USER MOD reduce.3.24.130724 H: found=0, std=0, add=527, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 527 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 27 TYR OH : rot -22:sc= 0.651 USER MOD Set 1.2: A 56 CYS SG : rot -20:sc= 0.572 USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot -160:sc= 0 USER MOD Single : A 9 ASN : amide:sc= 0.246 K(o=0.25,f=-3.4!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 23:sc= 1.04 USER MOD Single : A 29 HIS : no HD1:sc= -0.109 X(o=-0.11,f=-0.11) USER MOD Single : A 31 MET CE :methyl 177:sc= -0.417 (180deg=-0.428) USER MOD Single : A 32 GLN : amide:sc= 0.322 K(o=0.32,f=-3.1!) USER MOD Single : A 34 ASN : amide:sc= -0.1 X(o=-0.1,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.18 K(o=-0.18,f=-2.9!) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 46 ASN : amide:sc= -0.255 K(o=-0.25,f=-8.4!) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 49 SER OG : rot -61:sc= 0.995 USER MOD Single : A 58 SER OG : rot -56:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 18.198 40.840 33.572 1.00 0.00 N ATOM 2 CA PRO A 1 19.403 41.545 33.068 1.00 0.00 C ATOM 3 C PRO A 1 19.912 40.953 31.748 1.00 0.00 C ATOM 4 O PRO A 1 19.403 39.937 31.287 1.00 0.00 O ATOM 5 CB PRO A 1 20.458 41.537 34.190 1.00 0.00 C ATOM 6 CG PRO A 1 19.770 40.856 35.374 1.00 0.00 C ATOM 7 CD PRO A 1 18.287 40.964 35.035 1.00 0.00 C ATOM 0 H2 PRO A 1 18.190 39.862 33.281 1.00 0.00 H new ATOM 0 H3 PRO A 1 17.342 41.264 33.214 1.00 0.00 H new ATOM 0 HA PRO A 1 19.158 42.578 32.821 1.00 0.00 H new ATOM 0 HB2 PRO A 1 21.353 40.993 33.887 1.00 0.00 H new ATOM 0 HB3 PRO A 1 20.771 42.549 34.444 1.00 0.00 H new ATOM 0 HG2 PRO A 1 20.083 39.817 35.477 1.00 0.00 H new ATOM 0 HG3 PRO A 1 20.004 41.354 36.315 1.00 0.00 H new ATOM 0 HD2 PRO A 1 17.715 40.179 35.529 1.00 0.00 H new ATOM 0 HD3 PRO A 1 17.878 41.916 35.372 1.00 0.00 H new ATOM 17 N LYS A 2 20.921 41.570 31.124 1.00 0.00 N ATOM 18 CA LYS A 2 21.548 41.070 29.889 1.00 0.00 C ATOM 19 C LYS A 2 23.073 41.003 30.014 1.00 0.00 C ATOM 20 O LYS A 2 23.689 41.758 30.761 1.00 0.00 O ATOM 21 CB LYS A 2 21.113 41.888 28.655 1.00 0.00 C ATOM 22 CG LYS A 2 19.600 41.886 28.345 1.00 0.00 C ATOM 23 CD LYS A 2 18.924 43.258 28.485 1.00 0.00 C ATOM 24 CE LYS A 2 18.966 43.758 29.926 1.00 0.00 C ATOM 25 NZ LYS A 2 18.272 45.050 30.085 1.00 0.00 N ATOM 0 H LYS A 2 21.332 42.440 31.463 1.00 0.00 H new ATOM 0 HA LYS A 2 21.192 40.050 29.740 1.00 0.00 H new ATOM 0 HB2 LYS A 2 21.434 42.920 28.795 1.00 0.00 H new ATOM 0 HB3 LYS A 2 21.644 41.505 27.783 1.00 0.00 H new ATOM 0 HG2 LYS A 2 19.450 41.522 27.329 1.00 0.00 H new ATOM 0 HG3 LYS A 2 19.105 41.180 29.012 1.00 0.00 H new ATOM 0 HD2 LYS A 2 19.421 43.978 27.835 1.00 0.00 H new ATOM 0 HD3 LYS A 2 17.888 43.190 28.152 1.00 0.00 H new ATOM 0 HE2 LYS A 2 18.506 43.017 30.580 1.00 0.00 H new ATOM 0 HE3 LYS A 2 20.004 43.863 30.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 18.325 45.352 31.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 18.726 45.765 29.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 17.275 44.945 29.808 1.00 0.00 H new ATOM 39 N SER A 3 23.664 40.071 29.277 1.00 0.00 N ATOM 40 CA SER A 3 25.098 39.802 29.186 1.00 0.00 C ATOM 41 C SER A 3 25.376 39.064 27.879 1.00 0.00 C ATOM 42 O SER A 3 24.524 38.296 27.425 1.00 0.00 O ATOM 43 CB SER A 3 25.507 38.885 30.342 1.00 0.00 C ATOM 44 OG SER A 3 26.912 38.732 30.392 1.00 0.00 O ATOM 0 H SER A 3 23.121 39.440 28.687 1.00 0.00 H new ATOM 0 HA SER A 3 25.653 40.739 29.227 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.149 39.299 31.284 1.00 0.00 H new ATOM 0 HB3 SER A 3 25.035 37.910 30.222 1.00 0.00 H new ATOM 0 HG SER A 3 27.135 37.926 30.903 1.00 0.00 H new ATOM 50 N ARG A 4 26.566 39.226 27.294 1.00 0.00 N ATOM 51 CA ARG A 4 27.037 38.362 26.204 1.00 0.00 C ATOM 52 C ARG A 4 28.399 37.750 26.501 1.00 0.00 C ATOM 53 O ARG A 4 29.201 38.315 27.239 1.00 0.00 O ATOM 54 CB ARG A 4 26.933 39.068 24.844 1.00 0.00 C ATOM 55 CG ARG A 4 28.087 40.021 24.497 1.00 0.00 C ATOM 56 CD ARG A 4 27.752 40.667 23.152 1.00 0.00 C ATOM 57 NE ARG A 4 28.912 41.256 22.460 1.00 0.00 N ATOM 58 CZ ARG A 4 28.845 41.775 21.250 1.00 0.00 C ATOM 59 NH1 ARG A 4 27.723 41.881 20.607 1.00 0.00 N ATOM 60 NH2 ARG A 4 29.917 42.161 20.633 1.00 0.00 N ATOM 0 H ARG A 4 27.228 39.955 27.560 1.00 0.00 H new ATOM 0 HA ARG A 4 26.366 37.506 26.135 1.00 0.00 H new ATOM 0 HB2 ARG A 4 26.867 38.308 24.065 1.00 0.00 H new ATOM 0 HB3 ARG A 4 26.001 39.632 24.819 1.00 0.00 H new ATOM 0 HG2 ARG A 4 28.204 40.781 25.270 1.00 0.00 H new ATOM 0 HG3 ARG A 4 29.030 39.478 24.438 1.00 0.00 H new ATOM 0 HD2 ARG A 4 27.299 39.917 22.504 1.00 0.00 H new ATOM 0 HD3 ARG A 4 27.005 41.444 23.311 1.00 0.00 H new ATOM 0 HE ARG A 4 29.811 41.262 22.941 1.00 0.00 H new ATOM 0 HH11 ARG A 4 26.856 41.558 21.037 1.00 0.00 H new ATOM 0 HH12 ARG A 4 27.708 42.288 19.672 1.00 0.00 H new ATOM 0 HH21 ARG A 4 30.827 42.065 21.083 1.00 0.00 H new ATOM 0 HH22 ARG A 4 29.851 42.561 19.697 1.00 0.00 H new ATOM 74 N LEU A 5 28.646 36.585 25.919 1.00 0.00 N ATOM 75 CA LEU A 5 29.829 35.765 26.146 1.00 0.00 C ATOM 76 C LEU A 5 30.477 35.448 24.800 1.00 0.00 C ATOM 77 O LEU A 5 29.824 34.933 23.890 1.00 0.00 O ATOM 78 CB LEU A 5 29.383 34.526 26.937 1.00 0.00 C ATOM 79 CG LEU A 5 30.425 33.485 27.367 1.00 0.00 C ATOM 80 CD1 LEU A 5 30.931 32.588 26.242 1.00 0.00 C ATOM 81 CD2 LEU A 5 31.624 34.092 28.088 1.00 0.00 C ATOM 0 H LEU A 5 28.001 36.168 25.248 1.00 0.00 H new ATOM 0 HA LEU A 5 30.593 36.274 26.734 1.00 0.00 H new ATOM 0 HB2 LEU A 5 28.882 34.878 27.839 1.00 0.00 H new ATOM 0 HB3 LEU A 5 28.634 34.009 26.338 1.00 0.00 H new ATOM 0 HG LEU A 5 29.864 32.861 28.063 1.00 0.00 H new ATOM 0 HD11 LEU A 5 31.663 31.885 26.639 1.00 0.00 H new ATOM 0 HD12 LEU A 5 30.095 32.037 25.812 1.00 0.00 H new ATOM 0 HD13 LEU A 5 31.398 33.200 25.470 1.00 0.00 H new ATOM 0 HD21 LEU A 5 32.321 33.301 28.364 1.00 0.00 H new ATOM 0 HD22 LEU A 5 32.123 34.802 27.429 1.00 0.00 H new ATOM 0 HD23 LEU A 5 31.285 34.607 28.987 1.00 0.00 H new ATOM 93 N PHE A 6 31.758 35.776 24.700 1.00 0.00 N ATOM 94 CA PHE A 6 32.605 35.620 23.529 1.00 0.00 C ATOM 95 C PHE A 6 33.547 34.421 23.710 1.00 0.00 C ATOM 96 O PHE A 6 34.130 34.235 24.782 1.00 0.00 O ATOM 97 CB PHE A 6 33.364 36.944 23.348 1.00 0.00 C ATOM 98 CG PHE A 6 34.371 37.019 22.217 1.00 0.00 C ATOM 99 CD1 PHE A 6 34.152 36.349 20.999 1.00 0.00 C ATOM 100 CD2 PHE A 6 35.513 37.827 22.367 1.00 0.00 C ATOM 101 CE1 PHE A 6 35.076 36.474 19.952 1.00 0.00 C ATOM 102 CE2 PHE A 6 36.417 37.976 21.301 1.00 0.00 C ATOM 103 CZ PHE A 6 36.210 37.282 20.100 1.00 0.00 C ATOM 0 H PHE A 6 32.264 36.184 25.486 1.00 0.00 H new ATOM 0 HA PHE A 6 32.021 35.411 22.633 1.00 0.00 H new ATOM 0 HB2 PHE A 6 32.630 37.736 23.199 1.00 0.00 H new ATOM 0 HB3 PHE A 6 33.886 37.164 24.279 1.00 0.00 H new ATOM 0 HD1 PHE A 6 33.271 35.738 20.871 1.00 0.00 H new ATOM 0 HD2 PHE A 6 35.695 38.334 23.303 1.00 0.00 H new ATOM 0 HE1 PHE A 6 34.912 35.944 19.026 1.00 0.00 H new ATOM 0 HE2 PHE A 6 37.273 38.626 21.407 1.00 0.00 H new ATOM 0 HZ PHE A 6 36.922 37.370 19.293 1.00 0.00 H new ATOM 113 N ILE A 7 33.698 33.608 22.662 1.00 0.00 N ATOM 114 CA ILE A 7 34.652 32.492 22.610 1.00 0.00 C ATOM 115 C ILE A 7 35.885 32.908 21.799 1.00 0.00 C ATOM 116 O ILE A 7 35.770 33.506 20.725 1.00 0.00 O ATOM 117 CB ILE A 7 33.998 31.217 22.023 1.00 0.00 C ATOM 118 