USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=14 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 55 THR OG1 : rot -100:sc= 1.38 USER MOD Set 1.2: A 57 SER OG : rot -82:sc= 0.78 USER MOD Set 2.1: A 22 THR OG1 : rot -56:sc= 1.2 USER MOD Set 2.2: A 25 ASN : amide:sc= 1.6 K(o=2.8,f=-6.8!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 169:sc= 1.71 (180deg=1.6) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.048) USER MOD Single : A 11 LYS NZ :NH3+ -147:sc= 0.893 (180deg=0.0244!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -80:sc= 0.249 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00645 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 2.04 (180deg=2.04) USER MOD Single : A 29 LYS NZ :NH3+ 161:sc= 2.1 (180deg=1.43) USER MOD Single : A 31 GLN : amide:sc= -0.0215 K(o=-0.021,f=-0.54) USER MOD Single : A 33 LYS NZ :NH3+ -179:sc= 1.21 (180deg=1.21) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 41 GLN : amide:sc= 1.15 K(o=1.2,f=-3.5!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 59 TYR OH : rot 30:sc= 0.251 USER MOD Single : A 60 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 73:sc= 1.32 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.0297 X(o=-0.03,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 33.148 52.078 19.659 1.00 0.00 N ATOM 2 CA MET A 1 33.209 52.408 21.090 1.00 0.00 C ATOM 3 C MET A 1 34.668 52.621 21.505 1.00 0.00 C ATOM 4 O MET A 1 35.558 52.035 20.892 1.00 0.00 O ATOM 5 CB MET A 1 32.518 51.371 21.970 1.00 0.00 C ATOM 6 CG MET A 1 33.143 49.978 21.958 1.00 0.00 C ATOM 7 SD MET A 1 32.404 48.822 23.139 1.00 0.00 S ATOM 8 CE MET A 1 33.532 47.420 22.952 1.00 0.00 C ATOM 0 H1 MET A 1 32.190 51.753 19.418 1.00 0.00 H new ATOM 0 H2 MET A 1 33.378 52.923 19.098 1.00 0.00 H new ATOM 0 H3 MET A 1 33.833 51.324 19.447 1.00 0.00 H new ATOM 0 HA MET A 1 32.655 53.334 21.242 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.510 51.738 22.996 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.478 51.287 21.654 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.054 49.561 20.955 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.208 50.068 22.173 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.221 46.612 23.614 1.00 0.00 H new ATOM 0 HE2 MET A 1 33.512 47.072 21.919 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.544 47.731 23.210 1.00 0.00 H new ATOM 20 N GLN A 2 34.915 53.432 22.529 1.00 0.00 N ATOM 21 CA GLN A 2 36.251 53.743 22.996 1.00 0.00 C ATOM 22 C GLN A 2 36.804 52.654 23.918 1.00 0.00 C ATOM 23 O GLN A 2 36.075 52.156 24.773 1.00 0.00 O ATOM 24 CB GLN A 2 36.245 55.080 23.729 1.00 0.00 C ATOM 25 CG GLN A 2 35.889 56.280 22.855 1.00 0.00 C ATOM 26 CD GLN A 2 35.831 57.563 23.685 1.00 0.00 C ATOM 27 OE1 GLN A 2 35.078 57.679 24.650 1.00 0.00 O ATOM 28 NE2 GLN A 2 36.620 58.585 23.366 1.00 0.00 N ATOM 0 H GLN A 2 34.179 53.895 23.062 1.00 0.00 H new ATOM 0 HA GLN A 2 36.900 53.800 22.122 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.535 55.024 24.554 1.00 0.00 H new ATOM 0 HB3 GLN A 2 37.230 55.245 24.166 1.00 0.00 H new ATOM 0 HG2 GLN A 2 36.628 56.389 22.062 1.00 0.00 H new ATOM 0 HG3 GLN A 2 34.926 56.111 22.373 1.00 0.00 H new ATOM 0 HE21 GLN A 2 37.253 58.511 22.569 1.00 0.00 H new ATOM 0 HE22 GLN A 2 36.592 59.442 23.918 1.00 0.00 H new ATOM 37 N ILE A 3 38.098 52.361 23.824 1.00 0.00 N ATOM 38 CA ILE A 3 38.875 51.685 24.844 1.00 0.00 C ATOM 39 C ILE A 3 40.231 52.369 25.030 1.00 0.00 C ATOM 40 O ILE A 3 40.689 53.090 24.147 1.00 0.00 O ATOM 41 CB ILE A 3 39.050 50.194 24.569 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.803 49.915 23.271 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.715 49.456 24.633 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.264 48.471 23.101 1.00 0.00 C ATOM 0 H ILE A 3 38.650 52.600 23.000 1.00 0.00 H new ATOM 0 HA ILE A 3 38.309 51.762 25.772 1.00 0.00 H new ATOM 0 HB ILE A 3 39.679 49.799 25.367 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.161 50.179 22.430 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.674 50.568 23.224 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.875 48.397 24.433 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.280 49.576 25.625 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.035 49.868 23.887 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.789 48.366 22.152 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.935 48.205 23.918 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.398 47.809 23.112 1.00 0.00 H new ATOM 56 N PHE A 4 40.894 52.104 26.151 1.00 0.00 N ATOM 57 CA PHE A 4 42.212 52.618 26.462 1.00 0.00 C ATOM 58 C PHE A 4 43.210 51.480 26.687 1.00 0.00 C ATOM 59 O PHE A 4 42.885 50.514 27.374 1.00 0.00 O ATOM 60 CB PHE A 4 42.135 53.542 27.674 1.00 0.00 C ATOM 61 CG PHE A 4 41.084 54.621 27.574 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.287 55.732 26.745 1.00 0.00 C ATOM 63 CD2 PHE A 4 39.878 54.494 28.274 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.293 56.710 26.623 1.00 0.00 C ATOM 65 CE2 PHE A 4 38.879 55.467 28.151 1.00 0.00 C ATOM 66 CZ PHE A 4 39.088 56.575 27.322 1.00 0.00 C ATOM 0 H PHE A 4 40.513 51.508 26.886 1.00 0.00 H new ATOM 0 HA PHE A 4 42.573 53.195 25.611 1.00 0.00 H new ATOM 0 HB2 PHE A 4 41.937 52.941 28.561 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.108 54.012 27.819 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.213 55.834 26.199 1.00 0.00 H new ATOM 0 HD2 PHE A 4 39.717 53.639 28.914 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.456 57.569 25.989 1.00 0.00 H new ATOM 0 HE2 PHE A 4 37.951 55.363 28.694 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.319 57.326 27.222 1.00 0.00 H new ATOM 76 N VAL A 5 44.422 51.582 26.150 1.00 0.00 N ATOM 77 CA VAL A 5 45.476 50.599 26.300 1.00 0.00 C ATOM 78 C VAL A 5 46.726 51.247 26.900 1.00 0.00 C ATOM 79 O VAL A 5 47.244 52.222 26.361 1.00 0.00 O ATOM 80 CB VAL A 5 45.798 49.886 24.990 1.00 0.00 C ATOM 81 CG1 VAL A 5 46.677 48.664 25.245 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.557 49.399 24.247 1.00 0.00 C ATOM 0 H VAL A 5 44.701 52.381 25.580 1.00 0.00 H new ATOM 0 HA VAL A 5 45.114 49.834 26.987 1.00 0.00 H new ATOM 0 HB VAL A 5 46.309 50.628 24.377 1.00 0.00 H new ATOM 0 HG11 VAL A 5 46.896 48.169 24.299 1.00 0.00 H new ATOM 0 HG12 VAL A 5 47.609 48.978 25.714 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.154 47.971 25.904 1.00 0.00 H new ATOM 0 HG21 VAL A 5 44.857 48.901 23.325 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.008 48.698 24.876 1.00 0.00 H new ATOM 0 HG23 VAL A 5 43.918 50.250 24.009 1.00 0.00 H new ATOM 92 N LYS A 6 47.203 50.710 28.019 1.00 0.00 N ATOM 93 CA LYS A 6 48.338 51.172 28.792 1.00 0.00 C ATOM 94 C LYS A 6 49.620 50.408 28.456 1.00 0.00 C ATOM 95 O LYS A 6 49.583 49.188 28.315 1.00 0.00 O ATOM 96 CB LYS A 6 47.953 51.038 30.263 1.00 0.00 C ATOM 97 CG LYS A 6 48.993 51.456 31.298 1.00 0.00 C ATOM 98 CD LYS A 6 49.397 52.925 31.205 1.00 0.00 C ATOM 99 CE LYS A 6 50.195 53.398 32.416 1.00 0.00 C ATOM 100 NZ LYS A 6 51.388 52.574 32.661 1.00 0.00 N ATOM 0 H LYS A 6 46.773 49.883 28.433 1.00 0.00 H new ATOM 0 HA LYS A 6 48.564 52.211 28.551 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.053 51.629 30.431 1.00 0.00 H new ATOM 0 HB3 LYS A 6 47.690 49.997 30.450 1.00 0.00 H new ATOM 0 HG2 LYS A 6 48.599 51.259 32.295 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.881 50.836 31.178 1.00 0.00 H new ATOM 0 HD2 LYS A 6 49.990 53.077 30.303 1.00 0.00 H new ATOM 0 HD3 LYS A 6 48.501 53.538 31.105 1.00 0.00 H new ATOM 0 HE2 LYS A 6 50.498 54.434 32.265 1.00 0.00 H new ATOM 0 HE3 LYS A 6 49.556 53.378 33.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 51.966 53.013 33.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 51.097 51.623 32.