USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 911 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 79 HIS : no HE2:sc= -1.46 K(o=-3.9,f=-5) USER MOD Set 1.2: B 9 ASN : amide:sc= -2.43 K(o=-3.9,f=-9.9!) USER MOD Set 2.1: A 58 MET CE :methyl -176:sc= -4.38 (180deg=-4.43!) USER MOD Set 2.2: A 68 LYS NZ :NH3+ -171:sc= 0.325 (180deg=0.439) USER MOD Set 3.1: A 46 MET CE :methyl -177:sc= -0.415 (180deg=-3.18e-05) USER MOD Set 3.2: A 80 GLN : amide:sc= -2.95! C(o=-3.4!,f=-4.8!) USER MOD Single : A 1 GLY N :NH3+ -115:sc= 0.0451 (180deg=0) USER MOD Single : A 5 SER OG : rot 79:sc= 0.492 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl -129:sc= -6.23! (180deg=-12.2!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.194 K(o=-0.19,f=-2.3!) USER MOD Single : A 20 GLN : amide:sc= -3.95 K(o=-3.9,f=-6.2!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= -1.21 K(o=-1.2,f=-0.53) USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.473 X(o=-0.47,f=0) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 HIS : no HD1:sc= -8.13! C(o=-8.1!,f=-6.6!) USER MOD Single : A 38 THR OG1 : rot -152:sc= -1.42! USER MOD Single : A 42 LYS NZ :NH3+ -159:sc= 0.611 (180deg=-0.0586) USER MOD Single : A 44 THR OG1 : rot 85:sc= -0.458! USER MOD Single : A 52 ASN : amide:sc= -4.81! K(o=-4.8!,f=-3.8) USER MOD Single : A 53 SER OG : rot 180:sc= -0.0896 USER MOD Single : A 57 HIS : no HD1:sc= -0.297 K(o=-0.3,f=-2.6!) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -0.0744 K(o=-0.074,f=-1.9!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= -0.265 X(o=-0.27,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= -0.286 K(o=-0.29,f=-2.1!) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -61:sc= 1.17 USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.0656 USER MOD Single : B 1 VAL N :NH3+ 170:sc= -0.0366 (180deg=-0.184) USER MOD Single : B 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 4 SER OG : rot 180:sc= -0.267 USER MOD Single : B 5 LYS NZ :NH3+ -108:sc= -0.722 (180deg=-2.72!) USER MOD Single : B 7 SER OG : rot -100:sc= -1.58! USER MOD Single : B 14 TYR OH : rot 180:sc= 0 USER MOD Single : B 16 SER OG : rot 77:sc= -2.47! USER MOD Single : B 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0.0794 USER MOD Single : B 21 SER OG : rot 180:sc= 0.0105 USER MOD Single : B 22 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.090 -8.802 1.352 1.00 0.00 N ATOM 2 CA GLY A 1 -13.741 -9.840 0.344 1.00 0.00 C ATOM 3 C GLY A 1 -12.444 -10.557 0.672 1.00 0.00 C ATOM 4 O GLY A 1 -11.618 -10.037 1.423 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.967 -9.073 1.840 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.319 -8.718 2.045 1.00 0.00 H new ATOM 0 H3 GLY A 1 -14.228 -7.888 0.876 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.549 -10.568 0.283 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.657 -9.374 -0.638 1.00 0.00 H new ATOM 10 N PRO A 2 -12.235 -11.763 0.118 1.00 0.00 N ATOM 11 CA PRO A 2 -11.019 -12.547 0.363 1.00 0.00 C ATOM 12 C PRO A 2 -9.791 -11.919 -0.290 1.00 0.00 C ATOM 13 O PRO A 2 -9.789 -10.730 -0.610 1.00 0.00 O ATOM 14 CB PRO A 2 -11.339 -13.903 -0.275 1.00 0.00 C ATOM 15 CG PRO A 2 -12.351 -13.601 -1.323 1.00 0.00 C ATOM 16 CD PRO A 2 -13.167 -12.456 -0.791 1.00 0.00 C ATOM 0 HA PRO A 2 -10.775 -12.611 1.423 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -10.447 -14.358 -0.706 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -11.730 -14.604 0.462 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -11.871 -13.334 -2.264 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -12.979 -14.469 -1.521 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -13.509 -11.800 -1.592 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -14.055 -12.806 -0.265 1.00 0.00 H new ATOM 24 N LEU A 3 -8.747 -12.719 -0.483 1.00 0.00 N ATOM 25 CA LEU A 3 -7.518 -12.230 -1.097 1.00 0.00 C ATOM 26 C LEU A 3 -7.738 -11.918 -2.573 1.00 0.00 C ATOM 27 O LEU A 3 -8.796 -12.219 -3.130 1.00 0.00 O ATOM 28 CB LEU A 3 -6.401 -13.267 -0.949 1.00 0.00 C ATOM 29 CG LEU A 3 -5.926 -13.509 0.484 1.00 0.00 C ATOM 30 CD1 LEU A 3 -4.927 -14.655 0.527 1.00 0.00 C ATOM 31 CD2 LEU A 3 -5.312 -12.245 1.064 1.00 0.00 C ATOM 0 H LEU A 3 -8.727 -13.705 -0.224 1.00 0.00 H new ATOM 0 HA LEU A 3 -7.226 -11.313 -0.586 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -6.747 -14.213 -1.365 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -5.549 -12.948 -1.549 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.789 -13.781 1.091 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.599 -14.814 1.554 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -5.399 -15.563 0.152 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -4.066 -14.411 -0.095 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -4.980 -12.437 2.084 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -4.460 -11.942 0.456 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -6.056 -11.448 1.068 1.00 0.00 H new ATOM 43 N GLY A 4 -6.738 -11.312 -3.202 1.00 0.00 N ATOM 44 CA GLY A 4 -6.846 -10.970 -4.607 1.00 0.00 C ATOM 45 C GLY A 4 -6.081 -11.928 -5.499 1.00 0.00 C ATOM 46 O GLY A 4 -5.302 -12.749 -5.015 1.00 0.00 O ATOM 0 H GLY A 4 -5.854 -11.051 -2.764 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.897 -10.969 -4.897 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.472 -9.958 -4.761 1.00 0.00 H new ATOM 50 N SER A 5 -6.303 -11.822 -6.805 1.00 0.00 N ATOM 51 CA SER A 5 -5.627 -12.686 -7.765 1.00 0.00 C ATOM 52 C SER A 5 -4.235 -12.149 -8.091 1.00 0.00 C ATOM 53 O SER A 5 -4.027 -10.937 -8.150 1.00 0.00 O ATOM 54 CB SER A 5 -6.455 -12.802 -9.047 1.00 0.00 C ATOM 55 OG SER A 5 -6.426 -11.592 -9.784 1.00 0.00 O ATOM 0 H SER A 5 -6.945 -11.148 -7.222 1.00 0.00 H new ATOM 0 HA SER A 5 -5.521 -13.675 -7.318 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.068 -13.615 -9.661 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.485 -13.054 -8.797 1.00 0.00 H new ATOM 0 HG SER A 5 -5.581 -11.529 -10.276 1.00 0.00 H new ATOM 61 N PRO A 6 -3.259 -13.049 -8.310 1.00 0.00 N ATOM 62 CA PRO A 6 -1.884 -12.655 -8.630 1.00 0.00 C ATOM 63 C PRO A 6 -1.815 -11.677 -9.801 1.00 0.00 C ATOM 64 O PRO A 6 -0.845 -10.932 -9.942 1.00 0.00 O ATOM 65 CB PRO A 6 -1.210 -13.978 -9.001 1.00 0.00 C ATOM 66 CG PRO A 6 -2.002 -15.018 -8.286 1.00 0.00 C ATOM 67 CD PRO A 6 -3.418 -14.515 -8.260 1.00 0.00 C ATOM 0 HA PRO A 6 -1.408 -12.136 -7.798 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -1.223 -14.141 -10.079 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -0.166 -13.992 -8.690 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -1.938 -15.978 -8.798 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -1.623 -15.170 -7.275 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -3.992 -14.886 -9.109 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -3.941 -14.832 -7.358 1.00 0.00 H new ATOM 75 N LEU A 7 -2.849 -11.683 -10.638 1.00 0.00 N ATOM 76 CA LEU A 7 -2.899 -10.794 -11.792 1.00 0.00 C ATOM 77 C LEU A 7 -3.872 -9.641 -11.553 1.00 0.00 C ATOM 78 O LEU A 7 -4.968 -9.836 -11.024 1.00 0.00 O ATOM 79 CB LEU A 7 -3.291 -11.575 -13.049 1.00 0.00 C ATOM 80 CG LEU A 7 -2.192 -11.683 -14.106 1.00 0.00 C ATOM 81 CD1 LEU A 7 -1.843 -10.308 -14.654 1.00 0.00 C ATOM 82 CD2 LEU A 7 -0.958 -12.356 -13.522 1.00 0.00 C ATOM 0 H LEU A 7 -3.661 -12.292 -10.538 1.00 0.00 H new ATOM 0 HA LEU A 7 -1.905 -10.371 -11.939 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -3.593 -12.580 -12.755 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -4.162 -11.099 -13.499 1.00 0.00 H new ATOM 0 HG LEU A 7 -2.562 -12.296 -14.928 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.059 -10.404 -15.405 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -2.728 -9.862 -15.108 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -1.492 -9.671 -13.842 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -0.185 -12.425 -14.287 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.586 -11.769 -12.683 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -1.218 -13.357 -13.177 1.00 0.00 H new ATOM 94 N THR A 8 -3.453 -8.437 -11.927 1.00 0.00 N ATOM 95 CA THR A 8 -4.261 -7.243 -11.727 1.00 0.00 C ATOM 96 C THR A 8 -5.203 -7.041 -12.898 1.00 0.00 C ATOM 97 O THR A 8 -6.306 -6.519 -12.733 1.00 0.00 O ATOM 98 CB THR A 8 -3.358 -6.013 -11.559 1.00 0.00 C ATOM 99 OG1 THR A 8 -2.524 -5.844 -12.697 1.00 0.00 O ATOM 100 CG2 THR A 8 -2.465 -6.078 -10.334 1.00 0.00 C ATOM 0 H THR A 8 -2.552 -8.263 -12.373 1.00 0.00 H new ATOM 0 HA THR A 8 -4.852 -7.372 -10.821 1.00 0.00 H new ATOM 0 HB THR A 8 -4.040 -5.171 -11.439 1.00 0.00 H new ATOM 0 HG1 THR A 8 -1.957 -5.054 -12.573 1.00 0.00 H new ATOM 0 HG21 THR A 8 -1.855 -5.176 -10.280 1.00 0.00 H new ATOM 0 HG22 THR A 8 -3.081 -6.154 -9.438 1.00 0.00 H new ATOM 0 HG23 THR A 8 -1.816 -6.951 -10.403 1.00 0.00 H new ATOM 108 N ALA A 9 -4.795 -7.492 -14.078 1.00 0.00 N ATOM 109 CA ALA A 9 -5.647 -7.385 -15.247 1.00 0.00 C ATOM 110 C ALA A 9 -6.940 -8.141 -14.983 1.00 0.00 C ATOM 111 O ALA A 9 -8.013 -7.549 -14.862 1.00 0.00 O ATOM 112 CB ALA A 9 -4.941 -7.934 -16.481 1.00 0.00 C ATOM 0 H ALA A 9 -3.889 -7.930 -14.246 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.873 -6.336 -15.438 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -5.598 -7.844 -17.346 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.027 -7.368 -16.659 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -4.693 -8.983 -16.322 1.00 0.00 H new ATOM 118 N SER A 10 -6.826 -9.463 -14.916 1.00 0.00 N ATOM 119 CA SER A 10 -7.979 -10.331 -14.694 1.00 0.00 C ATOM 120 C SER A 10 -8.724 -9.986 -13.409 1.00 0.00 C ATOM 121 O SER A 10 -9.930 -10.235 -13.297 1.00 0.00 O ATOM 122 CB SER A 10 -7.534 -11.793 -14.648 1.00 0.00 C ATOM 123 OG SER A 10 -8.556 -12.651 -15.124 1.00 0.00 O ATOM 0 H SER A 10 -5.941 -9.960 -15.013 1.00 0.00 H new ATOM 0 HA SER A 10 -8.664 -10.174 -15.527 1.00 0.00 H new ATOM 0 HB2 SER A 10 -6.636 -11.922 -15.251 1.00 0.00 H new ATOM 0 HB3 SER A 10 -7.273 -12.065 -13.625 1.00 0.00 H new ATOM 0 HG SER A 10 -8.247 -13.580 -15.086 1.00 0.00 H new ATOM 129 N MET A 11 -8.027 -9.402 -12.435 1.00 0.00 N ATOM 130 CA MET A 11 -8.684 -9.043 -11.184 1.00 0.00 C ATOM 131 C MET A 11 -9.762 -8.007 -11.463 1.00 0.00 C ATOM 132 O MET A 11 -10.873 -8.093 -10.943 1.00 0.00 O ATOM 133 CB MET A 11 -7.652 -8.554 -10.154 1.00 0.00 C ATOM 134 CG MET A 11 -7.799 -7.105 -9.717 1.00 0.00 C ATOM 135 SD MET A 11 -9.044 -6.893 -8.425 1.00 0.00 S ATOM 136 CE MET A 11 -10.240 -5.850 -9.256 1.00 0.00 C ATOM 0 H MET A 11 -7.034 -9.173 -12.486 1.00 0.00 H new ATOM 0 HA MET A 11 -9.165 -9.920 -10.751 1.00 0.00 H new ATOM 0 HB2 MET A 11 -7.717 -9.190 -9.271 1.00 0.00 H new ATOM 0 HB3 MET A 11 -6.655 -8.690 -10.572 1.00 0.00 H new ATOM 0 HG2 MET A 11 -6.838 -6.739 -9.354 1.00 0.00 H new ATOM 0 HG3 MET A 11 -8.068 -6.495 -10.579 1.00 0.00 H new ATOM 0 HE1 MET A 11 -10.467 -4.987 -8.630 1.00 0.00 H new ATOM 0 HE2 MET A 11 -9.828 -5.511 -10.207 1.00 0.00 H new ATOM 0 HE3 MET A 11 -11.153 -6.417 -9.438 1.00 0.00 H new ATOM 146 N LEU A 12 -9.437 -7.051 -12.317 1.00 0.00 N ATOM 147 CA LEU A 12 -10.392 -6.020 -12.702 1.00 0.00 C ATOM 148 C LEU A 12 -11.605 -6.668 -13.362 1.00 0.00 C ATOM 149 O LEU A 12 -12.740 -6.474 -12.925 1.00 0.00 O ATOM 150 CB LEU A 12 -9.742 -5.013 -13.657 1.00 0.00 C ATOM 151 CG LEU A 12 -10.113 -3.546 -13.414 1.00 0.00 C ATOM 152 CD1 LEU A 12 -11.528 -3.262 -13.898 1.00 0.00 C ATOM 153 CD2 LEU A 12 -9.971 -3.192 -11.939 1.00 0.00 C ATOM 0 H LEU A 12 -8.521 -6.965 -12.758 1.00 0.00 H new ATOM 0 HA LEU A 12 -10.713 -5.484 -11.809 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -8.659 -5.114 -13.583 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -10.017 -5.276 -14.678 1.00 0.00 H new ATOM 0 HG LEU A 12 -9.424 -2.922 -13.984 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -11.772 -2.215 -13.716 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -11.596 -3.470 -14.966 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -12.231 -3.897 -13.359 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -10.239 -2.146 -11.788 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -10.632 -3.825 -11.348 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -8.940 -3.351 -11.624 1.00 0.00 H new ATOM 165 N ALA A 13 -11.356 -7.453 -14.412 1.00 0.00 N ATOM 166 CA ALA A 13 -12.422 -8.151 -15.128 1.00 0.00 C ATOM 167 C ALA A 13 -13.015 -9.293 -14.299 1.00 0.00 C ATOM 168 O ALA A 13 -13.814 -10.084 -14.801 1.00 0.00 O ATOM 169 CB ALA A 13 -11.890 -8.693 -16.439 1.00 0.00 C ATOM 0 H ALA A 13 -10.422 -7.621 -14.785 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.218 -7.432 -15.319 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -12.689 -9.212 -16.969 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.524 -7.869 -17.052 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -11.074 -9.388 -16.241 1.00 0.00 H new ATOM 175 N SER A 14 -12.642 -9.355 -13.029 1.00 0.00 N ATOM 176 CA SER A 14 -13.160 -10.378 -12.129 1.00 0.00 C ATOM 177 C SER A 14 -14.452 -9.898 -11.473 1.00 0.00 C ATOM 178 O SER A 14 -15.413 -10.655 -11.344 1.00 0.00 O ATOM 179 CB SER A 14 -12.126 -10.730 -11.057 1.00 0.00 C ATOM 180 OG SER A 14 -12.565 -11.822 -10.267 1.00 0.00 O ATOM 0 H SER A 14 -11.982 -8.709 -12.597 1.00 0.00 H new ATOM 0 HA SER A 14 -13.370 -11.274 -12.713 1.00 0.00 H new ATOM 0 HB2 SER A 14 -11.176 -10.978 -11.530 