USER MOD reduce.3.24.130724 H: found=0, std=0, add=729, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 732 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 367 THR OG1 : rot -85:sc= 0.837 USER MOD Set 1.2: A 379 SER OG : rot 180:sc= 0.328 USER MOD Set 2.1: A 362 SER OG : rot -52:sc= 2.19 USER MOD Set 2.2: A 365 SER OG : rot 10:sc= 0.0787 USER MOD Set 3.1: A 333 THR OG1 : rot -50:sc= 1.65 USER MOD Set 3.2: A 336 CYS SG : rot 136:sc= 0.191 USER MOD Set 3.3: A 338 MET CE :methyl -172:sc= -0.84 (180deg=-1.38) USER MOD Single : A 311 SER OG : rot 31:sc= 0.188 USER MOD Single : A 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 334 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 343 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 344 THR OG1 : rot 75:sc= 1.08 USER MOD Single : A 345 LYS NZ :NH3+ -151:sc= 1.27 (180deg=1.17) USER MOD Single : A 349 GLN : amide:sc= -0.0555 K(o=-0.056,f=-0.63) USER MOD Single : A 352 SER OG : rot 180:sc= 0 USER MOD Single : A 354 THR OG1 : rot 180:sc= 0 USER MOD Single : A 355 ASN : amide:sc= -0.225 X(o=-0.23,f=-0.7) USER MOD Single : A 357 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 364 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 TYR OH : rot 180:sc= 0 USER MOD Single : A 374 GLN : amide:sc= -0.973! C(o=-0.97!,f=-2.7!) USER MOD Single : A 377 TYR OH : rot 180:sc= 0 USER MOD Single : A 378 TYR OH : rot 30:sc= 1.23 USER MOD Single : A 381 GLN : amide:sc= -0.0198 K(o=-0.02,f=-1.2) USER MOD Single : A 382 THR OG1 : rot 180:sc= 0.5 USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 387 GLN : amide:sc= -0.0325 K(o=-0.033,f=-0.85) USER MOD Single : A 390 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : B 377 ASN : amide:sc= 1.21 K(o=1.2,f=-6!) USER MOD Single : B 380 TYR OH : rot 180:sc= 0.593 USER MOD Single : B 381 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 26 N SER A 311 3.043 6.932 9.230 1.00 0.71 N ATOM 27 CA SER A 311 3.492 5.635 9.704 1.00 0.41 C ATOM 28 C SER A 311 4.368 4.950 8.663 1.00 0.34 C ATOM 29 O SER A 311 4.017 4.897 7.485 1.00 0.47 O ATOM 30 CB SER A 311 2.280 4.762 10.031 1.00 0.59 C ATOM 31 OG SER A 311 1.396 5.435 10.913 1.00 1.06 O ATOM 0 HA SER A 311 4.088 5.779 10.605 1.00 0.41 H new ATOM 0 HB2 SER A 311 1.755 4.502 9.112 1.00 0.59 H new ATOM 0 HB3 SER A 311 2.611 3.828 10.484 1.00 0.59 H new ATOM 0 HG SER A 311 1.450 6.401 10.756 1.00 1.06 H new ATOM 37 N PHE A 312 5.510 4.442 9.098 1.00 0.29 N ATOM 38 CA PHE A 312 6.410 3.723 8.211 1.00 0.27 C ATOM 39 C PHE A 312 6.376 2.235 8.516 1.00 0.26 C ATOM 40 O PHE A 312 6.630 1.814 9.645 1.00 0.34 O ATOM 41 CB PHE A 312 7.842 4.245 8.340 1.00 0.31 C ATOM 42 CG PHE A 312 8.056 5.588 7.704 1.00 0.34 C ATOM 43 CD1 PHE A 312 8.347 5.685 6.354 1.00 0.33 C ATOM 44 CD2 PHE A 312 7.968 6.751 8.452 1.00 0.45 C ATOM 45 CE1 PHE A 312 8.546 6.916 5.760 1.00 0.38 C ATOM 46 CE2 PHE A 312 8.167 7.984 7.864 1.00 0.52 C ATOM 47 CZ PHE A 312 8.456 8.068 6.516 1.00 0.47 C ATOM 0 H PHE A 312 5.836 4.515 10.062 1.00 0.29 H new ATOM 0 HA PHE A 312 6.073 3.887 7.187 1.00 0.27 H new ATOM 0 HB2 PHE A 312 8.102 4.308 9.397 1.00 0.31 H new ATOM 0 HB3 PHE A 312 8.524 3.526 7.886 1.00 0.31 H new ATOM 0 HD1 PHE A 312 8.419 4.787 5.758 1.00 0.33 H new ATOM 0 HD2 PHE A 312 7.741 6.692 9.506 1.00 0.45 H new ATOM 0 HE1 PHE A 312 8.772 6.977 4.706 1.00 0.38 H new ATOM 0 HE2 PHE A 312 8.097 8.883 8.458 1.00 0.52 H new ATOM 0 HZ PHE A 312 8.611 9.032 6.055 1.00 0.47 H new ATOM 57 N PHE A 313 6.052 1.448 7.505 1.00 0.24 N ATOM 58 CA PHE A 313 6.027 0.002 7.640 1.00 0.26 C ATOM 59 C PHE A 313 7.206 -0.614 6.906 1.00 0.26 C ATOM 60 O PHE A 313 7.414 -0.356 5.721 1.00 0.26 O ATOM 61 CB PHE A 313 4.718 -0.570 7.092 1.00 0.28 C ATOM 62 CG PHE A 313 3.501 -0.136 7.859 1.00 0.30 C ATOM 63 CD1 PHE A 313 3.045 -0.877 8.935 1.00 0.34 C ATOM 64 CD2 PHE A 313 2.811 1.012 7.499 1.00 0.32 C ATOM 65 CE1 PHE A 313 1.925 -0.482 9.641 1.00 0.40 C ATOM 66 CE2 PHE A 313 1.691 1.411 8.201 1.00 0.37 C ATOM 67 CZ PHE A 313 1.247 0.663 9.273 1.00 0.41 C ATOM 0 H PHE A 313 5.801 1.788 6.577 1.00 0.24 H new ATOM 0 HA PHE A 313 6.098 -0.243 8.700 1.00 0.26 H new ATOM 0 HB2 PHE A 313 4.607 -0.267 6.051 1.00 0.28 H new ATOM 0 HB3 PHE A 313 4.775 -1.658 7.103 1.00 0.28 H new ATOM 0 HD1 PHE A 313 3.571 -1.774 9.226 1.00 0.34 H new ATOM 0 HD2 PHE A 313 3.153 1.600 6.660 1.00 0.32 H new ATOM 0 HE1 PHE A 313 1.580 -1.068 10.480 1.00 0.40 H new ATOM 0 HE2 PHE A 313 1.163 2.307 7.912 1.00 0.37 H new ATOM 0 HZ PHE A 313 0.371 0.973 9.823 1.00 0.41 H new ATOM 77 N LEU A 314 7.982 -1.416 7.617 1.00 0.36 N ATOM 78 CA LEU A 314 9.117 -2.097 7.018 1.00 0.38 C ATOM 79 C LEU A 314 8.643 -3.365 6.322 1.00 0.37 C ATOM 80 O LEU A 314 8.542 -4.428 6.937 1.00 0.50 O ATOM 81 CB LEU A 314 10.173 -2.422 8.079 1.00 0.51 C ATOM 82 CG LEU A 314 11.461 -3.062 7.551 1.00 0.57 C ATOM 83 CD1 LEU A 314 12.150 -2.146 6.551 1.00 0.54 C ATOM 84 CD2 LEU A 314 12.396 -3.391 8.703 1.00 0.72 C ATOM 0 H LEU A 314 7.846 -1.611 8.609 1.00 0.36 H new ATOM 0 HA LEU A 314 9.577 -1.440 6.280 1.00 0.38 H new ATOM 0 HB2 LEU A 314 10.433 -1.502 8.602 1.00 0.51 H new ATOM 0 HB3 LEU A 314 9.730 -3.093 8.815 1.00 0.51 H new ATOM 0 HG LEU A 314 11.199 -3.987 7.038 1.00 0.57 H new ATOM 0 HD11 LEU A 314 13.062 -2.622 6.190 1.00 0.54 H new ATOM 0 HD12 LEU A 314 11.482 -1.957 5.711 1.00 0.54 H new ATOM 0 HD13 LEU A 314 12.400 -1.202 7.035 1.00 0.54 H new ATOM 0 HD21 LEU A 314 13.307 -3.845 8.314 1.00 0.72 H new ATOM 0 HD22 LEU A 314 12.647 -2.476 9.240 1.00 0.72 H new ATOM 0 HD23 LEU A 314 11.905 -4.088 9.382 1.00 0.72 H new ATOM 96 N VAL A 315 8.320 -3.233 5.047 1.00 0.26 N ATOM 97 CA VAL A 315 7.775 -4.337 4.275 1.00 0.26 C ATOM 98 C VAL A 315 8.845 -4.957 3.390 1.00 0.24 C ATOM 99 O VAL A 315 9.954 -4.429 3.275 1.00 0.27 O ATOM 100 CB VAL A 315 6.584 -3.881 3.400 1.00 0.26 C ATOM 101 CG1 VAL A 315 5.441 -3.384 4.272 1.00 0.30 C ATOM 102 CG2 VAL A 315 7.015 -2.799 2.417 1.00 0.23 C ATOM 0 H VAL A 315 8.427 -2.366 4.521 1.00 0.26 H new ATOM 0 HA VAL A 315 7.419 -5.083 4.986 1.00 0.26 H new ATOM 0 HB VAL A 315 6.235 -4.740 2.828 1.00 0.26 H new ATOM 0 HG11 VAL A 315 4.612 -3.067 3.639 1.00 0.30 H new ATOM 0 HG12 VAL A 315 5.109 -4.187 4.930 1.00 0.30 H new ATOM 0 HG13 VAL A 315 5.782 -2.541 4.873 1.00 0.30 H new ATOM 0 HG21 VAL A 315 6.160 -2.495 1.813 1.00 0.23 H new ATOM 0 HG22 VAL A 315 7.395 -1.938 2.967 1.00 0.23 H new ATOM 0 HG23 VAL A 315 7.798 -3.189 1.767 1.00 0.23 H new ATOM 112 N LYS A 316 8.513 -6.077 2.771 1.00 0.25 N ATOM 113 CA LYS A 316 9.449 -6.770 1.904 1.00 0.28 C ATOM 114 C LYS A 316 8.875 -6.903 0.498 1.00 0.28 C ATOM 115 O LYS A 316 7.909 -7.637 0.281 1.00 0.28 O ATOM 116 CB LYS A 316 9.771 -8.151 2.479 1.00 0.34 C ATOM 117 CG LYS A 316 10.362 -8.100 3.880 1.00 0.44 C ATOM 118 CD LYS A 316 10.580 -9.491 4.454 1.00 0.55 C ATOM 119 CE LYS A 316 11.598 -10.280 3.650 1.00 0.67 C ATOM 120 NZ LYS A 316 11.831 -11.630 4.226 1.00 1.44 N ATOM 0 H LYS A 316 7.601 -6.526 2.853 1.00 0.25 H new ATOM 0 HA LYS A 316 10.369 -6.188 1.847 1.00 0.28 H new ATOM 0 HB2 LYS A 316 8.860 -8.749 2.499 1.00 0.34 H new ATOM 0 HB3 LYS A 316 10.471 -8.658 1.816 1.00 0.34 H new ATOM 0 HG2 LYS A 316 11.311 -7.565 3.854 1.00 0.44 H new ATOM 0 HG3 LYS A 316 9.696 -7.537 4.535 1.00 0.44 H new ATOM 0 HD2 LYS A 316 10.918 -9.409 5.487 1.00 0.55 H new ATOM 0 HD3 LYS A 316 9.633 -10.030 4.470 1.00 0.55 H new ATOM 0 HE2 LYS A 316 11.251 -10.379 2.621 1.00 0.67 H new ATOM 0 HE3 LYS A 316 12.539 -9.731 3.617 1.00 0.67 H new ATOM 0 HZ1 LYS A 316 12.532 -12.137 3.649 1.00 1.44 H new ATOM 0 HZ2 LYS A 316 12.186 -11.536 5.199 1.00 1.44 H new ATOM 0 HZ3 LYS A 316 10.938 -12.163 4.234 1.00 1.44 H new ATOM 134 N GLU A 317 9.463 -6.181 -0.446 1.00 0.32 N ATOM 135 CA GLU A 317 9.020 -6.223 -1.833 1.00 0.37 C ATOM 136 C GLU A 317 9.662 -7.401 -2.555 1.00 0.45 C ATOM 137 O GLU A 317 10.879 -7.432 -2.755 1.00 0.48 O ATOM 138 CB GLU A 317 9.381 -4.923 -2.563 1.00 0.39 C ATOM 139 CG GLU A 317 8.828 -3.666 -1.909 1.00 0.41 C ATOM 140 CD GLU A 317 9.148 -2.407 -2.693 1.00 0.49 C ATOM 141 OE1 GLU A 317 10.287 -2.279 -3.193 1.00 0.70 O ATOM 142 OE2 GLU A 317 8.261 -1.539 -2.828 1.00 0.61 O ATOM 0 H GLU A 317 10.251 -5.557 -0.276 1.00 0.32 H new ATOM 0 HA GLU A 317 7.936 -6.339 -1.836 1.00 0.37 H new ATOM 0 HB2 GLU A 317 10.466 -4.841 -2.621 1.00 0.39 H new ATOM 0 HB3 GLU A 317 9.011 -4.979 -3.587 1.00 0.39 H new ATOM 0 HG2 GLU A 317 7.747 -3.760 -1.807 1.00 0.41 H new ATOM 0 HG3 GLU A 317 9.236 -3.576 -0.902 1.00 0.41 H new ATOM 275 N LEU A 325 13.906 -10.749 -1.190 1.00 0.61 N ATOM 276 CA LEU A 325 12.968 -9.638 -1.087 1.00 0.49 C ATOM 277 C LEU A 325 13.693 -8.372 -0.650 1.00 0.45 C ATOM 278 O LEU A 325 14.670 -8.433 0.103 1.00 0.55 O ATOM 279 CB LEU A 325 11.831 -9.951 -0.101 1.00 0.47 C ATOM 280 CG LEU A 325 10.855 -11.057 -0.528 1.00 0.53 C ATOM 281 CD1 LEU A 325 11.446 -12.438 -0.293 1.00 0.69 C ATOM 282 CD2 LEU A 325 9.534 -10.914 0.210 1.00 0.56 C ATOM 0 HA LEU A 325 12.531 -9.483 -2.074 1.00 0.49 H new ATOM 0 HB2 LEU A 325 12.273 -10.233 0.855 1.00 0.47 H new ATOM 0 HB3 LEU A 325 11.262 -9.037 0.068 1.00 0.47 H new ATOM 0 HG LEU A 325 10.674 -10.948 -1.597 1.00 0.53 H new ATOM 0 HD11 LEU A 325 10.730 -13.198 -0.606 1.00 0.69 H new ATOM 0 HD12 LEU A 325 12.364 -12.544 -0.871 1.00 0.69 H new ATOM 0 HD13 LEU A 325 11.668 -12.563 0.767 1.00 0.69 H new ATOM 0 HD21 LEU A 325 8.854 -11.706 -0.104 1.00 0.56 H new ATOM 0 HD22 LEU A 325 9.707 -10.989 1.284 1.00 0.56 H new ATOM 0 HD23 LEU A 325 9.092 -9.944 -0.019 1.00 0.56 H new ATOM 294 N VAL A 326 13.213 -7.230 -1.117 1.00 0.40 N ATOM 295 CA VAL A 326 13.838 -5.952 -0.809 1.00 0.38 C ATOM 296 C VAL A 326 13.093 -5.248 0.323 1.00 0.32 C ATOM 297 O VAL A 326 11.877 -5.064 0.250 1.00 0.29 O ATOM 298 CB VAL A 326 13.866 -5.031 -2.049 1.00 0.42 C ATOM 299 CG1 VAL A 326 14.628 -3.746 -1.756 1.00 0.45 C ATOM 300 CG2 VAL A 326 14.470 -5.755 -3.243 1.00 0.51 C ATOM 0 H VAL A 326 12.389 -7.162 -1.714 1.00 0.40 H new ATOM 0 HA VAL A 326 14.863 -6.156 -0.498 1.00 0.38 H new ATOM 0 HB VAL A 326 12.838 -4.765 -2.295 1.00 0.42 H new ATOM 0 HG11 VAL A 326 14.633 -3.115 -2.645 1.00 0.45 H new ATOM 0 HG12 VAL A 326 14.144 -3.215 -0.937 1.00 0.45 H new ATOM 0 HG13 VAL A 326 15.654 -3.987 -1.476 1.00 0.45 H new ATOM 0 HG21 VAL A 326 14.480 -5.089 -4.106 1.00 0.51 H new ATOM 0 HG22 VAL A 326 15.490 -6.058 -3.007 1.00 0.51 H new ATOM 0 HG23 VAL A 326 13.873 -6.637 -3.473 1.00 0.51 H new ATOM 310 N PRO A 327 13.807 -4.873 1.395 1.00 