USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 776 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 27 LYS NZ :NH3+ 170:sc= -0.0592 (180deg=-0.0817) USER MOD Set 1.2: A 84 THR OG1 : rot -58:sc= 0.921 USER MOD Single : A 3 THR OG1 : rot 57:sc= 0.252 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 18 CYS SG : rot 170:sc= -0.451 USER MOD Single : A 19 GLN : amide:sc= -0.0166 K(o=-0.017,f=-0.82) USER MOD Single : A 23 SER OG : rot -148:sc= -0.225 USER MOD Single : A 25 SER OG : rot 180:sc= -0.962 USER MOD Single : A 28 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00384) USER MOD Single : A 31 GLN : amide:sc= 1.17 K(o=1.2,f=-0.039) USER MOD Single : A 33 SER OG : rot -67:sc= 0.436 USER MOD Single : A 35 MET CE :methyl -151:sc= -1.4 (180deg=-4.9!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ -118:sc= -1.91 (180deg=-3.36!) USER MOD Single : A 39 SER OG : rot 21:sc= 0.322 USER MOD Single : A 40 SER OG : rot -52:sc= -0.263 USER MOD Single : A 41 SER OG : rot -23:sc= 0.218 USER MOD Single : A 42 GLN : amide:sc= -3.49 K(o=-3.5,f=-0.64) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -0.388 X(o=-0.39,f=-0.83) USER MOD Single : A 54 GLN : amide:sc= -0.426 K(o=-0.43,f=-1.3) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 146:sc= -0.469 (180deg=-1.76!) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.405 X(o=-0.4,f=-0.15) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 151:sc= 0.16 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.179 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -3.69 K(o=-3.7,f=-5.1!) USER MOD Single : A 105 MET CE :methyl -118:sc= -0.857 (180deg=-1.19) USER MOD Single : A 107 GLN : amide:sc= -5.86! C(o=-5.9!,f=-3.1!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 31 N THR A 3 0.996 -4.937 -2.304 1.00 0.00 N ATOM 32 CA THR A 3 -0.218 -5.739 -2.234 1.00 0.00 C ATOM 33 C THR A 3 -1.414 -4.891 -1.817 1.00 0.00 C ATOM 34 O THR A 3 -2.195 -5.286 -0.950 1.00 0.00 O ATOM 35 CB THR A 3 -0.063 -6.910 -1.245 1.00 0.00 C ATOM 36 OG1 THR A 3 -0.150 -6.429 0.101 1.00 0.00 O ATOM 37 CG2 THR A 3 1.267 -7.619 -1.450 1.00 0.00 C ATOM 0 HA THR A 3 -0.390 -6.139 -3.233 1.00 0.00 H new ATOM 0 HB THR A 3 -0.868 -7.621 -1.429 1.00 0.00 H new ATOM 0 HG1 THR A 3 -1.001 -5.960 0.226 1.00 0.00 H new ATOM 0 HG21 THR A 3 1.354 -8.442 -0.741 1.00 0.00 H new ATOM 0 HG22 THR A 3 1.318 -8.009 -2.466 1.00 0.00 H new ATOM 0 HG23 THR A 3 2.083 -6.915 -1.290 1.00 0.00 H new ATOM 45 N ASP A 4 -1.553 -3.726 -2.439 1.00 0.00 N ATOM 46 CA ASP A 4 -2.656 -2.822 -2.132 1.00 0.00 C ATOM 47 C ASP A 4 -3.952 -3.312 -2.770 1.00 0.00 C ATOM 48 O ASP A 4 -4.925 -3.604 -2.074 1.00 0.00 O ATOM 49 CB ASP A 4 -2.335 -1.408 -2.620 1.00 0.00 C ATOM 50 CG ASP A 4 -3.417 -0.411 -2.255 1.00 0.00 C ATOM 51 OD1 ASP A 4 -4.080 -0.609 -1.216 1.00 0.00 O ATOM 52 OD2 ASP A 4 -3.600 0.568 -3.008 1.00 0.00 O ATOM 0 H ASP A 4 -0.916 -3.385 -3.159 1.00 0.00 H new ATOM 0 HA ASP A 4 -2.789 -2.803 -1.050 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -1.387 -1.085 -2.190 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -2.206 -1.421 -3.702 1.00 0.00 H new ATOM 57 N ILE A 5 -3.958 -3.397 -4.096 1.00 0.00 N ATOM 58 CA ILE A 5 -5.135 -3.851 -4.826 1.00 0.00 C ATOM 59 C ILE A 5 -5.415 -5.325 -4.556 1.00 0.00 C ATOM 60 O ILE A 5 -6.552 -5.785 -4.675 1.00 0.00 O ATOM 61 CB ILE A 5 -4.972 -3.641 -6.343 1.00 0.00 C ATOM 62 CG1 ILE A 5 -6.296 -3.193 -6.964 1.00 0.00 C ATOM 63 CG2 ILE A 5 -4.476 -4.919 -7.004 1.00 0.00 C ATOM 64 CD1 ILE A 5 -6.395 -1.697 -7.164 1.00 0.00 C ATOM 0 H ILE A 5 -3.161 -3.158 -4.686 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.975 -3.253 -4.472 1.00 0.00 H new ATOM 0 HB ILE A 5 -4.232 -2.858 -6.509 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -6.423 -3.689 -7.926 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.117 -3.521 -6.326 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -4.366 -4.755 -8.076 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -3.512 -5.198 -6.579 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -5.195 -5.720 -6.832 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.360 -1.452 -7.608 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.300 -1.194 -6.202 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.596 -1.365 -7.827 1.00 0.00 H new ATOM 76 N LEU A 6 -4.372 -6.062 -4.189 1.00 0.00 N ATOM 77 CA LEU A 6 -4.506 -7.486 -3.899 1.00 0.00 C ATOM 78 C LEU A 6 -4.291 -7.761 -2.414 1.00 0.00 C ATOM 79 O LEU A 6 -4.148 -6.836 -1.615 1.00 0.00 O ATOM 80 CB LEU A 6 -3.505 -8.292 -4.728 1.00 0.00 C ATOM 81 CG LEU A 6 -4.105 -9.289 -5.720 1.00 0.00 C ATOM 82 CD1 LEU A 6 -4.683 -8.562 -6.924 1.00 0.00 C ATOM 83 CD2 LEU A 6 -3.056 -10.301 -6.159 1.00 0.00 C ATOM 0 H LEU A 6 -3.425 -5.698 -4.085 1.00 0.00 H new ATOM 0 HA LEU A 6 -5.518 -7.792 -4.164 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -2.876 -7.594 -5.280 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -2.853 -8.837 -4.045 1.00 0.00 H new ATOM 0 HG LEU A 6 -4.913 -9.825 -5.223 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -5.105 -9.288 -7.619 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -5.465 -7.877 -6.595 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -3.894 -7.999 -7.422 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -3.500 -11.003 -6.865 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -2.227 -9.781 -6.638 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -2.689 -10.845 -5.289 1.00 0.00 H new ATOM 95 N SER A 7 -4.267 -9.040 -2.052 1.00 0.00 N ATOM 96 CA SER A 7 -4.071 -9.438 -0.663 1.00 0.00 C ATOM 97 C SER A 7 -2.626 -9.863 -0.418 1.00 0.00 C ATOM 98 O SER A 7 -2.030 -10.606 -1.198 1.00 0.00 O ATOM 99 CB SER A 7 -5.019 -10.581 -0.299 1.00 0.00 C ATOM 100 OG SER A 7 -5.862 -10.220 0.782 1.00 0.00 O ATOM 0 H SER A 7 -4.381 -9.818 -2.702 1.00 0.00 H new ATOM 0 HA SER A 7 -4.291 -8.578 -0.030 1.00 0.00 H new ATOM 0 HB2 SER A 7 -5.626 -10.844 -1.165 1.00 0.00 H new ATOM 0 HB3 SER A 7 -4.441 -11.466 -0.034 1.00 0.00 H new ATOM 0 HG SER A 7 -6.460 -10.967 0.994 1.00 0.00 H new ATOM 106 N PRO A 8 -2.048 -9.380 0.692 1.00 0.00 N ATOM 107 CA PRO A 8 -0.666 -9.697 1.067 1.00 0.00 C ATOM 108 C PRO A 8 -0.500 -11.151 1.494 1.00 0.00 C ATOM 109 O PRO A 8 0.607 -11.689 1.481 1.00 0.00 O ATOM 110 CB PRO A 8 -0.395 -8.759 2.245 1.00 0.00 C ATOM 111 CG PRO A 8 -1.738 -8.479 2.824 1.00 0.00 C ATOM 112 CD PRO A 8 -2.699 -8.489 1.667 1.00 0.00 C ATOM 0 HA PRO A 8 0.023 -9.566 0.233 1.00 0.00 H new ATOM 0 HB2 PRO A 8 0.263 -9.225 2.979 1.00 0.00 H new ATOM 0 HB3 PRO A 8 0.093 -7.842 1.916 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -2.009 -9.233 3.563 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -1.750 -7.515 3.333 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -3.679 -8.863 1.962 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -2.849 -7.489 1.260 1.00 0.00 H new ATOM 120 N SER A 9 -1.607 -11.782 1.873 1.00 0.00 N ATOM 121 CA SER A 9 -1.583 -13.174 2.307 1.00 0.00 C ATOM 122 C SER A 9 -1.887 -14.112 1.143 1.00 0.00 C ATOM 123 O SER A 9 -2.446 -15.192 1.332 1.00 0.00 O ATOM 124 CB SER A 9 -2.596 -13.396 3.433 1.00 0.00 C ATOM 125 OG SER A 9 -2.538 -12.347 4.385 1.00 0.00 O ATOM 0 H SER A 9 -2.532 -11.351 1.888 1.00 0.00 H new ATOM 0 HA SER A 9 -0.582 -13.396 2.678 1.00 0.00 H new ATOM 0 HB2 SER A 9 -3.601 -13.457 3.016 1.00 0.00 H new ATOM 0 HB3 SER A 9 -2.396 -14.348 3.924 1.00 0.00 H new ATOM 0 HG SER A 9 -3.196 -12.511 5.093 1.00 0.00 H new ATOM 131 N ASP A 10 -1.514 -13.691 -0.060 1.00 0.00 N ATOM 132 CA ASP A 10 -1.744 -14.492 -1.256 1.00 0.00 C ATOM 133 C ASP A 10 -0.466 -14.617 -2.081 1.00 0.00 C ATOM 134 O ASP A 10 -0.208 -15.655 -2.690 1.00 0.00 O ATOM 135 CB ASP A 10 -2.856 -13.874 -2.105 1.00 0.00 C ATOM 136 CG ASP A 10 -4.223 -14.024 -1.467 1.00 0.00 C ATOM 137 OD1 ASP A 10 -4.325 -13.850 -0.234 1.00 0.00 O ATOM 138 OD2 ASP A 10 -5.190 -14.315 -2.200 1.00 0.00 O ATOM 0 H ASP A 10 -1.051 -12.799 -0.233 1.00 0.00 H new ATOM 0 HA ASP A 10 -2.051 -15.489 -0.941 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -2.645 -12.816 -2.260 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -2.863 -14.345 -3.088 1.00 0.00 H new ATOM 143 N ILE A 11 0.328 -13.552 -2.097 1.00 0.00 N ATOM 144 CA ILE A 11 1.577 -13.542 -2.847 1.00 0.00 C ATOM 145 C ILE A 11 2.593 -14.501 -2.235 1.00 0.00 C ATOM 146 O ILE A 11 3.356 -15.151 -2.948 1.00 0.00 O ATOM 147 CB ILE A 11 2.190 -12.130 -2.903 1.00 0.00 C ATOM 148 CG1 ILE A 11 1.296 -11.195 -3.720 1.00 0.00 C ATOM 149 CG2 ILE A 11 3.591 -12.183 -3.494 1.00 0.00 C ATOM 150 CD1 ILE A 11 0.342 -10.380 -2.876 1.00 0.00 C ATOM 0 H ILE A 11 0.128 -12.685 -1.599 1.00 0.00 H new ATOM 0 HA ILE A 11 1.339 -13.866 -3.860 1.00 0.00 H new ATOM 0 HB ILE A 11 2.260 -11.740 -1.888 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.925 -10.518 -4.299 1.00 0.00 H new ATOM 0 HG13 ILE A 11 0.722 -11.786 -4.434 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.010 -11.177 -3.527 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.223 -12.820 -2.875 1.00 0.00 H new ATOM 0 HG23 ILE A 11 3.545 -12.590 -4.504 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.260 -9.740 -3.522 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -0.312 -11.049 -2.317 1.00 0.00 H new ATOM 0 HD13 ILE A 11 0.909 -9.762 -2.180 1.00 0.00 H new ATOM 162 N ALA A 12 2.595 -14.584 -0.909 1.00 0.00 N ATOM 163 CA ALA A 12 3.515 -15.466 -0.200 1.00 0.00 C ATOM 164 C ALA A 12 3.333 -16.915 -0.640 1.00 0.00 C ATOM 165 O ALA A 12 4.290 -17.689 -0.668 1.00 0.00 O ATOM 166 CB ALA A 12 3.314 -15.339 1.303 1.00 0.00 C ATOM 0 H ALA A 12 1.970 -14.052 -0.304 1.00 0.00 H new ATOM 0 HA ALA A 12 4.533 -15.164 -0.446 1.00 0.00 H new ATOM 0 HB1 ALA A 12 4.007 -16.003 1.820 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.500 -14.310 1.609 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.290 -15.614 1.558 1.00 0.00 H new ATOM 172 N ALA A 13 2.100 -17.275 -0.981 1.00 0.00 N ATOM 173 CA ALA A 13 1.795 -18.631 -1.420 1.00 0.00 C ATOM 174 C ALA A 13 2.330 -18.887 -2.824 1.00 0.00 C ATOM 175 O ALA A 13 2.496 -20.035 -3.236 1.00 0.00 O ATOM 176 CB ALA A 13 0.294 -18.875 -1.373 1.00 0.00 C ATOM 0 H ALA A 13 1.297 -16.647 -0.962 1.00 0.00 H new ATOM 0 HA ALA A 13 2.287 -19.326 -0.740 1.00 0.00 H new ATOM 0 HB1 ALA A 13 0.080 -19.891 -1.703 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.064 -18.742 -0.352 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.211 -18.166 -2.030 1.00 0.00 H new ATOM 182 N ALA A 14 2.599 -17.810 -3.556 1.00 0.00 N ATOM 183 CA ALA A 14 3.117 -17.919 -4.914 1.00 0.00 C ATOM 184 C ALA A 14 4.641 -17.933 -4.920 1.00 0.00 C ATOM 185 O ALA A 14 5.263 -18.626 -5.727 1.00 0.00 O ATOM 186 CB ALA A 14 2.594 -16.776 -5.771 1.00 0.00 C ATOM 0 H ALA A 14 2.467 -16.852 -3.231 1.00 0.00 H new ATOM 0 HA ALA A 14 2.770 -18.863 -5.335 1.00 0.00 H new ATOM 0 HB1 ALA A 14 2.989 -16.870 -6.783 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.505 -16.813 -5.801 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.913 -15.825 -5.344 1.00 0.00 H new ATOM 192 N LEU A 15 5.239 -17.164 -4.017 1.00 0.00 N ATOM 193 CA LEU A 15 6.693 -17.087 -3.919 1.00 0.00 C ATOM 194 C LEU A 15 7.263 -18.354 -3.289 1.00 0.00 C ATOM 195 O LEU A 15 8.443 -18.665 -3.456 1.00 0.00 O ATOM 196 CB LEU A 15 7.105 -15.865 -3.097 1.00 0.00 C ATOM 197 CG LEU A 15 6.638 -14.510 -3.630 1.00 0.00 C ATOM 198 CD1 LEU A 15 6.841 -13.426 -2.582 1.00 0.00 C ATOM 199 CD2 LEU A 15 7.377 -14.158 -4.913 1.00 0.00 C ATOM 0 H LEU A 15 4.740 -16.585 -3.342 1.00 0.00 H new ATOM 0 HA LEU A 15 7.096 -16.991 -4.927 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.721 -15.987 -2.084 