USER MOD reduce.3.24.130724 H: found=0, std=0, add=788, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 788 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 55 GLN : amide:sc= 0 K(o=-0.78,f=-1.7) USER MOD Set 1.2: A 116 MET CE :methyl -156:sc= -0.775 (180deg=-1.17) USER MOD Set 2.1: A 110 HIS : no HE2:sc= -0.326 X(o=-0.33,f=-0.61) USER MOD Set 2.2: A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 21:sc= 0.137 USER MOD Single : A 45 THR OG1 : rot 104:sc= 1.3 USER MOD Single : A 48 GLN : amide:sc= -1.02 K(o=-1,f=-0.23) USER MOD Single : A 52 TYR OH : rot 120:sc= 0.425 USER MOD Single : A 57 GLN : amide:sc= -1.16 K(o=-1.2,f=-0.54) USER MOD Single : A 62 THR OG1 : rot 75:sc= 1.18 USER MOD Single : A 64 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.138) USER MOD Single : A 67 THR OG1 : rot -84:sc= 1.26 USER MOD Single : A 75 ASN : amide:sc= 0.91 K(o=0.91,f=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 140:sc= 0 USER MOD Single : A 87 TYR OH : rot 169:sc= 0.826 USER MOD Single : A 88 ASN : amide:sc= 0.17 K(o=0.17,f=-2.8!) USER MOD Single : A 89 SER OG : rot 180:sc= 0.00253 USER MOD Single : A 92 LYS NZ :NH3+ 156:sc= 1.23 (180deg=0.727) USER MOD Single : A 95 ASN : amide:sc= 0.552 K(o=0.55,f=-5.2!) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 81:sc= 0.503 USER MOD Single : A 103 LYS NZ :NH3+ -153:sc= 1.31 (180deg=1.04) USER MOD Single : A 104 LYS NZ :NH3+ -160:sc= 1.26 (180deg=0.939) USER MOD Single : A 111 ASN : amide:sc= -0.44 X(o=-0.44,f=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= 0.00887 K(o=0.0089,f=-2.9) USER MOD Single : A 124 LYS NZ :NH3+ 152:sc= 1.22 (180deg=0.662) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 192 N THR A 38 -16.946 -12.286 0.144 1.00 0.00 N ATOM 193 CA THR A 38 -17.398 -10.956 0.348 1.00 0.00 C ATOM 194 C THR A 38 -18.902 -10.938 0.083 1.00 0.00 C ATOM 195 O THR A 38 -19.330 -11.100 -1.061 1.00 0.00 O ATOM 196 CB THR A 38 -16.653 -9.996 -0.613 1.00 0.00 C ATOM 197 OG1 THR A 38 -15.233 -10.141 -0.406 1.00 0.00 O ATOM 198 CG2 THR A 38 -17.047 -8.548 -0.365 1.00 0.00 C ATOM 0 HA THR A 38 -17.197 -10.624 1.366 1.00 0.00 H new ATOM 0 HB THR A 38 -16.923 -10.252 -1.637 1.00 0.00 H new ATOM 0 HG1 THR A 38 -15.051 -11.006 0.017 1.00 0.00 H new ATOM 0 HG21 THR A 38 -16.507 -7.901 -1.056 1.00 0.00 H new ATOM 0 HG22 THR A 38 -18.119 -8.431 -0.521 1.00 0.00 H new ATOM 0 HG23 THR A 38 -16.798 -8.274 0.660 1.00 0.00 H new ATOM 206 N VAL A 39 -19.696 -10.788 1.108 1.00 0.00 N ATOM 207 CA VAL A 39 -21.121 -10.752 0.908 1.00 0.00 C ATOM 208 C VAL A 39 -21.621 -9.326 1.015 1.00 0.00 C ATOM 209 O VAL A 39 -21.629 -8.714 2.088 1.00 0.00 O ATOM 210 CB VAL A 39 -21.908 -11.746 1.830 1.00 0.00 C ATOM 211 CG1 VAL A 39 -21.684 -11.479 3.314 1.00 0.00 C ATOM 212 CG2 VAL A 39 -23.393 -11.739 1.496 1.00 0.00 C ATOM 0 H VAL A 39 -19.389 -10.690 2.076 1.00 0.00 H new ATOM 0 HA VAL A 39 -21.321 -11.109 -0.102 1.00 0.00 H new ATOM 0 HB VAL A 39 -21.509 -12.740 1.627 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -22.254 -12.198 3.903 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -20.624 -11.579 3.546 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -22.014 -10.469 3.556 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -23.916 -12.437 2.150 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -23.794 -10.736 1.641 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -23.534 -12.039 0.458 1.00 0.00 H new ATOM 222 N ILE A 40 -22.021 -8.808 -0.101 1.00 0.00 N ATOM 223 CA ILE A 40 -22.413 -7.440 -0.204 1.00 0.00 C ATOM 224 C ILE A 40 -23.867 -7.294 0.195 1.00 0.00 C ATOM 225 O ILE A 40 -24.741 -7.930 -0.411 1.00 0.00 O ATOM 226 CB ILE A 40 -22.244 -6.946 -1.650 1.00 0.00 C ATOM 227 CG1 ILE A 40 -20.832 -7.255 -2.156 1.00 0.00 C ATOM 228 CG2 ILE A 40 -22.512 -5.451 -1.713 1.00 0.00 C ATOM 229 CD1 ILE A 40 -20.644 -7.000 -3.630 1.00 0.00 C ATOM 0 H ILE A 40 -22.085 -9.328 -0.976 1.00 0.00 H new ATOM 0 HA ILE A 40 -21.783 -6.847 0.459 1.00 0.00 H new ATOM 0 HB ILE A 40 -22.959 -7.464 -2.290 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -20.116 -6.651 -1.598 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -20.601 -8.299 -1.945 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -22.392 -5.103 -2.739 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -23.530 -5.249 -1.378 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -21.807 -4.927 -1.067 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -19.620 -7.242 -3.913 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -21.334 -7.623 -4.198 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -20.842 -5.950 -3.846 1.00 0.00 H new ATOM 241 N PRO A 41 -24.155 -6.488 1.221 1.00 0.00 N ATOM 242 CA PRO A 41 -25.517 -6.248 1.647 1.00 0.00 C ATOM 243 C PRO A 41 -26.303 -5.508 0.557 1.00 0.00 C ATOM 244 O PRO A 41 -25.783 -4.573 -0.076 1.00 0.00 O ATOM 245 CB PRO A 41 -25.386 -5.386 2.912 1.00 0.00 C ATOM 246 CG PRO A 41 -24.010 -4.822 2.879 1.00 0.00 C ATOM 247 CD PRO A 41 -23.172 -5.753 2.045 1.00 0.00 C ATOM 0 HA PRO A 41 -26.059 -7.174 1.839 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -26.133 -4.593 2.923 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -25.542 -5.984 3.810 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -24.014 -3.820 2.451 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -23.604 -4.736 3.887 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -22.464 -5.203 1.424 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -22.589 -6.431 2.669 1.00 0.00 H new ATOM 255 N PRO A 42 -27.529 -5.944 0.281 1.00 0.00 N ATOM 256 CA PRO A 42 -28.371 -5.321 -0.732 1.00 0.00 C ATOM 257 C PRO A 42 -28.785 -3.896 -0.338 1.00 0.00 C ATOM 258 O PRO A 42 -28.930 -3.580 0.856 1.00 0.00 O ATOM 259 CB PRO A 42 -29.592 -6.248 -0.806 1.00 0.00 C ATOM 260 CG PRO A 42 -29.617 -6.964 0.496 1.00 0.00 C ATOM 261 CD PRO A 42 -28.193 -7.090 0.929 1.00 0.00 C ATOM 0 HA PRO A 42 -27.856 -5.212 -1.687 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -30.509 -5.680 -0.960 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -29.506 -6.947 -1.638 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -30.201 -6.412 1.233 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -30.081 -7.945 0.392 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -28.099 -7.046 2.014 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -27.759 -8.038 0.609 1.00 0.00 H new ATOM 269 N GLY A 43 -28.963 -3.049 -1.328 1.00 0.00 N ATOM 270 CA GLY A 43 -29.365 -1.683 -1.087 1.00 0.00 C ATOM 271 C GLY A 43 -28.204 -0.704 -1.091 1.00 0.00 C ATOM 272 O GLY A 43 -28.383 0.485 -0.836 1.00 0.00 O ATOM 0 H GLY A 43 -28.835 -3.285 -2.312 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -30.085 -1.384 -1.848 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -29.875 -1.626 -0.126 1.00 0.00 H new ATOM 276 N LEU A 44 -27.023 -1.191 -1.376 1.00 0.00 N ATOM 277 CA LEU A 44 -25.869 -0.355 -1.489 1.00 0.00 C ATOM 278 C LEU A 44 -25.761 0.107 -2.911 1.00 0.00 C ATOM 279 O LEU A 44 -26.220 -0.586 -3.835 1.00 0.00 O ATOM 280 CB LEU A 44 -24.585 -1.097 -1.106 1.00 0.00 C ATOM 281 CG LEU A 44 -24.403 -1.505 0.350 1.00 0.00 C ATOM 282 CD1 LEU A 44 -23.063 -2.204 0.521 1.00 0.00 C ATOM 283 CD2 LEU A 44 -24.468 -0.292 1.245 1.00 0.00 C ATOM 0 H LEU A 44 -26.841 -2.182 -1.535 1.00 0.00 H new ATOM 0 HA LEU A 44 -25.983 0.486 -0.805 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -24.526 -1.999 -1.715 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -23.740 -0.468 -1.385 1.00 0.00 H new ATOM 0 HG LEU A 44 -25.205 -2.188 0.630 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -22.935 -2.495 1.564 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -23.033 -3.092 -0.110 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -22.260 -1.526 0.232 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -24.336 -0.598 2.283 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -23.678 0.406 0.970 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -25.437 0.193 1.130 1.00 0.00 H new ATOM 295 N THR A 45 -25.187 1.243 -3.108 1.00 0.00 N ATOM 296 CA THR A 45 -25.003 1.752 -4.422 1.00 0.00 C ATOM 297 C THR A 45 -23.686 1.216 -4.928 1.00 0.00 C ATOM 298 O THR A 45 -22.901 0.708 -4.131 1.00 0.00 O ATOM 299 CB THR A 45 -24.985 3.285 -4.385 1.00 0.00 C ATOM 300 OG1 THR A 45 -23.819 3.746 -3.679 1.00 0.00 O ATOM 301 CG2 THR A 45 -26.214 3.775 -3.657 1.00 0.00 C ATOM 0 H THR A 45 -24.833 1.844 -2.364 1.00 0.00 H new ATOM 0 HA THR A 45 -25.814 1.444 -5.081 1.00 0.00 H new ATOM 0 HB THR A 45 -24.969 3.667 -5.406 1.00 0.00 H new ATOM 0 HG1 THR A 45 -23.158 4.078 -4.321 1.00 0.00 H new ATOM 0 HG21 THR A 45 -26.209 4.865 -3.626 1.00 0.00 H new ATOM 0 HG22 THR A 45 -27.107 3.431 -4.179 1.00 0.00 H new ATOM 0 HG23 THR A 45 -26.215 3.384 -2.640 1.00 0.00 H new ATOM 309 N ARG A 46 -23.432 1.312 -6.216 1.00 0.00 N ATOM 310 CA ARG A 46 -22.181 0.810 -6.778 1.00 0.00 C ATOM 311 C ARG A 46 -20.960 1.443 -6.115 1.00 0.00 C ATOM 312 O ARG A 46 -19.960 0.768 -5.876 1.00 0.00 O ATOM 313 CB ARG A 46 -22.095 0.954 -8.317 1.00 0.00 C ATOM 314 CG ARG A 46 -22.240 2.362 -8.886 1.00 0.00 C ATOM 315 CD ARG A 46 -23.692 2.772 -9.017 1.00 0.00 C ATOM 316 NE ARG A 46 -23.842 4.130 -9.511 1.00 0.00 N ATOM 317 CZ ARG A 46 -24.724 4.513 -10.435 1.00 0.00 C ATOM 318 NH1 ARG A 46 -25.456 3.598 -11.098 1.00 0.00 N ATOM 319 NH2 ARG A 46 -24.846 5.796 -10.731 1.00 0.00 N ATOM 0 H ARG A 46 -24.067 1.730 -6.896 1.00 0.00 H new ATOM 0 HA ARG A 46 -22.179 -0.258 -6.558 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -21.135 0.553 -8.642 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -22.869 0.327 -8.760 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -21.720 3.070 -8.240 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -21.760 2.410 -9.863 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -24.201 2.084 -9.692 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -24.180 2.685 -8.046 1.00 0.00 H new ATOM 0 HE ARG A 46 -23.226 4.844 -9.122 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -25.338 2.606 -10.895 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -26.129 3.897 -11.804 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -24.267 6.487 -10.253 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -25.519 6.095 -11.437 1.00 0.00 H new ATOM 333 N GLU A 47 -21.079 2.708 -5.746 1.00 0.00 N ATOM 334 CA GLU A 47 -19.983 3.419 -5.124 1.00 0.00 C ATOM 335 C GLU A 47 -19.774 2.878 -3.721 1.00 0.00 C ATOM 336 O GLU A 47 -18.645 2.623 -3.294 1.00 0.00 O ATOM 337 CB GLU A 47 -20.246 4.943 -5.038 1.00 0.00 C ATOM 338 CG GLU A 47 -20.652 5.631 -6.346 1.00 0.00 C ATOM 339 CD GLU A 47 -22.094 5.372 -6.738 1.00 0.00 C ATOM 340 OE1 GLU A 47 -22.853 4.781 -5.933 1.00 0.00 O ATOM 341 OE2 GLU A 47 -22.494 5.733 -7.854 1.00 0.00 O ATOM 0 H GLU A 47 -21.927 3.261 -5.868 1.00 0.00 H new ATOM 0 HA GLU A 47 -19.097 3.266 -5.741 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -21.031 5.115 -4.302 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -19.344 5.426 -4.661 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -20.497 6.705 -6.246 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -19.998 5.288 -7.147 1.00 0.00 H new ATOM 348 N GLN A 48 -20.879 2.646 -3.026 1.00 0.00 N ATOM 349 CA GLN A 48 -20.830 2.186 -1.662 1.00 0.00 C ATOM 350 C GLN A 48 -20.383 0.729 -1.596 1.00 0.00 C ATOM 351 O GLN A 48 -19.633 0.347 -0.693 1.00 0.00 O ATOM 352 CB GLN A 48 -22.178 2.341 -0.974 1.00 0.00 C ATOM 353 CG GLN A 48 -22.080 2.209 0.526 1.00 0.00 C ATOM 354 CD GLN A 48 -21.227 3.299 1.171 1.00 0.00 C ATOM 355 OE1 GLN A 48 -20.585 3.073 2.190 1.00 0.00 O ATOM 356 NE2 GLN A 48 -21.239 4.488 0.615 1.00 0.00 N ATOM 0 H