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.948 -9.864 -10.420 1.00 0.00 H new ATOM 0 HG SER A 14 -11.887 -12.029 -9.590 1.00 0.00 H new ATOM 186 N ALA A 15 -14.458 -8.635 -11.047 1.00 0.00 N ATOM 187 CA ALA A 15 -15.626 -8.055 -10.386 1.00 0.00 C ATOM 188 C ALA A 15 -16.029 -6.724 -11.024 1.00 0.00 C ATOM 189 O ALA A 15 -16.002 -5.678 -10.373 1.00 0.00 O ATOM 190 CB ALA A 15 -15.339 -7.872 -8.904 1.00 0.00 C ATOM 0 H ALA A 15 -13.669 -7.996 -11.148 1.00 0.00 H new ATOM 0 HA ALA A 15 -16.464 -8.742 -10.508 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.212 -7.440 -8.415 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.114 -8.839 -8.455 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -14.485 -7.206 -8.778 1.00 0.00 H new ATOM 196 N PRO A 16 -16.410 -6.752 -12.316 1.00 0.00 N ATOM 197 CA PRO A 16 -16.819 -5.557 -13.054 1.00 0.00 C ATOM 198 C PRO A 16 -17.735 -4.630 -12.249 1.00 0.00 C ATOM 199 O PRO A 16 -17.517 -3.419 -12.222 1.00 0.00 O ATOM 200 CB PRO A 16 -17.566 -6.106 -14.279 1.00 0.00 C ATOM 201 CG PRO A 16 -17.471 -7.601 -14.217 1.00 0.00 C ATOM 202 CD PRO A 16 -16.459 -7.950 -13.161 1.00 0.00 C ATOM 0 HA PRO A 16 -15.953 -4.944 -13.304 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -18.608 -5.785 -14.271 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -17.123 -5.729 -15.201 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -18.441 -8.036 -13.976 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -17.171 -8.006 -15.183 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -16.761 -8.829 -12.592 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -15.485 -8.172 -13.598 1.00 0.00 H new ATOM 210 N PRO A 17 -18.781 -5.179 -11.597 1.00 0.00 N ATOM 211 CA PRO A 17 -19.730 -4.380 -10.806 1.00 0.00 C ATOM 212 C PRO A 17 -19.041 -3.437 -9.824 1.00 0.00 C ATOM 213 O PRO A 17 -17.889 -3.061 -10.012 1.00 0.00 O ATOM 214 CB PRO A 17 -20.538 -5.440 -10.055 1.00 0.00 C ATOM 215 CG PRO A 17 -20.486 -6.641 -10.931 1.00 0.00 C ATOM 216 CD PRO A 17 -19.136 -6.612 -11.595 1.00 0.00 C ATOM 0 HA PRO A 17 -20.331 -3.726 -11.438 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -20.108 -5.645 -9.075 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -21.565 -5.113 -9.891 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -20.615 -7.554 -10.350 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -21.286 -6.619 -11.671 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -18.406 -7.205 -11.045 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -19.178 -7.016 -12.606 1.00 0.00 H new ATOM 224 N GLN A 18 -19.760 -3.052 -8.773 1.00 0.00 N ATOM 225 CA GLN A 18 -19.224 -2.142 -7.762 1.00 0.00 C ATOM 226 C GLN A 18 -17.892 -2.630 -7.198 1.00 0.00 C ATOM 227 O GLN A 18 -17.150 -1.855 -6.595 1.00 0.00 O ATOM 228 CB GLN A 18 -20.236 -1.949 -6.632 1.00 0.00 C ATOM 229 CG GLN A 18 -20.547 -3.222 -5.865 1.00 0.00 C ATOM 230 CD GLN A 18 -21.779 -3.928 -6.393 1.00 0.00 C ATOM 231 OE1 GLN A 18 -21.680 -4.847 -7.207 1.00 0.00 O ATOM 232 NE2 GLN A 18 -22.948 -3.502 -5.932 1.00 0.00 N ATOM 0 H GLN A 18 -20.718 -3.356 -8.598 1.00 0.00 H new ATOM 0 HA GLN A 18 -19.041 -1.185 -8.251 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -19.853 -1.202 -5.937 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -21.161 -1.552 -7.049 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -19.692 -3.896 -5.923 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -20.692 -2.982 -4.812 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -22.982 -2.737 -5.258 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -23.812 -3.939 -6.252 1.00 0.00 H new ATOM 241 N GLU A 19 -17.578 -3.906 -7.406 1.00 0.00 N ATOM 242 CA GLU A 19 -16.319 -4.461 -6.926 1.00 0.00 C ATOM 243 C GLU A 19 -15.213 -4.240 -7.956 1.00 0.00 C ATOM 244 O GLU A 19 -14.298 -5.052 -8.082 1.00 0.00 O ATOM 245 CB GLU A 19 -16.473 -5.957 -6.637 1.00 0.00 C ATOM 246 CG GLU A 19 -17.388 -6.260 -5.460 1.00 0.00 C ATOM 247 CD GLU A 19 -16.759 -5.908 -4.123 1.00 0.00 C ATOM 248 OE1 GLU A 19 -15.663 -5.312 -4.121 1.00 0.00 O ATOM 249 OE2 GLU A 19 -17.365 -6.232 -3.080 1.00 0.00 O ATOM 0 H GLU A 19 -18.174 -4.570 -7.900 1.00 0.00 H new ATOM 0 HA GLU A 19 -16.047 -3.950 -6.003 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -16.863 -6.452 -7.526 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -15.489 -6.384 -6.441 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -18.319 -5.705 -5.576 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -17.645 -7.319 -5.468 1.00 0.00 H new ATOM 256 N GLN A 20 -15.277 -3.116 -8.662 1.00 0.00 N ATOM 257 CA GLN A 20 -14.249 -2.777 -9.644 1.00 0.00 C ATOM 258 C GLN A 20 -12.946 -2.435 -8.932 1.00 0.00 C ATOM 259 O GLN A 20 -12.101 -3.297 -8.693 1.00 0.00 O ATOM 260 CB GLN A 20 -14.672 -1.622 -10.580 1.00 0.00 C ATOM 261 CG GLN A 20 -15.887 -0.818 -10.131 1.00 0.00 C ATOM 262 CD GLN A 20 -16.446 0.050 -11.242 1.00 0.00 C ATOM 263 OE1 GLN A 20 -17.591 -0.118 -11.661 1.00 0.00 O ATOM 264 NE2 GLN A 20 -15.636 0.983 -11.729 1.00 0.00 N ATOM 0 H GLN A 20 -16.024 -2.427 -8.575 1.00 0.00 H new ATOM 0 HA GLN A 20 -14.105 -3.653 -10.276 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -13.829 -0.940 -10.690 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -14.878 -2.036 -11.567 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -16.662 -1.500 -9.781 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -15.611 -0.188 -9.285 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -14.694 1.088 -11.352 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -15.956 1.595 -12.480 1.00 0.00 H new ATOM 273 N LYS A 21 -12.813 -1.159 -8.585 1.00 0.00 N ATOM 274 CA LYS A 21 -11.637 -0.651 -7.876 1.00 0.00 C ATOM 275 C LYS A 21 -11.713 -0.963 -6.386 1.00 0.00 C ATOM 276 O LYS A 21 -10.972 -0.395 -5.587 1.00 0.00 O ATOM 277 CB LYS A 21 -11.508 0.858 -8.073 1.00 0.00 C ATOM 278 CG LYS A 21 -12.180 1.355 -9.338 1.00 0.00 C ATOM 279 CD LYS A 21 -11.599 0.691 -10.576 1.00 0.00 C ATOM 280 CE LYS A 21 -10.135 1.049 -10.768 1.00 0.00 C ATOM 281 NZ LYS A 21 -9.955 2.138 -11.767 1.00 0.00 N ATOM 0 H LYS A 21 -13.515 -0.446 -8.786 1.00 0.00 H new ATOM 0 HA LYS A 21 -10.761 -1.149 -8.291 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.943 1.369 -7.214 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.452 1.125 -8.101 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.250 1.155 -9.285 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.061 2.436 -9.414 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.701 -0.391 -10.491 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -12.167 0.997 -11.454 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -9.709 1.358 -9.814 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.585 0.165 -11.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -8.942 2.352 -11.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -10.338 1.834 -12.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -10.458 2.990 -11.447 1.00 0.00 H new ATOM 295 N GLN A 22 -12.604 -1.873 -6.016 1.00 0.00 N ATOM 296 CA GLN A 22 -12.765 -2.253 -4.618 1.00 0.00 C ATOM 297 C GLN A 22 -11.498 -2.890 -4.073 1.00 0.00 C ATOM 298 O GLN A 22 -10.855 -2.341 -3.177 1.00 0.00 O ATOM 299 CB GLN A 22 -13.943 -3.215 -4.459 1.00 0.00 C ATOM 300 CG GLN A 22 -14.993 -2.734 -3.473 1.00 0.00 C ATOM 301 CD GLN A 22 -14.889 -3.423 -2.126 1.00 0.00 C ATOM 302 OE1 GLN A 22 -15.887 -3.887 -1.574 1.00 0.00 O ATOM 303 NE2 GLN A 22 -13.677 -3.486 -1.587 1.00 0.00 N ATOM 0 H GLN A 22 -13.225 -2.361 -6.662 1.00 0.00 H new ATOM 0 HA GLN A 22 -12.965 -1.347 -4.047 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -14.412 -3.366 -5.431 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -13.568 -4.185 -4.133 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -14.890 -1.658 -3.335 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -15.985 -2.909 -3.890 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -12.878 -3.088 -2.081 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -13.545 -3.933 -0.680 1.00 0.00 H new ATOM 312 N MET A 23 -11.135 -4.052 -4.609 1.00 0.00 N ATOM 313 CA MET A 23 -9.941 -4.748 -4.156 1.00 0.00 C ATOM 314 C MET A 23 -8.720 -3.837 -4.247 1.00 0.00 C ATOM 315 O MET A 23 -8.401 -3.138 -3.295 1.00 0.00 O ATOM 316 CB MET A 23 -9.736 -6.032 -4.967 1.00 0.00 C ATOM 317 CG MET A 23 -10.970 -6.920 -5.020 1.00 0.00 C ATOM 318 SD MET A 23 -10.722 -8.517 -4.220 1.00 0.00 S ATOM 319 CE MET A 23 -11.089 -9.633 -5.573 1.00 0.00 C ATOM 0 H MET A 23 -11.648 -4.526 -5.352 1.00 0.00 H new ATOM 0 HA MET A 23 -10.072 -5.024 -3.110 1.00 0.00 H new ATOM 0 HB2 MET A 23 -9.445 -5.768 -5.983 1.00 0.00 H new ATOM 0 HB3 MET A 23 -8.910 -6.597 -4.535 1.00 0.00 H new ATOM 0 HG2 MET A 23 -11.803 -6.405 -4.541 1.00 0.00 H new ATOM 0 HG3 MET A 23 -11.251 -7.081 -6.061 1.00 0.00 H new ATOM 0 HE1 MET A 23 -10.979 -10.663 -5.235 1.00 0.00 H new ATOM 0 HE2 MET A 23 -12.112 -9.469 -5.912 1.00 0.00 H new ATOM 0 HE3 MET A 23 -10.399 -9.446 -6.396 1.00 0.00 H new ATOM 329 N LEU A 24 -8.031 -3.858 -5.383 1.00 0.00 N ATOM 330 CA LEU A 24 -6.828 -3.039 -5.577 1.00 0.00 C ATOM 331 C LEU A 24 -7.109 -1.539 -5.464 1.00 0.00 C ATOM 332 O LEU A 24 -6.771 -0.786 -6.379 1.00 0.00 O ATOM 333 CB LEU A 24 -6.176 -3.319 -6.945 1.00 0.00 C ATOM 334 CG LEU A 24 -7.005 -4.110 -7.958 1.00 0.00 C ATOM 335 CD1 LEU A 24 -8.164 -3.271 -8.473 1.00 0.00 C ATOM 336 CD2 LEU A 24 -6.118 -4.565 -9.106 1.00 0.00 C ATOM 0 H LEU A 24 -8.281 -4.433 -6.188 1.00 0.00 H new ATOM 0 HA LEU A 24 -6.146 -3.322 -4.775 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.911 -2.363 -7.396 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.245 -3.859 -6.773 1.00 0.00 H new ATOM 0 HG LEU A 24 -7.420 -4.989 -7.465 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.742 -3.851 -9.192 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.805 -2.985 -7.639 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -7.777 -2.374 -8.957 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -6.713 -5.128 -9.825 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.684 -3.694 -9.597 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -5.320 -5.199 -8.720 1.00 0.00 H new ATOM 348 N GLY A 25 -7.714 -1.092 -4.355 1.00 0.00 N ATOM 349 CA GLY A 25 -8.002 0.326 -4.200 1.00 0.00 C ATOM 350 C GLY A 25 -8.241 1.006 -5.538 1.00 0.00 C ATOM 351 O GLY A 25 -8.825 0.406 -6.442 1.00 0.00 O ATOM 0 H GLY A 25 -8.004 -1.681 -3.574 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -8.881 0.451 -3.567 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -7.170 0.812 -3.690 1.00 0.00 H new ATOM 355 N GLU A 26 -7.763 2.233 -5.693 1.00 0.00 N ATOM 356 CA GLU A 26 -7.909 2.926 -6.963 1.00 0.00 C ATOM 357 C GLU A 26 -6.932 2.320 -7.980 1.00 0.00 C ATOM 358 O GLU A 26 -7.295 1.441 -8.760 1.00 0.00 O ATOM 359 CB GLU A 26 -7.706 4.449 -6.816 1.00 0.00 C ATOM 360 CG GLU A 26 -7.510 4.936 -5.384 1.00 0.00 C ATOM 361 CD GLU A 26 -7.802 6.416 -5.220 1.00 0.00 C ATOM 362 OE1 GLU A 26 -7.159 7.228 -5.918 1.00 0.00 O ATOM 363 OE2 GLU A 26 -8.666 6.763 -4.387 1.00 0.00 O ATOM 0 H GLU A 26 -7.278 2.761 -4.967 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.929 2.791 -7.322 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -6.838 4.744 -7.406 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.570 4.959 -7.243 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.160 4.367 -4.719 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -6.484 4.736 -5.075 1.00 0.00 H new ATOM 370 N ARG A 27 -5.693 2.806 -7.960 1.00 0.00 N ATOM 371 CA ARG A 27 -4.648 2.328 -8.876 1.00 0.00 C ATOM 372 C ARG A 27 -3.301 2.145 -8.157 1.00 0.00 C ATOM 373 O ARG A 27 -2.255 1.988 -8.794 1.00 0.00 O ATOM 374 CB ARG A 27 -4.484 3.315 -10.039 1.00 0.00 C ATOM 375 CG ARG A 27 -5.236 2.921 -11.304 1.00 0.00 C ATOM 376 CD ARG A 27 -4.936 1.489 -11.712 1.00 0.00 C ATOM 377 NE ARG A 27 -4.955 1.315 -13.162 1.00 0.00 N ATOM 378 CZ ARG A 27 -4.737 0.151 -13.770 1.00 0.00 C ATOM 379 NH1 ARG A 27 -4.489 -0.940 -13.056 1.00 0.00 N ATOM 380 NH2 ARG A 27 -4.771 0.078 -15.093 1.00 0.00 N ATOM 0 H ARG A 27 -5.382 3.535 -7.317 1.00 0.00 H new ATOM 0 HA ARG A 27 -4.959 1.355 -9.257 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -4.827 4.298 -9.717 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.424 3.409 -10.274 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -6.308 3.036 -11.141 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -4.962 3.596 -12.115 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -3.959 1.200 -11.325 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -5.669 0.822 -11.258 1.00 0.00 H new ATOM 0 HE ARG A 27 -5.146 2.132 -13.742 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -4.465 -0.888 -12.038 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -4.323 -1.830 -13.526 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -4.964 0.914 -15.645 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -4.604 -0.814 -15.559 1.00 0.00 H new ATOM 394 N LEU A 28 -3.334 2.178 -6.829 1.00 0.00 N ATOM 395 CA LEU A 28 -2.127 2.041 -6.014 1.00 0.00 C ATOM 396 C LEU A 28 -1.591 0.612 -5.977 1.00 0.00 C ATOM 397 O LEU A 28 -0.388 0.394 -6.103 1.00 0.00 O ATOM 398 CB LEU A 28 -2.428 2.483 -4.589 1.00 0.00 C ATOM 399 CG LEU A 28 -2.004 3.902 -4.231 1.00 0.00 C ATOM 400 CD1 LEU A 28 -3.014 4.504 -3.267 1.00 0.00 C ATOM 401 CD2 LEU A 28 -0.607 3.898 -3.624 1.00 0.00 C ATOM 0 H LEU A 28 -4.190 