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 22 THR OG1 : rot -48:sc= 1.29 USER MOD Set 1.2: A 25 ASN : amide:sc= 1.53 K(o=2.8,f=-5.3!) USER MOD Set 2.1: A 6 LYS NZ :NH3+ 154:sc= 1.17 (180deg=0) USER MOD Set 2.2: A 12 THR OG1 : rot 170:sc= 0.982 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -167:sc= 2.37 (180deg=1.85) USER MOD Single : A 2 GLN : amide:sc= 0.63 K(o=0.63,f=-0.039) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -76:sc= 0.317 USER MOD Single : A 20 SER OG : rot 180:sc= 0.024 USER MOD Single : A 27 LYS NZ :NH3+ -179:sc= 2.09 (180deg=2.03) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.2 K(o=-0.2,f=-1.3) USER MOD Single : A 33 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00827) USER MOD Single : A 40 GLN : amide:sc= -0.0689 X(o=-0.069,f=-0.24) USER MOD Single : A 41 GLN : amide:sc= 1.77 K(o=1.8,f=-3.1!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.753 K(o=0.75,f=0) USER MOD Single : A 55 THR OG1 : rot -55:sc= 1.2 USER MOD Single : A 57 SER OG : rot 65:sc= 1.01 USER MOD Single : A 59 TYR OH : rot 130:sc= 0.266 USER MOD Single : A 60 ASN : amide:sc= -0.107 X(o=-0.11,f=-0.11) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -167:sc= 1.24 (180deg=1.09) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.026) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.892 51.495 20.025 1.00 0.00 N ATOM 2 CA MET A 1 33.265 51.868 21.399 1.00 0.00 C ATOM 3 C MET A 1 34.709 52.366 21.476 1.00 0.00 C ATOM 4 O MET A 1 35.602 51.802 20.848 1.00 0.00 O ATOM 5 CB MET A 1 32.993 50.739 22.390 1.00 0.00 C ATOM 6 CG MET A 1 33.850 49.487 22.228 1.00 0.00 C ATOM 7 SD MET A 1 33.413 48.153 23.371 1.00 0.00 S ATOM 8 CE MET A 1 34.767 47.001 23.027 1.00 0.00 C ATOM 0 H1 MET A 1 31.861 51.375 19.966 1.00 0.00 H new ATOM 0 H2 MET A 1 33.191 52.244 19.369 1.00 0.00 H new ATOM 0 H3 MET A 1 33.360 50.602 19.768 1.00 0.00 H new ATOM 0 HA MET A 1 32.625 52.701 21.691 1.00 0.00 H new ATOM 0 HB2 MET A 1 33.136 51.125 23.399 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.945 50.452 22.305 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.755 49.123 21.205 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.897 49.752 22.376 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.656 46.113 23.649 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.742 46.713 21.976 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.719 47.483 23.248 1.00 0.00 H new ATOM 20 N GLN A 2 34.926 53.388 22.300 1.00 0.00 N ATOM 21 CA GLN A 2 36.244 53.833 22.705 1.00 0.00 C ATOM 22 C GLN A 2 36.868 52.830 23.676 1.00 0.00 C ATOM 23 O GLN A 2 36.207 52.402 24.619 1.00 0.00 O ATOM 24 CB GLN A 2 36.154 55.205 23.367 1.00 0.00 C ATOM 25 CG GLN A 2 35.694 56.344 22.460 1.00 0.00 C ATOM 26 CD GLN A 2 36.764 56.772 21.455 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.589 57.646 21.711 1.00 0.00 O ATOM 28 NE2 GLN A 2 36.804 56.174 20.267 1.00 0.00 N ATOM 0 H GLN A 2 34.170 53.937 22.710 1.00 0.00 H new ATOM 0 HA GLN A 2 36.874 53.905 21.818 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.468 55.137 24.212 1.00 0.00 H new ATOM 0 HB3 GLN A 2 37.134 55.459 23.771 1.00 0.00 H new ATOM 0 HG2 GLN A 2 34.799 56.034 21.921 1.00 0.00 H new ATOM 0 HG3 GLN A 2 35.415 57.201 23.074 1.00 0.00 H new ATOM 0 HE21 GLN A 2 36.126 55.447 20.039 1.00 0.00 H new ATOM 0 HE22 GLN A 2 37.512 56.443 19.584 1.00 0.00 H new ATOM 37 N ILE A 3 38.141 52.490 23.489 1.00 0.00 N ATOM 38 CA ILE A 3 38.923 51.668 24.390 1.00 0.00 C ATOM 39 C ILE A 3 40.267 52.336 24.682 1.00 0.00 C ATOM 40 O ILE A 3 40.743 53.129 23.872 1.00 0.00 O ATOM 41 CB ILE A 3 39.087 50.237 23.882 1.00 0.00 C ATOM 42 CG1 ILE A 3 40.049 50.102 22.705 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.740 49.610 23.534 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.406 48.663 22.346 1.00 0.00 C ATOM 0 H ILE A 3 38.670 52.795 22.672 1.00 0.00 H new ATOM 0 HA ILE A 3 38.374 51.585 25.328 1.00 0.00 H new ATOM 0 HB ILE A 3 39.535 49.692 24.713 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.606 50.582 21.832 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.966 50.644 22.937 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.894 48.592 23.176 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.108 49.591 24.422 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.255 50.199 22.756 1.00 0.00 H new ATOM 0 HD11 ILE A 3 41.093 48.659 21.500 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.880 48.182 23.201 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.500 48.119 22.080 1.00 0.00 H new ATOM 56 N PHE A 4 40.917 51.985 25.789 1.00 0.00 N ATOM 57 CA PHE A 4 42.223 52.505 26.142 1.00 0.00 C ATOM 58 C PHE A 4 43.284 51.405 26.204 1.00 0.00 C ATOM 59 O PHE A 4 42.994 50.295 26.644 1.00 0.00 O ATOM 60 CB PHE A 4 42.163 53.225 27.486 1.00 0.00 C ATOM 61 CG PHE A 4 41.172 54.359 27.588 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.274 55.462 26.732 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.186 54.340 28.582 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.379 56.532 26.856 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.303 55.416 28.719 1.00 0.00 C ATOM 66 CZ PHE A 4 39.394 56.511 27.851 1.00 0.00 C ATOM 0 H PHE A 4 40.542 51.324 26.469 1.00 0.00 H new ATOM 0 HA PHE A 4 42.508 53.206 25.358 1.00 0.00 H new ATOM 0 HB2 PHE A 4 41.927 52.492 28.258 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.156 53.615 27.711 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.044 55.488 25.975 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.107 53.491 29.245 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.449 57.374 26.184 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.551 55.402 29.494 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.706 57.338 27.949 1.00 0.00 H new ATOM 76 N VAL A 5 44.522 51.729 25.841 1.00 0.00 N ATOM 77 CA VAL A 5 45.669 50.855 25.988 1.00 0.00 C ATOM 78 C VAL A 5 46.822 51.605 26.658 1.00 0.00 C ATOM 79 O VAL A 5 47.148 52.717 26.247 1.00 0.00 O ATOM 80 CB VAL A 5 46.120 50.258 24.657 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.142 49.147 24.872 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.972 49.675 23.837 1.00 0.00 C ATOM 0 H VAL A 5 44.755 52.631 25.426 1.00 0.00 H new ATOM 0 HA VAL A 5 45.364 50.023 26.622 1.00 0.00 H new ATOM 0 HB VAL A 5 46.557 51.091 24.106 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.445 48.740 23.907 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.014 49.550 25.387 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.698 48.356 25.476 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.361 49.268 22.904 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.486 48.881 24.404 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.248 50.459 23.616 1.00 0.00 H new ATOM 92 N LYS A 6 47.454 51.007 27.662 1.00 0.00 N ATOM 93 CA LYS A 6 48.670 51.519 28.260 1.00 0.00 C ATOM 94 C LYS A 6 49.898 51.100 27.449 1.00 0.00 C ATOM 95 O LYS A 6 50.233 49.918 27.395 1.00 0.00 O ATOM 96 CB LYS A 6 48.786 51.096 29.722 1.00 0.00 C ATOM 97 CG LYS A 6 47.693 51.630 30.643 1.00 0.00 C ATOM 98 CD LYS A 6 47.621 53.153 30.711 1.00 0.00 C ATOM 99 CE LYS A 6 46.620 53.588 31.778 1.00 0.00 C ATOM 100 NZ LYS A 6 46.445 55.048 31.796 1.00 0.00 N ATOM 0 H LYS A 6 47.126 50.139 28.086 1.00 0.00 H new ATOM 0 HA LYS A 6 48.623 52.608 28.242 1.00 0.00 H new ATOM 0 HB2 LYS A 6 48.779 50.007 29.770 1.00 0.00 H new ATOM 0 HB3 LYS A 6 49.753 51.425 30.103 1.00 0.00 H new ATOM 0 HG2 LYS A 6 46.730 51.247 30.306 1.00 0.00 H new ATOM 0 HG3 LYS A 6 47.857 51.240 31.647 1.00 0.00 H new ATOM 0 HD2 LYS A 6 48.606 53.561 30.939 1.00 0.00 H new ATOM 0 HD3 LYS A 6 47.326 53.554 29.741 1.00 0.00 H new ATOM 0 HE2 LYS A 6 45.659 53.108 31.593 1.00 0.00 H new ATOM 0 HE3 LYS A 6 46.961 53.250 32.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 45.504 55.280 32.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 47.176 55.478 32.