USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=27 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+ -175:sc= 0.853 (180deg=0.829) USER MOD Set 1.2: A 85 TYR OH : rot 46:sc= 0.641 USER MOD Set 2.1: A 52 SER OG : rot -160:sc= -0.346 USER MOD Set 2.2: A 123 LYS NZ :NH3+ 178:sc= 0.278 (180deg=0) USER MOD Single : A 45 SER OG : rot -100:sc= 1.21 USER MOD Single : A 49 THR OG1 : rot -44:sc= 0.431 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 : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : A 66 LYS NZ :NH3+ -165:sc= 1.22 (180deg=0.691) USER MOD Single : A 67 LYS NZ :NH3+ 177:sc= 1.1 (180deg=0.991) USER MOD Single : A 68 TYR OH : rot 30:sc= -0.0823 USER MOD Single : A 71 GLN :FLIP amide:sc= -1.23 F(o=-2.5,f=-1.2) USER MOD Single : A 75 THR OG1 : rot -90:sc= 1.63 USER MOD Single : A 79 LYS NZ :NH3+ -120:sc= 1.21 (180deg=-0.122) USER MOD Single : A 86 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0617) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 172:sc= 1.19 (180deg=0.802) USER MOD Single : A 104 THR OG1 : rot -87:sc= 1.12 USER MOD Single : A 115 LYS NZ :NH3+ -164:sc= -0.0461 (180deg=-0.318) USER MOD Single : A 118 GLN :FLIP amide:sc= -0.0788 F(o=-1.2!,f=-0.079) USER MOD Single : A 119 THR OG1 : rot 88:sc= 1.28 USER MOD Single : A 122 LYS NZ :NH3+ 162:sc= 0.572 (180deg=-0.185) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -139:sc= -0.0818 USER MOD Single : A 128 LYS NZ :NH3+ 173:sc= 0.893 (180deg=0.485) USER MOD Single : A 131 ASN : amide:sc= -0.78! X(o=-0.78!,f=-0.76) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -165:sc= 2.28 (180deg=1.45) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -158:sc= 0.0733 (180deg=0.0137) USER MOD ----------------------------------------------------------------- ATOM 222 N PRO A 41 3.332 -11.638 -24.589 1.00 44.12 N ATOM 223 CA PRO A 41 4.753 -11.529 -24.922 1.00 11.34 C ATOM 224 C PRO A 41 5.057 -12.085 -26.308 1.00 34.34 C ATOM 225 O PRO A 41 4.156 -12.519 -27.026 1.00 54.42 O ATOM 226 CB PRO A 41 5.429 -12.390 -23.857 1.00 24.34 C ATOM 227 CG PRO A 41 4.416 -13.424 -23.509 1.00 40.44 C ATOM 228 CD PRO A 41 3.069 -12.770 -23.674 1.00 63.43 C ATOM 0 HA PRO A 41 5.093 -10.493 -24.938 1.00 11.34 H new ATOM 0 HB2 PRO A 41 6.344 -12.844 -24.237 1.00 24.34 H new ATOM 0 HB3 PRO A 41 5.706 -11.797 -22.985 1.00 24.34 H new ATOM 0 HG2 PRO A 41 4.508 -14.293 -24.160 1.00 40.44 H new ATOM 0 HG3 PRO A 41 4.555 -13.775 -22.487 1.00 40.44 H new ATOM 0 HD2 PRO A 41 2.338 -13.461 -24.094 1.00 63.43 H new ATOM 0 HD3 PRO A 41 2.672 -12.427 -22.719 1.00 63.43 H new ATOM 236 N LEU A 42 6.331 -12.068 -26.680 1.00 15.45 N ATOM 237 CA LEU A 42 6.764 -12.682 -27.926 1.00 34.44 C ATOM 238 C LEU A 42 6.549 -14.190 -27.865 1.00 20.52 C ATOM 239 O LEU A 42 7.077 -14.866 -26.975 1.00 24.01 O ATOM 240 CB LEU A 42 8.238 -12.375 -28.197 1.00 44.41 C ATOM 241 CG LEU A 42 8.575 -10.893 -28.386 1.00 72.10 C ATOM 242 CD1 LEU A 42 10.066 -10.715 -28.619 1.00 14.44 C ATOM 243 CD2 LEU A 42 7.781 -10.308 -29.546 1.00 75.41 C ATOM 0 H LEU A 42 7.079 -11.637 -26.138 1.00 15.45 H new ATOM 0 HA LEU A 42 6.170 -12.267 -28.740 1.00 34.44 H new ATOM 0 HB2 LEU A 42 8.831 -12.762 -27.368 1.00 44.41 H new ATOM 0 HB3 LEU A 42 8.547 -12.917 -29.091 1.00 44.41 H new ATOM 0 HG LEU A 42 8.300 -10.358 -27.477 1.00 72.10 H new ATOM 0 HD11 LEU A 42 10.290 -9.656 -28.752 1.00 14.44 H new ATOM 0 HD12 LEU A 42 10.617 -11.097 -27.760 1.00 14.44 H new ATOM 0 HD13 LEU A 42 10.363 -11.263 -29.513 1.00 14.44 H new ATOM 0 HD21 LEU A 42 8.034 -9.254 -29.665 1.00 75.41 H new ATOM 0 HD22 LEU A 42 8.026 -10.846 -30.462 1.00 75.41 H new ATOM 0 HD23 LEU A 42 6.715 -10.405 -29.342 1.00 75.41 H new ATOM 255 N ASP A 43 5.758 -14.703 -28.794 1.00 31.14 N ATOM 256 CA ASP A 43 5.449 -16.125 -28.847 1.00 53.53 C ATOM 257 C ASP A 43 5.316 -16.583 -30.294 1.00 32.14 C ATOM 258 O ASP A 43 5.163 -15.764 -31.199 1.00 54.22 O ATOM 259 CB ASP A 43 4.161 -16.418 -28.068 1.00 41.02 C ATOM 260 CG ASP A 43 3.744 -17.875 -28.148 1.00 52.31 C ATOM 261 OD1 ASP A 43 4.425 -18.730 -27.549 1.00 42.23 O ATOM 262 OD2 ASP A 43 2.734 -18.173 -28.825 1.00 31.12 O ATOM 0 H ASP A 43 5.314 -14.151 -29.528 1.00 31.14 H new ATOM 0 HA ASP A 43 6.266 -16.679 -28.384 1.00 53.53 H new ATOM 0 HB2 ASP A 43 4.303 -16.142 -27.023 1.00 41.02 H new ATOM 0 HB3 ASP A 43 3.357 -15.793 -28.456 1.00 41.02 H new ATOM 267 N ALA A 44 5.373 -17.897 -30.500 1.00 45.10 N ATOM 268 CA ALA A 44 5.273 -18.493 -31.829 1.00 12.12 C ATOM 269 C ALA A 44 3.972 -18.105 -32.530 1.00 61.04 C ATOM 270 O ALA A 44 3.881 -18.154 -33.756 1.00 23.34 O ATOM 271 CB ALA A 44 5.384 -20.007 -31.729 1.00 42.40 C ATOM 0 H ALA A 44 5.490 -18.578 -29.750 1.00 45.10 H new ATOM 0 HA ALA A 44 6.097 -18.107 -32.429 1.00 12.12 H new ATOM 0 HB1 ALA A 44 5.308 -20.444 -32.725 1.00 42.40 H new ATOM 0 HB2 ALA A 44 6.345 -20.273 -31.288 1.00 42.40 H new ATOM 0 HB3 ALA A 44 4.579 -20.390 -31.103 1.00 42.40 H new ATOM 277 N SER A 45 2.960 -17.740 -31.746 1.00 54.31 N ATOM 278 CA SER A 45 1.666 -17.327 -32.282 1.00 74.35 C ATOM 279 C SER A 45 1.796 -16.103 -33.191 1.00 50.55 C ATOM 280 O SER A 45 0.989 -15.900 -34.101 1.00 73.21 O ATOM 281 CB SER A 45 0.703 -17.039 -31.131 1.00 24.25 C ATOM 282 OG SER A 45 1.345 -16.292 -30.112 1.00 52.13 O ATOM 0 H SER A 45 3.013 -17.722 -30.728 1.00 54.31 H new ATOM 0 HA SER A 45 1.272 -18.142 -32.890 1.00 74.35 H new ATOM 0 HB2 SER A 45 -0.161 -16.488 -31.503 1.00 24.25 H new ATOM 0 HB3 SER A 45 0.330 -17.977 -30.720 1.00 24.25 H new ATOM 0 HG SER A 45 1.609 -16.892 -29.384 1.00 52.13 H new ATOM 288 N PHE A 46 2.818 -15.298 -32.942 1.00 1.42 N ATOM 289 CA PHE A 46 3.077 -14.108 -33.739 1.00 70.25 C ATOM 290 C PHE A 46 3.623 -14.485 -35.118 1.00 20.34 C ATOM 291 O PHE A 46 3.405 -13.778 -36.101 1.00 11.22 O ATOM 292 CB PHE A 46 4.073 -13.209 -32.995 1.00 41.34 C ATOM 293 CG PHE A 46 4.423 -11.936 -33.717 1.00 5.24 C ATOM 294 CD1 PHE A 46 3.577 -10.842 -33.666 1.00 24.44 C ATOM 295 CD2 PHE A 46 5.601 -11.836 -34.442 1.00 1.13 C ATOM 296 CE1 PHE A 46 3.898 -9.671 -34.326 1.00 33.22 C ATOM 297 CE2 PHE A 46 5.926 -10.669 -35.105 1.00 13.31 C ATOM 298 CZ PHE A 46 5.073 -9.585 -35.046 1.00 2.25 C ATOM 0 H PHE A 46 3.487 -15.449 -32.187 1.00 1.42 H new ATOM 0 HA PHE A 46 2.142 -13.568 -33.887 1.00 70.25 H new ATOM 0 HB2 PHE A 46 3.657 -12.956 -32.020 1.00 41.34 H new ATOM 0 HB3 PHE A 46 4.988 -13.773 -32.815 1.00 41.34 H new ATOM 0 HD1 PHE A 46 2.656 -10.904 -33.105 1.00 24.44 H new ATOM 0 HD2 PHE A 46 6.272 -12.681 -34.489 1.00 1.13 H new ATOM 0 HE1 PHE A 46 3.230 -8.824 -34.279 1.00 33.22 H new ATOM 0 HE2 PHE A 46 6.845 -10.604 -35.668 1.00 13.31 H new ATOM 0 HZ PHE A 46 5.325 -8.671 -35.563 1.00 2.25 H new ATOM 308 N CYS A 47 4.320 -15.610 -35.182 1.00 51.15 N ATOM 309 CA CYS A 47 5.031 -16.016 -36.389 1.00 74.11 C ATOM 310 C CYS A 47 4.179 -16.912 -37.292 1.00 15.01 C ATOM 311 O CYS A 47 4.666 -17.407 -38.303 1.00 51.50 O ATOM 312 CB CYS A 47 6.310 -16.754 -36.002 1.00 21.02 C ATOM 313 SG CYS A 47 7.297 -15.919 -34.719 1.00 44.11 S ATOM 0 H CYS A 47 4.410 -16.265 -34.405 1.00 51.15 H new ATOM 0 HA CYS A 47 5.267 -15.112 -36.951 1.00 74.11 H new ATOM 0 HB2 CYS A 47 6.048 -17.752 -35.650 1.00 21.02 H new ATOM 0 HB3 CYS A 47 6.926 -16.881 -36.892 1.00 21.02 H new ATOM 318 N ARG A 48 2.911 -17.101 -36.937 1.00 53.11 N ATOM 319 CA ARG A 48 2.047 -18.090 -37.600 1.00 25.34 C ATOM 320 C ARG A 48 1.828 -17.818 -39.094 1.00 3.32 C ATOM 321 O ARG A 48 1.278 -18.661 -39.800 1.00 13.44 O ATOM 322 CB ARG A 48 0.691 -18.171 -36.903 1.00 13.51 C ATOM 323 CG ARG A 48 0.751 -18.785 -35.518 1.00 21.13 C ATOM 324 CD ARG A 48 -0.624 -18.821 -34.875 1.00 61.54 C ATOM 325 NE ARG A 48 -0.598 -19.432 -33.551 1.00 62.01 N ATOM 326 CZ ARG A 48 -1.574 -19.302 -32.657 1.00 72.33 C ATOM 327 NH1 ARG A 48 -2.641 -18.564 -32.939 1.00 30.52 N ATOM 328 NH2 ARG A 48 -1.482 -19.901 -31.479 1.00 72.14 N ATOM 0 H ARG A 48 2.451 -16.581 -36.189 1.00 53.11 H new ATOM 0 HA ARG A 48 2.576 -19.040 -37.521 1.00 25.34 H new ATOM 0 HB2 ARG A 48 0.271 -17.168 -36.828 1.00 13.51 H new ATOM 0 HB3 ARG A 48 0.010 -18.756 -37.521 1.00 13.51 H new ATOM 0 HG2 ARG A 48 1.152 -19.796 -35.583 1.00 21.13 H new ATOM 0 HG3 ARG A 48 1.434 -18.211 -34.892 1.00 21.13 H new ATOM 0 HD2 ARG A 48 -1.013 -17.806 -34.797 1.00 61.54 H new ATOM 0 HD3 ARG A 48 -1.308 -19.377 -35.516 1.00 61.54 H new ATOM 0 HE ARG A 48 0.216 -19.991 -33.296 1.00 62.01 H new ATOM 0 HH11 ARG A 48 -2.713 -18.096 -33.842 1.00 30.52 H new ATOM 0 HH12 ARG A 48 -3.389 -18.465 -32.252 1.00 30.52 H new ATOM 0 HH21 ARG A 48 -0.661 -20.464 -31.256 1.00 72.14 H new ATOM 0 HH22 ARG A 48 -2.232 -19.800 -30.795 1.00 72.14 H new ATOM 342 N THR A 49 2.217 -16.647 -39.570 1.00 72.32 N ATOM 343 CA THR A 49 2.069 -16.332 -40.986 1.00 61.22 C ATOM 344 C THR A 49 3.426 -16.007 -41.619 1.00 42.52 C ATOM 345 O THR A 49 3.505 -15.494 -42.737 1.00 13.21 O ATOM 346 CB THR A 49 1.081 -15.156 -41.189 1.00 65.20 C ATOM 347 OG1 THR A 49 0.733 -15.032 -42.576 1.00 33.45 O ATOM 348 CG2 THR A 49 1.675 -13.844 -40.688 1.00 3.41 C ATOM 0 H THR A 49 2.633 -15.905 -39.007 1.00 72.32 H new ATOM 0 HA THR A 49 1.662 -17.212 -41.484 1.00 61.22 H new ATOM 0 HB THR A 49 0.183 -15.371 -40.609 1.00 65.20 H new ATOM 0 HG1 THR A 49 1.539 -15.125 -43.125 1.00 33.45 H new ATOM 0 HG21 THR A 49 0.959 -13.037 -40.844 1.00 3.41 H new ATOM 0 HG22 THR A 49 1.900 -13.929 -39.625 1.00 3.41 H new ATOM 0 HG23 THR A 49 2.591 -13.626 -41.237 1.00 3.41 H new ATOM 356 N ALA A 50 4.501 -16.342 -40.914 1.00 33.53 N ATOM 357 CA ALA A 50 5.844 -16.005 -41.369 1.00 31.11 C ATOM 358 C ALA A 50 6.440 -17.098 -42.260 1.00 42.12 C ATOM 359 O ALA A 50 7.596 -17.000 -42.683 1.00 31.44 O ATOM 360 CB ALA A 50 6.746 -15.735 -40.177 1.00 4.52 C ATOM 0 H ALA A 50 4.469 -16.845 -40.027 1.00 33.53 H new ATOM 0 HA ALA A 50 5.771 -15.102 -41.975 1.00 31.11 H new ATOM 0 HB1 ALA A 50 7.747 -15.484 -40.528 1.00 4.52 H new ATOM 0 HB2 ALA A 50 6.345 -14.903 -39.598 1.00 4.52 H new ATOM 0 HB3 ALA A 50 6.794 -16.624 -39.548 1.00 4.52 H new ATOM 366 N GLY A 51 5.655 -18.141 -42.521 1.00 63.54 N ATOM 367 CA GLY A 51 6.073 -19.202 -43.428 1.00 3.44 C ATOM 368 C GLY A 51 7.367 -19.877 -43.012 1.00 53.52 C ATOM 369 O GLY A 51 7.392 -20.674 -42.074 1.00 3.00 O ATOM 0 H GLY A 51 4.728 -18.272 -42.117 1.00 63.54 H new ATOM 0 HA2 GLY A 51 5.284 -19.951 -43.487 1.00 3.44 H new ATOM 0 HA3 GLY A 51 6.194 -18.787 -44.429 1.00 3.44 H new ATOM 373 N SER A 52 8.451 -19.536 -43.696 1.00 21.44 N ATOM 374 CA SER A 52 9.754 -20.130 -43.424 1.00 74.14 C ATOM 375 C SER A 52 10.322 -19.649 -42.089 1.00 13.10 C ATOM 376 O SER A 52 11.286 -20.214 -41.573 1.00 32.11 O ATOM 377 CB SER A 52 10.719 -19.793 -44.558 1.00 0.40 C ATOM 378 OG SER A 52 10.181 -20.192 -45.804 1.00 50.14 O ATOM 0 H SER A 52 8.454 -18.847 -44.448 1.00 21.44 H new ATOM 0 HA SER A 52 9.628 -21.211 -43.360 1.00 74.14 H new ATOM 0 HB2 SER A 52 10.917 -18.721 -44.568 1.00 0.40 H new ATOM 0 HB3 SER A 52 11.673 -20.292 -44.391 1.00 0.40 H new ATOM 0 HG SER A 52 10.903 -20.269 -46.462 1.00 50.14 H new ATOM 384 N ARG A 53 9.733 -18.597 -41.535 1.00 40.40 N ATOM 385 CA ARG A 53 10.144 -18.105 -40.226 1.00 42.24 C ATOM 386 C ARG A 53 9.142 -18.563 -39.174 1.00 34.00 C ATOM 387 O ARG A 53 9.357 -18.404 -37.980 1.00 41.21 O ATOM 388 CB ARG A 53 10.243 -16.574 -40.220 1.00 61.00 C ATOM 389 CG ARG A 53 10.933 -15.991 -41.447 1.00 71.02 C ATOM 390 CD ARG A 53 12.324 -16.570 -41.645 1.00 70.33 C ATOM 391 NE ARG A 53 13.215 -16.268 -40.529 1.00 53.51 N ATOM 392 CZ ARG A 53 14.070 -17.146 -40.008 1.00 51.15 C ATOM 393 NH1 ARG A 53 14.098 -18.398 -40.450 1.00 72.43 N ATOM 394 NH2 ARG A 53 14.892 -16.776 -39.040 1.00 25.12 N ATOM 0 H ARG A 53 8.974 -18.071 -41.968 1.00 40.40 H new ATOM 0 HA ARG A 53 11.130 -18.510 -39.997 1.00 42.24 H new ATOM 0 HB2 ARG A 53 9.239 -16.156 -40.148 1.00 61.00 H new ATOM 0 HB3 ARG A 53 10.784 -16.259 -39.328 1.00 61.00 H new ATOM 0 HG2 ARG A 53 10.328 -16.189 -42.332 1.00 71.02 H new ATOM 0 HG3 ARG A 53 11.002 -14.908 -41.344 1.00 71.02 H new ATOM 0 HD2 ARG A 53 12.251 -17.651 -41.766 1.00 70.33 H new ATOM 0 HD3 ARG A 53 12.752 -16.174 -42.566 1.00 70.33 H new ATOM 0 HE ARG A 53 13.181 -15.332 -40.126 1.00 53.51 H new ATOM 0 HH11 ARG A 53 13.463 -18.691 -41.192 1.00 72.43 H new ATOM 0 HH12 ARG A 53 14.755 -19.066 -40.047 1.00 72.43 H new ATOM 0 HH21 ARG A 53 14.871 -15.817 -38.692 1.00 25.12 H new ATOM 0 HH22 ARG A 53 15.547 -17.449 -38.642 1.00 25.12 H new ATOM 408 N GLU A 54 8.047 -19.146 -39.648 1.00 10.23 N ATOM 409 CA GLU A 54 6.955 -19.596 -38.790 1.00 20.24 C ATOM 410 C GLU A 54 7.368 -20.799 -37.952 1.00 4.32 C ATOM 411 O GLU A 54 7.348 -20.756 -36.723 1.00 55.12 O ATOM 412 CB GLU A 54 5.755 -19.971 -39.658 1.00 41.14 C ATOM 413 CG GLU A 54 4.572 -20.535 -38.894 1.00 44.03 C ATOM 414 CD GLU A 54 3.600 -21.246 -39.807 1.00 1.10 C ATOM 415 OE1 GLU A 54 3.110 -20.624 -40.769 1.00 44.23 O ATOM 416 OE2 GLU A 54 3.342 -22.444 -39.584 1.00 52.32 O ATOM 0 H GLU A 54 7.890 -19.321 -40.641 1.00 10.23 H new ATOM 0 HA GLU A 54 6.694 -18.783 -38.113 1.00 20.24 H new ATOM 0 HB2 GLU A 54 5.429 -19.086 -40.205 1.00 41.14 H new ATOM 0 HB3 GLU A 54 6.075 -20.704 -40.399 1.00 41.14 H new ATOM 0 HG2 GLU A 54 4.929 -21.228 -38.132 1.00 44.03 H new ATOM 0 HG3 GLU A 54 4.057 -19.727 -38.374 1.00 44.03 H new ATOM 423 N LYS A 55 7.747 -21.866 -38.635 1.00 65.33 N ATOM 424 CA LYS A 55 8.058 -23.135 -37.990 1.00 2.55 C ATOM 425 C LYS A 55 9.329 -23.035 -37.160 1.00 72.43 C ATOM 426 O LYS A 55 9.431 -23.630 -36.088 1.00 20.13 O ATOM 427 CB LYS A 55 8.182 -24.222 -39.054 1.00 32.23 C ATOM 428 CG LYS A 55 6.905 -24.396 -39.854 1.00 12.33 C ATOM 429 CD LYS A 55 7.100 -25.294 -41.057 1.00 41.20 C ATOM 430 CE LYS A 55 5.802 -25.456 -41.823 1.00 73.12 C ATOM 431 NZ LYS A 55 5.967 -26.279 -43.049 1.00 4.20 N ATOM 0 H LYS A 55 7.848 -21.879 -39.650 1.00 65.33 H new ATOM 0 HA LYS A 55 7.249 -23.393 -37.306 1.00 2.55 H new ATOM 0 HB2 LYS A 55 9.000 -23.973 -39.730 1.00 32.23 H new ATOM 0 HB3 LYS A 55 8.440 -25.167 -38.576 1.00 32.23 H new ATOM 0 HG2 LYS A 55 6.131 -24.815 -39.212 1.00 12.33 H new ATOM 0 HG3 LYS A 55 6.550 -23.420 -40.185 1.00 12.33 H new ATOM 0 HD2 LYS A 55 7.863 -24.873 -41.711 1.00 41.20 H new ATOM 0 HD3 LYS A 55 7.461 -26.270 -40.733 1.00 41.20 H new ATOM 0 HE2 LYS A 55 5.057 -25.918 -41.176 1.00 73.12 H new ATOM 0 HE3 LYS A 55 5.420 -24.473 -42.097 1.00 73.12 H new ATOM 0 HZ1 LYS A 55 5.053 -26.361 -43.538 1.00 4.20 H new ATOM 0 HZ2 LYS A 55 6.658 -25.826 -43.681 1.00 4.20 H new ATOM 0 HZ3 LYS A 55 6.306 -27.227 -42.788 1.00 4.20 H new ATOM 445 N ASP A 56 10.285 -22.260 -37.653 1.00 63.51 N ATOM 446 CA ASP A 56 11.524 -22.016 -36.923 1.00 11.53 C ATOM 447 C ASP A 56 11.219 -21.283 -35.621 1.00 51.34 C ATOM 448 O ASP A 56 11.805 -21.560 -34.575 1.00 21.42 O ATOM 449 CB ASP A 56 12.486 -21.193 -37.783 1.00 24.34 C ATOM 450 CG ASP A 56 13.869 -21.084 -37.178 1.00 40.05 C ATOM 451 OD1 ASP A 56 14.510 -22.132 -36.965 1.00 4.22 O ATOM 452 OD2 ASP A 56 14.332 -19.951 -36.939 1.00 23.34 O ATOM 0 H ASP A 56 10.228 -21.789 -38.556 1.00 63.51 H new ATOM 0 HA ASP A 56 11.996 -22.970 -36.689 1.00 11.53 H new ATOM 0 HB2 ASP A 56 12.562 -21.647 -38.771 1.00 24.34 H new ATOM 0 HB3 ASP A 56 12.076 -20.193 -37.923 1.00 24.34 H new ATOM 457 N CYS A 57 10.260 -20.368 -35.699 1.00 74.10 N ATOM 458 CA CYS A 57 9.817 -19.588 -34.548 1.00 12.01 C ATOM 459 C CYS A 57 9.138 -20.480 -33.509 1.00 14.21 C ATOM 460 O CYS A 57 9.234 -20.232 -32.304 1.00 22.15 O ATOM 461 CB CYS A 57 8.854 -18.494 -35.020 1.00 2.03 C ATOM 462 SG CYS A 57 8.150 -17.455 -33.703 1.00 1.54 S ATOM 0 H CYS A 57 9.766 -20.145 -36.563 1.00 74.10 H new ATOM 0 HA CYS A 57 10.687 -19.131 -34.076 1.00 12.01 H new ATOM 0 HB2 CYS A 57 9.379 -17.851 -35.726 1.00 2.03 H new ATOM 0 HB3 CYS A 57 8.036 -18.964 -35.565 1.00 2.03 H new ATOM 467 N ARG A 58 8.468 -21.531 -33.979 1.00 42.25 N ATOM 468 CA ARG A 58 7.758 -22.443 -33.087 1.00 61.01 C ATOM 469 C ARG A 58 8.724 -23.091 -32.097 1.00 73.13 C ATOM 470 O ARG A 58 8.425 -23.208 -30.911 1.00 14.33 O ATOM 471 CB ARG A 58 7.024 -23.531 -33.881 1.00 13.24 C ATOM 472 CG ARG A 58 5.971 -23.000 -34.845 1.00 71.21 C ATOM 473 CD ARG A 58 5.207 -24.136 -35.515 1.00 55.42 C ATOM 474 NE ARG A 58 4.262 -23.655 -36.527 1.00 50.35 N ATOM 475 CZ ARG A 58 2.958 -23.940 -36.530 1.00 44.04 C ATOM 476 NH1 ARG A 58 2.424 -24.655 -35.550 1.00 15.23 N ATOM 477 NH2 ARG A 58 2.188 -23.511 -37.520 1.00 34.13 N ATOM 0 H ARG A 58 8.403 -21.771 -34.968 1.00 42.25 H new ATOM 0 HA ARG A 58 7.022 -21.858 -32.535 1.00 61.01 H new ATOM 0 HB2 ARG A 58 7.756 -24.110 -34.444 1.00 13.24 H new ATOM 0 HB3 ARG A 58 6.546 -24.216 -33.180 1.00 13.24 H new ATOM 0 HG2 ARG A 58 5.274 -22.358 -34.307 1.00 71.21 H new ATOM 0 HG3 ARG A 58 6.450 -22.383 -35.606 1.00 71.21 H new ATOM 0 HD2 ARG A 58 5.915 -24.821 -35.980 1.00 55.42 H new ATOM 0 HD3 ARG A 58 4.666 -24.703 -34.757 1.00 55.42 H new ATOM 0 HE ARG A 58 4.624 -23.065 -37.276 1.00 50.35 H new ATOM 0 HH11 ARG A 58 3.010 -24.992 -34.786 1.00 15.23 H new ATOM 0 HH12 ARG A 58 1.427 -24.869 -35.560 1.00 15.23 H new ATOM 0 HH21 ARG A 58 2.592 -22.963 -38.280 1.00 34.13 H new ATOM 0 HH22 ARG A 58 1.192 -23.729 -37.522 1.00 34.13 H new ATOM 491 N LYS A 59 9.879 -23.514 -32.594 1.00 51.22 N ATOM 492 CA LYS A 59 10.891 -24.138 -31.749 1.00 63.02 C ATOM 493 C LYS A 59 11.656 -23.118 -30.908 1.00 31.22 C ATOM 494 O LYS A 59 11.700 -23.225 -29.682 1.00 20.22 O ATOM 495 CB LYS A 59 11.872 -24.948 -32.599 1.00 34.02 C ATOM 496 CG LYS A 59 11.407 -26.367 -32.888 1.00 53.33 C ATOM 497 CD LYS A 59 11.323 -27.187 -31.609 1.00 33.15 C ATOM 498 CE LYS A 59 10.980 -28.640 -31.890 1.00 71.32 C ATOM 499 NZ LYS A 59 10.934 -29.441 -30.639 1.00 42.41 N ATOM 0 H LYS A 59 10.139 -23.437 -33.577 1.00 51.22 H new ATOM 0 HA LYS A 59 10.365 -24.802 -31.063 1.00 63.02 H new ATOM 0 HB2 LYS A 59 12.034 -24.429 -33.544 1.00 34.02 H new ATOM 0 HB3 LYS A 59 12.834 -24.988 -32.088 1.00 34.02 H new ATOM 0 HG2 LYS A 59 10.431 -26.342 -33.372 1.00 53.33 H new ATOM 0 HG3 LYS A 59 12.096 -26.844 -33.585 1.00 53.33 H new ATOM 0 HD2 LYS A 59 12.275 -27.134 -31.081 1.00 33.15 H new ATOM 0 HD3 LYS A 59 10.569 -26.757 -30.950 1.00 33.15 H new ATOM 0 HE2 LYS A 59 10.016 -28.696 -32.395 1.00 71.32 H new ATOM 0 HE3 LYS A 59 11.720 -29.065 -32.568 1.00 71.32 H new ATOM 0 HZ1 LYS A 59 10.697 -30.428 -30.867 1.00 42.41 H new ATOM 0 HZ2 LYS A 59 11.862 -29.407 -30.171 1.00 42.41 H new ATOM 0 HZ3 LYS A 59 10.210 -29.050 -30.003 1.00 42.41 H new ATOM 513 N ASP A 60 12.217 -22.110 -31.563 1.00 61.32 N ATOM 514 CA ASP A 60 13.174 -21.210 -30.917 1.00 61.10 C ATOM 515 C ASP A 60 12.534 -20.314 -29.866 1.00 43.02 C ATOM 516 O ASP A 60 13.113 -20.093 -28.803 1.00 42.31 O ATOM 517 CB ASP A 60 13.888 -20.354 -31.959 1.00 23.34 C ATOM 518 CG ASP A 60 15.140 -21.016 -32.497 1.00 33.42 C ATOM 519 OD1 ASP A 60 15.118 -22.241 -32.742 1.00 15.25 O ATOM 520 OD2 ASP A 60 16.165 -20.317 -32.651 1.00 13.12 O ATOM 0 H ASP A 60 12.028 -21.892 -32.541 1.00 61.32 H new ATOM 0 HA ASP A 60 13.894 -21.845 -30.402 1.00 61.10 H new ATOM 0 HB2 ASP A 60 13.206 -20.149 -32.784 1.00 23.34 H new ATOM 0 HB3 ASP A 60 14.151 -19.393 -31.516 1.00 23.34 H new ATOM 525 N VAL A 61 11.342 -19.811 -30.148 1.00 21.41 N ATOM 526 CA VAL A 61 10.710 -18.844 -29.259 1.00 52.21 C ATOM 527 C VAL A 61 10.152 -19.520 -28.008 1.00 44.43 C ATOM 528 O VAL A 61 10.265 -18.984 -26.905 1.00 53.24 O ATOM 529 CB VAL A 61 9.602 -18.046 -29.978 1.00 64.41 C ATOM 530 CG1 VAL A 61 8.878 -17.119 -29.011 1.00 45.34 C ATOM 531 CG2 VAL A 61 10.199 -17.250 -31.127 1.00 61.24 C ATOM 0 H VAL A 61 10.796 -20.052 -30.976 1.00 21.41 H new ATOM 0 HA VAL A 61 11.485 -18.142 -28.953 1.00 52.21 H new ATOM 0 HB VAL A 61 8.873 -18.753 -30.374 1.00 64.41 H new ATOM 0 HG11 VAL A 61 8.103 -16.570 -29.545 1.00 45.34 H new ATOM 0 HG12 VAL A 61 8.422 -17.708 -28.215 1.00 45.34 H new ATOM 0 HG13 VAL A 61 9.590 -16.415 -28.580 1.00 45.34 H new ATOM 0 HG21 VAL A 61 9.411 -16.689 -31.630 1.00 61.24 H new ATOM 0 HG22 VAL A 61 10.947 -16.557 -30.740 1.00 61.24 H new ATOM 0 HG23 VAL A 61 10.668 -17.931 -31.836 1.00 61.24 H new ATOM 541 N GLN A 62 9.574 -20.705 -28.169 1.00 2.54 N ATOM 542 CA GLN A 62 9.021 -21.429 -27.028 1.00 31.43 C ATOM 543 C GLN A 62 10.139 -22.002 -26.167 1.00 2.42 C ATOM 544 O GLN A 62 9.964 -22.219 -24.969 1.00 61.53 O ATOM 545 CB GLN A 62 8.092 -22.554 -27.482 1.00 50.44 C ATOM 546 CG GLN A 62 6.907 -22.074 -28.304 1.00 63.42 C ATOM 547 CD GLN A 62 5.881 -23.164 -28.517 1.00 4.13 C ATOM 548 OE1 GLN A 62 4.929 -23.295 -27.749 1.00 15.12 O ATOM 549 NE2 GLN A 62 6.078 -23.964 -29.551 1.00 0.41 N ATOM 0 H GLN A 62 9.476 -21.181 -29.066 1.00 2.54 H new ATOM 0 HA GLN A 62 8.440 -20.720 -26.438 1.00 31.43 H new ATOM 0 HB2 GLN A 62 8.665 -23.271 -28.071 1.00 50.44 H new ATOM 0 HB3 GLN A 62 7.723 -23.085 -26.604 1.00 50.44 H new ATOM 0 HG2 GLN A 62 6.437 -21.228 -27.802 1.00 63.42 H new ATOM 0 HG3 GLN A 62 7.259 -21.715 -29.271 1.00 63.42 H new ATOM 0 HE21 GLN A 62 6.881 -23.819 -30.162 1.00 0.41 H new ATOM 0 HE22 GLN A 62 5.427 -24.726 -29.737 1.00 0.41 H new ATOM 558 N ALA A 63 11.283 -22.253 -26.791 1.00 2.32 N ATOM 559 CA ALA A 63 12.463 -22.708 -26.066 1.00 3.11 C ATOM 560 C ALA A 63 12.984 -21.609 -25.147 1.00 22.24 C ATOM 561 O ALA A 63 13.631 -21.884 -24.136 1.00 22.23 O ATOM 562 CB ALA A 63 13.550 -23.145 -27.034 1.00 71.42 C ATOM 0 H ALA A 63 11.419 -22.149 -27.797 1.00 2.32 H new ATOM 0 HA ALA A 63 12.178 -23.565 -25.455 1.00 3.11 H new ATOM 0 HB1 ALA A 63 14.422 -23.481 -26.474 1.00 71.42 H new ATOM 0 HB2 ALA A 63 13.179 -23.962 -27.653 1.00 71.42 H new ATOM 0 HB3 ALA A 63 13.829 -22.306 -27.671 1.00 71.42 H new ATOM 568 N CYS A 64 12.686 -20.367 -25.500 1.00 41.42 N ATOM 569 CA CYS A 64 13.075 -19.225 -24.691 1.00 15.31 C ATOM 570 C CYS A 64 12.099 -19.078 -23.527 1.00 2.11 C ATOM 571 O CYS A 64 10.912 -18.819 -23.729 1.00 52.41 O ATOM 572 CB CYS A 64 13.087 -17.958 -25.552 1.00 10.35 C ATOM 573 SG CYS A 64 14.071 -16.584 -24.871 1.00 63.14 S ATOM 0 H CYS A 64 12.172 -20.125 -26.348 1.00 41.42 H new ATOM 0 HA CYS A 64 14.078 -19.378 -24.294 1.00 15.31 H new ATOM 0 HB2 CYS A 64 13.474 -18.210 -26.539 1.00 10.35 H new ATOM 0 HB3 CYS A 64 12.060 -17.619 -25.689 1.00 10.35 H new ATOM 578 N ASP A 65 12.585 -19.274 -22.310 1.00 53.41 N ATOM 579 CA ASP A 65 11.717 -19.263 -21.136 1.00 24.25 C ATOM 580 C ASP A 65 11.598 -17.875 -20.534 1.00 1.33 C ATOM 581 O ASP A 65 10.501 -17.339 -20.391 1.00 23.12 O ATOM 582 CB ASP A 65 12.247 -20.209 -20.064 1.00 44.42 C ATOM 583 CG ASP A 65 11.286 -20.337 -18.898 1.00 44.03 C ATOM 584 OD1 ASP A 65 10.236 -20.995 -19.063 1.00 62.32 O ATOM 585 OD2 ASP A 65 11.570 -19.779 -17.816 1.00 34.04 O ATOM 0 H ASP A 65 13.570 -19.442 -22.107 1.00 53.41 H new ATOM 0 HA ASP A 65 10.733 -19.590 -21.473 1.00 24.25 H new ATOM 0 HB2 ASP A 65 12.421 -21.192 -20.501 1.00 44.42 H new ATOM 0 HB3 ASP A 65 13.209 -19.846 -19.703 1.00 44.42 H new ATOM 590 N LYS A 66 12.743 -17.316 -20.169 1.00 20.12 N ATOM 591 CA LYS A 66 12.801 -16.047 -19.456 1.00 11.11 C ATOM 592 C LYS A 66 12.088 -14.928 -20.218 1.00 24.31 C ATOM 593 O LYS A 66 11.361 -14.137 -19.618 1.00 73.33 O ATOM 594 CB LYS A 66 14.256 -15.668 -19.189 1.00 54.45 C ATOM 595 CG LYS A 66 14.409 -14.387 -18.380 1.00 73.42 C ATOM 596 CD LYS A 66 15.868 -14.062 -18.094 1.00 44.34 C ATOM 597 CE LYS A 66 15.989 -12.933 -17.081 1.00 22.43 C ATOM 598 NZ LYS A 66 17.403 -12.560 -16.816 1.00 35.11 N ATOM 0 H LYS A 66 13.657 -17.728 -20.358 1.00 20.12 H new ATOM 0 HA LYS A 66 12.279 -16.174 -18.507 1.00 11.11 H new ATOM 0 HB2 LYS A 66 14.745 -16.485 -18.658 1.00 54.45 H new ATOM 0 HB3 LYS A 66 14.774 -15.552 -20.141 1.00 54.45 H new ATOM 0 HG2 LYS A 66 13.953 -13.559 -18.923 1.00 73.42 H new ATOM 0 HG3 LYS A 66 13.869 -14.486 -17.439 1.00 73.42 H new ATOM 0 HD2 LYS A 66 16.374 -14.950 -17.716 1.00 44.34 H new ATOM 0 HD3 LYS A 66 16.369 -13.779 -19.020 1.00 44.34 H new ATOM 0 HE2 LYS A 66 15.448 -12.060 -17.447 1.00 22.43 H new ATOM 0 HE3 LYS A 66 15.514 -13.234 -16.147 1.00 22.43 H new ATOM 0 HZ1 LYS A 66 17.453 -11.981 -15.954 1.00 35.11 H new ATOM 0 HZ2 LYS A 66 17.971 -13.422 -16.688 1.00 35.11 H new ATOM 0 HZ3 LYS A 66 17.775 -12.016 -17.621 1.00 35.11 H new ATOM 612 N LYS A 67 12.287 -14.889 -21.538 1.00 72.24 N ATOM 613 CA LYS A 67 11.679 -13.877 -22.412 1.00 70.34 C ATOM 614 C LYS A 67 12.228 -12.471 -22.154 1.00 24.35 C ATOM 615 O LYS A 67 12.886 -11.892 -23.023 1.00 24.12 O ATOM 616 CB LYS A 67 10.149 -13.880 -22.292 1.00 32.04 C ATOM 617 CG LYS A 67 9.494 -15.142 -22.836 1.00 3.33 C ATOM 618 CD LYS A 67 9.806 -15.344 -24.313 1.00 23.13 C ATOM 619 CE LYS A 67 9.119 -16.586 -24.864 1.00 11.11 C ATOM 620 NZ LYS A 67 7.633 -16.470 -24.840 1.00 11.15 N ATOM 0 H LYS A 67 12.875 -15.559 -22.034 1.00 72.24 H new ATOM 0 HA LYS A 67 11.951 -14.152 -23.431 1.00 70.34 H new ATOM 0 HB2 LYS A 67 9.876 -13.763 -21.243 1.00 32.04 H new ATOM 0 HB3 LYS A 67 9.750 -13.016 -22.824 1.00 32.04 H new ATOM 0 HG2 LYS A 67 9.841 -16.006 -22.269 1.00 3.33 H new ATOM 0 HG3 LYS A 67 8.415 -15.081 -22.697 1.00 3.33 H new ATOM 0 HD2 LYS A 67 9.484 -14.469 -24.877 1.00 23.13 H new ATOM 0 HD3 LYS A 67 10.884 -15.432 -24.449 1.00 23.13 H new ATOM 0 HE2 LYS A 67 9.451 -16.758 -25.888 1.00 11.11 H new ATOM 0 HE3 LYS A 67 9.423 -17.455 -24.280 1.00 11.11 H new ATOM 0 HZ1 LYS A 67 7.212 -17.317 -25.271 1.00 11.15 H new ATOM 0 HZ2 LYS A 67 7.307 -16.384 -23.856 1.00 11.15 H new ATOM 0 HZ3 LYS A 67 7.342 -15.628 -25.376 1.00 11.15 H new ATOM 634 N TYR A 68 12.004 -11.934 -20.962 1.00 33.41 N ATOM 635 CA TYR A 68 12.372 -10.559 -20.664 1.00 4.03 C ATOM 636 C TYR A 68 13.179 -10.511 -19.375 1.00 72.44 C ATOM 637 O TYR A 68 12.917 -11.266 -18.439 1.00 23.43 O ATOM 638 CB TYR A 68 11.128 -9.674 -20.557 1.00 13.23 C ATOM 639 CG TYR A 68 10.429 -9.448 -21.882 1.00 61.20 C ATOM 640 CD1 TYR A 68 10.778 -8.382 -22.701 1.00 45.40 C ATOM 641 CD2 TYR A 68 9.429 -10.308 -22.318 1.00 54.00 C ATOM 642 CE1 TYR A 68 10.148 -8.175 -23.914 1.00 73.41 C ATOM 643 CE2 TYR A 68 8.794 -10.109 -23.530 1.00 14.33 C ATOM 644 CZ TYR A 68 9.158 -9.043 -24.324 1.00 70.54 C ATOM 645 OH TYR A 68 8.529 -8.845 -25.534 1.00 42.11 O ATOM 0 H TYR A 68 11.568 -12.432 -20.186 1.00 33.41 H new ATOM 0 HA TYR A 68 12.985 -10.175 -21.479 1.00 4.03 H new ATOM 0 HB2 TYR A 68 10.426 -10.131 -19.859 1.00 13.23 H new ATOM 0 HB3 TYR A 68 11.413 -8.709 -20.137 1.00 13.23 H new ATOM 0 HD1 TYR A 68 11.556 -7.703 -22.385 1.00 45.40 H new ATOM 0 HD2 TYR A 68 9.143 -11.146 -21.700 1.00 54.00 H new ATOM 0 HE1 TYR A 68 10.429 -7.339 -24.537 1.00 73.41 H new ATOM 0 HE2 TYR A 68 8.017 -10.786 -23.853 1.00 14.33 H new ATOM 0 HH TYR A 68 9.149 -8.414 -26.158 1.00 42.11 H new ATOM 655 N ASP A 69 14.177 -9.639 -19.348 1.00 1.21 N ATOM 656 CA ASP A 69 15.118 -9.591 -18.237 1.00 32.13 C ATOM 657 C ASP A 69 14.543 -8.825 -17.048 1.00 25.02 C ATOM 658 O ASP A 69 13.439 -8.277 -17.114 1.00 15.35 O ATOM 659 CB ASP A 69 16.446 -8.971 -18.679 1.00 70.52 C ATOM 660 CG ASP A 69 17.620 -9.554 -17.917 1.00 52.43 C ATOM 661 OD1 ASP A 69 17.944 -9.046 -16.824 1.00 74.51 O ATOM 662 OD2 ASP A 69 18.201 -10.550 -18.392 1.00 43.41 O ATOM 0 H ASP A 69 14.356 -8.955 -20.083 1.00 1.21 H new ATOM 0 HA ASP A 69 15.300 -10.617 -17.917 1.00 32.13 H new ATOM 0 HB2 ASP A 69 16.587 -9.137 -19.747 1.00 70.52 H new ATOM 0 HB3 ASP A 69 16.413 -7.892 -18.526 1.00 70.52 H new ATOM 667 N ASP A 70 15.324 -8.757 -15.979 1.00 42.23 N ATOM 668 CA ASP A 70 14.861 -8.236 -14.696 1.00 50.24 C ATOM 669 C ASP A 70 14.544 -6.744 -14.777 1.00 51.11 C ATOM 670 O ASP A 70 13.654 -6.252 -14.087 1.00 60.43 O ATOM 671 CB ASP A 70 15.927 -8.501 -13.629 1.00 42.42 C ATOM 672 CG ASP A 70 15.466 -8.162 -12.227 1.00 12.32 C ATOM 673 OD1 ASP A 70 14.776 -8.999 -11.608 1.00 0.12 O ATOM 674 OD2 ASP A 70 15.823 -7.078 -11.724 1.00 40.15 O ATOM 0 H ASP A 70 16.298 -9.061 -15.975 1.00 42.23 H new ATOM 0 HA ASP A 70 13.937 -8.748 -14.427 1.00 50.24 H new ATOM 0 HB2 ASP A 70 16.215 -9.552 -13.666 1.00 42.42 H new ATOM 0 HB3 ASP A 70 16.818 -7.918 -13.862 1.00 42.42 H new ATOM 679 N GLN A 71 15.249 -6.039 -15.655 1.00 45.55 N ATOM 680 CA GLN A 71 15.082 -4.594 -15.791 1.00 45.22 C ATOM 681 C GLN A 71 13.800 -4.262 -16.554 1.00 74.55 C ATOM 682 O GLN A 71 13.417 -3.097 -16.669 1.00 1.31 O ATOM 683 CB GLN A 71 16.267 -3.962 -16.538 1.00 73.13 C ATOM 684 CG GLN A 71 17.648 -4.265 -15.966 1.00 31.33 C ATOM 685 CD GLN A 71 18.178 -5.622 -16.390 1.00 34.12 C ATOM 686 OE1 GLN A 71 18.010 -6.617 -15.541 1.00 25.20 O flip ATOM 687 NE2 GLN A 71 18.778 -5.759 -17.458 1.00 33.13 N flip ATOM 0 H GLN A 71 15.942 -6.444 -16.284 1.00 45.55 H new ATOM 0 HA GLN A 71 15.029 -4.186 -14.782 1.00 45.22 H new ATOM 0 HB2 GLN A 71 16.241 -4.300 -17.574 1.00 73.13 H new ATOM 0 HB3 GLN A 71 16.129 -2.881 -16.552 1.00 73.13 H new ATOM 0 HG2 GLN A 71 18.346 -3.492 -16.286 1.00 31.33 H new ATOM 0 HG3 GLN A 71 17.602 -4.222 -14.878 1.00 31.33 H new ATOM 0 HE21 GLN A 71 18.887 -4.964 -18.088 1.00 33.13 H new ATOM 0 HE22 GLN A 71 19.166 -6.667 -17.712 1.00 33.13 H new ATOM 696 N GLY A 72 13.140 -5.284 -17.080 1.00 30.12 N ATOM 697 CA GLY A 72 11.999 -5.053 -17.944 1.00 72.23 C ATOM 698 C GLY A 72 12.429 -4.951 -19.386 1.00 44.53 C ATOM 699 O GLY A 72 11.642 -4.610 -20.268 1.00 51.32 O ATOM 0 H GLY A 72 13.372 -6.265 -16.925 1.00 30.12 H new ATOM 0 HA2 GLY A 72 11.281 -5.866 -17.831 1.00 72.23 H new ATOM 0 HA3 GLY A 72 11.491 -4.136 -17.646 1.00 72.23 H new ATOM 703 N ARG A 73 13.700 -5.232 -19.616 1.00 64.22 N ATOM 704 CA ARG A 73 14.283 -5.116 -20.937 1.00 52.23 C ATOM 705 C ARG A 73 14.339 -6.456 -21.646 1.00 44.10 C ATOM 706 O ARG A 73 14.258 -7.510 -21.018 1.00 63.20 O ATOM 707 CB ARG A 73 15.680 -4.513 -20.844 1.00 44.12 C ATOM 708 CG ARG A 73 15.667 -3.005 -20.696 1.00 31.02 C ATOM 709 CD ARG A 73 14.985 -2.356 -21.890 1.00 30.10 C ATOM 710 NE ARG A 73 15.641 -2.725 -23.146 1.00 63.44 N ATOM 711 CZ ARG A 73 14.992 -3.006 -24.279 1.00 33.12 C ATOM 712 NH1 ARG A 73 13.668 -2.922 -24.336 1.00 32.34 N ATOM 713 NH2 ARG A 73 15.670 -3.389 -25.354 1.00 61.35 N ATOM 0 H ARG A 73 14.351 -5.545 -18.896 1.00 64.22 H new ATOM 0 HA ARG A 73 13.643 -4.457 -21.524 1.00 52.23 H new ATOM 0 HB2 ARG A 73 16.203 -4.951 -19.994 1.00 44.12 H new ATOM 0 HB3 ARG A 73 16.245 -4.780 -21.737 1.00 44.12 H new ATOM 0 HG2 ARG A 73 15.147 -2.729 -19.779 1.00 31.02 H new ATOM 0 HG3 ARG A 73 16.688 -2.634 -20.608 1.00 31.02 H new ATOM 0 HD2 ARG A 73 13.938 -2.659 -21.922 1.00 30.10 H new ATOM 0 HD3 ARG A 73 15.000 -1.272 -21.775 1.00 30.10 H new ATOM 0 HE ARG A 73 16.660 -2.770 -23.156 1.00 63.44 H new ATOM 0 HH11 ARG A 73 13.139 -2.641 -23.511 1.00 32.34 H new ATOM 0 HH12 ARG A 73 13.180 -3.138 -25.205 1.00 32.34 H new ATOM 0 HH21 ARG A 73 16.686 -3.469 -25.315 1.00 61.35 H new ATOM 0 HH22 ARG A 73 15.175 -3.604 -26.220 1.00 61.35 H new ATOM 727 N GLU A 74 14.475 -6.394 -22.959 1.00 11.43 N ATOM 728 CA GLU A 74 14.568 -7.583 -23.784 1.00 24.43 C ATOM 729 C GLU A 74 15.859 -8.329 -23.483 1.00 2.33 C ATOM 730 O GLU A 74 16.931 -7.722 -23.411 1.00 1.11 O ATOM 731 CB GLU A 74 14.516 -7.185 -25.259 1.00 62.30 C ATOM 732 CG GLU A 74 13.285 -6.365 -25.605 1.00 4.44 C ATOM 733 CD GLU A 74 13.322 -5.808 -27.010 1.00 54.14 C ATOM 734 OE1 GLU A 74 13.965 -4.753 -27.216 1.00 22.41 O ATOM 735 OE2 GLU A 74 12.696 -6.405 -27.908 1.00 3.32 O ATOM 0 H GLU A 74 14.524 -5.519 -23.481 1.00 11.43 H new ATOM 0 HA GLU A 74 13.729 -8.242 -23.562 1.00 24.43 H new ATOM 0 HB2 GLU A 74 15.410 -6.613 -25.508 1.00 62.30 H new ATOM 0 HB3 GLU A 74 14.532 -8.085 -25.874 1.00 62.30 H new ATOM 0 HG2 GLU A 74 12.397 -6.987 -25.490 1.00 4.44 H new ATOM 0 HG3 GLU A 74 13.192 -5.542 -24.896 1.00 4.44 H new ATOM 742 N THR A 75 15.749 -9.635 -23.292 1.00 64.15 N ATOM 743 CA THR A 75 16.907 -10.468 -23.007 1.00 3.10 C ATOM 744 C THR A 75 17.803 -10.590 -24.234 1.00 52.42 C ATOM 745 O THR A 75 17.443 -10.130 -25.318 1.00 75.21 O ATOM 746 CB THR A 75 16.474 -11.881 -22.570 1.00 4.44 C ATOM 747 OG1 THR A 75 15.556 -12.430 -23.529 1.00 72.03 O ATOM 748 CG2 THR A 75 15.831 -11.861 -21.192 1.00 22.43 C ATOM 0 H THR A 75 14.865 -10.143 -23.330 1.00 64.15 H new ATOM 0 HA THR A 75 17.459 -9.989 -22.198 1.00 3.10 H new ATOM 0 HB THR A 75 17.365 -12.506 -22.519 1.00 4.44 H new ATOM 0 HG1 THR A 75 14.639 -12.195 -23.275 1.00 72.03 H new ATOM 0 HG21 THR A 75 15.537 -12.873 -20.913 1.00 22.43 H new ATOM 0 HG22 THR A 75 16.544 -11.477 -20.463 1.00 22.43 H new ATOM 0 HG23 THR A 75 14.950 -11.219 -21.211 1.00 22.43 H new ATOM 756 N ALA A 76 18.963 -11.212 -24.065 1.00 54.13 N ATOM 757 CA ALA A 76 19.821 -11.534 -25.198 1.00 22.33 C ATOM 758 C ALA A 76 19.060 -12.429 -26.171 1.00 42.12 C ATOM 759 O ALA A 76 19.131 -12.257 -27.388 1.00 51.03 O ATOM 760 CB ALA A 76 21.095 -12.218 -24.725 1.00 14.21 C ATOM 0 H ALA A 76 19.330 -11.502 -23.159 1.00 54.13 H new ATOM 0 HA ALA A 76 20.104 -10.613 -25.707 1.00 22.33 H new ATOM 0 HB1 ALA A 76 21.723 -12.451 -25.585 1.00 14.21 H new ATOM 0 HB2 ALA A 76 21.635 -11.554 -24.050 1.00 14.21 H new ATOM 0 HB3 ALA A 76 20.840 -13.139 -24.201 1.00 14.21 H new ATOM 766 N CYS A 77 18.311 -13.367 -25.607 1.00 72.50 N ATOM 767 CA CYS A 77 17.444 -14.241 -26.383 1.00 35.20 C ATOM 768 C CYS A 77 16.432 -13.420 -27.177 1.00 75.21 C ATOM 769 O CYS A 77 16.265 -13.614 -28.380 1.00 61.11 O ATOM 770 CB CYS A 77 16.722 -15.218 -25.451 1.00 43.54 C ATOM 771 SG CYS A 77 15.504 -16.286 -26.279 1.00 75.33 S ATOM 0 H CYS A 77 18.288 -13.543 -24.602 1.00 72.50 H new ATOM 0 HA CYS A 77 18.054 -14.808 -27.087 1.00 35.20 H new ATOM 0 HB2 CYS A 77 17.464 -15.847 -24.959 1.00 43.54 H new ATOM 0 HB3 CYS A 77 16.217 -14.650 -24.670 1.00 43.54 H new ATOM 776 N ALA A 78 15.796 -12.470 -26.498 1.00 13.12 N ATOM 777 CA ALA A 78 14.802 -11.603 -27.121 1.00 43.11 C ATOM 778 C ALA A 78 15.431 -10.742 -28.211 1.00 42.24 C ATOM 779 O ALA A 78 14.785 -10.408 -29.202 1.00 42.13 O ATOM 780 CB ALA A 78 14.126 -10.732 -26.077 