USER MOD reduce.3.24.130724 H: found=0, std=0, add=884, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 882 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -159:sc= 0.0127 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc=-0.00283 K(o=-0.0028,f=-2.8!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= -0.739 K(o=-0.74,f=0.052) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 22 THR OG1 : rot 29:sc= 0.228 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= -0.737 USER MOD Single : A 28 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 96:sc= 0.118 USER MOD Single : A 36 HIS : no HD1:sc= -0.376 X(o=-0.38,f=-0.84!) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 HIS : no HE2:sc= -0.419 K(o=-0.42,f=-2.3) USER MOD Single : A 59 CYS SG : rot -170:sc= -1.93 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.294 K(o=-0.29,f=-0.98) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.484 K(o=-0.48,f=-3.1!) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ -133:sc= -0.552 (180deg=-2.55!) USER MOD Single : A 85 LYS NZ :NH3+ -149:sc= -0.555 (180deg=-1.88!) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.0744 USER MOD Single : A 95 TYR OH : rot -97:sc= 0.336 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -26.851 -43.313 4.578 1.00 0.00 N ATOM 2 CA MET A 1 -26.323 -42.929 5.917 1.00 0.00 C ATOM 3 C MET A 1 -26.277 -41.403 6.029 1.00 0.00 C ATOM 4 O MET A 1 -26.918 -40.697 5.277 1.00 0.00 O ATOM 5 CB MET A 1 -24.910 -43.495 6.089 1.00 0.00 C ATOM 6 CG MET A 1 -24.871 -44.407 7.315 1.00 0.00 C ATOM 7 SD MET A 1 -25.067 -46.129 6.794 1.00 0.00 S ATOM 8 CE MET A 1 -24.455 -46.897 8.313 1.00 0.00 C ATOM 0 H1 MET A 1 -27.215 -44.286 4.615 1.00 0.00 H new ATOM 0 H2 MET A 1 -27.619 -42.666 4.309 1.00 0.00 H new ATOM 0 H3 MET A 1 -26.087 -43.256 3.874 1.00 0.00 H new ATOM 0 HA MET A 1 -26.974 -43.331 6.693 1.00 0.00 H new ATOM 0 HB2 MET A 1 -24.619 -44.053 5.199 1.00 0.00 H new ATOM 0 HB3 MET A 1 -24.193 -42.682 6.204 1.00 0.00 H new ATOM 0 HG2 MET A 1 -23.927 -44.282 7.845 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.665 -44.134 8.010 1.00 0.00 H new ATOM 0 HE1 MET A 1 -24.488 -47.982 8.211 1.00 0.00 H new ATOM 0 HE2 MET A 1 -23.427 -46.581 8.492 1.00 0.00 H new ATOM 0 HE3 MET A 1 -25.080 -46.592 9.152 1.00 0.00 H new ATOM 20 N THR A 2 -25.522 -40.891 6.962 1.00 0.00 N ATOM 21 CA THR A 2 -25.434 -39.413 7.122 1.00 0.00 C ATOM 22 C THR A 2 -23.965 -38.987 7.135 1.00 0.00 C ATOM 23 O THR A 2 -23.632 -37.879 7.502 1.00 0.00 O ATOM 24 CB THR A 2 -26.095 -39.000 8.439 1.00 0.00 C ATOM 25 OG1 THR A 2 -27.248 -39.802 8.660 1.00 0.00 O ATOM 26 CG2 THR A 2 -26.499 -37.527 8.369 1.00 0.00 C ATOM 0 H THR A 2 -24.962 -41.433 7.620 1.00 0.00 H new ATOM 0 HA THR A 2 -25.946 -38.928 6.291 1.00 0.00 H new ATOM 0 HB THR A 2 -25.392 -39.141 9.260 1.00 0.00 H new ATOM 0 HG1 THR A 2 -27.672 -39.540 9.504 1.00 0.00 H new ATOM 0 HG21 THR A 2 -26.970 -37.234 9.307 1.00 0.00 H new ATOM 0 HG22 THR A 2 -25.613 -36.914 8.200 1.00 0.00 H new ATOM 0 HG23 THR A 2 -27.202 -37.381 7.549 1.00 0.00 H new ATOM 34 N VAL A 3 -23.081 -39.861 6.736 1.00 0.00 N ATOM 35 CA VAL A 3 -21.635 -39.506 6.728 1.00 0.00 C ATOM 36 C VAL A 3 -21.052 -39.764 5.338 1.00 0.00 C ATOM 37 O VAL A 3 -20.914 -40.893 4.912 1.00 0.00 O ATOM 38 CB VAL A 3 -20.894 -40.360 7.758 1.00 0.00 C ATOM 39 CG1 VAL A 3 -19.419 -39.960 7.785 1.00 0.00 C ATOM 40 CG2 VAL A 3 -21.508 -40.133 9.142 1.00 0.00 C ATOM 0 H VAL A 3 -23.298 -40.805 6.416 1.00 0.00 H new ATOM 0 HA VAL A 3 -21.520 -38.452 6.979 1.00 0.00 H new ATOM 0 HB VAL A 3 -20.980 -41.413 7.488 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -18.890 -40.568 8.519 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -18.981 -40.118 6.799 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -19.332 -38.908 8.056 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -20.981 -40.741 9.878 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -21.420 -39.080 9.411 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -22.560 -40.416 9.124 1.00 0.00 H new ATOM 50 N ILE A 4 -20.706 -38.726 4.627 1.00 0.00 N ATOM 51 CA ILE A 4 -20.129 -38.914 3.267 1.00 0.00 C ATOM 52 C ILE A 4 -18.620 -38.670 3.316 1.00 0.00 C ATOM 53 O ILE A 4 -18.167 -37.575 3.586 1.00 0.00 O ATOM 54 CB ILE A 4 -20.774 -37.924 2.295 1.00 0.00 C ATOM 55 CG1 ILE A 4 -22.278 -37.847 2.570 1.00 0.00 C ATOM 56 CG2 ILE A 4 -20.543 -38.395 0.859 1.00 0.00 C ATOM 57 CD1 ILE A 4 -22.620 -36.474 3.151 1.00 0.00 C ATOM 0 H ILE A 4 -20.798 -37.756 4.929 1.00 0.00 H new ATOM 0 HA ILE A 4 -20.323 -39.932 2.929 1.00 0.00 H new ATOM 0 HB ILE A 4 -20.328 -36.939 2.430 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -22.836 -38.013 1.649 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -22.572 -38.632 3.267 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -21.002 -37.690 0.166 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -19.472 -38.451 0.662 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -20.989 -39.380 0.723 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -23.691 -36.418 3.347 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -22.072 -36.326 4.082 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -22.341 -35.698 2.439 1.00 0.00 H new ATOM 69 N LYS A 5 -17.838 -39.680 3.057 1.00 0.00 N ATOM 70 CA LYS A 5 -16.360 -39.505 3.090 1.00 0.00 C ATOM 71 C LYS A 5 -15.736 -40.215 1.883 1.00 0.00 C ATOM 72 O LYS A 5 -15.552 -41.415 1.902 1.00 0.00 O ATOM 73 CB LYS A 5 -15.803 -40.115 4.378 1.00 0.00 C ATOM 74 CG LYS A 5 -14.656 -39.246 4.900 1.00 0.00 C ATOM 75 CD LYS A 5 -15.224 -38.093 5.731 1.00 0.00 C ATOM 76 CE LYS A 5 -14.518 -36.791 5.347 1.00 0.00 C ATOM 77 NZ LYS A 5 -15.501 -35.672 5.357 1.00 0.00 N ATOM 0 H LYS A 5 -18.159 -40.620 2.824 1.00 0.00 H new ATOM 0 HA LYS A 5 -16.119 -38.442 3.055 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -16.590 -40.187 5.129 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -15.449 -41.128 4.190 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -13.979 -39.846 5.507 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -14.074 -38.854 4.066 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -16.297 -38.002 5.560 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -15.086 -38.294 6.793 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -13.708 -36.584 6.046 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -14.069 -36.886 4.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -15.022 -34.787 5.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -16.259 -35.870 4.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -15.909 -35.577 6.309 1.00 0.00 H new ATOM 91 N PRO A 6 -15.425 -39.449 0.866 1.00 0.00 N ATOM 92 CA PRO A 6 -14.816 -39.982 -0.364 1.00 0.00 C ATOM 93 C PRO A 6 -13.330 -40.268 -0.136 1.00 0.00 C ATOM 94 O PRO A 6 -12.642 -39.524 0.536 1.00 0.00 O ATOM 95 CB PRO A 6 -15.013 -38.854 -1.382 1.00 0.00 C ATOM 96 CG PRO A 6 -15.203 -37.556 -0.562 1.00 0.00 C ATOM 97 CD PRO A 6 -15.648 -37.989 0.849 1.00 0.00 C ATOM 0 HA PRO A 6 -15.258 -40.922 -0.694 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -14.151 -38.773 -2.044 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -15.881 -39.046 -2.012 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -14.275 -36.986 -0.518 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -15.951 -36.912 -1.024 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -15.065 -37.488 1.622 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -16.695 -37.744 1.030 1.00 0.00 H new ATOM 105 N SER A 7 -12.831 -41.343 -0.680 1.00 0.00 N ATOM 106 CA SER A 7 -11.392 -41.674 -0.483 1.00 0.00 C ATOM 107 C SER A 7 -11.168 -42.074 0.977 1.00 0.00 C ATOM 108 O SER A 7 -11.860 -41.620 1.866 1.00 0.00 O ATOM 109 CB SER A 7 -10.537 -40.451 -0.816 1.00 0.00 C ATOM 110 OG SER A 7 -9.185 -40.856 -0.984 1.00 0.00 O ATOM 0 H SER A 7 -13.356 -42.005 -1.251 1.00 0.00 H new ATOM 0 HA SER A 7 -11.110 -42.499 -1.138 1.00 0.00 H new ATOM 0 HB2 SER A 7 -10.902 -39.974 -1.726 1.00 0.00 H new ATOM 0 HB3 SER A 7 -10.611 -39.713 -0.018 1.00 0.00 H new ATOM 0 HG SER A 7 -8.634 -40.075 -1.199 1.00 0.00 H new ATOM 116 N SER A 8 -10.211 -42.922 1.235 1.00 0.00 N ATOM 117 CA SER A 8 -9.955 -43.347 2.639 1.00 0.00 C ATOM 118 C SER A 8 -8.538 -42.945 3.051 1.00 0.00 C ATOM 119 O SER A 8 -7.673 -42.737 2.222 1.00 0.00 O ATOM 120 CB SER A 8 -10.103 -44.865 2.748 1.00 0.00 C ATOM 121 OG SER A 8 -11.338 -45.259 2.163 1.00 0.00 O ATOM 0 H SER A 8 -9.596 -43.338 0.535 1.00 0.00 H new ATOM 0 HA SER A 8 -10.675 -42.861 3.298 1.00 0.00 H new ATOM 0 HB2 SER A 8 -9.274 -45.360 2.243 1.00 0.00 H new ATOM 0 HB3 SER A 8 -10.068 -45.171 3.793 1.00 0.00 H new ATOM 0 HG SER A 8 -11.436 -46.232 2.229 1.00 0.00 H new ATOM 127 N ARG A 9 -8.292 -42.835 4.329 1.00 0.00 N ATOM 128 CA ARG A 9 -6.932 -42.451 4.799 1.00 0.00 C ATOM 129 C ARG A 9 -6.669 -43.100 6.161 1.00 0.00 C ATOM 130 O ARG A 9 -6.676 -42.432 7.177 1.00 0.00 O ATOM 131 CB ARG A 9 -6.847 -40.928 4.937 1.00 0.00 C ATOM 132 CG ARG A 9 -8.069 -40.414 5.699 1.00 0.00 C ATOM 133 CD ARG A 9 -7.898 -38.922 5.992 1.00 0.00 C ATOM 134 NE ARG A 9 -8.661 -38.566 7.223 1.00 0.00 N ATOM 135 CZ ARG A 9 -8.182 -38.871 8.398 1.00 0.00 C ATOM 136 NH1 ARG A 9 -6.930 -38.630 8.675 1.00 0.00 N ATOM 137 NH2 ARG A 9 -8.956 -39.417 9.294 1.00 0.00 N ATOM 0 H ARG A 9 -8.976 -42.995 5.068 1.00 0.00 H new ATOM 0 HA ARG A 9 -6.188 -42.790 4.079 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -5.934 -40.651 5.464 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -6.799 -40.465 3.951 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -8.973 -40.579 5.112 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -8.189 -40.967 6.631 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -6.842 -38.685 6.125 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -8.254 -38.332 5.148 1.00 0.00 H new ATOM 0 HE ARG A 9 -9.557 -38.084 7.147 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -6.325 -38.203 7.973 