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 46.531 55.420 30.829 1.00 0.00 H new ATOM 168 N LYS A 11 52.199 55.707 29.112 1.00 0.00 N ATOM 169 CA LYS A 11 51.209 56.645 28.622 1.00 0.00 C ATOM 170 C LYS A 11 50.048 55.928 27.931 1.00 0.00 C ATOM 171 O LYS A 11 50.229 54.830 27.410 1.00 0.00 O ATOM 172 CB LYS A 11 51.895 57.681 27.734 1.00 0.00 C ATOM 173 CG LYS A 11 50.952 58.809 27.330 1.00 0.00 C ATOM 174 CD LYS A 11 51.684 59.950 26.628 1.00 0.00 C ATOM 175 CE LYS A 11 50.645 60.971 26.173 1.00 0.00 C ATOM 176 NZ LYS A 11 51.283 62.201 25.681 1.00 0.00 N ATOM 0 HA LYS A 11 50.758 57.174 29.462 1.00 0.00 H new ATOM 0 HB2 LYS A 11 52.753 58.098 28.262 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.279 57.192 26.838 1.00 0.00 H new ATOM 0 HG2 LYS A 11 50.179 58.415 26.670 1.00 0.00 H new ATOM 0 HG3 LYS A 11 50.448 59.194 28.217 1.00 0.00 H new ATOM 0 HD2 LYS A 11 52.403 60.414 27.304 1.00 0.00 H new ATOM 0 HD3 LYS A 11 52.247 59.573 25.774 1.00 0.00 H new ATOM 0 HE2 LYS A 11 50.028 60.539 25.385 1.00 0.00 H new ATOM 0 HE3 LYS A 11 49.980 61.211 27.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 50.551 62.875 25.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 51.852 62.625 26.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 51.898 61.974 24.874 1.00 0.00 H new ATOM 190 N THR A 12 48.861 56.525 27.894 1.00 0.00 N ATOM 191 CA THR A 12 47.688 55.956 27.260 1.00 0.00 C ATOM 192 C THR A 12 47.629 56.263 25.762 1.00 0.00 C ATOM 193 O THR A 12 48.152 57.276 25.304 1.00 0.00 O ATOM 194 CB THR A 12 46.412 56.412 27.962 1.00 0.00 C ATOM 195 OG1 THR A 12 46.592 56.456 29.359 1.00 0.00 O ATOM 196 CG2 THR A 12 45.229 55.477 27.725 1.00 0.00 C ATOM 0 H THR A 12 48.689 57.438 28.315 1.00 0.00 H new ATOM 0 HA THR A 12 47.768 54.873 27.359 1.00 0.00 H new ATOM 0 HB THR A 12 46.201 57.395 27.542 1.00 0.00 H new ATOM 0 HG1 THR A 12 45.824 56.901 29.774 1.00 0.00 H new ATOM 0 HG21 THR A 12 44.353 55.858 28.251 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.016 55.423 26.657 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.472 54.482 28.097 1.00 0.00 H new ATOM 204 N ILE A 13 46.978 55.388 24.999 1.00 0.00 N ATOM 205 CA ILE A 13 46.431 55.651 23.684 1.00 0.00 C ATOM 206 C ILE A 13 44.956 55.245 23.642 1.00 0.00 C ATOM 207 O ILE A 13 44.567 54.280 24.296 1.00 0.00 O ATOM 208 CB ILE A 13 47.218 54.969 22.568 1.00 0.00 C ATOM 209 CG1 ILE A 13 47.411 53.474 22.805 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.530 55.715 22.339 1.00 0.00 C ATOM 211 CD1 ILE A 13 48.110 52.704 21.688 1.00 0.00 C ATOM 0 H ILE A 13 46.813 54.429 25.304 1.00 0.00 H new ATOM 0 HA ILE A 13 46.516 56.723 23.505 1.00 0.00 H new ATOM 0 HB ILE A 13 46.632 55.024 21.651 1.00 0.00 H new ATOM 0 HG12 ILE A 13 47.984 53.343 23.723 1.00 0.00 H new ATOM 0 HG13 ILE A 13 46.433 53.024 22.973 1.00 0.00 H new ATOM 0 HG21 ILE A 13 49.091 55.227 21.542 1.00 0.00 H new ATOM 0 HG22 ILE A 13 48.318 56.746 22.055 1.00 0.00 H new ATOM 0 HG23 ILE A 13 49.119 55.705 23.256 1.00 0.00 H new ATOM 0 HD11 ILE A 13 48.192 51.653 21.966 1.00 0.00 H new ATOM 0 HD12 ILE A 13 47.532 52.792 20.768 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.107 53.116 21.531 1.00 0.00 H new ATOM 223 N THR A 14 44.154 55.949 22.849 1.00 0.00 N ATOM 224 CA THR A 14 42.739 55.680 22.688 1.00 0.00 C ATOM 225 C THR A 14 42.454 55.086 21.308 1.00 0.00 C ATOM 226 O THR A 14 42.861 55.653 20.296 1.00 0.00 O ATOM 227 CB THR A 14 41.887 56.927 22.905 1.00 0.00 C ATOM 228 OG1 THR A 14 42.229 57.565 24.114 1.00 0.00 O ATOM 229 CG2 THR A 14 40.401 56.590 22.991 1.00 0.00 C ATOM 0 H THR A 14 44.482 56.738 22.291 1.00 0.00 H new ATOM 0 HA THR A 14 42.466 54.955 23.454 1.00 0.00 H new ATOM 0 HB THR A 14 42.078 57.575 22.050 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.845 57.068 24.866 1.00 0.00 H new ATOM 0 HG21 THR A 14 39.829 57.505 23.146 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.081 56.115 22.064 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.230 55.910 23.825 1.00 0.00 H new ATOM 237 N LEU A 15 41.738 53.966 21.261 1.00 0.00 N ATOM 238 CA LEU A 15 41.352 53.252 20.061 1.00 0.00 C ATOM 239 C LEU A 15 39.831 53.225 19.895 1.00 0.00 C ATOM 240 O LEU A 15 39.103 53.321 20.880 1.00 0.00 O ATOM 241 CB LEU A 15 41.924 51.837 20.100 1.00 0.00 C ATOM 242 CG LEU A 15 43.334 51.639 19.555 1.00 0.00 C ATOM 243 CD1 LEU A 15 44.427 52.376 20.324 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.668 50.151 19.615 1.00 0.00 C ATOM 0 H LEU A 15 41.396 53.513 22.108 1.00 0.00 H new ATOM 0 HA LEU A 15 41.761 53.776 19.197 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.911 51.496 21.135 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.252 51.186 19.542 1.00 0.00 H new ATOM 0 HG LEU A 15 43.323 52.046 18.544 1.00 0.00 H new ATOM 0 HD11 LEU A 15 45.394 52.175 19.863 1.00 0.00 H new ATOM 0 HD12 LEU A 15 44.229 53.448 20.300 1.00 0.00 H new ATOM 0 HD13 LEU A 15 44.439 52.032 21.358 1.00 0.00 H new ATOM 0 HD21 LEU A 15 44.674 49.988 19.229 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.616 49.808 20.648 1.00 0.00 H new ATOM 0 HD23 LEU A 15 42.953 49.593 19.011 1.00 0.00 H new ATOM 256 N GLU A 16 39.356 53.028 18.668 1.00 0.00 N ATOM 257 CA GLU A 16 37.954 52.849 18.347 1.00 0.00 C ATOM 258 C GLU A 16 37.728 51.532 17.600 1.00 0.00 C ATOM 259 O GLU A 16 38.253 51.325 16.509 1.00 0.00 O ATOM 260 CB GLU A 16 37.451 54.051 17.554 1.00 0.00 C ATOM 261 CG GLU A 16 36.014 53.987 17.044 1.00 0.00 C ATOM 262 CD GLU A 16 34.946 53.761 18.116 1.00 0.00 C ATOM 263 OE1 GLU A 16 34.148 52.811 17.974 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.832 54.562 19.070 1.00 0.00 O ATOM 0 H GLU A 16 39.961 52.988 17.848 1.00 0.00 H new ATOM 0 HA GLU A 16 37.378 52.789 19.271 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.550 54.937 18.181 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.110 54.192 16.697 1.00 0.00 H new ATOM 0 HG2 GLU A 16 35.790 54.918 16.523 1.00 0.00 H new ATOM 0 HG3 GLU A 16 35.943 53.185 16.309 1.00 0.00 H new ATOM 271 N VAL A 17 36.935 50.649 18.200 1.00 0.00 N ATOM 272 CA VAL A 17 36.609 49.324 17.711 1.00 0.00 C ATOM 273 C VAL A 17 35.156 48.978 18.042 1.00 0.00 C ATOM 274 O VAL A 17 34.545 49.590 18.916 1.00 0.00 O ATOM 275 CB VAL A 17 37.524 48.254 18.301 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.955 48.365 17.781 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.560 48.261 19.826 1.00 0.00 C ATOM 0 H VAL A 17 36.480 50.856 19.089 1.00 0.00 H new ATOM 0 HA VAL A 17 36.753 49.339 16.631 1.00 0.00 H new ATOM 0 HB VAL A 17 37.086 47.312 17.971 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.567 47.582 18.230 1.00 0.00 H new ATOM 0 HG12 VAL A 17 38.958 48.251 16.697 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.363 49.341 18.045 1.00 0.00 H new ATOM 0 HG21 VAL A 17 38.229 47.476 20.178 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.919 49.228 20.177 1.00 0.00 H new ATOM 0 HG23 VAL A 17 36.557 48.084 20.214 1.00 0.00 H new ATOM 287 N GLU A 18 34.592 47.956 17.403 1.00 0.00 N ATOM 288 CA GLU A 18 33.370 47.327 17.863 1.00 0.00 C ATOM 289 C GLU A 18 33.709 46.141 18.768 1.00 0.00 C ATOM 290 O GLU A 18 34.753 45.519 18.581 1.00 0.00 O ATOM 291 CB GLU A 18 32.521 46.907 16.666 1.00 0.00 C ATOM 292 CG GLU A 18 32.110 48.040 15.731 1.00 0.00 C ATOM 293 CD GLU A 18 31.389 49.194 16.432 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.498 48.947 17.274 1.00 0.00 O ATOM 295 OE2 GLU A 18 31.691 50.366 16.123 1.00 0.00 O ATOM 0 H GLU A 18 34.975 47.545 16.552 1.00 0.00 H new ATOM 0 HA GLU A 18 32.785 48.036 18.449 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.075 46.165 16.090 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.620 46.417 17.034 1.00 0.00 H new ATOM 0 HG2 GLU A 18 32.999 48.429 15.235 1.00 0.00 H new ATOM 0 HG3 GLU A 18 31.461 47.638 14.953 1.00 0.00 H new ATOM 302 N PRO A 19 32.869 45.746 19.720 1.00 0.00 N ATOM 303 CA PRO A 19 33.136 44.583 20.543 1.00 0.00 C ATOM 304 C PRO A 19 33.129 43.268 19.760 1.00 0.00 C ATOM 305 O PRO A 19 33.552 42.238 20.279 1.00 0.00 O ATOM 306 CB PRO A 19 32.089 44.618 21.652 1.00 0.00 C ATOM 307 CG PRO A 19 30.919 45.350 21.004 1.00 0.00 C ATOM 308 CD PRO A 19 31.618 46.368 20.107 1.00 0.00 C ATOM 0 HA PRO A 19 34.146 44.622 20.950 1.00 0.00 H new ATOM 0 HB2 PRO A 19 31.808 43.615 