GLN A 48 -21.821 2.772 -3.395 1.00 0.00 H new ATOM 0 HA GLN A 48 -20.102 2.806 -1.138 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -22.599 3.315 -1.223 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -22.867 1.588 -1.357 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -23.082 2.240 0.953 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -21.659 1.234 0.772 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -21.782 4.649 -0.233 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -20.705 5.251 1.031 1.00 0.00 H new ATOM 365 N GLU A 49 -20.845 -0.077 -2.549 1.00 0.00 N ATOM 366 CA GLU A 49 -20.446 -1.472 -2.619 1.00 0.00 C ATOM 367 C GLU A 49 -18.971 -1.559 -2.780 1.00 0.00 C ATOM 368 O GLU A 49 -18.301 -2.230 -2.004 1.00 0.00 O ATOM 369 CB GLU A 49 -21.127 -2.219 -3.764 1.00 0.00 C ATOM 370 CG GLU A 49 -22.599 -2.422 -3.564 1.00 0.00 C ATOM 371 CD GLU A 49 -23.289 -3.146 -4.696 1.00 0.00 C ATOM 372 OE1 GLU A 49 -23.125 -2.751 -5.868 1.00 0.00 O ATOM 373 OE2 GLU A 49 -24.058 -4.089 -4.435 1.00 0.00 O ATOM 0 H GLU A 49 -21.494 0.215 -3.280 1.00 0.00 H new ATOM 0 HA GLU A 49 -20.758 -1.946 -1.689 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -20.969 -1.667 -4.690 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -20.649 -3.191 -3.886 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -22.754 -2.983 -2.642 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -23.072 -1.450 -3.429 1.00 0.00 H new ATOM 380 N ARG A 50 -18.454 -0.824 -3.748 1.00 0.00 N ATOM 381 CA ARG A 50 -17.037 -0.813 -3.998 1.00 0.00 C ATOM 382 C ARG A 50 -16.283 -0.306 -2.810 1.00 0.00 C ATOM 383 O ARG A 50 -15.281 -0.860 -2.464 1.00 0.00 O ATOM 384 CB ARG A 50 -16.656 -0.027 -5.245 1.00 0.00 C ATOM 385 CG ARG A 50 -17.106 -0.643 -6.552 1.00 0.00 C ATOM 386 CD ARG A 50 -16.710 -2.109 -6.639 1.00 0.00 C ATOM 387 NE ARG A 50 -16.980 -2.695 -7.973 1.00 0.00 N ATOM 388 CZ ARG A 50 -16.387 -3.798 -8.482 1.00 0.00 C ATOM 389 NH1 ARG A 50 -15.449 -4.444 -7.796 1.00 0.00 N ATOM 390 NH2 ARG A 50 -16.715 -4.235 -9.696 1.00 0.00 N ATOM 0 H ARG A 50 -19.001 -0.229 -4.371 1.00 0.00 H new ATOM 0 HA ARG A 50 -16.755 -1.850 -4.180 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -17.079 0.975 -5.168 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -15.572 0.086 -5.268 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -18.188 -0.550 -6.646 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -16.665 -0.095 -7.385 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -15.649 -2.209 -6.411 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -17.254 -2.674 -5.882 1.00 0.00 H new ATOM 0 HE ARG A 50 -17.672 -2.226 -8.557 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -15.169 -4.108 -6.874 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -15.009 -5.275 -8.191 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -17.416 -3.737 -10.245 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -16.266 -5.068 -10.077 1.00 0.00 H new ATOM 404 N ALA A 51 -16.813 0.703 -2.157 1.00 0.00 N ATOM 405 CA ALA A 51 -16.188 1.268 -0.966 1.00 0.00 C ATOM 406 C ALA A 51 -16.022 0.195 0.116 1.00 0.00 C ATOM 407 O ALA A 51 -14.966 0.069 0.705 1.00 0.00 O ATOM 408 CB ALA A 51 -17.023 2.423 -0.435 1.00 0.00 C ATOM 0 H ALA A 51 -17.684 1.158 -2.428 1.00 0.00 H new ATOM 0 HA ALA A 51 -15.200 1.641 -1.237 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -16.547 2.837 0.454 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -17.101 3.197 -1.199 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -18.020 2.064 -0.179 1.00 0.00 H new ATOM 414 N TYR A 52 -17.046 -0.611 0.308 1.00 0.00 N ATOM 415 CA TYR A 52 -17.015 -1.692 1.269 1.00 0.00 C ATOM 416 C TYR A 52 -16.012 -2.784 0.840 1.00 0.00 C ATOM 417 O TYR A 52 -15.202 -3.257 1.641 1.00 0.00 O ATOM 418 CB TYR A 52 -18.452 -2.236 1.450 1.00 0.00 C ATOM 419 CG TYR A 52 -18.554 -3.692 1.820 1.00 0.00 C ATOM 420 CD1 TYR A 52 -18.332 -4.142 3.114 1.00 0.00 C ATOM 421 CD2 TYR A 52 -18.871 -4.616 0.847 1.00 0.00 C ATOM 422 CE1 TYR A 52 -18.425 -5.489 3.416 1.00 0.00 C ATOM 423 CE2 TYR A 52 -18.969 -5.954 1.133 1.00 0.00 C ATOM 424 CZ TYR A 52 -18.745 -6.392 2.415 1.00 0.00 C ATOM 425 OH TYR A 52 -18.832 -7.734 2.700 1.00 0.00 O ATOM 0 H TYR A 52 -17.927 -0.534 -0.201 1.00 0.00 H new ATOM 0 HA TYR A 52 -16.664 -1.327 2.234 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -18.950 -1.648 2.221 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -19.002 -2.076 0.522 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -18.085 -3.435 3.892 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -19.046 -4.278 -0.164 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -18.250 -5.834 4.424 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -19.221 -6.659 0.354 1.00 0.00 H new ATOM 0 HH TYR A 52 -19.738 -8.052 2.503 1.00 0.00 H new ATOM 435 N ILE A 53 -16.061 -3.138 -0.428 1.00 0.00 N ATOM 436 CA ILE A 53 -15.189 -4.158 -1.006 1.00 0.00 C ATOM 437 C ILE A 53 -13.714 -3.701 -0.941 1.00 0.00 C ATOM 438 O ILE A 53 -12.818 -4.467 -0.538 1.00 0.00 O ATOM 439 CB ILE A 53 -15.625 -4.451 -2.475 1.00 0.00 C ATOM 440 CG1 ILE A 53 -17.088 -4.935 -2.482 1.00 0.00 C ATOM 441 CG2 ILE A 53 -14.720 -5.492 -3.124 1.00 0.00 C ATOM 442 CD1 ILE A 53 -17.755 -4.947 -3.843 1.00 0.00 C ATOM 0 H ILE A 53 -16.711 -2.726 -1.098 1.00 0.00 H new ATOM 0 HA ILE A 53 -15.278 -5.079 -0.430 1.00 0.00 H new ATOM 0 HB ILE A 53 -15.538 -3.532 -3.055 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -17.123 -5.943 -2.069 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -17.669 -4.297 -1.816 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -15.050 -5.674 -4.147 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -13.693 -5.126 -3.134 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -14.769 -6.421 -2.556 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -18.780 -5.302 -3.742 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -17.759 -3.938 -4.255 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -17.205 -5.609 -4.512 1.00 0.00 H new ATOM 454 N VAL A 54 -13.490 -2.448 -1.293 1.00 0.00 N ATOM 455 CA VAL A 54 -12.176 -1.837 -1.261 1.00 0.00 C ATOM 456 C VAL A 54 -11.665 -1.733 0.179 1.00 0.00 C ATOM 457 O VAL A 54 -10.496 -1.991 0.437 1.00 0.00 O ATOM 458 CB VAL A 54 -12.173 -0.434 -1.972 1.00 0.00 C ATOM 459 CG1 VAL A 54 -10.858 0.298 -1.770 1.00 0.00 C ATOM 460 CG2 VAL A 54 -12.438 -0.591 -3.472 1.00 0.00 C ATOM 0 H VAL A 54 -14.226 -1.819 -1.613 1.00 0.00 H new ATOM 0 HA VAL A 54 -11.494 -2.480 -1.818 1.00 0.00 H new ATOM 0 HB VAL A 54 -12.969 0.156 -1.518 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -10.897 1.262 -2.277 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -10.688 0.454 -0.705 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -10.043 -0.297 -2.184 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -12.432 0.390 -3.947 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -11.661 -1.214 -3.916 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -13.410 -1.061 -3.623 1.00 0.00 H new ATOM 470 N GLN A 55 -12.564 -1.411 1.118 1.00 0.00 N ATOM 471 CA GLN A 55 -12.215 -1.298 2.544 1.00 0.00 C ATOM 472 C GLN A 55 -11.603 -2.594 3.047 1.00 0.00 C ATOM 473 O GLN A 55 -10.575 -2.580 3.727 1.00 0.00 O ATOM 474 CB GLN A 55 -13.447 -0.951 3.384 1.00 0.00 C ATOM 475 CG GLN A 55 -13.146 -0.698 4.859 1.00 0.00 C ATOM 476 CD GLN A 55 -14.377 -0.335 5.671 1.00 0.00 C ATOM 477 OE1 GLN A 55 -15.334 0.243 5.164 1.00 0.00 O ATOM 478 NE2 GLN A 55 -14.361 -0.655 6.939 1.00 0.00 N ATOM 0 H GLN A 55 -13.546 -1.223 0.916 1.00 0.00 H new ATOM 0 HA GLN A 55 -11.485 -0.495 2.645 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -13.921 -0.064 2.964 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -14.167 -1.765 3.306 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -12.687 -1.589 5.287 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -12.415 0.107 4.940 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -13.552 -1.135 7.334 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -15.157 -0.424 7.533 1.00 0.00 H new ATOM 487 N LEU A 56 -12.213 -3.710 2.662 1.00 0.00 N ATOM 488 CA LEU A 56 -11.739 -5.042 3.041 1.00 0.00 C ATOM 489 C LEU A 56 -10.321 -5.267 2.525 1.00 0.00 C ATOM 490 O LEU A 56 -9.490 -5.896 3.177 1.00 0.00 O ATOM 491 CB LEU A 56 -12.661 -6.121 2.475 1.00 0.00 C ATOM 492 CG LEU A 56 -14.132 -6.042 2.875 1.00 0.00 C ATOM 493 CD1 LEU A 56 -14.905 -7.166 2.239 1.00 0.00 C ATOM 494 CD2 LEU A 56 -14.293 -6.079 4.381 1.00 0.00 C ATOM 0 H LEU A 56 -13.050 -3.720 2.079 1.00 0.00 H new ATOM 0 HA LEU A 56 -11.741 -5.105 4.129 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -12.601 -6.084 1.387 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -12.276 -7.093 2.782 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.529 -5.092 2.518 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -15.953 -7.099 2.532 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.826 -7.094 1.154 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -14.497 -8.121 2.569 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -15.351 -6.021 4.635 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -13.877 -7.009 4.769 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.767 -5.234 4.824 1.00 0.00 H new ATOM 506 N GLN A 57 -10.074 -4.794 1.339 1.00 0.00 N ATOM 507 CA GLN A 57 -8.758 -4.875 0.738 1.00 0.00 C ATOM 508 C GLN A 57 -7.763 -3.936 1.461 1.00 0.00 C ATOM 509 O GLN A 57 -6.606 -4.284 1.657 1.00 0.00 O ATOM 510 CB GLN A 57 -8.833 -4.548 -0.739 1.00 0.00 C ATOM 511 CG GLN A 57 -9.878 -5.351 -1.483 1.00 0.00 C ATOM 512 CD GLN A 57 -9.952 -4.993 -2.942 1.00 0.00 C ATOM 513 OE1 GLN A 57 -8.953 -4.647 -3.567 1.00 0.00 O ATOM 514 NE2 GLN A 57 -11.129 -5.041 -3.490 1.00 0.00 N ATOM 0 H GLN A 57 -10.774 -4.339 0.753 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.392 -5.896 0.846 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -9.050 -3.486 -0.857 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.858 -4.727 -1.193 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -9.653 -6.413 -1.384 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -10.852 -5.187 -1.023 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -11.936 -5.333 -2.939 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -11.246 -4.786 -4.471 1.00 0.00 H new ATOM 523 N ILE A 58 -8.239 -2.741 1.845 1.00 0.00 N ATOM 524 CA ILE A 58 -7.425 -1.742 2.574 1.00 0.00 C ATOM 525 C ILE A 58 -6.967 -2.304 3.909 1.00 0.00 C ATOM 526 O ILE A 58 -5.783 -2.200 4.268 1.00 0.00 O ATOM 527 CB ILE A 58 -8.224 -0.420 2.849 1.00 0.00 C ATOM 528 CG1 ILE A 58 -8.569 0.310 1.549 1.00 0.00 C ATOM 529 CG2 ILE A 58 -7.454 0.506 3.795 1.00 0.00 C ATOM 530 CD1 ILE A 58 -9.468 1.515 1.733 1.00 0.00 C ATOM 0 H ILE A 58 -9.195 -2.436 1.662 1.00 0.00 H new ATOM 0 HA ILE A 58 -6.569 -1.514 1.939 1.00 0.00 H new ATOM 0 HB ILE A 58 -9.159 -0.704 3.333 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -7.644 0.631 1.069 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -9.054 -0.391 0.870 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -8.033 1.414 3.967 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -7.286 -0.002 4.745 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -6.495 0.767 3.348 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -9.664 1.974 0.764 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -10.410 1.201 2.183 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -8.978 2.238 2.385 1.00 0.00 H new ATOM 542 N GLU A 59 -7.889 -2.900 4.629 1.00 0.00 N ATOM 543 CA GLU A 59 -7.590 -3.468 5.917 1.00 0.00 C ATOM 544 C GLU A 59 -6.650 -4.653 5.767 1.00 0.00 C ATOM 545 O GLU A 59 -5.731 -4.814 