USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 665 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 51 HIS : no HD1:sc= -0.16 K(o=0.32,f=-0.99) USER MOD Set 1.2: A 54 SER OG : rot 81:sc= 0.483 USER MOD Set 1.3: A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 61 LYS NZ :NH3+ 144:sc= 0.378 (180deg=1.04) USER MOD Set 2.2: A 62 ASN : amide:sc= -0.837! C(o=-0.46!,f=-7.8!) USER MOD Set 3.1: A 39 HIS : no HD1:sc= 0.482 K(o=1,f=-0.05) USER MOD Set 3.2: A 41 SER OG : rot -96:sc= 0.536 USER MOD Set 4.1: A 32 SER OG : rot 28:sc= 0.185 USER MOD Set 4.2: A 35 SER OG : rot 108:sc= 1.72 USER MOD Set 5.1: A 33 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 34 HIS : no HD1:sc= -0.106 X(o=-0.11,f=0.37) USER MOD Set 6.1: A 23 CYS SG : rot -180:sc= 2.76 USER MOD Set 6.2: A 26 CYS SG : rot 24:sc= -0.173 USER MOD Set 6.3: A 71 CYS SG : rot -147:sc= 0.867 USER MOD Set 6.4: A 74 CYS SG : rot -34:sc= 0.369! USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot -22:sc= 0.0891 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -179:sc= 1.86 (180deg=1.86) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 179:sc= 1.47 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0.583 USER MOD Single : A 56 THR OG1 : rot 180:sc=-0.00435 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 CYS SG : rot 180:sc= -0.455 USER MOD Single : A 68 LYS NZ :NH3+ -163:sc= 1.13 (180deg=0.869) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= -0.604 K(o=-0.6,f=-5.8!) USER MOD Single : A 80 HIS : no HE2:sc= -0.133 K(o=-0.13,f=-1.6) USER MOD Single : A 84 ASN : amide:sc= -0.0286 X(o=-0.029,f=-0.029) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0.104 K(o=0.1,f=-3.2!) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 CYS SG : rot 114:sc= 0.0337 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 170:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0431) USER MOD ----------------------------------------------------------------- ATOM 261 N PRO A 18 60.925 50.932 43.530 1.00 0.00 N ATOM 262 CA PRO A 18 60.740 49.538 43.943 1.00 0.00 C ATOM 263 C PRO A 18 61.210 49.215 45.376 1.00 0.00 C ATOM 264 O PRO A 18 61.730 50.054 46.115 1.00 0.00 O ATOM 265 CB PRO A 18 61.477 48.708 42.876 1.00 0.00 C ATOM 266 CG PRO A 18 62.561 49.656 42.373 1.00 0.00 C ATOM 267 CD PRO A 18 61.852 51.006 42.408 1.00 0.00 C ATOM 0 HA PRO A 18 59.677 49.301 43.996 1.00 0.00 H new ATOM 0 HB2 PRO A 18 61.904 47.799 43.299 1.00 0.00 H new ATOM 0 HB3 PRO A 18 60.807 48.402 42.072 1.00 0.00 H new ATOM 0 HG2 PRO A 18 63.443 49.643 43.014 1.00 0.00 H new ATOM 0 HG3 PRO A 18 62.894 49.397 41.368 1.00 0.00 H new ATOM 0 HD2 PRO A 18 62.565 51.820 42.541 1.00 0.00 H new ATOM 0 HD3 PRO A 18 61.323 51.195 41.474 1.00 0.00 H new ATOM 275 N GLY A 19 60.990 47.955 45.764 1.00 0.00 N ATOM 276 CA GLY A 19 61.614 47.325 46.930 1.00 0.00 C ATOM 277 C GLY A 19 63.113 47.052 46.751 1.00 0.00 C ATOM 278 O GLY A 19 63.685 47.355 45.703 1.00 0.00 O ATOM 0 H GLY A 19 60.358 47.330 45.263 1.00 0.00 H new ATOM 0 HA2 GLY A 19 61.471 47.967 47.799 1.00 0.00 H new ATOM 0 HA3 GLY A 19 61.104 46.385 47.141 1.00 0.00 H new ATOM 282 N VAL A 20 63.742 46.468 47.775 1.00 0.00 N ATOM 283 CA VAL A 20 65.209 46.328 47.866 1.00 0.00 C ATOM 284 C VAL A 20 65.605 44.875 48.167 1.00 0.00 C ATOM 285 O VAL A 20 64.785 44.064 48.586 1.00 0.00 O ATOM 286 CB VAL A 20 65.799 47.307 48.904 1.00 0.00 C ATOM 287 CG1 VAL A 20 67.285 47.635 48.673 1.00 0.00 C ATOM 288 CG2 VAL A 20 65.070 48.662 48.978 1.00 0.00 C ATOM 0 H VAL A 20 63.247 46.073 48.575 1.00 0.00 H new ATOM 0 HA VAL A 20 65.634 46.589 46.897 1.00 0.00 H new ATOM 0 HB VAL A 20 65.667 46.756 49.835 1.00 0.00 H new ATOM 0 HG11 VAL A 20 67.628 48.328 49.441 1.00 0.00 H new ATOM 0 HG12 VAL A 20 67.872 46.718 48.723 1.00 0.00 H new ATOM 0 HG13 VAL A 20 67.408 48.092 47.691 1.00 0.00 H new ATOM 0 HG21 VAL A 20 65.546 49.291 49.730 1.00 0.00 H new ATOM 0 HG22 VAL A 20 65.121 49.156 48.008 1.00 0.00 H new ATOM 0 HG23 VAL A 20 64.027 48.500 49.248 1.00 0.00 H new ATOM 298 N TYR A 21 66.878 44.545 47.979 1.00 0.00 N ATOM 299 CA TYR A 21 67.503 43.246 48.250 1.00 0.00 C ATOM 300 C TYR A 21 68.427 43.371 49.471 1.00 0.00 C ATOM 301 O TYR A 21 69.123 44.375 49.640 1.00 0.00 O ATOM 302 CB TYR A 21 68.211 42.781 46.951 1.00 0.00 C ATOM 303 CG TYR A 21 69.493 41.951 47.000 1.00 0.00 C ATOM 304 CD1 TYR A 21 69.657 40.876 47.891 1.00 0.00 C ATOM 305 CD2 TYR A 21 70.553 42.264 46.120 1.00 0.00 C ATOM 306 CE1 TYR A 21 70.908 40.244 48.012 1.00 0.00 C ATOM 307 CE2 TYR A 21 71.782 41.585 46.190 1.00 0.00 C ATOM 308 CZ TYR A 21 71.980 40.601 47.173 1.00 0.00 C ATOM 309 OH TYR A 21 73.184 39.982 47.290 1.00 0.00 O ATOM 0 H TYR A 21 67.549 45.219 47.609 1.00 0.00 H new ATOM 0 HA TYR A 21 66.775 42.478 48.512 1.00 0.00 H new ATOM 0 HB2 TYR A 21 67.482 42.206 46.380 1.00 0.00 H new ATOM 0 HB3 TYR A 21 68.434 43.677 46.372 1.00 0.00 H new ATOM 0 HD1 TYR A 21 68.821 40.535 48.484 1.00 0.00 H new ATOM 0 HD2 TYR A 21 70.417 43.039 45.380 1.00 0.00 H new ATOM 0 HE1 TYR A 21 71.047 39.475 48.758 1.00 0.00 H new ATOM 0 HE2 TYR A 21 72.571 41.819 45.491 1.00 0.00 H new ATOM 0 HH TYR A 21 73.808 40.352 46.631 1.00 0.00 H new ATOM 319 N VAL A 22 68.429 42.337 50.316 1.00 0.00 N ATOM 320 CA VAL A 22 69.518 42.077 51.273 1.00 0.00 C ATOM 321 C VAL A 22 69.953 40.619 51.194 1.00 0.00 C ATOM 322 O VAL A 22 69.153 39.728 50.888 1.00 0.00 O ATOM 323 CB VAL A 22 69.213 42.450 52.741 1.00 0.00 C ATOM 324 CG1 VAL A 22 68.456 43.770 52.888 1.00 0.00 C ATOM 325 CG2 VAL A 22 68.386 41.416 53.518 1.00 0.00 C ATOM 0 H VAL A 22 67.675 41.652 50.359 1.00 0.00 H new ATOM 0 HA VAL A 22 70.324 42.744 50.966 1.00 0.00 H new ATOM 0 HB VAL A 22 70.218 42.512 53.159 1.00 0.00 H new ATOM 0 HG11 VAL A 22 68.275 43.970 53.944 1.00 0.00 H new ATOM 0 HG12 VAL A 22 69.049 44.579 52.462 1.00 0.00 H new ATOM 0 HG13 VAL A 22 67.503 43.703 52.363 1.00 0.00 H new ATOM 0 HG21 VAL A 22 68.226 41.769 54.537 1.00 0.00 H new ATOM 0 HG22 VAL A 22 67.423 41.276 53.026 1.00 0.00 H new ATOM 0 HG23 VAL A 22 68.921 40.467 53.543 1.00 0.00 H new ATOM 335 N CYS A 23 71.216 40.360 51.509 1.00 0.00 N ATOM 336 CA CYS A 23 71.752 39.010 51.466 1.00 0.00 C ATOM 337 C CYS A 23 71.236 38.153 52.638 1.00 0.00 C ATOM 338 O CYS A 23 70.935 38.666 53.718 1.00 0.00 O ATOM 339 CB CYS A 23 73.270 39.122 51.355 1.00 0.00 C ATOM 340 SG CYS A 23 73.973 37.485 51.048 1.00 0.00 S ATOM 0 H CYS A 23 71.888 41.071 51.798 1.00 0.00 H new ATOM 0 HA CYS A 23 71.397 38.466 50.591 1.00 0.00 H new ATOM 0 HB2 CYS A 23 73.537 39.802 50.546 1.00 0.00 H new ATOM 0 HB3 CYS A 23 73.683 39.541 52.273 1.00 0.00 H new ATOM 0 HG CYS A 23 75.267 37.578 50.959 1.00 0.00 H new ATOM 345 N ALA A 24 71.187 36.835 52.450 1.00 0.00 N ATOM 346 CA ALA A 24 70.893 35.938 53.562 1.00 0.00 C ATOM 347 C ALA A 24 72.121 35.755 54.479 1.00 0.00 C ATOM 348 O ALA A 24 71.981 35.326 55.625 1.00 0.00 O ATOM 349 CB ALA A 24 70.361 34.587 53.087 1.00 0.00 C ATOM 0 H ALA A 24 71.344 36.373 51.555 1.00 0.00 H new ATOM 0 HA ALA A 24 70.103 36.410 54.146 1.00 0.00 H new ATOM 0 HB1 ALA A 24 70.156 33.953 53.950 1.00 0.00 H new ATOM 0 HB2 ALA A 24 69.442 34.737 52.520 1.00 0.00 H new ATOM 0 HB3 ALA A 24 71.105 34.106 52.452 1.00 0.00 H new ATOM 355 N LYS A 25 73.326 36.055 53.969 1.00 0.00 N ATOM 356 CA LYS A 25 74.617 35.746 54.597 1.00 0.00 C ATOM 357 C LYS A 25 75.547 36.938 54.782 1.00 0.00 C ATOM 358 O LYS A 25 76.174 37.076 55.836 1.00 0.00 O ATOM 359 CB LYS A 25 75.292 34.640 53.785 1.00 0.00 C ATOM 360 CG LYS A 25 74.986 33.252 54.363 1.00 0.00 C ATOM 361 CD LYS A 25 75.675 32.957 55.704 1.00 0.00 C ATOM 362 CE LYS A 25 77.105 32.419 55.557 1.00 0.00 C ATOM 363 NZ LYS A 25 77.111 30.975 55.221 1.00 0.00 N ATOM 0 H LYS A 25 73.430 36.537 53.076 1.00 0.00 H new ATOM 0 HA LYS A 25 74.407 35.418 55.615 1.00 0.00 H new ATOM 0 HB2 LYS A 25 74.952 34.688 52.750 1.00 0.00 H new ATOM 0 HB3 LYS A 25 76.370 34.801 53.774 1.00 0.00 H new ATOM 0 HG2 LYS A 25 73.908 33.156 54.493 1.00 0.00 H new ATOM 0 HG3 LYS A 25 75.288 32.496 53.639 1.00 0.00 H new ATOM 0 HD2 LYS A 25 75.699 33.870 56.299 1.00 0.00 H new ATOM 0 HD3 LYS A 25 75.078 32.232 56.257 1.00 0.00 H new ATOM 0 HE2 LYS A 25 77.626 32.977 54.779 1.00 0.00 H new ATOM 0 HE3 LYS A 25 77.652 32.580 56.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 78.093 30.644 55.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 76.635 30.441 55.