 0.00 O ATOM 422 CB THR A 26 0.032 -35.788 32.489 1.00 0.00 C ATOM 423 OG1 THR A 26 -1.172 -35.027 32.669 1.00 0.00 O ATOM 424 CG2 THR A 26 1.219 -34.843 32.347 1.00 0.00 C ATOM 0 H THR A 26 -1.330 -35.248 30.369 1.00 0.00 H new ATOM 0 HA THR A 26 0.887 -37.075 30.977 1.00 0.00 H new ATOM 0 HB THR A 26 0.196 -36.422 33.361 1.00 0.00 H new ATOM 0 HG1 THR A 26 -1.081 -34.453 33.458 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.290 -34.212 33.233 1.00 0.00 H new ATOM 0 HG22 THR A 26 2.135 -35.423 32.241 1.00 0.00 H new ATOM 0 HG23 THR A 26 1.082 -34.216 31.466 1.00 0.00 H new ATOM 432 N THR A 27 -1.632 -38.442 30.540 1.00 0.00 N ATOM 433 CA THR A 27 -2.575 -39.536 30.706 1.00 0.00 C ATOM 434 C THR A 27 -2.632 -40.385 29.437 1.00 0.00 C ATOM 435 O THR A 27 -2.314 -39.907 28.345 1.00 0.00 O ATOM 436 CB THR A 27 -3.993 -39.002 31.028 1.00 0.00 C ATOM 437 OG1 THR A 27 -4.900 -40.091 31.254 1.00 0.00 O ATOM 438 CG2 THR A 27 -4.517 -38.128 29.889 1.00 0.00 C ATOM 0 H THR A 27 -1.501 -38.146 29.573 1.00 0.00 H new ATOM 0 HA THR A 27 -2.231 -40.149 31.539 1.00 0.00 H new ATOM 0 HB THR A 27 -3.925 -38.398 31.933 1.00 0.00 H new ATOM 0 HG1 THR A 27 -5.744 -39.745 31.612 1.00 0.00 H new ATOM 0 HG21 THR A 27 -5.514 -37.765 30.138 1.00 0.00 H new ATOM 0 HG22 THR A 27 -3.848 -37.280 29.744 1.00 0.00 H new ATOM 0 HG23 THR A 27 -4.563 -38.715 28.972 1.00 0.00 H new ATOM 446 N LYS A 28 -3.022 -41.645 29.593 1.00 0.00 N ATOM 447 CA LYS A 28 -3.243 -42.537 28.459 1.00 0.00 C ATOM 448 C LYS A 28 -4.715 -42.506 28.064 1.00 0.00 C ATOM 449 O LYS A 28 -5.105 -43.037 27.021 1.00 0.00 O ATOM 450 CB LYS A 28 -2.820 -43.972 28.814 1.00 0.00 C ATOM 451 CG LYS A 28 -1.314 -44.143 29.017 1.00 0.00 C ATOM 452 CD LYS A 28 -0.538 -44.113 27.695 1.00 0.00 C ATOM 453 CE LYS A 28 -0.534 -45.471 26.983 1.00 0.00 C ATOM 454 NZ LYS A 28 -1.894 -45.925 26.582 1.00 0.00 N ATOM 0 H LYS A 28 -3.193 -42.075 30.502 1.00 0.00 H new ATOM 0 HA LYS A 28 -2.638 -42.198 27.618 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -3.336 -44.278 29.724 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -3.148 -44.644 28.021 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.946 -43.351 29.669 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -1.124 -45.088 29.525 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -0.977 -43.363 27.037 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.490 -43.805 27.888 1.00 0.00 H new ATOM 0 HE2 LYS A 28 0.097 -45.408 26.097 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -0.087 -46.217 27.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -1.814 -46.643 25.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -2.380 -46.335 27.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.440 -45.114 26.226 1.00 0.00 H new ATOM 468 N ASP A 29 -5.531 -41.865 28.899 1.00 0.00 N ATOM 469 CA ASP A 29 -6.963 -41.782 28.658 1.00 0.00 C ATOM 470 C ASP A 29 -7.263 -40.653 27.686 1.00 0.00 C ATOM 471 O ASP A 29 -7.519 -39.512 28.091 1.00 0.00 O ATOM 472 CB ASP A 29 -7.741 -41.571 29.964 1.00 0.00 C ATOM 473 CG ASP A 29 -9.246 -41.505 29.727 1.00 0.00 C ATOM 474 OD1 ASP A 29 -9.866 -42.574 29.543 1.00 0.00 O ATOM 475 OD2 ASP A 29 -9.815 -40.391 29.723 1.00 0.00 O ATOM 0 H ASP A 29 -5.220 -41.396 29.750 1.00 0.00 H new ATOM 0 HA ASP A 29 -7.285 -42.729 28.224 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -7.518 -42.384 30.655 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -7.408 -40.649 30.440 1.00 0.00 H new ATOM 480 N THR A 30 -7.181 -40.966 26.403 1.00 0.00 N ATOM 481 CA THR A 30 -7.516 -40.013 25.368 1.00 0.00 C ATOM 482 C THR A 30 -8.984 -40.184 24.974 1.00 0.00 C ATOM 483 O THR A 30 -9.347 -41.101 24.237 1.00 0.00 O ATOM 484 CB THR A 30 -6.584 -40.158 24.132 1.00 0.00 C ATOM 485 OG1 THR A 30 -7.026 -39.304 23.067 1.00 0.00 O ATOM 486 CG2 THR A 30 -6.508 -41.604 23.639 1.00 0.00 C ATOM 0 H THR A 30 -6.883 -41.878 26.057 1.00 0.00 H new ATOM 0 HA THR A 30 -7.366 -39.007 25.760 1.00 0.00 H new ATOM 0 HB THR A 30 -5.584 -39.859 24.446 1.00 0.00 H new ATOM 0 HG1 THR A 30 -6.653 -39.620 22.218 1.00 0.00 H new ATOM 0 HG21 THR A 30 -5.846 -41.659 22.775 1.00 0.00 H new ATOM 0 HG22 THR A 30 -6.119 -42.240 24.435 1.00 0.00 H new ATOM 0 HG23 THR A 30 -7.504 -41.945 23.356 1.00 0.00 H new ATOM 494 N SER A 31 -9.829 -39.310 25.501 1.00 0.00 N ATOM 495 CA SER A 31 -11.261 -39.356 25.236 1.00 0.00 C ATOM 496 C SER A 31 -11.735 -38.002 24.715 1.00 0.00 C ATOM 497 O SER A 31 -12.159 -37.879 23.562 1.00 0.00 O ATOM 498 CB SER A 31 -12.003 -39.745 26.521 1.00 0.00 C ATOM 499 OG SER A 31 -11.546 -38.969 27.624 1.00 0.00 O ATOM 0 H SER A 31 -9.544 -38.552 26.121 1.00 0.00 H new ATOM 0 HA SER A 31 -11.473 -40.105 24.473 1.00 0.00 H new ATOM 0 HB2 SER A 31 -13.075 -39.598 26.386 1.00 0.00 H new ATOM 0 HB3 SER A 31 -11.850 -40.804 26.728 1.00 0.00 H new ATOM 0 HG SER A 31 -11.009 -39.532 28.220 1.00 0.00 H new ATOM 505 N THR A 32 -11.621 -36.985 25.570 1.00 0.00 N ATOM 506 CA THR A 32 -11.992 -35.615 25.223 1.00 0.00 C ATOM 507 C THR A 32 -11.307 -35.176 23.924 1.00 0.00 C ATOM 508 O THR A 32 -11.884 -34.444 23.115 1.00 0.00 O ATOM 509 CB THR A 32 -11.597 -34.653 26.367 1.00 0.00 C ATOM 510 OG1 THR A 32 -11.973 -35.228 27.626 1.00 0.00 O ATOM 511 CG2 THR A 32 -12.271 -33.290 26.210 1.00 0.00 C ATOM 0 H THR A 32 -11.269 -37.089 26.522 1.00 0.00 H new ATOM 0 HA THR A 32 -13.072 -35.582 25.076 1.00 0.00 H new ATOM 0 HB THR A 32 -10.518 -34.505 26.327 1.00 0.00 H new ATOM 0 HG1 THR A 32 -11.721 -34.619 28.352 1.00 0.00 H new ATOM 0 HG21 THR A 32 -11.971 -32.639 27.031 1.00 0.00 H new ATOM 0 HG22 THR A 32 -11.970 -32.842 25.263 1.00 0.00 H new ATOM 0 HG23 THR A 32 -13.354 -33.416 26.224 1.00 0.00 H new ATOM 519 N LEU A 33 -10.076 -35.653 23.733 1.00 0.00 N ATOM 520 CA LEU A 33 -9.300 -35.354 22.534 1.00 0.00 C ATOM 521 C LEU A 33 -10.047 -35.813 21.284 1.00 0.00 C ATOM 522 O LEU A 33 -10.295 -35.026 20.375 1.00 0.00 O ATOM 523 CB LEU A 33 -7.926 -36.037 22.613 1.00 0.00 C ATOM 524 CG LEU A 33 -7.003 -35.822 21.399 1.00 0.00 C ATOM 525 CD1 LEU A 33 -6.706 -34.337 21.191 1.00 0.00 C ATOM 526 CD2 LEU A 33 -5.706 -36.616 21.558 1.00 0.00 C ATOM 0 H LEU A 33 -9.594 -36.253 24.402 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.156 -34.275 22.472 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.413 -35.677 23.505 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.080 -37.108 22.744 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.522 -36.188 20.513 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.052 -34.214 20.327 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -7.639 -33.800 21.019 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -6.215 -33.937 22.078 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.069 -36.450 20.689 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.186 -36.287 22.458 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.937 -37.678 21.640 1.00 0.00 H new ATOM 538 N LYS A 34 -10.425 -37.086 21.258 1.00 0.00 N ATOM 539 CA LYS A 34 -11.112 -37.653 20.101 1.00 0.00 C ATOM 540 C LYS A 34 -12.471 -36.989 19.905 1.00 0.00 C ATOM 541 O LYS A 34 -12.868 -36.702 18.777 1.00 0.00 O ATOM 542 CB LYS A 34 -11.283 -39.166 20.260 1.00 0.00 C ATOM 543 CG LYS A 34 -9.961 -39.929 20.333 1.00 0.00 C ATOM 544 CD LYS A 34 -10.179 -41.433 20.475 1.00 0.00 C ATOM 545 CE LYS A 34 -10.970 -41.775 21.730 1.00 0.00 C ATOM 546 NZ LYS A 34 -11.138 -43.241 21.906 1.00 0.00 N ATOM 0 H LYS A 34 -10.269 -37.744 22.022 1.00 0.00 H new ATOM 0 HA LYS A 34 -10.500 -37.464 19.219 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -11.858 -39.365 21.165 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.866 -39.547 19.422 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -9.377 -39.730 19.434 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -9.378 -39.565 21.179 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -10.708 -41.808 19.599 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -9.214 -41.939 20.505 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -10.462 -41.362 22.601 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -11.951 -41.302 21.