USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 547 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 60 ASN : amide:sc= 0.796 K(o=1.7,f=-1.5) USER MOD Set 1.2: A 62 GLN : amide:sc= 0.919 K(o=1.7,f=-0.56) USER MOD Set 2.1: A 55 THR OG1 : rot 124:sc= 0.214 USER MOD Set 2.2: A 57 SER OG : rot -82:sc= 1.33 USER MOD Set 3.1: A 14 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 33 LYS NZ :NH3+ 179:sc= 1.24 (180deg=1.23) USER MOD Single : A 1 MET CE :methyl -177:sc= 0 (180deg=-0.00464) USER MOD Single : A 1 MET N :NH3+ -170:sc= 2.08 (180deg=1.79) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -138:sc= 0.874 (180deg=0.503) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00524 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.181 USER MOD Single : A 25 ASN : amide:sc= -0.522 K(o=-0.52,f=-3!) USER MOD Single : A 27 LYS NZ :NH3+ -119:sc= 0.523 (180deg=-0.104!) USER MOD Single : A 29 LYS NZ :NH3+ 171:sc= 1.39 (180deg=1.21) USER MOD Single : A 31 GLN : amide:sc= -0.028 K(o=-0.028,f=-0.74) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 41 GLN : amide:sc= 1.68 K(o=1.7,f=-2.9!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.5 K(o=0.5,f=-2.9!) USER MOD Single : A 59 TYR OH : rot 30:sc= 0.394 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 91:sc= 0.0294 USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.241 USER MOD Single : A 68 HIS : no HD1:sc= -0.0546 X(o=-0.055,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 33.140 52.104 19.700 1.00 0.00 N ATOM 2 CA MET A 1 33.450 52.427 21.102 1.00 0.00 C ATOM 3 C MET A 1 34.940 52.739 21.260 1.00 0.00 C ATOM 4 O MET A 1 35.762 52.187 20.532 1.00 0.00 O ATOM 5 CB MET A 1 33.002 51.333 22.066 1.00 0.00 C ATOM 6 CG MET A 1 33.716 49.995 21.900 1.00 0.00 C ATOM 7 SD MET A 1 33.274 48.757 23.144 1.00 0.00 S ATOM 8 CE MET A 1 34.432 47.439 22.697 1.00 0.00 C ATOM 0 H1 MET A 1 32.109 52.061 19.574 1.00 0.00 H new ATOM 0 H2 MET A 1 33.535 52.839 19.079 1.00 0.00 H new ATOM 0 H3 MET A 1 33.557 51.183 19.455 1.00 0.00 H new ATOM 0 HA MET A 1 32.880 53.318 21.366 1.00 0.00 H new ATOM 0 HB2 MET A 1 33.154 51.685 23.087 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.931 51.174 21.939 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.490 49.596 20.911 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.792 50.163 21.938 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.259 46.571 23.334 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.281 47.160 21.654 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.454 47.791 22.834 1.00 0.00 H new ATOM 20 N GLN A 2 35.294 53.568 22.239 1.00 0.00 N ATOM 21 CA GLN A 2 36.672 53.807 22.614 1.00 0.00 C ATOM 22 C GLN A 2 37.097 52.919 23.786 1.00 0.00 C ATOM 23 O GLN A 2 36.387 52.814 24.783 1.00 0.00 O ATOM 24 CB GLN A 2 36.951 55.281 22.894 1.00 0.00 C ATOM 25 CG GLN A 2 36.701 56.170 21.679 1.00 0.00 C ATOM 26 CD GLN A 2 37.611 57.400 21.652 1.00 0.00 C ATOM 27 OE1 GLN A 2 38.591 57.440 20.912 1.00 0.00 O ATOM 28 NE2 GLN A 2 37.332 58.437 22.437 1.00 0.00 N ATOM 0 H GLN A 2 34.621 54.094 22.795 1.00 0.00 H new ATOM 0 HA GLN A 2 37.284 53.532 21.755 1.00 0.00 H new ATOM 0 HB2 GLN A 2 36.322 55.615 23.719 1.00 0.00 H new ATOM 0 HB3 GLN A 2 37.986 55.396 23.216 1.00 0.00 H new ATOM 0 HG2 GLN A 2 36.855 55.588 20.770 1.00 0.00 H new ATOM 0 HG3 GLN A 2 35.660 56.493 21.678 1.00 0.00 H new ATOM 0 HE21 GLN A 2 36.519 58.407 23.052 1.00 0.00 H new ATOM 0 HE22 GLN A 2 37.931 59.263 22.424 1.00 0.00 H new ATOM 37 N ILE A 3 38.290 52.338 23.686 1.00 0.00 N ATOM 38 CA ILE A 3 38.997 51.693 24.773 1.00 0.00 C ATOM 39 C ILE A 3 40.320 52.415 25.042 1.00 0.00 C ATOM 40 O ILE A 3 40.684 53.334 24.313 1.00 0.00 O ATOM 41 CB ILE A 3 39.174 50.198 24.526 1.00 0.00 C ATOM 42 CG1 ILE A 3 40.055 49.897 23.317 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.815 49.512 24.419 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.474 48.436 23.192 1.00 0.00 C ATOM 0 H ILE A 3 38.806 52.306 22.807 1.00 0.00 H new ATOM 0 HA ILE A 3 38.393 51.770 25.677 1.00 0.00 H new ATOM 0 HB ILE A 3 39.702 49.788 25.387 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.521 50.188 22.412 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.951 50.516 23.372 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.958 48.446 24.243 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.261 49.655 25.347 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.253 49.944 23.591 1.00 0.00 H new ATOM 0 HD11 ILE A 3 41.097 48.311 22.307 1.00 0.00 H new ATOM 0 HD12 ILE A 3 41.038 48.142 24.077 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.587 47.809 23.103 1.00 0.00 H new ATOM 56 N PHE A 4 41.048 52.012 26.080 1.00 0.00 N ATOM 57 CA PHE A 4 42.401 52.459 26.341 1.00 0.00 C ATOM 58 C PHE A 4 43.407 51.316 26.193 1.00 0.00 C ATOM 59 O PHE A 4 43.116 50.188 26.588 1.00 0.00 O ATOM 60 CB PHE A 4 42.509 53.069 27.736 1.00 0.00 C ATOM 61 CG PHE A 4 41.586 54.233 28.007 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.928 55.520 27.574 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.399 54.035 28.721 1.00 0.00 C ATOM 64 CE1 PHE A 4 41.094 56.606 27.865 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.565 55.120 29.019 1.00 0.00 C ATOM 66 CZ PHE A 4 39.912 56.406 28.589 1.00 0.00 C ATOM 0 H PHE A 4 40.700 51.351 26.775 1.00 0.00 H new ATOM 0 HA PHE A 4 42.640 53.222 25.600 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.309 52.290 28.471 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.536 53.398 27.892 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.838 55.675 27.014 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.125 53.041 29.044 1.00 0.00 H new ATOM 0 HE1 PHE A 4 41.362 57.598 27.531 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.655 54.965 29.580 1.00 0.00 H new ATOM 0 HZ PHE A 4 39.269 57.243 28.815 1.00 0.00 H new ATOM 76 N VAL A 5 44.607 51.602 25.695 1.00 0.00 N ATOM 77 CA VAL A 5 45.745 50.706 25.706 1.00 0.00 C ATOM 78 C VAL A 5 46.897 51.396 26.438 1.00 0.00 C ATOM 79 O VAL A 5 47.225 52.536 26.116 1.00 0.00 O ATOM 80 CB VAL A 5 46.141 50.263 24.300 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.269 49.235 24.342 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.965 49.637 23.555 1.00 0.00 C ATOM 0 H VAL A 5 44.815 52.500 25.258 1.00 0.00 H new ATOM 0 HA VAL A 5 45.478 49.791 26.234 1.00 0.00 H new ATOM 0 HB VAL A 5 46.471 51.161 23.778 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.529 48.939 23.326 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.142 49.672 24.827 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.943 48.359 24.903 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.285 49.334 22.558 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.610 48.764 24.103 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.158 50.365 23.471 1.00 0.00 H new ATOM 92 N LYS A 6 47.472 50.744 27.444 1.00 0.00 N ATOM 93 CA LYS A 6 48.402 51.348 28.377 1.00 0.00 C ATOM 94 C LYS A 6 49.707 50.558 28.504 1.00 0.00 C ATOM 95 O LYS A 6 49.687 49.330 28.488 1.00 0.00 O ATOM 96 CB LYS A 6 47.724 51.564 29.726 1.00 0.00 C ATOM 97 CG LYS A 6 46.451 52.398 29.619 1.00 0.00 C ATOM 98 CD LYS A 6 45.874 52.816 30.968 1.00 0.00 C ATOM 99 CE LYS A 6 44.575 53.581 30.734 1.00 0.00 C ATOM 100 NZ LYS A 6 43.998 54.108 31.980 1.00 0.00 N ATOM 0 H LYS A 6 47.296 49.757 27.633 1.00 0.00 H new ATOM 0 HA LYS A 6 48.689 52.321 27.979 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.483 50.596 30.166 1.00 0.00 H new ATOM 0 HB3 LYS A 6 48.421 52.058 30.403 1.00 0.00 H new ATOM 0 HG2 LYS A 6 46.662 53.292 29.032 1.00 0.00 H new ATOM 0 HG3 LYS A 6 45.699 51.828 29.074 1.00 0.00 H new ATOM 0 HD2 LYS A 6 45.688 51.938 31.587 1.00 0.00 H new ATOM 0 HD3 LYS A 6 46.587 53.440 31.506 1.00 0.00 H new ATOM 0 HE2 LYS A 6 44.762 54.406 30.047 1.00 0.00 H new ATOM 0 HE3 LYS A 6 43.852 52.923 30.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 43.118 54.619 31.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 43.793 53.321 32.