USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 586 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 Single : A 1 MET CE :methyl -168:sc= -0.174 (180deg=-0.423) USER MOD Single : A 1 MET N :NH3+ 172:sc= 2.18 (180deg=1.87) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 160:sc= -0.0518 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0379 USER MOD Single : A 11 LYS NZ :NH3+ -151:sc= 1.17 (180deg=-0.0268!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -94:sc= 1.05 USER MOD Single : A 20 SER OG : rot -42:sc= 0.0269 USER MOD Single : A 22 THR OG1 : rot 180:sc=0.000738 USER MOD Single : A 25 ASN : amide:sc= -0.996! C(o=-1!,f=-2.6!) USER MOD Single : A 27 LYS NZ :NH3+ 172:sc= 0.497 (180deg=0.254) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.0198 X(o=-0.02,f=0) USER MOD Single : A 33 LYS NZ :NH3+ -117:sc=-0.00505 (180deg=-0.387) USER MOD Single : A 40 GLN : amide:sc= -0.218 K(o=-0.22,f=-3!) USER MOD Single : A 41 GLN : amide:sc= -0.363 K(o=-0.36,f=-2.1) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -2.13! C(o=-2.1!,f=-2.6!) USER MOD Single : A 55 THR OG1 : rot -85:sc= 0.158 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 130:sc= 0.847 USER MOD Single : A 60 ASN : amide:sc=-0.00918 K(o=-0.0092,f=-0.76) USER MOD Single : A 62 GLN : amide:sc= -0.174 K(o=-0.17,f=-1.4!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 87:sc= 0.986 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.259 X(o=-0.26,f=-0.49) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.327 30.745 16.723 1.00 0.00 N ATOM 2 CA MET A 1 13.385 30.591 18.180 1.00 0.00 C ATOM 3 C MET A 1 14.769 31.083 18.626 1.00 0.00 C ATOM 4 O MET A 1 15.734 30.958 17.870 1.00 0.00 O ATOM 5 CB MET A 1 12.938 29.231 18.723 1.00 0.00 C ATOM 6 CG MET A 1 13.999 28.155 18.477 1.00 0.00 C ATOM 7 SD MET A 1 13.807 26.549 19.283 1.00 0.00 S ATOM 8 CE MET A 1 15.475 25.831 19.368 1.00 0.00 C ATOM 0 H1 MET A 1 12.460 30.299 16.361 1.00 0.00 H new ATOM 0 H2 MET A 1 13.323 31.756 16.481 1.00 0.00 H new ATOM 0 H3 MET A 1 14.157 30.289 16.292 1.00 0.00 H new ATOM 0 HA MET A 1 12.620 31.212 18.647 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.740 29.311 19.792 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.002 28.937 18.247 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.051 27.982 17.402 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.962 28.565 18.781 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.405 24.780 19.647 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.958 25.916 18.395 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.064 26.366 20.113 1.00 0.00 H new ATOM 20 N GLN A 2 14.935 31.759 19.758 1.00 0.00 N ATOM 21 CA GLN A 2 16.217 32.063 20.360 1.00 0.00 C ATOM 22 C GLN A 2 16.954 30.915 21.053 1.00 0.00 C ATOM 23 O GLN A 2 16.323 30.073 21.690 1.00 0.00 O ATOM 24 CB GLN A 2 16.101 33.172 21.417 1.00 0.00 C ATOM 25 CG GLN A 2 15.316 34.453 21.121 1.00 0.00 C ATOM 26 CD GLN A 2 15.950 35.336 20.060 1.00 0.00 C ATOM 27 OE1 GLN A 2 17.147 35.301 19.766 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.186 36.103 19.291 1.00 0.00 N ATOM 0 H GLN A 2 14.148 32.121 20.297 1.00 0.00 H new ATOM 0 HA GLN A 2 16.796 32.351 19.483 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.659 32.723 22.306 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.115 33.471 21.681 1.00 0.00 H new ATOM 0 HG2 GLN A 2 14.309 34.184 20.801 1.00 0.00 H new ATOM 0 HG3 GLN A 2 15.215 35.026 22.043 1.00 0.00 H new ATOM 0 HE21 GLN A 2 14.186 36.178 19.478 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.599 36.617 18.513 1.00 0.00 H new ATOM 37 N ILE A 3 18.274 30.975 20.962 1.00 0.00 N ATOM 38 CA ILE A 3 19.205 30.178 21.748 1.00 0.00 C ATOM 39 C ILE A 3 20.256 31.126 22.334 1.00 0.00 C ATOM 40 O ILE A 3 20.757 31.910 21.535 1.00 0.00 O ATOM 41 CB ILE A 3 19.740 28.882 21.133 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.575 29.240 19.910 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.552 27.940 20.910 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.361 28.133 19.214 1.00 0.00 C ATOM 0 H ILE A 3 18.745 31.605 20.313 1.00 0.00 H new ATOM 0 HA ILE A 3 18.634 29.717 22.554 1.00 0.00 H new ATOM 0 HB ILE A 3 20.422 28.330 21.780 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.908 29.686 19.173 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.284 30.013 20.208 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.905 27.007 20.472 1.00 0.00 H new ATOM 0 HG22 ILE A 3 18.068 27.732 21.864 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.837 28.410 20.235 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.901 28.550 18.364 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.071 27.694 19.916 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.673 27.363 18.864 1.00 0.00 H new ATOM 56 N PHE A 4 20.592 31.022 23.613 1.00 0.00 N ATOM 57 CA PHE A 4 21.544 31.929 24.224 1.00 0.00 C ATOM 58 C PHE A 4 22.719 31.056 24.674 1.00 0.00 C ATOM 59 O PHE A 4 22.537 30.222 25.555 1.00 0.00 O ATOM 60 CB PHE A 4 20.829 32.600 25.397 1.00 0.00 C ATOM 61 CG PHE A 4 20.016 33.816 25.025 1.00 0.00 C ATOM 62 CD1 PHE A 4 18.730 33.756 24.454 1.00 0.00 C ATOM 63 CD2 PHE A 4 20.417 35.052 25.538 1.00 0.00 C ATOM 64 CE1 PHE A 4 17.966 34.918 24.394 1.00 0.00 C ATOM 65 CE2 PHE A 4 19.675 36.234 25.411 1.00 0.00 C ATOM 66 CZ PHE A 4 18.432 36.183 24.765 1.00 0.00 C ATOM 0 H PHE A 4 20.216 30.316 24.246 1.00 0.00 H new ATOM 0 HA PHE A 4 21.913 32.712 23.562 1.00 0.00 H new ATOM 0 HB2 PHE A 4 20.172 31.871 25.870 1.00 0.00 H new ATOM 0 HB3 PHE A 4 21.572 32.889 26.141 1.00 0.00 H new ATOM 0 HD1 PHE A 4 18.343 32.824 24.069 1.00 0.00 H new ATOM 0 HD2 PHE A 4 21.358 35.100 26.066 1.00 0.00 H new ATOM 0 HE1 PHE A 4 16.949 34.837 24.039 1.00 0.00 H new ATOM 0 HE2 PHE A 4 20.054 37.166 25.803 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.862 37.078 24.564 1.00 0.00 H new ATOM 76 N VAL A 5 23.864 31.128 24.008 1.00 0.00 N ATOM 77 CA VAL A 5 25.021 30.268 24.131 1.00 0.00 C ATOM 78 C VAL A 5 26.081 31.125 24.830 1.00 0.00 C ATOM 79 O VAL A 5 26.438 32.150 24.251 1.00 0.00 O ATOM 80 CB VAL A 5 25.465 29.802 22.743 1.00 0.00 C ATOM 81 CG1 VAL A 5 26.562 28.744 22.654 1.00 0.00 C ATOM 82 CG2 VAL A 5 24.223 29.498 21.895 1.00 0.00 C ATOM 0 H VAL A 5 24.014 31.855 23.308 1.00 0.00 H new ATOM 0 HA VAL A 5 24.826 29.361 24.703 1.00 0.00 H new ATOM 0 HB VAL A 5 26.012 30.644 22.318 1.00 0.00 H new ATOM 0 HG11 VAL A 5 26.766 28.518 21.607 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.469 29.120 23.128 1.00 0.00 H new ATOM 0 HG13 VAL A 5 26.235 27.837 23.163 1.00 0.00 H new ATOM 0 HG21 VAL A 5 24.532 29.165 20.904 1.00 0.00 H new ATOM 0 HG22 VAL A 5 23.638 28.714 22.375 1.00 0.00 H new ATOM 0 HG23 VAL A 5 23.616 30.399 21.803 1.00 0.00 H new ATOM 92 N LYS A 6 26.519 30.626 25.983 1.00 0.00 N ATOM 93 CA LYS A 6 27.550 31.321 26.728 1.00 0.00 C ATOM 94 C LYS A 6 28.951 30.769 26.445 1.00 0.00 C ATOM 95 O LYS A 6 29.076 29.587 26.109 1.00 0.00 O ATOM 96 CB LYS A 6 27.320 31.130 28.220 1.00 0.00 C ATOM 97 CG LYS A 6 26.185 31.919 28.879 1.00 0.00 C ATOM 98 CD LYS A 6 26.293 31.940 30.406 1.00 0.00 C ATOM 99 CE LYS A 6 25.198 32.705 31.153 1.00 0.00 C ATOM 100 NZ LYS A 6 25.617 33.188 32.477 1.00 0.00 N ATOM 0 H LYS A 6 26.182 29.763 26.409 1.00 0.00 H new ATOM 0 HA LYS A 6 27.494 32.366 26.423 1.00 0.00 H new ATOM 0 HB2 LYS A 6 27.136 30.070 28.397 1.00 0.00 H new ATOM 0 HB3 LYS A 6 28.246 31.383 28.736 1.00 0.00 H new ATOM 0 HG2 LYS A 6 26.193 32.942 28.504 1.00 0.00 H new ATOM 0 HG3 LYS A 6 25.229 31.482 28.592 1.00 0.00 H new ATOM 0 HD2 LYS A 6 26.295 30.910 30.763 1.00 0.00 H new ATOM 0 HD3 LYS A 6 27.257 32.373 30.675 1.00 0.00 H new ATOM 0 HE2 LYS A 6 24.883 33.555 30.548 1.00 0.00 H new ATOM 0 HE3 LYS A 6 24.329 32.058 31.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 24.829 33.696 32.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.891 32.379 33.