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -6.556 -38.868 9.593 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -9.935 -39.605 9.076 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -8.583 -39.656 10.213 1.00 0.00 H new ATOM 151 N PRO A 10 -6.447 -44.390 6.139 1.00 0.00 N ATOM 152 CA PRO A 10 -6.180 -45.170 7.360 1.00 0.00 C ATOM 153 C PRO A 10 -4.738 -44.958 7.827 1.00 0.00 C ATOM 154 O PRO A 10 -4.481 -44.244 8.775 1.00 0.00 O ATOM 155 CB PRO A 10 -6.405 -46.618 6.917 1.00 0.00 C ATOM 156 CG PRO A 10 -6.226 -46.636 5.381 1.00 0.00 C ATOM 157 CD PRO A 10 -6.437 -45.188 4.897 1.00 0.00 C ATOM 0 HA PRO A 10 -6.814 -44.883 8.199 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -5.692 -47.287 7.399 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -7.402 -46.959 7.196 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -5.233 -46.994 5.111 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -6.945 -47.309 4.915 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -5.638 -44.872 4.227 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -7.373 -45.084 4.349 1.00 0.00 H new ATOM 165 N ARG A 11 -3.795 -45.575 7.169 1.00 0.00 N ATOM 166 CA ARG A 11 -2.372 -45.408 7.578 1.00 0.00 C ATOM 167 C ARG A 11 -1.491 -45.278 6.331 1.00 0.00 C ATOM 168 O ARG A 11 -1.870 -45.705 5.258 1.00 0.00 O ATOM 169 CB ARG A 11 -1.930 -46.629 8.389 1.00 0.00 C ATOM 170 CG ARG A 11 -2.254 -46.405 9.868 1.00 0.00 C ATOM 171 CD ARG A 11 -1.264 -47.187 10.733 1.00 0.00 C ATOM 172 NE ARG A 11 -0.445 -46.237 11.537 1.00 0.00 N ATOM 173 CZ ARG A 11 -0.027 -46.578 12.725 1.00 0.00 C ATOM 174 NH1 ARG A 11 0.247 -47.826 12.989 1.00 0.00 N ATOM 175 NH2 ARG A 11 0.117 -45.670 13.652 1.00 0.00 N ATOM 0 H ARG A 11 -3.948 -46.187 6.367 1.00 0.00 H new ATOM 0 HA ARG A 11 -2.272 -44.509 8.187 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -2.437 -47.523 8.026 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -0.860 -46.796 8.261 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -2.200 -45.343 10.106 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -3.273 -46.728 10.081 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -1.801 -47.869 11.393 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -0.617 -47.797 10.102 1.00 0.00 H new ATOM 0 HE ARG A 11 -0.211 -45.319 11.158 1.00 0.00 H new ATOM 0 HH11 ARG A 11 0.135 -48.537 12.266 1.00 0.00 H new ATOM 0 HH12 ARG A 11 0.574 -48.091 13.918 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -0.097 -44.694 13.448 1.00 0.00 H new ATOM 0 HH22 ARG A 11 0.444 -45.937 14.581 1.00 0.00 H new ATOM 189 N PRO A 12 -0.337 -44.689 6.515 1.00 0.00 N ATOM 190 CA PRO A 12 0.634 -44.480 5.426 1.00 0.00 C ATOM 191 C PRO A 12 1.393 -45.777 5.123 1.00 0.00 C ATOM 192 O PRO A 12 1.415 -46.695 5.918 1.00 0.00 O ATOM 193 CB PRO A 12 1.580 -43.414 5.987 1.00 0.00 C ATOM 194 CG PRO A 12 1.451 -43.483 7.527 1.00 0.00 C ATOM 195 CD PRO A 12 0.108 -44.174 7.827 1.00 0.00 C ATOM 0 HA PRO A 12 0.165 -44.179 4.489 1.00 0.00 H new ATOM 0 HB2 PRO A 12 2.607 -43.603 5.674 1.00 0.00 H new ATOM 0 HB3 PRO A 12 1.312 -42.424 5.619 1.00 0.00 H new ATOM 0 HG2 PRO A 12 2.280 -44.043 7.960 1.00 0.00 H new ATOM 0 HG3 PRO A 12 1.479 -42.484 7.963 1.00 0.00 H new ATOM 0 HD2 PRO A 12 0.228 -44.980 8.551 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -0.615 -43.474 8.246 1.00 0.00 H new ATOM 203 N ARG A 13 2.015 -45.855 3.979 1.00 0.00 N ATOM 204 CA ARG A 13 2.773 -47.086 3.624 1.00 0.00 C ATOM 205 C ARG A 13 4.174 -46.699 3.140 1.00 0.00 C ATOM 206 O ARG A 13 4.548 -46.962 2.015 1.00 0.00 O ATOM 207 CB ARG A 13 2.037 -47.834 2.510 1.00 0.00 C ATOM 208 CG ARG A 13 1.584 -49.201 3.026 1.00 0.00 C ATOM 209 CD ARG A 13 2.710 -50.218 2.837 1.00 0.00 C ATOM 210 NE ARG A 13 3.648 -50.140 3.992 1.00 0.00 N ATOM 211 CZ ARG A 13 3.727 -51.132 4.838 1.00 0.00 C ATOM 212 NH1 ARG A 13 3.829 -52.357 4.399 1.00 0.00 N ATOM 213 NH2 ARG A 13 3.705 -50.898 6.121 1.00 0.00 N ATOM 0 H ARG A 13 2.031 -45.118 3.274 1.00 0.00 H new ATOM 0 HA ARG A 13 2.855 -47.729 4.500 1.00 0.00 H new ATOM 0 HB2 ARG A 13 1.175 -47.256 2.177 1.00 0.00 H new ATOM 0 HB3 ARG A 13 2.691 -47.958 1.647 1.00 0.00 H new ATOM 0 HG2 ARG A 13 1.315 -49.132 4.080 1.00 0.00 H new ATOM 0 HG3 ARG A 13 0.692 -49.526 2.490 1.00 0.00 H new ATOM 0 HD2 ARG A 13 2.297 -51.224 2.757 1.00 0.00 H new ATOM 0 HD3 ARG A 13 3.243 -50.018 1.908 1.00 0.00 H new ATOM 0 HE ARG A 13 4.229 -49.312 4.122 1.00 0.00 H new ATOM 0 HH11 ARG A 13 3.847 -52.539 3.396 1.00 0.00 H new ATOM 0 HH12 ARG A 13 3.891 -53.132 5.059 1.00 0.00 H new ATOM 0 HH21 ARG A 13 3.626 -49.940 6.463 1.00 0.00 H new ATOM 0 HH22 ARG A 13 3.767 -51.673 6.782 1.00 0.00 H new ATOM 227 N LYS A 14 4.950 -46.074 3.984 1.00 0.00 N ATOM 228 CA LYS A 14 6.324 -45.667 3.574 1.00 0.00 C ATOM 229 C LYS A 14 6.238 -44.708 2.385 1.00 0.00 C ATOM 230 O LYS A 14 6.206 -45.122 1.243 1.00 0.00 O ATOM 231 CB LYS A 14 7.128 -46.907 3.174 1.00 0.00 C ATOM 232 CG LYS A 14 7.938 -47.400 4.375 1.00 0.00 C ATOM 233 CD LYS A 14 9.246 -48.027 3.888 1.00 0.00 C ATOM 234 CE LYS A 14 10.404 -47.538 4.761 1.00 0.00 C ATOM 235 NZ LYS A 14 10.963 -48.684 5.532 1.00 0.00 N ATOM 0 H LYS A 14 4.692 -45.828 4.940 1.00 0.00 H new ATOM 0 HA LYS A 14 6.819 -45.169 4.408 1.00 0.00 H new ATOM 0 HB2 LYS A 14 6.456 -47.693 2.828 1.00 0.00 H new ATOM 0 HB3 LYS A 14 7.795 -46.669 2.345 1.00 0.00 H new ATOM 0 HG2 LYS A 14 8.149 -46.570 5.049 1.00 0.00 H new ATOM 0 HG3 LYS A 14 7.361 -48.131 4.941 1.00 0.00 H new ATOM 0 HD2 LYS A 14 9.178 -49.114 3.931 1.00 0.00 H new ATOM 0 HD3 LYS A 14 9.424 -47.760 2.846 1.00 0.00 H new ATOM 0 HE2 LYS A 14 11.180 -47.092 4.139 1.00 0.00 H new ATOM 0 HE3 LYS A 14 10.057 -46.762 5.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 11.750 -48.352 6.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 10.221 -49.091 6.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 11.309 -49.410 4.873 1.00 0.00 H new ATOM 249 N ASN A 15 6.202 -43.430 2.644 1.00 0.00 N ATOM 250 CA ASN A 15 6.118 -42.444 1.530 1.00 0.00 C ATOM 251 C ASN A 15 7.153 -42.794 0.458 1.00 0.00 C ATOM 252 O ASN A 15 8.259 -43.198 0.758 1.00 0.00 O ATOM 253 CB ASN A 15 6.398 -41.040 2.070 1.00 0.00 C ATOM 254 CG ASN A 15 5.517 -40.026 1.337 1.00 0.00 C ATOM 255 OD1 ASN A 15 5.294 -40.144 0.149 1.00 0.00 O ATOM 256 ND2 ASN A 15 5.002 -39.028 2.002 1.00 0.00 N ATOM 0 H ASN A 15 6.227 -43.025 3.580 1.00 0.00 H new ATOM 0 HA ASN A 15 5.120 -42.474 1.094 1.00 0.00 H new ATOM 0 HB2 ASN A 15 6.198 -41.004 3.141 1.00 0.00 H new ATOM 0 HB3 ASN A 15 7.450 -40.789 1.933 1.00 0.00 H new ATOM 0 HD21 ASN A 15 4.412 -38.347 1.524 1.00 0.00 H new ATOM 0 HD22 ASN A 15 5.189 -38.929 3.000 1.00 0.00 H new ATOM 263 N LYS A 16 6.803 -42.641 -0.790 1.00 0.00 N ATOM 264 CA LYS A 16 7.767 -42.963 -1.879 1.00 0.00 C ATOM 265 C LYS A 16 9.094 -42.250 -1.609 1.00 0.00 C ATOM 266 O LYS A 16 9.122 -41.115 -1.179 1.00 0.00 O ATOM 267 CB LYS A 16 7.198 -42.495 -3.220 1.00 0.00 C ATOM 268 CG LYS A 16 5.847 -43.170 -3.465 1.00 0.00 C ATOM 269 CD LYS A 16 6.072 -44.607 -3.937 1.00 0.00 C ATOM 270 CE LYS A 16 5.004 -45.518 -3.327 1.00 0.00 C ATOM 271 NZ LYS A 16 5.392 -46.943 -3.527 1.00 0.00 N ATOM 0 H LYS A 16 5.891 -42.307 -1.102 1.00 0.00 H new ATOM 0 HA LYS A 16 7.933 -44.040 -1.913 1.00 0.00 H new ATOM 0 HB2 LYS A 16 7.080 -41.411 -3.219 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.890 -42.739 -4.026 1.00 0.00 H new ATOM 0 HG2 LYS A 16 5.255 -43.165 -2.550 1.00 0.00 H new ATOM 0 HG3 LYS A 16 5.282 -42.615 -4.213 1.00 0.00 H new ATOM 0 HD2 LYS A 16 6.028 -44.655 -5.025 1.00 0.00 H new ATOM 0 HD3 LYS A 16 7.065 -44.946 -3.643 1.00 0.00 H new ATOM 0 HE2 LYS A 16 4.894 -45.306 -2.263 1.00 0.00 H new ATOM 0 HE3 LYS A 16 4.037 -45.325 -3.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 4.666 -47.562 -3.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 5.475 -47.141 -4.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 6.306 -47.122 -3.064 1.00 0.00 H new ATOM 285 N ASN A 17 10.194 -42.907 -1.856 1.00 0.00 N ATOM 286 CA ASN A 17 11.516 -42.265 -1.611 1.00 0.00 C ATOM 287 C ASN A 17 11.529 -40.868 -2.235 1.00 0.00 C ATOM 288 O ASN A 17 11.508 -40.716 -3.440 1.00 0.00 O ATOM 289 CB ASN A 17 12.621 -43.117 -2.238 1.00 0.00 C ATOM 290 CG ASN A 17 13.956 -42.793 -1.566 1.00 0.00 C ATOM 291 OD1 ASN A 17 14.643 -41.872 -1.964 1.00 0.00 O ATOM 292 ND2 ASN A 17 14.356 -43.517 -0.556 1.00 0.00 N ATOM 0 H ASN A 17 10.234 -43.860 -2.217 1.00 0.00 H new ATOM 0 HA ASN A 17 11.687 -42.183 -0.538 1.00 0.00 H new ATOM 0 HB2 ASN A 17 12.390 -44.176 -2.121 1.00 0.00 H new ATOM 0 HB3 ASN A 17 12.683 -42.921 -3.308 1.00 0.00 H new ATOM 0 HD21 ASN A 17 15.245 -43.310 -0.101 1.00 0.00 H new ATOM 0 HD22 ASN A 17 13.780 -44.290 -0.222 1.00 0.00 H new ATOM 299 N ILE A 18 11.563 -39.846 -1.423 1.00 0.00 N ATOM 300 CA ILE A 18 11.576 -38.460 -1.969 1.00 0.00 C ATOM 301 C ILE A 18 12.952 -38.153 -2.563 1.00 0.00 C ATOM 302 O ILE A 18 13.107 -37.250 -3.361 1.00 0.00 O ATOM 303 CB ILE A 18 11.274 -37.467 -0.845 1.00 0.00 C ATOM 304 CG1 ILE A 18 11.164 -36.056 -1.429 1.00 0.00 C ATOM 305 CG2 ILE A 18 12.401 -37.505 0.189 1.00 0.00 C ATOM 306 CD1 ILE A 18 10.907 -35.055 -0.301 1.00 0.00 C ATOM 0 H ILE A 18 11.582 -39.912 -0.405 1.00 0.00 H new ATOM 0 HA ILE A 18 10.819 -38.372 -2.748 1.00 0.00 H new ATOM 0 HB ILE A 18 10.334 -37.737 -0.365 1.00 0.00 H new ATOM 0 HG12 ILE A 18 12.082 -35.797 -1.957 1.00 0.00 H new ATOM 0 HG13 ILE A 18 10.354 -36.015 -2.158 1.00 0.00 H new ATOM 0 HG21 ILE A 18 12.185 -36.797 0.989 1.00 0.00 H new ATOM 0 HG22 ILE A 18 12.480 -38.510 0.605 1.00 0.00 H new ATOM 0 HG23 ILE A 18 13.343 -37.235 -0.289 1.00 0.00 H new ATOM 0 HD11 ILE A 18 10.829 -34.050 -0.717 1.00 0.00 H new ATOM 0 HD12 ILE A 18 9.977 -35.311 0.208 1.00 0.00 H new ATOM 0 HD13 ILE A 18 11.732 -35.090 0.411 1.00 0.00 H new ATOM 318 N LYS A 19 13.955 -38.895 -2.179 1.00 0.00 N ATOM 319 CA LYS A 19 15.319 -38.641 -2.723 1.00 0.00 C ATOM 320 C LYS A 19 15.549 -39.510 -3.961 1.00 0.00 C ATOM 321 O LYS A 19 14.969 -40.569 -4.104 1.00 0.00 O ATOM 322 CB LYS A 19 16.364 -38.983 -1.658 1.00 0.00 C ATOM 323 CG LYS A 19 17.611 -38.123 -1.872 1.00 0.00 C ATOM 324 CD LYS A 19 18.784 -39.017 -2.278 1.00 0.00 C ATOM 325 CE LYS A 19 20.062 -38.524 -1.597 1.00 0.00 C ATOM 326 NZ LYS A 19 21.039 -38.087 -2.633 1.00 0.00 N ATOM 0 H LYS A 19 13.889 -39.665 -1.513 1.00 0.00 H new ATOM 0 HA LYS A 19 15.409 -37.590 -2.998 1.00 0.00 H new ATOM 0 HB2 LYS A 19 15.955 -38.808 -0.663 1.00 0.00 H new ATOM 0 HB3 LYS A 19 16.624 -40.040 -1.715 1.00 0.00 H new ATOM 0 HG2 LYS A 19 17.423 -37.378 -2.645 1.00 0.00 H new ATOM 0 HG3 LYS A 19 17.853 -37.580 -0.958 1.00 0.00 H new ATOM 0 HD2 LYS A 19 18.583 -40.050 -1.994 1.00 0.00 H new ATOM 0 HD3 LYS A 19 18.908 -39.003 -3.361 1.00 0.00 H new ATOM 0 HE2 LYS A 19 19.833 -37.697 -0.925 1.00 0.00 H new ATOM 0 HE3 LYS A 19 20.492 -39.319 -0.