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 44.675 54.758 32.428 1.00 0.00 H new ATOM 168 N LYS A 11 52.705 55.702 28.416 1.00 0.00 N ATOM 169 CA LYS A 11 51.745 56.231 27.468 1.00 0.00 C ATOM 170 C LYS A 11 50.386 55.539 27.591 1.00 0.00 C ATOM 171 O LYS A 11 50.314 54.316 27.681 1.00 0.00 O ATOM 172 CB LYS A 11 52.298 56.114 26.050 1.00 0.00 C ATOM 173 CG LYS A 11 53.369 57.152 25.729 1.00 0.00 C ATOM 174 CD LYS A 11 54.048 56.940 24.379 1.00 0.00 C ATOM 175 CE LYS A 11 53.059 56.848 23.220 1.00 0.00 C ATOM 176 NZ LYS A 11 53.742 56.708 21.925 1.00 0.00 N ATOM 0 HA LYS A 11 51.584 57.284 27.697 1.00 0.00 H new ATOM 0 HB2 LYS A 11 52.716 55.117 25.912 1.00 0.00 H new ATOM 0 HB3 LYS A 11 51.478 56.217 25.339 1.00 0.00 H new ATOM 0 HG2 LYS A 11 52.917 58.144 25.746 1.00 0.00 H new ATOM 0 HG3 LYS A 11 54.126 57.133 26.513 1.00 0.00 H new ATOM 0 HD2 LYS A 11 54.740 57.761 24.194 1.00 0.00 H new ATOM 0 HD3 LYS A 11 54.641 56.026 24.417 1.00 0.00 H new ATOM 0 HE2 LYS A 11 52.397 55.996 23.375 1.00 0.00 H new ATOM 0 HE3 LYS A 11 52.433 57.740 23.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 53.272 57.308 21.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 54.735 57.001 22.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 53.703 55.715 21.617 1.00 0.00 H new ATOM 190 N THR A 12 49.317 56.323 27.487 1.00 0.00 N ATOM 191 CA THR A 12 47.945 55.869 27.365 1.00 0.00 C ATOM 192 C THR A 12 47.408 56.250 25.984 1.00 0.00 C ATOM 193 O THR A 12 47.355 57.426 25.631 1.00 0.00 O ATOM 194 CB THR A 12 47.073 56.444 28.476 1.00 0.00 C ATOM 195 OG1 THR A 12 47.424 55.861 29.710 1.00 0.00 O ATOM 196 CG2 THR A 12 45.584 56.167 28.287 1.00 0.00 C ATOM 0 H THR A 12 49.393 57.340 27.486 1.00 0.00 H new ATOM 0 HA THR A 12 47.918 54.784 27.469 1.00 0.00 H new ATOM 0 HB THR A 12 47.244 57.520 28.450 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.862 56.235 30.420 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.025 56.605 29.114 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.248 56.608 27.348 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.414 55.091 28.264 1.00 0.00 H new ATOM 204 N ILE A 13 46.996 55.248 25.212 1.00 0.00 N ATOM 205 CA ILE A 13 46.512 55.367 23.851 1.00 0.00 C ATOM 206 C ILE A 13 44.998 55.155 23.844 1.00 0.00 C ATOM 207 O ILE A 13 44.519 54.188 24.432 1.00 0.00 O ATOM 208 CB ILE A 13 47.209 54.343 22.959 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.730 54.343 23.088 1.00 0.00 C ATOM 210 CG2 ILE A 13 46.808 54.504 21.497 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.430 55.651 22.730 1.00 0.00 C ATOM 0 H ILE A 13 46.993 54.283 25.542 1.00 0.00 H new ATOM 0 HA ILE A 13 46.735 56.360 23.461 1.00 0.00 H new ATOM 0 HB ILE A 13 46.864 53.375 23.321 1.00 0.00 H new ATOM 0 HG12 ILE A 13 48.988 54.085 24.115 1.00 0.00 H new ATOM 0 HG13 ILE A 13 49.129 53.554 22.451 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.325 53.758 20.894 1.00 0.00 H new ATOM 0 HG22 ILE A 13 45.731 54.368 21.398 1.00 0.00 H new ATOM 0 HG23 ILE A 13 47.081 55.501 21.152 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.506 55.535 22.858 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.214 55.907 21.693 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.071 56.447 23.383 1.00 0.00 H new ATOM 223 N THR A 14 44.241 56.004 23.153 1.00 0.00 N ATOM 224 CA THR A 14 42.841 55.764 22.866 1.00 0.00 C ATOM 225 C THR A 14 42.706 54.964 21.570 1.00 0.00 C ATOM 226 O THR A 14 43.425 55.231 20.610 1.00 0.00 O ATOM 227 CB THR A 14 42.034 57.058 22.806 1.00 0.00 C ATOM 228 OG1 THR A 14 42.621 58.010 21.946 1.00 0.00 O ATOM 229 CG2 THR A 14 41.936 57.712 24.181 1.00 0.00 C ATOM 0 H THR A 14 44.592 56.884 22.776 1.00 0.00 H new ATOM 0 HA THR A 14 42.425 55.180 23.687 1.00 0.00 H new ATOM 0 HB THR A 14 41.049 56.772 22.436 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.073 58.822 21.935 1.00 0.00 H new ATOM 0 HG21 THR A 14 41.355 58.631 24.106 1.00 0.00 H new ATOM 0 HG22 THR A 14 41.446 57.029 24.875 1.00 0.00 H new ATOM 0 HG23 THR A 14 42.937 57.943 24.546 1.00 0.00 H new ATOM 237 N LEU A 15 41.815 53.976 21.530 1.00 0.00 N ATOM 238 CA LEU A 15 41.630 53.104 20.388 1.00 0.00 C ATOM 239 C LEU A 15 40.146 52.937 20.054 1.00 0.00 C ATOM 240 O LEU A 15 39.348 52.686 20.955 1.00 0.00 O ATOM 241 CB LEU A 15 42.309 51.766 20.674 1.00 0.00 C ATOM 242 CG LEU A 15 42.735 51.013 19.417 1.00 0.00 C ATOM 243 CD1 LEU A 15 44.045 51.559 18.856 1.00 0.00 C ATOM 244 CD2 LEU A 15 42.956 49.537 19.735 1.00 0.00 C ATOM 0 H LEU A 15 41.193 53.761 22.309 1.00 0.00 H new ATOM 0 HA LEU A 15 42.092 53.550 19.507 1.00 0.00 H new ATOM 0 HB2 LEU A 15 43.186 51.940 21.297 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.628 51.139 21.249 1.00 0.00 H new ATOM 0 HG LEU A 15 41.937 51.141 18.685 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.319 51.000 17.961 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.921 52.612 18.602 1.00 0.00 H new ATOM 0 HD13 LEU A 15 44.832 51.456 19.603 1.00 0.00 H new ATOM 0 HD21 LEU A 15 43.260 49.011 18.830 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.736 49.440 20.490 1.00 0.00 H new ATOM 0 HD23 LEU A 15 42.030 49.104 20.113 1.00 0.00 H new ATOM 256 N GLU A 16 39.780 53.038 18.780 1.00 0.00 N ATOM 257 CA GLU A 16 38.414 52.992 18.301 1.00 0.00 C ATOM 258 C GLU A 16 38.094 51.645 17.651 1.00 0.00 C ATOM 259 O GLU A 16 38.652 51.268 16.623 1.00 0.00 O ATOM 260 CB GLU A 16 38.165 54.186 17.385 1.00 0.00 C ATOM 261 CG GLU A 16 36.772 54.277 16.768 1.00 0.00 C ATOM 262 CD GLU A 16 35.640 54.440 17.784 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.577 55.488 18.463 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.765 53.551 17.863 1.00 0.00 O ATOM 0 H GLU A 16 40.458 53.159 18.028 1.00 0.00 H new ATOM 0 HA GLU A 16 37.724 53.072 19.141 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.350 55.098 17.952 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.897 54.158 16.578 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.748 55.120 16.077 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.589 53.378 16.180 1.00 0.00 H new ATOM 271 N VAL A 17 37.200 50.906 18.302 1.00 0.00 N ATOM 272 CA VAL A 17 36.925 49.501 18.082 1.00 0.00 C ATOM 273 C VAL A 17 35.428 49.197 18.150 1.00 0.00 C ATOM 274 O VAL A 17 34.653 49.957 18.728 1.00 0.00 O ATOM 275 CB VAL A 17 37.675 48.631 19.087 1.00 0.00 C ATOM 276 CG1 VAL A 17 39.188 48.725 18.917 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.335 48.967 20.536 1.00 0.00 C ATOM 0 H VAL A 17 36.617 51.301 19.040 1.00 0.00 H new ATOM 0 HA VAL A 17 37.275 49.265 17.077 1.00 0.00 H new ATOM 0 HB VAL A 17 37.344 47.615 18.873 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.677 48.089 19.654 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.463 48.396 17.915 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.507 49.757 19.060 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.899 48.315 21.203 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.594 50.006 20.739 1.00 0.00 H new ATOM 0 HG23 VAL A 17 36.268 48.820 20.703 1.00 0.00 H new ATOM 287 N GLU A 18 35.017 48.059 17.599 1.00 0.00 N ATOM 288 CA GLU A 18 33.702 47.486 17.804 1.00 0.00 C ATOM 289 C GLU A 18 33.797 46.236 18.682 1.00 0.00 C ATOM 290 O GLU A 18 34.783 45.510 18.573 1.00 0.00 O ATOM 291 CB GLU A 18 33.051 47.145 16.467 1.00 0.00 C ATOM 292 CG GLU A 18 32.783 48.343 15.561 1.00 0.00 C ATOM 293 CD GLU A 18 31.742 49.296 16.151 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.540 48.953 16.153 1.00 0.00 O ATOM 295 OE2 GLU A 18 32.112 50.385 16.643 1.00 0.00 O ATOM 0 H GLU A 18 35.608 47.500 16.983 1.00 0.00 H new ATOM 0 HA GLU A 18 33.081 48.224 18.312 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.692 46.442 15.936 1.00 0.00 H new ATOM 0 HB3 GLU A 18 32.107 46.634 16.658 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.714 48.884 15.393 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.440 47.991 14.588 1.00 0.00 H new ATOM 302 N PRO A 19 32.798 45.893 19.490 1.00 0.00 N ATOM 303 CA PRO A 19 32.749 44.636 20.210 1.00 0.00 C ATOM 304 C PRO A 19 32.883 43.389 19.334 1.00 0.00 C ATOM 305 O PRO A 19 33.264 42.326 19.820 1.00 0.00 O ATOM 306 CB PRO A 19 31.400 44.632 20.923 1.00 