USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=15 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 20 SER OG : rot 180:sc= 0.998 USER MOD Set 1.2: A 55 THR OG1 : rot -61:sc= 1.21 USER MOD Set 1.3: A 57 SER OG : rot -142:sc= 1.16 USER MOD Set 2.1: A 2 GLN : amide:sc= 0.58 K(o=2.1,f=0.64) USER MOD Set 2.2: A 14 THR OG1 : rot 21:sc= 1.57 USER MOD Single : A 1 MET CE :methyl 180:sc= -0.0138 (180deg=-0.0138) USER MOD Single : A 1 MET N :NH3+ -170:sc= 1.09 (180deg=1.01) USER MOD Single : A 6 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0143) USER MOD Single : A 11 LYS NZ :NH3+ -147:sc= 1.27 (180deg=0.656) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= 0.868 K(o=0.87,f=-0.33) USER MOD Single : A 27 LYS NZ :NH3+ -165:sc= 1.64 (180deg=0.863) USER MOD Single : A 29 LYS NZ :NH3+ -173:sc= 2.39 (180deg=2.23) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 33 LYS NZ :NH3+ 167:sc= 1.33 (180deg=1.13) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 GLN : amide:sc= 1.29 K(o=1.3,f=-2.1!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.911 K(o=0.91,f=0) USER MOD Single : A 59 TYR OH : rot 9:sc= 0.412 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 80:sc= 1.28 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.0445 X(o=-0.044,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 33.428 52.039 18.597 1.00 0.00 N ATOM 2 CA MET A 1 33.387 52.011 20.067 1.00 0.00 C ATOM 3 C MET A 1 34.787 52.271 20.626 1.00 0.00 C ATOM 4 O MET A 1 35.768 51.821 20.039 1.00 0.00 O ATOM 5 CB MET A 1 32.734 50.720 20.555 1.00 0.00 C ATOM 6 CG MET A 1 32.710 50.539 22.070 1.00 0.00 C ATOM 7 SD MET A 1 34.188 49.751 22.758 1.00 0.00 S ATOM 8 CE MET A 1 33.829 48.008 22.428 1.00 0.00 C ATOM 0 H1 MET A 1 32.458 52.032 18.222 1.00 0.00 H new ATOM 0 H2 MET A 1 33.916 52.901 18.280 1.00 0.00 H new ATOM 0 H3 MET A 1 33.940 51.204 18.248 1.00 0.00 H new ATOM 0 HA MET A 1 32.757 52.813 20.451 1.00 0.00 H new ATOM 0 HB2 MET A 1 31.709 50.687 20.184 1.00 0.00 H new ATOM 0 HB3 MET A 1 33.261 49.875 20.112 1.00 0.00 H new ATOM 0 HG2 MET A 1 32.584 51.516 22.538 1.00 0.00 H new ATOM 0 HG3 MET A 1 31.838 49.942 22.338 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.650 47.392 22.795 1.00 0.00 H new ATOM 0 HE2 MET A 1 32.907 47.724 22.935 1.00 0.00 H new ATOM 0 HE3 MET A 1 33.714 47.857 21.355 1.00 0.00 H new ATOM 20 N GLN A 2 34.906 53.013 21.723 1.00 0.00 N ATOM 21 CA GLN A 2 36.166 53.483 22.265 1.00 0.00 C ATOM 22 C GLN A 2 36.728 52.564 23.352 1.00 0.00 C ATOM 23 O GLN A 2 36.003 52.204 24.277 1.00 0.00 O ATOM 24 CB GLN A 2 35.940 54.894 22.796 1.00 0.00 C ATOM 25 CG GLN A 2 37.235 55.599 23.194 1.00 0.00 C ATOM 26 CD GLN A 2 37.026 56.979 23.822 1.00 0.00 C ATOM 27 OE1 GLN A 2 35.925 57.412 24.154 1.00 0.00 O ATOM 28 NE2 GLN A 2 38.113 57.714 24.035 1.00 0.00 N ATOM 0 H GLN A 2 34.100 53.310 22.273 1.00 0.00 H new ATOM 0 HA GLN A 2 36.916 53.482 21.474 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.431 55.485 22.035 1.00 0.00 H new ATOM 0 HB3 GLN A 2 35.278 54.849 23.660 1.00 0.00 H new ATOM 0 HG2 GLN A 2 37.778 54.969 23.899 1.00 0.00 H new ATOM 0 HG3 GLN A 2 37.865 55.705 22.311 1.00 0.00 H new ATOM 0 HE21 GLN A 2 39.030 57.360 23.762 1.00 0.00 H new ATOM 0 HE22 GLN A 2 38.030 58.632 24.472 1.00 0.00 H new ATOM 37 N ILE A 3 38.023 52.265 23.320 1.00 0.00 N ATOM 38 CA ILE A 3 38.768 51.652 24.401 1.00 0.00 C ATOM 39 C ILE A 3 40.081 52.385 24.684 1.00 0.00 C ATOM 40 O ILE A 3 40.438 53.324 23.976 1.00 0.00 O ATOM 41 CB ILE A 3 38.961 50.154 24.190 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.742 49.749 22.942 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.617 49.432 24.199 1.00 0.00 C ATOM 44 CD1 ILE A 3 41.259 49.848 23.084 1.00 0.00 C ATOM 0 H ILE A 3 38.602 52.454 22.502 1.00 0.00 H new ATOM 0 HA ILE A 3 38.162 51.755 25.301 1.00 0.00 H new ATOM 0 HB ILE A 3 39.582 49.849 25.032 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.480 48.723 22.682 1.00 0.00 H new ATOM 0 HG13 ILE A 3 39.426 50.379 22.111 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.776 48.364 24.047 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.124 49.592 25.158 1.00 0.00 H new ATOM 0 HG23 ILE A 3 36.989 49.823 23.399 1.00 0.00 H new ATOM 0 HD11 ILE A 3 41.733 49.542 22.151 1.00 0.00 H new ATOM 0 HD12 ILE A 3 41.537 50.877 23.311 1.00 0.00 H new ATOM 0 HD13 ILE A 3 41.592 49.196 23.891 1.00 0.00 H new ATOM 56 N PHE A 4 40.817 51.960 25.706 1.00 0.00 N ATOM 57 CA PHE A 4 42.107 52.505 26.081 1.00 0.00 C ATOM 58 C PHE A 4 43.173 51.424 26.262 1.00 0.00 C ATOM 59 O PHE A 4 42.854 50.280 26.580 1.00 0.00 O ATOM 60 CB PHE A 4 41.962 53.346 27.346 1.00 0.00 C ATOM 61 CG PHE A 4 41.035 54.531 27.210 1.00 0.00 C ATOM 62 CD1 PHE A 4 39.670 54.383 27.485 1.00 0.00 C ATOM 63 CD2 PHE A 4 41.534 55.771 26.797 1.00 0.00 C ATOM 64 CE1 PHE A 4 38.807 55.477 27.350 1.00 0.00 C ATOM 65 CE2 PHE A 4 40.674 56.868 26.669 1.00 0.00 C ATOM 66 CZ PHE A 4 39.309 56.718 26.940 1.00 0.00 C ATOM 0 H PHE A 4 40.516 51.199 26.315 1.00 0.00 H new ATOM 0 HA PHE A 4 42.449 53.138 25.262 1.00 0.00 H new ATOM 0 HB2 PHE A 4 41.599 52.708 28.151 1.00 0.00 H new ATOM 0 HB3 PHE A 4 42.948 53.704 27.643 1.00 0.00 H new ATOM 0 HD1 PHE A 4 39.283 53.425 27.801 1.00 0.00 H new ATOM 0 HD2 PHE A 4 42.585 55.882 26.576 1.00 0.00 H new ATOM 0 HE1 PHE A 4 37.754 55.364 27.562 1.00 0.00 H new ATOM 0 HE2 PHE A 4 41.063 57.828 26.362 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.642 57.561 26.833 1.00 0.00 H new ATOM 76 N VAL A 5 44.442 51.778 26.080 1.00 0.00 N ATOM 77 CA VAL A 5 45.584 50.896 26.205 1.00 0.00 C ATOM 78 C VAL A 5 46.726 51.599 26.942 1.00 0.00 C ATOM 79 O VAL A 5 47.086 52.711 26.565 1.00 0.00 O ATOM 80 CB VAL A 5 46.062 50.403 24.842 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.129 49.322 24.992 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.947 49.807 23.989 1.00 0.00 C ATOM 0 H VAL A 5 44.707 52.731 25.831 1.00 0.00 H new ATOM 0 HA VAL A 5 45.269 50.028 26.784 1.00 0.00 H new ATOM 0 HB VAL A 5 46.457 51.291 24.348 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.451 48.989 24.005 1.00 0.00 H new ATOM 0 HG12 VAL A 5 47.983 49.727 25.535 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.716 48.477 25.543 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.356 49.477 23.034 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.507 48.956 24.509 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.180 50.562 23.814 1.00 0.00 H new ATOM 92 N LYS A 6 47.317 50.956 27.945 1.00 0.00 N ATOM 93 CA LYS A 6 48.496 51.392 28.665 1.00 0.00 C ATOM 94 C LYS A 6 49.747 50.605 28.267 1.00 0.00 C ATOM 95 O LYS A 6 49.667 49.409 27.993 1.00 0.00 O ATOM 96 CB LYS A 6 48.244 51.341 30.169 1.00 0.00 C ATOM 97 CG LYS A 6 49.446 51.872 30.946 1.00 0.00 C ATOM 98 CD LYS A 6 49.265 51.966 32.458 1.00 0.00 C ATOM 99 CE LYS A 6 50.425 52.739 33.080 1.00 0.00 C ATOM 100 NZ LYS A 6 51.742 52.117 32.874 1.00 0.00 N ATOM 0 H LYS A 6 46.960 50.066 28.292 1.00 0.00 H new ATOM 0 HA LYS A 6 48.693 52.427 28.386 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.360 51.930 30.413 1.00 0.00 H new ATOM 0 HB3 LYS A 6 48.036 50.315 30.471 1.00 0.00 H new ATOM 0 HG2 LYS A 6 50.302 51.229 30.740 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.693 52.863 30.565 1.00 0.00 H new ATOM 0 HD2 LYS A 6 48.322 52.462 32.689 1.00 0.00 H new ATOM 0 HD3 LYS A 6 49.212 50.966 32.888 1.00 0.00 H new ATOM 0 HE2 LYS A 6 50.442 53.746 32.663 1.00 0.00 H new ATOM 0 HE3 LYS A 6 50.247 52.841 34.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 52.469 52.673 33.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 51.731 51.148 33.