USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=16 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 60 ASN : amide:sc= 0.859 K(o=2,f=-1.1) USER MOD Set 1.2: A 62 GLN : amide:sc= 1.13 K(o=2,f=-0.36) USER MOD Set 2.1: A 55 THR OG1 : rot -68:sc= 0.759 USER MOD Set 2.2: A 57 SER OG : rot -80:sc= 1.02 USER MOD Single : A 1 MET CE :methyl 171:sc= 0 (180deg=-0.125) USER MOD Single : A 1 MET N :NH3+ -160:sc= 2.42 (180deg=1.88) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 159:sc= 0.597 (180deg=-0.033!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00807 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.00345 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 27 LYS NZ :NH3+ -159:sc= 1.58 (180deg=1.2) USER MOD Single : A 29 LYS NZ :NH3+ 152:sc= 1.27 (180deg=0.934) USER MOD Single : A 31 GLN : amide:sc= -0.289 K(o=-0.29,f=-1.3) USER MOD Single : A 33 LYS NZ :NH3+ 159:sc= 0.941 (180deg=0.646) USER MOD Single : A 40 GLN : amide:sc= -0.0512 K(o=-0.051,f=-0.57) USER MOD Single : A 41 GLN : amide:sc= 0.984 K(o=0.98,f=-2.6!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.691 K(o=0.69,f=-4.8!) USER MOD Single : A 59 TYR OH : rot 50:sc= 0.205 USER MOD Single : A 63 LYS NZ :NH3+ -170:sc= 0.704 (180deg=0.647) USER MOD Single : A 65 SER OG : rot -160:sc= 0.0552 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.129 X(o=-0.13,f=-0.29) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 33.192 51.966 19.508 1.00 0.00 N ATOM 2 CA MET A 1 33.398 51.833 20.958 1.00 0.00 C ATOM 3 C MET A 1 34.813 52.293 21.317 1.00 0.00 C ATOM 4 O MET A 1 35.765 51.906 20.644 1.00 0.00 O ATOM 5 CB MET A 1 33.146 50.396 21.408 1.00 0.00 C ATOM 6 CG MET A 1 33.280 50.177 22.913 1.00 0.00 C ATOM 7 SD MET A 1 32.844 48.495 23.419 1.00 0.00 S ATOM 8 CE MET A 1 34.273 47.554 22.829 1.00 0.00 C ATOM 0 H1 MET A 1 32.173 51.987 19.303 1.00 0.00 H new ATOM 0 H2 MET A 1 33.630 52.848 19.175 1.00 0.00 H new ATOM 0 H3 MET A 1 33.627 51.157 19.020 1.00 0.00 H new ATOM 0 HA MET A 1 32.684 52.467 21.484 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.144 50.101 21.097 1.00 0.00 H new ATOM 0 HB3 MET A 1 33.846 49.738 20.893 1.00 0.00 H new ATOM 0 HG2 MET A 1 34.305 50.388 23.216 1.00 0.00 H new ATOM 0 HG3 MET A 1 32.640 50.887 23.437 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.219 46.534 23.209 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.272 47.536 21.739 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.190 48.025 23.183 1.00 0.00 H new ATOM 20 N GLN A 2 34.979 53.066 22.387 1.00 0.00 N ATOM 21 CA GLN A 2 36.277 53.505 22.860 1.00 0.00 C ATOM 22 C GLN A 2 36.884 52.494 23.834 1.00 0.00 C ATOM 23 O GLN A 2 36.184 52.041 24.738 1.00 0.00 O ATOM 24 CB GLN A 2 36.180 54.868 23.538 1.00 0.00 C ATOM 25 CG GLN A 2 35.603 55.967 22.650 1.00 0.00 C ATOM 26 CD GLN A 2 35.769 57.368 23.242 1.00 0.00 C ATOM 27 OE1 GLN A 2 36.141 57.561 24.398 1.00 0.00 O ATOM 28 NE2 GLN A 2 35.487 58.416 22.474 1.00 0.00 N ATOM 0 H GLN A 2 34.202 53.406 22.953 1.00 0.00 H new ATOM 0 HA GLN A 2 36.926 53.586 21.988 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.561 54.775 24.430 1.00 0.00 H new ATOM 0 HB3 GLN A 2 37.174 55.168 23.870 1.00 0.00 H new ATOM 0 HG2 GLN A 2 36.090 55.931 21.675 1.00 0.00 H new ATOM 0 HG3 GLN A 2 34.543 55.773 22.484 1.00 0.00 H new ATOM 0 HE21 GLN A 2 35.177 58.275 21.513 1.00 0.00 H new ATOM 0 HE22 GLN A 2 35.581 59.361 22.846 1.00 0.00 H new ATOM 37 N ILE A 3 38.174 52.193 23.715 1.00 0.00 N ATOM 38 CA ILE A 3 38.948 51.491 24.718 1.00 0.00 C ATOM 39 C ILE A 3 40.331 52.123 24.887 1.00 0.00 C ATOM 40 O ILE A 3 40.784 52.866 24.018 1.00 0.00 O ATOM 41 CB ILE A 3 39.060 49.990 24.462 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.836 49.652 23.193 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.691 49.317 24.493 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.174 48.171 23.048 1.00 0.00 C ATOM 0 H ILE A 3 38.720 52.441 22.890 1.00 0.00 H new ATOM 0 HA ILE A 3 38.396 51.597 25.652 1.00 0.00 H new ATOM 0 HB ILE A 3 39.649 49.581 25.283 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.253 49.967 22.328 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.761 50.228 23.181 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.806 48.249 24.307 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.233 49.468 25.471 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.054 49.753 23.723 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.725 48.013 22.121 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.785 47.853 23.893 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.253 47.588 23.026 1.00 0.00 H new ATOM 56 N PHE A 4 41.017 51.796 25.978 1.00 0.00 N ATOM 57 CA PHE A 4 42.349 52.280 26.276 1.00 0.00 C ATOM 58 C PHE A 4 43.359 51.135 26.373 1.00 0.00 C ATOM 59 O PHE A 4 43.032 50.074 26.898 1.00 0.00 O ATOM 60 CB PHE A 4 42.329 53.070 27.582 1.00 0.00 C ATOM 61 CG PHE A 4 41.290 54.162 27.668 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.425 55.326 26.904 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.206 54.027 28.544 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.480 56.353 27.017 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.271 55.060 28.671 1.00 0.00 C ATOM 66 CZ PHE A 4 39.403 56.223 27.903 1.00 0.00 C ATOM 0 H PHE A 4 40.647 51.171 26.694 1.00 0.00 H new ATOM 0 HA PHE A 4 42.662 52.928 25.458 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.167 52.373 28.405 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.312 53.516 27.731 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.259 55.433 26.226 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.091 53.123 29.123 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.582 57.247 26.420 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.447 54.960 29.362 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.677 57.017 27.993 1.00 0.00 H new ATOM 76 N VAL A 5 44.593 51.354 25.926 1.00 0.00 N ATOM 77 CA VAL A 5 45.688 50.414 26.057 1.00 0.00 C ATOM 78 C VAL A 5 46.911 51.112 26.657 1.00 0.00 C ATOM 79 O VAL A 5 47.470 52.017 26.042 1.00 0.00 O ATOM 80 CB VAL A 5 46.029 49.742 24.730 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.023 48.606 24.950 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.804 49.157 24.033 1.00 0.00 C ATOM 0 H VAL A 5 44.860 52.216 25.450 1.00 0.00 H new ATOM 0 HA VAL A 5 45.370 49.622 26.734 1.00 0.00 H new ATOM 0 HB VAL A 5 46.454 50.522 24.098 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.256 48.137 23.994 1.00 0.00 H new ATOM 0 HG12 VAL A 5 47.937 49.003 25.392 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.587 47.866 25.621 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.107 48.692 23.095 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.342 48.408 24.677 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.087 49.952 23.829 1.00 0.00 H new ATOM 92 N LYS A 6 47.344 50.700 27.844 1.00 0.00 N ATOM 93 CA LYS A 6 48.522 51.215 28.512 1.00 0.00 C ATOM 94 C LYS A 6 49.782 50.436 28.128 1.00 0.00 C ATOM 95 O LYS A 6 49.749 49.213 28.010 1.00 0.00 O ATOM 96 CB LYS A 6 48.271 51.260 30.017 1.00 0.00 C ATOM 97 CG LYS A 6 49.381 51.987 30.771 1.00 0.00 C ATOM 98 CD LYS A 6 48.963 52.240 32.217 1.00 0.00 C ATOM 99 CE LYS A 6 50.036 53.003 32.989 1.00 0.00 C ATOM 100 NZ LYS A 6 49.515 53.427 34.298 1.00 0.00 N ATOM 0 H LYS A 6 46.866 49.976 28.380 1.00 0.00 H new ATOM 0 HA LYS A 6 48.710 52.235 28.177 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.320 51.756 30.209 1.00 0.00 H new ATOM 0 HB3 LYS A 6 48.183 50.243 30.398 1.00 0.00 H new ATOM 0 HG2 LYS A 6 50.295 51.393 30.748 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.604 52.934 30.279 1.00 0.00 H new ATOM 0 HD2 LYS A 6 48.031 52.806 32.233 1.00 0.00 H new ATOM 0 HD3 LYS A 6 48.766 51.288 32.711 1.00 0.00 H new ATOM 0 HE2 LYS A 6 50.914 52.372 33.126 1.00 0.00 H new ATOM 0 HE3 LYS A 6 50.356 53.874 32.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 50.254 53.945 34.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 48.691 54.046 34.