USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=16 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 -78:sc= 1.24 USER MOD Set 1.2: A 57 SER OG : rot -82:sc= 0.855 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 175:sc= 1.22 (180deg=1.2) USER MOD Single : A 2 GLN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 171:sc= 1.29 (180deg=1.18) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0635 USER MOD Single : A 25 ASN : amide:sc=-0.000609 K(o=-0.00061,f=-0.79) USER MOD Single : A 27 LYS NZ :NH3+ -150:sc= 0.539 (180deg=-0.309!) USER MOD Single : A 29 LYS NZ :NH3+ 157:sc= 2.02 (180deg=1.3) USER MOD Single : A 31 GLN : amide:sc= -0.866 X(o=-0.87,f=-1.3) USER MOD Single : A 33 LYS NZ :NH3+ 170:sc= 1.26 (180deg=1.1) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 GLN : amide:sc= 1.11 K(o=1.1,f=-2.3!) USER MOD Single : A 48 LYS NZ :NH3+ 146:sc= 1.06 (180deg=0.399) USER MOD Single : A 49 GLN : amide:sc=-0.000694 X(o=-0.00069,f=-0.24) USER MOD Single : A 59 TYR OH : rot 24:sc= 1.3 USER MOD Single : A 60 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 62 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 63 LYS NZ :NH3+ -168:sc= 0.889 (180deg=0.819) USER MOD Single : A 65 SER OG : rot 88:sc= 1.25 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.0111 X(o=-0.011,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.737 51.986 20.054 1.00 0.00 N ATOM 2 CA MET A 1 33.046 52.346 21.445 1.00 0.00 C ATOM 3 C MET A 1 34.538 52.647 21.601 1.00 0.00 C ATOM 4 O MET A 1 35.338 52.136 20.821 1.00 0.00 O ATOM 5 CB MET A 1 32.587 51.281 22.438 1.00 0.00 C ATOM 6 CG MET A 1 33.233 49.913 22.237 1.00 0.00 C ATOM 7 SD MET A 1 32.812 48.688 23.501 1.00 0.00 S ATOM 8 CE MET A 1 33.784 47.282 22.903 1.00 0.00 C ATOM 0 H1 MET A 1 31.739 51.703 19.982 1.00 0.00 H new ATOM 0 H2 MET A 1 32.910 52.805 19.437 1.00 0.00 H new ATOM 0 H3 MET A 1 33.343 51.195 19.757 1.00 0.00 H new ATOM 0 HA MET A 1 32.484 53.250 21.680 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.803 51.627 23.449 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.505 51.173 22.363 1.00 0.00 H new ATOM 0 HG2 MET A 1 32.937 49.526 21.262 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.316 50.037 22.216 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.642 46.431 23.570 1.00 0.00 H new ATOM 0 HE2 MET A 1 33.457 47.014 21.898 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.840 47.553 22.881 1.00 0.00 H new ATOM 20 N GLN A 2 34.933 53.436 22.597 1.00 0.00 N ATOM 21 CA GLN A 2 36.327 53.736 22.852 1.00 0.00 C ATOM 22 C GLN A 2 36.933 52.804 23.905 1.00 0.00 C ATOM 23 O GLN A 2 36.266 52.425 24.865 1.00 0.00 O ATOM 24 CB GLN A 2 36.478 55.211 23.209 1.00 0.00 C ATOM 25 CG GLN A 2 37.935 55.662 23.265 1.00 0.00 C ATOM 26 CD GLN A 2 38.048 57.185 23.353 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.981 57.790 24.421 1.00 0.00 O ATOM 28 NE2 GLN A 2 38.160 57.881 22.225 1.00 0.00 N ATOM 0 H GLN A 2 34.288 53.884 23.248 1.00 0.00 H new ATOM 0 HA GLN A 2 36.898 53.551 21.942 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.944 55.814 22.474 1.00 0.00 H new ATOM 0 HB3 GLN A 2 36.008 55.396 24.175 1.00 0.00 H new ATOM 0 HG2 GLN A 2 38.424 55.209 24.128 1.00 0.00 H new ATOM 0 HG3 GLN A 2 38.461 55.308 22.378 1.00 0.00 H new ATOM 0 HE21 GLN A 2 38.217 57.396 21.330 1.00 0.00 H new ATOM 0 HE22 GLN A 2 38.189 58.900 22.255 1.00 0.00 H new ATOM 37 N ILE A 3 38.211 52.472 23.748 1.00 0.00 N ATOM 38 CA ILE A 3 39.053 51.864 24.758 1.00 0.00 C ATOM 39 C ILE A 3 40.372 52.629 24.897 1.00 0.00 C ATOM 40 O ILE A 3 40.777 53.344 23.984 1.00 0.00 O ATOM 41 CB ILE A 3 39.309 50.385 24.486 1.00 0.00 C ATOM 42 CG1 ILE A 3 40.013 50.151 23.153 1.00 0.00 C ATOM 43 CG2 ILE A 3 38.018 49.582 24.622 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.566 48.740 22.976 1.00 0.00 C ATOM 0 H ILE A 3 38.705 52.629 22.870 1.00 0.00 H new ATOM 0 HA ILE A 3 38.513 51.925 25.703 1.00 0.00 H new ATOM 0 HB ILE A 3 40.001 50.021 25.246 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.313 50.359 22.344 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.831 50.864 23.057 1.00 0.00 H new ATOM 0 HG21 ILE A 3 38.222 48.530 24.424 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.626 49.692 25.633 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.283 49.950 23.906 1.00 0.00 H new ATOM 0 HD11 ILE A 3 41.050 48.658 22.003 1.00 0.00 H new ATOM 0 HD12 ILE A 3 41.293 48.533 23.761 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.751 48.019 23.037 1.00 0.00 H new ATOM 56 N PHE A 4 41.066 52.423 26.012 1.00 0.00 N ATOM 57 CA PHE A 4 42.427 52.868 26.234 1.00 0.00 C ATOM 58 C PHE A 4 43.392 51.686 26.125 1.00 0.00 C ATOM 59 O PHE A 4 43.069 50.575 26.538 1.00 0.00 O ATOM 60 CB PHE A 4 42.551 53.547 27.595 1.00 0.00 C ATOM 61 CG PHE A 4 41.680 54.759 27.818 1.00 0.00 C ATOM 62 CD1 PHE A 4 42.199 56.045 27.630 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.356 54.603 28.247 1.00 0.00 C ATOM 64 CE1 PHE A 4 41.390 57.170 27.834 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.542 55.725 28.444 1.00 0.00 C ATOM 66 CZ PHE A 4 40.058 57.010 28.235 1.00 0.00 C ATOM 0 H PHE A 4 40.677 51.923 26.811 1.00 0.00 H new ATOM 0 HA PHE A 4 42.688 53.597 25.467 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.320 52.812 28.366 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.591 53.842 27.737 1.00 0.00 H new ATOM 0 HD1 PHE A 4 43.228 56.171 27.326 1.00 0.00 H new ATOM 0 HD2 PHE A 4 39.962 53.614 28.426 1.00 0.00 H new ATOM 0 HE1 PHE A 4 41.793 58.160 27.682 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.516 55.599 28.757 1.00 0.00 H new ATOM 0 HZ PHE A 4 39.430 57.876 28.383 1.00 0.00 H new ATOM 76 N VAL A 5 44.595 51.918 25.608 1.00 0.00 N ATOM 77 CA VAL A 5 45.693 50.973 25.621 1.00 0.00 C ATOM 78 C VAL A 5 46.926 51.649 26.221 1.00 0.00 C ATOM 79 O VAL A 5 47.309 52.735 25.791 1.00 0.00 O ATOM 80 CB VAL A 5 45.976 50.385 24.242 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.068 49.321 24.317 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.739 49.741 23.624 1.00 0.00 C ATOM 0 H VAL A 5 44.834 52.800 25.155 1.00 0.00 H new ATOM 0 HA VAL A 5 45.413 50.124 26.244 1.00 0.00 H new ATOM 0 HB VAL A 5 46.296 51.220 23.619 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.251 48.917 23.321 1.00 0.00 H new ATOM 0 HG12 VAL A 5 47.985 49.767 24.702 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.748 48.518 24.981 1.00 0.00 H new ATOM 0 HG21 VAL A 5 44.991 49.337 22.643 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.387 48.936 24.269 1.00 0.00 H new ATOM 0 HG23 VAL A 5 43.954 50.490 23.517 1.00 0.00 H new ATOM 92 N LYS A 6 47.520 51.014 27.228 1.00 0.00 N ATOM 93 CA LYS A 6 48.534 51.566 28.104 1.00 0.00 C ATOM 94 C LYS A 6 49.757 50.649 28.157 1.00 0.00 C ATOM 95 O LYS A 6 49.629 49.476 28.500 1.00 0.00 O ATOM 96 CB LYS A 6 47.877 51.751 29.469 1.00 0.00 C ATOM 97 CG LYS A 6 48.729 52.494 30.495 1.00 0.00 C ATOM 98 CD LYS A 6 47.984 52.605 31.822 1.00 0.00 C ATOM 99 CE LYS A 6 48.772 53.436 32.831 1.00 0.00 C ATOM 100 NZ LYS A 6 48.297 53.210 34.204 1.00 0.00 N ATOM 0 H LYS A 6 47.290 50.048 27.462 1.00 0.00 H new ATOM 0 HA LYS A 6 48.903 52.525 27.742 1.00 0.00 H new ATOM 0 HB2 LYS A 6 46.940 52.292 29.335 1.00 0.00 H new ATOM 0 HB3 LYS A 6 47.624 50.770 29.870 1.00 0.00 H new ATOM 0 HG2 LYS A 6 49.673 51.969 30.643 1.00 0.00 H new ATOM 0 HG3 LYS A 6 48.973 53.489 30.123 1.00 0.00 H new ATOM 0 HD2 LYS A 6 47.007 53.060 31.657 1.00 0.00 H new ATOM 0 HD3 LYS A 6 47.807 51.609 32.227 1.00 0.00 H new ATOM 0 HE2 LYS A 6 49.830 53.183 32.765 1.00 0.00 H new ATOM 0 HE3 LYS A 6 48.681 54.493 32.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 48.854 53.790 34.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 47.294 53.475 34.