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 51.946 52.502 31.786 1.00 0.00 H new ATOM 168 N LYS A 11 52.811 55.087 28.317 1.00 0.00 N ATOM 169 CA LYS A 11 51.921 55.660 27.328 1.00 0.00 C ATOM 170 C LYS A 11 50.506 55.111 27.516 1.00 0.00 C ATOM 171 O LYS A 11 50.345 53.939 27.849 1.00 0.00 O ATOM 172 CB LYS A 11 52.459 55.425 25.919 1.00 0.00 C ATOM 173 CG LYS A 11 51.760 56.321 24.901 1.00 0.00 C ATOM 174 CD LYS A 11 52.318 56.147 23.491 1.00 0.00 C ATOM 175 CE LYS A 11 51.614 57.125 22.556 1.00 0.00 C ATOM 176 NZ LYS A 11 52.107 56.968 21.178 1.00 0.00 N ATOM 0 HA LYS A 11 51.872 56.740 27.468 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.532 55.618 25.900 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.318 54.380 25.644 1.00 0.00 H new ATOM 0 HG2 LYS A 11 50.693 56.097 24.897 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.866 57.362 25.205 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.393 56.328 23.486 1.00 0.00 H new ATOM 0 HD3 LYS A 11 52.166 55.123 23.149 1.00 0.00 H new ATOM 0 HE2 LYS A 11 50.538 56.954 22.585 1.00 0.00 H new ATOM 0 HE3 LYS A 11 51.784 58.147 22.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 52.094 57.890 20.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.080 56.601 21.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 51.496 56.302 20.664 1.00 0.00 H new ATOM 190 N THR A 12 49.496 55.935 27.247 1.00 0.00 N ATOM 191 CA THR A 12 48.113 55.513 27.159 1.00 0.00 C ATOM 192 C THR A 12 47.580 55.801 25.754 1.00 0.00 C ATOM 193 O THR A 12 47.712 56.898 25.217 1.00 0.00 O ATOM 194 CB THR A 12 47.256 56.128 28.261 1.00 0.00 C ATOM 195 OG1 THR A 12 47.763 55.694 29.504 1.00 0.00 O ATOM 196 CG2 THR A 12 45.801 55.674 28.198 1.00 0.00 C ATOM 0 H THR A 12 49.626 56.933 27.082 1.00 0.00 H new ATOM 0 HA THR A 12 48.059 54.437 27.324 1.00 0.00 H new ATOM 0 HB THR A 12 47.291 57.210 28.135 1.00 0.00 H new ATOM 0 HG1 THR A 12 47.227 56.079 30.228 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.238 56.143 29.005 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.370 55.964 27.240 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.753 54.590 28.304 1.00 0.00 H new ATOM 204 N ILE A 13 46.994 54.770 25.153 1.00 0.00 N ATOM 205 CA ILE A 13 46.619 54.693 23.755 1.00 0.00 C ATOM 206 C ILE A 13 45.096 54.574 23.686 1.00 0.00 C ATOM 207 O ILE A 13 44.529 53.617 24.208 1.00 0.00 O ATOM 208 CB ILE A 13 47.322 53.503 23.107 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.836 53.527 23.289 1.00 0.00 C ATOM 210 CG2 ILE A 13 46.978 53.453 21.622 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.524 52.209 22.945 1.00 0.00 C ATOM 0 H ILE A 13 46.757 53.919 25.663 1.00 0.00 H new ATOM 0 HA ILE A 13 46.926 55.584 23.207 1.00 0.00 H new ATOM 0 HB ILE A 13 46.962 52.607 23.612 1.00 0.00 H new ATOM 0 HG12 ILE A 13 49.254 54.317 22.665 1.00 0.00 H new ATOM 0 HG13 ILE A 13 49.063 53.784 24.324 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.481 52.603 21.161 1.00 0.00 H new ATOM 0 HG22 ILE A 13 45.900 53.346 21.502 1.00 0.00 H new ATOM 0 HG23 ILE A 13 47.307 54.374 21.141 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.598 52.308 23.100 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.136 51.418 23.586 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.330 51.959 21.902 1.00 0.00 H new ATOM 223 N THR A 14 44.423 55.534 23.057 1.00 0.00 N ATOM 224 CA THR A 14 42.988 55.519 22.865 1.00 0.00 C ATOM 225 C THR A 14 42.660 54.864 21.521 1.00 0.00 C ATOM 226 O THR A 14 43.257 55.223 20.509 1.00 0.00 O ATOM 227 CB THR A 14 42.407 56.928 22.936 1.00 0.00 C ATOM 228 OG1 THR A 14 42.721 57.540 24.167 1.00 0.00 O ATOM 229 CG2 THR A 14 40.885 56.926 22.837 1.00 0.00 C ATOM 0 H THR A 14 44.876 56.358 22.661 1.00 0.00 H new ATOM 0 HA THR A 14 42.533 54.938 23.667 1.00 0.00 H new ATOM 0 HB THR A 14 42.842 57.469 22.096 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.108 57.215 24.859 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.515 57.950 22.892 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.583 56.482 21.889 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.468 56.345 23.659 1.00 0.00 H new ATOM 237 N LEU A 15 41.728 53.916 21.488 1.00 0.00 N ATOM 238 CA LEU A 15 41.297 53.228 20.288 1.00 0.00 C ATOM 239 C LEU A 15 39.775 53.264 20.147 1.00 0.00 C ATOM 240 O LEU A 15 39.057 53.157 21.139 1.00 0.00 O ATOM 241 CB LEU A 15 41.781 51.781 20.301 1.00 0.00 C ATOM 242 CG LEU A 15 43.287 51.556 20.393 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.572 50.063 20.528 1.00 0.00 C ATOM 244 CD2 LEU A 15 44.031 52.062 19.162 1.00 0.00 C ATOM 0 H LEU A 15 41.240 53.600 22.326 1.00 0.00 H new ATOM 0 HA LEU A 15 41.734 53.744 19.433 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.311 51.274 21.143 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.420 51.295 19.394 1.00 0.00 H new ATOM 0 HG LEU A 15 43.636 52.113 21.263 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.648 49.902 20.594 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.092 49.681 21.429 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.179 49.537 19.658 1.00 0.00 H new ATOM 0 HD21 LEU A 15 45.099 51.877 19.280 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.668 51.539 18.277 1.00 0.00 H new ATOM 0 HD23 LEU A 15 43.859 53.132 19.047 1.00 0.00 H new ATOM 256 N GLU A 16 39.288 53.335 18.911 1.00 0.00 N ATOM 257 CA GLU A 16 37.921 52.996 18.569 1.00 0.00 C ATOM 258 C GLU A 16 37.843 51.548 18.081 1.00 0.00 C ATOM 259 O GLU A 16 38.579 51.136 17.187 1.00 0.00 O ATOM 260 CB GLU A 16 37.361 53.973 17.540 1.00 0.00 C ATOM 261 CG GLU A 16 36.482 55.061 18.153 1.00 0.00 C ATOM 262 CD GLU A 16 35.099 54.551 18.564 1.00 0.00 C ATOM 263 OE1 GLU A 16 34.494 53.737 17.833 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.565 54.973 19.612 1.00 0.00 O ATOM 0 H GLU A 16 39.845 53.635 18.111 1.00 0.00 H new ATOM 0 HA GLU A 16 37.302 53.081 19.462 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.188 54.442 17.007 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.780 53.419 16.803 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.984 55.477 19.026 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.365 55.873 17.436 1.00 0.00 H new ATOM 271 N VAL A 17 36.958 50.769 18.697 1.00 0.00 N ATOM 272 CA VAL A 17 36.758 49.350 18.481 1.00 0.00 C ATOM 273 C VAL A 17 35.276 48.978 18.432 1.00 0.00 C ATOM 274 O VAL A 17 34.423 49.684 18.969 1.00 0.00 O ATOM 275 CB VAL A 17 37.467 48.510 19.540 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.981 48.694 19.500 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.964 48.788 20.954 1.00 0.00 C ATOM 0 H VAL A 17 36.324 51.141 19.404 1.00 0.00 H new ATOM 0 HA VAL A 17 37.198 49.128 17.509 1.00 0.00 H new ATOM 0 HB VAL A 17 37.227 47.477 19.290 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.443 48.077 20.271 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.358 48.395 18.522 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.225 49.741 19.679 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.505 48.161 21.663 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.128 49.837 21.199 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.899 48.564 21.012 1.00 0.00 H new ATOM 287 N GLU A 18 34.984 47.824 17.839 1.00 0.00 N ATOM 288 CA GLU A 18 33.688 47.177 17.893 1.00 0.00 C ATOM 289 C GLU A 18 33.764 45.930 18.777 1.00 0.00 C ATOM 290 O GLU A 18 34.824 45.311 18.833 1.00 0.00 O ATOM 291 CB GLU A 18 33.228 46.798 16.489 1.00 0.00 C ATOM 292 CG GLU A 18 33.039 47.961 15.519 1.00 0.00 C ATOM 293 CD GLU A 18 31.698 48.688 15.638 1.00 0.00 C ATOM 294 OE1 GLU A 18 31.084 48.774 16.724 1.00 0.00 O ATOM 295 OE2 GLU A 18 31.206 49.188 14.603 1.00 0.00 O ATOM 0 H GLU A 18 35.668 47.301 17.292 1.00 0.00 H new ATOM 0 HA GLU A 18 32.965 47.872 18.321 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.955 46.107 16.062 1.00 0.00 H new ATOM 0 HB3 GLU A 18 32.284 46.258 16.569 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.842 48.681 15.678 1.00 0.00 H new ATOM 0 HG3 GLU A 18 33.144 47.586 14.501 1.00 0.00 H new ATOM 302 N PRO A 19 32.695 45.478 19.425 1.00 0.00 N ATOM 303 CA PRO A 19 32.716 44.260 20.210 1.00 0.00 C ATOM 304 C PRO A 19 33.062 43.006 19.406 1.00 0.00 C ATOM 305 O PRO A 19 33.572 42.032 19.955 1.00 0.00 O ATOM 306 CB PRO A 19 31.340 44.155 20.862 1.00 0.00 C ATOM 307 CG PRO A 19 30.769 45.568 20.804 1.00 0.00 C ATOM 308 CD PRO A 19 31.404 46.127 19.535 1.00 0.00 C ATOM 0 HA PRO A 19 33.514 44.316 20.951 