USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=30 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 58 CYS SG : rot 180:sc= -1.21 USER MOD Set 1.2: A 68 LYS NZ :NH3+ -144:sc= 1.29 (180deg=0.821) USER MOD Set 2.1: A 54 SER OG : rot 72:sc= 1.28 USER MOD Set 2.2: A 73 LYS NZ :NH3+ 166:sc= 0.791 (180deg=0) USER MOD Set 3.1: A 39 HIS : no HE2:sc= 0.494 K(o=1.8,f=-2.5!) USER MOD Set 3.2: A 41 SER OG : rot 79:sc= 1.32 USER MOD Set 4.1: A 37 TYR OH : rot 30:sc= 0.122 USER MOD Set 4.2: A 47 THR OG1 : rot -152:sc= 1.16 USER MOD Set 5.1: A 33 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 34 HIS : no HD1:sc= -0.113 K(o=-0.11,f=0.4) USER MOD Set 6.1: A 23 CYS SG : rot -169:sc= 2.97 USER MOD Set 6.2: A 26 CYS SG : rot 180:sc= 0.00129 USER MOD Set 6.3: A 71 CYS SG : rot -135:sc= -0.999! USER MOD Set 6.4: A 74 CYS SG : rot -34:sc= -2.02! USER MOD Single : A 21 TYR OH : rot 110:sc= -0.192 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot -37:sc= 0.567 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0.067 USER MOD Single : A 35 SER OG : rot 84:sc= 0.512 USER MOD Single : A 36 LYS NZ :NH3+ 170:sc= 1.05 (180deg=0.925) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -100:sc= 1.2 USER MOD Single : A 51 HIS : no HE2:sc= 0.424 K(o=0.42,f=-2.1!) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.932 K(o=-0.93,f=-3.1!) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= -1.34 K(o=-1.3,f=-4.5) USER MOD Single : A 80 HIS : no HE2:sc= 0.315 K(o=0.31,f=-8.1!) USER MOD Single : A 84 ASN : amide:sc= 0.00468 X(o=0.0047,f=-0.0039) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0.751 K(o=0.75,f=-5.8!) USER MOD Single : A 92 SER OG : rot -73:sc= 1.41 USER MOD Single : A 95 CYS SG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0.0074 USER MOD Single : A 99 SER OG : rot -45:sc= 0.0503 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 261 N PRO A 18 57.310 48.360 45.198 1.00 0.00 N ATOM 262 CA PRO A 18 58.742 48.656 45.174 1.00 0.00 C ATOM 263 C PRO A 18 59.483 48.275 46.463 1.00 0.00 C ATOM 264 O PRO A 18 58.925 48.216 47.559 1.00 0.00 O ATOM 265 CB PRO A 18 58.850 50.155 44.883 1.00 0.00 C ATOM 266 CG PRO A 18 57.562 50.705 45.487 1.00 0.00 C ATOM 267 CD PRO A 18 56.551 49.603 45.183 1.00 0.00 C ATOM 0 HA PRO A 18 59.230 48.050 44.411 1.00 0.00 H new ATOM 0 HB2 PRO A 18 59.734 50.595 45.344 1.00 0.00 H new ATOM 0 HB3 PRO A 18 58.915 50.357 43.814 1.00 0.00 H new ATOM 0 HG2 PRO A 18 57.660 50.880 46.558 1.00 0.00 H new ATOM 0 HG3 PRO A 18 57.275 51.654 45.034 1.00 0.00 H new ATOM 0 HD2 PRO A 18 55.755 49.585 45.927 1.00 0.00 H new ATOM 0 HD3 PRO A 18 56.078 49.762 44.214 1.00 0.00 H new ATOM 275 N GLY A 19 60.792 48.065 46.334 1.00 0.00 N ATOM 276 CA GLY A 19 61.646 47.592 47.417 1.00 0.00 C ATOM 277 C GLY A 19 63.091 47.360 46.995 1.00 0.00 C ATOM 278 O GLY A 19 63.524 47.814 45.932 1.00 0.00 O ATOM 0 H GLY A 19 61.294 48.222 45.460 1.00 0.00 H new ATOM 0 HA2 GLY A 19 61.625 48.319 48.229 1.00 0.00 H new ATOM 0 HA3 GLY A 19 61.237 46.662 47.811 1.00 0.00 H new ATOM 282 N VAL A 20 63.825 46.657 47.853 1.00 0.00 N ATOM 283 CA VAL A 20 65.258 46.350 47.714 1.00 0.00 C ATOM 284 C VAL A 20 65.513 44.870 48.039 1.00 0.00 C ATOM 285 O VAL A 20 64.677 44.206 48.658 1.00 0.00 O ATOM 286 CB VAL A 20 66.111 47.253 48.626 1.00 0.00 C ATOM 287 CG1 VAL A 20 67.554 47.412 48.117 1.00 0.00 C ATOM 288 CG2 VAL A 20 65.556 48.676 48.829 1.00 0.00 C ATOM 0 H VAL A 20 63.425 46.265 48.705 1.00 0.00 H new ATOM 0 HA VAL A 20 65.550 46.544 46.682 1.00 0.00 H new ATOM 0 HB VAL A 20 66.082 46.722 49.578 1.00 0.00 H new ATOM 0 HG11 VAL A 20 68.110 48.058 48.797 1.00 0.00 H new ATOM 0 HG12 VAL A 20 68.033 46.434 48.071 1.00 0.00 H new ATOM 0 HG13 VAL A 20 67.542 47.857 47.122 1.00 0.00 H new ATOM 0 HG21 VAL A 20 66.223 49.237 49.484 1.00 0.00 H new ATOM 0 HG22 VAL A 20 65.486 49.180 47.865 1.00 0.00 H new ATOM 0 HG23 VAL A 20 64.566 48.619 49.281 1.00 0.00 H new ATOM 298 N TYR A 21 66.680 44.350 47.653 1.00 0.00 N ATOM 299 CA TYR A 21 67.102 42.985 47.977 1.00 0.00 C ATOM 300 C TYR A 21 68.336 43.005 48.879 1.00 0.00 C ATOM 301 O TYR A 21 69.196 43.878 48.730 1.00 0.00 O ATOM 302 CB TYR A 21 67.352 42.190 46.693 1.00 0.00 C ATOM 303 CG TYR A 21 66.111 42.005 45.836 1.00 0.00 C ATOM 304 CD1 TYR A 21 65.134 41.061 46.210 1.00 0.00 C ATOM 305 CD2 TYR A 21 65.919 42.792 44.683 1.00 0.00 C ATOM 306 CE1 TYR A 21 63.965 40.907 45.438 1.00 0.00 C ATOM 307 CE2 TYR A 21 64.757 42.637 43.904 1.00 0.00 C ATOM 308 CZ TYR A 21 63.775 41.698 44.282 1.00 0.00 C ATOM 309 OH TYR A 21 62.645 41.563 43.537 1.00 0.00 O ATOM 0 H TYR A 21 67.364 44.868 47.102 1.00 0.00 H new ATOM 0 HA TYR A 21 66.303 42.487 48.527 1.00 0.00 H new ATOM 0 HB2 TYR A 21 68.116 42.698 46.105 1.00 0.00 H new ATOM 0 HB3 TYR A 21 67.751 41.210 46.955 1.00 0.00 H new ATOM 0 HD1 TYR A 21 65.281 40.454 47.091 1.00 0.00 H new ATOM 0 HD2 TYR A 21 66.666 43.517 44.396 1.00 0.00 H new ATOM 0 HE1 TYR A 21 63.216 40.186 45.729 1.00 0.00 H new ATOM 0 HE2 TYR A 21 64.617 43.237 43.017 1.00 0.00 H new ATOM 0 HH TYR A 21 62.087 42.362 43.641 1.00 0.00 H new ATOM 319 N VAL A 22 68.421 42.059 49.817 1.00 0.00 N ATOM 320 CA VAL A 22 69.517 41.980 50.798 1.00 0.00 C ATOM 321 C VAL A 22 69.959 40.542 51.019 1.00 0.00 C ATOM 322 O VAL A 22 69.160 39.620 50.863 1.00 0.00 O ATOM 323 CB VAL A 22 69.180 42.643 52.150 1.00 0.00 C ATOM 324 CG1 VAL A 22 68.271 43.873 52.016 1.00 0.00 C ATOM 325 CG2 VAL A 22 68.466 41.731 53.162 1.00 0.00 C ATOM 0 H VAL A 22 67.728 41.318 49.922 1.00 0.00 H new ATOM 0 HA VAL A 22 70.340 42.547 50.362 1.00 0.00 H new ATOM 0 HB VAL A 22 70.174 42.906 52.512 1.00 0.00 H new ATOM 0 HG11 VAL A 22 68.074 44.289 53.004 1.00 0.00 H new ATOM 0 HG12 VAL A 22 68.763 44.623 51.397 1.00 0.00 H new ATOM 0 HG13 VAL A 22 67.329 43.581 51.551 1.00 0.00 H new ATOM 0 HG21 VAL A 22 68.272 42.287 54.079 1.00 0.00 H new ATOM 0 HG22 VAL A 22 67.522 41.388 52.739 1.00 0.00 H new ATOM 0 HG23 VAL A 22 69.097 40.871 53.386 1.00 0.00 H new ATOM 335 N CYS A 23 71.207 40.342 51.432 1.00 0.00 N ATOM 336 CA CYS A 23 71.770 38.997 51.496 1.00 0.00 C ATOM 337 C CYS A 23 71.044 38.101 52.526 1.00 0.00 C ATOM 338 O CYS A 23 70.696 38.538 53.627 1.00 0.00 O ATOM 339 CB CYS A 23 73.287 39.088 51.697 1.00 0.00 C ATOM 340 SG CYS A 23 74.007 37.426 51.602 1.00 0.00 S ATOM 0 H CYS A 23 71.842 41.085 51.724 1.00 0.00 H new ATOM 0 HA CYS A 23 71.601 38.491 50.546 1.00 0.00 H new ATOM 0 HB2 CYS A 23 73.728 39.732 50.936 1.00 0.00 H new ATOM 0 HB3 CYS A 23 73.511 39.539 52.664 1.00 0.00 H new ATOM 0 HG CYS A 23 75.245 37.466 51.997 1.00 0.00 H new ATOM 345 N ALA A 24 70.878 36.821 52.180 1.00 0.00 N ATOM 346 CA ALA A 24 70.335 35.819 53.098 1.00 0.00 C ATOM 347 C ALA A 24 71.297 35.508 54.268 1.00 0.00 C ATOM 348 O ALA A 24 70.877 34.940 55.280 1.00 0.00 O ATOM 349 CB ALA A 24 69.979 34.537 52.340 1.00 0.00 C ATOM 0 H ALA A 24 71.116 36.453 51.259 1.00 0.00 H new ATOM 0 HA ALA A 24 69.429 36.240 53.534 1.00 0.00 H new ATOM 0 HB1 ALA A 24 69.577 33.802 53.037 1.00 0.00 H new ATOM 0 HB2 ALA A 24 69.233 34.760 51.577 1.00 0.00 H new ATOM 0 HB3 ALA A 24 70.874 34.135 51.865 1.00 0.00 H new ATOM 355 N LYS A 25 72.578 35.875 54.132 1.00 0.00 N ATOM 356 CA LYS A 25 73.676 35.636 55.082 1.00 0.00 C ATOM 357 C LYS A 25 74.243 36.932 55.652 1.00 0.00 C ATOM 358 O LYS A 25 74.450 37.045 56.864 1.00 0.00 O ATOM 359 CB LYS A 25 74.764 34.838 54.345 1.00 0.00 C ATOM 360 CG LYS A 25 75.169 33.543 55.057 1.00 0.00 C ATOM 361 CD LYS A 25 76.129 33.756 56.229 1.00 0.00 C ATOM 362 CE LYS A 25 77.133 32.601 56.385 1.00 0.00 C ATOM 363 NZ LYS A 25 76.536 31.369 56.954 1.00 0.00 N ATOM 0 H LYS A 25 72.897 36.378 53.304 1.00 0.00 H new ATOM 0 HA LYS A 25 73.297 35.075 55.936 1.00 0.00 H new ATOM 0 HB2 LYS A 25 74.408 34.595 53.344 1.00 0.00 H new ATOM 0 HB3 LYS A 25 75.646 35.468 54.226 1.00 0.00 H new ATOM 0 HG2 LYS A 25 74.271 33.044 55.421 1.00 0.00 H new ATOM 0 HG3 LYS A 25 75.635 32.873 54.335 1.00 0.00 H new ATOM 0 HD2 LYS A 25 76.673 34.689 56.084 1.00 0.00 H new ATOM 0 HD3 LYS A 25 75.555 33.862 57.150 1.00 0.00 H new ATOM 0 HE2 LYS A 25 77.563 32.370 55.410 1.00 0.00 H new ATOM 0 HE3 LYS A 25 77.953 32.927 57.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 77.267 30.633 57.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 76.150 31.574 57.