CG1 ILE A 7 32.601 30.890 22.595 1.00 0.00 C ATOM 119 CG2 ILE A 7 34.917 29.994 22.219 1.00 0.00 C ATOM 120 CD1 ILE A 7 32.558 30.543 24.084 1.00 0.00 C ATOM 0 H ILE A 7 33.150 33.707 21.807 1.00 0.00 H new ATOM 0 HA ILE A 7 34.964 32.250 23.626 1.00 0.00 H new ATOM 0 HB ILE A 7 33.861 31.436 20.964 1.00 0.00 H new ATOM 0 HG12 ILE A 7 31.948 31.745 22.421 1.00 0.00 H new ATOM 0 HG13 ILE A 7 32.186 30.053 22.034 1.00 0.00 H new ATOM 0 HG21 ILE A 7 34.439 29.109 21.800 1.00 0.00 H new ATOM 0 HG22 ILE A 7 35.867 30.168 21.713 1.00 0.00 H new ATOM 0 HG23 ILE A 7 35.096 29.840 23.283 1.00 0.00 H new ATOM 0 HD11 ILE A 7 31.530 30.331 24.379 1.00 0.00 H new ATOM 0 HD12 ILE A 7 33.177 29.666 24.271 1.00 0.00 H new ATOM 0 HD13 ILE A 7 32.936 31.384 24.665 1.00 0.00 H new ATOM 132 N GLY A 8 37.074 32.540 22.282 1.00 0.00 N ATOM 133 CA GLY A 8 38.306 32.667 21.502 1.00 0.00 C ATOM 134 C GLY A 8 38.318 31.788 20.243 1.00 0.00 C ATOM 135 O GLY A 8 37.359 31.094 19.918 1.00 0.00 O ATOM 0 H GLY A 8 37.209 32.150 23.215 1.00 0.00 H new ATOM 0 HA2 GLY A 8 38.438 33.709 21.211 1.00 0.00 H new ATOM 0 HA3 GLY A 8 39.156 32.401 22.131 1.00 0.00 H new ATOM 139 N ASN A 9 39.443 31.771 19.535 1.00 0.00 N ATOM 140 CA ASN A 9 39.626 31.060 18.265 1.00 0.00 C ATOM 141 C ASN A 9 39.987 29.564 18.407 1.00 0.00 C ATOM 142 O ASN A 9 40.356 28.919 17.423 1.00 0.00 O ATOM 143 CB ASN A 9 40.598 31.864 17.385 1.00 0.00 C ATOM 144 CG ASN A 9 41.961 32.133 18.001 1.00 0.00 C ATOM 145 OD1 ASN A 9 42.202 31.949 19.187 1.00 0.00 O ATOM 146 ND2 ASN A 9 42.890 32.651 17.243 1.00 0.00 N ATOM 0 H ASN A 9 40.282 32.267 19.835 1.00 0.00 H new ATOM 0 HA ASN A 9 38.660 31.009 17.762 1.00 0.00 H new ATOM 0 HB2 ASN A 9 40.741 31.328 16.447 1.00 0.00 H new ATOM 0 HB3 ASN A 9 40.134 32.819 17.139 1.00 0.00 H new ATOM 0 HD21 ASN A 9 43.797 32.894 17.642 1.00 0.00 H new ATOM 0 HD22 ASN A 9 42.709 32.812 16.252 1.00 0.00 H new ATOM 153 N LEU A 10 39.836 28.996 19.607 1.00 0.00 N ATOM 154 CA LEU A 10 40.001 27.570 19.899 1.00 0.00 C ATOM 155 C LEU A 10 39.078 26.631 19.084 1.00 0.00 C ATOM 156 O LEU A 10 39.584 25.626 18.578 1.00 0.00 O ATOM 157 CB LEU A 10 39.809 27.368 21.416 1.00 0.00 C ATOM 158 CG LEU A 10 39.979 25.913 21.892 1.00 0.00 C ATOM 159 CD1 LEU A 10 41.422 25.427 21.771 1.00 0.00 C ATOM 160 CD2 LEU A 10 39.566 25.814 23.354 1.00 0.00 C ATOM 0 H LEU A 10 39.586 29.539 20.434 1.00 0.00 H new ATOM 0 HA LEU A 10 41.006 27.285 19.588 1.00 0.00 H new ATOM 0 HB2 LEU A 10 40.524 27.997 21.947 1.00 0.00 H new ATOM 0 HB3 LEU A 10 38.813 27.714 21.693 1.00 0.00 H new ATOM 0 HG LEU A 10 39.352 25.288 21.255 1.00 0.00 H new ATOM 0 HD11 LEU A 10 41.489 24.396 22.119 1.00 0.00 H new ATOM 0 HD12 LEU A 10 41.737 25.479 20.729 1.00 0.00 H new ATOM 0 HD13 LEU A 10 42.071 26.058 22.379 1.00 0.00 H new ATOM 0 HD21 LEU A 10 39.684 24.786 23.697 1.00 0.00 H new ATOM 0 HD22 LEU A 10 40.194 26.471 23.955 1.00 0.00 H new ATOM 0 HD23 LEU A 10 38.523 26.114 23.459 1.00 0.00 H new ATOM 172 N PRO A 11 37.764 26.898 18.899 1.00 0.00 N ATOM 173 CA PRO A 11 36.844 25.957 18.261 1.00 0.00 C ATOM 174 C PRO A 11 36.902 26.001 16.721 1.00 0.00 C ATOM 175 O PRO A 11 35.958 25.568 16.059 1.00 0.00 O ATOM 176 CB PRO A 11 35.470 26.305 18.836 1.00 0.00 C ATOM 177 CG PRO A 11 35.547 27.822 18.937 1.00 0.00 C ATOM 178 CD PRO A 11 37.001 28.059 19.345 1.00 0.00 C ATOM 0 HA PRO A 11 37.110 24.922 18.476 1.00 0.00 H new ATOM 0 HB2 PRO A 11 34.660 25.980 18.183 1.00 0.00 H new ATOM 0 HB3 PRO A 11 35.304 25.839 19.807 1.00 0.00 H new ATOM 0 HG2 PRO A 11 35.309 28.303 17.988 1.00 0.00 H new ATOM 0 HG3 PRO A 11 34.850 28.214 19.677 1.00 0.00 H new ATOM 0 HD2 PRO A 11 37.386 28.971 18.889 1.00 0.00 H new ATOM 0 HD3 PRO A 11 37.083 28.183 20.425 1.00 0.00 H new ATOM 186 N LEU A 12 38.003 26.488 16.129 1.00 0.00 N ATOM 187 CA LEU A 12 38.267 26.487 14.682 1.00 0.00 C ATOM 188 C LEU A 12 38.687 25.075 14.212 1.00 0.00 C ATOM 189 O LEU A 12 39.808 24.833 13.754 1.00 0.00 O ATOM 190 CB LEU A 12 39.254 27.629 14.349 1.00 0.00 C ATOM 191 CG LEU A 12 39.174 28.228 12.928 1.00 0.00 C ATOM 192 CD1 LEU A 12 39.512 27.246 11.809 1.00 0.00 C ATOM 193 CD2 LEU A 12 37.793 28.820 12.634 1.00 0.00 C ATOM 0 H LEU A 12 38.762 26.909 16.665 1.00 0.00 H new ATOM 0 HA LEU A 12 37.365 26.701 14.109 1.00 0.00 H new ATOM 0 HB2 LEU A 12 39.096 28.434 15.066 1.00 0.00 H new ATOM 0 HB3 LEU A 12 40.267 27.258 14.505 1.00 0.00 H new ATOM 0 HG LEU A 12 39.935 29.008 12.934 1.00 0.00 H new ATOM 0 HD11 LEU A 12 39.431 27.750 10.846 1.00 0.00 H new ATOM 0 HD12 LEU A 12 40.530 26.879 11.942 1.00 0.00 H new ATOM 0 HD13 LEU A 12 38.817 26.407 11.839 1.00 0.00 H new ATOM 0 HD21 LEU A 12 37.781 29.230 11.624 1.00 0.00 H new ATOM 0 HD22 LEU A 12 37.037 28.039 12.718 1.00 0.00 H new ATOM 0 HD23 LEU A 12 37.577 29.612 13.350 1.00 0.00 H new ATOM 205 N LYS A 13 37.784 24.121 14.440 1.00 0.00 N ATOM 206 CA LYS A 13 37.906 22.668 14.232 1.00 0.00 C ATOM 207 C LYS A 13 36.523 22.033 13.978 1.00 0.00 C ATOM 208 O LYS A 13 36.255 20.894 14.363 1.00 0.00 O ATOM 209 CB LYS A 13 38.659 22.042 15.420 1.00 0.00 C ATOM 210 CG LYS A 13 37.955 22.242 16.774 1.00 0.00 C ATOM 211 CD LYS A 13 38.693 21.554 17.925 1.00 0.00 C ATOM 212 CE LYS A 13 40.089 22.146 18.145 1.00 0.00 C ATOM 213 NZ LYS A 13 40.702 21.577 19.360 1.00 0.00 N ATOM 0 H LYS A 13 36.864 24.362 14.808 1.00 0.00 H new ATOM 0 HA LYS A 13 38.493 22.466 13.336 1.00 0.00 H new ATOM 0 HB2 LYS A 13 38.782 20.974 15.239 1.00 0.00 H new ATOM 0 HB3 LYS A 13 39.659 22.473 15.473 1.00 0.00 H new ATOM 0 HG2 LYS A 13 37.875 23.309 16.984 1.00 0.00 H new ATOM 0 HG3 LYS A 13 36.939 21.852 16.713 1.00 0.00 H new ATOM 0 HD2 LYS A 13 38.109 21.652 18.840 1.00 0.00 H new ATOM 0 HD3 LYS A 13 38.780 20.488 17.715 1.00 0.00 H new ATOM 0 HE2 LYS A 13 40.720 21.939 17.280 1.00 0.00 H new ATOM 0 HE3 LYS A 13 40.021 23.230 18.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 41.648 21.987 19.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 40.107 21.796 20.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 40.784 20.545 19.257 1.00 0.00 H new ATOM 227 N ASN A 14 35.641 22.815 13.355 1.00 0.00 N ATOM 228 CA ASN A 14 34.183 22.719 13.355 1.00 0.00 C ATOM 229 C ASN A 14 33.548 22.801 14.757 1.00 0.00 C ATOM 230 O ASN A 14 34.105 22.373 15.774 1.00 0.00 O ATOM 231 CB ASN A 14 33.678 21.545 12.509 1.00 0.00 C ATOM 232 CG ASN A 14 34.126 21.586 11.061 1.00 0.00 C ATOM 233 OD1 ASN A 14 34.987 20.819 10.637 1.00 0.00 O ATOM 234 ND2 ASN A 14 33.561 22.466 10.270 1.00 0.00 N ATOM 0 H ASN A 14 35.958 23.601 12.788 1.00 0.00 H new ATOM 0 HA ASN A 14 33.826 23.620 12.857 1.00 0.00 H new ATOM 0 HB2 ASN A 14 34.022 20.613 12.958 1.00 0.00 H new ATOM 0 HB3 ASN A 14 32.589 21.531 12.541 1.00 0.00 H new ATOM 0 HD21 ASN A 14 33.835 22.520 9.289 1.00 0.00 H new ATOM 0 HD22 ASN A 14 32.847 23.097 10.636 1.00 0.00 H new ATOM 241 N VAL A 15 32.355 23.391 14.805 1.00 0.00 N ATOM 242 CA VAL A 15 31.671 23.779 16.046 1.00 0.00 C ATOM 243 C VAL A 15 30.149 23.749 15.857 1.00 0.00 C ATOM 244 O VAL A 15 29.661 23.896 14.734 1.00 0.00 O ATOM 245 CB VAL A 15 32.205 25.160 16.487 1.00 0.00 C ATOM 246 CG1 VAL A 15 31.779 26.303 15.557 1.00 0.00 C ATOM 247 CG2 VAL A 15 31.857 25.483 17.941 1.00 0.00 C ATOM 0 H VAL A 15 31.822 23.619 13.966 1.00 0.00 H new ATOM 0 HA VAL A 15 31.882 23.066 16.843 1.00 0.00 H new ATOM 0 HB VAL A 15 33.289 25.080 16.412 1.00 0.00 H new ATOM 0 HG11 VAL A 15 