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 21.908 -37.752 -2.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 21.265 -38.888 -3.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 20.627 -37.316 -3.196 1.00 0.00 H new ATOM 340 N VAL A 20 16.390 -39.071 -4.857 1.00 0.00 N ATOM 341 CA VAL A 20 16.658 -39.871 -6.087 1.00 0.00 C ATOM 342 C VAL A 20 15.441 -39.817 -7.013 1.00 0.00 C ATOM 343 O VAL A 20 15.387 -40.492 -8.022 1.00 0.00 O ATOM 344 CB VAL A 20 16.937 -41.325 -5.701 1.00 0.00 C ATOM 345 CG1 VAL A 20 17.582 -42.052 -6.881 1.00 0.00 C ATOM 346 CG2 VAL A 20 17.885 -41.360 -4.500 1.00 0.00 C ATOM 0 H VAL A 20 16.904 -38.192 -4.791 1.00 0.00 H new ATOM 0 HA VAL A 20 17.524 -39.457 -6.603 1.00 0.00 H new ATOM 0 HB VAL A 20 16.000 -41.818 -5.440 1.00 0.00 H new ATOM 0 HG11 VAL A 20 17.781 -43.088 -6.606 1.00 0.00 H new ATOM 0 HG12 VAL A 20 16.907 -42.027 -7.737 1.00 0.00 H new ATOM 0 HG13 VAL A 20 18.519 -41.560 -7.143 1.00 0.00 H new ATOM 0 HG21 VAL A 20 18.085 -42.395 -4.224 1.00 0.00 H new ATOM 0 HG22 VAL A 20 18.821 -40.867 -4.761 1.00 0.00 H new ATOM 0 HG23 VAL A 20 17.425 -40.842 -3.658 1.00 0.00 H new ATOM 356 N ASN A 21 14.462 -39.022 -6.679 1.00 0.00 N ATOM 357 CA ASN A 21 13.251 -38.932 -7.542 1.00 0.00 C ATOM 358 C ASN A 21 12.793 -37.474 -7.636 1.00 0.00 C ATOM 359 O ASN A 21 12.331 -36.896 -6.672 1.00 0.00 O ATOM 360 CB ASN A 21 12.128 -39.777 -6.937 1.00 0.00 C ATOM 361 CG ASN A 21 12.047 -41.118 -7.668 1.00 0.00 C ATOM 362 OD1 ASN A 21 11.837 -41.159 -8.863 1.00 0.00 O ATOM 363 ND2 ASN A 21 12.202 -42.226 -6.995 1.00 0.00 N ATOM 0 H ASN A 21 14.448 -38.432 -5.847 1.00 0.00 H new ATOM 0 HA ASN A 21 13.491 -39.303 -8.539 1.00 0.00 H new ATOM 0 HB2 ASN A 21 12.313 -39.940 -5.875 1.00 0.00 H new ATOM 0 HB3 ASN A 21 11.178 -39.249 -7.017 1.00 0.00 H new ATOM 0 HD21 ASN A 21 12.147 -43.125 -7.473 1.00 0.00 H new ATOM 0 HD22 ASN A 21 12.378 -42.192 -5.991 1.00 0.00 H new ATOM 370 N THR A 22 12.916 -36.877 -8.790 1.00 0.00 N ATOM 371 CA THR A 22 12.483 -35.458 -8.944 1.00 0.00 C ATOM 372 C THR A 22 10.959 -35.379 -8.830 1.00 0.00 C ATOM 373 O THR A 22 10.241 -36.151 -9.435 1.00 0.00 O ATOM 374 CB THR A 22 12.924 -34.935 -10.315 1.00 0.00 C ATOM 375 OG1 THR A 22 12.356 -35.742 -11.341 1.00 0.00 O ATOM 376 CG2 THR A 22 14.449 -34.983 -10.414 1.00 0.00 C ATOM 0 H THR A 22 13.297 -37.309 -9.632 1.00 0.00 H new ATOM 0 HA THR A 22 12.938 -34.850 -8.163 1.00 0.00 H new ATOM 0 HB THR A 22 12.584 -33.906 -10.435 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.505 -36.115 -11.030 1.00 0.00 H new ATOM 0 HG21 THR A 22 14.762 -34.611 -11.389 1.00 0.00 H new ATOM 0 HG22 THR A 22 14.884 -34.361 -9.632 1.00 0.00 H new ATOM 0 HG23 THR A 22 14.789 -36.011 -10.292 1.00 0.00 H new ATOM 384 N TYR A 23 10.459 -34.455 -8.057 1.00 0.00 N ATOM 385 CA TYR A 23 8.982 -34.332 -7.904 1.00 0.00 C ATOM 386 C TYR A 23 8.462 -33.221 -8.817 1.00 0.00 C ATOM 387 O TYR A 23 7.388 -33.317 -9.378 1.00 0.00 O ATOM 388 CB TYR A 23 8.647 -33.996 -6.449 1.00 0.00 C ATOM 389 CG TYR A 23 7.447 -34.803 -6.011 1.00 0.00 C ATOM 390 CD1 TYR A 23 7.556 -36.191 -5.848 1.00 0.00 C ATOM 391 CD2 TYR A 23 6.225 -34.163 -5.768 1.00 0.00 C ATOM 392 CE1 TYR A 23 6.441 -36.938 -5.443 1.00 0.00 C ATOM 393 CE2 TYR A 23 5.110 -34.909 -5.363 1.00 0.00 C ATOM 394 CZ TYR A 23 5.218 -36.297 -5.200 1.00 0.00 C ATOM 395 OH TYR A 23 4.121 -37.033 -4.801 1.00 0.00 O ATOM 0 H TYR A 23 11.009 -33.780 -7.525 1.00 0.00 H new ATOM 0 HA TYR A 23 8.510 -35.275 -8.178 1.00 0.00 H new ATOM 0 HB2 TYR A 23 9.501 -34.216 -5.808 1.00 0.00 H new ATOM 0 HB3 TYR A 23 8.439 -32.931 -6.349 1.00 0.00 H new ATOM 0 HD1 TYR A 23 8.498 -36.685 -6.034 1.00 0.00 H new ATOM 0 HD2 TYR A 23 6.142 -33.093 -5.893 1.00 0.00 H new ATOM 0 HE1 TYR A 23 6.524 -38.008 -5.318 1.00 0.00 H new ATOM 0 HE2 TYR A 23 4.168 -34.415 -5.177 1.00 0.00 H new ATOM 0 HH TYR A 23 3.355 -36.435 -4.675 1.00 0.00 H new ATOM 405 N ARG A 24 9.213 -32.164 -8.971 1.00 0.00 N ATOM 406 CA ARG A 24 8.754 -31.050 -9.848 1.00 0.00 C ATOM 407 C ARG A 24 7.412 -30.523 -9.335 1.00 0.00 C ATOM 408 O ARG A 24 6.730 -31.176 -8.569 1.00 0.00 O ATOM 409 CB ARG A 24 8.586 -31.563 -11.280 1.00 0.00 C ATOM 410 CG ARG A 24 9.713 -31.014 -12.157 1.00 0.00 C ATOM 411 CD ARG A 24 9.154 -30.646 -13.533 1.00 0.00 C ATOM 412 NE ARG A 24 10.086 -29.700 -14.209 1.00 0.00 N ATOM 413 CZ ARG A 24 10.786 -30.095 -15.238 1.00 0.00 C ATOM 414 NH1 ARG A 24 11.672 -31.043 -15.099 1.00 0.00 N ATOM 415 NH2 ARG A 24 10.599 -29.542 -16.404 1.00 0.00 N ATOM 0 H ARG A 24 10.122 -32.024 -8.529 1.00 0.00 H new ATOM 0 HA ARG A 24 9.492 -30.248 -9.835 1.00 0.00 H new ATOM 0 HB2 ARG A 24 8.601 -32.653 -11.291 1.00 0.00 H new ATOM 0 HB3 ARG A 24 7.619 -31.254 -11.677 1.00 0.00 H new ATOM 0 HG2 ARG A 24 10.160 -30.137 -11.688 1.00 0.00 H new ATOM 0 HG3 ARG A 24 10.503 -31.758 -12.260 1.00 0.00 H new ATOM 0 HD2 ARG A 24 9.027 -31.544 -14.138 1.00 0.00 H new ATOM 0 HD3 ARG A 24 8.169 -30.191 -13.428 1.00 0.00 H new ATOM 0 HE ARG A 24 10.177 -28.743 -13.868 1.00 0.00 H new ATOM 0 HH11 ARG A 24 11.818 -31.475 -14.187 1.00 0.00 H new ATOM 0 HH12 ARG A 24 12.219 -31.352 -15.903 1.00 0.00 H new ATOM 0 HH21 ARG A 24 9.906 -28.801 -16.512 1.00 0.00 H new ATOM 0 HH22 ARG A 24 11.146 -29.850 -17.208 1.00 0.00 H new ATOM 429 N THR A 25 7.027 -29.347 -9.748 1.00 0.00 N ATOM 430 CA THR A 25 5.729 -28.782 -9.281 1.00 0.00 C ATOM 431 C THR A 25 4.912 -28.314 -10.489 1.00 0.00 C ATOM 432 O THR A 25 3.724 -28.554 -10.577 1.00 0.00 O ATOM 433 CB THR A 25 5.996 -27.594 -8.354 1.00 0.00 C ATOM 434 OG1 THR A 25 7.388 -27.307 -8.346 1.00 0.00 O ATOM 435 CG2 THR A 25 5.535 -27.935 -6.936 1.00 0.00 C ATOM 0 H THR A 25 7.554 -28.753 -10.388 1.00 0.00 H new ATOM 0 HA THR A 25 5.172 -29.547 -8.741 1.00 0.00 H new ATOM 0 HB THR A 25 5.446 -26.723 -8.711 1.00 0.00 H new ATOM 0 HG1 THR A 25 7.562 -26.545 -7.754 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.726 -27.088 -6.278 1.00 0.00 H new ATOM 0 HG22 THR A 25 4.467 -28.155 -6.944 1.00 0.00 H new ATOM 0 HG23 THR A 25 6.082 -28.806 -6.575 1.00 0.00 H new ATOM 443 N SER A 26 5.540 -27.650 -11.420 1.00 0.00 N ATOM 444 CA SER A 26 4.801 -27.169 -12.620 1.00 0.00 C ATOM 445 C SER A 26 3.667 -26.239 -12.185 1.00 0.00 C ATOM 446 O SER A 26 2.513 -26.469 -12.486 1.00 0.00 O ATOM 447 CB SER A 26 4.217 -28.366 -13.373 1.00 0.00 C ATOM 448 OG SER A 26 4.778 -29.565 -12.854 1.00 0.00 O ATOM 0 H SER A 26 6.534 -27.420 -11.401 1.00 0.00 H new ATOM 0 HA SER A 26 5.485 -26.626 -13.273 1.00 0.00 H new ATOM 0 HB2 SER A 26 3.132 -28.383 -13.268 1.00 0.00 H new ATOM 0 HB3 SER A 26 4.433 -28.281 -14.438 1.00 0.00 H new ATOM 0 HG SER A 26 4.405 -30.335 -13.333 1.00 0.00 H new ATOM 454 N ALA A 27 3.986 -25.190 -11.478 1.00 0.00 N ATOM 455 CA ALA A 27 2.925 -24.247 -11.025 1.00 0.00 C ATOM 456 C ALA A 27 3.079 -22.913 -11.761 1.00 0.00 C ATOM 457 O ALA A 27 3.104 -21.859 -11.158 1.00 0.00 O ATOM 458 CB ALA A 27 3.055 -24.016 -9.518 1.00 0.00 C ATOM 0 H ALA A 27 4.935 -24.945 -11.195 1.00 0.00 H new ATOM 0 HA ALA A 27 1.945 -24.672 -11.244 1.00 0.00 H new ATOM 0 HB1 ALA A 27 2.279 -23.326 -9.187 1.00 0.00 H new ATOM 0 HB2 ALA A 27 2.944 -24.965 -8.994 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.035 -23.592 -9.298 1.00 0.00 H new ATOM 464 N MET A 28 3.180 -22.951 -13.062 1.00 0.00 N ATOM 465 CA MET A 28 3.329 -21.686 -13.835 1.00 0.00 C ATOM 466 C MET A 28 1.946 -21.084 -14.094 1.00 0.00 C ATOM 467 O MET A 28 1.201 -21.557 -14.929 1.00 0.00 O ATOM 468 CB MET A 28 4.017 -21.981 -15.169 1.00 0.00 C ATOM 469 CG MET A 28 4.771 -20.738 -15.643 1.00 0.00 C ATOM 470 SD MET A 28 6.202 -20.457 -14.571 1.00 0.00 S ATOM 471 CE MET A 28 7.479 -20.707 -15.829 1.00 0.00 C ATOM 0 H MET A 28 3.166 -23.803 -13.622 1.00 0.00 H new ATOM 0 HA MET A 28 3.933 -20.979 -13.266 1.00 0.00 H new ATOM 0 HB2 MET A 28 4.708 -22.817 -15.057 1.00 0.00 H new ATOM 0 HB3 MET A 28 3.278 -22.276 -15.914 1.00 0.00 H new ATOM 0 HG2 MET A 28 5.096 -20.868 -16.675 1.00 0.00 H new ATOM 0 HG3 MET A 28 4.112 -19.870 -15.623 1.00 0.00 H new ATOM 0 HE1 MET A 28 8.463 -20.579 -15.379 1.00 0.00 H new ATOM 0 HE2 MET A 28 7.395 -21.714 -16.237 1.00 0.00 H new ATOM 0 HE3 MET A 28 7.349 -19.979 -16.630 1.00 0.00 H new ATOM 481 N ASP A 29 1.595 -20.046 -13.384 1.00 0.00 N ATOM 482 CA ASP A 29 0.258 -19.422 -13.595 1.00 0.00 C ATOM 483 C ASP A 29 0.095 -18.226 -12.653 1.00 0.00 C ATOM 484 O ASP A 29 -0.979 -17.964 -12.151 1.00 0.00 O ATOM 485 CB ASP A 29 -0.836 -20.452 -13.303 1.00 0.00 C ATOM 486 CG ASP A 29 -0.604 -21.064 -11.920 1.00 0.00 C ATOM 487 OD1 ASP A 29 -0.140 -20.349 -11.047 1.00 0.00 O ATOM 488 OD2 ASP A 29 -0.896 -22.237 -11.757 1.00 0.00 O ATOM 0 H ASP A 29 2.174 -19.605 -12.670 1.00 0.00 H new ATOM 0 HA ASP A 29 0.175 -19.084 -14.628 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -1.817 -19.978 -13.343 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -0.828 -21.232 -14.064 1.00 0.00 H new ATOM 493 N LEU A 30 1.151 -17.498 -12.409 1.00 0.00 N ATOM 494 CA LEU A 30 1.048 -16.322 -11.500 1.00 0.00 C ATOM 495 C LEU A 30 2.373 -15.560 -11.498 1.00 0.00 C ATOM 496 O LEU A 30 2.926 -15.259 -10.458 1.00 0.00 O