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 26.428 33.831 32.371 1.00 0.00 H new ATOM 114 N THR A 7 30.018 31.550 26.517 1.00 0.00 N ATOM 115 CA THR A 7 31.387 31.084 26.665 1.00 0.00 C ATOM 116 C THR A 7 31.807 31.586 28.051 1.00 0.00 C ATOM 117 O THR A 7 31.631 32.765 28.338 1.00 0.00 O ATOM 118 CB THR A 7 32.239 31.722 25.558 1.00 0.00 C ATOM 119 OG1 THR A 7 32.015 33.121 25.484 1.00 0.00 O ATOM 120 CG2 THR A 7 31.856 31.257 24.158 1.00 0.00 C ATOM 0 H THR A 7 29.950 32.567 26.472 1.00 0.00 H new ATOM 0 HA THR A 7 31.502 30.003 26.582 1.00 0.00 H new ATOM 0 HB THR A 7 33.259 31.441 25.822 1.00 0.00 H new ATOM 0 HG1 THR A 7 32.766 33.549 25.023 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.497 31.746 23.424 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.981 30.177 24.086 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.816 31.515 23.961 1.00 0.00 H new ATOM 128 N LEU A 8 32.502 30.718 28.778 1.00 0.00 N ATOM 129 CA LEU A 8 32.926 30.904 30.153 1.00 0.00 C ATOM 130 C LEU A 8 33.704 32.181 30.453 1.00 0.00 C ATOM 131 O LEU A 8 33.578 32.818 31.498 1.00 0.00 O ATOM 132 CB LEU A 8 33.657 29.642 30.623 1.00 0.00 C ATOM 133 CG LEU A 8 32.566 28.572 30.739 1.00 0.00 C ATOM 134 CD1 LEU A 8 33.107 27.147 30.580 1.00 0.00 C ATOM 135 CD2 LEU A 8 31.889 28.657 32.109 1.00 0.00 C ATOM 0 H LEU A 8 32.799 29.818 28.399 1.00 0.00 H new ATOM 0 HA LEU A 8 32.016 31.054 30.735 1.00 0.00 H new ATOM 0 HB2 LEU A 8 34.428 29.344 29.912 1.00 0.00 H new ATOM 0 HB3 LEU A 8 34.152 29.806 31.580 1.00 0.00 H new ATOM 0 HG LEU A 8 31.863 28.771 29.930 1.00 0.00 H new ATOM 0 HD11 LEU A 8 32.287 26.434 30.672 1.00 0.00 H new ATOM 0 HD12 LEU A 8 33.571 27.041 29.600 1.00 0.00 H new ATOM 0 HD13 LEU A 8 33.847 26.950 31.355 1.00 0.00 H new ATOM 0 HD21 LEU A 8 31.116 27.892 32.181 1.00 0.00 H new ATOM 0 HD22 LEU A 8 32.631 28.498 32.892 1.00 0.00 H new ATOM 0 HD23 LEU A 8 31.438 29.642 32.232 1.00 0.00 H new ATOM 147 N THR A 9 34.508 32.530 29.459 1.00 0.00 N ATOM 148 CA THR A 9 35.472 33.614 29.373 1.00 0.00 C ATOM 149 C THR A 9 34.826 34.981 29.221 1.00 0.00 C ATOM 150 O THR A 9 35.505 35.992 29.383 1.00 0.00 O ATOM 151 CB THR A 9 36.513 33.205 28.324 1.00 0.00 C ATOM 152 OG1 THR A 9 35.847 32.956 27.112 1.00 0.00 O ATOM 153 CG2 THR A 9 37.232 31.893 28.629 1.00 0.00 C ATOM 0 H THR A 9 34.497 31.995 28.591 1.00 0.00 H new ATOM 0 HA THR A 9 36.003 33.761 30.313 1.00 0.00 H new ATOM 0 HB THR A 9 37.236 34.021 28.301 1.00 0.00 H new ATOM 0 HG1 THR A 9 36.499 32.694 26.428 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.950 31.679 27.837 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.756 31.978 29.581 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.504 31.084 28.687 1.00 0.00 H new ATOM 161 N GLY A 10 33.523 35.102 28.951 1.00 0.00 N ATOM 162 CA GLY A 10 32.736 36.308 28.999 1.00 0.00 C ATOM 163 C GLY A 10 32.154 36.723 27.650 1.00 0.00 C ATOM 164 O GLY A 10 32.388 37.851 27.224 1.00 0.00 O ATOM 0 H GLY A 10 32.964 34.295 28.675 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.920 36.169 29.708 1.00 0.00 H new ATOM 0 HA3 GLY A 10 33.356 37.119 29.381 1.00 0.00 H new ATOM 168 N LYS A 11 31.421 35.882 26.923 1.00 0.00 N ATOM 169 CA LYS A 11 30.594 36.247 25.778 1.00 0.00 C ATOM 170 C LYS A 11 29.289 35.456 25.770 1.00 0.00 C ATOM 171 O LYS A 11 29.297 34.255 26.011 1.00 0.00 O ATOM 172 CB LYS A 11 31.359 36.254 24.463 1.00 0.00 C ATOM 173 CG LYS A 11 30.629 36.891 23.283 1.00 0.00 C ATOM 174 CD LYS A 11 31.471 37.090 22.021 1.00 0.00 C ATOM 175 CE LYS A 11 31.059 38.328 21.218 1.00 0.00 C ATOM 176 NZ LYS A 11 32.066 38.798 20.267 1.00 0.00 N ATOM 0 H LYS A 11 31.387 34.883 27.126 1.00 0.00 H new ATOM 0 HA LYS A 11 30.301 37.290 25.894 1.00 0.00 H new ATOM 0 HB2 LYS A 11 32.301 36.782 24.613 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.608 35.225 24.202 1.00 0.00 H new ATOM 0 HG2 LYS A 11 29.769 36.270 23.032 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.242 37.860 23.597 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.521 37.178 22.301 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.382 36.207 21.388 1.00 0.00 H new ATOM 0 HE2 LYS A 11 30.141 38.104 20.674 1.00 0.00 H new ATOM 0 HE3 LYS A 11 30.829 39.136 21.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 31.969 39.825 20.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 33.016 38.584 20.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 31.931 38.320 19.353 1.00 0.00 H new ATOM 190 N THR A 12 28.178 36.057 25.349 1.00 0.00 N ATOM 191 CA THR A 12 26.960 35.331 25.051 1.00 0.00 C ATOM 192 C THR A 12 26.637 35.718 23.602 1.00 0.00 C ATOM 193 O THR A 12 26.323 36.854 23.250 1.00 0.00 O ATOM 194 CB THR A 12 25.851 35.580 26.078 1.00 0.00 C ATOM 195 OG1 THR A 12 26.253 35.319 27.408 1.00 0.00 O ATOM 196 CG2 THR A 12 24.602 34.742 25.855 1.00 0.00 C ATOM 0 H THR A 12 28.104 37.064 25.207 1.00 0.00 H new ATOM 0 HA THR A 12 27.071 34.250 25.132 1.00 0.00 H new ATOM 0 HB THR A 12 25.631 36.638 25.932 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.506 35.497 28.017 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.865 34.976 26.623 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.186 34.964 24.872 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.859 33.684 25.910 1.00 0.00 H new ATOM 204 N ILE A 13 26.657 34.699 22.742 1.00 0.00 N ATOM 205 CA ILE A 13 26.023 34.706 21.445 1.00 0.00 C ATOM 206 C ILE A 13 24.547 34.402 21.734 1.00 0.00 C ATOM 207 O ILE A 13 24.232 33.369 22.319 1.00 0.00 O ATOM 208 CB ILE A 13 26.724 33.646 20.603 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.224 33.901 20.379 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.034 33.318 19.277 1.00 0.00 C ATOM 211 CD1 ILE A 13 28.655 34.954 19.367 1.00 0.00 C ATOM 0 H ILE A 13 27.134 33.821 22.947 1.00 0.00 H new ATOM 0 HA ILE A 13 26.088 35.641 20.889 1.00 0.00 H new ATOM 0 HB ILE A 13 26.636 32.761 21.232 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.658 34.174 21.341 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.677 32.955 20.082 1.00 0.00 H new ATOM 0 HG21 ILE A 13 26.605 32.555 18.749 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.028 32.948 19.472 1.00 0.00 H new ATOM 0 HG23 ILE A 13 25.977 34.218 18.664 1.00 0.00 H new ATOM 0 HD11 ILE A 13 29.743 35.004 19.335 1.00 0.00 H new ATOM 0 HD12 ILE A 13 28.275 34.688 18.381 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.256 35.925 19.660 1.00 0.00 H new ATOM 223 N THR A 14 23.691 35.359 21.385 1.00 0.00 N ATOM 224 CA THR A 14 22.267 35.108 21.278 1.00 0.00 C ATOM 225 C THR A 14 22.156 34.748 19.800 1.00 0.00 C ATOM 226 O THR A 14 22.648 35.457 18.929 1.00 0.00 O ATOM 227 CB THR A 14 21.548 36.408 21.641 1.00 0.00 C ATOM 228 OG1 THR A 14 21.609 36.578 23.038 1.00 0.00 O ATOM 229 CG2 THR A 14 20.058 36.477 21.300 1.00 0.00 C ATOM 0 H THR A 14 23.966 36.318 21.172 1.00 0.00 H new ATOM 0 HA THR A 14 21.838 34.339 21.921 1.00 0.00 H new ATOM 0 HB THR A 14 22.059 37.168 21.051 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.802 36.204 23.449 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.660 37.445 21.604 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.924 36.351 20.226 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.527 35.684 21.827 1.00 0.00 H new ATOM 237 N LEU A 15 21.538 33.624 19.446 1.00 0.00 N ATOM 238 CA LEU A 15 21.334 33.177 18.085 1.00 0.00 C ATOM 239 C LEU A 15 19.829 32.935 17.904 1.00 0.00 C ATOM 240 O LEU A 15 19.203 32.407 18.815 1.00 0.00 O ATOM 241 CB LEU A 15 22.208 31.972 17.727 1.00 0.00 C ATOM 242 CG LEU A 15 23.461 32.273 16.916 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.277 30.992 16.792 1.00 0.00 C ATOM 244 CD2 LEU A 15 23.172 32.811 15.514 1.00 0.00 C ATOM 0 H LEU A 15 21.152 32.978 20.134 1.00 0.00 H new ATOM 0 HA LEU A 15 21.657 33.941 17.378 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.508 31.478 18.651 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.600 31.261 17.168 1.00 0.00 H new ATOM 0 HG LEU A 15 24.004 33.055 17.446 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.179 31.190 16.213 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.553 30.639 17.786 1.00 0.00 H new ATOM 0 HD13 LEU A 15 23.683 30.229 16.288 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.112 33.002 14.997 1.00 0.00 H new ATOM 0 HD22 LEU A 15 22.593 32.076 14.955 1.00 0.00 H new ATOM 0 HD23 LEU A 15 22.605 33.739 15.590 1.00 0.00 H new ATOM 256 N GLU A 16 19.347 33.328 16.723 1.00 0.00 N ATOM 257 CA GLU A 16 18.066 32.811 16.283 1.00 0.00 C ATOM 258 C GLU A 16 18.248 31.562 15.429 1.00 0.00 C ATOM 259 O GLU A 16 18.939 31.537 14.405 1.00 0.00 O ATOM 260 CB GLU A 16 17.430 33.958 15.505 1.00 0.00 C ATOM 261 CG GLU A 16 15.935 34.153 15.791 1.00 0.00 C ATOM 262 CD GLU A 16 14.996 33.052 15.334 1.00 0.00 C ATOM 263 OE1 GLU A 16 15.335 32.171 14.506 1.00 0.00 O ATOM 264 OE2 GLU A 16 13.825 33.035 15.774 1.00 0.00 O ATOM 0 H GLU A 16 19.807 33.975 16.083 1.00 0.00 H new ATOM 0 HA GLU A 16 17.432 32.498 17.113 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.958 34.881 15.742 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.565 33.779 14.438 1.00 0.00 H new ATOM 0 HG2 GLU