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.193 -15.850 -3.026 1.00 0.00 H new ATOM 0 HG LEU A 15 5.573 -14.576 -3.854 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.503 -12.469 -2.979 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.267 -13.672 -1.689 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.899 -13.360 -2.327 1.00 0.00 H new ATOM 0 HD21 LEU A 15 7.032 -13.191 -5.278 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.448 -14.110 -4.715 1.00 0.00 H new ATOM 0 HD23 LEU A 15 7.181 -14.921 -5.667 1.00 0.00 H new ATOM 211 N ARG A 16 6.418 -19.082 -2.567 1.00 0.00 N ATOM 212 CA ARG A 16 6.838 -20.315 -1.913 1.00 0.00 C ATOM 213 C ARG A 16 6.499 -21.529 -2.773 1.00 0.00 C ATOM 214 O ARG A 16 7.103 -22.592 -2.630 1.00 0.00 O ATOM 215 CB ARG A 16 6.169 -20.445 -0.543 1.00 0.00 C ATOM 216 CG ARG A 16 6.411 -21.786 0.129 1.00 0.00 C ATOM 217 CD ARG A 16 5.269 -22.755 -0.134 1.00 0.00 C ATOM 218 NE ARG A 16 5.057 -23.669 0.985 1.00 0.00 N ATOM 219 CZ ARG A 16 4.143 -24.633 0.985 1.00 0.00 C ATOM 220 NH1 ARG A 16 3.361 -24.808 -0.071 1.00 0.00 N ATOM 221 NH2 ARG A 16 4.011 -25.424 2.042 1.00 0.00 N ATOM 0 H ARG A 16 5.438 -18.839 -2.420 1.00 0.00 H new ATOM 0 HA ARG A 16 7.919 -20.276 -1.780 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.536 -19.651 0.108 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.096 -20.294 -0.657 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.344 -22.214 -0.236 1.00 0.00 H new ATOM 0 HG3 ARG A 16 6.526 -21.640 1.203 1.00 0.00 H new ATOM 0 HD2 ARG A 16 4.354 -22.194 -0.322 1.00 0.00 H new ATOM 0 HD3 ARG A 16 5.482 -23.329 -1.036 1.00 0.00 H new ATOM 0 HE ARG A 16 5.643 -23.561 1.813 1.00 0.00 H new ATOM 0 HH11 ARG A 16 3.461 -24.202 -0.885 1.00 0.00 H new ATOM 0 HH12 ARG A 16 2.660 -25.549 -0.069 1.00 0.00 H new ATOM 0 HH21 ARG A 16 4.612 -25.292 2.856 1.00 0.00 H new ATOM 0 HH22 ARG A 16 3.309 -26.164 2.041 1.00 0.00 H new ATOM 235 N ASP A 17 5.529 -21.363 -3.665 1.00 0.00 N ATOM 236 CA ASP A 17 5.109 -22.445 -4.548 1.00 0.00 C ATOM 237 C ASP A 17 5.841 -22.370 -5.885 1.00 0.00 C ATOM 238 O ASP A 17 5.430 -22.992 -6.865 1.00 0.00 O ATOM 239 CB ASP A 17 3.598 -22.389 -4.777 1.00 0.00 C ATOM 240 CG ASP A 17 3.058 -23.662 -5.398 1.00 0.00 C ATOM 241 OD1 ASP A 17 3.213 -24.736 -4.781 1.00 0.00 O ATOM 242 OD2 ASP A 17 2.480 -23.583 -6.502 1.00 0.00 O ATOM 0 H ASP A 17 5.019 -20.490 -3.796 1.00 0.00 H new ATOM 0 HA ASP A 17 5.361 -23.391 -4.068 1.00 0.00 H new ATOM 0 HB2 ASP A 17 3.096 -22.211 -3.826 1.00 0.00 H new ATOM 0 HB3 ASP A 17 3.363 -21.544 -5.425 1.00 0.00 H new ATOM 247 N CYS A 18 6.926 -21.604 -5.917 1.00 0.00 N ATOM 248 CA CYS A 18 7.715 -21.446 -7.133 1.00 0.00 C ATOM 249 C CYS A 18 9.206 -21.538 -6.830 1.00 0.00 C ATOM 250 O CYS A 18 10.035 -21.037 -7.589 1.00 0.00 O ATOM 251 CB CYS A 18 7.399 -20.106 -7.800 1.00 0.00 C ATOM 252 SG CYS A 18 8.100 -18.674 -6.947 1.00 0.00 S ATOM 0 H CYS A 18 7.279 -21.083 -5.115 1.00 0.00 H new ATOM 0 HA CYS A 18 7.452 -22.254 -7.815 1.00 0.00 H new ATOM 0 HB2 CYS A 18 7.773 -20.125 -8.824 1.00 0.00 H new ATOM 0 HB3 CYS A 18 6.317 -19.987 -7.858 1.00 0.00 H new ATOM 0 HG CYS A 18 7.964 -17.616 -7.691 1.00 0.00 H new ATOM 258 N GLN A 19 9.540 -22.181 -5.716 1.00 0.00 N ATOM 259 CA GLN A 19 10.932 -22.336 -5.312 1.00 0.00 C ATOM 260 C GLN A 19 11.698 -23.193 -6.314 1.00 0.00 C ATOM 261 O GLN A 19 12.928 -23.191 -6.336 1.00 0.00 O ATOM 262 CB GLN A 19 11.014 -22.964 -3.919 1.00 0.00 C ATOM 263 CG GLN A 19 10.641 -22.007 -2.798 1.00 0.00 C ATOM 264 CD GLN A 19 10.776 -22.636 -1.425 1.00 0.00 C ATOM 265 OE1 GLN A 19 11.546 -23.578 -1.234 1.00 0.00 O ATOM 266 NE2 GLN A 19 10.026 -22.118 -0.460 1.00 0.00 N ATOM 0 H GLN A 19 8.866 -22.603 -5.077 1.00 0.00 H new ATOM 0 HA GLN A 19 11.388 -21.346 -5.285 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.354 -23.831 -3.881 1.00 0.00 H new ATOM 0 HB3 GLN A 19 12.028 -23.328 -3.753 1.00 0.00 H new ATOM 0 HG2 GLN A 19 11.277 -21.124 -2.853 1.00 0.00 H new ATOM 0 HG3 GLN A 19 9.614 -21.670 -2.940 1.00 0.00 H new ATOM 0 HE21 GLN A 19 9.402 -21.337 -0.663 1.00 0.00 H new ATOM 0 HE22 GLN A 19 10.074 -22.501 0.484 1.00 0.00 H new ATOM 275 N ALA A 20 10.961 -23.926 -7.143 1.00 0.00 N ATOM 276 CA ALA A 20 11.571 -24.786 -8.149 1.00 0.00 C ATOM 277 C ALA A 20 12.102 -23.969 -9.322 1.00 0.00 C ATOM 278 O ALA A 20 11.697 -22.828 -9.549 1.00 0.00 O ATOM 279 CB ALA A 20 10.568 -25.821 -8.636 1.00 0.00 C ATOM 0 H ALA A 20 9.941 -23.941 -7.137 1.00 0.00 H new ATOM 0 HA ALA A 20 12.414 -25.301 -7.688 1.00 0.00 H new ATOM 0 HB1 ALA A 20 11.037 -26.457 -9.387 1.00 0.00 H new ATOM 0 HB2 ALA A 20 10.240 -26.433 -7.796 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.707 -25.316 -9.074 1.00 0.00 H new ATOM 285 N PRO A 21 13.031 -24.563 -10.086 1.00 0.00 N ATOM 286 CA PRO A 21 13.637 -23.907 -11.248 1.00 0.00 C ATOM 287 C PRO A 21 12.653 -23.743 -12.401 1.00 0.00 C ATOM 288 O PRO A 21 11.942 -24.682 -12.760 1.00 0.00 O ATOM 289 CB PRO A 21 14.769 -24.859 -11.643 1.00 0.00 C ATOM 290 CG PRO A 21 14.338 -26.191 -11.132 1.00 0.00 C ATOM 291 CD PRO A 21 13.560 -25.920 -9.874 1.00 0.00 C ATOM 0 HA PRO A 21 13.973 -22.896 -11.015 1.00 0.00 H new ATOM 0 HB2 PRO A 21 14.913 -24.877 -12.723 1.00 0.00 H new ATOM 0 HB3 PRO A 21 15.717 -24.553 -11.200 1.00 0.00 H new ATOM 0 HG2 PRO A 21 13.723 -26.711 -11.867 1.00 0.00 H new ATOM 0 HG3 PRO A 21 15.199 -26.828 -10.929 1.00 0.00 H new ATOM 0 HD2 PRO A 21 12.759 -26.646 -9.732 1.00 0.00 H new ATOM 0 HD3 PRO A 21 14.195 -25.970 -8.990 1.00 0.00 H new ATOM 299 N ASP A 22 12.616 -22.547 -12.977 1.00 0.00 N ATOM 300 CA ASP A 22 11.719 -22.261 -14.091 1.00 0.00 C ATOM 301 C ASP A 22 10.276 -22.593 -13.725 1.00 0.00 C ATOM 302 O ASP A 22 9.454 -22.878 -14.596 1.00 0.00 O ATOM 303 CB ASP A 22 12.140 -23.055 -15.329 1.00 0.00 C ATOM 304 CG ASP A 22 11.550 -22.491 -16.606 1.00 0.00 C ATOM 305 OD1 ASP A 22 11.216 -21.288 -16.625 1.00 0.00 O ATOM 306 OD2 ASP A 22 11.423 -23.253 -17.587 1.00 0.00 O ATOM 0 H ASP A 22 13.197 -21.759 -12.691 1.00 0.00 H new ATOM 0 HA ASP A 22 11.783 -21.196 -14.313 1.00 0.00 H new ATOM 0 HB2 ASP A 22 13.227 -23.056 -15.404 1.00 0.00 H new ATOM 0 HB3 ASP A 22 11.827 -24.093 -15.215 1.00 0.00 H new ATOM 311 N SER A 23 9.975 -22.556 -12.431 1.00 0.00 N ATOM 312 CA SER A 23 8.632 -22.858 -11.949 1.00 0.00 C ATOM 313 C SER A 23 7.851 -21.575 -11.679 1.00 0.00 C ATOM 314 O SER A 23 6.635 -21.603 -11.491 1.00 0.00 O ATOM 315 CB SER A 23 8.702 -23.704 -10.677 1.00 0.00 C ATOM 316 OG SER A 23 8.273 -25.032 -10.923 1.00 0.00 O ATOM 0 H SER A 23 10.643 -22.320 -11.697 1.00 0.00 H new ATOM 0 HA SER A 23 8.113 -23.423 -12.723 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.724 -23.713 -10.298 1.00 0.00 H new ATOM 0 HB3 SER A 23 8.079 -23.255 -9.903 1.00 0.00 H new ATOM 0 HG SER A 23 7.846 -25.392 -10.118 1.00 0.00 H new ATOM 322 N PHE A 24 8.560 -20.451 -11.660 1.00 0.00 N ATOM 323 CA PHE A 24 7.935 -19.157 -11.412 1.00 0.00 C ATOM 324 C PHE A 24 7.603 -18.453 -12.724 1.00 0.00 C ATOM 325 O PHE A 24 8.328 -18.580 -13.710 1.00 0.00 O ATOM 326 CB PHE A 24 8.856 -18.276 -10.566 1.00 0.00 C ATOM 327 CG PHE A 24 8.327 -16.887 -10.352 1.00 0.00 C ATOM 328 CD1 PHE A 24 7.061 -16.687 -9.824 1.00 0.00 C ATOM 329 CD2 PHE A 24 9.094 -15.781 -10.680 1.00 0.00 C ATOM 330 CE1 PHE A 24 6.571 -15.410 -9.626 1.00 0.00 C ATOM 331 CE2 PHE A 24 8.610 -14.501 -10.483 1.00 0.00 C ATOM 332 CZ PHE A 24 7.346 -14.316 -9.957 1.00 0.00 C ATOM 0 H PHE A 24 9.568 -20.410 -11.813 1.00 0.00 H new ATOM 0 HA PHE A 24 7.007 -19.328 -10.867 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.010 -18.751 -9.597 1.00 0.00 H new ATOM 0 HB3 PHE A 24 9.831 -18.214 -11.049 1.00 0.00 H new ATOM 0 HD1 PHE A 24 6.450 -17.539 -9.564 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.082 -15.920 -11.094 1.00 0.00 H new ATOM 0 HE1 PHE A 24 5.583 -15.268 -9.213 1.00 0.00 H new ATOM 0 HE2 PHE A 24 9.219 -13.647 -10.740 1.00 0.00 H new ATOM 0 HZ PHE A 24 6.964 -13.317 -9.805 1.00 0.00 H new ATOM 342 N SER A 25 6.501 -17.710 -12.728 1.00 0.00 N ATOM 343 CA SER A 25 6.069 -16.988 -13.919 1.00 0.00 C ATOM 344 C SER A 25 4.898 -16.064 -13.600 1.00 0.00 C ATOM 345 O SER A 25 4.142 -16.282 -12.653 1.00 0.00 O ATOM 346 CB SER A 25 5.670 -17.972 -15.021 1.00 0.00 C ATOM 347 OG SER A 25 4.656 -18.856 -14.573 1.00 0.00 O ATOM 0 H SER A 25 5.891 -17.592 -11.919 1.00 0.00 H new ATOM 0 HA SER A 25 6.904 -16.381 -14.268 1.00 0.00 H new ATOM 0 HB2 SER A 25 5.318 -17.422 -15.894 1.00 0.00 H new ATOM 0 HB3 SER A 25 6.543 -18.544 -15.335 1.00 0.00 H new ATOM 0 HG SER A 25 4.417 -19.473 -15.296 1.00 0.00 H new ATOM 353 N PRO A 26 4.744 -15.005 -14.408 1.00 0.00 N ATOM 354 CA PRO A 26 3.668 -14.025 -14.233 1.00 0.00 C ATOM 355 C PRO A 26 2.297 -14.603 -14.567 1.00 0.00 C ATOM 356 O PRO A 26 1.269 -14.080 -14.137 1.00 0.00 O ATOM 357 CB PRO A 26 4.035 -12.914 -15.220 1.00 0.00 C ATOM 358 CG PRO A 26 4.854 -13.591 -16.264 1.00 0.00 C ATOM 359 CD PRO A 26 5.608 -14.682 -15.556 1.00 0.00 C ATOM 0 HA PRO A 26 3.589 -13.687 -13.200 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.144 -12.457 -15.650 1.00 0.00 H new ATOM 0 HB3 PRO A 26 4.597 -12.119 -14.730 1.00 0.00 H new ATOM 0 HG2 PRO A 26 4.221 -14.001 -17.051 1.00 0.00 H new ATOM 0 HG3 PRO A 26 5.539 -12.889 -16.739 1.00 0.00 H new ATOM 0 HD2 PRO A 26 5.761 -15.548 -16.200 1.00 0.00 H new ATOM 0 HD3 PRO A 26 6.594 -14.346 -15.235 1.00 0.00 H new ATOM 367 N LYS A 27 2.289 -15.686 -15.338 1.00 0.00 N ATOM 368 CA LYS A 27 1.045 -16.337 -15.730 1.00 0.00 C ATOM 369 C LYS A 27 0.765 -17.551 -14.849 1.00 0.00 C ATOM 370 O LYS A 27 -0.069 -18.393 -15.180 1.00 0.00 O ATOM 371 CB LYS A 27 1.109 -16.764 -17.198 1.00 0.00 C ATOM 372 CG LYS A 27 2.025 -17.949 -17.448 1.00 0.00 C ATOM 373 CD LYS A 27 2.269 -18.162 -18.932 1.00 0.00 C ATOM 374 CE LYS A 27 3.339 -17.219 -19.462 1.00 0.00 C ATOM 375 NZ LYS A 27 4.703 -17.627 -19.025 1.00 0.00 N ATOM 0 H LYS A 27 3.131 -16.131 -15.704 1.00 0.00 H new ATOM 0 HA LYS A 27 0.233 -15.621 -15.601 1.00 0.00 H new ATOM 0 HB2 LYS A 27 0.104 -17.014 -17.539 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.449 -15.920 -17.799 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.977 -17.788 -16.941 1.00 0.00 H new ATOM 0 HG3 LYS A 27 1.584 -18.848 -17.018 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.573 -19.194 -19.107 1.00 0.00 H new ATOM 0 HD3 LYS A 27 1.340 -18.005 -19.481 1.00 0.00 H new ATOM 0 HE2 LYS A 27 3.298 -17.198 -20.551 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.134 -16.206 -19.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 5.414 -17.068 -19.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 4.804 -17.461 -18.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 4.845 -18.637 -19.228 1.00 0.00 H new ATOM 389 N LYS A 28 1.468 -17.634 -13.724 1.00 0.00 N ATOM 390 CA LYS A 28 1.294 -18.742 -12.793 1.00 0.00 C ATOM 391 C LYS A 28 0.910 -18.234 -11.407 1.00 0.00 C ATOM 392 O LYS A 28 0.137 -18.873 -10.693 1.00 0.00 O ATOM 393 CB LYS A 28 2.579 -19.569 -12.706 1.00 0.00 C ATOM 394 CG LYS A 28 2.494 -20.724 -11.724 1.00 0.00 C ATOM 395 CD LYS A 28 1.548 -21.807 -12.217 1.00 0.00 C ATOM 396 CE LYS A 28 1.175 -22.771 -11.101 1.00 0.00 C ATOM 397 NZ LYS A 28 2.353 -23.546 -10.622 1.00 0.00 N ATOM 0 H LYS A 28 2.164 -16.946 -13.435 1.00 0.00 H new ATOM 0 HA LYS A 28 0.487 -19.373 -13.166 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.816 -19.961 -13.695 1.00 0.00 H new ATOM 0 HB3 LYS A 28 3.402 -18.916 -12.416 1.00 0.00 H new ATOM 0 HG2 LYS A 28 3.487 -21.148 -11.573 1.00 0.00 H new ATOM 0 HG3 LYS A 28 2.154 -20.356 -10.756 1.00 0.00 H new ATOM 0 HD2 LYS A 28 0.645 -21.348 -12.619 1.00 0.00 H new ATOM 0 HD3 LYS A 28 2.017 -22.357 -13.033 1.00 0.00 H new ATOM 0 HE2 LYS A 28 0.744 -22.214 -10.269 1.00 0.00 H new ATOM 0 HE3 LYS A 28 0.408 -23.459 -11.