0.33 N ATOM 311 CA PRO A 327 13.227 -4.123 2.512 1.00 0.30 C ATOM 312 C PRO A 327 12.808 -2.717 2.088 1.00 0.25 C ATOM 313 O PRO A 327 13.621 -1.940 1.581 1.00 0.32 O ATOM 314 CB PRO A 327 14.364 -4.055 3.544 1.00 0.39 C ATOM 315 CG PRO A 327 15.361 -5.074 3.102 1.00 0.46 C ATOM 316 CD PRO A 327 15.232 -5.153 1.611 1.00 0.42 C ATOM 0 HA PRO A 327 12.325 -4.598 2.898 1.00 0.30 H new ATOM 0 HB2 PRO A 327 14.807 -3.060 3.576 1.00 0.39 H new ATOM 0 HB3 PRO A 327 13.998 -4.273 4.547 1.00 0.39 H new ATOM 0 HG2 PRO A 327 16.371 -4.784 3.392 1.00 0.46 H new ATOM 0 HG3 PRO A 327 15.162 -6.041 3.563 1.00 0.46 H new ATOM 0 HD2 PRO A 327 15.868 -4.423 1.110 1.00 0.42 H new ATOM 0 HD3 PRO A 327 15.514 -6.135 1.232 1.00 0.42 H new ATOM 324 N ARG A 328 11.543 -2.396 2.287 1.00 0.21 N ATOM 325 CA ARG A 328 11.016 -1.109 1.875 1.00 0.23 C ATOM 326 C ARG A 328 10.300 -0.430 3.034 1.00 0.20 C ATOM 327 O ARG A 328 9.612 -1.084 3.813 1.00 0.23 O ATOM 328 CB ARG A 328 10.047 -1.293 0.704 1.00 0.32 C ATOM 329 CG ARG A 328 9.660 0.003 0.014 1.00 0.50 C ATOM 330 CD ARG A 328 10.846 0.613 -0.712 1.00 0.56 C ATOM 331 NE ARG A 328 11.339 -0.254 -1.779 1.00 0.47 N ATOM 332 CZ ARG A 328 12.567 -0.197 -2.280 1.00 0.58 C ATOM 333 NH1 ARG A 328 13.451 0.649 -1.770 1.00 0.78 N ATOM 334 NH2 ARG A 328 12.908 -1.000 -3.278 1.00 0.65 N ATOM 0 H ARG A 328 10.861 -3.010 2.732 1.00 0.21 H new ATOM 0 HA ARG A 328 11.847 -0.478 1.560 1.00 0.23 H new ATOM 0 HB2 ARG A 328 10.501 -1.961 -0.028 1.00 0.32 H new ATOM 0 HB3 ARG A 328 9.144 -1.783 1.067 1.00 0.32 H new ATOM 0 HG2 ARG A 328 8.854 -0.186 -0.695 1.00 0.50 H new ATOM 0 HG3 ARG A 328 9.278 0.710 0.750 1.00 0.50 H new ATOM 0 HD2 ARG A 328 10.558 1.577 -1.132 1.00 0.56 H new ATOM 0 HD3 ARG A 328 11.649 0.803 0.001 1.00 0.56 H new ATOM 0 HE ARG A 328 10.698 -0.948 -2.164 1.00 0.47 H new ATOM 0 HH11 ARG A 328 13.187 1.255 -0.993 1.00 0.78 H new ATOM 0 HH12 ARG A 328 14.395 0.694 -2.154 1.00 0.78 H new ATOM 0 HH21 ARG A 328 12.228 -1.658 -3.658 1.00 0.65 H new ATOM 0 HH22 ARG A 328 13.850 -0.959 -3.666 1.00 0.65 H new ATOM 348 N LEU A 329 10.473 0.877 3.149 1.00 0.18 N ATOM 349 CA LEU A 329 9.756 1.651 4.145 1.00 0.20 C ATOM 350 C LEU A 329 8.499 2.240 3.526 1.00 0.19 C ATOM 351 O LEU A 329 8.554 3.241 2.811 1.00 0.24 O ATOM 352 CB LEU A 329 10.644 2.762 4.712 1.00 0.25 C ATOM 353 CG LEU A 329 11.833 2.281 5.542 1.00 0.31 C ATOM 354 CD1 LEU A 329 12.725 3.451 5.919 1.00 0.37 C ATOM 355 CD2 LEU A 329 11.348 1.555 6.789 1.00 0.36 C ATOM 0 H LEU A 329 11.105 1.423 2.563 1.00 0.18 H new ATOM 0 HA LEU A 329 9.475 0.992 4.967 1.00 0.20 H new ATOM 0 HB2 LEU A 329 11.018 3.365 3.884 1.00 0.25 H new ATOM 0 HB3 LEU A 329 10.030 3.417 5.331 1.00 0.25 H new ATOM 0 HG LEU A 329 12.417 1.584 4.941 1.00 0.31 H new ATOM 0 HD11 LEU A 329 13.567 3.091 6.510 1.00 0.37 H new ATOM 0 HD12 LEU A 329 13.096 3.932 5.014 1.00 0.37 H new ATOM 0 HD13 LEU A 329 12.153 4.171 6.504 1.00 0.37 H new ATOM 0 HD21 LEU A 329 12.206 1.218 7.371 1.00 0.36 H new ATOM 0 HD22 LEU A 329 10.744 2.232 7.393 1.00 0.36 H new ATOM 0 HD23 LEU A 329 10.746 0.694 6.498 1.00 0.36 H new ATOM 367 N LEU A 330 7.375 1.592 3.767 1.00 0.17 N ATOM 368 CA LEU A 330 6.110 2.038 3.214 1.00 0.17 C ATOM 369 C LEU A 330 5.485 3.081 4.130 1.00 0.18 C ATOM 370 O LEU A 330 5.063 2.767 5.244 1.00 0.24 O ATOM 371 CB LEU A 330 5.164 0.848 3.033 1.00 0.22 C ATOM 372 CG LEU A 330 3.923 1.127 2.184 1.00 0.26 C ATOM 373 CD1 LEU A 330 4.323 1.480 0.760 1.00 0.57 C ATOM 374 CD2 LEU A 330 2.988 -0.072 2.198 1.00 0.49 C ATOM 0 H LEU A 330 7.312 0.753 4.344 1.00 0.17 H new ATOM 0 HA LEU A 330 6.287 2.489 2.238 1.00 0.17 H new ATOM 0 HB2 LEU A 330 5.720 0.028 2.577 1.00 0.22 H new ATOM 0 HB3 LEU A 330 4.842 0.507 4.017 1.00 0.22 H new ATOM 0 HG LEU A 330 3.394 1.978 2.613 1.00 0.26 H new ATOM 0 HD11 LEU A 330 3.428 1.676 0.169 1.00 0.57 H new ATOM 0 HD12 LEU A 330 4.954 2.369 0.769 1.00 0.57 H new ATOM 0 HD13 LEU A 330 4.874 0.649 0.320 1.00 0.57 H new ATOM 0 HD21 LEU A 330 2.110 0.144 1.589 1.00 0.49 H new ATOM 0 HD22 LEU A 330 3.506 -0.942 1.793 1.00 0.49 H new ATOM 0 HD23 LEU A 330 2.677 -0.279 3.222 1.00 0.49 H new ATOM 386 N GLY A 331 5.457 4.320 3.668 1.00 0.18 N ATOM 387 CA GLY A 331 4.911 5.397 4.462 1.00 0.22 C ATOM 388 C GLY A 331 3.446 5.632 4.172 1.00 0.22 C ATOM 389 O GLY A 331 3.062 5.854 3.022 1.00 0.29 O ATOM 0 H GLY A 331 5.805 4.600 2.751 1.00 0.18 H new ATOM 0 HA2 GLY A 331 5.038 5.167 5.520 1.00 0.22 H new ATOM 0 HA3 GLY A 331 5.470 6.312 4.265 1.00 0.22 H new ATOM 393 N ILE A 332 2.627 5.567 5.205 1.00 0.22 N ATOM 394 CA ILE A 332 1.199 5.787 5.058 1.00 0.22 C ATOM 395 C ILE A 332 0.800 7.096 5.724 1.00 0.24 C ATOM 396 O ILE A 332 0.948 7.253 6.939 1.00 0.36 O ATOM 397 CB ILE A 332 0.372 4.639 5.681 1.00 0.26 C ATOM 398 CG1 ILE A 332 0.857 3.276 5.174 1.00 0.27 C ATOM 399 CG2 ILE A 332 -1.108 4.825 5.370 1.00 0.28 C ATOM 400 CD1 ILE A 332 0.699 3.078 3.682 1.00 0.27 C ATOM 0 H ILE A 332 2.927 5.363 6.158 1.00 0.22 H new ATOM 0 HA ILE A 332 0.988 5.826 3.989 1.00 0.22 H new ATOM 0 HB ILE A 332 0.510 4.667 6.762 1.00 0.26 H new ATOM 0 HG12 ILE A 332 1.908 3.156 5.436 1.00 0.27 H new ATOM 0 HG13 ILE A 332 0.308 2.491 5.694 1.00 0.27 H new ATOM 0 HG21 ILE A 332 -1.679 4.010 5.815 1.00 0.28 H new ATOM 0 HG22 ILE A 332 -1.450 5.774 5.782 1.00 0.28 H new ATOM 0 HG23 ILE A 332 -1.256 4.824 4.290 1.00 0.28 H new ATOM 0 HD11 ILE A 332 1.065 2.089 3.405 1.00 0.27 H new ATOM 0 HD12 ILE A 332 -0.354 3.163 3.413 1.00 0.27 H new ATOM 0 HD13 ILE A 332 1.272 3.839 3.151 1.00 0.27 H new ATOM 412 N THR A 333 0.314 8.036 4.929 1.00 0.22 N ATOM 413 CA THR A 333 -0.154 9.308 5.452 1.00 0.23 C ATOM 414 C THR A 333 -1.643 9.466 5.169 1.00 0.23 C ATOM 415 O THR A 333 -2.273 8.554 4.634 1.00 0.28 O ATOM 416 CB THR A 333 0.619 10.492 4.841 1.00 0.26 C ATOM 417 OG1 THR A 333 0.399 10.551 3.426 1.00 0.34 O ATOM 418 CG2 THR A 333 2.109 10.372 5.122 1.00 0.38 C ATOM 0 H THR A 333 0.234 7.941 3.917 1.00 0.22 H new ATOM 0 HA THR A 333 0.021 9.312 6.528 1.00 0.23 H new ATOM 0 HB THR A 333 0.251 11.408 5.302 1.00 0.26 H new ATOM 0 HG1 THR A 333 0.555 9.667 3.034 1.00 0.34 H new ATOM 0 HG21 THR A 333 2.632 11.220 4.680 1.00 0.38 H new ATOM 0 HG22 THR A 333 2.277 10.363 6.199 1.00 0.38 H new ATOM 0 HG23 THR A 333 2.488 9.446 4.689 1.00 0.38 H new ATOM 426 N LYS A 334 -2.205 10.624 5.500 1.00 0.26 N ATOM 427 CA LYS A 334 -3.637 10.841 5.334 1.00 0.28 C ATOM 428 C LYS A 334 -3.971 11.318 3.925 1.00 0.26 C ATOM 429 O LYS A 334 -5.107 11.700 3.650 1.00 0.43 O ATOM 430 CB LYS A 334 -4.161 11.851 6.361 1.00 0.38 C ATOM 431 CG LYS A 334 -3.475 13.204 6.295 1.00 0.47 C ATOM 432 CD LYS A 334 -4.174 14.228 7.172 1.00 0.63 C ATOM 433 CE LYS A 334 -3.400 15.534 7.215 1.00 0.89 C ATOM 434 NZ LYS A 334 -4.179 16.621 7.859 1.00 1.61 N ATOM 0 H LYS A 334 -1.695 11.421 5.882 1.00 0.26 H new ATOM 0 HA LYS A 334 -4.128 9.882 5.498 1.00 0.28 H new ATOM 0 HB2 LYS A 334 -5.231 11.989 6.208 1.00 0.38 H new ATOM 0 HB3 LYS A 334 -4.033 11.438 7.361 1.00 0.38 H new ATOM 0 HG2 LYS A 334 -2.437 13.102 6.611 1.00 0.47 H new ATOM 0 HG3 LYS A 334 -3.462 13.556 5.263 1.00 0.47 H new ATOM 0 HD2 LYS A 334 -5.179 14.410 6.792 1.00 0.63 H new ATOM 0 HD3 LYS A 334 -4.282 13.833 8.182 1.00 0.63 H new ATOM 0 HE2 LYS A 334 -2.467 15.385 7.759 1.00 0.89 H new ATOM 0 HE3 LYS A 334 -3.133 15.831 6.201 1.00 0.89 H new ATOM 0 HZ1 LYS A 334 -3.614 17.494 7.868 1.00 1.61 H new ATOM 0 HZ2 LYS A 334 -5.057 16.782 7.326 1.00 1.61 H new ATOM 0 HZ3 LYS A 334 -4.412 16.350 8.836 1.00 1.61 H new ATOM 448 N GLU A 335 -2.991 11.297 3.031 1.00 0.27 N ATOM 449 CA GLU A 335 -3.224 11.736 1.664 1.00 0.33 C ATOM 450 C GLU A 335 -2.487 10.873 0.642 1.00 0.27 C ATOM 451 O GLU A 335 -2.967 10.696 -0.479 1.00 0.34 O ATOM 452 CB GLU A 335 -2.833 13.208 1.500 1.00 0.46 C ATOM 453 CG GLU A 335 -1.411 13.522 1.929 1.00 0.56 C ATOM 454 CD GLU A 335 -1.085 14.993 1.804 1.00 0.85 C ATOM 455 OE1 GLU A 335 -1.457 15.769 2.706 1.00 1.04 O ATOM 456 OE2 GLU A 335 -0.444 15.379 0.805 1.00 1.79 O ATOM 0 H GLU A 335 -2.040 10.985 3.225 1.00 0.27 H new ATOM 0 HA GLU A 335 -4.291 11.624 1.470 1.00 0.33 H new ATOM 0 HB2 GLU A 335 -2.957 13.492 0.455 1.00 0.46 H new ATOM 0 HB3 GLU A 335 -3.521 13.823 2.081 1.00 0.46 H new ATOM 0 HG2 GLU A 335 -1.268 13.207 2.963 1.00 0.56 H new ATOM 0 HG3 GLU A 335 -0.715 12.945 1.321 1.00 0.56 H new ATOM 463 N CYS A 336 -1.339 10.319 1.013 1.00 0.23 N ATOM 464 CA CYS A 336 -0.543 9.566 0.057 1.00 0.24 C ATOM 465 C CYS A 336 0.235 8.423 0.705 1.00 0.21 C ATOM 466 O CYS A 336 0.453 8.398 1.920 1.00 0.28 O ATOM 467 CB CYS A 336 0.418 10.510 -0.665 1.00 0.32 C ATOM 468 SG CYS A 336 1.419 11.533 0.441 1.00 1.10 S ATOM 0 H CYS A 336 -0.945 10.376 1.952 1.00 0.23 H new ATOM 0 HA CYS A 336 -1.233 9.114 -0.655 1.00 0.24 H new ATOM 0 HB2 CYS A 336 1.082 9.921 -1.298 1.00 0.32 H new ATOM 0 HB3 CYS A 336 -0.156 11.161 -1.324 1.00 0.32 H new ATOM 0 HG CYS A 336 2.649 11.553 0.020 1.00 1.10 H new ATOM 474 N VAL A 337 0.628 7.472 -0.128 1.00 0.22 N ATOM 475 CA VAL A 337 1.457 6.351 0.285 1.00 0.21 C ATOM 476 C VAL A 337 2.801 6.412 -0.439 1.00 0.19 C ATOM 477 O VAL A 337 2.864 6.248 -1.658 1.00 0.22 O ATOM 478 CB VAL A 337 0.771 5.002 -0.027 1.00 0.26 C ATOM 479 CG1 VAL A 337 1.665 3.834 0.360 1.00 0.27 C ATOM 480 CG2 VAL A 337 -0.574 4.906 0.680 1.00 0.32 C ATOM 0 H VAL A 337 0.379 7.457 -1.117 1.00 0.22 H new ATOM 0 HA VAL A 337 1.608 6.421 1.362 1.00 0.21 H new ATOM 0 HB VAL A 337 0.598 4.953 -1.102 1.00 0.26 H new ATOM 0 HG11 VAL A 337 1.159 2.897 0.130 1.00 0.27 H new ATOM 0 HG12 VAL A 337 2.598 3.889 -0.200 1.00 0.27 H new ATOM 0 HG13 VAL A 337 1.879 3.878 1.428 1.00 0.27 H new ATOM 0 HG21 VAL A 337 -1.040 3.949 0.447 1.00 0.32 H new ATOM 0 HG22 VAL A 337 -0.425 4.985 1.757 1.00 0.32 H new ATOM 0 HG23 VAL A 337 -1.221 5.716 0.343 1.00 0.32 H new ATOM 490 N MET A 338 3.865 6.663 0.304 1.00 0.17 N ATOM 491 CA MET A 338 5.183 6.823 -0.295 1.00 0.17 C ATOM 492 C MET A 338 6.076 5.618 -0.013 1.00 0.16 C ATOM 493 O MET A 338 6.082 5.077 1.091 1.00 0.20 O ATOM 494 CB MET A 338 5.863 8.102 0.213 1.00 0.22 C ATOM 495 CG MET A 338 6.050 8.161 1.724 1.00 0.24 C ATOM 496 SD MET A 338 4.547 8.623 2.610 1.00 1.08 S ATOM 497 CE MET A 338 4.283 10.278 1.986 1.00 0.62 C ATOM 0 H MET A 338 3.845 6.760 1.319 1.00 0.17 H new ATOM 0 HA MET A 338 5.040 6.900 -1.373 1.00 0.17 H new ATOM 0 HB2 MET A 338 6.838 8.194 -0.265 1.00 0.22 H new ATOM 0 HB3 MET A 338 5.272 8.962 -0.101 1.00 0.22 H new ATOM 0 HG2 MET A 338 6.389 