21.973 1.00 0.00 H new ATOM 0 HB3 PRO A 19 32.454 45.144 22.534 1.00 0.00 H new ATOM 0 HG2 PRO A 19 30.285 44.673 20.431 1.00 0.00 H new ATOM 0 HG3 PRO A 19 30.282 45.833 21.745 1.00 0.00 H new ATOM 0 HD2 PRO A 19 31.010 46.605 19.234 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.792 47.304 20.637 1.00 0.00 H new ATOM 316 N SER A 20 32.670 43.283 18.512 1.00 0.00 N ATOM 317 CA SER A 20 32.761 42.207 17.545 1.00 0.00 C ATOM 318 C SER A 20 34.118 42.101 16.846 1.00 0.00 C ATOM 319 O SER A 20 34.336 41.141 16.110 1.00 0.00 O ATOM 320 CB SER A 20 31.655 42.409 16.514 1.00 0.00 C ATOM 321 OG SER A 20 31.777 43.693 15.946 1.00 0.00 O ATOM 0 H SER A 20 32.195 44.101 18.130 1.00 0.00 H new ATOM 0 HA SER A 20 32.646 41.269 18.087 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.722 41.647 15.737 1.00 0.00 H new ATOM 0 HB3 SER A 20 30.678 42.298 16.985 1.00 0.00 H new ATOM 0 HG SER A 20 31.069 43.825 15.282 1.00 0.00 H new ATOM 327 N ASP A 21 35.033 43.047 17.033 1.00 0.00 N ATOM 328 CA ASP A 21 36.355 43.009 16.442 1.00 0.00 C ATOM 329 C ASP A 21 37.308 42.057 17.169 1.00 0.00 C ATOM 330 O ASP A 21 37.151 41.749 18.348 1.00 0.00 O ATOM 331 CB ASP A 21 36.947 44.410 16.326 1.00 0.00 C ATOM 332 CG ASP A 21 36.279 45.244 15.230 1.00 0.00 C ATOM 333 OD1 ASP A 21 36.031 44.706 14.130 1.00 0.00 O ATOM 334 OD2 ASP A 21 36.049 46.457 15.428 1.00 0.00 O ATOM 0 H ASP A 21 34.869 43.872 17.610 1.00 0.00 H new ATOM 0 HA ASP A 21 36.233 42.607 15.436 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.844 44.924 17.282 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.014 44.333 16.119 1.00 0.00 H new ATOM 339 N THR A 22 38.320 41.579 16.449 1.00 0.00 N ATOM 340 CA THR A 22 39.296 40.626 16.936 1.00 0.00 C ATOM 341 C THR A 22 40.405 41.277 17.765 1.00 0.00 C ATOM 342 O THR A 22 40.693 42.463 17.625 1.00 0.00 O ATOM 343 CB THR A 22 39.907 39.769 15.832 1.00 0.00 C ATOM 344 OG1 THR A 22 40.749 40.514 14.982 1.00 0.00 O ATOM 345 CG2 THR A 22 38.852 39.067 14.982 1.00 0.00 C ATOM 0 H THR A 22 38.482 41.857 15.481 1.00 0.00 H new ATOM 0 HA THR A 22 38.726 39.967 17.591 1.00 0.00 H new ATOM 0 HB THR A 22 40.498 39.016 16.353 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.295 41.340 14.714 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.342 38.471 14.212 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.249 38.416 15.615 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.210 39.811 14.511 1.00 0.00 H new ATOM 353 N ILE A 23 41.110 40.480 18.563 1.00 0.00 N ATOM 354 CA ILE A 23 42.314 40.918 19.240 1.00 0.00 C ATOM 355 C ILE A 23 43.380 41.375 18.242 1.00 0.00 C ATOM 356 O ILE A 23 44.118 42.318 18.520 1.00 0.00 O ATOM 357 CB ILE A 23 42.806 39.835 20.197 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.761 39.404 21.222 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.081 40.258 20.919 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.075 40.515 22.011 1.00 0.00 C ATOM 0 H ILE A 23 40.857 39.511 18.755 1.00 0.00 H new ATOM 0 HA ILE A 23 42.083 41.794 19.845 1.00 0.00 H new ATOM 0 HB ILE A 23 43.015 38.973 19.563 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.992 38.831 20.704 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.239 38.728 21.931 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.400 39.461 21.591 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.866 40.452 20.188 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.890 41.163 21.495 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.356 40.078 22.704 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.822 41.079 22.570 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.556 41.183 21.323 1.00 0.00 H new ATOM 372 N GLU A 24 43.426 40.812 17.038 1.00 0.00 N ATOM 373 CA GLU A 24 44.308 41.277 15.987 1.00 0.00 C ATOM 374 C GLU A 24 43.948 42.661 15.443 1.00 0.00 C ATOM 375 O GLU A 24 44.857 43.424 15.129 1.00 0.00 O ATOM 376 CB GLU A 24 44.361 40.295 14.820 1.00 0.00 C ATOM 377 CG GLU A 24 44.838 38.909 15.244 1.00 0.00 C ATOM 378 CD GLU A 24 45.137 38.053 14.012 1.00 0.00 C ATOM 379 OE1 GLU A 24 44.177 37.682 13.301 1.00 0.00 O ATOM 380 OE2 GLU A 24 46.332 37.799 13.748 1.00 0.00 O ATOM 0 H GLU A 24 42.847 40.017 16.769 1.00 0.00 H new ATOM 0 HA GLU A 24 45.286 41.349 16.464 1.00 0.00 H new ATOM 0 HB2 GLU A 24 43.370 40.214 14.373 1.00 0.00 H new ATOM 0 HB3 GLU A 24 45.027 40.685 14.051 1.00 0.00 H new ATOM 0 HG2 GLU A 24 45.733 38.997 15.860 1.00 0.00 H new ATOM 0 HG3 GLU A 24 44.076 38.426 15.855 1.00 0.00 H new ATOM 387 N ASN A 25 42.671 43.031 15.388 1.00 0.00 N ATOM 388 CA ASN A 25 42.279 44.384 15.045 1.00 0.00 C ATOM 389 C ASN A 25 42.817 45.382 16.072 1.00 0.00 C ATOM 390 O ASN A 25 43.351 46.425 15.705 1.00 0.00 O ATOM 391 CB ASN A 25 40.761 44.501 14.945 1.00 0.00 C ATOM 392 CG ASN A 25 40.118 43.733 13.790 1.00 0.00 C ATOM 393 OD1 ASN A 25 39.469 42.705 13.979 1.00 0.00 O ATOM 394 ND2 ASN A 25 40.230 44.241 12.566 1.00 0.00 N ATOM 0 H ASN A 25 41.890 42.404 15.579 1.00 0.00 H new ATOM 0 HA ASN A 25 42.710 44.620 14.072 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.324 44.150 15.880 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.501 45.555 14.848 1.00 0.00 H new ATOM 0 HD21 ASN A 25 39.777 43.778 11.778 1.00 0.00 H new ATOM 0 HD22 ASN A 25 40.769 45.094 12.415 1.00 0.00 H new ATOM 401 N VAL A 26 42.752 45.049 17.359 1.00 0.00 N ATOM 402 CA VAL A 26 43.318 45.874 18.407 1.00 0.00 C ATOM 403 C VAL A 26 44.836 45.975 18.247 1.00 0.00 C ATOM 404 O VAL A 26 45.366 47.084 18.244 1.00 0.00 O ATOM 405 CB VAL A 26 42.931 45.384 19.799 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.424 46.342 20.881 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.418 45.262 19.961 1.00 0.00 C ATOM 0 H VAL A 26 42.304 44.198 17.698 1.00 0.00 H new ATOM 0 HA VAL A 26 42.896 46.874 18.305 1.00 0.00 H new ATOM 0 HB VAL A 26 43.398 44.405 19.909 1.00 0.00 H new ATOM 0 HG11 VAL A 26 43.132 45.965 21.861 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.510 46.420 20.831 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.982 47.326 20.725 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.187 44.910 20.966 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.955 46.236 19.802 1.00 0.00 H new ATOM 0 HG23 VAL A 26 41.030 44.552 19.230 1.00 0.00 H new ATOM 417 N LYS A 27 45.536 44.868 18.021 1.00 0.00 N ATOM 418 CA LYS A 27 46.963 44.859 17.768 1.00 0.00 C ATOM 419 C LYS A 27 47.367 45.688 16.547 1.00 0.00 C ATOM 420 O LYS A 27 48.339 46.436 16.626 1.00 0.00 O ATOM 421 CB LYS A 27 47.462 43.427 17.588 1.00 0.00 C ATOM 422 CG LYS A 27 47.551 42.626 18.884 1.00 0.00 C ATOM 423 CD LYS A 27 47.992 41.199 18.568 1.00 0.00 C ATOM 424 CE LYS A 27 48.517 40.463 19.797 1.00 0.00 C ATOM 425 NZ LYS A 27 49.259 39.261 19.387 1.00 0.00 N ATOM 0 H LYS A 27 45.116 43.939 18.009 1.00 0.00 H new ATOM 0 HA LYS A 27 47.427 45.318 18.641 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.797 42.907 16.898 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.447 43.454 17.123 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.260 43.095 19.566 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.584 42.617 19.386 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.151 40.647 18.150 1.00 0.00 H new ATOM 0 HD3 LYS A 27 48.769 41.223 17.804 1.00 0.00 H new ATOM 0 HE2 LYS A 27 49.166 41.121 20.375 1.00 0.00 H new ATOM 0 HE3 LYS A 27 47.687 40.184 20.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 49.598 38.757 20.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.633 38.637 18.