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 75.772 31.034 56.333 1.00 0.00 H new ATOM 377 N CYS A 26 74.461 37.902 54.773 1.00 0.00 N ATOM 378 CA CYS A 26 75.185 39.127 55.047 1.00 0.00 C ATOM 379 C CYS A 26 74.262 40.313 55.402 1.00 0.00 C ATOM 380 O CYS A 26 74.725 41.287 55.992 1.00 0.00 O ATOM 381 CB CYS A 26 76.130 39.380 53.855 1.00 0.00 C ATOM 382 SG CYS A 26 76.931 37.877 53.221 1.00 0.00 S ATOM 0 H CYS A 26 74.123 37.850 53.812 1.00 0.00 H new ATOM 0 HA CYS A 26 75.784 39.020 55.952 1.00 0.00 H new ATOM 0 HB2 CYS A 26 75.565 39.847 53.048 1.00 0.00 H new ATOM 0 HB3 CYS A 26 76.899 40.090 54.158 1.00 0.00 H new ATOM 0 HG CYS A 26 77.703 38.185 52.221 1.00 0.00 H new ATOM 387 N SER A 27 72.984 40.231 55.006 1.00 0.00 N ATOM 388 CA SER A 27 71.916 41.234 55.200 1.00 0.00 C ATOM 389 C SER A 27 72.181 42.613 54.583 1.00 0.00 C ATOM 390 O SER A 27 71.360 43.518 54.702 1.00 0.00 O ATOM 391 CB SER A 27 71.467 41.321 56.667 1.00 0.00 C ATOM 392 OG SER A 27 72.333 42.154 57.412 1.00 0.00 O ATOM 0 H SER A 27 72.642 39.409 54.508 1.00 0.00 H new ATOM 0 HA SER A 27 71.080 40.850 54.616 1.00 0.00 H new ATOM 0 HB2 SER A 27 70.450 41.710 56.718 1.00 0.00 H new ATOM 0 HB3 SER A 27 71.449 40.323 57.106 1.00 0.00 H new ATOM 0 HG SER A 27 73.254 42.031 57.100 1.00 0.00 H new ATOM 398 N TYR A 28 73.306 42.766 53.882 1.00 0.00 N ATOM 399 CA TYR A 28 73.705 44.009 53.236 1.00 0.00 C ATOM 400 C TYR A 28 72.870 44.243 51.975 1.00 0.00 C ATOM 401 O TYR A 28 72.630 43.303 51.211 1.00 0.00 O ATOM 402 CB TYR A 28 75.208 44.001 52.973 1.00 0.00 C ATOM 403 CG TYR A 28 75.810 45.268 52.381 1.00 0.00 C ATOM 404 CD1 TYR A 28 75.441 46.541 52.866 1.00 0.00 C ATOM 405 CD2 TYR A 28 76.806 45.166 51.388 1.00 0.00 C ATOM 406 CE1 TYR A 28 76.054 47.702 52.355 1.00 0.00 C ATOM 407 CE2 TYR A 28 77.438 46.325 50.893 1.00 0.00 C ATOM 408 CZ TYR A 28 77.063 47.597 51.376 1.00 0.00 C ATOM 409 OH TYR A 28 77.688 48.713 50.914 1.00 0.00 O ATOM 0 H TYR A 28 73.977 42.010 53.747 1.00 0.00 H new ATOM 0 HA TYR A 28 73.507 44.853 53.897 1.00 0.00 H new ATOM 0 HB2 TYR A 28 75.716 43.792 53.914 1.00 0.00 H new ATOM 0 HB3 TYR A 28 75.430 43.173 52.300 1.00 0.00 H new ATOM 0 HD1 TYR A 28 74.685 46.626 53.633 1.00 0.00 H new ATOM 0 HD2 TYR A 28 77.086 44.196 51.005 1.00 0.00 H new ATOM 0 HE1 TYR A 28 75.750 48.674 52.714 1.00 0.00 H new ATOM 0 HE2 TYR A 28 78.210 46.239 50.143 1.00 0.00 H new ATOM 0 HH TYR A 28 78.357 48.460 50.244 1.00 0.00 H new ATOM 419 N GLU A 29 72.392 45.470 51.755 1.00 0.00 N ATOM 420 CA GLU A 29 71.412 45.728 50.704 1.00 0.00 C ATOM 421 C GLU A 29 72.098 45.948 49.359 1.00 0.00 C ATOM 422 O GLU A 29 72.881 46.890 49.177 1.00 0.00 O ATOM 423 CB GLU A 29 70.461 46.874 51.070 1.00 0.00 C ATOM 424 CG GLU A 29 69.962 46.799 52.524 1.00 0.00 C ATOM 425 CD GLU A 29 70.763 47.668 53.502 1.00 0.00 C ATOM 426 OE1 GLU A 29 71.841 48.206 53.143 1.00 0.00 O ATOM 427 OE2 GLU A 29 70.279 47.861 54.637 1.00 0.00 O ATOM 0 H GLU A 29 72.667 46.295 52.289 1.00 0.00 H new ATOM 0 HA GLU A 29 70.789 44.839 50.608 1.00 0.00 H new ATOM 0 HB2 GLU A 29 70.970 47.825 50.915 1.00 0.00 H new ATOM 0 HB3 GLU A 29 69.604 46.857 50.396 1.00 0.00 H new ATOM 0 HG2 GLU A 29 68.916 47.104 52.555 1.00 0.00 H new ATOM 0 HG3 GLU A 29 70.002 45.762 52.858 1.00 0.00 H new ATOM 434 N LEU A 30 71.817 45.059 48.406 1.00 0.00 N ATOM 435 CA LEU A 30 72.443 45.066 47.094 1.00 0.00 C ATOM 436 C LEU A 30 71.543 44.431 46.019 1.00 0.00 C ATOM 437 O LEU A 30 71.182 43.256 46.044 1.00 0.00 O ATOM 438 CB LEU A 30 73.860 44.462 47.202 1.00 0.00 C ATOM 439 CG LEU A 30 73.911 42.972 47.596 1.00 0.00 C ATOM 440 CD1 LEU A 30 74.121 42.121 46.347 1.00 0.00 C ATOM 441 CD2 LEU A 30 75.063 42.689 48.562 1.00 0.00 C ATOM 0 H LEU A 30 71.139 44.307 48.530 1.00 0.00 H new ATOM 0 HA LEU A 30 72.567 46.092 46.746 1.00 0.00 H new ATOM 0 HB2 LEU A 30 74.364 44.585 46.243 1.00 0.00 H new ATOM 0 HB3 LEU A 30 74.427 45.035 47.936 1.00 0.00 H new ATOM 0 HG LEU A 30 72.967 42.726 48.083 1.00 0.00 H new ATOM 0 HD11 LEU A 30 74.157 41.068 46.626 1.00 0.00 H new ATOM 0 HD12 LEU A 30 73.297 42.284 45.653 1.00 0.00 H new ATOM 0 HD13 LEU A 30 75.059 42.402 45.869 1.00 0.00 H new ATOM 0 HD21 LEU A 30 75.070 41.630 48.819 1.00 0.00 H new ATOM 0 HD22 LEU A 30 76.008 42.954 48.088 1.00 0.00 H new ATOM 0 HD23 LEU A 30 74.932 43.282 49.468 1.00 0.00 H new ATOM 453 N PHE A 31 71.213 45.273 45.049 1.00 0.00 N ATOM 454 CA PHE A 31 70.680 45.016 43.711 1.00 0.00 C ATOM 455 C PHE A 31 70.776 46.323 42.893 1.00 0.00 C ATOM 456 O PHE A 31 70.525 47.398 43.442 1.00 0.00 O ATOM 457 CB PHE A 31 69.227 44.532 43.787 1.00 0.00 C ATOM 458 CG PHE A 31 68.743 43.919 42.490 1.00 0.00 C ATOM 459 CD1 PHE A 31 69.171 42.630 42.120 1.00 0.00 C ATOM 460 CD2 PHE A 31 67.887 44.640 41.642 1.00 0.00 C ATOM 461 CE1 PHE A 31 68.769 42.076 40.893 1.00 0.00 C ATOM 462 CE2 PHE A 31 67.494 44.093 40.409 1.00 0.00 C ATOM 463 CZ PHE A 31 67.939 42.812 40.033 1.00 0.00 C ATOM 0 H PHE A 31 71.325 46.276 45.197 1.00 0.00 H new ATOM 0 HA PHE A 31 71.260 44.230 43.227 1.00 0.00 H new ATOM 0 HB2 PHE A 31 69.135 43.797 44.587 1.00 0.00 H new ATOM 0 HB3 PHE A 31 68.583 45.371 44.049 1.00 0.00 H new ATOM 0 HD1 PHE A 31 69.811 42.065 42.782 1.00 0.00 H new ATOM 0 HD2 PHE A 31 67.530 45.616 41.938 1.00 0.00 H new ATOM 0 HE1 PHE A 31 69.098 41.086 40.612 1.00 0.00 H new ATOM 0 HE2 PHE A 31 66.850 44.656 39.749 1.00 0.00 H new ATOM 0 HZ PHE A 31 67.642 42.395 39.082 1.00 0.00 H new ATOM 473 N SER A 32 71.136 46.282 41.604 1.00 0.00 N ATOM 474 CA SER A 32 71.062 47.480 40.744 1.00 0.00 C ATOM 475 C SER A 32 69.621 47.769 40.322 1.00 0.00 C ATOM 476 O SER A 32 68.859 46.869 39.966 1.00 0.00 O ATOM 477 CB SER A 32 71.996 47.385 39.529 1.00 0.00 C ATOM 478 OG SER A 32 71.725 48.389 38.562 1.00 0.00 O ATOM 0 H SER A 32 71.478 45.444 41.133 1.00 0.00 H new ATOM 0 HA SER A 32 71.412 48.322 41.341 1.00 0.00 H new ATOM 0 HB2 SER A 32 73.031 47.473 39.861 1.00 0.00 H new ATOM 0 HB3 SER A 32 71.891 46.402 39.069 1.00 0.00 H new ATOM 0 HG SER A 32 72.343 48.292 37.808 1.00 0.00 H new ATOM 484 N SER A 33 69.249 49.046 40.292 1.00 0.00 N ATOM 485 CA SER A 33 67.910 49.480 39.861 1.00 0.00 C ATOM 486 C SER A 33 67.613 49.173 38.385 1.00 0.00 C ATOM 487 O SER A 33 66.454 49.211 37.977 1.00 0.00 O ATOM 488 CB SER A 33 67.727 50.976 40.136 1.00 0.00 C ATOM 489 OG SER A 33 68.752 51.712 39.499 1.00 0.00 O ATOM 0 H SER A 33 69.862 49.814 40.564 1.00 0.00 H new ATOM 0 HA SER A 33 67.195 48.902 40.446 1.00 0.00 H new ATOM 0 HB2 SER A 33 66.753 51.305 39.774 1.00 0.00 H new ATOM 0 HB3 SER A 33 67.747 51.162 41.210 1.00 0.00 H new ATOM 0 HG SER A 33 68.628 52.668 39.678 1.00 0.00 H new ATOM 495 N HIS A 34 68.631 48.844 37.581 1.00 0.00 N ATOM 496 CA HIS A 34 68.522 48.613 36.133 1.00 0.00 C ATOM 497 C HIS A 34 68.396 47.133 35.731 1.00 0.00 C ATOM 498 O HIS A 34 68.062 46.827 34.588 1.00 0.00 O ATOM 499 CB HIS A 34 69.750 49.237 35.455 1.00 0.00 C ATOM 500 CG HIS A 34 69.989 50.708 35.727 1.00 0.00 C ATOM 501 ND1 HIS A 34 71.148 51.395 35.448 1.00 0.00 N ATOM 502 CD2 HIS A 34 69.117 51.618 36.267 1.00 0.00 C ATOM 503 CE1 HIS A 34 70.983 52.679 35.806 1.00 0.00 C ATOM 504 NE2 HIS A 34 69.767 52.856 36.354 1.00 0.00 N ATOM 0 H HIS A 34 69.583 48.727 37.929 1.00 0.00 H new ATOM 0 HA HIS A 34 67.594 49.080 35.803 1.00 0.00 H new ATOM 0 HB2 HIS A 34 70.634 48.682 35.770 1.00 0.00 H new ATOM 0 HB3 HIS A 34 69.654 49.099 34.378 1.00 0.00 H new ATOM 0 HD2 HIS A 34 68.101 51.415 36.573 1.00 0.00 H new ATOM 0 HE1 HIS A 34 71.720 53.457 35.673 1.00 0.00 H new ATOM 0 HE2 HIS A 34 69.394 53.718 36.752 1.00 0.00 H new ATOM 512 N SER A 35 68.673 46.209 36.653 1.00 0.00 N ATOM 513 CA SER A 35 68.788 44.778 36.417 1.00 0.00 C ATOM 514 C SER A 35 67.453 44.033 36.432 1.00 0.00 C ATOM 515 O SER A 35 67.381 42.892 35.985 1.00 0.00 O ATOM 516 CB SER A 35 69.799 44.129 37.374 1.00 0.00 C ATOM 517 OG SER A 35 70.103 44.865 38.545 1.00 0.00 O ATOM 0 H SER A 35 68.830 46.456 37.630 1.00 0.00 H new ATOM 0 HA SER A 35 69.165 44.684 35.399 1.00 0.00 H new ATOM 0 HB2 SER A 35 69.414 43.153 37.671 1.00 0.00 H new ATOM 0 HB3 SER A 35 70.726 43.953 36.828 1.00 0.00 H new ATOM 0 HG SER A 35 69.428 44.681 39.231 1.00 0.00 H new ATOM 523 N LYS A 36 66.398 44.675 36.946 1.00 0.00 N ATOM 524 CA LYS A 36 65.019 44.149 36.926 1.00 0.00 C ATOM 525 C LYS A 36 64.007 45.208 36.493 1.00 0.00 C ATOM 526 O LYS A 36 64.196 46.401 36.739 1.00 0.00 O ATOM 527 CB LYS A 36 64.634 43.543 38.292 1.00 0.00 C ATOM 528 CG LYS A 36 63.517 42.488 38.179 1.00 0.00 C ATOM 529 CD LYS A 36 63.090 41.903 39.534 1.00 0.00 C ATOM 530 CE LYS A 36 62.204 42.859 40.348 1.00 0.00 C ATOM 531 NZ LYS A 36 60.866 43.039 39.729 1.00 0.00 N ATOM 0 H LYS A 36 66.474 45.588 37.395 1.00 0.00 H new ATOM 0 HA LYS A 36 64.992 43.354 36.181 1.00 0.00 H new ATOM 0 HB2 LYS A 36 65.515 43.087 38.744 1.00 0.00 H new ATOM 0 HB3 LYS A 36 64.309 44.340 38.960 1.00 0.00 H new ATOM 0 HG2 LYS A 36 62.650 42.939 37.697 1.00 0.00 H new ATOM 0 HG3 LYS A 36 63.856 41.678 37.533 1.00 0.00 H new ATOM 0 HD2 LYS A 36 62.551 40.970 39.367 1.00 0.00 H new ATOM 0 HD3 LYS A 36 63.980 41.658 40.114 1.00 0.00 H new ATOM 0 HE2 LYS A 36 62.086 42.471 41.360 1.00 0.00 H new ATOM 0 HE3 LYS A 36 62.698 43.827 40.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 60.244 43.550 40.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 60.961 43.585 38.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 60.454 42.108 39.516 1.00 0.00 H new ATOM 545 N TYR A 37 62.903 44.734 35.923 1.00 0.00 N ATOM 546 CA TYR A 37 61.747 45.549 35.529 1.00 0.00 C ATOM 547 C TYR A 37 60.492 45.177 36.338 1.00 0.00 C ATOM 548 O TYR A 37 60.530 44.322 37.231 1.00 0.00 O ATOM 549 CB TYR A 37 61.578 45.499 33.997 1.00 0.00 C ATOM 550 CG TYR A 37 62.896 45.669 33.252 1.00 0.00 C ATOM 551 CD1 TYR A 37 63.764 46.730 33.586 1.00 0.00 C ATOM 552 CD2 TYR A 37 63.321 44.685 32.338 1.00 0.00 C ATOM 553 CE1 TYR A 37 65.096 46.728 33.130 1.00 0.00 C ATOM 554 CE2 TYR A 37 64.635 44.715 31.836 1.00 0.00 C ATOM 555 CZ TYR A 37 65.545 45.693 32.286 1.00 0.00 C ATOM 556 OH TYR A 37 66.856 45.606 31.941 1.00 0.00 O ATOM 0 H TYR A 37 62.780 43.743 35.714 1.00 0.00 H new ATOM 0 HA TYR A 37 61.921 46.595 35.781 1.00 0.00 H new ATOM 0 HB2 TYR A 37 61.128 44.547 33.717 1.00 0.00 H new ATOM 0 HB3 TYR A 37 60.887 46.282 33.686 1.00 0.00 H new ATOM 0 HD1 TYR A 37 63.405 47.547 34.194 1.00 0.00 H new ATOM 0 HD2 TYR A 37 62.639 43.909 32.023 1.00 0.00 H new ATOM 0 HE1 TYR A 37 65.771 47.517 33.426 1.00 0.00 H new ATOM 0 HE2 TYR A 37 64.948 43.986 31.103 1.00 0.00 H new ATOM 0 HH TYR A 37 67.409 45.969 32.664 1.00 0.00 H new ATOM 566 N ALA A 38 59.403 45.892 36.079 1.00 0.00 N ATOM 567 CA ALA A 38 58.123 45.773 36.780 1.00 0.00 C ATOM 568 C ALA A 38 57.086 44.981 35.961 1.00 0.00 C ATOM 569 O ALA A 38 56.816 45.304 34.807 1.00 0.00 O ATOM 570 CB ALA A 38 57.628 47.179 37.134 1.00 0.00 C ATOM 0 H ALA A 38 59.384 46.600 35.345 1.00 0.00 H new ATOM 0 HA ALA A 38 58.267 45.202 37.697 1.00 0.00 H new ATOM 0 HB1 ALA A 38 56.674 47.108 37.657 1.00 0.00 H new ATOM 0 HB2 ALA A 38 58.359 47.671 37.776 1.00 0.00 H new ATOM 0 HB3 ALA A 38 