7.188 2.080 1.00 0.24 H new ATOM 0 HG3 MET A 338 6.837 8.878 1.958 1.00 0.24 H new ATOM 0 HE1 MET A 338 3.475 10.752 2.543 1.00 0.62 H new ATOM 0 HE2 MET A 338 5.196 10.861 2.105 1.00 0.62 H new ATOM 0 HE3 MET A 338 4.017 10.231 0.930 1.00 0.62 H new ATOM 507 N ARG A 339 6.823 5.193 -1.025 1.00 0.16 N ATOM 508 CA ARG A 339 7.803 4.130 -0.853 1.00 0.17 C ATOM 509 C ARG A 339 9.172 4.718 -0.568 1.00 0.16 C ATOM 510 O ARG A 339 9.816 5.270 -1.462 1.00 0.18 O ATOM 511 CB ARG A 339 7.891 3.238 -2.092 1.00 0.22 C ATOM 512 CG ARG A 339 6.637 2.438 -2.374 1.00 0.27 C ATOM 513 CD ARG A 339 6.917 1.307 -3.352 1.00 0.31 C ATOM 514 NE ARG A 339 7.399 1.792 -4.645 1.00 0.73 N ATOM 515 CZ ARG A 339 8.305 1.150 -5.387 1.00 1.03 C ATOM 516 NH1 ARG A 339 8.818 -0.005 -4.972 1.00 1.15 N ATOM 517 NH2 ARG A 339 8.691 1.656 -6.551 1.00 1.55 N ATOM 0 H ARG A 339 6.768 5.568 -1.972 1.00 0.16 H new ATOM 0 HA ARG A 339 7.476 3.521 -0.010 1.00 0.17 H new ATOM 0 HB2 ARG A 339 8.113 3.861 -2.959 1.00 0.22 H new ATOM 0 HB3 ARG A 339 8.728 2.550 -1.971 1.00 0.22 H new ATOM 0 HG2 ARG A 339 6.246 2.029 -1.442 1.00 0.27 H new ATOM 0 HG3 ARG A 339 5.868 3.094 -2.782 1.00 0.27 H new ATOM 0 HD2 ARG A 339 7.658 0.633 -2.921 1.00 0.31 H new ATOM 0 HD3 ARG A 339 6.007 0.726 -3.502 1.00 0.31 H new ATOM 0 HE ARG A 339 7.022 2.671 -5.000 1.00 0.73 H new ATOM 0 HH11 ARG A 339 8.520 -0.405 -4.082 1.00 1.15 H new ATOM 0 HH12 ARG A 339 9.510 -0.490 -5.543 1.00 1.15 H new ATOM 0 HH21 ARG A 339 8.296 2.537 -6.880 1.00 1.55 H new ATOM 0 HH22 ARG A 339 9.383 1.164 -7.116 1.00 1.55 H new ATOM 531 N VAL A 340 9.606 4.607 0.672 1.00 0.18 N ATOM 532 CA VAL A 340 10.915 5.093 1.070 1.00 0.22 C ATOM 533 C VAL A 340 11.935 3.962 1.002 1.00 0.24 C ATOM 534 O VAL A 340 11.684 2.857 1.486 1.00 0.24 O ATOM 535 CB VAL A 340 10.880 5.687 2.494 1.00 0.25 C ATOM 536 CG1 VAL A 340 12.264 6.135 2.940 1.00 0.31 C ATOM 537 CG2 VAL A 340 9.898 6.846 2.557 1.00 0.28 C ATOM 0 H VAL A 340 9.068 4.182 1.427 1.00 0.18 H new ATOM 0 HA VAL A 340 11.207 5.884 0.379 1.00 0.22 H new ATOM 0 HB VAL A 340 10.547 4.906 3.178 1.00 0.25 H new ATOM 0 HG11 VAL A 340 12.206 6.549 3.947 1.00 0.31 H new ATOM 0 HG12 VAL A 340 12.941 5.281 2.937 1.00 0.31 H new ATOM 0 HG13 VAL A 340 12.638 6.897 2.256 1.00 0.31 H new ATOM 0 HG21 VAL A 340 9.883 7.256 3.567 1.00 0.28 H new ATOM 0 HG22 VAL A 340 10.205 7.622 1.855 1.00 0.28 H new ATOM 0 HG23 VAL A 340 8.901 6.493 2.294 1.00 0.28 H new ATOM 547 N ASP A 341 13.067 4.233 0.373 1.00 0.30 N ATOM 548 CA ASP A 341 14.131 3.247 0.260 1.00 0.36 C ATOM 549 C ASP A 341 14.796 3.034 1.614 1.00 0.38 C ATOM 550 O ASP A 341 15.074 3.992 2.329 1.00 0.41 O ATOM 551 CB ASP A 341 15.166 3.694 -0.774 1.00 0.46 C ATOM 552 CG ASP A 341 16.269 2.674 -0.967 1.00 0.55 C ATOM 553 OD1 ASP A 341 16.010 1.626 -1.590 1.00 0.67 O ATOM 554 OD2 ASP A 341 17.400 2.921 -0.498 1.00 0.77 O ATOM 0 H ASP A 341 13.274 5.129 -0.068 1.00 0.30 H new ATOM 0 HA ASP A 341 13.697 2.303 -0.070 1.00 0.36 H new ATOM 0 HB2 ASP A 341 14.669 3.872 -1.728 1.00 0.46 H new ATOM 0 HB3 ASP A 341 15.603 4.642 -0.460 1.00 0.46 H new ATOM 559 N GLU A 342 15.038 1.779 1.961 1.00 0.42 N ATOM 560 CA GLU A 342 15.608 1.440 3.258 1.00 0.47 C ATOM 561 C GLU A 342 17.022 2.010 3.383 1.00 0.60 C ATOM 562 O GLU A 342 17.357 2.658 4.374 1.00 0.72 O ATOM 563 CB GLU A 342 15.621 -0.086 3.430 1.00 0.49 C ATOM 564 CG GLU A 342 15.706 -0.568 4.875 1.00 0.60 C ATOM 565 CD GLU A 342 17.009 -0.204 5.558 1.00 0.95 C ATOM 566 OE1 GLU A 342 18.066 -0.728 5.151 1.00 1.51 O ATOM 567 OE2 GLU A 342 16.978 0.607 6.510 1.00 1.36 O ATOM 0 H GLU A 342 14.848 0.976 1.361 1.00 0.42 H new ATOM 0 HA GLU A 342 14.996 1.879 4.046 1.00 0.47 H new ATOM 0 HB2 GLU A 342 14.718 -0.496 2.978 1.00 0.49 H new ATOM 0 HB3 GLU A 342 16.467 -0.492 2.876 1.00 0.49 H new ATOM 0 HG2 GLU A 342 14.877 -0.143 5.441 1.00 0.60 H new ATOM 0 HG3 GLU A 342 15.584 -1.651 4.896 1.00 0.60 H new ATOM 574 N LYS A 343 17.829 1.797 2.357 1.00 0.69 N ATOM 575 CA LYS A 343 19.235 2.178 2.392 1.00 0.87 C ATOM 576 C LYS A 343 19.414 3.693 2.273 1.00 0.79 C ATOM 577 O LYS A 343 20.064 4.317 3.115 1.00 0.86 O ATOM 578 CB LYS A 343 19.988 1.448 1.265 1.00 1.08 C ATOM 579 CG LYS A 343 21.249 2.149 0.764 1.00 1.36 C ATOM 580 CD LYS A 343 22.435 1.998 1.705 1.00 1.63 C ATOM 581 CE LYS A 343 23.673 2.673 1.134 1.00 2.26 C ATOM 582 NZ LYS A 343 24.842 2.555 2.041 1.00 3.06 N ATOM 0 H LYS A 343 17.534 1.360 1.484 1.00 0.69 H new ATOM 0 HA LYS A 343 19.650 1.884 3.356 1.00 0.87 H new ATOM 0 HB2 LYS A 343 20.260 0.453 1.617 1.00 1.08 H new ATOM 0 HB3 LYS A 343 19.308 1.313 0.424 1.00 1.08 H new ATOM 0 HG2 LYS A 343 21.516 1.747 -0.213 1.00 1.36 H new ATOM 0 HG3 LYS A 343 21.036 3.209 0.625 1.00 1.36 H new ATOM 0 HD2 LYS A 343 22.193 2.434 2.674 1.00 1.63 H new ATOM 0 HD3 LYS A 343 22.638 0.940 1.873 1.00 1.63 H new ATOM 0 HE2 LYS A 343 23.916 2.227 0.170 1.00 2.26 H new ATOM 0 HE3 LYS A 343 23.460 3.727 0.953 1.00 2.26 H new ATOM 0 HZ1 LYS A 343 25.663 3.029 1.613 1.00 3.06 H new ATOM 0 HZ2 LYS A 343 24.621 3.003 2.953 1.00 3.06 H new ATOM 0 HZ3 LYS A 343 25.063 1.550 2.194 1.00 3.06 H new ATOM 596 N THR A 344 18.827 4.274 1.241 1.00 0.73 N ATOM 597 CA THR A 344 19.061 5.673 0.911 1.00 0.72 C ATOM 598 C THR A 344 18.108 6.601 1.666 1.00 0.63 C ATOM 599 O THR A 344 18.367 7.798 1.789 1.00 0.67 O ATOM 600 CB THR A 344 18.902 5.895 -0.604 1.00 0.80 C ATOM 601 OG1 THR A 344 19.273 4.698 -1.305 1.00 0.92 O ATOM 602 CG2 THR A 344 19.776 7.049 -1.077 1.00 0.92 C ATOM 0 H THR A 344 18.181 3.797 0.613 1.00 0.73 H new ATOM 0 HA THR A 344 20.080 5.914 1.214 1.00 0.72 H new ATOM 0 HB THR A 344 17.860 6.140 -0.810 1.00 0.80 H new ATOM 0 HG1 THR A 344 18.565 4.028 -1.206 1.00 0.92 H new ATOM 0 HG21 THR A 344 19.647 7.187 -2.150 1.00 0.92 H new ATOM 0 HG22 THR A 344 19.486 7.962 -0.556 1.00 0.92 H new ATOM 0 HG23 THR A 344 20.821 6.825 -0.863 1.00 0.92 H new ATOM 610 N LYS A 345 17.007 6.035 2.161 1.00 0.55 N ATOM 611 CA LYS A 345 16.007 6.780 2.932 1.00 0.52 C ATOM 612 C LYS A 345 15.289 7.834 2.087 1.00 0.53 C ATOM 613 O LYS A 345 14.674 8.752 2.626 1.00 0.61 O ATOM 614 CB LYS A 345 16.636 7.435 4.169 1.00 0.61 C ATOM 615 CG LYS A 345 17.052 6.444 5.247 1.00 0.63 C ATOM 616 CD LYS A 345 15.878 5.583 5.688 1.00 0.62 C ATOM 617 CE LYS A 345 16.205 4.765 6.928 1.00 0.71 C ATOM 618 NZ LYS A 345 17.389 3.886 6.738 1.00 1.50 N ATOM 0 H LYS A 345 16.782 5.048 2.040 1.00 0.55 H new ATOM 0 HA LYS A 345 15.262 6.053 3.257 1.00 0.52 H new ATOM 0 HB2 LYS A 345 17.510 8.008 3.860 1.00 0.61 H new ATOM 0 HB3 LYS A 345 15.925 8.143 4.595 1.00 0.61 H new ATOM 0 HG2 LYS A 345 17.852 5.807 4.869 1.00 0.63 H new ATOM 0 HG3 LYS A 345 17.453 6.984 6.105 1.00 0.63 H new ATOM 0 HD2 LYS A 345 15.017 6.220 5.891 1.00 0.62 H new ATOM 0 HD3 LYS A 345 15.595 4.913 4.876 1.00 0.62 H new ATOM 0 HE2 LYS A 345 16.388 5.439 7.765 1.00 0.71 H new ATOM 0 HE3 LYS A 345 15.342 4.154 7.193 1.00 0.71 H new ATOM 0 HZ1 LYS A 345 17.297 3.044 7.342 1.00 1.50 H new ATOM 0 HZ2 LYS A 345 17.448 3.593 5.742 1.00 1.50 H new ATOM 0 HZ3 LYS A 345 18.252 4.405 6.998 1.00 1.50 H new ATOM 632 N GLU A 346 15.341 7.682 0.771 1.00 0.53 N ATOM 633 CA GLU A 346 14.664 8.613 -0.124 1.00 0.58 C ATOM 634 C GLU A 346 13.351 8.021 -0.615 1.00 0.44 C ATOM 635 O GLU A 346 13.131 6.812 -0.520 1.00 0.42 O ATOM 636 CB GLU A 346 15.543 8.949 -1.326 1.00 0.77 C ATOM 637 CG GLU A 346 16.897 9.523 -0.962 1.00 0.95 C ATOM 638 CD GLU A 346 17.679 9.944 -2.185 1.00 1.61 C ATOM 639 OE1 GLU A 346 17.976 9.078 -3.034 1.00 1.81 O ATOM 640 OE2 GLU A 346 18.023 11.139 -2.293 1.00 2.46 O ATOM 0 H GLU A 346 15.841 6.928 0.301 1.00 0.53 H new ATOM 0 HA GLU A 346 14.464 9.526 0.437 1.00 0.58 H new ATOM 0 HB2 GLU A 346 15.691 8.046 -1.918 1.00 0.77 H new ATOM 0 HB3 GLU A 346 15.016 9.663 -1.959 1.00 0.77 H new ATOM 0 HG2 GLU A 346 16.762 10.382 -0.304 1.00 0.95 H new ATOM 0 HG3 GLU A 346 17.468 8.781 -0.404 1.00 0.95 H new ATOM 647 N VAL A 347 12.486 8.872 -1.144 1.00 0.39 N ATOM 648 CA VAL A 347 11.217 8.423 -1.689 1.00 0.33 C ATOM 649 C VAL A 347 11.390 8.015 -3.148 1.00 0.31 C ATOM 650 O VAL A 347 11.914 8.780 -3.961 1.00 0.42 O ATOM 651 CB VAL A 347 10.131 9.516 -1.583 1.00 0.41 C ATOM 652 CG1 VAL A 347 8.795 9.006 -2.105 1.00 0.54 C ATOM 653 CG2 VAL A 347 9.994 10.002 -0.149 1.00 0.58 C ATOM 0 H VAL A 347 12.641 9.878 -1.207 1.00 0.39 H new ATOM 0 HA VAL A 347 10.892 7.565 -1.101 1.00 0.33 H new ATOM 0 HB VAL A 347 10.439 10.358 -2.202 1.00 0.41 H new ATOM 0 HG11 VAL A 347 8.046 9.794 -2.020 1.00 0.54 H new ATOM 0 HG12 VAL A 347 8.900 8.716 -3.151 1.00 0.54 H new ATOM 0 HG13 VAL A 347 8.481 8.142 -1.519 1.00 0.54 H new ATOM 0 HG21 VAL A 347 9.224 10.771 -0.098 1.00 0.58 H new ATOM 0 HG22 VAL A 347 9.716 9.166 0.493 1.00 0.58 H new ATOM 0 HG23 VAL A 347 10.944 10.417 0.187 1.00 0.58 H new ATOM 663 N ILE A 348 10.980 6.797 -3.465 1.00 0.25 N ATOM 664 CA ILE A 348 11.065 6.295 -4.827 1.00 0.26 C ATOM 665 C ILE A 348 9.798 6.642 -5.601 1.00 0.26 C ATOM 666 O ILE A 348 9.851 7.287 -6.646 1.00 0.35 O ATOM 667 CB ILE A 348 11.276 4.767 -4.852 1.00 0.27 C ATOM 668 CG1 ILE A 348 12.535 4.395 -4.065 1.00 0.29 C ATOM 669 CG2 ILE A 348 11.373 4.263 -6.287 1.00 0.32 C ATOM 670 CD1 ILE A 348 12.795 2.907 -4.002 1.00 0.31 C ATOM 0 H ILE A 348 10.584 6.137 -2.796 1.00 0.25 H new ATOM 0 HA ILE A 348 11.924 6.772 -5.298 1.00 0.26 H new ATOM 0 HB ILE A 348 10.417 4.289 -4.381 1.00 0.27 H new ATOM 0 HG12 ILE A 348 13.395 4.886 -4.520 1.00 0.29 H new ATOM 0 HG13 ILE A 348 12.446 4.783 -3.050 1.00 0.29 H new ATOM 0 HG21 ILE A 348 11.522 3.183 -6.284 1.00 0.32 H new ATOM 0 HG22 ILE A 348 10.452 4.501 -6.819 1.00 0.32 H new ATOM 0 HG23 ILE A 348 12.215 4.744 -6.785 1.00 0.32 H new ATOM 0 HD11 ILE A 348 13.703 2.720 -3.429 1.00 0.31 H new ATOM 0 HD12 ILE A 348 11.953 2.411 -3.520 1.00 0.31 H new ATOM 0 HD13 ILE A 348 12.917 2.516 -5.012 1.00 0.31 H new ATOM 682 N GLN A 349 8.659 6.223 -5.070 1.00 0.23 N ATOM 683 CA GLN A 349 7.381 6.461 -5.721 1.00 0.23 C ATOM 684 C GLN A 349 6.315 6.740 -4.670 1.00 0.22 C ATOM 685 O GLN A 349 6.357 6.167 -3.580 1.00 0.29 O ATOM 686 CB GLN A 349 6.982 5.248 -6.566 1.00 0.28 C ATOM 687 CG GLN A 349 5.821 5.515 -7.508 1.00 0.40 C ATOM 688 CD GLN A 349 5.432 4.299 -8.322 1.00 0.86 C ATOM 689 OE1 GLN A 349 6.252 3.416 -8.578 1.00 1.65 O ATOM 690 NE2 GLN A 349 4.188 4.258 -8.763 1.00 0.81 N ATOM 0 H GLN A 349 8.595 5.715 -4.188 1.00 0.23 H new ATOM 0 HA GLN A 349 7.472 7.326 -6.377 1.00 0.23 H new ATOM 0 HB2 GLN A 349 7.844 4.923 -7.149 1.00 0.28 H new ATOM 0 HB3 GLN A 349 6.718 4.425 -5.902 1.00 0.28 H new ATOM 0 HG2 GLN A 349 4.960 5.850 -6.930 1.00 0.40 H new ATOM 0 HG3 GLN A 349 6.087 6.328 -8.183 1.00 0.40 H new ATOM 0 HE21 GLN A 349 3.539 5.009 -8.529 1.00 0.81 H new ATOM 0 HE22 GLN A 349 3.876 3.475 -9.338 1.00 0.81 H new ATOM 699 N GLU A 350 5.377 7.616 -4.992 1.00 0.23 N ATOM 700 CA GLU A 350 4.312 7.966 -4.066 1.00 0.25 C ATOM 701 C GLU A 350 2.953 7.841 -4.749 1.00 0.26 C ATOM 702 O GLU A 350 2.779 8.283 -5.888 1.00 0.36 O ATOM 703 CB GLU A 350 4.511 9.394 -3.551 1.00 0.30 C ATOM 704 CG GLU A 350 3.485 9.819 -2.515 1.00 0.36 C ATOM 705 CD GLU A 350 3.579 11.289 -2.171 1.00 0.45 C ATOM 706 OE1 GLU A 350 3.233 12.133 -3.023 1.00 0.60 O ATOM 707 OE2 GLU A 350 4.013 11.610 -1.048 1.00 0.65 O ATOM 0 H GLU A 350 5.332 8.099 -5.889 1.00 0.23 H new ATOM 0 HA GLU A 350 4.344 7.277 -3.222 1.00 0.25 H new ATOM 0 HB2 GLU A 350 5.508 9.479 -3.118 1.00 0.30 H new ATOM 0 HB3 GLU A 350 4.470 10.084 -4.394 1.00 0.30 H new ATOM 0 HG2 GLU A 350 2.485 9.601 -2.889 1.00 0.36 H new ATOM 0 HG3 GLU A 350 3.623 9.228 -1.609 1.00 0.36 H new ATOM 714 N TRP A 351 2.005 7.222 -4.062 1.00 0.23 N ATOM 715 CA TRP A 351 0.653 7.072 -4.581 1.00 0.26 C ATOM 716 C TRP A 351 -0.326 7.923 -3.788 1.00 0.25 C ATOM 717 O TRP A 351 -0.412 7.798 -2.569 1.00 0.52 O ATOM 718 CB TRP A 351 0.189 5.618 -4.502 1.00 0.30 C ATOM 719 CG TRP A 351 0.994 4.660 -5.317 1.00 0.30 C ATOM 720 CD1 TRP A 351 0.947 4.493 -6.669 1.00 0.38 C ATOM 721 CD2 TRP A 351 1.941 3.710 -4.825 1.00 0.30 C ATOM 722 NE1 TRP A 351 1.811 3.497 -7.047 1.00 0.41 N ATOM 723 CE2 TRP A 351 2.434 3.004 -5.935 1.00 0.34 C ATOM 724 CE3 TRP A 351 2.423 3.391 -3.554 1.00 0.35 C ATOM 725 CZ2 TRP A 351 3.385 1.997 -5.814 1.00 0.38 C ATOM 726 CZ3 TRP A 351 3.364 2.390 -3.435 1.00 0.40 C ATOM 727 CH2 TRP A 351 3.838 1.704 -4.561 1.00 0.39 C ATOM 0 H TRP A 351 2.148 6.813 -3.139 1.00 0.23 H new ATOM 0 HA TRP A 351 0.674 7.395 -5.622 1.00 0.26 H new ATOM 0 HB2 TRP A 351 0.215 5.299 -3.460 1.00 0.30 H new ATOM 0 HB3 TRP A 351 -0.851 5.565 -4.826 1.00 0.30 H new ATOM 0 HD1 TRP A 351 0.322 5.061 -7.343 1.00 0.38 H new ATOM 0 HE1 TRP A 351 1.964 3.176 -8.003 1.00 0.41 H new ATOM 0 HE3 TRP A 351 2.066 3.918 -2.681 1.00 0.35 H new ATOM 0 HZ2 TRP A 351 3.752 1.466 -6.680 1.00 0.38 H new ATOM 0 HZ3 TRP A 351 3.742 2.130 -2.457 1.00 0.40 H new ATOM 0 HH2 TRP A 351 4.577 0.927 -4.434 1.00 0.39 H new ATOM 738 N SER A 352 -1.049 8.792 -4.470 1.00 0.31 N ATOM 739 CA SER A 352 -2.165 9.485 -3.853 1.00 0.30 C ATOM 740 C SER A 352 -3.253 8.469 -3.501 1.00 0.26 C ATOM 741 O SER A 352 -3.481 7.521 -4.255 1.00 0.28 O ATOM 742 CB SER A 352 -2.720 10.540 -4.810 1.00 0.35 C ATOM 743 OG SER A 352 -1.689 11.387 -5.293 1.00 1.27 O ATOM 0 H SER A 352 -0.885 9.034 -5.447 1.00 0.31 H new ATOM 0 HA SER A 352 -1.827 9.984 -2.945 1.00 0.30 H new ATOM 0 HB2 SER A 352 -3.215 10.050 -5.649 1.00 0.35 H new ATOM 0 HB3 SER A 352 -3.475 11.137 -4.299 1.00 0.35 H new ATOM 0 HG SER A 352 -2.071 12.051 -5.904 1.00 1.27 H new ATOM 749 N LEU A 353 -3.916 8.655 -2.364 1.00 0.25 N ATOM 750 CA LEU A 353 -4.974 7.738 -1.939 1.00 0.24 C ATOM 751 C LEU A 353 -6.123 7.741 -2.944 1.00 0.23 C ATOM 752 O LEU A 353 -6.879 6.774 -3.047 1.00 0.23 O ATOM 753 CB LEU A 353 -5.495 8.111 -0.547 1.00 0.25 C ATOM 754 CG LEU A 353 -4.472 8.009 0.587 1.00 0.26 C ATOM 755 CD1 LEU A 353 -5.120 8.353 1.919 1.00 0.31 C ATOM 756 CD2 LEU A 353 -3.856 6.619 0.634 1.00 0.26 C ATOM 0 H LEU A 353 -3.742 9.428 -1.721 1.00 0.25 H new ATOM 0 HA LEU A 353 -4.549 6.735 -1.892 1.00 0.24 H new ATOM 0 HB2 LEU A 353 -5.873 9.133 -0.581 1.00 0.25 H new ATOM 0 HB3 LEU A 353 -6.341 7.466 -0.309 1.00 0.25 H new ATOM 0 HG LEU A 353 -3.675 8.727 0.395 1.00 0.26 H new ATOM 0 HD11 LEU A 353 -4.379 8.276 2.715 1.00 0.31 H new ATOM 0 HD12 LEU A 353 -5.508 9.371 1.883 1.00 0.31 H new ATOM 0 HD13 LEU A 353 -5.938 7.659 2.116 1.00 0.31 H new ATOM 0 HD21 LEU A 353 -3.132 6.569 1.447 1.00 0.26 H new ATOM 0 HD22 LEU A 353 -4.639 5.879 0.800 1.00 0.26 H new ATOM 0 HD23 LEU A 353 -3.355 6.411 -0.311 1.00 0.26 H new ATOM 768 N THR A 354 -6.233 8.832 -3.688 1.00 0.26 N ATOM 769 CA THR A 354 -7.248 8.970 -4.720 1.00 0.28 C ATOM 770 C THR A 354 -6.969 8.034 -5.907 1.00 0.28 C ATOM 771 O THR A 354 -7.862 7.742 -6.701 1.00 0.35 O ATOM 772 CB THR A 354 -7.308 10.426 -5.231 1.00 0.36 C ATOM 773 OG1 THR A 354 -6.063 10.784 -5.850 1.00 0.44 O ATOM 774 CG2 THR A 354 -7.595 11.404 -4.100 1.00 0.42 C ATOM 0 H THR A 354 -5.623 9.644 -3.593 1.00 0.26 H new ATOM 0 HA THR A 354 -8.204 8.698 -4.273 1.00 0.28 H new ATOM 0 HB THR A 354 -8.119 10.484 -5.957 1.00 0.36 H new ATOM 0 HG1 THR A 354 -6.112 11.708 -6.172 1.00 0.44 H new ATOM 0 HG21 THR A 354 -7.630 12.419 -4.497 1.00 0.42 H new ATOM 0 HG22 THR A 354 -8.554 11.160 -3.642 1.00 0.42 H new ATOM 0 HG23 THR A 354 -6.807 11.335 -3.350 1.00 0.42 H new ATOM 782 N ASN A 355 -5.727 7.558 -6.012 1.00 0.26 N ATOM 783 CA ASN A 355 -5.312 6.729 -7.148 1.00 0.30 C ATOM 784 C ASN A 355 -5.483 5.247 -6.846 1.00 0.28 C ATOM 785 O ASN A 355 -5.189 4.395 -7.684 1.00 0.33 O ATOM 786 CB ASN A 355 -3.848 7.001 -7.521 1.00 0.37 C ATOM 787 CG ASN A 355 -3.607 8.422 -7.988 1.00 0.49 C ATOM 788 OD1 ASN A 355 -4.497 9.073 -8.530 1.00 0.83 O ATOM 789 ND2 ASN A 355 -2.390 8.908 -7.794 1.00 0.66 N ATOM 0 H ASN A 355 -4.992 7.731 -5.327 1.00 0.26 H new ATOM 0 HA ASN A 355 -5.954 6.995 -7.988 1.00 0.30 H new ATOM 0 HB2 ASN A 355 -3.215 6.797 -6.657 1.00 0.37 H new ATOM 0 HB3 ASN A 355 -3.546 6.310 -8.308 1.00 0.37 H new ATOM 0 HD21 ASN A 355 -2.164 9.855 -8.099 1.00 0.66 H new ATOM 0 HD22 ASN A 355 -1.679 8.335 -7.340 1.00 0.66 H new ATOM 796 N ILE A 356 -5.946 4.939 -5.645 1.00 0.26 N ATOM 797 CA ILE A 356 -6.166 3.555 -5.247 1.00 0.28 C ATOM 798 C ILE A 356 -7.500 3.058 -5.797 1.00 0.28 C ATOM 799 O ILE A 356 -8.449 3.826 -5.900 1.00 0.38 O ATOM 800 CB ILE A 356 -6.135 3.408 -3.705 1.00 0.31 C ATOM 801 CG1 ILE A 356 -4.769 3.843 -3.165 1.00 0.33 C ATOM 802 CG2 ILE A 356 -6.443 1.975 -3.289 1.00 0.36 C ATOM 803 CD1 ILE A 356 -4.655 3.770 -1.658 1.00 0.38 C ATOM 0 H ILE A 356 -6.177 5.627 -4.928 1.00 0.26 H new ATOM 0 HA ILE A 356 -5.361 2.948 -5.661 1.00 0.28 H new ATOM 0 HB ILE A 356 -6.904 4.053 -3.280 1.00 0.31 H new ATOM 0 HG12 ILE A 356 -3.997 3.215 -3.609 1.00 0.33 H new ATOM 0 HG13 ILE A 356 -4.571 4.866 -3.486 1.00 0.33 H new ATOM 0 HG21 ILE A 356 -6.415 1.898 -2.202 1.00 0.36 H new ATOM 0 HG22 ILE A 356 -7.434 1.697 -3.647 1.00 0.36 H new ATOM 0 HG23 ILE A 356 -5.700 1.303 -3.720 1.00 0.36 H new ATOM 0 HD11 ILE A 356 -3.660 4.093 -1.352 1.00 0.38 H new ATOM 0 HD12 ILE A 356 -5.403 4.420 -1.205 1.00 0.38 H new ATOM 0 HD13 ILE A 356 -4.820 2.744 -1.330 1.00 0.38 H new ATOM 815 N LYS A 357 -7.557 1.789 -6.180 1.00 0.26 N ATOM 816 CA LYS A 357 -8.795 1.192 -6.671 1.00 0.30 C ATOM 817 C LYS A 357 -9.338 0.190 -5.653 1.00 0.31 C ATOM 818 O LYS A 357 -10.511 0.240 -5.274 1.00 0.45 O ATOM 819 CB LYS A 357 -8.544 0.505 -8.017 1.00 0.35 C ATOM 820 CG LYS A 357 -9.747 -0.239 -8.574 1.00 0.46 C ATOM 821 CD LYS A 357 -9.396 -0.939 -9.875 1.00 0.60 C ATOM 822 CE LYS A 357 -10.526 -1.826 -10.365 1.00 0.79 C ATOM 823 NZ LYS A 357 -10.155 -2.534 -11.618 1.00 1.75 N ATOM 0 H LYS A 357 -6.761 1.152 -6.161 1.00 0.26 H new ATOM 0 HA LYS A 357 -9.537 1.978 -6.811 1.00 0.30 H new ATOM 0 HB2 LYS A 357 -8.229 1.256 -8.742 1.00 0.35 H new ATOM 0 HB3 LYS A 357 -7.718 -0.197 -7.905 1.00 0.35 H new ATOM 0 HG2 LYS A 357 -10.097 -0.971 -7.845 1.00 0.46 H new ATOM 0 HG3 LYS A 357 -10.566 0.460 -8.742 1.00 0.46 H new ATOM 0 HD2 LYS A 357 -9.163 -0.194 -10.636 1.00 0.60 H new ATOM 0 HD3 LYS A 357 -8.498 -1.541 -9.733 1.00 0.60 H new ATOM 0 HE2 LYS A 357 -10.779 -2.555 -9.595 1.00 0.79 H new ATOM 0 HE3 LYS A 357 -11.417 -1.222 -10.537 1.00 0.79 H new ATOM 0 HZ1 LYS A 357 -10.948 -3.132 -11.927 1.00 1.75 H new ATOM 0 HZ2 LYS A 357 -9.937 -1.837 -12.359 1.00 1.75 H new ATOM 0 HZ3 LYS A 357 -9.320 -3.129 -11.446 1.00 1.75 H new ATOM 837 N ARG A 358 -8.472 -0.718 -5.223 1.00 0.26 N ATOM 838 CA ARG A 358 -8.817 -1.726 -4.227 1.00 0.29 C ATOM 839 C ARG A 358 -7.550 -2.329 -3.646 1.00 0.28 C ATOM 840 O ARG A 358 -6.536 -2.425 -4.333 1.00 0.35 O ATOM 841 CB ARG A 358 -9.690 -2.834 -4.835 1.00 0.34 C ATOM 842 CG ARG A 358 -9.215 -3.327 -6.193 1.00 0.37 C ATOM 843 CD ARG A 358 -9.991 -4.554 -6.647 1.00 0.54 C ATOM 844 NE ARG A 358 -11.436 -4.398 -6.470 1.00 0.83 N ATOM 845 CZ ARG A 358 -12.331 -4.502 -7.452 1.00 1.19 C ATOM 846 NH1 ARG A 358 -11.936 -4.722 -8.701 1.00 1.46 N ATOM 847 NH2 ARG A 358 -13.623 -4.387 -7.177 1.00 1.75 N ATOM 0 H ARG A 358 -7.509 -0.777 -5.555 1.00 0.26 H new ATOM 0 HA ARG A 358 -9.388 -1.240 -3.436 1.00 0.29 H new ATOM 0 HB2 ARG A 358 -9.720 -3.677 -4.145 1.00 0.34 H new ATOM 0 HB3 ARG A 358 -10.711 -2.465 -4.932 1.00 0.34 H new ATOM 0 HG2 ARG A 358 -9.328 -2.531 -6.929 1.00 0.37 H new ATOM 0 HG3 ARG A 358 -8.153 -3.566 -6.143 1.00 0.37 H new ATOM 0 HD2 ARG A 358 -9.775 -4.749 -7.698 1.00 0.54 H new ATOM 0 HD3 ARG A 358 -9.651 -5.424 -6.085 1.00 0.54 H new ATOM 0 HE ARG A 358 -11.781 -4.196 -5.532 1.00 0.83 H new ATOM 0 HH11 ARG A 358 -10.942 -4.812 -8.913 1.00 1.46 H new ATOM 0 HH12 ARG A 358 -12.626 -4.801 -9.448 1.00 1.46 H new ATOM 0 HH21 ARG A 358 -13.927 -4.220 -6.218 1.00 1.75 H new ATOM 0 HH22 ARG A 358 -14.313 -4.466 -7.925 1.00 1.75 H new ATOM 861 N TRP A 359 -7.593 -2.720 -2.383 1.00 0.25 N ATOM 862 CA TRP A 359 -6.442 -3.358 -1.770 1.00 0.27 C ATOM 863 C TRP A 359 -6.809 -4.710 -1.175 1.00 0.28 C ATOM 864 O TRP A 359 -7.941 -4.930 -0.739 1.00 0.36 O ATOM 865 CB TRP A 359 -5.791 -2.454 -0.712 1.00 0.28 C ATOM 866 CG TRP A 359 -6.696 -2.021 0.405 1.00 0.27 C ATOM 867 CD1 TRP A 359 -6.977 -2.709 1.551 1.00 0.36 C ATOM 868 CD2 TRP A 359 -7.418 -0.789 0.491 1.00 0.25 C ATOM 869 NE1 TRP A 359 -7.832 -1.981 2.341 1.00 0.35 N ATOM 870 CE2 TRP A 359 -8.120 -0.799 1.711 1.00 0.29 C ATOM 871 CE3 TRP A 359 -7.542 0.323 -0.346 1.00 0.32 C ATOM 872 CZ2 TRP A 359 -8.930 0.258 2.113 1.00 0.33 C ATOM 873 CZ3 TRP A 359 -8.348 1.371 0.054 1.00 0.40 C ATOM 874 CH2 TRP A 359 -9.033 1.332 1.274 1.00 0.39 C ATOM 0 H TRP A 359 -8.401 -2.609 -1.770 1.00 0.25 H new ATOM 0 HA TRP A 359 -5.709 -3.526 -2.559 1.00 0.27 H new ATOM 0 HB2 TRP A 359 -4.938 -2.980 -0.283 1.00 0.28 H new ATOM 0 HB3 TRP A 359 -5.401 -1.565 -1.207 1.00 0.28 H new ATOM 0 HD1 TRP A 359 -6.584 -3.684 1.800 1.00 0.36 H new ATOM 0 HE1 TRP A 359 -8.194 -2.273 3.249 1.00 0.35 H new ATOM 0 HE3 TRP A 359 -7.017 