USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 547 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 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -165:sc= 2.26 (180deg=1.87) USER MOD Single : A 2 GLN : amide:sc= -0.269 X(o=-0.27,f=-0.32) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 178:sc= 0.753 (180deg=0.731) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.00805 USER MOD Single : A 14 THR OG1 : rot -74:sc= 0.382 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.17 USER MOD Single : A 25 ASN : amide:sc= 0.963 K(o=0.96,f=-0.23) USER MOD Single : A 27 LYS NZ :NH3+ -145:sc= 0.374 (180deg=-0.105!) USER MOD Single : A 29 LYS NZ :NH3+ 164:sc= 1.89 (180deg=1.53) USER MOD Single : A 31 GLN : amide:sc= -0.0648 K(o=-0.065,f=-3.2!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 41 GLN : amide:sc= 1.33 K(o=1.3,f=-2.6!) USER MOD Single : A 48 LYS NZ :NH3+ -153:sc= 0.986 (180deg=0.561) USER MOD Single : A 49 GLN : amide:sc= 0.955 K(o=0.96,f=-6.1!) USER MOD Single : A 59 TYR OH : rot -163:sc= 1.35 USER MOD Single : A 60 ASN : amide:sc= 0.369 X(o=0.37,f=0) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.826 51.809 19.862 1.00 0.00 N ATOM 2 CA MET A 1 32.989 52.068 21.301 1.00 0.00 C ATOM 3 C MET A 1 34.405 52.545 21.630 1.00 0.00 C ATOM 4 O MET A 1 35.376 52.149 20.988 1.00 0.00 O ATOM 5 CB MET A 1 32.603 50.892 22.194 1.00 0.00 C ATOM 6 CG MET A 1 33.443 49.631 22.019 1.00 0.00 C ATOM 7 SD MET A 1 33.078 48.324 23.216 1.00 0.00 S ATOM 8 CE MET A 1 34.351 47.113 22.782 1.00 0.00 C ATOM 0 H1 MET A 1 31.814 51.737 19.635 1.00 0.00 H new ATOM 0 H2 MET A 1 33.248 52.589 19.319 1.00 0.00 H new ATOM 0 H3 MET A 1 33.301 50.918 19.614 1.00 0.00 H new ATOM 0 HA MET A 1 32.282 52.867 21.525 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.670 51.211 23.234 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.559 50.642 22.004 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.287 49.241 21.013 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.497 49.896 22.098 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.262 46.243 23.432 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.222 46.806 21.744 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.337 47.560 22.908 1.00 0.00 H new ATOM 20 N GLN A 2 34.515 53.351 22.682 1.00 0.00 N ATOM 21 CA GLN A 2 35.759 53.801 23.273 1.00 0.00 C ATOM 22 C GLN A 2 36.319 52.715 24.195 1.00 0.00 C ATOM 23 O GLN A 2 35.615 52.232 25.079 1.00 0.00 O ATOM 24 CB GLN A 2 35.508 55.106 24.023 1.00 0.00 C ATOM 25 CG GLN A 2 36.744 55.669 24.719 1.00 0.00 C ATOM 26 CD GLN A 2 36.523 57.003 25.433 1.00 0.00 C ATOM 27 OE1 GLN A 2 35.472 57.638 25.362 1.00 0.00 O ATOM 28 NE2 GLN A 2 37.512 57.503 26.167 1.00 0.00 N ATOM 0 H GLN A 2 33.697 53.723 23.164 1.00 0.00 H new ATOM 0 HA GLN A 2 36.502 53.987 22.498 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.128 55.849 23.322 1.00 0.00 H new ATOM 0 HB3 GLN A 2 34.728 54.942 24.766 1.00 0.00 H new ATOM 0 HG2 GLN A 2 37.100 54.938 25.445 1.00 0.00 H new ATOM 0 HG3 GLN A 2 37.535 55.795 23.980 1.00 0.00 H new ATOM 0 HE21 GLN A 2 38.395 56.998 26.244 1.00 0.00 H new ATOM 0 HE22 GLN A 2 37.388 58.391 26.653 1.00 0.00 H new ATOM 37 N ILE A 3 37.606 52.407 24.064 1.00 0.00 N ATOM 38 CA ILE A 3 38.381 51.730 25.085 1.00 0.00 C ATOM 39 C ILE A 3 39.668 52.511 25.357 1.00 0.00 C ATOM 40 O ILE A 3 40.042 53.398 24.593 1.00 0.00 O ATOM 41 CB ILE A 3 38.643 50.263 24.757 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.539 50.075 23.536 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.334 49.486 24.652 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.039 48.644 23.362 1.00 0.00 C ATOM 0 H ILE A 3 38.145 52.628 23.227 1.00 0.00 H new ATOM 0 HA ILE A 3 37.790 51.710 26.001 1.00 0.00 H new ATOM 0 HB ILE A 3 39.207 49.844 25.590 1.00 0.00 H new ATOM 0 HG12 ILE A 3 38.989 50.370 22.643 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.396 50.743 23.618 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.548 48.443 24.418 1.00 0.00 H new ATOM 0 HG22 ILE A 3 36.800 49.543 25.601 1.00 0.00 H new ATOM 0 HG23 ILE A 3 36.718 49.916 23.863 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.670 48.584 22.475 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.617 48.351 24.239 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.188 47.973 23.248 1.00 0.00 H new ATOM 56 N PHE A 4 40.372 52.157 26.428 1.00 0.00 N ATOM 57 CA PHE A 4 41.686 52.689 26.729 1.00 0.00 C ATOM 58 C PHE A 4 42.744 51.596 26.571 1.00 0.00 C ATOM 59 O PHE A 4 42.497 50.439 26.902 1.00 0.00 O ATOM 60 CB PHE A 4 41.686 53.282 28.135 1.00 0.00 C ATOM 61 CG PHE A 4 40.728 54.433 28.327 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.091 55.718 27.907 1.00 0.00 C ATOM 63 CD2 PHE A 4 39.485 54.225 28.936 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.234 56.803 28.126 1.00 0.00 C ATOM 65 CE2 PHE A 4 38.621 55.306 29.145 1.00 0.00 C ATOM 66 CZ PHE A 4 38.999 56.595 28.752 1.00 0.00 C ATOM 0 H PHE A 4 40.037 51.483 27.117 1.00 0.00 H new ATOM 0 HA PHE A 4 41.933 53.486 26.027 1.00 0.00 H new ATOM 0 HB2 PHE A 4 41.437 52.496 28.848 1.00 0.00 H new ATOM 0 HB3 PHE A 4 42.694 53.621 28.373 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.038 55.873 27.411 1.00 0.00 H new ATOM 0 HD2 PHE A 4 39.193 53.232 29.244 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.524 57.795 27.814 1.00 0.00 H new ATOM 0 HE2 PHE A 4 37.660 55.145 29.611 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.338 57.430 28.932 1.00 0.00 H new ATOM 76 N VAL A 5 43.929 51.953 26.085 1.00 0.00 N ATOM 77 CA VAL A 5 45.078 51.072 26.029 1.00 0.00 C ATOM 78 C VAL A 5 46.292 51.769 26.644 1.00 0.00 C ATOM 79 O VAL A 5 46.368 52.996 26.648 1.00 0.00 O ATOM 80 CB VAL A 5 45.329 50.525 24.627 1.00 0.00 C ATOM 81 CG1 VAL A 5 44.069 49.951 23.986 1.00 0.00 C ATOM 82 CG2 VAL A 5 45.916 51.539 23.649 1.00 0.00 C ATOM 0 H VAL A 5 44.115 52.884 25.713 1.00 0.00 H new ATOM 0 HA VAL A 5 44.870 50.186 26.629 1.00 0.00 H new ATOM 0 HB VAL A 5 46.065 49.739 24.800 1.00 0.00 H new ATOM 0 HG11 VAL A 5 44.306 49.576 22.990 1.00 0.00 H new ATOM 0 HG12 VAL A 5 43.688 49.135 24.600 1.00 0.00 H new ATOM 0 HG13 VAL A 5 43.312 50.731 23.909 1.00 0.00 H new ATOM 0 HG21 VAL A 5 46.062 51.066 22.678 1.00 0.00 H new ATOM 0 HG22 VAL A 5 45.232 52.381 23.543 1.00 0.00 H new ATOM 0 HG23 VAL A 5 46.874 51.896 24.026 1.00 0.00 H new ATOM 92 N LYS A 6 47.225 50.999 27.197 1.00 0.00 N ATOM 93 CA LYS A 6 48.478 51.493 27.736 1.00 0.00 C ATOM 94 C LYS A 6 49.686 50.790 27.113 1.00 0.00 C ATOM 95 O LYS A 6 49.623 49.611 26.772 1.00 0.00 O ATOM 96 CB LYS A 6 48.499 51.415 29.260 1.00 0.00 C ATOM 97 CG LYS A 6 47.455 52.333 29.885 1.00 0.00 C ATOM 98 CD LYS A 6 47.753 52.638 31.350 1.00 0.00 C ATOM 99 CE LYS A 6 46.663 53.556 31.896 1.00 0.00 C ATOM 100 NZ LYS A 6 47.078 54.253 33.123 1.00 0.00 N ATOM 0 H LYS A 6 47.123 49.988 27.282 1.00 0.00 H new ATOM 0 HA LYS A 6 48.553 52.546 27.464 1.00 0.00 H new ATOM 0 HB2 LYS A 6 48.315 50.388 29.575 1.00 0.00 H new ATOM 0 HB3 LYS A 6 49.489 51.688 29.625 1.00 0.00 H new ATOM 0 HG2 LYS A 6 47.413 53.266 29.323 1.00 0.00 H new ATOM 0 HG3 LYS A 6 46.472 51.868 29.806 1.00 0.00 H new ATOM 0 HD2 LYS A 6 47.791 51.714 31.927 1.00 0.00 H new ATOM 0 HD3 LYS A 6 48.729 53.114 31.445 1.00 0.00 H new ATOM 0 HE2 LYS A 6 46.397 54.291 31.136 1.00 0.00 H new ATOM 0 HE3 LYS A 6 45.767 52.970 32.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 46.304 54.864 33.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 47.307 53.554 33.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 47.917 54.835 32.925 1.00 0.00 H new ATOM 168 N LYS A 11 52.492 55.412 28.564 1.00 0.00 N ATOM 169 CA LYS A 11 51.679 56.483 28.024 1.00 0.00 C ATOM 170 C LYS A 11 50.250 56.018 27.733 1.00 0.00 C ATOM 171 O LYS A 11 50.016 54.852 27.422 1.00 0.00 O ATOM 172 CB LYS A 11 52.332 57.201 26.847 1.00 0.00 C ATOM 173 CG LYS A 11 52.567 56.343 25.608 1.00 0.00 C ATOM 174 CD LYS A 11 52.927 57.162 24.372 1.00 0.00 C ATOM 175 CE LYS A 11 53.143 56.194 23.211 1.00 0.00 C ATOM 176 NZ LYS A 11 53.370 56.879 21.930 1.00 0.00 N ATOM 0 HA LYS A 11 51.605 57.241 28.804 1.00 0.00 H new ATOM 0 HB2 LYS A 11 51.707 58.049 26.568 1.00 0.00 H new ATOM 0 HB3 LYS A 11 53.289 57.605 27.175 1.00 0.00 H new ATOM 0 HG2 LYS A 11 53.368 55.633 25.812 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.669 55.760 25.401 1.00 0.00 H new ATOM 0 HD2 LYS A 11 52.130 57.867 24.137 1.00 0.00 H new ATOM 0 HD3 LYS A 11 53.828 57.748 24.552 1.00 0.00 H new ATOM 0 HE2 LYS A 11 53.998 55.555 23.432 1.00 0.00 H new ATOM 0 HE3 LYS A 11 52.273 55.543 23.