USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 758 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 84 LYS NZ :NH3+ 162:sc= 1.16 (180deg=0.889) USER MOD Set 1.2: A 85 TYR OH : rot 48:sc= 0.822 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0.0259 USER MOD Single : A 52 SER OG : rot 180:sc= 0.0445 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN :FLIP amide:sc= -1.5 F(o=-5.3!,f=-1.5) USER MOD Single : A 66 LYS NZ :NH3+ 158:sc= 0.949 (180deg=0.681) USER MOD Single : A 67 LYS NZ :NH3+ -156:sc= 0.582 (180deg=-0.404) USER MOD Single : A 68 TYR OH : rot 15:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.095) USER MOD Single : A 75 THR OG1 : rot -159:sc= 0.796 USER MOD Single : A 79 LYS NZ :NH3+ -163:sc= 1.11 (180deg=0.48) USER MOD Single : A 86 LYS NZ :NH3+ -160:sc= -0.0839 (180deg=-0.538) USER MOD Single : A 91 TYR OH : rot 30:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 162:sc= 1.28 (180deg=0.876) USER MOD Single : A 104 THR OG1 : rot 64:sc= 0.415 USER MOD Single : A 115 LYS NZ :NH3+ -163:sc= -0.614! (180deg=-2.47!) USER MOD Single : A 118 GLN :FLIP amide:sc= -0.12 F(o=-1.3!,f=-0.12) USER MOD Single : A 119 THR OG1 : rot 89:sc= 0.117 USER MOD Single : A 122 LYS NZ :NH3+ -159:sc= 1.27 (180deg=1.22) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ -135:sc= 1.11 (180deg=0.649) USER MOD Single : A 131 ASN : amide:sc= -0.0225 K(o=-0.022,f=-3.3!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 177:sc= 0.0241 (180deg=-0.0234) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 222 N PRO A 41 3.958 -10.393 -26.271 1.00 10.03 N ATOM 223 CA PRO A 41 5.413 -10.553 -26.382 1.00 34.31 C ATOM 224 C PRO A 41 5.799 -11.311 -27.649 1.00 44.02 C ATOM 225 O PRO A 41 5.006 -12.098 -28.171 1.00 2.24 O ATOM 226 CB PRO A 41 5.776 -11.379 -25.145 1.00 61.02 C ATOM 227 CG PRO A 41 4.676 -11.118 -24.179 1.00 21.24 C ATOM 228 CD PRO A 41 3.437 -10.951 -25.012 1.00 4.43 C ATOM 0 HA PRO A 41 5.931 -9.595 -26.437 1.00 34.31 H new ATOM 0 HB2 PRO A 41 5.849 -12.440 -25.385 1.00 61.02 H new ATOM 0 HB3 PRO A 41 6.741 -11.078 -24.737 1.00 61.02 H new ATOM 0 HG2 PRO A 41 4.567 -11.944 -23.476 1.00 21.24 H new ATOM 0 HG3 PRO A 41 4.876 -10.223 -23.590 1.00 21.24 H new ATOM 0 HD2 PRO A 41 2.927 -11.901 -25.172 1.00 4.43 H new ATOM 0 HD3 PRO A 41 2.720 -10.280 -24.539 1.00 4.43 H new ATOM 236 N LEU A 42 7.010 -11.071 -28.145 1.00 31.23 N ATOM 237 CA LEU A 42 7.484 -11.734 -29.357 1.00 32.41 C ATOM 238 C LEU A 42 7.444 -13.257 -29.207 1.00 62.05 C ATOM 239 O LEU A 42 8.174 -13.844 -28.411 1.00 22.13 O ATOM 240 CB LEU A 42 8.888 -11.231 -29.740 1.00 22.22 C ATOM 241 CG LEU A 42 9.933 -11.200 -28.615 1.00 23.44 C ATOM 242 CD1 LEU A 42 10.797 -12.453 -28.633 1.00 12.43 C ATOM 243 CD2 LEU A 42 10.799 -9.954 -28.733 1.00 61.42 C ATOM 0 H LEU A 42 7.679 -10.424 -27.728 1.00 31.23 H new ATOM 0 HA LEU A 42 6.809 -11.476 -30.173 1.00 32.41 H new ATOM 0 HB2 LEU A 42 9.269 -11.862 -30.543 1.00 22.22 H new ATOM 0 HB3 LEU A 42 8.791 -10.223 -30.144 1.00 22.22 H new ATOM 0 HG LEU A 42 9.404 -11.171 -27.662 1.00 23.44 H new ATOM 0 HD11 LEU A 42 11.527 -12.403 -27.826 1.00 12.43 H new ATOM 0 HD12 LEU A 42 10.166 -13.332 -28.498 1.00 12.43 H new ATOM 0 HD13 LEU A 42 11.317 -12.523 -29.589 1.00 12.43 H new ATOM 0 HD21 LEU A 42 11.535 -9.945 -27.929 1.00 61.42 H new ATOM 0 HD22 LEU A 42 11.312 -9.957 -29.695 1.00 61.42 H new ATOM 0 HD23 LEU A 42 10.171 -9.066 -28.660 1.00 61.42 H new ATOM 255 N ASP A 43 6.546 -13.883 -29.953 1.00 44.14 N ATOM 256 CA ASP A 43 6.361 -15.324 -29.878 1.00 62.03 C ATOM 257 C ASP A 43 6.001 -15.866 -31.259 1.00 3.20 C ATOM 258 O ASP A 43 6.114 -15.147 -32.253 1.00 71.12 O ATOM 259 CB ASP A 43 5.269 -15.662 -28.853 1.00 72.14 C ATOM 260 CG ASP A 43 5.356 -17.089 -28.337 1.00 71.03 C ATOM 261 OD1 ASP A 43 6.128 -17.339 -27.388 1.00 51.40 O ATOM 262 OD2 ASP A 43 4.651 -17.968 -28.873 1.00 33.44 O ATOM 0 H ASP A 43 5.932 -13.414 -30.619 1.00 44.14 H new ATOM 0 HA ASP A 43 7.289 -15.794 -29.551 1.00 62.03 H new ATOM 0 HB2 ASP A 43 5.343 -14.973 -28.012 1.00 72.14 H new ATOM 0 HB3 ASP A 43 4.291 -15.506 -29.308 1.00 72.14 H new ATOM 267 N ALA A 44 5.538 -17.109 -31.314 1.00 1.23 N ATOM 268 CA ALA A 44 5.261 -17.783 -32.580 1.00 32.35 C ATOM 269 C ALA A 44 4.170 -17.073 -33.378 1.00 25.10 C ATOM 270 O ALA A 44 4.108 -17.194 -34.601 1.00 1.02 O ATOM 271 CB ALA A 44 4.872 -19.229 -32.326 1.00 1.43 C ATOM 0 H ALA A 44 5.344 -17.677 -30.489 1.00 1.23 H new ATOM 0 HA ALA A 44 6.173 -17.753 -33.177 1.00 32.35 H new ATOM 0 HB1 ALA A 44 4.667 -19.723 -33.276 1.00 1.43 H new ATOM 0 HB2 ALA A 44 5.689 -19.742 -31.819 1.00 1.43 H new ATOM 0 HB3 ALA A 44 3.980 -19.261 -31.701 1.00 1.43 H new ATOM 277 N SER A 45 3.322 -16.331 -32.677 1.00 21.42 N ATOM 278 CA SER A 45 2.226 -15.600 -33.301 1.00 1.10 C ATOM 279 C SER A 45 2.734 -14.638 -34.379 1.00 50.12 C ATOM 280 O SER A 45 2.056 -14.396 -35.377 1.00 1.12 O ATOM 281 CB SER A 45 1.461 -14.831 -32.224 1.00 1.55 C ATOM 282 OG SER A 45 1.115 -15.693 -31.150 1.00 13.31 O ATOM 0 H SER A 45 3.374 -16.219 -31.664 1.00 21.42 H new ATOM 0 HA SER A 45 1.564 -16.315 -33.788 1.00 1.10 H new ATOM 0 HB2 SER A 45 2.071 -14.007 -31.855 1.00 1.55 H new ATOM 0 HB3 SER A 45 0.559 -14.393 -32.652 1.00 1.55 H new ATOM 0 HG SER A 45 0.627 -15.186 -30.468 1.00 13.31 H new ATOM 288 N PHE A 46 3.927 -14.095 -34.175 1.00 22.43 N ATOM 289 CA PHE A 46 4.521 -13.168 -35.129 1.00 1.43 C ATOM 290 C PHE A 46 5.011 -13.903 -36.379 1.00 72.33 C ATOM 291 O PHE A 46 4.943 -13.380 -37.490 1.00 40.53 O ATOM 292 CB PHE A 46 5.682 -12.413 -34.470 1.00 12.11 C ATOM 293 CG PHE A 46 6.299 -11.355 -35.342 1.00 70.41 C ATOM 294 CD1 PHE A 46 5.715 -10.105 -35.449 1.00 52.33 C ATOM 295 CD2 PHE A 46 7.462 -11.610 -36.055 1.00 24.13 C ATOM 296 CE1 PHE A 46 6.274 -9.129 -36.249 1.00 13.02 C ATOM 297 CE2 PHE A 46 8.026 -10.637 -36.858 1.00 2.40 C ATOM 298 CZ PHE A 46 7.431 -9.395 -36.955 1.00 73.31 C ATOM 0 H PHE A 46 4.504 -14.281 -33.355 1.00 22.43 H new ATOM 0 HA PHE A 46 3.756 -12.455 -35.435 1.00 1.43 H new ATOM 0 HB2 PHE A 46 5.324 -11.948 -33.551 1.00 12.11 H new ATOM 0 HB3 PHE A 46 6.453 -13.130 -34.186 1.00 12.11 H new ATOM 0 HD1 PHE A 46 4.810 -9.890 -34.900 1.00 52.33 H new ATOM 0 HD2 PHE A 46 7.932 -12.580 -35.981 1.00 24.13 H new ATOM 0 HE1 PHE A 46 5.807 -8.158 -36.323 1.00 13.02 H new ATOM 0 HE2 PHE A 46 8.931 -10.848 -37.409 1.00 2.40 H new ATOM 0 HZ PHE A 46 7.869 -8.633 -37.582 1.00 73.31 H new ATOM 308 N CYS A 47 5.468 -15.134 -36.190 1.00 63.24 N ATOM 309 CA CYS A 47 6.152 -15.874 -37.248 1.00 32.32 C ATOM 310 C CYS A 47 5.177 -16.593 -38.179 1.00 10.42 C ATOM 311 O CYS A 47 5.595 -17.330 -39.074 1.00 42.14 O ATOM 312 CB CYS A 47 7.119 -16.883 -36.630 1.00 40.34 C ATOM 313 SG CYS A 47 8.265 -16.143 -35.417 1.00 62.20 S ATOM 0 H CYS A 47 5.378 -15.644 -35.312 1.00 63.24 H new ATOM 0 HA CYS A 47 6.701 -15.150 -37.850 1.00 32.32 H new ATOM 0 HB2 CYS A 47 6.546 -17.672 -36.143 1.00 40.34 H new ATOM 0 HB3 CYS A 47 7.698 -17.354 -37.425 1.00 40.34 H new ATOM 318 N ARG A 48 3.883 -16.374 -37.973 1.00 63.21 N ATOM 319 CA ARG A 48 2.858 -17.013 -38.798 1.00 2.54 C ATOM 320 C ARG A 48 3.037 -16.656 -40.274 1.00 40.52 C ATOM 321 O ARG A 48 2.889 -17.504 -41.151 1.00 12.42 O ATOM 322 CB ARG A 48 1.458 -16.600 -38.344 1.00 54.34 C ATOM 323 CG ARG A 48 1.111 -17.031 -36.931 1.00 15.31 C ATOM 324 CD ARG A 48 -0.279 -16.556 -36.551 1.00 5.23 C ATOM 325 NE ARG A 48 -0.621 -16.866 -35.163 1.00 5.00 N ATOM 326 CZ ARG A 48 -1.661 -16.328 -34.523 1.00 24.13 C ATOM 327 NH1 ARG A 48 -2.459 -15.473 -35.154 1.00 60.32 N ATOM 328 NH2 ARG A 48 -1.908 -16.649 -33.261 1.00 33.32 N ATOM 0 H ARG A 48 3.517 -15.761 -37.244 1.00 63.21 H new ATOM 0 HA ARG A 48 2.970 -18.091 -38.679 1.00 2.54 H new ATOM 0 HB2 ARG A 48 1.371 -15.516 -38.413 1.00 54.34 H new ATOM 0 HB3 ARG A 48 0.726 -17.023 -39.031 1.00 54.34 H new ATOM 0 HG2 ARG A 48 1.163 -18.117 -36.854 1.00 15.31 H new ATOM 0 HG3 ARG A 48 1.843 -16.626 -36.232 1.00 15.31 H new ATOM 0 HD2 ARG A 48 -0.345 -15.479 -36.706 1.00 5.23 H new ATOM 0 HD3 ARG A 48 -1.011 -17.019 -37.213 1.00 5.23 H new ATOM 0 HE ARG A 48 -0.033 -17.529 -34.657 1.00 5.00 H new ATOM 0 HH11 ARG A 48 -2.276 -15.228 -36.127 1.00 60.32 H new ATOM 0 HH12 ARG A 48 -3.254 -15.062 -34.665 1.00 60.32 H new ATOM 0 HH21 ARG A 48 -1.302 -17.310 -32.775 1.00 33.32 H new ATOM 0 HH22 ARG A 48 -2.704 -16.235 -32.776 1.00 33.32 H new ATOM 342 N THR A 49 3.381 -15.402 -40.537 1.00 12.35 N ATOM 343 CA THR A 49 3.512 -14.916 -41.905 1.00 43.44 C ATOM 344 C THR A 49 4.890 -15.225 -42.492 1.00 65.54 C ATOM 345 O THR A 49 5.173 -14.888 -43.644 1.00 11.43 O ATOM 346 CB THR A 49 3.251 -13.400 -41.973 1.00 14.03 C ATOM 347 OG1 THR A 49 3.918 -12.742 -40.885 1.00 0.00 O ATOM 348 CG2 THR A 49 1.759 -13.102 -41.915 1.00 71.53 C ATOM 0 H THR A 49 3.575 -14.702 -39.821 1.00 12.35 H new ATOM 0 HA THR A 49 2.764 -15.440 -42.500 1.00 43.44 H new ATOM 0 HB THR A 49 3.641 -13.027 -42.920 1.00 14.03 H new ATOM 0 HG1 THR A 49 3.750 -11.778 -40.934 1.00 0.00 H new ATOM 0 HG21 THR A 49 1.601 -12.025 -41.965 1.00 71.53 H new ATOM 0 HG22 THR A 49 1.259 -13.581 -42.757 1.00 71.53 H new ATOM 0 HG23 THR A 49 1.347 -13.486 -40.982 1.00 71.53 H new ATOM 356 N ALA A 50 5.742 -15.875 -41.703 1.00 12.01 N ATOM 357 CA ALA A 50 7.079 -16.232 -42.157 1.00 10.02 C ATOM 358 C ALA A 50 7.030 -17.466 -43.052 1.00 41.11 C ATOM 359 O ALA A 50 7.773 -17.568 -44.027 1.00 65.22 O ATOM 360 CB ALA A 50 8.001 -16.463 -40.969 1.00 71.44 C ATOM 0 H ALA A 50 5.529 -16.164 -40.748 1.00 12.01 H new ATOM 0 HA ALA A 50 7.477 -15.403 -42.742 1.00 10.02 H new ATOM 0 HB1 ALA A 50 8.996 -16.729 -41.327 1.00 71.44 H new ATOM 0 HB2 ALA A 50 8.061 -15.553 -40.373 1.00 71.44 H new ATOM 0 HB3 ALA A 50 7.608 -17.273 -40.355 1.00 71.44 H new ATOM 366 N GLY A 51 6.161 -18.410 -42.706 1.00 32.42 N ATOM 367 CA GLY A 51 5.959 -19.575 -43.545 1.00 24.00 C ATOM 368 C GLY A 51 6.995 -20.651 -43.308 1.00 53.35 C ATOM 369 O GLY A 51 6.759 -21.589 -42.550 1.00 3.21 O ATOM 0 H GLY A 51 5.593 -18.388 -41.859 1.00 32.42 H new ATOM 0 HA2 GLY A 51 4.966 -19.985 -43.358 1.00 24.00 H new ATOM 0 HA3 GLY A 51 5.987 -19.273 -44.592 1.00 24.00 H new ATOM 373 N SER A 52 8.154 -20.506 -43.934 1.00 12.13 N ATOM 374 CA SER A 52 9.219 -21.494 -43.817 1.00 63.34 C ATOM 375 C SER A 52 9.913 -21.395 -42.461 1.00 13.41 C ATOM 376 O SER A 52 10.672 -22.280 -42.065 1.00 43.54 O ATOM 377 CB SER A 52 10.223 -21.310 -44.955 1.00 53.31 C ATOM 378 OG SER A 52 10.511 -19.937 -45.168 1.00 52.21 O ATOM 0 H SER A 52 8.382 -19.711 -44.531 1.00 12.13 H new ATOM 0 HA SER A 52 8.780 -22.489 -43.890 1.00 63.34 H new ATOM 0 HB2 SER A 52 11.143 -21.845 -44.722 1.00 53.31 H new ATOM 0 HB3 SER A 52 9.823 -21.747 -45.870 1.00 53.31 H new ATOM 0 HG SER A 52 11.157 -19.848 -45.900 1.00 52.21 H new ATOM 384 N ARG A 53 9.639 -20.313 -41.749 1.00 10.25 N ATOM 385 CA ARG A 53 10.203 -20.107 -40.425 1.00 53.04 C ATOM 386 C ARG A 53 9.139 -20.271 -39.346 1.00 53.23 C ATOM 387 O ARG A 53 9.363 -19.915 -38.197 1.00 31.21 O ATOM 388 CB ARG A 53 10.824 -18.714 -40.323 1.00 12.15 C ATOM 389 CG ARG A 53 12.112 -18.547 -41.113 1.00 15.43 C ATOM 390 CD ARG A 53 13.227 -19.420 -40.558 1.00 13.22 C ATOM 391 NE ARG A 53 14.531 -19.054 -41.111 1.00 34.22 N ATOM 392 CZ ARG A 53 