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 50.071 39.538 18.800 1.00 0.00 H new ATOM 439 N ALA A 28 46.628 45.602 15.445 1.00 0.00 N ATOM 440 CA ALA A 28 46.896 46.363 14.242 1.00 0.00 C ATOM 441 C ALA A 28 46.681 47.864 14.450 1.00 0.00 C ATOM 442 O ALA A 28 47.471 48.667 13.959 1.00 0.00 O ATOM 443 CB ALA A 28 46.031 45.820 13.108 1.00 0.00 C ATOM 0 H ALA A 28 45.815 44.991 15.368 1.00 0.00 H new ATOM 0 HA ALA A 28 47.947 46.246 13.979 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.226 46.387 12.198 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.269 44.770 12.939 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.979 45.915 13.376 1.00 0.00 H new ATOM 449 N LYS A 29 45.683 48.250 15.240 1.00 0.00 N ATOM 450 CA LYS A 29 45.419 49.622 15.629 1.00 0.00 C ATOM 451 C LYS A 29 46.393 50.159 16.679 1.00 0.00 C ATOM 452 O LYS A 29 46.621 51.367 16.704 1.00 0.00 O ATOM 453 CB LYS A 29 43.970 49.748 16.091 1.00 0.00 C ATOM 454 CG LYS A 29 42.963 49.657 14.948 1.00 0.00 C ATOM 455 CD LYS A 29 41.543 49.818 15.483 1.00 0.00 C ATOM 456 CE LYS A 29 40.470 49.469 14.456 1.00 0.00 C ATOM 457 NZ LYS A 29 40.518 50.307 13.247 1.00 0.00 N ATOM 0 H LYS A 29 45.016 47.589 15.638 1.00 0.00 H new ATOM 0 HA LYS A 29 45.578 50.247 14.750 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.758 48.963 16.817 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.841 50.701 16.605 1.00 0.00 H new ATOM 0 HG2 LYS A 29 43.171 50.430 14.208 1.00 0.00 H new ATOM 0 HG3 LYS A 29 43.062 48.697 14.442 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.418 49.183 16.360 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.400 50.847 15.812 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.581 48.424 14.168 1.00 0.00 H new ATOM 0 HE3 LYS A 29 39.489 49.570 14.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 39.763 50.017 12.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 40.383 51.304 13.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 41.441 50.193 12.782 1.00 0.00 H new ATOM 471 N ILE A 30 47.003 49.299 17.487 1.00 0.00 N ATOM 472 CA ILE A 30 48.144 49.631 18.316 1.00 0.00 C ATOM 473 C ILE A 30 49.371 49.879 17.437 1.00 0.00 C ATOM 474 O ILE A 30 50.010 50.918 17.599 1.00 0.00 O ATOM 475 CB ILE A 30 48.402 48.568 19.381 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.314 48.580 20.452 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.770 48.737 20.036 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.297 47.331 21.328 1.00 0.00 C ATOM 0 H ILE A 30 46.706 48.328 17.582 1.00 0.00 H new ATOM 0 HA ILE A 30 47.923 50.551 18.857 1.00 0.00 H new ATOM 0 HB ILE A 30 48.385 47.606 18.870 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.452 49.455 21.087 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.343 48.686 19.969 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.912 47.960 20.787 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.549 48.656 19.278 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.827 49.716 20.511 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.497 47.414 22.064 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.128 46.452 20.706 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.254 47.233 21.841 1.00 0.00 H new ATOM 490 N GLN A 31 49.682 49.003 16.487 1.00 0.00 N ATOM 491 CA GLN A 31 50.793 49.183 15.573 1.00 0.00 C ATOM 492 C GLN A 31 50.683 50.502 14.805 1.00 0.00 C ATOM 493 O GLN A 31 51.683 51.202 14.661 1.00 0.00 O ATOM 494 CB GLN A 31 50.890 48.012 14.599 1.00 0.00 C ATOM 495 CG GLN A 31 52.178 48.071 13.783 1.00 0.00 C ATOM 496 CD GLN A 31 52.270 47.001 12.692 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.309 46.311 12.359 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.439 46.811 12.090 1.00 0.00 N ATOM 0 H GLN A 31 49.161 48.140 16.332 1.00 0.00 H new ATOM 0 HA GLN A 31 51.703 49.218 16.172 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.850 47.073 15.151 1.00 0.00 H new ATOM 0 HB3 GLN A 31 50.031 48.023 13.928 1.00 0.00 H new ATOM 0 HG2 GLN A 31 52.259 49.055 13.321 1.00 0.00 H new ATOM 0 HG3 GLN A 31 53.028 47.964 14.456 1.00 0.00 H new ATOM 0 HE21 GLN A 31 54.247 47.375 12.355 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.529 46.101 11.363 1.00 0.00 H new ATOM 507 N ASP A 32 49.478 50.867 14.377 1.00 0.00 N ATOM 508 CA ASP A 32 49.194 52.108 13.686 1.00 0.00 C ATOM 509 C ASP A 32 49.662 53.355 14.440 1.00 0.00 C ATOM 510 O ASP A 32 50.063 54.321 13.795 1.00 0.00 O ATOM 511 CB ASP A 32 47.691 52.157 13.429 1.00 0.00 C ATOM 512 CG ASP A 32 47.298 53.271 12.457 1.00 0.00 C ATOM 513 OD1 ASP A 32 46.722 54.285 12.909 1.00 0.00 O ATOM 514 OD2 ASP A 32 47.507 53.103 11.237 1.00 0.00 O ATOM 0 H ASP A 32 48.651 50.285 14.509 1.00 0.00 H new ATOM 0 HA ASP A 32 49.757 52.119 12.753 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.363 51.198 13.029 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.169 52.303 14.374 1.00 0.00 H new ATOM 519 N LYS A 33 49.682 53.320 15.769 1.00 0.00 N ATOM 520 CA LYS A 33 50.155 54.381 16.636 1.00 0.00 C ATOM 521 C LYS A 33 51.585 54.174 17.140 1.00 0.00 C ATOM 522 O LYS A 33 52.340 55.141 17.215 1.00 0.00 O ATOM 523 CB LYS A 33 49.197 54.546 17.811 1.00 0.00 C ATOM 524 CG LYS A 33 47.808 55.032 17.403 1.00 0.00 C ATOM 525 CD LYS A 33 46.922 55.292 18.617 1.00 0.00 C ATOM 526 CE LYS A 33 45.466 55.614 18.292 1.00 0.00 C ATOM 527 NZ LYS A 33 45.327 56.747 17.366 1.00 0.00 N ATOM 0 H LYS A 33 49.351 52.508 16.291 1.00 0.00 H new ATOM 0 HA LYS A 33 50.179 55.290 16.035 1.00 0.00 H new ATOM 0 HB2 LYS A 33 49.101 53.591 18.328 1.00 0.00 H new ATOM 0 HB3 LYS A 33 49.626 55.252 18.522 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.900 55.947 16.817 1.00 0.00 H new ATOM 0 HG3 LYS A 33 47.336 54.288 16.761 1.00 0.00 H new ATOM 0 HD2 LYS A 33 46.949 54.415 19.263 1.00 0.00 H new ATOM 0 HD3 LYS A 33 47.344 56.120 19.186 1.00 0.00 H new ATOM 0 HE2 LYS A 33 44.992 54.734 17.856 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.933 55.838 19.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 44.318 56.954 17.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 45.798 57.583 17.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 45.766 56.506 16.455 1.00 0.00 H new ATOM 541 N GLU A 34 51.967 52.950 17.492 1.00 0.00 N ATOM 542 CA GLU A 34 53.112 52.642 18.324 1.00 0.00 C ATOM 543 C GLU A 34 54.180 51.767 17.663 1.00 0.00 C ATOM 544 O GLU A 34 55.249 51.568 18.235 1.00 0.00 O ATOM 545 CB GLU A 34 52.625 51.965 19.601 1.00 0.00 C ATOM 546 CG GLU A 34 51.703 52.815 20.472 1.00 0.00 C ATOM 547 CD GLU A 34 52.443 54.012 21.072 1.00 0.00 C ATOM 548 OE1 GLU A 34 53.275 53.793 21.979 1.00 0.00 O ATOM 549 OE2 GLU A 34 52.235 55.163 20.631 1.00 0.00 O ATOM 0 H GLU A 34 51.463 52.116 17.190 1.00 0.00 H new ATOM 0 HA GLU A 34 53.601 53.595 18.525 1.00 0.00 H new ATOM 0 HB2 GLU A 34 52.101 51.048 19.331 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.492 51.674 20.193 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.861 53.168 19.876 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.291 52.202 21.274 1.00 0.00 H new ATOM 556 N GLY A 35 53.927 51.219 16.478 1.00 0.00 N ATOM 557 CA GLY A 35 54.927 50.557 15.663 1.00 0.00 C ATOM 558 C GLY A 35 55.191 49.072 15.916 1.00 0.00 C ATOM 559 O GLY A 35 55.707 48.413 15.017 1.00 0.00 O ATOM 0 H GLY A 35 53.000 51.226 16.053 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.636 50.671 14.619 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.869 51.090 15.791 1.00 0.00 H new ATOM 563 N ILE A 36 54.814 48.504 17.059 1.00 0.00 N ATOM 564 CA ILE A 36 55.098 47.122 17.386 1.00 0.00 C ATOM 565 C ILE A 36 54.268 46.181 16.510 1.00 0.00 C ATOM 566 O ILE A 36 53.045 46.298 16.541 1.00 0.00 O ATOM 567 CB ILE A 36 54.875 46.814 18.864 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.541 47.809 19.811 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.381 45.412 19.190 1.00 0.00 C ATOM 570 CD1 ILE A 36 54.573 48.876 20.315 1.00 0.00 C ATOM 0 H ILE A 36 54.299 49.000 17.786 1.00 0.00 H new ATOM 0 HA ILE A 36 56.156 46.958 17.182 1.00 0.00 H new ATOM 0 HB ILE A 36 53.799 46.891 19.022 1.00 0.00 H new ATOM 0 HG12 ILE A 36 55.959 47.271 20.662 1.00 0.00 H new ATOM 0 HG13 ILE A 36 56.373 48.291 19.299 1.00 0.00 H new ATOM 0 HG21 ILE A 36 55.217 45.203 20.247 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.842 44.681 18.587 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.446 45.349 18.969 1.00 0.00 H new ATOM 0 HD11 ILE A 36 55.099 49.557 20.984 1.00 0.00 H new ATOM 0 HD12 ILE A 36 54.175 49.435 19.468 1.00 0.00 H new ATOM 0 HD13 ILE A 36 53.754 48.399 20.853 1.00 0.00 H new ATOM 582 N PRO A 37 54.841 45.233 15.774 1.00 0.00 N ATOM 583 CA PRO A 37 54.073 44.312 14.962 1.00 