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 53.544 56.174 21.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 52.531 57.443 21.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 54.196 57.506 22.013 1.00 0.00 H new ATOM 190 N THR A 12 49.292 56.932 27.851 1.00 0.00 N ATOM 191 CA THR A 12 47.878 56.677 27.667 1.00 0.00 C ATOM 192 C THR A 12 47.442 56.907 26.219 1.00 0.00 C ATOM 193 O THR A 12 47.822 57.903 25.606 1.00 0.00 O ATOM 194 CB THR A 12 47.048 57.501 28.648 1.00 0.00 C ATOM 195 OG1 THR A 12 47.445 58.853 28.699 1.00 0.00 O ATOM 196 CG2 THR A 12 47.202 56.949 30.063 1.00 0.00 C ATOM 0 H THR A 12 49.492 57.904 28.086 1.00 0.00 H new ATOM 0 HA THR A 12 47.699 55.624 27.882 1.00 0.00 H new ATOM 0 HB THR A 12 46.020 57.437 28.292 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.882 59.335 29.340 1.00 0.00 H new ATOM 0 HG21 THR A 12 46.605 57.545 30.753 1.00 0.00 H new ATOM 0 HG22 THR A 12 46.861 55.914 30.089 1.00 0.00 H new ATOM 0 HG23 THR A 12 48.250 56.993 30.359 1.00 0.00 H new ATOM 204 N ILE A 13 46.656 55.984 25.671 1.00 0.00 N ATOM 205 CA ILE A 13 46.114 56.002 24.328 1.00 0.00 C ATOM 206 C ILE A 13 44.632 55.627 24.386 1.00 0.00 C ATOM 207 O ILE A 13 44.276 54.541 24.840 1.00 0.00 O ATOM 208 CB ILE A 13 46.904 55.068 23.418 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.331 55.561 23.198 1.00 0.00 C ATOM 210 CG2 ILE A 13 46.195 54.890 22.077 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.243 54.594 22.448 1.00 0.00 C ATOM 0 H ILE A 13 46.367 55.155 26.190 1.00 0.00 H new ATOM 0 HA ILE A 13 46.202 57.003 23.905 1.00 0.00 H new ATOM 0 HB ILE A 13 46.960 54.102 23.920 1.00 0.00 H new ATOM 0 HG12 ILE A 13 48.293 56.501 22.647 1.00 0.00 H new ATOM 0 HG13 ILE A 13 48.777 55.778 24.168 1.00 0.00 H new ATOM 0 HG21 ILE A 13 46.777 54.220 21.444 1.00 0.00 H new ATOM 0 HG22 ILE A 13 45.205 54.465 22.242 1.00 0.00 H new ATOM 0 HG23 ILE A 13 46.097 55.858 21.586 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.234 55.036 22.343 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.320 53.660 23.005 1.00 0.00 H new ATOM 0 HD13 ILE A 13 48.828 54.394 21.460 1.00 0.00 H new ATOM 223 N THR A 14 43.757 56.495 23.885 1.00 0.00 N ATOM 224 CA THR A 14 42.340 56.232 23.729 1.00 0.00 C ATOM 225 C THR A 14 42.059 55.690 22.325 1.00 0.00 C ATOM 226 O THR A 14 42.423 56.321 21.336 1.00 0.00 O ATOM 227 CB THR A 14 41.509 57.483 24.005 1.00 0.00 C ATOM 228 OG1 THR A 14 41.750 57.926 25.321 1.00 0.00 O ATOM 229 CG2 THR A 14 40.014 57.197 23.917 1.00 0.00 C ATOM 0 H THR A 14 44.028 57.426 23.569 1.00 0.00 H new ATOM 0 HA THR A 14 42.049 55.479 24.461 1.00 0.00 H new ATOM 0 HB THR A 14 41.794 58.226 23.259 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.297 57.331 25.955 1.00 0.00 H new ATOM 0 HG21 THR A 14 39.456 58.111 24.119 1.00 0.00 H new ATOM 0 HG22 THR A 14 39.771 56.837 22.917 1.00 0.00 H new ATOM 0 HG23 THR A 14 39.745 56.438 24.651 1.00 0.00 H new ATOM 237 N LEU A 15 41.404 54.535 22.248 1.00 0.00 N ATOM 238 CA LEU A 15 41.198 53.781 21.029 1.00 0.00 C ATOM 239 C LEU A 15 39.714 53.634 20.687 1.00 0.00 C ATOM 240 O LEU A 15 38.848 53.665 21.559 1.00 0.00 O ATOM 241 CB LEU A 15 41.911 52.441 21.193 1.00 0.00 C ATOM 242 CG LEU A 15 42.203 51.671 19.909 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.264 52.356 19.051 1.00 0.00 C ATOM 244 CD2 LEU A 15 42.725 50.276 20.241 1.00 0.00 C ATOM 0 H LEU A 15 40.990 54.088 23.066 1.00 0.00 H new ATOM 0 HA LEU A 15 41.621 54.313 20.177 1.00 0.00 H new ATOM 0 HB2 LEU A 15 42.855 52.616 21.709 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.305 51.808 21.842 1.00 0.00 H new ATOM 0 HG LEU A 15 41.264 51.627 19.357 1.00 0.00 H new ATOM 0 HD11 LEU A 15 43.437 51.769 18.149 1.00 0.00 H new ATOM 0 HD12 LEU A 15 42.921 53.353 18.776 1.00 0.00 H new ATOM 0 HD13 LEU A 15 44.193 52.435 19.615 1.00 0.00 H new ATOM 0 HD21 LEU A 15 42.930 49.735 19.317 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.642 50.360 20.824 1.00 0.00 H new ATOM 0 HD23 LEU A 15 41.976 49.735 20.819 1.00 0.00 H new ATOM 256 N GLU A 16 39.414 53.447 19.404 1.00 0.00 N ATOM 257 CA GLU A 16 38.097 53.173 18.865 1.00 0.00 C ATOM 258 C GLU A 16 38.032 51.755 18.292 1.00 0.00 C ATOM 259 O GLU A 16 38.835 51.363 17.449 1.00 0.00 O ATOM 260 CB GLU A 16 37.774 54.253 17.837 1.00 0.00 C ATOM 261 CG GLU A 16 36.374 54.160 17.237 1.00 0.00 C ATOM 262 CD GLU A 16 35.244 54.302 18.258 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.345 55.163 19.160 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.234 53.576 18.134 1.00 0.00 O ATOM 0 H GLU A 16 40.128 53.486 18.677 1.00 0.00 H new ATOM 0 HA GLU A 16 37.339 53.207 19.648 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.890 55.230 18.307 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.505 54.199 17.030 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.263 54.936 16.479 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.271 53.201 16.729 1.00 0.00 H new ATOM 271 N VAL A 17 37.083 50.958 18.776 1.00 0.00 N ATOM 272 CA VAL A 17 36.899 49.564 18.429 1.00 0.00 C ATOM 273 C VAL A 17 35.414 49.214 18.324 1.00 0.00 C ATOM 274 O VAL A 17 34.583 49.852 18.968 1.00 0.00 O ATOM 275 CB VAL A 17 37.581 48.630 19.424 1.00 0.00 C ATOM 276 CG1 VAL A 17 39.099 48.785 19.437 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.058 48.806 20.847 1.00 0.00 C ATOM 0 H VAL A 17 36.393 51.288 19.451 1.00 0.00 H new ATOM 0 HA VAL A 17 37.368 49.420 17.456 1.00 0.00 H new ATOM 0 HB VAL A 17 37.333 47.628 19.075 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.529 48.096 20.164 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.496 48.563 18.447 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.358 49.808 19.710 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.577 48.117 21.513 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.234 49.830 21.175 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.989 48.596 20.870 1.00 0.00 H new ATOM 287 N GLU A 18 35.072 48.181 17.560 1.00 0.00 N ATOM 288 CA GLU A 18 33.750 47.590 17.594 1.00 0.00 C ATOM 289 C GLU A 18 33.699 46.356 18.496 1.00 0.00 C ATOM 290 O GLU A 18 34.729 45.709 18.673 1.00 0.00 O ATOM 291 CB GLU A 18 33.216 47.338 16.186 1.00 0.00 C ATOM 292 CG GLU A 18 33.881 46.179 15.448 1.00 0.00 C ATOM 293 CD GLU A 18 33.178 45.909 14.117 1.00 0.00 C ATOM 294 OE1 GLU A 18 32.022 45.434 14.140 1.00 0.00 O ATOM 295 OE2 GLU A 18 33.772 46.172 13.050 1.00 0.00 O ATOM 0 H GLU A 18 35.709 47.734 16.901 1.00 0.00 H new ATOM 0 HA GLU A 18 33.072 48.312 18.050 1.00 0.00 H new ATOM 0 HB2 GLU A 18 32.145 47.144 16.248 1.00 0.00 H new ATOM 0 HB3 GLU A 18 33.342 48.246 15.597 1.00 0.00 H new ATOM 0 HG2 GLU A 18 34.931 46.410 15.270 1.00 0.00 H new ATOM 0 HG3 GLU A 18 33.853 45.283 16.068 1.00 0.00 H new ATOM 302 N PRO A 19 32.553 45.965 19.046 1.00 0.00 N ATOM 303 CA PRO A 19 32.440 44.797 19.899 1.00 0.00 C ATOM 304 C PRO A 19 32.967 43.495 19.294 1.00 0.00 C ATOM 305 O PRO A 19 33.468 42.633 20.013 1.00 0.00 O ATOM 306 CB PRO A 19 30.954 44.666 20.219 1.00 0.00 C ATOM 307 CG PRO A 19 30.464 46.110 20.161 1.00 0.00 C ATOM 308 CD PRO A 19 31.302 46.694 19.027 1.00 0.00 C ATOM 0 HA PRO A 19 33.067 44.947 20.778 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.439 44.035 19.495 1.00 0.00 H new ATOM 0 HB3 PRO A 19 30.790 44.223 21.201 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.396 46.169 19.949 1.00 0.00 H new ATOM 0 HG3 PRO A 19 30.632 46.634 21.102 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.797 46.579 18.068 