32.188 27.244 15.925 1.00 0.00 H new ATOM 0 HG12 VAL A 15 32.154 26.113 14.551 1.00 0.00 H new ATOM 0 HG13 VAL A 15 30.691 26.366 15.532 1.00 0.00 H new ATOM 0 HG21 VAL A 15 32.255 26.464 18.201 1.00 0.00 H new ATOM 0 HG22 VAL A 15 30.774 25.487 18.064 1.00 0.00 H new ATOM 0 HG23 VAL A 15 32.294 24.729 18.596 1.00 0.00 H new ATOM 257 N SER A 16 29.404 23.529 16.937 1.00 0.00 N ATOM 258 CA SER A 16 27.938 23.435 16.987 1.00 0.00 C ATOM 259 C SER A 16 27.397 24.232 18.177 1.00 0.00 C ATOM 260 O SER A 16 28.161 24.544 19.096 1.00 0.00 O ATOM 261 CB SER A 16 27.526 21.963 17.118 1.00 0.00 C ATOM 262 OG SER A 16 28.045 21.205 16.042 1.00 0.00 O ATOM 0 H SER A 16 29.827 23.404 17.857 1.00 0.00 H new ATOM 0 HA SER A 16 27.522 23.850 16.069 1.00 0.00 H new ATOM 0 HB2 SER A 16 27.890 21.560 18.063 1.00 0.00 H new ATOM 0 HB3 SER A 16 26.439 21.884 17.135 1.00 0.00 H new ATOM 0 HG SER A 16 27.775 20.268 16.141 1.00 0.00 H new ATOM 268 N LYS A 17 26.083 24.508 18.240 1.00 0.00 N ATOM 269 CA LYS A 17 25.443 25.121 19.431 1.00 0.00 C ATOM 270 C LYS A 17 25.776 24.347 20.705 1.00 0.00 C ATOM 271 O LYS A 17 25.944 24.925 21.775 1.00 0.00 O ATOM 272 CB LYS A 17 23.914 25.140 19.290 1.00 0.00 C ATOM 273 CG LYS A 17 23.367 25.986 18.135 1.00 0.00 C ATOM 274 CD LYS A 17 21.840 26.030 18.260 1.00 0.00 C ATOM 275 CE LYS A 17 21.194 26.759 17.087 1.00 0.00 C ATOM 276 NZ LYS A 17 19.731 26.839 17.275 1.00 0.00 N ATOM 0 H LYS A 17 25.434 24.317 17.477 1.00 0.00 H new ATOM 0 HA LYS A 17 25.831 26.137 19.498 1.00 0.00 H new ATOM 0 HB2 LYS A 17 23.566 24.115 19.163 1.00 0.00 H new ATOM 0 HB3 LYS A 17 23.485 25.509 20.222 1.00 0.00 H new ATOM 0 HG2 LYS A 17 23.781 26.994 18.172 1.00 0.00 H new ATOM 0 HG3 LYS A 17 23.658 25.556 17.177 1.00 0.00 H new ATOM 0 HD2 LYS A 17 21.451 25.013 18.314 1.00 0.00 H new ATOM 0 HD3 LYS A 17 21.566 26.526 19.191 1.00 0.00 H new ATOM 0 HE2 LYS A 17 21.611 27.762 16.999 1.00 0.00 H new ATOM 0 HE3 LYS A 17 21.420 26.237 16.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 19.304 27.338 16.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 19.336 25.879 17.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 19.522 27.356 18.152 1.00 0.00 H new ATOM 290 N GLU A 18 25.926 23.035 20.549 1.00 0.00 N ATOM 291 CA GLU A 18 26.258 22.077 21.595 1.00 0.00 C ATOM 292 C GLU A 18 27.669 22.216 22.177 1.00 0.00 C ATOM 293 O GLU A 18 27.891 21.772 23.305 1.00 0.00 O ATOM 294 CB GLU A 18 26.068 20.660 21.044 1.00 0.00 C ATOM 295 CG GLU A 18 24.627 20.397 20.588 1.00 0.00 C ATOM 296 CD GLU A 18 23.568 20.516 21.692 1.00 0.00 C ATOM 297 OE1 GLU A 18 23.912 20.546 22.899 1.00 0.00 O ATOM 298 OE2 GLU A 18 22.366 20.580 21.331 1.00 0.00 O ATOM 0 H GLU A 18 25.813 22.589 19.639 1.00 0.00 H new ATOM 0 HA GLU A 18 25.582 22.287 22.424 1.00 0.00 H new ATOM 0 HB2 GLU A 18 26.746 20.506 20.204 1.00 0.00 H new ATOM 0 HB3 GLU A 18 26.341 19.935 21.811 1.00 0.00 H new ATOM 0 HG2 GLU A 18 24.380 21.098 19.791 1.00 0.00 H new ATOM 0 HG3 GLU A 18 24.574 19.396 20.160 1.00 0.00 H new ATOM 305 N ASP A 19 28.612 22.834 21.460 1.00 0.00 N ATOM 306 CA ASP A 19 29.934 23.194 21.989 1.00 0.00 C ATOM 307 C ASP A 19 29.785 24.329 23.014 1.00 0.00 C ATOM 308 O ASP A 19 30.264 24.239 24.138 1.00 0.00 O ATOM 309 CB ASP A 19 30.878 23.619 20.849 1.00 0.00 C ATOM 310 CG ASP A 19 31.207 22.513 19.838 1.00 0.00 C ATOM 311 OD1 ASP A 19 30.300 21.986 19.156 1.00 0.00 O ATOM 312 OD2 ASP A 19 32.399 22.158 19.682 1.00 0.00 O ATOM 0 H ASP A 19 28.479 23.102 20.485 1.00 0.00 H new ATOM 0 HA ASP A 19 30.369 22.323 22.480 1.00 0.00 H new ATOM 0 HB2 ASP A 19 30.427 24.456 20.316 1.00 0.00 H new ATOM 0 HB3 ASP A 19 31.809 23.982 21.284 1.00 0.00 H new ATOM 317 N LEU A 20 29.031 25.379 22.681 1.00 0.00 N ATOM 318 CA LEU A 20 28.781 26.471 23.625 1.00 0.00 C ATOM 319 C LEU A 20 27.803 26.059 24.739 1.00 0.00 C ATOM 320 O LEU A 20 27.960 26.517 25.868 1.00 0.00 O ATOM 321 CB LEU A 20 28.354 27.735 22.866 1.00 0.00 C ATOM 322 CG LEU A 20 29.550 28.566 22.366 1.00 0.00 C ATOM 323 CD1 LEU A 20 30.334 27.868 21.248 1.00 0.00 C ATOM 324 CD2 LEU A 20 29.073 29.931 21.872 1.00 0.00 C ATOM 0 H LEU A 20 28.585 25.496 21.771 1.00 0.00 H new ATOM 0 HA LEU A 20 29.710 26.708 24.144 1.00 0.00 H new ATOM 0 HB2 LEU A 20 27.735 27.450 22.015 1.00 0.00 H new ATOM 0 HB3 LEU A 20 27.736 28.353 23.518 1.00 0.00 H new ATOM 0 HG LEU A 20 30.224 28.684 23.215 1.00 0.00 H new ATOM 0 HD11 LEU A 20 31.165 28.501 20.936 1.00 0.00 H new ATOM 0 HD12 LEU A 20 30.720 26.917 21.614 1.00 0.00 H new ATOM 0 HD13 LEU A 20 29.675 27.690 20.398 1.00 0.00 H new ATOM 0 HD21 LEU A 20 29.927 30.510 21.521 1.00 0.00 H new ATOM 0 HD22 LEU A 20 28.366 29.795 21.054 1.00 0.00 H new ATOM 0 HD23 LEU A 20 28.585 30.463 22.689 1.00 0.00 H new ATOM 336 N PHE A 21 26.880 25.128 24.467 1.00 0.00 N ATOM 337 CA PHE A 21 26.020 24.504 25.480 1.00 0.00 C ATOM 338 C PHE A 21 26.840 23.733 26.523 1.00 0.00 C ATOM 339 O PHE A 21 26.612 23.899 27.725 1.00 0.00 O ATOM 340 CB PHE A 21 25.023 23.549 24.806 1.00 0.00 C ATOM 341 CG PHE A 21 23.921 23.034 25.713 1.00 0.00 C ATOM 342 CD1 PHE A 21 24.168 21.968 26.600 1.00 0.00 C ATOM 343 CD2 PHE A 21 22.639 23.611 25.664 1.00 0.00 C ATOM 344 CE1 PHE A 21 23.150 21.507 27.452 1.00 0.00 C ATOM 345 CE2 PHE A 21 21.621 23.145 26.515 1.00 0.00 C ATOM 346 CZ PHE A 21 21.877 22.101 27.419 1.00 0.00 C ATOM 0 H PHE A 21 26.707 24.782 23.523 1.00 0.00 H new ATOM 0 HA PHE A 21 25.482 25.302 25.992 1.00 0.00 H new ATOM 0 HB2 PHE A 21 24.567 24.061 23.959 1.00 0.00 H new ATOM 0 HB3 PHE A 21 25.572 22.697 24.405 1.00 0.00 H new ATOM 0 HD1 PHE A 21 25.143 21.504 26.625 1.00 0.00 H new ATOM 0 HD2 PHE A 21 22.436 24.414 24.971 1.00 0.00 H new ATOM 0 HE1 PHE A 21 23.347 20.693 28.134 1.00 0.00 H new ATOM 0 HE2 PHE A 21 20.639 23.592 26.473 1.00 0.00 H new ATOM 0 HZ PHE A 21 21.100 21.757 28.085 1.00 0.00 H new ATOM 356 N ARG A 22 27.818 22.906 26.098 1.00 0.00 N ATOM 357 CA ARG A 22 28.673 22.155 27.039 1.00 0.00 C ATOM 358 C ARG A 22 29.466 23.115 27.914 1.00 0.00 C ATOM 359 O ARG A 22 29.594 22.860 29.112 1.00 0.00 O ATOM 360 CB ARG A 22 29.548 21.083 26.340 1.00 0.00 C ATOM 361 CG ARG A 22 30.979 21.463 25.898 1.00 0.00 C ATOM 362 CD ARG A 22 31.998 21.471 27.046 1.00 0.00 C ATOM 363 NE ARG A 22 33.337 21.907 26.622 1.00 0.00 N ATOM 364 CZ ARG A 22 34.372 22.087 27.417 1.00 0.00 C ATOM 365 NH1 ARG A 22 34.277 21.986 28.711 1.00 0.00 N ATOM 366 NH2 ARG A 22 35.548 22.382 26.956 1.00 0.00 N ATOM 0 H ARG A 22 28.034 22.742 25.115 1.00 0.00 H new ATOM 0 HA ARG A 22 28.023 21.580 27.698 1.00 0.00 H new ATOM 0 HB2 ARG A 22 29.626 20.230 27.014 1.00 0.00 H new ATOM 0 HB3 ARG A 22 29.009 20.742 25.456 1.00 0.00 H new ATOM 0 HG2 ARG A 22 31.312 20.761 25.133 1.00 0.00 H new ATOM 0 HG3 ARG A 22 30.957 22.450 25.437 1.00 0.00 H new ATOM 0 HD2 ARG A 22 31.641 22.130 27.837 1.00 0.00 H new ATOM 0 HD3 ARG A 22 32.066 20.470 27.472 1.00 0.00 H new ATOM 0 HE ARG A 22 33.476 22.085 25.627 1.00 0.00 H new ATOM 0 HH11 ARG A 22 33.380 21.761 29.140 1.00 0.00 H new ATOM 0 HH12 ARG A 22 35.100 22.132 29.296 1.00 0.00 H new ATOM 0 HH21 ARG A 22 35.692 22.481 25.951 1.00 0.00 H new ATOM 0 HH22 ARG A 22 36.329 22.515 27.598 1.00 0.00 H new ATOM 380 N ILE A 23 29.948 24.217 27.331 1.00 0.00 N ATOM 381 CA ILE A 23 30.624 25.304 28.041 1.00 0.00 C ATOM 382 C ILE A 23 29.658 25.909 29.072 1.00 0.00 C ATOM 383 O ILE A 23 29.764 25.559 30.249 1.00 0.00 O ATOM 384 CB ILE A 