USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 931 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 Single : A 9 HIS : no HD1:sc=-0.00495 X(o=-0.005,f=-0.066) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.0381) USER MOD Single : A 16 LYS NZ :NH3+ 146:sc= 0 (180deg=-0.804) USER MOD Single : A 20 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00583) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ -168:sc= 0.365 (180deg=0.145) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 130:sc= 1.27 USER MOD Single : A 53 SER OG : rot 180:sc= 0.0267 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0328 USER MOD Single : A 59 GLN : amide:sc= -0.607 X(o=-0.61,f=-0.67) USER MOD Single : A 61 TYR OH : rot 17:sc= 0.578 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -0.293 X(o=-0.29,f=-0.29) USER MOD Single : A 81 ASN : amide:sc= -0.172 K(o=-0.17,f=-1.7!) USER MOD Single : A 82 ASN : amide:sc= -0.189 X(o=-0.19,f=-0.19) USER MOD Single : A 83 THR OG1 : rot 77:sc= 0.328 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot -40:sc= 0.00992 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 MET CE :methyl -157:sc= 0 (180deg=-0.186) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 TYR OH : rot 30:sc= 0.592 USER MOD Single : A 98 ASN : amide:sc= -1.37 K(o=-1.4,f=-2.4!) USER MOD Single : A 99 HIS : no HD1:sc= -0.475 X(o=-0.48,f=-0.22) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 21:sc= 0.95 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= -0.166 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : B 732 TYR OH : rot 120:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 197 N HIS A 9 -9.683 13.315 2.488 1.00 0.00 N ATOM 198 CA HIS A 9 -10.884 14.140 2.346 1.00 0.00 C ATOM 199 C HIS A 9 -12.126 13.287 2.047 1.00 0.00 C ATOM 200 O HIS A 9 -13.093 13.380 2.815 1.00 0.00 O ATOM 201 CB HIS A 9 -10.697 15.235 1.277 1.00 0.00 C ATOM 202 CG HIS A 9 -10.675 16.622 1.859 1.00 0.00 C ATOM 203 ND1 HIS A 9 -9.901 17.024 2.917 1.00 0.00 N ATOM 204 CD2 HIS A 9 -11.429 17.695 1.465 1.00 0.00 C ATOM 205 CE1 HIS A 9 -10.190 18.304 3.174 1.00 0.00 C ATOM 206 NE2 HIS A 9 -11.093 18.775 2.292 1.00 0.00 N ATOM 0 HA HIS A 9 -11.045 14.635 3.304 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -9.765 15.057 0.740 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -11.504 15.165 0.547 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -12.152 17.707 0.662 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -9.759 18.881 3.978 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -11.458 19.726 2.237 1.00 0.00 H new ATOM 214 N PRO A 10 -12.168 12.483 0.968 1.00 0.00 N ATOM 215 CA PRO A 10 -13.311 11.647 0.643 1.00 0.00 C ATOM 216 C PRO A 10 -13.372 10.388 1.537 1.00 0.00 C ATOM 217 O PRO A 10 -13.272 9.264 1.039 1.00 0.00 O ATOM 218 CB PRO A 10 -13.134 11.345 -0.848 1.00 0.00 C ATOM 219 CG PRO A 10 -11.623 11.192 -0.981 1.00 0.00 C ATOM 220 CD PRO A 10 -11.130 12.289 -0.040 1.00 0.00 C ATOM 0 HA PRO A 10 -14.269 12.132 0.833 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -13.661 10.437 -1.143 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -13.516 12.152 -1.473 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -11.281 10.203 -0.675 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -11.282 11.345 -2.005 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -10.188 12.002 0.427 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -10.946 13.213 -0.588 1.00 0.00 H new ATOM 228 N PHE A 11 -13.599 10.566 2.846 1.00 0.00 N ATOM 229 CA PHE A 11 -13.700 9.494 3.832 1.00 0.00 C ATOM 230 C PHE A 11 -14.672 8.407 3.386 1.00 0.00 C ATOM 231 O PHE A 11 -14.366 7.224 3.524 1.00 0.00 O ATOM 232 CB PHE A 11 -14.195 10.019 5.187 1.00 0.00 C ATOM 233 CG PHE A 11 -13.134 10.655 6.049 1.00 0.00 C ATOM 234 CD1 PHE A 11 -12.221 9.844 6.746 1.00 0.00 C ATOM 235 CD2 PHE A 11 -13.071 12.050 6.178 1.00 0.00 C ATOM 236 CE1 PHE A 11 -11.224 10.440 7.534 1.00 0.00 C ATOM 237 CE2 PHE A 11 -12.062 12.642 6.956 1.00 0.00 C ATOM 238 CZ PHE A 11 -11.127 11.836 7.624 1.00 0.00 C ATOM 0 H PHE A 11 -13.721 11.492 3.255 1.00 0.00 H new ATOM 0 HA PHE A 11 -12.695 9.084 3.928 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -14.985 10.749 5.010 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -14.643 9.192 5.739 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -12.287 8.768 6.675 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -13.800 12.671 5.678 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -10.526 9.818 8.075 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -12.006 13.717 7.040 1.00 0.00 H new ATOM 0 HZ PHE A 11 -10.337 12.289 8.204 1.00 0.00 H new ATOM 248 N GLU A 12 -15.845 8.788 2.866 1.00 0.00 N ATOM 249 CA GLU A 12 -16.818 7.797 2.441 1.00 0.00 C ATOM 250 C GLU A 12 -16.299 6.953 1.286 1.00 0.00 C ATOM 251 O GLU A 12 -16.613 5.776 1.250 1.00 0.00 O ATOM 252 CB GLU A 12 -18.178 8.419 2.074 1.00 0.00 C ATOM 253 CG GLU A 12 -18.250 9.058 0.675 1.00 0.00 C ATOM 254 CD GLU A 12 -19.658 9.483 0.287 1.00 0.00 C ATOM 255 OE1 GLU A 12 -20.524 8.589 0.129 1.00 0.00 O ATOM 256 OE2 GLU A 12 -19.905 10.694 0.107 1.00 0.00 O ATOM 0 H GLU A 12 -16.132 9.758 2.734 1.00 0.00 H new ATOM 0 HA GLU A 12 -16.974 7.147 3.302 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -18.943 7.646 2.143 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -18.424 9.178 2.816 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -17.593 9.927 0.644 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -17.875 8.348 -0.062 1.00 0.00 H new ATOM 263 N TYR A 13 -15.539 7.537 0.358 1.00 0.00 N ATOM 264 CA TYR A 13 -15.016 6.846 -0.810 1.00 0.00 C ATOM 265 C TYR A 13 -13.906 5.879 -0.417 1.00 0.00 C ATOM 266 O TYR A 13 -13.813 4.777 -0.963 1.00 0.00 O ATOM 267 CB TYR A 13 -14.547 7.890 -1.829 1.00 0.00 C ATOM 268 CG TYR A 13 -14.584 7.432 -3.271 1.00 0.00 C ATOM 269 CD1 TYR A 13 -15.769 7.571 -4.018 1.00 0.00 C ATOM 270 CD2 TYR A 13 -13.433 6.897 -3.875 1.00 0.00 C ATOM 271 CE1 TYR A 13 -15.805 7.201 -5.372 1.00 0.00 C ATOM 272 CE2 TYR A 13 -13.461 6.526 -5.231 1.00 0.00 C ATOM 273 CZ TYR A 13 -14.645 6.680 -5.985 1.00 0.00 C ATOM 274 OH TYR A 13 -14.628 6.361 -7.308 1.00 0.00 O ATOM 0 H TYR A 13 -15.268 8.519 0.402 1.00 0.00 H new ATOM 0 HA TYR A 13 -15.798 6.241 -1.269 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -15.169 8.779 -1.729 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -13.527 8.185 -1.582 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -16.657 7.965 -3.546 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -12.529 6.771 -3.298 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -16.716 7.314 -5.942 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -12.574 6.122 -5.697 1.00 0.00 H new ATOM 0 HH TYR A 13 -13.743 6.018 -7.550 1.00 0.00 H new ATOM 284 N ARG A 14 -13.008 6.285 0.497 1.00 0.00 N ATOM 285 CA ARG A 14 -11.953 5.362 0.916 1.00 0.00 C ATOM 286 C ARG A 14 -12.618 4.235 1.704 1.00 0.00 C ATOM 287 O ARG A 14 -12.353 3.073 1.414 1.00 0.00 O ATOM 288 CB ARG A 14 -10.813 6.059 1.695 1.00 0.00 C ATOM 289 CG ARG A 14 -11.246 6.855 2.935 1.00 0.00 C ATOM 290 CD ARG A 14 -10.071 7.522 3.666 1.00 0.00 C ATOM 291 NE ARG A 14 -10.022 7.166 5.098 1.00 0.00 N ATOM 292 CZ ARG A 14 -9.416 7.852 6.075 1.00 0.00 C ATOM 293 NH1 ARG A 14 -8.870 9.022 5.789 1.00 0.00 N ATOM 294 NH2 ARG A 14 -9.382 7.382 7.316 1.00 0.00 N ATOM 0 H ARG A 14 -12.992 7.204 0.940 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.452 4.951 0.040 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -10.093 5.302 2.005 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.293 6.734 1.015 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -11.961 7.621 2.636 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -11.763 6.188 3.625 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -9.136 7.227 3.189 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -10.152 8.604 3.566 1.00 0.00 H new ATOM 0 HE ARG A 14 -10.500 6.307 5.372 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -8.915 9.387 4.838 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -8.404 9.560 6.520 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -9.821 6.488 7.535 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -8.917 7.915 8.051 1.00 0.00 H new ATOM 308 N LYS A 15 -13.579 4.542 2.579 1.00 0.00 N ATOM 309 CA LYS A 15 -14.243 3.518 3.366 1.00 0.00 C ATOM 310 C LYS A 15 -15.088 2.598 2.506 1.00 0.00 C ATOM 311 O LYS A 15 -14.953 1.393 2.641 1.00 0.00 O ATOM 312 CB LYS A 15 -15.041 4.157 4.511 1.00 0.00 C ATOM 313 CG LYS A 15 -15.741 3.114 5.399 1.00 0.00 C ATOM 314 CD LYS A 15 -17.099 2.654 4.870 1.00 0.00 C ATOM 315 CE LYS A 15 -17.988 2.370 6.073 1.00 0.00 C ATOM 316 NZ LYS A 15 -18.544 3.596 6.687 1.00 0.00 N ATOM 0 H LYS A 15 -13.909 5.491 2.755 1.00 0.00 H new ATOM 0 HA LYS A 15 -13.479 2.883 3.814 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -14.371 4.759 5.124 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -15.787 4.834 4.095 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -15.090 2.246 5.503 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -15.875 3.533 6.396 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -17.544 3.422 4.238 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -16.988 1.760 4.256 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -18.808 1.721 5.766 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -17.413 1.825 6.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -18.750 3.419 7.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -17.853 4.369 6.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -19.421 3.864 6.195 1.00 0.00 H new ATOM 330 N LYS A 16 -15.975 3.114 1.655 1.00 0.00 N ATOM 331 CA LYS A 16 -16.847 2.292 0.819 1.00 0.00 C ATOM 332 C LYS A 16 -16.056 1.380 -0.092 1.00 0.00 C ATOM 333 O LYS A 16 -16.380 0.190 -0.125 1.00 0.00 O ATOM 334 CB LYS A 16 -17.806 3.161 -0.002 1.00 0.00 C ATOM 335 CG LYS A 16 -18.961 3.670 0.869 1.00 0.00 C ATOM 336 CD LYS A 16 -19.665 4.856 0.207 1.00 0.00 C ATOM 337 CE LYS A 16 -20.933 5.305 0.943 1.00 0.00 C ATOM 338 NZ LYS A 16 -20.734 5.470 2.400 1.00 0.00 N ATOM 0 H LYS A 16 -16.109 4.117 1.526 1.00 0.00 H new ATOM 0 HA LYS A 16 -17.434 1.666 1.491 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -17.265 4.007 -0.426 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -18.202 2.584 -0.838 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -19.677 2.865 1.037 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -18.581 3.967 1.846 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -18.971 5.695 0.151 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -19.925 4.588 -0.817 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -21.275 6.250 0.520 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -21.723 4.574 0.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -21.325 6.253 2.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -21.003 4.592 2.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -19.734 5.681 2.592 1.00 0.00 H new ATOM 352 N GLU A 17 -15.047 1.887 -0.794 1.00 0.00 N ATOM 353 CA GLU A 17 -14.268 1.056 -1.697 1.00 0.00 C ATOM 354 C GLU A 17 -13.452 0.029 -0.899 1.00 0.00 C ATOM 355 O GLU A 17 -13.425 -1.149 -1.258 1.00 0.00 O ATOM 356 CB GLU A 17 -13.383 1.952 -2.560 1.00 0.00 C ATOM 357 CG GLU A 17 -14.094 2.770 -3.666 1.00 0.00 C ATOM 358 CD GLU A 17 -15.632 2.849 -3.612 1.00 0.00 C ATOM 359 OE1 GLU A 17 -16.180 3.700 -2.885 1.00 0.00 O ATOM 360 OE2 GLU A 17 -16.285 2.034 -4.312 1.00 0.00 O ATOM 0 H GLU A 17 -14.753 2.863 -0.754 1.00 0.00 H new ATOM 0 HA GLU A 17 -14.928 0.494 -2.358 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.860 2.648 -1.904 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -12.624 1.328 -3.032 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -13.703 3.787 -3.636 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -13.812 2.348 -4.631 1.00 0.00 H new ATOM 367 N GLY A 18 -12.815 0.445 0.205 1.00 0.00 N ATOM 368 CA GLY A 18 -12.020 -0.442 1.044 1.00 0.00 C ATOM 369 C GLY A 18 -12.904 -1.544 1.627 1.00 0.00 C ATOM 370 O GLY A 18 -12.546 -2.724 1.587 1.00 0.00 O ATOM 0 H GLY A 18 -12.841 1.410 0.536 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -11.214 -0.883 0.458 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -11.555 0.126 1.849 1.00 0.00 H new ATOM 374 N GLU A 19 -14.075 -1.172 2.148 1.00 0.00 N ATOM 375 CA GLU A 19 -15.069 -2.055 2.737 1.00 0.00 C ATOM 376 C GLU A 19 -15.513 -3.067 1.686 1.00 0.00 C ATOM 377 O GLU A 19 -15.651 -4.257 1.998 1.00 0.00 O ATOM 378 CB GLU A 19 -16.281 -1.225 3.220 1.00 0.00 C ATOM 379 CG GLU A 19 -17.462 -2.086 3.691 1.00 0.00 C ATOM 380 CD GLU A 19 -18.728 -1.305 4.075 1.00 0.00 C ATOM 381 OE1 GLU A 19 -18.945 -0.156 3.630 1.00 0.00 O ATOM 382 OE2 GLU A 19 -19.581 -1.892 4.781 1.00 0.00 O ATOM 0 H GLU A 19 -14.365 -0.194 2.169 1.00 0.00 H new ATOM 0 HA GLU A 19 -14.641 -2.580 3.591 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -15.965 -0.577 4.037 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -16.614 -0.577 2.409 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.715 -2.791 2.899 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -17.142 -2.674 4.551 1.00 0.00 H new ATOM 389 N LYS A 20 -15.704 -2.611 0.447 1.00 0.00 N ATOM 390 CA LYS A 20 -16.142 -3.458 -0.643 1.00 0.00 C ATOM 391 C LYS A 20 -15.081 -4.474 -0.972 1.00 0.00 C ATOM 392 O LYS A 20 -15.427 -5.646 -1.012 1.00 0.00 O ATOM 393 CB LYS A 20 -16.440 -2.618 -1.880 1.00 0.00 C ATOM 394 CG LYS A 20 -17.247 -3.344 -2.961 1.00 0.00 C ATOM 395 CD LYS A 20 -18.655 -3.767 -2.525 1.00 0.00 C ATOM 396 CE LYS A 20 -19.641 -3.708 -3.702 1.00 0.00 C ATOM 397 NZ LYS A 20 -19.275 -4.624 -4.799 1.00 0.00 N ATOM 0 H LYS A 20 -15.556 -1.638 0.179 1.00 0.00 H new ATOM 0 HA LYS A 20 -17.051 -3.974 -0.333 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -16.986 -1.725 -1.575 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -15.497 -2.283 -2.312 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -17.330 -2.695 -3.833 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -16.696 -4.230 -3.275 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -18.625 -4.779 -2.122 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -19.002 -3.115 -1.723 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -20.641 -3.956 -3.346 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -19.683 -2.688 -4.