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.469 47.761 19.173 1.00 0.00 H new ATOM 316 N SER A 20 32.882 43.356 17.973 1.00 0.00 N ATOM 317 CA SER A 20 33.352 42.205 17.228 1.00 0.00 C ATOM 318 C SER A 20 34.771 42.338 16.670 1.00 0.00 C ATOM 319 O SER A 20 35.165 41.487 15.876 1.00 0.00 O ATOM 320 CB SER A 20 32.379 41.851 16.108 1.00 0.00 C ATOM 321 OG SER A 20 31.046 41.857 16.571 1.00 0.00 O ATOM 0 H SER A 20 32.468 44.072 17.376 1.00 0.00 H new ATOM 0 HA SER A 20 33.396 41.396 17.957 1.00 0.00 H new ATOM 0 HB2 SER A 20 32.486 42.564 15.290 1.00 0.00 H new ATOM 0 HB3 SER A 20 32.623 40.867 15.707 1.00 0.00 H new ATOM 0 HG SER A 20 30.442 41.629 15.833 1.00 0.00 H new ATOM 327 N ASP A 21 35.547 43.356 17.031 1.00 0.00 N ATOM 328 CA ASP A 21 36.953 43.391 16.684 1.00 0.00 C ATOM 329 C ASP A 21 37.680 42.193 17.296 1.00 0.00 C ATOM 330 O ASP A 21 37.449 41.824 18.445 1.00 0.00 O ATOM 331 CB ASP A 21 37.627 44.699 17.088 1.00 0.00 C ATOM 332 CG ASP A 21 37.624 45.794 16.018 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.656 45.463 14.813 1.00 0.00 O ATOM 334 OD2 ASP A 21 37.683 46.993 16.366 1.00 0.00 O ATOM 0 H ASP A 21 35.221 44.163 17.563 1.00 0.00 H new ATOM 0 HA ASP A 21 37.017 43.331 15.598 1.00 0.00 H new ATOM 0 HB2 ASP A 21 37.132 45.084 17.979 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.660 44.486 17.364 1.00 0.00 H new ATOM 339 N THR A 22 38.558 41.565 16.517 1.00 0.00 N ATOM 340 CA THR A 22 39.435 40.506 16.973 1.00 0.00 C ATOM 341 C THR A 22 40.660 41.077 17.690 1.00 0.00 C ATOM 342 O THR A 22 40.999 42.248 17.530 1.00 0.00 O ATOM 343 CB THR A 22 39.882 39.600 15.830 1.00 0.00 C ATOM 344 OG1 THR A 22 40.595 40.355 14.877 1.00 0.00 O ATOM 345 CG2 THR A 22 38.719 38.922 15.109 1.00 0.00 C ATOM 0 H THR A 22 38.677 41.789 15.529 1.00 0.00 H new ATOM 0 HA THR A 22 38.859 39.904 17.676 1.00 0.00 H new ATOM 0 HB THR A 22 40.502 38.825 16.281 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.882 39.770 14.145 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.105 38.292 14.308 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.161 38.308 15.816 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.060 39.681 14.688 1.00 0.00 H new ATOM 353 N ILE A 23 41.381 40.247 18.439 1.00 0.00 N ATOM 354 CA ILE A 23 42.652 40.650 19.004 1.00 0.00 C ATOM 355 C ILE A 23 43.655 40.990 17.899 1.00 0.00 C ATOM 356 O ILE A 23 44.402 41.955 18.040 1.00 0.00 O ATOM 357 CB ILE A 23 43.167 39.595 19.978 1.00 0.00 C ATOM 358 CG1 ILE A 23 42.183 39.292 21.104 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.528 39.972 20.556 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.581 40.497 21.820 1.00 0.00 C ATOM 0 H ILE A 23 41.101 39.293 18.665 1.00 0.00 H new ATOM 0 HA ILE A 23 42.511 41.563 19.582 1.00 0.00 H new ATOM 0 HB ILE A 23 43.279 38.684 19.389 1.00 0.00 H new ATOM 0 HG12 ILE A 23 41.368 38.695 20.694 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.690 38.673 21.844 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.859 39.195 21.245 1.00 0.00 H new ATOM 0 HG22 ILE A 23 45.252 40.072 19.747 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.447 40.919 21.090 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.899 40.154 22.598 1.00 0.00 H new ATOM 0 HD12 ILE A 23 42.378 41.088 22.271 1.00 0.00 H new ATOM 0 HD13 ILE A 23 41.035 41.111 21.103 1.00 0.00 H new ATOM 372 N GLU A 24 43.606 40.308 16.758 1.00 0.00 N ATOM 373 CA GLU A 24 44.383 40.648 15.584 1.00 0.00 C ATOM 374 C GLU A 24 44.068 42.045 15.045 1.00 0.00 C ATOM 375 O GLU A 24 44.982 42.749 14.621 1.00 0.00 O ATOM 376 CB GLU A 24 44.175 39.621 14.475 1.00 0.00 C ATOM 377 CG GLU A 24 44.514 38.179 14.844 1.00 0.00 C ATOM 378 CD GLU A 24 43.296 37.373 15.296 1.00 0.00 C ATOM 379 OE1 GLU A 24 42.756 37.644 16.390 1.00 0.00 O ATOM 380 OE2 GLU A 24 42.898 36.445 14.558 1.00 0.00 O ATOM 0 H GLU A 24 43.012 39.489 16.628 1.00 0.00 H new ATOM 0 HA GLU A 24 45.425 40.642 15.903 1.00 0.00 H new ATOM 0 HB2 GLU A 24 43.133 39.661 14.157 1.00 0.00 H new ATOM 0 HB3 GLU A 24 44.782 39.910 13.617 1.00 0.00 H new ATOM 0 HG2 GLU A 24 44.969 37.687 13.984 1.00 0.00 H new ATOM 0 HG3 GLU A 24 45.258 38.179 15.641 1.00 0.00 H new ATOM 387 N ASN A 25 42.814 42.487 15.086 1.00 0.00 N ATOM 388 CA ASN A 25 42.445 43.836 14.707 1.00 0.00 C ATOM 389 C ASN A 25 42.986 44.874 15.691 1.00 0.00 C ATOM 390 O ASN A 25 43.520 45.899 15.271 1.00 0.00 O ATOM 391 CB ASN A 25 40.930 43.988 14.603 1.00 0.00 C ATOM 392 CG ASN A 25 40.240 43.187 13.498 1.00 0.00 C ATOM 393 OD1 ASN A 25 40.835 42.451 12.714 1.00 0.00 O ATOM 394 ND2 ASN A 25 38.918 43.325 13.435 1.00 0.00 N ATOM 0 H ASN A 25 42.026 41.912 15.385 1.00 0.00 H new ATOM 0 HA ASN A 25 42.894 44.014 13.730 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.491 43.700 15.558 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.702 45.043 14.453 1.00 0.00 H new ATOM 0 HD21 ASN A 25 38.385 42.816 12.729 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.437 43.939 14.092 1.00 0.00 H new ATOM 401 N VAL A 26 42.896 44.619 16.993 1.00 0.00 N ATOM 402 CA VAL A 26 43.398 45.526 18.006 1.00 0.00 C ATOM 403 C VAL A 26 44.920 45.658 17.919 1.00 0.00 C ATOM 404 O VAL A 26 45.432 46.775 17.903 1.00 0.00 O ATOM 405 CB VAL A 26 42.933 45.123 19.402 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.509 46.030 20.485 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.413 45.210 19.496 1.00 0.00 C ATOM 0 H VAL A 26 42.470 43.773 17.371 1.00 0.00 H new ATOM 0 HA VAL A 26 42.977 46.512 17.811 1.00 0.00 H new ATOM 0 HB VAL A 26 43.283 44.103 19.562 1.00 0.00 H new ATOM 0 HG11 VAL A 26 43.150 45.704 21.461 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.598 45.977 20.463 1.00 0.00 H new ATOM 0 HG13 VAL A 26 43.192 47.057 20.306 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.093 44.920 20.497 1.00 0.00 H new ATOM 0 HG22 VAL A 26 41.094 46.233 19.295 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.964 44.539 18.763 1.00 0.00 H new ATOM 417 N LYS A 27 45.641 44.551 17.763 1.00 0.00 N ATOM 418 CA LYS A 27 47.072 44.558 17.534 1.00 0.00 C ATOM 419 C LYS A 27 47.446 45.321 16.262 1.00 0.00 C ATOM 420 O LYS A 27 48.423 46.066 16.275 1.00 0.00 O ATOM 421 CB LYS A 27 47.603 43.129 17.482 1.00 0.00 C ATOM 422 CG LYS A 27 47.625 42.436 18.842 1.00 0.00 C ATOM 423 CD LYS A 27 47.997 40.966 18.675 1.00 0.00 C ATOM 424 CE LYS A 27 48.144 40.246 20.012 1.00 0.00 C ATOM 425 NZ LYS A 27 48.415 38.816 19.801 1.00 0.00 N ATOM 0 H LYS A 27 45.237 43.615 17.793 1.00 0.00 H new ATOM 0 HA LYS A 27 47.538 45.081 18.369 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.988 42.546 16.796 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.613 43.140 17.073 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.343 42.928 19.498 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.648 42.520 19.318 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.233 40.467 18.079 1.00 0.00 H new ATOM 0 HD3 LYS A 27 48.933 40.892 18.121 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.955 40.695 20.586 1.00 0.00 H new ATOM 0 HE3 LYS A 27 47.233 40.367 20.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 47.954 38.261 20.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.042 38.525 18.