USER MOD reduce.3.24.130724 H: found=0, std=0, add=989, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 991 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 110 LYS NZ :NH3+ 161:sc= 0.903 (180deg=0.626) USER MOD Set 1.2: A 111 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 76 TYR OH : rot 7:sc= 1.26 USER MOD Set 2.2: A 96 HIS : no HD1:sc= 1.08 K(o=2.3,f=-13!) USER MOD Set 3.1: A 16 MET CE :methyl -121:sc= -0.224 (180deg=-2.85!) USER MOD Set 3.2: A 63 MET CE :methyl -134:sc= -0.949 (180deg=-2.16!) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -128:sc= 1.26 (180deg=-0.378) USER MOD Single : A 21 SER OG : rot 180:sc= -0.0043 USER MOD Single : A 25 LYS NZ :NH3+ 148:sc= 1.27 (180deg=1.09) USER MOD Single : A 26 ASN : amide:sc=-0.00122 K(o=-0.0012,f=-1) USER MOD Single : A 30 LYS NZ :NH3+ -141:sc= -1.13 (180deg=-3.2!) USER MOD Single : A 33 TYR OH : rot 15:sc= -0.033 USER MOD Single : A 35 GLN : amide:sc= -0.212 K(o=-0.21,f=-0.91!) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 GLN : amide:sc= -0.527 X(o=-0.53,f=-0.42) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN :FLIP amide:sc= -0.0623 F(o=-1.1,f=-0.062) USER MOD Single : A 58 ASN : amide:sc= 1.19 K(o=1.2,f=-0.054) USER MOD Single : A 62 SER OG : rot 180:sc= -0.0371 USER MOD Single : A 64 LYS NZ :NH3+ 133:sc= 1.27 (180deg=0.989) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 57:sc= 1.01 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -0.199 X(o=-0.2,f=-0.059) USER MOD Single : A 86 ASN : amide:sc= 0.0772 K(o=0.077,f=-4.6!) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0.0884 USER MOD Single : A 104 SER OG : rot 180:sc= -0.0521 USER MOD Single : A 109 GLN :FLIP amide:sc= 0 F(o=-0.96,f=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -98:sc= 1.26 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 72:sc= 0.549 USER MOD Single : A 131 GLN : amide:sc= 0.45 K(o=0.45,f=-0.089) USER MOD Single : A 133 TYR OH : rot 51:sc= 0.475 USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 THR OG1 : rot 137:sc= 1.21 USER MOD ----------------------------------------------------------------- ATOM 215 N TYR A 14 -5.755 -11.026 -8.705 1.00 0.00 N ATOM 216 CA TYR A 14 -6.769 -10.155 -8.132 1.00 0.00 C ATOM 217 C TYR A 14 -6.456 -8.712 -8.486 1.00 0.00 C ATOM 218 O TYR A 14 -5.509 -8.122 -7.960 1.00 0.00 O ATOM 219 CB TYR A 14 -6.841 -10.320 -6.610 1.00 0.00 C ATOM 220 CG TYR A 14 -7.151 -11.730 -6.160 1.00 0.00 C ATOM 221 CD1 TYR A 14 -8.415 -12.276 -6.341 1.00 0.00 C ATOM 222 CD2 TYR A 14 -6.179 -12.516 -5.552 1.00 0.00 C ATOM 223 CE1 TYR A 14 -8.704 -13.564 -5.929 1.00 0.00 C ATOM 224 CE2 TYR A 14 -6.460 -13.803 -5.138 1.00 0.00 C ATOM 225 CZ TYR A 14 -7.723 -14.322 -5.328 1.00 0.00 C ATOM 226 OH TYR A 14 -8.003 -15.605 -4.916 1.00 0.00 O ATOM 0 HA TYR A 14 -7.739 -10.431 -8.546 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -5.890 -10.011 -6.176 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -7.604 -9.648 -6.217 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -9.186 -11.684 -6.812 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -5.188 -12.114 -5.401 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -9.692 -13.973 -6.077 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -5.693 -14.401 -4.667 1.00 0.00 H new ATOM 0 HH TYR A 14 -7.202 -16.001 -4.513 1.00 0.00 H new ATOM 236 N ALA A 15 -7.234 -8.156 -9.395 1.00 0.00 N ATOM 237 CA ALA A 15 -7.005 -6.804 -9.866 1.00 0.00 C ATOM 238 C ALA A 15 -8.315 -6.134 -10.235 1.00 0.00 C ATOM 239 O ALA A 15 -9.304 -6.809 -10.538 1.00 0.00 O ATOM 240 CB ALA A 15 -6.069 -6.819 -11.065 1.00 0.00 C ATOM 0 H ALA A 15 -8.034 -8.622 -9.823 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.542 -6.233 -9.061 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.904 -5.798 -11.411 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.116 -7.263 -10.777 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -6.515 -7.406 -11.868 1.00 0.00 H new ATOM 246 N MET A 16 -8.318 -4.811 -10.199 1.00 0.00 N ATOM 247 CA MET A 16 -9.474 -4.040 -10.630 1.00 0.00 C ATOM 248 C MET A 16 -9.451 -3.876 -12.142 1.00 0.00 C ATOM 249 O MET A 16 -8.607 -3.173 -12.698 1.00 0.00 O ATOM 250 CB MET A 16 -9.530 -2.680 -9.929 1.00 0.00 C ATOM 251 CG MET A 16 -9.999 -2.774 -8.488 1.00 0.00 C ATOM 252 SD MET A 16 -11.621 -3.553 -8.350 1.00 0.00 S ATOM 253 CE MET A 16 -11.857 -3.540 -6.577 1.00 0.00 C ATOM 0 H MET A 16 -7.532 -4.248 -9.875 1.00 0.00 H new ATOM 0 HA MET A 16 -10.376 -4.584 -10.350 1.00 0.00 H new ATOM 0 HB2 MET A 16 -8.541 -2.223 -9.954 1.00 0.00 H new ATOM 0 HB3 MET A 16 -10.200 -2.020 -10.481 1.00 0.00 H new ATOM 0 HG2 MET A 16 -9.273 -3.344 -7.908 1.00 0.00 H new ATOM 0 HG3 MET A 16 -10.039 -1.775 -8.055 1.00 0.00 H new ATOM 0 HE1 MET A 16 -11.991 -4.561 -6.220 1.00 0.00 H new ATOM 0 HE2 MET A 16 -10.983 -3.100 -6.097 1.00 0.00 H new ATOM 0 HE3 MET A 16 -12.741 -2.951 -6.332 1.00 0.00 H new ATOM 263 N LYS A 17 -10.381 -4.554 -12.792 1.00 0.00 N ATOM 264 CA LYS A 17 -10.420 -4.632 -14.243 1.00 0.00 C ATOM 265 C LYS A 17 -11.462 -3.675 -14.812 1.00 0.00 C ATOM 266 O LYS A 17 -12.465 -3.388 -14.162 1.00 0.00 O ATOM 267 CB LYS A 17 -10.741 -6.071 -14.656 1.00 0.00 C ATOM 268 CG LYS A 17 -9.695 -7.071 -14.190 1.00 0.00 C ATOM 269 CD LYS A 17 -10.192 -8.505 -14.277 1.00 0.00 C ATOM 270 CE LYS A 17 -11.143 -8.848 -13.143 1.00 0.00 C ATOM 271 NZ LYS A 17 -11.376 -10.315 -13.055 1.00 0.00 N ATOM 0 H LYS A 17 -11.131 -5.067 -12.329 1.00 0.00 H new ATOM 0 HA LYS A 17 -9.448 -4.342 -14.642 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -11.712 -6.352 -14.248 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -10.825 -6.121 -15.742 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -8.796 -6.963 -14.796 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -9.414 -6.847 -13.161 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -10.696 -8.657 -15.231 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -9.341 -9.186 -14.255 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -10.733 -8.486 -12.200 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -12.093 -8.336 -13.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -12.399 -10.504 -13.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -10.943 -10.785 -13.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -10.949 -10.682 -12.181 1.00 0.00 H new ATOM 285 N PRO A 18 -11.235 -3.158 -16.027 1.00 0.00 N ATOM 286 CA PRO A 18 -12.193 -2.277 -16.698 1.00 0.00 C ATOM 287 C PRO A 18 -13.490 -3.008 -17.035 1.00 0.00 C ATOM 288 O PRO A 18 -13.516 -3.880 -17.909 1.00 0.00 O ATOM 289 CB PRO A 18 -11.468 -1.842 -17.978 1.00 0.00 C ATOM 290 CG PRO A 18 -10.034 -2.174 -17.749 1.00 0.00 C ATOM 291 CD PRO A 18 -10.028 -3.366 -16.839 1.00 0.00 C ATOM 0 HA PRO A 18 -12.485 -1.437 -16.068 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -11.859 -2.367 -18.849 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -11.600 -0.776 -18.162 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -9.530 -2.398 -18.689 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -9.506 -1.335 -17.296 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -10.071 -4.302 -17.397 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -9.128 -3.402 -16.225 1.00 0.00 H new ATOM 299 N GLY A 19 -14.554 -2.668 -16.320 1.00 0.00 N ATOM 300 CA GLY A 19 -15.838 -3.302 -16.544 1.00 0.00 C ATOM 301 C GLY A 19 -15.901 -4.707 -15.976 1.00 0.00 C ATOM 302 O GLY A 19 -16.398 -5.623 -16.630 1.00 0.00 O ATOM 0 H GLY A 19 -14.550 -1.961 -15.585 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -16.623 -2.695 -16.091 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -16.040 -3.337 -17.615 1.00 0.00 H new ATOM 306 N LEU A 20 -15.396 -4.886 -14.763 1.00 0.00 N ATOM 307 CA LEU A 20 -15.421 -6.195 -14.122 1.00 0.00 C ATOM 308 C LEU A 20 -16.635 -6.319 -13.191 1.00 0.00 C ATOM 309 O LEU A 20 -17.138 -5.321 -12.673 1.00 0.00 O ATOM 310 CB LEU A 20 -14.067 -6.481 -13.433 1.00 0.00 C ATOM 311 CG LEU A 20 -13.767 -5.839 -12.078 1.00 0.00 C ATOM 312 CD1 LEU A 20 -14.262 -4.413 -11.978 1.00 0.00 C ATOM 313 CD2 LEU A 20 -14.344 -6.698 -10.993 1.00 0.00 C ATOM 0 H LEU A 20 -14.967 -4.147 -14.206 1.00 0.00 H new ATOM 0 HA LEU A 20 -15.547 -6.973 -14.875 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -13.984 -7.561 -13.310 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -13.278 -6.177 -14.121 1.00 0.00 H new ATOM 0 HG LEU A 20 -12.685 -5.779 -11.963 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -14.020 -4.012 -10.994 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -13.781 -3.806 -12.746 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -15.342 -4.392 -12.122 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -14.135 -6.248 -10.023 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -15.422 -6.781 -11.130 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -13.895 -7.690 -11.037 1.00 0.00 H new ATOM 325 N SER A 21 -17.114 -7.544 -13.011 1.00 0.00 N ATOM 326 CA SER A 21 -18.379 -7.796 -12.329 1.00 0.00 C ATOM 327 C SER A 21 -18.250 -7.612 -10.821 1.00 0.00 C ATOM 328 O SER A 21 -17.153 -7.677 -10.264 1.00 0.00 O ATOM 329 CB SER A 21 -18.865 -9.214 -12.644 1.00 0.00 C ATOM 330 OG SER A 21 -20.157 -9.457 -12.108 1.00 0.00 O ATOM 0 H SER A 21 -16.639 -8.388 -13.332 1.00 0.00 H new ATOM 0 HA SER A 21 -19.107 -7.070 -12.692 1.00 0.00 H new ATOM 0 HB2 SER A 21 -18.886 -9.360 -13.724 1.00 0.00 H new ATOM 0 HB3 SER A 21 -18.160 -9.939 -12.238 1.00 0.00 H new ATOM 0 HG SER A 21 -20.437 -10.370 -12.329 1.00 0.00 H new ATOM 336 N ALA A 22 -19.386 -7.402 -10.165 1.00 0.00 N ATOM 337 CA ALA A 22 -19.417 -7.180 -8.726 1.00 0.00 C ATOM 338 C ALA A 22 -18.902 -8.398 -7.967 1.00 0.00 C ATOM 339 O ALA A 22 -18.259 -8.262 -6.933 1.00 0.00 O ATOM 340 CB ALA A 22 -20.826 -6.829 -8.273 1.00 0.00 C ATOM 0 H ALA A 22 -20.303 -7.381 -10.612 1.00 0.00 H new ATOM 0 HA ALA A 22 -18.757 -6.342 -8.502 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -20.832 -6.666 -7.195 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -21.155 -5.921 -8.779 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -21.502 -7.648 -8.520 1.00 0.00 H new ATOM 346 N LEU A 23 -19.178 -9.585 -8.497 1.00 0.00 N ATOM 347 CA LEU A 23 -18.724 -10.828 -7.879 1.00 0.00 C ATOM 348 C LEU A 23 -17.198 -10.879 -7.847 1.00 0.00 C ATOM 349 O LEU A 23 -16.588 -11.192 -6.815 1.00 0.00 O ATOM 350 CB LEU A 23 -19.285 -12.029 -8.647 1.00 0.00 C ATOM 351 CG LEU A 23 -20.812 -12.093 -8.727 1.00 0.00 C ATOM 352 CD1 LEU A 23 -21.251 -13.277 -9.574 1.00 0.00 C ATOM 353 CD2 LEU A 23 -21.414 -12.185 -7.332 1.00 0.00 C ATOM 0 H LEU A 23 -19.715 -9.714 -9.355 1.00 0.00 H new ATOM 0 HA LEU A 23 -19.090 -10.866 -6.853 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -18.884 -12.012 -9.660 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -18.923 -12.943 -8.176 1.00 0.00 H new ATOM 0 HG LEU A 23 -21.172 -11.179 -9.199 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -22.340 -13.308 -9.620 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -20.848 -13.173 -10.581 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -20.881 -14.200 -9.128 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -22.501 -12.230 -7.407 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -21.047 -13.084 -6.836 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -21.126 -11.308 -6.753 1.00 0.00 H new ATOM 365 N GLU A 24 -16.592 -10.559 -8.984 1.00 0.00 N ATOM 366 CA GLU A 24 -15.142 -10.467 -9.093 1.00 0.00 C ATOM 367 C GLU A 24 -14.624 -9.403 -8.140 1.00 0.00 C ATOM 368 O GLU A 24 -13.651 -9.602 -7.416 1.00 0.00 O ATOM 369 CB GLU A 24 -14.745 -10.086 -10.523 1.00 0.00 C ATOM 370 CG GLU A 24 -15.390 -10.948 -11.594 1.00 0.00 C ATOM 371 CD GLU A 24 -14.988 -10.530 -12.993 1.00 0.00 C ATOM 372 OE1 GLU A 24 -13.977 -11.052 -13.502 1.00 0.00 O ATOM 373 OE2 GLU A 24 -15.681 -9.685 -13.591 1.00 0.00 O ATOM 0 H GLU A 24 -17.089 -10.357 -9.852 1.00 0.00 H new ATOM 0 HA GLU A 24 -14.710 -11.435 -8.840 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -15.014 -9.044 -10.699 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -13.661 -10.156 -10.619 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -15.111 -11.990 -11.435 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -16.474 -10.891 -11.498 1.00 0.00 H new ATOM 380 N LYS A 25 -15.323 -8.280 -8.146 1.00 0.00 N ATOM 381 CA LYS A 25 -14.942 -7.104 -7.389 1.00 0.00 C ATOM 382 C LYS A 25 -14.966 -7.368 -5.887 1.00 0.00 C ATOM 383 O LYS A 25 -14.017 -7.029 -5.182 1.00 0.00 O ATOM 384 CB LYS A 25 -15.890 -5.968 -7.755 1.00 0.00 C ATOM 385 CG LYS A 25 -15.477 -4.609 -7.237 1.00 0.00 C ATOM 386 CD LYS A 25 -16.297 -3.521 -7.902 1.00 0.00 C ATOM 387 CE LYS A 25 -16.030 -3.458 -9.402 1.00 0.00 C ATOM 388 NZ LYS A 25 -16.842 -2.405 -10.065 1.00 0.00 N ATOM 0 H LYS A 25 -16.181 -8.160 -8.684 1.00 0.00 H new ATOM 0 HA LYS A 25 -13.917 -6.832 -7.642 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -15.973 -5.918 -8.841 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -16.882 -6.203 -7.370 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -15.613 -4.567 -6.156 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -14.417 -4.445 -7.431 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -17.357 -3.705 -7.727 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -16.062 -2.558 -7.449 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -14.972 -3.263 -9.575 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -16.253 -4.426 -9.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -16.313 -2.014 -10.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -17.734 -2.817 -10.