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 49.232 52.590 34.846 1.00 0.00 H new ATOM 168 N LYS A 11 52.692 55.308 28.919 1.00 0.00 N ATOM 169 CA LYS A 11 51.855 56.009 27.966 1.00 0.00 C ATOM 170 C LYS A 11 50.566 55.225 27.705 1.00 0.00 C ATOM 171 O LYS A 11 50.641 54.006 27.564 1.00 0.00 O ATOM 172 CB LYS A 11 52.678 56.196 26.695 1.00 0.00 C ATOM 173 CG LYS A 11 51.998 56.956 25.560 1.00 0.00 C ATOM 174 CD LYS A 11 52.871 56.865 24.311 1.00 0.00 C ATOM 175 CE LYS A 11 52.283 57.675 23.158 1.00 0.00 C ATOM 176 NZ LYS A 11 53.061 57.480 21.925 1.00 0.00 N ATOM 0 HA LYS A 11 51.549 56.982 28.351 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.598 56.720 26.956 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.966 55.212 26.325 1.00 0.00 H new ATOM 0 HG2 LYS A 11 51.012 56.535 25.362 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.849 57.999 25.841 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.873 57.229 24.539 1.00 0.00 H new ATOM 0 HD3 LYS A 11 52.971 55.822 24.011 1.00 0.00 H new ATOM 0 HE2 LYS A 11 51.248 57.377 22.990 1.00 0.00 H new ATOM 0 HE3 LYS A 11 52.271 58.733 23.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 52.476 57.729 21.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.904 58.088 21.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 53.354 56.485 21.853 1.00 0.00 H new ATOM 190 N THR A 12 49.424 55.893 27.570 1.00 0.00 N ATOM 191 CA THR A 12 48.153 55.268 27.266 1.00 0.00 C ATOM 192 C THR A 12 47.641 55.661 25.879 1.00 0.00 C ATOM 193 O THR A 12 47.531 56.837 25.541 1.00 0.00 O ATOM 194 CB THR A 12 47.105 55.539 28.341 1.00 0.00 C ATOM 195 OG1 THR A 12 47.560 55.031 29.576 1.00 0.00 O ATOM 196 CG2 THR A 12 45.777 54.836 28.075 1.00 0.00 C ATOM 0 H THR A 12 49.362 56.906 27.672 1.00 0.00 H new ATOM 0 HA THR A 12 48.332 54.193 27.256 1.00 0.00 H new ATOM 0 HB THR A 12 46.954 56.619 28.345 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.889 55.205 30.269 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.075 55.069 28.876 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.369 55.177 27.124 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.937 53.759 28.035 1.00 0.00 H new ATOM 204 N ILE A 13 47.302 54.655 25.076 1.00 0.00 N ATOM 205 CA ILE A 13 46.799 54.772 23.723 1.00 0.00 C ATOM 206 C ILE A 13 45.273 54.664 23.735 1.00 0.00 C ATOM 207 O ILE A 13 44.732 53.695 24.264 1.00 0.00 O ATOM 208 CB ILE A 13 47.428 53.716 22.818 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.937 53.565 22.993 1.00 0.00 C ATOM 210 CG2 ILE A 13 47.097 53.997 21.355 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.759 54.841 22.840 1.00 0.00 C ATOM 0 H ILE A 13 47.378 53.683 25.376 1.00 0.00 H new ATOM 0 HA ILE A 13 47.074 55.746 23.319 1.00 0.00 H new ATOM 0 HB ILE A 13 46.989 52.767 23.125 1.00 0.00 H new ATOM 0 HG12 ILE A 13 49.128 53.150 23.982 1.00 0.00 H new ATOM 0 HG13 ILE A 13 49.296 52.836 22.267 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.554 53.234 20.725 1.00 0.00 H new ATOM 0 HG22 ILE A 13 46.016 53.981 21.217 1.00 0.00 H new ATOM 0 HG23 ILE A 13 47.484 54.977 21.076 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.815 54.613 22.985 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.610 55.252 21.842 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.440 55.571 23.584 1.00 0.00 H new ATOM 223 N THR A 14 44.580 55.631 23.141 1.00 0.00 N ATOM 224 CA THR A 14 43.143 55.615 22.965 1.00 0.00 C ATOM 225 C THR A 14 42.790 55.044 21.591 1.00 0.00 C ATOM 226 O THR A 14 43.322 55.499 20.581 1.00 0.00 O ATOM 227 CB THR A 14 42.537 57.003 23.153 1.00 0.00 C ATOM 228 OG1 THR A 14 42.975 57.588 24.359 1.00 0.00 O ATOM 229 CG2 THR A 14 41.012 56.960 23.222 1.00 0.00 C ATOM 0 H THR A 14 45.021 56.468 22.760 1.00 0.00 H new ATOM 0 HA THR A 14 42.714 54.972 23.734 1.00 0.00 H new ATOM 0 HB THR A 14 42.860 57.584 22.289 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.574 58.477 24.456 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.625 57.970 23.356 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.618 56.540 22.297 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.703 56.339 24.063 1.00 0.00 H new ATOM 237 N LEU A 15 41.914 54.043 21.558 1.00 0.00 N ATOM 238 CA LEU A 15 41.502 53.331 20.364 1.00 0.00 C ATOM 239 C LEU A 15 40.005 53.479 20.085 1.00 0.00 C ATOM 240 O LEU A 15 39.213 53.760 20.981 1.00 0.00 O ATOM 241 CB LEU A 15 41.859 51.853 20.482 1.00 0.00 C ATOM 242 CG LEU A 15 43.324 51.507 20.736 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.481 49.989 20.776 1.00 0.00 C ATOM 244 CD2 LEU A 15 44.250 52.035 19.643 1.00 0.00 C ATOM 0 H LEU A 15 41.456 53.696 22.401 1.00 0.00 H new ATOM 0 HA LEU A 15 42.039 53.776 19.526 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.266 51.426 21.291 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.549 51.356 19.563 1.00 0.00 H new ATOM 0 HG LEU A 15 43.601 51.973 21.682 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.526 49.736 20.957 1.00 0.00 H new ATOM 0 HD12 LEU A 15 42.865 49.580 21.577 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.165 49.565 19.823 1.00 0.00 H new ATOM 0 HD21 LEU A 15 45.279 51.761 19.874 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.965 51.601 18.684 1.00 0.00 H new ATOM 0 HD23 LEU A 15 44.167 53.121 19.589 1.00 0.00 H new ATOM 256 N GLU A 16 39.612 53.212 18.843 1.00 0.00 N ATOM 257 CA GLU A 16 38.239 53.027 18.417 1.00 0.00 C ATOM 258 C GLU A 16 38.070 51.623 17.833 1.00 0.00 C ATOM 259 O GLU A 16 38.789 51.238 16.913 1.00 0.00 O ATOM 260 CB GLU A 16 37.878 54.116 17.412 1.00 0.00 C ATOM 261 CG GLU A 16 36.376 54.263 17.181 1.00 0.00 C ATOM 262 CD GLU A 16 35.641 54.820 18.401 1.00 0.00 C ATOM 263 OE1 GLU A 16 36.113 55.804 19.011 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.554 54.299 18.733 1.00 0.00 O ATOM 0 H GLU A 16 40.277 53.115 18.075 1.00 0.00 H new ATOM 0 HA GLU A 16 37.558 53.113 19.264 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.278 55.068 17.761 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.363 53.896 16.461 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.207 54.921 16.329 1.00 0.00 H new ATOM 0 HG3 GLU A 16 35.956 53.291 16.922 1.00 0.00 H new ATOM 271 N VAL A 17 37.169 50.829 18.402 1.00 0.00 N ATOM 272 CA VAL A 17 36.984 49.417 18.130 1.00 0.00 C ATOM 273 C VAL A 17 35.504 49.029 18.085 1.00 0.00 C ATOM 274 O VAL A 17 34.648 49.757 18.585 1.00 0.00 O ATOM 275 CB VAL A 17 37.720 48.558 19.154 1.00 0.00 C ATOM 276 CG1 VAL A 17 39.213 48.861 19.242 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.144 48.692 20.561 1.00 0.00 C ATOM 0 H VAL A 17 36.515 51.177 19.103 1.00 0.00 H new ATOM 0 HA VAL A 17 37.408 49.230 17.144 1.00 0.00 H new ATOM 0 HB VAL A 17 37.578 47.542 18.785 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.672 48.214 19.989 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.678 48.683 18.272 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.357 49.903 19.527 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.707 48.059 21.247 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.214 49.730 20.886 1.00 0.00 H new ATOM 0 HG23 VAL A 17 36.099 48.383 20.557 1.00 0.00 H new ATOM 287 N GLU A 18 35.192 47.849 17.558 1.00 0.00 N ATOM 288 CA GLU A 18 33.898 47.202 17.635 1.00 0.00 C ATOM 289 C GLU A 18 33.955 45.959 18.526 1.00 0.00 C ATOM 290 O GLU A 18 34.926 45.211 18.440 1.00 0.00 O ATOM 291 CB GLU A 18 33.439 46.794 16.238 1.00 0.00 C ATOM 292 CG GLU A 18 32.828 47.914 15.400 1.00 0.00 C ATOM 293 CD GLU A 18 31.536 48.472 15.999 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.680 47.697 16.480 1.00 0.00 O ATOM 295 OE2 GLU A 18 31.386 49.713 16.010 1.00 0.00 O ATOM 0 H GLU A 18 35.874 47.295 17.040 1.00 0.00 H new ATOM 0 HA GLU A 18 33.193 47.911 18.068 1.00 0.00 H new ATOM 0 HB2 GLU A 18 34.292 46.383 15.699 1.00 0.00 H new ATOM 0 HB3 GLU A 18 32.706 45.993 16.334 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.553 48.721 15.299 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.625 47.540 14.397 1.00 0.00 H new ATOM 302 N PRO A 19 32.934 45.640 19.317 1.00 0.00 N ATOM 303 CA PRO A 19 32.870 44.407 20.073 1.00 0.00 C ATOM 304 C PRO A 19 33.026 43.118 19.261 1.00 0.00 C ATOM 305 O PRO A 19 33.443 42.097 19.802 1.00 0.00 O ATOM 306 CB PRO A 19 31.525 44.433 20.795 1.00 0.00 C ATOM 307 CG PRO A 19 31.257 45.924 