57.498 47.760 36.221 1.00 0.00 H new ATOM 576 N HIS A 39 56.507 43.942 36.570 1.00 0.00 N ATOM 577 CA HIS A 39 55.454 43.099 35.998 1.00 0.00 C ATOM 578 C HIS A 39 54.726 42.343 37.123 1.00 0.00 C ATOM 579 O HIS A 39 55.322 42.112 38.180 1.00 0.00 O ATOM 580 CB HIS A 39 56.091 42.106 35.006 1.00 0.00 C ATOM 581 CG HIS A 39 55.129 41.521 34.003 1.00 0.00 C ATOM 582 ND1 HIS A 39 54.841 40.187 33.820 1.00 0.00 N ATOM 583 CD2 HIS A 39 54.474 42.211 33.016 1.00 0.00 C ATOM 584 CE1 HIS A 39 54.043 40.077 32.744 1.00 0.00 C ATOM 585 NE2 HIS A 39 53.780 41.288 32.225 1.00 0.00 N ATOM 0 H HIS A 39 56.770 43.654 37.513 1.00 0.00 H new ATOM 0 HA HIS A 39 54.727 43.717 35.471 1.00 0.00 H new ATOM 0 HB2 HIS A 39 56.893 42.612 34.469 1.00 0.00 H new ATOM 0 HB3 HIS A 39 56.549 41.293 35.569 1.00 0.00 H new ATOM 0 HD1 HIS A 39 55.175 39.417 34.400 1.00 0.00 H new ATOM 0 HD2 HIS A 39 54.491 43.281 32.873 1.00 0.00 H new ATOM 0 HE1 HIS A 39 53.666 39.144 32.351 1.00 0.00 H new ATOM 593 N SER A 40 53.477 41.920 36.909 1.00 0.00 N ATOM 594 CA SER A 40 52.753 41.012 37.797 1.00 0.00 C ATOM 595 C SER A 40 52.331 39.731 37.072 1.00 0.00 C ATOM 596 O SER A 40 51.399 39.734 36.267 1.00 0.00 O ATOM 597 CB SER A 40 51.592 41.716 38.477 1.00 0.00 C ATOM 598 OG SER A 40 51.285 41.037 39.674 1.00 0.00 O ATOM 0 H SER A 40 52.931 42.206 36.096 1.00 0.00 H new ATOM 0 HA SER A 40 53.435 40.702 38.589 1.00 0.00 H new ATOM 0 HB2 SER A 40 51.851 42.753 38.688 1.00 0.00 H new ATOM 0 HB3 SER A 40 50.723 41.732 37.819 1.00 0.00 H new ATOM 0 HG SER A 40 50.537 41.485 40.122 1.00 0.00 H new ATOM 604 N SER A 41 53.052 38.636 37.314 1.00 0.00 N ATOM 605 CA SER A 41 52.892 37.351 36.619 1.00 0.00 C ATOM 606 C SER A 41 53.508 36.195 37.421 1.00 0.00 C ATOM 607 O SER A 41 54.311 36.444 38.325 1.00 0.00 O ATOM 608 CB SER A 41 53.566 37.422 35.235 1.00 0.00 C ATOM 609 OG SER A 41 54.966 37.646 35.317 1.00 0.00 O ATOM 0 H SER A 41 53.787 38.614 38.021 1.00 0.00 H new ATOM 0 HA SER A 41 51.824 37.162 36.510 1.00 0.00 H new ATOM 0 HB2 SER A 41 53.382 36.491 34.698 1.00 0.00 H new ATOM 0 HB3 SER A 41 53.108 38.222 34.653 1.00 0.00 H new ATOM 0 HG SER A 41 55.419 36.805 35.537 1.00 0.00 H new ATOM 615 N PRO A 42 53.228 34.927 37.061 1.00 0.00 N ATOM 616 CA PRO A 42 54.148 33.825 37.350 1.00 0.00 C ATOM 617 C PRO A 42 55.560 34.071 36.770 1.00 0.00 C ATOM 618 O PRO A 42 55.789 35.007 35.998 1.00 0.00 O ATOM 619 CB PRO A 42 53.484 32.577 36.747 1.00 0.00 C ATOM 620 CG PRO A 42 52.636 33.141 35.608 1.00 0.00 C ATOM 621 CD PRO A 42 52.148 34.464 36.194 1.00 0.00 C ATOM 0 HA PRO A 42 54.311 33.714 38.422 1.00 0.00 H new ATOM 0 HB2 PRO A 42 54.224 31.865 36.382 1.00 0.00 H new ATOM 0 HB3 PRO A 42 52.873 32.053 37.481 1.00 0.00 H new ATOM 0 HG2 PRO A 42 53.220 33.289 34.700 1.00 0.00 H new ATOM 0 HG3 PRO A 42 51.809 32.480 35.350 1.00 0.00 H new ATOM 0 HD2 PRO A 42 51.938 35.188 35.407 1.00 0.00 H new ATOM 0 HD3 PRO A 42 51.224 34.328 36.756 1.00 0.00 H new ATOM 629 N TRP A 43 56.496 33.195 37.148 1.00 0.00 N ATOM 630 CA TRP A 43 57.903 33.158 36.713 1.00 0.00 C ATOM 631 C TRP A 43 58.693 34.482 36.868 1.00 0.00 C ATOM 632 O TRP A 43 59.268 34.971 35.893 1.00 0.00 O ATOM 633 CB TRP A 43 57.975 32.561 35.297 1.00 0.00 C ATOM 634 CG TRP A 43 57.165 31.323 35.020 1.00 0.00 C ATOM 635 CD1 TRP A 43 56.571 31.065 33.833 1.00 0.00 C ATOM 636 CD2 TRP A 43 56.816 30.193 35.891 1.00 0.00 C ATOM 637 NE1 TRP A 43 55.873 29.879 33.904 1.00 0.00 N ATOM 638 CE2 TRP A 43 55.960 29.313 35.157 1.00 0.00 C ATOM 639 CE3 TRP A 43 57.126 29.812 37.219 1.00 0.00 C ATOM 640 CZ2 TRP A 43 55.410 28.152 35.716 1.00 0.00 C ATOM 641 CZ3 TRP A 43 56.583 28.643 37.788 1.00 0.00 C ATOM 642 CH2 TRP A 43 55.719 27.820 37.044 1.00 0.00 C ATOM 0 H TRP A 43 56.282 32.445 37.806 1.00 0.00 H new ATOM 0 HA TRP A 43 58.431 32.506 37.409 1.00 0.00 H new ATOM 0 HB2 TRP A 43 57.663 33.331 34.592 1.00 0.00 H new ATOM 0 HB3 TRP A 43 59.019 32.335 35.081 1.00 0.00 H new ATOM 0 HD1 TRP A 43 56.634 31.695 32.958 1.00 0.00 H new ATOM 0 HE1 TRP A 43 55.356 29.471 33.125 1.00 0.00 H new ATOM 0 HE3 TRP A 43 57.791 30.428 37.806 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 54.757 27.521 35.132 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 56.833 28.377 38.804 1.00 0.00 H new ATOM 0 HH2 TRP A 43 55.294 26.935 37.494 1.00 0.00 H new ATOM 653 N PRO A 44 58.778 35.065 38.083 1.00 0.00 N ATOM 654 CA PRO A 44 59.601 36.250 38.334 1.00 0.00 C ATOM 655 C PRO A 44 61.105 35.955 38.177 1.00 0.00 C ATOM 656 O PRO A 44 61.607 34.939 38.656 1.00 0.00 O ATOM 657 CB PRO A 44 59.247 36.694 39.757 1.00 0.00 C ATOM 658 CG PRO A 44 58.864 35.382 40.444 1.00 0.00 C ATOM 659 CD PRO A 44 58.176 34.600 39.326 1.00 0.00 C ATOM 0 HA PRO A 44 59.398 37.037 37.608 1.00 0.00 H new ATOM 0 HB2 PRO A 44 60.091 37.176 40.251 1.00 0.00 H new ATOM 0 HB3 PRO A 44 58.423 37.408 39.763 1.00 0.00 H new ATOM 0 HG2 PRO A 44 59.739 34.856 40.826 1.00 0.00 H new ATOM 0 HG3 PRO A 44 58.197 35.549 41.290 1.00 0.00 H new ATOM 0 HD2 PRO A 44 58.322 33.527 39.453 1.00 0.00 H new ATOM 0 HD3 PRO A 44 57.101 34.778 39.330 1.00 0.00 H new ATOM 667 N ALA A 45 61.822 36.876 37.531 1.00 0.00 N ATOM 668 CA ALA A 45 63.248 36.788 37.199 1.00 0.00 C ATOM 669 C ALA A 45 63.864 38.199 37.068 1.00 0.00 C ATOM 670 O ALA A 45 63.146 39.199 37.160 1.00 0.00 O ATOM 671 CB ALA A 45 63.361 36.000 35.886 1.00 0.00 C ATOM 0 H ALA A 45 61.404 37.749 37.208 1.00 0.00 H new ATOM 0 HA ALA A 45 63.801 36.279 37.988 1.00 0.00 H new ATOM 0 HB1 ALA A 45 64.410 35.912 35.604 1.00 0.00 H new ATOM 0 HB2 ALA A 45 62.937 35.005 36.021 1.00 0.00 H new ATOM 0 HB3 ALA A 45 62.816 36.523 35.100 1.00 0.00 H new ATOM 677 N PHE A 46 65.175 38.296 36.826 1.00 0.00 N ATOM 678 CA PHE A 46 65.848 39.561 36.463 1.00 0.00 C ATOM 679 C PHE A 46 66.752 39.374 35.235 1.00 0.00 C ATOM 680 O PHE A 46 67.386 38.338 35.060 1.00 0.00 O ATOM 681 CB PHE A 46 66.599 40.169 37.663 1.00 0.00 C ATOM 682 CG PHE A 46 67.144 39.241 38.730 1.00 0.00 C ATOM 683 CD1 PHE A 46 66.325 38.850 39.806 1.00 0.00 C ATOM 684 CD2 PHE A 46 68.496 38.855 38.710 1.00 0.00 C ATOM 685 CE1 PHE A 46 66.854 38.074 40.852 1.00 0.00 C ATOM 686 CE2 PHE A 46 69.022 38.065 39.747 1.00 0.00 C ATOM 687 CZ PHE A 46 68.204 37.682 40.822 1.00 0.00 C ATOM 0 H PHE A 46 65.809 37.498 36.875 1.00 0.00 H new ATOM 0 HA PHE A 46 65.080 40.282 36.184 1.00 0.00 H new ATOM 0 HB2 PHE A 46 67.435 40.747 37.270 1.00 0.00 H new ATOM 0 HB3 PHE A 46 65.926 40.874 38.151 1.00 0.00 H new ATOM 0 HD1 PHE A 46 65.287 39.147 39.828 1.00 0.00 H new ATOM 0 HD2 PHE A 46 69.133 39.167 37.895 1.00 0.00 H new ATOM 0 HE1 PHE A 46 66.224 37.779 41.678 1.00 0.00 H new ATOM 0 HE2 PHE A 46 70.055 37.753 39.717 1.00 0.00 H new ATOM 0 HZ PHE A 46 68.612 37.087 41.626 1.00 0.00 H new ATOM 697 N THR A 47 66.777 40.366 34.345 1.00 0.00 N ATOM 698 CA THR A 47 67.459 40.296 33.042 1.00 0.00 C ATOM 699 C THR A 47 68.974 40.355 33.168 1.00 0.00 C ATOM 700 O THR A 47 69.683 39.590 32.514 1.00 0.00 O ATOM 701 CB THR A 47 67.007 41.449 32.134 1.00 0.00 C ATOM 702 OG1 THR A 47 66.771 42.623 32.884 1.00 0.00 O ATOM 703 CG2 THR A 47 65.718 41.085 31.399 1.00 0.00 C ATOM 0 H THR A 47 66.316 41.261 34.508 1.00 0.00 H new ATOM 0 HA THR A 47 67.185 39.334 32.609 1.00 0.00 H new ATOM 0 HB THR A 47 67.809 41.626 31.417 1.00 0.00 H new ATOM 0 HG1 THR A 47 66.102 43.174 32.427 1.00 0.00 H new ATOM 0 HG21 THR A 47 65.416 41.916 30.761 1.00 0.00 H new ATOM 0 HG22 THR A 47 65.886 40.200 30.786 1.00 0.00 H new ATOM 0 HG23 THR A 47 64.931 40.879 32.125 1.00 0.00 H new ATOM 711 N GLU A 48 69.465 41.253 34.017 1.00 0.00 N ATOM 712 CA GLU A 48 70.857 41.487 34.313 1.00 0.00 C ATOM 713 C GLU A 48 71.134 41.294 35.812 1.00 0.00 C ATOM 714 O GLU A 48 70.244 41.025 36.616 1.00 0.00 O ATOM 715 CB GLU A 48 71.202 42.926 33.905 1.00 0.00 C ATOM 716 CG GLU A 48 70.601 43.526 32.643 1.00 0.00 C ATOM 717 CD GLU A 48 70.728 42.663 31.382 1.00 0.00 C ATOM 718 OE1 GLU A 48 71.757 41.969 31.213 1.00 0.00 O ATOM 719 OE2 GLU A 48 69.820 42.701 30.523 1.00 0.00 O ATOM 0 H GLU A 48 68.852 41.873 34.547 1.00 0.00 H new ATOM 0 HA GLU A 48 71.471 40.775 33.760 1.00 0.00 H new ATOM 0 HB2 GLU A 48 70.923 43.574 34.736 1.00 0.00 H new ATOM 0 HB3 GLU A 48 72.286 42.983 33.806 1.00 0.00 H new ATOM 0 HG2 GLU A 48 69.544 43.724 32.823 1.00 0.00 H new ATOM 0 HG3 GLU A 48 71.078 44.488 32.455 1.00 0.00 H new ATOM 726 N THR A 49 72.377 41.538 36.211 1.00 0.00 N ATOM 727 CA THR A 49 72.801 41.641 37.623 1.00 0.00 C ATOM 728 C THR A 49 73.801 42.779 37.836 1.00 0.00 C ATOM 729 O THR A 49 74.270 43.412 36.894 1.00 0.00 O ATOM 730 CB THR A 49 73.384 40.324 38.176 1.00 0.00 C ATOM 731 OG1 THR A 49 74.360 39.795 37.320 1.00 0.00 O ATOM 732 CG2 THR A 49 72.327 39.262 38.441 1.00 0.00 C ATOM 0 H THR A 49 73.145 41.675 35.554 1.00 0.00 H new ATOM 0 HA THR A 49 71.891 41.860 38.182 1.00 0.00 H new ATOM 0 HB THR A 49 73.836 40.590 39.131 1.00 0.00 H new ATOM 0 HG1 THR A 49 73.965 39.083 36.775 1.00 0.00 H new ATOM 0 HG21 THR A 49 72.805 38.362 38.828 1.00 0.00 H new ATOM 0 HG22 THR A 49 71.611 39.636 39.172 1.00 0.00 H new ATOM 0 HG23 THR A 49 71.807 39.026 37.512 1.00 0.00 H new ATOM 740 N ILE A 50 74.127 43.054 39.101 1.00 0.00 N ATOM 741 CA ILE A 50 75.011 44.138 39.558 1.00 0.00 C ATOM 742 C ILE A 50 76.499 43.893 39.217 1.00 0.00 C ATOM 743 O ILE A 50 77.300 44.820 39.246 1.00 0.00 O ATOM 744 CB ILE A 50 74.841 44.335 41.087 1.00 0.00 C ATOM 745 CG1 ILE A 50 73.457 43.978 41.675 1.00 0.00 C ATOM 746 CG2 ILE A 50 75.196 45.768 41.521 1.00 0.00 C ATOM 747 CD1 ILE A 50 73.350 42.520 42.150 1.00 0.00 C ATOM 0 H ILE A 50 73.765 42.500 39.877 1.00 0.00 H new ATOM 0 HA ILE A 50 74.715 45.041 39.024 1.00 0.00 H new ATOM 0 HB ILE A 50 75.544 43.609 41.496 1.00 0.00 H