0.00 C ATOM 307 CG PRO A 19 31.074 46.110 21.114 1.00 0.00 C ATOM 308 CD PRO A 19 31.662 46.719 19.843 1.00 0.00 C ATOM 0 HA PRO A 19 33.603 44.581 20.885 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.637 44.129 20.329 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.456 44.110 21.878 1.00 0.00 H new ATOM 0 HG2 PRO A 19 30.001 46.286 21.195 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.533 46.518 22.015 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.925 46.732 19.040 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.968 47.752 20.011 1.00 0.00 H new ATOM 316 N SER A 20 32.585 43.509 18.043 1.00 0.00 N ATOM 317 CA SER A 20 32.729 42.483 17.030 1.00 0.00 C ATOM 318 C SER A 20 34.159 42.280 16.524 1.00 0.00 C ATOM 319 O SER A 20 34.403 41.289 15.840 1.00 0.00 O ATOM 320 CB SER A 20 31.807 42.823 15.864 1.00 0.00 C ATOM 321 OG SER A 20 32.143 44.084 15.328 1.00 0.00 O ATOM 0 H SER A 20 32.215 44.379 17.660 1.00 0.00 H new ATOM 0 HA SER A 20 32.456 41.538 17.499 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.888 42.058 15.092 1.00 0.00 H new ATOM 0 HB3 SER A 20 30.770 42.827 16.200 1.00 0.00 H new ATOM 0 HG SER A 20 31.546 44.291 14.579 1.00 0.00 H new ATOM 327 N ASP A 21 35.095 43.176 16.825 1.00 0.00 N ATOM 328 CA ASP A 21 36.466 43.111 16.358 1.00 0.00 C ATOM 329 C ASP A 21 37.229 41.967 17.030 1.00 0.00 C ATOM 330 O ASP A 21 37.110 41.726 18.230 1.00 0.00 O ATOM 331 CB ASP A 21 37.203 44.430 16.567 1.00 0.00 C ATOM 332 CG ASP A 21 36.735 45.595 15.692 1.00 0.00 C ATOM 333 OD1 ASP A 21 36.082 45.360 14.653 1.00 0.00 O ATOM 334 OD2 ASP A 21 37.076 46.758 16.001 1.00 0.00 O ATOM 0 H ASP A 21 34.910 43.986 17.416 1.00 0.00 H new ATOM 0 HA ASP A 21 36.423 42.918 15.286 1.00 0.00 H new ATOM 0 HB2 ASP A 21 37.101 44.721 17.613 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.265 44.265 16.384 1.00 0.00 H new ATOM 339 N THR A 22 38.051 41.275 16.247 1.00 0.00 N ATOM 340 CA THR A 22 38.965 40.251 16.714 1.00 0.00 C ATOM 341 C THR A 22 40.170 40.863 17.429 1.00 0.00 C ATOM 342 O THR A 22 40.589 41.978 17.120 1.00 0.00 O ATOM 343 CB THR A 22 39.445 39.356 15.574 1.00 0.00 C ATOM 344 OG1 THR A 22 40.093 40.121 14.582 1.00 0.00 O ATOM 345 CG2 THR A 22 38.295 38.599 14.917 1.00 0.00 C ATOM 0 H THR A 22 38.097 41.420 15.238 1.00 0.00 H new ATOM 0 HA THR A 22 38.409 39.638 17.423 1.00 0.00 H new ATOM 0 HB THR A 22 40.137 38.638 16.014 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.396 39.531 13.860 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.683 37.975 14.112 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.803 37.970 15.659 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.576 39.310 14.511 1.00 0.00 H new ATOM 353 N ILE A 23 40.795 40.117 18.335 1.00 0.00 N ATOM 354 CA ILE A 23 42.021 40.534 18.986 1.00 0.00 C ATOM 355 C ILE A 23 43.152 40.703 17.968 1.00 0.00 C ATOM 356 O ILE A 23 43.960 41.617 18.114 1.00 0.00 O ATOM 357 CB ILE A 23 42.351 39.588 20.136 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.344 39.677 21.279 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.763 39.774 20.684 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.248 41.007 22.021 1.00 0.00 C ATOM 0 H ILE A 23 40.459 39.202 18.636 1.00 0.00 H new ATOM 0 HA ILE A 23 41.886 41.520 19.431 1.00 0.00 H new ATOM 0 HB ILE A 23 42.290 38.593 19.696 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.358 39.441 20.880 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.588 38.902 22.005 1.00 0.00 H new ATOM 0 HG21 ILE A 23 43.932 39.071 21.499 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.488 39.592 19.891 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.878 40.793 21.054 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.496 40.932 22.807 1.00 0.00 H new ATOM 0 HD12 ILE A 23 42.214 41.246 22.465 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.965 41.794 21.322 1.00 0.00 H new ATOM 372 N GLU A 24 43.165 39.946 16.875 1.00 0.00 N ATOM 373 CA GLU A 24 44.048 40.178 15.749 1.00 0.00 C ATOM 374 C GLU A 24 43.851 41.549 15.098 1.00 0.00 C ATOM 375 O GLU A 24 44.828 42.246 14.837 1.00 0.00 O ATOM 376 CB GLU A 24 43.807 39.077 14.720 1.00 0.00 C ATOM 377 CG GLU A 24 44.763 39.134 13.532 1.00 0.00 C ATOM 378 CD GLU A 24 44.431 37.999 12.562 1.00 0.00 C ATOM 379 OE1 GLU A 24 43.577 38.198 11.671 1.00 0.00 O ATOM 380 OE2 GLU A 24 44.986 36.892 12.735 1.00 0.00 O ATOM 0 H GLU A 24 42.550 39.142 16.750 1.00 0.00 H new ATOM 0 HA GLU A 24 45.073 40.162 16.119 1.00 0.00 H new ATOM 0 HB2 GLU A 24 43.904 38.107 15.208 1.00 0.00 H new ATOM 0 HB3 GLU A 24 42.782 39.149 14.355 1.00 0.00 H new ATOM 0 HG2 GLU A 24 44.677 40.096 13.027 1.00 0.00 H new ATOM 0 HG3 GLU A 24 45.794 39.045 13.875 1.00 0.00 H new ATOM 387 N ASN A 25 42.609 41.963 14.863 1.00 0.00 N ATOM 388 CA ASN A 25 42.291 43.266 14.317 1.00 0.00 C ATOM 389 C ASN A 25 42.631 44.397 15.290 1.00 0.00 C ATOM 390 O ASN A 25 43.152 45.431 14.877 1.00 0.00 O ATOM 391 CB ASN A 25 40.822 43.280 13.903 1.00 0.00 C ATOM 392 CG ASN A 25 40.436 44.589 13.211 1.00 0.00 C ATOM 393 OD1 ASN A 25 39.796 45.466 13.788 1.00 0.00 O ATOM 394 ND2 ASN A 25 40.801 44.768 11.946 1.00 0.00 N ATOM 0 H ASN A 25 41.787 41.389 15.052 1.00 0.00 H new ATOM 0 HA ASN A 25 42.909 43.446 13.437 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.626 42.443 13.232 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.195 43.136 14.783 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.550 45.629 11.460 1.00 0.00 H new ATOM 0 HD22 ASN A 25 41.332 44.045 11.461 1.00 0.00 H new ATOM 401 N VAL A 26 42.444 44.193 16.591 1.00 0.00 N ATOM 402 CA VAL A 26 42.873 45.125 17.615 1.00 0.00 C ATOM 403 C VAL A 26 44.395 45.280 17.623 1.00 0.00 C ATOM 404 O VAL A 26 44.884 46.407 17.626 1.00 0.00 O ATOM 405 CB VAL A 26 42.321 44.722 18.979 1.00 0.00 C ATOM 406 CG1 VAL A 26 42.848 45.584 20.123 1.00 0.00 C ATOM 407 CG2 VAL A 26 40.801 44.852 18.986 1.00 0.00 C ATOM 0 H VAL A 26 41.983 43.362 16.963 1.00 0.00 H new ATOM 0 HA VAL A 26 42.462 46.107 17.380 1.00 0.00 H new ATOM 0 HB VAL A 26 42.646 43.694 19.136 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.416 45.244 21.064 1.00 0.00 H new ATOM 0 HG12 VAL A 26 43.934 45.500 20.171 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.571 46.624 19.952 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.416 44.562 19.964 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.523 45.885 18.778 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.377 44.201 18.221 1.00 0.00 H new ATOM 417 N LYS A 27 45.155 44.193 17.514 1.00 0.00 N ATOM 418 CA LYS A 27 46.597 44.231 17.373 1.00 0.00 C ATOM 419 C LYS A 27 47.033 44.962 16.101 1.00 0.00 C ATOM 420 O LYS A 27 48.001 45.719 16.140 1.00 0.00 O ATOM 421 CB LYS A 27 47.164 42.816 17.432 1.00 0.00 C ATOM 422 CG LYS A 27 47.061 42.220 18.833 1.00 0.00 C ATOM 423 CD LYS A 27 47.258 40.708 18.880 1.00 0.00 C ATOM 424 CE LYS A 27 48.674 40.281 18.501 1.00 0.00 C ATOM 425 NZ LYS A 27 48.850 38.836 18.713 1.00 0.00 N ATOM 0 H LYS A 27 44.773 43.247 17.522 1.00 0.00 H new ATOM 0 HA LYS A 27 47.003 44.803 18.207 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.628 42.181 16.727 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.208 42.830 17.119 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.805 42.693 19.474 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.083 42.462 19.249 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.032 40.348 19.884 1.00 0.00 H new ATOM 0 HD3 LYS A 27 46.547 40.233 18.204 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.867 40.528 17.457 1.00 0.00 H new ATOM 0 HE3 LYS A 27 49.399 40.833 19.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 49.601 38.677 19.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 47.960 38.425 19.