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 76.610 30.826 54.322 1.00 0.00 H new ATOM 377 N CYS A 26 75.579 37.843 53.818 1.00 0.00 N ATOM 378 CA CYS A 26 76.180 39.154 53.963 1.00 0.00 C ATOM 379 C CYS A 26 75.281 40.037 54.865 1.00 0.00 C ATOM 380 O CYS A 26 75.793 40.836 55.648 1.00 0.00 O ATOM 381 CB CYS A 26 76.452 39.751 52.569 1.00 0.00 C ATOM 382 SG CYS A 26 77.144 38.585 51.384 1.00 0.00 S ATOM 0 H CYS A 26 75.179 37.681 52.894 1.00 0.00 H new ATOM 0 HA CYS A 26 77.147 39.092 54.463 1.00 0.00 H new ATOM 0 HB2 CYS A 26 75.519 40.147 52.168 1.00 0.00 H new ATOM 0 HB3 CYS A 26 77.137 40.593 52.675 1.00 0.00 H new ATOM 0 HG CYS A 26 76.837 37.372 51.738 1.00 0.00 H new ATOM 387 N SER A 27 73.952 39.861 54.763 1.00 0.00 N ATOM 388 CA SER A 27 72.874 40.668 55.386 1.00 0.00 C ATOM 389 C SER A 27 72.972 42.183 55.177 1.00 0.00 C ATOM 390 O SER A 27 72.242 42.964 55.792 1.00 0.00 O ATOM 391 CB SER A 27 72.527 40.235 56.817 1.00 0.00 C ATOM 392 OG SER A 27 73.493 40.584 57.796 1.00 0.00 O ATOM 0 H SER A 27 73.570 39.098 54.204 1.00 0.00 H new ATOM 0 HA SER A 27 71.992 40.414 54.798 1.00 0.00 H new ATOM 0 HB2 SER A 27 71.572 40.681 57.095 1.00 0.00 H new ATOM 0 HB3 SER A 27 72.390 39.154 56.831 1.00 0.00 H new ATOM 0 HG SER A 27 74.361 40.726 57.363 1.00 0.00 H new ATOM 398 N TYR A 28 73.841 42.562 54.238 1.00 0.00 N ATOM 399 CA TYR A 28 74.078 43.906 53.742 1.00 0.00 C ATOM 400 C TYR A 28 73.081 44.250 52.628 1.00 0.00 C ATOM 401 O TYR A 28 72.658 43.369 51.874 1.00 0.00 O ATOM 402 CB TYR A 28 75.536 43.999 53.298 1.00 0.00 C ATOM 403 CG TYR A 28 76.139 45.372 53.042 1.00 0.00 C ATOM 404 CD1 TYR A 28 75.915 46.444 53.934 1.00 0.00 C ATOM 405 CD2 TYR A 28 77.039 45.537 51.969 1.00 0.00 C ATOM 406 CE1 TYR A 28 76.608 47.659 53.766 1.00 0.00 C ATOM 407 CE2 TYR A 28 77.742 46.748 51.804 1.00 0.00 C ATOM 408 CZ TYR A 28 77.542 47.803 52.720 1.00 0.00 C ATOM 409 OH TYR A 28 78.286 48.934 52.632 1.00 0.00 O ATOM 0 H TYR A 28 74.440 41.880 53.773 1.00 0.00 H new ATOM 0 HA TYR A 28 73.914 44.647 54.524 1.00 0.00 H new ATOM 0 HB2 TYR A 28 76.144 43.508 54.058 1.00 0.00 H new ATOM 0 HB3 TYR A 28 75.640 43.417 52.382 1.00 0.00 H new ATOM 0 HD1 TYR A 28 75.212 46.332 54.746 1.00 0.00 H new ATOM 0 HD2 TYR A 28 77.191 44.729 51.268 1.00 0.00 H new ATOM 0 HE1 TYR A 28 76.423 48.482 54.440 1.00 0.00 H new ATOM 0 HE2 TYR A 28 78.430 46.868 50.980 1.00 0.00 H new ATOM 0 HH TYR A 28 78.882 48.874 51.856 1.00 0.00 H new ATOM 419 N GLU A 29 72.662 45.510 52.556 1.00 0.00 N ATOM 420 CA GLU A 29 71.484 45.928 51.796 1.00 0.00 C ATOM 421 C GLU A 29 71.860 46.696 50.523 1.00 0.00 C ATOM 422 O GLU A 29 72.505 47.746 50.585 1.00 0.00 O ATOM 423 CB GLU A 29 70.550 46.767 52.689 1.00 0.00 C ATOM 424 CG GLU A 29 70.407 46.271 54.142 1.00 0.00 C ATOM 425 CD GLU A 29 71.341 47.061 55.071 1.00 0.00 C ATOM 426 OE1 GLU A 29 72.581 46.954 54.958 1.00 0.00 O ATOM 427 OE2 GLU A 29 70.853 47.933 55.835 1.00 0.00 O ATOM 0 H GLU A 29 73.135 46.280 53.029 1.00 0.00 H new ATOM 0 HA GLU A 29 70.958 45.028 51.477 1.00 0.00 H new ATOM 0 HB2 GLU A 29 70.917 47.793 52.707 1.00 0.00 H new ATOM 0 HB3 GLU A 29 69.561 46.790 52.231 1.00 0.00 H new ATOM 0 HG2 GLU A 29 69.374 46.384 54.472 1.00 0.00 H new ATOM 0 HG3 GLU A 29 70.644 45.208 54.195 1.00 0.00 H new ATOM 434 N LEU A 30 71.459 46.187 49.356 1.00 0.00 N ATOM 435 CA LEU A 30 71.705 46.831 48.068 1.00 0.00 C ATOM 436 C LEU A 30 70.750 46.336 46.968 1.00 0.00 C ATOM 437 O LEU A 30 70.468 45.162 46.794 1.00 0.00 O ATOM 438 CB LEU A 30 73.194 46.728 47.661 1.00 0.00 C ATOM 439 CG LEU A 30 73.930 45.414 47.984 1.00 0.00 C ATOM 440 CD1 LEU A 30 73.268 44.219 47.317 1.00 0.00 C ATOM 441 CD2 LEU A 30 75.375 45.504 47.489 1.00 0.00 C ATOM 0 H LEU A 30 70.949 45.307 49.280 1.00 0.00 H new ATOM 0 HA LEU A 30 71.483 47.891 48.191 1.00 0.00 H new ATOM 0 HB2 LEU A 30 73.261 46.896 46.586 1.00 0.00 H new ATOM 0 HB3 LEU A 30 73.732 47.543 48.145 1.00 0.00 H new ATOM 0 HG LEU A 30 73.895 45.274 49.064 1.00 0.00 H new ATOM 0 HD11 LEU A 30 73.817 43.311 47.569 1.00 0.00 H new ATOM 0 HD12 LEU A 30 72.240 44.130 47.667 1.00 0.00 H new ATOM 0 HD13 LEU A 30 73.273 44.357 46.236 1.00 0.00 H new ATOM 0 HD21 LEU A 30 75.896 44.574 47.717 1.00 0.00 H new ATOM 0 HD22 LEU A 30 75.381 45.668 46.411 1.00 0.00 H new ATOM 0 HD23 LEU A 30 75.879 46.334 47.985 1.00 0.00 H new ATOM 453 N PHE A 31 70.244 47.296 46.216 1.00 0.00 N ATOM 454 CA PHE A 31 69.501 47.173 44.956 1.00 0.00 C ATOM 455 C PHE A 31 69.359 48.567 44.336 1.00 0.00 C ATOM 456 O PHE A 31 68.852 49.472 45.002 1.00 0.00 O ATOM 457 CB PHE A 31 68.101 46.575 45.196 1.00 0.00 C ATOM 458 CG PHE A 31 67.575 45.766 44.032 1.00 0.00 C ATOM 459 CD1 PHE A 31 68.235 44.581 43.657 1.00 0.00 C ATOM 460 CD2 PHE A 31 66.431 46.177 43.325 1.00 0.00 C ATOM 461 CE1 PHE A 31 67.762 43.809 42.583 1.00 0.00 C ATOM 462 CE2 PHE A 31 65.962 45.412 42.243 1.00 0.00 C ATOM 463 CZ PHE A 31 66.623 44.225 41.878 1.00 0.00 C ATOM 0 H PHE A 31 70.347 48.274 46.488 1.00 0.00 H new ATOM 0 HA PHE A 31 70.045 46.507 44.286 1.00 0.00 H new ATOM 0 HB2 PHE A 31 68.134 45.941 46.082 1.00 0.00 H new ATOM 0 HB3 PHE A 31 67.402 47.384 45.409 1.00 0.00 H new ATOM 0 HD1 PHE A 31 69.113 44.262 44.200 1.00 0.00 H new ATOM 0 HD2 PHE A 31 65.913 47.080 43.613 1.00 0.00 H new ATOM 0 HE1 PHE A 31 68.273 42.900 42.302 1.00 0.00 H new ATOM 0 HE2 PHE A 31 65.092 45.736 41.691 1.00 0.00 H new ATOM 0 HZ PHE A 31 66.253 43.633 41.054 1.00 0.00 H new ATOM 473 N SER A 32 69.772 48.780 43.087 1.00 0.00 N ATOM 474 CA SER A 32 69.335 49.928 42.324 1.00 0.00 C ATOM 475 C SER A 32 67.871 49.757 41.906 1.00 0.00 C ATOM 476 O SER A 32 67.371 48.646 41.732 1.00 0.00 O ATOM 477 CB SER A 32 70.266 50.094 41.120 1.00 0.00 C ATOM 478 OG SER A 32 70.618 48.871 40.503 1.00 0.00 O ATOM 0 H SER A 32 70.413 48.163 42.588 1.00 0.00 H new ATOM 0 HA SER A 32 69.386 50.834 42.928 1.00 0.00 H new ATOM 0 HB2 SER A 32 69.783 50.737 40.384 1.00 0.00 H new ATOM 0 HB3 SER A 32 71.174 50.604 41.441 1.00 0.00 H new ATOM 0 HG SER A 32 69.906 48.214 40.650 1.00 0.00 H new ATOM 484 N SER A 33 67.165 50.853 41.638 1.00 0.00 N ATOM 485 CA SER A 33 65.844 50.798 40.988 1.00 0.00 C ATOM 486 C SER A 33 65.894 50.267 39.541 1.00 0.00 C ATOM 487 O SER A 33 64.868 50.208 38.860 1.00 0.00 O ATOM 488 CB SER A 33 65.172 52.171 41.062 1.00 0.00 C ATOM 489 OG SER A 33 65.967 53.129 40.401 1.00 0.00 O ATOM 0 H SER A 33 67.482 51.797 41.859 1.00 0.00 H new ATOM 0 HA SER A 33 65.243 50.074 41.538 1.00 0.00 H new ATOM 0 HB2 SER A 33 64.184 52.127 40.604 1.00 0.00 H new ATOM 0 HB3 SER A 33 65.029 52.460 42.103 1.00 0.00 H new ATOM 0 HG SER A 33 65.531 54.006 40.450 1.00 0.00 H new ATOM 495 N HIS A 34 67.086 49.890 39.060 1.00 0.00 N ATOM 496 CA HIS A 34 67.398 49.512 37.683 1.00 0.00 C ATOM 497 C HIS A 34 67.682 48.015 37.473 1.00 0.00 C ATOM 498 O HIS A 34 67.623 47.535 36.345 1.00 0.00 O ATOM 499 CB HIS A 34 68.611 50.339 37.217 1.00 0.00 C ATOM 500 CG HIS A 34 68.595 51.832 37.501 1.00 0.00 C ATOM 501 ND1 HIS A 34 69.713 52.628 37.620 1.00 0.00 N ATOM 502 CD2 HIS A 34 67.511 52.654 37.679 1.00 0.00 C ATOM 503 CE1 HIS A 34 69.317 53.889 37.860 1.00 0.00 C ATOM 504 NE2 HIS A 34 67.974 53.955 37.934 1.00 0.00 N ATOM 0 H HIS A 34 67.907 49.839 39.663 1.00 0.00 H new ATOM 0 HA HIS A 34 66.506 49.721 37.092 1.00 0.00 H new ATOM 0 HB2 HIS A 34 69.503 49.918 37.681 1.00 0.00 H new ATOM 0 HB3 HIS A 34 68.717 50.203 36.141 1.00 0.00 H new ATOM 0 HD2 HIS A 34 66.475 52.351 37.631 1.00 0.00 H new ATOM 0 HE1 HIS A 34 69.982 54.732 37.977 1.00 0.00 H new ATOM 0 HE2 HIS A 34 67.409 54.780 38.134 1.00 0.00 H new ATOM 512 N SER A 35 67.991 47.261 38.532 1.00 0.00 N ATOM 513 CA SER A 35 68.593 45.931 38.461 1.00 0.00 C ATOM 514 C SER A 35 67.607 44.822 38.081 1.00 0.00 C ATOM 515 O SER A 35 67.995 43.721 37.691 1.00 0.00 O ATOM 516 CB SER A 35 69.345 45.600 39.757 1.00 0.00 C ATOM 517 OG SER A 35 68.879 46.290 40.901 1.00 0.00 O ATOM 0 H SER A 35 67.823 47.570 39.489 1.00 0.00 H new ATOM 0 HA SER A 35 69.311 45.969 37.642 1.00 0.00 H new ATOM 0 HB2 SER A 35 69.272 44.528 39.940 1.00 0.00 H new ATOM 0 HB3 SER A 35 70.402 45.828 39.617 1.00 0.00 H new ATOM 0 HG SER A 35 68.394 45.668 41.483 1.00 0.00 H new ATOM 523 N LYS A 36 66.313 45.136 38.169 1.00 0.00 N ATOM 524 CA LYS A 36 65.222 44.327 37.593 1.00 0.00 C ATOM 525 C LYS A 36 64.205 45.191 36.856 1.00 0.00 C ATOM 526 O LYS A 36 63.857 46.279 37.317 1.00 0.00 O ATOM 527 CB LYS A 36 64.580 43.425 38.661 1.00 0.00 C ATOM 528 CG LYS A 36 63.699 44.157 39.695 1.00 0.00 C ATOM 529 CD LYS A 36 62.187 43.967 39.470 1.00 0.00 C ATOM 530 CE LYS A 36 61.389 45.251 39.734 1.00 0.00 C ATOM 531 NZ LYS A 36 61.343 46.113 38.530 1.00 0.00 N ATOM 0 H LYS A 36 65.982 45.973 38.649 1.00 0.00 H new ATOM 0 HA LYS A 36 65.653 43.666 36.841 1.00 0.00 H new ATOM 0 HB2 LYS A 36 63.974 42.671 38.160 1.00 0.00 H new ATOM 0 HB3 LYS A 36 65.372 42.897 39.191 1.00 0.00 H new ATOM 0 HG2 LYS A 36 63.956 43.802 40.693 1.00 0.00 H new ATOM 0 HG3 LYS A 36 63.930 45.222 39.666 1.00 0.00 H new ATOM 0 HD2 LYS A 36 62.014 43.639 38.445 1.00 0.00 H new ATOM 0 HD3 LYS A 36 61.822 43.175 40.124 1.00 0.00 H new ATOM 0 HE2 LYS A 36 60.375 44.995 40.040 1.00 0.00 H new ATOM 0 HE3 LYS A 36 61.842 45.800 40.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 60.811 46.981 38.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 62.311 46.362 38.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 60.874 45.602 37.755 1.00 0.00 H new ATOM 545 N TYR A 37 63.658 44.674 35.761 1.00 0.00 N ATOM 546 CA TYR A 37 62.722 45.379 34.888 1.00 0.00 C ATOM 547 C TYR A 37 61.264 45.071 35.249 1.00 0.00 C ATOM 548 O TYR A 37 60.973 44.411 36.248 1.00 0.00 O ATOM 549 CB TYR A 37 63.087 45.043 33.433 1.00 0.00 C ATOM 550 CG TYR A 37 64.547 45.278 33.060 1.00 0.00 C ATOM 551 CD1 TYR A 37 65.224 46.436 33.503 1.00 0.00 C ATOM 552 CD2 TYR A 37 65.223 44.351 32.238 1.00 0.00 C ATOM 553 CE1 TYR A 37 66.564 46.660 33.139 1.00 0.00 C ATOM 554 CE2 TYR A 37 66.555 44.592 31.846 1.00 0.00 C ATOM 555 CZ TYR A 37 67.228 45.745 32.301 1.00 0.00 C ATOM 556 OH TYR A 37 68.496 45.995 31.890 1.00 0.00 O ATOM 0 H TYR A 37 63.859 43.725 35.446 1.00 0.00 H new ATOM 0 HA TYR A 37 62.809 46.457 35.024 1.00 0.00 H new ATOM 0 HB2 TYR A 37 62.845 43.997 33.247 1.00 0.00 H new ATOM 0 HB3 TYR A 37 62.459 45.639 32.771 1.00 0.00 H new ATOM 0 HD1 TYR A 37 64.710 47.154 34.125 1.00 0.00 H new ATOM 0 HD2 TYR A 37 64.718 43.455 31.909 1.00 0.00 H new ATOM 0 HE1 TYR A 37 67.083 47.534 33.503 1.00 0.00 H new ATOM 0 HE2 TYR A 37 67.061 43.893 31.196 1.00 0.00 H new ATOM 0 HH TYR A 37 68.805 45.262 31.318 1.00 0.00 H new ATOM 566 N ALA A 38 60.337 45.616 34.477 1.00 0.00 N ATOM 567 CA ALA A 38 58.915 45.286 34.548 1.00 0.00 C ATOM 568 C ALA A 38 58.647 43.901 33.925 1.00 0.00 C ATOM 569 O ALA A 38 58.937 43.681 32.748 1.00 0.00 O ATOM 570 CB ALA A 38 58.120 46.396 33.847 1.00 0.00 C ATOM 0 H ALA A 38 60.553 46.316 33.767 1.00 0.00 H new ATOM 0 HA ALA A 38 58.593 45.228 35.588 1.00 0.00 H new ATOM 0 HB1 ALA A 38 57.056 46.165 33.891 1.00 0.00 H new ATOM 0 HB2 ALA