new ATOM 0 HG12 ILE A 50 73.245 44.641 42.514 1.00 0.00 H new ATOM 0 HG13 ILE A 50 72.692 44.163 40.921 1.00 0.00 H new ATOM 0 HG21 ILE A 50 75.064 45.865 42.599 1.00 0.00 H new ATOM 0 HG22 ILE A 50 76.233 45.980 41.262 1.00 0.00 H new ATOM 0 HG23 ILE A 50 74.543 46.475 41.010 1.00 0.00 H new ATOM 0 HD11 ILE A 50 72.352 42.340 42.551 1.00 0.00 H new ATOM 0 HD12 ILE A 50 73.530 41.849 41.310 1.00 0.00 H new ATOM 0 HD13 ILE A 50 74.092 42.335 42.927 1.00 0.00 H new ATOM 759 N HIS A 51 76.863 42.637 38.939 1.00 0.00 N ATOM 760 CA HIS A 51 78.224 42.139 38.684 1.00 0.00 C ATOM 761 C HIS A 51 79.296 42.728 39.647 1.00 0.00 C ATOM 762 O HIS A 51 80.247 43.380 39.198 1.00 0.00 O ATOM 763 CB HIS A 51 78.520 42.282 37.179 1.00 0.00 C ATOM 764 CG HIS A 51 79.738 41.540 36.669 1.00 0.00 C ATOM 765 ND1 HIS A 51 81.026 41.668 37.134 1.00 0.00 N ATOM 766 CD2 HIS A 51 79.787 40.673 35.609 1.00 0.00 C ATOM 767 CE1 HIS A 51 81.831 40.896 36.387 1.00 0.00 C ATOM 768 NE2 HIS A 51 81.117 40.259 35.442 1.00 0.00 N ATOM 0 H HIS A 51 76.171 41.890 38.882 1.00 0.00 H new ATOM 0 HA HIS A 51 78.282 41.078 38.927 1.00 0.00 H new ATOM 0 HB2 HIS A 51 77.649 41.936 36.623 1.00 0.00 H new ATOM 0 HB3 HIS A 51 78.643 43.341 36.952 1.00 0.00 H new ATOM 0 HD1 HIS A 51 81.321 42.252 37.916 1.00 0.00 H new ATOM 0 HD2 HIS A 51 78.947 40.362 35.006 1.00 0.00 H new ATOM 0 HE1 HIS A 51 82.898 40.800 36.525 1.00 0.00 H new ATOM 776 N PRO A 52 79.151 42.543 40.977 1.00 0.00 N ATOM 777 CA PRO A 52 80.149 42.961 41.956 1.00 0.00 C ATOM 778 C PRO A 52 81.290 41.930 42.058 1.00 0.00 C ATOM 779 O PRO A 52 81.282 40.892 41.403 1.00 0.00 O ATOM 780 CB PRO A 52 79.355 43.089 43.261 1.00 0.00 C ATOM 781 CG PRO A 52 78.389 41.913 43.165 1.00 0.00 C ATOM 782 CD PRO A 52 78.085 41.822 41.665 1.00 0.00 C ATOM 0 HA PRO A 52 80.644 43.896 41.692 1.00 0.00 H new ATOM 0 HB2 PRO A 52 79.998 43.017 44.138 1.00 0.00 H new ATOM 0 HB3 PRO A 52 78.831 44.042 43.327 1.00 0.00 H new ATOM 0 HG2 PRO A 52 78.838 40.993 43.540 1.00 0.00 H new ATOM 0 HG3 PRO A 52 77.485 42.088 43.748 1.00 0.00 H new ATOM 0 HD2 PRO A 52 78.049 40.782 41.340 1.00 0.00 H new ATOM 0 HD3 PRO A 52 77.113 42.261 41.440 1.00 0.00 H new ATOM 790 N ASP A 53 82.254 42.202 42.931 1.00 0.00 N ATOM 791 CA ASP A 53 83.401 41.351 43.256 1.00 0.00 C ATOM 792 C ASP A 53 83.118 40.230 44.264 1.00 0.00 C ATOM 793 O ASP A 53 83.830 39.231 44.354 1.00 0.00 O ATOM 794 CB ASP A 53 84.519 42.266 43.789 1.00 0.00 C ATOM 795 CG ASP A 53 84.169 43.061 45.067 1.00 0.00 C ATOM 796 OD1 ASP A 53 82.983 43.106 45.490 1.00 0.00 O ATOM 797 OD2 ASP A 53 85.094 43.704 45.611 1.00 0.00 O ATOM 0 H ASP A 53 82.259 43.072 43.463 1.00 0.00 H new ATOM 0 HA ASP A 53 83.684 40.831 42.341 1.00 0.00 H new ATOM 0 HB2 ASP A 53 85.400 41.656 43.990 1.00 0.00 H new ATOM 0 HB3 ASP A 53 84.792 42.972 43.005 1.00 0.00 H new ATOM 802 N SER A 54 82.071 40.443 45.042 1.00 0.00 N ATOM 803 CA SER A 54 81.749 39.723 46.272 1.00 0.00 C ATOM 804 C SER A 54 80.853 38.499 46.082 1.00 0.00 C ATOM 805 O SER A 54 80.693 37.668 46.971 1.00 0.00 O ATOM 806 CB SER A 54 81.052 40.727 47.168 1.00 0.00 C ATOM 807 OG SER A 54 82.025 41.551 47.793 1.00 0.00 O ATOM 0 H SER A 54 81.381 41.162 44.824 1.00 0.00 H new ATOM 0 HA SER A 54 82.673 39.326 46.692 1.00 0.00 H new ATOM 0 HB2 SER A 54 80.363 41.337 46.584 1.00 0.00 H new ATOM 0 HB3 SER A 54 80.459 40.209 47.922 1.00 0.00 H new ATOM 0 HG SER A 54 82.415 42.158 47.129 1.00 0.00 H new ATOM 813 N VAL A 55 80.277 38.408 44.896 1.00 0.00 N ATOM 814 CA VAL A 55 79.532 37.240 44.398 1.00 0.00 C ATOM 815 C VAL A 55 80.258 36.657 43.191 1.00 0.00 C ATOM 816 O VAL A 55 80.939 37.371 42.456 1.00 0.00 O ATOM 817 CB VAL A 55 78.043 37.534 44.105 1.00 0.00 C ATOM 818 CG1 VAL A 55 77.382 38.335 45.234 1.00 0.00 C ATOM 819 CG2 VAL A 55 77.824 38.243 42.764 1.00 0.00 C ATOM 0 H VAL A 55 80.311 39.170 44.219 1.00 0.00 H new ATOM 0 HA VAL A 55 79.508 36.496 45.194 1.00 0.00 H new ATOM 0 HB VAL A 55 77.564 36.557 44.043 1.00 0.00 H new ATOM 0 HG11 VAL A 55 76.337 38.519 44.986 1.00 0.00 H new ATOM 0 HG12 VAL A 55 77.440 37.769 46.164 1.00 0.00 H new ATOM 0 HG13 VAL A 55 77.899 39.287 45.356 1.00 0.00 H new ATOM 0 HG21 VAL A 55 76.759 38.421 42.616 1.00 0.00 H new ATOM 0 HG22 VAL A 55 78.355 39.195 42.765 1.00 0.00 H new ATOM 0 HG23 VAL A 55 78.202 37.617 41.956 1.00 0.00 H new ATOM 829 N THR A 56 80.127 35.354 42.972 1.00 0.00 N ATOM 830 CA THR A 56 80.768 34.681 41.831 1.00 0.00 C ATOM 831 C THR A 56 79.918 33.556 41.273 1.00 0.00 C ATOM 832 O THR A 56 78.940 33.154 41.880 1.00 0.00 O ATOM 833 CB THR A 56 82.186 34.230 42.186 1.00 0.00 C ATOM 834 OG1 THR A 56 82.912 33.942 41.009 1.00 0.00 O ATOM 835 CG2 THR A 56 82.255 33.015 43.110 1.00 0.00 C ATOM 0 H THR A 56 79.581 34.733 43.569 1.00 0.00 H new ATOM 0 HA THR A 56 80.855 35.411 41.026 1.00 0.00 H new ATOM 0 HB THR A 56 82.623 35.066 42.733 1.00 0.00 H new ATOM 0 HG1 THR A 56 83.819 33.656 41.246 1.00 0.00 H new ATOM 0 HG21 THR A 56 83.298 32.767 43.308 1.00 0.00 H new ATOM 0 HG22 THR A 56 81.752 33.243 44.050 1.00 0.00 H new ATOM 0 HG23 THR A 56 81.764 32.167 42.633 1.00 0.00 H new ATOM 843 N LYS A 57 80.245 33.054 40.088 1.00 0.00 N ATOM 844 CA LYS A 57 79.497 32.007 39.403 1.00 0.00 C ATOM 845 C LYS A 57 80.371 30.912 38.817 1.00 0.00 C ATOM 846 O LYS A 57 81.575 31.087 38.646 1.00 0.00 O ATOM 847 CB LYS A 57 78.604 32.626 38.336 1.00 0.00 C ATOM 848 CG LYS A 57 79.162 33.744 37.474 1.00 0.00 C ATOM 849 CD LYS A 57 80.295 33.337 36.518 1.00 0.00 C ATOM 850 CE LYS A 57 80.736 34.507 35.630 1.00 0.00 C ATOM 851 NZ LYS A 57 81.871 35.260 36.214 1.00 0.00 N ATOM 0 H LYS A 57 81.060 33.373 39.563 1.00 0.00 H new ATOM 0 HA LYS A 57 78.883 31.514 40.157 1.00 0.00 H new ATOM 0 HB2 LYS A 57 78.282 31.825 37.670 1.00 0.00 H new ATOM 0 HB3 LYS A 57 77.711 33.006 38.833 1.00 0.00 H new ATOM 0 HG2 LYS A 57 78.348 34.167 36.886 1.00 0.00 H new ATOM 0 HG3 LYS A 57 79.528 34.536 38.128 1.00 0.00 H new ATOM 0 HD2 LYS A 57 81.147 32.977 37.095 1.00 0.00 H new ATOM 0 HD3 LYS A 57 79.963 32.510 35.891 1.00 0.00 H new ATOM 0 HE2 LYS A 57 81.021 34.128 34.649 1.00 0.00 H new ATOM 0 HE3 LYS A 57 79.894 35.183 35.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 82.133 36.040 35.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 81.593 35.645 37.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 82.685 34.623 36.335 1.00 0.00 H new ATOM 865 N CYS A 58 79.731 29.812 38.444 1.00 0.00 N ATOM 866 CA CYS A 58 80.366 28.745 37.681 1.00 0.00 C ATOM 867 C CYS A 58 79.439 27.983 36.708 1.00 0.00 C ATOM 868 O CYS A 58 78.268 27.754 37.010 1.00 0.00 O ATOM 869 CB CYS A 58 81.069 27.830 38.672 1.00 0.00 C ATOM 870 SG CYS A 58 80.022 27.249 40.034 1.00 0.00 S ATOM 0 H CYS A 58 78.751 29.633 38.663 1.00 0.00 H new ATOM 0 HA CYS A 58 81.084 29.199 36.998 1.00 0.00 H new ATOM 0 HB2 CYS A 58 81.458 26.965 38.135 1.00 0.00 H new ATOM 0 HB3 CYS A 58 81.926 28.358 39.089 1.00 0.00 H new ATOM 0 HG CYS A 58 80.716 26.477 40.816 1.00 0.00 H new ATOM 876 N PRO A 59 79.941 27.554 35.533 1.00 0.00 N ATOM 877 CA PRO A 59 79.134 26.860 34.534 1.00 0.00 C ATOM 878 C PRO A 59 78.783 25.433 34.927 1.00 0.00 C ATOM 879 O PRO A 59 79.519 24.764 35.652 1.00 0.00 O ATOM 880 CB PRO A 59 79.935 26.891 33.237 1.00 0.00 C ATOM 881 CG PRO A 59 81.386 26.966 33.720 1.00 0.00 C ATOM 882 CD PRO A 59 81.305 27.722 35.050 1.00 0.00 C ATOM 0 HA PRO A 59 78.172 27.362 34.430 1.00 0.00 H new ATOM 0 HB2 PRO A 59 79.758 26.001 32.633 1.00 0.00 H new ATOM 0 HB3 PRO A 59 79.671 27.751 32.622 1.00 0.00 H new ATOM 0 HG2 PRO A 59 81.813 25.972 33.853 1.00 0.00 H new ATOM 0 HG3 PRO A 59 82.017 27.490 33.003 1.00 0.00 H new ATOM 0 HD2 PRO A 59 82.023 27.325 35.767 1.00 0.00 H new ATOM 0 HD3 PRO A 59 81.542 28.777 34.913 1.00 0.00 H new ATOM 890 N GLU A 60 77.655 24.963 34.411 1.00 0.00 N ATOM 891 CA GLU A 60 77.274 23.560 34.486 1.00 0.00 C ATOM 892 C GLU A 60 77.988 22.634 33.496 1.00 0.00 C ATOM 893 O GLU A 60 78.503 23.030 32.448 1.00 0.00 O ATOM 894 CB GLU A 60 75.767 23.386 34.347 1.00 0.00 C ATOM 895 CG GLU A 60 74.956 24.094 35.426 1.00 0.00 C ATOM 896 CD GLU A 60 75.214 23.400 36.761 1.00 0.00 C ATOM 897 OE1 GLU A 60 76.220 23.746 37.420 1.00 0.00 O ATOM 898 OE2 GLU A 60 74.438 22.484 37.102 1.00 0.00 O ATOM 0 H GLU A 60 76.975 25.548 33.926 1.00 0.00 H new ATOM 0 HA GLU A 60 77.603 23.252 35.478 1.00 0.00 H new ATOM 0 HB2 GLU A 60 75.458 23.760 33.371 1.00 0.00 H new ATOM 0 HB3 GLU A 60 75.531 22.322 34.370 1.00 0.00 H new ATOM 0 HG2 GLU A 60 75.240 25.145 35.485 1.00 0.00 H new ATOM 0 HG3 GLU A 60 73.894 24.064 35.183 1.00 0.00 H new ATOM 905 N LYS A 61 77.972 21.347 33.853 1.00 0.00 N ATOM 906 CA LYS A 61 78.636 20.254 33.152 1.00 0.00 C ATOM 907 C LYS A 61 77.691 19.345 32.392 1.00 0.00 C ATOM 908 O LYS A 61 77.841 19.035 31.217 1.00 0.00 O ATOM 909 CB LYS A 61 79.547 19.583 34.175 1.00 0.00 C ATOM 910 CG LYS A 61 78.999 18.607 35.194 1.00 0.00 C ATOM 911 CD LYS A 61 78.997 17.179 34.651 1.00 0.00 C ATOM 912 CE LYS A 61 78.731 16.139 35.744 1.00 0.00 C ATOM 913 NZ LYS A 61 79.979 15.765 36.446 1.00 0.00 N ATOM 0 H LYS A 61 77.469 21.027 34.681 1.00 0.00 H new ATOM 0 HA LYS A 61 79.247 20.622 32.328 1.00 0.00 H new ATOM 0 HB2 LYS A 61 80.321 19.057 33.615 1.00 0.00 H new ATOM 0 HB3 LYS A 61 80.041 20.379 34.731 1.00 0.00 H new ATOM 0 HG2 LYS A 61 79.599 18.652 36.103 1.00 0.00 H new ATOM 0 HG3 LYS A 61 77.984 18.896 35.468 1.00 0.00 H new ATOM 0 HD2 LYS A 61 78.237 17.089 33.875 1.00 0.00 H new ATOM 0 HD3 LYS A 61 79.958 16.971 34.181 1.00 0.00 H new ATOM 0 HE2 LYS A 61 78.013 16.538 36.461 1.00 0.00 H new ATOM 0 HE3 LYS A 61 78.280 15.251 35.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 79.766 15.060 37.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 80.654 15.363 35.