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 60 ASN : amide:sc= 0.512 K(o=1.1,f=-1.2) USER MOD Set 1.2: A 62 GLN : amide:sc= 0.588 K(o=1.1,f=-0.33) USER MOD Set 2.1: A 55 THR OG1 : rot 130:sc= 1.23 USER MOD Set 2.2: A 57 SER OG : rot 180:sc= 1.02 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -178:sc= 2.28 (180deg=2.25) USER MOD Single : A 2 GLN : amide:sc= 1.23 K(o=1.2,f=-0.41) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 159:sc= 0.96 (180deg=0.296!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -65:sc= 0.584 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.00513 USER MOD Single : A 25 ASN : amide:sc= -0.371 X(o=-0.37,f=-0.33) USER MOD Single : A 27 LYS NZ :NH3+ -137:sc= 0.0364 (180deg=-1.3!) USER MOD Single : A 29 LYS NZ :NH3+ 170:sc= 2.48 (180deg=2.01) USER MOD Single : A 31 GLN : amide:sc= -1.13 K(o=-1.1,f=-1.8) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc=-0.00217 K(o=-0.0022,f=-1.1) USER MOD Single : A 41 GLN : amide:sc= 0.0482 K(o=0.048,f=-0.83) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 1.05 K(o=1,f=-5.1!) USER MOD Single : A 59 TYR OH : rot 120:sc= 0.339 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 73:sc= 1.23 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.696 52.178 20.101 1.00 0.00 N ATOM 2 CA MET A 1 33.107 52.378 21.499 1.00 0.00 C ATOM 3 C MET A 1 34.622 52.580 21.565 1.00 0.00 C ATOM 4 O MET A 1 35.340 51.989 20.762 1.00 0.00 O ATOM 5 CB MET A 1 32.637 51.250 22.414 1.00 0.00 C ATOM 6 CG MET A 1 33.397 49.934 22.272 1.00 0.00 C ATOM 7 SD MET A 1 32.701 48.589 23.264 1.00 0.00 S ATOM 8 CE MET A 1 33.974 47.320 23.055 1.00 0.00 C ATOM 0 H1 MET A 1 31.662 52.075 20.054 1.00 0.00 H new ATOM 0 H2 MET A 1 32.988 52.998 19.533 1.00 0.00 H new ATOM 0 H3 MET A 1 33.147 51.319 19.726 1.00 0.00 H new ATOM 0 HA MET A 1 32.619 53.278 21.872 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.716 51.586 23.448 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.581 51.063 22.220 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.401 49.637 21.223 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.436 50.090 22.563 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.690 46.425 23.609 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.074 47.076 21.997 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.926 47.694 23.433 1.00 0.00 H new ATOM 20 N GLN A 2 35.112 53.374 22.513 1.00 0.00 N ATOM 21 CA GLN A 2 36.533 53.550 22.733 1.00 0.00 C ATOM 22 C GLN A 2 37.085 52.570 23.771 1.00 0.00 C ATOM 23 O GLN A 2 36.390 52.214 24.720 1.00 0.00 O ATOM 24 CB GLN A 2 36.884 55.010 23.009 1.00 0.00 C ATOM 25 CG GLN A 2 36.524 55.532 24.397 1.00 0.00 C ATOM 26 CD GLN A 2 36.888 57.006 24.584 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.228 57.745 23.662 1.00 0.00 O ATOM 28 NE2 GLN A 2 36.815 57.528 25.805 1.00 0.00 N ATOM 0 H GLN A 2 34.526 53.914 23.150 1.00 0.00 H new ATOM 0 HA GLN A 2 37.045 53.295 21.805 1.00 0.00 H new ATOM 0 HB2 GLN A 2 37.956 55.140 22.860 1.00 0.00 H new ATOM 0 HB3 GLN A 2 36.381 55.631 22.267 1.00 0.00 H new ATOM 0 HG2 GLN A 2 35.455 55.402 24.564 1.00 0.00 H new ATOM 0 HG3 GLN A 2 37.039 54.936 25.150 1.00 0.00 H new ATOM 0 HE21 GLN A 2 36.536 56.944 26.593 1.00 0.00 H new ATOM 0 HE22 GLN A 2 37.038 58.512 25.953 1.00 0.00 H new ATOM 37 N ILE A 3 38.341 52.172 23.592 1.00 0.00 N ATOM 38 CA ILE A 3 39.139 51.443 24.558 1.00 0.00 C ATOM 39 C ILE A 3 40.556 52.018 24.597 1.00 0.00 C ATOM 40 O ILE A 3 40.959 52.732 23.681 1.00 0.00 O ATOM 41 CB ILE A 3 39.151 49.938 24.309 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.771 49.557 22.968 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.761 49.337 24.493 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.087 48.071 22.821 1.00 0.00 C ATOM 0 H ILE A 3 38.849 52.360 22.728 1.00 0.00 H new ATOM 0 HA ILE A 3 38.673 51.574 25.535 1.00 0.00 H new ATOM 0 HB ILE A 3 39.803 49.502 25.066 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.090 49.852 22.169 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.690 50.127 22.831 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.801 48.263 24.309 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.418 49.518 25.512 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.069 49.800 23.790 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.524 47.887 21.840 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.793 47.771 23.595 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.169 47.492 22.923 1.00 0.00 H new ATOM 56 N PHE A 4 41.325 51.676 25.627 1.00 0.00 N ATOM 57 CA PHE A 4 42.649 52.210 25.869 1.00 0.00 C ATOM 58 C PHE A 4 43.706 51.113 26.028 1.00 0.00 C ATOM 59 O PHE A 4 43.446 50.103 26.678 1.00 0.00 O ATOM 60 CB PHE A 4 42.612 53.077 27.125 1.00 0.00 C ATOM 61 CG PHE A 4 41.618 54.213 27.104 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.962 55.440 26.523 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.351 54.042 27.675 1.00 0.00 C ATOM 64 CE1 PHE A 4 41.054 56.506 26.547 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.439 55.104 27.681 1.00 0.00 C ATOM 66 CZ PHE A 4 39.793 56.341 27.130 1.00 0.00 C ATOM 0 H PHE A 4 41.030 51.001 26.332 1.00 0.00 H new ATOM 0 HA PHE A 4 42.934 52.802 24.999 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.389 52.438 27.979 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.607 53.491 27.288 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.928 55.564 26.056 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.078 53.092 28.110 1.00 0.00 H new ATOM 0 HE1 PHE A 4 41.328 57.457 26.115 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.458 54.968 28.113 1.00 0.00 H new ATOM 0 HZ PHE A 4 39.095 57.165 27.155 1.00 0.00 H new ATOM 76 N VAL A 5 44.912 51.328 25.513 1.00 0.00 N ATOM 77 CA VAL A 5 46.052 50.450 25.679 1.00 0.00 C ATOM 78 C VAL A 5 47.178 51.194 26.400 1.00 0.00 C ATOM 79 O VAL A 5 47.601 52.250 25.935 1.00 0.00 O ATOM 80 CB VAL A 5 46.532 49.899 24.340 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.640 48.869 24.539 1.00 0.00 C ATOM 82 CG2 VAL A 5 45.404 49.234 23.556 1.00 0.00 C ATOM 0 H VAL A 5 45.124 52.151 24.949 1.00 0.00 H new ATOM 0 HA VAL A 5 45.745 49.598 26.286 1.00 0.00 H new ATOM 0 HB VAL A 5 46.906 50.754 23.776 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.965 48.492 23.569 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.484 49.336 25.048 1.00 0.00 H new ATOM 0 HG13 VAL A 5 47.265 48.043 25.143 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.792 48.857 22.610 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.996 48.407 24.137 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.618 49.963 23.361 1.00 0.00 H new ATOM 92 N LYS A 6 47.662 50.657 27.517 1.00 0.00 N ATOM 93 CA LYS A 6 48.581 51.304 28.432 1.00 0.00 C ATOM 94 C LYS A 6 49.951 50.623 28.420 1.00 0.00 C ATOM 95 O LYS A 6 50.035 49.402 28.533 1.00 0.00 O ATOM 96 CB LYS A 6 47.983 51.331 29.835 1.00 0.00 C ATOM 97 CG LYS A 6 46.586 51.941 29.881 1.00 0.00 C ATOM 98 CD LYS A 6 46.046 52.139 31.294 1.00 0.00 C ATOM 99 CE LYS A 6 46.771 53.273 32.013 1.00 0.00 C ATOM 100 NZ LYS A 6 46.274 53.442 33.387 1.00 0.00 N ATOM 0 H LYS A 6 47.409 49.716 27.817 1.00 0.00 H new ATOM 0 HA LYS A 6 48.735 52.331 28.102 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.941 50.314 30.225 1.00 0.00 H new ATOM 0 HB3 LYS A 6 48.642 51.898 30.493 1.00 0.00 H new ATOM 0 HG2 LYS A 6 46.603 52.904 29.371 1.00 0.00 H new ATOM 0 HG3 LYS A 6 45.901 51.299 29.327 1.00 0.00 H new ATOM 0 HD2 LYS A 6 44.979 52.357 31.250 1.00 0.00 H new ATOM 0 HD3 LYS A 6 46.159 51.215 31.861 1.00 0.00 H new ATOM 0 HE2 LYS A 6 47.841 53.067 32.034 1.00 0.00 H new ATOM 0 HE3 LYS A 6 46.636 54.202 31.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 46.787 54.220 33.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 45.258 53.663 33.