A 38 58.306 47.347 34.346 1.00 0.00 H new ATOM 0 HB3 ALA A 38 58.433 46.466 32.805 1.00 0.00 H new ATOM 576 N HIS A 39 58.081 42.967 34.693 1.00 0.00 N ATOM 577 CA HIS A 39 57.739 41.625 34.224 1.00 0.00 C ATOM 578 C HIS A 39 56.583 41.011 35.024 1.00 0.00 C ATOM 579 O HIS A 39 56.625 41.004 36.258 1.00 0.00 O ATOM 580 CB HIS A 39 58.975 40.707 34.293 1.00 0.00 C ATOM 581 CG HIS A 39 58.954 39.625 33.244 1.00 0.00 C ATOM 582 ND1 HIS A 39 58.488 38.331 33.364 1.00 0.00 N ATOM 583 CD2 HIS A 39 59.410 39.769 31.962 1.00 0.00 C ATOM 584 CE1 HIS A 39 58.665 37.716 32.182 1.00 0.00 C ATOM 585 NE2 HIS A 39 59.209 38.559 31.289 1.00 0.00 N ATOM 0 H HIS A 39 57.845 43.126 35.672 1.00 0.00 H new ATOM 0 HA HIS A 39 57.410 41.716 33.189 1.00 0.00 H new ATOM 0 HB2 HIS A 39 59.876 41.308 34.172 1.00 0.00 H new ATOM 0 HB3 HIS A 39 59.028 40.249 35.281 1.00 0.00 H new ATOM 0 HD2 HIS A 39 59.849 40.662 31.542 1.00 0.00 H new ATOM 0 HE1 HIS A 39 58.406 36.687 31.979 1.00 0.00 H new ATOM 0 HE2 HIS A 39 59.431 38.357 30.314 1.00 0.00 H new ATOM 593 N SER A 40 55.600 40.426 34.334 1.00 0.00 N ATOM 594 CA SER A 40 54.621 39.513 34.909 1.00 0.00 C ATOM 595 C SER A 40 54.664 38.168 34.179 1.00 0.00 C ATOM 596 O SER A 40 54.519 38.089 32.956 1.00 0.00 O ATOM 597 CB SER A 40 53.215 40.108 34.963 1.00 0.00 C ATOM 598 OG SER A 40 52.645 39.856 36.240 1.00 0.00 O ATOM 0 H SER A 40 55.464 40.581 33.335 1.00 0.00 H new ATOM 0 HA SER A 40 54.895 39.342 35.950 1.00 0.00 H new ATOM 0 HB2 SER A 40 53.255 41.181 34.776 1.00 0.00 H new ATOM 0 HB3 SER A 40 52.593 39.671 34.182 1.00 0.00 H new ATOM 0 HG SER A 40 51.744 40.239 36.277 1.00 0.00 H new ATOM 604 N SER A 41 54.940 37.119 34.950 1.00 0.00 N ATOM 605 CA SER A 41 54.976 35.711 34.543 1.00 0.00 C ATOM 606 C SER A 41 54.958 34.801 35.785 1.00 0.00 C ATOM 607 O SER A 41 55.373 35.247 36.858 1.00 0.00 O ATOM 608 CB SER A 41 56.253 35.421 33.732 1.00 0.00 C ATOM 609 OG SER A 41 57.430 35.646 34.495 1.00 0.00 O ATOM 0 H SER A 41 55.159 37.234 35.940 1.00 0.00 H new ATOM 0 HA SER A 41 54.100 35.511 33.927 1.00 0.00 H new ATOM 0 HB2 SER A 41 56.237 34.387 33.387 1.00 0.00 H new ATOM 0 HB3 SER A 41 56.270 36.053 32.844 1.00 0.00 H new ATOM 0 HG SER A 41 57.770 36.547 34.314 1.00 0.00 H new ATOM 615 N PRO A 42 54.570 33.516 35.673 1.00 0.00 N ATOM 616 CA PRO A 42 54.981 32.498 36.642 1.00 0.00 C ATOM 617 C PRO A 42 56.516 32.413 36.689 1.00 0.00 C ATOM 618 O PRO A 42 57.175 32.608 35.663 1.00 0.00 O ATOM 619 CB PRO A 42 54.353 31.188 36.151 1.00 0.00 C ATOM 620 CG PRO A 42 54.266 31.400 34.639 1.00 0.00 C ATOM 621 CD PRO A 42 53.939 32.885 34.524 1.00 0.00 C ATOM 0 HA PRO A 42 54.653 32.726 37.656 1.00 0.00 H new ATOM 0 HB2 PRO A 42 54.969 30.325 36.404 1.00 0.00 H new ATOM 0 HB3 PRO A 42 53.371 31.020 36.593 1.00 0.00 H new ATOM 0 HG2 PRO A 42 55.204 31.153 34.141 1.00 0.00 H new ATOM 0 HG3 PRO A 42 53.492 30.779 34.187 1.00 0.00 H new ATOM 0 HD2 PRO A 42 54.321 33.299 33.591 1.00 0.00 H new ATOM 0 HD3 PRO A 42 52.862 33.050 34.529 1.00 0.00 H new ATOM 629 N TRP A 43 57.085 32.140 37.867 1.00 0.00 N ATOM 630 CA TRP A 43 58.536 32.057 38.113 1.00 0.00 C ATOM 631 C TRP A 43 59.344 33.197 37.451 1.00 0.00 C ATOM 632 O TRP A 43 60.132 32.952 36.530 1.00 0.00 O ATOM 633 CB TRP A 43 59.033 30.644 37.774 1.00 0.00 C ATOM 634 CG TRP A 43 58.184 29.546 38.344 1.00 0.00 C ATOM 635 CD1 TRP A 43 57.635 28.544 37.624 1.00 0.00 C ATOM 636 CD2 TRP A 43 57.702 29.359 39.715 1.00 0.00 C ATOM 637 NE1 TRP A 43 56.846 27.762 38.441 1.00 0.00 N ATOM 638 CE2 TRP A 43 56.826 28.233 39.734 1.00 0.00 C ATOM 639 CE3 TRP A 43 57.886 30.041 40.938 1.00 0.00 C ATOM 640 CZ2 TRP A 43 56.155 27.817 40.893 1.00 0.00 C ATOM 641 CZ3 TRP A 43 57.234 29.618 42.115 1.00 0.00 C ATOM 642 CH2 TRP A 43 56.366 28.514 42.094 1.00 0.00 C ATOM 0 H TRP A 43 56.533 31.964 38.707 1.00 0.00 H new ATOM 0 HA TRP A 43 58.716 32.222 39.175 1.00 0.00 H new ATOM 0 HB2 TRP A 43 59.072 30.534 36.690 1.00 0.00 H new ATOM 0 HB3 TRP A 43 60.052 30.530 38.143 1.00 0.00 H new ATOM 0 HD1 TRP A 43 57.790 28.380 36.568 1.00 0.00 H new ATOM 0 HE1 TRP A 43 56.339 26.935 38.125 1.00 0.00 H new ATOM 0 HE3 TRP A 43 58.537 30.902 40.973 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 55.484 26.971 40.862 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 57.404 30.148 43.041 1.00 0.00 H new ATOM 0 HH2 TRP A 43 55.863 28.202 42.997 1.00 0.00 H new ATOM 653 N PRO A 44 59.125 34.459 37.874 1.00 0.00 N ATOM 654 CA PRO A 44 59.847 35.615 37.351 1.00 0.00 C ATOM 655 C PRO A 44 61.325 35.604 37.778 1.00 0.00 C ATOM 656 O PRO A 44 61.731 34.856 38.673 1.00 0.00 O ATOM 657 CB PRO A 44 59.089 36.835 37.884 1.00 0.00 C ATOM 658 CG PRO A 44 58.559 36.342 39.230 1.00 0.00 C ATOM 659 CD PRO A 44 58.228 34.877 38.947 1.00 0.00 C ATOM 0 HA PRO A 44 59.879 35.618 36.261 1.00 0.00 H new ATOM 0 HB2 PRO A 44 59.743 37.699 37.999 1.00 0.00 H new ATOM 0 HB3 PRO A 44 58.281 37.133 37.216 1.00 0.00 H new ATOM 0 HG2 PRO A 44 59.304 36.443 40.020 1.00 0.00 H new ATOM 0 HG3 PRO A 44 57.679 36.901 39.548 1.00 0.00 H new ATOM 0 HD2 PRO A 44 58.374 34.265 39.837 1.00 0.00 H new ATOM 0 HD3 PRO A 44 57.185 34.763 38.650 1.00 0.00 H new ATOM 667 N ALA A 45 62.120 36.452 37.126 1.00 0.00 N ATOM 668 CA ALA A 45 63.571 36.543 37.267 1.00 0.00 C ATOM 669 C ALA A 45 64.046 38.009 37.214 1.00 0.00 C ATOM 670 O ALA A 45 63.295 38.899 36.808 1.00 0.00 O ATOM 671 CB ALA A 45 64.190 35.711 36.136 1.00 0.00 C ATOM 0 H ALA A 45 61.752 37.125 36.454 1.00 0.00 H new ATOM 0 HA ALA A 45 63.886 36.156 38.236 1.00 0.00 H new ATOM 0 HB1 ALA A 45 65.277 35.753 36.206 1.00 0.00 H new ATOM 0 HB2 ALA A 45 63.861 34.676 36.224 1.00 0.00 H new ATOM 0 HB3 ALA A 45 63.873 36.112 35.174 1.00 0.00 H new ATOM 677 N PHE A 46 65.297 38.249 37.598 1.00 0.00 N ATOM 678 CA PHE A 46 66.021 39.502 37.340 1.00 0.00 C ATOM 679 C PHE A 46 66.948 39.317 36.125 1.00 0.00 C ATOM 680 O PHE A 46 67.081 38.216 35.585 1.00 0.00 O ATOM 681 CB PHE A 46 66.798 39.921 38.603 1.00 0.00 C ATOM 682 CG PHE A 46 66.014 40.203 39.883 1.00 0.00 C ATOM 683 CD1 PHE A 46 64.609 40.349 39.903 1.00 0.00 C ATOM 684 CD2 PHE A 46 66.735 40.380 41.079 1.00 0.00 C ATOM 685 CE1 PHE A 46 63.941 40.656 41.103 1.00 0.00 C ATOM 686 CE2 PHE A 46 66.069 40.690 42.279 1.00 0.00 C ATOM 687 CZ PHE A 46 64.671 40.830 42.291 1.00 0.00 C ATOM 0 H PHE A 46 65.854 37.564 38.110 1.00 0.00 H new ATOM 0 HA PHE A 46 65.320 40.303 37.105 1.00 0.00 H new ATOM 0 HB2 PHE A 46 67.520 39.135 38.823 1.00 0.00 H new ATOM 0 HB3 PHE A 46 67.367 40.818 38.359 1.00 0.00 H new ATOM 0 HD1 PHE A 46 64.044 40.224 38.991 1.00 0.00 H new ATOM 0 HD2 PHE A 46 67.810 40.277 41.075 1.00 0.00 H new ATOM 0 HE1 PHE A 46 62.866 40.758 41.111 1.00 0.00 H new ATOM 0 HE2 PHE A 46 66.632 40.820 43.191 1.00 0.00 H new ATOM 0 HZ PHE A 46 64.159 41.071 43.211 1.00 0.00 H new ATOM 697 N THR A 47 67.566 40.409 35.689 1.00 0.00 N ATOM 698 CA THR A 47 68.423 40.501 34.492 1.00 0.00 C ATOM 699 C THR A 47 69.828 40.982 34.836 1.00 0.00 C ATOM 700 O THR A 47 70.824 40.449 34.348 1.00 0.00 O ATOM 701 CB THR A 47 67.818 41.505 33.498 1.00 0.00 C ATOM 702 OG1 THR A 47 67.194 42.590 34.171 1.00 0.00 O ATOM 703 CG2 THR A 47 66.748 40.858 32.626 1.00 0.00 C ATOM 0 H THR A 47 67.485 41.301 36.177 1.00 0.00 H new ATOM 0 HA THR A 47 68.481 39.501 34.061 1.00 0.00 H new ATOM 0 HB THR A 47 68.650 41.855 32.887 1.00 0.00 H new ATOM 0 HG1 THR A 47 66.839 43.223 33.512 1.00 0.00 H new ATOM 0 HG21 THR A 47 66.344 41.599 31.936 1.00 0.00 H new ATOM 0 HG22 THR A 47 67.188 40.037 32.060 1.00 0.00 H new ATOM 0 HG23 THR A 47 65.946 40.475 33.258 1.00 0.00 H new ATOM 711 N GLU A 48 69.907 41.996 35.694 1.00 0.00 N ATOM 712 CA GLU A 48 71.110 42.714 36.041 1.00 0.00 C ATOM 713 C GLU A 48 71.414 42.605 37.545 1.00 0.00 C ATOM 714 O GLU A 48 70.705 41.995 38.346 1.00 0.00 O ATOM 715 CB GLU A 48 70.902 44.185 35.641 1.00 0.00 C ATOM 716 CG GLU A 48 70.561 44.474 34.188 1.00 0.00 C ATOM 717 CD GLU A 48 71.649 43.991 33.231 1.00 0.00 C ATOM 718 OE1 GLU A 48 72.731 44.621 33.199 1.00 0.00 O ATOM 719 OE2 GLU A 48 71.470 42.962 32.544 1.00 0.00 O ATOM 0 H GLU A 48 69.086 42.350 36.186 1.00 0.00 H new ATOM 0 HA GLU A 48 71.962 42.285 35.513 1.00 0.00 H new ATOM 0 HB2 GLU A 48 70.104 44.593 36.262 1.00 0.00 H new ATOM 0 HB3 GLU A 48 71.811 44.733 35.889 1.00 0.00 H new ATOM 0 HG2 GLU A 48 69.617 43.991 33.935 1.00 0.00 H new ATOM 0 HG3 GLU A 48 70.415 45.546 34.058 1.00 0.00 H new ATOM 726 N THR A 49 72.502 43.254 37.928 1.00 0.00 N ATOM 727 CA THR A 49 72.947 43.435 39.315 1.00 0.00 C ATOM 728 C THR A 49 73.695 44.749 39.456 1.00 0.00 C ATOM 729 O THR A 49 74.317 45.238 38.518 1.00 0.00 O ATOM 730 CB THR A 49 73.769 42.244 39.858 1.00 0.00 C ATOM 731 OG1 THR A 49 74.652 42.596 40.902 1.00 0.00 O ATOM 732 CG2 THR A 49 74.588 41.489 38.813 1.00 0.00 C ATOM 0 H THR A 49 73.132 43.691 37.256 1.00 0.00 H new ATOM 0 HA THR A 49 72.052 43.470 39.936 1.00 0.00 H new ATOM 0 HB THR A 49 72.982 41.587 40.228 1.00 0.00 H new ATOM 0 HG1 THR A 49 75.139 41.800 41.201 1.00 0.00 H new ATOM 0 HG21 THR A 49 75.128 40.673 39.294 1.00 0.00 H new ATOM 0 HG22 THR A 49 73.922 41.084 38.051 1.00 0.00 H new ATOM 0 HG23 THR A 49 75.300 42.170 38.347 1.00 0.00 H new ATOM 740 N ILE A 50 73.637 45.302 40.663 1.00 0.00 N ATOM 741 CA ILE A 50 74.332 46.510 41.075 1.00 0.00 C ATOM 742 C ILE A 50 75.854 46.300 41.176 1.00 0.00 C ATOM 743 O ILE A 50 76.631 47.256 41.176 1.00 0.00 O ATOM 744 CB ILE A 50 73.771 46.964 42.441 1.00 0.00 C ATOM 745 CG1 ILE A 50 72.355 46.506 42.871 1.00 0.00 C ATOM 746 CG2 ILE A 50 73.828 48.492 42.513 1.00 0.00 C ATOM 747 CD1 ILE A 50 72.262 45.043 43.352 1.00 0.00 C ATOM 0 H ILE A 50 73.077 44.899 41.414 1.00 0.00 H new ATOM 0 HA ILE A 50 74.165 47.276 40.318 1.00 0.00 H new