6.555 1.00 0.00 O ATOM 546 CB GLU A 59 -8.871 -3.819 6.698 1.00 0.00 C ATOM 547 CG GLU A 59 -9.836 -4.705 5.962 1.00 0.00 C ATOM 548 CD GLU A 59 -11.021 -5.094 6.789 1.00 0.00 C ATOM 549 OE1 GLU A 59 -12.027 -4.371 6.794 1.00 0.00 O ATOM 550 OE2 GLU A 59 -10.967 -6.144 7.453 1.00 0.00 O ATOM 0 H GLU A 59 -8.861 -3.003 4.338 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.074 -2.716 6.514 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.589 -4.309 7.630 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.381 -2.894 6.966 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -10.180 -4.192 5.064 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.317 -5.606 5.635 1.00 0.00 H new ATOM 557 N ASP A 60 -6.851 -5.434 4.702 1.00 0.00 N ATOM 558 CA ASP A 60 -5.989 -6.583 4.375 1.00 0.00 C ATOM 559 C ASP A 60 -4.574 -6.073 4.165 1.00 0.00 C ATOM 560 O ASP A 60 -3.606 -6.597 4.730 1.00 0.00 O ATOM 561 CB ASP A 60 -6.421 -7.184 3.045 1.00 0.00 C ATOM 562 CG ASP A 60 -5.975 -8.620 2.831 1.00 0.00 C ATOM 563 OD1 ASP A 60 -4.783 -8.860 2.500 1.00 0.00 O ATOM 564 OD2 ASP A 60 -6.815 -9.527 2.981 1.00 0.00 O ATOM 0 H ASP A 60 -7.614 -5.291 4.040 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.053 -7.316 5.179 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -7.508 -7.140 2.976 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -6.025 -6.569 2.237 1.00 0.00 H new ATOM 569 N LEU A 61 -4.482 -4.992 3.382 1.00 0.00 N ATOM 570 CA LEU A 61 -3.215 -4.382 3.040 1.00 0.00 C ATOM 571 C LEU A 61 -2.517 -3.820 4.235 1.00 0.00 C ATOM 572 O LEU A 61 -1.369 -4.157 4.477 1.00 0.00 O ATOM 573 CB LEU A 61 -3.381 -3.278 1.987 1.00 0.00 C ATOM 574 CG LEU A 61 -3.578 -3.729 0.542 1.00 0.00 C ATOM 575 CD1 LEU A 61 -3.999 -2.562 -0.295 1.00 0.00 C ATOM 576 CD2 LEU A 61 -2.281 -4.288 -0.015 1.00 0.00 C ATOM 0 H LEU A 61 -5.291 -4.524 2.973 1.00 0.00 H new ATOM 0 HA LEU A 61 -2.602 -5.182 2.624 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.236 -2.664 2.271 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.501 -2.637 2.026 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.346 -4.502 0.520 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.139 -2.886 -1.326 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -4.936 -2.158 0.089 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.229 -1.791 -0.258 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -2.435 -4.606 -1.046 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.510 -3.518 0.016 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.965 -5.142 0.585 1.00 0.00 H new ATOM 588 N THR A 62 -3.214 -3.024 5.022 1.00 0.00 N ATOM 589 CA THR A 62 -2.626 -2.349 6.113 1.00 0.00 C ATOM 590 C THR A 62 -2.177 -3.370 7.147 1.00 0.00 C ATOM 591 O THR A 62 -1.080 -3.292 7.656 1.00 0.00 O ATOM 592 CB THR A 62 -3.615 -1.310 6.692 1.00 0.00 C ATOM 593 OG1 THR A 62 -4.118 -0.493 5.609 1.00 0.00 O ATOM 594 CG2 THR A 62 -2.933 -0.405 7.694 1.00 0.00 C ATOM 0 H THR A 62 -4.210 -2.840 4.904 1.00 0.00 H new ATOM 0 HA THR A 62 -1.745 -1.796 5.788 1.00 0.00 H new ATOM 0 HB THR A 62 -4.422 -1.844 7.193 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.769 -1.007 5.087 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.653 0.315 8.084 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.538 -1.003 8.515 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.116 0.127 7.207 1.00 0.00 H new ATOM 602 N ARG A 63 -2.991 -4.392 7.340 1.00 0.00 N ATOM 603 CA ARG A 63 -2.684 -5.502 8.235 1.00 0.00 C ATOM 604 C ARG A 63 -1.362 -6.156 7.816 1.00 0.00 C ATOM 605 O ARG A 63 -0.505 -6.453 8.650 1.00 0.00 O ATOM 606 CB ARG A 63 -3.812 -6.523 8.117 1.00 0.00 C ATOM 607 CG ARG A 63 -3.584 -7.834 8.809 1.00 0.00 C ATOM 608 CD ARG A 63 -4.596 -8.860 8.328 1.00 0.00 C ATOM 609 NE ARG A 63 -4.323 -10.177 8.899 1.00 0.00 N ATOM 610 CZ ARG A 63 -3.555 -11.115 8.326 1.00 0.00 C ATOM 611 NH1 ARG A 63 -3.069 -10.930 7.105 1.00 0.00 N ATOM 612 NH2 ARG A 63 -3.321 -12.254 8.964 1.00 0.00 N ATOM 0 H ARG A 63 -3.895 -4.479 6.876 1.00 0.00 H new ATOM 0 HA ARG A 63 -2.591 -5.146 9.261 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -4.723 -6.077 8.516 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -3.990 -6.718 7.060 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.573 -8.188 8.610 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -3.670 -7.705 9.888 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.601 -8.541 8.605 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.569 -8.919 7.240 1.00 0.00 H new ATOM 0 HE ARG A 63 -4.748 -10.399 9.799 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.279 -10.071 6.597 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.485 -11.647 6.674 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.725 -12.414 9.887 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -2.737 -12.970 8.532 1.00 0.00 H new ATOM 626 N LYS A 64 -1.202 -6.320 6.530 1.00 0.00 N ATOM 627 CA LYS A 64 -0.054 -6.925 5.925 1.00 0.00 C ATOM 628 C LYS A 64 1.213 -6.098 6.154 1.00 0.00 C ATOM 629 O LYS A 64 2.216 -6.623 6.631 1.00 0.00 O ATOM 630 CB LYS A 64 -0.388 -7.034 4.453 1.00 0.00 C ATOM 631 CG LYS A 64 0.740 -7.098 3.494 1.00 0.00 C ATOM 632 CD LYS A 64 0.210 -6.972 2.076 1.00 0.00 C ATOM 633 CE LYS A 64 -0.859 -8.018 1.817 1.00 0.00 C ATOM 634 NZ LYS A 64 -1.332 -8.045 0.426 1.00 0.00 N ATOM 0 H LYS A 64 -1.901 -6.021 5.849 1.00 0.00 H new ATOM 0 HA LYS A 64 0.159 -7.900 6.363 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.999 -7.926 4.313 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.008 -6.178 4.185 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.451 -6.298 3.700 1.00 0.00 H new ATOM 0 HG3 LYS A 64 1.277 -8.040 3.610 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.203 -5.975 1.922 1.00 0.00 H new ATOM 0 HD3 LYS A 64 1.026 -7.092 1.364 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -0.465 -9.000 2.077 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -1.706 -7.830 2.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.785 -8.961 0.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -2.021 -7.280 0.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -0.526 -7.913 -0.217 1.00 0.00 H new ATOM 648 N LEU A 65 1.142 -4.807 5.888 1.00 0.00 N ATOM 649 CA LEU A 65 2.298 -3.934 6.068 1.00 0.00 C ATOM 650 C LEU A 65 2.618 -3.677 7.529 1.00 0.00 C ATOM 651 O LEU A 65 3.744 -3.300 7.874 1.00 0.00 O ATOM 652 CB LEU A 65 2.184 -2.637 5.253 1.00 0.00 C ATOM 653 CG LEU A 65 0.868 -1.890 5.336 1.00 0.00 C ATOM 654 CD1 LEU A 65 1.058 -0.534 5.923 1.00 0.00 C ATOM 655 CD2 LEU A 65 0.262 -1.772 3.965 1.00 0.00 C ATOM 0 H LEU A 65 0.303 -4.337 5.548 1.00 0.00 H new ATOM 0 HA LEU A 65 3.153 -4.476 5.665 1.00 0.00 H new ATOM 0 HB2 LEU A 65 2.978 -1.963 5.575 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.373 -2.876 4.206 1.00 0.00 H new ATOM 0 HG LEU A 65 0.196 -2.452 5.985 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.098 -0.020 5.971 1.00 0.00 H new ATOM 0 HD12 LEU A 65 1.470 -0.627 6.928 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.745 0.039 5.301 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.684 -1.234 4.030 1.00 0.00 H new ATOM 0 HD22 LEU A 65 0.944 -1.228 3.311 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.086 -2.768 3.558 1.00 0.00 H new ATOM 667 N ARG A 66 1.629 -3.866 8.374 1.00 0.00 N ATOM 668 CA ARG A 66 1.807 -3.727 9.804 1.00 0.00 C ATOM 669 C ARG A 66 2.450 -4.972 10.421 1.00 0.00 C ATOM 670 O ARG A 66 3.430 -4.875 11.158 1.00 0.00 O ATOM 671 CB ARG A 66 0.462 -3.499 10.469 1.00 0.00 C ATOM 672 CG ARG A 66 -0.152 -2.139 10.203 1.00 0.00 C ATOM 673 CD ARG A 66 -1.620 -2.148 10.574 1.00 0.00 C ATOM 674 NE ARG A 66 -1.827 -2.625 11.952 1.00 0.00 N ATOM 675 CZ ARG A 66 -2.949 -3.177 12.439 1.00 0.00 C ATOM 676 NH1 ARG A 66 -4.038 -3.292 11.687 1.00 0.00 N ATOM 677 NH2 ARG A 66 -2.967 -3.611 13.695 1.00 0.00 N ATOM 0 H ARG A 66 0.682 -4.119 8.092 1.00 0.00 H new ATOM 0 HA ARG A 66 2.468 -2.876 9.968 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.231 -4.269 10.129 1.00 0.00 H new ATOM 0 HB3 ARG A 66 0.578 -3.626 11.545 1.00 0.00 H new ATOM 0 HG2 ARG A 66 0.372 -1.376 10.779 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -0.037 -1.879 9.151 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -2.028 -1.143 10.471 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -2.167 -2.787 9.881 1.00 0.00 H new ATOM 0 HE ARG A 66 -1.043 -2.526 12.597 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -4.030 -2.958 10.723 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -4.882 -3.714 12.073 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -2.134 -3.523 14.277 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -3.814 -4.032 14.077 1.00 0.00 H new ATOM 691 N THR A 67 1.933 -6.143 10.076 1.00 0.00 N ATOM 692 CA THR A 67 2.353 -7.374 10.744 1.00 0.00 C ATOM 693 C THR A 67 3.449 -8.134 10.007 1.00 0.00 C ATOM 694 O THR A 67 4.166 -8.934 10.611 1.00 0.00 O ATOM 695 CB THR A 67 1.148 -8.305 11.015 1.00 0.00 C ATOM 696 OG1 THR A 67 0.474 -8.633 9.777 1.00 0.00 O ATOM 697 CG2 THR A 67 0.160 -7.637 11.963 1.00 0.00 C ATOM 0 H THR A 67 1.231 -6.270 9.347 1.00 0.00 H new ATOM 0 HA THR A 67 2.783 -7.053 11.693 1.00 0.00 H new ATOM 0 HB THR A 67 1.525 -9.219 11.474 1.00 0.00 H new ATOM 0 HG1 THR A 67 -0.154 -7.917 9.547 1.00 0.00 H new ATOM 0 HG21 THR A 67 -0.681 -8.306 12.142 1.00 0.00 H new ATOM 0 HG22 THR A 67 0.656 -7.416 12.908 1.00 0.00 H new ATOM 0 HG23 THR A 67 -0.202 -6.710 11.517 1.00 0.00 H new ATOM 705 N GLY A 68 3.583 -7.897 8.721 1.00 0.00 N ATOM 706 CA GLY A 68 4.594 -8.595 7.965 1.00 0.00 C ATOM 707 C GLY A 68 4.037 -9.809 7.248 1.00 0.00 C ATOM 708 O GLY A 68 4.798 -10.632 6.710 1.00 0.00 O ATOM 0 H GLY A 68 3.016 -7.239 8.187 1.00 0.00 H new ATOM 0 HA2 GLY A 68 5.034 -7.915 7.236 1.00 0.00 H new ATOM 0 HA3 GLY A 68 5.396 -8.907 8.635 1.00 0.00 H new ATOM 712 N ASP A 69 2.712 -9.940 7.247 1.00 0.00 N ATOM 713 CA ASP A 69 2.046 -11.035 6.524 1.00 0.00 C ATOM 714 C ASP A 69 1.893 -10.638 5.081 1.00 0.00 C ATOM 715 O ASP A 69 0.930 -9.977 4.697 1.00 0.00 O ATOM 716 CB ASP A 69 0.679 -11.392 7.129 1.00 0.00 C ATOM 717 CG ASP A 69 -0.034 -12.529 6.380 1.00 0.00 C ATOM 718 OD1 ASP A 69 0.526 -13.635 6.275 1.00 0.00 O ATOM 719 OD2 ASP A 69 -1.170 -12.326 5.892 1.00 0.00 O ATOM 0 H ASP A 69 2.076 -9.308 7.734 1.00 0.00 H new ATOM 0 HA ASP A 69 2.666 -11.928 6.609 1.00 0.00 H new ATOM 0 HB2 ASP A 69 0.814 -11.680 8.171 1.00 0.00 H new ATOM 0 HB3 ASP A 69 0.043 -10.507 7.123 1.00 0.00 H new ATOM 724 N LEU A 70 2.869 -10.977 4.309 1.00 0.00 N ATOM 725 CA LEU A 70 2.932 -10.580 2.931 1.00 0.00 C ATOM 726 C LEU A 70 2.288 -11.568 2.002 1.00 0.00 C ATOM 727 O LEU A 70 1.693 -11.171 1.004 1.00 0.00 O ATOM 728 CB LEU A 70 4.381 -10.298 2.534 1.00 0.00 C ATOM 729 CG LEU A 70 4.794 -8.824 2.465 1.00 0.00 C ATOM 730 CD1 LEU A 70 4.136 -8.169 1.272 1.00 0.00 C ATOM 731 CD2 LEU A 70 4.411 -8.071 3.744 1.00 0.00 C ATOM 0 H LEU A 70 3.659 -11.545 4.615 1.00 0.00 H new ATOM 0 HA LEU A 70 2.351 -9.663 2.831 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.035 -10.803 3.245 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.562 -10.750 1.559 1.00 0.00 H new ATOM 0 HG LEU A 70 5.878 -8.782 2.362 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.431 -7.121 1.224 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.450 -8.676 0.360 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.053 -8.237 1.371 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.719 -7.029 3.659 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.331 -8.120 3.885 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.910 -8.528 4.599 1.00 0.00 H new ATOM 743 N GLY A 71 