USER MOD reduce.3.24.130724 H: found=0, std=0, add=795, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 796 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 2 SER OG : rot 40:sc= 0.204 USER MOD Single : A 4 THR OG1 : rot -110:sc= -1.51! USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0573 USER MOD Single : A 9 CYS SG : rot 180:sc= -0.808 USER MOD Single : A 10 GLN : amide:sc= -0.341 X(o=-0.34,f=-0.16) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -1.09 K(o=-1.1,f=-10!) USER MOD Single : A 24 LYS NZ :NH3+ 142:sc= -0.6 (180deg=-2.08!) USER MOD Single : A 25 THR OG1 : rot 139:sc= 0.255 USER MOD Single : A 28 TYR OH : rot 138:sc= 0.165 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -170:sc= -0.467 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= -0.543 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 130:sc= 0 USER MOD Single : A 50 SER OG : rot -120:sc= 0.0137 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 62 MET CE :methyl -156:sc= -0.182 (180deg=-0.875) USER MOD Single : A 68 GLN : amide:sc= -0.456 K(o=-0.46,f=-4.5!) USER MOD Single : A 70 GLN : amide:sc= -0.261 K(o=-0.26,f=-6.2!) USER MOD Single : A 75 GLN : amide:sc= -0.164 X(o=-0.16,f=-0.34) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 ASN : amide:sc= -0.745 K(o=-0.75,f=-0.02) USER MOD Single : A 82 ASN : amide:sc= -1.24 K(o=-1.2,f=0) USER MOD Single : A 90 TYR OH : rot -43:sc= 0.478 USER MOD Single : A 94 GLN : amide:sc= -0.0316 K(o=-0.032,f=-2.2) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0114 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 18 N SER A 2 -1.502 5.506 -3.357 1.00 0.00 N ATOM 19 CA SER A 2 -1.799 6.716 -4.104 1.00 0.00 C ATOM 20 C SER A 2 -0.513 7.469 -4.430 1.00 0.00 C ATOM 21 O SER A 2 0.521 7.252 -3.788 1.00 0.00 O ATOM 22 CB SER A 2 -2.739 7.607 -3.294 1.00 0.00 C ATOM 23 OG SER A 2 -3.852 6.868 -2.814 1.00 0.00 O ATOM 0 HA SER A 2 -2.286 6.441 -5.040 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.198 8.044 -2.454 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.087 8.434 -3.914 1.00 0.00 H new ATOM 0 HG SER A 2 -3.553 5.983 -2.516 1.00 0.00 H new ATOM 29 N ILE A 3 -0.583 8.359 -5.414 1.00 0.00 N ATOM 30 CA ILE A 3 0.583 9.126 -5.832 1.00 0.00 C ATOM 31 C ILE A 3 0.995 10.096 -4.732 1.00 0.00 C ATOM 32 O ILE A 3 0.146 10.686 -4.061 1.00 0.00 O ATOM 33 CB ILE A 3 0.311 9.892 -7.151 1.00 0.00 C ATOM 34 CG1 ILE A 3 0.082 8.898 -8.291 1.00 0.00 C ATOM 35 CG2 ILE A 3 1.457 10.838 -7.496 1.00 0.00 C ATOM 36 CD1 ILE A 3 1.254 7.970 -8.538 1.00 0.00 C ATOM 0 H ILE A 3 -1.434 8.566 -5.936 1.00 0.00 H new ATOM 0 HA ILE A 3 1.399 8.427 -6.014 1.00 0.00 H new ATOM 0 HB ILE A 3 -0.585 10.497 -7.013 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.802 8.300 -8.067 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.130 9.451 -9.206 1.00 0.00 H new ATOM 0 HG21 ILE A 3 1.232 11.358 -8.427 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.582 11.566 -6.694 1.00 0.00 H new ATOM 0 HG23 ILE A 3 2.378 10.267 -7.613 1.00 0.00 H new ATOM 0 HD11 ILE A 3 1.017 7.295 -9.360 1.00 0.00 H new ATOM 0 HD12 ILE A 3 2.136 8.558 -8.794 1.00 0.00 H new ATOM 0 HD13 ILE A 3 1.454 7.389 -7.638 1.00 0.00 H new ATOM 48 N THR A 4 2.296 10.254 -4.558 1.00 0.00 N ATOM 49 CA THR A 4 2.840 11.020 -3.455 1.00 0.00 C ATOM 50 C THR A 4 3.037 12.484 -3.838 1.00 0.00 C ATOM 51 O THR A 4 2.649 12.910 -4.926 1.00 0.00 O ATOM 52 CB THR A 4 4.181 10.417 -3.005 1.00 0.00 C ATOM 53 OG1 THR A 4 5.041 10.252 -4.140 1.00 0.00 O ATOM 54 CG2 THR A 4 3.966 9.071 -2.331 1.00 0.00 C ATOM 0 H THR A 4 3.002 9.855 -5.177 1.00 0.00 H new ATOM 0 HA THR A 4 2.125 10.976 -2.633 1.00 0.00 H new ATOM 0 HB THR A 4 4.643 11.096 -2.289 1.00 0.00 H new ATOM 0 HG1 THR A 4 5.146 9.297 -4.335 1.00 0.00 H new ATOM 0 HG21 THR A 4 4.927 8.662 -2.020 1.00 0.00 H new ATOM 0 HG22 THR A 4 3.327 9.200 -1.457 1.00 0.00 H new ATOM 0 HG23 THR A 4 3.489 8.385 -3.031 1.00 0.00 H new ATOM 62 N SER A 5 3.622 13.247 -2.930 1.00 0.00 N ATOM 63 CA SER A 5 3.845 14.668 -3.134 1.00 0.00 C ATOM 64 C SER A 5 5.056 14.909 -4.036 1.00 0.00 C ATOM 65 O SER A 5 5.597 13.967 -4.621 1.00 0.00 O ATOM 66 CB SER A 5 4.036 15.348 -1.781 1.00 0.00 C ATOM 67 OG SER A 5 2.998 14.981 -0.882 1.00 0.00 O ATOM 0 H SER A 5 3.955 12.899 -2.031 1.00 0.00 H new ATOM 0 HA SER A 5 2.975 15.095 -3.632 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.002 15.069 -1.362 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.046 16.430 -1.911 1.00 0.00 H new ATOM 0 HG SER A 5 3.139 15.426 -0.020 1.00 0.00 H new ATOM 73 N THR A 6 5.476 16.169 -4.128 1.00 0.00 N ATOM 74 CA THR A 6 6.558 16.601 -5.016 1.00 0.00 C ATOM 75 C THR A 6 7.822 15.744 -4.869 1.00 0.00 C ATOM 76 O THR A 6 8.639 15.667 -5.790 1.00 0.00 O ATOM 77 CB THR A 6 6.916 18.069 -4.723 1.00 0.00 C ATOM 78 OG1 THR A 6 5.720 18.803 -4.427 1.00 0.00 O ATOM 79 CG2 THR A 6 7.623 18.708 -5.910 1.00 0.00 C ATOM 0 H THR A 6 5.071 16.929 -3.582 1.00 0.00 H new ATOM 0 HA THR A 6 6.194 16.486 -6.037 1.00 0.00 H new ATOM 0 HB THR A 6 7.591 18.094 -3.867 1.00 0.00 H new ATOM 0 HG1 THR A 6 5.948 19.737 -4.239 1.00 0.00 H new ATOM 0 HG21 THR A 6 7.864 19.745 -5.675 1.00 0.00 H new ATOM 0 HG22 THR A 6 8.542 18.161 -6.124 1.00 0.00 H new ATOM 0 HG23 THR A 6 6.970 18.676 -6.782 1.00 0.00 H new ATOM 87 N ASP A 7 7.973 15.107 -3.711 1.00 0.00 N ATOM 88 CA ASP A 7 9.114 14.233 -3.437 1.00 0.00 C ATOM 89 C ASP A 7 9.282 13.176 -4.529 1.00 0.00 C ATOM 90 O ASP A 7 10.398 12.746 -4.815 1.00 0.00 O ATOM 91 CB ASP A 7 8.942 13.536 -2.084 1.00 0.00 C ATOM 92 CG ASP A 7 8.701 14.507 -0.946 1.00 0.00 C ATOM 93 OD1 ASP A 7 9.619 15.280 -0.607 1.00 0.00 O ATOM 94 OD2 ASP A 7 7.577 14.512 -0.391 1.00 0.00 O ATOM 0 H ASP A 7 7.312 15.180 -2.938 1.00 0.00 H new ATOM 0 HA ASP A 7 10.006 14.859 -3.416 1.00 0.00 H new ATOM 0 HB2 ASP A 7 8.106 12.840 -2.144 1.00 0.00 H new ATOM 0 HB3 ASP A 7 9.833 12.946 -1.869 1.00 0.00 H new ATOM 99 N ILE A 8 8.174 12.778 -5.150 1.00 0.00 N ATOM 100 CA ILE A 8 8.205 11.760 -6.197 1.00 0.00 C ATOM 101 C ILE A 8 9.010 12.247 -7.406 1.00 0.00 C ATOM 102 O ILE A 8 9.713 11.471 -8.053 1.00 0.00 O ATOM 103 CB ILE A 8 6.772 11.353 -6.635 1.00 0.00 C ATOM 104 CG1 ILE A 8 6.816 10.166 -7.600 1.00 0.00 C ATOM 105 CG2 ILE A 8 6.036 12.525 -7.273 1.00 0.00 C ATOM 106 CD1 ILE A 8 5.444 9.652 -7.984 1.00 0.00 C ATOM 0 H ILE A 8 7.244 13.145 -4.946 1.00 0.00 H new ATOM 0 HA ILE A 8 8.695 10.879 -5.782 1.00 0.00 H new ATOM 0 HB ILE A 8 6.225 11.055 -5.740 1.00 0.00 H new ATOM 0 HG12 ILE A 8 7.351 10.461 -8.503 1.00 0.00 H new ATOM 0 HG13 ILE A 8 7.384 9.356 -7.143 1.00 0.00 H new ATOM 0 HG21 ILE A 8 5.036 12.209 -7.569 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.961 13.342 -6.555 1.00 0.00 H new ATOM 0 HG23 ILE A 8 6.584 12.864 -8.152 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.549 8.811 -8.669 1.00 0.00 H new ATOM 0 HD12 ILE A 8 4.914 9.326 -7.089 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.880 10.448 -8.470 1.00 0.00 H new ATOM 118 N CYS A 9 8.925 13.543 -7.682 1.00 0.00 N ATOM 119 CA CYS A 9 9.624 14.136 -8.810 1.00 0.00 C ATOM 120 C CYS A 9 11.116 14.255 -8.512 1.00 0.00 C ATOM 121 O CYS A 9 11.957 14.004 -9.373 1.00 0.00 O ATOM 122 CB CYS A 9 9.040 15.517 -9.115 1.00 0.00 C ATOM 123 SG CYS A 9 7.233 15.560 -9.133 1.00 0.00 S ATOM 0 H CYS A 9 8.375 14.205 -7.135 1.00 0.00 H new ATOM 0 HA CYS A 9 9.494 13.491 -9.679 1.00 0.00 H new ATOM 0 HB2 CYS A 9 9.403 16.227 -8.372 1.00 0.00 H new ATOM 0 HB3 CYS A 9 9.411 15.852 -10.083 1.00 0.00 H new ATOM 0 HG CYS A 9 6.830 16.768 -9.397 1.00 0.00 H new ATOM 129 N GLN A 10 11.432 14.627 -7.278 1.00 0.00 N ATOM 130 CA GLN A 10 12.815 14.841 -6.872 1.00 0.00 C ATOM 131 C GLN A 10 13.549 13.518 -6.704 1.00 0.00 C ATOM 132 O GLN A 10 14.728 13.406 -7.038 1.00 0.00 O ATOM 133 CB GLN A 10 12.870 15.651 -5.574 1.00 0.00 C ATOM 134 CG GLN A 10 12.312 17.059 -5.715 1.00 0.00 C ATOM 135 CD GLN A 10 13.011 17.856 -6.800 1.00 0.00 C ATOM 136 OE1 GLN A 10 14.012 18.527 -6.550 1.00 0.00 O ATOM 137 NE2 GLN A 10 12.483 17.791 -8.012 1.00 0.00 N ATOM 0 H GLN A 10 10.747 14.787 -6.539 1.00 0.00 H new ATOM 0 HA GLN A 10 13.314 15.405 -7.660 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.312 15.123 -4.801 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.904 15.711 -5.235 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.247 17.003 -5.939 1.00 0.00 H new ATOM 0 HG3 GLN A 10 12.411 17.582 -4.764 1.00 0.00 H new ATOM 0 HE21 GLN A 10 11.652 17.223 -8.177 1.00 0.00 H new ATOM 0 HE22 GLN A 10 12.907 18.309 -8.781 1.00 0.00 H new ATOM 146 N ALA A 11 12.841 12.514 -6.199 1.00 0.00 N ATOM 147 CA ALA A 11 13.422 11.192 -6.002 1.00 0.00 C ATOM 148 C ALA A 11 13.892 10.596 -7.324 1.00 0.00 C ATOM 149 O ALA A 11 14.884 9.876 -7.366 1.00 0.00 O ATOM 150 CB ALA A 11 12.421 10.267 -5.328 1.00 0.00 C ATOM 0 H ALA A 11 11.863 12.591 -5.919 1.00 0.00 H new ATOM 0 HA ALA A 11 14.291 11.299 -5.353 1.00 0.00 H new ATOM 0 HB1 ALA A 11 12.871 9.284 -5.188 1.00 0.00 H new ATOM 0 HB2 ALA A 11 12.141 10.679 -4.359 1.00 0.00 H new ATOM 0 HB3 ALA A 11 11.533 10.174 -5.953 1.00 0.00 H new ATOM 156 N ALA A 12 13.187 10.925 -8.405 1.00 0.00 N ATOM 157 CA ALA A 12 13.512 10.408 -9.733 1.00 0.00 C ATOM 158 C ALA A 12 14.863 10.928 -10.225 1.00 0.00 C ATOM 159 O ALA A 12 15.528 10.288 -11.038 1.00 0.00 O ATOM 160 CB ALA A 12 12.416 10.777 -10.722 1.00 0.00 C ATOM 0 H ALA A 12 12.382 11.551 -8.386 1.00 0.00 H new ATOM 0 HA ALA A 12 13.580 9.323 -9.660 1.00 0.00 H new ATOM 0 HB1 ALA A 12 12.669 10.387 -11.708 1.00 0.00 H new ATOM 0 HB2 ALA A 12 11.470 10.347 -10.393 1.00 0.00 H new ATOM 0 HB3 ALA A 12 12.323 11.862 -10.774 1.00 0.00 H new ATOM 166 N ASP A 13 15.266 12.085 -9.718 1.00 0.00 N ATOM 167 CA ASP A 13 16.533 12.696 -10.110 1.00 0.00 C ATOM 168 C ASP A 13 17.667 12.153 -9.241 1.00 0.00 C ATOM 169 O ASP A 13 18.843 12.235 -9.599 1.00 0.00 O ATOM 170 CB ASP A 13 16.436 14.222 -9.977 1.00 0.00 C ATOM 171 CG ASP A 13 17.652 14.957 -10.515 1.00 0.00 C ATOM 172 OD1 ASP A 13 17.662 15.305 -11.716 1.00 0.00 O ATOM 173 OD2 ASP A 13 18.595 15.213 -9.736 1.00 0.00 O ATOM 0 H ASP A 13 14.734 12.622 -9.033 1.00 0.00 H new ATOM 0 HA ASP A 13 16.746 12.448 -11.150 1.00 0.00 H new ATOM 0 HB2 ASP A 13 15.548 14.569 -10.506 1.00 0.00 H new ATOM 0 HB3 ASP A 13 16.302 14.479 -8.926 1.00 0.00 H new ATOM 178 N ALA A 14 17.297 11.559 -8.112 1.00 0.00 N ATOM 179 CA ALA A 14 18.269 11.080 -7.132 1.00 0.00 C ATOM 180 C ALA A 14 18.746 9.659 -7.438 1.00 0.00 C ATOM 181 O ALA A 14 19.540 9.091 -6.683 1.00 0.00 O ATOM 182 CB ALA A 14 17.676 11.148 -5.733 1.00 0.00 C ATOM 0 H ALA A 14 16.325 11.396 -7.850 1.00 0.00 H new ATOM 0 HA ALA A 14 19.140 11.732 -7.189 1.00 0.00 H new ATOM 0 HB1 ALA A 14 18.408 10.789 -5.010 1.00 0.00 H new ATOM 0 HB2 ALA A 14 17.411 12.179 -5.500 1.00 0.00 H new ATOM 0 HB3 ALA A 14 16.783 10.525 -5.686 1.00 0.00 H new ATOM 188 N LEU A 15 18.265 9.091 -8.541 1.00 0.00 N ATOM 189 CA LEU A 15 18.687 7.754 -8.969 1.00 0.00 C ATOM 190 C LEU A 15 20.163 7.748 -9.369 1.00 0.00 C ATOM 191 O LEU A 15 20.786 8.805 -9.500 1.00 0.00 O ATOM 192 CB LEU A 15 17.833 7.262 -10.146 1.00 0.00 C ATOM 193 CG LEU A 15 16.537 6.527 -9.779 1.00 0.00 C ATOM 194 CD1 LEU A 15 15.597 7.423 -8.996 1.00 0.00 C ATOM 195 CD2 LEU A 15 15.849 6.012 -11.033 1.00 0.00 C ATOM 0 H LEU A 15 17.583 9.533 -9.157 1.00 0.00 H new ATOM 0 HA LEU A 15 18.548 7.080 -8.124 1.00 0.00 H new ATOM 0 HB2 LEU A 15 17.576 8.121 -10.766 1.00 0.00 H new ATOM 0 HB3 LEU A 15 18.443 6.597 -10.758 1.00 0.00 H new ATOM 0 HG LEU A 15 16.801 5.681 -9.145 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.689 6.872 -8.752 1.00 0.00 H new ATOM 0 HD12 LEU A 15 16.084 7.746 -8.076 1.00 0.00 H new ATOM 0 HD13 LEU A 15 15.342 8.296 -9.597 1.00 0.00 H new ATOM 0 HD21 LEU A 15 14.931 5.493 -10.757 1.00 0.00 H new ATOM 0 HD22 LEU A 15 15.609 6.850 -11.687 1.00 0.00 H new ATOM 0 HD23 LEU A 15 16.513 5.323 -11.555 1.00 0.00 H new ATOM 207 N LYS A 16 20.720 6.561 -9.566 1.00 0.00 N ATOM 208 CA LYS A 16 22.121 6.433 -9.940 1.00 0.00 C ATOM 209 C LYS A 16 22.306 5.317 -10.959 1.00 0.00 C ATOM 210 O LYS A 16 21.478 4.416 -11.062 1.00 0.00 O ATOM 211 CB LYS A 16 22.979 6.160 -8.702 1.00 0.00 C ATOM 212 CG LYS A 16 22.654 4.845 -8.008 1.00 0.00 C ATOM 213 CD LYS A 16 23.430 4.689 -6.712 1.00 0.00 C ATOM 214 CE LYS A 16 23.048 5.764 -5.710 1.00 0.00 C ATOM 215 NZ LYS A 16 23.808 5.636 -4.441 1.00 0.00 N ATOM 0 H LYS A 16 20.224 5.675 -9.473 1.00 0.00 H new ATOM 0 HA LYS A 16 22.441 7.372 -10.392 1.00 0.00 H new ATOM 0 HB2 LYS A 16 24.029 6.157 -8.993 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.847 6.977 -7.993 1.00 0.00 H new ATOM 0 HG2 LYS A 16 21.585 4.797 -7.800 1.00 0.00 H new ATOM 0 HG3 LYS A 16 22.887 4.014 -8.674 1.00 0.00 H new ATOM 0 HD2 LYS A 16 23.236 3.705 -6.285 1.00 0.00 H new ATOM 0 HD3 LYS A 16 24.499 4.742 -6.917 1.00 0.00 H new ATOM 0 HE2 LYS A 16 23.231 6.747 -6.145 1.00 0.00 H new ATOM 0 HE3 LYS A 16 21.980 5.702 -5.