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.703 43.449 20.329 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.416 43.802 21.890 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.681 45.564 20.746 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.039 46.152 21.684 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.785 45.918 18.662 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.514 47.210 19.596 1.00 0.00 H new ATOM 316 N SER A 20 32.825 43.029 18.097 1.00 0.00 N ATOM 317 CA SER A 20 33.201 42.007 17.142 1.00 0.00 C ATOM 318 C SER A 20 34.673 42.020 16.723 1.00 0.00 C ATOM 319 O SER A 20 35.093 41.117 16.003 1.00 0.00 O ATOM 320 CB SER A 20 32.323 42.141 15.902 1.00 0.00 C ATOM 321 OG SER A 20 32.451 43.439 15.367 1.00 0.00 O ATOM 0 H SER A 20 32.337 43.809 17.656 1.00 0.00 H new ATOM 0 HA SER A 20 33.051 41.054 17.650 1.00 0.00 H new ATOM 0 HB2 SER A 20 32.613 41.400 15.157 1.00 0.00 H new ATOM 0 HB3 SER A 20 31.282 41.944 16.159 1.00 0.00 H new ATOM 0 HG SER A 20 31.887 43.521 14.570 1.00 0.00 H new ATOM 327 N ASP A 21 35.463 43.011 17.125 1.00 0.00 N ATOM 328 CA ASP A 21 36.872 43.068 16.788 1.00 0.00 C ATOM 329 C ASP A 21 37.631 41.899 17.419 1.00 0.00 C ATOM 330 O ASP A 21 37.524 41.642 18.615 1.00 0.00 O ATOM 331 CB ASP A 21 37.511 44.383 17.224 1.00 0.00 C ATOM 332 CG ASP A 21 37.154 45.612 16.387 1.00 0.00 C ATOM 333 OD1 ASP A 21 36.523 45.488 15.314 1.00 0.00 O ATOM 334 OD2 ASP A 21 37.567 46.733 16.753 1.00 0.00 O ATOM 0 H ASP A 21 35.140 43.794 17.693 1.00 0.00 H new ATOM 0 HA ASP A 21 36.938 43.000 15.702 1.00 0.00 H new ATOM 0 HB2 ASP A 21 37.226 44.577 18.258 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.594 44.260 17.209 1.00 0.00 H new ATOM 339 N THR A 22 38.434 41.212 16.611 1.00 0.00 N ATOM 340 CA THR A 22 39.390 40.240 17.103 1.00 0.00 C ATOM 341 C THR A 22 40.596 40.939 17.734 1.00 0.00 C ATOM 342 O THR A 22 40.906 42.079 17.395 1.00 0.00 O ATOM 343 CB THR A 22 39.861 39.248 16.043 1.00 0.00 C ATOM 344 OG1 THR A 22 40.573 39.884 15.006 1.00 0.00 O ATOM 345 CG2 THR A 22 38.716 38.468 15.402 1.00 0.00 C ATOM 0 H THR A 22 38.436 41.318 15.597 1.00 0.00 H new ATOM 0 HA THR A 22 38.859 39.660 17.858 1.00 0.00 H new ATOM 0 HB THR A 22 40.509 38.557 16.583 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.018 40.590 14.613 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.116 37.780 14.657 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.186 37.904 16.169 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.027 39.162 14.921 1.00 0.00 H new ATOM 353 N ILE A 23 41.347 40.239 18.579 1.00 0.00 N ATOM 354 CA ILE A 23 42.589 40.757 19.115 1.00 0.00 C ATOM 355 C ILE A 23 43.599 41.034 18.000 1.00 0.00 C ATOM 356 O ILE A 23 44.356 41.997 18.093 1.00 0.00 O ATOM 357 CB ILE A 23 43.120 39.830 20.204 1.00 0.00 C ATOM 358 CG1 ILE A 23 42.101 39.525 21.298 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.401 40.371 20.834 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.472 40.722 22.004 1.00 0.00 C ATOM 0 H ILE A 23 41.109 39.303 18.906 1.00 0.00 H new ATOM 0 HA ILE A 23 42.403 41.721 19.588 1.00 0.00 H new ATOM 0 HB ILE A 23 43.337 38.892 19.692 1.00 0.00 H new ATOM 0 HG12 ILE A 23 41.300 38.929 20.860 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.586 38.903 22.050 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.747 39.682 21.605 1.00 0.00 H new ATOM 0 HG22 ILE A 23 45.169 40.473 20.067 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.203 41.345 21.281 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.767 40.371 22.758 1.00 0.00 H new ATOM 0 HD12 ILE A 23 42.252 41.312 22.484 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.946 41.339 21.275 1.00 0.00 H new ATOM 372 N GLU A 24 43.555 40.305 16.888 1.00 0.00 N ATOM 373 CA GLU A 24 44.296 40.610 15.680 1.00 0.00 C ATOM 374 C GLU A 24 43.922 41.957 15.059 1.00 0.00 C ATOM 375 O GLU A 24 44.808 42.680 14.609 1.00 0.00 O ATOM 376 CB GLU A 24 44.081 39.449 14.713 1.00 0.00 C ATOM 377 CG GLU A 24 44.701 39.611 13.328 1.00 0.00 C ATOM 378 CD GLU A 24 44.274 38.438 12.442 1.00 0.00 C ATOM 379 OE1 GLU A 24 44.818 37.324 12.609 1.00 0.00 O ATOM 380 OE2 GLU A 24 43.340 38.615 11.632 1.00 0.00 O ATOM 0 H GLU A 24 42.985 39.463 16.806 1.00 0.00 H new ATOM 0 HA GLU A 24 45.353 40.717 15.923 1.00 0.00 H new ATOM 0 HB2 GLU A 24 44.485 38.544 15.167 1.00 0.00 H new ATOM 0 HB3 GLU A 24 43.009 39.295 14.594 1.00 0.00 H new ATOM 0 HG2 GLU A 24 44.382 40.553 12.882 1.00 0.00 H new ATOM 0 HG3 GLU A 24 45.788 39.647 13.405 1.00 0.00 H new ATOM 387 N ASN A 25 42.650 42.345 15.078 1.00 0.00 N ATOM 388 CA ASN A 25 42.230 43.663 14.646 1.00 0.00 C ATOM 389 C ASN A 25 42.740 44.750 15.594 1.00 0.00 C ATOM 390 O ASN A 25 43.223 45.785 15.140 1.00 0.00 O ATOM 391 CB ASN A 25 40.715 43.757 14.486 1.00 0.00 C ATOM 392 CG ASN A 25 40.088 42.756 13.513 1.00 0.00 C ATOM 393 OD1 ASN A 25 39.269 41.925 13.900 1.00 0.00 O ATOM 394 ND2 ASN A 25 40.426 42.786 12.226 1.00 0.00 N ATOM 0 H ASN A 25 41.885 41.749 15.395 1.00 0.00 H new ATOM 0 HA ASN A 25 42.676 43.829 13.665 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.255 43.621 15.465 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.465 44.764 14.154 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.007 42.124 11.573 1.00 0.00 H new ATOM 0 HD22 ASN A 25 41.104 43.471 11.893 1.00 0.00 H new ATOM 401 N VAL A 26 42.714 44.519 16.903 1.00 0.00 N ATOM 402 CA VAL A 26 43.258 45.441 17.879 1.00 0.00 C ATOM 403 C VAL A 26 44.766 45.612 17.690 1.00 0.00 C ATOM 404 O VAL A 26 45.245 46.743 17.651 1.00 0.00 O ATOM 405 CB VAL A 26 42.912 45.030 19.307 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.482 46.013 20.327 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.402 44.983 19.525 1.00 0.00 C ATOM 0 H VAL A 26 42.310 43.677 17.314 1.00 0.00 H new ATOM 0 HA VAL A 26 42.789 46.411 17.710 1.00 0.00 H new ATOM 0 HB VAL A 26 43.348 44.041 19.447 1.00 0.00 H new ATOM 0 HG11 VAL A 26 43.216 45.689 21.333 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.567 46.047 20.232 1.00 0.00 H new ATOM 0 HG13 VAL A 26 43.070 47.006 20.145 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.192 44.687 20.553 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.976 45.969 19.337 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.958 44.260 18.841 1.00 0.00 H new ATOM 417 N LYS A 27 45.501 44.529 17.452 1.00 0.00 N ATOM 418 CA LYS A 27 46.907 44.579 17.104 1.00 0.00 C ATOM 419 C LYS A 27 47.172 45.394 15.837 1.00 0.00 C ATOM 420 O LYS A 27 48.151 46.136 15.807 1.00 0.00 O ATOM 421 CB LYS A 27 47.488 43.179 16.930 1.00 0.00 C ATOM 422 CG LYS A 27 47.766 42.431 18.232 1.00 0.00 C ATOM 423 CD LYS A 27 48.423 41.092 17.912 1.00 0.00 C ATOM 424 CE LYS A 27 48.958 40.408 19.167 1.00 0.00 C ATOM 425 NZ LYS A 27 49.747 39.221 18.805 1.00 0.00 N ATOM 0 H LYS A 27 45.126 43.582 17.498 1.00 0.00 H new ATOM 0 HA LYS A 27 47.401 45.077 17.938 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.798 42.587 16.329 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.418 43.255 16.366 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.417 43.024 18.874 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.837 42.272 18.779 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.699 40.440 17.423 1.00 0.00 H new ATOM 0 HD3 LYS A 27 49.239 41.247 17.207 1.00 0.00 H new ATOM 0 HE2 LYS A 27 49.576 41.105 19.734 1.00 0.00 H new ATOM 0 HE3 LYS A 27 48.129 40.119 19.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 50.105 38.765 19.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 49.147 38.551 18.