USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=13 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 25 ASN : amide:sc= 1.8 K(o=3,f=-7.6!) USER MOD Set 1.2: A 29 LYS NZ :NH3+ -179:sc= 1.2 (180deg=0) USER MOD Set 2.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 62 GLN : amide:sc= 0.119 K(o=0.12,f=-3.6!) USER MOD Single : A 1 MET N :NH3+ -145:sc= 1.52 (180deg=0.699) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -91:sc= 0.113 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 175:sc= 1.41 (180deg=1.38) USER MOD Single : A 31 GLN : amide:sc= -0.14 K(o=-0.14,f=-0.73) USER MOD Single : A 33 LYS NZ :NH3+ 172:sc= 0.885 (180deg=0.844) USER MOD Single : A 40 GLN : amide:sc= -0.187 X(o=-0.19,f=-0.68) USER MOD Single : A 41 GLN : amide:sc= 0.433 K(o=0.43,f=-0.56) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.136 K(o=-0.14,f=-3.7!) USER MOD Single : A 55 THR OG1 : rot -71:sc= 1.24 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 30:sc= 0.747 USER MOD Single : A 60 ASN : amide:sc= -0.0404 K(o=-0.04,f=-0.81) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 98:sc= 1.27 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.104 X(o=-0.1,f=-0.011) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.752 52.659 19.645 1.00 0.00 N ATOM 2 CA MET A 1 33.089 52.500 21.068 1.00 0.00 C ATOM 3 C MET A 1 34.555 52.880 21.287 1.00 0.00 C ATOM 4 O MET A 1 35.416 52.454 20.520 1.00 0.00 O ATOM 5 CB MET A 1 32.786 51.089 21.563 1.00 0.00 C ATOM 6 CG MET A 1 33.038 50.910 23.057 1.00 0.00 C ATOM 7 SD MET A 1 32.915 49.203 23.648 1.00 0.00 S ATOM 8 CE MET A 1 31.123 48.956 23.615 1.00 0.00 C ATOM 0 H1 MET A 1 31.769 52.988 19.556 1.00 0.00 H new ATOM 0 H2 MET A 1 33.391 53.356 19.213 1.00 0.00 H new ATOM 0 H3 MET A 1 32.857 51.745 19.159 1.00 0.00 H new ATOM 0 HA MET A 1 32.464 53.170 21.657 1.00 0.00 H new ATOM 0 HB2 MET A 1 31.745 50.850 21.345 1.00 0.00 H new ATOM 0 HB3 MET A 1 33.399 50.377 21.010 1.00 0.00 H new ATOM 0 HG2 MET A 1 34.032 51.290 23.292 1.00 0.00 H new ATOM 0 HG3 MET A 1 32.324 51.523 23.608 1.00 0.00 H new ATOM 0 HE1 MET A 1 30.889 47.947 23.954 1.00 0.00 H new ATOM 0 HE2 MET A 1 30.644 49.680 24.274 1.00 0.00 H new ATOM 0 HE3 MET A 1 30.756 49.092 22.598 1.00 0.00 H new ATOM 20 N GLN A 2 34.836 53.637 22.344 1.00 0.00 N ATOM 21 CA GLN A 2 36.181 53.967 22.771 1.00 0.00 C ATOM 22 C GLN A 2 36.730 52.924 23.745 1.00 0.00 C ATOM 23 O GLN A 2 36.041 52.528 24.682 1.00 0.00 O ATOM 24 CB GLN A 2 36.206 55.341 23.435 1.00 0.00 C ATOM 25 CG GLN A 2 35.866 56.476 22.473 1.00 0.00 C ATOM 26 CD GLN A 2 36.009 57.835 23.163 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.002 58.543 23.003 1.00 0.00 O ATOM 28 NE2 GLN A 2 35.047 58.225 23.994 1.00 0.00 N ATOM 0 H GLN A 2 34.114 54.045 22.937 1.00 0.00 H new ATOM 0 HA GLN A 2 36.813 53.978 21.883 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.498 55.351 24.264 1.00 0.00 H new ATOM 0 HB3 GLN A 2 37.195 55.515 23.859 1.00 0.00 H new ATOM 0 HG2 GLN A 2 36.524 56.433 21.605 1.00 0.00 H new ATOM 0 HG3 GLN A 2 34.847 56.355 22.106 1.00 0.00 H new ATOM 0 HE21 GLN A 2 34.222 57.641 24.129 1.00 0.00 H new ATOM 0 HE22 GLN A 2 35.134 59.109 24.496 1.00 0.00 H new ATOM 37 N ILE A 3 37.994 52.550 23.565 1.00 0.00 N ATOM 38 CA ILE A 3 38.778 51.797 24.521 1.00 0.00 C ATOM 39 C ILE A 3 40.187 52.387 24.620 1.00 0.00 C ATOM 40 O ILE A 3 40.647 53.026 23.677 1.00 0.00 O ATOM 41 CB ILE A 3 38.809 50.303 24.207 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.484 49.974 22.879 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.421 49.681 24.326 1.00 0.00 C ATOM 44 CD1 ILE A 3 39.791 48.491 22.688 1.00 0.00 C ATOM 0 H ILE A 3 38.513 52.775 22.716 1.00 0.00 H new ATOM 0 HA ILE A 3 38.294 51.885 25.493 1.00 0.00 H new ATOM 0 HB ILE A 3 39.441 49.843 24.967 1.00 0.00 H new ATOM 0 HG12 ILE A 3 38.842 50.309 22.064 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.413 50.539 22.806 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.478 48.617 24.096 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.049 49.813 25.342 1.00 0.00 H new ATOM 0 HG23 ILE A 3 36.743 50.168 23.625 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.270 48.340 21.720 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.459 48.153 23.480 1.00 0.00 H new ATOM 0 HD13 ILE A 3 38.864 47.920 22.727 1.00 0.00 H new ATOM 56 N PHE A 4 40.883 52.149 25.728 1.00 0.00 N ATOM 57 CA PHE A 4 42.247 52.597 25.930 1.00 0.00 C ATOM 58 C PHE A 4 43.241 51.434 25.933 1.00 0.00 C ATOM 59 O PHE A 4 42.914 50.333 26.373 1.00 0.00 O ATOM 60 CB PHE A 4 42.349 53.408 27.219 1.00 0.00 C ATOM 61 CG PHE A 4 41.284 54.461 27.409 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.242 55.580 26.570 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.332 54.327 28.427 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.245 56.550 26.739 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.343 55.302 28.605 1.00 0.00 C ATOM 66 CZ PHE A 4 39.291 56.412 27.754 1.00 0.00 C ATOM 0 H PHE A 4 40.504 51.631 26.520 1.00 0.00 H new ATOM 0 HA PHE A 4 42.514 53.237 25.089 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.311 52.721 28.064 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.325 53.893 27.246 1.00 0.00 H new ATOM 0 HD1 PHE A 4 41.980 55.696 25.790 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.361 53.466 29.079 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.212 57.408 26.083 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.619 55.197 29.400 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.520 57.157 27.880 1.00 0.00 H new ATOM 76 N VAL A 5 44.470 51.678 25.487 1.00 0.00 N ATOM 77 CA VAL A 5 45.571 50.738 25.537 1.00 0.00 C ATOM 78 C VAL A 5 46.773 51.423 26.190 1.00 0.00 C ATOM 79 O VAL A 5 47.191 52.484 25.728 1.00 0.00 O ATOM 80 CB VAL A 5 45.929 50.205 24.153 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.010 49.130 24.245 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.729 49.595 23.435 1.00 0.00 C ATOM 0 H VAL A 5 44.730 52.570 25.067 1.00 0.00 H new ATOM 0 HA VAL A 5 45.270 49.875 26.131 1.00 0.00 H new ATOM 0 HB VAL A 5 46.286 51.065 23.587 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.247 48.766 23.245 1.00 0.00 H new ATOM 0 HG12 VAL A 5 47.906 49.553 24.700 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.649 48.303 24.856 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.038 49.231 22.455 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.336 48.766 24.023 1.00 0.00 H new ATOM 0 HG23 VAL A 5 43.954 50.352 23.313 1.00 0.00 H new ATOM 92 N LYS A 6 47.321 50.840 27.251 1.00 0.00 N ATOM 93 CA LYS A 6 48.282 51.462 28.139 1.00 0.00 C ATOM 94 C LYS A 6 49.451 50.542 28.500 1.00 0.00 C ATOM 95 O LYS A 6 49.239 49.376 28.825 1.00 0.00 O ATOM 96 CB LYS A 6 47.529 51.962 29.368 1.00 0.00 C ATOM 97 CG LYS A 6 48.333 52.927 30.235 1.00 0.00 C ATOM 98 CD LYS A 6 47.409 53.604 31.243 1.00 0.00 C ATOM 99 CE LYS A 6 48.146 54.640 32.088 1.00 0.00 C ATOM 100 NZ LYS A 6 47.229 55.307 33.026 1.00 0.00 N ATOM 0 H LYS A 6 47.095 49.883 27.522 1.00 0.00 H new ATOM 0 HA LYS A 6 48.752 52.302 27.627 1.00 0.00 H new ATOM 0 HB2 LYS A 6 46.613 52.456 29.045 1.00 0.00 H new ATOM 0 HB3 LYS A 6 47.232 51.106 29.974 1.00 0.00 H new ATOM 0 HG2 LYS A 6 49.125 52.389 30.757 1.00 0.00 H new ATOM 0 HG3 LYS A 6 48.816 53.677 29.609 1.00 0.00 H new ATOM 0 HD2 LYS A 6 46.587 54.086 30.714 1.00 0.00 H new ATOM 0 HD3 LYS A 6 46.970 52.850 31.896 1.00 0.00 H new ATOM 0 HE2 LYS A 6 48.950 54.156 32.643 1.00 0.00 H new ATOM 0 HE3 LYS A 6 48.609 55.382 31.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 47.755 56.006 33.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 46.476 55.787 32.