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -20.000 -4.581 -5.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -18.355 -4.342 -5.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -19.211 -5.596 -4.433 1.00 0.00 H new ATOM 411 N ILE A 21 -13.806 -4.089 -1.121 1.00 0.00 N ATOM 412 CA ILE A 21 -12.801 -5.091 -1.447 1.00 0.00 C ATOM 413 C ILE A 21 -12.578 -6.022 -0.253 1.00 0.00 C ATOM 414 O ILE A 21 -12.422 -7.222 -0.469 1.00 0.00 O ATOM 415 CB ILE A 21 -11.493 -4.391 -1.884 1.00 0.00 C ATOM 416 CG1 ILE A 21 -11.627 -3.708 -3.266 1.00 0.00 C ATOM 417 CG2 ILE A 21 -10.290 -5.352 -1.885 1.00 0.00 C ATOM 418 CD1 ILE A 21 -11.898 -4.659 -4.443 1.00 0.00 C ATOM 0 H ILE A 21 -13.463 -3.133 -1.025 1.00 0.00 H new ATOM 0 HA ILE A 21 -13.148 -5.704 -2.278 1.00 0.00 H new ATOM 0 HB ILE A 21 -11.309 -3.617 -1.139 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.435 -2.978 -3.216 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -10.710 -3.155 -3.470 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -9.395 -4.814 -2.199 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -10.141 -5.750 -0.881 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -10.481 -6.173 -2.576 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -11.975 -4.083 -5.365 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -11.080 -5.374 -4.529 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -12.831 -5.195 -4.270 1.00 0.00 H new ATOM 430 N ARG A 22 -12.739 -5.555 0.991 1.00 0.00 N ATOM 431 CA ARG A 22 -12.529 -6.411 2.157 1.00 0.00 C ATOM 432 C ARG A 22 -13.628 -7.452 2.254 1.00 0.00 C ATOM 433 O ARG A 22 -13.358 -8.614 2.574 1.00 0.00 O ATOM 434 CB ARG A 22 -12.446 -5.561 3.437 1.00 0.00 C ATOM 435 CG ARG A 22 -12.247 -6.376 4.724 1.00 0.00 C ATOM 436 CD ARG A 22 -11.087 -7.373 4.629 1.00 0.00 C ATOM 437 NE ARG A 22 -10.822 -8.016 5.922 1.00 0.00 N ATOM 438 CZ ARG A 22 -11.452 -9.072 6.436 1.00 0.00 C ATOM 439 NH1 ARG A 22 -12.515 -9.583 5.828 1.00 0.00 N ATOM 440 NH2 ARG A 22 -11.044 -9.618 7.571 1.00 0.00 N ATOM 0 H ARG A 22 -13.012 -4.597 1.212 1.00 0.00 H new ATOM 0 HA ARG A 22 -11.581 -6.937 2.043 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.622 -4.854 3.337 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -13.360 -4.974 3.530 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -12.065 -5.694 5.555 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -13.166 -6.917 4.951 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -11.320 -8.134 3.884 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -10.190 -6.857 4.287 1.00 0.00 H new ATOM 0 HE ARG A 22 -10.076 -7.611 6.487 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -12.855 -9.167 4.961 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -12.992 -10.391 6.228 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.239 -9.231 8.063 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -11.535 -10.426 7.954 1.00 0.00 H new ATOM 454 N LYS A 23 -14.875 -7.066 2.004 1.00 0.00 N ATOM 455 CA LYS A 23 -15.969 -8.016 2.080 1.00 0.00 C ATOM 456 C LYS A 23 -16.016 -8.863 0.809 1.00 0.00 C ATOM 457 O LYS A 23 -16.332 -10.049 0.899 1.00 0.00 O ATOM 458 CB LYS A 23 -17.290 -7.261 2.349 1.00 0.00 C ATOM 459 CG LYS A 23 -18.324 -8.077 3.153 1.00 0.00 C ATOM 460 CD LYS A 23 -19.230 -8.862 2.206 1.00 0.00 C ATOM 461 CE LYS A 23 -20.008 -10.017 2.837 1.00 0.00 C ATOM 462 NZ LYS A 23 -20.347 -11.011 1.794 1.00 0.00 N ATOM 0 H LYS A 23 -15.147 -6.116 1.751 1.00 0.00 H new ATOM 0 HA LYS A 23 -15.815 -8.705 2.910 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -17.068 -6.341 2.890 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -17.732 -6.971 1.396 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -17.811 -8.762 3.828 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -18.924 -7.409 3.771 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -19.943 -8.170 1.758 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -18.620 -9.260 1.395 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -19.413 -10.485 3.621 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -20.917 -9.643 3.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -20.876 -11.797 2.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -20.930 -10.560 1.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -19.473 -11.376 1.365 1.00 0.00 H new ATOM 476 N LYS A 24 -15.721 -8.284 -0.365 1.00 0.00 N ATOM 477 CA LYS A 24 -15.761 -9.018 -1.625 1.00 0.00 C ATOM 478 C LYS A 24 -14.673 -10.083 -1.663 1.00 0.00 C ATOM 479 O LYS A 24 -14.999 -11.232 -1.949 1.00 0.00 O ATOM 480 CB LYS A 24 -15.580 -8.050 -2.836 1.00 0.00 C ATOM 481 CG LYS A 24 -15.514 -8.738 -4.209 1.00 0.00 C ATOM 482 CD LYS A 24 -16.764 -9.491 -4.690 1.00 0.00 C ATOM 483 CE LYS A 24 -17.809 -8.535 -5.272 1.00 0.00 C ATOM 484 NZ LYS A 24 -18.989 -9.241 -5.812 1.00 0.00 N ATOM 0 H LYS A 24 -15.452 -7.305 -0.461 1.00 0.00 H new ATOM 0 HA LYS A 24 -16.736 -9.500 -1.697 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -16.406 -7.339 -2.841 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -14.666 -7.475 -2.689 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.272 -7.979 -4.953 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -14.683 -9.443 -4.191 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -16.480 -10.224 -5.445 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.199 -10.044 -3.857 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.130 -7.839 -4.497 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.352 -7.942 -6.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -19.664 -8.548 -6.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -18.690 -9.886 -6.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -19.445 -9.787 -5.053 1.00 0.00 H new ATOM 498 N TYR A 25 -13.438 -9.749 -1.279 1.00 0.00 N ATOM 499 CA TYR A 25 -12.303 -10.660 -1.280 1.00 0.00 C ATOM 500 C TYR A 25 -11.543 -10.499 0.047 1.00 0.00 C ATOM 501 O TYR A 25 -10.557 -9.770 0.111 1.00 0.00 O ATOM 502 CB TYR A 25 -11.397 -10.379 -2.493 1.00 0.00 C ATOM 503 CG TYR A 25 -12.060 -10.287 -3.853 1.00 0.00 C ATOM 504 CD1 TYR A 25 -12.823 -11.357 -4.359 1.00 0.00 C ATOM 505 CD2 TYR A 25 -11.877 -9.128 -4.633 1.00 0.00 C ATOM 506 CE1 TYR A 25 -13.413 -11.265 -5.633 1.00 0.00 C ATOM 507 CE2 TYR A 25 -12.450 -9.036 -5.910 1.00 0.00 C ATOM 508 CZ TYR A 25 -13.231 -10.100 -6.413 1.00 0.00 C ATOM 509 OH TYR A 25 -13.842 -9.966 -7.621 1.00 0.00 O ATOM 0 H TYR A 25 -13.200 -8.813 -0.952 1.00 0.00 H new ATOM 0 HA TYR A 25 -12.645 -11.691 -1.366 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -10.871 -9.442 -2.311 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -10.642 -11.164 -2.539 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -12.956 -12.251 -3.767 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -11.293 -8.306 -4.246 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -14.005 -12.084 -6.015 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -12.294 -8.151 -6.509 1.00 0.00 H new ATOM 0 HH TYR A 25 -13.603 -9.101 -8.014 1.00 0.00 H new ATOM 519 N PRO A 26 -11.981 -11.160 1.131 1.00 0.00 N ATOM 520 CA PRO A 26 -11.331 -11.050 2.433 1.00 0.00 C ATOM 521 C PRO A 26 -9.911 -11.623 2.480 1.00 0.00 C ATOM 522 O PRO A 26 -9.152 -11.261 3.377 1.00 0.00 O ATOM 523 CB PRO A 26 -12.276 -11.763 3.402 1.00 0.00 C ATOM 524 CG PRO A 26 -12.988 -12.784 2.527 1.00 0.00 C ATOM 525 CD PRO A 26 -13.119 -12.055 1.197 1.00 0.00 C ATOM 0 HA PRO A 26 -11.175 -10.003 2.694 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -11.729 -12.243 4.214 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -12.980 -11.068 3.859 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -12.412 -13.704 2.429 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -13.961 -13.059 2.935 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -13.115 -12.757 0.363 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -14.057 -11.502 1.144 1.00 0.00 H new ATOM 533 N ASP A 27 -9.520 -12.468 1.521 1.00 0.00 N ATOM 534 CA ASP A 27 -8.185 -13.072 1.485 1.00 0.00 C ATOM 535 C ASP A 27 -7.127 -12.083 0.980 1.00 0.00 C ATOM 536 O ASP A 27 -5.943 -12.424 0.902 1.00 0.00 O ATOM 537 CB ASP A 27 -8.154 -14.312 0.570 1.00 0.00 C ATOM 538 CG ASP A 27 -9.076 -15.475 0.932 1.00 0.00 C ATOM 539 OD1 ASP A 27 -9.893 -15.406 1.877 1.00 0.00 O ATOM 540 OD2 ASP A 27 -9.015 -16.494 0.201 1.00 0.00 O ATOM 0 H ASP A 27 -10.121 -12.753 0.747 1.00 0.00 H new ATOM 0 HA ASP A 27 -7.956 -13.360 2.511 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -8.399 -13.990 -0.442 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -7.131 -14.688 0.546 1.00 0.00 H new ATOM 545 N ARG A 28 -7.518 -10.877 0.565 1.00 0.00 N ATOM 546 CA ARG A 28 -6.609 -9.851 0.052 1.00 0.00 C ATOM 547 C ARG A 28 -6.900 -8.520 0.726 1.00 0.00 C ATOM 548 O ARG A 28 -7.981 -8.321 1.275 1.00 0.00 O ATOM 549 CB ARG A 28 -6.656 -9.807 -1.484 1.00 0.00 C ATOM 550 CG ARG A 28 -8.077 -9.611 -2.030 1.00 0.00 C ATOM 551 CD ARG A 28 -8.119 -9.601 -3.558 1.00 0.00 C ATOM 552 NE ARG A 28 -8.005 -10.940 -4.156 1.00 0.00 N ATOM 553 CZ ARG A 28 -7.880 -11.183 -5.464 1.00 0.00 C ATOM 554 NH1 ARG A 28 -7.968 -10.196 -6.353 1.00 0.00 N ATOM 555 NH2 ARG A 28 -7.667 -12.432 -5.864 1.00 0.00 N ATOM 0 H ARG A 28 -8.494 -10.581 0.576 1.00 0.00 H new ATOM 0 HA ARG A 28 -5.578 -10.100 0.303 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -6.020 -8.996 -1.839 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -6.243 -10.734 -1.882 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -8.720 -10.409 -1.657 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -8.482 -8.672 -1.652 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -9.053 -9.144 -3.885 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -7.309 -8.974 -3.932 1.00 0.00 H new ATOM 0 HE ARG A 28 -8.023 -11.742 -3.526 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -8.133 -9.240 -6.039 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -7.871 -10.396 -7.348 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -7.602 -13.183 -5.177 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -7.569 -12.639 -6.858 1.00 0.00 H new ATOM 569 N VAL A 29 -5.931 -7.608 0.685 1.00 0.00 N ATOM 570 CA VAL A 29 -6.033 -6.300 1.311 1.00 0.00 C ATOM 571 C VAL A 29 -5.377 -5.246 0.404 1.00 0.00 C ATOM 572 O VAL A 29 -4.330 -5.519 -0.199 1.00 0.00 O ATOM 573 CB VAL A 29 -5.325 -6.397 2.687 1.00 0.00 C ATOM 574 CG1 VAL A 29 -5.130 -5.051 3.397 1.00 0.00 C ATOM 575 CG2 VAL A 29 -6.042 -7.347 3.663 1.00 0.00 C ATOM 0 H VAL A 29 -5.043 -7.763 0.209 1.00 0.00 H new ATOM 0 HA VAL A 29 -7.070 -5.999 1.456 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.344 -6.795 2.429 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -4.628 -5.212 4.351 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.522 -4.395 2.773 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -6.101 -4.588 3.572 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.500 -7.374 4.609 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -7.058 -6.992 3.837 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -6.076 -8.349 3.236 1.00 0.00 H new ATOM 585 N PRO A 30 -5.970 -4.044 0.289 1.00 0.00 N ATOM 586 CA PRO A 30 -5.429 -2.958 -0.506 1.00 0.00 C ATOM 587 C PRO A 30 -4.314 -2.244 0.268 1.00 0.00 C ATOM 588 O PRO A 30 -4.485 -1.912 1.444 1.00 0.00 O ATOM 589 CB PRO A 30 -6.591 -1.994 -0.721 1.00 0.00 C ATOM 590 CG PRO A 30 -7.418 -2.159 0.550 1.00 0.00 C ATOM 591 CD PRO A 30 -7.210 -3.623 0.923 1.00 0.00 C ATOM 0 HA PRO A 30 -5.009 -3.318 -1.445 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -6.245 -0.968 -0.847 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.166 -2.248 -1.612 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -7.076 -1.491 1.341 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.470 -1.935 0.376 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -7.151 -3.742 2.005 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -8.046 -4.232 0.580 1.00 0.00 H new ATOM 599 N VAL A 31 -3.204 -1.936 -0.399 1.00 0.00 N ATOM 600 CA VAL A 31 -2.075 -1.261 0.218 1.00 0.00 C ATOM 601 C VAL A 31 -1.721 -0.044 -0.625 1.00 0.00 C ATOM 602 O VAL A 31 -1.593 -0.145 -1.851 1.00 0.00 O ATOM 603 CB VAL A 31 -0.881 -2.231 0.349 1.00 0.00 C ATOM 604 CG1 VAL A 31 0.278 -1.604 1.142 1.00 0.00 C ATOM 605 CG2 VAL A 31 -1.272 -3.547 1.033 1.00 0.00 C ATOM 0 H VAL A 31 -3.066 -2.150 -1.387 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.333 -0.931 1.224 1.00 0.00 H new ATOM 0 HB VAL A 31 -0.561 -2.438 -0.672 1.00 0.00 H new ATOM 0 HG11 VAL A 31 1.099 -2.318 1.212 1.00 0.00 H new ATOM 0 HG12 VAL A 31 0.622 -0.704 0.633 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.065 -1.345 2.144 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -0.398 -4.195 1.101 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.649 -3.339 2.034 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.047 -4.044 0.450 1.00 0.00 H new ATOM 615 N ILE A 32 -1.580 1.114 0.013 1.00 0.00 N ATOM 616 CA ILE A 32 -1.198 2.340 -0.661 1.00 0.00 C ATOM 617 C ILE