20.970 1.00 0.00 C ATOM 308 CD PRO A 19 31.848 46.521 19.696 1.00 0.00 C ATOM 0 HA PRO A 19 33.726 44.376 20.748 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.743 43.949 20.210 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.572 43.916 21.754 1.00 0.00 H new ATOM 0 HG2 PRO A 19 30.192 46.136 21.061 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.738 46.320 21.864 1.00 0.00 H new ATOM 0 HD2 PRO A 19 31.098 46.580 18.907 1.00 0.00 H new ATOM 0 HD3 PRO A 19 32.209 47.535 19.869 1.00 0.00 H new ATOM 316 N SER A 20 32.705 43.135 17.970 1.00 0.00 N ATOM 317 CA SER A 20 32.917 42.035 17.051 1.00 0.00 C ATOM 318 C SER A 20 34.351 41.872 16.543 1.00 0.00 C ATOM 319 O SER A 20 34.643 40.877 15.882 1.00 0.00 O ATOM 320 CB SER A 20 31.962 42.179 15.871 1.00 0.00 C ATOM 321 OG SER A 20 32.103 43.436 15.248 1.00 0.00 O ATOM 0 H SER A 20 32.275 43.946 17.526 1.00 0.00 H new ATOM 0 HA SER A 20 32.717 41.129 17.623 1.00 0.00 H new ATOM 0 HB2 SER A 20 32.154 41.388 15.146 1.00 0.00 H new ATOM 0 HB3 SER A 20 30.935 42.054 16.214 1.00 0.00 H new ATOM 0 HG SER A 20 31.480 43.499 14.494 1.00 0.00 H new ATOM 327 N ASP A 21 35.250 42.817 16.802 1.00 0.00 N ATOM 328 CA ASP A 21 36.615 42.781 16.316 1.00 0.00 C ATOM 329 C ASP A 21 37.473 41.753 17.056 1.00 0.00 C ATOM 330 O ASP A 21 37.327 41.529 18.256 1.00 0.00 O ATOM 331 CB ASP A 21 37.294 44.144 16.413 1.00 0.00 C ATOM 332 CG ASP A 21 36.736 45.231 15.492 1.00 0.00 C ATOM 333 OD1 ASP A 21 36.212 44.942 14.395 1.00 0.00 O ATOM 334 OD2 ASP A 21 36.922 46.416 15.845 1.00 0.00 O ATOM 0 H ASP A 21 35.041 43.641 17.366 1.00 0.00 H new ATOM 0 HA ASP A 21 36.539 42.489 15.269 1.00 0.00 H new ATOM 0 HB2 ASP A 21 37.220 44.493 17.443 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.354 44.017 16.194 1.00 0.00 H new ATOM 339 N THR A 22 38.403 41.154 16.317 1.00 0.00 N ATOM 340 CA THR A 22 39.380 40.200 16.801 1.00 0.00 C ATOM 341 C THR A 22 40.523 40.875 17.560 1.00 0.00 C ATOM 342 O THR A 22 40.912 42.002 17.262 1.00 0.00 O ATOM 343 CB THR A 22 39.961 39.352 15.674 1.00 0.00 C ATOM 344 OG1 THR A 22 40.436 40.162 14.622 1.00 0.00 O ATOM 345 CG2 THR A 22 38.929 38.390 15.095 1.00 0.00 C ATOM 0 H THR A 22 38.495 41.334 15.317 1.00 0.00 H new ATOM 0 HA THR A 22 38.838 39.551 17.489 1.00 0.00 H new ATOM 0 HB THR A 22 40.781 38.784 16.114 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.805 39.595 13.913 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.385 37.806 14.296 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.576 37.720 15.879 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.087 38.956 14.696 1.00 0.00 H new ATOM 353 N ILE A 23 41.138 40.164 18.501 1.00 0.00 N ATOM 354 CA ILE A 23 42.287 40.647 19.240 1.00 0.00 C ATOM 355 C ILE A 23 43.463 40.973 18.317 1.00 0.00 C ATOM 356 O ILE A 23 44.163 41.954 18.551 1.00 0.00 O ATOM 357 CB ILE A 23 42.648 39.648 20.336 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.546 39.448 21.372 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.960 39.979 21.043 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.017 40.703 22.059 1.00 0.00 C ATOM 0 H ILE A 23 40.844 39.225 18.771 1.00 0.00 H new ATOM 0 HA ILE A 23 42.029 41.590 19.721 1.00 0.00 H new ATOM 0 HB ILE A 23 42.774 38.709 19.798 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.709 38.947 20.886 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.920 38.771 22.140 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.159 39.231 21.810 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.774 39.980 20.318 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.886 40.963 21.506 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.239 40.428 22.771 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.832 41.200 22.585 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.602 41.379 21.312 1.00 0.00 H new ATOM 372 N GLU A 24 43.657 40.247 17.219 1.00 0.00 N ATOM 373 CA GLU A 24 44.688 40.594 16.262 1.00 0.00 C ATOM 374 C GLU A 24 44.417 41.880 15.478 1.00 0.00 C ATOM 375 O GLU A 24 45.373 42.554 15.101 1.00 0.00 O ATOM 376 CB GLU A 24 45.018 39.426 15.336 1.00 0.00 C ATOM 377 CG GLU A 24 44.009 39.162 14.223 1.00 0.00 C ATOM 378 CD GLU A 24 44.486 38.036 13.304 1.00 0.00 C ATOM 379 OE1 GLU A 24 45.602 38.136 12.749 1.00 0.00 O ATOM 380 OE2 GLU A 24 43.742 37.049 13.122 1.00 0.00 O ATOM 0 H GLU A 24 43.113 39.419 16.976 1.00 0.00 H new ATOM 0 HA GLU A 24 45.571 40.810 16.864 1.00 0.00 H new ATOM 0 HB2 GLU A 24 45.992 39.609 14.883 1.00 0.00 H new ATOM 0 HB3 GLU A 24 45.112 38.523 15.939 1.00 0.00 H new ATOM 0 HG2 GLU A 24 43.045 38.898 14.657 1.00 0.00 H new ATOM 0 HG3 GLU A 24 43.858 40.071 13.641 1.00 0.00 H new ATOM 387 N ASN A 25 43.159 42.259 15.273 1.00 0.00 N ATOM 388 CA ASN A 25 42.804 43.546 14.711 1.00 0.00 C ATOM 389 C ASN A 25 43.117 44.687 15.681 1.00 0.00 C ATOM 390 O ASN A 25 43.612 45.726 15.249 1.00 0.00 O ATOM 391 CB ASN A 25 41.341 43.540 14.277 1.00 0.00 C ATOM 392 CG ASN A 25 40.935 44.864 13.626 1.00 0.00 C ATOM 393 OD1 ASN A 25 40.230 45.681 14.214 1.00 0.00 O ATOM 394 ND2 ASN A 25 41.352 45.122 12.390 1.00 0.00 N ATOM 0 H ASN A 25 42.355 41.672 15.496 1.00 0.00 H new ATOM 0 HA ASN A 25 43.415 43.722 13.826 1.00 0.00 H new ATOM 0 HB2 ASN A 25 41.174 42.723 13.575 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.706 43.351 15.143 1.00 0.00 H new ATOM 0 HD21 ASN A 25 41.087 45.995 11.934 1.00 0.00 H new ATOM 0 HD22 ASN A 25 41.937 44.447 11.898 1.00 0.00 H new ATOM 401 N VAL A 26 42.949 44.486 16.985 1.00 0.00 N ATOM 402 CA VAL A 26 43.371 45.447 17.982 1.00 0.00 C ATOM 403 C VAL A 26 44.891 45.623 17.961 1.00 0.00 C ATOM 404 O VAL A 26 45.362 46.757 17.924 1.00 0.00 O ATOM 405 CB VAL A 26 42.870 45.087 19.378 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.257 46.134 20.418 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.349 44.967 19.411 1.00 0.00 C ATOM 0 H VAL A 26 42.515 43.649 17.374 1.00 0.00 H new ATOM 0 HA VAL A 26 42.916 46.403 17.723 1.00 0.00 H new ATOM 0 HB VAL A 26 43.339 44.133 19.617 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.878 45.834 21.395 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.343 46.221 20.461 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.827 47.097 20.143 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.026 44.710 20.420 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.903 45.917 19.118 1.00 0.00 H new ATOM 0 HG23 VAL A 26 41.030 44.188 18.718 1.00 0.00 H new ATOM 417 N LYS A 27 45.660 44.542 17.865 1.00 0.00 N ATOM 418 CA LYS A 27 47.093 44.608 17.658 1.00 0.00 C ATOM 419 C LYS A 27 47.473 45.365 16.385 1.00 0.00 C ATOM 420 O LYS A 27 48.426 46.142 16.392 1.00 0.00 O ATOM 421 CB LYS A 27 47.717 43.214 17.663 1.00 0.00 C ATOM 422 CG LYS A 27 47.680 42.486 19.002 1.00 0.00 C ATOM 423 CD LYS A 27 48.324 41.106 18.894 1.00 0.00 C ATOM 424 CE LYS A 27 48.388 40.395 20.243 1.00 0.00 C ATOM 425 NZ LYS A 27 48.995 39.059 20.131 1.00 0.00 N ATOM 0 H LYS A 27 45.298 43.591 17.930 1.00 0.00 H new ATOM 0 HA LYS A 27 47.498 45.174 18.497 1.00 0.00 H new ATOM 0 HB2 LYS A 27 47.204 42.602 16.922 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.756 43.298 17.343 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.202 43.076 19.755 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.647 42.384 19.336 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.758 40.496 18.190 1.00 0.00 H new ATOM 0 HD3 LYS A 27 49.331 41.207 18.490 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.965 40.998 20.944 1.00 0.00 H new ATOM 0 HE3 LYS A 27 47.382 40.304 20.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 48.711 38.479 20.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.673 38.604 19.