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.441 38.649 19.829 1.00 0.00 H new ATOM 439 N ALA A 28 46.670 45.192 15.189 1.00 0.00 N ATOM 440 CA ALA A 28 46.886 45.928 13.960 1.00 0.00 C ATOM 441 C ALA A 28 46.632 47.432 14.094 1.00 0.00 C ATOM 442 O ALA A 28 47.382 48.229 13.537 1.00 0.00 O ATOM 443 CB ALA A 28 46.019 45.309 12.869 1.00 0.00 C ATOM 0 H ALA A 28 45.866 44.565 15.155 1.00 0.00 H new ATOM 0 HA ALA A 28 47.941 45.847 13.697 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.168 45.850 11.935 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.298 44.264 12.732 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.970 45.369 13.160 1.00 0.00 H new ATOM 449 N LYS A 29 45.618 47.839 14.853 1.00 0.00 N ATOM 450 CA LYS A 29 45.350 49.226 15.173 1.00 0.00 C ATOM 451 C LYS A 29 46.495 49.843 15.978 1.00 0.00 C ATOM 452 O LYS A 29 46.907 50.962 15.678 1.00 0.00 O ATOM 453 CB LYS A 29 44.014 49.338 15.904 1.00 0.00 C ATOM 454 CG LYS A 29 42.802 49.240 14.982 1.00 0.00 C ATOM 455 CD LYS A 29 41.485 49.283 15.752 1.00 0.00 C ATOM 456 CE LYS A 29 40.301 49.309 14.791 1.00 0.00 C ATOM 457 NZ LYS A 29 38.999 49.333 15.473 1.00 0.00 N ATOM 0 H LYS A 29 44.948 47.193 15.269 1.00 0.00 H new ATOM 0 HA LYS A 29 45.281 49.795 14.246 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.953 48.550 16.655 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.979 50.289 16.436 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.827 50.059 14.264 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.857 48.313 14.411 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.411 48.413 16.405 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.460 50.165 16.392 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.383 50.185 14.148 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.348 48.433 14.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.260 49.620 14.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.783 48.385 15.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 39.032 50.011 16.261 1.00 0.00 H new ATOM 471 N ILE A 30 47.057 49.105 16.931 1.00 0.00 N ATOM 472 CA ILE A 30 48.213 49.509 17.705 1.00 0.00 C ATOM 473 C ILE A 30 49.468 49.593 16.834 1.00 0.00 C ATOM 474 O ILE A 30 50.178 50.593 16.912 1.00 0.00 O ATOM 475 CB ILE A 30 48.386 48.599 18.917 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.241 48.797 19.906 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.722 48.824 19.618 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.131 47.702 20.964 1.00 0.00 C ATOM 0 H ILE A 30 46.706 48.183 17.189 1.00 0.00 H new ATOM 0 HA ILE A 30 48.046 50.517 18.085 1.00 0.00 H new ATOM 0 HB ILE A 30 48.372 47.573 18.549 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.369 49.757 20.405 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.303 48.848 19.353 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.801 48.154 20.475 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.536 48.621 18.923 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.785 49.858 19.958 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.293 47.919 21.626 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.970 46.740 20.477 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.052 47.664 21.545 1.00 0.00 H new ATOM 490 N GLN A 31 49.731 48.619 15.968 1.00 0.00 N ATOM 491 CA GLN A 31 50.839 48.620 15.034 1.00 0.00 C ATOM 492 C GLN A 31 50.838 49.875 14.158 1.00 0.00 C ATOM 493 O GLN A 31 51.830 50.598 14.105 1.00 0.00 O ATOM 494 CB GLN A 31 50.784 47.344 14.199 1.00 0.00 C ATOM 495 CG GLN A 31 51.552 47.317 12.880 1.00 0.00 C ATOM 496 CD GLN A 31 53.063 47.547 12.959 1.00 0.00 C ATOM 497 OE1 GLN A 31 53.582 48.326 13.756 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.845 46.954 12.062 1.00 0.00 N ATOM 0 H GLN A 31 49.155 47.780 15.899 1.00 0.00 H new ATOM 0 HA GLN A 31 51.776 48.640 15.590 1.00 0.00 H new ATOM 0 HB2 GLN A 31 51.152 46.525 14.817 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.737 47.133 13.980 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.379 46.351 12.406 1.00 0.00 H new ATOM 0 HG3 GLN A 31 51.126 48.075 12.223 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.444 46.302 11.387 1.00 0.00 H new ATOM 0 HE22 GLN A 31 54.846 47.151 12.049 1.00 0.00 H new ATOM 507 N ASP A 32 49.715 50.166 13.509 1.00 0.00 N ATOM 508 CA ASP A 32 49.548 51.333 12.666 1.00 0.00 C ATOM 509 C ASP A 32 49.915 52.638 13.374 1.00 0.00 C ATOM 510 O ASP A 32 50.570 53.483 12.768 1.00 0.00 O ATOM 511 CB ASP A 32 48.104 51.329 12.169 1.00 0.00 C ATOM 512 CG ASP A 32 47.721 52.619 11.443 1.00 0.00 C ATOM 513 OD1 ASP A 32 48.087 52.781 10.259 1.00 0.00 O ATOM 514 OD2 ASP A 32 47.057 53.473 12.072 1.00 0.00 O ATOM 0 H ASP A 32 48.881 49.581 13.559 1.00 0.00 H new ATOM 0 HA ASP A 32 50.239 51.280 11.825 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.959 50.483 11.497 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.434 51.182 13.016 1.00 0.00 H new ATOM 519 N LYS A 33 49.571 52.782 14.650 1.00 0.00 N ATOM 520 CA LYS A 33 49.835 53.972 15.435 1.00 0.00 C ATOM 521 C LYS A 33 51.216 54.039 16.090 1.00 0.00 C ATOM 522 O LYS A 33 51.765 55.135 16.168 1.00 0.00 O ATOM 523 CB LYS A 33 48.722 54.136 16.466 1.00 0.00 C ATOM 524 CG LYS A 33 47.491 54.737 15.794 1.00 0.00 C ATOM 525 CD LYS A 33 46.247 54.647 16.675 1.00 0.00 C ATOM 526 CE LYS A 33 45.117 55.417 15.999 1.00 0.00 C ATOM 527 NZ LYS A 33 43.831 55.213 16.686 1.00 0.00 N ATOM 0 H LYS A 33 49.089 52.053 15.175 1.00 0.00 H new ATOM 0 HA LYS A 33 49.846 54.807 14.734 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.474 53.170 16.906 1.00 0.00 H new ATOM 0 HB3 LYS A 33 49.057 54.780 17.279 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.686 55.781 15.551 1.00 0.00 H new ATOM 0 HG3 LYS A 33 47.305 54.220 14.853 1.00 0.00 H new ATOM 0 HD2 LYS A 33 45.961 53.605 16.821 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.451 55.063 17.662 1.00 0.00 H new ATOM 0 HE2 LYS A 33 45.358 56.480 15.986 1.00 0.00 H new ATOM 0 HE3 LYS A 33 45.029 55.097 14.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 43.087 55.752 16.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 43.589 54.202 16.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 43.907 55.541 17.670 1.00 0.00 H new ATOM 541 N GLU A 34 51.778 52.922 16.543 1.00 0.00 N ATOM 542 CA GLU A 34 52.938 52.883 17.410 1.00 0.00 C ATOM 543 C GLU A 34 54.188 52.226 16.820 1.00 0.00 C ATOM 544 O GLU A 34 55.273 52.413 17.366 1.00 0.00 O ATOM 545 CB GLU A 34 52.570 52.197 18.722 1.00 0.00 C ATOM 546 CG GLU A 34 51.589 52.983 19.587 1.00 0.00 C ATOM 547 CD GLU A 34 52.179 54.328 20.018 1.00 0.00 C ATOM 548 OE1 GLU A 34 53.237 54.344 20.684 1.00 0.00 O ATOM 549 OE2 GLU A 34 51.641 55.388 19.632 1.00 0.00 O ATOM 0 H GLU A 34 51.424 51.995 16.307 1.00 0.00 H new ATOM 0 HA GLU A 34 53.214 53.927 17.562 1.00 0.00 H new ATOM 0 HB2 GLU A 34 52.139 51.221 18.500 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.481 52.021 19.294 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.665 53.150 19.033 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.330 52.398 20.469 1.00 0.00 H new ATOM 556 N GLY A 35 54.083 51.471 15.730 1.00 0.00 N ATOM 557 CA GLY A 35 55.214 50.825 15.094 1.00 0.00 C ATOM 558 C GLY A 35 55.693 49.525 15.744 1.00 0.00 C ATOM 559 O GLY A 35 56.834 49.127 15.516 1.00 0.00 O ATOM 0 H GLY A 35 53.195 51.292 15.261 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.952 50.615 14.057 1.00 0.00 H new ATOM 0 HA3 GLY A 35 56.047 51.528 15.076 1.00 0.00 H new ATOM 563 N ILE A 36 54.860 48.868 16.546 1.00 0.00 N ATOM 564 CA ILE A 36 55.124 47.588 17.171 1.00 0.00 C ATOM 565 C ILE A 36 54.357 46.508 16.406 1.00 0.00 C ATOM 566 O ILE A 36 53.129 46.507 16.473 1.00 0.00 O ATOM 567 CB ILE A 36 54.746 47.599 18.649 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.388 48.756 19.412 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.145 46.271 19.285 1.00 0.00 C ATOM 570 CD1 ILE A 36 54.818 48.955 20.814 1.00 0.00 C ATOM 0 H ILE A 36 53.940 49.237 16.785 1.00 0.00 H new ATOM 0 HA ILE A 36 56.192 47.376 17.128 1.00 0.00 H new ATOM 0 HB ILE A 36 53.667 47.739 18.710 1.00 0.00 H new ATOM 0 HG12 ILE A 36 56.461 48.580 19.487 1.00 0.00 H new ATOM 0 HG13 ILE A 36 55.255 49.675 18.841 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.875 46.278 20.341 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.624 45.456 18.783 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.221 46.129 19.186 1.00 0.00 H new ATOM 0 HD11 ILE A 36 55.321 49.793 21.296 1.00 0.00 H new ATOM 0 HD12 ILE A 36 53.750 49.163 20.746 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.975 48.051 21.402 1.00 0.00 H new ATOM 582 N PRO A 37 55.000 45.576 15.709 1.00 0.00 N ATOM 583 CA PRO A 37 54.311 44.583 14.908 1.00 0.00 C ATOM 584 C PRO A 37 53.358 43.686 15.702 1.00 0.00 C ATOM 585 O PRO A 37 53.667 43.368 16.848 1.00 0.00 O ATOM 586 CB PRO A 37 55.396 43.746 14.238 1.00 