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.114 38.383 17.815 1.00 0.00 H new ATOM 439 N ALA A 28 46.293 44.822 15.005 1.00 0.00 N ATOM 440 CA ALA A 28 46.521 45.556 13.776 1.00 0.00 C ATOM 441 C ALA A 28 46.238 47.054 13.904 1.00 0.00 C ATOM 442 O ALA A 28 46.996 47.868 13.383 1.00 0.00 O ATOM 443 CB ALA A 28 45.690 44.923 12.665 1.00 0.00 C ATOM 0 H ALA A 28 45.502 44.180 14.951 1.00 0.00 H new ATOM 0 HA ALA A 28 47.581 45.487 13.533 1.00 0.00 H new ATOM 0 HB1 ALA A 28 45.853 45.466 11.734 1.00 0.00 H new ATOM 0 HB2 ALA A 28 45.989 43.883 12.535 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.634 44.967 12.931 1.00 0.00 H new ATOM 449 N LYS A 29 45.196 47.442 14.633 1.00 0.00 N ATOM 450 CA LYS A 29 44.870 48.818 14.957 1.00 0.00 C ATOM 451 C LYS A 29 45.903 49.466 15.881 1.00 0.00 C ATOM 452 O LYS A 29 46.197 50.648 15.720 1.00 0.00 O ATOM 453 CB LYS A 29 43.474 48.884 15.569 1.00 0.00 C ATOM 454 CG LYS A 29 42.347 48.728 14.552 1.00 0.00 C ATOM 455 CD LYS A 29 40.983 48.706 15.235 1.00 0.00 C ATOM 456 CE LYS A 29 39.855 48.700 14.208 1.00 0.00 C ATOM 457 NZ LYS A 29 38.531 48.804 14.841 1.00 0.00 N ATOM 0 H LYS A 29 44.532 46.776 15.028 1.00 0.00 H new ATOM 0 HA LYS A 29 44.888 49.390 14.029 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.381 48.103 16.323 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.358 49.838 16.083 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.384 49.549 13.836 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.488 47.806 13.988 1.00 0.00 H new ATOM 0 HD2 LYS A 29 40.905 47.824 15.870 1.00 0.00 H new ATOM 0 HD3 LYS A 29 40.884 49.576 15.884 1.00 0.00 H new ATOM 0 HE2 LYS A 29 39.992 49.530 13.515 1.00 0.00 H new ATOM 0 HE3 LYS A 29 39.905 47.783 13.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 37.807 48.950 14.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.325 47.928 15.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.524 49.608 15.500 1.00 0.00 H new ATOM 471 N ILE A 30 46.475 48.707 16.812 1.00 0.00 N ATOM 472 CA ILE A 30 47.588 49.123 17.642 1.00 0.00 C ATOM 473 C ILE A 30 48.844 49.334 16.794 1.00 0.00 C ATOM 474 O ILE A 30 49.501 50.359 16.964 1.00 0.00 O ATOM 475 CB ILE A 30 47.800 48.152 18.799 1.00 0.00 C ATOM 476 CG1 ILE A 30 46.637 48.226 19.783 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.108 48.414 19.540 1.00 0.00 C ATOM 478 CD1 ILE A 30 46.575 47.066 20.771 1.00 0.00 C ATOM 0 H ILE A 30 46.162 47.757 17.011 1.00 0.00 H new ATOM 0 HA ILE A 30 47.353 50.087 18.094 1.00 0.00 H new ATOM 0 HB ILE A 30 47.852 47.153 18.365 1.00 0.00 H new ATOM 0 HG12 ILE A 30 46.708 49.160 20.341 1.00 0.00 H new ATOM 0 HG13 ILE A 30 45.703 48.260 19.222 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.214 47.698 20.355 1.00 0.00 H new ATOM 0 HG22 ILE A 30 49.945 48.306 18.850 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.100 49.426 19.945 1.00 0.00 H new ATOM 0 HD11 ILE A 30 45.719 47.197 21.433 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.471 46.128 20.225 1.00 0.00 H new ATOM 0 HD13 ILE A 30 47.491 47.042 21.362 1.00 0.00 H new ATOM 490 N GLN A 31 49.158 48.454 15.848 1.00 0.00 N ATOM 491 CA GLN A 31 50.248 48.680 14.921 1.00 0.00 C ATOM 492 C GLN A 31 50.015 49.943 14.090 1.00 0.00 C ATOM 493 O GLN A 31 50.919 50.768 13.982 1.00 0.00 O ATOM 494 CB GLN A 31 50.464 47.469 14.017 1.00 0.00 C ATOM 495 CG GLN A 31 51.718 47.646 13.167 1.00 0.00 C ATOM 496 CD GLN A 31 51.891 46.618 12.046 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.076 45.730 11.808 1.00 0.00 O ATOM 498 NE2 GLN A 31 52.986 46.715 11.298 1.00 0.00 N ATOM 0 H GLN A 31 48.665 47.572 15.708 1.00 0.00 H new ATOM 0 HA GLN A 31 51.154 48.827 15.509 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.554 46.568 14.624 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.597 47.333 13.371 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.702 48.643 12.726 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.590 47.600 13.819 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.669 47.448 11.487 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.143 46.056 10.535 1.00 0.00 H new ATOM 507 N ASP A 32 48.819 50.135 13.541 1.00 0.00 N ATOM 508 CA ASP A 32 48.504 51.286 12.720 1.00 0.00 C ATOM 509 C ASP A 32 48.756 52.604 13.456 1.00 0.00 C ATOM 510 O ASP A 32 49.333 53.518 12.872 1.00 0.00 O ATOM 511 CB ASP A 32 47.061 51.187 12.236 1.00 0.00 C ATOM 512 CG ASP A 32 46.712 52.223 11.165 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.316 52.199 10.071 1.00 0.00 O ATOM 514 OD2 ASP A 32 45.786 53.033 11.387 1.00 0.00 O ATOM 0 H ASP A 32 48.039 49.488 13.658 1.00 0.00 H new ATOM 0 HA ASP A 32 49.170 51.284 11.857 1.00 0.00 H new ATOM 0 HB2 ASP A 32 46.886 50.188 11.837 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.390 51.312 13.086 1.00 0.00 H new ATOM 519 N LYS A 33 48.386 52.694 14.731 1.00 0.00 N ATOM 520 CA LYS A 33 48.530 53.895 15.531 1.00 0.00 C ATOM 521 C LYS A 33 49.914 54.083 16.155 1.00 0.00 C ATOM 522 O LYS A 33 50.460 55.181 16.086 1.00 0.00 O ATOM 523 CB LYS A 33 47.386 53.948 16.539 1.00 0.00 C ATOM 524 CG LYS A 33 47.299 55.306 17.230 1.00 0.00 C ATOM 525 CD LYS A 33 45.930 55.514 17.871 1.00 0.00 C ATOM 526 CE LYS A 33 45.898 56.880 18.549 1.00 0.00 C ATOM 527 NZ LYS A 33 44.546 57.225 19.018 1.00 0.00 N ATOM 0 H LYS A 33 47.970 51.915 15.242 1.00 0.00 H new ATOM 0 HA LYS A 33 48.459 54.756 14.867 1.00 0.00 H new ATOM 0 HB2 LYS A 33 46.445 53.738 16.031 1.00 0.00 H new ATOM 0 HB3 LYS A 33 47.525 53.168 17.288 1.00 0.00 H new ATOM 0 HG2 LYS A 33 48.075 55.379 17.992 1.00 0.00 H new ATOM 0 HG3 LYS A 33 47.488 56.098 16.505 1.00 0.00 H new ATOM 0 HD2 LYS A 33 45.147 55.451 17.115 1.00 0.00 H new ATOM 0 HD3 LYS A 33 45.733 54.728 18.600 1.00 0.00 H new ATOM 0 HE2 LYS A 33 46.588 56.883 19.393 1.00 0.00 H new ATOM 0 HE3 LYS A 33 46.246 57.641 17.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 44.568 58.152 19.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 43.896 57.263 18.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.217 56.503 19.691 1.00 0.00 H new ATOM 541 N GLU A 34 50.524 53.051 16.731 1.00 0.00 N ATOM 542 CA GLU A 34 51.747 53.140 17.502 1.00 0.00 C ATOM 543 C GLU A 34 52.996 52.561 16.833 1.00 0.00 C ATOM 544 O GLU A 34 54.099 52.795 17.322 1.00 0.00 O ATOM 545 CB GLU A 34 51.522 52.510 18.873 1.00 0.00 C ATOM 546 CG GLU A 34 50.904 53.479 19.878 1.00 0.00 C ATOM 547 CD GLU A 34 51.915 54.526 20.350 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.924 54.156 20.988 1.00 0.00 O ATOM 549 OE2 GLU A 34 51.717 55.734 20.092 1.00 0.00 O ATOM 0 H GLU A 34 50.163 52.099 16.668 1.00 0.00 H new ATOM 0 HA GLU A 34 51.966 54.204 17.590 1.00 0.00 H new ATOM 0 HB2 GLU A 34 50.872 51.642 18.766 1.00 0.00 H new ATOM 0 HB3 GLU A 34 52.474 52.149 19.262 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.048 53.978 19.423 1.00 0.00 H new ATOM 0 HG3 GLU A 34 50.529 52.922 20.737 1.00 0.00 H new ATOM 556 N GLY A 35 52.872 51.824 15.733 1.00 0.00 N ATOM 557 CA GLY A 35 53.991 51.259 15.006 1.00 0.00 C ATOM 558 C GLY A 35 54.649 50.037 15.650 1.00 0.00 C ATOM 559 O GLY A 35 55.738 49.647 15.233 1.00 0.00 O ATOM 0 H GLY A 35 51.967 51.601 15.318 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.650 50.982 14.008 1.00 0.00 H new ATOM 0 HA3 GLY A 35 54.748 52.033 14.881 1.00 0.00 H new ATOM 563 N ILE A 36 54.020 49.428 16.651 1.00 0.00 N ATOM 564 CA ILE A 36 54.478 48.217 17.301 1.00 0.00 C ATOM 565 C ILE A 36 53.836 47.034 16.574 1.00 0.00 C ATOM 566 O ILE A 36 52.617 46.897 16.651 1.00 0.00 O ATOM 567 CB ILE A 36 54.126 48.227 18.787 1.00 0.00 C ATOM 568 CG1 ILE A 36 54.670 49.448 19.522 1.00 0.00 C ATOM 569 CG2 ILE A 36 54.643 46.957 19.457 1.00 0.00 C ATOM 570 CD1 ILE A 36 54.025 49.679 20.885 1.00 0.00 C ATOM 0 H ILE A 36 53.147 49.782 17.041 1.00 0.00 H new ATOM 0 HA ILE A 36 55.564 48.139 17.246 1.00 0.00 H new ATOM 0 HB ILE A 36 53.039 48.272 18.848 1.00 0.00 H new ATOM 0 HG12 ILE A 36 55.746 49.333 19.654 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.517 50.332 18.903 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.387 46.974 20.516 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.186 46.086 18.987 1.00 0.00 H new ATOM 0 HG23 ILE A 36 55.726 46.902 19.347 1.00 0.00 H new ATOM 0 HD11 ILE A 36 54.461 50.564 21.349 1.00 0.00 H new ATOM 0 HD12 ILE A 36 52.952 49.827 20.760 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.200 48.812 21.522 1.00 0.00 H new ATOM 582 N PRO A 37 54.572 