ATOM 0 HB ILE A 50 74.420 46.448 43.148 1.00 0.00 H new ATOM 0 HG12 ILE A 50 72.005 47.159 43.671 1.00 0.00 H new ATOM 0 HG13 ILE A 50 71.675 46.640 42.030 1.00 0.00 H new ATOM 0 HG21 ILE A 50 73.435 48.826 43.473 1.00 0.00 H new ATOM 0 HG22 ILE A 50 74.861 48.823 42.409 1.00 0.00 H new ATOM 0 HG23 ILE A 50 73.229 48.917 41.708 1.00 0.00 H new ATOM 0 HD11 ILE A 50 71.233 44.816 43.631 1.00 0.00 H new ATOM 0 HD12 ILE A 50 72.576 44.375 42.549 1.00 0.00 H new ATOM 0 HD13 ILE A 50 72.912 44.902 44.216 1.00 0.00 H new ATOM 759 N HIS A 51 76.279 45.042 41.333 1.00 0.00 N ATOM 760 CA HIS A 51 77.661 44.672 41.666 1.00 0.00 C ATOM 761 C HIS A 51 77.959 43.201 41.270 1.00 0.00 C ATOM 762 O HIS A 51 78.147 42.348 42.144 1.00 0.00 O ATOM 763 CB HIS A 51 77.885 44.969 43.165 1.00 0.00 C ATOM 764 CG HIS A 51 79.328 45.134 43.578 1.00 0.00 C ATOM 765 ND1 HIS A 51 79.820 46.121 44.401 1.00 0.00 N ATOM 766 CD2 HIS A 51 80.384 44.333 43.247 1.00 0.00 C ATOM 767 CE1 HIS A 51 81.128 45.892 44.597 1.00 0.00 C ATOM 768 NE2 HIS A 51 81.517 44.791 43.927 1.00 0.00 N ATOM 0 H HIS A 51 75.662 44.237 41.231 1.00 0.00 H new ATOM 0 HA HIS A 51 78.372 45.265 41.091 1.00 0.00 H new ATOM 0 HB2 HIS A 51 77.343 45.879 43.424 1.00 0.00 H new ATOM 0 HB3 HIS A 51 77.447 44.160 43.749 1.00 0.00 H new ATOM 0 HD2 HIS A 51 80.350 43.489 42.574 1.00 0.00 H new ATOM 0 HE1 HIS A 51 81.777 46.504 45.206 1.00 0.00 H new ATOM 0 HE2 HIS A 51 82.448 44.375 43.917 1.00 0.00 H new ATOM 776 N PRO A 52 77.968 42.862 39.965 1.00 0.00 N ATOM 777 CA PRO A 52 78.143 41.483 39.471 1.00 0.00 C ATOM 778 C PRO A 52 79.402 40.783 39.982 1.00 0.00 C ATOM 779 O PRO A 52 79.391 39.642 40.423 1.00 0.00 O ATOM 780 CB PRO A 52 78.238 41.614 37.944 1.00 0.00 C ATOM 781 CG PRO A 52 78.516 43.091 37.669 1.00 0.00 C ATOM 782 CD PRO A 52 77.861 43.793 38.849 1.00 0.00 C ATOM 0 HA PRO A 52 77.311 40.873 39.824 1.00 0.00 H new ATOM 0 HB2 PRO A 52 79.035 40.986 37.547 1.00 0.00 H new ATOM 0 HB3 PRO A 52 77.312 41.295 37.466 1.00 0.00 H new ATOM 0 HG2 PRO A 52 79.585 43.297 37.621 1.00 0.00 H new ATOM 0 HG3 PRO A 52 78.086 43.412 36.720 1.00 0.00 H new ATOM 0 HD2 PRO A 52 78.363 44.734 39.074 1.00 0.00 H new ATOM 0 HD3 PRO A 52 76.819 44.031 38.635 1.00 0.00 H new ATOM 790 N ASP A 53 80.489 41.524 39.943 1.00 0.00 N ATOM 791 CA ASP A 53 81.871 41.149 40.212 1.00 0.00 C ATOM 792 C ASP A 53 82.179 40.888 41.700 1.00 0.00 C ATOM 793 O ASP A 53 83.285 40.469 42.050 1.00 0.00 O ATOM 794 CB ASP A 53 82.785 42.205 39.561 1.00 0.00 C ATOM 795 CG ASP A 53 82.523 43.668 39.963 1.00 0.00 C ATOM 796 OD1 ASP A 53 81.385 44.056 40.315 1.00 0.00 O ATOM 797 OD2 ASP A 53 83.478 44.472 39.900 1.00 0.00 O ATOM 0 H ASP A 53 80.424 42.511 39.696 1.00 0.00 H new ATOM 0 HA ASP A 53 82.067 40.176 39.762 1.00 0.00 H new ATOM 0 HB2 ASP A 53 83.819 41.962 39.806 1.00 0.00 H new ATOM 0 HB3 ASP A 53 82.686 42.124 38.479 1.00 0.00 H new ATOM 802 N SER A 54 81.179 41.046 42.572 1.00 0.00 N ATOM 803 CA SER A 54 81.221 40.561 43.967 1.00 0.00 C ATOM 804 C SER A 54 80.786 39.103 44.158 1.00 0.00 C ATOM 805 O SER A 54 81.145 38.463 45.147 1.00 0.00 O ATOM 806 CB SER A 54 80.412 41.472 44.895 1.00 0.00 C ATOM 807 OG SER A 54 81.268 42.392 45.554 1.00 0.00 O ATOM 0 H SER A 54 80.307 41.518 42.334 1.00 0.00 H new ATOM 0 HA SER A 54 82.277 40.596 44.235 1.00 0.00 H new ATOM 0 HB2 SER A 54 79.660 42.013 44.320 1.00 0.00 H new ATOM 0 HB3 SER A 54 79.878 40.871 45.631 1.00 0.00 H new ATOM 0 HG SER A 54 81.473 43.137 44.952 1.00 0.00 H new ATOM 813 N VAL A 55 80.046 38.582 43.193 1.00 0.00 N ATOM 814 CA VAL A 55 79.516 37.209 43.117 1.00 0.00 C ATOM 815 C VAL A 55 80.069 36.492 41.888 1.00 0.00 C ATOM 816 O VAL A 55 80.870 37.047 41.132 1.00 0.00 O ATOM 817 CB VAL A 55 77.973 37.195 43.202 1.00 0.00 C ATOM 818 CG1 VAL A 55 77.505 37.748 44.556 1.00 0.00 C ATOM 819 CG2 VAL A 55 77.271 37.978 42.087 1.00 0.00 C ATOM 0 H VAL A 55 79.775 39.136 42.381 1.00 0.00 H new ATOM 0 HA VAL A 55 79.860 36.646 43.985 1.00 0.00 H new ATOM 0 HB VAL A 55 77.693 36.148 43.084 1.00 0.00 H new ATOM 0 HG11 VAL A 55 76.416 37.731 44.599 1.00 0.00 H new ATOM 0 HG12 VAL A 55 77.910 37.133 45.360 1.00 0.00 H new ATOM 0 HG13 VAL A 55 77.857 38.773 44.672 1.00 0.00 H new ATOM 0 HG21 VAL A 55 76.191 37.916 42.223 1.00 0.00 H new ATOM 0 HG22 VAL A 55 77.582 39.022 42.124 1.00 0.00 H new ATOM 0 HG23 VAL A 55 77.540 37.554 41.120 1.00 0.00 H new ATOM 829 N THR A 56 79.734 35.215 41.735 1.00 0.00 N ATOM 830 CA THR A 56 80.166 34.419 40.565 1.00 0.00 C ATOM 831 C THR A 56 79.164 33.352 40.149 1.00 0.00 C ATOM 832 O THR A 56 78.302 32.966 40.924 1.00 0.00 O ATOM 833 CB THR A 56 81.545 33.805 40.815 1.00 0.00 C ATOM 834 OG1 THR A 56 82.074 33.267 39.628 1.00 0.00 O ATOM 835 CG2 THR A 56 81.584 32.720 41.892 1.00 0.00 C ATOM 0 H THR A 56 79.163 34.697 42.403 1.00 0.00 H new ATOM 0 HA THR A 56 80.227 35.114 39.727 1.00 0.00 H new ATOM 0 HB THR A 56 82.147 34.637 41.180 1.00 0.00 H new ATOM 0 HG1 THR A 56 82.956 32.881 39.809 1.00 0.00 H new ATOM 0 HG21 THR A 56 82.603 32.347 41.996 1.00 0.00 H new ATOM 0 HG22 THR A 56 81.252 33.138 42.842 1.00 0.00 H new ATOM 0 HG23 THR A 56 80.925 31.900 41.607 1.00 0.00 H new ATOM 843 N LYS A 57 79.262 32.848 38.920 1.00 0.00 N ATOM 844 CA LYS A 57 78.516 31.700 38.433 1.00 0.00 C ATOM 845 C LYS A 57 79.341 30.712 37.616 1.00 0.00 C ATOM 846 O LYS A 57 80.383 31.047 37.048 1.00 0.00 O ATOM 847 CB LYS A 57 77.304 32.174 37.656 1.00 0.00 C ATOM 848 CG LYS A 57 77.412 33.298 36.648 1.00 0.00 C ATOM 849 CD LYS A 57 78.453 33.027 35.567 1.00 0.00 C ATOM 850 CE LYS A 57 78.180 33.772 34.266 1.00 0.00 C ATOM 851 NZ LYS A 57 79.349 33.619 33.376 1.00 0.00 N ATOM 0 H LYS A 57 79.885 33.244 38.216 1.00 0.00 H new ATOM 0 HA LYS A 57 78.202 31.139 39.313 1.00 0.00 H new ATOM 0 HB2 LYS A 57 76.906 31.308 37.127 1.00 0.00 H new ATOM 0 HB3 LYS A 57 76.553 32.473 38.388 1.00 0.00 H new ATOM 0 HG2 LYS A 57 76.440 33.453 36.179 1.00 0.00 H new ATOM 0 HG3 LYS A 57 77.667 34.222 37.167 1.00 0.00 H new ATOM 0 HD2 LYS A 57 79.437 33.311 35.941 1.00 0.00 H new ATOM 0 HD3 LYS A 57 78.486 31.956 35.364 1.00 0.00 H new ATOM 0 HE2 LYS A 57 77.285 33.377 33.785 1.00 0.00 H new ATOM 0 HE3 LYS A 57 77.994 34.827 34.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 79.174 34.124 32.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 80.192 34.015 33.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 79.505 32.610 33.178 1.00 0.00 H new ATOM 865 N CYS A 58 78.791 29.513 37.492 1.00 0.00 N ATOM 866 CA CYS A 58 79.340 28.417 36.690 1.00 0.00 C ATOM 867 C CYS A 58 78.291 27.502 36.016 1.00 0.00 C ATOM 868 O CYS A 58 77.153 27.422 36.462 1.00 0.00 O ATOM 869 CB CYS A 58 80.302 27.634 37.582 1.00 0.00 C ATOM 870 SG CYS A 58 79.553 27.053 39.133 1.00 0.00 S ATOM 0 H CYS A 58 77.920 29.263 37.961 1.00 0.00 H new ATOM 0 HA CYS A 58 79.859 28.854 35.837 1.00 0.00 H new ATOM 0 HB2 CYS A 58 80.680 26.775 37.027 1.00 0.00 H new ATOM 0 HB3 CYS A 58 81.160 28.264 37.817 1.00 0.00 H new ATOM 0 HG CYS A 58 80.439 26.398 39.824 1.00 0.00 H new ATOM 876 N PRO A 59 78.632 26.785 34.932 1.00 0.00 N ATOM 877 CA PRO A 59 77.716 25.862 34.261 1.00 0.00 C ATOM 878 C PRO A 59 77.476 24.565 35.037 1.00 0.00 C ATOM 879 O PRO A 59 78.354 24.066 35.749 1.00 0.00 O ATOM 880 CB PRO A 59 78.334 25.583 32.892 1.00 0.00 C ATOM 881 CG PRO A 59 79.831 25.793 33.129 1.00 0.00 C ATOM 882 CD PRO A 59 79.881 26.880 34.204 1.00 0.00 C ATOM 0 HA PRO A 59 76.727 26.314 34.182 1.00 0.00 H new ATOM 0 HB2 PRO A 59 78.119 24.570 32.553 1.00 0.00 H new ATOM 0 HB3 PRO A 59 77.949 26.262 32.131 1.00 0.00 H new ATOM 0 HG2 PRO A 59 80.315 24.876 33.464 1.00 0.00 H new ATOM 0 HG3 PRO A 59 80.340 26.108 32.218 1.00 0.00 H new ATOM 0 HD2 PRO A 59 80.732 26.731 34.869 1.00 0.00 H new ATOM 0 HD3 PRO A 59 79.996 27.867 33.755 1.00 0.00 H new ATOM 890 N GLU A 60 76.301 23.972 34.823 1.00 0.00 N ATOM 891 CA GLU A 60 76.087 22.546 35.000 1.00 0.00 C ATOM 892 C GLU A 60 76.457 21.741 33.748 1.00 0.00 C ATOM 893 O GLU A 60 76.509 22.234 32.625 1.00 0.00 O ATOM 894 CB GLU A 60 74.651 22.220 35.419 1.00 0.00 C ATOM 895 CG GLU A 60 74.256 22.600 36.858 1.00 0.00 C ATOM 896 CD GLU A 60 74.874 21.712 37.962 1.00 0.00 C ATOM 897 OE1 GLU A 60 76.098 21.425 37.936 1.00 0.00 O ATOM 898 OE2 GLU A 60 74.162 21.341 38.927 1.00 0.00 O ATOM 0 H GLU A 60 75.468 24.477 34.520 1.00 0.00 H new ATOM 0 HA GLU A 60 76.755 22.249 35.808 1.00 0.00 H new ATOM 0 HB2 GLU A 60 73.972 22.726 34.733 1.00 0.00 H new ATOM 0 HB3 GLU A 60 74.493 21.149 35.293 1.00 0.00 H new ATOM 0 HG2 GLU A 60 74.550 23.634 37.038 1.00 0.00 H new ATOM 0 HG3 GLU A 60 73.170 22.557 36.944 1.00 0.00 H new ATOM 905 N LYS A 61 76.684 20.451 33.980 1.00 0.00 N ATOM 906 CA LYS A 61 77.152 19.443 33.022 1.00 0.00 C ATOM 907 C LYS A 61 76.038 18.489 32.592 1.00 0.00 C ATOM 908 O LYS A 61 75.857 18.139 31.431 1.00 0.00 O ATOM 909 CB LYS A 61 78.347 18.689 33.615 1.00 0.00 C ATOM 910 CG LYS A 61 78.239 18.314 35.088 1.00 0.00 C ATOM 911 CD LYS A 61 78.786 19.386 36.032 1.00 0.00 C ATOM 912 CE LYS A 61 78.641 18.992 37.511 1.00 0.00 C ATOM 913 NZ LYS A 61 77.227 18.938 37.967 1.00 0.00 N ATOM 0 H LYS A 61 76.537 20.050 34.906 1.00 0.00 H new ATOM 0 HA LYS A 61 77.472 19.956 32.115 1.00 0.00 H new ATOM 0 HB2 LYS A 61 78.497 17.776 33.039 1.00 0.00 H new ATOM 0 HB3 LYS A 61 79.239 19.301 33.481 1.00 0.00 H new ATOM 0 HG2 LYS A 61 77.193 18.126 35.331 1.00 0.00 H new ATOM 0 HG3 LYS A 61 78.778 17.382 35.258 1.00 0.00 H new ATOM 0 HD2 LYS A 61 79.838 19.562 35.807 1.00 0.00 H new ATOM 0 HD3 LYS A 61 78.261 20.325 35.855 1.00 0.00 H new ATOM 0 HE2 LYS A 61 79.104 18.018 37.668 1.00 0.00 H new ATOM 0 HE3 LYS A 61 79.187 19.707 38.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 77.111 18.161 38.