0.00 C ATOM 587 CG PRO A 37 56.586 44.700 14.177 1.00 0.00 C ATOM 588 CD PRO A 37 56.427 45.505 15.463 1.00 0.00 C ATOM 0 HA PRO A 37 53.670 45.094 14.190 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.627 42.850 14.815 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.093 43.416 13.244 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.535 44.164 14.148 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.552 45.336 13.293 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.944 45.023 16.293 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.856 46.501 15.356 1.00 0.00 H new ATOM 596 N PRO A 38 52.261 43.208 15.123 1.00 0.00 N ATOM 597 CA PRO A 38 51.331 42.325 15.798 1.00 0.00 C ATOM 598 C PRO A 38 51.970 41.090 16.438 1.00 0.00 C ATOM 599 O PRO A 38 51.646 40.786 17.584 1.00 0.00 O ATOM 600 CB PRO A 38 50.281 41.950 14.758 1.00 0.00 C ATOM 601 CG PRO A 38 50.230 43.200 13.884 1.00 0.00 C ATOM 602 CD PRO A 38 51.695 43.631 13.858 1.00 0.00 C ATOM 0 HA PRO A 38 50.897 42.844 16.653 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.570 41.067 14.188 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.315 41.733 15.215 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.851 42.984 12.885 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.586 43.969 14.310 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.222 43.171 13.022 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.781 44.710 13.734 1.00 0.00 H new ATOM 610 N ASP A 39 52.938 40.447 15.793 1.00 0.00 N ATOM 611 CA ASP A 39 53.640 39.296 16.324 1.00 0.00 C ATOM 612 C ASP A 39 54.477 39.604 17.566 1.00 0.00 C ATOM 613 O ASP A 39 54.920 38.687 18.257 1.00 0.00 O ATOM 614 CB ASP A 39 54.541 38.696 15.247 1.00 0.00 C ATOM 615 CG ASP A 39 53.800 37.949 14.137 1.00 0.00 C ATOM 616 OD1 ASP A 39 53.617 36.717 14.242 1.00 0.00 O ATOM 617 OD2 ASP A 39 53.470 38.567 13.101 1.00 0.00 O ATOM 0 H ASP A 39 53.260 40.722 14.865 1.00 0.00 H new ATOM 0 HA ASP A 39 52.871 38.586 16.630 1.00 0.00 H new ATOM 0 HB2 ASP A 39 55.129 39.496 14.798 1.00 0.00 H new ATOM 0 HB3 ASP A 39 55.244 38.011 15.721 1.00 0.00 H new ATOM 622 N GLN A 40 54.712 40.876 17.876 1.00 0.00 N ATOM 623 CA GLN A 40 55.555 41.360 18.950 1.00 0.00 C ATOM 624 C GLN A 40 54.766 41.885 20.151 1.00 0.00 C ATOM 625 O GLN A 40 55.365 42.181 21.182 1.00 0.00 O ATOM 626 CB GLN A 40 56.518 42.373 18.339 1.00 0.00 C ATOM 627 CG GLN A 40 57.732 42.717 19.196 1.00 0.00 C ATOM 628 CD GLN A 40 58.988 42.928 18.350 1.00 0.00 C ATOM 629 OE1 GLN A 40 59.474 42.009 17.694 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.563 44.125 18.279 1.00 0.00 N ATOM 0 H GLN A 40 54.289 41.639 17.347 1.00 0.00 H new ATOM 0 HA GLN A 40 56.124 40.539 19.386 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.867 41.986 17.382 1.00 0.00 H new ATOM 0 HB3 GLN A 40 55.969 43.291 18.130 1.00 0.00 H new ATOM 0 HG2 GLN A 40 57.526 43.620 19.771 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.908 41.916 19.913 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.182 44.906 18.812 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.385 44.262 17.691 1.00 0.00 H new ATOM 639 N GLN A 41 53.440 41.969 20.067 1.00 0.00 N ATOM 640 CA GLN A 41 52.575 42.464 21.119 1.00 0.00 C ATOM 641 C GLN A 41 51.942 41.339 21.939 1.00 0.00 C ATOM 642 O GLN A 41 51.427 40.384 21.360 1.00 0.00 O ATOM 643 CB GLN A 41 51.453 43.309 20.522 1.00 0.00 C ATOM 644 CG GLN A 41 51.885 44.562 19.767 1.00 0.00 C ATOM 645 CD GLN A 41 50.679 45.242 19.115 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.583 45.286 19.670 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.803 45.769 17.901 1.00 0.00 N ATOM 0 H GLN A 41 52.927 41.683 19.233 1.00 0.00 H new ATOM 0 HA GLN A 41 53.204 43.060 21.780 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.875 42.682 19.843 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.783 43.608 21.328 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.374 45.255 20.452 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.617 44.299 19.004 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.704 45.743 17.423 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.997 46.200 17.447 1.00 0.00 H new ATOM 656 N ARG A 42 51.883 41.471 23.261 1.00 0.00 N ATOM 657 CA ARG A 42 51.074 40.673 24.160 1.00 0.00 C ATOM 658 C ARG A 42 50.100 41.588 24.902 1.00 0.00 C ATOM 659 O ARG A 42 50.548 42.495 25.601 1.00 0.00 O ATOM 660 CB ARG A 42 51.985 39.912 25.119 1.00 0.00 C ATOM 661 CG ARG A 42 51.246 38.882 25.968 1.00 0.00 C ATOM 662 CD ARG A 42 52.037 38.411 27.186 1.00 0.00 C ATOM 663 NE ARG A 42 53.339 37.838 26.846 1.00 0.00 N ATOM 664 CZ ARG A 42 53.594 36.581 26.460 1.00 0.00 C ATOM 665 NH1 ARG A 42 52.650 35.639 26.322 1.00 0.00 N ATOM 666 NH2 ARG A 42 54.851 36.213 26.178 1.00 0.00 N ATOM 0 H ARG A 42 52.430 42.177 23.754 1.00 0.00 H new ATOM 0 HA ARG A 42 50.490 39.940 23.604 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.764 39.408 24.546 1.00 0.00 H new ATOM 0 HB3 ARG A 42 52.483 40.624 25.777 1.00 0.00 H new ATOM 0 HG2 ARG A 42 50.301 39.310 26.303 1.00 0.00 H new ATOM 0 HG3 ARG A 42 51.003 38.019 25.348 1.00 0.00 H new ATOM 0 HD2 ARG A 42 52.184 39.253 27.862 1.00 0.00 H new ATOM 0 HD3 ARG A 42 51.451 37.667 27.726 1.00 0.00 H new ATOM 0 HE ARG A 42 54.141 38.465 26.910 1.00 0.00 H new ATOM 0 HH11 ARG A 42 51.674 35.863 26.515 1.00 0.00 H new ATOM 0 HH12 ARG A 42 52.908 34.698 26.024 1.00 0.00 H new ATOM 0 HH21 ARG A 42 55.610 36.889 26.258 1.00 0.00 H new ATOM 0 HH22 ARG A 42 55.049 35.257 25.884 1.00 0.00 H new ATOM 680 N LEU A 43 48.796 41.366 24.763 1.00 0.00 N ATOM 681 CA LEU A 43 47.751 42.197 25.325 1.00 0.00 C ATOM 682 C LEU A 43 47.050 41.529 26.508 1.00 0.00 C ATOM 683 O LEU A 43 46.687 40.357 26.448 1.00 0.00 O ATOM 684 CB LEU A 43 46.767 42.616 24.236 1.00 0.00 C ATOM 685 CG LEU A 43 47.352 43.475 23.119 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.269 43.773 22.087 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.905 44.806 23.618 1.00 0.00 C ATOM 0 H LEU A 43 48.431 40.572 24.236 1.00 0.00 H new ATOM 0 HA LEU A 43 48.218 43.097 25.725 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.338 41.717 23.793 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.948 43.164 24.702 1.00 0.00 H new ATOM 0 HG LEU A 43 48.176 42.906 22.688 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.686 44.387 21.289 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.897 42.837 21.669 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.448 44.308 22.565 1.00 0.00 H new ATOM 0 HD21 LEU A 43 48.307 45.371 22.777 1.00 0.00 H new ATOM 0 HD22 LEU A 43 47.106 45.377 24.091 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.698 44.622 24.343 1.00 0.00 H new ATOM 699 N ILE A 44 46.849 42.299 27.574 1.00 0.00 N ATOM 700 CA ILE A 44 46.264 41.880 28.832 1.00 0.00 C ATOM 701 C ILE A 44 45.038 42.729 29.174 1.00 0.00 C ATOM 702 O ILE A 44 45.054 43.944 28.989 1.00 0.00 O ATOM 703 CB ILE A 44 47.296 41.933 29.955 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.636 41.270 29.653 1.00 0.00 C ATOM 705 CG2 ILE A 44 46.729 41.377 31.258 1.00 0.00 C ATOM 706 CD1 ILE A 44 48.615 39.767 29.393 1.00 0.00 C ATOM 0 H ILE A 44 47.106 43.286 27.577 1.00 0.00 H new ATOM 0 HA ILE A 44 45.936 40.846 28.724 1.00 0.00 H new ATOM 0 HB ILE A 44 47.512 42.997 30.057 1.00 0.00 H new ATOM 0 HG12 ILE A 44 49.069 41.760 28.781 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.306 41.461 30.491 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.489 41.429 32.037 1.00 0.00 H new ATOM 0 HG22 ILE A 44 45.861 41.965 31.557 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.431 40.339 31.111 1.00 0.00 H new ATOM 0 HD11 ILE A 44 49.628 39.418 29.191 1.00 0.00 H new ATOM 0 HD12 ILE A 44 48.222 39.252 30.269 1.00 0.00 H new ATOM 0 HD13 ILE A 44 47.980 39.555 28.532 1.00 0.00 H new ATOM 718 N PHE A 45 43.994 42.103 29.711 1.00 0.00 N ATOM 719 CA PHE A 45 42.836 42.745 30.301 1.00 0.00 C ATOM 720 C PHE A 45 42.416 42.037 31.591 1.00 0.00 C ATOM 721 O PHE A 45 42.145 40.837 31.573 1.00 0.00 O ATOM 722 CB PHE