23 31.251 26.309 27.038 1.00 0.00 C ATOM 385 CG1 ILE A 23 32.432 25.644 26.290 1.00 0.00 C ATOM 386 CG2 ILE A 23 31.734 27.597 27.727 1.00 0.00 C ATOM 387 CD1 ILE A 23 32.892 26.412 25.042 1.00 0.00 C ATOM 0 H ILE A 23 29.876 24.381 26.327 1.00 0.00 H new ATOM 0 HA ILE A 23 31.475 24.934 28.612 1.00 0.00 H new ATOM 0 HB ILE A 23 30.471 26.587 26.330 1.00 0.00 H new ATOM 0 HG12 ILE A 23 33.274 25.547 26.975 1.00 0.00 H new ATOM 0 HG13 ILE A 23 32.141 24.635 25.997 1.00 0.00 H new ATOM 0 HG21 ILE A 23 32.165 28.268 26.984 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.891 28.088 28.213 1.00 0.00 H new ATOM 0 HG23 ILE A 23 32.489 27.349 28.473 1.00 0.00 H new ATOM 0 HD11 ILE A 23 33.722 25.882 24.574 1.00 0.00 H new ATOM 0 HD12 ILE A 23 32.065 26.487 24.336 1.00 0.00 H new ATOM 0 HD13 ILE A 23 33.216 27.412 25.329 1.00 0.00 H new ATOM 399 N PHE A 24 28.687 26.737 28.669 1.00 0.00 N ATOM 400 CA PHE A 24 27.740 27.384 29.588 1.00 0.00 C ATOM 401 C PHE A 24 26.291 26.988 29.282 1.00 0.00 C ATOM 402 O PHE A 24 25.776 27.211 28.190 1.00 0.00 O ATOM 403 CB PHE A 24 27.875 28.920 29.580 1.00 0.00 C ATOM 404 CG PHE A 24 29.163 29.578 30.052 1.00 0.00 C ATOM 405 CD1 PHE A 24 30.244 28.853 30.592 1.00 0.00 C ATOM 406 CD2 PHE A 24 29.266 30.979 29.958 1.00 0.00 C ATOM 407 CE1 PHE A 24 31.451 29.495 30.897 1.00 0.00 C ATOM 408 CE2 PHE A 24 30.457 31.629 30.330 1.00 0.00 C ATOM 409 CZ PHE A 24 31.565 30.881 30.746 1.00 0.00 C ATOM 0 H PHE A 24 28.534 26.979 27.690 1.00 0.00 H new ATOM 0 HA PHE A 24 27.996 27.026 30.585 1.00 0.00 H new ATOM 0 HB2 PHE A 24 27.697 29.255 28.558 1.00 0.00 H new ATOM 0 HB3 PHE A 24 27.066 29.319 30.192 1.00 0.00 H new ATOM 0 HD1 PHE A 24 30.141 27.793 30.772 1.00 0.00 H new ATOM 0 HD2 PHE A 24 28.427 31.557 29.599 1.00 0.00 H new ATOM 0 HE1 PHE A 24 32.294 28.919 31.249 1.00 0.00 H new ATOM 0 HE2 PHE A 24 30.517 32.707 30.295 1.00 0.00 H new ATOM 0 HZ PHE A 24 32.505 31.373 30.950 1.00 0.00 H new ATOM 419 N SER A 25 25.609 26.452 30.294 1.00 0.00 N ATOM 420 CA SER A 25 24.154 26.232 30.339 1.00 0.00 C ATOM 421 C SER A 25 23.611 26.117 31.775 1.00 0.00 C ATOM 422 O SER A 25 22.616 26.786 32.062 1.00 0.00 O ATOM 423 CB SER A 25 23.756 25.006 29.508 1.00 0.00 C ATOM 424 OG SER A 25 23.787 25.380 28.144 1.00 0.00 O ATOM 0 H SER A 25 26.073 26.143 31.148 1.00 0.00 H new ATOM 0 HA SER A 25 23.695 27.117 29.899 1.00 0.00 H new ATOM 0 HB2 SER A 25 24.442 24.180 29.693 1.00 0.00 H new ATOM 0 HB3 SER A 25 22.760 24.662 29.787 1.00 0.00 H new ATOM 0 HG SER A 25 24.375 26.156 28.031 1.00 0.00 H new ATOM 430 N PRO A 26 24.268 25.423 32.736 1.00 0.00 N ATOM 431 CA PRO A 26 23.799 25.357 34.127 1.00 0.00 C ATOM 432 C PRO A 26 24.193 26.604 34.944 1.00 0.00 C ATOM 433 O PRO A 26 24.647 26.496 36.082 1.00 0.00 O ATOM 434 CB PRO A 26 24.361 24.039 34.675 1.00 0.00 C ATOM 435 CG PRO A 26 25.708 23.944 33.966 1.00 0.00 C ATOM 436 CD PRO A 26 25.408 24.516 32.581 1.00 0.00 C ATOM 0 HA PRO A 26 22.711 25.363 34.196 1.00 0.00 H new ATOM 0 HB2 PRO A 26 24.472 24.063 35.759 1.00 0.00 H new ATOM 0 HB3 PRO A 26 23.716 23.192 34.440 1.00 0.00 H new ATOM 0 HG2 PRO A 26 26.477 24.519 34.482 1.00 0.00 H new ATOM 0 HG3 PRO A 26 26.063 22.915 33.910 1.00 0.00 H new ATOM 0 HD2 PRO A 26 26.274 25.047 32.186 1.00 0.00 H new ATOM 0 HD3 PRO A 26 25.175 23.719 31.876 1.00 0.00 H new ATOM 444 N TYR A 27 24.044 27.795 34.364 1.00 0.00 N ATOM 445 CA TYR A 27 24.404 29.083 34.964 1.00 0.00 C ATOM 446 C TYR A 27 23.301 30.120 34.721 1.00 0.00 C ATOM 447 O TYR A 27 22.651 30.104 33.672 1.00 0.00 O ATOM 448 CB TYR A 27 25.737 29.584 34.386 1.00 0.00 C ATOM 449 CG TYR A 27 26.895 28.608 34.496 1.00 0.00 C ATOM 450 CD1 TYR A 27 27.551 28.427 35.729 1.00 0.00 C ATOM 451 CD2 TYR A 27 27.337 27.908 33.356 1.00 0.00 C ATOM 452 CE1 TYR A 27 28.656 27.560 35.824 1.00 0.00 C ATOM 453 CE2 TYR A 27 28.443 27.036 33.447 1.00 0.00 C ATOM 454 CZ TYR A 27 29.107 26.870 34.680 1.00 0.00 C ATOM 455 OH TYR A 27 30.186 26.051 34.755 1.00 0.00 O ATOM 0 H TYR A 27 23.654 27.895 33.427 1.00 0.00 H new ATOM 0 HA TYR A 27 24.515 28.942 36.039 1.00 0.00 H new ATOM 0 HB2 TYR A 27 25.589 29.831 33.335 1.00 0.00 H new ATOM 0 HB3 TYR A 27 26.011 30.508 34.895 1.00 0.00 H new ATOM 0 HD1 TYR A 27 27.205 28.955 36.605 1.00 0.00 H new ATOM 0 HD2 TYR A 27 26.829 28.039 32.412 1.00 0.00 H new ATOM 0 HE1 TYR A 27 29.157 27.424 36.771 1.00 0.00 H new ATOM 0 HE2 TYR A 27 28.780 26.497 32.574 1.00 0.00 H new ATOM 0 HH TYR A 27 30.735 26.303 35.527 1.00 0.00 H new ATOM 465 N GLY A 28 23.096 31.024 35.678 1.00 0.00 N ATOM 466 CA GLY A 28 22.249 32.208 35.513 1.00 0.00 C ATOM 467 C GLY A 28 20.772 31.951 35.216 1.00 0.00 C ATOM 468 O GLY A 28 20.240 30.851 35.414 1.00 0.00 O ATOM 0 H GLY A 28 23.519 30.955 36.604 1.00 0.00 H new ATOM 0 HA2 GLY A 28 22.316 32.805 36.422 1.00 0.00 H new ATOM 0 HA3 GLY A 28 22.660 32.812 34.704 1.00 0.00 H new ATOM 472 N HIS A 29 20.111 32.983 34.689 1.00 0.00 N ATOM 473 CA HIS A 29 18.718 32.922 34.228 1.00 0.00 C ATOM 474 C HIS A 29 18.597 32.682 32.708 1.00 0.00 C ATOM 475 O HIS A 29 17.487 32.481 32.223 1.00 0.00 O ATOM 476 CB HIS A 29 17.963 34.154 34.760 1.00 0.00 C ATOM 477 CG HIS A 29 16.481 34.161 34.467 1.00 0.00 C ATOM 478 ND1 HIS A 29 15.802 35.145 33.747 1.00 0.00 N ATOM 479 CD2 HIS A 29 15.586 33.202 34.838 1.00 0.00 C ATOM 480 CE1 HIS A 29 14.516 34.758 33.699 1.00 0.00 C ATOM 481 NE2 HIS A 29 14.362 33.593 34.343 1.00 0.00 N ATOM 0 H HIS A 29 20.534 33.903 34.567 1.00 0.00 H new ATOM 0 HA HIS A 29 18.230 32.041 34.646 1.00 0.00 H new ATOM 0 HB2 HIS A 29 18.107 34.213 35.839 1.00 0.00 H new ATOM 0 HB3 HIS A 29 18.409 35.051 34.329 1.00 0.00 H new ATOM 0 HD2 HIS A 29 15.796 32.310 35.409 1.00 0.00 H new ATOM 0 HE1 HIS A 29 13.723 35.306 33.212 1.00 0.00 H new ATOM 0 HE2 HIS A 29 13.486 33.082 34.449 1.00 0.00 H new ATOM 489 N ILE A 30 19.723 32.601 31.977 1.00 0.00 N ATOM 490 CA ILE A 30 19.825 32.260 30.537 1.00 0.00 C ATOM 491 C ILE A 30 19.113 33.257 29.600 1.00 0.00 C ATOM 492 O ILE A 30 18.373 34.123 30.049 1.00 0.00 O ATOM 493 CB ILE A 30 19.440 30.763 30.311 1.00 0.00 C ATOM 494 CG1 ILE A 30 20.523 29.961 29.563 1.00 0.00 C ATOM 495 CG2 ILE A 30 18.113 30.550 29.559 1.00 0.00 C ATOM 496 CD1 ILE A 30 21.803 29.763 30.381 1.00 0.00 C ATOM 0 H ILE A 30 20.637 32.780 32.392 1.00 0.00 H new ATOM 0 HA ILE A 30 20.869 32.370 30.243 1.00 0.00 H new ATOM 0 HB ILE A 30 19.332 30.394 31.331 1.00 0.00 H new ATOM 0 HG12 ILE A 30 20.120 28.986 29.290 1.00 0.00 H new ATOM 0 HG13 ILE A 30 20.770 30.475 28.634 1.00 0.00 H new ATOM 0 HG21 ILE A 30 17.926 29.482 29.447 1.00 0.00 H new ATOM 0 HG22 ILE A 30 17.298 31.004 30.123 1.00 0.00 H new ATOM 0 HG23 ILE A 30 18.175 31.013 28.574 1.00 0.00 H new ATOM 0 HD11 ILE A 30 22.524 29.191 29.796 1.00 0.00 H new ATOM 0 HD12 ILE A 30 22.229 30.735 30.632 1.00 0.00 H new ATOM 0 HD13 ILE A 30 21.569 29.222 31.298 1.00 0.00 H new ATOM 508 N MET A 31 19.359 33.175 28.287 1.00 0.00 N ATOM 509 CA MET A 31 18.504 33.791 27.255 1.00 0.00 C ATOM 510 C MET A 31 18.598 33.005 25.939 1.00 0.00 C ATOM 511 O MET A 31 17.632 32.323 25.592 1.00 0.00 O ATOM 512 CB MET A 31 18.807 35.289 27.028 1.00 0.00 C ATOM 513 CG MET A 31 17.863 36.262 27.735 1.00 0.00 C ATOM 514 SD MET A 31 18.136 37.994 27.269 1.00 0.00 S ATOM 515 CE MET A 31 19.807 38.274 27.913 1.00 0.00 C ATOM 0 H MET A 31 20.162 32.676 27.904 1.00 0.00 H new ATOM 0 HA MET A 31 17.481 33.742 27.627 1.00 0.00 