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 80.395 16.609 36.888 1.00 0.00 H new ATOM 927 N ASN A 62 76.663 19.005 33.131 1.00 0.00 N ATOM 928 CA ASN A 62 75.477 18.217 32.826 1.00 0.00 C ATOM 929 C ASN A 62 74.348 19.063 32.235 1.00 0.00 C ATOM 930 O ASN A 62 73.338 18.521 31.801 1.00 0.00 O ATOM 931 CB ASN A 62 75.073 17.488 34.132 1.00 0.00 C ATOM 932 CG ASN A 62 75.429 18.202 35.371 1.00 0.00 C ATOM 933 OD1 ASN A 62 75.405 19.413 35.506 1.00 0.00 O ATOM 934 ND2 ASN A 62 75.719 17.404 36.335 1.00 0.00 N ATOM 0 H ASN A 62 76.629 19.317 34.101 1.00 0.00 H new ATOM 0 HA ASN A 62 75.693 17.487 32.046 1.00 0.00 H new ATOM 0 HB2 ASN A 62 73.996 17.322 34.121 1.00 0.00 H new ATOM 0 HB3 ASN A 62 75.547 16.506 34.146 1.00 0.00 H new ATOM 0 HD21 ASN A 62 75.941 17.778 37.258 1.00 0.00 H new ATOM 0 HD22 ASN A 62 75.727 16.396 36.178 1.00 0.00 H new ATOM 941 N ARG A 63 74.536 20.387 32.210 1.00 0.00 N ATOM 942 CA ARG A 63 73.597 21.382 31.702 1.00 0.00 C ATOM 943 C ARG A 63 74.291 22.504 30.906 1.00 0.00 C ATOM 944 O ARG A 63 74.163 23.666 31.275 1.00 0.00 O ATOM 945 CB ARG A 63 72.729 21.920 32.858 1.00 0.00 C ATOM 946 CG ARG A 63 72.220 20.845 33.825 1.00 0.00 C ATOM 947 CD ARG A 63 71.189 21.372 34.829 1.00 0.00 C ATOM 948 NE ARG A 63 71.831 22.045 35.977 1.00 0.00 N ATOM 949 CZ ARG A 63 71.319 22.958 36.780 1.00 0.00 C ATOM 950 NH1 ARG A 63 70.133 23.473 36.632 1.00 0.00 N ATOM 951 NH2 ARG A 63 72.025 23.389 37.772 1.00 0.00 N ATOM 0 H ARG A 63 75.394 20.811 32.563 1.00 0.00 H new ATOM 0 HA ARG A 63 72.940 20.893 30.983 1.00 0.00 H new ATOM 0 HB2 ARG A 63 73.309 22.652 33.421 1.00 0.00 H new ATOM 0 HB3 ARG A 63 71.873 22.447 32.437 1.00 0.00 H new ATOM 0 HG2 ARG A 63 71.776 20.031 33.252 1.00 0.00 H new ATOM 0 HG3 ARG A 63 73.066 20.426 34.370 1.00 0.00 H new ATOM 0 HD2 ARG A 63 70.518 22.070 34.328 1.00 0.00 H new ATOM 0 HD3 ARG A 63 70.577 20.545 35.189 1.00 0.00 H new ATOM 0 HE ARG A 63 72.793 21.768 36.174 1.00 0.00 H new ATOM 0 HH11 ARG A 63 69.540 23.173 35.858 1.00 0.00 H new ATOM 0 HH12 ARG A 63 69.797 24.176 37.290 1.00 0.00 H new ATOM 0 HH21 ARG A 63 72.965 23.024 37.926 1.00 0.00 H new ATOM 0 HH22 ARG A 63 71.643 24.095 38.401 1.00 0.00 H new ATOM 965 N PRO A 64 75.050 22.198 29.835 1.00 0.00 N ATOM 966 CA PRO A 64 76.076 23.085 29.255 1.00 0.00 C ATOM 967 C PRO A 64 75.552 24.257 28.399 1.00 0.00 C ATOM 968 O PRO A 64 76.241 24.786 27.527 1.00 0.00 O ATOM 969 CB PRO A 64 77.021 22.136 28.509 1.00 0.00 C ATOM 970 CG PRO A 64 76.065 21.053 28.005 1.00 0.00 C ATOM 971 CD PRO A 64 75.068 20.910 29.157 1.00 0.00 C ATOM 0 HA PRO A 64 76.584 23.644 30.041 1.00 0.00 H new ATOM 0 HB2 PRO A 64 77.537 22.637 27.689 1.00 0.00 H new ATOM 0 HB3 PRO A 64 77.789 21.727 29.166 1.00 0.00 H new ATOM 0 HG2 PRO A 64 75.572 21.349 27.079 1.00 0.00 H new ATOM 0 HG3 PRO A 64 76.586 20.117 27.804 1.00 0.00 H new ATOM 0 HD2 PRO A 64 74.077 20.651 28.785 1.00 0.00 H new ATOM 0 HD3 PRO A 64 75.371 20.115 29.838 1.00 0.00 H new ATOM 979 N GLU A 65 74.328 24.669 28.694 1.00 0.00 N ATOM 980 CA GLU A 65 73.553 25.778 28.146 1.00 0.00 C ATOM 981 C GLU A 65 73.109 26.766 29.245 1.00 0.00 C ATOM 982 O GLU A 65 72.295 27.655 29.016 1.00 0.00 O ATOM 983 CB GLU A 65 72.344 25.241 27.344 1.00 0.00 C ATOM 984 CG GLU A 65 72.592 23.940 26.604 1.00 0.00 C ATOM 985 CD GLU A 65 71.514 23.612 25.566 1.00 0.00 C ATOM 986 OE1 GLU A 65 70.381 23.240 25.954 1.00 0.00 O ATOM 987 OE2 GLU A 65 71.800 23.658 24.344 1.00 0.00 O ATOM 0 H GLU A 65 73.789 24.177 29.407 1.00 0.00 H new ATOM 0 HA GLU A 65 74.196 26.336 27.466 1.00 0.00 H new ATOM 0 HB2 GLU A 65 71.508 25.098 28.028 1.00 0.00 H new ATOM 0 HB3 GLU A 65 72.040 25.999 26.623 1.00 0.00 H new ATOM 0 HG2 GLU A 65 73.560 23.993 26.106 1.00 0.00 H new ATOM 0 HG3 GLU A 65 72.649 23.126 27.326 1.00 0.00 H new ATOM 994 N ALA A 66 73.612 26.569 30.467 1.00 0.00 N ATOM 995 CA ALA A 66 73.247 27.280 31.676 1.00 0.00 C ATOM 996 C ALA A 66 74.377 27.207 32.715 1.00 0.00 C ATOM 997 O ALA A 66 75.252 26.337 32.688 1.00 0.00 O ATOM 998 CB ALA A 66 71.954 26.667 32.235 1.00 0.00 C ATOM 0 H ALA A 66 74.328 25.864 30.639 1.00 0.00 H new ATOM 0 HA ALA A 66 73.084 28.333 31.445 1.00 0.00 H new ATOM 0 HB1 ALA A 66 71.667 27.192 33.146 1.00 0.00 H new ATOM 0 HB2 ALA A 66 71.158 26.760 31.496 1.00 0.00 H new ATOM 0 HB3 ALA A 66 72.119 25.613 32.460 1.00 0.00 H new ATOM 1004 N LEU A 67 74.346 28.142 33.657 1.00 0.00 N ATOM 1005 CA LEU A 67 75.298 28.254 34.754 1.00 0.00 C ATOM 1006 C LEU A 67 74.651 28.525 36.116 1.00 0.00 C ATOM 1007 O LEU A 67 73.565 29.106 36.205 1.00 0.00 O ATOM 1008 CB LEU A 67 76.367 29.263 34.320 1.00 0.00 C ATOM 1009 CG LEU A 67 76.081 30.771 34.234 1.00 0.00 C ATOM 1010 CD1 LEU A 67 75.873 31.431 35.597 1.00 0.00 C ATOM 1011 CD2 LEU A 67 77.319 31.417 33.608 1.00 0.00 C ATOM 0 H LEU A 67 73.631 28.869 33.678 1.00 0.00 H new ATOM 0 HA LEU A 67 75.777 27.293 34.940 1.00 0.00 H new ATOM 0 HB2 LEU A 67 77.208 29.142 35.002 1.00 0.00 H new ATOM 0 HB3 LEU A 67 76.710 28.952 33.333 1.00 0.00 H new ATOM 0 HG LEU A 67 75.165 30.907 33.659 1.00 0.00 H new ATOM 0 HD11 LEU A 67 75.676 32.494 35.460 1.00 0.00 H new ATOM 0 HD12 LEU A 67 75.025 30.967 36.101 1.00 0.00 H new ATOM 0 HD13 LEU A 67 76.770 31.303 36.204 1.00 0.00 H new ATOM 0 HD21 LEU A 67 77.165 32.493 33.525 1.00 0.00 H new ATOM 0 HD22 LEU A 67 78.188 31.222 34.236 1.00 0.00 H new ATOM 0 HD23 LEU A 67 77.487 30.997 32.616 1.00 0.00 H new ATOM 1023 N LYS A 68 75.340 28.122 37.189 1.00 0.00 N ATOM 1024 CA LYS A 68 74.947 28.432 38.570 1.00 0.00 C ATOM 1025 C LYS A 68 75.757 29.615 39.100 1.00 0.00 C ATOM 1026 O LYS A 68 76.948 29.749 38.828 1.00 0.00 O ATOM 1027 CB LYS A 68 75.073 27.173 39.440 1.00 0.00 C ATOM 1028 CG LYS A 68 76.483 26.594 39.393 1.00 0.00 C ATOM 1029 CD LYS A 68 76.503 25.315 40.196 1.00 0.00 C ATOM 1030 CE LYS A 68 77.869 24.610 40.166 1.00 0.00 C ATOM 1031 NZ LYS A 68 78.402 24.471 38.788 1.00 0.00 N ATOM 0 H LYS A 68 76.193 27.567 37.124 1.00 0.00 H new ATOM 0 HA LYS A 68 73.901 28.738 38.602 1.00 0.00 H new ATOM 0 HB2 LYS A 68 74.813 27.415 40.471 1.00 0.00 H new ATOM 0 HB3 LYS A 68 74.360 26.422 39.099 1.00 0.00 H new ATOM 0 HG2 LYS A 68 76.778 26.399 38.362 1.00 0.00 H new ATOM 0 HG3 LYS A 68 77.199 27.308 39.800 1.00 0.00 H new ATOM 0 HD2 LYS A 68 76.237 25.537 41.230 1.00 0.00 H new ATOM 0 HD3 LYS A 68 75.742 24.637 39.809 1.00 0.00 H new ATOM 0 HE2 LYS A 68 78.579 25.172 40.772 1.00 0.00 H new ATOM 0 HE3 LYS A 68 77.776 23.623 40.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 78.907 23.566 38.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 77.616 24.496 38.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 79.057 25.254 38.589 1.00 0.00 H new ATOM 1045 N VAL A 69 75.121 30.491 39.864 1.00 0.00 N ATOM 1046 CA VAL A 69 75.750 31.637 40.528 1.00 0.00 C ATOM 1047 C VAL A 69 75.642 31.517 42.061 1.00 0.00 C ATOM 1048 O VAL A 69 74.585 31.180 42.601 1.00 0.00 O ATOM 1049 CB VAL A 69 75.086 32.949 40.075 1.00 0.00 C ATOM 1050 CG1 VAL A 69 75.906 34.136 40.588 1.00 0.00 C ATOM 1051 CG2 VAL A 69 74.853 33.078 38.561 1.00 0.00 C ATOM 0 H VAL A 69 74.120 30.427 40.049 1.00 0.00 H new ATOM 0 HA VAL A 69 76.803 31.645 40.248 1.00 0.00 H new ATOM 0 HB VAL A 69 74.087 32.941 40.510 1.00 0.00 H new ATOM 0 HG11 VAL A 69 75.438 35.067 40.268 1.00 0.00 H new ATOM 0 HG12 VAL A 69 75.948 34.106 41.677 1.00 0.00 H new ATOM 0 HG13 VAL A 69 76.917 34.081 40.184 1.00 0.00 H new ATOM 0 HG21 VAL A 69 74.381 34.037 38.346 1.00 0.00 H new ATOM 0 HG22 VAL A 69 75.808 33.019 38.039 1.00 0.00 H new ATOM 0 HG23 VAL A 69 74.204 32.270 38.223 1.00 0.00 H new ATOM 1061 N SER A 70 76.714 31.857 42.778 1.00 0.00 N ATOM 1062 CA SER A 70 76.771 31.868 44.253 1.00 0.00 C ATOM 1063 C SER A 70 77.097 33.207 44.922 1.00 0.00 C ATOM 1064 O SER A 70 77.821 34.051 44.389 1.00 0.00 O ATOM 1065 CB SER A 70 77.789 30.833 44.768 1.00 0.00 C ATOM 1066 OG SER A 70 79.021 30.855 44.074 1.00 0.00 O ATOM 0 H SER A 70 77.593 32.141 42.344 1.00 0.00 H new ATOM 0 HA SER A 70 75.745 31.629 44.533 1.00 0.00 H new ATOM 0 HB2 SER A 70 77.975 31.015 45.827 1.00 0.00 H new ATOM 0 HB3 SER A 70 77.354 29.837 44.687 1.00 0.00 H new ATOM 0 HG SER A 70 79.621 30.177 44.450 1.00 0.00 H new ATOM 1072 N CYS A 71 76.653 33.339 46.183 1.00 0.00 N ATOM 1073 CA CYS A 71 77.224 34.346 47.075 1.00 0.00 C ATOM 1074 C CYS A 71 78.556 33.808 47.627 1.00 0.00 C ATOM 1075 O CYS A 71 78.624 33.189 48.686 1.00 0.00 O ATOM 1076 CB CYS A 71 76.221 34.767 48.163 1.00 0.00 C ATOM 1077 SG CYS A 71 76.996 36.116 49.088 1.00 0.00 S ATOM 0 H CYS A 71 75.914 32.770 46.596 1.00 0.00 H new ATOM 0 HA CYS A 71 77.437 35.265 46.528 1.00 0.00 H new ATOM 0 HB2 CYS A 71 75.281 35.093 47.718 1.00 0.00 H new ATOM 0 HB3 CYS A 71 75.989 33.929 48.821 1.00 0.00 H new ATOM 0 HG CYS A 71 76.823 35.924 50.362 1.00 0.00 H new ATOM 1082 N GLY A 72 79.616 33.958 46.842 1.00 0.00 N ATOM 1083 CA GLY A 72 80.953 33.470 47.196 1.00 0.00 C ATOM 1084 C GLY A 72 81.616 34.155 48.406 1.00 0.00 C ATOM 1085 O GLY A 72 82.674 33.696 48.835 1.00 0.00 O ATOM 0 H GLY A 72 79.577 34.424 45.935 1.00 0.00 H new ATOM 0 HA2 GLY A 72 80.888 32.401 47.398 1.00 0.00 H new ATOM 0 HA3 GLY A 72 81.605 33.592 46.331 1.00 0.00 H new ATOM 1089 N LYS A 73 81.022 35.213 48.975 1.00 0.00 N ATOM 1090 CA LYS A 73 81.494 35.897 50.190 1.00 0.00 C ATOM 1091 C LYS A 73 81.224 35.097 51.463 1.00 0.00 C ATOM 1092 O LYS A 73 82.137 34.825 52.247 1.00 0.00 O ATOM 1093 CB LYS A 73 80.839 37.280 50.278 1.00 0.00 C ATOM 1094 CG LYS A 73 81.792 38.430 49.932 1.00 0.00 C ATOM 1095 CD LYS A 73 82.785 38.706 51.066 1.00 0.00 C ATOM 1096 CE LYS A 73 83.917 39.634 50.616 1.00 0.00 C ATOM 1097 NZ LYS A 73 83.462 41.000 50.261 1.00 0.00 N ATOM 0 H LYS A 73 80.174 35.630 48.592 1.00 0.00 H new ATOM 0 HA LYS A 73 82.577 35.998 50.113 1.00 0.00 H new ATOM 0 HB2 LYS A 73 79.983 37.312 49.603 1.00 0.00 H new ATOM 0 HB3 LYS A 73 80.455 37.428 51.287 1.00 0.00 H new ATOM 0 HG2 LYS A 73 82.339 38.187 49.021 1.00 0.00 H new ATOM 0 HG3 LYS A 73 81.215 39.331 49.727 1.00 0.00 H new ATOM 0 HD2 LYS A 73 82.259 39.156 51.908 1.00 0.00 H new ATOM 0 HD3 LYS A 73 83.205 37.764 51.419 1.00 0.00 H new ATOM 0 HE2 LYS A 73 84.657 39.703 51.413 1.00 0.00 H new ATOM 0 HE3 LYS A 73 84.417 39.192 49.