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -17.048 -1.646 -9.385 1.00 0.00 H new ATOM 402 N ASN A 26 -16.047 -7.979 -5.407 1.00 0.00 N ATOM 403 CA ASN A 26 -16.185 -8.302 -3.987 1.00 0.00 C ATOM 404 C ASN A 26 -15.022 -9.161 -3.514 1.00 0.00 C ATOM 405 O ASN A 26 -14.440 -8.906 -2.459 1.00 0.00 O ATOM 406 CB ASN A 26 -17.503 -9.033 -3.705 1.00 0.00 C ATOM 407 CG ASN A 26 -18.725 -8.148 -3.871 1.00 0.00 C ATOM 408 OD1 ASN A 26 -18.657 -6.930 -3.703 1.00 0.00 O ATOM 409 ND2 ASN A 26 -19.857 -8.759 -4.188 1.00 0.00 N ATOM 0 H ASN A 26 -16.842 -8.261 -5.981 1.00 0.00 H new ATOM 0 HA ASN A 26 -16.184 -7.359 -3.440 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -17.588 -9.888 -4.376 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -17.483 -9.426 -2.689 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -20.714 -8.218 -4.301 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -19.871 -9.771 -4.319 1.00 0.00 H new ATOM 416 N ALA A 27 -14.681 -10.172 -4.309 1.00 0.00 N ATOM 417 CA ALA A 27 -13.571 -11.059 -3.984 1.00 0.00 C ATOM 418 C ALA A 27 -12.261 -10.283 -3.871 1.00 0.00 C ATOM 419 O ALA A 27 -11.475 -10.504 -2.946 1.00 0.00 O ATOM 420 CB ALA A 27 -13.450 -12.156 -5.033 1.00 0.00 C ATOM 0 H ALA A 27 -15.158 -10.396 -5.182 1.00 0.00 H new ATOM 0 HA ALA A 27 -13.774 -11.517 -3.016 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -12.617 -12.812 -4.779 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -14.373 -12.735 -5.062 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -13.273 -11.707 -6.010 1.00 0.00 H new ATOM 426 N VAL A 28 -12.039 -9.366 -4.808 1.00 0.00 N ATOM 427 CA VAL A 28 -10.824 -8.557 -4.826 1.00 0.00 C ATOM 428 C VAL A 28 -10.780 -7.605 -3.629 1.00 0.00 C ATOM 429 O VAL A 28 -9.742 -7.462 -2.978 1.00 0.00 O ATOM 430 CB VAL A 28 -10.705 -7.751 -6.143 1.00 0.00 C ATOM 431 CG1 VAL A 28 -9.463 -6.869 -6.139 1.00 0.00 C ATOM 432 CG2 VAL A 28 -10.677 -8.689 -7.339 1.00 0.00 C ATOM 0 H VAL A 28 -12.688 -9.164 -5.568 1.00 0.00 H new ATOM 0 HA VAL A 28 -9.978 -9.242 -4.761 1.00 0.00 H new ATOM 0 HB VAL A 28 -11.580 -7.105 -6.220 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -9.407 -6.316 -7.076 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -9.517 -6.168 -5.306 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -8.575 -7.492 -6.031 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -10.593 -8.106 -8.256 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -9.822 -9.360 -7.256 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -11.596 -9.274 -7.364 1.00 0.00 H new ATOM 442 N ILE A 29 -11.911 -6.972 -3.334 1.00 0.00 N ATOM 443 CA ILE A 29 -12.002 -6.035 -2.214 1.00 0.00 C ATOM 444 C ILE A 29 -11.673 -6.726 -0.890 1.00 0.00 C ATOM 445 O ILE A 29 -10.860 -6.230 -0.106 1.00 0.00 O ATOM 446 CB ILE A 29 -13.404 -5.386 -2.126 1.00 0.00 C ATOM 447 CG1 ILE A 29 -13.682 -4.551 -3.377 1.00 0.00 C ATOM 448 CG2 ILE A 29 -13.522 -4.519 -0.878 1.00 0.00 C ATOM 449 CD1 ILE A 29 -15.061 -3.925 -3.400 1.00 0.00 C ATOM 0 H ILE A 29 -12.780 -7.090 -3.855 1.00 0.00 H new ATOM 0 HA ILE A 29 -11.268 -5.250 -2.397 1.00 0.00 H new ATOM 0 HB ILE A 29 -14.145 -6.183 -2.062 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -12.934 -3.762 -3.449 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.565 -5.183 -4.258 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -14.516 -4.073 -0.837 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -13.363 -5.133 0.008 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -12.771 -3.729 -0.911 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -15.184 -3.349 -4.317 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -15.817 -4.709 -3.360 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -15.176 -3.266 -2.539 1.00 0.00 H new ATOM 461 N LYS A 30 -12.291 -7.877 -0.652 1.00 0.00 N ATOM 462 CA LYS A 30 -12.059 -8.619 0.582 1.00 0.00 C ATOM 463 C LYS A 30 -10.616 -9.109 0.654 1.00 0.00 C ATOM 464 O LYS A 30 -10.000 -9.096 1.720 1.00 0.00 O ATOM 465 CB LYS A 30 -13.030 -9.795 0.697 1.00 0.00 C ATOM 466 CG LYS A 30 -14.489 -9.370 0.786 1.00 0.00 C ATOM 467 CD LYS A 30 -15.441 -10.560 0.863 1.00 0.00 C ATOM 468 CE LYS A 30 -15.494 -11.189 2.254 1.00 0.00 C ATOM 469 NZ LYS A 30 -14.253 -11.935 2.605 1.00 0.00 N ATOM 0 H LYS A 30 -12.953 -8.315 -1.293 1.00 0.00 H new ATOM 0 HA LYS A 30 -12.235 -7.945 1.421 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -12.902 -10.448 -0.166 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -12.776 -10.381 1.580 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -14.628 -8.741 1.665 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -14.741 -8.763 -0.084 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -16.442 -10.237 0.577 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -15.131 -11.314 0.140 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -15.662 -10.407 2.994 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -16.346 -11.867 2.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -14.504 -12.802 3.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -13.742 -12.187 1.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -13.646 -11.338 3.203 1.00 0.00 H new ATOM 483 N ALA A 31 -10.071 -9.515 -0.491 1.00 0.00 N ATOM 484 CA ALA A 31 -8.688 -9.970 -0.559 1.00 0.00 C ATOM 485 C ALA A 31 -7.735 -8.850 -0.154 1.00 0.00 C ATOM 486 O ALA A 31 -6.739 -9.085 0.533 1.00 0.00 O ATOM 487 CB ALA A 31 -8.357 -10.470 -1.957 1.00 0.00 C ATOM 0 H ALA A 31 -10.567 -9.537 -1.382 1.00 0.00 H new ATOM 0 HA ALA A 31 -8.565 -10.797 0.140 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -7.320 -10.805 -1.988 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -9.015 -11.301 -2.211 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -8.498 -9.662 -2.675 1.00 0.00 H new ATOM 493 N ALA A 32 -8.061 -7.628 -0.569 1.00 0.00 N ATOM 494 CA ALA A 32 -7.264 -6.460 -0.217 1.00 0.00 C ATOM 495 C ALA A 32 -7.189 -6.297 1.298 1.00 0.00 C ATOM 496 O ALA A 32 -6.106 -6.128 1.859 1.00 0.00 O ATOM 497 CB ALA A 32 -7.838 -5.204 -0.857 1.00 0.00 C ATOM 0 H ALA A 32 -8.874 -7.423 -1.150 1.00 0.00 H new ATOM 0 HA ALA A 32 -6.254 -6.611 -0.599 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -7.228 -4.344 -0.581 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -7.839 -5.316 -1.941 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -8.859 -5.052 -0.507 1.00 0.00 H new ATOM 503 N TYR A 33 -8.338 -6.380 1.959 1.00 0.00 N ATOM 504 CA TYR A 33 -8.384 -6.266 3.414 1.00 0.00 C ATOM 505 C TYR A 33 -7.639 -7.425 4.072 1.00 0.00 C ATOM 506 O TYR A 33 -6.974 -7.243 5.092 1.00 0.00 O ATOM 507 CB TYR A 33 -9.831 -6.222 3.918 1.00 0.00 C ATOM 508 CG TYR A 33 -10.594 -4.992 3.486 1.00 0.00 C ATOM 509 CD1 TYR A 33 -10.123 -3.719 3.783 1.00 0.00 C ATOM 510 CD2 TYR A 33 -11.788 -5.102 2.788 1.00 0.00 C ATOM 511 CE1 TYR A 33 -10.820 -2.593 3.394 1.00 0.00 C ATOM 512 CE2 TYR A 33 -12.491 -3.981 2.395 1.00 0.00 C ATOM 513 CZ TYR A 33 -12.002 -2.729 2.700 1.00 0.00 C ATOM 514 OH TYR A 33 -12.697 -1.611 2.307 1.00 0.00 O ATOM 0 H TYR A 33 -9.245 -6.525 1.515 1.00 0.00 H new ATOM 0 HA TYR A 33 -7.893 -5.332 3.688 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -10.357 -7.107 3.561 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -9.827 -6.271 5.007 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -9.197 -3.609 4.327 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -12.174 -6.082 2.548 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -10.441 -1.610 3.633 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -13.419 -4.084 1.852 1.00 0.00 H new ATOM 0 HH TYR A 33 -12.118 -0.824 2.380 1.00 0.00 H new ATOM 524 N ARG A 34 -7.732 -8.606 3.473 1.00 0.00 N ATOM 525 CA ARG A 34 -7.085 -9.795 4.023 1.00 0.00 C ATOM 526 C ARG A 34 -5.578 -9.785 3.785 1.00 0.00 C ATOM 527 O ARG A 34 -4.856 -10.635 4.313 1.00 0.00 O ATOM 528 CB ARG A 34 -7.689 -11.067 3.440 1.00 0.00 C ATOM 529 CG ARG A 34 -9.132 -11.296 3.851 1.00 0.00 C ATOM 530 CD ARG A 34 -9.615 -12.675 3.445 1.00 0.00 C ATOM 531 NE ARG A 34 -8.820 -13.733 4.068 1.00 0.00 N ATOM 532 CZ ARG A 34 -9.277 -14.549 5.013 1.00 0.00 C ATOM 533 NH1 ARG A 34 -10.508 -14.403 5.485 1.00 0.00 N ATOM 534 NH2 ARG A 34 -8.488 -15.504 5.496 1.00 0.00 N ATOM 0 H ARG A 34 -8.248 -8.768 2.608 1.00 0.00 H new ATOM 0 HA ARG A 34 -7.260 -9.778 5.099 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -7.632 -11.021 2.352 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -7.090 -11.922 3.755 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -9.226 -11.180 4.931 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -9.767 -10.538 3.392 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -10.661 -12.792 3.728 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -9.565 -12.773 2.361 1.00 0.00 H new ATOM 0 HE ARG A 34 -7.855 -13.852 3.758 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -11.108 -13.662 5.123 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -10.854 -15.032 6.210 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -7.537 -15.608 5.142 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -8.833 -16.133 6.221 1.00 0.00 H new ATOM 548 N GLN A 35 -5.099 -8.847 2.982 1.00 0.00 N ATOM 549 CA GLN A 35 -3.662 -8.676 2.819 1.00 0.00 C ATOM 550 C GLN A 35 -3.166 -7.454 3.581 1.00 0.00 C ATOM 551 O GLN A 35 -2.145 -7.517 4.263 1.00 0.00 O ATOM 552 CB GLN A 35 -3.275 -8.563 1.346 1.00 0.00 C ATOM 553 CG GLN A 35 -3.594 -9.807 0.537 1.00 0.00 C ATOM 554 CD GLN A 35 -2.633 -9.997 -0.615 1.00 0.00 C ATOM 555 OE1 GLN A 35 -1.460 -9.651 -0.516 1.00 0.00 O ATOM 556 NE2 GLN A 35 -3.120 -10.548 -1.716 1.00 0.00 N ATOM 0 H GLN A 35 -5.673 -8.201 2.440 1.00 0.00 H new ATOM 0 HA GLN A 35 -3.185 -9.565 3.232 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -3.794 -7.711 0.907 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -2.207 -8.357 1.274 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -3.558 -10.681 1.187 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -4.612 -9.738 0.152 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -4.102 -10.822 -1.758 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -2.514 -10.699 -2.522 1.00 0.00 H new ATOM 565 N ILE A 36 -3.892 -6.346 3.477 1.00 0.00 N ATOM 566 CA ILE A 36 -3.497 -5.110 4.146 1.00 0.00 C ATOM 567 C ILE A 36 -3.639 -5.236 5.660 1.00 0.00 C ATOM 568 O ILE A 36 -2.689 -4.990 6.401 1.00 0.00 O ATOM 569 CB ILE A 36 -4.314 -3.896 3.644 1.00 0.00 C ATOM 570 CG1 ILE A 36 -4.106 -3.698 2.137 1.00 0.00 C ATOM 571 CG2 ILE A 36 -3.926 -2.633 4.405 1.00 0.00 C ATOM 572 CD1 ILE A 36 -2.657 -3.497 1.740 1.00 0.00 C ATOM 0 H ILE A 36 -4.755 -6.278 2.938 1.00 0.00 H new ATOM 0 HA ILE A 36 -2.449 -4.940 3.900 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.370 -4.095 3.827 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.501 -4.566 1.608 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.686 -2.835 1.810 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.512 -1.791 4.036 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.122 -2.774 5.468 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.866 -2.430 4.256 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.591 -3.364 0.660 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -2.262 -2.612 2.240 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.075 -4.370 2.034 1.00 0.00 H new ATOM 584 N PHE A 37 -4.818 -5.630 6.114 1.00 0.00 N ATOM 585 CA PHE A 37 -5.061 -5.811 7.541 1.00 0.00 C ATOM 586 C PHE A 37 -4.958 -7.287 7.900 1.00 0.00 C ATOM 587 O PHE A 37 -5.033 -7.669 9.068 1.00 0.00 O ATOM 588 CB PHE A 37 -6.438 -5.264 7.926 1.00 0.00 C ATOM 589 CG PHE A 37 -6.620 -3.810 7.593 1.00 0.00 C ATOM 590 CD1 PHE A 37 -6.055 -2.825 8.388 1.00 0.00 C ATOM 591 CD2 PHE A 37 -7.353 -3.427 6.481 1.00 0.00 C ATOM 592 CE1 PHE A 37 -6.219 -1.486 8.081 1.00 0.00 C ATOM 593 CE2 PHE A 37 -7.521 -2.091 6.169 1.00 0.00 C ATOM 594 CZ PHE A 37 -6.953 -1.119 6.969 1.00 0.00 C ATOM 0 H PHE A 37 -5.622 -5.831 5.519 1.00 0.00 H new ATOM 0 HA PHE A 37 -4.306 -5.257 8.098 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.206 -5.844 7.415 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -6.590 -5.405 8.996 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -5.480 -3.106 9.258 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -7.799 -4.182 5.850 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -5.774 -0.729 8.709 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -8.096 -1.807 5.300 1.00 0.00 H new ATOM 0 HZ PHE A 37 -7.082 -0.075 6.726 1.00 0.00 H new ATOM 604 N GLU A 38 -4.799 -8.106 6.861 1.00 0.00 N ATOM 605 CA GLU A 38 -4.651 -9.553 6.995 1.00 0.00 C ATOM 606 C GLU A 38 -5.867 -10.192 7.661 1.00 0.00 C ATOM 607 O GLU A 38 -5.755 -11.244 8.297 1.00 0.00 O ATOM 608 CB GLU A 38 -3.369 -9.904 7.752 1.00 0.00 C ATOM 609 CG GLU A 38 -2.104 -9.601 6.962 1.00 0.00 C ATOM 610 CD GLU A 38 -0.865 -10.212 7.583 1.00 0.00 C ATOM 611 OE1 GLU A 38 -0.926 -11.382 8.012 1.00 0.00 O ATOM 612 OE2 GLU A 38 0.186 -9.540 7.618 1.00 0.00 O ATOM 0 H GLU A 38 -4.769 -7.780 5.895 1.00 0.00 H new ATOM 0 HA GLU A 38 -4.579 -9.964 5.988 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -3.345 -9.349 8.690 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -3.385 -10.963 8.008 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.218 -9.976 5.945 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.975 -8.521 6.891 1.00 0.00 H new ATOM 720 N TYR A 45 -14.822 -0.959 10.260 1.00 0.00 N ATOM 721 CA TYR A 45 -14.191 -0.185 11.340 1.00 0.00 C ATOM 722 C TYR A 45 -14.554 1.303 11.288 1.00 0.00 C ATOM 723 O TYR A 45 -15.105 1.846 12.246 1.00 0.00 O ATOM 724 CB TYR A 45 -12.665 -0.352 11.327 1.00 0.00 C ATOM 725 CG TYR A 45 -12.165 -1.470 12.214 1.00 0.00 C ATOM 726 CD1 TYR A 45 -12.496 -2.796 11.961 1.00 0.00 C ATOM 727 CD2 TYR A 45 -11.366 -1.192 13.315 1.00 0.00 C ATOM 728 CE1 TYR A 45 -12.041 -3.812 12.780 1.00 0.00 C ATOM 729 CE2 TYR A 45 -10.909 -2.201 14.139 1.00 0.00 C ATOM 730 CZ TYR A 45 -11.248 -3.508 13.868 1.00 0.00 C ATOM 731 OH TYR A 45 -10.795 -4.515 14.692 1.00 0.00 O ATOM 0 HA TYR A 45 -14.585 -0.588 12.273 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -12.338 -0.539 10.304 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -12.204 0.584 11.643 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -13.118 -3.036 11.112 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -11.097 -0.168 13.531 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -12.304 -4.838 12.570 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -10.289 -1.967 14.992 1.00 0.00 H new ATOM 0 HH TYR A 45 -10.249 -4.130 15.409 1.00 0.00 H new ATOM 741 N SER A 46 -14.237 1.953 10.181 1.00 0.00 N ATOM 742 CA SER A 46 -14.457 3.380 10.028 1.00 0.00 C ATOM 743 C SER A 46 -15.241 3.659 8.749 1.00 0.00 C ATOM 744 O SER A 46 -15.097 2.946 7.755 1.00 0.00 O ATOM 745 CB SER A 46 -13.105 4.101 10.005 1.00 0.00 C ATOM 746 OG SER A 46 -13.254 5.506 9.868 1.00 0.00 O ATOM 0 H SER A 46 -13.820 1.506 9.364 1.00 0.00 H new ATOM 0 HA SER A 46 -15.042 3.751 10.870 1.00 0.00 H new ATOM 0 HB2 SER A 46 -12.562 3.882 10.924 1.00 0.00 H new ATOM 0 HB3 SER A 46 -12.504 3.718 9.180 1.00 0.00 H new ATOM 0 HG SER A 46 -12.370 5.929 9.859 1.00 0.00 H new ATOM 752 N GLN A 47 -16.067 4.697 8.776 1.00 0.00 N ATOM 753 CA GLN A 47 -16.879 5.062 7.621 1.00 0.00 C ATOM 754 C GLN A 47 -16.002 5.558 6.488 1.00 0.00 C ATOM 755 O GLN A 47 -16.345 5.426 5.313 1.00 0.00 O ATOM 756 CB GLN A 47 -17.898 6.133 7.994 1.00 0.00 C ATOM 757 CG GLN A 47 -19.106 5.603 8.741 1.00 0.00 C ATOM 758 CD GLN A 47 -18.772 5.027 10.105 1.00 0.00 C ATOM 759 OE1 GLN A 47 -18.751 5.745 11.102 1.00 0.00 O ATOM 760 NE2 GLN A 47 -18.527 3.726 10.164 1.00 0.00 N ATOM 0 H GLN A 47 -16.193 5.303 9.587 1.00 0.00 H new ATOM 0 HA GLN A 47 -17.413 4.171 7.290 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -17.407 