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 51.958 52.090 31.857 1.00 0.00 H new ATOM 168 N LYS A 11 53.014 55.487 28.846 1.00 0.00 N ATOM 169 CA LYS A 11 52.091 55.984 27.845 1.00 0.00 C ATOM 170 C LYS A 11 50.714 55.338 28.017 1.00 0.00 C ATOM 171 O LYS A 11 50.622 54.144 28.292 1.00 0.00 O ATOM 172 CB LYS A 11 52.674 55.744 26.455 1.00 0.00 C ATOM 173 CG LYS A 11 52.048 56.649 25.397 1.00 0.00 C ATOM 174 CD LYS A 11 52.472 56.304 23.973 1.00 0.00 C ATOM 175 CE LYS A 11 53.981 56.337 23.748 1.00 0.00 C ATOM 176 NZ LYS A 11 54.296 56.217 22.317 1.00 0.00 N ATOM 0 HA LYS A 11 51.952 57.058 27.970 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.751 55.912 26.482 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.521 54.702 26.175 1.00 0.00 H new ATOM 0 HG2 LYS A 11 50.962 56.583 25.470 1.00 0.00 H new ATOM 0 HG3 LYS A 11 52.320 57.683 25.608 1.00 0.00 H new ATOM 0 HD2 LYS A 11 52.100 55.310 23.725 1.00 0.00 H new ATOM 0 HD3 LYS A 11 51.997 57.003 23.284 1.00 0.00 H new ATOM 0 HE2 LYS A 11 54.392 57.268 24.139 1.00 0.00 H new ATOM 0 HE3 LYS A 11 54.454 55.524 24.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 55.192 55.702 22.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.533 55.699 21.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 54.386 57.166 21.901 1.00 0.00 H new ATOM 190 N THR A 12 49.652 56.110 27.801 1.00 0.00 N ATOM 191 CA THR A 12 48.300 55.616 27.639 1.00 0.00 C ATOM 192 C THR A 12 47.684 56.237 26.383 1.00 0.00 C ATOM 193 O THR A 12 47.867 57.427 26.140 1.00 0.00 O ATOM 194 CB THR A 12 47.453 55.869 28.883 1.00 0.00 C ATOM 195 OG1 THR A 12 47.979 55.165 29.985 1.00 0.00 O ATOM 196 CG2 THR A 12 46.016 55.374 28.752 1.00 0.00 C ATOM 0 H THR A 12 49.717 57.126 27.733 1.00 0.00 H new ATOM 0 HA THR A 12 48.329 54.534 27.513 1.00 0.00 H new ATOM 0 HB THR A 12 47.468 56.951 29.013 1.00 0.00 H new ATOM 0 HG1 THR A 12 47.428 55.337 30.777 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.473 55.587 29.673 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.531 55.882 27.919 1.00 0.00 H new ATOM 0 HG23 THR A 12 46.016 54.299 28.571 1.00 0.00 H new ATOM 204 N ILE A 13 46.981 55.443 25.580 1.00 0.00 N ATOM 205 CA ILE A 13 46.383 55.822 24.315 1.00 0.00 C ATOM 206 C ILE A 13 44.939 55.329 24.210 1.00 0.00 C ATOM 207 O ILE A 13 44.574 54.362 24.876 1.00 0.00 O ATOM 208 CB ILE A 13 47.218 55.350 23.128 1.00 0.00 C ATOM 209 CG1 ILE A 13 47.363 53.832 23.065 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.570 56.058 23.113 1.00 0.00 C ATOM 211 CD1 ILE A 13 48.136 53.312 21.857 1.00 0.00 C ATOM 0 H ILE A 13 46.807 54.465 25.813 1.00 0.00 H new ATOM 0 HA ILE A 13 46.364 56.911 24.283 1.00 0.00 H new ATOM 0 HB ILE A 13 46.678 55.626 22.223 1.00 0.00 H new ATOM 0 HG12 ILE A 13 47.862 53.491 23.972 1.00 0.00 H new ATOM 0 HG13 ILE A 13 46.368 53.386 23.061 1.00 0.00 H new ATOM 0 HG21 ILE A 13 49.153 55.710 22.260 1.00 0.00 H new ATOM 0 HG22 ILE A 13 48.416 57.134 23.033 1.00 0.00 H new ATOM 0 HG23 ILE A 13 49.107 55.836 24.035 1.00 0.00 H new ATOM 0 HD11 ILE A 13 48.187 52.224 21.899 1.00 0.00 H new ATOM 0 HD12 ILE A 13 47.629 53.617 20.942 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.145 53.723 21.866 1.00 0.00 H new ATOM 223 N THR A 14 44.130 55.945 23.353 1.00 0.00 N ATOM 224 CA THR A 14 42.792 55.494 23.025 1.00 0.00 C ATOM 225 C THR A 14 42.732 54.865 21.632 1.00 0.00 C ATOM 226 O THR A 14 43.513 55.231 20.756 1.00 0.00 O ATOM 227 CB THR A 14 41.762 56.597 23.251 1.00 0.00 C ATOM 228 OG1 THR A 14 40.462 56.060 23.331 1.00 0.00 O ATOM 229 CG2 THR A 14 41.711 57.685 22.182 1.00 0.00 C ATOM 0 H THR A 14 44.400 56.794 22.857 1.00 0.00 H new ATOM 0 HA THR A 14 42.524 54.694 23.714 1.00 0.00 H new ATOM 0 HB THR A 14 42.093 57.057 24.182 1.00 0.00 H new ATOM 0 HG1 THR A 14 40.515 55.108 23.556 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.946 58.416 22.443 1.00 0.00 H new ATOM 0 HG22 THR A 14 42.680 58.181 22.121 1.00 0.00 H new ATOM 0 HG23 THR A 14 41.471 57.237 21.218 1.00 0.00 H new ATOM 237 N LEU A 15 41.847 53.893 21.432 1.00 0.00 N ATOM 238 CA LEU A 15 41.712 53.146 20.198 1.00 0.00 C ATOM 239 C LEU A 15 40.243 52.948 19.818 1.00 0.00 C ATOM 240 O LEU A 15 39.391 52.823 20.694 1.00 0.00 O ATOM 241 CB LEU A 15 42.407 51.796 20.349 1.00 0.00 C ATOM 242 CG LEU A 15 43.149 51.328 19.100 1.00 0.00 C ATOM 243 CD1 LEU A 15 44.515 52.001 19.000 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.367 49.819 19.147 1.00 0.00 C ATOM 0 H LEU A 15 41.186 53.599 22.151 1.00 0.00 H new ATOM 0 HA LEU A 15 42.182 53.715 19.396 1.00 0.00 H new ATOM 0 HB2 LEU A 15 43.114 51.855 21.177 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.663 51.046 20.618 1.00 0.00 H new ATOM 0 HG LEU A 15 42.540 51.594 18.236 1.00 0.00 H new ATOM 0 HD11 LEU A 15 45.027 51.653 18.103 1.00 0.00 H new ATOM 0 HD12 LEU A 15 44.385 53.082 18.948 1.00 0.00 H new ATOM 0 HD13 LEU A 15 45.110 51.749 19.878 1.00 0.00 H new ATOM 0 HD21 LEU A 15 43.897 49.500 18.250 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.957 49.564 20.027 1.00 0.00 H new ATOM 0 HD23 LEU A 15 42.403 49.313 19.198 1.00 0.00 H new ATOM 256 N GLU A 16 39.966 52.846 18.520 1.00 0.00 N ATOM 257 CA GLU A 16 38.655 52.517 17.998 1.00 0.00 C ATOM 258 C GLU A 16 38.534 51.027 17.674 1.00 0.00 C ATOM 259 O GLU A 16 39.344 50.450 16.953 1.00 0.00 O ATOM 260 CB GLU A 16 38.313 53.386 16.791 1.00 0.00 C ATOM 261 CG GLU A 16 38.262 54.870 17.143 1.00 0.00 C ATOM 262 CD GLU A 16 37.802 55.711 15.949 1.00 0.00 C ATOM 263 OE1 GLU A 16 38.655 56.281 15.236 1.00 0.00 O ATOM 264 OE2 GLU A 16 36.577 55.827 15.726 1.00 0.00 O ATOM 0 H GLU A 16 40.665 52.994 17.792 1.00 0.00 H new ATOM 0 HA GLU A 16 37.925 52.733 18.778 1.00 0.00 H new ATOM 0 HB2 GLU A 16 39.055 53.226 16.009 1.00 0.00 H new ATOM 0 HB3 GLU A 16 37.350 53.078 16.385 1.00 0.00 H new ATOM 0 HG2 GLU A 16 37.583 55.024 17.982 1.00 0.00 H new ATOM 0 HG3 GLU A 16 39.248 55.203 17.466 1.00 0.00 H new ATOM 271 N VAL A 17 37.506 50.386 18.222 1.00 0.00 N ATOM 272 CA VAL A 17 37.201 48.975 18.087 1.00 0.00 C ATOM 273 C VAL A 17 35.693 48.772 17.918 1.00 0.00 C ATOM 274 O VAL A 17 34.892 49.648 18.238 1.00 0.00 O ATOM 275 CB VAL A 17 37.723 48.171 19.273 1.00 0.00 C ATOM 276 CG1 VAL A 17 39.240 48.256 19.414 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.094 48.578 20.602 1.00 0.00 C ATOM 0 H VAL A 17 36.826 50.872 18.806 1.00 0.00 H new ATOM 0 HA VAL A 17 37.708 48.607 17.195 1.00 0.00 H new ATOM 0 HB VAL A 17 37.434 47.144 19.049 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.559 47.666 20.273 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.712 47.867 18.512 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.534 49.296 19.558 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.509 47.967 21.403 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.307 49.629 20.799 1.00 0.00 H new ATOM 0 HG23 VAL A 17 36.015 48.429 20.555 1.00 0.00 H new ATOM 287 N GLU A 18 35.292 47.592 17.454 1.00 0.00 N ATOM 288 CA GLU A 18 33.922 47.128 17.542 1.00 0.00 C ATOM 289 C GLU A 18 33.735 46.233 18.769 1.00 0.00 C ATOM 290 O GLU A 18 34.676 45.533 19.138 1.00 0.00 O ATOM 291 CB GLU A 18 33.509 46.403 16.265 1.00 0.00 C ATOM 292 CG GLU A 18 33.697 47.214 14.987 1.00 0.00 C ATOM 293 CD GLU A 18 33.003 48.577 15.024 1.00 0.00 C ATOM 294 OE1 GLU A 18 31.848 48.658 15.494 1.00 0.00 O ATOM 295 OE2 GLU A 18 33.602 49.573 14.562 1.00 0.00 O ATOM 0 H GLU A 18 35.921 46.928 17.002 1.00 0.00 H new ATOM 0 HA GLU A 18 33.273 47.997 17.655 1.00 0.00 H new ATOM 0 HB2 GLU A 18 34.085 45.481 16.183 1.00 0.00 H new ATOM 0 HB3 GLU A 18 32.460 46.117 16.348 1.00 0.00 H new ATOM 0 HG2 GLU A 18 34.763 47.362 14.813 1.00 0.00 H new ATOM 0 HG3 GLU A 18 33.313 46.642 14.143 1.00 0.00 H new ATOM 302 N PRO A 19 32.566 46.186 19.401 1.00 0.00 N ATOM 303 CA PRO A 19 32.309 45.296 20.516 1.00 0.00 C ATOM 304 C PRO A 19 32.605 43.818 20.257 1.00 0.00 C ATOM 305 O PRO A 19 32.993 43.119 21.191 1.00 0.00 O ATOM 306 CB PRO A 19 30.844 45.522 20.880 1.00 0.00 C ATOM 307 CG PRO A 19 30.601 46.973 20.474 1.00 0.00 C ATOM 308 CD PRO A 19 31.454 47.096 19.215 1.00 0.00 C ATOM 0 HA PRO A 19 32.994 45.534 21.330 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.186 44.839 20.343 1.00 0.00 H new ATOM 0 HB3 PRO A 19 30.665 45.367 21.944 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.548 47.170 20.274 1.00 0.00 H new ATOM 0 HG3 PRO A 19 30.915 47.672 21.249 