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 23.517 6.389 -3.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 23.614 4.709 -4.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 24.826 5.721 -4.636 1.00 0.00 H new ATOM 229 N GLY A 17 23.385 5.388 -11.718 1.00 0.00 N ATOM 230 CA GLY A 17 23.663 4.354 -12.687 1.00 0.00 C ATOM 231 C GLY A 17 23.457 4.827 -14.107 1.00 0.00 C ATOM 232 O GLY A 17 22.685 5.757 -14.361 1.00 0.00 O ATOM 0 H GLY A 17 24.072 6.141 -11.681 1.00 0.00 H new ATOM 0 HA2 GLY A 17 24.691 4.013 -12.566 1.00 0.00 H new ATOM 0 HA3 GLY A 17 23.018 3.497 -12.495 1.00 0.00 H new ATOM 236 N PHE A 18 24.150 4.192 -15.032 1.00 0.00 N ATOM 237 CA PHE A 18 24.075 4.559 -16.432 1.00 0.00 C ATOM 238 C PHE A 18 23.547 3.386 -17.241 1.00 0.00 C ATOM 239 O PHE A 18 24.108 2.290 -17.210 1.00 0.00 O ATOM 240 CB PHE A 18 25.452 4.997 -16.934 1.00 0.00 C ATOM 241 CG PHE A 18 25.973 6.224 -16.237 1.00 0.00 C ATOM 242 CD1 PHE A 18 26.606 6.124 -15.008 1.00 0.00 C ATOM 243 CD2 PHE A 18 25.818 7.477 -16.806 1.00 0.00 C ATOM 244 CE1 PHE A 18 27.074 7.250 -14.360 1.00 0.00 C ATOM 245 CE2 PHE A 18 26.286 8.608 -16.164 1.00 0.00 C ATOM 246 CZ PHE A 18 26.914 8.494 -14.939 1.00 0.00 C ATOM 0 H PHE A 18 24.777 3.412 -14.836 1.00 0.00 H new ATOM 0 HA PHE A 18 23.389 5.398 -16.552 1.00 0.00 H new ATOM 0 HB2 PHE A 18 26.159 4.180 -16.795 1.00 0.00 H new ATOM 0 HB3 PHE A 18 25.396 5.191 -18.005 1.00 0.00 H new ATOM 0 HD1 PHE A 18 26.735 5.154 -14.552 1.00 0.00 H new ATOM 0 HD2 PHE A 18 25.326 7.572 -17.763 1.00 0.00 H new ATOM 0 HE1 PHE A 18 27.564 7.158 -13.402 1.00 0.00 H new ATOM 0 HE2 PHE A 18 26.161 9.579 -16.619 1.00 0.00 H new ATOM 0 HZ PHE A 18 27.279 9.376 -14.435 1.00 0.00 H new ATOM 256 N VAL A 19 22.459 3.618 -17.951 1.00 0.00 N ATOM 257 CA VAL A 19 21.776 2.556 -18.664 1.00 0.00 C ATOM 258 C VAL A 19 21.865 2.779 -20.178 1.00 0.00 C ATOM 259 O VAL A 19 21.672 3.895 -20.669 1.00 0.00 O ATOM 260 CB VAL A 19 20.302 2.452 -18.195 1.00 0.00 C ATOM 261 CG1 VAL A 19 19.528 3.730 -18.491 1.00 0.00 C ATOM 262 CG2 VAL A 19 19.612 1.246 -18.806 1.00 0.00 C ATOM 0 H VAL A 19 22.028 4.537 -18.049 1.00 0.00 H new ATOM 0 HA VAL A 19 22.268 1.610 -18.438 1.00 0.00 H new ATOM 0 HB VAL A 19 20.316 2.318 -17.113 1.00 0.00 H new ATOM 0 HG11 VAL A 19 18.499 3.620 -18.148 1.00 0.00 H new ATOM 0 HG12 VAL A 19 19.996 4.567 -17.972 1.00 0.00 H new ATOM 0 HG13 VAL A 19 19.535 3.919 -19.564 1.00 0.00 H new ATOM 0 HG21 VAL A 19 18.580 1.202 -18.457 1.00 0.00 H new ATOM 0 HG22 VAL A 19 19.624 1.331 -19.893 1.00 0.00 H new ATOM 0 HG23 VAL A 19 20.135 0.338 -18.508 1.00 0.00 H new ATOM 272 N GLY A 20 22.183 1.720 -20.910 1.00 0.00 N ATOM 273 CA GLY A 20 22.371 1.833 -22.342 1.00 0.00 C ATOM 274 C GLY A 20 22.028 0.550 -23.071 1.00 0.00 C ATOM 275 O GLY A 20 21.705 -0.462 -22.445 1.00 0.00 O ATOM 0 H GLY A 20 22.315 0.781 -20.535 1.00 0.00 H new ATOM 0 HA2 GLY A 20 21.750 2.643 -22.725 1.00 0.00 H new ATOM 0 HA3 GLY A 20 23.407 2.100 -22.550 1.00 0.00 H new ATOM 279 N PHE A 21 22.091 0.589 -24.393 1.00 0.00 N ATOM 280 CA PHE A 21 21.751 -0.567 -25.208 1.00 0.00 C ATOM 281 C PHE A 21 23.007 -1.288 -25.679 1.00 0.00 C ATOM 282 O PHE A 21 23.877 -0.691 -26.315 1.00 0.00 O ATOM 283 CB PHE A 21 20.915 -0.133 -26.415 1.00 0.00 C ATOM 284 CG PHE A 21 20.451 -1.273 -27.276 1.00 0.00 C ATOM 285 CD1 PHE A 21 19.322 -1.997 -26.934 1.00 0.00 C ATOM 286 CD2 PHE A 21 21.141 -1.616 -28.428 1.00 0.00 C ATOM 287 CE1 PHE A 21 18.887 -3.043 -27.724 1.00 0.00 C ATOM 288 CE2 PHE A 21 20.713 -2.662 -29.222 1.00 0.00 C ATOM 289 CZ PHE A 21 19.584 -3.376 -28.869 1.00 0.00 C ATOM 0 H PHE A 21 22.375 1.411 -24.926 1.00 0.00 H new ATOM 0 HA PHE A 21 21.168 -1.255 -24.596 1.00 0.00 H new ATOM 0 HB2 PHE A 21 20.045 0.420 -26.062 1.00 0.00 H new ATOM 0 HB3 PHE A 21 21.503 0.553 -27.024 1.00 0.00 H new ATOM 0 HD1 PHE A 21 18.775 -1.741 -26.039 1.00 0.00 H new ATOM 0 HD2 PHE A 21 22.023 -1.059 -28.708 1.00 0.00 H new ATOM 0 HE1 PHE A 21 18.004 -3.599 -27.447 1.00 0.00 H new ATOM 0 HE2 PHE A 21 21.260 -2.921 -30.117 1.00 0.00 H new ATOM 0 HZ PHE A 21 19.247 -4.194 -29.488 1.00 0.00 H new ATOM 299 N ASN A 22 23.094 -2.571 -25.364 1.00 0.00 N ATOM 300 CA ASN A 22 24.211 -3.395 -25.801 1.00 0.00 C ATOM 301 C ASN A 22 23.836 -4.124 -27.089 1.00 0.00 C ATOM 302 O ASN A 22 22.940 -4.971 -27.091 1.00 0.00 O ATOM 303 CB ASN A 22 24.584 -4.402 -24.710 1.00 0.00 C ATOM 304 CG ASN A 22 25.803 -5.233 -25.066 1.00 0.00 C ATOM 305 OD1 ASN A 22 25.700 -6.234 -25.775 1.00 0.00 O ATOM 306 ND2 ASN A 22 26.960 -4.839 -24.555 1.00 0.00 N ATOM 0 H ASN A 22 22.400 -3.067 -24.804 1.00 0.00 H new ATOM 0 HA ASN A 22 25.074 -2.757 -25.991 1.00 0.00 H new ATOM 0 HB2 ASN A 22 24.774 -3.868 -23.779 1.00 0.00 H new ATOM 0 HB3 ASN A 22 23.738 -5.065 -24.530 1.00 0.00 H new ATOM 0 HD21 ASN A 22 27.809 -5.372 -24.745 1.00 0.00 H new ATOM 0 HD22 ASN A 22 27.002 -4.003 -23.972 1.00 0.00 H new ATOM 313 N ARG A 23 24.521 -3.791 -28.176 1.00 0.00 N ATOM 314 CA ARG A 23 24.166 -4.298 -29.501 1.00 0.00 C ATOM 315 C ARG A 23 24.486 -5.785 -29.671 1.00 0.00 C ATOM 316 O ARG A 23 23.921 -6.443 -30.542 1.00 0.00 O ATOM 317 CB ARG A 23 24.873 -3.479 -30.587 1.00 0.00 C ATOM 318 CG ARG A 23 26.387 -3.492 -30.471 1.00 0.00 C ATOM 319 CD ARG A 23 27.041 -2.533 -31.452 1.00 0.00 C ATOM 320 NE ARG A 23 26.916 -2.981 -32.835 1.00 0.00 N ATOM 321 CZ ARG A 23 26.783 -2.157 -33.872 1.00 0.00 C ATOM 322 NH1 ARG A 23 26.692 -0.846 -33.678 1.00 0.00 N ATOM 323 NH2 ARG A 23 26.734 -2.648 -35.103 1.00 0.00 N ATOM 0 H ARG A 23 25.330 -3.169 -28.168 1.00 0.00 H new ATOM 0 HA ARG A 23 23.086 -4.191 -29.603 1.00 0.00 H new ATOM 0 HB2 ARG A 23 24.589 -3.867 -31.565 1.00 0.00 H new ATOM 0 HB3 ARG A 23 24.522 -2.448 -30.539 1.00 0.00 H new ATOM 0 HG2 ARG A 23 26.675 -3.223 -29.455 1.00 0.00 H new ATOM 0 HG3 ARG A 23 26.756 -4.502 -30.651 1.00 0.00 H new ATOM 0 HD2 ARG A 23 26.587 -1.547 -31.350 1.00 0.00 H new ATOM 0 HD3 ARG A 23 28.096 -2.425 -31.202 1.00 0.00 H new ATOM 0 HE ARG A 23 26.931 -3.984 -33.018 1.00 0.00 H new ATOM 0 HH11 ARG A 23 26.724 -0.467 -32.732 1.00 0.00 H new ATOM 0 HH12 ARG A 23 26.590 -0.218 -34.476 1.00 0.00 H new ATOM 0 HH21 ARG A 23 26.798 -3.655 -35.253 1.00 0.00 H new ATOM 0 HH22 ARG A 23 26.632 -2.019 -35.899 1.00 0.00 H new ATOM 337 N LYS A 24 25.383 -6.321 -28.851 1.00 0.00 N ATOM 338 CA LYS A 24 25.738 -7.731 -28.950 1.00 0.00 C ATOM 339 C LYS A 24 24.647 -8.610 -28.347 1.00 0.00 C ATOM 340 O LYS A 24 24.194 -9.569 -28.972 1.00 0.00 O ATOM 341 CB LYS A 24 27.080 -8.007 -28.267 1.00 0.00 C ATOM 342 CG LYS A 24 27.521 -9.458 -28.358 1.00 0.00 C ATOM 343 CD LYS A 24 28.956 -9.656 -27.891 1.00 0.00 C ATOM 344 CE LYS A 24 29.962 -9.032 -28.851 1.00 0.00 C ATOM 345 NZ LYS A 24 30.220 -7.597 -28.560 1.00 0.00 N ATOM 0 H LYS A 24 25.873 -5.807 -28.118 1.00 0.00 H new ATOM 0 HA LYS A 24 25.834 -7.976 -30.008 1.00 0.00 H new ATOM 0 HB2 LYS A 24 27.845 -7.374 -28.718 1.00 0.00 H new ATOM 0 HB3 LYS A 24 27.009 -7.722 -27.217 1.00 0.00 H new ATOM 0 HG2 LYS A 24 26.856 -10.076 -27.754 1.00 0.00 H new ATOM 0 HG3 LYS A 24 27.426 -9.800 -29.388 1.00 0.00 H new ATOM 0 HD2 LYS A 24 29.079 -9.216 -26.901 1.00 0.00 H new ATOM 0 HD3 LYS A 24 29.161 -10.722 -27.794 1.00 0.00 H new ATOM 0 HE2 LYS A 24 30.900 -9.584 -28.796 1.00 0.00 H new ATOM 0 HE3 LYS A 24 29.593 -9.131 -29.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 31.227 -7.387 -28.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 29.644 -7.006 -29.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 29.970 -7.393 -27.571 1.00 0.00 H new ATOM 359 N THR A 25 24.219 -8.282 -27.136 1.00 0.00 N ATOM 360 CA THR A 25 23.188 -9.063 -26.467 1.00 0.00 C ATOM 361 C THR A 25 21.794 -8.653 -26.956 1.00 0.00 C ATOM 362 O THR A 25 20.847 -9.440 -26.903 1.00 0.00 O ATOM 363 CB THR A 25 23.288 -8.936 -24.926 1.00 0.00 C ATOM 364 OG1 THR A 25 22.346 -9.806 -24.290 1.00 0.00 O ATOM 365 CG2 THR A 25 23.046 -7.509 -24.470 1.00 0.00 C ATOM 0 H THR A 25 24.566 -7.487 -26.600 1.00 0.00 H new ATOM 0 HA THR A 25 23.350 -10.110 -26.723 1.00 0.00 H new ATOM 0 HB THR A 25 24.300 -9.223 -24.640 1.00 0.00 H new ATOM 0 HG1 THR A 25 22.765 -10.229 -23.512 1.00 0.00 H new ATOM 0 HG21 THR A 25 23.124 -7.456 -23.384 1.00 0.00 H new ATOM 0 HG22 THR A 25 23.791 -6.852 -24.920 1.00 0.00 H new ATOM 0 HG23 THR A 25 22.050 -7.192 -24.778 1.00 0.00 H new ATOM 373 N GLY A 26 21.682 -7.425 -27.451 1.00 0.00 N ATOM 374 CA GLY A 26 20.437 -6.969 -28.038 1.00 0.00 C ATOM 375 C GLY A 26 19.389 -6.622 -27.000 1.00 0.00 C ATOM 376 O GLY A 26 18.209 -6.928 -27.175 1.00 0.00 O ATOM 0 H GLY A 26 22.434 -6.736 -27.456 1.00 0.00 H new ATOM 0 HA2 GLY A 26 20.632 -6.093 -28.657 1.00 0.00 H new ATOM 0 HA3 GLY A 26 20.046 -7.744 -28.697 1.00 0.00 H new ATOM 380 N ARG A 27 19.811 -5.980 -25.920 1.00 0.00 N ATOM 381 CA ARG A 27 18.884 -5.559 -24.879 1.00 0.00 C ATOM 382 C ARG A 27 19.431 -4.360 -24.114 1.00 0.00 C ATOM 383 O ARG A 27 20.605 -4.004 -24.250 1.00 0.00 O ATOM 384 CB ARG A 27 18.560 -6.716 -23.925 1.00 0.00 C ATOM 385 CG ARG A 27 19.778 -7.424 -23.363 1.00 0.00 C ATOM 386 CD ARG A 27 19.375 -8.619 -22.517 1.00 0.00 C ATOM 387 NE ARG A 27 20.527 -9.401 -22.078 1.00 0.00 N ATOM 388 CZ ARG A 27 20.459 -10.379 -21.176 1.00 0.00 C ATOM 389 NH1 ARG A 27 19.288 -10.716 -20.647 1.00 0.00 N ATOM 390 NH2 ARG A 27 21.559 -11.032 -20.817 1.00 0.00 N ATOM 0 H ARG A 27 20.786 -5.740 -25.742 1.00 0.00 H new ATOM 0 HA ARG A 27 17.956 -5.256 -25.363 1.00 0.00 H new ATOM 0 HB2 ARG A 27 17.964 -6.332 -23.097 1.00 0.00 H new ATOM 0 HB3 ARG A 27 17.943 -7.444 -24.452 1.00 0.00 H new ATOM 0 HG2 ARG A 27 20.420 -7.753 -24.180 1.00 0.00 H new ATOM 0 HG3 ARG A 27 20.361 -6.728 -22.760 1.00 0.00 H new ATOM 0 HD2 ARG A 27 18.820 -8.273 -21.645 1.00 0.00 H new ATOM 0 HD3 ARG A 27 18.703 -9.257 -23.090 1.00 0.00 H new ATOM 0 HE ARG A 27 21.437 -9.186 -22.486 1.00 0.00 H new ATOM 0 HH11 ARG A 27 18.440 -10.226 -20.931 1.00 0.00 H new ATOM 0 HH12 ARG A 27 19.237 -11.465 -19.956 1.00 0.00 H new ATOM 0 HH21 ARG A 27 22.457 -10.785 -21.232 1.00 0.00 H new ATOM 0 HH22 ARG A 27 21.505 -11.781 -20.126 1.00 0.00 H new ATOM 404 N TYR A 28 18.570 -3.746 -23.317 1.00 0.00 N ATOM 405 CA TYR A 28 18.904 -2.519 -22.609 1.00 0.00 C ATOM 406 C TYR A 28 19.345 -2.848 -21.184 1.00 0.00 C ATOM 407 O TYR A 28 18.582 -3.431 -20.413 1.00 0.00 O ATOM 408 CB TYR A 28 17.682 -1.592 -22.597 1.00 0.00 C ATOM 409 CG TYR A 28 18.021 -0.122 -22.684 1.00 0.00 C ATOM 410 CD1 TYR A 28 18.537 0.420 -23.852 1.00 0.00 C ATOM 411 CD2 TYR A 28 17.819 0.724 -21.604 1.00 0.00 C ATOM 412 CE1 TYR A 28 18.848 1.763 -23.940 1.00 0.00 C ATOM 413 CE2 TYR A 28 18.127 2.069 -21.685 1.00 0.00 C ATOM 414 CZ TYR A 28 18.641 2.582 -22.854 1.00 0.00 C ATOM 415 OH TYR A 28 18.956 3.920 -22.937 1.00 0.00 O ATOM 0 H TYR A 28 17.623 -4.083 -23.143 1.00 0.00 H new ATOM 0 HA TYR A 28 19.726 -2.013 -23.115 1.00 0.00 H new ATOM 0 HB2 TYR A 28 17.033 -1.854 -23.432 1.00 0.00 H new ATOM 0 HB3 TYR A 28 17.114 -1.769 -21.684 1.00 0.00 H new ATOM 0 HD1 TYR A 28 18.698 -0.219 -24.707 1.00 0.00 H new ATOM 0 HD2 TYR A 28 17.415 0.326 -20.685 1.00 0.00 H new ATOM 0 HE1 TYR A 28 19.251 2.168 -24.856 1.00 0.00 H new ATOM 0 HE2 TYR A 28 17.965 2.715 -20.835 1.00 0.00 H new ATOM 0 HH TYR A 28 18.251 4.449 -22.510 1.00 0.00 H new ATOM 425 N ILE A 29 20.574 -2.479 -20.841 1.00 0.00 N ATOM 426 CA ILE A 29 21.153 -2.851 -19.553 1.00 0.00 C ATOM 427 C ILE A 29 21.753 -1.646 -18.833 1.00 0.00 C ATOM 428 O ILE A 29 22.059 -0.630 -19.456 1.00 0.00 O ATOM 429 CB ILE A 29 22.225 -3.962 -19.713 1.00 0.00 C ATOM 430 CG1 ILE A 29 23.180 -3.670 -20.885 1.00 0.00 C ATOM 431 CG2 ILE A 29 21.555 -5.315 -19.905 1.00 0.00 C ATOM 432 CD1 ILE A 29 24.246 -2.631 -20.591 1.00 0.00 C ATOM 0 H ILE A 29 21.189 -1.923 -21.435 1.00 0.00 H new ATOM 0 HA ILE A 29 20.337 -3.241 -18.944 1.00 0.00 H new ATOM 0 HB ILE A 29 22.820 -3.981 -18.800 1.00 0.00 H new ATOM 0 HG12 ILE A 29 23.669 -4.599 -21.178 1.00 0.00 H new ATOM 0 HG13 ILE A 29 22.592 -3.336 -21.740 1.00 0.00 H new ATOM 0 HG21 ILE A 29 22.317 -6.086 -20.016 1.00 0.00 H new ATOM 0 HG22 ILE A 29 20.935 -5.540 -19.037 1.00 0.00 H new ATOM 0 HG23 ILE A 29 20.932 -5.289 -20.799 1.00 0.00 H new ATOM 0 HD11 ILE A 29 24.871 -2.491 -21.473 1.00 0.00 H new ATOM 0 HD12 ILE A 29 23.770 -1.686 -20.330 1.00 0.00 H new ATOM 0 HD13 ILE A 29 24.864 -2.969 -19.759 1.00 0.00 H new ATOM 444 N VAL A 30 21.920 -1.767 -17.522 1.00 0.00 N ATOM 445 CA VAL A 30 22.454 -0.679 -16.710 1.00 0.00 C ATOM 446 C VAL A 30 23.792 -1.075 -16.081 1.00 0.00 C ATOM 447 O VAL A 30 24.012 -2.242 -15.747 1.00 0.00 O ATOM 448 CB VAL A 30 21.454 -0.267 -15.595 1.00 0.00 C ATOM 449 CG1 VAL A 30 21.152 -1.438 -14.672 1.00 0.00 C ATOM 450 CG2 VAL A 30 21.975 0.921 -14.798 1.00 0.00 C ATOM 0 H VAL A 30 21.693 -2.611 -16.996 1.00 0.00 H new ATOM 0 HA VAL A 30 22.611 0.174 -17.370 1.00 0.00 H new ATOM 0 HB VAL A 30 20.526 0.033 -16.081 1.00 0.00 H new ATOM 0 HG11 VAL A 30 20.450 -1.122 -13.901 1.00 0.00 H new ATOM 0 HG12 VAL A 30 20.715 -2.253 -15.249 1.00 0.00 H new ATOM 0 HG13 VAL A 30 22.075 -1.780 -14.204 1.00 0.00 H new ATOM 0 HG21 VAL A 30 21.253 1.186 -14.025 1.00 0.00 H new ATOM 0 HG22 VAL A 30 22.925 0.658 -14.332 1.00 0.00 H new ATOM 0 HG23 VAL A 30 22.121 1.771 -15.465 1.00 0.00 H new ATOM 460 N ARG A 31 24.689 -0.108 -15.953 1.00 0.00 N ATOM 461 CA ARG A 31 25.955 -0.313 -15.264 1.00 0.00 C ATOM 462 C ARG A 31 26.253 0.895 -14.379 1.00 0.00 C ATOM 463 O ARG A 31 25.859 2.018 -14.696 1.00 0.00 O ATOM 464 CB ARG A 31 27.089 -0.544 -16.269 1.00 0.00 C ATOM 465 CG ARG A 31 28.442 -0.781 -15.617 1.00 0.00 C ATOM 466 CD ARG A 31 29.081 -2.078 -16.086 1.00 0.00 C ATOM 467 NE ARG A 31 28.303 -3.256 -15.703 1.00 0.00 N ATOM 468 CZ ARG A 31 28.767 -4.237 -14.923 1.00 0.00 C ATOM 469 NH1 ARG A 31 29.972 -4.142 -14.370 1.00 0.00 N ATOM 470 NH2 ARG A 31 28.012 -5.299 -14.672 1.00 0.00 N ATOM 0 H ARG A 31 24.561 0.835 -16.321 1.00 0.00 H new ATOM 0 HA ARG A 31 25.881 -1.203 -14.639 1.00 0.00 H new ATOM 0 HB2 ARG A 31 26.841 -1.402 -16.893 1.00 0.00 H new ATOM 0 HB3 ARG A 31 27.160 0.320 -16.929 1.00 0.00 H new ATOM 0 HG2 ARG A 31 29.105 0.053 -15.845 1.00 0.00 H new ATOM 0 HG3 ARG A 31 28.323 -0.807 -14.534 1.00 0.00 H new ATOM 0 HD2 ARG A 31 29.189 -2.055 -17.170 1.00 0.00 H new ATOM 0 HD3 ARG A 31 30.084 -2.157 -15.667 1.00 0.00 H new ATOM 0 HE ARG A 31 27.348 -3.333 -16.053 1.00 0.00 H new ATOM 0 HH11 ARG A 31 30.548 -3.317 -14.540 1.00 0.00 H new ATOM 0 HH12 ARG A 31 30.321 -4.894 -13.776 1.00 0.00 H new ATOM 0 HH21 ARG A 31 27.077 -5.367 -15.074 1.00 0.00 H new ATOM 0 HH22 ARG A 31 28.366 -6.048 -14.077 1.00 0.00 H new ATOM 484 N PHE A 32 26.923 0.657 -13.261 1.00 0.00 N ATOM 485 CA PHE A 32 27.204 1.715 -12.299 1.00 0.00 C ATOM 486 C PHE A 32 28.288 2.664 -12.813 1.00 0.00 C ATOM 487 O PHE A 32 28.185 3.880 -12.657 1.00 0.00 O ATOM 488 CB PHE A 32 27.629 1.102 -10.959 1.00 0.00 C ATOM 489 CG PHE A 32 27.739 2.099 -9.839 1.00 0.00 C ATOM 490 CD1 PHE A 32 26.611 2.497 -9.139 1.00 0.00 C ATOM 491 CD2 PHE A 32 28.967 2.633 -9.484 1.00 0.00 C ATOM 492 CE1 PHE A 32 26.706 3.409 -8.107 1.00 0.00 C ATOM 493 CE2 PHE A 32 29.067 3.546 -8.453 1.00 0.00 C ATOM 494 CZ PHE A 32 27.937 3.934 -7.764 1.00 0.00 C ATOM 0 H PHE A 32 27.283 -0.260 -12.997 1.00 0.00 H new ATOM 0 HA PHE A 32 26.292 2.296 -12.158 1.00 0.00 H new ATOM 0 HB2 PHE A 32 26.909 0.333 -10.678 1.00 0.00 H new ATOM 0 HB3 PHE A 32 28.591 0.606 -11.087 1.00 0.00 H new ATOM 0 HD1 PHE A 32 25.647 2.089 -9.404 1.00 0.00 H new ATOM 0 HD2 PHE A 32 29.855 2.332 -10.019 1.00 0.00 H new ATOM 0 HE1 PHE A 32 25.820 3.711 -7.569 1.00 0.00 H new ATOM 0 HE2 PHE A 32 30.030 3.956 -8.186 1.00 0.00 H new ATOM 0 HZ PHE A 32 28.014 4.648 -6.957 1.00 0.00 H new ATOM 504 N SER A 33 29.320 2.105 -13.428 1.00 0.00 N ATOM 505 CA SER A 33 30.451 2.896 -13.894 1.00 0.00 C ATOM 506 C SER A 33 30.365 3.149 -15.400 1.00 0.00 C ATOM 507 O SER A 33 30.095 2.231 -16.177 1.00 0.00 O ATOM 508 CB SER A 33 31.753 2.174 -13.547 1.00 0.00 C ATOM 509 OG SER A 33 31.793 1.842 -12.165 1.00 0.00 O ATOM 0 H SER A 33 29.398 1.106 -13.616 1.00 0.00 H new ATOM 0 HA SER A 33 30.429 3.865 -13.395 1.00 0.00 H new ATOM 0 HB2 SER A 33 31.842 1.268 -14.146 1.00 0.00 H new ATOM 0 HB3 SER A 33 32.604 2.808 -13.798 1.00 0.00 H new ATOM 0 HG SER A 33 32.633 1.379 -11.964 1.00 0.00 H new ATOM 515 N GLU A 34 30.600 4.397 -15.797 1.00 0.00 N ATOM 516 CA GLU A 34 30.499 4.808 -17.196 1.00 0.00 C ATOM 517 C GLU A 34 31.573 4.137 -18.044 1.00 0.00 C ATOM 518 O GLU A 34 31.295 3.632 -19.128 1.00 0.00 O ATOM 519 CB GLU A 34 30.645 6.329 -17.337 1.00 0.00 C ATOM 520 CG GLU A 34 29.901 7.140 -16.286 1.00 0.00 C ATOM 521 CD GLU A 34 30.709 7.340 -15.017 1.00 0.00 C ATOM 522 OE1 GLU A 34 30.664 6.465 -14.128 1.00 0.00 O ATOM 523 OE2 GLU A 34 31.402 8.371 -14.908 1.00 0.00 O ATOM 0 H GLU A 34 30.865 5.150 -15.162 1.00 0.00 H new ATOM 0 HA GLU A 34 29.513 4.502 -17.546 1.00 0.00 H new ATOM 0 HB2 GLU A 34 31.704 6.584 -17.291 1.00 0.00 H new ATOM 0 HB3 GLU A 34 30.288 6.625 -18.324 1.00 0.00 H new ATOM 0 HG2 GLU A 34 29.640 8.113 -16.702 1.00 0.00 H new ATOM 0 HG3 GLU A 34 28.966 6.637 -16.040 1.00 0.00 H new ATOM 530 N ASP A 35 32.800 4.136 -17.531 1.00 0.00 N ATOM 531 CA ASP A 35 33.961 3.606 -18.253 1.00 0.00 C ATOM 532 C ASP A 35 33.811 2.117 -18.559 1.00 0.00 C ATOM 533 O ASP A 35 34.482 1.580 -19.439 1.00 0.00 O ATOM 534 CB ASP A 35 35.234 3.849 -17.431 1.00 0.00 C ATOM 535 CG ASP A 35 36.456 3.159 -18.004 1.00 0.00 C ATOM 536 OD1 ASP A 35 37.024 3.659 -18.997 1.00 0.00 O ATOM 537 OD2 ASP A 35 36.865 2.114 -17.454 1.00 0.00 O ATOM 0 H ASP A 35 33.021 4.501 -16.605 1.00 0.00 H new ATOM 0 HA ASP A 35 34.031 4.130 -19.206 1.00 0.00 H new ATOM 0 HB2 ASP A 35 35.423 4.921 -17.375 1.00 0.00 H new ATOM 0 HB3 ASP A 35 35.072 3.500 -16.411 1.00 0.00 H new ATOM 542 N SER A 36 32.899 1.463 -17.864 1.00 0.00 N ATOM 543 CA SER A 36 32.722 0.028 -18.000 1.00 0.00 C ATOM 544 C SER A 36 31.827 -0.315 -19.191 1.00 0.00 C ATOM 545 O SER A 36 31.189 -1.368 -19.220 1.00 0.00 O ATOM 546 CB SER A 36 32.131 -0.530 -16.710 1.00 0.00 C ATOM 547 OG SER A 36 32.948 -0.202 -15.596 1.00 0.00 O ATOM 0 H SER A 36 32.266 1.904 -17.197 1.00 0.00 H new ATOM 0 HA SER A 36 33.695 -0.427 -18.184 1.00 0.00 H new ATOM 0 HB2 SER A 36 31.128 -0.129 -16.561 1.00 0.00 H new ATOM 0 HB3 SER A 36 32.033 -1.613 -16.788 1.00 0.00 H new ATOM 0 HG SER A 36 32.641 -0.697 -14.808 1.00 0.00 H new ATOM 553 N PHE A 37 31.792 0.572 -20.176 1.00 0.00 N ATOM 554 CA PHE A 37 31.017 0.338 -21.381 1.00 0.00 C ATOM 555 C PHE A 37 31.873 -0.368 -22.426 1.00 0.00 C ATOM 556 O PHE A 37 33.094 -0.197 -22.467 1.00 0.00 O ATOM 557 CB PHE A 37 30.472 1.659 -21.947 1.00 0.00 C ATOM 558 CG PHE A 37 31.505 2.521 -22.625 1.00 0.00 C ATOM 559 CD1 PHE A 37 32.440 3.229 -21.887 1.00 0.00 C ATOM 560 CD2 PHE A 37 31.532 2.627 -24.006 1.00 0.00 C ATOM 561 CE1 PHE A 37 33.382 4.023 -22.512 1.00 0.00 C ATOM 562 CE2 PHE A 37 32.472 3.418 -24.637 1.00 0.00 C ATOM 563 CZ PHE A 37 33.398 4.118 -23.889 1.00 0.00 C ATOM 0 H PHE A 37 32.293 1.460 -20.162 1.00 0.00 H new ATOM 0 HA PHE A 37 30.170 -0.299 -21.125 1.00 0.00 H new ATOM 0 HB2 PHE A 37 29.679 1.434 -22.661 1.00 0.00 H new ATOM 0 HB3 PHE A 37 30.018 2.228 -21.135 1.00 0.00 H new ATOM 0 HD1 PHE A 37 32.432 3.159 -20.809 1.00 0.00 H new ATOM 0 HD2 PHE A 37 30.809 2.084 -24.597 1.00 0.00 H new ATOM 0 HE1 PHE A 37 34.105 4.569 -21.924 1.00 0.00 H new ATOM 0 HE2 PHE A 37 32.483 3.489 -25.715 1.00 0.00 H new ATOM 0 HZ PHE A 37 34.133 4.738 -24.380 1.00 0.00 H new ATOM 573 N GLY A 38 31.235 -1.175 -23.252 1.00 0.00 N ATOM 574 CA GLY A 38 31.939 -1.829 -24.331 1.00 0.00 C ATOM 575 C GLY A 38 31.661 -1.155 -25.653 1.00 0.00 C ATOM 576 O GLY A 38 30.842 -0.240 -25.717 1.00 0.00 O ATOM 0 H GLY A 38 30.240 -1.390 -23.196 1.00 0.00 H new ATOM 0 HA2 GLY A 38 33.010 -1.815 -24.131 1.00 0.00 H new ATOM 0 HA3 GLY A 38 31.638 -2.875 -24.383 1.00 0.00 H new ATOM 580 N MET A 39 32.305 -1.620 -26.714 1.00 0.00 N ATOM 581 CA MET A 39 32.127 -1.027 -28.039 1.00 0.00 C ATOM 582 C MET A 39 30.736 -1.326 -28.590 1.00 0.00 C ATOM 583 O MET A 39 30.382 -0.904 -29.690 1.00 0.00 O ATOM 584 CB MET A 39 33.198 -1.530 -29.006 1.00 0.00 C ATOM 585 CG MET A 39 34.603 -1.092 -28.629 1.00 0.00 C ATOM 586 SD MET A 39 34.797 0.701 -28.625 1.00 0.00 S ATOM 587 CE MET A 39 36.472 0.855 -28.008 1.00 0.00 C ATOM 0 H MET A 39 32.956 -2.405 -26.687 1.00 0.00 H new ATOM 0 HA MET A 39 32.230 0.053 -27.937 1.00 0.00 H new ATOM 0 HB2 MET A 39 33.162 -2.619 -29.042 1.00 0.00 H new ATOM 0 HB3 MET A 39 32.970 -1.170 -30.009 1.00 0.00 H new ATOM 0 HG2 MET A 39 34.848 -1.482 -27.641 1.00 0.00 H new ATOM 0 HG3 MET A 39 35.315 -1.529 -29.329 1.00 0.00 H new ATOM 0 HE1 MET A 39 36.742 1.909 -27.948 1.00 0.00 H new ATOM 0 HE2 MET A 39 36.537 0.406 -27.017 1.00 0.00 H new ATOM 0 HE3 MET A 39 37.157 0.343 -28.684 1.00 0.00 H new ATOM 597 N ASP A 40 29.953 -2.060 -27.812 1.00 0.00 N ATOM 598 CA ASP A 40 28.570 -2.343 -28.157 1.00 0.00 C ATOM 599 C ASP A 40 27.678 -1.178 -27.758 1.00 0.00 C ATOM 600 O ASP A 40 26.504 -1.126 -28.123 1.00 0.00 O ATOM 601 CB ASP A 40 28.086 -3.609 -27.453 1.00 0.00 C ATOM 602 CG ASP A 40 28.888 -4.831 -27.832 1.00 0.00 C ATOM 603 OD1 ASP A 40 28.575 -5.456 -28.864 1.00 0.00 O ATOM 604 OD2 ASP A 40 29.827 -5.180 -27.090 1.00 0.00 O ATOM 0 H ASP A 40 30.257 -2.473 -26.930 1.00 0.00 H new ATOM 0 HA ASP A 40 28.516 -2.491 -29.236 1.00 0.00 H new ATOM 0 HB2 ASP A 40 28.142 -3.463 -26.374 1.00 0.00 H new ATOM 0 HB3 ASP A 40 27.037 -3.778 -27.698 