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 50.548 39.506 18.207 1.00 0.00 H new ATOM 439 N ALA A 28 46.309 45.316 14.828 1.00 0.00 N ATOM 440 CA ALA A 28 46.446 46.086 13.608 1.00 0.00 C ATOM 441 C ALA A 28 46.226 47.585 13.816 1.00 0.00 C ATOM 442 O ALA A 28 46.915 48.401 13.208 1.00 0.00 O ATOM 443 CB ALA A 28 45.498 45.517 12.556 1.00 0.00 C ATOM 0 H ALA A 28 45.489 44.709 14.840 1.00 0.00 H new ATOM 0 HA ALA A 28 47.476 45.995 13.262 1.00 0.00 H new ATOM 0 HB1 ALA A 28 45.593 46.089 11.633 1.00 0.00 H new ATOM 0 HB2 ALA A 28 45.751 44.474 12.364 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.472 45.580 12.918 1.00 0.00 H new ATOM 449 N LYS A 29 45.322 47.977 14.710 1.00 0.00 N ATOM 450 CA LYS A 29 45.111 49.360 15.089 1.00 0.00 C ATOM 451 C LYS A 29 46.307 49.930 15.853 1.00 0.00 C ATOM 452 O LYS A 29 46.723 51.059 15.601 1.00 0.00 O ATOM 453 CB LYS A 29 43.815 49.487 15.883 1.00 0.00 C ATOM 454 CG LYS A 29 42.586 49.171 15.034 1.00 0.00 C ATOM 455 CD LYS A 29 41.283 49.123 15.826 1.00 0.00 C ATOM 456 CE LYS A 29 40.145 48.808 14.859 1.00 0.00 C ATOM 457 NZ LYS A 29 38.830 48.821 15.519 1.00 0.00 N ATOM 0 H LYS A 29 44.707 47.325 15.197 1.00 0.00 H new ATOM 0 HA LYS A 29 45.018 49.956 14.181 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.847 48.812 16.738 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.731 50.499 16.279 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.495 49.922 14.250 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.735 48.211 14.540 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.340 48.363 16.605 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.106 50.077 16.323 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.149 49.536 14.048 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.314 47.829 14.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.083 48.925 14.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.692 47.929 16.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.784 49.618 16.185 1.00 0.00 H new ATOM 471 N ILE A 30 46.924 49.130 16.717 1.00 0.00 N ATOM 472 CA ILE A 30 48.134 49.479 17.435 1.00 0.00 C ATOM 473 C ILE A 30 49.351 49.520 16.509 1.00 0.00 C ATOM 474 O ILE A 30 50.188 50.408 16.641 1.00 0.00 O ATOM 475 CB ILE A 30 48.321 48.548 18.631 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.205 48.772 19.647 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.679 48.734 19.302 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.120 47.706 20.735 1.00 0.00 C ATOM 0 H ILE A 30 46.582 48.195 16.940 1.00 0.00 H new ATOM 0 HA ILE A 30 48.032 50.492 17.825 1.00 0.00 H new ATOM 0 HB ILE A 30 48.279 47.526 18.256 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.349 49.744 20.118 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.252 48.812 19.119 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.764 48.050 20.147 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.472 48.524 18.584 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.772 49.761 19.656 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.300 47.943 21.413 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.942 46.733 20.278 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.056 47.680 21.292 1.00 0.00 H new ATOM 490 N GLN A 31 49.438 48.632 15.522 1.00 0.00 N ATOM 491 CA GLN A 31 50.479 48.633 14.514 1.00 0.00 C ATOM 492 C GLN A 31 50.514 49.964 13.762 1.00 0.00 C ATOM 493 O GLN A 31 51.594 50.490 13.501 1.00 0.00 O ATOM 494 CB GLN A 31 50.265 47.458 13.566 1.00 0.00 C ATOM 495 CG GLN A 31 51.372 47.247 12.537 1.00 0.00 C ATOM 496 CD GLN A 31 51.038 46.145 11.529 1.00 0.00 C ATOM 497 OE1 GLN A 31 49.887 45.885 11.189 1.00 0.00 O ATOM 498 NE2 GLN A 31 52.040 45.472 10.971 1.00 0.00 N ATOM 0 H GLN A 31 48.766 47.874 15.404 1.00 0.00 H new ATOM 0 HA GLN A 31 51.449 48.518 14.999 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.162 46.548 14.157 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.323 47.604 13.038 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.549 48.181 12.003 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.298 46.994 13.053 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.003 45.674 11.241 1.00 0.00 H new ATOM 0 HE22 GLN A 31 51.846 44.754 10.273 1.00 0.00 H new ATOM 507 N ASP A 32 49.360 50.561 13.475 1.00 0.00 N ATOM 508 CA ASP A 32 49.277 51.861 12.841 1.00 0.00 C ATOM 509 C ASP A 32 49.795 53.009 13.709 1.00 0.00 C ATOM 510 O ASP A 32 50.711 53.712 13.291 1.00 0.00 O ATOM 511 CB ASP A 32 47.850 52.103 12.359 1.00 0.00 C ATOM 512 CG ASP A 32 47.712 53.465 11.676 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.176 54.397 12.315 1.00 0.00 O ATOM 514 OD2 ASP A 32 48.125 53.602 10.505 1.00 0.00 O ATOM 0 H ASP A 32 48.451 50.147 13.681 1.00 0.00 H new ATOM 0 HA ASP A 32 49.949 51.846 11.983 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.561 51.315 11.663 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.165 52.048 13.205 1.00 0.00 H new ATOM 519 N LYS A 33 49.270 53.199 14.916 1.00 0.00 N ATOM 520 CA LYS A 33 49.617 54.339 15.738 1.00 0.00 C ATOM 521 C LYS A 33 50.863 54.195 16.616 1.00 0.00 C ATOM 522 O LYS A 33 51.356 55.206 17.109 1.00 0.00 O ATOM 523 CB LYS A 33 48.403 54.921 16.457 1.00 0.00 C ATOM 524 CG LYS A 33 47.749 54.041 17.518 1.00 0.00 C ATOM 525 CD LYS A 33 46.651 54.781 18.278 1.00 0.00 C ATOM 526 CE LYS A 33 45.455 55.175 17.414 1.00 0.00 C ATOM 527 NZ LYS A 33 44.506 56.016 18.159 1.00 0.00 N ATOM 0 H LYS A 33 48.595 52.566 15.345 1.00 0.00 H new ATOM 0 HA LYS A 33 49.949 55.090 15.022 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.703 55.857 16.929 1.00 0.00 H new ATOM 0 HB3 LYS A 33 47.650 55.168 15.708 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.327 53.155 17.044 1.00 0.00 H new ATOM 0 HG3 LYS A 33 48.507 53.697 18.221 1.00 0.00 H new ATOM 0 HD2 LYS A 33 46.303 54.152 19.097 1.00 0.00 H new ATOM 0 HD3 LYS A 33 47.075 55.680 18.725 1.00 0.00 H new ATOM 0 HE2 LYS A 33 45.803 55.712 16.532 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.948 54.277 17.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 43.698 56.252 17.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 44.169 55.500 18.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.980 56.892 18.459 1.00 0.00 H new ATOM 541 N GLU A 34 51.419 52.999 16.785 1.00 0.00 N ATOM 542 CA GLU A 34 52.638 52.758 17.530 1.00 0.00 C ATOM 543 C GLU A 34 53.791 52.151 16.727 1.00 0.00 C ATOM 544 O GLU A 34 54.936 52.236 17.167 1.00 0.00 O ATOM 545 CB GLU A 34 52.365 51.906 18.766 1.00 0.00 C ATOM 546 CG GLU A 34 51.326 52.456 19.741 1.00 0.00 C ATOM 547 CD GLU A 34 51.634 53.870 20.238 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.817 54.246 20.386 1.00 0.00 O ATOM 549 OE2 GLU A 34 50.698 54.665 20.473 1.00 0.00 O ATOM 0 H GLU A 34 51.016 52.148 16.393 1.00 0.00 H new ATOM 0 HA GLU A 34 52.975 53.754 17.819 1.00 0.00 H new ATOM 0 HB2 GLU A 34 52.040 50.919 18.438 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.303 51.770 19.304 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.350 52.456 19.256 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.256 51.787 20.598 1.00 0.00 H new ATOM 556 N GLY A 35 53.538 51.541 15.572 1.00 0.00 N ATOM 557 CA GLY A 35 54.572 50.924 14.768 1.00 0.00 C ATOM 558 C GLY A 35 55.119 49.603 15.313 1.00 0.00 C ATOM 559 O GLY A 35 56.233 49.216 14.966 1.00 0.00 O ATOM 0 H GLY A 35 52.603 51.464 15.171 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.177 50.750 13.767 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.399 51.627 14.666 1.00 0.00 H new ATOM 563 N ILE A 36 54.383 48.916 16.182 1.00 0.00 N ATOM 564 CA ILE A 36 54.794 47.672 16.801 1.00 0.00 C ATOM 565 C ILE A 36 54.283 46.495 15.967 1.00 0.00 C ATOM 566 O ILE A 36 53.069 46.386 15.804 1.00 0.00 O ATOM 567 CB ILE A 36 54.346 47.576 18.256 1.00 0.00 C ATOM 568 CG1 ILE A 36 54.743 48.791 19.090 1.00 0.00 C ATOM 569 CG2 ILE A 36 54.949 46.328 18.893 1.00 0.00 C ATOM 570 CD1 ILE A 36 53.974 48.910 20.402 1.00 0.00 C ATOM 0 H ILE A 36 53.457 49.224 16.480 1.00 0.00 H new ATOM 0 HA ILE A 36 55.883 47.640 16.823 1.00 0.00 H new ATOM 0 HB ILE A 36 53.257 47.529 18.244 1.00 0.00 H new ATOM 0 HG12 ILE A 36 55.810 48.739 19.308 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.582 49.694 18.501 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.629 46.259 19.933 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.613 45.444 18.351 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.037 46.388 18.851 1.00 0.00 H new ATOM 0 HD11 ILE A 36 54.309 49.796 20.941 1.00 0.00 H new ATOM 0 HD12 ILE A 36 52.908 48.994 20.192 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.155 48.025 21.011 1.00 0.00 H new ATOM 582 N PRO A 37 55.140 