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 46.425 52.563 33.922 1.00 0.00 H new ATOM 168 N LYS A 11 52.699 55.929 28.641 1.00 0.00 N ATOM 169 CA LYS A 11 51.872 56.273 27.503 1.00 0.00 C ATOM 170 C LYS A 11 50.570 55.470 27.496 1.00 0.00 C ATOM 171 O LYS A 11 50.570 54.284 27.821 1.00 0.00 O ATOM 172 CB LYS A 11 52.678 56.082 26.222 1.00 0.00 C ATOM 173 CG LYS A 11 52.058 56.789 25.020 1.00 0.00 C ATOM 174 CD LYS A 11 52.883 56.614 23.749 1.00 0.00 C ATOM 175 CE LYS A 11 52.292 57.481 22.640 1.00 0.00 C ATOM 176 NZ LYS A 11 52.950 57.281 21.339 1.00 0.00 N ATOM 0 HA LYS A 11 51.579 57.321 27.572 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.690 56.457 26.376 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.762 55.017 26.007 1.00 0.00 H new ATOM 0 HG2 LYS A 11 51.053 56.401 24.853 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.957 57.852 25.240 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.920 56.896 23.933 1.00 0.00 H new ATOM 0 HD3 LYS A 11 52.886 55.567 23.445 1.00 0.00 H new ATOM 0 HE2 LYS A 11 51.229 57.259 22.541 1.00 0.00 H new ATOM 0 HE3 LYS A 11 52.374 58.530 22.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 52.316 57.597 20.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.831 57.832 21.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 53.168 56.272 21.212 1.00 0.00 H new ATOM 190 N THR A 12 49.470 56.092 27.081 1.00 0.00 N ATOM 191 CA THR A 12 48.211 55.440 26.783 1.00 0.00 C ATOM 192 C THR A 12 47.772 55.770 25.354 1.00 0.00 C ATOM 193 O THR A 12 47.823 56.925 24.937 1.00 0.00 O ATOM 194 CB THR A 12 47.130 55.822 27.790 1.00 0.00 C ATOM 195 OG1 THR A 12 47.506 55.470 29.103 1.00 0.00 O ATOM 196 CG2 THR A 12 45.809 55.107 27.520 1.00 0.00 C ATOM 0 H THR A 12 49.436 57.102 26.940 1.00 0.00 H new ATOM 0 HA THR A 12 48.359 54.363 26.863 1.00 0.00 H new ATOM 0 HB THR A 12 47.008 56.900 27.685 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.796 55.728 29.727 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.072 55.412 28.263 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.450 55.369 26.524 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.960 54.029 27.580 1.00 0.00 H new ATOM 204 N ILE A 13 47.310 54.766 24.615 1.00 0.00 N ATOM 205 CA ILE A 13 46.786 54.882 23.268 1.00 0.00 C ATOM 206 C ILE A 13 45.269 54.683 23.293 1.00 0.00 C ATOM 207 O ILE A 13 44.803 53.689 23.846 1.00 0.00 O ATOM 208 CB ILE A 13 47.443 53.864 22.341 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.965 53.808 22.442 1.00 0.00 C ATOM 210 CG2 ILE A 13 47.022 54.099 20.893 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.688 55.118 22.146 1.00 0.00 C ATOM 0 H ILE A 13 47.292 53.806 24.960 1.00 0.00 H new ATOM 0 HA ILE A 13 47.012 55.877 22.885 1.00 0.00 H new ATOM 0 HB ILE A 13 47.083 52.893 22.681 1.00 0.00 H new ATOM 0 HG12 ILE A 13 49.234 53.483 23.447 1.00 0.00 H new ATOM 0 HG13 ILE A 13 49.330 53.047 21.753 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.503 53.362 20.250 1.00 0.00 H new ATOM 0 HG22 ILE A 13 45.939 54.003 20.809 1.00 0.00 H new ATOM 0 HG23 ILE A 13 47.323 55.100 20.585 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.763 54.971 22.245 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.458 55.439 21.130 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.360 55.882 22.851 1.00 0.00 H new ATOM 223 N THR A 14 44.511 55.582 22.673 1.00 0.00 N ATOM 224 CA THR A 14 43.077 55.450 22.505 1.00 0.00 C ATOM 225 C THR A 14 42.761 54.810 21.152 1.00 0.00 C ATOM 226 O THR A 14 43.317 55.233 20.141 1.00 0.00 O ATOM 227 CB THR A 14 42.381 56.803 22.609 1.00 0.00 C ATOM 228 OG1 THR A 14 42.714 57.448 23.817 1.00 0.00 O ATOM 229 CG2 THR A 14 40.859 56.699 22.602 1.00 0.00 C ATOM 0 H THR A 14 44.889 56.438 22.267 1.00 0.00 H new ATOM 0 HA THR A 14 42.704 54.810 23.305 1.00 0.00 H new ATOM 0 HB THR A 14 42.721 57.358 21.735 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.364 56.930 24.572 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.426 57.696 22.679 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.531 56.231 21.674 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.532 56.095 23.448 1.00 0.00 H new ATOM 237 N LEU A 15 41.867 53.825 21.128 1.00 0.00 N ATOM 238 CA LEU A 15 41.393 53.146 19.938 1.00 0.00 C ATOM 239 C LEU A 15 39.879 53.291 19.775 1.00 0.00 C ATOM 240 O LEU A 15 39.177 53.593 20.738 1.00 0.00 O ATOM 241 CB LEU A 15 41.776 51.671 20.002 1.00 0.00 C ATOM 242 CG LEU A 15 43.258 51.355 20.181 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.432 49.842 20.272 1.00 0.00 C ATOM 244 CD2 LEU A 15 44.118 51.869 19.030 1.00 0.00 C ATOM 0 H LEU A 15 41.437 53.466 21.980 1.00 0.00 H new ATOM 0 HA LEU A 15 41.865 53.609 19.071 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.228 51.213 20.826 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.434 51.191 19.085 1.00 0.00 H new ATOM 0 HG LEU A 15 43.587 51.857 21.091 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.488 49.604 20.400 1.00 0.00 H new ATOM 0 HD12 LEU A 15 42.868 49.462 21.124 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.064 49.378 19.357 1.00 0.00 H new ATOM 0 HD21 LEU A 15 45.162 51.614 19.214 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.791 51.409 18.098 1.00 0.00 H new ATOM 0 HD23 LEU A 15 44.016 52.952 18.955 1.00 0.00 H new ATOM 256 N GLU A 16 39.353 53.003 18.587 1.00 0.00 N ATOM 257 CA GLU A 16 37.941 52.799 18.340 1.00 0.00 C ATOM 258 C GLU A 16 37.690 51.345 17.934 1.00 0.00 C ATOM 259 O GLU A 16 38.417 50.790 17.113 1.00 0.00 O ATOM 260 CB GLU A 16 37.437 53.778 17.283 1.00 0.00 C ATOM 261 CG GLU A 16 35.935 53.732 17.012 1.00 0.00 C ATOM 262 CD GLU A 16 35.052 54.179 18.178 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.499 54.930 19.073 1.00 0.00 O ATOM 264 OE2 GLU A 16 33.861 53.802 18.191 1.00 0.00 O ATOM 0 H GLU A 16 39.923 52.903 17.747 1.00 0.00 H new ATOM 0 HA GLU A 16 37.382 52.994 19.255 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.703 54.789 17.592 1.00 0.00 H new ATOM 0 HB3 GLU A 16 37.964 53.581 16.349 1.00 0.00 H new ATOM 0 HG2 GLU A 16 35.718 54.362 16.149 1.00 0.00 H new ATOM 0 HG3 GLU A 16 35.662 52.713 16.739 1.00 0.00 H new ATOM 271 N VAL A 17 36.681 50.717 18.532 1.00 0.00 N ATOM 272 CA VAL A 17 36.323 49.323 18.367 1.00 0.00 C ATOM 273 C VAL A 17 34.810 49.130 18.493 1.00 0.00 C ATOM 274 O VAL A 17 34.086 50.041 18.890 1.00 0.00 O ATOM 275 CB VAL A 17 37.045 48.443 19.383 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.564 48.469 19.235 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.695 48.796 20.826 1.00 0.00 C ATOM 0 H VAL A 17 36.060 51.201 19.180 1.00 0.00 H new ATOM 0 HA VAL A 17 36.634 49.022 17.367 1.00 0.00 H new ATOM 0 HB VAL A 17 36.688 47.437 19.160 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.014 47.822 19.988 1.00 0.00 H new ATOM 0 HG12 VAL A 17 38.839 48.115 18.241 1.00 0.00 H new ATOM 0 HG13 VAL A 17 38.925 49.489 19.370 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.238 48.137 21.504 1.00 0.00 H new ATOM 0 HG22 VAL A 17 36.973 49.831 21.025 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.623 48.672 20.981 1.00 0.00 H new ATOM 287 N GLU A 18 34.330 47.914 18.251 1.00 0.00 N ATOM 288 CA GLU A 18 33.024 47.428 18.649 1.00 0.00 C ATOM 289 C GLU A 18 33.187 46.057 19.309 1.00 0.00 C ATOM 290 O GLU A 18 34.210 45.418 19.074 1.00 0.00 O ATOM 291 CB GLU A 18 32.089 47.334 17.447 1.00 0.00 C ATOM 292 CG GLU A 18 31.662 48.681 16.871 1.00 0.00 C ATOM 293 CD GLU A 18 30.816 49.519 17.831 1.00 0.00 C ATOM 294 OE1 GLU A 18 29.698 49.091 18.188 1.00 0.00 O ATOM 295 OE2 GLU A 18 31.231 50.639 18.204 1.00 0.00 O ATOM 0 H GLU A 18 34.871 47.211 17.748 1.00 0.00 H new ATOM 0 HA GLU A 18 32.580 48.127 19.358 1.00 0.00 H new ATOM 0 HB2 GLU A 18 32.581 46.758 16.664 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.198 46.779 17.739 1.00 0.00 H new ATOM 0 HG2 GLU A 18 32.552 49.247 16.596 1.00 0.00 H new ATOM 0 HG3 GLU A 18 31.096 48.512 15.955 1.00 0.00 H new ATOM 302 N PRO A 19 32.236 45.547 20.087 1.00 0.00 N ATOM 303 CA PRO A 19 32.390 44.270 20.754 1.00 0.00 C ATOM 304 C PRO A 19 32.669 43.084 19.828 1.00 0.00 C ATOM 305 O PRO A 19 33.392 42.162 20.198 1.00 0.00 O ATOM 306 CB PRO A 19 31.103 44.065 21.548 1.00 0.00 C ATOM 307 CG PRO A 19 30.627 45.488 21.823 1.00 0.00 C ATOM 308 CD PRO A 19 31.031 46.212 20.541 1.00 0.00 C ATOM 0 HA PRO A 19 33.278 44.302 21.385 