2.415 -12.843 2.313 1.00 0.00 N ATOM 744 CA GLY A 71 1.849 -13.888 1.467 1.00 0.00 C ATOM 745 C GLY A 71 2.646 -14.074 0.186 1.00 0.00 C ATOM 746 O GLY A 71 2.208 -14.745 -0.747 1.00 0.00 O ATOM 0 H GLY A 71 2.902 -13.185 3.141 1.00 0.00 H new ATOM 0 HA2 GLY A 71 1.824 -14.828 2.019 1.00 0.00 H new ATOM 0 HA3 GLY A 71 0.818 -13.636 1.220 1.00 0.00 H new ATOM 750 N ILE A 72 3.809 -13.477 0.150 1.00 0.00 N ATOM 751 CA ILE A 72 4.683 -13.520 -0.999 1.00 0.00 C ATOM 752 C ILE A 72 5.577 -14.749 -0.876 1.00 0.00 C ATOM 753 O ILE A 72 6.021 -15.070 0.240 1.00 0.00 O ATOM 754 CB ILE A 72 5.553 -12.208 -1.068 1.00 0.00 C ATOM 755 CG1 ILE A 72 4.658 -10.963 -1.259 1.00 0.00 C ATOM 756 CG2 ILE A 72 6.631 -12.268 -2.155 1.00 0.00 C ATOM 757 CD1 ILE A 72 3.843 -10.957 -2.542 1.00 0.00 C ATOM 0 H ILE A 72 4.184 -12.938 0.930 1.00 0.00 H new ATOM 0 HA ILE A 72 4.096 -13.582 -1.915 1.00 0.00 H new ATOM 0 HB ILE A 72 6.071 -12.128 -0.112 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.977 -10.889 -0.412 1.00 0.00 H new ATOM 0 HG13 ILE A 72 5.288 -10.073 -1.241 1.00 0.00 H new ATOM 0 HG21 ILE A 72 7.199 -11.338 -2.156 1.00 0.00 H new ATOM 0 HG22 ILE A 72 7.303 -13.103 -1.956 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.159 -12.406 -3.128 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.246 -10.046 -2.590 1.00 0.00 H new ATOM 0 HD12 ILE A 72 4.514 -10.996 -3.400 1.00 0.00 H new ATOM 0 HD13 ILE A 72 3.183 -11.824 -2.558 1.00 0.00 H new ATOM 769 N PRO A 73 5.798 -15.500 -1.972 1.00 0.00 N ATOM 770 CA PRO A 73 6.674 -16.659 -1.941 1.00 0.00 C ATOM 771 C PRO A 73 8.116 -16.246 -1.652 1.00 0.00 C ATOM 772 O PRO A 73 8.591 -15.200 -2.154 1.00 0.00 O ATOM 773 CB PRO A 73 6.572 -17.256 -3.348 1.00 0.00 C ATOM 774 CG PRO A 73 5.366 -16.628 -3.960 1.00 0.00 C ATOM 775 CD PRO A 73 5.216 -15.290 -3.310 1.00 0.00 C ATOM 0 HA PRO A 73 6.389 -17.364 -1.160 1.00 0.00 H new ATOM 0 HB2 PRO A 73 7.466 -17.040 -3.932 1.00 0.00 H new ATOM 0 HB3 PRO A 73 6.472 -18.341 -3.308 1.00 0.00 H new ATOM 0 HG2 PRO A 73 5.486 -16.525 -5.039 1.00 0.00 H new ATOM 0 HG3 PRO A 73 4.481 -17.242 -3.795 1.00 0.00 H new ATOM 0 HD2 PRO A 73 5.744 -14.513 -3.862 1.00 0.00 H new ATOM 0 HD3 PRO A 73 4.171 -14.985 -3.252 1.00 0.00 H new ATOM 783 N PRO A 74 8.830 -17.029 -0.845 1.00 0.00 N ATOM 784 CA PRO A 74 10.193 -16.731 -0.513 1.00 0.00 C ATOM 785 C PRO A 74 11.103 -17.008 -1.700 1.00 0.00 C ATOM 786 O PRO A 74 10.857 -17.920 -2.497 1.00 0.00 O ATOM 787 CB PRO A 74 10.509 -17.652 0.671 1.00 0.00 C ATOM 788 CG PRO A 74 9.519 -18.769 0.594 1.00 0.00 C ATOM 789 CD PRO A 74 8.356 -18.285 -0.233 1.00 0.00 C ATOM 0 HA PRO A 74 10.348 -15.682 -0.259 1.00 0.00 H new ATOM 0 HB2 PRO A 74 11.530 -18.029 0.611 1.00 0.00 H new ATOM 0 HB3 PRO A 74 10.422 -17.117 1.617 1.00 0.00 H new ATOM 0 HG2 PRO A 74 9.971 -19.652 0.141 1.00 0.00 H new ATOM 0 HG3 PRO A 74 9.187 -19.057 1.591 1.00 0.00 H new ATOM 0 HD2 PRO A 74 8.079 -19.016 -0.993 1.00 0.00 H new ATOM 0 HD3 PRO A 74 7.474 -18.117 0.384 1.00 0.00 H new ATOM 797 N ASN A 75 12.114 -16.221 -1.835 1.00 0.00 N ATOM 798 CA ASN A 75 13.027 -16.353 -2.940 1.00 0.00 C ATOM 799 C ASN A 75 14.123 -17.310 -2.594 1.00 0.00 C ATOM 800 O ASN A 75 14.487 -17.424 -1.445 1.00 0.00 O ATOM 801 CB ASN A 75 13.680 -15.011 -3.278 1.00 0.00 C ATOM 802 CG ASN A 75 12.754 -13.985 -3.883 1.00 0.00 C ATOM 803 OD1 ASN A 75 12.087 -13.221 -3.174 1.00 0.00 O ATOM 804 ND2 ASN A 75 12.756 -13.908 -5.180 1.00 0.00 N ATOM 0 H ASN A 75 12.339 -15.465 -1.188 1.00 0.00 H new ATOM 0 HA ASN A 75 12.451 -16.713 -3.793 1.00 0.00 H new ATOM 0 HB2 ASN A 75 14.113 -14.596 -2.368 1.00 0.00 H new ATOM 0 HB3 ASN A 75 14.503 -15.189 -3.970 1.00 0.00 H new ATOM 0 HD21 ASN A 75 12.194 -13.198 -5.650 1.00 0.00 H new ATOM 0 HD22 ASN A 75 13.320 -14.557 -5.729 1.00 0.00 H new ATOM 811 N PRO A 76 14.640 -18.052 -3.564 1.00 0.00 N ATOM 812 CA PRO A 76 15.882 -18.819 -3.387 1.00 0.00 C ATOM 813 C PRO A 76 17.058 -17.828 -3.298 1.00 0.00 C ATOM 814 O PRO A 76 18.142 -18.133 -2.800 1.00 0.00 O ATOM 815 CB PRO A 76 15.980 -19.643 -4.676 1.00 0.00 C ATOM 816 CG PRO A 76 14.617 -19.596 -5.277 1.00 0.00 C ATOM 817 CD PRO A 76 14.039 -18.284 -4.886 1.00 0.00 C ATOM 0 HA PRO A 76 15.899 -19.441 -2.492 1.00 0.00 H new ATOM 0 HB2 PRO A 76 16.724 -19.225 -5.354 1.00 0.00 H new ATOM 0 HB3 PRO A 76 16.282 -20.669 -4.465 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.666 -19.693 -6.362 1.00 0.00 H new ATOM 0 HG3 PRO A 76 14.001 -20.418 -4.911 1.00 0.00 H new ATOM 0 HD2 PRO A 76 14.301 -17.498 -5.594 1.00 0.00 H new ATOM 0 HD3 PRO A 76 12.951 -18.319 -4.836 1.00 0.00 H new ATOM 825 N GLU A 77 16.784 -16.621 -3.788 1.00 0.00 N ATOM 826 CA GLU A 77 17.693 -15.490 -3.784 1.00 0.00 C ATOM 827 C GLU A 77 17.669 -14.774 -2.439 1.00 0.00 C ATOM 828 O GLU A 77 18.445 -13.854 -2.212 1.00 0.00 O ATOM 829 CB GLU A 77 17.236 -14.433 -4.798 1.00 0.00 C ATOM 830 CG GLU A 77 17.179 -14.824 -6.271 1.00 0.00 C ATOM 831 CD GLU A 77 16.014 -15.725 -6.625 1.00 0.00 C ATOM 832 OE1 GLU A 77 14.890 -15.507 -6.121 1.00 0.00 O ATOM 833 OE2 GLU A 77 16.199 -16.665 -7.415 1.00 0.00 O ATOM 0 H GLU A 77 15.884 -16.401 -4.215 1.00 0.00 H new ATOM 0 HA GLU A 77 18.681 -15.889 -4.014 1.00 0.00 H new ATOM 0 HB2 GLU A 77 16.241 -14.098 -4.504 1.00 0.00 H new ATOM 0 HB3 GLU A 77 17.902 -13.575 -4.707 1.00 0.00 H new ATOM 0 HG2 GLU A 77 17.121 -13.918 -6.875 1.00 0.00 H new ATOM 0 HG3 GLU A 77 18.108 -15.327 -6.539 1.00 0.00 H new ATOM 840 N ASP A 78 16.799 -15.205 -1.551 1.00 0.00 N ATOM 841 CA ASP A 78 16.520 -14.444 -0.324 1.00 0.00 C ATOM 842 C ASP A 78 17.718 -14.441 0.590 1.00 0.00 C ATOM 843 O ASP A 78 18.014 -13.436 1.230 1.00 0.00 O ATOM 844 CB ASP A 78 15.318 -15.058 0.377 1.00 0.00 C ATOM 845 CG ASP A 78 14.704 -14.210 1.483 1.00 0.00 C ATOM 846 OD1 ASP A 78 15.419 -13.709 2.382 1.00 0.00 O ATOM 847 OD2 ASP A 78 13.478 -14.001 1.449 1.00 0.00 O ATOM 0 H ASP A 78 16.269 -16.072 -1.643 1.00 0.00 H new ATOM 0 HA ASP A 78 16.301 -13.409 -0.586 1.00 0.00 H new ATOM 0 HB2 ASP A 78 14.550 -15.264 -0.369 1.00 0.00 H new ATOM 0 HB3 ASP A 78 15.616 -16.017 0.801 1.00 0.00 H new ATOM 852 N ARG A 79 18.457 -15.519 0.562 1.00 0.00 N ATOM 853 CA ARG A 79 19.672 -15.643 1.343 1.00 0.00 C ATOM 854 C ARG A 79 20.785 -14.676 0.886 1.00 0.00 C ATOM 855 O ARG A 79 21.686 -14.348 1.663 1.00 0.00 O ATOM 856 CB ARG A 79 20.148 -17.119 1.423 1.00 0.00 C ATOM 857 CG ARG A 79 20.101 -17.915 0.109 1.00 0.00 C ATOM 858 CD ARG A 79 21.012 -17.366 -0.953 1.00 0.00 C ATOM 859 NE ARG A 79 20.871 -18.085 -2.217 1.00 0.00 N ATOM 860 CZ ARG A 79 21.868 -18.335 -3.066 1.00 0.00 C ATOM 861 NH1 ARG A 79 23.118 -17.972 -2.757 1.00 0.00 N ATOM 862 NH2 ARG A 79 21.621 -18.954 -4.215 1.00 0.00 N ATOM 0 H ARG A 79 18.238 -16.340 -0.002 1.00 0.00 H new ATOM 0 HA ARG A 79 19.426 -15.334 2.359 1.00 0.00 H new ATOM 0 HB2 ARG A 79 21.173 -17.130 1.795 1.00 0.00 H new ATOM 0 HB3 ARG A 79 19.536 -17.638 2.161 1.00 0.00 H new ATOM 0 HG2 ARG A 79 20.373 -18.951 0.310 1.00 0.00 H new ATOM 0 HG3 ARG A 79 19.078 -17.921 -0.267 1.00 0.00 H new ATOM 0 HD2 ARG A 79 20.792 -16.310 -1.110 1.00 0.00 H new ATOM 0 HD3 ARG A 79 22.046 -17.429 -0.613 1.00 0.00 H new ATOM 0 HE ARG A 79 19.941 -18.420 -2.468 1.00 0.00 H new ATOM 0 HH11 ARG A 79 23.309 -17.504 -1.871 1.00 0.00 H new ATOM 0 HH12 ARG A 79 23.880 -18.164 -3.407 1.00 0.00 H new ATOM 0 HH21 ARG A 79 20.669 -19.238 -4.447 1.00 0.00 H new ATOM 0 HH22 ARG A 79 22.383 -19.146 -4.865 1.00 0.00 H new ATOM 876 N SER A 80 20.697 -14.204 -0.346 1.00 0.00 N ATOM 877 CA SER A 80 21.673 -13.295 -0.895 1.00 0.00 C ATOM 878 C SER A 80 21.393 -11.871 -0.405 1.00 0.00 C ATOM 879 O SER A 80 20.279 -11.369 -0.564 1.00 0.00 O ATOM 880 CB SER A 80 21.628 -13.358 -2.421 1.00 0.00 C ATOM 881 OG SER A 80 21.870 -14.689 -2.866 1.00 0.00 O ATOM 0 H SER A 80 19.943 -14.444 -0.990 1.00 0.00 H new ATOM 0 HA SER A 80 22.669 -13.584 -0.561 1.00 0.00 H new ATOM 0 HB2 SER A 80 20.655 -13.019 -2.778 1.00 0.00 H new ATOM 0 HB3 SER A 80 22.375 -12.685 -2.842 1.00 0.00 H new ATOM 0 HG SER A 80 21.837 -14.718 -3.845 1.00 0.00 H new ATOM 887 N PRO A 81 22.372 -11.235 0.253 1.00 0.00 N ATOM 888 CA PRO A 81 22.232 -9.863 0.756 1.00 0.00 C ATOM 889 C PRO A 81 21.923 -8.851 -0.358 1.00 0.00 C ATOM 890 O PRO A 81 22.495 -8.910 -1.464 1.00 0.00 O ATOM 891 CB PRO A 81 23.609 -9.558 1.358 1.00 0.00 C ATOM 892 CG PRO A 81 24.206 -10.884 1.648 1.00 0.00 C ATOM 893 CD PRO A 81 23.687 -11.812 0.593 1.00 0.00 C ATOM 0 HA PRO A 81 21.405 -9.783 1.461 1.00 0.00 H new ATOM 0 HB2 PRO A 81 24.227 -8.991 0.662 1.00 0.00 H new ATOM 0 HB3 PRO A 81 23.519 -8.959 2.264 1.00 0.00 H new ATOM 0 HG2 PRO A 81 25.295 -10.835 1.623 1.00 0.00 H new ATOM 0 HG3 PRO A 81 23.925 -11.229 2.643 1.00 0.00 H new ATOM 0 HD2 PRO A 81 24.348 -11.846 -0.273 1.00 0.00 H new ATOM 0 HD3 PRO A 81 23.595 -12.833 0.964 1.00 0.00 H new ATOM 901 N SER A 82 21.041 -7.938 -0.062 1.00 0.00 N ATOM 902 CA SER A 82 20.660 -6.903 -0.977 1.00 0.00 C ATOM 903 C SER A 82 21.654 -5.722 -0.803 1.00 0.00 C ATOM 904 O SER A 82 22.351 -5.662 0.222 1.00 0.00 O ATOM 905 CB SER A 82 19.226 -6.481 -0.637 1.00 0.00 C ATOM 906 OG SER A 82 18.389 -7.638 -0.477 1.00 0.00 O ATOM 0 H SER A 82 20.560 -7.893 0.836 1.00 0.00 H new ATOM 0 HA SER A 82 20.692 -7.237 -2.014 1.00 0.00 H new ATOM 0 HB2 SER A 82 19.221 -5.891 0.280 1.00 0.00 H new ATOM 0 HB3 SER A 82 18.830 -5.844 -1.428 1.00 0.00 H new ATOM 0 HG SER A 82 17.779 -7.499 0.277 1.00 0.00 H new ATOM 912 N PRO A 83 21.771 -4.805 -1.794 1.00 0.00 N ATOM 913 CA PRO A 83 22.693 -3.654 -1.715 1.00 0.00 C ATOM 914 C PRO A 83 22.444 -2.768 -0.477 1.00 0.00 C ATOM 915 O PRO A 83 21.327 -2.716 0.065 1.00 0.00 O ATOM 916 CB PRO A 83 22.395 -2.866 -2.996 1.00 0.00 C ATOM 917 CG PRO A 83 21.821 -3.871 -3.927 1.00 0.00 C ATOM 918 CD PRO A 83 21.033 -4.814 -3.072 1.00 0.00 C ATOM 0 HA PRO A 83 23.729 -3.981 -1.624 1.00 0.00 H new ATOM 0 HB2 PRO A 83 21.693 -2.053 -2.808 1.00 0.00 H new ATOM 0 HB3 PRO A 83 23.300 -2.417 -3.405 1.00 0.00 H new ATOM 0 HG2 PRO A 83 21.185 -3.395 -4.673 1.00 0.00 H new ATOM 0 HG3 PRO A 83 22.607 -4.397 -4.468 1.00 0.00 H new ATOM 0 HD2 PRO A 83 20.004 -4.479 -2.945 1.00 0.00 H new ATOM 0 HD3 PRO A 83 20.992 -5.813 -3.506 1.00 0.00 H new ATOM 926 N GLU A 84 23.484 -2.112 -0.022 1.00 0.00 N ATOM 927 CA GLU A 84 23.405 -1.228 1.120 1.00 0.00 C ATOM 928 C GLU A 84 22.691 0.068 0.744 1.00 0.00 C ATOM 929 O GLU A 84 23.085 0.736 -0.223 1.00 0.00 O ATOM 930 CB GLU A 84 24.795 -0.942 1.657 1.00 0.00 C ATOM 931 CG GLU A 84 25.488 -2.175 2.190 1.00 0.00 C ATOM 932 CD GLU A 84 24.777 -2.767 3.378 1.00 0.00 C ATOM 933 OE1 GLU A 84 25.008 -2.283 4.505 1.00 0.00 O ATOM 934 OE2 GLU A 84 23.986 -3.737 3.211 1.00 0.00 O ATOM 0 H GLU A 84 24.415 -2.175 -0.434 1.00 0.00 H new ATOM 0 HA GLU A 84 22.827 -1.718 1.904 1.00 0.00 H new ATOM 0 HB2 GLU A 84 25.402 -0.505 0.864 1.00 0.00 H new ATOM 0 HB3 GLU A 84 24.726 -0.199 2.451 1.00 0.00 H new ATOM 0 HG2 GLU A 84 25.552 -2.922 1.399 1.00 0.00 H new ATOM 0 HG3 GLU A 84 26.510 -1.921 2.472 1.00 0.00 H new ATOM 941 N PRO A 85 21.628 0.436 1.485 1.00 0.00 N ATOM 942 CA PRO A 85 20.830 1.628 1.198 1.00 0.00 C ATOM 943 C PRO A 85 21.610 2.925 1.387 1.00 0.00 C ATOM 944 O PRO A 85 22.501 3.015 2.254 1.00 0.00 O ATOM 945 CB PRO A 85 19.680 1.562 2.212 1.00 0.00 C ATOM 946 CG PRO A 85 19.700 0.168 2.726 1.00 0.00 C ATOM 947 CD PRO A 85 21.121 -0.276 2.663 1.00 0.00 C ATOM 0 HA PRO A 85 20.504 1.636 0.158 1.00 0.00 H new ATOM 0 HB2 PRO A 85 19.823 2.282 3.018 1.00 0.00 H new ATOM 0 HB3 PRO A 85 18.725 1.795 1.741 1.00 0.00 H new ATOM 0 HG2 PRO A 85 19.323 0.124 3.748 1.00 0.00 H new ATOM 0 HG3 PRO A 85 19.063 -0.479 2.123 1.00 0.00 H new ATOM 0 HD2 PRO A 85 21.670 -0.008 3.566 