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -11.682 -43.426 22.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -11.646 -43.633 21.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -10.203 -43.691 21.981 1.00 0.00 H new ATOM 560 N GLU A 35 -13.166 -36.728 21.011 1.00 0.00 N ATOM 561 CA GLU A 35 -14.492 -36.117 20.960 1.00 0.00 C ATOM 562 C GLU A 35 -14.464 -34.808 20.173 1.00 0.00 C ATOM 563 O GLU A 35 -15.289 -34.603 19.276 1.00 0.00 O ATOM 564 CB GLU A 35 -15.040 -35.869 22.374 1.00 0.00 C ATOM 565 CG GLU A 35 -15.360 -37.145 23.148 1.00 0.00 C ATOM 566 CD GLU A 35 -16.348 -38.050 22.422 1.00 0.00 C ATOM 567 OE1 GLU A 35 -17.401 -37.552 21.961 1.00 0.00 O ATOM 568 OE2 GLU A 35 -16.087 -39.267 22.320 1.00 0.00 O ATOM 0 H GLU A 35 -12.832 -36.930 21.953 1.00 0.00 H new ATOM 0 HA GLU A 35 -15.154 -36.815 20.448 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -14.311 -35.287 22.938 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -15.944 -35.264 22.301 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -14.437 -37.695 23.328 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -15.768 -36.879 24.123 1.00 0.00 H new ATOM 575 N LEU A 36 -13.507 -33.936 20.491 1.00 0.00 N ATOM 576 CA LEU A 36 -13.407 -32.636 19.829 1.00 0.00 C ATOM 577 C LEU A 36 -13.091 -32.830 18.344 1.00 0.00 C ATOM 578 O LEU A 36 -13.541 -32.063 17.501 1.00 0.00 O ATOM 579 CB LEU A 36 -12.349 -31.742 20.522 1.00 0.00 C ATOM 580 CG LEU A 36 -10.869 -31.992 20.148 1.00 0.00 C ATOM 581 CD1 LEU A 36 -10.441 -31.127 18.960 1.00 0.00 C ATOM 582 CD2 LEU A 36 -9.958 -31.746 21.348 1.00 0.00 C ATOM 0 H LEU A 36 -12.793 -34.105 21.200 1.00 0.00 H new ATOM 0 HA LEU A 36 -14.366 -32.124 19.911 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.585 -30.702 20.298 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -12.452 -31.867 21.600 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.774 -33.037 19.852 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -9.396 -31.326 18.722 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -11.061 -31.364 18.095 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -10.560 -30.074 19.215 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -8.922 -31.928 21.062 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -10.066 -30.714 21.682 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -10.234 -32.420 22.159 1.00 0.00 H new ATOM 594 N LEU A 37 -12.336 -33.880 18.031 1.00 0.00 N ATOM 595 CA LEU A 37 -11.995 -34.199 16.645 1.00 0.00 C ATOM 596 C LEU A 37 -13.239 -34.665 15.889 1.00 0.00 C ATOM 597 O LEU A 37 -13.480 -34.271 14.744 1.00 0.00 O ATOM 598 CB LEU A 37 -10.924 -35.301 16.598 1.00 0.00 C ATOM 599 CG LEU A 37 -9.632 -35.005 17.377 1.00 0.00 C ATOM 600 CD1 LEU A 37 -8.711 -36.222 17.377 1.00 0.00 C ATOM 601 CD2 LEU A 37 -8.916 -33.784 16.803 1.00 0.00 C ATOM 0 H LEU A 37 -11.948 -34.526 18.718 1.00 0.00 H new ATOM 0 HA LEU A 37 -11.602 -33.299 16.172 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.359 -36.222 16.987 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -10.664 -35.486 15.556 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.903 -34.782 18.409 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.803 -35.991 17.934 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.220 -37.064 17.847 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.451 -36.482 16.351 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.005 -33.596 17.371 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.661 -33.969 15.760 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.570 -32.915 16.868 1.00 0.00 H new ATOM 613 N GLU A 38 -14.041 -35.487 16.561 1.00 0.00 N ATOM 614 CA GLU A 38 -15.201 -36.125 15.947 1.00 0.00 C ATOM 615 C GLU A 38 -16.356 -35.144 15.749 1.00 0.00 C ATOM 616 O GLU A 38 -17.237 -35.391 14.927 1.00 0.00 O ATOM 617 CB GLU A 38 -15.649 -37.330 16.787 1.00 0.00 C ATOM 618 CG GLU A 38 -14.584 -38.419 16.888 1.00 0.00 C ATOM 619 CD GLU A 38 -15.063 -39.664 17.615 1.00 0.00 C ATOM 620 OE1 GLU A 38 -15.701 -40.526 16.971 1.00 0.00 O ATOM 621 OE2 GLU A 38 -14.795 -39.801 18.827 1.00 0.00 O ATOM 0 H GLU A 38 -13.905 -35.729 17.543 1.00 0.00 H new ATOM 0 HA GLU A 38 -14.903 -36.472 14.958 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -15.909 -36.990 17.790 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -16.553 -37.754 16.350 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -14.260 -38.695 15.884 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -13.712 -38.018 17.405 1.00 0.00 H new ATOM 628 N THR A 39 -16.356 -34.032 16.487 1.00 0.00 N ATOM 629 CA THR A 39 -17.403 -33.018 16.323 1.00 0.00 C ATOM 630 C THR A 39 -17.363 -32.406 14.920 1.00 0.00 C ATOM 631 O THR A 39 -18.390 -31.974 14.387 1.00 0.00 O ATOM 632 CB THR A 39 -17.302 -31.895 17.383 1.00 0.00 C ATOM 633 OG1 THR A 39 -16.002 -31.292 17.353 1.00 0.00 O ATOM 634 CG2 THR A 39 -17.583 -32.431 18.782 1.00 0.00 C ATOM 0 H THR A 39 -15.655 -33.811 17.194 1.00 0.00 H new ATOM 0 HA THR A 39 -18.354 -33.531 16.464 1.00 0.00 H new ATOM 0 HB THR A 39 -18.054 -31.144 17.141 1.00 0.00 H new ATOM 0 HG1 THR A 39 -15.327 -31.957 17.605 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.505 -31.619 19.505 1.00 0.00 H new ATOM 0 HG22 THR A 39 -18.588 -32.851 18.816 1.00 0.00 H new ATOM 0 HG23 THR A 39 -16.857 -33.206 19.027 1.00 0.00 H new ATOM 642 N TYR A 40 -16.170 -32.391 14.318 1.00 0.00 N ATOM 643 CA TYR A 40 -16.000 -31.901 12.949 1.00 0.00 C ATOM 644 C TYR A 40 -16.530 -32.932 11.954 1.00 0.00 C ATOM 645 O TYR A 40 -16.648 -32.658 10.755 1.00 0.00 O ATOM 646 CB TYR A 40 -14.522 -31.586 12.665 1.00 0.00 C ATOM 647 CG TYR A 40 -13.956 -30.490 13.551 1.00 0.00 C ATOM 648 CD1 TYR A 40 -13.437 -30.784 14.806 1.00 0.00 C ATOM 649 CD2 TYR A 40 -13.953 -29.159 13.139 1.00 0.00 C ATOM 650 CE1 TYR A 40 -12.933 -29.791 15.623 1.00 0.00 C ATOM 651 CE2 TYR A 40 -13.450 -28.160 13.953 1.00 0.00 C ATOM 652 CZ TYR A 40 -12.943 -28.482 15.193 1.00 0.00 C ATOM 653 OH TYR A 40 -12.449 -27.490 16.007 1.00 0.00 O ATOM 0 H TYR A 40 -15.308 -32.713 14.758 1.00 0.00 H new ATOM 0 HA TYR A 40 -16.571 -30.979 12.835 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -13.933 -32.493 12.801 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.416 -31.290 11.621 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.428 -31.808 15.149 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.350 -28.903 12.168 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.533 -30.039 16.595 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.455 -27.133 13.618 1.00 0.00 H new ATOM 0 HH TYR A 40 -11.924 -27.892 16.730 1.00 0.00 H new ATOM 663 N GLN A 41 -16.845 -34.122 12.474 1.00 0.00 N ATOM 664 CA GLN A 41 -17.441 -35.205 11.694 1.00 0.00 C ATOM 665 C GLN A 41 -16.519 -35.630 10.556 1.00 0.00 C ATOM 666 O GLN A 41 -16.971 -36.127 9.523 1.00 0.00 O ATOM 667 CB GLN A 41 -18.821 -34.783 11.163 1.00 0.00 C ATOM 668 CG GLN A 41 -19.773 -34.319 12.263 1.00 0.00 C ATOM 669 CD GLN A 41 -19.983 -35.368 13.346 1.00 0.00 C ATOM 670 OE1 GLN A 41 -19.953 -36.570 13.079 1.00 0.00 O ATOM 671 NE2 GLN A 41 -20.183 -34.925 14.577 1.00 0.00 N ATOM 0 H GLN A 41 -16.692 -34.360 13.454 1.00 0.00 H new ATOM 0 HA GLN A 41 -17.575 -36.067 12.347 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -18.694 -33.979 10.438 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -19.271 -35.622 10.632 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -19.380 -33.409 12.717 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -20.736 -34.064 11.820 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -20.202 -33.922 14.761 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -20.318 -35.587 15.341 1.00 0.00 H new ATOM 680 N ARG A 42 -15.219 -35.448 10.767 1.00 0.00 N ATOM 681 CA ARG A 42 -14.215 -35.827 9.780 1.00 0.00 C ATOM 682 C ARG A 42 -13.338 -36.957 10.326 1.00 0.00 C ATOM 683 O ARG A 42 -13.256 -37.147 11.544 1.00 0.00 O ATOM 684 CB ARG A 42 -13.341 -34.619 9.404 1.00 0.00 C ATOM 685 CG ARG A 42 -12.419 -34.143 10.525 1.00 0.00 C ATOM 686 CD ARG A 42 -11.347 -33.183 10.013 1.00 0.00 C ATOM 687 NE ARG A 42 -11.866 -31.848 9.694 1.00 0.00 N ATOM 688 CZ ARG A 42 -12.243 -31.449 8.474 1.00 0.00 C ATOM 689 NH1 ARG A 42 -12.316 -32.314 7.465 1.00 0.00 N ATOM 690 NH2 ARG A 42 -12.553 -30.177 8.261 1.00 0.00 N ATOM 0 H ARG A 42 -14.835 -35.038 11.618 1.00 0.00 H new ATOM 0 HA ARG A 42 -14.729 -36.176 8.884 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.735 -34.879 8.536 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -13.989 -33.794 9.106 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -13.010 -33.649 11.296 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.942 -35.004 10.992 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -10.564 -33.090 10.765 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -10.885 -33.608 9.122 1.00 0.00 H new ATOM 0 HE ARG A 42 -11.945 -31.176 10.457 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -12.083 -33.295 7.617 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -12.605 -31.996 6.540 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -12.504 -29.505 9.027 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -12.841 -29.871 7.331 1.00 0.00 H new ATOM 704 N PRO A 43 -12.689 -37.737 9.438 1.00 0.00 N ATOM 705 CA PRO A 43 -11.746 -38.786 9.849 1.00 0.00 C ATOM 706 C PRO A 43 -10.445 -38.196 10.399 1.00 0.00 C ATOM 707 O PRO A 43 -10.105 -37.042 10.114 1.00 0.00 O ATOM 708 CB PRO A 43 -11.489 -39.565 8.551 1.00 0.00 C ATOM 709 CG PRO A 43 -11.728 -38.571 7.466 1.00 0.00 C ATOM 710 CD PRO A 43 -12.828 -37.671 7.965 1.00 0.00 C ATOM 0 HA PRO A 43 -12.140 -39.408 10.653 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -10.471 -39.954 8.516 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -12.160 -40.419 8.461 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -10.824 -38.001 7.252 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -12.019 -39.066 6.540 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -12.711 -36.652 7.596 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -13.809 -38.017 7.639 1.00 0.00 H new ATOM 718 N PHE A 44 -9.730 -38.988 11.193 1.00 0.00 N ATOM 719 CA PHE A 44 -8.456 -38.565 11.763 1.00 0.00 C ATOM 720 C PHE A 44 -7.566 -39.774 12.043 1.00 0.00 C ATOM 721 O PHE A 44 -8.033 -40.920 12.078 1.00 0.00 O ATOM 722 CB PHE A 44 -8.678 -37.753 13.054 1.00 0.00 C ATOM 723 CG PHE A 44 -9.406 -38.502 14.150 1.00 0.00 C ATOM 724 CD1 PHE A 44 -10.793 -38.471 14.231 1.00 0.00 C ATOM 725 CD2 PHE A 44 -8.704 -39.235 15.101 1.00 0.00 C ATOM 726 CE1 PHE A 44 -11.460 -39.153 15.232 1.00 0.00 C ATOM 727 CE2 PHE A 44 -9.370 -39.917 16.104 1.00 0.00 C ATOM 728 CZ PHE A 44 -10.748 -39.875 16.168 1.00 0.00 C ATOM 0 H PHE A 44 -10.014 -39.931 11.457 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.955 -37.925 11.037 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -7.710 -37.428 13.435 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -9.243 -36.853 12.810 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -11.357 -37.907 13.503 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -7.626 -39.272 15.056 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -12.538 -39.121 15.281 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -8.812 -40.482 16.836 1.00 0.00 H new ATOM 0 HZ PHE A 44 -11.269 -40.407 16.950 1.00 0.00 H new ATOM 738 N LYS A 45 -6.280 -39.510 12.237 1.00 0.00 N ATOM 739 CA LYS A 45 -5.305 -40.543 12.558 1.00 0.00 C ATOM 740 C LYS A 45 -4.744 -40.298 13.956 1.00 0.00 C ATOM 741 O LYS A 45 -3.940 -39.387 14.158 1.00 0.00 O ATOM 742 CB LYS A 45 -4.175 -40.541 11.516 1.00 0.00 C ATOM 743 CG LYS A 45 -3.136 -41.645 11.712 1.00 0.00 C ATOM 744 CD LYS A 45 -2.018 -41.558 10.671 1.00 0.00 C ATOM 745 CE LYS A 45 -1.241 -40.250 10.784 1.00 0.00 C ATOM 746 NZ LYS A 45 -0.201 -40.110 9.730 1.00 0.00 N ATOM 0 H LYS A 45 -5.884 -38.572 12.176 1.00 0.00 H new ATOM 0 HA LYS A 45 -5.790 -41.519 12.538 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -4.612 -40.642 10.523 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -3.671 -39.575 11.545 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -2.709 -41.570 12.712 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -3.622 -42.619 11.645 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -1.336 -42.398 10.799 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -2.444 -41.643 9.671 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -1.935 -39.412 10.718 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -0.769 -40.196 11.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 0.297 -39.205 9.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.479 -40.893 9.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -0.651 -40.134 8.793 1.00 0.00 H new ATOM 760 N LEU A 46 -5.207 -41.087 14.923 1.00 0.00 N ATOM 761 CA LEU A 46 -4.738 -40.984 16.302 1.00 0.00 C ATOM 762 C LEU A 46 -3.554 -41.921 16.518 1.00 0.00 C ATOM 763 O LEU A 46 -3.676 -43.136 16.337 1.00 0.00 O ATOM 764 CB LEU A 46 -5.869 -41.334 17.282 1.00 0.00 C ATOM 765 CG LEU A 46 -5.494 -41.264 18.775 1.00 0.00 C ATOM 766 CD1 LEU A 46 -5.177 -39.828 19.193 1.00 0.00 C ATOM 767 CD2 LEU A 46 -6.609 -41.846 19.641 1.00 0.00 C ATOM 0 H LEU A 46 -5.912 -41.809 14.775 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.422 -39.957 16.488 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -6.705 -40.658 17.102 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -6.221 -42.341 17.060 1.00 0.00 H new ATOM 0 HG LEU A 46 -4.597 -41.864 18.925 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.915 -39.806 20.251 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -4.339 -39.454 18.604 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.050 -39.198 19.022 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -6.323 -41.786 20.691 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.526 -41.279 19.482 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.775 -42.888 19.369 1.00 0.00 H new ATOM 779 N GLU A 47 -2.410 -41.358 16.896 1.00 0.00 N ATOM 780 CA GLU A 47 -1.201 -42.145 17.116 1.00 0.00 C ATOM 781 C GLU A 47 -0.623 -41.876 18.501 1.00 0.00 C ATOM 782 O GLU A 47 -0.633 -40.739 18.971 1.00 0.00 O ATOM 783 CB GLU A 47 -0.140 -41.797 16.063 1.00 0.00 C ATOM 784 CG GLU A 47 -0.637 -41.865 14.626 1.00 0.00 C ATOM 785 CD GLU A 47 0.464 -41.552 13.629 1.00 0.00 C ATOM 786 OE1 GLU A 47 0.926 -40.392 13.588 1.00 0.00 O ATOM 787 OE2 GLU A 47 0.895 -42.470 12.901 1.00 0.00 O ATOM 0 H GLU A 47 -2.295 -40.357 17.057 1.00 0.00 H new ATOM 0 HA GLU A 47 -1.471 -43.198 17.036 1.00 0.00 H new ATOM 0 HB2 GLU A 47 0.233 -40.792 16.259 1.00 0.00 H new ATOM 0 HB3 GLU A 47 0.704 -42.478 16.176 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -1.035 -42.860 14.427 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -1.458 -41.161 14.493 1.00 0.00 H new ATOM 794 N PHE A 48 -0.129 -42.922 19.150 1.00 0.00 N ATOM 795 CA PHE A 48 0.654 -42.771 20.372 1.00 0.00 C ATOM 796 C PHE A 48 2.109 -43.112 20.068 1.00 0.00 C ATOM 797 O PHE A 48 2.451 -44.277 19.853 1.00 0.00 O ATOM 798 CB PHE A 48 0.116 -43.669 21.496 1.00 0.00 C ATOM 799 CG PHE A 48 0.931 -43.593 22.766 1.00 0.00 C ATOM 800 CD1 PHE A 48 1.112 -42.381 23.418 1.00 0.00 C ATOM 801 CD2 PHE A 48 1.524 -44.729 23.301 1.00 0.00 C ATOM 802 CE1 PHE A 48 1.863 -42.305 24.575 1.00 0.00 C ATOM 803 CE2 PHE A 48 2.277 -44.656 24.457 1.00 0.00 C ATOM 804 CZ PHE A 48 2.447 -43.443 25.095 1.00 0.00 C ATOM 0 H PHE A 48 -0.257 -43.888 18.850 1.00 0.00 H new ATOM 0 HA PHE A 48 0.578 -41.740 20.717 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.913 -43.386 21.716 1.00 0.00 H new ATOM 0 HB3 PHE A 48 0.095 -44.702 21.148 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.660 -41.486 23.016 1.00 0.00 H new ATOM 0 HD2 PHE A 48 1.395 -45.681 22.807 1.00 0.00 H new ATOM 0 HE1 PHE A 48 1.993 -41.355 25.073 1.00 0.00 H new ATOM 0 HE2 PHE A 48 2.733 -45.548 24.862 1.00 0.00 H new ATOM 0 HZ PHE A 48 3.035 -43.385 25.999 1.00 0.00 H new ATOM 814 N LYS A 49 2.959 -42.092 20.039 1.00 0.00 N ATOM 815 CA LYS A 49 4.347 -42.270 19.632 1.00 0.00 C ATOM 816 C LYS A 49 5.151 -42.971 20.723 1.00 0.00 C ATOM 817 O LYS A 49 5.565 -44.122 20.557 1.00 0.00 O ATOM 818 CB LYS A 49 4.976 -40.915 19.274 1.00 0.00 C ATOM 819 CG LYS A 49 4.286 -40.215 18.102 1.00 0.00 C ATOM 820 CD LYS A 49 4.289 -41.083 16.842 1.00 0.00 C ATOM 821 CE LYS A 49 3.512 -40.440 15.697 1.00 0.00 C ATOM 822 NZ LYS A 49 3.430 -41.337 14.511 1.00 0.00 N ATOM 0 H LYS A 49 2.712 -41.135 20.292 1.00 0.00 H new ATOM 0 HA LYS A 49 4.366 -42.904 18.746 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.941 -40.264 20.148 1.00 0.00 H new ATOM 0 HB3 LYS A 49 6.028 -41.064 19.030 1.00 0.00 H new ATOM 0 HG2 LYS A 49 3.259 -39.975 18.376 1.00 0.00 H new ATOM 0 HG3 LYS A 49 4.790 -39.271 17.895 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.317 -41.259 16.527 1.00 0.00 H new ATOM 0 HD3 LYS A 49 3.855 -42.056 17.072 1.00 0.00 H new ATOM 0 HE2 LYS A 49 2.506 -40.192 16.035 1.00 0.00 H new ATOM 0 HE3 LYS A 49 3.993 -39.504 15.