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 46.807 54.600 33.661 1.00 0.00 H new ATOM 168 N LYS A 11 52.572 54.812 28.858 1.00 0.00 N ATOM 169 CA LYS A 11 52.210 55.352 27.563 1.00 0.00 C ATOM 170 C LYS A 11 50.819 54.866 27.153 1.00 0.00 C ATOM 171 O LYS A 11 50.570 53.663 27.165 1.00 0.00 O ATOM 172 CB LYS A 11 53.259 55.005 26.511 1.00 0.00 C ATOM 173 CG LYS A 11 54.694 55.374 26.878 1.00 0.00 C ATOM 174 CD LYS A 11 54.914 56.869 27.092 1.00 0.00 C ATOM 175 CE LYS A 11 56.339 57.148 27.559 1.00 0.00 C ATOM 176 NZ LYS A 11 56.512 56.845 28.988 1.00 0.00 N ATOM 0 HA LYS A 11 52.177 56.439 27.639 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.215 53.933 26.316 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.998 55.509 25.580 1.00 0.00 H new ATOM 0 HG2 LYS A 11 54.974 54.842 27.787 1.00 0.00 H new ATOM 0 HG3 LYS A 11 55.361 55.028 26.088 1.00 0.00 H new ATOM 0 HD2 LYS A 11 54.720 57.406 26.163 1.00 0.00 H new ATOM 0 HD3 LYS A 11 54.205 57.243 27.831 1.00 0.00 H new ATOM 0 HE2 LYS A 11 57.038 56.551 26.973 1.00 0.00 H new ATOM 0 HE3 LYS A 11 56.584 58.194 27.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 57.493 57.047 29.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 55.863 57.433 29.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 56.303 55.840 29.158 1.00 0.00 H new ATOM 190 N THR A 12 49.925 55.773 26.771 1.00 0.00 N ATOM 191 CA THR A 12 48.518 55.516 26.536 1.00 0.00 C ATOM 192 C THR A 12 48.081 55.980 25.145 1.00 0.00 C ATOM 193 O THR A 12 48.461 57.063 24.705 1.00 0.00 O ATOM 194 CB THR A 12 47.638 56.207 27.573 1.00 0.00 C ATOM 195 OG1 THR A 12 48.157 56.063 28.876 1.00 0.00 O ATOM 196 CG2 THR A 12 46.219 55.647 27.626 1.00 0.00 C ATOM 0 H THR A 12 50.178 56.748 26.611 1.00 0.00 H new ATOM 0 HA THR A 12 48.393 54.436 26.614 1.00 0.00 H new ATOM 0 HB THR A 12 47.621 57.250 27.257 1.00 0.00 H new ATOM 0 HG1 THR A 12 47.570 56.519 29.514 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.645 56.181 28.383 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.742 55.772 26.654 1.00 0.00 H new ATOM 0 HG23 THR A 12 46.255 54.587 27.879 1.00 0.00 H new ATOM 204 N ILE A 13 47.232 55.198 24.485 1.00 0.00 N ATOM 205 CA ILE A 13 46.503 55.581 23.293 1.00 0.00 C ATOM 206 C ILE A 13 45.027 55.192 23.400 1.00 0.00 C ATOM 207 O ILE A 13 44.681 54.223 24.072 1.00 0.00 O ATOM 208 CB ILE A 13 47.121 55.022 22.015 1.00 0.00 C ATOM 209 CG1 ILE A 13 47.202 53.498 22.002 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.473 55.675 21.740 1.00 0.00 C ATOM 211 CD1 ILE A 13 47.619 52.909 20.657 1.00 0.00 C ATOM 0 H ILE A 13 47.029 54.244 24.782 1.00 0.00 H new ATOM 0 HA ILE A 13 46.572 56.667 23.225 1.00 0.00 H new ATOM 0 HB ILE A 13 46.448 55.280 21.197 1.00 0.00 H new ATOM 0 HG12 ILE A 13 47.912 53.176 22.764 1.00 0.00 H new ATOM 0 HG13 ILE A 13 46.230 53.091 22.280 1.00 0.00 H new ATOM 0 HG21 ILE A 13 48.897 55.262 20.824 1.00 0.00 H new ATOM 0 HG22 ILE A 13 48.341 56.751 21.626 1.00 0.00 H new ATOM 0 HG23 ILE A 13 49.148 55.479 22.573 1.00 0.00 H new ATOM 0 HD11 ILE A 13 47.653 51.822 20.731 1.00 0.00 H new ATOM 0 HD12 ILE A 13 46.897 53.199 19.893 1.00 0.00 H new ATOM 0 HD13 ILE A 13 48.605 53.285 20.385 1.00 0.00 H new ATOM 223 N THR A 14 44.164 55.922 22.698 1.00 0.00 N ATOM 224 CA THR A 14 42.762 55.598 22.533 1.00 0.00 C ATOM 225 C THR A 14 42.530 54.926 21.179 1.00 0.00 C ATOM 226 O THR A 14 43.192 55.264 20.200 1.00 0.00 O ATOM 227 CB THR A 14 41.886 56.838 22.689 1.00 0.00 C ATOM 228 OG1 THR A 14 42.229 57.539 23.863 1.00 0.00 O ATOM 229 CG2 THR A 14 40.402 56.510 22.827 1.00 0.00 C ATOM 0 H THR A 14 44.436 56.779 22.217 1.00 0.00 H new ATOM 0 HA THR A 14 42.478 54.898 23.318 1.00 0.00 H new ATOM 0 HB THR A 14 42.057 57.422 21.785 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.675 57.223 24.607 1.00 0.00 H new ATOM 0 HG21 THR A 14 39.834 57.434 22.934 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.063 55.977 21.939 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.248 55.885 23.706 1.00 0.00 H new ATOM 237 N LEU A 15 41.601 53.977 21.113 1.00 0.00 N ATOM 238 CA LEU A 15 41.154 53.320 19.902 1.00 0.00 C ATOM 239 C LEU A 15 39.654 53.505 19.666 1.00 0.00 C ATOM 240 O LEU A 15 38.910 53.892 20.565 1.00 0.00 O ATOM 241 CB LEU A 15 41.526 51.842 19.944 1.00 0.00 C ATOM 242 CG LEU A 15 43.015 51.524 20.043 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.197 50.011 20.116 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.820 52.023 18.846 1.00 0.00 C ATOM 0 H LEU A 15 41.121 53.633 21.945 1.00 0.00 H new ATOM 0 HA LEU A 15 41.662 53.789 19.060 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.021 51.386 20.795 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.133 51.364 19.047 1.00 0.00 H new ATOM 0 HG LEU A 15 43.381 52.032 20.935 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.259 49.775 20.187 1.00 0.00 H new ATOM 0 HD12 LEU A 15 42.680 49.624 20.994 1.00 0.00 H new ATOM 0 HD13 LEU A 15 42.782 49.551 19.219 1.00 0.00 H new ATOM 0 HD21 LEU A 15 44.870 51.764 18.980 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.445 51.556 17.935 1.00 0.00 H new ATOM 0 HD23 LEU A 15 43.721 53.106 18.766 1.00 0.00 H new ATOM 256 N GLU A 16 39.208 53.221 18.445 1.00 0.00 N ATOM 257 CA GLU A 16 37.824 53.163 18.021 1.00 0.00 C ATOM 258 C GLU A 16 37.513 51.748 17.530 1.00 0.00 C ATOM 259 O GLU A 16 38.152 51.255 16.604 1.00 0.00 O ATOM 260 CB GLU A 16 37.599 54.225 16.949 1.00 0.00 C ATOM 261 CG GLU A 16 36.228 54.207 16.279 1.00 0.00 C ATOM 262 CD GLU A 16 35.086 54.549 17.239 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.029 55.696 17.734 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.198 53.704 17.480 1.00 0.00 O ATOM 0 H GLU A 16 39.851 53.013 17.681 1.00 0.00 H new ATOM 0 HA GLU A 16 37.143 53.376 18.845 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.751 55.206 17.398 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.361 54.105 16.179 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.225 54.917 15.452 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.052 53.220 15.852 1.00 0.00 H new ATOM 271 N VAL A 17 36.568 51.077 18.184 1.00 0.00 N ATOM 272 CA VAL A 17 36.228 49.680 18.003 1.00 0.00 C ATOM 273 C VAL A 17 34.718 49.459 18.108 1.00 0.00 C ATOM 274 O VAL A 17 33.980 50.356 18.509 1.00 0.00 O ATOM 275 CB VAL A 17 36.939 48.801 19.028 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.457 48.842 18.886 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.575 49.156 20.466 1.00 0.00 C ATOM 0 H VAL A 17 35.989 51.526 18.894 1.00 0.00 H new ATOM 0 HA VAL A 17 36.559 49.399 17.003 1.00 0.00 H new ATOM 0 HB VAL A 17 36.588 47.792 18.813 1.00 0.00 H new ATOM 0 HG11 VAL A 17 38.910 48.199 19.640 1.00 0.00 H new ATOM 0 HG12 VAL A 17 38.739 48.492 17.893 1.00 0.00 H new ATOM 0 HG13 VAL A 17 38.808 49.865 19.023 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.111 48.498 21.150 1.00 0.00 H new ATOM 0 HG22 VAL A 17 36.852 50.191 20.667 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.502 49.033 20.611 1.00 0.00 H new ATOM 287 N GLU A 18 34.254 48.252 17.796 1.00 0.00 N ATOM 288 CA GLU A 18 32.991 47.709 18.254 1.00 0.00 C ATOM 289 C GLU A 18 33.189 46.272 18.738 1.00 0.00 C ATOM 290 O GLU A 18 34.210 45.673 18.408 1.00 0.00 O ATOM 291 CB GLU A 18 31.912 47.850 17.184 1.00 0.00 C ATOM 292 CG GLU A 18 31.530 49.302 16.911 1.00 0.00 C ATOM 293 CD GLU A 18 30.366 49.435 15.927 1.00 0.00 C ATOM 294 OE1 GLU A 18 29.221 49.682 16.366 1.00 0.00 O ATOM 295 OE2 GLU A 18 30.603 49.348 14.703 1.00 0.00 O ATOM 0 H GLU A 18 34.769 47.608 17.196 1.00 0.00 H new ATOM 0 HA GLU A 18 32.633 48.285 19.107 1.00 0.00 H new ATOM 0 HB2 GLU A 18 32.263 47.392 16.259 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.025 47.299 17.496 1.00 0.00 H new ATOM 0 HG2 GLU A 18 31.262 49.785 17.851 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.396 49.832 16.516 1.00 0.00 H new ATOM 302 N PRO A 19 32.308 45.692 19.549 1.00 0.00 N ATOM 303 CA PRO A 19 32.645 44.525 20.338 1.00 0.00 C ATOM 304 C PRO A 19 33.036 43.253 19.582 1.00 0.00 C ATOM 305 O PRO A 19 33.762 42.421 20.121 1.00 0.00 O ATOM 306 CB PRO A 19 31.450 44.278 21.254 1.00 0.00 C ATOM 307 CG PRO A 19 30.846 45.669 21.421 1.00 0.00 C ATOM 308 CD PRO A 19 31.066 46.261 20.031 1.00 0.00 C ATOM 0 HA PRO A 19 33.569 44.752 20.870 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.739 43.581 20.810 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.756 43.854 22.210 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.790 