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 50.031 39.149 20.115 1.00 0.00 H new ATOM 439 N ALA A 28 46.727 45.208 15.295 1.00 0.00 N ATOM 440 CA ALA A 28 46.964 45.920 14.056 1.00 0.00 C ATOM 441 C ALA A 28 46.583 47.401 14.103 1.00 0.00 C ATOM 442 O ALA A 28 47.235 48.217 13.457 1.00 0.00 O ATOM 443 CB ALA A 28 46.255 45.184 12.922 1.00 0.00 C ATOM 0 H ALA A 28 45.931 44.572 15.253 1.00 0.00 H new ATOM 0 HA ALA A 28 48.040 45.927 13.880 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.426 45.711 11.983 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.647 44.170 12.846 1.00 0.00 H new ATOM 0 HB3 ALA A 28 45.185 45.145 13.126 1.00 0.00 H new ATOM 449 N LYS A 29 45.594 47.799 14.899 1.00 0.00 N ATOM 450 CA LYS A 29 45.321 49.196 15.166 1.00 0.00 C ATOM 451 C LYS A 29 46.404 49.836 16.038 1.00 0.00 C ATOM 452 O LYS A 29 46.767 50.987 15.804 1.00 0.00 O ATOM 453 CB LYS A 29 43.934 49.382 15.777 1.00 0.00 C ATOM 454 CG LYS A 29 42.841 49.217 14.725 1.00 0.00 C ATOM 455 CD LYS A 29 41.470 49.551 15.304 1.00 0.00 C ATOM 456 CE LYS A 29 40.402 49.392 14.225 1.00 0.00 C ATOM 457 NZ LYS A 29 39.052 49.492 14.801 1.00 0.00 N ATOM 0 H LYS A 29 44.962 47.155 15.375 1.00 0.00 H new ATOM 0 HA LYS A 29 45.336 49.714 14.207 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.786 48.656 16.576 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.862 50.372 16.228 1.00 0.00 H new ATOM 0 HG2 LYS A 29 43.049 49.867 13.875 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.842 48.193 14.352 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.250 48.894 16.146 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.465 50.572 15.686 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.534 50.159 13.462 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.520 48.428 13.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.393 49.851 14.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.739 48.552 15.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 39.068 50.143 15.612 1.00 0.00 H new ATOM 471 N ILE A 30 47.007 49.089 16.957 1.00 0.00 N ATOM 472 CA ILE A 30 48.186 49.524 17.678 1.00 0.00 C ATOM 473 C ILE A 30 49.370 49.729 16.730 1.00 0.00 C ATOM 474 O ILE A 30 50.143 50.660 16.943 1.00 0.00 O ATOM 475 CB ILE A 30 48.481 48.583 18.843 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.385 48.691 19.899 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.842 48.852 19.481 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.381 47.554 20.917 1.00 0.00 C ATOM 0 H ILE A 30 46.684 48.158 17.221 1.00 0.00 H new ATOM 0 HA ILE A 30 47.995 50.502 18.120 1.00 0.00 H new ATOM 0 HB ILE A 30 48.505 47.572 18.437 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.499 49.637 20.428 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.417 48.720 19.399 1.00 0.00 H new ATOM 0 HG21 ILE A 30 50.002 48.156 20.304 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.626 48.719 18.735 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.871 49.874 19.859 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.572 47.708 21.631 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.235 46.605 20.402 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.334 47.536 21.447 1.00 0.00 H new ATOM 490 N GLN A 31 49.494 48.970 15.646 1.00 0.00 N ATOM 491 CA GLN A 31 50.471 49.252 14.614 1.00 0.00 C ATOM 492 C GLN A 31 50.181 50.568 13.889 1.00 0.00 C ATOM 493 O GLN A 31 51.111 51.341 13.670 1.00 0.00 O ATOM 494 CB GLN A 31 50.593 48.078 13.647 1.00 0.00 C ATOM 495 CG GLN A 31 51.855 48.165 12.793 1.00 0.00 C ATOM 496 CD GLN A 31 52.027 46.988 11.831 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.131 46.176 11.608 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.206 46.814 11.242 1.00 0.00 N ATOM 0 H GLN A 31 48.920 48.147 15.464 1.00 0.00 H new ATOM 0 HA GLN A 31 51.438 49.380 15.101 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.601 47.145 14.210 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.718 48.051 12.998 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.832 49.092 12.219 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.724 48.217 13.449 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.964 47.475 11.412 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.353 46.019 10.620 1.00 0.00 H new ATOM 507 N ASP A 32 48.930 50.891 13.574 1.00 0.00 N ATOM 508 CA ASP A 32 48.569 52.167 12.993 1.00 0.00 C ATOM 509 C ASP A 32 48.842 53.343 13.934 1.00 0.00 C ATOM 510 O ASP A 32 49.337 54.383 13.507 1.00 0.00 O ATOM 511 CB ASP A 32 47.105 52.145 12.565 1.00 0.00 C ATOM 512 CG ASP A 32 46.783 53.185 11.489 1.00 0.00 C ATOM 513 OD1 ASP A 32 46.467 54.350 11.814 1.00 0.00 O ATOM 514 OD2 ASP A 32 46.827 52.820 10.294 1.00 0.00 O ATOM 0 H ASP A 32 48.137 50.266 13.718 1.00 0.00 H new ATOM 0 HA ASP A 32 49.202 52.319 12.118 1.00 0.00 H new ATOM 0 HB2 ASP A 32 46.856 51.152 12.190 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.474 52.324 13.436 1.00 0.00 H new ATOM 519 N LYS A 33 48.570 53.180 15.225 1.00 0.00 N ATOM 520 CA LYS A 33 48.739 54.195 16.247 1.00 0.00 C ATOM 521 C LYS A 33 50.196 54.430 16.655 1.00 0.00 C ATOM 522 O LYS A 33 50.584 55.584 16.818 1.00 0.00 O ATOM 523 CB LYS A 33 47.889 53.829 17.460 1.00 0.00 C ATOM 524 CG LYS A 33 46.386 53.903 17.203 1.00 0.00 C ATOM 525 CD LYS A 33 45.776 55.229 17.649 1.00 0.00 C ATOM 526 CE LYS A 33 44.287 55.267 17.321 1.00 0.00 C ATOM 527 NZ LYS A 33 43.642 56.458 17.893 1.00 0.00 N ATOM 0 H LYS A 33 48.212 52.301 15.598 1.00 0.00 H new ATOM 0 HA LYS A 33 48.405 55.140 15.818 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.144 52.819 17.780 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.141 54.497 18.284 1.00 0.00 H new ATOM 0 HG2 LYS A 33 46.196 53.760 16.139 1.00 0.00 H new ATOM 0 HG3 LYS A 33 45.891 53.086 17.728 1.00 0.00 H new ATOM 0 HD2 LYS A 33 45.922 55.361 18.721 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.285 56.056 17.153 1.00 0.00 H new ATOM 0 HE2 LYS A 33 44.151 55.262 16.240 1.00 0.00 H new ATOM 0 HE3 LYS A 33 43.805 54.369 17.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 42.757 56.652 17.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 43.433 56.291 18.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.279 57.275 17.803 1.00 0.00 H new ATOM 541 N GLU A 34 50.980 53.370 16.832 1.00 0.00 N ATOM 542 CA GLU A 34 52.271 53.379 17.491 1.00 0.00 C ATOM 543 C GLU A 34 53.399 52.685 16.724 1.00 0.00 C ATOM 544 O GLU A 34 54.534 52.668 17.193 1.00 0.00 O ATOM 545 CB GLU A 34 52.120 52.739 18.868 1.00 0.00 C ATOM 546 CG GLU A 34 51.376 53.581 19.899 1.00 0.00 C ATOM 547 CD GLU A 34 52.215 54.765 20.383 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.906 54.658 21.420 1.00 0.00 O ATOM 549 OE2 GLU A 34 52.175 55.845 19.755 1.00 0.00 O ATOM 0 H GLU A 34 50.715 52.442 16.503 1.00 0.00 H new ATOM 0 HA GLU A 34 52.571 54.425 17.555 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.598 51.789 18.754 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.113 52.512 19.256 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.446 53.949 19.465 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.105 52.956 20.750 1.00 0.00 H new ATOM 556 N GLY A 35 53.138 52.089 15.563 1.00 0.00 N ATOM 557 CA GLY A 35 54.148 51.506 14.703 1.00 0.00 C ATOM 558 C GLY A 35 54.660 50.117 15.090 1.00 0.00 C ATOM 559 O GLY A 35 55.484 49.563 14.366 1.00 0.00 O ATOM 0 H GLY A 35 52.193 51.999 15.191 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.744 51.450 13.692 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.000 52.185 14.669 1.00 0.00 H new ATOM 563 N ILE A 36 54.189 49.530 16.187 1.00 0.00 N ATOM 564 CA ILE A 36 54.667 48.264 16.705 1.00 0.00 C ATOM 565 C ILE A 36 54.047 47.099 15.931 1.00 0.00 C ATOM 566 O ILE A 36 52.824 46.978 15.955 1.00 0.00 O ATOM 567 CB ILE A 36 54.382 48.146 18.200 1.00 0.00 C ATOM 568 CG1 ILE A 36 54.845 49.345 19.022 1.00 0.00 C ATOM 569 CG2 ILE A 36 54.986 46.861 18.758 1.00 0.00 C ATOM 570 CD1 ILE A 36 56.322 49.710 18.901 1.00 0.00 C ATOM 0 H ILE A 36 53.444 49.938 16.751 1.00 0.00 H new ATOM 0 HA ILE A 36 55.748 48.223 16.569 1.00 0.00 H new ATOM 0 HB ILE A 36 53.296 48.120 18.292 1.00 0.00 H new ATOM 0 HG12 ILE A 36 54.252 50.212 18.729 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.625 49.148 20.071 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.774 46.793 19.825 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.552 46.002 18.246 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.065 46.869 18.603 1.00 0.00 H new ATOM 0 HD11 ILE A 36 56.535 50.576 19.528 1.00 0.00 H new ATOM 0 HD12 ILE A 36 56.933 48.867 19.225 1.00 0.00 H new ATOM 0 HD13 ILE A 36 56.554 49.948 17.863 1.00 0.00 H new