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 48.407 52.205 34.448 1.00 0.00 H new ATOM 168 N LYS A 11 52.947 54.933 28.342 1.00 0.00 N ATOM 169 CA LYS A 11 52.570 55.469 27.050 1.00 0.00 C ATOM 170 C LYS A 11 51.132 55.049 26.739 1.00 0.00 C ATOM 171 O LYS A 11 50.849 53.853 26.719 1.00 0.00 O ATOM 172 CB LYS A 11 53.584 54.997 26.011 1.00 0.00 C ATOM 173 CG LYS A 11 53.940 56.011 24.927 1.00 0.00 C ATOM 174 CD LYS A 11 52.837 56.274 23.905 1.00 0.00 C ATOM 175 CE LYS A 11 53.362 57.235 22.844 1.00 0.00 C ATOM 176 NZ LYS A 11 52.333 57.525 21.833 1.00 0.00 N ATOM 0 HA LYS A 11 52.588 56.559 27.041 1.00 0.00 H new ATOM 0 HB2 LYS A 11 54.499 54.709 26.528 1.00 0.00 H new ATOM 0 HB3 LYS A 11 53.194 54.100 25.530 1.00 0.00 H new ATOM 0 HG2 LYS A 11 54.205 56.954 25.405 1.00 0.00 H new ATOM 0 HG3 LYS A 11 54.828 55.661 24.400 1.00 0.00 H new ATOM 0 HD2 LYS A 11 52.521 55.339 23.443 1.00 0.00 H new ATOM 0 HD3 LYS A 11 51.961 56.698 24.397 1.00 0.00 H new ATOM 0 HE2 LYS A 11 53.683 58.163 23.317 1.00 0.00 H new ATOM 0 HE3 LYS A 11 54.239 56.804 22.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 52.662 58.293 21.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 52.156 56.673 21.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 51.453 57.815 22.306 1.00 0.00 H new ATOM 190 N THR A 12 50.219 55.999 26.559 1.00 0.00 N ATOM 191 CA THR A 12 48.793 55.747 26.519 1.00 0.00 C ATOM 192 C THR A 12 48.139 56.275 25.241 1.00 0.00 C ATOM 193 O THR A 12 48.252 57.461 24.933 1.00 0.00 O ATOM 194 CB THR A 12 48.099 56.344 27.741 1.00 0.00 C ATOM 195 OG1 THR A 12 48.686 55.867 28.930 1.00 0.00 O ATOM 196 CG2 THR A 12 46.625 55.958 27.826 1.00 0.00 C ATOM 0 H THR A 12 50.460 56.982 26.435 1.00 0.00 H new ATOM 0 HA THR A 12 48.671 54.664 26.528 1.00 0.00 H new ATOM 0 HB THR A 12 48.203 57.424 27.632 1.00 0.00 H new ATOM 0 HG1 THR A 12 48.229 56.262 29.702 1.00 0.00 H new ATOM 0 HG21 THR A 12 46.181 56.409 28.713 1.00 0.00 H new ATOM 0 HG22 THR A 12 46.104 56.315 26.938 1.00 0.00 H new ATOM 0 HG23 THR A 12 46.536 54.873 27.888 1.00 0.00 H new ATOM 204 N ILE A 13 47.410 55.411 24.541 1.00 0.00 N ATOM 205 CA ILE A 13 46.636 55.711 23.354 1.00 0.00 C ATOM 206 C ILE A 13 45.163 55.350 23.548 1.00 0.00 C ATOM 207 O ILE A 13 44.831 54.508 24.380 1.00 0.00 O ATOM 208 CB ILE A 13 47.224 55.042 22.115 1.00 0.00 C ATOM 209 CG1 ILE A 13 47.277 53.520 22.223 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.579 55.656 21.774 1.00 0.00 C ATOM 211 CD1 ILE A 13 47.720 52.802 20.952 1.00 0.00 C ATOM 0 H ILE A 13 47.344 54.429 24.807 1.00 0.00 H new ATOM 0 HA ILE A 13 46.689 56.787 23.190 1.00 0.00 H new ATOM 0 HB ILE A 13 46.547 55.239 21.284 1.00 0.00 H new ATOM 0 HG12 ILE A 13 47.957 53.251 23.031 1.00 0.00 H new ATOM 0 HG13 ILE A 13 46.289 53.155 22.504 1.00 0.00 H new ATOM 0 HG21 ILE A 13 48.987 55.169 20.888 1.00 0.00 H new ATOM 0 HG22 ILE A 13 48.457 56.721 21.579 1.00 0.00 H new ATOM 0 HG23 ILE A 13 49.263 55.517 22.611 1.00 0.00 H new ATOM 0 HD11 ILE A 13 47.727 51.726 21.126 1.00 0.00 H new ATOM 0 HD12 ILE A 13 47.028 53.035 20.143 1.00 0.00 H new ATOM 0 HD13 ILE A 13 48.722 53.132 20.678 1.00 0.00 H new ATOM 223 N THR A 14 44.278 55.931 22.744 1.00 0.00 N ATOM 224 CA THR A 14 42.881 55.558 22.642 1.00 0.00 C ATOM 225 C THR A 14 42.577 54.945 21.273 1.00 0.00 C ATOM 226 O THR A 14 43.131 55.372 20.263 1.00 0.00 O ATOM 227 CB THR A 14 41.938 56.728 22.909 1.00 0.00 C ATOM 228 OG1 THR A 14 42.234 57.839 22.092 1.00 0.00 O ATOM 229 CG2 THR A 14 41.991 57.201 24.359 1.00 0.00 C ATOM 0 H THR A 14 44.528 56.702 22.125 1.00 0.00 H new ATOM 0 HA THR A 14 42.705 54.813 23.418 1.00 0.00 H new ATOM 0 HB THR A 14 40.943 56.346 22.683 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.609 58.567 22.290 1.00 0.00 H new ATOM 0 HG21 THR A 14 41.302 58.034 24.495 1.00 0.00 H new ATOM 0 HG22 THR A 14 41.705 56.382 25.019 1.00 0.00 H new ATOM 0 HG23 THR A 14 43.004 57.525 24.599 1.00 0.00 H new ATOM 237 N LEU A 15 41.689 53.956 21.233 1.00 0.00 N ATOM 238 CA LEU A 15 41.229 53.315 20.017 1.00 0.00 C ATOM 239 C LEU A 15 39.700 53.276 19.967 1.00 0.00 C ATOM 240 O LEU A 15 39.061 53.027 20.987 1.00 0.00 O ATOM 241 CB LEU A 15 41.793 51.902 19.911 1.00 0.00 C ATOM 242 CG LEU A 15 43.312 51.777 19.854 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.697 50.300 19.858 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.907 52.410 18.600 1.00 0.00 C ATOM 0 H LEU A 15 41.260 53.571 22.074 1.00 0.00 H new ATOM 0 HA LEU A 15 41.587 53.901 19.171 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.435 51.327 20.765 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.379 51.436 19.017 1.00 0.00 H new ATOM 0 HG LEU A 15 43.706 52.301 20.725 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.782 50.207 19.817 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.326 49.830 20.769 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.258 49.807 18.991 1.00 0.00 H new ATOM 0 HD21 LEU A 15 44.991 52.292 18.612 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.498 51.920 17.716 1.00 0.00 H new ATOM 0 HD23 LEU A 15 43.658 53.471 18.575 1.00 0.00 H new ATOM 256 N GLU A 16 39.130 53.441 18.776 1.00 0.00 N ATOM 257 CA GLU A 16 37.734 53.149 18.519 1.00 0.00 C ATOM 258 C GLU A 16 37.583 51.708 18.028 1.00 0.00 C ATOM 259 O GLU A 16 38.094 51.315 16.981 1.00 0.00 O ATOM 260 CB GLU A 16 37.100 54.153 17.561 1.00 0.00 C ATOM 261 CG GLU A 16 36.731 55.489 18.198 1.00 0.00 C ATOM 262 CD GLU A 16 37.918 56.427 18.423 1.00 0.00 C ATOM 263 OE1 GLU A 16 38.114 56.910 19.560 1.00 0.00 O ATOM 264 OE2 GLU A 16 38.634 56.756 17.452 1.00 0.00 O ATOM 0 H GLU A 16 39.634 53.785 17.959 1.00 0.00 H new ATOM 0 HA GLU A 16 37.188 53.249 19.457 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.790 54.336 16.737 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.202 53.709 17.132 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.001 55.991 17.564 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.245 55.300 19.155 1.00 0.00 H new ATOM 271 N VAL A 17 36.853 50.901 18.792 1.00 0.00 N ATOM 272 CA VAL A 17 36.659 49.478 18.596 1.00 0.00 C ATOM 273 C VAL A 17 35.181 49.092 18.674 1.00 0.00 C ATOM 274 O VAL A 17 34.367 49.830 19.224 1.00 0.00 O ATOM 275 CB VAL A 17 37.483 48.656 19.584 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.983 48.886 19.426 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.085 48.924 21.033 1.00 0.00 C ATOM 0 H VAL A 17 36.354 51.249 19.611 1.00 0.00 H new ATOM 0 HA VAL A 17 37.012 49.248 17.591 1.00 0.00 H new ATOM 0 HB VAL A 17 37.263 47.615 19.345 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.523 48.278 20.152 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.290 48.606 18.418 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.209 49.939 19.595 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.699 48.316 21.697 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.236 49.979 21.263 1.00 0.00 H new ATOM 0 HG23 VAL A 17 36.035 48.669 21.175 1.00 0.00 H new ATOM 287 N GLU A 18 34.839 47.921 18.144 1.00 0.00 N ATOM 288 CA GLU A 18 33.498 47.375 18.156 1.00 0.00 C ATOM 289 C GLU A 18 33.450 46.025 18.874 1.00 0.00 C ATOM 290 O GLU A 18 34.465 45.332 18.910 1.00 0.00 O ATOM 291 CB GLU A 18 32.981 47.252 16.726 1.00 0.00 C ATOM 292 CG GLU A 18 32.711 48.596 16.055 1.00 0.00 C ATOM 293 CD GLU A 18 32.432 48.402 14.563 1.00 0.00 C ATOM 294 OE1 GLU A 18 31.250 48.368 14.157 1.00 0.00 O ATOM 295 OE2 GLU A 18 33.403 48.247 13.793 1.00 0.00 O ATOM 0 H GLU A 18 35.514 47.312 17.681 1.00 0.00 H new ATOM 0 HA GLU A 18 32.852 48.056 18.710 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.709 46.699 16.132 1.00 0.00 H new ATOM 0 HB3 GLU A 18 32.062 46.667 16.730 1.00 0.00 H new ATOM 0 HG2 GLU A 18 31.859 49.082 16.530 1.00 0.00 H new ATOM 0 HG3 GLU A 18 33.569 49.255 16.188 1.00 0.00 H new ATOM 302 N PRO A 19 32.310 45.586 19.400 1.00 0.00 N ATOM 303 CA PRO A 19 32.173 44.316 20.084 1.00 0.00 C ATOM 304 C PRO A 19 32.658 43.088 19.310 1.00 0.00 C ATOM 305 O PRO A 19 33.060 42.103 19.926 1.00 0.00 O ATOM 306 CB PRO A 19 30.688 44.180 20.405 1.00 0.00 C ATOM 307 CG PRO A 19 30.241 45.630 20.567 1.00 0.00 C ATOM 308 CD PRO A 19 31.080 46.344 19.511 1.00 0.00 C ATOM 0 HA PRO A 19 32.817 44.333 20.963 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.146 43.677 19.604 1.00 0.00 H new ATOM 0 HB3 PRO A 19 30.522 43.602 21.314 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.173 