6.889 8.608 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -18.236 6.631 7.085 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -19.829 6.409 8.863 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -19.586 4.832 8.138 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -18.554 3.163 9.314 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -18.312 3.288 11.059 1.00 0.00 H new ATOM 769 N SER A 48 -14.871 6.134 6.858 1.00 0.00 N ATOM 770 CA SER A 48 -13.879 6.575 5.899 1.00 0.00 C ATOM 771 C SER A 48 -13.431 5.406 5.023 1.00 0.00 C ATOM 772 O SER A 48 -13.227 5.556 3.819 1.00 0.00 O ATOM 773 CB SER A 48 -12.695 7.164 6.656 1.00 0.00 C ATOM 774 OG SER A 48 -13.106 8.233 7.496 1.00 0.00 O ATOM 0 H SER A 48 -14.617 6.308 7.830 1.00 0.00 H new ATOM 0 HA SER A 48 -14.308 7.336 5.247 1.00 0.00 H new ATOM 0 HB2 SER A 48 -12.220 6.388 7.256 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.947 7.521 5.947 1.00 0.00 H new ATOM 0 HG SER A 48 -12.328 8.593 7.972 1.00 0.00 H new ATOM 780 N ILE A 49 -13.326 4.231 5.636 1.00 0.00 N ATOM 781 CA ILE A 49 -12.928 3.027 4.923 1.00 0.00 C ATOM 782 C ILE A 49 -14.022 2.610 3.945 1.00 0.00 C ATOM 783 O ILE A 49 -13.741 2.235 2.809 1.00 0.00 O ATOM 784 CB ILE A 49 -12.633 1.864 5.901 1.00 0.00 C ATOM 785 CG1 ILE A 49 -11.544 2.268 6.908 1.00 0.00 C ATOM 786 CG2 ILE A 49 -12.222 0.607 5.139 1.00 0.00 C ATOM 787 CD1 ILE A 49 -10.222 2.635 6.268 1.00 0.00 C ATOM 0 H ILE A 49 -13.512 4.089 6.629 1.00 0.00 H new ATOM 0 HA ILE A 49 -12.014 3.252 4.374 1.00 0.00 H new ATOM 0 HB ILE A 49 -13.546 1.643 6.453 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -11.901 3.115 7.493 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -11.383 1.445 7.604 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -12.020 -0.197 5.846 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -13.028 0.307 4.470 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -11.324 0.812 4.556 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -9.506 2.908 7.043 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -9.841 1.782 5.706 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -10.366 3.479 5.594 1.00 0.00 H new ATOM 799 N SER A 50 -15.272 2.703 4.383 1.00 0.00 N ATOM 800 CA SER A 50 -16.407 2.389 3.527 1.00 0.00 C ATOM 801 C SER A 50 -16.439 3.310 2.308 1.00 0.00 C ATOM 802 O SER A 50 -16.802 2.892 1.208 1.00 0.00 O ATOM 803 CB SER A 50 -17.711 2.507 4.314 1.00 0.00 C ATOM 804 OG SER A 50 -17.732 1.592 5.396 1.00 0.00 O ATOM 0 H SER A 50 -15.524 2.994 5.328 1.00 0.00 H new ATOM 0 HA SER A 50 -16.298 1.362 3.177 1.00 0.00 H new ATOM 0 HB2 SER A 50 -17.823 3.524 4.690 1.00 0.00 H new ATOM 0 HB3 SER A 50 -18.557 2.316 3.654 1.00 0.00 H new ATOM 0 HG SER A 50 -18.575 1.686 5.887 1.00 0.00 H new ATOM 810 N TYR A 51 -16.041 4.560 2.506 1.00 0.00 N ATOM 811 CA TYR A 51 -15.983 5.514 1.412 1.00 0.00 C ATOM 812 C TYR A 51 -14.852 5.147 0.455 1.00 0.00 C ATOM 813 O TYR A 51 -15.013 5.212 -0.763 1.00 0.00 O ATOM 814 CB TYR A 51 -15.797 6.936 1.950 1.00 0.00 C ATOM 815 CG TYR A 51 -15.946 8.004 0.893 1.00 0.00 C ATOM 816 CD1 TYR A 51 -17.171 8.225 0.278 1.00 0.00 C ATOM 817 CD2 TYR A 51 -14.865 8.785 0.504 1.00 0.00 C ATOM 818 CE1 TYR A 51 -17.316 9.195 -0.693 1.00 0.00 C ATOM 819 CE2 TYR A 51 -15.002 9.758 -0.468 1.00 0.00 C ATOM 820 CZ TYR A 51 -16.230 9.957 -1.063 1.00 0.00 C ATOM 821 OH TYR A 51 -16.372 10.925 -2.030 1.00 0.00 O ATOM 0 H TYR A 51 -15.755 4.934 3.411 1.00 0.00 H new ATOM 0 HA TYR A 51 -16.925 5.478 0.865 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -16.525 7.115 2.741 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -14.809 7.019 2.402 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -18.024 7.628 0.564 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -13.902 8.629 0.968 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -18.276 9.356 -1.160 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -14.153 10.358 -0.760 1.00 0.00 H new ATOM 0 HH TYR A 51 -15.512 11.373 -2.173 1.00 0.00 H new ATOM 831 N LEU A 52 -13.715 4.751 1.015 1.00 0.00 N ATOM 832 CA LEU A 52 -12.591 4.277 0.213 1.00 0.00 C ATOM 833 C LEU A 52 -12.989 3.029 -0.569 1.00 0.00 C ATOM 834 O LEU A 52 -12.670 2.900 -1.755 1.00 0.00 O ATOM 835 CB LEU A 52 -11.383 3.974 1.103 1.00 0.00 C ATOM 836 CG LEU A 52 -10.795 5.180 1.841 1.00 0.00 C ATOM 837 CD1 LEU A 52 -9.657 4.747 2.754 1.00 0.00 C ATOM 838 CD2 LEU A 52 -10.312 6.230 0.851 1.00 0.00 C ATOM 0 H LEU A 52 -13.546 4.748 2.021 1.00 0.00 H new ATOM 0 HA LEU A 52 -12.316 5.063 -0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -11.674 3.225 1.839 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -10.601 3.529 0.487 1.00 0.00 H new ATOM 0 HG LEU A 52 -11.580 5.621 2.455 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -9.252 5.618 3.269 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -10.031 4.033 3.487 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.872 4.280 2.160 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -9.898 7.079 1.394 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -9.543 5.799 0.210 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -11.149 6.565 0.238 1.00 0.00 H new ATOM 850 N GLU A 53 -13.693 2.123 0.107 1.00 0.00 N ATOM 851 CA GLU A 53 -14.213 0.914 -0.519 1.00 0.00 C ATOM 852 C GLU A 53 -15.080 1.271 -1.718 1.00 0.00 C ATOM 853 O GLU A 53 -14.935 0.701 -2.793 1.00 0.00 O ATOM 854 CB GLU A 53 -15.044 0.108 0.485 1.00 0.00 C ATOM 855 CG GLU A 53 -15.535 -1.228 -0.055 1.00 0.00 C ATOM 856 CD GLU A 53 -16.663 -1.813 0.770 1.00 0.00 C ATOM 857 OE1 GLU A 53 -16.447 -2.108 1.963 1.00 0.00 O ATOM 858 OE2 GLU A 53 -17.784 -1.959 0.231 1.00 0.00 O ATOM 0 H GLU A 53 -13.917 2.207 1.099 1.00 0.00 H new ATOM 0 HA GLU A 53 -13.368 0.312 -0.851 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -14.445 -0.070 1.378 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -15.904 0.703 0.791 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -15.872 -1.098 -1.083 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -14.704 -1.933 -0.079 1.00 0.00 H new ATOM 865 N SER A 54 -15.972 2.233 -1.522 1.00 0.00 N ATOM 866 CA SER A 54 -16.891 2.660 -2.566 1.00 0.00 C ATOM 867 C SER A 54 -16.136 3.211 -3.777 1.00 0.00 C ATOM 868 O SER A 54 -16.508 2.950 -4.922 1.00 0.00 O ATOM 869 CB SER A 54 -17.853 3.716 -2.013 1.00 0.00 C ATOM 870 OG SER A 54 -18.836 4.073 -2.969 1.00 0.00 O ATOM 0 H SER A 54 -16.078 2.736 -0.641 1.00 0.00 H new ATOM 0 HA SER A 54 -17.462 1.792 -2.895 1.00 0.00 H new ATOM 0 HB2 SER A 54 -18.339 3.333 -1.115 1.00 0.00 H new ATOM 0 HB3 SER A 54 -17.292 4.603 -1.718 1.00 0.00 H new ATOM 0 HG SER A 54 -19.435 4.747 -2.586 1.00 0.00 H new ATOM 876 N GLN A 55 -15.066 3.955 -3.523 1.00 0.00 N ATOM 877 CA GLN A 55 -14.286 4.563 -4.597 1.00 0.00 C ATOM 878 C GLN A 55 -13.599 3.505 -5.455 1.00 0.00 C ATOM 879 O GLN A 55 -13.654 3.560 -6.683 1.00 0.00 O ATOM 880 CB GLN A 55 -13.256 5.540 -4.031 1.00 0.00 C ATOM 881 CG GLN A 55 -13.885 6.738 -3.339 1.00 0.00 C ATOM 882 CD GLN A 55 -12.864 7.755 -2.877 1.00 0.00 C ATOM 883 OE1 GLN A 55 -12.390 7.599 -1.652 1.00 0.00 O flip ATOM 884 NE2 GLN A 55 -12.511 8.676 -3.613 1.00 0.00 N flip ATOM 0 H GLN A 55 -14.718 4.152 -2.585 1.00 0.00 H new ATOM 0 HA GLN A 55 -14.977 5.115 -5.234 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -12.616 5.014 -3.322 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -12.615 5.891 -4.840 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -14.586 7.219 -4.022 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -14.462 6.394 -2.480 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -12.903 8.758 -4.551 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -11.827 9.357 -3.285 1.00 0.00 H new ATOM 893 N VAL A 56 -12.964 2.530 -4.814 1.00 0.00 N ATOM 894 CA VAL A 56 -12.298 1.459 -5.551 1.00 0.00 C ATOM 895 C VAL A 56 -13.338 0.503 -6.143 1.00 0.00 C ATOM 896 O VAL A 56 -13.094 -0.164 -7.146 1.00 0.00 O ATOM 897 CB VAL A 56 -11.291 0.689 -4.661 1.00 0.00 C ATOM 898 CG1 VAL A 56 -12.002 -0.151 -3.610 1.00 0.00 C ATOM 899 CG2 VAL A 56 -10.365 -0.171 -5.509 1.00 0.00 C ATOM 0 H VAL A 56 -12.896 2.457 -3.799 1.00 0.00 H new ATOM 0 HA VAL A 56 -11.730 1.914 -6.363 1.00 0.00 H new ATOM 0 HB VAL A 56 -10.685 1.427 -4.136 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.264 -0.677 -3.004 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -12.601 0.497 -2.970 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -12.651 -0.876 -4.102 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.667 -0.702 -4.862 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -10.955 -0.892 -6.075 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -9.809 0.464 -6.199 1.00 0.00 H new ATOM 909 N ARG A 57 -14.514 0.474 -5.526 1.00 0.00 N ATOM 910 CA ARG A 57 -15.628 -0.335 -6.004 1.00 0.00 C ATOM 911 C ARG A 57 -16.177 0.215 -7.317 1.00 0.00 C ATOM 912 O ARG A 57 -16.630 -0.535 -8.176 1.00 0.00 O ATOM 913 CB ARG A 57 -16.725 -0.372 -4.936 1.00 0.00 C ATOM 914 CG ARG A 57 -18.023 -1.026 -5.376 1.00 0.00 C ATOM 915 CD ARG A 57 -19.030 -1.034 -4.239 1.00 0.00 C ATOM 916 NE ARG A 57 -20.375 -1.382 -4.688 1.00 0.00 N ATOM 917 CZ ARG A 57 -21.452 -1.318 -3.906 1.00 0.00 C ATOM 918 NH1 ARG A 57 -21.332 -0.939 -2.638 1.00 0.00 N ATOM 919 NH2 ARG A 57 -22.647 -1.627 -4.393 1.00 0.00 N ATOM 0 H ARG A 57 -14.721 1.009 -4.683 1.00 0.00 H new ATOM 0 HA ARG A 57 -15.274 -1.349 -6.191 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -16.345 -0.903 -4.064 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -16.938 0.649 -4.619 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -18.435 -0.489 -6.230 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -17.829 -2.047 -5.704 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -18.709 -1.745 -3.478 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -19.050 -0.051 -3.768 1.00 0.00 H new ATOM 0 HE ARG A 57 -20.497 -1.691 -5.652 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -20.415 -0.697 -2.263 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -22.157 -0.890 -2.040 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -22.742 -1.914 -5.367 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -23.471 -1.578 -3.793 1.00 0.00 H new ATOM 933 N ASN A 58 -16.137 1.526 -7.477 1.00 0.00 N ATOM 934 CA ASN A 58 -16.602 2.146 -8.711 1.00 0.00 C ATOM 935 C ASN A 58 -15.454 2.306 -9.698 1.00 0.00 C ATOM 936 O ASN A 58 -15.639 2.812 -10.807 1.00 0.00 O ATOM 937 CB ASN A 58 -17.256 3.499 -8.428 1.00 0.00 C ATOM 938 CG ASN A 58 -18.636 3.358 -7.813 1.00 0.00 C ATOM 939 OD1 ASN A 58 -19.639 3.270 -8.525 1.00 0.00 O ATOM 940 ND2 ASN A 58 -18.703 3.339 -6.491 1.00 0.00 N ATOM 0 H ASN A 58 -15.791 2.180 -6.775 1.00 0.00 H new ATOM 0 HA ASN A 58 -17.351 1.491 -9.156 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -16.619 4.074 -7.756 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -17.331 4.064 -9.357 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -19.607 3.249 -6.027 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -17.851 3.414 -5.936 1.00 0.00 H new ATOM 947 N GLY A 59 -14.271 1.863 -9.287 1.00 0.00 N ATOM 948 CA GLY A 59 -13.104 1.933 -10.147 1.00 0.00 C ATOM 949 C GLY A 59 -12.605 3.351 -10.323 1.00 0.00 C ATOM 950 O GLY A 59 -11.938 3.665 -11.310 1.00 0.00 O ATOM 0 H GLY A 59 -14.099 1.454 -8.368 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.308 1.320 -9.726 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.348 1.512 -11.122 1.00 0.00 H new ATOM 954 N ASP A 60 -12.928 4.208 -9.364 1.00 0.00 N ATOM 955 CA ASP A 60 -12.521 5.606 -9.420 1.00 0.00 C ATOM 956 C ASP A 60 -11.051 5.731 -9.043 1.00 0.00 C ATOM 957 O ASP A 60 -10.323 6.561 -9.587 1.00 0.00 O ATOM 958 CB ASP A 60 -13.394 6.450 -8.489 1.00 0.00 C ATOM 959 CG ASP A 60 -13.153 7.941 -8.637 1.00 0.00 C ATOM 960 OD1 ASP A 60 -13.557 8.516 -9.672 1.00 0.00 O ATOM 961 OD2 ASP A 60 -12.582 8.549 -7.711 1.00 0.00 O ATOM 0 H ASP A 60 -13.471 3.960 -8.537 1.00 0.00 H new ATOM 0 HA ASP A 60 -12.652 5.976 -10.437 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -14.443 6.236 -8.691 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -13.202 6.158 -7.457 1.00 0.00 H new ATOM 966 N ILE A 61 -10.617 4.875 -8.128 1.00 0.00 N ATOM 967 CA ILE A 61 -9.219 4.820 -7.729 1.00 0.00 C ATOM 968 C ILE A 61 -8.673 3.407 -7.923 1.00 0.00 C ATOM 969 O ILE A 61 -9.402 2.426 -7.765 1.00 0.00 O ATOM 970 CB ILE A 61 -9.012 5.248 -6.257 1.00 0.00 C ATOM 971 CG1 ILE A 61 -9.838 4.367 -5.310 1.00 0.00 C ATOM 972 CG2 ILE A 61 -9.370 6.718 -6.077 1.00 0.00 C ATOM 973 CD1 ILE A 61 -9.567 4.627 -3.842 1.00 0.00 C ATOM 0 H ILE A 61 -11.218 4.206 -7.646 1.00 0.00 H new ATOM 0 HA ILE A 61 -8.678 5.523 -8.363 1.00 0.00 H new ATOM 0 HB ILE A 61 -7.960 5.116 -6.006 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -10.897 4.530 -5.509 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -9.630 3.320 -5.529 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -9.219 7.004 -5.036 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -8.733 7.329 -6.717 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -10.414 6.874 -6.349 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -10.187 3.967 -3.235 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -8.516 4.436 -3.627 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -9.803 5.665 -3.607 1.00 0.00 H new ATOM 985 N SER A 62 -7.400 3.314 -8.284 1.00 0.00 N ATOM 986 CA SER A 62 -6.744 2.028 -8.485 1.00 0.00 C ATOM 987 C SER A 62 -6.453 1.350 -7.148 1.00 0.00 C ATOM 988 O SER A 62 -6.591 1.966 -6.087 1.00 0.00 O ATOM 989 CB SER A 62 -5.440 2.230 -9.261 1.00 0.00 C ATOM 990 OG SER A 62 -4.591 3.163 -8.605 1.00 0.00 O ATOM 0 H SER A 62 -6.797 4.121 -8.445 1.00 0.00 H new ATOM 0 HA SER A 62 -7.413 1.384 -9.057 1.00 0.00 H new ATOM 0 HB2 SER A 62 -4.924 1.276 -9.365 1.00 0.00 H new ATOM 0 HB3 SER A 62 -5.664 2.583 -10.268 1.00 0.00 H new ATOM 0 HG SER A 62 -3.765 3.272 -9.121 1.00 0.00 H new ATOM 996 N MET A 63 -6.038 0.089 -7.195 1.00 0.00 N ATOM 997 CA MET A 63 -5.677 -0.629 -5.979 1.00 0.00 C ATOM 998 C MET A 63 -4.432 -0.024 -5.349 1.00 0.00 C ATOM 999 O MET A 63 -4.292 -0.010 -4.126 1.00 0.00 O ATOM 1000 CB MET A 63 -5.462 -2.116 -6.256 1.00 0.00 C ATOM 1001 CG MET A 63 -6.705 -2.952 -6.006 1.00 0.00 C ATOM 1002 SD MET A 63 -7.296 -2.791 -4.306 1.00 0.00 S ATOM 1003 CE MET A 63 -8.777 -3.795 -4.351 1.00 0.00 C ATOM 0 H MET A 63 -5.944 -0.453 -8.054 1.00 0.00 H new ATOM 0 HA MET A 63 -6.506 -0.532 -5.278 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.146 -2.245 -7.291 1.00 0.00 H new ATOM 0 HB3 MET A 63 -4.651 -2.484 -5.627 1.00 0.00 H new ATOM 0 HG2 MET A 63 -7.493 -2.646 -6.694 1.00 0.00 H new ATOM 0 HG3 MET A 63 -6.487 -3.999 -6.217 1.00 0.00 H new ATOM 0 HE1 MET A 63 -9.594 -3.261 -3.866 1.00 0.00 H new ATOM 0 HE2 MET A 63 -9.044 -4.003 -5.387 1.00 0.00 H new ATOM 0 HE3 MET A 63 -8.596 -4.734 -3.828 1.00 0.00 H new ATOM 1013 N LYS A 64 -3.536 0.488 -6.189 1.00 0.00 N ATOM 1014 CA LYS A 64 -2.360 1.203 -5.708 1.00 0.00 C ATOM 1015 C LYS A 64 -2.800 2.374 -4.834 1.00 0.00 C ATOM 1016 O LYS A 64 -2.258 2.603 -3.753 1.00 0.00 O ATOM 1017 CB LYS A 64 -1.527 1.727 -6.881 1.00 0.00 C ATOM 1018 CG LYS A 64 -0.160 2.253 -6.468 1.00 0.00 C ATOM 1019 CD LYS A 64 0.393 3.256 -7.470 1.00 0.00 C ATOM 1020 CE LYS A 64 -0.400 4.550 -7.439 1.00 0.00 C ATOM 1021 NZ LYS A 64 0.061 5.518 -8.469 1.00 0.00 N ATOM 0 H LYS A 64 -3.603 0.421 -7.205 1.00 0.00 H new ATOM 0 HA LYS A 64 -1.747 0.514 -5.126 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -1.395 0.926 -7.609 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -2.078 2.524 -7.380 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -0.234 2.724 -5.488 1.00 0.00 H new ATOM 0 HG3 LYS A 64 0.535 1.419 -6.370 1.00 0.00 H new ATOM 0 HD2 LYS A 64 1.440 3.461 -7.245 1.00 0.00 H new ATOM 0 HD3 LYS A 64 0.361 2.829 -8.473 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -1.456 4.330 -7.596 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -0.313 5.004 -6.