15.661 -19.041 -40.402 1.00 61.31 C ATOM 393 NH1 ARG A 53 15.674 -19.479 -39.150 1.00 74.34 N ATOM 394 NH2 ARG A 53 16.792 -18.619 -40.955 1.00 63.01 N ATOM 0 H ARG A 53 9.027 -19.562 -42.068 1.00 10.25 H new ATOM 0 HA ARG A 53 10.976 -20.860 -40.270 1.00 53.04 H new ATOM 0 HB2 ARG A 53 10.099 -17.979 -40.672 1.00 12.15 H new ATOM 0 HB3 ARG A 53 11.023 -18.493 -39.274 1.00 12.15 H new ATOM 0 HG2 ARG A 53 11.935 -18.803 -42.158 1.00 15.43 H new ATOM 0 HG3 ARG A 53 12.421 -17.502 -41.089 1.00 15.43 H new ATOM 0 HD2 ARG A 53 13.254 -19.328 -39.472 1.00 13.22 H new ATOM 0 HD3 ARG A 53 13.017 -20.465 -40.784 1.00 13.22 H new ATOM 0 HE ARG A 53 14.579 -18.794 -42.096 1.00 34.22 H new ATOM 0 HH11 ARG A 53 14.816 -19.829 -38.723 1.00 74.34 H new ATOM 0 HH12 ARG A 53 16.542 -19.466 -38.614 1.00 74.34 H new ATOM 0 HH21 ARG A 53 16.799 -18.303 -41.925 1.00 63.01 H new ATOM 0 HH22 ARG A 53 17.654 -18.610 -40.410 1.00 63.01 H new ATOM 408 N GLU A 54 7.992 -20.827 -39.712 1.00 50.52 N ATOM 409 CA GLU A 54 6.884 -20.977 -38.771 1.00 62.14 C ATOM 410 C GLU A 54 7.230 -22.013 -37.702 1.00 21.15 C ATOM 411 O GLU A 54 7.274 -21.699 -36.509 1.00 13.00 O ATOM 412 CB GLU A 54 5.607 -21.361 -39.530 1.00 1.31 C ATOM 413 CG GLU A 54 4.334 -21.367 -38.691 1.00 72.43 C ATOM 414 CD GLU A 54 4.088 -22.688 -37.981 1.00 24.43 C ATOM 415 OE1 GLU A 54 3.972 -23.727 -38.668 1.00 12.21 O ATOM 416 OE2 GLU A 54 3.976 -22.687 -36.740 1.00 1.35 O ATOM 0 H GLU A 54 7.802 -21.181 -40.649 1.00 50.52 H new ATOM 0 HA GLU A 54 6.709 -20.027 -38.266 1.00 62.14 H new ATOM 0 HB2 GLU A 54 5.474 -20.667 -40.360 1.00 1.31 H new ATOM 0 HB3 GLU A 54 5.744 -22.352 -39.962 1.00 1.31 H new ATOM 0 HG2 GLU A 54 4.392 -20.570 -37.950 1.00 72.43 H new ATOM 0 HG3 GLU A 54 3.482 -21.144 -39.334 1.00 72.43 H new ATOM 423 N LYS A 55 7.519 -23.234 -38.139 1.00 40.00 N ATOM 424 CA LYS A 55 7.844 -24.320 -37.216 1.00 52.30 C ATOM 425 C LYS A 55 9.207 -24.090 -36.578 1.00 70.41 C ATOM 426 O LYS A 55 9.451 -24.494 -35.440 1.00 73.40 O ATOM 427 CB LYS A 55 7.828 -25.676 -37.925 1.00 65.42 C ATOM 428 CG LYS A 55 6.480 -26.045 -38.522 1.00 13.03 C ATOM 429 CD LYS A 55 6.372 -27.542 -38.775 1.00 53.14 C ATOM 430 CE LYS A 55 7.461 -28.041 -39.712 1.00 54.04 C ATOM 431 NZ LYS A 55 7.420 -29.520 -39.858 1.00 34.02 N ATOM 0 H LYS A 55 7.535 -23.498 -39.124 1.00 40.00 H new ATOM 0 HA LYS A 55 7.081 -24.329 -36.438 1.00 52.30 H new ATOM 0 HB2 LYS A 55 8.575 -25.669 -38.718 1.00 65.42 H new ATOM 0 HB3 LYS A 55 8.124 -26.449 -37.216 1.00 65.42 H new ATOM 0 HG2 LYS A 55 5.684 -25.731 -37.847 1.00 13.03 H new ATOM 0 HG3 LYS A 55 6.336 -25.506 -39.458 1.00 13.03 H new ATOM 0 HD2 LYS A 55 6.437 -28.076 -37.827 1.00 53.14 H new ATOM 0 HD3 LYS A 55 5.395 -27.768 -39.202 1.00 53.14 H new ATOM 0 HE2 LYS A 55 7.343 -27.575 -40.690 1.00 54.04 H new ATOM 0 HE3 LYS A 55 8.437 -27.739 -39.331 1.00 54.04 H new ATOM 0 HZ1 LYS A 55 8.176 -29.826 -40.503 1.00 34.02 H new ATOM 0 HZ2 LYS A 55 7.558 -29.965 -38.928 1.00 34.02 H new ATOM 0 HZ3 LYS A 55 6.498 -29.805 -40.245 1.00 34.02 H new ATOM 445 N ASP A 56 10.092 -23.445 -37.323 1.00 43.52 N ATOM 446 CA ASP A 56 11.412 -23.095 -36.811 1.00 2.10 C ATOM 447 C ASP A 56 11.275 -22.111 -35.655 1.00 52.23 C ATOM 448 O ASP A 56 11.907 -22.267 -34.609 1.00 72.40 O ATOM 449 CB ASP A 56 12.272 -22.498 -37.933 1.00 70.43 C ATOM 450 CG ASP A 56 13.619 -21.994 -37.447 1.00 64.50 C ATOM 451 OD1 ASP A 56 14.393 -22.788 -36.884 1.00 32.25 O ATOM 452 OD2 ASP A 56 13.913 -20.794 -37.632 1.00 14.14 O ATOM 0 H ASP A 56 9.922 -23.152 -38.285 1.00 43.52 H new ATOM 0 HA ASP A 56 11.904 -23.996 -36.444 1.00 2.10 H new ATOM 0 HB2 ASP A 56 12.430 -23.253 -38.703 1.00 70.43 H new ATOM 0 HB3 ASP A 56 11.730 -21.676 -38.400 1.00 70.43 H new ATOM 457 N CYS A 57 10.406 -21.125 -35.843 1.00 2.52 N ATOM 458 CA CYS A 57 10.178 -20.090 -34.844 1.00 33.24 C ATOM 459 C CYS A 57 9.541 -20.661 -33.589 1.00 13.14 C ATOM 460 O CYS A 57 10.079 -20.510 -32.493 1.00 34.21 O ATOM 461 CB CYS A 57 9.284 -18.994 -35.422 1.00 12.43 C ATOM 462 SG CYS A 57 8.796 -17.705 -34.234 1.00 72.30 S ATOM 0 H CYS A 57 9.843 -21.021 -36.687 1.00 2.52 H new ATOM 0 HA CYS A 57 11.146 -19.669 -34.572 1.00 33.24 H new ATOM 0 HB2 CYS A 57 9.804 -18.522 -36.256 1.00 12.43 H new ATOM 0 HB3 CYS A 57 8.383 -19.455 -35.827 1.00 12.43 H new ATOM 467 N ARG A 58 8.405 -21.336 -33.755 1.00 73.22 N ATOM 468 CA ARG A 58 7.619 -21.823 -32.627 1.00 23.14 C ATOM 469 C ARG A 58 8.434 -22.696 -31.678 1.00 4.10 C ATOM 470 O ARG A 58 8.187 -22.698 -30.478 1.00 12.15 O ATOM 471 CB ARG A 58 6.385 -22.582 -33.123 1.00 32.15 C ATOM 472 CG ARG A 58 6.702 -23.851 -33.895 1.00 42.15 C ATOM 473 CD ARG A 58 5.448 -24.450 -34.504 1.00 52.54 C ATOM 474 NE ARG A 58 4.451 -24.787 -33.490 1.00 1.24 N ATOM 475 CZ ARG A 58 3.144 -24.563 -33.628 1.00 1.50 C ATOM 476 NH1 ARG A 58 2.679 -23.973 -34.722 1.00 54.42 N ATOM 477 NH2 ARG A 58 2.299 -24.922 -32.665 1.00 53.14 N ATOM 0 H ARG A 58 8.008 -21.558 -34.668 1.00 73.22 H new ATOM 0 HA ARG A 58 7.300 -20.948 -32.061 1.00 23.14 H new ATOM 0 HB2 ARG A 58 5.761 -22.838 -32.266 1.00 32.15 H new ATOM 0 HB3 ARG A 58 5.797 -21.920 -33.759 1.00 32.15 H new ATOM 0 HG2 ARG A 58 7.422 -23.630 -34.683 1.00 42.15 H new ATOM 0 HG3 ARG A 58 7.169 -24.577 -33.230 1.00 42.15 H new ATOM 0 HD2 ARG A 58 5.018 -23.744 -35.214 1.00 52.54 H new ATOM 0 HD3 ARG A 58 5.711 -25.347 -35.065 1.00 52.54 H new ATOM 0 HE ARG A 58 4.775 -25.220 -32.625 1.00 1.24 H new ATOM 0 HH11 ARG A 58 3.322 -23.689 -35.461 1.00 54.42 H new ATOM 0 HH12 ARG A 58 1.678 -23.803 -34.824 1.00 54.42 H new ATOM 0 HH21 ARG A 58 2.651 -25.370 -31.819 1.00 53.14 H new ATOM 0 HH22 ARG A 58 1.300 -24.749 -32.773 1.00 53.14 H new ATOM 491 N LYS A 59 9.416 -23.419 -32.201 1.00 54.11 N ATOM 492 CA LYS A 59 10.206 -24.313 -31.370 1.00 74.42 C ATOM 493 C LYS A 59 11.203 -23.491 -30.556 1.00 43.44 C ATOM 494 O LYS A 59 11.317 -23.649 -29.338 1.00 22.42 O ATOM 495 CB LYS A 59 10.936 -25.344 -32.249 1.00 31.31 C ATOM 496 CG LYS A 59 11.374 -26.613 -31.517 1.00 2.04 C ATOM 497 CD LYS A 59 12.496 -26.356 -30.521 1.00 61.32 C ATOM 498 CE LYS A 59 12.929 -27.633 -29.817 1.00 4.44 C ATOM 499 NZ LYS A 59 13.906 -27.357 -28.731 1.00 11.42 N ATOM 0 H LYS A 59 9.681 -23.404 -33.186 1.00 54.11 H new ATOM 0 HA LYS A 59 9.552 -24.855 -30.687 1.00 74.42 H new ATOM 0 HB2 LYS A 59 10.282 -25.625 -33.075 1.00 31.31 H new ATOM 0 HB3 LYS A 59 11.816 -24.871 -32.685 1.00 31.31 H new ATOM 0 HG2 LYS A 59 10.519 -27.039 -30.993 1.00 2.04 H new ATOM 0 HG3 LYS A 59 11.703 -27.354 -32.246 1.00 2.04 H new ATOM 0 HD2 LYS A 59 13.350 -25.919 -31.040 1.00 61.32 H new ATOM 0 HD3 LYS A 59 12.166 -25.627 -29.781 1.00 61.32 H new ATOM 0 HE2 LYS A 59 12.055 -28.134 -29.401 1.00 4.44 H new ATOM 0 HE3 LYS A 59 13.373 -28.316 -30.542 1.00 4.44 H new ATOM 0 HZ1 LYS A 59 14.178 -28.250 -28.274 1.00 11.42 H new ATOM 0 HZ2 LYS A 59 14.751 -26.901 -29.132 1.00 11.42 H new ATOM 0 HZ3 LYS A 59 13.473 -26.726 -28.027 1.00 11.42 H new ATOM 513 N ASP A 60 11.893 -22.593 -31.246 1.00 43.34 N ATOM 514 CA ASP A 60 12.973 -21.812 -30.654 1.00 2.31 C ATOM 515 C ASP A 60 12.440 -20.761 -29.685 1.00 3.51 C ATOM 516 O ASP A 60 12.978 -20.585 -28.592 1.00 31.43 O ATOM 517 CB ASP A 60 13.786 -21.145 -31.767 1.00 1.53 C ATOM 518 CG ASP A 60 15.064 -20.501 -31.266 1.00 31.50 C ATOM 519 OD1 ASP A 60 15.854 -21.187 -30.584 1.00 43.20 O ATOM 520 OD2 ASP A 60 15.310 -19.322 -31.595 1.00 10.44 O ATOM 0 H ASP A 60 11.721 -22.385 -32.230 1.00 43.34 H new ATOM 0 HA ASP A 60 13.613 -22.486 -30.084 1.00 2.31 H new ATOM 0 HB2 ASP A 60 14.034 -21.889 -32.524 1.00 1.53 H new ATOM 0 HB3 ASP A 60 13.171 -20.388 -32.254 1.00 1.53 H new ATOM 525 N VAL A 61 11.369 -20.078 -30.078 1.00 74.41 N ATOM 526 CA VAL A 61 10.812 -18.998 -29.269 1.00 65.30 C ATOM 527 C VAL A 61 10.256 -19.517 -27.937 1.00 31.31 C ATOM 528 O VAL A 61 10.288 -18.808 -26.928 1.00 50.23 O ATOM 529 CB VAL A 61 9.718 -18.211 -30.032 1.00 61.40 C ATOM 530 CG1 VAL A 61 8.485 -19.064 -30.286 1.00 12.43 C ATOM 531 CG2 VAL A 61 9.345 -16.942 -29.281 1.00 43.31 C ATOM 0 H VAL A 61 10.870 -20.253 -30.950 1.00 74.41 H new ATOM 0 HA VAL A 61 11.635 -18.316 -29.055 1.00 65.30 H new ATOM 0 HB VAL A 61 10.132 -17.933 -31.001 1.00 61.40 H new ATOM 0 HG11 VAL A 61 7.741 -18.476 -30.823 1.00 12.43 H new ATOM 0 HG12 VAL A 61 8.761 -19.934 -30.883 1.00 12.43 H new ATOM 0 HG13 VAL A 61 8.069 -19.394 -29.334 1.00 12.43 H new ATOM 0 HG21 VAL A 61 8.575 -16.405 -29.835 1.00 43.31 H new ATOM 0 HG22 VAL A 61 8.966 -17.202 -28.293 1.00 43.31 H new ATOM 0 HG23 VAL A 61 10.226 -16.309 -29.177 1.00 43.31 H new ATOM 541 N GLN A 62 9.747 -20.749 -27.934 1.00 12.32 N ATOM 542 CA GLN A 62 9.231 -21.350 -26.705 1.00 61.20 C ATOM 543 C GLN A 62 10.354 -21.615 -25.707 1.00 51.35 C ATOM 544 O GLN A 62 10.124 -21.619 -24.497 1.00 25.24 O ATOM 545 CB GLN A 62 8.468 -22.652 -26.975 1.00 44.40 C ATOM 546 CG GLN A 62 7.145 -22.468 -27.706 1.00 54.24 C ATOM 547 CD GLN A 62 6.372 -21.249 -27.238 1.00 55.24 C ATOM 548 OE1 GLN A 62 6.531 -20.147 -27.953 1.00 32.13 O flip ATOM 549 NE2 GLN A 62 5.620 -21.303 -26.267 1.00 32.44 N flip ATOM 0 H GLN A 62 9.681 -21.345 -28.759 1.00 12.32 H new ATOM 0 HA GLN A 62 8.534 -20.629 -26.278 1.00 61.20 H new ATOM 0 HB2 GLN A 62 9.103 -23.316 -27.561 1.00 44.40 H new ATOM 0 HB3 GLN A 62 8.277 -23.150 -26.025 1.00 44.40 H new ATOM 0 HG2 GLN A 62 7.337 -22.381 -28.776 1.00 54.24 H new ATOM 0 HG3 GLN A 62 6.531 -23.357 -27.563 1.00 54.24 H new ATOM 0 HE21 GLN A 62 5.526 -22.173 -25.742 1.00 32.44 H new ATOM 0 HE22 GLN A 62 5.090 -20.478 -25.986 1.00 32.44 H new ATOM 558 N ALA A 63 11.566 -21.816 -26.213 1.00 5.21 N ATOM 559 CA ALA A 63 12.713 -22.074 -25.353 1.00 31.20 C ATOM 560 C ALA A 63 13.100 -20.818 -24.582 1.00 21.23 C ATOM 561 O ALA A 63 13.650 -20.893 -23.484 1.00 73.33 O ATOM 562 CB ALA A 63 13.891 -22.583 -26.168 1.00 44.12 C ATOM 0 H ALA A 63 11.778 -21.805 -27.211 1.00 5.21 H new ATOM 0 HA ALA A 63 12.434 -22.845 -24.635 1.00 31.20 H new ATOM 0 HB1 ALA A 63 14.737 -22.770 -25.507 1.00 44.12 H new ATOM 0 HB2 ALA A 63 13.612 -23.509 -26.671 1.00 44.12 H new ATOM 0 HB3 ALA A 63 14.169 -21.836 -26.911 1.00 44.12 H new ATOM 568 N CYS A 64 12.804 -19.664 -25.163 1.00 73.42 N ATOM 569 CA CYS A 64 13.050 -18.389 -24.506 1.00 53.55 C ATOM 570 C CYS A 64 11.901 -18.089 -23.545 1.00 1.32 C ATOM 571 O CYS A 64 10.865 -17.540 -23.940 1.00 4.33 O ATOM 572 CB CYS A 64 13.203 -17.277 -25.554 1.00 75.33 C ATOM 573 SG CYS A 64 13.635 -15.636 -24.879 1.00 63.42 S ATOM 0 H CYS A 64 12.391 -19.585 -26.092 1.00 73.42 H new ATOM 0 HA CYS A 64 13.978 -18.439 -23.936 1.00 53.55 H new ATOM 0 HB2 CYS A 64 13.972 -17.574 -26.267 1.00 75.33 H new ATOM 0 HB3 CYS A 64 12.269 -17.191 -26.109 1.00 75.33 H new ATOM 578 N ASP A 65 12.081 -18.505 -22.290 1.00 13.25 N ATOM 579 CA ASP A 65 11.037 -18.398 -21.271 1.00 42.45 C ATOM 580 C ASP A 65 10.757 -16.944 -20.908 1.00 31.30 C ATOM 581 O ASP A 65 9.603 -16.513 -20.894 1.00 30.52 O ATOM 582 CB ASP A 65 11.437 -19.186 -20.022 1.00 12.34 C ATOM 583 CG ASP A 65 10.406 -19.078 -18.919 1.00 31.34 C ATOM 584 OD1 ASP A 65 9.377 -19.782 -18.992 1.00 44.50 O ATOM 585 OD2 ASP A 65 10.618 -18.284 -17.979 1.00 3.05 O ATOM 0 H ASP A 65 12.949 -18.923 -21.954 1.00 13.25 H new ATOM 0 HA ASP A 65 