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.366 43.498 20.979 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.284 43.516 22.472 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.552 45.532 21.995 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.108 45.916 22.702 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.243 46.152 19.791 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.213 47.270 20.728 1.00 0.00 H new ATOM 316 N SER A 20 32.153 43.128 18.603 1.00 0.00 N ATOM 317 CA SER A 20 32.372 42.150 17.555 1.00 0.00 C ATOM 318 C SER A 20 33.719 42.253 16.839 1.00 0.00 C ATOM 319 O SER A 20 33.973 41.475 15.922 1.00 0.00 O ATOM 320 CB SER A 20 31.251 42.268 16.528 1.00 0.00 C ATOM 321 OG SER A 20 31.258 43.544 15.928 1.00 0.00 O ATOM 0 H SER A 20 31.541 43.887 18.305 1.00 0.00 H new ATOM 0 HA SER A 20 32.378 41.180 18.051 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.369 41.500 15.763 1.00 0.00 H new ATOM 0 HB3 SER A 20 30.289 42.092 17.010 1.00 0.00 H new ATOM 0 HG SER A 20 30.533 43.600 15.271 1.00 0.00 H new ATOM 327 N ASP A 21 34.566 43.216 17.195 1.00 0.00 N ATOM 328 CA ASP A 21 35.873 43.404 16.598 1.00 0.00 C ATOM 329 C ASP A 21 36.883 42.389 17.137 1.00 0.00 C ATOM 330 O ASP A 21 36.792 41.916 18.268 1.00 0.00 O ATOM 331 CB ASP A 21 36.329 44.851 16.759 1.00 0.00 C ATOM 332 CG ASP A 21 37.296 45.322 15.672 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.713 44.514 14.814 1.00 0.00 O ATOM 334 OD2 ASP A 21 37.584 46.537 15.602 1.00 0.00 O ATOM 0 H ASP A 21 34.352 43.898 17.922 1.00 0.00 H new ATOM 0 HA ASP A 21 35.803 43.213 15.527 1.00 0.00 H new ATOM 0 HB2 ASP A 21 35.453 45.500 16.758 1.00 0.00 H new ATOM 0 HB3 ASP A 21 36.808 44.964 17.731 1.00 0.00 H new ATOM 339 N THR A 22 37.852 42.026 16.302 1.00 0.00 N ATOM 340 CA THR A 22 38.799 40.951 16.528 1.00 0.00 C ATOM 341 C THR A 22 40.059 41.430 17.250 1.00 0.00 C ATOM 342 O THR A 22 40.539 42.536 17.012 1.00 0.00 O ATOM 343 CB THR A 22 39.168 40.246 15.226 1.00 0.00 C ATOM 344 OG1 THR A 22 39.554 41.172 14.234 1.00 0.00 O ATOM 345 CG2 THR A 22 37.993 39.453 14.662 1.00 0.00 C ATOM 0 H THR A 22 38.001 42.498 15.410 1.00 0.00 H new ATOM 0 HA THR A 22 38.299 40.233 17.178 1.00 0.00 H new ATOM 0 HB THR A 22 39.993 39.577 15.471 1.00 0.00 H new ATOM 0 HG1 THR A 22 39.786 40.692 13.412 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.295 38.965 13.735 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.683 38.698 15.385 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.161 40.128 14.463 1.00 0.00 H new ATOM 353 N ILE A 23 40.646 40.585 18.094 1.00 0.00 N ATOM 354 CA ILE A 23 41.875 40.903 18.792 1.00 0.00 C ATOM 355 C ILE A 23 43.019 41.144 17.806 1.00 0.00 C ATOM 356 O ILE A 23 43.810 42.068 17.985 1.00 0.00 O ATOM 357 CB ILE A 23 42.215 39.810 19.801 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.115 39.544 20.825 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.534 40.079 20.519 1.00 0.00 C ATOM 360 CD1 ILE A 23 40.622 40.749 21.620 1.00 0.00 C ATOM 0 H ILE A 23 40.276 39.659 18.309 1.00 0.00 H new ATOM 0 HA ILE A 23 41.729 41.830 19.346 1.00 0.00 H new ATOM 0 HB ILE A 23 42.314 38.908 19.198 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.263 39.106 20.305 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.478 38.795 21.529 1.00 0.00 H new ATOM 0 HG21 ILE A 23 43.734 39.274 21.227 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.342 40.129 19.789 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.470 41.026 21.055 1.00 0.00 H new ATOM 0 HD11 ILE A 23 39.842 40.433 22.313 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.452 41.180 22.179 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.219 41.496 20.936 1.00 0.00 H new ATOM 372 N GLU A 24 43.065 40.387 16.713 1.00 0.00 N ATOM 373 CA GLU A 24 43.978 40.593 15.606 1.00 0.00 C ATOM 374 C GLU A 24 43.838 41.978 14.971 1.00 0.00 C ATOM 375 O GLU A 24 44.846 42.652 14.772 1.00 0.00 O ATOM 376 CB GLU A 24 43.715 39.467 14.610 1.00 0.00 C ATOM 377 CG GLU A 24 44.569 39.497 13.345 1.00 0.00 C ATOM 378 CD GLU A 24 44.169 38.370 12.391 1.00 0.00 C ATOM 379 OE1 GLU A 24 42.959 38.203 12.128 1.00 0.00 O ATOM 380 OE2 GLU A 24 45.062 37.657 11.884 1.00 0.00 O ATOM 0 H GLU A 24 42.445 39.589 16.575 1.00 0.00 H new ATOM 0 HA GLU A 24 45.010 40.564 15.957 1.00 0.00 H new ATOM 0 HB2 GLU A 24 43.877 38.514 15.114 1.00 0.00 H new ATOM 0 HB3 GLU A 24 42.665 39.500 14.320 1.00 0.00 H new ATOM 0 HG2 GLU A 24 44.454 40.459 12.846 1.00 0.00 H new ATOM 0 HG3 GLU A 24 45.622 39.399 13.609 1.00 0.00 H new ATOM 387 N ASN A 25 42.624 42.462 14.722 1.00 0.00 N ATOM 388 CA ASN A 25 42.415 43.813 14.241 1.00 0.00 C ATOM 389 C ASN A 25 42.789 44.869 15.283 1.00 0.00 C ATOM 390 O ASN A 25 43.391 45.880 14.926 1.00 0.00 O ATOM 391 CB ASN A 25 40.978 43.994 13.761 1.00 0.00 C ATOM 392 CG ASN A 25 40.729 45.341 13.079 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.555 45.875 12.342 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.554 45.937 13.264 1.00 0.00 N ATOM 0 H ASN A 25 41.765 41.927 14.849 1.00 0.00 H new ATOM 0 HA ASN A 25 43.085 43.963 13.395 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.732 43.192 13.065 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.304 43.896 14.612 1.00 0.00 H new ATOM 0 HD21 ASN A 25 39.352 46.821 12.798 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.855 45.509 13.872 1.00 0.00 H new ATOM 401 N VAL A 26 42.518 44.652 16.567 1.00 0.00 N ATOM 402 CA VAL A 26 42.962 45.535 17.626 1.00 0.00 C ATOM 403 C VAL A 26 44.487 45.654 17.650 1.00 0.00 C ATOM 404 O VAL A 26 45.017 46.761 17.709 1.00 0.00 O ATOM 405 CB VAL A 26 42.395 45.106 18.977 1.00 0.00 C ATOM 406 CG1 VAL A 26 42.987 45.875 20.154 1.00 0.00 C ATOM 407 CG2 VAL A 26 40.886 45.331 19.007 1.00 0.00 C ATOM 0 H VAL A 26 41.980 43.851 16.898 1.00 0.00 H new ATOM 0 HA VAL A 26 42.571 46.531 17.418 1.00 0.00 H new ATOM 0 HB VAL A 26 42.654 44.053 19.083 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.540 45.520 21.082 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.065 45.717 20.187 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.780 46.938 20.035 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.491 45.022 19.975 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.673 46.388 18.849 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.415 44.744 18.219 1.00 0.00 H new ATOM 417 N LYS A 27 45.213 44.550 17.490 1.00 0.00 N ATOM 418 CA LYS A 27 46.658 44.551 17.395 1.00 0.00 C ATOM 419 C LYS A 27 47.153 45.266 16.136 1.00 0.00 C ATOM 420 O LYS A 27 48.112 46.030 16.213 1.00 0.00 O ATOM 421 CB LYS A 27 47.172 43.117 17.501 1.00 0.00 C ATOM 422 CG LYS A 27 46.980 42.554 18.906 1.00 0.00 C ATOM 423 CD LYS A 27 47.184 41.045 19.011 1.00 0.00 C ATOM 424 CE LYS A 27 48.585 40.618 18.581 1.00 0.00 C ATOM 425 NZ LYS A 27 48.843 39.199 18.867 1.00 0.00 N ATOM 0 H LYS A 27 44.801 43.619 17.423 1.00 0.00 H new ATOM 0 HA LYS A 27 47.067 45.123 18.228 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.648 42.488 16.782 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.230 43.089 17.238 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.676 43.051 19.582 1.00 0.00 H new ATOM 0 HG3 LYS A 27 45.974 42.798 19.248 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.010 40.728 20.039 1.00 0.00 H new ATOM 0 HD3 LYS A 27 46.445 40.537 18.391 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.707 40.800 17.513 1.00 0.00 H new ATOM 0 HE3 LYS A 27 49.324 41.231 19.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 49.798 39.093 19.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.143 38.850 19.