USER MOD reduce.3.24.130724 H: found=0, std=0, add=989, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 988 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 122 ASN : amide:sc= -0.367 K(o=-0.36,f=-11!) USER MOD Set 1.2: A 127 TYR OH : rot 24:sc= 0.0113 USER MOD Single : A 1 VAL N :NH3+ -164:sc= -0.0784 (180deg=-0.513) USER MOD Single : A 2 LYS NZ :NH3+ 160:sc= -0.0721 (180deg=-0.381) USER MOD Single : A 5 CYS SG : rot -170:sc= -0.842 USER MOD Single : A 9 THR OG1 : rot 179:sc= -2.42! USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -161:sc= 0.0569 (180deg=-0.294) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot -54:sc= 0.841 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 67:sc= 0.601 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot -140:sc= -1.51 USER MOD Single : A 44 LYS NZ :NH3+ -134:sc= 1.24 (180deg=0.958) USER MOD Single : A 47 SER OG : rot 180:sc= 0.0108 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= 0.352 X(o=0.35,f=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc=-0.000775 K(o=-0.00078,f=-1.8!) USER MOD Single : A 79 LYS NZ :NH3+ -136:sc= 0.373 (180deg=0) USER MOD Single : A 83 ASN :FLIP amide:sc= -2.83! C(o=-3.3!,f=-2.8!) USER MOD Single : A 84 LYS NZ :NH3+ 144:sc= 0.757 (180deg=0.119) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 120:sc= -0.0053 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 MET CE :methyl -170:sc= -1.11 (180deg=-1.25) USER MOD Single : A 108 LYS NZ :NH3+ 147:sc= 1.14 (180deg=0.261) USER MOD Single : A 114 LYS NZ :NH3+ -125:sc= 0.0157 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 173:sc= -0.109 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 5.489 15.641 -10.844 1.00 0.00 N ATOM 2 CA VAL A 1 5.662 16.077 -9.466 1.00 0.00 C ATOM 3 C VAL A 1 6.205 14.935 -8.614 1.00 0.00 C ATOM 4 O VAL A 1 5.746 13.795 -8.723 1.00 0.00 O ATOM 5 CB VAL A 1 4.332 16.574 -8.852 1.00 0.00 C ATOM 6 CG1 VAL A 1 4.560 17.143 -7.459 1.00 0.00 C ATOM 7 CG2 VAL A 1 3.664 17.609 -9.747 1.00 0.00 C ATOM 0 H1 VAL A 1 5.384 16.472 -11.460 1.00 0.00 H new ATOM 0 H2 VAL A 1 6.321 15.092 -11.141 1.00 0.00 H new ATOM 0 H3 VAL A 1 4.638 15.047 -10.916 1.00 0.00 H new ATOM 0 HA VAL A 1 6.371 16.905 -9.476 1.00 0.00 H new ATOM 0 HB VAL A 1 3.664 15.717 -8.771 1.00 0.00 H new ATOM 0 HG11 VAL A 1 3.611 17.486 -7.046 1.00 0.00 H new ATOM 0 HG12 VAL A 1 4.978 16.370 -6.814 1.00 0.00 H new ATOM 0 HG13 VAL A 1 5.255 17.981 -7.517 1.00 0.00 H new ATOM 0 HG21 VAL A 1 2.732 17.939 -9.289 1.00 0.00 H new ATOM 0 HG22 VAL A 1 4.329 18.464 -9.874 1.00 0.00 H new ATOM 0 HG23 VAL A 1 3.453 17.166 -10.720 1.00 0.00 H new ATOM 17 N LYS A 2 7.186 15.246 -7.783 1.00 0.00 N ATOM 18 CA LYS A 2 7.759 14.263 -6.877 1.00 0.00 C ATOM 19 C LYS A 2 7.199 14.476 -5.478 1.00 0.00 C ATOM 20 O LYS A 2 7.543 15.451 -4.804 1.00 0.00 O ATOM 21 CB LYS A 2 9.284 14.375 -6.853 1.00 0.00 C ATOM 22 CG LYS A 2 9.913 14.389 -8.233 1.00 0.00 C ATOM 23 CD LYS A 2 11.429 14.445 -8.152 1.00 0.00 C ATOM 24 CE LYS A 2 12.051 14.708 -9.515 1.00 0.00 C ATOM 25 NZ LYS A 2 11.669 16.046 -10.046 1.00 0.00 N ATOM 0 H LYS A 2 7.604 16.174 -7.717 1.00 0.00 H new ATOM 0 HA LYS A 2 7.495 13.265 -7.227 1.00 0.00 H new ATOM 0 HB2 LYS A 2 9.565 15.287 -6.325 1.00 0.00 H new ATOM 0 HB3 LYS A 2 9.693 13.539 -6.285 1.00 0.00 H new ATOM 0 HG2 LYS A 2 9.609 13.497 -8.782 1.00 0.00 H new ATOM 0 HG3 LYS A 2 9.545 15.249 -8.793 1.00 0.00 H new ATOM 0 HD2 LYS A 2 11.728 15.229 -7.457 1.00 0.00 H new ATOM 0 HD3 LYS A 2 11.808 13.504 -7.753 1.00 0.00 H new ATOM 0 HE2 LYS A 2 13.136 14.643 -9.438 1.00 0.00 H new ATOM 0 HE3 LYS A 2 11.734 13.935 -10.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 12.348 16.335 -10.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 10.715 15.997 -10.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 11.677 16.742 -9.273 1.00 0.00 H new ATOM 39 N PHE A 3 6.328 13.577 -5.049 1.00 0.00 N ATOM 40 CA PHE A 3 5.677 13.714 -3.754 1.00 0.00 C ATOM 41 C PHE A 3 6.537 13.100 -2.666 1.00 0.00 C ATOM 42 O PHE A 3 7.156 12.055 -2.874 1.00 0.00 O ATOM 43 CB PHE A 3 4.305 13.041 -3.758 1.00 0.00 C ATOM 44 CG PHE A 3 3.398 13.511 -4.860 1.00 0.00 C ATOM 45 CD1 PHE A 3 2.577 14.612 -4.678 1.00 0.00 C ATOM 46 CD2 PHE A 3 3.363 12.845 -6.075 1.00 0.00 C ATOM 47 CE1 PHE A 3 1.736 15.041 -5.687 1.00 0.00 C ATOM 48 CE2 PHE A 3 2.526 13.270 -7.089 1.00 0.00 C ATOM 49 CZ PHE A 3 1.711 14.369 -6.894 1.00 0.00 C ATOM 0 H PHE A 3 6.055 12.747 -5.576 1.00 0.00 H new ATOM 0 HA PHE A 3 5.545 14.778 -3.556 1.00 0.00 H new ATOM 0 HB2 PHE A 3 4.440 11.963 -3.847 1.00 0.00 H new ATOM 0 HB3 PHE A 3 3.820 13.223 -2.799 1.00 0.00 H new ATOM 0 HD1 PHE A 3 2.595 15.141 -3.737 1.00 0.00 H new ATOM 0 HD2 PHE A 3 3.997 11.985 -6.231 1.00 0.00 H new ATOM 0 HE1 PHE A 3 1.100 15.900 -5.532 1.00 0.00 H new ATOM 0 HE2 PHE A 3 2.509 12.744 -8.032 1.00 0.00 H new ATOM 0 HZ PHE A 3 1.055 14.702 -7.685 1.00 0.00 H new ATOM 59 N ALA A 4 6.569 13.746 -1.513 1.00 0.00 N ATOM 60 CA ALA A 4 7.370 13.272 -0.396 1.00 0.00 C ATOM 61 C ALA A 4 6.558 12.332 0.481 1.00 0.00 C ATOM 62 O ALA A 4 5.446 12.659 0.897 1.00 0.00 O ATOM 63 CB ALA A 4 7.887 14.444 0.424 1.00 0.00 C ATOM 0 H ALA A 4 6.048 14.603 -1.325 1.00 0.00 H new ATOM 0 HA ALA A 4 8.224 12.724 -0.794 1.00 0.00 H new ATOM 0 HB1 ALA A 4 8.484 14.071 1.256 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.503 15.085 -0.206 1.00 0.00 H new ATOM 0 HB3 ALA A 4 7.044 15.017 0.811 1.00 0.00 H new ATOM 69 N CYS A 5 7.107 11.162 0.744 1.00 0.00 N ATOM 70 CA CYS A 5 6.443 10.183 1.579 1.00 0.00 C ATOM 71 C CYS A 5 7.312 9.850 2.784 1.00 0.00 C ATOM 72 O CYS A 5 8.524 10.068 2.762 1.00 0.00 O ATOM 73 CB CYS A 5 6.173 8.915 0.777 1.00 0.00 C ATOM 74 SG CYS A 5 5.579 9.218 -0.904 1.00 0.00 S ATOM 0 H CYS A 5 8.016 10.866 0.389 1.00 0.00 H new ATOM 0 HA CYS A 5 5.497 10.599 1.925 1.00 0.00 H new ATOM 0 HB2 CYS A 5 7.090 8.328 0.727 1.00 0.00 H new ATOM 0 HB3 CYS A 5 5.437 8.312 1.308 1.00 0.00 H new ATOM 0 HG CYS A 5 5.181 8.099 -1.432 1.00 0.00 H new ATOM 80 N ARG A 6 6.699 9.327 3.829 1.00 0.00 N ATOM 81 CA ARG A 6 7.446 8.899 4.999 1.00 0.00 C ATOM 82 C ARG A 6 7.579 7.385 4.995 1.00 0.00 C ATOM 83 O ARG A 6 6.584 6.660 5.066 1.00 0.00 O ATOM 84 CB ARG A 6 6.780 9.398 6.284 1.00 0.00 C ATOM 85 CG ARG A 6 7.464 8.919 7.553 1.00 0.00 C ATOM 86 CD ARG A 6 7.185 9.853 8.716 1.00 0.00 C ATOM 87 NE ARG A 6 7.844 11.148 8.538 1.00 0.00 N ATOM 88 CZ ARG A 6 7.909 12.091 9.476 1.00 0.00 C ATOM 89 NH1 ARG A 6 7.279 11.931 10.635 1.00 0.00 N ATOM 90 NH2 ARG A 6 8.595 13.202 9.241 1.00 0.00 N ATOM 0 H ARG A 6 5.691 9.188 3.893 1.00 0.00 H new ATOM 0 HA ARG A 6 8.445 9.334 4.963 1.00 0.00 H new ATOM 0 HB2 ARG A 6 6.769 10.488 6.277 1.00 0.00 H new ATOM 0 HB3 ARG A 6 5.741 9.069 6.296 1.00 0.00 H new ATOM 0 HG2 ARG A 6 7.117 7.915 7.799 1.00 0.00 H new ATOM 0 HG3 ARG A 6 8.539 8.853 7.387 1.00 0.00 H new ATOM 0 HD2 ARG A 6 6.110 10.002 8.814 1.00 0.00 H new ATOM 0 HD3 ARG A 6 7.529 9.394 9.643 1.00 0.00 H new ATOM 0 HE ARG A 6 8.282 11.341 7.637 1.00 0.00 H new ATOM 0 HH11 ARG A 6 6.742 11.082 10.810 1.00 0.00 H new ATOM 0 HH12 ARG A 6 7.333 12.657 11.349 1.00 0.00 H new ATOM 0 HH21 ARG A 6 9.068 13.330 8.346 1.00 0.00 H new ATOM 0 HH22 ARG A 6 8.649 13.929 9.955 1.00 0.00 H new ATOM 104 N ALA A 7 8.813 6.919 4.886 1.00 0.00 N ATOM 105 CA ALA A 7 9.090 5.500 4.732 1.00 0.00 C ATOM 106 C ALA A 7 8.863 4.732 6.024 1.00 0.00 C ATOM 107 O ALA A 7 9.286 5.157 7.098 1.00 0.00 O ATOM 108 CB ALA A 7 10.512 5.295 4.239 1.00 0.00 C ATOM 0 H ALA A 7 9.645 7.509 4.902 1.00 0.00 H new ATOM 0 HA ALA A 7 8.392 5.107 3.993 1.00 0.00 H new ATOM 0 HB1 ALA A 7 10.708 4.229 4.127 1.00 0.00 H new ATOM 0 HB2 ALA A 7 10.638 5.790 3.276 1.00 0.00 H new ATOM 0 HB3 ALA A 7 11.212 5.719 4.959 1.00 0.00 H new ATOM 114 N ILE A 8 8.177 3.605 5.908 1.00 0.00 N ATOM 115 CA ILE A 8 7.981 2.716 7.037 1.00 0.00 C ATOM 116 C ILE A 8 8.850 1.480 6.854 1.00 0.00 C ATOM 117 O ILE A 8 9.583 1.077 7.759 1.00 0.00 O ATOM 118 CB ILE A 8 6.500 2.297 7.183 1.00 0.00 C ATOM 119 CG1 ILE A 8 5.597 3.536 7.266 1.00 0.00 C ATOM 120 CG2 ILE A 8 6.310 1.415 8.412 1.00 0.00 C ATOM 121 CD1 ILE A 8 5.896 4.430 8.452 1.00 0.00 C ATOM 0 H ILE A 8 7.747 3.286 5.040 1.00 0.00 H new ATOM 0 HA ILE A 8 8.265 3.247 7.945 1.00 0.00 H new ATOM 0 HB ILE A 8 6.218 1.722 6.301 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.705 4.116 6.349 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.557 3.214 7.318 1.00 0.00 H new ATOM 0 HG21 ILE A 8 5.261 1.131 8.497 1.00 0.00 H new ATOM 0 HG22 ILE A 8 6.922 0.518 8.315 1.00 0.00 H new ATOM 0 HG23 ILE A 8 6.611 1.964 9.304 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.219 5.284 8.444 1.00 0.00 H new ATOM 0 HD12 ILE A 8 5.759 3.867 9.375 1.00 0.00 H new ATOM 0 HD13 ILE A 8 6.925 4.783 8.391 1.00 0.00 H new ATOM 133 N THR A 9 8.767 0.887 5.670 1.00 0.00 N ATOM 134 CA THR A 9 9.635 -0.219 5.310 1.00 0.00 C ATOM 135 C THR A 9 10.504 0.173 4.118 1.00 0.00 C ATOM 136 O THR A 9 10.368 1.274 3.580 1.00 0.00 O ATOM 137 CB THR A 9 8.829 -1.488 4.976 1.00 0.00 C ATOM 138 OG1 THR A 9 7.892 -1.225 3.924 1.00 0.00 O ATOM 139 CG2 THR A 9 8.088 -2.001 6.203 1.00 0.00 C ATOM 0 H THR A 9 8.104 1.157 4.943 1.00 0.00 H new ATOM 0 HA THR A 9 10.268 -0.442 6.169 1.00 0.00 H new ATOM 0 HB THR A 9 9.533 -2.253 4.647 1.00 0.00 H new ATOM 0 HG1 THR A 9 7.400 -2.046 3.711 1.00 0.00 H new ATOM 0 HG21 THR A 9 7.527 -2.898 5.940 1.00 0.00 H new ATOM 0 HG22 THR A 9 8.806 -2.239 6.988 1.00 0.00 H new ATOM 0 HG23 THR A 9 7.401 -1.234 6.560 1.00 0.00 H new ATOM 147 N ARG A 10 11.393 -0.719 3.707 1.00 0.00 N ATOM 148 CA ARG A 10 12.303 -0.428 2.609 1.00 0.00 C ATOM 149 C ARG A 10 11.826 -1.076 1.320 1.00 0.00 C ATOM 150 O ARG A 10 10.912 -1.904 1.330 1.00 0.00 O ATOM 151 CB ARG A 10 13.710 -0.920 2.931 1.00 0.00 C ATOM 152 CG ARG A 10 14.318 -0.278 4.160 1.00 0.00 C ATOM 153 CD ARG A 10 15.686 -0.860 4.445 1.00 0.00 C ATOM 154 NE ARG A 10 16.256 -0.355 5.689 1.00 0.00 N ATOM 155 CZ ARG A 10 16.694 -1.141 6.670 1.00 0.00 C ATOM 156 NH1 ARG A 10 16.563 -2.462 6.572 1.00 0.00 N ATOM 157 NH2 ARG A 10 17.239 -0.611 7.760 1.00 0.00 N ATOM 0 H ARG A 10 11.504 -1.647 4.115 1.00 0.00 H new ATOM 0 HA ARG A 10 12.322 0.654 2.475 1.00 0.00 H new ATOM 0 HB2 ARG A 10 13.683 -2.000 3.073 1.00 0.00 H new ATOM 0 HB3 ARG A 10 14.357 -0.727 2.075 1.00 0.00 H new ATOM 0 HG2 ARG A 10 14.399 0.799 4.012 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.665 -0.433 5.019 1.00 0.00 H new ATOM 0 HD2 ARG A 10 15.612 -1.946 4.497 1.00 0.00 H new ATOM 0 HD3 ARG A 10 16.357 -0.625 3.619 1.00 0.00 H new ATOM 0 HE ARG A 10 16.323 0.655 5.814 1.00 0.00 H new ATOM 0 HH11 ARG A 10 16.127 -2.871 5.746 1.00 0.00 H new ATOM 0 HH12 ARG A 10 16.898 -3.065 7.323 1.00 0.00 H new ATOM 0 HH21 ARG A 10 17.323 0.402 7.847 1.00 0.00 H new ATOM 0 HH22 ARG A 10 17.573 -1.217 8.509 1.00 0.00 H new ATOM 171 N GLY A 11 12.457 -0.700 0.219 1.00 0.00 N ATOM 172 CA GLY A 11 12.119 -1.272 -1.063 1.00 0.00 C ATOM 173 C GLY A 11 11.996 -0.220 -2.141 1.00 0.00 C ATOM 174 O GLY A 11 11.707 0.943 -1.855 1.00 0.00 O ATOM 0 H GLY A 11 13.202 -0.004 0.193 1.00 0.00 H new ATOM 0 HA2 GLY A 11 12.882 -1.996 -1.349 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.178 -1.817 -0.980 1.00 0.00 H new ATOM 178 N ARG A 12 12.229 -0.622 -3.378 1.00 0.00 N ATOM 179 CA ARG A 12 12.095 0.273 -4.514 1.00 0.00 C ATOM 180 C ARG A 12 11.406 -0.468 -5.648 1.00 0.00 C ATOM 181 O ARG A 12 11.801 -1.583 -5.993 1.00 0.00 O ATOM 182 CB ARG A 12 13.466 0.780 -4.963 1.00 0.00 C ATOM 183 CG ARG A 12 13.402 1.834 -6.058 1.00 0.00 C ATOM 184 CD ARG A 12 14.789 2.189 -6.556 1.00 0.00 C ATOM 185 NE ARG A 12 15.448 1.043 -7.184 1.00 0.00 N ATOM 186 CZ ARG A 12 16.695 0.659 -6.920 1.00 0.00 C ATOM 187 NH1 ARG A 12 17.422 1.310 -6.017 1.00 0.00 N ATOM 188 NH2 ARG A 12 17.207 -0.391 -7.548 1.00 0.00 N ATOM 0 H ARG A 12 12.514 -1.570 -3.622 1.00 0.00 H new ATOM 0 HA ARG A 12 11.496 1.137 -4.226 1.00 0.00 H new ATOM 0 HB2 ARG A 12 13.989 1.195 -4.102 1.00 0.00 H new ATOM 0 HB3 ARG A 12 14.057 -0.064 -5.318 1.00 0.00 H new ATOM 0 HG2 ARG A 12 12.798 1.465 -6.887 1.00 0.00 H new ATOM 0 HG3 ARG A 12 12.909 2.729 -5.678 1.00 0.00 H new ATOM 0 HD2 ARG A 12 14.720 3.007 -7.273 1.00 0.00 H new ATOM 0 HD3 ARG A 12 15.395 2.546 -5.723 1.00 0.00 H new ATOM 0 HE ARG A 12 14.918 0.504 -7.868 1.00 0.00 H new ATOM 0 HH11 ARG A 12 17.025 2.109 -5.522 1.00 0.00 H new ATOM 0 HH12 ARG A 12 18.377 1.011 -5.819 1.00 0.00 H new ATOM 0 HH21 ARG A 12 16.646 -0.901 -8.230 1.00 0.00 H new ATOM 0 HH22 ARG A 12 18.162 -0.689 -7.349 1.00 0.00 H new ATOM 202 N ALA A 13 10.379 0.133 -6.220 1.00 0.00 N ATOM 203 CA ALA A 13 9.596 -0.542 -7.240 1.00 0.00 C ATOM 204 C ALA A 13 9.087 0.435 -8.284 1.00 0.00 C ATOM 205 O ALA A 13 9.097 1.647 -8.074 1.00 0.00 O ATOM 206 CB ALA A 13 8.432 -1.281 -6.605 1.00 0.00 C ATOM 0 H ALA A 13 10.069 1.079 -5.999 1.00 0.00 H new ATOM 0 HA ALA A 13 10.246 -1.260 -7.740 1.00 0.00 H new ATOM 0 HB1 ALA A 13 7.853 -1.783 -7.380 1.00 0.00 H new ATOM 0 HB2 ALA A 13 8.812 -2.020 -5.900 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.794 -0.571 -6.078 1.00 0.00 H new ATOM 212 N GLU A 14 8.650 -0.101 -9.409 1.00 0.00 N ATOM 213 CA GLU A 14 8.116 0.710 -10.488 1.00 0.00 C ATOM 214 C GLU A 14 7.128 -0.105 -11.305 1.00 0.00 C ATOM 215 O GLU A 14 7.256 -1.328 -11.409 1.00 0.00 O ATOM 216 CB GLU A 14 9.252 1.197 -11.386 1.00 0.00 C ATOM 217 CG GLU A 14 10.013 0.059 -12.044 1.00 0.00 C ATOM 218 CD GLU A 14 11.178 0.533 -12.873 1.00 0.00 C ATOM 219 OE1 GLU A 14 12.271 0.727 -12.303 1.00 0.00 O ATOM 220 OE2 GLU A 14 11.010 0.698 -14.098 1.00 0.00 O ATOM 0 H GLU A 14 8.655 -1.103 -9.600 1.00 0.00 H new ATOM 0 HA GLU A 14 7.603 1.573 -10.063 1.00 0.00 H new ATOM 0 HB2 GLU A 14 8.844 1.849 -12.158 1.00 0.00 H new ATOM 0 HB3 GLU A 14 9.944 1.797 -10.795 1.00 0.00 H new ATOM 0 HG2 GLU A 14 10.375 -0.622 -11.274 1.00 0.00 H new ATOM 0 HG3 GLU A 14 9.331 -0.509 -12.677 1.00 0.00 H new ATOM 227 N GLY A 15 6.138 0.562 -11.863 1.00 0.00 N ATOM 228 CA GLY A 15 5.213 -0.114 -12.743 1.00 0.00 C ATOM 229 C GLY A 15 3.924 0.644 -12.901 1.00 0.00 C ATOM 230 O GLY A 15 3.832 1.813 -12.513 1.00 0.00 O ATOM 0 H GLY A 15 5.956 1.556 -11.725 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.676 -0.248 -13.721 1.00 0.00 H new ATOM 0 HA3 GLY A 15 5.002 -1.109 -12.351 1.00 0.00 H new ATOM 234 N GLU A 16 2.933 -0.019 -13.476 1.00 0.00 N ATOM 235 CA GLU