1.00 0.00 H new ATOM 0 HD3 PRO A 85 21.203 -1.357 2.549 1.00 0.00 H new ATOM 955 N ILE A 86 21.266 3.915 0.592 1.00 0.00 N ATOM 956 CA ILE A 86 21.899 5.215 0.647 1.00 0.00 C ATOM 957 C ILE A 86 21.280 6.000 1.812 1.00 0.00 C ATOM 958 O ILE A 86 20.142 5.716 2.230 1.00 0.00 O ATOM 959 CB ILE A 86 21.738 5.991 -0.707 1.00 0.00 C ATOM 960 CG1 ILE A 86 22.639 7.243 -0.737 1.00 0.00 C ATOM 961 CG2 ILE A 86 20.281 6.379 -0.932 1.00 0.00 C ATOM 962 CD1 ILE A 86 22.607 8.007 -2.048 1.00 0.00 C ATOM 0 H ILE A 86 20.535 3.840 -0.115 1.00 0.00 H new ATOM 0 HA ILE A 86 22.970 5.093 0.808 1.00 0.00 H new ATOM 0 HB ILE A 86 22.050 5.328 -1.514 1.00 0.00 H new ATOM 0 HG12 ILE A 86 22.336 7.913 0.068 1.00 0.00 H new ATOM 0 HG13 ILE A 86 23.666 6.942 -0.531 1.00 0.00 H new ATOM 0 HG21 ILE A 86 20.189 6.916 -1.876 1.00 0.00 H new ATOM 0 HG22 ILE A 86 19.666 5.480 -0.965 1.00 0.00 H new ATOM 0 HG23 ILE A 86 19.945 7.019 -0.116 1.00 0.00 H new ATOM 0 HD11 ILE A 86 23.268 8.871 -1.982 1.00 0.00 H new ATOM 0 HD12 ILE A 86 22.940 7.356 -2.857 1.00 0.00 H new ATOM 0 HD13 ILE A 86 21.590 8.343 -2.249 1.00 0.00 H new ATOM 974 N TYR A 87 22.015 6.928 2.349 1.00 0.00 N ATOM 975 CA TYR A 87 21.595 7.646 3.525 1.00 0.00 C ATOM 976 C TYR A 87 20.831 8.902 3.169 1.00 0.00 C ATOM 977 O TYR A 87 21.053 9.511 2.117 1.00 0.00 O ATOM 978 CB TYR A 87 22.808 8.028 4.375 1.00 0.00 C ATOM 979 CG TYR A 87 23.652 6.866 4.858 1.00 0.00 C ATOM 980 CD1 TYR A 87 24.451 6.145 3.977 1.00 0.00 C ATOM 981 CD2 TYR A 87 23.660 6.502 6.194 1.00 0.00 C ATOM 982 CE1 TYR A 87 25.230 5.100 4.411 1.00 0.00 C ATOM 983 CE2 TYR A 87 24.445 5.458 6.638 1.00 0.00 C ATOM 984 CZ TYR A 87 25.228 4.763 5.741 1.00 0.00 C ATOM 985 OH TYR A 87 26.002 3.710 6.179 1.00 0.00 O ATOM 0 H TYR A 87 22.925 7.212 1.987 1.00 0.00 H new ATOM 0 HA TYR A 87 20.937 6.985 4.089 1.00 0.00 H new ATOM 0 HB2 TYR A 87 23.441 8.699 3.794 1.00 0.00 H new ATOM 0 HB3 TYR A 87 22.461 8.589 5.243 1.00 0.00 H new ATOM 0 HD1 TYR A 87 24.459 6.412 2.931 1.00 0.00 H new ATOM 0 HD2 TYR A 87 23.044 7.042 6.897 1.00 0.00 H new ATOM 0 HE1 TYR A 87 25.839 4.548 3.711 1.00 0.00 H new ATOM 0 HE2 TYR A 87 24.446 5.186 7.683 1.00 0.00 H new ATOM 0 HH TYR A 87 26.031 3.711 7.159 1.00 0.00 H new ATOM 995 N ASN A 88 19.903 9.252 4.019 1.00 0.00 N ATOM 996 CA ASN A 88 19.204 10.523 3.910 1.00 0.00 C ATOM 997 C ASN A 88 20.046 11.554 4.668 1.00 0.00 C ATOM 998 O ASN A 88 20.883 11.163 5.478 1.00 0.00 O ATOM 999 CB ASN A 88 17.777 10.423 4.502 1.00 0.00 C ATOM 1000 CG ASN A 88 16.979 11.722 4.408 1.00 0.00 C ATOM 1001 OD1 ASN A 88 17.155 12.520 3.487 1.00 0.00 O ATOM 1002 ND2 ASN A 88 16.125 11.947 5.361 1.00 0.00 N ATOM 0 H ASN A 88 19.605 8.674 4.805 1.00 0.00 H new ATOM 0 HA ASN A 88 19.085 10.814 2.866 1.00 0.00 H new ATOM 0 HB2 ASN A 88 17.233 9.634 3.983 1.00 0.00 H new ATOM 0 HB3 ASN A 88 17.848 10.126 5.548 1.00 0.00 H new ATOM 0 HD21 ASN A 88 15.575 12.806 5.361 1.00 0.00 H new ATOM 0 HD22 ASN A 88 16.004 11.264 6.109 1.00 0.00 H new ATOM 1009 N SER A 89 19.804 12.830 4.439 1.00 0.00 N ATOM 1010 CA SER A 89 20.597 13.941 4.982 1.00 0.00 C ATOM 1011 C SER A 89 20.801 13.926 6.521 1.00 0.00 C ATOM 1012 O SER A 89 21.757 14.502 7.017 1.00 0.00 O ATOM 1013 CB SER A 89 19.978 15.243 4.516 1.00 0.00 C ATOM 1014 OG SER A 89 19.815 15.202 3.101 1.00 0.00 O ATOM 0 H SER A 89 19.029 13.143 3.854 1.00 0.00 H new ATOM 0 HA SER A 89 21.609 13.825 4.593 1.00 0.00 H new ATOM 0 HB2 SER A 89 19.014 15.396 5.001 1.00 0.00 H new ATOM 0 HB3 SER A 89 20.613 16.083 4.797 1.00 0.00 H new ATOM 0 HG SER A 89 19.413 16.041 2.794 1.00 0.00 H new ATOM 1020 N GLU A 90 19.941 13.259 7.266 1.00 0.00 N ATOM 1021 CA GLU A 90 20.127 13.189 8.715 1.00 0.00 C ATOM 1022 C GLU A 90 21.029 11.988 9.106 1.00 0.00 C ATOM 1023 O GLU A 90 21.197 11.685 10.295 1.00 0.00 O ATOM 1024 CB GLU A 90 18.778 13.090 9.440 1.00 0.00 C ATOM 1025 CG GLU A 90 18.003 11.818 9.136 1.00 0.00 C ATOM 1026 CD GLU A 90 16.778 11.654 10.002 1.00 0.00 C ATOM 1027 OE1 GLU A 90 16.930 11.552 11.240 1.00 0.00 O ATOM 1028 OE2 GLU A 90 15.653 11.560 9.476 1.00 0.00 O ATOM 0 H GLU A 90 19.122 12.766 6.909 1.00 0.00 H new ATOM 0 HA GLU A 90 20.622 14.109 9.025 1.00 0.00 H new ATOM 0 HB2 GLU A 90 18.950 13.150 10.515 1.00 0.00 H new ATOM 0 HB3 GLU A 90 18.166 13.950 9.166 1.00 0.00 H new ATOM 0 HG2 GLU A 90 17.703 11.824 8.088 1.00 0.00 H new ATOM 0 HG3 GLU A 90 18.658 10.958 9.275 1.00 0.00 H new ATOM 1035 N GLY A 91 21.603 11.322 8.106 1.00 0.00 N ATOM 1036 CA GLY A 91 22.415 10.134 8.345 1.00 0.00 C ATOM 1037 C GLY A 91 21.525 8.938 8.557 1.00 0.00 C ATOM 1038 O GLY A 91 21.852 8.002 9.307 1.00 0.00 O ATOM 0 H GLY A 91 21.520 11.586 7.124 1.00 0.00 H new ATOM 0 HA2 GLY A 91 23.077 9.959 7.497 1.00 0.00 H new ATOM 0 HA3 GLY A 91 23.049 10.286 9.219 1.00 0.00 H new ATOM 1042 N LYS A 92 20.400 8.970 7.884 1.00 0.00 N ATOM 1043 CA LYS A 92 19.358 7.983 8.046 1.00 0.00 C ATOM 1044 C LYS A 92 19.609 6.829 7.104 1.00 0.00 C ATOM 1045 O LYS A 92 19.765 7.041 5.900 1.00 0.00 O ATOM 1046 CB LYS A 92 18.030 8.617 7.666 1.00 0.00 C ATOM 1047 CG LYS A 92 16.797 8.010 8.308 1.00 0.00 C ATOM 1048 CD LYS A 92 15.551 8.655 7.729 1.00 0.00 C ATOM 1049 CE LYS A 92 14.303 8.404 8.567 1.00 0.00 C ATOM 1050 NZ LYS A 92 14.359 9.107 9.874 1.00 0.00 N ATOM 0 H LYS A 92 20.179 9.692 7.199 1.00 0.00 H new ATOM 0 HA LYS A 92 19.344 7.631 9.077 1.00 0.00 H new ATOM 0 HB2 LYS A 92 18.067 9.675 7.926 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.918 8.558 6.583 1.00 0.00 H new ATOM 0 HG2 LYS A 92 16.776 6.934 8.134 1.00 0.00 H new ATOM 0 HG3 LYS A 92 16.827 8.157 9.388 1.00 0.00 H new ATOM 0 HD2 LYS A 92 15.713 9.729 7.642 1.00 0.00 H new ATOM 0 HD3 LYS A 92 15.387 8.274 6.721 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.423 8.735 8.015 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.189 7.333 8.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 13.393 9.260 10.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 14.890 8.529 10.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 14.833 10.025 9.754 1.00 0.00 H new ATOM 1064 N ARG A 93 19.655 5.640 7.627 1.00 0.00 N ATOM 1065 CA ARG A 93 19.788 4.469 6.816 1.00 0.00 C ATOM 1066 C ARG A 93 18.777 3.469 7.318 1.00 0.00 C ATOM 1067 O ARG A 93 18.623 3.295 8.526 1.00 0.00 O ATOM 1068 CB ARG A 93 21.200 3.868 6.885 1.00 0.00 C ATOM 1069 CG ARG A 93 21.470 2.842 5.780 1.00 0.00 C ATOM 1070 CD ARG A 93 22.832 2.175 5.920 1.00 0.00 C ATOM 1071 NE ARG A 93 22.894 1.261 7.064 1.00 0.00 N ATOM 1072 CZ ARG A 93 24.017 0.818 7.651 1.00 0.00 C ATOM 1073 NH1 ARG A 93 25.202 1.324 7.326 1.00 0.00 N ATOM 1074 NH2 ARG A 93 23.939 -0.113 8.587 1.00 0.00 N ATOM 0 H ARG A 93 19.601 5.456 8.629 1.00 0.00 H new ATOM 0 HA ARG A 93 19.616 4.730 5.772 1.00 0.00 H new ATOM 0 HB2 ARG A 93 21.934 4.671 6.815 1.00 0.00 H new ATOM 0 HB3 ARG A 93 21.339 3.393 7.856 1.00 0.00 H new ATOM 0 HG2 ARG A 93 20.692 2.079 5.800 1.00 0.00 H new ATOM 0 HG3 ARG A 93 21.409 3.334 4.809 1.00 0.00 H new ATOM 0 HD2 ARG A 93 23.059 1.625 5.007 1.00 0.00 H new ATOM 0 HD3 ARG A 93 23.599 2.942 6.030 1.00 0.00 H new ATOM 0 HE ARG A 93 22.007 0.933 7.447 1.00 0.00 H new ATOM 0 HH11 ARG A 93 25.267 2.059 6.622 1.00 0.00 H new ATOM 0 HH12 ARG A 93 26.047 0.977 7.781 1.00 0.00 H new ATOM 0 HH21 ARG A 93 23.030 -0.489 8.858 1.00 0.00 H new ATOM 0 HH22 ARG A 93 24.788 -0.455 9.038 1.00 0.00 H new ATOM 1088 N LEU A 94 18.099 2.841 6.424 1.00 0.00 N ATOM 1089 CA LEU A 94 17.067 1.894 6.768 1.00 0.00 C ATOM 1090 C LEU A 94 17.341 0.621 5.999 1.00 0.00 C ATOM 1091 O LEU A 94 18.487 0.388 5.594 1.00 0.00 O ATOM 1092 CB LEU A 94 15.688 2.497 6.404 1.00 0.00 C ATOM 1093 CG LEU A 94 15.206 2.474 4.924 1.00 0.00 C ATOM 1094 CD1 LEU A 94 14.007 3.348 4.767 1.00 0.00 C ATOM 1095 CD2 LEU A 94 16.288 2.830 3.895 1.00 0.00 C ATOM 0 H LEU A 94 18.237 2.962 5.421 1.00 0.00 H new ATOM 0 HA LEU A 94 17.060 1.672 7.835 1.00 0.00 H new ATOM 0 HB2 LEU A 94 14.937 1.978 7.000 1.00 0.00 H new ATOM 0 HB3 LEU A 94 15.690 3.537 6.730 1.00 0.00 H new ATOM 0 HG LEU A 94 14.944 1.439 4.706 1.00 0.00 H new ATOM 0 HD11 LEU A 94 13.675 3.327 3.729 1.00 0.00 H new ATOM 0 HD12 LEU A 94 13.206 2.986 5.411 1.00 0.00 H new ATOM 0 HD13 LEU A 94 14.263 4.370 5.046 1.00 0.00 H new ATOM 0 HD21 LEU A 94 15.864 2.789 2.892 1.00 0.00 H new ATOM 0 HD22 LEU A 94 16.659 3.836 4.091 1.00 0.00 H new ATOM 0 HD23 LEU A 94 17.110 2.118 3.971 1.00 0.00 H new ATOM 1107 N ASN A 95 16.347 -0.199 5.799 1.00 0.00 N ATOM 1108 CA ASN A 95 16.541 -1.361 5.003 1.00 0.00 C ATOM 1109 C ASN A 95 15.789 -1.292 3.702 1.00 0.00 C ATOM 1110 O ASN A 95 14.580 -1.232 3.692 1.00 0.00 O ATOM 1111 CB ASN A 95 16.238 -2.625 5.741 1.00 0.00 C ATOM 1112 CG ASN A 95 16.576 -3.795 4.878 1.00 0.00 C ATOM 1113 OD1 ASN A 95 15.716 -4.373 4.211 1.00 0.00 O ATOM 1114 ND2 ASN A 95 17.839 -4.069 4.789 1.00 0.00 N ATOM 0 H ASN A 95 15.406 -0.080 6.175 1.00 0.00 H new ATOM 0 HA ASN A 95 17.604 -1.383 4.764 1.00 0.00 H new ATOM 0 HB2 ASN A 95 16.811 -2.665 6.667 1.00 0.00 H new ATOM 0 HB3 ASN A 95 15.184 -2.655 6.017 1.00 0.00 H new ATOM 0 HD21 ASN A 95 18.160 -4.792 4.145 1.00 0.00 H new ATOM 0 HD22 ASN A 95 18.513 -3.562 5.363 1.00 0.00 H new ATOM 1121 N THR A 96 16.536 -1.340 2.611 1.00 0.00 N ATOM 1122 CA THR A 96 16.004 -1.202 1.274 1.00 0.00 C ATOM 1123 C THR A 96 14.946 -2.262 0.925 1.00 0.00 C ATOM 1124 O THR A 96 13.878 -1.907 0.455 1.00 0.00 O ATOM 1125 CB THR A 96 17.139 -1.153 0.182 1.00 0.00 C ATOM 1126 OG1 THR A 96 16.576 -1.032 -1.131 1.00 0.00 O ATOM 1127 CG2 THR A 96 18.037 -2.387 0.234 1.00 0.00 C ATOM 0 H THR A 96 17.546 -1.479 2.635 1.00 0.00 H new ATOM 0 HA THR A 96 15.493 -0.239 1.268 1.00 0.00 H new ATOM 0 HB THR A 96 17.749 -0.276 0.401 1.00 0.00 H new ATOM 0 HG1 THR A 96 17.297 -1.002 -1.794 1.00 0.00 H new ATOM 0 HG21 THR A 96 18.805 -2.311 -0.536 1.00 0.00 H new ATOM 0 HG22 THR A 96 18.510 -2.451 1.214 1.00 0.00 H new ATOM 0 HG23 THR A 96 17.438 -3.281 0.061 1.00 0.00 H new ATOM 1135 N ARG A 97 15.205 -3.533 1.212 1.00 0.00 N ATOM 1136 CA ARG A 97 14.288 -4.586 0.808 1.00 0.00 C ATOM 1137 C ARG A 97 13.002 -4.546 1.628 1.00 0.00 C ATOM 1138 O ARG A 97 11.906 -4.710 1.083 1.00 0.00 O ATOM 1139 CB ARG A 97 14.960 -5.946 0.888 1.00 0.00 C ATOM 1140 CG ARG A 97 14.123 -7.094 0.388 1.00 0.00 C ATOM 1141 CD ARG A 97 14.883 -8.387 0.503 1.00 0.00 C ATOM 1142 NE ARG A 97 14.071 -9.523 0.117 1.00 0.00 N ATOM 1143 CZ ARG A 97 14.129 -10.725 0.679 1.00 0.00 C ATOM 1144 NH1 ARG A 97 15.083 -11.015 1.584 1.00 0.00 N ATOM 1145 NH2 ARG A 97 13.259 -11.649 0.316 1.00 0.00 N ATOM 0 H ARG A 97 16.032 -3.854 1.716 1.00 0.00 H new ATOM 0 HA ARG A 97 14.012 -4.413 -0.232 1.00 0.00 H new ATOM 0 HB2 ARG A 97 15.886 -5.913 0.314 1.00 0.00 H new ATOM 0 HB3 ARG A 97 15.235 -6.140 1.925 1.00 0.00 H new ATOM 0 HG2 ARG A 97 13.199 -7.156 0.963 1.00 0.00 H new ATOM 0 HG3 ARG A 97 13.841 -6.922 -0.651 1.00 0.00 H new ATOM 0 HD2 ARG A 97 15.771 -8.344 -0.127 1.00 0.00 H new ATOM 0 HD3 ARG A 97 15.226 -8.517 1.529 1.00 0.00 H new ATOM 0 HE ARG A 97 13.405 -9.390 -0.644 1.00 0.00 H new ATOM 0 HH11 ARG A 97 15.771 -10.308 1.844 1.00 0.00 H new ATOM 0 HH12 ARG A 97 15.118 -11.942 2.009 1.00 0.00 H new ATOM 0 HH21 ARG A 97 12.553 -11.436 -0.389 1.00 0.00 H new ATOM 0 HH22 ARG A 97 13.293 -12.576 0.740 1.00 0.00 H new ATOM 1159 N GLU A 98 13.127 -4.318 2.925 1.00 0.00 N ATOM 1160 CA GLU A 98 11.958 -4.191 3.787 1.00 0.00 C ATOM 1161 C GLU A 98 11.142 -2.995 3.390 1.00 0.00 C ATOM 1162 O GLU A 98 9.928 -3.092 3.179 1.00 0.00 O ATOM 1163 CB GLU A 98 12.366 -4.066 5.249 1.00 0.00 C ATOM 1164 CG GLU A 98 12.980 -5.332 5.826 1.00 0.00 C ATOM 1165 CD GLU A 98 12.052 -6.532 5.746 1.00 0.00 C ATOM 1166 OE1 GLU A 98 11.977 -7.176 4.676 1.00 