2.299 -6.288 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.363 2.669 -6.473 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.501 2.391 -4.419 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.936 1.793 -3.903 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.975 4.511 -5.134 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.712 5.519 -3.010 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.997 4.526 -3.737 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.058 3.899 -2.362 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.316 4.918 -3.373 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.604 3.287 -2.721 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.101 3.486 -4.343 1.00 0.00 H new ATOM 413 N PHE A 29 -2.482 -0.355 -5.788 1.00 0.00 N ATOM 414 CA PHE A 29 -2.083 -1.758 -5.715 1.00 0.00 C ATOM 415 C PHE A 29 -1.162 -2.124 -6.873 1.00 0.00 C ATOM 416 O PHE A 29 -0.080 -2.659 -6.662 1.00 0.00 O ATOM 417 CB PHE A 29 -3.320 -2.653 -5.718 1.00 0.00 C ATOM 418 CG PHE A 29 -3.215 -3.911 -4.890 1.00 0.00 C ATOM 419 CD1 PHE A 29 -2.383 -4.006 -3.778 1.00 0.00 C ATOM 420 CD2 PHE A 29 -3.983 -5.014 -5.232 1.00 0.00 C ATOM 421 CE1 PHE A 29 -2.332 -5.180 -3.041 1.00 0.00 C ATOM 422 CE2 PHE A 29 -3.935 -6.178 -4.501 1.00 0.00 C ATOM 423 CZ PHE A 29 -3.110 -6.264 -3.403 1.00 0.00 C ATOM 0 H PHE A 29 -3.484 -0.195 -5.683 1.00 0.00 H new ATOM 0 HA PHE A 29 -1.534 -1.912 -4.786 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -4.168 -2.071 -5.357 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.541 -2.934 -6.748 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -1.775 -3.162 -3.488 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -4.634 -4.958 -6.092 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -1.682 -5.248 -2.181 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -4.544 -7.023 -4.788 1.00 0.00 H new ATOM 0 HZ PHE A 29 -3.070 -7.176 -2.826 1.00 0.00 H new ATOM 433 N PRO A 30 -1.568 -1.826 -8.117 1.00 0.00 N ATOM 434 CA PRO A 30 -0.749 -2.123 -9.292 1.00 0.00 C ATOM 435 C PRO A 30 0.634 -1.485 -9.192 1.00 0.00 C ATOM 436 O PRO A 30 1.646 -2.117 -9.496 1.00 0.00 O ATOM 437 CB PRO A 30 -1.534 -1.509 -10.456 1.00 0.00 C ATOM 438 CG PRO A 30 -2.931 -1.352 -9.958 1.00 0.00 C ATOM 439 CD PRO A 30 -2.837 -1.169 -8.470 1.00 0.00 C ATOM 0 HA PRO A 30 -0.575 -3.193 -9.406 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -1.112 -0.548 -10.750 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -1.501 -2.153 -11.334 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -3.415 -0.494 -10.424 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -3.531 -2.228 -10.204 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -2.831 -0.114 -8.196 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -3.682 -1.627 -7.956 1.00 0.00 H new ATOM 447 N LEU A 31 0.661 -0.222 -8.781 1.00 0.00 N ATOM 448 CA LEU A 31 1.918 0.518 -8.655 1.00 0.00 C ATOM 449 C LEU A 31 2.757 0.018 -7.483 1.00 0.00 C ATOM 450 O LEU A 31 3.952 -0.285 -7.620 1.00 0.00 O ATOM 451 CB LEU A 31 1.628 2.003 -8.485 1.00 0.00 C ATOM 452 CG LEU A 31 0.614 2.565 -9.478 1.00 0.00 C ATOM 453 CD1 LEU A 31 0.085 3.918 -9.018 1.00 0.00 C ATOM 454 CD2 LEU A 31 1.246 2.667 -10.852 1.00 0.00 C ATOM 0 H LEU A 31 -0.170 0.313 -8.529 1.00 0.00 H new ATOM 0 HA LEU A 31 2.492 0.355 -9.567 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.262 2.176 -7.473 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.561 2.557 -8.585 1.00 0.00 H new ATOM 0 HG LEU A 31 -0.236 1.885 -9.531 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.635 4.293 -9.745 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -0.402 3.808 -8.049 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.913 4.622 -8.931 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.519 3.069 -11.558 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.111 3.328 -10.806 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.563 1.677 -11.181 1.00 0.00 H new ATOM 466 N ILE A 32 2.127 -0.085 -6.331 1.00 0.00 N ATOM 467 CA ILE A 32 2.824 -0.551 -5.155 1.00 0.00 C ATOM 468 C ILE A 32 3.193 -2.013 -5.321 1.00 0.00 C ATOM 469 O ILE A 32 4.304 -2.411 -4.994 1.00 0.00 O ATOM 470 CB ILE A 32 2.009 -0.345 -3.875 1.00 0.00 C ATOM 471 CG1 ILE A 32 2.920 -0.550 -2.662 1.00 0.00 C ATOM 472 CG2 ILE A 32 0.808 -1.278 -3.847 1.00 0.00 C ATOM 473 CD1 ILE A 32 3.165 -2.001 -2.315 1.00 0.00 C ATOM 0 H ILE A 32 1.144 0.145 -6.186 1.00 0.00 H new ATOM 0 HA ILE A 32 3.731 0.045 -5.052 1.00 0.00 H new ATOM 0 HB ILE A 32 1.619 0.673 -3.846 1.00 0.00 H new ATOM 0 HG12 ILE A 32 3.878 -0.066 -2.854 1.00 0.00 H new ATOM 0 HG13 ILE A 32 2.478 -0.051 -1.800 1.00 0.00 H new ATOM 0 HG21 ILE A 32 0.242 -1.116 -2.929 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.170 -1.076 -4.707 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.150 -2.312 -3.884 1.00 0.00 H new ATOM 0 HD11 ILE A 32 3.819 -2.062 -1.445 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.216 -2.486 -2.089 1.00 0.00 H new ATOM 0 HD13 ILE A 32 3.637 -2.502 -3.160 1.00 0.00 H new ATOM 485 N GLN A 33 2.272 -2.806 -5.869 1.00 0.00 N ATOM 486 CA GLN A 33 2.543 -4.214 -6.109 1.00 0.00 C ATOM 487 C GLN A 33 3.923 -4.361 -6.746 1.00 0.00 C ATOM 488 O GLN A 33 4.715 -5.227 -6.372 1.00 0.00 O ATOM 489 CB GLN A 33 1.485 -4.835 -7.023 1.00 0.00 C ATOM 490 CG GLN A 33 1.721 -6.311 -7.294 1.00 0.00 C ATOM 491 CD GLN A 33 0.799 -6.868 -8.365 1.00 0.00 C ATOM 492 OE1 GLN A 33 0.149 -7.893 -8.165 1.00 0.00 O ATOM 493 NE2 GLN A 33 0.739 -6.192 -9.508 1.00 0.00 N ATOM 0 H GLN A 33 1.342 -2.497 -6.151 1.00 0.00 H new ATOM 0 HA GLN A 33 2.514 -4.738 -5.154 1.00 0.00 H new ATOM 0 HB2 GLN A 33 0.502 -4.708 -6.569 1.00 0.00 H new ATOM 0 HB3 GLN A 33 1.471 -4.296 -7.970 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.757 -6.458 -7.600 1.00 0.00 H new ATOM 0 HG3 GLN A 33 1.579 -6.872 -6.371 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.296 -5.346 -9.630 1.00 0.00 H new ATOM 0 HE22 GLN A 33 0.136 -6.519 -10.263 1.00 0.00 H new ATOM 502 N ALA A 34 4.193 -3.488 -7.716 1.00 0.00 N ATOM 503 CA ALA A 34 5.470 -3.479 -8.428 1.00 0.00 C ATOM 504 C ALA A 34 6.642 -3.312 -7.474 1.00 0.00 C ATOM 505 O ALA A 34 7.730 -3.840 -7.703 1.00 0.00 O ATOM 506 CB ALA A 34 5.476 -2.372 -9.474 1.00 0.00 C ATOM 0 H ALA A 34 3.538 -2.772 -8.029 1.00 0.00 H new ATOM 0 HA ALA A 34 5.584 -4.443 -8.924 1.00 0.00 H new ATOM 0 HB1 ALA A 34 6.431 -2.373 -9.999 1.00 0.00 H new ATOM 0 HB2 ALA A 34 4.669 -2.541 -10.187 1.00 0.00 H new ATOM 0 HB3 ALA A 34 5.332 -1.409 -8.985 1.00 0.00 H new ATOM 512 N MET A 35 6.411 -2.570 -6.409 1.00 0.00 N ATOM 513 CA MET A 35 7.456 -2.317 -5.406 1.00 0.00 C ATOM 514 C MET A 35 7.303 -3.241 -4.196 1.00 0.00 C ATOM 515 O MET A 35 8.249 -3.924 -3.799 1.00 0.00 O ATOM 516 CB MET A 35 7.412 -0.857 -4.950 1.00 0.00 C ATOM 517 CG MET A 35 7.525 0.136 -6.096 1.00 0.00 C ATOM 518 SD MET A 35 8.977 1.197 -5.961 1.00 0.00 S ATOM 519 CE MET A 35 9.891 0.712 -7.422 1.00 0.00 C ATOM 0 H MET A 35 5.515 -2.127 -6.206 1.00 0.00 H new ATOM 0 HA MET A 35 8.420 -2.522 -5.873 1.00 0.00 H new ATOM 0 HB2 MET A 35 6.479 -0.679 -4.415 1.00 0.00 H new ATOM 0 HB3 MET A 35 8.223 -0.680 -4.244 1.00 0.00 H new ATOM 0 HG2 MET A 35 7.565 -0.408 -7.040 1.00 0.00 H new ATOM 0 HG3 MET A 35 6.629 0.756 -6.123 1.00 0.00 H new ATOM 0 HE1 MET A 35 10.818 1.283 -7.478 1.00 0.00 H new ATOM 0 HE2 MET A 35 10.123 -0.352 -7.370 1.00 0.00 H new ATOM 0 HE3 MET A 35 9.290 0.909 -8.309 1.00 0.00 H new ATOM 529 N HIS A 36 6.102 -3.280 -3.639 1.00 0.00 N ATOM 530 CA HIS A 36 5.795 -4.138 -2.497 1.00 0.00 C ATOM 531 C HIS A 36 6.678 -3.861 -1.280 1.00 0.00 C ATOM 532 O HIS A 36 7.142 -4.798 -0.629 1.00 0.00 O ATOM 533 CB HIS A 36 5.937 -5.604 -2.890 1.00 0.00 C ATOM 534 CG HIS A 36 4.669 -6.211 -3.393 1.00 0.00 C ATOM 535 ND1 HIS A 36 4.581 -7.510 -3.844 1.00 0.00 N ATOM 536 CD2 HIS A 36 3.426 -5.691 -3.513 1.00 0.00 C ATOM 537 CE1 HIS A 36 3.342 -7.765 -4.219 1.00 0.00 C ATOM 538 NE2 HIS A 36 2.619 -6.677 -4.028 1.00 0.00 N ATOM 0 H HIS A 36 5.313 -2.721 -3.962 1.00 0.00 H new ATOM 0 HA HIS A 36 4.767 -3.912 -2.213 1.00 0.00 H new ATOM 0 HB2 HIS A 36 6.704 -5.693 -3.660 1.00 0.00 H new ATOM 0 HB3 HIS A 36 6.285 -6.171 -2.027 1.00 0.00 H new ATOM 0 HD2 HIS A 36 3.124 -4.687 -3.252 1.00 0.00 H new ATOM 0 HE1 HIS A 36 2.981 -8.703 -4.614 1.00 0.00 H new ATOM 0 HE2 HIS A 36 1.624 -6.583 -4.230 1.00 0.00 H new ATOM 546 N PRO A 37 6.914 -2.593 -0.923 1.00 0.00 N ATOM 547 CA PRO A 37 7.724 -2.282 0.245 1.00 0.00 C ATOM 548 C PRO A 37 7.101 -2.863 1.513 1.00 0.00 C ATOM 549 O PRO A 37 7.599 -3.841 2.068 1.00 0.00 O ATOM 550 CB PRO A 37 7.746 -0.751 0.296 1.00 0.00 C ATOM 551 CG PRO A 37 6.617 -0.303 -0.568 1.00 0.00 C ATOM 552 CD PRO A 37 6.405 -1.385 -1.591 1.00 0.00 C ATOM 0 HA PRO A 37 8.725 -2.709 0.181 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.624 -0.391 1.318 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.696 -0.361 -0.068 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.715 -0.146 0.023 1.00 0.00 H new ATOM 0 HG3 PRO A 37 6.851 0.646 -1.050 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.353 -1.486 -1.856 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.948 -1.177 -2.513 1.00 0.00 H new ATOM 560 N THR A 38 6.020 -2.242 1.978 1.00 0.00 N ATOM 561 CA THR A 38 5.344 -2.687 3.195 1.00 0.00 C ATOM 562 C THR A 38 4.211 -3.670 2.897 1.00 0.00 C ATOM 563 O THR A 38 4.261 -4.828 3.313 1.00 0.00 O ATOM 564 CB THR A 38 4.794 -1.484 3.965 1.00 0.00 C ATOM 565 OG1 THR A 38 4.090 -0.613 3.101 1.00 0.00 O ATOM 566 CG2 THR A 38 5.865 -0.674 4.659 1.00 0.00 C ATOM 0 H THR A 38 5.593 -1.430 1.532 1.00 0.00 H new ATOM 0 HA THR A 38 6.084 -3.207 3.804 1.00 0.00 H new ATOM 0 HB THR A 38 4.134 -1.907 4.723 1.00 0.00 H new ATOM 0 HG1 THR A 38 4.133 0.301 3.452 1.00 0.00 H new ATOM 0 HG21 THR A 38 5.405 0.163 5.185 1.00 0.00 H new ATOM 0 HG22 THR A 38 6.393 -1.305 5.373 1.00 0.00 H new ATOM 0 HG23 THR A 38 6.570 -0.294 3.920 1.00 0.00 H new ATOM 574 N LEU A 39 3.185 -3.200 2.193 1.00 0.00 N ATOM 575 CA LEU A 39 2.037 -4.042 1.864 1.00 0.00 C ATOM 576 C LEU A 39 1.149 -3.365 0.825 1.00 0.00 C ATOM 577 O LEU A 39 0.449 -2.402 1.130 1.00 0.00 O ATOM 578 CB LEU A 39 1.228 -4.330 3.135 1.00 0.00 C ATOM 579 CG LEU A 39 0.760 -5.778 3.315 1.00 0.00 C ATOM 580 CD1 LEU A 39 -0.185 -6.180 2.194 1.00 0.00 C ATOM 581 CD2 LEU A 39 1.949 -6.725 3.382 1.00 0.00 C ATOM 0 H LEU A 39 3.124 -2.245 1.840 1.00 0.00 H new ATOM 0 HA LEU A 39 2.402 -4.979 1.444 1.00 0.00 H new ATOM 0 HB2 LEU A 39 1.833 -4.054 3.998 1.00 0.00 H new ATOM 0 HB3 LEU A 39 0.352 -3.682 3.140 1.00 0.00 H new ATOM 0 HG LEU A 39 0.219 -5.846 4.259 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -0.506 -7.211 2.341 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -1.056 -5.525 2.200 1.00 0.00 H new ATOM 0 HD13 LEU A 39 0.328 -6.092 1.236 1.00 0.00 H new ATOM 0 HD21 LEU A 39 1.593 -7.747 3.510 1.00 0.00 H new ATOM 0 HD22 LEU A 39 2.523 -6.654 2.458 1.00 0.00 H new ATOM 0 HD23 LEU A 39 2.583 -6.453 4.226 1.00 0.00 H new ATOM 593 N ALA A 40 1.179 -3.882 -0.401 1.00 0.00 N ATOM 594 CA ALA A 40 0.378 -3.348 -1.506 1.00 0.00 C ATOM 595 C ALA A 40 -1.073 -3.071 -1.108 1.00 0.00 C ATOM 596 O ALA A 40 -1.606 -2.006 -1.415 1.00 0.00 O ATOM 597 CB ALA A 40 0.466 -4.296 -2.697 1.00 0.00 C ATOM 0 H ALA A 40 1.757 -4.682 -0.659 1.00 0.00 H new ATOM 0 HA ALA A 40 0.792 -2.379 -1.786 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -0.129 -3.902 -3.521 1.00 0.00 H new ATOM 0 HB2 ALA A 40 1.505 -4.389 -3.012 1.00 0.00 H new ATOM 0 HB3 ALA A 40 0.085 -5.276 -2.411 1.00 0.00 H new ATOM 603 N GLY A 41 -1.723 -4.027 -0.459 1.00 0.00 N ATOM 604 CA GLY A 41 -3.111 -3.838 -0.073 1.00 0.00 C ATOM 605 C GLY A 41 -3.325 -2.639 0.838 1.00 0.00 C ATOM 606 O GLY A 41 -4.020 -1.688 0.476 1.00 0.00 O ATOM 0 H GLY A 41 -1.319 -4.925 -0.193 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.717 -3.716 -0.971 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.466 -4.737 0.431 1.00 0.00 H new ATOM 610 N LYS A 42 -2.751 -2.701 2.035 1.00 0.00 N ATOM 611 CA LYS A 42 -2.897 -1.632 3.026 1.00 0.00 C ATOM 612 C LYS A 42 -2.210 -0.336 2.598 1.00 0.00 C ATOM 613 O LYS A 42 -2.741 0.758 2.809 1.00 0.00 O ATOM 614 CB LYS A 42 -2.328 -2.088 4.369 1.00 0.00 C ATOM 615 CG LYS A 42 -3.366 -2.705 5.288 1.00 0.00 C ATOM 616 CD LYS A 42 -3.681 -4.132 4.882 1.00 0.00 C ATOM 617 CE LYS A 42 -4.810 -4.182 3.867 1.00 0.00 C ATOM 618 NZ LYS A 42 -6.146 -4.242 4.524 1.00 0.00 N ATOM 0 H LYS A 42 -2.176 -3.484 2.347 1.00 0.00 H new ATOM 0 HA LYS A 42 -3.963 -1.424 3.116 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.535 -2.814 4.191 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.872 -1.234 4.870 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -3.001 -2.689 6.315 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -4.278 -2.108 5.264 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -2.790 -4.597 4.461 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -3.956 -4.711 5.764 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -4.760 -3.302 3.225 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -4.682 -5.053 3.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -6.845 -4.625 3.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -6.094 -4.857 5.