A 45 41.686 42.725 29.298 1.00 0.00 C ATOM 723 CG PHE A 45 40.335 43.054 29.887 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.134 44.274 30.543 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.297 42.116 29.834 1.00 0.00 C ATOM 726 CE1 PHE A 45 38.912 44.542 31.170 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.065 42.391 30.440 1.00 0.00 C ATOM 728 CZ PHE A 45 37.879 43.597 31.125 1.00 0.00 C ATOM 0 H PHE A 45 43.936 41.085 29.745 1.00 0.00 H new ATOM 0 HA PHE A 45 43.093 43.775 30.549 1.00 0.00 H new ATOM 0 HB2 PHE A 45 41.904 43.436 28.501 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.638 41.737 28.840 1.00 0.00 H new ATOM 0 HD1 PHE A 45 40.924 45.010 30.565 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.447 41.176 29.323 1.00 0.00 H new ATOM 0 HE1 PHE A 45 38.765 45.478 31.689 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.260 41.674 30.379 1.00 0.00 H new ATOM 0 HZ PHE A 45 36.940 43.799 31.619 1.00 0.00 H new ATOM 738 N ALA A 46 42.331 42.759 32.704 1.00 0.00 N ATOM 739 CA ALA A 46 41.968 42.242 34.008 1.00 0.00 C ATOM 740 C ALA A 46 42.749 40.983 34.387 1.00 0.00 C ATOM 741 O ALA A 46 42.181 39.973 34.797 1.00 0.00 O ATOM 742 CB ALA A 46 40.450 42.104 34.091 1.00 0.00 C ATOM 0 H ALA A 46 42.522 43.761 32.717 1.00 0.00 H new ATOM 0 HA ALA A 46 42.267 42.956 34.775 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.173 41.715 35.071 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.987 43.080 33.944 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.104 41.418 33.318 1.00 0.00 H new ATOM 748 N GLY A 47 44.054 40.996 34.133 1.00 0.00 N ATOM 749 CA GLY A 47 44.958 39.877 34.304 1.00 0.00 C ATOM 750 C GLY A 47 44.812 38.718 33.317 1.00 0.00 C ATOM 751 O GLY A 47 45.689 37.857 33.293 1.00 0.00 O ATOM 0 H GLY A 47 44.527 41.830 33.786 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.979 40.252 34.239 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.826 39.484 35.312 1.00 0.00 H new ATOM 755 N LYS A 48 43.778 38.693 32.481 1.00 0.00 N ATOM 756 CA LYS A 48 43.537 37.707 31.447 1.00 0.00 C ATOM 757 C LYS A 48 44.384 38.027 30.213 1.00 0.00 C ATOM 758 O LYS A 48 44.354 39.156 29.732 1.00 0.00 O ATOM 759 CB LYS A 48 42.064 37.654 31.051 1.00 0.00 C ATOM 760 CG LYS A 48 41.079 37.584 32.216 1.00 0.00 C ATOM 761 CD LYS A 48 39.619 37.429 31.802 1.00 0.00 C ATOM 762 CE LYS A 48 39.102 38.557 30.913 1.00 0.00 C ATOM 763 NZ LYS A 48 37.665 38.418 30.625 1.00 0.00 N ATOM 0 H LYS A 48 43.047 39.404 32.514 1.00 0.00 H new ATOM 0 HA LYS A 48 43.817 36.733 31.848 1.00 0.00 H new ATOM 0 HB2 LYS A 48 41.833 38.536 30.454 1.00 0.00 H new ATOM 0 HB3 LYS A 48 41.907 36.786 30.411 1.00 0.00 H new ATOM 0 HG2 LYS A 48 41.353 36.746 32.857 1.00 0.00 H new ATOM 0 HG3 LYS A 48 41.179 38.489 32.815 1.00 0.00 H new ATOM 0 HD2 LYS A 48 39.500 36.482 31.276 1.00 0.00 H new ATOM 0 HD3 LYS A 48 39.002 37.375 32.699 1.00 0.00 H new ATOM 0 HE2 LYS A 48 39.283 39.515 31.401 1.00 0.00 H new ATOM 0 HE3 LYS A 48 39.660 38.566 29.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 37.448 38.874 29.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 37.417 37.409 30.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 37.114 38.873 31.381 1.00 0.00 H new ATOM 777 N GLN A 49 45.092 37.047 29.660 1.00 0.00 N ATOM 778 CA GLN A 49 45.760 37.205 28.383 1.00 0.00 C ATOM 779 C GLN A 49 44.754 37.134 27.234 1.00 0.00 C ATOM 780 O GLN A 49 43.950 36.209 27.149 1.00 0.00 O ATOM 781 CB GLN A 49 46.890 36.191 28.227 1.00 0.00 C ATOM 782 CG GLN A 49 47.565 36.317 26.864 1.00 0.00 C ATOM 783 CD GLN A 49 48.770 35.392 26.683 1.00 0.00 C ATOM 784 OE1 GLN A 49 49.890 35.840 26.449 1.00 0.00 O ATOM 785 NE2 GLN A 49 48.587 34.075 26.715 1.00 0.00 N ATOM 0 H GLN A 49 45.215 36.128 30.085 1.00 0.00 H new ATOM 0 HA GLN A 49 46.217 38.194 28.350 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.627 36.341 29.015 1.00 0.00 H new ATOM 0 HB3 GLN A 49 46.495 35.182 28.348 1.00 0.00 H new ATOM 0 HG2 GLN A 49 46.833 36.101 26.085 1.00 0.00 H new ATOM 0 HG3 GLN A 49 47.886 37.349 26.722 1.00 0.00 H new ATOM 0 HE21 GLN A 49 47.661 33.693 26.908 1.00 0.00 H new ATOM 0 HE22 GLN A 49 49.373 33.447 26.546 1.00 0.00 H new ATOM 794 N LEU A 50 44.861 38.086 26.311 1.00 0.00 N ATOM 795 CA LEU A 50 44.051 38.160 25.112 1.00 0.00 C ATOM 796 C LEU A 50 44.800 37.501 23.952 1.00 0.00 C ATOM 797 O LEU A 50 45.707 38.096 23.375 1.00 0.00 O ATOM 798 CB LEU A 50 43.704 39.622 24.845 1.00 0.00 C ATOM 799 CG LEU A 50 43.009 40.351 25.991 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.725 41.791 25.573 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.689 39.693 26.381 1.00 0.00 C ATOM 0 H LEU A 50 45.536 38.847 26.385 1.00 0.00 H new ATOM 0 HA LEU A 50 43.114 37.617 25.232 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.622 40.157 24.601 1.00 0.00 H new ATOM 0 HB3 LEU A 50 43.063 39.670 23.965 1.00 0.00 H new ATOM 0 HG LEU A 50 43.676 40.312 26.852 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.228 42.316 26.389 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.663 42.293 25.337 1.00 0.00 H new ATOM 0 HD13 LEU A 50 42.080 41.794 24.694 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.233 40.249 27.200 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.015 39.693 25.524 1.00 0.00 H new ATOM 0 HD23 LEU A 50 41.874 38.666 26.698 1.00 0.00 H new ATOM 813 N GLU A 51 44.456 36.255 23.636 1.00 0.00 N ATOM 814 CA GLU A 51 45.030 35.513 22.532 1.00 0.00 C ATOM 815 C GLU A 51 44.248 35.693 21.230 1.00 0.00 C ATOM 816 O GLU A 51 43.035 35.891 21.230 1.00 0.00 O ATOM 817 CB GLU A 51 45.191 34.037 22.883 1.00 0.00 C ATOM 818 CG GLU A 51 46.222 33.824 23.988 1.00 0.00 C ATOM 819 CD GLU A 51 46.627 32.354 24.119 1.00 0.00 C ATOM 820 OE1 GLU A 51 46.004 31.612 24.909 1.00 0.00 O ATOM 821 OE2 GLU A 51 47.602 31.929 23.462 1.00 0.00 O ATOM 0 H GLU A 51 43.755 35.727 24.156 1.00 0.00 H new ATOM 0 HA GLU A 51 46.022 35.930 22.358 1.00 0.00 H new ATOM 0 HB2 GLU A 51 44.230 33.632 23.200 1.00 0.00 H new ATOM 0 HB3 GLU A 51 45.492 33.483 21.994 1.00 0.00 H new ATOM 0 HG2 GLU A 51 47.106 34.426 23.780 1.00 0.00 H new ATOM 0 HG3 GLU A 51 45.814 34.174 24.936 1.00 0.00 H new ATOM 828 N ASP A 52 44.961 35.602 20.111 1.00 0.00 N ATOM 829 CA ASP A 52 44.446 35.769 18.767 1.00 0.00 C ATOM 830 C ASP A 52 43.393 34.719 18.408 1.00 0.00 C ATOM 831 O ASP A 52 43.428 33.589 18.891 1.00 0.00 O ATOM 832 CB ASP A 52 45.592 35.713 17.760 1.00 0.00 C ATOM 833 CG ASP A 52 46.706 36.709 18.087 1.00 0.00 C ATOM 834 OD1 ASP A 52 46.535 37.937 17.923 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.780 36.268 18.552 1.00 0.00 O ATOM 0 H ASP A 52 45.961 35.400 20.124 1.00 0.00 H new ATOM 0 HA ASP A 52 43.960 36.744 18.728 1.00 0.00 H new ATOM 0 HB2 ASP A 52 46.005 34.704 17.739 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.205 35.920 16.762 1.00 0.00 H new ATOM 840 N GLY A 53 42.474 35.080 17.517 1.00 0.00 N ATOM 841 CA GLY A 53 41.398 34.230 17.049 1.00 0.00 C ATOM 842 C GLY A 53 40.089 34.365 17.832 1.00 0.00 C ATOM 843 O GLY A 53 39.167 33.597 17.571 1.00 0.00 O ATOM 0 H GLY A 53 42.463 36.006 17.090 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.204 34.457 16.001 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.727 33.192 17.094 1.00 0.00 H new ATOM 847 N ARG A 54 39.982 35.312 18.760 1.00 0.00 N ATOM 848 CA ARG A 54 38.772 35.642 19.486 1.00 0.00 C ATOM 849 C ARG A 54 38.529 37.152 19.519 1.00 0.00 C ATOM 850 O ARG A 54 39.412 37.942 19.193 1.00 0.00 O ATOM 851 CB ARG A 54 38.818 35.035 20.885 1.00 0.00 C ATOM 852 CG ARG A 54 38.793 33.511 20.959 1.00 0.00 C ATOM 853 CD ARG A 54 37.502 32.885 20.441 1.00 0.00 C ATOM 854 NE ARG A 54 37.552 31.426 20.540 1.00 0.00 N ATOM 855 CZ ARG A 54 37.086 30.530 19.658 1.00 0.00 C ATOM 856 NH1 ARG A 54 36.426 30.884 18.547 1.00 0.00 N ATOM 857 NH2 ARG A 54 37.241 29.215 19.866 1.00 0.00 N ATOM 0 H ARG A 54 40.775 35.892 19.034 1.00 0.00 H new ATOM 0 HA ARG A 54 37.922 35.207 18.960 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.722 35.387 21.382 1.00 0.00 H new ATOM 0 HB3 ARG A 54 