45.749 20.388 1.00 0.00 H new ATOM 0 HG3 PRO A 19 30.440 46.008 21.570 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.556 46.381 18.556 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.282 47.374 19.804 1.00 0.00 H new ATOM 316 N SER A 20 32.623 43.140 17.982 1.00 0.00 N ATOM 317 CA SER A 20 33.063 42.087 17.089 1.00 0.00 C ATOM 318 C SER A 20 34.482 42.262 16.542 1.00 0.00 C ATOM 319 O SER A 20 34.864 41.501 15.656 1.00 0.00 O ATOM 320 CB SER A 20 32.085 41.888 15.935 1.00 0.00 C ATOM 321 OG SER A 20 30.733 42.008 16.316 1.00 0.00 O ATOM 0 H SER A 20 32.270 43.956 17.482 1.00 0.00 H new ATOM 0 HA SER A 20 33.085 41.194 17.714 1.00 0.00 H new ATOM 0 HB2 SER A 20 32.301 42.619 15.156 1.00 0.00 H new ATOM 0 HB3 SER A 20 32.245 40.902 15.499 1.00 0.00 H new ATOM 0 HG SER A 20 30.159 41.872 15.533 1.00 0.00 H new ATOM 327 N ASP A 21 35.272 43.225 17.007 1.00 0.00 N ATOM 328 CA ASP A 21 36.663 43.350 16.617 1.00 0.00 C ATOM 329 C ASP A 21 37.494 42.199 17.188 1.00 0.00 C ATOM 330 O ASP A 21 37.338 41.858 18.359 1.00 0.00 O ATOM 331 CB ASP A 21 37.271 44.673 17.075 1.00 0.00 C ATOM 332 CG ASP A 21 36.898 45.917 16.265 1.00 0.00 C ATOM 333 OD1 ASP A 21 36.246 45.841 15.202 1.00 0.00 O ATOM 334 OD2 ASP A 21 37.321 47.028 16.650 1.00 0.00 O ATOM 0 H ASP A 21 34.961 43.939 17.665 1.00 0.00 H new ATOM 0 HA ASP A 21 36.684 43.317 15.528 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.979 44.841 18.111 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.356 44.571 17.062 1.00 0.00 H new ATOM 339 N THR A 22 38.394 41.617 16.401 1.00 0.00 N ATOM 340 CA THR A 22 39.295 40.570 16.840 1.00 0.00 C ATOM 341 C THR A 22 40.530 41.126 17.551 1.00 0.00 C ATOM 342 O THR A 22 41.009 42.209 17.221 1.00 0.00 O ATOM 343 CB THR A 22 39.716 39.619 15.723 1.00 0.00 C ATOM 344 OG1 THR A 22 40.516 40.269 14.761 1.00 0.00 O ATOM 345 CG2 THR A 22 38.524 38.986 15.012 1.00 0.00 C ATOM 0 H THR A 22 38.515 41.869 15.420 1.00 0.00 H new ATOM 0 HA THR A 22 38.715 39.988 17.556 1.00 0.00 H new ATOM 0 HB THR A 22 40.291 38.833 16.212 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.769 39.631 14.061 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.881 38.319 14.227 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.932 38.418 15.730 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.906 39.768 14.570 1.00 0.00 H new ATOM 353 N ILE A 23 41.097 40.375 18.491 1.00 0.00 N ATOM 354 CA ILE A 23 42.325 40.751 19.164 1.00 0.00 C ATOM 355 C ILE A 23 43.484 40.905 18.177 1.00 0.00 C ATOM 356 O ILE A 23 44.264 41.847 18.300 1.00 0.00 O ATOM 357 CB ILE A 23 42.647 39.755 20.274 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.613 39.761 21.397 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.048 39.930 20.852 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.443 41.068 22.167 1.00 0.00 C ATOM 0 H ILE A 23 40.711 39.485 18.805 1.00 0.00 H new ATOM 0 HA ILE A 23 42.179 41.728 19.624 1.00 0.00 H new ATOM 0 HB ILE A 23 42.609 38.781 19.786 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.647 39.489 20.971 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.879 38.979 22.108 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.213 39.191 21.636 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.787 39.793 20.063 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.146 40.932 21.271 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.681 40.941 22.936 1.00 0.00 H new ATOM 0 HD12 ILE A 23 42.389 41.340 22.635 1.00 0.00 H new ATOM 0 HD13 ILE A 23 41.138 41.858 21.480 1.00 0.00 H new ATOM 372 N GLU A 24 43.559 40.050 17.162 1.00 0.00 N ATOM 373 CA GLU A 24 44.493 40.174 16.061 1.00 0.00 C ATOM 374 C GLU A 24 44.420 41.548 15.391 1.00 0.00 C ATOM 375 O GLU A 24 45.435 42.211 15.189 1.00 0.00 O ATOM 376 CB GLU A 24 44.169 39.081 15.048 1.00 0.00 C ATOM 377 CG GLU A 24 45.136 39.064 13.867 1.00 0.00 C ATOM 378 CD GLU A 24 44.859 37.858 12.968 1.00 0.00 C ATOM 379 OE1 GLU A 24 43.792 37.827 12.317 1.00 0.00 O ATOM 380 OE2 GLU A 24 45.693 36.927 12.951 1.00 0.00 O ATOM 0 H GLU A 24 42.954 39.232 17.086 1.00 0.00 H new ATOM 0 HA GLU A 24 45.508 40.067 16.445 1.00 0.00 H new ATOM 0 HB2 GLU A 24 44.194 38.112 15.546 1.00 0.00 H new ATOM 0 HB3 GLU A 24 43.154 39.224 14.678 1.00 0.00 H new ATOM 0 HG2 GLU A 24 45.035 39.985 13.292 1.00 0.00 H new ATOM 0 HG3 GLU A 24 46.163 39.027 14.230 1.00 0.00 H new ATOM 387 N ASN A 25 43.214 42.005 15.068 1.00 0.00 N ATOM 388 CA ASN A 25 42.999 43.279 14.414 1.00 0.00 C ATOM 389 C ASN A 25 43.147 44.475 15.356 1.00 0.00 C ATOM 390 O ASN A 25 43.579 45.535 14.910 1.00 0.00 O ATOM 391 CB ASN A 25 41.652 43.235 13.699 1.00 0.00 C ATOM 392 CG ASN A 25 41.661 42.384 12.426 1.00 0.00 C ATOM 393 OD1 ASN A 25 42.689 42.000 11.873 1.00 0.00 O ATOM 394 ND2 ASN A 25 40.478 42.111 11.883 1.00 0.00 N ATOM 0 H ASN A 25 42.353 41.491 15.258 1.00 0.00 H new ATOM 0 HA ASN A 25 43.785 43.435 13.676 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.900 42.842 14.383 1.00 0.00 H new ATOM 0 HB3 ASN A 25 41.352 44.251 13.444 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.426 41.585 11.011 1.00 0.00 H new ATOM 0 HD22 ASN A 25 39.622 42.428 12.339 1.00 0.00 H new ATOM 401 N VAL A 26 42.917 44.334 16.658 1.00 0.00 N ATOM 402 CA VAL A 26 43.255 45.365 17.619 1.00 0.00 C ATOM 403 C VAL A 26 44.770 45.539 17.743 1.00 0.00 C ATOM 404 O VAL A 26 45.229 46.679 17.751 1.00 0.00 O ATOM 405 CB VAL A 26 42.568 45.172 18.967 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.002 46.231 19.977 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.054 45.296 18.824 1.00 0.00 C ATOM 0 H VAL A 26 42.492 43.503 17.070 1.00 0.00 H new ATOM 0 HA VAL A 26 42.858 46.302 17.228 1.00 0.00 H new ATOM 0 HB VAL A 26 42.852 44.179 19.315 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.492 46.061 20.925 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.080 46.169 20.129 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.745 47.221 19.599 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.584 45.155 19.797 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.805 46.285 18.440 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.690 44.536 18.132 1.00 0.00 H new ATOM 417 N LYS A 27 45.568 44.476 17.687 1.00 0.00 N ATOM 418 CA LYS A 27 47.003 44.596 17.526 1.00 0.00 C ATOM 419 C LYS A 27 47.380 45.326 16.236 1.00 0.00 C ATOM 420 O LYS A 27 48.321 46.117 16.231 1.00 0.00 O ATOM 421 CB LYS A 27 47.695 43.238 17.593 1.00 0.00 C ATOM 422 CG LYS A 27 47.634 42.542 18.951 1.00 0.00 C ATOM 423 CD LYS A 27 48.297 41.172 18.848 1.00 0.00 C ATOM 424 CE LYS A 27 48.267 40.407 20.167 1.00 0.00 C ATOM 425 NZ LYS A 27 48.737 39.024 19.984 1.00 0.00 N ATOM 0 H LYS A 27 45.234 43.514 17.752 1.00 0.00 H new ATOM 0 HA LYS A 27 47.356 45.199 18.363 1.00 0.00 H new ATOM 0 HB2 LYS A 27 47.246 42.583 16.847 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.741 43.367 17.316 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.138 43.147 19.705 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.597 42.434 19.270 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.793 40.585 18.080 1.00 0.00 H new ATOM 0 HD3 LYS A 27 49.331 41.296 18.527 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.894 40.914 20.900 1.00 0.00 H new ATOM 0 HE3 LYS A 27 47.252 40.401 20.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 48.267 38.403 20.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.510 38.705 19.