0.00 O ATOM 1167 OE2 GLU A 98 11.393 -6.861 6.757 1.00 0.00 O ATOM 0 H GLU A 98 14.021 -4.217 3.405 1.00 0.00 H new ATOM 0 HA GLU A 98 11.358 -5.093 3.668 1.00 0.00 H new ATOM 0 HB2 GLU A 98 13.081 -3.249 5.348 1.00 0.00 H new ATOM 0 HB3 GLU A 98 11.490 -3.797 5.839 1.00 0.00 H new ATOM 0 HG2 GLU A 98 13.903 -5.557 5.292 1.00 0.00 H new ATOM 0 HG3 GLU A 98 13.249 -5.157 6.868 1.00 0.00 H new ATOM 1174 N PHE A 99 11.828 -1.893 3.231 1.00 0.00 N ATOM 1175 CA PHE A 99 11.224 -0.636 2.914 1.00 0.00 C ATOM 1176 C PHE A 99 10.544 -0.673 1.562 1.00 0.00 C ATOM 1177 O PHE A 99 9.441 -0.183 1.417 1.00 0.00 O ATOM 1178 CB PHE A 99 12.281 0.455 2.942 1.00 0.00 C ATOM 1179 CG PHE A 99 11.734 1.826 2.739 1.00 0.00 C ATOM 1180 CD1 PHE A 99 10.870 2.367 3.671 1.00 0.00 C ATOM 1181 CD2 PHE A 99 12.090 2.576 1.635 1.00 0.00 C ATOM 1182 CE1 PHE A 99 10.369 3.639 3.508 1.00 0.00 C ATOM 1183 CE2 PHE A 99 11.598 3.851 1.464 1.00 0.00 C ATOM 1184 CZ PHE A 99 10.739 4.385 2.401 1.00 0.00 C ATOM 0 H PHE A 99 12.843 -1.849 3.321 1.00 0.00 H new ATOM 0 HA PHE A 99 10.459 -0.424 3.661 1.00 0.00 H new ATOM 0 HB2 PHE A 99 12.802 0.419 3.899 1.00 0.00 H new ATOM 0 HB3 PHE A 99 13.021 0.251 2.169 1.00 0.00 H new ATOM 0 HD1 PHE A 99 10.585 1.787 4.536 1.00 0.00 H new ATOM 0 HD2 PHE A 99 12.761 2.158 0.899 1.00 0.00 H new ATOM 0 HE1 PHE A 99 9.691 4.053 4.240 1.00 0.00 H new ATOM 0 HE2 PHE A 99 11.884 4.431 0.599 1.00 0.00 H new ATOM 0 HZ PHE A 99 10.354 5.386 2.272 1.00 0.00 H new ATOM 1194 N ARG A 100 11.199 -1.284 0.590 1.00 0.00 N ATOM 1195 CA ARG A 100 10.685 -1.357 -0.770 1.00 0.00 C ATOM 1196 C ARG A 100 9.352 -2.086 -0.786 1.00 0.00 C ATOM 1197 O ARG A 100 8.386 -1.610 -1.374 1.00 0.00 O ATOM 1198 CB ARG A 100 11.677 -2.094 -1.663 1.00 0.00 C ATOM 1199 CG ARG A 100 11.361 -2.040 -3.143 1.00 0.00 C ATOM 1200 CD ARG A 100 12.294 -2.943 -3.922 1.00 0.00 C ATOM 1201 NE ARG A 100 13.712 -2.640 -3.692 1.00 0.00 N ATOM 1202 CZ ARG A 100 14.727 -3.466 -3.974 1.00 0.00 C ATOM 1203 NH1 ARG A 100 14.497 -4.621 -4.604 1.00 0.00 N ATOM 1204 NH2 ARG A 100 15.966 -3.122 -3.639 1.00 0.00 N ATOM 0 H ARG A 100 12.101 -1.743 0.719 1.00 0.00 H new ATOM 0 HA ARG A 100 10.545 -0.343 -1.145 1.00 0.00 H new ATOM 0 HB2 ARG A 100 12.670 -1.675 -1.502 1.00 0.00 H new ATOM 0 HB3 ARG A 100 11.718 -3.138 -1.352 1.00 0.00 H new ATOM 0 HG2 ARG A 100 10.328 -2.344 -3.311 1.00 0.00 H new ATOM 0 HG3 ARG A 100 11.454 -1.015 -3.503 1.00 0.00 H new ATOM 0 HD2 ARG A 100 12.101 -3.980 -3.647 1.00 0.00 H new ATOM 0 HD3 ARG A 100 12.076 -2.850 -4.986 1.00 0.00 H new ATOM 0 HE ARG A 100 13.941 -1.732 -3.287 1.00 0.00 H new ATOM 0 HH11 ARG A 100 13.546 -4.875 -4.871 1.00 0.00 H new ATOM 0 HH12 ARG A 100 15.272 -5.249 -4.818 1.00 0.00 H new ATOM 0 HH21 ARG A 100 16.139 -2.233 -3.170 1.00 0.00 H new ATOM 0 HH22 ARG A 100 16.744 -3.747 -3.851 1.00 0.00 H new ATOM 1218 N THR A 101 9.299 -3.217 -0.112 1.00 0.00 N ATOM 1219 CA THR A 101 8.100 -3.995 -0.055 1.00 0.00 C ATOM 1220 C THR A 101 7.022 -3.268 0.745 1.00 0.00 C ATOM 1221 O THR A 101 5.911 -3.093 0.261 1.00 0.00 O ATOM 1222 CB THR A 101 8.376 -5.372 0.563 1.00 0.00 C ATOM 1223 OG1 THR A 101 9.484 -5.976 -0.120 1.00 0.00 O ATOM 1224 CG2 THR A 101 7.157 -6.274 0.422 1.00 0.00 C ATOM 0 H THR A 101 10.085 -3.612 0.405 1.00 0.00 H new ATOM 0 HA THR A 101 7.741 -4.136 -1.075 1.00 0.00 H new ATOM 0 HB THR A 101 8.603 -5.246 1.622 1.00 0.00 H new ATOM 0 HG1 THR A 101 10.323 -5.616 0.236 1.00 0.00 H new ATOM 0 HG21 THR A 101 7.371 -7.246 0.866 1.00 0.00 H new ATOM 0 HG22 THR A 101 6.308 -5.821 0.933 1.00 0.00 H new ATOM 0 HG23 THR A 101 6.919 -6.401 -0.634 1.00 0.00 H new ATOM 1232 N ARG A 102 7.367 -2.788 1.937 1.00 0.00 N ATOM 1233 CA ARG A 102 6.381 -2.146 2.795 1.00 0.00 C ATOM 1234 C ARG A 102 5.862 -0.846 2.217 1.00 0.00 C ATOM 1235 O ARG A 102 4.677 -0.571 2.309 1.00 0.00 O ATOM 1236 CB ARG A 102 6.865 -1.959 4.225 1.00 0.00 C ATOM 1237 CG ARG A 102 7.099 -3.256 4.975 1.00 0.00 C ATOM 1238 CD ARG A 102 7.479 -2.998 6.420 1.00 0.00 C ATOM 1239 NE ARG A 102 6.390 -2.373 7.204 1.00 0.00 N ATOM 1240 CZ ARG A 102 6.552 -1.370 8.085 1.00 0.00 C ATOM 1241 NH1 ARG A 102 7.727 -0.766 8.207 1.00 0.00 N ATOM 1242 NH2 ARG A 102 5.519 -0.956 8.817 1.00 0.00 N ATOM 0 H ARG A 102 8.309 -2.831 2.325 1.00 0.00 H new ATOM 0 HA ARG A 102 5.542 -2.841 2.835 1.00 0.00 H new ATOM 0 HB2 ARG A 102 7.793 -1.388 4.211 1.00 0.00 H new ATOM 0 HB3 ARG A 102 6.132 -1.364 4.770 1.00 0.00 H new ATOM 0 HG2 ARG A 102 6.197 -3.867 4.938 1.00 0.00 H new ATOM 0 HG3 ARG A 102 7.890 -3.824 4.485 1.00 0.00 H new ATOM 0 HD2 ARG A 102 7.762 -3.941 6.889 1.00 0.00 H new ATOM 0 HD3 ARG A 102 8.356 -2.352 6.449 1.00 0.00 H new ATOM 0 HE ARG A 102 5.445 -2.730 7.065 1.00 0.00 H new ATOM 0 HH11 ARG A 102 8.515 -1.062 7.630 1.00 0.00 H new ATOM 0 HH12 ARG A 102 7.843 -0.006 8.877 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.607 -1.400 8.709 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.640 -0.195 9.486 1.00 0.00 H new ATOM 1256 N LYS A 103 6.727 -0.059 1.607 1.00 0.00 N ATOM 1257 CA LYS A 103 6.296 1.175 0.980 1.00 0.00 C ATOM 1258 C LYS A 103 5.369 0.872 -0.194 1.00 0.00 C ATOM 1259 O LYS A 103 4.387 1.567 -0.409 1.00 0.00 O ATOM 1260 CB LYS A 103 7.476 2.064 0.547 1.00 0.00 C ATOM 1261 CG LYS A 103 7.055 3.442 0.019 1.00 0.00 C ATOM 1262 CD LYS A 103 6.290 4.253 1.078 1.00 0.00 C ATOM 1263 CE LYS A 103 7.170 4.659 2.253 1.00 0.00 C ATOM 1264 NZ LYS A 103 6.388 5.271 3.344 1.00 0.00 N ATOM 0 H LYS A 103 7.726 -0.250 1.532 1.00 0.00 H new ATOM 0 HA LYS A 103 5.744 1.746 1.727 1.00 0.00 H new ATOM 0 HB2 LYS A 103 8.146 2.200 1.396 1.00 0.00 H new ATOM 0 HB3 LYS A 103 8.043 1.547 -0.227 1.00 0.00 H new ATOM 0 HG2 LYS A 103 7.940 3.997 -0.294 1.00 0.00 H new ATOM 0 HG3 LYS A 103 6.429 3.316 -0.864 1.00 0.00 H new ATOM 0 HD2 LYS A 103 5.874 5.147 0.615 1.00 0.00 H new ATOM 0 HD3 LYS A 103 5.450 3.663 1.445 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.696 3.783 2.632 1.00 0.00 H new ATOM 0 HE3 LYS A 103 7.929 5.363 1.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 6.995 5.921 3.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 5.586 5.798 2.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 6.031 4.526 3.976 1.00 0.00 H new ATOM 1278 N LYS A 104 5.690 -0.182 -0.941 1.00 0.00 N ATOM 1279 CA LYS A 104 4.872 -0.608 -2.073 1.00 0.00 C ATOM 1280 C LYS A 104 3.477 -0.999 -1.545 1.00 0.00 C ATOM 1281 O LYS A 104 2.454 -0.721 -2.171 1.00 0.00 O ATOM 1282 CB LYS A 104 5.554 -1.806 -2.770 1.00 0.00 C ATOM 1283 CG LYS A 104 5.299 -1.943 -4.276 1.00 0.00 C ATOM 1284 CD LYS A 104 3.858 -2.265 -4.652 1.00 0.00 C ATOM 1285 CE LYS A 104 3.739 -2.328 -6.165 1.00 0.00 C ATOM 1286 NZ LYS A 104 2.418 -2.777 -6.647 1.00 0.00 N ATOM 0 H LYS A 104 6.516 -0.759 -0.781 1.00 0.00 H new ATOM 0 HA LYS A 104 4.766 0.197 -2.800 1.00 0.00 H new ATOM 0 HB2 LYS A 104 6.629 -1.730 -2.609 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.223 -2.722 -2.281 1.00 0.00 H new ATOM 0 HG2 LYS A 104 5.589 -1.013 -4.766 1.00 0.00 H new ATOM 0 HG3 LYS A 104 5.947 -2.726 -4.670 1.00 0.00 H new ATOM 0 HD2 LYS A 104 3.559 -3.216 -4.212 1.00 0.00 H new ATOM 0 HD3 LYS A 104 3.187 -1.504 -4.254 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.948 -1.341 -6.577 1.00 0.00 H new ATOM 0 HE3 LYS A 104 4.503 -3.002 -6.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 2.503 -3.117 -7.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 2.071 -3.548 -6.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 1.748 -1.982 -6.614 1.00 0.00 H new ATOM 1300 N LEU A 105 3.461 -1.606 -0.367 1.00 0.00 N ATOM 1301 CA LEU A 105 2.229 -1.994 0.301 1.00 0.00 C ATOM 1302 C LEU A 105 1.458 -0.771 0.706 1.00 0.00 C ATOM 1303 O LEU A 105 0.233 -0.707 0.528 1.00 0.00 O ATOM 1304 CB LEU A 105 2.532 -2.795 1.545 1.00 0.00 C ATOM 1305 CG LEU A 105 3.348 -4.053 1.383 1.00 0.00 C ATOM 1306 CD1 LEU A 105 3.521 -4.694 2.718 1.00 0.00 C ATOM 1307 CD2 LEU A 105 2.706 -4.998 0.380 1.00 0.00 C ATOM 0 H LEU A 105 4.305 -1.844 0.153 1.00 0.00 H new ATOM 0 HA LEU A 105 1.644 -2.597 -0.393 1.00 0.00 H new ATOM 0 HB2 LEU A 105 3.054 -2.143 2.245 1.00 0.00 H new ATOM 0 HB3 LEU A 105 1.584 -3.067 2.009 1.00 0.00 H new ATOM 0 HG LEU A 105 4.331 -3.801 0.985 1.00 0.00 H new ATOM 0 HD11 LEU A 105 4.110 -5.605 2.611 1.00 0.00 H new ATOM 0 HD12 LEU A 105 4.036 -4.006 3.388 1.00 0.00 H new ATOM 0 HD13 LEU A 105 2.544 -4.941 3.133 1.00 0.00 H new ATOM 0 HD21 LEU A 105 3.316 -5.896 0.284 1.00 0.00 H new ATOM 0 HD22 LEU A 105 1.709 -5.272 0.725 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.632 -4.504 -0.589 1.00 0.00 H new ATOM 1319 N GLU A 106 2.179 0.205 1.242 1.00 0.00 N ATOM 1320 CA GLU A 106 1.597 1.457 1.644 1.00 0.00 C ATOM 1321 C GLU A 106 0.975 2.147 0.470 1.00 0.00 C ATOM 1322 O GLU A 106 -0.072 2.763 0.593 1.00 0.00 O ATOM 1323 CB GLU A 106 2.619 2.387 2.252 1.00 0.00 C ATOM 1324 CG GLU A 106 3.269 1.895 3.510 1.00 0.00 C ATOM 1325 CD GLU A 106 3.900 3.036 4.245 1.00 0.00 C ATOM 1326 OE1 GLU A 106 3.160 3.935 4.715 1.00 0.00 O ATOM 1327 OE2 GLU A 106 5.137 3.104 4.335 1.00 0.00 O ATOM 0 H GLU A 106 3.184 0.141 1.406 1.00 0.00 H new ATOM 0 HA GLU A 106 0.841 1.223 2.394 1.00 0.00 H new ATOM 0 HB2 GLU A 106 3.397 2.578 1.512 1.00 0.00 H new ATOM 0 HB3 GLU A 106 2.137 3.342 2.462 1.00 0.00 H new ATOM 0 HG2 GLU A 106 2.528 1.409 4.145 1.00 0.00 H new ATOM 0 HG3 GLU A 106 4.023 1.146 3.269 1.00 0.00 H new ATOM 1334 N GLU A 107 1.626 2.037 -0.657 1.00 0.00 N ATOM 1335 CA GLU A 107 1.158 2.630 -1.869 1.00 0.00 C ATOM 1336 C GLU A 107 -0.084 1.971 -2.409 1.00 0.00 C ATOM 1337 O GLU A 107 -0.972 2.666 -2.904 1.00 0.00 O ATOM 1338 CB GLU A 107 2.252 2.725 -2.900 1.00 0.00 C ATOM 1339 CG GLU A 107 3.253 3.817 -2.574 1.00 0.00 C ATOM 1340 CD GLU A 107 2.567 5.169 -2.390 1.00 0.00 C ATOM 1341 OE1 GLU A 107 2.200 5.802 -3.408 1.00 0.00 O ATOM 1342 OE2 GLU A 107 2.374 5.616 -1.233 1.00 0.00 O ATOM 0 H GLU A 107 2.504 1.527 -0.755 1.00 0.00 H new ATOM 0 HA GLU A 107 0.862 3.649 -1.618 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.770 1.768 -2.967 1.00 0.00 H new ATOM 0 HB3 GLU A 107 1.811 2.918 -3.878 1.00 0.00 H new ATOM 0 HG2 GLU A 107 3.794 3.556 -1.665 1.00 0.00 H new ATOM 0 HG3 GLU A 107 3.990 3.888 -3.374 1.00 0.00 H new ATOM 1349 N GLU A 108 -0.172 0.648 -2.326 1.00 0.00 N ATOM 1350 CA GLU A 108 -1.389 -0.035 -2.699 1.00 0.00 C ATOM 1351 C GLU A 108 -2.515 0.373 -1.752 1.00 0.00 C ATOM 1352 O GLU A 108 -3.646 0.608 -2.178 1.00 0.00 O ATOM 1353 CB GLU A 108 -1.187 -1.533 -2.671 1.00 0.00 C ATOM 1354 CG GLU A 108 -0.133 -2.019 -3.641 1.00 0.00 C ATOM 1355 CD GLU A 108 -0.448 -1.660 -5.075 1.00 0.00 C ATOM 1356 OE1 GLU A 108 -1.613 -1.820 -5.497 1.00 0.00 O ATOM 1357 OE2 GLU A 108 0.465 -1.229 -5.796 1.00 0.00 O ATOM 0 H GLU A 108 0.581 0.039 -2.006 1.00 0.00 H new ATOM 0 HA GLU A 108 -1.660 0.249 -3.716 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.907 -1.835 -1.662 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -2.133 -2.023 -2.900 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.831 -1.591 -3.367 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.037 -3.101 -3.555 1.00 0.00 H new ATOM 1364 N ARG A 109 -2.178 0.490 -0.468 1.00 0.00 N ATOM 1365 CA ARG A 109 -3.116 0.948 0.554 1.00 0.00 C ATOM 1366 C ARG A 109 -3.577 2.358 0.208 1.00 0.00 C ATOM 1367 O ARG A 109 -4.749 2.656 0.226 1.00 0.00 O ATOM 1368 CB ARG A 109 -2.399 0.989 1.916 1.00 0.00 C ATOM 1369 CG ARG A 109 -3.209 1.590 3.066 1.00 0.00 C ATOM 1370 CD ARG A 109 -2.290 2.016 4.212 1.00 0.00 C ATOM 1371 NE ARG A 109 -1.336 3.069 3.768 1.00 0.00 N ATOM 1372 CZ ARG A 109 -0.185 3.403 4.390 1.00 0.00 C ATOM 1373 NH1 ARG A 109 0.143 2.877 5.569 1.00 0.00 N ATOM 1374 NH2 ARG A 109 0.632 