37.971 35.420 21.453 1.00 0.00 H new ATOM 0 HG2 ARG A 54 39.632 33.116 20.386 1.00 0.00 H new ATOM 0 HG3 ARG A 54 38.943 33.205 21.995 1.00 0.00 H new ATOM 0 HD2 ARG A 54 36.655 33.263 21.013 1.00 0.00 H new ATOM 0 HD3 ARG A 54 37.342 33.178 19.403 1.00 0.00 H new ATOM 0 HE ARG A 54 37.993 31.046 21.378 1.00 0.00 H new ATOM 0 HH11 ARG A 54 36.260 31.870 18.344 1.00 0.00 H new ATOM 0 HH12 ARG A 54 36.089 30.168 17.904 1.00 0.00 H new ATOM 0 HH21 ARG A 54 37.719 28.884 20.704 1.00 0.00 H new ATOM 0 HH22 ARG A 54 36.881 28.545 19.186 1.00 0.00 H new ATOM 871 N THR A 55 37.313 37.547 19.885 1.00 0.00 N ATOM 872 CA THR A 55 36.785 38.894 19.800 1.00 0.00 C ATOM 873 C THR A 55 36.639 39.587 21.157 1.00 0.00 C ATOM 874 O THR A 55 36.560 38.936 22.196 1.00 0.00 O ATOM 875 CB THR A 55 35.446 38.903 19.068 1.00 0.00 C ATOM 876 OG1 THR A 55 34.589 37.935 19.629 1.00 0.00 O ATOM 877 CG2 THR A 55 35.595 38.573 17.586 1.00 0.00 C ATOM 0 H THR A 55 36.634 36.891 20.271 1.00 0.00 H new ATOM 0 HA THR A 55 37.523 39.465 19.236 1.00 0.00 H new ATOM 0 HB THR A 55 35.040 39.909 19.172 1.00 0.00 H new ATOM 0 HG1 THR A 55 33.730 37.946 19.157 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.615 38.592 17.109 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.244 39.310 17.113 1.00 0.00 H new ATOM 0 HG23 THR A 55 36.033 37.581 17.476 1.00 0.00 H new ATOM 885 N LEU A 56 36.574 40.915 21.149 1.00 0.00 N ATOM 886 CA LEU A 56 36.414 41.720 22.343 1.00 0.00 C ATOM 887 C LEU A 56 35.160 41.363 23.144 1.00 0.00 C ATOM 888 O LEU A 56 35.248 41.201 24.358 1.00 0.00 O ATOM 889 CB LEU A 56 36.418 43.201 21.976 1.00 0.00 C ATOM 890 CG LEU A 56 37.730 43.754 21.427 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.571 45.248 21.162 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.893 43.577 22.399 1.00 0.00 C ATOM 0 H LEU A 56 36.633 41.467 20.293 1.00 0.00 H new ATOM 0 HA LEU A 56 37.262 41.502 22.992 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.637 43.373 21.235 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.148 43.775 22.863 1.00 0.00 H new ATOM 0 HG LEU A 56 37.954 43.199 20.516 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.505 45.649 20.769 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.774 45.406 20.435 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.320 45.758 22.092 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.801 43.988 21.958 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.672 44.100 23.329 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.037 42.516 22.605 1.00 0.00 H new ATOM 904 N SER A 57 34.019 41.172 22.488 1.00 0.00 N ATOM 905 CA SER A 57 32.790 40.734 23.118 1.00 0.00 C ATOM 906 C SER A 57 32.922 39.376 23.811 1.00 0.00 C ATOM 907 O SER A 57 32.408 39.198 24.914 1.00 0.00 O ATOM 908 CB SER A 57 31.660 40.702 22.094 1.00 0.00 C ATOM 909 OG SER A 57 31.885 39.690 21.136 1.00 0.00 O ATOM 0 H SER A 57 33.927 41.322 21.483 1.00 0.00 H new ATOM 0 HA SER A 57 32.559 41.458 23.899 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.710 40.527 22.599 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.584 41.670 21.598 1.00 0.00 H new ATOM 0 HG SER A 57 31.149 39.683 20.488 1.00 0.00 H new ATOM 915 N ASP A 58 33.650 38.438 23.210 1.00 0.00 N ATOM 916 CA ASP A 58 33.881 37.110 23.740 1.00 0.00 C ATOM 917 C ASP A 58 34.791 37.128 24.970 1.00 0.00 C ATOM 918 O ASP A 58 34.526 36.407 25.930 1.00 0.00 O ATOM 919 CB ASP A 58 34.426 36.209 22.636 1.00 0.00 C ATOM 920 CG ASP A 58 34.391 34.731 23.033 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.335 34.091 22.843 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.428 34.211 23.501 1.00 0.00 O ATOM 0 H ASP A 58 34.107 38.593 22.312 1.00 0.00 H new ATOM 0 HA ASP A 58 32.929 36.704 24.083 1.00 0.00 H new ATOM 0 HB2 ASP A 58 33.841 36.354 21.728 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.451 36.498 22.405 1.00 0.00 H new ATOM 927 N TYR A 59 35.793 38.002 25.005 1.00 0.00 N ATOM 928 CA TYR A 59 36.600 38.283 26.176 1.00 0.00 C ATOM 929 C TYR A 59 35.912 39.170 27.215 1.00 0.00 C ATOM 930 O TYR A 59 36.519 39.483 28.237 1.00 0.00 O ATOM 931 CB TYR A 59 37.945 38.863 25.749 1.00 0.00 C ATOM 932 CG TYR A 59 38.913 37.875 25.146 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.463 36.870 25.951 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.325 38.002 23.813 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.406 35.979 25.425 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.286 37.130 23.286 1.00 0.00 C ATOM 937 CZ TYR A 59 40.825 36.102 24.086 1.00 0.00 C ATOM 938 OH TYR A 59 41.737 35.227 23.574 1.00 0.00 O ATOM 0 H TYR A 59 36.070 38.549 24.190 1.00 0.00 H new ATOM 0 HA TYR A 59 36.755 37.331 26.683 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.766 39.658 25.025 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.416 39.323 26.618 1.00 0.00 H new ATOM 0 HD1 TYR A 59 39.158 36.782 26.983 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.900 38.775 23.190 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.813 35.196 26.047 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.615 37.245 22.264 1.00 0.00 H new ATOM 0 HH TYR A 59 42.113 35.593 22.746 1.00 0.00 H new ATOM 948 N ASN A 60 34.657 39.556 27.003 1.00 0.00 N ATOM 949 CA ASN A 60 33.879 40.414 27.875 1.00 0.00 C ATOM 950 C ASN A 60 34.498 41.798 28.078 1.00 0.00 C ATOM 951 O ASN A 60 34.480 42.358 29.172 1.00 0.00 O ATOM 952 CB ASN A 60 33.506 39.650 29.143 1.00 0.00 C ATOM 953 CG ASN A 60 32.214 40.147 29.795 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.160 39.524 29.684 1.00 0.00 O ATOM 955 ND2 ASN A 60 32.238 41.281 30.490 1.00 0.00 N ATOM 0 H ASN A 60 34.135 39.262 26.178 1.00 0.00 H new ATOM 0 HA ASN A 60 32.938 40.667 27.387 1.00 0.00 H new ATOM 0 HB2 ASN A 60 33.399 38.592 28.903 1.00 0.00 H new ATOM 0 HB3 ASN A 60 34.322 39.733 29.861 1.00 0.00 H new ATOM 0 HD21 ASN A 60 31.385 41.629 30.927 1.00 0.00 H new ATOM 0 HD22 ASN A 60 33.110 41.802 30.586 1.00 0.00 H new ATOM 962 N ILE A 61 35.061 42.372 27.019 1.00 0.00 N ATOM 963 CA ILE A 61 35.602 43.716 26.999 1.00 0.00 C ATOM 964 C ILE A 61 34.492 44.684 26.584 1.00 0.00 C ATOM 965 O ILE A 61 33.855 44.512 25.547 1.00 0.00 O ATOM 966 CB ILE A 61 36.854 43.782 26.129 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.968 42.953 26.761 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.321 45.223 25.936 1.00 0.00 C ATOM 969 CD1 ILE A 61 39.103 42.584 25.811 1.00 0.00 C ATOM 0 H ILE A 61 35.153 41.893 26.123 1.00 0.00 H new ATOM 0 HA ILE A 61 35.936 44.018 27.992 1.00 0.00 H new ATOM 0 HB ILE A 61 36.608 43.374 25.149 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.382 43.507 27.603 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.537 42.037 27.164 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.215 45.235 25.312 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.532 45.799 25.452 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.550 45.664 26.906 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.849 41.996 26.346 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.707 41.999 24.981 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.566 43.493 25.426 1.00 0.00 H new ATOM 981 N GLN A 62 34.254 45.691 27.420 1.00 0.00 N ATOM 982 CA GLN A 62 33.175 46.652 27.311 1.00 0.00 C ATOM 983 C GLN A 62 33.723 48.076 27.194 1.00 0.00 C ATOM 984 O GLN A 62 34.918 48.312 27.362 1.00 0.00 O ATOM 985 CB GLN A 62 32.250 46.477 28.512 1.00 0.00 C ATOM 986 CG GLN A 62 31.566 45.112 28.516 1.00 0.00 C ATOM 987 CD GLN A 62 30.609 44.889 29.688 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.504 45.668 30.633 1.00 0.00 O ATOM 989 NE2 GLN A 62 29.853 43.794 29.674 1.00 0.00 N ATOM 0 H GLN A 62 34.844 45.862 28.234 1.00 0.00 H new ATOM 0 HA GLN A 62 32.600 46.475 26.402 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.823 46.597 29.431 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.493 47.261 28.503 1.00 0.00 H new ATOM 0 HG2 GLN A 62 31.014 44.993 27.584 1.00 0.00 H new ATOM 0 HG3 GLN A 62 32.331 44.336 28.534 1.00 0.00 H new ATOM 0 HE21 