1.00 0.00 H new ATOM 609 N VAL A 41 28.240 -0.260 -26.986 1.00 0.00 N ATOM 610 CA VAL A 41 27.509 0.902 -26.507 1.00 0.00 C ATOM 611 C VAL A 41 28.306 2.165 -26.799 1.00 0.00 C ATOM 612 O VAL A 41 29.463 2.277 -26.400 1.00 0.00 O ATOM 613 CB VAL A 41 27.247 0.826 -24.984 1.00 0.00 C ATOM 614 CG1 VAL A 41 26.367 1.982 -24.530 1.00 0.00 C ATOM 615 CG2 VAL A 41 26.623 -0.507 -24.598 1.00 0.00 C ATOM 0 H VAL A 41 29.211 -0.299 -26.676 1.00 0.00 H new ATOM 0 HA VAL A 41 26.550 0.923 -27.025 1.00 0.00 H new ATOM 0 HB VAL A 41 28.208 0.905 -24.476 1.00 0.00 H new ATOM 0 HG11 VAL A 41 26.196 1.909 -23.456 1.00 0.00 H new ATOM 0 HG12 VAL A 41 26.862 2.927 -24.755 1.00 0.00 H new ATOM 0 HG13 VAL A 41 25.412 1.940 -25.054 1.00 0.00 H new ATOM 0 HG21 VAL A 41 26.451 -0.530 -23.522 1.00 0.00 H new ATOM 0 HG22 VAL A 41 25.674 -0.629 -25.120 1.00 0.00 H new ATOM 0 HG23 VAL A 41 27.297 -1.318 -24.875 1.00 0.00 H new ATOM 625 N ALA A 42 27.701 3.103 -27.507 1.00 0.00 N ATOM 626 CA ALA A 42 28.342 4.383 -27.757 1.00 0.00 C ATOM 627 C ALA A 42 28.340 5.214 -26.480 1.00 0.00 C ATOM 628 O ALA A 42 27.376 5.173 -25.714 1.00 0.00 O ATOM 629 CB ALA A 42 27.639 5.122 -28.884 1.00 0.00 C ATOM 0 H ALA A 42 26.772 3.004 -27.917 1.00 0.00 H new ATOM 0 HA ALA A 42 29.374 4.211 -28.063 1.00 0.00 H new ATOM 0 HB1 ALA A 42 28.133 6.078 -29.056 1.00 0.00 H new ATOM 0 HB2 ALA A 42 27.681 4.523 -29.794 1.00 0.00 H new ATOM 0 HB3 ALA A 42 26.598 5.296 -28.611 1.00 0.00 H new ATOM 635 N ASP A 43 29.415 5.955 -26.245 1.00 0.00 N ATOM 636 CA ASP A 43 29.544 6.752 -25.025 1.00 0.00 C ATOM 637 C ASP A 43 28.477 7.847 -24.965 1.00 0.00 C ATOM 638 O ASP A 43 28.069 8.265 -23.883 1.00 0.00 O ATOM 639 CB ASP A 43 30.951 7.357 -24.903 1.00 0.00 C ATOM 640 CG ASP A 43 31.276 8.362 -25.992 1.00 0.00 C ATOM 641 OD1 ASP A 43 31.540 7.941 -27.139 1.00 0.00 O ATOM 642 OD2 ASP A 43 31.289 9.576 -25.704 1.00 0.00 O ATOM 0 H ASP A 43 30.211 6.023 -26.880 1.00 0.00 H new ATOM 0 HA ASP A 43 29.390 6.083 -24.178 1.00 0.00 H new ATOM 0 HB2 ASP A 43 31.046 7.843 -23.932 1.00 0.00 H new ATOM 0 HB3 ASP A 43 31.687 6.553 -24.930 1.00 0.00 H new ATOM 647 N ASP A 44 28.014 8.292 -26.128 1.00 0.00 N ATOM 648 CA ASP A 44 26.915 9.253 -26.202 1.00 0.00 C ATOM 649 C ASP A 44 25.598 8.585 -25.815 1.00 0.00 C ATOM 650 O ASP A 44 24.703 9.224 -25.260 1.00 0.00 O ATOM 651 CB ASP A 44 26.810 9.835 -27.617 1.00 0.00 C ATOM 652 CG ASP A 44 25.614 10.754 -27.792 1.00 0.00 C ATOM 653 OD1 ASP A 44 25.724 11.953 -27.462 1.00 0.00 O ATOM 654 OD2 ASP A 44 24.561 10.287 -28.276 1.00 0.00 O ATOM 0 H ASP A 44 28.382 8.003 -27.034 1.00 0.00 H new ATOM 0 HA ASP A 44 27.118 10.063 -25.502 1.00 0.00 H new ATOM 0 HB2 ASP A 44 27.722 10.387 -27.846 1.00 0.00 H new ATOM 0 HB3 ASP A 44 26.742 9.018 -28.336 1.00 0.00 H new ATOM 659 N SER A 45 25.508 7.288 -26.079 1.00 0.00 N ATOM 660 CA SER A 45 24.294 6.526 -25.818 1.00 0.00 C ATOM 661 C SER A 45 24.209 6.102 -24.351 1.00 0.00 C ATOM 662 O SER A 45 23.203 5.537 -23.918 1.00 0.00 O ATOM 663 CB SER A 45 24.247 5.294 -26.722 1.00 0.00 C ATOM 664 OG SER A 45 24.364 5.662 -28.087 1.00 0.00 O ATOM 0 H SER A 45 26.269 6.738 -26.477 1.00 0.00 H new ATOM 0 HA SER A 45 23.439 7.167 -26.034 1.00 0.00 H new ATOM 0 HB2 SER A 45 25.054 4.611 -26.455 1.00 0.00 H new ATOM 0 HB3 SER A 45 23.311 4.758 -26.565 1.00 0.00 H new ATOM 0 HG SER A 45 24.333 4.858 -28.646 1.00 0.00 H new ATOM 670 N ILE A 46 25.271 6.358 -23.596 1.00 0.00 N ATOM 671 CA ILE A 46 25.264 6.092 -22.167 1.00 0.00 C ATOM 672 C ILE A 46 24.335 7.081 -21.470 1.00 0.00 C ATOM 673 O ILE A 46 24.682 8.247 -21.273 1.00 0.00 O ATOM 674 CB ILE A 46 26.682 6.185 -21.555 1.00 0.00 C ATOM 675 CG1 ILE A 46 27.620 5.172 -22.219 1.00 0.00 C ATOM 676 CG2 ILE A 46 26.630 5.953 -20.052 1.00 0.00 C ATOM 677 CD1 ILE A 46 29.038 5.215 -21.686 1.00 0.00 C ATOM 0 H ILE A 46 26.144 6.748 -23.950 1.00 0.00 H new ATOM 0 HA ILE A 46 24.907 5.073 -22.018 1.00 0.00 H new ATOM 0 HB ILE A 46 27.070 7.187 -21.737 1.00 0.00 H new ATOM 0 HG12 ILE A 46 27.218 4.169 -22.076 1.00 0.00 H new ATOM 0 HG13 ILE A 46 27.639 5.357 -23.293 1.00 0.00 H new ATOM 0 HG21 ILE A 46 27.636 6.022 -19.638 1.00 0.00 H new ATOM 0 HG22 ILE A 46 25.995 6.708 -19.589 1.00 0.00 H new ATOM 0 HG23 ILE A 46 26.222 4.962 -19.851 1.00 0.00 H new ATOM 0 HD11 ILE A 46 29.644 4.471 -22.203 1.00 0.00 H new ATOM 0 HD12 ILE A 46 29.460 6.206 -21.854 1.00 0.00 H new ATOM 0 HD13 ILE A 46 29.032 4.999 -20.618 1.00 0.00 H new ATOM 689 N THR A 47 23.144 6.618 -21.130 1.00 0.00 N ATOM 690 CA THR A 47 22.130 7.478 -20.555 1.00 0.00 C ATOM 691 C THR A 47 22.053 7.302 -19.044 1.00 0.00 C ATOM 692 O THR A 47 21.756 6.214 -18.551 1.00 0.00 O ATOM 693 CB THR A 47 20.747 7.176 -21.162 1.00 0.00 C ATOM 694 OG1 THR A 47 20.854 7.064 -22.587 1.00 0.00 O ATOM 695 CG2 THR A 47 19.750 8.272 -20.814 1.00 0.00 C ATOM 0 H THR A 47 22.857 5.646 -21.244 1.00 0.00 H new ATOM 0 HA THR A 47 22.412 8.506 -20.783 1.00 0.00 H new ATOM 0 HB THR A 47 20.390 6.234 -20.745 1.00 0.00 H new ATOM 0 HG1 THR A 47 19.972 6.870 -22.967 1.00 0.00 H new ATOM 0 HG21 THR A 47 18.781 8.036 -21.254 1.00 0.00 H new ATOM 0 HG22 THR A 47 19.649 8.342 -19.731 1.00 0.00 H new ATOM 0 HG23 THR A 47 20.105 9.225 -21.207 1.00 0.00 H new ATOM 703 N PRO A 48 22.345 8.366 -18.289 1.00 0.00 N ATOM 704 CA PRO A 48 22.133 8.380 -16.845 1.00 0.00 C ATOM 705 C PRO A 48 20.657 8.187 -16.526 1.00 0.00 C ATOM 706 O PRO A 48 19.806 8.863 -17.105 1.00 0.00 O ATOM 707 CB PRO A 48 22.594 9.778 -16.412 1.00 0.00 C ATOM 708 CG PRO A 48 23.427 10.290 -17.539 1.00 0.00 C ATOM 709 CD PRO A 48 22.906 9.631 -18.785 1.00 0.00 C ATOM 0 HA PRO A 48 22.672 7.583 -16.333 1.00 0.00 H new ATOM 0 HB2 PRO A 48 21.742 10.432 -16.225 1.00 0.00 H new ATOM 0 HB3 PRO A 48 23.170 9.733 -15.488 1.00 0.00 H new ATOM 0 HG2 PRO A 48 23.354 11.375 -17.614 1.00 0.00 H new ATOM 0 HG3 PRO A 48 24.479 10.051 -17.384 1.00 0.00 H new ATOM 0 HD2 PRO A 48 22.149 10.242 -19.276 1.00 0.00 H new ATOM 0 HD3 PRO A 48 23.700 9.461 -19.512 1.00 0.00 H new ATOM 717 N THR A 49 20.347 7.269 -15.621 1.00 0.00 N ATOM 718 CA THR A 49 18.958 6.967 -15.293 1.00 0.00 C ATOM 719 C THR A 49 18.230 8.201 -14.743 1.00 0.00 C ATOM 720 O THR A 49 17.010 8.320 -14.879 1.00 0.00 O ATOM 721 CB THR A 49 18.850 5.795 -14.292 1.00 0.00 C ATOM 722 OG1 THR A 49 17.473 5.471 -14.053 1.00 0.00 O ATOM 723 CG2 THR A 49 19.533 6.130 -12.978 1.00 0.00 C ATOM 0 H THR A 49 21.034 6.722 -15.102 1.00 0.00 H new ATOM 0 HA THR A 49 18.473 6.667 -16.222 1.00 0.00 H new ATOM 0 HB THR A 49 19.353 4.934 -14.731 1.00 0.00 H new ATOM 0 HG1 THR A 49 17.340 4.506 -14.164 1.00 0.00 H new ATOM 0 HG21 THR A 49 19.440 5.286 -12.294 1.00 0.00 H new ATOM 0 HG22 THR A 49 20.588 6.336 -13.159 1.00 0.00 H new ATOM 0 HG23 THR A 49 19.062 7.008 -12.537 1.00 0.00 H new ATOM 731 N SER A 50 18.982 9.130 -14.156 1.00 0.00 N ATOM 732 CA SER A 50 18.412 10.373 -13.641 1.00 0.00 C ATOM 733 C SER A 50 17.936 11.272 -14.785 1.00 0.00 C ATOM 734 O SER A 50 17.166 12.208 -14.574 1.00 0.00 O ATOM 735 CB SER A 50 19.450 11.115 -12.799 1.00 0.00 C ATOM 736 OG SER A 50 20.026 10.256 -11.831 1.00 0.00 O ATOM 0 H SER A 50 19.990 9.045 -14.025 1.00 0.00 H new ATOM 0 HA SER A 50 17.553 10.121 -13.019 1.00 0.00 H new ATOM 0 HB2 SER A 50 20.231 11.514 -13.446 1.00 0.00 H new ATOM 0 HB3 SER A 50 18.981 11.965 -12.303 1.00 0.00 H new ATOM 0 HG SER A 50 19.851 10.610 -10.934 1.00 0.00 H new ATOM 742 N GLU A 51 18.413 10.989 -15.990 1.00 0.00 N ATOM 743 CA GLU A 51 18.019 11.736 -17.176 1.00 0.00 C ATOM 744 C GLU A 51 17.267 10.828 -18.141 1.00 0.00 C ATOM 745 O GLU A 51 16.888 11.238 -19.236 1.00 0.00 O ATOM 746 CB GLU A 51 19.256 12.328 -17.858 1.00 0.00 C ATOM 747 CG GLU A 51 19.927 13.423 -17.045 1.00 0.00 C ATOM 748 CD GLU A 51 21.295 13.801 -17.576 1.00 0.00 C ATOM 749 OE1 GLU A 51 21.386 14.296 -18.719 1.00 0.00 O ATOM 750 OE2 GLU A 51 22.284 13.626 -16.836 1.00 0.00 O ATOM 0 H GLU A 51 19.080 10.239 -16.172 1.00 0.00 H new ATOM 0 HA GLU A 51 17.359 12.551 -16.878 1.00 0.00 H new ATOM 0 HB2 GLU A 51 19.976 11.531 -18.044 1.00 0.00 H new ATOM 0 HB3 GLU A 51 18.969 12.731 -18.829 1.00 0.00 H new ATOM 0 HG2 GLU A 51 19.289 14.307 -17.039 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.023 13.093 -16.011 1.00 0.00 H new ATOM 757 N PHE A 52 17.051 9.588 -17.717 1.00 0.00 N ATOM 758 CA PHE A 52 16.377 8.601 -18.546 1.00 0.00 C ATOM 759 C PHE A 52 14.884 8.589 -18.257 1.00 0.00 C ATOM 760 O PHE A 52 14.069 8.553 -19.174 1.00 0.00 O ATOM 761 CB PHE A 52 16.967 7.204 -18.311 1.00 0.00 C ATOM 762 CG PHE A 52 16.359 6.137 -19.179 1.00 0.00 C ATOM 763 CD1 PHE A 52 16.649 6.083 -20.532 1.00 0.00 C ATOM 764 CD2 PHE A 52 15.500 5.188 -18.643 1.00 0.00 C ATOM 765 CE1 PHE A 52 16.097 5.105 -21.335 1.00 0.00 C ATOM 766 CE2 PHE A 52 14.945 4.209 -19.442 1.00 0.00 C ATOM 767 CZ PHE A 52 15.243 4.167 -20.789 1.00 0.00 C ATOM 0 H PHE A 52 17.335 9.243 -16.800 1.00 0.00 H new ATOM 0 HA PHE A 52 16.530 8.875 -19.590 1.00 0.00 H new ATOM 0 HB2 PHE A 52 18.041 7.238 -18.491 1.00 0.00 H new ATOM 0 HB3 PHE A 52 16.828 6.932 -17.265 1.00 0.00 H new ATOM 0 HD1 PHE A 52 17.315 6.815 -20.964 1.00 0.00 H new ATOM 0 HD2 PHE A 52 15.263 5.216 -17.590 1.00 0.00 H new ATOM 0 HE1 PHE A 52 16.333 5.074 -22.389 1.00 0.00 H new ATOM 0 HE2 PHE A 52 14.278 3.476 -19.013 1.00 0.00 H new ATOM 0 HZ PHE A 52 14.809 3.402 -21.415 1.00 0.00 H new ATOM 777 N VAL A 53 14.527 8.626 -16.977 1.00 0.00 N ATOM 778 CA VAL A 53 13.124 8.590 -16.588 1.00 0.00 C ATOM 779 C VAL A 53 12.412 9.880 -16.989 1.00 0.00 C ATOM 780 O VAL A 53 11.189 9.910 -17.133 1.00 0.00 O ATOM 781 CB VAL A 53 12.946 8.341 -15.077 1.00 0.00 C ATOM 782 CG1 VAL A 53 13.541 6.998 -14.683 1.00 0.00 C ATOM 783 CG2 VAL A 53 13.567 9.463 -14.257 1.00 0.00 C ATOM 0 H VAL A 53 15.184 8.680 -16.199 1.00 0.00 H new ATOM 0 HA VAL A 53 12.673 7.753 -17.121 1.00 0.00 H new ATOM 0 HB VAL A 53 11.877 8.323 -14.864 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.406 6.840 -13.613 1.00 0.00 H new ATOM 0 HG12 VAL A 53 13.039 6.202 -15.234 1.00 0.00 H new ATOM 0 HG13 VAL A 53 14.605 6.988 -14.920 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.425 9.259 -13.196 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.633 9.526 -14.475 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.088 10.408 -14.512 1.00 0.00 H new ATOM 793 N TRP A 54 13.187 10.939 -17.175 1.00 0.00 N ATOM 794 CA TRP A 54 12.650 12.186 -17.685 1.00 0.00 C ATOM 795 C TRP A 54 12.675 12.160 -19.205 1.00 0.00 C ATOM 796 O TRP A 54 13.737 12.105 -19.821 1.00 0.00 O ATOM 797 CB TRP A 54 13.453 13.384 -17.168 1.00 0.00 C ATOM 798 CG TRP A 54 13.330 13.596 -15.691 1.00 0.00 C ATOM 799 CD1 TRP A 54 14.181 13.148 -14.723 1.00 0.00 C ATOM 800 CD2 TRP A 54 12.294 14.316 -15.012 1.00 0.00 C ATOM 801 NE1 TRP A 54 13.738 13.542 -13.484 1.00 0.00 N ATOM 802 CE2 TRP A 54 12.582 14.261 -13.634 1.00 0.00 C ATOM 803 CE3 TRP A 54 11.151 15.001 -15.435 1.00 0.00 C ATOM 804 CZ2 TRP A 54 11.767 14.866 -12.680 1.00 0.00 C ATOM 805 CZ3 TRP A 54 10.344 15.600 -14.487 1.00 0.00 C ATOM 806 CH2 TRP A 54 10.655 15.529 -13.123 1.00 0.00 C ATOM 0 H TRP A 54 14.188 10.957 -16.980 1.00 0.00 H new ATOM 0 HA TRP A 54 11.623 12.293 -17.335 1.00 0.00 H new ATOM 0 HB2 TRP A 54 14.504 13.242 -17.420 1.00 0.00 H new ATOM 0 HB3 TRP A 54 13.120 14.284 -17.685 1.00 0.00 H new ATOM 0 HD1 TRP A 54 15.074 12.568 -14.905 1.00 0.00 H new ATOM 0 HE1 TRP A 54 14.195 13.333 -12.597 1.00 0.00 H new ATOM 0 HE3 TRP A 54 10.903 15.061 -16.484 