0.362 -1.289 1.00 0.32 H new ATOM 0 HZ2 TRP A 359 -9.459 0.231 3.054 1.00 0.33 H new ATOM 0 HZ3 TRP A 359 -8.451 2.235 -0.585 1.00 0.40 H new ATOM 0 HH2 TRP A 359 -9.656 2.168 1.558 1.00 0.39 H new ATOM 885 N ALA A 360 -5.842 -5.611 -1.189 1.00 0.25 N ATOM 886 CA ALA A 360 -6.007 -6.944 -0.640 1.00 0.27 C ATOM 887 C ALA A 360 -5.103 -7.124 0.562 1.00 0.25 C ATOM 888 O ALA A 360 -3.881 -7.005 0.459 1.00 0.31 O ATOM 889 CB ALA A 360 -5.721 -7.997 -1.701 1.00 0.31 C ATOM 0 H ALA A 360 -4.917 -5.437 -1.583 1.00 0.25 H new ATOM 0 HA ALA A 360 -7.040 -7.068 -0.316 1.00 0.27 H new ATOM 0 HB1 ALA A 360 -5.850 -8.991 -1.272 1.00 0.31 H new ATOM 0 HB2 ALA A 360 -6.411 -7.870 -2.535 1.00 0.31 H new ATOM 0 HB3 ALA A 360 -4.697 -7.886 -2.057 1.00 0.31 H new ATOM 895 N ALA A 361 -5.712 -7.397 1.701 1.00 0.26 N ATOM 896 CA ALA A 361 -4.981 -7.504 2.948 1.00 0.27 C ATOM 897 C ALA A 361 -5.039 -8.921 3.500 1.00 0.25 C ATOM 898 O ALA A 361 -6.108 -9.529 3.565 1.00 0.38 O ATOM 899 CB ALA A 361 -5.539 -6.519 3.963 1.00 0.35 C ATOM 0 H ALA A 361 -6.717 -7.549 1.787 1.00 0.26 H new ATOM 0 HA ALA A 361 -3.936 -7.263 2.753 1.00 0.27 H new ATOM 0 HB1 ALA A 361 -4.984 -6.606 4.897 1.00 0.35 H new ATOM 0 HB2 ALA A 361 -5.442 -5.504 3.577 1.00 0.35 H new ATOM 0 HB3 ALA A 361 -6.591 -6.740 4.144 1.00 0.35 H new ATOM 905 N SER A 362 -3.883 -9.442 3.876 1.00 0.32 N ATOM 906 CA SER A 362 -3.798 -10.739 4.524 1.00 0.40 C ATOM 907 C SER A 362 -2.736 -10.675 5.617 1.00 0.42 C ATOM 908 O SER A 362 -1.995 -9.694 5.699 1.00 0.44 O ATOM 909 CB SER A 362 -3.454 -11.828 3.498 1.00 0.47 C ATOM 910 OG SER A 362 -2.147 -11.660 2.980 1.00 1.00 O ATOM 0 H SER A 362 -2.983 -8.981 3.742 1.00 0.32 H new ATOM 0 HA SER A 362 -4.761 -10.991 4.969 1.00 0.40 H new ATOM 0 HB2 SER A 362 -3.538 -12.809 3.966 1.00 0.47 H new ATOM 0 HB3 SER A 362 -4.176 -11.801 2.682 1.00 0.47 H new ATOM 0 HG SER A 362 -2.040 -10.743 2.652 1.00 1.00 H new ATOM 916 N PRO A 363 -2.640 -11.703 6.476 1.00 0.46 N ATOM 917 CA PRO A 363 -1.630 -11.744 7.534 1.00 0.48 C ATOM 918 C PRO A 363 -0.238 -12.090 7.008 1.00 0.45 C ATOM 919 O PRO A 363 0.682 -12.337 7.787 1.00 0.66 O ATOM 920 CB PRO A 363 -2.138 -12.854 8.454 1.00 0.58 C ATOM 921 CG PRO A 363 -2.888 -13.770 7.553 1.00 0.60 C ATOM 922 CD PRO A 363 -3.515 -12.893 6.504 1.00 0.53 C ATOM 0 HA PRO A 363 -1.513 -10.776 8.021 1.00 0.48 H new ATOM 0 HB2 PRO A 363 -1.314 -13.369 8.947 1.00 0.58 H new ATOM 0 HB3 PRO A 363 -2.780 -12.456 9.239 1.00 0.58 H new ATOM 0 HG2 PRO A 363 -2.222 -14.505 7.101 1.00 0.60 H new ATOM 0 HG3 PRO A 363 -3.648 -14.324 8.104 1.00 0.60 H new ATOM 0 HD2 PRO A 363 -3.548 -13.389 5.534 1.00 0.53 H new ATOM 0 HD3 PRO A 363 -4.541 -12.630 6.762 1.00 0.53 H new ATOM 930 N LYS A 364 -0.080 -12.108 5.689 1.00 0.44 N ATOM 931 CA LYS A 364 1.195 -12.478 5.096 1.00 0.44 C ATOM 932 C LYS A 364 1.601 -11.524 3.972 1.00 0.37 C ATOM 933 O LYS A 364 2.783 -11.238 3.797 1.00 0.40 O ATOM 934 CB LYS A 364 1.141 -13.916 4.576 1.00 0.56 C ATOM 935 CG LYS A 364 2.498 -14.463 4.166 1.00 0.72 C ATOM 936 CD LYS A 364 2.443 -15.957 3.908 1.00 0.98 C ATOM 937 CE LYS A 364 3.834 -16.533 3.720 1.00 1.26 C ATOM 938 NZ LYS A 364 3.825 -18.018 3.708 1.00 2.08 N ATOM 0 H LYS A 364 -0.812 -11.873 5.018 1.00 0.44 H new ATOM 0 HA LYS A 364 1.952 -12.406 5.877 1.00 0.44 H new ATOM 0 HB2 LYS A 364 0.718 -14.558 5.349 1.00 0.56 H new ATOM 0 HB3 LYS A 364 0.467 -13.960 3.721 1.00 0.56 H new ATOM 0 HG2 LYS A 364 2.841 -13.950 3.267 1.00 0.72 H new ATOM 0 HG3 LYS A 364 3.227 -14.255 4.950 1.00 0.72 H new ATOM 0 HD2 LYS A 364 1.950 -16.455 4.743 1.00 0.98 H new ATOM 0 HD3 LYS A 364 1.842 -16.153 3.020 1.00 0.98 H new ATOM 0 HE2 LYS A 364 4.255 -16.166 2.784 1.00 1.26 H new ATOM 0 HE3 LYS A 364 4.483 -16.181 4.522 1.00 1.26 H new ATOM 0 HZ1 LYS A 364 4.795 -18.370 3.577 1.00 2.08 H new ATOM 0 HZ2 LYS A 364 3.448 -18.370 4.611 1.00 2.08 H new ATOM 0 HZ3 LYS A 364 3.226 -18.355 2.927 1.00 2.08 H new ATOM 952 N SER A 365 0.634 -11.028 3.214 1.00 0.35 N ATOM 953 CA SER A 365 0.940 -10.130 2.112 1.00 0.34 C ATOM 954 C SER A 365 -0.103 -9.025 1.975 1.00 0.32 C ATOM 955 O SER A 365 -1.270 -9.193 2.341 1.00 0.52 O ATOM 956 CB SER A 365 1.057 -10.924 0.809 1.00 0.40 C ATOM 957 OG SER A 365 -0.039 -11.810 0.650 1.00 1.32 O ATOM 0 H SER A 365 -0.358 -11.229 3.340 1.00 0.35 H new ATOM 0 HA SER A 365 1.894 -9.649 2.326 1.00 0.34 H new ATOM 0 HB2 SER A 365 1.099 -10.237 -0.036 1.00 0.40 H new ATOM 0 HB3 SER A 365 1.989 -11.489 0.807 1.00 0.40 H new ATOM 0 HG SER A 365 -0.720 -11.613 1.327 1.00 1.32 H new ATOM 963 N PHE A 366 0.333 -7.886 1.461 1.00 0.19 N ATOM 964 CA PHE A 366 -0.553 -6.765 1.207 1.00 0.16 C ATOM 965 C PHE A 366 -0.465 -6.367 -0.262 1.00 0.16 C ATOM 966 O PHE A 366 0.627 -6.147 -0.786 1.00 0.28 O ATOM 967 CB PHE A 366 -0.184 -5.586 2.111 1.00 0.19 C ATOM 968 CG PHE A 366 -1.096 -4.403 1.960 1.00 0.20 C ATOM 969 CD1 PHE A 366 -2.414 -4.471 2.380 1.00 0.23 C ATOM 970 CD2 PHE A 366 -0.634 -3.223 1.400 1.00 0.25 C ATOM 971 CE1 PHE A 366 -3.256 -3.385 2.242 1.00 0.28 C ATOM 972 CE2 PHE A 366 -1.471 -2.135 1.262 1.00 0.29 C ATOM 973 CZ PHE A 366 -2.784 -2.215 1.684 1.00 0.30 C ATOM 0 H PHE A 366 1.307 -7.714 1.210 1.00 0.19 H new ATOM 0 HA PHE A 366 -1.579 -7.057 1.430 1.00 0.16 H new ATOM 0 HB2 PHE A 366 -0.201 -5.916 3.150 1.00 0.19 H new ATOM 0 HB3 PHE A 366 0.838 -5.277 1.891 1.00 0.19 H new ATOM 0 HD1 PHE A 366 -2.788 -5.384 2.820 1.00 0.23 H new ATOM 0 HD2 PHE A 366 0.391 -3.154 1.068 1.00 0.25 H new ATOM 0 HE1 PHE A 366 -4.283 -3.452 2.571 1.00 0.28 H new ATOM 0 HE2 PHE A 366 -1.100 -1.220 0.824 1.00 0.29 H new ATOM 0 HZ PHE A 366 -3.440 -1.363 1.577 1.00 0.30 H new ATOM 983 N THR A 367 -1.610 -6.299 -0.923 1.00 0.17 N ATOM 984 CA THR A 367 -1.657 -6.008 -2.348 1.00 0.19 C ATOM 985 C THR A 367 -2.452 -4.737 -2.633 1.00 0.19 C ATOM 986 O THR A 367 -3.602 -4.613 -2.230 1.00 0.27 O ATOM 987 CB THR A 367 -2.289 -7.183 -3.118 1.00 0.26 C ATOM 988 OG1 THR A 367 -1.539 -8.380 -2.870 1.00 0.34 O ATOM 989 CG2 THR A 367 -2.333 -6.906 -4.617 1.00 0.32 C ATOM 0 H THR A 367 -2.524 -6.442 -0.493 1.00 0.17 H new ATOM 0 HA THR A 367 -0.630 -5.860 -2.682 1.00 0.19 H new ATOM 0 HB THR A 367 -3.313 -7.307 -2.767 1.00 0.26 H new ATOM 0 HG1 THR A 367 -0.784 -8.428 -3.493 1.00 0.34 H new ATOM 0 HG21 THR A 367 -2.785 -7.755 -5.131 1.00 0.32 H new ATOM 0 HG22 THR A 367 -2.926 -6.011 -4.804 1.00 0.32 H new ATOM 0 HG23 THR A 367 -1.320 -6.754 -4.989 1.00 0.32 H new ATOM 997 N LEU A 368 -1.823 -3.797 -3.317 1.00 0.20 N ATOM 998 CA LEU A 368 -2.493 -2.584 -3.757 1.00 0.22 C ATOM 999 C LEU A 368 -2.788 -2.645 -5.250 1.00 0.23 C ATOM 1000 O LEU A 368 -1.884 -2.871 -6.058 1.00 0.33 O ATOM 1001 CB LEU A 368 -1.630 -1.355 -3.454 1.00 0.24 C ATOM 1002 CG LEU A 368 -1.584 -0.929 -1.987 1.00 0.25 C ATOM 1003 CD1 LEU A 368 -0.533 0.151 -1.778 1.00 0.29 C ATOM 1004 CD2 LEU A 368 -2.948 -0.428 -1.541 1.00 0.25 C ATOM 0 H LEU A 368 -0.840 -3.851 -3.582 1.00 0.20 H new ATOM 0 HA LEU A 368 -3.434 -2.502 -3.213 1.00 0.22 H new ATOM 0 HB2 LEU A 368 -0.612 -1.556 -3.788 1.00 0.24 H new ATOM 0 HB3 LEU A 368 -2.000 -0.518 -4.046 1.00 0.24 H new ATOM 0 HG LEU A 368 -1.314 -1.796 -1.384 1.00 0.25 H new ATOM 0 HD11 LEU A 368 -0.514 0.442 -0.728 1.00 0.29 H new ATOM 0 HD12 LEU A 368 0.446 -0.233 -2.066 1.00 0.29 H new ATOM 0 HD13 LEU A 368 -0.776 1.019 -2.391 1.00 0.29 H new ATOM 0 HD21 LEU A 368 -2.901 -0.128 -0.494 1.00 0.25 H new ATOM 0 HD22 LEU A 368 -3.239 0.427 -2.151 1.00 0.25 H new ATOM 0 HD23 LEU A 368 -3.684 -1.224 -1.658 1.00 0.25 H new ATOM 1016 N ASP A 369 -4.050 -2.472 -5.608 1.00 0.21 N ATOM 1017 CA ASP A 369 -4.438 -2.360 -7.007 1.00 0.24 C ATOM 1018 C ASP A 369 -4.896 -0.942 -7.294 1.00 0.21 C ATOM 1019 O ASP A 369 -5.739 -0.392 -6.579 1.00 0.22 O ATOM 1020 CB ASP A 369 -5.548 -3.353 -7.363 1.00 0.31 C ATOM 1021 CG ASP A 369 -6.067 -3.162 -8.780 1.00 0.99 C ATOM 1022 OD1 ASP A 369 -5.261 -2.852 -9.686 1.00 1.52 O ATOM 1023 OD2 ASP A 369 -7.285 -3.333 -8.998 1.00 1.47 O ATOM 0 H ASP A 369 -4.825 -2.406 -4.949 1.00 0.21 H new ATOM 0 HA ASP A 369 -3.570 -2.599 -7.622 1.00 0.24 H new ATOM 0 HB2 ASP A 369 -5.171 -4.370 -7.251 1.00 0.31 H new ATOM 0 HB3 ASP A 369 -6.372 -3.239 -6.659 1.00 0.31 H new ATOM 1028 N PHE A 370 -4.329 -0.352 -8.328 1.00 0.25 N ATOM 1029 CA PHE A 370 -4.621 1.029 -8.673 1.00 0.26 C ATOM 1030 C PHE A 370 -5.413 1.099 -9.970 1.00 0.31 C ATOM 1031 O PHE A 370 -5.738 2.182 -10.452 1.00 0.35 O ATOM 1032 CB PHE A 370 -3.318 1.820 -8.801 1.00 0.31 C ATOM 1033 CG PHE A 370 -2.447 1.726 -7.579 1.00 0.32 C ATOM 1034 CD1 PHE A 370 -2.699 2.517 -6.470 1.00 0.35 C ATOM 1035 CD2 PHE A 370 -1.384 0.839 -7.538 1.00 0.37 C ATOM 1036 CE1 PHE A 370 -1.906 2.424 -5.343 1.00 0.41 C ATOM 1037 CE2 PHE A 370 -0.588 0.743 -6.415 1.00 0.42 C ATOM 1038 CZ PHE A 370 -0.849 1.536 -5.316 1.00 0.44 C ATOM 0 H PHE A 370 -3.660 -0.809 -8.948 1.00 0.25 H new ATOM 0 HA PHE A 370 -5.225 1.469 -7.880 1.00 0.26 H new ATOM 0 HB2 PHE A 370 -2.762 1.455 -9.665 1.00 0.31 H new ATOM 0 HB3 PHE A 370 -3.553 2.867 -8.992 1.00 0.31 H new ATOM 0 HD1 PHE A 370 -3.524 3.214 -6.487 1.00 0.35 H new ATOM 0 HD2 PHE A 370 -1.176 0.215 -8.395 1.00 0.37 H new ATOM 0 HE1 PHE A 370 -2.112 3.045 -4.484 1.00 0.41 H new ATOM 0 HE2 PHE A 370 0.238 0.048 -6.396 1.00 0.42 H new ATOM 0 HZ PHE A 370 -0.227 1.462 -4.436 1.00 0.44 H new ATOM 1048 N GLY A 371 -5.722 -0.070 -10.522 1.00 0.40 N ATOM 1049 CA GLY A 371 -6.485 -0.142 -11.752 1.00 0.50 C ATOM 1050 C GLY A 371 -5.807 0.569 -12.905 1.00 0.49 C ATOM 1051 O GLY A 371 -4.727 0.169 -13.348 1.00 0.58 O ATOM 0 H GLY A 371 -5.454 -0.975 -10.135 1.00 0.40 H new ATOM 0 HA2 GLY A 371 -6.641 -1.188 -12.017 1.00 0.50 H new ATOM 0 HA3 GLY A 371 -7.470 0.296 -11.590 1.00 0.50 H new ATOM 1055 N ASP A 372 -6.427 1.642 -13.369 1.00 0.49 N ATOM 1056 CA ASP A 372 -5.916 2.391 -14.505 1.00 0.56 C ATOM 1057 C ASP A 372 -4.940 3.463 -14.036 1.00 0.55 C ATOM 1058 O ASP A 372 -5.216 4.662 -14.108 1.00 0.72 O ATOM 1059 CB ASP A 372 -7.062 3.017 -15.305 1.00 0.71 C ATOM 1060 CG ASP A 372 -6.592 3.622 -16.613 1.00 1.57 C ATOM 1061 OD1 ASP A 372 -6.208 2.862 -17.525 1.00 1.89 O ATOM 1062 OD2 ASP A 372 -6.596 4.868 -16.729 1.00 2.38 O ATOM 0 H ASP A 372 -7.290 2.015 -12.973 1.00 0.49 H new ATOM 0 HA ASP A 372 -5.385 1.701 -15.160 1.00 0.56 H new ATOM 0 HB2 ASP A 372 -7.816 2.257 -15.510 1.00 0.71 H new ATOM 0 HB3 ASP A 372 -7.542 3.788 -14.703 1.00 0.71 H new ATOM 1067 N TYR A 373 -3.812 3.022 -13.505 1.00 0.52 N ATOM 1068 CA TYR A 373 -2.784 3.936 -13.037 1.00 0.51 C ATOM 1069 C TYR A 373 -1.413 3.475 -13.509 1.00 0.52 C ATOM 1070 O TYR A 373 -0.703 4.209 -14.197 1.00 0.60 O ATOM 1071 CB TYR A 373 -2.821 4.047 -11.511 1.00 0.50 C ATOM 1072 CG TYR A 373 -1.847 5.057 -10.943 1.00 0.51 C ATOM 1073 CD1 TYR A 373 -2.057 6.421 -11.103 1.00 0.56 C ATOM 1074 CD2 TYR A 373 -0.720 4.647 -10.241 1.00 0.56 C ATOM 1075 CE1 TYR A 373 -1.174 7.346 -10.581 1.00 0.64 C ATOM 1076 CE2 TYR A 373 0.167 5.565 -9.717 1.00 0.64 C ATOM 1077 CZ TYR A 373 -0.063 6.913 -9.888 1.00 0.67 C ATOM 1078 OH TYR A 373 0.817 7.829 -9.357 1.00 0.79 O ATOM 0 H TYR A 373 -3.585 2.035 -13.387 1.00 0.52 H new ATOM 0 HA TYR A 373 -2.979 4.923 -13.456 1.00 0.51 H new ATOM 0 HB2 TYR A 373 -3.830 4.317 -11.201 1.00 0.50 H new ATOM 0 HB3 TYR A 373 -2.606 3.069 -11.081 1.00 0.50 H new ATOM 0 HD1 TYR A 373 -2.926 6.764 -11.645 1.00 0.56 H new ATOM 0 HD2 TYR A 373 -0.535 3.592 -10.103 1.00 0.56 H new ATOM 0 HE1 TYR A 373 -1.353 8.403 -10.715 1.00 0.64 H new ATOM 0 HE2 TYR A 373 1.038 5.228 -9.175 1.00 0.64 H new ATOM 0 HH TYR A 373 1.544 7.357 -8.899 1.00 0.79 H new ATOM 1088 N GLN A 374 -1.049 2.248 -13.161 1.00 0.53 N ATOM 1089 CA GLN A 374 0.237 1.702 -13.563 1.00 0.59 C ATOM 1090 C GLN A 374 0.126 0.220 -13.896 1.00 0.60 C ATOM 1091 O GLN A 374 -0.947 -0.377 -13.779 1.00 0.59 O ATOM 1092 CB GLN A 374 1.290 1.922 -12.474 1.00 0.63 C ATOM 1093 CG GLN A 374 0.934 1.318 -11.127 1.00 0.59 C ATOM 1094 CD GLN A 374 2.107 1.324 -10.165 1.00 0.69 C ATOM 1095 OE1 GLN A 374 1.935 1.461 -8.958 1.00 1.09 O ATOM 1096 NE2 GLN A 374 3.311 1.161 -10.695 1.00 0.85 N ATOM 0 H GLN A 374 -1.624 1.616 -12.604 1.00 0.53 H new ATOM 0 HA GLN A 374 0.552 2.232 -14.462 1.00 0.59 H new ATOM 0 HB2 GLN A 374 2.237 1.498 -12.810 1.00 0.63 H new ATOM 0 HB3 GLN A 374 1.447 2.993 -12.348 1.00 0.63 H new ATOM 0 HG2 GLN A 374 0.105 1.875 -10.689 1.00 0.59 H new ATOM 0 HG3 GLN A 374 0.590 0.294 -11.270 1.00 0.59 H new ATOM 0 HE21 GLN A 374 3.413 1.050 -11.704 1.00 0.85 H new ATOM 0 HE22 GLN A 374 4.135 1.146 -10.094 1.00 0.85 H new ATOM 1105 N ASP A 375 1.248 -0.363 -14.297 1.00 0.74 N ATOM 1106 CA ASP A 375 1.294 -1.753 -14.730 1.00 0.78 C ATOM 1107 C ASP A 375 1.523 -2.687 -13.551 1.00 0.64 C ATOM 1108 O ASP A 375 2.482 -2.522 -12.790 1.00 0.73 O ATOM 1109 CB ASP A 375 2.407 -1.943 -15.769 1.00 1.06 C ATOM 1110 CG ASP A 375 2.685 -3.404 -16.078 1.00 1.71 C ATOM 1111 OD1 ASP A 375 1.801 -4.078 -16.642 1.00 2.21 O ATOM 1112 OD2 ASP A 375 3.797 -3.883 -15.761 1.00 2.30 O ATOM 0 H ASP A 375 2.150 0.113 -14.331 1.00 0.74 H new ATOM 0 HA ASP A 375 0.332 -2.000 -15.180 1.00 0.78 H new ATOM 0 HB2 ASP A 375 2.130 -1.429 -16.689 1.00 1.06 H new ATOM 0 HB3 ASP A 375 3.321 -1.474 -15.405 1.00 1.06 H new ATOM 1117 N GLY A 376 0.638 -3.661 -13.400 1.00 0.57 N ATOM 1118 CA GLY A 376 0.788 -4.651 -12.355 1.00 0.53 C ATOM 1119 C GLY A 376 0.327 -4.159 -10.999 1.00 0.52 C ATOM 1120 O GLY A 376 0.200 -2.952 -10.773 1.00 0.70 O ATOM 0 H GLY A 376 -0.187 -3.783 -13.987 1.00 0.57 H new ATOM 0 HA2 GLY A 376 0.221 -5.542 -12.623 1.00 0.53 H new ATOM 0 HA3 GLY A 376 1.835 -4.947 -12.291 1.00 0.53 H new ATOM 1124 N TYR A 377 0.081 -5.095 -10.093 1.00 0.46 N ATOM 1125 CA TYR A 377 -0.325 -4.759 -8.735 1.00 0.46 C ATOM 1126 C TYR A 377 0.897 -4.409 -7.898 1.00 0.37 C ATOM 1127 O TYR A 377 2.031 -4.473 -8.376 1.00 0.38 O ATOM 1128 CB TYR A 377 -1.055 -5.933 -8.075 1.00 0.53 C ATOM 1129 CG TYR A 377 -2.199 -6.500 -8.884 1.00 0.63 C ATOM 1130 CD1 TYR A 377 -3.421 -5.845 -8.954 1.00 0.83 C ATOM 1131 CD2 TYR A 377 -2.058 -7.701 -9.564 1.00 0.64 C ATOM 1132 CE1 TYR A 377 -4.471 -6.373 -9.681 1.00 0.97 C ATOM 1133 CE2 TYR A 377 -3.100 -8.233 -10.295 1.00 0.76 C ATOM 1134 CZ TYR A 377 -4.304 -7.567 -10.349 1.00 0.91 C ATOM 1135 OH TYR A 377 -5.346 -8.100 -11.071 1.00 1.06 O ATOM 0 H TYR A 377 0.156 -6.096 -10.274 1.00 0.46 H new ATOM 0 HA TYR A 377 -0.999 -3.904 -8.789 1.00 0.46 H new ATOM 0 HB2 TYR A 377 -0.335 -6.728 -7.882 1.00 0.53 H new ATOM 0 HB3 TYR A 377 -1.438 -5.608 -7.108 1.00 0.53 H new ATOM 0 HD1 TYR A 377 -3.553 -4.909 -8.432 1.00 0.83 H new ATOM 0 HD2 TYR A 377 -1.117 -8.228 -9.520 1.00 0.64 H new ATOM 0 HE1 TYR A 377 -5.417 -5.853 -9.725 1.00 0.97 H new ATOM 0 HE2 TYR A 377 -2.972 -9.167 -10.822 1.00 0.76 H new ATOM 0 HH TYR A 377 -5.062 -8.943 -11.481 1.00 1.06 H new ATOM 1145 N TYR A 378 0.665 -4.040 -6.653 1.00 0.32 N ATOM 1146 CA TYR A 378 1.748 -3.821 -5.713 1.00 0.29 C ATOM 1147 C TYR A 378 1.565 -4.722 -4.498 1.00 0.24 C ATOM 1148 O TYR A 378 0.763 -4.431 -3.614 1.00 0.26 O ATOM 1149 CB TYR A 378 1.811 -2.350 -5.291 1.00 0.31 C ATOM 1150 CG TYR A 378 2.912 -2.055 -4.300 1.00 0.32 C ATOM 1151 CD1 TYR A 378 4.232 -2.375 -4.586 1.00 0.36 C ATOM 1152 CD2 TYR A 378 2.633 -1.456 -3.078 1.00 0.37 C ATOM 1153 CE1 TYR A 378 5.241 -2.111 -3.684 1.00 0.41 C ATOM 1154 CE2 TYR A 378 3.638 -1.187 -2.170 1.00 0.40 C ATOM 1155 CZ TYR A 378 4.939 -1.518 -2.477 1.00 0.41 C ATOM 1156 OH TYR A 378 5.944 -1.253 -1.577 1.00 0.47 O ATOM 0 H TYR A 378 -0.267 -3.885 -6.268 1.00 0.32 H new ATOM 0 HA TYR A 378 2.691 -4.070 -6.199 1.00 0.29 H new ATOM 0 HB2 TYR A 378 1.955 -1.732 -6.177 1.00 0.31 H new ATOM 0 HB3 TYR A 378 0.854 -2.064 -4.855 1.00 0.31 H new ATOM 0 HD1 TYR A 378 4.473 -2.839 -5.531 1.00 0.36 H new ATOM 0 HD2 TYR A 378 1.613 -1.196 -2.834 1.00 0.37 H new ATOM 0 HE1 TYR A 378 6.263 -2.368 -3.922 1.00 0.41 H new ATOM 0 HE2 TYR A 378 3.405 -0.720 -1.225 1.00 0.40 H new ATOM 0 HH TYR A 378 6.779 -1.082 -2.060 1.00 0.47 H new ATOM 1166 N SER A 379 2.288 -5.830 -4.474 1.00 0.26 N ATOM 1167 CA SER A 379 2.166 -6.794 -3.393 1.00 0.27 C ATOM 1168 C SER A 379 3.468 -6.903 -2.616 1.00 0.24 C ATOM 1169 O SER A 379 4.518 -7.203 -3.186 1.00 0.29 O ATOM 1170 CB SER A 379 1.781 -8.166 -3.946 1.00 0.36 C ATOM 1171 OG SER A 379 0.604 -8.086 -4.732 1.00 1.06 O ATOM 0 H SER A 379 2.966 -6.084 -5.192 1.00 0.26 H new ATOM 0 HA SER A 379 1.384 -6.446 -2.718 1.00 0.27 H new ATOM 0 HB2 SER A 379 2.599 -8.561 -4.549 1.00 0.36 H new ATOM 0 HB3 SER A 379 1.626 -8.863 -3.123 1.00 0.36 H new ATOM 0 HG SER A 379 0.379 -8.976 -5.076 1.00 1.06 H new ATOM 1177 N VAL A 380 3.394 -6.653 -1.321 1.00 0.22 N ATOM 1178 CA VAL A 380 4.546 -6.797 -0.446 1.00 0.24 C ATOM 1179 C VAL A 380 4.269 -7.841 0.625 1.00 0.23 C ATOM 1180 O VAL A 380 3.131 -7.994 1.074 1.00 0.30 O ATOM 1181 CB VAL A 380 4.933 -5.463 0.228 1.00 0.27 C ATOM 1182 CG1 VAL A 380 5.495 -4.497 -0.797 1.00 0.33 C ATOM 1183 CG2 VAL A 380 3.739 -4.847 0.946 1.00 0.29 C ATOM 0 H VAL A 380 2.543 -6.347 -0.849 1.00 0.22 H new ATOM 0 HA VAL A 380 5.382 -7.117 -1.068 1.00 0.24 H new ATOM 0 HB VAL A 380 5.703 -5.669 0.972 1.00 0.27 H new ATOM 0 HG11 VAL A 380 5.763 -3.561 -0.306 1.00 0.33 H new ATOM 0 HG12 VAL A 380 6.382 -4.932 -1.259 1.00 0.33 H new ATOM 0 HG13 VAL A 380 4.745 -4.303 -1.564 1.00 0.33 H new ATOM 0 HG21 VAL A 380 4.039 -3.908 1.412 1.00 0.29 H new ATOM 0 HG22 VAL A 380 2.941 -4.657 0.228 1.00 0.29 H new ATOM 0 HG23 VAL A 380 3.381 -5.534 1.712 1.00 0.29 H new ATOM 1193 N GLN A 381 5.302 -8.569 1.014 1.00 0.22 N ATOM 1194 CA GLN A 381 5.172 -9.568 2.059 1.00 0.24 C ATOM 1195 C GLN A 381 5.372 -8.910 3.416 1.00 0.24 C ATOM 1196 O GLN A 381 6.414 -8.299 3.674 1.00 0.32 O ATOM 1197 CB GLN A 381 6.179 -10.702 1.845 1.00 0.34 C ATOM 1198 CG GLN A 381 6.005 -11.869 2.804 1.00 0.43 C ATOM 1199 CD GLN A 381 6.801 -13.090 2.386 1.00 0.72 C ATOM 1200 OE1 GLN A 381 7.029 -13.320 1.199 1.00 1.47 O ATOM 1201 NE2 GLN A 381 7.224 -13.887 3.354 1.00 0.94 N ATOM 0 H GLN A 381 6.240 -8.486 0.621 1.00 0.22 H new ATOM 0 HA GLN A 381 4.172 -10.001 2.022 1.00 0.24 H new ATOM 0 HB2 GLN A 381 6.087 -11.068 0.822 1.00 0.34 H new ATOM 0 HB3 GLN A 381 7.188 -10.304 1.952 1.00 0.34 H new ATOM 0 HG2 GLN A 381 6.314 -11.563 3.803 1.00 0.43 H new ATOM 0 HG3 GLN A 381 4.949 -12.131 2.864 1.00 0.43 H new ATOM 0 HE21 GLN A 381 7.015 -13.663 4.327 1.00 0.94 H new ATOM 0 HE22 GLN A 381 7.759 -14.725 3.127 1.00 0.94 H new ATOM 1210 N THR A 382 4.364 -9.017 4.266 1.00 0.21 N ATOM 1211 CA THR A 382 4.374 -8.349 5.552 1.00 0.26 C ATOM 1212 C THR A 382 3.232 -8.847 6.431 1.00 0.25 C ATOM 1213 O THR A 382 2.120 -9.084 5.951 1.00 0.30 O ATOM 1214 CB THR A 382 4.260 -6.813 5.387 1.00 0.30 C ATOM 1215 OG1 THR A 382 4.111 -6.186 6.665 1.00 0.42 O ATOM 1216 CG2 THR A 382 3.083 -6.437 4.495 1.00 0.28 C ATOM 0 H THR A 382 3.523 -9.565 4.084 1.00 0.21 H new ATOM 0 HA THR A 382 5.325 -8.583 6.031 1.00 0.26 H new ATOM 0 HB THR A 382 5.177 -6.462 4.914 1.00 0.30 H new ATOM 0 HG1 THR A 382 4.042 -5.216 6.547 1.00 0.42 H new ATOM 0 HG21 THR A 382 3.031 -5.352 4.399 1.00 0.28 H new ATOM 0 HG22 THR A 382 3.217 -6.882 3.509 1.00 0.28 H new ATOM 0 HG23 THR A 382 2.158 -6.807 4.938 1.00 0.28 H new ATOM 1224 N THR A 383 3.510 -9.011 7.715 1.00 0.31 N ATOM 1225 CA THR A 383 2.485 -9.396 8.669 1.00 0.37 C ATOM 1226 C THR A 383 1.687 -8.170 9.098 1.00 0.36 C ATOM 1227 O THR A 383 0.623 -8.280 9.709 1.00 0.46 O ATOM 1228 CB THR A 383 3.103 -10.073 9.910 1.00 0.50 C ATOM 1229 OG1 THR A 383 4.083 -9.212 10.506 1.00 0.55 O ATOM 1230 CG2 THR A 383 3.750 -11.399 9.537 1.00 0.55 C ATOM 0 H THR A 383 4.438 -8.883 8.119 1.00 0.31 H new ATOM 0 HA THR A 383 1.823 -10.112 8.182 1.00 0.37 H new ATOM 0 HB THR A 383 2.303 -10.263 10.626 1.00 0.50 H new ATOM 0 HG1 THR A 383 4.468 -9.650 11.294 1.00 0.55 H new ATOM 0 HG21 THR A 383 4.179 -11.858 10.428 1.00 0.55 H new ATOM 0 HG22 THR A 383 2.998 -12.064 9.112 1.00 0.55 H new ATOM 0 HG23 THR A 383 4.537 -11.226 8.803 1.00 0.55 H new ATOM 1238 N GLU A 384 2.206 -6.998 8.746 1.00 0.31 N ATOM 1239 CA GLU A 384 1.584 -5.738 9.117 1.00 0.35 C ATOM 1240 C GLU A 384 0.677 -5.241 7.995 1.00 0.28 C ATOM 1241 O GLU A 384 0.185 -4.114 8.037 1.00 0.27 O ATOM 1242 CB GLU A 384 2.657 -4.693 9.432 1.00 0.46 C ATOM 1243 CG GLU A 384 3.662 -5.160 10.476 1.00 0.57 C ATOM 1244 CD GLU A 384 4.761 -4.149 10.732 1.00 0.90 C ATOM 1245 OE1 GLU A 384 5.670 -4.027 9.886 1.00 0.95 O ATOM 1246 OE2 GLU A 384 4.718 -3.463 11.775 1.00 1.39 O ATOM 0 H GLU A 384 3.062 -6.898 8.200 1.00 0.31 H new ATOM 0 HA GLU A 384 0.977 -5.899 10.008 1.00 0.35 H new ATOM 0 HB2 GLU A 384 3.188 -4.439 8.514 1.00 0.46 H new ATOM 0 HB3 GLU A 384 2.175 -3.781 9.784 1.00 0.46 H new ATOM 0 HG2 GLU A 384 3.139 -5.365 11.410 1.00 0.57 H new ATOM 0 HG3 GLU A 384 4.108 -6.099 10.148 1.00 0.57 H new ATOM 1253 N GLY A 385 0.458 -6.095 6.994 1.00 0.27 N ATOM 1254 CA GLY A 385 -0.430 -5.753 5.894 1.00 0.27 C ATOM 1255 C GLY A 385 -1.829 -5.439 6.377 1.00 0.26 C ATOM 