45.605 15.474 1.00 0.00 N ATOM 583 CA PRO A 37 54.721 44.427 14.741 1.00 0.00 C ATOM 584 C PRO A 37 53.743 43.549 15.523 1.00 0.00 C ATOM 585 O PRO A 37 53.993 43.309 16.702 1.00 0.00 O ATOM 586 CB PRO A 37 56.004 43.662 14.428 1.00 0.00 C ATOM 587 CG PRO A 37 57.064 44.758 14.365 1.00 0.00 C ATOM 588 CD PRO A 37 56.585 45.708 15.458 1.00 0.00 C ATOM 0 HA PRO A 37 54.178 44.718 13.842 1.00 0.00 H new ATOM 0 HB2 PRO A 37 56.232 42.927 15.200 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.929 43.121 13.485 1.00 0.00 H new ATOM 0 HG2 PRO A 37 58.064 44.373 14.565 1.00 0.00 H new ATOM 0 HG3 PRO A 37 57.098 45.240 13.388 1.00 0.00 H new ATOM 0 HD2 PRO A 37 57.006 45.433 16.425 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.901 46.731 15.252 1.00 0.00 H new ATOM 596 N PRO A 38 52.666 43.036 14.934 1.00 0.00 N ATOM 597 CA PRO A 38 51.687 42.227 15.630 1.00 0.00 C ATOM 598 C PRO A 38 52.240 41.031 16.409 1.00 0.00 C ATOM 599 O PRO A 38 51.779 40.768 17.517 1.00 0.00 O ATOM 600 CB PRO A 38 50.709 41.766 14.552 1.00 0.00 C ATOM 601 CG PRO A 38 50.710 42.937 13.574 1.00 0.00 C ATOM 602 CD PRO A 38 52.159 43.415 13.631 1.00 0.00 C ATOM 0 HA PRO A 38 51.229 42.833 16.412 1.00 0.00 H new ATOM 0 HB2 PRO A 38 51.037 40.841 14.077 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.715 41.580 14.960 1.00 0.00 H new ATOM 0 HG2 PRO A 38 50.425 42.626 12.569 1.00 0.00 H new ATOM 0 HG3 PRO A 38 50.013 43.719 13.876 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.750 42.958 12.837 1.00 0.00 H new ATOM 0 HD3 PRO A 38 52.217 44.494 13.491 1.00 0.00 H new ATOM 610 N ASP A 39 53.263 40.346 15.906 1.00 0.00 N ATOM 611 CA ASP A 39 53.906 39.246 16.597 1.00 0.00 C ATOM 612 C ASP A 39 54.759 39.689 17.787 1.00 0.00 C ATOM 613 O ASP A 39 55.028 38.892 18.682 1.00 0.00 O ATOM 614 CB ASP A 39 54.715 38.411 15.609 1.00 0.00 C ATOM 615 CG ASP A 39 55.922 39.152 15.029 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.725 40.205 14.387 1.00 0.00 O ATOM 617 OD2 ASP A 39 57.062 38.662 15.186 1.00 0.00 O ATOM 0 H ASP A 39 53.671 40.547 14.993 1.00 0.00 H new ATOM 0 HA ASP A 39 53.114 38.630 17.023 1.00 0.00 H new ATOM 0 HB2 ASP A 39 55.060 37.505 16.108 1.00 0.00 H new ATOM 0 HB3 ASP A 39 54.065 38.097 14.793 1.00 0.00 H new ATOM 622 N GLN A 40 55.125 40.965 17.854 1.00 0.00 N ATOM 623 CA GLN A 40 55.836 41.589 18.951 1.00 0.00 C ATOM 624 C GLN A 40 54.901 42.238 19.973 1.00 0.00 C ATOM 625 O GLN A 40 55.377 42.733 20.993 1.00 0.00 O ATOM 626 CB GLN A 40 56.859 42.577 18.396 1.00 0.00 C ATOM 627 CG GLN A 40 57.892 41.909 17.493 1.00 0.00 C ATOM 628 CD GLN A 40 58.985 42.853 16.987 1.00 0.00 C ATOM 629 OE1 GLN A 40 59.032 44.044 17.289 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.931 42.342 16.203 1.00 0.00 N ATOM 0 H GLN A 40 54.920 41.622 17.101 1.00 0.00 H new ATOM 0 HA GLN A 40 56.362 40.809 19.502 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.340 43.354 17.835 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.370 43.069 19.224 1.00 0.00 H new ATOM 0 HG2 GLN A 40 58.359 41.089 18.039 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.380 41.471 16.636 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.902 41.355 15.946 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.685 42.937 15.859 1.00 0.00 H new ATOM 639 N GLN A 41 53.590 42.232 19.749 1.00 0.00 N ATOM 640 CA GLN A 41 52.593 42.705 20.688 1.00 0.00 C ATOM 641 C GLN A 41 52.028 41.560 21.531 1.00 0.00 C ATOM 642 O GLN A 41 51.699 40.506 20.992 1.00 0.00 O ATOM 643 CB GLN A 41 51.446 43.397 19.956 1.00 0.00 C ATOM 644 CG GLN A 41 51.824 44.666 19.196 1.00 0.00 C ATOM 645 CD GLN A 41 50.600 45.289 18.520 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.518 45.363 19.098 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.691 45.740 17.273 1.00 0.00 N ATOM 0 H GLN A 41 53.185 41.885 18.879 1.00 0.00 H new ATOM 0 HA GLN A 41 53.088 43.417 21.348 1.00 0.00 H new ATOM 0 HB2 GLN A 41 51.007 42.690 19.252 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.672 43.646 20.682 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.270 45.386 19.883 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.579 44.433 18.445 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.580 45.688 16.775 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.872 46.138 16.814 1.00 0.00 H new ATOM 656 N ARG A 42 51.813 41.791 22.823 1.00 0.00 N ATOM 657 CA ARG A 42 51.066 40.926 23.713 1.00 0.00 C ATOM 658 C ARG A 42 50.024 41.759 24.463 1.00 0.00 C ATOM 659 O ARG A 42 50.383 42.737 25.114 1.00 0.00 O ATOM 660 CB ARG A 42 52.014 40.205 24.667 1.00 0.00 C ATOM 661 CG ARG A 42 51.807 38.694 24.714 1.00 0.00 C ATOM 662 CD ARG A 42 50.494 38.274 25.368 1.00 0.00 C ATOM 663 NE ARG A 42 50.401 36.816 25.443 1.00 0.00 N ATOM 664 CZ ARG A 42 49.440 36.026 24.948 1.00 0.00 C ATOM 665 NH1 ARG A 42 48.359 36.482 24.300 1.00 0.00 N ATOM 666 NH2 ARG A 42 49.489 34.692 25.074 1.00 0.00 N ATOM 0 H ARG A 42 52.172 42.623 23.292 1.00 0.00 H new ATOM 0 HA ARG A 42 50.544 40.160 23.140 1.00 0.00 H new ATOM 0 HB2 ARG A 42 53.042 40.413 24.369 1.00 0.00 H new ATOM 0 HB3 ARG A 42 51.884 40.612 25.670 1.00 0.00 H new ATOM 0 HG2 ARG A 42 51.839 38.300 23.698 1.00 0.00 H new ATOM 0 HG3 ARG A 42 52.635 38.240 25.258 1.00 0.00 H new ATOM 0 HD2 ARG A 42 50.427 38.700 26.369 1.00 0.00 H new ATOM 0 HD3 ARG A 42 49.654 38.669 24.797 1.00 0.00 H new ATOM 0 HE ARG A 42 51.161 36.344 25.932 1.00 0.00 H new ATOM 0 HH11 ARG A 42 48.233 37.485 24.160 1.00 0.00 H new ATOM 0 HH12 ARG A 42 47.662 35.826 23.947 1.00 0.00 H new ATOM 0 HH21 ARG A 42 50.273 34.254 25.557 1.00 0.00 H new ATOM 0 HH22 ARG A 42 48.742 34.115 24.687 1.00 0.00 H new ATOM 680 N LEU A 43 48.748 41.396 24.371 1.00 0.00 N ATOM 681 CA LEU A 43 47.629 42.165 24.876 1.00 0.00 C ATOM 682 C LEU A 43 46.974 41.486 26.081 1.00 0.00 C ATOM 683 O LEU A 43 46.843 40.264 26.114 1.00 0.00 O ATOM 684 CB LEU A 43 46.662 42.438 23.728 1.00 0.00 C ATOM 685 CG LEU A 43 47.183 43.439 22.702 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.302 43.442 21.456 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.220 44.872 23.226 1.00 0.00 C ATOM 0 H LEU A 43 48.461 40.525 23.925 1.00 0.00 H new ATOM 0 HA LEU A 43 47.978 43.126 25.255 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.440 41.498 23.223 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.723 42.809 24.138 1.00 0.00 H new ATOM 0 HG LEU A 43 48.199 43.116 22.475 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.691 44.163 20.737 1.00 0.00 H new ATOM 0 HD12 LEU A 43 46.301 42.448 21.009 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.284 43.717 21.731 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.600 45.534 22.448 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.214 45.183 23.507 1.00 0.00 H new ATOM 0 HD23 LEU A 43 47.873 44.924 24.097 1.00 0.00 H new ATOM 699 N ILE A 44 46.609 42.272 27.089 1.00 0.00 N ATOM 700 CA ILE A 44 46.127 41.837 28.385 1.00 0.00 C ATOM 701 C ILE A 44 44.909 42.658 28.812 1.00 0.00 C ATOM 702 O ILE A 44 44.860 43.857 28.550 1.00 0.00 O ATOM 703 CB ILE A 44 47.229 41.901 29.437 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.610 41.432 28.985 1.00 0.00 C ATOM 705 CG2 ILE A 44 46.860 41.098 30.682 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.497 42.534 28.412 1.00 0.00 C ATOM 0 H ILE A 44 46.646 43.289 27.013 1.00 0.00 H new ATOM 0 HA ILE A 44 45.820 40.795 28.296 1.00 0.00 H new ATOM 0 HB ILE A 44 47.302 42.968 29.645 1.00 0.00 H new ATOM 0 HG12 ILE A 44 49.121 40.976 29.833 1.00 0.00 H new ATOM 0 HG13 ILE A 44 48.487 40.654 28.232 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.668 41.165 31.411 1.00 0.00 H new ATOM 0 HG22 ILE A 44 45.945 41.500 31.116 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.704 40.054 30.409 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.458 42.111 28.117 1.00 0.00 H new ATOM 0 HD12 ILE A 44 49.012 42.976 27.541 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.656 43.303 29.168 1.00 0.00 H new ATOM 718 N PHE A 45 43.937 42.047 29.484 1.00 0.00 N ATOM 719 CA PHE A 45 42.887 42.724 30.218 1.00 0.00 C ATOM 720 C PHE A 45 42.538 41.981 31.509 1.00 0.00 C