10.122 -18.821 -21.685 1.00 42.45 H new ATOM 0 HB2 ASP A 65 11.575 -20.235 -20.286 1.00 12.34 H new ATOM 0 HB3 ASP A 65 12.396 -18.820 -19.656 1.00 12.34 H new ATOM 590 N LYS A 66 11.805 -16.188 -20.617 1.00 0.25 N ATOM 591 CA LYS A 66 11.642 -14.768 -20.364 1.00 63.53 C ATOM 592 C LYS A 66 12.093 -13.996 -21.594 1.00 20.40 C ATOM 593 O LYS A 66 13.271 -13.998 -21.957 1.00 60.34 O ATOM 594 CB LYS A 66 12.377 -14.293 -19.095 1.00 1.54 C ATOM 595 CG LYS A 66 13.899 -14.332 -19.152 1.00 33.23 C ATOM 596 CD LYS A 66 14.500 -13.525 -18.007 1.00 22.15 C ATOM 597 CE LYS A 66 16.021 -13.520 -18.047 1.00 23.43 C ATOM 598 NZ LYS A 66 16.601 -12.644 -16.990 1.00 32.31 N ATOM 0 H LYS A 66 12.764 -16.529 -20.551 1.00 0.25 H new ATOM 0 HA LYS A 66 10.586 -14.574 -20.173 1.00 63.53 H new ATOM 0 HB2 LYS A 66 12.067 -13.270 -18.881 1.00 1.54 H new ATOM 0 HB3 LYS A 66 12.048 -14.908 -18.257 1.00 1.54 H new ATOM 0 HG2 LYS A 66 14.244 -15.364 -19.097 1.00 33.23 H new ATOM 0 HG3 LYS A 66 14.243 -13.932 -20.106 1.00 33.23 H new ATOM 0 HD2 LYS A 66 14.133 -12.500 -18.055 1.00 22.15 H new ATOM 0 HD3 LYS A 66 14.164 -13.940 -17.056 1.00 22.15 H new ATOM 0 HE2 LYS A 66 16.391 -14.537 -17.919 1.00 23.43 H new ATOM 0 HE3 LYS A 66 16.357 -13.179 -19.026 1.00 23.43 H new ATOM 0 HZ1 LYS A 66 17.580 -12.936 -16.796 1.00 32.31 H new ATOM 0 HZ2 LYS A 66 16.592 -11.656 -17.314 1.00 32.31 H new ATOM 0 HZ3 LYS A 66 16.036 -12.728 -16.121 1.00 32.31 H new ATOM 612 N LYS A 67 11.145 -13.366 -22.263 1.00 10.13 N ATOM 613 CA LYS A 67 11.424 -12.689 -23.515 1.00 31.35 C ATOM 614 C LYS A 67 11.795 -11.245 -23.246 1.00 33.41 C ATOM 615 O LYS A 67 12.273 -10.532 -24.124 1.00 31.44 O ATOM 616 CB LYS A 67 10.203 -12.784 -24.429 1.00 73.42 C ATOM 617 CG LYS A 67 9.636 -14.193 -24.505 1.00 13.22 C ATOM 618 CD LYS A 67 8.389 -14.255 -25.363 1.00 43.42 C ATOM 619 CE LYS A 67 7.707 -15.606 -25.244 1.00 62.45 C ATOM 620 NZ LYS A 67 8.612 -16.730 -25.601 1.00 55.54 N ATOM 0 H LYS A 67 10.173 -13.309 -21.959 1.00 10.13 H new ATOM 0 HA LYS A 67 12.266 -13.168 -24.014 1.00 31.35 H new ATOM 0 HB2 LYS A 67 9.431 -12.105 -24.069 1.00 73.42 H new ATOM 0 HB3 LYS A 67 10.477 -12.452 -25.431 1.00 73.42 H new ATOM 0 HG2 LYS A 67 10.390 -14.866 -24.912 1.00 13.22 H new ATOM 0 HG3 LYS A 67 9.403 -14.545 -23.500 1.00 13.22 H new ATOM 0 HD2 LYS A 67 7.698 -13.468 -25.062 1.00 43.42 H new ATOM 0 HD3 LYS A 67 8.651 -14.068 -26.404 1.00 43.42 H new ATOM 0 HE2 LYS A 67 7.349 -15.741 -24.223 1.00 62.45 H new ATOM 0 HE3 LYS A 67 6.832 -15.627 -25.894 1.00 62.45 H new ATOM 0 HZ1 LYS A 67 8.046 -17.550 -25.900 1.00 55.54 H new ATOM 0 HZ2 LYS A 67 9.237 -16.438 -26.379 1.00 55.54 H new ATOM 0 HZ3 LYS A 67 9.187 -16.989 -24.774 1.00 55.54 H new ATOM 634 N TYR A 68 11.583 -10.825 -22.008 1.00 32.11 N ATOM 635 CA TYR A 68 11.984 -9.510 -21.566 1.00 33.51 C ATOM 636 C TYR A 68 12.566 -9.639 -20.168 1.00 43.12 C ATOM 637 O TYR A 68 12.034 -10.370 -19.330 1.00 21.43 O ATOM 638 CB TYR A 68 10.795 -8.538 -21.559 1.00 23.12 C ATOM 639 CG TYR A 68 10.089 -8.430 -22.895 1.00 33.32 C ATOM 640 CD1 TYR A 68 10.682 -7.773 -23.965 1.00 10.14 C ATOM 641 CD2 TYR A 68 8.840 -9.007 -23.090 1.00 75.25 C ATOM 642 CE1 TYR A 68 10.047 -7.691 -25.190 1.00 30.34 C ATOM 643 CE2 TYR A 68 8.203 -8.933 -24.312 1.00 41.30 C ATOM 644 CZ TYR A 68 8.809 -8.274 -25.359 1.00 54.31 C ATOM 645 OH TYR A 68 8.179 -8.211 -26.581 1.00 54.14 O ATOM 0 H TYR A 68 11.130 -11.388 -21.289 1.00 32.11 H new ATOM 0 HA TYR A 68 12.728 -9.107 -22.253 1.00 33.51 H new ATOM 0 HB2 TYR A 68 10.078 -8.860 -20.804 1.00 23.12 H new ATOM 0 HB3 TYR A 68 11.147 -7.550 -21.263 1.00 23.12 H new ATOM 0 HD1 TYR A 68 11.654 -7.319 -23.838 1.00 10.14 H new ATOM 0 HD2 TYR A 68 8.360 -9.522 -22.271 1.00 75.25 H new ATOM 0 HE1 TYR A 68 10.519 -7.172 -26.012 1.00 30.34 H new ATOM 0 HE2 TYR A 68 7.234 -9.390 -24.447 1.00 41.30 H new ATOM 0 HH TYR A 68 8.824 -7.940 -27.268 1.00 54.14 H new ATOM 655 N ASP A 69 13.661 -8.949 -19.933 1.00 23.12 N ATOM 656 CA ASP A 69 14.335 -9.011 -18.646 1.00 34.43 C ATOM 657 C ASP A 69 13.535 -8.273 -17.581 1.00 71.15 C ATOM 658 O ASP A 69 12.649 -7.483 -17.902 1.00 32.25 O ATOM 659 CB ASP A 69 15.748 -8.442 -18.749 1.00 50.32 C ATOM 660 CG ASP A 69 16.531 -8.656 -17.478 1.00 2.05 C ATOM 661 OD1 ASP A 69 16.871 -9.818 -17.177 1.00 23.11 O ATOM 662 OD2 ASP A 69 16.786 -7.668 -16.760 1.00 75.23 O ATOM 0 H ASP A 69 14.107 -8.336 -20.615 1.00 23.12 H new ATOM 0 HA ASP A 69 14.409 -10.058 -18.352 1.00 34.43 H new ATOM 0 HB2 ASP A 69 16.270 -8.914 -19.582 1.00 50.32 H new ATOM 0 HB3 ASP A 69 15.696 -7.376 -18.969 1.00 50.32 H new ATOM 667 N ASP A 70 13.867 -8.528 -16.317 1.00 34.30 N ATOM 668 CA ASP A 70 13.133 -7.979 -15.180 1.00 44.10 C ATOM 669 C ASP A 70 13.048 -6.459 -15.233 1.00 61.10 C ATOM 670 O ASP A 70 12.106 -5.863 -14.710 1.00 65.33 O ATOM 671 CB ASP A 70 13.801 -8.390 -13.866 1.00 12.23 C ATOM 672 CG ASP A 70 13.971 -9.887 -13.726 1.00 74.03 C ATOM 673 OD1 ASP A 70 13.042 -10.561 -13.233 1.00 51.11 O ATOM 674 OD2 ASP A 70 15.053 -10.396 -14.093 1.00 3.54 O ATOM 0 H ASP A 70 14.653 -9.122 -16.053 1.00 34.30 H new ATOM 0 HA ASP A 70 12.122 -8.383 -15.232 1.00 44.10 H new ATOM 0 HB2 ASP A 70 14.778 -7.912 -13.798 1.00 12.23 H new ATOM 0 HB3 ASP A 70 13.206 -8.019 -13.032 1.00 12.23 H new ATOM 679 N GLN A 71 14.032 -5.836 -15.861 1.00 34.12 N ATOM 680 CA GLN A 71 14.115 -4.383 -15.893 1.00 24.43 C ATOM 681 C GLN A 71 13.490 -3.814 -17.162 1.00 31.14 C ATOM 682 O GLN A 71 13.292 -2.606 -17.272 1.00 31.20 O ATOM 683 CB GLN A 71 15.573 -3.964 -15.775 1.00 51.51 C ATOM 684 CG GLN A 71 16.255 -4.627 -14.600 1.00 14.33 C ATOM 685 CD GLN A 71 17.757 -4.555 -14.671 1.00 0.34 C ATOM 686 OE1 GLN A 71 18.334 -3.574 -15.141 1.00 21.51 O ATOM 687 NE2 GLN A 71 18.394 -5.627 -14.247 1.00 51.23 N ATOM 0 H GLN A 71 14.785 -6.313 -16.356 1.00 34.12 H new ATOM 0 HA GLN A 71 13.551 -3.981 -15.051 1.00 24.43 H new ATOM 0 HB2 GLN A 71 16.100 -4.221 -16.694 1.00 51.51 H new ATOM 0 HB3 GLN A 71 15.632 -2.881 -15.666 1.00 51.51 H new ATOM 0 HG2 GLN A 71 15.918 -4.154 -13.678 1.00 14.33 H new ATOM 0 HG3 GLN A 71 15.949 -5.672 -14.553 1.00 14.33 H new ATOM 0 HE21 GLN A 71 17.870 -6.414 -13.865 1.00 51.23 H new ATOM 0 HE22 GLN A 71 19.412 -5.670 -14.300 1.00 51.23 H new ATOM 696 N GLY A 72 13.172 -4.684 -18.118 1.00 61.10 N ATOM 697 CA GLY A 72 12.501 -4.234 -19.323 1.00 45.15 C ATOM 698 C GLY A 72 13.366 -4.276 -20.567 1.00 51.51 C ATOM 699 O GLY A 72 12.967 -3.762 -21.615 1.00 5.21 O ATOM 0 H GLY A 72 13.366 -5.685 -18.079 1.00 61.10 H new ATOM 0 HA2 GLY A 72 11.618 -4.852 -19.487 1.00 45.15 H new ATOM 0 HA3 GLY A 72 12.151 -3.213 -19.171 1.00 45.15 H new ATOM 703 N ARG A 73 14.539 -4.888 -20.482 1.00 70.05 N ATOM 704 CA ARG A 73 15.400 -4.998 -21.654 1.00 61.55 C ATOM 705 C ARG A 73 15.211 -6.354 -22.321 1.00 32.13 C ATOM 706 O ARG A 73 14.935 -7.346 -21.650 1.00 55.54 O ATOM 707 CB ARG A 73 16.883 -4.778 -21.313 1.00 60.02 C ATOM 708 CG ARG A 73 17.421 -5.647 -20.185 1.00 2.43 C ATOM 709 CD ARG A 73 17.273 -4.966 -18.833 1.00 5.31 C ATOM 710 NE ARG A 73 17.999 -3.699 -18.785 1.00 24.33 N ATOM 711 CZ ARG A 73 19.223 -3.550 -18.277 1.00 45.01 C ATOM 712 NH1 ARG A 73 19.880 -4.592 -17.780 1.00 41.03 N ATOM 713 NH2 ARG A 73 19.794 -2.354 -18.272 1.00 3.22 N ATOM 0 H ARG A 73 14.912 -5.309 -19.631 1.00 70.05 H new ATOM 0 HA ARG A 73 15.106 -4.208 -22.345 1.00 61.55 H new ATOM 0 HB2 ARG A 73 17.477 -4.962 -22.208 1.00 60.02 H new ATOM 0 HB3 ARG A 73 17.027 -3.731 -21.045 1.00 60.02 H new ATOM 0 HG2 ARG A 73 16.890 -6.599 -20.173 1.00 2.43 H new ATOM 0 HG3 ARG A 73 18.472 -5.871 -20.367 1.00 2.43 H new ATOM 0 HD2 ARG A 73 16.217 -4.789 -18.628 1.00 5.31 H new ATOM 0 HD3 ARG A 73 17.643 -5.628 -18.050 1.00 5.31 H new ATOM 0 HE ARG A 73 17.538 -2.872 -19.166 1.00 24.33 H new ATOM 0 HH11 ARG A 73 19.449 -5.516 -17.785 1.00 41.03 H new ATOM 0 HH12 ARG A 73 20.816 -4.468 -17.394 1.00 41.03 H new ATOM 0 HH21 ARG A 73 19.297 -1.550 -18.656 1.00 3.22 H new ATOM 0 HH22 ARG A 73 20.730 -2.237 -17.884 1.00 3.22 H new ATOM 727 N GLU A 74 15.334 -6.381 -23.639 1.00 55.53 N ATOM 728 CA GLU A 74 15.204 -7.618 -24.399 1.00 70.25 C ATOM 729 C GLU A 74 16.291 -8.610 -23.997 1.00 63.15 C ATOM 730 O GLU A 74 17.433 -8.222 -23.737 1.00 20.44 O ATOM 731 CB GLU A 74 15.281 -7.314 -25.892 1.00 74.24 C ATOM 732 CG GLU A 74 14.136 -6.448 -26.384 1.00 34.32 C ATOM 733 CD GLU A 74 14.404 -5.844 -27.744 1.00 32.41 C ATOM 734 OE1 GLU A 74 14.256 -6.552 -28.759 1.00 62.41 O ATOM 735 OE2 GLU A 74 14.774 -4.651 -27.802 1.00 2.44 O ATOM 0 H GLU A 74 15.525 -5.557 -24.209 1.00 55.53 H new ATOM 0 HA GLU A 74 14.237 -8.069 -24.179 1.00 70.25 H new ATOM 0 HB2 GLU A 74 16.225 -6.813 -26.106 1.00 74.24 H new ATOM 0 HB3 GLU A 74 15.284 -8.252 -26.448 1.00 74.24 H new ATOM 0 HG2 GLU A 74 13.226 -7.047 -26.430 1.00 34.32 H new ATOM 0 HG3 GLU A 74 13.955 -5.649 -25.665 1.00 34.32 H new ATOM 742 N THR A 75 15.934 -9.883 -23.923 1.00 54.01 N ATOM 743 CA THR A 75 16.873 -10.912 -23.507 1.00 75.30 C ATOM 744 C THR A 75 17.697 -11.419 -24.686 1.00 62.14 C ATOM 745 O THR A 75 17.417 -11.086 -25.839 1.00 24.02 O ATOM 746 CB THR A 75 16.146 -12.092 -22.835 1.00 23.01 C ATOM 747 OG1 THR A 75 15.090 -12.566 -23.678 1.00 12.34 O ATOM 748 CG2 THR A 75 15.576 -11.681 -21.488 1.00 74.20 C ATOM 0 H THR A 75 15.000 -10.228 -24.146 1.00 54.01 H new ATOM 0 HA THR A 75 17.546 -10.457 -22.781 1.00 75.30 H new ATOM 0 HB THR A 75 16.871 -12.891 -22.678 1.00 23.01 H new ATOM 0 HG1 THR A 75 14.440 -13.064 -23.140 1.00 12.34 H new ATOM 0 HG21 THR A 75 15.068 -12.531 -21.033 1.00 74.20 H new ATOM 0 HG22 THR A 75 16.385 -11.351 -20.836 1.00 74.20 H new ATOM 0 HG23 THR A 75 14.866 -10.866 -21.627 1.00 74.20 H new ATOM 756 N ALA A 76 18.715 -12.224 -24.391 1.00 75.42 N ATOM 757 CA ALA A 76 19.590 -12.769 -25.421 1.00 62.10 C ATOM 758 C ALA A 76 18.797 -13.569 -26.451 1.00 45.30 C ATOM 759 O ALA A 76 18.968 -13.389 -27.659 1.00 20.04 O ATOM 760 CB ALA A 76 20.669 -13.638 -24.791 1.00 4.43 C ATOM 0 H ALA A 76 18.953 -12.513 -23.442 1.00 75.42 H new ATOM 0 HA ALA A 76 20.065 -11.935 -25.937 1.00 62.10 H new ATOM 0 HB1 ALA A 76 21.315 -14.039 -25.572 1.00 4.43 H new ATOM 0 HB2 ALA A 76 21.262 -13.038 -24.101 1.00 4.43 H new ATOM 0 HB3 ALA A 76 20.203 -14.460 -24.248 1.00 4.43 H new ATOM 766 N CYS A 77 17.921 -14.443 -25.968 1.00 21.03 N ATOM 767 CA CYS A 77 17.101 -15.264 -26.850 1.00 71.44 C ATOM 768 C CYS A 77 16.127 -14.402 -27.648 1.00 12.32 C ATOM 769 O CYS A 77 15.964 -14.598 -28.852 1.00 54.32 O ATOM 770 CB CYS A 77 16.353 -16.343 -26.053 1.00 43.32 C ATOM 771 SG CYS A 77 15.622 -15.765 -24.483 1.00 61.40 S ATOM 0 H CYS A 77 17.761 -14.601 -24.973 1.00 21.03 H new ATOM 0 HA CYS A 77 17.763 -15.765 -27.557 1.00 71.44 H new ATOM 0 HB2 CYS A 77 15.559 -16.752 -26.678 1.00 43.32 H new ATOM 0 HB3 CYS A 77 17.042 -17.159 -25.838 1.00 43.32 H new ATOM 776 N ALA A 78 15.503 -13.436 -26.981 1.00 1.02 N ATOM 777 CA ALA A 78 14.561 -12.531 -27.632 1.00 21.22 C ATOM 778 C ALA A 78 15.224 -11.722 -28.745 1.00 13.12 C ATOM 779 O ALA A 78 14.581 -11.384 -29.740 1.00 72.12 O ATOM 780 CB ALA A 78 13.938 -11.598 -26.610 1.00 12.42 C ATOM 0 H ALA A 78 15.634 -13.259 -25.985 1.00 1.02 H new ATOM 0 HA ALA A 78 13.782 -13.142 -28.087 1.00 21.22 H new ATOM 0 HB1 ALA