ATOM 582 N PRO A 37 54.807 46.219 15.286 1.00 0.00 N ATOM 583 CA PRO A 37 54.251 45.096 14.559 1.00 0.00 C ATOM 584 C PRO A 37 53.473 44.132 15.457 1.00 0.00 C ATOM 585 O PRO A 37 53.947 43.849 16.556 1.00 0.00 O ATOM 586 CB PRO A 37 55.423 44.386 13.888 1.00 0.00 C ATOM 587 CG PRO A 37 56.497 45.468 13.810 1.00 0.00 C ATOM 588 CD PRO A 37 56.239 46.282 15.074 1.00 0.00 C ATOM 0 HA PRO A 37 53.527 45.456 13.829 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.759 43.528 14.470 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.155 44.015 12.899 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.501 45.043 13.799 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.397 46.074 12.910 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.781 45.869 15.925 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.573 47.312 14.953 1.00 0.00 H new ATOM 596 N PRO A 38 52.341 43.582 15.029 1.00 0.00 N ATOM 597 CA PRO A 38 51.531 42.674 15.816 1.00 0.00 C ATOM 598 C PRO A 38 52.292 41.493 16.422 1.00 0.00 C ATOM 599 O PRO A 38 52.039 41.157 17.576 1.00 0.00 O ATOM 600 CB PRO A 38 50.416 42.192 14.891 1.00 0.00 C ATOM 601 CG PRO A 38 50.201 43.406 13.990 1.00 0.00 C ATOM 602 CD PRO A 38 51.615 43.958 13.833 1.00 0.00 C ATOM 0 HA PRO A 38 51.153 43.208 16.688 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.711 41.310 14.323 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.514 41.929 15.443 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.766 43.127 13.030 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.530 44.134 14.445 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.094 43.548 12.944 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.597 45.041 13.715 1.00 0.00 H new ATOM 610 N ASP A 39 53.256 40.912 15.712 1.00 0.00 N ATOM 611 CA ASP A 39 54.052 39.802 16.194 1.00 0.00 C ATOM 612 C ASP A 39 54.909 40.111 17.424 1.00 0.00 C ATOM 613 O ASP A 39 55.276 39.178 18.136 1.00 0.00 O ATOM 614 CB ASP A 39 54.873 39.194 15.060 1.00 0.00 C ATOM 615 CG ASP A 39 55.845 40.171 14.396 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.683 40.429 13.185 1.00 0.00 O ATOM 617 OD2 ASP A 39 56.783 40.646 15.074 1.00 0.00 O ATOM 0 H ASP A 39 53.505 41.210 14.769 1.00 0.00 H new ATOM 0 HA ASP A 39 53.337 39.059 16.549 1.00 0.00 H new ATOM 0 HB2 ASP A 39 55.437 38.346 15.449 1.00 0.00 H new ATOM 0 HB3 ASP A 39 54.193 38.804 14.303 1.00 0.00 H new ATOM 622 N GLN A 40 55.151 41.377 17.753 1.00 0.00 N ATOM 623 CA GLN A 40 55.854 41.773 18.956 1.00 0.00 C ATOM 624 C GLN A 40 54.938 41.929 20.171 1.00 0.00 C ATOM 625 O GLN A 40 55.431 42.025 21.293 1.00 0.00 O ATOM 626 CB GLN A 40 56.631 43.063 18.716 1.00 0.00 C ATOM 627 CG GLN A 40 57.561 43.000 17.507 1.00 0.00 C ATOM 628 CD GLN A 40 58.498 44.204 17.381 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.743 44.976 18.306 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.100 44.396 16.211 1.00 0.00 N ATOM 0 H GLN A 40 54.856 42.165 17.177 1.00 0.00 H new ATOM 0 HA GLN A 40 56.545 40.962 19.189 1.00 0.00 H new ATOM 0 HB2 GLN A 40 55.925 43.882 18.579 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.219 43.294 19.604 1.00 0.00 H new ATOM 0 HG2 GLN A 40 58.160 42.091 17.569 1.00 0.00 H new ATOM 0 HG3 GLN A 40 56.959 42.924 16.602 1.00 0.00 H new ATOM 0 HE21 GLN A 40 58.911 43.767 15.431 1.00 0.00 H new ATOM 0 HE22 GLN A 40 59.751 45.172 16.094 1.00 0.00 H new ATOM 639 N GLN A 41 53.624 41.975 19.968 1.00 0.00 N ATOM 640 CA GLN A 41 52.644 42.381 20.956 1.00 0.00 C ATOM 641 C GLN A 41 51.938 41.210 21.643 1.00 0.00 C ATOM 642 O GLN A 41 51.529 40.259 20.981 1.00 0.00 O ATOM 643 CB GLN A 41 51.569 43.248 20.307 1.00 0.00 C ATOM 644 CG GLN A 41 52.029 44.501 19.569 1.00 0.00 C ATOM 645 CD GLN A 41 50.829 45.249 18.988 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.743 45.275 19.562 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.928 45.856 17.808 1.00 0.00 N ATOM 0 H GLN A 41 53.203 41.720 19.075 1.00 0.00 H new ATOM 0 HA GLN A 41 53.207 42.929 21.712 1.00 0.00 H new ATOM 0 HB2 GLN A 41 51.015 42.627 19.603 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.868 43.553 21.084 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.576 45.152 20.251 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.717 44.227 18.769 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.816 45.853 17.306 1.00 0.00 H new ATOM 0 HE22 GLN A 41 50.116 46.325 17.406 1.00 0.00 H new ATOM 656 N ARG A 42 51.639 41.353 22.931 1.00 0.00 N ATOM 657 CA ARG A 42 50.579 40.639 23.614 1.00 0.00 C ATOM 658 C ARG A 42 49.747 41.570 24.497 1.00 0.00 C ATOM 659 O ARG A 42 50.284 42.499 25.097 1.00 0.00 O ATOM 660 CB ARG A 42 51.122 39.428 24.367 1.00 0.00 C ATOM 661 CG ARG A 42 52.262 39.720 25.339 1.00 0.00 C ATOM 662 CD ARG A 42 52.471 38.507 26.242 1.00 0.00 C ATOM 663 NE ARG A 42 53.615 38.656 27.141 1.00 0.00 N ATOM 664 CZ ARG A 42 53.773 38.034 28.317 1.00 0.00 C ATOM 665 NH1 ARG A 42 52.850 37.220 28.850 1.00 0.00 N ATOM 666 NH2 ARG A 42 54.909 38.198 29.008 1.00 0.00 N ATOM 0 H ARG A 42 52.148 41.991 23.543 1.00 0.00 H new ATOM 0 HA ARG A 42 49.895 40.251 22.859 1.00 0.00 H new ATOM 0 HB2 ARG A 42 50.303 38.969 24.921 1.00 0.00 H new ATOM 0 HB3 ARG A 42 51.466 38.693 23.639 1.00 0.00 H new ATOM 0 HG2 ARG A 42 53.177 39.942 24.790 1.00 0.00 H new ATOM 0 HG3 ARG A 42 52.029 40.600 25.939 1.00 0.00 H new ATOM 0 HD2 ARG A 42 51.570 38.341 26.833 1.00 0.00 H new ATOM 0 HD3 ARG A 42 52.614 37.621 25.624 1.00 0.00 H new ATOM 0 HE ARG A 42 54.358 39.289 26.847 1.00 0.00 H new ATOM 0 HH11 ARG A 42 51.974 37.049 28.355 1.00 0.00 H new ATOM 0 HH12 ARG A 42 53.024 36.772 29.750 1.00 0.00 H new ATOM 0 HH21 ARG A 42 55.649 38.794 28.638 1.00 0.00 H new ATOM 0 HH22 ARG A 42 55.034 37.726 29.904 1.00 0.00 H new ATOM 680 N LEU A 43 48.438 41.342 24.564 1.00 0.00 N ATOM 681 CA LEU A 43 47.477 42.192 25.237 1.00 0.00 C ATOM 682 C LEU A 43 46.868 41.498 26.458 1.00 0.00 C ATOM 683 O LEU A 43 46.490 40.330 26.395 1.00 0.00 O ATOM 684 CB LEU A 43 46.407 42.656 24.253 1.00 0.00 C ATOM 685 CG LEU A 43 46.910 43.454 23.054 1.00 0.00 C ATOM 686 CD1 LEU A 43 45.747 43.816 22.135 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.605 44.751 23.459 1.00 0.00 C ATOM 0 H LEU A 43 48.007 40.525 24.131 1.00 0.00 H new ATOM 0 HA LEU A 43 47.999 43.073 25.610 1.00 0.00 H new ATOM 0 HB2 LEU A 43 45.874 41.779 23.885 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.683 43.266 24.793 1.00 0.00 H new ATOM 0 HG LEU A 43 47.631 42.815 22.545 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.120 44.385 21.283 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.267 42.904 21.780 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.023 44.417 22.684 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.942 45.277 22.566 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.907 45.381 24.010 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.463 44.522 24.091 1.00 0.00 H new ATOM 699 N ILE A 44 46.778 42.233 27.563 1.00 0.00 N ATOM 700 CA ILE A 44 46.374 41.751 28.868 1.00 0.00 C ATOM 701 C ILE A 44 45.189 42.566 29.388 1.00 0.00 C ATOM 702 O ILE A 44 45.167 43.790 29.275 1.00 0.00 O ATOM 703 CB ILE A 44 47.562 41.753 29.827 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.699 40.897 29.279 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.156 41.285 31.222 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.926 40.773 30.178 1.00 0.00 C ATOM 0 H ILE A 44 46.997 43.229 27.566 1.00 0.00 H new ATOM 0 HA ILE A 44 46.038 40.717 28.788 1.00 0.00 H new ATOM 0 HB ILE A 44 47.915 42.781 29.914 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.314 39.897 29.081 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.013 41.313 28.322 1.00 0.00 H new ATOM 0 HG21 ILE A 44 48.026 41.299 31.878 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.390 41.951 31.621 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.761 40.271 31.165 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.671 40.144 29.692 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.347 41.762 30.357 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.637 40.324 31.128 1.00 0.00 H new ATOM 718 N PHE A 45 44.208 41.895 29.985 1.00 0.00 N ATOM 719 