1.00 1.32 C ATOM 0 H ALA A 78 15.953 -12.280 -25.508 1.00 13.12 H new ATOM 0 HA ALA A 78 14.047 -12.236 -27.586 1.00 43.11 H new ATOM 0 HB1 ALA A 78 13.388 -10.092 -26.560 1.00 1.32 H new ATOM 0 HB2 ALA A 78 13.631 -11.365 -25.340 1.00 1.32 H new ATOM 0 HB3 ALA A 78 14.873 -10.113 -25.580 1.00 1.32 H new ATOM 786 N LYS A 79 16.713 -10.441 -28.053 1.00 4.54 N ATOM 787 CA LYS A 79 17.413 -9.542 -28.963 1.00 65.42 C ATOM 788 C LYS A 79 17.772 -10.300 -30.234 1.00 62.20 C ATOM 789 O LYS A 79 17.643 -9.780 -31.345 1.00 14.12 O ATOM 790 CB LYS A 79 18.670 -8.983 -28.274 1.00 51.24 C ATOM 791 CG LYS A 79 19.756 -8.455 -29.209 1.00 72.22 C ATOM 792 CD LYS A 79 19.301 -7.258 -30.039 1.00 24.05 C ATOM 793 CE LYS A 79 20.478 -6.652 -30.791 1.00 52.14 C ATOM 794 NZ LYS A 79 20.064 -5.609 -31.765 1.00 74.04 N ATOM 0 H LYS A 79 17.293 -10.808 -27.299 1.00 4.54 H new ATOM 0 HA LYS A 79 16.772 -8.701 -29.229 1.00 65.42 H new ATOM 0 HB2 LYS A 79 18.368 -8.177 -27.606 1.00 51.24 H new ATOM 0 HB3 LYS A 79 19.101 -9.768 -27.652 1.00 51.24 H new ATOM 0 HG2 LYS A 79 20.628 -8.171 -28.620 1.00 72.22 H new ATOM 0 HG3 LYS A 79 20.071 -9.255 -29.879 1.00 72.22 H new ATOM 0 HD2 LYS A 79 18.532 -7.569 -30.746 1.00 24.05 H new ATOM 0 HD3 LYS A 79 18.852 -6.507 -29.389 1.00 24.05 H new ATOM 0 HE2 LYS A 79 21.176 -6.218 -30.075 1.00 52.14 H new ATOM 0 HE3 LYS A 79 21.013 -7.443 -31.318 1.00 52.14 H new ATOM 0 HZ1 LYS A 79 20.357 -5.892 -32.722 1.00 74.04 H new ATOM 0 HZ2 LYS A 79 19.030 -5.499 -31.737 1.00 74.04 H new ATOM 0 HZ3 LYS A 79 20.515 -4.705 -31.518 1.00 74.04 H new ATOM 808 N GLY A 80 18.195 -11.545 -30.055 1.00 4.20 N ATOM 809 CA GLY A 80 18.504 -12.398 -31.184 1.00 21.21 C ATOM 810 C GLY A 80 17.270 -12.707 -32.004 1.00 72.03 C ATOM 811 O GLY A 80 17.351 -12.864 -33.221 1.00 42.34 O ATOM 0 H GLY A 80 18.330 -11.980 -29.142 1.00 4.20 H new ATOM 0 HA2 GLY A 80 19.248 -11.912 -31.815 1.00 21.21 H new ATOM 0 HA3 GLY A 80 18.947 -13.328 -30.827 1.00 21.21 H new ATOM 815 N ILE A 81 16.117 -12.752 -31.341 1.00 41.03 N ATOM 816 CA ILE A 81 14.859 -13.068 -32.003 1.00 2.40 C ATOM 817 C ILE A 81 14.418 -11.906 -32.891 1.00 21.01 C ATOM 818 O ILE A 81 14.018 -12.111 -34.034 1.00 72.45 O ATOM 819 CB ILE A 81 13.749 -13.394 -30.970 1.00 65.10 C ATOM 820 CG1 ILE A 81 14.053 -14.723 -30.271 1.00 51.14 C ATOM 821 CG2 ILE A 81 12.374 -13.439 -31.630 1.00 11.32 C ATOM 822 CD1 ILE A 81 13.067 -15.077 -29.178 1.00 74.54 C ATOM 0 H ILE A 81 16.031 -12.572 -30.341 1.00 41.03 H new ATOM 0 HA ILE A 81 15.020 -13.950 -32.623 1.00 2.40 H new ATOM 0 HB ILE A 81 13.734 -12.598 -30.225 1.00 65.10 H new ATOM 0 HG12 ILE A 81 14.060 -15.521 -31.014 1.00 51.14 H new ATOM 0 HG13 ILE A 81 15.055 -14.677 -29.843 1.00 51.14 H new ATOM 0 HG21 ILE A 81 11.618 -13.670 -30.880 1.00 11.32 H new ATOM 0 HG22 ILE A 81 12.155 -12.471 -32.080 1.00 11.32 H new ATOM 0 HG23 ILE A 81 12.366 -14.209 -32.402 1.00 11.32 H new ATOM 0 HD11 ILE A 81 13.347 -16.030 -28.730 1.00 74.54 H new ATOM 0 HD12 ILE A 81 13.076 -14.300 -28.414 1.00 74.54 H new ATOM 0 HD13 ILE A 81 12.066 -15.156 -29.603 1.00 74.54 H new ATOM 834 N ARG A 82 14.508 -10.691 -32.352 1.00 14.44 N ATOM 835 CA ARG A 82 14.126 -9.476 -33.077 1.00 14.12 C ATOM 836 C ARG A 82 14.737 -9.425 -34.476 1.00 41.43 C ATOM 837 O ARG A 82 14.042 -9.166 -35.455 1.00 23.41 O ATOM 838 CB ARG A 82 14.555 -8.235 -32.287 1.00 21.13 C ATOM 839 CG ARG A 82 13.927 -8.142 -30.905 1.00 73.23 C ATOM 840 CD ARG A 82 12.412 -8.100 -30.977 1.00 31.40 C ATOM 841 NE ARG A 82 11.931 -6.882 -31.625 1.00 52.44 N ATOM 842 CZ ARG A 82 11.101 -6.866 -32.666 1.00 63.30 C ATOM 843 NH1 ARG A 82 10.662 -8.008 -33.187 1.00 34.50 N ATOM 844 NH2 ARG A 82 10.717 -5.708 -33.190 1.00 52.03 N ATOM 0 H ARG A 82 14.846 -10.519 -31.405 1.00 14.44 H new ATOM 0 HA ARG A 82 13.042 -9.492 -33.186 1.00 14.12 H new ATOM 0 HB2 ARG A 82 15.640 -8.238 -32.184 1.00 21.13 H new ATOM 0 HB3 ARG A 82 14.292 -7.344 -32.857 1.00 21.13 H new ATOM 0 HG2 ARG A 82 14.239 -8.997 -30.306 1.00 73.23 H new ATOM 0 HG3 ARG A 82 14.292 -7.248 -30.399 1.00 73.23 H new ATOM 0 HD2 ARG A 82 12.050 -8.970 -31.525 1.00 31.40 H new ATOM 0 HD3 ARG A 82 11.999 -8.163 -29.970 1.00 31.40 H new ATOM 0 HE ARG A 82 12.252 -5.987 -31.256 1.00 52.44 H new ATOM 0 HH11 ARG A 82 10.961 -8.898 -32.789 1.00 34.50 H new ATOM 0 HH12 ARG A 82 10.026 -7.994 -33.984 1.00 34.50 H new ATOM 0 HH21 ARG A 82 11.058 -4.832 -32.795 1.00 52.03 H new ATOM 0 HH22 ARG A 82 10.081 -5.695 -33.987 1.00 52.03 H new ATOM 858 N GLU A 83 16.031 -9.690 -34.567 1.00 53.53 N ATOM 859 CA GLU A 83 16.738 -9.570 -35.837 1.00 14.22 C ATOM 860 C GLU A 83 16.598 -10.838 -36.685 1.00 10.23 C ATOM 861 O GLU A 83 16.721 -10.794 -37.912 1.00 50.12 O ATOM 862 CB GLU A 83 18.215 -9.264 -35.584 1.00 34.53 C ATOM 863 CG GLU A 83 18.431 -8.055 -34.684 1.00 42.22 C ATOM 864 CD GLU A 83 19.893 -7.745 -34.439 1.00 51.34 C ATOM 865 OE1 GLU A 83 20.704 -8.689 -34.375 1.00 42.41 O ATOM 866 OE2 GLU A 83 20.235 -6.551 -34.299 1.00 62.44 O ATOM 0 H GLU A 83 16.612 -9.988 -33.783 1.00 53.53 H new ATOM 0 HA GLU A 83 16.288 -8.749 -36.395 1.00 14.22 H new ATOM 0 HB2 GLU A 83 18.688 -10.135 -35.131 1.00 34.53 H new ATOM 0 HB3 GLU A 83 18.713 -9.092 -36.538 1.00 34.53 H new ATOM 0 HG2 GLU A 83 17.953 -7.185 -35.134 1.00 42.22 H new ATOM 0 HG3 GLU A 83 17.938 -8.230 -33.728 1.00 42.22 H new ATOM 873 N LYS A 84 16.330 -11.961 -36.029 1.00 10.23 N ATOM 874 CA LYS A 84 16.223 -13.248 -36.711 1.00 32.21 C ATOM 875 C LYS A 84 14.825 -13.441 -37.305 1.00 32.24 C ATOM 876 O LYS A 84 14.657 -14.097 -38.334 1.00 35.21 O ATOM 877 CB LYS A 84 16.545 -14.384 -35.735 1.00 54.31 C ATOM 878 CG LYS A 84 16.484 -15.771 -36.351 1.00 71.31 C ATOM 879 CD LYS A 84 16.806 -16.853 -35.332 1.00 31.35 C ATOM 880 CE LYS A 84 16.662 -18.241 -35.932 1.00 71.41 C ATOM 881 NZ LYS A 84 17.022 -19.318 -34.972 1.00 73.32 N ATOM 0 H LYS A 84 16.182 -12.007 -35.021 1.00 10.23 H new ATOM 0 HA LYS A 84 16.943 -13.264 -37.530 1.00 32.21 H new ATOM 0 HB2 LYS A 84 17.542 -14.224 -35.326 1.00 54.31 H new ATOM 0 HB3 LYS A 84 15.846 -14.339 -34.899 1.00 54.31 H new ATOM 0 HG2 LYS A 84 15.490 -15.943 -36.763 1.00 71.31 H new ATOM 0 HG3 LYS A 84 17.188 -15.832 -37.181 1.00 71.31 H new ATOM 0 HD2 LYS A 84 17.823 -16.718 -34.965 1.00 31.35 H new ATOM 0 HD3 LYS A 84 16.142 -16.756 -34.473 1.00 31.35 H new ATOM 0 HE2 LYS A 84 15.634 -18.384 -36.265 1.00 71.41 H new ATOM 0 HE3 LYS A 84 17.297 -18.319 -36.815 1.00 71.41 H new ATOM 0 HZ1 LYS A 84 16.989 -20.239 -35.455 1.00 73.32 H new ATOM 0 HZ2 LYS A 84 17.982 -19.152 -34.608 1.00 73.32 H new ATOM 0 HZ3 LYS A 84 16.347 -19.317 -34.181 1.00 73.32 H new ATOM 895 N TYR A 85 13.830 -12.869 -36.648 1.00 43.34 N ATOM 896 CA TYR A 85 12.443 -13.006 -37.076 1.00 60.14 C ATOM 897 C TYR A 85 11.855 -11.647 -37.430 1.00 41.51 C ATOM 898 O TYR A 85 10.667 -11.399 -37.216 1.00 61.35 O ATOM 899 CB TYR A 85 11.613 -13.676 -35.980 1.00 31.12 C ATOM 900 CG TYR A 85 12.097 -15.065 -35.635 1.00 41.52 C ATOM 901 CD1 TYR A 85 11.747 -16.155 -36.420 1.00 22.55 C ATOM 902 CD2 TYR A 85 12.917 -15.283 -34.537 1.00 23.35 C ATOM 903 CE1 TYR A 85 12.198 -17.423 -36.116 1.00 71.31 C ATOM 904 CE2 TYR A 85 13.375 -16.547 -34.229 1.00 15.31 C ATOM 905 CZ TYR A 85 13.012 -17.613 -35.020 1.00 63.34 C ATOM 906 OH TYR A 85 13.470 -18.873 -34.718 1.00 41.42 O ATOM 0 H TYR A 85 13.956 -12.301 -35.810 1.00 43.34 H new ATOM 0 HA TYR A 85 12.417 -13.634 -37.966 1.00 60.14 H new ATOM 0 HB2 TYR A 85 11.638 -13.056 -35.084 1.00 31.12 H new ATOM 0 HB3 TYR A 85 10.573 -13.730 -36.302 1.00 31.12 H new ATOM 0 HD1 TYR A 85 11.112 -16.008 -37.281 1.00 22.55 H new ATOM 0 HD2 TYR A 85 13.201 -14.449 -33.913 1.00 23.35 H new ATOM 0 HE1 TYR A 85 11.915 -18.262 -36.734 1.00 71.31 H new ATOM 0 HE2 TYR A 85 14.015 -16.699 -33.372 1.00 15.31 H new ATOM 0 HH TYR A 85 13.800 -19.305 -35.533 1.00 41.42 H new ATOM 916 N LYS A 86 12.708 -10.775 -37.959 1.00 33.43 N ATOM 917 CA LYS A 86 12.308 -9.431 -38.364 1.00 52.43 C ATOM 918 C LYS A 86 11.054 -9.473 -39.247 1.00 22.21 C ATOM 919 O LYS A 86 10.911 -10.348 -40.105 1.00 22.24 O ATOM 920 CB LYS A 86 13.454 -8.738 -39.119 1.00 12.11 C ATOM 921 CG LYS A 86 13.697 -9.290 -40.516 1.00 50.43 C ATOM 922 CD LYS A 86 14.809 -8.543 -41.234 1.00 31.44 C ATOM 923 CE LYS A 86 16.188 -9.055 -40.852 1.00 2.05 C ATOM 924 NZ LYS A 86 16.478 -10.378 -41.472 1.00 50.21 N ATOM 0 H LYS A 86 13.694 -10.979 -38.119 1.00 33.43 H new ATOM 0 HA LYS A 86 12.077 -8.863 -37.463 1.00 52.43 H new ATOM 0 HB2 LYS A 86 13.235 -7.673 -39.193 1.00 12.11 H new ATOM 0 HB3 LYS A 86 14.370 -8.835 -38.537 1.00 12.11 H new ATOM 0 HG2 LYS A 86 13.954 -10.347 -40.449 1.00 50.43 H new ATOM 0 HG3 LYS A 86 12.778 -9.221 -41.099 1.00 50.43 H new ATOM 0 HD2 LYS A 86 14.673 -8.641 -42.311 1.00 31.44 H new ATOM 0 HD3 LYS A 86 14.740 -7.481 -40.999 1.00 31.44 H new ATOM 0 HE2 LYS A 86 16.943 -8.334 -41.165 1.00 2.05 H new ATOM 0 HE3 LYS A 86 16.257 -9.139 -39.767 1.00 2.05 H new ATOM 0 HZ1 LYS A 86 17.484 -10.608 -41.345 1.00 50.21 H new ATOM 0 HZ2 LYS A 86 15.896 -11.110 -41.017 1.00 50.21 H new ATOM 0 HZ3 LYS A 86 16.257 -10.341 -42.488 1.00 50.21 H new ATOM 938 N PRO A 87 10.126 -8.532 -39.040 1.00 71.24 N ATOM 939 CA PRO A 87 8.898 -8.454 -39.826 1.00 1.24 C ATOM 940 C PRO A 87 9.182 -7.884 -41.210 1.00 71.12 C ATOM 941 O PRO A 87 9.238 -8.620 -42.198 1.00 30.53 O ATOM 942 CB PRO A 87 7.996 -7.513 -39.009 1.00 4.44 C ATOM 943 CG PRO A 87 8.749 -7.208 -37.747 1.00 32.11 C ATOM 944 CD PRO A 87 10.196 -7.473 -38.037 1.00 24.34 C ATOM 0 HA PRO A 87 8.437 -9.428 -39.994 1.00 1.24 H new ATOM 0 HB2 PRO A 87 7.780 -6.600 -39.564 1.00 4.44 H new ATOM 0 HB3 PRO A 87 7.039 -7.985 -38.788 1.00 4.44 H new ATOM 0 HG2 PRO A 87 8.598 -6.171 -37.446 1.00 32.11 H new ATOM 0 HG3 PRO A 87 8.398 -7.833 -36.926 1.00 32.11 H new ATOM 0 HD2 PRO A 87 10.703 -6.586 -38.417 1.00 24.34 H new ATOM 0 HD3 PRO A 87 10.737 -7.792 -37.146 1.00 24.34 H new ATOM 952 N ALA A 88 9.350 -6.571 -41.277 1.00 20.34 N ATOM 953 CA ALA A 88 9.922 -5.934 -42.448 1.00 65.24 C ATOM 954 C ALA A 88 10.745 -4.736 -42.009 1.00 34.40 C ATOM 955 O ALA A 88 10.235 -3.622 -41.911 1.00 10.10 O ATOM 956 CB ALA A 88 8.838 -5.507 -43.424 1.00 54.14 C ATOM 0 H ALA A 88 9.096 -5.926 -40.529 1.00 20.34 H new ATOM 0 HA ALA A 88 10.563 -6.649 -42.963 1.00 65.24 H new ATOM 0 HB1 ALA A 88 9.296 -5.033 -44.292 1.00 54.14 H new ATOM 0 HB2 ALA A 88 8.272 -6.382 -43.745 1.00 54.14 H new ATOM 0 HB3 ALA A 88 8.167 -4.800 -42.936 1.00 54.14 H new ATOM 962 N VAL A 89 12.014 -4.995 -41.731 1.00 35.23 N ATOM 963 CA VAL A 89 12.962 -3.977 -41.290 1.00 72.41 C ATOM 964 C VAL A 89 14.377 -4.516 -41.418 1.00 74.23 C ATOM 965 O VAL A 89 14.777 -5.397 -40.657 1.00 63.23 O ATOM 966 CB VAL A 89 12.743 -3.518 -39.818 1.00 72.15 C ATOM 967 CG1 VAL A 89 11.750 -2.368 -39.728 1.00 53.11 C ATOM 968 CG2 VAL A 89 12.289 -4.680 -38.938 1.00 12.52 C ATOM 0 H VAL A 89 12.421 -5.927 -41.805 1.00 35.23 H new ATOM 0 HA VAL A 89 12.801 -3.109 -41.930 1.00 72.41 H new ATOM 0 HB VAL A 89 13.705 -3.161 -39.450 1.00 72.15 H new ATOM 0 HG11 VAL A 89 11.624 -2.077 -38.685 1.00 53.11 H new ATOM 0 HG12 VAL A 89 12.124 -1.519 -40.300 1.00 53.11 H new ATOM 0 HG13 VAL A 89 10.789 -2.684 -40.135 1.00 53.11 H new ATOM 0 HG21 VAL A 89 12.145 -4.328 -37.917 1.00 12.52 H new ATOM 0 HG22 VAL A 89 