45.629 21.688 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.350 46.245 22.197 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.239 46.013 19.366 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.126 47.348 20.075 1.00 0.00 H new ATOM 316 N SER A 20 32.604 43.095 18.334 1.00 0.00 N ATOM 317 CA SER A 20 32.973 41.982 17.481 1.00 0.00 C ATOM 318 C SER A 20 34.359 42.097 16.843 1.00 0.00 C ATOM 319 O SER A 20 34.725 41.218 16.067 1.00 0.00 O ATOM 320 CB SER A 20 31.912 41.739 16.411 1.00 0.00 C ATOM 321 OG SER A 20 30.657 41.522 17.016 1.00 0.00 O ATOM 0 H SER A 20 31.973 43.756 17.882 1.00 0.00 H new ATOM 0 HA SER A 20 33.028 41.122 18.148 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.858 42.596 15.740 1.00 0.00 H new ATOM 0 HB3 SER A 20 32.187 40.876 15.804 1.00 0.00 H new ATOM 0 HG SER A 20 29.982 41.369 16.323 1.00 0.00 H new ATOM 327 N ASP A 21 35.157 43.122 17.129 1.00 0.00 N ATOM 328 CA ASP A 21 36.514 43.228 16.631 1.00 0.00 C ATOM 329 C ASP A 21 37.444 42.198 17.274 1.00 0.00 C ATOM 330 O ASP A 21 37.423 42.009 18.489 1.00 0.00 O ATOM 331 CB ASP A 21 37.041 44.648 16.820 1.00 0.00 C ATOM 332 CG ASP A 21 36.555 45.566 15.697 1.00 0.00 C ATOM 333 OD1 ASP A 21 36.901 45.265 14.534 1.00 0.00 O ATOM 334 OD2 ASP A 21 35.824 46.551 15.944 1.00 0.00 O ATOM 0 H ASP A 21 34.873 43.905 17.718 1.00 0.00 H new ATOM 0 HA ASP A 21 36.494 43.007 15.564 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.710 45.038 17.782 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.131 44.636 16.839 1.00 0.00 H new ATOM 339 N THR A 22 38.274 41.536 16.474 1.00 0.00 N ATOM 340 CA THR A 22 39.255 40.592 16.971 1.00 0.00 C ATOM 341 C THR A 22 40.445 41.296 17.626 1.00 0.00 C ATOM 342 O THR A 22 40.807 42.411 17.260 1.00 0.00 O ATOM 343 CB THR A 22 39.746 39.595 15.925 1.00 0.00 C ATOM 344 OG1 THR A 22 40.199 40.241 14.757 1.00 0.00 O ATOM 345 CG2 THR A 22 38.661 38.595 15.535 1.00 0.00 C ATOM 0 H THR A 22 38.281 41.643 15.460 1.00 0.00 H new ATOM 0 HA THR A 22 38.723 40.015 17.727 1.00 0.00 H new ATOM 0 HB THR A 22 40.576 39.063 16.390 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.507 39.571 14.111 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.054 37.905 14.789 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.347 38.036 16.417 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.806 39.129 15.121 1.00 0.00 H new ATOM 353 N ILE A 23 41.111 40.604 18.547 1.00 0.00 N ATOM 354 CA ILE A 23 42.316 41.097 19.181 1.00 0.00 C ATOM 355 C ILE A 23 43.412 41.346 18.143 1.00 0.00 C ATOM 356 O ILE A 23 44.117 42.347 18.253 1.00 0.00 O ATOM 357 CB ILE A 23 42.773 40.166 20.300 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.708 39.912 21.363 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.038 40.689 20.975 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.078 41.138 22.018 1.00 0.00 C ATOM 0 H ILE A 23 40.823 39.681 18.872 1.00 0.00 H new ATOM 0 HA ILE A 23 42.092 42.056 19.647 1.00 0.00 H new ATOM 0 HB ILE A 23 42.977 39.214 19.809 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.911 39.322 20.910 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.152 39.299 22.147 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.338 40.003 21.768 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.838 40.765 20.239 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.843 41.673 21.401 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.339 40.819 22.753 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.852 41.724 22.513 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.592 41.748 21.257 1.00 0.00 H new ATOM 372 N GLU A 24 43.532 40.538 17.094 1.00 0.00 N ATOM 373 CA GLU A 24 44.482 40.819 16.037 1.00 0.00 C ATOM 374 C GLU A 24 44.111 42.034 15.185 1.00 0.00 C ATOM 375 O GLU A 24 45.009 42.781 14.803 1.00 0.00 O ATOM 376 CB GLU A 24 44.718 39.567 15.196 1.00 0.00 C ATOM 377 CG GLU A 24 46.012 39.641 14.390 1.00 0.00 C ATOM 378 CD GLU A 24 46.360 38.268 13.813 1.00 0.00 C ATOM 379 OE1 GLU A 24 47.429 37.718 14.158 1.00 0.00 O ATOM 380 OE2 GLU A 24 45.566 37.731 13.012 1.00 0.00 O ATOM 0 H GLU A 24 42.984 39.689 16.959 1.00 0.00 H new ATOM 0 HA GLU A 24 45.422 41.097 16.515 1.00 0.00 H new ATOM 0 HB2 GLU A 24 44.750 38.695 15.849 1.00 0.00 H new ATOM 0 HB3 GLU A 24 43.878 39.426 14.516 1.00 0.00 H new ATOM 0 HG2 GLU A 24 45.904 40.365 13.582 1.00 0.00 H new ATOM 0 HG3 GLU A 24 46.825 39.992 15.026 1.00 0.00 H new ATOM 387 N ASN A 25 42.832 42.315 14.959 1.00 0.00 N ATOM 388 CA ASN A 25 42.429 43.559 14.335 1.00 0.00 C ATOM 389 C ASN A 25 42.795 44.769 15.196 1.00 0.00 C ATOM 390 O ASN A 25 43.288 45.772 14.687 1.00 0.00 O ATOM 391 CB ASN A 25 40.944 43.530 13.984 1.00 0.00 C ATOM 392 CG ASN A 25 40.567 44.736 13.120 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.315 45.136 12.231 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.437 45.400 13.344 1.00 0.00 N ATOM 0 H ASN A 25 42.060 41.694 15.201 1.00 0.00 H new ATOM 0 HA ASN A 25 42.985 43.665 13.403 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.709 42.608 13.452 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.349 43.531 14.898 1.00 0.00 H new ATOM 0 HD21 ASN A 25 39.208 46.221 12.784 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.799 45.088 14.076 1.00 0.00 H new ATOM 401 N VAL A 26 42.634 44.659 16.513 1.00 0.00 N ATOM 402 CA VAL A 26 43.096 45.650 17.464 1.00 0.00 C ATOM 403 C VAL A 26 44.617 45.807 17.416 1.00 0.00 C ATOM 404 O VAL A 26 45.091 46.936 17.306 1.00 0.00 O ATOM 405 CB VAL A 26 42.579 45.336 18.865 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.224 46.192 19.952 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.072 45.561 18.939 1.00 0.00 C ATOM 0 H VAL A 26 42.170 43.863 16.950 1.00 0.00 H new ATOM 0 HA VAL A 26 42.682 46.618 17.181 1.00 0.00 H new ATOM 0 HB VAL A 26 42.838 44.293 19.045 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.812 45.918 20.923 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.301 46.026 19.955 1.00 0.00 H new ATOM 0 HG13 VAL A 26 43.020 47.244 19.755 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.719 45.333 19.945 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.847 46.601 18.703 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.571 44.910 18.222 1.00 0.00 H new ATOM 417 N LYS A 27 45.387 44.723 17.381 1.00 0.00 N ATOM 418 CA LYS A 27 46.824 44.761 17.200 1.00 0.00 C ATOM 419 C LYS A 27 47.240 45.434 15.892 1.00 0.00 C ATOM 420 O LYS A 27 48.179 46.228 15.906 1.00 0.00 O ATOM 421 CB LYS A 27 47.434 43.362 17.258 1.00 0.00 C ATOM 422 CG LYS A 27 47.451 42.749 18.654 1.00 0.00 C ATOM 423 CD LYS A 27 48.138 41.386 18.610 1.00 0.00 C ATOM 424 CE LYS A 27 48.532 40.919 20.008 1.00 0.00 C ATOM 425 NZ LYS A 27 49.367 39.712 19.919 1.00 0.00 N ATOM 0 H LYS A 27 45.016 43.778 17.480 1.00 0.00 H new ATOM 0 HA LYS A 27 47.206 45.360 18.027 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.875 42.705 16.591 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.455 43.406 16.880 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.975 43.409 19.345 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.432 42.642 19.027 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.471 40.654 18.154 1.00 0.00 H new ATOM 0 HD3 LYS A 27 49.026 41.444 17.980 1.00 0.00 H new ATOM 0 HE2 LYS A 27 49.076 41.710 20.525 1.00 0.00 H new ATOM 0 HE3 LYS A 27 47.638 40.710 20.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 49.701 39.450 20.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.807 38.931 19.