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -6.433 -3.286 4.815 1.00 0.00 H new ATOM 632 N ILE A 43 -1.031 -0.457 2.000 1.00 0.00 N ATOM 633 CA ILE A 43 -0.278 0.712 1.555 1.00 0.00 C ATOM 634 C ILE A 43 -1.135 1.619 0.682 1.00 0.00 C ATOM 635 O ILE A 43 -1.030 2.845 0.739 1.00 0.00 O ATOM 636 CB ILE A 43 0.979 0.297 0.774 1.00 0.00 C ATOM 637 CG1 ILE A 43 1.874 1.502 0.505 1.00 0.00 C ATOM 638 CG2 ILE A 43 0.599 -0.379 -0.528 1.00 0.00 C ATOM 639 CD1 ILE A 43 3.342 1.155 0.531 1.00 0.00 C ATOM 0 H ILE A 43 -0.575 -1.350 1.812 1.00 0.00 H new ATOM 0 HA ILE A 43 0.022 1.259 2.449 1.00 0.00 H new ATOM 0 HB ILE A 43 1.536 -0.414 1.384 1.00 0.00 H new ATOM 0 HG12 ILE A 43 1.622 1.926 -0.467 1.00 0.00 H new ATOM 0 HG13 ILE A 43 1.674 2.272 1.250 1.00 0.00 H new ATOM 0 HG21 ILE A 43 1.502 -0.665 -1.066 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.005 -1.268 -0.316 1.00 0.00 H new ATOM 0 HG23 ILE A 43 0.016 0.310 -1.139 1.00 0.00 H new ATOM 0 HD11 ILE A 43 3.931 2.051 0.333 1.00 0.00 H new ATOM 0 HD12 ILE A 43 3.604 0.757 1.511 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.552 0.406 -0.233 1.00 0.00 H new ATOM 651 N THR A 44 -1.974 0.999 -0.127 1.00 0.00 N ATOM 652 CA THR A 44 -2.855 1.720 -1.031 1.00 0.00 C ATOM 653 C THR A 44 -3.873 2.560 -0.260 1.00 0.00 C ATOM 654 O THR A 44 -4.172 3.691 -0.643 1.00 0.00 O ATOM 655 CB THR A 44 -3.576 0.715 -1.939 1.00 0.00 C ATOM 656 OG1 THR A 44 -2.671 0.104 -2.839 1.00 0.00 O ATOM 657 CG2 THR A 44 -4.695 1.321 -2.756 1.00 0.00 C ATOM 0 H THR A 44 -2.065 -0.016 -0.177 1.00 0.00 H new ATOM 0 HA THR A 44 -2.256 2.400 -1.636 1.00 0.00 H new ATOM 0 HB THR A 44 -4.008 -0.015 -1.255 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.244 -0.663 -2.403 1.00 0.00 H new ATOM 0 HG21 THR A 44 -5.156 0.548 -3.372 1.00 0.00 H new ATOM 0 HG22 THR A 44 -5.444 1.747 -2.088 1.00 0.00 H new ATOM 0 HG23 THR A 44 -4.293 2.105 -3.398 1.00 0.00 H new ATOM 665 N GLY A 45 -4.407 2.003 0.819 1.00 0.00 N ATOM 666 CA GLY A 45 -5.386 2.723 1.611 1.00 0.00 C ATOM 667 C GLY A 45 -4.856 4.047 2.110 1.00 0.00 C ATOM 668 O GLY A 45 -5.612 5.001 2.292 1.00 0.00 O ATOM 0 H GLY A 45 -4.181 1.068 1.160 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.280 2.894 1.012 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -5.685 2.110 2.461 1.00 0.00 H new ATOM 672 N MET A 46 -3.551 4.103 2.329 1.00 0.00 N ATOM 673 CA MET A 46 -2.910 5.316 2.811 1.00 0.00 C ATOM 674 C MET A 46 -2.778 6.346 1.696 1.00 0.00 C ATOM 675 O MET A 46 -3.285 7.462 1.813 1.00 0.00 O ATOM 676 CB MET A 46 -1.542 4.984 3.397 1.00 0.00 C ATOM 677 CG MET A 46 -1.619 4.446 4.815 1.00 0.00 C ATOM 678 SD MET A 46 -2.535 2.896 4.924 1.00 0.00 S ATOM 679 CE MET A 46 -3.131 2.975 6.613 1.00 0.00 C ATOM 0 H MET A 46 -2.914 3.320 2.180 1.00 0.00 H new ATOM 0 HA MET A 46 -3.535 5.749 3.592 1.00 0.00 H new ATOM 0 HB2 MET A 46 -1.049 4.248 2.761 1.00 0.00 H new ATOM 0 HB3 MET A 46 -0.921 5.880 3.387 1.00 0.00 H new ATOM 0 HG2 MET A 46 -0.609 4.294 5.197 1.00 0.00 H new ATOM 0 HG3 MET A 46 -2.093 5.189 5.456 1.00 0.00 H new ATOM 0 HE1 MET A 46 -3.673 2.060 6.851 1.00 0.00 H new ATOM 0 HE2 MET A 46 -2.286 3.083 7.292 1.00 0.00 H new ATOM 0 HE3 MET A 46 -3.798 3.830 6.724 1.00 0.00 H new ATOM 689 N LEU A 47 -2.087 5.980 0.620 1.00 0.00 N ATOM 690 CA LEU A 47 -1.894 6.904 -0.492 1.00 0.00 C ATOM 691 C LEU A 47 -3.241 7.356 -1.036 1.00 0.00 C ATOM 692 O LEU A 47 -3.332 8.405 -1.673 1.00 0.00 O ATOM 693 CB LEU A 47 -1.058 6.258 -1.606 1.00 0.00 C ATOM 694 CG LEU A 47 0.408 5.930 -1.275 1.00 0.00 C ATOM 695 CD1 LEU A 47 1.364 6.823 -2.067 1.00 0.00 C ATOM 696 CD2 LEU A 47 0.689 6.041 0.217 1.00 0.00 C ATOM 0 H LEU A 47 -1.657 5.063 0.495 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.350 7.774 -0.123 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -1.552 5.335 -1.909 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -1.070 6.924 -2.469 1.00 0.00 H new ATOM 0 HG LEU A 47 0.579 4.894 -1.569 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.393 6.569 -1.813 1.00 0.00 H new ATOM 0 HD12 LEU A 47 1.205 6.670 -3.134 1.00 0.00 H new ATOM 0 HD13 LEU A 47 1.176 7.868 -1.819 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.735 5.802 0.409 1.00 0.00 H new ATOM 0 HD22 LEU A 47 0.482 7.058 0.552 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.051 5.343 0.760 1.00 0.00 H new ATOM 708 N LEU A 48 -4.288 6.553 -0.805 1.00 0.00 N ATOM 709 CA LEU A 48 -5.636 6.871 -1.292 1.00 0.00 C ATOM 710 C LEU A 48 -6.132 8.252 -0.827 1.00 0.00 C ATOM 711 O LEU A 48 -7.326 8.542 -0.913 1.00 0.00 O ATOM 712 CB LEU A 48 -6.628 5.793 -0.822 1.00 0.00 C ATOM 713 CG LEU A 48 -7.305 4.993 -1.939 1.00 0.00 C ATOM 714 CD1 LEU A 48 -6.361 3.938 -2.479 1.00 0.00 C ATOM 715 CD2 LEU A 48 -8.591 4.342 -1.442 1.00 0.00 C ATOM 0 H LEU A 48 -4.227 5.678 -0.284 1.00 0.00 H new ATOM 0 HA LEU A 48 -5.579 6.894 -2.380 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -6.101 5.098 -0.168 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -7.401 6.272 -0.221 1.00 0.00 H new ATOM 0 HG LEU A 48 -7.560 5.684 -2.743 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.857 3.378 -3.272 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -5.468 4.419 -2.878 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -6.079 3.257 -1.676 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -9.052 3.780 -2.254 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -8.362 3.666 -0.618 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -9.280 5.113 -1.098 1.00 0.00 H new ATOM 727 N GLU A 49 -5.224 9.106 -0.358 1.00 0.00 N ATOM 728 CA GLU A 49 -5.584 10.443 0.092 1.00 0.00 C ATOM 729 C GLU A 49 -5.882 11.354 -1.102 1.00 0.00 C ATOM 730 O GLU A 49 -6.305 12.497 -0.926 1.00 0.00 O ATOM 731 CB GLU A 49 -4.442 11.040 0.921 1.00 0.00 C ATOM 732 CG GLU A 49 -4.903 11.936 2.060 1.00 0.00 C ATOM 733 CD GLU A 49 -4.543 13.394 1.841 1.00 0.00 C ATOM 734 OE1 GLU A 49 -3.337 13.694 1.713 1.00 0.00 O ATOM 735 OE2 GLU A 49 -5.466 14.234 1.799 1.00 0.00 O ATOM 0 H GLU A 49 -4.230 8.891 -0.281 1.00 0.00 H new ATOM 0 HA GLU A 49 -6.480 10.369 0.708 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -3.843 10.228 1.332 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.791 11.614 0.262 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.983 11.846 2.173 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.455 11.591 2.992 1.00 0.00 H new ATOM 742 N ILE A 50 -5.653 10.846 -2.315 1.00 0.00 N ATOM 743 CA ILE A 50 -5.889 11.618 -3.529 1.00 0.00 C ATOM 744 C ILE A 50 -7.105 11.087 -4.302 1.00 0.00 C ATOM 745 O ILE A 50 -7.669 10.050 -3.955 1.00 0.00 O ATOM 746 CB ILE A 50 -4.633 11.616 -4.429 1.00 0.00 C ATOM 747 CG1 ILE A 50 -4.452 12.976 -5.108 1.00 0.00 C ATOM 748 CG2 ILE A 50 -4.707 10.505 -5.459 1.00 0.00 C ATOM 749 CD1 ILE A 50 -3.260 13.753 -4.592 1.00 0.00 C ATOM 0 H ILE A 50 -5.304 9.902 -2.479 1.00 0.00 H new ATOM 0 HA ILE A 50 -6.103 12.645 -3.232 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.764 11.432 -3.797 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.341 12.825 -6.182 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.354 13.570 -4.961 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.812 10.525 -6.080 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.776 9.543 -4.952 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.587 10.648 -6.086 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -3.192 14.706 -5.117 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.379 13.935 -3.524 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -2.350 13.179 -4.763 1.00 0.00 H new ATOM 761 N ASP A 51 -7.477 11.793 -5.372 1.00 0.00 N ATOM 762 CA ASP A 51 -8.592 11.390 -6.225 1.00 0.00 C ATOM 763 C ASP A 51 -8.217 10.206 -7.116 1.00 0.00 C ATOM 764 O ASP A 51 -7.075 10.095 -7.559 1.00 0.00 O ATOM 765 CB ASP A 51 -9.046 12.565 -7.089 1.00 0.00 C ATOM 766 CG ASP A 51 -10.552 12.734 -7.090 1.00 0.00 C ATOM 767 OD1 ASP A 51 -11.143 12.819 -5.992 1.00 0.00 O ATOM 768 OD2 ASP A 51 -11.144 12.781 -8.189 1.00 0.00 O ATOM 0 H ASP A 51 -7.016 12.654 -5.668 1.00 0.00 H new ATOM 0 HA ASP A 51 -9.410 11.079 -5.576 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -8.581 13.481 -6.725 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -8.699 12.416 -8.112 1.00 0.00 H new ATOM 773 N ASN A 52 -9.189 9.345 -7.410 1.00 0.00 N ATOM 774 CA ASN A 52 -8.945 8.201 -8.288 1.00 0.00 C ATOM 775 C ASN A 52 -8.292 8.660 -9.597 1.00 0.00 C ATOM 776 O ASN A 52 -7.609 7.888 -10.273 1.00 0.00 O ATOM 777 CB ASN A 52 -10.260 7.480 -8.608 1.00 0.00 C ATOM 778 CG ASN A 52 -10.036 6.097 -9.198 1.00 0.00 C ATOM 779 OD1 ASN A 52 -8.904 5.711 -9.489 1.00 0.00 O ATOM 780 ND2 ASN A 52 -11.117 5.340 -9.380 1.00 0.00 N ATOM 0 H ASN A 52 -10.144 9.415 -7.058 1.00 0.00 H new ATOM 0 HA ASN A 52 -8.274 7.516 -7.770 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -10.853 7.392 -7.698 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -10.839 8.081 -9.309 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -11.024 4.404 -9.774 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -12.038 5.697 -9.126 1.00 0.00 H new ATOM 787 N SER A 53 -8.531 9.923 -9.953 1.00 0.00 N ATOM 788 CA SER A 53 -8.002 10.492 -11.191 1.00 0.00 C ATOM 789 C SER A 53 -6.505 10.762 -11.114 1.00 0.00 C ATOM 790 O SER A 53 -5.811 10.722 -12.129 1.00 0.00 O ATOM 791 CB SER A 53 -8.737 11.790 -11.527 1.00 0.00 C ATOM 792 OG SER A 53 -8.490 12.784 -10.547 1.00 0.00 O ATOM 0 H SER A 53 -9.089 10.572 -9.399 1.00 0.00 H new ATOM 0 HA SER A 53 -8.165 9.754 -11.976 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.416 12.151 -12.504 1.00 0.00 H new ATOM 0 HB3 SER A 53 -9.808 11.599 -11.594 1.00 0.00 H new ATOM 0 HG SER A 53 -8.970 13.605 -10.785 1.00 0.00 H new ATOM 798 N GLU A 54 -6.009 11.050 -9.919 1.00 0.00 N ATOM 799 CA GLU A 54 -4.592 11.336 -9.748 1.00 0.00 C ATOM 800 C GLU A 54 -3.761 10.061 -9.811 1.00 0.00 C ATOM 801 O GLU A 54 -2.724 10.026 -10.466 1.00 0.00 O ATOM 802 CB GLU A 54 -4.348 12.064 -8.427 1.00 0.00 C ATOM 803 CG GLU A 54 -4.264 13.575 -8.580 1.00 0.00 C ATOM 804 CD GLU A 54 -3.046 14.013 -9.371 1.00 0.00 C ATOM 805 OE1 GLU A 54 -1.922 13.911 -8.835 1.00 0.00 O ATOM 806 OE2 GLU A 54 -3.217 14.457 -10.525 1.00 0.00 O ATOM 0 H GLU A 54 -6.560 11.092 -9.062 1.00 0.00 H new ATOM 0 HA GLU A 54 -4.280 11.983 -10.568 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -5.151 11.820 -7.732 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -3.421 11.698 -7.984 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.165 13.937 -9.076 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.237 14.036 -7.593 1.00 0.00 H new ATOM 813 N LEU A 55 -4.223 9.012 -9.137 1.00 0.00 N ATOM 814 CA LEU A 55 -3.508 7.741 -9.131 1.00 0.00 C ATOM 815 C LEU A 55 -3.352 7.205 -10.549 1.00 0.00 C ATOM 816 O LEU A 55 -2.361 6.551 -10.873 1.00 0.00 O ATOM 817 CB LEU A 55 -4.246 6.721 -8.263 1.00 0.00 C ATOM 818 CG LEU A 55 -3.678 6.541 -6.857 1.00 0.00 C ATOM 819 CD1 LEU A 55 -4.127 7.673 -5.956 1.00 0.00 C ATOM 820 CD2 LEU A 55 -4.112 5.211 -6.277 1.00 0.00 C ATOM 0 H LEU A 55 -5.084 9.017 -8.591 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.516 7.909 -8.713 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.290 7.023 -8.181 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.232 5.757 -8.771 1.00 0.00 H new ATOM 0 HG LEU A 55 -2.590 6.556 -6.922 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -3.713 7.529 -4.958 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -3.776 8.622 -6.361 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.215 7.683 -5.900 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -3.698 5.099 -5.275 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.200 5.174 -6.227 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.750 4.402 -6.911 1.00 0.00 H new ATOM 832 N LEU A 56 -4.330 7.506 -11.396 1.00 0.00 N ATOM 833 CA LEU A 56 -4.287 7.072 -12.786 1.00 0.00 C ATOM 834 C LEU A 56 -3.114 7.735 -13.505 1.00 0.00 C ATOM 835 O LEU A 56 -2.366 7.085 -14.237 1.00 0.00 O ATOM 836 CB LEU A 56 -5.600 7.418 -13.491 1.00 0.00 C ATOM 837 CG LEU A 56 -6.557 6.241 -13.689 1.00 0.00 C ATOM 838 CD1 LEU A 56 -7.095 5.761 -12.350 1.00 0.00 C ATOM 839 CD2 LEU A 56 -7.697 6.636 -14.614 1.00 0.00 C ATOM 0 H LEU A 56 -5.158 8.046 -11.146 1.00 0.00 H new ATOM 0 HA LEU A 56 -4.152 5.991 -12.811 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.111 8.190 -12.916 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -5.369 7.847 -14.466 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.007 5.421 -14.151 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -7.774 4.923 -12.510 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.266 5.441 -11.719 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -7.631 6.574 -11.861 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -8.369 5.788 -14.745 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -8.246 7.471 -14.179 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -7.294 6.933 -15.582 1.00 0.00 H new ATOM 851 N HIS A 57 -2.967 9.037 -13.282 1.00 0.00 N ATOM 852 CA HIS A 57 -1.892 9.816 -13.890 1.00 0.00 C ATOM 853 C HIS A 57 -0.527 9.299 -13.449 1.00 0.00 C ATOM 854 O HIS A 57 0.417 9.261 -14.236 1.00 0.00 O ATOM 855 CB HIS A 57 -2.032 11.292 -13.518 1.00 0.00 C ATOM 856 CG HIS A 57 -2.625 12.132 -14.606 1.00 0.00 C ATOM 857 ND1 HIS A 57 -2.489 11.839 -15.945 1.00 0.00 N ATOM 858 CD2 HIS A 57 -3.362 13.268 -14.546 1.00 0.00 C ATOM 859 CE1 HIS A 57 -3.113 12.754 -16.663 1.00 0.00 C ATOM 860 NE2 HIS A 57 -3.651 13.633 -15.838 1.00 