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 2.880 -40.871 13.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 4.389 -41.540 14.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 2.964 -42.227 14.780 1.00 0.00 H new ATOM 836 N ASN A 50 5.345 -42.289 21.845 1.00 0.00 N ATOM 837 CA ASN A 50 6.143 -42.824 22.946 1.00 0.00 C ATOM 838 C ASN A 50 5.992 -41.925 24.172 1.00 0.00 C ATOM 839 O ASN A 50 5.627 -40.751 24.048 1.00 0.00 O ATOM 840 CB ASN A 50 7.628 -42.932 22.527 1.00 0.00 C ATOM 841 CG ASN A 50 8.472 -43.794 23.465 1.00 0.00 C ATOM 842 OD1 ASN A 50 8.208 -43.893 24.660 1.00 0.00 O ATOM 843 ND2 ASN A 50 9.496 -44.434 22.923 1.00 0.00 N ATOM 0 H ASN A 50 4.960 -41.361 22.019 1.00 0.00 H new ATOM 0 HA ASN A 50 5.787 -43.823 23.197 1.00 0.00 H new ATOM 0 HB2 ASN A 50 7.683 -43.346 21.520 1.00 0.00 H new ATOM 0 HB3 ASN A 50 8.057 -41.931 22.484 1.00 0.00 H new ATOM 0 HD21 ASN A 50 10.090 -45.028 23.501 1.00 0.00 H new ATOM 0 HD22 ASN A 50 9.691 -44.333 21.927 1.00 0.00 H new ATOM 850 N THR A 51 6.243 -42.481 25.348 1.00 0.00 N ATOM 851 CA THR A 51 6.196 -41.723 26.587 1.00 0.00 C ATOM 852 C THR A 51 7.568 -41.108 26.876 1.00 0.00 C ATOM 853 O THR A 51 8.603 -41.694 26.545 1.00 0.00 O ATOM 854 CB THR A 51 5.750 -42.615 27.773 1.00 0.00 C ATOM 855 OG1 THR A 51 5.559 -41.818 28.946 1.00 0.00 O ATOM 856 CG2 THR A 51 6.770 -43.716 28.062 1.00 0.00 C ATOM 0 H THR A 51 6.484 -43.465 25.469 1.00 0.00 H new ATOM 0 HA THR A 51 5.462 -40.926 26.471 1.00 0.00 H new ATOM 0 HB THR A 51 4.808 -43.088 27.494 1.00 0.00 H new ATOM 0 HG1 THR A 51 5.326 -40.903 28.685 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.424 -44.322 28.900 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.884 -44.347 27.181 1.00 0.00 H new ATOM 0 HG23 THR A 51 7.731 -43.266 28.312 1.00 0.00 H new ATOM 864 N SER A 52 7.571 -39.917 27.466 1.00 0.00 N ATOM 865 CA SER A 52 8.807 -39.209 27.772 1.00 0.00 C ATOM 866 C SER A 52 9.590 -39.913 28.888 1.00 0.00 C ATOM 867 O SER A 52 9.411 -39.611 30.071 1.00 0.00 O ATOM 868 CB SER A 52 8.493 -37.757 28.154 1.00 0.00 C ATOM 869 OG SER A 52 7.757 -37.113 27.121 1.00 0.00 O ATOM 0 H SER A 52 6.725 -39.420 27.743 1.00 0.00 H new ATOM 0 HA SER A 52 9.437 -39.211 26.882 1.00 0.00 H new ATOM 0 HB2 SER A 52 7.922 -37.735 29.082 1.00 0.00 H new ATOM 0 HB3 SER A 52 9.421 -37.215 28.338 1.00 0.00 H new ATOM 0 HG SER A 52 7.836 -36.141 27.220 1.00 0.00 H new ATOM 875 N LYS A 53 10.409 -40.892 28.481 1.00 0.00 N ATOM 876 CA LYS A 53 11.333 -41.623 29.362 1.00 0.00 C ATOM 877 C LYS A 53 10.679 -42.096 30.668 1.00 0.00 C ATOM 878 O LYS A 53 10.235 -43.238 30.767 1.00 0.00 O ATOM 879 CB LYS A 53 12.589 -40.783 29.655 1.00 0.00 C ATOM 880 CG LYS A 53 13.400 -40.442 28.407 1.00 0.00 C ATOM 881 CD LYS A 53 14.741 -39.774 28.729 1.00 0.00 C ATOM 882 CE LYS A 53 14.584 -38.374 29.326 1.00 0.00 C ATOM 883 NZ LYS A 53 14.160 -38.395 30.753 1.00 0.00 N ATOM 0 H LYS A 53 10.449 -41.205 27.511 1.00 0.00 H new ATOM 0 HA LYS A 53 11.625 -42.523 28.820 1.00 0.00 H new ATOM 0 HB2 LYS A 53 12.291 -39.858 30.148 1.00 0.00 H new ATOM 0 HB3 LYS A 53 13.225 -41.326 30.354 1.00 0.00 H new ATOM 0 HG2 LYS A 53 13.582 -41.354 27.838 1.00 0.00 H new ATOM 0 HG3 LYS A 53 12.814 -39.780 27.769 1.00 0.00 H new ATOM 0 HD2 LYS A 53 15.294 -40.401 29.428 1.00 0.00 H new ATOM 0 HD3 LYS A 53 15.337 -39.710 27.818 1.00 0.00 H new ATOM 0 HE2 LYS A 53 15.531 -37.841 29.242 1.00 0.00 H new ATOM 0 HE3 LYS A 53 13.851 -37.816 28.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.170 -38.084 30.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 14.248 -39.361 31.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.765 -37.754 31.305 1.00 0.00 H new ATOM 897 N ASN A 54 10.592 -41.203 31.653 1.00 0.00 N ATOM 898 CA ASN A 54 10.131 -41.561 33.000 1.00 0.00 C ATOM 899 C ASN A 54 8.597 -41.591 33.077 1.00 0.00 C ATOM 900 O ASN A 54 8.011 -41.443 34.155 1.00 0.00 O ATOM 901 CB ASN A 54 10.705 -40.558 34.017 1.00 0.00 C ATOM 902 CG ASN A 54 10.417 -40.932 35.465 1.00 0.00 C ATOM 903 OD1 ASN A 54 10.278 -42.111 35.807 1.00 0.00 O ATOM 904 ND2 ASN A 54 10.332 -39.931 36.324 1.00 0.00 N ATOM 0 H ASN A 54 10.836 -40.219 31.545 1.00 0.00 H new ATOM 0 HA ASN A 54 10.488 -42.563 33.237 1.00 0.00 H new ATOM 0 HB2 ASN A 54 11.783 -40.486 33.876 1.00 0.00 H new ATOM 0 HB3 ASN A 54 10.290 -39.570 33.815 1.00 0.00 H new ATOM 0 HD21 ASN A 54 10.146 -40.119 37.309 1.00 0.00 H new ATOM 0 HD22 ASN A 54 10.453 -38.971 36.002 1.00 0.00 H new ATOM 911 N ALA A 55 7.955 -41.794 31.926 1.00 0.00 N ATOM 912 CA ALA A 55 6.496 -41.877 31.839 1.00 0.00 C ATOM 913 C ALA A 55 5.839 -40.588 32.333 1.00 0.00 C ATOM 914 O ALA A 55 4.654 -40.573 32.675 1.00 0.00 O ATOM 915 CB ALA A 55 5.981 -43.081 32.623 1.00 0.00 C ATOM 0 H ALA A 55 8.430 -41.905 31.030 1.00 0.00 H new ATOM 0 HA ALA A 55 6.228 -42.007 30.791 1.00 0.00 H new ATOM 0 HB1 ALA A 55 4.895 -43.127 32.547 1.00 0.00 H new ATOM 0 HB2 ALA A 55 6.412 -43.994 32.213 1.00 0.00 H new ATOM 0 HB3 ALA A 55 6.268 -42.983 33.670 1.00 0.00 H new ATOM 921 N LYS A 56 6.618 -39.508 32.340 1.00 0.00 N ATOM 922 CA LYS A 56 6.157 -38.218 32.849 1.00 0.00 C ATOM 923 C LYS A 56 5.108 -37.616 31.915 1.00 0.00 C ATOM 924 O LYS A 56 4.114 -37.038 32.361 1.00 0.00 O ATOM 925 CB LYS A 56 7.347 -37.254 32.999 1.00 0.00 C ATOM 926 CG LYS A 56 7.011 -35.969 33.754 1.00 0.00 C ATOM 927 CD LYS A 56 6.622 -36.249 35.205 1.00 0.00 C ATOM 928 CE LYS A 56 7.779 -36.855 35.997 1.00 0.00 C ATOM 929 NZ LYS A 56 7.368 -37.250 37.371 1.00 0.00 N ATOM 0 H LYS A 56 7.578 -39.502 31.996 1.00 0.00 H new ATOM 0 HA LYS A 56 5.701 -38.374 33.827 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.155 -37.768 33.519 1.00 0.00 H new ATOM 0 HB3 LYS A 56 7.719 -36.995 32.008 1.00 0.00 H new ATOM 0 HG2 LYS A 56 7.870 -35.299 33.731 1.00 0.00 H new ATOM 0 HG3 LYS A 56 6.192 -35.455 33.251 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.302 -35.322 35.681 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.770 -36.929 35.228 1.00 0.00 H new ATOM 0 HE2 LYS A 56 8.162 -37.728 35.468 1.00 0.00 H new ATOM 0 HE3 LYS A 56 8.595 -36.134 36.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 8.183 -37.656 37.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.026 -36.413 37.