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 48.770 38.649 17.987 1.00 0.00 H new ATOM 439 N ALA A 28 46.472 45.107 15.005 1.00 0.00 N ATOM 440 CA ALA A 28 46.761 45.838 13.788 1.00 0.00 C ATOM 441 C ALA A 28 46.445 47.332 13.877 1.00 0.00 C ATOM 442 O ALA A 28 47.159 48.130 13.273 1.00 0.00 O ATOM 443 CB ALA A 28 46.019 45.174 12.630 1.00 0.00 C ATOM 0 H ALA A 28 45.693 44.455 14.913 1.00 0.00 H new ATOM 0 HA ALA A 28 47.837 45.793 13.619 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.228 45.714 11.707 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.352 44.141 12.529 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.947 45.192 12.827 1.00 0.00 H new ATOM 449 N LYS A 29 45.443 47.733 14.654 1.00 0.00 N ATOM 450 CA LYS A 29 45.091 49.110 14.937 1.00 0.00 C ATOM 451 C LYS A 29 46.137 49.808 15.809 1.00 0.00 C ATOM 452 O LYS A 29 46.413 50.982 15.575 1.00 0.00 O ATOM 453 CB LYS A 29 43.726 49.183 15.613 1.00 0.00 C ATOM 454 CG LYS A 29 42.558 49.076 14.636 1.00 0.00 C ATOM 455 CD LYS A 29 41.235 48.978 15.391 1.00 0.00 C ATOM 456 CE LYS A 29 40.077 49.075 14.402 1.00 0.00 C ATOM 457 NZ LYS A 29 38.766 48.967 15.058 1.00 0.00 N ATOM 0 H LYS A 29 44.828 47.069 15.124 1.00 0.00 H new ATOM 0 HA LYS A 29 45.054 49.632 13.981 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.650 48.382 16.348 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.649 50.124 16.158 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.545 49.946 13.979 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.687 48.199 14.001 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.184 48.035 15.936 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.165 49.777 16.129 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.136 50.025 13.870 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.173 48.285 13.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.017 49.206 14.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.627 47.994 15.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.725 49.624 15.863 1.00 0.00 H new ATOM 471 N ILE A 30 46.740 49.102 16.762 1.00 0.00 N ATOM 472 CA ILE A 30 47.870 49.607 17.516 1.00 0.00 C ATOM 473 C ILE A 30 49.072 49.772 16.584 1.00 0.00 C ATOM 474 O ILE A 30 49.668 50.847 16.576 1.00 0.00 O ATOM 475 CB ILE A 30 48.220 48.736 18.720 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.057 48.562 19.692 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.394 49.348 19.480 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.222 47.345 20.597 1.00 0.00 C ATOM 0 H ILE A 30 46.453 48.160 17.029 1.00 0.00 H new ATOM 0 HA ILE A 30 47.588 50.578 17.924 1.00 0.00 H new ATOM 0 HB ILE A 30 48.475 47.753 18.323 1.00 0.00 H new ATOM 0 HG12 ILE A 30 46.966 49.457 20.307 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.129 48.467 19.128 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.638 48.721 20.338 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.259 49.414 18.821 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.124 50.346 19.825 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.366 47.271 21.267 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.284 46.444 19.987 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.134 47.449 21.184 1.00 0.00 H new ATOM 490 N GLN A 31 49.392 48.783 15.755 1.00 0.00 N ATOM 491 CA GLN A 31 50.454 48.867 14.774 1.00 0.00 C ATOM 492 C GLN A 31 50.300 50.086 13.862 1.00 0.00 C ATOM 493 O GLN A 31 51.268 50.817 13.660 1.00 0.00 O ATOM 494 CB GLN A 31 50.501 47.581 13.954 1.00 0.00 C ATOM 495 CG GLN A 31 51.627 47.571 12.926 1.00 0.00 C ATOM 496 CD GLN A 31 51.545 46.416 11.926 1.00 0.00 C ATOM 497 OE1 GLN A 31 50.487 45.861 11.641 1.00 0.00 O ATOM 498 NE2 GLN A 31 52.680 46.003 11.369 1.00 0.00 N ATOM 0 H GLN A 31 48.907 47.886 15.751 1.00 0.00 H new ATOM 0 HA GLN A 31 51.396 48.989 15.309 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.623 46.732 14.627 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.548 47.448 13.442 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.614 48.514 12.379 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.582 47.519 13.449 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.560 46.462 11.604 1.00 0.00 H new ATOM 0 HE22 GLN A 31 52.670 45.227 10.707 1.00 0.00 H new ATOM 507 N ASP A 32 49.101 50.349 13.350 1.00 0.00 N ATOM 508 CA ASP A 32 48.818 51.476 12.485 1.00 0.00 C ATOM 509 C ASP A 32 49.065 52.840 13.134 1.00 0.00 C ATOM 510 O ASP A 32 49.299 53.819 12.429 1.00 0.00 O ATOM 511 CB ASP A 32 47.375 51.353 12.004 1.00 0.00 C ATOM 512 CG ASP A 32 47.021 52.401 10.946 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.621 52.374 9.850 1.00 0.00 O ATOM 514 OD2 ASP A 32 46.119 53.235 11.177 1.00 0.00 O ATOM 0 H ASP A 32 48.284 49.767 13.533 1.00 0.00 H new ATOM 0 HA ASP A 32 49.516 51.437 11.648 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.216 50.357 11.592 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.701 51.457 12.854 1.00 0.00 H new ATOM 519 N LYS A 33 49.055 52.917 14.461 1.00 0.00 N ATOM 520 CA LYS A 33 49.358 54.109 15.229 1.00 0.00 C ATOM 521 C LYS A 33 50.806 54.163 15.720 1.00 0.00 C ATOM 522 O LYS A 33 51.417 55.227 15.645 1.00 0.00 O ATOM 523 CB LYS A 33 48.363 54.251 16.377 1.00 0.00 C ATOM 524 CG LYS A 33 46.932 54.483 15.897 1.00 0.00 C ATOM 525 CD LYS A 33 45.932 54.658 17.035 1.00 0.00 C ATOM 526 CE LYS A 33 46.107 55.937 17.848 1.00 0.00 C ATOM 527 NZ LYS A 33 45.718 57.140 17.097 1.00 0.00 N ATOM 0 H LYS A 33 48.826 52.116 15.050 1.00 0.00 H new ATOM 0 HA LYS A 33 49.253 54.963 14.560 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.394 53.351 16.991 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.667 55.082 17.014 1.00 0.00 H new ATOM 0 HG2 LYS A 33 46.909 55.369 15.263 1.00 0.00 H new ATOM 0 HG3 LYS A 33 46.623 53.640 15.278 1.00 0.00 H new ATOM 0 HD2 LYS A 33 44.924 54.643 16.620 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.013 53.803 17.706 1.00 0.00 H new ATOM 0 HE2 LYS A 33 45.509 55.871 18.757 1.00 0.00 H new ATOM 0 HE3 LYS A 33 47.148 56.027 18.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 45.856 57.981 17.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 46.306 57.221 16.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.717 57.070 16.823 1.00 0.00 H new ATOM 541 N GLU A 34 51.372 53.058 16.196 1.00 0.00 N ATOM 542 CA GLU A 34 52.591 53.010 16.978 1.00 0.00 C ATOM 543 C GLU A 34 53.737 52.214 16.353 1.00 0.00 C ATOM 544 O GLU A 34 54.817 52.150 16.937 1.00 0.00 O ATOM 545 CB GLU A 34 52.269 52.470 18.368 1.00 0.00 C ATOM 546 CG GLU A 34 51.367 53.365 19.211 1.00 0.00 C ATOM 547 CD GLU A 34 52.091 54.624 19.694 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.883 54.551 20.658 1.00 0.00 O ATOM 549 OE2 GLU A 34 51.861 55.725 19.147 1.00 0.00 O ATOM 0 H GLU A 34 50.971 52.134 16.037 1.00 0.00 H new ATOM 0 HA GLU A 34 52.960 54.035 17.023 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.793 51.495 18.262 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.204 52.311 18.906 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.493 53.652 18.626 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.003 52.804 20.072 1.00 0.00 H new ATOM 556 N GLY A 35 53.561 51.581 15.196 1.00 0.00 N ATOM 557 CA GLY A 35 54.620 50.925 14.455 1.00 0.00 C ATOM 558 C GLY A 35 55.144 49.597 15.003 1.00 0.00 C ATOM 559 O GLY A 35 55.805 48.867 14.267 1.00 0.00 O ATOM 0 H GLY A 35 52.651 51.512 14.741 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.264 50.753 13.439 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.460 51.616 14.386 1.00 0.00 H new ATOM 563 N ILE A 36 54.817 49.242 16.242 1.00 0.00 N ATOM 564 CA ILE A 36 55.185 47.992 16.875 1.00 0.00 C ATOM 565 C ILE A 36 54.274 46.882 16.348 1.00 0.00 C ATOM 566 O ILE A 36 53.064 46.991 16.526 1.00 0.00 O ATOM 567 CB ILE A 36 55.138 48.142 18.393 1.00 0.00 C ATOM 568 CG1 ILE A 36 56.192 49.135 18.876 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.309 46.801 19.101 1.00 0.00 C ATOM 570 CD1 ILE A 36 56.108 49.484 20.359 1.00 0.00 C ATOM 0 H ILE A 36 54.266 49.846 16.852 1.00 0.00 H new ATOM 0 HA ILE A 36 56.210 47.718 16.627 1.00 0.00 H new ATOM 0 HB ILE A 36 54.151 48.529 18.647 1.00 0.00 H new ATOM 0 HG12 ILE A 36 57.180 48.724 18.669 1.00 0.00 H new ATOM 0 HG13 ILE A 36 56.100 50.053 18.295 1.00 0.00 H new ATOM 0 HG21 ILE A 36 55.270 46.952 20.180 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.508 46.126 18.799 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.271 46.367 18.830 1.00 0.00 H new ATOM 0 HD11 ILE A 36 56.895 50.195 20.611 1.00 0.00 H new ATOM 0 HD12 ILE A 36 55.136 49.928 20.574 1.00 0.00 H