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 2.052 -24.216 -9.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.770 -24.071 -11.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 3.061 -22.894 -10.228 1.00 0.00 H new ATOM 411 N PHE A 29 1.453 -17.080 -11.033 1.00 0.00 N ATOM 412 CA PHE A 29 1.166 -16.486 -9.733 1.00 0.00 C ATOM 413 C PHE A 29 -0.099 -15.635 -9.791 1.00 0.00 C ATOM 414 O PHE A 29 -0.729 -15.368 -8.767 1.00 0.00 O ATOM 415 CB PHE A 29 2.347 -15.632 -9.267 1.00 0.00 C ATOM 416 CG PHE A 29 2.237 -14.188 -9.665 1.00 0.00 C ATOM 417 CD1 PHE A 29 2.371 -13.809 -10.991 1.00 0.00 C ATOM 418 CD2 PHE A 29 1.999 -13.210 -8.713 1.00 0.00 C ATOM 419 CE1 PHE A 29 2.271 -12.480 -11.359 1.00 0.00 C ATOM 420 CE2 PHE A 29 1.897 -11.880 -9.075 1.00 0.00 C ATOM 421 CZ PHE A 29 2.033 -11.515 -10.401 1.00 0.00 C ATOM 0 H PHE A 29 2.094 -16.538 -11.612 1.00 0.00 H new ATOM 0 HA PHE A 29 1.007 -17.294 -9.020 1.00 0.00 H new ATOM 0 HB2 PHE A 29 2.426 -15.696 -8.182 1.00 0.00 H new ATOM 0 HB3 PHE A 29 3.268 -16.045 -9.678 1.00 0.00 H new ATOM 0 HD1 PHE A 29 2.556 -14.560 -11.745 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.892 -13.490 -7.676 1.00 0.00 H new ATOM 0 HE1 PHE A 29 2.379 -12.197 -12.396 1.00 0.00 H new ATOM 0 HE2 PHE A 29 1.711 -11.127 -8.323 1.00 0.00 H new ATOM 0 HZ PHE A 29 1.953 -10.477 -10.687 1.00 0.00 H new ATOM 431 N PHE A 30 -0.466 -15.211 -10.996 1.00 0.00 N ATOM 432 CA PHE A 30 -1.654 -14.389 -11.189 1.00 0.00 C ATOM 433 C PHE A 30 -2.870 -15.026 -10.521 1.00 0.00 C ATOM 434 O PHE A 30 -3.774 -14.328 -10.061 1.00 0.00 O ATOM 435 CB PHE A 30 -1.925 -14.189 -12.682 1.00 0.00 C ATOM 436 CG PHE A 30 -2.622 -15.352 -13.326 1.00 0.00 C ATOM 437 CD1 PHE A 30 -1.981 -16.573 -13.460 1.00 0.00 C ATOM 438 CD2 PHE A 30 -3.918 -15.225 -13.799 1.00 0.00 C ATOM 439 CE1 PHE A 30 -2.620 -17.647 -14.052 1.00 0.00 C ATOM 440 CE2 PHE A 30 -4.562 -16.295 -14.392 1.00 0.00 C ATOM 441 CZ PHE A 30 -3.912 -17.506 -14.520 1.00 0.00 C ATOM 0 H PHE A 30 0.043 -15.424 -11.854 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.473 -13.419 -10.726 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -2.531 -13.293 -12.816 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -0.979 -14.014 -13.194 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -0.970 -16.687 -13.098 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -4.431 -14.279 -13.703 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -2.110 -18.594 -14.148 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -5.573 -16.183 -14.755 1.00 0.00 H new ATOM 0 HZ PHE A 30 -4.413 -18.342 -14.985 1.00 0.00 H new ATOM 451 N GLN A 31 -2.884 -16.354 -10.474 1.00 0.00 N ATOM 452 CA GLN A 31 -3.988 -17.085 -9.864 1.00 0.00 C ATOM 453 C GLN A 31 -3.764 -17.259 -8.365 1.00 0.00 C ATOM 454 O GLN A 31 -4.716 -17.289 -7.585 1.00 0.00 O ATOM 455 CB GLN A 31 -4.152 -18.452 -10.530 1.00 0.00 C ATOM 456 CG GLN A 31 -3.150 -19.488 -10.046 1.00 0.00 C ATOM 457 CD GLN A 31 -2.917 -20.592 -11.059 1.00 0.00 C ATOM 458 OE1 GLN A 31 -3.860 -21.228 -11.529 1.00 0.00 O ATOM 459 NE2 GLN A 31 -1.655 -20.824 -11.401 1.00 0.00 N ATOM 0 H GLN A 31 -2.143 -16.946 -10.851 1.00 0.00 H new ATOM 0 HA GLN A 31 -4.900 -16.506 -10.011 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -5.161 -18.819 -10.343 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.050 -18.336 -11.609 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -2.202 -18.996 -9.826 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -3.507 -19.925 -9.113 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -0.904 -20.272 -10.986 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -1.436 -21.554 -12.079 1.00 0.00 H new ATOM 468 N ILE A 32 -2.501 -17.374 -7.971 1.00 0.00 N ATOM 469 CA ILE A 32 -2.153 -17.544 -6.566 1.00 0.00 C ATOM 470 C ILE A 32 -2.375 -16.254 -5.784 1.00 0.00 C ATOM 471 O ILE A 32 -3.161 -16.217 -4.837 1.00 0.00 O ATOM 472 CB ILE A 32 -0.687 -17.987 -6.398 1.00 0.00 C ATOM 473 CG1 ILE A 32 -0.448 -19.317 -7.116 1.00 0.00 C ATOM 474 CG2 ILE A 32 -0.334 -18.104 -4.923 1.00 0.00 C ATOM 475 CD1 ILE A 32 0.979 -19.504 -7.582 1.00 0.00 C ATOM 0 H ILE A 32 -1.702 -17.353 -8.604 1.00 0.00 H new ATOM 0 HA ILE A 32 -2.807 -18.322 -6.172 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.041 -17.232 -6.847 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.713 -20.135 -6.446 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.114 -19.381 -7.976 1.00 0.00 H new ATOM 0 HG21 ILE A 32 0.705 -18.418 -4.821 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.470 -17.137 -4.439 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -0.984 -18.841 -4.451 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.075 -20.468 -8.082 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.242 -18.707 -8.277 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.649 -19.472 -6.723 1.00 0.00 H new ATOM 487 N SER A 33 -1.677 -15.197 -6.187 1.00 0.00 N ATOM 488 CA SER A 33 -1.797 -13.904 -5.523 1.00 0.00 C ATOM 489 C SER A 33 -3.231 -13.390 -5.588 1.00 0.00 C ATOM 490 O SER A 33 -3.746 -12.828 -4.622 1.00 0.00 O ATOM 491 CB SER A 33 -0.849 -12.888 -6.164 1.00 0.00 C ATOM 492 OG SER A 33 -1.118 -12.743 -7.548 1.00 0.00 O ATOM 0 H SER A 33 -1.023 -15.210 -6.970 1.00 0.00 H new ATOM 0 HA SER A 33 -1.524 -14.035 -4.476 1.00 0.00 H new ATOM 0 HB2 SER A 33 -0.954 -11.924 -5.667 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.183 -13.209 -6.022 1.00 0.00 H new ATOM 0 HG SER A 33 -0.890 -13.574 -8.014 1.00 0.00 H new ATOM 498 N GLY A 34 -3.873 -13.588 -6.736 1.00 0.00 N ATOM 499 CA GLY A 34 -5.242 -13.139 -6.908 1.00 0.00 C ATOM 500 C GLY A 34 -5.370 -12.059 -7.964 1.00 0.00 C ATOM 501 O GLY A 34 -6.371 -11.345 -8.013 1.00 0.00 O ATOM 0 H GLY A 34 -3.469 -14.051 -7.550 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -5.868 -13.988 -7.183 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.619 -12.760 -5.958 1.00 0.00 H new ATOM 505 N MET A 35 -4.353 -11.938 -8.811 1.00 0.00 N ATOM 506 CA MET A 35 -4.356 -10.937 -9.871 1.00 0.00 C ATOM 507 C MET A 35 -5.387 -11.281 -10.941 1.00 0.00 C ATOM 508 O MET A 35 -5.786 -10.426 -11.731 1.00 0.00 O ATOM 509 CB MET A 35 -2.967 -10.826 -10.502 1.00 0.00 C ATOM 510 CG MET A 35 -1.950 -10.128 -9.613 1.00 0.00 C ATOM 511 SD MET A 35 -0.816 -9.080 -10.546 1.00 0.00 S ATOM 512 CE MET A 35 -0.420 -10.154 -11.924 1.00 0.00 C ATOM 0 H MET A 35 -3.516 -12.521 -8.784 1.00 0.00 H new ATOM 0 HA MET A 35 -4.624 -9.977 -9.429 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.604 -11.826 -10.740 1.00 0.00 H new ATOM 0 HB3 MET A 35 -3.047 -10.283 -11.444 1.00 0.00 H new ATOM 0 HG2 MET A 35 -2.474 -9.522 -8.874 1.00 0.00 H new ATOM 0 HG3 MET A 35 -1.379 -10.876 -9.064 1.00 0.00 H new ATOM 0 HE1 MET A 35 0.581 -9.924 -12.288 1.00 0.00 H new ATOM 0 HE2 MET A 35 -0.458 -11.193 -11.598 1.00 0.00 H new ATOM 0 HE3 MET A 35 -1.142 -9.999 -12.726 1.00 0.00 H new ATOM 522 N SER A 36 -5.815 -12.540 -10.961 1.00 0.00 N ATOM 523 CA SER A 36 -6.796 -12.998 -11.937 1.00 0.00 C ATOM 524 C SER A 36 -8.035 -12.108 -11.921 1.00 0.00 C ATOM 525 O SER A 36 -8.654 -11.865 -12.958 1.00 0.00 O ATOM 526 CB SER A 36 -7.193 -14.448 -11.651 1.00 0.00 C ATOM 527 OG SER A 36 -8.102 -14.523 -10.566 1.00 0.00 O ATOM 0 H SER A 36 -5.497 -13.260 -10.312 1.00 0.00 H new ATOM 0 HA SER A 36 -6.341 -12.941 -12.926 1.00 0.00 H new ATOM 0 HB2 SER A 36 -7.646 -14.887 -12.540 1.00 0.00 H new ATOM 0 HB3 SER A 36 -6.302 -15.034 -11.425 1.00 0.00 H new ATOM 0 HG SER A 36 -8.342 -15.459 -10.404 1.00 0.00 H new ATOM 533 N LYS A 37 -8.392 -11.622 -10.737 1.00 0.00 N ATOM 534 CA LYS A 37 -9.555 -10.757 -10.583 1.00 0.00 C ATOM 535 C LYS A 37 -9.358 -9.442 -11.329 1.00 0.00 C ATOM 536 O LYS A 37 -10.317 -8.842 -11.815 1.00 0.00 O ATOM 537 CB LYS A 37 -9.818 -10.480 -9.101 1.00 0.00 C ATOM 538 CG LYS A 37 -10.128 -11.729 -8.294 1.00 0.00 C ATOM 539 CD LYS A 37 -10.288 -11.414 -6.816 1.00 0.00 C ATOM 540 CE LYS A 37 -8.946 -11.133 -6.158 1.00 0.00 C ATOM 541 NZ LYS A 37 -9.051 -11.115 -4.672 1.00 0.00 N ATOM 0 H LYS A 37 -7.892 -11.813 -9.869 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.417 -11.271 -11.009 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -8.945 -9.988 -8.672 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.652 -9.784 -9.013 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.042 -12.188 -8.670 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.328 -12.457 -8.427 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -10.942 -10.550 -6.696 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.772 -12.252 -6.315 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -8.226 -11.893 -6.462 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -8.564 -10.174 -6.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -8.116 -10.920 -4.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -9.719 -10.373 -4.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -9.391 -12.039 -4.337 1.00 0.00 H new ATOM 555 N LYS A 38 -8.108 -8.999 -11.418 1.00 0.00 N ATOM 556 CA LYS A 38 -7.783 -7.756 -12.108 1.00 0.00 C ATOM 557 C LYS A 38 -8.380 -7.741 -13.511 1.00 0.00 C ATOM 558 O LYS A 38 -8.896 -8.752 -13.988 1.00 0.00 O ATOM 559 CB LYS A 38 -6.266 -7.573 -12.185 1.00 0.00 C ATOM 560 CG LYS A 38 -5.582 -7.581 -10.829 1.00 0.00 C ATOM 561 CD LYS A 38 -6.258 -6.626 -9.859 1.00 0.00 C ATOM 562 CE LYS A 38 -7.292 -7.340 -9.003 1.00 0.00 C ATOM 563 NZ LYS A 38 -7.449 -6.696 -7.669 1.00 0.00 N ATOM 0 H LYS A 38 -7.303 -9.483 -11.020 1.00 0.00 H new ATOM 0 HA LYS A 38 -8.213 -6.931 -11.540 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.844 -8.367 -12.800 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -6.047 -6.631 -12.687 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -5.598 -8.590 -10.418 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -4.535 -7.301 -10.947 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.507 -6.166 -9.216 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.738 -5.821 -10.415 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -8.252 -7.343 -9.520 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.998 -8.381 -8.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.184 -7.372 -6.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -6.834 -5.860 -7.