A 16 15.810 34.280 16.866 1.00 0.00 H new ATOM 0 HG3 GLU A 16 15.619 35.084 15.321 1.00 0.00 H new ATOM 271 N VAL A 17 17.494 30.514 15.741 1.00 0.00 N ATOM 272 CA VAL A 17 17.462 29.225 15.085 1.00 0.00 C ATOM 273 C VAL A 17 16.017 28.752 14.862 1.00 0.00 C ATOM 274 O VAL A 17 15.113 29.146 15.589 1.00 0.00 O ATOM 275 CB VAL A 17 18.295 28.229 15.896 1.00 0.00 C ATOM 276 CG1 VAL A 17 19.789 28.506 15.691 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.956 28.194 17.381 1.00 0.00 C ATOM 0 H VAL A 17 16.840 30.554 16.522 1.00 0.00 H new ATOM 0 HA VAL A 17 17.905 29.305 14.092 1.00 0.00 H new ATOM 0 HB VAL A 17 18.041 27.240 15.515 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.374 27.793 16.272 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.036 28.404 14.634 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.020 29.519 16.021 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.591 27.463 17.882 1.00 0.00 H new ATOM 0 HG22 VAL A 17 18.124 29.179 17.816 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.910 27.914 17.509 1.00 0.00 H new ATOM 287 N GLU A 18 15.771 27.824 13.950 1.00 0.00 N ATOM 288 CA GLU A 18 14.627 26.933 13.916 1.00 0.00 C ATOM 289 C GLU A 18 14.755 25.803 14.937 1.00 0.00 C ATOM 290 O GLU A 18 15.907 25.457 15.213 1.00 0.00 O ATOM 291 CB GLU A 18 14.730 26.362 12.503 1.00 0.00 C ATOM 292 CG GLU A 18 13.884 27.185 11.528 1.00 0.00 C ATOM 293 CD GLU A 18 12.391 27.230 11.775 1.00 0.00 C ATOM 294 OE1 GLU A 18 11.811 26.147 12.003 1.00 0.00 O ATOM 295 OE2 GLU A 18 11.780 28.273 11.446 1.00 0.00 O ATOM 0 H GLU A 18 16.405 27.665 13.167 1.00 0.00 H new ATOM 0 HA GLU A 18 13.687 27.432 14.150 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.771 26.362 12.180 1.00 0.00 H new ATOM 0 HB3 GLU A 18 14.395 25.325 12.498 1.00 0.00 H new ATOM 0 HG2 GLU A 18 14.259 28.209 11.536 1.00 0.00 H new ATOM 0 HG3 GLU A 18 14.049 26.793 10.524 1.00 0.00 H new ATOM 302 N PRO A 19 13.719 25.226 15.539 1.00 0.00 N ATOM 303 CA PRO A 19 13.929 24.114 16.432 1.00 0.00 C ATOM 304 C PRO A 19 14.523 22.867 15.775 1.00 0.00 C ATOM 305 O PRO A 19 15.174 22.114 16.496 1.00 0.00 O ATOM 306 CB PRO A 19 12.542 23.793 17.008 1.00 0.00 C ATOM 307 CG PRO A 19 11.524 24.724 16.330 1.00 0.00 C ATOM 308 CD PRO A 19 12.344 25.698 15.481 1.00 0.00 C ATOM 0 HA PRO A 19 14.666 24.396 17.184 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.285 22.749 16.826 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.534 23.940 18.088 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.828 24.157 15.711 1.00 0.00 H new ATOM 0 HG3 PRO A 19 10.929 25.258 17.071 1.00 0.00 H new ATOM 0 HD2 PRO A 19 11.982 25.719 14.453 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.264 26.714 15.867 1.00 0.00 H new ATOM 316 N SER A 20 14.360 22.661 14.472 1.00 0.00 N ATOM 317 CA SER A 20 14.873 21.584 13.651 1.00 0.00 C ATOM 318 C SER A 20 16.091 22.006 12.835 1.00 0.00 C ATOM 319 O SER A 20 16.560 21.238 11.997 1.00 0.00 O ATOM 320 CB SER A 20 13.821 20.999 12.711 1.00 0.00 C ATOM 321 OG SER A 20 13.991 19.723 12.128 1.00 0.00 O ATOM 0 H SER A 20 13.809 23.314 13.915 1.00 0.00 H new ATOM 0 HA SER A 20 15.170 20.810 14.359 1.00 0.00 H new ATOM 0 HB2 SER A 20 12.880 20.975 13.261 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.694 21.709 11.893 1.00 0.00 H new ATOM 0 HG SER A 20 14.918 19.622 11.827 1.00 0.00 H new ATOM 327 N ASP A 21 16.819 23.060 13.197 1.00 0.00 N ATOM 328 CA ASP A 21 18.106 23.412 12.635 1.00 0.00 C ATOM 329 C ASP A 21 19.229 22.614 13.310 1.00 0.00 C ATOM 330 O ASP A 21 19.072 22.049 14.388 1.00 0.00 O ATOM 331 CB ASP A 21 18.478 24.844 13.012 1.00 0.00 C ATOM 332 CG ASP A 21 19.414 25.543 12.039 1.00 0.00 C ATOM 333 OD1 ASP A 21 20.096 24.799 11.307 1.00 0.00 O ATOM 334 OD2 ASP A 21 19.516 26.785 11.926 1.00 0.00 O ATOM 0 H ASP A 21 16.510 23.712 13.918 1.00 0.00 H new ATOM 0 HA ASP A 21 18.019 23.238 11.562 1.00 0.00 H new ATOM 0 HB2 ASP A 21 17.563 25.430 13.097 1.00 0.00 H new ATOM 0 HB3 ASP A 21 18.944 24.835 13.997 1.00 0.00 H new ATOM 339 N THR A 22 20.319 22.468 12.564 1.00 0.00 N ATOM 340 CA THR A 22 21.353 21.556 12.991 1.00 0.00 C ATOM 341 C THR A 22 22.270 22.183 14.051 1.00 0.00 C ATOM 342 O THR A 22 22.459 23.399 14.054 1.00 0.00 O ATOM 343 CB THR A 22 22.131 20.953 11.819 1.00 0.00 C ATOM 344 OG1 THR A 22 22.682 21.882 10.916 1.00 0.00 O ATOM 345 CG2 THR A 22 21.434 19.827 11.046 1.00 0.00 C ATOM 0 H THR A 22 20.500 22.957 11.687 1.00 0.00 H new ATOM 0 HA THR A 22 20.848 20.718 13.472 1.00 0.00 H new ATOM 0 HB THR A 22 22.954 20.493 12.366 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.159 21.404 10.206 1.00 0.00 H new ATOM 0 HG21 THR A 22 22.083 19.482 10.241 1.00 0.00 H new ATOM 0 HG22 THR A 22 21.223 18.998 11.722 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.500 20.199 10.625 1.00 0.00 H new ATOM 353 N ILE A 23 22.891 21.402 14.929 1.00 0.00 N ATOM 354 CA ILE A 23 23.965 21.849 15.802 1.00 0.00 C ATOM 355 C ILE A 23 25.219 22.199 15.001 1.00 0.00 C ATOM 356 O ILE A 23 26.009 23.047 15.424 1.00 0.00 O ATOM 357 CB ILE A 23 24.236 20.674 16.745 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.124 20.557 17.791 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.613 20.409 17.340 1.00 0.00 C ATOM 360 CD1 ILE A 23 23.351 21.568 18.913 1.00 0.00 C ATOM 0 H ILE A 23 22.654 20.418 15.054 1.00 0.00 H new ATOM 0 HA ILE A 23 23.688 22.753 16.345 1.00 0.00 H new ATOM 0 HB ILE A 23 24.235 19.858 16.023 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.155 20.732 17.324 1.00 0.00 H new ATOM 0 HG13 ILE A 23 23.103 19.547 18.200 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.570 19.526 17.977 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.331 20.242 16.537 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.925 21.269 17.933 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.555 21.477 19.652 1.00 0.00 H new ATOM 0 HD12 ILE A 23 24.312 21.373 19.389 1.00 0.00 H new ATOM 0 HD13 ILE A 23 23.349 22.577 18.500 1.00 0.00 H new ATOM 372 N GLU A 24 25.252 21.815 13.730 1.00 0.00 N ATOM 373 CA GLU A 24 26.268 22.269 12.800 1.00 0.00 C ATOM 374 C GLU A 24 26.074 23.743 12.438 1.00 0.00 C ATOM 375 O GLU A 24 27.045 24.499 12.443 1.00 0.00 O ATOM 376 CB GLU A 24 26.350 21.373 11.556 1.00 0.00 C ATOM 377 CG GLU A 24 26.957 19.983 11.752 1.00 0.00 C ATOM 378 CD GLU A 24 26.938 19.170 10.461 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.427 19.676 9.426 1.00 0.00 O ATOM 380 OE2 GLU A 24 26.478 18.012 10.577 1.00 0.00 O ATOM 0 H GLU A 24 24.570 21.178 13.318 1.00 0.00 H new ATOM 0 HA GLU A 24 27.231 22.186 13.304 1.00 0.00 H new ATOM 0 HB2 GLU A 24 25.343 21.252 11.157 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.933 21.896 10.798 1.00 0.00 H new ATOM 0 HG2 GLU A 24 27.984 20.081 12.105 1.00 0.00 H new ATOM 0 HG3 GLU A 24 26.404 19.450 12.525 1.00 0.00 H new ATOM 387 N ASN A 25 24.836 24.112 12.138 1.00 0.00 N ATOM 388 CA ASN A 25 24.463 25.485 11.868 1.00 0.00 C ATOM 389 C ASN A 25 24.869 26.480 12.948 1.00 0.00 C ATOM 390 O ASN A 25 25.240 27.603 12.615 1.00 0.00 O ATOM 391 CB ASN A 25 22.997 25.588 11.471 1.00 0.00 C ATOM 392 CG ASN A 25 22.695 26.684 10.452 1.00 0.00 C ATOM 393 OD1 ASN A 25 23.525 26.967 9.583 1.00 0.00 O ATOM 394 ND2 ASN A 25 21.479 27.217 10.511 1.00 0.00 N ATOM 0 H ASN A 25 24.058 23.456 12.076 1.00 0.00 H new ATOM 0 HA ASN A 25 25.058 25.793 11.008 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.676 24.630 11.062 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.402 25.768 12.367 1.00 0.00 H new ATOM 0 HD21 ASN A 25 21.187 27.901 9.813 1.00 0.00 H new ATOM 0 HD22 ASN A 25 20.837 26.942 11.255 1.00 0.00 H new ATOM 401 N VAL A 26 24.864 26.091 14.223 1.00 0.00 N ATOM 402 CA VAL A 26 25.248 26.953 15.329 1.00 0.00 C ATOM 403 C VAL A 26 26.769 27.133 15.301 1.00 0.00 C ATOM 404 O VAL A 26 27.215 28.264 15.466 1.00 0.00 O ATOM 405 CB VAL A 26 24.744 26.369 16.645 1.00 0.00 C ATOM 406 CG1 VAL A 26 25.161 27.193 17.868 1.00 0.00 C ATOM 407 CG2 VAL A 26 23.227 26.153 16.654 1.00 0.00 C ATOM 0 H VAL A 26 24.588 25.154 14.516 1.00 0.00 H new ATOM 0 HA VAL A 26 24.791 27.938 15.233 1.00 0.00 H new ATOM 0 HB VAL A 26 25.228 25.395 16.718 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.771 26.725 18.772 1.00 0.00 H new ATOM 0 HG12 VAL A 26 26.249 27.238 17.923 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.760 28.203 17.780 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.925 25.736 17.615 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.723 27.107 16.498 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.953 25.463 15.856 1.00 0.00 H new ATOM 417 N LYS A 27 27.592 26.122 15.026 1.00 0.00 N ATOM 418 CA LYS A 27 29.035 26.223 14.985 1.00 0.00 C ATOM 419 C LYS A 27 29.499 27.033 13.764 1.00 0.00 C ATOM 420 O LYS A 27 30.496 27.748 13.794 1.00 0.00 O ATOM 421 CB LYS A 27 29.634 24.813 14.926 1.00 0.00 C ATOM 422 CG LYS A 27 29.088 23.842 15.981 1.00 0.00 C ATOM 423 CD LYS A 27 29.579 22.413 15.763 1.00 0.00 C ATOM 424 CE LYS A 27 30.996 22.129 16.264 1.00 0.00 C ATOM 425 NZ LYS A 27 31.431 20.754 16.007 1.00 0.00 N ATOM 0 H LYS A 27 27.253 25.182 14.820 1.00 0.00 H new ATOM 0 HA LYS A 27 29.375 26.739 15.883 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.449 24.395 13.936 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.715 24.887 15.044 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.389 24.180 16.973 1.00 0.00 H new ATOM 0 HG3 LYS A 27 27.998 23.857 15.956 1.00 0.00 H new ATOM 0 HD2 LYS A 27 28.891 21.729 16.260 1.00 0.00 H new ATOM 0 HD3 LYS A 27 29.536 22.189 14.697 1.00 0.00 H new ATOM 0 HE2 LYS A 27 31.690 22.819 15.784 1.00 0.00 H new ATOM 0 HE3 LYS A 27 31.042 22.324 17.