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 50.185 39.900 19.305 1.00 0.00 H new ATOM 439 N ALA A 28 46.536 45.201 14.787 1.00 0.00 N ATOM 440 CA ALA A 28 46.786 45.866 13.524 1.00 0.00 C ATOM 441 C ALA A 28 46.476 47.363 13.563 1.00 0.00 C ATOM 442 O ALA A 28 47.138 48.152 12.893 1.00 0.00 O ATOM 443 CB ALA A 28 45.994 45.148 12.435 1.00 0.00 C ATOM 0 H ALA A 28 45.766 44.534 14.750 1.00 0.00 H new ATOM 0 HA ALA A 28 47.852 45.807 13.305 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.170 45.635 11.476 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.315 44.108 12.378 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.931 45.187 12.672 1.00 0.00 H new ATOM 449 N LYS A 29 45.509 47.797 14.366 1.00 0.00 N ATOM 450 CA LYS A 29 45.210 49.198 14.587 1.00 0.00 C ATOM 451 C LYS A 29 46.268 49.862 15.472 1.00 0.00 C ATOM 452 O LYS A 29 46.697 50.974 15.173 1.00 0.00 O ATOM 453 CB LYS A 29 43.794 49.362 15.132 1.00 0.00 C ATOM 454 CG LYS A 29 42.727 49.711 14.099 1.00 0.00 C ATOM 455 CD LYS A 29 42.195 48.610 13.187 1.00 0.00 C ATOM 456 CE LYS A 29 43.232 48.072 12.206 1.00 0.00 C ATOM 457 NZ LYS A 29 42.638 47.261 11.132 1.00 0.00 N ATOM 0 H LYS A 29 44.902 47.167 14.890 1.00 0.00 H new ATOM 0 HA LYS A 29 45.247 49.718 13.630 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.505 48.435 15.628 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.805 50.141 15.894 1.00 0.00 H new ATOM 0 HG2 LYS A 29 41.877 50.135 14.634 1.00 0.00 H new ATOM 0 HG3 LYS A 29 43.129 50.500 13.463 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.828 47.788 13.801 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.343 48.995 12.627 1.00 0.00 H new ATOM 0 HE2 LYS A 29 43.775 48.908 11.765 1.00 0.00 H new ATOM 0 HE3 LYS A 29 43.960 47.469 12.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 43.390 46.909 10.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 42.127 46.456 11.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 41.976 47.845 10.582 1.00 0.00 H new ATOM 471 N ILE A 30 46.773 49.156 16.480 1.00 0.00 N ATOM 472 CA ILE A 30 47.939 49.546 17.246 1.00 0.00 C ATOM 473 C ILE A 30 49.170 49.632 16.340 1.00 0.00 C ATOM 474 O ILE A 30 49.950 50.572 16.466 1.00 0.00 O ATOM 475 CB ILE A 30 48.153 48.611 18.431 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.003 48.707 19.430 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.475 48.881 19.146 1.00 0.00 C ATOM 478 CD1 ILE A 30 46.951 47.556 20.431 1.00 0.00 C ATOM 0 H ILE A 30 46.367 48.273 16.790 1.00 0.00 H new ATOM 0 HA ILE A 30 47.771 50.541 17.659 1.00 0.00 H new ATOM 0 HB ILE A 30 48.186 47.601 18.022 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.088 49.646 19.976 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.061 48.741 18.882 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.584 48.191 19.983 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.301 48.739 18.449 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.485 49.906 19.517 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.107 47.698 21.105 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.834 46.614 19.896 1.00 0.00 H new ATOM 0 HD13 ILE A 30 47.876 47.533 21.008 1.00 0.00 H new ATOM 490 N GLN A 31 49.338 48.722 15.385 1.00 0.00 N ATOM 491 CA GLN A 31 50.433 48.752 14.436 1.00 0.00 C ATOM 492 C GLN A 31 50.377 49.978 13.524 1.00 0.00 C ATOM 493 O GLN A 31 51.397 50.639 13.350 1.00 0.00 O ATOM 494 CB GLN A 31 50.487 47.457 13.631 1.00 0.00 C ATOM 495 CG GLN A 31 51.763 47.396 12.798 1.00 0.00 C ATOM 496 CD GLN A 31 51.943 46.095 12.012 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.019 45.324 11.765 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.176 45.810 11.600 1.00 0.00 N ATOM 0 H GLN A 31 48.705 47.934 15.251 1.00 0.00 H new ATOM 0 HA GLN A 31 51.357 48.835 15.009 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.445 46.601 14.305 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.617 47.392 12.978 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.766 48.232 12.099 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.620 47.529 13.458 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.943 46.450 11.805 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.354 44.951 11.079 1.00 0.00 H new ATOM 507 N ASP A 32 49.218 50.326 12.970 1.00 0.00 N ATOM 508 CA ASP A 32 49.051 51.537 12.192 1.00 0.00 C ATOM 509 C ASP A 32 49.375 52.796 12.998 1.00 0.00 C ATOM 510 O ASP A 32 50.087 53.667 12.503 1.00 0.00 O ATOM 511 CB ASP A 32 47.636 51.570 11.621 1.00 0.00 C ATOM 512 CG ASP A 32 47.346 52.819 10.787 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.026 53.872 11.378 1.00 0.00 O ATOM 514 OD2 ASP A 32 47.343 52.741 9.538 1.00 0.00 O ATOM 0 H ASP A 32 48.368 49.769 13.052 1.00 0.00 H new ATOM 0 HA ASP A 32 49.766 51.526 11.370 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.481 50.686 11.003 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.920 51.515 12.441 1.00 0.00 H new ATOM 519 N LYS A 33 48.943 52.867 14.253 1.00 0.00 N ATOM 520 CA LYS A 33 49.184 54.008 15.114 1.00 0.00 C ATOM 521 C LYS A 33 50.622 54.137 15.619 1.00 0.00 C ATOM 522 O LYS A 33 51.154 55.244 15.592 1.00 0.00 O ATOM 523 CB LYS A 33 48.181 54.030 16.263 1.00 0.00 C ATOM 524 CG LYS A 33 46.784 54.408 15.779 1.00 0.00 C ATOM 525 CD LYS A 33 45.788 54.694 16.899 1.00 0.00 C ATOM 526 CE LYS A 33 46.186 55.909 17.731 1.00 0.00 C ATOM 527 NZ LYS A 33 45.056 56.467 18.490 1.00 0.00 N ATOM 0 H LYS A 33 48.410 52.122 14.701 1.00 0.00 H new ATOM 0 HA LYS A 33 49.035 54.888 14.488 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.150 53.050 16.739 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.510 54.741 17.021 1.00 0.00 H new ATOM 0 HG2 LYS A 33 46.859 55.289 15.141 1.00 0.00 H new ATOM 0 HG3 LYS A 33 46.395 53.599 15.160 1.00 0.00 H new ATOM 0 HD2 LYS A 33 44.799 54.858 16.470 1.00 0.00 H new ATOM 0 HD3 LYS A 33 45.713 53.821 17.547 1.00 0.00 H new ATOM 0 HE2 LYS A 33 46.980 55.627 18.422 1.00 0.00 H new ATOM 0 HE3 LYS A 33 46.593 56.678 17.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 45.403 57.201 19.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 44.368 56.884 17.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.597 55.710 19.036 1.00 0.00 H new ATOM 541 N GLU A 34 51.250 53.055 16.072 1.00 0.00 N ATOM 542 CA GLU A 34 52.476 53.072 16.845 1.00 0.00 C ATOM 543 C GLU A 34 53.634 52.270 16.247 1.00 0.00 C ATOM 544 O GLU A 34 54.746 52.331 16.767 1.00 0.00 O ATOM 545 CB GLU A 34 52.187 52.587 18.263 1.00 0.00 C ATOM 546 CG GLU A 34 51.266 53.485 19.082 1.00 0.00 C ATOM 547 CD GLU A 34 51.918 54.827 19.421 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.928 54.835 20.156 1.00 0.00 O ATOM 549 OE2 GLU A 34 51.446 55.881 18.941 1.00 0.00 O ATOM 0 H GLU A 34 50.902 52.112 15.902 1.00 0.00 H new ATOM 0 HA GLU A 34 52.814 54.108 16.839 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.743 51.593 18.206 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.133 52.483 18.794 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.345 53.661 18.526 1.00 0.00 H new ATOM 0 HG3 GLU A 34 50.990 52.974 20.004 1.00 0.00 H new ATOM 556 N GLY A 35 53.426 51.518 15.171 1.00 0.00 N ATOM 557 CA GLY A 35 54.479 50.803 14.478 1.00 0.00 C ATOM 558 C GLY A 35 55.022 49.572 15.209 1.00 0.00 C ATOM 559 O GLY A 35 56.233 49.363 15.226 1.00 0.00 O ATOM 0 H GLY A 35 52.504 51.390 14.753 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.104 50.491 13.503 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.305 51.491 14.296 1.00 0.00 H new ATOM 563 N ILE A 36 54.153 48.803 15.857 1.00 0.00 N ATOM 564 CA ILE A 36 54.483 47.626 16.635 1.00 0.00 C ATOM 565 C ILE A 36 53.797 46.408 16.011 1.00 0.00 C ATOM 566 O ILE A 36 52.579 46.293 16.134 1.00 0.00 O ATOM 567 CB ILE A 36 54.088 47.811 18.096 1.00 0.00 C ATOM 568 CG1 ILE A 36 54.722 49.054 18.712 1.00 0.00 C ATOM 569 CG2 ILE A 36 54.477 46.571 18.897 1.00 0.00 C ATOM 570 CD1 ILE A 36 54.209 49.411 20.104 1.00 0.00 C ATOM 0 H ILE A 36 53.152 48.998 15.850 1.00 0.00 H new ATOM 0 HA ILE A 36 55.561 47.467 16.619 1.00 0.00 H new ATOM 0 HB ILE A 36 53.007 47.949 18.130 1.00 0.00 H new ATOM 0 HG12 ILE A 36 55.801 48.906 18.764 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.548 49.901 18.048 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.193 46.708 19.940 1.00 0.00 H new ATOM 0 HG22 ILE A 36 53.962 45.700 18.492 1.00 0.00 H new ATOM 0 HG23 ILE A 36 55.554 46.419 18.831 1.00 0.00 H new ATOM 0 HD11 ILE A 36 54.717 50.307 20.460 1.00 0.00 H new ATOM 0 HD12 ILE A 36 53.136 49.595 20.060 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.408 48.586 20.788 1.00 0.00 H new ATOM 582 N PRO A 37 