46.187 15.861 1.00 0.00 N ATOM 583 CA PRO A 37 53.980 45.145 15.047 1.00 0.00 C ATOM 584 C PRO A 37 53.451 43.962 15.860 1.00 0.00 C ATOM 585 O PRO A 37 53.885 43.756 16.991 1.00 0.00 O ATOM 586 CB PRO A 37 55.055 44.750 14.038 1.00 0.00 C ATOM 587 CG PRO A 37 56.345 45.000 14.815 1.00 0.00 C ATOM 588 CD PRO A 37 56.003 46.239 15.637 1.00 0.00 C ATOM 0 HA PRO A 37 53.085 45.510 14.543 1.00 0.00 H new ATOM 0 HB2 PRO A 37 54.961 43.708 13.732 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.003 45.354 13.132 1.00 0.00 H new ATOM 0 HG2 PRO A 37 56.607 44.153 15.449 1.00 0.00 H new ATOM 0 HG3 PRO A 37 57.191 45.175 14.151 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.546 46.242 16.582 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.282 47.149 15.106 1.00 0.00 H new ATOM 596 N PRO A 38 52.517 43.175 15.334 1.00 0.00 N ATOM 597 CA PRO A 38 51.705 42.285 16.140 1.00 0.00 C ATOM 598 C PRO A 38 52.456 41.137 16.819 1.00 0.00 C ATOM 599 O PRO A 38 51.985 40.630 17.834 1.00 0.00 O ATOM 600 CB PRO A 38 50.611 41.751 15.220 1.00 0.00 C ATOM 601 CG PRO A 38 50.520 42.807 14.121 1.00 0.00 C ATOM 602 CD PRO A 38 51.983 43.219 13.988 1.00 0.00 C ATOM 0 HA PRO A 38 51.312 42.856 16.981 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.869 40.772 14.815 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.664 41.638 15.747 1.00 0.00 H new ATOM 0 HG2 PRO A 38 50.120 42.401 13.192 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.881 43.643 14.405 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.524 42.541 13.328 1.00 0.00 H new ATOM 0 HD3 PRO A 38 52.073 44.218 13.562 1.00 0.00 H new ATOM 610 N ASP A 39 53.626 40.757 16.316 1.00 0.00 N ATOM 611 CA ASP A 39 54.466 39.732 16.903 1.00 0.00 C ATOM 612 C ASP A 39 55.238 40.218 18.132 1.00 0.00 C ATOM 613 O ASP A 39 55.675 39.399 18.938 1.00 0.00 O ATOM 614 CB ASP A 39 55.432 39.206 15.845 1.00 0.00 C ATOM 615 CG ASP A 39 56.524 40.222 15.507 1.00 0.00 C ATOM 616 OD1 ASP A 39 56.202 41.263 14.895 1.00 0.00 O ATOM 617 OD2 ASP A 39 57.699 39.985 15.862 1.00 0.00 O ATOM 0 H ASP A 39 54.021 41.166 15.469 1.00 0.00 H new ATOM 0 HA ASP A 39 53.811 38.933 17.250 1.00 0.00 H new ATOM 0 HB2 ASP A 39 55.893 38.285 16.201 1.00 0.00 H new ATOM 0 HB3 ASP A 39 54.877 38.956 14.941 1.00 0.00 H new ATOM 622 N GLN A 40 55.428 41.526 18.284 1.00 0.00 N ATOM 623 CA GLN A 40 56.126 42.118 19.408 1.00 0.00 C ATOM 624 C GLN A 40 55.181 42.415 20.574 1.00 0.00 C ATOM 625 O GLN A 40 55.616 42.368 21.722 1.00 0.00 O ATOM 626 CB GLN A 40 56.845 43.389 18.961 1.00 0.00 C ATOM 627 CG GLN A 40 57.946 43.126 17.938 1.00 0.00 C ATOM 628 CD GLN A 40 58.690 44.398 17.528 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.836 45.356 18.286 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.194 44.482 16.300 1.00 0.00 N ATOM 0 H GLN A 40 55.091 42.214 17.611 1.00 0.00 H new ATOM 0 HA GLN A 40 56.860 41.396 19.766 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.118 44.079 18.534 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.277 43.880 19.833 1.00 0.00 H new ATOM 0 HG2 GLN A 40 58.658 42.412 18.352 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.510 42.664 17.052 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.088 43.703 15.651 1.00 0.00 H new ATOM 0 HE22 GLN A 40 59.687 45.326 16.008 1.00 0.00 H new ATOM 639 N GLN A 41 53.910 42.686 20.292 1.00 0.00 N ATOM 640 CA GLN A 41 52.880 42.982 21.267 1.00 0.00 C ATOM 641 C GLN A 41 52.551 41.773 22.145 1.00 0.00 C ATOM 642 O GLN A 41 52.459 40.654 21.646 1.00 0.00 O ATOM 643 CB GLN A 41 51.598 43.425 20.568 1.00 0.00 C ATOM 644 CG GLN A 41 51.693 44.692 19.722 1.00 0.00 C ATOM 645 CD GLN A 41 50.378 45.000 19.002 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.285 44.717 19.487 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.409 45.578 17.806 1.00 0.00 N ATOM 0 H GLN A 41 53.561 42.705 19.334 1.00 0.00 H new ATOM 0 HA GLN A 41 53.270 43.780 21.899 1.00 0.00 H new ATOM 0 HB2 GLN A 41 51.258 42.611 19.928 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.830 43.576 21.326 1.00 0.00 H new ATOM 0 HG2 GLN A 41 51.963 45.534 20.359 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.491 44.579 18.988 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.303 45.823 17.381 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.539 45.777 17.313 1.00 0.00 H new ATOM 656 N ARG A 42 52.265 42.000 23.424 1.00 0.00 N ATOM 657 CA ARG A 42 51.671 41.048 24.340 1.00 0.00 C ATOM 658 C ARG A 42 50.562 41.734 25.140 1.00 0.00 C ATOM 659 O ARG A 42 50.819 42.762 25.764 1.00 0.00 O ATOM 660 CB ARG A 42 52.782 40.478 25.218 1.00 0.00 C ATOM 661 CG ARG A 42 52.314 39.589 26.366 1.00 0.00 C ATOM 662 CD ARG A 42 53.534 39.054 27.110 1.00 0.00 C ATOM 663 NE ARG A 42 53.168 38.240 28.270 1.00 0.00 N ATOM 664 CZ ARG A 42 53.984 37.919 29.283 1.00 0.00 C ATOM 665 NH1 ARG A 42 55.254 38.337 29.353 1.00 0.00 N ATOM 666 NH2 ARG A 42 53.574 37.148 30.300 1.00 0.00 N ATOM 0 H ARG A 42 52.453 42.900 23.866 1.00 0.00 H new ATOM 0 HA ARG A 42 51.203 40.218 23.812 1.00 0.00 H new ATOM 0 HB2 ARG A 42 53.461 39.903 24.589 1.00 0.00 H new ATOM 0 HB3 ARG A 42 53.356 41.307 25.633 1.00 0.00 H new ATOM 0 HG2 ARG A 42 51.677 40.156 27.045 1.00 0.00 H new ATOM 0 HG3 ARG A 42 51.715 38.763 25.982 1.00 0.00 H new ATOM 0 HD2 ARG A 42 54.139 38.458 26.428 1.00 0.00 H new ATOM 0 HD3 ARG A 42 54.152 39.890 27.437 1.00 0.00 H new ATOM 0 HE ARG A 42 52.212 37.888 28.311 1.00 0.00 H new ATOM 0 HH11 ARG A 42 55.638 38.926 28.614 1.00 0.00 H new ATOM 0 HH12 ARG A 42 55.837 38.066 30.145 1.00 0.00 H new ATOM 0 HH21 ARG A 42 52.619 36.790 30.316 1.00 0.00 H new ATOM 0 HH22 ARG A 42 54.217 36.919 31.058 1.00 0.00 H new ATOM 680 N LEU A 43 49.348 41.192 25.098 1.00 0.00 N ATOM 681 CA LEU A 43 48.138 41.824 25.583 1.00 0.00 C ATOM 682 C LEU A 43 47.478 41.040 26.719 1.00 0.00 C ATOM 683 O LEU A 43 47.201 39.851 26.575 1.00 0.00 O ATOM 684 CB LEU A 43 47.162 42.002 24.423 1.00 0.00 C ATOM 685 CG LEU A 43 47.577 42.995 23.341 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.517 42.995 22.243 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.691 44.427 23.857 1.00 0.00 C ATOM 0 H LEU A 43 49.180 40.264 24.709 1.00 0.00 H new ATOM 0 HA LEU A 43 48.413 42.795 25.994 1.00 0.00 H new ATOM 0 HB2 LEU A 43 47.005 41.030 23.955 1.00 0.00 H new ATOM 0 HB3 LEU A 43 46.201 42.319 24.829 1.00 0.00 H new ATOM 0 HG LEU A 43 48.556 42.679 22.981 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.801 43.701 21.463 1.00 0.00 H new ATOM 0 HD12 LEU A 43 46.436 41.995 21.816 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.556 43.289 22.665 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.989 45.085 23.041 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.727 44.750 24.250 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.438 44.470 24.649 1.00 0.00 H new ATOM 699 N ILE A 44 47.189 41.720 27.826 1.00 0.00 N ATOM 700 CA ILE A 44 46.640 41.151 29.040 1.00 0.00 C ATOM 701 C ILE A 44 45.421 41.953 29.499 1.00 0.00 C ATOM 702 O ILE A 44 45.473 43.180 29.557 1.00 0.00 O ATOM 703 CB ILE A 44 47.701 41.059 30.133 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.997 40.420 29.644 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.167 40.291 31.340 1.00 0.00 C ATOM 706 CD1 ILE A 44 50.108 40.286 30.682 1.00 0.00 C ATOM 0 H ILE A 44 47.340 42.726 27.898 1.00 0.00 H new ATOM 0 HA ILE A 44 46.311 40.134 28.828 1.00 0.00 H new ATOM 0 HB ILE A 44 47.933 42.083 30.426 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.766 39.427 29.257 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.376 41.008 28.808 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.939 40.237 32.108 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.293 40.804 31.740 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.887 39.283 31.035 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.980 39.819 30.224 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.379 41.274 31.055 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.760 39.669 31.510 1.00 0.00 H new ATOM 718 N PHE A 45 44.331 41.273 29.844 1.00 0.00 N ATOM 719 CA PHE A 