USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 586 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 60 ASN : amide:sc= 0.0677 K(o=0.14,f=-0.79) USER MOD Set 1.2: A 62 GLN : amide:sc= 0.0717 K(o=0.14,f=-0.45) USER MOD Set 2.1: A 55 THR OG1 : rot -77:sc= 1.23 USER MOD Set 2.2: A 57 SER OG : rot -84:sc= 0.395 USER MOD Set 3.1: A 22 THR OG1 : rot 180:sc= 0.195 USER MOD Set 3.2: A 25 ASN : amide:sc= 0 X(o=0.2,f=0.42) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 144:sc= 1.3 (180deg=1.17) USER MOD Single : A 2 GLN : amide:sc= 1.19 K(o=1.2,f=-0.77) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot -39:sc= 0.491 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -142:sc= 1.03 (180deg=-0.477!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.125 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.144 K(o=-0.14,f=-1.4) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.108 X(o=-0.11,f=-0.15) USER MOD Single : A 41 GLN : amide:sc= 1.48 K(o=1.5,f=-1.4!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.0654 K(o=0.065,f=-2.2!) USER MOD Single : A 59 TYR OH : rot 151:sc= 0.0861 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 92:sc= 0.123 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.19) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.401 31.055 15.964 1.00 0.00 N ATOM 2 CA MET A 1 13.631 31.403 17.374 1.00 0.00 C ATOM 3 C MET A 1 15.069 31.913 17.510 1.00 0.00 C ATOM 4 O MET A 1 15.764 32.230 16.551 1.00 0.00 O ATOM 5 CB MET A 1 13.282 30.193 18.240 1.00 0.00 C ATOM 6 CG MET A 1 14.160 28.945 18.106 1.00 0.00 C ATOM 7 SD MET A 1 14.143 27.792 19.500 1.00 0.00 S ATOM 8 CE MET A 1 15.462 26.616 19.090 1.00 0.00 C ATOM 0 H1 MET A 1 12.785 30.219 15.909 1.00 0.00 H new ATOM 0 H2 MET A 1 12.945 31.854 15.479 1.00 0.00 H new ATOM 0 H3 MET A 1 14.311 30.845 15.505 1.00 0.00 H new ATOM 0 HA MET A 1 12.988 32.210 17.726 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.305 30.509 19.283 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.254 29.906 18.017 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.850 28.404 17.212 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.188 29.267 17.943 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.538 25.866 19.877 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.232 26.127 18.144 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.409 27.148 19.003 1.00 0.00 H new ATOM 20 N GLN A 2 15.374 31.991 18.802 1.00 0.00 N ATOM 21 CA GLN A 2 16.623 32.401 19.411 1.00 0.00 C ATOM 22 C GLN A 2 17.151 31.525 20.545 1.00 0.00 C ATOM 23 O GLN A 2 16.417 30.978 21.368 1.00 0.00 O ATOM 24 CB GLN A 2 16.628 33.899 19.748 1.00 0.00 C ATOM 25 CG GLN A 2 16.718 34.924 18.622 1.00 0.00 C ATOM 26 CD GLN A 2 16.779 36.375 19.080 1.00 0.00 C ATOM 27 OE1 GLN A 2 16.295 36.694 20.160 1.00 0.00 O ATOM 28 NE2 GLN A 2 17.407 37.297 18.357 1.00 0.00 N ATOM 0 H GLN A 2 14.683 31.744 19.511 1.00 0.00 H new ATOM 0 HA GLN A 2 17.363 32.229 18.630 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.718 34.110 20.309 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.466 34.079 20.421 1.00 0.00 H new ATOM 0 HG2 GLN A 2 17.604 34.709 18.025 1.00 0.00 H new ATOM 0 HG3 GLN A 2 15.855 34.801 17.968 1.00 0.00 H new ATOM 0 HE21 GLN A 2 17.815 37.048 17.456 1.00 0.00 H new ATOM 0 HE22 GLN A 2 17.481 38.254 18.703 1.00 0.00 H new ATOM 37 N ILE A 3 18.482 31.535 20.629 1.00 0.00 N ATOM 38 CA ILE A 3 19.272 31.040 21.741 1.00 0.00 C ATOM 39 C ILE A 3 20.424 31.969 22.131 1.00 0.00 C ATOM 40 O ILE A 3 21.106 32.565 21.299 1.00 0.00 O ATOM 41 CB ILE A 3 19.814 29.652 21.425 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.692 29.638 20.173 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.787 28.518 21.415 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.524 28.375 19.911 1.00 0.00 C ATOM 0 H ILE A 3 19.063 31.910 19.879 1.00 0.00 H new ATOM 0 HA ILE A 3 18.600 30.996 22.598 1.00 0.00 H new ATOM 0 HB ILE A 3 20.445 29.428 22.285 1.00 0.00 H new ATOM 0 HG12 ILE A 3 20.049 29.804 19.308 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.375 30.486 20.230 1.00 0.00 H new ATOM 0 HG21 ILE A 3 19.285 27.578 21.179 1.00 0.00 H new ATOM 0 HG22 ILE A 3 18.318 28.443 22.396 1.00 0.00 H new ATOM 0 HG23 ILE A 3 18.025 28.724 20.663 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.098 28.501 18.993 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.206 28.209 20.745 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.860 27.517 19.809 1.00 0.00 H new ATOM 56 N PHE A 4 20.781 32.099 23.408 1.00 0.00 N ATOM 57 CA PHE A 4 22.043 32.665 23.830 1.00 0.00 C ATOM 58 C PHE A 4 23.080 31.548 23.944 1.00 0.00 C ATOM 59 O PHE A 4 22.884 30.552 24.639 1.00 0.00 O ATOM 60 CB PHE A 4 21.888 33.441 25.137 1.00 0.00 C ATOM 61 CG PHE A 4 20.683 34.330 25.354 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.673 35.617 24.789 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.531 33.890 26.013 1.00 0.00 C ATOM 64 CE1 PHE A 4 19.524 36.421 24.805 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.519 34.799 26.326 1.00 0.00 C ATOM 66 CZ PHE A 4 18.465 36.010 25.627 1.00 0.00 C ATOM 0 H PHE A 4 20.186 31.807 24.183 1.00 0.00 H new ATOM 0 HA PHE A 4 22.388 33.382 23.085 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.904 32.714 25.949 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.775 34.065 25.250 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.574 35.997 24.330 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.424 32.849 26.279 1.00 0.00 H new ATOM 0 HE1 PHE A 4 19.458 37.319 24.209 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.792 34.572 27.092 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.592 36.639 25.722 1.00 0.00 H new ATOM 76 N VAL A 5 24.175 31.691 23.200 1.00 0.00 N ATOM 77 CA VAL A 5 25.464 31.082 23.427 1.00 0.00 C ATOM 78 C VAL A 5 26.068 32.037 24.447 1.00 0.00 C ATOM 79 O VAL A 5 26.237 33.241 24.244 1.00 0.00 O ATOM 80 CB VAL A 5 26.267 31.059 22.115 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.703 30.597 22.345 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.611 30.333 20.945 1.00 0.00 C ATOM 0 H VAL A 5 24.174 32.279 22.366 1.00 0.00 H new ATOM 0 HA VAL A 5 25.438 30.047 23.767 1.00 0.00 H new ATOM 0 HB VAL A 5 26.282 32.100 21.793 1.00 0.00 H new ATOM 0 HG11 VAL A 5 28.240 30.593 21.397 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.197 31.277 23.039 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.699 29.591 22.764 1.00 0.00 H new ATOM 0 HG21 VAL A 5 26.265 30.380 20.075 1.00 0.00 H new ATOM 0 HG22 VAL A 5 25.439 29.291 21.214 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.659 30.809 20.709 1.00 0.00 H new ATOM 92 N LYS A 6 26.453 31.366 25.532 1.00 0.00 N ATOM 93 CA LYS A 6 27.386 31.920 26.505 1.00 0.00 C ATOM 94 C LYS A 6 28.712 31.212 26.226 1.00 0.00 C ATOM 95 O LYS A 6 28.934 30.045 26.533 1.00 0.00 O ATOM 96 CB LYS A 6 26.941 31.682 27.950 1.00 0.00 C ATOM 97 CG LYS A 6 27.675 32.244 29.168 1.00 0.00 C ATOM 98 CD LYS A 6 27.117 31.503 30.388 1.00 0.00 C ATOM 99 CE LYS A 6 27.618 32.017 31.748 1.00 0.00 C ATOM 100 NZ LYS A 6 27.074 33.325 32.128 1.00 0.00 N ATOM 0 H LYS A 6 26.127 30.426 25.758 1.00 0.00 H new ATOM 0 HA LYS A 6 27.455 33.003 26.403 1.00 0.00 H new ATOM 0 HB2 LYS A 6 25.915 32.044 28.017 1.00 0.00 H new ATOM 0 HB3 LYS A 6 26.907 30.601 28.085 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.750 32.090 29.079 1.00 0.00 H new ATOM 0 HG3 LYS A 6 27.513 33.318 29.258 1.00 0.00 H new ATOM 0 HD2 LYS A 6 26.029 31.572 30.369 1.00 0.00 H new ATOM 0 HD3 LYS A 6 27.371 30.447 30.300 1.00 0.00 H new ATOM 0 HE2 LYS A 6 27.359 31.290 32.518 1.00 0.00 H new ATOM 0 HE3 LYS A 6 28.706 32.081 31.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 27.457 33.604 33.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 27.342 34.033 31.