A 32 0.301 2.420 -0.427 1.00 0.00 C ATOM 618 O ILE A 32 0.740 2.341 0.724 1.00 0.00 O ATOM 619 CB ILE A 32 -1.940 3.597 -0.160 1.00 0.00 C ATOM 620 CG1 ILE A 32 -3.469 3.443 -0.212 1.00 0.00 C ATOM 621 CG2 ILE A 32 -1.581 4.783 -1.076 1.00 0.00 C ATOM 622 CD1 ILE A 32 -4.077 2.843 1.052 1.00 0.00 C ATOM 0 H ILE A 32 -1.729 1.224 1.016 1.00 0.00 H new ATOM 0 HA ILE A 32 -1.469 2.316 -1.716 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.635 3.754 0.875 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -3.916 4.421 -0.389 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -3.732 2.814 -1.063 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -2.099 5.678 -0.732 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.505 4.953 -1.046 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.885 4.558 -2.098 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -5.158 2.768 0.935 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -3.660 1.850 1.220 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.848 3.482 1.905 1.00 0.00 H new ATOM 634 N VAL A 33 1.091 2.558 -1.487 1.00 0.00 N ATOM 635 CA VAL A 33 2.548 2.648 -1.439 1.00 0.00 C ATOM 636 C VAL A 33 2.903 4.118 -1.690 1.00 0.00 C ATOM 637 O VAL A 33 2.564 4.649 -2.755 1.00 0.00 O ATOM 638 CB VAL A 33 3.134 1.651 -2.465 1.00 0.00 C ATOM 639 CG1 VAL A 33 4.657 1.752 -2.602 1.00 0.00 C ATOM 640 CG2 VAL A 33 2.785 0.194 -2.105 1.00 0.00 C ATOM 0 H VAL A 33 0.722 2.612 -2.437 1.00 0.00 H new ATOM 0 HA VAL A 33 2.980 2.366 -0.479 1.00 0.00 H new ATOM 0 HB VAL A 33 2.677 1.927 -3.415 1.00 0.00 H new ATOM 0 HG11 VAL A 33 5.005 1.026 -3.337 1.00 0.00 H new ATOM 0 HG12 VAL A 33 4.927 2.756 -2.928 1.00 0.00 H new ATOM 0 HG13 VAL A 33 5.123 1.545 -1.639 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.214 -0.477 -2.849 1.00 0.00 H new ATOM 0 HG22 VAL A 33 3.192 -0.045 -1.123 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.702 0.073 -2.089 1.00 0.00 H new ATOM 650 N GLU A 34 3.588 4.772 -0.743 1.00 0.00 N ATOM 651 CA GLU A 34 3.976 6.178 -0.837 1.00 0.00 C ATOM 652 C GLU A 34 5.455 6.377 -0.512 1.00 0.00 C ATOM 653 O GLU A 34 5.962 5.834 0.474 1.00 0.00 O ATOM 654 CB GLU A 34 3.071 6.959 0.123 1.00 0.00 C ATOM 655 CG GLU A 34 3.358 8.452 0.273 1.00 0.00 C ATOM 656 CD GLU A 34 2.156 9.135 0.923 1.00 0.00 C ATOM 657 OE1 GLU A 34 1.168 9.375 0.181 1.00 0.00 O ATOM 658 OE2 GLU A 34 2.217 9.413 2.148 1.00 0.00 O ATOM 0 H GLU A 34 3.891 4.328 0.123 1.00 0.00 H new ATOM 0 HA GLU A 34 3.849 6.542 -1.857 1.00 0.00 H new ATOM 0 HB2 GLU A 34 2.040 6.842 -0.210 1.00 0.00 H new ATOM 0 HB3 GLU A 34 3.141 6.498 1.108 1.00 0.00 H new ATOM 0 HG2 GLU A 34 4.250 8.603 0.882 1.00 0.00 H new ATOM 0 HG3 GLU A 34 3.559 8.895 -0.702 1.00 0.00 H new ATOM 665 N LYS A 35 6.132 7.214 -1.303 1.00 0.00 N ATOM 666 CA LYS A 35 7.553 7.486 -1.112 1.00 0.00 C ATOM 667 C LYS A 35 7.634 8.601 -0.078 1.00 0.00 C ATOM 668 O LYS A 35 6.914 9.599 -0.179 1.00 0.00 O ATOM 669 CB LYS A 35 8.250 7.774 -2.463 1.00 0.00 C ATOM 670 CG LYS A 35 7.847 9.077 -3.187 1.00 0.00 C ATOM 671 CD LYS A 35 8.755 10.264 -2.824 1.00 0.00 C ATOM 672 CE LYS A 35 9.970 10.416 -3.752 1.00 0.00 C ATOM 673 NZ LYS A 35 9.661 11.203 -4.966 1.00 0.00 N ATOM 0 H LYS A 35 5.713 7.716 -2.086 1.00 0.00 H new ATOM 0 HA LYS A 35 8.105 6.627 -0.730 1.00 0.00 H new ATOM 0 HB2 LYS A 35 9.326 7.798 -2.292 1.00 0.00 H new ATOM 0 HB3 LYS A 35 8.052 6.937 -3.133 1.00 0.00 H new ATOM 0 HG2 LYS A 35 7.882 8.915 -4.264 1.00 0.00 H new ATOM 0 HG3 LYS A 35 6.816 9.324 -2.935 1.00 0.00 H new ATOM 0 HD2 LYS A 35 8.168 11.182 -2.854 1.00 0.00 H new ATOM 0 HD3 LYS A 35 9.104 10.143 -1.799 1.00 0.00 H new ATOM 0 HE2 LYS A 35 10.781 10.899 -3.207 1.00 0.00 H new ATOM 0 HE3 LYS A 35 10.326 9.428 -4.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 10.513 11.276 -5.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 8.906 10.731 -5.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 9.347 12.156 -4.692 1.00 0.00 H new ATOM 687 N ALA A 36 8.530 8.444 0.886 1.00 0.00 N ATOM 688 CA ALA A 36 8.745 9.360 1.997 1.00 0.00 C ATOM 689 C ALA A 36 9.789 10.429 1.674 1.00 0.00 C ATOM 690 O ALA A 36 10.559 10.286 0.715 1.00 0.00 O ATOM 691 CB ALA A 36 9.216 8.471 3.154 1.00 0.00 C ATOM 0 H ALA A 36 9.155 7.638 0.916 1.00 0.00 H new ATOM 0 HA ALA A 36 7.835 9.911 2.234 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.401 9.087 4.034 1.00 0.00 H new ATOM 0 HB2 ALA A 36 8.447 7.733 3.383 1.00 0.00 H new ATOM 0 HB3 ALA A 36 10.136 7.960 2.869 1.00 0.00 H new ATOM 697 N PRO A 37 9.799 11.527 2.448 1.00 0.00 N ATOM 698 CA PRO A 37 10.733 12.633 2.286 1.00 0.00 C ATOM 699 C PRO A 37 12.163 12.133 2.479 1.00 0.00 C ATOM 700 O PRO A 37 12.404 11.309 3.358 1.00 0.00 O ATOM 701 CB PRO A 37 10.348 13.655 3.367 1.00 0.00 C ATOM 702 CG PRO A 37 9.625 12.817 4.417 1.00 0.00 C ATOM 703 CD PRO A 37 8.920 11.776 3.581 1.00 0.00 C ATOM 0 HA PRO A 37 10.686 13.078 1.292 1.00 0.00 H new ATOM 0 HB2 PRO A 37 11.227 14.147 3.783 1.00 0.00 H new ATOM 0 HB3 PRO A 37 9.704 14.438 2.967 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.321 12.365 5.124 1.00 0.00 H new ATOM 0 HG3 PRO A 37 8.922 13.414 4.998 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.749 10.864 4.153 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.945 12.133 3.250 1.00 0.00 H new ATOM 711 N LYS A 38 13.115 12.690 1.723 1.00 0.00 N ATOM 712 CA LYS A 38 14.542 12.346 1.779 1.00 0.00 C ATOM 713 C LYS A 38 14.811 10.933 1.236 1.00 0.00 C ATOM 714 O LYS A 38 15.459 10.113 1.888 1.00 0.00 O ATOM 715 CB LYS A 38 15.117 12.579 3.197 1.00 0.00 C ATOM 716 CG LYS A 38 14.826 13.987 3.753 1.00 0.00 C ATOM 717 CD LYS A 38 15.063 14.066 5.267 1.00 0.00 C ATOM 718 CE LYS A 38 13.761 13.996 6.085 1.00 0.00 C ATOM 719 NZ LYS A 38 12.965 12.761 5.900 1.00 0.00 N ATOM 0 H LYS A 38 12.909 13.414 1.035 1.00 0.00 H new ATOM 0 HA LYS A 38 15.080 13.022 1.115 1.00 0.00 H new ATOM 0 HB2 LYS A 38 14.701 11.835 3.876 1.00 0.00 H new ATOM 0 HB3 LYS A 38 16.195 12.421 3.174 1.00 0.00 H new ATOM 0 HG2 LYS A 38 15.461 14.715 3.248 1.00 0.00 H new ATOM 0 HG3 LYS A 38 13.793 14.258 3.533 1.00 0.00 H new ATOM 0 HD2 LYS A 38 15.720 13.250 5.569 1.00 0.00 H new ATOM 0 HD3 LYS A 38 15.582 14.996 5.500 1.00 0.00 H new ATOM 0 HE2 LYS A 38 14.009 14.094 7.142 1.00 0.00 H new ATOM 0 HE3 LYS A 38 13.140 14.852 5.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 12.023 12.888 6.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 12.864 12.562 4.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 13.448 11.964 6.363 1.00 0.00 H new ATOM 733 N ALA A 39 14.270 10.621 0.054 1.00 0.00 N ATOM 734 CA ALA A 39 14.435 9.338 -0.626 1.00 0.00 C ATOM 735 C ALA A 39 14.946 9.573 -2.051 1.00 0.00 C ATOM 736 O ALA A 39 14.777 10.667 -2.595 1.00 0.00 O ATOM 737 CB ALA A 39 13.107 8.573 -0.620 1.00 0.00 C ATOM 0 H ALA A 39 13.688 11.276 -0.469 1.00 0.00 H new ATOM 0 HA ALA A 39 15.172 8.731 -0.100 1.00 0.00 H new ATOM 0 HB1 ALA A 39 13.235 7.617 -1.128 1.00 0.00 H new ATOM 0 HB2 ALA A 39 12.793 8.398 0.409 1.00 0.00 H new ATOM 0 HB3 ALA A 39 12.347 9.159 -1.136 1.00 0.00 H new ATOM 743 N ARG A 40 15.498 8.533 -2.688 1.00 0.00 N ATOM 744 CA ARG A 40 16.041 8.583 -4.045 1.00 0.00 C ATOM 745 C ARG A 40 15.597 7.328 -4.794 1.00 0.00 C ATOM 746 O ARG A 40 16.405 6.471 -5.150 1.00 0.00 O ATOM 747 CB ARG A 40 17.571 8.745 -3.946 1.00 0.00 C ATOM 748 CG ARG A 40 18.246 9.335 -5.195 1.00 0.00 C ATOM 749 CD ARG A 40 18.303 8.374 -6.385 1.00 0.00 C ATOM 750 NE ARG A 40 19.129 8.914 -7.475 1.00 0.00 N ATOM 751 CZ ARG A 40 18.735 9.246 -8.709 1.00 0.00 C ATOM 752 NH1 ARG A 40 17.474 9.129 -9.102 1.00 0.00 N ATOM 753 NH2 ARG A 40 19.637 9.692 -9.572 1.00 0.00 N ATOM 0 H ARG A 40 15.580 7.611 -2.260 1.00 0.00 H new ATOM 0 HA ARG A 40 15.666 9.434 -4.614 1.00 0.00 H new ATOM 0 HB2 ARG A 40 17.799 9.384 -3.093 1.00 0.00 H new ATOM 0 HB3 ARG A 40 18.012 7.769 -3.740 1.00 0.00 H new ATOM 0 HG2 ARG A 40 17.710 10.236 -5.494 1.00 0.00 H new ATOM 0 HG3 ARG A 40 19.261 9.639 -4.938 1.00 0.00 H new ATOM 0 HD2 ARG A 40 18.708 7.415 -6.061 1.00 0.00 H new ATOM 0 HD3 ARG A 40 17.294 8.186 -6.751 1.00 0.00 H new ATOM 0 HE ARG A 40 20.118 9.051 -7.265 1.00 0.00 H new ATOM 0 HH11 ARG A 40 16.769 8.776 -8.455 1.00 0.00 H new ATOM 0 HH12 ARG A 40 17.209 9.392 -10.051 1.00 0.00 H new ATOM 0 HH21 ARG A 40 20.614 9.777 -9.291 1.00 0.00 H new ATOM 0 HH22 ARG A 40 19.354 9.950 -10.518 1.00 0.00 H new ATOM 767 N VAL A 41 14.295 7.199 -5.024 1.00 0.00 N ATOM 768 CA VAL A 41 13.707 6.058 -5.719 1.00 0.00 C ATOM 769 C VAL A 41 12.809 6.559 -6.856 1.00 0.00 C ATOM 770 O VAL A 41 12.297 7.677 -6.758 1.00 0.00 O ATOM 771 CB VAL A 41 12.941 5.175 -4.708 1.00 0.00 C ATOM 772 CG1 VAL A 41 13.908 4.515 -3.712 1.00 0.00 C ATOM 773 CG2 VAL A 41 11.851 5.949 -3.943 1.00 0.00 C ATOM 0 H VAL A 41 13.608 7.893 -4.729 1.00 0.00 H new ATOM 0 HA VAL A 41 14.487 5.441 -6.166 1.00 0.00 H new ATOM 0 HB VAL A 41 12.442 4.404 -5.295 1.00 0.00 H new ATOM 0 HG11 VAL A 41 13.344 3.899 -3.011 1.00 0.00 H new ATOM 0 HG12 VAL A 41 14.618 3.891 -4.254 1.00 0.00 H new ATOM 0 HG13 VAL A 41 14.448 5.287 -3.163 1.00 0.00 H new ATOM 0 HG21 VAL A 41 11.347 5.277 -3.248 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.308 6.769 -3.388 1.00 0.00 H new ATOM 0 HG23 VAL A 41 11.125 6.350 -4.650 1.00 0.00 H new ATOM 783 N PRO A 42 12.598 5.772 -7.924 1.00 0.00 N ATOM 784 CA PRO A 42 11.744 6.174 -9.036 1.00 0.00 C ATOM 785 C PRO A 42 10.276 6.244 -8.602 1.00 0.00 C ATOM 786 O PRO A 42 9.864 5.596 -7.639 1.00 0.00 O ATOM 787 CB PRO A 42 11.974 5.116 -10.115 1.00 0.00 C ATOM 788 CG PRO A 42 12.353 3.868 -9.320 1.00 0.00 C ATOM 789 CD PRO A 42 13.156 4.447 -8.157 1.00 0.00 C ATOM 0 HA PRO A 42 11.984 7.172 -9.404 1.00 0.00 H new ATOM 0 HB2 PRO A 42 11.078 4.953 -10.714 1.00 0.00 H new ATOM 0 HB3 PRO A 42 12.768 5.410 -10.802 1.00 0.00 H new ATOM 0 HG2 PRO A 42 11.474 3.324 -8.975 1.00 0.00 H new ATOM 0 HG3 PRO A 42 12.945 3.172 -9.915 1.00 0.00 H new ATOM 0 HD2 PRO A 42 13.068 3.822 -7.269 1.00 0.00 H new ATOM 0 HD3 PRO A 42 14.217 4.505 -8.402 1.00 0.00 H new ATOM 797 N ASP A 43 9.484 7.047 -9.314 1.00 0.00 N ATOM 798 CA ASP A 43 8.062 7.220 -9.034 1.00 0.00 C ATOM 799 C ASP A 43 7.250 6.158 -9.771 1.00 0.00 C ATOM 800 O ASP A 43 7.546 5.807 -10.918 1.00 0.00 O ATOM 801 CB ASP A 43 7.570 8.632 -9.389 1.00 0.00 C ATOM 802 CG ASP A 43 7.377 8.857 -10.886 1.00 0.00 C ATOM 803 OD1 ASP A 43 8.391 9.013 -11.604 1.00 0.00 O ATOM 804 OD2 ASP A 43 6.219 8.959 -11.354 1.00 0.00 O ATOM 0 H ASP A 43 9.815 7.598 -10.106 1.00 0.00 H new ATOM 0 HA ASP A 43 7.917 7.096 -7.961 1.00 0.00 H new ATOM 0 HB2 ASP A 43 6.625 8.817 -8.878 1.00 0.00 H new ATOM 0 HB3 ASP A 43 8.285 9.362 -9.010 1.00 0.00 H new ATOM 809 N LEU A 44 6.203 5.665 -9.111 1.00 0.00 N ATOM 810 CA LEU A 44 5.295 4.635 -9.615 1.00 0.00 C ATOM 811 C LEU A 44 4.037 5.274 -10.200 1.00 0.00 C ATOM 812 O LEU A 44 3.699 6.399 -9.821 1.00 0.00 O ATOM 813 CB LEU A 44 4.912 3.668 -8.480 1.00 0.00 C ATOM 814 CG LEU A 44 6.090 3.093 -7.666 1.00 0.00 C ATOM 815 CD1 LEU A 44 5.565 2.076 -6.644 1.00 0.00 C ATOM 816 CD2 LEU A 44 7.143 2.445 -8.571 1.00 0.00 C ATOM 0 H LEU A 44 5.954 5.984 -8.175 1.00 0.00 H new ATOM 0 HA LEU A 44 5.804 4.078 -10.402 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.241 4.187 -7.796 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.351 2.838 -8.909 1.00 0.00 H new ATOM 0 HG LEU A 44 6.574 3.918 -7.143 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.400 1.672 -6.071 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.865 2.567 -5.968 1.00 0.00 H new ATOM 0 HD13 LEU A 44 5.057 1.265 -7.166 1.00 0.00 H new ATOM 0 HD21 LEU A 44 7.956 2.052 -7.960 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.687 1.631 -9.135 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.536 3.190 -9.263 1.00 0.00 H new ATOM 828 N ASP A 45 3.344 4.564 -11.098 1.00 0.00 N ATOM 829 CA ASP A 45 2.107 4.993 -11.764 1.00 0.00 C ATOM 830 C ASP A 45 1.022 5.276 -10.717 1.00 0.00 C ATOM 831 O ASP A 45 0.833 6.413 -10.284 1.00 0.00 O ATOM 832 CB ASP A 45 1.593 3.916 -12.749 1.00 0.00 C ATOM 833 CG ASP A 45 2.116 4.013 -14.175 1.00 0.00 C ATOM 834 OD1 ASP A 45 1.530 4.810 -14.945 1.00 0.00 O ATOM 835 OD2 ASP A 45 2.959 3.175 -14.566 1.00 0.00 O ATOM 0 H ASP A 45 3.642 3.634 -11.394 1.00 0.00 H new ATOM 0 HA ASP A 45 2.330 5.899 -12.327 1.00 0.00 H new ATOM 0 HB2 ASP A 45 1.855 2.935 -12.353 1.00 0.00 H new ATOM 0 HB3 ASP A 45 0.505 3.968 -12.778 1.00 0.00 H new ATOM 840 N LYS A 46 0.259 4.239 -10.336 1.00 0.00 N ATOM 841 CA LYS A 46 -0.807 4.317 -9.350 1.00 0.00 C ATOM 842 C LYS A 46 -0.191 4.211 -7.965 1.00 0.00 C ATOM 843 O LYS A 46 0.963 3.816 -7.795 1.00 0.00 O ATOM 844 CB LYS A 46 -1.842 3.196 -9.580 1.00 0.00 C ATOM 845 CG LYS A 46 -2.798 3.431 -10.762 1.00 0.00 C ATOM 846 CD LYS A 46 -4.000 4.360 -10.493 1.00 0.00 C ATOM 847 CE LYS A 46 -3.681 5.860 -10.580 1.00 0.00 C ATOM 848 NZ LYS A 46 -4.901 6.692 -10.685 1.00 0.00 N ATOM 0 H LYS A 46 0.378 3.302 -10.721 1.00 0.00 H new ATOM 0 HA LYS A 46 -1.331 5.268 -9.444 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -1.311 2.258 -9.742 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.433 3.075 -8.672 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -2.223 3.846 -11.590 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -3.179 2.464 -11.091 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -4.789 4.128 -11.208 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -4.395 4.143 -9.501 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.115 6.160 -9.698 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -3.044 6.043 -11.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -4.633 7.695 -10.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -5.430 6.427 -11.