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= 0.781 K(o=1.7,f=0.33) USER MOD Set 1.2: A 62 GLN : amide:sc= 0.965 K(o=1.7,f=0.33) USER MOD Set 2.1: A 55 THR OG1 : rot -68:sc= 1.87 USER MOD Set 2.2: A 57 SER OG : rot -36:sc= 0.813 USER MOD Set 3.1: A 6 LYS NZ :NH3+ -163:sc= 0.745 (180deg=-0.0123) USER MOD Set 3.2: A 12 THR OG1 : rot 180:sc= 0.885 USER MOD Single : A 1 MET CE :methyl -165:sc= 0 (180deg=-0.119) USER MOD Single : A 1 MET N :NH3+ -166:sc= 2.32 (180deg=1.9) USER MOD Single : A 2 GLN : amide:sc= 0.844 K(o=0.84,f=-0.31) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -94:sc= 0.102 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00937 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.562 USER MOD Single : A 25 ASN : amide:sc= 0.963 K(o=0.96,f=-0.17) USER MOD Single : A 27 LYS NZ :NH3+ -165:sc= 0.894 (180deg=0.565) USER MOD Single : A 29 LYS NZ :NH3+ 151:sc= 1.24 (180deg=0.98) USER MOD Single : A 31 GLN : amide:sc= -0.818 X(o=-0.82,f=-1.1) USER MOD Single : A 33 LYS NZ :NH3+ -174:sc= 1.25 (180deg=1.22) USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 41 GLN : amide:sc= 1.16 K(o=1.2,f=-2.7!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 2.36 K(o=2.4,f=-5.9!) USER MOD Single : A 59 TYR OH : rot 80:sc= 0.114 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 106:sc= 1.25 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.992 52.013 19.740 1.00 0.00 N ATOM 2 CA MET A 1 33.317 52.319 21.141 1.00 0.00 C ATOM 3 C MET A 1 34.799 52.667 21.294 1.00 0.00 C ATOM 4 O MET A 1 35.636 52.142 20.563 1.00 0.00 O ATOM 5 CB MET A 1 32.913 51.201 22.097 1.00 0.00 C ATOM 6 CG MET A 1 33.653 49.885 21.872 1.00 0.00 C ATOM 7 SD MET A 1 33.382 48.624 23.141 1.00 0.00 S ATOM 8 CE MET A 1 34.627 47.422 22.610 1.00 0.00 C ATOM 0 H1 MET A 1 31.960 52.014 19.615 1.00 0.00 H new ATOM 0 H2 MET A 1 33.416 52.732 19.120 1.00 0.00 H new ATOM 0 H3 MET A 1 33.370 51.076 19.493 1.00 0.00 H new ATOM 0 HA MET A 1 32.726 53.192 21.418 1.00 0.00 H new ATOM 0 HB2 MET A 1 33.088 51.533 23.120 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.842 51.024 21.998 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.352 49.477 20.907 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.721 50.093 21.811 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.440 46.465 23.097 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.573 47.295 21.529 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.619 47.781 22.884 1.00 0.00 H new ATOM 20 N GLN A 2 35.117 53.500 22.282 1.00 0.00 N ATOM 21 CA GLN A 2 36.470 53.812 22.692 1.00 0.00 C ATOM 22 C GLN A 2 36.953 52.833 23.765 1.00 0.00 C ATOM 23 O GLN A 2 36.248 52.646 24.754 1.00 0.00 O ATOM 24 CB GLN A 2 36.512 55.234 23.244 1.00 0.00 C ATOM 25 CG GLN A 2 36.241 56.332 22.218 1.00 0.00 C ATOM 26 CD GLN A 2 37.449 56.662 21.339 1.00 0.00 C ATOM 27 OE1 GLN A 2 38.308 57.466 21.697 1.00 0.00 O ATOM 28 NE2 GLN A 2 37.560 56.077 20.150 1.00 0.00 N ATOM 0 H GLN A 2 34.411 53.989 22.833 1.00 0.00 H new ATOM 0 HA GLN A 2 37.127 53.727 21.826 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.779 55.318 24.046 1.00 0.00 H new ATOM 0 HB3 GLN A 2 37.492 55.407 23.688 1.00 0.00 H new ATOM 0 HG2 GLN A 2 35.412 56.025 21.581 1.00 0.00 H new ATOM 0 HG3 GLN A 2 35.925 57.235 22.740 1.00 0.00 H new ATOM 0 HE21 GLN A 2 36.854 55.409 19.843 1.00 0.00 H new ATOM 0 HE22 GLN A 2 38.352 56.297 19.545 1.00 0.00 H new ATOM 37 N ILE A 3 38.145 52.261 23.628 1.00 0.00 N ATOM 38 CA ILE A 3 38.826 51.542 24.686 1.00 0.00 C ATOM 39 C ILE A 3 40.327 51.834 24.731 1.00 0.00 C ATOM 40 O ILE A 3 40.981 51.972 23.699 1.00 0.00 O ATOM 41 CB ILE A 3 38.576 50.037 24.650 1.00 0.00 C ATOM 42 CG1 ILE A 3 38.841 49.401 23.289 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.162 49.702 25.118 1.00 0.00 C ATOM 44 CD1 ILE A 3 39.013 47.887 23.365 1.00 0.00 C ATOM 0 H ILE A 3 38.672 52.288 22.755 1.00 0.00 H new ATOM 0 HA ILE A 3 38.384 51.922 25.607 1.00 0.00 H new ATOM 0 HB ILE A 3 39.300 49.607 25.342 1.00 0.00 H new ATOM 0 HG12 ILE A 3 38.015 49.635 22.617 1.00 0.00 H new ATOM 0 HG13 ILE A 3 39.739 49.842 22.856 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.013 48.623 25.082 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.024 50.053 26.141 1.00 0.00 H new ATOM 0 HG23 ILE A 3 36.438 50.191 24.466 1.00 0.00 H new ATOM 0 HD11 ILE A 3 39.199 47.491 22.366 1.00 0.00 H new ATOM 0 HD12 ILE A 3 39.857 47.649 24.013 1.00 0.00 H new ATOM 0 HD13 ILE A 3 38.106 47.438 23.770 1.00 0.00 H new ATOM 56 N PHE A 4 40.899 51.902 25.930 1.00 0.00 N ATOM 57 CA PHE A 4 42.257 52.351 26.161 1.00 0.00 C ATOM 58 C PHE A 4 43.293 51.225 26.163 1.00 0.00 C ATOM 59 O PHE A 4 42.963 50.077 26.453 1.00 0.00 O ATOM 60 CB PHE A 4 42.330 53.146 27.462 1.00 0.00 C ATOM 61 CG PHE A 4 41.247 54.189 27.607 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.242 55.315 26.776 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.215 53.999 28.533 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.175 56.220 26.831 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.163 54.920 28.610 1.00 0.00 C ATOM 66 CZ PHE A 4 39.131 56.017 27.740 1.00 0.00 C ATOM 0 H PHE A 4 40.413 51.638 26.787 1.00 0.00 H new ATOM 0 HA PHE A 4 42.515 52.990 25.316 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.269 52.454 28.302 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.302 53.636 27.522 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.061 55.486 26.093 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.230 53.141 29.189 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.158 57.075 26.171 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.378 54.785 29.339 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.300 56.706 27.771 1.00 0.00 H new ATOM 76 N VAL A 5 44.551 51.553 25.887 1.00 0.00 N ATOM 77 CA VAL A 5 45.700 50.691 26.086 1.00 0.00 C ATOM 78 C VAL A 5 46.794 51.456 26.832 1.00 0.00 C ATOM 79 O VAL A 5 47.113 52.586 26.469 1.00 0.00 O ATOM 80 CB VAL A 5 46.278 50.136 24.787 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.245 48.984 25.046 1.00 0.00 C ATOM 82 CG2 VAL A 5 45.231 49.624 23.803 1.00 0.00 C ATOM 0 H VAL A 5 44.803 52.464 25.503 1.00 0.00 H new ATOM 0 HA VAL A 5 45.349 49.840 26.669 1.00 0.00 H new ATOM 0 HB VAL A 5 46.786 50.992 24.344 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.635 48.616 24.097 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.070 49.334 25.666 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.721 48.178 25.560 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.726 49.248 22.908 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.659 48.820 24.266 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.559 50.438 23.531 1.00 0.00 H new ATOM 92 N LYS A 6 47.394 50.829 27.840 1.00 0.00 N ATOM 93 CA LYS A 6 48.639 51.250 28.451 1.00 0.00 C ATOM 94 C LYS A 6 49.825 50.703 27.655 1.00 0.00 C ATOM 95 O LYS A 6 49.979 49.491 27.531 1.00 0.00 O ATOM 96 CB LYS A 6 48.681 50.816 29.913 1.00 0.00 C ATOM 97 CG LYS A 6 48.624 51.981 30.898 1.00 0.00 C ATOM 98 CD LYS A 6 47.315 52.764 30.838 1.00 0.00 C ATOM 99 CE LYS A 6 47.240 53.824 31.933 1.00 0.00 C ATOM 100 NZ LYS A 6 48.232 54.893 31.741 1.00 0.00 N ATOM 0 H LYS A 6 47.009 49.985 28.264 1.00 0.00 H new ATOM 0 HA LYS A 6 48.704 52.338 28.432 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.845 50.145 30.108 1.00 0.00 H new ATOM 0 HB3 LYS A 6 49.594 50.247 30.088 1.00 0.00 H new ATOM 0 HG2 LYS A 6 48.764 51.599 31.909 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.453 52.659 30.696 1.00 0.00 H new ATOM 0 HD2 LYS A 6 47.221 53.241 29.863 1.00 0.00 H new ATOM 0 HD3 LYS A 6 46.475 52.077 30.939 1.00 0.00 H new ATOM 0 HE2 LYS A 6 46.240 54.257 31.949 1.00 0.00 H new ATOM 0 HE3 LYS A 6 47.399 53.353 32.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 48.348 55.423 32.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 49.144 54.475 31.