A 16 1.624 0.558 -13.653 1.00 0.00 C ATOM 236 C GLU A 16 0.984 0.823 -12.296 1.00 0.00 C ATOM 237 O GLU A 16 0.921 -0.066 -11.445 1.00 0.00 O ATOM 238 CB GLU A 16 0.754 -0.404 -14.458 1.00 0.00 C ATOM 239 CG GLU A 16 1.292 -0.729 -15.845 1.00 0.00 C ATOM 240 CD GLU A 16 1.190 0.434 -16.814 1.00 0.00 C ATOM 241 OE1 GLU A 16 0.061 0.892 -17.082 1.00 0.00 O ATOM 242 OE2 GLU A 16 2.239 0.883 -17.324 1.00 0.00 O ATOM 0 H GLU A 16 3.021 -0.971 -13.831 1.00 0.00 H new ATOM 0 HA GLU A 16 1.714 1.503 -14.189 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.645 -1.332 -13.897 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -0.243 0.025 -14.560 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.335 -1.033 -15.761 1.00 0.00 H new ATOM 0 HG3 GLU A 16 0.744 -1.580 -16.250 1.00 0.00 H new ATOM 249 N ALA A 17 0.521 2.043 -12.102 1.00 0.00 N ATOM 250 CA ALA A 17 -0.085 2.434 -10.847 1.00 0.00 C ATOM 251 C ALA A 17 -1.530 1.978 -10.780 1.00 0.00 C ATOM 252 O ALA A 17 -2.344 2.322 -11.640 1.00 0.00 O ATOM 253 CB ALA A 17 -0.001 3.941 -10.666 1.00 0.00 C ATOM 0 H ALA A 17 0.554 2.783 -12.803 1.00 0.00 H new ATOM 0 HA ALA A 17 0.465 1.951 -10.039 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -0.461 4.220 -9.718 1.00 0.00 H new ATOM 0 HB2 ALA A 17 1.044 4.250 -10.667 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.526 4.435 -11.483 1.00 0.00 H new ATOM 259 N LEU A 18 -1.833 1.192 -9.766 1.00 0.00 N ATOM 260 CA LEU A 18 -3.187 0.760 -9.510 1.00 0.00 C ATOM 261 C LEU A 18 -3.707 1.524 -8.302 1.00 0.00 C ATOM 262 O LEU A 18 -3.283 1.282 -7.172 1.00 0.00 O ATOM 263 CB LEU A 18 -3.223 -0.746 -9.239 1.00 0.00 C ATOM 264 CG LEU A 18 -4.590 -1.407 -9.418 1.00 0.00 C ATOM 265 CD1 LEU A 18 -4.993 -1.383 -10.882 1.00 0.00 C ATOM 266 CD2 LEU A 18 -4.575 -2.835 -8.888 1.00 0.00 C ATOM 0 H LEU A 18 -1.147 0.837 -9.099 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.813 0.960 -10.379 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.511 -1.236 -9.903 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.882 -0.924 -8.219 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.325 -0.844 -8.843 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.968 -1.856 -10.999 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.047 -0.351 -11.228 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -4.254 -1.925 -11.472 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.558 -3.285 -9.026 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.830 -3.417 -9.431 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.326 -2.827 -7.827 1.00 0.00 H new ATOM 278 N VAL A 19 -4.618 2.446 -8.539 1.00 0.00 N ATOM 279 CA VAL A 19 -5.070 3.343 -7.488 1.00 0.00 C ATOM 280 C VAL A 19 -6.504 3.039 -7.093 1.00 0.00 C ATOM 281 O VAL A 19 -7.431 3.223 -7.882 1.00 0.00 O ATOM 282 CB VAL A 19 -4.963 4.824 -7.912 1.00 0.00 C ATOM 283 CG1 VAL A 19 -5.346 5.742 -6.760 1.00 0.00 C ATOM 284 CG2 VAL A 19 -3.558 5.145 -8.404 1.00 0.00 C ATOM 0 H VAL A 19 -5.060 2.596 -9.446 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.415 3.178 -6.632 1.00 0.00 H new ATOM 0 HB VAL A 19 -5.660 4.992 -8.733 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -5.264 6.781 -7.080 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -6.372 5.536 -6.456 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -4.676 5.568 -5.918 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.506 6.193 -8.697 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -2.841 4.956 -7.605 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -3.320 4.516 -9.262 1.00 0.00 H new ATOM 294 N THR A 20 -6.674 2.572 -5.872 1.00 0.00 N ATOM 295 CA THR A 20 -7.986 2.255 -5.354 1.00 0.00 C ATOM 296 C THR A 20 -8.429 3.330 -4.369 1.00 0.00 C ATOM 297 O THR A 20 -7.876 3.452 -3.281 1.00 0.00 O ATOM 298 CB THR A 20 -7.986 0.878 -4.665 1.00 0.00 C ATOM 299 OG1 THR A 20 -7.447 -0.108 -5.561 1.00 0.00 O ATOM 300 CG2 THR A 20 -9.392 0.469 -4.249 1.00 0.00 C ATOM 0 H THR A 20 -5.911 2.403 -5.216 1.00 0.00 H new ATOM 0 HA THR A 20 -8.686 2.220 -6.189 1.00 0.00 H new ATOM 0 HB THR A 20 -7.369 0.946 -3.769 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.446 -0.984 -5.121 1.00 0.00 H new ATOM 0 HG21 THR A 20 -9.359 -0.507 -3.765 1.00 0.00 H new ATOM 0 HG22 THR A 20 -9.794 1.205 -3.553 1.00 0.00 H new ATOM 0 HG23 THR A 20 -10.031 0.416 -5.130 1.00 0.00 H new ATOM 308 N LYS A 21 -9.419 4.116 -4.763 1.00 0.00 N ATOM 309 CA LYS A 21 -9.899 5.219 -3.937 1.00 0.00 C ATOM 310 C LYS A 21 -10.955 4.735 -2.944 1.00 0.00 C ATOM 311 O LYS A 21 -11.807 5.502 -2.492 1.00 0.00 O ATOM 312 CB LYS A 21 -10.465 6.333 -4.825 1.00 0.00 C ATOM 313 CG LYS A 21 -9.420 6.988 -5.719 1.00 0.00 C ATOM 314 CD LYS A 21 -10.019 8.114 -6.545 1.00 0.00 C ATOM 315 CE LYS A 21 -8.962 8.816 -7.387 1.00 0.00 C ATOM 316 NZ LYS A 21 -7.901 9.441 -6.549 1.00 0.00 N ATOM 0 H LYS A 21 -9.909 4.012 -5.652 1.00 0.00 H new ATOM 0 HA LYS A 21 -9.059 5.616 -3.368 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.259 5.922 -5.449 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.920 7.095 -4.192 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -8.608 7.378 -5.105 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -8.987 6.239 -6.383 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.797 7.714 -7.196 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -10.497 8.837 -5.884 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -8.508 8.098 -8.070 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.437 9.582 -8.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -7.397 10.160 -7.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -8.335 9.889 -5.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -7.229 8.711 -6.238 1.00 0.00 H new ATOM 330 N GLU A 22 -10.872 3.461 -2.591 1.00 0.00 N ATOM 331 CA GLU A 22 -11.787 2.859 -1.637 1.00 0.00 C ATOM 332 C GLU A 22 -11.022 2.426 -0.392 1.00 0.00 C ATOM 333 O GLU A 22 -9.810 2.215 -0.433 1.00 0.00 O ATOM 334 CB GLU A 22 -12.492 1.655 -2.272 1.00 0.00 C ATOM 335 CG GLU A 22 -13.554 0.994 -1.397 1.00 0.00 C ATOM 336 CD GLU A 22 -14.629 1.952 -0.934 1.00 0.00 C ATOM 337 OE1 GLU A 22 -14.372 2.720 0.016 1.00 0.00 O ATOM 338 OE2 GLU A 22 -15.736 1.936 -1.507 1.00 0.00 O ATOM 0 H GLU A 22 -10.170 2.818 -2.957 1.00 0.00 H new ATOM 0 HA GLU A 22 -12.540 3.593 -1.352 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -12.958 1.976 -3.203 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -11.741 0.909 -2.532 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.018 0.180 -1.954 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.072 0.551 -0.526 1.00 0.00 H new ATOM 345 N TYR A 23 -11.739 2.300 0.704 1.00 0.00 N ATOM 346 CA TYR A 23 -11.158 1.868 1.963 1.00 0.00 C ATOM 347 C TYR A 23 -11.528 0.415 2.211 1.00 0.00 C ATOM 348 O TYR A 23 -12.615 0.115 2.716 1.00 0.00 O ATOM 349 CB TYR A 23 -11.649 2.748 3.117 1.00 0.00 C ATOM 350 CG TYR A 23 -11.284 4.211 2.974 1.00 0.00 C ATOM 351 CD1 TYR A 23 -12.059 5.071 2.204 1.00 0.00 C ATOM 352 CD2 TYR A 23 -10.170 4.734 3.616 1.00 0.00 C ATOM 353 CE1 TYR A 23 -11.734 6.407 2.079 1.00 0.00 C ATOM 354 CE2 TYR A 23 -9.838 6.071 3.495 1.00 0.00 C ATOM 355 CZ TYR A 23 -10.622 6.901 2.725 1.00 0.00 C ATOM 356 OH TYR A 23 -10.295 8.234 2.603 1.00 0.00 O ATOM 0 H TYR A 23 -12.739 2.493 0.751 1.00 0.00 H new ATOM 0 HA TYR A 23 -10.074 1.963 1.907 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -12.733 2.660 3.192 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -11.233 2.370 4.051 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -12.931 4.687 1.695 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -9.552 4.086 4.220 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -12.348 7.061 1.478 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -8.968 6.462 4.002 1.00 0.00 H new ATOM 0 HH TYR A 23 -9.484 8.421 3.121 1.00 0.00 H new ATOM 366 N ILE A 24 -10.641 -0.486 1.817 1.00 0.00 N ATOM 367 CA ILE A 24 -10.912 -1.912 1.907 1.00 0.00 C ATOM 368 C ILE A 24 -10.566 -2.459 3.287 1.00 0.00 C ATOM 369 O ILE A 24 -9.981 -1.764 4.125 1.00 0.00 O ATOM 370 CB ILE A 24 -10.140 -2.714 0.837 1.00 0.00 C ATOM 371 CG1 ILE A 24 -8.628 -2.535 1.014 1.00 0.00 C ATOM 372 CG2 ILE A 24 -10.571 -2.287 -0.561 1.00 0.00 C ATOM 373 CD1 ILE A 24 -7.797 -3.404 0.091 1.00 0.00 C ATOM 0 H ILE A 24 -9.726 -0.254 1.431 1.00 0.00 H new ATOM 0 HA ILE A 24 -11.981 -2.032 1.731 1.00 0.00 H new ATOM 0 HB ILE A 24 -10.375 -3.771 0.963 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -8.373 -1.490 0.841 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -8.363 -2.761 2.047 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -10.018 -2.862 -1.304 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -11.639 -2.468 -0.684 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.365 -1.225 -0.697 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -6.738 -3.222 0.275 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -8.022 -4.454 0.279 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -8.032 -3.162 -0.946 1.00 0.00 H new ATOM 385 N SER A 25 -10.929 -3.709 3.517 1.00 0.00 N ATOM 386 CA SER A 25 -10.671 -4.349 4.789 1.00 0.00 C ATOM 387 C SER A 25 -9.603 -5.432 4.649 1.00 0.00 C ATOM 388 O SER A 25 -9.743 -6.367 3.856 1.00 0.00 O ATOM 389 CB SER A 25 -11.973 -4.923 5.357 1.00 0.00 C ATOM 390 OG SER A 25 -12.651 -5.740 4.411 1.00 0.00 O ATOM 0 H SER A 25 -11.405 -4.300 2.835 1.00 0.00 H new ATOM 0 HA SER A 25 -10.289 -3.603 5.486 1.00 0.00 H new ATOM 0 HB2 SER A 25 -11.752 -5.508 6.250 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.626 -4.106 5.665 1.00 0.00 H new ATOM 0 HG SER A 25 -12.783 -5.238 3.580 1.00 0.00 H new ATOM 396 N PHE A 26 -8.530 -5.298 5.417 1.00 0.00 N ATOM 397 CA PHE A 26 -7.449 -6.270 5.389 1.00 0.00 C ATOM 398 C PHE A 26 -7.798 -7.481 6.248 1.00 0.00 C ATOM 399 O PHE A 26 -7.181 -7.730 7.284 1.00 0.00 O ATOM 400 CB PHE A 26 -6.132 -5.640 5.857 1.00 0.00 C ATOM 401 CG PHE A 26 -5.584 -4.616 4.904 1.00 0.00 C ATOM 402 CD1 PHE A 26 -5.987 -3.293 4.976 1.00 0.00 C ATOM 403 CD2 PHE A 26 -4.663 -4.981 3.937 1.00 0.00 C ATOM 404 CE1 PHE A 26 -5.482 -2.354 4.099 1.00 0.00 C ATOM 405 CE2 PHE A 26 -4.154 -4.048 3.057 1.00 0.00 C ATOM 406 CZ PHE A 26 -4.564 -2.732 3.138 1.00 0.00 C ATOM 0 H PHE A 26 -8.386 -4.525 6.067 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.318 -6.601 4.359 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -6.288 -5.173 6.829 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -5.391 -6.428 5.997 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.704 -2.993 5.726 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -4.339 -6.009 3.871 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.804 -1.325 4.164 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.437 -4.346 2.307 1.00 0.00 H new ATOM 0 HZ PHE A 26 -4.168 -1.999 2.451 1.00 0.00 H new ATOM 416 N LEU A 27 -8.834 -8.191 5.828 1.00 0.00 N ATOM 417 CA LEU A 27 -9.241 -9.436 6.463 1.00 0.00 C ATOM 418 C LEU A 27 -9.165 -10.560 5.440 1.00 0.00 C ATOM 419 O LEU A 27 -8.465 -11.550 5.632 1.00 0.00 O ATOM 420 CB LEU A 27 -10.670 -9.334 7.029 1.00 0.00 C ATOM 421 CG LEU A 27 -10.846 -8.480 8.296 1.00 0.00 C ATOM 422 CD1 LEU A 27 -9.850 -8.892 9.366 1.00 0.00 C ATOM 423 CD2 LEU A 27 -10.721 -6.995 7.989 1.00 0.00 C ATOM 0 H LEU A 27 -9.417 -7.920 5.036 1.00 0.00 H new ATOM 0 HA LEU A 27 -8.569 -9.642 7.296 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -11.317 -8.928 6.251 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -11.024 -10.342 7.245 1.00 0.00 H new ATOM 0 HG LEU A 27 -11.853 -8.656 8.675 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.993 -8.275 10.253 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.006 -9.940 9.624 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -8.836 -8.758 8.990 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -10.851 -6.422 8.907 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.735 -6.792 7.570 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -11.487 -6.706 7.270 1.00 0.00 H new ATOM 435 N GLY A 28 -9.885 -10.382 4.341 1.00 0.00 N ATOM 436 CA GLY A 28 -9.834 -11.329 3.247 1.00 0.00 C ATOM 437 C GLY A 28 -10.099 -10.648 1.923 1.00 0.00 C ATOM 438 O GLY A 28 -10.861 -11.150 1.096 1.00 0.00 O ATOM 0 H GLY A 28 -10.509 -9.590 4.188 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.856 -11.809 3.223 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.571 -12.116 3.409 1.00 0.00 H new ATOM 442 N GLY A 29 -9.470 -9.495 1.730 1.00 0.00 N ATOM 443 CA GLY A 29 -9.699 -8.713 0.531 1.00 0.00 C ATOM 444 C GLY A 29 -9.024 -9.298 -0.694 1.00 0.00 C ATOM 445 O GLY A 29 -9.669 -9.524 -1.710 1.00 0.00 O ATOM 0 H GLY A 29 -8.803 -9.087 2.385 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -10.771 -8.642 0.349 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -9.335 -7.698 0.690 1.00 0.00 H new ATOM 449 N ILE A 30 -7.729 -9.550 -0.599 1.00 0.00 N ATOM 450 CA ILE A 30 -6.961 -10.053 -1.732 1.00 0.00 C ATOM 451 C ILE A 30 -6.785 -11.571 -1.639 1.00 0.00 C ATOM 452 O ILE A 30 -6.501 -12.107 -0.569 1.00 0.00 O ATOM 453 CB ILE A 30 -5.573 -9.375 -1.803 1.00 0.00 C ATOM 454 CG1 ILE A 30 -5.729 -7.850 -1.860 1.00 0.00 C ATOM 455 CG2 ILE A 30 -4.792 -9.875 -3.013 1.00 0.00 C ATOM 456 CD1 ILE A 30 -4.414 -7.100 -1.810 1.00 0.00 C ATOM 0 H ILE A 30 -7.184 -9.415 0.252 1.00 0.00 H new ATOM 0 HA ILE A 30 -7.517 -9.815 -2.639 1.00 0.00 H new ATOM 0 HB ILE A 30 -5.015 -9.636 -0.904 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -6.255 -7.582 -2.776 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.353 -7.526 -1.027 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.818 -9.386 -3.045 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.654 -10.954 -2.937 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.344 -9.643 -3.924 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -4.605 -6.028 -1.855 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -3.895 -7.338 -0.882 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.795 -7.394 -2.658 1.00 0.00 H new ATOM 468 N ASP A 31 -6.984 -12.249 -2.764 1.00 0.00 N ATOM 469 CA ASP A 31 -6.794 -13.695 -2.853 1.00 0.00 C ATOM 470 C ASP A 31 -5.318 -14.046 -2.682 1.00 0.00 C ATOM 471 O ASP A 31 -4.455 -13.421 -3.297 1.00 0.00 O ATOM 472 CB ASP A 31 -7.303 -14.206 -4.204 1.00 0.00 C ATOM 473 CG ASP A 31 -7.196 -15.710 -4.343 1.00 0.00 C ATOM 474 OD1 ASP A 31 -6.104 -16.202 -4.686 1.00 0.00 O ATOM 475 OD2 ASP A 31 -8.208 -16.402 -4.134 1.00 0.00 O ATOM 0 H ASP A 31 -7.281 -11.815 -3.638 1.00 0.00 H new ATOM 0 HA ASP A 31 -7.361 -14.174 -2.055 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -8.344 -13.908 -4.331 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -6.735 -13.731 -5.004 1.00 0.00 H new ATOM 480 N LYS A 32 -5.039 -15.062 -1.870 1.00 0.00 N ATOM 481 CA LYS A 32 -3.667 -15.394 -1.473 1.00 0.00 C ATOM 482 C LYS A 32 -2.843 -15.931 -2.639 1.00 0.00 C ATOM 483 O LYS A 32 -1.616 -15.835 -2.638 1.00 0.00 O ATOM 484 CB LYS A 32 -3.682 -16.452 -0.363 1.00 0.00 C ATOM 485 CG LYS A 32 -3.953 -17.868 -0.875 1.00 0.00 C ATOM 486 CD LYS A 32 -4.050 -18.876 0.262 1.00 0.00 C ATOM 487 CE LYS A 32 -2.683 -19.189 0.855 1.00 0.00 C ATOM 488 NZ LYS A 32 -2.770 -20.179 1.963 1.00 0.00 N ATOM 0 H LYS A 32 -5.748 -15.676 -1.470 1.00 0.00 H new ATOM 0 HA LYS A 32 -3.208 -14.470 -1.120 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -2.723 -16.438 0.154 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.444 -16.187 0.371 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.881 -17.876 -1.447 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -3.156 -18.166 -1.557 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.704 -18.484 1.041 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -4.507 -19.795 -0.105 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -2.029 -19.576 0.074 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -2.229 -18.270 1.