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 32.439 20.659 16.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.875 20.099 16.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.288 20.527 15.002 1.00 0.00 H new ATOM 439 N ALA A 28 28.796 26.830 12.658 1.00 0.00 N ATOM 440 CA ALA A 28 28.987 27.481 11.384 1.00 0.00 C ATOM 441 C ALA A 28 28.856 29.001 11.497 1.00 0.00 C ATOM 442 O ALA A 28 29.845 29.644 11.131 1.00 0.00 O ATOM 443 CB ALA A 28 27.908 27.053 10.379 1.00 0.00 C ATOM 0 H ALA A 28 28.027 26.160 12.633 1.00 0.00 H new ATOM 0 HA ALA A 28 29.986 27.195 11.056 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.076 27.558 9.428 1.00 0.00 H new ATOM 0 HB2 ALA A 28 27.957 25.974 10.230 1.00 0.00 H new ATOM 0 HB3 ALA A 28 26.925 27.322 10.764 1.00 0.00 H new ATOM 449 N LYS A 29 27.888 29.536 12.234 1.00 0.00 N ATOM 450 CA LYS A 29 27.744 30.945 12.538 1.00 0.00 C ATOM 451 C LYS A 29 28.712 31.426 13.616 1.00 0.00 C ATOM 452 O LYS A 29 29.066 32.599 13.625 1.00 0.00 O ATOM 453 CB LYS A 29 26.360 30.938 13.176 1.00 0.00 C ATOM 454 CG LYS A 29 25.185 30.719 12.227 1.00 0.00 C ATOM 455 CD LYS A 29 23.759 30.816 12.748 1.00 0.00 C ATOM 456 CE LYS A 29 22.806 30.297 11.672 1.00 0.00 C ATOM 457 NZ LYS A 29 22.558 31.319 10.642 1.00 0.00 N ATOM 0 H LYS A 29 27.151 28.968 12.652 1.00 0.00 H new ATOM 0 HA LYS A 29 27.911 31.577 11.665 1.00 0.00 H new ATOM 0 HB2 LYS A 29 26.337 30.158 13.937 1.00 0.00 H new ATOM 0 HB3 LYS A 29 26.214 31.888 13.689 1.00 0.00 H new ATOM 0 HG2 LYS A 29 25.284 31.441 11.416 1.00 0.00 H new ATOM 0 HG3 LYS A 29 25.303 29.728 11.788 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.650 30.232 13.662 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.518 31.849 12.999 1.00 0.00 H new ATOM 0 HE2 LYS A 29 23.228 29.405 11.209 1.00 0.00 H new ATOM 0 HE3 LYS A 29 21.862 30.002 12.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.908 30.939 9.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 22.134 32.160 11.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 23.457 31.581 10.190 1.00 0.00 H new ATOM 471 N ILE A 30 29.165 30.678 14.619 1.00 0.00 N ATOM 472 CA ILE A 30 30.176 31.112 15.562 1.00 0.00 C ATOM 473 C ILE A 30 31.539 31.182 14.850 1.00 0.00 C ATOM 474 O ILE A 30 32.248 32.133 15.168 1.00 0.00 O ATOM 475 CB ILE A 30 30.229 30.183 16.774 1.00 0.00 C ATOM 476 CG1 ILE A 30 29.024 30.568 17.645 1.00 0.00 C ATOM 477 CG2 ILE A 30 31.464 30.539 17.591 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.783 29.655 18.850 1.00 0.00 C ATOM 0 H ILE A 30 28.827 29.732 14.797 1.00 0.00 H new ATOM 0 HA ILE A 30 29.920 32.105 15.931 1.00 0.00 H new ATOM 0 HB ILE A 30 30.237 29.135 16.476 1.00 0.00 H new ATOM 0 HG12 ILE A 30 29.164 31.588 18.002 1.00 0.00 H new ATOM 0 HG13 ILE A 30 28.129 30.568 17.023 1.00 0.00 H new ATOM 0 HG21 ILE A 30 31.523 29.888 18.463 1.00 0.00 H new ATOM 0 HG22 ILE A 30 32.356 30.407 16.978 1.00 0.00 H new ATOM 0 HG23 ILE A 30 31.398 31.577 17.917 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.912 30.006 19.404 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.607 28.636 18.505 1.00 0.00 H new ATOM 0 HD13 ILE A 30 29.658 29.672 19.500 1.00 0.00 H new ATOM 490 N GLN A 31 31.919 30.296 13.937 1.00 0.00 N ATOM 491 CA GLN A 31 32.977 30.556 12.983 1.00 0.00 C ATOM 492 C GLN A 31 32.861 31.809 12.116 1.00 0.00 C ATOM 493 O GLN A 31 33.804 32.462 11.682 1.00 0.00 O ATOM 494 CB GLN A 31 33.200 29.270 12.196 1.00 0.00 C ATOM 495 CG GLN A 31 33.874 29.280 10.816 1.00 0.00 C ATOM 496 CD GLN A 31 35.312 29.697 10.571 1.00 0.00 C ATOM 497 OE1 GLN A 31 35.634 29.977 9.419 1.00 0.00 O ATOM 498 NE2 GLN A 31 36.111 29.863 11.622 1.00 0.00 N ATOM 0 H GLN A 31 31.496 29.373 13.842 1.00 0.00 H new ATOM 0 HA GLN A 31 33.864 30.829 13.554 1.00 0.00 H new ATOM 0 HB2 GLN A 31 33.789 28.608 12.831 1.00 0.00 H new ATOM 0 HB3 GLN A 31 32.223 28.804 12.068 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.782 28.266 10.426 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.260 29.922 10.184 1.00 0.00 H new ATOM 0 HE21 GLN A 31 35.785 29.611 12.555 1.00 0.00 H new ATOM 0 HE22 GLN A 31 37.049 30.242 11.494 1.00 0.00 H new ATOM 507 N ASP A 32 31.604 32.047 11.742 1.00 0.00 N ATOM 508 CA ASP A 32 31.287 33.190 10.914 1.00 0.00 C ATOM 509 C ASP A 32 31.547 34.562 11.556 1.00 0.00 C ATOM 510 O ASP A 32 32.119 35.450 10.931 1.00 0.00 O ATOM 511 CB ASP A 32 29.903 33.106 10.286 1.00 0.00 C ATOM 512 CG ASP A 32 29.590 34.113 9.195 1.00 0.00 C ATOM 513 OD1 ASP A 32 30.353 34.031 8.203 1.00 0.00 O ATOM 514 OD2 ASP A 32 28.586 34.854 9.257 1.00 0.00 O ATOM 0 H ASP A 32 30.805 31.468 11.999 1.00 0.00 H new ATOM 0 HA ASP A 32 32.016 33.124 10.106 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.777 32.105 9.873 1.00 0.00 H new ATOM 0 HB3 ASP A 32 29.162 33.220 11.077 1.00 0.00 H new ATOM 519 N LYS A 33 31.210 34.604 12.839 1.00 0.00 N ATOM 520 CA LYS A 33 31.213 35.762 13.713 1.00 0.00 C ATOM 521 C LYS A 33 32.625 35.886 14.294 1.00 0.00 C ATOM 522 O LYS A 33 33.318 36.857 14.012 1.00 0.00 O ATOM 523 CB LYS A 33 30.188 35.555 14.834 1.00 0.00 C ATOM 524 CG LYS A 33 28.736 35.514 14.367 1.00 0.00 C ATOM 525 CD LYS A 33 27.859 35.022 15.522 1.00 0.00 C ATOM 526 CE LYS A 33 26.397 34.989 15.074 1.00 0.00 C ATOM 527 NZ LYS A 33 25.984 36.395 15.142 1.00 0.00 N ATOM 0 H LYS A 33 30.905 33.763 13.329 1.00 0.00 H new ATOM 0 HA LYS A 33 30.946 36.670 13.172 1.00 0.00 H new ATOM 0 HB2 LYS A 33 30.417 34.622 15.350 1.00 0.00 H new ATOM 0 HB3 LYS A 33 30.299 36.358 15.563 1.00 0.00 H new ATOM 0 HG2 LYS A 33 28.415 36.505 14.045 1.00 0.00 H new ATOM 0 HG3 LYS A 33 28.635 34.851 13.508 1.00 0.00 H new ATOM 0 HD2 LYS A 33 28.177 34.028 15.836 1.00 0.00 H new ATOM 0 HD3 LYS A 33 27.972 35.680 16.384 1.00 0.00 H new ATOM 0 HE2 LYS A 33 26.296 34.590 14.065 1.00 0.00 H new ATOM 0 HE3 LYS A 33 25.791 34.361 15.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 25.228 36.501 15.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 26.797 36.983 15.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 25.634 36.699 14.211 1.00 0.00 H new ATOM 541 N GLU A 34 32.943 34.928 15.144 1.00 0.00 N ATOM 542 CA GLU A 34 34.024 34.976 16.118 1.00 0.00 C ATOM 543 C GLU A 34 35.393 34.603 15.557 1.00 0.00 C ATOM 544 O GLU A 34 36.428 34.849 16.180 1.00 0.00 O ATOM 545 CB GLU A 34 33.682 34.130 17.347 1.00 0.00 C ATOM 546 CG GLU A 34 32.397 34.688 17.962 1.00 0.00 C ATOM 547 CD GLU A 34 32.632 36.004 18.691 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.725 36.328 19.222 1.00 0.00 O ATOM 549 OE2 GLU A 34 31.708 36.835 18.626 1.00 0.00 O ATOM 0 H GLU A 34 32.429 34.048 15.178 1.00 0.00 H new ATOM 0 HA GLU A 34 34.111 36.022 16.413 1.00 0.00 H new ATOM 0 HB2 GLU A 34 33.547 33.086 17.065 1.00 0.00 H new ATOM 0 HB3 GLU A 34 34.496 34.163 18.071 1.00 0.00 H new ATOM 0 HG2 GLU A 34 31.656 34.837 17.177 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.983 33.958 18.658 1.00 0.00 H new ATOM 556 N GLY A 35 35.518 33.977 14.391 1.00 0.00 N ATOM 557 CA GLY A 35 36.760 33.651 13.719 1.00 0.00 C ATOM 558 C GLY A 35 37.376 32.297 14.078 1.00 0.00 C ATOM 559 O GLY A 35 38.550 32.043 13.821 1.00 0.00 O ATOM 0 H GLY A 35 34.702 33.667 13.863 1.00 0.00 H new ATOM 0 HA2 GLY A 35 36.587 33.676 12.643 1.00 0.00 H new ATOM 0 HA3 GLY A 35 37.488 34.431 13.943 1.00 0.00 H new ATOM 563 N ILE A 36 36.662 31.459 14.823 1.00 0.00 N ATOM 564 CA ILE A 36 37.169 30.253 15.439 1.00 