H new ATOM 0 HB2 MET A 31 19.825 35.491 27.360 1.00 0.00 H new ATOM 0 HB3 MET A 31 18.775 35.491 25.957 1.00 0.00 H new ATOM 0 HG2 MET A 31 16.833 35.989 27.505 1.00 0.00 H new ATOM 0 HG3 MET A 31 17.987 36.159 28.813 1.00 0.00 H new ATOM 0 HE1 MET A 31 20.133 39.282 27.654 1.00 0.00 H new ATOM 0 HE2 MET A 31 19.803 38.161 28.997 1.00 0.00 H new ATOM 0 HE3 MET A 31 20.492 37.548 27.475 1.00 0.00 H new ATOM 525 N GLN A 32 19.723 33.074 25.215 1.00 0.00 N ATOM 526 CA GLN A 32 19.866 32.516 23.863 1.00 0.00 C ATOM 527 C GLN A 32 21.333 32.206 23.478 1.00 0.00 C ATOM 528 O GLN A 32 22.283 32.811 23.981 1.00 0.00 O ATOM 529 CB GLN A 32 19.229 33.525 22.881 1.00 0.00 C ATOM 530 CG GLN A 32 19.121 33.064 21.420 1.00 0.00 C ATOM 531 CD GLN A 32 18.386 31.737 21.252 1.00 0.00 C ATOM 532 OE1 GLN A 32 18.990 30.684 21.091 1.00 0.00 O ATOM 533 NE2 GLN A 32 17.075 31.727 21.295 1.00 0.00 N ATOM 0 H GLN A 32 20.572 33.525 25.557 1.00 0.00 H new ATOM 0 HA GLN A 32 19.359 31.552 23.822 1.00 0.00 H new ATOM 0 HB2 GLN A 32 18.229 33.769 23.239 1.00 0.00 H new ATOM 0 HB3 GLN A 32 19.811 34.446 22.909 1.00 0.00 H new ATOM 0 HG2 GLN A 32 18.605 33.831 20.843 1.00 0.00 H new ATOM 0 HG3 GLN A 32 20.123 32.970 21.002 1.00 0.00 H new ATOM 0 HE21 GLN A 32 16.562 32.599 21.429 1.00 0.00 H new ATOM 0 HE22 GLN A 32 16.568 30.848 21.195 1.00 0.00 H new ATOM 542 N ILE A 33 21.504 31.277 22.536 1.00 0.00 N ATOM 543 CA ILE A 33 22.767 30.920 21.871 1.00 0.00 C ATOM 544 C ILE A 33 22.825 31.558 20.471 1.00 0.00 C ATOM 545 O ILE A 33 21.854 31.494 19.714 1.00 0.00 O ATOM 546 CB ILE A 33 22.925 29.375 21.858 1.00 0.00 C ATOM 547 CG1 ILE A 33 24.129 28.845 21.055 1.00 0.00 C ATOM 548 CG2 ILE A 33 21.686 28.644 21.316 1.00 0.00 C ATOM 549 CD1 ILE A 33 25.473 29.265 21.629 1.00 0.00 C ATOM 0 H ILE A 33 20.722 30.719 22.194 1.00 0.00 H new ATOM 0 HA ILE A 33 23.618 31.320 22.422 1.00 0.00 H new ATOM 0 HB ILE A 33 23.080 29.161 22.915 1.00 0.00 H new ATOM 0 HG12 ILE A 33 24.082 27.757 21.020 1.00 0.00 H new ATOM 0 HG13 ILE A 33 24.055 29.200 20.027 1.00 0.00 H new ATOM 0 HG21 ILE A 33 21.861 27.568 21.334 1.00 0.00 H new ATOM 0 HG22 ILE A 33 20.823 28.881 21.938 1.00 0.00 H new ATOM 0 HG23 ILE A 33 21.494 28.964 20.292 1.00 0.00 H new ATOM 0 HD11 ILE A 33 26.275 28.857 21.014 1.00 0.00 H new ATOM 0 HD12 ILE A 33 25.541 30.353 21.638 1.00 0.00 H new ATOM 0 HD13 ILE A 33 25.568 28.887 22.647 1.00 0.00 H new ATOM 561 N ASN A 34 23.967 32.149 20.100 1.00 0.00 N ATOM 562 CA ASN A 34 24.248 32.665 18.754 1.00 0.00 C ATOM 563 C ASN A 34 25.571 32.078 18.233 1.00 0.00 C ATOM 564 O ASN A 34 26.601 32.748 18.125 1.00 0.00 O ATOM 565 CB ASN A 34 24.190 34.204 18.752 1.00 0.00 C ATOM 566 CG ASN A 34 24.427 34.789 17.366 1.00 0.00 C ATOM 567 OD1 ASN A 34 25.279 35.640 17.148 1.00 0.00 O ATOM 568 ND2 ASN A 34 23.679 34.367 16.376 1.00 0.00 N ATOM 0 H ASN A 34 24.744 32.286 20.746 1.00 0.00 H new ATOM 0 HA ASN A 34 23.480 32.341 18.052 1.00 0.00 H new ATOM 0 HB2 ASN A 34 23.217 34.529 19.120 1.00 0.00 H new ATOM 0 HB3 ASN A 34 24.938 34.595 19.442 1.00 0.00 H new ATOM 0 HD21 ASN A 34 23.811 34.747 15.439 1.00 0.00 H new ATOM 0 HD22 ASN A 34 22.965 33.658 16.543 1.00 0.00 H new ATOM 575 N ILE A 35 25.558 30.773 17.959 1.00 0.00 N ATOM 576 CA ILE A 35 26.735 30.057 17.473 1.00 0.00 C ATOM 577 C ILE A 35 27.072 30.476 16.034 1.00 0.00 C ATOM 578 O ILE A 35 26.186 30.609 15.191 1.00 0.00 O ATOM 579 CB ILE A 35 26.560 28.535 17.677 1.00 0.00 C ATOM 580 CG1 ILE A 35 27.813 27.935 18.336 1.00 0.00 C ATOM 581 CG2 ILE A 35 26.125 27.757 16.422 1.00 0.00 C ATOM 582 CD1 ILE A 35 29.097 27.934 17.507 1.00 0.00 C ATOM 0 H ILE A 35 24.732 30.185 18.068 1.00 0.00 H new ATOM 0 HA ILE A 35 27.609 30.334 18.063 1.00 0.00 H new ATOM 0 HB ILE A 35 25.715 28.418 18.356 1.00 0.00 H new ATOM 0 HG12 ILE A 35 28.006 28.482 19.259 1.00 0.00 H new ATOM 0 HG13 ILE A 35 27.589 26.906 18.616 1.00 0.00 H new ATOM 0 HG21 ILE A 35 26.029 26.699 16.665 1.00 0.00 H new ATOM 0 HG22 ILE A 35 25.165 28.138 16.072 1.00 0.00 H new ATOM 0 HG23 ILE A 35 26.872 27.883 15.639 1.00 0.00 H new ATOM 0 HD11 ILE A 35 29.904 27.485 18.086 1.00 0.00 H new ATOM 0 HD12 ILE A 35 28.941 27.358 16.595 1.00 0.00 H new ATOM 0 HD13 ILE A 35 29.364 28.959 17.248 1.00 0.00 H new ATOM 594 N LYS A 36 28.361 30.671 15.755 1.00 0.00 N ATOM 595 CA LYS A 36 28.911 30.975 14.433 1.00 0.00 C ATOM 596 C LYS A 36 29.972 29.931 14.094 1.00 0.00 C ATOM 597 O LYS A 36 30.685 29.460 14.980 1.00 0.00 O ATOM 598 CB LYS A 36 29.496 32.399 14.376 1.00 0.00 C ATOM 599 CG LYS A 36 28.671 33.510 15.053 1.00 0.00 C ATOM 600 CD LYS A 36 27.299 33.760 14.413 1.00 0.00 C ATOM 601 CE LYS A 36 27.439 34.480 13.072 1.00 0.00 C ATOM 602 NZ LYS A 36 26.126 34.645 12.415 1.00 0.00 N ATOM 0 H LYS A 36 29.082 30.619 16.475 1.00 0.00 H new ATOM 0 HA LYS A 36 28.110 30.937 13.695 1.00 0.00 H new ATOM 0 HB2 LYS A 36 30.484 32.380 14.835 1.00 0.00 H new ATOM 0 HB3 LYS A 36 29.636 32.668 13.329 1.00 0.00 H new ATOM 0 HG2 LYS A 36 28.527 33.251 16.102 1.00 0.00 H new ATOM 0 HG3 LYS A 36 29.244 34.437 15.029 1.00 0.00 H new ATOM 0 HD2 LYS A 36 26.784 32.810 14.267 1.00 0.00 H new ATOM 0 HD3 LYS A 36 26.683 34.356 15.087 1.00 0.00 H new ATOM 0 HE2 LYS A 36 27.897 35.457 13.227 1.00 0.00 H new ATOM 0 HE3 LYS A 36 28.106 33.915 12.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 26.251 35.137 11.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 25.702 33.710 12.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 25.499 35.204 13.028 1.00 0.00 H new ATOM 616 N ASN A 37 30.086 29.575 12.822 1.00 0.00 N ATOM 617 CA ASN A 37 30.852 28.414 12.357 1.00 0.00 C ATOM 618 C ASN A 37 32.388 28.541 12.473 1.00 0.00 C ATOM 619 O ASN A 37 33.092 27.543 12.285 1.00 0.00 O ATOM 620 CB ASN A 37 30.377 28.077 10.934 1.00 0.00 C ATOM 621 CG ASN A 37 30.608 29.185 9.926 1.00 0.00 C ATOM 622 OD1 ASN A 37 31.371 30.118 10.135 1.00 0.00 O ATOM 623 ND2 ASN A 37 29.966 29.103 8.794 1.00 0.00 N ATOM 0 H ASN A 37 29.641 30.093 12.064 1.00 0.00 H new ATOM 0 HA ASN A 37 30.646 27.584 13.033 1.00 0.00 H new ATOM 0 HB2 ASN A 37 30.891 27.178 10.594 1.00 0.00 H new ATOM 0 HB3 ASN A 37 29.313 27.843 10.964 1.00 0.00 H new ATOM 0 HD21 ASN A 37 30.099 29.818 8.079 1.00 0.00 H new ATOM 0 HD22 ASN A 37 29.331 28.324 8.623 1.00 0.00 H new ATOM 630 N ALA A 38 32.933 29.715 12.801 1.00 0.00 N ATOM 631 CA ALA A 38 34.330 29.880 13.210 1.00 0.00 C ATOM 632 C ALA A 38 34.463 29.837 14.744 1.00 0.00 C ATOM 633 O ALA A 38 35.117 28.946 15.284 1.00 0.00 O ATOM 634 CB ALA A 38 34.894 31.153 12.565 1.00 0.00 C ATOM 0 H ALA A 38 32.409 30.590 12.790 1.00 0.00 H new ATOM 0 HA ALA A 38 34.934 29.047 12.852 1.00 0.00 H new ATOM 0 HB1 ALA A 38 35.934 31.283 12.865 1.00 0.00 H new ATOM 0 HB2 ALA A 38 34.837 31.067 11.480 1.00 0.00 H new ATOM 0 HB3 ALA A 38 34.312 32.015 12.892 1.00 0.00 H new ATOM 640 N PHE A 39 33.790 30.754 15.443 1.00 0.00 N ATOM 641 CA PHE A 39 33.696 30.826 16.908 1.00 0.00 C ATOM 642 C PHE A 39 32.358 31.461 17.323 1.00 0.00 C ATOM 643 O PHE A 39 31.957 32.491 16.783 1.00 0.00 O ATOM 644 CB PHE A 39 34.890 31.618 17.476 1.00 0.00 C ATOM 645 CG PHE A 39 35.134 32.948 16.785 1.00 0.00 C ATOM 646 CD1 PHE A 39 34.446 34.107 17.194 1.00 0.00 C ATOM 647 CD2 PHE A 39 35.999 33.010 15.677 1.00 0.00 C ATOM 648 CE1 PHE A 39 34.603 35.312 16.485 1.00 0.00 C ATOM 649 CE2 PHE A 39 36.150 34.211 14.967 1.00 0.00 C ATOM 650 CZ PHE A 39 35.458 35.366 