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 26.037 33.266 32.185 1.00 0.00 H new ATOM 114 N THR A 7 29.616 31.958 25.590 1.00 0.00 N ATOM 115 CA THR A 7 30.989 31.537 25.386 1.00 0.00 C ATOM 116 C THR A 7 31.748 31.600 26.711 1.00 0.00 C ATOM 117 O THR A 7 31.579 32.549 27.473 1.00 0.00 O ATOM 118 CB THR A 7 31.641 32.428 24.324 1.00 0.00 C ATOM 119 OG1 THR A 7 31.778 33.810 24.542 1.00 0.00 O ATOM 120 CG2 THR A 7 30.844 32.281 23.027 1.00 0.00 C ATOM 0 H THR A 7 29.407 32.878 25.201 1.00 0.00 H new ATOM 0 HA THR A 7 31.016 30.507 25.031 1.00 0.00 H new ATOM 0 HB THR A 7 32.667 32.059 24.324 1.00 0.00 H new ATOM 0 HG1 THR A 7 30.979 34.150 24.995 1.00 0.00 H new ATOM 0 HG21 THR A 7 31.289 32.907 22.254 1.00 0.00 H new ATOM 0 HG22 THR A 7 30.861 31.240 22.706 1.00 0.00 H new ATOM 0 HG23 THR A 7 29.813 32.592 23.196 1.00 0.00 H new ATOM 128 N LEU A 8 32.582 30.614 27.033 1.00 0.00 N ATOM 129 CA LEU A 8 33.203 30.507 28.337 1.00 0.00 C ATOM 130 C LEU A 8 33.920 31.717 28.937 1.00 0.00 C ATOM 131 O LEU A 8 33.651 31.931 30.113 1.00 0.00 O ATOM 132 CB LEU A 8 34.045 29.230 28.411 1.00 0.00 C ATOM 133 CG LEU A 8 33.605 28.346 29.573 1.00 0.00 C ATOM 134 CD1 LEU A 8 32.362 27.496 29.328 1.00 0.00 C ATOM 135 CD2 LEU A 8 34.784 27.508 30.078 1.00 0.00 C ATOM 0 H LEU A 8 32.843 29.867 26.389 1.00 0.00 H new ATOM 0 HA LEU A 8 32.344 30.461 29.006 1.00 0.00 H new ATOM 0 HB2 LEU A 8 33.955 28.677 27.476 1.00 0.00 H new ATOM 0 HB3 LEU A 8 35.097 29.491 28.527 1.00 0.00 H new ATOM 0 HG LEU A 8 33.285 29.036 30.353 1.00 0.00 H new ATOM 0 HD11 LEU A 8 32.141 26.909 30.219 1.00 0.00 H new ATOM 0 HD12 LEU A 8 31.516 28.145 29.103 1.00 0.00 H new ATOM 0 HD13 LEU A 8 32.539 26.826 28.487 1.00 0.00 H new ATOM 0 HD21 LEU A 8 34.456 26.881 30.908 1.00 0.00 H new ATOM 0 HD22 LEU A 8 35.154 26.876 29.270 1.00 0.00 H new ATOM 0 HD23 LEU A 8 35.582 28.169 30.416 1.00 0.00 H new ATOM 147 N THR A 9 34.684 32.577 28.266 1.00 0.00 N ATOM 148 CA THR A 9 35.082 33.946 28.501 1.00 0.00 C ATOM 149 C THR A 9 34.054 34.865 29.156 1.00 0.00 C ATOM 150 O THR A 9 34.443 35.739 29.938 1.00 0.00 O ATOM 151 CB THR A 9 35.866 34.537 27.320 1.00 0.00 C ATOM 152 OG1 THR A 9 36.660 35.619 27.744 1.00 0.00 O ATOM 153 CG2 THR A 9 34.984 34.904 26.130 1.00 0.00 C ATOM 0 H THR A 9 35.105 32.259 27.393 1.00 0.00 H new ATOM 0 HA THR A 9 35.797 33.882 29.321 1.00 0.00 H new ATOM 0 HB THR A 9 36.526 33.751 26.954 1.00 0.00 H new ATOM 0 HG1 THR A 9 37.153 35.982 26.979 1.00 0.00 H new ATOM 0 HG21 THR A 9 35.602 35.315 25.332 1.00 0.00 H new ATOM 0 HG22 THR A 9 34.471 34.013 25.769 1.00 0.00 H new ATOM 0 HG23 THR A 9 34.248 35.646 26.438 1.00 0.00 H new ATOM 161 N GLY A 10 32.760 34.653 28.935 1.00 0.00 N ATOM 162 CA GLY A 10 31.675 35.389 29.560 1.00 0.00 C ATOM 163 C GLY A 10 30.766 36.007 28.496 1.00 0.00 C ATOM 164 O GLY A 10 29.629 36.437 28.702 1.00 0.00 O ATOM 0 H GLY A 10 32.430 33.935 28.290 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.096 34.722 30.199 1.00 0.00 H new ATOM 0 HA3 GLY A 10 32.080 36.172 30.200 1.00 0.00 H new ATOM 168 N LYS A 11 31.303 36.143 27.291 1.00 0.00 N ATOM 169 CA LYS A 11 30.652 36.930 26.265 1.00 0.00 C ATOM 170 C LYS A 11 29.409 36.177 25.783 1.00 0.00 C ATOM 171 O LYS A 11 29.550 34.962 25.606 1.00 0.00 O ATOM 172 CB LYS A 11 31.755 37.034 25.211 1.00 0.00 C ATOM 173 CG LYS A 11 31.506 38.129 24.166 1.00 0.00 C ATOM 174 CD LYS A 11 32.469 37.949 22.984 1.00 0.00 C ATOM 175 CE LYS A 11 32.261 39.068 21.964 1.00 0.00 C ATOM 176 NZ LYS A 11 33.326 38.966 20.944 1.00 0.00 N ATOM 0 H LYS A 11 32.185 35.718 27.005 1.00 0.00 H new ATOM 0 HA LYS A 11 30.287 37.912 26.565 1.00 0.00 H new ATOM 0 HB2 LYS A 11 32.705 37.229 25.709 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.852 36.074 24.703 1.00 0.00 H new ATOM 0 HG2 LYS A 11 30.475 38.083 23.817 1.00 0.00 H new ATOM 0 HG3 LYS A 11 31.647 39.112 24.615 1.00 0.00 H new ATOM 0 HD2 LYS A 11 33.499 37.957 23.340 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.302 36.981 22.513 1.00 0.00 H new ATOM 0 HE2 LYS A 11 31.279 38.981 21.499 1.00 0.00 H new ATOM 0 HE3 LYS A 11 32.296 40.041 22.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.633 39.920 20.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 34.134 38.443 21.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 32.961 38.463 20.110 1.00 0.00 H new ATOM 190 N THR A 12 28.310 36.875 25.548 1.00 0.00 N ATOM 191 CA THR A 12 27.025 36.294 25.194 1.00 0.00 C ATOM 192 C THR A 12 26.497 36.708 23.819 1.00 0.00 C ATOM 193 O THR A 12 25.928 37.774 23.600 1.00 0.00 O ATOM 194 CB THR A 12 26.112 36.536 26.391 1.00 0.00 C ATOM 195 OG1 THR A 12 26.526 35.719 27.466 1.00 0.00 O ATOM 196 CG2 THR A 12 24.686 36.043 26.195 1.00 0.00 C ATOM 0 H THR A 12 28.287 37.893 25.600 1.00 0.00 H new ATOM 0 HA THR A 12 27.103 35.220 25.026 1.00 0.00 H new ATOM 0 HB THR A 12 26.158 37.614 26.546 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.942 35.873 28.238 1.00 0.00 H new ATOM 0 HG21 THR A 12 24.102 36.253 27.091 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.238 36.554 25.342 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.695 34.969 26.011 1.00 0.00 H new ATOM 204 N ILE A 13 26.464 35.730 22.929 1.00 0.00 N ATOM 205 CA ILE A 13 26.046 36.025 21.574 1.00 0.00 C ATOM 206 C ILE A 13 24.622 35.491 21.391 1.00 0.00 C ATOM 207 O ILE A 13 24.425 34.290 21.509 1.00 0.00 O ATOM 208 CB ILE A 13 26.990 35.206 20.702 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.501 35.087 20.947 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.796 35.582 19.233 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.240 36.422 20.918 1.00 0.00 C ATOM 0 H ILE A 13 26.713 34.758 23.112 1.00 0.00 H new ATOM 0 HA ILE A 13 26.067 37.088 21.336 1.00 0.00 H new ATOM 0 HB ILE A 13 26.657 34.219 21.023 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.666 34.613 21.914 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.931 34.429 20.192 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.473 34.993 18.614 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.766 35.379 18.938 1.00 0.00 H new ATOM 0 HG23 ILE A 13 27.010 36.642 19.098 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.302 36.254 21.099 1.00 0.00 H new ATOM 0 HD12 ILE A 13 29.108 36.890 19.942 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.839 37.077 21.692 1.00 0.00 H new ATOM 223 N THR A 14 23.645 36.234 20.858 1.00 0.00 N ATOM 224 CA THR A 14 22.318 35.733 20.605 1.00 0.00 C ATOM 225 C THR A 14 22.244 35.237 19.152 1.00 0.00 C ATOM 226 O THR A 14 22.525 35.980 18.217 1.00 0.00 O ATOM 227 CB THR A 14 21.482 36.968 20.938 1.00 0.00 C ATOM 228 OG1 THR A 14 21.931 37.697 22.059 1.00 0.00 O ATOM 229 CG2 THR A 14 19.981 36.740 21.135 1.00 0.00 C ATOM 0 H THR A 14 23.770 37.211 20.592 1.00 0.00 H new ATOM 0 HA THR A 14 21.980 34.869 21.177 1.00 0.00 H new ATOM 0 HB THR A 14 21.631 37.540 20.022 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.345 38.469 22.203 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.496 37.688 21.366 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.553 36.327 20.222 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.824 36.042 21.957 1.00 0.00 H new ATOM 237 N LEU A 15 21.875 33.975 18.906 1.00 0.00 N ATOM 238 CA LEU A 15 21.823 33.366 17.593 1.00 0.00 C ATOM 239 C LEU A 15 20.347 33.122 17.247 1.00 0.00 C ATOM 240 O LEU A 15 19.601 32.617 18.066 1.00 0.00 O ATOM 241 CB LEU A 15 22.525 32.010 17.621 1.00 0.00 C ATOM 242 CG LEU A 15 23.987 31.915 17.181 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.860 32.850 18.017 1.00 0.00 C ATOM 244 CD2 LEU A 15 24.543 30.506 17.383 1.00 0.00 C ATOM 0 H LEU A 15 21.596 33.335 19.650 1.00 0.00 H new ATOM 0 HA LEU A 15 22.307 34.017 16.865 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.465 31.631 18.641 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.949 31.330 16.993 1.00 0.00 H new ATOM 0 HG LEU A 15 24.009 32.186 16.125 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.897 32.769 17.690 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.518 33.877 17.890 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.788 32.571 19.068 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.584 30.476 17.060 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.483 30.239 18.438 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.960 29.797 16.795 1.00 0.00 H new ATOM 256 N GLU A 16 19.933 33.510 16.040 1.00 0.00 N ATOM 257 CA GLU A 16 18.646 33.198 15.452 1.00 0.00 C ATOM 258 C GLU A 16 18.799 31.799 14.849 1.00 0.00 C ATOM 259 O GLU A 16 19.768 31.478 14.160 1.00 0.00 O ATOM 260 CB GLU A 16 18.201 34.204 14.384 1.00 0.00 C ATOM 261 CG GLU A 16 17.979 35.593 14.967 1.00 0.00 C ATOM 262 CD GLU A 16 19.107 36.575 15.230 1.00 0.00 C ATOM 263 OE1 GLU A 16 20.025 36.674 14.393 1.00 0.00 O ATOM 264 OE2 GLU A 16 19.031 37.280 16.269 1.00 0.00 O ATOM 0 H GLU A 16 20.518 34.075 15.425 1.00 0.00 H new ATOM 0 HA GLU A 16 17.869 33.245 16.215 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.955 34.257 13.599 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.280 33.855 13.918 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.279 36.098 14.301 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.467 35.450 15.919 1.00 0.00 H new ATOM 271 N VAL A 17 17.833 30.935 15.149 1.00 0.00 N ATOM 272 