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.607 -37.957 37.316 1.00 0.00 H new ATOM 943 N PHE A 57 5.342 -37.761 30.615 1.00 0.00 N ATOM 944 CA PHE A 57 4.436 -37.245 29.593 1.00 0.00 C ATOM 945 C PHE A 57 4.177 -38.315 28.541 1.00 0.00 C ATOM 946 O PHE A 57 5.022 -39.178 28.302 1.00 0.00 O ATOM 947 CB PHE A 57 5.026 -35.991 28.931 1.00 0.00 C ATOM 948 CG PHE A 57 5.332 -34.874 29.898 1.00 0.00 C ATOM 949 CD1 PHE A 57 4.310 -34.229 30.579 1.00 0.00 C ATOM 950 CD2 PHE A 57 6.640 -34.471 30.128 1.00 0.00 C ATOM 951 CE1 PHE A 57 4.587 -33.208 31.469 1.00 0.00 C ATOM 952 CE2 PHE A 57 6.919 -33.450 31.017 1.00 0.00 C ATOM 953 CZ PHE A 57 5.892 -32.818 31.686 1.00 0.00 C ATOM 0 H PHE A 57 6.162 -38.238 30.240 1.00 0.00 H new ATOM 0 HA PHE A 57 3.494 -36.974 30.069 1.00 0.00 H new ATOM 0 HB2 PHE A 57 5.942 -36.266 28.407 1.00 0.00 H new ATOM 0 HB3 PHE A 57 4.326 -35.626 28.179 1.00 0.00 H new ATOM 0 HD1 PHE A 57 3.286 -34.528 30.412 1.00 0.00 H new ATOM 0 HD2 PHE A 57 7.449 -34.961 29.606 1.00 0.00 H new ATOM 0 HE1 PHE A 57 3.782 -32.716 31.994 1.00 0.00 H new ATOM 0 HE2 PHE A 57 7.942 -33.147 31.188 1.00 0.00 H new ATOM 0 HZ PHE A 57 6.109 -32.019 32.379 1.00 0.00 H new ATOM 963 N TYR A 58 3.006 -38.265 27.923 1.00 0.00 N ATOM 964 CA TYR A 58 2.637 -39.214 26.879 1.00 0.00 C ATOM 965 C TYR A 58 2.406 -38.471 25.568 1.00 0.00 C ATOM 966 O TYR A 58 1.491 -37.652 25.459 1.00 0.00 O ATOM 967 CB TYR A 58 1.389 -40.000 27.303 1.00 0.00 C ATOM 968 CG TYR A 58 1.590 -40.764 28.601 1.00 0.00 C ATOM 969 CD1 TYR A 58 2.287 -41.969 28.618 1.00 0.00 C ATOM 970 CD2 TYR A 58 1.106 -40.273 29.808 1.00 0.00 C ATOM 971 CE1 TYR A 58 2.496 -42.656 29.798 1.00 0.00 C ATOM 972 CE2 TYR A 58 1.309 -40.959 30.992 1.00 0.00 C ATOM 973 CZ TYR A 58 2.006 -42.150 30.982 1.00 0.00 C ATOM 974 OH TYR A 58 2.220 -42.833 32.159 1.00 0.00 O ATOM 0 H TYR A 58 2.288 -37.571 28.128 1.00 0.00 H new ATOM 0 HA TYR A 58 3.448 -39.927 26.728 1.00 0.00 H new ATOM 0 HB2 TYR A 58 0.552 -39.311 27.418 1.00 0.00 H new ATOM 0 HB3 TYR A 58 1.119 -40.700 26.512 1.00 0.00 H new ATOM 0 HD1 TYR A 58 2.671 -42.373 27.693 1.00 0.00 H new ATOM 0 HD2 TYR A 58 0.562 -39.340 29.822 1.00 0.00 H new ATOM 0 HE1 TYR A 58 3.042 -43.588 29.792 1.00 0.00 H new ATOM 0 HE2 TYR A 58 0.924 -40.564 31.920 1.00 0.00 H new ATOM 0 HH TYR A 58 1.811 -42.341 32.902 1.00 0.00 H new ATOM 984 N SER A 59 3.257 -38.748 24.585 1.00 0.00 N ATOM 985 CA SER A 59 3.237 -38.032 23.316 1.00 0.00 C ATOM 986 C SER A 59 2.274 -38.683 22.323 1.00 0.00 C ATOM 987 O SER A 59 2.509 -39.798 21.844 1.00 0.00 O ATOM 988 CB SER A 59 4.650 -37.989 22.729 1.00 0.00 C ATOM 989 OG SER A 59 5.572 -37.437 23.655 1.00 0.00 O ATOM 0 H SER A 59 3.975 -39.470 24.645 1.00 0.00 H new ATOM 0 HA SER A 59 2.886 -37.017 23.501 1.00 0.00 H new ATOM 0 HB2 SER A 59 4.964 -38.996 22.455 1.00 0.00 H new ATOM 0 HB3 SER A 59 4.649 -37.396 21.815 1.00 0.00 H new ATOM 0 HG SER A 59 6.485 -37.567 23.324 1.00 0.00 H new ATOM 995 N PHE A 60 1.194 -37.971 22.018 1.00 0.00 N ATOM 996 CA PHE A 60 0.243 -38.386 20.996 1.00 0.00 C ATOM 997 C PHE A 60 0.426 -37.525 19.750 1.00 0.00 C ATOM 998 O PHE A 60 0.969 -36.419 19.823 1.00 0.00 O ATOM 999 CB PHE A 60 -1.204 -38.252 21.502 1.00 0.00 C ATOM 1000 CG PHE A 60 -1.537 -39.134 22.682 1.00 0.00 C ATOM 1001 CD1 PHE A 60 -1.932 -40.451 22.490 1.00 0.00 C ATOM 1002 CD2 PHE A 60 -1.465 -38.643 23.979 1.00 0.00 C ATOM 1003 CE1 PHE A 60 -2.246 -41.259 23.567 1.00 0.00 C ATOM 1004 CE2 PHE A 60 -1.778 -39.447 25.058 1.00 0.00 C ATOM 1005 CZ PHE A 60 -2.169 -40.757 24.852 1.00 0.00 C ATOM 0 H PHE A 60 0.954 -37.090 22.473 1.00 0.00 H new ATOM 0 HA PHE A 60 0.430 -39.433 20.757 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -1.385 -37.213 21.778 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -1.885 -38.488 20.684 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -1.995 -40.849 21.488 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -1.161 -37.620 24.146 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -2.551 -42.282 23.404 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.717 -39.053 26.062 1.00 0.00 H new ATOM 0 HZ PHE A 60 -2.414 -41.387 25.694 1.00 0.00 H new ATOM 1015 N ASN A 61 -0.019 -38.040 18.615 1.00 0.00 N ATOM 1016 CA ASN A 61 0.024 -37.305 17.357 1.00 0.00 C ATOM 1017 C ASN A 61 -1.300 -37.484 16.628 1.00 0.00 C ATOM 1018 O ASN A 61 -1.716 -38.613 16.356 1.00 0.00 O ATOM 1019 CB ASN A 61 1.185 -37.794 16.479 1.00 0.00 C ATOM 1020 CG ASN A 61 1.356 -36.964 15.211 1.00 0.00 C ATOM 1021 OD1 ASN A 61 2.090 -35.975 15.201 1.00 0.00 O ATOM 1022 ND2 ASN A 61 0.694 -37.367 14.134 1.00 0.00 N ATOM 0 H ASN A 61 -0.419 -38.975 18.538 1.00 0.00 H new ATOM 0 HA ASN A 61 0.185 -36.248 17.568 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.109 -37.763 17.056 1.00 0.00 H new ATOM 0 HB3 ASN A 61 1.015 -38.835 16.206 1.00 0.00 H new ATOM 0 HD21 ASN A 61 0.784 -36.852 13.258 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.095 -38.192 14.182 1.00 0.00 H new ATOM 1029 N VAL A 62 -1.965 -36.376 16.338 1.00 0.00 N ATOM 1030 CA VAL A 62 -3.258 -36.403 15.667 1.00 0.00 C ATOM 1031 C VAL A 62 -3.150 -35.797 14.274 1.00 0.00 C ATOM 1032 O VAL A 62 -2.786 -34.632 14.125 1.00 0.00 O ATOM 1033 CB VAL A 62 -4.329 -35.625 16.474 1.00 0.00 C ATOM 1034 CG1 VAL A 62 -5.661 -35.593 15.725 1.00 0.00 C ATOM 1035 CG2 VAL A 62 -4.503 -36.230 17.868 1.00 0.00 C ATOM 0 H VAL A 62 -1.628 -35.439 16.559 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.562 -37.447 15.592 1.00 0.00 H new ATOM 0 HB VAL A 62 -3.984 -34.598 16.590 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.395 -35.042 16.312 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.525 -35.103 14.761 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.014 -36.612 15.567 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.259 -35.668 18.417 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.818 -37.269 17.777 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -3.556 -36.184 18.405 1.00 0.00 H new ATOM 1045 N SER A 63 -3.456 -36.591 13.259 1.00 0.00 N ATOM 1046 CA SER A 63 -3.488 -36.108 11.886 1.00 0.00 C ATOM 1047 C SER A 63 -4.935 -36.004 11.419 1.00 0.00 C ATOM 1048 O SER A 63 -5.603 -37.020 11.232 1.00 0.00 O ATOM 1049 CB SER A 63 -2.702 -37.053 10.977 1.00 0.00 C ATOM 1050 OG SER A 63 -1.436 -37.355 11.538 1.00 0.00 O ATOM 0 H SER A 63 -3.687 -37.579 13.361 1.00 0.00 H new ATOM 0 HA SER A 63 -3.026 -35.122 11.839 1.00 0.00 H new ATOM 0 HB2 SER A 63 -3.267 -37.973 10.826 1.00 0.00 H new ATOM 0 HB3 SER A 63 -2.570 -36.596 9.996 1.00 0.00 H new ATOM 0 HG SER A 63 -0.814 -36.619 11.357 1.00 0.00 H new ATOM 1056 N MET A 64 -5.425 -34.782 11.258 1.00 0.00 N ATOM 1057 CA MET A 64 -6.805 -34.559 10.834 1.00 0.00 C ATOM 1058 C MET A 64 -6.853 -33.497 9.747 1.00 0.00 C ATOM 1059 O MET A 64 -5.913 -32.718 9.586 1.00 0.00 O ATOM 1060 CB MET A 64 -7.681 -34.141 12.026 1.00 0.00 C ATOM 1061 CG MET A 64 -7.349 -32.763 12.589 1.00 0.00 C ATOM 1062 SD MET A 64 -8.342 -32.338 14.033 1.00 0.00 S ATOM 1063 CE MET A 64 -10.002 -32.438 13.368 1.00 0.00 C ATOM 0 H MET A 64 -4.889 -33.928 11.414 1.00 0.00 H new ATOM 0 HA MET A 64 -7.197 -35.494 10.433 1.00 0.00 H new ATOM 0 HB2 MET A 64 -8.726 -34.153 11.717 1.00 0.00 H new ATOM 0 HB3 MET A 64 -7.574 -34.881 12.819 1.00 0.00 H new ATOM 0 HG2 MET A 64 -6.293 -32.731 12.858 1.00 0.00 H new ATOM 0 HG3 MET A 64 -7.504 -32.012 11.814 1.00 0.00 H new ATOM 0 HE1 MET A 64 -10.717 -32.114 14.124 1.00 0.00 H new ATOM 0 HE2 MET A 64 -10.083 -31.794 12.492 1.00 0.00 H new ATOM 0 HE3 MET A 64 -10.218 -33.467 13.082 1.00 0.00 H new ATOM 1073 N GLU A 65 -7.948 -33.478 9.001 1.00 0.00 N ATOM 1074 CA GLU A 65 -8.120 -32.525 7.912 1.00 0.00 C ATOM 1075 C GLU A 65 -8.388 -31.124 8.456 1.00 0.00 C ATOM 1076 O GLU A 65 -9.019 -30.964 9.503 1.00 0.00 O ATOM 1077 CB GLU A 65 -9.292 -32.943 7.023 1.00 0.00 C ATOM 1078 CG GLU A 65 -9.277 -34.404 6.604 1.00 0.00 C ATOM 1079 CD GLU A 65 -10.540 -34.789 5.857 1.00 0.00 C ATOM 1080 OE1 GLU A 65 -11.603 -34.902 6.504 1.00 0.00 O ATOM 1081 OE2 GLU A 65 -10.479 -34.963 4.621 1.00 0.00 O ATOM 0 H GLU A 65 -8.735 -34.114 9.130 1.00 0.00 H new ATOM 0 HA GLU A 65 -7.199 -32.514 7.328 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -10.223 -32.740 7.552 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -9.292 -32.322 6.128 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -8.409 -34.592 5.972 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -9.171 -35.034 7.487 1.00 0.00 H new ATOM 1088 N VAL A 66 -7.893 -30.122 7.742 1.00 0.00 N ATOM 1089 CA VAL A 66 -8.214 -28.728 8.016 1.00 0.00 C ATOM 1090 C VAL A 66 -8.545 -28.026 6.704 1.00 0.00 C ATOM 1091 O VAL A 66 -7.779 -28.110 5.743 1.00 0.00 O ATOM 1092 CB VAL A 66 -7.050 -27.992 