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 47.907 55.538 30.993 1.00 0.00 H new ATOM 168 N LYS A 11 51.904 55.292 28.581 1.00 0.00 N ATOM 169 CA LYS A 11 51.006 56.252 27.972 1.00 0.00 C ATOM 170 C LYS A 11 49.637 55.623 27.703 1.00 0.00 C ATOM 171 O LYS A 11 49.553 54.442 27.376 1.00 0.00 O ATOM 172 CB LYS A 11 51.640 56.796 26.694 1.00 0.00 C ATOM 173 CG LYS A 11 50.911 58.011 26.128 1.00 0.00 C ATOM 174 CD LYS A 11 51.583 58.563 24.874 1.00 0.00 C ATOM 175 CE LYS A 11 51.471 57.594 23.700 1.00 0.00 C ATOM 176 NZ LYS A 11 52.268 58.048 22.551 1.00 0.00 N ATOM 0 HA LYS A 11 50.843 57.083 28.658 1.00 0.00 H new ATOM 0 HB2 LYS A 11 52.677 57.065 26.897 1.00 0.00 H new ATOM 0 HB3 LYS A 11 51.657 56.008 25.941 1.00 0.00 H new ATOM 0 HG2 LYS A 11 49.882 57.737 25.895 1.00 0.00 H new ATOM 0 HG3 LYS A 11 50.869 58.792 26.887 1.00 0.00 H new ATOM 0 HD2 LYS A 11 51.125 59.515 24.605 1.00 0.00 H new ATOM 0 HD3 LYS A 11 52.634 58.762 25.082 1.00 0.00 H new ATOM 0 HE2 LYS A 11 51.807 56.605 24.010 1.00 0.00 H new ATOM 0 HE3 LYS A 11 50.426 57.497 23.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 52.170 57.368 21.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 51.930 58.981 22.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 53.268 58.116 22.828 1.00 0.00 H new ATOM 190 N THR A 12 48.569 56.407 27.819 1.00 0.00 N ATOM 191 CA THR A 12 47.212 55.974 27.552 1.00 0.00 C ATOM 192 C THR A 12 46.813 56.310 26.115 1.00 0.00 C ATOM 193 O THR A 12 46.428 57.440 25.823 1.00 0.00 O ATOM 194 CB THR A 12 46.244 56.591 28.558 1.00 0.00 C ATOM 195 OG1 THR A 12 46.701 56.358 29.871 1.00 0.00 O ATOM 196 CG2 THR A 12 44.846 55.985 28.478 1.00 0.00 C ATOM 0 H THR A 12 48.631 57.383 28.108 1.00 0.00 H new ATOM 0 HA THR A 12 47.164 54.891 27.665 1.00 0.00 H new ATOM 0 HB THR A 12 46.198 57.653 28.316 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.076 56.758 30.511 1.00 0.00 H new ATOM 0 HG21 THR A 12 44.200 56.461 29.216 1.00 0.00 H new ATOM 0 HG22 THR A 12 44.437 56.145 27.480 1.00 0.00 H new ATOM 0 HG23 THR A 12 44.901 54.915 28.681 1.00 0.00 H new ATOM 204 N ILE A 13 46.900 55.346 25.202 1.00 0.00 N ATOM 205 CA ILE A 13 46.351 55.454 23.866 1.00 0.00 C ATOM 206 C ILE A 13 44.905 54.956 23.830 1.00 0.00 C ATOM 207 O ILE A 13 44.520 54.158 24.682 1.00 0.00 O ATOM 208 CB ILE A 13 47.230 54.775 22.819 1.00 0.00 C ATOM 209 CG1 ILE A 13 47.335 53.265 23.012 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.606 55.432 22.771 1.00 0.00 C ATOM 211 CD1 ILE A 13 48.020 52.526 21.867 1.00 0.00 C ATOM 0 H ILE A 13 47.363 54.455 25.380 1.00 0.00 H new ATOM 0 HA ILE A 13 46.339 56.511 23.600 1.00 0.00 H new ATOM 0 HB ILE A 13 46.742 54.916 21.854 1.00 0.00 H new ATOM 0 HG12 ILE A 13 47.882 53.067 23.934 1.00 0.00 H new ATOM 0 HG13 ILE A 13 46.332 52.858 23.142 1.00 0.00 H new ATOM 0 HG21 ILE A 13 49.220 54.936 22.019 1.00 0.00 H new ATOM 0 HG22 ILE A 13 48.497 56.485 22.513 1.00 0.00 H new ATOM 0 HG23 ILE A 13 49.085 55.345 23.746 1.00 0.00 H new ATOM 0 HD11 ILE A 13 48.050 51.459 22.089 1.00 0.00 H new ATOM 0 HD12 ILE A 13 47.463 52.689 20.944 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.037 52.901 21.748 1.00 0.00 H new ATOM 223 N THR A 14 44.120 55.360 22.835 1.00 0.00 N ATOM 224 CA THR A 14 42.761 54.893 22.646 1.00 0.00 C ATOM 225 C THR A 14 42.566 54.235 21.279 1.00 0.00 C ATOM 226 O THR A 14 43.081 54.727 20.278 1.00 0.00 O ATOM 227 CB THR A 14 41.702 55.979 22.818 1.00 0.00 C ATOM 228 OG1 THR A 14 42.051 56.949 23.780 1.00 0.00 O ATOM 229 CG2 THR A 14 40.390 55.342 23.269 1.00 0.00 C ATOM 0 H THR A 14 44.421 56.032 22.129 1.00 0.00 H new ATOM 0 HA THR A 14 42.619 54.158 23.438 1.00 0.00 H new ATOM 0 HB THR A 14 41.610 56.472 21.850 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.661 56.706 24.646 1.00 0.00 H new ATOM 0 HG21 THR A 14 39.633 56.116 23.392 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.057 54.625 22.519 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.542 54.829 24.219 1.00 0.00 H new ATOM 237 N LEU A 15 41.794 53.152 21.227 1.00 0.00 N ATOM 238 CA LEU A 15 41.363 52.497 20.009 1.00 0.00 C ATOM 239 C LEU A 15 39.867 52.716 19.780 1.00 0.00 C ATOM 240 O LEU A 15 39.087 52.669 20.729 1.00 0.00 O ATOM 241 CB LEU A 15 41.683 51.005 20.064 1.00 0.00 C ATOM 242 CG LEU A 15 43.090 50.629 20.519 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.213 49.108 20.532 1.00 0.00 C ATOM 244 CD2 LEU A 15 44.194 51.180 19.623 1.00 0.00 C ATOM 0 H LEU A 15 41.442 52.695 22.068 1.00 0.00 H new ATOM 0 HA LEU A 15 41.905 52.936 19.172 1.00 0.00 H new ATOM 0 HB2 LEU A 15 40.968 50.527 20.734 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.521 50.584 19.072 1.00 0.00 H new ATOM 0 HG LEU A 15 43.223 51.068 21.508 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.215 48.827 20.856 1.00 0.00 H new ATOM 0 HD12 LEU A 15 42.478 48.689 21.220 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.033 48.720 19.529 1.00 0.00 H new ATOM 0 HD21 LEU A 15 45.165 50.871 20.010 1.00 0.00 H new ATOM 0 HD22 LEU A 15 44.068 50.795 18.611 1.00 0.00 H new ATOM 0 HD23 LEU A 15 44.140 52.269 19.606 1.00 0.00 H new ATOM 256 N GLU A 16 39.468 52.895 18.524 1.00 0.00 N ATOM 257 CA GLU A 16 38.084 52.878 18.094 1.00 0.00 C ATOM 258 C GLU A 16 37.758 51.528 17.452 1.00 0.00 C ATOM 259 O GLU A 16 38.340 51.159 16.434 1.00 0.00 O ATOM 260 CB GLU A 16 37.810 54.049 17.154 1.00 0.00 C ATOM 261 CG GLU A 16 36.373 54.096 16.642 1.00 0.00 C ATOM 262 CD GLU A 16 35.329 54.078 17.760 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.433 54.884 18.710 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.364 53.287 17.678 1.00 0.00 O ATOM 0 H GLU A 16 40.122 53.060 17.759 1.00 0.00 H new ATOM 0 HA GLU A 16 37.428 52.999 18.956 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.033 54.981 17.673 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.489 53.988 16.303 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.238 54.997 16.043 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.202 53.246 15.982 1.00 0.00 H new ATOM 271 N VAL A 17 36.851 50.781 18.075 1.00 0.00 N ATOM 272 CA VAL A 17 36.546 49.396 17.775 1.00 0.00 C ATOM 273 C VAL A 17 35.083 49.054 18.067 1.00 0.00 C ATOM 274 O VAL A 17 34.370 49.807 18.727 1.00 0.00 O ATOM 275 CB VAL A 17 37.451 48.448 18.557 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.882 48.426 18.024 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.482 48.776 20.047 1.00 0.00 C ATOM 0 H VAL A 17 36.284 51.148 18.839 1.00 0.00 H new ATOM 0 HA VAL A 17 36.725 49.266 16.708 1.00 0.00 H new ATOM 0 HB VAL A 17 37.013 47.460 18.419 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.481 47.735 18.618 1.00 0.00 H new ATOM 0 HG12 VAL A 17 38.878 48.101 16.984 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.310 49.426 18.090 1.00 0.00 H new ATOM 0 HG21 VAL A 17 38.139 48.074 20.560 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.853 49.791 20.188 1.00 0.00 H new ATOM 0 HG23 VAL A 17 36.475 48.698 20.458 1.00 0.00 H new ATOM 287 N GLU A 18 34.645 47.883 17.614 1.00 0.00 N ATOM 288 CA GLU A 18 33.411 47.234 18.007 1.00 0.00 C ATOM 289 C GLU A 18 33.677 46.079 18.975 1.00 0.00 C ATOM 290 O GLU A 18 34.736 45.460 18.890 1.00 0.00 O ATOM 291 CB GLU A 18 32.702 46.689 16.771 1.00 0.00 C ATOM 292 CG GLU A 18 32.309 47.748 15.744 1.00 0.00 C ATOM 293 CD GLU A 18 31.421 48.836 16.354 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.400 48.492 16.986 1.00 0.00 O ATOM 295 OE2 GLU A 18 31.740 50.034 16.202 1.00 0.00 O ATOM 0 H GLU A 18 35.171 47.339 16.930 1.00 0.00 H new ATOM 0 HA GLU A 18 32.786 47.974 18.507 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.351 45.958 16.289 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.804 46.158 17.088 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.209 48.204 15.331 1.00 0.00 H new ATOM 0 HG3 GLU A 18 31.783 47.273 14.916 1.00 0.00 H new ATOM 302 N PRO A 19 32.742 45.680 19.832 1.00 0.00 N ATOM 303 CA PRO A 19 32.862 44.460 20.604 1.00 0.00 C ATOM 304 C PRO A 19 33.100 43.200 19.770 1.00 0.00 C ATOM 305 O PRO A 19 33.654 42.222 20.264 1.00 0.00 O ATOM 306 CB PRO A 19 31.563 44.351 21.398 1.00 0.00 C ATOM 307 CG PRO A 19 31.143 45.809 21.567 1.00 0.00 C ATOM 308 CD PRO A 19 31.570 46.428 20.240 1.00 0.00 C ATOM 0 HA PRO A 19 33.747 44.520 21.238 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.810 