new ATOM 0 HD13 ILE A 36 56.233 48.579 20.953 1.00 0.00 H new ATOM 582 N PRO A 37 54.796 45.840 15.705 1.00 0.00 N ATOM 583 CA PRO A 37 54.010 44.895 14.939 1.00 0.00 C ATOM 584 C PRO A 37 53.203 43.911 15.790 1.00 0.00 C ATOM 585 O PRO A 37 53.574 43.658 16.934 1.00 0.00 O ATOM 586 CB PRO A 37 54.997 44.180 14.022 1.00 0.00 C ATOM 587 CG PRO A 37 56.283 44.188 14.844 1.00 0.00 C ATOM 588 CD PRO A 37 56.205 45.550 15.531 1.00 0.00 C ATOM 0 HA PRO A 37 53.242 45.427 14.378 1.00 0.00 H new ATOM 0 HB2 PRO A 37 54.672 43.166 13.789 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.120 44.702 13.073 1.00 0.00 H new ATOM 0 HG2 PRO A 37 56.314 43.369 15.562 1.00 0.00 H new ATOM 0 HG3 PRO A 37 57.170 44.096 14.217 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.719 45.530 16.492 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.688 46.318 14.927 1.00 0.00 H new ATOM 596 N PRO A 38 52.138 43.311 15.265 1.00 0.00 N ATOM 597 CA PRO A 38 51.215 42.497 16.029 1.00 0.00 C ATOM 598 C PRO A 38 51.815 41.329 16.814 1.00 0.00 C ATOM 599 O PRO A 38 51.370 41.063 17.928 1.00 0.00 O ATOM 600 CB PRO A 38 50.181 41.985 15.029 1.00 0.00 C ATOM 601 CG PRO A 38 50.124 43.113 14.002 1.00 0.00 C ATOM 602 CD PRO A 38 51.586 43.546 13.946 1.00 0.00 C ATOM 0 HA PRO A 38 50.801 43.128 16.816 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.486 41.041 14.578 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.212 41.815 15.499 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.761 42.769 13.034 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.468 43.924 14.319 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.130 42.978 13.191 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.668 44.598 13.673 1.00 0.00 H new ATOM 610 N ASP A 39 52.857 40.669 16.315 1.00 0.00 N ATOM 611 CA ASP A 39 53.523 39.593 17.019 1.00 0.00 C ATOM 612 C ASP A 39 54.304 40.038 18.257 1.00 0.00 C ATOM 613 O ASP A 39 54.697 39.207 19.073 1.00 0.00 O ATOM 614 CB ASP A 39 54.404 38.819 16.042 1.00 0.00 C ATOM 615 CG ASP A 39 55.597 39.631 15.535 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.391 40.584 14.752 1.00 0.00 O ATOM 617 OD2 ASP A 39 56.740 39.253 15.872 1.00 0.00 O ATOM 0 H ASP A 39 53.262 40.873 15.401 1.00 0.00 H new ATOM 0 HA ASP A 39 52.744 38.940 17.412 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.769 37.915 16.529 1.00 0.00 H new ATOM 0 HB3 ASP A 39 53.801 38.502 15.191 1.00 0.00 H new ATOM 622 N GLN A 40 54.520 41.340 18.423 1.00 0.00 N ATOM 623 CA GLN A 40 55.025 41.962 19.630 1.00 0.00 C ATOM 624 C GLN A 40 53.898 42.518 20.503 1.00 0.00 C ATOM 625 O GLN A 40 54.101 42.763 21.691 1.00 0.00 O ATOM 626 CB GLN A 40 56.032 43.046 19.257 1.00 0.00 C ATOM 627 CG GLN A 40 57.242 42.505 18.498 1.00 0.00 C ATOM 628 CD GLN A 40 58.211 43.587 18.018 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.209 44.734 18.459 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.084 43.252 17.072 1.00 0.00 N ATOM 0 H GLN A 40 54.337 42.016 17.681 1.00 0.00 H new ATOM 0 HA GLN A 40 55.527 41.202 20.228 1.00 0.00 H new ATOM 0 HB2 GLN A 40 55.535 43.800 18.647 1.00 0.00 H new ATOM 0 HB3 GLN A 40 56.373 43.544 20.164 1.00 0.00 H new ATOM 0 HG2 GLN A 40 57.780 41.809 19.142 1.00 0.00 H new ATOM 0 HG3 GLN A 40 56.893 41.936 17.636 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.093 42.302 16.700 1.00 0.00 H new ATOM 0 HE22 GLN A 40 59.744 43.945 16.719 1.00 0.00 H new ATOM 639 N GLN A 41 52.693 42.682 19.966 1.00 0.00 N ATOM 640 CA GLN A 41 51.527 43.198 20.656 1.00 0.00 C ATOM 641 C GLN A 41 50.847 42.135 21.520 1.00 0.00 C ATOM 642 O GLN A 41 49.728 41.714 21.236 1.00 0.00 O ATOM 643 CB GLN A 41 50.548 43.842 19.678 1.00 0.00 C ATOM 644 CG GLN A 41 51.053 45.097 18.975 1.00 0.00 C ATOM 645 CD GLN A 41 51.258 46.274 19.931 1.00 0.00 C ATOM 646 OE1 GLN A 41 50.788 46.294 21.067 1.00 0.00 O ATOM 647 NE2 GLN A 41 52.004 47.293 19.513 1.00 0.00 N ATOM 0 H GLN A 41 52.499 42.446 18.993 1.00 0.00 H new ATOM 0 HA GLN A 41 51.875 43.975 21.337 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.280 43.105 18.921 1.00 0.00 H new ATOM 0 HB3 GLN A 41 49.634 44.091 20.217 1.00 0.00 H new ATOM 0 HG2 GLN A 41 51.996 44.873 18.475 1.00 0.00 H new ATOM 0 HG3 GLN A 41 50.342 45.384 18.200 1.00 0.00 H new ATOM 0 HE21 GLN A 41 52.398 47.285 18.572 1.00 0.00 H new ATOM 0 HE22 GLN A 41 52.182 48.083 20.133 1.00 0.00 H new ATOM 656 N ARG A 42 51.484 41.718 22.611 1.00 0.00 N ATOM 657 CA ARG A 42 50.814 40.940 23.633 1.00 0.00 C ATOM 658 C ARG A 42 50.001 41.867 24.539 1.00 0.00 C ATOM 659 O ARG A 42 50.502 42.925 24.915 1.00 0.00 O ATOM 660 CB ARG A 42 51.761 40.033 24.413 1.00 0.00 C ATOM 661 CG ARG A 42 52.487 39.059 23.490 1.00 0.00 C ATOM 662 CD ARG A 42 53.059 37.860 24.242 1.00 0.00 C ATOM 663 NE ARG A 42 52.041 36.863 24.578 1.00 0.00 N ATOM 664 CZ ARG A 42 51.616 35.864 23.793 1.00 0.00 C ATOM 665 NH1 ARG A 42 51.989 35.736 22.512 1.00 0.00 N ATOM 666 NH2 ARG A 42 50.782 34.949 24.304 1.00 0.00 N ATOM 0 H ARG A 42 52.467 41.910 22.805 1.00 0.00 H new ATOM 0 HA ARG A 42 50.126 40.256 23.137 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.490 40.641 24.949 1.00 0.00 H new ATOM 0 HB3 ARG A 42 51.199 39.476 25.162 1.00 0.00 H new ATOM 0 HG2 ARG A 42 51.797 38.708 22.723 1.00 0.00 H new ATOM 0 HG3 ARG A 42 53.295 39.582 22.978 1.00 0.00 H new ATOM 0 HD2 ARG A 42 53.833 37.392 23.634 1.00 0.00 H new ATOM 0 HD3 ARG A 42 53.538 38.206 25.158 1.00 0.00 H new ATOM 0 HE ARG A 42 51.613 36.936 25.501 1.00 0.00 H new ATOM 0 HH11 ARG A 42 52.624 36.417 22.095 1.00 0.00 H new ATOM 0 HH12 ARG A 42 51.638 34.957 21.954 1.00 0.00 H new ATOM 0 HH21 ARG A 42 50.481 35.020 25.276 1.00 0.00 H new ATOM 0 HH22 ARG A 42 50.448 34.181 23.721 1.00 0.00 H new ATOM 680 N LEU A 43 48.766 41.486 24.853 1.00 0.00 N ATOM 681 CA LEU A 43 47.778 42.317 25.510 1.00 0.00 C ATOM 682 C LEU A 43 47.038 41.538 26.601 1.00 0.00 C ATOM 683 O LEU A 43 46.646 40.393 26.392 1.00 0.00 O ATOM 684 CB LEU A 43 46.780 42.847 24.484 1.00 0.00 C ATOM 685 CG LEU A 43 47.343 43.779 23.416 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.270 44.059 22.367 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.799 45.117 23.992 1.00 0.00 C ATOM 0 H LEU A 43 48.418 40.550 24.645 1.00 0.00 H new ATOM 0 HA LEU A 43 48.296 43.153 25.980 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.316 41.996 23.986 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.989 43.375 25.017 1.00 0.00 H new ATOM 0 HG LEU A 43 48.207 43.277 22.980 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.672 44.725 21.604 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.960 43.122 21.904 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.410 44.530 22.843 1.00 0.00 H new ATOM 0 HD21 LEU A 43 48.191 45.743 23.191 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.953 45.618 24.463 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.579 44.947 24.734 1.00 0.00 H new ATOM 699 N ILE A 44 46.831 42.185 27.745 1.00 0.00 N ATOM 700 CA ILE A 44 46.177 41.651 28.923 1.00 0.00 C ATOM 701 C ILE A 44 44.938 42.477 29.269 1.00 0.00 C ATOM 702 O ILE A 44 45.003 43.704 29.305 1.00 0.00 O ATOM 703 CB ILE A 44 47.155 41.567 30.091 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.342 40.645 29.826 1.00 0.00 C ATOM 705 CG2 ILE A 44 46.464 41.055 31.353 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.554 41.322 29.193 1.00 0.00 C ATOM 0 H ILE A 44 47.135 43.150 27.876 1.00 0.00 H new ATOM 0 HA ILE A 44 45.842 40.636 28.710 1.00 0.00 H new ATOM 0 HB ILE A 44 47.519 42.586 30.221 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.649 40.192 30.769 1.00 0.00 H new ATOM 0 HG13 ILE A 44 48.015 39.835 29.174 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.186 41.006 32.168 1.00 0.00 H new ATOM 0 HG22 ILE A 44 45.655 41.733 31.625 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.058 40.061 31.167 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.345 40.587 29.044 1.00 0.00 H new ATOM 0 HD12 ILE A 44 49.271 41.751 28.232 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.914 42.113 29.851 1.00 0.00 H new ATOM 718 N PHE A 45 43.826 41.814 29.573 1.00 