0.00 C ATOM 584 C PRO A 37 53.161 43.396 15.781 1.00 0.00 C ATOM 585 O PRO A 37 53.571 42.974 16.859 1.00 0.00 O ATOM 586 CB PRO A 37 55.078 43.496 14.155 1.00 0.00 C ATOM 587 CG PRO A 37 56.325 44.375 14.143 1.00 0.00 C ATOM 588 CD PRO A 37 56.254 45.069 15.501 1.00 0.00 C ATOM 0 HA PRO A 37 53.399 44.877 14.318 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.273 42.529 14.618 1.00 0.00 H new ATOM 0 HB3 PRO A 37 54.716 43.299 13.146 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.236 43.786 14.036 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.309 45.090 13.321 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.737 44.471 16.274 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.764 46.032 15.478 1.00 0.00 H new ATOM 596 N PRO A 38 51.972 43.032 15.306 1.00 0.00 N ATOM 597 CA PRO A 38 51.040 42.166 16.000 1.00 0.00 C ATOM 598 C PRO A 38 51.611 40.864 16.567 1.00 0.00 C ATOM 599 O PRO A 38 51.242 40.475 17.672 1.00 0.00 O ATOM 600 CB PRO A 38 49.938 41.868 14.986 1.00 0.00 C ATOM 601 CG PRO A 38 49.865 43.166 14.187 1.00 0.00 C ATOM 602 CD PRO A 38 51.325 43.609 14.145 1.00 0.00 C ATOM 0 HA PRO A 38 50.699 42.686 16.895 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.188 41.016 14.354 1.00 0.00 H new ATOM 0 HB3 PRO A 38 48.990 41.637 15.473 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.461 43.005 13.188 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.230 43.907 14.673 1.00 0.00 H new ATOM 0 HD2 PRO A 38 51.805 43.271 13.227 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.400 44.696 14.162 1.00 0.00 H new ATOM 610 N ASP A 39 52.557 40.222 15.887 1.00 0.00 N ATOM 611 CA ASP A 39 53.185 39.007 16.363 1.00 0.00 C ATOM 612 C ASP A 39 54.078 39.225 17.587 1.00 0.00 C ATOM 613 O ASP A 39 54.324 38.285 18.338 1.00 0.00 O ATOM 614 CB ASP A 39 54.000 38.363 15.245 1.00 0.00 C ATOM 615 CG ASP A 39 53.135 37.822 14.105 1.00 0.00 C ATOM 616 OD1 ASP A 39 53.333 38.245 12.946 1.00 0.00 O ATOM 617 OD2 ASP A 39 52.259 36.968 14.366 1.00 0.00 O ATOM 0 H ASP A 39 52.908 40.538 14.983 1.00 0.00 H new ATOM 0 HA ASP A 39 52.376 38.345 16.673 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.700 39.097 14.845 1.00 0.00 H new ATOM 0 HB3 ASP A 39 54.594 37.549 15.660 1.00 0.00 H new ATOM 622 N GLN A 40 54.534 40.453 17.819 1.00 0.00 N ATOM 623 CA GLN A 40 55.432 40.829 18.892 1.00 0.00 C ATOM 624 C GLN A 40 54.735 41.577 20.031 1.00 0.00 C ATOM 625 O GLN A 40 55.383 41.974 20.997 1.00 0.00 O ATOM 626 CB GLN A 40 56.630 41.582 18.321 1.00 0.00 C ATOM 627 CG GLN A 40 57.345 40.839 17.195 1.00 0.00 C ATOM 628 CD GLN A 40 57.777 39.422 17.574 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.176 39.134 18.699 1.00 0.00 O ATOM 630 NE2 GLN A 40 57.699 38.460 16.658 1.00 0.00 N ATOM 0 H GLN A 40 54.271 41.246 17.233 1.00 0.00 H new ATOM 0 HA GLN A 40 55.799 39.916 19.360 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.295 42.550 17.949 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.341 41.777 19.124 1.00 0.00 H new ATOM 0 HG2 GLN A 40 56.686 40.789 16.328 1.00 0.00 H new ATOM 0 HG3 GLN A 40 58.224 41.410 16.895 1.00 0.00 H new ATOM 0 HE21 GLN A 40 57.370 38.677 15.717 1.00 0.00 H new ATOM 0 HE22 GLN A 40 57.968 37.505 16.897 1.00 0.00 H new ATOM 639 N GLN A 41 53.415 41.725 19.957 1.00 0.00 N ATOM 640 CA GLN A 41 52.579 42.221 21.032 1.00 0.00 C ATOM 641 C GLN A 41 51.951 41.064 21.812 1.00 0.00 C ATOM 642 O GLN A 41 51.481 40.107 21.199 1.00 0.00 O ATOM 643 CB GLN A 41 51.463 43.104 20.481 1.00 0.00 C ATOM 644 CG GLN A 41 51.905 44.359 19.733 1.00 0.00 C ATOM 645 CD GLN A 41 50.697 45.152 19.233 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.654 45.236 19.878 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.758 45.747 18.045 1.00 0.00 N ATOM 0 H GLN A 41 52.886 41.493 19.116 1.00 0.00 H new ATOM 0 HA GLN A 41 53.214 42.805 21.698 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.850 42.503 19.809 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.824 43.407 21.311 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.509 44.985 20.390 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.536 44.081 18.889 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.612 45.692 17.490 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.951 46.258 17.689 1.00 0.00 H new ATOM 656 N ARG A 42 51.845 41.189 23.131 1.00 0.00 N ATOM 657 CA ARG A 42 50.886 40.473 23.948 1.00 0.00 C ATOM 658 C ARG A 42 49.973 41.454 24.687 1.00 0.00 C ATOM 659 O ARG A 42 50.453 42.443 25.238 1.00 0.00 O ATOM 660 CB ARG A 42 51.564 39.502 24.910 1.00 0.00 C ATOM 661 CG ARG A 42 52.111 38.267 24.200 1.00 0.00 C ATOM 662 CD ARG A 42 52.440 37.127 25.159 1.00 0.00 C ATOM 663 NE ARG A 42 53.679 37.336 25.907 1.00 0.00 N ATOM 664 CZ ARG A 42 54.874 36.789 25.644 1.00 0.00 C ATOM 665 NH1 ARG A 42 55.156 36.118 24.519 1.00 0.00 N ATOM 666 NH2 ARG A 42 55.860 36.887 26.547 1.00 0.00 N ATOM 0 H ARG A 42 52.445 41.812 23.672 1.00 0.00 H new ATOM 0 HA ARG A 42 50.269 39.869 23.283 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.378 40.013 25.424 1.00 0.00 H new ATOM 0 HB3 ARG A 42 50.850 39.193 25.673 1.00 0.00 H new ATOM 0 HG2 ARG A 42 51.380 37.921 23.469 1.00 0.00 H new ATOM 0 HG3 ARG A 42 53.010 38.540 23.647 1.00 0.00 H new ATOM 0 HD2 ARG A 42 51.616 37.005 25.862 1.00 0.00 H new ATOM 0 HD3 ARG A 42 52.518 36.198 24.594 1.00 0.00 H new ATOM 0 HE ARG A 42 53.629 37.962 26.711 1.00 0.00 H new ATOM 0 HH11 ARG A 42 54.440 36.000 23.802 1.00 0.00 H new ATOM 0 HH12 ARG A 42 56.087 35.725 24.379 1.00 0.00 H new ATOM 0 HH21 ARG A 42 55.698 37.375 27.428 1.00 0.00 H new ATOM 0 HH22 ARG A 42 56.772 36.473 26.353 1.00 0.00 H new ATOM 680 N LEU A 43 48.668 41.194 24.672 1.00 0.00 N ATOM 681 CA LEU A 43 47.645 42.017 25.285 1.00 0.00 C ATOM 682 C LEU A 43 47.061 41.331 26.521 1.00 0.00 C ATOM 683 O LEU A 43 46.799 40.132 26.491 1.00 0.00 O ATOM 684 CB LEU A 43 46.553 42.354 24.274 1.00 0.00 C ATOM 685 CG LEU A 43 46.830 43.551 23.370 1.00 0.00 C ATOM 686 CD1 LEU A 43 48.061 43.387 22.483 1.00 0.00 C ATOM 687 CD2 LEU A 43 45.639 43.771 22.442 1.00 0.00 C ATOM 0 H LEU A 43 48.285 40.368 24.212 1.00 0.00 H new ATOM 0 HA LEU A 43 48.104 42.950 25.611 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.384 41.480 23.645 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.626 42.540 24.817 1.00 0.00 H new ATOM 0 HG LEU A 43 47.005 44.392 24.041 1.00 0.00 H new ATOM 0 HD11 LEU A 43 48.190 44.280 21.871 1.00 0.00 H new ATOM 0 HD12 LEU A 43 48.943 43.245 23.107 1.00 0.00 H new ATOM 0 HD13 LEU A 43 47.931 42.519 21.836 1.00 0.00 H new ATOM 0 HD21 LEU A 43 45.835 44.626 21.795 1.00 0.00 H new ATOM 0 HD22 LEU A 43 45.485 42.882 21.831 1.00 0.00 H new ATOM 0 HD23 LEU A 43 44.745 43.963 23.036 1.00 0.00 H new ATOM 699 N ILE A 44 46.840 42.097 27.587 1.00 0.00 N ATOM 700 CA ILE A 44 46.348 41.630 28.868 1.00 0.00 C ATOM 701 C ILE A 44 45.157 42.471 29.332 1.00 0.00 C ATOM 702 O ILE A 44 45.188 43.697 29.267 1.00 0.00 O ATOM 703 CB ILE A 44 47.465 41.588 29.907 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.650 40.749 29.437 1.00 0.00 C ATOM 705 CG2 ILE A 44 46.945 41.051 31.238 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.852 40.715 30.378 1.00 0.00 C ATOM 0 H ILE A 44 47.008 43.103 27.574 1.00 0.00 H new ATOM 0 HA ILE A 44 45.993 40.607 28.746 1.00 0.00 H new ATOM 0 HB ILE A 44 47.812 42.612 30.044 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.307 39.727 29.278 1.00 0.00 H new ATOM 0 HG13 ILE A 44 48.980 41.129 28.470 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.758 41.030 31.964 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.148 41.698 31.605 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.558 40.042 31.097 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.635 40.091 29.946 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.232 41.727 30.520 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.549 40.303 31.341 1.00 0.00 H new ATOM 718 N PHE A 45 44.123 41.811 29.847 1.00 0.00 N ATOM 719 CA PHE A 45 43.015 42.418 30.557 1.00 0.00 C ATOM 720 C PHE A 45 42.523 41.505 31.680 1.00 0.00 C ATOM 721 O PHE A 45 42.414 40.297 31.480 