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -5.498 6.539 -9.847 1.00 0.00 H new ATOM 862 N ARG A 47 -1.002 4.529 -6.961 1.00 0.00 N ATOM 863 CA ARG A 47 -0.602 4.477 -5.565 1.00 0.00 C ATOM 864 C ARG A 47 -1.283 3.323 -4.831 1.00 0.00 C ATOM 865 O ARG A 47 -0.741 2.883 -3.825 1.00 0.00 O ATOM 866 CB ARG A 47 -0.773 5.851 -4.888 1.00 0.00 C ATOM 867 CG ARG A 47 -2.122 6.574 -5.073 1.00 0.00 C ATOM 868 CD ARG A 47 -2.211 7.435 -6.349 1.00 0.00 C ATOM 869 NE ARG A 47 -3.405 8.293 -6.331 1.00 0.00 N ATOM 870 CZ ARG A 47 -3.716 9.278 -7.178 1.00 0.00 C ATOM 871 NH1 ARG A 47 -3.022 9.473 -8.294 1.00 0.00 N ATOM 872 NH2 ARG A 47 -4.743 10.071 -6.914 1.00 0.00 N ATOM 0 H ARG A 47 -1.966 4.833 -7.099 1.00 0.00 H new ATOM 0 HA ARG A 47 0.464 4.257 -5.512 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -0.605 5.722 -3.819 1.00 0.00 H new ATOM 0 HB3 ARG A 47 0.014 6.508 -5.258 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -2.919 5.831 -5.094 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -2.302 7.210 -4.206 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -1.317 8.053 -6.437 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -2.238 6.788 -7.226 1.00 0.00 H new ATOM 0 HE ARG A 47 -4.075 8.115 -5.583 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -2.235 8.864 -8.518 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -3.277 10.231 -8.927 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -5.293 9.928 -6.067 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -4.984 10.824 -7.558 1.00 0.00 H new ATOM 886 N LYS A 48 -2.441 2.832 -5.296 1.00 0.00 N ATOM 887 CA LYS A 48 -3.169 1.727 -4.670 1.00 0.00 C ATOM 888 C LYS A 48 -2.816 0.408 -5.347 1.00 0.00 C ATOM 889 O LYS A 48 -2.932 0.286 -6.571 1.00 0.00 O ATOM 890 CB LYS A 48 -4.690 1.912 -4.784 1.00 0.00 C ATOM 891 CG LYS A 48 -5.359 2.574 -3.577 1.00 0.00 C ATOM 892 CD LYS A 48 -5.155 4.085 -3.455 1.00 0.00 C ATOM 893 CE LYS A 48 -5.837 4.827 -4.617 1.00 0.00 C ATOM 894 NZ LYS A 48 -6.554 6.028 -4.151 1.00 0.00 N ATOM 0 H LYS A 48 -2.902 3.199 -6.129 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.879 1.716 -3.619 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -4.902 2.511 -5.670 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.148 0.936 -4.942 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -6.429 2.372 -3.621 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -4.983 2.100 -2.670 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.561 4.435 -2.506 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.089 4.313 -3.449 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.088 5.114 -5.355 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.536 4.157 -5.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.001 6.502 -4.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.285 5.751 -3.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -5.882 6.679 -3.697 1.00 0.00 H new ATOM 908 N TYR A 49 -2.470 -0.572 -4.526 1.00 0.00 N ATOM 909 CA TYR A 49 -2.092 -1.923 -4.887 1.00 0.00 C ATOM 910 C TYR A 49 -2.974 -2.889 -4.096 1.00 0.00 C ATOM 911 O TYR A 49 -3.592 -2.475 -3.118 1.00 0.00 O ATOM 912 CB TYR A 49 -0.601 -2.085 -4.572 1.00 0.00 C ATOM 913 CG TYR A 49 0.254 -1.151 -5.412 1.00 0.00 C ATOM 914 CD1 TYR A 49 0.579 -1.519 -6.726 1.00 0.00 C ATOM 915 CD2 TYR A 49 0.620 0.125 -4.942 1.00 0.00 C ATOM 916 CE1 TYR A 49 1.269 -0.635 -7.572 1.00 0.00 C ATOM 917 CE2 TYR A 49 1.295 1.027 -5.787 1.00 0.00 C ATOM 918 CZ TYR A 49 1.616 0.651 -7.111 1.00 0.00 C ATOM 919 OH TYR A 49 2.268 1.509 -7.935 1.00 0.00 O ATOM 0 H TYR A 49 -2.446 -0.429 -3.516 1.00 0.00 H new ATOM 0 HA TYR A 49 -2.239 -2.135 -5.946 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -0.428 -1.885 -3.515 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -0.300 -3.117 -4.754 1.00 0.00 H new ATOM 0 HD1 TYR A 49 0.295 -2.495 -7.092 1.00 0.00 H new ATOM 0 HD2 TYR A 49 0.382 0.413 -3.929 1.00 0.00 H new ATOM 0 HE1 TYR A 49 1.533 -0.940 -8.574 1.00 0.00 H new ATOM 0 HE2 TYR A 49 1.568 2.007 -5.423 1.00 0.00 H new ATOM 0 HH TYR A 49 1.812 2.376 -7.931 1.00 0.00 H new ATOM 929 N LEU A 50 -3.011 -4.170 -4.461 1.00 0.00 N ATOM 930 CA LEU A 50 -3.815 -5.205 -3.817 1.00 0.00 C ATOM 931 C LEU A 50 -2.968 -6.470 -3.698 1.00 0.00 C ATOM 932 O LEU A 50 -2.512 -6.983 -4.725 1.00 0.00 O ATOM 933 CB LEU A 50 -5.084 -5.457 -4.664 1.00 0.00 C ATOM 934 CG LEU A 50 -6.363 -5.438 -3.813 1.00 0.00 C ATOM 935 CD1 LEU A 50 -6.840 -3.995 -3.646 1.00 0.00 C ATOM 936 CD2 LEU A 50 -7.507 -6.225 -4.460 1.00 0.00 C ATOM 0 H LEU A 50 -2.461 -4.527 -5.242 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.127 -4.895 -2.819 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.156 -4.697 -5.442 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.998 -6.421 -5.166 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.114 -5.899 -2.857 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -7.748 -3.979 -3.042 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -6.065 -3.411 -3.151 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.048 -3.565 -4.626 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -8.387 -6.180 -3.819 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.743 -5.791 -5.432 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.205 -7.264 -4.590 1.00 0.00 H new ATOM 948 N VAL A 51 -2.738 -6.972 -2.482 1.00 0.00 N ATOM 949 CA VAL A 51 -1.930 -8.174 -2.239 1.00 0.00 C ATOM 950 C VAL A 51 -2.650 -9.117 -1.259 1.00 0.00 C ATOM 951 O VAL A 51 -3.513 -8.647 -0.508 1.00 0.00 O ATOM 952 CB VAL A 51 -0.525 -7.763 -1.730 1.00 0.00 C ATOM 953 CG1 VAL A 51 0.257 -6.980 -2.796 1.00 0.00 C ATOM 954 CG2 VAL A 51 -0.549 -6.936 -0.437 1.00 0.00 C ATOM 0 H VAL A 51 -3.110 -6.553 -1.630 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.800 -8.723 -3.172 1.00 0.00 H new ATOM 0 HB VAL A 51 -0.026 -8.708 -1.513 1.00 0.00 H new ATOM 0 HG11 VAL A 51 1.237 -6.709 -2.403 1.00 0.00 H new ATOM 0 HG12 VAL A 51 0.381 -7.599 -3.684 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -0.291 -6.075 -3.058 1.00 0.00 H new ATOM 0 HG21 VAL A 51 0.471 -6.687 -0.145 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.113 -6.018 -0.603 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -1.022 -7.515 0.356 1.00 0.00 H new ATOM 964 N PRO A 52 -2.332 -10.427 -1.244 1.00 0.00 N ATOM 965 CA PRO A 52 -2.970 -11.366 -0.332 1.00 0.00 C ATOM 966 C PRO A 52 -2.485 -11.117 1.102 1.00 0.00 C ATOM 967 O PRO A 52 -1.378 -10.620 1.325 1.00 0.00 O ATOM 968 CB PRO A 52 -2.581 -12.755 -0.841 1.00 0.00 C ATOM 969 CG PRO A 52 -1.214 -12.522 -1.451 1.00 0.00 C ATOM 970 CD PRO A 52 -1.349 -11.127 -2.067 1.00 0.00 C ATOM 0 HA PRO A 52 -4.054 -11.257 -0.306 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -2.543 -13.485 -0.033 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -3.293 -13.130 -1.576 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -0.425 -12.558 -0.700 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -0.973 -13.274 -2.202 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -0.393 -10.604 -2.065 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -1.678 -11.187 -3.104 1.00 0.00 H new ATOM 978 N SER A 53 -3.301 -11.474 2.091 1.00 0.00 N ATOM 979 CA SER A 53 -2.968 -11.292 3.500 1.00 0.00 C ATOM 980 C SER A 53 -1.834 -12.215 3.965 1.00 0.00 C ATOM 981 O SER A 53 -1.027 -11.846 4.813 1.00 0.00 O ATOM 982 CB SER A 53 -4.231 -11.578 4.334 1.00 0.00 C ATOM 983 OG SER A 53 -4.876 -12.773 3.912 1.00 0.00 O ATOM 0 H SER A 53 -4.215 -11.899 1.936 1.00 0.00 H new ATOM 0 HA SER A 53 -2.621 -10.268 3.636 1.00 0.00 H new ATOM 0 HB2 SER A 53 -3.962 -11.661 5.387 1.00 0.00 H new ATOM 0 HB3 SER A 53 -4.923 -10.740 4.247 1.00 0.00 H new ATOM 0 HG SER A 53 -5.672 -12.927 4.462 1.00 0.00 H new ATOM 989 N ASP A 54 -1.714 -13.392 3.360 1.00 0.00 N ATOM 990 CA ASP A 54 -0.727 -14.398 3.745 1.00 0.00 C ATOM 991 C ASP A 54 0.664 -14.236 3.131 1.00 0.00 C ATOM 992 O ASP A 54 1.505 -15.125 3.304 1.00 0.00 O ATOM 993 CB ASP A 54 -1.334 -15.798 3.556 1.00 0.00 C ATOM 994 CG ASP A 54 -2.618 -15.971 4.374 1.00 0.00 C ATOM 995 OD1 ASP A 54 -2.651 -15.524 5.545 1.00 0.00 O ATOM 996 OD2 ASP A 54 -3.638 -16.449 3.820 1.00 0.00 O ATOM 0 H ASP A 54 -2.305 -13.679 2.580 1.00 0.00 H new ATOM 0 HA ASP A 54 -0.511 -14.242 4.802 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -1.550 -15.962 2.500 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -0.607 -16.554 3.854 1.00 0.00 H new ATOM 1001 N LEU A 55 0.915 -13.143 2.407 1.00 0.00 N ATOM 1002 CA LEU A 55 2.203 -12.842 1.784 1.00 0.00 C ATOM 1003 C LEU A 55 3.192 -12.419 2.867 1.00 0.00 C ATOM 1004 O LEU A 55 2.844 -11.602 3.721 1.00 0.00 O ATOM 1005 CB LEU A 55 2.003 -11.698 0.774 1.00 0.00 C ATOM 1006 CG LEU A 55 3.270 -11.043 0.191 1.00 0.00 C ATOM 1007 CD1 LEU A 55 4.143 -12.065 -0.539 1.00 0.00 C ATOM 1008 CD2 LEU A 55 2.843 -9.939 -0.785 1.00 0.00 C ATOM 0 H LEU A 55 0.210 -12.426 2.234 1.00 0.00 H new ATOM 0 HA LEU A 55 2.594 -13.719 1.268 1.00 0.00 H new ATOM 0 HB2 LEU A 55 1.408 -12.080 -0.056 1.00 0.00 H new ATOM 0 HB3 LEU A 55 1.413 -10.920 1.258 1.00 0.00 H new ATOM 0 HG LEU A 55 3.859 -10.627 1.008 1.00 0.00 H new ATOM 0 HD11 LEU A 55 5.028 -11.569 -0.938 1.00 0.00 H new ATOM 0 HD12 LEU A 55 4.448 -12.846 0.157 1.00 0.00 H new ATOM 0 HD13 LEU A 55 3.576 -12.509 -1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 55 3.729 -9.464 -1.207 1.00 0.00 H new ATOM 0 HD22 LEU A 55 2.247 -10.373 -1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 55 2.250 -9.194 -0.255 1.00 0.00 H new ATOM 1020 N THR A 56 4.404 -12.976 2.869 1.00 0.00 N ATOM 1021 CA THR A 56 5.423 -12.608 3.844 1.00 0.00 C ATOM 1022 C THR A 56 5.975 -11.226 3.474 1.00 0.00 C ATOM 1023 O THR A 56 6.145 -10.921 2.287 1.00 0.00 O ATOM 1024 CB THR A 56 6.542 -13.665 3.912 1.00 0.00 C ATOM 1025 OG1 THR A 56 6.807 -14.249 2.645 1.00 0.00 O ATOM 1026 CG2 THR A 56 6.152 -14.788 4.874 1.00 0.00 C ATOM 0 H THR A 56 4.702 -13.687 2.201 1.00 0.00 H new ATOM 0 HA THR A 56 4.979 -12.565 4.838 1.00 0.00 H new ATOM 0 HB THR A 56 7.437 -13.148 4.258 1.00 0.00 H new ATOM 0 HG1 THR A 56 7.524 -14.912 2.734 1.00 0.00 H new ATOM 0 HG21 THR A 56 6.951 -15.528 4.913 1.00 0.00 H new ATOM 0 HG22 THR A 56 5.992 -14.375 5.870 1.00 0.00 H new ATOM 0 HG23 THR A 56 5.235 -15.263 4.526 1.00 0.00 H new ATOM 1034 N VAL A 57 6.298 -10.405 4.477 1.00 0.00 N ATOM 1035 CA VAL A 57 6.841 -9.065 4.268 1.00 0.00 C ATOM 1036 C VAL A 57 8.109 -9.153 3.414 1.00 0.00 C ATOM 1037 O VAL A 57 8.269 -8.362 2.485 1.00 0.00 O ATOM 1038 CB VAL A 57 7.076 -8.354 5.619 1.00 0.00 C ATOM 1039 CG1 VAL A 57 7.700 -6.966 5.435 1.00 0.00 C ATOM 1040 CG2 VAL A 57 5.758 -8.148 6.371 1.00 0.00 C ATOM 0 H VAL A 57 6.189 -10.655 5.460 1.00 0.00 H new ATOM 0 HA VAL A 57 6.120 -8.456 3.723 1.00 0.00 H new ATOM 0 HB VAL A 57 7.751 -9.000 6.180 1.00 0.00 H new ATOM 0 HG11 VAL A 57 7.848 -6.502 6.410 1.00 0.00 H new ATOM 0 HG12 VAL A 57 8.661 -7.063 4.930 1.00 0.00 H new ATOM 0 HG13 VAL A 57 7.035 -6.345 4.834 1.00 0.00 H new ATOM 0 HG21 VAL A 57 5.954 -7.645 7.318 1.00 0.00 H new ATOM 0 HG22 VAL A 57 5.087 -7.537 5.768 1.00 0.00 H new ATOM 0 HG23 VAL A 57 5.294 -9.115 6.563 1.00 0.00 H new ATOM 1050 N GLY A 58 8.971 -10.147 3.656 1.00 0.00 N ATOM 1051 CA GLY A 58 10.203 -10.327 2.901 1.00 0.00 C ATOM 1052 C GLY A 58 9.974 -10.449 1.391 1.00 0.00 C ATOM 1053 O GLY A 58 10.758 -9.888 0.616 1.00 0.00 O ATOM 0 H GLY A 58 8.828 -10.847 4.384 1.00 0.00 H new ATOM 0 HA2 GLY A 58 10.866 -9.484 3.094 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.713 -11.222 3.258 1.00 0.00 H new ATOM 1057 N GLN A 59 8.932 -11.170 0.960 1.00 0.00 N ATOM 1058 CA GLN A 59 8.630 -11.331 -0.458 1.00 0.00 C ATOM 1059 C GLN A 59 8.132 -10.006 -1.026 1.00 0.00 C ATOM 1060 O GLN A 59 8.601 -9.588 -2.081 1.00 0.00 O ATOM 1061 CB GLN A 59 7.605 -12.454 -0.702 1.00 0.00 C ATOM 1062 CG GLN A 59 8.248 -13.786 -1.112 1.00 0.00 C ATOM 1063 CD GLN A 59 9.151 -13.643 -2.343 1.00 0.00 C ATOM 1064 OE1 GLN A 59 8.800 -13.040 -3.352 1.00 0.00 O ATOM 1065 NE2 GLN A 59 10.376 -14.130 -2.272 1.00 0.00 N ATOM 0 H GLN A 59 8.283 -11.652 1.582 1.00 0.00 H new ATOM 0 HA GLN A 59 9.546 -11.622 -0.973 1.00 0.00 H new ATOM 0 HB2 GLN A 59 7.020 -12.605 0.205 1.00 0.00 H new ATOM 0 HB3 GLN A 59 6.910 -12.139 -1.481 1.00 0.00 H new ATOM 0 HG2 GLN A 59 8.833 -14.176 -0.279 1.00 0.00 H new ATOM 0 HG3 GLN A 59 7.465 -14.515 -1.321 1.00 0.00 H new ATOM 0 HE21 GLN A 59 10.677 -14.633 -1.437 1.00 0.00 H new ATOM 0 HE22 GLN A 59 11.021 -14.003 -3.052 1.00 0.00 H new ATOM 1074 N PHE A 60 7.246 -9.307 -0.305 1.00 0.00 N ATOM 1075 CA PHE A 60 6.719 -8.018 -0.753 1.00 0.00 C ATOM 1076 C PHE A 60 7.912 -7.074 -0.962 1.00 0.00 C ATOM 1077 O PHE A 60 7.995 -6.390 -1.988 1.00 0.00 O ATOM 1078 CB PHE A 60 5.720 -7.500 0.305 1.00 0.00 C ATOM 1079 CG PHE A 60 5.511 -5.997 0.371 1.00 0.00 C ATOM 1080 CD1 PHE A 60 5.143 -5.268 -0.777 1.00 0.00 C ATOM 1081 CD2 PHE A 60 5.667 -5.325 1.600 1.00 0.00 C ATOM 1082 CE1 PHE A 60 4.972 -3.873 -0.699 1.00 0.00 C ATOM 1083 CE2 PHE A 60 5.490 -3.933 1.678 1.00 0.00 C ATOM 1084 CZ PHE A 60 5.168 -3.205 0.522 1.00 0.00 C ATOM 0 H PHE A 60 6.880 -9.617 0.595 1.00 0.00 H new ATOM 0 HA PHE A 60 6.178 -8.094 -1.696 1.00 0.00 H new ATOM 0 HB2 PHE A 60 4.754 -7.970 0.119 1.00 0.00 H new ATOM 0 HB3 PHE A 60 6.056 -7.840 1.285 1.00 0.00 H new ATOM 0 HD1 PHE A 60 4.992 -5.779 -1.716 1.00 0.00 H new ATOM 0 HD2 PHE A 60 5.924 -5.884 2.488 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.690 -3.315 -1.579 1.00 0.00 H new ATOM 0 HE2 PHE A 60 5.601 -3.425 2.625 1.00 0.00 H new ATOM 0 HZ PHE A 60 5.071 -2.130 0.571 1.00 0.00 H new ATOM 1094 N TYR A 61 8.886 -7.114 -0.053 1.00 0.00 N ATOM 1095 CA TYR A 61 10.092 -6.307 -0.113 1.00 0.00 C ATOM 1096 C TYR