0.00 N ATOM 719 CA PHE A 45 42.642 42.387 30.181 1.00 0.00 C ATOM 720 C PHE A 45 42.392 41.746 31.547 1.00 0.00 C ATOM 721 O PHE A 45 42.194 40.536 31.627 1.00 0.00 O ATOM 722 CB PHE A 45 41.431 42.197 29.273 1.00 0.00 C ATOM 723 CG PHE A 45 40.139 42.771 29.805 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.066 44.117 30.182 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.004 41.960 29.922 1.00 0.00 C ATOM 726 CE1 PHE A 45 38.870 44.650 30.677 1.00 0.00 C ATOM 727 CE2 PHE A 45 37.802 42.493 30.403 1.00 0.00 C ATOM 728 CZ PHE A 45 37.733 43.839 30.783 1.00 0.00 C ATOM 0 H PHE A 45 43.727 40.815 29.391 1.00 0.00 H new ATOM 0 HA PHE A 45 42.802 43.456 30.320 1.00 0.00 H new ATOM 0 HB2 PHE A 45 41.644 42.655 28.307 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.292 41.130 29.096 1.00 0.00 H new ATOM 0 HD1 PHE A 45 40.938 44.748 30.090 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.056 40.919 29.640 1.00 0.00 H new ATOM 0 HE1 PHE A 45 38.824 45.686 30.977 1.00 0.00 H new ATOM 0 HE2 PHE A 45 36.927 41.865 30.481 1.00 0.00 H new ATOM 0 HZ PHE A 45 36.807 44.250 31.156 1.00 0.00 H new ATOM 738 N ALA A 46 42.404 42.542 32.612 1.00 0.00 N ATOM 739 CA ALA A 46 42.162 42.112 33.974 1.00 0.00 C ATOM 740 C ALA A 46 42.909 40.836 34.367 1.00 0.00 C ATOM 741 O ALA A 46 42.339 39.902 34.927 1.00 0.00 O ATOM 742 CB ALA A 46 40.657 42.080 34.222 1.00 0.00 C ATOM 0 H ALA A 46 42.590 43.542 32.541 1.00 0.00 H new ATOM 0 HA ALA A 46 42.596 42.843 34.656 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.464 41.757 35.245 1.00 0.00 H new ATOM 0 HB2 ALA A 46 40.242 43.077 34.071 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.188 41.383 33.527 1.00 0.00 H new ATOM 748 N GLY A 47 44.195 40.763 34.038 1.00 0.00 N ATOM 749 CA GLY A 47 45.055 39.634 34.329 1.00 0.00 C ATOM 750 C GLY A 47 45.005 38.442 33.370 1.00 0.00 C ATOM 751 O GLY A 47 45.743 37.484 33.594 1.00 0.00 O ATOM 0 H GLY A 47 44.677 41.515 33.546 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.083 39.995 34.364 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.810 39.273 35.328 1.00 0.00 H new ATOM 755 N LYS A 48 44.201 38.462 32.312 1.00 0.00 N ATOM 756 CA LYS A 48 44.126 37.420 31.306 1.00 0.00 C ATOM 757 C LYS A 48 44.659 37.875 29.946 1.00 0.00 C ATOM 758 O LYS A 48 44.325 38.972 29.505 1.00 0.00 O ATOM 759 CB LYS A 48 42.683 36.932 31.223 1.00 0.00 C ATOM 760 CG LYS A 48 42.556 35.648 30.407 1.00 0.00 C ATOM 761 CD LYS A 48 41.177 35.017 30.584 1.00 0.00 C ATOM 762 CE LYS A 48 41.123 33.696 29.822 1.00 0.00 C ATOM 763 NZ LYS A 48 39.879 32.958 30.088 1.00 0.00 N ATOM 0 H LYS A 48 43.562 39.235 32.129 1.00 0.00 H new ATOM 0 HA LYS A 48 44.773 36.595 31.602 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.300 36.761 32.229 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.064 37.709 30.774 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.727 35.865 29.353 1.00 0.00 H new ATOM 0 HG3 LYS A 48 43.325 34.940 30.715 1.00 0.00 H new ATOM 0 HD2 LYS A 48 40.975 34.848 31.642 1.00 0.00 H new ATOM 0 HD3 LYS A 48 40.405 35.693 30.216 1.00 0.00 H new ATOM 0 HE2 LYS A 48 41.208 33.890 28.753 1.00 0.00 H new ATOM 0 HE3 LYS A 48 41.977 33.080 30.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 39.882 32.067 29.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 39.810 32.750 31.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 39.064 33.535 29.796 1.00 0.00 H new ATOM 777 N GLN A 49 45.461 37.056 29.270 1.00 0.00 N ATOM 778 CA GLN A 49 45.975 37.354 27.949 1.00 0.00 C ATOM 779 C GLN A 49 44.888 37.265 26.875 1.00 0.00 C ATOM 780 O GLN A 49 43.983 36.439 26.969 1.00 0.00 O ATOM 781 CB GLN A 49 47.146 36.444 27.588 1.00 0.00 C ATOM 782 CG GLN A 49 48.439 36.795 28.317 1.00 0.00 C ATOM 783 CD GLN A 49 49.615 35.946 27.827 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.200 36.195 26.776 1.00 0.00 O ATOM 785 NE2 GLN A 49 50.014 34.914 28.563 1.00 0.00 N ATOM 0 H GLN A 49 45.772 36.156 29.635 1.00 0.00 H new ATOM 0 HA GLN A 49 46.331 38.384 27.980 1.00 0.00 H new ATOM 0 HB2 GLN A 49 46.878 35.413 27.817 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.319 36.497 26.513 1.00 0.00 H new ATOM 0 HG2 GLN A 49 48.666 37.851 28.168 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.304 36.646 29.388 1.00 0.00 H new ATOM 0 HE21 GLN A 49 49.537 34.697 29.438 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.798 34.339 28.253 1.00 0.00 H new ATOM 794 N LEU A 50 45.007 38.083 25.834 1.00 0.00 N ATOM 795 CA LEU A 50 44.099 38.145 24.705 1.00 0.00 C ATOM 796 C LEU A 50 44.704 37.508 23.453 1.00 0.00 C ATOM 797 O LEU A 50 45.800 37.885 23.044 1.00 0.00 O ATOM 798 CB LEU A 50 43.708 39.596 24.444 1.00 0.00 C ATOM 799 CG LEU A 50 43.125 40.364 25.626 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.813 41.793 25.188 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.837 39.736 26.150 1.00 0.00 C ATOM 0 H LEU A 50 45.776 38.749 25.756 1.00 0.00 H new ATOM 0 HA LEU A 50 43.206 37.571 24.951 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.591 40.130 24.092 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.980 39.613 23.633 1.00 0.00 H new ATOM 0 HG LEU A 50 43.866 40.341 26.425 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.396 42.348 26.028 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.729 42.279 24.851 1.00 0.00 H new ATOM 0 HD13 LEU A 50 42.091 41.774 24.371 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.463 40.320 26.991 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.090 39.722 25.357 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.037 38.716 26.478 1.00 0.00 H new ATOM 813 N GLU A 51 43.991 36.577 22.825 1.00 0.00 N ATOM 814 CA GLU A 51 44.405 35.834 21.653 1.00 0.00 C ATOM 815 C GLU A 51 43.854 36.394 20.340 1.00 0.00 C ATOM 816 O GLU A 51 42.654 36.631 20.226 1.00 0.00 O ATOM 817 CB GLU A 51 43.962 34.380 21.795 1.00 0.00 C ATOM 818 CG GLU A 51 44.904 33.531 22.643 1.00 0.00 C ATOM 819 CD GLU A 51 46.217 33.220 21.924 1.00 0.00 C ATOM 820 OE1 GLU A 51 47.291 33.380 22.544 1.00 0.00 O ATOM 821 OE2 GLU A 51 46.194 32.775 20.756 1.00 0.00 O ATOM 0 H GLU A 51 43.059 36.311 23.143 1.00 0.00 H new ATOM 0 HA GLU A 51 45.490 35.919 21.602 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.966 34.355 22.238 1.00 0.00 H new ATOM 0 HB3 GLU A 51 43.881 33.936 20.803 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.119 34.053 23.575 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.408 32.597 22.907 1.00 0.00 H new ATOM 828 N ASP A 52 44.704 36.528 19.325 1.00 0.00 N ATOM 829 CA ASP A 52 44.386 37.013 17.997 1.00 0.00 C ATOM 830 C ASP A 52 43.077 36.486 17.406 1.00 0.00 C ATOM 831 O ASP A 52 42.280 37.269 16.894 1.00 0.00 O ATOM 832 CB ASP A 52 45.502 36.610 17.038 1.00 0.00 C ATOM 833 CG ASP A 52 46.789 37.418 17.211 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.795 36.877 17.718 1.00 0.00 O ATOM 835 OD2 ASP A 52 46.841 38.601 16.809 1.00 0.00 O ATOM 0 H ASP A 52 45.690 36.285 19.420 1.00 0.00 H new ATOM 0 HA ASP A 52 44.277 38.092 18.110 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.726 35.553 17.181 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.147 36.725 16.014 1.00 0.00 H new ATOM 840 N GLY A 53 42.835 35.180 17.483 1.00 0.00 N ATOM 841 CA GLY A 53 41.705 34.504 16.881 1.00 0.00 C ATOM 842 C GLY A 53 40.344 34.726 17.545 1.00 0.00 C ATOM 843 O GLY A 53 39.368 34.107 17.127 1.00 0.00 O ATOM 0 H GLY A 53 43.451 34.543 17.989 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.633 34.821 15.840 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.911 33.434 16.875 1.00 0.00 H new ATOM 847 N ARG A 54 40.257 35.583 18.558 1.00 0.00 N ATOM 848 CA ARG A 54 39.051 35.892 19.301 1.00 0.00 C ATOM 849 C ARG A 54 38.494 37.283 18.990 1.00 0.00 C ATOM 850 O ARG A 54 39.098 38.052 18.245 1.00 0.00 O ATOM 851 CB ARG A 54 39.346 35.708 20.787 1.00 0.00 C ATOM 852 CG ARG A 54 39.867 34.342 21.223 1.00 0.00 C ATOM 853 CD ARG A 54 39.192 33.104 20.638 1.00 0.00 C ATOM 854 NE ARG A 54 37.732 33.134 20.729 1.00 0.00 N ATOM 855 CZ ARG A 54 36.886 32.153 20.389 1.00 0.00 C ATOM 856 NH1 ARG A 54 37.304 30.945 19.986 1.00 