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.879 46.835 18.326 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.805 48.119 19.079 1.00 0.00 H new ATOM 316 N SER A 20 32.502 43.362 19.012 1.00 0.00 N ATOM 317 CA SER A 20 32.908 42.054 18.541 1.00 0.00 C ATOM 318 C SER A 20 34.068 42.095 17.545 1.00 0.00 C ATOM 319 O SER A 20 34.092 41.334 16.582 1.00 0.00 O ATOM 320 CB SER A 20 31.706 41.291 17.992 1.00 0.00 C ATOM 321 OG SER A 20 30.715 41.139 18.985 1.00 0.00 O ATOM 0 H SER A 20 32.109 43.935 18.265 1.00 0.00 H new ATOM 0 HA SER A 20 33.297 41.513 19.404 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.291 41.823 17.136 1.00 0.00 H new ATOM 0 HB3 SER A 20 32.023 40.311 17.635 1.00 0.00 H new ATOM 0 HG SER A 20 29.952 40.649 18.613 1.00 0.00 H new ATOM 327 N ASP A 21 35.034 42.994 17.724 1.00 0.00 N ATOM 328 CA ASP A 21 36.267 43.006 16.965 1.00 0.00 C ATOM 329 C ASP A 21 37.260 41.956 17.468 1.00 0.00 C ATOM 330 O ASP A 21 37.288 41.642 18.655 1.00 0.00 O ATOM 331 CB ASP A 21 36.897 44.396 16.977 1.00 0.00 C ATOM 332 CG ASP A 21 37.854 44.669 15.815 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.823 43.940 14.801 1.00 0.00 O ATOM 334 OD2 ASP A 21 38.563 45.697 15.876 1.00 0.00 O ATOM 0 H ASP A 21 34.974 43.743 18.413 1.00 0.00 H new ATOM 0 HA ASP A 21 36.016 42.747 15.936 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.102 45.142 16.959 1.00 0.00 H new ATOM 0 HB3 ASP A 21 37.437 44.528 17.915 1.00 0.00 H new ATOM 339 N THR A 22 38.080 41.409 16.576 1.00 0.00 N ATOM 340 CA THR A 22 39.053 40.373 16.863 1.00 0.00 C ATOM 341 C THR A 22 40.312 40.979 17.485 1.00 0.00 C ATOM 342 O THR A 22 40.748 42.044 17.055 1.00 0.00 O ATOM 343 CB THR A 22 39.388 39.582 15.602 1.00 0.00 C ATOM 344 OG1 THR A 22 38.220 39.013 15.055 1.00 0.00 O ATOM 345 CG2 THR A 22 40.333 38.405 15.831 1.00 0.00 C ATOM 0 H THR A 22 38.081 41.690 15.596 1.00 0.00 H new ATOM 0 HA THR A 22 38.619 39.681 17.585 1.00 0.00 H new ATOM 0 HB THR A 22 39.865 40.312 14.948 1.00 0.00 H new ATOM 0 HG1 THR A 22 38.449 38.510 14.246 1.00 0.00 H new ATOM 0 HG21 THR A 22 40.518 37.898 14.884 1.00 0.00 H new ATOM 0 HG22 THR A 22 41.276 38.769 16.238 1.00 0.00 H new ATOM 0 HG23 THR A 22 39.880 37.706 16.534 1.00 0.00 H new ATOM 353 N ILE A 23 40.946 40.310 18.445 1.00 0.00 N ATOM 354 CA ILE A 23 42.099 40.839 19.144 1.00 0.00 C ATOM 355 C ILE A 23 43.267 41.138 18.202 1.00 0.00 C ATOM 356 O ILE A 23 43.906 42.178 18.353 1.00 0.00 O ATOM 357 CB ILE A 23 42.481 39.913 20.296 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.412 39.832 21.383 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.817 40.284 20.933 1.00 0.00 C ATOM 360 CD1 ILE A 23 40.944 41.146 22.001 1.00 0.00 C ATOM 0 H ILE A 23 40.667 39.380 18.757 1.00 0.00 H new ATOM 0 HA ILE A 23 41.828 41.805 19.571 1.00 0.00 H new ATOM 0 HB ILE A 23 42.573 38.930 19.834 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.542 39.327 20.964 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.793 39.199 22.184 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.037 39.592 21.746 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.606 40.226 20.183 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.763 41.299 21.326 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.185 40.943 22.757 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.791 41.652 22.464 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.521 41.783 21.224 1.00 0.00 H new ATOM 372 N GLU A 24 43.499 40.333 17.169 1.00 0.00 N ATOM 373 CA GLU A 24 44.462 40.635 16.129 1.00 0.00 C ATOM 374 C GLU A 24 44.196 41.969 15.429 1.00 0.00 C ATOM 375 O GLU A 24 45.139 42.694 15.122 1.00 0.00 O ATOM 376 CB GLU A 24 44.494 39.471 15.144 1.00 0.00 C ATOM 377 CG GLU A 24 45.619 39.576 14.119 1.00 0.00 C ATOM 378 CD GLU A 24 45.603 38.388 13.154 1.00 0.00 C ATOM 379 OE1 GLU A 24 45.426 38.600 11.935 1.00 0.00 O ATOM 380 OE2 GLU A 24 45.812 37.234 13.583 1.00 0.00 O ATOM 0 H GLU A 24 43.016 39.445 17.034 1.00 0.00 H new ATOM 0 HA GLU A 24 45.442 40.754 16.591 1.00 0.00 H new ATOM 0 HB2 GLU A 24 44.603 38.539 15.698 1.00 0.00 H new ATOM 0 HB3 GLU A 24 43.539 39.421 14.621 1.00 0.00 H new ATOM 0 HG2 GLU A 24 45.517 40.505 13.558 1.00 0.00 H new ATOM 0 HG3 GLU A 24 46.579 39.617 14.633 1.00 0.00 H new ATOM 387 N ASN A 25 42.938 42.358 15.244 1.00 0.00 N ATOM 388 CA ASN A 25 42.567 43.621 14.637 1.00 0.00 C ATOM 389 C ASN A 25 42.820 44.809 15.568 1.00 0.00 C ATOM 390 O ASN A 25 43.225 45.875 15.109 1.00 0.00 O ATOM 391 CB ASN A 25 41.100 43.603 14.216 1.00 0.00 C ATOM 392 CG ASN A 25 40.709 42.481 13.252 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.537 41.803 12.647 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.410 42.244 13.095 1.00 0.00 N ATOM 0 H ASN A 25 42.137 41.790 15.519 1.00 0.00 H new ATOM 0 HA ASN A 25 43.199 43.746 13.758 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.483 43.522 15.111 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.861 44.559 13.750 1.00 0.00 H new ATOM 0 HD21 ASN A 25 39.099 41.499 12.472 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.724 42.807 13.598 1.00 0.00 H new ATOM 401 N VAL A 26 42.649 44.631 16.874 1.00 0.00 N ATOM 402 CA VAL A 26 43.012 45.620 17.870 1.00 0.00 C ATOM 403 C VAL A 26 44.524 45.849 17.839 1.00 0.00 C ATOM 404 O VAL A 26 44.974 46.986 17.715 1.00 0.00 O ATOM 405 CB VAL A 26 42.560 45.213 19.269 1.00 0.00 C ATOM 406 CG1 VAL A 26 42.783 46.343 20.269 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.080 44.842 19.333 1.00 0.00 C ATOM 0 H VAL A 26 42.248 43.781 17.271 1.00 0.00 H new ATOM 0 HA VAL A 26 42.498 46.550 17.626 1.00 0.00 H new ATOM 0 HB VAL A 26 43.162 44.339 19.520 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.452 46.025 21.257 1.00 0.00 H new ATOM 0 HG12 VAL A 26 43.843 46.593 20.305 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.213 47.220 19.960 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.819 44.562 20.353 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.477 45.697 19.026 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.886 44.003 18.665 1.00 0.00 H new ATOM 417 N LYS A 27 45.309 44.775 17.852 1.00 0.00 N ATOM 418 CA LYS A 27 46.755 44.812 17.766 1.00 0.00 C ATOM 419 C LYS A 27 47.247 45.421 16.451 1.00 0.00 C ATOM 420 O LYS A 27 48.209 46.187 16.447 1.00 0.00 O ATOM 421 CB LYS A 27 47.297 43.397 17.950 1.00 0.00 C ATOM 422 CG LYS A 27 47.011 42.824 19.334 1.00 0.00 C ATOM 423 CD LYS A 27 47.319 41.332 19.413 1.00 0.00 C ATOM 424 CE LYS A 27 48.825 41.097 19.364 1.00 0.00 C ATOM 425 NZ LYS A 27 49.173 39.686 19.137 1.00 0.00 N ATOM 0 H LYS A 27 44.938 43.828 17.925 1.00 0.00 H new ATOM 0 HA LYS A 27 47.130 45.459 18.559 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.858 42.745 17.195 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.374 43.401 17.780 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.606 43.356 20.076 1.00 0.00 H new ATOM 0 HG3 LYS A 27 45.964 42.991 19.586 1.00 0.00 H new ATOM 0 HD2 LYS A 27 46.910 40.918 20.334 1.00 0.00 H new ATOM 0 HD3 LYS A 27 46.836 40.810 18.587 1.00 0.00 H new ATOM 0 HE2 LYS A 27 49.258 41.706 18.570 1.00 0.00 H new ATOM 0 HE3 LYS A 27 49.271 41.431 20.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 50.177 39.535 19.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.587 39.081 19.