43.773 20.863 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.717 43.861 22.359 1.00 0.00 H new ATOM 0 HG2 PRO A 19 30.070 45.906 21.734 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.642 46.280 22.414 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.776 46.353 19.497 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.799 47.487 20.355 1.00 0.00 H new ATOM 316 N SER A 20 32.706 43.217 18.499 1.00 0.00 N ATOM 317 CA SER A 20 32.918 42.162 17.528 1.00 0.00 C ATOM 318 C SER A 20 34.293 42.167 16.856 1.00 0.00 C ATOM 319 O SER A 20 34.589 41.233 16.113 1.00 0.00 O ATOM 320 CB SER A 20 31.805 42.219 16.486 1.00 0.00 C ATOM 321 OG SER A 20 31.725 43.497 15.895 1.00 0.00 O ATOM 0 H SER A 20 32.204 44.012 18.104 1.00 0.00 H new ATOM 0 HA SER A 20 32.890 41.223 18.081 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.986 41.470 15.715 1.00 0.00 H new ATOM 0 HB3 SER A 20 30.852 41.971 16.954 1.00 0.00 H new ATOM 0 HG SER A 20 31.005 43.505 15.230 1.00 0.00 H new ATOM 327 N ASP A 21 35.143 43.164 17.091 1.00 0.00 N ATOM 328 CA ASP A 21 36.492 43.200 16.564 1.00 0.00 C ATOM 329 C ASP A 21 37.384 42.120 17.180 1.00 0.00 C ATOM 330 O ASP A 21 37.279 41.807 18.364 1.00 0.00 O ATOM 331 CB ASP A 21 37.135 44.573 16.738 1.00 0.00 C ATOM 332 CG ASP A 21 36.819 45.496 15.559 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.154 45.111 14.419 1.00 0.00 O ATOM 334 OD2 ASP A 21 36.293 46.617 15.732 1.00 0.00 O ATOM 0 H ASP A 21 34.905 43.976 17.660 1.00 0.00 H new ATOM 0 HA ASP A 21 36.403 42.995 15.497 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.779 45.028 17.662 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.215 44.460 16.833 1.00 0.00 H new ATOM 339 N THR A 22 38.286 41.567 16.374 1.00 0.00 N ATOM 340 CA THR A 22 39.222 40.549 16.805 1.00 0.00 C ATOM 341 C THR A 22 40.398 41.154 17.574 1.00 0.00 C ATOM 342 O THR A 22 40.747 42.317 17.387 1.00 0.00 O ATOM 343 CB THR A 22 39.739 39.689 15.654 1.00 0.00 C ATOM 344 OG1 THR A 22 40.642 40.435 14.870 1.00 0.00 O ATOM 345 CG2 THR A 22 38.640 39.159 14.738 1.00 0.00 C ATOM 0 H THR A 22 38.384 41.821 15.391 1.00 0.00 H new ATOM 0 HA THR A 22 38.660 39.897 17.474 1.00 0.00 H new ATOM 0 HB THR A 22 40.222 38.829 16.119 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.972 39.879 14.134 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.085 38.558 13.945 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.950 38.544 15.316 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.098 39.996 14.297 1.00 0.00 H new ATOM 353 N ILE A 23 41.094 40.341 18.364 1.00 0.00 N ATOM 354 CA ILE A 23 42.359 40.715 18.961 1.00 0.00 C ATOM 355 C ILE A 23 43.405 41.038 17.892 1.00 0.00 C ATOM 356 O ILE A 23 44.281 41.870 18.121 1.00 0.00 O ATOM 357 CB ILE A 23 42.820 39.645 19.946 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.796 39.328 21.032 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.153 39.998 20.601 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.210 40.519 21.785 1.00 0.00 C ATOM 0 H ILE A 23 40.788 39.398 18.606 1.00 0.00 H new ATOM 0 HA ILE A 23 42.221 41.633 19.532 1.00 0.00 H new ATOM 0 HB ILE A 23 42.943 38.751 19.335 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.975 38.776 20.575 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.263 38.662 21.758 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.439 39.206 21.293 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.919 40.103 19.833 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.054 40.937 21.145 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.497 40.164 22.529 1.00 0.00 H new ATOM 0 HD12 ILE A 23 42.012 41.065 22.283 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.703 41.180 21.082 1.00 0.00 H new ATOM 372 N GLU A 24 43.288 40.489 16.686 1.00 0.00 N ATOM 373 CA GLU A 24 44.171 40.818 15.587 1.00 0.00 C ATOM 374 C GLU A 24 43.896 42.210 15.013 1.00 0.00 C ATOM 375 O GLU A 24 44.841 42.956 14.771 1.00 0.00 O ATOM 376 CB GLU A 24 44.124 39.744 14.503 1.00 0.00 C ATOM 377 CG GLU A 24 44.337 38.334 15.043 1.00 0.00 C ATOM 378 CD GLU A 24 44.950 37.403 13.996 1.00 0.00 C ATOM 379 OE1 GLU A 24 44.224 36.548 13.445 1.00 0.00 O ATOM 380 OE2 GLU A 24 46.175 37.491 13.760 1.00 0.00 O ATOM 0 H GLU A 24 42.573 39.801 16.449 1.00 0.00 H new ATOM 0 HA GLU A 24 45.184 40.844 15.989 1.00 0.00 H new ATOM 0 HB2 GLU A 24 43.160 39.790 13.997 1.00 0.00 H new ATOM 0 HB3 GLU A 24 44.887 39.959 13.755 1.00 0.00 H new ATOM 0 HG2 GLU A 24 44.988 38.375 15.916 1.00 0.00 H new ATOM 0 HG3 GLU A 24 43.383 37.926 15.376 1.00 0.00 H new ATOM 387 N ASN A 25 42.633 42.607 14.893 1.00 0.00 N ATOM 388 CA ASN A 25 42.245 43.954 14.526 1.00 0.00 C ATOM 389 C ASN A 25 42.742 44.969 15.557 1.00 0.00 C ATOM 390 O ASN A 25 43.274 46.016 15.197 1.00 0.00 O ATOM 391 CB ASN A 25 40.729 44.059 14.388 1.00 0.00 C ATOM 392 CG ASN A 25 40.075 43.210 13.297 1.00 0.00 C ATOM 393 OD1 ASN A 25 40.709 42.609 12.433 1.00 0.00 O ATOM 394 ND2 ASN A 25 38.747 43.149 13.285 1.00 0.00 N ATOM 0 H ASN A 25 41.840 41.986 15.052 1.00 0.00 H new ATOM 0 HA ASN A 25 42.706 44.181 13.564 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.281 43.787 15.344 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.476 45.103 14.203 1.00 0.00 H new ATOM 0 HD21 ASN A 25 38.268 42.608 12.565 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.207 43.643 13.996 1.00 0.00 H new ATOM 401 N VAL A 26 42.630 44.642 16.842 1.00 0.00 N ATOM 402 CA VAL A 26 43.138 45.432 17.946 1.00 0.00 C ATOM 403 C VAL A 26 44.648 45.638 17.831 1.00 0.00 C ATOM 404 O VAL A 26 45.109 46.778 17.866 1.00 0.00 O ATOM 405 CB VAL A 26 42.750 44.787 19.274 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.459 45.364 20.496 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.248 44.908 19.516 1.00 0.00 C ATOM 0 H VAL A 26 42.165 43.787 17.148 1.00 0.00 H new ATOM 0 HA VAL A 26 42.682 46.421 17.907 1.00 0.00 H new ATOM 0 HB VAL A 26 43.063 43.748 19.169 1.00 0.00 H new ATOM 0 HG11 VAL A 26 43.120 44.844 21.392 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.536 45.235 20.387 1.00 0.00 H new ATOM 0 HG13 VAL A 26 43.228 46.426 20.583 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.994 44.442 20.468 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.967 45.961 19.541 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.708 44.408 18.712 1.00 0.00 H new ATOM 417 N LYS A 27 45.423 44.579 17.611 1.00 0.00 N ATOM 418 CA LYS A 27 46.855 44.673 17.410 1.00 0.00 C ATOM 419 C LYS A 27 47.249 45.532 16.208 1.00 0.00 C ATOM 420 O LYS A 27 48.203 46.302 16.303 1.00 0.00 O ATOM 421 CB LYS A 27 47.462 43.281 17.259 1.00 0.00 C ATOM 422 CG LYS A 27 47.568 42.512 18.573 1.00 0.00 C ATOM 423 CD LYS A 27 48.125 41.119 18.289 1.00 0.00 C ATOM 424 CE LYS A 27 48.563 40.401 19.562 1.00 0.00 C ATOM 425 NZ LYS A 27 49.373 39.222 19.216 1.00 0.00 N ATOM 0 H LYS A 27 45.065 43.625 17.568 1.00 0.00 H new ATOM 0 HA LYS A 27 47.251 45.167 18.298 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.857 42.705 16.559 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.456 43.373 16.821 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.218 43.043 19.269 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.589 42.437 19.046 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.367 40.523 17.781 1.00 0.00 H new ATOM 0 HD3 LYS A 27 48.974 41.201 17.610 1.00 0.00 H new ATOM 0 HE2 LYS A 27 49.140 41.078 20.192 1.00 0.00 H new ATOM 0 HE3 LYS A 27 47.689 40.097 20.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 49.455 38.601 20.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.916 38.703 18.