4.299 3.832 1.00 0.00 N ATOM 0 H ARG A 109 -1.249 0.270 -0.109 1.00 0.00 H new ATOM 0 HA ARG A 109 -3.969 0.271 0.599 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -2.113 -0.027 2.188 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -1.478 1.561 1.805 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -3.774 2.450 2.708 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -3.934 0.860 3.427 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -2.888 2.389 5.043 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -1.737 1.152 4.580 1.00 0.00 H new ATOM 0 HE ARG A 109 -1.573 3.583 2.920 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -0.481 2.207 6.020 1.00 0.00 H new ATOM 0 HH12 ARG A 109 1.018 3.144 6.021 1.00 0.00 H new ATOM 0 HH21 ARG A 109 0.386 4.728 2.940 1.00 0.00 H new ATOM 0 HH22 ARG A 109 1.503 4.555 4.298 1.00 0.00 H new ATOM 1388 N HIS A 110 -2.623 3.183 -0.154 1.00 0.00 N ATOM 1389 CA HIS A 110 -2.829 4.574 -0.511 1.00 0.00 C ATOM 1390 C HIS A 110 -3.722 4.681 -1.752 1.00 0.00 C ATOM 1391 O HIS A 110 -4.638 5.514 -1.802 1.00 0.00 O ATOM 1392 CB HIS A 110 -1.450 5.217 -0.750 1.00 0.00 C ATOM 1393 CG HIS A 110 -1.444 6.661 -1.113 1.00 0.00 C ATOM 1394 ND1 HIS A 110 -0.368 7.291 -1.680 1.00 0.00 N ATOM 1395 CD2 HIS A 110 -2.403 7.602 -0.977 1.00 0.00 C ATOM 1396 CE1 HIS A 110 -0.693 8.562 -1.873 1.00 0.00 C ATOM 1397 NE2 HIS A 110 -1.934 8.808 -1.460 1.00 0.00 N ATOM 0 H HIS A 110 -1.645 2.897 -0.211 1.00 0.00 H new ATOM 0 HA HIS A 110 -3.339 5.102 0.295 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -0.853 5.090 0.153 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -0.949 4.664 -1.544 1.00 0.00 H new ATOM 0 HD1 HIS A 110 0.526 6.859 -1.913 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -3.384 7.437 -0.556 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -0.037 9.301 -2.308 1.00 0.00 H new ATOM 1405 N ASN A 111 -3.457 3.826 -2.719 1.00 0.00 N ATOM 1406 CA ASN A 111 -4.230 3.756 -3.945 1.00 0.00 C ATOM 1407 C ASN A 111 -5.679 3.430 -3.620 1.00 0.00 C ATOM 1408 O ASN A 111 -6.597 4.031 -4.169 1.00 0.00 O ATOM 1409 CB ASN A 111 -3.624 2.702 -4.887 1.00 0.00 C ATOM 1410 CG ASN A 111 -4.357 2.533 -6.218 1.00 0.00 C ATOM 1411 OD1 ASN A 111 -4.359 1.447 -6.788 1.00 0.00 O ATOM 1412 ND2 ASN A 111 -4.935 3.581 -6.740 1.00 0.00 N ATOM 0 H ASN A 111 -2.692 3.153 -2.677 1.00 0.00 H new ATOM 0 HA ASN A 111 -4.200 4.721 -4.451 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -2.588 2.971 -5.091 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -3.609 1.741 -4.372 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -5.403 3.508 -7.643 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -4.918 4.472 -6.244 1.00 0.00 H new ATOM 1419 N LEU A 112 -5.876 2.520 -2.698 1.00 0.00 N ATOM 1420 CA LEU A 112 -7.207 2.183 -2.272 1.00 0.00 C ATOM 1421 C LEU A 112 -7.830 3.305 -1.448 1.00 0.00 C ATOM 1422 O LEU A 112 -9.009 3.584 -1.593 1.00 0.00 O ATOM 1423 CB LEU A 112 -7.243 0.875 -1.510 1.00 0.00 C ATOM 1424 CG LEU A 112 -6.812 -0.375 -2.264 1.00 0.00 C ATOM 1425 CD1 LEU A 112 -7.124 -1.595 -1.442 1.00 0.00 C ATOM 1426 CD2 LEU A 112 -7.491 -0.463 -3.612 1.00 0.00 C ATOM 0 H LEU A 112 -5.132 2.002 -2.231 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.804 2.055 -3.175 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.606 0.977 -0.631 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.260 0.720 -1.150 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.737 -0.320 -2.436 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.814 -2.488 -1.985 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.588 -1.542 -0.494 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.196 -1.640 -1.251 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.163 -1.366 -4.126 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.572 -0.497 -3.474 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.229 0.410 -4.209 1.00 0.00 H new ATOM 1438 N ILE A 113 -7.027 3.957 -0.593 1.00 0.00 N ATOM 1439 CA ILE A 113 -7.515 5.090 0.202 1.00 0.00 C ATOM 1440 C ILE A 113 -8.064 6.180 -0.700 1.00 0.00 C ATOM 1441 O ILE A 113 -9.199 6.578 -0.543 1.00 0.00 O ATOM 1442 CB ILE A 113 -6.408 5.734 1.095 1.00 0.00 C ATOM 1443 CG1 ILE A 113 -5.838 4.736 2.116 1.00 0.00 C ATOM 1444 CG2 ILE A 113 -6.967 6.958 1.815 1.00 0.00 C ATOM 1445 CD1 ILE A 113 -6.850 4.185 3.094 1.00 0.00 C ATOM 0 H ILE A 113 -6.047 3.721 -0.437 1.00 0.00 H new ATOM 0 HA ILE A 113 -8.292 4.680 0.847 1.00 0.00 H new ATOM 0 HB ILE A 113 -5.590 6.035 0.440 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -5.384 3.905 1.577 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -5.041 5.225 2.676 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -6.189 7.402 2.436 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.306 7.689 1.081 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.806 6.659 2.443 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.358 3.490 3.775 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -7.287 5.004 3.665 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -7.636 3.663 2.549 1.00 0.00 H new ATOM 1457 N THR A 114 -7.296 6.584 -1.698 1.00 0.00 N ATOM 1458 CA THR A 114 -7.713 7.665 -2.574 1.00 0.00 C ATOM 1459 C THR A 114 -8.960 7.262 -3.384 1.00 0.00 C ATOM 1460 O THR A 114 -9.865 8.079 -3.617 1.00 0.00 O ATOM 1461 CB THR A 114 -6.540 8.176 -3.490 1.00 0.00 C ATOM 1462 OG1 THR A 114 -6.921 9.356 -4.220 1.00 0.00 O ATOM 1463 CG2 THR A 114 -6.073 7.115 -4.475 1.00 0.00 C ATOM 0 H THR A 114 -6.385 6.182 -1.921 1.00 0.00 H new ATOM 0 HA THR A 114 -7.990 8.512 -1.946 1.00 0.00 H new ATOM 0 HB THR A 114 -5.715 8.413 -2.818 1.00 0.00 H new ATOM 0 HG1 THR A 114 -6.172 9.651 -4.779 1.00 0.00 H new ATOM 0 HG21 THR A 114 -5.263 7.516 -5.084 1.00 0.00 H new ATOM 0 HG22 THR A 114 -5.718 6.242 -3.928 1.00 0.00 H new ATOM 0 HG23 THR A 114 -6.903 6.826 -5.120 1.00 0.00 H new ATOM 1471 N GLU A 115 -9.025 5.992 -3.745 1.00 0.00 N ATOM 1472 CA GLU A 115 -10.134 5.469 -4.500 1.00 0.00 C ATOM 1473 C GLU A 115 -11.391 5.423 -3.616 1.00 0.00 C ATOM 1474 O GLU A 115 -12.443 5.927 -3.997 1.00 0.00 O ATOM 1475 CB GLU A 115 -9.784 4.082 -5.054 1.00 0.00 C ATOM 1476 CG GLU A 115 -10.766 3.549 -6.081 1.00 0.00 C ATOM 1477 CD GLU A 115 -10.355 2.207 -6.644 1.00 0.00 C ATOM 1478 OE1 GLU A 115 -9.269 2.103 -7.263 1.00 0.00 O ATOM 1479 OE2 GLU A 115 -11.131 1.244 -6.543 1.00 0.00 O ATOM 0 H GLU A 115 -8.309 5.301 -3.520 1.00 0.00 H new ATOM 0 HA GLU A 115 -10.341 6.124 -5.347 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.793 4.124 -5.505 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -9.727 3.377 -4.225 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -11.751 3.459 -5.623 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -10.858 4.267 -6.896 1.00 0.00 H new ATOM 1486 N MET A 116 -11.254 4.889 -2.406 1.00 0.00 N ATOM 1487 CA MET A 116 -12.380 4.771 -1.487 1.00 0.00 C ATOM 1488 C MET A 116 -12.840 6.136 -0.981 1.00 0.00 C ATOM 1489 O MET A 116 -14.024 6.352 -0.785 1.00 0.00 O ATOM 1490 CB MET A 116 -12.084 3.819 -0.323 1.00 0.00 C ATOM 1491 CG MET A 116 -13.289 3.596 0.587 1.00 0.00 C ATOM 1492 SD MET A 116 -12.967 2.463 1.941 1.00 0.00 S ATOM 1493 CE MET A 116 -14.551 2.510 2.787 1.00 0.00 C ATOM 0 H MET A 116 -10.372 4.531 -2.039 1.00 0.00 H new ATOM 0 HA MET A 116 -13.200 4.334 -2.056 1.00 0.00 H new ATOM 0 HB2 MET A 116 -11.754 2.859 -0.721 1.00 0.00 H new ATOM 0 HB3 MET A 116 -11.260 4.220 0.267 1.00 0.00 H new ATOM 0 HG2 MET A 116 -13.608 4.555 0.995 1.00 0.00 H new ATOM 0 HG3 MET A 116 -14.117 3.211 -0.008 1.00 0.00 H new ATOM 0 HE1 MET A 116 -14.414 2.231 3.832 1.00 0.00 H new ATOM 0 HE2 MET A 116 -14.963 3.517 2.731 1.00 0.00 H new ATOM 0 HE3 MET A 116 -15.238 1.810 2.312 1.00 0.00 H new ATOM 1503 N VAL A 117 -11.902 7.055 -0.795 1.00 0.00 N ATOM 1504 CA VAL A 117 -12.218 8.430 -0.410 1.00 0.00 C ATOM 1505 C VAL A 117 -13.063 9.105 -1.515 1.00 0.00 C ATOM 1506 O VAL A 117 -13.946 9.935 -1.232 1.00 0.00 O ATOM 1507 CB VAL A 117 -10.911 9.249 -0.080 1.00 0.00 C ATOM 1508 CG1 VAL A 117 -11.174 10.726 0.043 1.00 0.00 C ATOM 1509 CG2 VAL A 117 -10.310 8.779 1.229 1.00 0.00 C ATOM 0 H VAL A 117 -10.904 6.873 -0.905 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.811 8.411 0.505 1.00 0.00 H new ATOM 0 HB VAL A 117 -10.227 9.078 -0.911 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.242 11.244 0.271 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.578 11.103 -0.896 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -11.892 10.902 0.844 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.409 9.354 1.443 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.032 8.923 2.033 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.057 7.722 1.154 1.00 0.00 H new ATOM 1519 N ALA A 118 -12.787 8.741 -2.762 1.00 0.00 N ATOM 1520 CA ALA A 118 -13.555 9.226 -3.897 1.00 0.00 C ATOM 1521 C ALA A 118 -14.929 8.544 -3.952 1.00 0.00 C ATOM 1522 O ALA A 118 -15.953 9.193 -4.195 1.00 0.00 O ATOM 1523 CB ALA A 118 -12.802 8.998 -5.193 1.00 0.00 C ATOM 0 H ALA A 118 -12.029 8.105 -3.011 1.00 0.00 H new ATOM 0 HA ALA A 118 -13.705 10.298 -3.770 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -13.396 9.369 -6.029 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.851 9.529 -5.160 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -12.617 7.932 -5.324 1.00 0.00 H new ATOM 1529 N LEU A 119 -14.941 7.241 -3.723 1.00 0.00 N ATOM 1530 CA LEU A 119 -16.172 6.442 -3.744 1.00 0.00 C ATOM 1531 C LEU A 119 -17.107 6.821 -2.606 1.00 0.00 C ATOM 1532 O LEU A 119 -18.311 6.926 -2.789 1.00 0.00 O ATOM 1533 CB LEU A 119 -15.847 4.947 -3.657 1.00 0.00 C ATOM 1534 CG LEU A 119 -15.013 4.365 -4.797 1.00 0.00 C ATOM 1535 CD1 LEU A 119 -14.688 2.910 -4.520 1.00 0.00 C ATOM 1536 CD2 LEU A 119 -15.745 4.500 -6.121 1.00 0.00 C ATOM 0 H LEU A 119 -14.101 6.700 -3.516 1.00 0.00 H new ATOM 0 HA LEU A 119 -16.674 6.652 -4.688 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -15.319 4.766 -2.721 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -16.786 4.396 -3.605 1.00 0.00 H new ATOM 0 HG LEU A 119 -14.081 4.926 -4.863 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -14.093 2.507 -5.340 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -14.123 2.834 -3.591 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -15.613 2.341 -4.430 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -15.134 4.079 -6.919 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -16.693 3.964 -6.069 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -15.935 5.554 -6.326 1.00 0.00 H new ATOM 1548 N ASN A 120 -16.553 7.023 -1.447 1.00 0.00 N ATOM 1549 CA ASN A 120 -17.333 7.362 -0.280 1.00 0.00 C ATOM 1550 C ASN A 120 -16.747 8.585 0.394 1.00 0.00 C ATOM 1551 O ASN A 120 -15.649 8.528 0.947 1.00 0.00 O ATOM 1552 CB ASN A 120 -17.354 6.195 0.716 1.00 0.00 C ATOM 1553 CG ASN A 120 -18.233 6.449 1.932 1.00 0.00 C ATOM 1554 OD1 ASN A 120 -19.229 7.177 1.864 1.00 0.00 O ATOM 1555 ND2 ASN A 120 -17.894 5.846 3.040 1.00 0.00 N ATOM 0 H ASN A 120 -15.549 6.959 -1.278 1.00 0.00 H new ATOM 0 HA ASN A 120 -18.354 7.572 -0.600 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -17.705 5.298 0.205 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -16.336 5.994 1.049 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -18.458 5.970 3.881 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -17.066 5.251 3.064 1.00 0.00 H new ATOM 1562 N PRO A 121 -17.457 9.712 0.366 1.00 0.00 N ATOM 1563 CA PRO A 121 -16.993 10.962 0.997 1.00 0.00 C ATOM 1564 C PRO A 121 -16.972 10.849 2.528 1.00 0.00 C ATOM 1565 O PRO A 121 -16.260 11.584 3.220 1.00 0.00 O ATOM 1566 CB PRO A 121 -18.049 11.982 0.559 1.00 0.00 C ATOM 