8.733 1.00 0.00 C ATOM 1093 CG1 VAL A 66 -6.869 -28.527 10.151 1.00 0.00 C ATOM 1094 CG2 VAL A 66 -5.746 -28.121 7.941 1.00 0.00 C ATOM 0 H VAL A 66 -7.257 -30.253 6.956 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.073 -28.702 8.686 1.00 0.00 H new ATOM 0 HB VAL A 66 -7.307 -26.934 8.791 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.049 -27.999 10.637 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -7.787 -28.372 10.718 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -6.642 -29.592 10.112 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -4.948 -27.596 8.466 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.484 -29.174 7.841 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -5.877 -27.684 6.951 1.00 0.00 H new ATOM 1104 N SER A 67 -9.696 -27.365 6.656 1.00 0.00 N ATOM 1105 CA SER A 67 -10.150 -26.695 5.438 1.00 0.00 C ATOM 1106 C SER A 67 -9.482 -25.331 5.287 1.00 0.00 C ATOM 1107 O SER A 67 -9.353 -24.808 4.176 1.00 0.00 O ATOM 1108 CB SER A 67 -11.677 -26.547 5.454 1.00 0.00 C ATOM 1109 OG SER A 67 -12.160 -25.951 4.260 1.00 0.00 O ATOM 0 H SER A 67 -10.334 -27.277 7.447 1.00 0.00 H new ATOM 0 HA SER A 67 -9.866 -27.307 4.582 1.00 0.00 H new ATOM 0 HB2 SER A 67 -12.136 -27.527 5.583 1.00 0.00 H new ATOM 0 HB3 SER A 67 -11.975 -25.941 6.309 1.00 0.00 H new ATOM 0 HG SER A 67 -13.136 -25.874 4.304 1.00 0.00 H new ATOM 1115 N ASN A 68 -9.053 -24.763 6.409 1.00 0.00 N ATOM 1116 CA ASN A 68 -8.396 -23.460 6.420 1.00 0.00 C ATOM 1117 C ASN A 68 -7.647 -23.261 7.730 1.00 0.00 C ATOM 1118 O ASN A 68 -7.720 -24.105 8.632 1.00 0.00 O ATOM 1119 CB ASN A 68 -9.414 -22.325 6.213 1.00 0.00 C ATOM 1120 CG ASN A 68 -10.562 -22.355 7.211 1.00 0.00 C ATOM 1121 OD1 ASN A 68 -10.407 -22.793 8.352 1.00 0.00 O ATOM 1122 ND2 ASN A 68 -11.727 -21.890 6.786 1.00 0.00 N ATOM 0 H ASN A 68 -9.150 -25.189 7.331 1.00 0.00 H new ATOM 0 HA ASN A 68 -7.684 -23.432 5.595 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -8.900 -21.367 6.290 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -9.818 -22.389 5.203 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -12.533 -21.887 7.411 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -11.818 -21.535 5.834 1.00 0.00 H new ATOM 1129 N GLU A 69 -6.937 -22.144 7.835 1.00 0.00 N ATOM 1130 CA GLU A 69 -6.148 -21.845 9.024 1.00 0.00 C ATOM 1131 C GLU A 69 -7.059 -21.637 10.233 1.00 0.00 C ATOM 1132 O GLU A 69 -6.687 -21.946 11.367 1.00 0.00 O ATOM 1133 CB GLU A 69 -5.268 -20.607 8.796 1.00 0.00 C ATOM 1134 CG GLU A 69 -4.276 -20.344 9.925 1.00 0.00 C ATOM 1135 CD GLU A 69 -3.384 -19.142 9.663 1.00 0.00 C ATOM 1136 OE1 GLU A 69 -2.529 -19.219 8.756 1.00 0.00 O ATOM 1137 OE2 GLU A 69 -3.531 -18.116 10.358 1.00 0.00 O ATOM 0 H GLU A 69 -6.892 -21.429 7.109 1.00 0.00 H new ATOM 0 HA GLU A 69 -5.496 -22.696 9.223 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.719 -20.729 7.863 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.909 -19.733 8.676 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -4.824 -20.187 10.854 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -3.654 -21.227 10.068 1.00 0.00 H new ATOM 1144 N SER A 70 -8.260 -21.128 9.981 1.00 0.00 N ATOM 1145 CA SER A 70 -9.241 -20.909 11.036 1.00 0.00 C ATOM 1146 C SER A 70 -9.530 -22.217 11.773 1.00 0.00 C ATOM 1147 O SER A 70 -9.611 -22.243 13.004 1.00 0.00 O ATOM 1148 CB SER A 70 -10.535 -20.326 10.451 1.00 0.00 C ATOM 1149 OG SER A 70 -11.454 -19.974 11.474 1.00 0.00 O ATOM 0 H SER A 70 -8.578 -20.858 9.050 1.00 0.00 H new ATOM 0 HA SER A 70 -8.831 -20.193 11.748 1.00 0.00 H new ATOM 0 HB2 SER A 70 -10.301 -19.446 9.852 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.994 -21.054 9.782 1.00 0.00 H new ATOM 0 HG SER A 70 -12.267 -19.604 11.070 1.00 0.00 H new ATOM 1155 N GLU A 71 -9.666 -23.306 11.015 1.00 0.00 N ATOM 1156 CA GLU A 71 -9.941 -24.617 11.596 1.00 0.00 C ATOM 1157 C GLU A 71 -8.751 -25.126 12.400 1.00 0.00 C ATOM 1158 O GLU A 71 -8.922 -25.553 13.537 1.00 0.00 O ATOM 1159 CB GLU A 71 -10.344 -25.636 10.515 1.00 0.00 C ATOM 1160 CG GLU A 71 -11.796 -25.498 10.067 1.00 0.00 C ATOM 1161 CD GLU A 71 -12.213 -26.512 9.010 1.00 0.00 C ATOM 1162 OE1 GLU A 71 -11.652 -27.630 8.982 1.00 0.00 O ATOM 1163 OE2 GLU A 71 -13.117 -26.198 8.206 1.00 0.00 O ATOM 0 H GLU A 71 -9.590 -23.304 9.998 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.783 -24.500 12.278 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.691 -25.515 9.650 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -10.183 -26.644 10.898 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.446 -25.605 10.936 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -11.951 -24.493 9.674 1.00 0.00 H new ATOM 1170 N ARG A 72 -7.545 -25.061 11.832 1.00 0.00 N ATOM 1171 CA ARG A 72 -6.364 -25.576 12.530 1.00 0.00 C ATOM 1172 C ARG A 72 -6.168 -24.851 13.864 1.00 0.00 C ATOM 1173 O ARG A 72 -5.760 -25.457 14.856 1.00 0.00 O ATOM 1174 CB ARG A 72 -5.090 -25.462 11.674 1.00 0.00 C ATOM 1175 CG ARG A 72 -4.603 -24.034 11.455 1.00 0.00 C ATOM 1176 CD ARG A 72 -3.220 -23.988 10.816 1.00 0.00 C ATOM 1177 NE ARG A 72 -2.207 -24.651 11.644 1.00 0.00 N ATOM 1178 CZ ARG A 72 -1.648 -24.113 12.735 1.00 0.00 C ATOM 1179 NH1 ARG A 72 -2.038 -22.925 13.185 1.00 0.00 N ATOM 1180 NH2 ARG A 72 -0.706 -24.770 13.392 1.00 0.00 N ATOM 0 H ARG A 72 -7.361 -24.666 10.910 1.00 0.00 H new ATOM 0 HA ARG A 72 -6.540 -26.635 12.720 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -4.295 -26.035 12.150 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -5.277 -25.922 10.704 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -5.312 -23.504 10.820 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -4.577 -23.510 12.411 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -3.257 -24.466 9.837 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -2.931 -22.950 10.653 1.00 0.00 H new ATOM 0 HE ARG A 72 -1.908 -25.587 11.370 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -2.772 -22.411 12.698 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -1.603 -22.527 14.018 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -0.404 -25.689 13.068 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -0.282 -24.358 14.223 1.00 0.00 H new ATOM 1194 N ASN A 73 -6.480 -23.554 13.884 1.00 0.00 N ATOM 1195 CA ASN A 73 -6.353 -22.750 15.098 1.00 0.00 C ATOM 1196 C ASN A 73 -7.459 -23.111 16.088 1.00 0.00 C ATOM 1197 O ASN A 73 -7.213 -23.252 17.287 1.00 0.00 O ATOM 1198 CB ASN A 73 -6.405 -21.249 14.773 1.00 0.00 C ATOM 1199 CG ASN A 73 -5.275 -20.797 13.859 1.00 0.00 C ATOM 1200 OD1 ASN A 73 -4.196 -21.393 13.835 1.00 0.00 O ATOM 1201 ND2 ASN A 73 -5.509 -19.728 13.110 1.00 0.00 N ATOM 0 H ASN A 73 -6.822 -23.039 13.073 1.00 0.00 H new ATOM 0 HA ASN A 73 -5.385 -22.968 15.549 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -7.360 -21.018 14.301 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -6.363 -20.680 15.702 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -4.783 -19.373 12.487 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -6.415 -19.261 13.157 1.00 0.00 H new ATOM 1208 N GLU A 74 -8.677 -23.265 15.574 1.00 0.00 N ATOM 1209 CA GLU A 74 -9.823 -23.659 16.390 1.00 0.00 C ATOM 1210 C GLU A 74 -9.541 -24.988 17.092 1.00 0.00 C ATOM 1211 O GLU A 74 -9.640 -25.097 18.319 1.00 0.00 O ATOM 1212 CB GLU A 74 -11.074 -23.768 15.504 1.00 0.00 C ATOM 1213 CG GLU A 74 -12.320 -24.240 16.241 1.00 0.00 C ATOM 1214 CD GLU A 74 -13.569 -24.227 15.373 1.00 0.00 C ATOM 1215 OE1 GLU A 74 -13.847 -23.192 14.731 1.00 0.00 O ATOM 1216 OE2 GLU A 74 -14.298 -25.243 15.350 1.00 0.00 O ATOM 0 H GLU A 74 -8.897 -23.122 14.588 1.00 0.00 H new ATOM 0 HA GLU A 74 -9.998 -22.901 17.154 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.276 -22.794 15.058 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.867 -24.457 14.685 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -12.154 -25.251 16.612 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -12.483 -23.604 17.111 1.00 0.00 H new ATOM 1223 N ILE A 75 -9.159 -25.980 