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -1.818 -20.364 2.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -3.374 -19.800 2.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -3.179 -21.066 1.605 1.00 0.00 H new ATOM 502 N GLU A 33 -3.519 -16.505 -3.616 1.00 0.00 N ATOM 503 CA GLU A 33 -2.852 -17.267 -4.655 1.00 0.00 C ATOM 504 C GLU A 33 -2.922 -16.551 -5.997 1.00 0.00 C ATOM 505 O GLU A 33 -1.974 -16.570 -6.780 1.00 0.00 O ATOM 506 CB GLU A 33 -3.514 -18.640 -4.754 1.00 0.00 C ATOM 507 CG GLU A 33 -2.801 -19.597 -5.682 1.00 0.00 C ATOM 508 CD GLU A 33 -3.601 -20.851 -5.947 1.00 0.00 C ATOM 509 OE1 GLU A 33 -3.491 -21.817 -5.161 1.00 0.00 O ATOM 510 OE2 GLU A 33 -4.351 -20.877 -6.944 1.00 0.00 O ATOM 0 H GLU A 33 -4.533 -16.458 -3.712 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.799 -17.375 -4.397 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -3.562 -19.082 -3.759 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -4.541 -18.514 -5.097 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -2.595 -19.095 -6.627 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -1.839 -19.869 -5.249 1.00 0.00 H new ATOM 517 N THR A 34 -4.047 -15.929 -6.261 1.00 0.00 N ATOM 518 CA THR A 34 -4.276 -15.283 -7.539 1.00 0.00 C ATOM 519 C THR A 34 -4.025 -13.778 -7.461 1.00 0.00 C ATOM 520 O THR A 34 -3.889 -13.110 -8.486 1.00 0.00 O ATOM 521 CB THR A 34 -5.704 -15.543 -8.015 1.00 0.00 C ATOM 522 OG1 THR A 34 -6.228 -16.711 -7.366 1.00 0.00 O ATOM 523 CG2 THR A 34 -5.738 -15.740 -9.521 1.00 0.00 C ATOM 0 H THR A 34 -4.825 -15.855 -5.605 1.00 0.00 H new ATOM 0 HA THR A 34 -3.571 -15.708 -8.253 1.00 0.00 H new ATOM 0 HB THR A 34 -6.316 -14.678 -7.760 1.00 0.00 H new ATOM 0 HG1 THR A 34 -6.340 -16.531 -6.409 1.00 0.00 H new ATOM 0 HG21 THR A 34 -6.764 -15.924 -9.841 1.00 0.00 H new ATOM 0 HG22 THR A 34 -5.359 -14.844 -10.014 1.00 0.00 H new ATOM 0 HG23 THR A 34 -5.115 -16.593 -9.790 1.00 0.00 H new ATOM 531 N GLY A 35 -3.952 -13.251 -6.242 1.00 0.00 N ATOM 532 CA GLY A 35 -3.751 -11.824 -6.058 1.00 0.00 C ATOM 533 C GLY A 35 -4.953 -11.018 -6.502 1.00 0.00 C ATOM 534 O GLY A 35 -4.841 -9.831 -6.802 1.00 0.00 O ATOM 0 H GLY A 35 -4.029 -13.787 -5.378 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -3.546 -11.620 -5.007 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -2.874 -11.506 -6.621 1.00 0.00 H new ATOM 538 N ILE A 36 -6.105 -11.673 -6.545 1.00 0.00 N ATOM 539 CA ILE A 36 -7.338 -11.044 -6.995 1.00 0.00 C ATOM 540 C ILE A 36 -8.053 -10.374 -5.832 1.00 0.00 C ATOM 541 O ILE A 36 -8.293 -11.006 -4.805 1.00 0.00 O ATOM 542 CB ILE A 36 -8.294 -12.087 -7.630 1.00 0.00 C ATOM 543 CG1 ILE A 36 -7.656 -12.735 -8.864 1.00 0.00 C ATOM 544 CG2 ILE A 36 -9.636 -11.453 -7.982 1.00 0.00 C ATOM 545 CD1 ILE A 36 -7.443 -11.787 -10.023 1.00 0.00 C ATOM 0 H ILE A 36 -6.211 -12.650 -6.271 1.00 0.00 H new ATOM 0 HA ILE A 36 -7.069 -10.297 -7.742 1.00 0.00 H new ATOM 0 HB ILE A 36 -8.474 -12.870 -6.893 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -6.695 -13.164 -8.579 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.288 -13.559 -9.195 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.288 -12.205 -8.426 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -10.100 -11.058 -7.078 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -9.480 -10.642 -8.694 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -6.988 -12.325 -10.854 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -8.402 -11.376 -10.338 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -6.785 -10.975 -9.713 1.00 0.00 H new ATOM 557 N VAL A 37 -8.382 -9.103 -5.986 1.00 0.00 N ATOM 558 CA VAL A 37 -9.173 -8.399 -4.987 1.00 0.00 C ATOM 559 C VAL A 37 -10.617 -8.902 -5.025 1.00 0.00 C ATOM 560 O VAL A 37 -11.327 -8.719 -6.018 1.00 0.00 O ATOM 561 CB VAL A 37 -9.156 -6.870 -5.208 1.00 0.00 C ATOM 562 CG1 VAL A 37 -9.925 -6.152 -4.106 1.00 0.00 C ATOM 563 CG2 VAL A 37 -7.726 -6.354 -5.286 1.00 0.00 C ATOM 0 H VAL A 37 -8.115 -8.537 -6.791 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.728 -8.601 -4.013 1.00 0.00 H new ATOM 0 HB VAL A 37 -9.649 -6.661 -6.157 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -9.898 -5.077 -4.285 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -10.960 -6.494 -4.103 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -9.468 -6.371 -3.141 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -7.736 -5.275 -5.442 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -7.206 -6.581 -4.355 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -7.210 -6.836 -6.117 1.00 0.00 H new ATOM 573 N LYS A 38 -11.029 -9.551 -3.949 1.00 0.00 N ATOM 574 CA LYS A 38 -12.351 -10.153 -3.865 1.00 0.00 C ATOM 575 C LYS A 38 -13.374 -9.156 -3.332 1.00 0.00 C ATOM 576 O LYS A 38 -14.557 -9.244 -3.658 1.00 0.00 O ATOM 577 CB LYS A 38 -12.304 -11.390 -2.961 1.00 0.00 C ATOM 578 CG LYS A 38 -11.358 -12.479 -3.452 1.00 0.00 C ATOM 579 CD LYS A 38 -11.905 -13.192 -4.680 1.00 0.00 C ATOM 580 CE LYS A 38 -10.917 -14.219 -5.217 1.00 0.00 C ATOM 581 NZ LYS A 38 -11.506 -15.044 -6.306 1.00 0.00 N ATOM 0 H LYS A 38 -10.460 -9.676 -3.112 1.00 0.00 H new ATOM 0 HA LYS A 38 -12.656 -10.450 -4.868 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -12.002 -11.084 -1.959 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -13.308 -11.805 -2.878 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -10.389 -12.039 -3.689 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.193 -13.204 -2.655 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -12.843 -13.686 -4.427 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -12.129 -12.461 -5.457 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -10.029 -13.708 -5.589 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -10.593 -14.869 -4.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -10.800 -15.730 -6.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -12.338 -15.553 -5.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -11.792 -14.427 -7.093 1.00 0.00 H new ATOM 595 N GLU A 39 -12.917 -8.208 -2.514 1.00 0.00 N ATOM 596 CA GLU A 39 -13.814 -7.211 -1.938 1.00 0.00 C ATOM 597 C GLU A 39 -14.376 -6.326 -3.045 1.00 0.00 C ATOM 598 O GLU A 39 -13.626 -5.711 -3.809 1.00 0.00 O ATOM 599 CB GLU A 39 -13.096 -6.365 -0.880 1.00 0.00 C ATOM 600 CG GLU A 39 -14.043 -5.518 -0.036 1.00 0.00 C ATOM 601 CD GLU A 39 -13.338 -4.738 1.060 1.00 0.00 C ATOM 602 OE1 GLU A 39 -12.522 -5.334 1.798 1.00 0.00 O ATOM 603 OE2 GLU A 39 -13.621 -3.530 1.214 1.00 0.00 O ATOM 0 H GLU A 39 -11.940 -8.111 -2.238 1.00 0.00 H new ATOM 0 HA GLU A 39 -14.636 -7.728 -1.442 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -12.527 -7.024 -0.224 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -12.378 -5.711 -1.375 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -14.572 -4.821 -0.686 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -14.794 -6.166 0.415 1.00 0.00 H new ATOM 610 N ASP A 40 -15.695 -6.280 -3.138 1.00 0.00 N ATOM 611 CA ASP A 40 -16.364 -5.593 -4.236 1.00 0.00 C ATOM 612 C ASP A 40 -16.275 -4.077 -4.099 1.00 0.00 C ATOM 613 O ASP A 40 -16.391 -3.531 -3.001 1.00 0.00 O ATOM 614 CB ASP A 40 -17.826 -6.029 -4.322 1.00 0.00 C ATOM 615 CG ASP A 40 -18.554 -5.349 -5.461 1.00 0.00 C ATOM 616 OD1 ASP A 40 -18.127 -5.517 -6.622 1.00 0.00 O ATOM 617 OD2 ASP A 40 -19.549 -4.646 -5.195 1.00 0.00 O ATOM 0 H ASP A 40 -16.328 -6.712 -2.464 1.00 0.00 H new ATOM 0 HA ASP A 40 -15.850 -5.871 -5.156 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -17.875 -7.110 -4.454 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -18.329 -5.800 -3.382 1.00 0.00 H new ATOM 622 N CYS A 41 -16.083 -3.412 -5.234 1.00 0.00 N ATOM 623 CA CYS A 41 -15.961 -1.961 -5.286 1.00 0.00 C ATOM 624 C CYS A 41 -15.927 -1.490 -6.737 1.00 0.00 C ATOM 625 O CYS A 41 -16.898 -0.942 -7.251 1.00 0.00 O ATOM 626 CB CYS A 41 -14.691 -1.498 -4.564 1.00 0.00 C ATOM 627 SG CYS A 41 -14.393 0.280 -4.677 1.00 0.00 S ATOM 0 H CYS A 41 -16.008 -3.866 -6.144 1.00 0.00 H new ATOM 0 HA CYS A 41 -16.826 -1.527 -4.785 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -14.759 -1.779 -3.513 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -13.834 -2.027 -4.981 1.00 0.00 H new ATOM 0 HG CYS A 41 -13.123 0.497 -4.852 1.00 0.00 H new ATOM 633 N GLU A 42 -14.797 -1.729 -7.390 1.00 0.00 N ATOM 634 CA GLU A 42 -14.604 -1.350 -8.783 1.00 0.00 C ATOM 635 C GLU A 42 -13.523 -2.224 -9.397 1.00 0.00 C ATOM 636 O GLU A 42 -13.721 -2.842 -10.434 1.00 0.00 O ATOM 637 CB GLU A 42 -14.216 0.130 -8.887 1.00 0.00 C ATOM 638 CG GLU A 42 -13.880 0.593 -10.298 1.00 0.00 C ATOM 639 CD GLU A 42 -15.009 0.371 -11.284 1.00 0.00 C ATOM 640 OE1 GLU A 42 -16.059 1.032 -11.151 1.00 0.00 O ATOM 641 OE2 GLU A 42 -14.843 -0.447 -12.211 1.00 0.00 O ATOM 0 H GLU A 42 -13.990 -2.190 -6.970 1.00 0.00 H new ATOM 0 HA GLU A 42 -15.537 -1.496 -9.327 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -15.037 0.736 -8.504 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -13.356 0.314 -8.243 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -13.629 1.654 -10.275 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -12.993 0.063 -10.646 1.00 0.00 H new ATOM 648 N ILE A 43 -12.385 -2.294 -8.718 1.00 0.00 N ATOM 649 CA ILE A 43 -11.278 -3.133 -9.162 1.00 0.00 C ATOM 650 C ILE A 43 -11.478 -4.583 -8.725 1.00 0.00 C ATOM 651 O ILE A 43 -10.551 -5.391 -8.762 1.00 0.00 O ATOM 652 CB ILE A 43 -9.904 -2.602 -8.665 1.00 0.00 C ATOM 653 CG1 ILE A 43 -9.965 -2.068 -7.223 1.00 0.00 C ATOM 654 CG2 ILE A 43 -9.402 -1.514 -9.598 1.00 0.00 C ATOM 655 CD1 ILE A 43 -10.243 -3.118 -6.169 1.00 0.00 C ATOM 0 H ILE A 43 -12.204 -1.779 -7.856 1.00 0.00 H new ATOM 0 HA ILE A 43 -11.271 -3.094 -10.251 1.00 0.00 H new ATOM 0 HB ILE A 43 -9.212 -3.444 -8.668 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -9.018 -1.581 -6.990 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -10.739 -1.303 -7.166 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -8.439 -1.147 -9.244 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -9.288 -1.921 -10.603 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -10.118 -0.693 -9.618 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -10.268 -2.649 -5.186 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -11.205 -3.590 -6.370 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -9.457 -3.873 -6.191 1.00 0.00 H new ATOM 667 N LYS A 44 -12.705 -4.903 -8.325 1.00 0.00 N ATOM 668 CA LYS A 44 -13.054 -6.249 -7.895 1.00 0.00 C ATOM 669 C LYS A 44 -12.930 -7.209 -9.066 1.00 0.00 C ATOM 670 O LYS A 44 -13.525 -7.001 -10.124 1.00 0.00 O ATOM 671 CB LYS A 44 -14.477 -6.253 -7.320 1.00 0.00 C ATOM 672 CG LYS A 44 -14.947 -7.576 -6.710 1.00 0.00 C ATOM 673 CD LYS A 44 -15.396 -8.583 -7.760 1.00 0.00 C ATOM 674 CE LYS A 44 -16.568 -8.069 -8.584 1.00 0.00 C ATOM 675 NZ LYS A 44 -17.794 -7.852 -7.767 1.00 0.00 N ATOM 0 H LYS A 44 -13.479 -4.240 -8.291 1.00 0.00 H new ATOM 0 HA LYS A 44 -12.369 -6.577 -7.113 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -14.541 -5.479 -6.555 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -15.170 -5.975 -8.114 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -14.137 -8.008 -6.122 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -15.771 -7.382 -6.023 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.561 -8.812 -8.422 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.679 -9.515 -7.270 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.286 -7.132 -9.064 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -16.788 -8.781 -9.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -18.616 -8.257 -8.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -17.681 -8.315 -6.