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.002 39.442 18.141 1.00 0.00 H new ATOM 439 N ALA A 28 46.569 45.153 15.340 1.00 0.00 N ATOM 440 CA ALA A 28 46.869 45.773 14.065 1.00 0.00 C ATOM 441 C ALA A 28 46.644 47.285 14.103 1.00 0.00 C ATOM 442 O ALA A 28 47.493 48.039 13.633 1.00 0.00 O ATOM 443 CB ALA A 28 46.033 45.095 12.982 1.00 0.00 C ATOM 0 H ALA A 28 45.791 44.494 15.304 1.00 0.00 H new ATOM 0 HA ALA A 28 47.926 45.636 13.836 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.249 45.552 12.016 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.278 44.034 12.944 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.974 45.215 13.211 1.00 0.00 H new ATOM 449 N LYS A 29 45.579 47.769 14.735 1.00 0.00 N ATOM 450 CA LYS A 29 45.330 49.184 14.914 1.00 0.00 C ATOM 451 C LYS A 29 46.303 49.864 15.879 1.00 0.00 C ATOM 452 O LYS A 29 46.578 51.051 15.719 1.00 0.00 O ATOM 453 CB LYS A 29 43.869 49.401 15.299 1.00 0.00 C ATOM 454 CG LYS A 29 42.990 49.311 14.055 1.00 0.00 C ATOM 455 CD LYS A 29 41.496 49.382 14.361 1.00 0.00 C ATOM 456 CE LYS A 29 40.998 48.068 14.957 1.00 0.00 C ATOM 457 NZ LYS A 29 39.566 48.157 15.285 1.00 0.00 N ATOM 0 H LYS A 29 44.857 47.174 15.141 1.00 0.00 H new ATOM 0 HA LYS A 29 45.518 49.675 13.959 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.560 48.653 16.029 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.748 50.376 15.771 1.00 0.00 H new ATOM 0 HG2 LYS A 29 43.253 50.121 13.374 1.00 0.00 H new ATOM 0 HG3 LYS A 29 43.203 48.377 13.536 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.302 50.198 15.057 1.00 0.00 H new ATOM 0 HD3 LYS A 29 40.944 49.604 13.448 1.00 0.00 H new ATOM 0 HE2 LYS A 29 41.165 47.256 14.250 1.00 0.00 H new ATOM 0 HE3 LYS A 29 41.568 47.831 15.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 39.273 47.300 15.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 39.398 48.991 15.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 39.014 48.243 14.408 1.00 0.00 H new ATOM 471 N ILE A 30 46.896 49.121 16.809 1.00 0.00 N ATOM 472 CA ILE A 30 47.999 49.570 17.634 1.00 0.00 C ATOM 473 C ILE A 30 49.282 49.763 16.822 1.00 0.00 C ATOM 474 O ILE A 30 50.054 50.656 17.164 1.00 0.00 O ATOM 475 CB ILE A 30 48.174 48.656 18.844 1.00 0.00 C ATOM 476 CG1 ILE A 30 46.991 48.816 19.794 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.478 48.889 19.601 1.00 0.00 C ATOM 478 CD1 ILE A 30 46.916 47.762 20.895 1.00 0.00 C ATOM 0 H ILE A 30 46.610 48.163 17.011 1.00 0.00 H new ATOM 0 HA ILE A 30 47.757 50.559 18.022 1.00 0.00 H new ATOM 0 HB ILE A 30 48.216 47.638 18.456 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.043 49.802 20.256 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.069 48.784 19.214 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.534 48.205 20.448 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.322 48.712 18.935 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.510 49.917 19.962 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.046 47.953 21.523 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.830 46.772 20.446 1.00 0.00 H new ATOM 0 HD13 ILE A 30 47.819 47.807 21.504 1.00 0.00 H new ATOM 490 N GLN A 31 49.508 49.046 15.725 1.00 0.00 N ATOM 491 CA GLN A 31 50.658 49.271 14.871 1.00 0.00 C ATOM 492 C GLN A 31 50.688 50.699 14.323 1.00 0.00 C ATOM 493 O GLN A 31 51.754 51.311 14.304 1.00 0.00 O ATOM 494 CB GLN A 31 50.712 48.255 13.734 1.00 0.00 C ATOM 495 CG GLN A 31 51.993 48.347 12.911 1.00 0.00 C ATOM 496 CD GLN A 31 52.069 47.346 11.757 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.152 46.578 11.475 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.180 47.321 11.025 1.00 0.00 N ATOM 0 H GLN A 31 48.896 48.294 15.408 1.00 0.00 H new ATOM 0 HA GLN A 31 51.545 49.136 15.489 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.624 47.250 14.148 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.854 48.406 13.079 1.00 0.00 H new ATOM 0 HG2 GLN A 31 52.081 49.356 12.508 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.847 48.191 13.570 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.950 47.952 11.246 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.261 46.671 10.243 1.00 0.00 H new ATOM 507 N ASP A 32 49.541 51.262 13.954 1.00 0.00 N ATOM 508 CA ASP A 32 49.447 52.615 13.445 1.00 0.00 C ATOM 509 C ASP A 32 49.944 53.649 14.457 1.00 0.00 C ATOM 510 O ASP A 32 50.651 54.581 14.084 1.00 0.00 O ATOM 511 CB ASP A 32 48.004 52.893 13.031 1.00 0.00 C ATOM 512 CG ASP A 32 47.878 54.129 12.137 1.00 0.00 C ATOM 513 OD1 ASP A 32 48.042 53.986 10.906 1.00 0.00 O ATOM 514 OD2 ASP A 32 47.609 55.239 12.647 1.00 0.00 O ATOM 0 H ASP A 32 48.643 50.780 14.003 1.00 0.00 H new ATOM 0 HA ASP A 32 50.098 52.704 12.575 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.607 52.025 12.504 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.393 53.030 13.923 1.00 0.00 H new ATOM 519 N LYS A 33 49.636 53.458 15.738 1.00 0.00 N ATOM 520 CA LYS A 33 49.996 54.366 16.808 1.00 0.00 C ATOM 521 C LYS A 33 51.381 54.117 17.410 1.00 0.00 C ATOM 522 O LYS A 33 52.071 55.089 17.711 1.00 0.00 O ATOM 523 CB LYS A 33 48.910 54.392 17.879 1.00 0.00 C ATOM 524 CG LYS A 33 47.603 54.986 17.361 1.00 0.00 C ATOM 525 CD LYS A 33 46.659 55.399 18.486 1.00 0.00 C ATOM 526 CE LYS A 33 45.412 56.071 17.914 1.00 0.00 C ATOM 527 NZ LYS A 33 44.740 56.906 18.921 1.00 0.00 N ATOM 0 H LYS A 33 49.115 52.643 16.062 1.00 0.00 H new ATOM 0 HA LYS A 33 50.067 55.353 16.352 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.730 53.378 18.236 1.00 0.00 H new ATOM 0 HB3 LYS A 33 49.258 54.973 18.733 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.824 55.854 16.740 1.00 0.00 H new ATOM 0 HG3 LYS A 33 47.104 54.256 16.723 1.00 0.00 H new ATOM 0 HD2 LYS A 33 46.373 54.524 19.069 1.00 0.00 H new ATOM 0 HD3 LYS A 33 47.169 56.082 19.165 1.00 0.00 H new ATOM 0 HE2 LYS A 33 45.689 56.685 17.057 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.721 55.310 17.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 44.037 57.514 18.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 44.264 56.296 19.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 45.444 57.499 19.406 1.00 0.00 H new ATOM 541 N GLU A 34 51.823 52.872 17.570 1.00 0.00 N ATOM 542 CA GLU A 34 53.036 52.513 18.275 1.00 0.00 C ATOM 543 C GLU A 34 54.176 51.976 17.408 1.00 0.00 C ATOM 544 O GLU A 34 55.291 51.838 17.907 1.00 0.00 O ATOM 545 CB GLU A 34 52.700 51.542 19.403 1.00 0.00 C ATOM 546 CG GLU A 34 52.013 52.200 20.596 1.00 0.00 C ATOM 547 CD GLU A 34 52.887 53.278 21.240 1.00 0.00 C ATOM 548 OE1 GLU A 34 54.042 52.997 21.629 1.00 0.00 O ATOM 549 OE2 GLU A 34 52.465 54.453 21.289 1.00 0.00 O ATOM 0 H GLU A 34 51.325 52.063 17.197 1.00 0.00 H new ATOM 0 HA GLU A 34 53.431 53.448 18.672 1.00 0.00 H new ATOM 0 HB2 GLU A 34 52.055 50.755 19.013 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.618 51.062 19.743 1.00 0.00 H new ATOM 0 HG2 GLU A 34 51.071 52.643 20.273 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.770 51.440 21.338 1.00 0.00 H new ATOM 556 N GLY A 35 53.945 51.697 16.128 1.00 0.00 N ATOM 557 CA GLY A 35 54.971 51.290 15.189 1.00 0.00 C ATOM 558 C GLY A 35 55.484 49.856 15.334 1.00 0.00 C ATOM 559 O GLY A 35 56.584 49.544 14.881 1.00 0.00 O ATOM 0 H GLY A 35 53.016 51.751 15.711 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.581 51.414 14.179 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.817 51.969 15.290 1.00 0.00 H new ATOM 563 N ILE A 36 54.722 48.979 15.981 1.00 0.00 N ATOM 564 CA ILE A 36 55.085 47.614 16.302 1.00 0.00 C ATOM 565 C ILE A 36 54.102 46.628 15.667 1.00 0.00 C ATOM 566 O ILE A 36 52.901 46.797 15.870 1.00 0.00 O ATOM 567 CB ILE A 36 55.228 47.427 17.811 1.00 0.00 C ATOM 568 CG1 ILE A 36 54.029 47.923 18.615 1.00 0.00 C ATOM 569 CG2 ILE A 36 56.516 48.106 18.266 1.00 0.00 C ATOM 570 CD1 ILE A 36 54.129 47.681 20.119 1.00 0.00 C ATOM 0 H ILE A 36 53.787 49.220 16.310 1.00 0.00 H new ATOM 0 HA ILE A 36 56.063 47.399 15.872 1.00 0.00 H new ATOM 0 HB ILE A 36 55.270 46.356 18.007 1.00 0.00 H new ATOM 0 HG12 ILE A 36 53.907 48.992 18.439 1.00 0.00 H new ATOM 0 HG13 ILE A 36 53.130 47.434 18.241 1.00 0.00 H new ATOM 0 HG21 ILE A 36 56.632 47.981 19.343 1.00 0.00 H new ATOM 0 HG22 ILE A 36 57.366 47.654 17.754 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.471 49.168 18.027 1.00 0.00 H new ATOM 0 HD11 ILE A 36 53.235 48.065 20.610 1.00 0.00 H new ATOM 0 HD12 ILE A 36 54.217 46.612 20.310 1.00 0.00 H new ATOM 0 HD13 ILE A 36 55.007 48.193 20.512 1.00 0.00 H new ATOM 582 N PRO A 37 54.532 45.620 14.915 1.00 0.00 N ATOM 583 CA PRO A 37 53.632 44.684 14.271 1.00 0.00 C ATOM 584 C PRO A 37 52.735 43.932 15.257 1.00 0.00 C ATOM 585 O PRO A 37 53.162 43.683 