0.00 N ATOM 0 H HIS A 57 -3.585 9.580 -12.679 1.00 0.00 H new ATOM 0 HA HIS A 57 -1.969 9.710 -14.972 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -2.654 11.376 -12.627 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -1.050 11.688 -13.260 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -3.665 13.789 -13.650 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -3.173 12.779 -17.741 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -4.194 14.451 -16.115 1.00 0.00 H new ATOM 868 N MET A 58 -0.420 8.903 -12.188 1.00 0.00 N ATOM 869 CA MET A 58 0.841 8.386 -11.669 1.00 0.00 C ATOM 870 C MET A 58 1.165 7.057 -12.337 1.00 0.00 C ATOM 871 O MET A 58 2.296 6.808 -12.747 1.00 0.00 O ATOM 872 CB MET A 58 0.790 8.194 -10.148 1.00 0.00 C ATOM 873 CG MET A 58 -0.088 9.190 -9.414 1.00 0.00 C ATOM 874 SD MET A 58 0.617 10.850 -9.385 1.00 0.00 S ATOM 875 CE MET A 58 -0.645 11.766 -10.265 1.00 0.00 C ATOM 0 H MET A 58 -1.182 8.929 -11.511 1.00 0.00 H new ATOM 0 HA MET A 58 1.619 9.117 -11.892 1.00 0.00 H new ATOM 0 HB2 MET A 58 0.432 7.187 -9.934 1.00 0.00 H new ATOM 0 HB3 MET A 58 1.803 8.262 -9.752 1.00 0.00 H new ATOM 0 HG2 MET A 58 -1.068 9.224 -9.890 1.00 0.00 H new ATOM 0 HG3 MET A 58 -0.242 8.847 -8.391 1.00 0.00 H new ATOM 0 HE1 MET A 58 -0.322 12.799 -10.393 1.00 0.00 H new ATOM 0 HE2 MET A 58 -0.808 11.313 -11.243 1.00 0.00 H new ATOM 0 HE3 MET A 58 -1.574 11.744 -9.696 1.00 0.00 H new ATOM 885 N LEU A 59 0.152 6.205 -12.425 1.00 0.00 N ATOM 886 CA LEU A 59 0.306 4.885 -13.016 1.00 0.00 C ATOM 887 C LEU A 59 0.761 4.970 -14.468 1.00 0.00 C ATOM 888 O LEU A 59 1.392 4.045 -14.980 1.00 0.00 O ATOM 889 CB LEU A 59 -1.012 4.114 -12.907 1.00 0.00 C ATOM 890 CG LEU A 59 -1.115 2.855 -13.769 1.00 0.00 C ATOM 891 CD1 LEU A 59 -1.602 1.676 -12.939 1.00 0.00 C ATOM 892 CD2 LEU A 59 -2.040 3.098 -14.955 1.00 0.00 C ATOM 0 H LEU A 59 -0.790 6.408 -12.092 1.00 0.00 H new ATOM 0 HA LEU A 59 1.081 4.352 -12.465 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.162 3.832 -11.865 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.828 4.785 -13.176 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.123 2.615 -14.151 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.669 0.790 -13.570 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -0.901 1.490 -12.125 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.585 1.903 -12.527 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.103 2.193 -15.559 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.034 3.363 -14.593 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -1.646 3.913 -15.563 1.00 0.00 H new ATOM 904 N GLU A 60 0.466 6.083 -15.126 1.00 0.00 N ATOM 905 CA GLU A 60 0.881 6.265 -16.511 1.00 0.00 C ATOM 906 C GLU A 60 2.230 6.989 -16.583 1.00 0.00 C ATOM 907 O GLU A 60 2.791 7.167 -17.665 1.00 0.00 O ATOM 908 CB GLU A 60 -0.192 7.025 -17.302 1.00 0.00 C ATOM 909 CG GLU A 60 -0.168 8.532 -17.106 1.00 0.00 C ATOM 910 CD GLU A 60 -1.443 9.202 -17.578 1.00 0.00 C ATOM 911 OE1 GLU A 60 -2.529 8.822 -17.091 1.00 0.00 O ATOM 912 OE2 GLU A 60 -1.357 10.108 -18.432 1.00 0.00 O ATOM 0 H GLU A 60 -0.053 6.866 -14.729 1.00 0.00 H new ATOM 0 HA GLU A 60 1.002 5.281 -16.964 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -0.067 6.807 -18.363 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -1.173 6.649 -17.013 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.014 8.755 -16.050 1.00 0.00 H new ATOM 0 HG3 GLU A 60 0.680 8.952 -17.647 1.00 0.00 H new ATOM 919 N SER A 61 2.751 7.396 -15.421 1.00 0.00 N ATOM 920 CA SER A 61 4.034 8.090 -15.351 1.00 0.00 C ATOM 921 C SER A 61 4.815 7.671 -14.102 1.00 0.00 C ATOM 922 O SER A 61 4.535 8.145 -13.000 1.00 0.00 O ATOM 923 CB SER A 61 3.820 9.605 -15.348 1.00 0.00 C ATOM 924 OG SER A 61 4.176 10.173 -16.595 1.00 0.00 O ATOM 0 H SER A 61 2.301 7.255 -14.517 1.00 0.00 H new ATOM 0 HA SER A 61 4.615 7.814 -16.231 1.00 0.00 H new ATOM 0 HB2 SER A 61 2.776 9.827 -15.129 1.00 0.00 H new ATOM 0 HB3 SER A 61 4.416 10.058 -14.555 1.00 0.00 H new ATOM 0 HG SER A 61 4.028 11.141 -16.567 1.00 0.00 H new ATOM 930 N PRO A 62 5.809 6.772 -14.254 1.00 0.00 N ATOM 931 CA PRO A 62 6.627 6.295 -13.129 1.00 0.00 C ATOM 932 C PRO A 62 7.224 7.431 -12.305 1.00 0.00 C ATOM 933 O PRO A 62 7.400 7.310 -11.092 1.00 0.00 O ATOM 934 CB PRO A 62 7.745 5.507 -13.814 1.00 0.00 C ATOM 935 CG PRO A 62 7.164 5.067 -15.110 1.00 0.00 C ATOM 936 CD PRO A 62 6.212 6.153 -15.531 1.00 0.00 C ATOM 0 HA PRO A 62 6.033 5.714 -12.424 1.00 0.00 H new ATOM 0 HB2 PRO A 62 8.629 6.127 -13.967 1.00 0.00 H new ATOM 0 HB3 PRO A 62 8.055 4.654 -13.210 1.00 0.00 H new ATOM 0 HG2 PRO A 62 7.944 4.921 -15.857 1.00 0.00 H new ATOM 0 HG3 PRO A 62 6.645 4.115 -15.001 1.00 0.00 H new ATOM 0 HD2 PRO A 62 6.693 6.874 -16.192 1.00 0.00 H new ATOM 0 HD3 PRO A 62 5.355 5.749 -16.069 1.00 0.00 H new ATOM 944 N GLU A 63 7.548 8.529 -12.977 1.00 0.00 N ATOM 945 CA GLU A 63 8.145 9.691 -12.325 1.00 0.00 C ATOM 946 C GLU A 63 7.294 10.182 -11.154 1.00 0.00 C ATOM 947 O GLU A 63 7.773 10.279 -10.023 1.00 0.00 O ATOM 948 CB GLU A 63 8.349 10.819 -13.342 1.00 0.00 C ATOM 949 CG GLU A 63 7.243 10.924 -14.384 1.00 0.00 C ATOM 950 CD GLU A 63 7.692 10.493 -15.765 1.00 0.00 C ATOM 951 OE1 GLU A 63 8.152 9.340 -15.907 1.00 0.00 O ATOM 952 OE2 GLU A 63 7.579 11.305 -16.707 1.00 0.00 O ATOM 0 H GLU A 63 7.406 8.640 -13.981 1.00 0.00 H new ATOM 0 HA GLU A 63 9.112 9.387 -11.925 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.422 11.766 -12.808 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.300 10.667 -13.852 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.398 10.309 -14.073 1.00 0.00 H new ATOM 0 HG3 GLU A 63 6.888 11.954 -14.428 1.00 0.00 H new ATOM 959 N SER A 64 6.030 10.479 -11.427 1.00 0.00 N ATOM 960 CA SER A 64 5.111 10.950 -10.401 1.00 0.00 C ATOM 961 C SER A 64 4.663 9.782 -9.539 1.00 0.00 C ATOM 962 O SER A 64 4.396 9.929 -8.347 1.00 0.00 O ATOM 963 CB SER A 64 3.896 11.619 -11.050 1.00 0.00 C ATOM 964 OG SER A 64 3.909 13.019 -10.836 1.00 0.00 O ATOM 0 H SER A 64 5.617 10.401 -12.356 1.00 0.00 H new ATOM 0 HA SER A 64 5.621 11.682 -9.775 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.891 11.412 -12.120 1.00 0.00 H new ATOM 0 HB3 SER A 64 2.980 11.194 -10.639 1.00 0.00 H new ATOM 0 HG SER A 64 3.124 13.422 -11.262 1.00 0.00 H new ATOM 970 N LEU A 65 4.576 8.618 -10.170 1.00 0.00 N ATOM 971 CA LEU A 65 4.151 7.411 -9.491 1.00 0.00 C ATOM 972 C LEU A 65 5.045 7.130 -8.296 1.00 0.00 C ATOM 973 O LEU A 65 4.576 7.118 -7.158 1.00 0.00 O ATOM 974 CB LEU A 65 4.165 6.234 -10.473 1.00 0.00 C ATOM 975 CG LEU A 65 4.164 4.828 -9.863 1.00 0.00 C ATOM 976 CD1 LEU A 65 5.583 4.382 -9.546 1.00 0.00 C ATOM 977 CD2 LEU A 65 3.288 4.766 -8.619 1.00 0.00 C ATOM 0 H LEU A 65 4.797 8.489 -11.157 1.00 0.00 H new ATOM 0 HA LEU A 65 3.134 7.548 -9.123 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.295 6.323 -11.123 1.00 0.00 H new ATOM 0 HB3 LEU A 65 5.047 6.330 -11.106 1.00 0.00 H new ATOM 0 HG LEU A 65 3.743 4.143 -10.599 1.00 0.00 H new ATOM 0 HD11 LEU A 65 5.562 3.382 -9.114 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.174 4.369 -10.462 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.032 5.075 -8.835 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.308 3.756 -8.210 1.00 0.00 H new ATOM 0 HD22 LEU A 65 3.664 5.467 -7.874 1.00 0.00 H new ATOM 0 HD23 LEU A 65 2.264 5.031 -8.882 1.00 0.00 H new ATOM 989 N ARG A 66 6.327 6.912 -8.539 1.00 0.00 N ATOM 990 CA ARG A 66 7.249 6.639 -7.447 1.00 0.00 C ATOM 991 C ARG A 66 7.230 7.780 -6.437 1.00 0.00 C ATOM 992 O ARG A 66 7.437 7.572 -5.243 1.00 0.00 O ATOM 993 CB ARG A 66 8.668 6.426 -7.974 1.00 0.00 C ATOM 994 CG ARG A 66 9.000 4.971 -8.260 1.00 0.00 C ATOM 995 CD ARG A 66 10.376 4.821 -8.894 1.00 0.00 C ATOM 996 NE ARG A 66 11.392 5.622 -8.212 1.00 0.00 N ATOM 997 CZ ARG A 66 12.701 5.475 -8.402 1.00 0.00 C ATOM 998 NH1 ARG A 66 13.159 4.555 -9.240 1.00 0.00 N ATOM 999 NH2 ARG A 66 13.555 6.251 -7.748 1.00 0.00 N ATOM 0 H ARG A 66 6.749 6.918 -9.468 1.00 0.00 H new ATOM 0 HA ARG A 66 6.925 5.724 -6.951 1.00 0.00 H new ATOM 0 HB2 ARG A 66 8.798 7.006 -8.888 1.00 0.00 H new ATOM 0 HB3 ARG A 66 9.379 6.816 -7.246 1.00 0.00 H new ATOM 0 HG2 ARG A 66 8.963 4.400 -7.332 1.00 0.00 H new ATOM 0 HG3 ARG A 66 8.245 4.549 -8.924 1.00 0.00 H new ATOM 0 HD2 ARG A 66 10.670 3.772 -8.874 1.00 0.00 H new ATOM 0 HD3 ARG A 66 10.325 5.118 -9.942 1.00 0.00 H new ATOM 0 HE ARG A 66 11.079 6.335 -7.553 1.00 0.00 H new ATOM 0 HH11 ARG A 66 12.507 3.954 -9.744 1.00 0.00 H new ATOM 0 HH12 ARG A 66 14.164 4.448 -9.381 1.00 0.00 H new ATOM 0 HH21 ARG A 66 13.208 6.959 -7.101 1.00 0.00 H new ATOM 0 HH22 ARG A 66 14.559 6.140 -7.892 1.00 0.00 H new ATOM 1013 N SER A 67 6.976 8.984 -6.927 1.00 0.00 N ATOM 1014 CA SER A 67 6.922 10.168 -6.077 1.00 0.00 C ATOM 1015 C SER A 67 5.992 9.961 -4.881 1.00 0.00 C ATOM 1016 O SER A 67 6.359 10.248 -3.741 1.00 0.00 O ATOM 1017 CB SER A 67 6.450 11.371 -6.893 1.00 0.00 C ATOM 1018 OG SER A 67 7.072 12.564 -6.452 1.00 0.00 O ATOM 0 H SER A 67 6.803 9.169 -7.915 1.00 0.00 H new ATOM 0 HA SER A 67 7.926 10.351 -5.695 1.00 0.00 H new ATOM 0 HB2 SER A 67 6.674 11.209 -7.947 1.00 0.00 H new ATOM 0 HB3 SER A 67 5.368 11.469 -6.808 1.00 0.00 H new ATOM 0 HG SER A 67 6.754 13.318 -6.992 1.00 0.00 H new ATOM 1024 N LYS A 68 4.783 9.475 -5.149 1.00 0.00 N ATOM 1025 CA LYS A 68 3.797 9.247 -4.094 1.00 0.00 C ATOM 1026 C LYS A 68 4.079 7.968 -3.314 1.00 0.00 C ATOM 1027 O LYS A 68 4.115 7.978 -2.084 1.00 0.00 O ATOM 1028 CB LYS A 68 2.386 9.179 -4.684 1.00 0.00 C ATOM 1029 CG LYS A 68 2.157 10.118 -5.854 1.00 0.00 C ATOM 1030 CD LYS A 68 0.672 10.377 -6.074 1.00 0.00 C ATOM 1031 CE LYS A 68 0.387 11.844 -6.352 1.00 0.00 C ATOM 1032 NZ LYS A 68 -0.995 12.055 -6.870 1.00 0.00 N ATOM 0 H LYS A 68 4.462 9.231 -6.086 1.00 0.00 H new ATOM 0 HA LYS A 68 3.869 10.089 -3.405 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.188 8.157 -5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 68 1.665 9.410 -3.900 1.00 0.00 H new ATOM 0 HG2 LYS A 68 2.670 11.062 -5.671 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.591 9.689 -6.757 1.00 0.00 H new ATOM 0 HD2 LYS A 68 0.318 9.774 -6.910 1.00 0.00 H new ATOM 0 HD3 LYS A 68 0.114 10.059 -5.193 1.00 0.00 H new ATOM 0 HE2 LYS A 68 0.523 12.420 -5.437 1.00 0.00 H new ATOM 0 HE3 LYS A 68 1.108 12.223 -7.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -1.099 13.039 -7.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -1.169 11.411 -7.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -1.682 11.862 -6.114 1.00 0.00 H new ATOM 1046 N VAL A 69 4.269 6.863 -4.030 1.00 0.00 N ATOM 1047 CA VAL A 69 4.535 5.575 -3.395 1.00 0.00 C ATOM 1048 C VAL A 69 5.761 5.637 -2.498 1.00 0.00 C ATOM 1049 O VAL A 69 5.704 5.249 -1.331 1.00 0.00 O ATOM 1050 CB VAL A 69 4.740 4.470 -4.445 1.00 0.00 C ATOM 1051 CG1 VAL A 69 4.799 3.105 -3.776 1.00 0.00 C ATOM 1052 CG2 VAL A 69 3.635 4.521 -5.489 1.00 0.00 C ATOM 0 H VAL A 69 4.244 6.833 -5.049 1.00 0.00 H new ATOM 0 HA VAL A 69 3.662 5.340 -2.787 1.00 0.00 H new ATOM 0 HB VAL A 69 5.691 4.638 -4.950 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.944 2.335 -4.533 1.00 0.00 H new ATOM 0 HG12 VAL A 69 5.629 3.081 -3.070 1.00 0.00 H new ATOM 0 HG13 VAL A 69 3.866 2.920 -3.244 1.00 0.00 H new ATOM 0 HG21 VAL A 69 3.794 3.733 -6.225 1.00 0.00 H new ATOM 0 HG22 VAL A 69 2.670 4.376 -5.004 1.00 0.00 H new ATOM 0 HG23 VAL A 69 3.649 5.491 -5.987 1.00 0.00 H new ATOM 1062 N ASP A 70 6.869 6.136 -3.037 1.00 0.00 N ATOM 1063 CA ASP A 70 8.099 6.255 -2.258 1.00 0.00 C ATOM 1064 C ASP A 70 7.782 6.943 -0.939 1.00 0.00 C ATOM 1065 O ASP A 70 8.105 6.442 0.138 1.00 0.00 O ATOM 1066 CB ASP A 70 9.160 7.044 -3.029 1.00 0.00 C ATOM 1067 CG ASP A 70 10.569 6.712 -2.577 1.00 0.00 C ATOM 1068 OD1 ASP A 70 10.895 5.510 -2.483 1.00 0.00 O ATOM 1069 OD2 ASP A 70 11.347 7.655 -2.314 1.00 0.00 O ATOM 0 H ASP A 70 6.942 6.462 -4.001 1.00 0.00 H new ATOM 0 HA ASP A 70 8.500 5.260 -2.067 1.00 0.00 H new ATOM 0 HB2 ASP A 70 9.064 6.833 -4.094 1.00 0.00 H new ATOM 0 HB3 ASP A 70 8.981 8.111 -2.898 1.00 0.00 H new ATOM 1074 N GLU A 71 7.119 8.088 -1.049 1.00 0.00 N ATOM 1075 CA GLU A 71 6.710 8.864 0.111 1.00 0.00 C ATOM 1076 C GLU A 71 6.034 7.951 1.125 1.00 0.00 C ATOM 1077 O GLU A 71 6.414 7.918 2.296 1.00 0.00 O ATOM 1078 CB GLU A 71 5.764 9.983 -0.333 1.00 0.00 C ATOM 1079 CG GLU A 71 6.450 11.320 -0.573 1.00 0.00 C ATOM 1080 CD GLU A 71 7.669 11.227 -1.478 1.00 0.00 C ATOM 1081 OE1 GLU A 71 8.048 10.102 -1.862 1.00 0.00 O ATOM 1082 OE2 GLU A 71 8.245 12.286 -1.804 1.00 0.00 O ATOM 0 H GLU A 71 6.852 8.502 -1.942 1.00 0.00 H new ATOM 0 HA GLU A 71 7.583 9.314 0.583 1.00 0.00 H new ATOM 0 HB2 GLU A 71 5.261 9.676 -1.250 1.00 0.00 H new ATOM 0 HB3 GLU A 71 4.993 10.114 0.426 1.00 0.00 H new ATOM 0 HG2 GLU A 71 5.733 12.012 -1.014 1.00 0.00 H new ATOM 0 HG3 GLU A 71 6.752 11.741 0.386 1.00 0.00 H new ATOM 1089 N ALA A 72 5.042 7.199 0.657 1.00 0.00 N ATOM 1090 CA ALA A 72 4.310 6.261 1.503 1.00 0.00 C ATOM 1091 C ALA A 72 5.251 5.449 2.369 1.00 0.00 C ATOM 1092 O ALA A 72 5.094 5.370 3.582 1.00 0.00 O ATOM 1093 CB ALA A 72 3.503 5.306 0.643 1.00 0.00 C ATOM 0 H ALA A 72 4.724 7.222 -0.312 1.00 0.00 H new ATOM 0 HA ALA A 72 3.650 6.845 2.145 1.00 0.00 H new ATOM 0 HB1 ALA A 72 2.960 4.610 1.283 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.794 5.871 0.038 