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 50.321 39.528 18.917 1.00 0.00 H new ATOM 439 N ALA A 28 46.518 45.448 15.100 1.00 0.00 N ATOM 440 CA ALA A 28 46.758 46.267 13.929 1.00 0.00 C ATOM 441 C ALA A 28 46.483 47.750 14.184 1.00 0.00 C ATOM 442 O ALA A 28 47.252 48.601 13.746 1.00 0.00 O ATOM 443 CB ALA A 28 45.933 45.716 12.770 1.00 0.00 C ATOM 0 H ALA A 28 45.736 44.801 14.995 1.00 0.00 H new ATOM 0 HA ALA A 28 47.816 46.216 13.672 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.104 46.323 11.881 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.230 44.687 12.569 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.875 45.744 13.031 1.00 0.00 H new ATOM 449 N LYS A 29 45.451 48.081 14.956 1.00 0.00 N ATOM 450 CA LYS A 29 45.155 49.440 15.361 1.00 0.00 C ATOM 451 C LYS A 29 46.147 49.993 16.388 1.00 0.00 C ATOM 452 O LYS A 29 46.418 51.191 16.369 1.00 0.00 O ATOM 453 CB LYS A 29 43.704 49.532 15.824 1.00 0.00 C ATOM 454 CG LYS A 29 42.761 49.532 14.624 1.00 0.00 C ATOM 455 CD LYS A 29 41.289 49.628 15.018 1.00 0.00 C ATOM 456 CE LYS A 29 40.461 49.869 13.759 1.00 0.00 C ATOM 457 NZ LYS A 29 39.018 49.878 14.040 1.00 0.00 N ATOM 0 H LYS A 29 44.789 47.396 15.321 1.00 0.00 H new ATOM 0 HA LYS A 29 45.279 50.086 14.492 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.470 48.692 16.478 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.559 50.441 16.408 1.00 0.00 H new ATOM 0 HG2 LYS A 29 43.012 50.369 13.973 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.918 48.621 14.047 1.00 0.00 H new ATOM 0 HD2 LYS A 29 40.969 48.710 15.511 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.140 50.440 15.729 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.749 50.821 13.313 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.682 49.093 13.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.535 50.493 13.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.643 48.911 13.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.854 50.237 15.002 1.00 0.00 H new ATOM 471 N ILE A 30 46.751 49.152 17.223 1.00 0.00 N ATOM 472 CA ILE A 30 47.878 49.514 18.059 1.00 0.00 C ATOM 473 C ILE A 30 49.124 49.771 17.211 1.00 0.00 C ATOM 474 O ILE A 30 49.834 50.743 17.460 1.00 0.00 O ATOM 475 CB ILE A 30 48.118 48.464 19.140 1.00 0.00 C ATOM 476 CG1 ILE A 30 46.960 48.438 20.133 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.428 48.699 19.887 1.00 0.00 C ATOM 478 CD1 ILE A 30 46.942 47.215 21.047 1.00 0.00 C ATOM 0 H ILE A 30 46.460 48.181 17.335 1.00 0.00 H new ATOM 0 HA ILE A 30 47.642 50.447 18.572 1.00 0.00 H new ATOM 0 HB ILE A 30 48.186 47.500 18.635 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.005 49.336 20.749 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.022 48.477 19.580 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.557 47.928 20.647 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.260 48.659 19.184 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.404 49.678 20.365 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.087 47.277 21.721 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.864 46.311 20.443 1.00 0.00 H new ATOM 0 HD13 ILE A 30 47.862 47.183 21.630 1.00 0.00 H new ATOM 490 N GLN A 31 49.382 48.963 16.186 1.00 0.00 N ATOM 491 CA GLN A 31 50.510 49.137 15.293 1.00 0.00 C ATOM 492 C GLN A 31 50.505 50.502 14.603 1.00 0.00 C ATOM 493 O GLN A 31 51.569 51.099 14.455 1.00 0.00 O ATOM 494 CB GLN A 31 50.575 47.992 14.287 1.00 0.00 C ATOM 495 CG GLN A 31 51.883 47.992 13.500 1.00 0.00 C ATOM 496 CD GLN A 31 52.015 46.832 12.510 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.053 46.201 12.079 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.234 46.504 12.092 1.00 0.00 N ATOM 0 H GLN A 31 48.800 48.158 15.954 1.00 0.00 H new ATOM 0 HA GLN A 31 51.416 49.110 15.899 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.468 47.043 14.812 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.736 48.070 13.595 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.967 48.932 12.955 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.717 47.954 14.201 1.00 0.00 H new ATOM 0 HE21 GLN A 31 54.046 47.015 12.437 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.357 45.741 11.426 1.00 0.00 H new ATOM 507 N ASP A 32 49.349 51.049 14.236 1.00 0.00 N ATOM 508 CA ASP A 32 49.256 52.375 13.659 1.00 0.00 C ATOM 509 C ASP A 32 49.738 53.477 14.605 1.00 0.00 C ATOM 510 O ASP A 32 50.445 54.386 14.176 1.00 0.00 O ATOM 511 CB ASP A 32 47.818 52.639 13.218 1.00 0.00 C ATOM 512 CG ASP A 32 47.713 53.852 12.293 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.583 54.989 12.797 1.00 0.00 O ATOM 514 OD2 ASP A 32 47.739 53.671 11.057 1.00 0.00 O ATOM 0 H ASP A 32 48.450 50.578 14.334 1.00 0.00 H new ATOM 0 HA ASP A 32 49.922 52.401 12.797 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.429 51.759 12.706 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.193 52.799 14.097 1.00 0.00 H new ATOM 519 N LYS A 33 49.413 53.378 15.891 1.00 0.00 N ATOM 520 CA LYS A 33 49.700 54.379 16.898 1.00 0.00 C ATOM 521 C LYS A 33 51.041 54.232 17.619 1.00 0.00 C ATOM 522 O LYS A 33 51.512 55.217 18.184 1.00 0.00 O ATOM 523 CB LYS A 33 48.549 54.452 17.899 1.00 0.00 C ATOM 524 CG LYS A 33 47.296 55.037 17.255 1.00 0.00 C ATOM 525 CD LYS A 33 46.210 55.365 18.276 1.00 0.00 C ATOM 526 CE LYS A 33 45.073 56.125 17.599 1.00 0.00 C ATOM 527 NZ LYS A 33 44.088 56.615 18.576 1.00 0.00 N ATOM 0 H LYS A 33 48.925 52.566 16.268 1.00 0.00 H new ATOM 0 HA LYS A 33 49.795 55.317 16.350 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.333 53.455 18.282 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.843 55.064 18.752 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.561 55.942 16.709 1.00 0.00 H new ATOM 0 HG3 LYS A 33 46.902 54.329 16.526 1.00 0.00 H new ATOM 0 HD2 LYS A 33 45.830 54.447 18.723 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.628 55.964 19.085 1.00 0.00 H new ATOM 0 HE2 LYS A 33 45.481 56.967 17.040 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.578 55.474 16.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 43.281 57.037 18.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 43.756 55.822 19.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.530 57.333 19.185 1.00 0.00 H new ATOM 541 N GLU A 34 51.640 53.046 17.638 1.00 0.00 N ATOM 542 CA GLU A 34 52.847 52.757 18.386 1.00 0.00 C ATOM 543 C GLU A 34 53.933 52.030 17.590 1.00 0.00 C ATOM 544 O GLU A 34 55.061 51.898 18.059 1.00 0.00 O ATOM 545 CB GLU A 34 52.438 52.030 19.664 1.00 0.00 C ATOM 546 CG GLU A 34 53.510 51.752 20.713 1.00 0.00 C ATOM 547 CD GLU A 34 54.113 52.983 21.394 1.00 0.00 C ATOM 548 OE1 GLU A 34 54.570 53.937 20.728 1.00 0.00 O ATOM 549 OE2 GLU A 34 54.198 52.982 22.641 1.00 0.00 O ATOM 0 H GLU A 34 51.286 52.242 17.119 1.00 0.00 H new ATOM 0 HA GLU A 34 53.337 53.698 18.635 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.650 52.613 20.140 1.00 0.00 H new ATOM 0 HB3 GLU A 34 51.998 51.075 19.377 1.00 0.00 H new ATOM 0 HG2 GLU A 34 53.081 51.109 21.482 1.00 0.00 H new ATOM 0 HG3 GLU A 34 54.316 51.190 20.241 1.00 0.00 H new ATOM 556 N GLY A 35 53.649 51.561 16.378 1.00 0.00 N ATOM 557 CA GLY A 35 54.639 50.990 15.486 1.00 0.00 C ATOM 558 C GLY A 35 55.154 49.597 15.848 1.00 0.00 C ATOM 559 O GLY A 35 56.058 49.094 15.184 1.00 0.00 O ATOM 0 H GLY A 35 52.707 51.570 15.987 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.212 50.947 14.484 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.491 51.669 15.441 1.00 0.00 H new ATOM 563 N ILE A 36 54.608 48.958 16.880 1.00 0.00 N ATOM 564 CA ILE A 36 55.006 47.649 17.354 1.00 0.00 C ATOM 565 C ILE A 36 54.339 46.533 16.548 1.00 0.00 C ATOM 566 O ILE A 36 53.112 46.514 16.481 1.00 0.00 O ATOM 567 CB ILE A 36 54.803 47.528 18.862 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.269 46.158 19.348 1.00 0.00 C ATOM 569 CG2 ILE A 36 53.390 47.861 19.333 1.00 0.00 C ATOM 570 CD1 ILE A 36 55.363 46.015 20.864 1.00 0.00 C ATOM 0 H ILE A 36 53.846 49.360 17.426 1.00 0.00 H new ATOM 0 HA ILE A 36 56.076 47.528 17.185 1.00 0.00 H new ATOM 0 HB ILE A 36 55.426 48.294 19.323 1.00 0.00 H new ATOM 0 HG12 ILE A 36 54.584 45.401 18.968 1.00 0.00 H new ATOM 0 HG13 ILE A 36 56.248 45.948 18.916 1.00 0.00 H new ATOM 0 HG21 ILE A 36 53.332 47.750 20.416 1.00 0.00 H new ATOM 0 HG22 ILE A 36 53.148 48.888 19.060 1.00 0.00 H new ATOM 0 HG23 ILE A 36 52.680 47.183 18.860 1.00 0.00 H new ATOM 0 HD11 ILE A 36 55.702 45.010 21.114 1.00 0.00 H new ATOM 0 HD12 ILE A 36 56.072 46.745 21.255 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.382 46.188 21.307 1.00 0.00 H new