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 12.004 14.814 -11.628 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 9.459 16.132 -14.803 1.00 0.00 H new ATOM 0 HH2 TRP A 54 10.004 16.007 -12.406 1.00 0.00 H new ATOM 817 N SER A 55 11.502 12.193 -19.799 1.00 0.00 N ATOM 818 CA SER A 55 11.380 12.148 -21.238 1.00 0.00 C ATOM 819 C SER A 55 11.181 13.551 -21.786 1.00 0.00 C ATOM 820 O SER A 55 10.151 14.188 -21.544 1.00 0.00 O ATOM 821 CB SER A 55 10.213 11.243 -21.642 1.00 0.00 C ATOM 822 OG SER A 55 10.077 11.171 -23.052 1.00 0.00 O ATOM 0 H SER A 55 10.613 12.251 -19.302 1.00 0.00 H new ATOM 0 HA SER A 55 12.297 11.736 -21.659 1.00 0.00 H new ATOM 0 HB2 SER A 55 10.370 10.243 -21.239 1.00 0.00 H new ATOM 0 HB3 SER A 55 9.289 11.621 -21.205 1.00 0.00 H new ATOM 0 HG SER A 55 9.325 10.585 -23.279 1.00 0.00 H new ATOM 828 N SER A 56 12.178 14.044 -22.496 1.00 0.00 N ATOM 829 CA SER A 56 12.080 15.341 -23.125 1.00 0.00 C ATOM 830 C SER A 56 11.172 15.251 -24.347 1.00 0.00 C ATOM 831 O SER A 56 11.481 14.556 -25.318 1.00 0.00 O ATOM 832 CB SER A 56 13.475 15.828 -23.521 1.00 0.00 C ATOM 833 OG SER A 56 14.374 15.695 -22.432 1.00 0.00 O ATOM 0 H SER A 56 13.064 13.563 -22.650 1.00 0.00 H new ATOM 0 HA SER A 56 11.649 16.057 -22.425 1.00 0.00 H new ATOM 0 HB2 SER A 56 13.839 15.254 -24.373 1.00 0.00 H new ATOM 0 HB3 SER A 56 13.427 16.870 -23.836 1.00 0.00 H new ATOM 0 HG SER A 56 15.263 16.009 -22.701 1.00 0.00 H new ATOM 839 N VAL A 57 10.036 15.927 -24.275 1.00 0.00 N ATOM 840 CA VAL A 57 9.098 15.970 -25.387 1.00 0.00 C ATOM 841 C VAL A 57 9.073 17.365 -25.982 1.00 0.00 C ATOM 842 O VAL A 57 8.427 17.618 -26.998 1.00 0.00 O ATOM 843 CB VAL A 57 7.671 15.564 -24.954 1.00 0.00 C ATOM 844 CG1 VAL A 57 7.634 14.101 -24.541 1.00 0.00 C ATOM 845 CG2 VAL A 57 7.173 16.455 -23.823 1.00 0.00 C ATOM 0 H VAL A 57 9.740 16.456 -23.454 1.00 0.00 H new ATOM 0 HA VAL A 57 9.436 15.251 -26.134 1.00 0.00 H new ATOM 0 HB VAL A 57 7.006 15.697 -25.807 1.00 0.00 H new ATOM 0 HG11 VAL A 57 6.621 13.834 -24.239 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.939 13.478 -25.382 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.315 13.941 -23.705 1.00 0.00 H new ATOM 0 HG21 VAL A 57 6.167 16.150 -23.536 1.00 0.00 H new ATOM 0 HG22 VAL A 57 7.839 16.361 -22.966 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.156 17.492 -24.158 1.00 0.00 H new ATOM 855 N ARG A 58 9.799 18.257 -25.335 1.00 0.00 N ATOM 856 CA ARG A 58 9.902 19.636 -25.753 1.00 0.00 C ATOM 857 C ARG A 58 11.257 20.160 -25.295 1.00 0.00 C ATOM 858 O ARG A 58 11.920 19.507 -24.490 1.00 0.00 O ATOM 859 CB ARG A 58 8.753 20.450 -25.147 1.00 0.00 C ATOM 860 CG ARG A 58 8.558 21.821 -25.769 1.00 0.00 C ATOM 861 CD ARG A 58 7.287 22.473 -25.255 1.00 0.00 C ATOM 862 NE ARG A 58 7.061 23.796 -25.833 1.00 0.00 N ATOM 863 CZ ARG A 58 5.852 24.287 -26.113 1.00 0.00 C ATOM 864 NH1 ARG A 58 4.767 23.545 -25.913 1.00 0.00 N ATOM 865 NH2 ARG A 58 5.733 25.514 -26.600 1.00 0.00 N ATOM 0 H ARG A 58 10.338 18.039 -24.497 1.00 0.00 H new ATOM 0 HA ARG A 58 9.826 19.724 -26.837 1.00 0.00 H new ATOM 0 HB2 ARG A 58 7.828 19.883 -25.251 1.00 0.00 H new ATOM 0 HB3 ARG A 58 8.934 20.572 -24.079 1.00 0.00 H new ATOM 0 HG2 ARG A 58 9.415 22.454 -25.539 1.00 0.00 H new ATOM 0 HG3 ARG A 58 8.511 21.729 -26.854 1.00 0.00 H new ATOM 0 HD2 ARG A 58 6.436 21.831 -25.482 1.00 0.00 H new ATOM 0 HD3 ARG A 58 7.340 22.559 -24.170 1.00 0.00 H new ATOM 0 HE ARG A 58 7.874 24.378 -26.034 1.00 0.00 H new ATOM 0 HH11 ARG A 58 4.857 22.598 -25.545 1.00 0.00 H new ATOM 0 HH12 ARG A 58 3.844 23.923 -26.128 1.00 0.00 H new ATOM 0 HH21 ARG A 58 6.565 26.082 -26.760 1.00 0.00 H new ATOM 0 HH22 ARG A 58 4.809 25.890 -26.814 1.00 0.00 H new ATOM 879 N ASP A 59 11.670 21.307 -25.811 1.00 0.00 N ATOM 880 CA ASP A 59 12.986 21.861 -25.498 1.00 0.00 C ATOM 881 C ASP A 59 13.126 22.151 -24.008 1.00 0.00 C ATOM 882 O ASP A 59 14.086 21.722 -23.370 1.00 0.00 O ATOM 883 CB ASP A 59 13.226 23.143 -26.296 1.00 0.00 C ATOM 884 CG ASP A 59 13.162 22.916 -27.792 1.00 0.00 C ATOM 885 OD1 ASP A 59 12.047 22.963 -28.357 1.00 0.00 O ATOM 886 OD2 ASP A 59 14.223 22.701 -28.412 1.00 0.00 O ATOM 0 H ASP A 59 11.115 21.876 -26.450 1.00 0.00 H new ATOM 0 HA ASP A 59 13.733 21.117 -25.775 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.482 23.888 -26.013 1.00 0.00 H new ATOM 0 HB3 ASP A 59 14.202 23.552 -26.035 1.00 0.00 H new ATOM 891 N ASP A 60 12.167 22.883 -23.463 1.00 0.00 N ATOM 892 CA ASP A 60 12.200 23.261 -22.053 1.00 0.00 C ATOM 893 C ASP A 60 11.336 22.323 -21.212 1.00 0.00 C ATOM 894 O ASP A 60 11.652 22.035 -20.059 1.00 0.00 O ATOM 895 CB ASP A 60 11.714 24.704 -21.897 1.00 0.00 C ATOM 896 CG ASP A 60 11.808 25.216 -20.474 1.00 0.00 C ATOM 897 OD1 ASP A 60 12.864 25.772 -20.110 1.00 0.00 O ATOM 898 OD2 ASP A 60 10.820 25.091 -19.724 1.00 0.00 O ATOM 0 H ASP A 60 11.354 23.229 -23.973 1.00 0.00 H new ATOM 0 HA ASP A 60 13.227 23.182 -21.698 1.00 0.00 H new ATOM 0 HB2 ASP A 60 12.302 25.351 -22.548 1.00 0.00 H new ATOM 0 HB3 ASP A 60 10.679 24.770 -22.232 1.00 0.00 H new ATOM 903 N VAL A 61 10.258 21.832 -21.806 1.00 0.00 N ATOM 904 CA VAL A 61 9.284 21.025 -21.081 1.00 0.00 C ATOM 905 C VAL A 61 9.605 19.532 -21.168 1.00 0.00 C ATOM 906 O VAL A 61 9.570 18.933 -22.247 1.00 0.00 O ATOM 907 CB VAL A 61 7.853 21.269 -21.608 1.00 0.00 C ATOM 908 CG1 VAL A 61 6.831 20.490 -20.791 1.00 0.00 C ATOM 909 CG2 VAL A 61 7.523 22.754 -21.604 1.00 0.00 C ATOM 0 H VAL A 61 10.034 21.978 -22.790 1.00 0.00 H new ATOM 0 HA VAL A 61 9.341 21.333 -20.037 1.00 0.00 H new ATOM 0 HB VAL A 61 7.808 20.911 -22.636 1.00 0.00 H new ATOM 0 HG11 VAL A 61 5.832 20.679 -21.183 1.00 0.00 H new ATOM 0 HG12 VAL A 61 7.050 19.424 -20.855 1.00 0.00 H new ATOM 0 HG13 VAL A 61 6.879 20.808 -19.750 1.00 0.00 H new ATOM 0 HG21 VAL A 61 6.510 22.903 -21.979 1.00 0.00 H new ATOM 0 HG22 VAL A 61 7.594 23.140 -20.587 1.00 0.00 H new ATOM 0 HG23 VAL A 61 8.228 23.285 -22.243 1.00 0.00 H new ATOM 919 N MET A 62 9.919 18.941 -20.025 1.00 0.00 N ATOM 920 CA MET A 62 10.151 17.503 -19.933 1.00 0.00 C ATOM 921 C MET A 62 8.989 16.839 -19.203 1.00 0.00 C ATOM 922 O MET A 62 8.266 17.499 -18.460 1.00 0.00 O ATOM 923 CB MET A 62 11.456 17.216 -19.187 1.00 0.00 C ATOM 924 CG MET A 62 12.694 17.777 -19.864 1.00 0.00 C ATOM 925 SD MET A 62 14.188 17.531 -18.883 1.00 0.00 S ATOM 926 CE MET A 62 13.801 18.502 -17.427 1.00 0.00 C ATOM 0 H MET A 62 10.020 19.438 -19.140 1.00 0.00 H new ATOM 0 HA MET A 62 10.227 17.098 -20.942 1.00 0.00 H new ATOM 0 HB2 MET A 62 11.386 17.631 -18.181 1.00 0.00 H new ATOM 0 HB3 MET A 62 11.571 16.137 -19.080 1.00 0.00 H new ATOM 0 HG2 MET A 62 12.819 17.302 -20.837 1.00 0.00 H new ATOM 0 HG3 MET A 62 12.554 18.843 -20.046 1.00 0.00 H new ATOM 0 HE1 MET A 62 14.726 18.807 -16.937 1.00 0.00 H new ATOM 0 HE2 MET A 62 13.236 19.387 -17.720 1.00 0.00 H new ATOM 0 HE3 MET A 62 13.206 17.903 -16.738 1.00 0.00 H new ATOM 936 N ARG A 63 8.802 15.543 -19.414 1.00 0.00 N ATOM 937 CA ARG A 63 7.758 14.803 -18.712 1.00 0.00 C ATOM 938 C ARG A 63 8.332 13.533 -18.099 1.00 0.00 C ATOM 939 O ARG A 63 9.220 12.908 -18.673 1.00 0.00 O ATOM 940 CB ARG A 63 6.601 14.439 -19.655 1.00 0.00 C ATOM 941 CG ARG A 63 6.990 13.474 -20.767 1.00 0.00 C ATOM 942 CD ARG A 63 5.771 12.906 -21.481 1.00 0.00 C ATOM 943 NE ARG A 63 4.905 12.146 -20.577 1.00 0.00 N ATOM 944 CZ ARG A 63 4.903 10.812 -20.479 1.00 0.00 C ATOM 945 NH1 ARG A 63 5.723 10.080 -21.227 1.00 0.00 N ATOM 946 NH2 ARG A 63 4.069 10.210 -19.642 1.00 0.00 N ATOM 0 H ARG A 63 9.356 14.983 -20.062 1.00 0.00 H new ATOM 0 HA ARG A 63 7.371 15.447 -17.922 1.00 0.00 H new ATOM 0 HB2 ARG A 63 5.794 13.997 -19.070 1.00 0.00 H new ATOM 0 HB3 ARG A 63 6.208 15.353 -20.101 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.625 13.989 -21.488 1.00 0.00 H new ATOM 0 HG3 ARG A 63 7.579 12.657 -20.349 1.00 0.00 H new ATOM 0 HD2 ARG A 63 5.201 13.721 -21.928 1.00 0.00 H new ATOM 0 HD3 ARG A 63 6.098 12.261 -22.297 1.00 0.00 H new ATOM 0 HE ARG A 63 4.261 12.668 -19.983 1.00 0.00 H new ATOM 0 HH11 ARG A 63 6.359 10.535 -21.881 1.00 0.00 H new ATOM 0 HH12 ARG A 63 5.716 9.063 -21.147 1.00 0.00 H new ATOM 0 HH21 ARG A 63 3.429 10.764 -19.073 1.00 0.00 H new ATOM 0 HH22 ARG A 63 4.067 9.193 -19.567 1.00 0.00 H new ATOM 960 N LEU A 64 7.837 13.160 -16.930 1.00 0.00 N ATOM 961 CA LEU A 64 8.241 11.911 -16.303 1.00 0.00 C ATOM 962 C LEU A 64 7.588 10.747 -17.045 1.00 0.00 C ATOM 963 O LEU A 64 6.361 10.656 -17.121 1.00 0.00 O ATOM 964 CB LEU A 64 7.841 11.904 -14.818 1.00 0.00 C ATOM 965 CG LEU A 64 8.722 11.054 -13.884 1.00 0.00 C ATOM 966 CD1 LEU A 64 8.656 9.578 -14.239 1.00 0.00 C ATOM 967 CD2 LEU A 64 10.161 11.539 -13.923 1.00 0.00 C ATOM 0 H LEU A 64 7.157 13.702 -16.397 1.00 0.00 H new ATOM 0 HA LEU A 64 9.325 11.808 -16.358 1.00 0.00 H new ATOM 0 HB2 LEU A 64 7.849 12.932 -14.456 1.00 0.00 H new ATOM 0 HB3 LEU A 64 6.814 11.546 -14.741 1.00 0.00 H new ATOM 0 HG LEU A 64 8.334 11.171 -12.872 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.291 9.011 -13.558 1.00 0.00 H new ATOM 0 HD12 LEU A 64 7.627 9.228 -14.152 1.00 0.00 H new ATOM 0 HD13 LEU A 64 9.003 9.434 -15.262 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.769 10.927 -13.257 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.544 11.459 -14.940 1.00 0.00 H new ATOM 0 HD23 LEU A 64 10.203 12.579 -13.600 1.00 0.00 H new ATOM 979 N GLY A 65 8.409 9.875 -17.608 1.00 0.00 N ATOM 980 CA GLY A 65 7.889 8.758 -18.364 1.00 0.00 C ATOM 981 C GLY A 65 7.883 7.477 -17.557 1.00 0.00 C ATOM 982 O GLY A 65 8.935 6.955 -17.202 1.00 0.00 O ATOM 0 H GLY A 65 9.427 9.921 -17.554 1.00 0.00 H new ATOM 0 HA2 GLY A 65 6.874 8.984 -18.692 1.00 0.00 H new ATOM 0 HA3 GLY A 65 8.491 8.617 -19.262 1.00 0.00 H new ATOM 986 N ARG A 66 6.701 6.981 -17.233 1.00 0.00 N ATOM 987 CA ARG A 66 6.588 5.735 -16.488 1.00 0.00 C ATOM 988 C ARG A 66 6.984 4.527 -17.341 1.00 0.00 C ATOM 989 O ARG A 66 7.294 3.459 -16.811 1.00 0.00 O ATOM 990 CB ARG A 66 5.176 5.571 -15.903 1.00 0.00 C ATOM 991 CG ARG A 66 4.056 5.529 -16.938 1.00 0.00 C ATOM 992 CD ARG A 66 3.737 4.107 -17.377 1.00 0.00 C ATOM 993 NE ARG A 66 3.205 3.302 -16.276 1.00 0.00 N ATOM 994 CZ ARG A 66 3.392 1.988 -16.151 1.00 0.00 C ATOM 995 NH1 ARG A 66 4.083 1.321 -17.065 1.00 0.00 N ATOM 996 NH2 ARG A 66 2.866 1.339 -15.121 1.00 0.00 N ATOM 0 H ARG A 66 5.810 7.417 -17.471 1.00 0.00 H new ATOM 0 HA ARG A 66 7.291 5.783 -15.657 1.00 0.00 H new ATOM 0 HB2 ARG A 66 5.145 4.652 -15.317 1.00 0.00 H new ATOM 0 HB3 ARG A 66 4.985 6.394 -15.215 1.00 0.00 H new ATOM 0 HG2 ARG A 66 3.160 5.989 -16.521 1.00 0.00 H new ATOM 0 HG3 ARG A 66 4.343 6.121 -17.807 1.00 0.00 H new ATOM 0 HD2 ARG A 66 3.013 4.132 -18.191 1.00 0.00 H new ATOM 0 HD3 ARG A 66 4.639 3.637 -17.768 1.00 0.00 H new ATOM 0 HE ARG A 66 2.656 3.777 -15.559 1.00 0.00 H new ATOM 0 HH11 ARG A 66 4.474 1.813 -17.868 1.00 0.00 H new ATOM 0 HH12 ARG A 66 4.223 0.316 -16.965 1.00 0.00 H new ATOM 0 HH21 ARG A 66 2.319 1.845 -14.425 1.00 0.00 H new ATOM 0 HH22 ARG A 66 3.009 0.334 -15.025 1.00 0.00 H new ATOM 1010 N GLU A 67 6.983 4.703 -18.661 1.00 0.00 N ATOM 1011 CA GLU A 67 7.374 3.635 -19.583 1.00 0.00 C ATOM 1012 C GLU A 67 8.834 3.245 -19.373 1.00 0.00 C ATOM 1013 O GLU A 67 9.247 2.130 -19.692 1.00 0.00 O ATOM 1014 CB GLU A 67 7.144 4.046 -21.047 1.00 0.00 C ATOM 1015 CG GLU A 67 7.750 5.390 -21.428 1.00 0.00 C ATOM 1016 CD GLU A 67 6.771 6.539 -21.281 1.00 0.00 C ATOM 1017 OE1 GLU A 67 6.353 6.829 -20.146 1.00 0.00 O