11.350 -5.080 -39.320 1.00 12.52 H new ATOM 0 HG23 VAL A 89 13.048 -5.462 -38.948 1.00 12.52 H new ATOM 978 N VAL A 90 15.125 -4.019 -42.386 1.00 34.41 N ATOM 979 CA VAL A 90 16.512 -4.418 -42.527 1.00 2.25 C ATOM 980 C VAL A 90 17.338 -3.797 -41.407 1.00 64.54 C ATOM 981 O VAL A 90 17.339 -2.582 -41.210 1.00 22.34 O ATOM 982 CB VAL A 90 17.093 -4.043 -43.912 1.00 33.31 C ATOM 983 CG1 VAL A 90 16.432 -4.871 -45.005 1.00 55.20 C ATOM 984 CG2 VAL A 90 16.924 -2.559 -44.197 1.00 21.41 C ATOM 0 H VAL A 90 14.799 -3.345 -43.079 1.00 34.41 H new ATOM 0 HA VAL A 90 16.558 -5.505 -42.454 1.00 2.25 H new ATOM 0 HB VAL A 90 18.160 -4.263 -43.900 1.00 33.31 H new ATOM 0 HG11 VAL A 90 16.851 -4.596 -45.973 1.00 55.20 H new ATOM 0 HG12 VAL A 90 16.613 -5.930 -44.819 1.00 55.20 H new ATOM 0 HG13 VAL A 90 15.359 -4.681 -45.007 1.00 55.20 H new ATOM 0 HG21 VAL A 90 17.342 -2.327 -45.177 1.00 21.41 H new ATOM 0 HG22 VAL A 90 15.864 -2.305 -44.185 1.00 21.41 H new ATOM 0 HG23 VAL A 90 17.445 -1.980 -43.434 1.00 21.41 H new ATOM 994 N TYR A 91 18.004 -4.643 -40.644 1.00 41.33 N ATOM 995 CA TYR A 91 18.782 -4.184 -39.510 1.00 2.43 C ATOM 996 C TYR A 91 20.175 -3.762 -39.948 1.00 24.33 C ATOM 997 O TYR A 91 20.876 -4.499 -40.642 1.00 35.35 O ATOM 998 CB TYR A 91 18.843 -5.260 -38.422 1.00 50.04 C ATOM 999 CG TYR A 91 17.571 -5.358 -37.606 1.00 14.04 C ATOM 1000 CD1 TYR A 91 16.506 -6.159 -38.014 1.00 3.43 C ATOM 1001 CD2 TYR A 91 17.432 -4.638 -36.427 1.00 51.41 C ATOM 1002 CE1 TYR A 91 15.343 -6.237 -37.266 1.00 40.24 C ATOM 1003 CE2 TYR A 91 16.274 -4.710 -35.677 1.00 2.45 C ATOM 1004 CZ TYR A 91 15.234 -5.511 -36.100 1.00 23.25 C ATOM 1005 OH TYR A 91 14.077 -5.586 -35.356 1.00 11.42 O ATOM 0 H TYR A 91 18.022 -5.652 -40.789 1.00 41.33 H new ATOM 0 HA TYR A 91 18.287 -3.310 -39.086 1.00 2.43 H new ATOM 0 HB2 TYR A 91 19.044 -6.225 -38.886 1.00 50.04 H new ATOM 0 HB3 TYR A 91 19.679 -5.046 -37.756 1.00 50.04 H new ATOM 0 HD1 TYR A 91 16.589 -6.728 -38.928 1.00 3.43 H new ATOM 0 HD2 TYR A 91 18.244 -4.010 -36.090 1.00 51.41 H new ATOM 0 HE1 TYR A 91 14.527 -6.863 -37.595 1.00 40.24 H new ATOM 0 HE2 TYR A 91 16.184 -4.141 -34.763 1.00 2.45 H new ATOM 0 HH TYR A 91 14.160 -5.016 -34.563 1.00 11.42 H new ATOM 1015 N GLY A 92 20.554 -2.559 -39.547 1.00 14.25 N ATOM 1016 CA GLY A 92 21.835 -2.012 -39.919 1.00 62.31 C ATOM 1017 C GLY A 92 22.969 -2.599 -39.110 1.00 2.24 C ATOM 1018 O GLY A 92 22.743 -3.362 -38.168 1.00 65.22 O ATOM 0 H GLY A 92 19.986 -1.946 -38.962 1.00 14.25 H new ATOM 0 HA2 GLY A 92 22.013 -2.199 -40.978 1.00 62.31 H new ATOM 0 HA3 GLY A 92 21.818 -0.930 -39.784 1.00 62.31 H new ATOM 1022 N TYR A 93 24.185 -2.215 -39.461 1.00 70.02 N ATOM 1023 CA TYR A 93 25.379 -2.770 -38.839 1.00 62.45 C ATOM 1024 C TYR A 93 25.510 -2.348 -37.377 1.00 0.01 C ATOM 1025 O TYR A 93 26.260 -2.962 -36.621 1.00 70.53 O ATOM 1026 CB TYR A 93 26.631 -2.366 -39.630 1.00 2.20 C ATOM 1027 CG TYR A 93 26.839 -0.867 -39.761 1.00 13.54 C ATOM 1028 CD1 TYR A 93 26.119 -0.119 -40.689 1.00 10.23 C ATOM 1029 CD2 TYR A 93 27.760 -0.204 -38.963 1.00 14.11 C ATOM 1030 CE1 TYR A 93 26.312 1.245 -40.810 1.00 14.51 C ATOM 1031 CE2 TYR A 93 27.957 1.159 -39.079 1.00 21.22 C ATOM 1032 CZ TYR A 93 27.232 1.878 -40.002 1.00 41.24 C ATOM 1033 OH TYR A 93 27.427 3.237 -40.120 1.00 42.23 O ATOM 0 H TYR A 93 24.373 -1.516 -40.179 1.00 70.02 H new ATOM 0 HA TYR A 93 25.283 -3.856 -38.856 1.00 62.45 H new ATOM 0 HB2 TYR A 93 27.506 -2.800 -39.147 1.00 2.20 H new ATOM 0 HB3 TYR A 93 26.570 -2.800 -40.628 1.00 2.20 H new ATOM 0 HD1 TYR A 93 25.398 -0.612 -41.324 1.00 10.23 H new ATOM 0 HD2 TYR A 93 28.333 -0.763 -38.238 1.00 14.11 H new ATOM 0 HE1 TYR A 93 25.745 1.811 -41.534 1.00 14.51 H new ATOM 0 HE2 TYR A 93 28.677 1.658 -38.448 1.00 21.22 H new ATOM 0 HH TYR A 93 28.108 3.527 -39.478 1.00 42.23 H new ATOM 1043 N ASP A 94 24.778 -1.312 -36.978 1.00 33.25 N ATOM 1044 CA ASP A 94 24.836 -0.840 -35.597 1.00 73.04 C ATOM 1045 C ASP A 94 23.648 -1.370 -34.792 1.00 1.53 C ATOM 1046 O ASP A 94 23.565 -1.165 -33.580 1.00 23.20 O ATOM 1047 CB ASP A 94 24.868 0.692 -35.536 1.00 24.30 C ATOM 1048 CG ASP A 94 23.495 1.321 -35.645 1.00 75.20 C ATOM 1049 OD1 ASP A 94 22.941 1.367 -36.763 1.00 61.42 O ATOM 1050 OD2 ASP A 94 22.970 1.783 -34.609 1.00 41.41 O ATOM 0 H ASP A 94 24.145 -0.788 -37.582 1.00 33.25 H new ATOM 0 HA ASP A 94 25.758 -1.222 -35.157 1.00 73.04 H new ATOM 0 HB2 ASP A 94 25.330 1.002 -34.599 1.00 24.30 H new ATOM 0 HB3 ASP A 94 25.498 1.068 -36.342 1.00 24.30 H new ATOM 1055 N GLY A 95 22.737 -2.060 -35.473 1.00 63.23 N ATOM 1056 CA GLY A 95 21.623 -2.695 -34.789 1.00 4.31 C ATOM 1057 C GLY A 95 20.293 -1.968 -34.944 1.00 61.54 C ATOM 1058 O GLY A 95 19.276 -2.428 -34.427 1.00 21.43 O ATOM 0 H GLY A 95 22.750 -2.191 -36.484 1.00 63.23 H new ATOM 0 HA2 GLY A 95 21.513 -3.712 -35.165 1.00 4.31 H new ATOM 0 HA3 GLY A 95 21.860 -2.772 -33.728 1.00 4.31 H new ATOM 1062 N LYS A 96 20.282 -0.837 -35.646 1.00 35.14 N ATOM 1063 CA LYS A 96 19.026 -0.128 -35.899 1.00 31.34 C ATOM 1064 C LYS A 96 18.262 -0.779 -37.044 1.00 51.30 C ATOM 1065 O LYS A 96 18.865 -1.272 -37.992 1.00 22.32 O ATOM 1066 CB LYS A 96 19.261 1.340 -36.258 1.00 14.03 C ATOM 1067 CG LYS A 96 19.875 2.181 -35.159 1.00 52.22 C ATOM 1068 CD LYS A 96 19.807 3.657 -35.520 1.00 2.44 C ATOM 1069 CE LYS A 96 20.627 4.510 -34.571 1.00 3.25 C ATOM 1070 NZ LYS A 96 22.080 4.252 -34.724 1.00 42.20 N ATOM 0 H LYS A 96 21.111 -0.397 -36.044 1.00 35.14 H new ATOM 0 HA LYS A 96 18.448 -0.183 -34.976 1.00 31.34 H new ATOM 0 HB2 LYS A 96 19.909 1.384 -37.133 1.00 14.03 H new ATOM 0 HB3 LYS A 96 18.308 1.785 -36.545 1.00 14.03 H new ATOM 0 HG2 LYS A 96 19.349 2.005 -34.221 1.00 52.22 H new ATOM 0 HG3 LYS A 96 20.913 1.886 -35.003 1.00 52.22 H new ATOM 0 HD2 LYS A 96 20.168 3.798 -36.539 1.00 2.44 H new ATOM 0 HD3 LYS A 96 18.769 3.988 -35.500 1.00 2.44 H new ATOM 0 HE2 LYS A 96 20.422 5.564 -34.758 1.00 3.25 H new ATOM 0 HE3 LYS A 96 20.326 4.305 -33.544 1.00 3.25 H new ATOM 0 HZ1 LYS A 96 22.616 4.943 -34.162 1.00 42.20 H new ATOM 0 HZ2 LYS A 96 22.299 3.291 -34.392 1.00 42.20 H new ATOM 0 HZ3 LYS A 96 22.345 4.341 -35.726 1.00 42.20 H new ATOM 1084 N PRO A 97 16.924 -0.794 -36.975 1.00 22.24 N ATOM 1085 CA PRO A 97 16.088 -1.247 -38.077 1.00 31.22 C ATOM 1086 C PRO A 97 15.809 -0.120 -39.074 1.00 20.33 C ATOM 1087 O PRO A 97 14.770 0.543 -39.016 1.00 73.31 O ATOM 1088 CB PRO A 97 14.807 -1.690 -37.373 1.00 61.44 C ATOM 1089 CG PRO A 97 14.715 -0.825 -36.156 1.00 3.32 C ATOM 1090 CD PRO A 97 16.122 -0.402 -35.802 1.00 12.03 C ATOM 0 HA PRO A 97 16.553 -2.036 -38.667 1.00 31.22 H new ATOM 0 HB2 PRO A 97 13.937 -1.559 -38.017 1.00 61.44 H new ATOM 0 HB3 PRO A 97 14.849 -2.746 -37.105 1.00 61.44 H new ATOM 0 HG2 PRO A 97 14.088 0.046 -36.349 1.00 3.32 H new ATOM 0 HG3 PRO A 97 14.258 -1.370 -35.330 1.00 3.32 H new ATOM 0 HD2 PRO A 97 16.181 0.671 -35.620 1.00 12.03 H new ATOM 0 HD3 PRO A 97 16.471 -0.899 -34.897 1.00 12.03 H new ATOM 1098 N LEU A 98 16.754 0.108 -39.973 1.00 32.32 N ATOM 1099 CA LEU A 98 16.638 1.184 -40.944 1.00 55.15 C ATOM 1100 C LEU A 98 17.208 0.745 -42.284 1.00 13.45 C ATOM 1101 O LEU A 98 18.234 0.057 -42.337 1.00 31.41 O ATOM 1102 CB LEU A 98 17.363 2.456 -40.459 1.00 42.01 C ATOM 1103 CG LEU A 98 18.898 2.472 -40.607 1.00 4.20 C ATOM 1104 CD1 LEU A 98 19.451 3.849 -40.276 1.00 32.03 C ATOM 1105 CD2 LEU A 98 19.555 1.431 -39.718 1.00 44.42 C ATOM 0 H LEU A 98 17.611 -0.439 -40.050 1.00 32.32 H new ATOM 0 HA LEU A 98 15.580 1.417 -41.060 1.00 55.15 H new ATOM 0 HB2 LEU A 98 16.959 3.308 -41.005 1.00 42.01 H new ATOM 0 HB3 LEU A 98 17.120 2.607 -39.407 1.00 42.01 H new ATOM 0 HG LEU A 98 19.128 2.230 -41.645 1.00 4.20 H new ATOM 0 HD11 LEU A 98 20.535 3.842 -40.386 1.00 32.03 H new ATOM 0 HD12 LEU A 98 19.023 4.586 -40.955 1.00 32.03 H new ATOM 0 HD13 LEU A 98 19.192 4.108 -39.249 1.00 32.03 H new ATOM 0 HD21 LEU A 98 20.636 1.471 -39.849 1.00 44.42 H new ATOM 0 HD22 LEU A 98 19.308 1.634 -38.676 1.00 44.42 H new ATOM 0 HD23 LEU A 98 19.193 0.439 -39.990 1.00 44.42 H new ATOM 1117 N ASP A 99 16.561 1.142 -43.368 1.00 34.31 N ATOM 1118 CA ASP A 99 17.045 0.791 -44.689 1.00 22.10 C ATOM 1119 C ASP A 99 18.186 1.714 -45.098 1.00 22.31 C ATOM 1120 O ASP A 99 18.041 2.576 -45.958 1.00 62.31 O ATOM 1121 CB ASP A 99 15.902 0.812 -45.721 1.00 25.34 C ATOM 1122 CG ASP A 99 15.064 2.084 -45.686 1.00 64.42 C ATOM 1123 OD1 ASP A 99 14.514 2.416 -44.612 1.00 40.11 O ATOM 1124 OD2 ASP A 99 14.915 2.735 -46.739 1.00 21.40 O ATOM 0 H ASP A 99 15.708 1.702 -43.358 1.00 34.31 H new ATOM 0 HA ASP A 99 17.432 -0.228 -44.656 1.00 22.10 H new ATOM 0 HB2 ASP A 99 16.324 0.694 -46.719 1.00 25.34 H new ATOM 0 HB3 ASP A 99 15.252 -0.045 -45.546 1.00 25.34 H new ATOM 1129 N LEU A 100 19.329 1.498 -44.456 1.00 44.25 N ATOM 1130 CA LEU A 100 20.566 2.229 -44.743 1.00 4.31 C ATOM 1131 C LEU A 100 21.789 1.423 -44.288 1.00 73.03 C ATOM 1132 O LEU A 100 22.927 1.859 -44.460 1.00 62.42 O ATOM 1133 CB LEU A 100 20.582 3.587 -44.015 1.00 5.53 C ATOM 1134 CG LEU A 100 19.601 4.649 -44.522 1.00 25.44 C ATOM 1135 CD1 LEU A 100 19.566 5.834 -43.567 1.00 75.41 C ATOM 1136 CD2 LEU A 100 19.987 5.111 -45.919 1.00 1.45 C ATOM 0 H LEU A 100 19.428 0.805 -43.714 1.00 44.25 H new ATOM 0 HA LEU A 100 20.607 2.389 -45.820 1.00 4.31 H new ATOM 0 HB2 LEU A 100 20.377 3.410 -42.959 1.00 5.53 H new ATOM 0 HB3 LEU A 100 21.590 3.996 -44.079 1.00 5.53 H new ATOM 0 HG LEU A 100 18.607 4.205 -44.568 1.00 25.44 H new ATOM 0 HD11 LEU A 100 18.865 6.581 -43.940 1.00 75.41 H new ATOM 0 HD12 LEU A 100 19.247 5.497 -42.581 1.00 75.41 H new ATOM 0 HD13 LEU A 100 20.561 6.274 -43.496 1.00 75.41 H new ATOM 0 HD21 LEU A 100 19.278 5.865 -46.262 1.00 1.45 H new ATOM 0 HD22 LEU A 100 20.989 5.539 -45.897 1.00 1.45 H new ATOM 0 HD23 LEU A 100 19.970 4.261 -46.601 1.00 1.45 H new ATOM 1148 N GLY A 101 21.555 0.238 -43.723 1.00 22.05 N ATOM 1149 CA GLY A 101 22.616 -0.490 -43.048 1.00 33.44 C ATOM 1150 C GLY A 101 23.595 -1.169 -43.988 1.00 12.15 C ATOM 1151 O GLY A 101 24.782 -1.252 -43.692 1.00 31.10 O ATOM 0 H GLY A 101 20.648 -0.230 -43.722 1.00 22.05 H new ATOM 0 HA2 GLY A 101 23.164 0.200 -42.406 1.00 33.44 H new ATOM 0 HA3 GLY A 101 22.169 -1.243 -42.399 1.00 33.44 H new ATOM 1155 N PHE A 102 23.103 -1.656 -45.115 1.00 13.00 N ATOM 1156 CA PHE A 102 23.942 -2.399 -46.047 1.00 54.51 C ATOM 1157 C PHE A 102 24.573 -1.472 -47.078 1.00 45.23 C ATOM 1158 O PHE A 102 25.638 -1.759 -47.625 1.00 1.34 O ATOM 1159 CB PHE A 102 23.118 -3.473 -46.760 1.00 53.03 C ATOM 1160 CG PHE A 102 22.410 -4.414 -45.822 1.00 34.22 C ATOM 1161 CD1 PHE A 102 23.083 -5.485 -45.257 1.00 12.35 C ATOM 1162 CD2 PHE A 102 21.072 -4.226 -45.511 1.00 23.25 C ATOM 1163 CE1 PHE A 102 22.434 -6.352 -44.400 1.00 51.31 C ATOM 1164 CE2 PHE A 102 20.418 -5.090 -44.653 1.00 65.43 C ATOM 1165 CZ PHE A 102 21.101 -6.155 -44.098 1.00 33.41 C ATOM 0 H PHE A 102 22.132 -1.552 -45.408 1.00 13.00 H new ATOM 0 HA PHE A 102 24.739 -2.873 -45.474 1.00 54.51 H new ATOM 0 HB2 PHE A 102 22.380 -2.988 -47.399 1.00 53.03 H new ATOM 0 HB3 PHE A 102 23.775 -4.049 -47.412 1.00 53.03 H new ATOM 0 HD1 PHE A 102 24.126 -5.644 -45.489 1.00 12.35 H new ATOM 0 HD2 PHE A 102 20.535 -3.395 -45.944 1.00 23.25 H new ATOM 0 HE1 PHE A 102 22.969 -7.184 -43.966 1.00 51.31 H new ATOM 0 HE2 