ATOM 497 CB LEU A 30 0.731 -16.799 -10.081 1.00 0.00 C ATOM 498 CG LEU A 30 0.313 -15.604 -9.224 1.00 0.00 C ATOM 499 CD1 LEU A 30 -1.208 -15.604 -9.054 1.00 0.00 C ATOM 500 CD2 LEU A 30 0.981 -15.706 -7.851 1.00 0.00 C ATOM 0 H LEU A 30 2.078 -17.667 -12.799 1.00 0.00 H new ATOM 0 HA LEU A 30 0.252 -15.664 -11.848 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.068 -17.540 -10.105 1.00 0.00 H new ATOM 0 HB3 LEU A 30 1.604 -17.285 -9.646 1.00 0.00 H new ATOM 0 HG LEU A 30 0.622 -14.680 -9.712 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -1.506 -14.752 -8.443 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.683 -15.533 -10.032 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.520 -16.527 -8.566 1.00 0.00 H new ATOM 0 HD21 LEU A 30 0.684 -14.855 -7.238 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.671 -16.630 -7.363 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.064 -15.706 -7.972 1.00 0.00 H new ATOM 512 N SER A 31 2.887 -15.240 -12.655 1.00 0.00 N ATOM 513 CA SER A 31 4.175 -14.494 -12.717 1.00 0.00 C ATOM 514 C SER A 31 3.896 -13.042 -13.120 1.00 0.00 C ATOM 515 O SER A 31 2.911 -12.761 -13.774 1.00 0.00 O ATOM 516 CB SER A 31 5.099 -15.155 -13.747 1.00 0.00 C ATOM 517 OG SER A 31 5.388 -14.235 -14.794 1.00 0.00 O ATOM 0 H SER A 31 2.470 -15.463 -13.559 1.00 0.00 H new ATOM 0 HA SER A 31 4.660 -14.511 -11.741 1.00 0.00 H new ATOM 0 HB2 SER A 31 6.023 -15.476 -13.267 1.00 0.00 H new ATOM 0 HB3 SER A 31 4.625 -16.048 -14.155 1.00 0.00 H new ATOM 0 HG SER A 31 5.980 -14.660 -15.449 1.00 0.00 H new ATOM 523 N PRO A 32 4.774 -12.162 -12.712 1.00 0.00 N ATOM 524 CA PRO A 32 4.655 -10.724 -13.011 1.00 0.00 C ATOM 525 C PRO A 32 5.075 -10.440 -14.456 1.00 0.00 C ATOM 526 O PRO A 32 6.196 -10.698 -14.849 1.00 0.00 O ATOM 527 CB PRO A 32 5.620 -10.069 -12.019 1.00 0.00 C ATOM 528 CG PRO A 32 6.636 -11.164 -11.612 1.00 0.00 C ATOM 529 CD PRO A 32 5.968 -12.518 -11.918 1.00 0.00 C ATOM 0 HA PRO A 32 3.636 -10.349 -12.915 1.00 0.00 H new ATOM 0 HB2 PRO A 32 6.127 -9.218 -12.474 1.00 0.00 H new ATOM 0 HB3 PRO A 32 5.085 -9.692 -11.147 1.00 0.00 H new ATOM 0 HG2 PRO A 32 7.566 -11.056 -12.169 1.00 0.00 H new ATOM 0 HG3 PRO A 32 6.887 -11.086 -10.554 1.00 0.00 H new ATOM 0 HD2 PRO A 32 6.636 -13.175 -12.476 1.00 0.00 H new ATOM 0 HD3 PRO A 32 5.695 -13.043 -11.003 1.00 0.00 H new ATOM 537 N GLY A 33 4.185 -9.909 -15.250 1.00 0.00 N ATOM 538 CA GLY A 33 4.533 -9.610 -16.667 1.00 0.00 C ATOM 539 C GLY A 33 3.611 -10.397 -17.600 1.00 0.00 C ATOM 540 O GLY A 33 4.035 -10.919 -18.612 1.00 0.00 O ATOM 0 H GLY A 33 3.232 -9.670 -14.978 1.00 0.00 H new ATOM 0 HA2 GLY A 33 4.434 -8.541 -16.858 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.573 -9.874 -16.860 1.00 0.00 H new ATOM 544 N SER A 34 2.352 -10.489 -17.268 1.00 0.00 N ATOM 545 CA SER A 34 1.406 -11.244 -18.137 1.00 0.00 C ATOM 546 C SER A 34 0.186 -10.372 -18.445 1.00 0.00 C ATOM 547 O SER A 34 -0.083 -9.402 -17.765 1.00 0.00 O ATOM 548 CB SER A 34 0.958 -12.516 -17.416 1.00 0.00 C ATOM 549 OG SER A 34 2.078 -13.109 -16.772 1.00 0.00 O ATOM 0 H SER A 34 1.938 -10.074 -16.433 1.00 0.00 H new ATOM 0 HA SER A 34 1.903 -11.511 -19.070 1.00 0.00 H new ATOM 0 HB2 SER A 34 0.186 -12.280 -16.684 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.520 -13.216 -18.127 1.00 0.00 H new ATOM 0 HG SER A 34 2.101 -12.829 -15.833 1.00 0.00 H new ATOM 555 N VAL A 35 -0.553 -10.709 -19.467 1.00 0.00 N ATOM 556 CA VAL A 35 -1.753 -9.896 -19.819 1.00 0.00 C ATOM 557 C VAL A 35 -3.023 -10.692 -19.504 1.00 0.00 C ATOM 558 O VAL A 35 -3.145 -11.849 -19.855 1.00 0.00 O ATOM 559 CB VAL A 35 -1.720 -9.559 -21.311 1.00 0.00 C ATOM 560 CG1 VAL A 35 -0.351 -8.984 -21.675 1.00 0.00 C ATOM 561 CG2 VAL A 35 -1.971 -10.831 -22.125 1.00 0.00 C ATOM 0 H VAL A 35 -0.378 -11.511 -20.073 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.750 -8.975 -19.237 1.00 0.00 H new ATOM 0 HB VAL A 35 -2.493 -8.824 -21.535 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -0.328 -8.744 -22.738 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.171 -8.079 -21.095 1.00 0.00 H new ATOM 0 HG13 VAL A 35 0.423 -9.718 -21.452 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -1.948 -10.593 -23.188 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.197 -11.565 -21.901 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.947 -11.242 -21.866 1.00 0.00 H new ATOM 571 N HIS A 36 -3.969 -10.081 -18.846 1.00 0.00 N ATOM 572 CA HIS A 36 -5.230 -10.800 -18.511 1.00 0.00 C ATOM 573 C HIS A 36 -6.400 -9.811 -18.526 1.00 0.00 C ATOM 574 O HIS A 36 -6.210 -8.614 -18.608 1.00 0.00 O ATOM 575 CB HIS A 36 -5.107 -11.424 -17.119 1.00 0.00 C ATOM 576 CG HIS A 36 -4.689 -12.863 -17.248 1.00 0.00 C ATOM 577 ND1 HIS A 36 -5.132 -13.673 -18.284 1.00 0.00 N ATOM 578 CD2 HIS A 36 -3.867 -13.652 -16.482 1.00 0.00 C ATOM 579 CE1 HIS A 36 -4.581 -14.889 -18.111 1.00 0.00 C ATOM 580 NE2 HIS A 36 -3.802 -14.930 -17.028 1.00 0.00 N ATOM 0 H HIS A 36 -3.923 -9.114 -18.526 1.00 0.00 H new ATOM 0 HA HIS A 36 -5.408 -11.585 -19.246 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -4.376 -10.874 -16.526 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -6.060 -11.357 -16.594 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -3.349 -13.329 -15.591 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -4.749 -15.729 -18.769 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -3.272 -15.728 -16.676 1.00 0.00 H new ATOM 588 N GLU A 37 -7.606 -10.303 -18.451 1.00 0.00 N ATOM 589 CA GLU A 37 -8.784 -9.389 -18.465 1.00 0.00 C ATOM 590 C GLU A 37 -9.296 -9.186 -17.037 1.00 0.00 C ATOM 591 O GLU A 37 -9.120 -10.028 -16.178 1.00 0.00 O ATOM 592 CB GLU A 37 -9.895 -10.004 -19.321 1.00 0.00 C ATOM 593 CG GLU A 37 -10.022 -9.220 -20.629 1.00 0.00 C ATOM 594 CD GLU A 37 -11.155 -9.811 -21.471 1.00 0.00 C ATOM 595 OE1 GLU A 37 -11.055 -10.973 -21.830 1.00 0.00 O ATOM 596 OE2 GLU A 37 -12.101 -9.091 -21.743 1.00 0.00 O ATOM 0 H GLU A 37 -7.827 -11.296 -18.381 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.489 -8.427 -18.883 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -9.670 -11.050 -19.531 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -10.840 -9.984 -18.779 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -10.222 -8.169 -20.418 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -9.084 -9.261 -21.182 1.00 0.00 H new ATOM 603 N GLY A 38 -9.927 -8.073 -16.775 1.00 0.00 N ATOM 604 CA GLY A 38 -10.448 -7.815 -15.403 1.00 0.00 C ATOM 605 C GLY A 38 -11.322 -6.558 -15.407 1.00 0.00 C ATOM 606 O GLY A 38 -11.440 -5.873 -16.406 1.00 0.00 O ATOM 0 H GLY A 38 -10.104 -7.331 -17.453 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -11.028 -8.671 -15.058 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.619 -7.690 -14.707 1.00 0.00 H new ATOM 610 N ILE A 39 -11.933 -6.250 -14.296 1.00 0.00 N ATOM 611 CA ILE A 39 -12.801 -5.039 -14.223 1.00 0.00 C ATOM 612 C ILE A 39 -12.005 -3.895 -13.591 1.00 0.00 C ATOM 613 O ILE A 39 -11.196 -4.106 -12.710 1.00 0.00 O ATOM 614 CB ILE A 39 -14.034 -5.353 -13.368 1.00 0.00 C ATOM 615 CG1 ILE A 39 -15.028 -6.174 -14.193 1.00 0.00 C ATOM 616 CG2 ILE A 39 -14.706 -4.054 -12.915 1.00 0.00 C ATOM 617 CD1 ILE A 39 -14.825 -7.662 -13.906 1.00 0.00 C ATOM 0 H ILE A 39 -11.868 -6.787 -13.431 1.00 0.00 H new ATOM 0 HA ILE A 39 -13.124 -4.747 -15.222 1.00 0.00 H new ATOM 0 HB ILE A 39 -13.723 -5.919 -12.490 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -16.049 -5.882 -13.947 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -14.886 -5.975 -15.255 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -15.581 -4.289 -12.308 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -14.002 -3.467 -12.325 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -15.014 -3.480 -13.789 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -15.533 -8.246 -14.494 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -13.808 -7.949 -14.174 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -14.989 -7.854 -12.846 1.00 0.00 H new ATOM 629 N VAL A 40 -12.221 -2.687 -14.035 1.00 0.00 N ATOM 630 CA VAL A 40 -11.466 -1.537 -13.456 1.00 0.00 C ATOM 631 C VAL A 40 -12.346 -0.790 -12.452 1.00 0.00 C ATOM 632 O VAL A 40 -13.523 -1.058 -12.322 1.00 0.00 O ATOM 633 CB VAL A 40 -11.056 -0.583 -14.583 1.00 0.00 C ATOM 634 CG1 VAL A 40 -9.840 0.234 -14.142 1.00 0.00 C ATOM 635 CG2 VAL A 40 -10.696 -1.393 -15.830 1.00 0.00 C ATOM 0 H VAL A 40 -12.885 -2.446 -14.771 1.00 0.00 H new ATOM 0 HA VAL A 40 -10.577 -1.909 -12.946 1.00 0.00 H new ATOM 0 HB VAL A 40 -11.884 0.088 -14.810 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -9.548 0.913 -14.943 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -10.092 0.810 -13.252 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.012 -0.438 -13.916 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -10.404 -0.715 -16.632 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.867 -2.063 -15.602 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -11.560 -1.978 -16.146 1.00 0.00 H new ATOM 645 N TYR A 41 -11.786 0.149 -11.744 1.00 0.00 N ATOM 646 CA TYR A 41 -12.595 0.920 -10.758 1.00 0.00 C ATOM 647 C TYR A 41 -11.937 2.279 -10.507 1.00 0.00 C ATOM 648 O TYR A 41 -10.730 2.414 -10.557 1.00 0.00 O ATOM 649 CB TYR A 41 -12.678 0.145 -9.441 1.00 0.00 C ATOM 650 CG TYR A 41 -14.033 0.365 -8.812 1.00 0.00 C ATOM 651 CD1 TYR A 41 -14.328 1.589 -8.201 1.00 0.00 C ATOM 652 CD2 TYR A 41 -14.993 -0.656 -8.841 1.00 0.00 C ATOM 653 CE1 TYR A 41 -15.585 1.796 -7.617 1.00 0.00 C ATOM 654 CE2 TYR A 41 -16.250 -0.448 -8.258 1.00 0.00 C ATOM 655 CZ TYR A 41 -16.546 0.777 -7.646 1.00 0.00 C ATOM 656 OH TYR A 41 -17.785 0.981 -7.072 1.00 0.00 O ATOM 0 H TYR A 41 -10.804 0.417 -11.804 1.00 0.00 H new ATOM 0 HA TYR A 41 -13.599 1.069 -11.155 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -12.517 -0.918 -9.621 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -11.892 0.476 -8.762 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -13.587 