45 43.160 41.845 30.478 1.00 0.00 C ATOM 720 C PHE A 45 42.514 40.855 31.449 1.00 0.00 C ATOM 721 O PHE A 45 42.481 39.655 31.185 1.00 0.00 O ATOM 722 CB PHE A 45 42.160 42.310 29.424 1.00 0.00 C ATOM 723 CG PHE A 45 40.852 42.835 29.965 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.835 43.979 30.772 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.649 42.183 29.673 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.628 44.463 31.291 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.438 42.670 30.178 1.00 0.00 C ATOM 728 CZ PHE A 45 38.426 43.808 30.993 1.00 0.00 C ATOM 0 H PHE A 45 44.242 40.270 29.681 1.00 0.00 H new ATOM 0 HA PHE A 45 43.477 42.711 31.058 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.626 43.091 28.824 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.949 41.477 28.754 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.759 44.491 30.996 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.655 41.298 29.054 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.624 45.341 31.921 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.512 42.168 29.939 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.493 44.180 31.391 1.00 0.00 H new ATOM 738 N ALA A 46 42.007 41.344 32.578 1.00 0.00 N ATOM 739 CA ALA A 46 41.525 40.546 33.687 1.00 0.00 C ATOM 740 C ALA A 46 42.511 39.454 34.108 1.00 0.00 C ATOM 741 O ALA A 46 42.138 38.306 34.337 1.00 0.00 O ATOM 742 CB ALA A 46 40.106 40.065 33.401 1.00 0.00 C ATOM 0 H ALA A 46 41.920 42.346 32.745 1.00 0.00 H new ATOM 0 HA ALA A 46 41.464 41.173 34.576 1.00 0.00 H new ATOM 0 HB1 ALA A 46 39.749 39.466 34.239 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.451 40.925 33.265 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.103 39.460 32.494 1.00 0.00 H new ATOM 748 N GLY A 47 43.795 39.800 34.135 1.00 0.00 N ATOM 749 CA GLY A 47 44.897 38.940 34.517 1.00 0.00 C ATOM 750 C GLY A 47 45.327 37.888 33.493 1.00 0.00 C ATOM 751 O GLY A 47 46.325 37.212 33.735 1.00 0.00 O ATOM 0 H GLY A 47 44.104 40.737 33.877 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.758 39.569 34.743 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.626 38.427 35.440 1.00 0.00 H new ATOM 755 N LYS A 48 44.627 37.719 32.375 1.00 0.00 N ATOM 756 CA LYS A 48 44.853 36.658 31.413 1.00 0.00 C ATOM 757 C LYS A 48 45.318 37.199 30.058 1.00 0.00 C ATOM 758 O LYS A 48 44.923 38.289 29.652 1.00 0.00 O ATOM 759 CB LYS A 48 43.595 35.807 31.269 1.00 0.00 C ATOM 760 CG LYS A 48 43.071 35.163 32.549 1.00 0.00 C ATOM 761 CD LYS A 48 44.040 34.207 33.237 1.00 0.00 C ATOM 762 CE LYS A 48 43.361 33.535 34.428 1.00 0.00 C ATOM 763 NZ LYS A 48 44.212 32.509 35.052 1.00 0.00 N ATOM 0 H LYS A 48 43.863 38.340 32.110 1.00 0.00 H new ATOM 0 HA LYS A 48 45.660 36.029 31.789 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.805 36.430 30.850 1.00 0.00 H new ATOM 0 HB3 LYS A 48 43.796 35.017 30.545 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.804 35.953 33.251 1.00 0.00 H new ATOM 0 HG3 LYS A 48 42.155 34.621 32.316 1.00 0.00 H new ATOM 0 HD2 LYS A 48 44.381 33.451 32.529 1.00 0.00 H new ATOM 0 HD3 LYS A 48 44.923 34.751 33.572 1.00 0.00 H new ATOM 0 HE2 LYS A 48 43.104 34.291 35.170 1.00 0.00 H new ATOM 0 HE3 LYS A 48 42.427 33.079 34.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 43.708 32.082 35.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 44.437 31.773 34.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 45.093 32.947 35.389 1.00 0.00 H new ATOM 777 N GLN A 49 46.143 36.429 29.354 1.00 0.00 N ATOM 778 CA GLN A 49 46.602 36.769 28.023 1.00 0.00 C ATOM 779 C GLN A 49 45.489 36.582 26.990 1.00 0.00 C ATOM 780 O GLN A 49 44.732 35.617 27.069 1.00 0.00 O ATOM 781 CB GLN A 49 47.832 35.952 27.639 1.00 0.00 C ATOM 782 CG GLN A 49 48.985 36.074 28.631 1.00 0.00 C ATOM 783 CD GLN A 49 50.298 35.544 28.052 1.00 0.00 C ATOM 784 OE1 GLN A 49 51.191 36.302 27.683 1.00 0.00 O ATOM 785 NE2 GLN A 49 50.473 34.233 27.926 1.00 0.00 N ATOM 0 H GLN A 49 46.512 35.544 29.701 1.00 0.00 H new ATOM 0 HA GLN A 49 46.883 37.822 28.032 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.548 34.903 27.553 1.00 0.00 H new ATOM 0 HB3 GLN A 49 48.176 36.271 26.655 1.00 0.00 H new ATOM 0 HG2 GLN A 49 49.110 37.119 28.915 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.741 35.524 29.540 1.00 0.00 H new ATOM 0 HE21 GLN A 49 49.741 33.590 28.228 1.00 0.00 H new ATOM 0 HE22 GLN A 49 51.339 33.870 27.528 1.00 0.00 H new ATOM 794 N LEU A 50 45.384 37.480 26.014 1.00 0.00 N ATOM 795 CA LEU A 50 44.315 37.477 25.035 1.00 0.00 C ATOM 796 C LEU A 50 44.708 36.821 23.709 1.00 0.00 C ATOM 797 O LEU A 50 45.822 36.998 23.222 1.00 0.00 O ATOM 798 CB LEU A 50 43.780 38.890 24.817 1.00 0.00 C ATOM 799 CG LEU A 50 43.346 39.634 26.076 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.641 40.917 25.644 1.00 0.00 C ATOM 801 CD2 LEU A 50 42.402 38.841 26.974 1.00 0.00 C ATOM 0 H LEU A 50 46.052 38.239 25.884 1.00 0.00 H new ATOM 0 HA LEU A 50 43.518 36.859 25.448 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.550 39.477 24.317 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.929 38.836 24.138 1.00 0.00 H new ATOM 0 HG LEU A 50 44.245 39.823 26.663 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.319 41.470 26.526 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.328 41.531 25.061 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.772 40.667 25.035 1.00 0.00 H new ATOM 0 HD21 LEU A 50 42.141 39.440 27.847 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.496 38.592 26.421 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.893 37.923 27.298 1.00 0.00 H new ATOM 813 N GLU A 51 43.791 36.061 23.117 1.00 0.00 N ATOM 814 CA GLU A 51 44.024 35.222 21.959 1.00 0.00 C ATOM 815 C GLU A 51 43.356 35.772 20.697 1.00 0.00 C ATOM 816 O GLU A 51 42.141 35.957 20.646 1.00 0.00 O ATOM 817 CB GLU A 51 43.587 33.800 22.298 1.00 0.00 C ATOM 818 CG GLU A 51 44.211 32.713 21.428 1.00 0.00 C ATOM 819 CD GLU A 51 43.438 32.434 20.138 1.00 0.00 C ATOM 820 OE1 GLU A 51 42.495 31.613 20.161 1.00 0.00 O ATOM 821 OE2 GLU A 51 43.833 32.962 19.077 1.00 0.00 O ATOM 0 H GLU A 51 42.828 36.015 23.449 1.00 0.00 H new ATOM 0 HA GLU A 51 45.088 35.214 21.722 1.00 0.00 H new ATOM 0 HB2 GLU A 51 43.834 33.598 23.340 1.00 0.00 H new ATOM 0 HB3 GLU A 51 42.502 33.738 22.210 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.230 33.005 21.174 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.278 31.792 22.007 1.00 0.00 H new ATOM 828 N ASP A 52 44.169 36.034 19.678 1.00 0.00 N ATOM 829 CA ASP A 52 43.868 36.615 18.385 1.00 0.00 C ATOM 830 C ASP A 52 42.578 36.175 17.689 1.00 0.00 C ATOM 831 O ASP A 52 41.961 36.992 17.010 1.00 0.00 O ATOM 832 CB ASP A 52 45.041 36.279 17.468 1.00 0.00 C ATOM 833 CG ASP A 52 46.315 37.042 17.836 1.00 0.00 C ATOM 834 OD1 ASP A 52 46.770 36.933 18.995 1.00 0.00 O ATOM 835 OD2 ASP A 52 46.870 37.750 16.969 1.00 0.00 O ATOM 0 H ASP A 52 45.163 35.818 19.753 1.00 0.00 H new ATOM 0 HA ASP A 52 43.712 37.677 18.576 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.238 35.208 17.514 1.00 0.00 H new ATOM 0 HB3 ASP A 52 44.769 36.509 16.438 1.00 0.00 H new ATOM 840 N GLY A 53 42.178 34.914 17.824 1.00 0.00 N ATOM 841 CA GLY A 53 40.978 34.358 17.232 1.00 0.00 C ATOM 842 C GLY A 53 39.669 34.728 17.931 1.00 0.00 C ATOM 843 O GLY A 53 38.604 34.493 17.364 1.00 0.00 O ATOM 0 H GLY A 53 42.704 34.231 18.370 1.00 0.00 H new ATOM 0 HA2 GLY A 53 40.921 34.685 16.194 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.069 33.272 17.220 1.00 0.00 H new ATOM 847 N ARG A 54 39.715 35.267 19.147 1.00 0.00 N ATOM 848 CA ARG A 54 38.558 35.706 19.902 1.00 0.00 C ATOM 849 C ARG A 54 38.263 37.184 19.643 1.00 0.00 C ATOM 850 O ARG A 54 39.096 37.904 19.099 1.00 0.00 O ATOM 851 CB ARG A 54 38.767 35.438 21.390 1.00 0.00 C ATOM 852 CG ARG A 54 39.309 34.066 21.781 1.00 0.00 C ATOM 853 CD ARG A 54 38.488 32.881 21.280 1.00 0.00 C ATOM 854 NE ARG A 54 37.176 32.811 21.923 1.00 0.00 N ATOM 855 CZ ARG A 54 35.991 32.567 21.347 1.00 0.00 C ATOM 856 NH1 ARG A 54 35.817 32.297 20.046 1.00 0.00 N ATOM 857 NH2 ARG A 54 34.895 