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -8.439 -6.407 -7.538 1.00 0.00 H new ATOM 577 N SER A 39 -8.306 -6.588 -14.169 1.00 0.00 N ATOM 578 CA SER A 39 -8.841 -6.441 -15.517 1.00 0.00 C ATOM 579 C SER A 39 -8.078 -5.370 -16.291 1.00 0.00 C ATOM 580 O SER A 39 -8.676 -4.523 -16.954 1.00 0.00 O ATOM 581 CB SER A 39 -10.328 -6.085 -15.463 1.00 0.00 C ATOM 582 OG SER A 39 -11.124 -7.244 -15.288 1.00 0.00 O ATOM 0 H SER A 39 -7.880 -5.742 -13.790 1.00 0.00 H new ATOM 0 HA SER A 39 -8.721 -7.393 -16.034 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.509 -5.389 -14.644 1.00 0.00 H new ATOM 0 HB3 SER A 39 -10.617 -5.577 -16.383 1.00 0.00 H new ATOM 0 HG SER A 39 -10.576 -7.963 -14.911 1.00 0.00 H new ATOM 588 N SER A 40 -6.752 -5.415 -16.200 1.00 0.00 N ATOM 589 CA SER A 40 -5.906 -4.447 -16.888 1.00 0.00 C ATOM 590 C SER A 40 -6.247 -3.024 -16.456 1.00 0.00 C ATOM 591 O SER A 40 -5.950 -2.061 -17.163 1.00 0.00 O ATOM 592 CB SER A 40 -6.066 -4.584 -18.403 1.00 0.00 C ATOM 593 OG SER A 40 -5.285 -3.619 -19.088 1.00 0.00 O ATOM 0 H SER A 40 -6.241 -6.111 -15.657 1.00 0.00 H new ATOM 0 HA SER A 40 -4.870 -4.652 -16.619 1.00 0.00 H new ATOM 0 HB2 SER A 40 -5.768 -5.585 -18.714 1.00 0.00 H new ATOM 0 HB3 SER A 40 -7.115 -4.465 -18.673 1.00 0.00 H new ATOM 0 HG SER A 40 -5.486 -2.726 -18.737 1.00 0.00 H new ATOM 599 N SER A 41 -6.871 -2.900 -15.289 1.00 0.00 N ATOM 600 CA SER A 41 -7.257 -1.596 -14.763 1.00 0.00 C ATOM 601 C SER A 41 -6.567 -1.322 -13.430 1.00 0.00 C ATOM 602 O SER A 41 -6.582 -0.198 -12.931 1.00 0.00 O ATOM 603 CB SER A 41 -8.775 -1.520 -14.589 1.00 0.00 C ATOM 604 OG SER A 41 -9.179 -0.221 -14.196 1.00 0.00 O ATOM 0 H SER A 41 -7.120 -3.687 -14.690 1.00 0.00 H new ATOM 0 HA SER A 41 -6.943 -0.836 -15.479 1.00 0.00 H new ATOM 0 HB2 SER A 41 -9.265 -1.789 -15.525 1.00 0.00 H new ATOM 0 HB3 SER A 41 -9.095 -2.246 -13.841 1.00 0.00 H new ATOM 0 HG SER A 41 -8.425 0.242 -13.774 1.00 0.00 H new ATOM 610 N GLN A 42 -5.963 -2.360 -12.860 1.00 0.00 N ATOM 611 CA GLN A 42 -5.268 -2.232 -11.584 1.00 0.00 C ATOM 612 C GLN A 42 -3.822 -2.705 -11.702 1.00 0.00 C ATOM 613 O GLN A 42 -2.991 -2.416 -10.840 1.00 0.00 O ATOM 614 CB GLN A 42 -5.993 -3.034 -10.502 1.00 0.00 C ATOM 615 CG GLN A 42 -7.458 -2.663 -10.348 1.00 0.00 C ATOM 616 CD GLN A 42 -8.391 -3.784 -10.763 1.00 0.00 C ATOM 617 OE1 GLN A 42 -9.381 -4.065 -10.087 1.00 0.00 O ATOM 618 NE2 GLN A 42 -8.080 -4.431 -11.880 1.00 0.00 N ATOM 0 H GLN A 42 -5.941 -3.298 -13.261 1.00 0.00 H new ATOM 0 HA GLN A 42 -5.265 -1.178 -11.304 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -5.919 -4.096 -10.737 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -5.486 -2.883 -9.549 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -7.654 -2.398 -9.309 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.670 -1.778 -10.948 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -7.250 -4.165 -12.409 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -8.671 -5.194 -12.209 1.00 0.00 H new ATOM 627 N LEU A 43 -3.529 -3.434 -12.773 1.00 0.00 N ATOM 628 CA LEU A 43 -2.184 -3.948 -13.004 1.00 0.00 C ATOM 629 C LEU A 43 -1.160 -2.817 -12.997 1.00 0.00 C ATOM 630 O LEU A 43 -0.017 -3.002 -12.577 1.00 0.00 O ATOM 631 CB LEU A 43 -2.124 -4.696 -14.337 1.00 0.00 C ATOM 632 CG LEU A 43 -3.113 -5.851 -14.503 1.00 0.00 C ATOM 633 CD1 LEU A 43 -2.516 -6.944 -15.375 1.00 0.00 C ATOM 634 CD2 LEU A 43 -3.515 -6.409 -13.146 1.00 0.00 C ATOM 0 H LEU A 43 -4.205 -3.682 -13.495 1.00 0.00 H new ATOM 0 HA LEU A 43 -1.942 -4.638 -12.196 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.294 -3.980 -15.141 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.115 -5.087 -14.467 1.00 0.00 H new ATOM 0 HG LEU A 43 -4.007 -5.469 -14.996 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.234 -7.757 -15.482 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.280 -6.537 -16.358 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.605 -7.323 -14.911 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.219 -7.230 -13.284 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.629 -6.774 -12.626 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.985 -5.623 -12.554 1.00 0.00 H new ATOM 646 N LYS A 44 -1.578 -1.645 -13.462 1.00 0.00 N ATOM 647 CA LYS A 44 -0.700 -0.481 -13.506 1.00 0.00 C ATOM 648 C LYS A 44 -1.043 0.502 -12.391 1.00 0.00 C ATOM 649 O LYS A 44 -0.532 1.620 -12.359 1.00 0.00 O ATOM 650 CB LYS A 44 -0.810 0.214 -14.864 1.00 0.00 C ATOM 651 CG LYS A 44 -2.170 0.839 -15.120 1.00 0.00 C ATOM 652 CD LYS A 44 -2.978 0.026 -16.118 1.00 0.00 C ATOM 653 CE LYS A 44 -3.816 0.922 -17.018 1.00 0.00 C ATOM 654 NZ LYS A 44 -3.039 1.412 -18.191 1.00 0.00 N ATOM 0 H LYS A 44 -2.520 -1.475 -13.814 1.00 0.00 H new ATOM 0 HA LYS A 44 0.325 -0.824 -13.361 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -0.046 0.988 -14.929 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -0.598 -0.510 -15.651 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -2.719 0.915 -14.182 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.040 1.854 -15.496 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -2.305 -0.577 -16.728 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.629 -0.666 -15.583 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -4.690 0.372 -17.366 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -4.182 1.773 -16.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.645 2.019 -18.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -2.218 1.959 -17.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -2.711 0.601 -18.753 1.00 0.00 H new ATOM 668 N GLU A 45 -1.909 0.075 -11.477 1.00 0.00 N ATOM 669 CA GLU A 45 -2.318 0.918 -10.360 1.00 0.00 C ATOM 670 C GLU A 45 -1.361 0.764 -9.183 1.00 0.00 C ATOM 671 O GLU A 45 -1.168 1.694 -8.399 1.00 0.00 O ATOM 672 CB GLU A 45 -3.742 0.569 -9.923 1.00 0.00 C ATOM 673 CG GLU A 45 -4.818 1.294 -10.715 1.00 0.00 C ATOM 674 CD GLU A 45 -5.091 2.689 -10.186 1.00 0.00 C ATOM 675 OE1 GLU A 45 -4.265 3.196 -9.398 1.00 0.00 O ATOM 676 OE2 GLU A 45 -6.130 3.272 -10.559 1.00 0.00 O ATOM 0 H GLU A 45 -2.340 -0.849 -11.488 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.292 1.955 -10.693 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -3.891 -0.506 -10.024 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.857 0.809 -8.866 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.514 1.359 -11.760 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.739 0.712 -10.687 1.00 0.00 H new ATOM 683 N ILE A 46 -0.763 -0.417 -9.064 1.00 0.00 N ATOM 684 CA ILE A 46 0.174 -0.694 -7.983 1.00 0.00 C ATOM 685 C ILE A 46 1.606 -0.376 -8.402 1.00 0.00 C ATOM 686 O ILE A 46 2.479 -0.166 -7.560 1.00 0.00 O ATOM 687 CB ILE A 46 0.097 -2.164 -7.533 1.00 0.00 C ATOM 688 CG1 ILE A 46 -1.360 -2.580 -7.321 1.00 0.00 C ATOM 689 CG2 ILE A 46 0.904 -2.372 -6.260 1.00 0.00 C ATOM 690 CD1 ILE A 46 -1.894 -3.487 -8.406 1.00 0.00 C ATOM 0 H ILE A 46 -0.911 -1.198 -9.704 1.00 0.00 H new ATOM 0 HA ILE A 46 -0.109 -0.053 -7.148 1.00 0.00 H new ATOM 0 HB ILE A 46 0.524 -2.791 -8.316 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -1.448 -3.086 -6.360 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.981 -1.685 -7.269 1.00 0.00 H new ATOM 0 HG21 ILE A 46 0.839 -3.416 -5.955 1.00 0.00 H new ATOM 0 HG22 ILE A 46 1.946 -2.111 -6.443 1.00 0.00 H new ATOM 0 HG23 ILE A 46 0.505 -1.737 -5.469 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.932 -3.741 -8.190 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.838 -2.976 -9.367 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.298 -4.399 -8.444 1.00 0.00 H new ATOM 702 N PHE A 47 1.840 -0.341 -9.710 1.00 0.00 N ATOM 703 CA PHE A 47 3.165 -0.049 -10.242 1.00 0.00 C ATOM 704 C PHE A 47 4.249 -0.709 -9.395 1.00 0.00 C ATOM 705 O PHE A 47 5.301 -0.120 -9.145 1.00 0.00 O ATOM 706 CB PHE A 47 3.394 1.463 -10.295 1.00 0.00 C ATOM 707 CG PHE A 47 3.065 2.165 -9.008 1.00 0.00 C ATOM 708 CD1 PHE A 47 4.027 2.319 -8.022 1.00 0.00 C ATOM 709 CD2 PHE A 47 1.795 2.671 -8.784 1.00 0.00 C ATOM 710 CE1 PHE A 47 3.727 2.963 -6.837 1.00 0.00 C ATOM 711 CE2 PHE A 47 1.489 3.316 -7.601 1.00 0.00 C ATOM 712 CZ PHE A 47 2.457 3.463 -6.627 1.00 0.00 C ATOM 0 H PHE A 47 1.129 -0.511 -10.421 1.00 0.00 H new ATOM 0 HA PHE A 47 3.221 -0.454 -11.252 1.00 0.00 H new ATOM 0 HB2 PHE A 47 4.436 1.656 -10.548 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.788 1.886 -11.096 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.022 1.931 -8.182 1.00 0.00 H new ATOM 0 HD2 PHE A 47 1.035 2.560 -9.543 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.485 3.075 -6.076 1.00 0.00 H new ATOM 0 HE2 PHE A 47 0.495 3.705 -7.438 1.00 0.00 H new ATOM 0 HZ PHE A 47 2.221 3.968 -5.702 1.00 0.00 H new ATOM 722 N ARG A 48 3.984 -1.936 -8.957 1.00 0.00 N ATOM 723 CA ARG A 48 4.935 -2.676 -8.138 1.00 0.00 C ATOM 724 C ARG A 48 4.875 -4.169 -8.449 1.00 0.00 C ATOM 725 O ARG A 48 5.392 -4.992 -7.694 1.00 0.00 O ATOM 726 CB ARG A 48 4.651 -2.443 -6.653 1.00 0.00 C ATOM 727 CG ARG A 48 4.970 -1.032 -6.186 1.00 0.00 C ATOM 728 CD ARG A 48 4.229 -0.689 -4.903 1.00 0.00 C ATOM 729 NE ARG A 48 4.179 0.752 -4.668 1.00 0.00 N ATOM 730 CZ ARG A 48 3.278 1.339 -3.889 1.00 0.00 C ATOM 731 NH1 ARG A 48 2.356 0.613 -3.273 1.00 0.00 N ATOM 732 NH2 ARG A 48 3.298 2.656 -3.725 1.00 0.00 N ATOM 0 H ARG A 48 3.119 -2.438 -9.156 1.00 0.00 H new ATOM 0 HA ARG A 48 5.936 -2.313 -8.372 1.00 0.00 H new ATOM 0 HB2 ARG A 48 3.600 -2.653 -6.455 1.00 0.00 H new ATOM 0 HB3 ARG A 48 5.234 -3.152 -6.065 1.00 0.00 H new ATOM 0 HG2 ARG A 48 6.044 -0.935 -6.024 1.00 0.00 H new ATOM 0 HG3 ARG A 48 4.699 -0.320 -6.965 1.00 0.00 H new ATOM 0 HD2 ARG A 48 3.214 -1.083 -4.954 1.00 0.00 H new ATOM 0 HD3 ARG A 48 4.719 -1.177 -4.060 1.00 0.00 H new ATOM 0 HE ARG A 48 4.875 1.340 -5.128 1.00 0.00 H new ATOM 0 HH11 ARG A 48 2.337 -0.399 -3.397 1.00 0.00 H new ATOM 0 HH12 ARG A 48 1.665 1.067 -2.675 1.00 0.00 H new ATOM 0 HH21 ARG A 48 4.006 3.218 -4.198 1.00 0.00 H new ATOM 0 HH22 ARG A 48 2.605 3.106 -3.126 1.00 0.00 H new ATOM 746 N ILE A 49 4.241 -4.509 -9.566 1.00 0.00 N ATOM 747 CA ILE A 49 4.114 -5.902 -9.978 1.00 0.00 C ATOM 748 C ILE A 49 4.604 -6.099 -11.408 1.00 0.00 C ATOM 749 O ILE A 49 4.620 -7.219 -11.922 1.00 0.00 O ATOM 750 CB ILE A 49 2.657 -6.389 -9.874 1.00 0.00 C ATOM 751 CG1 ILE A 49 1.769 -5.623 -10.856 1.00 0.00 C ATOM 752 CG2 ILE A 49 2.145 -6.228 -8.450 1.00 0.00 C ATOM 753 CD1 ILE A 49 1.396 -4.237 -10.378 1.00 0.00 C ATOM 0 H ILE A 49 3.807 -3.840 -10.202 1.00 0.00 H new ATOM 0 HA ILE A 49 4.734 -6.489 -9.300 1.00 0.00 H new ATOM 0 HB ILE A 49 2.623 -7.447 -10.133 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.285 -5.542 -11.813 1.00 0.00 H new ATOM 0 HG13 ILE A 49 0.858 -6.195 -11.032 1.00 0.00 H new ATOM 0 HG21 ILE A 49 1.114 -6.577 -8.393 1.00 0.00 H new ATOM 0 HG22 ILE A 49 2.765 -6.815 -7.772 1.00 0.00 H new ATOM 0 HG23 ILE A 49 2.189 -5.177 -8.164 1.00 0.00 H new ATOM 0 HD11 ILE A 49 0.766 -3.752 -11.124 1.00 0.00 H new ATOM 0 HD12 ILE A 49 0.852 -4.311 -9.436 1.00 0.00 H new ATOM 0 HD13 ILE A 49 2.301 -3.648 -10.229 1.00 0.00 H new ATOM 765 N LEU A 50 5.003 -5.005 -12.047 1.00 0.00 N ATOM 766 CA LEU A 50 5.495 -5.057 -13.419 1.00 0.00 C ATOM 767 C LEU A 50 6.961 -4.643 -13.488 1.00 0.00 C ATOM 768 O LEU A 50 7.830 -5.450 -13.818 1.00 0.00 O ATOM 769 CB LEU A 50 4.654 -4.149 -14.319 1.00 0.00 C ATOM 770 CG LEU A 50 3.167 -4.055 -13.975 1.00 0.00 C ATOM 771 CD1 LEU A 50 2.541 -2.840 -14.641 1.00 0.00 C ATOM 772 CD2 LEU A 50 2.442 -5.326 -14.391 1.00 0.00 C ATOM 0 H LEU A 50 4.995 -4.071 -11.637 1.00 0.00 H new ATOM 0 HA LEU A 50 5.410 -6.085 -13.770 1.00 0.00 H new ATOM 0 HB2 LEU A 50 5.078 -3.145 -14.287 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.747 -4.502 -15.346 1.00 0.00 H new ATOM 0 HG LEU A 50 3.070 -3.942 -12.895 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.483 -2.790 -14.385 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.042 -1.936 -14.294 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.649 -2.922 -15.723 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.385 -5.241 -14.138 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.548 -5.470 -15.466 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.873 -6.179 -13.867 1.00 0.00 H new ATOM 784 N ASP A 51 7.230 -3.381 -13.172 1.00 0.00 N ATOM 785 CA ASP A 51 8.591 -2.860 -13.194 1.00 0.00 C ATOM 786 C ASP A 51 8.847 -1.955 -11.993 1.00 0.00 C ATOM 787 O ASP A 51 7.997 -1.819 -11.114 1.00 0.00 O ATOM 788 CB ASP A 51 8.845 -2.090 -14.491 1.00 0.00 C ATOM 789 CG ASP A 51 10.269 -2.244 -14.987 1.00 0.00 C ATOM 790 OD1 ASP A 51 11.083 -2.863 -14.270 1.00 0.00 O ATOM 791 OD2 ASP A 51 10.571 -1.744 -16.092 1.00 0.00 O ATOM 0 H ASP A 51 6.522 -2.700 -12.897 1.00 0.00 H new ATOM 0 HA ASP A 51 9.277 -3.705 -13.142 1.00 0.00 H new ATOM 0 HB2 ASP A 51 8.156 -2.441 -15.259 1.00 0.00 H