CA PHE A 45 43.017 42.478 30.569 1.00 0.00 C ATOM 720 C PHE A 45 42.686 41.805 31.903 1.00 0.00 C ATOM 721 O PHE A 45 42.575 40.582 31.962 1.00 0.00 O ATOM 722 CB PHE A 45 41.866 42.316 29.580 1.00 0.00 C ATOM 723 CG PHE A 45 40.541 42.882 30.031 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.411 44.257 30.253 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.435 42.041 30.206 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.183 44.793 30.661 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.204 42.577 30.606 1.00 0.00 C ATOM 728 CZ PHE A 45 38.077 43.952 30.835 1.00 0.00 C ATOM 0 H PHE A 45 44.229 40.879 30.076 1.00 0.00 H new ATOM 0 HA PHE A 45 43.183 43.537 30.769 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.146 42.794 28.641 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.736 41.254 29.370 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.261 44.908 30.109 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.531 40.979 30.033 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.089 45.854 30.841 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.351 41.928 30.738 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.128 44.363 31.145 1.00 0.00 H new ATOM 738 N ALA A 46 42.554 42.574 32.980 1.00 0.00 N ATOM 739 CA ALA A 46 42.348 42.080 34.327 1.00 0.00 C ATOM 740 C ALA A 46 43.288 40.938 34.717 1.00 0.00 C ATOM 741 O ALA A 46 42.864 39.895 35.209 1.00 0.00 O ATOM 742 CB ALA A 46 40.862 41.790 34.517 1.00 0.00 C ATOM 0 H ALA A 46 42.590 43.592 32.931 1.00 0.00 H new ATOM 0 HA ALA A 46 42.630 42.854 35.041 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.690 41.417 35.527 1.00 0.00 H new ATOM 0 HB2 ALA A 46 40.290 42.706 34.366 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.542 41.040 33.794 1.00 0.00 H new ATOM 748 N GLY A 47 44.574 41.097 34.416 1.00 0.00 N ATOM 749 CA GLY A 47 45.624 40.117 34.612 1.00 0.00 C ATOM 750 C GLY A 47 45.685 38.950 33.623 1.00 0.00 C ATOM 751 O GLY A 47 46.687 38.239 33.596 1.00 0.00 O ATOM 0 H GLY A 47 44.925 41.963 34.007 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.582 40.637 34.581 1.00 0.00 H new ATOM 0 HA3 GLY A 47 45.518 39.704 35.615 1.00 0.00 H new ATOM 755 N LYS A 48 44.657 38.744 32.804 1.00 0.00 N ATOM 756 CA LYS A 48 44.488 37.617 31.910 1.00 0.00 C ATOM 757 C LYS A 48 44.968 37.941 30.493 1.00 0.00 C ATOM 758 O LYS A 48 44.779 39.064 30.033 1.00 0.00 O ATOM 759 CB LYS A 48 43.025 37.181 31.903 1.00 0.00 C ATOM 760 CG LYS A 48 42.558 36.705 33.275 1.00 0.00 C ATOM 761 CD LYS A 48 41.060 36.421 33.339 1.00 0.00 C ATOM 762 CE LYS A 48 40.229 37.700 33.271 1.00 0.00 C ATOM 763 NZ LYS A 48 38.793 37.395 33.359 1.00 0.00 N ATOM 0 H LYS A 48 43.879 39.401 32.748 1.00 0.00 H new ATOM 0 HA LYS A 48 45.104 36.795 32.275 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.401 38.014 31.578 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.890 36.379 31.177 1.00 0.00 H new ATOM 0 HG2 LYS A 48 43.104 35.800 33.543 1.00 0.00 H new ATOM 0 HG3 LYS A 48 42.809 37.461 34.019 1.00 0.00 H new ATOM 0 HD2 LYS A 48 40.781 35.764 32.516 1.00 0.00 H new ATOM 0 HD3 LYS A 48 40.831 35.890 34.263 1.00 0.00 H new ATOM 0 HE2 LYS A 48 40.514 38.368 34.084 1.00 0.00 H new ATOM 0 HE3 LYS A 48 40.437 38.225 32.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 38.247 38.279 33.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 38.521 36.776 32.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 38.595 36.914 34.260 1.00 0.00 H new ATOM 777 N GLN A 49 45.558 36.983 29.784 1.00 0.00 N ATOM 778 CA GLN A 49 46.022 37.186 28.426 1.00 0.00 C ATOM 779 C GLN A 49 44.884 37.038 27.413 1.00 0.00 C ATOM 780 O GLN A 49 44.127 36.071 27.453 1.00 0.00 O ATOM 781 CB GLN A 49 47.183 36.257 28.087 1.00 0.00 C ATOM 782 CG GLN A 49 48.421 36.496 28.947 1.00 0.00 C ATOM 783 CD GLN A 49 49.652 35.781 28.386 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.432 36.357 27.630 1.00 0.00 O ATOM 785 NE2 GLN A 49 49.894 34.522 28.736 1.00 0.00 N ATOM 0 H GLN A 49 45.726 36.043 30.142 1.00 0.00 H new ATOM 0 HA GLN A 49 46.388 38.211 28.362 1.00 0.00 H new ATOM 0 HB2 GLN A 49 46.859 35.223 28.209 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.448 36.387 27.038 1.00 0.00 H new ATOM 0 HG2 GLN A 49 48.619 37.566 29.008 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.230 36.148 29.962 1.00 0.00 H new ATOM 0 HE21 GLN A 49 49.253 34.035 29.363 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.720 34.043 28.378 1.00 0.00 H new ATOM 794 N LEU A 50 44.781 37.986 26.486 1.00 0.00 N ATOM 795 CA LEU A 50 43.822 37.977 25.400 1.00 0.00 C ATOM 796 C LEU A 50 44.391 37.250 24.181 1.00 0.00 C ATOM 797 O LEU A 50 45.576 37.385 23.886 1.00 0.00 O ATOM 798 CB LEU A 50 43.422 39.405 25.040 1.00 0.00 C ATOM 799 CG LEU A 50 42.814 40.234 26.168 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.502 41.633 25.645 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.516 39.623 26.689 1.00 0.00 C ATOM 0 H LEU A 50 45.386 38.807 26.475 1.00 0.00 H new ATOM 0 HA LEU A 50 42.932 37.439 25.727 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.305 39.926 24.668 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.706 39.365 24.219 1.00 0.00 H new ATOM 0 HG LEU A 50 43.537 40.263 26.983 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.067 42.232 26.445 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.421 42.105 25.297 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.795 41.563 24.819 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.117 40.245 27.491 1.00 0.00 H new ATOM 0 HD22 LEU A 50 40.790 39.566 25.878 1.00 0.00 H new ATOM 0 HD23 LEU A 50 41.713 38.621 27.071 1.00 0.00 H new ATOM 813 N GLU A 51 43.568 36.490 23.461 1.00 0.00 N ATOM 814 CA GLU A 51 44.001 35.576 22.425 1.00 0.00 C ATOM 815 C GLU A 51 43.544 35.986 21.023 1.00 0.00 C ATOM 816 O GLU A 51 42.385 36.329 20.803 1.00 0.00 O ATOM 817 CB GLU A 51 43.549 34.161 22.776 1.00 0.00 C ATOM 818 CG GLU A 51 44.319 33.623 23.979 1.00 0.00 C ATOM 819 CD GLU A 51 43.819 32.257 24.452 1.00 0.00 C ATOM 820 OE1 GLU A 51 43.438 32.134 25.636 1.00 0.00 O ATOM 821 OE2 GLU A 51 43.897 31.278 23.679 1.00 0.00 O ATOM 0 H GLU A 51 42.556 36.499 23.591 1.00 0.00 H new ATOM 0 HA GLU A 51 45.090 35.610 22.389 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.481 34.160 22.993 1.00 0.00 H new ATOM 0 HB3 GLU A 51 43.700 33.504 21.919 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.375 33.547 23.722 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.241 34.336 24.800 1.00 0.00 H new ATOM 828 N ASP A 52 44.463 35.927 20.064 1.00 0.00 N ATOM 829 CA ASP A 52 44.365 36.502 18.738 1.00 0.00 C ATOM 830 C ASP A 52 43.141 36.073 17.926 1.00 0.00 C ATOM 831 O ASP A 52 42.611 36.873 17.158 1.00 0.00 O ATOM 832 CB ASP A 52 45.623 36.150 17.950 1.00 0.00 C ATOM 833 CG ASP A 52 46.907 36.581 18.662 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.430 37.674 18.353 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.384 35.822 19.534 1.00 0.00 O ATOM 0 H ASP A 52 45.350 35.444 20.207 1.00 0.00 H new ATOM 0 HA ASP A 52 44.256 37.575 18.894 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.651 35.074 17.780 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.578 36.626 16.971 1.00 0.00 H new ATOM 840 N GLY A 53 42.694 34.831 18.089 1.00 0.00 N ATOM 841 CA GLY A 53 41.549 34.256 17.411 1.00 0.00 C ATOM 842 C GLY A 53 40.181 34.640 17.978 1.00 0.00 C ATOM 843 O GLY A 53 39.166 34.345 17.352 1.00 0.00 O ATOM 0 H GLY A 53 43.144 34.174 18.726 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.584 34.553 16.363 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.641 33.170 17.438 1.00 0.00 H new ATOM 847 N ARG A 54 40.130 35.269 19.148 1.00 0.00 N ATOM 848 CA ARG A 54 38.911 35.639 19.838 1.00 0.00 C ATOM 849 C ARG A 54 38.575 37.119 19.646 1.00 0.00 C ATOM 850 O ARG A 54 39.381 37.876 19.110 1.00 0.00 O ATOM 851 CB ARG A 54 39.004 35.242 21.309 1.00 0.00 C ATOM 852 CG ARG A 54 39.250 33.746 21.481 1.00 0.00 C ATOM 853 CD ARG A 54 39.055 33.308 22.930 1.00 0.00 C ATOM 854 NE ARG A 54 39.421 31.904 23.120 1.00 0.00 N ATOM 855 CZ ARG A 54 39.081 31.149 24.174 1.00 0.00 C ATOM 856 NH1 ARG A 54 38.294 31.591 25.164 1.00 0.00 N ATOM 