0.00 C ATOM 565 C ILE A 36 36.817 28.996 14.640 1.00 0.00 C ATOM 566 O ILE A 36 35.608 28.891 14.395 1.00 0.00 O ATOM 567 CB ILE A 36 36.775 30.105 16.915 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.329 30.554 17.088 1.00 0.00 C ATOM 569 CG2 ILE A 36 37.670 30.978 17.800 1.00 0.00 C ATOM 570 CD1 ILE A 36 34.751 30.318 18.484 1.00 0.00 C ATOM 0 H ILE A 36 35.673 31.615 15.018 1.00 0.00 H new ATOM 0 HA ILE A 36 38.253 30.361 15.421 1.00 0.00 H new ATOM 0 HB ILE A 36 36.892 29.062 17.209 1.00 0.00 H new ATOM 0 HG12 ILE A 36 35.262 31.617 16.857 1.00 0.00 H new ATOM 0 HG13 ILE A 36 34.710 30.030 16.360 1.00 0.00 H new ATOM 0 HG21 ILE A 36 37.376 30.860 18.843 1.00 0.00 H new ATOM 0 HG22 ILE A 36 38.710 30.673 17.679 1.00 0.00 H new ATOM 0 HG23 ILE A 36 37.562 32.023 17.508 1.00 0.00 H new ATOM 0 HD11 ILE A 36 33.719 30.668 18.514 1.00 0.00 H new ATOM 0 HD12 ILE A 36 34.780 29.253 18.715 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.341 30.865 19.219 1.00 0.00 H new ATOM 582 N PRO A 37 37.654 28.081 14.155 1.00 0.00 N ATOM 583 CA PRO A 37 37.241 26.920 13.388 1.00 0.00 C ATOM 584 C PRO A 37 36.309 26.024 14.209 1.00 0.00 C ATOM 585 O PRO A 37 36.482 25.835 15.411 1.00 0.00 O ATOM 586 CB PRO A 37 38.535 26.315 12.855 1.00 0.00 C ATOM 587 CG PRO A 37 39.658 26.846 13.746 1.00 0.00 C ATOM 588 CD PRO A 37 39.087 28.119 14.376 1.00 0.00 C ATOM 0 HA PRO A 37 36.609 27.139 12.527 1.00 0.00 H new ATOM 0 HB2 PRO A 37 38.496 25.226 12.886 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.697 26.599 11.815 1.00 0.00 H new ATOM 0 HG2 PRO A 37 39.936 26.118 14.508 1.00 0.00 H new ATOM 0 HG3 PRO A 37 40.556 27.060 13.166 1.00 0.00 H new ATOM 0 HD2 PRO A 37 39.314 28.160 15.441 1.00 0.00 H new ATOM 0 HD3 PRO A 37 39.526 29.007 13.922 1.00 0.00 H new ATOM 596 N PRO A 38 35.235 25.511 13.620 1.00 0.00 N ATOM 597 CA PRO A 38 34.317 24.610 14.301 1.00 0.00 C ATOM 598 C PRO A 38 34.946 23.281 14.693 1.00 0.00 C ATOM 599 O PRO A 38 34.358 22.668 15.590 1.00 0.00 O ATOM 600 CB PRO A 38 33.107 24.490 13.367 1.00 0.00 C ATOM 601 CG PRO A 38 33.657 24.716 11.957 1.00 0.00 C ATOM 602 CD PRO A 38 34.848 25.642 12.231 1.00 0.00 C ATOM 0 HA PRO A 38 34.015 25.004 15.271 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.640 23.509 13.454 1.00 0.00 H new ATOM 0 HB3 PRO A 38 32.345 25.229 13.614 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.964 23.784 11.483 1.00 0.00 H new ATOM 0 HG3 PRO A 38 32.921 25.180 11.300 1.00 0.00 H new ATOM 0 HD2 PRO A 38 35.684 25.383 11.581 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.580 26.675 12.010 1.00 0.00 H new ATOM 610 N ASP A 39 36.143 22.825 14.338 1.00 0.00 N ATOM 611 CA ASP A 39 36.699 21.612 14.911 1.00 0.00 C ATOM 612 C ASP A 39 37.187 21.907 16.327 1.00 0.00 C ATOM 613 O ASP A 39 37.421 20.940 17.051 1.00 0.00 O ATOM 614 CB ASP A 39 37.814 21.121 13.985 1.00 0.00 C ATOM 615 CG ASP A 39 38.011 19.617 14.156 1.00 0.00 C ATOM 616 OD1 ASP A 39 37.063 18.847 14.447 1.00 0.00 O ATOM 617 OD2 ASP A 39 39.184 19.249 14.323 1.00 0.00 O ATOM 0 H ASP A 39 36.746 23.282 13.653 1.00 0.00 H new ATOM 0 HA ASP A 39 35.954 20.820 14.992 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.563 21.348 12.949 1.00 0.00 H new ATOM 0 HB3 ASP A 39 38.742 21.646 14.210 1.00 0.00 H new ATOM 622 N GLN A 40 37.299 23.167 16.763 1.00 0.00 N ATOM 623 CA GLN A 40 37.762 23.615 18.053 1.00 0.00 C ATOM 624 C GLN A 40 36.644 23.700 19.089 1.00 0.00 C ATOM 625 O GLN A 40 36.888 23.744 20.293 1.00 0.00 O ATOM 626 CB GLN A 40 38.527 24.939 18.078 1.00 0.00 C ATOM 627 CG GLN A 40 39.782 25.126 17.216 1.00 0.00 C ATOM 628 CD GLN A 40 40.983 24.279 17.620 1.00 0.00 C ATOM 629 OE1 GLN A 40 40.845 23.095 17.930 1.00 0.00 O ATOM 630 NE2 GLN A 40 42.155 24.890 17.709 1.00 0.00 N ATOM 0 H GLN A 40 37.044 23.952 16.164 1.00 0.00 H new ATOM 0 HA GLN A 40 38.473 22.830 18.310 1.00 0.00 H new ATOM 0 HB2 GLN A 40 37.824 25.723 17.798 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.816 25.125 19.112 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.529 24.897 16.181 1.00 0.00 H new ATOM 0 HG3 GLN A 40 40.072 26.176 17.249 1.00 0.00 H new ATOM 0 HE21 GLN A 40 42.240 25.872 17.445 1.00 0.00 H new ATOM 0 HE22 GLN A 40 42.973 24.379 18.041 1.00 0.00 H new ATOM 639 N GLN A 41 35.388 23.811 18.655 1.00 0.00 N ATOM 640 CA GLN A 41 34.180 24.187 19.352 1.00 0.00 C ATOM 641 C GLN A 41 33.564 22.840 19.737 1.00 0.00 C ATOM 642 O GLN A 41 33.352 21.991 18.881 1.00 0.00 O ATOM 643 CB GLN A 41 33.281 25.018 18.450 1.00 0.00 C ATOM 644 CG GLN A 41 33.845 26.389 18.057 1.00 0.00 C ATOM 645 CD GLN A 41 33.018 26.835 16.862 1.00 0.00 C ATOM 646 OE1 GLN A 41 31.811 26.623 16.850 1.00 0.00 O ATOM 647 NE2 GLN A 41 33.499 27.571 15.867 1.00 0.00 N ATOM 0 H GLN A 41 35.179 23.611 17.677 1.00 0.00 H new ATOM 0 HA GLN A 41 34.347 24.817 20.226 1.00 0.00 H new ATOM 0 HB2 GLN A 41 33.080 24.451 17.541 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.325 25.166 18.952 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.762 27.099 18.880 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.902 26.321 17.800 1.00 0.00 H new ATOM 0 HE21 GLN A 41 34.496 27.781 15.824 1.00 0.00 H new ATOM 0 HE22 GLN A 41 32.871 27.927 15.146 1.00 0.00 H new ATOM 656 N ARG A 42 33.154 22.658 20.998 1.00 0.00 N ATOM 657 CA ARG A 42 32.391 21.541 21.511 1.00 0.00 C ATOM 658 C ARG A 42 31.160 22.086 22.226 1.00 0.00 C ATOM 659 O ARG A 42 31.224 22.858 23.189 1.00 0.00 O ATOM 660 CB ARG A 42 33.389 20.921 22.490 1.00 0.00 C ATOM 661 CG ARG A 42 34.409 20.024 21.792 1.00 0.00 C ATOM 662 CD ARG A 42 35.149 19.132 22.800 1.00 0.00 C ATOM 663 NE ARG A 42 34.456 17.852 22.828 1.00 0.00 N ATOM 664 CZ ARG A 42 34.256 17.114 23.929 1.00 0.00 C ATOM 665 NH1 ARG A 42 34.801 17.552 25.060 1.00 0.00 N ATOM 666 NH2 ARG A 42 33.521 15.996 23.819 1.00 0.00 N ATOM 0 H ARG A 42 33.367 23.339 21.726 1.00 0.00 H new ATOM 0 HA ARG A 42 32.025 20.830 20.770 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.912 21.715 23.023 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.848 20.339 23.236 1.00 0.00 H new ATOM 0 HG2 ARG A 42 33.904 19.401 21.054 1.00 0.00 H new ATOM 0 HG3 ARG A 42 35.128 20.639 21.251 1.00 0.00 H new ATOM 0 HD2 ARG A 42 36.190 19.000 22.506 1.00 0.00 H new ATOM 0 HD3 ARG A 42 35.153 19.590 23.789 1.00 0.00 H new ATOM 0 HE ARG A 42 34.096 17.490 21.945 1.00 0.00 H new ATOM 0 HH11 ARG A 42 35.344 18.416 25.064 1.00 0.00 H new ATOM 0 HH12 ARG A 42 34.676 17.024 25.924 1.00 0.00 H new ATOM 0 HH21 ARG A 42 33.132 15.728 22.915 1.00 0.00 H new ATOM 0 HH22 ARG A 42 33.352 15.414 24.639 1.00 0.00 H new ATOM 680 N LEU A 43 29.959 21.882 21.688 1.00 0.00 N ATOM 681 CA LEU A 43 28.687 22.428 22.112 1.00 0.00 C ATOM 682 C LEU A 43 27.887 21.527 23.056 1.00 0.00 C ATOM 683 O LEU A 43 27.716 20.336 22.833 1.00 0.00 O ATOM 684 CB LEU A 43 27.771 22.517 20.892 1.00 0.00 C ATOM 685 CG LEU A 43 27.942 23.790 20.071 1.00 0.00 C ATOM 686 CD1 LEU A 43 27.152 23.580 18.779 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.553 25.117 20.720 1.00 0.00 C ATOM 0 H LEU A 43 29.850 21.277 20.874 1.00 0.00 H new ATOM 0 HA LEU A 43 28.939 23.368 22.603 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.957 21.656 20.249 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.735 22.449 21.224 1.00 0.00 H new ATOM 0 HG LEU A 43 29.015 23.916 19.927 1.00 0.00 H new ATOM 0 HD11 LEU A 43 27.240 24.466 18.150 1.00 0.00 H new ATOM 0 HD12 LEU A 43 27.549 22.716 18.246 1.00 0.00 H new ATOM 0 HD13 LEU A 43 26.103 23.408 19.018 1.00 0.00 H new ATOM 0 HD21 LEU A 43 27.729 25.931 20.017 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.497 25.094 20.991 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.154 25.274 21.616 1.00 0.00 H new ATOM 699 N ILE A 44 27.361 22.089 24.147 1.00 0.00 N ATOM 700 CA ILE A 44 27.004 21.467 25.405 1.00 0.00 C ATOM 701 C ILE A 44 25.742 22.123 25.983 1.00 0.00 C ATOM 702 O ILE A 44 25.676 23.348 25.996 1.00 0.00 O ATOM 703 CB ILE A 44 28.241 21.490 26.293 1.00 0.00 C ATOM 704 CG1 ILE A 44 28.067 20.989 27.722 1.00 0.00 C ATOM 705 CG2 ILE A 44 28.985 22.827 26.233 1.00 0.00 C ATOM 706 CD1 ILE A 44 29.372 20.689 28.458 1.00 0.00 C ATOM 0 H ILE A 44 27.158 23.089 24.163 1.00 0.00 H new ATOM 0 HA ILE A 44 26.720 20.420 25.296 1.00 0.00 H new ATOM 0 HB ILE A 44 28.875 20.728 25.839 1.00 0.00 H new ATOM 0 HG12 ILE A 44 27.510 21.735 28.289 1.00 0.00 H new ATOM 0 HG13 ILE A 44 27.460 20.084 27.704 1.00 0.00 H new ATOM 0 HG21 ILE A 44 29.858 22.787 26.885 1.00 0.00 H new ATOM 0 HG22 ILE A 44 29.305 23.020 25.209 1.00 0.00 H new