ATOM 582 N PRO A 37 55.070 45.597 15.948 1.00 0.00 N ATOM 583 CA PRO A 37 54.490 44.540 15.144 1.00 0.00 C ATOM 584 C PRO A 37 53.541 43.627 15.922 1.00 0.00 C ATOM 585 O PRO A 37 53.880 43.258 17.045 1.00 0.00 O ATOM 586 CB PRO A 37 55.656 43.747 14.561 1.00 0.00 C ATOM 587 CG PRO A 37 56.796 44.762 14.542 1.00 0.00 C ATOM 588 CD PRO A 37 56.511 45.584 15.796 1.00 0.00 C ATOM 0 HA PRO A 37 53.869 44.982 14.365 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.900 42.880 15.175 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.431 43.376 13.561 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.772 44.279 14.584 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.782 45.375 13.641 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.991 45.142 16.669 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.902 46.597 15.696 1.00 0.00 H new ATOM 596 N PRO A 38 52.404 43.209 15.373 1.00 0.00 N ATOM 597 CA PRO A 38 51.440 42.354 16.036 1.00 0.00 C ATOM 598 C PRO A 38 51.998 41.083 16.679 1.00 0.00 C ATOM 599 O PRO A 38 51.553 40.719 17.766 1.00 0.00 O ATOM 600 CB PRO A 38 50.417 42.004 14.960 1.00 0.00 C ATOM 601 CG PRO A 38 50.376 43.272 14.113 1.00 0.00 C ATOM 602 CD PRO A 38 51.837 43.708 14.137 1.00 0.00 C ATOM 0 HA PRO A 38 51.028 42.894 16.888 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.724 41.136 14.376 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.442 41.771 15.388 1.00 0.00 H new ATOM 0 HG2 PRO A 38 50.024 43.076 13.100 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.716 44.028 14.539 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.374 43.308 13.277 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.917 44.794 14.086 1.00 0.00 H new ATOM 610 N ASP A 39 53.004 40.445 16.085 1.00 0.00 N ATOM 611 CA ASP A 39 53.605 39.252 16.644 1.00 0.00 C ATOM 612 C ASP A 39 54.427 39.505 17.909 1.00 0.00 C ATOM 613 O ASP A 39 54.617 38.585 18.702 1.00 0.00 O ATOM 614 CB ASP A 39 54.400 38.497 15.582 1.00 0.00 C ATOM 615 CG ASP A 39 55.804 39.058 15.345 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.983 39.941 14.478 1.00 0.00 O ATOM 617 OD2 ASP A 39 56.747 38.607 16.030 1.00 0.00 O ATOM 0 H ASP A 39 53.420 40.746 15.204 1.00 0.00 H new ATOM 0 HA ASP A 39 52.781 38.618 16.971 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.482 37.451 15.878 1.00 0.00 H new ATOM 0 HB3 ASP A 39 53.847 38.520 14.643 1.00 0.00 H new ATOM 622 N GLN A 40 54.866 40.739 18.142 1.00 0.00 N ATOM 623 CA GLN A 40 55.566 41.153 19.341 1.00 0.00 C ATOM 624 C GLN A 40 54.622 41.601 20.458 1.00 0.00 C ATOM 625 O GLN A 40 55.038 41.643 21.614 1.00 0.00 O ATOM 626 CB GLN A 40 56.539 42.285 19.022 1.00 0.00 C ATOM 627 CG GLN A 40 57.537 41.925 17.925 1.00 0.00 C ATOM 628 CD GLN A 40 58.648 42.960 17.733 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.866 43.869 18.531 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.420 42.848 16.656 1.00 0.00 N ATOM 0 H GLN A 40 54.737 41.499 17.475 1.00 0.00 H new ATOM 0 HA GLN A 40 56.107 40.277 19.699 1.00 0.00 H new ATOM 0 HB2 GLN A 40 55.975 43.166 18.717 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.084 42.554 19.927 1.00 0.00 H new ATOM 0 HG2 GLN A 40 57.989 40.961 18.160 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.000 41.804 16.984 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.252 42.099 15.984 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.180 43.511 16.502 1.00 0.00 H new ATOM 639 N GLN A 41 53.371 41.917 20.138 1.00 0.00 N ATOM 640 CA GLN A 41 52.389 42.381 21.097 1.00 0.00 C ATOM 641 C GLN A 41 51.785 41.205 21.867 1.00 0.00 C ATOM 642 O GLN A 41 51.212 40.299 21.266 1.00 0.00 O ATOM 643 CB GLN A 41 51.282 43.170 20.402 1.00 0.00 C ATOM 644 CG GLN A 41 51.725 44.440 19.680 1.00 0.00 C ATOM 645 CD GLN A 41 50.545 45.150 19.013 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.448 45.229 19.563 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.684 45.680 17.802 1.00 0.00 N ATOM 0 H GLN A 41 53.010 41.855 19.186 1.00 0.00 H new ATOM 0 HA GLN A 41 52.897 43.039 21.802 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.794 42.516 19.680 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.532 43.440 21.146 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.202 45.115 20.390 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.472 44.189 18.927 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.583 45.629 17.323 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.892 46.138 17.352 1.00 0.00 H new ATOM 656 N ARG A 42 51.836 41.255 23.195 1.00 0.00 N ATOM 657 CA ARG A 42 51.084 40.400 24.091 1.00 0.00 C ATOM 658 C ARG A 42 50.130 41.290 24.890 1.00 0.00 C ATOM 659 O ARG A 42 50.579 42.169 25.622 1.00 0.00 O ATOM 660 CB ARG A 42 52.083 39.617 24.938 1.00 0.00 C ATOM 661 CG ARG A 42 51.464 38.651 25.944 1.00 0.00 C ATOM 662 CD ARG A 42 52.557 38.042 26.817 1.00 0.00 C ATOM 663 NE ARG A 42 52.032 36.982 27.679 1.00 0.00 N ATOM 664 CZ ARG A 42 52.472 36.606 28.888 1.00 0.00 C ATOM 665 NH1 ARG A 42 53.479 37.191 29.551 1.00 0.00 N ATOM 666 NH2 ARG A 42 51.882 35.567 29.493 1.00 0.00 N ATOM 0 H ARG A 42 52.428 41.921 23.691 1.00 0.00 H new ATOM 0 HA ARG A 42 50.468 39.662 23.577 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.737 39.054 24.272 1.00 0.00 H new ATOM 0 HB3 ARG A 42 52.712 40.325 25.478 1.00 0.00 H new ATOM 0 HG2 ARG A 42 50.739 39.175 26.566 1.00 0.00 H new ATOM 0 HG3 ARG A 42 50.923 37.863 25.420 1.00 0.00 H new ATOM 0 HD2 ARG A 42 53.347 37.638 26.183 1.00 0.00 H new ATOM 0 HD3 ARG A 42 53.008 38.821 27.431 1.00 0.00 H new ATOM 0 HE ARG A 42 51.232 36.465 27.314 1.00 0.00 H new ATOM 0 HH11 ARG A 42 53.970 37.983 29.137 1.00 0.00 H new ATOM 0 HH12 ARG A 42 53.754 36.844 30.470 1.00 0.00 H new ATOM 0 HH21 ARG A 42 51.114 35.078 29.033 1.00 0.00 H new ATOM 0 HH22 ARG A 42 52.201 35.264 30.413 1.00 0.00 H new ATOM 680 N LEU A 43 48.824 41.113 24.708 1.00 0.00 N ATOM 681 CA LEU A 43 47.797 41.977 25.250 1.00 0.00 C ATOM 682 C LEU A 43 47.073 41.320 26.427 1.00 0.00 C ATOM 683 O LEU A 43 46.708 40.148 26.357 1.00 0.00 O ATOM 684 CB LEU A 43 46.831 42.404 24.147 1.00 0.00 C ATOM 685 CG LEU A 43 47.447 43.129 22.954 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.348 43.512 21.965 1.00 0.00 C ATOM 687 CD2 LEU A 43 48.191 44.399 23.357 1.00 0.00 C ATOM 0 H LEU A 43 48.447 40.339 24.161 1.00 0.00 H new ATOM 0 HA LEU A 43 48.273 42.875 25.644 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.317 41.516 23.780 1.00 0.00 H new ATOM 0 HB3 LEU A 43 46.073 43.052 24.587 1.00 0.00 H new ATOM 0 HG LEU A 43 48.165 42.443 22.504 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.789 44.030 21.113 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.840 42.612 21.619 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.629 44.168 22.456 1.00 0.00 H new ATOM 0 HD21 LEU A 43 48.609 44.873 22.469 1.00 0.00 H new ATOM 0 HD22 LEU A 43 47.500 45.086 23.845 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.997 44.146 24.046 1.00 0.00 H new ATOM 699 N ILE A 44 46.864 42.082 27.497 1.00 0.00 N ATOM 700 CA ILE A 44 46.300 41.632 28.754 1.00 0.00 C ATOM 701 C ILE A 44 45.076 42.469 29.129 1.00 0.00 C ATOM 702 O ILE A 44 45.102 43.692 29.002 1.00 0.00 O ATOM 703 CB ILE A 44 47.344 41.659 29.868 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.710 41.075 29.520 1.00 0.00 C ATOM 705 CG2 ILE A 44 46.810 40.982 31.126 1.00 0.00 C ATOM 706 CD1 ILE A 44 48.775 39.583 29.208 1.00 0.00 C ATOM 0 H ILE A 44 47.096 43.075 27.506 1.00 0.00 H new ATOM 0 HA ILE A 44 45.978 40.598 28.627 1.00 0.00 H new ATOM 0 HB ILE A 44 47.518 42.722 30.035 1.00 0.00 H new ATOM 0 HG12 ILE A 44 49.099 41.617 28.658 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.384 41.275 30.353 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.570 41.013 31.906 1.00 0.00 H new ATOM 0 HG22 ILE A 44 45.917 41.504 31.469 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.561 39.945 30.903 1.00 0.00 H new ATOM 0 HD11 ILE A 44 49.803 39.304 28.978 1.00 0.00 H new ATOM 0 HD12 ILE A 44 48.429 39.015 30.072 1.00 0.00 H new ATOM 0 HD13 ILE A 44 48.139 39.363 28.351 1.00 0.00 H new ATOM 718 N PHE A 45 