ATOM 1018 OE2 GLU A 67 6.409 7.153 -22.307 1.00 0.00 O ATOM 0 H GLU A 67 6.716 5.575 -19.118 1.00 0.00 H new ATOM 0 HA GLU A 67 6.744 2.772 -19.368 1.00 0.00 H new ATOM 0 HB2 GLU A 67 7.561 3.277 -21.697 1.00 0.00 H new ATOM 0 HB3 GLU A 67 6.071 4.078 -21.238 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.623 5.580 -20.803 1.00 0.00 H new ATOM 0 HG3 GLU A 67 8.100 5.346 -22.459 1.00 0.00 H new ATOM 1025 N GLN A 68 9.600 4.173 -18.824 1.00 0.00 N ATOM 1026 CA GLN A 68 11.021 3.969 -18.578 1.00 0.00 C ATOM 1027 C GLN A 68 11.220 2.904 -17.507 1.00 0.00 C ATOM 1028 O GLN A 68 12.154 2.104 -17.564 1.00 0.00 O ATOM 1029 CB GLN A 68 11.653 5.282 -18.119 1.00 0.00 C ATOM 1030 CG GLN A 68 11.198 6.491 -18.923 1.00 0.00 C ATOM 1031 CD GLN A 68 11.749 6.523 -20.338 1.00 0.00 C ATOM 1032 OE1 GLN A 68 11.995 5.485 -20.951 1.00 0.00 O ATOM 1033 NE2 GLN A 68 11.939 7.718 -20.871 1.00 0.00 N ATOM 0 H GLN A 68 9.256 5.089 -18.536 1.00 0.00 H new ATOM 0 HA GLN A 68 11.498 3.637 -19.500 1.00 0.00 H new ATOM 0 HB2 GLN A 68 11.412 5.444 -17.068 1.00 0.00 H new ATOM 0 HB3 GLN A 68 12.737 5.197 -18.188 1.00 0.00 H new ATOM 0 HG2 GLN A 68 10.109 6.499 -18.966 1.00 0.00 H new ATOM 0 HG3 GLN A 68 11.503 7.399 -18.403 1.00 0.00 H new ATOM 0 HE21 GLN A 68 11.724 8.557 -20.332 1.00 0.00 H new ATOM 0 HE22 GLN A 68 12.301 7.801 -21.821 1.00 0.00 H new ATOM 1042 N LEU A 69 10.304 2.890 -16.547 1.00 0.00 N ATOM 1043 CA LEU A 69 10.381 1.980 -15.414 1.00 0.00 C ATOM 1044 C LEU A 69 10.163 0.537 -15.852 1.00 0.00 C ATOM 1045 O LEU A 69 10.664 -0.386 -15.221 1.00 0.00 O ATOM 1046 CB LEU A 69 9.364 2.366 -14.331 1.00 0.00 C ATOM 1047 CG LEU A 69 9.708 3.613 -13.503 1.00 0.00 C ATOM 1048 CD1 LEU A 69 9.639 4.879 -14.345 1.00 0.00 C ATOM 1049 CD2 LEU A 69 8.778 3.723 -12.306 1.00 0.00 C ATOM 0 H LEU A 69 9.491 3.506 -16.532 1.00 0.00 H new ATOM 0 HA LEU A 69 11.383 2.062 -14.993 1.00 0.00 H new ATOM 0 HB2 LEU A 69 8.397 2.526 -14.808 1.00 0.00 H new ATOM 0 HB3 LEU A 69 9.249 1.522 -13.651 1.00 0.00 H new ATOM 0 HG LEU A 69 10.733 3.506 -13.149 1.00 0.00 H new ATOM 0 HD11 LEU A 69 9.888 5.741 -13.727 1.00 0.00 H new ATOM 0 HD12 LEU A 69 10.348 4.807 -15.170 1.00 0.00 H new ATOM 0 HD13 LEU A 69 8.631 4.997 -14.743 1.00 0.00 H new ATOM 0 HD21 LEU A 69 9.033 4.611 -11.728 1.00 0.00 H new ATOM 0 HD22 LEU A 69 7.747 3.799 -12.652 1.00 0.00 H new ATOM 0 HD23 LEU A 69 8.886 2.838 -11.679 1.00 0.00 H new ATOM 1061 N GLN A 70 9.417 0.349 -16.937 1.00 0.00 N ATOM 1062 CA GLN A 70 9.146 -0.988 -17.460 1.00 0.00 C ATOM 1063 C GLN A 70 10.436 -1.688 -17.872 1.00 0.00 C ATOM 1064 O GLN A 70 10.560 -2.906 -17.738 1.00 0.00 O ATOM 1065 CB GLN A 70 8.194 -0.917 -18.654 1.00 0.00 C ATOM 1066 CG GLN A 70 6.782 -0.498 -18.283 1.00 0.00 C ATOM 1067 CD GLN A 70 6.065 -1.516 -17.415 1.00 0.00 C ATOM 1068 OE1 GLN A 70 5.234 -1.156 -16.583 1.00 0.00 O ATOM 1069 NE2 GLN A 70 6.359 -2.792 -17.613 1.00 0.00 N ATOM 0 H GLN A 70 8.989 1.105 -17.472 1.00 0.00 H new ATOM 0 HA GLN A 70 8.676 -1.565 -16.664 1.00 0.00 H new ATOM 0 HB2 GLN A 70 8.593 -0.213 -19.384 1.00 0.00 H new ATOM 0 HB3 GLN A 70 8.159 -1.893 -19.138 1.00 0.00 H new ATOM 0 HG2 GLN A 70 6.819 0.456 -17.757 1.00 0.00 H new ATOM 0 HG3 GLN A 70 6.206 -0.337 -19.194 1.00 0.00 H new ATOM 0 HE21 GLN A 70 7.054 -3.053 -18.312 1.00 0.00 H new ATOM 0 HE22 GLN A 70 5.890 -3.514 -17.066 1.00 0.00 H new ATOM 1078 N ILE A 71 11.394 -0.915 -18.364 1.00 0.00 N ATOM 1079 CA ILE A 71 12.682 -1.462 -18.767 1.00 0.00 C ATOM 1080 C ILE A 71 13.463 -1.922 -17.540 1.00 0.00 C ATOM 1081 O ILE A 71 14.102 -2.970 -17.548 1.00 0.00 O ATOM 1082 CB ILE A 71 13.513 -0.423 -19.554 1.00 0.00 C ATOM 1083 CG1 ILE A 71 12.725 0.066 -20.774 1.00 0.00 C ATOM 1084 CG2 ILE A 71 14.849 -1.018 -19.983 1.00 0.00 C ATOM 1085 CD1 ILE A 71 13.437 1.135 -21.575 1.00 0.00 C ATOM 0 H ILE A 71 11.304 0.093 -18.494 1.00 0.00 H new ATOM 0 HA ILE A 71 12.494 -2.314 -19.420 1.00 0.00 H new ATOM 0 HB ILE A 71 13.714 0.428 -18.903 1.00 0.00 H new ATOM 0 HG12 ILE A 71 12.517 -0.784 -21.424 1.00 0.00 H new ATOM 0 HG13 ILE A 71 11.763 0.456 -20.441 1.00 0.00 H new ATOM 0 HG21 ILE A 71 15.419 -0.271 -20.536 1.00 0.00 H new ATOM 0 HG22 ILE A 71 15.411 -1.324 -19.101 1.00 0.00 H new ATOM 0 HG23 ILE A 71 14.673 -1.885 -20.620 1.00 0.00 H new ATOM 0 HD11 ILE A 71 12.816 1.429 -22.421 1.00 0.00 H new ATOM 0 HD12 ILE A 71 13.621 2.002 -20.941 1.00 0.00 H new ATOM 0 HD13 ILE A 71 14.387 0.744 -21.940 1.00 0.00 H new ATOM 1097 N LEU A 72 13.381 -1.135 -16.479 1.00 0.00 N ATOM 1098 CA LEU A 72 14.041 -1.464 -15.221 1.00 0.00 C ATOM 1099 C LEU A 72 13.314 -2.605 -14.516 1.00 0.00 C ATOM 1100 O LEU A 72 13.897 -3.339 -13.727 1.00 0.00 O ATOM 1101 CB LEU A 72 14.063 -0.238 -14.309 1.00 0.00 C ATOM 1102 CG LEU A 72 14.623 1.042 -14.938 1.00 0.00 C ATOM 1103 CD1 LEU A 72 14.691 2.154 -13.903 1.00 0.00 C ATOM 1104 CD2 LEU A 72 15.995 0.792 -15.549 1.00 0.00 C ATOM 0 H LEU A 72 12.861 -0.258 -16.462 1.00 0.00 H new ATOM 0 HA LEU A 72 15.062 -1.777 -15.440 1.00 0.00 H new ATOM 0 HB2 LEU A 72 13.046 -0.041 -13.970 1.00 0.00 H new ATOM 0 HB3 LEU A 72 14.653 -0.476 -13.424 1.00 0.00 H new ATOM 0 HG LEU A 72 13.950 1.353 -15.737 1.00 0.00 H new ATOM 0 HD11 LEU A 72 15.091 3.057 -14.365 1.00 0.00 H new ATOM 0 HD12 LEU A 72 13.691 2.355 -13.519 1.00 0.00 H new ATOM 0 HD13 LEU A 72 15.340 1.848 -13.082 1.00 0.00 H new ATOM 0 HD21 LEU A 72 16.371 1.716 -15.989 1.00 0.00 H new ATOM 0 HD22 LEU A 72 16.682 0.453 -14.774 1.00 0.00 H new ATOM 0 HD23 LEU A 72 15.915 0.028 -16.322 1.00 0.00 H new ATOM 1116 N LEU A 73 12.032 -2.739 -14.818 1.00 0.00 N ATOM 1117 CA LEU A 73 11.163 -3.697 -14.148 1.00 0.00 C ATOM 1118 C LEU A 73 11.520 -5.144 -14.497 1.00 0.00 C ATOM 1119 O LEU A 73 11.276 -6.055 -13.706 1.00 0.00 O ATOM 1120 CB LEU A 73 9.708 -3.397 -14.518 1.00 0.00 C ATOM 1121 CG LEU A 73 8.652 -4.332 -13.923 1.00 0.00 C ATOM 1122 CD1 LEU A 73 8.628 -4.220 -12.406 1.00 0.00 C ATOM 1123 CD2 LEU A 73 7.283 -4.013 -14.505 1.00 0.00 C ATOM 0 H LEU A 73 11.563 -2.186 -15.536 1.00 0.00 H new ATOM 0 HA LEU A 73 11.303 -3.591 -13.072 1.00 0.00 H new ATOM 0 HB2 LEU A 73 9.478 -2.378 -14.206 1.00 0.00 H new ATOM 0 HB3 LEU A 73 9.618 -3.426 -15.604 1.00 0.00 H new ATOM 0 HG LEU A 73 8.911 -5.358 -14.182 1.00 0.00 H new ATOM 0 HD11 LEU A 73 7.871 -4.893 -12.003 1.00 0.00 H new ATOM 0 HD12 LEU A 73 9.605 -4.492 -12.006 1.00 0.00 H new ATOM 0 HD13 LEU A 73 8.391 -3.195 -12.121 1.00 0.00 H new ATOM 0 HD21 LEU A 73 6.539 -4.684 -14.075 1.00 0.00 H new ATOM 0 HD22 LEU A 73 7.020 -2.982 -14.271 1.00 0.00 H new ATOM 0 HD23 LEU A 73 7.308 -4.145 -15.587 1.00 0.00 H new ATOM 1135 N GLU A 74 12.099 -5.361 -15.673 1.00 0.00 N ATOM 1136 CA GLU A 74 12.463 -6.713 -16.085 1.00 0.00 C ATOM 1137 C GLU A 74 13.802 -7.116 -15.479 1.00 0.00 C ATOM 1138 O GLU A 74 14.105 -8.301 -15.333 1.00 0.00 O ATOM 1139 CB GLU A 74 12.477 -6.836 -17.616 1.00 0.00 C ATOM 1140 CG GLU A 74 13.493 -5.960 -18.338 1.00 0.00 C ATOM 1141 CD GLU A 74 14.847 -6.627 -18.497 1.00 0.00 C ATOM 1142 OE1 GLU A 74 14.919 -7.699 -19.139 1.00 0.00 O ATOM 1143 OE2 GLU A 74 15.849 -6.083 -18.005 1.00 0.00 O ATOM 0 H GLU A 74 12.324 -4.631 -16.349 1.00 0.00 H new ATOM 0 HA GLU A 74 11.707 -7.402 -15.710 1.00 0.00 H new ATOM 0 HB2 GLU A 74 12.671 -7.876 -17.877 1.00 0.00 H new ATOM 0 HB3 GLU A 74 11.483 -6.593 -17.991 1.00 0.00 H new ATOM 0 HG2 GLU A 74 13.105 -5.700 -19.323 1.00 0.00 H new ATOM 0 HG3 GLU A 74 13.616 -5.027 -17.787 1.00 0.00 H new ATOM 1150 N GLN A 75 14.588 -6.121 -15.112 1.00 0.00 N ATOM 1151 CA GLN A 75 15.867 -6.351 -14.459 1.00 0.00 C ATOM 1152 C GLN A 75 15.777 -5.939 -12.995 1.00 0.00 C ATOM 1153 O GLN A 75 16.045 -4.788 -12.647 1.00 0.00 O ATOM 1154 CB GLN A 75 16.970 -5.558 -15.163 1.00 0.00 C ATOM 1155 CG GLN A 75 18.379 -5.992 -14.794 1.00 0.00 C ATOM 1156 CD GLN A 75 18.679 -7.411 -15.230 1.00 0.00 C ATOM 1157 OE1 GLN A 75 18.490 -8.363 -14.473 1.00 0.00 O ATOM 1158 NE2 GLN A 75 19.134 -7.563 -16.463 1.00 0.00 N ATOM 0 H GLN A 75 14.362 -5.137 -15.256 1.00 0.00 H new ATOM 0 HA GLN A 75 16.111 -7.412 -14.517 1.00 0.00 H new ATOM 0 HB2 GLN A 75 16.842 -5.656 -16.241 1.00 0.00 H new ATOM 0 HB3 GLN A 75 16.852 -4.501 -14.923 1.00 0.00 H new ATOM 0 HG2 GLN A 75 19.097 -5.314 -15.254 1.00 0.00 H new ATOM 0 HG3 GLN A 75 18.510 -5.911 -13.715 1.00 0.00 H new ATOM 0 HE21 GLN A 75 19.277 -6.747 -17.058 1.00 0.00 H new ATOM 0 HE22 GLN A 75 19.342 -8.496 -16.818 1.00 0.00 H new ATOM 1167 N ASN A 76 15.380 -6.871 -12.139 1.00 0.00 N ATOM 1168 CA ASN A 76 15.180 -6.567 -10.726 1.00 0.00 C ATOM 1169 C ASN A 76 16.508 -6.393 -10.004 1.00 0.00 C ATOM 1170 O ASN A 76 17.051 -7.338 -9.431 1.00 0.00 O ATOM 1171 CB ASN A 76 14.343 -7.648 -10.035 1.00 0.00 C ATOM 1172 CG ASN A 76 12.894 -7.638 -10.480 1.00 0.00 C ATOM 1173 OD1 ASN A 76 12.524 -8.298 -11.451 1.00 0.00 O ATOM 1174 ND2 ASN A 76 12.060 -6.895 -9.769 1.00 0.00 N ATOM 0 H ASN A 76 15.190 -7.840 -12.395 1.00 0.00 H new ATOM 0 HA ASN A 76 14.634 -5.625 -10.676 1.00 0.00 H new ATOM 0 HB2 ASN A 76 14.776 -8.626 -10.244 1.00 0.00 H new ATOM 0 HB3 ASN A 76 14.389 -7.503 -8.956 1.00 0.00 H new ATOM 0 HD21 ASN A 76 11.072 -6.855 -10.019 1.00 0.00 H new ATOM 0 HD22 ASN A 76 12.406 -6.362 -8.971 1.00 0.00 H new ATOM 1181 N ILE A 77 17.042 -5.183 -10.077 1.00 0.00 N ATOM 1182 CA ILE A 77 18.245 -4.820 -9.345 1.00 0.00 C ATOM 1183 C ILE A 77 18.082 -3.451 -8.691 1.00 0.00 C ATOM 1184 O ILE A 77 18.875 -2.534 -8.910 1.00 0.00 O ATOM 1185 CB ILE A 77 19.516 -4.850 -10.234 1.00 0.00 C ATOM 1186 CG1 ILE A 77 19.220 -4.428 -11.682 1.00 0.00 C ATOM 1187 CG2 ILE A 77 20.145 -6.234 -10.203 1.00 0.00 C ATOM 1188 CD1 ILE A 77 19.004 -2.941 -11.872 1.00 0.00 C ATOM 0 H ILE A 77 16.655 -4.428 -10.643 1.00 0.00 H new ATOM 0 HA ILE A 77 18.383 -5.573 -8.569 1.00 0.00 H new ATOM 0 HB ILE A 77 20.219 -4.125 -9.824 1.00 0.00 H new ATOM 0 HG12 ILE A 77 20.048 -4.746 -12.316 1.00 0.00 H new ATOM 0 HG13 ILE A 77 18.332 -4.958 -12.027 1.00 0.00 H new ATOM 0 HG21 ILE A 77 21.036 -6.243 -10.831 1.00 0.00 H new ATOM 0 HG22 ILE A 77 20.420 -6.486 -9.179 1.00 0.00 H new ATOM 0 HG23 ILE A 77 19.430 -6.967 -10.577 1.00 0.00 H new ATOM 0 HD11 ILE A 77 18.802 -2.734 -12.923 1.00 0.00 H new ATOM 0 HD12 ILE A 77 18.156 -2.616 -11.268 1.00 0.00 H new ATOM 0 HD13 ILE A 77 19.898 -2.401 -11.562 1.00 0.00 H new ATOM 1200 N ASN A 78 17.041 -3.330 -7.875 1.00 0.00 N ATOM 1201 CA ASN A 78 16.753 -2.094 -7.149 1.00 0.00 C ATOM 1202 C ASN A 78 17.944 -1.678 -6.295 1.00 0.00 C ATOM 1203 O ASN A 78 18.229 -0.493 -6.148 1.00 0.00 O ATOM 1204 CB ASN A 78 15.514 -2.267 -6.263 1.00 0.00 C ATOM 1205 CG ASN A 78 14.240 -2.455 -7.063 1.00 0.00 C ATOM 1206 OD1 ASN A 78 13.901 -3.569 -7.462 1.00 0.00 O ATOM 1207 ND2 ASN A 78 13.513 -1.370 -7.283 1.00 0.00 N ATOM 0 H ASN A 78 16.374 -4.081 -7.697 1.00 0.00 H new ATOM 0 HA ASN A 78 16.558 -1.311 -7.882 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.658 -3.128 -5.610 1.00 0.00 H new ATOM 0 HB3 ASN A 78 15.408 -1.393 -5.620 1.00 0.00 H new ATOM 0 HD21 ASN A 78 12.637 -1.440 -7.800 1.00 0.00 H new ATOM 0 HD22 ASN A 78 13.829 -0.465 -6.935 1.00 0.00 H new ATOM 1214 N GLU A 79 18.642 -2.665 -5.751 1.00 0.00 N ATOM 1215 CA GLU A 79 19.834 -2.422 -4.946 1.00 0.00 C ATOM 1216 C GLU A 79 20.976 -1.874 -5.804 1.00 0.00 C ATOM 1217 O GLU A 79 21.848 -1.166 -5.314 1.00 0.00 O ATOM 1218 CB GLU A 79 20.269 -3.714 -4.250 1.00 0.00 C ATOM 1219 CG GLU A 79 20.449 -3.573 -2.745 1.00 0.00 C ATOM 1220 CD GLU A 79 21.631 -2.704 -2.363 1.00 0.00 C ATOM 1221 OE1 GLU A 