A 61 10.872 -6.603 -1.398 1.00 0.00 C ATOM 1097 O TYR A 61 11.266 -5.679 -2.111 1.00 0.00 O ATOM 1098 CB TYR A 61 10.961 -6.648 1.106 1.00 0.00 C ATOM 1099 CG TYR A 61 11.565 -5.453 1.788 1.00 0.00 C ATOM 1100 CD1 TYR A 61 12.647 -4.775 1.200 1.00 0.00 C ATOM 1101 CD2 TYR A 61 11.061 -5.049 3.037 1.00 0.00 C ATOM 1102 CE1 TYR A 61 13.266 -3.725 1.893 1.00 0.00 C ATOM 1103 CE2 TYR A 61 11.679 -4.003 3.734 1.00 0.00 C ATOM 1104 CZ TYR A 61 12.814 -3.374 3.180 1.00 0.00 C ATOM 1105 OH TYR A 61 13.475 -2.449 3.913 1.00 0.00 O ATOM 0 H TYR A 61 8.852 -7.725 0.763 1.00 0.00 H new ATOM 0 HA TYR A 61 9.826 -5.250 -0.109 1.00 0.00 H new ATOM 0 HB2 TYR A 61 10.355 -7.196 1.828 1.00 0.00 H new ATOM 0 HB3 TYR A 61 11.763 -7.316 0.791 1.00 0.00 H new ATOM 0 HD1 TYR A 61 12.999 -5.061 0.220 1.00 0.00 H new ATOM 0 HD2 TYR A 61 10.199 -5.544 3.458 1.00 0.00 H new ATOM 0 HE1 TYR A 61 14.087 -3.187 1.442 1.00 0.00 H new ATOM 0 HE2 TYR A 61 11.290 -3.680 4.688 1.00 0.00 H new ATOM 0 HH TYR A 61 14.066 -1.930 3.329 1.00 0.00 H new ATOM 1115 N PHE A 62 11.063 -7.885 -1.725 1.00 0.00 N ATOM 1116 CA PHE A 62 11.789 -8.321 -2.914 1.00 0.00 C ATOM 1117 C PHE A 62 11.109 -7.824 -4.187 1.00 0.00 C ATOM 1118 O PHE A 62 11.792 -7.290 -5.069 1.00 0.00 O ATOM 1119 CB PHE A 62 11.932 -9.857 -2.930 1.00 0.00 C ATOM 1120 CG PHE A 62 13.243 -10.408 -2.394 1.00 0.00 C ATOM 1121 CD1 PHE A 62 13.954 -9.756 -1.364 1.00 0.00 C ATOM 1122 CD2 PHE A 62 13.763 -11.595 -2.945 1.00 0.00 C ATOM 1123 CE1 PHE A 62 15.182 -10.273 -0.916 1.00 0.00 C ATOM 1124 CE2 PHE A 62 14.990 -12.110 -2.495 1.00 0.00 C ATOM 1125 CZ PHE A 62 15.703 -11.448 -1.483 1.00 0.00 C ATOM 0 H PHE A 62 10.711 -8.658 -1.160 1.00 0.00 H new ATOM 0 HA PHE A 62 12.787 -7.885 -2.879 1.00 0.00 H new ATOM 0 HB2 PHE A 62 11.116 -10.284 -2.348 1.00 0.00 H new ATOM 0 HB3 PHE A 62 11.807 -10.203 -3.956 1.00 0.00 H new ATOM 0 HD1 PHE A 62 13.554 -8.857 -0.919 1.00 0.00 H new ATOM 0 HD2 PHE A 62 13.215 -12.113 -3.718 1.00 0.00 H new ATOM 0 HE1 PHE A 62 15.727 -9.765 -0.134 1.00 0.00 H new ATOM 0 HE2 PHE A 62 15.385 -13.017 -2.928 1.00 0.00 H new ATOM 0 HZ PHE A 62 16.649 -11.841 -1.141 1.00 0.00 H new ATOM 1135 N LEU A 63 9.785 -7.979 -4.287 1.00 0.00 N ATOM 1136 CA LEU A 63 9.035 -7.550 -5.461 1.00 0.00 C ATOM 1137 C LEU A 63 9.200 -6.049 -5.682 1.00 0.00 C ATOM 1138 O LEU A 63 9.553 -5.647 -6.796 1.00 0.00 O ATOM 1139 CB LEU A 63 7.548 -7.955 -5.381 1.00 0.00 C ATOM 1140 CG LEU A 63 7.202 -9.386 -5.855 1.00 0.00 C ATOM 1141 CD1 LEU A 63 7.817 -9.722 -7.219 1.00 0.00 C ATOM 1142 CD2 LEU A 63 7.595 -10.476 -4.861 1.00 0.00 C ATOM 0 H LEU A 63 9.210 -8.403 -3.559 1.00 0.00 H new ATOM 0 HA LEU A 63 9.449 -8.068 -6.326 1.00 0.00 H new ATOM 0 HB2 LEU A 63 7.219 -7.848 -4.347 1.00 0.00 H new ATOM 0 HB3 LEU A 63 6.968 -7.248 -5.975 1.00 0.00 H new ATOM 0 HG LEU A 63 6.115 -9.376 -5.939 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.542 -10.738 -7.502 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.445 -9.023 -7.968 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.902 -9.644 -7.158 1.00 0.00 H new ATOM 0 HD21 LEU A 63 7.321 -11.451 -5.263 1.00 0.00 H new ATOM 0 HD22 LEU A 63 8.671 -10.443 -4.691 1.00 0.00 H new ATOM 0 HD23 LEU A 63 7.074 -10.313 -3.918 1.00 0.00 H new ATOM 1154 N ILE A 64 8.989 -5.218 -4.654 1.00 0.00 N ATOM 1155 CA ILE A 64 9.146 -3.773 -4.824 1.00 0.00 C ATOM 1156 C ILE A 64 10.606 -3.450 -5.153 1.00 0.00 C ATOM 1157 O ILE A 64 10.838 -2.674 -6.077 1.00 0.00 O ATOM 1158 CB ILE A 64 8.597 -2.957 -3.633 1.00 0.00 C ATOM 1159 CG1 ILE A 64 7.120 -3.277 -3.314 1.00 0.00 C ATOM 1160 CG2 ILE A 64 8.731 -1.446 -3.921 1.00 0.00 C ATOM 1161 CD1 ILE A 64 6.138 -3.117 -4.482 1.00 0.00 C ATOM 0 H ILE A 64 8.715 -5.514 -3.717 1.00 0.00 H new ATOM 0 HA ILE A 64 8.530 -3.462 -5.668 1.00 0.00 H new ATOM 0 HB ILE A 64 9.192 -3.238 -2.764 1.00 0.00 H new ATOM 0 HG12 ILE A 64 7.060 -4.303 -2.951 1.00 0.00 H new ATOM 0 HG13 ILE A 64 6.795 -2.630 -2.499 1.00 0.00 H new ATOM 0 HG21 ILE A 64 8.341 -0.879 -3.076 1.00 0.00 H new ATOM 0 HG22 ILE A 64 9.781 -1.196 -4.073 1.00 0.00 H new ATOM 0 HG23 ILE A 64 8.165 -1.195 -4.818 1.00 0.00 H new ATOM 0 HD11 ILE A 64 5.131 -3.367 -4.148 1.00 0.00 H new ATOM 0 HD12 ILE A 64 6.158 -2.086 -4.835 1.00 0.00 H new ATOM 0 HD13 ILE A 64 6.427 -3.784 -5.294 1.00 0.00 H new ATOM 1173 N ARG A 65 11.591 -4.064 -4.476 1.00 0.00 N ATOM 1174 CA ARG A 65 13.018 -3.827 -4.735 1.00 0.00 C ATOM 1175 C ARG A 65 13.312 -4.028 -6.226 1.00 0.00 C ATOM 1176 O ARG A 65 13.965 -3.193 -6.845 1.00 0.00 O ATOM 1177 CB ARG A 65 13.875 -4.733 -3.829 1.00 0.00 C ATOM 1178 CG ARG A 65 15.366 -4.363 -3.821 1.00 0.00 C ATOM 1179 CD ARG A 65 16.197 -5.421 -3.075 1.00 0.00 C ATOM 1180 NE ARG A 65 17.469 -4.869 -2.570 1.00 0.00 N ATOM 1181 CZ ARG A 65 18.705 -5.374 -2.691 1.00 0.00 C ATOM 1182 NH1 ARG A 65 18.939 -6.475 -3.398 1.00 0.00 N ATOM 1183 NH2 ARG A 65 19.724 -4.768 -2.096 1.00 0.00 N ATOM 0 H ARG A 65 11.418 -4.740 -3.732 1.00 0.00 H new ATOM 0 HA ARG A 65 13.279 -2.797 -4.491 1.00 0.00 H new ATOM 0 HB2 ARG A 65 13.491 -4.681 -2.810 1.00 0.00 H new ATOM 0 HB3 ARG A 65 13.768 -5.767 -4.158 1.00 0.00 H new ATOM 0 HG2 ARG A 65 15.726 -4.270 -4.846 1.00 0.00 H new ATOM 0 HG3 ARG A 65 15.500 -3.391 -3.347 1.00 0.00 H new ATOM 0 HD2 ARG A 65 15.617 -5.816 -2.241 1.00 0.00 H new ATOM 0 HD3 ARG A 65 16.404 -6.257 -3.743 1.00 0.00 H new ATOM 0 HE ARG A 65 17.399 -3.987 -2.062 1.00 0.00 H new ATOM 0 HH11 ARG A 65 18.169 -6.955 -3.864 1.00 0.00 H new ATOM 0 HH12 ARG A 65 19.889 -6.839 -3.475 1.00 0.00 H new ATOM 0 HH21 ARG A 65 19.565 -3.922 -1.549 1.00 0.00 H new ATOM 0 HH22 ARG A 65 20.666 -5.148 -2.185 1.00 0.00 H new ATOM 1197 N LYS A 66 12.809 -5.122 -6.815 1.00 0.00 N ATOM 1198 CA LYS A 66 13.001 -5.415 -8.235 1.00 0.00 C ATOM 1199 C LYS A 66 12.321 -4.336 -9.086 1.00 0.00 C ATOM 1200 O LYS A 66 12.913 -3.864 -10.059 1.00 0.00 O ATOM 1201 CB LYS A 66 12.487 -6.835 -8.560 1.00 0.00 C ATOM 1202 CG LYS A 66 12.661 -7.188 -10.048 1.00 0.00 C ATOM 1203 CD LYS A 66 12.360 -8.663 -10.364 1.00 0.00 C ATOM 1204 CE LYS A 66 12.327 -8.936 -11.878 1.00 0.00 C ATOM 1205 NZ LYS A 66 13.652 -8.789 -12.518 1.00 0.00 N ATOM 0 H LYS A 66 12.260 -5.824 -6.319 1.00 0.00 H new ATOM 0 HA LYS A 66 14.064 -5.397 -8.476 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.023 -7.562 -7.950 1.00 0.00 H new ATOM 0 HB3 LYS A 66 11.433 -6.909 -8.291 1.00 0.00 H new ATOM 0 HG2 LYS A 66 12.003 -6.555 -10.644 1.00 0.00 H new ATOM 0 HG3 LYS A 66 13.683 -6.960 -10.351 1.00 0.00 H new ATOM 0 HD2 LYS A 66 13.117 -9.295 -9.899 1.00 0.00 H new ATOM 0 HD3 LYS A 66 11.401 -8.939 -9.925 1.00 0.00 H new ATOM 0 HE2 LYS A 66 11.955 -9.946 -12.052 1.00 0.00 H new ATOM 0 HE3 LYS A 66 11.623 -8.251 -12.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 13.569 -8.984 -13.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 13.999 -7.819 -12.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 14.321 -9.461 -12.090 1.00 0.00 H new ATOM 1219 N ARG A 67 11.100 -3.917 -8.742 1.00 0.00 N ATOM 1220 CA ARG A 67 10.371 -2.893 -9.500 1.00 0.00 C ATOM 1221 C ARG A 67 11.121 -1.559 -9.516 1.00 0.00 C ATOM 1222 O ARG A 67 11.297 -1.007 -10.599 1.00 0.00 O ATOM 1223 CB ARG A 67 8.951 -2.701 -8.918 1.00 0.00 C ATOM 1224 CG ARG A 67 7.816 -3.338 -9.738 1.00 0.00 C ATOM 1225 CD ARG A 67 7.962 -4.849 -9.911 1.00 0.00 C ATOM 1226 NE ARG A 67 6.891 -5.439 -10.738 1.00 0.00 N ATOM 1227 CZ ARG A 67 6.981 -5.708 -12.048 1.00 0.00 C ATOM 1228 NH1 ARG A 67 7.888 -5.108 -12.813 1.00 0.00 N ATOM 1229 NH2 ARG A 67 6.163 -6.599 -12.593 1.00 0.00 N ATOM 0 H ARG A 67 10.590 -4.275 -7.935 1.00 0.00 H new ATOM 0 HA ARG A 67 10.291 -3.241 -10.530 1.00 0.00 H new ATOM 0 HB2 ARG A 67 8.929 -3.118 -7.911 1.00 0.00 H new ATOM 0 HB3 ARG A 67 8.755 -1.633 -8.825 1.00 0.00 H new ATOM 0 HG2 ARG A 67 6.864 -3.126 -9.251 1.00 0.00 H new ATOM 0 HG3 ARG A 67 7.782 -2.869 -10.722 1.00 0.00 H new ATOM 0 HD2 ARG A 67 8.928 -5.066 -10.368 1.00 0.00 H new ATOM 0 HD3 ARG A 67 7.960 -5.324 -8.930 1.00 0.00 H new ATOM 0 HE ARG A 67 6.010 -5.660 -10.274 1.00 0.00 H new ATOM 0 HH11 ARG A 67 8.531 -4.430 -12.405 1.00 0.00 H new ATOM 0 HH12 ARG A 67 7.941 -5.326 -13.808 1.00 0.00 H new ATOM 0 HH21 ARG A 67 5.470 -7.075 -12.016 1.00 0.00 H new ATOM 0 HH22 ARG A 67 6.227 -6.808 -13.589 1.00 0.00 H new ATOM 1243 N ILE A 68 11.653 -1.089 -8.385 1.00 0.00 N ATOM 1244 CA ILE A 68 12.361 0.194 -8.319 1.00 0.00 C ATOM 1245 C ILE A 68 13.779 0.182 -8.915 1.00 0.00 C ATOM 1246 O ILE A 68 14.440 1.220 -8.895 1.00 0.00 O ATOM 1247 CB ILE A 68 12.294 0.777 -6.893 1.00 0.00 C ATOM 1248 CG1 ILE A 68 13.115 -0.063 -5.905 1.00 0.00 C ATOM 1249 CG2 ILE A 68 10.826 0.957 -6.454 1.00 0.00 C ATOM 1250 CD1 ILE A 68 13.202 0.560 -4.516 1.00 0.00 C ATOM 0 H ILE A 68 11.606 -1.583 -7.494 1.00 0.00 H new ATOM 0 HA ILE A 68 11.827 0.874 -8.983 1.00 0.00 H new ATOM 0 HB ILE A 68 12.751 1.767 -6.897 1.00 0.00 H new ATOM 0 HG12 ILE A 68 12.670 -1.055 -5.824 1.00 0.00 H new ATOM 0 HG13 ILE A 68 14.122 -0.196 -6.300 1.00 0.00 H new ATOM 0 HG21 ILE A 68 10.796 1.369 -5.445 1.00 0.00 H new ATOM 0 HG22 ILE A 68 10.322 1.638 -7.140 1.00 0.00 H new ATOM 0 HG23 ILE A 68 10.321 -0.009 -6.466 1.00 0.00 H new ATOM 0 HD11 ILE A 68 13.795 -0.083 -3.866 1.00 0.00 H new ATOM 0 HD12 ILE A 68 13.673 1.540 -4.586 1.00 0.00 H new ATOM 0 HD13 ILE A 68 12.199 0.668 -4.102 1.00 0.00 H new ATOM 1262 N HIS A 69 14.253 -0.973 -9.409 1.00 0.00 N ATOM 1263 CA HIS A 69 15.556 -1.197 -10.051 1.00 0.00 C ATOM 1264 C HIS A 69 16.740 -0.424 -9.426 1.00 0.00 C ATOM 1265 O HIS A 69 17.613 0.080 -10.134 1.00 0.00 O ATOM 1266 CB HIS A 69 15.387 -0.970 -11.565 1.00 0.00 C ATOM 1267 CG HIS A 69 14.815 0.380 -11.950 1.00 0.00 C ATOM 1268 ND1 HIS A 69 15.430 1.602 -11.808 1.00 0.00 N ATOM 1269 CD2 HIS A 69 13.552 0.617 -12.423 1.00 0.00 C ATOM 1270 CE1 HIS A 69 14.551 2.548 -12.181 1.00 0.00 C ATOM 1271 NE2 HIS A 69 13.391 1.996 -12.582 1.00 0.00 N ATOM 0 H HIS A 69 13.700 -1.829 -9.367 1.00 0.00 H new ATOM 0 HA HIS A 69 15.853 -2.230 -9.868 1.00 0.00 H new ATOM 0 HB2 HIS A 69 16.358 -1.087 -12.045 1.00 0.00 H new ATOM 0 HB3 HIS A 69 14.738 -1.750 -11.964 1.00 0.00 H new ATOM 0 HD2 HIS A 69 12.807 -0.135 -12.637 1.00 0.00 H new ATOM 0 HE1 HIS A 69 14.749 3.609 -12.161 1.00 0.00 H new ATOM 0 HE2 HIS A 69 12.565 2.483 -12.930 1.00 0.00 H new ATOM 1279 N LEU A 70 16.752 -0.341 -8.093 1.00 0.00 N ATOM 1280 CA LEU A 70 17.749 0.337 -7.267 1.00 0.00 C ATOM 1281 C LEU A 70 19.147 -0.279 -7.312 1.00 0.00 C ATOM 1282 O LEU A 70 19.324 -1.410 -7.774 1.00 0.00 O ATOM 1283 CB LEU A 70 17.280 0.466 -5.810 1.00 0.00 C ATOM 1284 CG LEU A 70 16.900 -0.802 -5.013 1.00 0.00 C ATOM 1285 CD1 LEU A 70 17.837 -2.009 -5.107 1.00 0.00 C ATOM 1286 CD2 LEU A 70 16.832 -0.368 -3.550 1.00 0.00 C ATOM 0 H LEU A 70 16.020 -0.773 -7.529 1.00 0.00 H new ATOM 0 HA LEU A 70 17.841 1.327 -7.714 1.00 0.00 H new ATOM 0 HB2 LEU A 70 18.071 0.973 -5.257 1.00 0.00 H new ATOM 0 HB3 LEU A 70 16.413 1.126 -5.804 1.00 0.00 H new ATOM 0 HG LEU A 70 15.969 -1.164 -5.449 1.00 0.00 H new ATOM 0 HD11 LEU A 70 17.444 -2.823 -4.498 1.00 0.00 H new ATOM 0 HD12 LEU A 70 17.908 -2.334 -6.145 1.00 0.00 H new ATOM 0 HD13 LEU A 70 18.827 -1.730 -4.746 1.00 0.00 H new ATOM 0 HD21 LEU A 70 16.566 -1.223 -2.929 1.00 0.00 H new ATOM 0 HD22 LEU A 70 17.803 0.018 -3.240 1.00 0.00 H new ATOM 0 HD23 LEU A 70 16.078 0.411 -3.436 1.00 0.00 H new ATOM 1298 N ARG A 71 20.171 0.516 -6.973 1.00 0.00 N ATOM 1299 CA ARG A 71 21.540 -0.002 -6.927 1.00 0.00 C ATOM 1300 C ARG A 71 21.635 -0.821 -5.632 1.00 0.00 C ATOM 1301 O ARG A 71 20.971 -0.482 -4.652 1.00 0.00 O ATOM 1302 CB ARG A 71 22.604 1.101 -6.901 1.00 0.00 C ATOM 1303 CG ARG A 71 22.411 2.194 -7.959 1.00 0.00 C ATOM 1304 CD ARG A 71 23.680 3.049 -8.089 1.00 0.00 C ATOM 1305 NE ARG A 71 24.737 2.368 -8.869 1.00 0.00 N ATOM 1306 CZ ARG A 71 24.832 2.324 -10.205 1.00 0.00 C ATOM 1307 NH1 ARG A 71 23.920 2.922 -10.959 1.00 0.00 N ATOM 1308 NH2 ARG A 71 25.853 1.702 -10.780 1.00 0.00 N ATOM 0 H ARG A 71 20.078 1.503 -6.731 1.00 0.00 H new ATOM 0 HA ARG A 71 21.734 -0.587 -7.826 1.00 0.00 H new ATOM 0 HB2 ARG A 71 22.605 1.564 -5.914 1.00 0.00 H new ATOM 0 HB3 ARG A 71 23.585 0.646 -7.041 1.00 0.00 H new ATOM 0 HG2 ARG A 71 22.172 1.739 -8.920 1.00 0.00 H new ATOM 0 HG3 ARG A 71 21.566 2.826 -7.687 1.00 0.00 H new ATOM 0 HD2 ARG A 71 23.430 3.996 -8.568 1.00 0.00 H new ATOM 0 HD3 ARG A 71 24.060 3.285 -7.095 1.00 0.00 H new ATOM 0 HE ARG A 71 25.463 1.886 -8.339 1.00 0.00 H new ATOM 0 HH11 ARG A 71 23.143 3.418 -10.522 1.00 0.00 H new ATOM 0 HH12 ARG A 71 23.996 2.886 -11.976 1.00 0.00 H new ATOM 0 HH21 ARG A 71 26.568 1.256 -10.205 1.00 0.00 H new ATOM 0 HH22 ARG A 71 25.923 1.670 -11.797 1.00 0.00 H new ATOM 1322 N PRO A 72 22.493 -1.845 -5.556 1.00 0.00 N ATOM 1323 CA PRO A 72 22.612 -2.663 -4.358 1.00 0.00 C ATOM 1324 C PRO A 72 23.332 -1.934 -3.221 1.00 0.00 C ATOM 1325 O PRO A 72 23.142 -2.294 -2.062 1.00 0.00 O ATOM 1326 CB PRO A 72 23.362 -3.911 -4.817 1.00 0.00 C ATOM 1327 CG PRO A 72 24.224 -3.409 -5.970 1.00 0.00 C ATOM 1328 CD PRO A 72 23.344 -2.342 -6.615 1.00 0.00 C ATOM 0 HA PRO A 72 21.637 -2.908 -3.936 1.00 0.00 H new ATOM 0 HB2 PRO A 72 23.970 -4.331 -4.015 1.00 0.00 H new ATOM 0 HB3 PRO A 72 22.676 -4.694 -5.141 1.00 0.00 H new ATOM 0 HG2 PRO A 72 25.169 -2.995 -5.617 1.00 0.00 H new ATOM 0 HG3 PRO A 72 24.468 -4.208 -6.670 1.00 0.00 H new ATOM 0 HD2 PRO A 72 23.948 -1.541 -7.041 1.00 0.00 H new ATOM 0 HD3 PRO A 72 22.752 -2.762 -7.429 1.00 0.00 H new ATOM 1336 N GLU A 73 24.130 -0.910 -3.530 1.00 0.00 N ATOM 1337 CA GLU A 73 24.866 -0.139 -2.531 1.00 0.00 C ATOM 1338 C GLU A 73 23.941 0.863 -1.830 1.00 0.00 C ATOM 1339 O GLU A 73 24.308 1.447 -0.810 1.00 0.00 O ATOM 1340 CB GLU A 73 26.045 0.596 -3.193 