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 84.284 41.634 50.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 82.972 40.975 49.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 82.811 41.350 50.992 1.00 0.00 H new ATOM 1111 N CYS A 74 79.965 34.729 51.658 1.00 0.00 N ATOM 1112 CA CYS A 74 79.444 33.953 52.763 1.00 0.00 C ATOM 1113 C CYS A 74 79.374 32.446 52.422 1.00 0.00 C ATOM 1114 O CYS A 74 79.322 31.600 53.320 1.00 0.00 O ATOM 1115 CB CYS A 74 78.113 34.616 53.102 1.00 0.00 C ATOM 1116 SG CYS A 74 77.011 34.799 51.660 1.00 0.00 S ATOM 0 H CYS A 74 79.232 34.986 50.997 1.00 0.00 H new ATOM 0 HA CYS A 74 80.088 33.957 53.642 1.00 0.00 H new ATOM 0 HB2 CYS A 74 77.606 34.027 53.866 1.00 0.00 H new ATOM 0 HB3 CYS A 74 78.304 35.599 53.532 1.00 0.00 H new ATOM 0 HG CYS A 74 77.723 35.023 50.595 1.00 0.00 H new ATOM 1121 N GLY A 75 79.452 32.135 51.127 1.00 0.00 N ATOM 1122 CA GLY A 75 79.601 30.796 50.576 1.00 0.00 C ATOM 1123 C GLY A 75 78.260 30.121 50.295 1.00 0.00 C ATOM 1124 O GLY A 75 78.033 28.996 50.737 1.00 0.00 O ATOM 0 H GLY A 75 79.410 32.850 50.401 1.00 0.00 H new ATOM 0 HA2 GLY A 75 80.177 30.850 49.652 1.00 0.00 H new ATOM 0 HA3 GLY A 75 80.173 30.183 51.272 1.00 0.00 H new ATOM 1128 N ASN A 76 77.350 30.802 49.596 1.00 0.00 N ATOM 1129 CA ASN A 76 76.058 30.276 49.192 1.00 0.00 C ATOM 1130 C ASN A 76 76.188 29.590 47.810 1.00 0.00 C ATOM 1131 O ASN A 76 77.274 29.171 47.407 1.00 0.00 O ATOM 1132 CB ASN A 76 75.038 31.418 49.332 1.00 0.00 C ATOM 1133 CG ASN A 76 73.619 30.950 49.597 1.00 0.00 C ATOM 1134 OD1 ASN A 76 73.317 29.780 49.473 1.00 0.00 O ATOM 1135 ND2 ASN A 76 72.709 31.836 49.931 1.00 0.00 N ATOM 0 H ASN A 76 77.503 31.763 49.290 1.00 0.00 H new ATOM 0 HA ASN A 76 75.682 29.474 49.827 1.00 0.00 H new ATOM 0 HB2 ASN A 76 75.351 32.073 50.145 1.00 0.00 H new ATOM 0 HB3 ASN A 76 75.048 32.014 48.420 1.00 0.00 H new ATOM 0 HD21 ASN A 76 71.745 31.543 50.087 1.00 0.00 H new ATOM 0 HD22 ASN A 76 72.967 32.818 50.034 1.00 0.00 H new ATOM 1142 N GLY A 77 75.103 29.490 47.049 1.00 0.00 N ATOM 1143 CA GLY A 77 75.108 28.999 45.672 1.00 0.00 C ATOM 1144 C GLY A 77 73.842 28.378 45.126 1.00 0.00 C ATOM 1145 O GLY A 77 73.796 27.182 44.852 1.00 0.00 O ATOM 0 H GLY A 77 74.174 29.753 47.378 1.00 0.00 H new ATOM 0 HA2 GLY A 77 75.375 29.833 45.023 1.00 0.00 H new ATOM 0 HA3 GLY A 77 75.904 28.260 45.586 1.00 0.00 H new ATOM 1149 N LEU A 78 72.811 29.207 44.988 1.00 0.00 N ATOM 1150 CA LEU A 78 71.444 28.752 44.710 1.00 0.00 C ATOM 1151 C LEU A 78 70.809 29.428 43.487 1.00 0.00 C ATOM 1152 O LEU A 78 69.809 28.938 42.966 1.00 0.00 O ATOM 1153 CB LEU A 78 70.546 29.006 45.934 1.00 0.00 C ATOM 1154 CG LEU A 78 71.180 28.966 47.336 1.00 0.00 C ATOM 1155 CD1 LEU A 78 70.114 29.267 48.379 1.00 0.00 C ATOM 1156 CD2 LEU A 78 71.830 27.642 47.733 1.00 0.00 C ATOM 0 H LEU A 78 72.897 30.220 45.066 1.00 0.00 H new ATOM 0 HA LEU A 78 71.520 27.687 44.491 1.00 0.00 H new ATOM 0 HB2 LEU A 78 70.084 29.985 45.808 1.00 0.00 H new ATOM 0 HB3 LEU A 78 69.743 28.270 45.913 1.00 0.00 H new ATOM 0 HG LEU A 78 71.975 29.710 47.296 1.00 0.00 H new ATOM 0 HD11 LEU A 78 70.560 29.239 49.373 1.00 0.00 H new ATOM 0 HD12 LEU A 78 69.695 30.257 48.196 1.00 0.00 H new ATOM 0 HD13 LEU A 78 69.322 28.521 48.316 1.00 0.00 H new ATOM 0 HD21 LEU A 78 72.244 27.727 48.738 1.00 0.00 H new ATOM 0 HD22 LEU A 78 71.082 26.849 47.714 1.00 0.00 H new ATOM 0 HD23 LEU A 78 72.629 27.404 47.031 1.00 0.00 H new ATOM 1168 N GLY A 79 71.334 30.578 43.053 1.00 0.00 N ATOM 1169 CA GLY A 79 70.828 31.263 41.867 1.00 0.00 C ATOM 1170 C GLY A 79 71.547 30.799 40.611 1.00 0.00 C ATOM 1171 O GLY A 79 72.520 30.057 40.662 1.00 0.00 O ATOM 0 H GLY A 79 72.112 31.053 43.510 1.00 0.00 H new ATOM 0 HA2 GLY A 79 69.759 31.077 41.766 1.00 0.00 H new ATOM 0 HA3 GLY A 79 70.955 32.339 41.984 1.00 0.00 H new ATOM 1175 N HIS A 80 71.016 31.186 39.466 1.00 0.00 N ATOM 1176 CA HIS A 80 71.437 30.742 38.146 1.00 0.00 C ATOM 1177 C HIS A 80 71.333 31.861 37.102 1.00 0.00 C ATOM 1178 O HIS A 80 70.599 32.834 37.273 1.00 0.00 O ATOM 1179 CB HIS A 80 70.537 29.587 37.728 1.00 0.00 C ATOM 1180 CG HIS A 80 70.846 28.232 38.323 1.00 0.00 C ATOM 1181 ND1 HIS A 80 70.834 27.866 39.653 1.00 0.00 N ATOM 1182 CD2 HIS A 80 71.166 27.109 37.612 1.00 0.00 C ATOM 1183 CE1 HIS A 80 71.159 26.569 39.741 1.00 0.00 C ATOM 1184 NE2 HIS A 80 71.336 26.051 38.514 1.00 0.00 N ATOM 0 H HIS A 80 70.243 31.850 39.427 1.00 0.00 H new ATOM 0 HA HIS A 80 72.482 30.438 38.199 1.00 0.00 H new ATOM 0 HB2 HIS A 80 69.510 29.846 37.987 1.00 0.00 H new ATOM 0 HB3 HIS A 80 70.579 29.499 36.642 1.00 0.00 H new ATOM 0 HD1 HIS A 80 70.615 28.480 40.438 1.00 0.00 H new ATOM 0 HD2 HIS A 80 71.270 27.048 36.539 1.00 0.00 H new ATOM 0 HE1 HIS A 80 71.264 26.019 40.665 1.00 0.00 H new ATOM 1192 N GLU A 81 72.004 31.648 35.975 1.00 0.00 N ATOM 1193 CA GLU A 81 71.801 32.308 34.697 1.00 0.00 C ATOM 1194 C GLU A 81 71.840 31.235 33.607 1.00 0.00 C ATOM 1195 O GLU A 81 72.769 30.434 33.518 1.00 0.00 O ATOM 1196 CB GLU A 81 72.908 33.332 34.458 1.00 0.00 C ATOM 1197 CG GLU A 81 72.464 34.541 33.610 1.00 0.00 C ATOM 1198 CD GLU A 81 71.774 34.190 32.285 1.00 0.00 C ATOM 1199 OE1 GLU A 81 70.558 33.898 32.318 1.00 0.00 O ATOM 1200 OE2 GLU A 81 72.447 34.185 31.238 1.00 0.00 O ATOM 0 H GLU A 81 72.756 30.961 35.931 1.00 0.00 H new ATOM 0 HA GLU A 81 70.844 32.829 34.685 1.00 0.00 H new ATOM 0 HB2 GLU A 81 73.273 33.690 35.421 1.00 0.00 H new ATOM 0 HB3 GLU A 81 73.745 32.840 33.962 1.00 0.00 H new ATOM 0 HG2 GLU A 81 71.785 35.152 34.205 1.00 0.00 H new ATOM 0 HG3 GLU A 81 73.339 35.155 33.395 1.00 0.00 H new ATOM 1207 N PHE A 82 70.823 31.213 32.772 1.00 0.00 N ATOM 1208 CA PHE A 82 70.734 30.303 31.620 1.00 0.00 C ATOM 1209 C PHE A 82 71.484 30.869 30.385 1.00 0.00 C ATOM 1210 O PHE A 82 70.881 31.242 29.373 1.00 0.00 O ATOM 1211 CB PHE A 82 69.243 29.965 31.392 1.00 0.00 C ATOM 1212 CG PHE A 82 68.938 28.589 30.817 1.00 0.00 C ATOM 1213 CD1 PHE A 82 69.312 28.258 29.502 1.00 0.00 C ATOM 1214 CD2 PHE A 82 68.242 27.638 31.594 1.00 0.00 C ATOM 1215 CE1 PHE A 82 69.008 26.991 28.972 1.00 0.00 C ATOM 1216 CE2 PHE A 82 67.929 26.373 31.062 1.00 0.00 C ATOM 1217 CZ PHE A 82 68.317 26.048 29.750 1.00 0.00 C ATOM 0 H PHE A 82 70.017 31.831 32.865 1.00 0.00 H new ATOM 0 HA PHE A 82 71.251 29.364 31.817 1.00 0.00 H new ATOM 0 HB2 PHE A 82 68.722 30.059 32.345 1.00 0.00 H new ATOM 0 HB3 PHE A 82 68.822 30.715 30.723 1.00 0.00 H new ATOM 0 HD1 PHE A 82 69.836 28.982 28.895 1.00 0.00 H new ATOM 0 HD2 PHE A 82 67.948 27.883 32.604 1.00 0.00 H new ATOM 0 HE1 PHE A 82 69.307 26.743 27.964 1.00 0.00 H new ATOM 0 HE2 PHE A 82 67.391 25.653 31.661 1.00 0.00 H new ATOM 0 HZ PHE A 82 68.084 25.076 29.342 1.00 0.00 H new ATOM 1227 N LEU A 83 72.813 30.993 30.497 1.00 0.00 N ATOM 1228 CA LEU A 83 73.652 31.797 29.603 1.00 0.00 C ATOM 1229 C LEU A 83 74.045 31.106 28.288 1.00 0.00 C ATOM 1230 O LEU A 83 74.258 29.904 28.174 1.00 0.00 O ATOM 1231 CB LEU A 83 74.911 32.270 30.359 1.00 0.00 C ATOM 1232 CG LEU A 83 75.751 33.408 29.734 1.00 0.00 C ATOM 1233 CD1 LEU A 83 75.009 34.730 29.541 1.00 0.00 C ATOM 1234 CD2 LEU A 83 76.972 33.687 30.613 1.00 0.00 C ATOM 0 H LEU A 83 73.346 30.525 31.230 1.00 0.00 H new ATOM 0 HA LEU A 83 73.038 32.646 29.303 1.00 0.00 H new ATOM 0 HB2 LEU A 83 74.602 32.591 31.354 1.00 0.00 H new ATOM 0 HB3 LEU A 83 75.564 31.407 30.492 1.00 0.00 H new ATOM 0 HG LEU A 83 76.020 33.045 28.742 1.00 0.00 H new ATOM 0 HD11 LEU A 83 75.682 35.464 29.097 1.00 0.00 H new ATOM 0 HD12 LEU A 83 74.155 34.575 28.881 1.00 0.00 H new ATOM 0 HD13 LEU A 83 74.660 35.096 30.507 1.00 0.00 H new ATOM 0 HD21 LEU A 83 77.563 34.489 30.171 1.00 0.00 H new ATOM 0 HD22 LEU A 83 76.643 33.985 31.609 1.00 0.00 H new ATOM 0 HD23 LEU A 83 77.581 32.786 30.686 1.00 0.00 H new ATOM 1246 N ASN A 84 74.279 31.976 27.316 1.00 0.00 N ATOM 1247 CA ASN A 84 74.613 31.779 25.899 1.00 0.00 C ATOM 1248 C ASN A 84 73.509 31.147 25.036 1.00 0.00 C ATOM 1249 O ASN A 84 73.645 31.072 23.814 1.00 0.00 O ATOM 1250 CB ASN A 84 75.953 31.062 25.718 1.00 0.00 C ATOM 1251 CG ASN A 84 77.085 31.505 26.592 1.00 0.00 C ATOM 1252 OD1 ASN A 84 77.859 32.395 26.275 1.00 0.00 O ATOM 1253 ND2 ASN A 84 77.258 30.778 27.662 1.00 0.00 N ATOM 0 H ASN A 84 74.234 32.973 27.525 1.00 0.00 H new ATOM 0 HA ASN A 84 74.708 32.793 25.511 1.00 0.00 H new ATOM 0 HB2 ASN A 84 75.793 29.997 25.886 1.00 0.00 H new ATOM 0 HB3 ASN A 84 76.262 31.178 24.679 1.00 0.00 H new ATOM 0 HD21 ASN A 84 78.062 30.944 28.267 1.00 0.00 H new ATOM 0 HD22 ASN A 84 76.589 30.044 27.893 1.00 0.00 H new ATOM 1260 N ASP A 85 72.402 30.748 25.653 1.00 0.00 N ATOM 1261 CA ASP A 85 71.300 30.043 24.984 1.00 0.00 C ATOM 1262 C ASP A 85 70.361 30.994 24.225 1.00 0.00 C ATOM 1263 O ASP A 85 69.790 30.643 23.193 1.00 0.00 O ATOM 1264 CB ASP A 85 70.543 29.212 26.032 1.00 0.00 C ATOM 1265 CG ASP A 85 69.539 28.250 25.394 1.00 0.00 C ATOM 1266 OD1 ASP A 85 69.930 27.119 25.026 1.00 0.00 O ATOM 1267 OD2 ASP A 85 68.354 28.621 25.226 1.00 0.00 O ATOM 0 H ASP A 85 72.237 30.905 26.647 1.00 0.00 H new ATOM 0 HA ASP A 85 71.718 29.384 24.223 1.00 0.00 H new ATOM 0 HB2 ASP A 85 71.258 