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.766 38.985 20.128 1.00 0.00 H new ATOM 439 N ALA A 28 46.620 45.145 15.160 1.00 0.00 N ATOM 440 CA ALA A 28 46.793 45.874 13.919 1.00 0.00 C ATOM 441 C ALA A 28 46.331 47.333 13.957 1.00 0.00 C ATOM 442 O ALA A 28 46.806 48.124 13.146 1.00 0.00 O ATOM 443 CB ALA A 28 46.130 45.104 12.780 1.00 0.00 C ATOM 0 H ALA A 28 45.853 44.473 15.131 1.00 0.00 H new ATOM 0 HA ALA A 28 47.868 45.942 13.750 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.260 45.652 11.847 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.590 44.120 12.690 1.00 0.00 H new ATOM 0 HB3 ALA A 28 45.066 44.990 12.989 1.00 0.00 H new ATOM 449 N LYS A 29 45.471 47.731 14.890 1.00 0.00 N ATOM 450 CA LYS A 29 45.152 49.112 15.189 1.00 0.00 C ATOM 451 C LYS A 29 46.255 49.780 16.012 1.00 0.00 C ATOM 452 O LYS A 29 46.647 50.905 15.709 1.00 0.00 O ATOM 453 CB LYS A 29 43.806 49.228 15.899 1.00 0.00 C ATOM 454 CG LYS A 29 42.603 48.926 15.010 1.00 0.00 C ATOM 455 CD LYS A 29 41.283 49.059 15.765 1.00 0.00 C ATOM 456 CE LYS A 29 40.122 48.792 14.810 1.00 0.00 C ATOM 457 NZ LYS A 29 38.801 49.008 15.422 1.00 0.00 N ATOM 0 H LYS A 29 44.961 47.071 15.477 1.00 0.00 H new ATOM 0 HA LYS A 29 45.081 49.638 14.237 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.796 48.546 16.749 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.704 50.237 16.299 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.603 49.606 14.158 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.692 47.915 14.611 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.254 48.354 16.596 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.195 50.058 16.192 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.221 49.440 13.939 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.185 47.764 14.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.100 49.196 14.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.522 48.159 15.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.847 49.822 16.068 1.00 0.00 H new ATOM 471 N ILE A 30 46.830 49.070 16.980 1.00 0.00 N ATOM 472 CA ILE A 30 48.010 49.494 17.706 1.00 0.00 C ATOM 473 C ILE A 30 49.180 49.698 16.740 1.00 0.00 C ATOM 474 O ILE A 30 49.864 50.716 16.817 1.00 0.00 O ATOM 475 CB ILE A 30 48.328 48.506 18.824 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.220 48.512 19.874 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.676 48.799 19.476 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.257 47.338 20.848 1.00 0.00 C ATOM 0 H ILE A 30 46.475 48.163 17.283 1.00 0.00 H new ATOM 0 HA ILE A 30 47.821 50.456 18.182 1.00 0.00 H new ATOM 0 HB ILE A 30 48.388 47.515 18.375 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.282 49.440 20.442 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.256 48.514 19.365 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.863 48.072 20.267 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.465 48.732 18.727 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.664 49.803 19.901 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.433 47.427 21.556 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.161 46.403 20.295 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.203 47.344 21.389 1.00 0.00 H new ATOM 490 N GLN A 31 49.373 48.800 15.779 1.00 0.00 N ATOM 491 CA GLN A 31 50.349 48.947 14.718 1.00 0.00 C ATOM 492 C GLN A 31 50.142 50.212 13.882 1.00 0.00 C ATOM 493 O GLN A 31 51.121 50.864 13.526 1.00 0.00 O ATOM 494 CB GLN A 31 50.299 47.709 13.827 1.00 0.00 C ATOM 495 CG GLN A 31 51.407 47.683 12.778 1.00 0.00 C ATOM 496 CD GLN A 31 51.355 46.414 11.924 1.00 0.00 C ATOM 497 OE1 GLN A 31 50.296 45.846 11.666 1.00 0.00 O ATOM 498 NE2 GLN A 31 52.506 45.915 11.484 1.00 0.00 N ATOM 0 H GLN A 31 48.840 47.932 15.720 1.00 0.00 H new ATOM 0 HA GLN A 31 51.330 49.047 15.182 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.375 46.817 14.449 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.332 47.667 13.327 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.318 48.558 12.134 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.376 47.749 13.272 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.383 46.389 11.700 1.00 0.00 H new ATOM 0 HE22 GLN A 31 52.512 45.058 10.930 1.00 0.00 H new ATOM 507 N ASP A 32 48.906 50.602 13.586 1.00 0.00 N ATOM 508 CA ASP A 32 48.640 51.835 12.872 1.00 0.00 C ATOM 509 C ASP A 32 49.001 53.090 13.668 1.00 0.00 C ATOM 510 O ASP A 32 49.473 54.053 13.069 1.00 0.00 O ATOM 511 CB ASP A 32 47.187 51.876 12.408 1.00 0.00 C ATOM 512 CG ASP A 32 46.855 53.158 11.641 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.585 53.485 10.681 1.00 0.00 O ATOM 514 OD2 ASP A 32 45.870 53.841 11.995 1.00 0.00 O ATOM 0 H ASP A 32 48.070 50.073 13.834 1.00 0.00 H new ATOM 0 HA ASP A 32 49.295 51.839 12.001 1.00 0.00 H new ATOM 0 HB2 ASP A 32 46.987 51.013 11.772 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.530 51.793 13.274 1.00 0.00 H new ATOM 519 N LYS A 33 48.830 53.103 14.987 1.00 0.00 N ATOM 520 CA LYS A 33 49.179 54.247 15.806 1.00 0.00 C ATOM 521 C LYS A 33 50.648 54.298 16.230 1.00 0.00 C ATOM 522 O LYS A 33 51.198 55.395 16.301 1.00 0.00 O ATOM 523 CB LYS A 33 48.235 54.374 16.999 1.00 0.00 C ATOM 524 CG LYS A 33 46.817 54.714 16.549 1.00 0.00 C ATOM 525 CD LYS A 33 46.003 55.410 17.637 1.00 0.00 C ATOM 526 CE LYS A 33 44.639 55.795 17.071 1.00 0.00 C ATOM 527 NZ LYS A 33 43.924 56.728 17.955 1.00 0.00 N ATOM 0 H LYS A 33 48.445 52.318 15.513 1.00 0.00 H new ATOM 0 HA LYS A 33 49.048 55.119 15.166 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.227 53.440 17.560 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.600 55.148 17.674 1.00 0.00 H new ATOM 0 HG2 LYS A 33 46.864 55.356 15.670 1.00 0.00 H new ATOM 0 HG3 LYS A 33 46.307 53.799 16.249 1.00 0.00 H new ATOM 0 HD2 LYS A 33 45.881 54.750 18.496 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.528 56.298 17.990 1.00 0.00 H new ATOM 0 HE2 LYS A 33 44.768 56.251 16.090 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.038 54.897 16.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 43.085 57.097 17.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 43.629 56.230 18.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.552 57.517 18.208 1.00 0.00 H new ATOM 541 N GLU A 34 51.303 53.167 16.479 1.00 0.00 N ATOM 542 CA GLU A 34 52.632 53.105 17.051 1.00 0.00 C ATOM 543 C GLU A 34 53.693 52.455 16.161 1.00 0.00 C ATOM 544 O GLU A 34 54.882 52.560 16.455 1.00 0.00 O ATOM 545 CB GLU A 34 52.554 52.382 18.393 1.00 0.00 C ATOM 546 CG GLU A 34 51.801 53.153 19.473 1.00 0.00 C ATOM 547 CD GLU A 34 52.493 54.465 19.846 1.00 0.00 C ATOM 548 OE1 GLU A 34 53.741 54.508 19.902 1.00 0.00 O ATOM 549 OE2 GLU A 34 51.806 55.483 20.073 1.00 0.00 O ATOM 0 H GLU A 34 50.908 52.248 16.281 1.00 0.00 H new ATOM 0 HA GLU A 34 52.964 54.137 17.169 1.00 0.00 H new ATOM 0 HB2 GLU A 34 52.069 51.417 18.246 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.566 52.180 18.744 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.790 53.365 19.125 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.708 52.529 20.362 1.00 0.00 H new ATOM 556 N GLY A 35 53.319 51.764 15.088 1.00 0.00 N ATOM 557 CA GLY A 35 54.233 51.061 14.210 1.00 0.00 C ATOM 558 C GLY A 35 54.796 49.750 14.759 1.00 0.00 C ATOM 559 O GLY A 35 55.645 49.139 14.111 1.00 0.00 O ATOM 0 H GLY A 35 52.344 51.679 14.802 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.719 50.851 13.272 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.066 51.724 13.975 1.00 0.00 H new ATOM 563 N ILE A 36 54.328 49.291 15.916 1.00 0.00 N ATOM 564 CA ILE A 36 54.783 48.081 16.570 1.00 0.00 C ATOM 565 C ILE A 36 54.148 46.875 15.875 1.00 0.00 C ATOM 566 O ILE A 36 52.922 46.802 15.847 1.00 0.00 O ATOM 567 CB ILE A 36 54.453 48.119 18.060 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.103 49.315 18.750 1.00 0.00 C ATOM 569 CG2 ILE A 36 54.898 46.825 18.737 1.00 0.00 C ATOM 570 CD1 ILE A 36 54.588 49.573 20.163 1.00 0.00 C ATOM 0 H ILE A 36 53.596 49.773 16.438 1.00 0.00 H new ATOM 0 HA ILE A 36 55.867 47.999 16.489 1.00 0.00 H new ATOM 0 HB ILE A 36 53.372 48.222 18.153 1.00 0.00 H new ATOM 0 HG12 ILE A 36 56.181 49.156 18.791 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.935 50.206 18.145 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.656 46.868 19.799 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.382 45.980 18.281 1.00 0.00 H new ATOM 0 HG23 ILE A 36 55.974 46.702 18.615 1.00 0.00 H new ATOM 0 HD11 ILE A 36 55.099 50.439 20.584 1.00 0.00 H new ATOM 0 HD12 ILE A 36 53.516 49.765 20.130 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.781 48.699 20.786 1.00 0.00 H new ATOM 582 N PRO A 37 54.906 45.918 15.347 1.00 0.00 N ATOM 583 CA