54.509 45.491 15.364 1.00 0.00 N ATOM 583 CA PRO A 37 53.914 44.319 14.752 1.00 0.00 C ATOM 584 C PRO A 37 53.182 43.394 15.726 1.00 0.00 C ATOM 585 O PRO A 37 53.681 43.181 16.829 1.00 0.00 O ATOM 586 CB PRO A 37 55.053 43.590 14.044 1.00 0.00 C ATOM 587 CG PRO A 37 56.004 44.728 13.689 1.00 0.00 C ATOM 588 CD PRO A 37 55.874 45.642 14.904 1.00 0.00 C ATOM 0 HA PRO A 37 53.130 44.636 14.064 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.527 42.852 14.691 1.00 0.00 H new ATOM 0 HB3 PRO A 37 54.706 43.060 13.157 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.027 44.377 13.550 1.00 0.00 H new ATOM 0 HG3 PRO A 37 55.712 45.231 12.767 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.583 45.361 15.683 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.086 46.678 14.639 1.00 0.00 H new ATOM 596 N PRO A 38 52.042 42.817 15.355 1.00 0.00 N ATOM 597 CA PRO A 38 51.217 41.978 16.201 1.00 0.00 C ATOM 598 C PRO A 38 51.905 40.856 16.981 1.00 0.00 C ATOM 599 O PRO A 38 51.475 40.558 18.093 1.00 0.00 O ATOM 600 CB PRO A 38 50.166 41.382 15.268 1.00 0.00 C ATOM 601 CG PRO A 38 49.921 42.521 14.283 1.00 0.00 C ATOM 602 CD PRO A 38 51.315 43.123 14.140 1.00 0.00 C ATOM 0 HA PRO A 38 50.832 42.613 16.999 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.528 40.484 14.769 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.258 41.105 15.803 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.533 42.160 13.331 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.202 43.244 14.667 1.00 0.00 H new ATOM 0 HD2 PRO A 38 51.826 42.708 13.271 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.255 44.201 13.989 1.00 0.00 H new ATOM 610 N ASP A 39 52.970 40.259 16.454 1.00 0.00 N ATOM 611 CA ASP A 39 53.705 39.212 17.135 1.00 0.00 C ATOM 612 C ASP A 39 54.625 39.723 18.246 1.00 0.00 C ATOM 613 O ASP A 39 54.927 38.970 19.170 1.00 0.00 O ATOM 614 CB ASP A 39 54.466 38.344 16.139 1.00 0.00 C ATOM 615 CG ASP A 39 55.635 39.024 15.422 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.455 40.133 14.877 1.00 0.00 O ATOM 617 OD2 ASP A 39 56.719 38.414 15.311 1.00 0.00 O ATOM 0 H ASP A 39 53.345 40.494 15.535 1.00 0.00 H new ATOM 0 HA ASP A 39 52.957 38.598 17.636 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.846 37.468 16.665 1.00 0.00 H new ATOM 0 HB3 ASP A 39 53.763 37.984 15.388 1.00 0.00 H new ATOM 622 N GLN A 40 55.032 40.988 18.201 1.00 0.00 N ATOM 623 CA GLN A 40 55.908 41.601 19.178 1.00 0.00 C ATOM 624 C GLN A 40 55.167 42.103 20.419 1.00 0.00 C ATOM 625 O GLN A 40 55.777 42.232 21.478 1.00 0.00 O ATOM 626 CB GLN A 40 56.685 42.752 18.547 1.00 0.00 C ATOM 627 CG GLN A 40 57.515 42.360 17.328 1.00 0.00 C ATOM 628 CD GLN A 40 58.314 43.532 16.752 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.620 44.516 17.421 1.00 0.00 O ATOM 630 NE2 GLN A 40 58.679 43.493 15.474 1.00 0.00 N ATOM 0 H GLN A 40 54.750 41.629 17.459 1.00 0.00 H new ATOM 0 HA GLN A 40 56.594 40.820 19.506 1.00 0.00 H new ATOM 0 HB2 GLN A 40 55.982 43.533 18.257 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.347 43.183 19.299 1.00 0.00 H new ATOM 0 HG2 GLN A 40 58.201 41.559 17.604 1.00 0.00 H new ATOM 0 HG3 GLN A 40 56.855 41.963 16.557 1.00 0.00 H new ATOM 0 HE21 GLN A 40 58.436 42.686 14.899 1.00 0.00 H new ATOM 0 HE22 GLN A 40 59.202 44.270 15.069 1.00 0.00 H new ATOM 639 N GLN A 41 53.871 42.373 20.291 1.00 0.00 N ATOM 640 CA GLN A 41 53.023 42.907 21.339 1.00 0.00 C ATOM 641 C GLN A 41 52.191 41.830 22.037 1.00 0.00 C ATOM 642 O GLN A 41 51.501 41.042 21.394 1.00 0.00 O ATOM 643 CB GLN A 41 52.170 44.069 20.837 1.00 0.00 C ATOM 644 CG GLN A 41 51.434 43.836 19.520 1.00 0.00 C ATOM 645 CD GLN A 41 50.451 44.959 19.184 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.538 45.271 19.946 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.552 45.586 18.015 1.00 0.00 N ATOM 0 H GLN A 41 53.368 42.218 19.417 1.00 0.00 H new ATOM 0 HA GLN A 41 53.689 43.307 22.104 1.00 0.00 H new ATOM 0 HB2 GLN A 41 51.434 44.312 21.604 1.00 0.00 H new ATOM 0 HB3 GLN A 41 52.812 44.943 20.723 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.162 43.743 18.714 1.00 0.00 H new ATOM 0 HG3 GLN A 41 50.894 42.891 19.573 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.302 45.342 17.369 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.879 46.311 17.765 1.00 0.00 H new ATOM 656 N ARG A 42 52.220 41.840 23.367 1.00 0.00 N ATOM 657 CA ARG A 42 51.360 41.081 24.251 1.00 0.00 C ATOM 658 C ARG A 42 50.275 41.992 24.829 1.00 0.00 C ATOM 659 O ARG A 42 50.599 43.034 25.395 1.00 0.00 O ATOM 660 CB ARG A 42 52.206 40.406 25.326 1.00 0.00 C ATOM 661 CG ARG A 42 51.364 39.765 26.425 1.00 0.00 C ATOM 662 CD ARG A 42 52.133 38.726 27.236 1.00 0.00 C ATOM 663 NE ARG A 42 53.291 39.280 27.939 1.00 0.00 N ATOM 664 CZ ARG A 42 54.572 38.911 27.805 1.00 0.00 C ATOM 665 NH1 ARG A 42 54.981 37.959 26.955 1.00 0.00 N ATOM 666 NH2 ARG A 42 55.493 39.527 28.559 1.00 0.00 N ATOM 0 H ARG A 42 52.887 42.415 23.881 1.00 0.00 H new ATOM 0 HA ARG A 42 50.848 40.292 23.701 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.833 39.644 24.863 1.00 0.00 H new ATOM 0 HB3 ARG A 42 52.876 41.142 25.770 1.00 0.00 H new ATOM 0 HG2 ARG A 42 50.998 40.543 27.095 1.00 0.00 H new ATOM 0 HG3 ARG A 42 50.490 39.293 25.977 1.00 0.00 H new ATOM 0 HD2 ARG A 42 51.459 38.271 27.962 1.00 0.00 H new ATOM 0 HD3 ARG A 42 52.468 37.931 26.570 1.00 0.00 H new ATOM 0 HE ARG A 42 53.102 40.030 28.604 1.00 0.00 H new ATOM 0 HH11 ARG A 42 54.303 37.474 26.368 1.00 0.00 H new ATOM 0 HH12 ARG A 42 55.971 37.719 26.895 1.00 0.00 H new ATOM 0 HH21 ARG A 42 55.211 40.256 29.214 1.00 0.00 H new ATOM 0 HH22 ARG A 42 56.476 39.266 28.478 1.00 0.00 H new ATOM 680 N LEU A 43 49.017 41.579 24.709 1.00 0.00 N ATOM 681 CA LEU A 43 47.860 42.279 25.228 1.00 0.00 C ATOM 682 C LEU A 43 47.226 41.500 26.383 1.00 0.00 C ATOM 683 O LEU A 43 46.931 40.315 26.244 1.00 0.00 O ATOM 684 CB LEU A 43 46.877 42.566 24.097 1.00 0.00 C ATOM 685 CG LEU A 43 47.398 43.496 23.005 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.359 43.624 21.895 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.709 44.898 23.521 1.00 0.00 C ATOM 0 H LEU A 43 48.772 40.713 24.228 1.00 0.00 H new ATOM 0 HA LEU A 43 48.170 43.239 25.640 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.588 41.620 23.639 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.974 43.003 24.524 1.00 0.00 H new ATOM 0 HG LEU A 43 48.323 43.052 22.636 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.736 44.289 21.118 1.00 0.00 H new ATOM 0 HD12 LEU A 43 46.161 42.641 21.467 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.436 44.033 22.306 1.00 0.00 H new ATOM 0 HD21 LEU A 43 48.076 45.515 22.700 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.803 45.343 23.933 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.470 44.839 24.299 1.00 0.00 H new ATOM 699 N ILE A 44 47.049 42.163 27.523 1.00 0.00 N ATOM 700 CA ILE A 44 46.650 41.587 28.791 1.00 0.00 C ATOM 701 C ILE A 44 45.427 42.303 29.367 1.00 0.00 C ATOM 702 O ILE A 44 45.382 43.529 29.435 1.00 0.00 O ATOM 703 CB ILE A 44 47.831 41.581 29.757 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.848 40.515 29.361 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.412 41.376 31.211 1.00 0.00 C ATOM 706 CD1 ILE A 44 50.247 40.753 29.922 1.00 0.00 C ATOM 0 H ILE A 44 47.189 43.171 27.583 1.00 0.00 H new ATOM 0 HA ILE A 44 46.350 40.552 28.630 1.00 0.00 H new ATOM 0 HB ILE A 44 48.286 42.569 29.686 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.492 39.543 29.702 1.00 0.00 H new ATOM 0 HG13 ILE A 44 48.907 40.470 28.274 1.00 0.00 H new ATOM 0 HG21 ILE A 44 48.296 41.381 31.849 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.742 42.181 31.513 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.899 40.420 31.310 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.911 39.952 29.596 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.626 41.709 29.561 1.00 0.00 H new ATOM 0 HD13 ILE A 44 50.205 40.768 31.011 1.00 0.00 H new ATOM 718 N PHE A 45 44.462 41.520 29.839 1.00 0.00 N ATOM 719 CA PHE A 45 