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -17.942 -6.832 -7.628 1.00 0.00 H new ATOM 689 N GLY A 45 -12.147 -8.248 -8.865 1.00 0.00 N ATOM 690 CA GLY A 45 -11.930 -9.226 -9.909 1.00 0.00 C ATOM 691 C GLY A 45 -10.571 -9.081 -10.561 1.00 0.00 C ATOM 692 O GLY A 45 -10.117 -9.979 -11.271 1.00 0.00 O ATOM 0 H GLY A 45 -11.653 -8.436 -7.993 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -12.024 -10.228 -9.490 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -12.707 -9.123 -10.667 1.00 0.00 H new ATOM 696 N GLU A 46 -9.922 -7.947 -10.338 1.00 0.00 N ATOM 697 CA GLU A 46 -8.589 -7.723 -10.867 1.00 0.00 C ATOM 698 C GLU A 46 -7.506 -8.156 -9.890 1.00 0.00 C ATOM 699 O GLU A 46 -7.741 -8.278 -8.686 1.00 0.00 O ATOM 700 CB GLU A 46 -8.415 -6.259 -11.231 1.00 0.00 C ATOM 701 CG GLU A 46 -8.887 -5.950 -12.630 1.00 0.00 C ATOM 702 CD GLU A 46 -8.026 -6.638 -13.670 1.00 0.00 C ATOM 703 OE1 GLU A 46 -6.891 -6.173 -13.905 1.00 0.00 O ATOM 704 OE2 GLU A 46 -8.461 -7.668 -14.230 1.00 0.00 O ATOM 0 H GLU A 46 -10.298 -7.170 -9.795 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.482 -8.336 -11.762 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.967 -5.644 -10.521 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.363 -5.988 -11.138 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.923 -6.269 -12.745 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.865 -4.872 -12.793 1.00 0.00 H new ATOM 711 N SER A 47 -6.318 -8.390 -10.432 1.00 0.00 N ATOM 712 CA SER A 47 -5.178 -8.827 -9.648 1.00 0.00 C ATOM 713 C SER A 47 -4.196 -7.682 -9.414 1.00 0.00 C ATOM 714 O SER A 47 -4.186 -6.687 -10.146 1.00 0.00 O ATOM 715 CB SER A 47 -4.488 -9.994 -10.358 1.00 0.00 C ATOM 716 OG SER A 47 -4.493 -9.804 -11.764 1.00 0.00 O ATOM 0 H SER A 47 -6.121 -8.281 -11.427 1.00 0.00 H new ATOM 0 HA SER A 47 -5.532 -9.158 -8.672 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.462 -10.086 -10.003 1.00 0.00 H new ATOM 0 HB3 SER A 47 -4.995 -10.927 -10.111 1.00 0.00 H new ATOM 0 HG SER A 47 -4.046 -10.560 -12.198 1.00 0.00 H new ATOM 722 N VAL A 48 -3.381 -7.829 -8.382 1.00 0.00 N ATOM 723 CA VAL A 48 -2.394 -6.817 -8.023 1.00 0.00 C ATOM 724 C VAL A 48 -0.978 -7.298 -8.342 1.00 0.00 C ATOM 725 O VAL A 48 0.007 -6.761 -7.833 1.00 0.00 O ATOM 726 CB VAL A 48 -2.500 -6.464 -6.526 1.00 0.00 C ATOM 727 CG1 VAL A 48 -3.857 -5.840 -6.225 1.00 0.00 C ATOM 728 CG2 VAL A 48 -2.275 -7.700 -5.663 1.00 0.00 C ATOM 0 H VAL A 48 -3.382 -8.646 -7.772 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.601 -5.925 -8.614 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.723 -5.738 -6.287 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.918 -5.596 -5.164 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.978 -4.931 -6.814 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.647 -6.546 -6.481 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.354 -7.428 -4.610 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.027 -8.452 -5.901 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.282 -8.105 -5.859 1.00 0.00 H new ATOM 738 N ALA A 49 -0.894 -8.276 -9.236 1.00 0.00 N ATOM 739 CA ALA A 49 0.357 -8.940 -9.555 1.00 0.00 C ATOM 740 C ALA A 49 1.262 -8.056 -10.400 1.00 0.00 C ATOM 741 O ALA A 49 1.168 -8.023 -11.632 1.00 0.00 O ATOM 742 CB ALA A 49 0.091 -10.261 -10.264 1.00 0.00 C ATOM 0 H ALA A 49 -1.695 -8.629 -9.759 1.00 0.00 H new ATOM 0 HA ALA A 49 0.874 -9.140 -8.617 1.00 0.00 H new ATOM 0 HB1 ALA A 49 1.039 -10.747 -10.496 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.499 -10.909 -9.616 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.457 -10.074 -11.188 1.00 0.00 H new ATOM 748 N GLY A 50 2.112 -7.314 -9.717 1.00 0.00 N ATOM 749 CA GLY A 50 3.117 -6.514 -10.389 1.00 0.00 C ATOM 750 C GLY A 50 2.679 -5.083 -10.611 1.00 0.00 C ATOM 751 O GLY A 50 3.224 -4.382 -11.463 1.00 0.00 O ATOM 0 H GLY A 50 2.127 -7.249 -8.699 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.034 -6.521 -9.799 1.00 0.00 H new ATOM 0 HA3 GLY A 50 3.353 -6.970 -11.351 1.00 0.00 H new ATOM 755 N ARG A 51 1.700 -4.642 -9.837 1.00 0.00 N ATOM 756 CA ARG A 51 1.179 -3.291 -9.969 1.00 0.00 C ATOM 757 C ARG A 51 1.565 -2.445 -8.759 1.00 0.00 C ATOM 758 O ARG A 51 1.903 -2.983 -7.702 1.00 0.00 O ATOM 759 CB ARG A 51 -0.341 -3.331 -10.149 1.00 0.00 C ATOM 760 CG ARG A 51 -0.762 -3.891 -11.501 1.00 0.00 C ATOM 761 CD ARG A 51 -2.272 -4.032 -11.626 1.00 0.00 C ATOM 762 NE ARG A 51 -2.675 -4.259 -13.014 1.00 0.00 N ATOM 763 CZ ARG A 51 -3.853 -4.759 -13.399 1.00 0.00 C ATOM 764 NH1 ARG A 51 -4.736 -5.196 -12.509 1.00 0.00 N ATOM 765 NH2 ARG A 51 -4.135 -4.856 -14.689 1.00 0.00 N ATOM 0 H ARG A 51 1.250 -5.200 -9.111 1.00 0.00 H new ATOM 0 HA ARG A 51 1.619 -2.829 -10.853 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -0.780 -3.938 -9.357 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -0.742 -2.324 -10.038 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -0.394 -3.238 -12.292 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -0.295 -4.865 -11.649 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -2.614 -4.861 -11.006 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -2.755 -3.131 -11.248 1.00 0.00 H new ATOM 0 HE ARG A 51 -2.005 -4.017 -13.744 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -4.520 -5.153 -11.513 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -5.630 -5.574 -12.821 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -3.454 -4.550 -15.384 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -5.033 -5.237 -14.988 1.00 0.00 H new ATOM 779 N ILE A 52 1.541 -1.128 -8.933 1.00 0.00 N ATOM 780 CA ILE A 52 1.868 -0.202 -7.853 1.00 0.00 C ATOM 781 C ILE A 52 0.591 0.260 -7.165 1.00 0.00 C ATOM 782 O ILE A 52 -0.145 1.083 -7.698 1.00 0.00 O ATOM 783 CB ILE A 52 2.651 1.028 -8.373 1.00 0.00 C ATOM 784 CG1 ILE A 52 3.954 0.585 -9.050 1.00 0.00 C ATOM 785 CG2 ILE A 52 2.938 2.003 -7.235 1.00 0.00 C ATOM 786 CD1 ILE A 52 4.891 -0.175 -8.134 1.00 0.00 C ATOM 0 H ILE A 52 1.298 -0.676 -9.814 1.00 0.00 H new ATOM 0 HA ILE A 52 2.503 -0.731 -7.142 1.00 0.00 H new ATOM 0 HB ILE A 52 2.037 1.541 -9.113 1.00 0.00 H new ATOM 0 HG12 ILE A 52 3.712 -0.042 -9.908 1.00 0.00 H new ATOM 0 HG13 ILE A 52 4.470 1.465 -9.434 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.489 2.861 -7.621 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.998 2.342 -6.800 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.533 1.504 -6.470 1.00 0.00 H new ATOM 0 HD11 ILE A 52 5.790 -0.455 -8.684 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.164 0.456 -7.288 1.00 0.00 H new ATOM 0 HD13 ILE A 52 4.394 -1.074 -7.770 1.00 0.00 H new ATOM 798 N LEU A 53 0.336 -0.273 -5.983 1.00 0.00 N ATOM 799 CA LEU A 53 -0.927 -0.038 -5.299 1.00 0.00 C ATOM 800 C LEU A 53 -0.896 1.251 -4.486 1.00 0.00 C ATOM 801 O LEU A 53 0.059 1.523 -3.760 1.00 0.00 O ATOM 802 CB LEU A 53 -1.269 -1.222 -4.388 1.00 0.00 C ATOM 803 CG LEU A 53 -2.013 -2.385 -5.059 1.00 0.00 C ATOM 804 CD1 LEU A 53 -1.255 -2.908 -6.270 1.00 0.00 C ATOM 805 CD2 LEU A 53 -2.251 -3.507 -4.060 1.00 0.00 C ATOM 0 H LEU A 53 0.986 -0.872 -5.475 1.00 0.00 H new ATOM 0 HA LEU A 53 -1.698 0.065 -6.062 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.343 -1.606 -3.959 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.876 -0.856 -3.560 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.975 -2.008 -5.406 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.811 -3.731 -6.720 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.138 -2.107 -7.000 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.272 -3.262 -5.959 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.779 -4.325 -4.550 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -1.294 -3.868 -3.683 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -2.850 -3.134 -3.230 1.00 0.00 H new ATOM 817 N VAL A 54 -1.947 2.043 -4.629 1.00 0.00 N ATOM 818 CA VAL A 54 -2.105 3.268 -3.857 1.00 0.00 C ATOM 819 C VAL A 54 -3.450 3.254 -3.138 1.00 0.00 C ATOM 820 O VAL A 54 -4.500 3.141 -3.778 1.00 0.00 O ATOM 821 CB VAL A 54 -2.021 4.523 -4.755 1.00 0.00 C ATOM 822 CG1 VAL A 54 -2.186 5.793 -3.931 1.00 0.00 C ATOM 823 CG2 VAL A 54 -0.707 4.556 -5.525 1.00 0.00 C ATOM 0 H VAL A 54 -2.711 1.858 -5.279 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.291 3.311 -3.133 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.838 4.472 -5.475 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.123 6.662 -4.586 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.157 5.782 -3.435 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.396 5.845 -3.181 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.673 5.449 -6.149 1.00 0.00 H new ATOM 0 HG22 VAL A 54 0.126 4.573 -4.822 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -0.632 3.670 -6.155 1.00 0.00 H new ATOM 833 N PHE A 55 -3.416 3.350 -1.814 1.00 0.00 N ATOM 834 CA PHE A 55 -4.633 3.316 -1.013 1.00 0.00 C ATOM 835 C PHE A 55 -4.692 4.490 -0.045 1.00 0.00 C ATOM 836 O PHE A 55 -3.669 4.923 0.484 1.00 0.00 O ATOM 837 CB PHE A 55 -4.727 2.006 -0.227 1.00 0.00 C ATOM 838 CG PHE A 55 -5.011 0.805 -1.084 1.00 0.00 C ATOM 839 CD1 PHE A 55 -3.983 0.137 -1.733 1.00 0.00 C ATOM 840 CD2 PHE A 55 -6.309 0.341 -1.235 1.00 0.00 C ATOM 841 CE1 PHE A 55 -4.247 -0.970 -2.516 1.00 0.00 C ATOM 842 CE2 PHE A 55 -6.576 -0.766 -2.017 1.00 0.00 C ATOM 843 CZ PHE A 55 -5.542 -1.422 -2.658 1.00 0.00 C ATOM 0 H PHE A 55 -2.558 3.452 -1.272 1.00 0.00 H new ATOM 0 HA PHE A 55 -5.476 3.387 -1.701 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -3.791 1.846 0.308 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -5.512 2.099 0.524 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -2.967 0.486 -1.625 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.120 0.851 -0.736 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -3.439 -1.482 -3.017 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -7.591 -1.118 -2.127 1.00 0.00 H new ATOM 0 HZ PHE A 55 -5.748 -2.288 -3.270 1.00 0.00 H new ATOM 853 N PRO A 56 -5.897 5.026 0.196 1.00 0.00 N ATOM 854 CA PRO A 56 -6.102 6.090 1.175 1.00 0.00 C ATOM 855 C PRO A 56 -6.197 5.544 2.597 1.00 0.00 C ATOM 856 O PRO A 56 -6.163 6.295 3.573 1.00 0.00 O ATOM 857 CB PRO A 56 -7.433 6.701 0.737 1.00 0.00 C ATOM 858 CG PRO A 56 -8.182 5.571 0.116 1.00 0.00 C ATOM 859 CD PRO A 56 -7.150 4.655 -0.490 1.00 0.00 C ATOM 0 HA PRO A 56 -5.278 6.804 1.201 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -7.976 7.117 1.586 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -7.281 7.513 0.026 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -8.778 5.045 0.861 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -8.872 5.935 -0.645 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -7.400 3.607 -0.325 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -7.073 4.798 -1.568 1.00 0.00 H new ATOM 867 N GLY A 57 -6.317 4.230 2.706 1.00 0.00 N ATOM 868 CA GLY A 57 -6.412 3.602 4.001 1.00 0.00 C ATOM 869 C GLY A 57 -7.460 2.512 4.028 1.00 0.00 C ATOM 870 O GLY A 57 -7.847 1.987 2.984 1.00 0.00 O ATOM 0 H GLY A 57 -6.350 3.587 1.915 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -5.444 3.180 4.271 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -6.653 4.355 4.752 1.00 0.00 H new ATOM 969 N TYR A 66 1.135 -10.970 7.425 1.00 0.00 N ATOM 970 CA TYR A 66 1.614 -12.332 7.147 1.00 0.00 C ATOM 971 C TYR A 66 1.140 -12.837 5.778 1.00 0.00 C ATOM 972 O TYR A 66 1.922 -13.413 5.024 1.00 0.00 O ATOM 973 CB TYR A 66 1.179 -13.301 8.257 1.00 0.00 C ATOM 974 CG TYR A 66 2.200 -14.371 8.569 1.00 0.00 C ATOM 975 CD1 TYR A 66 3.265 -14.104 9.418 1.00 0.00 C ATOM 976 CD2 TYR A 66 2.101 -15.642 8.018 1.00 0.00 C ATOM 977 CE1 TYR A 66 4.202 -15.071 9.712 1.00 0.00 C ATOM 978 CE2 TYR A 66 3.036 -16.616 8.310 1.00 0.00 C ATOM 979 CZ TYR A 66 4.084 -16.326 9.157 1.00 0.00 C ATOM 980 OH TYR A 66 5.021 -17.292 9.450 1.00 0.00 O ATOM 0 HA TYR A 66 2.703 -12.292 7.124 1.00 0.00 H new ATOM 0 HB2 TYR A 66 0.975 -12.732 9.164 1.00 0.00 H new ATOM 0 HB3 TYR A 66 0.244 -13.779 7.963 1.00 0.00 H new ATOM 0 HD1 TYR A 66 3.361 -13.121 9.856 1.00 0.00 H new ATOM 0 HD2 TYR A 66 1.282 -15.872 7.352 1.00 0.00 H new ATOM 0 HE1 TYR A 66 5.025 -14.846 10.374 1.00 0.00 H new ATOM 0 HE2 TYR A 66 2.946 -17.601 7.876 1.00 0.00 H new ATOM 0 HH TYR A 66 4.794 -18.121 8.980 1.00 0.00 H new ATOM 990 N VAL A 67 -0.132 -12.600 5.458 1.00 0.00 N ATOM 991 CA VAL A 67 -0.718 -13.043 4.189 1.00 0.00 C ATOM 992 C VAL A 67 0.032 -12.454 2.995 1.00 0.00 C ATOM 993 O VAL A 67 0.176 -13.100 1.957 1.00 0.00 O ATOM 994 CB VAL A 67 -2.210 -12.650 4.100 1.00 0.00 C ATOM 995 CG1 VAL A 67 -2.833 -13.147 2.800 1.00 0.00 C ATOM 996 CG2 VAL A 67 -2.976 -13.187 5.300 1.00 0.00 C ATOM 0 H VAL A 67 -0.782 -12.100 6.064 1.00 0.00 H new ATOM 0 HA VAL A 67 -0.632 -14.129 4.158 1.00 0.00 H new ATOM 0 HB VAL A 67 -2.272 -11.562 4.107 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.883 -12.856 2.765 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -2.306 -12.708 1.953 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -2.756 -14.233 2.751 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -4.025 -12.901 5.220 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -2.898 -14.274 5.325 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -2.555 -12.772 6.216 1.00 0.00 H new ATOM 1006 N LEU A 68 0.529 -11.232 3.164 1.00 0.00 N ATOM 1007 CA LEU A 68 1.269 -10.539 2.111 1.00 0.00 C ATOM 1008 C LEU A 68 2.488 -11.345 1.656 1.00 0.00 C ATOM 1009 O LEU A 68 2.886 -11.283 0.492 1.00 0.00 O ATOM 1010 CB LEU A 68 1.716 -9.161 2.602 1.00 0.00 C ATOM 1011 CG LEU A 68 0.586 -8.223 3.034 1.00 0.00 C ATOM 1012 CD1 LEU A 68 1.151 -6.925 3.594 1.00 0.00 C ATOM 1013 CD2 LEU A 68 -0.348 -7.936 1.868 1.00 0.00 C ATOM 0 H LEU A 68 0.432 -10.697 4.027 1.00 0.00 H new ATOM 0 HA LEU A 68 0.601 -10.424 1.257 1.00 0.00 H new ATOM 0 HB2 LEU A 68 2.396 -9.296 3.443 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.284 -8.677 1.808 1.00 0.00 H new ATOM 0 HG LEU A 68 0.014 -8.717 3.820 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.332 -6.272 3.895 1.00 0.00 H new ATOM 0 HD12 LEU A 68 1.778 -7.144 4.459 1.00 0.00 H new ATOM 0 HD13 LEU A 68 1.749 -6.429 2.829 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.144 -7.268 2.196 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.212 -7.465 1.061 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.782 -8.870 1.511 1.00 0.00 H new ATOM 1025 N LEU A 69 3.070 -12.103 2.580 1.00 0.00 N ATOM 1026 CA LEU A 69 4.261 -12.895 2.290 1.00 0.00 C ATOM 1027 C LEU A 69 3.932 -14.015 1.312 1.00 0.00 C ATOM 1028 O LEU A 69 4.751 -14.383 0.465 1.00 0.00 O ATOM 1029 CB LEU A 69 4.833 -13.479 3.583 1.00 0.00 C ATOM 1030 CG LEU A 69 6.120 -14.295 3.423 1.00 0.00 C ATOM 1031 CD1 LEU A 69 7.238 -13.435 2.859 1.00 0.00 C ATOM 1032 CD2 LEU A 69 6.535 -14.901 4.755 1.00 0.00 C ATOM 0 H LEU A 69 2.735 -12.186 3.540 1.00 0.00 H new ATOM 0 HA LEU A 69 5.007 -12.244 1.835 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.026 -12.661 4.277 1.00 0.00 H new ATOM 0 HB3 LEU A 69 4.075 -14.114 4.041 1.00 0.00 H new ATOM 0 HG LEU A 69 5.925 -15.104 2.719 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.142 -14.036 2.754 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.943 -13.049 1.883 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.432 -12.602 3.535 1.00 0.00 H new ATOM 0 HD21 LEU A 69 7.451 -15.477 4.623 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.708 -14.105 5.479 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.744 -15.556 5.119 1.00 0.00 H new ATOM 1044 N ASN A 70 2.721 -14.542 1.425 1.00 0.00 N ATOM 1045 CA ASN A 70 2.275 -15.628 0.559 1.00 0.00 C ATOM 1046 C ASN A 70 2.171 -15.138 -0.877 1.00 0.00 C ATOM 1047 O ASN A 70 2.578 -15.824 -1.813 1.00 0.00 O ATOM 1048 CB ASN A 70 0.921 -16.164 1.027 1.00 0.00 C ATOM 1049 CG ASN A 70 0.570 -17.493 0.383 1.00 0.00 C ATOM 1050 OD1 ASN A 70 0.878 -18.552 0.928 1.00 0.00 O ATOM 1051 ND2 ASN A 70 -0.078 -17.456 -0.773 1.00 0.00 N ATOM 0 H ASN A 70 2.028 -14.236 2.108 1.00 0.00 H new ATOM 0 HA ASN A 70 3.005 -16.435 0.609 1.00 0.00 H new ATOM 0 HB2 ASN A 70 0.935 -16.281 2.111 1.00 0.00 H new ATOM 0 HB3 ASN A 70 0.145 -15.435 0.795 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -0.338 -18.325 -1.240 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -0.317 -16.559 -1.195 1.00 0.00 H new ATOM 1058 N LEU A 71 1.639 -13.930 -1.032 1.00 0.00 N ATOM 1059 CA LEU A 71 1.498 -13.303 -2.342 1.00 0.00 C ATOM 1060 C LEU A 71 2.854 -13.195 -3.034 1.00 0.00 C ATOM 1061 O LEU A 71 2.982 -13.456 -4.234 1.00 0.00 O ATOM 1062 CB LEU A 71 0.894 -11.903 -2.194 1.00 0.00 C ATOM 1063 CG LEU A 71 -0.505 -11.849 -1.580 1.00 0.00 C ATOM 1064 CD1 LEU A 71 -0.910 -10.410 -1.301 1.00 0.00 C ATOM 1065 CD2 LEU A 71 -1.511 -12.510 -2.504 1.00 0.00 C ATOM 0 H LEU A 71 1.295 -13.361 -0.259 1.00 0.00 H new ATOM 0 HA LEU A 71 0.837 -13.924 -2.947 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.564 -11.301 -1.581 1.00 0.00 H new ATOM 0 HB3 LEU A 71 0.858 -11.437 -3.178 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.489 -12.392 -0.635 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.908 -10.391 -0.864 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -0.201 -9.961 -0.605 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.911 -9.845 -2.233 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.503 -12.464 -2.054 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -1.522 -11.989 -3.462 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.231 -13.552 -2.661 1.00 0.00 H new ATOM 1077 N ARG A 72 3.861 -12.806 -2.256 1.00 0.00 N ATOM 1078 CA ARG A 72 5.211 -12.613 -2.771 1.00 0.00 C ATOM 1079 C ARG A 72 5.754 -13.903 -3.369 1.00 0.00 C ATOM 1080 O ARG A 72 6.203 -13.926 -4.513 1.00 0.00 O ATOM 1081 CB ARG A 72 6.137 -12.138 -1.647 1.00 0.00 C ATOM 1082 CG ARG A 72 7.527 -11.739 -2.117 1.00 0.00 C ATOM 1083 CD ARG A 72 8.485 -11.596 -0.946 1.00 0.00 C ATOM 1084 NE ARG A 72 9.733 -10.934 -1.325 1.00 0.00 N ATOM 1085 CZ ARG A 72 10.932 -11.284 -0.861 1.00 0.00 C ATOM 1086 NH1 ARG A 72 11.057 -12.346 -0.071 1.00 0.00 N ATOM 1087 NH2 ARG A 72 12.004 -10.571 -1.186 1.00 0.00 N ATOM 0 H ARG A 72 3.764 -12.617 -1.258 1.00 0.00 H new ATOM 0 HA ARG A 72 5.171 -11.857 -3.555 1.00 0.00 H new ATOM 0 HB2 ARG A 72 5.676 -11.287 -1.146 1.00 0.00 H new ATOM 0 HB3 ARG A 72 6.229 -12.932 -0.906 1.00 0.00 H new ATOM 0 HG2 ARG A 72 7.907 -12.488 -2.812 1.00 0.00 H new ATOM 0 HG3 ARG A 72 7.472 -10.797 -2.662 1.00 0.00 H new ATOM 0 HD2 ARG A 72 8.002 -11.027 -0.152 1.00 0.00 H new ATOM 0 HD3 ARG A 72 8.709 -12.583 -0.540 1.00 0.00 H new ATOM 0 HE ARG A 72 9.682 -10.157 -1.984 1.00 0.00 H new ATOM 0 HH11 ARG A 72 10.234 -12.894 0.181 1.00 0.00 H new ATOM 0 HH12 ARG A 72 11.976 -12.613 0.283 1.00 0.00 H new ATOM 0 HH21 ARG A 72 11.910 -9.755 -1.791 1.00 0.00 H new ATOM 0 HH22 ARG A 72 12.922 -10.839 -0.831 1.00 0.00 H new ATOM 1101 N LYS A 73 5.671 -14.984 -2.603 1.00 0.00 N ATOM 1102 CA LYS A 73 6.261 -16.260 -3.002 1.00 0.00 C ATOM 1103 C LYS A 73 5.436 -16.959 -4.080 1.00 0.00 C ATOM 1104 O LYS A 73 5.852 -17.979 -4.632 1.00 0.00 O ATOM 1105 CB LYS A 73 6.422 -17.169 -1.787 1.00 0.00 C ATOM 1106 CG LYS A 73 7.374 -16.608 -0.743 1.00 0.00 C ATOM 1107 CD LYS A 73 7.554 -17.569 0.418 1.00 0.00 C ATOM 1108 CE LYS A 73 6.265 -17.755 1.201 1.00 0.00 C ATOM 1109 NZ LYS A 73 6.435 -18.738 2.303 1.00 0.00 N ATOM 0 H LYS A 73 5.200 -15.004 -1.699 1.00 0.00 H new ATOM 0 HA LYS A 73 7.242 -16.049 -3.427 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.446 -17.331 -1.330 1.00 0.00 H new ATOM 0 HB3 LYS A 73 6.785 -18.143 -2.115 1.00 0.00 H new ATOM 0 HG2 LYS A 73 8.341 -16.405 -1.203 1.00 0.00 H new ATOM 0 HG3 LYS A 73 6.991 -15.657 -0.373 1.00 0.00 H new ATOM 0 HD2 LYS A 73 7.893 -18.534 0.042 1.00 0.00 H new ATOM 0 HD3 LYS A 73 8.332 -17.194 1.083 1.00 0.00 H new ATOM 0 HE2 LYS A 73 5.946 -16.797 1.612 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.475 -18.092 0.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 5.537 -18.842 2.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.716 -19.658 1.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 7.172 -18.403 2.956 1.00 0.00 H new ATOM 1123 N ASN A 74 4.263 -16.422 -4.370 1.00 0.00 N ATOM 1124 CA ASN A 74 3.448 -16.946 -5.454 1.00 0.00 C ATOM 1125 C ASN A 74 3.752 -16.193 -6.742 1.00 0.00 C ATOM 1126 O ASN A 74 3.674 -16.752 -7.837 1.00 0.00 O ATOM 1127 CB ASN A 74 1.960 -16.832 -5.127 1.00 0.00 C ATOM 1128 CG ASN A 74 1.098 -17.566 -6.135 1.00 0.00 C ATOM 1129 OD1 ASN A 74 0.753 -17.027 -7.185 1.00 0.00 O ATOM 1130 ND2 ASN A 74 0.748 -18.804 -5.822 1.00 0.00 N ATOM 0 H ASN A 74 3.855 -15.629 -3.874 1.00 0.00 H new ATOM 0 HA ASN A 74 3.691 -18.001 -5.583 1.00 0.00 H new ATOM 0 HB2 ASN A 74 1.776 -17.235 -4.131 1.00 0.00 H new ATOM 0 HB3 ASN A 74 1.674 -15.781 -5.103 1.00 0.00 H new ATOM 0 HD21 ASN A 74 0.170 -19.348 -6.463 1.00 0.00 H new ATOM 0 HD22 ASN A 74 1.056 -19.214 -4.940 1.00 0.00 H new ATOM 1137 N GLY A 75 4.113 -14.924 -6.600 1.00 0.00 N ATOM 1138 CA GLY A 75 4.391 -14.093 -7.755 1.00 0.00 C ATOM 1139 C GLY A 75 3.232 -13.177 -8.090 1.00 0.00 C ATOM 1140 O GLY A 75 3.172 -12.606 -9.179 1.00 0.00 O ATOM 0 H GLY A 75 4.219 -14.454 -5.701 1.00 0.00 H new ATOM 0 HA2 GLY A 75 5.282 -13.495 -7.565 1.00 0.00 H new ATOM 0 HA3 GLY A 75 4.611 -14.728 -8.613 1.00 0.00 H new ATOM 1144 N VAL A 76 2.313 -13.030 -7.146 1.00 0.00 N ATOM 1145 CA VAL A 76 1.136 -12.201 -7.351 1.00 0.00 C ATOM 1146 C VAL A 76 1.105 -11.035 -6.368 1.00 0.00 C ATOM 1147 O VAL A 76 0.082 -10.371 -6.208 1.00 0.00 O ATOM 1148 CB VAL A 76 -0.165 -13.024 -7.213 1.00 0.00 C ATOM 1149 CG1 VAL A 76 -0.289 -14.029 -8.350 1.00 0.00 C ATOM 1150 CG2 VAL A 76 -0.217 -13.727 -5.863 1.00 0.00 C ATOM 0 H VAL A 76 2.361 -13.475 -6.230 1.00 0.00 H new ATOM 0 HA VAL A 76 1.197 -11.809 -8.366 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.010 -12.338 -7.272 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -1.212 -14.598 -8.234 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -0.306 -13.500 -9.303 1.00 0.00 H new ATOM 0 HG13 VAL A 76 0.562 -14.710 -8.328 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.141 -14.301 -5.787 1.00 0.00 H new ATOM 0 HG22 VAL A 76 0.636 -14.399 -5.770 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -0.184 -12.985 -5.065 1.00 0.00 H new ATOM 1160 N ALA A 77 2.233 -10.786 -5.717 1.00 0.00 N ATOM 1161 CA ALA A 77 2.334 -9.694 -4.762 1.00 0.00 C ATOM 1162 C ALA A 77 2.391 -8.344 -5.470 1.00 0.00 C ATOM 1163 O ALA A 77 2.874 -8.242 -6.602 1.00 0.00 O ATOM 1164 CB ALA A 77 3.566 -9.867 -3.892 1.00 0.00 C ATOM 0 H ALA A 77 3.090 -11.326 -5.834 1.00 0.00 H new ATOM 0 HA ALA A 77 1.442 -9.717 -4.135 1.00 0.00 H new ATOM 0 HB1 ALA A 77 3.629 -9.042 -3.182 1.00 0.00 H new ATOM 0 HB2 ALA A 77 3.498 -10.809 -3.349 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.457 -9.874 -4.520 1.00 0.00 H new ATOM 1170 N PRO A 78 1.882 -7.294 -4.813 1.00 0.00 N ATOM 1171 CA PRO A 78 2.033 -5.926 -5.286 1.00 0.00 C ATOM 1172 C PRO A 78 3.467 -5.458 -5.103 1.00 0.00 C ATOM 1173 O PRO A 78 4.088 -5.742 -4.080 1.00 0.00 O ATOM 1174 CB PRO A 78 1.083 -5.111 -4.394 1.00 0.00 C ATOM 1175 CG PRO A 78 0.288 -6.111 -3.621 1.00 0.00 C ATOM 1176 CD PRO A 78 1.119 -7.357 -3.562 1.00 0.00 C ATOM 0 HA PRO A 78 1.804 -5.821 -6.346 1.00 0.00 H new ATOM 0 HB2 PRO A 78 1.641 -4.455 -3.726 1.00 0.00 H new ATOM 0 HB3 PRO A 78 0.433 -4.475 -4.995 1.00 0.00 H new ATOM 0 HG2 PRO A 78 0.069 -5.742 -2.619 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -0.669 -6.305 -4.106 1.00 0.00 H new ATOM 0 HD2 PRO A 78 1.772 -7.367 -2.689 1.00 0.00 H new ATOM 0 HD3 PRO A 78 0.501 -8.254 -3.509 1.00 0.00 H new ATOM 1184 N LYS A 79 3.997 -4.754 -6.094 1.00 0.00 N ATOM 1185 CA LYS A 79 5.376 -4.293 -6.037 1.00 0.00 C ATOM 1186 C LYS A 79 5.587 -3.315 -4.887 1.00 0.00 C ATOM 1187 O LYS A 79 6.592 -3.383 -4.179 1.00 0.00 O ATOM 1188 CB LYS A 79 5.775 -3.640 -7.355 1.00 0.00 C ATOM 1189 CG LYS A 79 6.060 -4.632 -8.469 1.00 0.00 C ATOM 1190 CD LYS A 79 6.719 -3.947 -9.655 1.00 0.00 C ATOM 1191 CE LYS A 79 7.195 -4.956 -10.685 1.00 0.00 C ATOM 1192 NZ LYS A 79 7.966 -4.314 -11.787 1.00 0.00 N ATOM 0 H LYS A 79 3.496 -4.491 -6.942 1.00 0.00 H new ATOM 0 HA LYS A 79 6.009 -5.164 -5.864 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.977 -2.969 -7.674 1.00 0.00 H new ATOM 0 HB3 LYS A 79 6.661 -3.026 -7.192 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.708 -5.425 -8.097 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.130 -5.103 -8.788 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.012 -3.258 -10.118 1.00 0.00 H new ATOM 0 HD3 LYS A 79 7.564 -3.352 -9.309 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.818 -5.705 -10.196 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.335 -5.480 -11.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 7.659 -4.707 -12.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 7.797 -3.288 -11.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 8.981 -4.499 -11.654 1.00 0.00 H new ATOM 1206 N ALA A 80 4.636 -2.410 -4.709 1.00 0.00 N ATOM 1207 CA ALA A 80 4.696 -1.429 -3.638 1.00 0.00 C ATOM 1208 C ALA A 80 3.302 -0.913 -3.335 1.00 0.00 C ATOM 1209 O ALA A 80 2.429 -0.942 -4.205 1.00 0.00 O ATOM 1210 CB ALA A 80 5.616 -0.276 -4.016 1.00 0.00 C ATOM 0 H ALA A 80 3.807 -2.336 -5.299 1.00 0.00 H new ATOM 0 HA ALA A 80 5.100 -1.909 -2.747 1.00 0.00 H new ATOM 0 HB1 ALA A 80 5.647 0.447 -3.201 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.620 -0.657 -4.201 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.240 0.209 -4.917 1.00 0.00 H new ATOM 1216 N ILE A 81 3.086 -0.463 -2.106 1.00 0.00 N ATOM 1217 CA ILE A 81 1.791 0.066 -1.708 1.00 0.00 C ATOM 1218 C ILE A 81 1.963 1.374 -0.941 1.00 0.00 C ATOM 1219 O ILE A 81 2.527 1.397 0.153 1.00 0.00 O ATOM 1220 CB ILE A 81 0.998 -0.932 -0.830 1.00 0.00 C ATOM 1221 CG1 ILE A 81 0.894 -2.298 -1.518 1.00 0.00 C ATOM 1222 CG2 ILE A 81 -0.395 -0.386 -0.541 1.00 0.00 C ATOM 1223 CD1 ILE A 81 0.178 -3.346 -0.691 1.00 0.00 C ATOM 0 H ILE A 81 3.791 -0.454 -1.369 1.00 0.00 H new ATOM 0 HA ILE A 81 1.226 0.240 -2.624 1.00 0.00 H new ATOM 0 HB ILE A 81 1.533 -1.060 0.111 1.00 0.00 H new ATOM 0 HG12 ILE A 81 0.371 -2.178 -2.467 1.00 0.00 H new ATOM 0 HG13 ILE A 81 1.897 -2.655 -1.750 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -0.943 -1.097 0.077 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -0.311 0.564 -0.014 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.928 -0.235 -1.479 1.00 0.00 H new ATOM 0 HD11 ILE A 81 0.144 -4.285 -1.244 1.00 0.00 H new ATOM 0 HD12 ILE A 81 0.712 -3.496 0.247 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -0.838 -3.012 -0.481 1.00 0.00 H new ATOM 1235 N ILE A 82 1.482 2.458 -1.524 1.00 0.00 N ATOM 1236 CA ILE A 82 1.586 3.770 -0.900 1.00 0.00 C ATOM 1237 C ILE A 82 0.254 4.127 -0.250 1.00 0.00 C ATOM 1238 O ILE A 82 -0.785 4.112 -0.910 1.00 0.00 O ATOM 1239 CB ILE A 82 1.977 4.863 -1.928 1.00 0.00 C ATOM 1240 CG1 ILE A 82 3.134 4.377 -2.807 1.00 0.00 C ATOM 1241 CG2 ILE A 82 2.364 6.159 -1.220 1.00 0.00 C ATOM 1242 CD1 ILE A 82 4.384 4.016 -2.031 1.00 0.00 C ATOM 0 H ILE A 82 1.014 2.458 -2.430 1.00 0.00 H new ATOM 0 HA ILE A 82 2.372 3.727 -0.146 1.00 0.00 H new ATOM 0 HB ILE A 82 1.112 5.061 -2.561 1.00 0.00 H new ATOM 0 HG12 ILE A 82 2.806 3.506 -3.374 1.00 0.00 H new ATOM 0 HG13 ILE A 82 3.379 5.154 -3.531 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.635 6.911 -1.961 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.520 6.517 -0.630 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.214 5.975 -0.563 1.00 0.00 H new ATOM 0 HD11 ILE A 82 5.157 3.681 -2.722 1.00 0.00 H new ATOM 0 HD12 ILE A 82 4.739 4.890 -1.485 1.00 0.00 H new ATOM 0 HD13 ILE A 82 4.156 3.216 -1.326 1.00 0.00 H new ATOM 1254 N ASN A 83 0.279 4.428 1.041 1.00 0.00 N ATOM 1255 CA ASN A 83 -0.952 4.665 1.784 1.00 0.00 C ATOM 1256 C ASN A 83 -0.943 6.033 2.440 1.00 0.00 C ATOM 1257 O ASN A 83 0.114 6.598 2.712 1.00 0.00 O ATOM 1258 CB ASN A 83 -1.159 3.603 2.866 1.00 0.00 C ATOM 1259 CG ASN A 83 -1.350 2.204 2.314 1.00 0.00 C ATOM 1260 OD1 ASN A 83 -0.251 1.495 2.105 1.00 0.00 O flip ATOM 1261 ND2 ASN A 83 -2.471 1.764 2.070 1.00 0.00 N flip ATOM 0 H ASN A 83 1.132 4.514 1.593 1.00 0.00 H new ATOM 0 HA ASN A 83 -1.769 4.614 1.065 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -0.299 3.606 3.536 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -2.030 3.871 3.464 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -3.294 2.340 2.244 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -2.578 0.822 1.693 1.00 0.00 H new ATOM 1268 N LYS A 84 -2.130 6.552 2.699 1.00 0.00 N ATOM 1269 CA LYS A 84 -2.277 7.803 3.429 1.00 0.00 C ATOM 1270 C LYS A 84 -2.053 7.554 4.915 1.00 0.00 C ATOM 1271 O LYS A 84 -1.317 8.280 5.583 1.00 0.00 O ATOM 1272 CB LYS A 84 -3.671 8.392 3.193 1.00 0.00 C ATOM 1273 CG LYS A 84 -3.937 9.681 3.949 1.00 0.00 C ATOM 1274 CD LYS A 84 -5.291 10.257 3.579 1.00 0.00 C ATOM 1275 CE LYS A 84 -5.605 11.505 4.382 1.00 0.00 C ATOM 1276 NZ LYS A 84 -6.878 12.137 3.947 1.00 0.00 N ATOM 0 H LYS A 84 -3.012 6.125 2.414 1.00 0.00 H new ATOM 0 HA LYS A 84 -1.536 8.517 3.071 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.800 8.576 2.126 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -4.419 7.654 3.482 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -3.899 9.492 5.022 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -3.155 10.407 3.725 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -5.308 10.494 2.515 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -6.065 9.509 3.751 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -5.669 11.250 5.440 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -4.789 12.220 4.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -7.369 12.533 4.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -6.674 12.898 3.