ATOM 0 HG23 ILE A 44 28.322 23.627 26.562 1.00 0.00 H new ATOM 0 HD11 ILE A 44 29.149 20.339 29.466 1.00 0.00 H new ATOM 0 HD12 ILE A 44 29.924 19.919 27.920 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.975 21.595 28.514 1.00 0.00 H new ATOM 718 N PHE A 45 24.837 21.296 26.485 1.00 0.00 N ATOM 719 CA PHE A 45 23.652 21.704 27.207 1.00 0.00 C ATOM 720 C PHE A 45 23.348 20.781 28.391 1.00 0.00 C ATOM 721 O PHE A 45 23.390 19.567 28.173 1.00 0.00 O ATOM 722 CB PHE A 45 22.537 21.650 26.166 1.00 0.00 C ATOM 723 CG PHE A 45 21.084 21.519 26.550 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.388 22.570 27.170 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.375 20.368 26.191 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.000 22.470 27.321 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.973 20.368 26.229 1.00 0.00 C ATOM 728 CZ PHE A 45 18.253 21.349 26.915 1.00 0.00 C ATOM 0 H PHE A 45 24.916 20.283 26.394 1.00 0.00 H new ATOM 0 HA PHE A 45 23.770 22.694 27.646 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.622 22.557 25.568 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.764 20.812 25.507 1.00 0.00 H new ATOM 0 HD1 PHE A 45 20.916 23.443 27.525 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.907 19.479 25.885 1.00 0.00 H new ATOM 0 HE1 PHE A 45 18.474 23.298 27.773 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.434 19.587 25.713 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.197 21.254 27.119 1.00 0.00 H new ATOM 738 N ALA A 46 22.954 21.260 29.565 1.00 0.00 N ATOM 739 CA ALA A 46 22.445 20.546 30.717 1.00 0.00 C ATOM 740 C ALA A 46 23.279 19.353 31.163 1.00 0.00 C ATOM 741 O ALA A 46 22.725 18.454 31.801 1.00 0.00 O ATOM 742 CB ALA A 46 20.966 20.274 30.428 1.00 0.00 C ATOM 0 H ALA A 46 22.989 22.263 29.746 1.00 0.00 H new ATOM 0 HA ALA A 46 22.531 21.155 31.617 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.525 19.735 31.266 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.442 21.220 30.289 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.877 19.674 29.523 1.00 0.00 H new ATOM 748 N GLY A 47 24.607 19.426 31.042 1.00 0.00 N ATOM 749 CA GLY A 47 25.518 18.365 31.430 1.00 0.00 C ATOM 750 C GLY A 47 26.025 17.617 30.193 1.00 0.00 C ATOM 751 O GLY A 47 26.996 16.864 30.236 1.00 0.00 O ATOM 0 H GLY A 47 25.081 20.245 30.663 1.00 0.00 H new ATOM 0 HA2 GLY A 47 26.361 18.784 31.980 1.00 0.00 H new ATOM 0 HA3 GLY A 47 25.013 17.670 32.101 1.00 0.00 H new ATOM 755 N LYS A 48 25.340 17.605 29.060 1.00 0.00 N ATOM 756 CA LYS A 48 25.400 16.717 27.913 1.00 0.00 C ATOM 757 C LYS A 48 26.152 17.417 26.779 1.00 0.00 C ATOM 758 O LYS A 48 25.718 18.508 26.438 1.00 0.00 O ATOM 759 CB LYS A 48 23.983 16.294 27.523 1.00 0.00 C ATOM 760 CG LYS A 48 22.997 16.166 28.680 1.00 0.00 C ATOM 761 CD LYS A 48 21.696 15.598 28.126 1.00 0.00 C ATOM 762 CE LYS A 48 20.508 15.554 29.090 1.00 0.00 C ATOM 763 NZ LYS A 48 19.473 14.720 28.445 1.00 0.00 N ATOM 0 H LYS A 48 24.630 18.321 28.906 1.00 0.00 H new ATOM 0 HA LYS A 48 25.948 15.805 28.150 1.00 0.00 H new ATOM 0 HB2 LYS A 48 23.589 17.019 26.810 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.037 15.336 27.006 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.400 15.512 29.454 1.00 0.00 H new ATOM 0 HG3 LYS A 48 22.823 17.138 29.142 1.00 0.00 H new ATOM 0 HD2 LYS A 48 21.408 16.188 27.256 1.00 0.00 H new ATOM 0 HD3 LYS A 48 21.888 14.584 27.774 1.00 0.00 H new ATOM 0 HE2 LYS A 48 20.803 15.131 30.050 1.00 0.00 H new ATOM 0 HE3 LYS A 48 20.131 16.558 29.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 18.640 14.659 29.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.199 15.147 27.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.851 13.765 28.278 1.00 0.00 H new ATOM 777 N GLN A 49 27.201 16.768 26.268 1.00 0.00 N ATOM 778 CA GLN A 49 27.961 17.230 25.125 1.00 0.00 C ATOM 779 C GLN A 49 27.209 16.723 23.899 1.00 0.00 C ATOM 780 O GLN A 49 26.831 15.555 23.857 1.00 0.00 O ATOM 781 CB GLN A 49 29.352 16.589 25.216 1.00 0.00 C ATOM 782 CG GLN A 49 29.433 15.082 25.428 1.00 0.00 C ATOM 783 CD GLN A 49 29.315 14.685 26.898 1.00 0.00 C ATOM 784 OE1 GLN A 49 29.778 15.337 27.824 1.00 0.00 O ATOM 785 NE2 GLN A 49 28.613 13.585 27.188 1.00 0.00 N ATOM 0 H GLN A 49 27.546 15.888 26.652 1.00 0.00 H new ATOM 0 HA GLN A 49 28.074 18.313 25.080 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.890 16.826 24.298 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.889 17.071 26.033 1.00 0.00 H new ATOM 0 HG2 GLN A 49 28.639 14.596 24.860 1.00 0.00 H new ATOM 0 HG3 GLN A 49 30.379 14.714 25.032 1.00 0.00 H new ATOM 0 HE21 GLN A 49 28.215 13.021 26.437 1.00 0.00 H new ATOM 0 HE22 GLN A 49 28.475 13.309 28.160 1.00 0.00 H new ATOM 794 N LEU A 50 26.909 17.664 23.012 1.00 0.00 N ATOM 795 CA LEU A 50 25.900 17.418 21.999 1.00 0.00 C ATOM 796 C LEU A 50 26.580 16.965 20.699 1.00 0.00 C ATOM 797 O LEU A 50 27.370 17.733 20.170 1.00 0.00 O ATOM 798 CB LEU A 50 25.166 18.713 21.630 1.00 0.00 C ATOM 799 CG LEU A 50 24.450 19.465 22.763 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.629 20.664 22.288 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.337 18.526 23.210 1.00 0.00 C ATOM 0 H LEU A 50 27.343 18.587 22.975 1.00 0.00 H new ATOM 0 HA LEU A 50 25.215 16.672 22.403 1.00 0.00 H new ATOM 0 HB2 LEU A 50 25.888 19.393 21.178 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.428 18.476 20.864 1.00 0.00 H new ATOM 0 HG LEU A 50 25.212 19.771 23.480 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.154 21.142 23.145 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.284 21.379 21.790 1.00 0.00 H new ATOM 0 HD13 LEU A 50 22.863 20.327 21.590 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.774 18.989 24.021 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.669 18.328 22.371 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.770 17.588 23.558 1.00 0.00 H new ATOM 813 N GLU A 51 26.143 15.844 20.131 1.00 0.00 N ATOM 814 CA GLU A 51 26.697 15.267 18.932 1.00 0.00 C ATOM 815 C GLU A 51 26.384 16.007 17.628 1.00 0.00 C ATOM 816 O GLU A 51 25.214 16.291 17.349 1.00 0.00 O ATOM 817 CB GLU A 51 26.272 13.798 18.892 1.00 0.00 C ATOM 818 CG GLU A 51 27.295 13.034 18.052 1.00 0.00 C ATOM 819 CD GLU A 51 27.289 11.517 18.159 1.00 0.00 C ATOM 820 OE1 GLU A 51 26.186 10.935 18.133 1.00 0.00 O ATOM 821 OE2 GLU A 51 28.381 10.908 18.202 1.00 0.00 O ATOM 0 H GLU A 51 25.368 15.303 20.513 1.00 0.00 H new ATOM 0 HA GLU A 51 27.781 15.363 18.989 1.00 0.00 H new ATOM 0 HB2 GLU A 51 26.224 13.387 19.901 1.00 0.00 H new ATOM 0 HB3 GLU A 51 25.276 13.701 18.461 1.00 0.00 H new ATOM 0 HG2 GLU A 51 27.139 13.299 17.006 1.00 0.00 H new ATOM 0 HG3 GLU A 51 28.289 13.388 18.326 1.00 0.00 H new ATOM 828 N ASP A 52 27.393 16.286 16.818 1.00 0.00 N ATOM 829 CA ASP A 52 27.416 17.072 15.608 1.00 0.00 C ATOM 830 C ASP A 52 26.518 16.479 14.510 1.00 0.00 C ATOM 831 O ASP A 52 26.503 15.316 14.121 1.00 0.00 O ATOM 832 CB ASP A 52 28.838 17.327 15.098 1.00 0.00 C ATOM 833 CG ASP A 52 29.810 18.071 15.994 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.408 19.040 16.681 1.00 0.00 O ATOM 835 OD2 ASP A 52 31.035 17.862 15.826 1.00 0.00 O ATOM 0 H ASP A 52 28.323 15.920 17.024 1.00 0.00 H new ATOM 0 HA ASP A 52 26.999 18.043 15.873 1.00 0.00 H new ATOM 0 HB2 ASP A 52 29.282 16.361 14.859 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.759 17.882 14.163 1.00 0.00 H new ATOM 840 N GLY A 53 25.615 17.346 14.083 1.00 0.00 N ATOM 841 CA GLY A 53 24.717 17.142 12.966 1.00 0.00 C ATOM 842 C GLY A 53 23.283 16.792 13.353 1.00 0.00 C ATOM 843 O GLY A 53 22.420 16.674 12.485 1.00 0.00 O ATOM 0 H GLY A 53 25.485 18.254 14.530 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.704 18.047 12.359 1.00 0.00 H new ATOM 0 HA3 GLY A 53 25.115 16.343 12.340 1.00 0.00 H new ATOM 847 N ARG A 54 23.011 16.585 14.636 1.00 0.00 N ATOM 848 CA ARG A 54 21.664 16.518 15.158 1.00 0.00 C ATOM 849 C ARG A 54 20.986 17.884 15.204 1.00 0.00 C ATOM 850 O ARG A 54 21.663 18.923 15.183 1.00 0.00 O ATOM 851 CB ARG A 54 21.670 15.737 16.474 1.00 0.00 C ATOM 852 CG ARG A 54 22.259 14.333 16.536 1.00 0.00 C ATOM 853 CD ARG A 54 21.428 13.226 15.894 1.00 0.00 C ATOM 854 NE ARG A 54 21.146 13.512 14.482 1.00 0.00 N ATOM 855 CZ ARG A 54 21.976 13.218 13.470 1.00 0.00 C ATOM 856 NH1 ARG A 54 23.158 12.592 13.558 1.00 0.00 N ATOM 857 NH2 ARG A 54 21.546 13.431 12.216 1.00 0.00 N ATOM 0 H ARG A 54 23.732 16.458 15.346 1.00 0.00 H new ATOM 0 HA ARG A 54 21.028 15.959 14.472 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.205 