43.284 41.959 30.559 1.00 0.00 C ATOM 720 C PHE A 45 42.906 40.928 31.624 1.00 0.00 C ATOM 721 O PHE A 45 43.106 39.733 31.415 1.00 0.00 O ATOM 722 CB PHE A 45 42.134 42.162 29.576 1.00 0.00 C ATOM 723 CG PHE A 45 40.948 42.930 30.109 1.00 0.00 C ATOM 724 CD1 PHE A 45 41.009 44.324 30.216 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.769 42.263 30.465 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.901 45.048 30.669 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.660 42.984 30.925 1.00 0.00 C ATOM 728 CZ PHE A 45 38.723 44.379 31.020 1.00 0.00 C ATOM 0 H PHE A 45 44.488 40.507 29.720 1.00 0.00 H new ATOM 0 HA PHE A 45 43.494 42.905 31.058 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.517 42.683 28.699 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.790 41.184 29.240 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.917 44.844 29.947 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.715 41.187 30.384 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.955 46.124 30.748 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.756 42.464 31.206 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.865 44.938 31.363 1.00 0.00 H new ATOM 738 N ALA A 46 42.338 41.347 32.751 1.00 0.00 N ATOM 739 CA ALA A 46 41.837 40.483 33.801 1.00 0.00 C ATOM 740 C ALA A 46 42.807 39.402 34.279 1.00 0.00 C ATOM 741 O ALA A 46 42.404 38.280 34.575 1.00 0.00 O ATOM 742 CB ALA A 46 40.454 39.970 33.406 1.00 0.00 C ATOM 0 H ALA A 46 42.212 42.337 32.960 1.00 0.00 H new ATOM 0 HA ALA A 46 41.737 41.085 34.704 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.070 39.319 34.191 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.778 40.814 33.271 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.526 39.410 32.473 1.00 0.00 H new ATOM 748 N GLY A 47 44.100 39.710 34.330 1.00 0.00 N ATOM 749 CA GLY A 47 45.151 38.797 34.729 1.00 0.00 C ATOM 750 C GLY A 47 45.551 37.722 33.717 1.00 0.00 C ATOM 751 O GLY A 47 46.273 36.804 34.102 1.00 0.00 O ATOM 0 H GLY A 47 44.450 40.636 34.085 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.038 39.384 34.970 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.839 38.300 35.647 1.00 0.00 H new ATOM 755 N LYS A 48 45.125 37.813 32.462 1.00 0.00 N ATOM 756 CA LYS A 48 45.444 36.880 31.400 1.00 0.00 C ATOM 757 C LYS A 48 45.897 37.563 30.108 1.00 0.00 C ATOM 758 O LYS A 48 45.529 38.704 29.837 1.00 0.00 O ATOM 759 CB LYS A 48 44.264 35.951 31.133 1.00 0.00 C ATOM 760 CG LYS A 48 42.991 36.666 30.690 1.00 0.00 C ATOM 761 CD LYS A 48 41.988 35.699 30.067 1.00 0.00 C ATOM 762 CE LYS A 48 40.711 36.418 29.641 1.00 0.00 C ATOM 763 NZ LYS A 48 39.799 36.660 30.770 1.00 0.00 N ATOM 0 H LYS A 48 44.522 38.574 32.149 1.00 0.00 H new ATOM 0 HA LYS A 48 46.294 36.294 31.749 1.00 0.00 H new ATOM 0 HB2 LYS A 48 44.549 35.232 30.365 1.00 0.00 H new ATOM 0 HB3 LYS A 48 44.052 35.383 32.039 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.535 37.161 31.547 1.00 0.00 H new ATOM 0 HG3 LYS A 48 43.243 37.444 29.969 1.00 0.00 H new ATOM 0 HD2 LYS A 48 42.439 35.212 29.202 1.00 0.00 H new ATOM 0 HD3 LYS A 48 41.744 34.914 30.783 1.00 0.00 H new ATOM 0 HE2 LYS A 48 40.971 37.370 29.177 1.00 0.00 H new ATOM 0 HE3 LYS A 48 40.198 35.824 28.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 38.947 37.150 30.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 39.528 35.752 31.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 40.276 37.249 31.482 1.00 0.00 H new ATOM 777 N GLN A 49 46.638 36.833 29.280 1.00 0.00 N ATOM 778 CA GLN A 49 46.912 37.177 27.899 1.00 0.00 C ATOM 779 C GLN A 49 45.672 36.923 27.038 1.00 0.00 C ATOM 780 O GLN A 49 44.939 35.965 27.272 1.00 0.00 O ATOM 781 CB GLN A 49 48.108 36.361 27.416 1.00 0.00 C ATOM 782 CG GLN A 49 48.586 36.733 26.015 1.00 0.00 C ATOM 783 CD GLN A 49 49.771 35.869 25.583 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.932 36.163 25.857 1.00 0.00 O ATOM 785 NE2 GLN A 49 49.540 34.751 24.901 1.00 0.00 N ATOM 0 H GLN A 49 47.076 35.958 29.567 1.00 0.00 H new ATOM 0 HA GLN A 49 47.155 38.236 27.815 1.00 0.00 H new ATOM 0 HB2 GLN A 49 48.932 36.493 28.117 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.843 35.304 27.430 1.00 0.00 H new ATOM 0 HG2 GLN A 49 47.768 36.612 25.305 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.873 37.784 25.994 1.00 0.00 H new ATOM 0 HE21 GLN A 49 48.584 34.487 24.663 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.319 34.157 24.616 1.00 0.00 H new ATOM 794 N LEU A 50 45.455 37.747 26.017 1.00 0.00 N ATOM 795 CA LEU A 50 44.366 37.596 25.072 1.00 0.00 C ATOM 796 C LEU A 50 44.813 36.913 23.778 1.00 0.00 C ATOM 797 O LEU A 50 45.952 37.042 23.336 1.00 0.00 O ATOM 798 CB LEU A 50 43.701 38.948 24.836 1.00 0.00 C ATOM 799 CG LEU A 50 43.256 39.700 26.088 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.441 40.919 25.666 1.00 0.00 C ATOM 801 CD2 LEU A 50 42.413 38.853 27.037 1.00 0.00 C ATOM 0 H LEU A 50 46.048 38.554 25.824 1.00 0.00 H new ATOM 0 HA LEU A 50 43.620 36.927 25.501 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.395 39.581 24.283 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.830 38.796 24.198 1.00 0.00 H new ATOM 0 HG LEU A 50 44.160 39.983 26.628 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.117 41.465 26.552 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.055 41.570 25.043 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.568 40.595 25.100 1.00 0.00 H new ATOM 0 HD21 LEU A 50 42.132 39.450 27.905 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.514 38.515 26.522 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.991 37.988 27.363 1.00 0.00 H new ATOM 813 N GLU A 51 43.929 36.138 23.156 1.00 0.00 N ATOM 814 CA GLU A 51 44.193 35.356 21.964 1.00 0.00 C ATOM 815 C GLU A 51 43.823 36.140 20.703 1.00 0.00 C ATOM 816 O GLU A 51 42.796 36.813 20.645 1.00 0.00 O ATOM 817 CB GLU A 51 43.459 34.020 22.033 1.00 0.00 C ATOM 818 CG GLU A 51 44.236 32.836 21.466 1.00 0.00 C ATOM 819 CD GLU A 51 44.622 33.013 19.997 1.00 0.00 C ATOM 820 OE1 GLU A 51 43.714 33.118 19.143 1.00 0.00 O ATOM 821 OE2 GLU A 51 45.835 33.077 19.698 1.00 0.00 O ATOM 0 H GLU A 51 42.970 36.037 23.488 1.00 0.00 H new ATOM 0 HA GLU A 51 45.262 35.148 21.913 1.00 0.00 H new ATOM 0 HB2 GLU A 51 43.212 33.810 23.074 1.00 0.00 H new ATOM 0 HB3 GLU A 51 42.516 34.110 21.493 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.140 32.687 22.057 1.00 0.00 H new ATOM 0 HG3 GLU A 51 43.635 31.933 21.570 1.00 0.00 H new ATOM 828 N ASP A 52 44.643 36.013 19.663 1.00 0.00 N ATOM 829 CA ASP A 52 44.550 36.782 18.439 1.00 0.00 C ATOM 830 C ASP A 52 43.249 36.566 17.664 1.00 0.00 C ATOM 831 O ASP A 52 42.774 37.493 17.013 1.00 0.00 O ATOM 832 CB ASP A 52 45.774 36.441 17.594 1.00 0.00 C ATOM 833 CG ASP A 52 47.088 36.805 18.289 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.903 35.896 18.557 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.343 37.998 18.561 1.00 0.00 O ATOM 0 H ASP A 52 45.415 35.347 19.656 1.00 0.00 H new ATOM 0 HA ASP A 52 44.531 37.842 18.694 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.770 35.375 17.368 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.712 36.968 16.642 1.00 0.00 H new ATOM 840 N GLY A 53 42.648 35.381 17.734 1.00 0.00 N ATOM 841 CA GLY A 53 41.412 35.017 17.070 1.00 0.00 C ATOM 842 C GLY A 53 40.126 35.265 17.860 1.00 0.00 C ATOM 843 O GLY A 53 39.041 35.095 17.308 1.00 0.00 O ATOM 0 H GLY A 53 43.034 34.614 18.285 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.351 35.569 16.132 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.459 33.959 16.814 1.00 0.00 H new ATOM 847 N ARG A 54 40.211 35.662 19.127 1.00 0.00 N ATOM 848 CA ARG A 54 39.074 36.047 19.936 1.00 0.00 C ATOM 849 C ARG A 54 38.744 37.531 19.767 1.00 0.00 C ATOM 850 O ARG A 54 39.518 38.279 19.172 1.00 0.00 O ATOM 851 CB ARG A 54 39.327 35.657 21.390 1.00 0.00 C ATOM 852 CG ARG A 54 39.399 34.164 21.700 1.00 0.00 C ATOM 853 CD ARG A 54 38.166 33.342 21.334 1.00 0.00 C ATOM 854 NE ARG A 54 38.133 32.969 19.919 1.00 0.00 N ATOM 855 CZ ARG A 54 37.037 32.753 19.179 1.00 0.00 C ATOM 