CA VAL A 17 17.767 29.585 14.625 1.00 0.00 C ATOM 273 C VAL A 17 16.336 29.122 14.357 1.00 0.00 C ATOM 274 O VAL A 17 15.394 29.837 14.679 1.00 0.00 O ATOM 275 CB VAL A 17 18.517 28.637 15.561 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.035 28.839 15.702 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.935 28.594 16.968 1.00 0.00 C ATOM 0 H VAL A 17 17.062 31.164 15.776 1.00 0.00 H new ATOM 0 HA VAL A 17 18.256 29.575 13.651 1.00 0.00 H new ATOM 0 HB VAL A 17 18.368 27.694 15.035 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.438 28.100 16.395 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.510 28.720 14.728 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.235 29.840 16.083 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.514 27.902 17.580 1.00 0.00 H new ATOM 0 HG22 VAL A 17 17.975 29.590 17.409 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.899 28.259 16.923 1.00 0.00 H new ATOM 287 N GLU A 18 16.299 27.842 13.996 1.00 0.00 N ATOM 288 CA GLU A 18 15.080 27.090 13.770 1.00 0.00 C ATOM 289 C GLU A 18 15.255 25.683 14.334 1.00 0.00 C ATOM 290 O GLU A 18 16.353 25.140 14.258 1.00 0.00 O ATOM 291 CB GLU A 18 14.759 27.233 12.274 1.00 0.00 C ATOM 292 CG GLU A 18 13.496 26.574 11.755 1.00 0.00 C ATOM 293 CD GLU A 18 12.179 27.318 11.943 1.00 0.00 C ATOM 294 OE1 GLU A 18 12.180 28.388 12.591 1.00 0.00 O ATOM 295 OE2 GLU A 18 11.163 26.800 11.441 1.00 0.00 O ATOM 0 H GLU A 18 17.143 27.289 13.850 1.00 0.00 H new ATOM 0 HA GLU A 18 14.200 27.456 14.298 1.00 0.00 H new ATOM 0 HB2 GLU A 18 14.700 28.297 12.045 1.00 0.00 H new ATOM 0 HB3 GLU A 18 15.602 26.832 11.711 1.00 0.00 H new ATOM 0 HG2 GLU A 18 13.628 26.390 10.689 1.00 0.00 H new ATOM 0 HG3 GLU A 18 13.403 25.601 12.237 1.00 0.00 H new ATOM 302 N PRO A 19 14.302 24.975 14.931 1.00 0.00 N ATOM 303 CA PRO A 19 14.575 23.769 15.681 1.00 0.00 C ATOM 304 C PRO A 19 14.923 22.535 14.846 1.00 0.00 C ATOM 305 O PRO A 19 15.221 21.450 15.351 1.00 0.00 O ATOM 306 CB PRO A 19 13.287 23.487 16.465 1.00 0.00 C ATOM 307 CG PRO A 19 12.195 24.100 15.598 1.00 0.00 C ATOM 308 CD PRO A 19 12.896 25.306 14.974 1.00 0.00 C ATOM 0 HA PRO A 19 15.460 23.942 16.293 1.00 0.00 H new ATOM 0 HB2 PRO A 19 13.131 22.418 16.608 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.314 23.941 17.456 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.840 23.401 14.840 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.328 24.397 16.189 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.512 25.505 13.974 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.725 26.205 15.566 1.00 0.00 H new ATOM 316 N SER A 20 14.655 22.551 13.545 1.00 0.00 N ATOM 317 CA SER A 20 15.123 21.667 12.488 1.00 0.00 C ATOM 318 C SER A 20 16.566 21.858 12.012 1.00 0.00 C ATOM 319 O SER A 20 17.037 21.140 11.130 1.00 0.00 O ATOM 320 CB SER A 20 14.226 21.843 11.264 1.00 0.00 C ATOM 321 OG SER A 20 13.890 23.206 11.114 1.00 0.00 O ATOM 0 H SER A 20 14.034 23.265 13.165 1.00 0.00 H new ATOM 0 HA SER A 20 15.084 20.676 12.939 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.738 21.484 10.371 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.321 21.245 11.375 1.00 0.00 H new ATOM 0 HG SER A 20 13.316 23.317 10.327 1.00 0.00 H new ATOM 327 N ASP A 21 17.320 22.779 12.600 1.00 0.00 N ATOM 328 CA ASP A 21 18.680 23.149 12.267 1.00 0.00 C ATOM 329 C ASP A 21 19.647 22.345 13.145 1.00 0.00 C ATOM 330 O ASP A 21 19.217 21.945 14.225 1.00 0.00 O ATOM 331 CB ASP A 21 18.886 24.623 12.602 1.00 0.00 C ATOM 332 CG ASP A 21 18.216 25.702 11.762 1.00 0.00 C ATOM 333 OD1 ASP A 21 17.907 25.455 10.579 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.271 26.898 12.110 1.00 0.00 O ATOM 0 H ASP A 21 16.963 23.326 13.383 1.00 0.00 H new ATOM 0 HA ASP A 21 18.860 22.956 11.209 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.562 24.768 13.632 1.00 0.00 H new ATOM 0 HB3 ASP A 21 19.959 24.813 12.576 1.00 0.00 H new ATOM 339 N THR A 22 20.851 22.069 12.648 1.00 0.00 N ATOM 340 CA THR A 22 21.861 21.253 13.290 1.00 0.00 C ATOM 341 C THR A 22 22.355 22.107 14.451 1.00 0.00 C ATOM 342 O THR A 22 22.322 23.341 14.471 1.00 0.00 O ATOM 343 CB THR A 22 22.952 20.803 12.320 1.00 0.00 C ATOM 344 OG1 THR A 22 23.421 21.789 11.430 1.00 0.00 O ATOM 345 CG2 THR A 22 22.464 19.609 11.498 1.00 0.00 C ATOM 0 H THR A 22 21.156 22.429 11.744 1.00 0.00 H new ATOM 0 HA THR A 22 21.470 20.302 13.652 1.00 0.00 H new ATOM 0 HB THR A 22 23.794 20.546 12.962 1.00 0.00 H new ATOM 0 HG1 THR A 22 24.115 21.406 10.854 1.00 0.00 H new ATOM 0 HG21 THR A 22 23.249 19.296 10.810 1.00 0.00 H new ATOM 0 HG22 THR A 22 22.217 18.784 12.166 1.00 0.00 H new ATOM 0 HG23 THR A 22 21.578 19.895 10.932 1.00 0.00 H new ATOM 353 N ILE A 23 22.984 21.423 15.398 1.00 0.00 N ATOM 354 CA ILE A 23 24.093 21.772 16.264 1.00 0.00 C ATOM 355 C ILE A 23 25.261 22.357 15.460 1.00 0.00 C ATOM 356 O ILE A 23 25.850 23.313 15.952 1.00 0.00 O ATOM 357 CB ILE A 23 24.385 20.649 17.265 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.205 20.505 18.230 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.731 20.862 17.968 1.00 0.00 C ATOM 360 CD1 ILE A 23 23.147 21.623 19.272 1.00 0.00 C ATOM 0 H ILE A 23 22.678 20.471 15.601 1.00 0.00 H new ATOM 0 HA ILE A 23 23.831 22.602 16.920 1.00 0.00 H new ATOM 0 HB ILE A 23 24.487 19.702 16.735 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.276 20.498 17.661 1.00 0.00 H new ATOM 0 HG13 ILE A 23 23.274 19.544 18.739 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.907 20.048 18.671 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.530 20.880 17.227 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.714 21.809 18.507 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.290 21.466 19.927 1.00 0.00 H new ATOM 0 HD12 ILE A 23 24.062 21.616 19.864 1.00 0.00 H new ATOM 0 HD13 ILE A 23 23.048 22.585 18.769 1.00 0.00 H new ATOM 372 N GLU A 24 25.568 21.772 14.306 1.00 0.00 N ATOM 373 CA GLU A 24 26.592 22.423 13.509 1.00 0.00 C ATOM 374 C GLU A 24 26.231 23.855 13.121 1.00 0.00 C ATOM 375 O GLU A 24 27.073 24.713 13.380 1.00 0.00 O ATOM 376 CB GLU A 24 27.083 21.613 12.310 1.00 0.00 C ATOM 377 CG GLU A 24 28.339 22.135 11.602 1.00 0.00 C ATOM 378 CD GLU A 24 28.563 21.449 10.269 1.00 0.00 C ATOM 379 OE1 GLU A 24 28.716 20.205 10.257 1.00 0.00 O ATOM 380 OE2 GLU A 24 28.495 22.045 9.172 1.00 0.00 O ATOM 0 H GLU A 24 25.159 20.918 13.927 1.00 0.00 H new ATOM 0 HA GLU A 24 27.446 22.479 14.184 1.00 0.00 H new ATOM 0 HB2 GLU A 24 27.278 20.594 12.643 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.276 21.561 11.579 1.00 0.00 H new ATOM 0 HG2 GLU A 24 28.248 23.210 11.446 1.00 0.00 H new ATOM 0 HG3 GLU A 24 29.208 21.978 12.241 1.00 0.00 H new ATOM 387 N ASN A 25 25.011 24.113 12.656 1.00 0.00 N ATOM 388 CA ASN A 25 24.657 25.453 12.253 1.00 0.00 C ATOM 389 C ASN A 25 24.493 26.420 13.429 1.00 0.00 C ATOM 390 O ASN A 25 24.507 27.630 13.235 1.00 0.00 O ATOM 391 CB ASN A 25 23.420 25.541 11.360 1.00 0.00 C ATOM 392 CG ASN A 25 23.636 25.138 9.913 1.00 0.00 C ATOM 393 OD1 ASN A 25 24.120 24.054 9.574 1.00 0.00 O ATOM 394 ND2 ASN A 25 23.259 25.930 8.915 1.00 0.00 N ATOM 0 H ASN A 25 24.270 23.420 12.554 1.00 0.00 H new ATOM 0 HA ASN A 25 25.518 25.760 11.659 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.640 24.908 11.784 1.00 0.00 H new ATOM 0 HB3 ASN A 25 23.047 26.565 11.383 1.00 0.00 H new ATOM 0 HD21 ASN A 25 23.379 25.625 7.949 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.850 26.843 9.115 1.00 0.00 H new ATOM 401 N VAL A 26 24.213 25.926 14.636 1.00 0.00 N ATOM 402 CA VAL A 26 24.641 26.600 15.837 1.00 0.00 C ATOM 403 C VAL A 26 26.111 27.010 15.850 1.00 0.00 C ATOM 404 O VAL A 26 26.402 28.202 15.988 1.00 0.00 O ATOM 405 CB VAL A 26 24.121 25.863 17.082 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.578 26.454 18.412 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.620 25.571 17.139 1.00 0.00 C ATOM 0 H VAL A 26 23.693 25.063 14.795 1.00 0.00 H new ATOM 0 HA VAL A 26 24.166 27.581 15.858 1.00 0.00 H new ATOM 0 HB VAL A 26 24.610 24.899 16.940 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.162 25.869 19.232 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.666 26.431 18.465 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.232 27.485 18.490 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.386 25.049 18.067 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.065 26.508 17.100 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.338 24.948 16.291 1.00 0.00 H new ATOM 417 N LYS A 27 27.073 26.095 15.793 1.00 0.00 N ATOM 418 CA LYS A 27 28.500 26.372 15.877 1.00 0.00 C ATOM 419 C LYS A 27 29.086 27.119 14.681 1.00 0.00 C ATOM 420 O LYS A 27 29.943 27.973 14.903 1.00 0.00 O ATOM 421 CB LYS A 27 29.170 25.001 15.901 1.00 0.00 C ATOM 422 CG LYS A 27 28.755 24.227 17.153 1.00 0.00 C ATOM 423 CD LYS A 27 28.829 22.701 17.081 1.00 0.00 C ATOM 424 CE LYS A 27 30.257 22.191 16.898 1.00 0.00 C ATOM 425 NZ LYS A 27 30.300 20.724 16.961 1.00 0.00 N ATOM 0 H LYS A 27 26.870 25.101 15.683 1.00 0.00 H new ATOM 0 HA LYS A 27 28.666 27.005 16.749 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.893 24.438 15.009 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.253 25.118 15.881 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.383 24.558 17.980 1.00 0.00 H new ATOM 0 HG3 LYS A 27 27.730 24.505 17.400 1.00 0.00 H new ATOM 0 HD2 LYS A 27 28.410 22.277 17.993 1.00 0.00 H new ATOM 0 HD3 LYS A 27 28.213 22.350 16.254 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.649 22.530 15.939 1.00 0.00 H new ATOM 0 HE3 LYS A 27 30.900 22.612 17.