15.371 1.00 0.00 C ATOM 0 H PHE A 39 33.271 31.503 14.984 1.00 0.00 H new ATOM 0 HA PHE A 39 33.732 29.817 17.320 1.00 0.00 H new ATOM 0 HB2 PHE A 39 34.722 31.797 18.538 1.00 0.00 H new ATOM 0 HB3 PHE A 39 35.789 31.008 17.395 1.00 0.00 H new ATOM 0 HD1 PHE A 39 33.795 34.071 18.055 1.00 0.00 H new ATOM 0 HD2 PHE A 39 36.548 32.131 15.372 1.00 0.00 H new ATOM 0 HE1 PHE A 39 34.066 36.196 16.797 1.00 0.00 H new ATOM 0 HE2 PHE A 39 36.801 34.248 14.106 1.00 0.00 H new ATOM 0 HZ PHE A 39 35.583 36.291 14.828 1.00 0.00 H new ATOM 660 N GLY A 40 31.643 30.846 18.265 1.00 0.00 N ATOM 661 CA GLY A 40 30.299 31.288 18.646 1.00 0.00 C ATOM 662 C GLY A 40 30.239 32.455 19.632 1.00 0.00 C ATOM 663 O GLY A 40 31.236 32.831 20.247 1.00 0.00 O ATOM 0 H GLY A 40 31.975 30.033 18.783 1.00 0.00 H new ATOM 0 HA2 GLY A 40 29.760 31.572 17.742 1.00 0.00 H new ATOM 0 HA3 GLY A 40 29.768 30.441 19.081 1.00 0.00 H new ATOM 667 N PHE A 41 29.021 32.963 19.820 1.00 0.00 N ATOM 668 CA PHE A 41 28.633 33.853 20.910 1.00 0.00 C ATOM 669 C PHE A 41 27.452 33.271 21.701 1.00 0.00 C ATOM 670 O PHE A 41 26.629 32.522 21.177 1.00 0.00 O ATOM 671 CB PHE A 41 28.282 35.240 20.353 1.00 0.00 C ATOM 672 CG PHE A 41 29.467 36.174 20.219 1.00 0.00 C ATOM 673 CD1 PHE A 41 30.352 36.058 19.130 1.00 0.00 C ATOM 674 CD2 PHE A 41 29.681 37.169 21.192 1.00 0.00 C ATOM 675 CE1 PHE A 41 31.438 36.942 19.012 1.00 0.00 C ATOM 676 CE2 PHE A 41 30.759 38.059 21.065 1.00 0.00 C ATOM 677 CZ PHE A 41 31.635 37.951 19.972 1.00 0.00 C ATOM 0 H PHE A 41 28.247 32.756 19.189 1.00 0.00 H new ATOM 0 HA PHE A 41 29.476 33.951 21.595 1.00 0.00 H new ATOM 0 HB2 PHE A 41 27.817 35.119 19.375 1.00 0.00 H new ATOM 0 HB3 PHE A 41 27.540 35.703 21.004 1.00 0.00 H new ATOM 0 HD1 PHE A 41 30.196 35.291 18.386 1.00 0.00 H new ATOM 0 HD2 PHE A 41 29.014 37.248 22.038 1.00 0.00 H new ATOM 0 HE1 PHE A 41 32.123 36.846 18.182 1.00 0.00 H new ATOM 0 HE2 PHE A 41 30.915 38.827 21.808 1.00 0.00 H new ATOM 0 HZ PHE A 41 32.459 38.642 19.869 1.00 0.00 H new ATOM 687 N ILE A 42 27.344 33.663 22.966 1.00 0.00 N ATOM 688 CA ILE A 42 26.185 33.437 23.842 1.00 0.00 C ATOM 689 C ILE A 42 25.619 34.800 24.266 1.00 0.00 C ATOM 690 O ILE A 42 26.372 35.770 24.364 1.00 0.00 O ATOM 691 CB ILE A 42 26.612 32.517 25.020 1.00 0.00 C ATOM 692 CG1 ILE A 42 26.198 31.064 24.709 1.00 0.00 C ATOM 693 CG2 ILE A 42 26.072 32.956 26.392 1.00 0.00 C ATOM 694 CD1 ILE A 42 26.830 30.012 25.630 1.00 0.00 C ATOM 0 H ILE A 42 28.093 34.171 23.436 1.00 0.00 H new ATOM 0 HA ILE A 42 25.376 32.914 23.332 1.00 0.00 H new ATOM 0 HB ILE A 42 27.696 32.596 25.102 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.113 30.986 24.779 1.00 0.00 H new ATOM 0 HG13 ILE A 42 26.468 30.835 23.678 1.00 0.00 H new ATOM 0 HG21 ILE A 42 26.416 32.261 27.158 1.00 0.00 H new ATOM 0 HG22 ILE A 42 26.434 33.958 26.622 1.00 0.00 H new ATOM 0 HG23 ILE A 42 24.982 32.961 26.370 1.00 0.00 H new ATOM 0 HD11 ILE A 42 26.484 29.020 25.340 1.00 0.00 H new ATOM 0 HD12 ILE A 42 27.916 30.058 25.543 1.00 0.00 H new ATOM 0 HD13 ILE A 42 26.540 30.210 26.662 1.00 0.00 H new ATOM 706 N GLN A 43 24.320 34.881 24.553 1.00 0.00 N ATOM 707 CA GLN A 43 23.698 36.056 25.169 1.00 0.00 C ATOM 708 C GLN A 43 22.729 35.596 26.266 1.00 0.00 C ATOM 709 O GLN A 43 21.695 35.013 25.958 1.00 0.00 O ATOM 710 CB GLN A 43 23.024 36.901 24.077 1.00 0.00 C ATOM 711 CG GLN A 43 22.679 38.315 24.565 1.00 0.00 C ATOM 712 CD GLN A 43 22.084 39.196 23.471 1.00 0.00 C ATOM 713 OE1 GLN A 43 21.670 38.748 22.403 1.00 0.00 O ATOM 714 NE2 GLN A 43 22.008 40.486 23.696 1.00 0.00 N ATOM 0 H GLN A 43 23.662 34.125 24.363 1.00 0.00 H new ATOM 0 HA GLN A 43 24.442 36.692 25.649 1.00 0.00 H new ATOM 0 HB2 GLN A 43 23.685 36.968 23.213 1.00 0.00 H new ATOM 0 HB3 GLN A 43 22.114 36.402 23.744 1.00 0.00 H new ATOM 0 HG2 GLN A 43 21.972 38.245 25.392 1.00 0.00 H new ATOM 0 HG3 GLN A 43 23.580 38.789 24.955 1.00 0.00 H new ATOM 0 HE21 GLN A 43 22.348 40.871 24.577 1.00 0.00 H new ATOM 0 HE22 GLN A 43 21.609 41.104 22.990 1.00 0.00 H new ATOM 723 N PHE A 44 23.075 35.804 27.540 1.00 0.00 N ATOM 724 CA PHE A 44 22.395 35.233 28.715 1.00 0.00 C ATOM 725 C PHE A 44 21.993 36.300 29.747 1.00 0.00 C ATOM 726 O PHE A 44 22.551 37.395 29.793 1.00 0.00 O ATOM 727 CB PHE A 44 23.270 34.145 29.377 1.00 0.00 C ATOM 728 CG PHE A 44 23.429 32.791 28.688 1.00 0.00 C ATOM 729 CD1 PHE A 44 22.629 32.378 27.599 1.00 0.00 C ATOM 730 CD2 PHE A 44 24.394 31.896 29.191 1.00 0.00 C ATOM 731 CE1 PHE A 44 22.820 31.121 26.998 1.00 0.00 C ATOM 732 CE2 PHE A 44 24.568 30.630 28.605 1.00 0.00 C ATOM 733 CZ PHE A 44 23.788 30.243 27.504 1.00 0.00 C ATOM 0 H PHE A 44 23.865 36.396 27.795 1.00 0.00 H new ATOM 0 HA PHE A 44 21.473 34.779 28.352 1.00 0.00 H new ATOM 0 HB2 PHE A 44 24.268 34.564 29.511 1.00 0.00 H new ATOM 0 HB3 PHE A 44 22.866 33.960 30.372 1.00 0.00 H new ATOM 0 HD1 PHE A 44 21.860 33.037 27.223 1.00 0.00 H new ATOM 0 HD2 PHE A 44 25.005 32.185 30.033 1.00 0.00 H new ATOM 0 HE1 PHE A 44 22.221 30.832 26.147 1.00 0.00 H new ATOM 0 HE2 PHE A 44 25.307 29.951 29.005 1.00 0.00 H new ATOM 0 HZ PHE A 44 23.933 29.274 27.049 1.00 0.00 H new ATOM 743 N ASP A 45 21.021 35.962 30.596 1.00 0.00 N ATOM 744 CA ASP A 45 20.628 36.740 31.772 1.00 0.00 C ATOM 745 C ASP A 45 21.439 36.295 33.017 1.00 0.00 C ATOM 746 O ASP A 45 21.791 35.119 33.149 1.00 0.00 O ATOM 747 CB ASP A 45 19.100 36.626 31.918 1.00 0.00 C ATOM 748 CG ASP A 45 18.464 37.684 32.821 1.00 0.00 C ATOM 749 OD1 ASP A 45 19.115 38.149 33.781 1.00 0.00 O ATOM 750 OD2 ASP A 45 17.311 38.096 32.569 1.00 0.00 O ATOM 0 H ASP A 45 20.468 35.113 30.480 1.00 0.00 H new ATOM 0 HA ASP A 45 20.867 37.798 31.660 1.00 0.00 H new ATOM 0 HB2 ASP A 45 18.648 36.693 30.928 1.00 0.00 H new ATOM 0 HB3 ASP A 45 18.859 35.639 32.312 1.00 0.00 H new ATOM 755 N ASN A 46 21.715 37.244 33.921 1.00 0.00 N ATOM 756 CA ASN A 46 22.719 37.250 34.999 1.00 0.00 C ATOM 757 C ASN A 46 24.203 37.259 34.527 1.00 0.00 C ATOM 758 O ASN A 46 24.840 36.201 34.481 1.00 0.00 O ATOM 759 CB ASN A 46 22.412 36.167 36.053 1.00 0.00 C ATOM 760 CG ASN A 46 23.280 36.306 37.295 1.00 0.00 C ATOM 761 OD1 ASN A 46 24.253 37.047 37.335 1.00 0.00 O ATOM 762 ND2 ASN A 46 22.988 35.568 38.331 1.00 0.00 N ATOM 0 H ASN A 46 21.188 38.117 33.917 1.00 0.00 H new ATOM 0 HA ASN A 46 22.619 38.220 35.486 1.00 0.00 H new ATOM 0 HB2 ASN A 46 21.362 36.228 36.338 1.00 0.00 H new ATOM 0 HB3 ASN A 46 22.566 35.182 35.613 1.00 0.00 H new ATOM 0 HD21 ASN A 46 23.570 35.611 39.168 1.00 0.00 H new ATOM 0 HD22 ASN A 46 22.178 34.948 38.304 1.00 0.00 H new ATOM 769 N PRO A 47 24.815 38.438 34.261 1.00 0.00 N ATOM 770 CA PRO A 47 26.246 38.557 33.935 1.00 0.00 C ATOM 771 C PRO A 47 27.201 38.038 35.021 1.00 0.00 C ATOM 772 O PRO A 47 28.267 37.524 34.683 1.00 0.00 O ATOM 773 CB PRO A 47 26.508 40.051 33.691 1.00 0.00 C ATOM 774 CG PRO A 47 25.358 40.750 34.408 1.00 0.00 C ATOM 775 CD PRO A 47 24.205 39.762 34.270 1.00 0.00 C ATOM 0 HA PRO A 47 26.449 37.931 33.066 1.00 0.00 H new ATOM 0 HB2 PRO A 47 27.474 40.358 34.093 1.00 0.00 H new ATOM 0 HB3 PRO A 47 26.516 40.286 32.627 1.00 0.00 H new ATOM 0 HG2 PRO A 47 25.596 40.947 35.453 1.00 0.00 H new ATOM 0 HG3 PRO A 47 25.122 41.710 33.949 1.00 0.00 H new ATOM 0 HD2 PRO A 47 23.502 39.863 35.097 1.00 0.00 H new ATOM 0 HD3 PRO A 47 23.645 39.941 33.352 1.00 0.00 H new ATOM 783 N GLN A 48 26.840 38.110 36.307 1.00 0.00 N ATOM 784 