28.645 26.628 1.00 0.00 H new ATOM 0 HB3 ASP A 85 70.019 29.881 26.714 1.00 0.00 H new ATOM 1272 N GLY A 86 70.222 32.218 24.734 1.00 0.00 N ATOM 1273 CA GLY A 86 69.165 33.151 24.369 1.00 0.00 C ATOM 1274 C GLY A 86 69.482 34.466 23.637 1.00 0.00 C ATOM 1275 O GLY A 86 68.549 35.261 23.514 1.00 0.00 O ATOM 0 H GLY A 86 70.863 32.595 25.432 1.00 0.00 H new ATOM 0 HA2 GLY A 86 68.457 32.603 23.747 1.00 0.00 H new ATOM 0 HA3 GLY A 86 68.643 33.416 25.288 1.00 0.00 H new ATOM 1279 N PRO A 87 70.708 34.759 23.153 1.00 0.00 N ATOM 1280 CA PRO A 87 71.287 36.115 23.129 1.00 0.00 C ATOM 1281 C PRO A 87 70.512 37.231 22.412 1.00 0.00 C ATOM 1282 O PRO A 87 70.719 38.403 22.717 1.00 0.00 O ATOM 1283 CB PRO A 87 72.679 35.945 22.504 1.00 0.00 C ATOM 1284 CG PRO A 87 72.641 34.584 21.810 1.00 0.00 C ATOM 1285 CD PRO A 87 71.706 33.796 22.715 1.00 0.00 C ATOM 0 HA PRO A 87 71.276 36.479 24.156 1.00 0.00 H new ATOM 0 HB2 PRO A 87 72.892 36.744 21.794 1.00 0.00 H new ATOM 0 HB3 PRO A 87 73.459 35.978 23.264 1.00 0.00 H new ATOM 0 HG2 PRO A 87 72.259 34.655 20.791 1.00 0.00 H new ATOM 0 HG3 PRO A 87 73.630 34.129 21.749 1.00 0.00 H new ATOM 0 HD2 PRO A 87 71.245 32.966 22.180 1.00 0.00 H new ATOM 0 HD3 PRO A 87 72.243 33.370 23.563 1.00 0.00 H new ATOM 1293 N LYS A 88 69.649 36.896 21.450 1.00 0.00 N ATOM 1294 CA LYS A 88 68.800 37.849 20.726 1.00 0.00 C ATOM 1295 C LYS A 88 67.508 38.272 21.436 1.00 0.00 C ATOM 1296 O LYS A 88 67.035 39.386 21.220 1.00 0.00 O ATOM 1297 CB LYS A 88 68.521 37.323 19.312 1.00 0.00 C ATOM 1298 CG LYS A 88 69.755 37.429 18.414 1.00 0.00 C ATOM 1299 CD LYS A 88 69.354 37.607 16.949 1.00 0.00 C ATOM 1300 CE LYS A 88 68.769 39.009 16.729 1.00 0.00 C ATOM 1301 NZ LYS A 88 68.593 39.294 15.291 1.00 0.00 N ATOM 0 H LYS A 88 69.517 35.932 21.145 1.00 0.00 H new ATOM 0 HA LYS A 88 69.375 38.774 20.681 1.00 0.00 H new ATOM 0 HB2 LYS A 88 68.200 36.283 19.368 1.00 0.00 H new ATOM 0 HB3 LYS A 88 67.700 37.887 18.870 1.00 0.00 H new ATOM 0 HG2 LYS A 88 70.369 38.272 18.732 1.00 0.00 H new ATOM 0 HG3 LYS A 88 70.365 36.532 18.521 1.00 0.00 H new ATOM 0 HD2 LYS A 88 70.222 37.462 16.306 1.00 0.00 H new ATOM 0 HD3 LYS A 88 68.621 36.850 16.670 1.00 0.00 H new ATOM 0 HE2 LYS A 88 67.809 39.089 17.239 1.00 0.00 H new ATOM 0 HE3 LYS A 88 69.429 39.755 17.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 68.196 40.248 15.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 69.514 39.240 14.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 67.945 38.595 14.875 1.00 0.00 H new ATOM 1315 N ARG A 89 66.896 37.374 22.204 1.00 0.00 N ATOM 1316 CA ARG A 89 65.668 37.531 22.962 1.00 0.00 C ATOM 1317 C ARG A 89 65.882 38.028 24.400 1.00 0.00 C ATOM 1318 O ARG A 89 66.994 38.272 24.840 1.00 0.00 O ATOM 1319 CB ARG A 89 64.963 36.174 22.914 1.00 0.00 C ATOM 1320 CG ARG A 89 64.196 36.003 21.629 1.00 0.00 C ATOM 1321 CD ARG A 89 64.958 35.549 20.386 1.00 0.00 C ATOM 1322 NE ARG A 89 64.013 35.224 19.297 1.00 0.00 N ATOM 1323 CZ ARG A 89 63.269 34.130 19.205 1.00 0.00 C ATOM 1324 NH1 ARG A 89 63.337 33.134 20.038 1.00 0.00 N ATOM 1325 NH2 ARG A 89 62.381 33.996 18.266 1.00 0.00 N ATOM 0 H ARG A 89 67.285 36.438 22.318 1.00 0.00 H new ATOM 0 HA ARG A 89 65.056 38.315 22.516 1.00 0.00 H new ATOM 0 HB2 ARG A 89 65.699 35.376 23.010 1.00 0.00 H new ATOM 0 HB3 ARG A 89 64.283 36.085 23.761 1.00 0.00 H new ATOM 0 HG2 ARG A 89 63.398 35.283 21.811 1.00 0.00 H new ATOM 0 HG3 ARG A 89 63.719 36.955 21.397 1.00 0.00 H new ATOM 0 HD2 ARG A 89 65.641 36.335 20.062 1.00 0.00 H new ATOM 0 HD3 ARG A 89 65.566 34.676 20.622 1.00 0.00 H new ATOM 0 HE ARG A 89 63.925 35.906 18.544 1.00 0.00 H new ATOM 0 HH11 ARG A 89 63.992 33.166 20.819 1.00 0.00 H new ATOM 0 HH12 ARG A 89 62.735 32.320 19.910 1.00 0.00 H new ATOM 0 HH21 ARG A 89 62.246 34.740 17.582 1.00 0.00 H new ATOM 0 HH22 ARG A 89 61.819 33.146 18.213 1.00 0.00 H new ATOM 1339 N GLY A 90 64.780 38.079 25.155 1.00 0.00 N ATOM 1340 CA GLY A 90 64.738 38.043 26.613 1.00 0.00 C ATOM 1341 C GLY A 90 64.914 36.645 27.230 1.00 0.00 C ATOM 1342 O GLY A 90 64.632 36.433 28.410 1.00 0.00 O ATOM 0 H GLY A 90 63.850 38.150 24.742 1.00 0.00 H new ATOM 0 HA2 GLY A 90 65.519 38.697 27.001 1.00 0.00 H new ATOM 0 HA3 GLY A 90 63.785 38.454 26.945 1.00 0.00 H new ATOM 1346 N GLN A 91 65.281 35.662 26.410 1.00 0.00 N ATOM 1347 CA GLN A 91 65.976 34.445 26.802 1.00 0.00 C ATOM 1348 C GLN A 91 67.351 34.798 27.407 1.00 0.00 C ATOM 1349 O GLN A 91 67.873 35.874 27.142 1.00 0.00 O ATOM 1350 CB GLN A 91 66.115 33.540 25.567 1.00 0.00 C ATOM 1351 CG GLN A 91 64.826 32.917 25.017 1.00 0.00 C ATOM 1352 CD GLN A 91 64.998 32.468 23.563 1.00 0.00 C ATOM 1353 OE1 GLN A 91 64.459 33.073 22.648 1.00 0.00 O ATOM 1354 NE2 GLN A 91 65.767 31.445 23.270 1.00 0.00 N ATOM 0 H GLN A 91 65.091 35.697 25.408 1.00 0.00 H new ATOM 0 HA GLN A 91 65.411 33.911 27.566 1.00 0.00 H new ATOM 0 HB2 GLN A 91 66.578 34.122 24.770 1.00 0.00 H new ATOM 0 HB3 GLN A 91 66.804 32.732 25.814 1.00 0.00 H new ATOM 0 HG2 GLN A 91 64.542 32.063 25.632 1.00 0.00 H new ATOM 0 HG3 GLN A 91 64.014 33.641 25.082 1.00 0.00 H new ATOM 0 HE21 GLN A 91 66.228 30.924 24.016 1.00 0.00 H new ATOM 0 HE22 GLN A 91 65.903 31.172 22.297 1.00 0.00 H new ATOM 1363 N SER A 92 67.918 33.908 28.226 1.00 0.00 N ATOM 1364 CA SER A 92 69.057 34.177 29.117 1.00 0.00 C ATOM 1365 C SER A 92 68.798 35.375 30.047 1.00 0.00 C ATOM 1366 O SER A 92 69.094 36.541 29.768 1.00 0.00 O ATOM 1367 CB SER A 92 70.357 34.307 28.342 1.00 0.00 C ATOM 1368 OG SER A 92 70.624 33.144 27.568 1.00 0.00 O ATOM 0 H SER A 92 67.587 32.945 28.291 1.00 0.00 H new ATOM 0 HA SER A 92 69.168 33.310 29.768 1.00 0.00 H new ATOM 0 HB2 SER A 92 70.305 35.177 27.687 1.00 0.00 H new ATOM 0 HB3 SER A 92 71.179 34.479 29.036 1.00 0.00 H new ATOM 0 HG SER A 92 70.894 32.412 28.161 1.00 0.00 H new ATOM 1374 N ARG A 93 68.172 35.037 31.169 1.00 0.00 N ATOM 1375 CA ARG A 93 67.864 35.900 32.314 1.00 0.00 C ATOM 1376 C ARG A 93 68.174 35.135 33.600 1.00 0.00 C ATOM 1377 O ARG A 93 67.915 33.931 33.686 1.00 0.00 O ATOM 1378 CB ARG A 93 66.415 36.431 32.271 1.00 0.00 C ATOM 1379 CG ARG A 93 65.309 35.479 32.773 1.00 0.00 C ATOM 1380 CD ARG A 93 64.999 34.304 31.838 1.00 0.00 C ATOM 1381 NE ARG A 93 64.201 34.754 30.681 1.00 0.00 N ATOM 1382 CZ ARG A 93 62.901 34.597 30.502 1.00 0.00 C ATOM 1383 NH1 ARG A 93 62.149 33.878 31.285 1.00 0.00 N ATOM 1384 NH2 ARG A 93 62.332 35.197 29.500 1.00 0.00 N ATOM 0 H ARG A 93 67.840 34.084 31.317 1.00 0.00 H new ATOM 0 HA ARG A 93 68.492 36.790 32.275 1.00 0.00 H new ATOM 0 HB2 ARG A 93 66.371 37.345 32.863 1.00 0.00 H new ATOM 0 HB3 ARG A 93 66.185 36.706 31.242 1.00 0.00 H new ATOM 0 HG2 ARG A 93 65.603 35.084 33.745 1.00 0.00 H new ATOM 0 HG3 ARG A 93 64.396 36.054 32.926 1.00 0.00 H new ATOM 0 HD2 ARG A 93 65.929 33.854 31.491 1.00 0.00 H new ATOM 0 HD3 ARG A 93 64.455 33.533 32.383 1.00 0.00 H new ATOM 0 HE ARG A 93 64.707 35.238 29.940 1.00 0.00 H new ATOM 0 HH11 ARG A 93 62.559 33.399 32.087 1.00 0.00 H new ATOM 0 HH12 ARG A 93 61.150 33.794 31.096 1.00 0.00 H new ATOM 0 HH21 ARG A 93 62.887 35.776 28.870 1.00 0.00 H new ATOM 0 HH22 ARG A 93 61.330 35.089 29.343 1.00 0.00 H new ATOM 1398 N PHE A 94 68.643 35.841 34.620 1.00 0.00 N ATOM 1399 CA PHE A 94 68.974 35.246 35.895 1.00 0.00 C ATOM 1400 C PHE A 94 67.693 34.897 36.664 1.00 0.00 C ATOM 1401 O PHE A 94 66.713 35.649 36.667 1.00 0.00 O ATOM 1402 CB PHE A 94 69.779 36.245 36.741 1.00 0.00 C ATOM 1403 CG PHE A 94 71.163 36.630 36.258 1.00 0.00 C ATOM 1404 CD1 PHE A 94 71.323 37.645 35.294 1.00 0.00 C ATOM 1405 CD2 PHE A 94 72.300 36.012 36.815 1.00 0.00 C ATOM 1406 CE1 PHE A 94 72.612 38.021 34.876 1.00 0.00 C ATOM 1407 CE2 PHE A 94 73.589 36.394 36.398 1.00 0.00 C ATOM 1408 CZ PHE A 94 73.745 37.392 35.420 1.00 0.00 C ATOM 0 H PHE A 94 68.803 36.848 34.580 1.00 0.00 H new ATOM 0 HA PHE A 94 69.558 34.344 35.712 1.00 0.00 H new ATOM 0 HB2 PHE A 94 69.190 37.158 36.831 1.00 0.00 H new ATOM 0 HB3 PHE A 94 69.878 35.830 37.744 1.00 0.00 H new ATOM 0 HD1 PHE A 94 70.456 38.134 34.876 1.00 0.00 H new ATOM 0 HD2 PHE A 94 72.182 35.243 37.564 1.00 0.00 H new ATOM 0 HE1 PHE A 94 72.732 38.796 34.134 1.00 0.00 H new ATOM 0 HE2 PHE A 94 74.458 35.920 36.829 1.00 0.00 H new ATOM 0 HZ PHE A 94 74.733 37.675 35.088 1.00 0.00 H new ATOM 1418 N CYS A 95 67.736 33.788 37.394 1.00 0.00 N ATOM 1419 CA CYS A 95 66.707 33.393 38.349 1.00 0.00 C ATOM 1420 C CYS A 95 67.353 32.898 39.656 1.00 0.00 C ATOM 1421 O CYS A 95 68.428 32.298 39.630 1.00 0.00 O ATOM 1422 CB CYS A 95 65.826 32.328 37.691 1.00 0.00 C ATOM 1423 SG CYS A 95 64.318 32.068 38.669 1.00 0.00 S ATOM 0 H CYS A 95 68.507 33.122 37.337 1.00 0.00 H new ATOM 0 HA CYS A 95 66.081 34.244 38.618 1.00 0.00 H new ATOM 0 HB2 CYS A 95 65.563 32.638 36.679 1.00 0.00 H new ATOM 0 HB3 CYS A 95 66.378 31.392 37.605 1.00 0.00 H new ATOM 0 HG CYS A 95 63.580 31.164 38.097 1.00 0.00 H new ATOM 1429 N ILE A 96 66.731 33.154 40.808 1.00 0.00 N ATOM 1430 CA ILE A 96 67.316 32.920 42.134 1.00 0.00 C ATOM 1431 C ILE A 96 66.333 32.267 43.119 1.00 0.00 C ATOM 1432 O ILE A 96 65.118 32.347 42.949 1.00 0.00 O ATOM 1433 CB ILE A 96 67.839 34.273 42.645 1.00 0.00 C ATOM 1434 CG1 ILE A 96 68.891 34.108 43.755 1.00 0.00 C ATOM 1435 CG2 ILE A 96 66.714 35.223 43.098 1.00 0.00 C ATOM 1436 CD1 ILE A 96 69.883 35.275 43.823 1.00 0.00 C ATOM 0 H ILE A 96 65.787 33.538 40.849 1.00 0.00 H new ATOM 0 HA ILE A 96 68.132 32.202 42.052 1.00 0.00 H new ATOM 0 HB ILE A 96 68.324 34.738 41.787 1.00 0.00 H new ATOM 0 HG12 ILE A 96 68.385 34.013 44.716 1.00 0.00 H new ATOM 0 HG13 ILE A 96 69.441 33.181 43.591 1.00 0.00 H new ATOM 0 HG21 ILE A 96 67.148 36.160 43.447 1.00 0.00 H new ATOM 0 HG22 ILE A 96 66.047 35.422 42.260 