1567 CG PRO A 121 -19.264 11.158 0.303 1.00 0.00 C ATOM 1568 CD PRO A 121 -18.767 9.890 -0.298 1.00 0.00 C ATOM 0 HA PRO A 121 -15.976 11.224 0.706 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -18.229 12.728 1.333 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -17.736 12.521 -0.336 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -19.810 10.967 1.227 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -19.950 11.670 -0.372 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -19.440 9.056 -0.099 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -18.666 9.966 -1.381 1.00 0.00 H new ATOM 1576 N ASP A 122 -17.710 9.877 3.025 1.00 0.00 N ATOM 1577 CA ASP A 122 -17.875 9.640 4.456 1.00 0.00 C ATOM 1578 C ASP A 122 -16.795 8.665 4.954 1.00 0.00 C ATOM 1579 O ASP A 122 -16.816 8.212 6.081 1.00 0.00 O ATOM 1580 CB ASP A 122 -19.287 9.065 4.705 1.00 0.00 C ATOM 1581 CG ASP A 122 -19.682 8.973 6.171 1.00 0.00 C ATOM 1582 OD1 ASP A 122 -19.441 7.942 6.814 1.00 0.00 O ATOM 1583 OD2 ASP A 122 -20.279 9.928 6.691 1.00 0.00 O ATOM 0 H ASP A 122 -18.223 9.216 2.442 1.00 0.00 H new ATOM 0 HA ASP A 122 -17.766 10.575 5.005 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -20.015 9.686 4.184 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -19.343 8.070 4.264 1.00 0.00 H new ATOM 1588 N PHE A 123 -15.849 8.359 4.105 1.00 0.00 N ATOM 1589 CA PHE A 123 -14.797 7.436 4.458 1.00 0.00 C ATOM 1590 C PHE A 123 -13.726 8.092 5.349 1.00 0.00 C ATOM 1591 O PHE A 123 -13.225 9.182 5.047 1.00 0.00 O ATOM 1592 CB PHE A 123 -14.175 6.813 3.196 1.00 0.00 C ATOM 1593 CG PHE A 123 -12.956 5.979 3.452 1.00 0.00 C ATOM 1594 CD1 PHE A 123 -12.924 5.066 4.482 1.00 0.00 C ATOM 1595 CD2 PHE A 123 -11.838 6.142 2.679 1.00 0.00 C ATOM 1596 CE1 PHE A 123 -11.805 4.330 4.735 1.00 0.00 C ATOM 1597 CE2 PHE A 123 -10.705 5.413 2.911 1.00 0.00 C ATOM 1598 CZ PHE A 123 -10.678 4.498 3.949 1.00 0.00 C ATOM 0 H PHE A 123 -15.784 8.736 3.160 1.00 0.00 H new ATOM 0 HA PHE A 123 -15.246 6.636 5.047 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -14.926 6.195 2.703 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -13.914 7.612 2.502 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -13.800 4.931 5.099 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -11.851 6.859 1.872 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -11.798 3.618 5.547 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.834 5.551 2.287 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.786 3.921 4.144 1.00 0.00 H new ATOM 1608 N LYS A 124 -13.417 7.427 6.456 1.00 0.00 N ATOM 1609 CA LYS A 124 -12.354 7.832 7.362 1.00 0.00 C ATOM 1610 C LYS A 124 -11.237 6.813 7.244 1.00 0.00 C ATOM 1611 O LYS A 124 -11.417 5.658 7.625 1.00 0.00 O ATOM 1612 CB LYS A 124 -12.810 7.907 8.850 1.00 0.00 C ATOM 1613 CG LYS A 124 -13.830 8.997 9.183 1.00 0.00 C ATOM 1614 CD LYS A 124 -15.189 8.727 8.575 1.00 0.00 C ATOM 1615 CE LYS A 124 -15.902 7.556 9.234 1.00 0.00 C ATOM 1616 NZ LYS A 124 -17.278 7.384 8.711 1.00 0.00 N ATOM 0 H LYS A 124 -13.905 6.581 6.751 1.00 0.00 H new ATOM 0 HA LYS A 124 -12.035 8.835 7.079 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -13.234 6.942 9.129 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -11.928 8.059 9.473 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -13.930 9.078 10.265 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -13.460 9.958 8.825 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -15.807 9.621 8.664 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -15.073 8.524 7.510 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -15.332 6.642 9.065 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -15.940 7.714 10.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -17.556 6.385 8.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -17.935 7.970 9.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -17.309 7.677 7.714 1.00 0.00 H new ATOM 1630 N PRO A 125 -10.098 7.195 6.681 1.00 0.00 N ATOM 1631 CA PRO A 125 -8.982 6.275 6.492 1.00 0.00 C ATOM 1632 C PRO A 125 -8.326 5.846 7.824 1.00 0.00 C ATOM 1633 O PRO A 125 -8.458 6.542 8.851 1.00 0.00 O ATOM 1634 CB PRO A 125 -8.005 7.072 5.624 1.00 0.00 C ATOM 1635 CG PRO A 125 -8.325 8.497 5.890 1.00 0.00 C ATOM 1636 CD PRO A 125 -9.797 8.549 6.177 1.00 0.00 C ATOM 0 HA PRO A 125 -9.301 5.338 6.037 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -6.971 6.845 5.884 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -8.128 6.831 4.568 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -7.750 8.874 6.736 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -8.074 9.119 5.031 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -10.035 9.314 6.916 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -10.373 8.781 5.281 1.00 0.00 H new ATOM 1644 N PRO A 126 -7.652 4.677 7.833 1.00 0.00 N ATOM 1645 CA PRO A 126 -6.959 4.148 9.021 1.00 0.00 C ATOM 1646 C PRO A 126 -5.838 5.084 9.516 1.00 0.00 C ATOM 1647 O PRO A 126 -5.223 5.820 8.725 1.00 0.00 O ATOM 1648 CB PRO A 126 -6.355 2.823 8.513 1.00 0.00 C ATOM 1649 CG PRO A 126 -6.303 2.981 7.041 1.00 0.00 C ATOM 1650 CD PRO A 126 -7.530 3.753 6.694 1.00 0.00 C ATOM 0 HA PRO A 126 -7.634 4.037 9.869 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -5.362 2.654 8.930 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -6.971 1.970 8.799 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -5.402 3.511 6.732 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -6.290 2.013 6.540 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -7.422 4.285 5.749 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -8.403 3.108 6.599 1.00 0.00 H new ATOM 1658 N ALA A 127 -5.566 5.035 10.811 1.00 0.00 N ATOM 1659 CA ALA A 127 -4.551 5.882 11.454 1.00 0.00 C ATOM 1660 C ALA A 127 -3.120 5.518 11.029 1.00 0.00 C ATOM 1661 O ALA A 127 -2.173 6.286 11.253 1.00 0.00 O ATOM 1662 CB ALA A 127 -4.699 5.824 12.966 1.00 0.00 C ATOM 0 H ALA A 127 -6.042 4.405 11.457 1.00 0.00 H new ATOM 0 HA ALA A 127 -4.723 6.904 11.117 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -3.941 6.455 13.430 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.690 6.179 13.248 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -4.572 4.796 13.305 1.00 0.00 H new ATOM 1668 N ASP A 128 -2.962 4.359 10.421 1.00 0.00 N ATOM 1669 CA ASP A 128 -1.651 3.918 9.931 1.00 0.00 C ATOM 1670 C ASP A 128 -1.363 4.563 8.573 1.00 0.00 C ATOM 1671 O ASP A 128 -0.205 4.674 8.138 1.00 0.00 O ATOM 1672 CB ASP A 128 -1.640 2.381 9.797 1.00 0.00 C ATOM 1673 CG ASP A 128 -0.335 1.819 9.257 1.00 0.00 C ATOM 1674 OD1 ASP A 128 -0.191 1.685 8.024 1.00 0.00 O ATOM 1675 OD2 ASP A 128 0.568 1.504 10.058 1.00 0.00 O ATOM 0 H ASP A 128 -3.720 3.698 10.250 1.00 0.00 H new ATOM 0 HA ASP A 128 -0.879 4.221 10.639 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -1.838 1.940 10.774 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -2.455 2.078 9.139 1.00 0.00 H new ATOM 1680 N TYR A 129 -2.409 5.081 7.955 1.00 0.00 N ATOM 1681 CA TYR A 129 -2.289 5.723 6.671 1.00 0.00 C ATOM 1682 C TYR A 129 -1.687 7.091 6.807 1.00 0.00 C ATOM 1683 O TYR A 129 -2.184 7.946 7.550 1.00 0.00 O ATOM 1684 CB TYR A 129 -3.636 5.788 5.929 1.00 0.00 C ATOM 1685 CG TYR A 129 -3.661 6.728 4.717 1.00 0.00 C ATOM 1686 CD1 TYR A 129 -2.768 6.586 3.656 1.00 0.00 C ATOM 1687 CD2 TYR A 129 -4.604 7.742 4.638 1.00 0.00 C ATOM 1688 CE1 TYR A 129 -2.816 7.440 2.567 1.00 0.00 C ATOM 1689 CE2 TYR A 129 -4.657 8.595 3.555 1.00 0.00 C ATOM 1690 CZ TYR A 129 -3.766 8.441 2.522 1.00 0.00 C ATOM 1691 OH TYR A 129 -3.815 9.306 1.441 1.00 0.00 O ATOM 0 H TYR A 129 -3.357 5.066 8.331 1.00 0.00 H new ATOM 0 HA TYR A 129 -1.618 5.111 6.069 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -3.900 4.784 5.597 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -4.407 6.105 6.632 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -2.029 5.799 3.684 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -5.313 7.867 5.443 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -2.113 7.323 1.756 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -5.397 9.381 3.520 1.00 0.00 H new ATOM 0 HH TYR A 129 -4.543 9.949 1.569 1.00 0.00 H new ATOM 1701 N LYS A 130 -0.617 7.278 6.109 1.00 0.00 N ATOM 1702 CA LYS A 130 0.048 8.526 6.052 1.00 0.00 C ATOM 1703 C LYS A 130 -0.270 9.176 4.726 1.00 0.00 C ATOM 1704 O LYS A 130 -0.041 8.561 3.673 1.00 0.00 O ATOM 1705 CB LYS A 130 1.550 8.323 6.152 1.00 0.00 C ATOM 1706 CG LYS A 130 2.035 7.670 7.446 1.00 0.00 C ATOM 1707 CD LYS A 130 1.698 8.491 8.690 1.00 0.00 C ATOM 1708 CE LYS A 130 2.365 9.859 8.671 1.00 0.00 C ATOM 1709 NZ LYS A 130 2.089 10.627 9.898 1.00 0.00 N ATOM 0 H LYS A 130 -0.175 6.547 5.551 1.00 0.00 H new ATOM 0 HA LYS A 130 -0.283 9.154 6.880 1.00 0.00 H new ATOM 0 HB2 LYS A 130 1.874 7.710 5.311 1.00 0.00 H new ATOM 0 HB3 LYS A 130 2.039 9.292 6.047 1.00 0.00 H new ATOM 0 HG2 LYS A 130 1.587 6.681 7.538 1.00 0.00 H new ATOM 0 HG3 LYS A 130 3.114 7.527 7.393 1.00 0.00 H new ATOM 0 HD2 LYS A 130 0.617 8.616 8.760 1.00 0.00 H new ATOM 0 HD3 LYS A 130 2.014 7.946 9.580 1.00 0.00 H new ATOM 0 HE2 LYS A 130 3.442 9.735 8.556 1.00 0.00 H new ATOM 0 HE3 LYS A 130 2.014 10.421 7.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 2.562 11.552 9.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 1.063 10.768 9.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 2.447 10.104 10.723 1.00 0.00 H new ATOM 1723 N PRO A 131 -0.845 10.383 4.734 1.00 0.00 N ATOM 1724 CA PRO A 131 -1.097 11.123 3.502 1.00 0.00 C ATOM 1725 C PRO A 131 0.241 11.497 2.849 1.00 0.00 C ATOM 1726 O PRO A 131 1.211 11.801 3.555 1.00 0.00 O ATOM 1727 CB PRO A 131 -1.847 12.376 3.982 1.00 0.00 C ATOM 1728 CG PRO A 131 -1.484 12.515 5.417 1.00 0.00 C ATOM 1729 CD PRO A 131 -1.296 11.125 5.930 1.00 0.00 C ATOM 0 HA PRO A 131 -1.663 10.562 2.758 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -1.550 13.256 3.412 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -2.924 12.264 3.856 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -0.572 13.101 5.534 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -2.268 13.032 5.970 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -0.557 11.087 6.730 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -2.222 10.715 6.333 1.00 0.00 H new ATOM 1737 N PRO A 132 0.324 11.496 1.522 1.00 0.00 N ATOM 1738 CA PRO A 132 1.583 11.725 0.838 1.00 0.00 C ATOM 1739 C PRO A 132 2.078 13.145 1.017 1.00 0.00 C ATOM 1740 O PRO A 132 1.305 14.112 0.954 1.00 0.00 O ATOM 1741 CB PRO A 132 1.236 11.477 -0.632 1.00 0.00 C ATOM 1742 CG PRO A 132 -0.212 11.794 -0.715 1.00 0.00 C ATOM 1743 CD PRO A 132 -0.792 11.317 0.584 1.00 0.00 C ATOM 0 HA PRO A 132 2.378 11.085 1.222 1.00 0.00 H new ATOM 0 HB2 PRO A 132 1.823 12.114 -1.294 1.00 0.00 H new ATOM 0 HB3 PRO A 132 1.436 10.445 -0.921 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -0.374 12.863 -0.850 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -0.678 11.291 -1.563 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -1.664 11.901 0.877 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -1.110 10.276 0.527 1.00 0.00 H new ATOM 1751 N ALA A 133 3.336 13.272 1.245 1.00 0.00 N ATOM 1752 CA ALA A 133 3.941 14.554 1.330 1.00 0.00 C ATOM 1753 C ALA A 133 4.587 14.842 0.005 1.00 0.00 C ATOM 1754 O ALA A 133 5.721 14.420 -0.248 1.00 0.00 O ATOM 1755 CB ALA A 133 4.954 14.618 2.471 1.00 0.00 C ATOM 0 H ALA A 133 3.977 12.490 1.378 1.00 0.00 H new ATOM 0 HA ALA A 133 3.187 15.310 1.550 1.00 0.00 H new ATOM 0 HB1 ALA A 133 5.398 15.613 2.508 1.00 0.00 H new ATOM 0 HB2 ALA A 133 4.452 14.410 3.416 1.00 0.00 H new ATOM 0 HB3 ALA A 133 5.736 13.877 2.305 1.00 0.00 H new