ATOM 721 O PHE A 45 42.343 40.768 31.491 1.00 0.00 O ATOM 722 CB PHE A 45 41.643 42.898 29.352 1.00 0.00 C ATOM 723 CG PHE A 45 40.460 43.488 30.082 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.513 44.803 30.559 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.324 42.710 30.333 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.437 45.343 31.273 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.246 43.247 31.047 1.00 0.00 C ATOM 728 CZ PHE A 45 38.300 44.566 31.514 1.00 0.00 C ATOM 0 H PHE A 45 43.862 41.031 29.530 1.00 0.00 H new ATOM 0 HA PHE A 45 43.262 43.711 30.489 1.00 0.00 H new ATOM 0 HB2 PHE A 45 41.890 43.538 28.505 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.358 41.928 28.945 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.390 45.405 30.375 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.279 41.692 29.975 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.485 46.359 31.637 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.371 42.643 31.238 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.465 44.982 32.059 1.00 0.00 H new ATOM 738 N ALA A 46 42.433 42.711 32.616 1.00 0.00 N ATOM 739 CA ALA A 46 42.187 42.190 33.944 1.00 0.00 C ATOM 740 C ALA A 46 43.064 40.984 34.287 1.00 0.00 C ATOM 741 O ALA A 46 42.586 39.926 34.694 1.00 0.00 O ATOM 742 CB ALA A 46 40.684 41.991 34.129 1.00 0.00 C ATOM 0 H ALA A 46 42.522 43.727 32.604 1.00 0.00 H new ATOM 0 HA ALA A 46 42.502 42.919 34.691 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.489 41.599 35.127 1.00 0.00 H new ATOM 0 HB2 ALA A 46 40.173 42.946 34.008 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.316 41.286 33.384 1.00 0.00 H new ATOM 748 N GLY A 47 44.362 41.112 34.031 1.00 0.00 N ATOM 749 CA GLY A 47 45.385 40.119 34.291 1.00 0.00 C ATOM 750 C GLY A 47 45.421 38.919 33.343 1.00 0.00 C ATOM 751 O GLY A 47 46.344 38.115 33.449 1.00 0.00 O ATOM 0 H GLY A 47 44.744 41.961 33.613 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.357 40.612 34.256 1.00 0.00 H new ATOM 0 HA3 GLY A 47 45.252 39.748 35.307 1.00 0.00 H new ATOM 755 N LYS A 48 44.477 38.776 32.416 1.00 0.00 N ATOM 756 CA LYS A 48 44.398 37.668 31.487 1.00 0.00 C ATOM 757 C LYS A 48 44.813 38.086 30.074 1.00 0.00 C ATOM 758 O LYS A 48 44.440 39.152 29.593 1.00 0.00 O ATOM 759 CB LYS A 48 43.013 37.028 31.531 1.00 0.00 C ATOM 760 CG LYS A 48 42.611 36.452 32.886 1.00 0.00 C ATOM 761 CD LYS A 48 43.582 35.420 33.453 1.00 0.00 C ATOM 762 CE LYS A 48 43.035 34.786 34.729 1.00 0.00 C ATOM 763 NZ LYS A 48 44.003 33.846 35.317 1.00 0.00 N ATOM 0 H LYS A 48 43.725 39.454 32.293 1.00 0.00 H new ATOM 0 HA LYS A 48 45.114 36.907 31.798 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.275 37.774 31.237 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.974 36.231 30.788 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.514 37.270 33.599 1.00 0.00 H new ATOM 0 HG3 LYS A 48 41.627 35.992 32.793 1.00 0.00 H new ATOM 0 HD2 LYS A 48 43.767 34.645 32.710 1.00 0.00 H new ATOM 0 HD3 LYS A 48 44.540 35.896 33.663 1.00 0.00 H new ATOM 0 HE2 LYS A 48 42.797 35.566 35.452 1.00 0.00 H new ATOM 0 HE3 LYS A 48 42.105 34.262 34.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 43.602 33.431 36.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 44.210 33.089 34.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 44.881 34.352 35.550 1.00 0.00 H new ATOM 777 N GLN A 49 45.620 37.250 29.427 1.00 0.00 N ATOM 778 CA GLN A 49 46.250 37.523 28.151 1.00 0.00 C ATOM 779 C GLN A 49 45.344 37.114 26.987 1.00 0.00 C ATOM 780 O GLN A 49 44.793 36.014 26.974 1.00 0.00 O ATOM 781 CB GLN A 49 47.613 36.841 28.084 1.00 0.00 C ATOM 782 CG GLN A 49 48.586 37.338 29.148 1.00 0.00 C ATOM 783 CD GLN A 49 49.999 36.772 28.979 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.251 35.792 28.283 1.00 0.00 O ATOM 785 NE2 GLN A 49 51.001 37.376 29.610 1.00 0.00 N ATOM 0 H GLN A 49 45.858 36.330 29.797 1.00 0.00 H new ATOM 0 HA GLN A 49 46.409 38.598 28.060 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.480 35.765 28.197 1.00 0.00 H new ATOM 0 HB3 GLN A 49 48.047 37.007 27.098 1.00 0.00 H new ATOM 0 HG2 GLN A 49 48.630 38.427 29.112 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.208 37.067 30.134 1.00 0.00 H new ATOM 0 HE21 GLN A 49 50.818 38.192 30.194 1.00 0.00 H new ATOM 0 HE22 GLN A 49 51.953 37.024 29.510 1.00 0.00 H new ATOM 794 N LEU A 50 45.175 38.001 26.012 1.00 0.00 N ATOM 795 CA LEU A 50 44.125 37.943 25.016 1.00 0.00 C ATOM 796 C LEU A 50 44.635 37.362 23.694 1.00 0.00 C ATOM 797 O LEU A 50 45.695 37.753 23.212 1.00 0.00 O ATOM 798 CB LEU A 50 43.501 39.325 24.846 1.00 0.00 C ATOM 799 CG LEU A 50 43.130 40.072 26.124 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.526 41.426 25.761 1.00 0.00 C ATOM 801 CD2 LEU A 50 42.131 39.309 26.989 1.00 0.00 C ATOM 0 H LEU A 50 45.790 38.806 25.894 1.00 0.00 H new ATOM 0 HA LEU A 50 43.346 37.263 25.361 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.196 39.945 24.279 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.601 39.220 24.240 1.00 0.00 H new ATOM 0 HG LEU A 50 44.047 40.188 26.702 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.260 41.962 26.672 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.253 42.009 25.196 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.633 41.275 25.155 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.906 39.890 27.883 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.214 39.142 26.424 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.559 38.349 27.278 1.00 0.00 H new ATOM 813 N GLU A 51 43.895 36.426 23.105 1.00 0.00 N ATOM 814 CA GLU A 51 44.342 35.627 21.983 1.00 0.00 C ATOM 815 C GLU A 51 43.852 36.100 20.613 1.00 0.00 C ATOM 816 O GLU A 51 42.697 36.487 20.448 1.00 0.00 O ATOM 817 CB GLU A 51 43.963 34.166 22.208 1.00 0.00 C ATOM 818 CG GLU A 51 44.738 33.506 23.345 1.00 0.00 C ATOM 819 CD GLU A 51 46.245 33.503 23.077 1.00 0.00 C ATOM 820 OE1 GLU A 51 46.678 32.928 22.055 1.00 0.00 O ATOM 821 OE2 GLU A 51 47.008 34.085 23.877 1.00 0.00 O ATOM 0 H GLU A 51 42.947 36.202 23.407 1.00 0.00 H new ATOM 0 HA GLU A 51 45.425 35.746 21.950 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.896 34.104 22.422 1.00 0.00 H new ATOM 0 HB3 GLU A 51 44.137 33.608 21.288 1.00 0.00 H new ATOM 0 HG2 GLU A 51 44.535 34.033 24.277 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.390 32.481 23.476 1.00 0.00 H new ATOM 828 N ASP A 52 44.727 36.012 19.617 1.00 0.00 N ATOM 829 CA ASP A 52 44.596 36.605 18.301 1.00 0.00 C ATOM 830 C ASP A 52 43.335 36.247 17.511 1.00 0.00 C ATOM 831 O ASP A 52 42.891 37.057 16.700 1.00 0.00 O ATOM 832 CB ASP A 52 45.827 36.224 17.486 1.00 0.00 C ATOM 833 CG ASP A 52 47.143 36.670 18.125 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.691 37.714 17.710 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.663 35.965 19.016 1.00 0.00 O ATOM 0 H ASP A 52 45.598 35.492 19.719 1.00 0.00 H new ATOM 0 HA ASP A 52 44.507 37.678 18.472 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.845 35.142 17.353 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.746 36.666 16.493 1.00 0.00 H new ATOM 840 N GLY A 53 42.746 35.071 17.710 1.00 0.00 N ATOM 841 CA GLY A 53 41.530 34.637 17.054 1.00 0.00 C ATOM 842 C GLY A 53 40.233 34.964 17.795 1.00 0.00 C ATOM 843 O GLY A 53 39.158 34.815 17.218 1.00 0.00 O ATOM 0 H GLY A 53 43.120 34.375 18.355 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.488 35.093 16.065 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.582 33.558 16.906 1.00 0.00 H new ATOM 847 N ARG A 54 40.312 35.392 19.051 1.00 0.00 N ATOM 848 CA ARG A 54 39.196 35.678 19.931 1.00 0.00 C ATOM 849 C ARG A 54 38.791 37.151 19.863 1.00 0.00 C ATOM 850 O ARG A 54 39.545 37.967 19.336 1.00 0.00 O ATOM 851 CB ARG A 54 39.545 35.208 21.340 1.00 0.00 C ATOM 852 CG ARG A 54 39.802 33.705 21.398 1.00 0.00 C ATOM 853 CD ARG A 54 39.908 33.205 22.835 1.00 0.00 C ATOM 854 NE ARG A 54 40.059 31.753 22.927 1.00 0.00 N ATOM 855 CZ ARG A 54 39.115 30.830 22.698 1.00 0.00 C ATOM 856 NH1 ARG A 54 37.887 31.127 22.249 1.00 0.00 N ATOM 857 NH2 ARG A 54 39.333 29.525 22.907 1.00 0.00 N ATOM 0 H