0.00 N ATOM 857 NH2 ARG A 54 35.565 32.383 20.420 1.00 0.00 N ATOM 0 H ARG A 54 41.067 36.103 18.895 1.00 0.00 H new ATOM 0 HA ARG A 54 38.262 35.206 18.993 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.077 36.460 21.084 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.432 35.916 21.343 1.00 0.00 H new ATOM 0 HG2 ARG A 54 40.928 34.294 20.976 1.00 0.00 H new ATOM 0 HG3 ARG A 54 39.789 34.285 22.309 1.00 0.00 H new ATOM 0 HD2 ARG A 54 39.480 33.004 19.592 1.00 0.00 H new ATOM 0 HD3 ARG A 54 39.562 32.220 21.157 1.00 0.00 H new ATOM 0 HE ARG A 54 37.315 33.992 21.089 1.00 0.00 H new ATOM 0 HH11 ARG A 54 38.302 30.744 19.929 1.00 0.00 H new ATOM 0 HH12 ARG A 54 36.624 30.227 19.737 1.00 0.00 H new ATOM 0 HH21 ARG A 54 35.213 33.298 20.701 1.00 0.00 H new ATOM 0 HH22 ARG A 54 34.912 31.643 20.163 1.00 0.00 H new ATOM 871 N THR A 55 37.352 37.623 19.580 1.00 0.00 N ATOM 872 CA THR A 55 36.770 38.949 19.623 1.00 0.00 C ATOM 873 C THR A 55 36.887 39.590 21.008 1.00 0.00 C ATOM 874 O THR A 55 37.054 38.904 22.014 1.00 0.00 O ATOM 875 CB THR A 55 35.302 38.976 19.203 1.00 0.00 C ATOM 876 OG1 THR A 55 34.522 38.107 19.993 1.00 0.00 O ATOM 877 CG2 THR A 55 35.093 38.595 17.741 1.00 0.00 C ATOM 0 H THR A 55 36.779 36.935 20.068 1.00 0.00 H new ATOM 0 HA THR A 55 37.351 39.524 18.902 1.00 0.00 H new ATOM 0 HB THR A 55 34.985 40.009 19.347 1.00 0.00 H new ATOM 0 HG1 THR A 55 33.737 38.587 20.330 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.030 38.633 17.504 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.633 39.294 17.102 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.467 37.585 17.571 1.00 0.00 H new ATOM 885 N LEU A 56 36.717 40.907 21.081 1.00 0.00 N ATOM 886 CA LEU A 56 36.558 41.618 22.334 1.00 0.00 C ATOM 887 C LEU A 56 35.395 41.072 23.164 1.00 0.00 C ATOM 888 O LEU A 56 35.508 40.962 24.382 1.00 0.00 O ATOM 889 CB LEU A 56 36.364 43.102 22.036 1.00 0.00 C ATOM 890 CG LEU A 56 37.594 43.808 21.471 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.226 45.241 21.097 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.744 43.890 22.470 1.00 0.00 C ATOM 0 H LEU A 56 36.686 41.512 20.260 1.00 0.00 H new ATOM 0 HA LEU A 56 37.458 41.473 22.932 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.542 43.212 21.328 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.063 43.606 22.954 1.00 0.00 H new ATOM 0 HG LEU A 56 37.917 43.223 20.610 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.102 45.748 20.693 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.435 45.230 20.347 1.00 0.00 H new ATOM 0 HD13 LEU A 56 36.877 45.770 21.984 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.589 44.402 22.010 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.421 44.443 23.352 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.045 42.884 22.762 1.00 0.00 H new ATOM 904 N SER A 57 34.303 40.668 22.521 1.00 0.00 N ATOM 905 CA SER A 57 33.158 40.044 23.153 1.00 0.00 C ATOM 906 C SER A 57 33.404 38.656 23.745 1.00 0.00 C ATOM 907 O SER A 57 32.729 38.318 24.714 1.00 0.00 O ATOM 908 CB SER A 57 31.977 40.014 22.187 1.00 0.00 C ATOM 909 OG SER A 57 32.303 39.397 20.962 1.00 0.00 O ATOM 0 H SER A 57 34.193 40.772 21.512 1.00 0.00 H new ATOM 0 HA SER A 57 32.934 40.672 24.015 1.00 0.00 H new ATOM 0 HB2 SER A 57 31.146 39.482 22.649 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.638 41.033 21.999 1.00 0.00 H new ATOM 0 HG SER A 57 31.518 39.399 20.376 1.00 0.00 H new ATOM 915 N ASP A 58 34.377 37.879 23.274 1.00 0.00 N ATOM 916 CA ASP A 58 34.747 36.622 23.891 1.00 0.00 C ATOM 917 C ASP A 58 35.313 36.799 25.301 1.00 0.00 C ATOM 918 O ASP A 58 35.157 35.921 26.147 1.00 0.00 O ATOM 919 CB ASP A 58 35.799 35.893 23.059 1.00 0.00 C ATOM 920 CG ASP A 58 35.302 35.347 21.720 1.00 0.00 C ATOM 921 OD1 ASP A 58 34.199 34.763 21.638 1.00 0.00 O ATOM 922 OD2 ASP A 58 36.079 35.352 20.742 1.00 0.00 O ATOM 0 H ASP A 58 34.930 38.111 22.449 1.00 0.00 H new ATOM 0 HA ASP A 58 33.826 36.042 23.947 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.628 36.575 22.870 1.00 0.00 H new ATOM 0 HB3 ASP A 58 36.195 35.065 23.647 1.00 0.00 H new ATOM 927 N TYR A 59 35.942 37.942 25.557 1.00 0.00 N ATOM 928 CA TYR A 59 36.522 38.330 26.828 1.00 0.00 C ATOM 929 C TYR A 59 35.660 39.334 27.598 1.00 0.00 C ATOM 930 O TYR A 59 36.113 39.868 28.608 1.00 0.00 O ATOM 931 CB TYR A 59 37.929 38.870 26.585 1.00 0.00 C ATOM 932 CG TYR A 59 38.899 37.872 25.998 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.512 36.932 26.833 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.225 37.928 24.637 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.471 36.051 26.320 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.200 37.067 24.121 1.00 0.00 C ATOM 937 CZ TYR A 59 40.826 36.123 24.958 1.00 0.00 C ATOM 938 OH TYR A 59 41.803 35.316 24.452 1.00 0.00 O ATOM 0 H TYR A 59 36.065 38.658 24.841 1.00 0.00 H new ATOM 0 HA TYR A 59 36.571 37.446 27.463 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.863 39.728 25.916 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.332 39.234 27.530 1.00 0.00 H new ATOM 0 HD1 TYR A 59 39.244 36.886 27.878 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.726 38.633 23.988 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.936 35.320 26.964 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.473 37.127 23.078 1.00 0.00 H new ATOM 0 HH TYR A 59 41.428 34.754 23.742 1.00 0.00 H new ATOM 948 N ASN A 60 34.444 39.606 27.133 1.00 0.00 N ATOM 949 CA ASN A 60 33.524 40.563 27.712 1.00 0.00 C ATOM 950 C ASN A 60 34.112 41.960 27.924 1.00 0.00 C ATOM 951 O ASN A 60 33.819 42.625 28.914 1.00 0.00 O ATOM 952 CB ASN A 60 32.867 39.949 28.945 1.00 0.00 C ATOM 953 CG ASN A 60 31.563 40.629 29.367 1.00 0.00 C ATOM 954 OD1 ASN A 60 30.977 41.440 28.652 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.042 40.273 30.537 1.00 0.00 N ATOM 0 H ASN A 60 34.063 39.143 26.308 1.00 0.00 H new ATOM 0 HA ASN A 60 32.739 40.763 26.983 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.667 38.895 28.749 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.571 39.991 29.776 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.155 40.673 30.843 1.00 0.00 H new ATOM 0 HD22 ASN A 60 31.529 39.600 31.129 1.00 0.00 H new ATOM 962 N ILE A 61 34.952 42.419 27.001 1.00 0.00 N ATOM 963 CA ILE A 61 35.511 43.756 27.001 1.00 0.00 C ATOM 964 C ILE A 61 34.444 44.743 26.527 1.00 0.00 C ATOM 965 O ILE A 61 33.761 44.511 25.531 1.00 0.00 O ATOM 966 CB ILE A 61 36.795 43.819 26.179 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.883 42.944 26.794 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.304 45.253 26.066 1.00 0.00 C ATOM 969 CD1 ILE A 61 39.011 42.578 25.834 1.00 0.00 C ATOM 0 H ILE A 61 35.267 41.852 26.214 1.00 0.00 H new ATOM 0 HA ILE A 61 35.800 44.037 28.014 1.00 0.00 H new ATOM 0 HB ILE A 61 36.559 43.446 25.182 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.307 43.462 27.654 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.428 42.027 27.168 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.220 45.268 25.475 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.548 45.870 25.580 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.508 45.646 27.062 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.741 41.955 26.351 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.603 42.029 24.985 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.496 43.487 25.479 1.00 0.00 H new ATOM 981 N GLN A 62 34.301 45.851 27.251 1.00 0.00 N ATOM 982 CA GLN A 62 33.249 46.835 27.110 1.00 0.00 C ATOM 983 C GLN A 62 33.833 48.236 26.915 1.00 0.00 C ATOM 984 O GLN A 62 35.048 48.409 26.974 1.00 0.00 O ATOM 985 CB GLN A 62 32.346 46.744 28.338 1.00 0.00 C ATOM 986 CG GLN A 62 31.610 45.411 28.443 1.00 0.00 C ATOM 987 CD GLN A 62 30.877 45.192 29.769 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.725 46.084 30.601 1.00 0.00 O ATOM 989 NE2 GLN A 62 30.382 43.984 30.018 1.00 0.00 N ATOM 0 H GLN A 62 34.958 46.093 27.993 1.00 0.00 H new ATOM 0 HA GLN A 62 32.654 46.632 26.219 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.947 