856 NH1 ARG A 54 35.786 33.002 19.593 1.00 0.00 N ATOM 857 NH2 ARG A 54 37.138 32.279 17.930 1.00 0.00 N ATOM 0 H ARG A 54 41.099 35.724 19.626 1.00 0.00 H new ATOM 0 HA ARG A 54 38.190 35.508 19.596 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.264 36.115 21.706 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.537 36.093 22.001 1.00 0.00 H new ATOM 0 HG2 ARG A 54 40.258 33.746 21.176 1.00 0.00 H new ATOM 0 HG3 ARG A 54 39.587 34.044 22.767 1.00 0.00 H new ATOM 0 HD2 ARG A 54 38.143 32.439 21.944 1.00 0.00 H new ATOM 0 HD3 ARG A 54 37.269 33.913 21.576 1.00 0.00 H new ATOM 0 HE ARG A 54 39.033 32.863 19.450 1.00 0.00 H new ATOM 0 HH11 ARG A 54 35.623 33.381 20.526 1.00 0.00 H new ATOM 0 HH12 ARG A 54 34.997 32.813 18.975 1.00 0.00 H new ATOM 0 HH21 ARG A 54 38.056 32.079 17.533 1.00 0.00 H new ATOM 0 HH22 ARG A 54 36.297 32.118 17.376 1.00 0.00 H new ATOM 871 N THR A 55 37.583 37.951 20.262 1.00 0.00 N ATOM 872 CA THR A 55 37.055 39.297 20.160 1.00 0.00 C ATOM 873 C THR A 55 36.873 39.979 21.518 1.00 0.00 C ATOM 874 O THR A 55 36.959 39.337 22.563 1.00 0.00 O ATOM 875 CB THR A 55 35.727 39.335 19.409 1.00 0.00 C ATOM 876 OG1 THR A 55 34.739 38.624 20.121 1.00 0.00 O ATOM 877 CG2 THR A 55 35.798 38.764 17.996 1.00 0.00 C ATOM 0 H THR A 55 36.958 37.325 20.770 1.00 0.00 H new ATOM 0 HA THR A 55 37.808 39.849 19.599 1.00 0.00 H new ATOM 0 HB THR A 55 35.474 40.392 19.326 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.932 37.664 20.078 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.815 38.827 17.528 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.517 39.335 17.408 1.00 0.00 H new ATOM 0 HG23 THR A 55 36.113 37.721 18.040 1.00 0.00 H new ATOM 885 N LEU A 56 36.578 41.276 21.517 1.00 0.00 N ATOM 886 CA LEU A 56 36.257 41.997 22.732 1.00 0.00 C ATOM 887 C LEU A 56 35.041 41.401 23.443 1.00 0.00 C ATOM 888 O LEU A 56 35.064 41.282 24.665 1.00 0.00 O ATOM 889 CB LEU A 56 36.061 43.480 22.430 1.00 0.00 C ATOM 890 CG LEU A 56 37.231 44.173 21.737 1.00 0.00 C ATOM 891 CD1 LEU A 56 36.851 45.613 21.401 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.493 44.193 22.596 1.00 0.00 C ATOM 0 H LEU A 56 36.556 41.850 20.674 1.00 0.00 H new ATOM 0 HA LEU A 56 37.099 41.896 23.417 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.175 43.591 21.805 1.00 0.00 H new ATOM 0 HB3 LEU A 56 35.858 43.999 23.367 1.00 0.00 H new ATOM 0 HG LEU A 56 37.445 43.603 20.833 1.00 0.00 H new ATOM 0 HD11 LEU A 56 37.689 46.104 20.906 1.00 0.00 H new ATOM 0 HD12 LEU A 56 35.986 45.616 20.738 1.00 0.00 H new ATOM 0 HD13 LEU A 56 36.607 46.148 22.318 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.294 44.697 22.055 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.292 44.725 23.526 1.00 0.00 H new ATOM 0 HD23 LEU A 56 38.796 43.170 22.822 1.00 0.00 H new ATOM 904 N SER A 57 34.033 40.943 22.705 1.00 0.00 N ATOM 905 CA SER A 57 32.905 40.203 23.233 1.00 0.00 C ATOM 906 C SER A 57 33.280 38.873 23.890 1.00 0.00 C ATOM 907 O SER A 57 32.699 38.548 24.922 1.00 0.00 O ATOM 908 CB SER A 57 31.894 39.884 22.136 1.00 0.00 C ATOM 909 OG SER A 57 31.333 41.046 21.568 1.00 0.00 O ATOM 0 H SER A 57 33.983 41.084 21.696 1.00 0.00 H new ATOM 0 HA SER A 57 32.486 40.862 23.993 1.00 0.00 H new ATOM 0 HB2 SER A 57 32.381 39.300 21.355 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.098 39.264 22.548 1.00 0.00 H new ATOM 0 HG SER A 57 30.693 40.793 20.870 1.00 0.00 H new ATOM 915 N ASP A 58 34.231 38.115 23.348 1.00 0.00 N ATOM 916 CA ASP A 58 34.674 36.863 23.926 1.00 0.00 C ATOM 917 C ASP A 58 35.266 37.043 25.326 1.00 0.00 C ATOM 918 O ASP A 58 35.169 36.139 26.152 1.00 0.00 O ATOM 919 CB ASP A 58 35.730 36.187 23.058 1.00 0.00 C ATOM 920 CG ASP A 58 35.217 35.573 21.753 1.00 0.00 C ATOM 921 OD1 ASP A 58 34.756 34.411 21.780 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.422 36.177 20.679 1.00 0.00 O ATOM 0 H ASP A 58 34.717 38.362 22.486 1.00 0.00 H new ATOM 0 HA ASP A 58 33.781 36.241 23.988 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.500 36.920 22.816 1.00 0.00 H new ATOM 0 HB3 ASP A 58 36.209 35.403 23.644 1.00 0.00 H new ATOM 927 N TYR A 59 35.849 38.205 25.604 1.00 0.00 N ATOM 928 CA TYR A 59 36.446 38.553 26.877 1.00 0.00 C ATOM 929 C TYR A 59 35.615 39.520 27.724 1.00 0.00 C ATOM 930 O TYR A 59 36.078 39.938 28.782 1.00 0.00 O ATOM 931 CB TYR A 59 37.865 39.064 26.644 1.00 0.00 C ATOM 932 CG TYR A 59 38.776 38.055 25.987 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.027 36.828 26.613 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.380 38.355 24.760 1.00 0.00 C ATOM 935 CE1 TYR A 59 39.886 35.893 26.025 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.259 37.436 24.173 1.00 0.00 C ATOM 937 CZ TYR A 59 40.519 36.204 24.804 1.00 0.00 C ATOM 938 OH TYR A 59 41.385 35.323 24.227 1.00 0.00 O ATOM 0 H TYR A 59 35.918 38.956 24.917 1.00 0.00 H new ATOM 0 HA TYR A 59 36.478 37.643 27.476 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.822 39.959 26.023 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.296 39.360 27.600 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.554 36.601 27.557 1.00 0.00 H new ATOM 0 HD2 TYR A 59 39.169 39.293 24.267 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.063 34.941 26.503 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.738 37.673 23.235 1.00 0.00 H new ATOM 0 HH TYR A 59 41.126 34.408 24.463 1.00 0.00 H new ATOM 948 N ASN A 60 34.400 39.853 27.295 1.00 0.00 N ATOM 949 CA ASN A 60 33.487 40.749 27.975 1.00 0.00 C ATOM 950 C ASN A 60 34.055 42.145 28.241 1.00 0.00 C ATOM 951 O ASN A 60 33.781 42.754 29.273 1.00 0.00 O ATOM 952 CB ASN A 60 32.931 40.041 29.207 1.00 0.00 C ATOM 953 CG ASN A 60 31.623 40.648 29.720 1.00 0.00 C ATOM 954 OD1 ASN A 60 30.794 41.174 28.981 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.365 40.520 31.019 1.00 0.00 N ATOM 0 H ASN A 60 34.014 39.486 26.425 1.00 0.00 H new ATOM 0 HA ASN A 60 32.655 40.971 27.307 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.766 38.990 28.969 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.675 40.075 30.003 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.481 40.858 31.399 1.00 0.00 H new ATOM 0 HD22 ASN A 60 32.051 40.084 31.635 1.00 0.00 H new ATOM 962 N ILE A 61 34.874 42.656 27.326 1.00 0.00 N ATOM 963 CA ILE A 61 35.494 43.962 27.406 1.00 0.00 C ATOM 964 C ILE A 61 34.471 45.031 27.016 1.00 0.00 C ATOM 965 O ILE A 61 33.634 44.805 26.144 1.00 0.00 O ATOM 966 CB ILE A 61 36.773 44.001 26.574 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.802 43.023 27.135 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.368 45.405 26.516 1.00 0.00 C ATOM 969 CD1 ILE A 61 39.028 42.784 26.259 1.00 0.00 C ATOM 0 H ILE A 61 35.129 42.148 26.479 1.00 0.00 H new ATOM 0 HA ILE A 61 35.804 44.175 28.429 1.00 0.00 H new ATOM 0 HB ILE A 61 36.510 43.706 25.558 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.136 43.392 28.105 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.310 42.066 27.310 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.277 45.390 25.915 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.647 46.088 26.067 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.606 45.741 27.525 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.694 42.074 26.750 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.714 42.380 25.296 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.553 43.726 26.104 1.00 0.00 H new ATOM 981 N GLN A 62 34.511 46.188 27.671 1.00 0.00 N ATOM 982 CA GLN A 62 33.496 47.217 27.569 1.00 0.00 C ATOM 983 C GLN A 62 34.040 48.642 27.465 1.00 0.00 C ATOM 984 O GLN A 62 35.205 48.905 27.755 1.00 0.00 O ATOM 985 CB GLN A 62 32.526 47.081 28.740 1.00 0.00 C ATOM 986 CG GLN A 62 31.298 46.257 28.364 1.00 0.00 C ATOM 987 CD GLN A 62 30.466 46.908 27.256 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.535 48.111 27.016 1.00 0.00 O ATOM 989 NE2 GLN A 62 29.663 46.141 26.524 1.00 0.00 N ATOM 0 H GLN A 62 35.273 46.436 28.302 1.00 0.00 H new ATOM 0 HA GLN A 62 32.979 47.054 26.624 1.00 0.00 H new ATOM 0 HB2 GLN A 62 33.035 46.611 29.582 1.00 