79 21.510 -1.464 -2.400 1.00 0.00 O ATOM 1222 OE2 GLU A 79 22.689 -3.262 -2.004 1.00 0.00 O ATOM 0 H GLU A 79 18.401 -3.651 -5.853 1.00 0.00 H new ATOM 0 HA GLU A 79 19.589 -1.674 -4.192 1.00 0.00 H new ATOM 0 HB2 GLU A 79 19.528 -4.488 -4.446 1.00 0.00 H new ATOM 0 HB3 GLU A 79 21.208 -4.053 -4.688 1.00 0.00 H new ATOM 0 HG2 GLU A 79 19.541 -3.149 -2.315 1.00 0.00 H new ATOM 0 HG3 GLU A 79 20.577 -4.563 -2.307 1.00 0.00 H new ATOM 1229 N ARG A 80 20.979 -2.211 -7.085 1.00 0.00 N ATOM 1230 CA ARG A 80 22.068 -1.806 -7.964 1.00 0.00 C ATOM 1231 C ARG A 80 21.837 -0.401 -8.517 1.00 0.00 C ATOM 1232 O ARG A 80 22.700 0.466 -8.413 1.00 0.00 O ATOM 1233 CB ARG A 80 22.220 -2.797 -9.120 1.00 0.00 C ATOM 1234 CG ARG A 80 23.621 -2.821 -9.705 1.00 0.00 C ATOM 1235 CD ARG A 80 24.636 -3.248 -8.656 1.00 0.00 C ATOM 1236 NE ARG A 80 26.010 -3.192 -9.146 1.00 0.00 N ATOM 1237 CZ ARG A 80 27.070 -3.519 -8.410 1.00 0.00 C ATOM 1238 NH1 ARG A 80 26.909 -3.976 -7.174 1.00 0.00 N ATOM 1239 NH2 ARG A 80 28.292 -3.405 -8.918 1.00 0.00 N ATOM 0 H ARG A 80 20.247 -2.759 -7.537 1.00 0.00 H new ATOM 0 HA ARG A 80 22.985 -1.799 -7.374 1.00 0.00 H new ATOM 0 HB2 ARG A 80 21.962 -3.796 -8.770 1.00 0.00 H new ATOM 0 HB3 ARG A 80 21.509 -2.541 -9.906 1.00 0.00 H new ATOM 0 HG2 ARG A 80 23.655 -3.507 -10.551 1.00 0.00 H new ATOM 0 HG3 ARG A 80 23.878 -1.833 -10.086 1.00 0.00 H new ATOM 0 HD2 ARG A 80 24.540 -2.605 -7.781 1.00 0.00 H new ATOM 0 HD3 ARG A 80 24.411 -4.264 -8.331 1.00 0.00 H new ATOM 0 HE ARG A 80 26.167 -2.885 -10.106 1.00 0.00 H new ATOM 0 HH11 ARG A 80 25.971 -4.077 -6.786 1.00 0.00 H new ATOM 0 HH12 ARG A 80 27.723 -4.226 -6.613 1.00 0.00 H new ATOM 0 HH21 ARG A 80 28.418 -3.067 -9.872 1.00 0.00 H new ATOM 0 HH22 ARG A 80 29.104 -3.656 -8.354 1.00 0.00 H new ATOM 1253 N LEU A 81 20.663 -0.187 -9.099 1.00 0.00 N ATOM 1254 CA LEU A 81 20.354 1.079 -9.765 1.00 0.00 C ATOM 1255 C LEU A 81 19.830 2.111 -8.762 1.00 0.00 C ATOM 1256 O LEU A 81 19.961 3.315 -8.971 1.00 0.00 O ATOM 1257 CB LEU A 81 19.326 0.828 -10.880 1.00 0.00 C ATOM 1258 CG LEU A 81 19.115 1.972 -11.884 1.00 0.00 C ATOM 1259 CD1 LEU A 81 18.628 1.417 -13.209 1.00 0.00 C ATOM 1260 CD2 LEU A 81 18.110 2.988 -11.358 1.00 0.00 C ATOM 0 H LEU A 81 19.907 -0.872 -9.125 1.00 0.00 H new ATOM 0 HA LEU A 81 21.266 1.483 -10.204 1.00 0.00 H new ATOM 0 HB2 LEU A 81 19.632 -0.060 -11.433 1.00 0.00 H new ATOM 0 HB3 LEU A 81 18.367 0.600 -10.415 1.00 0.00 H new ATOM 0 HG LEU A 81 20.072 2.475 -12.026 1.00 0.00 H new ATOM 0 HD11 LEU A 81 18.481 2.235 -13.914 1.00 0.00 H new ATOM 0 HD12 LEU A 81 19.368 0.723 -13.607 1.00 0.00 H new ATOM 0 HD13 LEU A 81 17.684 0.893 -13.059 1.00 0.00 H new ATOM 0 HD21 LEU A 81 17.982 3.785 -12.090 1.00 0.00 H new ATOM 0 HD22 LEU A 81 17.153 2.497 -11.185 1.00 0.00 H new ATOM 0 HD23 LEU A 81 18.476 3.410 -10.422 1.00 0.00 H new ATOM 1272 N ASN A 82 19.254 1.623 -7.667 1.00 0.00 N ATOM 1273 CA ASN A 82 18.628 2.483 -6.658 1.00 0.00 C ATOM 1274 C ASN A 82 17.415 3.199 -7.236 1.00 0.00 C ATOM 1275 O ASN A 82 17.452 4.399 -7.504 1.00 0.00 O ATOM 1276 CB ASN A 82 19.612 3.508 -6.069 1.00 0.00 C ATOM 1277 CG ASN A 82 20.536 2.919 -5.018 1.00 0.00 C ATOM 1278 OD1 ASN A 82 20.960 3.613 -4.092 1.00 0.00 O ATOM 1279 ND2 ASN A 82 20.867 1.648 -5.156 1.00 0.00 N ATOM 0 H ASN A 82 19.206 0.627 -7.452 1.00 0.00 H new ATOM 0 HA ASN A 82 18.308 1.831 -5.846 1.00 0.00 H new ATOM 0 HB2 ASN A 82 20.212 3.930 -6.875 1.00 0.00 H new ATOM 0 HB3 ASN A 82 19.048 4.330 -5.628 1.00 0.00 H new ATOM 0 HD21 ASN A 82 21.494 1.208 -4.482 1.00 0.00 H new ATOM 0 HD22 ASN A 82 20.495 1.106 -5.936 1.00 0.00 H new ATOM 1286 N ILE A 83 16.348 2.444 -7.455 1.00 0.00 N ATOM 1287 CA ILE A 83 15.098 3.019 -7.922 1.00 0.00 C ATOM 1288 C ILE A 83 14.392 3.692 -6.753 1.00 0.00 C ATOM 1289 O ILE A 83 14.158 3.062 -5.720 1.00 0.00 O ATOM 1290 CB ILE A 83 14.157 1.960 -8.562 1.00 0.00 C ATOM 1291 CG1 ILE A 83 14.721 1.437 -9.892 1.00 0.00 C ATOM 1292 CG2 ILE A 83 12.767 2.540 -8.785 1.00 0.00 C ATOM 1293 CD1 ILE A 83 15.868 0.462 -9.746 1.00 0.00 C ATOM 0 H ILE A 83 16.324 1.434 -7.317 1.00 0.00 H new ATOM 0 HA ILE A 83 15.337 3.746 -8.698 1.00 0.00 H new ATOM 0 HB ILE A 83 14.088 1.124 -7.866 1.00 0.00 H new ATOM 0 HG12 ILE A 83 13.918 0.953 -10.448 1.00 0.00 H new ATOM 0 HG13 ILE A 83 15.055 2.285 -10.489 1.00 0.00 H new ATOM 0 HG21 ILE A 83 12.124 1.782 -9.234 1.00 0.00 H new ATOM 0 HG22 ILE A 83 12.346 2.854 -7.830 1.00 0.00 H new ATOM 0 HG23 ILE A 83 12.834 3.400 -9.452 1.00 0.00 H new ATOM 0 HD11 ILE A 83 16.204 0.145 -10.733 1.00 0.00 H new ATOM 0 HD12 ILE A 83 16.692 0.945 -9.221 1.00 0.00 H new ATOM 0 HD13 ILE A 83 15.536 -0.408 -9.179 1.00 0.00 H new ATOM 1305 N GLY A 84 14.083 4.974 -6.918 1.00 0.00 N ATOM 1306 CA GLY A 84 13.443 5.740 -5.865 1.00 0.00 C ATOM 1307 C GLY A 84 12.161 5.102 -5.372 1.00 0.00 C ATOM 1308 O GLY A 84 11.381 4.566 -6.156 1.00 0.00 O ATOM 0 H GLY A 84 14.267 5.500 -7.772 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.134 5.848 -5.029 1.00 0.00 H new ATOM 0 HA3 GLY A 84 13.227 6.743 -6.232 1.00 0.00 H new ATOM 1312 N GLU A 85 11.943 5.176 -4.071 1.00 0.00 N ATOM 1313 CA GLU A 85 10.790 4.559 -3.432 1.00 0.00 C ATOM 1314 C GLU A 85 9.465 5.084 -4.009 1.00 0.00 C ATOM 1315 O GLU A 85 8.590 4.286 -4.355 1.00 0.00 O ATOM 1316 CB GLU A 85 10.829 4.774 -1.916 1.00 0.00 C ATOM 1317 CG GLU A 85 12.203 4.577 -1.292 1.00 0.00 C ATOM 1318 CD GLU A 85 13.017 5.857 -1.253 1.00 0.00 C ATOM 1319 OE1 GLU A 85 13.555 6.266 -2.300 1.00 0.00 O ATOM 1320 OE2 GLU A 85 13.120 6.463 -0.168 1.00 0.00 O ATOM 0 H GLU A 85 12.561 5.667 -3.425 1.00 0.00 H new ATOM 0 HA GLU A 85 10.842 3.490 -3.639 1.00 0.00 H new ATOM 0 HB2 GLU A 85 10.484 5.784 -1.695 1.00 0.00 H new ATOM 0 HB3 GLU A 85 10.127 4.086 -1.445 1.00 0.00 H new ATOM 0 HG2 GLU A 85 12.086 4.195 -0.278 1.00 0.00 H new ATOM 0 HG3 GLU A 85 12.749 3.821 -1.856 1.00 0.00 H new ATOM 1327 N PRO A 86 9.278 6.424 -4.128 1.00 0.00 N ATOM 1328 CA PRO A 86 8.058 6.991 -4.723 1.00 0.00 C ATOM 1329 C PRO A 86 7.900 6.612 -6.196 1.00 0.00 C ATOM 1330 O PRO A 86 6.816 6.731 -6.765 1.00 0.00 O ATOM 1331 CB PRO A 86 8.243 8.507 -4.580 1.00 0.00 C ATOM 1332 CG PRO A 86 9.290 8.676 -3.537 1.00 0.00 C ATOM 1333 CD PRO A 86 10.196 7.490 -3.677 1.00 0.00 C ATOM 0 HA PRO A 86 7.161 6.615 -4.230 1.00 0.00 H new ATOM 0 HB2 PRO A 86 8.551 8.957 -5.524 1.00 0.00 H new ATOM 0 HB3 PRO A 86 7.312 8.991 -4.285 1.00 0.00 H new ATOM 0 HG2 PRO A 86 9.839 9.607 -3.680 1.00 0.00 H new ATOM 0 HG3 PRO A 86 8.848 8.716 -2.541 1.00 0.00 H new ATOM 0 HD2 PRO A 86 10.990 7.672 -4.401 1.00 0.00 H new ATOM 0 HD3 PRO A 86 10.677 7.236 -2.733 1.00 0.00 H new ATOM 1341 N LEU A 87 8.982 6.143 -6.805 1.00 0.00 N ATOM 1342 CA LEU A 87 8.958 5.739 -8.206 1.00 0.00 C ATOM 1343 C LEU A 87 8.188 4.433 -8.365 1.00 0.00 C ATOM 1344 O LEU A 87 7.533 4.212 -9.381 1.00 0.00 O ATOM 1345 CB LEU A 87 10.381 5.590 -8.763 1.00 0.00 C ATOM 1346 CG LEU A 87 11.108 6.896 -9.125 1.00 0.00 C ATOM 1347 CD1 LEU A 87 10.380 7.613 -10.252 1.00 0.00 C ATOM 1348 CD2 LEU A 87 11.243 7.813 -7.917 1.00 0.00 C ATOM 0 H LEU A 87 9.888 6.033 -6.350 1.00 0.00 H new ATOM 0 HA LEU A 87 8.453 6.519 -8.775 1.00 0.00 H new ATOM 0 HB2 LEU A 87 10.983 5.055 -8.028 1.00 0.00 H new ATOM 0 HB3 LEU A 87 10.336 4.964 -9.654 1.00 0.00 H new ATOM 0 HG LEU A 87 12.112 6.635 -9.460 1.00 0.00 H new ATOM 0 HD11 LEU A 87 10.907 8.535 -10.497 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.347 6.970 -11.131 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.364 7.848 -9.937 1.00 0.00 H new ATOM 0 HD21 LEU A 87 11.761 8.726 -8.209 1.00 0.00 H new ATOM 0 HD22 LEU A 87 10.252 8.064 -7.538 1.00 0.00 H new ATOM 0 HD23 LEU A 87 11.812 7.306 -7.137 1.00 0.00 H new ATOM 1360 N LEU A 88 8.256 3.576 -7.350 1.00 0.00 N ATOM 1361 CA LEU A 88 7.464 2.350 -7.336 1.00 0.00 C ATOM 1362 C LEU A 88 5.981 2.700 -7.312 1.00 0.00 C ATOM 1363 O LEU A 88 5.146 1.977 -7.851 1.00 0.00 O ATOM 1364 CB LEU A 88 7.807 1.466 -6.127 1.00 0.00 C ATOM 1365 CG LEU A 88 9.125 0.681 -6.210 1.00 0.00 C ATOM 1366 CD1 LEU A 88 9.217 -0.086 -7.519 1.00 0.00 C ATOM 1367 CD2 LEU A 88 10.323 1.599 -6.040 1.00 0.00 C ATOM 0 H LEU A 88 8.848 3.707 -6.530 1.00 0.00 H new ATOM 0 HA LEU A 88 7.700 1.787 -8.239 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.841 2.098 -5.240 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.994 0.755 -5.981 1.00 0.00 H new ATOM 0 HG LEU A 88 9.135 -0.038 -5.391 1.00 0.00 H new ATOM 0 HD11 LEU A 88 10.159 -0.634 -7.554 1.00 0.00 H new ATOM 0 HD12 LEU A 88 8.386 -0.788 -7.589 1.00 0.00 H new ATOM 0 HD13 LEU A 88 9.172 0.613 -8.354 1.00 0.00 H new ATOM 0 HD21 LEU A 88 11.241 1.015 -6.103 1.00 0.00 H new ATOM 0 HD22 LEU A 88 10.318 2.353 -6.827 1.00 0.00 H new ATOM 0 HD23 LEU A 88 10.271 2.089 -5.068 1.00 0.00 H new ATOM 1379 N VAL A 89 5.670 3.827 -6.685 1.00 0.00 N ATOM 1380 CA VAL A 89 4.305 4.327 -6.626 1.00 0.00 C ATOM 1381 C VAL A 89 3.845 4.782 -8.008 1.00 0.00 C ATOM 1382 O VAL A 89 2.721 4.501 -8.427 1.00 0.00 O ATOM 1383 CB VAL A 89 4.186 5.503 -5.636 1.00 0.00 C ATOM 1384 CG1 VAL A 89 2.750 5.985 -5.541 1.00 0.00 C ATOM 1385 CG2 VAL A 89 4.715 5.102 -4.267 1.00 0.00 C ATOM 0 H VAL A 89 6.352 4.416 -6.207 1.00 0.00 H new ATOM 0 HA VAL A 89 3.669 3.512 -6.280 1.00 0.00 H new ATOM 0 HB VAL A 89 4.793 6.328 -6.009 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.691 6.815 -4.837 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.412 6.317 -6.523 1.00 0.00 H new ATOM 0 HG13 VAL A 89 2.115 5.170 -5.195 1.00 0.00 H new ATOM 0 HG21 VAL A 89 4.623 5.944 -3.581 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.138 4.259 -3.887 1.00 0.00 H new ATOM 0 HG23 VAL A 89 5.763 4.815 -4.352 1.00 0.00 H new ATOM 1395 N TYR A 90 4.734 5.473 -8.714 1.00 0.00 N ATOM 1396 CA TYR A 90 4.452 5.950 -10.065 1.00 0.00 C ATOM 1397 C TYR A 90 4.287 4.763 -11.009 1.00 0.00 C ATOM 1398 O TYR A 90 3.542 4.824 -11.987 1.00 0.00 O ATOM 1399 CB TYR A 90 5.591 6.854 -10.547 1.00 0.00 C ATOM 1400 CG TYR A 90 5.207 7.807 -11.659 1.00 0.00 C ATOM 1401 CD1 TYR A 90 4.377 8.892 -11.409 1.00 0.00 C ATOM 1402 CD2 TYR A 90 5.694 7.637 -12.948 1.00 0.00 C ATOM 1403 CE1 TYR A 90 4.044 9.782 -12.412 1.00 0.00 C ATOM 1404 CE2 TYR A 90 5.361 8.522 -13.958 1.00 0.00 C ATOM 1405 CZ TYR A 90 4.537 9.593 -13.684 1.00 0.00 C ATOM 1406 OH TYR A 90 4.218 10.486 -14.684 1.00 0.00 O ATOM 0 H TYR A 90 5.663 5.717 -8.370 1.00 0.00 H new ATOM 0 HA TYR A 90 3.526 6.525 -10.056 1.00 0.00 H new ATOM 0 HB2 TYR A 90 5.962 7.433 -9.701 1.00 0.00 H new ATOM 0 HB3 TYR A 90 6.415 6.228 -10.890 1.00 0.00 H new ATOM 0 HD1 TYR A 90 3.985 9.043 -10.414 1.00 0.00 H new ATOM 0 HD2 TYR A 90 6.343 6.801 -13.166 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.400 10.622 -12.199 1.00 0.00 H new ATOM 0 HE2 TYR A 90 5.745 8.375 -14.957 1.00 0.00 H new ATOM 0 HH TYR A 90 3.265 10.710 -14.631 1.00 0.00 H new ATOM 1416 N LEU A 91 4.993 3.681 -10.698 1.00 0.00 N ATOM 1417 CA LEU A 91 4.895 2.447 -11.463 1.00 0.00 C ATOM 1418 C LEU A 91 3.533 1.792 -11.250 1.00 0.00 C ATOM 1419 O LEU A 91 2.972 1.200 -12.171 1.00 0.00 O ATOM 1420 CB LEU A 91 6.014 1.482 -11.056 1.00 0.00 C ATOM 1421 CG LEU A 91 6.052 0.156 -11.822 1.00 0.00 C ATOM 1422 CD1 LEU A 91 6.306 0.396 -13.303 1.00 0.00 C ATOM 1423 CD2 LEU A 91 7.116 -0.762 -11.240 1.00 0.00 C ATOM 0 H LEU A 91 5.644 3.636 -9.914 1.00 0.00 H new ATOM 0 HA LEU A 91 5.003 2.687 -12.521 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.971 1.986 -11.189 