new ATOM 0 HB3 ASP A 51 8.632 -1.033 -14.330 1.00 0.00 H new ATOM 796 N ASN A 52 10.024 -1.338 -11.962 1.00 0.00 N ATOM 797 CA ASN A 52 10.392 -0.448 -10.868 1.00 0.00 C ATOM 798 C ASN A 52 10.945 0.870 -11.402 1.00 0.00 C ATOM 799 O ASN A 52 11.412 1.715 -10.637 1.00 0.00 O ATOM 800 CB ASN A 52 11.427 -1.118 -9.963 1.00 0.00 C ATOM 801 CG ASN A 52 11.729 -0.298 -8.723 1.00 0.00 C ATOM 802 OD1 ASN A 52 10.832 0.293 -8.123 1.00 0.00 O ATOM 803 ND2 ASN A 52 12.999 -0.260 -8.335 1.00 0.00 N ATOM 0 H ASN A 52 10.739 -1.438 -12.682 1.00 0.00 H new ATOM 0 HA ASN A 52 9.494 -0.237 -10.287 1.00 0.00 H new ATOM 0 HB2 ASN A 52 11.063 -2.101 -9.665 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.348 -1.276 -10.524 1.00 0.00 H new ATOM 0 HD21 ASN A 52 13.264 0.275 -7.508 1.00 0.00 H new ATOM 0 HD22 ASN A 52 13.709 -0.766 -8.864 1.00 0.00 H new ATOM 810 N ASP A 53 10.889 1.039 -12.718 1.00 0.00 N ATOM 811 CA ASP A 53 11.382 2.254 -13.355 1.00 0.00 C ATOM 812 C ASP A 53 10.272 2.945 -14.142 1.00 0.00 C ATOM 813 O ASP A 53 10.180 4.172 -14.156 1.00 0.00 O ATOM 814 CB ASP A 53 12.555 1.930 -14.281 1.00 0.00 C ATOM 815 CG ASP A 53 13.394 3.152 -14.602 1.00 0.00 C ATOM 816 OD1 ASP A 53 12.844 4.272 -14.575 1.00 0.00 O ATOM 817 OD2 ASP A 53 14.600 2.987 -14.882 1.00 0.00 O ATOM 0 H ASP A 53 10.507 0.349 -13.365 1.00 0.00 H new ATOM 0 HA ASP A 53 11.723 2.932 -12.572 1.00 0.00 H new ATOM 0 HB2 ASP A 53 13.185 1.173 -13.814 1.00 0.00 H new ATOM 0 HB3 ASP A 53 12.175 1.500 -15.208 1.00 0.00 H new ATOM 822 N GLN A 54 9.434 2.147 -14.797 1.00 0.00 N ATOM 823 CA GLN A 54 8.332 2.682 -15.587 1.00 0.00 C ATOM 824 C GLN A 54 8.830 3.731 -16.576 1.00 0.00 C ATOM 825 O GLN A 54 8.100 4.652 -16.940 1.00 0.00 O ATOM 826 CB GLN A 54 7.269 3.292 -14.672 1.00 0.00 C ATOM 827 CG GLN A 54 5.863 2.786 -14.951 1.00 0.00 C ATOM 828 CD GLN A 54 5.721 1.295 -14.713 1.00 0.00 C ATOM 829 OE1 GLN A 54 6.042 0.483 -15.582 1.00 0.00 O ATOM 830 NE2 GLN A 54 5.239 0.927 -13.532 1.00 0.00 N ATOM 0 H GLN A 54 9.498 1.129 -14.796 1.00 0.00 H new ATOM 0 HA GLN A 54 7.889 1.860 -16.149 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.526 3.074 -13.635 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.285 4.376 -14.783 1.00 0.00 H new ATOM 0 HG2 GLN A 54 5.156 3.320 -14.316 1.00 0.00 H new ATOM 0 HG3 GLN A 54 5.598 3.012 -15.984 1.00 0.00 H new ATOM 0 HE21 GLN A 54 4.986 1.634 -12.842 1.00 0.00 H new ATOM 0 HE22 GLN A 54 5.122 -0.063 -13.315 1.00 0.00 H new ATOM 839 N SER A 55 10.079 3.584 -17.007 1.00 0.00 N ATOM 840 CA SER A 55 10.677 4.521 -17.951 1.00 0.00 C ATOM 841 C SER A 55 10.007 4.418 -19.318 1.00 0.00 C ATOM 842 O SER A 55 10.047 5.354 -20.114 1.00 0.00 O ATOM 843 CB SER A 55 12.178 4.256 -18.085 1.00 0.00 C ATOM 844 OG SER A 55 12.839 5.356 -18.685 1.00 0.00 O ATOM 0 H SER A 55 10.696 2.825 -16.718 1.00 0.00 H new ATOM 0 HA SER A 55 10.526 5.530 -17.567 1.00 0.00 H new ATOM 0 HB2 SER A 55 12.606 4.064 -17.101 1.00 0.00 H new ATOM 0 HB3 SER A 55 12.340 3.360 -18.684 1.00 0.00 H new ATOM 0 HG SER A 55 13.797 5.162 -18.758 1.00 0.00 H new ATOM 850 N GLY A 56 9.390 3.269 -19.582 1.00 0.00 N ATOM 851 CA GLY A 56 8.720 3.063 -20.853 1.00 0.00 C ATOM 852 C GLY A 56 8.511 1.594 -21.166 1.00 0.00 C ATOM 853 O GLY A 56 7.633 1.239 -21.952 1.00 0.00 O ATOM 0 H GLY A 56 9.343 2.479 -18.939 1.00 0.00 H new ATOM 0 HA2 GLY A 56 7.755 3.569 -20.838 1.00 0.00 H new ATOM 0 HA3 GLY A 56 9.308 3.521 -21.649 1.00 0.00 H new ATOM 857 N PHE A 57 9.321 0.739 -20.551 1.00 0.00 N ATOM 858 CA PHE A 57 9.222 -0.700 -20.770 1.00 0.00 C ATOM 859 C PHE A 57 9.969 -1.468 -19.684 1.00 0.00 C ATOM 860 O PHE A 57 10.382 -0.894 -18.676 1.00 0.00 O ATOM 861 CB PHE A 57 9.782 -1.066 -22.146 1.00 0.00 C ATOM 862 CG PHE A 57 11.282 -1.126 -22.187 1.00 0.00 C ATOM 863 CD1 PHE A 57 12.043 -0.023 -21.834 1.00 0.00 C ATOM 864 CD2 PHE A 57 11.932 -2.286 -22.578 1.00 0.00 C ATOM 865 CE1 PHE A 57 13.423 -0.075 -21.870 1.00 0.00 C ATOM 866 CE2 PHE A 57 13.312 -2.344 -22.615 1.00 0.00 C ATOM 867 CZ PHE A 57 14.059 -1.236 -22.262 1.00 0.00 C ATOM 0 H PHE A 57 10.053 1.017 -19.897 1.00 0.00 H new ATOM 0 HA PHE A 57 8.169 -0.978 -20.727 1.00 0.00 H new ATOM 0 HB2 PHE A 57 9.379 -2.033 -22.448 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.436 -0.335 -22.876 1.00 0.00 H new ATOM 0 HD1 PHE A 57 11.551 0.888 -21.527 1.00 0.00 H new ATOM 0 HD2 PHE A 57 11.353 -3.154 -22.857 1.00 0.00 H new ATOM 0 HE1 PHE A 57 14.004 0.792 -21.592 1.00 0.00 H new ATOM 0 HE2 PHE A 57 13.807 -3.255 -22.920 1.00 0.00 H new ATOM 0 HZ PHE A 57 15.138 -1.278 -22.293 1.00 0.00 H new ATOM 877 N ILE A 58 10.137 -2.768 -19.897 1.00 0.00 N ATOM 878 CA ILE A 58 10.834 -3.615 -18.937 1.00 0.00 C ATOM 879 C ILE A 58 11.936 -4.424 -19.614 1.00 0.00 C ATOM 880 O ILE A 58 11.855 -4.723 -20.805 1.00 0.00 O ATOM 881 CB ILE A 58 9.865 -4.581 -18.230 1.00 0.00 C ATOM 882 CG1 ILE A 58 8.628 -3.827 -17.738 1.00 0.00 C ATOM 883 CG2 ILE A 58 10.562 -5.279 -17.072 1.00 0.00 C ATOM 884 CD1 ILE A 58 7.589 -4.723 -17.100 1.00 0.00 C ATOM 0 H ILE A 58 9.800 -3.258 -20.726 1.00 0.00 H new ATOM 0 HA ILE A 58 11.278 -2.951 -18.196 1.00 0.00 H new ATOM 0 HB ILE A 58 9.545 -5.339 -18.945 1.00 0.00 H new ATOM 0 HG12 ILE A 58 8.937 -3.071 -17.016 1.00 0.00 H new ATOM 0 HG13 ILE A 58 8.175 -3.300 -18.578 1.00 0.00 H new ATOM 0 HG21 ILE A 58 9.864 -5.958 -16.583 1.00 0.00 H new ATOM 0 HG22 ILE A 58 11.415 -5.844 -17.448 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.908 -4.535 -16.354 1.00 0.00 H new ATOM 0 HD11 ILE A 58 6.740 -4.122 -16.775 1.00 0.00 H new ATOM 0 HD12 ILE A 58 7.252 -5.464 -17.825 1.00 0.00 H new ATOM 0 HD13 ILE A 58 8.025 -5.230 -16.239 1.00 0.00 H new ATOM 896 N GLU A 59 12.963 -4.774 -18.847 1.00 0.00 N ATOM 897 CA GLU A 59 14.080 -5.549 -19.374 1.00 0.00 C ATOM 898 C GLU A 59 14.480 -6.657 -18.403 1.00 0.00 C ATOM 899 O GLU A 59 14.038 -6.679 -17.255 1.00 0.00 O ATOM 900 CB GLU A 59 15.278 -4.638 -19.646 1.00 0.00 C ATOM 901 CG GLU A 59 16.220 -5.172 -20.712 1.00 0.00 C ATOM 902 CD GLU A 59 17.200 -4.124 -21.203 1.00 0.00 C ATOM 903 OE1 GLU A 59 18.030 -3.662 -20.392 1.00 0.00 O ATOM 904 OE2 GLU A 59 17.137 -3.767 -22.398 1.00 0.00 O ATOM 0 H GLU A 59 13.045 -4.533 -17.859 1.00 0.00 H new ATOM 0 HA GLU A 59 13.761 -6.007 -20.310 1.00 0.00 H new ATOM 0 HB2 GLU A 59 14.915 -3.657 -19.952 1.00 0.00 H new ATOM 0 HB3 GLU A 59 15.834 -4.497 -18.719 1.00 0.00 H new ATOM 0 HG2 GLU A 59 16.773 -6.021 -20.310 1.00 0.00 H new ATOM 0 HG3 GLU A 59 15.636 -5.542 -21.555 1.00 0.00 H new ATOM 911 N GLU A 60 15.318 -7.575 -18.874 1.00 0.00 N ATOM 912 CA GLU A 60 15.776 -8.686 -18.049 1.00 0.00 C ATOM 913 C GLU A 60 16.471 -8.177 -16.789 1.00 0.00 C ATOM 914 O GLU A 60 16.587 -8.898 -15.797 1.00 0.00 O ATOM 915 CB GLU A 60 16.728 -9.582 -18.843 1.00 0.00 C ATOM 916 CG GLU A 60 16.124 -10.125 -20.128 1.00 0.00 C ATOM 917 CD GLU A 60 17.175 -10.519 -21.146 1.00 0.00 C ATOM 918 OE1 GLU A 60 18.008 -9.658 -21.502 1.00 0.00 O ATOM 919 OE2 GLU A 60 17.166 -11.687 -21.588 1.00 0.00 O ATOM 0 H GLU A 60 15.693 -7.571 -19.822 1.00 0.00 H new ATOM 0 HA GLU A 60 14.904 -9.268 -17.752 1.00 0.00 H new ATOM 0 HB2 GLU A 60 17.628 -9.017 -19.085 1.00 0.00 H new ATOM 0 HB3 GLU A 60 17.036 -10.418 -18.215 1.00 0.00 H new ATOM 0 HG2 GLU A 60 15.505 -10.992 -19.896 1.00 0.00 H new ATOM 0 HG3 GLU A 60 15.467 -9.372 -20.563 1.00 0.00 H new ATOM 926 N ASP A 61 16.932 -6.932 -16.837 1.00 0.00 N ATOM 927 CA ASP A 61 17.616 -6.326 -15.700 1.00 0.00 C ATOM 928 C ASP A 61 16.621 -5.942 -14.609 1.00 0.00 C ATOM 929 O ASP A 61 17.011 -5.503 -13.528 1.00 0.00 O ATOM 930 CB ASP A 61 18.401 -5.093 -16.149 1.00 0.00 C ATOM 931 CG ASP A 61 19.263 -4.521 -15.040 1.00 0.00 C ATOM 932 OD1 ASP A 61 20.324 -5.112 -14.749 1.00 0.00 O ATOM 933 OD2 ASP A 61 18.877 -3.482 -14.464 1.00 0.00 O ATOM 0 H ASP A 61 16.845 -6.323 -17.650 1.00 0.00 H new ATOM 0 HA ASP A 61 18.310 -7.060 -15.291 1.00 0.00 H new ATOM 0 HB2 ASP A 61 19.033 -5.357 -16.997 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.705 -4.329 -16.495 1.00 0.00 H new ATOM 938 N GLU A 62 15.335 -6.110 -14.903 1.00 0.00 N ATOM 939 CA GLU A 62 14.285 -5.779 -13.947 1.00 0.00 C ATOM 940 C GLU A 62 13.426 -7.001 -13.637 1.00 0.00 C ATOM 941 O GLU A 62 12.270 -6.875 -13.230 1.00 0.00 O ATOM 942 CB GLU A 62 13.407 -4.650 -14.491 1.00 0.00 C ATOM 943 CG GLU A 62 13.949 -3.261 -14.195 1.00 0.00 C ATOM 944 CD GLU A 62 13.747 -2.852 -12.749 1.00 0.00 C ATOM 945 OE1 GLU A 62 13.330 -3.709 -11.942 1.00 0.00 O ATOM 946 OE2 GLU A 62 14.007 -1.675 -12.424 1.00 0.00 O ATOM 0 H GLU A 62 14.996 -6.473 -15.794 1.00 0.00 H new ATOM 0 HA GLU A 62 14.761 -5.448 -13.024 1.00 0.00 H new ATOM 0 HB2 GLU A 62 13.304 -4.769 -15.570 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.408 -4.740 -14.064 1.00 0.00 H new ATOM 0 HG2 GLU A 62 15.013 -3.232 -14.432 1.00 0.00 H new ATOM 0 HG3 GLU A 62 13.458 -2.537 -14.845 1.00 0.00 H new ATOM 953 N LEU A 63 13.998 -8.184 -13.832 1.00 0.00 N ATOM 954 CA LEU A 63 13.286 -9.431 -13.574 1.00 0.00 C ATOM 955 C LEU A 63 14.019 -10.271 -12.533 1.00 0.00 C ATOM 956 O LEU A 63 13.431 -10.698 -11.539 1.00 0.00 O ATOM 957 CB LEU A 63 13.128 -10.228 -14.870 1.00 0.00 C ATOM 958 CG LEU A 63 12.724 -9.425 -16.107 1.00 0.00 C ATOM 959 CD1 LEU A 63 12.616 -10.334 -17.322 1.00 0.00 C ATOM 960 CD2 LEU A 63 11.409 -8.698 -15.865 1.00 0.00 C ATOM 0 H LEU A 63 14.953 -8.306 -14.168 1.00 0.00 H new ATOM 0 HA LEU A 63 12.299 -9.183 -13.184 1.00 0.00 H new ATOM 0 HB2 LEU A 63 14.072 -10.732 -15.081 1.00 0.00 H new ATOM 0 HB3 LEU A 63 12.382 -11.005 -14.706 1.00 0.00 H new ATOM 0 HG LEU A 63 13.497 -8.682 -16.302 1.00 0.00 H new ATOM 0 HD11 LEU A 63 12.328 -9.745 -18.193 1.00 0.00 H new ATOM 0 HD12 LEU A 63 13.579 -10.809 -17.508 1.00 0.00 H new ATOM 0 HD13 LEU A 63 11.863 -11.101 -17.137 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.137 -8.132 -16.756 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.627 -9.424 -15.644 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.520 -8.016 -15.022 1.00 0.00 H new ATOM 972 N LYS A 64 15.306 -10.503 -12.767 1.00 0.00 N ATOM 973 CA LYS A 64 16.121 -11.289 -11.848 1.00 0.00 C ATOM 974 C LYS A 64 15.918 -10.827 -10.409 1.00 0.00 C ATOM 975 O LYS A 64 15.895 -11.638 -9.483 1.00 0.00 O ATOM 976 CB LYS A 64 17.600 -11.182 -12.227 1.00 0.00 C ATOM 977 CG LYS A 64 18.067 -9.755 -12.456 1.00 0.00 C ATOM 978 CD LYS A 64 19.147 -9.686 -13.522 1.00 0.00 C ATOM 979 CE LYS A 64 20.369 -10.503 -13.130 1.00 0.00 C ATOM 980 NZ LYS A 64 20.270 -11.911 -13.605 1.00 0.00 N ATOM 0 H LYS A 64 15.807 -10.158 -13.585 1.00 0.00 H new ATOM 0 HA LYS A 64 15.808 -12.330 -11.923 1.00 0.00 H new ATOM 0 HB2 LYS A 64 18.202 -11.630 -11.437 1.00 0.00 H new ATOM 0 HB3 LYS A 64 17.778 -11.763 -13.132 1.00 0.00 H new ATOM 0 HG2 LYS A 64 17.220 -9.138 -12.755 1.00 0.00 H new ATOM 0 HG3 LYS A 64 18.449 -9.342 -11.522 1.00 0.00 H new ATOM 0 HD2 LYS A 64 18.750 -10.054 -14.468 1.00 0.00 H new ATOM 0 HD3 LYS A 64 19.438 -8.648 -13.681 1.00 0.00 H new ATOM 0 HE2 LYS A 64 21.264 -10.041 -13.547 1.00 0.00 H new ATOM 0 HE3 LYS A 64 20.481 -10.492 -12.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 21.217 -12.260 -13.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 19.871 -12.505 -12.