2.374 -8.180 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -14.764 -1.601 -9.312 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -15.813 2.740 -7.145 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -16.992 -1.233 -8.280 1.00 0.00 H new ATOM 0 HH TYR A 41 -18.332 0.175 -7.181 1.00 0.00 H new ATOM 666 N PHE A 42 -12.721 3.288 -10.236 1.00 0.00 N ATOM 667 CA PHE A 42 -12.141 4.638 -9.982 1.00 0.00 C ATOM 668 C PHE A 42 -12.105 4.902 -8.475 1.00 0.00 C ATOM 669 O PHE A 42 -13.109 5.209 -7.865 1.00 0.00 O ATOM 670 CB PHE A 42 -13.008 5.700 -10.663 1.00 0.00 C ATOM 671 CG PHE A 42 -12.384 7.062 -10.472 1.00 0.00 C ATOM 672 CD1 PHE A 42 -11.267 7.433 -11.233 1.00 0.00 C ATOM 673 CD2 PHE A 42 -12.921 7.954 -9.536 1.00 0.00 C ATOM 674 CE1 PHE A 42 -10.688 8.697 -11.057 1.00 0.00 C ATOM 675 CE2 PHE A 42 -12.343 9.218 -9.358 1.00 0.00 C ATOM 676 CZ PHE A 42 -11.226 9.589 -10.119 1.00 0.00 C ATOM 0 H PHE A 42 -13.738 3.235 -10.180 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.129 4.680 -10.383 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -13.104 5.479 -11.726 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -14.014 5.687 -10.243 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -10.853 6.745 -11.955 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -13.782 7.667 -8.950 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.828 8.984 -11.644 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -12.758 9.905 -8.635 1.00 0.00 H new ATOM 0 HZ PHE A 42 -10.779 10.563 -9.983 1.00 0.00 H new ATOM 686 N LYS A 43 -10.954 4.785 -7.870 1.00 0.00 N ATOM 687 CA LYS A 43 -10.858 5.028 -6.404 1.00 0.00 C ATOM 688 C LYS A 43 -10.532 6.502 -6.151 1.00 0.00 C ATOM 689 O LYS A 43 -10.210 7.240 -7.060 1.00 0.00 O ATOM 690 CB LYS A 43 -9.752 4.150 -5.814 1.00 0.00 C ATOM 691 CG LYS A 43 -10.102 3.786 -4.370 1.00 0.00 C ATOM 692 CD LYS A 43 -9.073 2.791 -3.831 1.00 0.00 C ATOM 693 CE LYS A 43 -7.873 3.552 -3.265 1.00 0.00 C ATOM 694 NZ LYS A 43 -8.053 3.747 -1.798 1.00 0.00 N ATOM 0 H LYS A 43 -10.078 4.532 -8.327 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.808 4.781 -5.931 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -9.635 3.245 -6.410 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -8.799 4.678 -5.846 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -10.115 4.683 -3.751 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -11.101 3.353 -4.325 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -9.523 2.171 -3.055 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -8.749 2.120 -4.627 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -6.954 2.999 -3.459 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -7.774 4.517 -3.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -7.237 4.264 -1.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -8.921 4.292 -1.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -8.126 2.821 -1.331 1.00 0.00 H new ATOM 708 N ASP A 44 -10.616 6.935 -4.923 1.00 0.00 N ATOM 709 CA ASP A 44 -10.313 8.360 -4.611 1.00 0.00 C ATOM 710 C ASP A 44 -8.812 8.521 -4.360 1.00 0.00 C ATOM 711 O ASP A 44 -8.375 9.481 -3.758 1.00 0.00 O ATOM 712 CB ASP A 44 -11.085 8.785 -3.360 1.00 0.00 C ATOM 713 CG ASP A 44 -10.784 7.813 -2.219 1.00 0.00 C ATOM 714 OD1 ASP A 44 -11.422 6.774 -2.168 1.00 0.00 O ATOM 715 OD2 ASP A 44 -9.921 8.123 -1.414 1.00 0.00 O ATOM 0 H ASP A 44 -10.882 6.363 -4.122 1.00 0.00 H new ATOM 0 HA ASP A 44 -10.611 8.985 -5.453 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -10.803 9.798 -3.073 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -12.155 8.799 -3.567 1.00 0.00 H new ATOM 720 N GLY A 45 -8.018 7.588 -4.813 1.00 0.00 N ATOM 721 CA GLY A 45 -6.547 7.694 -4.595 1.00 0.00 C ATOM 722 C GLY A 45 -5.804 7.104 -5.794 1.00 0.00 C ATOM 723 O GLY A 45 -4.788 7.616 -6.220 1.00 0.00 O ATOM 0 H GLY A 45 -8.324 6.759 -5.323 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.264 8.738 -4.458 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -6.266 7.165 -3.684 1.00 0.00 H new ATOM 727 N ILE A 46 -6.301 6.031 -6.342 1.00 0.00 N ATOM 728 CA ILE A 46 -5.622 5.408 -7.511 1.00 0.00 C ATOM 729 C ILE A 46 -6.643 4.604 -8.314 1.00 0.00 C ATOM 730 O ILE A 46 -7.828 4.867 -8.265 1.00 0.00 O ATOM 731 CB ILE A 46 -4.510 4.482 -7.017 1.00 0.00 C ATOM 732 CG1 ILE A 46 -5.126 3.342 -6.202 1.00 0.00 C ATOM 733 CG2 ILE A 46 -3.542 5.271 -6.135 1.00 0.00 C ATOM 734 CD1 ILE A 46 -4.063 2.277 -5.929 1.00 0.00 C ATOM 0 H ILE A 46 -7.149 5.558 -6.030 1.00 0.00 H new ATOM 0 HA ILE A 46 -5.190 6.183 -8.144 1.00 0.00 H new ATOM 0 HB ILE A 46 -3.971 4.073 -7.871 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -5.521 3.726 -5.261 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -5.964 2.904 -6.745 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.750 4.610 -5.783 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -3.105 6.086 -6.712 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.080 5.680 -5.280 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -4.502 1.465 -5.349 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -3.689 1.886 -6.875 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.240 2.720 -5.369 1.00 0.00 H new ATOM 746 N PHE A 47 -6.202 3.621 -9.051 1.00 0.00 N ATOM 747 CA PHE A 47 -7.164 2.809 -9.843 1.00 0.00 C ATOM 748 C PHE A 47 -7.300 1.428 -9.204 1.00 0.00 C ATOM 749 O PHE A 47 -6.412 0.965 -8.517 1.00 0.00 O ATOM 750 CB PHE A 47 -6.655 2.664 -11.280 1.00 0.00 C ATOM 751 CG PHE A 47 -7.255 3.752 -12.137 1.00 0.00 C ATOM 752 CD1 PHE A 47 -7.583 4.991 -11.570 1.00 0.00 C ATOM 753 CD2 PHE A 47 -7.488 3.521 -13.499 1.00 0.00 C ATOM 754 CE1 PHE A 47 -8.142 6.001 -12.367 1.00 0.00 C ATOM 755 CE2 PHE A 47 -8.046 4.530 -14.296 1.00 0.00 C ATOM 756 CZ PHE A 47 -8.373 5.769 -13.729 1.00 0.00 C ATOM 0 H PHE A 47 -5.223 3.348 -9.138 1.00 0.00 H new ATOM 0 HA PHE A 47 -8.136 3.303 -9.857 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -5.567 2.728 -11.300 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -6.924 1.685 -11.676 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -7.405 5.168 -10.520 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -7.238 2.565 -13.935 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -8.394 6.956 -11.931 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -8.224 4.353 -15.346 1.00 0.00 H new ATOM 0 HZ PHE A 47 -8.804 6.546 -14.343 1.00 0.00 H new ATOM 766 N LYS A 48 -8.404 0.769 -9.418 1.00 0.00 N ATOM 767 CA LYS A 48 -8.590 -0.580 -8.816 1.00 0.00 C ATOM 768 C LYS A 48 -8.947 -1.583 -9.912 1.00 0.00 C ATOM 769 O LYS A 48 -9.549 -1.239 -10.910 1.00 0.00 O ATOM 770 CB LYS A 48 -9.718 -0.531 -7.785 1.00 0.00 C ATOM 771 CG LYS A 48 -9.446 -1.552 -6.679 1.00 0.00 C ATOM 772 CD LYS A 48 -10.728 -1.789 -5.877 1.00 0.00 C ATOM 773 CE LYS A 48 -10.388 -2.491 -4.561 1.00 0.00 C ATOM 774 NZ LYS A 48 -11.596 -3.195 -4.048 1.00 0.00 N ATOM 0 H LYS A 48 -9.184 1.105 -9.983 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.665 -0.888 -8.327 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -9.793 0.470 -7.360 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.673 -0.745 -8.265 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -9.097 -2.489 -7.112 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -8.655 -1.190 -6.022 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -11.224 -0.839 -5.677 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -11.424 -2.396 -6.456 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -9.577 -3.203 -4.715 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -10.039 -1.764 -3.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -11.366 -3.673 -3.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -12.357 -2.505 -3.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -11.910 -3.900 -4.746 1.00 0.00 H new ATOM 788 N VAL A 49 -8.582 -2.822 -9.731 1.00 0.00 N ATOM 789 CA VAL A 49 -8.901 -3.851 -10.758 1.00 0.00 C ATOM 790 C VAL A 49 -9.355 -5.135 -10.057 1.00 0.00 C ATOM 791 O VAL A 49 -8.586 -5.788 -9.382 1.00 0.00 O ATOM 792 CB VAL A 49 -7.653 -4.143 -11.592 1.00 0.00 C ATOM 793 CG1 VAL A 49 -8.055 -4.856 -12.885 1.00 0.00 C ATOM 794 CG2 VAL A 49 -6.952 -2.826 -11.935 1.00 0.00 C ATOM 0 H VAL A 49 -8.076 -3.166 -8.915 1.00 0.00 H new ATOM 0 HA VAL A 49 -9.695 -3.486 -11.409 1.00 0.00 H new ATOM 0 HB VAL A 49 -6.977 -4.780 -11.022 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -7.164 -5.063 -13.478 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -8.556 -5.793 -12.643 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -8.731 -4.220 -13.456 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -6.062 -3.032 -12.530 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.630 -2.191 -12.505 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.664 -2.317 -11.015 1.00 0.00 H new ATOM 804 N ARG A 50 -10.599 -5.498 -10.208 1.00 0.00 N ATOM 805 CA ARG A 50 -11.097 -6.737 -9.547 1.00 0.00 C ATOM 806 C ARG A 50 -11.128 -7.879 -10.564 1.00 0.00 C ATOM 807 O ARG A 50 -11.692 -7.757 -11.633 1.00 0.00 O ATOM 808 CB ARG A 50 -12.509 -6.495 -9.007 1.00 0.00 C ATOM 809 CG ARG A 50 -13.111 -7.819 -8.534 1.00 0.00 C ATOM 810 CD ARG A 50 -13.308 -7.777 -7.018 1.00 0.00 C ATOM 811 NE ARG A 50 -14.618 -7.141 -6.705 1.00 0.00 N ATOM 812 CZ ARG A 50 -15.192 -7.361 -5.553 1.00 0.00 C ATOM 813 NH1 ARG A 50 -14.841 -6.665 -4.506 1.00 0.00 N ATOM 814 NH2 ARG A 50 -16.114 -8.277 -5.449 1.00 0.00 N ATOM 0 H ARG A 50 -11.291 -4.991 -10.760 1.00 0.00 H new ATOM 0 HA ARG A 50 -10.434 -7.002 -8.723 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -12.477 -5.783 -8.182 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -13.136 -6.055 -9.783 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -14.065 -7.995 -9.031 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -12.454 -8.646 -8.803 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -13.275 -8.786 -6.608 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -12.498 -7.216 -6.551 1.00 0.00 H