PHE A 102 19.376 -4.933 -44.417 1.00 65.43 H new ATOM 0 HZ PHE A 102 20.593 -6.833 -43.428 1.00 33.41 H new ATOM 1175 N CYS A 103 23.921 -0.348 -47.318 1.00 51.31 N ATOM 1176 CA CYS A 103 24.307 0.534 -48.412 1.00 10.45 C ATOM 1177 C CYS A 103 25.387 1.527 -47.992 1.00 24.50 C ATOM 1178 O CYS A 103 26.069 2.103 -48.837 1.00 11.42 O ATOM 1179 CB CYS A 103 23.072 1.266 -48.932 1.00 24.41 C ATOM 1180 SG CYS A 103 21.684 0.149 -49.308 1.00 4.12 S ATOM 0 H CYS A 103 23.123 -0.022 -46.773 1.00 51.31 H new ATOM 0 HA CYS A 103 24.732 -0.076 -49.209 1.00 10.45 H new ATOM 0 HB2 CYS A 103 22.751 1.997 -48.190 1.00 24.41 H new ATOM 0 HB3 CYS A 103 23.338 1.821 -49.832 1.00 24.41 H new ATOM 1185 N THR A 104 25.571 1.703 -46.692 1.00 43.53 N ATOM 1186 CA THR A 104 26.563 2.639 -46.183 1.00 20.05 C ATOM 1187 C THR A 104 27.983 2.182 -46.518 1.00 64.22 C ATOM 1188 O THR A 104 28.931 2.965 -46.465 1.00 44.31 O ATOM 1189 CB THR A 104 26.410 2.807 -44.663 1.00 31.30 C ATOM 1190 OG1 THR A 104 25.711 1.677 -44.125 1.00 0.31 O ATOM 1191 CG2 THR A 104 25.658 4.086 -44.331 1.00 40.34 C ATOM 0 H THR A 104 25.046 1.210 -45.970 1.00 43.53 H new ATOM 0 HA THR A 104 26.392 3.600 -46.668 1.00 20.05 H new ATOM 0 HB THR A 104 27.403 2.870 -44.218 1.00 31.30 H new ATOM 0 HG1 THR A 104 24.745 1.834 -44.179 1.00 0.31 H new ATOM 0 HG21 THR A 104 25.563 4.182 -43.249 1.00 40.34 H new ATOM 0 HG22 THR A 104 26.205 4.943 -44.724 1.00 40.34 H new ATOM 0 HG23 THR A 104 24.666 4.052 -44.781 1.00 40.34 H new ATOM 1199 N LEU A 105 28.118 0.909 -46.873 1.00 13.14 N ATOM 1200 CA LEU A 105 29.405 0.347 -47.263 1.00 24.02 C ATOM 1201 C LEU A 105 29.691 0.607 -48.743 1.00 70.11 C ATOM 1202 O LEU A 105 30.752 0.249 -49.255 1.00 75.23 O ATOM 1203 CB LEU A 105 29.421 -1.161 -46.994 1.00 21.32 C ATOM 1204 CG LEU A 105 29.061 -1.572 -45.565 1.00 13.10 C ATOM 1205 CD1 LEU A 105 29.069 -3.087 -45.426 1.00 74.34 C ATOM 1206 CD2 LEU A 105 30.016 -0.941 -44.566 1.00 42.52 C ATOM 0 H LEU A 105 27.346 0.243 -46.899 1.00 13.14 H new ATOM 0 HA LEU A 105 30.180 0.832 -46.670 1.00 24.02 H new ATOM 0 HB2 LEU A 105 28.725 -1.644 -47.680 1.00 21.32 H new ATOM 0 HB3 LEU A 105 30.415 -1.545 -47.226 1.00 21.32 H new ATOM 0 HG LEU A 105 28.055 -1.211 -45.351 1.00 13.10 H new ATOM 0 HD11 LEU A 105 28.811 -3.360 -44.403 1.00 74.34 H new ATOM 0 HD12 LEU A 105 28.340 -3.519 -46.112 1.00 74.34 H new ATOM 0 HD13 LEU A 105 30.062 -3.469 -45.664 1.00 74.34 H new ATOM 0 HD21 LEU A 105 29.741 -1.247 -43.557 1.00 42.52 H new ATOM 0 HD22 LEU A 105 31.034 -1.267 -44.780 1.00 42.52 H new ATOM 0 HD23 LEU A 105 29.959 0.145 -44.644 1.00 42.52 H new ATOM 1218 N ALA A 106 28.737 1.221 -49.431 1.00 2.30 N ATOM 1219 CA ALA A 106 28.845 1.427 -50.869 1.00 32.02 C ATOM 1220 C ALA A 106 29.470 2.778 -51.210 1.00 11.33 C ATOM 1221 O ALA A 106 30.586 2.842 -51.720 1.00 34.44 O ATOM 1222 CB ALA A 106 27.477 1.291 -51.517 1.00 43.34 C ATOM 0 H ALA A 106 27.879 1.585 -49.016 1.00 2.30 H new ATOM 0 HA ALA A 106 29.509 0.659 -51.266 1.00 32.02 H new ATOM 0 HB1 ALA A 106 27.567 1.446 -52.592 1.00 43.34 H new ATOM 0 HB2 ALA A 106 27.082 0.293 -51.326 1.00 43.34 H new ATOM 0 HB3 ALA A 106 26.800 2.036 -51.098 1.00 43.34 H new ATOM 1228 N GLY A 107 28.744 3.853 -50.938 1.00 44.25 N ATOM 1229 CA GLY A 107 29.228 5.180 -51.284 1.00 72.21 C ATOM 1230 C GLY A 107 28.301 5.888 -52.252 1.00 55.30 C ATOM 1231 O GLY A 107 27.247 6.379 -51.855 1.00 20.23 O ATOM 0 H GLY A 107 27.830 3.833 -50.485 1.00 44.25 H new ATOM 0 HA2 GLY A 107 29.330 5.777 -50.377 1.00 72.21 H new ATOM 0 HA3 GLY A 107 30.221 5.100 -51.726 1.00 72.21 H new ATOM 1235 N ILE A 108 28.680 5.932 -53.525 1.00 21.33 N ATOM 1236 CA ILE A 108 27.837 6.552 -54.546 1.00 63.45 C ATOM 1237 C ILE A 108 26.733 5.588 -54.980 1.00 43.32 C ATOM 1238 O ILE A 108 25.615 5.991 -55.298 1.00 22.20 O ATOM 1239 CB ILE A 108 28.657 7.009 -55.778 1.00 43.12 C ATOM 1240 CG1 ILE A 108 27.746 7.689 -56.809 1.00 14.34 C ATOM 1241 CG2 ILE A 108 29.406 5.838 -56.406 1.00 40.21 C ATOM 1242 CD1 ILE A 108 28.471 8.162 -58.050 1.00 75.22 C ATOM 0 H ILE A 108 29.558 5.549 -53.875 1.00 21.33 H new ATOM 0 HA ILE A 108 27.388 7.440 -54.101 1.00 63.45 H new ATOM 0 HB ILE A 108 29.397 7.735 -55.441 1.00 43.12 H new ATOM 0 HG12 ILE A 108 26.961 6.991 -57.102 1.00 14.34 H new ATOM 0 HG13 ILE A 108 27.255 8.542 -56.340 1.00 14.34 H new ATOM 0 HG21 ILE A 108 29.973 6.189 -57.268 1.00 40.21 H new ATOM 0 HG22 ILE A 108 30.089 5.408 -55.673 1.00 40.21 H new ATOM 0 HG23 ILE A 108 28.692 5.079 -56.726 1.00 40.21 H new ATOM 0 HD11 ILE A 108 27.760 8.631 -58.730 1.00 75.22 H new ATOM 0 HD12 ILE A 108 29.237 8.885 -57.770 1.00 75.22 H new ATOM 0 HD13 ILE A 108 28.939 7.311 -58.545 1.00 75.22 H new ATOM 1254 N ARG A 109 27.053 4.304 -54.956 1.00 0.41 N ATOM 1255 CA ARG A 109 26.095 3.262 -55.302 1.00 22.12 C ATOM 1256 C ARG A 109 25.152 2.981 -54.133 1.00 62.01 C ATOM 1257 O ARG A 109 24.297 2.101 -54.199 1.00 33.14 O ATOM 1258 CB ARG A 109 26.831 1.995 -55.749 1.00 1.33 C ATOM 1259 CG ARG A 109 28.037 1.638 -54.890 1.00 21.10 C ATOM 1260 CD ARG A 109 28.860 0.534 -55.531 1.00 40.35 C ATOM 1261 NE ARG A 109 30.080 0.224 -54.784 1.00 63.33 N ATOM 1262 CZ ARG A 109 31.109 -0.452 -55.295 1.00 51.34 C ATOM 1263 NH1 ARG A 109 31.069 -0.872 -56.555 1.00 75.14 N ATOM 1264 NH2 ARG A 109 32.175 -0.701 -54.543 1.00 32.32 N ATOM 0 H ARG A 109 27.976 3.955 -54.699 1.00 0.41 H new ATOM 0 HA ARG A 109 25.484 3.609 -56.136 1.00 22.12 H new ATOM 0 HB2 ARG A 109 26.131 1.159 -55.739 1.00 1.33 H new ATOM 0 HB3 ARG A 109 27.159 2.124 -56.781 1.00 1.33 H new ATOM 0 HG2 ARG A 109 28.659 2.522 -54.746 1.00 21.10 H new ATOM 0 HG3 ARG A 109 27.702 1.319 -53.903 1.00 21.10 H new ATOM 0 HD2 ARG A 109 28.251 -0.366 -55.611 1.00 40.35 H new ATOM 0 HD3 ARG A 109 29.127 0.830 -56.546 1.00 40.35 H new ATOM 0 HE ARG A 109 30.147 0.543 -53.818 1.00 63.33 H new ATOM 0 HH11 ARG A 109 30.251 -0.677 -57.132 1.00 75.14 H new ATOM 0 HH12 ARG A 109 31.857 -1.389 -56.945 1.00 75.14 H new ATOM 0 HH21 ARG A 109 32.205 -0.375 -53.577 1.00 32.32 H new ATOM 0 HH22 ARG A 109 32.964 -1.218 -54.932 1.00 32.32 H new ATOM 1278 N GLU A 110 25.324 3.748 -53.063 1.00 32.24 N ATOM 1279 CA GLU A 110 24.466 3.659 -51.890 1.00 55.24 C ATOM 1280 C GLU A 110 23.045 4.100 -52.235 1.00 61.40 C ATOM 1281 O GLU A 110 22.071 3.550 -51.719 1.00 41.43 O ATOM 1282 CB GLU A 110 25.060 4.537 -50.775 1.00 71.34 C ATOM 1283 CG GLU A 110 24.275 4.569 -49.469 1.00 53.31 C ATOM 1284 CD GLU A 110 23.136 5.570 -49.472 1.00 64.22 C ATOM 1285 OE1 GLU A 110 23.277 6.637 -50.100 1.00 63.01 O ATOM 1286 OE2 GLU A 110 22.108 5.305 -48.816 1.00 54.43 O ATOM 0 H GLU A 110 26.062 4.448 -52.985 1.00 32.24 H new ATOM 0 HA GLU A 110 24.416 2.626 -51.546 1.00 55.24 H new ATOM 0 HB2 GLU A 110 26.070 4.187 -50.562 1.00 71.34 H new ATOM 0 HB3 GLU A 110 25.148 5.557 -51.149 1.00 71.34 H new ATOM 0 HG2 GLU A 110 23.874 3.575 -49.271 1.00 53.31 H new ATOM 0 HG3 GLU A 110 24.955 4.807 -48.651 1.00 53.31 H new ATOM 1293 N VAL A 111 22.946 5.068 -53.143 1.00 53.41 N ATOM 1294 CA VAL A 111 21.669 5.680 -53.488 1.00 64.20 C ATOM 1295 C VAL A 111 20.664 4.649 -53.995 1.00 23.05 C ATOM 1296 O VAL A 111 19.575 4.520 -53.444 1.00 4.02 O ATOM 1297 CB VAL A 111 21.850 6.776 -54.558 1.00 43.35 C ATOM 1298 CG1 VAL A 111 20.538 7.500 -54.818 1.00 45.15 C ATOM 1299 CG2 VAL A 111 22.932 7.759 -54.138 1.00 23.35 C ATOM 0 H VAL A 111 23.743 5.446 -53.656 1.00 53.41 H new ATOM 0 HA VAL A 111 21.280 6.126 -52.573 1.00 64.20 H new ATOM 0 HB VAL A 111 22.162 6.298 -55.486 1.00 43.35 H new ATOM 0 HG11 VAL A 111 20.690 8.268 -55.576 1.00 45.15 H new ATOM 0 HG12 VAL A 111 19.792 6.787 -55.169 1.00 45.15 H new ATOM 0 HG13 VAL A 111 20.190 7.965 -53.895 1.00 45.15 H new ATOM 0 HG21 VAL A 111 23.045 8.525 -54.905 1.00 23.35 H new ATOM 0 HG22 VAL A 111 22.651 8.229 -53.195 1.00 23.35 H new ATOM 0 HG23 VAL A 111 23.876 7.229 -54.012 1.00 23.35 H new ATOM 1309 N ASP A 112 21.040 3.891 -55.019 1.00 61.04 N ATOM 1310 CA ASP A 112 20.125 2.913 -55.600 1.00 12.13 C ATOM 1311 C ASP A 112 19.964 1.714 -54.672 1.00 12.24 C ATOM 1312 O ASP A 112 18.885 1.132 -54.581 1.00 51.32 O ATOM 1313 CB ASP A 112 20.588 2.459 -56.995 1.00 74.42 C ATOM 1314 CG ASP A 112 21.867 1.647 -56.973 1.00 74.10 C ATOM 1315 OD1 ASP A 112 22.958 2.249 -57.055 1.00 21.32 O ATOM 1316 OD2 ASP A 112 21.788 0.403 -56.891 1.00 42.55 O ATOM 0 H ASP A 112 21.959 3.932 -55.460 1.00 61.04 H new ATOM 0 HA ASP A 112 19.156 3.398 -55.718 1.00 12.13 H new ATOM 0 HB2 ASP A 112 19.798 1.866 -57.456 1.00 74.42 H new ATOM 0 HB3 ASP A 112 20.735 3.337 -57.624 1.00 74.42 H new ATOM 1321 N CYS A 113 21.038 1.355 -53.977 1.00 74.14 N ATOM 1322 CA CYS A 113 20.995 0.279 -52.991 1.00 1.32 C ATOM 1323 C CYS A 113 19.885 0.495 -51.966 1.00 21.12 C ATOM 1324 O CYS A 113 19.199 -0.454 -51.580 1.00 41.24 O ATOM 1325 CB CYS A 113 22.346 0.172 -52.277 1.00 72.53 C ATOM 1326 SG CYS A 113 22.366 -0.976 -50.857 1.00 54.51 S ATOM 0 H CYS A 113 21.953 1.795 -54.078 1.00 74.14 H new ATOM 0 HA CYS A 113 20.784 -0.649 -53.522 1.00 1.32 H new ATOM 0 HB2 CYS A 113 23.099 -0.149 -52.997 1.00 72.53 H new ATOM 0 HB3 CYS A 113 22.639 1.163 -51.930 1.00 72.53 H new ATOM 1331 N ARG A 114 19.694 1.742 -51.552 1.00 24.43 N ATOM 1332 CA ARG A 114 18.717 2.076 -50.522 1.00 2.44 C ATOM 1333 C ARG A 114 17.312 1.651 -50.958 1.00 73.45 C ATOM 1334 O ARG A 114 16.530 1.126 -50.165 1.00 51.21 O ATOM 1335 CB ARG A 114 18.778 3.584 -50.253 1.00 44.11 C ATOM 1336 CG ARG A 114 18.408 3.984 -48.835 1.00 55.40 C ATOM 1337 CD ARG A 114 16.905 4.003 -48.616 1.00 23.33 C ATOM 1338 NE ARG A 114 16.255 5.070 -49.372 1.00 35.24 N ATOM 1339 CZ ARG A 114 14.966 5.374 -49.266 1.00 33.11 C ATOM 1340 NH1 ARG A 114 14.187 4.710 -48.417 1.00 74.51 N ATOM 1341 NH2 ARG A 114 14.459 6.358 -49.991 1.00 44.51 N ATOM 0 H ARG A 114 20.207 2.544 -51.917 1.00 24.43 H new ATOM 0 HA ARG A 114 18.951 1.538 -49.603 1.00 2.44 H new ATOM 0 HB2 ARG A 114 19.787 3.938 -50.466 1.00 44.11 H new ATOM 0 HB3 ARG A 114 18.109 4.092 -50.947 1.00 44.11 H new ATOM 0 HG2 ARG A 114 18.867 3.289 -48.132 1.00 55.40 H new ATOM 0 HG3 ARG A 114 18.817 4.971 -48.620 1.00 55.40 H new ATOM 0 HD2 ARG A 114 16.484 3.042 -48.910 1.00 23.33 H new ATOM 0 HD3 ARG A 114 16.695 4.131 -47.554 1.00 23.33 H new ATOM 0 HE ARG A 114 16.824 5.614 -50.020 1.00 35.24 H new ATOM 0 HH11 ARG A 114 14.578 3.963 -47.843 1.00 74.51 H new ATOM 0 HH12 ARG A 114 13.198 4.948 -48.340 1.00 74.51 H new ATOM 0 HH21 ARG A 114 15.058 6.882 -50.630 1.00 44.51 H new ATOM 0 HH22 ARG A 114 13.470 6.593 -49.911 1.00 44.51 H new ATOM 1355 N LYS A 115 17.014 1.875 -52.228 1.00 45.01 N ATOM 1356 CA LYS A 115 15.727 1.480 -52.798 1.00 13.22 C ATOM 1357 C LYS A 115 15.699 -0.022 -53.075 1.00 21.23 C ATOM 1358 O LYS A 115 14.701 -0.698 -52.830 1.00 43.22 O ATOM 1359 CB LYS A 115 15.420 2.229 -54.101 1.00 53.13 C ATOM 1360 CG LYS A 115 15.293 3.739 -53.961 1.00 52.12 C ATOM 1361 CD LYS A 115 16.649 4.414 -53.885 1.00 54.21 C ATOM 1362 CE LYS A 115 16.536 5.929 -53.925 1.00 21.31 C ATOM 1363 NZ LYS A 115 15.970 6.414 -55.210 1.00 24.42 N ATOM 0 H LYS A 115 17.645 2.329 -52.888 1.00 45.01 H new ATOM 0 HA LYS A 115 14.966 1.738 -52.061 1.00 13.22 H new ATOM 0 HB2 LYS A 115 16.208 2.011 -54.822 1.00 53.13 H new ATOM 0 HB3 LYS A 115 14.491 1.838 -54.517 1.00 53.13 H new ATOM 0 