0.00 H new ATOM 0 HB3 GLN A 62 32.212 48.072 29.070 1.00 0.00 H new ATOM 0 HG2 GLN A 62 31.616 45.266 28.039 1.00 0.00 H new ATOM 0 HG3 GLN A 62 30.674 46.118 29.247 1.00 0.00 H new ATOM 0 HE21 GLN A 62 29.599 45.141 26.715 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.111 46.553 25.771 1.00 0.00 H new ATOM 998 N LYS A 63 33.157 49.554 27.069 1.00 0.00 N ATOM 999 CA LYS A 63 33.360 50.977 26.891 1.00 0.00 C ATOM 1000 C LYS A 63 34.273 51.604 27.946 1.00 0.00 C ATOM 1001 O LYS A 63 34.004 51.518 29.143 1.00 0.00 O ATOM 1002 CB LYS A 63 31.972 51.612 26.930 1.00 0.00 C ATOM 1003 CG LYS A 63 31.933 53.126 26.748 1.00 0.00 C ATOM 1004 CD LYS A 63 30.481 53.589 26.827 1.00 0.00 C ATOM 1005 CE LYS A 63 30.361 55.110 26.863 1.00 0.00 C ATOM 1006 NZ LYS A 63 29.019 55.505 27.317 1.00 0.00 N ATOM 0 H LYS A 63 32.198 49.286 26.846 1.00 0.00 H new ATOM 0 HA LYS A 63 33.871 51.154 25.944 1.00 0.00 H new ATOM 0 HB2 LYS A 63 31.361 51.155 26.151 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.507 51.367 27.885 1.00 0.00 H new ATOM 0 HG2 LYS A 63 32.528 53.615 27.519 1.00 0.00 H new ATOM 0 HG3 LYS A 63 32.367 53.403 25.787 1.00 0.00 H new ATOM 0 HD2 LYS A 63 29.931 53.203 25.968 1.00 0.00 H new ATOM 0 HD3 LYS A 63 30.016 53.169 27.718 1.00 0.00 H new ATOM 0 HE2 LYS A 63 31.115 55.525 27.531 1.00 0.00 H new ATOM 0 HE3 LYS A 63 30.552 55.520 25.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 28.951 56.543 27.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 28.305 55.124 26.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 28.851 55.129 28.272 1.00 0.00 H new ATOM 1020 N GLU A 64 35.325 52.270 27.476 1.00 0.00 N ATOM 1021 CA GLU A 64 36.303 52.990 28.266 1.00 0.00 C ATOM 1022 C GLU A 64 37.079 52.150 29.283 1.00 0.00 C ATOM 1023 O GLU A 64 37.666 52.692 30.217 1.00 0.00 O ATOM 1024 CB GLU A 64 35.715 54.291 28.803 1.00 0.00 C ATOM 1025 CG GLU A 64 35.382 55.274 27.684 1.00 0.00 C ATOM 1026 CD GLU A 64 34.846 56.619 28.179 1.00 0.00 C ATOM 1027 OE1 GLU A 64 34.275 57.365 27.354 1.00 0.00 O ATOM 1028 OE2 GLU A 64 34.975 56.966 29.373 1.00 0.00 O ATOM 0 H GLU A 64 35.523 52.320 26.477 1.00 0.00 H new ATOM 0 HA GLU A 64 37.105 53.270 27.583 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.812 54.072 29.374 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.423 54.752 29.491 1.00 0.00 H new ATOM 0 HG2 GLU A 64 36.278 55.448 27.088 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.643 54.821 27.023 1.00 0.00 H new ATOM 1035 N SER A 65 37.150 50.837 29.082 1.00 0.00 N ATOM 1036 CA SER A 65 38.128 49.992 29.735 1.00 0.00 C ATOM 1037 C SER A 65 39.541 50.269 29.216 1.00 0.00 C ATOM 1038 O SER A 65 39.713 50.619 28.051 1.00 0.00 O ATOM 1039 CB SER A 65 37.836 48.511 29.515 1.00 0.00 C ATOM 1040 OG SER A 65 36.541 48.150 29.944 1.00 0.00 O ATOM 0 H SER A 65 36.523 50.332 28.456 1.00 0.00 H new ATOM 0 HA SER A 65 38.064 50.227 30.798 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.944 48.275 28.456 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.573 47.914 30.052 1.00 0.00 H new ATOM 0 HG SER A 65 35.934 48.136 29.175 1.00 0.00 H new ATOM 1046 N THR A 66 40.557 49.998 30.030 1.00 0.00 N ATOM 1047 CA THR A 66 41.953 50.011 29.640 1.00 0.00 C ATOM 1048 C THR A 66 42.509 48.592 29.512 1.00 0.00 C ATOM 1049 O THR A 66 42.253 47.729 30.348 1.00 0.00 O ATOM 1050 CB THR A 66 42.792 50.856 30.594 1.00 0.00 C ATOM 1051 OG1 THR A 66 42.253 52.157 30.677 1.00 0.00 O ATOM 1052 CG2 THR A 66 44.232 51.031 30.119 1.00 0.00 C ATOM 0 H THR A 66 40.421 49.756 31.011 1.00 0.00 H new ATOM 0 HA THR A 66 42.013 50.476 28.656 1.00 0.00 H new ATOM 0 HB THR A 66 42.780 50.330 31.549 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.793 52.696 31.292 1.00 0.00 H new ATOM 0 HG21 THR A 66 44.780 51.640 30.837 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.708 50.054 30.034 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.237 51.523 29.147 1.00 0.00 H new ATOM 1060 N LEU A 67 43.304 48.364 28.470 1.00 0.00 N ATOM 1061 CA LEU A 67 43.987 47.132 28.128 1.00 0.00 C ATOM 1062 C LEU A 67 45.492 47.315 28.332 1.00 0.00 C ATOM 1063 O LEU A 67 46.028 48.346 27.928 1.00 0.00 O ATOM 1064 CB LEU A 67 43.633 46.814 26.679 1.00 0.00 C ATOM 1065 CG LEU A 67 44.235 45.549 26.074 1.00 0.00 C ATOM 1066 CD1 LEU A 67 43.634 44.292 26.698 1.00 0.00 C ATOM 1067 CD2 LEU A 67 43.922 45.507 24.581 1.00 0.00 C ATOM 0 H LEU A 67 43.499 49.100 27.791 1.00 0.00 H new ATOM 0 HA LEU A 67 43.680 46.300 28.763 1.00 0.00 H new ATOM 0 HB2 LEU A 67 42.548 46.740 26.605 1.00 0.00 H new ATOM 0 HB3 LEU A 67 43.938 47.660 26.064 1.00 0.00 H new ATOM 0 HG LEU A 67 45.309 45.573 26.261 1.00 0.00 H new ATOM 0 HD11 LEU A 67 44.085 43.409 26.244 1.00 0.00 H new ATOM 0 HD12 LEU A 67 43.830 44.289 27.770 1.00 0.00 H new ATOM 0 HD13 LEU A 67 42.558 44.279 26.525 1.00 0.00 H new ATOM 0 HD21 LEU A 67 44.350 44.605 24.145 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.842 45.503 24.436 1.00 0.00 H new ATOM 0 HD23 LEU A 67 44.350 46.384 24.095 1.00 0.00 H new ATOM 1079 N HIS A 68 46.180 46.349 28.934 1.00 0.00 N ATOM 1080 CA HIS A 68 47.607 46.451 29.163 1.00 0.00 C ATOM 1081 C HIS A 68 48.417 45.924 27.977 1.00 0.00 C ATOM 1082 O HIS A 68 48.131 44.850 27.455 1.00 0.00 O ATOM 1083 CB HIS A 68 48.017 45.805 30.484 1.00 0.00 C ATOM 1084 CG HIS A 68 47.544 46.562 31.694 1.00 0.00 C ATOM 1085 ND1 HIS A 68 46.947 45.997 32.820 1.00 0.00 N ATOM 1086 CD2 HIS A 68 47.652 47.914 31.890 1.00 0.00 C ATOM 1087 CE1 HIS A 68 46.658 47.009 33.642 1.00 0.00 C ATOM 1088 NE2 HIS A 68 47.080 48.172 33.120 1.00 0.00 N ATOM 0 H HIS A 68 45.763 45.482 29.272 1.00 0.00 H new ATOM 0 HA HIS A 68 47.843 47.512 29.249 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.620 44.791 30.522 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.103 45.724 30.518 1.00 0.00 H new ATOM 0 HD2 HIS A 68 48.095 48.633 31.217 1.00 0.00 H new ATOM 0 HE1 HIS A 68 46.156 46.907 34.593 1.00 0.00 H new ATOM 0 HE2 HIS A 68 46.993 49.089 33.557 1.00 0.00 H new ATOM 1096 N LEU A 69 49.442 46.675 27.584 1.00 0.00 N ATOM 1097 CA LEU A 69 50.337 46.380 26.483 1.00 0.00 C ATOM 1098 C LEU A 69 51.761 46.158 26.992 1.00 0.00 C ATOM 1099 O LEU A 69 52.329 47.039 27.633 1.00 0.00 O ATOM 1100 CB LEU A 69 50.235 47.521 25.475 1.00 0.00 C ATOM 1101 CG LEU A 69 51.291 47.563 24.375 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.285 46.325 23.483 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.060 48.781 23.484 1.00 0.00 C ATOM 0 H LEU A 69 49.678 47.550 28.053 1.00 0.00 H new ATOM 0 HA LEU A 69 50.053 45.453 25.986 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.254 47.470 25.003 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.277 48.463 26.022 1.00 0.00 H new ATOM 0 HG LEU A 69 52.254 47.610 24.883 1.00 0.00 H new ATOM 0 HD11 LEU A 69 52.060 46.421 22.723 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.478 45.439 24.088 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.313 46.229 23.000 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.817 48.807 22.700 1.00 0.00 H new ATOM 0 HD22 LEU A 69 50.070 48.718 23.031 1.00 0.00 H new ATOM 0 HD23 LEU A 69 51.128 49.689 24.084 1.00 0.00 H new ATOM 1115 N VAL A 70 52.360 45.015 26.670 1.00 0.00 N ATOM 1116 CA VAL A 70 53.725 44.655 26.997 1.00 0.00 C ATOM 1117 C VAL A 70 54.457 44.217 25.727 1.00 0.00 C ATOM 1118 O VAL A 70 53.902 43.469 24.925 1.00 0.00 O ATOM 1119 CB VAL A 70 53.763 43.558 28.057 1.00 0.00 C ATOM 1120 CG1 VAL A 70 55.187 43.138 28.411 1.00 0.00 C ATOM 1121 CG2 VAL A 70 53.098 43.997 29.359 1.00 0.00 C ATOM 0 H VAL A 70 51.878 44.283 26.148 1.00 0.00 H new ATOM 0 HA VAL A 70 54.230 45.527 27.413 1.00 0.00 H new ATOM 0 HB VAL A 70 53.223 42.723 27.611 1.00 0.00 H new ATOM 0 HG11 VAL A 70 55.158 42.355 29.169 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.687 42.761 27.519 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.734 43.998 28.798 1.00 0.00 H new ATOM 0 HG21 VAL A 70 53.148 43.185 30.085 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.615 44.871 29.755 1.00 0.00 H new ATOM 0 HG23 VAL A 70 52.055 44.249 29.168 1.00 0.00 H new