16.299 1.00 0.00 N ATOM 1224 CA ILE A 75 -8.831 -27.312 16.796 1.00 0.00 C ATOM 1225 C ILE A 75 -7.693 -27.241 17.814 1.00 0.00 C ATOM 1226 O ILE A 75 -7.769 -27.840 18.889 1.00 0.00 O ATOM 1227 CB ILE A 75 -8.430 -28.242 15.621 1.00 0.00 C ATOM 1228 CG1 ILE A 75 -9.571 -28.303 14.590 1.00 0.00 C ATOM 1229 CG2 ILE A 75 -8.079 -29.644 16.126 1.00 0.00 C ATOM 1230 CD1 ILE A 75 -9.177 -28.889 13.252 1.00 0.00 C ATOM 0 H ILE A 75 -9.067 -25.884 15.288 1.00 0.00 H new ATOM 0 HA ILE A 75 -9.714 -27.721 17.287 1.00 0.00 H new ATOM 0 HB ILE A 75 -7.542 -27.832 15.140 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -10.387 -28.894 15.005 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -9.955 -27.295 14.432 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -7.802 -30.276 15.282 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -7.243 -29.581 16.823 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -8.942 -30.075 16.633 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -10.041 -28.893 12.588 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -8.383 -28.286 12.810 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -8.822 -29.910 13.392 1.00 0.00 H new ATOM 1242 N PHE A 76 -6.655 -26.476 17.472 1.00 0.00 N ATOM 1243 CA PHE A 76 -5.489 -26.299 18.341 1.00 0.00 C ATOM 1244 C PHE A 76 -5.909 -25.854 19.744 1.00 0.00 C ATOM 1245 O PHE A 76 -5.350 -26.309 20.745 1.00 0.00 O ATOM 1246 CB PHE A 76 -4.528 -25.269 17.723 1.00 0.00 C ATOM 1247 CG PHE A 76 -3.334 -24.934 18.587 1.00 0.00 C ATOM 1248 CD1 PHE A 76 -2.244 -25.792 18.655 1.00 0.00 C ATOM 1249 CD2 PHE A 76 -3.301 -23.758 19.328 1.00 0.00 C ATOM 1250 CE1 PHE A 76 -1.151 -25.485 19.444 1.00 0.00 C ATOM 1251 CE2 PHE A 76 -2.210 -23.450 20.116 1.00 0.00 C ATOM 1252 CZ PHE A 76 -1.134 -24.313 20.174 1.00 0.00 C ATOM 0 H PHE A 76 -6.598 -25.965 16.591 1.00 0.00 H new ATOM 0 HA PHE A 76 -4.980 -27.259 18.431 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.173 -25.650 16.765 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.081 -24.352 17.516 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -2.250 -26.709 18.085 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -4.139 -23.077 19.287 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.311 -26.162 19.489 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -2.198 -22.534 20.687 1.00 0.00 H new ATOM 0 HZ PHE A 76 -0.280 -24.072 20.790 1.00 0.00 H new ATOM 1262 N GLN A 77 -6.907 -24.977 19.805 1.00 0.00 N ATOM 1263 CA GLN A 77 -7.375 -24.438 21.075 1.00 0.00 C ATOM 1264 C GLN A 77 -8.123 -25.510 21.859 1.00 0.00 C ATOM 1265 O GLN A 77 -7.916 -25.673 23.065 1.00 0.00 O ATOM 1266 CB GLN A 77 -8.275 -23.218 20.832 1.00 0.00 C ATOM 1267 CG GLN A 77 -7.557 -22.060 20.141 1.00 0.00 C ATOM 1268 CD GLN A 77 -8.489 -20.923 19.757 1.00 0.00 C ATOM 1269 OE1 GLN A 77 -8.709 -19.988 20.531 1.00 0.00 O ATOM 1270 NE2 GLN A 77 -9.036 -20.990 18.554 1.00 0.00 N ATOM 0 H GLN A 77 -7.407 -24.625 18.988 1.00 0.00 H new ATOM 0 HA GLN A 77 -6.514 -24.120 21.663 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -9.128 -23.521 20.225 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -8.671 -22.872 21.787 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -6.779 -21.677 20.802 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -7.059 -22.432 19.245 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -8.829 -21.780 17.943 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -9.665 -20.252 18.238 1.00 0.00 H new ATOM 1279 N LYS A 78 -8.966 -26.265 21.160 1.00 0.00 N ATOM 1280 CA LYS A 78 -9.781 -27.297 21.794 1.00 0.00 C ATOM 1281 C LYS A 78 -8.899 -28.395 22.382 1.00 0.00 C ATOM 1282 O LYS A 78 -9.175 -28.912 23.466 1.00 0.00 O ATOM 1283 CB LYS A 78 -10.780 -27.896 20.795 1.00 0.00 C ATOM 1284 CG LYS A 78 -11.642 -26.852 20.094 1.00 0.00 C ATOM 1285 CD LYS A 78 -12.922 -27.461 19.523 1.00 0.00 C ATOM 1286 CE LYS A 78 -13.857 -26.395 18.962 1.00 0.00 C ATOM 1287 NZ LYS A 78 -15.160 -26.969 18.533 1.00 0.00 N ATOM 0 H LYS A 78 -9.103 -26.181 20.153 1.00 0.00 H new ATOM 0 HA LYS A 78 -10.342 -26.831 22.604 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -10.233 -28.467 20.045 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -11.428 -28.598 21.319 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -11.899 -26.061 20.798 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -11.070 -26.389 19.290 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -12.667 -28.171 18.736 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -13.437 -28.022 20.303 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -14.029 -25.629 19.718 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -13.380 -25.904 18.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -15.766 -26.212 18.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -14.999 -27.682 17.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -15.628 -27.415 19.348 1.00 0.00 H new ATOM 1301 N ILE A 79 -7.827 -28.728 21.668 1.00 0.00 N ATOM 1302 CA ILE A 79 -6.878 -29.745 22.117 1.00 0.00 C ATOM 1303 C ILE A 79 -6.251 -29.356 23.462 1.00 0.00 C ATOM 1304 O ILE A 79 -5.870 -30.214 24.254 1.00 0.00 O ATOM 1305 CB ILE A 79 -5.766 -29.988 21.060 1.00 0.00 C ATOM 1306 CG1 ILE A 79 -6.380 -30.493 19.743 1.00 0.00 C ATOM 1307 CG2 ILE A 79 -4.727 -30.982 21.575 1.00 0.00 C ATOM 1308 CD1 ILE A 79 -5.369 -30.710 18.633 1.00 0.00 C ATOM 0 H ILE A 79 -7.592 -28.305 20.770 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.434 -30.673 22.247 1.00 0.00 H new ATOM 0 HB ILE A 79 -5.264 -29.039 20.874 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.902 -31.431 19.934 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -7.128 -29.776 19.404 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.960 -31.134 20.815 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -4.266 -30.590 22.482 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.212 -31.933 21.796 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -5.881 -31.066 17.739 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.864 -29.770 18.412 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.635 -31.451 18.949 1.00 0.00 H new ATOM 1320 N SER A 80 -6.139 -28.059 23.715 1.00 0.00 N ATOM 1321 CA SER A 80 -5.580 -27.574 24.973 1.00 0.00 C ATOM 1322 C SER A 80 -6.656 -27.524 26.066 1.00 0.00 C ATOM 1323 O SER A 80 -6.345 -27.512 27.261 1.00 0.00 O ATOM 1324 CB SER A 80 -4.953 -26.192 24.763 1.00 0.00 C ATOM 1325 OG SER A 80 -4.244 -25.759 25.916 1.00 0.00 O ATOM 0 H SER A 80 -6.427 -27.324 23.069 1.00 0.00 H new ATOM 0 HA SER A 80 -4.805 -28.266 25.302 1.00 0.00 H new ATOM 0 HB2 SER A 80 -4.276 -26.225 23.910 1.00 0.00 H new ATOM 0 HB3 SER A 80 -5.734 -25.470 24.523 1.00 0.00 H new ATOM 0 HG SER A 80 -3.855 -24.875 25.748 1.00 0.00 H new ATOM 1331 N GLN A 81 -7.921 -27.537 25.650 1.00 0.00 N ATOM 1332 CA GLN A 81 -9.049 -27.408 26.579 1.00 0.00 C ATOM 1333 C GLN A 81 -9.361 -28.728 27.288 1.00 0.00 C ATOM 1334 O GLN A 81 -10.358 -28.827 28.007 1.00 0.00 O ATOM 1335 CB GLN A 81 -10.294 -26.897 25.837 1.00 0.00 C ATOM 1336 CG GLN A 81 -10.153 -25.468 25.320 1.00 0.00 C ATOM 1337 CD GLN A 81 -11.389 -24.969 24.585 1.00 0.00 C ATOM 1338 OE1 GLN A 81 -11.704 -23.779 24.617 1.00 0.00 O ATOM 1339 NE2 GLN A 81 -12.093 -25.866 23.908 1.00 0.00 N ATOM 0 H GLN A 81 -8.194 -27.636 24.672 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.762 -26.685 27.343 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -10.504 -27.559 24.997 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -11.153 -26.949 26.506 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -9.945 -24.804 26.159 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -9.294 -25.414 24.651 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -11.803 -26.844 23.903 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -12.924 -25.578 23.392 1.00 0.00 H new ATOM 1348 N LEU A 82 -8.512 -29.734 27.093 1.00 0.00 N ATOM 1349 CA LEU A 82 -8.702 -31.031 27.743 1.00 0.00 C ATOM 1350 C LEU A 82 -8.250 -30.965 29.200 1.00 0.00 C ATOM 1351 