new ATOM 0 HE ARG A 50 -15.067 -6.534 -7.391 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -14.119 -5.950 -4.588 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -15.289 -6.837 -3.606 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -16.387 -8.821 -6.267 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -16.563 -8.449 -4.549 1.00 0.00 H new ATOM 828 N LEU A 51 -10.525 -8.990 -10.241 1.00 0.00 N ATOM 829 CA LEU A 51 -10.521 -10.136 -11.193 1.00 0.00 C ATOM 830 C LEU A 51 -11.852 -10.882 -11.101 1.00 0.00 C ATOM 831 O LEU A 51 -11.981 -11.855 -10.385 1.00 0.00 O ATOM 832 CB LEU A 51 -9.377 -11.089 -10.845 1.00 0.00 C ATOM 833 CG LEU A 51 -8.388 -11.141 -12.009 1.00 0.00 C ATOM 834 CD1 LEU A 51 -7.049 -10.547 -11.570 1.00 0.00 C ATOM 835 CD2 LEU A 51 -8.187 -12.595 -12.442 1.00 0.00 C ATOM 0 H LEU A 51 -10.036 -9.154 -9.361 1.00 0.00 H new ATOM 0 HA LEU A 51 -10.384 -9.762 -12.207 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -8.872 -10.753 -9.939 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -9.768 -12.086 -10.641 1.00 0.00 H new ATOM 0 HG LEU A 51 -8.781 -10.564 -12.846 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -6.344 -10.585 -12.401 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -7.194 -9.511 -11.263 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -6.653 -11.121 -10.732 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -7.482 -12.633 -13.272 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -7.794 -13.173 -11.605 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -9.142 -13.016 -12.757 1.00 0.00 H new ATOM 847 N LEU A 52 -12.844 -10.436 -11.822 1.00 0.00 N ATOM 848 CA LEU A 52 -14.165 -11.120 -11.777 1.00 0.00 C ATOM 849 C LEU A 52 -14.001 -12.572 -12.229 1.00 0.00 C ATOM 850 O LEU A 52 -13.199 -12.879 -13.088 1.00 0.00 O ATOM 851 CB LEU A 52 -15.142 -10.404 -12.713 1.00 0.00 C ATOM 852 CG LEU A 52 -16.436 -11.214 -12.824 1.00 0.00 C ATOM 853 CD1 LEU A 52 -17.274 -11.016 -11.559 1.00 0.00 C ATOM 854 CD2 LEU A 52 -17.231 -10.734 -14.041 1.00 0.00 C ATOM 0 H LEU A 52 -12.796 -9.626 -12.441 1.00 0.00 H new ATOM 0 HA LEU A 52 -14.553 -11.096 -10.758 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -15.358 -9.405 -12.334 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -14.693 -10.281 -13.698 1.00 0.00 H new ATOM 0 HG LEU A 52 -16.195 -12.271 -12.937 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -18.195 -11.593 -11.639 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -16.708 -11.354 -10.691 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -17.516 -9.959 -11.445 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -18.153 -11.309 -14.123 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -17.471 -9.677 -13.925 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -16.635 -10.874 -14.943 1.00 0.00 H new ATOM 866 N GLY A 53 -14.759 -13.469 -11.658 1.00 0.00 N ATOM 867 CA GLY A 53 -14.649 -14.900 -12.058 1.00 0.00 C ATOM 868 C GLY A 53 -13.840 -15.667 -11.011 1.00 0.00 C ATOM 869 O GLY A 53 -14.283 -16.666 -10.480 1.00 0.00 O ATOM 0 H GLY A 53 -15.449 -13.272 -10.933 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -15.642 -15.338 -12.156 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -14.168 -14.979 -13.033 1.00 0.00 H new ATOM 873 N TYR A 54 -12.654 -15.211 -10.712 1.00 0.00 N ATOM 874 CA TYR A 54 -11.818 -15.919 -9.702 1.00 0.00 C ATOM 875 C TYR A 54 -12.413 -15.712 -8.308 1.00 0.00 C ATOM 876 O TYR A 54 -12.205 -16.502 -7.410 1.00 0.00 O ATOM 877 CB TYR A 54 -10.393 -15.362 -9.736 1.00 0.00 C ATOM 878 CG TYR A 54 -9.417 -16.494 -9.948 1.00 0.00 C ATOM 879 CD1 TYR A 54 -9.303 -17.510 -8.989 1.00 0.00 C ATOM 880 CD2 TYR A 54 -8.626 -16.530 -11.104 1.00 0.00 C ATOM 881 CE1 TYR A 54 -8.398 -18.561 -9.186 1.00 0.00 C ATOM 882 CE2 TYR A 54 -7.721 -17.581 -11.301 1.00 0.00 C ATOM 883 CZ TYR A 54 -7.607 -18.596 -10.343 1.00 0.00 C ATOM 884 OH TYR A 54 -6.715 -19.631 -10.537 1.00 0.00 O ATOM 0 H TYR A 54 -12.229 -14.380 -11.123 1.00 0.00 H new ATOM 0 HA TYR A 54 -11.797 -16.984 -9.933 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -10.296 -14.629 -10.537 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -10.170 -14.845 -8.802 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -9.913 -17.483 -8.098 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -8.714 -15.747 -11.843 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -8.310 -19.344 -8.447 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -7.111 -17.608 -12.192 1.00 0.00 H new ATOM 0 HH TYR A 54 -6.247 -19.504 -11.389 1.00 0.00 H new ATOM 894 N GLU A 55 -13.156 -14.655 -8.120 1.00 0.00 N ATOM 895 CA GLU A 55 -13.764 -14.401 -6.784 1.00 0.00 C ATOM 896 C GLU A 55 -12.700 -14.567 -5.696 1.00 0.00 C ATOM 897 O GLU A 55 -12.556 -15.623 -5.112 1.00 0.00 O ATOM 898 CB GLU A 55 -14.899 -15.399 -6.543 1.00 0.00 C ATOM 899 CG GLU A 55 -16.091 -14.676 -5.915 1.00 0.00 C ATOM 900 CD GLU A 55 -16.309 -15.193 -4.491 1.00 0.00 C ATOM 901 OE1 GLU A 55 -15.325 -15.427 -3.810 1.00 0.00 O ATOM 902 OE2 GLU A 55 -17.457 -15.343 -4.106 1.00 0.00 O ATOM 0 H GLU A 55 -13.368 -13.957 -8.833 1.00 0.00 H new ATOM 0 HA GLU A 55 -14.158 -13.385 -6.753 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -15.196 -15.862 -7.484 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -14.559 -16.200 -5.887 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -15.911 -13.601 -5.899 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -16.987 -14.841 -6.514 1.00 0.00 H new ATOM 909 N GLY A 56 -11.956 -13.533 -5.417 1.00 0.00 N ATOM 910 CA GLY A 56 -10.904 -13.634 -4.366 1.00 0.00 C ATOM 911 C GLY A 56 -9.625 -12.948 -4.851 1.00 0.00 C ATOM 912 O GLY A 56 -8.690 -12.752 -4.101 1.00 0.00 O ATOM 0 H GLY A 56 -12.031 -12.623 -5.871 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -11.251 -13.168 -3.444 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -10.703 -14.681 -4.138 1.00 0.00 H new ATOM 916 N HIS A 57 -9.576 -12.585 -6.103 1.00 0.00 N ATOM 917 CA HIS A 57 -8.357 -11.915 -6.638 1.00 0.00 C ATOM 918 C HIS A 57 -8.565 -10.399 -6.643 1.00 0.00 C ATOM 919 O HIS A 57 -9.172 -9.850 -7.542 1.00 0.00 O ATOM 920 CB HIS A 57 -8.096 -12.400 -8.066 1.00 0.00 C ATOM 921 CG HIS A 57 -7.163 -13.578 -8.034 1.00 0.00 C ATOM 922 ND1 HIS A 57 -7.134 -14.525 -9.046 1.00 0.00 N ATOM 923 CD2 HIS A 57 -6.218 -13.977 -7.121 1.00 0.00 C ATOM 924 CE1 HIS A 57 -6.202 -15.439 -8.721 1.00 0.00 C ATOM 925 NE2 HIS A 57 -5.612 -15.152 -7.556 1.00 0.00 N ATOM 0 H HIS A 57 -10.327 -12.723 -6.779 1.00 0.00 H new ATOM 0 HA HIS A 57 -7.502 -12.160 -6.008 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -9.035 -12.680 -8.544 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -7.663 -11.596 -8.661 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -7.714 -14.528 -9.885 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -5.981 -13.458 -6.204 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -5.960 -16.300 -9.327 1.00 0.00 H new ATOM 933 N GLU A 58 -8.066 -9.718 -5.648 1.00 0.00 N ATOM 934 CA GLU A 58 -8.235 -8.238 -5.600 1.00 0.00 C ATOM 935 C GLU A 58 -6.939 -7.563 -6.054 1.00 0.00 C ATOM 936 O GLU A 58 -5.948 -7.559 -5.351 1.00 0.00 O ATOM 937 CB GLU A 58 -8.561 -7.804 -4.170 1.00 0.00 C ATOM 938 CG GLU A 58 -8.557 -6.276 -4.087 1.00 0.00 C ATOM 939 CD GLU A 58 -9.120 -5.835 -2.735 1.00 0.00 C ATOM 940 OE1 GLU A 58 -10.318 -5.960 -2.544 1.00 0.00 O ATOM 941 OE2 GLU A 58 -8.342 -5.381 -1.912 1.00 0.00 O ATOM 0 H GLU A 58 -7.549 -10.122 -4.867 1.00 0.00 H new ATOM 0 HA GLU A 58 -9.051 -7.945 -6.261 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.536 -8.192 -3.874 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.829 -8.218 -3.477 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.542 -5.898 -4.211 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -9.155 -5.856 -4.896 1.00 0.00 H new ATOM 948 N CYS A 59 -6.937 -6.992 -7.227 1.00 0.00 N ATOM 949 CA CYS A 59 -5.705 -6.320 -7.722 1.00 0.00 C ATOM 950 C CYS A 59 -5.873 -4.803 -7.625 1.00 0.00 C ATOM 951 O CYS A 59 -6.971 -4.295 -7.505 1.00 0.00 O ATOM 952 CB CYS A 59 -5.460 -6.709 -9.181 1.00 0.00 C ATOM 953 SG CYS A 59 -5.461 -8.512 -9.334 1.00 0.00 S ATOM 0 H CYS A 59 -7.734 -6.962 -7.862 1.00 0.00 H new ATOM 0 HA CYS A 59 -4.856 -6.632 -7.113 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -6.233 -6.279 -9.818 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -4.506 -6.305 -9.521 1.00 0.00 H new ATOM 0 HG CYS A 59 -5.048 -8.847 -10.520 1.00 0.00 H new ATOM 959 N ILE A 60 -4.792 -4.079 -7.683 1.00 0.00 N ATOM 960 CA ILE A 60 -4.874 -2.594 -7.605 1.00 0.00 C ATOM 961 C ILE A 60 -4.049 -2.001 -8.745 1.00 0.00 C ATOM 962 O ILE A 60 -2.930 -2.403 -8.982 1.00 0.00 O ATOM 963 CB ILE A 60 -4.317 -2.107 -6.262 1.00 0.00 C ATOM 964 CG1 ILE A 60 -3.304 -3.121 -5.720 1.00 0.00 C ATOM 965 CG2 ILE A 60 -5.463 -1.952 -5.261 1.00 0.00 C ATOM 966 CD1 ILE A 60 -2.596 -2.534 -4.498 1.00 0.00 C ATOM 0 H ILE A 60 -3.849 -4.454 -7.782 1.00 0.00 H new ATOM 0 HA ILE A 60 -5.914 -2.278 -7.688 1.00 0.00 H new ATOM 0 HB ILE A 60 -3.823 -1.146 -6.407 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -3.811 -4.047 -5.449 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -2.575 -3.370 -6.491 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.068 -1.606 -4.306 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.182 -1.226 -5.641 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -5.957 -2.914 -5.122 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -1.876 -3.256 -4.113 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -2.076 -1.619 -4.783 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -3.331 -2.308 -3.726 1.00 0.00 H new ATOM 978 N LEU A 61 -4.589 -1.057 -9.461 1.00 0.00 N ATOM 979 CA LEU A 61 -3.824 -0.462 -10.590 1.00 0.00 C ATOM 980 C LEU A 61 -3.159 0.836 -10.138 1.00 0.00 C ATOM 981 O LEU A 61 -3.804 1.747 -9.651 1.00 0.00 O ATOM 982 CB LEU A 61 -4.772 -0.170 -11.754 1.00 0.00 C ATOM 983 CG LEU A 61 -3.973 -0.121 -13.057 1.00 