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 31.280 20.400 16.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 29.947 20.406 17.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 29.704 20.327 16.207 1.00 0.00 H new ATOM 439 N ALA A 28 28.669 26.848 13.443 1.00 0.00 N ATOM 440 CA ALA A 28 28.973 27.520 12.202 1.00 0.00 C ATOM 441 C ALA A 28 28.625 29.008 12.136 1.00 0.00 C ATOM 442 O ALA A 28 29.392 29.767 11.541 1.00 0.00 O ATOM 443 CB ALA A 28 28.369 26.824 10.988 1.00 0.00 C ATOM 0 H ALA A 28 28.040 26.062 13.280 1.00 0.00 H new ATOM 0 HA ALA A 28 30.061 27.454 12.176 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.631 27.375 10.085 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.759 25.808 10.920 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.284 26.790 11.090 1.00 0.00 H new ATOM 449 N LYS A 29 27.495 29.385 12.730 1.00 0.00 N ATOM 450 CA LYS A 29 27.298 30.794 13.022 1.00 0.00 C ATOM 451 C LYS A 29 28.420 31.533 13.751 1.00 0.00 C ATOM 452 O LYS A 29 28.535 32.748 13.580 1.00 0.00 O ATOM 453 CB LYS A 29 25.943 30.998 13.694 1.00 0.00 C ATOM 454 CG LYS A 29 24.779 31.154 12.727 1.00 0.00 C ATOM 455 CD LYS A 29 23.432 31.155 13.460 1.00 0.00 C ATOM 456 CE LYS A 29 22.258 31.109 12.471 1.00 0.00 C ATOM 457 NZ LYS A 29 21.863 32.455 12.011 1.00 0.00 N ATOM 0 H LYS A 29 26.735 28.763 13.007 1.00 0.00 H new ATOM 0 HA LYS A 29 27.323 31.276 12.045 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.744 30.149 14.349 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.995 31.884 14.327 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.891 32.084 12.169 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.798 30.342 12.000 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.380 30.297 14.130 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.353 32.048 14.080 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.534 30.499 11.611 1.00 0.00 H new ATOM 0 HE3 LYS A 29 21.405 30.624 12.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.068 32.375 11.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 21.574 33.030 12.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 22.668 32.909 11.535 1.00 0.00 H new ATOM 471 N ILE A 30 29.121 30.928 14.714 1.00 0.00 N ATOM 472 CA ILE A 30 30.087 31.615 15.545 1.00 0.00 C ATOM 473 C ILE A 30 31.288 31.970 14.665 1.00 0.00 C ATOM 474 O ILE A 30 32.097 32.844 14.959 1.00 0.00 O ATOM 475 CB ILE A 30 30.379 30.781 16.796 1.00 0.00 C ATOM 476 CG1 ILE A 30 29.206 30.535 17.746 1.00 0.00 C ATOM 477 CG2 ILE A 30 31.584 31.194 17.641 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.692 31.842 18.332 1.00 0.00 C ATOM 0 H ILE A 30 29.025 29.936 14.933 1.00 0.00 H new ATOM 0 HA ILE A 30 29.717 32.560 15.944 1.00 0.00 H new ATOM 0 HB ILE A 30 30.621 29.848 16.286 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.401 30.031 17.212 1.00 0.00 H new ATOM 0 HG13 ILE A 30 29.519 29.870 18.551 1.00 0.00 H new ATOM 0 HG21 ILE A 30 31.677 30.522 18.494 1.00 0.00 H new ATOM 0 HG22 ILE A 30 32.489 31.139 17.036 1.00 0.00 H new ATOM 0 HG23 ILE A 30 31.446 32.215 17.996 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.858 31.637 19.004 1.00 0.00 H new ATOM 0 HD12 ILE A 30 29.492 32.332 18.886 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.357 32.495 17.526 1.00 0.00 H new ATOM 490 N GLN A 31 31.414 31.425 13.464 1.00 0.00 N ATOM 491 CA GLN A 31 32.393 31.805 12.460 1.00 0.00 C ATOM 492 C GLN A 31 32.231 33.252 11.988 1.00 0.00 C ATOM 493 O GLN A 31 33.138 34.071 11.905 1.00 0.00 O ATOM 494 CB GLN A 31 32.408 30.992 11.155 1.00 0.00 C ATOM 495 CG GLN A 31 33.556 31.110 10.157 1.00 0.00 C ATOM 496 CD GLN A 31 34.954 30.752 10.630 1.00 0.00 C ATOM 497 OE1 GLN A 31 35.482 31.322 11.587 1.00 0.00 O ATOM 498 NE2 GLN A 31 35.623 29.812 9.958 1.00 0.00 N ATOM 0 H GLN A 31 30.806 30.669 13.149 1.00 0.00 H new ATOM 0 HA GLN A 31 33.312 31.620 13.016 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.338 29.941 11.435 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.493 31.240 10.617 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.321 30.477 9.302 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.579 32.138 9.795 1.00 0.00 H new ATOM 0 HE21 GLN A 31 35.184 29.341 9.166 1.00 0.00 H new ATOM 0 HE22 GLN A 31 36.573 29.564 10.236 1.00 0.00 H new ATOM 507 N ASP A 32 30.972 33.613 11.766 1.00 0.00 N ATOM 508 CA ASP A 32 30.643 34.915 11.227 1.00 0.00 C ATOM 509 C ASP A 32 30.602 35.961 12.346 1.00 0.00 C ATOM 510 O ASP A 32 31.017 37.104 12.139 1.00 0.00 O ATOM 511 CB ASP A 32 29.308 34.861 10.488 1.00 0.00 C ATOM 512 CG ASP A 32 28.834 36.102 9.749 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.592 36.461 8.827 1.00 0.00 O ATOM 514 OD2 ASP A 32 27.825 36.729 10.147 1.00 0.00 O ATOM 0 H ASP A 32 30.166 33.017 11.953 1.00 0.00 H new ATOM 0 HA ASP A 32 31.417 35.205 10.516 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.362 34.046 9.766 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.539 34.594 11.213 1.00 0.00 H new ATOM 519 N LYS A 33 30.202 35.620 13.569 1.00 0.00 N ATOM 520 CA LYS A 33 30.380 36.507 14.695 1.00 0.00 C ATOM 521 C LYS A 33 31.853 36.490 15.103 1.00 0.00 C ATOM 522 O LYS A 33 32.487 37.537 15.042 1.00 0.00 O ATOM 523 CB LYS A 33 29.384 36.102 15.788 1.00 0.00 C ATOM 524 CG LYS A 33 27.883 36.005 15.504 1.00 0.00 C ATOM 525 CD LYS A 33 27.134 37.303 15.239 1.00 0.00 C ATOM 526 CE LYS A 33 25.637 37.117 15.040 1.00 0.00 C ATOM 527 NZ LYS A 33 24.978 38.432 14.878 1.00 0.00 N ATOM 0 H LYS A 33 29.753 34.733 13.796 1.00 0.00 H new ATOM 0 HA LYS A 33 30.157 37.548 14.461 1.00 0.00 H new ATOM 0 HB2 LYS A 33 29.700 35.127 16.160 1.00 0.00 H new ATOM 0 HB3 LYS A 33 29.507 36.811 16.607 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.745 35.355 14.640 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.411 35.511 16.353 1.00 0.00 H new ATOM 0 HD2 LYS A 33 27.298 37.984 16.074 1.00 0.00 H new ATOM 0 HD3 LYS A 33 27.553 37.779 14.352 1.00 0.00 H new ATOM 0 HE2 LYS A 33 25.453 36.499 14.161 1.00 0.00 H new ATOM 0 HE3 LYS A 33 25.211 36.591 15.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 23.956 38.294 14.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.140 39.009 15.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 25.374 38.919 14.049 1.00 0.00 H new ATOM 541 N GLU A 34 32.473 35.443 15.630 1.00 0.00 N ATOM 542 CA GLU A 34 33.651 35.444 16.471 1.00 0.00 C ATOM 543 C GLU A 34 34.952 35.036 15.791 1.00 0.00 C ATOM 544 O GLU A 34 36.086 35.298 16.179 1.00 0.00 O ATOM 545 CB GLU A 34 33.493 34.472 17.635 1.00 0.00 C ATOM 546 CG GLU A 34 32.442 34.866 18.684 1.00 0.00 C ATOM 547 CD GLU A 34 32.803 36.042 19.580 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.821 35.957 20.301 1.00 0.00 O ATOM 549 OE2 GLU A 34 32.011 37.009 19.588 1.00 0.00 O ATOM 0 H GLU A 34 32.133 34.496 15.463 1.00 0.00 H new ATOM 0 HA GLU A 34 33.724 36.488 16.775 1.00 0.00 H new ATOM 0 HB2 GLU A 34 33.233 33.492 17.235 1.00 0.00 H new ATOM 0 HB3 GLU A 34 34.457 34.368 18.133 1.00 0.00 H new ATOM 0 HG2 GLU A 34 31.512 35.101 18.167 1.00 0.00 H new ATOM 0 HG3 GLU A 34 32.246 34.000 19.316 1.00 0.00 H new ATOM 556 N GLY A 35 34.791 34.278 14.702 1.00 0.00 N ATOM 557 CA GLY A 35 35.875 33.912 13.807 1.00 0.00 C ATOM 558 C GLY A 35 36.365 32.508 14.182 1.00 0.00 C ATOM 559 O GLY A 35 37.544 32.253 13.953 1.00 0.00 O ATOM 0 H GLY A 35 33.887 33.899 14.420 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.534 33.930 12.772 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.690 34.631 13.886 1.00 0.00 H new ATOM 563 N ILE