1.00 0.00 O ATOM 722 CB PHE A 45 41.880 42.710 29.578 1.00 0.00 C ATOM 723 CG PHE A 45 40.709 43.446 30.184 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.859 44.785 30.561 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.479 42.806 30.378 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.785 45.491 31.117 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.401 43.510 30.928 1.00 0.00 C ATOM 728 CZ PHE A 45 38.548 44.855 31.286 1.00 0.00 C ATOM 0 H PHE A 45 44.036 40.797 29.775 1.00 0.00 H new ATOM 0 HA PHE A 45 43.355 43.351 31.006 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.274 43.298 28.749 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.525 41.768 29.160 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.810 45.278 30.422 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.362 41.768 30.103 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.910 46.522 31.414 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.453 43.014 31.076 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.710 45.402 31.692 1.00 0.00 H new ATOM 738 N ALA A 46 42.227 42.055 32.855 1.00 0.00 N ATOM 739 CA ALA A 46 41.868 41.310 34.045 1.00 0.00 C ATOM 740 C ALA A 46 42.801 40.136 34.349 1.00 0.00 C ATOM 741 O ALA A 46 42.353 39.044 34.688 1.00 0.00 O ATOM 742 CB ALA A 46 40.390 40.934 33.979 1.00 0.00 C ATOM 0 H ALA A 46 42.232 43.064 33.003 1.00 0.00 H new ATOM 0 HA ALA A 46 42.012 41.958 34.909 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.117 40.373 34.873 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.786 41.840 33.920 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.210 40.320 33.097 1.00 0.00 H new ATOM 748 N GLY A 47 44.102 40.322 34.148 1.00 0.00 N ATOM 749 CA GLY A 47 45.133 39.312 34.275 1.00 0.00 C ATOM 750 C GLY A 47 45.212 38.277 33.152 1.00 0.00 C ATOM 751 O GLY A 47 46.213 37.570 33.052 1.00 0.00 O ATOM 0 H GLY A 47 44.479 41.231 33.878 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.097 39.815 34.345 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.980 38.784 35.216 1.00 0.00 H new ATOM 755 N LYS A 48 44.202 38.172 32.291 1.00 0.00 N ATOM 756 CA LYS A 48 44.092 37.184 31.239 1.00 0.00 C ATOM 757 C LYS A 48 44.830 37.627 29.974 1.00 0.00 C ATOM 758 O LYS A 48 44.690 38.770 29.544 1.00 0.00 O ATOM 759 CB LYS A 48 42.624 36.912 30.922 1.00 0.00 C ATOM 760 CG LYS A 48 41.849 36.336 32.103 1.00 0.00 C ATOM 761 CD LYS A 48 40.372 36.097 31.805 1.00 0.00 C ATOM 762 CE LYS A 48 40.182 35.064 30.697 1.00 0.00 C ATOM 763 NZ LYS A 48 38.765 34.779 30.420 1.00 0.00 N ATOM 0 H LYS A 48 43.404 38.807 32.316 1.00 0.00 H new ATOM 0 HA LYS A 48 44.559 36.266 31.595 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.150 37.840 30.603 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.563 36.219 30.083 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.308 35.394 32.403 1.00 0.00 H new ATOM 0 HG3 LYS A 48 41.935 37.017 32.950 1.00 0.00 H new ATOM 0 HD2 LYS A 48 39.868 35.758 32.710 1.00 0.00 H new ATOM 0 HD3 LYS A 48 39.903 37.036 31.512 1.00 0.00 H new ATOM 0 HE2 LYS A 48 40.661 35.423 29.786 1.00 0.00 H new ATOM 0 HE3 LYS A 48 40.686 34.139 30.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 38.695 34.072 29.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 38.311 34.410 31.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 38.286 35.654 30.124 1.00 0.00 H new ATOM 777 N GLN A 49 45.557 36.709 29.342 1.00 0.00 N ATOM 778 CA GLN A 49 46.140 36.929 28.034 1.00 0.00 C ATOM 779 C GLN A 49 45.052 36.894 26.959 1.00 0.00 C ATOM 780 O GLN A 49 44.301 35.925 26.877 1.00 0.00 O ATOM 781 CB GLN A 49 47.238 35.903 27.774 1.00 0.00 C ATOM 782 CG GLN A 49 48.036 36.194 26.506 1.00 0.00 C ATOM 783 CD GLN A 49 49.087 35.113 26.247 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.040 34.939 27.003 1.00 0.00 O ATOM 785 NE2 GLN A 49 48.945 34.318 25.191 1.00 0.00 N ATOM 0 H GLN A 49 45.756 35.787 29.731 1.00 0.00 H new ATOM 0 HA GLN A 49 46.599 37.917 27.999 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.916 35.881 28.627 1.00 0.00 H new ATOM 0 HB3 GLN A 49 46.791 34.912 27.696 1.00 0.00 H new ATOM 0 HG2 GLN A 49 47.359 36.256 25.654 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.524 37.164 26.596 1.00 0.00 H new ATOM 0 HE21 GLN A 49 48.159 34.451 24.555 1.00 0.00 H new ATOM 0 HE22 GLN A 49 49.622 33.575 25.017 1.00 0.00 H new ATOM 794 N LEU A 50 44.971 37.930 26.128 1.00 0.00 N ATOM 795 CA LEU A 50 43.990 38.043 25.068 1.00 0.00 C ATOM 796 C LEU A 50 44.538 37.435 23.775 1.00 0.00 C ATOM 797 O LEU A 50 45.589 37.853 23.295 1.00 0.00 O ATOM 798 CB LEU A 50 43.557 39.496 24.891 1.00 0.00 C ATOM 799 CG LEU A 50 43.063 40.212 26.146 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.526 41.590 25.769 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.951 39.455 26.865 1.00 0.00 C ATOM 0 H LEU A 50 45.603 38.729 26.179 1.00 0.00 H new ATOM 0 HA LEU A 50 43.099 37.478 25.340 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.399 40.057 24.486 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.764 39.528 24.144 1.00 0.00 H new ATOM 0 HG LEU A 50 43.917 40.282 26.820 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.173 42.101 26.665 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.320 42.176 25.306 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.700 41.479 25.066 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.642 40.014 27.748 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.099 39.336 26.195 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.315 38.473 27.166 1.00 0.00 H new ATOM 813 N GLU A 51 43.854 36.435 23.224 1.00 0.00 N ATOM 814 CA GLU A 51 44.351 35.604 22.147 1.00 0.00 C ATOM 815 C GLU A 51 43.834 35.982 20.758 1.00 0.00 C ATOM 816 O GLU A 51 42.690 36.393 20.571 1.00 0.00 O ATOM 817 CB GLU A 51 44.080 34.135 22.454 1.00 0.00 C ATOM 818 CG GLU A 51 44.995 33.568 23.535 1.00 0.00 C ATOM 819 CD GLU A 51 46.399 33.287 22.996 1.00 0.00 C ATOM 820 OE1 GLU A 51 47.224 34.220 22.896 1.00 0.00 O ATOM 821 OE2 GLU A 51 46.674 32.125 22.627 1.00 0.00 O ATOM 0 H GLU A 51 42.914 36.179 23.527 1.00 0.00 H new ATOM 0 HA GLU A 51 45.425 35.782 22.101 1.00 0.00 H new ATOM 0 HB2 GLU A 51 43.043 34.022 22.769 1.00 0.00 H new ATOM 0 HB3 GLU A 51 44.201 33.551 21.541 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.058 34.272 24.365 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.565 32.647 23.930 1.00 0.00 H new ATOM 828 N ASP A 52 44.688 35.795 19.756 1.00 0.00 N ATOM 829 CA ASP A 52 44.536 36.316 18.413 1.00 0.00 C ATOM 830 C ASP A 52 43.355 35.731 17.634 1.00 0.00 C ATOM 831 O ASP A 52 42.800 36.400 16.765 1.00 0.00 O ATOM 832 CB ASP A 52 45.851 36.108 17.668 1.00 0.00 C ATOM 833 CG ASP A 52 47.030 36.830 18.323 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.369 37.954 17.893 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.651 36.281 19.259 1.00 0.00 O ATOM 0 H ASP A 52 45.543 35.250 19.870 1.00 0.00 H new ATOM 0 HA ASP A 52 44.300 37.377 18.498 1.00 0.00 H new ATOM 0 HB2 ASP A 52 46.068 35.041 17.617 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.741 36.460 16.642 1.00 0.00 H new ATOM 840 N GLY A 53 42.909 34.521 17.958 1.00 0.00 N ATOM 841 CA GLY A 53 41.738 33.896 17.376 1.00 0.00 C ATOM 842 C GLY A 53 40.384 34.371 17.910 1.00 0.00 C ATOM 843 O GLY A 53 39.368 33.830 17.481 1.00 0.00 O ATOM 0 H GLY A 53 43.370 33.935 18.654 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.760 34.063 16.299 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.810 32.820 17.533 1.00 0.00 H new ATOM 847 N ARG A 54 40.335 35.319 18.841 1.00 0.00 N ATOM 848 CA ARG A 54 39.148 35.702 19.579 1.00 0.00 C ATOM 849 C ARG A 54 38.713 37.146 19.319 1.00 0.00 C ATOM 850 O ARG A 54 39.493 37.966 18.839 1.00 0.00 O ATOM 851 CB ARG A 54 39.366 35.457 21.069 1.00 0.00 C ATOM 852 CG ARG A 54 39.778 34.043 21.467 1.00 0.00 C ATOM 853 CD ARG A 54 38.733 32.978 21.143 1.00 0.00 C ATOM 854 NE ARG A 54 39.288 31.640 21.354 1.00 0.00 N ATOM 855 CZ ARG A 54 39.364 30.651 20.453 1.00 0.00 C ATOM 856 NH1 ARG A 54 38.720 30.653 19.278 1.00 0.00 N ATOM 857 NH2 ARG A 54 40.147 29.590 