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -0.761 5.906 -8.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 0.582 6.292 -8.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 0.685 5.034 -9.146 1.00 0.00 H new ATOM 1035 N GLU A 65 -3.807 3.102 -5.307 1.00 0.00 N ATOM 1036 CA GLU A 65 -4.359 4.219 -4.557 1.00 0.00 C ATOM 1037 C GLU A 65 -5.034 3.739 -3.289 1.00 0.00 C ATOM 1038 O GLU A 65 -4.807 4.295 -2.217 1.00 0.00 O ATOM 1039 CB GLU A 65 -5.354 5.005 -5.405 1.00 0.00 C ATOM 1040 CG GLU A 65 -4.683 5.854 -6.464 1.00 0.00 C ATOM 1041 CD GLU A 65 -3.643 6.768 -5.863 1.00 0.00 C ATOM 1042 OE1 GLU A 65 -2.483 6.336 -5.728 1.00 0.00 O ATOM 1043 OE2 GLU A 65 -3.985 7.916 -5.504 1.00 0.00 O ATOM 0 H GLU A 65 -4.256 2.936 -6.208 1.00 0.00 H new ATOM 0 HA GLU A 65 -3.532 4.875 -4.287 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -6.043 4.310 -5.886 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -5.950 5.646 -4.756 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -4.215 5.208 -7.207 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.434 6.448 -6.985 1.00 0.00 H new ATOM 1050 N PHE A 66 -5.853 2.702 -3.419 1.00 0.00 N ATOM 1051 CA PHE A 66 -6.573 2.136 -2.285 1.00 0.00 C ATOM 1052 C PHE A 66 -5.603 1.776 -1.161 1.00 0.00 C ATOM 1053 O PHE A 66 -5.816 2.139 -0.005 1.00 0.00 O ATOM 1054 CB PHE A 66 -7.369 0.907 -2.735 1.00 0.00 C ATOM 1055 CG PHE A 66 -8.302 0.361 -1.690 1.00 0.00 C ATOM 1056 CD1 PHE A 66 -9.324 1.147 -1.178 1.00 0.00 C ATOM 1057 CD2 PHE A 66 -8.167 -0.938 -1.231 1.00 0.00 C ATOM 1058 CE1 PHE A 66 -10.192 0.645 -0.227 1.00 0.00 C ATOM 1059 CE2 PHE A 66 -9.030 -1.445 -0.278 1.00 0.00 C ATOM 1060 CZ PHE A 66 -10.044 -0.653 0.224 1.00 0.00 C ATOM 0 H PHE A 66 -6.036 2.233 -4.306 1.00 0.00 H new ATOM 0 HA PHE A 66 -7.271 2.880 -1.900 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -7.947 1.167 -3.622 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -6.671 0.123 -3.028 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -9.443 2.162 -1.526 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -7.378 -1.563 -1.622 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -10.985 1.266 0.163 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -8.912 -2.459 0.074 1.00 0.00 H new ATOM 0 HZ PHE A 66 -10.720 -1.047 0.968 1.00 0.00 H new ATOM 1070 N VAL A 67 -4.519 1.096 -1.518 1.00 0.00 N ATOM 1071 CA VAL A 67 -3.493 0.724 -0.551 1.00 0.00 C ATOM 1072 C VAL A 67 -2.835 1.962 0.056 1.00 0.00 C ATOM 1073 O VAL A 67 -2.601 2.019 1.265 1.00 0.00 O ATOM 1074 CB VAL A 67 -2.412 -0.180 -1.191 1.00 0.00 C ATOM 1075 CG1 VAL A 67 -1.285 -0.468 -0.208 1.00 0.00 C ATOM 1076 CG2 VAL A 67 -3.030 -1.480 -1.680 1.00 0.00 C ATOM 0 H VAL A 67 -4.328 0.791 -2.472 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.989 0.163 0.241 1.00 0.00 H new ATOM 0 HB VAL A 67 -1.990 0.352 -2.044 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -0.540 -1.105 -0.685 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -0.819 0.469 0.096 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -1.688 -0.975 0.669 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -2.257 -2.105 -2.127 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -3.481 -2.007 -0.839 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -3.796 -1.261 -2.424 1.00 0.00 H new ATOM 1086 N ARG A 68 -2.556 2.962 -0.782 1.00 0.00 N ATOM 1087 CA ARG A 68 -1.913 4.190 -0.317 1.00 0.00 C ATOM 1088 C ARG A 68 -2.788 4.888 0.723 1.00 0.00 C ATOM 1089 O ARG A 68 -2.287 5.424 1.712 1.00 0.00 O ATOM 1090 CB ARG A 68 -1.637 5.154 -1.480 1.00 0.00 C ATOM 1091 CG ARG A 68 -0.470 6.099 -1.211 1.00 0.00 C ATOM 1092 CD ARG A 68 -0.584 7.409 -1.984 1.00 0.00 C ATOM 1093 NE ARG A 68 -0.742 7.220 -3.429 1.00 0.00 N ATOM 1094 CZ ARG A 68 -0.054 7.898 -4.355 1.00 0.00 C ATOM 1095 NH1 ARG A 68 0.958 8.682 -4.007 1.00 0.00 N ATOM 1096 NH2 ARG A 68 -0.371 7.769 -5.636 1.00 0.00 N ATOM 0 H ARG A 68 -2.764 2.945 -1.780 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.961 3.910 0.134 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -1.429 4.577 -2.381 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.534 5.741 -1.678 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -0.421 6.315 -0.144 1.00 0.00 H new ATOM 0 HG3 ARG A 68 0.463 5.603 -1.479 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -1.435 7.974 -1.604 1.00 0.00 H new ATOM 0 HD3 ARG A 68 0.306 8.010 -1.799 1.00 0.00 H new ATOM 0 HE ARG A 68 -1.419 6.528 -3.749 1.00 0.00 H new ATOM 0 HH11 ARG A 68 1.219 8.773 -3.025 1.00 0.00 H new ATOM 0 HH12 ARG A 68 1.475 9.194 -4.721 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -1.137 7.155 -5.912 1.00 0.00 H new ATOM 0 HH22 ARG A 68 0.151 8.284 -6.345 1.00 0.00 H new ATOM 1110 N ARG A 69 -4.097 4.861 0.501 1.00 0.00 N ATOM 1111 CA ARG A 69 -5.038 5.520 1.402 1.00 0.00 C ATOM 1112 C ARG A 69 -5.163 4.741 2.709 1.00 0.00 C ATOM 1113 O ARG A 69 -5.254 5.329 3.787 1.00 0.00 O ATOM 1114 CB ARG A 69 -6.417 5.657 0.747 1.00 0.00 C ATOM 1115 CG ARG A 69 -6.383 6.201 -0.676 1.00 0.00 C ATOM 1116 CD ARG A 69 -5.700 7.555 -0.762 1.00 0.00 C ATOM 1117 NE ARG A 69 -5.465 7.958 -2.151 1.00 0.00 N ATOM 1118 CZ ARG A 69 -5.974 9.059 -2.708 1.00 0.00 C ATOM 1119 NH1 ARG A 69 -6.769 9.858 -2.008 1.00 0.00 N ATOM 1120 NH2 ARG A 69 -5.688 9.357 -3.970 1.00 0.00 N ATOM 0 H ARG A 69 -4.531 4.391 -0.293 1.00 0.00 H new ATOM 0 HA ARG A 69 -4.653 6.517 1.617 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -6.901 4.681 0.739 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -7.034 6.314 1.360 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -5.862 5.493 -1.320 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -7.402 6.286 -1.054 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -6.315 8.305 -0.265 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -4.750 7.518 -0.229 1.00 0.00 H new ATOM 0 HE ARG A 69 -4.875 7.359 -2.729 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -6.994 9.632 -1.039 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -7.155 10.698 -2.439 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -5.080 8.745 -4.513 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -6.077 10.198 -4.396 1.00 0.00 H new ATOM 1134 N LEU A 70 -5.158 3.414 2.607 1.00 0.00 N ATOM 1135 CA LEU A 70 -5.246 2.553 3.783 1.00 0.00 C ATOM 1136 C LEU A 70 -4.024 2.727 4.674 1.00 0.00 C ATOM 1137 O LEU A 70 -4.142 2.802 5.895 1.00 0.00 O ATOM 1138 CB LEU A 70 -5.378 1.082 3.376 1.00 0.00 C ATOM 1139 CG LEU A 70 -6.656 0.722 2.623 1.00 0.00 C ATOM 1140 CD1 LEU A 70 -6.655 -0.754 2.263 1.00 0.00 C ATOM 1141 CD2 LEU A 70 -7.883 1.067 3.451 1.00 0.00 C ATOM 0 H LEU A 70 -5.094 2.912 1.722 1.00 0.00 H new ATOM 0 HA LEU A 70 -6.136 2.847 4.340 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -4.523 0.817 2.754 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.321 0.468 4.275 1.00 0.00 H new ATOM 0 HG LEU A 70 -6.691 1.306 1.703 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.572 -0.998 1.726 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -5.795 -0.974 1.631 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.598 -1.351 3.173 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -8.783 0.802 2.896 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.858 0.510 4.388 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.889 2.136 3.664 1.00 0.00 H new ATOM 1153 N ALA A 71 -2.854 2.808 4.054 1.00 0.00 N ATOM 1154 CA ALA A 71 -1.607 2.977 4.790 1.00 0.00 C ATOM 1155 C ALA A 71 -1.531 4.362 5.428 1.00 0.00 C ATOM 1156 O ALA A 71 -0.886 4.551 6.460 1.00 0.00 O ATOM 1157 CB ALA A 71 -0.421 2.751 3.869 1.00 0.00 C ATOM 0 H ALA A 71 -2.742 2.759 3.041 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.579 2.237 5.589 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.505 2.880 4.430 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -0.462 1.740 3.464 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -0.453 3.471 3.051 1.00 0.00 H new ATOM 1163 N LYS A 72 -2.199 5.326 4.805 1.00 0.00 N ATOM 1164 CA LYS A 72 -2.253 6.686 5.324 1.00 0.00 C ATOM 1165 C LYS A 72 -3.243 6.766 6.489 1.00 0.00 C ATOM 1166 O LYS A 72 -3.155 7.656 7.339 1.00 0.00 O ATOM 1167 CB LYS A 72 -2.645 7.649 4.188 1.00 0.00 C ATOM 1168 CG LYS A 72 -2.580 9.129 4.545 1.00 0.00 C ATOM 1169 CD LYS A 72 -3.874 9.618 5.176 1.00 0.00 C ATOM 1170 CE LYS A 72 -3.785 11.079 5.577 1.00 0.00 C ATOM 1171 NZ LYS A 72 -5.035 11.549 6.225 1.00 0.00 N ATOM 0 H LYS A 72 -2.713 5.189 3.935 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.273 6.976 5.702 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.990 7.467 3.336 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -3.659 7.413 3.866 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -1.753 9.300 5.234 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -2.372 9.710 3.647 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -4.696 9.483 4.473 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -4.103 9.013 6.053 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -2.947 11.218 6.260 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -3.582 11.686 4.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -4.936 12.551 6.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -5.831 11.440 5.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -5.215 10.986 7.081 1.00 0.00 H new ATOM 1185 N SER A 73 -4.170 5.816 6.533 1.00 0.00 N ATOM 1186 CA SER A 73 -5.186 5.781 7.573 1.00 0.00 C ATOM 1187 C SER A 73 -4.550 5.562 8.946 1.00 0.00 C ATOM 1188 O SER A 73 -3.641 4.741 9.097 1.00 0.00 O ATOM 1189 CB SER A 73 -6.212 4.684 7.272 1.00 0.00 C ATOM 1190 OG SER A 73 -6.872 4.934 6.040 1.00 0.00 O ATOM 0 H SER A 73 -4.237 5.057 5.855 1.00 0.00 H new ATOM 0 HA SER A 73 -5.698 6.743 7.589 1.00 0.00 H new ATOM 0 HB2 SER A 73 -5.714 3.715 7.233 1.00 0.00 H new ATOM 0 HB3 SER A 73 -6.944 4.634 8.078 1.00 0.00 H new ATOM 0 HG SER A 73 -6.208 5.009 5.323 1.00 0.00 H new ATOM 1196 N PRO A 74 -5.030 6.305 9.962 1.00 0.00 N ATOM 1197 CA PRO A 74 -4.460 6.285 11.318 1.00 0.00 C ATOM 1198 C PRO A 74 -4.341 4.881 11.906 1.00 0.00 C ATOM 1199 O PRO A 74 -3.395 4.594 12.638 1.00 0.00 O ATOM 1200 CB PRO A 74 -5.450 7.120 12.132 1.00 0.00 C ATOM 1201 CG PRO A 74 -6.095 8.018 11.138 1.00 0.00 C ATOM 1202 CD PRO A 74 -6.172 7.232 9.860 1.00 0.00 C ATOM 0 HA PRO A 74 -3.440 6.669 11.323 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -6.185 6.488 12.630 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -4.941 7.690 12.909 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -7.088 8.320 11.471 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -5.514 8.930 11.001 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -7.118 6.697 9.773 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -6.089 7.877 8.985 1.00 0.00 H new ATOM 1210 N LEU A 75 -5.296 4.015 11.586 1.00 0.00 N ATOM 1211 CA LEU A 75 -5.274 2.643 12.074 1.00 0.00 C ATOM 1212 C LEU A 75 -3.989 1.938 11.648 1.00 0.00 C ATOM 1213 O LEU A 75 -3.212 1.495 12.492 1.00 0.00 O ATOM 1214 CB LEU A 75 -6.494 1.871 11.563 1.00 0.00 C ATOM 1215 CG LEU A 75 -6.616 0.432 12.077 1.00 0.00 C ATOM 1216 CD1 LEU A 75 -6.749 0.408 13.594 1.00 0.00 C ATOM 1217 CD2 LEU A 75 -7.800 -0.271 11.426 1.00 0.00 C ATOM 0 H LEU A 75 -6.094 4.239 10.991 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.309 2.670 13.163 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -7.394 2.418 11.844 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -6.461 1.850 10.474 1.00 0.00 H new ATOM 0 HG LEU A 75 -5.706 -0.103 11.806 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -6.834 -0.624 13.935 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.869 0.868 14.044 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -7.639 0.963 13.890 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -7.870 -1.291 11.804 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -8.718 0.267 11.663 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -7.661 -0.293 10.345 1.00 0.00 H new ATOM 1229 N TYR A 76 -3.753 1.871 10.340 1.00 0.00 N ATOM 1230 CA TYR A 76 -2.574 1.196 9.804 1.00 0.00 C ATOM 1231 C TYR A 76 -1.303 1.911 10.245 1.00 0.00 C ATOM 1232 O TYR A 76 -0.314 1.272 10.610 1.00 0.00 O ATOM 1233 CB TYR A 76 -2.646 1.136 8.275 1.00 0.00 C ATOM 1234 CG TYR A 76 -1.501 0.379 7.632 1.00 0.00 C ATOM 1235 CD1 TYR A 76 -1.573 -0.996 7.442 1.00 0.00 C ATOM 1236 CD2 TYR A 76 -0.352 1.039 7.211 1.00 0.00 C ATOM 1237 CE1 TYR A 76 -0.533 -1.690 6.851 1.00 0.00 C ATOM 1238 CE2 TYR A 76 0.693 0.352 6.621 1.00 0.00 C ATOM 1239 CZ TYR A 76 0.597 -1.011 6.442 1.00 0.00 C ATOM 1240 OH TYR A 76 1.639 -1.699 5.853 1.00 0.00 O ATOM 0 H TYR A 76 -4.364 2.277 9.631 1.00 0.00 H new ATOM 0 HA TYR A 76 -2.551 0.178 10.194 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -3.586 0.668 7.984 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -2.662 2.153 7.882 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -2.455 -1.531 7.761 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.274 2.108 7.347 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -0.605 -2.758 6.710 1.00 0.00 H new ATOM 0 HE2 TYR A 76 1.579 0.881 6.302 1.00 0.00 H new ATOM 0 HH TYR A 76 1.373 -2.631 5.704 1.00 0.00 H new ATOM 1250 N ARG A 77 -1.349 3.237 10.215 1.00 0.00 N ATOM 1251 CA ARG A 77 -0.224 4.066 10.631 1.00 0.00 C ATOM 1252 C ARG A 77 0.229 3.702 12.042 1.00 0.00 C ATOM 1253 O ARG A 77 1.407 3.456 12.287 1.00 0.00 O ATOM 1254 CB ARG A 77 -0.628 5.541 10.592 1.00 0.00 C ATOM 1255 