ARG A 54 41.211 35.556 19.503 1.00 0.00 H new ATOM 0 HA ARG A 54 38.314 35.127 19.604 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.429 35.740 21.690 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.731 35.462 22.018 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.995 33.178 20.888 1.00 0.00 H new ATOM 0 HG3 ARG A 54 40.723 33.473 20.863 1.00 0.00 H new ATOM 0 HD2 ARG A 54 40.759 33.684 23.318 1.00 0.00 H new ATOM 0 HD3 ARG A 54 39.017 33.507 23.385 1.00 0.00 H new ATOM 0 HE ARG A 54 40.980 31.406 23.194 1.00 0.00 H new ATOM 0 HH11 ARG A 54 37.632 32.097 22.064 1.00 0.00 H new ATOM 0 HH12 ARG A 54 37.207 30.383 22.092 1.00 0.00 H new ATOM 0 HH21 ARG A 54 40.240 29.208 23.251 1.00 0.00 H new ATOM 0 HH22 ARG A 54 38.592 28.848 22.723 1.00 0.00 H new ATOM 871 N THR A 55 37.612 37.514 20.360 1.00 0.00 N ATOM 872 CA THR A 55 37.056 38.848 20.250 1.00 0.00 C ATOM 873 C THR A 55 36.860 39.573 21.583 1.00 0.00 C ATOM 874 O THR A 55 36.744 38.946 22.634 1.00 0.00 O ATOM 875 CB THR A 55 35.738 38.906 19.482 1.00 0.00 C ATOM 876 OG1 THR A 55 34.684 38.404 20.272 1.00 0.00 O ATOM 877 CG2 THR A 55 35.748 38.175 18.143 1.00 0.00 C ATOM 0 H THR A 55 37.005 36.867 20.863 1.00 0.00 H new ATOM 0 HA THR A 55 37.830 39.368 19.685 1.00 0.00 H new ATOM 0 HB THR A 55 35.590 39.962 19.257 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.491 37.479 20.011 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.771 38.270 17.669 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.509 38.611 17.496 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.971 37.121 18.306 1.00 0.00 H new ATOM 885 N LEU A 56 36.764 40.899 21.528 1.00 0.00 N ATOM 886 CA LEU A 56 36.480 41.728 22.682 1.00 0.00 C ATOM 887 C LEU A 56 35.162 41.362 23.367 1.00 0.00 C ATOM 888 O LEU A 56 35.132 41.266 24.591 1.00 0.00 O ATOM 889 CB LEU A 56 36.483 43.197 22.266 1.00 0.00 C ATOM 890 CG LEU A 56 37.813 43.743 21.752 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.639 45.208 21.362 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.926 43.672 22.792 1.00 0.00 C ATOM 0 H LEU A 56 36.884 41.429 20.665 1.00 0.00 H new ATOM 0 HA LEU A 56 37.265 41.550 23.417 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.731 43.336 21.489 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.172 43.797 23.121 1.00 0.00 H new ATOM 0 HG LEU A 56 38.097 43.123 20.902 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.587 45.602 20.994 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.884 45.289 20.580 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.321 45.781 22.233 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.846 44.074 22.368 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.644 44.257 23.667 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.085 42.634 23.085 1.00 0.00 H new ATOM 904 N SER A 57 34.101 41.100 22.609 1.00 0.00 N ATOM 905 CA SER A 57 32.820 40.661 23.124 1.00 0.00 C ATOM 906 C SER A 57 32.885 39.304 23.826 1.00 0.00 C ATOM 907 O SER A 57 32.287 39.157 24.890 1.00 0.00 O ATOM 908 CB SER A 57 31.757 40.600 22.031 1.00 0.00 C ATOM 909 OG SER A 57 32.163 39.819 20.929 1.00 0.00 O ATOM 0 H SER A 57 34.115 41.191 21.593 1.00 0.00 H new ATOM 0 HA SER A 57 32.543 41.413 23.862 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.837 40.188 22.445 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.530 41.611 21.692 1.00 0.00 H new ATOM 0 HG SER A 57 32.727 40.358 20.336 1.00 0.00 H new ATOM 915 N ASP A 58 33.620 38.335 23.288 1.00 0.00 N ATOM 916 CA ASP A 58 33.783 37.040 23.916 1.00 0.00 C ATOM 917 C ASP A 58 34.516 37.136 25.256 1.00 0.00 C ATOM 918 O ASP A 58 34.127 36.479 26.217 1.00 0.00 O ATOM 919 CB ASP A 58 34.496 36.071 22.978 1.00 0.00 C ATOM 920 CG ASP A 58 33.698 35.720 21.721 1.00 0.00 C ATOM 921 OD1 ASP A 58 32.513 35.331 21.816 1.00 0.00 O ATOM 922 OD2 ASP A 58 34.264 35.824 20.611 1.00 0.00 O ATOM 0 H ASP A 58 34.118 38.432 22.403 1.00 0.00 H new ATOM 0 HA ASP A 58 32.785 36.655 24.123 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.450 36.506 22.680 1.00 0.00 H new ATOM 0 HB3 ASP A 58 34.720 35.153 23.522 1.00 0.00 H new ATOM 927 N TYR A 59 35.487 38.039 25.356 1.00 0.00 N ATOM 928 CA TYR A 59 36.152 38.423 26.585 1.00 0.00 C ATOM 929 C TYR A 59 35.353 39.370 27.483 1.00 0.00 C ATOM 930 O TYR A 59 35.884 39.832 28.491 1.00 0.00 O ATOM 931 CB TYR A 59 37.534 38.980 26.261 1.00 0.00 C ATOM 932 CG TYR A 59 38.580 37.969 25.853 1.00 0.00 C ATOM 933 CD1 TYR A 59 38.987 36.987 26.764 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.213 38.067 24.609 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.028 36.108 26.441 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.260 37.200 24.273 1.00 0.00 C ATOM 937 CZ TYR A 59 40.673 36.216 25.193 1.00 0.00 C ATOM 938 OH TYR A 59 41.715 35.390 24.892 1.00 0.00 O ATOM 0 H TYR A 59 35.843 38.542 24.543 1.00 0.00 H new ATOM 0 HA TYR A 59 36.246 37.516 27.182 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.430 39.709 25.458 1.00 0.00 H new ATOM 0 HB3 TYR A 59 37.900 39.519 27.135 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.495 36.907 27.722 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.891 38.818 23.902 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.335 35.350 27.146 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.748 37.285 23.314 1.00 0.00 H new ATOM 0 HH TYR A 59 41.600 34.535 25.358 1.00 0.00 H new ATOM 948 N ASN A 60 34.091 39.663 27.181 1.00 0.00 N ATOM 949 CA ASN A 60 33.222 40.555 27.922 1.00 0.00 C ATOM 950 C ASN A 60 33.743 41.984 28.087 1.00 0.00 C ATOM 951 O ASN A 60 33.343 42.676 29.021 1.00 0.00 O ATOM 952 CB ASN A 60 32.787 39.904 29.233 1.00 0.00 C ATOM 953 CG ASN A 60 31.732 38.802 29.109 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.034 38.644 28.111 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.545 38.040 30.183 1.00 0.00 N ATOM 0 H ASN A 60 33.628 39.259 26.367 1.00 0.00 H new ATOM 0 HA ASN A 60 32.335 40.701 27.306 1.00 0.00 H new ATOM 0 HB2 ASN A 60 33.668 39.485 29.719 1.00 0.00 H new ATOM 0 HB3 ASN A 60 32.399 40.681 29.892 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.820 37.322 30.179 1.00 0.00 H new ATOM 0 HD22 ASN A 60 32.126 38.173 31.010 1.00 0.00 H new ATOM 962 N ILE A 61 34.614 42.478 27.212 1.00 0.00 N ATOM 963 CA ILE A 61 35.214 43.791 27.339 1.00 0.00 C ATOM 964 C ILE A 61 34.248 44.851 26.804 1.00 0.00 C ATOM 965 O ILE A 61 33.877 44.825 25.633 1.00 0.00 O ATOM 966 CB ILE A 61 36.589 43.859 26.680 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.473 42.714 27.168 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.238 45.209 26.971 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.919 42.696 26.679 1.00 0.00 C ATOM 0 H ILE A 61 34.923 41.966 26.386 1.00 0.00 H new ATOM 0 HA ILE A 61 35.389 43.996 28.395 1.00 0.00 H new ATOM 0 HB ILE A 61 36.471 43.756 25.601 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.484 42.736 28.258 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.004 41.775 26.873 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.219 45.251 26.498 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.610 46.007 26.575 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.349 45.335 28.048 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.435 41.833 27.099 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.934 42.633 25.591 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.422 43.609 26.997 1.00 0.00 H new ATOM 981 N GLN A 62 33.833 45.774 27.668 1.00 0.00 N ATOM 982 CA GLN A 62 32.866 46.814 27.382 1.00 0.00 C ATOM 983 C GLN A 62 33.514 48.189 27.211 1.00 0.00 C ATOM 984 O GLN A 62 34.695 48.368 27.497 1.00 0.00 O ATOM 985 CB GLN A 62 31.785 46.787 28.457 1.00 0.00 C ATOM 986 CG GLN A 62 31.001 45.480 28.388 1.00 0.00 C ATOM 987 CD GLN A 62 29.773 45.399 29.298 1.00 0.00 C ATOM 988 OE1 GLN A 62 29.516 46.216 30.180 1.00 0.00 O ATOM 989 NE2 GLN A 62 28.961 44.363 29.114 1.00 0.00 N ATOM 0 H GLN A 62 34.181 45.813 28.626 1.00 0.00 H new ATOM 0 HA GLN A 62 32.400 46.615 26.417 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.239 46.895 29.442 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.109 