20.693 1.00 0.00 N ATOM 0 H ARG A 54 41.157 35.860 19.109 1.00 0.00 H new ATOM 0 HA ARG A 54 38.331 35.076 19.220 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.131 36.149 21.421 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.445 35.706 21.595 1.00 0.00 H new ATOM 0 HG2 ARG A 54 40.709 33.790 20.960 1.00 0.00 H new ATOM 0 HG3 ARG A 54 39.983 34.023 22.537 1.00 0.00 H new ATOM 0 HD2 ARG A 54 37.854 33.118 21.773 1.00 0.00 H new ATOM 0 HD3 ARG A 54 38.405 33.084 20.109 1.00 0.00 H new ATOM 0 HE ARG A 54 39.655 31.439 22.284 1.00 0.00 H new ATOM 0 HH11 ARG A 54 38.126 31.442 19.023 1.00 0.00 H new ATOM 0 HH12 ARG A 54 38.823 29.865 18.638 1.00 0.00 H new ATOM 0 HH21 ARG A 54 40.683 29.537 21.559 1.00 0.00 H new ATOM 0 HH22 ARG A 54 40.207 28.835 20.009 1.00 0.00 H new ATOM 871 N THR A 55 37.475 37.457 19.689 1.00 0.00 N ATOM 872 CA THR A 55 36.902 38.788 19.691 1.00 0.00 C ATOM 873 C THR A 55 36.854 39.402 21.091 1.00 0.00 C ATOM 874 O THR A 55 36.897 38.689 22.092 1.00 0.00 O ATOM 875 CB THR A 55 35.511 38.832 19.064 1.00 0.00 C ATOM 876 OG1 THR A 55 34.583 38.137 19.866 1.00 0.00 O ATOM 877 CG2 THR A 55 35.458 38.253 17.654 1.00 0.00 C ATOM 0 H THR A 55 36.816 36.748 20.011 1.00 0.00 H new ATOM 0 HA THR A 55 37.573 39.386 19.074 1.00 0.00 H new ATOM 0 HB THR A 55 35.255 39.890 18.999 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.905 37.225 20.022 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.439 38.318 17.272 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.126 38.818 17.003 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.771 37.209 17.677 1.00 0.00 H new ATOM 885 N LEU A 56 36.699 40.720 21.183 1.00 0.00 N ATOM 886 CA LEU A 56 36.491 41.399 22.445 1.00 0.00 C ATOM 887 C LEU A 56 35.232 40.925 23.172 1.00 0.00 C ATOM 888 O LEU A 56 35.219 40.874 24.401 1.00 0.00 O ATOM 889 CB LEU A 56 36.471 42.906 22.202 1.00 0.00 C ATOM 890 CG LEU A 56 37.809 43.500 21.769 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.608 44.954 21.351 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.845 43.476 22.889 1.00 0.00 C ATOM 0 H LEU A 56 36.715 41.344 20.376 1.00 0.00 H new ATOM 0 HA LEU A 56 37.319 41.150 23.109 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.726 43.127 21.437 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.147 43.403 23.116 1.00 0.00 H new ATOM 0 HG LEU A 56 38.175 42.891 20.942 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.563 45.379 21.042 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.904 45.000 20.520 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.213 45.523 22.193 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.779 43.909 22.530 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.478 44.055 23.736 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.019 42.446 23.201 1.00 0.00 H new ATOM 904 N SER A 57 34.209 40.498 22.436 1.00 0.00 N ATOM 905 CA SER A 57 33.011 39.884 22.969 1.00 0.00 C ATOM 906 C SER A 57 33.265 38.529 23.633 1.00 0.00 C ATOM 907 O SER A 57 32.607 38.236 24.629 1.00 0.00 O ATOM 908 CB SER A 57 31.949 39.717 21.884 1.00 0.00 C ATOM 909 OG SER A 57 31.503 40.986 21.460 1.00 0.00 O ATOM 0 H SER A 57 34.198 40.576 21.419 1.00 0.00 H new ATOM 0 HA SER A 57 32.654 40.567 23.740 1.00 0.00 H new ATOM 0 HB2 SER A 57 32.361 39.164 21.040 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.111 39.135 22.268 1.00 0.00 H new ATOM 0 HG SER A 57 32.240 41.463 21.025 1.00 0.00 H new ATOM 915 N ASP A 58 34.240 37.736 23.197 1.00 0.00 N ATOM 916 CA ASP A 58 34.591 36.495 23.854 1.00 0.00 C ATOM 917 C ASP A 58 35.147 36.702 25.265 1.00 0.00 C ATOM 918 O ASP A 58 35.166 35.756 26.048 1.00 0.00 O ATOM 919 CB ASP A 58 35.584 35.690 23.020 1.00 0.00 C ATOM 920 CG ASP A 58 35.012 35.227 21.679 1.00 0.00 C ATOM 921 OD1 ASP A 58 35.417 35.772 20.631 1.00 0.00 O ATOM 922 OD2 ASP A 58 34.150 34.321 21.673 1.00 0.00 O ATOM 0 H ASP A 58 34.807 37.943 22.375 1.00 0.00 H new ATOM 0 HA ASP A 58 33.661 35.934 23.949 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.471 36.297 22.839 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.905 34.819 23.591 1.00 0.00 H new ATOM 927 N TYR A 59 35.579 37.914 25.600 1.00 0.00 N ATOM 928 CA TYR A 59 36.004 38.356 26.913 1.00 0.00 C ATOM 929 C TYR A 59 35.045 39.362 27.553 1.00 0.00 C ATOM 930 O TYR A 59 35.339 39.891 28.623 1.00 0.00 O ATOM 931 CB TYR A 59 37.420 38.917 26.815 1.00 0.00 C ATOM 932 CG TYR A 59 38.481 37.962 26.321 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.199 37.176 27.231 1.00 0.00 C ATOM 934 CD2 TYR A 59 38.799 37.902 24.959 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.229 36.337 26.794 1.00 0.00 C ATOM 936 CE2 TYR A 59 39.831 37.070 24.510 1.00 0.00 C ATOM 937 CZ TYR A 59 40.555 36.278 25.424 1.00 0.00 C ATOM 938 OH TYR A 59 41.555 35.467 24.975 1.00 0.00 O ATOM 0 H TYR A 59 35.644 38.661 24.909 1.00 0.00 H new ATOM 0 HA TYR A 59 35.995 37.491 27.576 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.401 39.782 26.152 1.00 0.00 H new ATOM 0 HB3 TYR A 59 37.715 39.278 27.800 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.954 37.218 28.282 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.245 38.501 24.251 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.774 35.735 27.506 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.074 37.035 23.458 1.00 0.00 H new ATOM 0 HH TYR A 59 41.228 34.929 24.224 1.00 0.00 H new ATOM 948 N ASN A 60 33.907 39.649 26.927 1.00 0.00 N ATOM 949 CA ASN A 60 32.887 40.577 27.374 1.00 0.00 C ATOM 950 C ASN A 60 33.406 41.967 27.746 1.00 0.00 C ATOM 951 O ASN A 60 33.027 42.540 28.765 1.00 0.00 O ATOM 952 CB ASN A 60 32.005 39.873 28.401 1.00 0.00 C ATOM 953 CG ASN A 60 30.740 40.645 28.782 1.00 0.00 C ATOM 954 OD1 ASN A 60 30.473 40.911 29.951 1.00 0.00 O ATOM 955 ND2 ASN A 60 29.889 41.016 27.829 1.00 0.00 N ATOM 0 H ASN A 60 33.663 39.209 26.040 1.00 0.00 H new ATOM 0 HA ASN A 60 32.245 40.843 26.534 1.00 0.00 H new ATOM 0 HB2 ASN A 60 31.717 38.898 28.007 1.00 0.00 H new ATOM 0 HB3 ASN A 60 32.591 39.692 29.302 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.032 41.512 28.075 1.00 0.00 H new ATOM 0 HD22 ASN A 60 30.093 40.804 26.852 1.00 0.00 H new ATOM 962 N ILE A 61 34.291 42.527 26.927 1.00 0.00 N ATOM 963 CA ILE A 61 34.901 43.829 27.113 1.00 0.00 C ATOM 964 C ILE A 61 33.981 44.951 26.623 1.00 0.00 C ATOM 965 O ILE A 61 33.275 44.785 25.631 1.00 0.00 O ATOM 966 CB ILE A 61 36.289 43.835 26.481 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.219 42.889 27.234 1.00 0.00 C ATOM 968 CG2 ILE A 61 36.903 45.231 26.431 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.539 42.577 26.533 1.00 0.00 C ATOM 0 H ILE A 61 34.613 42.060 26.079 1.00 0.00 H new ATOM 0 HA ILE A 61 35.038 44.028 28.176 1.00 0.00 H new ATOM 0 HB ILE A 61 36.169 43.493 25.453 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.438 43.322 28.210 1.00 0.00 H new ATOM 0 HG13 ILE A 61 36.691 41.952 27.412 1.00 0.00 H new ATOM 0 HG21 ILE A 61 37.890 45.178 25.972 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.264 45.889 25.842 1.00 0.00 H new ATOM 0 HG23 ILE A 61 36.994 45.625 27.443 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.127 41.897 27.150 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.337 42.110 25.569 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.096 43.501 26.379 1.00 0.00 H new ATOM 981 N GLN A 62 33.977 46.092 27.305 1.00 0.00 N ATOM 982 CA GLN A 62 33.151 47.248 27.018 1.00 0.00 C ATOM 983 C GLN A 62 33.909 48.577 27.028 1.00 0.00 C ATOM 984 O GLN A 62 35.071 48.655 27.417 1.00 0.00 O ATOM 985 CB GLN A 62 31.968 47.280 27.980 1.00 0.00 C ATOM 986 CG GLN A 62 30.898 46.236 27.669 1.00 0.00 C ATOM 987 CD GLN A 62 29.603 46.484 28.444 1.00 0.00 C ATOM 988 OE1 GLN A 62 28.878 47.447 28.204 1.00 0.00 O ATOM 989 NE2 GLN A 62 29.260 45.651 29.422 1.00 0.00 N ATOM 0 H GLN A 62 34.582 46.237 28.113 1.00 0.00 H new ATOM 0 HA GLN A 62 32.796 47.135 25.994 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.332 47.123 28.995 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.515 48.271 27.953 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.686 