1.00 0.00 C ATOM 1341 CG GLU A 73 26.896 -0.291 -4.115 1.00 0.00 C ATOM 1342 CD GLU A 73 27.376 -1.581 -3.442 1.00 0.00 C ATOM 1343 OE1 GLU A 73 28.474 -1.577 -2.849 1.00 0.00 O ATOM 1344 OE2 GLU A 73 26.731 -2.645 -3.616 1.00 0.00 O ATOM 0 H GLU A 73 24.283 -0.592 -4.487 1.00 0.00 H new ATOM 0 HA GLU A 73 25.255 -0.828 -1.781 1.00 0.00 H new ATOM 0 HB2 GLU A 73 25.658 1.436 -3.770 1.00 0.00 H new ATOM 0 HB3 GLU A 73 26.684 1.011 -2.414 1.00 0.00 H new ATOM 0 HG2 GLU A 73 26.314 -0.546 -5.000 1.00 0.00 H new ATOM 0 HG3 GLU A 73 27.762 0.277 -4.456 1.00 0.00 H new ATOM 1351 N ASP A 74 22.758 1.109 -2.399 1.00 0.00 N ATOM 1352 CA ASP A 74 21.781 2.023 -1.836 1.00 0.00 C ATOM 1353 C ASP A 74 20.924 1.241 -0.859 1.00 0.00 C ATOM 1354 O ASP A 74 20.744 0.024 -1.000 1.00 0.00 O ATOM 1355 CB ASP A 74 20.879 2.634 -2.918 1.00 0.00 C ATOM 1356 CG ASP A 74 21.595 3.627 -3.826 1.00 0.00 C ATOM 1357 OD1 ASP A 74 22.553 4.295 -3.381 1.00 0.00 O ATOM 1358 OD2 ASP A 74 21.191 3.759 -5.011 1.00 0.00 O ATOM 0 H ASP A 74 22.456 0.672 -3.270 1.00 0.00 H new ATOM 0 HA ASP A 74 22.306 2.842 -1.345 1.00 0.00 H new ATOM 0 HB2 ASP A 74 20.464 1.832 -3.528 1.00 0.00 H new ATOM 0 HB3 ASP A 74 20.039 3.136 -2.437 1.00 0.00 H new ATOM 1363 N ALA A 75 20.416 1.929 0.155 1.00 0.00 N ATOM 1364 CA ALA A 75 19.559 1.344 1.160 1.00 0.00 C ATOM 1365 C ALA A 75 18.104 1.520 0.737 1.00 0.00 C ATOM 1366 O ALA A 75 17.783 2.208 -0.240 1.00 0.00 O ATOM 1367 CB ALA A 75 19.841 1.994 2.509 1.00 0.00 C ATOM 0 H ALA A 75 20.594 2.923 0.298 1.00 0.00 H new ATOM 0 HA ALA A 75 19.757 0.277 1.259 1.00 0.00 H new ATOM 0 HB1 ALA A 75 19.195 1.553 3.268 1.00 0.00 H new ATOM 0 HB2 ALA A 75 20.884 1.830 2.781 1.00 0.00 H new ATOM 0 HB3 ALA A 75 19.647 3.065 2.445 1.00 0.00 H new ATOM 1373 N LEU A 76 17.225 0.842 1.470 1.00 0.00 N ATOM 1374 CA LEU A 76 15.796 0.869 1.244 1.00 0.00 C ATOM 1375 C LEU A 76 15.112 0.384 2.517 1.00 0.00 C ATOM 1376 O LEU A 76 15.366 -0.747 2.941 1.00 0.00 O ATOM 1377 CB LEU A 76 15.494 -0.089 0.071 1.00 0.00 C ATOM 1378 CG LEU A 76 14.076 0.068 -0.490 1.00 0.00 C ATOM 1379 CD1 LEU A 76 13.989 1.331 -1.356 1.00 0.00 C ATOM 1380 CD2 LEU A 76 13.697 -1.166 -1.322 1.00 0.00 C ATOM 0 H LEU A 76 17.499 0.248 2.253 1.00 0.00 H new ATOM 0 HA LEU A 76 15.437 1.869 1.002 1.00 0.00 H new ATOM 0 HB2 LEU A 76 16.215 0.087 -0.728 1.00 0.00 H new ATOM 0 HB3 LEU A 76 15.633 -1.117 0.405 1.00 0.00 H new ATOM 0 HG LEU A 76 13.378 0.161 0.342 1.00 0.00 H new ATOM 0 HD11 LEU A 76 12.978 1.433 -1.750 1.00 0.00 H new ATOM 0 HD12 LEU A 76 14.233 2.204 -0.751 1.00 0.00 H new ATOM 0 HD13 LEU A 76 14.694 1.254 -2.183 1.00 0.00 H new ATOM 0 HD21 LEU A 76 12.688 -1.044 -1.715 1.00 0.00 H new ATOM 0 HD22 LEU A 76 14.398 -1.276 -2.149 1.00 0.00 H new ATOM 0 HD23 LEU A 76 13.736 -2.055 -0.693 1.00 0.00 H new ATOM 1392 N PHE A 77 14.224 1.184 3.106 1.00 0.00 N ATOM 1393 CA PHE A 77 13.483 0.838 4.317 1.00 0.00 C ATOM 1394 C PHE A 77 12.004 1.111 4.094 1.00 0.00 C ATOM 1395 O PHE A 77 11.629 1.968 3.286 1.00 0.00 O ATOM 1396 CB PHE A 77 14.016 1.547 5.561 1.00 0.00 C ATOM 1397 CG PHE A 77 15.439 1.167 5.910 1.00 0.00 C ATOM 1398 CD1 PHE A 77 15.682 0.015 6.682 1.00 0.00 C ATOM 1399 CD2 PHE A 77 16.520 1.937 5.444 1.00 0.00 C ATOM 1400 CE1 PHE A 77 16.999 -0.374 6.981 1.00 0.00 C ATOM 1401 CE2 PHE A 77 17.835 1.545 5.740 1.00 0.00 C ATOM 1402 CZ PHE A 77 18.075 0.386 6.495 1.00 0.00 C ATOM 0 H PHE A 77 13.995 2.111 2.746 1.00 0.00 H new ATOM 0 HA PHE A 77 13.624 -0.225 4.512 1.00 0.00 H new ATOM 0 HB2 PHE A 77 13.964 2.625 5.406 1.00 0.00 H new ATOM 0 HB3 PHE A 77 13.369 1.315 6.407 1.00 0.00 H new ATOM 0 HD1 PHE A 77 14.852 -0.573 7.046 1.00 0.00 H new ATOM 0 HD2 PHE A 77 16.339 2.827 4.860 1.00 0.00 H new ATOM 0 HE1 PHE A 77 17.182 -1.253 7.581 1.00 0.00 H new ATOM 0 HE2 PHE A 77 18.665 2.137 5.385 1.00 0.00 H new ATOM 0 HZ PHE A 77 19.089 0.078 6.702 1.00 0.00 H new ATOM 1412 N PHE A 78 11.170 0.333 4.776 1.00 0.00 N ATOM 1413 CA PHE A 78 9.723 0.409 4.734 1.00 0.00 C ATOM 1414 C PHE A 78 9.230 0.575 6.160 1.00 0.00 C ATOM 1415 O PHE A 78 9.822 0.049 7.109 1.00 0.00 O ATOM 1416 CB PHE A 78 9.121 -0.853 4.108 1.00 0.00 C ATOM 1417 CG PHE A 78 9.176 -0.910 2.597 1.00 0.00 C ATOM 1418 CD1 PHE A 78 10.397 -1.150 1.945 1.00 0.00 C ATOM 1419 CD2 PHE A 78 8.001 -0.742 1.838 1.00 0.00 C ATOM 1420 CE1 PHE A 78 10.447 -1.213 0.546 1.00 0.00 C ATOM 1421 CE2 PHE A 78 8.053 -0.796 0.434 1.00 0.00 C ATOM 1422 CZ PHE A 78 9.280 -1.026 -0.210 1.00 0.00 C ATOM 0 H PHE A 78 11.505 -0.400 5.401 1.00 0.00 H new ATOM 0 HA PHE A 78 9.414 1.253 4.118 1.00 0.00 H new ATOM 0 HB2 PHE A 78 9.643 -1.722 4.508 1.00 0.00 H new ATOM 0 HB3 PHE A 78 8.080 -0.934 4.421 1.00 0.00 H new ATOM 0 HD1 PHE A 78 11.299 -1.286 2.523 1.00 0.00 H new ATOM 0 HD2 PHE A 78 7.058 -0.571 2.336 1.00 0.00 H new ATOM 0 HE1 PHE A 78 11.386 -1.406 0.049 1.00 0.00 H new ATOM 0 HE2 PHE A 78 7.153 -0.661 -0.147 1.00 0.00 H new ATOM 0 HZ PHE A 78 9.325 -1.059 -1.289 1.00 0.00 H new ATOM 1432 N PHE A 79 8.117 1.286 6.287 1.00 0.00 N ATOM 1433 CA PHE A 79 7.467 1.586 7.540 1.00 0.00 C ATOM 1434 C PHE A 79 5.962 1.450 7.320 1.00 0.00 C ATOM 1435 O PHE A 79 5.458 1.766 6.239 1.00 0.00 O ATOM 1436 CB PHE A 79 7.824 3.029 7.967 1.00 0.00 C ATOM 1437 CG PHE A 79 9.292 3.426 7.837 1.00 0.00 C ATOM 1438 CD1 PHE A 79 9.821 3.779 6.576 1.00 0.00 C ATOM 1439 CD2 PHE A 79 10.140 3.435 8.961 1.00 0.00 C ATOM 1440 CE1 PHE A 79 11.187 4.069 6.429 1.00 0.00 C ATOM 1441 CE2 PHE A 79 11.501 3.765 8.818 1.00 0.00 C ATOM 1442 CZ PHE A 79 12.028 4.072 7.552 1.00 0.00 C ATOM 0 H PHE A 79 7.629 1.682 5.483 1.00 0.00 H new ATOM 0 HA PHE A 79 7.792 0.906 8.327 1.00 0.00 H new ATOM 0 HB2 PHE A 79 7.228 3.720 7.371 1.00 0.00 H new ATOM 0 HB3 PHE A 79 7.523 3.163 9.006 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.169 3.826 5.717 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.745 3.188 9.935 1.00 0.00 H new ATOM 0 HE1 PHE A 79 11.590 4.290 5.452 1.00 0.00 H new ATOM 0 HE2 PHE A 79 12.144 3.782 9.686 1.00 0.00 H new ATOM 0 HZ PHE A 79 13.076 4.309 7.444 1.00 0.00 H new ATOM 1452 N VAL A 80 5.249 0.952 8.321 1.00 0.00 N ATOM 1453 CA VAL A 80 3.803 0.788 8.339 1.00 0.00 C ATOM 1454 C VAL A 80 3.434 1.551 9.599 1.00 0.00 C ATOM 1455 O VAL A 80 3.933 1.237 10.676 1.00 0.00 O ATOM 1456 CB VAL A 80 3.329 -0.680 8.301 1.00 0.00 C ATOM 1457 CG1 VAL A 80 4.164 -1.641 9.145 1.00 0.00 C ATOM 1458 CG2 VAL A 80 1.844 -0.801 8.684 1.00 0.00 C ATOM 0 H VAL A 80 5.687 0.636 9.186 1.00 0.00 H new ATOM 0 HA VAL A 80 3.304 1.166 7.447 1.00 0.00 H new ATOM 0 HB VAL A 80 3.469 -0.986 7.264 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.758 -2.649 9.058 1.00 0.00 H new ATOM 0 HG12 VAL A 80 5.195 -1.633 8.792 1.00 0.00 H new ATOM 0 HG13 VAL A 80 4.136 -1.328 10.189 1.00 0.00 H new ATOM 0 HG21 VAL A 80 1.543 -1.848 8.647 1.00 0.00 H new ATOM 0 HG22 VAL A 80 1.696 -0.416 9.693 1.00 0.00 H new ATOM 0 HG23 VAL A 80 1.239 -0.225 7.984 1.00 0.00 H new ATOM 1468 N ASN A 81 2.578 2.558 9.467 1.00 0.00 N ATOM 1469 CA ASN A 81 2.129 3.426 10.546 1.00 0.00 C ATOM 1470 C ASN A 81 3.286 3.863 11.444 1.00 0.00 C ATOM 1471 O ASN A 81 3.290 3.686 12.665 1.00 0.00 O ATOM 1472 CB ASN A 81 0.976 2.816 11.333 1.00 0.00 C ATOM 1473 CG ASN A 81 0.341 3.887 12.209 1.00 0.00 C ATOM 1474 OD1 ASN A 81 0.288 5.060 11.826 1.00 0.00 O ATOM 1475 ND2 ASN A 81 -0.173 3.524 13.361 1.00 0.00 N ATOM 0 H ASN A 81 2.162 2.801 8.568 1.00 0.00 H new ATOM 0 HA ASN A 81 1.736 4.331 10.084 1.00 0.00 H new ATOM 0 HB2 ASN A 81 0.234 2.402 10.650 1.00 0.00 H new ATOM 0 HB3 ASN A 81 1.337 1.993 11.950 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -0.626 4.216 13.958 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -0.119 2.550 13.659 1.00 0.00 H new ATOM 1482 N ASN A 82 4.316 4.427 10.807 1.00 0.00 N ATOM 1483 CA ASN A 82 5.520 4.929 11.461 1.00 0.00 C ATOM 1484 C ASN A 82 6.272 3.842 12.266 1.00 0.00 C ATOM 1485 O ASN A 82 7.157 4.200 13.050 1.00 0.00 O ATOM 1486 CB ASN A 82 5.193 6.153 12.364 1.00 0.00 C ATOM 1487 CG ASN A 82 3.925 6.945 12.035 1.00 0.00 C ATOM 1488 OD1 ASN A 82 3.812 7.593 10.996 1.00 0.00 O ATOM 1489 ND2 ASN A 82 2.927 6.879 12.903 1.00 0.00 N ATOM 0 H ASN A 82 4.332 4.549 9.794 1.00 0.00 H new ATOM 0 HA ASN A 82 6.192 5.246 10.663 1.00 0.00 H new ATOM 0 HB2 ASN A 82 5.115 5.803 13.393 1.00 0.00 H new ATOM 0 HB3 ASN A 82 6.040 6.838 12.324 1.00 0.00 H new ATOM 0 HD21 ASN A 82 2.053 7.369 12.713 1.00 0.00 H new ATOM 0 HD22 ASN A 82 3.033 6.338 13.761 1.00 0.00 H new ATOM 1496 N THR A 83 5.981 2.552 12.075 1.00 0.00 N ATOM 1497 CA THR A 83 6.546 1.387 12.762 1.00 0.00 C ATOM 1498 C THR A 83 7.212 0.419 11.768 1.00 0.00 C ATOM 1499 O THR A 83 6.870 0.423 10.584 1.00 0.00 O ATOM 1500 CB THR A 83 5.416 0.781 13.624 1.00 0.00 C ATOM 1501 OG1 THR A 83 4.894 1.803 14.462 1.00 0.00 O ATOM 1502 CG2 THR A 83 5.851 -0.373 14.528 1.00 0.00 C ATOM 0 H THR A 83 5.288 2.273 11.380 1.00 0.00 H new ATOM 0 HA THR A 83 7.365 1.658 13.428 1.00 0.00 H new ATOM 0 HB THR A 83 4.685 0.379 12.922 1.00 0.00 H new ATOM 0 HG1 THR A 83 4.307 2.387 13.938 1.00 0.00 H new ATOM 0 HG21 THR A 83 4.993 -0.735 15.095 1.00 0.00 H new ATOM 0 HG22 THR A 83 6.250 -1.183 13.917 1.00 0.00 H new ATOM 0 HG23 THR A 83 6.621 -0.025 15.217 1.00 0.00 H new ATOM 1510 N ILE A 84 8.190 -0.380 12.219 1.00 0.00 N ATOM 1511 CA ILE A 84 8.952 -1.321 11.394 1.00 0.00 C ATOM 1512 C ILE A 84 8.680 -2.795 11.780 1.00 0.00 C ATOM 1513 O ILE A 84 9.160 -3.245 12.826 1.00 0.00 O ATOM 1514 CB ILE A 84 10.453 -0.960 11.495 1.00 0.00 C ATOM 1515 CG1 ILE A 84 10.692 0.541 11.194 1.00 0.00 C ATOM 1516 CG2 ILE A 84 11.260 -1.840 10.529 1.00 0.00 C ATOM 1517 CD1 ILE A 84 12.161 0.973 11.207 1.00 0.00 C ATOM 0 H ILE A 84 8.479 -0.387 13.197 1.00 0.00 H new ATOM 0 HA ILE A 84 8.628 -1.230 10.357 1.00 0.00 H new ATOM 0 HB ILE A 84 10.787 -1.147 12.516 1.00 0.00 H new ATOM 0 HG12 ILE A 84 10.268 0.773 10.217 1.00 0.00 H new ATOM 0 HG13 ILE A 84 10.147 1.135 11.927 1.00 0.00 H new ATOM 0 HG21 ILE A 84 12.317 -1.585 10.601 1.00 0.00 H new ATOM 0 HG22 ILE A 84 11.121 -2.889 10.790 1.00 0.00 H new ATOM 0 HG23 ILE A 84 10.915 -1.672 9.509 1.00 0.00 H new ATOM 0 HD11 ILE A 84 12.229 2.038 10.986 1.00 0.00 H new ATOM 0 HD12 ILE A 84 12.589 0.778 12.190 1.00 0.00 H new ATOM 0 HD13 ILE A 84 12.712 0.410 10.454 1.00 0.00 H new ATOM 1529 N PRO A 85 7.956 -3.578 10.958 1.00 0.00 N ATOM 1530 CA PRO A 85 7.649 -4.983 11.219 1.00 0.00 C ATOM 1531 C PRO A 85 8.773 -5.922 10.722 1.00 0.00 C ATOM 1532 O PRO A 85 9.523 -5.565 9.805 1.00 0.00 O ATOM 1533 CB PRO A 85 6.367 -5.239 10.417 1.00 0.00 C ATOM 1534 CG PRO A 85 6.581 -4.379 9.172 1.00 0.00 C ATOM 1535 CD PRO A 85 7.335 -3.162 9.715 1.00 0.00 C ATOM 0 HA PRO A 85 7.544 -5.178 12.286 1.00 0.00 H new ATOM 0 HB2 PRO A 85 6.248 -6.293 10.167 1.00 0.00 H new ATOM 0 HB3 PRO A 85 5.476 -4.940 10.969 1.00 0.00 H new ATOM 0 HG2 PRO A 85 7.159 -4.906 8.413 1.00 0.00 H new ATOM 0 HG3 PRO A 85 5.635 -4.094 8.711 1.00 0.00 H new ATOM 0 HD2 PRO A 85 8.086 -2.822 9.002 1.00 0.00 H new ATOM 0 HD3 PRO A 85 6.654 -2.328 9.883 1.00 0.00 H new ATOM 1543 N PRO A 86 8.870 -7.154 11.257 1.00 0.00 N ATOM 1544 CA PRO A 86 9.887 -8.117 10.847 1.00 0.00 C ATOM 1545 C PRO A 86 9.601 -8.716 9.461 1.00 0.00 C ATOM 1546 O PRO A 86 8.451 -8.833 9.039 1.00 0.00 O ATOM 1547 CB PRO A 86 9.889 -9.185 11.943 1.00 0.00 C ATOM 1548 CG PRO A 86 8.497 -9.124 12.563 1.00 0.00 C ATOM 1549 CD PRO A 86 8.054 -7.679 12.345 1.00 0.00 C ATOM 0 HA PRO A 86 10.863 -7.643 10.742 1.00 0.00 H new ATOM 0 HB2 PRO A 86 10.093 -10.173 11.530 1.00 0.00 H new ATOM 0 HB3 PRO A 86 10.660 -8.985 12.687 1.00 0.00 H new ATOM 0 HG2 PRO A 86 7.816 -9.826 12.083 1.00 0.00 H new ATOM 0 HG3 PRO A 86 8.521 -9.378 13.623 1.00 0.00 H new ATOM 0 HD2 PRO A 86 6.995 -7.632 12.092 1.00 0.00 H new ATOM 0 HD3 PRO A 86 8.192 -7.090 13.252 1.00 0.00 H new ATOM 1557 N THR A 87 10.651 -9.159 8.763 1.00 0.00 N ATOM 1558 CA THR A 87 10.564 -9.752 7.426 1.00 0.00 C ATOM 1559 C THR A 87 9.764 -11.068 7.415 1.00 0.00 C ATOM 1560 O THR A 87 9.140 -11.409 6.404 1.00 0.00 O ATOM 1561 CB THR A 87 11.991 -9.876 6.848 1.00 0.00 C ATOM 1562 OG1 THR A 87 11.988 -10.368 5.529 1.00 0.00 O ATOM 1563 CG2 THR A 87 12.948 -10.750 7.659 1.00 0.00 C ATOM 0 H THR A 87 11.605 -9.114 9.120 1.00 0.00 H new ATOM 0 HA THR A 87 9.991 -9.097 6.770 1.00 0.00 H new ATOM 0 HB THR A 87 12.357 -8.850 6.887 1.00 0.00 H new ATOM 0 HG1 THR A 87 12.909 -10.430 5.201 1.00 0.00 H new ATOM 0 HG21 THR A 87 13.922 -10.773 7.171 1.00 0.00 H new ATOM 0 HG22 THR A 87 13.055 -10.338 8.663 1.00 0.00 H new ATOM 0 HG23 THR A 87 12.550 -11.763 7.723 1.00 0.00 H new ATOM 1571 N SER A 88 9.746 -11.802 8.534 1.00 0.00 N ATOM 1572 CA SER A 88 9.020 -13.060 8.665 1.00 0.00 C ATOM 1573 C SER A 88 7.512 -12.828 8.884 1.00 0.00 C ATOM 1574 O SER A 88 6.748 -13.795 8.862 1.00 0.00 O ATOM 1575 CB SER A 88 9.661 -13.868 9.802 1.00 0.00 C ATOM 1576 OG SER A 88 9.341 -15.241 9.724 1.00 0.00 O ATOM 0 H SER A 88 10.243 -11.531 9.382 1.00 0.00 H new ATOM 0 HA SER A 88 9.094 -13.629 7.738 1.00 0.00 H new ATOM 0 HB2 SER A 88 10.744 -13.746 9.767 1.00 0.00 H new ATOM 0 HB3 SER A 88 9.326 -13.472 10.761 1.00 0.00 H new ATOM 0 HG SER A 88 8.403 -15.344 9.459 1.00 0.00 H new ATOM 1582 N ALA A 89 7.076 -11.583 9.137 1.00 0.00 N ATOM 1583 CA ALA A 89 5.667 -11.261 9.342 1.00 0.00 C ATOM 1584 C ALA A 89 4.882 -11.402 8.036 1.00 0.00 C ATOM 1585 O ALA A 89 5.464 -11.642 6.972 1.00 0.00 O ATOM 1586 CB ALA A 89 5.536 -9.819 9.853 1.00 0.00 C ATOM 0 H ALA A 89 7.696 -10.776 9.204 1.00 0.00 H new ATOM 0 HA ALA A 89 5.260 -11.956 10.076 1.00 0.00 H new ATOM 0 HB1 ALA A 89 4.483 -9.581 10.005 1.00 0.00 H new ATOM 0 HB2 ALA A 89 6.071 -9.718 10.797 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.961 -9.133 