CA GLN A 48 27.707 37.627 37.394 1.00 0.00 C ATOM 785 C GLN A 48 27.853 36.104 37.348 1.00 0.00 C ATOM 786 O GLN A 48 28.950 35.586 37.559 1.00 0.00 O ATOM 787 CB GLN A 48 27.174 38.068 38.764 1.00 0.00 C ATOM 788 CG GLN A 48 27.120 39.595 38.899 1.00 0.00 C ATOM 789 CD GLN A 48 26.542 40.051 40.231 1.00 0.00 C ATOM 790 OE1 GLN A 48 26.483 39.331 41.222 1.00 0.00 O ATOM 791 NE2 GLN A 48 26.065 41.267 40.308 1.00 0.00 N ATOM 0 H GLN A 48 25.952 38.499 36.624 1.00 0.00 H new ATOM 0 HA GLN A 48 28.692 38.071 37.249 1.00 0.00 H new ATOM 0 HB2 GLN A 48 26.176 37.656 38.914 1.00 0.00 H new ATOM 0 HB3 GLN A 48 27.809 37.658 39.549 1.00 0.00 H new ATOM 0 HG2 GLN A 48 28.126 40.001 38.787 1.00 0.00 H new ATOM 0 HG3 GLN A 48 26.519 40.006 38.088 1.00 0.00 H new ATOM 0 HE21 GLN A 48 26.104 41.883 39.496 1.00 0.00 H new ATOM 0 HE22 GLN A 48 25.654 41.599 41.180 1.00 0.00 H new ATOM 800 N SER A 49 26.783 35.394 36.976 1.00 0.00 N ATOM 801 CA SER A 49 26.834 33.952 36.721 1.00 0.00 C ATOM 802 C SER A 49 27.659 33.605 35.476 1.00 0.00 C ATOM 803 O SER A 49 28.424 32.647 35.505 1.00 0.00 O ATOM 804 CB SER A 49 25.427 33.373 36.608 1.00 0.00 C ATOM 805 OG SER A 49 24.849 33.661 35.349 1.00 0.00 O ATOM 0 H SER A 49 25.858 35.803 36.843 1.00 0.00 H new ATOM 0 HA SER A 49 27.337 33.498 37.575 1.00 0.00 H new ATOM 0 HB2 SER A 49 25.463 32.294 36.755 1.00 0.00 H new ATOM 0 HB3 SER A 49 24.799 33.781 37.400 1.00 0.00 H new ATOM 0 HG SER A 49 24.773 34.632 35.238 1.00 0.00 H new ATOM 811 N VAL A 50 27.588 34.415 34.408 1.00 0.00 N ATOM 812 CA VAL A 50 28.418 34.251 33.201 1.00 0.00 C ATOM 813 C VAL A 50 29.897 34.447 33.549 1.00 0.00 C ATOM 814 O VAL A 50 30.746 33.675 33.106 1.00 0.00 O ATOM 815 CB VAL A 50 27.962 35.215 32.081 1.00 0.00 C ATOM 816 CG1 VAL A 50 28.832 35.136 30.821 1.00 0.00 C ATOM 817 CG2 VAL A 50 26.526 34.910 31.634 1.00 0.00 C ATOM 0 H VAL A 50 26.949 35.208 34.356 1.00 0.00 H new ATOM 0 HA VAL A 50 28.292 33.237 32.823 1.00 0.00 H new ATOM 0 HB VAL A 50 28.045 36.208 32.523 1.00 0.00 H new ATOM 0 HG11 VAL A 50 28.457 35.837 30.076 1.00 0.00 H new ATOM 0 HG12 VAL A 50 29.862 35.390 31.073 1.00 0.00 H new ATOM 0 HG13 VAL A 50 28.797 34.124 30.417 1.00 0.00 H new ATOM 0 HG21 VAL A 50 26.235 35.605 30.846 1.00 0.00 H new ATOM 0 HG22 VAL A 50 26.472 33.889 31.256 1.00 0.00 H new ATOM 0 HG23 VAL A 50 25.850 35.019 32.482 1.00 0.00 H new ATOM 827 N ARG A 51 30.222 35.423 34.405 1.00 0.00 N ATOM 828 CA ARG A 51 31.589 35.646 34.890 1.00 0.00 C ATOM 829 C ARG A 51 32.069 34.566 35.866 1.00 0.00 C ATOM 830 O ARG A 51 33.240 34.190 35.807 1.00 0.00 O ATOM 831 CB ARG A 51 31.682 37.061 35.485 1.00 0.00 C ATOM 832 CG ARG A 51 33.072 37.396 36.043 1.00 0.00 C ATOM 833 CD ARG A 51 34.208 37.209 35.017 1.00 0.00 C ATOM 834 NE ARG A 51 35.541 37.384 35.617 1.00 0.00 N ATOM 835 CZ ARG A 51 36.109 36.591 36.507 1.00 0.00 C ATOM 836 NH1 ARG A 51 35.545 35.506 36.945 1.00 0.00 N ATOM 837 NH2 ARG A 51 37.277 36.871 36.984 1.00 0.00 N ATOM 0 H ARG A 51 29.542 36.083 34.782 1.00 0.00 H new ATOM 0 HA ARG A 51 32.271 35.568 34.043 1.00 0.00 H new ATOM 0 HB2 ARG A 51 31.422 37.789 34.716 1.00 0.00 H new ATOM 0 HB3 ARG A 51 30.945 37.162 36.281 1.00 0.00 H new ATOM 0 HG2 ARG A 51 33.075 38.428 36.393 1.00 0.00 H new ATOM 0 HG3 ARG A 51 33.269 36.765 36.910 1.00 0.00 H new ATOM 0 HD2 ARG A 51 34.138 36.213 34.579 1.00 0.00 H new ATOM 0 HD3 ARG A 51 34.082 37.925 34.205 1.00 0.00 H new ATOM 0 HE ARG A 51 36.078 38.197 35.316 1.00 0.00 H new ATOM 0 HH11 ARG A 51 34.624 35.235 36.601 1.00 0.00 H new ATOM 0 HH12 ARG A 51 36.023 34.925 37.633 1.00 0.00 H new ATOM 0 HH21 ARG A 51 37.767 37.710 36.673 1.00 0.00 H new ATOM 0 HH22 ARG A 51 37.709 36.253 37.671 1.00 0.00 H new ATOM 851 N ASP A 52 31.196 34.038 36.720 1.00 0.00 N ATOM 852 CA ASP A 52 31.483 32.891 37.593 1.00 0.00 C ATOM 853 C ASP A 52 31.685 31.593 36.781 1.00 0.00 C ATOM 854 O ASP A 52 32.510 30.741 37.123 1.00 0.00 O ATOM 855 CB ASP A 52 30.344 32.756 38.612 1.00 0.00 C ATOM 856 CG ASP A 52 30.567 31.625 39.615 1.00 0.00 C ATOM 857 OD1 ASP A 52 31.696 31.470 40.134 1.00 0.00 O ATOM 858 OD2 ASP A 52 29.590 30.900 39.918 1.00 0.00 O ATOM 0 H ASP A 52 30.249 34.399 36.831 1.00 0.00 H new ATOM 0 HA ASP A 52 32.420 33.063 38.122 1.00 0.00 H new ATOM 0 HB2 ASP A 52 30.235 33.696 39.152 1.00 0.00 H new ATOM 0 HB3 ASP A 52 29.408 32.583 38.081 1.00 0.00 H new ATOM 863 N ALA A 53 30.997 31.470 35.646 1.00 0.00 N ATOM 864 CA ALA A 53 31.178 30.382 34.699 1.00 0.00 C ATOM 865 C ALA A 53 32.514 30.482 33.931 1.00 0.00 C ATOM 866 O ALA A 53 33.133 29.451 33.669 1.00 0.00 O ATOM 867 CB ALA A 53 29.957 30.350 33.781 1.00 0.00 C ATOM 0 H ALA A 53 30.285 32.141 35.358 1.00 0.00 H new ATOM 0 HA ALA A 53 31.248 29.434 35.233 1.00 0.00 H new ATOM 0 HB1 ALA A 53 30.066 29.541 33.058 1.00 0.00 H new ATOM 0 HB2 ALA A 53 29.059 30.186 34.376 1.00 0.00 H new ATOM 0 HB3 ALA A 53 29.874 31.300 33.253 1.00 0.00 H new ATOM 873 N ILE A 54 33.027 31.688 33.637 1.00 0.00 N ATOM 874 CA ILE A 54 34.371 31.868 33.044 1.00 0.00 C ATOM 875 C ILE A 54 35.448 31.303 33.971 1.00 0.00 C ATOM 876 O ILE A 54 36.277 30.511 33.530 1.00 0.00 O ATOM 877 CB ILE A 54 34.658 33.344 32.671 1.00 0.00 C ATOM 878 CG1 ILE A 54 33.796 33.753 31.463 1.00 0.00 C ATOM 879 CG2 ILE A 54 36.150 33.577 32.345 1.00 0.00 C ATOM 880 CD1 ILE A 54 33.864 35.234 31.099 1.00 0.00 C ATOM 0 H ILE A 54 32.529 32.563 33.801 1.00 0.00 H new ATOM 0 HA ILE A 54 34.394 31.306 32.111 1.00 0.00 H new ATOM 0 HB ILE A 54 34.405 33.958 33.535 1.00 0.00 H new ATOM 0 HG12 ILE A 54 34.106 33.166 30.598 1.00 0.00 H new ATOM 0 HG13 ILE A 54 32.758 33.492 31.670 1.00 0.00 H new ATOM 0 HG21 ILE A 54 36.307 34.625 32.089 1.00 0.00 H new ATOM 0 HG22 ILE A 54 36.757 33.321 33.214 1.00 0.00 H new ATOM 0 HG23 ILE A 54 36.440 32.950 31.502 1.00 0.00 H new ATOM 0 HD11 ILE A 54 33.225 35.427 30.237 1.00 0.00 H new ATOM 0 HD12 ILE A 54 33.524 35.832 31.944 1.00 0.00 H new ATOM 0 HD13 ILE A 54 34.892 35.502 30.856 1.00 0.00 H new ATOM 892 N GLU A 55 35.429 31.657 35.255 1.00 0.00 N ATOM 893 CA GLU A 55 36.414 31.156 36.226 1.00 0.00 C ATOM 894 C GLU A 55 36.208 29.680 36.617 1.00 0.00 C ATOM 895 O GLU A 55 37.133 29.055 37.143 1.00 0.00 O ATOM 896 CB GLU A 55 36.449 32.063 37.462 1.00 0.00 C ATOM 897 CG GLU A 55 35.082 32.141 38.141 1.00 0.00 C ATOM 898 CD GLU A 55 35.114 32.961 39.419 1.00 0.00 C ATOM 899 OE1 GLU A 55 35.143 34.211 39.358 1.00 0.00 O ATOM 900 OE2 GLU A 55 35.106 32.346 40.505 1.00 0.00 O ATOM 0 H GLU A 55 34.739 32.293 35.654 1.00 0.00 H new ATOM 0 HA GLU A 55 37.384 31.188 35.729 1.00 0.00 H new ATOM 0 HB2 GLU A 55 37.187 31.686 38.170 1.00 0.00 H new ATOM 0 HB3 GLU A 55 36.769 33.063 37.171 1.00 0.00 H new ATOM 0 HG2 GLU A 55 34.361 32.578 37.450 1.00 0.00 H new ATOM 0 HG3 GLU A 55 34.735 31.133 38.368 1.00 0.00 H new ATOM 907 N CYS A 56 35.024 29.121 36.342 1.00 0.00 N ATOM 908 CA CYS A 56 34.719 27.696 36.452 1.00 0.00 C ATOM 909 C CYS A 56 35.305 26.908 35.271 1.00 0.00 C ATOM 910 O CYS A 56 36.101 25.986 35.448 1.00 0.00 O ATOM 911 CB CYS A 56 33.188 27.532 36.499 1.00 0.00 C ATOM 912 SG CYS A 56 32.737 25.792 36.709 1.00 0.00 S ATOM 0 H CYS A 56 34.225 29.671 36.026 1.00 0.00 H new ATOM 0 HA CYS A 56 35.170 27.299 37.361 1.00 0.00 H new ATOM 0 HB2 CYS A 56 32.779 28.120 37.321 1.00 0.00 H new ATOM 0 HB3 CYS A 56 32.747 27.919 35.580 1.00 0.00 H new ATOM 0 HG CYS A 56 33.735 25.039 36.352 1.00 0.00 H new