46.892 29.235 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.617 47.553 28.306 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.889 45.344 27.629 1.00 0.00 H new ATOM 0 HG3 GLN A 62 32.327 44.603 28.301 1.00 0.00 H new ATOM 0 HE21 GLN A 62 30.500 43.234 29.337 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.884 43.807 30.890 1.00 0.00 H new ATOM 998 N LYS A 63 33.003 49.251 26.693 1.00 0.00 N ATOM 999 CA LYS A 63 33.426 50.630 26.547 1.00 0.00 C ATOM 1000 C LYS A 63 34.324 51.121 27.683 1.00 0.00 C ATOM 1001 O LYS A 63 34.215 50.667 28.821 1.00 0.00 O ATOM 1002 CB LYS A 63 32.214 51.539 26.360 1.00 0.00 C ATOM 1003 CG LYS A 63 31.291 51.642 27.570 1.00 0.00 C ATOM 1004 CD LYS A 63 30.157 52.641 27.352 1.00 0.00 C ATOM 1005 CE LYS A 63 29.113 52.182 26.338 1.00 0.00 C ATOM 1006 NZ LYS A 63 28.108 51.285 26.928 1.00 0.00 N ATOM 0 H LYS A 63 31.994 49.129 26.608 1.00 0.00 H new ATOM 0 HA LYS A 63 34.045 50.673 25.651 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.565 52.539 26.104 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.635 51.177 25.510 1.00 0.00 H new ATOM 0 HG2 LYS A 63 30.870 50.660 27.788 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.872 51.940 28.443 1.00 0.00 H new ATOM 0 HD2 LYS A 63 29.664 52.830 28.306 1.00 0.00 H new ATOM 0 HD3 LYS A 63 30.580 53.589 27.019 1.00 0.00 H new ATOM 0 HE2 LYS A 63 28.613 53.054 25.916 1.00 0.00 H new ATOM 0 HE3 LYS A 63 29.612 51.671 25.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 27.423 51.003 26.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 28.578 50.438 27.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 27.611 51.778 27.697 1.00 0.00 H new ATOM 1020 N GLU A 64 35.217 52.053 27.363 1.00 0.00 N ATOM 1021 CA GLU A 64 36.168 52.674 28.263 1.00 0.00 C ATOM 1022 C GLU A 64 37.201 51.731 28.880 1.00 0.00 C ATOM 1023 O GLU A 64 38.016 52.165 29.692 1.00 0.00 O ATOM 1024 CB GLU A 64 35.411 53.498 29.302 1.00 0.00 C ATOM 1025 CG GLU A 64 36.138 54.710 29.878 1.00 0.00 C ATOM 1026 CD GLU A 64 36.087 55.953 28.989 1.00 0.00 C ATOM 1027 OE1 GLU A 64 35.823 55.848 27.771 1.00 0.00 O ATOM 1028 OE2 GLU A 64 36.287 57.069 29.517 1.00 0.00 O ATOM 0 H GLU A 64 35.296 52.412 26.412 1.00 0.00 H new ATOM 0 HA GLU A 64 36.790 53.334 27.659 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.480 53.842 28.851 1.00 0.00 H new ATOM 0 HB3 GLU A 64 35.141 52.839 30.127 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.704 54.953 30.848 1.00 0.00 H new ATOM 0 HG3 GLU A 64 37.181 54.445 30.053 1.00 0.00 H new ATOM 1035 N SER A 65 37.215 50.448 28.531 1.00 0.00 N ATOM 1036 CA SER A 65 38.113 49.468 29.110 1.00 0.00 C ATOM 1037 C SER A 65 39.587 49.758 28.819 1.00 0.00 C ATOM 1038 O SER A 65 39.940 50.247 27.748 1.00 0.00 O ATOM 1039 CB SER A 65 37.799 48.052 28.640 1.00 0.00 C ATOM 1040 OG SER A 65 36.503 47.659 29.034 1.00 0.00 O ATOM 0 H SER A 65 36.590 50.059 27.825 1.00 0.00 H new ATOM 0 HA SER A 65 37.948 49.544 30.185 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.884 47.999 27.555 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.533 47.359 29.051 1.00 0.00 H new ATOM 0 HG SER A 65 35.838 48.133 28.492 1.00 0.00 H new ATOM 1046 N THR A 66 40.449 49.388 29.762 1.00 0.00 N ATOM 1047 CA THR A 66 41.890 49.499 29.667 1.00 0.00 C ATOM 1048 C THR A 66 42.545 48.131 29.467 1.00 0.00 C ATOM 1049 O THR A 66 42.154 47.146 30.090 1.00 0.00 O ATOM 1050 CB THR A 66 42.489 50.198 30.884 1.00 0.00 C ATOM 1051 OG1 THR A 66 42.025 49.660 32.101 1.00 0.00 O ATOM 1052 CG2 THR A 66 42.165 51.688 30.929 1.00 0.00 C ATOM 0 H THR A 66 40.143 48.986 30.648 1.00 0.00 H new ATOM 0 HA THR A 66 42.098 50.113 28.791 1.00 0.00 H new ATOM 0 HB THR A 66 43.562 50.041 30.774 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.438 50.139 32.849 1.00 0.00 H new ATOM 0 HG21 THR A 66 42.617 52.132 31.816 1.00 0.00 H new ATOM 0 HG22 THR A 66 42.562 52.174 30.038 1.00 0.00 H new ATOM 0 HG23 THR A 66 41.084 51.824 30.966 1.00 0.00 H new ATOM 1060 N LEU A 67 43.554 48.081 28.602 1.00 0.00 N ATOM 1061 CA LEU A 67 44.384 46.927 28.320 1.00 0.00 C ATOM 1062 C LEU A 67 45.833 47.215 28.719 1.00 0.00 C ATOM 1063 O LEU A 67 46.322 48.330 28.544 1.00 0.00 O ATOM 1064 CB LEU A 67 44.294 46.543 26.846 1.00 0.00 C ATOM 1065 CG LEU A 67 42.899 46.198 26.329 1.00 0.00 C ATOM 1066 CD1 LEU A 67 42.979 45.768 24.867 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.266 45.057 27.120 1.00 0.00 C ATOM 0 H LEU A 67 43.825 48.895 28.050 1.00 0.00 H new ATOM 0 HA LEU A 67 44.021 46.084 28.908 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.687 47.368 26.251 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.946 45.687 26.673 1.00 0.00 H new ATOM 0 HG LEU A 67 42.286 47.092 26.442 1.00 0.00 H new ATOM 0 HD11 LEU A 67 41.981 45.523 24.505 1.00 0.00 H new ATOM 0 HD12 LEU A 67 43.392 46.581 24.271 1.00 0.00 H new ATOM 0 HD13 LEU A 67 43.621 44.892 24.780 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.275 44.843 26.720 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.890 44.167 27.038 1.00 0.00 H new ATOM 0 HD23 LEU A 67 42.180 45.344 28.168 1.00 0.00 H new ATOM 1079 N HIS A 68 46.520 46.195 29.226 1.00 0.00 N ATOM 1080 CA HIS A 68 47.847 46.269 29.801 1.00 0.00 C ATOM 1081 C HIS A 68 48.840 45.370 29.060 1.00 0.00 C ATOM 1082 O HIS A 68 48.445 44.477 28.314 1.00 0.00 O ATOM 1083 CB HIS A 68 47.741 45.884 31.274 1.00 0.00 C ATOM 1084 CG HIS A 68 46.842 46.776 32.087 1.00 0.00 C ATOM 1085 ND1 HIS A 68 45.573 46.453 32.564 1.00 0.00 N ATOM 1086 CD2 HIS A 68 47.165 48.041 32.507 1.00 0.00 C ATOM 1087 CE1 HIS A 68 45.163 47.515 33.261 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.089 48.488 33.247 1.00 0.00 N ATOM 0 H HIS A 68 46.141 45.248 29.245 1.00 0.00 H new ATOM 0 HA HIS A 68 48.231 47.284 29.705 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.375 44.860 31.344 1.00 0.00 H new ATOM 0 HB3 HIS A 68 48.739 45.897 31.713 1.00 0.00 H new ATOM 0 HD2 HIS A 68 48.078 48.579 32.300 1.00 0.00 H new ATOM 0 HE1 HIS A 68 44.212 47.583 33.769 1.00 0.00 H new ATOM 0 HE2 HIS A 68 46.011 49.397 33.703 1.00 0.00 H new ATOM 1096 N LEU A 69 50.135 45.566 29.291 1.00 0.00 N ATOM 1097 CA LEU A 69 51.197 44.714 28.797 1.00 0.00 C ATOM 1098 C LEU A 69 52.160 44.278 29.903 1.00 0.00 C ATOM 1099 O LEU A 69 52.266 44.931 30.939 1.00 0.00 O ATOM 1100 CB LEU A 69 51.874 45.362 27.593 1.00 0.00 C ATOM 1101 CG LEU A 69 52.743 46.589 27.857 1.00 0.00 C ATOM 1102 CD1 LEU A 69 54.168 46.230 28.268 1.00 0.00 C ATOM 1103 CD2 LEU A 69 52.863 47.417 26.581 1.00 0.00 C ATOM 0 H LEU A 69 50.479 46.350 29.846 1.00 0.00 H new ATOM 0 HA LEU A 69 50.761 43.780 28.444 1.00 0.00 H new ATOM 0 HB2 LEU A 69 52.493 44.608 27.107 1.00 0.00 H new ATOM 0 HB3 LEU A 69 51.098 45.644 26.881 1.00 0.00 H new ATOM 0 HG LEU A 69 52.257 47.133 28.667 1.00 0.00 H new ATOM 0 HD11 LEU A 69 54.737 47.143 28.442 1.00 0.00 H new ATOM 0 HD12 LEU A 69 54.145 45.637 29.182 1.00 0.00 H new ATOM 0 HD13 LEU A 69 54.641 45.653 27.474 1.00 0.00 H new ATOM 0 HD21 LEU A 69 53.484 48.292 26.772 1.00 0.00 H new ATOM 0 HD22 LEU A 69 53.319 46.813 25.797 1.00 0.00 H new ATOM 0 HD23 LEU A 69 51.872 47.738 26.261 1.00 0.00 H new ATOM 1115 N VAL A 70 52.895 43.195 29.664 1.00 0.00 N ATOM 1116 CA VAL A 70 53.958 42.679 30.503 1.00 0.00 C ATOM 1117 C VAL A 70 55.222 42.550 29.649 1.00 0.00 C ATOM 1118 O VAL A 70 55.218 41.845 28.641 1.00 0.00 O ATOM 1119 CB VAL A 70 53.554 41.339 31.109 1.00 0.00 C ATOM 1120 CG1 VAL A 70 54.666 40.643 31.889 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.372 41.490 32.061 1.00 0.00 C ATOM 0 H VAL A 70 52.751 42.626 28.830 1.00 0.00 H new ATOM 0 HA VAL A 70 54.152 43.359 31.332 1.00 0.00 H new ATOM 0 HB VAL A 70 53.298 40.727 30.244 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.295 39.698 32.286 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.510 40.452 31.227 1.00 0.00 H new ATOM 0 HG13 VAL A 70 54.988 41.281 32.712 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.111 40.516 32.474 1.00 0.00 H new ATOM 0 HG22 VAL A 70 52.642 42.168 32.871 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.517 41.895 31.519 1.00 0.00 H new