16.382 1.00 0.00 O ATOM 586 CB PRO A 37 54.517 43.710 13.500 1.00 0.00 C ATOM 587 CG PRO A 37 55.761 44.540 13.195 1.00 0.00 C ATOM 588 CD PRO A 37 55.888 45.373 14.467 1.00 0.00 C ATOM 0 HA PRO A 37 52.945 45.225 13.620 1.00 0.00 H new ATOM 0 HB2 PRO A 37 54.757 42.827 14.093 1.00 0.00 H new ATOM 0 HB3 PRO A 37 54.032 43.360 12.589 1.00 0.00 H new ATOM 0 HG2 PRO A 37 56.638 43.917 13.023 1.00 0.00 H new ATOM 0 HG3 PRO A 37 55.633 45.161 12.309 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.460 44.841 15.227 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.411 46.309 14.271 1.00 0.00 H new ATOM 596 N PRO A 38 51.533 43.507 14.878 1.00 0.00 N ATOM 597 CA PRO A 38 50.656 42.763 15.758 1.00 0.00 C ATOM 598 C PRO A 38 51.263 41.442 16.236 1.00 0.00 C ATOM 599 O PRO A 38 51.101 41.091 17.403 1.00 0.00 O ATOM 600 CB PRO A 38 49.348 42.567 14.998 1.00 0.00 C ATOM 601 CG PRO A 38 49.744 42.726 13.533 1.00 0.00 C ATOM 602 CD PRO A 38 50.911 43.706 13.583 1.00 0.00 C ATOM 0 HA PRO A 38 50.488 43.319 16.681 1.00 0.00 H new ATOM 0 HB2 PRO A 38 48.918 41.584 15.191 1.00 0.00 H new ATOM 0 HB3 PRO A 38 48.601 43.305 15.292 1.00 0.00 H new ATOM 0 HG2 PRO A 38 50.038 41.774 13.091 1.00 0.00 H new ATOM 0 HG3 PRO A 38 48.920 43.114 12.934 1.00 0.00 H new ATOM 0 HD2 PRO A 38 51.618 43.515 12.775 1.00 0.00 H new ATOM 0 HD3 PRO A 38 50.565 44.733 13.468 1.00 0.00 H new ATOM 610 N ASP A 39 52.059 40.763 15.415 1.00 0.00 N ATOM 611 CA ASP A 39 52.790 39.573 15.798 1.00 0.00 C ATOM 612 C ASP A 39 53.900 39.830 16.821 1.00 0.00 C ATOM 613 O ASP A 39 54.443 38.889 17.394 1.00 0.00 O ATOM 614 CB ASP A 39 53.340 38.873 14.559 1.00 0.00 C ATOM 615 CG ASP A 39 54.246 39.779 13.725 1.00 0.00 C ATOM 616 OD1 ASP A 39 53.689 40.591 12.955 1.00 0.00 O ATOM 617 OD2 ASP A 39 55.487 39.675 13.831 1.00 0.00 O ATOM 0 H ASP A 39 52.213 41.036 14.444 1.00 0.00 H new ATOM 0 HA ASP A 39 52.076 38.920 16.300 1.00 0.00 H new ATOM 0 HB2 ASP A 39 53.899 37.988 14.864 1.00 0.00 H new ATOM 0 HB3 ASP A 39 52.510 38.529 13.942 1.00 0.00 H new ATOM 622 N GLN A 40 54.255 41.085 17.082 1.00 0.00 N ATOM 623 CA GLN A 40 55.219 41.497 18.083 1.00 0.00 C ATOM 624 C GLN A 40 54.563 41.936 19.394 1.00 0.00 C ATOM 625 O GLN A 40 55.266 42.262 20.347 1.00 0.00 O ATOM 626 CB GLN A 40 56.114 42.565 17.463 1.00 0.00 C ATOM 627 CG GLN A 40 57.453 42.739 18.176 1.00 0.00 C ATOM 628 CD GLN A 40 58.366 43.683 17.391 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.489 44.866 17.702 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.013 43.203 16.333 1.00 0.00 N ATOM 0 H GLN A 40 53.856 41.875 16.574 1.00 0.00 H new ATOM 0 HA GLN A 40 55.833 40.645 18.374 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.299 42.309 16.420 1.00 0.00 H new ATOM 0 HB3 GLN A 40 55.584 43.517 17.468 1.00 0.00 H new ATOM 0 HG2 GLN A 40 57.288 43.135 19.178 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.938 41.769 18.292 1.00 0.00 H new ATOM 0 HE21 GLN A 40 58.911 42.221 16.075 1.00 0.00 H new ATOM 0 HE22 GLN A 40 59.611 43.816 15.780 1.00 0.00 H new ATOM 639 N GLN A 41 53.236 41.915 19.486 1.00 0.00 N ATOM 640 CA GLN A 41 52.457 42.378 20.616 1.00 0.00 C ATOM 641 C GLN A 41 51.738 41.236 21.338 1.00 0.00 C ATOM 642 O GLN A 41 51.435 40.209 20.735 1.00 0.00 O ATOM 643 CB GLN A 41 51.411 43.377 20.132 1.00 0.00 C ATOM 644 CG GLN A 41 51.881 44.678 19.488 1.00 0.00 C ATOM 645 CD GLN A 41 50.684 45.394 18.860 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.580 45.387 19.400 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.801 45.985 17.674 1.00 0.00 N ATOM 0 H GLN A 41 52.651 41.555 18.732 1.00 0.00 H new ATOM 0 HA GLN A 41 53.151 42.839 21.319 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.773 42.864 19.413 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.784 43.638 20.985 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.351 45.318 20.235 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.634 44.469 18.728 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.705 46.006 17.202 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.987 46.417 17.237 1.00 0.00 H new ATOM 656 N ARG A 42 51.342 41.464 22.587 1.00 0.00 N ATOM 657 CA ARG A 42 50.309 40.759 23.318 1.00 0.00 C ATOM 658 C ARG A 42 49.448 41.767 24.082 1.00 0.00 C ATOM 659 O ARG A 42 49.988 42.714 24.650 1.00 0.00 O ATOM 660 CB ARG A 42 50.927 39.785 24.318 1.00 0.00 C ATOM 661 CG ARG A 42 51.551 38.546 23.682 1.00 0.00 C ATOM 662 CD ARG A 42 52.338 37.767 24.733 1.00 0.00 C ATOM 663 NE ARG A 42 52.818 36.488 24.209 1.00 0.00 N ATOM 664 CZ ARG A 42 53.833 35.761 24.697 1.00 0.00 C ATOM 665 NH1 ARG A 42 54.625 36.172 25.697 1.00 0.00 N ATOM 666 NH2 ARG A 42 54.085 34.564 24.148 1.00 0.00 N ATOM 0 H ARG A 42 51.769 42.200 23.149 1.00 0.00 H new ATOM 0 HA ARG A 42 49.700 40.202 22.605 1.00 0.00 H new ATOM 0 HB2 ARG A 42 51.691 40.308 24.893 1.00 0.00 H new ATOM 0 HB3 ARG A 42 50.158 39.469 25.023 1.00 0.00 H new ATOM 0 HG2 ARG A 42 50.773 37.914 23.255 1.00 0.00 H new ATOM 0 HG3 ARG A 42 52.209 38.838 22.864 1.00 0.00 H new ATOM 0 HD2 ARG A 42 53.186 38.364 25.070 1.00 0.00 H new ATOM 0 HD3 ARG A 42 51.707 37.590 25.604 1.00 0.00 H new ATOM 0 HE ARG A 42 52.333 36.113 23.393 1.00 0.00 H new ATOM 0 HH11 ARG A 42 54.470 37.083 26.129 1.00 0.00 H new ATOM 0 HH12 ARG A 42 55.383 35.574 26.026 1.00 0.00 H new ATOM 0 HH21 ARG A 42 53.510 34.225 23.377 1.00 0.00 H new ATOM 0 HH22 ARG A 42 54.852 33.992 24.502 1.00 0.00 H new ATOM 680 N LEU A 43 48.138 41.545 24.133 1.00 0.00 N ATOM 681 CA LEU A 43 47.219 42.329 24.934 1.00 0.00 C ATOM 682 C LEU A 43 46.797 41.586 26.203 1.00 0.00 C ATOM 683 O LEU A 43 46.484 40.397 26.174 1.00 0.00 O ATOM 684 CB LEU A 43 46.022 42.781 24.103 1.00 0.00 C ATOM 685 CG LEU A 43 46.317 43.960 23.179 1.00 0.00 C ATOM 686 CD1 LEU A 43 45.127 44.195 22.253 1.00 0.00 C ATOM 687 CD2 LEU A 43 46.564 45.264 23.932 1.00 0.00 C ATOM 0 H LEU A 43 47.682 40.800 23.607 1.00 0.00 H new ATOM 0 HA LEU A 43 47.743 43.226 25.263 1.00 0.00 H new ATOM 0 HB2 LEU A 43 45.671 41.941 23.503 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.208 43.054 24.775 1.00 0.00 H new ATOM 0 HG LEU A 43 47.221 43.697 22.631 1.00 0.00 H new ATOM 0 HD11 LEU A 43 45.339 45.037 21.594 1.00 0.00 H new ATOM 0 HD12 LEU A 43 44.950 43.302 21.654 1.00 0.00 H new ATOM 0 HD13 LEU A 43 44.241 44.415 22.848 1.00 0.00 H new ATOM 0 HD21 LEU A 43 46.768 46.063 23.219 1.00 0.00 H new ATOM 0 HD22 LEU A 43 45.681 45.518 24.519 1.00 0.00 H new ATOM 0 HD23 LEU A 43 47.420 45.144 24.597 1.00 0.00 H new ATOM 699 N ILE A 44 46.791 42.318 27.313 1.00 0.00 N ATOM 700 CA ILE A 44 46.507 41.856 28.656 1.00 0.00 C ATOM 701 C ILE A 44 45.264 42.581 29.178 1.00 0.00 C ATOM 702 O ILE A 44 45.160 43.802 29.087 1.00 0.00 O ATOM 703 CB ILE A 44 47.706 42.086 29.572 1.00 0.00 C ATOM 704 CG1 ILE A 44 49.071 41.696 29.011 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.491 41.428 30.932 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.259 40.230 28.635 1.00 0.00 C ATOM 0 H ILE A 44 46.999 43.316 27.290 1.00 0.00 H new ATOM 0 HA ILE A 44 46.314 40.783 28.640 1.00 0.00 H new ATOM 0 HB ILE A 44 47.748 43.171 29.671 1.00 0.00 H new ATOM 0 HG12 ILE A 44 49.262 42.302 28.126 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.830 41.959 29.747 1.00 0.00 H new ATOM 0 HG21 ILE A 44 48.360 41.608 31.565 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.605 41.851 31.405 1.00 0.00 H new ATOM 0 HG23 ILE A 44 47.354 40.355 30.799 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.267 40.080 28.250 1.00 0.00 H new ATOM 0 HD12 ILE A 44 49.111 39.606 29.517 1.00 0.00 H new ATOM 0 HD13 ILE A 44 48.533 39.955 27.870 1.00 0.00 H new ATOM 718 N PHE A 45 44.316 41.835 29.736 1.00 0.00 N ATOM 719 CA PHE A 45 43.127 42.353 30.382 1.00 0.00 C ATOM 720 C PHE A 45 42.667 41.394 31.482 1.00 0.00 C ATOM 721 O PHE A 45 42.848 40.185 31.350 1.00 0.00 O ATOM 722 CB PHE A 45 42.018 42.556 29.353 1.00 0.00 C ATOM 723 CG PHE A 45 40.754 43.154 29.923 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.681 44.531 30.161 