ATOM 918 N GLU A 57 34.905 27.260 34.047 1.00 0.00 N ATOM 919 CA GLU A 57 35.164 26.460 32.853 1.00 0.00 C ATOM 920 C GLU A 57 36.490 26.842 32.188 1.00 0.00 C ATOM 921 O GLU A 57 37.295 25.957 31.909 1.00 0.00 O ATOM 922 CB GLU A 57 33.963 26.589 31.899 1.00 0.00 C ATOM 923 CG GLU A 57 33.895 25.488 30.833 1.00 0.00 C ATOM 924 CD GLU A 57 33.711 24.101 31.457 1.00 0.00 C ATOM 925 OE1 GLU A 57 32.611 23.779 31.969 1.00 0.00 O ATOM 926 OE2 GLU A 57 34.672 23.302 31.449 1.00 0.00 O ATOM 0 H GLU A 57 34.387 28.118 33.858 1.00 0.00 H new ATOM 0 HA GLU A 57 35.273 25.413 33.134 1.00 0.00 H new ATOM 0 HB2 GLU A 57 33.043 26.572 32.484 1.00 0.00 H new ATOM 0 HB3 GLU A 57 34.008 27.559 31.403 1.00 0.00 H new ATOM 0 HG2 GLU A 57 33.069 25.692 30.152 1.00 0.00 H new ATOM 0 HG3 GLU A 57 34.809 25.501 30.239 1.00 0.00 H new ATOM 933 N SER A 58 36.779 28.140 32.031 1.00 0.00 N ATOM 934 CA SER A 58 38.046 28.666 31.487 1.00 0.00 C ATOM 935 C SER A 58 39.198 28.637 32.505 1.00 0.00 C ATOM 936 O SER A 58 40.209 29.322 32.331 1.00 0.00 O ATOM 937 CB SER A 58 37.859 30.089 30.938 1.00 0.00 C ATOM 938 OG SER A 58 38.622 30.281 29.766 1.00 0.00 O ATOM 0 H SER A 58 36.122 28.878 32.285 1.00 0.00 H new ATOM 0 HA SER A 58 38.326 27.999 30.672 1.00 0.00 H new ATOM 0 HB2 SER A 58 36.805 30.265 30.723 1.00 0.00 H new ATOM 0 HB3 SER A 58 38.156 30.817 31.693 1.00 0.00 H new ATOM 0 HG SER A 58 39.563 30.077 29.951 1.00 0.00 H new ATOM 944 N GLN A 59 39.057 27.879 33.598 1.00 0.00 N ATOM 945 CA GLN A 59 40.090 27.734 34.622 1.00 0.00 C ATOM 946 C GLN A 59 41.392 27.198 34.005 1.00 0.00 C ATOM 947 O GLN A 59 41.358 26.346 33.110 1.00 0.00 O ATOM 948 CB GLN A 59 39.569 26.834 35.749 1.00 0.00 C ATOM 949 CG GLN A 59 40.406 26.968 37.031 1.00 0.00 C ATOM 950 CD GLN A 59 39.917 26.072 38.163 1.00 0.00 C ATOM 951 OE1 GLN A 59 39.016 25.255 38.013 1.00 0.00 O ATOM 952 NE2 GLN A 59 40.526 26.177 39.322 1.00 0.00 N ATOM 0 H GLN A 59 38.211 27.344 33.796 1.00 0.00 H new ATOM 0 HA GLN A 59 40.323 28.709 35.050 1.00 0.00 H new ATOM 0 HB2 GLN A 59 38.532 27.089 35.966 1.00 0.00 H new ATOM 0 HB3 GLN A 59 39.579 25.796 35.417 1.00 0.00 H new ATOM 0 HG2 GLN A 59 41.445 26.725 36.806 1.00 0.00 H new ATOM 0 HG3 GLN A 59 40.386 28.006 37.363 1.00 0.00 H new ATOM 0 HE21 GLN A 59 41.276 26.858 39.444 1.00 0.00 H new ATOM 0 HE22 GLN A 59 40.249 25.578 40.100 1.00 0.00 H new ATOM 1097 N ILE A 68 39.717 29.935 26.233 1.00 0.00 N ATOM 1098 CA ILE A 68 39.486 31.380 26.108 1.00 0.00 C ATOM 1099 C ILE A 68 37.975 31.650 26.060 1.00 0.00 C ATOM 1100 O ILE A 68 37.314 31.360 25.056 1.00 0.00 O ATOM 1101 CB ILE A 68 40.205 31.954 24.861 1.00 0.00 C ATOM 1102 CG1 ILE A 68 41.740 31.776 24.965 1.00 0.00 C ATOM 1103 CG2 ILE A 68 39.848 33.443 24.688 1.00 0.00 C ATOM 1104 CD1 ILE A 68 42.532 32.284 23.752 1.00 0.00 C ATOM 0 HA ILE A 68 39.906 31.887 26.977 1.00 0.00 H new ATOM 0 HB ILE A 68 39.865 31.400 23.986 1.00 0.00 H new ATOM 0 HG12 ILE A 68 42.092 32.297 25.855 1.00 0.00 H new ATOM 0 HG13 ILE A 68 41.960 30.718 25.107 1.00 0.00 H new ATOM 0 HG21 ILE A 68 40.357 33.840 23.810 1.00 0.00 H new ATOM 0 HG22 ILE A 68 38.770 33.546 24.560 1.00 0.00 H new ATOM 0 HG23 ILE A 68 40.164 33.998 25.572 1.00 0.00 H new ATOM 0 HD11 ILE A 68 43.596 32.117 23.917 1.00 0.00 H new ATOM 0 HD12 ILE A 68 42.214 31.746 22.859 1.00 0.00 H new ATOM 0 HD13 ILE A 68 42.349 33.350 23.618 1.00 0.00 H new ATOM 1116 N LEU A 69 37.458 32.236 27.141 1.00 0.00 N ATOM 1117 CA LEU A 69 36.089 32.733 27.313 1.00 0.00 C ATOM 1118 C LEU A 69 36.146 34.175 27.859 1.00 0.00 C ATOM 1119 O LEU A 69 36.956 34.463 28.742 1.00 0.00 O ATOM 1120 CB LEU A 69 35.312 31.824 28.291 1.00 0.00 C ATOM 1121 CG LEU A 69 35.309 30.311 27.996 1.00 0.00 C ATOM 1122 CD1 LEU A 69 34.513 29.560 29.066 1.00 0.00 C ATOM 1123 CD2 LEU A 69 34.646 29.971 26.666 1.00 0.00 C ATOM 0 H LEU A 69 38.022 32.387 27.977 1.00 0.00 H new ATOM 0 HA LEU A 69 35.573 32.725 26.353 1.00 0.00 H new ATOM 0 HB2 LEU A 69 35.723 31.973 29.289 1.00 0.00 H new ATOM 0 HB3 LEU A 69 34.277 32.165 28.319 1.00 0.00 H new ATOM 0 HG LEU A 69 36.358 30.016 27.976 1.00 0.00 H new ATOM 0 HD11 LEU A 69 34.521 28.493 28.843 1.00 0.00 H new ATOM 0 HD12 LEU A 69 34.966 29.730 30.043 1.00 0.00 H new ATOM 0 HD13 LEU A 69 33.485 29.921 29.075 1.00 0.00 H new ATOM 0 HD21 LEU A 69 34.673 28.892 26.511 1.00 0.00 H new ATOM 0 HD22 LEU A 69 33.610 30.310 26.679 1.00 0.00 H new ATOM 0 HD23 LEU A 69 35.180 30.467 25.856 1.00 0.00 H new ATOM 1135 N GLU A 70 35.295 35.075 27.367 1.00 0.00 N ATOM 1136 CA GLU A 70 35.282 36.493 27.766 1.00 0.00 C ATOM 1137 C GLU A 70 33.852 37.044 27.874 1.00 0.00 C ATOM 1138 O GLU A 70 33.057 36.896 26.948 1.00 0.00 O ATOM 1139 CB GLU A 70 36.094 37.298 26.739 1.00 0.00 C ATOM 1140 CG GLU A 70 36.137 38.811 27.002 1.00 0.00 C ATOM 1141 CD GLU A 70 37.075 39.190 28.144 1.00 0.00 C ATOM 1142 OE1 GLU A 70 36.793 38.875 29.325 1.00 0.00 O ATOM 1143 OE2 GLU A 70 38.117 39.832 27.869 1.00 0.00 O ATOM 0 H GLU A 70 34.585 34.843 26.672 1.00 0.00 H new ATOM 0 HA GLU A 70 35.730 36.584 28.755 1.00 0.00 H new ATOM 0 HB2 GLU A 70 37.115 36.916 26.723 1.00 0.00 H new ATOM 0 HB3 GLU A 70 35.674 37.127 25.748 1.00 0.00 H new ATOM 0 HG2 GLU A 70 36.454 39.323 26.094 1.00 0.00 H new ATOM 0 HG3 GLU A 70 35.132 39.163 27.233 1.00 0.00 H new ATOM 1150 N VAL A 71 33.521 37.719 28.980 1.00 0.00 N ATOM 1151 CA VAL A 71 32.201 38.347 29.166 1.00 0.00 C ATOM 1152 C VAL A 71 32.208 39.799 28.687 1.00 0.00 C ATOM 1153 O VAL A 71 33.099 40.576 29.036 1.00 0.00 O ATOM 1154 CB VAL A 71 31.680 38.186 30.611 1.00 0.00 C ATOM 1155 CG1 VAL A 71 32.502 38.931 31.667 1.00 0.00 C ATOM 1156 CG2 VAL A 71 30.215 38.611 30.732 1.00 0.00 C ATOM 0 H VAL A 71 34.154 37.847 29.770 1.00 0.00 H new ATOM 0 HA VAL A 71 31.487 37.815 28.537 1.00 0.00 H new ATOM 0 HB VAL A 71 31.782 37.120 30.816 1.00 0.00 H new ATOM 0 HG11 VAL A 71 32.066 38.764 32.652 1.00 0.00 H new ATOM 0 HG12 VAL A 71 33.528 38.562 31.656 1.00 0.00 H new ATOM 0 HG13 VAL A 71 32.498 39.998 31.445 1.00 0.00 H new ATOM 0 HG21 VAL A 71 29.883 38.484 31.762 1.00 0.00 H new ATOM 0 HG22 VAL A 71 30.115 39.658 30.445 1.00 0.00 H new ATOM 0 HG23 VAL A 71 29.602 37.994 30.075 1.00 0.00 H new ATOM 1166 N SER A 72 31.177 40.181 27.938 1.00 0.00 N ATOM 1167 CA SER A 72 30.763 41.564 27.692 1.00 0.00 C ATOM 1168 C SER A 72 29.439 41.807 28.405 1.00 0.00 C ATOM 1169 O SER A 72 28.371 41.411 27.930 1.00 0.00 O ATOM 1170 CB SER A 72 30.695 41.865 26.194 1.00 0.00 C ATOM 1171 OG SER A 72 31.891 42.514 25.813 1.00 0.00 O ATOM 0 H SER A 72 30.578 39.505 27.463 1.00 0.00 H new ATOM 0 HA SER A 72 31.504 42.254 28.095 1.00 0.00 H new ATOM 0 HB2 SER A 72 30.567 40.943 25.628 1.00 0.00 H new ATOM 0 HB3 SER A 72 29.834 42.496 25.973 1.00 0.00 H new ATOM 0 HG SER A 72 31.864 42.713 24.854 1.00 0.00 H new ATOM 1177 N SER A 73 29.505 42.432 29.580 1.00 0.00 N ATOM 1178 CA SER A 73 28.385 42.583 30.524 1.00 0.00 C ATOM 1179 C SER A 73 27.374 43.671 30.128 1.00 0.00 C ATOM 1180 O SER A 73 26.798 44.339 30.988 1.00 0.00 O ATOM 1181 CB SER A 73 28.926 42.780 31.943 1.00 0.00 C ATOM 1182 OG SER A 73 29.766 41.695 32.275 1.00 0.00 O ATOM 0 H SER A 73 30.366 42.863 29.917 1.00 0.00 H new ATOM 0 HA SER A 73 27.810 41.658 30.489 1.00 0.00 H new ATOM 0 HB2 SER A 73 29.480 43.717 32.007 1.00 0.00 H new ATOM 0 HB3 SER A 73 28.102 42.848 32.653 1.00 0.00 H new ATOM 0 HG SER A 73 30.116 41.818 33.182 1.00 0.00 H new