1256 O GLY A 385 -2.512 -4.574 5.825 1.00 0.27 O ATOM 0 H GLY A 385 0.882 -7.020 6.927 1.00 0.27 H new ATOM 0 HA2 GLY A 385 -0.029 -4.893 5.358 1.00 0.27 H new ATOM 0 HA3 GLY A 385 -0.467 -6.581 5.186 1.00 0.27 H new ATOM 1260 N GLU A 386 -2.245 -6.149 7.419 1.00 0.30 N ATOM 1261 CA GLU A 386 -3.519 -5.900 8.077 1.00 0.35 C ATOM 1262 C GLU A 386 -3.600 -4.449 8.547 1.00 0.31 C ATOM 1263 O GLU A 386 -4.592 -3.754 8.309 1.00 0.36 O ATOM 1264 CB GLU A 386 -3.663 -6.836 9.276 1.00 0.44 C ATOM 1265 CG GLU A 386 -4.963 -6.669 10.039 1.00 0.53 C ATOM 1266 CD GLU A 386 -4.923 -7.340 11.392 1.00 1.40 C ATOM 1267 OE1 GLU A 386 -4.958 -8.586 11.447 1.00 1.77 O ATOM 1268 OE2 GLU A 386 -4.854 -6.624 12.412 1.00 2.28 O ATOM 0 H GLU A 386 -1.708 -6.913 7.830 1.00 0.30 H new ATOM 0 HA GLU A 386 -4.326 -6.084 7.368 1.00 0.35 H new ATOM 0 HB2 GLU A 386 -3.587 -7.867 8.930 1.00 0.44 H new ATOM 0 HB3 GLU A 386 -2.830 -6.667 9.958 1.00 0.44 H new ATOM 0 HG2 GLU A 386 -5.172 -5.607 10.168 1.00 0.53 H new ATOM 0 HG3 GLU A 386 -5.782 -7.086 9.453 1.00 0.53 H new ATOM 1275 N GLN A 387 -2.530 -4.001 9.197 1.00 0.29 N ATOM 1276 CA GLN A 387 -2.453 -2.649 9.734 1.00 0.30 C ATOM 1277 C GLN A 387 -2.538 -1.621 8.617 1.00 0.27 C ATOM 1278 O GLN A 387 -3.319 -0.678 8.691 1.00 0.31 O ATOM 1279 CB GLN A 387 -1.145 -2.459 10.504 1.00 0.35 C ATOM 1280 CG GLN A 387 -0.968 -3.422 11.664 1.00 0.45 C ATOM 1281 CD GLN A 387 0.363 -3.243 12.364 1.00 1.13 C ATOM 1282 OE1 GLN A 387 0.897 -2.135 12.444 1.00 2.27 O ATOM 1283 NE2 GLN A 387 0.918 -4.335 12.852 1.00 0.83 N ATOM 0 H GLN A 387 -1.696 -4.563 9.365 1.00 0.29 H new ATOM 0 HA GLN A 387 -3.295 -2.505 10.411 1.00 0.30 H new ATOM 0 HB2 GLN A 387 -0.309 -2.578 9.815 1.00 0.35 H new ATOM 0 HB3 GLN A 387 -1.103 -1.438 10.883 1.00 0.35 H new ATOM 0 HG2 GLN A 387 -1.775 -3.275 12.381 1.00 0.45 H new ATOM 0 HG3 GLN A 387 -1.049 -4.446 11.299 1.00 0.45 H new ATOM 0 HE21 GLN A 387 0.441 -5.232 12.764 1.00 0.83 H new ATOM 0 HE22 GLN A 387 1.824 -4.282 13.317 1.00 0.83 H new ATOM 1292 N ILE A 388 -1.737 -1.832 7.575 1.00 0.24 N ATOM 1293 CA ILE A 388 -1.671 -0.908 6.445 1.00 0.23 C ATOM 1294 C ILE A 388 -3.049 -0.699 5.823 1.00 0.22 C ATOM 1295 O ILE A 388 -3.466 0.434 5.579 1.00 0.22 O ATOM 1296 CB ILE A 388 -0.700 -1.421 5.359 1.00 0.23 C ATOM 1297 CG1 ILE A 388 0.673 -1.716 5.969 1.00 0.27 C ATOM 1298 CG2 ILE A 388 -0.574 -0.401 4.235 1.00 0.24 C ATOM 1299 CD1 ILE A 388 1.656 -2.335 4.996 1.00 0.29 C ATOM 0 H ILE A 388 -1.121 -2.640 7.490 1.00 0.24 H new ATOM 0 HA ILE A 388 -1.304 0.043 6.832 1.00 0.23 H new ATOM 0 HB ILE A 388 -1.101 -2.346 4.944 1.00 0.23 H new ATOM 0 HG12 ILE A 388 1.095 -0.788 6.356 1.00 0.27 H new ATOM 0 HG13 ILE A 388 0.546 -2.387 6.818 1.00 0.27 H new ATOM 0 HG21 ILE A 388 0.114 -0.777 3.478 1.00 0.24 H new ATOM 0 HG22 ILE A 388 -1.552 -0.233 3.785 1.00 0.24 H new ATOM 0 HG23 ILE A 388 -0.193 0.538 4.637 1.00 0.24 H new ATOM 0 HD11 ILE A 388 2.605 -2.514 5.502 1.00 0.29 H new ATOM 0 HD12 ILE A 388 1.257 -3.280 4.627 1.00 0.29 H new ATOM 0 HD13 ILE A 388 1.814 -1.656 4.158 1.00 0.29 H new ATOM 1311 N ALA A 389 -3.752 -1.803 5.591 1.00 0.22 N ATOM 1312 CA ALA A 389 -5.068 -1.769 4.959 1.00 0.24 C ATOM 1313 C ALA A 389 -6.040 -0.882 5.726 1.00 0.22 C ATOM 1314 O ALA A 389 -6.621 0.054 5.170 1.00 0.23 O ATOM 1315 CB ALA A 389 -5.625 -3.178 4.849 1.00 0.28 C ATOM 0 H ALA A 389 -3.430 -2.740 5.833 1.00 0.22 H new ATOM 0 HA ALA A 389 -4.948 -1.344 3.962 1.00 0.24 H new ATOM 0 HB1 ALA A 389 -6.607 -3.145 4.377 1.00 0.28 H new ATOM 0 HB2 ALA A 389 -4.953 -3.789 4.247 1.00 0.28 H new ATOM 0 HB3 ALA A 389 -5.716 -3.612 5.845 1.00 0.28 H new ATOM 1321 N GLN A 390 -6.201 -1.164 7.011 1.00 0.22 N ATOM 1322 CA GLN A 390 -7.162 -0.443 7.829 1.00 0.25 C ATOM 1323 C GLN A 390 -6.669 0.969 8.133 1.00 0.21 C ATOM 1324 O GLN A 390 -7.464 1.871 8.401 1.00 0.23 O ATOM 1325 CB GLN A 390 -7.444 -1.216 9.119 1.00 0.34 C ATOM 1326 CG GLN A 390 -8.535 -0.595 9.976 1.00 0.50 C ATOM 1327 CD GLN A 390 -9.083 -1.558 11.006 1.00 1.15 C ATOM 1328 OE1 GLN A 390 -8.573 -1.650 12.124 1.00 1.99 O ATOM 1329 NE2 GLN A 390 -10.130 -2.278 10.637 1.00 1.61 N ATOM 0 H GLN A 390 -5.679 -1.886 7.508 1.00 0.22 H new ATOM 0 HA GLN A 390 -8.094 -0.354 7.270 1.00 0.25 H new ATOM 0 HB2 GLN A 390 -7.730 -2.237 8.866 1.00 0.34 H new ATOM 0 HB3 GLN A 390 -6.526 -1.278 9.703 1.00 0.34 H new ATOM 0 HG2 GLN A 390 -8.138 0.285 10.482 1.00 0.50 H new ATOM 0 HG3 GLN A 390 -9.347 -0.255 9.334 1.00 0.50 H new ATOM 0 HE21 GLN A 390 -10.520 -2.169 9.701 1.00 1.61 H new ATOM 0 HE22 GLN A 390 -10.548 -2.942 11.289 1.00 1.61 H new ATOM 1338 N LEU A 391 -5.360 1.168 8.075 1.00 0.21 N ATOM 1339 CA LEU A 391 -4.792 2.492 8.272 1.00 0.22 C ATOM 1340 C LEU A 391 -5.169 3.397 7.102 1.00 0.20 C ATOM 1341 O LEU A 391 -5.617 4.527 7.300 1.00 0.22 O ATOM 1342 CB LEU A 391 -3.270 2.415 8.418 1.00 0.26 C ATOM 1343 CG LEU A 391 -2.593 3.719 8.838 1.00 0.27 C ATOM 1344 CD1 LEU A 391 -3.112 4.179 10.191 1.00 0.60 C ATOM 1345 CD2 LEU A 391 -1.084 3.545 8.878 1.00 0.63 C ATOM 0 H LEU A 391 -4.676 0.434 7.894 1.00 0.21 H new ATOM 0 HA LEU A 391 -5.199 2.912 9.192 1.00 0.22 H new ATOM 0 HB2 LEU A 391 -3.029 1.646 9.152 1.00 0.26 H new ATOM 0 HB3 LEU A 391 -2.845 2.093 7.467 1.00 0.26 H new ATOM 0 HG LEU A 391 -2.833 4.484 8.100 1.00 0.27 H new ATOM 0 HD11 LEU A 391 -2.618 5.109 10.473 1.00 0.60 H new ATOM 0 HD12 LEU A 391 -4.188 4.343 10.131 1.00 0.60 H new ATOM 0 HD13 LEU A 391 -2.902 3.415 10.940 1.00 0.60 H new ATOM 0 HD21 LEU A 391 -0.617 4.483 9.179 1.00 0.63 H new ATOM 0 HD22 LEU A 391 -0.827 2.765 9.595 1.00 0.63 H new ATOM 0 HD23 LEU A 391 -0.724 3.262 7.889 1.00 0.63 H new ATOM 1357 N ILE A 392 -5.007 2.885 5.883 1.00 0.18 N ATOM 1358 CA ILE A 392 -5.403 3.621 4.687 1.00 0.17 C ATOM 1359 C ILE A 392 -6.899 3.914 4.725 1.00 0.17 C ATOM 1360 O ILE A 392 -7.325 5.048 4.507 1.00 0.19 O ATOM 1361 CB ILE A 392 -5.062 2.845 3.390 1.00 0.17 C ATOM 1362 CG1 ILE A 392 -3.555 2.583 3.305 1.00 0.19 C ATOM 1363 CG2 ILE A 392 -5.537 3.614 2.158 1.00 0.19 C ATOM 1364 CD1 ILE A 392 -3.145 1.761 2.102 1.00 0.21 C ATOM 0 H ILE A 392 -4.605 1.966 5.699 1.00 0.18 H new ATOM 0 HA ILE A 392 -4.841 4.555 4.678 1.00 0.17 H new ATOM 0 HB ILE A 392 -5.582 1.888 3.418 1.00 0.17 H new ATOM 0 HG12 ILE A 392 -3.031 3.538 3.277 1.00 0.19 H new ATOM 0 HG13 ILE A 392 -3.233 2.070 4.211 1.00 0.19 H new ATOM 0 HG21 ILE A 392 -5.287 3.051 1.259 1.00 0.19 H new ATOM 0 HG22 ILE A 392 -6.617 3.754 2.210 1.00 0.19 H new ATOM 0 HG23 ILE A 392 -5.046 4.587 2.125 1.00 0.19 H new ATOM 0 HD11 ILE A 392 -2.065 1.617 2.111 1.00 0.21 H new ATOM 0 HD12 ILE A 392 -3.640 0.791 2.138 1.00 0.21 H new ATOM 0 HD13 ILE A 392 -3.435 2.282 1.189 1.00 0.21 H new ATOM 1376 N ALA A 393 -7.688 2.889 5.040 1.00 0.18 N ATOM 1377 CA ALA A 393 -9.138 3.035 5.144 1.00 0.21 C ATOM 1378 C ALA A 393 -9.511 4.063 6.209 1.00 0.23 C ATOM 1379 O ALA A 393 -10.495 4.793 6.064 1.00 0.29 O ATOM 1380 CB ALA A 393 -9.782 1.694 5.456 1.00 0.24 C ATOM 0 H ALA A 393 -7.347 1.946 5.228 1.00 0.18 H new ATOM 0 HA ALA A 393 -9.512 3.391 4.184 1.00 0.21 H new ATOM 0 HB1 ALA A 393 -10.862 1.818 5.531 1.00 0.24 H new ATOM 0 HB2 ALA A 393 -9.552 0.986 4.660 1.00 0.24 H new ATOM 0 HB3 ALA A 393 -9.394 1.315 6.402 1.00 0.24 H new ATOM 1386 N GLY A 394 -8.721 4.113 7.274 1.00 0.23 N ATOM 1387 CA GLY A 394 -8.951 5.074 8.338 1.00 0.27 C ATOM 1388 C GLY A 394 -8.729 6.503 7.883 1.00 0.28 C ATOM 1389 O GLY A 394 -9.555 7.380 8.151 1.00 0.35 O ATOM 0 H GLY A 394 -7.919 3.500 7.421 1.00 0.23 H new ATOM 0 HA2 GLY A 394 -9.971 4.967 8.706 1.00 0.27 H new ATOM 0 HA3 GLY A 394 -8.286 4.854 9.173 1.00 0.27 H new ATOM 1393 N TYR A 395 -7.620 6.738 7.189 1.00 0.27 N ATOM 1394 CA TYR A 395 -7.316 8.060 6.651 1.00 0.30 C ATOM 1395 C TYR A 395 -8.326 8.447 5.577 1.00 0.30 C ATOM 1396 O TYR A 395 -8.795 9.584 5.529 1.00 0.36 O ATOM 1397 CB TYR A 395 -5.901 8.100 6.072 1.00 0.31 C ATOM 1398 CG TYR A 395 -4.809 8.041 7.118 1.00 0.37 C ATOM 1399 CD1 TYR A 395 -4.828 8.895 8.214 1.00 0.48 C ATOM 1400 CD2 TYR A 395 -3.756 7.146 7.002 1.00 0.41 C ATOM 1401 CE1 TYR A 395 -3.830 8.854 9.166 1.00 0.58 C ATOM 1402 CE2 TYR A 395 -2.751 7.102 7.949 1.00 0.51 C ATOM 1403 CZ TYR A 395 -2.793 7.958 9.029 1.00 0.58 C ATOM 1404 OH TYR A 395 -1.793 7.922 9.972 1.00 0.70 O ATOM 0 H TYR A 395 -6.916 6.029 6.986 1.00 0.27 H new ATOM 0 HA TYR A 395 -7.378 8.777 7.470 1.00 0.30 H new ATOM 0 HB2 TYR A 395 -5.777 7.264 5.384 1.00 0.31 H new ATOM 0 HB3 TYR A 395 -5.783 9.013 5.489 1.00 0.31 H new ATOM 0 HD1 TYR A 395 -5.637 9.602 8.322 1.00 0.48 H new ATOM 0 HD2 TYR A 395 -3.721 6.473 6.158 1.00 0.41 H new ATOM 0 HE1 TYR A 395 -3.862 9.521 10.015 1.00 0.58 H new ATOM 0 HE2 TYR A 395 -1.937 6.401 7.844 1.00 0.51 H new ATOM 0 HH TYR A 395 -1.139 7.234 9.729 1.00 0.70 H new ATOM 1414 N ILE A 396 -8.661 7.486 4.726 1.00 0.27 N ATOM 1415 CA ILE A 396 -9.662 7.681 3.685 1.00 0.31 C ATOM 1416 C ILE A 396 -11.004 8.091 4.287 1.00 0.37 C ATOM 1417 O ILE A 396 -11.718 8.928 3.733 1.00 0.45 O ATOM 1418 CB ILE A 396 -9.816 6.395 2.840 1.00 0.33 C ATOM 1419 CG1 ILE A 396 -8.641 6.273 1.868 1.00 0.34 C ATOM 1420 CG2 ILE A 396 -11.145 6.360 2.094 1.00 0.38 C ATOM 1421 CD1 ILE A 396 -8.566 4.932 1.178 1.00 0.42 C ATOM 0 H ILE A 396 -8.249 6.553 4.737 1.00 0.27 H new ATOM 0 HA ILE A 396 -9.324 8.488 3.034 1.00 0.31 H new ATOM 0 HB ILE A 396 -9.811 5.541 3.517 1.00 0.33 H new ATOM 0 HG12 ILE A 396 -8.721 7.056 1.114 1.00 0.34 H new ATOM 0 HG13 ILE A 396 -7.712 6.446 2.411 1.00 0.34 H new ATOM 0 HG21 ILE A 396 -11.212 5.440 1.513 1.00 0.38 H new ATOM 0 HG22 ILE A 396 -11.966 6.397 2.811 1.00 0.38 H new ATOM 0 HG23 ILE A 396 -11.209 7.218 1.424 1.00 0.38 H new ATOM 0 HD11 ILE A 396 -7.709 4.917 0.504 1.00 0.42 H new ATOM 0 HD12 ILE A 396 -8.455 4.145 1.924 1.00 0.42 H new ATOM 0 HD13 ILE A 396 -9.480 4.765 0.607 1.00 0.42 H new ATOM 1433 N ASP A 397 -11.322 7.521 5.443 1.00 0.38 N ATOM 1434 CA ASP A 397 -12.563 7.838 6.140 1.00 0.47 C ATOM 1435 C ASP A 397 -12.579 9.301 6.576 1.00 0.51 C ATOM 1436 O ASP A 397 -13.639 9.918 6.678 1.00 0.63 O ATOM 1437 CB ASP A 397 -12.731 6.926 7.355 1.00 0.52 C ATOM 1438 CG ASP A 397 -14.099 7.050 7.992 1.00 0.69 C ATOM 1439 OD1 ASP A 397 -15.066 6.498 7.429 1.00 0.73 O ATOM 1440 OD2 ASP A 397 -14.208 7.669 9.068 1.00 0.99 O ATOM 0 H ASP A 397 -10.736 6.835 5.919 1.00 0.38 H new ATOM 0 HA ASP A 397 -13.394 7.674 5.454 1.00 0.47 H new ATOM 0 HB2 ASP A 397 -12.567 5.891 7.053 1.00 0.52 H new ATOM 0 HB3 ASP A 397 -11.967 7.167 