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -7.483 11.423 3.494 1.00 0.00 H new ATOM 1290 N LYS A 85 -2.692 6.510 5.424 1.00 0.00 N ATOM 1291 CA LYS A 85 -2.531 6.118 6.814 1.00 0.00 C ATOM 1292 C LYS A 85 -1.911 4.734 6.890 1.00 0.00 C ATOM 1293 O LYS A 85 -2.463 3.768 6.362 1.00 0.00 O ATOM 1294 CB LYS A 85 -3.872 6.141 7.556 1.00 0.00 C ATOM 1295 CG LYS A 85 -4.516 7.516 7.598 1.00 0.00 C ATOM 1296 CD LYS A 85 -5.720 7.551 8.531 1.00 0.00 C ATOM 1297 CE LYS A 85 -6.842 6.632 8.059 1.00 0.00 C ATOM 1298 NZ LYS A 85 -8.054 6.771 8.910 1.00 0.00 N ATOM 0 H LYS A 85 -3.329 5.918 4.891 1.00 0.00 H new ATOM 0 HA LYS A 85 -1.869 6.836 7.298 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -4.557 5.442 7.075 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -3.720 5.788 8.576 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -3.781 8.251 7.926 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -4.827 7.802 6.593 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.409 7.257 9.533 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.094 8.572 8.600 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -7.094 6.865 7.024 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -6.499 5.598 8.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -8.798 6.133 8.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -7.818 6.525 9.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -8.395 7.753 8.871 1.00 0.00 H new ATOM 1312 N THR A 86 -0.761 4.647 7.534 1.00 0.00 N ATOM 1313 CA THR A 86 -0.041 3.393 7.630 1.00 0.00 C ATOM 1314 C THR A 86 -0.293 2.727 8.982 1.00 0.00 C ATOM 1315 O THR A 86 -0.267 3.382 10.027 1.00 0.00 O ATOM 1316 CB THR A 86 1.481 3.595 7.409 1.00 0.00 C ATOM 1317 OG1 THR A 86 2.165 2.337 7.461 1.00 0.00 O ATOM 1318 CG2 THR A 86 2.072 4.539 8.448 1.00 0.00 C ATOM 0 H THR A 86 -0.306 5.433 7.999 1.00 0.00 H new ATOM 0 HA THR A 86 -0.414 2.740 6.841 1.00 0.00 H new ATOM 0 HB THR A 86 1.614 4.040 6.423 1.00 0.00 H new ATOM 0 HG1 THR A 86 2.619 2.176 6.607 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.140 4.659 8.265 1.00 0.00 H new ATOM 0 HG22 THR A 86 1.581 5.510 8.379 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.919 4.125 9.445 1.00 0.00 H new ATOM 1326 N GLU A 87 -0.557 1.429 8.951 1.00 0.00 N ATOM 1327 CA GLU A 87 -0.777 0.668 10.167 1.00 0.00 C ATOM 1328 C GLU A 87 0.451 -0.192 10.450 1.00 0.00 C ATOM 1329 O GLU A 87 1.055 -0.747 9.529 1.00 0.00 O ATOM 1330 CB GLU A 87 -2.024 -0.212 10.036 1.00 0.00 C ATOM 1331 CG GLU A 87 -2.857 -0.298 11.311 1.00 0.00 C ATOM 1332 CD GLU A 87 -2.021 -0.583 12.540 1.00 0.00 C ATOM 1333 OE1 GLU A 87 -1.596 -1.737 12.722 1.00 0.00 O ATOM 1334 OE2 GLU A 87 -1.752 0.358 13.314 1.00 0.00 O ATOM 0 H GLU A 87 -0.624 0.881 8.093 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.937 1.357 10.996 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -2.648 0.177 9.232 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.718 -1.217 9.745 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.394 0.640 11.452 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -3.607 -1.081 11.198 1.00 0.00 H new ATOM 1341 N THR A 88 0.803 -0.306 11.721 1.00 0.00 N ATOM 1342 CA THR A 88 2.002 -1.019 12.125 1.00 0.00 C ATOM 1343 C THR A 88 1.886 -2.521 11.839 1.00 0.00 C ATOM 1344 O THR A 88 2.865 -3.160 11.451 1.00 0.00 O ATOM 1345 CB THR A 88 2.293 -0.792 13.621 1.00 0.00 C ATOM 1346 OG1 THR A 88 2.106 0.595 13.942 1.00 0.00 O ATOM 1347 CG2 THR A 88 3.718 -1.200 13.962 1.00 0.00 C ATOM 0 H THR A 88 0.270 0.090 12.495 1.00 0.00 H new ATOM 0 HA THR A 88 2.830 -0.623 11.537 1.00 0.00 H new ATOM 0 HB THR A 88 1.605 -1.405 14.204 1.00 0.00 H new ATOM 0 HG1 THR A 88 2.290 0.738 14.894 1.00 0.00 H new ATOM 0 HG21 THR A 88 3.901 -1.031 15.023 1.00 0.00 H new ATOM 0 HG22 THR A 88 3.859 -2.256 13.733 1.00 0.00 H new ATOM 0 HG23 THR A 88 4.417 -0.605 13.374 1.00 0.00 H new ATOM 1355 N ILE A 89 0.685 -3.072 12.008 1.00 0.00 N ATOM 1356 CA ILE A 89 0.448 -4.489 11.737 1.00 0.00 C ATOM 1357 C ILE A 89 0.727 -4.803 10.268 1.00 0.00 C ATOM 1358 O ILE A 89 1.380 -5.800 9.944 1.00 0.00 O ATOM 1359 CB ILE A 89 -1.001 -4.893 12.092 1.00 0.00 C ATOM 1360 CG1 ILE A 89 -1.253 -4.712 13.592 1.00 0.00 C ATOM 1361 CG2 ILE A 89 -1.276 -6.332 11.677 1.00 0.00 C ATOM 1362 CD1 ILE A 89 -2.685 -4.980 14.001 1.00 0.00 C ATOM 0 H ILE A 89 -0.137 -2.561 12.330 1.00 0.00 H new ATOM 0 HA ILE A 89 1.128 -5.065 12.364 1.00 0.00 H new ATOM 0 HB ILE A 89 -1.682 -4.243 11.543 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -0.594 -5.381 14.146 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -0.987 -3.694 13.877 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.301 -6.596 11.936 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.136 -6.433 10.601 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -0.588 -6.998 12.197 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -2.790 -4.833 15.076 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -3.348 -4.294 13.474 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -2.950 -6.007 13.748 1.00 0.00 H new ATOM 1374 N ILE A 90 0.252 -3.932 9.384 1.00 0.00 N ATOM 1375 CA ILE A 90 0.485 -4.089 7.956 1.00 0.00 C ATOM 1376 C ILE A 90 1.976 -3.969 7.654 1.00 0.00 C ATOM 1377 O ILE A 90 2.522 -4.730 6.857 1.00 0.00 O ATOM 1378 CB ILE A 90 -0.294 -3.038 7.132 1.00 0.00 C ATOM 1379 CG1 ILE A 90 -1.786 -3.093 7.476 1.00 0.00 C ATOM 1380 CG2 ILE A 90 -0.084 -3.271 5.641 1.00 0.00 C ATOM 1381 CD1 ILE A 90 -2.617 -2.045 6.764 1.00 0.00 C ATOM 0 H ILE A 90 -0.297 -3.109 9.633 1.00 0.00 H new ATOM 0 HA ILE A 90 0.127 -5.078 7.670 1.00 0.00 H new ATOM 0 HB ILE A 90 0.085 -2.048 7.384 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -2.171 -4.081 7.224 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -1.906 -2.969 8.552 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.639 -2.523 5.074 1.00 0.00 H new ATOM 0 HG22 ILE A 90 0.977 -3.191 5.406 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -0.440 -4.266 5.375 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.662 -2.147 7.058 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.259 -1.052 7.035 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -2.529 -2.181 5.686 1.00 0.00 H new ATOM 1393 N ALA A 91 2.626 -3.025 8.326 1.00 0.00 N ATOM 1394 CA ALA A 91 4.051 -2.780 8.135 1.00 0.00 C ATOM 1395 C ALA A 91 4.880 -4.020 8.455 1.00 0.00 C ATOM 1396 O ALA A 91 5.765 -4.396 7.689 1.00 0.00 O ATOM 1397 CB ALA A 91 4.506 -1.609 8.992 1.00 0.00 C ATOM 0 H ALA A 91 2.185 -2.413 9.013 1.00 0.00 H new ATOM 0 HA ALA A 91 4.207 -2.535 7.084 1.00 0.00 H new ATOM 0 HB1 ALA A 91 5.572 -1.438 8.839 1.00 0.00 H new ATOM 0 HB2 ALA A 91 3.951 -0.714 8.710 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.322 -1.834 10.043 1.00 0.00 H new ATOM 1403 N VAL A 92 4.584 -4.656 9.586 1.00 0.00 N ATOM 1404 CA VAL A 92 5.293 -5.867 9.996 1.00 0.00 C ATOM 1405 C VAL A 92 5.155 -6.956 8.932 1.00 0.00 C ATOM 1406 O VAL A 92 6.132 -7.623 8.574 1.00 0.00 O ATOM 1407 CB VAL A 92 4.772 -6.399 11.352 1.00 0.00 C ATOM 1408 CG1 VAL A 92 5.498 -7.674 11.751 1.00 0.00 C ATOM 1409 CG2 VAL A 92 4.923 -5.343 12.440 1.00 0.00 C ATOM 0 H VAL A 92 3.858 -4.353 10.235 1.00 0.00 H new ATOM 0 HA VAL A 92 6.345 -5.604 10.111 1.00 0.00 H new ATOM 0 HB VAL A 92 3.713 -6.629 11.236 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.113 -8.028 12.708 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.337 -8.438 10.990 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.565 -7.472 11.841 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.550 -5.738 13.385 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.975 -5.079 12.547 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.352 -4.456 12.168 1.00 0.00 H new ATOM 1419 N GLY A 93 3.941 -7.112 8.412 1.00 0.00 N ATOM 1420 CA GLY A 93 3.688 -8.117 7.399 1.00 0.00 C ATOM 1421 C GLY A 93 4.332 -7.775 6.068 1.00 0.00 C ATOM 1422 O GLY A 93 4.897 -8.645 5.402 1.00 0.00 O ATOM 0 H GLY A 93 3.127 -6.558 8.676 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.065 -9.080 7.745 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.612 -8.227 7.261 1.00 0.00 H new ATOM 1426 N ALA A 94 4.262 -6.507 5.689 1.00 0.00 N ATOM 1427 CA ALA A 94 4.786 -6.057 4.405 1.00 0.00 C ATOM 1428 C ALA A 94 6.310 -6.080 4.387 1.00 0.00 C ATOM 1429 O ALA A 94 6.918 -6.307 3.342 1.00 0.00 O ATOM 1430 CB ALA A 94 4.271 -4.664 4.090 1.00 0.00 C ATOM 0 H ALA A 94 3.846 -5.767 6.255 1.00 0.00 H new ATOM 0 HA ALA A 94 4.436 -6.747 3.637 1.00 0.00 H new ATOM 0 HB1 ALA A 94 4.669 -4.338 3.129 1.00 0.00 H new ATOM 0 HB2 ALA A 94 3.182 -4.680 4.046 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.592 -3.973 4.869 1.00 0.00 H new ATOM 1436 N ALA A 95 6.920 -5.851 5.544 1.00 0.00 N ATOM 1437 CA ALA A 95 8.375 -5.864 5.662 1.00 0.00 C ATOM 1438 C ALA A 95 8.941 -7.223 5.274 1.00 0.00 C ATOM 1439 O ALA A 95 9.939 -7.313 4.563 1.00 0.00 O ATOM 1440 CB ALA A 95 8.790 -5.508 7.080 1.00 0.00 C ATOM 0 H ALA A 95 6.429 -5.654 6.416 1.00 0.00 H new ATOM 0 HA ALA A 95 8.779 -5.119 4.977 1.00 0.00 H new ATOM 0 HB1 ALA A 95 9.877 -5.521 7.155 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.421 -4.513 7.328 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.370 -6.234 7.775 1.00 0.00 H new ATOM 1446 N MET A 96 8.280 -8.282 5.730 1.00 0.00 N ATOM 1447 CA MET A 96 8.723 -9.643 5.447 1.00 0.00 C ATOM 1448 C MET A 96 8.512 -9.992 3.978 1.00 0.00 C ATOM 1449 O MET A 96 9.292 -10.735 3.386 1.00 0.00 O ATOM 1450 CB MET A 96 7.976 -10.641 6.335 1.00 0.00 C ATOM 1451 CG MET A 96 8.288 -10.489 7.815 1.00 0.00 C ATOM 1452 SD MET A 96 7.373 -11.651 8.852 1.00 0.00 S ATOM 1453 CE MET A 96 5.682 -11.168 8.510 1.00 0.00 C ATOM 0 H MET A 96 7.435 -8.224 6.298 1.00 0.00 H new ATOM 0 HA MET A 96 9.789 -9.702 5.664 1.00 0.00 H new ATOM 0 HB2 MET A 96 6.904 -10.518 6.184 1.00 0.00 H new ATOM 0 HB3 MET A 96 8.228 -11.654 6.021 1.00 0.00 H new ATOM 0 HG2 MET A 96 9.357 -10.634 7.972 1.00 0.00 H new ATOM 0 HG3 MET A 96 8.055 -9.471 8.127 1.00 0.00 H new ATOM 0 HE1 MET A 96 5.012 -11.672 9.207 1.00 0.00 H new ATOM 0 HE2 MET A 96 5.581 -10.089 8.626 1.00 0.00 H new ATOM 0 HE3 MET A 96 5.423 -11.449 7.489 1.00 0.00 H new ATOM 1463 N ALA A 97 7.459 -9.435 3.396 1.00 0.00 N ATOM 1464 CA ALA A 97 7.124 -9.694 2.002 1.00 0.00 C ATOM 1465 C ALA A 97 7.826 -8.718 1.059 1.00 0.00 C ATOM 1466 O ALA A 97 7.598 -8.748 -0.149 1.00 0.00 O ATOM 1467 CB ALA A 97 5.620 -9.622 1.810 1.00 0.00 C ATOM 0 H ALA A 97 6.819 -8.798 3.870 1.00 0.00 H new ATOM 0 HA ALA A 97 7.474 -10.696 1.755 1.00 0.00 H new ATOM 0 HB1 ALA A 97 5.377 -9.817 0.765 1.00 0.00 H new ATOM 0 HB2 ALA A 97 5.137 -10.368 2.440 1.00 0.00 H new ATOM 0 HB3 ALA A 97 5.265 -8.629 2.086 1.00 0.00 H new ATOM 1473 N GLU A 98 8.667 -7.854 1.623 1.00 0.00 N ATOM 1474 CA GLU A 98 9.414 -6.865 0.845 1.00 0.00 C ATOM 1475 C GLU A 98 8.453 -5.995 0.024 1.00 0.00 C ATOM 1476 O GLU A 98 8.685 -5.696 -1.148 1.00 0.00 O ATOM 1477 CB GLU A 98 10.455 -7.561 -0.043 1.00 0.00 C ATOM 1478 CG GLU A 98 11.414 -6.608 -0.741 1.00 0.00 C ATOM 1479 CD GLU A 98 12.629 -7.314 -1.306 1.00 0.00 C ATOM 1480 OE1 GLU A 98 12.477 -8.131 -2.239 1.00 0.00 O ATOM 1481 OE2 GLU A 98 13.748 -7.063 -0.802 1.00 0.00 O ATOM 0 H GLU A 98 8.850 -7.818 2.626 1.00 0.00 H new ATOM 0 HA GLU A 98 9.952 -6.206 1.527 1.00 0.00 H new ATOM 0 HB2 GLU A 98 11.031 -8.256 0.568 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.936 -8.153 -0.797 1.00 0.00 H new ATOM 0 HG2 GLU A 98 10.889 -6.096 -1.547 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.738 -5.843 -0.035 1.00 0.00 H new ATOM 1488 N ILE A 99 7.368 -5.594 0.670 1.00 0.00 N ATOM 1489 CA ILE A 99 6.380 -4.716 0.065 1.00 0.00 C ATOM 1490 C ILE A 99 6.443 -3.340 0.724 1.00 0.00 C ATOM 1491 O ILE A 99 5.799 -3.106 1.747 1.00 0.00 O ATOM 1492 CB ILE A 99 4.947 -5.285 0.178 1.00 0.00 C ATOM 1493 CG1 ILE A 99 4.871 -6.681 -0.451 1.00 0.00 C ATOM 1494 CG2 ILE A 99 3.952 -4.347 -0.493 1.00 0.00 C ATOM 1495 CD1 ILE A 99 3.510 -7.335 -0.321 1.00 0.00 C ATOM 0 H ILE A 99 7.149 -5.868 1.628 1.00 0.00 H new ATOM 0 HA ILE A 99 6.617 -4.634 -0.996 1.00 0.00 H new ATOM 0 HB ILE A 99 4.691 -5.369 1.234 1.00 0.00 H new ATOM 0 HG12 ILE A 99 5.130 -6.608 -1.507 1.00 0.00 H new ATOM 0 HG13 ILE A 99 5.618 -7.322 0.017 1.00 0.00 H new ATOM 0 HG21 ILE A 99 2.947 -4.760 -0.406 1.00 0.00 H new ATOM 0 HG22 ILE A 99 3.987 -3.372 -0.007 1.00 0.00 H new ATOM 0 HG23 ILE A 99 4.209 -4.237 -1.547 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.533 -8.319 -0.789 1.00 0.00 H new ATOM 0 HD12 ILE A 99 3.256 -7.441 0.734 1.00 0.00 H new ATOM 0 HD13 ILE A 99 2.760 -6.716 -0.814 1.00 0.00 H new ATOM 1507 N PRO A 100 7.285 -2.441 0.191 1.00 0.00 N ATOM 1508 CA PRO A 100 7.493 -1.107 0.764 1.00 0.00 C ATOM 1509 C PRO A 100 6.197 -0.310 0.881 1.00 0.00 C ATOM 1510 O PRO A 100 5.548 0.001 -0.123 1.00 0.00 O ATOM 1511 CB PRO A 100 8.451 -0.424 -0.225 1.00 0.00 C ATOM 1512 CG PRO A 100 8.372 -1.237 -1.473 1.00 0.00 C ATOM 1513 CD PRO A 100 8.076 -2.639 -1.030 1.00 0.00 C ATOM 0 HA PRO A 100 7.883 -1.168 1.780 1.00 0.00 H new ATOM 0 HB2 PRO A 100 8.156 0.609 -0.409 1.00 0.00 H new ATOM 0 HB3 PRO A 100 9.468 -0.400 0.165 1.00 0.00 H new ATOM 0 HG2 PRO A 100 7.591 -0.863 -2.134 1.00 0.00 H new ATOM 0 HG3 PRO A 100 9.309 -1.192 -2.029 1.00 0.00 H new ATOM 0 HD2 PRO A 100 7.519 -3.192 -1.786 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.989 -3.201 -0.833 1.00 0.00 H new ATOM 1521 N LEU A 101 5.816 -0.005 2.112 1.00 0.00 N ATOM 1522 CA LEU A 101 4.658 0.833 2.358 1.00 0.00 C ATOM 1523 C LEU A 101 5.090 2.094 3.091 1.00 0.00 C ATOM 1524 O LEU A 101 5.923 2.052 3.999 1.00 0.00 O ATOM 1525 CB LEU A 101 3.563 0.095 3.152 1.00 0.00 C ATOM 1526 CG LEU A 101 3.813 -0.086 4.656 1.00 0.00 C ATOM 1527 CD1 LEU A 101 2.513 -0.428 5.367 1.00 0.00 C ATOM 1528 CD2 LEU A 101 4.843 -1.172 4.914 1.00 0.00 C ATOM 0 H LEU A 101 6.293 -0.326 2.954 1.00 0.00 H new ATOM 0 HA LEU A 101 4.225 1.098 1.394 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.625 0.636 3.025 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.425 -0.891 2.708 1.00 0.00 H new ATOM 0 HG LEU A 101 4.201 0.854 5.047 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.703 -0.554 6.433 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.795 0.378 5.219 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.108 -1.354 4.959 