16.343 17.206 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.636 15.668 16.812 1.00 0.00 H new ATOM 0 HG2 ARG A 54 23.237 14.350 16.055 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.423 14.076 17.583 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.960 12.278 15.975 1.00 0.00 H new ATOM 0 HD3 ARG A 54 20.490 13.113 16.437 1.00 0.00 H new ATOM 0 HE ARG A 54 20.260 13.964 14.255 1.00 0.00 H new ATOM 0 HH11 ARG A 54 23.507 12.287 14.467 1.00 0.00 H new ATOM 0 HH12 ARG A 54 23.708 12.420 12.716 1.00 0.00 H new ATOM 0 HH21 ARG A 54 20.612 13.806 12.054 1.00 0.00 H new ATOM 0 HH22 ARG A 54 22.154 13.217 11.425 1.00 0.00 H new ATOM 871 N THR A 55 19.668 17.880 15.347 1.00 0.00 N ATOM 872 CA THR A 55 18.848 19.067 15.531 1.00 0.00 C ATOM 873 C THR A 55 18.454 19.343 16.977 1.00 0.00 C ATOM 874 O THR A 55 18.385 18.475 17.846 1.00 0.00 O ATOM 875 CB THR A 55 17.590 18.982 14.660 1.00 0.00 C ATOM 876 OG1 THR A 55 16.675 18.070 15.220 1.00 0.00 O ATOM 877 CG2 THR A 55 17.818 18.483 13.227 1.00 0.00 C ATOM 0 H THR A 55 19.122 17.019 15.338 1.00 0.00 H new ATOM 0 HA THR A 55 19.474 19.905 15.223 1.00 0.00 H new ATOM 0 HB THR A 55 17.232 20.011 14.624 1.00 0.00 H new ATOM 0 HG1 THR A 55 16.897 17.162 14.926 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.867 18.459 12.694 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.505 19.155 12.713 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.244 17.480 13.254 1.00 0.00 H new ATOM 885 N LEU A 56 18.181 20.586 17.351 1.00 0.00 N ATOM 886 CA LEU A 56 17.903 21.112 18.675 1.00 0.00 C ATOM 887 C LEU A 56 16.764 20.336 19.331 1.00 0.00 C ATOM 888 O LEU A 56 16.867 19.910 20.481 1.00 0.00 O ATOM 889 CB LEU A 56 17.931 22.638 18.622 1.00 0.00 C ATOM 890 CG LEU A 56 19.014 23.293 17.774 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.837 24.812 17.718 1.00 0.00 C ATOM 892 CD2 LEU A 56 20.386 22.900 18.348 1.00 0.00 C ATOM 0 H LEU A 56 18.146 21.330 16.654 1.00 0.00 H new ATOM 0 HA LEU A 56 18.676 20.927 19.421 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.963 22.979 18.254 1.00 0.00 H new ATOM 0 HB3 LEU A 56 18.033 23.008 19.642 1.00 0.00 H new ATOM 0 HG LEU A 56 18.939 22.939 16.746 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.626 25.248 17.105 1.00 0.00 H new ATOM 0 HD12 LEU A 56 17.866 25.049 17.283 1.00 0.00 H new ATOM 0 HD13 LEU A 56 18.892 25.222 18.726 1.00 0.00 H new ATOM 0 HD21 LEU A 56 21.175 23.360 17.753 1.00 0.00 H new ATOM 0 HD22 LEU A 56 20.461 23.245 19.379 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.495 21.816 18.319 1.00 0.00 H new ATOM 904 N SER A 57 15.674 20.161 18.588 1.00 0.00 N ATOM 905 CA SER A 57 14.452 19.508 18.988 1.00 0.00 C ATOM 906 C SER A 57 14.735 18.081 19.436 1.00 0.00 C ATOM 907 O SER A 57 14.131 17.597 20.391 1.00 0.00 O ATOM 908 CB SER A 57 13.657 19.499 17.675 1.00 0.00 C ATOM 909 OG SER A 57 12.350 18.985 17.768 1.00 0.00 O ATOM 0 H SER A 57 15.629 20.499 17.627 1.00 0.00 H new ATOM 0 HA SER A 57 13.941 19.994 19.819 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.603 20.519 17.295 1.00 0.00 H new ATOM 0 HB3 SER A 57 14.209 18.914 16.939 1.00 0.00 H new ATOM 0 HG SER A 57 11.921 19.020 16.887 1.00 0.00 H new ATOM 915 N ASP A 58 15.521 17.364 18.629 1.00 0.00 N ATOM 916 CA ASP A 58 15.739 15.943 18.763 1.00 0.00 C ATOM 917 C ASP A 58 16.582 15.637 20.012 1.00 0.00 C ATOM 918 O ASP A 58 16.548 14.521 20.520 1.00 0.00 O ATOM 919 CB ASP A 58 16.482 15.384 17.544 1.00 0.00 C ATOM 920 CG ASP A 58 15.598 15.057 16.338 1.00 0.00 C ATOM 921 OD1 ASP A 58 14.367 14.902 16.454 1.00 0.00 O ATOM 922 OD2 ASP A 58 16.109 15.139 15.195 1.00 0.00 O ATOM 0 H ASP A 58 16.031 17.777 17.848 1.00 0.00 H new ATOM 0 HA ASP A 58 14.758 15.475 18.847 1.00 0.00 H new ATOM 0 HB2 ASP A 58 17.237 16.107 17.236 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.010 14.479 17.844 1.00 0.00 H new ATOM 927 N TYR A 59 17.361 16.584 20.524 1.00 0.00 N ATOM 928 CA TYR A 59 18.096 16.641 21.766 1.00 0.00 C ATOM 929 C TYR A 59 17.328 17.308 22.900 1.00 0.00 C ATOM 930 O TYR A 59 17.903 17.347 23.985 1.00 0.00 O ATOM 931 CB TYR A 59 19.308 17.522 21.497 1.00 0.00 C ATOM 932 CG TYR A 59 20.538 16.650 21.379 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.952 15.884 22.477 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.249 16.619 20.176 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.089 15.076 22.415 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.361 15.767 20.090 1.00 0.00 C ATOM 937 CZ TYR A 59 22.778 15.029 21.199 1.00 0.00 C ATOM 938 OH TYR A 59 23.908 14.290 21.035 1.00 0.00 O ATOM 0 H TYR A 59 17.505 17.445 19.996 1.00 0.00 H new ATOM 0 HA TYR A 59 18.323 15.620 22.071 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.162 18.092 20.580 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.435 18.244 22.304 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.379 15.919 23.392 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.952 17.232 19.338 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.423 14.510 23.272 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.899 15.682 19.157 1.00 0.00 H new ATOM 0 HH TYR A 59 23.823 13.737 20.231 1.00 0.00 H new ATOM 948 N ASN A 60 16.119 17.828 22.676 1.00 0.00 N ATOM 949 CA ASN A 60 15.163 18.391 23.597 1.00 0.00 C ATOM 950 C ASN A 60 15.405 19.836 24.024 1.00 0.00 C ATOM 951 O ASN A 60 14.847 20.408 24.968 1.00 0.00 O ATOM 952 CB ASN A 60 14.723 17.373 24.659 1.00 0.00 C ATOM 953 CG ASN A 60 14.024 16.216 23.957 1.00 0.00 C ATOM 954 OD1 ASN A 60 14.744 15.374 23.423 1.00 0.00 O ATOM 955 ND2 ASN A 60 12.695 16.104 23.956 1.00 0.00 N ATOM 0 H ASN A 60 15.755 17.862 21.724 1.00 0.00 H new ATOM 0 HA ASN A 60 14.250 18.573 23.029 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.586 17.011 25.218 1.00 0.00 H new ATOM 0 HB3 ASN A 60 14.051 17.842 25.378 1.00 0.00 H new ATOM 0 HD21 ASN A 60 12.251 15.304 23.504 1.00 0.00 H new ATOM 0 HD22 ASN A 60 12.123 16.818 24.407 1.00 0.00 H new ATOM 962 N ILE A 61 16.155 20.584 23.224 1.00 0.00 N ATOM 963 CA ILE A 61 16.388 22.013 23.325 1.00 0.00 C ATOM 964 C ILE A 61 15.203 22.707 22.650 1.00 0.00 C ATOM 965 O ILE A 61 14.992 22.722 21.441 1.00 0.00 O ATOM 966 CB ILE A 61 17.716 22.226 22.587 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.914 21.413 23.092 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.084 23.713 22.588 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.119 21.446 22.151 1.00 0.00 C ATOM 0 H ILE A 61 16.650 20.175 22.432 1.00 0.00 H new ATOM 0 HA ILE A 61 16.459 22.413 24.336 1.00 0.00 H new ATOM 0 HB ILE A 61 17.523 21.852 21.582 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.215 21.794 24.068 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.605 20.378 23.236 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.028 23.855 22.062 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.301 24.282 22.087 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.185 24.062 23.616 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.927 20.849 22.574 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.835 21.037 21.181 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.455 22.475 22.026 1.00 0.00 H new ATOM 981 N GLN A 62 14.422 23.393 23.478 1.00 0.00 N ATOM 982 CA GLN A 62 13.215 24.137 23.174 1.00 0.00 C ATOM 983 C GLN A 62 13.490 25.613 22.887 1.00 0.00 C ATOM 984 O GLN A 62 14.608 26.070 23.138 1.00 0.00 O ATOM 985 CB GLN A 62 12.339 23.922 24.410 1.00 0.00 C ATOM 986 CG GLN A 62 10.846 24.042 24.099 1.00 0.00 C ATOM 987 CD GLN A 62 10.134 24.940 25.101 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.662 25.819 25.785 1.00 0.00 O ATOM 989 NE2 GLN A 62 8.814 24.825 25.132 1.00 0.00 N ATOM 0 H GLN A 62 14.644 23.444 24.472 1.00 0.00 H new ATOM 0 HA GLN A 62 12.731 23.793 22.260 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.542 22.936 24.828 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.608 24.653 25.173 1.00 0.00 H new ATOM 0 HG2 GLN A 62 10.714 24.442 23.094 1.00 0.00 H new ATOM 0 HG3 GLN A 62 10.391 23.052 24.110 1.00 0.00 H new ATOM 0 HE21 GLN A 62 8.351 24.106 24.576 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.261 25.455 25.712 1.00 0.00 H new ATOM 998 N LYS A 63 12.448 26.372 22.569 1.00 0.00 N ATOM 999 CA LYS A 63 12.480 27.820 22.445 1.00 0.00 C ATOM 1000 C LYS A 63 13.024 28.492 23.709 1.00 0.00 C ATOM 1001 O LYS A 63 12.540 28.191 24.805 1.00 0.00 O ATOM 1002 CB LYS A 63 11.155 28.334 21.899 1.00 0.00 C ATOM 1003 CG LYS A 63 9.922 27.936 22.703 1.00 0.00 C ATOM 1004 CD LYS A 63 8.601 28.450 22.127 1.00 0.00 C ATOM 1005 CE LYS A 63 7.335 28.024 22.875 1.00 0.00 C ATOM 1006 NZ LYS A 63 6.154 28.643 22.271 1.00 0.00 N ATOM 0 H LYS A 63 11.525 25.979 22.384 1.00 0.00 H new ATOM 0 HA LYS A 63 13.211 28.119 21.694 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.199 29.422 21.847 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.036 27.971 20.878 1.00 0.00 H new ATOM 0 HG2 LYS A 63 9.879 26.849 22.765 1.00 0.00 H new ATOM 0 HG3 LYS A 63 10.031 28.310 23.721 1.00 0.00 H new ATOM 0 HD2 LYS A 63 8.637 29.539 22.103 1.00 0.00 H new ATOM 0 HD3 LYS A 63 8.521 28.111 21.094 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.238 26.939 22.850 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.409 28.313 23.