A 78 13.237 -10.928 -27.108 1.00 12.42 H new ATOM 0 HB2 ALA A 78 13.408 -12.183 -25.858 1.00 12.42 H new ATOM 0 HB3 ALA A 78 14.720 -11.012 -26.128 1.00 12.42 H new ATOM 786 N LYS A 79 16.515 -11.442 -28.593 1.00 30.33 N ATOM 787 CA LYS A 79 17.228 -10.630 -29.567 1.00 43.33 C ATOM 788 C LYS A 79 17.611 -11.480 -30.771 1.00 31.23 C ATOM 789 O LYS A 79 17.627 -11.005 -31.904 1.00 13.33 O ATOM 790 CB LYS A 79 18.476 -9.990 -28.946 1.00 32.32 C ATOM 791 CG LYS A 79 19.273 -9.144 -29.927 1.00 44.31 C ATOM 792 CD LYS A 79 20.521 -8.565 -29.286 1.00 42.32 C ATOM 793 CE LYS A 79 21.413 -7.898 -30.321 1.00 40.13 C ATOM 794 NZ LYS A 79 21.810 -8.851 -31.394 1.00 23.45 N ATOM 0 H LYS A 79 17.083 -11.764 -27.810 1.00 30.33 H new ATOM 0 HA LYS A 79 16.567 -9.827 -29.893 1.00 43.33 H new ATOM 0 HB2 LYS A 79 18.175 -9.368 -28.103 1.00 32.32 H new ATOM 0 HB3 LYS A 79 19.119 -10.776 -28.549 1.00 32.32 H new ATOM 0 HG2 LYS A 79 19.554 -9.752 -30.787 1.00 44.31 H new ATOM 0 HG3 LYS A 79 18.647 -8.334 -30.301 1.00 44.31 H new ATOM 0 HD2 LYS A 79 20.238 -7.839 -28.524 1.00 42.32 H new ATOM 0 HD3 LYS A 79 21.075 -9.357 -28.781 1.00 42.32 H new ATOM 0 HE2 LYS A 79 20.889 -7.050 -30.762 1.00 40.13 H new ATOM 0 HE3 LYS A 79 22.305 -7.504 -29.834 1.00 40.13 H new ATOM 0 HZ1 LYS A 79 22.627 -8.469 -31.912 1.00 23.45 H new ATOM 0 HZ2 LYS A 79 22.066 -9.765 -30.969 1.00 23.45 H new ATOM 0 HZ3 LYS A 79 21.015 -8.985 -32.051 1.00 23.45 H new ATOM 808 N GLY A 80 17.912 -12.747 -30.521 1.00 64.10 N ATOM 809 CA GLY A 80 18.223 -13.648 -31.608 1.00 10.15 C ATOM 810 C GLY A 80 17.011 -13.878 -32.483 1.00 70.15 C ATOM 811 O GLY A 80 17.078 -13.742 -33.702 1.00 31.22 O ATOM 0 H GLY A 80 17.946 -13.163 -29.590 1.00 64.10 H new ATOM 0 HA2 GLY A 80 19.035 -13.235 -32.206 1.00 10.15 H new ATOM 0 HA3 GLY A 80 18.573 -14.599 -31.208 1.00 10.15 H new ATOM 815 N ILE A 81 15.902 -14.233 -31.843 1.00 62.23 N ATOM 816 CA ILE A 81 14.620 -14.397 -32.520 1.00 73.24 C ATOM 817 C ILE A 81 14.276 -13.197 -33.407 1.00 65.25 C ATOM 818 O ILE A 81 14.017 -13.370 -34.597 1.00 2.12 O ATOM 819 CB ILE A 81 13.490 -14.613 -31.485 1.00 1.42 C ATOM 820 CG1 ILE A 81 13.782 -15.858 -30.640 1.00 63.03 C ATOM 821 CG2 ILE A 81 12.136 -14.741 -32.173 1.00 65.50 C ATOM 822 CD1 ILE A 81 12.838 -16.043 -29.472 1.00 50.04 C ATOM 0 H ILE A 81 15.866 -14.415 -30.840 1.00 62.23 H new ATOM 0 HA ILE A 81 14.708 -15.274 -33.162 1.00 73.24 H new ATOM 0 HB ILE A 81 13.453 -13.742 -30.830 1.00 1.42 H new ATOM 0 HG12 ILE A 81 13.730 -16.739 -31.279 1.00 63.03 H new ATOM 0 HG13 ILE A 81 14.803 -15.798 -30.263 1.00 63.03 H new ATOM 0 HG21 ILE A 81 11.360 -14.892 -31.423 1.00 65.50 H new ATOM 0 HG22 ILE A 81 11.926 -13.831 -32.735 1.00 65.50 H new ATOM 0 HG23 ILE A 81 12.153 -15.592 -32.854 1.00 65.50 H new ATOM 0 HD11 ILE A 81 13.110 -16.945 -28.924 1.00 50.04 H new ATOM 0 HD12 ILE A 81 12.906 -15.181 -28.809 1.00 50.04 H new ATOM 0 HD13 ILE A 81 11.817 -16.137 -29.841 1.00 50.04 H new ATOM 834 N ARG A 82 14.276 -11.991 -32.837 1.00 2.10 N ATOM 835 CA ARG A 82 13.940 -10.783 -33.602 1.00 65.23 C ATOM 836 C ARG A 82 14.816 -10.633 -34.855 1.00 71.50 C ATOM 837 O ARG A 82 14.360 -10.111 -35.872 1.00 32.42 O ATOM 838 CB ARG A 82 14.053 -9.524 -32.727 1.00 2.24 C ATOM 839 CG ARG A 82 15.474 -9.031 -32.537 1.00 24.12 C ATOM 840 CD ARG A 82 15.529 -7.762 -31.707 1.00 21.43 C ATOM 841 NE ARG A 82 16.836 -7.108 -31.796 1.00 31.43 N ATOM 842 CZ ARG A 82 17.181 -6.032 -31.090 1.00 13.12 C ATOM 843 NH1 ARG A 82 16.362 -5.549 -30.164 1.00 12.23 N ATOM 844 NH2 ARG A 82 18.363 -5.454 -31.285 1.00 31.43 N ATOM 0 H ARG A 82 14.502 -11.822 -31.857 1.00 2.10 H new ATOM 0 HA ARG A 82 12.906 -10.895 -33.927 1.00 65.23 H new ATOM 0 HB2 ARG A 82 13.460 -8.727 -33.176 1.00 2.24 H new ATOM 0 HB3 ARG A 82 13.618 -9.733 -31.750 1.00 2.24 H new ATOM 0 HG2 ARG A 82 16.065 -9.808 -32.052 1.00 24.12 H new ATOM 0 HG3 ARG A 82 15.927 -8.847 -33.511 1.00 24.12 H new ATOM 0 HD2 ARG A 82 14.755 -7.073 -32.045 1.00 21.43 H new ATOM 0 HD3 ARG A 82 15.312 -8.000 -30.666 1.00 21.43 H new ATOM 0 HE ARG A 82 17.525 -7.500 -32.438 1.00 31.43 H new ATOM 0 HH11 ARG A 82 15.465 -6.002 -29.991 1.00 12.23 H new ATOM 0 HH12 ARG A 82 16.630 -4.725 -29.626 1.00 12.23 H new ATOM 0 HH21 ARG A 82 19.009 -5.834 -31.977 1.00 31.43 H new ATOM 0 HH22 ARG A 82 18.624 -4.630 -30.743 1.00 31.43 H new ATOM 858 N GLU A 83 16.065 -11.094 -34.789 1.00 53.34 N ATOM 859 CA GLU A 83 16.958 -11.030 -35.944 1.00 2.52 C ATOM 860 C GLU A 83 16.708 -12.191 -36.913 1.00 53.04 C ATOM 861 O GLU A 83 16.722 -12.006 -38.132 1.00 32.41 O ATOM 862 CB GLU A 83 18.427 -11.026 -35.508 1.00 2.43 C ATOM 863 CG GLU A 83 19.072 -9.644 -35.508 1.00 64.34 C ATOM 864 CD GLU A 83 19.151 -9.005 -34.132 1.00 43.25 C ATOM 865 OE1 GLU A 83 20.125 -9.290 -33.400 1.00 43.00 O ATOM 866 OE2 GLU A 83 18.270 -8.187 -33.794 1.00 70.45 O ATOM 0 H GLU A 83 16.478 -11.512 -33.955 1.00 53.34 H new ATOM 0 HA GLU A 83 16.742 -10.096 -36.462 1.00 2.52 H new ATOM 0 HB2 GLU A 83 18.499 -11.449 -34.506 1.00 2.43 H new ATOM 0 HB3 GLU A 83 18.994 -11.680 -36.171 1.00 2.43 H new ATOM 0 HG2 GLU A 83 20.078 -9.723 -35.920 1.00 64.34 H new ATOM 0 HG3 GLU A 83 18.506 -8.989 -36.171 1.00 64.34 H new ATOM 873 N LYS A 84 16.487 -13.386 -36.367 1.00 72.35 N ATOM 874 CA LYS A 84 16.247 -14.583 -37.179 1.00 52.45 C ATOM 875 C LYS A 84 14.948 -14.464 -37.973 1.00 23.43 C ATOM 876 O LYS A 84 14.889 -14.805 -39.154 1.00 44.41 O ATOM 877 CB LYS A 84 16.170 -15.825 -36.282 1.00 11.21 C ATOM 878 CG LYS A 84 17.483 -16.202 -35.611 1.00 60.15 C ATOM 879 CD LYS A 84 17.279 -17.275 -34.549 1.00 12.41 C ATOM 880 CE LYS A 84 16.678 -18.548 -35.131 1.00 42.12 C ATOM 881 NZ LYS A 84 16.376 -19.559 -34.080 1.00 11.23 N ATOM 0 H LYS A 84 16.469 -13.553 -35.361 1.00 72.35 H new ATOM 0 HA LYS A 84 17.079 -14.679 -37.877 1.00 52.45 H new ATOM 0 HB2 LYS A 84 15.419 -15.655 -35.511 1.00 11.21 H new ATOM 0 HB3 LYS A 84 15.827 -16.669 -36.880 1.00 11.21 H new ATOM 0 HG2 LYS A 84 18.187 -16.561 -36.362 1.00 60.15 H new ATOM 0 HG3 LYS A 84 17.927 -15.317 -35.155 1.00 60.15 H new ATOM 0 HD2 LYS A 84 18.235 -17.507 -34.080 1.00 12.41 H new ATOM 0 HD3 LYS A 84 16.625 -16.890 -33.766 1.00 12.41 H new ATOM 0 HE2 LYS A 84 15.763 -18.302 -35.670 1.00 42.12 H new ATOM 0 HE3 LYS A 84 17.370 -18.976 -35.856 1.00 42.12 H new ATOM 0 HZ1 LYS A 84 15.708 -20.262 -34.456 1.00 11.23 H new ATOM 0 HZ2 LYS A 84 17.255 -20.036 -33.794 1.00 11.23 H new ATOM 0 HZ3 LYS A 84 15.954 -19.087 -33.255 1.00 11.23 H new ATOM 895 N TYR A 85 13.919 -13.968 -37.309 1.00 22.31 N ATOM 896 CA TYR A 85 12.580 -13.895 -37.880 1.00 3.11 C ATOM 897 C TYR A 85 12.229 -12.450 -38.193 1.00 23.55 C ATOM 898 O TYR A 85 11.076 -12.034 -38.083 1.00 12.51 O ATOM 899 CB TYR A 85 11.581 -14.523 -36.910 1.00 71.12 C ATOM 900 CG TYR A 85 12.029 -15.895 -36.462 1.00 71.51 C ATOM 901 CD1 TYR A 85 11.897 -16.993 -37.296 1.00 5.22 C ATOM 902 CD2 TYR A 85 12.623 -16.081 -35.221 1.00 23.10 C ATOM 903 CE1 TYR A 85 12.347 -18.238 -36.910 1.00 32.11 C ATOM 904 CE2 TYR A 85 13.069 -17.325 -34.822 1.00 64.15 C ATOM 905 CZ TYR A 85 12.930 -18.399 -35.671 1.00 31.22 C ATOM 906 OH TYR A 85 13.391 -19.635 -35.287 1.00 35.13 O ATOM 0 H TYR A 85 13.985 -13.604 -36.359 1.00 22.31 H new ATOM 0 HA TYR A 85 12.542 -14.453 -38.815 1.00 3.11 H new ATOM 0 HB2 TYR A 85 11.461 -13.877 -36.041 1.00 71.12 H new ATOM 0 HB3 TYR A 85 10.605 -14.597 -37.389 1.00 71.12 H new ATOM 0 HD1 TYR A 85 11.434 -16.872 -38.264 1.00 5.22 H new ATOM 0 HD2 TYR A 85 12.738 -15.238 -34.556 1.00 23.10 H new ATOM 0 HE1 TYR A 85 12.243 -19.083 -37.575 1.00 32.11 H new ATOM 0 HE2 TYR A 85 13.524 -17.454 -33.851 1.00 64.15 H new ATOM 0 HH TYR A 85 13.932 -20.020 -36.007 1.00 35.13 H new ATOM 916 N LYS A 86 13.270 -11.712 -38.577 1.00 12.13 N ATOM 917 CA LYS A 86 13.203 -10.286 -38.900 1.00 50.53 C ATOM 918 C LYS A 86 11.888 -9.864 -39.556 1.00 75.51 C ATOM 919 O LYS A 86 11.442 -10.458 -40.546 1.00 24.10 O ATOM 920 CB LYS A 86 14.350 -9.927 -39.848 1.00 72.22 C ATOM 921 CG LYS A 86 14.338 -10.746 -41.133 1.00 10.33 C ATOM 922 CD LYS A 86 15.316 -10.210 -42.168 1.00 1.23 C ATOM 923 CE LYS A 86 14.818 -8.907 -42.776 1.00 45.42 C ATOM 924 NZ LYS A 86 13.506 -9.077 -43.462 1.00 71.23 N ATOM 0 H LYS A 86 14.209 -12.099 -38.675 1.00 12.13 H new ATOM 0 HA LYS A 86 13.277 -9.754 -37.951 1.00 50.53 H new ATOM 0 HB2 LYS A 86 14.290 -8.868 -40.098 1.00 72.22 H new ATOM 0 HB3 LYS A 86 15.300 -10.080 -39.335 1.00 72.22 H new ATOM 0 HG2 LYS A 86 14.587 -11.782 -40.903 1.00 10.33 H new ATOM 0 HG3 LYS A 86 13.332 -10.745 -41.552 1.00 10.33 H new ATOM 0 HD2 LYS A 86 16.289 -10.049 -41.703 1.00 1.23 H new ATOM 0 HD3 LYS A 86 15.458 -10.950 -42.955 1.00 1.23 H new ATOM 0 HE2 LYS A 86 14.723 -8.155 -41.993 1.00 45.42 H new ATOM 0 HE3 LYS A 86 15.554 -8.535 -43.488 1.00 45.42 H new ATOM 0 HZ1 LYS A 86 13.362 -8.296 -44.134 1.00 71.23 H new ATOM 0 HZ2 LYS A 86 13.497 -9.981 -43.975 1.00 71.23 H new ATOM 0 HZ3 LYS A 86 12.742 -9.072 -42.756 1.00 71.23 H new ATOM 938 N PRO A 87 11.257 -8.820 -39.011 1.00 13.12 N ATOM 939 CA PRO A 87 10.133 -8.163 -39.662 1.00 12.03 C ATOM 940 C PRO A 87 10.552 -7.638 -41.025 1.00 15.05 C ATOM 941 O PRO A 87 11.652 -7.096 -41.170 1.00 1.24 O ATOM 942 CB PRO A 87 9.785 -7.002 -38.723 1.00 22.04 C ATOM 943 CG PRO A 87 10.381 -7.371 -37.407 1.00 42.13 C ATOM 944 CD PRO A 87 11.590 -8.208 -37.715 1.00 44.23 C ATOM 0 HA PRO A 87 9.289 -8.832 -39.829 1.00 12.03 H new ATOM 0 HB2 PRO A 87 10.195 -6.062 -39.091 1.00 22.04 H new ATOM 0 HB3 PRO A 87 8.706 -6.870 -38.643 1.00 22.04 H new ATOM 0 HG2 PRO A 87 10.657 -6.481 -36.841 1.00 42.13 H new ATOM 0 HG3 PRO A 87 9.667 -7.927 -36.798 1.00 42.13 H new ATOM 0 HD2 PRO A 87 12.494 -7.602 -37.777 1.00 44.23 H new ATOM 0 HD3 PRO A 87 11.764 -8.962 -36.947 1.00 44.23 H new ATOM 952 N ALA A 88 9.727 -7.863 -42.036 1.00 33.31 N ATOM 953 CA ALA A 88 9.969 -7.257 -43.338 1.00 63.12 C ATOM 954 C ALA A 88 9.878 -5.741 -43.219 1.00 3.01 C ATOM 955 O ALA A 88 8.809 -5.149 -43.353 1.00 75.43 O ATOM 956 CB ALA A 88 8.977 -7.779 -44.364 1.00 65.40 C ATOM 0 H ALA A 88 8.896 -8.452 -41.984 1.00 33.31 H new ATOM 0 HA ALA A 88 10.970 -7.525 -43.676 1.00 63.12 H new ATOM 0 HB1 ALA A 88 9.174 -7.314 -45.330 1.00 65.40 H new ATOM 0 HB2 ALA A 88 9.081 -8.860 -44.453 1.00 65.40 H new ATOM 0 HB3 ALA A 88 7.963 -7.537 -44.045 1.00 65.40 H new ATOM 962 N VAL A 89 11.017 -5.136 -42.935 1.00 70.12 N ATOM 963 CA VAL A 89 11.097 -3.719 -42.655 1.00 52.02 C ATOM 964 C VAL A 89 12.561 -3.290 -42.684 1.00 11.22 C ATOM 965 O VAL A 89 13.454 -4.130 -42.544 1.00 61.41 O ATOM 966 CB VAL A 89 10.460 -3.412 -41.278 1.00 34.23 C ATOM 967 CG1 VAL A 89 11.325 -3.931 -40.145 1.00 32.23 C ATOM 968 CG2 VAL A 89 10.180 -1.932 -41.106 1.00 33.21 C ATOM 0 H VAL A 89 11.915 -5.618 -42.893 1.00 70.12 H new ATOM 0 HA VAL A 89 10.546 -3.160 -43.412 1.00 52.02 H new ATOM 0 HB VAL A 89 9.504 -3.935 -41.243 1.00 34.23 H new ATOM 0 HG11 VAL A 89 10.851 -3.700 -39.191 1.00 32.23 H new ATOM 0 HG12 VAL A 89 11.441 -5.011 -40.241 1.00 32.23 H new ATOM 0 HG13 VAL A 89 12.305 -3.455 -40.188 1.00 32.23 H new ATOM 0 HG21 VAL A 89 9.733 -1.758 -40.127 1.00 33.21 H new ATOM 0 HG22 VAL A 89 11.113 -1.374 -41.184 1.00 33.21 H new ATOM 0 HG23 VAL A 89 9.492 -1.599 -41.883 1.00 33.21 