PRO A 37 54.345 44.794 14.626 1.00 0.00 C ATOM 584 C PRO A 37 53.571 43.857 15.556 1.00 0.00 C ATOM 585 O PRO A 37 54.088 43.530 16.622 1.00 0.00 O ATOM 586 CB PRO A 37 55.529 44.098 13.962 1.00 0.00 C ATOM 587 CG PRO A 37 56.708 44.439 14.868 1.00 0.00 C ATOM 588 CD PRO A 37 56.352 45.833 15.377 1.00 0.00 C ATOM 0 HA PRO A 37 53.616 45.118 13.883 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.374 43.021 13.896 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.687 44.460 12.946 1.00 0.00 H new ATOM 0 HG2 PRO A 37 56.810 43.724 15.685 1.00 0.00 H new ATOM 0 HG3 PRO A 37 57.651 44.437 14.322 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.730 45.986 16.388 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.800 46.603 14.749 1.00 0.00 H new ATOM 596 N PRO A 38 52.373 43.402 15.200 1.00 0.00 N ATOM 597 CA PRO A 38 51.554 42.521 16.010 1.00 0.00 C ATOM 598 C PRO A 38 52.277 41.305 16.594 1.00 0.00 C ATOM 599 O PRO A 38 52.036 40.967 17.752 1.00 0.00 O ATOM 600 CB PRO A 38 50.409 42.082 15.104 1.00 0.00 C ATOM 601 CG PRO A 38 50.176 43.326 14.252 1.00 0.00 C ATOM 602 CD PRO A 38 51.593 43.863 14.070 1.00 0.00 C ATOM 0 HA PRO A 38 51.226 43.066 16.895 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.679 41.218 14.497 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.522 41.807 15.674 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.707 43.084 13.298 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.529 44.046 14.752 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.023 43.506 13.134 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.589 44.952 14.024 1.00 0.00 H new ATOM 610 N ASP A 39 53.201 40.683 15.869 1.00 0.00 N ATOM 611 CA ASP A 39 53.965 39.557 16.367 1.00 0.00 C ATOM 612 C ASP A 39 54.813 39.864 17.602 1.00 0.00 C ATOM 613 O ASP A 39 55.057 38.961 18.398 1.00 0.00 O ATOM 614 CB ASP A 39 54.804 38.937 15.252 1.00 0.00 C ATOM 615 CG ASP A 39 55.909 39.852 14.721 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.721 40.456 13.643 1.00 0.00 O ATOM 617 OD2 ASP A 39 56.994 39.935 15.338 1.00 0.00 O ATOM 0 H ASP A 39 53.438 40.952 14.914 1.00 0.00 H new ATOM 0 HA ASP A 39 53.229 38.828 16.707 1.00 0.00 H new ATOM 0 HB2 ASP A 39 55.255 38.016 15.621 1.00 0.00 H new ATOM 0 HB3 ASP A 39 54.147 38.662 14.427 1.00 0.00 H new ATOM 622 N GLN A 40 55.199 41.116 17.833 1.00 0.00 N ATOM 623 CA GLN A 40 55.956 41.552 18.989 1.00 0.00 C ATOM 624 C GLN A 40 55.074 42.022 20.147 1.00 0.00 C ATOM 625 O GLN A 40 55.587 42.303 21.227 1.00 0.00 O ATOM 626 CB GLN A 40 56.949 42.610 18.515 1.00 0.00 C ATOM 627 CG GLN A 40 58.143 42.844 19.436 1.00 0.00 C ATOM 628 CD GLN A 40 59.150 43.796 18.788 1.00 0.00 C ATOM 629 OE1 GLN A 40 59.086 45.015 18.926 1.00 0.00 O ATOM 630 NE2 GLN A 40 60.109 43.285 18.022 1.00 0.00 N ATOM 0 H GLN A 40 54.982 41.879 17.192 1.00 0.00 H new ATOM 0 HA GLN A 40 56.498 40.707 19.413 1.00 0.00 H new ATOM 0 HB2 GLN A 40 57.321 42.321 17.532 1.00 0.00 H new ATOM 0 HB3 GLN A 40 56.417 43.553 18.390 1.00 0.00 H new ATOM 0 HG2 GLN A 40 57.801 43.259 20.384 1.00 0.00 H new ATOM 0 HG3 GLN A 40 58.627 41.893 19.661 1.00 0.00 H new ATOM 0 HE21 GLN A 40 60.177 42.275 17.896 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.776 43.903 17.560 1.00 0.00 H new ATOM 639 N GLN A 41 53.761 42.102 19.955 1.00 0.00 N ATOM 640 CA GLN A 41 52.794 42.562 20.931 1.00 0.00 C ATOM 641 C GLN A 41 52.169 41.411 21.723 1.00 0.00 C ATOM 642 O GLN A 41 51.800 40.389 21.149 1.00 0.00 O ATOM 643 CB GLN A 41 51.663 43.339 20.264 1.00 0.00 C ATOM 644 CG GLN A 41 52.047 44.571 19.450 1.00 0.00 C ATOM 645 CD GLN A 41 50.816 45.234 18.829 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.722 45.229 19.389 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.896 45.808 17.632 1.00 0.00 N ATOM 0 H GLN A 41 53.328 41.834 19.071 1.00 0.00 H new ATOM 0 HA GLN A 41 53.349 43.206 21.613 1.00 0.00 H new ATOM 0 HB2 GLN A 41 51.125 42.655 19.608 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.965 43.652 21.040 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.563 45.286 20.091 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.745 44.286 18.663 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.787 45.832 17.136 1.00 0.00 H new ATOM 0 HE22 GLN A 41 50.066 46.225 17.210 1.00 0.00 H new ATOM 656 N ARG A 42 51.939 41.626 23.015 1.00 0.00 N ATOM 657 CA ARG A 42 51.034 40.872 23.860 1.00 0.00 C ATOM 658 C ARG A 42 50.066 41.814 24.578 1.00 0.00 C ATOM 659 O ARG A 42 50.464 42.903 24.985 1.00 0.00 O ATOM 660 CB ARG A 42 51.824 40.023 24.850 1.00 0.00 C ATOM 661 CG ARG A 42 52.218 38.671 24.260 1.00 0.00 C ATOM 662 CD ARG A 42 53.280 37.991 25.120 1.00 0.00 C ATOM 663 NE ARG A 42 53.511 36.611 24.691 1.00 0.00 N ATOM 664 CZ ARG A 42 54.545 35.832 25.037 1.00 0.00 C ATOM 665 NH1 ARG A 42 55.557 36.260 25.803 1.00 0.00 N ATOM 666 NH2 ARG A 42 54.611 34.570 24.593 1.00 0.00 N ATOM 0 H ARG A 42 52.409 42.375 23.524 1.00 0.00 H new ATOM 0 HA ARG A 42 50.443 40.200 23.238 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.722 40.561 25.153 1.00 0.00 H new ATOM 0 HB3 ARG A 42 51.228 39.866 25.749 1.00 0.00 H new ATOM 0 HG2 ARG A 42 51.339 38.031 24.187 1.00 0.00 H new ATOM 0 HG3 ARG A 42 52.597 38.808 23.247 1.00 0.00 H new ATOM 0 HD2 ARG A 42 54.212 38.553 25.061 1.00 0.00 H new ATOM 0 HD3 ARG A 42 52.967 38.002 26.164 1.00 0.00 H new ATOM 0 HE ARG A 42 52.816 36.202 24.067 1.00 0.00 H new ATOM 0 HH11 ARG A 42 55.563 37.219 26.151 1.00 0.00 H new ATOM 0 HH12 ARG A 42 56.321 35.627 26.038 1.00 0.00 H new ATOM 0 HH21 ARG A 42 53.874 34.202 23.991 1.00 0.00 H new ATOM 0 HH22 ARG A 42 55.398 33.977 24.856 1.00 0.00 H new ATOM 680 N LEU A 43 48.812 41.402 24.740 1.00 0.00 N ATOM 681 CA LEU A 43 47.767 42.183 25.373 1.00 0.00 C ATOM 682 C LEU A 43 47.219 41.478 26.616 1.00 0.00 C ATOM 683 O LEU A 43 46.789 40.330 26.540 1.00 0.00 O ATOM 684 CB LEU A 43 46.669 42.488 24.359 1.00 0.00 C ATOM 685 CG LEU A 43 47.057 43.517 23.301 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.023 43.515 22.178 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.117 44.932 23.870 1.00 0.00 C ATOM 0 H LEU A 43 48.491 40.487 24.423 1.00 0.00 H new ATOM 0 HA LEU A 43 48.189 43.128 25.715 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.384 41.562 23.860 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.788 42.847 24.892 1.00 0.00 H new ATOM 0 HG LEU A 43 48.045 43.238 22.935 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.303 44.251 21.424 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.983 42.526 21.722 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.044 43.767 22.585 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.397 45.630 23.081 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.140 45.206 24.267 1.00 0.00 H new ATOM 0 HD23 LEU A 43 47.857 44.972 24.669 1.00 0.00 H new ATOM 699 N ILE A 44 47.205 42.184 27.742 1.00 0.00 N ATOM 700 CA ILE A 44 46.742 41.716 29.034 1.00 0.00 C ATOM 701 C ILE A 44 45.538 42.548 29.482 1.00 0.00 C ATOM 702 O ILE A 44 45.578 43.774 29.412 1.00 0.00 O ATOM 703 CB ILE A 44 47.851 41.761 30.080 1.00 0.00 C ATOM 704 CG1 ILE A 44 49.209 41.226 29.634 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.412 41.062 31.363 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.259 39.753 29.236 1.00 0.00 C ATOM 0 H ILE A 44 47.535 43.149 27.774 1.00 0.00 H new ATOM 0 HA ILE A 44 46.440 40.674 28.932 1.00 0.00 H new ATOM 0 HB ILE A 44 48.010 42.825 30.254 1.00 0.00 H new ATOM 0 HG12 ILE A 44 49.549 41.821 28.786 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.922 41.386 30.443 1.00 0.00 H new ATOM 0 HG21 ILE A 44 48.218 41.106 32.095 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.529 41.560 31.765 1.00 0.00 H new ATOM 0 HG23 ILE A 44 47.175 40.020 31.147 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.274 39.491 28.939 1.00 0.00 H new ATOM 0 HD12 ILE A 44 48.958 39.137 30.083 1.00 0.00 H new ATOM 0 HD13 ILE A 44 48.580 39.578 28.401 1.00 0.00 H new ATOM 718 N PHE A 45 44.478 41.902 29.960 1.00 0.00 N ATOM 719 CA PHE A 45 43.362 42.577 30.589 1.00 0.00 C ATOM 720 C PHE A 45 42.611 