857 NH2 ARG A 54 39.537 29.894 24.296 1.00 0.00 N ATOM 0 H ARG A 54 40.971 35.543 19.656 1.00 0.00 H new ATOM 0 HA ARG A 54 38.080 35.089 19.397 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.811 35.799 21.785 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.081 35.519 21.819 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.570 33.188 20.837 1.00 0.00 H new ATOM 0 HG3 ARG A 54 40.263 33.504 21.160 1.00 0.00 H new ATOM 0 HD2 ARG A 54 39.660 33.935 23.585 1.00 0.00 H new ATOM 0 HD3 ARG A 54 38.015 33.456 23.219 1.00 0.00 H new ATOM 0 HE ARG A 54 39.981 31.464 22.390 1.00 0.00 H new ATOM 0 HH11 ARG A 54 37.925 32.541 25.136 1.00 0.00 H new ATOM 0 HH12 ARG A 54 38.064 30.977 25.945 1.00 0.00 H new ATOM 0 HH21 ARG A 54 40.151 29.503 23.581 1.00 0.00 H new ATOM 0 HH22 ARG A 54 39.270 29.331 25.103 1.00 0.00 H new ATOM 871 N THR A 55 37.384 37.530 20.071 1.00 0.00 N ATOM 872 CA THR A 55 36.870 38.875 19.911 1.00 0.00 C ATOM 873 C THR A 55 36.618 39.591 21.239 1.00 0.00 C ATOM 874 O THR A 55 36.434 38.954 22.275 1.00 0.00 O ATOM 875 CB THR A 55 35.597 38.914 19.069 1.00 0.00 C ATOM 876 OG1 THR A 55 34.531 38.264 19.725 1.00 0.00 O ATOM 877 CG2 THR A 55 35.757 38.257 17.701 1.00 0.00 C ATOM 0 H THR A 55 36.732 36.910 20.552 1.00 0.00 H new ATOM 0 HA THR A 55 37.662 39.410 19.386 1.00 0.00 H new ATOM 0 HB THR A 55 35.386 39.974 18.930 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.715 37.303 19.774 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.816 38.320 17.155 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.537 38.771 17.140 1.00 0.00 H new ATOM 0 HG23 THR A 55 36.033 37.210 17.830 1.00 0.00 H new ATOM 885 N LEU A 56 36.563 40.919 21.214 1.00 0.00 N ATOM 886 CA LEU A 56 36.335 41.731 22.393 1.00 0.00 C ATOM 887 C LEU A 56 35.046 41.370 23.132 1.00 0.00 C ATOM 888 O LEU A 56 35.043 41.284 24.359 1.00 0.00 O ATOM 889 CB LEU A 56 36.354 43.202 21.989 1.00 0.00 C ATOM 890 CG LEU A 56 37.704 43.733 21.515 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.546 45.183 21.065 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.766 43.707 22.611 1.00 0.00 C ATOM 0 H LEU A 56 36.678 41.464 20.360 1.00 0.00 H new ATOM 0 HA LEU A 56 37.138 41.531 23.102 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.624 43.352 21.194 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.026 43.799 22.840 1.00 0.00 H new ATOM 0 HG LEU A 56 38.028 43.084 20.701 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.509 45.566 20.726 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.827 45.234 20.248 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.190 45.786 21.900 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.705 44.096 22.217 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.440 44.325 23.448 1.00 0.00 H new ATOM 0 HD23 LEU A 56 38.912 42.682 22.952 1.00 0.00 H new ATOM 904 N SER A 57 33.967 41.084 22.409 1.00 0.00 N ATOM 905 CA SER A 57 32.710 40.626 22.965 1.00 0.00 C ATOM 906 C SER A 57 32.775 39.245 23.618 1.00 0.00 C ATOM 907 O SER A 57 32.051 39.027 24.588 1.00 0.00 O ATOM 908 CB SER A 57 31.595 40.649 21.923 1.00 0.00 C ATOM 909 OG SER A 57 31.945 39.973 20.737 1.00 0.00 O ATOM 0 H SER A 57 33.949 41.169 21.393 1.00 0.00 H new ATOM 0 HA SER A 57 32.487 41.337 23.760 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.699 40.193 22.345 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.345 41.683 21.687 1.00 0.00 H new ATOM 0 HG SER A 57 32.502 40.556 20.180 1.00 0.00 H new ATOM 915 N ASP A 58 33.658 38.345 23.195 1.00 0.00 N ATOM 916 CA ASP A 58 33.824 37.054 23.832 1.00 0.00 C ATOM 917 C ASP A 58 34.330 37.202 25.268 1.00 0.00 C ATOM 918 O ASP A 58 33.929 36.450 26.153 1.00 0.00 O ATOM 919 CB ASP A 58 34.778 36.156 23.051 1.00 0.00 C ATOM 920 CG ASP A 58 34.334 35.854 21.617 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.127 35.628 21.385 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.194 35.847 20.710 1.00 0.00 O ATOM 0 H ASP A 58 34.277 38.496 22.399 1.00 0.00 H new ATOM 0 HA ASP A 58 32.839 36.587 23.847 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.760 36.628 23.022 1.00 0.00 H new ATOM 0 HB3 ASP A 58 34.893 35.215 23.588 1.00 0.00 H new ATOM 927 N TYR A 59 35.171 38.203 25.511 1.00 0.00 N ATOM 928 CA TYR A 59 35.683 38.587 26.811 1.00 0.00 C ATOM 929 C TYR A 59 34.804 39.586 27.568 1.00 0.00 C ATOM 930 O TYR A 59 35.171 39.989 28.669 1.00 0.00 O ATOM 931 CB TYR A 59 37.094 39.141 26.635 1.00 0.00 C ATOM 932 CG TYR A 59 38.112 38.135 26.156 1.00 0.00 C ATOM 933 CD1 TYR A 59 38.647 37.209 27.059 1.00 0.00 C ATOM 934 CD2 TYR A 59 38.573 38.170 24.834 1.00 0.00 C ATOM 935 CE1 TYR A 59 39.661 36.334 26.653 1.00 0.00 C ATOM 936 CE2 TYR A 59 39.590 37.302 24.420 1.00 0.00 C ATOM 937 CZ TYR A 59 40.147 36.383 25.331 1.00 0.00 C ATOM 938 OH TYR A 59 41.167 35.567 24.939 1.00 0.00 O ATOM 0 H TYR A 59 35.529 38.796 24.762 1.00 0.00 H new ATOM 0 HA TYR A 59 35.686 37.690 27.430 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.059 39.968 25.926 1.00 0.00 H new ATOM 0 HB3 TYR A 59 37.430 39.552 27.587 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.276 37.170 28.073 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.143 38.869 24.132 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.071 35.621 27.353 1.00 0.00 H new ATOM 0 HE2 TYR A 59 39.948 37.337 23.402 1.00 0.00 H new ATOM 0 HH TYR A 59 40.967 34.644 25.201 1.00 0.00 H new ATOM 948 N ASN A 60 33.667 39.997 27.016 1.00 0.00 N ATOM 949 CA ASN A 60 32.803 41.031 27.551 1.00 0.00 C ATOM 950 C ASN A 60 33.487 42.382 27.768 1.00 0.00 C ATOM 951 O ASN A 60 33.171 43.104 28.710 1.00 0.00 O ATOM 952 CB ASN A 60 32.042 40.488 28.756 1.00 0.00 C ATOM 953 CG ASN A 60 30.828 41.335 29.141 1.00 0.00 C ATOM 954 OD1 ASN A 60 30.300 42.116 28.352 1.00 0.00 O ATOM 955 ND2 ASN A 60 30.355 41.219 30.379 1.00 0.00 N ATOM 0 H ASN A 60 33.312 39.599 26.147 1.00 0.00 H new ATOM 0 HA ASN A 60 32.066 41.283 26.789 1.00 0.00 H new ATOM 0 HB2 ASN A 60 31.713 39.472 28.540 1.00 0.00 H new ATOM 0 HB3 ASN A 60 32.720 40.429 29.608 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.554 41.778 30.673 1.00 0.00 H new ATOM 0 HD22 ASN A 60 30.793 40.571 31.034 1.00 0.00 H new ATOM 962 N ILE A 61 34.434 42.752 26.910 1.00 0.00 N ATOM 963 CA ILE A 61 35.098 44.039 26.934 1.00 0.00 C ATOM 964 C ILE A 61 34.155 45.113 26.390 1.00 0.00 C ATOM 965 O ILE A 61 33.483 44.904 25.383 1.00 0.00 O ATOM 966 CB ILE A 61 36.437 43.965 26.206 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.395 43.047 26.960 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.059 45.349 26.037 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.630 42.624 26.171 1.00 0.00 C ATOM 0 H ILE A 61 34.765 42.144 26.161 1.00 0.00 H new ATOM 0 HA ILE A 61 35.336 44.322 27.959 1.00 0.00 H new ATOM 0 HB ILE A 61 36.255 43.557 25.212 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.718 43.552 27.871 1.00 0.00 H new ATOM 0 HG13 ILE A 61 36.853 42.152 27.266 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.011 45.259 25.515 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.386 45.982 25.458 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.224 45.796 27.017 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.251 41.974 26.788 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.322 42.087 25.274 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.201 43.508 25.887 1.00 0.00 H new ATOM 981 N GLN A 62 34.081 46.259 27.062 1.00 0.00 N ATOM 982 CA GLN A 62 33.093 47.296 26.842 1.00 0.00 C ATOM 983 C GLN A 62 33.719 48.691 26.781 1.00 0.00 C ATOM 984 O GLN A 62 34.909 48.867 27.028 1.00 0.00 O ATOM 985 CB GLN A 62 32.042 47.219 27.944 1.00 0.00 C ATOM 986 CG GLN A 62 31.137 45.995 27.833 1.00 0.00 C ATOM 987 CD GLN A 62 30.132 45.873 28.979 1.00 0.00 C ATOM 988 OE1 GLN A 62 29.731 46.845 29.617 1.00 0.00 O ATOM 989 NE2 GLN A 62 29.638 44.672 29.266 1.00 0.00 N ATOM 0 H GLN A 62 34.739 46.494 27.805 1.00 0.00 H new ATOM 0 HA GLN A 62 32.626 47.127 25.872 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.542 47.206 28.913 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.428 48.119 27.914 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.595 46.038 26.888 