H new ATOM 978 N VAL A 90 12.813 -2.011 -42.897 1.00 63.11 N ATOM 979 CA VAL A 90 14.173 -1.496 -42.865 1.00 30.23 C ATOM 980 C VAL A 90 14.567 -1.085 -41.446 1.00 12.21 C ATOM 981 O VAL A 90 13.994 -0.162 -40.867 1.00 23.02 O ATOM 982 CB VAL A 90 14.362 -0.306 -43.831 1.00 71.11 C ATOM 983 CG1 VAL A 90 14.405 -0.792 -45.271 1.00 1.53 C ATOM 984 CG2 VAL A 90 13.258 0.727 -43.650 1.00 62.34 C ATOM 0 H VAL A 90 12.098 -1.311 -43.093 1.00 63.11 H new ATOM 0 HA VAL A 90 14.827 -2.303 -43.195 1.00 30.23 H new ATOM 0 HB VAL A 90 15.313 0.172 -43.596 1.00 71.11 H new ATOM 0 HG11 VAL A 90 14.539 0.059 -45.938 1.00 1.53 H new ATOM 0 HG12 VAL A 90 15.237 -1.485 -45.396 1.00 1.53 H new ATOM 0 HG13 VAL A 90 13.471 -1.299 -45.512 1.00 1.53 H new ATOM 0 HG21 VAL A 90 13.416 1.554 -44.343 1.00 62.34 H new ATOM 0 HG22 VAL A 90 12.291 0.265 -43.851 1.00 62.34 H new ATOM 0 HG23 VAL A 90 13.275 1.103 -42.627 1.00 62.34 H new ATOM 994 N TYR A 91 15.528 -1.803 -40.880 1.00 11.44 N ATOM 995 CA TYR A 91 16.041 -1.491 -39.551 1.00 74.42 C ATOM 996 C TYR A 91 17.434 -0.888 -39.632 1.00 5.55 C ATOM 997 O TYR A 91 18.205 -1.195 -40.543 1.00 51.44 O ATOM 998 CB TYR A 91 16.086 -2.740 -38.663 1.00 3.12 C ATOM 999 CG TYR A 91 14.773 -3.091 -38.005 1.00 22.23 C ATOM 1000 CD1 TYR A 91 14.016 -2.120 -37.363 1.00 71.54 C ATOM 1001 CD2 TYR A 91 14.302 -4.398 -38.006 1.00 43.01 C ATOM 1002 CE1 TYR A 91 12.823 -2.439 -36.745 1.00 31.22 C ATOM 1003 CE2 TYR A 91 13.111 -4.726 -37.387 1.00 54.40 C ATOM 1004 CZ TYR A 91 12.375 -3.743 -36.758 1.00 34.11 C ATOM 1005 OH TYR A 91 11.190 -4.067 -36.140 1.00 1.35 O ATOM 0 H TYR A 91 15.970 -2.609 -41.322 1.00 11.44 H new ATOM 0 HA TYR A 91 15.359 -0.765 -39.108 1.00 74.42 H new ATOM 0 HB2 TYR A 91 16.413 -3.587 -39.266 1.00 3.12 H new ATOM 0 HB3 TYR A 91 16.838 -2.592 -37.888 1.00 3.12 H new ATOM 0 HD1 TYR A 91 14.366 -1.098 -37.347 1.00 71.54 H new ATOM 0 HD2 TYR A 91 14.876 -5.170 -38.498 1.00 43.01 H new ATOM 0 HE1 TYR A 91 12.244 -1.671 -36.254 1.00 31.22 H new ATOM 0 HE2 TYR A 91 12.758 -5.747 -37.395 1.00 54.40 H new ATOM 0 HH TYR A 91 10.584 -3.297 -36.170 1.00 1.35 H new ATOM 1015 N GLY A 92 17.736 -0.013 -38.689 1.00 23.43 N ATOM 1016 CA GLY A 92 19.081 0.487 -38.537 1.00 53.34 C ATOM 1017 C GLY A 92 19.838 -0.344 -37.526 1.00 2.11 C ATOM 1018 O GLY A 92 19.289 -1.307 -36.988 1.00 4.03 O ATOM 0 H GLY A 92 17.064 0.363 -38.020 1.00 23.43 H new ATOM 0 HA2 GLY A 92 19.596 0.462 -39.497 1.00 53.34 H new ATOM 0 HA3 GLY A 92 19.055 1.528 -38.216 1.00 53.34 H new ATOM 1022 N TYR A 93 21.075 0.024 -37.235 1.00 35.35 N ATOM 1023 CA TYR A 93 21.885 -0.762 -36.315 1.00 62.44 C ATOM 1024 C TYR A 93 21.423 -0.524 -34.881 1.00 20.35 C ATOM 1025 O TYR A 93 21.697 -1.317 -33.981 1.00 24.23 O ATOM 1026 CB TYR A 93 23.366 -0.416 -36.469 1.00 0.05 C ATOM 1027 CG TYR A 93 24.291 -1.470 -35.901 1.00 55.44 C ATOM 1028 CD1 TYR A 93 24.445 -2.690 -36.543 1.00 64.24 C ATOM 1029 CD2 TYR A 93 24.999 -1.252 -34.725 1.00 72.52 C ATOM 1030 CE1 TYR A 93 25.277 -3.665 -36.036 1.00 51.13 C ATOM 1031 CE2 TYR A 93 25.835 -2.225 -34.208 1.00 52.52 C ATOM 1032 CZ TYR A 93 25.971 -3.430 -34.869 1.00 24.42 C ATOM 1033 OH TYR A 93 26.799 -4.407 -34.361 1.00 33.23 O ATOM 0 H TYR A 93 21.537 0.850 -37.616 1.00 35.35 H new ATOM 0 HA TYR A 93 21.759 -1.818 -36.553 1.00 62.44 H new ATOM 0 HB2 TYR A 93 23.591 -0.277 -37.526 1.00 0.05 H new ATOM 0 HB3 TYR A 93 23.563 0.535 -35.974 1.00 0.05 H new ATOM 0 HD1 TYR A 93 23.903 -2.880 -37.458 1.00 64.24 H new ATOM 0 HD2 TYR A 93 24.895 -0.310 -34.208 1.00 72.52 H new ATOM 0 HE1 TYR A 93 25.384 -4.608 -36.551 1.00 51.13 H new ATOM 0 HE2 TYR A 93 26.378 -2.044 -33.292 1.00 52.52 H new ATOM 0 HH TYR A 93 27.216 -4.085 -33.535 1.00 33.23 H new ATOM 1043 N ASP A 94 20.706 0.576 -34.690 1.00 2.22 N ATOM 1044 CA ASP A 94 20.118 0.914 -33.397 1.00 52.54 C ATOM 1045 C ASP A 94 18.914 0.027 -33.094 1.00 11.01 C ATOM 1046 O ASP A 94 18.456 -0.052 -31.954 1.00 11.12 O ATOM 1047 CB ASP A 94 19.646 2.371 -33.388 1.00 72.43 C ATOM 1048 CG ASP A 94 20.752 3.384 -33.575 1.00 0.21 C ATOM 1049 OD1 ASP A 94 21.403 3.373 -34.636 1.00 5.33 O ATOM 1050 OD2 ASP A 94 20.944 4.226 -32.670 1.00 2.24 O ATOM 0 H ASP A 94 20.515 1.258 -35.424 1.00 2.22 H new ATOM 0 HA ASP A 94 20.888 0.760 -32.641 1.00 52.54 H new ATOM 0 HB2 ASP A 94 18.908 2.506 -34.178 1.00 72.43 H new ATOM 0 HB3 ASP A 94 19.142 2.571 -32.443 1.00 72.43 H new ATOM 1055 N GLY A 95 18.399 -0.632 -34.125 1.00 55.04 N ATOM 1056 CA GLY A 95 17.163 -1.377 -33.988 1.00 50.41 C ATOM 1057 C GLY A 95 15.956 -0.508 -34.283 1.00 51.14 C ATOM 1058 O GLY A 95 14.814 -0.904 -34.048 1.00 0.34 O ATOM 0 H GLY A 95 18.817 -0.663 -35.055 1.00 55.04 H new ATOM 0 HA2 GLY A 95 17.174 -2.230 -34.667 1.00 50.41 H new ATOM 0 HA3 GLY A 95 17.087 -1.776 -32.976 1.00 50.41 H new ATOM 1062 N LYS A 96 16.221 0.688 -34.791 1.00 22.15 N ATOM 1063 CA LYS A 96 15.169 1.631 -35.153 1.00 53.24 C ATOM 1064 C LYS A 96 14.785 1.433 -36.616 1.00 10.42 C ATOM 1065 O LYS A 96 15.606 0.976 -37.410 1.00 11.05 O ATOM 1066 CB LYS A 96 15.661 3.066 -34.945 1.00 62.21 C ATOM 1067 CG LYS A 96 16.111 3.368 -33.524 1.00 25.52 C ATOM 1068 CD LYS A 96 16.995 4.603 -33.482 1.00 42.51 C ATOM 1069 CE LYS A 96 17.513 4.875 -32.082 1.00 63.34 C ATOM 1070 NZ LYS A 96 18.686 5.789 -32.095 1.00 51.50 N ATOM 0 H LYS A 96 17.166 1.032 -34.963 1.00 22.15 H new ATOM 0 HA LYS A 96 14.299 1.454 -34.521 1.00 53.24 H new ATOM 0 HB2 LYS A 96 16.491 3.257 -35.626 1.00 62.21 H new ATOM 0 HB3 LYS A 96 14.862 3.756 -35.216 1.00 62.21 H new ATOM 0 HG2 LYS A 96 15.239 3.519 -32.887 1.00 25.52 H new ATOM 0 HG3 LYS A 96 16.655 2.513 -33.122 1.00 25.52 H new ATOM 0 HD2 LYS A 96 17.837 4.471 -34.162 1.00 42.51 H new ATOM 0 HD3 LYS A 96 16.431 5.466 -33.836 1.00 42.51 H new ATOM 0 HE2 LYS A 96 16.718 5.313 -31.479 1.00 63.34 H new ATOM 0 HE3 LYS A 96 17.791 3.934 -31.608 1.00 63.34 H new ATOM 0 HZ1 LYS A 96 18.823 6.192 -31.146 1.00 51.50 H new ATOM 0 HZ2 LYS A 96 19.536 5.258 -32.372 1.00 51.50 H new ATOM 0 HZ3 LYS A 96 18.520 6.557 -32.776 1.00 51.50 H new ATOM 1084 N PRO A 97 13.537 1.752 -36.995 1.00 43.40 N ATOM 1085 CA PRO A 97 13.097 1.684 -38.390 1.00 22.24 C ATOM 1086 C PRO A 97 13.755 2.772 -39.237 1.00 11.54 C ATOM 1087 O PRO A 97 13.217 3.873 -39.388 1.00 45.40 O ATOM 1088 CB PRO A 97 11.577 1.897 -38.314 1.00 13.23 C ATOM 1089 CG PRO A 97 11.227 1.764 -36.868 1.00 53.34 C ATOM 1090 CD PRO A 97 12.452 2.183 -36.107 1.00 3.54 C ATOM 0 HA PRO A 97 13.369 0.739 -38.861 1.00 22.24 H new ATOM 0 HB2 PRO A 97 11.299 2.879 -38.696 1.00 13.23 H new ATOM 0 HB3 PRO A 97 11.047 1.159 -38.916 1.00 13.23 H new ATOM 0 HG2 PRO A 97 10.375 2.394 -36.613 1.00 53.34 H new ATOM 0 HG3 PRO A 97 10.949 0.738 -36.626 1.00 53.34 H new ATOM 0 HD2 PRO A 97 12.473 3.259 -35.932 1.00 3.54 H new ATOM 0 HD3 PRO A 97 12.509 1.700 -35.132 1.00 3.54 H new ATOM 1098 N LEU A 98 14.940 2.467 -39.748 1.00 51.14 N ATOM 1099 CA LEU A 98 15.722 3.421 -40.519 1.00 23.32 C ATOM 1100 C LEU A 98 16.498 2.692 -41.611 1.00 31.31 C ATOM 1101 O LEU A 98 17.017 1.597 -41.387 1.00 74.24 O ATOM 1102 CB LEU A 98 16.682 4.174 -39.595 1.00 1.51 C ATOM 1103 CG LEU A 98 17.442 5.338 -40.234 1.00 4.01 C ATOM 1104 CD1 LEU A 98 16.474 6.367 -40.795 1.00 50.01 C ATOM 1105 CD2 LEU A 98 18.371 5.984 -39.216 1.00 71.22 C ATOM 0 H LEU A 98 15.384 1.555 -39.640 1.00 51.14 H new ATOM 0 HA LEU A 98 15.051 4.141 -40.988 1.00 23.32 H new ATOM 0 HB2 LEU A 98 16.115 4.557 -38.746 1.00 1.51 H new ATOM 0 HB3 LEU A 98 17.408 3.464 -39.199 1.00 1.51 H new ATOM 0 HG LEU A 98 18.042 4.948 -41.056 1.00 4.01 H new ATOM 0 HD11 LEU A 98 17.034 7.186 -41.245 1.00 50.01 H new ATOM 0 HD12 LEU A 98 15.844 5.899 -41.552 1.00 50.01 H new ATOM 0 HD13 LEU A 98 15.848 6.754 -39.991 1.00 50.01 H new ATOM 0 HD21 LEU A 98 18.905 6.811 -39.684 1.00 71.22 H new ATOM 0 HD22 LEU A 98 17.786 6.359 -38.376 1.00 71.22 H new ATOM 0 HD23 LEU A 98 19.088 5.245 -38.857 1.00 71.22 H new ATOM 1117 N ASP A 99 16.577 3.295 -42.786 1.00 40.23 N ATOM 1118 CA ASP A 99 17.225 2.663 -43.929 1.00 51.53 C ATOM 1119 C ASP A 99 18.742 2.788 -43.833 1.00 74.22 C ATOM 1120 O ASP A 99 19.342 3.625 -44.507 1.00 70.32 O ATOM 1121 CB ASP A 99 16.763 3.318 -45.235 1.00 64.13 C ATOM 1122 CG ASP A 99 15.292 3.680 -45.233 1.00 52.22 C ATOM 1123 OD1 ASP A 99 14.952 4.779 -44.737 1.00 24.21 O ATOM 1124 OD2 ASP A 99 14.475 2.888 -45.736 1.00 64.13 O ATOM 0 H ASP A 99 16.200 4.224 -42.976 1.00 40.23 H new ATOM 0 HA ASP A 99 16.947 1.609 -43.923 1.00 51.53 H new ATOM 0 HB2 ASP A 99 17.352 4.218 -45.411 1.00 64.13 H new ATOM 0 HB3 ASP A 99 16.963 2.640 -46.065 1.00 64.13 H new ATOM 1129 N LEU A 100 19.365 1.969 -42.989 1.00 30.11 N ATOM 1130 CA LEU A 100 20.816 2.025 -42.811 1.00 11.15 C ATOM 1131 C LEU A 100 21.403 0.673 -42.414 1.00 35.42 C ATOM 1132 O LEU A 100 22.438 0.271 -42.939 1.00 54.34 O ATOM 1133 CB LEU A 100 21.195 3.069 -41.750 1.00 60.15 C ATOM 1134 CG LEU A 100 21.098 4.534 -42.188 1.00 45.22 C ATOM 1135 CD1 LEU A 100 21.428 5.458 -41.027 1.00 31.11 C ATOM 1136 CD2 LEU A 100 22.031 4.806 -43.358 1.00 35.31 C ATOM 0 H LEU A 100 18.894 1.264 -42.422 1.00 30.11 H new ATOM 0 HA LEU A 100 21.236 2.309 -43.776 1.00 11.15 H new ATOM 0 HB2 LEU A 100 20.552 2.926 -40.882 1.00 60.15 H new ATOM 0 HB3 LEU A 100 22.217 2.874 -41.425 1.00 60.15 H new ATOM 0 HG LEU A 100 20.075 4.728 -42.509 1.00 45.22 H new ATOM 0 HD11 LEU A 100 21.354 6.495 -41.355 1.00 31.11 H new ATOM 0 HD12 LEU A 100 20.725 5.284 -40.213 1.00 31.11 H new ATOM 0 HD13 LEU A 100 22.442 5.258 -40.680 1.00 31.11 H new ATOM 0 HD21 LEU A 100 21.948 5.852 -43.654 1.00 35.31 H new ATOM 0 HD22 LEU A 100 23.058 4.594 -43.061 1.00 35.31 H new ATOM 0 HD23 LEU A 100 21.757 4.168 -44.198 1.00 35.31 H new ATOM 1148 N GLY A 101 20.719 -0.036 -41.518 1.00 62.01 N ATOM 1149 CA GLY A 101 21.288 -1.224 -40.881 1.00 41.41 C ATOM 1150 C GLY A 101 21.834 -2.270 -41.844 1.00 62.44 C ATOM 1151 O GLY A 101 22.766 -2.996 -41.506 1.00 31.50 O ATOM 0 H GLY A 101 19.771 0.190 -41.216 1.00 62.01 H new ATOM 0 HA2 GLY A 101 22.091 -0.911 -40.214 1.00 41.41 H new ATOM 0 HA3 GLY A 101 20.521 -1.688 -40.261 1.00 41.41 H new ATOM 1155 N PHE A 102 21.261 -2.359 -43.033 1.00 33.20 N ATOM 1156 CA PHE A 102 21.696 -3.352 -44.008 1.00 24.51 C ATOM 1157 C PHE A 102 22.588 -2.721 -45.080 1.00 62.02 C ATOM 1158 O PHE A 102 23.329 -3.415 -45.772 1.00 2.21 O ATOM 1159 CB PHE A 102 20.469 -4.010 -44.654 1.00 32.53 C ATOM 1160 CG PHE A 102 20.793 -5.137 -45.598 1.00 43.05 C ATOM 1161 CD1 PHE A 102 21.116 -6.392 -45.111 1.00 62.01 C ATOM 1162 CD2 PHE A 102 20.769 -4.940 -46.971 1.00 62.33 C ATOM 1163 CE1 PHE A 102 21.410 -7.431 -45.974 1.00 4.33 C ATOM 1164 CE2 PHE A 102 21.063 -5.975 -47.839 1.00 15.24 C ATOM 1165 CZ PHE A 102 21.383 -7.222 -47.340 1.00 61.43 C ATOM 0 H PHE A 102 20.497 -1.760 -43.348 1.00 33.20 H new ATOM 0 HA PHE A 102 22.284 -4.111 -43.491 1.00 24.51 H new ATOM 0 HB2 PHE A 102 19.817 -4.388 -43.866 1.00 32.53 H new ATOM 0 HB3 PHE A 102 19.906 -3.249 -45.195 1.00 32.53 H new ATOM 0 HD1 PHE A 102 21.139 -6.561 -44.045 1.00 62.01 H new ATOM 0 HD2 PHE A 102 20.518 -3.967 -47.366 1.00 62.33 H new ATOM 0 HE1 PHE A 102 21.661 -8.405 -45.581 1.00 4.33 H new ATOM 0 HE2 PHE A 102 21.042 -5.808 -48.906 1.00 15.24 H new ATOM 0 HZ PHE A 102 21.612 -8.033 -48.016 1.00 61.43 H new ATOM 1175 N CYS A 103 22.553 -1.402 -45.183 1.00 63.13 N ATOM 1176 CA CYS A 103 23.157 -0.726 -46.321 1.00 12.51 C ATOM 1177 C CYS A 103 24.441 0.013 -45.946 1.00 53.32 C ATOM 1178 O CYS A 103 25.341 0.150 -46.773 1.00 70.40 O ATOM 1179 CB CYS A 103 22.148 0.239 -46.943 1.00 72.25 C ATOM 1180 SG CYS A 103 20.595 -0.557 -47.475 1.00 62.34 S ATOM 0 H CYS A 103 22.117 -0.783 -44.500 1.00 63.13 H new ATOM 0 HA CYS A 103 23.433 -1.489 -47.049 1.00 12.51 H new ATOM 0 HB2 CYS A 103 21.915 1.021 -46.220 1.00 72.25 H new ATOM 0 HB3 CYS A 103 22.608 0.726 -47.803 1.00 72.25 H new ATOM 1185 N THR A 104 24.537 0.472 -44.700 1.00 73.30 N ATOM 1186 CA THR A 104 25.702 1.232 -44.242 1.00 13.51 C ATOM 1187 C THR A 104 26.998 0.428 -44.401 1.00 3.43 C ATOM 1188 O THR A 104 28.084 0.995 -44.540 1.00 34.44 O ATOM 1189 CB THR A 104 25.528 1.663 -42.771 1.00 44.54 C ATOM 1190 OG1 THR A 104 24.324 2.427 -42.635 1.00 2.35 O ATOM 1191 CG2 THR A 104 26.706 2.495 -42.287 1.00 11.42 C ATOM 0 H THR A 104 23.821 0.331 -43.987 1.00 73.30 H new ATOM 0 HA THR A 104 25.776 2.122 -44.867 1.00 13.51 H new ATOM 0 HB THR A 104 25.475 0.761 -42.162 1.00 44.54 H new ATOM 0 HG1 THR A 104 23.552 1.860 -42.843 1.00 2.35 H new ATOM 0 HG21 THR A 104 26.547 2.780 -41.247 1.00 11.42 H new ATOM 0 HG22 THR A 104 27.622 1.910 -42.367 1.00 11.42 H new ATOM 0 HG23 THR A 104 26.794 3.392 -42.900 1.00 11.42 H new ATOM 1199 N LEU A 105 26.868 -0.894 -44.415 1.00 21.12 N ATOM 1200 CA LEU A 105 28.018 -1.779 -44.567 1.00 61.51 C ATOM 1201 C LEU A 105 28.662 -1.610 -45.944 1.00 44.20 C ATOM 1202 O LEU A 105 29.856 -1.854 -46.114 1.00 74.35 O ATOM 1203 CB LEU A 105 27.620 -3.247 -44.355 1.00 55.14 C ATOM 1204 CG LEU A 105 27.183 -3.626 -42.932 1.00 35.40 C ATOM 1205 CD1 LEU A 105 25.765 -3.158 -42.645 1.00 61.51 C ATOM 1206 CD2 LEU A 105 27.308 -5.129 -42.723 1.00 62.21 C ATOM 0 H LEU A 105 25.975 -1.378 -44.323 1.00 21.12 H new ATOM 0 HA LEU A 105 28.745 -1.502 -43.803 1.00 61.51 H new ATOM 0 HB2 LEU A 105 26.806 -3.485 -45.040 1.00 55.14 H new ATOM 0 HB3 LEU A 105 28.465 -3.876 -44.634 1.00 55.14 H new ATOM 0 HG LEU A 105 27.845 -3.120 -42.230 1.00 35.40 H new ATOM 0 HD11 LEU A 105 25.487 -3.442 -41.630 1.00 61.51 H new ATOM 0 HD12 LEU A 105 25.712 -2.074 -42.746 1.00 61.51 H new ATOM 0 HD13 LEU A 105 25.078 -3.622 -43.353 1.00 61.51 H new ATOM 0 HD21 LEU A 105 26.995 -5.383 -41.710 1.00 62.21 H new ATOM 0 HD22 LEU A 105 26.674 -5.650 -43.440 1.00 62.21 H new ATOM 0 HD23 LEU A 105 28.345 -5.432 -42.869 1.00 62.21 H new ATOM 1218 N ALA A 106 27.870 -1.178 -46.921 1.00 33.22 N ATOM 1219 CA ALA A 106 28.366 -0.979 -48.278 1.00 33.12 C ATOM 1220 C ALA A 106 28.996 0.404 -48.425 1.00 32.50 C ATOM 1221 O ALA A 106 29.855 0.620 -49.280 1.00 35.20 O ATOM 1222 CB ALA A 106 27.240 -1.158 -49.287 1.00 55.21 C ATOM 0 H ALA A 106 26.881 -0.959 -46.798 1.00 33.22 H new ATOM 0 HA ALA A 106 29.133 -1.728 -48.475 1.00 33.12 H new ATOM 0 HB1 ALA A 106 27.627 -1.006 -50.295 1.00 55.21 H new ATOM 0 HB2 ALA A 106 26.833 -2.165 -49.203 1.00 55.21 H new ATOM 0 HB3 ALA A 106 26.453 -0.431 -49.087 1.00 55.21 H new ATOM 1228 N GLY A 107 28.557 1.337 -47.590 1.00 3.41 N ATOM 1229 CA GLY A 107 29.112 2.674 -47.614 1.00 55.23 C ATOM 1230 C GLY A 107 28.328 3.613 -48.506 1.00 41.45 C ATOM 1231 O GLY A 107 27.123 3.753 -48.349 1.00 62.00 O ATOM 0 H GLY A 107 27.825 1.190 -46.895 1.00 3.41 H new ATOM 0 HA2 GLY A 107 29.132 3.074 -46.600 1.00 55.23 H new ATOM 0 HA3 GLY A 107 30.145 2.629 -47.959 1.00 55.23 H new ATOM 1235 N ILE A 108 29.018 4.208 -49.474 1.00 62.44 N ATOM 1236 CA ILE A 108 28.449 5.249 -50.339 1.00 22.10 C ATOM 1237 C ILE A 108 27.225 4.753 -51.115 1.00 50.45 C ATOM 1238 O ILE A 108 26.335 5.528 -51.467 1.00 51.50 O ATOM 1239 CB ILE A 108 29.512 5.766 -51.339 1.00 32.14 C ATOM 1240 CG1 ILE A 108 30.739 6.287 -50.586 1.00 72.03 C ATOM 1241 CG2 ILE A 108 28.939 6.853 -52.240 1.00 4.31 C ATOM 1242 CD1 ILE A 108 30.429 7.409 -49.616 1.00 74.42 C ATOM 0 H ILE A 108 29.991 3.985 -49.685 1.00 62.44 H new ATOM 0 HA ILE A 108 28.130 6.060 -49.685 1.00 22.10 H new ATOM 0 HB ILE A 108 29.815 4.932 -51.972 1.00 32.14 H new ATOM 0 HG12 ILE A 108 31.196 5.462 -50.039 1.00 72.03 H new ATOM 0 HG13 ILE A 108 31.476 6.637 -51.309 1.00 72.03 H new ATOM 0 HG21 ILE A 108 29.709 7.196 -52.931 1.00 4.31 H new ATOM 0 HG22 ILE A 108 28.097 6.451 -52.805 1.00 4.31 H new ATOM 0 HG23 ILE A 108 28.600 7.690 -51.630 1.00 4.31 H new ATOM 0 HD11 ILE A 108 31.347 7.726 -49.120 1.00 74.42 H new ATOM 0 HD12 ILE A 108 30.001 8.251 -50.159 1.00 74.42 H new ATOM 0 HD13 ILE A 108 29.716 7.058 -48.870 1.00 74.42 H new ATOM 1254 N ARG A 109 27.186 3.459 -51.380 1.00 13.43 N ATOM 1255 CA ARG A 109 26.138 2.879 -52.210 1.00 44.03 C ATOM 1256 C ARG A 109 24.874 2.579 -51.397 1.00 61.45 C ATOM 1257 O ARG A 109 23.905 2.030 -51.929 1.00 61.13 O ATOM 1258 CB ARG A 109 26.654 1.607 -52.891 1.00 13.14 C ATOM 1259 CG ARG A 109 27.974 1.813 -53.619 1.00 21.13 C ATOM 1260 CD ARG A 109 27.872 2.910 -54.672 1.00 0.24 C ATOM 1261 NE ARG A 109 29.190 3.419 -55.051 1.00 42.41 N ATOM 1262 CZ ARG A 109 29.395 4.536 -55.747 1.00 41.21 C ATOM 1263 NH1 ARG A 109 28.374 5.221 -56.245 1.00 72.43 N ATOM 1264 NH2 ARG A 109 30.629 4.963 -55.966 1.00 63.34 N ATOM 0 H ARG A 109 27.869 2.786 -51.032 1.00 13.43 H new ATOM 0 HA ARG A 109 25.869 3.610 -52.973 1.00 44.03 H new ATOM 0 HB2 ARG A 109 26.778 0.825 -52.141 1.00 13.14 H new ATOM 0 HB3 ARG A 109 25.906 1.253 -53.600 1.00 13.14 H new ATOM 0 HG2 ARG A 109 28.750 2.071 -52.899 1.00 21.13 H new ATOM 0 HG3 ARG A 109 28.277 0.880 -54.094 1.00 21.13 H new ATOM 0 HD2 ARG A 109 27.364 2.521 -55.555 1.00 0.24 H new ATOM 0 HD3 ARG A 109 27.262 3.728 -54.288 1.00 0.24 H new ATOM 0 HE ARG A 109 30.008 2.882 -54.763 1.00 42.41 H new ATOM 0 HH11 ARG A 109 27.419 4.894 -56.097 1.00 72.43 H new ATOM 0 HH12 ARG A 109 28.544 6.075 -56.776 1.00 72.43 H new ATOM 0 HH21 ARG A 109 31.423 4.437 -55.602 1.00 63.34 H new ATOM 0 HH22 ARG A 109 30.786 5.818 -56.499 1.00 63.34 H new ATOM 1278 N GLU A 110 24.882 2.941 -50.112 1.00 64.41 N ATOM 1279 CA GLU A 110 23.767 2.621 -49.225 1.00 71.44 C ATOM 1280 C GLU A 110 22.488 3.328 -49.670 1.00 61.13 C ATOM 1281 O GLU A 110 21.390 2.796 -49.510 1.00 20.11 O ATOM 1282 CB GLU A 110 24.094 2.966 -47.757 1.00 53.12 C ATOM 1283 CG GLU A 110 23.755 4.390 -47.320 1.00 43.33 C ATOM 1284 CD GLU A 110 24.725 5.435 -47.830 1.00 33.01 C ATOM 1285 OE1 GLU A 110 24.633 5.811 -49.014 1.00 34.11 O ATOM 1286 OE2 GLU A 110 25.560 5.909 -47.032 1.00 62.22 O ATOM 0 H GLU A 110 25.644 3.453 -49.667 1.00 64.41 H new ATOM 0 HA GLU A 110 23.603 1.545 -49.288 1.00 71.44 H new ATOM 0 HB2 GLU A 110 23.558 2.270 -47.111 1.00 53.12 H new ATOM 0 HB3 GLU A 110 25.158 2.799 -47.592 1.00 53.12 H new ATOM 0 HG2 GLU A 110 22.753 4.638 -47.669 1.00 43.33 H new ATOM 0 HG3 GLU A 110 23.732 4.430 -46.231 1.00 43.33 H new ATOM 1293 N VAL A 111 22.640 4.527 -50.223 1.00 12.14 N ATOM 1294 CA VAL A 111 21.512 5.303 -50.719 1.00 21.41 C ATOM 1295 C VAL A 111 20.716 4.532 -51.778 1.00 43.34 C ATOM 1296 O VAL A 111 19.485 4.584 -51.798 1.00 25.44 O ATOM 1297 CB VAL A 111 21.979 6.668 -51.279 1.00 33.03 C ATOM 1298 CG1 VAL A 111 22.959 6.493 -52.431 1.00 33.13 C ATOM 1299 CG2 VAL A 111 20.788 7.515 -51.703 1.00 75.43 C ATOM 0 H VAL A 111 23.544 4.985 -50.339 1.00 12.14 H new ATOM 0 HA VAL A 111 20.850 5.486 -49.873 1.00 21.41 H new ATOM 0 HB VAL A 111 22.503 7.191 -50.479 1.00 33.03 H new ATOM 0 HG11 VAL A 111 23.266 7.472 -52.800 1.00 33.13 H new ATOM 0 HG12 VAL A 111 23.835 5.945 -52.084 1.00 33.13 H new ATOM 0 HG13 VAL A 111 22.479 5.936 -53.236 1.00 33.13 H new ATOM 0 HG21 VAL A 111 21.141 8.470 -52.093 1.00 75.43 H new ATOM 0 HG22 VAL A 111 20.227 6.992 -52.477 1.00 75.43 H new ATOM 0 HG23 VAL A 111 20.142 7.691 -50.843 1.00 75.43 H new ATOM 1309 N ASP A 112 21.412 3.807 -52.642 1.00 30.41 N ATOM 1310 CA ASP A 112 20.750 3.004 -53.663 1.00 73.00 C ATOM 1311 C ASP A 112 20.153 1.758 -53.030 1.00 22.50 C ATOM 1312 O ASP A 112 19.016 1.379 -53.316 1.00 13.14 O ATOM 1313 CB ASP A 112 21.725 2.625 -54.775 1.00 64.41 C ATOM 1314 CG ASP A 112 21.049 1.888 -55.911 1.00 14.15 C ATOM 1315 OD1 ASP A 112 20.154 2.481 -56.553 1.00 44.43 O ATOM 1316 OD2 ASP A 112 21.422 0.736 -56.194 1.00 33.44 O ATOM 0 H ASP A 112 22.431 3.757 -52.658 1.00 30.41 H new ATOM 0 HA ASP A 112 19.950 3.596 -54.107 1.00 73.00 H new ATOM 0 HB2 ASP A 112 22.198 3.527 -55.162 1.00 64.41 H new ATOM 0 HB3 ASP A 112 22.518 2.001 -54.362 1.00 64.41 H new ATOM 1321 N CYS A 113 20.929 1.156 -52.140 1.00 2.11 N ATOM 1322 CA CYS A 113 20.497 0.000 -51.358 1.00 63.32 C ATOM 1323 C CYS A 113 19.167 0.262 -50.644 1.00 14.44 C ATOM 1324 O CYS A 113 18.369 -0.653 -50.452 1.00 31.11 O ATOM 1325 CB CYS A 113 21.589 -0.347 -50.337 1.00 31.32 C ATOM 1326 SG CYS A 113 21.130 -1.624 -49.120 1.00 15.44 S ATOM 0 H CYS A 113 21.883 1.456 -51.937 1.00 2.11 H new ATOM 0 HA CYS A 113 20.339 -0.838 -52.037 1.00 63.32 H new ATOM 0 HB2 CYS A 113 22.475 -0.682 -50.876 1.00 31.32 H new ATOM 0 HB3 CYS A 113 21.866 0.561 -49.801 1.00 31.32 H new ATOM 1331 N ARG A 114 18.921 1.522 -50.291 1.00 1.33 N ATOM 1332 CA ARG A 114 17.714 1.913 -49.560 1.00 31.23 C ATOM 1333 C ARG A 114 16.451 1.434 -50.281 1.00 4.14 C ATOM 1334 O ARG A 114 15.521 0.923 -49.660 1.00 52.44 O ATOM 1335 CB ARG A 114 17.697 3.444 -49.399 1.00 64.24 C ATOM 1336 CG ARG A 114 16.552 4.007 -48.563 1.00 72.30 C ATOM 1337 CD ARG A 114 15.248 4.108 -49.343 1.00 62.13 C ATOM 1338 NE ARG A 114 14.197 4.756 -48.564 1.00 34.40 N ATOM 1339 CZ ARG A 114 12.904 4.458 -48.649 1.00 73.52 C ATOM 1340 NH1 ARG A 114 12.480 3.504 -49.472 1.00 52.43 N ATOM 1341 NH2 ARG A 114 12.032 5.118 -47.897 1.00 20.22 N ATOM 0 H ARG A 114 19.548 2.298 -50.502 1.00 1.33 H new ATOM 0 HA ARG A 114 17.727 1.442 -48.577 1.00 31.23 H new ATOM 0 HB2 ARG A 114 18.639 3.754 -48.947 1.00 64.24 H new ATOM 0 HB3 ARG A 114 17.655 3.895 -50.390 1.00 64.24 H new ATOM 0 HG2 ARG A 114 16.400 3.373 -47.689 1.00 72.30 H new ATOM 0 HG3 ARG A 114 16.828 4.995 -48.195 1.00 72.30 H new ATOM 0 HD2 ARG A 114 15.417 4.669 -50.262 1.00 62.13 H new ATOM 0 HD3 ARG A 114 14.921 3.110 -49.635 1.00 62.13 H new ATOM 0 HE ARG A 114 14.474 5.488 -47.909 1.00 34.40 H new ATOM 0 HH11 ARG A 114 13.149 2.992 -50.047 1.00 52.43 H new ATOM 0 HH12 ARG A 114 11.486 3.284 -49.529 1.00 52.43 H new ATOM 0 HH21 ARG A 114 12.356 5.847 -47.261 1.00 20.22 H new ATOM 0 HH22 ARG A 114 11.038 4.897 -47.955 1.00 20.22 H new ATOM 1355 N LYS A 115 16.428 1.605 -51.595 1.00 31.52 N ATOM 1356 CA LYS A 115 15.259 1.256 -52.395 1.00 3.45 C ATOM 1357 C LYS A 115 15.140 -0.254 -52.563 1.00 52.41 C ATOM 1358 O LYS A 115 14.088 -0.850 -52.330 1.00 41.54 O ATOM 1359 CB LYS A 115 15.340 1.895 -53.791 1.00 70.24 C ATOM 1360 CG LYS A 115 15.454 3.411 -53.793 1.00 65.54 C ATOM 1361 CD LYS A 115 16.900 3.875 -53.718 1.00 22.24 C ATOM 1362 CE LYS A 115 17.605 3.828 -55.071 1.00 2.54 C ATOM 1363 NZ LYS A 115 17.710 2.452 -55.632 1.00 12.13 N ATOM 0 H LYS A 115 17.207 1.984 -52.133 1.00 31.52 H new ATOM 0 HA LYS A 115 14.385 1.635 -51.866 1.00 3.45 H new ATOM 0 HB2 LYS A 115 16.200 1.479 -54.316 1.00 70.24 H new ATOM 0 HB3 LYS A 115 14.453 1.611 -54.357 1.00 70.24 H new ATOM 0 HG2 LYS A 115 14.993 3.808 -54.697 