1.00 0.00 H new ATOM 0 HG23 ILE A 96 66.151 34.760 43.908 1.00 0.00 H new ATOM 0 HD11 ILE A 96 70.599 35.098 44.626 1.00 0.00 H new ATOM 0 HD12 ILE A 96 70.414 35.357 42.875 1.00 0.00 H new ATOM 0 HD13 ILE A 96 69.342 36.201 44.017 1.00 0.00 H new ATOM 1448 N PHE A 97 66.866 31.678 44.192 1.00 0.00 N ATOM 1449 CA PHE A 97 66.076 31.184 45.330 1.00 0.00 C ATOM 1450 C PHE A 97 65.829 32.264 46.391 1.00 0.00 C ATOM 1451 O PHE A 97 66.723 33.044 46.714 1.00 0.00 O ATOM 1452 CB PHE A 97 66.746 29.963 45.980 1.00 0.00 C ATOM 1453 CG PHE A 97 66.230 28.630 45.472 1.00 0.00 C ATOM 1454 CD1 PHE A 97 66.587 28.166 44.192 1.00 0.00 C ATOM 1455 CD2 PHE A 97 65.361 27.861 46.274 1.00 0.00 C ATOM 1456 CE1 PHE A 97 66.073 26.947 43.715 1.00 0.00 C ATOM 1457 CE2 PHE A 97 64.852 26.640 45.797 1.00 0.00 C ATOM 1458 CZ PHE A 97 65.204 26.185 44.515 1.00 0.00 C ATOM 0 H PHE A 97 67.869 31.527 44.299 1.00 0.00 H new ATOM 0 HA PHE A 97 65.108 30.891 44.924 1.00 0.00 H new ATOM 0 HB2 PHE A 97 67.821 30.015 45.805 1.00 0.00 H new ATOM 0 HB3 PHE A 97 66.596 30.011 47.059 1.00 0.00 H new ATOM 0 HD1 PHE A 97 67.257 28.747 43.575 1.00 0.00 H new ATOM 0 HD2 PHE A 97 65.086 28.211 47.258 1.00 0.00 H new ATOM 0 HE1 PHE A 97 66.347 26.595 42.731 1.00 0.00 H new ATOM 0 HE2 PHE A 97 64.191 26.052 46.416 1.00 0.00 H new ATOM 0 HZ PHE A 97 64.807 25.251 44.145 1.00 0.00 H new ATOM 1468 N SER A 98 64.662 32.194 47.034 1.00 0.00 N ATOM 1469 CA SER A 98 64.287 32.951 48.242 1.00 0.00 C ATOM 1470 C SER A 98 65.216 32.714 49.446 1.00 0.00 C ATOM 1471 O SER A 98 65.437 33.617 50.246 1.00 0.00 O ATOM 1472 CB SER A 98 62.848 32.585 48.594 1.00 0.00 C ATOM 1473 OG SER A 98 62.683 31.173 48.627 1.00 0.00 O ATOM 0 H SER A 98 63.913 31.580 46.715 1.00 0.00 H new ATOM 0 HA SER A 98 64.386 34.013 48.016 1.00 0.00 H new ATOM 0 HB2 SER A 98 62.586 33.010 49.563 1.00 0.00 H new ATOM 0 HB3 SER A 98 62.167 33.019 47.861 1.00 0.00 H new ATOM 0 HG SER A 98 61.755 30.957 48.856 1.00 0.00 H new ATOM 1479 N SER A 99 65.842 31.535 49.532 1.00 0.00 N ATOM 1480 CA SER A 99 66.886 31.221 50.526 1.00 0.00 C ATOM 1481 C SER A 99 68.289 31.750 50.143 1.00 0.00 C ATOM 1482 O SER A 99 69.243 31.655 50.915 1.00 0.00 O ATOM 1483 CB SER A 99 66.858 29.721 50.808 1.00 0.00 C ATOM 1484 OG SER A 99 67.540 29.397 52.000 1.00 0.00 O ATOM 0 H SER A 99 65.637 30.757 48.905 1.00 0.00 H new ATOM 0 HA SER A 99 66.660 31.757 51.448 1.00 0.00 H new ATOM 0 HB2 SER A 99 65.824 29.384 50.878 1.00 0.00 H new ATOM 0 HB3 SER A 99 67.311 29.186 49.973 1.00 0.00 H new ATOM 0 HG SER A 99 68.394 29.876 52.029 1.00 0.00 H new ATOM 1490 N SER A 100 68.452 32.330 48.944 1.00 0.00 N ATOM 1491 CA SER A 100 69.710 32.938 48.495 1.00 0.00 C ATOM 1492 C SER A 100 69.856 34.396 48.915 1.00 0.00 C ATOM 1493 O SER A 100 70.963 34.825 49.234 1.00 0.00 O ATOM 1494 CB SER A 100 69.871 32.837 46.991 1.00 0.00 C ATOM 1495 OG SER A 100 71.235 32.933 46.626 1.00 0.00 O ATOM 0 H SER A 100 67.704 32.390 48.253 1.00 0.00 H new ATOM 0 HA SER A 100 70.497 32.367 48.988 1.00 0.00 H new ATOM 0 HB2 SER A 100 69.461 31.890 46.639 1.00 0.00 H new ATOM 0 HB3 SER A 100 69.303 33.630 46.505 1.00 0.00 H new ATOM 0 HG SER A 100 71.319 32.864 45.652 1.00 0.00 H new ATOM 1501 N LEU A 101 68.756 35.154 48.877 1.00 0.00 N ATOM 1502 CA LEU A 101 68.637 36.518 49.376 1.00 0.00 C ATOM 1503 C LEU A 101 67.172 36.921 49.598 1.00 0.00 C ATOM 1504 O LEU A 101 66.255 36.352 49.007 1.00 0.00 O ATOM 1505 CB LEU A 101 69.397 37.504 48.478 1.00 0.00 C ATOM 1506 CG LEU A 101 69.298 37.365 46.947 1.00 0.00 C ATOM 1507 CD1 LEU A 101 67.873 37.521 46.414 1.00 0.00 C ATOM 1508 CD2 LEU A 101 70.156 38.457 46.305 1.00 0.00 C ATOM 0 H LEU A 101 67.883 34.811 48.476 1.00 0.00 H new ATOM 0 HA LEU A 101 69.110 36.557 50.357 1.00 0.00 H new ATOM 0 HB2 LEU A 101 69.061 38.508 48.737 1.00 0.00 H new ATOM 0 HB3 LEU A 101 70.452 37.442 48.744 1.00 0.00 H new ATOM 0 HG LEU A 101 69.638 36.360 46.697 1.00 0.00 H new ATOM 0 HD11 LEU A 101 67.876 37.412 45.329 1.00 0.00 H new ATOM 0 HD12 LEU A 101 67.234 36.755 46.854 1.00 0.00 H new ATOM 0 HD13 LEU A 101 67.492 38.507 46.678 1.00 0.00 H new ATOM 0 HD21 LEU A 101 70.098 38.374 45.220 1.00 0.00 H new ATOM 0 HD22 LEU A 101 69.790 39.436 46.614 1.00 0.00 H new ATOM 0 HD23 LEU A 101 71.192 38.340 46.623 1.00 0.00 H new ATOM 1520 N LYS A 102 66.971 37.911 50.469 1.00 0.00 N ATOM 1521 CA LYS A 102 65.678 38.356 50.989 1.00 0.00 C ATOM 1522 C LYS A 102 65.198 39.639 50.308 1.00 0.00 C ATOM 1523 O LYS A 102 65.979 40.376 49.707 1.00 0.00 O ATOM 1524 CB LYS A 102 65.728 38.534 52.516 1.00 0.00 C ATOM 1525 CG LYS A 102 66.832 37.782 53.286 1.00 0.00 C ATOM 1526 CD LYS A 102 66.718 37.947 54.809 1.00 0.00 C ATOM 1527 CE LYS A 102 66.945 39.394 55.280 1.00 0.00 C ATOM 1528 NZ LYS A 102 65.746 39.973 55.930 1.00 0.00 N ATOM 0 H LYS A 102 67.747 38.452 50.851 1.00 0.00 H new ATOM 0 HA LYS A 102 64.954 37.575 50.758 1.00 0.00 H new ATOM 0 HB2 LYS A 102 65.836 39.598 52.727 1.00 0.00 H new ATOM 0 HB3 LYS A 102 64.765 38.225 52.922 1.00 0.00 H new ATOM 0 HG2 LYS A 102 66.785 36.722 53.036 1.00 0.00 H new ATOM 0 HG3 LYS A 102 67.807 38.143 52.959 1.00 0.00 H new ATOM 0 HD2 LYS A 102 65.730 37.618 55.131 1.00 0.00 H new ATOM 0 HD3 LYS A 102 67.445 37.295 55.294 1.00 0.00 H new ATOM 0 HE2 LYS A 102 67.781 39.418 55.979 1.00 0.00 H new ATOM 0 HE3 LYS A 102 67.225 40.011 54.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 65.950 40.948 56.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 64.953 39.976 55.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 65.492 39.402 56.761 1.00 0.00 H new ATOM 1542 N PHE A 103 63.912 39.939 50.471 1.00 0.00 N ATOM 1543 CA PHE A 103 63.246 41.145 50.020 1.00 0.00 C ATOM 1544 C PHE A 103 62.855 42.012 51.220 1.00 0.00 C ATOM 1545 O PHE A 103 62.243 41.549 52.191 1.00 0.00 O ATOM 1546 CB PHE A 103 62.024 40.743 49.190 1.00 0.00 C ATOM 1547 CG PHE A 103 61.252 41.893 48.566 1.00 0.00 C ATOM 1548 CD1 PHE A 103 61.881 42.769 47.660 1.00 0.00 C ATOM 1549 CD2 PHE A 103 59.890 42.076 48.875 1.00 0.00 C ATOM 1550 CE1 PHE A 103 61.153 43.815 47.065 1.00 0.00 C ATOM 1551 CE2 PHE A 103 59.161 43.116 48.271 1.00 0.00 C ATOM 1552 CZ PHE A 103 59.792 43.989 47.367 1.00 0.00 C ATOM 0 H PHE A 103 63.274 39.304 50.951 1.00 0.00 H new ATOM 0 HA PHE A 103 63.915 41.740 49.398 1.00 0.00 H new ATOM 0 HB2 PHE A 103 62.351 40.073 48.394 1.00 0.00 H new ATOM 0 HB3 PHE A 103 61.345 40.175 49.826 1.00 0.00 H new ATOM 0 HD1 PHE A 103 62.926 42.637 47.421 1.00 0.00 H new ATOM 0 HD2 PHE A 103 59.404 41.416 49.578 1.00 0.00 H new ATOM 0 HE1 PHE A 103 61.641 44.486 46.374 1.00 0.00 H new ATOM 0 HE2 PHE A 103 58.114 43.245 48.502 1.00 0.00 H new ATOM 0 HZ PHE A 103 59.233 44.790 46.907 1.00 0.00 H new ATOM 1562 N VAL A 104 63.218 43.283 51.116 1.00 0.00 N ATOM 1563 CA VAL A 104 62.814 44.373 52.005 1.00 0.00 C ATOM 1564 C VAL A 104 62.076 45.451 51.191 1.00 0.00 C ATOM 1565 O VAL A 104 62.699 46.173 50.408 1.00 0.00 O ATOM 1566 CB VAL A 104 64.013 44.883 52.832 1.00 0.00 C ATOM 1567 CG1 VAL A 104 65.132 45.580 52.049 1.00 0.00 C ATOM 1568 CG2 VAL A 104 63.546 45.810 53.958 1.00 0.00 C ATOM 0 H VAL A 104 63.836 43.603 50.370 1.00 0.00 H new ATOM 0 HA VAL A 104 62.102 44.018 52.750 1.00 0.00 H new ATOM 0 HB VAL A 104 64.455 43.967 53.223 1.00 0.00 H new ATOM 0 HG11 VAL A 104 65.917 45.893 52.737 1.00 0.00 H new ATOM 0 HG12 VAL A 104 65.547 44.889 51.315 1.00 0.00 H new ATOM 0 HG13 VAL A 104 64.728 46.454 51.537 1.00 0.00 H new ATOM 0 HG21 VAL A 104 64.409 46.156 54.526 1.00 0.00 H new ATOM 0 HG22 VAL A 104 63.025 46.667 53.531 1.00 0.00 H new ATOM 0 HG23 VAL A 104 62.870 45.268 54.619 1.00 0.00 H new ATOM 1578 N PRO A 105 60.737 45.539 51.279 1.00 0.00 N ATOM 1579 CA PRO A 105 59.977 46.515 50.508 1.00 0.00 C ATOM 1580 C PRO A 105 60.134 47.938 51.055 1.00 0.00 C ATOM 1581 O PRO A 105 60.628 48.156 52.166 1.00 0.00 O ATOM 1582 CB PRO A 105 58.524 46.033 50.534 1.00 0.00 C ATOM 1583 CG PRO A 105 58.439 45.270 51.853 1.00 0.00 C ATOM 1584 CD PRO A 105 59.834 44.667 52.015 1.00 0.00 C ATOM 0 HA PRO A 105 60.346 46.578 49.484 1.00 0.00 H new ATOM 0 HB2 PRO A 105 57.822 46.866 50.504 1.00 0.00 H new ATOM 0 HB3 PRO A 105 58.296 45.393 49.682 1.00 0.00 H new ATOM 0 HG2 PRO A 105 58.190 45.932 52.683 1.00 0.00 H new ATOM 0 HG3 PRO A 105 57.671 44.498 51.820 1.00 0.00 H new ATOM 0 HD2 PRO A 105 60.115 44.612 53.067 1.00 0.00 H new ATOM 0 HD3 PRO A 105 59.867 43.651 51.623 1.00 0.00 H new ATOM 1592 N LYS A 106 59.695 48.927 50.271 1.00 0.00 N ATOM 1593 CA LYS A 106 59.497 50.291 50.718 1.00 0.00 C ATOM 1594 C LYS A 106 58.334 50.432 51.700 1.00 0.00 C ATOM 1595 O LYS A 106 57.678 49.468 52.075 1.00 0.00 O ATOM 1596 CB LYS A 106 59.435 51.221 49.505 1.00 0.00 C ATOM 1597 CG LYS A 106 60.674 52.122 49.351 1.00 0.00 C ATOM 1598 CD LYS A 106 61.953 51.284 49.198 1.00 0.00 C ATOM 1599 CE LYS A 106 63.230 52.120 49.091 1.00 0.00 C ATOM 1600 NZ LYS A 106 63.586 52.467 47.698 1.00 0.00 N ATOM 0 H LYS A 106 59.465 48.789 49.287 1.00 0.00 H new ATOM 0 HA LYS A 106 60.356 50.603 51.312 1.00 0.00 H new ATOM 0 HB2 LYS A 106 59.320 50.620 48.603 1.00 0.00 H new ATOM 0 HB3 LYS A 106 58.548 51.849 49.585 1.00 0.00 H new ATOM 0 HG2 LYS A 106 60.552 52.767 48.481 1.00 0.00 H new ATOM 0 HG3 LYS A 106 60.764 52.773 50.221 1.00 0.00 H new ATOM 0 HD2 LYS A 106 62.040 50.612 50.052 1.00 0.00 H new ATOM 0 HD3 LYS A 106 61.863 50.660 48.309 1.00 0.00 H new ATOM 0 HE2 LYS A 106 63.105 53.037 49.666 1.00 0.00 H new ATOM 0 HE3 LYS A 106 64.055 51.570 49.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 64.459 53.033 47.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 63.735 51.595 47.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 62.815 53.017 47.269 1.00 0.00 H new