CG ARG A 77 0.487 6.497 10.979 1.00 0.00 C ATOM 1256 CD ARG A 77 -0.060 7.877 11.307 1.00 0.00 C ATOM 1257 NE ARG A 77 1.005 8.846 11.566 1.00 0.00 N ATOM 1258 CZ ARG A 77 1.396 9.232 12.783 1.00 0.00 C ATOM 1259 NH1 ARG A 77 0.832 8.715 13.869 1.00 0.00 N ATOM 1260 NH2 ARG A 77 2.355 10.143 12.902 1.00 0.00 N ATOM 0 H ARG A 77 -2.163 3.766 9.903 1.00 0.00 H new ATOM 0 HA ARG A 77 0.603 3.890 9.944 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -0.971 5.787 9.587 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -1.473 5.694 11.263 1.00 0.00 H new ATOM 0 HG2 ARG A 77 1.025 6.102 11.841 1.00 0.00 H new ATOM 0 HG3 ARG A 77 1.205 6.572 10.162 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -0.675 8.228 10.479 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -0.709 7.811 12.180 1.00 0.00 H new ATOM 0 HE ARG A 77 1.481 9.255 10.762 1.00 0.00 H new ATOM 0 HH11 ARG A 77 0.094 8.017 13.777 1.00 0.00 H new ATOM 0 HH12 ARG A 77 1.137 9.016 14.795 1.00 0.00 H new ATOM 0 HH21 ARG A 77 2.786 10.542 12.068 1.00 0.00 H new ATOM 0 HH22 ARG A 77 2.660 10.444 13.827 1.00 0.00 H new ATOM 1274 N LYS A 78 -0.728 3.650 12.954 1.00 0.00 N ATOM 1275 CA LYS A 78 -0.446 3.439 14.366 1.00 0.00 C ATOM 1276 C LYS A 78 0.008 2.005 14.647 1.00 0.00 C ATOM 1277 O LYS A 78 0.838 1.774 15.532 1.00 0.00 O ATOM 1278 CB LYS A 78 -1.689 3.785 15.185 1.00 0.00 C ATOM 1279 CG LYS A 78 -1.517 3.614 16.679 1.00 0.00 C ATOM 1280 CD LYS A 78 -2.573 4.388 17.444 1.00 0.00 C ATOM 1281 CE LYS A 78 -2.427 4.197 18.942 1.00 0.00 C ATOM 1282 NZ LYS A 78 -3.227 5.191 19.700 1.00 0.00 N ATOM 0 H LYS A 78 -1.720 3.752 12.738 1.00 0.00 H new ATOM 0 HA LYS A 78 0.376 4.094 14.656 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -1.970 4.818 14.979 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -2.516 3.158 14.852 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -1.579 2.557 16.936 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -0.525 3.956 16.975 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -2.495 5.448 17.202 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -3.564 4.061 17.129 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -2.744 3.190 19.214 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -1.377 4.286 19.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -3.103 5.031 20.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -2.907 6.151 19.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -4.232 5.089 19.453 1.00 0.00 H new ATOM 1296 N GLN A 79 -0.517 1.056 13.873 1.00 0.00 N ATOM 1297 CA GLN A 79 -0.216 -0.366 14.066 1.00 0.00 C ATOM 1298 C GLN A 79 1.287 -0.642 14.061 1.00 0.00 C ATOM 1299 O GLN A 79 1.766 -1.503 14.799 1.00 0.00 O ATOM 1300 CB GLN A 79 -0.884 -1.210 12.978 1.00 0.00 C ATOM 1301 CG GLN A 79 -2.396 -1.327 13.110 1.00 0.00 C ATOM 1302 CD GLN A 79 -2.826 -2.102 14.342 1.00 0.00 C ATOM 1303 OE1 GLN A 79 -2.961 -3.325 14.304 1.00 0.00 O ATOM 1304 NE2 GLN A 79 -3.061 -1.398 15.438 1.00 0.00 N ATOM 0 H GLN A 79 -1.157 1.246 13.102 1.00 0.00 H new ATOM 0 HA GLN A 79 -0.611 -0.641 15.044 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -0.649 -0.778 12.005 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -0.452 -2.211 12.995 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -2.830 -0.328 13.146 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -2.796 -1.816 12.222 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -2.938 -0.386 15.430 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -3.365 -1.868 16.291 1.00 0.00 H new ATOM 1313 N PHE A 80 2.030 0.087 13.236 1.00 0.00 N ATOM 1314 CA PHE A 80 3.460 -0.157 13.101 1.00 0.00 C ATOM 1315 C PHE A 80 4.280 1.034 13.581 1.00 0.00 C ATOM 1316 O PHE A 80 5.482 1.105 13.341 1.00 0.00 O ATOM 1317 CB PHE A 80 3.809 -0.476 11.647 1.00 0.00 C ATOM 1318 CG PHE A 80 3.087 -1.679 11.111 1.00 0.00 C ATOM 1319 CD1 PHE A 80 3.440 -2.953 11.523 1.00 0.00 C ATOM 1320 CD2 PHE A 80 2.054 -1.535 10.198 1.00 0.00 C ATOM 1321 CE1 PHE A 80 2.777 -4.063 11.034 1.00 0.00 C ATOM 1322 CE2 PHE A 80 1.389 -2.640 9.705 1.00 0.00 C ATOM 1323 CZ PHE A 80 1.749 -3.906 10.124 1.00 0.00 C ATOM 0 H PHE A 80 1.670 0.845 12.656 1.00 0.00 H new ATOM 0 HA PHE A 80 3.708 -1.013 13.729 1.00 0.00 H new ATOM 0 HB2 PHE A 80 3.571 0.388 11.026 1.00 0.00 H new ATOM 0 HB3 PHE A 80 4.884 -0.641 11.567 1.00 0.00 H new ATOM 0 HD1 PHE A 80 4.242 -3.081 12.234 1.00 0.00 H new ATOM 0 HD2 PHE A 80 1.766 -0.548 9.869 1.00 0.00 H new ATOM 0 HE1 PHE A 80 3.062 -5.052 11.363 1.00 0.00 H new ATOM 0 HE2 PHE A 80 0.588 -2.515 8.992 1.00 0.00 H new ATOM 0 HZ PHE A 80 1.228 -4.771 9.741 1.00 0.00 H new ATOM 1333 N PHE A 81 3.634 1.961 14.277 1.00 0.00 N ATOM 1334 CA PHE A 81 4.318 3.155 14.753 1.00 0.00 C ATOM 1335 C PHE A 81 4.479 3.125 16.269 1.00 0.00 C ATOM 1336 O PHE A 81 5.504 3.550 16.801 1.00 0.00 O ATOM 1337 CB PHE A 81 3.551 4.410 14.327 1.00 0.00 C ATOM 1338 CG PHE A 81 4.280 5.693 14.611 1.00 0.00 C ATOM 1339 CD1 PHE A 81 5.394 6.046 13.868 1.00 0.00 C ATOM 1340 CD2 PHE A 81 3.854 6.543 15.621 1.00 0.00 C ATOM 1341 CE1 PHE A 81 6.071 7.223 14.124 1.00 0.00 C ATOM 1342 CE2 PHE A 81 4.527 7.720 15.883 1.00 0.00 C ATOM 1343 CZ PHE A 81 5.637 8.061 15.132 1.00 0.00 C ATOM 0 H PHE A 81 2.645 1.910 14.523 1.00 0.00 H new ATOM 0 HA PHE A 81 5.312 3.178 14.306 1.00 0.00 H new ATOM 0 HB2 PHE A 81 3.341 4.351 13.259 1.00 0.00 H new ATOM 0 HB3 PHE A 81 2.589 4.428 14.840 1.00 0.00 H new ATOM 0 HD1 PHE A 81 5.738 5.394 13.079 1.00 0.00 H new ATOM 0 HD2 PHE A 81 2.987 6.281 16.209 1.00 0.00 H new ATOM 0 HE1 PHE A 81 6.938 7.487 13.537 1.00 0.00 H new ATOM 0 HE2 PHE A 81 4.187 8.373 16.673 1.00 0.00 H new ATOM 0 HZ PHE A 81 6.164 8.982 15.334 1.00 0.00 H new ATOM 1353 N GLU A 82 3.466 2.621 16.966 1.00 0.00 N ATOM 1354 CA GLU A 82 3.501 2.573 18.426 1.00 0.00 C ATOM 1355 C GLU A 82 4.458 1.496 18.950 1.00 0.00 C ATOM 1356 O GLU A 82 5.360 1.810 19.728 1.00 0.00 O ATOM 1357 CB GLU A 82 2.100 2.356 19.004 1.00 0.00 C ATOM 1358 CG GLU A 82 1.129 3.485 18.707 1.00 0.00 C ATOM 1359 CD GLU A 82 1.544 4.804 19.324 1.00 0.00 C ATOM 1360 OE1 GLU A 82 2.004 4.807 20.485 1.00 0.00 O ATOM 1361 OE2 GLU A 82 1.385 5.848 18.663 1.00 0.00 O ATOM 0 H GLU A 82 2.616 2.242 16.549 1.00 0.00 H new ATOM 0 HA GLU A 82 3.876 3.540 18.760 1.00 0.00 H new ATOM 0 HB2 GLU A 82 1.694 1.426 18.606 1.00 0.00 H new ATOM 0 HB3 GLU A 82 2.179 2.233 20.084 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.043 3.607 17.627 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.141 3.213 19.077 1.00 0.00 H new ATOM 1368 N PRO A 83 4.301 0.215 18.545 1.00 0.00 N ATOM 1369 CA PRO A 83 5.097 -0.877 19.088 1.00 0.00 C ATOM 1370 C PRO A 83 6.375 -1.138 18.297 1.00 0.00 C ATOM 1371 O PRO A 83 7.195 -1.974 18.684 1.00 0.00 O ATOM 1372 CB PRO A 83 4.157 -2.085 18.976 1.00 0.00 C ATOM 1373 CG PRO A 83 3.047 -1.679 18.048 1.00 0.00 C ATOM 1374 CD PRO A 83 3.358 -0.294 17.543 1.00 0.00 C ATOM 0 HA PRO A 83 5.435 -0.658 20.101 1.00 0.00 H new ATOM 0 HB2 PRO A 83 4.688 -2.955 18.588 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.763 -2.362 19.954 1.00 0.00 H new ATOM 0 HG2 PRO A 83 2.967 -2.380 17.217 1.00 0.00 H new ATOM 0 HG3 PRO A 83 2.089 -1.691 18.569 1.00 0.00 H new ATOM 0 HD2 PRO A 83 3.800 -0.317 16.547 1.00 0.00 H new ATOM 0 HD3 PRO A 83 2.462 0.324 17.480 1.00 0.00 H new ATOM 1382 N PHE A 84 6.545 -0.428 17.193 1.00 0.00 N ATOM 1383 CA PHE A 84 7.678 -0.661 16.317 1.00 0.00 C ATOM 1384 C PHE A 84 8.530 0.587 16.180 1.00 0.00 C ATOM 1385 O PHE A 84 8.017 1.700 16.067 1.00 0.00 O ATOM 1386 CB PHE A 84 7.214 -1.145 14.941 1.00 0.00 C ATOM 1387 CG PHE A 84 6.561 -2.497 14.974 1.00 0.00 C ATOM 1388 CD1 PHE A 84 7.333 -3.648 14.998 1.00 0.00 C ATOM 1389 CD2 PHE A 84 5.181 -2.616 14.985 1.00 0.00 C ATOM 1390 CE1 PHE A 84 6.738 -4.895 15.032 1.00 0.00 C ATOM 1391 CE2 PHE A 84 4.582 -3.859 15.019 1.00 0.00 C ATOM 1392 CZ PHE A 84 5.361 -5.000 15.043 1.00 0.00 C ATOM 0 H PHE A 84 5.914 0.312 16.884 1.00 0.00 H new ATOM 0 HA PHE A 84 8.290 -1.442 16.768 1.00 0.00 H new ATOM 0 HB2 PHE A 84 6.513 -0.421 14.527 1.00 0.00 H new ATOM 0 HB3 PHE A 84 8.071 -1.180 14.268 1.00 0.00 H new ATOM 0 HD1 PHE A 84 8.410 -3.570 14.990 1.00 0.00 H new ATOM 0 HD2 PHE A 84 4.568 -1.727 14.967 1.00 0.00 H new ATOM 0 HE1 PHE A 84 7.349 -5.786 15.050 1.00 0.00 H new ATOM 0 HE2 PHE A 84 3.505 -3.940 15.027 1.00 0.00 H new ATOM 0 HZ PHE A 84 4.893 -5.973 15.070 1.00 0.00 H new ATOM 1402 N ILE A 85 9.837 0.387 16.219 1.00 0.00 N ATOM 1403 CA ILE A 85 10.787 1.474 16.068 1.00 0.00 C ATOM 1404 C ILE A 85 11.039 1.736 14.580 1.00 0.00 C ATOM 1405 O ILE A 85 10.747 0.877 13.742 1.00 0.00 O ATOM 1406 CB ILE A 85 12.114 1.145 16.798 1.00 0.00 C ATOM 1407 CG1 ILE A 85 12.977 2.404 16.955 1.00 0.00 C ATOM 1408 CG2 ILE A 85 12.880 0.055 16.051 1.00 0.00 C ATOM 1409 CD1 ILE A 85 14.211 2.194 17.808 1.00 0.00 C ATOM 0 H ILE A 85 10.266 -0.528 16.355 1.00 0.00 H new ATOM 0 HA ILE A 85 10.370 2.374 16.520 1.00 0.00 H new ATOM 0 HB ILE A 85 11.873 0.774 17.794 1.00 0.00 H new ATOM 0 HG12 ILE A 85 13.283 2.749 15.968 1.00 0.00 H new ATOM 0 HG13 ILE A 85 12.372 3.196 17.396 1.00 0.00 H new ATOM 0 HG21 ILE A 85 13.809 -0.163 16.578 1.00 0.00 H new ATOM 0 HG22 ILE A 85 12.271 -0.848 16.000 1.00 0.00 H new ATOM 0 HG23 ILE A 85 13.107 0.397 15.041 1.00 0.00 H new ATOM 0 HD11 ILE A 85 14.771 3.127 17.874 1.00 0.00 H new ATOM 0 HD12 ILE A 85 13.913 1.879 18.808 1.00 0.00 H new ATOM 0 HD13 ILE A 85 14.838 1.425 17.357 1.00 0.00 H new ATOM 1421 N ASN A 86 11.584 2.913 14.269 1.00 0.00 N ATOM 1422 CA ASN A 86 11.820 3.349 12.889 1.00 0.00 C ATOM 1423 C ASN A 86 12.462 2.246 12.049 1.00 0.00 C ATOM 1424 O ASN A 86 11.996 1.937 10.952 1.00 0.00 O ATOM 1425 CB ASN A 86 12.734 4.584 12.863 1.00 0.00 C ATOM 1426 CG ASN A 86 12.189 5.774 13.640 1.00 0.00 C ATOM 1427 OD1 ASN A 86 11.522 5.624 14.665 1.00 0.00 O ATOM 1428 ND2 ASN A 86 12.485 6.970 13.157 1.00 0.00 N ATOM 0 H ASN A 86 11.876 3.595 14.969 1.00 0.00 H new ATOM 0 HA ASN A 86 10.847 3.594 12.463 1.00 0.00 H new ATOM 0 HB2 ASN A 86 13.707 4.312 13.271 1.00 0.00 H new ATOM 0 HB3 ASN A 86 12.895 4.882 11.827 1.00 0.00 H new ATOM 0 HD21 ASN A 86 12.158 7.809 13.637 1.00 0.00 H new ATOM 0 HD22 ASN A 86 13.040 7.053 12.305 1.00 0.00 H new ATOM 1435 N SER A 87 13.528 1.659 12.578 1.00 0.00 N ATOM 1436 CA SER A 87 14.280 0.623 11.876 1.00 0.00 C ATOM 1437 C SER A 87 13.390 -0.550 11.455 1.00 0.00 C ATOM 1438 O SER A 87 13.470 -1.019 10.318 1.00 0.00 O ATOM 1439 CB SER A 87 15.419 0.125 12.766 1.00 0.00 C ATOM 1440 OG SER A 87 16.167 -0.898 12.133 1.00 0.00 O ATOM 0 H SER A 87 13.896 1.885 13.502 1.00 0.00 H new ATOM 0 HA SER A 87 14.686 1.064 10.966 1.00 0.00 H new ATOM 0 HB2 SER A 87 16.078 0.957 13.015 1.00 0.00 H new ATOM 0 HB3 SER A 87 15.011 -0.250 13.705 1.00 0.00 H new ATOM 0 HG SER A 87 16.888 -1.192 12.728 1.00 0.00 H new ATOM 1446 N ARG A 88 12.529 -1.012 12.355 1.00 0.00 N ATOM 1447 CA ARG A 88 11.724 -2.190 12.067 1.00 0.00 C ATOM 1448 C ARG A 88 10.500 -1.823 11.239 1.00 0.00 C ATOM 1449 O ARG A 88 10.058 -2.605 10.399 1.00 0.00 O ATOM 1450 CB ARG A 88 11.293 -2.902 13.349 1.00 0.00 C ATOM 1451 CG ARG A 88 10.999 -4.377 13.125 1.00 0.00 C ATOM 1452 CD ARG A 88 12.264 -5.117 12.712 1.00 0.00 C ATOM 1453 NE ARG A 88 12.004 -6.476 12.240 1.00 0.00 N ATOM 1454 CZ ARG A 88 12.221 -7.571 12.962 1.00 0.00 C ATOM 1455 NH1 ARG A 88 12.599 -7.473 14.232 1.00 0.00 N ATOM 1456 NH2 ARG A 88 12.055 -8.766 12.406 1.00 0.00 N ATOM 0 H ARG A 88 12.373 -0.597 13.274 1.00 0.00 H new ATOM 0 HA ARG A 88 12.347 -2.874 11.491 1.00 0.00 H new ATOM 0 HB2 ARG A 88 12.078 -2.801 14.098 1.00 0.00 H new ATOM 0 HB3 ARG A 88 10.405 -2.415 13.750 1.00 0.00 H new ATOM 0 HG2 ARG A 88 10.596 -4.816 14.037 1.00 0.00 H new ATOM 0 HG3 ARG A 88 10.237 -4.489 12.354 1.00 0.00 H new ATOM 0 HD2 ARG A 88 12.766 -4.555 11.925 1.00 0.00 H new ATOM 0 HD3 ARG A 88 12.948 -5.158 13.560 1.00 0.00 H new ATOM 0 HE ARG A 88 11.633 -6.591 11.297 1.00 0.00 H new ATOM 0 HH11 ARG A 88 12.724 -6.554 14.657 1.00 0.00 H new ATOM 0 HH12 ARG A 88 12.764 -8.316 14.781 1.00 0.00 H new ATOM 0 HH21 ARG A 88 11.763 -8.839 11.431 1.00 0.00 H new ATOM 0 HH22 ARG A 88 12.220 -9.611 12.954 1.00 0.00 H new ATOM 1470 N ALA A 89 9.955 -0.632 11.474 1.00 0.00 N ATOM 1471 CA ALA A 89 8.825 -0.143 10.690 1.00 0.00 C ATOM 1472 C ALA A 89 9.223 -0.032 9.222 1.00 0.00 C ATOM 1473 O ALA A 89 8.442 -0.352 8.326 1.00 0.00 O ATOM 1474 CB ALA A 89 8.339 1.201 11.225 1.00 0.00 C ATOM 0 H ALA A 89 10.276 0.010 12.198 1.00 0.00 H new ATOM 0 HA ALA A 89 8.002 -0.853 10.776 1.00 0.00 H new ATOM 0 HB1 ALA A 89 7.496 1.548 10.627 1.00 0.00 H new ATOM 0 HB2 ALA A 89 8.025 1.088 12.263 1.00 0.00 H new ATOM 0 HB3 ALA A 89 9.148 1.929 11.168 1.00 0.00 H new ATOM 1480 N LEU A 90 10.458 0.403 8.994 1.00 0.00 N ATOM 1481 CA LEU A 90 11.019 0.486 7.652 1.00 0.00 C ATOM 1482 C LEU A 90 11.059 -0.898 7.005 1.00 0.00 C ATOM 1483 O LEU A 90 10.657 -1.076 5.852 1.00 0.00 O ATOM 1484 CB LEU A 90 12.433 1.072 7.718 1.00 0.00 C ATOM 1485 CG LEU A 90 13.113 1.307 6.369 1.00 0.00 C ATOM 1486 CD1 LEU A 90 12.431 2.435 5.618 1.00 0.00 C ATOM 1487 CD2 LEU A 90 14.590 1.610 6.565 1.00 0.00 C ATOM 0 H LEU A 90 11.095 0.706 9.731 1.00 0.00 H new ATOM 0 HA LEU A 90 10.387 1.136 7.046 1.00 0.00 H new ATOM 0 HB2 LEU A 90 12.389 2.021 8.253 1.00 0.00 H new ATOM 0 HB3 LEU A 90 13.058 0.402 8.308 1.00 0.00 H new ATOM 0 HG LEU A 90 13.024 0.398 5.774 1.00 0.00 H new ATOM 0 HD11 LEU A 90 12.929 2.588 4.660 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.386 2.178 5.447 1.00 0.00 H new ATOM 0 HD13 LEU A 90 12.488 3.351 6.207 1.00 0.00 H new ATOM 0 HD21 LEU A 90 15.059 1.775 5.595 1.00 0.00 H new ATOM 0 HD22 LEU A 90 14.700 2.505 7.178 1.00 0.00 H new ATOM 0 HD23 LEU A 90 15.071 0.768 7.063 1.00 0.00 H new ATOM 1499 N GLU A 91 11.536 -1.877 7.767 1.00 0.00 N ATOM 1500 CA GLU A 91 11.640 -3.253 7.293 1.00 0.00 C ATOM 1501 C GLU A 91 10.270 -3.798 6.897 1.00 0.00 C ATOM 1502 O GLU A 91 10.106 -4.392 5.825 1.00 0.00 O ATOM 1503 CB GLU A 91 12.245 -4.140 8.385 1.00 0.00 C ATOM 1504 CG GLU A 91 12.490 -5.570 7.936 1.00 0.00 C ATOM 1505 CD GLU A 91 12.736 -6.515 9.091 1.00 0.00 C ATOM 1506 OE1 GLU A 91 13.876 -6.577 9.584 1.00 0.00 O ATOM 1507 OE2 GLU A 91 11.784 -7.210 9.507 1.00 0.00 O ATOM 0 H GLU A 91 11.860 -1.741 8.725 1.00 0.00 H new ATOM 0 HA GLU A 91 12.287 -3.261 6.415 1.00 0.00 H new ATOM 0 HB2 GLU A 91 13.188 -3.704 8.715 1.00 0.00 H new ATOM 0 HB3 GLU A 91 11.578 -4.147 9.247 1.00 0.00 H new ATOM 0 HG2 GLU A 91 11.630 -5.919 7.365 1.00 0.00 H new ATOM 0 HG3 GLU A 91 13.349 -5.593 7.265 1.00 0.00 H new ATOM 1514 N LEU A 92 9.291 -3.587 7.769 1.00 0.00 N ATOM 1515 CA LEU A 92 7.940 -4.085 7.553 1.00 0.00 C ATOM 1516 C LEU A 92 7.295 -3.424 6.339 1.00 0.00 C ATOM 1517 O LEU