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 76.974 19.838 38.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 76.605 18.777 37.150 1.00 0.00 H new ATOM 927 N ASN A 62 75.267 18.138 33.607 1.00 0.00 N ATOM 928 CA ASN A 62 74.025 17.378 33.644 1.00 0.00 C ATOM 929 C ASN A 62 72.798 18.234 33.305 1.00 0.00 C ATOM 930 O ASN A 62 71.716 17.706 33.063 1.00 0.00 O ATOM 931 CB ASN A 62 73.929 16.687 35.033 1.00 0.00 C ATOM 932 CG ASN A 62 74.757 17.339 36.127 1.00 0.00 C ATOM 933 OD1 ASN A 62 74.805 18.543 36.314 1.00 0.00 O ATOM 934 ND2 ASN A 62 75.615 16.563 36.740 1.00 0.00 N ATOM 0 H ASN A 62 75.533 18.417 34.552 1.00 0.00 H new ATOM 0 HA ASN A 62 74.036 16.615 32.866 1.00 0.00 H new ATOM 0 HB2 ASN A 62 72.885 16.674 35.346 1.00 0.00 H new ATOM 0 HB3 ASN A 62 74.243 15.648 34.929 1.00 0.00 H new ATOM 0 HD21 ASN A 62 76.312 16.967 37.365 1.00 0.00 H new ATOM 0 HD22 ASN A 62 75.586 15.554 36.593 1.00 0.00 H new ATOM 941 N ARG A 63 72.994 19.552 33.245 1.00 0.00 N ATOM 942 CA ARG A 63 72.098 20.556 32.693 1.00 0.00 C ATOM 943 C ARG A 63 72.886 21.538 31.814 1.00 0.00 C ATOM 944 O ARG A 63 73.061 22.684 32.216 1.00 0.00 O ATOM 945 CB ARG A 63 71.308 21.255 33.812 1.00 0.00 C ATOM 946 CG ARG A 63 70.663 20.268 34.781 1.00 0.00 C ATOM 947 CD ARG A 63 69.587 20.925 35.651 1.00 0.00 C ATOM 948 NE ARG A 63 68.784 19.901 36.342 1.00 0.00 N ATOM 949 CZ ARG A 63 67.639 19.381 35.943 1.00 0.00 C ATOM 950 NH1 ARG A 63 67.002 19.802 34.892 1.00 0.00 N ATOM 951 NH2 ARG A 63 67.092 18.403 36.599 1.00 0.00 N ATOM 0 H ARG A 63 73.849 19.972 33.610 1.00 0.00 H new ATOM 0 HA ARG A 63 71.361 20.072 32.052 1.00 0.00 H new ATOM 0 HB2 ARG A 63 71.976 21.917 34.364 1.00 0.00 H new ATOM 0 HB3 ARG A 63 70.534 21.881 33.368 1.00 0.00 H new ATOM 0 HG2 ARG A 63 70.220 19.447 34.218 1.00 0.00 H new ATOM 0 HG3 ARG A 63 71.432 19.837 35.422 1.00 0.00 H new ATOM 0 HD2 ARG A 63 70.055 21.583 36.383 1.00 0.00 H new ATOM 0 HD3 ARG A 63 68.940 21.546 35.032 1.00 0.00 H new ATOM 0 HE ARG A 63 69.155 19.556 37.227 1.00 0.00 H new ATOM 0 HH11 ARG A 63 67.385 20.567 34.336 1.00 0.00 H new ATOM 0 HH12 ARG A 63 66.119 19.368 34.623 1.00 0.00 H new ATOM 0 HH21 ARG A 63 67.548 18.029 37.432 1.00 0.00 H new ATOM 0 HH22 ARG A 63 66.207 18.008 36.282 1.00 0.00 H new ATOM 965 N PRO A 64 73.378 21.121 30.630 1.00 0.00 N ATOM 966 CA PRO A 64 74.249 21.932 29.767 1.00 0.00 C ATOM 967 C PRO A 64 73.467 23.006 28.982 1.00 0.00 C ATOM 968 O PRO A 64 73.721 23.267 27.809 1.00 0.00 O ATOM 969 CB PRO A 64 74.964 20.903 28.882 1.00 0.00 C ATOM 970 CG PRO A 64 73.875 19.854 28.664 1.00 0.00 C ATOM 971 CD PRO A 64 73.148 19.820 30.011 1.00 0.00 C ATOM 0 HA PRO A 64 74.966 22.528 30.332 1.00 0.00 H new ATOM 0 HB2 PRO A 64 75.303 21.339 27.942 1.00 0.00 H new ATOM 0 HB3 PRO A 64 75.842 20.483 29.373 1.00 0.00 H new ATOM 0 HG2 PRO A 64 73.204 20.133 27.851 1.00 0.00 H new ATOM 0 HG3 PRO A 64 74.297 18.882 28.410 1.00 0.00 H new ATOM 0 HD2 PRO A 64 72.082 19.637 29.874 1.00 0.00 H new ATOM 0 HD3 PRO A 64 73.531 19.016 30.640 1.00 0.00 H new ATOM 979 N GLU A 65 72.449 23.572 29.626 1.00 0.00 N ATOM 980 CA GLU A 65 71.413 24.450 29.087 1.00 0.00 C ATOM 981 C GLU A 65 71.111 25.653 30.002 1.00 0.00 C ATOM 982 O GLU A 65 70.168 26.405 29.768 1.00 0.00 O ATOM 983 CB GLU A 65 70.123 23.644 28.808 1.00 0.00 C ATOM 984 CG GLU A 65 70.334 22.225 28.315 1.00 0.00 C ATOM 985 CD GLU A 65 69.066 21.602 27.717 1.00 0.00 C ATOM 986 OE1 GLU A 65 68.268 21.036 28.502 1.00 0.00 O ATOM 987 OE2 GLU A 65 68.861 21.660 26.483 1.00 0.00 O ATOM 0 H GLU A 65 72.316 23.414 30.625 1.00 0.00 H new ATOM 0 HA GLU A 65 71.797 24.858 28.152 1.00 0.00 H new ATOM 0 HB2 GLU A 65 69.533 23.608 29.724 1.00 0.00 H new ATOM 0 HB3 GLU A 65 69.531 24.183 28.068 1.00 0.00 H new ATOM 0 HG2 GLU A 65 71.123 22.221 27.563 1.00 0.00 H new ATOM 0 HG3 GLU A 65 70.680 21.606 29.143 1.00 0.00 H new ATOM 994 N ALA A 66 71.881 25.786 31.081 1.00 0.00 N ATOM 995 CA ALA A 66 71.784 26.810 32.106 1.00 0.00 C ATOM 996 C ALA A 66 73.101 26.883 32.891 1.00 0.00 C ATOM 997 O ALA A 66 73.900 25.941 32.908 1.00 0.00 O ATOM 998 CB ALA A 66 70.630 26.466 33.059 1.00 0.00 C ATOM 0 H ALA A 66 72.641 25.132 31.270 1.00 0.00 H new ATOM 0 HA ALA A 66 71.594 27.776 31.639 1.00 0.00 H new ATOM 0 HB1 ALA A 66 70.554 27.233 33.830 1.00 0.00 H new ATOM 0 HB2 ALA A 66 69.696 26.421 32.498 1.00 0.00 H new ATOM 0 HB3 ALA A 66 70.819 25.499 33.526 1.00 0.00 H new ATOM 1004 N LEU A 67 73.285 27.983 33.610 1.00 0.00 N ATOM 1005 CA LEU A 67 74.331 28.121 34.622 1.00 0.00 C ATOM 1006 C LEU A 67 73.715 28.126 36.025 1.00 0.00 C ATOM 1007 O LEU A 67 72.619 28.640 36.236 1.00 0.00 O ATOM 1008 CB LEU A 67 75.209 29.361 34.361 1.00 0.00 C ATOM 1009 CG LEU A 67 76.132 29.269 33.129 1.00 0.00 C ATOM 1010 CD1 LEU A 67 75.431 29.621 31.817 1.00 0.00 C ATOM 1011 CD2 LEU A 67 77.296 30.248 33.286 1.00 0.00 C ATOM 0 H LEU A 67 72.706 28.816 33.507 1.00 0.00 H new ATOM 0 HA LEU A 67 74.994 27.258 34.557 1.00 0.00 H new ATOM 0 HB2 LEU A 67 74.559 30.228 34.243 1.00 0.00 H new ATOM 0 HB3 LEU A 67 75.824 29.542 35.242 1.00 0.00 H new ATOM 0 HG LEU A 67 76.462 28.231 33.081 1.00 0.00 H new ATOM 0 HD11 LEU A 67 76.138 29.536 30.992 1.00 0.00 H new ATOM 0 HD12 LEU A 67 74.599 28.936 31.654 1.00 0.00 H new ATOM 0 HD13 LEU A 67 75.055 30.643 31.868 1.00 0.00 H new ATOM 0 HD21 LEU A 67 77.947 30.182 32.414 1.00 0.00 H new ATOM 0 HD22 LEU A 67 76.908 31.263 33.373 1.00 0.00 H new ATOM 0 HD23 LEU A 67 77.863 29.998 34.183 1.00 0.00 H new ATOM 1023 N LYS A 68 74.444 27.583 37.000 1.00 0.00 N ATOM 1024 CA LYS A 68 74.217 27.775 38.433 1.00 0.00 C ATOM 1025 C LYS A 68 75.052 28.955 38.939 1.00 0.00 C ATOM 1026 O LYS A 68 76.161 29.197 38.474 1.00 0.00 O ATOM 1027 CB LYS A 68 74.519 26.476 39.186 1.00 0.00 C ATOM 1028 CG LYS A 68 75.905 25.921 38.865 1.00 0.00 C ATOM 1029 CD LYS A 68 76.092 24.675 39.689 1.00 0.00 C ATOM 1030 CE LYS A 68 77.475 24.095 39.409 1.00 0.00 C ATOM 1031 NZ LYS A 68 77.583 22.724 39.942 1.00 0.00 N ATOM 0 H LYS A 68 75.239 26.974 36.806 1.00 0.00 H new ATOM 0 HA LYS A 68 73.170 28.019 38.616 1.00 0.00 H new ATOM 0 HB2 LYS A 68 74.443 26.656 40.258 1.00 0.00 H new ATOM 0 HB3 LYS A 68 73.765 25.730 38.933 1.00 0.00 H new ATOM 0 HG2 LYS A 68 75.991 25.695 37.802 1.00 0.00 H new ATOM 0 HG3 LYS A 68 76.676 26.655 39.099 1.00 0.00 H new ATOM 0 HD2 LYS A 68 75.989 24.906 40.749 1.00 0.00 H new ATOM 0 HD3 LYS A 68 75.321 23.944 39.446 1.00 0.00 H new ATOM 0 HE2 LYS A 68 77.662 24.089 38.335 1.00 0.00 H new ATOM 0 HE3 LYS A 68 78.239 24.728 39.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 78.585 22.454 40.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 77.153 22.685 40.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 77.086 22.065 39.309 1.00 0.00 H new ATOM 1045 N VAL A 69 74.524 29.713 39.889 1.00 0.00 N ATOM 1046 CA VAL A 69 75.138 30.948 40.388 1.00 0.00 C ATOM 1047 C VAL A 69 75.389 30.875 41.898 1.00 0.00 C ATOM 1048 O VAL A 69 74.526 30.442 42.669 1.00 0.00 O ATOM 1049 CB VAL A 69 74.251 32.165 40.071 1.00 0.00 C ATOM 1050 CG1 VAL A 69 74.980 33.453 40.451 1.00 0.00 C ATOM 1051 CG2 VAL A 69 73.793 32.277 38.611 1.00 0.00 C ATOM 0 H VAL A 69 73.641 29.488 40.347 1.00 0.00 H new ATOM 0 HA VAL A 69 76.096 31.062 39.882 1.00 0.00 H new ATOM 0 HB VAL A 69 73.349 32.016 40.665 1.00 0.00 H new ATOM 0 HG11 VAL A 69 74.346 34.310 40.224 1.00 0.00 H new ATOM 0 HG12 VAL A 69 75.207 33.442 41.517 1.00 0.00 H new ATOM 0 HG13 VAL A 69 75.908 33.527 39.883 1.00 0.00 H new ATOM 0 HG21 VAL A 69 73.174 33.166 38.491 1.00 0.00 H new ATOM 0 HG22 VAL A 69 74.665 32.351 37.961 1.00 0.00 H new ATOM 0 HG23 VAL A 69 73.214 31.393 38.342 1.00 0.00 H new ATOM 1061 N SER A 70 76.553 31.360 42.321 1.00 0.00 N ATOM 1062 CA SER A 70 77.017 31.381 43.709 1.00 0.00 C ATOM 1063 C SER A 70 77.261 32.782 44.278 1.00 0.00 C ATOM 1064 O SER A 70 77.932 33.618 43.664 1.00 0.00 O ATOM 1065 CB SER A 70 78.271 30.497 43.882 1.00 0.00 C ATOM 1066 OG SER A 70 78.920 30.122 42.677 1.00 0.00 O ATOM 0 H SER A 70 77.231 31.768 41.678 1.00 0.00 H new ATOM 0 HA SER A 70 76.194 30.969 44.293 1.00 0.00 H new ATOM 0 HB2 SER A 70 78.986 31.028 44.510 1.00 0.00 H new ATOM 0 HB3 SER A 70 77.986 29.592 44.419 1.00 0.00 H new ATOM 0 HG SER A 70 79.701 29.567 42.885 1.00 0.00 H new ATOM 1072 N CYS A 71 76.804 33.016 45.519 1.00 0.00 N ATOM 1073 CA CYS A 71 77.217 34.206 46.249 1.00 0.00 C ATOM 1074 C CYS A 71 78.645 33.986 46.774 1.00 0.00 C ATOM 1075 O CYS A 71 78.879 33.616 47.920 1.00 0.00 O ATOM 1076 CB CYS A 71 76.197 34.583 47.341 1.00 0.00 C ATOM 1077 SG CYS A 71 76.793 36.094 48.134 1.00 0.00 S ATOM 0 H CYS A 71 76.161 32.405 46.022 1.00 0.00 H new ATOM 0 HA CYS A 71 77.237 35.071 45.586 1.00 0.00 H new ATOM 0 HB2 CYS A 71 75.210 34.741 46.907 1.00 0.00 H new ATOM 0 HB3 CYS A 71 76.100 33.779 48.070 1.00 0.00 H new ATOM 0 HG CYS A 71 76.458 36.086 49.390 1.00 0.00 H new ATOM 1082 N GLY A 72 79.620 34.201 45.900 1.00 0.00 N ATOM 1083 CA GLY A 72 81.038 34.203 46.263 1.00 0.00 C ATOM 1084 C GLY A 72 81.469 35.396 47.135 1.00 0.00 C ATOM 1085 O GLY A 72 82.660 35.551 47.388 1.00 0.00 O ATOM 0 H GLY A 72 79.451 34.381 44.910 1.00 0.00 H new ATOM 0 HA2 GLY A 72 81.266 33.279 46.794 1.00 0.00 H new ATOM 0 HA3 GLY A 72 81.634 34.201 45.351 1.00 0.00 H new ATOM 1089 N LYS A 73 80.537 36.235 47.608 1.00 0.00 N ATOM 1090 CA LYS A 73 80.777 37.288 48.602 1.00 0.00 C ATOM 1091 C LYS A 73 80.957 36.713 50.002 1.00 0.00 C ATOM 1092 O LYS A 73 81.962 36.992 50.653 1.00 0.00 O ATOM 1093 CB LYS A 73 79.622 38.289 48.575 1.00 0.00 C ATOM 1094 CG LYS A 73 80.049 39.700 48.164 1.00 0.00 C ATOM 1095 CD LYS A 73 80.720 40.470 49.308 1.00 0.00 C ATOM 1096 CE LYS A 73 81.415 41.725 48.761 1.00 0.00 C ATOM 1097 NZ LYS A 73 82.774 41.414 48.261 1.00 0.00 N ATOM 0 H LYS A 73 79.566 36.198 47.299 1.00 0.00 H new ATOM 0 HA LYS A 73 81.705 37.798 48.343 1.00 0.00 H new ATOM 0 HB2 LYS A 73 78.859 37.933 47.883 1.00 0.00 H new ATOM 0 HB3 LYS A 73 79.163 38.330 49.563 1.00 0.00 H new ATOM 0 HG2 LYS A 73 80.737 39.636 47.321 1.00 0.00 H new ATOM 0 HG3 LYS A 73 79.176 40.254 47.821 1.00 0.00 H new ATOM 0 HD2 LYS A 73 79.976 40.752 50.053 1.00 0.00 H new ATOM 0 HD3 LYS A 73 81.447 39.831 49.810 1.00 0.00 H new ATOM 0 HE2 LYS A 73 80.818 42.152 47.955 1.00 0.00 H new ATOM 0 HE3 LYS A 73 81.478 42.479 49.