44.028 41.827 29.636 1.00 0.00 N ATOM 719 CA PHE A 45 42.878 42.452 30.257 1.00 0.00 C ATOM 720 C PHE A 45 42.506 41.728 31.554 1.00 0.00 C ATOM 721 O PHE A 45 42.301 40.516 31.532 1.00 0.00 O ATOM 722 CB PHE A 45 41.691 42.422 29.298 1.00 0.00 C ATOM 723 CG PHE A 45 40.402 42.978 29.854 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.297 44.342 30.156 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.309 42.135 30.084 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.109 44.863 30.681 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.114 42.657 30.597 1.00 0.00 C ATOM 728 CZ PHE A 45 38.012 44.021 30.896 1.00 0.00 C ATOM 0 H PHE A 45 43.960 40.809 29.621 1.00 0.00 H new ATOM 0 HA PHE A 45 43.132 43.486 30.492 1.00 0.00 H new ATOM 0 HB2 PHE A 45 41.954 42.984 28.402 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.520 41.391 28.989 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.139 44.996 29.982 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.387 41.080 29.866 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.039 45.914 30.920 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.269 42.005 30.762 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.090 44.422 31.291 1.00 0.00 H new ATOM 738 N ALA A 46 42.414 42.445 32.670 1.00 0.00 N ATOM 739 CA ALA A 46 42.092 41.902 33.974 1.00 0.00 C ATOM 740 C ALA A 46 42.867 40.627 34.314 1.00 0.00 C ATOM 741 O ALA A 46 42.305 39.623 34.744 1.00 0.00 O ATOM 742 CB ALA A 46 40.576 41.780 34.097 1.00 0.00 C ATOM 0 H ALA A 46 42.568 43.453 32.686 1.00 0.00 H new ATOM 0 HA ALA A 46 42.433 42.595 34.743 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.322 41.372 35.075 1.00 0.00 H new ATOM 0 HB2 ALA A 46 40.122 42.764 33.985 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.200 41.116 33.318 1.00 0.00 H new ATOM 748 N GLY A 47 44.173 40.634 34.064 1.00 0.00 N ATOM 749 CA GLY A 47 45.081 39.516 34.226 1.00 0.00 C ATOM 750 C GLY A 47 45.050 38.450 33.128 1.00 0.00 C ATOM 751 O GLY A 47 45.998 37.676 33.031 1.00 0.00 O ATOM 0 H GLY A 47 44.647 41.470 33.724 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.096 39.907 34.294 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.861 39.033 35.178 1.00 0.00 H new ATOM 755 N LYS A 48 44.023 38.407 32.284 1.00 0.00 N ATOM 756 CA LYS A 48 43.819 37.407 31.256 1.00 0.00 C ATOM 757 C LYS A 48 44.553 37.771 29.964 1.00 0.00 C ATOM 758 O LYS A 48 44.453 38.898 29.486 1.00 0.00 O ATOM 759 CB LYS A 48 42.333 37.215 30.963 1.00 0.00 C ATOM 760 CG LYS A 48 41.410 37.044 32.166 1.00 0.00 C ATOM 761 CD LYS A 48 41.817 36.004 33.204 1.00 0.00 C ATOM 762 CE LYS A 48 42.029 34.609 32.624 1.00 0.00 C ATOM 763 NZ LYS A 48 42.301 33.620 33.679 1.00 0.00 N ATOM 0 H LYS A 48 43.279 39.104 32.304 1.00 0.00 H new ATOM 0 HA LYS A 48 44.230 36.472 31.637 1.00 0.00 H new ATOM 0 HB2 LYS A 48 41.986 38.074 30.389 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.223 36.339 30.324 1.00 0.00 H new ATOM 0 HG2 LYS A 48 41.323 38.008 32.667 1.00 0.00 H new ATOM 0 HG3 LYS A 48 40.417 36.786 31.798 1.00 0.00 H new ATOM 0 HD2 LYS A 48 42.737 36.329 33.690 1.00 0.00 H new ATOM 0 HD3 LYS A 48 41.049 35.954 33.976 1.00 0.00 H new ATOM 0 HE2 LYS A 48 41.144 34.309 32.063 1.00 0.00 H new ATOM 0 HE3 LYS A 48 42.861 34.629 31.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 42.440 32.683 33.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 43.160 33.894 34.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 41.496 33.583 34.336 1.00 0.00 H new ATOM 777 N GLN A 49 45.246 36.803 29.370 1.00 0.00 N ATOM 778 CA GLN A 49 45.899 36.942 28.084 1.00 0.00 C ATOM 779 C GLN A 49 44.885 36.890 26.941 1.00 0.00 C ATOM 780 O GLN A 49 44.056 35.985 26.876 1.00 0.00 O ATOM 781 CB GLN A 49 46.969 35.861 27.964 1.00 0.00 C ATOM 782 CG GLN A 49 47.802 35.983 26.691 1.00 0.00 C ATOM 783 CD GLN A 49 48.937 34.957 26.689 1.00 0.00 C ATOM 784 OE1 GLN A 49 49.959 35.124 27.350 1.00 0.00 O ATOM 785 NE2 GLN A 49 48.804 33.843 25.974 1.00 0.00 N ATOM 0 H GLN A 49 45.368 35.879 29.785 1.00 0.00 H new ATOM 0 HA GLN A 49 46.379 37.918 28.013 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.629 35.914 28.830 1.00 0.00 H new ATOM 0 HB3 GLN A 49 46.492 34.881 27.986 1.00 0.00 H new ATOM 0 HG2 GLN A 49 47.167 35.832 25.818 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.214 36.989 26.615 1.00 0.00 H new ATOM 0 HE21 GLN A 49 47.961 33.690 25.420 1.00 0.00 H new ATOM 0 HE22 GLN A 49 49.545 33.142 25.980 1.00 0.00 H new ATOM 794 N LEU A 50 44.977 37.839 26.014 1.00 0.00 N ATOM 795 CA LEU A 50 44.087 37.967 24.877 1.00 0.00 C ATOM 796 C LEU A 50 44.656 37.247 23.654 1.00 0.00 C ATOM 797 O LEU A 50 45.707 37.625 23.139 1.00 0.00 O ATOM 798 CB LEU A 50 43.822 39.444 24.604 1.00 0.00 C ATOM 799 CG LEU A 50 43.237 40.235 25.770 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.999 41.685 25.358 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.901 39.670 26.242 1.00 0.00 C ATOM 0 H LEU A 50 45.698 38.560 26.039 1.00 0.00 H new ATOM 0 HA LEU A 50 43.135 37.487 25.105 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.759 39.913 24.304 1.00 0.00 H new ATOM 0 HB3 LEU A 50 43.140 39.522 23.757 1.00 0.00 H new ATOM 0 HG LEU A 50 43.962 40.166 26.581 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.581 42.238 26.199 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.944 42.138 25.059 1.00 0.00 H new ATOM 0 HD13 LEU A 50 42.301 41.716 24.521 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.526 40.268 27.073 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.184 39.699 25.422 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.037 38.639 26.569 1.00 0.00 H new ATOM 813 N GLU A 51 43.970 36.207 23.188 1.00 0.00 N ATOM 814 CA GLU A 51 44.440 35.346 22.122 1.00 0.00 C ATOM 815 C GLU A 51 44.054 35.849 20.729 1.00 0.00 C ATOM 816 O GLU A 51 42.919 36.249 20.478 1.00 0.00 O ATOM 817 CB GLU A 51 43.937 33.921 22.334 1.00 0.00 C ATOM 818 CG GLU A 51 44.528 33.207 23.546 1.00 0.00 C ATOM 819 CD GLU A 51 45.972 32.749 23.334 1.00 0.00 C ATOM 820 OE1 GLU A 51 46.872 33.170 24.093 1.00 0.00 O ATOM 821 OE2 GLU A 51 46.237 31.926 22.431 1.00 0.00 O ATOM 0 H GLU A 51 43.055 35.939 23.552 1.00 0.00 H new ATOM 0 HA GLU A 51 45.529 35.359 22.165 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.852 33.945 22.438 1.00 0.00 H new ATOM 0 HB3 GLU A 51 44.159 33.336 21.441 1.00 0.00 H new ATOM 0 HG2 GLU A 51 44.489 33.874 24.407 1.00 0.00 H new ATOM 0 HG3 GLU A 51 43.911 32.341 23.785 1.00 0.00 H new ATOM 828 N ASP A 52 44.986 35.764 19.784 1.00 0.00 N ATOM 829 CA ASP A 52 44.763 36.091 18.390 1.00 0.00 C ATOM 830 C ASP A 52 43.688 35.174 17.805 1.00 0.00 C ATOM 831 O ASP A 52 43.825 33.952 17.813 1.00 0.00 O ATOM 832 CB ASP A 52 46.047 35.994 17.572 1.00 0.00 C ATOM 833 CG ASP A 52 47.184 36.913 18.021 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.357 38.017 17.462 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.975 36.497 18.895 1.00 0.00 O ATOM 0 H ASP A 52 45.939 35.457 19.977 1.00 0.00 H new ATOM 0 HA ASP A 52 44.423 37.125 18.340 1.00 0.00 H new ATOM 0 HB2 ASP A 52 46.401 34.964 17.605 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.812 36.217 16.531 1.00 0.00 H new ATOM 840 N GLY A 53 42.608 35.756 17.293 1.00 0.00 N ATOM 841 CA GLY A 53 41.445 35.061 16.777 1.00 0.00 C ATOM 842 C GLY A 53 40.210 35.097 17.680 1.00 0.00 C ATOM 843 O GLY A 53 39.116 34.817 17.196 1.00 0.00 O ATOM 0 H GLY A 53 42.521 36.770 17.226 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.182 35.493 15.812 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.714 34.020 16.598 1.00 0.00 H new ATOM 847 N ARG A 54 40.320 35.497 18.944 1.00 0.00 N ATOM 848 CA ARG A 54 39.181 35.862 19.762 1.00 0.00 C ATOM 849 C ARG A 54 38.729 37.294 19.470 1.00 0.00 C ATOM 850 O ARG A 54 39.430 38.029 18.777 1.00 0.00 O ATOM 851 CB ARG A 54 39.480 35.650 21.243 1.00 0.00 C ATOM 852 CG ARG A 54 39.705 34.204 21.675 1.00 0.00 C ATOM 853 CD ARG A 54 38.457 33.325 21.690 1.00 0.00 C ATOM 854 NE ARG A 54 38.034 32.856 20.370 1.00 0.00 N ATOM 855 CZ ARG A 54 38.660 31.985 19.567 1.00 0.00 C ATOM 856 NH1 ARG A 54 39.805 