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.174 4.749 -0.011 1.00 0.00 H new ATOM 1099 N VAL A 73 6.225 4.833 1.726 1.00 0.00 N ATOM 1100 CA VAL A 73 7.179 4.002 2.432 1.00 0.00 C ATOM 1101 C VAL A 73 7.781 4.748 3.612 1.00 0.00 C ATOM 1102 O VAL A 73 7.940 4.184 4.689 1.00 0.00 O ATOM 1103 CB VAL A 73 8.302 3.519 1.494 1.00 0.00 C ATOM 1104 CG1 VAL A 73 9.197 2.512 2.203 1.00 0.00 C ATOM 1105 CG2 VAL A 73 7.712 2.921 0.221 1.00 0.00 C ATOM 0 H VAL A 73 6.375 4.893 0.719 1.00 0.00 H new ATOM 0 HA VAL A 73 6.638 3.131 2.803 1.00 0.00 H new ATOM 0 HB VAL A 73 8.914 4.377 1.216 1.00 0.00 H new ATOM 0 HG11 VAL A 73 9.984 2.183 1.524 1.00 0.00 H new ATOM 0 HG12 VAL A 73 9.646 2.978 3.080 1.00 0.00 H new ATOM 0 HG13 VAL A 73 8.603 1.653 2.514 1.00 0.00 H new ATOM 0 HG21 VAL A 73 8.518 2.585 -0.431 1.00 0.00 H new ATOM 0 HG22 VAL A 73 7.076 2.074 0.478 1.00 0.00 H new ATOM 0 HG23 VAL A 73 7.119 3.676 -0.295 1.00 0.00 H new ATOM 1115 N ALA A 74 8.103 6.015 3.413 1.00 0.00 N ATOM 1116 CA ALA A 74 8.670 6.820 4.479 1.00 0.00 C ATOM 1117 C ALA A 74 7.612 7.169 5.521 1.00 0.00 C ATOM 1118 O ALA A 74 7.753 6.838 6.698 1.00 0.00 O ATOM 1119 CB ALA A 74 9.298 8.081 3.913 1.00 0.00 C ATOM 0 H ALA A 74 7.982 6.506 2.527 1.00 0.00 H new ATOM 0 HA ALA A 74 9.447 6.235 4.971 1.00 0.00 H new ATOM 0 HB1 ALA A 74 9.719 8.674 4.725 1.00 0.00 H new ATOM 0 HB2 ALA A 74 10.089 7.811 3.213 1.00 0.00 H new ATOM 0 HB3 ALA A 74 8.538 8.665 3.394 1.00 0.00 H new ATOM 1125 N VAL A 75 6.554 7.846 5.082 1.00 0.00 N ATOM 1126 CA VAL A 75 5.476 8.245 5.978 1.00 0.00 C ATOM 1127 C VAL A 75 4.704 7.047 6.508 1.00 0.00 C ATOM 1128 O VAL A 75 4.639 6.817 7.713 1.00 0.00 O ATOM 1129 CB VAL A 75 4.497 9.214 5.279 1.00 0.00 C ATOM 1130 CG1 VAL A 75 3.935 8.650 3.979 1.00 0.00 C ATOM 1131 CG2 VAL A 75 3.378 9.635 6.222 1.00 0.00 C ATOM 0 H VAL A 75 6.422 8.129 4.111 1.00 0.00 H new ATOM 0 HA VAL A 75 5.946 8.754 6.820 1.00 0.00 H new ATOM 0 HB VAL A 75 5.074 10.099 5.010 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.254 9.374 3.533 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.752 8.447 3.287 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.397 7.725 4.186 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.703 10.317 5.704 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.825 8.754 6.546 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.804 10.136 7.091 1.00 0.00 H new ATOM 1141 N LEU A 76 4.105 6.312 5.599 1.00 0.00 N ATOM 1142 CA LEU A 76 3.299 5.145 5.950 1.00 0.00 C ATOM 1143 C LEU A 76 4.049 4.181 6.862 1.00 0.00 C ATOM 1144 O LEU A 76 3.627 3.924 7.989 1.00 0.00 O ATOM 1145 CB LEU A 76 2.861 4.410 4.693 1.00 0.00 C ATOM 1146 CG LEU A 76 1.726 3.413 4.899 1.00 0.00 C ATOM 1147 CD1 LEU A 76 1.117 3.032 3.565 1.00 0.00 C ATOM 1148 CD2 LEU A 76 2.225 2.178 5.636 1.00 0.00 C ATOM 0 H LEU A 76 4.157 6.498 4.597 1.00 0.00 H new ATOM 0 HA LEU A 76 2.426 5.511 6.491 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.551 5.144 3.949 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.720 3.881 4.280 1.00 0.00 H new ATOM 0 HG LEU A 76 0.955 3.883 5.510 1.00 0.00 H new ATOM 0 HD11 LEU A 76 0.308 2.320 3.725 1.00 0.00 H new ATOM 0 HD12 LEU A 76 0.724 3.924 3.076 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.880 2.578 2.933 1.00 0.00 H new ATOM 0 HD21 LEU A 76 1.401 1.478 5.773 1.00 0.00 H new ATOM 0 HD22 LEU A 76 3.013 1.700 5.054 1.00 0.00 H new ATOM 0 HD23 LEU A 76 2.619 2.470 6.609 1.00 0.00 H new ATOM 1160 N GLN A 77 5.154 3.637 6.360 1.00 0.00 N ATOM 1161 CA GLN A 77 5.939 2.688 7.140 1.00 0.00 C ATOM 1162 C GLN A 77 6.225 3.262 8.527 1.00 0.00 C ATOM 1163 O GLN A 77 6.378 2.525 9.497 1.00 0.00 O ATOM 1164 CB GLN A 77 7.249 2.348 6.431 1.00 0.00 C ATOM 1165 CG GLN A 77 7.897 1.066 6.925 1.00 0.00 C ATOM 1166 CD GLN A 77 9.371 0.990 6.580 1.00 0.00 C ATOM 1167 OE1 GLN A 77 10.026 2.013 6.377 1.00 0.00 O ATOM 1168 NE2 GLN A 77 9.905 -0.225 6.514 1.00 0.00 N ATOM 0 H GLN A 77 5.522 3.834 5.429 1.00 0.00 H new ATOM 0 HA GLN A 77 5.361 1.770 7.244 1.00 0.00 H new ATOM 0 HB2 GLN A 77 7.060 2.260 5.361 1.00 0.00 H new ATOM 0 HB3 GLN A 77 7.949 3.173 6.565 1.00 0.00 H new ATOM 0 HG2 GLN A 77 7.776 0.995 8.006 1.00 0.00 H new ATOM 0 HG3 GLN A 77 7.381 0.211 6.489 1.00 0.00 H new ATOM 0 HE21 GLN A 77 9.326 -1.047 6.689 1.00 0.00 H new ATOM 0 HE22 GLN A 77 10.893 -0.336 6.288 1.00 0.00 H new ATOM 1177 N ALA A 78 6.282 4.591 8.604 1.00 0.00 N ATOM 1178 CA ALA A 78 6.530 5.285 9.863 1.00 0.00 C ATOM 1179 C ALA A 78 5.252 5.415 10.694 1.00 0.00 C ATOM 1180 O ALA A 78 5.160 4.887 11.801 1.00 0.00 O ATOM 1181 CB ALA A 78 7.122 6.660 9.594 1.00 0.00 C ATOM 0 H ALA A 78 6.159 5.210 7.803 1.00 0.00 H new ATOM 0 HA ALA A 78 7.242 4.692 10.437 1.00 0.00 H new ATOM 0 HB1 ALA A 78 7.303 7.170 10.540 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.063 6.552 9.054 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.425 7.245 8.994 1.00 0.00 H new ATOM 1187 N HIS A 79 4.276 6.142 10.149 1.00 0.00 N ATOM 1188 CA HIS A 79 3.002 6.375 10.830 1.00 0.00 C ATOM 1189 C HIS A 79 2.283 5.068 11.149 1.00 0.00 C ATOM 1190 O HIS A 79 1.742 4.902 12.243 1.00 0.00 O ATOM 1191 CB HIS A 79 2.099 7.262 9.965 1.00 0.00 C ATOM 1192 CG HIS A 79 1.643 8.514 10.649 1.00 0.00 C ATOM 1193 ND1 HIS A 79 0.603 8.542 11.553 1.00 0.00 N ATOM 1194 CD2 HIS A 79 2.083 9.790 10.547 1.00 0.00 C ATOM 1195 CE1 HIS A 79 0.419 9.780 11.976 1.00 0.00 C ATOM 1196 NE2 HIS A 79 1.305 10.559 11.380 1.00 0.00 N ATOM 0 H HIS A 79 4.345 6.582 9.232 1.00 0.00 H new ATOM 0 HA HIS A 79 3.220 6.877 11.772 1.00 0.00 H new ATOM 0 HB2 HIS A 79 2.635 7.531 9.055 1.00 0.00 H new ATOM 0 HB3 HIS A 79 1.225 6.687 9.661 1.00 0.00 H new ATOM 0 HD1 HIS A 79 0.059 7.732 11.850 1.00 0.00 H new ATOM 0 HD2 HIS A 79 2.895 10.139 9.926 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -0.328 10.101 12.687 1.00 0.00 H new ATOM 1204 N GLN A 80 2.272 4.143 10.194 1.00 0.00 N ATOM 1205 CA GLN A 80 1.607 2.856 10.386 1.00 0.00 C ATOM 1206 C GLN A 80 2.499 1.867 11.138 1.00 0.00 C ATOM 1207 O GLN A 80 2.398 0.655 10.942 1.00 0.00 O ATOM 1208 CB GLN A 80 1.195 2.264 9.037 1.00 0.00 C ATOM 1209 CG GLN A 80 -0.053 1.399 9.106 1.00 0.00 C ATOM 1210 CD GLN A 80 -0.310 0.642 7.817 1.00 0.00 C ATOM 1211 OE1 GLN A 80 0.624 0.213 7.139 1.00 0.00 O ATOM 1212 NE2 GLN A 80 -1.581 0.473 7.473 1.00 0.00 N ATOM 0 H GLN A 80 2.714 4.259 9.282 1.00 0.00 H new ATOM 0 HA GLN A 80 0.717 3.033 10.990 1.00 0.00 H new ATOM 0 HB2 GLN A 80 1.025 3.076 8.330 1.00 0.00 H new ATOM 0 HB3 GLN A 80 2.019 1.668 8.645 1.00 0.00 H new ATOM 0 HG2 GLN A 80 0.047 0.688 9.927 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -0.914 2.028 9.332 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -2.323 0.846 8.065 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -1.815 -0.029 6.617 1.00 0.00 H new ATOM 1221 N ALA A 81 3.370 2.387 12.000 1.00 0.00 N ATOM 1222 CA ALA A 81 4.270 1.546 12.780 1.00 0.00 C ATOM 1223 C ALA A 81 4.021 1.713 14.275 1.00 0.00 C ATOM 1224 O ALA A 81 4.238 0.788 15.056 1.00 0.00 O ATOM 1225 CB ALA A 81 5.717 1.874 12.449 1.00 0.00 C ATOM 0 H ALA A 81 3.470 3.387 12.175 1.00 0.00 H new ATOM 0 HA ALA A 81 4.073 0.507 12.518 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.378 1.239 13.038 1.00 0.00 H new ATOM 0 HB2 ALA A 81 5.896 1.699 11.388 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.916 2.920 12.683 1.00 0.00 H new ATOM 1231 N LYS A 82 3.561 2.899 14.667 1.00 0.00 N ATOM 1232 CA LYS A 82 3.280 3.183 16.067 1.00 0.00 C ATOM 1233 C LYS A 82 2.121 2.325 16.567 1.00 0.00 C ATOM 1234 O LYS A 82 0.993 2.800 16.691 1.00 0.00 O ATOM 1235 CB LYS A 82 2.957 4.669 16.253 1.00 0.00 C ATOM 1236 CG LYS A 82 4.080 5.459 16.906 1.00 0.00 C ATOM 1237 CD LYS A 82 4.288 6.801 16.224 1.00 0.00 C ATOM 1238 CE LYS A 82 3.597 7.926 16.979 1.00 0.00 C ATOM 1239 NZ LYS A 82 2.146 8.001 16.656 1.00 0.00 N ATOM 0 H LYS A 82 3.376 3.677 14.033 1.00 0.00 H new ATOM 0 HA LYS A 82 4.167 2.940 16.652 1.00 0.00 H new ATOM 0 HB2 LYS A 82 2.733 5.108 15.281 1.00 0.00 H new ATOM 0 HB3 LYS A 82 2.057 4.763 16.860 1.00 0.00 H new ATOM 0 HG2 LYS A 82 3.850 5.617 17.960 1.00 0.00 H new ATOM 0 HG3 LYS A 82 5.004 4.882 16.865 1.00 0.00 H new ATOM 0 HD2 LYS A 82 5.355 7.012 16.152 1.00 0.00 H new ATOM 0 HD3 LYS A 82 3.903 6.756 15.205 1.00 0.00 H new ATOM 0 HE2 LYS A 82 3.723 7.775 18.051 1.00 0.00 H new ATOM 0 HE3 LYS A 82 4.073 8.875 16.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 1.711 8.780 17.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 2.025 8.171 15.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 1.686 7.105 16.915 1.00 0.00 H new ATOM 1253 N GLU A 83 2.410 1.059 16.845 1.00 0.00 N ATOM 1254 CA GLU A 83 1.393 0.133 17.326 1.00 0.00 C ATOM 1255 C GLU A 83 1.352 0.116 18.851 1.00 0.00 C ATOM 1256 O GLU A 83 1.778 -0.849 19.486 1.00 0.00 O ATOM 1257 CB GLU A 83 1.664 -1.273 16.783 1.00 0.00 C ATOM 1258 CG GLU A 83 0.521 -1.833 15.948 1.00 0.00 C ATOM 1259 CD GLU A 83 0.175 -3.266 16.307 1.00 0.00 C ATOM 1260 OE1 GLU A 83 0.931 -3.884 17.086 1.00 0.00 O ATOM 1261 OE2 GLU A 83 -0.853 -3.770 15.808 1.00 0.00 O ATOM 0 H GLU A 83 3.340 0.651 16.746 1.00 0.00 H new ATOM 0 HA GLU A 83 0.421 0.470 16.965 1.00 0.00 H new ATOM 0 HB2 GLU A 83 2.569 -1.251 16.177 1.00 0.00 H new ATOM 0 HB3 GLU A 83 1.856 -1.946 17.619 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.361 -1.207 16.082 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.790 -1.783 14.893 1.00 0.00 H new ATOM 1268 N ALA A 84 0.835 1.193 19.432 1.00 0.00 N ATOM 1269 CA ALA A 84 0.733 1.305 20.881 1.00 0.00 C ATOM 1270 C ALA A 84 -0.143 0.198 21.456 1.00 0.00 C ATOM 1271 O ALA A 84 -1.266 -0.019 20.999 1.00 0.00 O ATOM 1272 CB ALA A 84 0.183 2.670 21.266 1.00 0.00 C ATOM 0 H ALA A 84 0.480 2.001 18.921 1.00 0.00 H new ATOM 0 HA ALA A 84 1.733 1.196 21.301 1.00 0.00 H new ATOM 0 HB1 ALA A 84 0.112 2.741 22.351 1.00 0.00 H new ATOM 0 HB2 ALA A 84 0.849 3.449 20.895 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.807 2.800 20.828 1.00 0.00 H new ATOM 1278 N ALA A 85 0.377 -0.499 22.460 1.00 0.00 N ATOM 1279 CA ALA A 85 -0.359 -1.584 23.097 1.00 0.00 C ATOM 1280 C ALA A 85 -1.402 -1.043 24.067 1.00 0.00 C ATOM 1281 O ALA A 85 -1.063 -0.441 25.086 1.00 0.00 O ATOM 1282 CB ALA A 85 0.600 -2.521 23.815 1.00 0.00 C ATOM 0 H ALA A 85 1.305 -0.332 22.850 1.00 0.00 H new ATOM 0 HA ALA A 85 -0.881 -2.143 22.320 1.00 0.00 H new ATOM 0 HB1 ALA A 85 0.037 -3.327 24.286 1.00 0.00 H new ATOM 0 HB2 ALA A 85 1.304 -2.942 23.097 1.00 0.00 H new ATOM 0 HB3 ALA A 85 1.148 -1.967 24.577 1.00 0.00 H new ATOM 1288 N GLN A 86 -2.673 -1.260 23.746 1.00 0.00 N ATOM 1289 CA GLN A 86 -3.766 -0.793 24.590 1.00 0.00 C ATOM 1290 C GLN A 86 -4.207 -1.882 25.562 1.00 0.00 C ATOM 1291 O GLN A 86 -4.430 -1.620 26.744 1.00 0.00 O ATOM 1292 CB GLN A 86 -4.950 -0.344 23.732 1.00 0.00 C ATOM 1293 CG GLN A 86 -5.495 -1.436 22.825 1.00 0.00 C ATOM 1294 CD GLN A 86 -6.678 -0.971 21.998 1.00 0.00 C ATOM 1295 OE1 GLN A 86 -6.719 -1.172 20.785 1.00 0.00 O ATOM 1296 NE2 GLN A 86 -7.648 -0.343 22.653 1.00 0.00 N ATOM 0 H GLN A 86 -2.971 -1.757 22.907 1.00 0.00 H new ATOM 0 HA GLN A 86 -3.406 0.058 25.167 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -5.749 0.006 24.385 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -4.643 0.505 23.121 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -4.703 -1.779 22.159 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -5.794 -2.291 23.431 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -7.573 -0.198 23.660 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -8.468 -0.006 22.149 1.00 0.00 H new ATOM 1305 N LYS A 87 -4.331 -3.104 25.057 1.00 0.00 N ATOM 1306 CA LYS A 87 -4.745 -4.233 25.883 1.00 0.00 C ATOM 1307 C LYS A 87 -3.566 -4.787 26.678 1.00 0.00 C ATOM 1308 O LYS A 87 -2.993 -5.816 26.321 1.00 0.00 O ATOM 1309 CB LYS A 87 -5.352 -5.337 25.014 1.00 0.00 C ATOM 1310 CG LYS A 87 -6.332 -6.228 25.761 1.00 0.00 C ATOM 1311 CD LYS A 87 -6.853 -7.347 24.874 1.00 0.00 C ATOM 1312 CE LYS A 87 -7.882 -6.838 23.879 1.00 0.00 C ATOM 1313 NZ LYS A 87 -8.454 -7.939 23.056 1.00 0.00 N ATOM 0 H LYS A 87 -4.151 -3.339 24.081 1.00 0.00 H new ATOM 0 HA LYS A 87 -5.500 -3.878 26.584 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -5.862 -4.881 24.165 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -4.549 -5.953 24.610 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.843 -6.654 26.637 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.168 -5.629 26.122 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -6.022 -7.804 24.337 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -7.299 -8.126 25.493 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -8.685 -6.331 24.415 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -7.419 -6.099 23.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -9.151 -7.549 22.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -7.692 -8.407 22.