41.696 31.591 1.00 0.00 C ATOM 721 O PHE A 45 42.320 40.537 31.306 1.00 0.00 O ATOM 722 CB PHE A 45 42.395 43.091 29.526 1.00 0.00 C ATOM 723 CG PHE A 45 41.255 43.897 30.100 1.00 0.00 C ATOM 724 CD1 PHE A 45 41.521 45.087 30.788 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.934 43.445 29.989 1.00 0.00 C ATOM 726 CE1 PHE A 45 40.477 45.818 31.367 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.886 44.175 30.564 1.00 0.00 C ATOM 728 CZ PHE A 45 39.158 45.356 31.264 1.00 0.00 C ATOM 0 H PHE A 45 44.375 40.888 29.918 1.00 0.00 H new ATOM 0 HA PHE A 45 43.780 43.411 31.153 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.943 43.706 28.812 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.990 42.244 28.972 1.00 0.00 H new ATOM 0 HD1 PHE A 45 42.537 45.443 30.872 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.722 42.529 29.457 1.00 0.00 H new ATOM 0 HE1 PHE A 45 40.688 46.737 31.893 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.868 43.827 30.467 1.00 0.00 H new ATOM 0 HZ PHE A 45 38.353 45.910 31.724 1.00 0.00 H new ATOM 738 N ALA A 46 42.243 42.271 32.733 1.00 0.00 N ATOM 739 CA ALA A 46 41.532 41.635 33.823 1.00 0.00 C ATOM 740 C ALA A 46 42.126 40.289 34.241 1.00 0.00 C ATOM 741 O ALA A 46 41.429 39.286 34.370 1.00 0.00 O ATOM 742 CB ALA A 46 40.034 41.653 33.528 1.00 0.00 C ATOM 0 H ALA A 46 42.448 43.251 32.927 1.00 0.00 H new ATOM 0 HA ALA A 46 41.670 42.217 34.734 1.00 0.00 H new ATOM 0 HB1 ALA A 46 39.496 41.175 34.347 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.696 42.684 33.425 1.00 0.00 H new ATOM 0 HB3 ALA A 46 39.839 41.113 32.602 1.00 0.00 H new ATOM 748 N GLY A 47 43.442 40.253 34.429 1.00 0.00 N ATOM 749 CA GLY A 47 44.160 39.121 34.979 1.00 0.00 C ATOM 750 C GLY A 47 44.494 37.987 34.007 1.00 0.00 C ATOM 751 O GLY A 47 44.945 36.937 34.460 1.00 0.00 O ATOM 0 H GLY A 47 44.051 41.037 34.194 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.092 39.485 35.411 1.00 0.00 H new ATOM 0 HA3 GLY A 47 43.570 38.707 35.796 1.00 0.00 H new ATOM 755 N LYS A 48 44.278 38.170 32.707 1.00 0.00 N ATOM 756 CA LYS A 48 44.602 37.208 31.674 1.00 0.00 C ATOM 757 C LYS A 48 45.119 37.839 30.379 1.00 0.00 C ATOM 758 O LYS A 48 44.819 38.990 30.065 1.00 0.00 O ATOM 759 CB LYS A 48 43.445 36.237 31.457 1.00 0.00 C ATOM 760 CG LYS A 48 42.059 36.819 31.192 1.00 0.00 C ATOM 761 CD LYS A 48 41.880 37.432 29.807 1.00 0.00 C ATOM 762 CE LYS A 48 40.450 37.901 29.554 1.00 0.00 C ATOM 763 NZ LYS A 48 40.058 38.991 30.460 1.00 0.00 N ATOM 0 H LYS A 48 43.858 39.023 32.338 1.00 0.00 H new ATOM 0 HA LYS A 48 45.451 36.628 32.036 1.00 0.00 H new ATOM 0 HB2 LYS A 48 43.703 35.593 30.616 1.00 0.00 H new ATOM 0 HB3 LYS A 48 43.376 35.598 32.338 1.00 0.00 H new ATOM 0 HG2 LYS A 48 41.318 36.031 31.324 1.00 0.00 H new ATOM 0 HG3 LYS A 48 41.851 37.582 31.942 1.00 0.00 H new ATOM 0 HD2 LYS A 48 42.560 38.276 29.697 1.00 0.00 H new ATOM 0 HD3 LYS A 48 42.157 36.698 29.050 1.00 0.00 H new ATOM 0 HE2 LYS A 48 40.356 38.237 28.521 1.00 0.00 H new ATOM 0 HE3 LYS A 48 39.766 37.062 29.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 39.416 39.641 29.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 39.574 38.595 31.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 40.906 39.509 30.767 1.00 0.00 H new ATOM 777 N GLN A 49 45.884 37.065 29.614 1.00 0.00 N ATOM 778 CA GLN A 49 46.359 37.392 28.285 1.00 0.00 C ATOM 779 C GLN A 49 45.296 37.097 27.225 1.00 0.00 C ATOM 780 O GLN A 49 44.612 36.076 27.283 1.00 0.00 O ATOM 781 CB GLN A 49 47.676 36.657 28.049 1.00 0.00 C ATOM 782 CG GLN A 49 48.383 37.006 26.744 1.00 0.00 C ATOM 783 CD GLN A 49 49.791 36.408 26.742 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.774 37.059 27.086 1.00 0.00 O ATOM 785 NE2 GLN A 49 49.930 35.127 26.413 1.00 0.00 N ATOM 0 H GLN A 49 46.202 36.147 29.926 1.00 0.00 H new ATOM 0 HA GLN A 49 46.549 38.462 28.202 1.00 0.00 H new ATOM 0 HB2 GLN A 49 48.349 36.873 28.879 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.484 35.584 28.065 1.00 0.00 H new ATOM 0 HG2 GLN A 49 47.814 36.622 25.897 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.437 38.088 26.627 1.00 0.00 H new ATOM 0 HE21 GLN A 49 49.116 34.583 26.127 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.850 34.689 26.447 1.00 0.00 H new ATOM 794 N LEU A 50 45.153 37.996 26.255 1.00 0.00 N ATOM 795 CA LEU A 50 44.148 37.957 25.212 1.00 0.00 C ATOM 796 C LEU A 50 44.693 37.274 23.955 1.00 0.00 C ATOM 797 O LEU A 50 45.706 37.701 23.407 1.00 0.00 O ATOM 798 CB LEU A 50 43.663 39.375 24.925 1.00 0.00 C ATOM 799 CG LEU A 50 43.140 40.163 26.122 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.732 41.569 25.692 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.924 39.506 26.769 1.00 0.00 C ATOM 0 H LEU A 50 45.767 38.807 26.177 1.00 0.00 H new ATOM 0 HA LEU A 50 43.297 37.364 25.548 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.485 39.935 24.479 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.871 39.322 24.178 1.00 0.00 H new ATOM 0 HG LEU A 50 43.954 40.192 26.847 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.361 42.120 26.556 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.596 42.087 25.275 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.948 41.506 24.938 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.593 40.108 27.615 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.118 39.432 26.038 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.191 38.508 27.116 1.00 0.00 H new ATOM 813 N GLU A 51 44.018 36.227 23.492 1.00 0.00 N ATOM 814 CA GLU A 51 44.388 35.448 22.328 1.00 0.00 C ATOM 815 C GLU A 51 43.776 36.016 21.045 1.00 0.00 C ATOM 816 O GLU A 51 42.597 36.359 21.004 1.00 0.00 O ATOM 817 CB GLU A 51 43.985 33.983 22.478 1.00 0.00 C ATOM 818 CG GLU A 51 44.492 33.275 23.731 1.00 0.00 C ATOM 819 CD GLU A 51 43.436 32.290 24.234 1.00 0.00 C ATOM 820 OE1 GLU A 51 43.138 31.292 23.544 1.00 0.00 O ATOM 821 OE2 GLU A 51 42.803 32.550 25.280 1.00 0.00 O ATOM 0 H GLU A 51 43.166 35.889 23.939 1.00 0.00 H new ATOM 0 HA GLU A 51 45.474 35.508 22.253 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.897 33.923 22.466 1.00 0.00 H new ATOM 0 HB3 GLU A 51 44.344 33.437 21.606 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.420 32.747 23.511 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.718 34.007 24.507 1.00 0.00 H new ATOM 828 N ASP A 52 44.566 36.053 19.976 1.00 0.00 N ATOM 829 CA ASP A 52 44.284 36.662 18.692 1.00 0.00 C ATOM 830 C ASP A 52 43.010 36.180 17.995 1.00 0.00 C ATOM 831 O ASP A 52 42.392 36.939 17.251 1.00 0.00 O ATOM 832 CB ASP A 52 45.495 36.402 17.799 1.00 0.00 C ATOM 833 CG ASP A 52 46.747 37.107 18.324 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.079 38.213 17.844 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.402 36.579 19.248 1.00 0.00 O ATOM 0 H ASP A 52 45.491 35.623 19.993 1.00 0.00 H new ATOM 0 HA ASP A 52 44.103 37.722 18.872 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.679 35.329 17.739 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.281 36.746 16.787 1.00 0.00 H new ATOM 840 N GLY A 53 42.604 34.934 18.229 1.00 0.00 N ATOM 841 CA GLY A 53 41.507 34.275 17.549 1.00 0.00 C ATOM 842 C GLY A 53 40.089 34.708 17.923 1.00 0.00 C ATOM 843 O GLY A 53 39.157 34.280 17.243 1.00 0.00 O ATOM 0 H GLY A 53 43.052 34.338 18.926 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.634 34.427 16.477 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.592 33.204 17.731 1.00 0.00 H new ATOM 847 N ARG A 54 39.879 35.491 18.978 1.00 0.00 N ATOM 848 CA ARG A 54 38.563 35.815 19.492 1.00 0.00 C ATOM 849 C ARG A 54 38.296 37.321 19.542 1.00 0.00 C ATOM 850 O ARG A 54 39.211 38.129 19.407 1.00 0.00 O ATOM 851 CB ARG A 54 38.314 35.094 20.813 1.00 0.00 C ATOM 852 CG ARG A 54 38.432 33.578 20.679 1.00 0.00 C ATOM 853 CD ARG A 54 37.837 32.790 21.843 1.00 0.00 C ATOM 854 NE ARG A 54 38.486 33.043 23.130 1.00 0.00 N ATOM 855 CZ ARG A 54 39.682 32.601 23.539 1.00 0.00 C ATOM 856 NH1 ARG A 54 40.513 31.903 22.754 1.00 0.00 N ATOM 857 NH2 ARG A 54 40.095 32.848 24.790 1.00 0.00 N ATOM 0 H ARG A 54 