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.674 42.334 30.271 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.536 45.087 30.744 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.532 42.886 30.863 1.00 0.00 C ATOM 728 CZ PHE A 45 38.458 44.266 31.091 1.00 0.00 C ATOM 0 H PHE A 45 44.362 40.816 29.748 1.00 0.00 H new ATOM 0 HA PHE A 45 43.361 43.316 30.836 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.388 43.204 28.558 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.780 41.595 28.896 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.512 45.168 29.894 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.722 41.272 30.082 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.485 46.150 30.926 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.708 42.248 31.144 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.571 44.695 31.533 1.00 0.00 H new ATOM 738 N ALA A 46 42.076 41.907 32.558 1.00 0.00 N ATOM 739 CA ALA A 46 41.685 41.134 33.719 1.00 0.00 C ATOM 740 C ALA A 46 42.802 40.241 34.263 1.00 0.00 C ATOM 741 O ALA A 46 42.576 39.105 34.674 1.00 0.00 O ATOM 742 CB ALA A 46 40.365 40.422 33.432 1.00 0.00 C ATOM 0 H ALA A 46 41.853 42.899 32.642 1.00 0.00 H new ATOM 0 HA ALA A 46 41.507 41.813 34.553 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.069 39.840 34.304 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.594 41.160 33.210 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.488 39.757 32.577 1.00 0.00 H new ATOM 748 N GLY A 47 44.036 40.733 34.223 1.00 0.00 N ATOM 749 CA GLY A 47 45.218 40.040 34.697 1.00 0.00 C ATOM 750 C GLY A 47 45.690 38.851 33.859 1.00 0.00 C ATOM 751 O GLY A 47 46.616 38.163 34.285 1.00 0.00 O ATOM 0 H GLY A 47 44.242 41.658 33.846 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.034 40.760 34.759 1.00 0.00 H new ATOM 0 HA3 GLY A 47 45.025 39.689 35.711 1.00 0.00 H new ATOM 755 N LYS A 48 45.098 38.593 32.697 1.00 0.00 N ATOM 756 CA LYS A 48 45.404 37.485 31.814 1.00 0.00 C ATOM 757 C LYS A 48 45.720 37.942 30.388 1.00 0.00 C ATOM 758 O LYS A 48 45.250 38.988 29.946 1.00 0.00 O ATOM 759 CB LYS A 48 44.317 36.418 31.907 1.00 0.00 C ATOM 760 CG LYS A 48 42.862 36.840 31.725 1.00 0.00 C ATOM 761 CD LYS A 48 42.424 37.029 30.276 1.00 0.00 C ATOM 762 CE LYS A 48 41.038 37.657 30.159 1.00 0.00 C ATOM 763 NZ LYS A 48 39.950 36.795 30.643 1.00 0.00 N ATOM 0 H LYS A 48 44.353 39.186 32.331 1.00 0.00 H new ATOM 0 HA LYS A 48 46.328 37.016 32.151 1.00 0.00 H new ATOM 0 HB2 LYS A 48 44.537 35.656 31.159 1.00 0.00 H new ATOM 0 HB3 LYS A 48 44.404 35.941 32.883 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.221 36.090 32.188 1.00 0.00 H new ATOM 0 HG3 LYS A 48 42.700 37.774 32.263 1.00 0.00 H new ATOM 0 HD2 LYS A 48 43.149 37.659 29.760 1.00 0.00 H new ATOM 0 HD3 LYS A 48 42.425 36.063 29.771 1.00 0.00 H new ATOM 0 HE2 LYS A 48 41.025 38.591 30.720 1.00 0.00 H new ATOM 0 HE3 LYS A 48 40.851 37.909 29.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 39.041 37.288 30.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 39.935 35.913 30.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 40.103 36.574 31.648 1.00 0.00 H new ATOM 777 N GLN A 49 46.510 37.162 29.656 1.00 0.00 N ATOM 778 CA GLN A 49 46.756 37.400 28.249 1.00 0.00 C ATOM 779 C GLN A 49 45.530 37.004 27.424 1.00 0.00 C ATOM 780 O GLN A 49 44.925 35.961 27.665 1.00 0.00 O ATOM 781 CB GLN A 49 47.999 36.650 27.779 1.00 0.00 C ATOM 782 CG GLN A 49 48.554 37.168 26.455 1.00 0.00 C ATOM 783 CD GLN A 49 49.006 36.037 25.529 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.042 35.407 25.731 1.00 0.00 O ATOM 785 NE2 GLN A 49 48.244 35.719 24.487 1.00 0.00 N ATOM 0 H GLN A 49 46.996 36.346 30.029 1.00 0.00 H new ATOM 0 HA GLN A 49 46.938 38.465 28.104 1.00 0.00 H new ATOM 0 HB2 GLN A 49 48.772 36.727 28.544 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.758 35.592 27.675 1.00 0.00 H new ATOM 0 HG2 GLN A 49 47.791 37.762 25.952 1.00 0.00 H new ATOM 0 HG3 GLN A 49 49.396 37.831 26.652 1.00 0.00 H new ATOM 0 HE21 GLN A 49 47.382 36.235 24.309 1.00 0.00 H new ATOM 0 HE22 GLN A 49 48.521 34.959 23.865 1.00 0.00 H new ATOM 794 N LEU A 50 45.187 37.811 26.424 1.00 0.00 N ATOM 795 CA LEU A 50 44.141 37.513 25.467 1.00 0.00 C ATOM 796 C LEU A 50 44.696 36.685 24.306 1.00 0.00 C ATOM 797 O LEU A 50 45.759 36.999 23.775 1.00 0.00 O ATOM 798 CB LEU A 50 43.496 38.810 24.988 1.00 0.00 C ATOM 799 CG LEU A 50 42.958 39.722 26.087 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.304 40.954 25.467 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.909 39.035 26.959 1.00 0.00 C ATOM 0 H LEU A 50 45.642 38.709 26.258 1.00 0.00 H new ATOM 0 HA LEU A 50 43.369 36.913 25.948 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.230 39.367 24.405 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.677 38.560 24.314 1.00 0.00 H new ATOM 0 HG LEU A 50 43.812 39.991 26.709 1.00 0.00 H new ATOM 0 HD11 LEU A 50 41.922 41.600 26.258 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.041 41.499 24.877 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.481 40.644 24.823 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.561 39.729 27.724 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.067 38.725 26.340 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.349 38.160 27.437 1.00 0.00 H new ATOM 813 N GLU A 51 43.969 35.648 23.900 1.00 0.00 N ATOM 814 CA GLU A 51 44.189 34.914 22.670 1.00 0.00 C ATOM 815 C GLU A 51 43.763 35.746 21.459 1.00 0.00 C ATOM 816 O GLU A 51 42.656 36.273 21.390 1.00 0.00 O ATOM 817 CB GLU A 51 43.484 33.562 22.732 1.00 0.00 C ATOM 818 CG GLU A 51 43.580 32.751 21.443 1.00 0.00 C ATOM 819 CD GLU A 51 42.961 31.363 21.630 1.00 0.00 C ATOM 820 OE1 GLU A 51 41.740 31.198 21.423 1.00 0.00 O ATOM 821 OE2 GLU A 51 43.707 30.421 21.972 1.00 0.00 O ATOM 0 H GLU A 51 43.184 35.287 24.442 1.00 0.00 H new ATOM 0 HA GLU A 51 45.255 34.718 22.553 1.00 0.00 H new ATOM 0 HB2 GLU A 51 43.910 32.979 23.548 1.00 0.00 H new ATOM 0 HB3 GLU A 51 42.433 33.723 22.970 1.00 0.00 H new ATOM 0 HG2 GLU A 51 43.068 33.277 20.637 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.624 32.652 21.146 1.00 0.00 H new ATOM 828 N ASP A 52 44.662 35.824 20.480 1.00 0.00 N ATOM 829 CA ASP A 52 44.601 36.747 19.365 1.00 0.00 C ATOM 830 C ASP A 52 43.480 36.465 18.364 1.00 0.00 C ATOM 831 O ASP A 52 43.018 37.385 17.691 1.00 0.00 O ATOM 832 CB ASP A 52 45.954 36.792 18.662 1.00 0.00 C ATOM 833 CG ASP A 52 47.114 37.151 19.592 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.107 38.246 20.193 1.00 0.00 O ATOM 835 OD2 ASP A 52 48.071 36.354 19.704 1.00 0.00 O ATOM 0 H ASP A 52 45.483 35.219 20.447 1.00 0.00 H new ATOM 0 HA ASP A 52 44.360 37.721 19.790 1.00 0.00 H new ATOM 0 HB2 ASP A 52 46.151 35.821 18.207 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.910 37.520 17.852 1.00 0.00 H new ATOM 840 N GLY A 53 43.004 35.225 18.289 1.00 0.00 N ATOM 841 CA GLY A 53 41.947 34.788 17.399 1.00 0.00 C ATOM 842 C GLY A 53 40.524 34.858 17.955 1.00 0.00 C ATOM 843 O GLY A 53 39.595 34.423 17.277 1.00 0.00 O ATOM 0 H GLY A 53 43.363 34.470 18.874 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.991 35.392 16.493 1.00 0.00 H new ATOM 0 HA3 GLY A 53 42.150 33.758 17.106 1.00 0.00 H new ATOM 847 N ARG A 54 40.327 35.371 19.167 1.00 0.00 N ATOM 848 CA ARG A 54 39.025 35.623 19.752 1.00 0.00 C ATOM 849 C ARG A 54 38.621 37.092 19.603 1.00 0.00 C ATOM 850 O ARG A 54 39.438 37.933 19.238 1.00 0.00 O ATOM 851 CB ARG A 54 38.980 35.152 21.202 1.00 0.00 C ATOM 852 CG ARG A 54 39.300 33.673 21.391 1.00 0.00 C ATOM 853 CD ARG A 54 38.971 33.220 22.812 1.00 0.00 C ATOM 854 NE ARG A 54 39.392 31.840 23.055 1.00 0.00 N ATOM 855 CZ ARG A 54 38.984 31.065 24.070 1.00 0.00 C ATOM 856 NH1 ARG A 54 38.113 31.453 25.012 1.00 0.00 N ATOM 857 NH2 ARG A 54 39.446 29.815 24.212 1.00 0.00 N ATOM 0 H ARG A 54 41.098 35.629 19.784 1.00 0.00 H new ATOM 0 HA ARG A 54 38.286 35.040 19.202 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.686 35.742 21.786 1.00 0.00 H new