1.00 65.54 H new ATOM 0 HG3 LYS A 115 14.899 3.817 -52.947 1.00 65.54 H new ATOM 0 HD2 LYS A 115 16.931 4.894 -53.332 1.00 22.24 H new ATOM 0 HD3 LYS A 115 17.442 3.249 -53.009 1.00 22.24 H new ATOM 0 HE2 LYS A 115 17.066 4.460 -55.776 1.00 2.54 H new ATOM 0 HE3 LYS A 115 18.605 4.248 -54.967 1.00 2.54 H new ATOM 0 HZ1 LYS A 115 18.429 2.437 -56.383 1.00 12.13 H new ATOM 0 HZ2 LYS A 115 17.983 1.790 -54.878 1.00 12.13 H new ATOM 0 HZ3 LYS A 115 16.791 2.167 -56.027 1.00 12.13 H new ATOM 1377 N ASP A 116 16.244 -0.849 -52.964 1.00 3.10 N ATOM 1378 CA ASP A 116 16.253 -2.209 -53.481 1.00 62.11 C ATOM 1379 C ASP A 116 16.270 -3.271 -52.380 1.00 41.12 C ATOM 1380 O ASP A 116 15.595 -4.296 -52.493 1.00 13.22 O ATOM 1381 CB ASP A 116 17.424 -2.383 -54.441 1.00 61.34 C ATOM 1382 CG ASP A 116 17.295 -1.473 -55.649 1.00 13.21 C ATOM 1383 OD1 ASP A 116 17.630 -0.275 -55.539 1.00 74.50 O ATOM 1384 OD2 ASP A 116 16.828 -1.946 -56.710 1.00 74.30 O ATOM 0 H ASP A 116 17.163 -0.407 -52.942 1.00 3.10 H new ATOM 0 HA ASP A 116 15.318 -2.362 -54.019 1.00 62.11 H new ATOM 0 HB2 ASP A 116 18.357 -2.168 -53.920 1.00 61.34 H new ATOM 0 HB3 ASP A 116 17.475 -3.421 -54.770 1.00 61.34 H new ATOM 1389 N ALA A 117 17.018 -3.015 -51.308 1.00 13.33 N ATOM 1390 CA ALA A 117 17.276 -4.026 -50.281 1.00 31.24 C ATOM 1391 C ALA A 117 16.003 -4.541 -49.620 1.00 23.40 C ATOM 1392 O ALA A 117 15.863 -5.742 -49.390 1.00 2.24 O ATOM 1393 CB ALA A 117 18.219 -3.479 -49.222 1.00 14.50 C ATOM 0 H ALA A 117 17.458 -2.113 -51.127 1.00 13.33 H new ATOM 0 HA ALA A 117 17.740 -4.871 -50.790 1.00 31.24 H new ATOM 0 HB1 ALA A 117 18.400 -4.243 -48.466 1.00 14.50 H new ATOM 0 HB2 ALA A 117 19.164 -3.197 -49.687 1.00 14.50 H new ATOM 0 HB3 ALA A 117 17.770 -2.604 -48.752 1.00 14.50 H new ATOM 1399 N GLN A 118 15.070 -3.645 -49.320 1.00 23.11 N ATOM 1400 CA GLN A 118 13.865 -4.028 -48.589 1.00 31.21 C ATOM 1401 C GLN A 118 12.953 -4.949 -49.402 1.00 51.42 C ATOM 1402 O GLN A 118 12.016 -5.533 -48.857 1.00 14.11 O ATOM 1403 CB GLN A 118 13.087 -2.797 -48.134 1.00 51.20 C ATOM 1404 CG GLN A 118 12.681 -1.867 -49.265 1.00 62.42 C ATOM 1405 CD GLN A 118 11.619 -0.870 -48.843 1.00 45.21 C ATOM 1406 OE1 GLN A 118 10.675 -1.312 -48.022 1.00 53.13 O flip ATOM 1407 NE2 GLN A 118 11.617 0.273 -49.293 1.00 4.14 N flip ATOM 0 H GLN A 118 15.122 -2.657 -49.568 1.00 23.11 H new ATOM 0 HA GLN A 118 14.200 -4.585 -47.714 1.00 31.21 H new ATOM 0 HB2 GLN A 118 12.191 -3.122 -47.605 1.00 51.20 H new ATOM 0 HB3 GLN A 118 13.694 -2.240 -47.420 1.00 51.20 H new ATOM 0 HG2 GLN A 118 13.559 -1.329 -49.622 1.00 62.42 H new ATOM 0 HG3 GLN A 118 12.308 -2.458 -50.101 1.00 62.42 H new ATOM 0 HE21 GLN A 118 12.361 0.575 -49.922 1.00 4.14 H new ATOM 0 HE22 GLN A 118 10.871 0.920 -49.038 1.00 4.14 H new ATOM 1416 N THR A 119 13.227 -5.083 -50.696 1.00 12.21 N ATOM 1417 CA THR A 119 12.468 -5.997 -51.541 1.00 13.31 C ATOM 1418 C THR A 119 12.756 -7.443 -51.124 1.00 4.12 C ATOM 1419 O THR A 119 11.953 -8.348 -51.342 1.00 72.01 O ATOM 1420 CB THR A 119 12.817 -5.776 -53.025 1.00 31.52 C ATOM 1421 OG1 THR A 119 12.675 -4.385 -53.342 1.00 72.31 O ATOM 1422 CG2 THR A 119 11.915 -6.593 -53.937 1.00 45.40 C ATOM 0 H THR A 119 13.966 -4.573 -51.180 1.00 12.21 H new ATOM 0 HA THR A 119 11.404 -5.800 -51.414 1.00 13.31 H new ATOM 0 HB THR A 119 13.845 -6.100 -53.185 1.00 31.52 H new ATOM 0 HG1 THR A 119 13.520 -3.921 -53.164 1.00 72.31 H new ATOM 0 HG21 THR A 119 12.189 -6.413 -54.976 1.00 45.40 H new ATOM 0 HG22 THR A 119 12.031 -7.653 -53.710 1.00 45.40 H new ATOM 0 HG23 THR A 119 10.877 -6.300 -53.780 1.00 45.40 H new ATOM 1430 N CYS A 120 13.911 -7.633 -50.500 1.00 74.31 N ATOM 1431 CA CYS A 120 14.282 -8.907 -49.882 1.00 44.04 C ATOM 1432 C CYS A 120 13.504 -9.116 -48.578 1.00 44.12 C ATOM 1433 O CYS A 120 14.073 -9.538 -47.571 1.00 44.11 O ATOM 1434 CB CYS A 120 15.788 -8.926 -49.580 1.00 44.24 C ATOM 1435 SG CYS A 120 16.880 -9.270 -51.007 1.00 13.21 S ATOM 0 H CYS A 120 14.622 -6.908 -50.406 1.00 74.31 H new ATOM 0 HA CYS A 120 14.038 -9.710 -50.578 1.00 44.04 H new ATOM 0 HB2 CYS A 120 16.067 -7.961 -49.157 1.00 44.24 H new ATOM 0 HB3 CYS A 120 15.976 -9.677 -48.813 1.00 44.24 H new ATOM 1440 N ASP A 121 12.204 -8.820 -48.599 1.00 51.30 N ATOM 1441 CA ASP A 121 11.421 -8.736 -47.373 1.00 24.55 C ATOM 1442 C ASP A 121 11.274 -10.091 -46.669 1.00 14.31 C ATOM 1443 O ASP A 121 11.692 -10.222 -45.514 1.00 3.15 O ATOM 1444 CB ASP A 121 10.043 -8.099 -47.654 1.00 50.21 C ATOM 1445 CG ASP A 121 9.174 -8.865 -48.644 1.00 70.13 C ATOM 1446 OD1 ASP A 121 9.692 -9.737 -49.372 1.00 45.03 O ATOM 1447 OD2 ASP A 121 7.954 -8.598 -48.686 1.00 41.12 O ATOM 0 H ASP A 121 11.675 -8.635 -49.451 1.00 51.30 H new ATOM 0 HA ASP A 121 11.970 -8.093 -46.686 1.00 24.55 H new ATOM 0 HB2 ASP A 121 9.502 -8.008 -46.712 1.00 50.21 H new ATOM 0 HB3 ASP A 121 10.196 -7.088 -48.033 1.00 50.21 H new ATOM 1452 N LYS A 122 10.697 -11.096 -47.329 1.00 52.04 N ATOM 1453 CA LYS A 122 10.668 -12.435 -46.740 1.00 20.01 C ATOM 1454 C LYS A 122 11.214 -13.496 -47.690 1.00 34.45 C ATOM 1455 O LYS A 122 12.295 -14.041 -47.478 1.00 52.13 O ATOM 1456 CB LYS A 122 9.247 -12.854 -46.329 1.00 14.44 C ATOM 1457 CG LYS A 122 8.419 -11.770 -45.661 1.00 25.35 C ATOM 1458 CD LYS A 122 7.563 -11.039 -46.680 1.00 4.10 C ATOM 1459 CE LYS A 122 6.682 -9.982 -46.040 1.00 1.44 C ATOM 1460 NZ LYS A 122 5.898 -9.240 -47.060 1.00 31.21 N ATOM 0 H LYS A 122 10.255 -11.014 -48.245 1.00 52.04 H new ATOM 0 HA LYS A 122 11.304 -12.373 -45.857 1.00 20.01 H new ATOM 0 HB2 LYS A 122 8.716 -13.199 -47.217 1.00 14.44 H new ATOM 0 HB3 LYS A 122 9.318 -13.704 -45.650 1.00 14.44 H new ATOM 0 HG2 LYS A 122 7.782 -12.213 -44.895 1.00 25.35 H new ATOM 0 HG3 LYS A 122 9.077 -11.062 -45.158 1.00 25.35 H new ATOM 0 HD2 LYS A 122 8.208 -10.570 -47.423 1.00 4.10 H new ATOM 0 HD3 LYS A 122 6.938 -11.758 -47.209 1.00 4.10 H new ATOM 0 HE2 LYS A 122 6.003 -10.454 -45.329 1.00 1.44 H new ATOM 0 HE3 LYS A 122 7.300 -9.284 -45.475 1.00 1.44 H new ATOM 0 HZ1 LYS A 122 5.593 -8.327 -46.667 1.00 31.21 H new ATOM 0 HZ2 LYS A 122 6.489 -9.076 -47.900 1.00 31.21 H new ATOM 0 HZ3 LYS A 122 5.062 -9.797 -47.328 1.00 31.21 H new ATOM 1474 N LYS A 123 10.452 -13.779 -48.747 1.00 2.40 N ATOM 1475 CA LYS A 123 10.740 -14.914 -49.620 1.00 5.42 C ATOM 1476 C LYS A 123 10.657 -14.542 -51.096 1.00 21.42 C ATOM 1477 O LYS A 123 11.659 -14.476 -51.805 1.00 55.13 O ATOM 1478 CB LYS A 123 9.735 -16.034 -49.363 1.00 12.31 C ATOM 1479 CG LYS A 123 9.806 -16.654 -47.980 1.00 62.33 C ATOM 1480 CD LYS A 123 8.576 -17.509 -47.717 1.00 55.20 C ATOM 1481 CE LYS A 123 8.385 -18.561 -48.800 1.00 44.53 C ATOM 1482 NZ LYS A 123 6.957 -18.946 -48.949 1.00 64.41 N ATOM 0 H LYS A 123 9.631 -13.237 -49.018 1.00 2.40 H new ATOM 0 HA LYS A 123 11.757 -15.235 -49.394 1.00 5.42 H new ATOM 0 HB2 LYS A 123 8.730 -15.642 -49.518 1.00 12.31 H new ATOM 0 HB3 LYS A 123 9.890 -16.818 -50.105 1.00 12.31 H new ATOM 0 HG2 LYS A 123 10.705 -17.264 -47.894 1.00 62.33 H new ATOM 0 HG3 LYS A 123 9.879 -15.870 -47.227 1.00 62.33 H new ATOM 0 HD2 LYS A 123 8.672 -17.997 -46.747 1.00 55.20 H new ATOM 0 HD3 LYS A 123 7.693 -16.872 -47.667 1.00 55.20 H new ATOM 0 HE2 LYS A 123 8.759 -18.178 -49.749 1.00 44.53 H new ATOM 0 HE3 LYS A 123 8.976 -19.444 -48.558 1.00 44.53 H new ATOM 0 HZ1 LYS A 123 6.867 -19.664 -49.696 1.00 64.41 H new ATOM 0 HZ2 LYS A 123 6.607 -19.335 -48.050 1.00 64.41 H new ATOM 0 HZ3 LYS A 123 6.397 -18.108 -49.205 1.00 64.41 H new ATOM 1496 N TYR A 124 9.419 -14.294 -51.517 1.00 73.22 N ATOM 1497 CA TYR A 124 9.044 -14.179 -52.925 1.00 31.43 C ATOM 1498 C TYR A 124 9.909 -13.177 -53.670 1.00 71.40 C ATOM 1499 O TYR A 124 10.544 -13.507 -54.674 1.00 72.34 O ATOM 1500 CB TYR A 124 7.567 -13.775 -53.016 1.00 43.33 C ATOM 1501 CG TYR A 124 6.976 -13.836 -54.407 1.00 22.01 C ATOM 1502 CD1 TYR A 124 6.607 -15.052 -54.968 1.00 53.22 C ATOM 1503 CD2 TYR A 124 6.773 -12.681 -55.152 1.00 73.45 C ATOM 1504 CE1 TYR A 124 6.052 -15.115 -56.230 1.00 13.50 C ATOM 1505 CE2 TYR A 124 6.215 -12.736 -56.415 1.00 4.23 C ATOM 1506 CZ TYR A 124 5.857 -13.956 -56.949 1.00 70.43 C ATOM 1507 OH TYR A 124 5.296 -14.018 -58.205 1.00 63.51 O ATOM 0 H TYR A 124 8.634 -14.165 -50.878 1.00 73.22 H new ATOM 0 HA TYR A 124 9.201 -15.148 -53.399 1.00 31.43 H new ATOM 0 HB2 TYR A 124 6.986 -14.425 -52.361 1.00 43.33 H new ATOM 0 HB3 TYR A 124 7.459 -12.760 -52.635 1.00 43.33 H new ATOM 0 HD1 TYR A 124 6.757 -15.963 -54.407 1.00 53.22 H new ATOM 0 HD2 TYR A 124 7.056 -11.725 -54.737 1.00 73.45 H new ATOM 0 HE1 TYR A 124 5.772 -16.069 -56.652 1.00 13.50 H new ATOM 0 HE2 TYR A 124 6.060 -11.829 -56.980 1.00 4.23 H new ATOM 0 HH TYR A 124 5.226 -13.114 -58.577 1.00 63.51 H new ATOM 1517 N GLU A 125 9.943 -11.957 -53.178 1.00 14.23 N ATOM 1518 CA GLU A 125 10.662 -10.901 -53.858 1.00 14.32 C ATOM 1519 C GLU A 125 12.116 -10.838 -53.409 1.00 65.31 C ATOM 1520 O GLU A 125 12.866 -9.983 -53.868 1.00 73.04 O ATOM 1521 CB GLU A 125 9.958 -9.567 -53.632 1.00 30.43 C ATOM 1522 CG GLU A 125 8.544 -9.547 -54.188 1.00 41.42 C ATOM 1523 CD GLU A 125 7.814 -8.257 -53.890 1.00 53.24 C ATOM 1524 OE1 GLU A 125 7.266 -8.129 -52.777 1.00 5.33 O ATOM 1525 OE2 GLU A 125 7.765 -7.375 -54.778 1.00 63.53 O ATOM 0 H GLU A 125 9.483 -11.673 -52.313 1.00 14.23 H new ATOM 0 HA GLU A 125 10.666 -11.119 -54.926 1.00 14.32 H new ATOM 0 HB2 GLU A 125 9.927 -9.354 -52.563 1.00 30.43 H new ATOM 0 HB3 GLU A 125 10.539 -8.771 -54.099 1.00 30.43 H new ATOM 0 HG2 GLU A 125 8.581 -9.697 -55.267 1.00 41.42 H new ATOM 0 HG3 GLU A 125 7.982 -10.382 -53.769 1.00 41.42 H new ATOM 1532 N SER A 126 12.527 -11.755 -52.537 1.00 74.22 N ATOM 1533 CA SER A 126 13.913 -11.798 -52.092 1.00 73.31 C ATOM 1534 C SER A 126 14.807 -12.231 -53.252 1.00 74.34 C ATOM 1535 O SER A 126 15.842 -11.621 -53.516 1.00 10.55 O ATOM 1536 CB SER A 126 14.073 -12.751 -50.902 1.00 53.33 C ATOM 1537 OG SER A 126 15.377 -12.676 -50.346 1.00 21.22 O ATOM 0 H SER A 126 11.925 -12.471 -52.129 1.00 74.22 H new ATOM 0 HA SER A 126 14.211 -10.802 -51.764 1.00 73.31 H new ATOM 0 HB2 SER A 126 13.336 -12.506 -50.137 1.00 53.33 H new ATOM 0 HB3 SER A 126 13.872 -13.773 -51.223 1.00 53.33 H new ATOM 0 HG SER A 126 15.446 -13.294 -49.589 1.00 21.22 H new ATOM 1543 N ASP A 127 14.390 -13.289 -53.944 1.00 30.12 N ATOM 1544 CA ASP A 127 15.070 -13.736 -55.159 1.00 24.42 C ATOM 1545 C ASP A 127 15.163 -12.601 -56.176 1.00 0.24 C ATOM 1546 O ASP A 127 16.223 -12.351 -56.751 1.00 71.31 O ATOM 1547 CB ASP A 127 14.331 -14.926 -55.772 1.00 62.04 C ATOM 1548 CG ASP A 127 15.023 -15.471 -57.008 1.00 2.30 C ATOM 1549 OD1 ASP A 127 16.007 -16.223 -56.857 1.00 22.43 O ATOM 1550 OD2 ASP A 127 14.573 -15.166 -58.135 1.00 24.21 O ATOM 0 H ASP A 127 13.582 -13.855 -53.684 1.00 30.12 H new ATOM 0 HA ASP A 127 16.080 -14.044 -54.890 1.00 24.42 H new ATOM 0 HB2 ASP A 127 14.247 -15.719 -55.028 1.00 62.04 H new ATOM 0 HB3 ASP A 127 13.317 -14.624 -56.032 1.00 62.04 H new ATOM 1555 N LYS A 128 14.046 -11.910 -56.380 1.00 55.44 N ATOM 1556 CA LYS A 128 14.000 -10.773 -57.291 1.00 2.42 C ATOM 1557 C LYS A 128 14.942 -9.668 -56.816 1.00 61.43 C ATOM 1558 O LYS A 128 15.661 -9.065 -57.609 1.00 15.34 O ATOM 1559 CB LYS A 128 12.568 -10.229 -57.382 1.00 4.11 C ATOM 1560 CG LYS A 128 11.517 -11.256 -57.806 1.00 63.24 C ATOM 1561 CD LYS A 128 11.709 -11.718 -59.245 1.00 43.12 C ATOM 1562 CE LYS A 128 12.723 -12.846 -59.353 1.00 61.52 C ATOM 1563 NZ LYS A 128 12.210 -14.117 -58.777 1.00 33.21 N ATOM 0 H LYS A 128 13.158 -12.119 -55.924 1.00 55.44 H new ATOM 0 HA LYS A 128 14.321 -11.108 -58.277 1.00 2.42 H new ATOM 0 HB2 LYS A 128 12.287 -9.822 -56.411 1.00 4.11 H new ATOM 0 HB3 LYS A 128 12.553 -9.401 -58.091 1.00 4.11 H new ATOM 0 HG2 LYS A 128 11.565 -12.118 -57.140 1.00 63.24 H new ATOM 0 HG3 LYS A 128 10.523 -10.823 -57.695 1.00 63.24 H new ATOM 0 HD2 LYS A 128 10.753 -12.051 -59.649 1.00 43.12 H new ATOM 0 HD3 LYS A 128 12.037 -10.876 -59.855 1.00 43.12 H new ATOM 0 HE2 LYS A 128 12.981 -13.002 -60.400 1.00 61.52 H new ATOM 0 HE3 LYS A 128 13.640 -12.559 -58.838 1.00 61.52 H new ATOM 0 HZ1 LYS A 128 12.947 -14.553 -58.187 1.00 33.21 H new ATOM 0 HZ2 LYS A 128 11.371 -13.921 -58.195 1.00 33.21 H new ATOM 0 HZ3 LYS A 128 11.953 -14.768 -59.546 1.00 33.21 H new ATOM 1577 N CYS A 129 14.934 -9.434 -55.512 1.00 3.13 N ATOM 1578 CA CYS A 129 15.754 -8.407 -54.878 1.00 52.43 C ATOM 1579 C CYS A 129 17.249 -8.709 -55.008 1.00 51.10 C ATOM 1580 O CYS A 129 18.052 -7.800 -55.205 1.00 31.23 O ATOM 1581 CB CYS A 129 15.332 -8.289 -53.408 1.00 34.32 C ATOM 1582 SG CYS A 129 16.609 -7.693 -52.257 1.00 53.14 S ATOM 0 H CYS A 129 14.353 -9.956 -54.856 1.00 3.13 H new ATOM 0 HA CYS A 129 15.593 -7.455 -55.385 1.00 52.43 H new ATOM 0 HB2 CYS A 129 14.476 -7.617 -53.349 1.00 34.32 H new ATOM 0 HB3 CYS A 129 14.993 -9.268 -53.068 1.00 34.32 H new ATOM 1587 N LEU A 130 17.616 -9.984 -54.930 1.00 44.24 N ATOM 1588 CA LEU A 130 19.014 -10.374 -55.056 1.00 43.41 C ATOM 1589 C LEU A 130 19.495 -10.051 -56.464 1.00 13.34 C ATOM 1590 O LEU A 130 20.532 -9.408 -56.652 1.00 70.22 O ATOM 1591 CB LEU A 130 19.188 -11.873 -54.744 1.00 63.34 C ATOM 1592 CG LEU A 130 20.638 -12.382 -54.604 1.00 23.40 C ATOM 1593 CD1 LEU A 130 21.309 -12.556 -55.959 1.00 22.14 C ATOM 1594 CD2 LEU A 130 21.453 -11.443 -53.726 1.00 1.35 C ATOM 0 H LEU A 130 16.970 -10.759 -54.781 1.00 44.24 H new ATOM 0 HA LEU A 130 19.614 -9.817 -54.337 1.00 43.41 H new ATOM 0 HB2 LEU A 130 18.658 -12.093 -53.817 1.00 63.34 H new ATOM 0 HB3 LEU A 130 18.700 -12.445 -55.533 1.00 63.34 H new ATOM 0 HG LEU A 130 20.595 -13.362 -54.128 1.00 23.40 H new ATOM 0 HD11 LEU A 130 22.328 -12.916 -55.817 1.00 22.14 H new ATOM 0 HD12 LEU A 130 20.749 -13.279 -56.552 1.00 22.14 H new ATOM 0 HD13 LEU A 130 21.331 -11.599 -56.480 1.00 22.14 H new ATOM 0 HD21 LEU A 130 22.472 -11.819 -53.639 1.00 1.35 H new ATOM 0 HD22 LEU A 130 21.470 -10.449 -54.173 1.00 1.35 H new ATOM 0 HD23 LEU A 130 21.001 -11.387 -52.735 1.00 1.35 H new ATOM 1606 N ASN A 131 18.721 -10.491 -57.448 1.00 55.31 N ATOM 1607 CA ASN A 131 19.008 -10.200 -58.849 1.00 25.10 C ATOM 1608 C ASN A 131 19.003 -8.700 -59.114 1.00 32.31 C ATOM 1609 O ASN A 131 19.752 -8.207 -59.958 1.00 72.42 O ATOM 1610 CB ASN A 131 17.990 -10.885 -59.758 1.00 62.20 C ATOM 1611 CG ASN A 131 18.179 -12.387 -59.826 1.00 31.32 C ATOM 1612 OD1 ASN A 131 19.287 -12.895 -59.662 1.00 60.24 O ATOM 1613 ND2 ASN A 131 17.104 -13.109 -60.095 1.00 70.14 N ATOM 0 H ASN A 131 17.884 -11.055 -57.301 1.00 55.31 H new ATOM 0 HA ASN A 131 20.003 -10.587 -59.068 1.00 25.10 H new ATOM 0 HB2 ASN A 131 16.984 -10.666 -59.399 1.00 62.20 H new ATOM 0 HB3 ASN A 131 18.068 -10.468 -60.762 1.00 62.20 H new ATOM 0 HD21 ASN A 131 17.177 -14.123 -60.173 1.00 70.14 H new ATOM 0 HD22 ASN A 131 16.202 -12.651 -60.225 1.00 70.14 H new ATOM 1620 N ALA A 132 18.169 -7.983 -58.371 1.00 11.21 N ATOM 1621 CA ALA A 132 18.022 -6.542 -58.535 1.00 12.30 C ATOM 1622 C ALA A 132 19.238 -5.794 -58.003 1.00 24.13 C ATOM 1623 O ALA A 132 19.540 -4.690 -58.451 1.00 43.35 O ATOM 1624 CB ALA A 132 16.762 -6.061 -57.836 1.00 23.15 C ATOM 0 H ALA A 132 17.578 -8.381 -57.641 1.00 11.21 H new ATOM 0 HA ALA A 132 17.942 -6.333 -59.602 1.00 12.30 H new ATOM 0 HB1 ALA A 132 16.663 -4.983 -57.965 1.00 23.15 H new ATOM 0 HB2 ALA A 132 15.894 -6.560 -58.267 1.00 23.15 H new ATOM 0 HB3 ALA A 132 16.824 -6.295 -56.773 1.00 23.15 H new ATOM 1630 N ILE A 133 19.939 -6.400 -57.057 1.00 1.11 N ATOM 1631 CA ILE A 133 21.084 -5.749 -56.443 1.00 54.42 C ATOM 1632 C ILE A 133 22.337 -6.045 -57.252 1.00 43.33 C ATOM 1633 O ILE A 133 23.052 -5.137 -57.670 1.00 32.55 O ATOM 1634 CB ILE A 133 21.286 -6.227 -54.984 1.00 13.20 C ATOM 1635 CG1 ILE A 133 20.182 -5.673 -54.079 1.00 31.14 C ATOM 1636 CG2 ILE A 133 22.658 -5.824 -54.455 1.00 61.34 C ATOM 1637 CD1 ILE A 133 20.231 -4.171 -53.913 1.00 13.12 C ATOM 0 H ILE A 133 19.737 -7.334 -56.701 1.00 1.11 H new ATOM 0 HA ILE A 133 20.896 -4.675 -56.429 1.00 54.42 H new ATOM 0 HB ILE A 133 21.230 -7.316 -54.979 1.00 13.20 H new ATOM 0 HG12 ILE A 133 19.212 -5.953 -54.490 1.00 31.14 H new ATOM 0 HG13 ILE A 133 20.259 -6.141 -53.098 1.00 31.14 H new ATOM 0 HG21 ILE A 133 22.769 -6.174 -53.429 1.00 61.34 H new ATOM 0 HG22 ILE A 133 23.433 -6.271 -55.077 1.00 61.34 H new ATOM 0 HG23 ILE A 133 22.753 -4.738 -54.481 1.00 61.34 H new ATOM 0 HD11 ILE A 133 19.420 -3.850 -53.260 1.00 13.12 H new ATOM 0 HD12 ILE A 133 21.186 -3.885 -53.473 1.00 13.12 H new ATOM 0 HD13 ILE A 133 20.123 -3.694 -54.887 1.00 13.12 H new ATOM 1649 N LYS A 134 22.585 -7.334 -57.461 1.00 54.14 N ATOM 1650 CA LYS A 134 23.713 -7.783 -58.269 1.00 71.30 C ATOM 1651 C LYS A 134 23.785 -7.094 -59.636 1.00 75.44 C ATOM 1652 O LYS A 134 24.880 -6.872 -60.148 1.00 12.02 O ATOM 1653 CB LYS A 134 23.691 -9.312 -58.420 1.00 15.43 C ATOM 1654 CG LYS A 134 22.513 -9.855 -59.215 1.00 45.24 C ATOM 1655 CD LYS A 134 22.368 -11.360 -59.035 1.00 34.25 C ATOM 1656 CE LYS A 134 23.673 -12.090 -59.302 1.00 2.42 C ATOM 1657 NZ LYS A 134 23.548 -13.559 -59.107 1.00 40.42 N ATOM 0 H LYS A 134 22.016 -8.090 -57.079 1.00 54.14 H new ATOM 0 HA LYS A 134 24.618 -7.493 -57.736 1.00 71.30 H new ATOM 0 HB2 LYS A 134 24.615 -9.629 -58.903 1.00 15.43 H new ATOM 0 HB3 LYS A 134 23.680 -9.762 -57.427 1.00 15.43 H new ATOM 0 HG2 LYS A 134 21.597 -9.359 -58.895 1.00 45.24 H new ATOM 0 HG3 LYS A 134 22.648 -9.625 -60.272 1.00 45.24 H new ATOM 0 HD2 LYS A 134 22.033 -11.574 -58.020 1.00 34.25 H new ATOM 0 HD3 LYS A 134 21.598 -11.734 -59.710 1.00 34.25 H new ATOM 0 HE2 LYS A 134 23.998 -11.888 -60.323 1.00 2.42 H new ATOM 0 HE3 LYS A 134 24.446 -11.702 -58.639 1.00 2.42 H new ATOM 0 HZ1 LYS A 134 24.463 -14.014 -59.300 1.00 40.42 H new ATOM 0 HZ2 LYS A 134 23.264 -13.756 -58.126 1.00 40.42 H new ATOM 0 HZ3 LYS A 134 22.830 -13.936 -59.758 1.00 40.42 H new ATOM 1671 N GLU A 135 22.645 -6.744 -60.231 1.00 24.04 N ATOM 1672 CA GLU A 135 22.662 -6.057 -61.520 1.00 72.01 C ATOM 1673 C GLU A 135 23.033 -4.581 -61.360 1.00 2.34 C ATOM 1674 O GLU A 135 23.669 -4.002 -62.234 1.00 73.42 O ATOM 1675 CB GLU A 135 21.317 -6.197 -62.240 1.00 40.32 C ATOM 1676 CG GLU A 135 20.154 -5.537 -61.521 1.00 72.33 C ATOM 1677 CD GLU A 135 18.849 -5.685 -62.268 1.00 64.51 C ATOM 1678 OE1 GLU A 135 18.858 -6.213 -63.404 1.00 44.13 O ATOM 1679 OE2 GLU A 135 17.805 -5.264 -61.731 1.00 70.43 O ATOM 0 H GLU A 135 21.716 -6.921 -59.850 1.00 24.04 H new ATOM 0 HA GLU A 135 23.428 -6.534 -62.132 1.00 72.01 H new ATOM 0 HB2 GLU A 135 21.405 -5.766 -63.237 1.00 40.32 H new ATOM 0 HB3 GLU A 135 21.095 -7.256 -62.369 1.00 40.32 H new ATOM 0 HG2 GLU A 135 20.051 -5.974 -60.528 1.00 72.33 H new ATOM 0 HG3 GLU A 135 20.371 -4.478 -61.383 1.00 72.33 H new ATOM 1686 N LYS A 136 22.607 -3.962 -60.260 1.00 3.41 N ATOM 1687 CA LYS A 136 23.027 -2.595 -59.947 1.00 33.34 C ATOM 1688 C LYS A 136 24.540 -2.513 -59.785 1.00 23.15 C ATOM 1689 O LYS A 136 25.144 -1.474 -60.032 1.00 65.12 O ATOM 1690 CB LYS A 136 22.344 -2.069 -58.680 1.00 35.32 C ATOM 1691 CG LYS A 136 20.853 -1.800 -58.841 1.00 41.33 C ATOM 1692 CD LYS A 136 20.556 -0.906 -60.040 1.00 32.01 C ATOM 1693 CE LYS A 136 21.357 0.391 -60.010 1.00 42.32 C ATOM 1694 NZ LYS A 136 21.032 1.233 -58.831 1.00 40.51 N ATOM 0 H LYS A 136 21.977 -4.380 -59.575 1.00 3.41 H new ATOM 0 HA LYS A 136 22.723 -1.969 -60.786 1.00 33.34 H new ATOM 0 HB2 LYS A 136 22.487 -2.792 -57.877 1.00 35.32 H new ATOM 0 HB3 LYS A 136 22.837 -1.147 -58.371 1.00 35.32 H new ATOM 0 HG2 LYS A 136 20.325 -2.747 -58.956 1.00 41.33 H new ATOM 0 HG3 LYS A 136 20.470 -1.329 -57.935 1.00 41.33 H new ATOM 0 HD2 LYS A 136 20.781 -1.448 -60.959 1.00 32.01 H new ATOM 0 HD3 LYS A 136 19.492 -0.672 -60.061 1.00 32.01 H new ATOM 0 HE2 LYS A 136 22.421 0.157 -60.003 1.00 42.32 H new ATOM 0 HE3 LYS A 136 21.161 0.956 -60.921 1.00 42.32 H new ATOM 0 HZ1 LYS A 136 21.639 2.078 -58.830 1.00 40.51 H new ATOM 0 HZ2 LYS A 136 20.034 1.523 -58.876 1.00 40.51 H new ATOM 0 HZ3 LYS A 136 21.195 0.689 -57.960 1.00 40.51 H new ATOM 1708 N TYR A 137 25.144 -3.622 -59.383 1.00 61.40 N ATOM 1709 CA TYR A 137 26.594 -3.702 -59.247 1.00 51.55 C ATOM 1710 C TYR A 137 27.225 -4.206 -60.544 1.00 31.23 C ATOM 1711 O TYR A 137 28.244 -4.900 -60.534 1.00 64.14 O ATOM 1712 CB TYR A 137 26.973 -4.604 -58.069 1.00 4.31 C ATOM 1713 CG TYR A 137 26.730 -3.967 -56.718 1.00 45.32 C ATOM 1714 CD1 TYR A 137 27.719 -3.212 -56.100 1.00 53.12 C ATOM 1715 CD2 TYR A 137 25.514 -4.112 -56.064 1.00 33.22 C ATOM 1716 CE1 TYR A 137 27.503 -2.622 -54.869 1.00 31.22 C ATOM 1717 CE2 TYR A 137 25.289 -3.525 -54.833 1.00 33.32 C ATOM 1718 CZ TYR A 137 26.284 -2.783 -54.240 1.00 61.44 C ATOM 1719 OH TYR A 137 26.062 -2.200 -53.013 1.00 51.24 O ATOM 0 H TYR A 137 24.651 -4.483 -59.144 1.00 61.40 H new ATOM 0 HA TYR A 137 26.980 -2.702 -59.047 1.00 51.55 H new ATOM 0 HB2 TYR A 137 26.402 -5.530 -58.133 1.00 4.31 H new ATOM 0 HB3 TYR A 137 28.026 -4.872 -58.151 1.00 4.31 H new ATOM 0 HD1 TYR A 137 28.673 -3.084 -56.590 1.00 53.12 H new ATOM 0 HD2 TYR A 137 24.730 -4.694 -56.525 1.00 33.22 H new ATOM 0 HE1 TYR A 137 28.283 -2.039 -54.402 1.00 31.22 H new ATOM 0 HE2 TYR A 137 24.337 -3.648 -54.339 1.00 33.32 H new ATOM 0 HH TYR A 137 25.154 -2.410 -52.711 1.00 51.24 H new ATOM 1729 N LYS A 138 26.599 -3.847 -61.657 1.00 33.25 N ATOM 1730 CA LYS A 138 27.096 -4.186 -62.982 1.00 12.01 C ATOM 1731 C LYS A 138 28.353 -3.372 -63.286 1.00 4.22 C ATOM 1732 O LYS A 138 28.395 -2.168 -63.026 1.00 62.33 O ATOM 1733 CB LYS A 138 26.005 -3.894 -64.014 1.00 14.41 C ATOM 1734 CG LYS A 138 26.260 -4.469 -65.399 1.00 11.14 C ATOM 1735 CD LYS A 138 25.087 -4.191 -66.330 1.00 54.20 C ATOM 1736 CE LYS A 138 23.787 -4.764 -65.780 1.00 34.25 C ATOM 1737 NZ LYS A 138 22.612 -4.395 -66.612 1.00 42.24 N ATOM 0 H LYS A 138 25.731 -3.312 -61.665 1.00 33.25 H new ATOM 0 HA LYS A 138 27.353 -5.245 -63.023 1.00 12.01 H new ATOM 0 HB2 LYS A 138 25.059 -4.288 -63.642 1.00 14.41 H new ATOM 0 HB3 LYS A 138 25.888 -2.814 -64.101 1.00 14.41 H new ATOM 0 HG2 LYS A 138 27.170 -4.035 -65.815 1.00 11.14 H new ATOM 0 HG3 LYS A 138 26.424 -5.544 -65.326 1.00 11.14 H new ATOM 0 HD2 LYS A 138 24.980 -3.115 -66.471 1.00 54.20 H new ATOM 0 HD3 LYS A 138 25.290 -4.622 -67.310 1.00 54.20 H new ATOM 0 HE2 LYS A 138 23.865 -5.850 -65.726 1.00 34.25 H new ATOM 0 HE3 LYS A 138 23.636 -4.405 -64.762 1.00 34.25 H new ATOM 0 HZ1 LYS A 138 21.751 -4.807 -66.199 1.00 42.24 H new ATOM 0 HZ2 LYS A 138 22.520 -3.360 -66.643 1.00 42.24 H new ATOM 0 HZ3 LYS A 138 22.742 -4.760 -67.577 1.00 42.24 H new