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 83.217 42.282 47.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 83.350 41.029 49.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 82.710 40.712 47.496 1.00 0.00 H new ATOM 1111 N CYS A 74 79.995 35.900 50.416 1.00 0.00 N ATOM 1112 CA CYS A 74 79.908 35.245 51.705 1.00 0.00 C ATOM 1113 C CYS A 74 80.188 33.728 51.611 1.00 0.00 C ATOM 1114 O CYS A 74 80.650 33.115 52.578 1.00 0.00 O ATOM 1115 CB CYS A 74 78.525 35.596 52.241 1.00 0.00 C ATOM 1116 SG CYS A 74 77.199 35.242 51.036 1.00 0.00 S ATOM 0 H CYS A 74 79.203 35.668 49.816 1.00 0.00 H new ATOM 0 HA CYS A 74 80.677 35.590 52.396 1.00 0.00 H new ATOM 0 HB2 CYS A 74 78.340 35.034 53.156 1.00 0.00 H new ATOM 0 HB3 CYS A 74 78.499 36.653 52.506 1.00 0.00 H new ATOM 0 HG CYS A 74 77.640 35.453 49.831 1.00 0.00 H new ATOM 1121 N GLY A 75 79.967 33.152 50.429 1.00 0.00 N ATOM 1122 CA GLY A 75 80.264 31.764 50.087 1.00 0.00 C ATOM 1123 C GLY A 75 79.021 30.871 50.052 1.00 0.00 C ATOM 1124 O GLY A 75 78.958 29.858 50.752 1.00 0.00 O ATOM 0 H GLY A 75 79.557 33.666 49.649 1.00 0.00 H new ATOM 0 HA2 GLY A 75 80.753 31.733 49.113 1.00 0.00 H new ATOM 0 HA3 GLY A 75 80.972 31.362 50.812 1.00 0.00 H new ATOM 1128 N ASN A 76 78.025 31.230 49.241 1.00 0.00 N ATOM 1129 CA ASN A 76 76.825 30.469 48.978 1.00 0.00 C ATOM 1130 C ASN A 76 76.816 30.048 47.496 1.00 0.00 C ATOM 1131 O ASN A 76 77.715 30.395 46.735 1.00 0.00 O ATOM 1132 CB ASN A 76 75.633 31.303 49.441 1.00 0.00 C ATOM 1133 CG ASN A 76 74.515 30.457 50.015 1.00 0.00 C ATOM 1134 OD1 ASN A 76 74.383 29.292 49.683 1.00 0.00 O ATOM 1135 ND2 ASN A 76 73.709 31.003 50.894 1.00 0.00 N ATOM 0 H ASN A 76 78.045 32.110 48.726 1.00 0.00 H new ATOM 0 HA ASN A 76 76.774 29.534 49.535 1.00 0.00 H new ATOM 0 HB2 ASN A 76 75.965 32.018 50.194 1.00 0.00 H new ATOM 0 HB3 ASN A 76 75.251 31.881 48.600 1.00 0.00 H new ATOM 0 HD21 ASN A 76 72.959 30.451 51.310 1.00 0.00 H new ATOM 0 HD22 ASN A 76 73.832 31.979 51.162 1.00 0.00 H new ATOM 1142 N GLY A 77 75.814 29.292 47.072 1.00 0.00 N ATOM 1143 CA GLY A 77 75.806 28.568 45.801 1.00 0.00 C ATOM 1144 C GLY A 77 74.534 27.841 45.412 1.00 0.00 C ATOM 1145 O GLY A 77 74.541 26.629 45.217 1.00 0.00 O ATOM 0 H GLY A 77 74.960 29.159 47.614 1.00 0.00 H new ATOM 0 HA2 GLY A 77 76.042 29.279 45.009 1.00 0.00 H new ATOM 0 HA3 GLY A 77 76.615 27.838 45.826 1.00 0.00 H new ATOM 1149 N LEU A 78 73.444 28.603 45.336 1.00 0.00 N ATOM 1150 CA LEU A 78 72.078 28.068 45.195 1.00 0.00 C ATOM 1151 C LEU A 78 71.318 28.589 43.967 1.00 0.00 C ATOM 1152 O LEU A 78 70.313 28.003 43.570 1.00 0.00 O ATOM 1153 CB LEU A 78 71.241 28.400 46.446 1.00 0.00 C ATOM 1154 CG LEU A 78 71.967 28.454 47.798 1.00 0.00 C ATOM 1155 CD1 LEU A 78 70.955 28.765 48.893 1.00 0.00 C ATOM 1156 CD2 LEU A 78 72.692 27.165 48.186 1.00 0.00 C ATOM 0 H LEU A 78 73.478 29.622 45.370 1.00 0.00 H new ATOM 0 HA LEU A 78 72.208 26.993 45.069 1.00 0.00 H new ATOM 0 HB2 LEU A 78 70.764 29.366 46.283 1.00 0.00 H new ATOM 0 HB3 LEU A 78 70.445 27.660 46.523 1.00 0.00 H new ATOM 0 HG LEU A 78 72.728 29.227 47.692 1.00 0.00 H new ATOM 0 HD11 LEU A 78 71.463 28.805 49.857 1.00 0.00 H new ATOM 0 HD12 LEU A 78 70.484 29.727 48.691 1.00 0.00 H new ATOM 0 HD13 LEU A 78 70.193 27.986 48.916 1.00 0.00 H new ATOM 0 HD21 LEU A 78 73.175 27.297 49.154 1.00 0.00 H new ATOM 0 HD22 LEU A 78 71.973 26.348 48.247 1.00 0.00 H new ATOM 0 HD23 LEU A 78 73.445 26.931 47.434 1.00 0.00 H new ATOM 1168 N GLY A 79 71.726 29.732 43.411 1.00 0.00 N ATOM 1169 CA GLY A 79 70.994 30.382 42.326 1.00 0.00 C ATOM 1170 C GLY A 79 71.302 29.786 40.963 1.00 0.00 C ATOM 1171 O GLY A 79 72.059 28.827 40.840 1.00 0.00 O ATOM 0 H GLY A 79 72.569 30.229 43.699 1.00 0.00 H new ATOM 0 HA2 GLY A 79 69.924 30.302 42.518 1.00 0.00 H new ATOM 0 HA3 GLY A 79 71.238 31.444 42.316 1.00 0.00 H new ATOM 1175 N HIS A 80 70.703 30.360 39.929 1.00 0.00 N ATOM 1176 CA HIS A 80 70.894 30.032 38.525 1.00 0.00 C ATOM 1177 C HIS A 80 70.753 31.261 37.613 1.00 0.00 C ATOM 1178 O HIS A 80 70.104 32.254 37.927 1.00 0.00 O ATOM 1179 CB HIS A 80 69.885 28.974 38.100 1.00 0.00 C ATOM 1180 CG HIS A 80 70.318 27.534 38.267 1.00 0.00 C ATOM 1181 ND1 HIS A 80 70.657 26.900 39.442 1.00 0.00 N ATOM 1182 CD2 HIS A 80 70.468 26.614 37.265 1.00 0.00 C ATOM 1183 CE1 HIS A 80 71.010 25.637 39.156 1.00 0.00 C ATOM 1184 NE2 HIS A 80 70.880 25.404 37.840 1.00 0.00 N ATOM 0 H HIS A 80 70.029 31.114 40.058 1.00 0.00 H new ATOM 0 HA HIS A 80 71.910 29.653 38.419 1.00 0.00 H new ATOM 0 HB2 HIS A 80 68.969 29.125 38.671 1.00 0.00 H new ATOM 0 HB3 HIS A 80 69.637 29.138 37.051 1.00 0.00 H new ATOM 0 HD1 HIS A 80 70.642 27.319 40.372 1.00 0.00 H new ATOM 0 HD2 HIS A 80 70.298 26.790 36.213 1.00 0.00 H new ATOM 0 HE1 HIS A 80 71.350 24.912 39.881 1.00 0.00 H new ATOM 1192 N GLU A 81 71.340 31.114 36.439 1.00 0.00 N ATOM 1193 CA GLU A 81 71.365 32.017 35.294 1.00 0.00 C ATOM 1194 C GLU A 81 71.065 31.187 34.043 1.00 0.00 C ATOM 1195 O GLU A 81 71.912 30.439 33.556 1.00 0.00 O ATOM 1196 CB GLU A 81 72.749 32.668 35.246 1.00 0.00 C ATOM 1197 CG GLU A 81 72.967 33.619 34.061 1.00 0.00 C ATOM 1198 CD GLU A 81 74.371 34.238 34.101 1.00 0.00 C ATOM 1199 OE1 GLU A 81 74.699 34.922 35.097 1.00 0.00 O ATOM 1200 OE2 GLU A 81 75.158 34.088 33.133 1.00 0.00 O ATOM 0 H GLU A 81 71.870 30.266 36.239 1.00 0.00 H new ATOM 0 HA GLU A 81 70.620 32.810 35.362 1.00 0.00 H new ATOM 0 HB2 GLU A 81 72.909 33.220 36.172 1.00 0.00 H new ATOM 0 HB3 GLU A 81 73.504 31.883 35.209 1.00 0.00 H new ATOM 0 HG2 GLU A 81 72.832 33.076 33.125 1.00 0.00 H new ATOM 0 HG3 GLU A 81 72.217 34.409 34.082 1.00 0.00 H new ATOM 1207 N PHE A 82 69.832 31.251 33.540 1.00 0.00 N ATOM 1208 CA PHE A 82 69.456 30.477 32.356 1.00 0.00 C ATOM 1209 C PHE A 82 69.925 31.213 31.092 1.00 0.00 C ATOM 1210 O PHE A 82 69.574 32.376 30.869 1.00 0.00 O ATOM 1211 CB PHE A 82 67.944 30.186 32.354 1.00 0.00 C ATOM 1212 CG PHE A 82 67.573 28.717 32.388 1.00 0.00 C ATOM 1213 CD1 PHE A 82 67.679 27.936 31.222 1.00 0.00 C ATOM 1214 CD2 PHE A 82 67.095 28.133 33.577 1.00 0.00 C ATOM 1215 CE1 PHE A 82 67.297 26.582 31.241 1.00 0.00 C ATOM 1216 CE2 PHE A 82 66.714 26.778 33.597 1.00 0.00 C ATOM 1217 CZ PHE A 82 66.812 26.004 32.427 1.00 0.00 C ATOM 0 H PHE A 82 69.083 31.824 33.929 1.00 0.00 H new ATOM 0 HA PHE A 82 69.953 29.507 32.374 1.00 0.00 H new ATOM 0 HB2 PHE A 82 67.494 30.679 33.216 1.00 0.00 H new ATOM 0 HB3 PHE A 82 67.504 30.636 31.464 1.00 0.00 H new ATOM 0 HD1 PHE A 82 68.054 28.377 30.310 1.00 0.00 H new ATOM 0 HD2 PHE A 82 67.021 28.727 34.476 1.00 0.00 H new ATOM 0 HE1 PHE A 82 67.376 25.986 30.344 1.00 0.00 H new ATOM 0 HE2 PHE A 82 66.347 26.333 34.510 1.00 0.00 H new ATOM 0 HZ PHE A 82 66.515 24.966 32.440 1.00 0.00 H new ATOM 1227 N LEU A 83 70.737 30.528 30.284 1.00 0.00 N ATOM 1228 CA LEU A 83 71.576 31.108 29.232 1.00 0.00 C ATOM 1229 C LEU A 83 71.705 30.128 28.052 1.00 0.00 C ATOM 1230 O LEU A 83 70.975 29.148 27.956 1.00 0.00 O ATOM 1231 CB LEU A 83 72.946 31.451 29.870 1.00 0.00 C ATOM 1232 CG LEU A 83 73.663 32.661 29.237 1.00 0.00 C ATOM 1233 CD1 LEU A 83 73.033 33.984 29.674 1.00 0.00 C ATOM 1234 CD2 LEU A 83 75.140 32.673 29.618 1.00 0.00 C ATOM 0 H LEU A 83 70.832 29.514 30.347 1.00 0.00 H new ATOM 0 HA LEU A 83 71.133 32.017 28.825 1.00 0.00 H new ATOM 0 HB2 LEU A 83 72.799 31.647 30.932 1.00 0.00 H new ATOM 0 HB3 LEU A 83 73.596 30.579 29.794 1.00 0.00 H new ATOM 0 HG LEU A 83 73.559 32.560 28.157 1.00 0.00 H new ATOM 0 HD11 LEU A 83 73.566 34.812 29.207 1.00 0.00 H new ATOM 0 HD12 LEU A 83 71.987 34.007 29.369 1.00 0.00 H new ATOM 0 HD13 LEU A 83 73.097 34.077 30.758 1.00 0.00 H new ATOM 0 HD21 LEU A 83 75.627 33.535 29.161 1.00 0.00 H new ATOM 0 HD22 LEU A 83 75.236 32.735 30.702 1.00 0.00 H new ATOM 0 HD23 LEU A 83 75.615 31.758 29.264 1.00 0.00 H new ATOM 1246 N ASN A 84 72.608 30.423 27.115 1.00 0.00 N ATOM 1247 CA ASN A 84 73.021 29.596 25.964 1.00 0.00 C ATOM 1248 C ASN A 84 71.936 29.394 24.883 1.00 0.00 C ATOM 1249 O ASN A 84 72.208 28.899 23.789 1.00 0.00 O ATOM 1250 CB ASN A 84 73.674 28.289 26.447 1.00 0.00 C ATOM 1251 CG ASN A 84 74.522 28.403 27.670 1.00 0.00 C ATOM 1252 OD1 ASN A 84 74.164 28.056 28.781 1.00 0.00 O ATOM 1253 ND2 ASN A 84 75.740 28.808 27.464 1.00 0.00 N ATOM 0 H ASN A 84 73.111 31.310 27.136 1.00 0.00 H new ATOM 0 HA ASN A 84 73.779 30.167 25.428 1.00 0.00 H new ATOM 0 HB2 ASN A 84 72.886 27.561 26.640 1.00 0.00 H new ATOM 0 HB3 ASN A 84 74.286 27.890 25.638 1.00 0.00 H new ATOM 0 HD21 ASN A 84 76.405 28.837 28.237 1.00 0.00 H new ATOM 0 HD22 ASN A 84 76.030 29.097 26.530 1.00 0.00 H new ATOM 1260 N ASP A 85 70.729 29.861 25.186 1.00 0.00 N ATOM 1261 CA ASP A 85 69.531 29.923 24.344 1.00 0.00 C ATOM 1262 C ASP A 85 69.317 31.313 23.714 1.00 0.00 C ATOM 1263 O ASP A 85 68.561 31.466 22.755 1.00 0.00 O ATOM 1264 CB ASP A 85 68.335 29.536 25.221 1.00 0.00 C ATOM 1265 CG ASP A 85 67.026 29.504 24.433 1.00 0.00 C ATOM 1266 OD1 ASP A 85 66.899 28.629 23.551 1.00 0.00 O ATOM 1267 OD2 ASP A 85 66.135 30.335 24.724 1.00 0.00 O ATOM 0 H ASP A 85 70.544 30.242 26.114 1.00 0.00 H new ATOM 0 HA ASP A 85 69.646 29.234 23.507 1.00 0.00 H new ATOM 