9.120 1.00 0.00 H new ATOM 1592 N THR A 90 3.561 -11.213 8.098 1.00 0.00 N ATOM 1593 CA THR A 90 2.693 -11.288 6.933 1.00 0.00 C ATOM 1594 C THR A 90 1.940 -9.978 6.747 1.00 0.00 C ATOM 1595 O THR A 90 1.720 -9.213 7.691 1.00 0.00 O ATOM 1596 CB THR A 90 1.731 -12.489 6.987 1.00 0.00 C ATOM 1597 OG1 THR A 90 0.910 -12.514 8.140 1.00 0.00 O ATOM 1598 CG2 THR A 90 2.506 -13.799 6.928 1.00 0.00 C ATOM 0 H THR A 90 3.067 -11.003 8.965 1.00 0.00 H new ATOM 0 HA THR A 90 3.330 -11.449 6.063 1.00 0.00 H new ATOM 0 HB THR A 90 1.082 -12.375 6.119 1.00 0.00 H new ATOM 0 HG1 THR A 90 0.325 -13.300 8.108 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.809 -14.636 6.967 1.00 0.00 H new ATOM 0 HG22 THR A 90 3.075 -13.844 5.999 1.00 0.00 H new ATOM 0 HG23 THR A 90 3.190 -13.856 7.775 1.00 0.00 H new ATOM 1606 N MET A 91 1.506 -9.752 5.510 1.00 0.00 N ATOM 1607 CA MET A 91 0.750 -8.581 5.110 1.00 0.00 C ATOM 1608 C MET A 91 -0.528 -8.448 5.943 1.00 0.00 C ATOM 1609 O MET A 91 -0.938 -7.334 6.252 1.00 0.00 O ATOM 1610 CB MET A 91 0.420 -8.705 3.616 1.00 0.00 C ATOM 1611 CG MET A 91 1.644 -8.517 2.709 1.00 0.00 C ATOM 1612 SD MET A 91 2.672 -7.043 2.981 1.00 0.00 S ATOM 1613 CE MET A 91 1.416 -5.743 2.864 1.00 0.00 C ATOM 0 H MET A 91 1.678 -10.400 4.741 1.00 0.00 H new ATOM 0 HA MET A 91 1.342 -7.682 5.282 1.00 0.00 H new ATOM 0 HB2 MET A 91 -0.017 -9.686 3.427 1.00 0.00 H new ATOM 0 HB3 MET A 91 -0.335 -7.964 3.355 1.00 0.00 H new ATOM 0 HG2 MET A 91 2.280 -9.395 2.817 1.00 0.00 H new ATOM 0 HG3 MET A 91 1.297 -8.499 1.676 1.00 0.00 H new ATOM 0 HE1 MET A 91 1.893 -4.799 2.600 1.00 0.00 H new ATOM 0 HE2 MET A 91 0.688 -6.008 2.097 1.00 0.00 H new ATOM 0 HE3 MET A 91 0.910 -5.638 3.824 1.00 0.00 H new ATOM 1623 N GLY A 92 -1.139 -9.570 6.323 1.00 0.00 N ATOM 1624 CA GLY A 92 -2.348 -9.658 7.118 1.00 0.00 C ATOM 1625 C GLY A 92 -2.114 -9.252 8.570 1.00 0.00 C ATOM 1626 O GLY A 92 -2.945 -8.565 9.150 1.00 0.00 O ATOM 0 H GLY A 92 -0.778 -10.489 6.066 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.115 -9.017 6.682 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -2.729 -10.679 7.085 1.00 0.00 H new ATOM 1630 N GLN A 93 -0.981 -9.638 9.158 1.00 0.00 N ATOM 1631 CA GLN A 93 -0.651 -9.313 10.541 1.00 0.00 C ATOM 1632 C GLN A 93 -0.443 -7.807 10.716 1.00 0.00 C ATOM 1633 O GLN A 93 -0.962 -7.222 11.666 1.00 0.00 O ATOM 1634 CB GLN A 93 0.595 -10.106 10.946 1.00 0.00 C ATOM 1635 CG GLN A 93 0.229 -11.546 11.336 1.00 0.00 C ATOM 1636 CD GLN A 93 0.093 -11.679 12.848 1.00 0.00 C ATOM 1637 OE1 GLN A 93 -0.997 -11.698 13.413 1.00 0.00 O ATOM 1638 NE2 GLN A 93 1.223 -11.736 13.526 1.00 0.00 N ATOM 0 H GLN A 93 -0.265 -10.188 8.684 1.00 0.00 H new ATOM 0 HA GLN A 93 -1.479 -9.592 11.193 1.00 0.00 H new ATOM 0 HB2 GLN A 93 1.306 -10.119 10.120 1.00 0.00 H new ATOM 0 HB3 GLN A 93 1.088 -9.613 11.784 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -0.707 -11.831 10.856 1.00 0.00 H new ATOM 0 HG3 GLN A 93 0.995 -12.232 10.973 1.00 0.00 H new ATOM 0 HE21 GLN A 93 2.115 -11.719 13.032 1.00 0.00 H new ATOM 0 HE22 GLN A 93 1.204 -11.798 14.544 1.00 0.00 H new ATOM 1647 N LEU A 94 0.340 -7.174 9.840 1.00 0.00 N ATOM 1648 CA LEU A 94 0.593 -5.740 9.897 1.00 0.00 C ATOM 1649 C LEU A 94 -0.698 -5.012 9.539 1.00 0.00 C ATOM 1650 O LEU A 94 -0.954 -3.949 10.090 1.00 0.00 O ATOM 1651 CB LEU A 94 1.850 -5.333 9.115 1.00 0.00 C ATOM 1652 CG LEU A 94 1.780 -5.524 7.591 1.00 0.00 C ATOM 1653 CD1 LEU A 94 1.408 -4.220 6.885 1.00 0.00 C ATOM 1654 CD2 LEU A 94 3.126 -6.010 7.053 1.00 0.00 C ATOM 0 H LEU A 94 0.816 -7.646 9.071 1.00 0.00 H new ATOM 0 HA LEU A 94 0.853 -5.428 10.908 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.060 -4.283 9.322 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.694 -5.908 9.496 1.00 0.00 H new ATOM 0 HG LEU A 94 1.009 -6.268 7.391 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.367 -4.388 5.809 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.434 -3.881 7.237 1.00 0.00 H new ATOM 0 HD13 LEU A 94 2.158 -3.460 7.105 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.060 -6.141 5.973 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.897 -5.275 7.284 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.382 -6.962 7.519 1.00 0.00 H new ATOM 1666 N TYR A 95 -1.512 -5.569 8.633 1.00 0.00 N ATOM 1667 CA TYR A 95 -2.797 -5.010 8.251 1.00 0.00 C ATOM 1668 C TYR A 95 -3.680 -4.966 9.498 1.00 0.00 C ATOM 1669 O TYR A 95 -4.246 -3.925 9.804 1.00 0.00 O ATOM 1670 CB TYR A 95 -3.420 -5.895 7.166 1.00 0.00 C ATOM 1671 CG TYR A 95 -4.927 -5.920 7.110 1.00 0.00 C ATOM 1672 CD1 TYR A 95 -5.612 -4.769 6.704 1.00 0.00 C ATOM 1673 CD2 TYR A 95 -5.639 -7.092 7.444 1.00 0.00 C ATOM 1674 CE1 TYR A 95 -7.000 -4.808 6.573 1.00 0.00 C ATOM 1675 CE2 TYR A 95 -7.040 -7.126 7.330 1.00 0.00 C ATOM 1676 CZ TYR A 95 -7.720 -5.973 6.881 1.00 0.00 C ATOM 1677 OH TYR A 95 -9.066 -5.961 6.713 1.00 0.00 O ATOM 0 H TYR A 95 -1.285 -6.434 8.142 1.00 0.00 H new ATOM 0 HA TYR A 95 -2.690 -4.002 7.851 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -3.047 -5.563 6.197 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -3.066 -6.916 7.311 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.070 -3.858 6.494 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -5.106 -7.966 7.788 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -7.528 -3.930 6.230 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -7.588 -8.022 7.582 1.00 0.00 H new ATOM 0 HH TYR A 95 -9.299 -5.347 5.986 1.00 0.00 H new ATOM 1687 N GLU A 96 -3.770 -6.077 10.236 1.00 0.00 N ATOM 1688 CA GLU A 96 -4.562 -6.192 11.451 1.00 0.00 C ATOM 1689 C GLU A 96 -4.021 -5.261 12.538 1.00 0.00 C ATOM 1690 O GLU A 96 -4.791 -4.762 13.362 1.00 0.00 O ATOM 1691 CB GLU A 96 -4.576 -7.665 11.883 1.00 0.00 C ATOM 1692 CG GLU A 96 -5.338 -7.884 13.196 1.00 0.00 C ATOM 1693 CD GLU A 96 -6.051 -9.231 13.239 1.00 0.00 C ATOM 1694 OE1 GLU A 96 -5.509 -10.252 12.768 1.00 0.00 O ATOM 1695 OE2 GLU A 96 -7.255 -9.230 13.602 1.00 0.00 O ATOM 0 H GLU A 96 -3.280 -6.938 9.994 1.00 0.00 H new ATOM 0 HA GLU A 96 -5.590 -5.877 11.270 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.032 -8.267 11.097 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -3.551 -8.016 11.999 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.642 -7.818 14.032 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -6.068 -7.085 13.326 1.00 0.00 H new ATOM 1702 N ASP A 97 -2.724 -4.984 12.546 1.00 0.00 N ATOM 1703 CA ASP A 97 -2.088 -4.094 13.514 1.00 0.00 C ATOM 1704 C ASP A 97 -2.271 -2.619 13.123 1.00 0.00 C ATOM 1705 O ASP A 97 -2.242 -1.736 13.974 1.00 0.00 O ATOM 1706 CB ASP A 97 -0.621 -4.486 13.641 1.00 0.00 C ATOM 1707 CG ASP A 97 0.088 -3.883 14.847 1.00 0.00 C ATOM 1708 OD1 ASP A 97 -0.561 -3.562 15.869 1.00 0.00 O ATOM 1709 OD2 ASP A 97 1.335 -3.837 14.789 1.00 0.00 O ATOM 0 H ASP A 97 -2.071 -5.378 11.869 1.00 0.00 H new ATOM 0 HA ASP A 97 -2.565 -4.203 14.488 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -0.551 -5.572 13.699 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -0.096 -4.181 12.736 1.00 0.00 H new ATOM 1714 N ASN A 98 -2.536 -2.354 11.833 1.00 0.00 N ATOM 1715 CA ASN A 98 -2.765 -1.014 11.266 1.00 0.00 C ATOM 1716 C ASN A 98 -4.253 -0.739 10.949 1.00 0.00 C ATOM 1717 O ASN A 98 -4.588 0.306 10.391 1.00 0.00 O ATOM 1718 CB ASN A 98 -1.842 -0.749 10.064 1.00 0.00 C ATOM 1719 CG ASN A 98 -1.753 0.717 9.606 1.00 0.00 C ATOM 1720 OD1 ASN A 98 -1.283 0.978 8.501 1.00 0.00 O ATOM 1721 ND2 ASN A 98 -2.124 1.711 10.403 1.00 0.00 N ATOM 0 H ASN A 98 -2.599 -3.092 11.132 1.00 0.00 H new ATOM 0 HA ASN A 98 -2.499 -0.294 12.040 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -0.839 -1.094 10.316 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -2.186 -1.353 9.224 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -2.018 2.678 10.096 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -2.516 1.508 11.323 1.00 0.00 H new ATOM 1728 N HIS A 99 -5.143 -1.687 11.252 1.00 0.00 N ATOM 1729 CA HIS A 99 -6.583 -1.646 11.013 1.00 0.00 C ATOM 1730 C HIS A 99 -7.238 -0.295 11.340 1.00 0.00 C ATOM 1731 O HIS A 99 -7.370 0.097 12.503 1.00 0.00 O ATOM 1732 CB HIS A 99 -7.291 -2.833 11.696 1.00 0.00 C ATOM 1733 CG HIS A 99 -7.474 -2.732 13.196 1.00 0.00 C ATOM 1734 ND1 HIS A 99 -8.669 -2.846 13.876 1.00 0.00 N ATOM 1735 CD2 HIS A 99 -6.498 -2.482 14.124 1.00 0.00 C ATOM 1736 CE1 HIS A 99 -8.415 -2.668 15.184 1.00 0.00 C ATOM 1737 NE2 HIS A 99 -7.103 -2.454 15.384 1.00 0.00 N ATOM 0 H HIS A 99 -4.856 -2.558 11.699 1.00 0.00 H new ATOM 0 HA HIS A 99 -6.715 -1.753 9.936 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -8.273 -2.955 11.239 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -6.725 -3.739 11.481 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -5.448 -2.333 13.919 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -9.161 -2.693 15.965 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -6.640 -2.301 16.280 1.00 0.00 H new ATOM 1745 N GLU A 100 -7.690 0.402 10.303 1.00 0.00 N ATOM 1746 CA GLU A 100 -8.362 1.693 10.357 1.00 0.00 C ATOM 1747 C GLU A 100 -9.817 1.452 9.926 1.00 0.00 C ATOM 1748 O GLU A 100 -10.162 0.386 9.397 1.00 0.00 O ATOM 1749 CB GLU A 100 -7.577 2.685 9.478 1.00 0.00 C ATOM 1750 CG GLU A 100 -8.159 4.104 9.361 1.00 0.00 C ATOM 1751 CD GLU A 100 -8.326 4.792 10.715 1.00 0.00 C ATOM 1752 OE1 GLU A 100 -9.351 4.557 11.396 1.00 0.00 O ATOM 1753 OE2 GLU A 100 -7.463 5.610 11.106 1.00 0.00 O ATOM 0 H GLU A 100 -7.591 0.060 9.347 1.00 0.00 H new ATOM 0 HA GLU A 100 -8.389 2.140 11.351 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -6.564 2.763 9.872 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -7.498 2.265 8.475 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -7.507 4.708 8.730 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -9.127 4.054 8.863 1.00 0.00 H new ATOM 1760 N GLU A 101 -10.715 2.399 10.175 1.00 0.00 N ATOM 1761 CA GLU A 101 -12.136 2.303 9.833 1.00 0.00 C ATOM 1762 C GLU A 101 -12.422 2.555 8.345 1.00 0.00 C ATOM 1763 O GLU A 101 -13.578 2.691 7.946 1.00 0.00 O ATOM 1764 CB GLU A 101 -12.950 3.235 10.737 1.00 0.00 C ATOM 1765 CG GLU A 101 -12.735 2.888 12.215 1.00 0.00 C ATOM 1766 CD GLU A 101 -13.895 3.381 13.066 1.00 0.00 C ATOM 1767 OE1 GLU A 101 -14.140 4.599 13.151 1.00 0.00 O ATOM 1768 OE2 GLU A 101 -14.596 2.537 13.674 1.00 0.00 O ATOM 0 H GLU A 101 -10.472 3.278 10.632 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.447 1.274 10.012 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -12.659 4.270 10.556 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -14.009 3.154 10.490 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -12.630 1.809 12.327 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.806 3.337 12.566 1.00 0.00 H new ATOM 1775 N ASP A 102 -11.384 2.688 7.522 1.00 0.00 N ATOM 1776 CA ASP A 102 -11.474 2.913 6.083 1.00 0.00 C ATOM 1777 C ASP A 102 -11.147 1.662 5.266 1.00 0.00 C ATOM 1778 O ASP A 102 -11.310 1.674 4.049 1.00 0.00 O ATOM 1779 CB ASP A 102 -10.571 4.077 5.682 1.00 0.00 C ATOM 1780 CG ASP A 102 -9.072 3.770 5.711 1.00 0.00 C ATOM 1781 OD1 ASP A 102 -8.667 2.705 6.215 1.00 0.00 O ATOM 1782 OD2 ASP A 102 -8.337 4.677 5.254 1.00 0.00 O ATOM 0 H ASP A 102 -10.420 2.640 7.853 1.00 0.00 H new ATOM 0 HA ASP A 102 -12.510 3.164 5.857 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -10.842 4.398 4.676 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -10.768 4.917 6.348 1.00 0.00 H new ATOM 1787 N TYR A 103 -10.757 0.568 5.928 1.00 0.00 N ATOM 1788 CA TYR A 103 -10.396 -0.701 5.308 1.00 0.00 C ATOM 1789 C TYR A 103 -9.231 -0.583 4.299 1.00 0.00 C ATOM 1790 O TYR A 103 -9.143 -1.404 3.376 1.00 0.00 O ATOM 1791 CB TYR A 103 -11.650 -1.416 4.773 1.00 0.00 C ATOM 1792 CG TYR A 103 -12.565 -1.985 5.841 1.00 0.00 C ATOM 1793 CD1 TYR A 103 -12.183 -3.145 6.542 1.00 0.00 C ATOM 1794 CD2 TYR A 103 -13.806 -1.384 6.115 1.00 0.00 C ATOM 1795 CE1 TYR A 103 -13.047 -3.729 7.484 1.00 0.00 C ATOM 1796 CE2 TYR A 103 -14.672 -1.954 7.065 1.00 0.00 C ATOM 1797 CZ TYR A 103 -14.299 -3.136 7.749 1.00 0.00 C ATOM 1798 OH TYR A 103 -15.122 -3.699 8.678 1.00 0.00 O ATOM 0 H TYR A 103 -10.683 0.546 6.945 1.00 0.00 H new ATOM 0 HA TYR A 103 -9.982 -1.349 6.080 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -12.219 -0.713 4.164 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -11.336 -2.226 4.115 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -11.217 -3.590 6.354 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -14.095 -0.483 5.595 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -12.753 -4.629 8.003 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -15.624 -1.489 7.273 1.00 0.00 H new ATOM 0 HH TYR A 103 -15.946 -3.173 8.747 1.00 0.00 H new ATOM 1808 N PHE A 104 -8.339 0.404 4.442 1.00 0.00 N ATOM 1809 CA PHE A 104 -7.179 0.607 3.579 1.00 0.00 C ATOM 1810 C PHE A 104 -5.899 0.511 4.418 1.00 0.00 C ATOM 1811 O PHE A 104 -5.876 0.945 5.570 1.00 0.00 O ATOM 1812 CB PHE A 104 -7.293 1.939 2.832 1.00 0.00 C ATOM 1813 CG PHE A 104 -7.900 1.839 1.442 1.00 0.00 C ATOM 1814 CD1 PHE A 104 -7.122 1.364 0.370 1.00 0.00 C ATOM 1815 CD2 PHE A 104 -9.225 2.246 1.204 1.00 0.00 C ATOM 1816 CE1 PHE A 104 -7.645 1.332 -0.934 1.00 0.00 C ATOM 1817 CE2 PHE A 104 -9.750 2.202 -0.101 1.00 0.00 C ATOM 1818 CZ PHE A 104 -8.960 1.755 -1.168 1.00 0.00 C ATOM 0 H PHE A 104 -8.410 1.101 5.183 1.00 0.00 H new ATOM 0 HA PHE A 104 -7.139 -0.173 2.819 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -7.896 2.624 3.428 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -6.299 2.379 2.749 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -6.114 1.021 0.551 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -9.839 2.592 2.022 