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 19.653 -11.953 -14.441 1.00 0.00 H new ATOM 994 N TYR A 65 15.771 -9.519 -10.228 1.00 0.00 N ATOM 995 CA TYR A 65 15.572 -8.949 -8.901 1.00 0.00 C ATOM 996 C TYR A 65 14.124 -8.508 -8.710 1.00 0.00 C ATOM 997 O TYR A 65 13.855 -7.383 -8.289 1.00 0.00 O ATOM 998 CB TYR A 65 16.510 -7.760 -8.687 1.00 0.00 C ATOM 999 CG TYR A 65 17.970 -8.147 -8.615 1.00 0.00 C ATOM 1000 CD1 TYR A 65 18.452 -8.925 -7.569 1.00 0.00 C ATOM 1001 CD2 TYR A 65 18.868 -7.734 -9.591 1.00 0.00 C ATOM 1002 CE1 TYR A 65 19.785 -9.281 -7.498 1.00 0.00 C ATOM 1003 CE2 TYR A 65 20.203 -8.086 -9.529 1.00 0.00 C ATOM 1004 CZ TYR A 65 20.656 -8.859 -8.481 1.00 0.00 C ATOM 1005 OH TYR A 65 21.985 -9.210 -8.415 1.00 0.00 O ATOM 0 H TYR A 65 15.786 -8.834 -10.983 1.00 0.00 H new ATOM 0 HA TYR A 65 15.799 -9.720 -8.165 1.00 0.00 H new ATOM 0 HB2 TYR A 65 16.371 -7.047 -9.500 1.00 0.00 H new ATOM 0 HB3 TYR A 65 16.232 -7.250 -7.765 1.00 0.00 H new ATOM 0 HD1 TYR A 65 17.772 -9.257 -6.798 1.00 0.00 H new ATOM 0 HD2 TYR A 65 18.517 -7.127 -10.413 1.00 0.00 H new ATOM 0 HE1 TYR A 65 20.143 -9.886 -6.678 1.00 0.00 H new ATOM 0 HE2 TYR A 65 20.888 -7.757 -10.297 1.00 0.00 H new ATOM 0 HH TYR A 65 22.461 -8.833 -9.184 1.00 0.00 H new ATOM 1015 N PHE A 66 13.193 -9.405 -9.020 1.00 0.00 N ATOM 1016 CA PHE A 66 11.772 -9.111 -8.883 1.00 0.00 C ATOM 1017 C PHE A 66 11.243 -9.596 -7.537 1.00 0.00 C ATOM 1018 O PHE A 66 10.736 -8.810 -6.736 1.00 0.00 O ATOM 1019 CB PHE A 66 10.982 -9.764 -10.020 1.00 0.00 C ATOM 1020 CG PHE A 66 9.514 -9.447 -9.989 1.00 0.00 C ATOM 1021 CD1 PHE A 66 8.645 -10.201 -9.216 1.00 0.00 C ATOM 1022 CD2 PHE A 66 9.003 -8.396 -10.733 1.00 0.00 C ATOM 1023 CE1 PHE A 66 7.294 -9.911 -9.187 1.00 0.00 C ATOM 1024 CE2 PHE A 66 7.653 -8.102 -10.708 1.00 0.00 C ATOM 1025 CZ PHE A 66 6.798 -8.860 -9.933 1.00 0.00 C ATOM 0 H PHE A 66 13.398 -10.342 -9.368 1.00 0.00 H new ATOM 0 HA PHE A 66 11.644 -8.030 -8.935 1.00 0.00 H new ATOM 0 HB2 PHE A 66 11.396 -9.437 -10.974 1.00 0.00 H new ATOM 0 HB3 PHE A 66 11.113 -10.845 -9.969 1.00 0.00 H new ATOM 0 HD1 PHE A 66 9.028 -11.024 -8.630 1.00 0.00 H new ATOM 0 HD2 PHE A 66 9.668 -7.799 -11.340 1.00 0.00 H new ATOM 0 HE1 PHE A 66 6.627 -10.506 -8.581 1.00 0.00 H new ATOM 0 HE2 PHE A 66 7.267 -7.281 -11.294 1.00 0.00 H new ATOM 0 HZ PHE A 66 5.743 -8.631 -9.910 1.00 0.00 H new ATOM 1035 N LEU A 67 11.364 -10.897 -7.295 1.00 0.00 N ATOM 1036 CA LEU A 67 10.898 -11.489 -6.046 1.00 0.00 C ATOM 1037 C LEU A 67 11.455 -10.733 -4.844 1.00 0.00 C ATOM 1038 O LEU A 67 10.826 -10.680 -3.787 1.00 0.00 O ATOM 1039 CB LEU A 67 11.309 -12.961 -5.972 1.00 0.00 C ATOM 1040 CG LEU A 67 10.978 -13.812 -7.198 1.00 0.00 C ATOM 1041 CD1 LEU A 67 11.341 -15.268 -6.950 1.00 0.00 C ATOM 1042 CD2 LEU A 67 9.505 -13.682 -7.556 1.00 0.00 C ATOM 0 H LEU A 67 11.781 -11.562 -7.947 1.00 0.00 H new ATOM 0 HA LEU A 67 9.810 -11.420 -6.023 1.00 0.00 H new ATOM 0 HB2 LEU A 67 12.384 -13.009 -5.801 1.00 0.00 H new ATOM 0 HB3 LEU A 67 10.827 -13.409 -5.103 1.00 0.00 H new ATOM 0 HG LEU A 67 11.569 -13.449 -8.039 1.00 0.00 H new ATOM 0 HD11 LEU A 67 11.099 -15.859 -7.833 1.00 0.00 H new ATOM 0 HD12 LEU A 67 12.408 -15.347 -6.743 1.00 0.00 H new ATOM 0 HD13 LEU A 67 10.777 -15.643 -6.096 1.00 0.00 H new ATOM 0 HD21 LEU A 67 9.288 -14.295 -8.431 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.896 -14.018 -6.717 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.275 -12.640 -7.777 1.00 0.00 H new ATOM 1054 N GLN A 68 12.636 -10.148 -5.014 1.00 0.00 N ATOM 1055 CA GLN A 68 13.276 -9.393 -3.943 1.00 0.00 C ATOM 1056 C GLN A 68 12.294 -8.415 -3.305 1.00 0.00 C ATOM 1057 O GLN A 68 12.204 -8.321 -2.081 1.00 0.00 O ATOM 1058 CB GLN A 68 14.492 -8.636 -4.480 1.00 0.00 C ATOM 1059 CG GLN A 68 15.459 -8.191 -3.395 1.00 0.00 C ATOM 1060 CD GLN A 68 16.901 -8.192 -3.863 1.00 0.00 C ATOM 1061 OE1 GLN A 68 17.613 -7.197 -3.722 1.00 0.00 O ATOM 1062 NE2 GLN A 68 17.341 -9.313 -4.424 1.00 0.00 N ATOM 0 H GLN A 68 13.169 -10.182 -5.883 1.00 0.00 H new ATOM 0 HA GLN A 68 13.605 -10.099 -3.181 1.00 0.00 H new ATOM 0 HB2 GLN A 68 15.022 -9.272 -5.189 1.00 0.00 H new ATOM 0 HB3 GLN A 68 14.150 -7.760 -5.032 1.00 0.00 H new ATOM 0 HG2 GLN A 68 15.190 -7.189 -3.062 1.00 0.00 H new ATOM 0 HG3 GLN A 68 15.360 -8.850 -2.533 1.00 0.00 H new ATOM 0 HE21 GLN A 68 16.717 -10.114 -4.521 1.00 0.00 H new ATOM 0 HE22 GLN A 68 18.303 -9.373 -4.758 1.00 0.00 H new ATOM 1071 N ARG A 69 11.561 -7.689 -4.142 1.00 0.00 N ATOM 1072 CA ARG A 69 10.588 -6.717 -3.660 1.00 0.00 C ATOM 1073 C ARG A 69 9.661 -7.345 -2.623 1.00 0.00 C ATOM 1074 O ARG A 69 9.746 -7.041 -1.433 1.00 0.00 O ATOM 1075 CB ARG A 69 9.766 -6.164 -4.825 1.00 0.00 C ATOM 1076 CG ARG A 69 10.361 -4.912 -5.450 1.00 0.00 C ATOM 1077 CD ARG A 69 10.406 -3.761 -4.457 1.00 0.00 C ATOM 1078 NE ARG A 69 9.147 -3.616 -3.731 1.00 0.00 N ATOM 1079 CZ ARG A 69 9.038 -2.981 -2.569 1.00 0.00 C ATOM 1080 NH1 ARG A 69 10.107 -2.437 -2.004 1.00 0.00 N ATOM 1081 NH2 ARG A 69 7.858 -2.891 -1.970 1.00 0.00 N ATOM 0 H ARG A 69 11.623 -7.756 -5.158 1.00 0.00 H new ATOM 0 HA ARG A 69 11.133 -5.899 -3.189 1.00 0.00 H new ATOM 0 HB2 ARG A 69 9.674 -6.934 -5.591 1.00 0.00 H new ATOM 0 HB3 ARG A 69 8.758 -5.941 -4.474 1.00 0.00 H new ATOM 0 HG2 ARG A 69 11.369 -5.126 -5.807 1.00 0.00 H new ATOM 0 HG3 ARG A 69 9.770 -4.622 -6.319 1.00 0.00 H new ATOM 0 HD2 ARG A 69 11.217 -3.926 -3.747 1.00 0.00 H new ATOM 0 HD3 ARG A 69 10.628 -2.834 -4.986 1.00 0.00 H new ATOM 0 HE ARG A 69 8.306 -4.024 -4.138 1.00 0.00 H new ATOM 0 HH11 ARG A 69 11.016 -2.505 -2.461 1.00 0.00 H new ATOM 0 HH12 ARG A 69 10.020 -1.950 -1.112 1.00 0.00 H new ATOM 0 HH21 ARG A 69 7.034 -3.309 -2.401 1.00 0.00 H new ATOM 0 HH22 ARG A 69 7.775 -2.403 -1.078 1.00 0.00 H new ATOM 1095 N PHE A 70 8.775 -8.223 -3.083 1.00 0.00 N ATOM 1096 CA PHE A 70 7.831 -8.893 -2.197 1.00 0.00 C ATOM 1097 C PHE A 70 8.564 -9.758 -1.176 1.00 0.00 C ATOM 1098 O PHE A 70 8.628 -9.422 0.006 1.00 0.00 O ATOM 1099 CB PHE A 70 6.859 -9.752 -3.008 1.00 0.00 C ATOM 1100 CG PHE A 70 5.956 -8.954 -3.903 1.00 0.00 C ATOM 1101 CD1 PHE A 70 6.408 -8.488 -5.127 1.00 0.00 C ATOM 1102 CD2 PHE A 70 4.655 -8.669 -3.521 1.00 0.00 C ATOM 1103 CE1 PHE A 70 5.579 -7.752 -5.953 1.00 0.00 C ATOM 1104 CE2 PHE A 70 3.822 -7.934 -4.343 1.00 0.00 C ATOM 1105 CZ PHE A 70 4.284 -7.476 -5.561 1.00 0.00 C ATOM 0 H PHE A 70 8.692 -8.487 -4.065 1.00 0.00 H new ATOM 0 HA PHE A 70 7.268 -8.129 -1.661 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.428 -10.456 -3.615 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.250 -10.342 -2.323 1.00 0.00 H new ATOM 0 HD1 PHE A 70 7.419 -8.702 -5.439 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.288 -9.025 -2.570 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.944 -7.393 -6.904 1.00 0.00 H new ATOM 0 HE2 PHE A 70 2.810 -7.718 -4.033 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.634 -6.903 -6.206 1.00 0.00 H new ATOM 1115 N GLU A 71 9.114 -10.875 -1.642 1.00 0.00 N ATOM 1116 CA GLU A 71 9.841 -11.790 -0.770 1.00 0.00 C ATOM 1117 C GLU A 71 10.894 -11.044 0.044 1.00 0.00 C ATOM 1118 O GLU A 71 11.244 -9.906 -0.268 1.00 0.00 O ATOM 1119 CB GLU A 71 10.505 -12.895 -1.593 1.00 0.00 C ATOM 1120 CG GLU A 71 10.747 -14.175 -0.811 1.00 0.00 C ATOM 1121 CD GLU A 71 9.484 -14.711 -0.164 1.00 0.00 C ATOM 1122 OE1 GLU A 71 9.162 -14.274 0.960 1.00 0.00 O ATOM 1123 OE2 GLU A 71 8.818 -15.567 -0.783 1.00 0.00 O ATOM 0 H GLU A 71 9.070 -11.168 -2.618 1.00 0.00 H new ATOM 0 HA GLU A 71 9.126 -12.240 -0.081 1.00 0.00 H new ATOM 0 HB2 GLU A 71 9.879 -13.120 -2.456 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.457 -12.528 -1.977 1.00 0.00 H new ATOM 0 HG2 GLU A 71 11.158 -14.932 -1.479 1.00 0.00 H new ATOM 0 HG3 GLU A 71 11.495 -13.990 -0.040 1.00 0.00 H new ATOM 1130 N SER A 72 11.395 -11.694 1.090 1.00 0.00 N ATOM 1131 CA SER A 72 12.405 -11.092 1.952 1.00 0.00 C ATOM 1132 C SER A 72 13.682 -11.927 1.960 1.00 0.00 C ATOM 1133 O SER A 72 14.547 -11.751 2.816 1.00 0.00 O ATOM 1134 CB SER A 72 11.869 -10.946 3.377 1.00 0.00 C ATOM 1135 OG SER A 72 11.113 -9.756 3.519 1.00 0.00 O ATOM 0 H SER A 72 11.118 -12.638 1.361 1.00 0.00 H new ATOM 0 HA SER A 72 12.641 -10.104 1.557 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.248 -11.807 3.625 1.00 0.00 H new ATOM 0 HB3 SER A 72 12.700 -10.939 4.082 1.00 0.00 H new ATOM 0 HG SER A 72 10.780 -9.687 4.438 1.00 0.00 H new ATOM 1141 N GLY A 73 13.791 -12.839 0.998 1.00 0.00 N ATOM 1142 CA GLY A 73 14.963 -13.689 0.911 1.00 0.00 C ATOM 1143 C GLY A 73 15.374 -13.967 -0.522 1.00 0.00 C ATOM 1144 O GLY A 73 16.204 -14.837 -0.779 1.00 0.00 O ATOM 0 H GLY A 73 13.088 -13.004 0.278 1.00 0.00 H new ATOM 0 HA2 GLY A 73 15.791 -13.215 1.438 1.00 0.00 H new ATOM 0 HA3 GLY A 73 14.762 -14.633 1.417 1.00 0.00 H new ATOM 1148 N ALA A 74 14.789 -13.225 -1.457 1.00 0.00 N ATOM 1149 CA ALA A 74 15.099 -13.396 -2.871 1.00 0.00 C ATOM 1150 C ALA A 74 16.416 -12.715 -3.230 1.00 0.00 C ATOM 1151 O ALA A 74 16.586 -11.516 -3.011 1.00 0.00 O ATOM 1152 CB ALA A 74 13.968 -12.848 -3.729 1.00 0.00 C ATOM 0 H ALA A 74 14.098 -12.500 -1.261 1.00 0.00 H new ATOM 0 HA ALA A 74 15.206 -14.463 -3.068 1.00 0.00 H new ATOM 0 HB1 ALA A 74 14.213 -12.982 -4.783 1.00 0.00 H new ATOM 0 HB2 ALA A 74 13.046 -13.382 -3.500 1.00 0.00 H new ATOM 0 HB3 ALA A 74 13.834 -11.787 -3.520 1.00 0.00 H new ATOM 1158 N ARG A 75 17.345 -13.489 -3.782 1.00 0.00 N ATOM 1159 CA ARG A 75 18.647 -12.961 -4.170 1.00 0.00 C ATOM 1160 C ARG A 75 18.706 -12.707 -5.673 1.00 0.00 C ATOM 1161 O ARG A 75 18.671 -11.561 -6.122 1.00 0.00 O ATOM 1162 CB ARG A 75 19.757 -13.932 -3.762 1.00 0.00 C ATOM 1163 CG ARG A 75 19.277 -15.362 -3.579 1.00 0.00 C ATOM 1164 CD ARG A 75 20.440 -16.343 -3.571 1.00 0.00 C ATOM 1165 NE ARG A 75 20.104 -17.584 -2.879 1.00 0.00 N ATOM 1166 CZ ARG A 75 19.329 -18.529 -3.399 1.00 0.00 C ATOM 1167 NH1 ARG A 75 18.813 -18.375 -4.611 1.00 0.00 N ATOM 1168 NH2 ARG A 75 19.069 -19.631 -2.707 1.00 0.00 N ATOM 0 H ARG A 75 17.220 -14.484 -3.970 1.00 0.00 H new ATOM 0 HA ARG A 75 18.795 -12.013 -3.653 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.540 -13.915 -4.520 1.00 0.00 H new ATOM 0 HB3 ARG A 75 20.207 -13.586 -2.831 1.00 0.00 H new ATOM 0 HG2 ARG A 75 18.724 -15.444 -2.644 1.00 0.00 H new ATOM 0 HG3 ARG A 75 18.587 -15.621 -4.382 1.00 0.00 H new ATOM 0 HD2 ARG A 75 20.732 -16.568 -4.597 1.00 0.00 H new ATOM 0 HD3 ARG A 75 21.301 -15.881 -3.089 1.00 0.00 H new ATOM 0 HE ARG A 75 20.485 -17.733 -1.945 1.00 0.00 H new ATOM 0 HH11 ARG A 75 19.011 -17.529 -5.146 1.00 0.00 H new ATOM 0 HH12 ARG A 75 18.218 -19.102 -5.008 1.00 0.00 H new ATOM 0 HH21 ARG A 75 19.464 -19.753 -1.775 1.00 0.00 H new ATOM 0 HH22 ARG A 75 18.474 -20.356 -3.107 1.00 0.00 H new ATOM 1182 N VAL A 76 18.794 -13.784 -6.447 1.00 0.00 N ATOM 1183 CA VAL A 76 18.856 -13.678 -7.900 1.00 0.00 C ATOM 1184 C VAL A 76 18.043 -14.781 -8.567 1.00 0.00 C ATOM 1185 O VAL A 76 18.407 -15.957 -8.511 1.00 0.00 O ATOM 1186 CB VAL A 76 20.309 -13.750 -8.406 1.00 0.00 C ATOM 1187 CG1 VAL A 76 20.403 -13.239 -9.836 1.00 0.00 C ATOM 1188 CG2 VAL A 76 21.232 -12.961 -7.489 1.00 0.00 C ATOM 0 H VAL A 76 18.824 -14.740 -6.092 1.00 0.00 H new ATOM 0 HA VAL A 76 18.434 -12.709 -8.165 1.00 0.00 H new ATOM 0 HB VAL A 76 20.627 -14.792 -8.396 1.00 0.00 H new ATOM 0 HG11 VAL A 76 21.437 -13.298 -10.176 1.00 0.00 H new ATOM 0 HG12 VAL A 76 19.773 -13.850 -10.483 1.00 0.00 H new ATOM 0 HG13 VAL A 76 20.066 -12.203 -9.875 1.00 0.00 H new ATOM 0 HG21 VAL A 76 22.255 -13.023 -7.861 1.00 0.00 H new ATOM 0 HG22 VAL A 76 20.917 -11.918 -7.465 1.00 0.00 H new ATOM 0 HG23 VAL A 76 21.187 -13.376 -6.482 1.00 0.00 H new ATOM 1198 N LEU A 77 16.939 -14.396 -9.197 1.00 0.00 N ATOM 1199 CA LEU A 77 16.072 -15.353 -9.877 1.00 0.00 C ATOM 1200 C LEU A 77 16.864 -16.192 -10.875 1.00 0.00 C ATOM 1201 O LEU A 77 18.036 -15.921 -11.138 1.00 0.00 O ATOM 1202 CB LEU A 77 14.937 -14.622 -10.595 1.00 0.00 C ATOM 1203 CG LEU A 77 13.615 -14.520 -9.832 1.00 0.00 C ATOM 1204 CD1 LEU A 77 12.871 -13.252 -10.219 1.00 0.00 C ATOM 1205 CD2 LEU A 77 