A 36 35.504 31.684 14.788 1.00 0.00 N ATOM 564 CA ILE A 36 35.890 30.402 15.314 1.00 0.00 C ATOM 565 C ILE A 36 35.283 29.368 14.367 1.00 0.00 C ATOM 566 O ILE A 36 34.096 29.411 14.059 1.00 0.00 O ATOM 567 CB ILE A 36 35.313 30.135 16.711 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.616 31.272 17.682 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.803 28.849 17.364 1.00 0.00 C ATOM 570 CD1 ILE A 36 37.032 31.410 18.246 1.00 0.00 C ATOM 0 H ILE A 36 34.517 31.904 14.920 1.00 0.00 H new ATOM 0 HA ILE A 36 36.976 30.360 15.393 1.00 0.00 H new ATOM 0 HB ILE A 36 34.243 30.045 16.526 1.00 0.00 H new ATOM 0 HG12 ILE A 36 35.369 32.208 17.180 1.00 0.00 H new ATOM 0 HG13 ILE A 36 34.934 31.174 18.526 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.344 28.742 18.347 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.529 27.997 16.741 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.887 28.886 17.472 1.00 0.00 H new ATOM 0 HD11 ILE A 36 37.074 32.267 18.918 1.00 0.00 H new ATOM 0 HD12 ILE A 36 37.295 30.506 18.795 1.00 0.00 H new ATOM 0 HD13 ILE A 36 37.737 31.555 17.428 1.00 0.00 H new ATOM 582 N PRO A 37 36.056 28.405 13.872 1.00 0.00 N ATOM 583 CA PRO A 37 35.516 27.283 13.131 1.00 0.00 C ATOM 584 C PRO A 37 34.734 26.329 14.036 1.00 0.00 C ATOM 585 O PRO A 37 34.771 26.401 15.260 1.00 0.00 O ATOM 586 CB PRO A 37 36.709 26.669 12.404 1.00 0.00 C ATOM 587 CG PRO A 37 37.945 27.065 13.225 1.00 0.00 C ATOM 588 CD PRO A 37 37.509 28.400 13.801 1.00 0.00 C ATOM 0 HA PRO A 37 34.764 27.577 12.399 1.00 0.00 H new ATOM 0 HB2 PRO A 37 36.613 25.585 12.340 1.00 0.00 H new ATOM 0 HB3 PRO A 37 36.781 27.044 11.383 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.171 26.336 14.003 1.00 0.00 H new ATOM 0 HG3 PRO A 37 38.837 27.157 12.605 1.00 0.00 H new ATOM 0 HD2 PRO A 37 37.940 28.547 14.792 1.00 0.00 H new ATOM 0 HD3 PRO A 37 37.863 29.219 13.175 1.00 0.00 H new ATOM 596 N PRO A 38 33.927 25.400 13.522 1.00 0.00 N ATOM 597 CA PRO A 38 33.127 24.425 14.243 1.00 0.00 C ATOM 598 C PRO A 38 33.880 23.289 14.945 1.00 0.00 C ATOM 599 O PRO A 38 33.494 23.014 16.077 1.00 0.00 O ATOM 600 CB PRO A 38 32.129 23.792 13.275 1.00 0.00 C ATOM 601 CG PRO A 38 32.919 23.883 11.965 1.00 0.00 C ATOM 602 CD PRO A 38 33.709 25.182 12.107 1.00 0.00 C ATOM 0 HA PRO A 38 32.664 25.002 15.044 1.00 0.00 H new ATOM 0 HB2 PRO A 38 31.886 22.764 13.543 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.188 24.341 13.231 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.579 23.025 11.835 1.00 0.00 H new ATOM 0 HG3 PRO A 38 32.257 23.910 11.099 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.659 25.114 11.578 1.00 0.00 H new ATOM 0 HD3 PRO A 38 33.160 26.016 11.670 1.00 0.00 H new ATOM 610 N ASP A 39 34.937 22.771 14.338 1.00 0.00 N ATOM 611 CA ASP A 39 35.775 21.675 14.787 1.00 0.00 C ATOM 612 C ASP A 39 36.398 21.894 16.167 1.00 0.00 C ATOM 613 O ASP A 39 36.657 20.912 16.854 1.00 0.00 O ATOM 614 CB ASP A 39 36.868 21.275 13.794 1.00 0.00 C ATOM 615 CG ASP A 39 36.415 21.097 12.345 1.00 0.00 C ATOM 616 OD1 ASP A 39 35.893 22.055 11.754 1.00 0.00 O ATOM 617 OD2 ASP A 39 36.619 19.995 11.797 1.00 0.00 O ATOM 0 H ASP A 39 35.256 23.140 13.442 1.00 0.00 H new ATOM 0 HA ASP A 39 35.069 20.848 14.860 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.651 22.032 13.820 1.00 0.00 H new ATOM 0 HB3 ASP A 39 37.316 20.341 14.132 1.00 0.00 H new ATOM 622 N GLN A 40 36.505 23.134 16.640 1.00 0.00 N ATOM 623 CA GLN A 40 37.106 23.587 17.876 1.00 0.00 C ATOM 624 C GLN A 40 36.156 23.785 19.059 1.00 0.00 C ATOM 625 O GLN A 40 36.564 24.176 20.148 1.00 0.00 O ATOM 626 CB GLN A 40 37.710 24.948 17.533 1.00 0.00 C ATOM 627 CG GLN A 40 38.684 24.788 16.362 1.00 0.00 C ATOM 628 CD GLN A 40 39.704 25.911 16.270 1.00 0.00 C ATOM 629 OE1 GLN A 40 39.626 27.012 16.796 1.00 0.00 O ATOM 630 NE2 GLN A 40 40.805 25.468 15.665 1.00 0.00 N ATOM 0 H GLN A 40 36.133 23.920 16.107 1.00 0.00 H new ATOM 0 HA GLN A 40 37.803 22.818 18.208 1.00 0.00 H new ATOM 0 HB2 GLN A 40 36.921 25.653 17.271 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.229 25.357 18.400 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.208 23.838 16.462 1.00 0.00 H new ATOM 0 HG3 GLN A 40 38.118 24.743 15.431 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.816 24.540 15.242 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.637 26.057 15.625 1.00 0.00 H new ATOM 639 N GLN A 41 34.850 23.717 18.810 1.00 0.00 N ATOM 640 CA GLN A 41 33.793 24.028 19.740 1.00 0.00 C ATOM 641 C GLN A 41 33.315 22.724 20.401 1.00 0.00 C ATOM 642 O GLN A 41 32.965 21.843 19.624 1.00 0.00 O ATOM 643 CB GLN A 41 32.656 24.711 18.975 1.00 0.00 C ATOM 644 CG GLN A 41 33.068 26.113 18.524 1.00 0.00 C ATOM 645 CD GLN A 41 31.935 26.671 17.664 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.828 26.860 18.159 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.238 27.121 16.453 1.00 0.00 N ATOM 0 H GLN A 41 34.492 23.426 17.900 1.00 0.00 H new ATOM 0 HA GLN A 41 34.143 24.703 20.521 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.384 24.110 18.107 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.772 24.774 19.609 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.247 26.756 19.386 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.997 26.075 17.956 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.165 26.951 16.063 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.544 27.637 15.912 1.00 0.00 H new ATOM 656 N ARG A 42 33.146 22.680 21.713 1.00 0.00 N ATOM 657 CA ARG A 42 32.728 21.531 22.496 1.00 0.00 C ATOM 658 C ARG A 42 31.415 21.890 23.197 1.00 0.00 C ATOM 659 O ARG A 42 31.438 22.708 24.113 1.00 0.00 O ATOM 660 CB ARG A 42 33.941 21.212 23.366 1.00 0.00 C ATOM 661 CG ARG A 42 33.725 19.896 24.114 1.00 0.00 C ATOM 662 CD ARG A 42 34.928 19.600 25.002 1.00 0.00 C ATOM 663 NE ARG A 42 34.928 18.242 25.559 1.00 0.00 N ATOM 664 CZ ARG A 42 35.480 17.901 26.722 1.00 0.00 C ATOM 665 NH1 ARG A 42 36.405 18.709 27.268 1.00 0.00 N ATOM 666 NH2 ARG A 42 35.044 16.791 27.319 1.00 0.00 N ATOM 0 H ARG A 42 33.308 23.501 22.296 1.00 0.00 H new ATOM 0 HA ARG A 42 32.477 20.621 21.952 1.00 0.00 H new ATOM 0 HB2 ARG A 42 34.834 21.143 22.745 1.00 0.00 H new ATOM 0 HB3 ARG A 42 34.109 22.020 24.078 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.821 19.956 24.720 1.00 0.00 H new ATOM 0 HG3 ARG A 42 33.578 19.083 23.403 1.00 0.00 H new ATOM 0 HD2 ARG A 42 35.840 19.746 24.424 1.00 0.00 H new ATOM 0 HD3 ARG A 42 34.950 20.319 25.821 1.00 0.00 H new ATOM 0 HE ARG A 42 34.473 17.507 25.017 1.00 0.00 H new ATOM 0 HH11 ARG A 42 36.675 19.570 26.792 1.00 0.00 H new ATOM 0 HH12 ARG A 42 36.837 18.461 28.158 1.00 0.00 H new ATOM 0 HH21 ARG A 42 34.310 16.233 26.884 1.00 0.00 H new ATOM 0 HH22 ARG A 42 35.445 16.500 28.211 1.00 0.00 H new ATOM 680 N LEU A 43 30.337 21.341 22.658 1.00 0.00 N ATOM 681 CA LEU A 43 28.964 21.643 23.009 1.00 0.00 C ATOM 682 C LEU A 43 28.534 20.530 23.981 1.00 0.00 C ATOM 683 O LEU A 43 28.523 19.338 23.680 1.00 0.00 O ATOM 684 CB LEU A 43 28.042 21.681 21.788 1.00 0.00 C ATOM 685 CG LEU A 43 26.924 22.705 21.920 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.250 23.105 20.606 1.00 0.00 C ATOM 687 CD2 LEU A 43 25.893 22.315 22.987 1.00 0.00 C ATOM 0 H LEU A 43 30.404 20.635 21.925 1.00 0.00 H new ATOM 0 HA LEU A 43 28.892 22.635 23.456 1.00 0.00 H new ATOM 0 HB2 LEU A 43 28.633 21.908 20.900 1.00 0.00 H new ATOM 0 HB3 LEU A 43 27.607 20.693 21.637 1.00 0.00 H new ATOM 0 HG LEU A 43 27.436 23.606 22.258 1.00 0.00 H new ATOM 0 HD11 LEU A 43 25.468 23.838 20.806 1.00 0.00 H new ATOM 0 HD12 LEU A 43 26.991 23.539 19.934 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.810 22.223 20.140 1.00 0.00 H new ATOM 0 HD21 LEU A 43 25.118 23.079 23.040 1.00 0.00 H new ATOM 0 HD22 LEU A 43 25.442 21.358 22.724 1.00 0.00 H new ATOM 0 HD23 LEU A 43 26.386 22.230 23.955 1.00 0.00 H new ATOM 699 N ILE A 44 28.177 20.881 25.209 1.00 0.00 N ATOM 700 CA ILE A 44 27.713 20.009 26.266 1.00 0.00 C ATOM 701 C ILE A 44 26.289 20.490 26.541 1.00 0.00 C ATOM 702 O ILE A 44 26.070 21.679 26.305 1.00 0.00 O ATOM 703 CB ILE A 44 28.577 20.205 27.519 1.00 0.00 C ATOM 704 CG1 ILE A 44 30.054 20.261 27.145 1.00 0.00 C ATOM 705 CG2 ILE A 44 28.219 19.194 28.607 1.00 0.00 C ATOM 706 CD1 ILE A 44 31.030 20.141 28.317 1.00 0.00 C ATOM 0 H ILE A 44 28.209 21.855 25.509 1.00 0.00 H new ATOM 0 HA ILE A 44 27.762 18.954 25.998 1.00 0.00 H new ATOM 0 HB ILE A 44 28.357 21.173 27.969 1.00 0.00 H new ATOM 0 HG12 ILE A 44 30.263 19.460 26.436 1.00 0.00 H new ATOM 0 HG13 ILE A 44 30.246 