ATOM 0 HB3 ARG A 54 37.988 35.352 21.606 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.731 33.080 20.675 1.00 0.00 H new ATOM 0 HG3 ARG A 54 40.355 33.496 21.184 1.00 0.00 H new ATOM 0 HD2 ARG A 54 39.462 33.881 23.527 1.00 0.00 H new ATOM 0 HD3 ARG A 54 37.898 33.308 22.982 1.00 0.00 H new ATOM 0 HE ARG A 54 40.054 31.432 22.395 1.00 0.00 H new ATOM 0 HH11 ARG A 54 37.716 32.392 24.984 1.00 0.00 H new ATOM 0 HH12 ARG A 54 37.847 30.809 25.757 1.00 0.00 H new ATOM 0 HH21 ARG A 54 40.118 29.441 23.542 1.00 0.00 H new ATOM 0 HH22 ARG A 54 39.126 29.238 24.990 1.00 0.00 H new ATOM 871 N THR A 55 37.360 37.408 19.887 1.00 0.00 N ATOM 872 CA THR A 55 36.792 38.740 19.811 1.00 0.00 C ATOM 873 C THR A 55 36.556 39.369 21.186 1.00 0.00 C ATOM 874 O THR A 55 36.436 38.666 22.186 1.00 0.00 O ATOM 875 CB THR A 55 35.514 38.780 18.980 1.00 0.00 C ATOM 876 OG1 THR A 55 34.467 38.040 19.569 1.00 0.00 O ATOM 877 CG2 THR A 55 35.692 38.254 17.559 1.00 0.00 C ATOM 0 H THR A 55 36.682 36.708 20.189 1.00 0.00 H new ATOM 0 HA THR A 55 37.544 39.343 19.302 1.00 0.00 H new ATOM 0 HB THR A 55 35.262 39.840 18.943 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.733 37.100 19.644 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.742 38.313 17.028 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.437 38.856 17.039 1.00 0.00 H new ATOM 0 HG23 THR A 55 36.024 37.217 17.594 1.00 0.00 H new ATOM 885 N LEU A 56 36.455 40.694 21.252 1.00 0.00 N ATOM 886 CA LEU A 56 36.225 41.425 22.482 1.00 0.00 C ATOM 887 C LEU A 56 34.963 40.984 23.226 1.00 0.00 C ATOM 888 O LEU A 56 34.980 40.927 24.453 1.00 0.00 O ATOM 889 CB LEU A 56 36.222 42.921 22.185 1.00 0.00 C ATOM 890 CG LEU A 56 37.585 43.506 21.825 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.425 44.944 21.342 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.551 43.537 23.007 1.00 0.00 C ATOM 0 H LEU A 56 36.533 41.296 20.432 1.00 0.00 H new ATOM 0 HA LEU A 56 37.043 41.195 23.164 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.532 43.112 21.363 1.00 0.00 H new ATOM 0 HB3 LEU A 56 35.835 43.449 23.056 1.00 0.00 H new ATOM 0 HG LEU A 56 37.993 42.858 21.050 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.403 45.353 21.087 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.783 44.963 20.461 1.00 0.00 H new ATOM 0 HD13 LEU A 56 36.975 45.545 22.132 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.502 43.963 22.688 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.129 44.147 23.806 1.00 0.00 H new ATOM 0 HD23 LEU A 56 38.712 42.523 23.372 1.00 0.00 H new ATOM 904 N SER A 57 33.911 40.583 22.517 1.00 0.00 N ATOM 905 CA SER A 57 32.704 40.021 23.090 1.00 0.00 C ATOM 906 C SER A 57 32.848 38.594 23.622 1.00 0.00 C ATOM 907 O SER A 57 32.048 38.185 24.461 1.00 0.00 O ATOM 908 CB SER A 57 31.550 40.120 22.098 1.00 0.00 C ATOM 909 OG SER A 57 31.834 39.462 20.883 1.00 0.00 O ATOM 0 H SER A 57 33.880 40.644 21.499 1.00 0.00 H new ATOM 0 HA SER A 57 32.489 40.627 23.970 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.653 39.688 22.542 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.333 41.170 21.899 1.00 0.00 H new ATOM 0 HG SER A 57 31.458 39.975 20.137 1.00 0.00 H new ATOM 915 N ASP A 58 33.879 37.851 23.234 1.00 0.00 N ATOM 916 CA ASP A 58 34.228 36.586 23.850 1.00 0.00 C ATOM 917 C ASP A 58 34.881 36.778 25.219 1.00 0.00 C ATOM 918 O ASP A 58 34.894 35.859 26.036 1.00 0.00 O ATOM 919 CB ASP A 58 35.138 35.764 22.941 1.00 0.00 C ATOM 920 CG ASP A 58 34.553 35.532 21.546 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.353 35.201 21.435 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.272 35.693 20.536 1.00 0.00 O ATOM 0 H ASP A 58 34.501 38.119 22.472 1.00 0.00 H new ATOM 0 HA ASP A 58 33.297 36.039 23.999 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.098 36.272 22.845 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.333 34.800 23.410 1.00 0.00 H new ATOM 927 N TYR A 59 35.381 37.976 25.510 1.00 0.00 N ATOM 928 CA TYR A 59 35.923 38.380 26.791 1.00 0.00 C ATOM 929 C TYR A 59 35.013 39.329 27.575 1.00 0.00 C ATOM 930 O TYR A 59 35.362 39.685 28.699 1.00 0.00 O ATOM 931 CB TYR A 59 37.299 39.003 26.576 1.00 0.00 C ATOM 932 CG TYR A 59 38.292 38.137 25.839 1.00 0.00 C ATOM 933 CD1 TYR A 59 38.678 38.481 24.538 1.00 0.00 C ATOM 934 CD2 TYR A 59 38.832 37.003 26.460 1.00 0.00 C ATOM 935 CE1 TYR A 59 39.628 37.709 23.860 1.00 0.00 C ATOM 936 CE2 TYR A 59 39.783 36.224 25.791 1.00 0.00 C ATOM 937 CZ TYR A 59 40.190 36.581 24.490 1.00 0.00 C ATOM 938 OH TYR A 59 41.152 35.843 23.864 1.00 0.00 O ATOM 0 H TYR A 59 35.418 38.725 24.819 1.00 0.00 H new ATOM 0 HA TYR A 59 36.003 37.483 27.405 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.175 39.935 26.025 1.00 0.00 H new ATOM 0 HB3 TYR A 59 37.719 39.261 27.548 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.242 39.344 24.057 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.514 36.730 27.455 1.00 0.00 H new ATOM 0 HE1 TYR A 59 39.929 37.977 22.858 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.203 35.352 26.270 1.00 0.00 H new ATOM 0 HH TYR A 59 41.444 36.308 23.052 1.00 0.00 H new ATOM 948 N ASN A 60 33.879 39.732 27.012 1.00 0.00 N ATOM 949 CA ASN A 60 32.970 40.732 27.538 1.00 0.00 C ATOM 950 C ASN A 60 33.657 42.053 27.888 1.00 0.00 C ATOM 951 O ASN A 60 33.451 42.603 28.968 1.00 0.00 O ATOM 952 CB ASN A 60 32.087 40.135 28.629 1.00 0.00 C ATOM 953 CG ASN A 60 30.992 39.221 28.072 1.00 0.00 C ATOM 954 OD1 ASN A 60 29.866 39.648 27.832 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.290 37.948 27.831 1.00 0.00 N ATOM 0 H ASN A 60 33.555 39.344 26.126 1.00 0.00 H new ATOM 0 HA ASN A 60 32.289 41.030 26.741 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.708 39.569 29.323 1.00 0.00 H new ATOM 0 HB3 ASN A 60 31.626 40.942 29.199 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.582 37.323 27.446 1.00 0.00 H new ATOM 0 HD22 ASN A 60 32.226 37.597 28.032 1.00 0.00 H new ATOM 962 N ILE A 61 34.496 42.572 26.995 1.00 0.00 N ATOM 963 CA ILE A 61 35.162 43.850 27.145 1.00 0.00 C ATOM 964 C ILE A 61 34.294 44.942 26.516 1.00 0.00 C ATOM 965 O ILE A 61 34.167 45.016 25.297 1.00 0.00 O ATOM 966 CB ILE A 61 36.579 43.797 26.580 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.420 42.782 27.350 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.241 45.171 26.644 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.794 42.484 26.756 1.00 0.00 C ATOM 0 H ILE A 61 34.734 42.096 26.125 1.00 0.00 H new ATOM 0 HA ILE A 61 35.280 44.092 28.201 1.00 0.00 H new ATOM 0 HB ILE A 61 36.515 43.490 25.536 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.555 43.146 28.369 1.00 0.00 H new ATOM 0 HG13 ILE A 61 36.861 41.848 27.416 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.250 45.108 26.236 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.657 45.884 26.061 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.289 45.504 27.681 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.308 41.752 27.378 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.676 42.085 25.749 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.380 43.402 26.716 1.00 0.00 H new ATOM 981 N GLN A 62 33.681 45.772 27.357 1.00 0.00 N ATOM 982 CA GLN A 62 32.773 46.838 26.987 1.00 0.00 C ATOM 983 C GLN A 62 33.417 48.226 27.023 1.00 0.00 C ATOM 984 O GLN A 62 34.512 48.407 27.550 1.00 0.00 O ATOM 985 CB GLN A 62 31.514 46.756 27.847 1.00 0.00 C ATOM 986 CG GLN A 62 30.671 45.534 27.494 1.00 0.00 C ATOM 987 CD GLN A 62 29.248 45.574 28.054 1.00 0.00 C ATOM 988 OE1 GLN A 62 28.658 46.622 28.310 1.00 0.00 O ATOM 989 NE2 GLN A 62 28.604 44.429 28.256 1.00 0.00 N ATOM 0 H GLN A 62 33.816 45.710 28.366 1.00 0.00 H new ATOM 0 HA GLN A 62 32.496 46.693 25.943 1.00 0.00 H new ATOM 0 HB2 GLN A 62 31.794 46.714 28.900 1.00 0.00 H new ATOM 0 HB3 GLN A 62 30.920 47.660 27.711 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.621 45.442 26.409 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.172 44.640 27.867 1.00 0.00 H new ATOM 0 