GLN A 62 29.925 43.135 28.899 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.202 43.614 30.438 1.00 0.00 H new ATOM 998 N LYS A 63 32.858 49.043 26.899 1.00 0.00 N ATOM 999 CA LYS A 63 33.235 50.435 26.760 1.00 0.00 C ATOM 1000 C LYS A 63 33.927 50.968 28.015 1.00 0.00 C ATOM 1001 O LYS A 63 33.500 50.686 29.133 1.00 0.00 O ATOM 1002 CB LYS A 63 32.041 51.282 26.327 1.00 0.00 C ATOM 1003 CG LYS A 63 30.922 51.399 27.358 1.00 0.00 C ATOM 1004 CD LYS A 63 29.728 52.162 26.793 1.00 0.00 C ATOM 1005 CE LYS A 63 28.641 52.270 27.857 1.00 0.00 C ATOM 1006 NZ LYS A 63 27.500 53.069 27.383 1.00 0.00 N ATOM 0 H LYS A 63 31.864 48.873 26.749 1.00 0.00 H new ATOM 0 HA LYS A 63 33.976 50.507 25.964 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.395 52.284 26.083 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.628 50.858 25.412 1.00 0.00 H new ATOM 0 HG2 LYS A 63 30.606 50.404 27.670 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.295 51.908 28.247 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.038 53.157 26.473 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.340 51.650 25.913 1.00 0.00 H new ATOM 0 HE2 LYS A 63 28.299 51.272 28.132 1.00 0.00 H new ATOM 0 HE3 LYS A 63 29.055 52.724 28.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 26.779 53.122 28.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 27.823 54.028 27.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 27.090 52.622 26.538 1.00 0.00 H new ATOM 1020 N GLU A 64 35.010 51.715 27.824 1.00 0.00 N ATOM 1021 CA GLU A 64 35.860 52.290 28.847 1.00 0.00 C ATOM 1022 C GLU A 64 36.500 51.292 29.814 1.00 0.00 C ATOM 1023 O GLU A 64 36.912 51.652 30.914 1.00 0.00 O ATOM 1024 CB GLU A 64 35.185 53.488 29.507 1.00 0.00 C ATOM 1025 CG GLU A 64 34.907 54.605 28.505 1.00 0.00 C ATOM 1026 CD GLU A 64 34.301 55.845 29.163 1.00 0.00 C ATOM 1027 OE1 GLU A 64 34.811 56.312 30.205 1.00 0.00 O ATOM 1028 OE2 GLU A 64 33.306 56.389 28.638 1.00 0.00 O ATOM 0 H GLU A 64 35.334 51.947 26.885 1.00 0.00 H new ATOM 0 HA GLU A 64 36.741 52.670 28.330 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.249 53.170 29.966 1.00 0.00 H new ATOM 0 HB3 GLU A 64 35.820 53.868 30.308 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.836 54.880 28.006 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.228 54.238 27.735 1.00 0.00 H new ATOM 1035 N SER A 65 36.643 50.039 29.390 1.00 0.00 N ATOM 1036 CA SER A 65 37.609 49.106 29.935 1.00 0.00 C ATOM 1037 C SER A 65 39.013 49.405 29.404 1.00 0.00 C ATOM 1038 O SER A 65 39.157 50.036 28.359 1.00 0.00 O ATOM 1039 CB SER A 65 37.195 47.665 29.655 1.00 0.00 C ATOM 1040 OG SER A 65 35.999 47.379 30.346 1.00 0.00 O ATOM 0 H SER A 65 36.075 49.641 28.642 1.00 0.00 H new ATOM 0 HA SER A 65 37.634 49.232 31.017 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.054 47.517 28.584 1.00 0.00 H new ATOM 0 HB3 SER A 65 37.983 46.981 29.970 1.00 0.00 H new ATOM 0 HG SER A 65 35.730 46.454 30.166 1.00 0.00 H new ATOM 1046 N THR A 66 40.049 48.966 30.113 1.00 0.00 N ATOM 1047 CA THR A 66 41.428 49.324 29.850 1.00 0.00 C ATOM 1048 C THR A 66 42.310 48.105 29.572 1.00 0.00 C ATOM 1049 O THR A 66 42.323 47.158 30.356 1.00 0.00 O ATOM 1050 CB THR A 66 42.023 50.152 30.986 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.212 51.276 31.244 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.410 50.702 30.665 1.00 0.00 C ATOM 0 H THR A 66 39.943 48.334 30.907 1.00 0.00 H new ATOM 0 HA THR A 66 41.411 49.933 28.946 1.00 0.00 H new ATOM 0 HB THR A 66 42.085 49.474 31.837 1.00 0.00 H new ATOM 0 HG1 THR A 66 41.601 51.799 31.975 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.777 51.281 31.513 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.092 49.875 30.468 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.353 51.343 29.785 1.00 0.00 H new ATOM 1060 N LEU A 67 43.080 48.143 28.488 1.00 0.00 N ATOM 1061 CA LEU A 67 44.047 47.138 28.095 1.00 0.00 C ATOM 1062 C LEU A 67 45.476 47.532 28.477 1.00 0.00 C ATOM 1063 O LEU A 67 45.795 48.715 28.568 1.00 0.00 O ATOM 1064 CB LEU A 67 43.974 46.860 26.596 1.00 0.00 C ATOM 1065 CG LEU A 67 42.593 46.652 25.983 1.00 0.00 C ATOM 1066 CD1 LEU A 67 42.746 46.242 24.520 1.00 0.00 C ATOM 1067 CD2 LEU A 67 41.794 45.553 26.679 1.00 0.00 C ATOM 0 H LEU A 67 43.039 48.920 27.829 1.00 0.00 H new ATOM 0 HA LEU A 67 43.789 46.230 28.640 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.450 47.691 26.077 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.571 45.971 26.390 1.00 0.00 H new ATOM 0 HG LEU A 67 42.059 47.596 26.094 1.00 0.00 H new ATOM 0 HD11 LEU A 67 41.760 46.093 24.079 1.00 0.00 H new ATOM 0 HD12 LEU A 67 43.272 47.026 23.975 1.00 0.00 H new ATOM 0 HD13 LEU A 67 43.315 45.314 24.460 1.00 0.00 H new ATOM 0 HD21 LEU A 67 40.821 45.451 26.199 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.335 44.609 26.607 1.00 0.00 H new ATOM 0 HD23 LEU A 67 41.655 45.813 27.728 1.00 0.00 H new ATOM 1079 N HIS A 68 46.340 46.540 28.669 1.00 0.00 N ATOM 1080 CA HIS A 68 47.754 46.694 28.946 1.00 0.00 C ATOM 1081 C HIS A 68 48.625 45.926 27.949 1.00 0.00 C ATOM 1082 O HIS A 68 48.175 44.938 27.373 1.00 0.00 O ATOM 1083 CB HIS A 68 48.035 46.263 30.383 1.00 0.00 C ATOM 1084 CG HIS A 68 47.844 47.365 31.387 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.859 47.890 32.187 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.673 48.017 31.676 1.00 0.00 C ATOM 1087 CE1 HIS A 68 48.297 48.854 32.920 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.989 48.959 32.635 1.00 0.00 N ATOM 0 H HIS A 68 46.054 45.562 28.633 1.00 0.00 H new ATOM 0 HA HIS A 68 48.017 47.745 28.829 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.379 45.431 30.639 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.059 45.894 30.450 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.702 47.832 31.242 1.00 0.00 H new ATOM 0 HE1 HIS A 68 48.821 49.464 33.641 1.00 0.00 H new ATOM 0 HE2 HIS A 68 46.339 49.623 33.056 1.00 0.00 H new ATOM 1096 N LEU A 69 49.858 46.375 27.733 1.00 0.00 N ATOM 1097 CA LEU A 69 50.793 45.837 26.766 1.00 0.00 C ATOM 1098 C LEU A 69 52.069 45.305 27.423 1.00 0.00 C ATOM 1099 O LEU A 69 52.703 45.984 28.226 1.00 0.00 O ATOM 1100 CB LEU A 69 51.115 46.911 25.731 1.00 0.00 C ATOM 1101 CG LEU A 69 52.132 46.532 24.659 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.663 45.414 23.734 1.00 0.00 C ATOM 1103 CD2 LEU A 69 52.432 47.747 23.786 1.00 0.00 C ATOM 0 H LEU A 69 50.245 47.161 28.255 1.00 0.00 H new ATOM 0 HA LEU A 69 50.325 44.984 26.275 1.00 0.00 H new ATOM 0 HB2 LEU A 69 50.187 47.199 25.236 1.00 0.00 H new ATOM 0 HB3 LEU A 69 51.483 47.793 26.256 1.00 0.00 H new ATOM 0 HG LEU A 69 53.012 46.180 25.197 1.00 0.00 H new ATOM 0 HD11 LEU A 69 52.439 45.200 22.999 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.462 44.517 24.320 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.753 45.724 23.221 1.00 0.00 H new ATOM 0 HD21 LEU A 69 53.159 47.475 23.021 1.00 0.00 H new ATOM 0 HD22 LEU A 69 51.513 48.088 23.309 1.00 0.00 H new ATOM 0 HD23 LEU A 69 52.839 48.548 24.404 1.00 0.00 H new ATOM 1115 N VAL A 70 52.492 44.118 26.997 1.00 0.00 N ATOM 1116 CA VAL A 70 53.786 43.519 27.252 1.00 0.00 C ATOM 1117 C VAL A 70 54.395 43.127 25.904 1.00 0.00 C ATOM 1118 O VAL A 70 53.665 42.860 24.952 1.00 0.00 O ATOM 1119 CB VAL A 70 53.632 42.337 28.205 1.00 0.00 C ATOM 1120 CG1 VAL A 70 54.966 41.700 28.581 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.947 42.734 29.510 1.00 0.00 C ATOM 0 H VAL A 70 51.897 43.515 26.429 1.00 0.00 H new ATOM 0 HA VAL A 70 54.462 44.219 27.743 1.00 0.00 H new ATOM 0 HB VAL A 70 53.022 41.622 27.653 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.792 40.865 29.260 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.463 41.338 27.681 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.598 42.441 29.071 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.860 41.860 30.156 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.538 43.499 30.013 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.953 43.126 29.295 1.00 0.00 H new