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.999 -1.278 5.988 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.486 -2.117 4.505 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.784 -0.902 4.435 1.00 0.00 H new ATOM 1540 N VAL A 102 4.546 3.216 2.665 1.00 0.00 N ATOM 1541 CA VAL A 102 4.885 4.499 3.253 1.00 0.00 C ATOM 1542 C VAL A 102 3.615 5.282 3.553 1.00 0.00 C ATOM 1543 O VAL A 102 2.546 4.949 3.035 1.00 0.00 O ATOM 1544 CB VAL A 102 5.788 5.331 2.310 1.00 0.00 C ATOM 1545 CG1 VAL A 102 7.043 4.556 1.933 1.00 0.00 C ATOM 1546 CG2 VAL A 102 5.028 5.741 1.061 1.00 0.00 C ATOM 0 H VAL A 102 3.863 3.266 1.909 1.00 0.00 H new ATOM 0 HA VAL A 102 5.433 4.309 4.176 1.00 0.00 H new ATOM 0 HB VAL A 102 6.089 6.232 2.845 1.00 0.00 H new ATOM 0 HG11 VAL A 102 7.660 5.163 1.270 1.00 0.00 H new ATOM 0 HG12 VAL A 102 7.607 4.316 2.834 1.00 0.00 H new ATOM 0 HG13 VAL A 102 6.762 3.634 1.424 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.681 6.325 0.413 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.692 4.850 0.531 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.164 6.343 1.342 1.00 0.00 H new ATOM 1556 N GLU A 103 3.723 6.303 4.391 1.00 0.00 N ATOM 1557 CA GLU A 103 2.579 7.154 4.680 1.00 0.00 C ATOM 1558 C GLU A 103 2.711 8.481 3.936 1.00 0.00 C ATOM 1559 O GLU A 103 3.793 9.071 3.882 1.00 0.00 O ATOM 1560 CB GLU A 103 2.419 7.400 6.191 1.00 0.00 C ATOM 1561 CG GLU A 103 3.518 8.252 6.814 1.00 0.00 C ATOM 1562 CD GLU A 103 3.249 8.589 8.272 1.00 0.00 C ATOM 1563 OE1 GLU A 103 2.249 9.288 8.556 1.00 0.00 O ATOM 1564 OE2 GLU A 103 4.046 8.176 9.143 1.00 0.00 O ATOM 0 H GLU A 103 4.582 6.560 4.878 1.00 0.00 H new ATOM 0 HA GLU A 103 1.683 6.637 4.335 1.00 0.00 H new ATOM 0 HB2 GLU A 103 1.458 7.884 6.367 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.390 6.437 6.702 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.468 7.723 6.738 1.00 0.00 H new ATOM 0 HG3 GLU A 103 3.621 9.176 6.245 1.00 0.00 H new ATOM 1571 N VAL A 104 1.621 8.920 3.329 1.00 0.00 N ATOM 1572 CA VAL A 104 1.584 10.211 2.664 1.00 0.00 C ATOM 1573 C VAL A 104 0.583 11.132 3.349 1.00 0.00 C ATOM 1574 O VAL A 104 -0.554 10.747 3.618 1.00 0.00 O ATOM 1575 CB VAL A 104 1.242 10.084 1.162 1.00 0.00 C ATOM 1576 CG1 VAL A 104 2.392 9.445 0.405 1.00 0.00 C ATOM 1577 CG2 VAL A 104 -0.034 9.286 0.953 1.00 0.00 C ATOM 0 H VAL A 104 0.746 8.398 3.283 1.00 0.00 H new ATOM 0 HA VAL A 104 2.583 10.640 2.739 1.00 0.00 H new ATOM 0 HB VAL A 104 1.080 11.089 0.772 1.00 0.00 H new ATOM 0 HG11 VAL A 104 2.132 9.364 -0.651 1.00 0.00 H new ATOM 0 HG12 VAL A 104 3.285 10.060 0.513 1.00 0.00 H new ATOM 0 HG13 VAL A 104 2.585 8.451 0.808 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.248 9.214 -0.113 1.00 0.00 H new ATOM 0 HG22 VAL A 104 0.091 8.285 1.366 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -0.862 9.785 1.456 1.00 0.00 H new ATOM 1587 N ARG A 105 1.021 12.343 3.643 1.00 0.00 N ATOM 1588 CA ARG A 105 0.184 13.308 4.336 1.00 0.00 C ATOM 1589 C ARG A 105 -0.375 14.326 3.345 1.00 0.00 C ATOM 1590 O ARG A 105 -1.112 15.241 3.714 1.00 0.00 O ATOM 1591 CB ARG A 105 1.002 14.015 5.421 1.00 0.00 C ATOM 1592 CG ARG A 105 0.156 14.700 6.479 1.00 0.00 C ATOM 1593 CD ARG A 105 -0.674 13.689 7.249 1.00 0.00 C ATOM 1594 NE ARG A 105 -1.438 14.314 8.323 1.00 0.00 N ATOM 1595 CZ ARG A 105 -1.839 13.671 9.415 1.00 0.00 C ATOM 1596 NH1 ARG A 105 -1.558 12.385 9.581 1.00 0.00 N ATOM 1597 NH2 ARG A 105 -2.517 14.322 10.352 1.00 0.00 N ATOM 0 H ARG A 105 1.954 12.683 3.412 1.00 0.00 H new ATOM 0 HA ARG A 105 -0.651 12.787 4.805 1.00 0.00 H new ATOM 0 HB2 ARG A 105 1.652 13.286 5.905 1.00 0.00 H new ATOM 0 HB3 ARG A 105 1.648 14.756 4.950 1.00 0.00 H new ATOM 0 HG2 ARG A 105 0.800 15.247 7.167 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -0.500 15.432 6.008 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -1.356 13.184 6.565 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -0.019 12.925 7.667 1.00 0.00 H new ATOM 0 HE ARG A 105 -1.678 15.301 8.231 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -1.030 11.882 8.868 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -1.870 11.899 10.422 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -2.729 15.313 10.233 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -2.826 13.832 11.191 1.00 0.00 H new ATOM 1611 N ASP A 106 -0.036 14.142 2.079 1.00 0.00 N ATOM 1612 CA ASP A 106 -0.401 15.098 1.044 1.00 0.00 C ATOM 1613 C ASP A 106 -1.680 14.671 0.333 1.00 0.00 C ATOM 1614 O ASP A 106 -1.769 13.560 -0.192 1.00 0.00 O ATOM 1615 CB ASP A 106 0.737 15.242 0.037 1.00 0.00 C ATOM 1616 CG ASP A 106 0.510 16.388 -0.916 1.00 0.00 C ATOM 1617 OD1 ASP A 106 -0.163 16.184 -1.942 1.00 0.00 O ATOM 1618 OD2 ASP A 106 0.995 17.504 -0.628 1.00 0.00 O ATOM 0 H ASP A 106 0.493 13.337 1.742 1.00 0.00 H new ATOM 0 HA ASP A 106 -0.581 16.062 1.519 1.00 0.00 H new ATOM 0 HB2 ASP A 106 1.675 15.395 0.570 1.00 0.00 H new ATOM 0 HB3 ASP A 106 0.839 14.316 -0.528 1.00 0.00 H new ATOM 1623 N GLU A 107 -2.672 15.554 0.337 1.00 0.00 N ATOM 1624 CA GLU A 107 -3.955 15.282 -0.291 1.00 0.00 C ATOM 1625 C GLU A 107 -3.844 15.299 -1.812 1.00 0.00 C ATOM 1626 O GLU A 107 -4.534 14.548 -2.503 1.00 0.00 O ATOM 1627 CB GLU A 107 -4.983 16.319 0.162 1.00 0.00 C ATOM 1628 CG GLU A 107 -6.148 15.735 0.943 1.00 0.00 C ATOM 1629 CD GLU A 107 -5.717 15.116 2.255 1.00 0.00 C ATOM 1630 OE1 GLU A 107 -5.386 13.913 2.272 1.00 0.00 O ATOM 1631 OE2 GLU A 107 -5.717 15.830 3.281 1.00 0.00 O ATOM 0 H GLU A 107 -2.608 16.473 0.774 1.00 0.00 H new ATOM 0 HA GLU A 107 -4.276 14.286 0.015 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -4.483 17.065 0.779 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -5.371 16.838 -0.715 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -6.879 16.519 1.138 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -6.646 14.979 0.335 1.00 0.00 H new ATOM 1638 N LYS A 108 -2.956 16.143 -2.326 1.00 0.00 N ATOM 1639 CA LYS A 108 -2.826 16.338 -3.756 1.00 0.00 C ATOM 1640 C LYS A 108 -2.233 15.108 -4.418 1.00 0.00 C ATOM 1641 O LYS A 108 -2.426 14.891 -5.611 1.00 0.00 O ATOM 1642 CB LYS A 108 -1.960 17.555 -4.046 1.00 0.00 C ATOM 1643 CG LYS A 108 -2.500 18.841 -3.451 1.00 0.00 C ATOM 1644 CD LYS A 108 -1.695 20.042 -3.916 1.00 0.00 C ATOM 1645 CE LYS A 108 -1.822 20.247 -5.417 1.00 0.00 C ATOM 1646 NZ LYS A 108 -3.226 20.528 -5.824 1.00 0.00 N ATOM 0 H LYS A 108 -2.314 16.704 -1.765 1.00 0.00 H new ATOM 0 HA LYS A 108 -3.821 16.504 -4.168 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.957 17.378 -3.657 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -1.867 17.675 -5.125 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -3.544 18.967 -3.737 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -2.473 18.781 -2.363 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -2.038 20.936 -3.395 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -0.646 19.903 -3.654 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.183 21.074 -5.725 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -1.465 19.357 -5.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -3.228 21.173 -6.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -3.696 19.638 -6.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -3.735 20.969 -5.032 1.00 0.00 H new ATOM 1660 N PHE A 109 -1.506 14.314 -3.643 1.00 0.00 N ATOM 1661 CA PHE A 109 -0.991 13.045 -4.128 1.00 0.00 C ATOM 1662 C PHE A 109 -2.132 12.196 -4.679 1.00 0.00 C ATOM 1663 O PHE A 109 -2.060 11.702 -5.801 1.00 0.00 O ATOM 1664 CB PHE A 109 -0.260 12.293 -3.010 1.00 0.00 C ATOM 1665 CG PHE A 109 0.156 10.899 -3.392 1.00 0.00 C ATOM 1666 CD1 PHE A 109 1.068 10.687 -4.413 1.00 0.00 C ATOM 1667 CD2 PHE A 109 -0.372 9.800 -2.733 1.00 0.00 C ATOM 1668 CE1 PHE A 109 1.445 9.408 -4.770 1.00 0.00 C ATOM 1669 CE2 PHE A 109 0.004 8.517 -3.084 1.00 0.00 C ATOM 1670 CZ PHE A 109 0.913 8.320 -4.105 1.00 0.00 C ATOM 0 H PHE A 109 -1.261 14.528 -2.676 1.00 0.00 H new ATOM 0 HA PHE A 109 -0.278 13.243 -4.928 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.625 12.860 -2.720 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.907 12.243 -2.134 1.00 0.00 H new ATOM 0 HD1 PHE A 109 1.489 11.533 -4.936 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -1.086 9.948 -1.936 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.156 9.258 -5.569 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -0.413 7.669 -2.560 1.00 0.00 H new ATOM 0 HZ PHE A 109 1.207 7.319 -4.383 1.00 0.00 H new ATOM 1680 N PHE A 110 -3.200 12.068 -3.899 1.00 0.00 N ATOM 1681 CA PHE A 110 -4.355 11.265 -4.297 1.00 0.00 C ATOM 1682 C PHE A 110 -5.177 11.981 -5.361 1.00 0.00 C ATOM 1683 O PHE A 110 -5.846 11.346 -6.181 1.00 0.00 O ATOM 1684 CB PHE A 110 -5.227 10.949 -3.081 1.00 0.00 C ATOM 1685 CG PHE A 110 -4.538 10.088 -2.068 1.00 0.00 C ATOM 1686 CD1 PHE A 110 -4.465 8.717 -2.242 1.00 0.00 C ATOM 1687 CD2 PHE A 110 -3.960 10.649 -0.943 1.00 0.00 C ATOM 1688 CE1 PHE A 110 -3.825 7.921 -1.314 1.00 0.00 C ATOM 1689 CE2 PHE A 110 -3.322 9.860 -0.012 1.00 0.00 C ATOM 1690 CZ PHE A 110 -3.253 8.493 -0.198 1.00 0.00 C ATOM 0 H PHE A 110 -3.292 12.511 -2.985 1.00 0.00 H new ATOM 0 HA PHE A 110 -3.987 10.331 -4.721 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -5.531 11.883 -2.608 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -6.137 10.449 -3.414 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -4.914 8.265 -3.114 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.010 11.717 -0.793 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -3.772 6.852 -1.462 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -2.876 10.310 0.863 1.00 0.00 H new ATOM 0 HZ PHE A 110 -2.751 7.873 0.530 1.00 0.00 H new ATOM 1700 N GLU A 111 -5.125 13.304 -5.334 1.00 0.00 N ATOM 1701 CA GLU A 111 -5.792 14.129 -6.314 1.00 0.00 C ATOM 1702 C GLU A 111 -5.162 13.940 -7.695 1.00 0.00 C ATOM 1703 O GLU A 111 -5.859 13.766 -8.698 1.00 0.00 O ATOM 1704 CB GLU A 111 -5.684 15.590 -5.869 1.00 0.00 C ATOM 1705 CG GLU A 111 -6.343 16.568 -6.807 1.00 0.00 C ATOM 1706 CD GLU A 111 -6.146 18.011 -6.382 1.00 0.00 C ATOM 1707 OE1 GLU A 111 -5.040 18.557 -6.600 1.00 0.00 O ATOM 1708 OE2 GLU A 111 -7.095 18.615 -5.839 1.00 0.00 O ATOM 0 H GLU A 111 -4.615 13.832 -4.626 1.00 0.00 H new ATOM 0 HA GLU A 111 -6.841 13.841 -6.388 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -6.133 15.692 -4.881 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -4.631 15.852 -5.769 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -5.940 16.431 -7.810 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -7.410 16.352 -6.860 1.00 0.00 H new ATOM 1715 N ALA A 112 -3.837 13.948 -7.727 1.00 0.00 N ATOM 1716 CA ALA A 112 -3.092 13.899 -8.976 1.00 0.00 C ATOM 1717 C ALA A 112 -2.906 12.474 -9.488 1.00 0.00 C ATOM 1718 O ALA A 112 -2.982 12.235 -10.696 1.00 0.00 O ATOM 1719 CB ALA A 112 -1.739 14.565 -8.799 1.00 0.00 C ATOM 0 H ALA A 112 -3.251 13.988 -6.893 1.00 0.00 H new ATOM 0 HA ALA A 112 -3.677 14.438 -9.722 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -1.188 14.524 -9.738 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -1.881 15.605 -8.507 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -1.176 14.044 -8.025 1.00 0.00 H new ATOM 1725 N VAL A 113 -2.649 11.533 -8.583 1.00 0.00 N ATOM 1726 CA VAL A 113 -2.371 10.160 -8.990 1.00 0.00 C ATOM 1727 C VAL A 113 -3.601 9.522 -9.641 1.00 0.00 C ATOM 1728 O VAL A 113 -4.711 9.556 -9.096 1.00 0.00 O ATOM 1729 CB VAL A 113 -1.862 9.281 -7.813 1.00 0.00 C ATOM 1730 CG1 VAL A 113 -2.966 8.975 -6.808 1.00 0.00 C ATOM 1731 CG2 VAL A 113 -1.235 7.995 -8.335 1.00 0.00 C ATOM 0 H VAL A 113 -2.628 11.693 -7.576 1.00 0.00 H new ATOM 0 HA VAL A 113 -1.568 10.209 -9.726 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.098 9.854 -7.287 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -2.565 8.359 -6.003 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -3.350 9.907 -6.394 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -3.774 8.440 -7.307 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -0.885 7.394 -7.496 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.977 7.432 -8.900 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.393 8.238 -8.983 1.00 0.00 H new ATOM 1741 N LYS A 114 -3.399 8.971 -10.827 1.00 0.00 N ATOM 1742 CA LYS A 114 -4.471 8.320 -11.562 1.00 0.00 C ATOM 1743 C LYS A 114 -4.083 6.885 -11.872 1.00 0.00 C ATOM 1744 O LYS A 114 -2.947 6.615 -12.274 1.00 0.00 O ATOM 1745 CB LYS A 114 -4.771 9.069 -12.866 1.00 0.00 C ATOM 1746 CG LYS A 114 -5.165 10.524 -12.665 1.00 0.00 C ATOM 1747 CD LYS A 114 -6.383 10.651 -11.767 1.00 0.00 C ATOM 1748 CE LYS A 114 -6.796 12.103 -11.585 1.00 0.00 C ATOM 1749 NZ LYS A 114 -7.946 12.240 -10.656 1.00 0.00 N ATOM 0 H LYS A 114 -2.497 8.962 -11.303 1.00 0.00 H new ATOM 0 HA LYS A 114 -5.369 8.330 -10.944 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.891 9.027 -13.508 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -5.575 8.555 -13.392 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -4.330 11.071 -12.227 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -5.375 10.982 -13.631 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -7.212 10.087 -12.195 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -6.166 10.209 -10.794 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.951 12.676 -11.203 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -7.059 12.530 -12.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -8.712 12.763 -11.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -8.287 11.296 -10.