32.594 22.118 1.00 0.00 N ATOM 0 H ARG A 54 40.593 35.413 19.646 1.00 0.00 H new ATOM 0 HA ARG A 54 37.691 35.136 19.569 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.450 36.194 21.777 1.00 0.00 H new ATOM 0 HB3 ARG A 54 37.813 35.581 21.897 1.00 0.00 H new ATOM 0 HG2 ARG A 54 40.326 33.971 21.399 1.00 0.00 H new ATOM 0 HG3 ARG A 54 39.370 34.013 22.868 1.00 0.00 H new ATOM 0 HD2 ARG A 54 38.359 32.960 20.201 1.00 0.00 H new ATOM 0 HD3 ARG A 54 39.034 31.956 21.469 1.00 0.00 H new ATOM 0 HE ARG A 54 37.161 32.967 22.931 1.00 0.00 H new ATOM 0 HH11 ARG A 54 36.621 32.267 19.419 1.00 0.00 H new ATOM 0 HH12 ARG A 54 34.880 32.122 19.682 1.00 0.00 H new ATOM 0 HH21 ARG A 54 34.977 32.796 23.114 1.00 0.00 H new ATOM 0 HH22 ARG A 54 33.979 32.412 21.708 1.00 0.00 H new ATOM 871 N THR A 55 37.080 37.643 20.045 1.00 0.00 N ATOM 872 CA THR A 55 36.644 39.017 19.906 1.00 0.00 C ATOM 873 C THR A 55 36.641 39.796 21.223 1.00 0.00 C ATOM 874 O THR A 55 36.683 39.213 22.304 1.00 0.00 O ATOM 875 CB THR A 55 35.273 39.122 19.243 1.00 0.00 C ATOM 876 OG1 THR A 55 34.287 38.547 20.072 1.00 0.00 O ATOM 877 CG2 THR A 55 35.194 38.446 17.878 1.00 0.00 C ATOM 0 H THR A 55 36.383 37.045 20.489 1.00 0.00 H new ATOM 0 HA THR A 55 37.388 39.478 19.257 1.00 0.00 H new ATOM 0 HB THR A 55 35.102 40.188 19.096 1.00 0.00 H new ATOM 0 HG1 THR A 55 33.587 39.208 20.254 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.190 38.564 17.471 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.915 38.906 17.202 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.421 37.385 17.984 1.00 0.00 H new ATOM 885 N LEU A 56 36.551 41.119 21.134 1.00 0.00 N ATOM 886 CA LEU A 56 36.369 41.984 22.282 1.00 0.00 C ATOM 887 C LEU A 56 35.110 41.636 23.079 1.00 0.00 C ATOM 888 O LEU A 56 35.163 41.602 24.306 1.00 0.00 O ATOM 889 CB LEU A 56 36.347 43.442 21.830 1.00 0.00 C ATOM 890 CG LEU A 56 37.671 44.005 21.326 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.485 45.476 20.964 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.777 43.939 22.376 1.00 0.00 C ATOM 0 H LEU A 56 36.604 41.622 20.248 1.00 0.00 H new ATOM 0 HA LEU A 56 37.213 41.829 22.955 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.606 43.545 21.037 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.008 44.056 22.665 1.00 0.00 H new ATOM 0 HG LEU A 56 37.963 43.400 20.468 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.429 45.884 20.603 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.729 45.566 20.184 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.164 46.030 21.846 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.697 44.353 21.962 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.481 44.516 23.253 1.00 0.00 H new ATOM 0 HD23 LEU A 56 38.944 42.901 22.664 1.00 0.00 H new ATOM 904 N SER A 57 34.007 41.307 22.413 1.00 0.00 N ATOM 905 CA SER A 57 32.793 40.838 23.052 1.00 0.00 C ATOM 906 C SER A 57 32.939 39.476 23.732 1.00 0.00 C ATOM 907 O SER A 57 32.341 39.279 24.788 1.00 0.00 O ATOM 908 CB SER A 57 31.613 40.828 22.084 1.00 0.00 C ATOM 909 OG SER A 57 31.895 40.144 20.884 1.00 0.00 O ATOM 0 H SER A 57 33.936 41.362 21.397 1.00 0.00 H new ATOM 0 HA SER A 57 32.592 41.559 23.844 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.755 40.362 22.569 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.330 41.855 21.853 1.00 0.00 H new ATOM 0 HG SER A 57 32.378 40.740 20.274 1.00 0.00 H new ATOM 915 N ASP A 58 33.762 38.562 23.227 1.00 0.00 N ATOM 916 CA ASP A 58 34.026 37.299 23.886 1.00 0.00 C ATOM 917 C ASP A 58 34.766 37.493 25.211 1.00 0.00 C ATOM 918 O ASP A 58 34.391 36.897 26.218 1.00 0.00 O ATOM 919 CB ASP A 58 34.815 36.347 22.992 1.00 0.00 C ATOM 920 CG ASP A 58 34.099 35.994 21.685 1.00 0.00 C ATOM 921 OD1 ASP A 58 32.879 35.727 21.696 1.00 0.00 O ATOM 922 OD2 ASP A 58 34.770 36.004 20.631 1.00 0.00 O ATOM 0 H ASP A 58 34.263 38.682 22.347 1.00 0.00 H new ATOM 0 HA ASP A 58 33.053 36.854 24.094 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.779 36.798 22.757 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.018 35.429 23.544 1.00 0.00 H new ATOM 927 N TYR A 59 35.760 38.375 25.244 1.00 0.00 N ATOM 928 CA TYR A 59 36.463 38.770 26.448 1.00 0.00 C ATOM 929 C TYR A 59 35.735 39.818 27.292 1.00 0.00 C ATOM 930 O TYR A 59 36.261 40.225 28.325 1.00 0.00 O ATOM 931 CB TYR A 59 37.884 39.204 26.100 1.00 0.00 C ATOM 932 CG TYR A 59 38.804 38.083 25.678 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.047 37.017 26.552 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.451 38.136 24.437 1.00 0.00 C ATOM 935 CE1 TYR A 59 39.913 35.980 26.185 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.349 37.125 24.077 1.00 0.00 C ATOM 937 CZ TYR A 59 40.568 36.032 24.939 1.00 0.00 C ATOM 938 OH TYR A 59 41.418 35.037 24.554 1.00 0.00 O ATOM 0 H TYR A 59 36.104 38.845 24.407 1.00 0.00 H new ATOM 0 HA TYR A 59 36.501 37.889 27.089 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.838 39.939 25.296 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.318 39.705 26.965 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.563 36.994 27.517 1.00 0.00 H new ATOM 0 HD2 TYR A 59 39.257 38.955 23.760 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.078 35.147 26.852 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.876 37.183 23.136 1.00 0.00 H new ATOM 0 HH TYR A 59 41.134 34.190 24.957 1.00 0.00 H new ATOM 948 N ASN A 60 34.531 40.232 26.907 1.00 0.00 N ATOM 949 CA ASN A 60 33.697 41.175 27.625 1.00 0.00 C ATOM 950 C ASN A 60 34.389 42.508 27.917 1.00 0.00 C ATOM 951 O ASN A 60 34.327 43.060 29.012 1.00 0.00 O ATOM 952 CB ASN A 60 33.064 40.467 28.819 1.00 0.00 C ATOM 953 CG ASN A 60 31.795 41.144 29.342 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.382 42.214 28.902 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.102 40.484 30.267 1.00 0.00 N ATOM 0 H ASN A 60 34.096 39.901 26.046 1.00 0.00 H new ATOM 0 HA ASN A 60 32.877 41.501 26.985 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.826 39.441 28.536 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.794 40.414 29.626 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.223 40.866 30.615 1.00 0.00 H new ATOM 0 HD22 ASN A 60 31.450 39.596 30.628 1.00 0.00 H new ATOM 962 N ILE A 61 35.081 43.015 26.901 1.00 0.00 N ATOM 963 CA ILE A 61 35.727 44.311 26.870 1.00 0.00 C ATOM 964 C ILE A 61 34.704 45.342 26.387 1.00 0.00 C ATOM 965 O ILE A 61 33.997 45.098 25.412 1.00 0.00 O ATOM 966 CB ILE A 61 36.991 44.246 26.017 1.00 0.00 C ATOM 967 CG1 ILE A 61 38.018 43.320 26.661 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.575 45.641 25.814 1.00 0.00 C ATOM 969 CD1 ILE A 61 39.111 42.834 25.712 1.00 0.00 C ATOM 0 H ILE A 61 35.210 42.498 26.031 1.00 0.00 H new ATOM 0 HA ILE A 61 36.060 44.618 27.862 1.00 0.00 H new ATOM 0 HB ILE A 61 36.728 43.843 25.039 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.485 43.841 27.497 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.500 42.454 27.074 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.475 45.573 25.203 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.842 46.272 25.311 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.825 46.075 26.782 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.798 42.182 26.251 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.659 42.283 24.888 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.658 43.690 25.318 1.00 0.00 H new ATOM 981 N GLN A 62 34.597 46.468 27.086 1.00 0.00 N ATOM 982 CA GLN A 62 33.550 47.458 26.931 1.00 0.00 C ATOM 983 C GLN A 62 34.130 48.869 26.803 1.00 0.00 C ATOM 984 O GLN A 62 35.324 49.074 27.004 1.00 0.00 O ATOM 985 CB GLN A 62 32.608 47.371 28.128 1.00 0.00 C ATOM 986 CG GLN A 62 31.955 46.007 28.328 1.00 0.00 C ATOM 987 CD GLN A 62 31.005 45.963 29.527 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.637 46.975 30.119 1.00 0.00 O ATOM 989 NE2 GLN A 62 30.565 44.775 29.929 1.00 0.00 N ATOM 0 H GLN A 62 35.272 46.722 27.808 1.00 0.00 H new ATOM 0 HA GLN A 62 33.000 47.252 26.013 1.00 0.00 H new ATOM 0 HB2 GLN A 62 33.164 47.628 29.030 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.825 