0 HB2 ASP A 85 68.514 28.556 25.664 1.00 0.00 H new ATOM 0 HB3 ASP A 85 68.245 30.246 26.043 1.00 0.00 H new ATOM 1272 N GLY A 86 70.011 32.334 24.232 1.00 0.00 N ATOM 1273 CA GLY A 86 69.958 33.723 23.799 1.00 0.00 C ATOM 1274 C GLY A 86 71.236 34.198 23.093 1.00 0.00 C ATOM 1275 O GLY A 86 71.930 35.050 23.650 1.00 0.00 O ATOM 0 H GLY A 86 70.659 32.198 25.008 1.00 0.00 H new ATOM 0 HA2 GLY A 86 69.111 33.852 23.125 1.00 0.00 H new ATOM 0 HA3 GLY A 86 69.775 34.358 24.666 1.00 0.00 H new ATOM 1279 N PRO A 87 71.567 33.701 21.882 1.00 0.00 N ATOM 1280 CA PRO A 87 72.763 34.119 21.144 1.00 0.00 C ATOM 1281 C PRO A 87 72.636 35.518 20.513 1.00 0.00 C ATOM 1282 O PRO A 87 73.646 36.115 20.147 1.00 0.00 O ATOM 1283 CB PRO A 87 72.944 33.041 20.068 1.00 0.00 C ATOM 1284 CG PRO A 87 71.518 32.588 19.766 1.00 0.00 C ATOM 1285 CD PRO A 87 70.858 32.664 21.139 1.00 0.00 C ATOM 0 HA PRO A 87 73.620 34.206 21.812 1.00 0.00 H new ATOM 0 HB2 PRO A 87 73.434 33.440 19.180 1.00 0.00 H new ATOM 0 HB3 PRO A 87 73.559 32.216 20.427 1.00 0.00 H new ATOM 0 HG2 PRO A 87 71.028 33.240 19.042 1.00 0.00 H new ATOM 0 HG3 PRO A 87 71.490 31.578 19.356 1.00 0.00 H new ATOM 0 HD2 PRO A 87 69.799 32.907 21.048 1.00 0.00 H new ATOM 0 HD3 PRO A 87 70.922 31.705 21.654 1.00 0.00 H new ATOM 1293 N LYS A 88 71.401 36.014 20.343 1.00 0.00 N ATOM 1294 CA LYS A 88 71.052 37.236 19.614 1.00 0.00 C ATOM 1295 C LYS A 88 70.475 38.349 20.480 1.00 0.00 C ATOM 1296 O LYS A 88 70.903 39.494 20.393 1.00 0.00 O ATOM 1297 CB LYS A 88 70.101 36.871 18.470 1.00 0.00 C ATOM 1298 CG LYS A 88 70.816 36.103 17.358 1.00 0.00 C ATOM 1299 CD LYS A 88 69.830 35.425 16.408 1.00 0.00 C ATOM 1300 CE LYS A 88 68.791 36.392 15.829 1.00 0.00 C ATOM 1301 NZ LYS A 88 68.171 35.824 14.615 1.00 0.00 N ATOM 0 H LYS A 88 70.580 35.548 20.731 1.00 0.00 H new ATOM 0 HA LYS A 88 71.981 37.653 19.225 1.00 0.00 H new ATOM 0 HB2 LYS A 88 69.280 36.268 18.858 1.00 0.00 H new ATOM 0 HB3 LYS A 88 69.662 37.780 18.059 1.00 0.00 H new ATOM 0 HG2 LYS A 88 71.451 36.787 16.795 1.00 0.00 H new ATOM 0 HG3 LYS A 88 71.470 35.351 17.799 1.00 0.00 H new ATOM 0 HD2 LYS A 88 70.382 34.962 15.590 1.00 0.00 H new ATOM 0 HD3 LYS A 88 69.316 34.624 16.939 1.00 0.00 H new ATOM 0 HE2 LYS A 88 68.022 36.597 16.574 1.00 0.00 H new ATOM 0 HE3 LYS A 88 69.266 37.344 15.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 67.470 36.493 14.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 68.905 35.651 13.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 67.700 34.927 14.852 1.00 0.00 H new ATOM 1315 N ARG A 89 69.470 38.007 21.284 1.00 0.00 N ATOM 1316 CA ARG A 89 68.775 38.920 22.180 1.00 0.00 C ATOM 1317 C ARG A 89 69.649 39.419 23.330 1.00 0.00 C ATOM 1318 O ARG A 89 70.597 38.756 23.745 1.00 0.00 O ATOM 1319 CB ARG A 89 67.488 38.290 22.707 1.00 0.00 C ATOM 1320 CG ARG A 89 66.372 38.386 21.691 1.00 0.00 C ATOM 1321 CD ARG A 89 66.372 37.384 20.533 1.00 0.00 C ATOM 1322 NE ARG A 89 66.167 35.996 20.991 1.00 0.00 N ATOM 1323 CZ ARG A 89 66.225 34.902 20.255 1.00 0.00 C ATOM 1324 NH1 ARG A 89 66.412 34.933 18.971 1.00 0.00 N ATOM 1325 NH2 ARG A 89 66.080 33.735 20.802 1.00 0.00 N ATOM 0 H ARG A 89 69.108 37.055 21.329 1.00 0.00 H new ATOM 0 HA ARG A 89 68.521 39.798 21.586 1.00 0.00 H new ATOM 0 HB2 ARG A 89 67.668 37.244 22.955 1.00 0.00 H new ATOM 0 HB3 ARG A 89 67.187 38.789 23.628 1.00 0.00 H new ATOM 0 HG2 ARG A 89 65.426 38.284 22.222 1.00 0.00 H new ATOM 0 HG3 ARG A 89 66.392 39.389 21.266 1.00 0.00 H new ATOM 0 HD2 ARG A 89 65.587 37.650 19.826 1.00 0.00 H new ATOM 0 HD3 ARG A 89 67.319 37.451 19.998 1.00 0.00 H new ATOM 0 HE ARG A 89 65.958 35.869 21.981 1.00 0.00 H new ATOM 0 HH11 ARG A 89 66.521 35.827 18.493 1.00 0.00 H new ATOM 0 HH12 ARG A 89 66.450 34.063 18.440 1.00 0.00 H new ATOM 0 HH21 ARG A 89 65.920 33.659 21.807 1.00 0.00 H new ATOM 0 HH22 ARG A 89 66.126 32.893 20.228 1.00 0.00 H new ATOM 1339 N GLY A 90 69.233 40.549 23.885 1.00 0.00 N ATOM 1340 CA GLY A 90 69.846 41.222 25.019 1.00 0.00 C ATOM 1341 C GLY A 90 69.493 40.634 26.389 1.00 0.00 C ATOM 1342 O GLY A 90 69.994 41.102 27.406 1.00 0.00 O ATOM 0 H GLY A 90 68.414 41.047 23.536 1.00 0.00 H new ATOM 0 HA2 GLY A 90 70.929 41.195 24.897 1.00 0.00 H new ATOM 0 HA3 GLY A 90 69.550 42.271 25.003 1.00 0.00 H new ATOM 1346 N GLN A 91 68.600 39.646 26.410 1.00 0.00 N ATOM 1347 CA GLN A 91 68.035 39.016 27.596 1.00 0.00 C ATOM 1348 C GLN A 91 68.819 37.817 28.145 1.00 0.00 C ATOM 1349 O GLN A 91 69.482 37.080 27.415 1.00 0.00 O ATOM 1350 CB GLN A 91 66.575 38.669 27.374 1.00 0.00 C ATOM 1351 CG GLN A 91 65.734 39.783 28.012 1.00 0.00 C ATOM 1352 CD GLN A 91 65.397 39.536 29.479 1.00 0.00 C ATOM 1353 OE1 GLN A 91 65.897 38.623 30.115 1.00 0.00 O ATOM 1354 NE2 GLN A 91 64.533 40.327 30.072 1.00 0.00 N ATOM 0 H GLN A 91 68.232 39.242 25.549 1.00 0.00 H new ATOM 0 HA GLN A 91 68.118 39.768 28.380 1.00 0.00 H new ATOM 0 HB2 GLN A 91 66.358 38.587 26.309 1.00 0.00 H new ATOM 0 HB3 GLN A 91 66.338 37.704 27.823 1.00 0.00 H new ATOM 0 HG2 GLN A 91 66.273 40.727 27.926 1.00 0.00 H new ATOM 0 HG3 GLN A 91 64.807 39.893 27.449 1.00 0.00 H new ATOM 0 HE21 GLN A 91 64.106 41.095 29.554 1.00 0.00 H new ATOM 0 HE22 GLN A 91 64.289 40.173 31.050 1.00 0.00 H new ATOM 1363 N SER A 92 68.643 37.600 29.443 1.00 0.00 N ATOM 1364 CA SER A 92 69.154 36.527 30.276 1.00 0.00 C ATOM 1365 C SER A 92 68.385 36.569 31.601 1.00 0.00 C ATOM 1366 O SER A 92 68.202 37.622 32.205 1.00 0.00 O ATOM 1367 CB SER A 92 70.653 36.681 30.528 1.00 0.00 C ATOM 1368 OG SER A 92 71.016 37.920 31.098 1.00 0.00 O ATOM 0 H SER A 92 68.076 38.245 29.994 1.00 0.00 H new ATOM 0 HA SER A 92 69.014 35.570 29.773 1.00 0.00 H new ATOM 0 HB2 SER A 92 70.984 35.879 31.187 1.00 0.00 H new ATOM 0 HB3 SER A 92 71.184 36.558 29.584 1.00 0.00 H new ATOM 0 HG SER A 92 71.986 37.947 31.232 1.00 0.00 H new ATOM 1374 N ARG A 93 67.884 35.415 32.041 1.00 0.00 N ATOM 1375 CA ARG A 93 67.109 35.280 33.294 1.00 0.00 C ATOM 1376 C ARG A 93 67.964 34.743 34.449 1.00 0.00 C ATOM 1377 O ARG A 93 68.272 33.551 34.500 1.00 0.00 O ATOM 1378 CB ARG A 93 65.798 34.486 33.096 1.00 0.00 C ATOM 1379 CG ARG A 93 65.928 33.213 32.246 1.00 0.00 C ATOM 1380 CD ARG A 93 64.898 32.124 32.602 1.00 0.00 C ATOM 1381 NE ARG A 93 63.488 32.501 32.366 1.00 0.00 N ATOM 1382 CZ ARG A 93 62.842 32.493 31.214 1.00 0.00 C ATOM 1383 NH1 ARG A 93 63.442 32.300 30.075 1.00 0.00 N ATOM 1384 NH2 ARG A 93 61.558 32.670 31.208 1.00 0.00 N ATOM 0 H ARG A 93 68.001 34.534 31.540 1.00 0.00 H new ATOM 0 HA ARG A 93 66.806 36.286 33.583 1.00 0.00 H new ATOM 0 HB2 ARG A 93 65.406 34.212 34.076 1.00 0.00 H new ATOM 0 HB3 ARG A 93 65.062 35.141 32.631 1.00 0.00 H new ATOM 0 HG2 ARG A 93 65.817 33.476 31.194 1.00 0.00 H new ATOM 0 HG3 ARG A 93 66.932 32.806 32.368 1.00 0.00 H new ATOM 0 HD2 ARG A 93 65.122 31.229 32.022 1.00 0.00 H new ATOM 0 HD3 ARG A 93 65.018 31.861 33.653 1.00 0.00 H new ATOM 0 HE ARG A 93 62.955 32.800 33.183 1.00 0.00 H new ATOM 0 HH11 ARG A 93 64.450 32.147 30.049 1.00 0.00 H new ATOM 0 HH12 ARG A 93 62.904 32.302 29.208 1.00 0.00 H new ATOM 0 HH21 ARG A 93 61.059 32.813 32.086 1.00 0.00 H new ATOM 0 HH22 ARG A 93 61.047 32.666 30.325 1.00 0.00 H new ATOM 1398 N PHE A 94 68.269 35.618 35.402 1.00 0.00 N ATOM 1399 CA PHE A 94 68.915 35.308 36.677 1.00 0.00 C ATOM 1400 C PHE A 94 67.859 35.114 37.782 1.00 0.00 C ATOM 1401 O PHE A 94 67.014 35.983 38.010 1.00 0.00 O ATOM 1402 CB PHE A 94 69.911 36.426 37.036 1.00 0.00 C ATOM 1403 CG PHE A 94 70.412 36.384 38.474 1.00 0.00 C ATOM 1404 CD1 PHE A 94 71.094 35.250 38.950 1.00 0.00 C ATOM 1405 CD2 PHE A 94 70.166 37.463 39.347 1.00 0.00 C ATOM 1406 CE1 PHE A 94 71.502 35.179 40.293 1.00 0.00 C ATOM 1407 CE2 PHE A 94 70.580 37.398 40.688 1.00 0.00 C ATOM 1408 CZ PHE A 94 71.245 36.254 41.163 1.00 0.00 C ATOM 0 H PHE A 94 68.063 36.612 35.303 1.00 0.00 H new ATOM 0 HA PHE A 94 69.468 34.373 36.587 1.00 0.00 H new ATOM 0 HB2 PHE A 94 70.767 36.363 36.364 1.00 0.00 H new ATOM 0 HB3 PHE A 94 69.436 37.391 36.858 1.00 0.00 H new ATOM 0 HD1 PHE A 94 71.305 34.430 38.280 1.00 0.00 H new ATOM 0 HD2 PHE A 94 69.657 38.343 38.983 1.00 0.00 H new ATOM 0 HE1 PHE A 94 72.013 34.300 40.657 1.00 0.00 H new ATOM 0 HE2 PHE A 94 70.387 38.226 41.354 1.00 0.00 H new ATOM 0 HZ PHE A 94 71.558 36.201 42.195 1.00 0.00 H new ATOM 1418 N CYS A 95 67.889 33.972 38.473 1.00 0.00 N ATOM 1419 CA CYS A 95 66.950 33.647 39.540 1.00 0.00 C ATOM 1420 C CYS A 95 67.614 32.841 40.669 1.00 0.00 C ATOM 1421 O CYS A 95 68.352 31.886 40.426 1.00 0.00 O ATOM 1422 CB CYS A 95 65.775 32.901 38.914 1.00 0.00 C ATOM 1423 SG CYS A 95 64.391 32.886 40.087 1.00 0.00 S ATOM 0 H CYS A 95 68.577 33.239 38.302 1.00 0.00 H new ATOM 0 HA CYS A 95 66.595 34.563 40.013 1.00 0.00 H new ATOM 0 HB2 CYS A 95 65.475 33.384 37.984 1.00 0.00 H new ATOM 0 HB3 CYS A 95 66.067 31.881 38.664 1.00 0.00 H new ATOM 0 HG CYS A 95 63.409 33.592 39.609 1.00 0.00 H new ATOM 1429 N ILE A 96 67.363 33.218 41.925 1.00 0.00 N ATOM 1430 CA ILE A 96 68.055 32.702 43.116 1.00 0.00 C ATOM 1431 C ILE A 96 67.088 32.288 44.239 1.00 0.00 C ATOM 1432 O ILE A 96 65.904 32.630 44.236 1.00 0.00 O ATOM 1433 CB ILE A 96 69.101 33.759 43.514 1.00 0.00 C ATOM 1434 CG1 ILE A 96 70.141 33.209 44.511 1.00 0.00 C ATOM 1435 CG2 ILE A 96 68.444 35.040 44.057 1.00 0.00 C ATOM 1436 CD1 ILE A 96 71.522 33.847 44.333 1.00 0.00 C ATOM 0 H ILE A 96 66.651 33.912 42.152 1.00 0.00 H new ATOM 0 HA ILE A 96 68.567 31.765 42.898 1.00 0.00 H new ATOM 0 HB ILE A 96 69.634 34.019 42.600 1.00 0.00 H new ATOM 0 HG12 ILE A 96 69.792 33.385 45.529 1.00 0.00 H new ATOM 0 HG13 ILE A 96 70.224 32.130 44.385 1.00 0.00 H new ATOM 0 HG21 ILE A 96 69.217 35.760 44.326 1.00 0.00 H new ATOM 0 HG22 ILE A 96 67.798 35.470 