47.632 28.324 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.679 45.324 27.358 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.673 44.660 28.640 1.00 0.00 H new ATOM 0 HE21 GLN A 62 29.164 43.679 28.385 1.00 0.00 H new ATOM 0 HE22 GLN A 62 28.135 44.252 29.702 1.00 0.00 H new ATOM 998 N LYS A 63 32.756 49.177 26.742 1.00 0.00 N ATOM 999 CA LYS A 63 33.230 50.520 26.474 1.00 0.00 C ATOM 1000 C LYS A 63 33.951 51.174 27.654 1.00 0.00 C ATOM 1001 O LYS A 63 33.619 50.950 28.816 1.00 0.00 O ATOM 1002 CB LYS A 63 32.089 51.401 25.975 1.00 0.00 C ATOM 1003 CG LYS A 63 31.031 51.743 27.020 1.00 0.00 C ATOM 1004 CD LYS A 63 29.898 52.550 26.393 1.00 0.00 C ATOM 1005 CE LYS A 63 28.749 52.829 27.360 1.00 0.00 C ATOM 1006 NZ LYS A 63 29.076 53.840 28.376 1.00 0.00 N ATOM 0 H LYS A 63 31.765 49.055 26.534 1.00 0.00 H new ATOM 0 HA LYS A 63 33.982 50.422 25.691 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.510 52.330 25.589 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.602 50.899 25.138 1.00 0.00 H new ATOM 0 HG2 LYS A 63 30.634 50.827 27.457 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.484 52.312 27.832 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.295 53.497 26.028 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.513 52.011 25.528 1.00 0.00 H new ATOM 0 HE2 LYS A 63 27.879 53.162 26.793 1.00 0.00 H new ATOM 0 HE3 LYS A 63 28.469 51.901 27.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 28.256 53.983 29.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 29.888 53.516 28.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 29.316 54.737 27.908 1.00 0.00 H new ATOM 1020 N GLU A 64 34.919 52.030 27.340 1.00 0.00 N ATOM 1021 CA GLU A 64 35.713 52.819 28.261 1.00 0.00 C ATOM 1022 C GLU A 64 36.572 52.008 29.233 1.00 0.00 C ATOM 1023 O GLU A 64 37.094 52.565 30.195 1.00 0.00 O ATOM 1024 CB GLU A 64 34.874 53.904 28.928 1.00 0.00 C ATOM 1025 CG GLU A 64 34.095 54.752 27.927 1.00 0.00 C ATOM 1026 CD GLU A 64 33.295 55.894 28.556 1.00 0.00 C ATOM 1027 OE1 GLU A 64 32.911 56.818 27.808 1.00 0.00 O ATOM 1028 OE2 GLU A 64 32.987 55.872 29.768 1.00 0.00 O ATOM 0 H GLU A 64 35.183 52.198 26.369 1.00 0.00 H new ATOM 0 HA GLU A 64 36.461 53.325 27.651 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.176 53.440 29.624 1.00 0.00 H new ATOM 0 HB3 GLU A 64 35.526 54.551 29.515 1.00 0.00 H new ATOM 0 HG2 GLU A 64 34.793 55.170 27.202 1.00 0.00 H new ATOM 0 HG3 GLU A 64 33.412 54.106 27.376 1.00 0.00 H new ATOM 1035 N SER A 65 36.754 50.715 28.984 1.00 0.00 N ATOM 1036 CA SER A 65 37.665 49.848 29.705 1.00 0.00 C ATOM 1037 C SER A 65 39.132 50.245 29.520 1.00 0.00 C ATOM 1038 O SER A 65 39.512 50.751 28.466 1.00 0.00 O ATOM 1039 CB SER A 65 37.519 48.394 29.263 1.00 0.00 C ATOM 1040 OG SER A 65 36.243 47.890 29.585 1.00 0.00 O ATOM 0 H SER A 65 36.248 50.228 28.244 1.00 0.00 H new ATOM 0 HA SER A 65 37.394 49.958 30.755 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.682 48.320 28.188 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.285 47.786 29.744 1.00 0.00 H new ATOM 0 HG SER A 65 35.574 48.286 28.988 1.00 0.00 H new ATOM 1046 N THR A 66 39.958 49.932 30.514 1.00 0.00 N ATOM 1047 CA THR A 66 41.401 50.041 30.450 1.00 0.00 C ATOM 1048 C THR A 66 42.055 48.661 30.359 1.00 0.00 C ATOM 1049 O THR A 66 41.862 47.795 31.210 1.00 0.00 O ATOM 1050 CB THR A 66 41.960 50.850 31.616 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.538 52.188 31.477 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.485 50.893 31.646 1.00 0.00 C ATOM 0 H THR A 66 39.624 49.585 31.413 1.00 0.00 H new ATOM 0 HA THR A 66 41.647 50.585 29.538 1.00 0.00 H new ATOM 0 HB THR A 66 41.600 50.368 32.525 1.00 0.00 H new ATOM 0 HG1 THR A 66 41.889 52.721 32.221 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.816 51.484 32.500 1.00 0.00 H new ATOM 0 HG22 THR A 66 43.876 49.879 31.733 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.854 51.346 30.726 1.00 0.00 H new ATOM 1060 N LEU A 67 42.859 48.473 29.317 1.00 0.00 N ATOM 1061 CA LEU A 67 43.590 47.275 28.956 1.00 0.00 C ATOM 1062 C LEU A 67 45.095 47.553 28.959 1.00 0.00 C ATOM 1063 O LEU A 67 45.513 48.697 29.121 1.00 0.00 O ATOM 1064 CB LEU A 67 43.126 46.792 27.584 1.00 0.00 C ATOM 1065 CG LEU A 67 41.646 46.525 27.323 1.00 0.00 C ATOM 1066 CD1 LEU A 67 40.830 47.778 27.018 1.00 0.00 C ATOM 1067 CD2 LEU A 67 41.534 45.635 26.088 1.00 0.00 C ATOM 0 H LEU A 67 43.026 49.225 28.648 1.00 0.00 H new ATOM 0 HA LEU A 67 43.392 46.492 29.688 1.00 0.00 H new ATOM 0 HB2 LEU A 67 43.455 47.531 26.853 1.00 0.00 H new ATOM 0 HB3 LEU A 67 43.664 45.869 27.368 1.00 0.00 H new ATOM 0 HG LEU A 67 41.253 46.076 28.235 1.00 0.00 H new ATOM 0 HD11 LEU A 67 39.790 47.502 26.845 1.00 0.00 H new ATOM 0 HD12 LEU A 67 40.887 48.464 27.863 1.00 0.00 H new ATOM 0 HD13 LEU A 67 41.229 48.264 26.128 1.00 0.00 H new ATOM 0 HD21 LEU A 67 40.484 45.430 25.881 1.00 0.00 H new ATOM 0 HD22 LEU A 67 41.980 46.142 25.232 1.00 0.00 H new ATOM 0 HD23 LEU A 67 42.058 44.696 26.267 1.00 0.00 H new ATOM 1079 N HIS A 68 45.933 46.541 28.754 1.00 0.00 N ATOM 1080 CA HIS A 68 47.377 46.663 28.719 1.00 0.00 C ATOM 1081 C HIS A 68 48.019 46.053 27.471 1.00 0.00 C ATOM 1082 O HIS A 68 47.459 45.156 26.846 1.00 0.00 O ATOM 1083 CB HIS A 68 47.981 46.042 29.975 1.00 0.00 C ATOM 1084 CG HIS A 68 47.856 46.886 31.215 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.930 47.424 31.920 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.694 47.176 31.882 1.00 0.00 C ATOM 1087 CE1 HIS A 68 48.401 48.053 32.972 1.00 0.00 C ATOM 1088 NE2 HIS A 68 47.064 47.925 32.982 1.00 0.00 N ATOM 0 H HIS A 68 45.610 45.585 28.603 1.00 0.00 H new ATOM 0 HA HIS A 68 47.594 47.731 28.681 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.500 45.081 30.156 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.037 45.841 29.793 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.693 46.879 31.604 1.00 0.00 H new ATOM 0 HE1 HIS A 68 48.971 48.592 33.714 1.00 0.00 H new ATOM 0 HE2 HIS A 68 46.431 48.314 33.681 1.00 0.00 H new ATOM 1096 N LEU A 69 49.218 46.529 27.150 1.00 0.00 N ATOM 1097 CA LEU A 69 50.089 46.062 26.089 1.00 0.00 C ATOM 1098 C LEU A 69 51.497 45.822 26.637 1.00 0.00 C ATOM 1099 O LEU A 69 52.067 46.694 27.288 1.00 0.00 O ATOM 1100 CB LEU A 69 50.084 47.109 24.980 1.00 0.00 C ATOM 1101 CG LEU A 69 51.122 46.948 23.872 1.00 0.00 C ATOM 1102 CD1 LEU A 69 50.942 45.679 23.044 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.033 48.141 22.925 1.00 0.00 C ATOM 0 H LEU A 69 49.631 47.307 27.664 1.00 0.00 H new ATOM 0 HA LEU A 69 49.736 45.113 25.685 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.095 47.112 24.521 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.226 48.088 25.438 1.00 0.00 H new ATOM 0 HG LEU A 69 52.091 46.885 24.367 1.00 0.00 H new ATOM 0 HD11 LEU A 69 51.715 45.633 22.277 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.022 44.807 23.693 1.00 0.00 H new ATOM 0 HD13 LEU A 69 49.960 45.690 22.570 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.772 48.032 22.131 1.00 0.00 H new ATOM 0 HD22 LEU A 69 50.035 48.185 22.488 1.00 0.00 H new ATOM 0 HD23 LEU A 69 51.228 49.060 23.478 1.00 0.00 H new ATOM 1115 N VAL A 70 52.082 44.670 26.315 1.00 0.00 N ATOM 1116 CA VAL A 70 53.452 44.288 26.586 1.00 0.00 C ATOM 1117 C VAL A 70 54.173 44.008 25.266 1.00 0.00 C ATOM 1118 O VAL A 70 53.573 43.467 24.339 1.00 0.00 O ATOM 1119 CB VAL A 70 53.497 43.087 27.529 1.00 0.00 C ATOM 1120 CG1 VAL A 70 54.877 42.453 27.673 1.00 0.00 C ATOM 1121 CG2 VAL A 70 53.040 43.497 28.926 1.00 0.00 C ATOM 0 H VAL A 70 51.571 43.935 25.826 1.00 0.00 H new ATOM 0 HA VAL A 70 53.969 45.106 27.088 1.00 0.00 H new ATOM 0 HB VAL A 70 52.833 42.350 27.076 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.819 41.608 28.360 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.221 42.106 26.699 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.578 43.191 28.064 1.00 0.00 H new ATOM 0 HG21 VAL A 70 53.076 42.633 29.589 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.698 44.277 29.310 1.00 0.00 H new ATOM 0 HG23 VAL A 70 52.019 43.875 28.878 1.00 0.00 H new