O LEU A 82 -8.698 -31.757 30.032 1.00 0.00 O ATOM 1352 CB LEU A 82 -7.907 -32.130 27.020 1.00 0.00 C ATOM 1353 CG LEU A 82 -7.891 -32.034 25.487 1.00 0.00 C ATOM 1354 CD1 LEU A 82 -7.073 -33.170 24.880 1.00 0.00 C ATOM 1355 CD2 LEU A 82 -9.306 -32.015 24.919 1.00 0.00 C ATOM 0 H LEU A 82 -7.689 -29.678 26.493 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.764 -31.273 27.698 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.878 -32.106 27.379 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.320 -33.098 27.302 1.00 0.00 H new ATOM 0 HG LEU A 82 -7.414 -31.092 25.217 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -7.076 -33.081 23.794 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -6.048 -33.115 25.245 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -7.510 -34.127 25.167 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -9.261 -31.947 23.832 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -9.825 -32.930 25.204 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.845 -31.154 25.315 1.00 0.00 H new ATOM 1367 N ASP A 83 -7.334 -30.029 29.480 1.00 0.00 N ATOM 1368 CA ASP A 83 -6.710 -29.868 30.807 1.00 0.00 C ATOM 1369 C ASP A 83 -5.680 -30.974 31.076 1.00 0.00 C ATOM 1370 O ASP A 83 -4.631 -30.725 31.671 1.00 0.00 O ATOM 1371 CB ASP A 83 -7.760 -29.830 31.933 1.00 0.00 C ATOM 1372 CG ASP A 83 -7.136 -29.624 33.308 1.00 0.00 C ATOM 1373 OD1 ASP A 83 -6.837 -28.463 33.665 1.00 0.00 O ATOM 1374 OD2 ASP A 83 -6.939 -30.617 34.042 1.00 0.00 O ATOM 0 H ASP A 83 -7.000 -29.356 28.790 1.00 0.00 H new ATOM 0 HA ASP A 83 -6.193 -28.909 30.799 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -8.470 -29.027 31.736 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -8.325 -30.762 31.930 1.00 0.00 H new ATOM 1379 N LYS A 84 -5.980 -32.188 30.615 1.00 0.00 N ATOM 1380 CA LYS A 84 -5.094 -33.343 30.790 1.00 0.00 C ATOM 1381 C LYS A 84 -3.816 -33.167 29.964 1.00 0.00 C ATOM 1382 O LYS A 84 -2.840 -33.905 30.131 1.00 0.00 O ATOM 1383 CB LYS A 84 -5.822 -34.628 30.358 1.00 0.00 C ATOM 1384 CG LYS A 84 -7.278 -34.686 30.810 1.00 0.00 C ATOM 1385 CD LYS A 84 -8.000 -35.935 30.305 1.00 0.00 C ATOM 1386 CE LYS A 84 -7.842 -37.123 31.252 1.00 0.00 C ATOM 1387 NZ LYS A 84 -8.653 -38.292 30.816 1.00 0.00 N ATOM 0 H LYS A 84 -6.841 -32.400 30.111 1.00 0.00 H new ATOM 0 HA LYS A 84 -4.822 -33.419 31.843 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -5.784 -34.710 29.272 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -5.290 -35.490 30.761 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -7.318 -34.663 31.899 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -7.801 -33.799 30.453 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -9.060 -35.713 30.179 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -7.612 -36.203 29.322 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -6.791 -37.409 31.303 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -8.142 -36.828 32.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -8.599 -39.040 31.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -9.644 -38.001 30.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -8.284 -38.653 29.913 1.00 0.00 H new ATOM 1401 N VAL A 85 -3.841 -32.187 29.066 1.00 0.00 N ATOM 1402 CA VAL A 85 -2.716 -31.903 28.187 1.00 0.00 C ATOM 1403 C VAL A 85 -1.842 -30.796 28.773 1.00 0.00 C ATOM 1404 O VAL A 85 -2.347 -29.781 29.261 1.00 0.00 O ATOM 1405 CB VAL A 85 -3.209 -31.500 26.776 1.00 0.00 C ATOM 1406 CG1 VAL A 85 -4.105 -30.265 26.841 1.00 0.00 C ATOM 1407 CG2 VAL A 85 -2.034 -31.277 25.826 1.00 0.00 C ATOM 0 H VAL A 85 -4.641 -31.569 28.929 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.119 -32.811 28.100 1.00 0.00 H new ATOM 0 HB VAL A 85 -3.804 -32.324 26.382 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -4.437 -30.003 25.836 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -4.972 -30.477 27.466 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.546 -29.432 27.267 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -2.410 -30.995 24.842 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.399 -30.481 26.214 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.454 -32.196 25.743 1.00 0.00 H new ATOM 1417 N VAL A 86 -0.531 -31.002 28.735 1.00 0.00 N ATOM 1418 CA VAL A 86 0.417 -30.038 29.284 1.00 0.00 C ATOM 1419 C VAL A 86 1.015 -29.169 28.185 1.00 0.00 C ATOM 1420 O VAL A 86 1.400 -28.025 28.429 1.00 0.00 O ATOM 1421 CB VAL A 86 1.565 -30.739 30.053 1.00 0.00 C ATOM 1422 CG1 VAL A 86 1.020 -31.501 31.257 1.00 0.00 C ATOM 1423 CG2 VAL A 86 2.352 -31.668 29.128 1.00 0.00 C ATOM 0 H VAL A 86 -0.098 -31.831 28.328 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.142 -29.411 29.979 1.00 0.00 H new ATOM 0 HB VAL A 86 2.248 -29.972 30.418 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.842 -31.986 31.783 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.518 -30.806 31.930 1.00 0.00 H new ATOM 0 HG13 VAL A 86 0.310 -32.256 30.919 1.00 0.00 H new ATOM 0 HG21 VAL A 86 3.152 -32.149 29.690 1.00 0.00 H new ATOM 0 HG22 VAL A 86 1.685 -32.429 28.724 1.00 0.00 H new ATOM 0 HG23 VAL A 86 2.780 -31.089 28.310 1.00 0.00 H new ATOM 1433 N GLN A 87 1.087 -29.715 26.974 1.00 0.00 N ATOM 1434 CA GLN A 87 1.713 -29.016 25.860 1.00 0.00 C ATOM 1435 C GLN A 87 1.089 -29.442 24.532 1.00 0.00 C ATOM 1436 O GLN A 87 0.965 -30.637 24.245 1.00 0.00 O ATOM 1437 CB GLN A 87 3.225 -29.289 25.856 1.00 0.00 C ATOM 1438 CG GLN A 87 3.991 -28.513 24.793 1.00 0.00 C ATOM 1439 CD GLN A 87 5.493 -28.742 24.857 1.00 0.00 C ATOM 1440 OE1 GLN A 87 5.959 -29.809 25.264 1.00 0.00 O ATOM 1441 NE2 GLN A 87 6.262 -27.742 24.454 1.00 0.00 N ATOM 0 H GLN A 87 0.720 -30.638 26.741 1.00 0.00 H new ATOM 0 HA GLN A 87 1.546 -27.946 25.982 1.00 0.00 H new ATOM 0 HB2 GLN A 87 3.631 -29.040 26.836 1.00 0.00 H new ATOM 0 HB3 GLN A 87 3.391 -30.355 25.703 1.00 0.00 H new ATOM 0 HG2 GLN A 87 3.627 -28.802 23.807 1.00 0.00 H new ATOM 0 HG3 GLN A 87 3.786 -27.449 24.909 1.00 0.00 H new ATOM 0 HE21 GLN A 87 5.839 -26.874 24.124 1.00 0.00 H new ATOM 0 HE22 GLN A 87 7.277 -27.839 24.474 1.00 0.00 H new ATOM 1450 N THR A 88 0.685 -28.456 23.738 1.00 0.00 N ATOM 1451 CA THR A 88 0.097 -28.687 22.425 1.00 0.00 C ATOM 1452 C THR A 88 0.932 -28.003 21.344 1.00 0.00 C ATOM 1453 O THR A 88 1.087 -26.779 21.356 1.00 0.00 O ATOM 1454 CB THR A 88 -1.352 -28.144 22.370 1.00 0.00 C ATOM 1455 OG1 THR A 88 -1.378 -26.784 22.824 1.00 0.00 O ATOM 1456 CG2 THR A 88 -2.294 -28.979 23.228 1.00 0.00 C ATOM 0 H THR A 88 0.757 -27.470 23.989 1.00 0.00 H new ATOM 0 HA THR A 88 0.081 -29.762 22.248 1.00 0.00 H new ATOM 0 HB THR A 88 -1.690 -28.200 21.335 1.00 0.00 H new ATOM 0 HG1 THR A 88 -0.557 -26.329 22.542 1.00 0.00 H new ATOM 0 HG21 THR A 88 -3.302 -28.569 23.166 1.00 0.00 H new ATOM 0 HG22 THR A 88 -2.298 -30.008 22.869 1.00 0.00 H new ATOM 0 HG23 THR A 88 -1.957 -28.958 24.264 1.00 0.00 H new ATOM 1464 N LEU A 89 1.481 -28.790 20.423 1.00 0.00 N ATOM 1465 CA LEU A 89 2.255 -28.243 19.309 1.00 0.00 C ATOM 1466 C LEU A 89 1.464 -28.376 18.012 1.00 0.00 C ATOM 1467 O LEU A 89 1.322 -29.474 17.468 1.00 0.00 O ATOM 1468 CB LEU A 89 3.621 -28.942 19.161 1.00 0.00 C ATOM 1469 CG LEU A 89 4.583 -28.835 20.362 1.00 0.00 C ATOM 1470 CD1 LEU A 89 4.719 -27.386 20.829 1.00 0.00 C ATOM 1471 CD2 LEU A 89 4.140 -29.744 21.506 1.00 0.00 C ATOM 0 H LEU A 89 1.405 -29.807 20.424 1.00 0.00 H new ATOM 0 HA LEU A 89 2.441 -27.190 19.522 1.00 0.00 H new ATOM 0 HB2 LEU A 89 3.444 -29.998 18.959 1.00 0.00 H new ATOM 0 HB3 LEU A 89 4.122 -28.530 18.285 1.00 0.00 H new ATOM 0 HG LEU A 89 5.566 -29.173 20.033 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.403 -27.340 21.677 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.109 -26.776 20.014 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.742 -27.007 21.130 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.837 -29.647 22.338 1.00 0.00 H new ATOM 0 HD22 LEU A 89 3.141 -29.456 21.834 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.125 -30.779 21.164 1.00 0.00 H new