48.120 28.012 1.00 0.00 H new ATOM 0 HG2 GLN A 62 31.404 45.739 27.426 1.00 0.00 H new ATOM 0 HG3 GLN A 62 32.733 45.255 28.461 1.00 0.00 H new ATOM 0 HE21 GLN A 62 30.865 43.929 29.444 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.928 44.709 30.723 1.00 0.00 H new ATOM 998 N LYS A 63 33.293 49.858 26.504 1.00 0.00 N ATOM 999 CA LYS A 63 33.697 51.246 26.404 1.00 0.00 C ATOM 1000 C LYS A 63 34.393 51.755 27.668 1.00 0.00 C ATOM 1001 O LYS A 63 33.947 51.492 28.783 1.00 0.00 O ATOM 1002 CB LYS A 63 32.532 52.137 25.986 1.00 0.00 C ATOM 1003 CG LYS A 63 31.410 52.323 27.003 1.00 0.00 C ATOM 1004 CD LYS A 63 30.307 53.181 26.390 1.00 0.00 C ATOM 1005 CE LYS A 63 29.093 53.319 27.304 1.00 0.00 C ATOM 1006 NZ LYS A 63 29.332 54.247 28.420 1.00 0.00 N ATOM 0 H LYS A 63 32.300 49.709 26.323 1.00 0.00 H new ATOM 0 HA LYS A 63 34.445 51.298 25.613 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.929 53.120 25.735 1.00 0.00 H new ATOM 0 HB3 LYS A 63 32.099 51.725 25.074 1.00 0.00 H new ATOM 0 HG2 LYS A 63 31.009 51.354 27.300 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.797 52.798 27.905 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.704 54.172 26.168 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.995 52.742 25.442 1.00 0.00 H new ATOM 0 HE2 LYS A 63 28.241 53.668 26.721 1.00 0.00 H new ATOM 0 HE3 LYS A 63 28.827 52.339 27.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 28.478 54.306 29.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 30.128 53.902 28.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 29.559 55.190 28.045 1.00 0.00 H new ATOM 1020 N GLU A 64 35.493 52.481 27.487 1.00 0.00 N ATOM 1021 CA GLU A 64 36.365 53.002 28.519 1.00 0.00 C ATOM 1022 C GLU A 64 37.070 51.971 29.402 1.00 0.00 C ATOM 1023 O GLU A 64 37.651 52.349 30.418 1.00 0.00 O ATOM 1024 CB GLU A 64 35.692 54.108 29.327 1.00 0.00 C ATOM 1025 CG GLU A 64 35.130 55.237 28.467 1.00 0.00 C ATOM 1026 CD GLU A 64 34.783 56.471 29.301 1.00 0.00 C ATOM 1027 OE1 GLU A 64 34.195 56.336 30.396 1.00 0.00 O ATOM 1028 OE2 GLU A 64 35.093 57.593 28.843 1.00 0.00 O ATOM 0 H GLU A 64 35.814 52.734 26.552 1.00 0.00 H new ATOM 0 HA GLU A 64 37.191 53.441 27.960 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.884 53.675 29.917 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.414 54.523 30.031 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.859 55.508 27.703 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.238 54.888 27.947 1.00 0.00 H new ATOM 1035 N SER A 65 37.082 50.695 29.030 1.00 0.00 N ATOM 1036 CA SER A 65 37.932 49.690 29.634 1.00 0.00 C ATOM 1037 C SER A 65 39.381 49.800 29.154 1.00 0.00 C ATOM 1038 O SER A 65 39.658 50.408 28.122 1.00 0.00 O ATOM 1039 CB SER A 65 37.381 48.287 29.393 1.00 0.00 C ATOM 1040 OG SER A 65 36.073 48.174 29.908 1.00 0.00 O ATOM 0 H SER A 65 36.488 50.330 28.286 1.00 0.00 H new ATOM 0 HA SER A 65 37.933 49.875 30.708 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.377 48.070 28.325 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.029 47.549 29.866 1.00 0.00 H new ATOM 0 HG SER A 65 35.425 48.407 29.210 1.00 0.00 H new ATOM 1046 N THR A 66 40.317 49.226 29.905 1.00 0.00 N ATOM 1047 CA THR A 66 41.741 49.269 29.642 1.00 0.00 C ATOM 1048 C THR A 66 42.282 47.903 29.212 1.00 0.00 C ATOM 1049 O THR A 66 41.946 46.876 29.798 1.00 0.00 O ATOM 1050 CB THR A 66 42.495 49.798 30.859 1.00 0.00 C ATOM 1051 OG1 THR A 66 42.318 51.195 30.934 1.00 0.00 O ATOM 1052 CG2 THR A 66 44.005 49.586 30.841 1.00 0.00 C ATOM 0 H THR A 66 40.088 48.698 30.747 1.00 0.00 H new ATOM 0 HA THR A 66 41.902 49.955 28.810 1.00 0.00 H new ATOM 0 HB THR A 66 42.083 49.237 31.698 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.798 51.544 31.714 1.00 0.00 H new ATOM 0 HG21 THR A 66 44.441 49.999 31.751 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.222 48.519 30.786 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.433 50.088 29.973 1.00 0.00 H new ATOM 1060 N LEU A 67 43.173 47.917 28.225 1.00 0.00 N ATOM 1061 CA LEU A 67 44.030 46.819 27.826 1.00 0.00 C ATOM 1062 C LEU A 67 45.461 47.107 28.288 1.00 0.00 C ATOM 1063 O LEU A 67 45.959 48.211 28.085 1.00 0.00 O ATOM 1064 CB LEU A 67 43.947 46.637 26.314 1.00 0.00 C ATOM 1065 CG LEU A 67 43.658 45.223 25.819 1.00 0.00 C ATOM 1066 CD1 LEU A 67 44.602 44.178 26.409 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.222 44.800 26.115 1.00 0.00 C ATOM 0 H LEU A 67 43.320 48.748 27.652 1.00 0.00 H new ATOM 0 HA LEU A 67 43.705 45.889 28.292 1.00 0.00 H new ATOM 0 HB2 LEU A 67 43.170 47.299 25.932 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.890 46.967 25.877 1.00 0.00 H new ATOM 0 HG LEU A 67 43.817 45.265 24.741 1.00 0.00 H new ATOM 0 HD11 LEU A 67 44.345 43.193 26.018 1.00 0.00 H new ATOM 0 HD12 LEU A 67 45.629 44.420 26.136 1.00 0.00 H new ATOM 0 HD13 LEU A 67 44.507 44.174 27.495 1.00 0.00 H new ATOM 0 HD21 LEU A 67 42.058 43.787 25.746 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.049 44.827 27.191 1.00 0.00 H new ATOM 0 HD23 LEU A 67 41.532 45.483 25.619 1.00 0.00 H new ATOM 1079 N HIS A 68 46.143 46.120 28.860 1.00 0.00 N ATOM 1080 CA HIS A 68 47.511 46.255 29.317 1.00 0.00 C ATOM 1081 C HIS A 68 48.449 45.652 28.270 1.00 0.00 C ATOM 1082 O HIS A 68 48.269 44.505 27.867 1.00 0.00 O ATOM 1083 CB HIS A 68 47.675 45.630 30.700 1.00 0.00 C ATOM 1084 CG HIS A 68 46.690 46.134 31.718 1.00 0.00 C ATOM 1085 ND1 HIS A 68 46.898 47.189 32.605 1.00 0.00 N ATOM 1086 CD2 HIS A 68 45.410 45.671 31.886 1.00 0.00 C ATOM 1087 CE1 HIS A 68 45.748 47.357 33.263 1.00 0.00 C ATOM 1088 NE2 HIS A 68 44.830 46.466 32.854 1.00 0.00 N ATOM 0 H HIS A 68 45.750 45.192 29.019 1.00 0.00 H new ATOM 0 HA HIS A 68 47.773 47.307 29.427 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.572 44.548 30.613 1.00 0.00 H new ATOM 0 HB3 HIS A 68 48.685 45.826 31.059 1.00 0.00 H new ATOM 0 HD2 HIS A 68 44.947 44.847 31.364 1.00 0.00 H new ATOM 0 HE1 HIS A 68 45.579 48.107 34.021 1.00 0.00 H new ATOM 0 HE2 HIS A 68 43.873 46.390 33.198 1.00 0.00 H new ATOM 1096 N LEU A 69 49.422 46.435 27.811 1.00 0.00 N ATOM 1097 CA LEU A 69 50.358 46.086 26.761 1.00 0.00 C ATOM 1098 C LEU A 69 51.789 46.059 27.298 1.00 0.00 C ATOM 1099 O LEU A 69 52.211 46.977 27.998 1.00 0.00 O ATOM 1100 CB LEU A 69 50.172 47.067 25.607 1.00 0.00 C ATOM 1101 CG LEU A 69 51.196 47.013 24.478 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.200 45.692 23.713 1.00 0.00 C ATOM 1103 CD2 LEU A 69 50.907 48.113 23.460 1.00 0.00 C ATOM 0 H LEU A 69 49.581 47.372 28.182 1.00 0.00 H new ATOM 0 HA LEU A 69 50.162 45.080 26.390 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.185 46.900 25.177 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.174 48.077 26.018 1.00 0.00 H new ATOM 0 HG LEU A 69 52.165 47.136 24.961 1.00 0.00 H new ATOM 0 HD11 LEU A 69 51.954 45.729 22.926 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.430 44.876 24.398 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.219 45.526 23.268 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.643 48.068 22.657 1.00 0.00 H new ATOM 0 HD22 LEU A 69 49.909 47.972 23.046 1.00 0.00 H new ATOM 0 HD23 LEU A 69 50.963 49.085 23.949 1.00 0.00 H new ATOM 1115 N VAL A 70 52.548 45.033 26.922 1.00 0.00 N ATOM 1116 CA VAL A 70 53.988 44.939 27.046 1.00 0.00 C ATOM 1117 C VAL A 70 54.584 44.383 25.751 1.00 0.00 C ATOM 1118 O VAL A 70 53.860 43.842 24.917 1.00 0.00 O ATOM 1119 CB VAL A 70 54.415 44.114 28.256 1.00 0.00 C ATOM 1120 CG1 VAL A 70 53.862 44.645 29.575 1.00 0.00 C ATOM 1121 CG2 VAL A 70 54.047 42.636 28.156 1.00 0.00 C ATOM 0 H VAL A 70 52.143 44.198 26.498 1.00 0.00 H new ATOM 0 HA VAL A 70 54.377 45.944 27.212 1.00 0.00 H new ATOM 0 HB VAL A 70 55.501 44.212 28.249 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.204 44.012 30.394 1.00 0.00 H new ATOM 0 HG12 VAL A 70 54.214 45.665 29.733 1.00 0.00 H new ATOM 0 HG13 VAL A 70 52.773 44.638 29.542 1.00 0.00 H new ATOM 0 HG21 VAL A 70 54.383 42.116 29.053 1.00 0.00 H new ATOM 0 HG22 VAL A 70 52.966 42.536 28.062 1.00 0.00 H new ATOM 0 HG23 VAL A 70 54.529 42.199 27.281 1.00 0.00 H new