21.202 26.629 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.850 19.361 29.480 1.00 0.00 H new ATOM 0 HG22 ILE A 44 27.172 19.316 28.886 1.00 0.00 H new ATOM 0 HG23 ILE A 44 28.379 18.183 28.231 1.00 0.00 H new ATOM 0 HD11 ILE A 44 32.053 20.192 27.945 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.858 20.957 29.019 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.875 19.188 28.823 1.00 0.00 H new ATOM 718 N PHE A 45 25.384 19.618 26.971 1.00 0.00 N ATOM 719 CA PHE A 45 24.092 19.972 27.523 1.00 0.00 C ATOM 720 C PHE A 45 23.468 18.700 28.101 1.00 0.00 C ATOM 721 O PHE A 45 23.482 17.610 27.537 1.00 0.00 O ATOM 722 CB PHE A 45 23.158 20.707 26.552 1.00 0.00 C ATOM 723 CG PHE A 45 21.704 20.941 26.885 1.00 0.00 C ATOM 724 CD1 PHE A 45 21.369 21.742 27.985 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.687 20.486 26.037 1.00 0.00 C ATOM 726 CE1 PHE A 45 20.063 22.123 28.311 1.00 0.00 C ATOM 727 CE2 PHE A 45 19.379 20.876 26.323 1.00 0.00 C ATOM 728 CZ PHE A 45 19.081 21.742 27.384 1.00 0.00 C ATOM 0 H PHE A 45 25.540 18.611 26.941 1.00 0.00 H new ATOM 0 HA PHE A 45 24.246 20.710 28.310 1.00 0.00 H new ATOM 0 HB2 PHE A 45 23.602 21.685 26.364 1.00 0.00 H new ATOM 0 HB3 PHE A 45 23.184 20.158 25.610 1.00 0.00 H new ATOM 0 HD1 PHE A 45 22.170 22.087 28.622 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.908 19.854 25.190 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.828 22.671 29.211 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.573 20.500 25.710 1.00 0.00 H new ATOM 0 HZ PHE A 45 18.076 22.123 27.490 1.00 0.00 H new ATOM 738 N ALA A 46 22.874 18.868 29.274 1.00 0.00 N ATOM 739 CA ALA A 46 22.210 17.862 30.077 1.00 0.00 C ATOM 740 C ALA A 46 23.075 16.733 30.653 1.00 0.00 C ATOM 741 O ALA A 46 22.719 15.554 30.556 1.00 0.00 O ATOM 742 CB ALA A 46 20.970 17.306 29.375 1.00 0.00 C ATOM 0 H ALA A 46 22.844 19.785 29.720 1.00 0.00 H new ATOM 0 HA ALA A 46 21.916 18.424 30.963 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.500 16.554 30.009 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.265 18.115 29.187 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.261 16.852 28.428 1.00 0.00 H new ATOM 748 N GLY A 47 24.340 17.042 30.895 1.00 0.00 N ATOM 749 CA GLY A 47 25.263 16.118 31.520 1.00 0.00 C ATOM 750 C GLY A 47 26.103 15.314 30.532 1.00 0.00 C ATOM 751 O GLY A 47 26.940 14.554 31.016 1.00 0.00 O ATOM 0 H GLY A 47 24.753 17.945 30.661 1.00 0.00 H new ATOM 0 HA2 GLY A 47 25.930 16.676 32.178 1.00 0.00 H new ATOM 0 HA3 GLY A 47 24.700 15.428 32.148 1.00 0.00 H new ATOM 755 N LYS A 48 25.807 15.478 29.240 1.00 0.00 N ATOM 756 CA LYS A 48 26.376 14.768 28.118 1.00 0.00 C ATOM 757 C LYS A 48 26.955 15.712 27.054 1.00 0.00 C ATOM 758 O LYS A 48 26.478 16.834 26.896 1.00 0.00 O ATOM 759 CB LYS A 48 25.275 13.956 27.437 1.00 0.00 C ATOM 760 CG LYS A 48 24.455 13.215 28.489 1.00 0.00 C ATOM 761 CD LYS A 48 23.266 12.372 28.029 1.00 0.00 C ATOM 762 CE LYS A 48 22.349 12.016 29.201 1.00 0.00 C ATOM 763 NZ LYS A 48 21.230 11.123 28.905 1.00 0.00 N ATOM 0 H LYS A 48 25.112 16.162 28.942 1.00 0.00 H new ATOM 0 HA LYS A 48 27.178 14.143 28.511 1.00 0.00 H new ATOM 0 HB2 LYS A 48 24.629 14.616 26.857 1.00 0.00 H new ATOM 0 HB3 LYS A 48 25.714 13.245 26.738 1.00 0.00 H new ATOM 0 HG2 LYS A 48 25.133 12.560 29.036 1.00 0.00 H new ATOM 0 HG3 LYS A 48 24.082 13.953 29.199 1.00 0.00 H new ATOM 0 HD2 LYS A 48 22.700 12.919 27.275 1.00 0.00 H new ATOM 0 HD3 LYS A 48 23.627 11.458 27.556 1.00 0.00 H new ATOM 0 HE2 LYS A 48 22.955 11.556 29.981 1.00 0.00 H new ATOM 0 HE3 LYS A 48 21.947 12.942 29.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 20.682 10.954 29.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 20.617 11.560 28.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 21.594 10.218 28.544 1.00 0.00 H new ATOM 777 N GLN A 49 28.020 15.293 26.372 1.00 0.00 N ATOM 778 CA GLN A 49 28.519 15.850 25.132 1.00 0.00 C ATOM 779 C GLN A 49 27.589 15.617 23.943 1.00 0.00 C ATOM 780 O GLN A 49 27.158 14.479 23.773 1.00 0.00 O ATOM 781 CB GLN A 49 29.919 15.312 24.826 1.00 0.00 C ATOM 782 CG GLN A 49 30.535 15.848 23.532 1.00 0.00 C ATOM 783 CD GLN A 49 32.052 15.775 23.584 1.00 0.00 C ATOM 784 OE1 GLN A 49 32.731 16.646 24.134 1.00 0.00 O ATOM 785 NE2 GLN A 49 32.697 14.770 23.002 1.00 0.00 N ATOM 0 H GLN A 49 28.586 14.509 26.696 1.00 0.00 H new ATOM 0 HA GLN A 49 28.566 16.929 25.280 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.579 15.559 25.657 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.872 14.225 24.768 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.168 15.271 22.683 1.00 0.00 H new ATOM 0 HG3 GLN A 49 30.222 16.880 23.375 1.00 0.00 H new ATOM 0 HE21 GLN A 49 32.173 14.029 22.536 1.00 0.00 H new ATOM 0 HE22 GLN A 49 33.716 14.739 23.021 1.00 0.00 H new ATOM 794 N LEU A 50 27.315 16.608 23.091 1.00 0.00 N ATOM 795 CA LEU A 50 26.485 16.489 21.910 1.00 0.00 C ATOM 796 C LEU A 50 27.471 16.185 20.778 1.00 0.00 C ATOM 797 O LEU A 50 28.061 17.140 20.280 1.00 0.00 O ATOM 798 CB LEU A 50 25.707 17.794 21.713 1.00 0.00 C ATOM 799 CG LEU A 50 24.421 18.080 22.491 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.716 18.326 23.976 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.746 19.339 21.956 1.00 0.00 C ATOM 0 H LEU A 50 27.685 17.550 23.219 1.00 0.00 H new ATOM 0 HA LEU A 50 25.730 15.705 21.966 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.397 18.610 21.929 1.00 0.00 H new ATOM 0 HB3 LEU A 50 25.458 17.858 20.654 1.00 0.00 H new ATOM 0 HG LEU A 50 23.777 17.209 22.372 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.784 18.527 24.504 1.00 0.00 H new ATOM 0 HD12 LEU A 50 25.192 17.444 24.403 1.00 0.00 H new ATOM 0 HD13 LEU A 50 25.382 19.183 24.078 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.833 19.529 22.519 1.00 0.00 H new ATOM 0 HD22 LEU A 50 24.422 20.188 22.063 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.501 19.201 20.903 1.00 0.00 H new ATOM 813 N GLU A 51 27.566 14.923 20.373 1.00 0.00 N ATOM 814 CA GLU A 51 28.583 14.576 19.398 1.00 0.00 C ATOM 815 C GLU A 51 28.275 14.962 17.954 1.00 0.00 C ATOM 816 O GLU A 51 29.122 14.900 17.063 1.00 0.00 O ATOM 817 CB GLU A 51 28.927 13.089 19.484 1.00 0.00 C ATOM 818 CG GLU A 51 29.814 12.681 20.656 1.00 0.00 C ATOM 819 CD GLU A 51 31.304 12.909 20.398 1.00 0.00 C ATOM 820 OE1 GLU A 51 31.741 13.918 19.816 1.00 0.00 O ATOM 821 OE2 GLU A 51 31.997 12.054 20.988 1.00 0.00 O ATOM 0 H GLU A 51 26.976 14.154 20.691 1.00 0.00 H new ATOM 0 HA GLU A 51 29.443 15.186 19.675 1.00 0.00 H new ATOM 0 HB2 GLU A 51 27.997 12.523 19.542 1.00 0.00 H new ATOM 0 HB3 GLU A 51 29.422 12.795 18.558 1.00 0.00 H new ATOM 0 HG2 GLU A 51 29.516 13.243 21.541 1.00 0.00 H new ATOM 0 HG3 GLU A 51 29.648 11.627 20.878 1.00 0.00 H new ATOM 828 N ASP A 52 27.019 15.259 17.634 1.00 0.00 N ATOM 829 CA ASP A 52 26.510 15.682 16.342 1.00 0.00 C ATOM 830 C ASP A 52 25.773 14.553 15.614 1.00 0.00 C ATOM 831 O ASP A 52 26.115 13.380 15.654 1.00 0.00 O ATOM 832 CB ASP A 52 27.320 16.694 15.529 1.00 0.00 C ATOM 833 CG ASP A 52 26.650 17.226 14.270 1.00 0.00 C ATOM 834 OD1 ASP A 52 25.427 17.483 14.240 1.00 0.00 O ATOM 835 OD2 ASP A 52 27.315 17.578 13.275 1.00 0.00 O ATOM 0 H ASP A 52 26.275 15.204 18.330 1.00 0.00 H new ATOM 0 HA ASP A 52 25.725 16.403 16.571 1.00 0.00 H new ATOM 0 HB2 ASP A 52 27.561 17.539 16.174 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.265 16.230 15.246 1.00 0.00 H new ATOM 840 N GLY A 53 24.738 14.946 14.876 1.00 0.00 N ATOM 841 CA GLY A 53 24.039 14.030 13.992 1.00 0.00 C ATOM 842 C GLY A 53 22.538 14.307 14.065 1.00 0.00 C ATOM 843 O GLY A 53 21.799 13.805 13.227 1.00 0.00 O ATOM 0 H GLY A 53 24.367 15.896 14.876 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.394 14.152 12.969 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.245 12.999 14.280 1.00 0.00 H new ATOM 847 N ARG A 54 22.095 15.163 14.985 1.00 0.00 N ATOM 848 CA ARG A 54 20.701 15.347 15.339 1.00 0.00 C ATOM 849 C ARG A 54 20.444 16.808 15.681 1.00 0.00 C ATOM 850 O ARG A 54 21.301 17.536 16.181 1.00 0.00 O ATOM 851 CB ARG A 54 20.160 14.262 16.263 1.00 0.00 C ATOM 852 CG ARG A 54 19.770 12.963 15.561 1.00 0.00 C ATOM 853 CD ARG A 54 19.078 11.944 16.472 1.00 0.00 C ATOM 854 NE ARG A 54 17.648 12.248 16.512 1.00 0.00 N ATOM 855 CZ ARG A 54 16.786 11.528 17.244 1.00 0.00 C ATOM 856 NH1 ARG A 54 17.248 10.470 17.922 1.00 0.00 N ATOM 857 NH2 ARG A 54 15.507 11.919 17.332 1.00 0.00 N ATOM 0 H ARG A 54 22.723 15.764 15.518 1.00 0.00 H new ATOM 0 HA ARG A 54 20.058 15.169 14.477 1.00 0.00 H new ATOM 0 HB2 