A 92 6.465 -4.029 5.660 1.00 0.00 O ATOM 1518 CB LEU A 92 7.087 -3.855 8.801 1.00 0.00 C ATOM 1519 CG LEU A 92 7.582 -4.567 10.063 1.00 0.00 C ATOM 1520 CD1 LEU A 92 6.694 -4.229 11.248 1.00 0.00 C ATOM 1521 CD2 LEU A 92 7.632 -6.073 9.845 1.00 0.00 C ATOM 0 H LEU A 92 9.411 -3.069 8.640 1.00 0.00 H new ATOM 0 HA LEU A 92 8.001 -5.156 7.358 1.00 0.00 H new ATOM 0 HB2 LEU A 92 7.042 -2.784 9.000 1.00 0.00 H new ATOM 0 HB3 LEU A 92 6.069 -4.183 8.592 1.00 0.00 H new ATOM 0 HG LEU A 92 8.592 -4.219 10.279 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.061 -4.744 12.136 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.710 -3.153 11.420 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.673 -4.548 11.040 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.986 -6.561 10.753 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.634 -6.439 9.602 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.311 -6.299 9.023 1.00 0.00 H new ATOM 1533 N ALA A 93 7.689 -2.184 6.063 1.00 0.00 N ATOM 1534 CA ALA A 93 7.191 -1.464 4.899 1.00 0.00 C ATOM 1535 C ALA A 93 7.598 -2.174 3.612 1.00 0.00 C ATOM 1536 O ALA A 93 6.760 -2.460 2.757 1.00 0.00 O ATOM 1537 CB ALA A 93 7.698 -0.031 4.902 1.00 0.00 C ATOM 0 H ALA A 93 8.353 -1.658 6.631 1.00 0.00 H new ATOM 0 HA ALA A 93 6.102 -1.444 4.948 1.00 0.00 H new ATOM 0 HB1 ALA A 93 7.316 0.492 4.025 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.354 0.475 5.804 1.00 0.00 H new ATOM 0 HB3 ALA A 93 8.788 -0.031 4.879 1.00 0.00 H new ATOM 1543 N PHE A 94 8.887 -2.479 3.488 1.00 0.00 N ATOM 1544 CA PHE A 94 9.398 -3.176 2.309 1.00 0.00 C ATOM 1545 C PHE A 94 8.785 -4.568 2.182 1.00 0.00 C ATOM 1546 O PHE A 94 8.661 -5.107 1.081 1.00 0.00 O ATOM 1547 CB PHE A 94 10.923 -3.297 2.362 1.00 0.00 C ATOM 1548 CG PHE A 94 11.649 -1.990 2.211 1.00 0.00 C ATOM 1549 CD1 PHE A 94 11.639 -1.311 1.000 1.00 0.00 C ATOM 1550 CD2 PHE A 94 12.349 -1.446 3.273 1.00 0.00 C ATOM 1551 CE1 PHE A 94 12.312 -0.115 0.857 1.00 0.00 C ATOM 1552 CE2 PHE A 94 13.024 -0.250 3.136 1.00 0.00 C ATOM 1553 CZ PHE A 94 13.005 0.417 1.927 1.00 0.00 C ATOM 0 H PHE A 94 9.596 -2.256 4.187 1.00 0.00 H new ATOM 0 HA PHE A 94 9.116 -2.585 1.438 1.00 0.00 H new ATOM 0 HB2 PHE A 94 11.208 -3.751 3.311 1.00 0.00 H new ATOM 0 HB3 PHE A 94 11.250 -3.975 1.574 1.00 0.00 H new ATOM 0 HD1 PHE A 94 11.099 -1.723 0.161 1.00 0.00 H new ATOM 0 HD2 PHE A 94 12.368 -1.963 4.221 1.00 0.00 H new ATOM 0 HE1 PHE A 94 12.297 0.404 -0.090 1.00 0.00 H new ATOM 0 HE2 PHE A 94 13.566 0.164 3.973 1.00 0.00 H new ATOM 0 HZ PHE A 94 13.531 1.354 1.818 1.00 0.00 H new ATOM 1563 N ARG A 95 8.408 -5.143 3.313 1.00 0.00 N ATOM 1564 CA ARG A 95 7.818 -6.474 3.341 1.00 0.00 C ATOM 1565 C ARG A 95 6.367 -6.450 2.878 1.00 0.00 C ATOM 1566 O ARG A 95 5.960 -7.249 2.041 1.00 0.00 O ATOM 1567 CB ARG A 95 7.871 -7.043 4.756 1.00 0.00 C ATOM 1568 CG ARG A 95 8.601 -8.369 4.868 1.00 0.00 C ATOM 1569 CD ARG A 95 10.040 -8.236 4.407 1.00 0.00 C ATOM 1570 NE ARG A 95 10.923 -9.213 5.044 1.00 0.00 N ATOM 1571 CZ ARG A 95 11.344 -9.121 6.310 1.00 0.00 C ATOM 1572 NH1 ARG A 95 10.877 -8.162 7.103 1.00 0.00 N ATOM 1573 NH2 ARG A 95 12.216 -9.998 6.781 1.00 0.00 N ATOM 0 H ARG A 95 8.501 -4.706 4.230 1.00 0.00 H new ATOM 0 HA ARG A 95 8.395 -7.101 2.661 1.00 0.00 H new ATOM 0 HB2 ARG A 95 8.357 -6.318 5.409 1.00 0.00 H new ATOM 0 HB3 ARG A 95 6.852 -7.170 5.123 1.00 0.00 H new ATOM 0 HG2 ARG A 95 8.577 -8.716 5.901 1.00 0.00 H new ATOM 0 HG3 ARG A 95 8.091 -9.122 4.267 1.00 0.00 H new ATOM 0 HD2 ARG A 95 10.085 -8.361 3.325 1.00 0.00 H new ATOM 0 HD3 ARG A 95 10.397 -7.230 4.627 1.00 0.00 H new ATOM 0 HE ARG A 95 11.236 -10.011 4.490 1.00 0.00 H new ATOM 0 HH11 ARG A 95 10.195 -7.493 6.747 1.00 0.00 H new ATOM 0 HH12 ARG A 95 11.201 -8.095 8.068 1.00 0.00 H new ATOM 0 HH21 ARG A 95 12.566 -10.743 6.179 1.00 0.00 H new ATOM 0 HH22 ARG A 95 12.538 -9.929 7.746 1.00 0.00 H new ATOM 1587 N HIS A 96 5.600 -5.524 3.428 1.00 0.00 N ATOM 1588 CA HIS A 96 4.153 -5.538 3.266 1.00 0.00 C ATOM 1589 C HIS A 96 3.694 -4.721 2.056 1.00 0.00 C ATOM 1590 O HIS A 96 2.591 -4.924 1.556 1.00 0.00 O ATOM 1591 CB HIS A 96 3.495 -5.013 4.543 1.00 0.00 C ATOM 1592 CG HIS A 96 2.017 -5.216 4.590 1.00 0.00 C ATOM 1593 ND1 HIS A 96 1.125 -4.202 4.863 1.00 0.00 N ATOM 1594 CD2 HIS A 96 1.274 -6.333 4.413 1.00 0.00 C ATOM 1595 CE1 HIS A 96 -0.101 -4.687 4.854 1.00 0.00 C ATOM 1596 NE2 HIS A 96 -0.036 -5.975 4.582 1.00 0.00 N ATOM 0 H HIS A 96 5.954 -4.751 3.992 1.00 0.00 H new ATOM 0 HA HIS A 96 3.847 -6.568 3.085 1.00 0.00 H new ATOM 0 HB2 HIS A 96 3.947 -5.508 5.403 1.00 0.00 H new ATOM 0 HB3 HIS A 96 3.709 -3.948 4.639 1.00 0.00 H new ATOM 0 HD2 HIS A 96 1.645 -7.321 4.182 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -1.005 -4.125 5.038 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -0.835 -6.605 4.509 1.00 0.00 H new ATOM 1605 N ILE A 97 4.522 -3.793 1.601 1.00 0.00 N ATOM 1606 CA ILE A 97 4.154 -2.954 0.468 1.00 0.00 C ATOM 1607 C ILE A 97 4.714 -3.515 -0.838 1.00 0.00 C ATOM 1608 O ILE A 97 3.962 -3.889 -1.736 1.00 0.00 O ATOM 1609 CB ILE A 97 4.641 -1.499 0.656 1.00 0.00 C ATOM 1610 CG1 ILE A 97 4.041 -0.896 1.932 1.00 0.00 C ATOM 1611 CG2 ILE A 97 4.268 -0.651 -0.553 1.00 0.00 C ATOM 1612 CD1 ILE A 97 4.554 0.493 2.250 1.00 0.00 C ATOM 0 H ILE A 97 5.444 -3.602 1.993 1.00 0.00 H new ATOM 0 HA ILE A 97 3.065 -2.952 0.416 1.00 0.00 H new ATOM 0 HB ILE A 97 5.727 -1.509 0.751 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.956 -0.858 1.830 1.00 0.00 H new ATOM 0 HG13 ILE A 97 4.259 -1.555 2.772 1.00 0.00 H new ATOM 0 HG21 ILE A 97 4.619 0.370 -0.403 1.00 0.00 H new ATOM 0 HG22 ILE A 97 4.733 -1.067 -1.447 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.185 -0.648 -0.675 1.00 0.00 H new ATOM 0 HD11 ILE A 97 4.085 0.853 3.165 1.00 0.00 H new ATOM 0 HD12 ILE A 97 5.635 0.459 2.385 1.00 0.00 H new ATOM 0 HD13 ILE A 97 4.312 1.167 1.429 1.00 0.00 H new ATOM 1624 N LEU A 98 6.036 -3.578 -0.933 1.00 0.00 N ATOM 1625 CA LEU A 98 6.691 -4.016 -2.162 1.00 0.00 C ATOM 1626 C LEU A 98 6.789 -5.532 -2.216 1.00 0.00 C ATOM 1627 O LEU A 98 6.690 -6.132 -3.285 1.00 0.00 O ATOM 1628 CB LEU A 98 8.086 -3.399 -2.294 1.00 0.00 C ATOM 1629 CG LEU A 98 8.127 -1.870 -2.299 1.00 0.00 C ATOM 1630 CD1 LEU A 98 8.199 -1.325 -0.882 1.00 0.00 C ATOM 1631 CD2 LEU A 98 9.299 -1.376 -3.130 1.00 0.00 C ATOM 0 H LEU A 98 6.675 -3.333 -0.177 1.00 0.00 H new ATOM 0 HA LEU A 98 6.080 -3.675 -2.997 1.00 0.00 H new ATOM 0 HB2 LEU A 98 8.704 -3.760 -1.472 1.00 0.00 H new ATOM 0 HB3 LEU A 98 8.540 -3.761 -3.217 1.00 0.00 H new ATOM 0 HG LEU A 98 7.206 -1.503 -2.751 1.00 0.00 H new ATOM 0 HD11 LEU A 98 8.227 -0.236 -0.912 1.00 0.00 H new ATOM 0 HD12 LEU A 98 7.322 -1.650 -0.322 1.00 0.00 H new ATOM 0 HD13 LEU A 98 9.100 -1.698 -0.394 1.00 0.00 H new ATOM 0 HD21 LEU A 98 9.315 -0.286 -3.124 1.00 0.00 H new ATOM 0 HD22 LEU A 98 10.230 -1.755 -2.708 1.00 0.00 H new ATOM 0 HD23 LEU A 98 9.194 -1.732 -4.155 1.00 0.00 H new ATOM 1643 N GLY A 99 6.985 -6.147 -1.061 1.00 0.00 N ATOM 1644 CA GLY A 99 7.050 -7.591 -0.998 1.00 0.00 C ATOM 1645 C GLY A 99 8.449 -8.123 -1.224 1.00 0.00 C ATOM 1646 O GLY A 99 8.637 -9.115 -1.930 1.00 0.00 O ATOM 0 H GLY A 99 7.100 -5.672 -0.166 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.692 -7.925 -0.024 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.380 -8.014 -1.746 1.00 0.00 H new ATOM 1650 N ARG A 100 9.437 -7.467 -0.631 1.00 0.00 N ATOM 1651 CA ARG A 100 10.817 -7.915 -0.743 1.00 0.00 C ATOM 1652 C ARG A 100 11.540 -7.766 0.595 1.00 0.00 C ATOM 1653 O ARG A 100 11.766 -8.748 1.305 1.00 0.00 O ATOM 1654 CB ARG A 100 11.550 -7.134 -1.843 1.00 0.00 C ATOM 1655 CG ARG A 100 12.991 -7.573 -2.045 1.00 0.00 C ATOM 1656 CD ARG A 100 13.662 -6.820 -3.187 1.00 0.00 C ATOM 1657 NE ARG A 100 15.086 -7.141 -3.281 1.00 0.00 N ATOM 1658 CZ ARG A 100 15.920 -6.600 -4.168 1.00 0.00 C ATOM 1659 NH1 ARG A 100 15.455 -5.811 -5.129 1.00 0.00 N ATOM 1660 NH2 ARG A 100 17.215 -6.877 -4.118 1.00 0.00 N ATOM 0 H ARG A 100 9.309 -6.625 -0.069 1.00 0.00 H new ATOM 0 HA ARG A 100 10.814 -8.970 -1.016 1.00 0.00 H new ATOM 0 HB2 ARG A 100 11.009 -7.251 -2.782 1.00 0.00 H new ATOM 0 HB3 ARG A 100 11.534 -6.073 -1.595 1.00 0.00 H new ATOM 0 HG2 ARG A 100 13.552 -7.411 -1.125 1.00 0.00 H new ATOM 0 HG3 ARG A 100 13.019 -8.643 -2.251 1.00 0.00 H new ATOM 0 HD2 ARG A 100 13.170 -7.069 -4.127 1.00 0.00 H new ATOM 0 HD3 ARG A 100 13.539 -5.747 -3.038 1.00 0.00 H new ATOM 0 HE ARG A 100 15.465 -7.824 -2.625 1.00 0.00 H new ATOM 0 HH11 ARG A 100 14.456 -5.617 -5.190 1.00 0.00 H new ATOM 0 HH12 ARG A 100 16.097 -5.399 -5.806 1.00 0.00 H new ATOM 0 HH21 ARG A 100 17.575 -7.505 -3.400 1.00 0.00 H new ATOM 0 HH22 ARG A 100 17.852 -6.462 -4.798 1.00 0.00 H new ATOM 1674 N GLY A 101 11.883 -6.536 0.946 1.00 0.00 N ATOM 1675 CA GLY A 101 12.594 -6.293 2.184 1.00 0.00 C ATOM 1676 C GLY A 101 13.816 -5.424 1.968 1.00 0.00 C ATOM 1677 O GLY A 101 14.148 -5.102 0.829 1.00 0.00 O ATOM 0 H GLY A 101 11.682 -5.701 0.396 1.00 0.00 H new ATOM 0 HA2 GLY A 101 11.926 -5.811 2.898 1.00 0.00 H new ATOM 0 HA3 GLY A 101 12.897 -7.244 2.622 1.00 0.00 H new ATOM 1681 N PRO A 102 14.493 -5.010 3.049 1.00 0.00 N ATOM 1682 CA PRO A 102 15.700 -4.188 2.963 1.00 0.00 C ATOM 1683 C PRO A 102 16.897 -4.991 2.464 1.00 0.00 C ATOM 1684 O PRO A 102 17.244 -6.024 3.037 1.00 0.00 O ATOM 1685 CB PRO A 102 15.935 -3.719 4.408 1.00 0.00 C ATOM 1686 CG PRO A 102 14.714 -4.122 5.171 1.00 0.00 C ATOM 1687 CD PRO A 102 14.140 -5.299 4.441 1.00 0.00 C ATOM 0 HA PRO A 102 15.582 -3.365 2.258 1.00 0.00 H new ATOM 0 HB2 PRO A 102 16.829 -4.180 4.828 1.00 0.00 H new ATOM 0 HB3 PRO A 102 16.084 -2.640 4.450 1.00 0.00 H new ATOM 0 HG2 PRO A 102 14.965 -4.385 6.199 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.995 -3.304 5.218 1.00 0.00 H new ATOM 0 HD2 PRO A 102 14.573 -6.239 4.783 1.00 0.00 H new ATOM 0 HD3 PRO A 102 13.061 -5.376 4.579 1.00 0.00 H new ATOM 1695 N SER A 103 17.517 -4.513 1.397 1.00 0.00 N ATOM 1696 CA SER A 103 18.650 -5.200 0.797 1.00 0.00 C ATOM 1697 C SER A 103 19.907 -5.053 1.656 1.00 0.00 C ATOM 1698 O SER A 103 20.389 -6.022 2.244 1.00 0.00 O ATOM 1699 CB SER A 103 18.893 -4.652 -0.609 1.00 0.00 C ATOM 1700 OG SER A 103 18.883 -3.233 -0.603 1.00 0.00 O ATOM 0 H SER A 103 17.253 -3.647 0.926 1.00 0.00 H new ATOM 0 HA SER A 103 18.418 -6.263 0.735 1.00 0.00 H new ATOM 0 HB2 SER A 103 19.851 -5.012 -0.985 1.00 0.00 H new ATOM 0 HB3 SER A 103 18.125 -5.023 -1.287 1.00 0.00 H new ATOM 0 HG SER A 103 19.042 -2.901 -1.511 1.00 0.00 H new ATOM 1706 N SER A 104 20.422 -3.837 1.736 1.00 0.00 N ATOM 1707 CA SER A 104 21.625 -3.566 2.504 1.00 0.00 C ATOM 1708 C SER A 104 21.541 -2.178 3.129 1.00 0.00 C ATOM 1709 O SER A 104 20.610 -1.420 2.838 1.00 0.00 O ATOM 1710 CB SER A 104 22.856 -3.685 1.602 1.00 0.00 C ATOM 1711 OG SER A 104 24.056 -3.566 2.346 1.00 0.00 O ATOM 0 H SER A 104 20.023 -3.019 1.276 1.00 0.00 H new ATOM 0 HA SER A 104 21.715 -4.298 3.306 1.00 0.00 H new ATOM 0 HB2 SER A 104 22.840 -4.645 1.086 1.00 0.00 H new ATOM 0 HB3 SER A 104 22.823 -2.911 0.835 1.00 0.00 H new ATOM 0 HG SER A 104 24.824 -3.648 1.743 1.00 0.00 H new ATOM 1717 N ARG A 105 22.524 -1.850 3.966 1.00 0.00 N ATOM 1718 CA ARG A 105 22.526 -0.610 4.744 1.00 0.00 C ATOM 1719 C ARG A 105 22.339 0.629 3.865 1.00 0.00 C ATOM 1720 O ARG A 105 21.745 1.616 4.302 1.00 0.00 O ATOM 1721 CB ARG A 105 23.828 -0.488 5.541 1.00 0.00 C ATOM 1722 CG ARG A 105 23.907 0.770 6.389 1.00 0.00 C ATOM 1723 CD ARG A 105 25.188 0.820 7.208 1.00 0.00 C ATOM 1724 NE ARG A 105 25.289 -0.299 8.148 1.00 0.00 N ATOM 1725 CZ ARG A 105 24.742 -0.304 9.364 1.00 0.00 C ATOM 1726 NH1 ARG A 105 24.028 0.739 9.779 1.00 0.00 N ATOM 1727 NH2 ARG A 105 24.907 -1.350 10.162 1.00 0.00 N ATOM 0 H ARG A 105 23.343 -2.437 4.125 1.00 0.00 H new ATOM 0 HA ARG A 105 21.678 -0.659 5.427 1.00 0.00 H new ATOM 0 HB2 ARG A 105 23.931 -1.359 6.188 1.00 0.00 H new ATOM 0 HB3 ARG A 105 24.670 -0.503 4.849 1.00 0.00 H new ATOM 0 HG2 ARG A 105 23.854 1.647 5.744 1.00 0.00 H new ATOM 0 HG3 ARG A 105 23.047 0.813 7.057 1.00 0.00 H new ATOM 0 HD2 ARG A 105 26.047 0.807 6.537 1.00 0.00 H new ATOM 0 HD3 ARG A 105 25.228 1.760 7.759 1.00 0.00 H new ATOM 0 HE ARG A 105 25.810 -1.125 7.854 1.00 0.00 H new ATOM 0 HH11 ARG A 105 23.898 1.544 9.167 1.00 0.00 H new ATOM 0 HH12 ARG A 105 23.610 0.733 10.710 1.00 0.00 H new ATOM 0 HH21 ARG A 105 25.453 -2.152 9.846 1.00 0.00 H new ATOM 0 HH22 ARG A 105 24.488 -1.353 11.092 1.00 0.00 H new ATOM 1741 N GLU A 106 22.845 0.577 2.638 1.00 0.00 N ATOM 1742 CA GLU A 106 22.730 1.701 1.718 1.00 0.00 C ATOM 1743 C GLU A 106 21.265 2.065 1.475 1.00 0.00 C ATOM 1744 O GLU A 106 20.845 3.192 1.739 1.00 0.00 O ATOM 1745 CB GLU A 106 23.412 1.368 0.391 1.00 0.00 C ATOM 1746 CG GLU A 106 23.390 2.509 -0.613 1.00 0.00 C ATOM 1747 CD GLU A 106 24.280 3.666 -0.211 1.00 0.00 C ATOM 1748 OE1 GLU A 106 24.120 4.198 0.904 1.00 0.00 O ATOM 1749 OE2 GLU A 106 25.154 4.054 -1.012 1.00 0.00 O ATOM 0 H GLU A 106 23.338 -0.231 2.258 1.00 0.00 H new ATOM 0 HA GLU A 106 23.225 2.560 2.170 1.00 0.00 H new ATOM 0 HB2 GLU A 106 24.447 1.087 0.586 1.00 0.00 H new ATOM 0 HB3 GLU A 106 22.924 0.499 -0.050 1.00 0.00 H new ATOM 0 HG2 GLU A 106 23.706 2.135 -1.587 1.00 0.00 H new ATOM 0 HG3 GLU A 106 22.367 2.867 -0.726 1.00 0.00 H new ATOM 1756 N GLU A 107 20.493 1.095 0.998 1.00 0.00 N ATOM 1757 CA GLU A 107 19.081 1.308 0.705 1.00 0.00 C ATOM 1758 C GLU A 107 18.318 1.593 1.999 1.00 0.00 C ATOM 1759 O GLU A 107 17.385 2.397 2.022 1.00 0.00 O ATOM 1760 CB GLU A 107 18.494 0.071 0.010 1.00 0.00 C ATOM 1761 CG GLU A 107 17.101 0.282 -0.570 1.00 0.00 C ATOM 1762 CD GLU A 107 17.117 0.964 -1.928 1.00 0.00 C ATOM 1763 OE1 GLU A 107 17.324 2.190 -1.990 1.00 0.00 O ATOM 1764 OE2 GLU A 107 16.908 0.269 -2.947 1.00 0.00 O ATOM 0 H GLU A 107 20.823 0.149 0.805 1.00 0.00 H new ATOM 0 HA GLU A 107 18.983 2.165 0.039 1.00 0.00 H new ATOM 0 HB2 GLU A 107 19.166 -0.235 -0.792 1.00 0.00 H new ATOM 0 HB3 GLU A 107 18.457 -0.750 0.726 1.00 0.00 H new ATOM 0 HG2 GLU A 107 16.602 -0.683 -0.661 1.00 0.00 H new ATOM 0 HG3 GLU A 107 16.512 0.882 0.124 1.00 0.00 H new ATOM 1771 N VAL A 108 18.737 0.937 3.079 1.00 0.00 N ATOM 1772 CA VAL A 108 18.099 1.109 4.381 1.00 0.00 C ATOM 1773 C VAL A 108 18.197 2.557 4.856 1.00 0.00 C ATOM 1774 O VAL A 108 17.179 3.197 5.105 1.00 0.00 O ATOM 1775 CB VAL A 108 18.712 0.176 5.451 1.00 0.00 C ATOM 1776 CG1 VAL A 108 18.114 0.456 6.824 1.00 0.00 C ATOM 1777 CG2 VAL A 108 18.501 -1.282 5.073 1.00 0.00 C ATOM 0 H VAL A 108 19.517 0.280 3.077 1.00 0.00 H new ATOM 0 HA VAL A 108 17.050 0.844 4.251 1.00 0.00 H new ATOM 0 HB VAL A 108 19.783 0.374 5.496 1.00 0.00 H new ATOM 0 HG11 VAL A 108 18.561 -0.213 7.559 1.00 0.00 H new ATOM 0 