40.637 35.923 19.506 1.00 0.00 H new ATOM 0 HA ARG A 54 37.822 35.441 18.785 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.028 35.447 21.557 1.00 0.00 H new ATOM 0 HB3 ARG A 54 37.320 35.347 21.180 1.00 0.00 H new ATOM 0 HG2 ARG A 54 37.939 33.268 19.758 1.00 0.00 H new ATOM 0 HG3 ARG A 54 39.485 33.316 20.580 1.00 0.00 H new ATOM 0 HD2 ARG A 54 36.778 33.033 21.928 1.00 0.00 H new ATOM 0 HD3 ARG A 54 37.903 31.725 21.618 1.00 0.00 H new ATOM 0 HE ARG A 54 37.968 33.622 23.791 1.00 0.00 H new ATOM 0 HH11 ARG A 54 40.245 31.685 21.794 1.00 0.00 H new ATOM 0 HH12 ARG A 54 41.414 31.590 23.116 1.00 0.00 H new ATOM 0 HH21 ARG A 54 39.498 33.372 25.430 1.00 0.00 H new ATOM 0 HH22 ARG A 54 41.006 32.512 25.102 1.00 0.00 H new ATOM 871 N THR A 55 37.025 37.691 19.673 1.00 0.00 N ATOM 872 CA THR A 55 36.554 39.062 19.636 1.00 0.00 C ATOM 873 C THR A 55 36.482 39.720 21.016 1.00 0.00 C ATOM 874 O THR A 55 36.420 39.028 22.030 1.00 0.00 O ATOM 875 CB THR A 55 35.206 39.212 18.939 1.00 0.00 C ATOM 876 OG1 THR A 55 34.175 38.588 19.671 1.00 0.00 O ATOM 877 CG2 THR A 55 35.183 38.654 17.519 1.00 0.00 C ATOM 0 H THR A 55 36.273 37.017 19.812 1.00 0.00 H new ATOM 0 HA THR A 55 37.311 39.583 19.049 1.00 0.00 H new ATOM 0 HB THR A 55 35.043 40.288 18.885 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.209 37.620 19.524 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.192 38.797 17.088 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.922 39.176 16.911 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.419 37.590 17.542 1.00 0.00 H new ATOM 885 N LEU A 56 36.422 41.047 21.077 1.00 0.00 N ATOM 886 CA LEU A 56 36.291 41.780 22.320 1.00 0.00 C ATOM 887 C LEU A 56 35.102 41.326 23.171 1.00 0.00 C ATOM 888 O LEU A 56 35.230 41.225 24.388 1.00 0.00 O ATOM 889 CB LEU A 56 36.211 43.279 22.049 1.00 0.00 C ATOM 890 CG LEU A 56 37.442 43.914 21.409 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.239 45.421 21.290 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.719 43.704 22.217 1.00 0.00 C ATOM 0 H LEU A 56 36.464 41.645 20.252 1.00 0.00 H new ATOM 0 HA LEU A 56 37.187 41.561 22.902 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.354 43.465 21.402 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.014 43.788 22.993 1.00 0.00 H new ATOM 0 HG LEU A 56 37.557 43.430 20.439 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.120 45.872 20.833 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.365 45.623 20.671 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.087 45.847 22.282 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.556 44.180 21.706 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.600 44.145 23.207 1.00 0.00 H new ATOM 0 HD23 LEU A 56 38.915 42.636 22.316 1.00 0.00 H new ATOM 904 N SER A 57 33.974 40.986 22.553 1.00 0.00 N ATOM 905 CA SER A 57 32.823 40.437 23.240 1.00 0.00 C ATOM 906 C SER A 57 32.959 38.969 23.648 1.00 0.00 C ATOM 907 O SER A 57 32.341 38.583 24.637 1.00 0.00 O ATOM 908 CB SER A 57 31.547 40.657 22.431 1.00 0.00 C ATOM 909 OG SER A 57 31.627 40.017 21.177 1.00 0.00 O ATOM 0 H SER A 57 33.838 41.088 21.547 1.00 0.00 H new ATOM 0 HA SER A 57 32.762 40.991 24.177 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.690 40.273 22.985 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.382 41.725 22.288 1.00 0.00 H new ATOM 0 HG SER A 57 32.124 40.584 20.551 1.00 0.00 H new ATOM 915 N ASP A 58 33.795 38.152 23.012 1.00 0.00 N ATOM 916 CA ASP A 58 34.158 36.848 23.531 1.00 0.00 C ATOM 917 C ASP A 58 34.931 36.957 24.847 1.00 0.00 C ATOM 918 O ASP A 58 34.866 36.053 25.677 1.00 0.00 O ATOM 919 CB ASP A 58 34.985 36.048 22.529 1.00 0.00 C ATOM 920 CG ASP A 58 34.244 35.681 21.240 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.225 34.960 21.306 1.00 0.00 O ATOM 922 OD2 ASP A 58 34.711 36.080 20.152 1.00 0.00 O ATOM 0 H ASP A 58 34.237 38.381 22.122 1.00 0.00 H new ATOM 0 HA ASP A 58 33.220 36.323 23.713 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.874 36.623 22.270 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.327 35.131 23.010 1.00 0.00 H new ATOM 927 N TYR A 59 35.627 38.068 25.066 1.00 0.00 N ATOM 928 CA TYR A 59 36.284 38.416 26.310 1.00 0.00 C ATOM 929 C TYR A 59 35.447 39.304 27.234 1.00 0.00 C ATOM 930 O TYR A 59 35.963 39.767 28.249 1.00 0.00 O ATOM 931 CB TYR A 59 37.647 39.037 26.017 1.00 0.00 C ATOM 932 CG TYR A 59 38.608 38.129 25.290 1.00 0.00 C ATOM 933 CD1 TYR A 59 38.905 38.354 23.941 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.207 37.063 25.973 1.00 0.00 C ATOM 935 CE1 TYR A 59 39.775 37.496 23.258 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.096 36.211 25.307 1.00 0.00 C ATOM 937 CZ TYR A 59 40.372 36.419 23.942 1.00 0.00 C ATOM 938 OH TYR A 59 41.217 35.572 23.286 1.00 0.00 O ATOM 0 H TYR A 59 35.751 38.779 24.345 1.00 0.00 H new ATOM 0 HA TYR A 59 36.417 37.488 26.865 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.500 39.939 25.423 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.101 39.345 26.959 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.461 39.193 23.425 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.982 36.898 27.016 1.00 0.00 H new ATOM 0 HE1 TYR A 59 39.987 37.659 22.212 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.568 35.398 25.838 1.00 0.00 H new ATOM 0 HH TYR A 59 41.604 36.031 22.511 1.00 0.00 H new ATOM 948 N ASN A 60 34.178 39.566 26.936 1.00 0.00 N ATOM 949 CA ASN A 60 33.314 40.429 27.715 1.00 0.00 C ATOM 950 C ASN A 60 33.883 41.823 27.985 1.00 0.00 C ATOM 951 O ASN A 60 33.614 42.412 29.030 1.00 0.00 O ATOM 952 CB ASN A 60 32.841 39.692 28.965 1.00 0.00 C ATOM 953 CG ASN A 60 31.889 38.526 28.690 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.152 38.505 27.707 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.820 37.561 29.602 1.00 0.00 N ATOM 0 H ASN A 60 33.714 39.168 26.119 1.00 0.00 H new ATOM 0 HA ASN A 60 32.438 40.652 27.106 1.00 0.00 H new ATOM 0 HB2 ASN A 60 33.712 39.315 29.501 1.00 0.00 H new ATOM 0 HB3 ASN A 60 32.344 40.403 29.625 1.00 0.00 H new ATOM 0 HD21 ASN A 60 31.153 36.798 29.488 1.00 0.00 H new ATOM 0 HD22 ASN A 60 32.434 37.584 30.416 1.00 0.00 H new ATOM 962 N ILE A 61 34.698 42.372 27.088 1.00 0.00 N ATOM 963 CA ILE A 61 35.321 43.669 27.255 1.00 0.00 C ATOM 964 C ILE A 61 34.298 44.766 26.953 1.00 0.00 C ATOM 965 O ILE A 61 33.780 44.852 25.841 1.00 0.00 O ATOM 966 CB ILE A 61 36.597 43.788 26.426 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.634 42.767 26.887 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.181 45.195 26.515 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.855 42.628 25.983 1.00 0.00 C ATOM 0 H ILE A 61 34.944 41.914 26.211 1.00 0.00 H new ATOM 0 HA ILE A 61 35.639 43.791 28.291 1.00 0.00 H new ATOM 0 HB ILE A 61 36.337 43.586 25.387 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.971 43.041 27.887 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.150 41.794 26.970 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.089 45.251 25.915 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.454 45.915 26.140 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.418 45.426 27.554 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.531 41.879 26.397 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.537 42.319 24.987 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.371 43.586 25.918 1.00 0.00 H new ATOM 981 N GLN A 62 34.023 45.604 27.948 1.00 0.00 N ATOM 982 CA GLN A 62 33.113 46.729 27.863 1.00 0.00 C ATOM 983 C GLN A 62 33.824 48.038 27.511 1.00 0.00 C ATOM 984 O GLN A 62 35.037 48.157 27.658 1.00 0.00 O ATOM 985 CB GLN A 62 32.327 46.854 29.165 1.00 0.00 C ATOM 986 CG GLN A 62 31.466 45.631 29.466 1.00 0.00 C ATOM 987 CD GLN A 62 30.447 45.863 30.584 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.305 46.952 31.135 1.00 0.00 O ATOM 989 NE2 GLN A 62 29.634 44.869 30.929 1.00 0.00 N ATOM 0 H GLN A 62 34.448 45.509 28.870 1.00 0.00 H new ATOM 0 HA GLN A 62 32.420 46.536 27.044 1.00 0.00 H new ATOM 0 HB2 GLN A 62 33.023 47.012 29.989 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.689 