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.914 1.265 -9.993 1.00 0.00 H new ATOM 0 HG LEU A 91 5.081 -0.328 -11.718 1.00 0.00 H new ATOM 0 HD11 LEU A 91 6.329 -0.559 -13.828 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.509 1.016 -13.713 1.00 0.00 H new ATOM 0 HD13 LEU A 91 7.262 0.903 -13.431 1.00 0.00 H new ATOM 0 HD21 LEU A 91 7.130 -1.700 -11.795 1.00 0.00 H new ATOM 0 HD22 LEU A 91 8.091 -0.281 -11.314 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.890 -0.964 -10.193 1.00 0.00 H new ATOM 1435 N ARG A 92 3.005 1.903 -10.031 1.00 0.00 N ATOM 1436 CA ARG A 92 1.695 1.342 -9.707 1.00 0.00 C ATOM 1437 C ARG A 92 0.623 1.934 -10.610 1.00 0.00 C ATOM 1438 O ARG A 92 -0.062 1.217 -11.340 1.00 0.00 O ATOM 1439 CB ARG A 92 1.319 1.616 -8.248 1.00 0.00 C ATOM 1440 CG ARG A 92 2.226 0.952 -7.229 1.00 0.00 C ATOM 1441 CD ARG A 92 1.706 1.175 -5.819 1.00 0.00 C ATOM 1442 NE ARG A 92 2.536 0.524 -4.809 1.00 0.00 N ATOM 1443 CZ ARG A 92 2.076 -0.364 -3.930 1.00 0.00 C ATOM 1444 NH1 ARG A 92 0.807 -0.754 -3.975 1.00 0.00 N ATOM 1445 NH2 ARG A 92 2.889 -0.867 -3.011 1.00 0.00 N ATOM 0 H ARG A 92 3.464 2.376 -9.253 1.00 0.00 H new ATOM 0 HA ARG A 92 1.756 0.265 -9.863 1.00 0.00 H new ATOM 0 HB2 ARG A 92 1.331 2.693 -8.079 1.00 0.00 H new ATOM 0 HB3 ARG A 92 0.296 1.278 -8.080 1.00 0.00 H new ATOM 0 HG2 ARG A 92 2.289 -0.117 -7.433 1.00 0.00 H new ATOM 0 HG3 ARG A 92 3.235 1.354 -7.317 1.00 0.00 H new ATOM 0 HD2 ARG A 92 1.664 2.245 -5.616 1.00 0.00 H new ATOM 0 HD3 ARG A 92 0.687 0.796 -5.747 1.00 0.00 H new ATOM 0 HE ARG A 92 3.527 0.764 -4.775 1.00 0.00 H new ATOM 0 HH11 ARG A 92 0.181 -0.373 -4.685 1.00 0.00 H new ATOM 0 HH12 ARG A 92 0.458 -1.434 -3.300 1.00 0.00 H new ATOM 0 HH21 ARG A 92 3.865 -0.574 -2.978 1.00 0.00 H new ATOM 0 HH22 ARG A 92 2.538 -1.547 -2.337 1.00 0.00 H new ATOM 1459 N ARG A 93 0.494 3.249 -10.563 1.00 0.00 N ATOM 1460 CA ARG A 93 -0.503 3.946 -11.355 1.00 0.00 C ATOM 1461 C ARG A 93 0.034 5.292 -11.812 1.00 0.00 C ATOM 1462 O ARG A 93 0.586 6.050 -11.015 1.00 0.00 O ATOM 1463 CB ARG A 93 -1.794 4.156 -10.549 1.00 0.00 C ATOM 1464 CG ARG A 93 -1.597 4.965 -9.274 1.00 0.00 C ATOM 1465 CD ARG A 93 -2.920 5.391 -8.659 1.00 0.00 C ATOM 1466 NE ARG A 93 -3.729 4.252 -8.233 1.00 0.00 N ATOM 1467 CZ ARG A 93 -4.428 4.218 -7.100 1.00 0.00 C ATOM 1468 NH1 ARG A 93 -4.438 5.269 -6.286 1.00 0.00 N ATOM 1469 NH2 ARG A 93 -5.131 3.139 -6.791 1.00 0.00 N ATOM 0 H ARG A 93 1.071 3.857 -9.982 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.729 3.332 -12.227 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -2.527 4.661 -11.179 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -2.212 3.183 -10.290 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -1.036 4.372 -8.552 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -0.999 5.849 -9.494 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -2.728 6.037 -7.802 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -3.481 5.981 -9.384 1.00 0.00 H new ATOM 0 HE ARG A 93 -3.760 3.433 -8.840 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -3.909 6.107 -6.528 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -4.975 5.238 -5.419 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -5.136 2.336 -7.420 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -5.667 3.111 -5.924 1.00 0.00 H new ATOM 1483 N GLN A 94 -0.120 5.594 -13.088 1.00 0.00 N ATOM 1484 CA GLN A 94 0.220 6.917 -13.575 1.00 0.00 C ATOM 1485 C GLN A 94 -0.980 7.842 -13.411 1.00 0.00 C ATOM 1486 O GLN A 94 -1.542 8.344 -14.385 1.00 0.00 O ATOM 1487 CB GLN A 94 0.708 6.888 -15.029 1.00 0.00 C ATOM 1488 CG GLN A 94 -0.215 6.162 -15.994 1.00 0.00 C ATOM 1489 CD GLN A 94 0.195 6.364 -17.441 1.00 0.00 C ATOM 1490 OE1 GLN A 94 0.726 7.412 -17.808 1.00 0.00 O ATOM 1491 NE2 GLN A 94 -0.038 5.361 -18.271 1.00 0.00 N ATOM 0 H GLN A 94 -0.473 4.951 -13.797 1.00 0.00 H new ATOM 0 HA GLN A 94 1.050 7.299 -12.980 1.00 0.00 H new ATOM 0 HB2 GLN A 94 0.839 7.913 -15.375 1.00 0.00 H new ATOM 0 HB3 GLN A 94 1.689 6.414 -15.059 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -0.214 5.097 -15.763 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -1.236 6.517 -15.854 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -0.480 4.508 -17.929 1.00 0.00 H new ATOM 0 HE22 GLN A 94 0.225 5.440 -19.253 1.00 0.00 H new ATOM 1500 N ASP A 95 -1.381 8.025 -12.153 1.00 0.00 N ATOM 1501 CA ASP A 95 -2.493 8.907 -11.804 1.00 0.00 C ATOM 1502 C ASP A 95 -2.260 10.281 -12.408 1.00 0.00 C ATOM 1503 O ASP A 95 -3.161 10.887 -12.988 1.00 0.00 O ATOM 1504 CB ASP A 95 -2.624 9.003 -10.283 1.00 0.00 C ATOM 1505 CG ASP A 95 -3.749 9.912 -9.843 1.00 0.00 C ATOM 1506 OD1 ASP A 95 -4.895 9.434 -9.728 1.00 0.00 O ATOM 1507 OD2 ASP A 95 -3.490 11.102 -9.583 1.00 0.00 O ATOM 0 H ASP A 95 -0.946 7.568 -11.351 1.00 0.00 H new ATOM 0 HA ASP A 95 -3.421 8.499 -12.205 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -2.789 8.006 -9.874 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -1.685 9.367 -9.865 1.00 0.00 H new ATOM 1512 N LEU A 96 -1.035 10.758 -12.270 1.00 0.00 N ATOM 1513 CA LEU A 96 -0.573 11.897 -13.032 1.00 0.00 C ATOM 1514 C LEU A 96 0.172 11.367 -14.248 1.00 0.00 C ATOM 1515 O LEU A 96 1.314 10.931 -14.136 1.00 0.00 O ATOM 1516 CB LEU A 96 0.346 12.784 -12.188 1.00 0.00 C ATOM 1517 CG LEU A 96 -0.262 13.305 -10.884 1.00 0.00 C ATOM 1518 CD1 LEU A 96 0.753 14.141 -10.122 1.00 0.00 C ATOM 1519 CD2 LEU A 96 -1.516 14.120 -11.164 1.00 0.00 C ATOM 0 H LEU A 96 -0.341 10.369 -11.632 1.00 0.00 H new ATOM 0 HA LEU A 96 -1.421 12.509 -13.339 1.00 0.00 H new ATOM 0 HB2 LEU A 96 1.248 12.220 -11.949 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.654 13.637 -12.792 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.539 12.449 -10.269 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.305 14.504 -9.197 1.00 0.00 H new ATOM 0 HD12 LEU A 96 1.625 13.530 -9.887 1.00 0.00 H new ATOM 0 HD13 LEU A 96 1.059 14.989 -10.734 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.933 14.481 -10.224 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -1.264 14.969 -11.799 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.251 13.494 -11.670 1.00 0.00 H new ATOM 1531 N PRO A 97 -0.479 11.365 -15.419 1.00 0.00 N ATOM 1532 CA PRO A 97 0.055 10.714 -16.620 1.00 0.00 C ATOM 1533 C PRO A 97 1.278 11.427 -17.179 1.00 0.00 C ATOM 1534 O PRO A 97 2.044 10.856 -17.955 1.00 0.00 O ATOM 1535 CB PRO A 97 -1.109 10.778 -17.610 1.00 0.00 C ATOM 1536 CG PRO A 97 -1.933 11.934 -17.160 1.00 0.00 C ATOM 1537 CD PRO A 97 -1.781 12.005 -15.665 1.00 0.00 C ATOM 0 HA PRO A 97 0.397 9.700 -16.412 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -0.752 10.921 -18.630 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -1.687 9.854 -17.601 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -1.595 12.858 -17.629 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -2.978 11.798 -17.438 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -1.795 13.035 -15.309 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -2.589 11.480 -15.154 1.00 0.00 H new ATOM 1545 N GLU A 98 1.461 12.673 -16.782 1.00 0.00 N ATOM 1546 CA GLU A 98 2.592 13.448 -17.244 1.00 0.00 C ATOM 1547 C GLU A 98 3.020 14.478 -16.206 1.00 0.00 C ATOM 1548 O GLU A 98 2.477 15.584 -16.145 1.00 0.00 O ATOM 1549 CB GLU A 98 2.272 14.135 -18.578 1.00 0.00 C ATOM 1550 CG GLU A 98 0.967 14.917 -18.572 1.00 0.00 C ATOM 1551 CD GLU A 98 0.784 15.746 -19.821 1.00 0.00 C ATOM 1552 OE1 GLU A 98 0.348 15.185 -20.848 1.00 0.00 O ATOM 1553 OE2 GLU A 98 1.080 16.957 -19.783 1.00 0.00 O ATOM 0 H GLU A 98 0.840 13.167 -16.141 1.00 0.00 H new ATOM 0 HA GLU A 98 3.423 12.759 -17.398 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.088 14.811 -18.832 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.228 13.380 -19.363 1.00 0.00 H new ATOM 0 HG2 GLU A 98 0.132 14.223 -18.475 1.00 0.00 H new ATOM 0 HG3 GLU A 98 0.942 15.570 -17.700 1.00 0.00 H new ATOM 1560 N ILE A 99 3.965 14.102 -15.360 1.00 0.00 N ATOM 1561 CA ILE A 99 4.607 15.074 -14.500 1.00 0.00 C ATOM 1562 C ILE A 99 5.573 15.889 -15.344 1.00 0.00 C ATOM 1563 O ILE A 99 6.630 15.398 -15.740 1.00 0.00 O ATOM 1564 CB ILE A 99 5.367 14.413 -13.329 1.00 0.00 C ATOM 1565 CG1 ILE A 99 4.401 13.604 -12.455 1.00 0.00 C ATOM 1566 CG2 ILE A 99 6.083 15.472 -12.497 1.00 0.00 C ATOM 1567 CD1 ILE A 99 5.070 12.920 -11.282 1.00 0.00 C ATOM 0 H ILE A 99 4.299 13.144 -15.253 1.00 0.00 H new ATOM 0 HA ILE A 99 3.837 15.708 -14.060 1.00 0.00 H new ATOM 0 HB ILE A 99 6.114 13.732 -13.738 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.621 14.267 -12.081 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.910 12.851 -13.072 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.614 14.991 -11.675 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.795 16.008 -13.125 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.353 16.174 -12.095 1.00 0.00 H new ATOM 0 HD11 ILE A 99 4.325 12.367 -10.710 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.831 12.231 -11.648 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.537 13.669 -10.642 1.00 0.00 H new ATOM 1579 N THR A 100 5.189 17.111 -15.652 1.00 0.00 N ATOM 1580 CA THR A 100 5.974 17.940 -16.538 1.00 0.00 C ATOM 1581 C THR A 100 6.836 18.920 -15.764 1.00 0.00 C ATOM 1582 O THR A 100 6.396 19.521 -14.782 1.00 0.00 O ATOM 1583 CB THR A 100 5.076 18.701 -17.531 1.00 0.00 C ATOM 1584 OG1 THR A 100 3.915 19.203 -16.855 1.00 0.00 O ATOM 1585 CG2 THR A 100 4.656 17.797 -18.681 1.00 0.00 C ATOM 0 H THR A 100 4.338 17.550 -15.301 1.00 0.00 H new ATOM 0 HA THR A 100 6.630 17.275 -17.100 1.00 0.00 H new ATOM 0 HB THR A 100 5.645 19.537 -17.939 1.00 0.00 H new ATOM 0 HG1 THR A 100 3.349 19.687 -17.492 1.00 0.00 H new ATOM 0 HG21 THR A 100 4.022 18.355 -19.370 1.00 0.00 H new ATOM 0 HG22 THR A 100 5.542 17.444 -19.208 1.00 0.00 H new ATOM 0 HG23 THR A 100 4.102 16.944 -18.289 1.00 0.00 H new ATOM 1593 N ALA A 101 8.066 19.065 -16.213 1.00 0.00 N ATOM 1594 CA ALA A 101 9.003 19.987 -15.607 1.00 0.00 C ATOM 1595 C ALA A 101 9.447 21.007 -16.639 1.00 0.00 C ATOM 1596 O ALA A 101 9.986 20.647 -17.686 1.00 0.00 O ATOM 1597 CB ALA A 101 10.200 19.239 -15.040 1.00 0.00 C ATOM 0 H ALA A 101 8.443 18.548 -17.007 1.00 0.00 H new ATOM 0 HA ALA A 101 8.512 20.505 -14.783 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.893 19.950 -14.589 1.00 0.00 H new ATOM 0 HB2 ALA A 101 9.862 18.532 -14.283 1.00 0.00 H new ATOM 0 HB3 ALA A 101 10.705 18.699 -15.841 1.00 0.00 H new ATOM 1603 N GLN A 102 9.194 22.269 -16.345 1.00 0.00 N ATOM 1604 CA GLN A 102 9.528 23.354 -17.250 1.00 0.00 C ATOM 1605 C GLN A 102 10.010 24.556 -16.453 1.00 0.00 C ATOM 1606 O GLN A 102 9.611 24.741 -15.299 1.00 0.00 O ATOM 1607 CB GLN A 102 8.317 23.724 -18.116 1.00 0.00 C ATOM 1608 CG GLN A 102 7.078 24.117 -17.322 1.00 0.00 C ATOM 1609 CD GLN A 102 5.864 24.339 -18.207 1.00 0.00 C ATOM 1610 OE1 GLN A 102 5.615 25.449 -18.679 1.00 0.00 O ATOM 1611 NE2 GLN A 102 5.098 23.283 -18.436 1.00 0.00 N ATOM 0 H GLN A 102 8.753 22.570 -15.476 1.00 0.00 H new ATOM 0 HA GLN A 102 10.329 23.030 -17.915 1.00 0.00 H new ATOM 0 HB2 GLN A 102 8.592 24.550 -18.771 1.00 0.00 H new ATOM 0 HB3 GLN A 102 8.071 22.877 -18.757 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.855 23.337 -16.594 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.285 25.028 -16.760 1.00 0.00 H new ATOM 0 HE21 GLN A 102 5.338 22.380 -18.027 1.00 0.00 H new ATOM 0 HE22 GLN A 102 4.268 23.373 -19.022 1.00 0.00 H new