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 5.303 28.345 22.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 6.243 29.678 22.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.076 28.346 21.277 1.00 0.00 H new ATOM 1020 N GLU A 64 13.887 29.501 23.586 1.00 0.00 N ATOM 1021 CA GLU A 64 14.496 30.370 24.567 1.00 0.00 C ATOM 1022 C GLU A 64 15.502 29.636 25.456 1.00 0.00 C ATOM 1023 O GLU A 64 15.790 30.055 26.577 1.00 0.00 O ATOM 1024 CB GLU A 64 13.453 31.153 25.373 1.00 0.00 C ATOM 1025 CG GLU A 64 13.927 32.568 25.725 1.00 0.00 C ATOM 1026 CD GLU A 64 12.885 33.373 26.502 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.587 32.846 27.587 1.00 0.00 O ATOM 1028 OE2 GLU A 64 12.218 34.281 25.961 1.00 0.00 O ATOM 0 H GLU A 64 14.215 29.755 22.654 1.00 0.00 H new ATOM 0 HA GLU A 64 15.072 31.110 24.012 1.00 0.00 H new ATOM 0 HB2 GLU A 64 12.527 31.215 24.801 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.225 30.611 26.291 1.00 0.00 H new ATOM 0 HG2 GLU A 64 14.841 32.502 26.315 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.178 33.100 24.807 1.00 0.00 H new ATOM 1035 N SER A 65 16.092 28.511 25.053 1.00 0.00 N ATOM 1036 CA SER A 65 16.870 27.667 25.926 1.00 0.00 C ATOM 1037 C SER A 65 18.269 28.297 25.979 1.00 0.00 C ATOM 1038 O SER A 65 18.763 28.836 24.996 1.00 0.00 O ATOM 1039 CB SER A 65 17.158 26.269 25.372 1.00 0.00 C ATOM 1040 OG SER A 65 16.005 25.475 25.509 1.00 0.00 O ATOM 0 H SER A 65 16.035 28.165 24.095 1.00 0.00 H new ATOM 0 HA SER A 65 16.311 27.585 26.858 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.449 26.332 24.323 1.00 0.00 H new ATOM 0 HB3 SER A 65 17.992 25.816 25.908 1.00 0.00 H new ATOM 0 HG SER A 65 15.427 25.601 24.728 1.00 0.00 H new ATOM 1046 N THR A 66 18.785 28.299 27.207 1.00 0.00 N ATOM 1047 CA THR A 66 20.091 28.845 27.519 1.00 0.00 C ATOM 1048 C THR A 66 21.059 27.662 27.551 1.00 0.00 C ATOM 1049 O THR A 66 20.811 26.734 28.330 1.00 0.00 O ATOM 1050 CB THR A 66 20.045 29.501 28.901 1.00 0.00 C ATOM 1051 OG1 THR A 66 18.794 30.053 29.248 1.00 0.00 O ATOM 1052 CG2 THR A 66 21.151 30.546 28.797 1.00 0.00 C ATOM 0 H THR A 66 18.298 27.916 28.017 1.00 0.00 H new ATOM 0 HA THR A 66 20.399 29.591 26.786 1.00 0.00 H new ATOM 0 HB THR A 66 20.191 28.781 29.707 1.00 0.00 H new ATOM 0 HG1 THR A 66 18.848 30.449 30.143 1.00 0.00 H new ATOM 0 HG21 THR A 66 21.223 31.094 29.736 1.00 0.00 H new ATOM 0 HG22 THR A 66 22.101 30.052 28.592 1.00 0.00 H new ATOM 0 HG23 THR A 66 20.921 31.240 27.988 1.00 0.00 H new ATOM 1060 N LEU A 67 22.224 27.751 26.918 1.00 0.00 N ATOM 1061 CA LEU A 67 23.273 26.753 27.014 1.00 0.00 C ATOM 1062 C LEU A 67 24.645 27.401 26.851 1.00 0.00 C ATOM 1063 O LEU A 67 24.746 28.614 27.031 1.00 0.00 O ATOM 1064 CB LEU A 67 22.936 25.515 26.187 1.00 0.00 C ATOM 1065 CG LEU A 67 22.678 25.613 24.688 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.212 25.275 24.380 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.955 26.902 23.904 1.00 0.00 C ATOM 0 H LEU A 67 22.466 28.536 26.313 1.00 0.00 H new ATOM 0 HA LEU A 67 23.336 26.330 28.017 1.00 0.00 H new ATOM 0 HB2 LEU A 67 23.755 24.809 26.323 1.00 0.00 H new ATOM 0 HB3 LEU A 67 22.049 25.065 26.634 1.00 0.00 H new ATOM 0 HG LEU A 67 23.440 24.913 24.346 1.00 0.00 H new ATOM 0 HD11 LEU A 67 21.040 25.348 23.306 1.00 0.00 H new ATOM 0 HD12 LEU A 67 20.995 24.260 24.714 1.00 0.00 H new ATOM 0 HD13 LEU A 67 20.560 25.976 24.901 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.701 26.751 22.855 1.00 0.00 H new ATOM 0 HD22 LEU A 67 22.350 27.712 24.311 1.00 0.00 H new ATOM 0 HD23 LEU A 67 24.011 27.160 23.989 1.00 0.00 H new ATOM 1079 N HIS A 68 25.636 26.624 26.421 1.00 0.00 N ATOM 1080 CA HIS A 68 27.026 27.062 26.453 1.00 0.00 C ATOM 1081 C HIS A 68 27.951 26.326 25.486 1.00 0.00 C ATOM 1082 O HIS A 68 27.529 25.326 24.910 1.00 0.00 O ATOM 1083 CB HIS A 68 27.595 26.999 27.871 1.00 0.00 C ATOM 1084 CG HIS A 68 27.121 25.892 28.765 1.00 0.00 C ATOM 1085 ND1 HIS A 68 25.923 25.958 29.464 1.00 0.00 N ATOM 1086 CD2 HIS A 68 27.743 24.685 28.984 1.00 0.00 C ATOM 1087 CE1 HIS A 68 25.781 24.732 29.975 1.00 0.00 C ATOM 1088 NE2 HIS A 68 26.862 23.968 29.773 1.00 0.00 N ATOM 0 H HIS A 68 25.500 25.685 26.046 1.00 0.00 H new ATOM 0 HA HIS A 68 26.996 28.097 26.111 1.00 0.00 H new ATOM 0 HB2 HIS A 68 28.680 26.926 27.794 1.00 0.00 H new ATOM 0 HB3 HIS A 68 27.373 27.946 28.363 1.00 0.00 H new ATOM 0 HD2 HIS A 68 28.708 24.367 28.619 1.00 0.00 H new ATOM 0 HE1 HIS A 68 24.895 24.395 30.492 1.00 0.00 H new ATOM 0 HE2 HIS A 68 27.009 23.026 30.136 1.00 0.00 H new ATOM 1096 N LEU A 69 29.150 26.888 25.396 1.00 0.00 N ATOM 1097 CA LEU A 69 30.150 26.346 24.492 1.00 0.00 C ATOM 1098 C LEU A 69 31.402 26.180 25.341 1.00 0.00 C ATOM 1099 O LEU A 69 31.676 27.056 26.157 1.00 0.00 O ATOM 1100 CB LEU A 69 30.375 27.381 23.386 1.00 0.00 C ATOM 1101 CG LEU A 69 31.480 27.046 22.378 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.046 25.966 21.384 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.722 28.334 21.589 1.00 0.00 C ATOM 0 H LEU A 69 29.448 27.705 25.929 1.00 0.00 H new ATOM 0 HA LEU A 69 29.867 25.400 24.031 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.440 27.513 22.842 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.611 28.338 23.852 1.00 0.00 H new ATOM 0 HG LEU A 69 32.360 26.677 22.906 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.861 25.762 20.690 1.00 0.00 H new ATOM 0 HD12 LEU A 69 30.793 25.054 21.925 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.174 26.312 20.829 1.00 0.00 H new ATOM 0 HD21 LEU A 69 32.503 28.165 20.848 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.802 28.630 21.085 1.00 0.00 H new ATOM 0 HD23 LEU A 69 32.033 29.125 22.271 1.00 0.00 H new ATOM 1115 N VAL A 70 32.129 25.108 25.010 1.00 0.00 N ATOM 1116 CA VAL A 70 33.474 24.845 25.489 1.00 0.00 C ATOM 1117 C VAL A 70 34.435 24.770 24.307 1.00 0.00 C ATOM 1118 O VAL A 70 34.163 24.049 23.340 1.00 0.00 O ATOM 1119 CB VAL A 70 33.531 23.588 26.357 1.00 0.00 C ATOM 1120 CG1 VAL A 70 34.915 23.364 26.954 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.460 23.807 27.431 1.00 0.00 C ATOM 0 H VAL A 70 31.780 24.383 24.383 1.00 0.00 H new ATOM 0 HA VAL A 70 33.784 25.670 26.131 1.00 0.00 H new ATOM 0 HB VAL A 70 33.341 22.685 25.778 1.00 0.00 H new ATOM 0 HG11 VAL A 70 34.907 22.460 27.563 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.644 23.254 26.151 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.185 24.217 27.576 1.00 0.00 H new ATOM 0 HG21 VAL A 70 32.434 22.947 28.100 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.696 24.704 28.003 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.487 23.926 26.955 1.00 0.00 H new ATOM 1131 N LEU A 71 35.488 25.570 24.306 1.00 0.00 N ATOM 1132 CA LEU A 71 36.595 25.548 23.369 1.00 0.00 C ATOM 1133 C LEU A 71 37.644 24.559 23.880 1.00 0.00 C ATOM 1134 O LEU A 71 38.046 24.670 25.039 1.00 0.00 O ATOM 1135 CB LEU A 71 37.243 26.930 23.324 1.00 0.00 C ATOM 1136 CG LEU A 71 36.342 27.908 22.553 1.00 0.00 C ATOM 1137 CD1 LEU A 71 36.717 29.331 22.940 1.00 0.00 C ATOM 1138 CD2 LEU A 71 36.385 27.723 21.031 1.00 0.00 C ATOM 0 H LEU A 71 35.598 26.301 25.008 1.00 0.00 H new ATOM 0 HA LEU A 71 36.234 25.264 22.381 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.408 27.296 24.337 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.220 26.867 22.844 1.00 0.00 H new ATOM 0 HG LEU A 71 35.311 27.694 22.836 1.00 0.00 H new ATOM 0 HD11 LEU A 71 36.084 30.034 22.399 1.00 0.00 H new ATOM 0 HD12 LEU A 71 36.575 29.466 24.012 1.00 0.00 H new ATOM 0 HD13 LEU A 71 37.761 29.514 22.687 1.00 0.00 H new ATOM 0 HD21 LEU A 71 35.724 28.449 20.557 1.00 0.00 H new ATOM 0 HD22 LEU A 71 37.404 27.874 20.675 1.00 0.00 H new ATOM 0 HD23 LEU A 71 36.058 26.715 20.778 1.00 0.00 H new