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -7.645 12.757 -9.805 1.00 0.00 H new ATOM 1763 N THR A 115 -5.015 5.968 -11.676 1.00 0.00 N ATOM 1764 CA THR A 115 -4.761 4.570 -11.948 1.00 0.00 C ATOM 1765 C THR A 115 -4.701 4.345 -13.462 1.00 0.00 C ATOM 1766 O THR A 115 -5.681 4.543 -14.179 1.00 0.00 O ATOM 1767 CB THR A 115 -5.823 3.665 -11.264 1.00 0.00 C ATOM 1768 OG1 THR A 115 -5.475 2.281 -11.396 1.00 0.00 O ATOM 1769 CG2 THR A 115 -7.223 3.899 -11.817 1.00 0.00 C ATOM 0 H THR A 115 -5.953 6.170 -11.330 1.00 0.00 H new ATOM 0 HA THR A 115 -3.796 4.291 -11.524 1.00 0.00 H new ATOM 0 HB THR A 115 -5.832 3.936 -10.208 1.00 0.00 H new ATOM 0 HG1 THR A 115 -6.092 1.736 -10.864 1.00 0.00 H new ATOM 0 HG21 THR A 115 -7.930 3.244 -11.308 1.00 0.00 H new ATOM 0 HG22 THR A 115 -7.510 4.938 -11.654 1.00 0.00 H new ATOM 0 HG23 THR A 115 -7.233 3.683 -12.885 1.00 0.00 H new ATOM 1777 N GLY A 116 -3.523 3.983 -13.950 1.00 0.00 N ATOM 1778 CA GLY A 116 -3.337 3.826 -15.377 1.00 0.00 C ATOM 1779 C GLY A 116 -2.024 4.412 -15.856 1.00 0.00 C ATOM 1780 O GLY A 116 -1.559 4.088 -16.946 1.00 0.00 O ATOM 0 H GLY A 116 -2.695 3.796 -13.384 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -3.373 2.767 -15.631 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -4.161 4.308 -15.903 1.00 0.00 H new ATOM 1784 N ASP A 117 -1.438 5.292 -15.051 1.00 0.00 N ATOM 1785 CA ASP A 117 -0.115 5.832 -15.359 1.00 0.00 C ATOM 1786 C ASP A 117 0.932 5.077 -14.552 1.00 0.00 C ATOM 1787 O ASP A 117 0.609 4.077 -13.914 1.00 0.00 O ATOM 1788 CB ASP A 117 -0.042 7.335 -15.073 1.00 0.00 C ATOM 1789 CG ASP A 117 0.611 8.097 -16.214 1.00 0.00 C ATOM 1790 OD1 ASP A 117 1.638 7.618 -16.748 1.00 0.00 O ATOM 1791 OD2 ASP A 117 0.090 9.168 -16.594 1.00 0.00 O ATOM 0 H ASP A 117 -1.852 5.645 -14.188 1.00 0.00 H new ATOM 0 HA ASP A 117 0.080 5.699 -16.423 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -1.047 7.722 -14.906 1.00 0.00 H new ATOM 0 HB3 ASP A 117 0.521 7.503 -14.155 1.00 0.00 H new ATOM 1796 N ARG A 118 2.177 5.531 -14.567 1.00 0.00 N ATOM 1797 CA ARG A 118 3.235 4.797 -13.911 1.00 0.00 C ATOM 1798 C ARG A 118 3.814 5.562 -12.735 1.00 0.00 C ATOM 1799 O ARG A 118 4.046 6.767 -12.808 1.00 0.00 O ATOM 1800 CB ARG A 118 4.330 4.463 -14.909 1.00 0.00 C ATOM 1801 CG ARG A 118 4.023 3.232 -15.740 1.00 0.00 C ATOM 1802 CD ARG A 118 3.864 3.572 -17.209 1.00 0.00 C ATOM 1803 NE ARG A 118 2.904 4.654 -17.433 1.00 0.00 N ATOM 1804 CZ ARG A 118 1.777 4.517 -18.128 1.00 0.00 C ATOM 1805 NH1 ARG A 118 1.382 3.314 -18.532 1.00 0.00 N ATOM 1806 NH2 ARG A 118 1.013 5.576 -18.360 1.00 0.00 N ATOM 0 H ARG A 118 2.472 6.395 -15.022 1.00 0.00 H new ATOM 0 HA ARG A 118 2.804 3.875 -13.520 1.00 0.00 H new ATOM 0 HB2 ARG A 118 4.480 5.314 -15.573 1.00 0.00 H new ATOM 0 HB3 ARG A 118 5.267 4.308 -14.373 1.00 0.00 H new ATOM 0 HG2 ARG A 118 4.824 2.503 -15.620 1.00 0.00 H new ATOM 0 HG3 ARG A 118 3.109 2.764 -15.374 1.00 0.00 H new ATOM 0 HD2 ARG A 118 4.832 3.859 -17.619 1.00 0.00 H new ATOM 0 HD3 ARG A 118 3.539 2.684 -17.751 1.00 0.00 H new ATOM 0 HE ARG A 118 3.111 5.569 -17.032 1.00 0.00 H new ATOM 0 HH11 ARG A 118 1.943 2.492 -18.310 1.00 0.00 H new ATOM 0 HH12 ARG A 118 0.518 3.213 -19.064 1.00 0.00 H new ATOM 0 HH21 ARG A 118 1.290 6.492 -18.006 1.00 0.00 H new ATOM 0 HH22 ARG A 118 0.149 5.475 -18.892 1.00 0.00 H new ATOM 1820 N VAL A 119 4.046 4.845 -11.648 1.00 0.00 N ATOM 1821 CA VAL A 119 4.646 5.436 -10.461 1.00 0.00 C ATOM 1822 C VAL A 119 5.954 4.735 -10.111 1.00 0.00 C ATOM 1823 O VAL A 119 6.019 3.506 -10.058 1.00 0.00 O ATOM 1824 CB VAL A 119 3.695 5.379 -9.241 1.00 0.00 C ATOM 1825 CG1 VAL A 119 4.386 5.886 -7.982 1.00 0.00 C ATOM 1826 CG2 VAL A 119 2.433 6.183 -9.503 1.00 0.00 C ATOM 0 H VAL A 119 3.828 3.852 -11.562 1.00 0.00 H new ATOM 0 HA VAL A 119 4.842 6.482 -10.695 1.00 0.00 H new ATOM 0 HB VAL A 119 3.420 4.336 -9.086 1.00 0.00 H new ATOM 0 HG11 VAL A 119 3.694 5.834 -7.141 1.00 0.00 H new ATOM 0 HG12 VAL A 119 5.259 5.268 -7.772 1.00 0.00 H new ATOM 0 HG13 VAL A 119 4.700 6.919 -8.130 1.00 0.00 H new ATOM 0 HG21 VAL A 119 1.780 6.129 -8.632 1.00 0.00 H new ATOM 0 HG22 VAL A 119 2.697 7.223 -9.694 1.00 0.00 H new ATOM 0 HG23 VAL A 119 1.915 5.775 -10.371 1.00 0.00 H new ATOM 1836 N VAL A 120 6.995 5.525 -9.895 1.00 0.00 N ATOM 1837 CA VAL A 120 8.268 5.005 -9.430 1.00 0.00 C ATOM 1838 C VAL A 120 8.372 5.214 -7.924 1.00 0.00 C ATOM 1839 O VAL A 120 8.454 6.349 -7.450 1.00 0.00 O ATOM 1840 CB VAL A 120 9.461 5.693 -10.132 1.00 0.00 C ATOM 1841 CG1 VAL A 120 10.781 5.096 -9.666 1.00 0.00 C ATOM 1842 CG2 VAL A 120 9.331 5.582 -11.644 1.00 0.00 C ATOM 0 H VAL A 120 6.980 6.535 -10.036 1.00 0.00 H new ATOM 0 HA VAL A 120 8.310 3.943 -9.671 1.00 0.00 H new ATOM 0 HB VAL A 120 9.449 6.749 -9.861 1.00 0.00 H new ATOM 0 HG11 VAL A 120 11.606 5.596 -10.174 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.882 5.232 -8.589 1.00 0.00 H new ATOM 0 HG13 VAL A 120 10.802 4.032 -9.901 1.00 0.00 H new ATOM 0 HG21 VAL A 120 10.181 6.073 -12.119 1.00 0.00 H new ATOM 0 HG22 VAL A 120 9.312 4.531 -11.931 1.00 0.00 H new ATOM 0 HG23 VAL A 120 8.408 6.063 -11.966 1.00 0.00 H new ATOM 1852 N VAL A 121 8.339 4.122 -7.179 1.00 0.00 N ATOM 1853 CA VAL A 121 8.345 4.182 -5.725 1.00 0.00 C ATOM 1854 C VAL A 121 9.755 4.011 -5.174 1.00 0.00 C ATOM 1855 O VAL A 121 10.401 2.989 -5.408 1.00 0.00 O ATOM 1856 CB VAL A 121 7.434 3.095 -5.114 1.00 0.00 C ATOM 1857 CG1 VAL A 121 7.472 3.152 -3.593 1.00 0.00 C ATOM 1858 CG2 VAL A 121 6.010 3.241 -5.624 1.00 0.00 C ATOM 0 H VAL A 121 8.308 3.176 -7.560 1.00 0.00 H new ATOM 0 HA VAL A 121 7.965 5.165 -5.448 1.00 0.00 H new ATOM 0 HB VAL A 121 7.809 2.120 -5.426 1.00 0.00 H new ATOM 0 HG11 VAL A 121 6.823 2.378 -3.184 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.493 2.989 -3.248 1.00 0.00 H new ATOM 0 HG13 VAL A 121 7.127 4.130 -3.257 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.384 2.466 -5.182 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.623 4.222 -5.347 1.00 0.00 H new ATOM 0 HG23 VAL A 121 6.000 3.140 -6.709 1.00 0.00 H new ATOM 1868 N ASN A 122 10.221 5.009 -4.440 1.00 0.00 N ATOM 1869 CA ASN A 122 11.525 4.948 -3.800 1.00 0.00 C ATOM 1870 C ASN A 122 11.372 5.198 -2.304 1.00 0.00 C ATOM 1871 O ASN A 122 11.239 6.340 -1.861 1.00 0.00 O ATOM 1872 CB ASN A 122 12.477 5.971 -4.433 1.00 0.00 C ATOM 1873 CG ASN A 122 13.899 5.873 -3.905 1.00 0.00 C ATOM 1874 OD1 ASN A 122 14.133 5.580 -2.732 1.00 0.00 O ATOM 1875 ND2 ASN A 122 14.862 6.113 -4.777 1.00 0.00 N ATOM 0 H ASN A 122 9.711 5.876 -4.272 1.00 0.00 H new ATOM 0 HA ASN A 122 11.953 3.956 -3.946 1.00 0.00 H new ATOM 0 HB2 ASN A 122 12.487 5.828 -5.514 1.00 0.00 H new ATOM 0 HB3 ASN A 122 12.096 6.975 -4.248 1.00 0.00 H new ATOM 0 HD21 ASN A 122 15.838 6.058 -4.487 1.00 0.00 H new ATOM 0 HD22 ASN A 122 14.629 6.353 -5.741 1.00 0.00 H new ATOM 1882 N ALA A 123 11.374 4.119 -1.533 1.00 0.00 N ATOM 1883 CA ALA A 123 11.189 4.212 -0.092 1.00 0.00 C ATOM 1884 C ALA A 123 12.511 4.466 0.615 1.00 0.00 C ATOM 1885 O ALA A 123 12.540 4.796 1.796 1.00 0.00 O ATOM 1886 CB ALA A 123 10.532 2.950 0.445 1.00 0.00 C ATOM 0 H ALA A 123 11.502 3.169 -1.882 1.00 0.00 H new ATOM 0 HA ALA A 123 10.532 5.058 0.108 1.00 0.00 H new ATOM 0 HB1 ALA A 123 10.402 3.038 1.524 1.00 0.00 H new ATOM 0 HB2 ALA A 123 9.559 2.817 -0.028 1.00 0.00 H new ATOM 0 HB3 ALA A 123 11.163 2.089 0.225 1.00 0.00 H new ATOM 1892 N ASP A 124 13.608 4.323 -0.117 1.00 0.00 N ATOM 1893 CA ASP A 124 14.931 4.567 0.445 1.00 0.00 C ATOM 1894 C ASP A 124 15.099 6.045 0.757 1.00 0.00 C ATOM 1895 O ASP A 124 15.627 6.417 1.809 1.00 0.00 O ATOM 1896 CB ASP A 124 16.033 4.121 -0.519 1.00 0.00 C ATOM 1897 CG ASP A 124 15.995 2.636 -0.812 1.00 0.00 C ATOM 1898 OD1 ASP A 124 16.273 1.837 0.108 1.00 0.00 O ATOM 1899 OD2 ASP A 124 15.706 2.265 -1.969 1.00 0.00 O ATOM 0 H ASP A 124 13.609 4.041 -1.097 1.00 0.00 H new ATOM 0 HA ASP A 124 15.018 3.985 1.363 1.00 0.00 H new ATOM 0 HB2 ASP A 124 15.936 4.673 -1.454 1.00 0.00 H new ATOM 0 HB3 ASP A 124 17.004 4.378 -0.096 1.00 0.00 H new ATOM 1904 N GLU A 125 14.651 6.885 -0.164 1.00 0.00 N ATOM 1905 CA GLU A 125 14.696 8.326 0.030 1.00 0.00 C ATOM 1906 C GLU A 125 13.357 8.838 0.550 1.00 0.00 C ATOM 1907 O GLU A 125 13.285 9.890 1.190 1.00 0.00 O ATOM 1908 CB GLU A 125 15.067 9.029 -1.276 1.00 0.00 C ATOM 1909 CG GLU A 125 16.426 8.620 -1.814 1.00 0.00 C ATOM 1910 CD GLU A 125 16.836 9.414 -3.036 1.00 0.00 C ATOM 1911 OE1 GLU A 125 17.092 10.628 -2.899 1.00 0.00 O ATOM 1912 OE2 GLU A 125 16.927 8.819 -4.129 1.00 0.00 O ATOM 0 H GLU A 125 14.251 6.592 -1.055 1.00 0.00 H new ATOM 0 HA GLU A 125 15.462 8.550 0.773 1.00 0.00 H new ATOM 0 HB2 GLU A 125 14.307 8.811 -2.026 1.00 0.00 H new ATOM 0 HB3 GLU A 125 15.057 10.107 -1.116 1.00 0.00 H new ATOM 0 HG2 GLU A 125 17.175 8.751 -1.033 1.00 0.00 H new ATOM 0 HG3 GLU A 125 16.408 7.559 -2.065 1.00 0.00 H new ATOM 1919 N GLY A 126 12.302 8.084 0.278 1.00 0.00 N ATOM 1920 CA GLY A 126 10.988 8.441 0.774 1.00 0.00 C ATOM 1921 C GLY A 126 10.255 9.385 -0.154 1.00 0.00 C ATOM 1922 O GLY A 126 9.945 10.517 0.218 1.00 0.00 O ATOM 0 H GLY A 126 12.332 7.230 -0.278 1.00 0.00 H new ATOM 0 HA2 GLY A 126 10.396 7.536 0.908 1.00 0.00 H new ATOM 0 HA3 GLY A 126 11.087 8.905 1.755 1.00 0.00 H new ATOM 1926 N TYR A 127 9.973 8.923 -1.366 1.00 0.00 N ATOM 1927 CA TYR A 127 9.250 9.728 -2.334 1.00 0.00 C ATOM 1928 C TYR A 127 8.691 8.844 -3.438 1.00 0.00 C ATOM 1929 O TYR A 127 9.115 7.697 -3.604 1.00 0.00 O ATOM 1930 CB TYR A 127 10.156 10.821 -2.937 1.00 0.00 C ATOM 1931 CG TYR A 127 11.201 10.312 -3.917 1.00 0.00 C ATOM 1932 CD1 TYR A 127 10.875 10.085 -5.251 1.00 0.00 C ATOM 1933 CD2 TYR A 127 12.510 10.065 -3.516 1.00 0.00 C ATOM 1934 CE1 TYR A 127 11.815 9.627 -6.149 1.00 0.00 C ATOM 1935 CE2 TYR A 127 13.458 9.608 -4.417 1.00 0.00 C ATOM 1936 CZ TYR A 127 13.101 9.392 -5.730 1.00 0.00 C ATOM 1937 OH TYR A 127 14.032 8.934 -6.631 1.00 0.00 O ATOM 0 H TYR A 127 10.235 7.995 -1.699 1.00 0.00 H new ATOM 0 HA TYR A 127 8.425 10.219 -1.817 1.00 0.00 H new ATOM 0 HB2 TYR A 127 9.529 11.554 -3.444 1.00 0.00 H new ATOM 0 HB3 TYR A 127 10.663 11.342 -2.125 1.00 0.00 H new ATOM 0 HD1 TYR A 127 9.866 10.271 -5.589 1.00 0.00 H new ATOM 0 HD2 TYR A 127 12.791 10.232 -2.487 1.00 0.00 H new ATOM 0 HE1 TYR A 127 11.541 9.454 -7.179 1.00 0.00 H new ATOM 0 HE2 TYR A 127 14.471 9.422 -4.092 1.00 0.00 H new ATOM 0 HH TYR A 127 13.761 9.187 -7.538 1.00 0.00 H new ATOM 1947 N VAL A 128 7.746 9.379 -4.187 1.00 0.00 N ATOM 1948 CA VAL A 128 7.194 8.682 -5.333 1.00 0.00 C ATOM 1949 C VAL A 128 7.171 9.600 -6.547 1.00 0.00 C ATOM 1950 O VAL A 128 6.661 10.722 -6.486 1.00 0.00 O ATOM 1951 CB VAL A 128 5.768 8.141 -5.058 1.00 0.00 C ATOM 1952 CG1 VAL A 128 5.817 6.970 -4.090 1.00 0.00 C ATOM 1953 CG2 VAL A 128 4.864 9.237 -4.513 1.00 0.00 C ATOM 0 H VAL A 128 7.342 10.301 -4.021 1.00 0.00 H new ATOM 0 HA VAL A 128 7.840 7.827 -5.531 1.00 0.00 H new ATOM 0 HB VAL A 128 5.353 7.795 -6.005 1.00 0.00 H new ATOM 0 HG11 VAL A 128 4.806 6.604 -3.910 1.00 0.00 H new ATOM 0 HG12 VAL A 128 6.421 6.170 -4.517 1.00 0.00 H new ATOM 0 HG13 VAL A 128 6.259 7.295 -3.148 1.00 0.00 H new ATOM 0 HG21 VAL A 128 3.870 8.830 -4.329 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.278 9.620 -3.580 1.00 0.00 H new ATOM 0 HG23 VAL A 128 4.796 10.047 -5.239 1.00 0.00 H new ATOM 1963 N GLU A 129 7.756 9.138 -7.638 1.00 0.00 N ATOM 1964 CA GLU A 129 7.732 9.889 -8.879 1.00 0.00 C ATOM 1965 C GLU A 129 6.636 9.358 -9.790 1.00 0.00 C ATOM 1966 O GLU A 129 6.741 8.255 -10.328 1.00 0.00 O ATOM 1967 CB GLU A 129 9.086 9.827 -9.594 1.00 0.00 C ATOM 1968 CG GLU A 129 10.170 10.665 -8.929 1.00 0.00 C ATOM 1969 CD GLU A 129 11.473 10.685 -9.709 1.00 0.00 C ATOM 1970 OE1 GLU A 129 11.541 11.382 -10.746 1.00 0.00 O ATOM 1971 OE2 GLU A 129 12.440 10.017 -9.285 1.00 0.00 O ATOM 0 H GLU A 129 8.252 8.248 -7.689 1.00 0.00 H new ATOM 0 HA GLU A 129 7.526 10.932 -8.637 1.00 0.00 H new ATOM 0 HB2 GLU A 129 9.417 8.789 -9.637 1.00 0.00 H new ATOM 0 HB3 GLU A 129 8.959 10.164 -10.623 1.00 0.00 H new ATOM 0 HG2 GLU A 129 9.809 11.687 -8.811 1.00 0.00 H new ATOM 0 HG3 GLU A 129 10.359 10.276 -7.929 1.00 0.00 H new ATOM 1978 N LEU A 130 5.575 10.138 -9.932 1.00 0.00 N ATOM 1979 CA LEU A 130 4.509 9.813 -10.864 1.00 0.00 C ATOM 1980 C LEU A 130 4.913 10.275 -12.254 1.00 0.00 C ATOM 1981 O LEU A 130 4.852 11.469 -12.561 1.00 0.00 O ATOM 1982 CB LEU A 130 3.191 10.473 -10.434 1.00 0.00 C ATOM 1983 CG LEU A 130 2.022 10.319 -11.417 1.00 0.00 C ATOM 1984 CD1 LEU A 130 1.653 8.858 -11.600 1.00 0.00 C ATOM 1985 CD2 LEU A 130 0.819 11.114 -10.937 1.00 0.00 C ATOM 0 H LEU A 130 5.430 11.003 -9.411 1.00 0.00 H new ATOM 0 HA LEU A 130 4.350 8.735 -10.872 1.00 0.00 H new ATOM 0 HB2 LEU A 130 2.892 10.054 -9.473 1.00 0.00 H new ATOM 0 HB3 LEU A 130 3.372 11.536 -10.276 1.00 0.00 H new ATOM 0 HG LEU A 130 2.338 10.711 -12.384 1.00 0.00 H new ATOM 0 HD11 LEU A 130 0.822 8.778 -12.301 1.00 0.00 H new ATOM 0 HD12 LEU A 130 2.512 8.312 -11.991 1.00 0.00 H new ATOM 0 HD13 LEU A 130 1.360 8.434 -10.640 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -0.002 10.995 -11.644 1.00 0.00 H new ATOM 0 HD22 LEU A 130 0.509 10.750 -9.957 1.00 0.00 H new ATOM 0 HD23 LEU A 130 1.085 12.169 -10.864 1.00 0.00 H new ATOM 1997 N ILE A 131 5.346 9.337 -13.083 1.00 0.00 N ATOM 1998 CA ILE A 131 5.842 9.681 -14.397 1.00 0.00 C ATOM 1999 C ILE A 131 4.722 9.613 -15.416 1.00 0.00 C ATOM 2000 O ILE A 131 4.221 8.538 -15.750 1.00 0.00 O ATOM 2001 CB ILE A 131 7.023 8.780 -14.829 1.00 0.00 C ATOM 2002 CG1 ILE A 131 6.690 7.298 -14.625 1.00 0.00 C ATOM 2003 CG2 ILE A 131 8.280 9.158 -14.059 1.00 0.00 C ATOM 2004 CD1 ILE A 131 7.758 6.354 -15.136 1.00 0.00 C ATOM 0 H ILE A 131 5.362 8.340 -12.867 1.00 0.00 H new ATOM 0 HA ILE A 131 6.218 10.703 -14.346 1.00 0.00 H new ATOM 0 HB ILE A 131 7.202 8.938 -15.893 1.00 0.00 H new ATOM 0 HG12 ILE A 131 6.534 7.114 -13.562 1.00 0.00 H new ATOM 0 HG13 ILE A 131 5.750 7.074 -15.129 1.00 0.00 H new ATOM 0 HG21 ILE A 131 9.105 8.517 -14.371 1.00 0.00 H new ATOM 0 HG22 ILE A 131 8.532 10.199 -14.262 1.00 0.00 H new ATOM 0 HG23 ILE A 131 8.105 9.029 -12.991 1.00 0.00 H new ATOM 0 HD11 ILE A 131 7.450 5.324 -14.956 1.00 0.00 H new ATOM 0 HD12 ILE A 131 7.899 6.509 -16.206 1.00 0.00 H new ATOM 0 HD13 ILE A 131 8.695 6.549 -14.615 1.00 0.00 H new ATOM 2016 N GLU A 132 4.330 10.776 -15.892 1.00 0.00 N ATOM 2017 CA GLU A 132 3.232 10.885 -16.826 1.00 0.00 C ATOM 2018 C GLU A 132 3.701 10.534 -18.224 1.00 0.00 C ATOM 2019 O GLU A 132 4.274 11.377 -18.921 1.00 0.00 O ATOM 2020 CB GLU A 132 2.675 12.306 -16.816 1.00 0.00 C ATOM 2021 CG GLU A 132 2.366 12.822 -15.425 1.00 0.00 C ATOM 2022 CD GLU A 132 2.050 14.299 -15.416 1.00 0.00 C ATOM 2023 OE1 GLU A 132 2.963 15.108 -15.684 1.00 0.00 O ATOM 2024 OE2 GLU A 132 0.895 14.661 -15.117 1.00 0.00 O ATOM 0 H GLU A 132 4.761 11.667 -15.644 1.00 0.00 H new ATOM 0 HA GLU A 132 2.448 10.190 -16.526 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.394 12.973 -17.292 1.00 0.00 H new ATOM 0 HB3 GLU A 132 1.766 12.336 -17.417 1.00 0.00 H new ATOM 0 HG2 GLU A 132 1.520 12.270 -15.015 1.00 0.00 H new ATOM 0 HG3 GLU A 132 3.218 12.631 -14.772 1.00 0.00 H new