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -7.035 0.982 -1.754 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -10.768 2.515 -0.281 1.00 0.00 H new ATOM 0 HZ PHE A 104 -9.364 1.736 -2.169 1.00 0.00 H new ATOM 1828 N LEU A 105 -4.799 0.010 3.834 1.00 0.00 N ATOM 1829 CA LEU A 105 -3.518 -0.160 4.529 1.00 0.00 C ATOM 1830 C LEU A 105 -2.481 0.835 3.985 1.00 0.00 C ATOM 1831 O LEU A 105 -2.255 0.879 2.774 1.00 0.00 O ATOM 1832 CB LEU A 105 -3.054 -1.618 4.316 1.00 0.00 C ATOM 1833 CG LEU A 105 -2.381 -2.312 5.512 1.00 0.00 C ATOM 1834 CD1 LEU A 105 -1.564 -3.496 4.988 1.00 0.00 C ATOM 1835 CD2 LEU A 105 -1.487 -1.401 6.342 1.00 0.00 C ATOM 0 H LEU A 105 -4.776 -0.290 2.859 1.00 0.00 H new ATOM 0 HA LEU A 105 -3.631 0.039 5.595 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.920 -2.211 4.022 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -2.358 -1.634 3.478 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.178 -2.634 6.182 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.079 -4.001 5.823 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.224 -4.195 4.475 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.806 -3.136 4.292 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.052 -1.969 7.164 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.690 -1.003 5.714 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -2.078 -0.578 6.743 1.00 0.00 H new ATOM 1847 N TYR A 106 -1.803 1.597 4.846 1.00 0.00 N ATOM 1848 CA TYR A 106 -0.805 2.593 4.455 1.00 0.00 C ATOM 1849 C TYR A 106 0.633 2.089 4.631 1.00 0.00 C ATOM 1850 O TYR A 106 0.982 1.538 5.677 1.00 0.00 O ATOM 1851 CB TYR A 106 -1.032 3.851 5.325 1.00 0.00 C ATOM 1852 CG TYR A 106 -0.024 4.979 5.144 1.00 0.00 C ATOM 1853 CD1 TYR A 106 0.168 5.544 3.875 1.00 0.00 C ATOM 1854 CD2 TYR A 106 0.702 5.494 6.235 1.00 0.00 C ATOM 1855 CE1 TYR A 106 1.102 6.575 3.677 1.00 0.00 C ATOM 1856 CE2 TYR A 106 1.665 6.506 6.046 1.00 0.00 C ATOM 1857 CZ TYR A 106 1.875 7.049 4.757 1.00 0.00 C ATOM 1858 OH TYR A 106 2.813 8.019 4.548 1.00 0.00 O ATOM 0 H TYR A 106 -1.936 1.537 5.856 1.00 0.00 H new ATOM 0 HA TYR A 106 -0.927 2.813 3.394 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -2.027 4.242 5.111 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -1.026 3.550 6.373 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -0.410 5.182 3.038 1.00 0.00 H new ATOM 0 HD2 TYR A 106 0.519 5.109 7.228 1.00 0.00 H new ATOM 0 HE1 TYR A 106 1.228 7.006 2.695 1.00 0.00 H new ATOM 0 HE2 TYR A 106 2.242 6.866 6.885 1.00 0.00 H new ATOM 0 HH TYR A 106 2.608 8.500 3.719 1.00 0.00 H new ATOM 1868 N VAL A 107 1.511 2.284 3.640 1.00 0.00 N ATOM 1869 CA VAL A 107 2.925 1.900 3.720 1.00 0.00 C ATOM 1870 C VAL A 107 3.749 3.058 3.153 1.00 0.00 C ATOM 1871 O VAL A 107 3.394 3.644 2.119 1.00 0.00 O ATOM 1872 CB VAL A 107 3.238 0.514 3.103 1.00 0.00 C ATOM 1873 CG1 VAL A 107 3.428 0.470 1.584 1.00 0.00 C ATOM 1874 CG2 VAL A 107 4.501 -0.075 3.750 1.00 0.00 C ATOM 0 H VAL A 107 1.257 2.717 2.752 1.00 0.00 H new ATOM 0 HA VAL A 107 3.207 1.744 4.761 1.00 0.00 H new ATOM 0 HB VAL A 107 2.340 -0.068 3.311 1.00 0.00 H new ATOM 0 HG11 VAL A 107 3.642 -0.553 1.274 1.00 0.00 H new ATOM 0 HG12 VAL A 107 2.518 0.816 1.093 1.00 0.00 H new ATOM 0 HG13 VAL A 107 4.260 1.116 1.302 1.00 0.00 H new ATOM 0 HG21 VAL A 107 4.714 -1.050 3.311 1.00 0.00 H new ATOM 0 HG22 VAL A 107 5.344 0.594 3.577 1.00 0.00 H new ATOM 0 HG23 VAL A 107 4.342 -0.187 4.822 1.00 0.00 H new ATOM 1884 N ALA A 108 4.819 3.414 3.859 1.00 0.00 N ATOM 1885 CA ALA A 108 5.748 4.473 3.507 1.00 0.00 C ATOM 1886 C ALA A 108 7.110 3.826 3.277 1.00 0.00 C ATOM 1887 O ALA A 108 7.453 2.882 3.994 1.00 0.00 O ATOM 1888 CB ALA A 108 5.812 5.494 4.644 1.00 0.00 C ATOM 0 H ALA A 108 5.069 2.948 4.731 1.00 0.00 H new ATOM 0 HA ALA A 108 5.430 4.997 2.606 1.00 0.00 H new ATOM 0 HB1 ALA A 108 6.509 6.289 4.380 1.00 0.00 H new ATOM 0 HB2 ALA A 108 4.822 5.919 4.807 1.00 0.00 H new ATOM 0 HB3 ALA A 108 6.151 5.002 5.556 1.00 0.00 H new ATOM 1894 N TYR A 109 7.874 4.301 2.292 1.00 0.00 N ATOM 1895 CA TYR A 109 9.196 3.754 1.997 1.00 0.00 C ATOM 1896 C TYR A 109 10.186 4.891 1.683 1.00 0.00 C ATOM 1897 O TYR A 109 9.835 5.794 0.913 1.00 0.00 O ATOM 1898 CB TYR A 109 9.049 2.648 0.925 1.00 0.00 C ATOM 1899 CG TYR A 109 8.754 3.065 -0.510 1.00 0.00 C ATOM 1900 CD1 TYR A 109 7.484 3.562 -0.850 1.00 0.00 C ATOM 1901 CD2 TYR A 109 9.718 2.897 -1.525 1.00 0.00 C ATOM 1902 CE1 TYR A 109 7.201 3.977 -2.163 1.00 0.00 C ATOM 1903 CE2 TYR A 109 9.428 3.267 -2.852 1.00 0.00 C ATOM 1904 CZ TYR A 109 8.173 3.827 -3.175 1.00 0.00 C ATOM 1905 OH TYR A 109 7.896 4.196 -4.455 1.00 0.00 O ATOM 0 H TYR A 109 7.595 5.069 1.682 1.00 0.00 H new ATOM 0 HA TYR A 109 9.640 3.259 2.861 1.00 0.00 H new ATOM 0 HB2 TYR A 109 9.971 2.067 0.919 1.00 0.00 H new ATOM 0 HB3 TYR A 109 8.252 1.978 1.247 1.00 0.00 H new ATOM 0 HD1 TYR A 109 6.716 3.626 -0.093 1.00 0.00 H new ATOM 0 HD2 TYR A 109 10.685 2.482 -1.283 1.00 0.00 H new ATOM 0 HE1 TYR A 109 6.240 4.411 -2.397 1.00 0.00 H new ATOM 0 HE2 TYR A 109 10.168 3.122 -3.625 1.00 0.00 H new ATOM 0 HH TYR A 109 8.677 4.025 -5.021 1.00 0.00 H new ATOM 1915 N SER A 110 11.391 4.857 2.273 1.00 0.00 N ATOM 1916 CA SER A 110 12.468 5.851 2.101 1.00 0.00 C ATOM 1917 C SER A 110 13.828 5.158 1.867 1.00 0.00 C ATOM 1918 O SER A 110 13.988 3.971 2.170 1.00 0.00 O ATOM 1919 CB SER A 110 12.532 6.837 3.291 1.00 0.00 C ATOM 1920 OG SER A 110 11.545 6.564 4.275 1.00 0.00 O ATOM 0 H SER A 110 11.655 4.106 2.910 1.00 0.00 H new ATOM 0 HA SER A 110 12.235 6.438 1.212 1.00 0.00 H new ATOM 0 HB2 SER A 110 13.520 6.787 3.748 1.00 0.00 H new ATOM 0 HB3 SER A 110 12.402 7.855 2.923 1.00 0.00 H new ATOM 0 HG SER A 110 11.625 7.211 5.007 1.00 0.00 H new ATOM 1926 N ASP A 111 14.809 5.881 1.319 1.00 0.00 N ATOM 1927 CA ASP A 111 16.163 5.388 1.018 1.00 0.00 C ATOM 1928 C ASP A 111 16.941 5.219 2.327 1.00 0.00 C ATOM 1929 O ASP A 111 17.256 4.098 2.727 1.00 0.00 O ATOM 1930 CB ASP A 111 16.829 6.377 0.048 1.00 0.00 C ATOM 1931 CG ASP A 111 18.133 5.871 -0.573 1.00 0.00 C ATOM 1932 OD1 ASP A 111 19.187 5.856 0.098 1.00 0.00 O ATOM 1933 OD2 ASP A 111 18.129 5.612 -1.798 1.00 0.00 O ATOM 0 H ASP A 111 14.681 6.860 1.063 1.00 0.00 H new ATOM 0 HA ASP A 111 16.139 4.411 0.536 1.00 0.00 H new ATOM 0 HB2 ASP A 111 16.127 6.611 -0.752 1.00 0.00 H new ATOM 0 HB3 ASP A 111 17.030 7.308 0.578 1.00 0.00 H new ATOM 1938 N GLU A 112 17.194 6.320 3.037 1.00 0.00 N ATOM 1939 CA GLU A 112 17.904 6.336 4.314 1.00 0.00 C ATOM 1940 C GLU A 112 16.857 6.568 5.401 1.00 0.00 C ATOM 1941 O GLU A 112 15.824 7.195 5.138 1.00 0.00 O ATOM 1942 CB GLU A 112 19.004 7.413 4.292 1.00 0.00 C ATOM 1943 CG GLU A 112 19.850 7.417 5.574 1.00 0.00 C ATOM 1944 CD GLU A 112 21.033 8.382 5.490 1.00 0.00 C ATOM 1945 OE1 GLU A 112 22.036 8.055 4.808 1.00 0.00 O ATOM 1946 OE2 GLU A 112 21.009 9.448 6.146 1.00 0.00 O ATOM 0 H GLU A 112 16.903 7.248 2.731 1.00 0.00 H new ATOM 0 HA GLU A 112 18.416 5.394 4.512 1.00 0.00 H new ATOM 0 HB2 GLU A 112 19.654 7.247 3.433 1.00 0.00 H new ATOM 0 HB3 GLU A 112 18.546 8.393 4.160 1.00 0.00 H new ATOM 0 HG2 GLU A 112 19.220 7.691 6.420 1.00 0.00 H new ATOM 0 HG3 GLU A 112 20.220 6.410 5.765 1.00 0.00 H new ATOM 1953 N SER A 113 17.047 5.996 6.596 1.00 0.00 N ATOM 1954 CA SER A 113 16.077 6.177 7.665 1.00 0.00 C ATOM 1955 C SER A 113 16.272 7.584 8.227 1.00 0.00 C ATOM 1956 O SER A 113 17.111 7.800 9.090 1.00 0.00 O ATOM 1957 CB SER A 113 16.288 5.072 8.723 1.00 0.00 C ATOM 1958 OG SER A 113 15.532 5.269 9.911 1.00 0.00 O ATOM 0 H SER A 113 17.850 5.416 6.838 1.00 0.00 H new ATOM 0 HA SER A 113 15.049 6.087 7.314 1.00 0.00 H new ATOM 0 HB2 SER A 113 16.021 4.109 8.288 1.00 0.00 H new ATOM 0 HB3 SER A 113 17.346 5.024 8.980 1.00 0.00 H new ATOM 0 HG SER A 113 15.709 4.536 10.537 1.00 0.00 H new ATOM 2086 N GLU B 730 -13.746 -2.948 -7.308 1.00 0.00 N ATOM 2087 CA GLU B 730 -13.033 -1.690 -7.506 1.00 0.00 C ATOM 2088 C GLU B 730 -11.795 -1.906 -8.393 1.00 0.00 C ATOM 2089 O GLU B 730 -11.381 -3.049 -8.632 1.00 0.00 O ATOM 2090 CB GLU B 730 -12.662 -1.097 -6.134 1.00 0.00 C ATOM 2091 CG GLU B 730 -13.843 -0.572 -5.303 1.00 0.00 C ATOM 2092 CD GLU B 730 -14.981 -1.573 -5.106 1.00 0.00 C ATOM 2093 OE1 GLU B 730 -14.718 -2.740 -4.757 1.00 0.00 O ATOM 2094 OE2 GLU B 730 -16.142 -1.197 -5.416 1.00 0.00 O ATOM 0 HA GLU B 730 -13.675 -0.978 -8.025 1.00 0.00 H new ATOM 0 HB2 GLU B 730 -12.143 -1.861 -5.555 1.00 0.00 H new ATOM 0 HB3 GLU B 730 -11.957 -0.280 -6.289 1.00 0.00 H new ATOM 0 HG2 GLU B 730 -13.473 -0.266 -4.324 1.00 0.00 H new ATOM 0 HG3 GLU B 730 -14.242 0.320 -5.786 1.00 0.00 H new ATOM 2101 N ASP B 731 -11.163 -0.815 -8.840 1.00 0.00 N ATOM 2102 CA ASP B 731 -9.993 -0.844 -9.718 1.00 0.00 C ATOM 2103 C ASP B 731 -8.751 -0.318 -9.012 1.00 0.00 C ATOM 2104 O ASP B 731 -8.595 0.893 -8.812 1.00 0.00 O ATOM 2105 CB ASP B 731 -10.254 -0.025 -10.991 1.00 0.00 C ATOM 2106 CG ASP B 731 -11.534 -0.438 -11.700 1.00 0.00 C ATOM 2107 OD1 ASP B 731 -11.534 -1.502 -12.369 1.00 0.00 O ATOM 2108 OD2 ASP B 731 -12.535 0.295 -11.568 1.00 0.00 O ATOM 0 H ASP B 731 -11.458 0.130 -8.595 1.00 0.00 H new ATOM 0 HA ASP B 731 -9.815 -1.884 -9.990 1.00 0.00 H new ATOM 0 HB2 ASP B 731 -10.311 1.032 -10.733 1.00 0.00 H new ATOM 0 HB3 ASP B 731 -9.412 -0.142 -11.673 1.00 0.00 H new ATOM 2113 N TYR B 732 -7.859 -1.242 -8.670 1.00 0.00 N ATOM 2114 CA TYR B 732 -6.579 -1.062 -8.002 1.00 0.00 C ATOM 2115 C TYR B 732 -5.590 -2.017 -8.678 1.00 0.00 C ATOM 2116 O TYR B 732 -6.027 -2.939 -9.377 1.00 0.00 O ATOM 2117 CB TYR B 732 -6.769 -1.352 -6.504 1.00 0.00 C ATOM 2118 CG TYR B 732 -7.757 -0.410 -5.830 1.00 0.00 C ATOM 2119 CD1 TYR B 732 -7.568 0.974 -5.971 1.00 0.00 C ATOM 2120 CD2 TYR B 732 -8.900 -0.885 -5.153 1.00 0.00 C ATOM 2121 CE1 TYR B 732 -8.507 1.889 -5.482 1.00 0.00 C ATOM 2122 CE2 TYR B 732 -9.845 0.027 -4.638 1.00 0.00 C ATOM 2123 CZ TYR B 732 -9.656 1.416 -4.823 1.00 0.00 C ATOM 2124 OH TYR B 732 -10.568 2.318 -4.377 1.00 0.00 O ATOM 0 H TYR B 732 -8.032 -2.226 -8.873 1.00 0.00 H new ATOM 0 HA TYR B 732 -6.191 -0.047 -8.082 1.00 0.00 H new ATOM 0 HB2 TYR B 732 -7.114 -2.379 -6.380 1.00 0.00 H new ATOM 0 HB3 TYR B 732 -5.805 -1.277 -6.001 1.00 0.00 H new ATOM 0 HD1 TYR B 732 -6.681 1.340 -6.466 1.00 0.00 H new ATOM 0 HD2 TYR B 732 -9.052 -1.947 -5.029 1.00 0.00 H new ATOM 0 HE1 TYR B 732 -8.351 2.950 -5.610 1.00 0.00 H new ATOM 0 HE2 TYR B 732 -10.711 -0.335 -4.104 1.00 0.00 H new ATOM 0 HH TYR B 732 -11.432 2.149 -4.807 1.00 0.00 H new ATOM 2134 N ILE B 733 -4.285 -1.882 -8.426 1.00 0.00 N ATOM 2135 CA ILE B 733 -3.325 -2.758 -9.092 1.00 0.00 C ATOM 2136 C ILE B 733 -3.221 -4.074 -8.314 1.00 0.00 C ATOM 2137 O ILE B 733 -2.648 -4.114 -7.227 1.00 0.00 O ATOM 2138 CB ILE B 733 -1.948 -2.065 -9.213 1.00 0.00 C ATOM 2139 CG1 ILE B 733 -1.966 -0.653 -9.843 1.00 0.00 C ATOM 2140 CG2 ILE B 733 -0.955 -2.973 -9.964 1.00 0.00 C ATOM 2141 CD1 ILE B 733 -2.584 -0.557 -11.241 1.00 0.00 C ATOM 0 H ILE B 733 -3.881 -1.197 -7.787 1.00 0.00 H new ATOM 0 HA ILE B 733 -3.669 -2.974 -10.104 1.00 0.00 H new ATOM 0 HB ILE B 733 -1.623 -1.908 -8.184 1.00 0.00 H new ATOM 0 HG12 ILE B 733 -2.513 0.015 -9.177 1.00 0.00 H new ATOM 0 HG13 ILE B 733 -0.941 -0.284 -9.893 1.00 0.00 H new ATOM 0 HG21 ILE B 733 0.010 -2.472 -10.041 1.00 0.00 H new ATOM 0 HG22 ILE B 733 -0.835 -3.909 -9.419 1.00 0.00 H new ATOM 0 HG23 ILE B 733 -1.337 -3.181 -10.964 1.00 0.00 H new ATOM 0 HD11 ILE B 733 -2.544 0.476 -11.586 1.00 0.00 H new ATOM 0 HD12 ILE B 733 -2.026 -1.191 -11.930 1.00 0.00 H new ATOM 0 HD13 ILE B 733 -3.622 -0.887 -11.203 1.00 0.00 H new ATOM 2153 N ILE B 734 -3.767 -5.158 -8.871 1.00 0.00 N ATOM 2154 CA ILE B 734 -3.721 -6.479 -8.251 1.00 0.00 C ATOM 2155 C ILE B 734 -2.296 -6.988 -8.480 1.00 0.00 C ATOM 2156 O ILE B 734 -1.840 -6.983 -9.627 1.00 0.00 O ATOM 2157 CB ILE B 734 -4.729 -7.445 -8.930 1.00 0.00 C ATOM 2158 CG1 ILE B 734 -6.173 -6.907 -9.056 1.00 0.00 C ATOM 2159 CG2 ILE B 734 -4.726 -8.820 -8.235 1.00 0.00 C ATOM 2160 CD1 ILE B 734 -6.894 -6.657 -7.733 1.00 0.00 C ATOM 0 H ILE B 734 -4.254 -5.141 -9.767 1.00 0.00 H new ATOM 0 HA ILE B 734 -3.983 -6.427 -7.194 1.00 0.00 H new ATOM 0 HB ILE B 734 -4.370 -7.544 -9.954 1.00 0.00 H new ATOM 0 HG12 ILE B 734 -6.148 -5.974 -9.619 1.00 0.00 H new ATOM 0 HG13 ILE B 734 -6.758 -7.617 -9.641 1.00 0.00 H new ATOM 0 HG21 ILE B 734 -5.440 -9.479 -8.729 1.00 0.00 H new ATOM 0 HG22 ILE B 734 -3.729 -9.256 -8.295 1.00 0.00 H new ATOM 0 HG23 ILE B 734 -5.007 -8.699 -7.189 1.00 0.00 H new ATOM 0 HD11 ILE B 734 -7.898 -6.281 -7.931 1.00 0.00 H new ATOM 0 HD12 ILE B 734 -6.959 -7.590 -7.172 1.00 0.00 H new ATOM 0 HD13 ILE B 734 -6.340 -5.921 -7.150 1.00 0.00 H new ATOM 2172 N ILE B 735 -1.586 -7.407 -7.432 1.00 0.00 N ATOM 2173 CA ILE B 735 -0.228 -7.923 -7.552 1.00 0.00 C ATOM 2174 C ILE B 735 -0.182 -9.292 -6.889 1.00 0.00 C ATOM 2175 O ILE B 735 0.103 -9.405 -5.695 1.00 0.00 O ATOM 2176 CB ILE B 735 0.856 -6.956 -7.011 1.00 0.00 C ATOM 2177 CG1 ILE B 735 0.750 -5.576 -7.691 1.00 0.00 C ATOM 2178 CG2 ILE B 735 2.252 -7.567 -7.263 1.00 0.00 C ATOM 2179 CD1 ILE B 735 1.903 -4.611 -7.382 1.00 0.00 C ATOM 0 H ILE B 735 -1.940 -7.397 -6.475 1.00 0.00 H new ATOM 0 HA ILE B 735 0.018 -8.018 -8.609 1.00 0.00 H new ATOM 0 HB ILE B 735 0.704 -6.816 -5.941 1.00 0.00 H new ATOM 0 HG12 ILE B 735 0.698 -5.722 -8.770 1.00 0.00 H new ATOM 0 HG13 ILE B 735 -0.187 -5.109 -7.387 1.00 0.00 H new ATOM 0 HG21 ILE B 735 3.019 -6.891 -6.884 1.00 0.00 H new ATOM 0 HG22 ILE B 735 2.328 -8.526 -6.750 1.00 0.00 H new ATOM 0 HG23 ILE B 735 2.396 -7.716 -8.333 1.00 0.00 H new ATOM 0 HD11 ILE B 735 1.739 -3.669 -7.905 1.00 0.00 H new ATOM 0 HD12 ILE B 735 1.946 -4.427 -6.308 1.00 0.00 H new ATOM 0 HD13 ILE B 735 2.844 -5.051 -7.713 1.00 0.00 H new