47.736 29.114 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.938 45.336 28.559 1.00 0.00 H new ATOM 0 HG3 GLN A 62 32.114 44.799 29.742 1.00 0.00 H new ATOM 0 HE21 GLN A 62 29.730 43.955 30.487 1.00 0.00 H new ATOM 0 HE22 GLN A 62 28.914 45.021 31.636 1.00 0.00 H new ATOM 998 N LYS A 63 33.062 49.035 27.069 1.00 0.00 N ATOM 999 CA LYS A 63 33.542 50.360 26.731 1.00 0.00 C ATOM 1000 C LYS A 63 34.363 51.008 27.848 1.00 0.00 C ATOM 1001 O LYS A 63 34.129 50.761 29.029 1.00 0.00 O ATOM 1002 CB LYS A 63 32.365 51.254 26.349 1.00 0.00 C ATOM 1003 CG LYS A 63 31.504 51.688 27.531 1.00 0.00 C ATOM 1004 CD LYS A 63 30.279 52.475 27.073 1.00 0.00 C ATOM 1005 CE LYS A 63 29.488 53.010 28.264 1.00 0.00 C ATOM 1006 NZ LYS A 63 30.048 54.258 28.806 1.00 0.00 N ATOM 0 H LYS A 63 32.056 48.932 26.933 1.00 0.00 H new ATOM 0 HA LYS A 63 34.216 50.247 25.882 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.746 52.142 25.845 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.738 50.724 25.632 1.00 0.00 H new ATOM 0 HG2 LYS A 63 31.184 50.809 28.091 1.00 0.00 H new ATOM 0 HG3 LYS A 63 32.098 52.300 28.210 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.593 53.305 26.440 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.639 51.835 26.466 1.00 0.00 H new ATOM 0 HE2 LYS A 63 28.455 53.182 27.961 1.00 0.00 H new ATOM 0 HE3 LYS A 63 29.468 52.255 29.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 29.606 54.467 29.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 31.075 54.151 28.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 29.860 55.039 28.145 1.00 0.00 H new ATOM 1020 N GLU A 64 35.289 51.886 27.475 1.00 0.00 N ATOM 1021 CA GLU A 64 36.078 52.707 28.372 1.00 0.00 C ATOM 1022 C GLU A 64 36.987 51.910 29.309 1.00 0.00 C ATOM 1023 O GLU A 64 37.455 52.421 30.324 1.00 0.00 O ATOM 1024 CB GLU A 64 35.202 53.737 29.078 1.00 0.00 C ATOM 1025 CG GLU A 64 34.337 54.530 28.101 1.00 0.00 C ATOM 1026 CD GLU A 64 33.444 55.553 28.805 1.00 0.00 C ATOM 1027 OE1 GLU A 64 32.528 55.161 29.560 1.00 0.00 O ATOM 1028 OE2 GLU A 64 33.605 56.759 28.517 1.00 0.00 O ATOM 0 H GLU A 64 35.516 52.048 26.494 1.00 0.00 H new ATOM 0 HA GLU A 64 36.785 53.263 27.756 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.561 53.231 29.800 1.00 0.00 H new ATOM 0 HB3 GLU A 64 35.834 54.424 29.640 1.00 0.00 H new ATOM 0 HG2 GLU A 64 34.980 55.045 27.387 1.00 0.00 H new ATOM 0 HG3 GLU A 64 33.714 53.841 27.530 1.00 0.00 H new ATOM 1035 N SER A 65 37.266 50.659 28.955 1.00 0.00 N ATOM 1036 CA SER A 65 38.258 49.819 29.593 1.00 0.00 C ATOM 1037 C SER A 65 39.676 50.191 29.153 1.00 0.00 C ATOM 1038 O SER A 65 39.878 50.708 28.057 1.00 0.00 O ATOM 1039 CB SER A 65 37.986 48.342 29.322 1.00 0.00 C ATOM 1040 OG SER A 65 36.713 47.959 29.793 1.00 0.00 O ATOM 0 H SER A 65 36.786 50.191 28.186 1.00 0.00 H new ATOM 0 HA SER A 65 38.183 49.991 30.667 1.00 0.00 H new ATOM 0 HB2 SER A 65 38.053 48.148 28.251 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.752 47.735 29.804 1.00 0.00 H new ATOM 0 HG SER A 65 36.044 48.119 29.095 1.00 0.00 H new ATOM 1046 N THR A 66 40.657 49.901 30.003 1.00 0.00 N ATOM 1047 CA THR A 66 42.072 50.121 29.781 1.00 0.00 C ATOM 1048 C THR A 66 42.806 48.781 29.693 1.00 0.00 C ATOM 1049 O THR A 66 42.870 48.042 30.673 1.00 0.00 O ATOM 1050 CB THR A 66 42.678 50.978 30.888 1.00 0.00 C ATOM 1051 OG1 THR A 66 42.106 52.266 30.880 1.00 0.00 O ATOM 1052 CG2 THR A 66 44.176 51.216 30.708 1.00 0.00 C ATOM 0 H THR A 66 40.469 49.483 30.914 1.00 0.00 H new ATOM 0 HA THR A 66 42.186 50.656 28.838 1.00 0.00 H new ATOM 0 HB THR A 66 42.485 50.427 31.809 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.503 52.805 31.596 1.00 0.00 H new ATOM 0 HG21 THR A 66 44.548 51.832 31.527 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.699 50.260 30.707 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.352 51.727 29.761 1.00 0.00 H new ATOM 1060 N LEU A 67 43.380 48.485 28.531 1.00 0.00 N ATOM 1061 CA LEU A 67 44.139 47.278 28.269 1.00 0.00 C ATOM 1062 C LEU A 67 45.637 47.535 28.448 1.00 0.00 C ATOM 1063 O LEU A 67 46.116 48.605 28.079 1.00 0.00 O ATOM 1064 CB LEU A 67 43.840 46.747 26.870 1.00 0.00 C ATOM 1065 CG LEU A 67 42.385 46.756 26.408 1.00 0.00 C ATOM 1066 CD1 LEU A 67 42.284 46.076 25.045 1.00 0.00 C ATOM 1067 CD2 LEU A 67 41.415 46.029 27.334 1.00 0.00 C ATOM 0 H LEU A 67 43.325 49.103 27.722 1.00 0.00 H new ATOM 0 HA LEU A 67 43.837 46.518 28.990 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.423 47.331 26.157 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.204 45.721 26.815 1.00 0.00 H new ATOM 0 HG LEU A 67 42.100 47.808 26.389 1.00 0.00 H new ATOM 0 HD11 LEU A 67 41.246 46.081 24.712 1.00 0.00 H new ATOM 0 HD12 LEU A 67 42.899 46.614 24.324 1.00 0.00 H new ATOM 0 HD13 LEU A 67 42.635 45.047 25.125 1.00 0.00 H new ATOM 0 HD21 LEU A 67 40.407 46.089 26.924 1.00 0.00 H new ATOM 0 HD22 LEU A 67 41.710 44.983 27.421 1.00 0.00 H new ATOM 0 HD23 LEU A 67 41.434 46.495 28.319 1.00 0.00 H new ATOM 1079 N HIS A 68 46.392 46.564 28.956 1.00 0.00 N ATOM 1080 CA HIS A 68 47.833 46.658 29.063 1.00 0.00 C ATOM 1081 C HIS A 68 48.535 46.043 27.850 1.00 0.00 C ATOM 1082 O HIS A 68 48.199 44.938 27.430 1.00 0.00 O ATOM 1083 CB HIS A 68 48.330 46.045 30.370 1.00 0.00 C ATOM 1084 CG HIS A 68 48.040 46.879 31.587 1.00 0.00 C ATOM 1085 ND1 HIS A 68 47.271 46.477 32.678 1.00 0.00 N ATOM 1086 CD2 HIS A 68 48.541 48.131 31.837 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.306 47.492 33.545 1.00 0.00 C ATOM 1088 NE2 HIS A 68 48.063 48.498 33.079 1.00 0.00 N ATOM 0 H HIS A 68 46.011 45.685 29.306 1.00 0.00 H new ATOM 0 HA HIS A 68 48.090 47.717 29.076 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.871 45.064 30.497 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.406 45.887 30.299 1.00 0.00 H new ATOM 0 HD2 HIS A 68 49.181 48.713 31.191 1.00 0.00 H new ATOM 0 HE1 HIS A 68 46.793 47.502 34.495 1.00 0.00 H new ATOM 0 HE2 HIS A 68 48.252 49.378 33.558 1.00 0.00 H new ATOM 1096 N LEU A 69 49.533 46.746 27.321 1.00 0.00 N ATOM 1097 CA LEU A 69 50.331 46.338 26.183 1.00 0.00 C ATOM 1098 C LEU A 69 51.756 45.988 26.618 1.00 0.00 C ATOM 1099 O LEU A 69 52.452 46.813 27.205 1.00 0.00 O ATOM 1100 CB LEU A 69 50.283 47.455 25.145 1.00 0.00 C ATOM 1101 CG LEU A 69 51.159 47.267 23.909 1.00 0.00 C ATOM 1102 CD1 LEU A 69 50.822 46.015 23.106 1.00 0.00 C ATOM 1103 CD2 LEU A 69 50.996 48.471 22.984 1.00 0.00 C ATOM 0 H LEU A 69 49.814 47.653 27.694 1.00 0.00 H new ATOM 0 HA LEU A 69 49.928 45.431 25.733 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.250 47.574 24.818 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.572 48.387 25.631 1.00 0.00 H new ATOM 0 HG LEU A 69 52.181 47.164 24.275 1.00 0.00 H new ATOM 0 HD11 LEU A 69 51.484 45.947 22.243 1.00 0.00 H new ATOM 0 HD12 LEU A 69 50.953 45.134 23.734 1.00 0.00 H new ATOM 0 HD13 LEU A 69 49.788 46.068 22.766 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.621 48.339 22.101 1.00 0.00 H new ATOM 0 HD22 LEU A 69 49.953 48.558 22.681 1.00 0.00 H new ATOM 0 HD23 LEU A 69 51.298 49.377 23.509 1.00 0.00 H new ATOM 1115 N VAL A 70 52.196 44.776 26.292 1.00 0.00 N ATOM 1116 CA VAL A 70 53.480 44.199 26.636 1.00 0.00 C ATOM 1117 C VAL A 70 54.292 43.945 25.364 1.00 0.00 C ATOM 1118 O VAL A 70 53.756 43.437 24.382 1.00 0.00 O ATOM 1119 CB VAL A 70 53.283 42.917 27.440 1.00 0.00 C ATOM 1120 CG1 VAL A 70 54.611 42.286 27.847 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.479 43.166 28.713 1.00 0.00 C ATOM 0 H VAL A 70 51.623 44.134 25.745 1.00 0.00 H new ATOM 0 HA VAL A 70 54.037 44.898 27.259 1.00 0.00 H new ATOM 0 HB VAL A 70 52.740 42.240 26.781 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.422 41.376 28.417 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.187 42.042 26.954 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.175 42.988 28.461 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.360 42.229 29.257 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.004 43.886 29.340 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.497 43.561 28.452 1.00 0.00 H new