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -8.918 -8.632 23.677 1.00 0.00 H new ATOM 1327 N ALA A 88 -3.210 -4.098 27.757 1.00 0.00 N ATOM 1328 CA ALA A 88 -2.100 -4.520 28.601 1.00 0.00 C ATOM 1329 C ALA A 88 -2.559 -5.538 29.641 1.00 0.00 C ATOM 1330 O ALA A 88 -3.511 -5.298 30.381 1.00 0.00 O ATOM 1331 CB ALA A 88 -1.467 -3.315 29.281 1.00 0.00 C ATOM 0 H ALA A 88 -3.675 -3.245 28.067 1.00 0.00 H new ATOM 0 HA ALA A 88 -1.353 -4.999 27.967 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -0.639 -3.645 29.909 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -1.096 -2.624 28.524 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -2.212 -2.812 29.898 1.00 0.00 H new ATOM 1337 N VAL A 89 -1.872 -6.676 29.690 1.00 0.00 N ATOM 1338 CA VAL A 89 -2.207 -7.729 30.640 1.00 0.00 C ATOM 1339 C VAL A 89 -1.212 -7.762 31.797 1.00 0.00 C ATOM 1340 O VAL A 89 -0.452 -8.719 31.950 1.00 0.00 O ATOM 1341 CB VAL A 89 -2.235 -9.111 29.958 1.00 0.00 C ATOM 1342 CG1 VAL A 89 -3.410 -9.209 28.997 1.00 0.00 C ATOM 1343 CG2 VAL A 89 -0.923 -9.376 29.235 1.00 0.00 C ATOM 0 H VAL A 89 -1.081 -6.891 29.083 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.201 -7.504 31.027 1.00 0.00 H new ATOM 0 HB VAL A 89 -2.360 -9.873 30.727 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -3.413 -10.192 28.525 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -4.341 -9.067 29.545 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -3.319 -8.439 28.231 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -0.961 -10.356 28.760 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -0.765 -8.610 28.476 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -0.102 -9.352 29.951 1.00 0.00 H new ATOM 1353 N ASN A 90 -1.223 -6.710 32.607 1.00 0.00 N ATOM 1354 CA ASN A 90 -0.320 -6.615 33.750 1.00 0.00 C ATOM 1355 C ASN A 90 -1.019 -7.046 35.036 1.00 0.00 C ATOM 1356 O ASN A 90 -0.454 -7.784 35.842 1.00 0.00 O ATOM 1357 CB ASN A 90 0.204 -5.186 33.894 1.00 0.00 C ATOM 1358 CG ASN A 90 1.352 -5.086 34.877 1.00 0.00 C ATOM 1359 OD1 ASN A 90 1.236 -5.508 36.029 1.00 0.00 O ATOM 1360 ND2 ASN A 90 2.471 -4.530 34.428 1.00 0.00 N ATOM 0 H ASN A 90 -1.847 -5.911 32.494 1.00 0.00 H new ATOM 0 HA ASN A 90 0.520 -7.287 33.574 1.00 0.00 H new ATOM 0 HB2 ASN A 90 0.531 -4.822 32.920 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -0.608 -4.536 34.221 1.00 0.00 H new ATOM 0 HD21 ASN A 90 3.278 -4.439 35.045 1.00 0.00 H new ATOM 0 HD22 ASN A 90 2.523 -4.194 33.466 1.00 0.00 H new ATOM 1367 N SER A 91 -2.249 -6.580 35.220 1.00 0.00 N ATOM 1368 CA SER A 91 -3.023 -6.916 36.410 1.00 0.00 C ATOM 1369 C SER A 91 -3.904 -8.136 36.159 1.00 0.00 C ATOM 1370 O SER A 91 -3.776 -8.807 35.135 1.00 0.00 O ATOM 1371 CB SER A 91 -3.886 -5.724 36.834 1.00 0.00 C ATOM 1372 OG SER A 91 -3.503 -5.247 38.112 1.00 0.00 O ATOM 0 H SER A 91 -2.732 -5.969 34.561 1.00 0.00 H new ATOM 0 HA SER A 91 -2.326 -7.155 37.213 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.792 -4.923 36.100 1.00 0.00 H new ATOM 0 HB3 SER A 91 -4.935 -6.019 36.852 1.00 0.00 H new ATOM 0 HG SER A 91 -4.067 -4.485 38.359 1.00 0.00 H new ATOM 1378 N ALA A 92 -4.801 -8.417 37.101 1.00 0.00 N ATOM 1379 CA ALA A 92 -5.706 -9.554 36.981 1.00 0.00 C ATOM 1380 C ALA A 92 -7.031 -9.143 36.344 1.00 0.00 C ATOM 1381 O ALA A 92 -8.060 -9.780 36.564 1.00 0.00 O ATOM 1382 CB ALA A 92 -5.945 -10.185 38.344 1.00 0.00 C ATOM 0 H ALA A 92 -4.920 -7.872 37.955 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.236 -10.291 36.329 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -6.622 -11.032 38.239 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -4.997 -10.528 38.758 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.388 -9.448 39.014 1.00 0.00 H new ATOM 1388 N THR A 93 -6.998 -8.073 35.555 1.00 0.00 N ATOM 1389 CA THR A 93 -8.194 -7.574 34.887 1.00 0.00 C ATOM 1390 C THR A 93 -8.312 -8.165 33.486 1.00 0.00 C ATOM 1391 O THR A 93 -8.480 -7.440 32.505 1.00 0.00 O ATOM 1392 CB THR A 93 -8.152 -6.047 34.804 1.00 0.00 C ATOM 1393 OG1 THR A 93 -9.235 -5.557 34.034 1.00 0.00 O ATOM 1394 CG2 THR A 93 -6.875 -5.519 34.191 1.00 0.00 C ATOM 0 H THR A 93 -6.153 -7.534 35.363 1.00 0.00 H new ATOM 0 HA THR A 93 -9.065 -7.877 35.469 1.00 0.00 H new ATOM 0 HB THR A 93 -8.213 -5.698 35.835 1.00 0.00 H new ATOM 0 HG1 THR A 93 -9.176 -5.913 33.123 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.909 -4.430 34.161 1.00 0.00 H new ATOM 0 HG22 THR A 93 -6.024 -5.839 34.791 1.00 0.00 H new ATOM 0 HG23 THR A 93 -6.771 -5.906 33.178 1.00 0.00 H new ATOM 1402 N GLY A 94 -8.218 -9.487 33.398 1.00 0.00 N ATOM 1403 CA GLY A 94 -8.309 -10.151 32.112 1.00 0.00 C ATOM 1404 C GLY A 94 -9.645 -10.835 31.896 1.00 0.00 C ATOM 1405 O GLY A 94 -10.699 -10.210 32.014 1.00 0.00 O ATOM 0 H GLY A 94 -8.081 -10.110 34.194 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -8.148 -9.421 31.319 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -7.511 -10.889 32.032 1.00 0.00 H new ATOM 1409 N VAL A 95 -9.598 -12.122 31.573 1.00 0.00 N ATOM 1410 CA VAL A 95 -10.806 -12.901 31.329 1.00 0.00 C ATOM 1411 C VAL A 95 -11.260 -13.630 32.590 1.00 0.00 C ATOM 1412 O VAL A 95 -10.492 -13.776 33.542 1.00 0.00 O ATOM 1413 CB VAL A 95 -10.588 -13.932 30.204 1.00 0.00 C ATOM 1414 CG1 VAL A 95 -10.610 -13.248 28.845 1.00 0.00 C ATOM 1415 CG2 VAL A 95 -9.283 -14.683 30.411 1.00 0.00 C ATOM 0 H VAL A 95 -8.731 -12.651 31.474 1.00 0.00 H new ATOM 0 HA VAL A 95 -11.580 -12.196 31.025 1.00 0.00 H new ATOM 0 HB VAL A 95 -11.403 -14.656 30.235 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -10.455 -13.990 28.062 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -11.574 -12.762 28.698 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -9.817 -12.502 28.800 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -9.148 -15.406 29.607 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -8.453 -13.977 30.408 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -9.312 -15.205 31.367 1.00 0.00 H new ATOM 1425 N PRO A 96 -12.522 -14.099 32.619 1.00 0.00 N ATOM 1426 CA PRO A 96 -13.074 -14.817 33.775 1.00 0.00 C ATOM 1427 C PRO A 96 -12.296 -16.092 34.086 1.00 0.00 C ATOM 1428 O PRO A 96 -12.663 -17.178 33.639 1.00 0.00 O ATOM 1429 CB PRO A 96 -14.507 -15.154 33.347 1.00 0.00 C ATOM 1430 CG PRO A 96 -14.500 -15.051 31.861 1.00 0.00 C ATOM 1431 CD PRO A 96 -13.511 -13.972 31.534 1.00 0.00 C ATOM 0 HA PRO A 96 -13.022 -14.219 34.685 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -14.791 -16.155 33.672 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -15.224 -14.461 33.787 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -14.212 -15.998 31.404 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -15.491 -14.802 31.481 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -13.058 -14.121 30.554 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -13.976 -12.986 31.523 1.00 0.00 H new ATOM 1439 N THR A 97 -11.224 -15.951 34.860 1.00 0.00 N ATOM 1440 CA THR A 97 -10.396 -17.093 35.233 1.00 0.00 C ATOM 1441 C THR A 97 -10.840 -17.666 36.575 1.00 0.00 C ATOM 1442 O THR A 97 -11.527 -16.999 37.349 1.00 0.00 O ATOM 1443 CB THR A 97 -8.925 -16.682 35.302 1.00 0.00 C ATOM 1444 OG1 THR A 97 -8.669 -15.588 34.439 1.00 0.00 O ATOM 1445 CG2 THR A 97 -7.974 -17.796 34.927 1.00 0.00 C ATOM 0 H THR A 97 -10.909 -15.059 35.241 1.00 0.00 H new ATOM 0 HA THR A 97 -10.514 -17.863 34.470 1.00 0.00 H new ATOM 0 HB THR A 97 -8.749 -16.413 36.343 1.00 0.00 H new ATOM 0 HG1 THR A 97 -7.723 -15.339 34.499 1.00 0.00 H new ATOM 0 HG21 THR A 97 -6.947 -17.437 34.997 1.00 0.00 H new ATOM 0 HG22 THR A 97 -8.112 -18.636 35.607 1.00 0.00 H new ATOM 0 HG23 THR A 97 -8.176 -18.119 33.906 1.00 0.00 H new ATOM 1453 N VAL A 98 -10.446 -18.906 36.844 1.00 0.00 N ATOM 1454 CA VAL A 98 -10.806 -19.567 38.094 1.00 0.00 C ATOM 1455 C VAL A 98 -9.570 -19.834 38.950 1.00 0.00 C ATOM 1456 O VAL A 98 -8.455 -19.494 38.502 1.00 0.00 O ATOM 1457 CB VAL A 98 -11.541 -20.896 37.835 1.00 0.00 C ATOM 1458 CG1 VAL A 98 -10.638 -21.881 37.106 1.00 0.00 C ATOM 1459 CG2 VAL A 98 -12.051 -21.491 39.140 1.00 0.00 C ATOM 1460 OXT VAL A 98 -9.729 -20.382 40.060 1.00 0.00 O ATOM 0 H VAL A 98 -9.878 -19.473 36.215 1.00 0.00 H new ATOM 0 HA VAL A 98 -11.474 -18.893 38.630 1.00 0.00 H new ATOM 0 HB VAL A 98 -12.400 -20.691 37.196 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -11.179 -22.812 36.934 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -10.334 -21.456 36.149 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -9.754 -22.081 37.712 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -12.567 -22.429 38.935 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -11.210 -21.678 39.808 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -12.742 -20.793 39.613 1.00 0.00 H new TER 1470 VAL A 98 ATOM 1471 N VAL B 1 4.419 15.375 13.803 1.00 0.00 N ATOM 1472 CA VAL B 1 5.035 15.159 12.468 1.00 0.00 C ATOM 1473 C VAL B 1 4.607 16.251 11.489 1.00 0.00 C ATOM 1474 O VAL B 1 3.533 16.184 10.893 1.00 0.00 O ATOM 1475 CB VAL B 1 4.660 13.773 11.898 1.00 0.00 C ATOM 1476 CG1 VAL B 1 3.152 13.636 11.738 1.00 0.00 C ATOM 1477 CG2 VAL B 1 5.369 13.523 10.574 1.00 0.00 C ATOM 0 H1 VAL B 1 4.583 14.539 14.400 1.00 0.00 H new ATOM 0 H2 VAL B 1 4.846 16.210 14.251 1.00 0.00 H new ATOM 0 H3 VAL B 1 3.396 15.527 13.693 1.00 0.00 H new ATOM 0 HA VAL B 1 6.117 15.202 12.597 1.00 0.00 H new ATOM 0 HB VAL B 1 4.991 13.017 12.610 1.00 0.00 H new ATOM 0 HG11 VAL B 1 2.917 12.651 11.335 1.00 0.00 H new ATOM 0 HG12 VAL B 1 2.671 13.755 12.709 1.00 0.00 H new ATOM 0 HG13 VAL B 1 2.787 14.404 11.055 1.00 0.00 H new ATOM 0 HG21 VAL B 1 5.090 12.541 10.192 1.00 0.00 H new ATOM 0 HG22 VAL B 1 5.078 14.289 9.855 1.00 0.00 H new ATOM 0 HG23 VAL B 1 6.448 13.560 10.726 1.00 0.00 H new ATOM 1489 N LEU B 2 5.459 17.261 11.337 1.00 0.00 N ATOM 1490 CA LEU B 2 5.172 18.375 10.439 1.00 0.00 C ATOM 1491 C LEU B 2 5.679 18.091 9.030 1.00 0.00 C ATOM 1492 O LEU B 2 4.909 18.095 8.071 1.00 0.00 O ATOM 1493 CB LEU B 2 5.811 19.662 10.965 1.00 0.00 C ATOM 1494 CG LEU B 2 5.759 19.844 12.481 1.00 0.00 C ATOM 1495 CD1 LEU B 2 6.952 20.658 12.959 1.00 0.00 C ATOM 1496 CD2 LEU B 2 4.456 20.511 12.892 1.00 0.00 C ATOM 0 H LEU B 2 6.353 17.331 11.824 1.00 0.00 H new ATOM 0 HA LEU B 2 4.090 18.499 10.399 1.00 0.00 H new ATOM 0 HB2 LEU B 2 6.854 19.686 10.648 1.00 0.00 H new ATOM 0 HB3 LEU B 2 5.315 20.512 10.496 1.00 0.00 H new ATOM 0 HG LEU B 2 5.804 18.861 12.950 1.00 0.00 H new ATOM 0 HD11 LEU B 2 6.900 20.779 14.041 1.00 0.00 H new ATOM 0 HD12 LEU B 2 7.875 20.141 12.695 1.00 0.00 H new ATOM 0 HD13 LEU B 2 6.937 21.639 12.483 1.00 0.00 H new ATOM 0 HD21 LEU B 2 4.435 20.633 13.975 1.00 0.00 H new ATOM 0 HD22 LEU B 2 4.381 21.488 12.415 1.00 0.00 H new ATOM 0 HD23 LEU B 2 3.616 19.890 12.581 1.00 0.00 H new ATOM 1508 N MET B 3 6.981 17.853 8.911 1.00 0.00 N ATOM 1509 CA MET B 3 7.585 17.573 7.616 1.00 0.00 C ATOM 1510 C MET B 3 7.316 16.133 7.193 1.00 0.00 C ATOM 1511 O MET B 3 8.242 15.340 7.024 1.00 0.00 O ATOM 1512 CB MET B 3 9.092 17.837 7.659 1.00 0.00 C ATOM 1513 CG MET B 3 9.646 18.405 6.362 1.00 0.00 C ATOM 1514 SD MET B 3 11.076 19.470 6.625 1.00 0.00 S ATOM 1515 CE MET B 3 11.836 19.429 5.004 1.00 0.00 C ATOM 0 H MET B 3 7.635 17.849 9.693 1.00 0.00 H new ATOM 0 HA MET B 3 7.133 18.239 6.881 1.00 0.00 H new ATOM 0 HB2 MET B 3 9.308 18.531 8.472 1.00 0.00 H new ATOM 0 HB3 MET B 3 9.610 16.906 7.889 1.00 0.00 H new ATOM 0 HG2 MET B 3 9.926 17.585 5.701 1.00 0.00 H new ATOM 0 HG3 MET B 3 8.865 18.971 5.855 1.00 0.00 H new ATOM 0 HE1 MET B 3 12.736 20.044 5.008 1.00 0.00 H new ATOM 0 HE2 MET B 3 12.099 18.402 4.752 1.00 0.00 H new ATOM 0 HE3 MET B 3 11.136 19.816 4.264 1.00 0.00 H new ATOM 1525 N SER B 4 6.041 15.807 7.026 1.00 0.00 N ATOM 1526 CA SER B 4 5.642 14.466 6.618 1.00 0.00 C ATOM 1527 C SER B 4 5.856 14.282 5.121 1.00 0.00 C ATOM 1528 O SER B 4 6.491 15.113 4.471 1.00 0.00 O ATOM 1529 CB SER B 4 4.172 14.214 6.972 1.00 0.00 C ATOM 1530 OG SER B 4 3.736 15.058 8.026 1.00 0.00 O ATOM 0 H SER B 4 5.265 16.453 7.167 1.00 0.00 H new ATOM 0 HA SER B 4 6.260 13.745 7.153 1.00 0.00 H new ATOM 0 HB2 SER B 4 3.552 14.381 6.091 1.00 0.00 H new ATOM 0 HB3 SER B 4 4.041 13.172 7.262 1.00 0.00 H new ATOM 0 HG SER B 4 2.795 14.873 8.225 1.00 0.00 H new ATOM 1536 N LYS B 5 5.324 13.196 4.575 1.00 0.00 N ATOM 1537 CA LYS B 5 5.461 12.919 3.151 1.00 0.00 C ATOM 1538 C LYS B 5 4.225 13.386 2.385 1.00 0.00 C ATOM 1539 O LYS B 5 3.252 13.846 2.981 1.00 0.00 O ATOM 1540 CB LYS B 5 5.708 11.429 2.915 1.00 0.00 C ATOM 1541 CG LYS B 5 7.098 10.966 3.336 1.00 0.00 C ATOM 1542 CD LYS B 5 8.183 11.900 2.818 1.00 0.00 C ATOM 1543 CE LYS B 5 9.506 11.177 2.626 1.00 0.00 C ATOM 1544 NZ LYS B 5 9.672 10.680 1.232 1.00 0.00 N ATOM 0 H LYS B 5 4.796 12.495 5.094 1.00 0.00 H new ATOM 0 HA LYS B 5 6.322 13.475 2.778 1.00 0.00 H new ATOM 0 HB2 LYS B 5 4.961 10.854 3.463 1.00 0.00 H new ATOM 0 HB3 LYS B 5 5.566 11.209 1.857 1.00 0.00 H new ATOM 0 HG2 LYS B 5 7.151 10.915 4.424 1.00 0.00 H new ATOM 0 HG3 LYS B 5 7.275 9.958 2.960 1.00 0.00 H new ATOM 0 HD2 LYS B 5 7.866 12.335 1.870 1.00 0.00 H new ATOM 0 HD3 LYS B 5 8.318 12.724 3.518 1.00 0.00 H new ATOM 0 HE2 LYS B 5 10.327 11.851 2.871 1.00 0.00 H new ATOM 0 HE3 LYS B 5 9.565 10.338 3.320 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 9.576 9.645 1.219 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 8.942 11.103 0.623 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 10.614 10.945 0.879 1.00 0.00 H new ATOM 1558 N LEU B 6 4.276 13.280 1.061 1.00 0.00 N ATOM 1559 CA LEU B 6 3.163 13.707 0.214 1.00 0.00 C ATOM 1560 C LEU B 6 1.938 12.814 0.397 1.00 0.00 C ATOM 1561 O LEU B 6 0.805 13.295 0.383 1.00 0.00 O ATOM 1562 CB LEU B 6 3.568 13.710 -1.262 1.00 0.00 C ATOM 1563 CG LEU B 6 4.961 14.261 -1.566 1.00 0.00 C ATOM 1564 CD1 LEU B 6 5.505 13.633 -2.841 1.00 0.00 C ATOM 1565 CD2 LEU B 6 4.925 15.778 -1.688 1.00 0.00 C ATOM 0 