HG12 VAL A 108 18.315 1.490 7.105 1.00 0.00 H new ATOM 0 HG13 VAL A 108 17.037 0.292 6.792 1.00 0.00 H new ATOM 0 HG21 VAL A 108 18.939 -1.923 5.838 1.00 0.00 H new ATOM 0 HG22 VAL A 108 17.433 -1.487 4.996 1.00 0.00 H new ATOM 0 HG23 VAL A 108 18.979 -1.482 4.114 1.00 0.00 H new ATOM 1787 N GLN A 109 19.418 3.076 4.956 1.00 0.00 N ATOM 1788 CA GLN A 109 19.641 4.422 5.460 1.00 0.00 C ATOM 1789 C GLN A 109 18.961 5.454 4.563 1.00 0.00 C ATOM 1790 O GLN A 109 18.427 6.459 5.040 1.00 0.00 O ATOM 1791 CB GLN A 109 21.138 4.701 5.537 1.00 0.00 C ATOM 1792 CG GLN A 109 21.473 6.011 6.215 1.00 0.00 C ATOM 1793 CD GLN A 109 22.956 6.324 6.193 1.00 0.00 C ATOM 1794 OE1 GLN A 109 23.781 5.291 6.160 1.00 0.00 O flip ATOM 1795 NE2 GLN A 109 23.357 7.488 6.197 1.00 0.00 N flip ATOM 0 H GLN A 109 20.269 2.580 4.693 1.00 0.00 H new ATOM 0 HA GLN A 109 19.208 4.497 6.458 1.00 0.00 H new ATOM 0 HB2 GLN A 109 21.624 3.887 6.076 1.00 0.00 H new ATOM 0 HB3 GLN A 109 21.551 4.707 4.528 1.00 0.00 H new ATOM 0 HG2 GLN A 109 20.929 6.818 5.724 1.00 0.00 H new ATOM 0 HG3 GLN A 109 21.129 5.978 7.249 1.00 0.00 H new ATOM 0 HE21 GLN A 109 22.688 8.258 6.223 1.00 0.00 H new ATOM 0 HE22 GLN A 109 24.358 7.683 6.174 1.00 0.00 H new ATOM 1804 N LYS A 110 18.983 5.180 3.265 1.00 0.00 N ATOM 1805 CA LYS A 110 18.345 6.029 2.268 1.00 0.00 C ATOM 1806 C LYS A 110 16.872 6.278 2.605 1.00 0.00 C ATOM 1807 O LYS A 110 16.423 7.425 2.656 1.00 0.00 O ATOM 1808 CB LYS A 110 18.488 5.363 0.899 1.00 0.00 C ATOM 1809 CG LYS A 110 17.621 5.955 -0.194 1.00 0.00 C ATOM 1810 CD LYS A 110 17.786 5.162 -1.476 1.00 0.00 C ATOM 1811 CE LYS A 110 16.679 5.446 -2.470 1.00 0.00 C ATOM 1812 NZ LYS A 110 16.707 4.479 -3.597 1.00 0.00 N ATOM 0 H LYS A 110 19.446 4.360 2.873 1.00 0.00 H new ATOM 0 HA LYS A 110 18.835 7.003 2.258 1.00 0.00 H new ATOM 0 HB2 LYS A 110 19.531 5.425 0.588 1.00 0.00 H new ATOM 0 HB3 LYS A 110 18.248 4.305 1.000 1.00 0.00 H new ATOM 0 HG2 LYS A 110 16.576 5.947 0.116 1.00 0.00 H new ATOM 0 HG3 LYS A 110 17.896 6.996 -0.363 1.00 0.00 H new ATOM 0 HD2 LYS A 110 18.748 5.401 -1.928 1.00 0.00 H new ATOM 0 HD3 LYS A 110 17.799 4.097 -1.244 1.00 0.00 H new ATOM 0 HE2 LYS A 110 15.713 5.394 -1.967 1.00 0.00 H new ATOM 0 HE3 LYS A 110 16.784 6.460 -2.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 15.785 4.480 -4.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 17.450 4.753 -4.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 16.906 3.526 -3.232 1.00 0.00 H new ATOM 1826 N TYR A 111 16.129 5.208 2.855 1.00 0.00 N ATOM 1827 CA TYR A 111 14.712 5.331 3.180 1.00 0.00 C ATOM 1828 C TYR A 111 14.510 5.638 4.659 1.00 0.00 C ATOM 1829 O TYR A 111 13.486 6.200 5.051 1.00 0.00 O ATOM 1830 CB TYR A 111 13.958 4.055 2.803 1.00 0.00 C ATOM 1831 CG TYR A 111 13.803 3.852 1.314 1.00 0.00 C ATOM 1832 CD1 TYR A 111 12.720 4.387 0.631 1.00 0.00 C ATOM 1833 CD2 TYR A 111 14.737 3.124 0.593 1.00 0.00 C ATOM 1834 CE1 TYR A 111 12.570 4.200 -0.731 1.00 0.00 C ATOM 1835 CE2 TYR A 111 14.594 2.933 -0.767 1.00 0.00 C ATOM 1836 CZ TYR A 111 13.512 3.472 -1.423 1.00 0.00 C ATOM 1837 OH TYR A 111 13.372 3.282 -2.778 1.00 0.00 O ATOM 0 H TYR A 111 16.480 4.250 2.840 1.00 0.00 H new ATOM 0 HA TYR A 111 14.312 6.162 2.599 1.00 0.00 H new ATOM 0 HB2 TYR A 111 14.482 3.197 3.224 1.00 0.00 H new ATOM 0 HB3 TYR A 111 12.969 4.080 3.261 1.00 0.00 H new ATOM 0 HD1 TYR A 111 11.981 4.959 1.173 1.00 0.00 H new ATOM 0 HD2 TYR A 111 15.589 2.700 1.103 1.00 0.00 H new ATOM 0 HE1 TYR A 111 11.721 4.622 -1.248 1.00 0.00 H new ATOM 0 HE2 TYR A 111 15.330 2.362 -1.314 1.00 0.00 H new ATOM 0 HH TYR A 111 14.122 2.748 -3.113 1.00 0.00 H new ATOM 1847 N PHE A 112 15.490 5.276 5.476 1.00 0.00 N ATOM 1848 CA PHE A 112 15.437 5.542 6.908 1.00 0.00 C ATOM 1849 C PHE A 112 15.385 7.044 7.163 1.00 0.00 C ATOM 1850 O PHE A 112 14.708 7.509 8.081 1.00 0.00 O ATOM 1851 CB PHE A 112 16.651 4.927 7.612 1.00 0.00 C ATOM 1852 CG PHE A 112 16.567 4.965 9.112 1.00 0.00 C ATOM 1853 CD1 PHE A 112 15.874 3.983 9.801 1.00 0.00 C ATOM 1854 CD2 PHE A 112 17.180 5.979 9.831 1.00 0.00 C ATOM 1855 CE1 PHE A 112 15.793 4.013 11.178 1.00 0.00 C ATOM 1856 CE2 PHE A 112 17.102 6.014 11.208 1.00 0.00 C ATOM 1857 CZ PHE A 112 16.407 5.029 11.884 1.00 0.00 C ATOM 0 H PHE A 112 16.336 4.795 5.170 1.00 0.00 H new ATOM 0 HA PHE A 112 14.534 5.086 7.313 1.00 0.00 H new ATOM 0 HB2 PHE A 112 16.760 3.891 7.290 1.00 0.00 H new ATOM 0 HB3 PHE A 112 17.550 5.456 7.294 1.00 0.00 H new ATOM 0 HD1 PHE A 112 15.392 3.186 9.255 1.00 0.00 H new ATOM 0 HD2 PHE A 112 17.725 6.751 9.307 1.00 0.00 H new ATOM 0 HE1 PHE A 112 15.249 3.242 11.704 1.00 0.00 H new ATOM 0 HE2 PHE A 112 17.583 6.810 11.757 1.00 0.00 H new ATOM 0 HZ PHE A 112 16.344 5.054 12.962 1.00 0.00 H new ATOM 1867 N SER A 113 16.096 7.799 6.340 1.00 0.00 N ATOM 1868 CA SER A 113 16.081 9.247 6.439 1.00 0.00 C ATOM 1869 C SER A 113 14.696 9.786 6.075 1.00 0.00 C ATOM 1870 O SER A 113 14.220 10.756 6.661 1.00 0.00 O ATOM 1871 CB SER A 113 17.153 9.847 5.527 1.00 0.00 C ATOM 1872 OG SER A 113 17.331 11.230 5.781 1.00 0.00 O ATOM 0 H SER A 113 16.690 7.432 5.597 1.00 0.00 H new ATOM 0 HA SER A 113 16.302 9.535 7.467 1.00 0.00 H new ATOM 0 HB2 SER A 113 18.097 9.323 5.678 1.00 0.00 H new ATOM 0 HB3 SER A 113 16.870 9.700 4.485 1.00 0.00 H new ATOM 0 HG SER A 113 18.023 11.586 5.185 1.00 0.00 H new ATOM 1878 N ILE A 114 14.041 9.123 5.128 1.00 0.00 N ATOM 1879 CA ILE A 114 12.723 9.539 4.675 1.00 0.00 C ATOM 1880 C ILE A 114 11.675 9.316 5.765 1.00 0.00 C ATOM 1881 O ILE A 114 10.873 10.200 6.053 1.00 0.00 O ATOM 1882 CB ILE A 114 12.307 8.780 3.395 1.00 0.00 C ATOM 1883 CG1 ILE A 114 13.351 9.001 2.294 1.00 0.00 C ATOM 1884 CG2 ILE A 114 10.929 9.234 2.926 1.00 0.00 C ATOM 1885 CD1 ILE A 114 13.069 8.236 1.019 1.00 0.00 C ATOM 0 H ILE A 114 14.405 8.293 4.659 1.00 0.00 H new ATOM 0 HA ILE A 114 12.779 10.604 4.449 1.00 0.00 H new ATOM 0 HB ILE A 114 12.254 7.715 3.620 1.00 0.00 H new ATOM 0 HG12 ILE A 114 13.402 10.065 2.064 1.00 0.00 H new ATOM 0 HG13 ILE A 114 14.331 8.709 2.672 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.654 8.688 2.024 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.195 9.037 3.708 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.952 10.302 2.711 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.851 8.444 0.289 1.00 0.00 H new ATOM 0 HD12 ILE A 114 13.048 7.167 1.233 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.105 8.545 0.615 1.00 0.00 H new ATOM 1897 N VAL A 115 11.706 8.143 6.390 1.00 0.00 N ATOM 1898 CA VAL A 115 10.714 7.799 7.405 1.00 0.00 C ATOM 1899 C VAL A 115 10.909 8.616 8.689 1.00 0.00 C ATOM 1900 O VAL A 115 9.957 8.845 9.435 1.00 0.00 O ATOM 1901 CB VAL A 115 10.735 6.281 7.726 1.00 0.00 C ATOM 1902 CG1 VAL A 115 12.041 5.868 8.381 1.00 0.00 C ATOM 1903 CG2 VAL A 115 9.550 5.894 8.599 1.00 0.00 C ATOM 0 H VAL A 115 12.402 7.418 6.214 1.00 0.00 H new ATOM 0 HA VAL A 115 9.738 8.049 6.990 1.00 0.00 H new ATOM 0 HB VAL A 115 10.654 5.745 6.780 1.00 0.00 H new ATOM 0 HG11 VAL A 115 12.020 4.799 8.592 1.00 0.00 H new ATOM 0 HG12 VAL A 115 12.871 6.090 7.710 1.00 0.00 H new ATOM 0 HG13 VAL A 115 12.171 6.419 9.313 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.587 4.825 8.810 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.591 6.450 9.535 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.622 6.129 8.078 1.00 0.00 H new ATOM 1913 N SER A 116 12.131 9.072 8.938 1.00 0.00 N ATOM 1914 CA SER A 116 12.413 9.842 10.143 1.00 0.00 C ATOM 1915 C SER A 116 12.087 11.326 9.958 1.00 0.00 C ATOM 1916 O SER A 116 11.459 11.944 10.821 1.00 0.00 O ATOM 1917 CB SER A 116 13.875 9.660 10.555 1.00 0.00 C ATOM 1918 OG SER A 116 14.741 9.789 9.441 1.00 0.00 O ATOM 0 H SER A 116 12.935 8.924 8.328 1.00 0.00 H new ATOM 0 HA SER A 116 11.770 9.464 10.938 1.00 0.00 H new ATOM 0 HB2 SER A 116 14.137 10.400 11.311 1.00 0.00 H new ATOM 0 HB3 SER A 116 14.008 8.679 11.011 1.00 0.00 H new ATOM 0 HG SER A 116 14.981 8.899 9.108 1.00 0.00 H new ATOM 1924 N SER A 117 12.514 11.899 8.838 1.00 0.00 N ATOM 1925 CA SER A 117 12.281 13.313 8.575 1.00 0.00 C ATOM 1926 C SER A 117 10.899 13.549 7.964 1.00 0.00 C ATOM 1927 O SER A 117 10.090 14.306 8.511 1.00 0.00 O ATOM 1928 CB SER A 117 13.373 13.865 7.657 1.00 0.00 C ATOM 1929 OG SER A 117 14.646 13.788 8.280 1.00 0.00 O ATOM 0 H SER A 117 13.021 11.408 8.101 1.00 0.00 H new ATOM 0 HA SER A 117 12.316 13.842 9.527 1.00 0.00 H new ATOM 0 HB2 SER A 117 13.386 13.303 6.723 1.00 0.00 H new ATOM 0 HB3 SER A 117 13.150 14.901 7.403 1.00 0.00 H new ATOM 0 HG SER A 117 15.329 14.145 7.674 1.00 0.00 H new ATOM 1935 N GLY A 118 10.627 12.891 6.844 1.00 0.00 N ATOM 1936 CA GLY A 118 9.356 13.062 6.170 1.00 0.00 C ATOM 1937 C GLY A 118 8.222 12.373 6.901 1.00 0.00 C ATOM 1938 O GLY A 118 7.097 12.874 6.936 1.00 0.00 O ATOM 0 H GLY A 118 11.267 12.240 6.390 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.135 14.126 6.080 1.00 0.00 H new ATOM 0 HA3 GLY A 118 9.428 12.665 5.157 1.00 0.00 H new ATOM 1942 N GLY A 119 8.515 11.217 7.475 1.00 0.00 N ATOM 1943 CA GLY A 119 7.520 10.492 8.234 1.00 0.00 C ATOM 1944 C GLY A 119 7.145 9.173 7.590 1.00 0.00 C ATOM 1945 O GLY A 119 7.531 8.896 6.452 1.00 0.00 O ATOM 0 H GLY A 119 9.429 10.766 7.428 1.00 0.00 H new ATOM 0 HA2 GLY A 119 7.899 10.307 9.239 1.00 0.00 H new ATOM 0 HA3 GLY A 119 6.627 11.108 8.338 1.00 0.00 H new ATOM 1949 N LEU A 120 6.387 8.363 8.319 1.00 0.00 N ATOM 1950 CA LEU A 120 5.938 7.065 7.824 1.00 0.00 C ATOM 1951 C LEU A 120 5.115 7.202 6.534 1.00 0.00 C ATOM 1952 O LEU A 120 5.401 6.510 5.560 1.00 0.00 O ATOM 1953 CB LEU A 120 5.136 6.322 8.902 1.00 0.00 C ATOM 1954 CG LEU A 120 4.653 4.921 8.516 1.00 0.00 C ATOM 1955 CD1 LEU A 120 5.837 3.993 8.286 1.00 0.00 C ATOM 1956 CD2 LEU A 120 3.735 4.363 9.593 1.00 0.00 C ATOM 0 H LEU A 120 6.068 8.583 9.262 1.00 0.00 H new ATOM 0 HA LEU A 120 6.826 6.480 7.586 1.00 0.00 H new ATOM 0 HB2 LEU A 120 5.752 6.241 9.797 1.00 0.00 H new ATOM 0 HB3 LEU A 120 4.268 6.927 9.166 1.00 0.00 H new ATOM 0 HG LEU A 120 4.090 4.992 7.586 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.475 3.002 8.013 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.457 4.387 7.481 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.428 3.924 9.199 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.400 3.367 9.305 1.00 0.00 H new ATOM 0 HD22 LEU A 120 4.276 4.305 10.538 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.871 5.017 9.709 1.00 0.00 H new ATOM 1968 N PRO A 121 4.088 8.090 6.486 1.00 0.00 N ATOM 1969 CA PRO A 121 3.291 8.289 5.267 1.00 0.00 C ATOM 1970 C PRO A 121 4.152 8.688 4.071 1.00 0.00 C ATOM 1971 O PRO A 121 3.918 8.230 2.956 1.00 0.00 O ATOM 1972 CB PRO A 121 2.329 9.421 5.635 1.00 0.00 C ATOM 1973 CG PRO A 121 2.235 9.366 7.117 1.00 0.00 C ATOM 1974 CD PRO A 121 3.596 8.944 7.591 1.00 0.00 C ATOM 0 HA PRO A 121 2.785 7.372 4.964 1.00 0.00 H new ATOM 0 HB2 PRO A 121 2.705 10.387 5.297 1.00 0.00 H new ATOM 0 HB3 PRO A 121 1.353 9.279 5.170 1.00 0.00 H new ATOM 0 HG2 PRO A 121 1.960 10.337 7.529 1.00 0.00 H new ATOM 0 HG3 PRO A 121 1.471 8.657 7.436 1.00 0.00 H new ATOM 0 HD2 PRO A 121 4.248 9.801 7.759 1.00 0.00 H new ATOM 0 HD3 PRO A 121 3.543 8.395 8.531 1.00 0.00 H new ATOM 1982 N ALA A 122 5.156 9.527 4.314 1.00 0.00 N ATOM 1983 CA ALA A 122 6.074 9.958 3.264 1.00 0.00 C ATOM 1984 C ALA A 122 6.848 8.766 2.705 1.00 0.00 C ATOM 1985 O ALA A 122 7.035 8.647 1.490 1.00 0.00 O ATOM 1986 CB ALA A 122 7.030 11.012 3.800 1.00 0.00 C ATOM 0 H ALA A 122 5.355 9.923 5.233 1.00 0.00 H new ATOM 0 HA ALA A 122 5.492 10.397 2.454 1.00 0.00 H new ATOM 0 HB1 ALA A 122 7.709 11.325 3.007 1.00 0.00 H new ATOM 0 HB2 ALA A 122 6.462 11.873 4.152 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.605 10.595 4.626 1.00 0.00 H new ATOM 1992 N LEU A 123 7.283 7.890 3.605 1.00 0.00 N ATOM 1993 CA LEU A 123 7.968 6.660 3.229 1.00 0.00 C ATOM 1994 C LEU A 123 7.054 5.781 2.384 1.00 0.00 C ATOM 1995 O LEU A 123 7.409 5.378 1.276 1.00 0.00 O ATOM 1996 CB LEU A 123 8.399 5.898 4.486 1.00 0.00 C ATOM 1997 CG LEU A 123 9.021 4.525 4.236 1.00 0.00 C ATOM 1998 CD1 LEU A 123 10.391 4.664 3.595 1.00 0.00 C ATOM 1999 CD2 LEU A 123 9.108 3.739 5.534 1.00 0.00 C ATOM 0 H LEU A 123 7.171 8.013 4.611 1.00 0.00 H new ATOM 0 HA LEU A 123 8.850 6.918 2.643 1.00 0.00 H new ATOM 0 HB2 LEU A 123 9.116 6.509 5.033 1.00 0.00 H new ATOM 0 HB3 LEU A 123 7.529 5.773 5.131 1.00 0.00 H new ATOM 0 HG LEU A 123 8.381 3.976 3.545 1.00 0.00 H new ATOM 0 HD11 LEU A 123 10.816 3.674 3.426 1.00 0.00 H new ATOM 0 HD12 LEU A 123 10.296 5.186 2.643 1.00 0.00 H new ATOM 0 HD13 LEU A 123 11.046 5.232 4.256 1.00 0.00 H new ATOM 0 HD21 LEU A 123 9.553 2.763 5.339 1.00 0.00 H new ATOM 0 HD22 LEU A 123 9.725 4.284 6.248 1.00 0.00 H new ATOM 0 HD23 LEU A 123 8.108 3.606 5.946 1.00 0.00 H new ATOM 2011 N VAL A 124 5.869 5.505 2.917 1.00 0.00 N ATOM 2012 CA VAL A 124 4.890 4.657 2.244 1.00 0.00 C ATOM 2013 C VAL A 124 4.531 5.216 0.870 1.00 0.00 C ATOM 2014 O VAL A 124 4.454 4.474 -0.110 1.00 0.00 O ATOM 2015 CB VAL A 124 3.603 4.512 3.087 1.00 0.00 C ATOM 2016 CG1 VAL A 124 2.566 3.683 2.351 1.00 0.00 C ATOM 2017 CG2 VAL A 124 3.913 3.890 4.441 1.00 0.00 C ATOM 0 H VAL A 124 5.560 5.860 3.822 1.00 0.00 H new ATOM 0 HA VAL A 124 5.347 3.675 2.122 1.00 0.00 H new ATOM 0 HB VAL A 124 3.194 5.509 3.250 1.00 0.00 H new ATOM 0 HG11 VAL A 124 1.669 3.595 2.964 1.00 0.00 H new ATOM 0 HG12 VAL A 124 2.315 4.168 1.408 1.00 0.00 H new ATOM 0 HG13 VAL A 124 2.969 2.690 2.152 1.00 0.00 H new ATOM 0 HG21 VAL A 124 2.993 3.797 5.018 1.00 0.00 H new ATOM 0 HG22 VAL A 124 4.352 2.903 4.296 1.00 0.00 H new ATOM 0 HG23 VAL A 124 4.617 4.524 4.980 1.00 0.00 H new ATOM 2027 N ASP A 125 4.329 6.526 0.804 1.00 0.00 N ATOM 2028 CA ASP A 125 3.954 7.197 -0.438 1.00 0.00 C ATOM 2029 C ASP A 125 4.979 6.936 -1.541 1.00 0.00 C ATOM 2030 O ASP A 125 4.615 6.620 -2.675 1.00 0.00 O ATOM 2031 CB ASP A 125 3.817 8.701 -0.197 1.00 0.00 C ATOM 2032 CG ASP A 125 3.460 9.471 -1.450 1.00 0.00 C ATOM 2033 OD1 ASP A 125 2.285 9.429 -1.865 1.00 0.00 O ATOM 2034 OD2 ASP A 125 4.354 10.140 -2.015 1.00 0.00 O ATOM 0 H ASP A 125 4.419 7.152 1.604 1.00 0.00 H new ATOM 0 HA ASP A 125 2.996 6.793 -0.765 1.00 0.00 H new ATOM 0 HB2 ASP A 125 3.051 8.874 0.559 1.00 0.00 H new ATOM 0 HB3 ASP A 125 4.754 9.086 0.205 1.00 0.00 H new ATOM 2039 N ALA A 126 6.258 7.044 -1.194 1.00 0.00 N ATOM 2040 CA ALA A 126 7.336 6.846 -2.158 1.00 0.00 C ATOM 2041 C ALA A 126 7.424 5.387 -2.599 1.00 0.00 C ATOM 2042 O ALA A 126 7.827 5.090 -3.722 1.00 0.00 O ATOM 2043 CB ALA A 126 8.664 7.304 -1.564 1.00 0.00 C ATOM 0 H ALA A 126 6.574 7.268 -0.250 1.00 0.00 H new ATOM 0 HA ALA A 126 7.116 7.448 -3.040 1.00 0.00 H new ATOM 0 HB1 ALA A 126 9.460 7.151 -2.292 1.00 0.00 H new ATOM 0 HB2 ALA A 126 8.603 8.362 -1.309 1.00 0.00 H new ATOM 0 HB3 ALA A 126 8.879 6.726 -0.665 1.00 0.00 H new ATOM 2049 N LEU A 127 7.038 4.480 -1.709 1.00 0.00 N ATOM 2050 CA LEU A 127 7.086 3.054 -2.001 1.00 0.00 C ATOM 2051 C LEU A 127 5.901 2.630 -2.863 1.00 0.00 C ATOM 2052 O LEU A 127 6.057 1.879 -3.825 1.00 0.00 O ATOM 2053 CB LEU A 127 7.100 2.250 -0.697 1.00 0.00 C ATOM 2054 CG LEU A 127 8.299 2.516 0.219 1.00 0.00 C ATOM 2055 CD1 LEU A 127 8.181 1.702 1.497 1.00 0.00 C ATOM 2056 CD2 LEU A 127 9.600 2.193 -0.500 1.00 0.00 C ATOM 0 H LEU A 127 6.688 4.708 -0.778 1.00 0.00 H new ATOM 0 HA LEU A 127 8.001 2.852 -2.557 1.00 0.00 H new ATOM 0 HB2 LEU A 127 6.186 2.467 -0.145 1.00 0.00 H new ATOM 0 HB3 LEU A 127 7.079 1.188 -0.943 1.00 0.00 H new ATOM 0 HG LEU A 127 8.305 3.574 0.483 1.00 0.00 H new ATOM 0 HD11 LEU A 127 9.040 1.902 2.137 1.00 0.00 H new ATOM 0 HD12 LEU A 127 7.266 1.978 2.021 1.00 0.00 H new ATOM 0 HD13 LEU A 127 8.152 0.641 1.251 1.00 0.00 H new ATOM 0 HD21 LEU A 127 10.441 2.388 0.165 1.00 0.00 H new ATOM 0 HD22 LEU A 127 9.603 1.143 -0.792 1.00 0.00 H new ATOM 0 HD23 LEU A 127 9.689 2.817 -1.389 1.00 0.00 H new ATOM 2068 N VAL A 128 4.719 3.122 -2.514 1.00 0.00 N ATOM 2069 CA VAL A 128 3.494 2.760 -3.220 1.00 0.00 C ATOM 2070 C VAL A 128 3.455 3.355 -4.623 1.00 0.00 C ATOM 2071 O VAL A 128 3.108 2.673 -5.585 1.00 0.00 O ATOM 2072 CB VAL A 128 2.238 3.219 -2.440 1.00 0.00 C ATOM 2073 CG1 VAL A 128 0.968 2.984 -3.247 1.00 0.00 C ATOM 2074 CG2 VAL A 128 2.155 2.498 -1.107 1.00 0.00 C ATOM 0 H VAL A 128 4.581 3.776 -1.743 1.00 0.00 H new ATOM 0 HA VAL A 128 3.491 1.673 -3.298 1.00 0.00 H new ATOM 0 HB VAL A 128 2.327 4.290 -2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 128 0.104 3.317 -2.671 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.021 3.545 -4.180 1.00 0.00 H new ATOM 0 HG13 VAL A 128 0.869 1.921 -3.468 1.00 0.00 H new ATOM 0 HG21 VAL A 128 1.267 2.830 -0.568 1.00 0.00 H new ATOM 0 HG22 VAL A 128 2.095 1.423 -1.278 1.00 0.00 H new ATOM 0 HG23 VAL A 128 3.043 2.722 -0.516 1.00 0.00 H new ATOM 2084 N ASP A 129 3.824 4.624 -4.745 1.00 0.00 N ATOM 2085 CA ASP A 129 3.714 5.314 -6.024 1.00 0.00 C ATOM 2086 C ASP A 129 4.954 5.084 -6.884 1.00 0.00 C ATOM 2087 O ASP A 129 5.118 5.704 -7.936 1.00 0.00 O ATOM 2088 CB ASP A 129 3.479 6.811 -5.807 1.00 0.00 C ATOM 2089 CG ASP A 129 3.078 7.523 -7.085 1.00 0.00 C ATOM 2090 OD1 ASP A 129 2.043 7.152 -7.682 1.00 0.00 O ATOM 2091 OD2 ASP A 129 3.786 8.465 -7.496 1.00 0.00 O ATOM 0 H ASP A 129 4.198 5.191 -3.984 1.00 0.00 H new ATOM 0 HA ASP A 129 2.857 4.901 -6.556 1.00 0.00 H new ATOM 0 HB2 ASP A 129 2.700 6.949 -5.057 1.00 0.00 H new ATOM 0 HB3 ASP A 129 4.387 7.265 -5.410 1.00 0.00 H new ATOM 2096 N SER A 130 5.822 4.185 -6.439 1.00 0.00 N ATOM 2097 CA SER A 130 6.996 3.803 -7.211 1.00 0.00 C ATOM 2098 C SER A 130 6.583 3.369 -8.615 1.00 0.00 C ATOM 2099 O SER A 130 5.773 2.449 -8.781 1.00 0.00 O ATOM 2100 CB SER A 130 7.747 2.671 -6.498 1.00 0.00 C ATOM 2101 OG SER A 130 8.752 2.096 -7.325 1.00 0.00 O ATOM 0 H SER A 130 5.734 3.705 -5.543 1.00 0.00 H new ATOM 0 HA SER A 130 7.661 4.663 -7.296 1.00 0.00 H new ATOM 0 HB2 SER A 130 8.204 3.057 -5.587 1.00 0.00 H new ATOM 0 HB3 SER A 130 7.039 1.899 -6.197 1.00 0.00 H new ATOM 0 HG SER A 130 9.494 2.729 -7.426 1.00 0.00 H new ATOM 2107 N GLN A 131 7.126 4.044 -9.623 1.00 0.00 N ATOM 2108 CA GLN A 131 6.811 3.728 -11.009 1.00 0.00 C ATOM 2109 C GLN A 131 7.213 2.293 -11.316 1.00 0.00 C ATOM 2110 O GLN A 131 6.524 1.589 -12.051 1.00 0.00 O ATOM 2111 CB GLN A 131 7.521 4.698 -11.958 1.00 0.00 C ATOM 2112 CG GLN A 131 7.213 4.453 -13.427 1.00 0.00 C ATOM 2113 CD GLN A 131 5.734 4.564 -13.743 1.00 0.00 C ATOM 2114 OE1 GLN A 131 5.236 5.642 -14.064 1.00 0.00 O ATOM 2115 NE2 GLN A 131 5.020 3.453 -13.650 1.00 0.00 N ATOM 0 H GLN A 131 7.786 4.813 -9.505 1.00 0.00 H new ATOM 0 HA GLN A 131 5.736 3.834 -11.158 1.00 0.00 H new ATOM 0 HB2 GLN A 131 7.235 5.718 -11.701 1.00 0.00 H new ATOM 0 HB3 GLN A 131 8.597 4.620 -11.804 1.00 0.00 H new ATOM 0 HG2 GLN A 131 7.765 5.171 -14.034 1.00 0.00 H new ATOM 0 HG3 GLN A 131 7.566 3.461 -13.707 1.00 0.00 H new ATOM 0 HE21 GLN A 131 5.470 2.578 -13.381 1.00 0.00 H new ATOM 0 HE22 GLN A 131 4.020 3.472 -13.848 1.00 0.00 H new ATOM 2124 N GLU A 132 8.329 1.875 -10.739 1.00 0.00 N ATOM 2125 CA GLU A 132 8.798 0.503 -10.854 1.00 0.00 C ATOM 2126 C GLU A 132 7.727 -0.454 -10.343 1.00 0.00 C ATOM 2127 O GLU A 132 7.262 -1.335 -11.066 1.00 0.00 O ATOM 2128 CB GLU A 132 10.092 0.294 -10.047 1.00 0.00 C ATOM 2129 CG GLU A 132 11.187 1.322 -10.314 1.00 0.00 C ATOM 2130 CD GLU A 132 10.927 2.652 -9.633 1.00 0.00 C ATOM 2131 OE1 GLU A 132 11.244 2.783 -8.434 1.00 0.00 O ATOM 2132 OE2 GLU A 132 10.392 3.567 -10.291 1.00 0.00 O ATOM 0 H GLU A 132 8.934 2.476 -10.179 1.00 0.00 H new ATOM 0 HA GLU A 132 9.004 0.302 -11.905 1.00 0.00 H new ATOM 0 HB2 GLU A 132 9.848 0.312 -8.985 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.484 -0.699 -10.267 1.00 0.00 H new ATOM 0 HG2 GLU A 132 12.142 0.925 -9.971 1.00 0.00 H new ATOM 0 HG3 GLU A 132 11.275 1.481 -11.389 1.00 0.00 H new ATOM 2139 N TYR A 133 7.315 -0.245 -9.099 1.00 0.00 N ATOM 2140 CA TYR A 133 6.319 -1.089 -8.453 1.00 0.00 C ATOM 2141 C TYR A 133 5.025 -1.132 -9.267 1.00 0.00 C ATOM 2142 O TYR A 133 4.470 -2.205 -9.520 1.00 0.00 O ATOM 2143 CB TYR A 133 6.044 -0.563 -7.041 1.00 0.00 C ATOM 2144 CG TYR A 133 5.073 -1.400 -6.244 1.00 0.00 C ATOM 2145 CD1 TYR A 133 5.488 -2.571 -5.625 1.00 0.00 C ATOM 2146 CD2 TYR A 133 3.742 -1.020 -6.105 1.00 0.00 C ATOM 2147 CE1 TYR A 133 4.610 -3.339 -4.891 1.00 0.00 C ATOM 2148 CE2 TYR A 133 2.857 -1.784 -5.371 1.00 0.00 C ATOM 2149 CZ TYR A 133 3.296 -2.943 -4.768 1.00 0.00 C ATOM 2150 OH TYR A 133 2.422 -3.707 -4.033 1.00 0.00 O ATOM 0 H TYR A 133 7.661 0.513 -8.511 1.00 0.00 H new ATOM 0 HA TYR A 133 6.707 -2.106 -8.392 1.00 0.00 H new ATOM 0 HB2 TYR A 133 6.987 -0.505 -6.497 1.00 0.00 H new ATOM 0 HB3 TYR A 133 5.655 0.453 -7.114 1.00 0.00 H new ATOM 0 HD1 TYR A 133 6.517 -2.886 -5.720 1.00 0.00 H new ATOM 0 HD2 TYR A 133 3.396 -0.113 -6.579 1.00 0.00 H new ATOM 0 HE1 TYR A 133 4.950 -4.247 -4.415 1.00 0.00 H new ATOM 0 HE2 TYR A 133 1.827 -1.475 -5.270 1.00 0.00 H new ATOM 0 HH TYR A 133 2.807 -3.886 -3.150 1.00 0.00 H new ATOM 2160 N ALA A 134 4.572 0.038 -9.703 1.00 0.00 N ATOM 2161 CA ALA A 134 3.322 0.154 -10.445 1.00 0.00 C ATOM 2162 C ALA A 134 3.430 -0.450 -11.844 1.00 0.00 C ATOM 2163 O ALA A 134 2.427 -0.841 -12.432 1.00 0.00 O ATOM 2164 CB ALA A 134 2.901 1.614 -10.529 1.00 0.00 C ATOM 0 H ALA A 134 5.055 0.924 -9.554 1.00 0.00 H new ATOM 0 HA ALA A 134 2.562 -0.411 -9.906 1.00 0.00 H new ATOM 0 HB1 ALA A 134 1.967 1.692 -11.085 1.00 0.00 H new ATOM 0 HB2 ALA A 134 2.759 2.010 -9.524 1.00 0.00 H new ATOM 0 HB3 ALA A 134 3.675 2.187 -11.039 1.00 0.00 H new ATOM 2170 N ASP A 135 4.644 -0.524 -12.376 1.00 0.00 N ATOM 2171 CA ASP A 135 4.854 -1.058 -13.720 1.00 0.00 C ATOM 2172 C ASP A 135 4.925 -2.581 -13.702 1.00 0.00 C ATOM 2173 O ASP A 135 4.287 -3.252 -14.511 1.00 0.00 O ATOM 2174 CB ASP A 135 6.135 -0.487 -14.333 1.00 0.00 C ATOM 2175 CG ASP A 135 6.279 -0.828 -15.806 1.00 0.00 C ATOM 2176 OD1 ASP A 135 5.677 -0.119 -16.642 1.00 0.00 O ATOM 2177 OD2 ASP A 135 6.996 -1.795 -16.137 1.00 0.00 O ATOM 0 H ASP A 135 5.495 -0.223 -11.902 1.00 0.00 H new ATOM 0 HA ASP A 135 4.003 -0.758 -14.331 1.00 0.00 H new ATOM 0 HB2 ASP A 135 6.140 0.596 -14.212 1.00 0.00 H new ATOM 0 HB3 ASP A 135 6.997 -0.872 -13.789 1.00 0.00 H new ATOM 2182 N TYR A 136 5.698 -3.121 -12.768 1.00 0.00 N ATOM 2183 CA TYR A 136 5.894 -4.566 -12.679 1.00 0.00 C ATOM 2184 C TYR A 136 4.635 -5.277 -12.193 1.00 0.00 C ATOM 2185 O TYR A 136 4.237 -6.296 -12.754 1.00 0.00 O ATOM 2186 CB TYR A 136 7.069 -4.901 -11.752 1.00 0.00 C ATOM 2187 CG TYR A 136 8.430 -4.586 -12.340 1.00 0.00 C ATOM 2188 CD1 TYR A 136 9.101 -5.515 -13.125 1.00 0.00 C ATOM 2189 CD2 TYR A 136 9.044 -3.364 -12.104 1.00 0.00 C ATOM 2190 CE1 TYR A 136 10.342 -5.230 -13.664 1.00 0.00 C ATOM 2191 CE2 TYR A 136 10.282 -3.071 -12.638 1.00 0.00 C ATOM 2192 CZ TYR A 136 10.927 -4.006 -13.415 1.00 0.00 C ATOM 2193 OH TYR A 136 12.161 -3.711 -13.951 1.00 0.00 O ATOM 0 H TYR A 136 6.200 -2.583 -12.062 1.00 0.00 H new ATOM 0 HA TYR A 136 6.120 -4.921 -13.685 1.00 0.00 H new ATOM 0 HB2 TYR A 136 6.951 -4.349 -10.820 1.00 0.00 H new ATOM 0 HB3 TYR A 136 7.030 -5.961 -11.502 1.00 0.00 H new ATOM 0 HD1 TYR A 136 8.646 -6.475 -13.317 1.00 0.00 H new ATOM 0 HD2 TYR A 136 8.544 -2.629 -11.491 1.00 0.00 H new ATOM 0 HE1 TYR A 136 10.850 -5.961 -14.276 1.00 0.00 H new ATOM 0 HE2 TYR A 136 10.742 -2.113 -12.447 1.00 0.00 H new ATOM 0 HH TYR A 136 12.428 -2.808 -13.679 1.00 0.00 H new ATOM 2203 N PHE A 137 4.011 -4.745 -11.152 1.00 0.00 N ATOM 2204 CA PHE A 137 2.839 -5.387 -10.566 1.00 0.00 C ATOM 2205 C PHE A 137 1.551 -4.864 -11.187 1.00 0.00 C ATOM 2206 O PHE A 137 0.591 -5.614 -11.382 1.00 0.00 O ATOM 2207 CB PHE A 137 2.813 -5.172 -9.051 1.00 0.00 C ATOM 2208 CG PHE A 137 3.932 -5.861 -8.323 1.00 0.00 C ATOM 2209 CD1 PHE A 137 5.140 -5.215 -8.106 1.00 0.00 C ATOM 2210 CD2 PHE A 137 3.778 -7.158 -7.858 1.00 0.00 C ATOM 2211 CE1 PHE A 137 6.170 -5.848 -7.438 1.00 0.00 C ATOM 2212 CE2 PHE A 137 4.805 -7.796 -7.189 1.00 0.00 C ATOM 2213 CZ PHE A 137 6.002 -7.140 -6.980 1.00 0.00 C ATOM 0 H PHE A 137 4.293 -3.877 -10.697 1.00 0.00 H new ATOM 0 HA PHE A 137 2.908 -6.455 -10.775 1.00 0.00 H new ATOM 0 HB2 PHE A 137 2.861 -4.103 -8.844 1.00 0.00 H new ATOM 0 HB3 PHE A 137 1.861 -5.530 -8.659 1.00 0.00 H new ATOM 0 HD1 PHE A 137 5.277 -4.205 -8.464 1.00 0.00 H new ATOM 0 HD2 PHE A 137 2.844 -7.676 -8.021 1.00 0.00 H new ATOM 0 HE1 PHE A 137 7.105 -5.333 -7.274 1.00 0.00 H new ATOM 0 HE2 PHE A 137 4.672 -8.806 -6.830 1.00 0.00 H new ATOM 0 HZ PHE A 137 6.807 -7.637 -6.459 1.00 0.00 H new ATOM 2223 N GLY A 138 1.533 -3.579 -11.501 1.00 0.00 N ATOM 2224 CA GLY A 138 0.334 -2.961 -12.029 1.00 0.00 C ATOM 2225 C GLY A 138 -0.490 -2.322 -10.931 1.00 0.00 C ATOM 2226 O GLY A 138 -0.771 -2.954 -9.914 1.00 0.00 O ATOM 0 H GLY A 138 2.330 -2.950 -11.400 1.00 0.00 H new ATOM 0 HA2 GLY A 138 0.607 -2.206 -12.767 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -0.265 -3.710 -12.546 1.00 0.00 H new ATOM 2230 N GLU A 139 -0.885 -1.072 -11.137 1.00 0.00 N ATOM 2231 CA GLU A 139 -1.632 -0.326 -10.127 1.00 0.00 C ATOM 2232 C GLU A 139 -3.039 -0.895 -9.939 1.00 0.00 C ATOM 2233 O GLU A 139 -3.720 -0.583 -8.961 1.00 0.00 O ATOM 2234 CB GLU A 139 -1.708 1.157 -10.504 1.00 0.00 C ATOM 2235 CG GLU A 139 -2.274 1.412 -11.892 1.00 0.00 C ATOM 2236 CD GLU A 139 -2.444 2.887 -12.185 1.00 0.00 C ATOM 2237 OE1 GLU A 139 -1.442 3.556 -12.516 1.00 0.00 O ATOM 2238 OE2 GLU A 139 -3.580 3.386 -12.078 1.00 0.00 O ATOM 0 H GLU A 139 -0.701 -0.551 -11.995 1.00 0.00 H new ATOM 0 HA GLU A 139 -1.100 -0.425 -9.181 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -2.324 1.677 -9.770 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -0.709 1.588 -10.445 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -1.613 0.970 -12.638 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -3.238 0.913 -11.985 1.00 0.00 H new ATOM 2245 N GLU A 140 -3.469 -1.723 -10.881 1.00 0.00 N ATOM 2246 CA GLU A 140 -4.773 -2.369 -10.796 1.00 0.00 C ATOM 2247 C GLU A 140 -4.709 -3.605 -9.903 1.00 0.00 C ATOM 2248 O GLU A 140 -5.722 -4.036 -9.351 1.00 0.00 O ATOM 2249 CB GLU A 140 -5.257 -2.773 -12.193 1.00 0.00 C ATOM 2250 CG GLU A 140 -4.334 -3.758 -12.899 1.00 0.00 C ATOM 2251 CD GLU A 140 -4.822 -4.141 -14.281 1.00 0.00 C ATOM 2252 OE1 GLU A 140 -4.867 -3.259 -15.164 1.00 0.00 O ATOM 2253 OE2 GLU A 140 -5.155 -5.326 -14.494 1.00 0.00 O ATOM 0 H GLU A 140 -2.933 -1.964 -11.715 1.00 0.00 H new ATOM 0 HA GLU A 140 -5.474 -1.657 -10.361 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -6.250 -3.214 -12.110 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -5.356 -1.878 -12.807 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -3.339 -3.321 -12.979 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -4.239 -4.658 -12.291 1.00 0.00 H new ATOM 2260 N THR A 141 -3.511 -4.152 -9.754 1.00 0.00 N ATOM 2261 CA THR A 141 -3.325 -5.429 -9.087 1.00 0.00 C ATOM 2262 C THR A 141 -3.133 -5.250 -7.585 1.00 0.00 C ATOM 2263 O THR A 141 -2.530 -4.274 -7.136 1.00 0.00 O ATOM 2264 CB THR A 141 -2.096 -6.170 -9.659 1.00 0.00 C ATOM 2265 OG1 THR A 141 -2.086 -6.082 -11.093 1.00 0.00 O ATOM 2266 CG2 THR A 141 -2.099 -7.636 -9.248 1.00 0.00 C ATOM 0 H THR A 141 -2.647 -3.725 -10.090 1.00 0.00 H new ATOM 0 HA THR A 141 -4.226 -6.016 -9.264 1.00 0.00 H new ATOM 0 HB THR A 141 -1.203 -5.693 -9.255 1.00 0.00 H new ATOM 0 HG1 THR A 141 -1.176 -5.892 -11.403 1.00 0.00 H new ATOM 0 HG21 THR A 141 -1.223 -8.133 -9.665 1.00 0.00 H new ATOM 0 HG22 THR A 141 -2.075 -7.709 -8.161 1.00 0.00 H new ATOM 0 HG23 THR A 141 -3.002 -8.117 -9.624 1.00 0.00 H new ATOM 2274 N VAL A 142 -3.676 -6.183 -6.817 1.00 0.00 N ATOM 2275 CA VAL A 142 -3.405 -6.252 -5.391 1.00 0.00 C ATOM 2276 C VAL A 142 -2.031 -6.882 -5.181 1.00 0.00 C ATOM 2277 O VAL A 142 -1.718 -7.884 -5.830 1.00 0.00 O ATOM 2278 CB VAL A 142 -4.473 -7.095 -4.651 1.00 0.00 C ATOM 2279 CG1 VAL A 142 -4.253 -7.068 -3.148 1.00 0.00 C ATOM 2280 CG2 VAL A 142 -5.872 -6.613 -4.993 1.00 0.00 C ATOM 0 H VAL A 142 -4.309 -6.905 -7.160 1.00 0.00 H new ATOM 0 HA VAL A 142 -3.432 -5.241 -4.984 1.00 0.00 H new ATOM 0 HB VAL A 142 -4.371 -8.127 -4.987 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -5.019 -7.669 -2.657 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -3.269 -7.475 -2.917 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -4.313 -6.040 -2.790 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -6.606 -7.219 -4.462 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -5.980 -5.570 -4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -6.036 -6.703 -6.067 1.00 0.00 H new ATOM 2290 N PRO A 143 -1.187 -6.284 -4.314 1.00 0.00 N ATOM 2291 CA PRO A 143 0.146 -6.805 -3.997 1.00 0.00 C ATOM 2292 C PRO A 143 0.155 -8.326 -3.873 1.00 0.00 C ATOM 2293 O PRO A 143 -0.532 -8.895 -3.027 1.00 0.00 O ATOM 2294 CB PRO A 143 0.455 -6.156 -2.649 1.00 0.00 C ATOM 2295 CG PRO A 143 -0.279 -4.858 -2.673 1.00 0.00 C ATOM 2296 CD PRO A 143 -1.469 -5.035 -3.584 1.00 0.00 C ATOM 0 HA PRO A 143 0.876 -6.580 -4.775 1.00 0.00 H new ATOM 0 HB2 PRO A 143 0.122 -6.783 -1.822 1.00 0.00 H new ATOM 0 HB3 PRO A 143 1.526 -6.002 -2.521 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -0.601 -4.579 -1.670 1.00 0.00 H new ATOM 0 HG3 PRO A 143 0.367 -4.058 -3.034 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -2.397 -5.107 -3.017 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -1.577 -4.191 -4.266 1.00 0.00 H new