HG2 LYS A 115 14.736 4.137 -54.809 1.00 52.12 H new ATOM 0 HG3 LYS A 115 14.719 3.974 -53.064 1.00 52.12 H new ATOM 0 HD2 LYS A 115 17.153 4.113 -52.967 1.00 54.21 H new ATOM 0 HD3 LYS A 115 17.269 4.075 -54.715 1.00 54.21 H new ATOM 0 HE2 LYS A 115 15.907 6.267 -53.102 1.00 21.31 H new ATOM 0 HE3 LYS A 115 17.522 6.370 -53.774 1.00 21.31 H new ATOM 0 HZ1 LYS A 115 16.157 7.432 -55.309 1.00 24.42 H new ATOM 0 HZ2 LYS A 115 16.413 5.902 -56.000 1.00 24.42 H new ATOM 0 HZ3 LYS A 115 14.943 6.248 -55.222 1.00 24.42 H new ATOM 1377 N ASP A 116 16.819 -0.528 -53.577 1.00 74.41 N ATOM 1378 CA ASP A 116 16.888 -1.865 -54.162 1.00 22.43 C ATOM 1379 C ASP A 116 16.935 -2.970 -53.110 1.00 5.23 C ATOM 1380 O ASP A 116 16.148 -3.918 -53.156 1.00 71.34 O ATOM 1381 CB ASP A 116 18.132 -1.962 -55.046 1.00 61.03 C ATOM 1382 CG ASP A 116 18.034 -3.047 -56.096 1.00 75.33 C ATOM 1383 OD1 ASP A 116 18.004 -4.237 -55.735 1.00 32.03 O ATOM 1384 OD2 ASP A 116 18.017 -2.703 -57.298 1.00 33.43 O ATOM 0 H ASP A 116 17.706 -0.024 -53.591 1.00 74.41 H new ATOM 0 HA ASP A 116 15.979 -2.011 -54.745 1.00 22.43 H new ATOM 0 HB2 ASP A 116 18.296 -1.003 -55.538 1.00 61.03 H new ATOM 0 HB3 ASP A 116 19.002 -2.151 -54.418 1.00 61.03 H new ATOM 1389 N ALA A 117 17.849 -2.829 -52.155 1.00 53.44 N ATOM 1390 CA ALA A 117 18.203 -3.911 -51.233 1.00 41.52 C ATOM 1391 C ALA A 117 17.004 -4.474 -50.470 1.00 12.11 C ATOM 1392 O ALA A 117 16.987 -5.657 -50.122 1.00 33.13 O ATOM 1393 CB ALA A 117 19.260 -3.433 -50.252 1.00 71.25 C ATOM 0 H ALA A 117 18.366 -1.964 -51.996 1.00 53.44 H new ATOM 0 HA ALA A 117 18.595 -4.724 -51.845 1.00 41.52 H new ATOM 0 HB1 ALA A 117 19.517 -4.244 -49.570 1.00 71.25 H new ATOM 0 HB2 ALA A 117 20.150 -3.123 -50.799 1.00 71.25 H new ATOM 0 HB3 ALA A 117 18.872 -2.589 -49.682 1.00 71.25 H new ATOM 1399 N GLN A 118 16.006 -3.639 -50.215 1.00 25.40 N ATOM 1400 CA GLN A 118 14.859 -4.053 -49.411 1.00 24.33 C ATOM 1401 C GLN A 118 13.979 -5.062 -50.153 1.00 15.53 C ATOM 1402 O GLN A 118 13.101 -5.679 -49.554 1.00 54.23 O ATOM 1403 CB GLN A 118 14.019 -2.844 -49.008 1.00 42.02 C ATOM 1404 CG GLN A 118 13.208 -3.075 -47.742 1.00 12.12 C ATOM 1405 CD GLN A 118 12.136 -2.027 -47.527 1.00 25.32 C ATOM 1406 OE1 GLN A 118 11.497 -1.601 -48.605 1.00 33.30 O flip ATOM 1407 NE2 GLN A 118 11.856 -1.632 -46.395 1.00 34.20 N flip ATOM 0 H GLN A 118 15.965 -2.676 -50.550 1.00 25.40 H new ATOM 0 HA GLN A 118 15.253 -4.536 -48.517 1.00 24.33 H new ATOM 0 HB2 GLN A 118 14.675 -1.986 -48.860 1.00 42.02 H new ATOM 0 HB3 GLN A 118 13.343 -2.591 -49.824 1.00 42.02 H new ATOM 0 HG2 GLN A 118 12.742 -4.059 -47.790 1.00 12.12 H new ATOM 0 HG3 GLN A 118 13.879 -3.082 -46.883 1.00 12.12 H new ATOM 0 HE21 GLN A 118 12.373 -1.985 -45.589 1.00 34.20 H new ATOM 0 HE22 GLN A 118 11.107 -0.952 -46.263 1.00 34.20 H new ATOM 1416 N THR A 119 14.208 -5.224 -51.453 1.00 11.35 N ATOM 1417 CA THR A 119 13.460 -6.196 -52.242 1.00 34.24 C ATOM 1418 C THR A 119 13.733 -7.616 -51.729 1.00 42.53 C ATOM 1419 O THR A 119 12.888 -8.507 -51.831 1.00 13.01 O ATOM 1420 CB THR A 119 13.831 -6.093 -53.735 1.00 62.04 C ATOM 1421 OG1 THR A 119 13.786 -4.719 -54.151 1.00 62.03 O ATOM 1422 CG2 THR A 119 12.879 -6.911 -54.593 1.00 32.41 C ATOM 0 H THR A 119 14.903 -4.696 -51.981 1.00 11.35 H new ATOM 0 HA THR A 119 12.398 -5.977 -52.136 1.00 34.24 H new ATOM 0 HB THR A 119 14.839 -6.488 -53.863 1.00 62.04 H new ATOM 0 HG1 THR A 119 14.656 -4.299 -53.986 1.00 62.03 H new ATOM 0 HG21 THR A 119 13.164 -6.820 -55.641 1.00 32.41 H new ATOM 0 HG22 THR A 119 12.927 -7.958 -54.293 1.00 32.41 H new ATOM 0 HG23 THR A 119 11.862 -6.542 -54.461 1.00 32.41 H new ATOM 1430 N CYS A 120 14.923 -7.797 -51.167 1.00 43.03 N ATOM 1431 CA CYS A 120 15.320 -9.044 -50.505 1.00 71.02 C ATOM 1432 C CYS A 120 14.542 -9.259 -49.193 1.00 4.41 C ATOM 1433 O CYS A 120 15.122 -9.651 -48.180 1.00 51.32 O ATOM 1434 CB CYS A 120 16.831 -9.015 -50.216 1.00 41.45 C ATOM 1435 SG CYS A 120 17.914 -9.415 -51.642 1.00 43.40 S ATOM 0 H CYS A 120 15.648 -7.080 -51.156 1.00 43.03 H new ATOM 0 HA CYS A 120 15.086 -9.873 -51.173 1.00 71.02 H new ATOM 0 HB2 CYS A 120 17.094 -8.023 -49.849 1.00 41.45 H new ATOM 0 HB3 CYS A 120 17.043 -9.719 -49.412 1.00 41.45 H new ATOM 1440 N ASP A 121 13.229 -9.007 -49.224 1.00 62.44 N ATOM 1441 CA ASP A 121 12.417 -8.966 -48.008 1.00 3.43 C ATOM 1442 C ASP A 121 12.325 -10.327 -47.305 1.00 54.21 C ATOM 1443 O ASP A 121 12.773 -10.458 -46.166 1.00 51.20 O ATOM 1444 CB ASP A 121 11.013 -8.457 -48.367 1.00 32.14 C ATOM 1445 CG ASP A 121 10.000 -8.606 -47.246 1.00 13.42 C ATOM 1446 OD1 ASP A 121 10.003 -7.785 -46.307 1.00 54.52 O ATOM 1447 OD2 ASP A 121 9.169 -9.535 -47.313 1.00 52.01 O ATOM 0 H ASP A 121 12.707 -8.828 -50.082 1.00 62.44 H new ATOM 0 HA ASP A 121 12.903 -8.290 -47.305 1.00 3.43 H new ATOM 0 HB2 ASP A 121 11.079 -7.406 -48.647 1.00 32.14 H new ATOM 0 HB3 ASP A 121 10.654 -8.998 -49.242 1.00 32.14 H new ATOM 1452 N LYS A 122 11.753 -11.344 -47.953 1.00 53.23 N ATOM 1453 CA LYS A 122 11.725 -12.672 -47.340 1.00 2.25 C ATOM 1454 C LYS A 122 12.211 -13.780 -48.272 1.00 52.51 C ATOM 1455 O LYS A 122 13.303 -14.320 -48.092 1.00 4.33 O ATOM 1456 CB LYS A 122 10.314 -12.986 -46.836 1.00 21.04 C ATOM 1457 CG LYS A 122 9.899 -12.113 -45.665 1.00 1.41 C ATOM 1458 CD LYS A 122 8.399 -12.146 -45.431 1.00 61.31 C ATOM 1459 CE LYS A 122 7.989 -11.138 -44.371 1.00 5.33 C ATOM 1460 NZ LYS A 122 8.534 -9.783 -44.665 1.00 54.20 N ATOM 0 H LYS A 122 11.316 -11.279 -48.872 1.00 53.23 H new ATOM 0 HA LYS A 122 12.423 -12.645 -46.503 1.00 2.25 H new ATOM 0 HB2 LYS A 122 9.604 -12.853 -47.652 1.00 21.04 H new ATOM 0 HB3 LYS A 122 10.264 -14.033 -46.538 1.00 21.04 H new ATOM 0 HG2 LYS A 122 10.413 -12.447 -44.764 1.00 1.41 H new ATOM 0 HG3 LYS A 122 10.214 -11.086 -45.849 1.00 1.41 H new ATOM 0 HD2 LYS A 122 7.877 -11.930 -46.364 1.00 61.31 H new ATOM 0 HD3 LYS A 122 8.098 -13.147 -45.121 1.00 61.31 H new ATOM 0 HE2 LYS A 122 6.902 -11.089 -44.315 1.00 5.33 H new ATOM 0 HE3 LYS A 122 8.344 -11.470 -43.395 1.00 5.33 H new ATOM 0 HZ1 LYS A 122 8.007 -9.071 -44.120 1.00 54.20 H new ATOM 0 HZ2 LYS A 122 9.539 -9.748 -44.399 1.00 54.20 H new ATOM 0 HZ3 LYS A 122 8.438 -9.583 -45.681 1.00 54.20 H new ATOM 1474 N LYS A 123 11.400 -14.105 -49.280 1.00 74.43 N ATOM 1475 CA LYS A 123 11.699 -15.237 -50.159 1.00 73.14 C ATOM 1476 C LYS A 123 11.534 -14.887 -51.636 1.00 72.15 C ATOM 1477 O LYS A 123 12.502 -14.806 -52.386 1.00 43.32 O ATOM 1478 CB LYS A 123 10.786 -16.421 -49.814 1.00 72.41 C ATOM 1479 CG LYS A 123 10.928 -16.915 -48.382 1.00 3.52 C ATOM 1480 CD LYS A 123 9.888 -17.975 -48.051 1.00 20.44 C ATOM 1481 CE LYS A 123 10.075 -19.237 -48.880 1.00 20.15 C ATOM 1482 NZ LYS A 123 9.029 -20.251 -48.579 1.00 10.41 N ATOM 0 H LYS A 123 10.540 -13.606 -49.507 1.00 74.43 H new ATOM 0 HA LYS A 123 12.743 -15.503 -49.995 1.00 73.14 H new ATOM 0 HB2 LYS A 123 9.750 -16.130 -49.986 1.00 72.41 H new ATOM 0 HB3 LYS A 123 11.003 -17.244 -50.495 1.00 72.41 H new ATOM 0 HG2 LYS A 123 11.927 -17.326 -48.235 1.00 3.52 H new ATOM 0 HG3 LYS A 123 10.825 -16.075 -47.695 1.00 3.52 H new ATOM 0 HD2 LYS A 123 9.950 -18.225 -46.992 1.00 20.44 H new ATOM 0 HD3 LYS A 123 8.891 -17.571 -48.226 1.00 20.44 H new ATOM 0 HE2 LYS A 123 10.043 -18.985 -49.940 1.00 20.15 H new ATOM 0 HE3 LYS A 123 11.060 -19.660 -48.682 1.00 20.15 H new ATOM 0 HZ1 LYS A 123 9.168 -21.084 -49.186 1.00 10.41 H new ATOM 0 HZ2 LYS A 123 9.098 -20.535 -47.581 1.00 10.41 H new ATOM 0 HZ3 LYS A 123 8.089 -19.844 -48.759 1.00 10.41 H new ATOM 1496 N TYR A 124 10.276 -14.678 -52.019 1.00 50.12 N ATOM 1497 CA TYR A 124 9.859 -14.530 -53.416 1.00 4.41 C ATOM 1498 C TYR A 124 10.643 -13.472 -54.185 1.00 35.54 C ATOM 1499 O TYR A 124 11.015 -13.688 -55.336 1.00 53.22 O ATOM 1500 CB TYR A 124 8.362 -14.209 -53.461 1.00 24.35 C ATOM 1501 CG TYR A 124 7.863 -13.483 -52.227 1.00 55.01 C ATOM 1502 CD1 TYR A 124 8.034 -12.113 -52.075 1.00 23.11 C ATOM 1503 CD2 TYR A 124 7.229 -14.180 -51.204 1.00 0.11 C ATOM 1504 CE1 TYR A 124 7.589 -11.461 -50.940 1.00 72.14 C ATOM 1505 CE2 TYR A 124 6.779 -13.533 -50.071 1.00 32.10 C ATOM 1506 CZ TYR A 124 6.962 -12.175 -49.944 1.00 34.55 C ATOM 1507 OH TYR A 124 6.521 -11.532 -48.811 1.00 50.20 O ATOM 0 H TYR A 124 9.503 -14.605 -51.358 1.00 50.12 H new ATOM 0 HA TYR A 124 10.070 -15.478 -53.912 1.00 4.41 H new ATOM 0 HB2 TYR A 124 8.155 -13.599 -54.340 1.00 24.35 H new ATOM 0 HB3 TYR A 124 7.803 -15.137 -53.578 1.00 24.35 H new ATOM 0 HD1 TYR A 124 8.522 -11.548 -52.856 1.00 23.11 H new ATOM 0 HD2 TYR A 124 7.086 -15.246 -51.298 1.00 0.11 H new ATOM 0 HE1 TYR A 124 7.733 -10.396 -50.835 1.00 72.14 H new ATOM 0 HE2 TYR A 124 6.286 -14.090 -49.288 1.00 32.10 H new ATOM 0 HH TYR A 124 6.100 -12.181 -48.209 1.00 50.20 H new ATOM 1517 N GLU A 125 10.891 -12.336 -53.562 1.00 43.24 N ATOM 1518 CA GLU A 125 11.549 -11.238 -54.248 1.00 23.31 C ATOM 1519 C GLU A 125 13.015 -11.132 -53.848 1.00 13.22 C ATOM 1520 O GLU A 125 13.708 -10.194 -54.242 1.00 12.22 O ATOM 1521 CB GLU A 125 10.822 -9.931 -53.951 1.00 62.03 C ATOM 1522 CG GLU A 125 10.161 -9.309 -55.172 1.00 52.44 C ATOM 1523 CD GLU A 125 9.107 -10.200 -55.804 1.00 25.40 C ATOM 1524 OE1 GLU A 125 7.970 -10.235 -55.292 1.00 73.22 O ATOM 1525 OE2 GLU A 125 9.399 -10.843 -56.835 1.00 65.22 O ATOM 0 H GLU A 125 10.649 -12.149 -52.589 1.00 43.24 H new ATOM 0 HA GLU A 125 11.512 -11.435 -55.319 1.00 23.31 H new ATOM 0 HB2 GLU A 125 10.063 -10.112 -53.190 1.00 62.03 H new ATOM 0 HB3 GLU A 125 11.531 -9.218 -53.530 1.00 62.03 H new ATOM 0 HG2 GLU A 125 9.702 -8.363 -54.886 1.00 52.44 H new ATOM 0 HG3 GLU A 125 10.926 -9.081 -55.914 1.00 52.44 H new ATOM 1532 N SER A 126 13.492 -12.101 -53.086 1.00 24.55 N ATOM 1533 CA SER A 126 14.856 -12.068 -52.591 1.00 75.34 C ATOM 1534 C SER A 126 15.859 -12.364 -53.702 1.00 44.12 C ATOM 1535 O SER A 126 16.885 -11.696 -53.810 1.00 23.32 O ATOM 1536 CB SER A 126 15.021 -13.055 -51.443 1.00 54.22 C ATOM 1537 OG SER A 126 14.079 -12.786 -50.421 1.00 53.01 O ATOM 0 H SER A 126 12.955 -12.919 -52.797 1.00 24.55 H new ATOM 0 HA SER A 126 15.059 -11.062 -52.224 1.00 75.34 H new ATOM 0 HB2 SER A 126 14.889 -14.073 -51.809 1.00 54.22 H new ATOM 0 HB3 SER A 126 16.032 -12.989 -51.041 1.00 54.22 H new ATOM 0 HG SER A 126 14.509 -12.882 -49.546 1.00 53.01 H new ATOM 1543 N ASP A 127 15.563 -13.352 -54.540 1.00 55.40 N ATOM 1544 CA ASP A 127 16.446 -13.683 -55.654 1.00 64.43 C ATOM 1545 C ASP A 127 16.322 -12.627 -56.747 1.00 64.21 C ATOM 1546 O ASP A 127 17.287 -12.346 -57.462 1.00 33.25 O ATOM 1547 CB ASP A 127 16.133 -15.077 -56.213 1.00 22.14 C ATOM 1548 CG ASP A 127 14.779 -15.163 -56.890 1.00 41.11 C ATOM 1549 OD1 ASP A 127 13.804 -14.606 -56.348 1.00 15.31 O ATOM 1550 OD2 ASP A 127 14.680 -15.810 -57.959 1.00 23.11 O ATOM 0 H ASP A 127 14.727 -13.933 -54.471 1.00 55.40 H new ATOM 0 HA ASP A 127 17.472 -13.695 -55.287 1.00 64.43 H new ATOM 0 HB2 ASP A 127 16.907 -15.356 -56.928 1.00 22.14 H new ATOM 0 HB3 ASP A 127 16.172 -15.803 -55.401 1.00 22.14 H new ATOM 1555 N LYS A 128 15.128 -12.042 -56.865 1.00 72.12 N ATOM 1556 CA LYS A 128 14.895 -10.901 -57.752 1.00 33.32 C ATOM 1557 C LYS A 128 15.823 -9.758 -57.371 1.00 1.34 C ATOM 1558 O LYS A 128 16.386 -9.069 -58.222 1.00 31.01 O ATOM 1559 CB LYS A 128 13.448 -10.415 -57.632 1.00 