ARG A 54 20.913 14.039 17.019 1.00 0.00 H new ATOM 0 HB3 ARG A 54 19.288 14.652 16.787 1.00 0.00 H new ATOM 0 HG2 ARG A 54 19.108 13.197 14.727 1.00 0.00 H new ATOM 0 HG3 ARG A 54 20.666 12.508 15.139 1.00 0.00 H new ATOM 0 HD2 ARG A 54 19.239 10.933 16.099 1.00 0.00 H new ATOM 0 HD3 ARG A 54 19.502 11.985 17.476 1.00 0.00 H new ATOM 0 HE ARG A 54 17.295 13.033 15.965 1.00 0.00 H new ATOM 0 HH11 ARG A 54 18.237 10.227 17.875 1.00 0.00 H new ATOM 0 HH12 ARG A 54 16.611 9.907 18.486 1.00 0.00 H new ATOM 0 HH21 ARG A 54 15.196 12.759 16.844 1.00 0.00 H new ATOM 0 HH22 ARG A 54 14.845 11.377 17.887 1.00 0.00 H new ATOM 871 N THR A 55 19.187 17.178 15.449 1.00 0.00 N ATOM 872 CA THR A 55 18.772 18.568 15.460 1.00 0.00 C ATOM 873 C THR A 55 18.469 19.137 16.847 1.00 0.00 C ATOM 874 O THR A 55 18.405 18.347 17.784 1.00 0.00 O ATOM 875 CB THR A 55 17.578 18.617 14.504 1.00 0.00 C ATOM 876 OG1 THR A 55 16.431 17.897 14.873 1.00 0.00 O ATOM 877 CG2 THR A 55 17.970 18.094 13.117 1.00 0.00 C ATOM 0 H THR A 55 18.433 16.521 15.249 1.00 0.00 H new ATOM 0 HA THR A 55 19.585 19.219 15.138 1.00 0.00 H new ATOM 0 HB THR A 55 17.317 19.675 14.524 1.00 0.00 H new ATOM 0 HG1 THR A 55 16.575 16.943 14.704 1.00 0.00 H new ATOM 0 HG21 THR A 55 17.106 18.138 12.454 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.772 18.709 12.709 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.311 17.062 13.200 1.00 0.00 H new ATOM 885 N LEU A 56 18.316 20.453 16.938 1.00 0.00 N ATOM 886 CA LEU A 56 17.885 21.181 18.118 1.00 0.00 C ATOM 887 C LEU A 56 16.654 20.635 18.841 1.00 0.00 C ATOM 888 O LEU A 56 16.704 20.461 20.049 1.00 0.00 O ATOM 889 CB LEU A 56 17.785 22.684 17.853 1.00 0.00 C ATOM 890 CG LEU A 56 19.020 23.354 17.246 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.783 24.851 17.064 1.00 0.00 C ATOM 892 CD2 LEU A 56 20.142 23.094 18.243 1.00 0.00 C ATOM 0 H LEU A 56 18.500 21.070 16.147 1.00 0.00 H new ATOM 0 HA LEU A 56 18.687 21.008 18.835 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.940 22.857 17.186 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.555 23.182 18.795 1.00 0.00 H new ATOM 0 HG LEU A 56 19.259 22.960 16.258 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.672 25.310 16.631 1.00 0.00 H new ATOM 0 HD12 LEU A 56 17.934 25.007 16.399 1.00 0.00 H new ATOM 0 HD13 LEU A 56 18.574 25.307 18.032 1.00 0.00 H new ATOM 0 HD21 LEU A 56 21.065 23.545 17.878 1.00 0.00 H new ATOM 0 HD22 LEU A 56 19.881 23.531 19.207 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.284 22.020 18.359 1.00 0.00 H new ATOM 904 N SER A 57 15.619 20.186 18.122 1.00 0.00 N ATOM 905 CA SER A 57 14.479 19.406 18.585 1.00 0.00 C ATOM 906 C SER A 57 14.788 18.048 19.206 1.00 0.00 C ATOM 907 O SER A 57 14.296 17.791 20.311 1.00 0.00 O ATOM 908 CB SER A 57 13.421 19.398 17.479 1.00 0.00 C ATOM 909 OG SER A 57 13.881 18.917 16.241 1.00 0.00 O ATOM 0 H SER A 57 15.558 20.377 17.122 1.00 0.00 H new ATOM 0 HA SER A 57 14.071 19.906 19.464 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.579 18.787 17.803 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.045 20.412 17.344 1.00 0.00 H new ATOM 0 HG SER A 57 14.325 19.642 15.753 1.00 0.00 H new ATOM 915 N ASP A 58 15.485 17.203 18.452 1.00 0.00 N ATOM 916 CA ASP A 58 15.958 15.894 18.840 1.00 0.00 C ATOM 917 C ASP A 58 16.620 15.852 20.217 1.00 0.00 C ATOM 918 O ASP A 58 16.136 15.111 21.073 1.00 0.00 O ATOM 919 CB ASP A 58 16.933 15.320 17.819 1.00 0.00 C ATOM 920 CG ASP A 58 16.359 15.072 16.427 1.00 0.00 C ATOM 921 OD1 ASP A 58 15.272 14.473 16.313 1.00 0.00 O ATOM 922 OD2 ASP A 58 16.983 15.472 15.414 1.00 0.00 O ATOM 0 H ASP A 58 15.747 17.437 17.494 1.00 0.00 H new ATOM 0 HA ASP A 58 15.055 15.286 18.886 1.00 0.00 H new ATOM 0 HB2 ASP A 58 17.779 16.002 17.728 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.323 14.378 18.205 1.00 0.00 H new ATOM 927 N TYR A 59 17.666 16.653 20.417 1.00 0.00 N ATOM 928 CA TYR A 59 18.388 16.842 21.650 1.00 0.00 C ATOM 929 C TYR A 59 17.667 17.688 22.704 1.00 0.00 C ATOM 930 O TYR A 59 18.024 17.603 23.879 1.00 0.00 O ATOM 931 CB TYR A 59 19.759 17.446 21.368 1.00 0.00 C ATOM 932 CG TYR A 59 20.783 16.646 20.597 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.323 15.513 21.219 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.485 17.224 19.536 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.461 14.853 20.740 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.657 16.599 19.080 1.00 0.00 C ATOM 937 CZ TYR A 59 23.113 15.398 19.633 1.00 0.00 C ATOM 938 OH TYR A 59 24.209 14.794 19.085 1.00 0.00 O ATOM 0 H TYR A 59 18.049 17.221 19.661 1.00 0.00 H new ATOM 0 HA TYR A 59 18.476 15.844 22.080 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.599 18.379 20.827 1.00 0.00 H new ATOM 0 HB3 TYR A 59 20.204 17.706 22.328 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.840 15.132 22.107 1.00 0.00 H new ATOM 0 HD2 TYR A 59 21.133 18.135 19.075 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.823 13.951 21.212 1.00 0.00 H new ATOM 0 HE2 TYR A 59 23.221 17.058 18.281 1.00 0.00 H new ATOM 0 HH TYR A 59 24.253 15.002 18.128 1.00 0.00 H new ATOM 948 N ASN A 60 16.639 18.453 22.344 1.00 0.00 N ATOM 949 CA ASN A 60 15.634 19.098 23.156 1.00 0.00 C ATOM 950 C ASN A 60 16.064 20.505 23.566 1.00 0.00 C ATOM 951 O ASN A 60 16.183 20.785 24.752 1.00 0.00 O ATOM 952 CB ASN A 60 15.114 18.175 24.258 1.00 0.00 C ATOM 953 CG ASN A 60 13.796 18.666 24.861 1.00 0.00 C ATOM 954 OD1 ASN A 60 13.497 19.810 25.202 1.00 0.00 O ATOM 955 ND2 ASN A 60 12.915 17.715 25.116 1.00 0.00 N ATOM 0 H ASN A 60 16.481 18.653 21.356 1.00 0.00 H new ATOM 0 HA ASN A 60 14.741 19.279 22.558 1.00 0.00 H new ATOM 0 HB2 ASN A 60 14.973 17.173 23.852 1.00 0.00 H new ATOM 0 HB3 ASN A 60 15.863 18.097 25.046 1.00 0.00 H new ATOM 0 HD21 ASN A 60 12.034 17.946 25.576 1.00 0.00 H new ATOM 0 HD22 ASN A 60 13.116 16.750 24.853 1.00 0.00 H new ATOM 962 N ILE A 61 16.223 21.410 22.596 1.00 0.00 N ATOM 963 CA ILE A 61 16.618 22.770 22.913 1.00 0.00 C ATOM 964 C ILE A 61 15.488 23.682 22.431 1.00 0.00 C ATOM 965 O ILE A 61 15.108 23.579 21.272 1.00 0.00 O ATOM 966 CB ILE A 61 17.937 23.140 22.230 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.097 22.233 22.654 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.304 24.596 22.497 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.367 22.293 21.807 1.00 0.00 C ATOM 0 H ILE A 61 16.085 21.223 21.603 1.00 0.00 H new ATOM 0 HA ILE A 61 16.781 22.879 23.985 1.00 0.00 H new ATOM 0 HB ILE A 61 17.775 22.996 21.162 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.363 22.480 23.682 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.739 21.203 22.656 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.245 24.831 22.000 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.518 25.246 22.112 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.411 24.753 23.570 1.00 0.00 H new ATOM 0 HD11 ILE A 61 21.108 21.605 22.213 1.00 0.00 H new ATOM 0 HD12 ILE A 61 20.133 22.010 20.781 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.767 23.307 21.822 1.00 0.00 H new ATOM 981 N GLN A 62 15.068 24.574 23.312 1.00 0.00 N ATOM 982 CA GLN A 62 13.768 25.208 23.184 1.00 0.00 C ATOM 983 C GLN A 62 14.006 26.711 23.270 1.00 0.00 C ATOM 984 O GLN A 62 15.068 27.179 23.679 1.00 0.00 O ATOM 985 CB GLN A 62 12.980 24.842 24.446 1.00 0.00 C ATOM 986 CG GLN A 62 12.590 23.381 24.680 1.00 0.00 C ATOM 987 CD GLN A 62 11.473 22.931 23.748 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.624 23.652 23.233 1.00 0.00 O ATOM 989 NE2 GLN A 62 11.308 21.617 23.593 1.00 0.00 N ATOM 0 H GLN A 62 15.608 24.875 24.123 1.00 0.00 H new ATOM 0 HA GLN A 62 13.259 24.914 22.266 1.00 0.00 H new ATOM 0 HB2 GLN A 62 13.566 25.168 25.306 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.063 25.431 24.444 1.00 0.00 H new ATOM 0 HG2 GLN A 62 13.463 22.745 24.533 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.272 23.252 25.715 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.981 20.967 23.999 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.508 21.262 23.069 1.00 0.00 H new ATOM 998 N LYS A 63 12.994 27.483 22.872 1.00 0.00 N ATOM 999 CA LYS A 63 13.209 28.903 22.665 1.00 0.00 C ATOM 1000 C LYS A 63 13.662 29.575 23.970 1.00 0.00 C ATOM 1001 O LYS A 63 13.104 29.216 25.001 1.00 0.00 O ATOM 1002 CB LYS A 63 11.959 29.569 22.097 1.00 0.00 C ATOM 1003 CG LYS A 63 10.880 29.947 23.113 1.00 0.00 C ATOM 1004 CD LYS A 63 9.563 30.389 22.465 1.00 0.00 C ATOM 1005 CE LYS A 63 8.577 30.994 23.453 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.551 31.823 22.797 1.00 0.00 N ATOM 0 H LYS A 63 12.045 27.155 22.692 1.00 0.00 H new ATOM 0 HA LYS A 63 14.005 29.027 21.931 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.262 30.471 21.566 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.517 28.898 21.360 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.688 29.093 23.763 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.253 30.752 23.746 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.778 31.119 21.684 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.099 29.530 21.980 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.090 30.194 24.010 1.00 0.00 H new ATOM 0 HE3 LYS A 63 9.121 31.601 24.