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.755 45.098 27.805 1.00 0.00 H new ATOM 0 HE21 GLN A 62 29.957 43.853 28.749 1.00 0.00 H new ATOM 0 HE22 GLN A 62 28.940 44.570 30.003 1.00 0.00 H new ATOM 998 N LYS A 63 32.917 49.708 26.477 1.00 0.00 N ATOM 999 CA LYS A 63 33.303 51.105 26.454 1.00 0.00 C ATOM 1000 C LYS A 63 34.129 51.514 27.674 1.00 0.00 C ATOM 1001 O LYS A 63 33.734 51.258 28.809 1.00 0.00 O ATOM 1002 CB LYS A 63 32.033 51.944 26.352 1.00 0.00 C ATOM 1003 CG LYS A 63 32.289 53.448 26.388 1.00 0.00 C ATOM 1004 CD LYS A 63 31.007 54.196 26.029 1.00 0.00 C ATOM 1005 CE LYS A 63 31.202 55.709 25.998 1.00 0.00 C ATOM 1006 NZ LYS A 63 31.396 56.278 27.340 1.00 0.00 N ATOM 0 H LYS A 63 31.937 49.568 26.230 1.00 0.00 H new ATOM 0 HA LYS A 63 33.948 51.274 25.592 1.00 0.00 H new ATOM 0 HB2 LYS A 63 31.516 51.694 25.425 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.365 51.678 27.171 1.00 0.00 H new ATOM 0 HG2 LYS A 63 32.629 53.745 27.380 1.00 0.00 H new ATOM 0 HG3 LYS A 63 33.082 53.709 25.687 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.654 53.858 25.055 1.00 0.00 H new ATOM 0 HD3 LYS A 63 30.231 53.948 26.753 1.00 0.00 H new ATOM 0 HE2 LYS A 63 32.065 55.948 25.377 1.00 0.00 H new ATOM 0 HE3 LYS A 63 30.334 56.175 25.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 31.354 57.316 27.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 30.647 55.934 27.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 32.324 55.987 27.710 1.00 0.00 H new ATOM 1020 N GLU A 64 35.262 52.165 27.426 1.00 0.00 N ATOM 1021 CA GLU A 64 36.210 52.647 28.411 1.00 0.00 C ATOM 1022 C GLU A 64 36.837 51.555 29.281 1.00 0.00 C ATOM 1023 O GLU A 64 37.285 51.822 30.394 1.00 0.00 O ATOM 1024 CB GLU A 64 35.645 53.836 29.183 1.00 0.00 C ATOM 1025 CG GLU A 64 35.421 55.067 28.310 1.00 0.00 C ATOM 1026 CD GLU A 64 34.748 56.193 29.097 1.00 0.00 C ATOM 1027 OE1 GLU A 64 33.507 56.151 29.234 1.00 0.00 O ATOM 1028 OE2 GLU A 64 35.451 57.099 29.597 1.00 0.00 O ATOM 0 H GLU A 64 35.555 52.380 26.473 1.00 0.00 H new ATOM 0 HA GLU A 64 37.071 53.021 27.858 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.700 53.547 29.642 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.327 54.092 29.993 1.00 0.00 H new ATOM 0 HG2 GLU A 64 36.376 55.416 27.918 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.803 54.800 27.453 1.00 0.00 H new ATOM 1035 N SER A 65 36.904 50.315 28.805 1.00 0.00 N ATOM 1036 CA SER A 65 37.792 49.314 29.360 1.00 0.00 C ATOM 1037 C SER A 65 39.258 49.702 29.157 1.00 0.00 C ATOM 1038 O SER A 65 39.604 50.289 28.134 1.00 0.00 O ATOM 1039 CB SER A 65 37.549 47.945 28.730 1.00 0.00 C ATOM 1040 OG SER A 65 36.331 47.383 29.165 1.00 0.00 O ATOM 0 H SER A 65 36.341 49.982 28.023 1.00 0.00 H new ATOM 0 HA SER A 65 37.578 49.259 30.427 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.539 48.040 27.644 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.371 47.276 28.984 1.00 0.00 H new ATOM 0 HG SER A 65 36.345 46.415 29.015 1.00 0.00 H new ATOM 1046 N THR A 66 40.124 49.342 30.100 1.00 0.00 N ATOM 1047 CA THR A 66 41.558 49.520 29.999 1.00 0.00 C ATOM 1048 C THR A 66 42.264 48.167 29.903 1.00 0.00 C ATOM 1049 O THR A 66 42.053 47.274 30.721 1.00 0.00 O ATOM 1050 CB THR A 66 42.120 50.364 31.139 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.695 51.701 31.000 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.645 50.441 31.153 1.00 0.00 C ATOM 0 H THR A 66 39.834 48.908 30.976 1.00 0.00 H new ATOM 0 HA THR A 66 41.753 50.074 29.080 1.00 0.00 H new ATOM 0 HB THR A 66 41.763 49.880 32.048 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.058 52.238 31.735 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.971 51.058 31.991 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.059 49.438 31.258 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.996 50.882 30.220 1.00 0.00 H new ATOM 1060 N LEU A 67 43.111 48.031 28.885 1.00 0.00 N ATOM 1061 CA LEU A 67 43.981 46.906 28.611 1.00 0.00 C ATOM 1062 C LEU A 67 45.436 47.337 28.810 1.00 0.00 C ATOM 1063 O LEU A 67 45.740 48.528 28.833 1.00 0.00 O ATOM 1064 CB LEU A 67 43.758 46.419 27.182 1.00 0.00 C ATOM 1065 CG LEU A 67 42.494 45.617 26.887 1.00 0.00 C ATOM 1066 CD1 LEU A 67 41.178 46.354 27.121 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.514 45.199 25.419 1.00 0.00 C ATOM 0 H LEU A 67 43.209 48.763 28.182 1.00 0.00 H new ATOM 0 HA LEU A 67 43.755 46.087 29.294 1.00 0.00 H new ATOM 0 HB2 LEU A 67 43.760 47.291 26.528 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.615 45.807 26.900 1.00 0.00 H new ATOM 0 HG LEU A 67 42.517 44.781 27.587 1.00 0.00 H new ATOM 0 HD11 LEU A 67 40.344 45.694 26.881 1.00 0.00 H new ATOM 0 HD12 LEU A 67 41.112 46.658 28.166 1.00 0.00 H new ATOM 0 HD13 LEU A 67 41.137 47.237 26.483 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.616 44.624 25.192 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.545 46.087 24.788 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.395 44.587 25.227 1.00 0.00 H new ATOM 1079 N HIS A 68 46.353 46.377 28.894 1.00 0.00 N ATOM 1080 CA HIS A 68 47.782 46.606 28.979 1.00 0.00 C ATOM 1081 C HIS A 68 48.507 45.869 27.851 1.00 0.00 C ATOM 1082 O HIS A 68 48.134 44.754 27.494 1.00 0.00 O ATOM 1083 CB HIS A 68 48.298 46.214 30.361 1.00 0.00 C ATOM 1084 CG HIS A 68 47.652 46.984 31.479 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.159 48.134 32.083 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.416 46.714 32.007 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.218 48.547 32.936 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.159 47.721 32.917 1.00 0.00 N ATOM 0 H HIS A 68 46.108 45.387 28.905 1.00 0.00 H new ATOM 0 HA HIS A 68 47.988 47.668 28.849 1.00 0.00 H new ATOM 0 HB2 HIS A 68 48.126 45.149 30.516 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.376 46.371 30.397 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.773 45.882 31.761 1.00 0.00 H new ATOM 0 HE1 HIS A 68 47.298 49.427 33.557 1.00 0.00 H new ATOM 0 HE2 HIS A 68 45.312 47.820 33.477 1.00 0.00 H new ATOM 1096 N LEU A 69 49.544 46.488 27.295 1.00 0.00 N ATOM 1097 CA LEU A 69 50.414 45.942 26.272 1.00 0.00 C ATOM 1098 C LEU A 69 51.728 45.486 26.909 1.00 0.00 C ATOM 1099 O LEU A 69 52.363 46.232 27.652 1.00 0.00 O ATOM 1100 CB LEU A 69 50.612 46.995 25.186 1.00 0.00 C ATOM 1101 CG LEU A 69 51.651 46.672 24.115 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.300 45.444 23.282 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.786 47.851 23.156 1.00 0.00 C ATOM 0 H LEU A 69 49.810 47.435 27.564 1.00 0.00 H new ATOM 0 HA LEU A 69 49.970 45.064 25.803 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.654 47.164 24.694 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.894 47.932 25.665 1.00 0.00 H new ATOM 0 HG LEU A 69 52.579 46.470 24.649 1.00 0.00 H new ATOM 0 HD11 LEU A 69 52.080 45.272 22.541 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.220 44.573 23.933 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.349 45.607 22.776 1.00 0.00 H new ATOM 0 HD21 LEU A 69 52.528 47.616 22.393 1.00 0.00 H new ATOM 0 HD22 LEU A 69 50.825 48.044 22.680 1.00 0.00 H new ATOM 0 HD23 LEU A 69 52.101 48.736 23.709 1.00 0.00 H new ATOM 1115 N VAL A 70 52.146 44.267 26.581 1.00 0.00 N ATOM 1116 CA VAL A 70 53.409 43.669 26.959 1.00 0.00 C ATOM 1117 C VAL A 70 54.083 43.141 25.691 1.00 0.00 C ATOM 1118 O VAL A 70 53.396 42.764 24.744 1.00 0.00 O ATOM 1119 CB VAL A 70 53.189 42.594 28.020 1.00 0.00 C ATOM 1120 CG1 VAL A 70 54.478 41.903 28.457 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.563 43.187 29.280 1.00 0.00 C ATOM 0 H VAL A 70 51.576 43.641 26.013 1.00 0.00 H new ATOM 0 HA VAL A 70 54.074 44.403 27.414 1.00 0.00 H new ATOM 0 HB VAL A 70 52.531 41.866 27.546 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.250 41.151 29.212 1.00 0.00 H new ATOM 0 HG12 VAL A 70 54.944 41.423 27.596 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.163 42.641 28.875 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.417 42.399 30.019 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.224 43.951 29.689 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.600 43.634 29.032 1.00 0.00 H new