HE21 GLN A 62 29.065 43.542 28.054 1.00 0.00 H new ATOM 0 HE22 GLN A 62 27.649 44.437 28.613 1.00 0.00 H new ATOM 998 N LYS A 63 32.741 49.204 26.427 1.00 0.00 N ATOM 999 CA LYS A 63 33.233 50.535 26.133 1.00 0.00 C ATOM 1000 C LYS A 63 33.978 51.243 27.266 1.00 0.00 C ATOM 1001 O LYS A 63 33.588 51.197 28.431 1.00 0.00 O ATOM 1002 CB LYS A 63 32.121 51.415 25.569 1.00 0.00 C ATOM 1003 CG LYS A 63 30.942 51.692 26.497 1.00 0.00 C ATOM 1004 CD LYS A 63 30.006 52.711 25.854 1.00 0.00 C ATOM 1005 CE LYS A 63 28.649 52.877 26.531 1.00 0.00 C ATOM 1006 NZ LYS A 63 28.757 53.228 27.956 1.00 0.00 N ATOM 0 H LYS A 63 31.777 49.074 26.120 1.00 0.00 H new ATOM 0 HA LYS A 63 34.000 50.375 25.375 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.556 52.370 25.275 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.740 50.945 24.662 1.00 0.00 H new ATOM 0 HG2 LYS A 63 30.403 50.767 26.701 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.302 52.069 27.455 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.506 53.679 25.840 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.841 52.422 24.816 1.00 0.00 H new ATOM 0 HE2 LYS A 63 28.083 53.652 26.013 1.00 0.00 H new ATOM 0 HE3 LYS A 63 28.084 51.950 26.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 27.805 53.328 28.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 29.272 52.478 28.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 29.271 54.127 28.054 1.00 0.00 H new ATOM 1020 N GLU A 64 35.052 51.925 26.879 1.00 0.00 N ATOM 1021 CA GLU A 64 35.928 52.733 27.703 1.00 0.00 C ATOM 1022 C GLU A 64 36.676 51.956 28.790 1.00 0.00 C ATOM 1023 O GLU A 64 37.230 52.550 29.712 1.00 0.00 O ATOM 1024 CB GLU A 64 35.211 54.003 28.151 1.00 0.00 C ATOM 1025 CG GLU A 64 34.752 54.848 26.966 1.00 0.00 C ATOM 1026 CD GLU A 64 33.947 56.072 27.407 1.00 0.00 C ATOM 1027 OE1 GLU A 64 34.529 56.996 28.014 1.00 0.00 O ATOM 1028 OE2 GLU A 64 32.721 56.118 27.165 1.00 0.00 O ATOM 0 H GLU A 64 35.350 51.923 25.904 1.00 0.00 H new ATOM 0 HA GLU A 64 36.762 53.064 27.084 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.349 53.736 28.762 1.00 0.00 H new ATOM 0 HB3 GLU A 64 35.877 54.593 28.781 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.622 55.174 26.395 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.144 54.236 26.299 1.00 0.00 H new ATOM 1035 N SER A 65 36.755 50.635 28.659 1.00 0.00 N ATOM 1036 CA SER A 65 37.692 49.786 29.367 1.00 0.00 C ATOM 1037 C SER A 65 39.145 50.029 28.949 1.00 0.00 C ATOM 1038 O SER A 65 39.406 50.448 27.823 1.00 0.00 O ATOM 1039 CB SER A 65 37.360 48.316 29.130 1.00 0.00 C ATOM 1040 OG SER A 65 36.098 47.990 29.667 1.00 0.00 O ATOM 0 H SER A 65 36.143 50.113 28.032 1.00 0.00 H new ATOM 0 HA SER A 65 37.595 50.038 30.423 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.370 48.105 28.061 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.126 47.688 29.585 1.00 0.00 H new ATOM 0 HG SER A 65 35.395 48.283 29.051 1.00 0.00 H new ATOM 1046 N THR A 66 40.083 49.704 29.834 1.00 0.00 N ATOM 1047 CA THR A 66 41.510 49.858 29.637 1.00 0.00 C ATOM 1048 C THR A 66 42.224 48.506 29.610 1.00 0.00 C ATOM 1049 O THR A 66 42.001 47.666 30.479 1.00 0.00 O ATOM 1050 CB THR A 66 42.132 50.749 30.709 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.328 51.879 30.960 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.521 51.256 30.332 1.00 0.00 C ATOM 0 H THR A 66 39.853 49.309 30.746 1.00 0.00 H new ATOM 0 HA THR A 66 41.641 50.339 28.667 1.00 0.00 H new ATOM 0 HB THR A 66 42.210 50.118 31.594 1.00 0.00 H new ATOM 0 HG1 THR A 66 41.748 52.432 31.651 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.909 51.883 31.134 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.189 50.408 30.179 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.458 51.839 29.413 1.00 0.00 H new ATOM 1060 N LEU A 67 43.094 48.294 28.627 1.00 0.00 N ATOM 1061 CA LEU A 67 43.944 47.129 28.482 1.00 0.00 C ATOM 1062 C LEU A 67 45.409 47.494 28.733 1.00 0.00 C ATOM 1063 O LEU A 67 45.781 48.662 28.662 1.00 0.00 O ATOM 1064 CB LEU A 67 43.764 46.504 27.102 1.00 0.00 C ATOM 1065 CG LEU A 67 42.397 45.891 26.811 1.00 0.00 C ATOM 1066 CD1 LEU A 67 41.339 46.900 26.374 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.529 44.871 25.683 1.00 0.00 C ATOM 0 H LEU A 67 43.228 48.969 27.874 1.00 0.00 H new ATOM 0 HA LEU A 67 43.649 46.392 29.229 1.00 0.00 H new ATOM 0 HB2 LEU A 67 43.963 47.269 26.351 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.520 45.729 26.976 1.00 0.00 H new ATOM 0 HG LEU A 67 42.072 45.446 27.751 1.00 0.00 H new ATOM 0 HD11 LEU A 67 40.398 46.383 26.187 1.00 0.00 H new ATOM 0 HD12 LEU A 67 41.196 47.641 27.161 1.00 0.00 H new ATOM 0 HD13 LEU A 67 41.666 47.398 25.461 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.554 44.432 25.474 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.904 45.366 24.787 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.224 44.086 25.982 1.00 0.00 H new ATOM 1079 N HIS A 68 46.263 46.503 28.972 1.00 0.00 N ATOM 1080 CA HIS A 68 47.702 46.666 29.037 1.00 0.00 C ATOM 1081 C HIS A 68 48.383 45.975 27.855 1.00 0.00 C ATOM 1082 O HIS A 68 47.926 44.934 27.389 1.00 0.00 O ATOM 1083 CB HIS A 68 48.220 46.159 30.380 1.00 0.00 C ATOM 1084 CG HIS A 68 47.978 47.079 31.546 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.971 47.755 32.254 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.780 47.257 32.187 1.00 0.00 C ATOM 1087 CE1 HIS A 68 48.361 48.327 33.295 1.00 0.00 C ATOM 1088 NE2 HIS A 68 47.046 48.054 33.283 1.00 0.00 N ATOM 0 H HIS A 68 45.960 45.542 29.129 1.00 0.00 H new ATOM 0 HA HIS A 68 47.948 47.725 28.963 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.753 45.198 30.593 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.292 45.980 30.294 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.821 46.855 31.894 1.00 0.00 H new ATOM 0 HE1 HIS A 68 48.857 48.927 34.044 1.00 0.00 H new ATOM 0 HE2 HIS A 68 46.362 48.379 33.966 1.00 0.00 H new ATOM 1096 N LEU A 69 49.476 46.554 27.364 1.00 0.00 N ATOM 1097 CA LEU A 69 50.214 46.095 26.205 1.00 0.00 C ATOM 1098 C LEU A 69 51.631 45.660 26.582 1.00 0.00 C ATOM 1099 O LEU A 69 52.360 46.425 27.210 1.00 0.00 O ATOM 1100 CB LEU A 69 50.215 47.243 25.200 1.00 0.00 C ATOM 1101 CG LEU A 69 50.987 47.018 23.904 1.00 0.00 C ATOM 1102 CD1 LEU A 69 50.374 45.918 23.042 1.00 0.00 C ATOM 1103 CD2 LEU A 69 50.988 48.310 23.091 1.00 0.00 C ATOM 0 H LEU A 69 49.883 47.389 27.785 1.00 0.00 H new ATOM 0 HA LEU A 69 49.745 45.213 25.769 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.181 47.472 24.944 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.625 48.125 25.692 1.00 0.00 H new ATOM 0 HG LEU A 69 51.997 46.714 24.180 1.00 0.00 H new ATOM 0 HD11 LEU A 69 50.962 45.799 22.132 1.00 0.00 H new ATOM 0 HD12 LEU A 69 50.370 44.980 23.597 1.00 0.00 H new ATOM 0 HD13 LEU A 69 49.351 46.188 22.780 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.539 48.156 22.163 1.00 0.00 H new ATOM 0 HD22 LEU A 69 49.962 48.596 22.861 1.00 0.00 H new ATOM 0 HD23 LEU A 69 51.465 49.103 23.668 1.00 0.00 H new ATOM 1115 N VAL A 70 52.037 44.472 26.145 1.00 0.00 N ATOM 1116 CA VAL A 70 53.387 43.961 26.259 1.00 0.00 C ATOM 1117 C VAL A 70 53.901 43.433 24.918 1.00 0.00 C ATOM 1118 O VAL A 70 53.124 43.073 24.035 1.00 0.00 O ATOM 1119 CB VAL A 70 53.542 42.912 27.356 1.00 0.00 C ATOM 1120 CG1 VAL A 70 53.130 43.439 28.727 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.781 41.616 27.091 1.00 0.00 C ATOM 0 H VAL A 70 51.405 43.818 25.684 1.00 0.00 H new ATOM 0 HA VAL A 70 54.005 44.809 26.554 1.00 0.00 H new ATOM 0 HB VAL A 70 54.608 42.687 27.349 1.00 0.00 H new ATOM 0 HG11 VAL A 70 53.259 42.654 29.472 1.00 0.00 H new ATOM 0 HG12 VAL A 70 53.752 44.295 28.990 1.00 0.00 H new ATOM 0 HG13 VAL A 70 52.084 43.745 28.700 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.943 40.923 27.917 1.00 0.00 H new ATOM 0 HG22 VAL A 70 51.716 41.831 27.002 1.00 0.00 H new ATOM 0 HG23 VAL A 70 53.139 41.166 26.165 1.00 0.00 H new