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.906 32.210 23.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 8.010 32.604 22.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.011 31.241 22.125 1.00 0.00 H new ATOM 1020 N GLU A 64 14.495 30.608 23.867 1.00 0.00 N ATOM 1021 CA GLU A 64 15.088 31.473 24.860 1.00 0.00 C ATOM 1022 C GLU A 64 15.939 30.692 25.852 1.00 0.00 C ATOM 1023 O GLU A 64 16.229 31.304 26.875 1.00 0.00 O ATOM 1024 CB GLU A 64 13.984 32.363 25.434 1.00 0.00 C ATOM 1025 CG GLU A 64 14.418 33.779 25.824 1.00 0.00 C ATOM 1026 CD GLU A 64 13.547 34.418 26.907 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.500 34.972 26.504 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.804 34.391 28.126 1.00 0.00 O ATOM 0 H GLU A 64 14.810 30.890 22.939 1.00 0.00 H new ATOM 0 HA GLU A 64 15.822 32.152 24.426 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.182 32.436 24.700 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.567 31.874 26.314 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.450 33.749 26.173 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.399 34.412 24.936 1.00 0.00 H new ATOM 1035 N SER A 65 16.417 29.469 25.601 1.00 0.00 N ATOM 1036 CA SER A 65 17.380 28.765 26.413 1.00 0.00 C ATOM 1037 C SER A 65 18.822 29.195 26.149 1.00 0.00 C ATOM 1038 O SER A 65 19.078 29.726 25.069 1.00 0.00 O ATOM 1039 CB SER A 65 17.209 27.258 26.216 1.00 0.00 C ATOM 1040 OG SER A 65 15.943 26.761 26.608 1.00 0.00 O ATOM 0 H SER A 65 16.122 28.930 24.787 1.00 0.00 H new ATOM 0 HA SER A 65 17.182 29.025 27.453 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.371 27.020 25.165 1.00 0.00 H new ATOM 0 HB3 SER A 65 17.982 26.739 26.783 1.00 0.00 H new ATOM 0 HG SER A 65 15.336 26.770 25.839 1.00 0.00 H new ATOM 1046 N THR A 66 19.684 29.122 27.171 1.00 0.00 N ATOM 1047 CA THR A 66 21.101 29.399 27.183 1.00 0.00 C ATOM 1048 C THR A 66 21.829 28.073 26.931 1.00 0.00 C ATOM 1049 O THR A 66 21.630 27.129 27.704 1.00 0.00 O ATOM 1050 CB THR A 66 21.466 29.875 28.587 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.683 31.009 28.861 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.891 30.428 28.719 1.00 0.00 C ATOM 0 H THR A 66 19.360 28.838 28.096 1.00 0.00 H new ATOM 0 HA THR A 66 21.369 30.145 26.435 1.00 0.00 H new ATOM 0 HB THR A 66 21.332 29.008 29.234 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.891 31.341 29.759 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.065 30.743 29.748 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.608 29.653 28.450 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.013 31.282 28.053 1.00 0.00 H new ATOM 1060 N LEU A 67 22.796 28.031 26.016 1.00 0.00 N ATOM 1061 CA LEU A 67 23.864 27.065 25.874 1.00 0.00 C ATOM 1062 C LEU A 67 25.206 27.620 26.369 1.00 0.00 C ATOM 1063 O LEU A 67 25.469 28.774 26.019 1.00 0.00 O ATOM 1064 CB LEU A 67 24.040 26.467 24.481 1.00 0.00 C ATOM 1065 CG LEU A 67 22.782 25.935 23.795 1.00 0.00 C ATOM 1066 CD1 LEU A 67 23.142 25.487 22.370 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.103 24.798 24.551 1.00 0.00 C ATOM 0 H LEU A 67 22.849 28.745 25.290 1.00 0.00 H new ATOM 0 HA LEU A 67 23.539 26.241 26.510 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.481 27.228 23.838 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.760 25.652 24.550 1.00 0.00 H new ATOM 0 HG LEU A 67 22.058 26.750 23.775 1.00 0.00 H new ATOM 0 HD11 LEU A 67 22.250 25.106 21.872 1.00 0.00 H new ATOM 0 HD12 LEU A 67 23.535 26.336 21.810 1.00 0.00 H new ATOM 0 HD13 LEU A 67 23.896 24.701 22.415 1.00 0.00 H new ATOM 0 HD21 LEU A 67 21.218 24.474 24.003 1.00 0.00 H new ATOM 0 HD22 LEU A 67 22.796 23.962 24.650 1.00 0.00 H new ATOM 0 HD23 LEU A 67 21.809 25.144 25.542 1.00 0.00 H new ATOM 1079 N HIS A 68 25.945 26.904 27.222 1.00 0.00 N ATOM 1080 CA HIS A 68 27.280 27.345 27.558 1.00 0.00 C ATOM 1081 C HIS A 68 28.189 26.671 26.533 1.00 0.00 C ATOM 1082 O HIS A 68 27.951 25.498 26.260 1.00 0.00 O ATOM 1083 CB HIS A 68 27.640 26.961 29.000 1.00 0.00 C ATOM 1084 CG HIS A 68 27.859 25.521 29.369 1.00 0.00 C ATOM 1085 ND1 HIS A 68 26.724 24.755 29.601 1.00 0.00 N ATOM 1086 CD2 HIS A 68 28.912 24.869 29.970 1.00 0.00 C ATOM 1087 CE1 HIS A 68 27.133 23.645 30.234 1.00 0.00 C ATOM 1088 NE2 HIS A 68 28.443 23.682 30.494 1.00 0.00 N ATOM 0 H HIS A 68 25.643 26.042 27.676 1.00 0.00 H new ATOM 0 HA HIS A 68 27.382 28.430 27.519 1.00 0.00 H new ATOM 0 HB2 HIS A 68 28.549 27.503 29.261 1.00 0.00 H new ATOM 0 HB3 HIS A 68 26.846 27.342 29.643 1.00 0.00 H new ATOM 0 HD2 HIS A 68 29.930 25.225 30.022 1.00 0.00 H new ATOM 0 HE1 HIS A 68 26.484 22.824 30.500 1.00 0.00 H new ATOM 0 HE2 HIS A 68 28.989 22.973 30.983 1.00 0.00 H new ATOM 1096 N LEU A 69 29.200 27.360 26.005 1.00 0.00 N ATOM 1097 CA LEU A 69 30.076 26.654 25.098 1.00 0.00 C ATOM 1098 C LEU A 69 31.506 26.727 25.626 1.00 0.00 C ATOM 1099 O LEU A 69 31.957 27.825 25.962 1.00 0.00 O ATOM 1100 CB LEU A 69 30.013 27.489 23.818 1.00 0.00 C ATOM 1101 CG LEU A 69 31.042 27.077 22.757 1.00 0.00 C ATOM 1102 CD1 LEU A 69 30.806 25.675 22.212 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.040 28.098 21.618 1.00 0.00 C ATOM 0 H LEU A 69 29.418 28.341 26.179 1.00 0.00 H new ATOM 0 HA LEU A 69 29.796 25.609 24.966 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.013 27.408 23.391 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.167 28.538 24.072 1.00 0.00 H new ATOM 0 HG LEU A 69 32.018 27.059 23.242 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.566 25.442 21.466 1.00 0.00 H new ATOM 0 HD12 LEU A 69 30.864 24.953 23.027 1.00 0.00 H new ATOM 0 HD13 LEU A 69 29.819 25.625 21.752 1.00 0.00 H new ATOM 0 HD21 LEU A 69 31.771 27.804 20.865 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.049 28.137 21.166 1.00 0.00 H new ATOM 0 HD23 LEU A 69 31.298 29.082 22.011 1.00 0.00 H new ATOM 1115 N VAL A 70 32.141 25.556 25.697 1.00 0.00 N ATOM 1116 CA VAL A 70 33.546 25.345 26.003 1.00 0.00 C ATOM 1117 C VAL A 70 34.240 25.238 24.639 1.00 0.00 C ATOM 1118 O VAL A 70 33.623 24.713 23.708 1.00 0.00 O ATOM 1119 CB VAL A 70 33.639 23.974 26.675 1.00 0.00 C ATOM 1120 CG1 VAL A 70 35.086 23.552 26.945 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.859 23.750 27.971 1.00 0.00 C ATOM 0 H VAL A 70 31.651 24.677 25.531 1.00 0.00 H new ATOM 0 HA VAL A 70 33.977 26.125 26.631 1.00 0.00 H new ATOM 0 HB VAL A 70 33.154 23.359 25.917 1.00 0.00 H new ATOM 0 HG11 VAL A 70 35.096 22.572 27.423 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.632 23.502 26.003 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.561 24.281 27.602 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.025 22.732 28.325 1.00 0.00 H new ATOM 0 HG22 VAL A 70 33.199 24.457 28.727 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.795 23.901 27.786 1.00 0.00 H new ATOM 1131 N LEU A 71 35.417 25.826 24.472 1.00 0.00 N ATOM 1132 CA LEU A 71 36.202 25.726 23.261 1.00 0.00 C ATOM 1133 C LEU A 71 37.520 24.991 23.498 1.00 0.00 C ATOM 1134 O LEU A 71 38.093 25.019 24.587 1.00 0.00 O ATOM 1135 CB LEU A 71 36.607 27.065 22.650 1.00 0.00 C ATOM 1136 CG LEU A 71 35.445 28.061 22.555 1.00 0.00 C ATOM 1137 CD1 LEU A 71 35.389 29.120 23.651 1.00 0.00 C ATOM 1138 CD2 LEU A 71 35.454 28.781 21.209 1.00 0.00 C ATOM 0 H LEU A 71 35.857 26.397 25.194 1.00 0.00 H new ATOM 0 HA LEU A 71 35.533 25.194 22.584 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.405 27.504 23.249 1.00 0.00 H new ATOM 0 HB3 LEU A 71 37.013 26.894 21.653 1.00 0.00 H new ATOM 0 HG LEU A 71 34.562 27.434 22.678 1.00 0.00 H new ATOM 0 HD11 LEU A 71 34.529 29.770 23.486 1.00 0.00 H new ATOM 0 HD12 LEU A 71 35.295 28.634 24.622 1.00 0.00 H new ATOM 0 HD13 LEU A 71 36.302 29.714 23.630 1.00 0.00 H new ATOM 0 HD21 LEU A 71 34.620 29.482 21.166 1.00 0.00 H new ATOM 0 HD22 LEU A 71 36.392 29.325 21.093 1.00 0.00 H new ATOM 0 HD23 LEU A 71 35.356 28.051 20.405 1.00 0.00 H new