43.291 1.00 0.00 H new ATOM 0 HG23 ILE A 96 67.850 34.799 44.939 1.00 0.00 H new ATOM 0 HD11 ILE A 96 72.215 33.423 45.060 1.00 0.00 H new ATOM 0 HD12 ILE A 96 71.887 33.649 43.325 1.00 0.00 H new ATOM 0 HD13 ILE A 96 71.448 34.924 44.487 1.00 0.00 H new ATOM 1448 N PHE A 97 67.595 31.495 45.187 1.00 0.00 N ATOM 1449 CA PHE A 97 66.836 30.982 46.338 1.00 0.00 C ATOM 1450 C PHE A 97 66.833 31.931 47.542 1.00 0.00 C ATOM 1451 O PHE A 97 67.853 32.528 47.887 1.00 0.00 O ATOM 1452 CB PHE A 97 67.356 29.603 46.769 1.00 0.00 C ATOM 1453 CG PHE A 97 66.731 28.445 46.021 1.00 0.00 C ATOM 1454 CD1 PHE A 97 67.171 28.103 44.730 1.00 0.00 C ATOM 1455 CD2 PHE A 97 65.674 27.725 46.606 1.00 0.00 C ATOM 1456 CE1 PHE A 97 66.570 27.034 44.039 1.00 0.00 C ATOM 1457 CE2 PHE A 97 65.073 26.660 45.911 1.00 0.00 C ATOM 1458 CZ PHE A 97 65.521 26.309 44.627 1.00 0.00 C ATOM 0 H PHE A 97 68.566 31.183 45.178 1.00 0.00 H new ATOM 0 HA PHE A 97 65.805 30.898 45.995 1.00 0.00 H new ATOM 0 HB2 PHE A 97 68.436 29.573 46.626 1.00 0.00 H new ATOM 0 HB3 PHE A 97 67.172 29.474 47.836 1.00 0.00 H new ATOM 0 HD1 PHE A 97 67.972 28.662 44.268 1.00 0.00 H new ATOM 0 HD2 PHE A 97 65.323 27.991 47.592 1.00 0.00 H new ATOM 0 HE1 PHE A 97 66.918 26.770 43.051 1.00 0.00 H new ATOM 0 HE2 PHE A 97 64.263 26.110 46.367 1.00 0.00 H new ATOM 0 HZ PHE A 97 65.062 25.488 44.096 1.00 0.00 H new ATOM 1468 N SER A 98 65.714 31.903 48.264 1.00 0.00 N ATOM 1469 CA SER A 98 65.466 32.507 49.580 1.00 0.00 C ATOM 1470 C SER A 98 66.548 32.223 50.639 1.00 0.00 C ATOM 1471 O SER A 98 66.868 33.090 51.447 1.00 0.00 O ATOM 1472 CB SER A 98 64.134 31.959 50.085 1.00 0.00 C ATOM 1473 OG SER A 98 64.198 30.539 50.083 1.00 0.00 O ATOM 0 H SER A 98 64.886 31.418 47.918 1.00 0.00 H new ATOM 0 HA SER A 98 65.468 33.588 49.441 1.00 0.00 H new ATOM 0 HB2 SER A 98 63.930 32.327 51.091 1.00 0.00 H new ATOM 0 HB3 SER A 98 63.318 32.302 49.449 1.00 0.00 H new ATOM 0 HG SER A 98 63.349 30.173 50.407 1.00 0.00 H new ATOM 1479 N SER A 99 67.142 31.026 50.610 1.00 0.00 N ATOM 1480 CA SER A 99 68.230 30.632 51.512 1.00 0.00 C ATOM 1481 C SER A 99 69.552 31.359 51.200 1.00 0.00 C ATOM 1482 O SER A 99 70.370 31.563 52.096 1.00 0.00 O ATOM 1483 CB SER A 99 68.381 29.110 51.493 1.00 0.00 C ATOM 1484 OG SER A 99 69.398 28.670 52.374 1.00 0.00 O ATOM 0 H SER A 99 66.878 30.294 49.951 1.00 0.00 H new ATOM 0 HA SER A 99 67.968 30.942 52.523 1.00 0.00 H new ATOM 0 HB2 SER A 99 67.434 28.648 51.772 1.00 0.00 H new ATOM 0 HB3 SER A 99 68.611 28.780 50.480 1.00 0.00 H new ATOM 0 HG SER A 99 69.464 27.693 52.336 1.00 0.00 H new ATOM 1490 N SER A 100 69.750 31.824 49.960 1.00 0.00 N ATOM 1491 CA SER A 100 70.896 32.656 49.595 1.00 0.00 C ATOM 1492 C SER A 100 70.675 34.144 49.835 1.00 0.00 C ATOM 1493 O SER A 100 71.639 34.821 50.190 1.00 0.00 O ATOM 1494 CB SER A 100 71.327 32.423 48.156 1.00 0.00 C ATOM 1495 OG SER A 100 72.602 32.993 47.911 1.00 0.00 O ATOM 0 H SER A 100 69.118 31.632 49.183 1.00 0.00 H new ATOM 0 HA SER A 100 71.696 32.340 50.264 1.00 0.00 H new ATOM 0 HB2 SER A 100 71.357 31.353 47.950 1.00 0.00 H new ATOM 0 HB3 SER A 100 70.593 32.858 47.477 1.00 0.00 H new ATOM 0 HG SER A 100 72.930 32.697 47.037 1.00 0.00 H new ATOM 1501 N LEU A 101 69.456 34.659 49.624 1.00 0.00 N ATOM 1502 CA LEU A 101 69.087 36.053 49.862 1.00 0.00 C ATOM 1503 C LEU A 101 67.582 36.342 49.813 1.00 0.00 C ATOM 1504 O LEU A 101 66.794 35.536 49.322 1.00 0.00 O ATOM 1505 CB LEU A 101 69.837 36.939 48.872 1.00 0.00 C ATOM 1506 CG LEU A 101 69.607 36.655 47.368 1.00 0.00 C ATOM 1507 CD1 LEU A 101 68.451 37.487 46.802 1.00 0.00 C ATOM 1508 CD2 LEU A 101 70.872 36.974 46.572 1.00 0.00 C ATOM 0 H LEU A 101 68.680 34.097 49.273 1.00 0.00 H new ATOM 0 HA LEU A 101 69.376 36.278 50.889 1.00 0.00 H new ATOM 0 HB2 LEU A 101 69.562 37.975 49.068 1.00 0.00 H new ATOM 0 HB3 LEU A 101 70.904 36.848 49.076 1.00 0.00 H new ATOM 0 HG LEU A 101 69.356 35.598 47.276 1.00 0.00 H new ATOM 0 HD11 LEU A 101 68.322 37.258 45.744 1.00 0.00 H new ATOM 0 HD12 LEU A 101 67.533 37.248 47.339 1.00 0.00 H new ATOM 0 HD13 LEU A 101 68.674 38.547 46.919 1.00 0.00 H new ATOM 0 HD21 LEU A 101 70.698 36.770 45.515 1.00 0.00 H new ATOM 0 HD22 LEU A 101 71.128 38.026 46.701 1.00 0.00 H new ATOM 0 HD23 LEU A 101 71.694 36.354 46.931 1.00 0.00 H new ATOM 1520 N LYS A 102 67.209 37.536 50.289 1.00 0.00 N ATOM 1521 CA LYS A 102 65.839 38.025 50.450 1.00 0.00 C ATOM 1522 C LYS A 102 65.599 39.352 49.734 1.00 0.00 C ATOM 1523 O LYS A 102 66.514 40.124 49.449 1.00 0.00 O ATOM 1524 CB LYS A 102 65.475 38.153 51.944 1.00 0.00 C ATOM 1525 CG LYS A 102 66.650 38.124 52.948 1.00 0.00 C ATOM 1526 CD LYS A 102 66.235 38.502 54.375 1.00 0.00 C ATOM 1527 CE LYS A 102 65.448 37.378 55.052 1.00 0.00 C ATOM 1528 NZ LYS A 102 64.831 37.850 56.311 1.00 0.00 N ATOM 0 H LYS A 102 67.898 38.226 50.589 1.00 0.00 H new ATOM 0 HA LYS A 102 65.189 37.285 49.984 1.00 0.00 H new ATOM 0 HB2 LYS A 102 64.931 39.087 52.083 1.00 0.00 H new ATOM 0 HB3 LYS A 102 64.790 37.344 52.198 1.00 0.00 H new ATOM 0 HG2 LYS A 102 67.088 37.126 52.956 1.00 0.00 H new ATOM 0 HG3 LYS A 102 67.426 38.810 52.609 1.00 0.00 H new ATOM 0 HD2 LYS A 102 67.123 38.730 54.964 1.00 0.00 H new ATOM 0 HD3 LYS A 102 65.628 39.407 54.350 1.00 0.00 H new ATOM 0 HE2 LYS A 102 64.674 37.013 54.377 1.00 0.00 H new ATOM 0 HE3 LYS A 102 66.111 36.538 55.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 64.303 37.070 56.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 65.574 38.176 56.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 64.182 38.636 56.106 1.00 0.00 H new ATOM 1542 N PHE A 103 64.323 39.643 49.526 1.00 0.00 N ATOM 1543 CA PHE A 103 63.820 40.881 48.972 1.00 0.00 C ATOM 1544 C PHE A 103 62.787 41.488 49.919 1.00 0.00 C ATOM 1545 O PHE A 103 61.827 40.840 50.335 1.00 0.00 O ATOM 1546 CB PHE A 103 63.228 40.602 47.597 1.00 0.00 C ATOM 1547 CG PHE A 103 63.087 41.833 46.720 1.00 0.00 C ATOM 1548 CD1 PHE A 103 64.195 42.296 45.985 1.00 0.00 C ATOM 1549 CD2 PHE A 103 61.862 42.520 46.643 1.00 0.00 C ATOM 1550 CE1 PHE A 103 64.082 43.444 45.180 1.00 0.00 C ATOM 1551 CE2 PHE A 103 61.744 43.663 45.829 1.00 0.00 C ATOM 1552 CZ PHE A 103 62.856 44.125 45.098 1.00 0.00 C ATOM 0 H PHE A 103 63.577 38.985 49.752 1.00 0.00 H new ATOM 0 HA PHE A 103 64.628 41.604 48.859 1.00 0.00 H new ATOM 0 HB2 PHE A 103 63.856 39.874 47.084 1.00 0.00 H new ATOM 0 HB3 PHE A 103 62.247 40.144 47.722 1.00 0.00 H new ATOM 0 HD1 PHE A 103 65.135 41.768 46.039 1.00 0.00 H new ATOM 0 HD2 PHE A 103 61.011 42.170 47.209 1.00 0.00 H new ATOM 0 HE1 PHE A 103 64.937 43.802 44.625 1.00 0.00 H new ATOM 0 HE2 PHE A 103 60.801 44.185 45.765 1.00 0.00 H new ATOM 0 HZ PHE A 103 62.766 45.002 44.475 1.00 0.00 H new ATOM 1562 N VAL A 104 62.999 42.743 50.263 1.00 0.00 N ATOM 1563 CA VAL A 104 62.275 43.538 51.214 1.00 0.00 C ATOM 1564 C VAL A 104 61.518 44.651 50.474 1.00 0.00 C ATOM 1565 O VAL A 104 62.105 45.680 50.116 1.00 0.00 O ATOM 1566 CB VAL A 104 63.289 44.055 52.227 1.00 0.00 C ATOM 1567 CG1 VAL A 104 63.482 43.055 53.371 1.00 0.00 C ATOM 1568 CG2 VAL A 104 64.673 44.486 51.722 1.00 0.00 C ATOM 0 H VAL A 104 63.758 43.276 49.838 1.00 0.00 H new ATOM 0 HA VAL A 104 61.517 42.967 51.751 1.00 0.00 H new ATOM 0 HB VAL A 104 62.817 44.983 52.549 1.00 0.00 H new ATOM 0 HG11 VAL A 104 64.211 43.449 54.080 1.00 0.00 H new ATOM 0 HG12 VAL A 104 62.531 42.896 53.879 1.00 0.00 H new ATOM 0 HG13 VAL A 104 63.842 42.108 52.969 1.00 0.00 H new ATOM 0 HG21 VAL A 104 65.277 44.828 52.563 1.00 0.00 H new ATOM 0 HG22 VAL A 104 65.165 43.640 51.243 1.00 0.00 H new ATOM 0 HG23 VAL A 104 64.561 45.296 51.002 1.00 0.00 H new ATOM 1578 N PRO A 105 60.223 44.454 50.165 1.00 0.00 N ATOM 1579 CA PRO A 105 59.448 45.444 49.434 1.00 0.00 C ATOM 1580 C PRO A 105 58.987 46.604 50.325 1.00 0.00 C ATOM 1581 O PRO A 105 58.860 46.472 51.546 1.00 0.00 O ATOM 1582 CB PRO A 105 58.281 44.670 48.815 1.00 0.00 C ATOM 1583 CG PRO A 105 58.036 43.551 49.827 1.00 0.00 C ATOM 1584 CD PRO A 105 59.438 43.238 50.353 1.00 0.00 C ATOM 0 HA PRO A 105 60.048 45.931 48.665 1.00 0.00 H new ATOM 0 HB2 PRO A 105 57.401 45.300 48.689 1.00 0.00 H new ATOM 0 HB3 PRO A 105 58.535 44.276 47.831 1.00 0.00 H new ATOM 0 HG2 PRO A 105 57.369 43.871 50.627 1.00 0.00 H new ATOM 0 HG3 PRO A 105 57.578 42.679 49.360 1.00 0.00 H new ATOM 0 HD2 PRO A 105 59.405 42.954 51.405 1.00 0.00 H new ATOM 0 HD3 PRO A 105 59.880 42.402 49.811 1.00 0.00 H new ATOM 1592 N LYS A 106 58.688 47.749 49.698 1.00 0.00 N ATOM 1593 CA LYS A 106 58.035 48.896 50.280 1.00 0.00 C ATOM 1594 C LYS A 106 56.687 48.539 50.927 1.00 0.00 C ATOM 1595 O LYS A 106 56.088 47.496 50.673 1.00 0.00 O ATOM 1596 CB LYS A 106 57.830 49.874 49.135 1.00 0.00 C ATOM 1597 CG LYS A 106 59.072 50.473 48.451 1.00 0.00 C ATOM 1598 CD LYS A 106 59.806 51.520 49.309 1.00 0.00 C ATOM 1599 CE LYS A 106 60.980 52.162 48.555 1.00 0.00 C ATOM 1600 NZ LYS A 106 60.540 53.031 47.436 1.00 0.00 N ATOM 0 H LYS A 106 58.915 47.893 48.714 1.00 0.00 H new ATOM 0 HA LYS A 106 58.644 49.314 51.082 1.00 0.00 H new ATOM 0 HB2 LYS A 106 57.241 49.370 48.369 1.00 0.00 H new ATOM 0 HB3 LYS A 106 57.226 50.701 49.509 1.00 0.00 H new ATOM 0 HG2 LYS A 106 59.764 49.668 48.205 1.00 0.00 H new ATOM 0 HG3 LYS A 106 58.771 50.933 47.510 1.00 0.00 H new ATOM 0 HD2 LYS A 106 59.103 52.296 49.614 1.00 0.00 H new ATOM 0 HD3 LYS A 106 60.175 51.048 50.220 1.00 0.00 H new ATOM 0 HE2 LYS A 106 61.576 52.750 49.253 1.00 0.00 H new ATOM 0 HE3 LYS A 106 61.628 51.377 48.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 61.365 53.516 47.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 60.083 52.450 46.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 59.863 53.737 47.790 1.00 0.00 H new