8.094 1.00 0.52 H new ATOM 1445 N ILE A 398 -11.393 9.849 6.817 1.00 0.47 N ATOM 1446 CA ILE A 398 -11.252 11.247 7.209 1.00 0.53 C ATOM 1447 C ILE A 398 -11.427 12.159 5.997 1.00 0.55 C ATOM 1448 O ILE A 398 -12.009 13.242 6.098 1.00 0.65 O ATOM 1449 CB ILE A 398 -9.871 11.515 7.854 1.00 0.54 C ATOM 1450 CG1 ILE A 398 -9.651 10.584 9.051 1.00 0.57 C ATOM 1451 CG2 ILE A 398 -9.750 12.972 8.283 1.00 0.62 C ATOM 1452 CD1 ILE A 398 -8.285 10.726 9.689 1.00 0.81 C ATOM 0 H ILE A 398 -10.510 9.343 6.747 1.00 0.47 H new ATOM 0 HA ILE A 398 -12.028 11.461 7.944 1.00 0.53 H new ATOM 0 HB ILE A 398 -9.100 11.313 7.110 1.00 0.54 H new ATOM 0 HG12 ILE A 398 -10.416 10.785 9.802 1.00 0.57 H new ATOM 0 HG13 ILE A 398 -9.786 9.552 8.727 1.00 0.57 H new ATOM 0 HG21 ILE A 398 -8.772 13.138 8.734 1.00 0.62 H new ATOM 0 HG22 ILE A 398 -9.863 13.618 7.413 1.00 0.62 H new ATOM 0 HG23 ILE A 398 -10.529 13.203 9.010 1.00 0.62 H new ATOM 0 HD11 ILE A 398 -8.202 10.036 10.529 1.00 0.81 H new ATOM 0 HD12 ILE A 398 -7.514 10.496 8.953 1.00 0.81 H new ATOM 0 HD13 ILE A 398 -8.154 11.748 10.045 1.00 0.81 H new ATOM 1464 N ILE A 399 -10.925 11.707 4.852 1.00 0.50 N ATOM 1465 CA ILE A 399 -11.038 12.460 3.608 1.00 0.52 C ATOM 1466 C ILE A 399 -12.490 12.499 3.136 1.00 0.59 C ATOM 1467 O ILE A 399 -12.965 13.510 2.618 1.00 0.72 O ATOM 1468 CB ILE A 399 -10.163 11.844 2.492 1.00 0.47 C ATOM 1469 CG1 ILE A 399 -8.714 11.700 2.965 1.00 0.47 C ATOM 1470 CG2 ILE A 399 -10.226 12.696 1.229 1.00 0.50 C ATOM 1471 CD1 ILE A 399 -7.815 11.008 1.963 1.00 0.48 C ATOM 0 H ILE A 399 -10.433 10.818 4.760 1.00 0.50 H new ATOM 0 HA ILE A 399 -10.688 13.472 3.811 1.00 0.52 H new ATOM 0 HB ILE A 399 -10.552 10.853 2.260 1.00 0.47 H new ATOM 0 HG12 ILE A 399 -8.311 12.690 3.180 1.00 0.47 H new ATOM 0 HG13 ILE A 399 -8.700 11.140 3.900 1.00 0.47 H new ATOM 0 HG21 ILE A 399 -9.604 12.246 0.455 1.00 0.50 H new ATOM 0 HG22 ILE A 399 -11.257 12.752 0.879 1.00 0.50 H new ATOM 0 HG23 ILE A 399 -9.863 13.700 1.449 1.00 0.50 H new ATOM 0 HD11 ILE A 399 -6.804 10.942 2.366 1.00 0.48 H new ATOM 0 HD12 ILE A 399 -8.194 10.005 1.766 1.00 0.48 H new ATOM 0 HD13 ILE A 399 -7.799 11.578 1.034 1.00 0.48 H new ATOM 1603 N TRP B 374 -10.857 -8.137 -0.663 1.00 1.08 N ATOM 1604 CA TRP B 374 -10.623 -6.882 -1.351 1.00 0.61 C ATOM 1605 C TRP B 374 -11.446 -5.767 -0.747 1.00 0.55 C ATOM 1606 O TRP B 374 -12.655 -5.898 -0.551 1.00 0.90 O ATOM 1607 CB TRP B 374 -10.933 -7.040 -2.837 1.00 0.88 C ATOM 1608 CG TRP B 374 -10.086 -8.086 -3.500 1.00 0.97 C ATOM 1609 CD1 TRP B 374 -10.272 -9.437 -3.432 1.00 1.38 C ATOM 1610 CD2 TRP B 374 -8.919 -7.881 -4.313 1.00 0.81 C ATOM 1611 NE1 TRP B 374 -9.307 -10.084 -4.163 1.00 1.42 N ATOM 1612 CE2 TRP B 374 -8.463 -9.154 -4.710 1.00 1.02 C ATOM 1613 CE3 TRP B 374 -8.215 -6.751 -4.748 1.00 0.85 C ATOM 1614 CZ2 TRP B 374 -7.343 -9.325 -5.518 1.00 0.98 C ATOM 1615 CZ3 TRP B 374 -7.103 -6.925 -5.549 1.00 0.97 C ATOM 1616 CH2 TRP B 374 -6.676 -8.203 -5.926 1.00 0.88 C ATOM 0 HA TRP B 374 -9.573 -6.615 -1.236 1.00 0.61 H new ATOM 0 HB2 TRP B 374 -11.985 -7.300 -2.958 1.00 0.88 H new ATOM 0 HB3 TRP B 374 -10.781 -6.084 -3.339 1.00 0.88 H new ATOM 0 HD1 TRP B 374 -11.063 -9.926 -2.883 1.00 1.38 H new ATOM 0 HE1 TRP B 374 -9.231 -11.094 -4.280 1.00 1.42 H new ATOM 0 HE3 TRP B 374 -8.536 -5.760 -4.462 1.00 0.85 H new ATOM 0 HZ2 TRP B 374 -7.012 -10.310 -5.813 1.00 0.98 H new ATOM 0 HZ3 TRP B 374 -6.554 -6.060 -5.890 1.00 0.97 H new ATOM 0 HH2 TRP B 374 -5.802 -8.305 -6.552 1.00 0.88 H new ATOM 1627 N VAL B 375 -10.773 -4.676 -0.439 1.00 0.40 N ATOM 1628 CA VAL B 375 -11.417 -3.507 0.127 1.00 0.38 C ATOM 1629 C VAL B 375 -11.276 -2.348 -0.848 1.00 0.44 C ATOM 1630 O VAL B 375 -10.166 -1.893 -1.126 1.00 0.53 O ATOM 1631 CB VAL B 375 -10.806 -3.116 1.493 1.00 0.48 C ATOM 1632 CG1 VAL B 375 -11.637 -2.021 2.156 1.00 0.84 C ATOM 1633 CG2 VAL B 375 -10.684 -4.331 2.415 1.00 1.07 C ATOM 0 H VAL B 375 -9.767 -4.575 -0.574 1.00 0.40 H new ATOM 0 HA VAL B 375 -12.468 -3.742 0.294 1.00 0.38 H new ATOM 0 HB VAL B 375 -9.802 -2.731 1.313 1.00 0.48 H new ATOM 0 HG11 VAL B 375 -11.193 -1.758 3.116 1.00 0.84 H new ATOM 0 HG12 VAL B 375 -11.659 -1.141 1.513 1.00 0.84 H new ATOM 0 HG13 VAL B 375 -12.654 -2.381 2.313 1.00 0.84 H new ATOM 0 HG21 VAL B 375 -10.251 -4.023 3.367 1.00 1.07 H new ATOM 0 HG22 VAL B 375 -11.672 -4.758 2.587 1.00 1.07 H new ATOM 0 HG23 VAL B 375 -10.042 -5.078 1.949 1.00 1.07 H new ATOM 1643 N GLU B 376 -12.392 -1.899 -1.398 1.00 0.51 N ATOM 1644 CA GLU B 376 -12.372 -0.861 -2.406 1.00 0.63 C ATOM 1645 C GLU B 376 -12.667 0.505 -1.804 1.00 0.52 C ATOM 1646 O GLU B 376 -13.446 0.633 -0.857 1.00 0.61 O ATOM 1647 CB GLU B 376 -13.359 -1.182 -3.537 1.00 0.86 C ATOM 1648 CG GLU B 376 -14.814 -1.346 -3.108 1.00 1.43 C ATOM 1649 CD GLU B 376 -15.062 -2.606 -2.304 1.00 1.69 C ATOM 1650 OE1 GLU B 376 -15.194 -3.687 -2.909 1.00 2.06 O ATOM 1651 OE2 GLU B 376 -15.124 -2.517 -1.060 1.00 2.28 O ATOM 0 H GLU B 376 -13.323 -2.240 -1.160 1.00 0.51 H new ATOM 0 HA GLU B 376 -11.367 -0.827 -2.826 1.00 0.63 H new ATOM 0 HB2 GLU B 376 -13.304 -0.387 -4.281 1.00 0.86 H new ATOM 0 HB3 GLU B 376 -13.037 -2.100 -4.028 1.00 0.86 H new ATOM 0 HG2 GLU B 376 -15.111 -0.481 -2.515 1.00 1.43 H new ATOM 0 HG3 GLU B 376 -15.448 -1.358 -3.995 1.00 1.43 H new ATOM 1658 N ASN B 377 -12.029 1.516 -2.365 1.00 0.54 N ATOM 1659 CA ASN B 377 -12.171 2.883 -1.895 1.00 0.58 C ATOM 1660 C ASN B 377 -13.184 3.639 -2.746 1.00 0.50 C ATOM 1661 O ASN B 377 -13.422 3.290 -3.903 1.00 0.65 O ATOM 1662 CB ASN B 377 -10.818 3.602 -1.937 1.00 0.83 C ATOM 1663 CG ASN B 377 -10.241 3.690 -3.339 1.00 0.88 C ATOM 1664 OD1 ASN B 377 -10.533 2.862 -4.197 1.00 1.83 O ATOM 1665 ND2 ASN B 377 -9.400 4.682 -3.578 1.00 1.23 N ATOM 0 H ASN B 377 -11.398 1.413 -3.159 1.00 0.54 H new ATOM 0 HA ASN B 377 -12.528 2.856 -0.866 1.00 0.58 H new ATOM 0 HB2 ASN B 377 -10.934 4.608 -1.533 1.00 0.83 H new ATOM 0 HB3 ASN B 377 -10.113 3.078 -1.291 1.00 0.83 H new ATOM 0 HD21 ASN B 377 -8.972 4.777 -4.499 1.00 1.23 H new ATOM 0 HD22 ASN B 377 -9.180 5.352 -2.842 1.00 1.23 H new ATOM 1672 N GLU B 378 -13.779 4.672 -2.172 1.00 0.43 N ATOM 1673 CA GLU B 378 -14.779 5.461 -2.876 1.00 0.51 C ATOM 1674 C GLU B 378 -14.228 6.818 -3.282 1.00 0.44 C ATOM 1675 O GLU B 378 -14.979 7.755 -3.556 1.00 0.53 O ATOM 1676 CB GLU B 378 -16.026 5.629 -2.006 1.00 0.71 C ATOM 1677 CG GLU B 378 -16.650 4.311 -1.576 1.00 0.87 C ATOM 1678 CD GLU B 378 -17.773 4.496 -0.584 1.00 1.05 C ATOM 1679 OE1 GLU B 378 -18.932 4.667 -1.012 1.00 1.39 O ATOM 1680 OE2 GLU B 378 -17.504 4.464 0.632 1.00 1.88 O ATOM 0 H GLU B 378 -13.587 4.984 -1.220 1.00 0.43 H new ATOM 0 HA GLU B 378 -15.051 4.927 -3.787 1.00 0.51 H new ATOM 0 HB2 GLU B 378 -15.764 6.204 -1.118 1.00 0.71 H new ATOM 0 HB3 GLU B 378 -16.767 6.210 -2.556 1.00 0.71 H new ATOM 0 HG2 GLU B 378 -17.029 3.789 -2.455 1.00 0.87 H new ATOM 0 HG3 GLU B 378 -15.881 3.676 -1.135 1.00 0.87 H new ATOM 1687 N ILE B 379 -12.914 6.916 -3.319 1.00 0.36 N ATOM 1688 CA ILE B 379 -12.261 8.118 -3.825 1.00 0.38 C ATOM 1689 C ILE B 379 -11.416 7.811 -5.055 1.00 0.48 C ATOM 1690 O ILE B 379 -10.546 8.596 -5.430 1.00 1.17 O ATOM 1691 CB ILE B 379 -11.375 8.819 -2.766 1.00 0.38 C ATOM 1692 CG1 ILE B 379 -10.316 7.860 -2.195 1.00 0.37 C ATOM 1693 CG2 ILE B 379 -12.234 9.393 -1.638 1.00 0.43 C ATOM 1694 CD1 ILE B 379 -9.422 8.485 -1.129 1.00 0.44 C ATOM 0 H ILE B 379 -12.275 6.184 -3.007 1.00 0.36 H new ATOM 0 HA ILE B 379 -13.069 8.800 -4.091 1.00 0.38 H new ATOM 0 HB ILE B 379 -10.854 9.638 -3.262 1.00 0.38 H new ATOM 0 HG12 ILE B 379 -10.819 6.992 -1.769 1.00 0.37 H new ATOM 0 HG13 ILE B 379 -9.691 7.498 -3.011 1.00 0.37 H new ATOM 0 HG21 ILE B 379 -11.592 9.881 -0.904 1.00 0.43 H new ATOM 0 HG22 ILE B 379 -12.935 10.120 -2.048 1.00 0.43 H new ATOM 0 HG23 ILE B 379 -12.788 8.587 -1.156 1.00 0.43 H new ATOM 0 HD11 ILE B 379 -8.703 7.745 -0.778 1.00 0.44 H new ATOM 0 HD12 ILE B 379 -8.889 9.335 -1.554 1.00 0.44 H new ATOM 0 HD13 ILE B 379 -10.034 8.822 -0.292 1.00 0.44 H new ATOM 1706 N TYR B 380 -11.684 6.676 -5.689 1.00 0.45 N ATOM 1707 CA TYR B 380 -10.987 6.313 -6.918 1.00 0.42 C ATOM 1708 C TYR B 380 -11.526 7.135 -8.077 1.00 0.46 C ATOM 1709 O TYR B 380 -12.725 7.114 -8.360 1.00 0.58 O ATOM 1710 CB TYR B 380 -11.131 4.814 -7.222 1.00 0.48 C ATOM 1711 CG TYR B 380 -10.436 4.383 -8.501 1.00 0.45 C ATOM 1712 CD1 TYR B 380 -9.087 4.640 -8.700 1.00 0.49 C ATOM 1713 CD2 TYR B 380 -11.126 3.712 -9.507 1.00 0.54 C ATOM 1714 CE1 TYR B 380 -8.445 4.245 -9.857 1.00 0.51 C ATOM 1715 CE2 TYR B 380 -10.491 3.314 -10.668 1.00 0.54 C ATOM 1716 CZ TYR B 380 -9.173 3.602 -10.858 1.00 0.47 C ATOM 1717 OH TYR B 380 -8.507 3.185 -11.992 1.00 0.52 O ATOM 0 H TYR B 380 -12.375 5.994 -5.375 1.00 0.45 H new ATOM 0 HA TYR B 380 -9.927 6.526 -6.783 1.00 0.42 H new ATOM 0 HB2 TYR B 380 -10.725 4.242 -6.388 1.00 0.48 H new ATOM 0 HB3 TYR B 380 -12.190 4.566 -7.293 1.00 0.48 H new ATOM 0 HD1 TYR B 380 -8.528 5.159 -7.935 1.00 0.49 H new ATOM 0 HD2 TYR B 380 -12.177 3.499 -9.378 1.00 0.54 H new ATOM 0 HE1 TYR B 380 -7.389 4.432 -9.986 1.00 0.51 H new ATOM 0 HE2 TYR B 380 -11.040 2.774 -11.425 1.00 0.54 H new ATOM 0 HH TYR B 380 -9.140 2.752 -12.602 1.00 0.52 H new ATOM 1727 N TYR B 381 -10.648 7.876 -8.727 1.00 0.55 N ATOM 1728 CA TYR B 381 -11.029 8.703 -9.843 1.00 0.70 C ATOM 1729 C TYR B 381 -11.030 7.900 -11.138 1.00 0.79 C ATOM 1730 O TYR B 381 -10.033 7.964 -11.888 1.00 1.31 O ATOM 1731 CB TYR B 381 -10.074 9.889 -9.929 1.00 1.01 C ATOM 1732 CG TYR B 381 -10.524 11.090 -9.121 1.00 1.28 C ATOM 1733 CD1 TYR B 381 -10.913 10.954 -7.793 1.00 1.73 C ATOM 1734 CD2 TYR B 381 -10.571 12.354 -9.691 1.00 1.66 C ATOM 1735 CE1 TYR B 381 -11.333 12.045 -7.057 1.00 2.35 C ATOM 1736 CE2 TYR B 381 -10.993 13.449 -8.962 1.00 2.20 C ATOM 1737 CZ TYR B 381 -11.371 13.290 -7.646 1.00 2.50 C ATOM 1738 OH TYR B 381 -11.804 14.380 -6.921 1.00 3.20 O ATOM 1739 OXT TYR B 381 -12.033 7.198 -11.396 1.00 1.47 O ATOM 0 H TYR B 381 -9.656 7.918 -8.493 1.00 0.55 H new ATOM 0 HA TYR B 381 -12.044 9.072 -9.693 1.00 0.70 H new ATOM 0 HB2 TYR B 381 -9.089 9.577 -9.583 1.00 1.01 H new ATOM 0 HB3 TYR B 381 -9.967 10.183 -10.973 1.00 1.01 H new ATOM 0 HD1 TYR B 381 -10.886 9.979 -7.329 1.00 1.73 H new ATOM 0 HD2 TYR B 381 -10.273 12.484 -10.721 1.00 1.66 H new ATOM 0 HE1 TYR B 381 -11.630 11.923 -6.026 1.00 2.35 H new ATOM 0 HE2 TYR B 381 -11.027 14.426 -9.421 1.00 2.20 H new ATOM 0 HH TYR B 381 -11.768 15.182 -7.483 1.00 3.20 H new