31.387 19.922 1.00 0.00 N ATOM 857 NH2 ARG A 54 38.141 31.694 18.366 1.00 0.00 N ATOM 0 H ARG A 54 41.214 35.576 19.428 1.00 0.00 H new ATOM 0 HA ARG A 54 38.352 35.204 19.502 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.367 36.229 21.502 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.653 36.058 21.823 1.00 0.00 H new ATOM 0 HG2 ARG A 54 40.439 33.753 21.007 1.00 0.00 H new ATOM 0 HG3 ARG A 54 40.141 34.204 22.674 1.00 0.00 H new ATOM 0 HD2 ARG A 54 38.644 32.460 22.327 1.00 0.00 H new ATOM 0 HD3 ARG A 54 37.639 33.884 22.143 1.00 0.00 H new ATOM 0 HE ARG A 54 37.156 33.239 20.019 1.00 0.00 H new ATOM 0 HH11 ARG A 54 40.227 31.590 20.828 1.00 0.00 H new ATOM 0 HH12 ARG A 54 40.255 30.729 19.286 1.00 0.00 H new ATOM 0 HH21 ARG A 54 37.272 32.135 18.066 1.00 0.00 H new ATOM 0 HH22 ARG A 54 38.615 31.031 17.752 1.00 0.00 H new ATOM 871 N THR A 55 37.585 37.702 20.012 1.00 0.00 N ATOM 872 CA THR A 55 37.055 39.049 19.953 1.00 0.00 C ATOM 873 C THR A 55 37.049 39.742 21.317 1.00 0.00 C ATOM 874 O THR A 55 37.098 39.090 22.358 1.00 0.00 O ATOM 875 CB THR A 55 35.643 39.104 19.375 1.00 0.00 C ATOM 876 OG1 THR A 55 34.706 38.561 20.277 1.00 0.00 O ATOM 877 CG2 THR A 55 35.499 38.385 18.038 1.00 0.00 C ATOM 0 H THR A 55 36.977 37.066 20.528 1.00 0.00 H new ATOM 0 HA THR A 55 37.734 39.580 19.286 1.00 0.00 H new ATOM 0 HB THR A 55 35.447 40.163 19.207 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.854 37.596 20.361 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.469 38.467 17.690 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.167 38.840 17.306 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.758 37.333 18.161 1.00 0.00 H new ATOM 885 N LEU A 56 36.917 41.065 21.314 1.00 0.00 N ATOM 886 CA LEU A 56 36.765 41.858 22.517 1.00 0.00 C ATOM 887 C LEU A 56 35.571 41.423 23.368 1.00 0.00 C ATOM 888 O LEU A 56 35.666 41.363 24.592 1.00 0.00 O ATOM 889 CB LEU A 56 36.653 43.327 22.120 1.00 0.00 C ATOM 890 CG LEU A 56 37.939 43.930 21.562 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.647 45.313 20.988 1.00 0.00 C ATOM 892 CD2 LEU A 56 39.009 44.083 22.640 1.00 0.00 C ATOM 0 H LEU A 56 36.913 41.620 20.458 1.00 0.00 H new ATOM 0 HA LEU A 56 37.644 41.704 23.143 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.865 43.430 21.374 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.344 43.904 22.992 1.00 0.00 H new ATOM 0 HG LEU A 56 38.308 43.253 20.792 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.566 45.743 20.590 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.910 45.227 20.189 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.256 45.958 21.775 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.908 44.516 22.201 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.639 44.738 23.429 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.245 43.105 23.060 1.00 0.00 H new ATOM 904 N SER A 57 34.463 41.050 22.734 1.00 0.00 N ATOM 905 CA SER A 57 33.279 40.558 23.408 1.00 0.00 C ATOM 906 C SER A 57 33.484 39.245 24.167 1.00 0.00 C ATOM 907 O SER A 57 32.845 39.057 25.201 1.00 0.00 O ATOM 908 CB SER A 57 32.119 40.411 22.427 1.00 0.00 C ATOM 909 OG SER A 57 32.317 39.370 21.496 1.00 0.00 O ATOM 0 H SER A 57 34.367 41.084 21.719 1.00 0.00 H new ATOM 0 HA SER A 57 33.044 41.312 24.159 1.00 0.00 H new ATOM 0 HB2 SER A 57 31.200 40.224 22.983 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.982 41.350 21.891 1.00 0.00 H new ATOM 0 HG SER A 57 33.264 39.328 21.249 1.00 0.00 H new ATOM 915 N ASP A 58 34.395 38.373 23.746 1.00 0.00 N ATOM 916 CA ASP A 58 34.617 37.086 24.374 1.00 0.00 C ATOM 917 C ASP A 58 35.192 37.200 25.788 1.00 0.00 C ATOM 918 O ASP A 58 35.042 36.286 26.594 1.00 0.00 O ATOM 919 CB ASP A 58 35.511 36.225 23.488 1.00 0.00 C ATOM 920 CG ASP A 58 34.868 35.930 22.132 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.692 35.508 22.095 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.520 36.152 21.089 1.00 0.00 O ATOM 0 H ASP A 58 35.005 38.548 22.948 1.00 0.00 H new ATOM 0 HA ASP A 58 33.644 36.607 24.483 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.464 36.732 23.334 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.728 35.286 23.997 1.00 0.00 H new ATOM 927 N TYR A 59 35.788 38.349 26.096 1.00 0.00 N ATOM 928 CA TYR A 59 36.314 38.745 27.386 1.00 0.00 C ATOM 929 C TYR A 59 35.488 39.842 28.061 1.00 0.00 C ATOM 930 O TYR A 59 35.903 40.363 29.093 1.00 0.00 O ATOM 931 CB TYR A 59 37.774 39.157 27.219 1.00 0.00 C ATOM 932 CG TYR A 59 38.678 38.121 26.596 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.343 37.191 27.403 1.00 0.00 C ATOM 934 CD2 TYR A 59 38.897 38.125 25.213 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.239 36.276 26.839 1.00 0.00 C ATOM 936 CE2 TYR A 59 39.796 37.219 24.637 1.00 0.00 C ATOM 937 CZ TYR A 59 40.479 36.293 25.450 1.00 0.00 C ATOM 938 OH TYR A 59 41.362 35.422 24.883 1.00 0.00 O ATOM 0 H TYR A 59 35.922 39.077 25.394 1.00 0.00 H new ATOM 0 HA TYR A 59 36.250 37.888 28.057 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.810 40.059 26.608 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.173 39.419 28.199 1.00 0.00 H new ATOM 0 HD1 TYR A 59 39.164 37.179 28.468 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.370 38.830 24.588 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.746 35.558 27.467 1.00 0.00 H new ATOM 0 HE2 TYR A 59 39.966 37.230 23.570 1.00 0.00 H new ATOM 0 HH TYR A 59 40.932 34.549 24.769 1.00 0.00 H new ATOM 948 N ASN A 60 34.331 40.213 27.520 1.00 0.00 N ATOM 949 CA ASN A 60 33.498 41.298 27.998 1.00 0.00 C ATOM 950 C ASN A 60 34.240 42.627 28.156 1.00 0.00 C ATOM 951 O ASN A 60 34.065 43.351 29.132 1.00 0.00 O ATOM 952 CB ASN A 60 32.697 40.847 29.217 1.00 0.00 C ATOM 953 CG ASN A 60 31.518 41.772 29.526 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.521 42.529 30.493 1.00 0.00 O ATOM 955 ND2 ASN A 60 30.463 41.731 28.717 1.00 0.00 N ATOM 0 H ASN A 60 33.938 39.743 26.704 1.00 0.00 H new ATOM 0 HA ASN A 60 32.771 41.537 27.221 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.326 39.836 29.049 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.356 40.804 30.084 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.657 42.328 28.900 1.00 0.00 H new ATOM 0 HD22 ASN A 60 30.460 41.102 27.914 1.00 0.00 H new ATOM 962 N ILE A 61 35.086 42.965 27.187 1.00 0.00 N ATOM 963 CA ILE A 61 35.771 44.240 27.134 1.00 0.00 C ATOM 964 C ILE A 61 34.780 45.275 26.596 1.00 0.00 C ATOM 965 O ILE A 61 34.504 45.328 25.400 1.00 0.00 O ATOM 966 CB ILE A 61 37.050 44.131 26.307 1.00 0.00 C ATOM 967 CG1 ILE A 61 38.036 43.163 26.955 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.710 45.500 26.165 1.00 0.00 C ATOM 969 CD1 ILE A 61 39.085 42.620 25.988 1.00 0.00 C ATOM 0 H ILE A 61 35.314 42.347 26.408 1.00 0.00 H new ATOM 0 HA ILE A 61 36.098 44.558 28.124 1.00 0.00 H new ATOM 0 HB ILE A 61 36.778 43.754 25.321 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.540 43.668 27.779 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.483 42.328 27.384 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.620 45.405 25.573 1.00 0.00 H new ATOM 0 HG22 ILE A 61 37.023 46.185 25.668 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.958 45.888 27.153 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.751 41.939 26.518 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.590 42.086 25.177 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.664 43.447 25.577 1.00 0.00 H new ATOM 981 N GLN A 62 34.176 46.052 27.490 1.00 0.00 N ATOM 982 CA GLN A 62 33.200 47.077 27.180 1.00 0.00 C ATOM 983 C GLN A 62 33.853 48.435 26.915 1.00 0.00 C ATOM 984 O GLN A 62 35.031 48.631 27.205 1.00 0.00 O ATOM 985 CB GLN A 62 32.201 47.187 28.328 1.00 0.00 C ATOM 986 CG GLN A 62 31.510 45.881 28.712 1.00 0.00 C ATOM 987 CD GLN A 62 30.444 46.076 29.793 1.00 0.00 C ATOM 988 OE1 GLN A 62 29.804 47.119 29.898 1.00 0.00 O ATOM 989 NE2 GLN A 62 30.213 45.084 30.648 1.00 0.00 N ATOM 0 H GLN A 62 34.365 45.977 28.490 1.00 0.00 H new ATOM 0 HA GLN A 62 32.685 46.786 26.264 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.719 47.577 29.204 