12.753 -15.747 -10.094 1.00 0.00 C ATOM 0 H LEU A 77 16.623 -13.428 -9.251 1.00 0.00 H new ATOM 0 HA LEU A 77 15.648 -16.020 -9.126 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.275 -13.613 -10.833 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.749 -15.127 -11.542 1.00 0.00 H new ATOM 0 HG LEU A 77 13.836 -14.475 -8.766 1.00 0.00 H new ATOM 0 HD11 LEU A 77 11.933 -13.197 -9.666 1.00 0.00 H new ATOM 0 HD12 LEU A 77 13.484 -12.383 -9.980 1.00 0.00 H new ATOM 0 HD13 LEU A 77 12.661 -13.265 -11.289 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.816 -15.658 -9.544 1.00 0.00 H new ATOM 0 HD22 LEU A 77 12.541 -15.822 -11.161 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.283 -16.641 -9.766 1.00 0.00 H new ATOM 1217 N THR A 78 16.215 -17.210 -11.430 1.00 0.00 N ATOM 1218 CA THR A 78 16.857 -18.088 -12.400 1.00 0.00 C ATOM 1219 C THR A 78 16.954 -17.419 -13.767 1.00 0.00 C ATOM 1220 O THR A 78 16.296 -16.412 -14.024 1.00 0.00 O ATOM 1221 CB THR A 78 16.094 -19.418 -12.546 1.00 0.00 C ATOM 1222 OG1 THR A 78 14.814 -19.186 -13.144 1.00 0.00 O ATOM 1223 CG2 THR A 78 15.913 -20.089 -11.192 1.00 0.00 C ATOM 0 H THR A 78 15.245 -17.447 -11.224 1.00 0.00 H new ATOM 0 HA THR A 78 17.860 -18.292 -12.026 1.00 0.00 H new ATOM 0 HB THR A 78 16.679 -20.078 -13.186 1.00 0.00 H new ATOM 0 HG1 THR A 78 14.539 -19.981 -13.646 1.00 0.00 H new ATOM 0 HG21 THR A 78 15.372 -21.026 -11.320 1.00 0.00 H new ATOM 0 HG22 THR A 78 16.890 -20.291 -10.753 1.00 0.00 H new ATOM 0 HG23 THR A 78 15.348 -19.431 -10.532 1.00 0.00 H new ATOM 1231 N ALA A 79 17.780 -17.986 -14.640 1.00 0.00 N ATOM 1232 CA ALA A 79 17.962 -17.446 -15.982 1.00 0.00 C ATOM 1233 C ALA A 79 16.804 -17.840 -16.893 1.00 0.00 C ATOM 1234 O ALA A 79 16.759 -17.447 -18.059 1.00 0.00 O ATOM 1235 CB ALA A 79 19.283 -17.921 -16.568 1.00 0.00 C ATOM 0 H ALA A 79 18.334 -18.819 -14.442 1.00 0.00 H new ATOM 0 HA ALA A 79 17.980 -16.359 -15.910 1.00 0.00 H new ATOM 0 HB1 ALA A 79 19.405 -17.510 -17.570 1.00 0.00 H new ATOM 0 HB2 ALA A 79 20.104 -17.584 -15.935 1.00 0.00 H new ATOM 0 HB3 ALA A 79 19.288 -19.010 -16.619 1.00 0.00 H new ATOM 1241 N SER A 80 15.871 -18.618 -16.354 1.00 0.00 N ATOM 1242 CA SER A 80 14.716 -19.068 -17.121 1.00 0.00 C ATOM 1243 C SER A 80 13.458 -18.311 -16.704 1.00 0.00 C ATOM 1244 O SER A 80 12.689 -17.854 -17.548 1.00 0.00 O ATOM 1245 CB SER A 80 14.506 -20.572 -16.931 1.00 0.00 C ATOM 1246 OG SER A 80 15.061 -21.304 -18.010 1.00 0.00 O ATOM 0 H SER A 80 15.892 -18.950 -15.390 1.00 0.00 H new ATOM 0 HA SER A 80 14.909 -18.865 -18.174 1.00 0.00 H new ATOM 0 HB2 SER A 80 14.966 -20.891 -15.996 1.00 0.00 H new ATOM 0 HB3 SER A 80 13.440 -20.787 -16.852 1.00 0.00 H new ATOM 0 HG SER A 80 14.915 -22.262 -17.864 1.00 0.00 H new ATOM 1252 N GLU A 81 13.258 -18.184 -15.396 1.00 0.00 N ATOM 1253 CA GLU A 81 12.094 -17.483 -14.867 1.00 0.00 C ATOM 1254 C GLU A 81 12.002 -16.071 -15.439 1.00 0.00 C ATOM 1255 O GLU A 81 10.966 -15.669 -15.967 1.00 0.00 O ATOM 1256 CB GLU A 81 12.158 -17.424 -13.339 1.00 0.00 C ATOM 1257 CG GLU A 81 11.878 -18.757 -12.666 1.00 0.00 C ATOM 1258 CD GLU A 81 12.415 -18.819 -11.249 1.00 0.00 C ATOM 1259 OE1 GLU A 81 13.556 -18.363 -11.027 1.00 0.00 O ATOM 1260 OE2 GLU A 81 11.694 -19.322 -10.362 1.00 0.00 O ATOM 0 H GLU A 81 13.886 -18.557 -14.684 1.00 0.00 H new ATOM 0 HA GLU A 81 11.203 -18.035 -15.165 1.00 0.00 H new ATOM 0 HB2 GLU A 81 13.146 -17.075 -13.038 1.00 0.00 H new ATOM 0 HB3 GLU A 81 11.438 -16.688 -12.982 1.00 0.00 H new ATOM 0 HG2 GLU A 81 10.802 -18.933 -12.651 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.324 -19.558 -13.255 1.00 0.00 H new ATOM 1267 N THR A 82 13.095 -15.322 -15.328 1.00 0.00 N ATOM 1268 CA THR A 82 13.139 -13.955 -15.831 1.00 0.00 C ATOM 1269 C THR A 82 12.702 -13.893 -17.290 1.00 0.00 C ATOM 1270 O THR A 82 11.839 -13.095 -17.657 1.00 0.00 O ATOM 1271 CB THR A 82 14.552 -13.355 -15.704 1.00 0.00 C ATOM 1272 OG1 THR A 82 15.482 -14.121 -16.477 1.00 0.00 O ATOM 1273 CG2 THR A 82 14.997 -13.324 -14.249 1.00 0.00 C ATOM 0 H THR A 82 13.962 -15.640 -14.894 1.00 0.00 H new ATOM 0 HA THR A 82 12.449 -13.371 -15.222 1.00 0.00 H new ATOM 0 HB THR A 82 14.524 -12.333 -16.081 1.00 0.00 H new ATOM 0 HG1 THR A 82 16.377 -13.731 -16.392 1.00 0.00 H new ATOM 0 HG21 THR A 82 15.998 -12.896 -14.184 1.00 0.00 H new ATOM 0 HG22 THR A 82 14.303 -12.715 -13.669 1.00 0.00 H new ATOM 0 HG23 THR A 82 15.009 -14.338 -13.851 1.00 0.00 H new ATOM 1281 N LYS A 83 13.304 -14.738 -18.120 1.00 0.00 N ATOM 1282 CA LYS A 83 12.976 -14.781 -19.540 1.00 0.00 C ATOM 1283 C LYS A 83 11.468 -14.871 -19.748 1.00 0.00 C ATOM 1284 O LYS A 83 10.905 -14.179 -20.598 1.00 0.00 O ATOM 1285 CB LYS A 83 13.665 -15.973 -20.208 1.00 0.00 C ATOM 1286 CG LYS A 83 13.379 -16.087 -21.695 1.00 0.00 C ATOM 1287 CD LYS A 83 14.184 -17.205 -22.335 1.00 0.00 C ATOM 1288 CE LYS A 83 13.451 -18.535 -22.256 1.00 0.00 C ATOM 1289 NZ LYS A 83 13.832 -19.446 -23.371 1.00 0.00 N ATOM 0 H LYS A 83 14.022 -15.403 -17.833 1.00 0.00 H new ATOM 0 HA LYS A 83 13.334 -13.859 -19.997 1.00 0.00 H new ATOM 0 HB2 LYS A 83 14.742 -15.890 -20.059 1.00 0.00 H new ATOM 0 HB3 LYS A 83 13.345 -16.890 -19.714 1.00 0.00 H new ATOM 0 HG2 LYS A 83 12.315 -16.270 -21.849 1.00 0.00 H new ATOM 0 HG3 LYS A 83 13.614 -15.142 -22.185 1.00 0.00 H new ATOM 0 HD2 LYS A 83 14.384 -16.960 -23.378 1.00 0.00 H new ATOM 0 HD3 LYS A 83 15.150 -17.290 -21.837 1.00 0.00 H new ATOM 0 HE2 LYS A 83 13.672 -19.015 -21.303 1.00 0.00 H new ATOM 0 HE3 LYS A 83 12.376 -18.359 -22.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 13.311 -20.341 -23.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 13.598 -18.999 -24.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 14.854 -19.635 -23.331 1.00 0.00 H new ATOM 1303 N THR A 84 10.817 -15.726 -18.966 1.00 0.00 N ATOM 1304 CA THR A 84 9.374 -15.906 -19.064 1.00 0.00 C ATOM 1305 C THR A 84 8.635 -14.923 -18.162 1.00 0.00 C ATOM 1306 O THR A 84 7.672 -15.288 -17.488 1.00 0.00 O ATOM 1307 CB THR A 84 8.959 -17.341 -18.689 1.00 0.00 C ATOM 1308 OG1 THR A 84 7.544 -17.498 -18.841 1.00 0.00 O ATOM 1309 CG2 THR A 84 9.359 -17.663 -17.257 1.00 0.00 C ATOM 0 H THR A 84 11.267 -16.305 -18.257 1.00 0.00 H new ATOM 0 HA THR A 84 9.102 -15.718 -20.103 1.00 0.00 H new ATOM 0 HB THR A 84 9.474 -18.031 -19.358 1.00 0.00 H new ATOM 0 HG1 THR A 84 7.080 -16.848 -18.273 1.00 0.00 H new ATOM 0 HG21 THR A 84 9.056 -18.682 -17.015 1.00 0.00 H new ATOM 0 HG22 THR A 84 10.440 -17.572 -17.152 1.00 0.00 H new ATOM 0 HG23 THR A 84 8.868 -16.967 -16.577 1.00 0.00 H new ATOM 1317 N PHE A 85 9.091 -13.675 -18.155 1.00 0.00 N ATOM 1318 CA PHE A 85 8.473 -12.640 -17.335 1.00 0.00 C ATOM 1319 C PHE A 85 7.990 -11.479 -18.199 1.00 0.00 C ATOM 1320 O PHE A 85 6.856 -11.017 -18.061 1.00 0.00 O ATOM 1321 CB PHE A 85 9.464 -12.132 -16.286 1.00 0.00 C ATOM 1322 CG PHE A 85 8.817 -11.756 -14.983 1.00 0.00 C ATOM 1323 CD1 PHE A 85 8.318 -12.732 -14.135 1.00 0.00 C ATOM 1324 CD2 PHE A 85 8.708 -10.427 -14.607 1.00 0.00 C ATOM 1325 CE1 PHE A 85 7.722 -12.388 -12.937 1.00 0.00 C ATOM 1326 CE2 PHE A 85 8.113 -10.078 -13.409 1.00 0.00 C ATOM 1327 CZ PHE A 85 7.620 -11.060 -12.572 1.00 0.00 C ATOM 0 H PHE A 85 9.886 -13.356 -18.708 1.00 0.00 H new ATOM 0 HA PHE A 85 7.612 -13.077 -16.830 1.00 0.00 H new ATOM 0 HB2 PHE A 85 10.213 -12.902 -16.102 1.00 0.00 H new ATOM 0 HB3 PHE A 85 9.990 -11.265 -16.685 1.00 0.00 H new ATOM 0 HD1 PHE A 85 8.396 -13.773 -14.414 1.00 0.00 H new ATOM 0 HD2 PHE A 85 9.092 -9.655 -15.257 1.00 0.00 H new ATOM 0 HE1 PHE A 85 7.336 -13.158 -12.286 1.00 0.00 H new ATOM 0 HE2 PHE A 85 8.034 -9.038 -13.128 1.00 0.00 H new ATOM 0 HZ PHE A 85 7.156 -10.790 -11.635 1.00 0.00 H new ATOM 1337 N LEU A 86 8.857 -11.010 -19.089 1.00 0.00 N ATOM 1338 CA LEU A 86 8.520 -9.902 -19.976 1.00 0.00 C ATOM 1339 C LEU A 86 8.569 -10.340 -21.437 1.00 0.00 C ATOM 1340 O LEU A 86 7.949 -9.721 -22.301 1.00 0.00 O ATOM 1341 CB LEU A 86 9.479 -8.732 -19.750 1.00 0.00 C ATOM 1342 CG LEU A 86 10.962 -9.026 -19.979 1.00 0.00 C ATOM 1343 CD1 LEU A 86 11.266 -9.110 -21.467 1.00 0.00 C ATOM 1344 CD2 LEU A 86 11.825 -7.963 -19.316 1.00 0.00 C ATOM 0 H LEU A 86 9.799 -11.380 -19.216 1.00 0.00 H new ATOM 0 HA LEU A 86 7.504 -9.581 -19.746 1.00 0.00 H new ATOM 0 HB2 LEU A 86 9.185 -7.915 -20.409 1.00 0.00 H new ATOM 0 HB3 LEU A 86 9.353 -8.377 -18.727 1.00 0.00 H new ATOM 0 HG LEU A 86 11.196 -9.990 -19.526 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.326 -9.320 -21.611 1.00 0.00 H new ATOM 0 HD12 LEU A 86 10.674 -9.908 -21.915 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.016 -8.162 -21.944 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.877 -8.188 -19.489 1.00 0.00 H new ATOM 0 HD22 LEU A 86 11.589 -6.987 -19.739 1.00 0.00 H new ATOM 0 HD23 LEU A 86 11.628 -7.951 -18.244 1.00 0.00 H new ATOM 1356 N ALA A 87 9.308 -11.411 -21.704 1.00 0.00 N ATOM 1357 CA ALA A 87 9.434 -11.934 -23.059 1.00 0.00 C ATOM 1358 C ALA A 87 8.162 -12.658 -23.488 1.00 0.00 C ATOM 1359 O ALA A 87 7.921 -12.855 -24.679 1.00 0.00 O ATOM 1360 CB ALA A 87 10.633 -12.867 -23.155 1.00 0.00 C ATOM 0 H ALA A 87 9.829 -11.934 -21.000 1.00 0.00 H new ATOM 0 HA ALA A 87 9.587 -11.092 -23.735 1.00 0.00 H new ATOM 0 HB1 ALA A 87 10.715 -13.250 -24.172 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.541 -12.321 -22.899 1.00 0.00 H new ATOM 0 HB3 ALA A 87 10.503 -13.699 -22.463 1.00 0.00 H new ATOM 1366 N ALA A 88 7.353 -13.052 -22.511 1.00 0.00 N ATOM 1367 CA ALA A 88 6.105 -13.753 -22.789 1.00 0.00 C ATOM 1368 C ALA A 88 5.174 -12.899 -23.642 1.00 0.00 C ATOM 1369 O ALA A 88 4.531 -13.398 -24.565 1.00 0.00 O ATOM 1370 CB ALA A 88 5.420 -14.147 -21.489 1.00 0.00 C ATOM 0 H ALA A 88 7.539 -12.898 -21.520 1.00 0.00 H new ATOM 0 HA ALA A 88 6.342 -14.657 -23.350 1.00 0.00 H new ATOM 0 HB1 ALA A 88 4.490 -14.669 -21.712 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.076 -14.802 -20.916 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.203 -13.252 -20.906 1.00 0.00 H new ATOM 1376 N ALA A 89 5.107 -11.610 -23.328 1.00 0.00 N ATOM 1377 CA ALA A 89 4.255 -10.686 -24.067 1.00 0.00 C ATOM 1378 C ALA A 89 4.504 -10.792 -25.568 1.00 0.00 C ATOM 1379 O ALA A 89 3.703 -11.374 -26.300 1.00 0.00 O ATOM 1380 CB ALA A 89 4.485 -9.260 -23.591 1.00 0.00 C ATOM 0 H ALA A 89 5.633 -11.181 -22.566 1.00 0.00 H new ATOM 0 HA ALA A 89 3.216 -10.957 -23.877 1.00 0.00 H new ATOM 0 HB1 ALA A 89 3.842 -8.581 -24.152 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.250 -9.188 -22.529 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.528 -8.987 -23.751 1.00 0.00 H new ATOM 1386 N ASP A 90 5.617 -10.226 -26.019 1.00 0.00 N ATOM 1387 CA ASP A 90 5.971 -10.257 -27.434 1.00 0.00 C ATOM 1388 C ASP A 90 4.804 -9.789 -28.297 1.00 0.00 C ATOM 1389 O ASP A 90 4.540 -10.350 -29.360 1.00 0.00 O ATOM 1390 CB ASP A 90 6.392 -11.668 -27.845 1.00 0.00 C ATOM 1391 CG ASP A 90 7.849 -11.952 -27.534 1.00 0.00 C ATOM 1392 OD1 ASP A 90 8.439 -11.206 -26.726 1.00 0.00 O ATOM 1393 OD2 ASP A 90 8.397 -12.921 -28.099 1.00 0.00 O ATOM 0 H ASP A 90 6.290 -9.740 -25.426 1.00 0.00 H new ATOM 0 HA ASP A 90 6.809 -9.577 -27.589 1.00 0.00 H new ATOM 0 HB2 ASP A 90 5.765 -12.396 -27.330 1.00 0.00 H new ATOM 0 HB3 ASP A 90 6.219 -11.799 -28.913 1.00 0.00 H new ATOM 1453 N LYS A 96 9.188 -5.847 -25.647 1.00 0.00 N ATOM 1454 CA LYS A 96 9.202 -4.678 -24.774 1.00 0.00 C ATOM 1455 C LYS A 96 7.803 -4.378 -24.246 1.00 0.00 C ATOM 1456 O LYS A 96 6.823 -4.434 -24.989 1.00 0.00 O ATOM 1457 CB LYS A 96 9.746 -3.462 -25.526 1.00 0.00 C ATOM 1458 CG LYS A 96 8.760 -2.866 -26.516 1.00 0.00 C ATOM 1459 CD LYS A 96 9.460 -2.362 -27.766 1.00 0.00 C ATOM 1460 CE LYS A 96 8.539 -2.404 -28.976 1.00 0.00 C ATOM 1461 NZ LYS A 96 9.111 -1.661 -30.134 1.00 0.00 N ATOM 0 HA LYS A 96 9.853 -4.895 -23.927 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.030 -2.696 -24.804 1.00 0.00 H new ATOM 0 HB3 LYS A 96 10.652 -3.750 -26.058 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.020 -3.617 -26.791 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.221 -2.045 -26.044 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.804 -1.340 -27.605 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.344 -2.969 -27.959 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.361 -3.441 -29.262 1.00 0.00 H new ATOM 0 HE3 LYS A 96 7.572 -1.976 -28.