0.00 C ATOM 984 CD1 LEU A 61 -4.466 -1.221 -13.999 1.00 0.00 C ATOM 985 CD2 LEU A 61 -4.168 1.244 -13.722 1.00 0.00 C ATOM 0 H LEU A 61 -5.523 -0.673 -9.315 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.057 -1.166 -10.913 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.541 -0.941 -11.814 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -5.284 0.779 -11.592 1.00 0.00 H new ATOM 0 HG LEU A 61 -2.916 -0.274 -12.842 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.897 -1.187 -14.928 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -4.330 -2.193 -13.526 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -5.523 -1.068 -14.215 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.599 1.281 -14.651 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.226 1.396 -13.938 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -3.818 2.029 -13.051 1.00 0.00 H new ATOM 997 N LEU A 62 -1.867 0.925 -10.301 1.00 0.00 N ATOM 998 CA LEU A 62 -1.145 2.159 -9.885 1.00 0.00 C ATOM 999 C LEU A 62 0.102 2.337 -10.753 1.00 0.00 C ATOM 1000 O LEU A 62 0.457 3.437 -11.127 1.00 0.00 O ATOM 1001 CB LEU A 62 -0.730 2.042 -8.417 1.00 0.00 C ATOM 1002 CG LEU A 62 0.088 3.271 -8.017 1.00 0.00 C ATOM 1003 CD1 LEU A 62 -0.842 4.340 -7.440 1.00 0.00 C ATOM 1004 CD2 LEU A 62 1.121 2.873 -6.960 1.00 0.00 C ATOM 0 H LEU A 62 -1.280 0.195 -10.705 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.802 3.020 -10.008 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -1.614 1.959 -7.784 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -0.143 1.136 -8.265 1.00 0.00 H new ATOM 0 HG LEU A 62 0.597 3.668 -8.895 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.258 5.215 -7.155 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -1.579 4.624 -8.191 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -1.352 3.943 -6.562 1.00 0.00 H new ATOM 0 HD21 LEU A 62 1.705 3.748 -6.674 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.610 2.475 -6.083 1.00 0.00 H new ATOM 0 HD23 LEU A 62 1.785 2.112 -7.369 1.00 0.00 H new ATOM 1016 N ASP A 63 0.770 1.263 -11.081 1.00 0.00 N ATOM 1017 CA ASP A 63 1.988 1.382 -11.928 1.00 0.00 C ATOM 1018 C ASP A 63 1.680 2.292 -13.115 1.00 0.00 C ATOM 1019 O ASP A 63 2.369 3.261 -13.363 1.00 0.00 O ATOM 1020 CB ASP A 63 2.404 -0.001 -12.435 1.00 0.00 C ATOM 1021 CG ASP A 63 3.896 0.011 -12.779 1.00 0.00 C ATOM 1022 OD1 ASP A 63 4.565 0.954 -12.392 1.00 0.00 O ATOM 1023 OD2 ASP A 63 4.342 -0.923 -13.425 1.00 0.00 O ATOM 0 H ASP A 63 0.525 0.314 -10.800 1.00 0.00 H new ATOM 0 HA ASP A 63 2.803 1.804 -11.340 1.00 0.00 H new ATOM 0 HB2 ASP A 63 2.201 -0.755 -11.675 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.819 -0.269 -13.315 1.00 0.00 H new ATOM 1028 N TYR A 64 0.640 1.996 -13.848 1.00 0.00 N ATOM 1029 CA TYR A 64 0.286 2.857 -15.011 1.00 0.00 C ATOM 1030 C TYR A 64 -1.106 3.451 -14.792 1.00 0.00 C ATOM 1031 O TYR A 64 -1.959 3.400 -15.655 1.00 0.00 O ATOM 1032 CB TYR A 64 0.294 2.022 -16.294 1.00 0.00 C ATOM 1033 CG TYR A 64 1.143 2.712 -17.335 1.00 0.00 C ATOM 1034 CD1 TYR A 64 0.590 3.726 -18.130 1.00 0.00 C ATOM 1035 CD2 TYR A 64 2.482 2.339 -17.505 1.00 0.00 C ATOM 1036 CE1 TYR A 64 1.379 4.366 -19.096 1.00 0.00 C ATOM 1037 CE2 TYR A 64 3.270 2.980 -18.471 1.00 0.00 C ATOM 1038 CZ TYR A 64 2.720 3.994 -19.266 1.00 0.00 C ATOM 1039 OH TYR A 64 3.496 4.625 -20.215 1.00 0.00 O ATOM 0 H TYR A 64 0.023 1.199 -13.692 1.00 0.00 H new ATOM 0 HA TYR A 64 1.016 3.661 -15.105 1.00 0.00 H new ATOM 0 HB2 TYR A 64 0.687 1.026 -16.090 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -0.723 1.894 -16.664 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -0.443 4.014 -17.998 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.907 1.558 -16.892 1.00 0.00 H new ATOM 0 HE1 TYR A 64 0.953 5.146 -19.710 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.302 2.692 -18.603 1.00 0.00 H new ATOM 0 HH TYR A 64 4.400 4.248 -20.201 1.00 0.00 H new ATOM 1049 N LEU A 65 -1.341 4.011 -13.636 1.00 0.00 N ATOM 1050 CA LEU A 65 -2.676 4.607 -13.351 1.00 0.00 C ATOM 1051 C LEU A 65 -3.008 5.655 -14.415 1.00 0.00 C ATOM 1052 O LEU A 65 -4.153 6.013 -14.608 1.00 0.00 O ATOM 1053 CB LEU A 65 -2.651 5.272 -11.973 1.00 0.00 C ATOM 1054 CG LEU A 65 -1.663 6.440 -11.985 1.00 0.00 C ATOM 1055 CD1 LEU A 65 -2.242 7.610 -11.188 1.00 0.00 C ATOM 1056 CD2 LEU A 65 -0.344 5.996 -11.350 1.00 0.00 C ATOM 0 H LEU A 65 -0.664 4.081 -12.876 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.434 3.823 -13.366 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.648 5.628 -11.712 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -2.362 4.546 -11.213 1.00 0.00 H new ATOM 0 HG LEU A 65 -1.486 6.755 -13.014 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -1.537 8.441 -11.198 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.183 7.927 -11.638 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.420 7.297 -10.159 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.361 6.827 -11.358 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.523 5.681 -10.322 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.071 5.163 -11.917 1.00 0.00 H new ATOM 1068 N ASN A 66 -2.019 6.148 -15.107 1.00 0.00 N ATOM 1069 CA ASN A 66 -2.282 7.172 -16.159 1.00 0.00 C ATOM 1070 C ASN A 66 -2.720 8.480 -15.498 1.00 0.00 C ATOM 1071 O ASN A 66 -3.159 8.498 -14.365 1.00 0.00 O ATOM 1072 CB ASN A 66 -3.392 6.676 -17.090 1.00 0.00 C ATOM 1073 CG ASN A 66 -3.447 7.560 -18.336 1.00 0.00 C ATOM 1074 OD1 ASN A 66 -2.427 7.887 -18.909 1.00 0.00 O ATOM 1075 ND2 ASN A 66 -4.604 7.965 -18.784 1.00 0.00 N ATOM 0 H ASN A 66 -1.040 5.887 -14.990 1.00 0.00 H new ATOM 0 HA ASN A 66 -1.373 7.341 -16.736 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -3.207 5.640 -17.374 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -4.351 6.698 -16.573 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -4.651 8.555 -19.614 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -5.461 7.691 -18.304 1.00 0.00 H new ATOM 1082 N TYR A 67 -2.606 9.576 -16.196 1.00 0.00 N ATOM 1083 CA TYR A 67 -3.017 10.881 -15.607 1.00 0.00 C ATOM 1084 C TYR A 67 -4.096 11.519 -16.485 1.00 0.00 C ATOM 1085 O TYR A 67 -4.340 11.091 -17.595 1.00 0.00 O ATOM 1086 CB TYR A 67 -1.808 11.817 -15.528 1.00 0.00 C ATOM 1087 CG TYR A 67 -0.871 11.535 -16.679 1.00 0.00 C ATOM 1088 CD1 TYR A 67 -1.308 11.715 -17.998 1.00 0.00 C ATOM 1089 CD2 TYR A 67 0.435 11.092 -16.428 1.00 0.00 C ATOM 1090 CE1 TYR A 67 -0.440 11.454 -19.066 1.00 0.00 C ATOM 1091 CE2 TYR A 67 1.303 10.831 -17.495 1.00 0.00 C ATOM 1092 CZ TYR A 67 0.866 11.011 -18.815 1.00 0.00 C ATOM 1093 OH TYR A 67 1.721 10.753 -19.867 1.00 0.00 O ATOM 0 H TYR A 67 -2.246 9.624 -17.149 1.00 0.00 H new ATOM 0 HA TYR A 67 -3.411 10.715 -14.604 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -2.137 12.856 -15.560 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -1.288 11.677 -14.580 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -2.315 12.055 -18.191 1.00 0.00 H new ATOM 0 HD2 TYR A 67 0.772 10.952 -15.411 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -0.777 11.594 -20.083 1.00 0.00 H new ATOM 0 HE2 TYR A 67 2.310 10.491 -17.301 1.00 0.00 H new ATOM 0 HH TYR A 67 2.587 10.456 -19.519 1.00 0.00 H new ATOM 1103 N ARG A 68 -4.746 12.539 -15.995 1.00 0.00 N ATOM 1104 CA ARG A 68 -5.809 13.201 -16.801 1.00 0.00 C ATOM 1105 C ARG A 68 -5.401 14.647 -17.094 1.00 0.00 C ATOM 1106 O ARG A 68 -4.640 15.247 -16.361 1.00 0.00 O ATOM 1107 CB ARG A 68 -7.123 13.187 -16.019 1.00 0.00 C ATOM 1108 CG ARG A 68 -8.009 12.049 -16.532 1.00 0.00 C ATOM 1109 CD ARG A 68 -8.468 12.360 -17.956 1.00 0.00 C ATOM 1110 NE ARG A 68 -8.969 11.113 -18.599 1.00 0.00 N ATOM 1111 CZ ARG A 68 -8.844 10.947 -19.888 1.00 0.00 C ATOM 1112 NH1 ARG A 68 -8.821 11.984 -20.681 1.00 0.00 N ATOM 1113 NH2 ARG A 68 -8.741 9.744 -20.384 1.00 0.00 N ATOM 0 H ARG A 68 -4.587 12.942 -15.072 1.00 0.00 H new ATOM 0 HA ARG A 68 -5.941 12.665 -17.741 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -6.924 13.056 -14.955 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -7.637 14.142 -16.133 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -7.458 11.109 -16.514 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -8.873 11.925 -15.879 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -9.254 13.115 -17.940 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -7.641 12.773 -18.534 1.00 0.00 H new ATOM 0 HE ARG A 68 -9.410 10.389 -18.032 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -8.901 12.924 -20.294 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -8.723 11.854 -21.688 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -8.758 8.934 -19.765 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -8.643 9.614 -21.391 1.00 0.00 H new ATOM 1127 N GLN A 69 -5.902 15.211 -18.159 1.00 0.00 N ATOM 1128 CA GLN A 69 -5.540 16.617 -18.498 1.00 0.00 C ATOM 1129 C GLN A 69 -6.494 17.576 -17.786 1.00 0.00 C ATOM 1130 O GLN A 69 -7.271 18.272 -18.410 1.00 0.00 O ATOM 1131 CB GLN A 69 -5.645 16.820 -20.011 1.00 0.00 C ATOM 1132 CG GLN A 69 -4.632 17.878 -20.454 1.00 0.00 C ATOM 1133 CD GLN A 69 -5.347 18.970 -21.250 1.00 0.00 C ATOM 1134 OE1 GLN A 69 -6.552 19.103 -21.172 1.00 0.00 O ATOM 1135 NE2 GLN A 69 -4.653 19.763 -22.019 1.00 0.00 N ATOM 0 H GLN A 69 -6.546 14.760 -18.809 1.00 0.00 H new ATOM 0 HA GLN A 69 -4.518 16.817 -18.175 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -5.455 15.880 -20.529 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -6.654 17.133 -20.278 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -4.139 18.312 -19.584 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -3.854 17.419 -21.064 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -3.641 19.652 -22.085 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -5.122 20.494 -22.554 1.00 0.00 H new ATOM 1144 N ASP A 70 -6.441 17.622 -16.482 1.00 0.00 N ATOM 1145 CA ASP A 70 -7.344 18.539 -15.733 1.00 0.00 C ATOM 1146 C ASP A 70 -8.757 18.442 -16.310 