H LEU B 6 5.074 12.903 0.550 1.00 0.00 H new ATOM 0 HA LEU B 6 2.904 14.720 0.521 1.00 0.00 H new ATOM 0 HB2 LEU B 6 3.512 12.688 -1.637 1.00 0.00 H new ATOM 0 HB3 LEU B 6 2.836 14.295 -1.819 1.00 0.00 H new ATOM 0 HG LEU B 6 5.624 14.004 -0.740 1.00 0.00 H new ATOM 0 HD11 LEU B 6 6.498 14.032 -3.048 1.00 0.00 H new ATOM 0 HD12 LEU B 6 5.568 12.552 -2.716 1.00 0.00 H new ATOM 0 HD13 LEU B 6 4.840 13.864 -3.673 1.00 0.00 H new ATOM 0 HD21 LEU B 6 5.927 16.149 -1.904 1.00 0.00 H new ATOM 0 HD22 LEU B 6 4.250 16.062 -2.495 1.00 0.00 H new ATOM 0 HD23 LEU B 6 4.572 16.210 -0.751 1.00 0.00 H new ATOM 1577 N SER B 7 2.165 11.515 0.571 1.00 0.00 N ATOM 1578 CA SER B 7 1.071 10.574 0.755 1.00 0.00 C ATOM 1579 C SER B 7 1.043 10.047 2.184 1.00 0.00 C ATOM 1580 O SER B 7 1.561 8.969 2.471 1.00 0.00 O ATOM 1581 CB SER B 7 1.203 9.423 -0.233 1.00 0.00 C ATOM 1582 OG SER B 7 0.967 9.868 -1.559 1.00 0.00 O ATOM 0 H SER B 7 3.094 11.094 0.588 1.00 0.00 H new ATOM 0 HA SER B 7 0.132 11.095 0.569 1.00 0.00 H new ATOM 0 HB2 SER B 7 2.201 8.990 -0.162 1.00 0.00 H new ATOM 0 HB3 SER B 7 0.494 8.635 0.023 1.00 0.00 H new ATOM 0 HG SER B 7 0.052 9.636 -1.824 1.00 0.00 H new ATOM 1588 N VAL B 8 0.431 10.820 3.075 1.00 0.00 N ATOM 1589 CA VAL B 8 0.327 10.443 4.477 1.00 0.00 C ATOM 1590 C VAL B 8 -0.397 9.110 4.636 1.00 0.00 C ATOM 1591 O VAL B 8 -0.864 8.526 3.658 1.00 0.00 O ATOM 1592 CB VAL B 8 -0.416 11.520 5.289 1.00 0.00 C ATOM 1593 CG1 VAL B 8 0.365 12.827 5.282 1.00 0.00 C ATOM 1594 CG2 VAL B 8 -1.819 11.727 4.737 1.00 0.00 C ATOM 0 H VAL B 8 -0.002 11.715 2.848 1.00 0.00 H new ATOM 0 HA VAL B 8 1.344 10.346 4.858 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.501 11.180 6.321 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -0.175 13.577 5.861 1.00 0.00 H new ATOM 0 HG12 VAL B 8 1.348 12.666 5.725 1.00 0.00 H new ATOM 0 HG13 VAL B 8 0.482 13.176 4.256 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -2.331 12.491 5.322 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -1.757 12.047 3.697 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -2.375 10.791 4.797 1.00 0.00 H new ATOM 1604 N ASN B 9 -0.481 8.634 5.873 1.00 0.00 N ATOM 1605 CA ASN B 9 -1.142 7.368 6.164 1.00 0.00 C ATOM 1606 C ASN B 9 -2.663 7.528 6.223 1.00 0.00 C ATOM 1607 O ASN B 9 -3.284 7.210 7.239 1.00 0.00 O ATOM 1608 CB ASN B 9 -0.627 6.812 7.493 1.00 0.00 C ATOM 1609 CG ASN B 9 -0.874 7.768 8.645 1.00 0.00 C ATOM 1610 OD1 ASN B 9 -0.277 8.843 8.714 1.00 0.00 O ATOM 1611 ND2 ASN B 9 -1.758 7.380 9.558 1.00 0.00 N ATOM 0 H ASN B 9 -0.099 9.107 6.692 1.00 0.00 H new ATOM 0 HA ASN B 9 -0.910 6.673 5.357 1.00 0.00 H new ATOM 0 HB2 ASN B 9 -1.116 5.860 7.701 1.00 0.00 H new ATOM 0 HB3 ASN B 9 0.441 6.611 7.412 1.00 0.00 H new ATOM 0 HD21 ASN B 9 -1.965 7.981 10.355 1.00 0.00 H new ATOM 0 HD22 ASN B 9 -2.230 6.481 9.461 1.00 0.00 H new ATOM 1618 N ALA B 10 -3.260 8.035 5.144 1.00 0.00 N ATOM 1619 CA ALA B 10 -4.707 8.247 5.092 1.00 0.00 C ATOM 1620 C ALA B 10 -5.483 6.983 5.477 1.00 0.00 C ATOM 1621 O ALA B 10 -4.888 5.973 5.849 1.00 0.00 O ATOM 1622 CB ALA B 10 -5.105 8.718 3.700 1.00 0.00 C ATOM 0 H ALA B 10 -2.764 8.306 4.295 1.00 0.00 H new ATOM 0 HA ALA B 10 -4.964 9.015 5.822 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -6.183 8.875 3.663 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -4.594 9.653 3.472 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -4.823 7.963 2.966 1.00 0.00 H new ATOM 1628 N PRO B 11 -6.834 7.034 5.404 1.00 0.00 N ATOM 1629 CA PRO B 11 -7.695 5.894 5.753 1.00 0.00 C ATOM 1630 C PRO B 11 -7.280 4.601 5.057 1.00 0.00 C ATOM 1631 O PRO B 11 -6.151 4.474 4.587 1.00 0.00 O ATOM 1632 CB PRO B 11 -9.079 6.340 5.278 1.00 0.00 C ATOM 1633 CG PRO B 11 -9.034 7.826 5.349 1.00 0.00 C ATOM 1634 CD PRO B 11 -7.627 8.209 4.989 1.00 0.00 C ATOM 0 HA PRO B 11 -7.645 5.662 6.817 1.00 0.00 H new ATOM 0 HB2 PRO B 11 -9.280 5.997 4.263 1.00 0.00 H new ATOM 0 HB3 PRO B 11 -9.867 5.936 5.914 1.00 0.00 H new ATOM 0 HG2 PRO B 11 -9.750 8.273 4.659 1.00 0.00 H new ATOM 0 HG3 PRO B 11 -9.292 8.178 6.348 1.00 0.00 H new ATOM 0 HD2 PRO B 11 -7.525 8.406 3.922 1.00 0.00 H new ATOM 0 HD3 PRO B 11 -7.310 9.112 5.511 1.00 0.00 H new ATOM 1642 N GLU B 12 -8.209 3.653 4.960 1.00 0.00 N ATOM 1643 CA GLU B 12 -7.952 2.387 4.282 1.00 0.00 C ATOM 1644 C GLU B 12 -8.140 2.530 2.769 1.00 0.00 C ATOM 1645 O GLU B 12 -8.375 3.625 2.259 1.00 0.00 O ATOM 1646 CB GLU B 12 -8.883 1.299 4.838 1.00 0.00 C ATOM 1647 CG GLU B 12 -8.390 -0.123 4.597 1.00 0.00 C ATOM 1648 CD GLU B 12 -8.168 -0.906 5.876 1.00 0.00 C ATOM 1649 OE1 GLU B 12 -8.675 -0.477 6.934 1.00 0.00 O ATOM 1650 OE2 GLU B 12 -7.481 -1.952 5.818 1.00 0.00 O ATOM 0 H GLU B 12 -9.150 3.739 5.344 1.00 0.00 H new ATOM 0 HA GLU B 12 -6.917 2.098 4.466 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -9.005 1.453 5.910 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -9.868 1.412 4.385 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -9.115 -0.651 3.977 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -7.457 -0.086 4.035 1.00 0.00 H new ATOM 1657 N PHE B 13 -8.048 1.406 2.065 1.00 0.00 N ATOM 1658 CA PHE B 13 -8.222 1.389 0.619 1.00 0.00 C ATOM 1659 C PHE B 13 -9.607 0.849 0.271 1.00 0.00 C ATOM 1660 O PHE B 13 -9.922 -0.316 0.512 1.00 0.00 O ATOM 1661 CB PHE B 13 -7.117 0.570 -0.065 1.00 0.00 C ATOM 1662 CG PHE B 13 -7.223 -0.921 0.100 1.00 0.00 C ATOM 1663 CD1 PHE B 13 -7.270 -1.510 1.356 1.00 0.00 C ATOM 1664 CD2 PHE B 13 -7.262 -1.735 -1.016 1.00 0.00 C ATOM 1665 CE1 PHE B 13 -7.357 -2.883 1.487 1.00 0.00 C ATOM 1666 CE2 PHE B 13 -7.348 -3.105 -0.887 1.00 0.00 C ATOM 1667 CZ PHE B 13 -7.396 -3.679 0.358 1.00 0.00 C ATOM 0 H PHE B 13 -7.853 0.493 2.475 1.00 0.00 H new ATOM 0 HA PHE B 13 -8.142 2.410 0.246 1.00 0.00 H new ATOM 0 HB2 PHE B 13 -7.123 0.802 -1.130 1.00 0.00 H new ATOM 0 HB3 PHE B 13 -6.153 0.894 0.327 1.00 0.00 H new ATOM 0 HD1 PHE B 13 -7.238 -0.889 2.239 1.00 0.00 H new ATOM 0 HD2 PHE B 13 -7.225 -1.293 -2.001 1.00 0.00 H new ATOM 0 HE1 PHE B 13 -7.394 -3.332 2.468 1.00 0.00 H new ATOM 0 HE2 PHE B 13 -7.378 -3.728 -1.769 1.00 0.00 H new ATOM 0 HZ PHE B 13 -7.464 -4.752 0.456 1.00 0.00 H new ATOM 1677 N TYR B 14 -10.419 1.725 -0.316 1.00 0.00 N ATOM 1678 CA TYR B 14 -11.775 1.386 -0.734 1.00 0.00 C ATOM 1679 C TYR B 14 -11.919 1.539 -2.251 1.00 0.00 C ATOM 1680 O TYR B 14 -10.982 1.978 -2.919 1.00 0.00 O ATOM 1681 CB TYR B 14 -12.778 2.259 0.021 1.00 0.00 C ATOM 1682 CG TYR B 14 -13.264 1.614 1.302 1.00 0.00 C ATOM 1683 CD1 TYR B 14 -14.354 0.751 1.305 1.00 0.00 C ATOM 1684 CD2 TYR B 14 -12.618 1.855 2.509 1.00 0.00 C ATOM 1685 CE1 TYR B 14 -14.788 0.150 2.472 1.00 0.00 C ATOM 1686 CE2 TYR B 14 -13.044 1.256 3.680 1.00 0.00 C ATOM 1687 CZ TYR B 14 -14.129 0.405 3.654 1.00 0.00 C ATOM 1688 OH TYR B 14 -14.556 -0.197 4.817 1.00 0.00 O ATOM 0 H TYR B 14 -10.154 2.690 -0.515 1.00 0.00 H new ATOM 0 HA TYR B 14 -11.982 0.344 -0.491 1.00 0.00 H new ATOM 0 HB2 TYR B 14 -12.316 3.218 0.254 1.00 0.00 H new ATOM 0 HB3 TYR B 14 -13.632 2.465 -0.624 1.00 0.00 H new ATOM 0 HD1 TYR B 14 -14.871 0.546 0.379 1.00 0.00 H new ATOM 0 HD2 TYR B 14 -11.769 2.522 2.532 1.00 0.00 H new ATOM 0 HE1 TYR B 14 -15.639 -0.515 2.457 1.00 0.00 H new ATOM 0 HE2 TYR B 14 -12.530 1.453 4.609 1.00 0.00 H new ATOM 0 HH TYR B 14 -13.984 0.086 5.561 1.00 0.00 H new ATOM 1698 N PRO B 15 -13.087 1.185 -2.827 1.00 0.00 N ATOM 1699 CA PRO B 15 -13.309 1.300 -4.273 1.00 0.00 C ATOM 1700 C PRO B 15 -13.390 2.748 -4.744 1.00 0.00 C ATOM 1701 O PRO B 15 -14.455 3.372 -4.718 1.00 0.00 O ATOM 1702 CB PRO B 15 -14.646 0.606 -4.489 1.00 0.00 C ATOM 1703 CG PRO B 15 -15.347 0.714 -3.183 1.00 0.00 C ATOM 1704 CD PRO B 15 -14.272 0.644 -2.134 1.00 0.00 C ATOM 0 HA PRO B 15 -12.486 0.862 -4.837 1.00 0.00 H new ATOM 0 HB2 PRO B 15 -15.216 1.086 -5.285 1.00 0.00 H new ATOM 0 HB3 PRO B 15 -14.508 -0.436 -4.779 1.00 0.00 H new ATOM 0 HG2 PRO B 15 -15.901 1.650 -3.113 1.00 0.00 H new ATOM 0 HG3 PRO B 15 -16.068 -0.094 -3.058 1.00 0.00 H new ATOM 0 HD2 PRO B 15 -14.529 1.235 -1.255 1.00 0.00 H new ATOM 0 HD3 PRO B 15 -14.107 -0.378 -1.794 1.00 0.00 H new ATOM 1712 N SER B 16 -12.258 3.269 -5.195 1.00 0.00 N ATOM 1713 CA SER B 16 -12.181 4.636 -5.689 1.00 0.00 C ATOM 1714 C SER B 16 -13.215 4.868 -6.786 1.00 0.00 C ATOM 1715 O SER B 16 -14.094 5.718 -6.655 1.00 0.00 O ATOM 1716 CB SER B 16 -10.773 4.918 -6.210 1.00 0.00 C ATOM 1717 OG SER B 16 -10.415 6.278 -6.024 1.00 0.00 O ATOM 0 H SER B 16 -11.374 2.761 -5.229 1.00 0.00 H new ATOM 0 HA SER B 16 -12.398 5.321 -4.869 1.00 0.00 H new ATOM 0 HB2 SER B 16 -10.057 4.278 -5.694 1.00 0.00 H new ATOM 0 HB3 SER B 16 -10.718 4.667 -7.269 1.00 0.00 H new ATOM 0 HG SER B 16 -10.175 6.428 -5.086 1.00 0.00 H new ATOM 1723 N GLY B 17 -13.110 4.093 -7.858 1.00 0.00 N ATOM 1724 CA GLY B 17 -14.050 4.215 -8.955 1.00 0.00 C ATOM 1725 C GLY B 17 -15.305 3.391 -8.734 1.00 0.00 C ATOM 1726 O GLY B 17 -15.677 2.579 -9.579 1.00 0.00 O ATOM 0 H GLY B 17 -12.390 3.382 -7.987 1.00 0.00 H new ATOM 0 HA2 GLY B 17 -14.324 5.263 -9.081 1.00 0.00 H new ATOM 0 HA3 GLY B 17 -13.568 3.898 -9.880 1.00 0.00 H new ATOM 1730 N TYR B 18 -15.964 3.601 -7.595 1.00 0.00 N ATOM 1731 CA TYR B 18 -17.186 2.872 -7.276 1.00 0.00 C ATOM 1732 C TYR B 18 -18.301 3.216 -8.261 1.00 0.00 C ATOM 1733 O TYR B 18 -19.032 4.187 -8.065 1.00 0.00 O ATOM 1734 CB TYR B 18 -17.637 3.196 -5.853 1.00 0.00 C ATOM 1735 CG TYR B 18 -18.249 2.021 -5.127 1.00 0.00 C ATOM 1736 CD1 TYR B 18 -17.607 0.791 -5.102 1.00 0.00 C ATOM 1737 CD2 TYR B 18 -19.464 2.142 -4.466 1.00 0.00 C ATOM 1738 CE1 TYR B 18 -18.158 -0.287 -4.437 1.00 0.00 C ATOM 1739 CE2 TYR B 18 -20.023 1.069 -3.798 1.00 0.00 C ATOM 1740 CZ TYR B 18 -19.366 -0.143 -3.786 1.00 0.00 C ATOM 1741 OH TYR B 18 -19.922 -1.214 -3.124 1.00 0.00 O ATOM 0 H TYR B 18 -15.672 4.268 -6.881 1.00 0.00 H new ATOM 0 HA TYR B 18 -16.973 1.806 -7.353 1.00 0.00 H new ATOM 0 HB2 TYR B 18 -16.781 3.558 -5.284 1.00 0.00 H new ATOM 0 HB3 TYR B 18 -18.363 4.008 -5.888 1.00 0.00 H new ATOM 0 HD1 TYR B 18 -16.661 0.675 -5.611 1.00 0.00 H new ATOM 0 HD2 TYR B 18 -19.981 3.090 -4.474 1.00 0.00 H new ATOM 0 HE1 TYR B 18 -17.646 -1.238 -4.427 1.00 0.00 H new ATOM 0 HE2 TYR B 18 -20.969 1.179 -3.288 1.00 0.00 H new ATOM 0 HH TYR B 18 -20.772 -0.943 -2.719 1.00 0.00 H new ATOM 1751 N SER B 19 -18.428 2.416 -9.314 1.00 0.00 N ATOM 1752 CA SER B 19 -19.457 2.639 -10.324 1.00 0.00 C ATOM 1753 C SER B 19 -20.712 1.830 -10.015 1.00 0.00 C ATOM 1754 O SER B 19 -20.644 0.776 -9.385 1.00 0.00 O ATOM 1755 CB SER B 19 -18.925 2.274 -11.713 1.00 0.00 C ATOM 1756 OG SER B 19 -19.176 3.313 -12.642 1.00 0.00 O ATOM 0 H SER B 19 -17.832 1.608 -9.491 1.00 0.00 H new ATOM 0 HA SER B 19 -19.720 3.697 -10.310 1.00 0.00 H new ATOM 0 HB2 SER B 19 -17.853 2.082 -11.657 1.00 0.00 H new ATOM 0 HB3 SER B 19 -19.396 1.353 -12.056 1.00 0.00 H new ATOM 0 HG SER B 19 -18.826 3.058 -13.521 1.00 0.00 H new ATOM 1762 N SER B 20 -21.860 2.333 -10.462 1.00 0.00 N ATOM 1763 CA SER B 20 -23.133 1.658 -10.233 1.00 0.00 C ATOM 1764 C SER B 20 -23.411 0.625 -11.321 1.00 0.00 C ATOM 1765 O SER B 20 -23.282 -0.579 -11.094 1.00 0.00 O ATOM 1766 CB SER B 20 -24.273 2.678 -10.180 1.00 0.00 C ATOM 1767 OG SER B 20 -24.058 3.733 -11.102 1.00 0.00 O ATOM 0 H SER B 20 -21.934 3.206 -10.985 1.00 0.00 H new ATOM 0 HA SER B 20 -23.071 1.140 -9.276 1.00 0.00 H new ATOM 0 HB2 SER B 20 -25.218 2.183 -10.403 1.00 0.00 H new ATOM 0 HB3 SER B 20 -24.356 3.083 -9.172 1.00 0.00 H new ATOM 0 HG SER B 20 -24.801 4.370 -11.049 1.00 0.00 H new ATOM 1773 N SER B 21 -23.799 1.100 -12.501 1.00 0.00 N ATOM 1774 CA SER B 21 -24.100 0.214 -13.620 1.00 0.00 C ATOM 1775 C SER B 21 -23.020 0.297 -14.694 1.00 0.00 C ATOM 1776 O SER B 21 -22.021 0.999 -14.534 1.00 0.00 O ATOM 1777 CB SER B 21 -25.461 0.567 -14.221 1.00 0.00 C ATOM 1778 OG SER B 21 -25.683 1.967 -14.197 1.00 0.00 O ATOM 0 H SER B 21 -23.912 2.093 -12.707 1.00 0.00 H new ATOM 0 HA SER B 21 -24.128 -0.808 -13.242 1.00 0.00 H new ATOM 0 HB2 SER B 21 -25.513 0.205 -15.248 1.00 0.00 H new ATOM 0 HB3 SER B 21 -26.250 0.061 -13.664 1.00 0.00 H new ATOM 0 HG SER B 21 -26.559 2.166 -14.588 1.00 0.00 H new ATOM 1784 N TYR B 22 -23.230 -0.426 -15.790 1.00 0.00 N ATOM 1785 CA TYR B 22 -22.279 -0.440 -16.896 1.00 0.00 C ATOM 1786 C TYR B 22 -22.734 0.491 -18.017 1.00 0.00 C ATOM 1787 O TYR B 22 -22.462 0.176 -19.195 1.00 0.00 O ATOM 1788 CB TYR B 22 -22.109 -1.863 -17.432 1.00 0.00 C ATOM 1789 CG TYR B 22 -23.402 -2.492 -17.903 1.00 0.00 C ATOM 1790 CD1 TYR B 22 -24.214 -3.197 -17.025 1.00 0.00 C ATOM 1791 CD2 TYR B 22 -23.807 -2.381 -19.228 1.00 0.00 C ATOM 1792 CE1 TYR B 22 -25.395 -3.775 -17.453 1.00 0.00 C ATOM 1793 CE2 TYR B 22 -24.987 -2.955 -19.664 1.00 0.00 C ATOM 1794 CZ TYR B 22 -25.777 -3.651 -18.773 1.00 0.00 C ATOM 1795 OH TYR B 22 -26.952 -4.225 -19.203 1.00 0.00 O ATOM 1796 OXT TYR B 22 -23.362 1.525 -17.709 1.00 0.00 O ATOM 0 H TYR B 22 -24.053 -1.011 -15.936 1.00 0.00 H new ATOM 0 HA TYR B 22 -21.319 -0.085 -16.522 1.00 0.00 H new ATOM 0 HB2 TYR B 22 -21.400 -1.848 -18.259 1.00 0.00 H new ATOM 0 HB3 TYR B 22 -21.675 -2.487 -16.651 1.00 0.00 H new ATOM 0 HD1 TYR B 22 -23.918 -3.296 -15.991 1.00 0.00 H new ATOM 0 HD2 TYR B 22 -23.190 -1.838 -19.928 1.00 0.00 H new ATOM 0 HE1 TYR B 22 -26.015 -4.321 -16.758 1.00 0.00 H new ATOM 0 HE2 TYR B 22 -25.288 -2.859 -20.697 1.00 0.00 H new ATOM 0 HH TYR B 22 -27.074 -4.044 -20.158 1.00 0.00 H new TER 1806 TYR B 22