71.54 C ATOM 1560 CG LYS A 128 12.403 -11.513 -57.726 1.00 2.01 C ATOM 1561 CD LYS A 128 12.350 -12.138 -59.108 1.00 51.34 C ATOM 1562 CE LYS A 128 11.198 -13.119 -59.212 1.00 61.14 C ATOM 1563 NZ LYS A 128 9.890 -12.461 -58.942 1.00 10.55 N ATOM 0 H LYS A 128 14.300 -12.344 -56.351 1.00 72.12 H new ATOM 0 HA LYS A 128 15.088 -11.218 -58.777 1.00 33.32 H new ATOM 0 HB2 LYS A 128 13.330 -9.899 -56.679 1.00 71.54 H new ATOM 0 HB3 LYS A 128 13.258 -9.683 -58.417 1.00 71.54 H new ATOM 0 HG2 LYS A 128 12.622 -12.285 -56.988 1.00 2.01 H new ATOM 0 HG3 LYS A 128 11.424 -11.103 -57.477 1.00 2.01 H new ATOM 0 HD2 LYS A 128 12.238 -11.358 -59.861 1.00 51.34 H new ATOM 0 HD3 LYS A 128 13.289 -12.650 -59.317 1.00 51.34 H new ATOM 0 HE2 LYS A 128 11.185 -13.561 -60.208 1.00 61.14 H new ATOM 0 HE3 LYS A 128 11.349 -13.934 -58.504 1.00 61.14 H new ATOM 0 HZ1 LYS A 128 9.118 -13.130 -59.137 1.00 10.55 H new ATOM 0 HZ2 LYS A 128 9.849 -12.166 -57.946 1.00 10.55 H new ATOM 0 HZ3 LYS A 128 9.788 -11.627 -59.555 1.00 10.55 H new ATOM 1577 N CYS A 129 15.961 -9.570 -56.073 1.00 51.22 N ATOM 1578 CA CYS A 129 16.817 -8.545 -55.515 1.00 54.21 C ATOM 1579 C CYS A 129 18.286 -8.936 -55.671 1.00 24.53 C ATOM 1580 O CYS A 129 19.124 -8.113 -56.042 1.00 60.33 O ATOM 1581 CB CYS A 129 16.415 -8.356 -54.044 1.00 62.34 C ATOM 1582 SG CYS A 129 17.731 -7.828 -52.898 1.00 11.41 S ATOM 0 H CYS A 129 15.477 -10.130 -55.371 1.00 51.22 H new ATOM 0 HA CYS A 129 16.695 -7.599 -56.043 1.00 54.21 H new ATOM 0 HB2 CYS A 129 15.612 -7.620 -54.002 1.00 62.34 H new ATOM 0 HB3 CYS A 129 16.004 -9.297 -53.680 1.00 62.34 H new ATOM 1587 N LEU A 130 18.574 -10.213 -55.442 1.00 51.12 N ATOM 1588 CA LEU A 130 19.937 -10.724 -55.510 1.00 45.25 C ATOM 1589 C LEU A 130 20.519 -10.579 -56.922 1.00 24.03 C ATOM 1590 O LEU A 130 21.608 -10.031 -57.085 1.00 1.41 O ATOM 1591 CB LEU A 130 19.964 -12.194 -55.052 1.00 0.14 C ATOM 1592 CG LEU A 130 21.349 -12.794 -54.749 1.00 62.34 C ATOM 1593 CD1 LEU A 130 22.100 -13.135 -56.026 1.00 23.32 C ATOM 1594 CD2 LEU A 130 22.167 -11.845 -53.887 1.00 35.22 C ATOM 0 H LEU A 130 17.875 -10.917 -55.206 1.00 51.12 H new ATOM 0 HA LEU A 130 20.562 -10.133 -54.841 1.00 45.25 H new ATOM 0 HB2 LEU A 130 19.350 -12.283 -54.156 1.00 0.14 H new ATOM 0 HB3 LEU A 130 19.491 -12.801 -55.824 1.00 0.14 H new ATOM 0 HG LEU A 130 21.194 -13.721 -54.197 1.00 62.34 H new ATOM 0 HD11 LEU A 130 23.073 -13.556 -55.774 1.00 23.32 H new ATOM 0 HD12 LEU A 130 21.528 -13.863 -56.601 1.00 23.32 H new ATOM 0 HD13 LEU A 130 22.238 -12.231 -56.619 1.00 23.32 H new ATOM 0 HD21 LEU A 130 23.142 -12.287 -53.684 1.00 35.22 H new ATOM 0 HD22 LEU A 130 22.300 -10.899 -54.412 1.00 35.22 H new ATOM 0 HD23 LEU A 130 21.646 -11.668 -52.946 1.00 35.22 H new ATOM 1606 N ASN A 131 19.799 -11.056 -57.942 1.00 75.13 N ATOM 1607 CA ASN A 131 20.305 -10.997 -59.318 1.00 34.02 C ATOM 1608 C ASN A 131 20.518 -9.564 -59.787 1.00 2.12 C ATOM 1609 O ASN A 131 21.346 -9.313 -60.659 1.00 2.23 O ATOM 1610 CB ASN A 131 19.398 -11.753 -60.307 1.00 0.31 C ATOM 1611 CG ASN A 131 18.126 -11.010 -60.684 1.00 11.01 C ATOM 1612 OD1 ASN A 131 18.125 -10.164 -61.580 1.00 30.31 O ATOM 1613 ND2 ASN A 131 17.028 -11.354 -60.041 1.00 71.20 N ATOM 0 H ASN A 131 18.877 -11.482 -57.845 1.00 75.13 H new ATOM 0 HA ASN A 131 21.273 -11.497 -59.303 1.00 34.02 H new ATOM 0 HB2 ASN A 131 19.965 -11.962 -61.214 1.00 0.31 H new ATOM 0 HB3 ASN A 131 19.127 -12.715 -59.871 1.00 0.31 H new ATOM 0 HD21 ASN A 131 16.139 -10.916 -60.280 1.00 71.20 H new ATOM 0 HD22 ASN A 131 17.068 -12.059 -59.305 1.00 71.20 H new ATOM 1620 N ALA A 132 19.801 -8.628 -59.185 1.00 35.13 N ATOM 1621 CA ALA A 132 19.930 -7.231 -59.563 1.00 53.44 C ATOM 1622 C ALA A 132 21.190 -6.653 -58.930 1.00 33.43 C ATOM 1623 O ALA A 132 22.035 -6.063 -59.602 1.00 32.43 O ATOM 1624 CB ALA A 132 18.703 -6.442 -59.137 1.00 52.24 C ATOM 0 H ALA A 132 19.129 -8.809 -58.439 1.00 35.13 H new ATOM 0 HA ALA A 132 20.009 -7.159 -60.648 1.00 53.44 H new ATOM 0 HB1 ALA A 132 18.821 -5.399 -59.430 1.00 52.24 H new ATOM 0 HB2 ALA A 132 17.818 -6.856 -59.620 1.00 52.24 H new ATOM 0 HB3 ALA A 132 18.588 -6.504 -58.055 1.00 52.24 H new ATOM 1630 N ILE A 133 21.290 -6.847 -57.619 1.00 25.34 N ATOM 1631 CA ILE A 133 22.449 -6.426 -56.839 1.00 71.21 C ATOM 1632 C ILE A 133 23.764 -6.981 -57.399 1.00 50.34 C ATOM 1633 O ILE A 133 24.781 -6.286 -57.405 1.00 73.21 O ATOM 1634 CB ILE A 133 22.299 -6.850 -55.355 1.00 3.32 C ATOM 1635 CG1 ILE A 133 21.124 -6.116 -54.702 1.00 62.01 C ATOM 1636 CG2 ILE A 133 23.583 -6.593 -54.576 1.00 1.41 C ATOM 1637 CD1 ILE A 133 21.281 -4.609 -54.676 1.00 54.32 C ATOM 0 H ILE A 133 20.565 -7.303 -57.065 1.00 25.34 H new ATOM 0 HA ILE A 133 22.488 -5.339 -56.906 1.00 71.21 H new ATOM 0 HB ILE A 133 22.099 -7.921 -55.332 1.00 3.32 H new ATOM 0 HG12 ILE A 133 20.208 -6.367 -55.237 1.00 62.01 H new ATOM 0 HG13 ILE A 133 21.005 -6.477 -53.680 1.00 62.01 H new ATOM 0 HG21 ILE A 133 23.447 -6.900 -53.539 1.00 1.41 H new ATOM 0 HG22 ILE A 133 24.398 -7.164 -55.020 1.00 1.41 H new ATOM 0 HG23 ILE A 133 23.823 -5.530 -54.611 1.00 1.41 H new ATOM 0 HD11 ILE A 133 20.410 -4.161 -54.199 1.00 54.32 H new ATOM 0 HD12 ILE A 133 22.178 -4.346 -54.115 1.00 54.32 H new ATOM 0 HD13 ILE A 133 21.369 -4.235 -55.696 1.00 54.32 H new ATOM 1649 N LYS A 134 23.745 -8.205 -57.920 1.00 25.20 N ATOM 1650 CA LYS A 134 24.990 -8.869 -58.284 1.00 42.43 C ATOM 1651 C LYS A 134 25.540 -8.313 -59.600 1.00 15.23 C ATOM 1652 O LYS A 134 26.735 -8.048 -59.715 1.00 40.05 O ATOM 1653 CB LYS A 134 24.797 -10.393 -58.354 1.00 51.52 C ATOM 1654 CG LYS A 134 23.838 -10.852 -59.439 1.00 45.21 C ATOM 1655 CD LYS A 134 23.412 -12.301 -59.249 1.00 75.50 C ATOM 1656 CE LYS A 134 24.581 -13.267 -59.351 1.00 73.43 C ATOM 1657 NZ LYS A 134 24.144 -14.682 -59.198 1.00 75.33 N ATOM 0 H LYS A 134 22.899 -8.747 -58.096 1.00 25.20 H new ATOM 0 HA LYS A 134 25.726 -8.665 -57.507 1.00 42.43 H new ATOM 0 HB2 LYS A 134 25.766 -10.863 -58.519 1.00 51.52 H new ATOM 0 HB3 LYS A 134 24.432 -10.746 -57.390 1.00 51.52 H new ATOM 0 HG2 LYS A 134 22.956 -10.212 -59.437 1.00 45.21 H new ATOM 0 HG3 LYS A 134 24.312 -10.739 -60.414 1.00 45.21 H new ATOM 0 HD2 LYS A 134 22.936 -12.412 -58.275 1.00 75.50 H new ATOM 0 HD3 LYS A 134 22.665 -12.559 -60.000 1.00 75.50 H new ATOM 0 HE2 LYS A 134 25.074 -13.141 -60.315 1.00 73.43 H new ATOM 0 HE3 LYS A 134 25.317 -13.029 -58.583 1.00 73.43 H new ATOM 0 HZ1 LYS A 134 24.969 -15.310 -59.273 1.00 75.33 H new ATOM 0 HZ2 LYS A 134 23.696 -14.808 -58.268 1.00 75.33 H new ATOM 0 HZ3 LYS A 134 23.460 -14.917 -59.946 1.00 75.33 H new ATOM 1671 N GLU A 135 24.660 -8.114 -60.584 1.00 23.44 N ATOM 1672 CA GLU A 135 25.073 -7.623 -61.897 1.00 61.02 C ATOM 1673 C GLU A 135 25.513 -6.162 -61.842 1.00 72.10 C ATOM 1674 O GLU A 135 26.108 -5.649 -62.788 1.00 13.02 O ATOM 1675 CB GLU A 135 23.948 -7.800 -62.922 1.00 14.41 C ATOM 1676 CG GLU A 135 22.667 -7.059 -62.572 1.00 53.44 C ATOM 1677 CD GLU A 135 21.606 -7.199 -63.644 1.00 51.31 C ATOM 1678 OE1 GLU A 135 21.591 -6.377 -64.581 1.00 51.41 O ATOM 1679 OE2 GLU A 135 20.784 -8.134 -63.559 1.00 41.53 O ATOM 0 H GLU A 135 23.658 -8.286 -60.495 1.00 23.44 H new ATOM 0 HA GLU A 135 25.931 -8.218 -62.210 1.00 61.02 H new ATOM 0 HB2 GLU A 135 24.300 -7.456 -63.895 1.00 14.41 H new ATOM 0 HB3 GLU A 135 23.725 -8.862 -63.021 1.00 14.41 H new ATOM 0 HG2 GLU A 135 22.277 -7.439 -61.628 1.00 53.44 H new ATOM 0 HG3 GLU A 135 22.891 -6.003 -62.422 1.00 53.44 H new ATOM 1686 N LYS A 136 25.200 -5.489 -60.745 1.00 34.43 N ATOM 1687 CA LYS A 136 25.673 -4.129 -60.535 1.00 21.42 C ATOM 1688 C LYS A 136 27.161 -4.114 -60.198 1.00 15.34 C ATOM 1689 O LYS A 136 27.868 -3.157 -60.514 1.00 0.52 O ATOM 1690 CB LYS A 136 24.890 -3.452 -59.409 1.00 62.51 C ATOM 1691 CG LYS A 136 23.423 -3.231 -59.721 1.00 42.43 C ATOM 1692 CD LYS A 136 22.708 -2.590 -58.545 1.00 62.24 C ATOM 1693 CE LYS A 136 21.236 -2.367 -58.837 1.00 15.23 C ATOM 1694 NZ LYS A 136 20.533 -1.764 -57.676 1.00 4.04 N ATOM 0 H LYS A 136 24.623 -5.860 -59.990 1.00 34.43 H new ATOM 0 HA LYS A 136 25.515 -3.579 -61.463 1.00 21.42 H new ATOM 0 HB2 LYS A 136 24.971 -4.060 -58.508 1.00 62.51 H new ATOM 0 HB3 LYS A 136 25.352 -2.490 -59.187 1.00 62.51 H new ATOM 0 HG2 LYS A 136 23.326 -2.595 -60.601 1.00 42.43 H new ATOM 0 HG3 LYS A 136 22.951 -4.183 -59.963 1.00 42.43 H new ATOM 0 HD2 LYS A 136 22.812 -3.225 -57.665 1.00 62.24 H new ATOM 0 HD3 LYS A 136 23.180 -1.637 -58.308 1.00 62.24 H new ATOM 0 HE2 LYS A 136 21.131 -1.716 -59.705 1.00 15.23 H new ATOM 0 HE3 LYS A 136 20.767 -3.317 -59.093 1.00 15.23 H new ATOM 0 HZ1 LYS A 136 19.505 -1.858 -57.806 1.00 4.04 H new ATOM 0 HZ2 LYS A 136 20.818 -2.254 -56.804 1.00 4.04 H new ATOM 0 HZ3 LYS A 136 20.782 -0.757 -57.604 1.00 4.04 H new ATOM 1708 N TYR A 137 27.640 -5.185 -59.574 1.00 12.42 N ATOM 1709 CA TYR A 137 28.995 -5.205 -59.039 1.00 63.02 C ATOM 1710 C TYR A 137 29.878 -6.238 -59.736 1.00 1.52 C ATOM 1711 O TYR A 137 30.775 -6.809 -59.115 1.00 63.22 O ATOM 1712 CB TYR A 137 28.952 -5.493 -57.534 1.00 3.23 C ATOM 1713 CG TYR A 137 28.067 -4.540 -56.763 1.00 11.11 C ATOM 1714 CD1 TYR A 137 28.148 -3.167 -56.960 1.00 35.22 C ATOM 1715 CD2 TYR A 137 27.145 -5.014 -55.840 1.00 34.32 C ATOM 1716 CE1 TYR A 137 27.335 -2.297 -56.263 1.00 45.34 C ATOM 1717 CE2 TYR A 137 26.326 -4.148 -55.138 1.00 1.22 C ATOM 1718 CZ TYR A 137 26.427 -2.790 -55.352 1.00 72.30 C ATOM 1719 OH TYR A 137 25.616 -1.918 -54.661 1.00 41.45 O ATOM 0 H TYR A 137 27.113 -6.046 -59.427 1.00 12.42 H new ATOM 0 HA TYR A 137 29.433 -4.224 -59.222 1.00 63.02 H new ATOM 0 HB2 TYR A 137 28.599 -6.512 -57.377 1.00 3.23 H new ATOM 0 HB3 TYR A 137 29.964 -5.441 -57.133 1.00 3.23 H new ATOM 0 HD1 TYR A 137 28.860 -2.774 -57.671 1.00 35.22 H new ATOM 0 HD2 TYR A 137 27.066 -6.077 -55.667 1.00 34.32 H new ATOM 0 HE1 TYR A 137 27.410 -1.233 -56.431 1.00 45.34 H new ATOM 0 HE2 TYR A 137 25.611 -4.534 -54.426 1.00 1.22 H new ATOM 0 HH TYR A 137 25.031 -2.423 -54.058 1.00 41.45 H new ATOM 1729 N LYS A 138 29.644 -6.476 -61.021 1.00 64.34 N ATOM 1730 CA LYS A 138 30.484 -7.410 -61.764 1.00 11.24 C ATOM 1731 C LYS A 138 31.783 -6.720 -62.188 1.00 43.52 C ATOM 1732 O LYS A 138 31.779 -5.538 -62.544 1.00 31.42 O ATOM 1733 CB LYS A 138 29.749 -8.003 -62.983 1.00 52.04 C ATOM 1734 CG LYS A 138 29.659 -7.097 -64.209 1.00 74.40 C ATOM 1735 CD LYS A 138 28.791 -5.877 -63.966 1.00 73.31 C ATOM 1736 CE LYS A 138 28.434 -5.180 -65.268 1.00 30.33 C ATOM 1737 NZ LYS A 138 27.596 -3.975 -65.039 1.00 51.33 N ATOM 0 H LYS A 138 28.895 -6.045 -61.563 1.00 64.34 H new ATOM 0 HA LYS A 138 30.724 -8.244 -61.105 1.00 11.24 H new ATOM 0 HB2 LYS A 138 30.251 -8.926 -63.273 1.00 52.04 H new ATOM 0 HB3 LYS A 138 28.738 -8.272 -62.678 1.00 52.04 H new ATOM 0 HG2 LYS A 138 30.661 -6.775 -64.494 1.00 74.40 H new ATOM 0 HG3 LYS A 138 29.256 -7.665 -65.048 1.00 74.40 H new ATOM 0 HD2 LYS A 138 27.879 -6.175 -63.450 1.00 73.31 H new ATOM 0 HD3 LYS A 138 29.315 -5.181 -63.311 1.00 73.31 H new ATOM 0 HE2 LYS A 138 29.348 -4.893 -65.789 1.00 30.33 H new ATOM 0 HE3 LYS A 138 27.901 -5.875 -65.918 1.00 30.33 H new ATOM 0 HZ1 LYS A 138 27.073 -3.746 -65.908 1.00 51.33 H new ATOM 0 HZ2 LYS A 138 26.923 -4.162 -64.269 1.00 51.33 H new ATOM 0 HZ3 LYS A 138 28.205 -3.173 -64.780 1.00 51.33 H new