46.243 26.600 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.280 45.244 27.911 1.00 0.00 H new ATOM 0 HE21 GLN A 62 29.849 44.846 29.636 1.00 0.00 H new ATOM 0 HE22 GLN A 62 28.408 45.817 29.958 1.00 0.00 H new ATOM 998 N LYS A 63 33.232 49.633 26.586 1.00 0.00 N ATOM 999 CA LYS A 63 33.661 51.016 26.513 1.00 0.00 C ATOM 1000 C LYS A 63 34.477 51.484 27.719 1.00 0.00 C ATOM 1001 O LYS A 63 34.051 51.355 28.865 1.00 0.00 O ATOM 1002 CB LYS A 63 32.416 51.882 26.350 1.00 0.00 C ATOM 1003 CG LYS A 63 32.655 53.388 26.304 1.00 0.00 C ATOM 1004 CD LYS A 63 31.334 54.110 26.051 1.00 0.00 C ATOM 1005 CE LYS A 63 31.454 55.625 25.910 1.00 0.00 C ATOM 1006 NZ LYS A 63 31.657 56.309 27.196 1.00 0.00 N ATOM 0 H LYS A 63 32.279 49.526 26.238 1.00 0.00 H new ATOM 0 HA LYS A 63 34.334 51.109 25.661 1.00 0.00 H new ATOM 0 HB2 LYS A 63 31.908 51.586 25.432 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.736 51.666 27.174 1.00 0.00 H new ATOM 0 HG2 LYS A 63 33.091 53.726 27.244 1.00 0.00 H new ATOM 0 HG3 LYS A 63 33.369 53.629 25.517 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.884 53.708 25.143 1.00 0.00 H new ATOM 0 HD3 LYS A 63 30.651 53.888 26.871 1.00 0.00 H new ATOM 0 HE2 LYS A 63 32.287 55.857 25.246 1.00 0.00 H new ATOM 0 HE3 LYS A 63 30.552 56.013 25.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 31.512 57.331 27.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 30.977 55.945 27.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 32.626 56.135 27.533 1.00 0.00 H new ATOM 1020 N GLU A 64 35.630 52.083 27.433 1.00 0.00 N ATOM 1021 CA GLU A 64 36.501 52.777 28.360 1.00 0.00 C ATOM 1022 C GLU A 64 37.046 51.932 29.514 1.00 0.00 C ATOM 1023 O GLU A 64 37.593 52.456 30.482 1.00 0.00 O ATOM 1024 CB GLU A 64 35.888 54.118 28.753 1.00 0.00 C ATOM 1025 CG GLU A 64 35.819 55.064 27.558 1.00 0.00 C ATOM 1026 CD GLU A 64 35.193 56.415 27.908 1.00 0.00 C ATOM 1027 OE1 GLU A 64 34.077 56.454 28.470 1.00 0.00 O ATOM 1028 OE2 GLU A 64 35.779 57.469 27.578 1.00 0.00 O ATOM 0 H GLU A 64 36.000 52.094 26.482 1.00 0.00 H new ATOM 0 HA GLU A 64 37.427 52.995 27.828 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.887 53.960 29.153 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.480 54.573 29.547 1.00 0.00 H new ATOM 0 HG2 GLU A 64 36.824 55.224 27.169 1.00 0.00 H new ATOM 0 HG3 GLU A 64 35.240 54.595 26.762 1.00 0.00 H new ATOM 1035 N SER A 65 36.996 50.609 29.384 1.00 0.00 N ATOM 1036 CA SER A 65 37.922 49.711 30.043 1.00 0.00 C ATOM 1037 C SER A 65 39.317 49.837 29.430 1.00 0.00 C ATOM 1038 O SER A 65 39.441 50.078 28.231 1.00 0.00 O ATOM 1039 CB SER A 65 37.441 48.264 29.973 1.00 0.00 C ATOM 1040 OG SER A 65 36.174 48.120 30.573 1.00 0.00 O ATOM 0 H SER A 65 36.301 50.131 28.810 1.00 0.00 H new ATOM 0 HA SER A 65 37.971 49.997 31.094 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.392 47.944 28.932 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.159 47.614 30.473 1.00 0.00 H new ATOM 0 HG SER A 65 35.888 47.185 30.513 1.00 0.00 H new ATOM 1046 N THR A 66 40.361 49.663 30.237 1.00 0.00 N ATOM 1047 CA THR A 66 41.752 49.847 29.875 1.00 0.00 C ATOM 1048 C THR A 66 42.484 48.510 29.761 1.00 0.00 C ATOM 1049 O THR A 66 42.466 47.710 30.694 1.00 0.00 O ATOM 1050 CB THR A 66 42.458 50.745 30.888 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.916 52.047 30.863 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.948 50.916 30.608 1.00 0.00 C ATOM 0 H THR A 66 40.247 49.375 31.209 1.00 0.00 H new ATOM 0 HA THR A 66 41.774 50.329 28.898 1.00 0.00 H new ATOM 0 HB THR A 66 42.314 50.249 31.848 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.380 52.607 31.520 1.00 0.00 H new ATOM 0 HG21 THR A 66 44.388 51.565 31.365 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.437 49.942 30.636 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.084 51.363 29.623 1.00 0.00 H new ATOM 1060 N LEU A 67 43.191 48.295 28.655 1.00 0.00 N ATOM 1061 CA LEU A 67 44.024 47.141 28.384 1.00 0.00 C ATOM 1062 C LEU A 67 45.500 47.453 28.637 1.00 0.00 C ATOM 1063 O LEU A 67 45.938 48.593 28.499 1.00 0.00 O ATOM 1064 CB LEU A 67 43.802 46.680 26.947 1.00 0.00 C ATOM 1065 CG LEU A 67 42.543 45.860 26.675 1.00 0.00 C ATOM 1066 CD1 LEU A 67 41.225 46.578 26.949 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.534 45.434 25.210 1.00 0.00 C ATOM 0 H LEU A 67 43.194 48.963 27.884 1.00 0.00 H new ATOM 0 HA LEU A 67 43.742 46.336 29.063 1.00 0.00 H new ATOM 0 HB2 LEU A 67 43.778 47.562 26.307 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.665 46.088 26.643 1.00 0.00 H new ATOM 0 HG LEU A 67 42.595 45.021 27.369 1.00 0.00 H new ATOM 0 HD11 LEU A 67 40.393 45.910 26.725 1.00 0.00 H new ATOM 0 HD12 LEU A 67 41.182 46.872 27.998 1.00 0.00 H new ATOM 0 HD13 LEU A 67 41.157 47.466 26.321 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.638 44.848 25.007 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.540 46.319 24.574 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.417 44.831 25.001 1.00 0.00 H new ATOM 1079 N HIS A 68 46.289 46.426 28.940 1.00 0.00 N ATOM 1080 CA HIS A 68 47.731 46.496 29.060 1.00 0.00 C ATOM 1081 C HIS A 68 48.427 45.743 27.925 1.00 0.00 C ATOM 1082 O HIS A 68 47.889 44.794 27.359 1.00 0.00 O ATOM 1083 CB HIS A 68 48.167 46.014 30.441 1.00 0.00 C ATOM 1084 CG HIS A 68 48.039 47.084 31.490 1.00 0.00 C ATOM 1085 ND1 HIS A 68 46.880 47.413 32.189 1.00 0.00 N ATOM 1086 CD2 HIS A 68 49.049 47.916 31.902 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.204 48.433 32.988 1.00 0.00 C ATOM 1088 NE2 HIS A 68 48.497 48.764 32.843 1.00 0.00 N ATOM 0 H HIS A 68 45.922 45.490 29.114 1.00 0.00 H new ATOM 0 HA HIS A 68 48.040 47.537 28.963 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.564 45.153 30.729 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.202 45.677 30.395 1.00 0.00 H new ATOM 0 HD2 HIS A 68 50.073 47.909 31.559 1.00 0.00 H new ATOM 0 HE1 HIS A 68 46.518 48.926 33.661 1.00 0.00 H new ATOM 0 HE2 HIS A 68 48.985 49.509 33.339 1.00 0.00 H new ATOM 1096 N LEU A 69 49.638 46.186 27.601 1.00 0.00 N ATOM 1097 CA LEU A 69 50.431 45.768 26.463 1.00 0.00 C ATOM 1098 C LEU A 69 51.851 45.396 26.895 1.00 0.00 C ATOM 1099 O LEU A 69 52.481 46.144 27.639 1.00 0.00 O ATOM 1100 CB LEU A 69 50.434 46.921 25.463 1.00 0.00 C ATOM 1101 CG LEU A 69 51.347 46.779 24.249 1.00 0.00 C ATOM 1102 CD1 LEU A 69 50.916 45.639 23.329 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.336 48.077 23.449 1.00 0.00 C ATOM 0 H LEU A 69 50.116 46.889 28.164 1.00 0.00 H new ATOM 0 HA LEU A 69 50.005 44.876 26.003 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.414 47.063 25.106 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.715 47.830 25.994 1.00 0.00 H new ATOM 0 HG LEU A 69 52.347 46.556 24.622 1.00 0.00 H new ATOM 0 HD11 LEU A 69 51.597 45.579 22.480 1.00 0.00 H new ATOM 0 HD12 LEU A 69 50.939 44.699 23.880 1.00 0.00 H new ATOM 0 HD13 LEU A 69 49.904 45.824 22.970 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.988 47.975 22.582 1.00 0.00 H new ATOM 0 HD22 LEU A 69 50.320 48.291 23.116 1.00 0.00 H new ATOM 0 HD23 LEU A 69 51.691 48.894 24.077 1.00 0.00 H new ATOM 1115 N VAL A 70 52.364 44.278 26.389 1.00 0.00 N ATOM 1116 CA VAL A 70 53.691 43.755 26.644 1.00 0.00 C ATOM 1117 C VAL A 70 54.408 43.460 25.325 1.00 0.00 C ATOM 1118 O VAL A 70 53.812 42.910 24.402 1.00 0.00 O ATOM 1119 CB VAL A 70 53.621 42.510 27.525 1.00 0.00 C ATOM 1120 CG1 VAL A 70 55.004 41.958 27.860 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.922 42.783 28.854 1.00 0.00 C ATOM 0 H VAL A 70 51.830 43.684 25.755 1.00 0.00 H new ATOM 0 HA VAL A 70 54.266 44.509 27.181 1.00 0.00 H new ATOM 0 HB VAL A 70 53.056 41.786 26.938 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.900 41.073 28.488 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.522 41.690 26.939 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.579 42.716 28.392 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.896 41.868 29.446 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.466 43.554 29.400 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.903 43.122 28.666 1.00 0.00 H new