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 8.454 -1.713 -30.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 9.257 -0.666 -29.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 10.022 -2.085 -30.403 1.00 0.00 H new ATOM 1475 N ILE A 97 7.718 -4.059 -22.959 1.00 0.00 N ATOM 1476 CA ILE A 97 6.439 -3.748 -22.332 1.00 0.00 C ATOM 1477 C ILE A 97 6.098 -2.269 -22.484 1.00 0.00 C ATOM 1478 O ILE A 97 6.974 -1.441 -22.731 1.00 0.00 O ATOM 1479 CB ILE A 97 6.442 -4.111 -20.836 1.00 0.00 C ATOM 1480 CG1 ILE A 97 7.194 -5.424 -20.609 1.00 0.00 C ATOM 1481 CG2 ILE A 97 5.017 -4.214 -20.313 1.00 0.00 C ATOM 1482 CD1 ILE A 97 6.625 -6.589 -21.387 1.00 0.00 C ATOM 0 H ILE A 97 8.519 -4.009 -22.330 1.00 0.00 H new ATOM 0 HA ILE A 97 5.684 -4.347 -22.841 1.00 0.00 H new ATOM 0 HB ILE A 97 6.954 -3.321 -20.287 1.00 0.00 H new ATOM 0 HG12 ILE A 97 8.239 -5.287 -20.887 1.00 0.00 H new ATOM 0 HG13 ILE A 97 7.176 -5.664 -19.546 1.00 0.00 H new ATOM 0 HG21 ILE A 97 5.036 -4.471 -19.254 1.00 0.00 H new ATOM 0 HG22 ILE A 97 4.511 -3.258 -20.445 1.00 0.00 H new ATOM 0 HG23 ILE A 97 4.482 -4.987 -20.865 1.00 0.00 H new ATOM 0 HD11 ILE A 97 7.208 -7.486 -21.177 1.00 0.00 H new ATOM 0 HD12 ILE A 97 5.589 -6.752 -21.092 1.00 0.00 H new ATOM 0 HD13 ILE A 97 6.668 -6.370 -22.454 1.00 0.00 H new ATOM 1494 N GLY A 98 4.818 -1.944 -22.333 1.00 0.00 N ATOM 1495 CA GLY A 98 4.383 -0.564 -22.455 1.00 0.00 C ATOM 1496 C GLY A 98 2.996 -0.341 -21.887 1.00 0.00 C ATOM 1497 O GLY A 98 2.129 0.225 -22.552 1.00 0.00 O ATOM 0 H GLY A 98 4.074 -2.611 -22.128 1.00 0.00 H new ATOM 0 HA2 GLY A 98 5.092 0.084 -21.940 1.00 0.00 H new ATOM 0 HA3 GLY A 98 4.393 -0.275 -23.506 1.00 0.00 H new ATOM 1501 N ALA A 99 2.784 -0.788 -20.653 1.00 0.00 N ATOM 1502 CA ALA A 99 1.493 -0.634 -19.996 1.00 0.00 C ATOM 1503 C ALA A 99 0.358 -1.115 -20.894 1.00 0.00 C ATOM 1504 O ALA A 99 -0.711 -0.508 -20.938 1.00 0.00 O ATOM 1505 CB ALA A 99 1.273 0.818 -19.598 1.00 0.00 C ATOM 0 H ALA A 99 3.491 -1.260 -20.089 1.00 0.00 H new ATOM 0 HA ALA A 99 1.496 -1.250 -19.097 1.00 0.00 H new ATOM 0 HB1 ALA A 99 0.304 0.918 -19.108 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.061 1.131 -18.912 1.00 0.00 H new ATOM 0 HB3 ALA A 99 1.296 1.447 -20.488 1.00 0.00 H new ATOM 1511 N GLU A 100 0.600 -2.209 -21.610 1.00 0.00 N ATOM 1512 CA GLU A 100 -0.402 -2.770 -22.508 1.00 0.00 C ATOM 1513 C GLU A 100 -0.228 -4.280 -22.642 1.00 0.00 C ATOM 1514 O GLU A 100 -1.197 -5.036 -22.562 1.00 0.00 O ATOM 1515 CB GLU A 100 -0.310 -2.111 -23.886 1.00 0.00 C ATOM 1516 CG GLU A 100 -0.801 -0.674 -23.907 1.00 0.00 C ATOM 1517 CD GLU A 100 -2.287 -0.561 -23.623 1.00 0.00 C ATOM 1518 OE1 GLU A 100 -3.005 -1.565 -23.809 1.00 0.00 O ATOM 1519 OE2 GLU A 100 -2.730 0.533 -23.214 1.00 0.00 O ATOM 0 H GLU A 100 1.480 -2.724 -21.585 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.386 -2.571 -22.083 1.00 0.00 H new ATOM 0 HB2 GLU A 100 0.726 -2.137 -24.223 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -0.892 -2.695 -24.599 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -0.248 -0.094 -23.168 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -0.587 -0.235 -24.881 1.00 0.00 H new ATOM 1526 N GLU A 101 1.012 -4.712 -22.847 1.00 0.00 N ATOM 1527 CA GLU A 101 1.312 -6.131 -22.994 1.00 0.00 C ATOM 1528 C GLU A 101 1.183 -6.855 -21.657 1.00 0.00 C ATOM 1529 O GLU A 101 0.512 -7.883 -21.557 1.00 0.00 O ATOM 1530 CB GLU A 101 2.723 -6.322 -23.555 1.00 0.00 C ATOM 1531 CG GLU A 101 3.066 -5.357 -24.678 1.00 0.00 C ATOM 1532 CD GLU A 101 1.916 -5.156 -25.646 1.00 0.00 C ATOM 1533 OE1 GLU A 101 1.170 -6.127 -25.890 1.00 0.00 O ATOM 1534 OE2 GLU A 101 1.763 -4.027 -26.159 1.00 0.00 O ATOM 0 H GLU A 101 1.825 -4.100 -22.915 1.00 0.00 H new ATOM 0 HA GLU A 101 0.591 -6.558 -23.691 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.446 -6.199 -22.748 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.824 -7.344 -23.921 1.00 0.00 H new ATOM 0 HG2 GLU A 101 3.349 -4.395 -24.251 1.00 0.00 H new ATOM 0 HG3 GLU A 101 3.933 -5.732 -25.222 1.00 0.00 H new ATOM 1541 N PHE A 102 1.831 -6.313 -20.631 1.00 0.00 N ATOM 1542 CA PHE A 102 1.791 -6.907 -19.300 1.00 0.00 C ATOM 1543 C PHE A 102 0.351 -7.132 -18.849 1.00 0.00 C ATOM 1544 O PHE A 102 0.052 -8.105 -18.158 1.00 0.00 O ATOM 1545 CB PHE A 102 2.519 -6.010 -18.296 1.00 0.00 C ATOM 1546 CG PHE A 102 3.376 -6.770 -17.325 1.00 0.00 C ATOM 1547 CD1 PHE A 102 2.834 -7.780 -16.546 1.00 0.00 C ATOM 1548 CD2 PHE A 102 4.723 -6.475 -17.191 1.00 0.00 C ATOM 1549 CE1 PHE A 102 3.621 -8.482 -15.651 1.00 0.00 C ATOM 1550 CE2 PHE A 102 5.514 -7.174 -16.299 1.00 0.00 C ATOM 1551 CZ PHE A 102 4.962 -8.177 -15.527 1.00 0.00 C ATOM 0 H PHE A 102 2.391 -5.463 -20.696 1.00 0.00 H new ATOM 0 HA PHE A 102 2.294 -7.873 -19.344 1.00 0.00 H new ATOM 0 HB2 PHE A 102 3.142 -5.300 -18.840 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.783 -5.428 -17.741 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.785 -8.022 -16.639 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.160 -5.690 -17.790 1.00 0.00 H new ATOM 0 HE1 PHE A 102 3.187 -9.268 -15.050 1.00 0.00 H new ATOM 0 HE2 PHE A 102 6.563 -6.936 -16.206 1.00 0.00 H new ATOM 0 HZ PHE A 102 5.578 -8.722 -14.827 1.00 0.00 H new ATOM 1561 N GLN A 103 -0.535 -6.224 -19.244 1.00 0.00 N ATOM 1562 CA GLN A 103 -1.944 -6.322 -18.879 1.00 0.00 C ATOM 1563 C GLN A 103 -2.590 -7.541 -19.528 1.00 0.00 C ATOM 1564 O GLN A 103 -3.039 -8.457 -18.840 1.00 0.00 O ATOM 1565 CB GLN A 103 -2.690 -5.053 -19.293 1.00 0.00 C ATOM 1566 CG GLN A 103 -2.518 -3.900 -18.317 1.00 0.00 C ATOM 1567 CD GLN A 103 -1.062 -3.581 -18.041 1.00 0.00 C ATOM 1568 OE1 GLN A 103 -0.629 -3.547 -16.889 1.00 0.00 O ATOM 1569 NE2 GLN A 103 -0.297 -3.344 -19.100 1.00 0.00 N ATOM 0 H GLN A 103 -0.303 -5.412 -19.816 1.00 0.00 H new ATOM 0 HA GLN A 103 -2.006 -6.434 -17.796 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -2.340 -4.740 -20.277 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -3.752 -5.281 -19.390 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -3.011 -3.014 -18.717 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -3.016 -4.146 -17.379 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -0.697 -3.383 -20.037 1.00 0.00 H new ATOM 0 HE22 GLN A 103 0.691 -3.123 -18.976 1.00 0.00 H new ATOM 1578 N GLU A 104 -2.634 -7.545 -20.857 1.00 0.00 N ATOM 1579 CA GLU A 104 -3.228 -8.651 -21.598 1.00 0.00 C ATOM 1580 C GLU A 104 -2.581 -9.977 -21.207 1.00 0.00 C ATOM 1581 O GLU A 104 -3.192 -11.038 -21.330 1.00 0.00 O ATOM 1582 CB GLU A 104 -3.080 -8.423 -23.104 1.00 0.00 C ATOM 1583 CG GLU A 104 -1.772 -8.947 -23.673 1.00 0.00 C ATOM 1584 CD GLU A 104 -1.329 -8.190 -24.909 1.00 0.00 C ATOM 1585 OE1 GLU A 104 -1.324 -6.942 -24.870 1.00 0.00 O ATOM 1586 OE2 GLU A 104 -0.987 -8.845 -25.916 1.00 0.00 O ATOM 0 H GLU A 104 -2.265 -6.795 -21.442 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.288 -8.695 -21.347 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.910 -8.906 -23.619 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -3.155 -7.355 -23.310 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -0.995 -8.878 -22.911 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.884 -10.003 -23.919 1.00 0.00 H new ATOM 1593 N MET A 105 -1.340 -9.907 -20.736 1.00 0.00 N ATOM 1594 CA MET A 105 -0.610 -11.101 -20.326 1.00 0.00 C ATOM 1595 C MET A 105 -1.280 -11.762 -19.125 1.00 0.00 C ATOM 1596 O MET A 105 -1.213 -12.980 -18.957 1.00 0.00 O ATOM 1597 CB MET A 105 0.839 -10.748 -19.987 1.00 0.00 C ATOM 1598 CG MET A 105 1.615 -11.897 -19.365 1.00 0.00 C ATOM 1599 SD MET A 105 2.993 -11.335 -18.347 1.00 0.00 S ATOM 1600 CE MET A 105 3.893 -10.327 -19.522 1.00 0.00 C ATOM 0 H MET A 105 -0.819 -9.037 -20.629 1.00 0.00 H new ATOM 0 HA MET A 105 -0.619 -11.806 -21.158 1.00 0.00 H new ATOM 0 HB2 MET A 105 1.348 -10.426 -20.896 1.00 0.00 H new ATOM 0 HB3 MET A 105 0.847 -9.901 -19.301 1.00 0.00 H new ATOM 0 HG2 MET A 105 0.940 -12.498 -18.756 1.00 0.00 H new ATOM 0 HG3 MET A 105 1.993 -12.545 -20.156 1.00 0.00 H new ATOM 0 HE1 MET A 105 4.887 -10.747 -19.675 1.00 0.00 H new ATOM 0 HE2 MET A 105 3.357 -10.308 -20.471 1.00 0.00 H new ATOM 0 HE3 MET A 105 3.984 -9.312 -19.136 1.00 0.00 H new ATOM 1610 N VAL A 106 -1.924 -10.951 -18.292 1.00 0.00 N ATOM 1611 CA VAL A 106 -2.606 -11.458 -17.107 1.00 0.00 C ATOM 1612 C VAL A 106 -4.084 -11.707 -17.388 1.00 0.00 C ATOM 1613 O VAL A 106 -4.614 -12.771 -17.071 1.00 0.00 O ATOM 1614 CB VAL A 106 -2.478 -10.480 -15.924 1.00 0.00 C ATOM 1615 CG1 VAL A 106 -3.110 -11.069 -14.673 1.00 0.00 C ATOM 1616 CG2 VAL A 106 -1.018 -10.130 -15.679 1.00 0.00 C ATOM 0 H VAL A 106 -1.988 -9.941 -18.416 1.00 0.00 H new ATOM 0 HA VAL A 106 -2.125 -12.400 -16.844 1.00 0.00 H new ATOM 0 HB VAL A 106 -3.012 -9.563 -16.174 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -3.010 -10.364 -13.848 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -4.166 -11.265 -14.857 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -2.608 -12.002 -14.416 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -0.946 -9.438 -14.840 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -0.460 -11.038 -15.450 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.601 -9.663 -16.571 1.00 0.00 H new ATOM 1626 N GLN A 107 -4.742 -10.719 -17.985 1.00 0.00 N ATOM 1627 CA GLN A 107 -6.159 -10.831 -18.308 1.00 0.00 C ATOM 1628 C GLN A 107 -6.402 -11.959 -19.306 1.00 0.00 C ATOM 1629 O GLN A 107 -7.496 -12.521 -19.369 1.00 0.00 O ATOM 1630 CB GLN A 107 -6.681 -9.511 -18.877 1.00 0.00 C ATOM 1631 CG GLN A 107 -6.424 -8.316 -17.973 1.00 0.00 C ATOM 1632 CD GLN A 107 -6.594 -8.648 -16.503 1.00 0.00 C ATOM 1633 OE1 GLN A 107 -7.535 -9.342 -16.117 1.00 0.00 O ATOM 1634 NE2 GLN A 107 -5.682 -8.153 -15.675 1.00 0.00 N ATOM 0 H GLN A 107 -4.317 -9.832 -18.255 1.00 0.00 H new ATOM 0 HA GLN A 107 -6.698 -11.060 -17.389 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -6.213 -9.331 -19.845 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -7.753 -9.599 -19.053 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -5.413 -7.947 -18.144 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -7.107 -7.509 -18.241 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -4.919 -7.583 -16.039 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -5.745 -8.343 -14.675 1.00 0.00 H new ATOM 1643 N SER A 108 -5.375 -12.285 -20.084 1.00 0.00 N ATOM 1644 CA SER A 108 -5.478 -13.343 -21.082 1.00 0.00 C ATOM 1645 C SER A 108 -4.268 -14.271 -21.018 1.00 0.00 C ATOM 1646 O SER A 108 -4.348 -15.375 -20.483 1.00 0.00 O ATOM 1647 CB SER A 108 -5.600 -12.742 -22.484 1.00 0.00 C ATOM 1648 OG SER A 108 -6.908 -12.248 -22.715 1.00 0.00 O ATOM 0 H SER A 108 -4.462 -11.832 -20.042 1.00 0.00 H new ATOM 0 HA SER A 108 -6.373 -13.926 -20.865 1.00 0.00 H new ATOM 0 HB2 SER A 108 -4.877 -11.935 -22.601 1.00 0.00 H new ATOM 0 HB3 SER A 108 -5.357 -13.499 -23.230 1.00 0.00 H new ATOM 0 HG SER A 108 -6.960 -11.868 -23.617 1.00 0.00 H new