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.439 47.917 28.057 1.00 0.00 H new ATOM 0 HG2 GLN A 62 31.049 45.444 27.826 1.00 0.00 H new ATOM 0 HG3 GLN A 62 32.256 45.170 29.066 1.00 0.00 H new ATOM 0 HE21 GLN A 62 30.738 44.213 30.572 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.511 45.195 31.380 1.00 0.00 H new ATOM 998 N LYS A 63 33.082 49.411 26.442 1.00 0.00 N ATOM 999 CA LYS A 63 33.441 50.811 26.351 1.00 0.00 C ATOM 1000 C LYS A 63 34.183 51.316 27.591 1.00 0.00 C ATOM 1001 O LYS A 63 33.787 51.028 28.717 1.00 0.00 O ATOM 1002 CB LYS A 63 32.150 51.590 26.114 1.00 0.00 C ATOM 1003 CG LYS A 63 32.269 53.109 26.196 1.00 0.00 C ATOM 1004 CD LYS A 63 30.902 53.755 25.996 1.00 0.00 C ATOM 1005 CE LYS A 63 30.966 55.267 26.198 1.00 0.00 C ATOM 1006 NZ LYS A 63 29.644 55.882 26.008 1.00 0.00 N ATOM 0 H LYS A 63 32.140 49.229 26.095 1.00 0.00 H new ATOM 0 HA LYS A 63 34.140 50.956 25.527 1.00 0.00 H new ATOM 0 HB2 LYS A 63 31.764 51.327 25.129 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.410 51.262 26.844 1.00 0.00 H new ATOM 0 HG2 LYS A 63 32.678 53.397 27.164 1.00 0.00 H new ATOM 0 HG3 LYS A 63 32.964 53.468 25.437 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.537 53.535 24.993 1.00 0.00 H new ATOM 0 HD3 LYS A 63 30.187 53.323 26.696 1.00 0.00 H new ATOM 0 HE2 LYS A 63 31.333 55.488 27.200 1.00 0.00 H new ATOM 0 HE3 LYS A 63 31.677 55.701 25.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 29.715 56.910 26.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 29.307 55.689 25.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 28.973 55.483 26.695 1.00 0.00 H new ATOM 1020 N GLU A 64 35.248 52.080 27.366 1.00 0.00 N ATOM 1021 CA GLU A 64 36.127 52.673 28.354 1.00 0.00 C ATOM 1022 C GLU A 64 36.860 51.685 29.264 1.00 0.00 C ATOM 1023 O GLU A 64 37.340 52.050 30.334 1.00 0.00 O ATOM 1024 CB GLU A 64 35.454 53.848 29.059 1.00 0.00 C ATOM 1025 CG GLU A 64 35.226 55.020 28.108 1.00 0.00 C ATOM 1026 CD GLU A 64 34.404 56.145 28.740 1.00 0.00 C ATOM 1027 OE1 GLU A 64 34.945 57.237 29.017 1.00 0.00 O ATOM 1028 OE2 GLU A 64 33.175 55.978 28.891 1.00 0.00 O ATOM 0 H GLU A 64 35.535 52.315 26.416 1.00 0.00 H new ATOM 0 HA GLU A 64 36.966 53.094 27.801 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.499 53.525 29.474 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.072 54.173 29.896 1.00 0.00 H new ATOM 0 HG2 GLU A 64 36.190 55.416 27.789 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.716 54.662 27.213 1.00 0.00 H new ATOM 1035 N SER A 65 37.014 50.437 28.831 1.00 0.00 N ATOM 1036 CA SER A 65 37.971 49.506 29.394 1.00 0.00 C ATOM 1037 C SER A 65 39.417 49.957 29.178 1.00 0.00 C ATOM 1038 O SER A 65 39.697 50.691 28.233 1.00 0.00 O ATOM 1039 CB SER A 65 37.856 48.125 28.756 1.00 0.00 C ATOM 1040 OG SER A 65 36.589 47.546 28.977 1.00 0.00 O ATOM 0 H SER A 65 36.466 50.043 28.066 1.00 0.00 H new ATOM 0 HA SER A 65 37.736 49.470 30.458 1.00 0.00 H new ATOM 0 HB2 SER A 65 38.037 48.204 27.684 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.629 47.472 29.162 1.00 0.00 H new ATOM 0 HG SER A 65 36.064 47.583 28.150 1.00 0.00 H new ATOM 1046 N THR A 66 40.342 49.444 29.985 1.00 0.00 N ATOM 1047 CA THR A 66 41.771 49.565 29.784 1.00 0.00 C ATOM 1048 C THR A 66 42.414 48.196 29.554 1.00 0.00 C ATOM 1049 O THR A 66 42.243 47.286 30.361 1.00 0.00 O ATOM 1050 CB THR A 66 42.441 50.280 30.953 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.987 51.614 31.024 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.958 50.378 30.812 1.00 0.00 C ATOM 0 H THR A 66 40.102 48.916 30.824 1.00 0.00 H new ATOM 0 HA THR A 66 41.922 50.169 28.889 1.00 0.00 H new ATOM 0 HB THR A 66 42.187 49.690 31.834 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.420 52.067 31.778 1.00 0.00 H new ATOM 0 HG21 THR A 66 44.371 50.897 31.677 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.383 49.376 30.753 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.204 50.931 29.905 1.00 0.00 H new ATOM 1060 N LEU A 67 43.196 48.082 28.483 1.00 0.00 N ATOM 1061 CA LEU A 67 44.086 46.978 28.191 1.00 0.00 C ATOM 1062 C LEU A 67 45.522 47.328 28.591 1.00 0.00 C ATOM 1063 O LEU A 67 45.888 48.501 28.639 1.00 0.00 O ATOM 1064 CB LEU A 67 44.025 46.637 26.705 1.00 0.00 C ATOM 1065 CG LEU A 67 42.643 46.450 26.086 1.00 0.00 C ATOM 1066 CD1 LEU A 67 42.781 46.006 24.632 1.00 0.00 C ATOM 1067 CD2 LEU A 67 41.824 45.397 26.828 1.00 0.00 C ATOM 0 H LEU A 67 43.222 48.801 27.760 1.00 0.00 H new ATOM 0 HA LEU A 67 43.766 46.111 28.768 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.536 47.428 26.156 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.593 45.720 26.546 1.00 0.00 H new ATOM 0 HG LEU A 67 42.129 47.409 26.154 1.00 0.00 H new ATOM 0 HD11 LEU A 67 41.791 45.874 24.196 1.00 0.00 H new ATOM 0 HD12 LEU A 67 43.327 46.764 24.070 1.00 0.00 H new ATOM 0 HD13 LEU A 67 43.324 45.062 24.590 1.00 0.00 H new ATOM 0 HD21 LEU A 67 40.847 45.296 26.355 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.345 44.440 26.794 1.00 0.00 H new ATOM 0 HD23 LEU A 67 41.694 45.702 27.866 1.00 0.00 H new ATOM 1079 N HIS A 68 46.366 46.323 28.802 1.00 0.00 N ATOM 1080 CA HIS A 68 47.802 46.476 28.926 1.00 0.00 C ATOM 1081 C HIS A 68 48.533 45.807 27.760 1.00 0.00 C ATOM 1082 O HIS A 68 48.184 44.698 27.364 1.00 0.00 O ATOM 1083 CB HIS A 68 48.284 45.938 30.271 1.00 0.00 C ATOM 1084 CG HIS A 68 48.473 47.019 31.300 1.00 0.00 C ATOM 1085 ND1 HIS A 68 49.708 47.471 31.761 1.00 0.00 N ATOM 1086 CD2 HIS A 68 47.478 47.730 31.920 1.00 0.00 C ATOM 1087 CE1 HIS A 68 49.440 48.432 32.648 1.00 0.00 C ATOM 1088 NE2 HIS A 68 48.115 48.616 32.767 1.00 0.00 N ATOM 0 H HIS A 68 46.056 45.355 28.893 1.00 0.00 H new ATOM 0 HA HIS A 68 48.036 47.540 28.886 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.564 45.210 30.644 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.227 45.410 30.129 1.00 0.00 H new ATOM 0 HD2 HIS A 68 46.413 47.620 31.776 1.00 0.00 H new ATOM 0 HE1 HIS A 68 50.188 48.986 33.196 1.00 0.00 H new ATOM 0 HE2 HIS A 68 47.658 49.293 33.378 1.00 0.00 H new ATOM 1096 N LEU A 69 49.575 46.464 27.260 1.00 0.00 N ATOM 1097 CA LEU A 69 50.544 45.899 26.342 1.00 0.00 C ATOM 1098 C LEU A 69 51.784 45.445 27.113 1.00 0.00 C ATOM 1099 O LEU A 69 52.347 46.213 27.891 1.00 0.00 O ATOM 1100 CB LEU A 69 50.869 46.940 25.274 1.00 0.00 C ATOM 1101 CG LEU A 69 52.017 46.585 24.333 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.750 45.355 23.472 1.00 0.00 C ATOM 1103 CD2 LEU A 69 52.270 47.759 23.392 1.00 0.00 C ATOM 0 H LEU A 69 49.770 47.437 27.494 1.00 0.00 H new ATOM 0 HA LEU A 69 50.140 45.018 25.844 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.974 47.113 24.677 1.00 0.00 H new ATOM 0 HB3 LEU A 69 51.108 47.881 25.770 1.00 0.00 H new ATOM 0 HG LEU A 69 52.874 46.365 24.969 1.00 0.00 H new ATOM 0 HD11 LEU A 69 52.611 45.166 22.830 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.580 44.491 24.114 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.868 45.527 22.855 1.00 0.00 H new ATOM 0 HD21 LEU A 69 53.089 47.514 22.716 1.00 0.00 H new ATOM 0 HD22 LEU A 69 51.369 47.961 22.812 1.00 0.00 H new ATOM 0 HD23 LEU A 69 52.533 48.642 23.974 1.00 0.00 H new ATOM 1115 N VAL A 70 52.228 44.218 26.854 1.00 0.00 N ATOM 1116 CA VAL A 70 53.501 43.654 27.258 1.00 0.00 C ATOM 1117 C VAL A 70 54.130 42.906 26.082 1.00 0.00 C ATOM 1118 O VAL A 70 53.547 42.832 25.002 1.00 0.00 O ATOM 1119 CB VAL A 70 53.363 42.801 28.514 1.00 0.00 C ATOM 1120 CG1 VAL A 70 52.894 43.623 29.712 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.405 41.623 28.362 1.00 0.00 C ATOM 0 H VAL A 70 51.667 43.553 26.321 1.00 0.00 H new ATOM 0 HA VAL A 70 54.182 44.460 27.532 1.00 0.00 H new ATOM 0 HB VAL A 70 54.368 42.413 28.679 1.00 0.00 H new ATOM 0 HG11 VAL A 70 52.809 42.977 30.586 1.00 0.00 H new ATOM 0 HG12 VAL A 70 53.615 44.415 29.915 1.00 0.00 H new ATOM 0 HG13 VAL A 70 51.922 44.065 29.492 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.362 41.066 29.298 1.00 0.00 H new ATOM 0 HG22 VAL A 70 51.410 41.993 28.114 1.00 0.00 H new ATOM 0 HG23 VAL A 70 52.758 40.968 27.566 1.00 0.00 H new