1.00 0.00 C ATOM 1147 O ASP A 70 -9.368 19.435 -16.654 1.00 0.00 O ATOM 1148 CB ASP A 70 -6.834 19.976 -15.866 1.00 0.00 C ATOM 1149 CG ASP A 70 -5.582 20.152 -15.005 1.00 0.00 C ATOM 1150 OD1 ASP A 70 -4.540 19.658 -15.403 1.00 0.00 O ATOM 1151 OD2 ASP A 70 -5.687 20.777 -13.963 1.00 0.00 O ATOM 0 H ASP A 70 -5.812 17.064 -15.905 1.00 0.00 H new ATOM 0 HA ASP A 70 -7.361 18.256 -14.680 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -6.606 20.198 -16.909 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -7.606 20.678 -15.552 1.00 0.00 H new ATOM 1156 N THR A 71 -9.282 17.253 -16.420 1.00 0.00 N ATOM 1157 CA THR A 71 -10.655 17.092 -16.975 1.00 0.00 C ATOM 1158 C THR A 71 -11.410 16.028 -16.177 1.00 0.00 C ATOM 1159 O THR A 71 -10.948 14.916 -16.017 1.00 0.00 O ATOM 1160 CB THR A 71 -10.564 16.661 -18.442 1.00 0.00 C ATOM 1161 OG1 THR A 71 -11.862 16.331 -18.918 1.00 0.00 O ATOM 1162 CG2 THR A 71 -9.650 15.441 -18.562 1.00 0.00 C ATOM 0 H THR A 71 -8.819 16.385 -16.149 1.00 0.00 H new ATOM 0 HA THR A 71 -11.187 18.041 -16.906 1.00 0.00 H new ATOM 0 HB THR A 71 -10.155 17.478 -19.036 1.00 0.00 H new ATOM 0 HG1 THR A 71 -11.806 16.056 -19.857 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.586 15.135 -19.606 1.00 0.00 H new ATOM 0 HG22 THR A 71 -8.655 15.695 -18.197 1.00 0.00 H new ATOM 0 HG23 THR A 71 -10.057 14.622 -17.969 1.00 0.00 H new ATOM 1170 N LEU A 72 -12.567 16.360 -15.674 1.00 0.00 N ATOM 1171 CA LEU A 72 -13.349 15.365 -14.887 1.00 0.00 C ATOM 1172 C LEU A 72 -13.455 14.059 -15.677 1.00 0.00 C ATOM 1173 O LEU A 72 -13.505 12.984 -15.114 1.00 0.00 O ATOM 1174 CB LEU A 72 -14.752 15.916 -14.623 1.00 0.00 C ATOM 1175 CG LEU A 72 -15.057 15.845 -13.125 1.00 0.00 C ATOM 1176 CD1 LEU A 72 -15.857 17.080 -12.709 1.00 0.00 C ATOM 1177 CD2 LEU A 72 -15.876 14.586 -12.831 1.00 0.00 C ATOM 0 H LEU A 72 -13.004 17.276 -15.774 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.847 15.176 -13.938 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.820 16.947 -14.970 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -15.491 15.342 -15.183 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.122 15.811 -12.565 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.075 17.030 -11.642 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -15.276 17.978 -12.919 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.792 17.114 -13.269 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -16.094 14.534 -11.764 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.811 14.621 -13.391 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -15.308 13.705 -13.128 1.00 0.00 H new ATOM 1189 N ASP A 73 -13.488 14.144 -16.978 1.00 0.00 N ATOM 1190 CA ASP A 73 -13.589 12.908 -17.805 1.00 0.00 C ATOM 1191 C ASP A 73 -14.983 12.298 -17.642 1.00 0.00 C ATOM 1192 O ASP A 73 -15.182 11.376 -16.877 1.00 0.00 O ATOM 1193 CB ASP A 73 -12.535 11.899 -17.345 1.00 0.00 C ATOM 1194 CG ASP A 73 -12.012 11.121 -18.554 1.00 0.00 C ATOM 1195 OD1 ASP A 73 -11.269 11.700 -19.330 1.00 0.00 O ATOM 1196 OD2 ASP A 73 -12.365 9.961 -18.685 1.00 0.00 O ATOM 0 H ASP A 73 -13.449 15.016 -17.505 1.00 0.00 H new ATOM 0 HA ASP A 73 -13.421 13.157 -18.853 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -11.714 12.416 -16.849 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -12.967 11.213 -16.616 1.00 0.00 H new ATOM 1201 N ARG A 74 -15.949 12.805 -18.357 1.00 0.00 N ATOM 1202 CA ARG A 74 -17.329 12.254 -18.243 1.00 0.00 C ATOM 1203 C ARG A 74 -17.343 10.805 -18.734 1.00 0.00 C ATOM 1204 O ARG A 74 -18.167 10.009 -18.326 1.00 0.00 O ATOM 1205 CB ARG A 74 -18.283 13.090 -19.099 1.00 0.00 C ATOM 1206 CG ARG A 74 -19.561 13.374 -18.308 1.00 0.00 C ATOM 1207 CD ARG A 74 -20.412 14.396 -19.063 1.00 0.00 C ATOM 1208 NE ARG A 74 -21.199 15.205 -18.090 1.00 0.00 N ATOM 1209 CZ ARG A 74 -21.309 16.496 -18.251 1.00 0.00 C ATOM 1210 NH1 ARG A 74 -20.246 17.217 -18.484 1.00 0.00 N ATOM 1211 NH2 ARG A 74 -22.480 17.064 -18.182 1.00 0.00 N ATOM 0 H ARG A 74 -15.843 13.577 -19.015 1.00 0.00 H new ATOM 0 HA ARG A 74 -17.648 12.288 -17.201 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -17.805 14.026 -19.387 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -18.523 12.559 -20.020 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -20.124 12.452 -18.163 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -19.311 13.754 -17.317 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -19.773 15.047 -19.660 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -21.083 13.886 -19.755 1.00 0.00 H new ATOM 0 HE ARG A 74 -21.652 14.750 -17.298 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -19.330 16.772 -18.540 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -20.331 18.226 -18.610 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -23.311 16.500 -18.002 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -22.566 18.073 -18.308 1.00 0.00 H new ATOM 1225 N LEU A 75 -16.440 10.456 -19.609 1.00 0.00 N ATOM 1226 CA LEU A 75 -16.401 9.061 -20.132 1.00 0.00 C ATOM 1227 C LEU A 75 -16.343 8.071 -18.965 1.00 0.00 C ATOM 1228 O LEU A 75 -17.068 7.097 -18.929 1.00 0.00 O ATOM 1229 CB LEU A 75 -15.163 8.882 -21.011 1.00 0.00 C ATOM 1230 CG LEU A 75 -15.580 8.347 -22.381 1.00 0.00 C ATOM 1231 CD1 LEU A 75 -16.623 9.280 -22.997 1.00 0.00 C ATOM 1232 CD2 LEU A 75 -14.355 8.278 -23.295 1.00 0.00 C ATOM 0 H LEU A 75 -15.725 11.079 -19.985 1.00 0.00 H new ATOM 0 HA LEU A 75 -17.299 8.872 -20.720 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -14.644 9.834 -21.124 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.465 8.192 -20.537 1.00 0.00 H new ATOM 0 HG LEU A 75 -16.006 7.350 -22.268 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -16.920 8.899 -23.974 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -17.496 9.330 -22.346 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -16.197 10.277 -23.111 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -14.651 7.897 -24.272 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -13.929 9.275 -23.408 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -13.611 7.613 -22.856 1.00 0.00 H new ATOM 1244 N LYS A 76 -15.479 8.307 -18.015 1.00 0.00 N ATOM 1245 CA LYS A 76 -15.371 7.375 -16.856 1.00 0.00 C ATOM 1246 C LYS A 76 -16.771 7.025 -16.345 1.00 0.00 C ATOM 1247 O LYS A 76 -17.071 5.880 -16.065 1.00 0.00 O ATOM 1248 CB LYS A 76 -14.573 8.047 -15.737 1.00 0.00 C ATOM 1249 CG LYS A 76 -13.238 8.546 -16.292 1.00 0.00 C ATOM 1250 CD LYS A 76 -12.318 8.937 -15.133 1.00 0.00 C ATOM 1251 CE LYS A 76 -11.284 7.832 -14.903 1.00 0.00 C ATOM 1252 NZ LYS A 76 -9.928 8.338 -15.256 1.00 0.00 N ATOM 0 H LYS A 76 -14.844 9.105 -17.991 1.00 0.00 H new ATOM 0 HA LYS A 76 -14.863 6.463 -17.170 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -15.140 8.880 -15.321 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -14.400 7.341 -14.924 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -12.770 7.769 -16.896 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -13.401 9.403 -16.946 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.816 9.878 -15.356 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -12.904 9.095 -14.228 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -11.304 7.512 -13.861 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.527 6.960 -15.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -9.440 7.638 -15.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.017 9.233 -15.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -9.380 8.497 -14.387 1.00 0.00 H new ATOM 1266 N GLU A 77 -17.627 8.002 -16.219 1.00 0.00 N ATOM 1267 CA GLU A 77 -19.007 7.728 -15.723 1.00 0.00 C ATOM 1268 C GLU A 77 -19.630 6.594 -16.539 1.00 0.00 C ATOM 1269 O GLU A 77 -20.216 5.677 -15.997 1.00 0.00 O ATOM 1270 CB GLU A 77 -19.859 8.991 -15.869 1.00 0.00 C ATOM 1271 CG GLU A 77 -20.501 9.332 -14.522 1.00 0.00 C ATOM 1272 CD GLU A 77 -21.807 10.091 -14.757 1.00 0.00 C ATOM 1273 OE1 GLU A 77 -22.020 10.533 -15.874 1.00 0.00 O ATOM 1274 OE2 GLU A 77 -22.575 10.217 -13.816 1.00 0.00 O ATOM 0 H GLU A 77 -17.431 8.979 -16.438 1.00 0.00 H new ATOM 0 HA GLU A 77 -18.965 7.436 -14.674 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -19.241 9.822 -16.210 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -20.631 8.837 -16.623 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -20.695 8.420 -13.958 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -19.819 9.937 -13.925 1.00 0.00 H new ATOM 1281 N ARG A 78 -19.508 6.646 -17.838 1.00 0.00 N ATOM 1282 CA ARG A 78 -20.094 5.568 -18.688 1.00 0.00 C ATOM 1283 C ARG A 78 -19.805 4.206 -18.056 1.00 0.00 C ATOM 1284 O ARG A 78 -20.701 3.519 -17.605 1.00 0.00 O ATOM 1285 CB ARG A 78 -19.471 5.625 -20.085 1.00 0.00 C ATOM 1286 CG ARG A 78 -20.548 5.980 -21.112 1.00 0.00 C ATOM 1287 CD ARG A 78 -19.951 6.894 -22.183 1.00 0.00 C ATOM 1288 NE ARG A 78 -21.021 7.319 -23.129 1.00 0.00 N ATOM 1289 CZ ARG A 78 -21.598 6.438 -23.901 1.00 0.00 C ATOM 1290 NH1 ARG A 78 -20.996 6.020 -24.980 1.00 0.00 N ATOM 1291 NH2 ARG A 78 -22.778 5.974 -23.592 1.00 0.00 N ATOM 0 H ARG A 78 -19.028 7.388 -18.348 1.00 0.00 H new ATOM 0 HA ARG A 78 -21.172 5.711 -18.764 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -18.673 6.367 -20.108 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -19.020 4.664 -20.333 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -20.941 5.073 -21.571 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -21.385 6.476 -20.620 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -19.495 7.768 -21.717 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -19.161 6.372 -22.722 1.00 0.00 H new ATOM 0 HE ARG A 78 -21.303 8.298 -23.174 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -20.073 6.381 -25.222 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -21.448 5.332 -25.582 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -23.249 6.300 -22.748 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -23.229 5.286 -24.195 1.00 0.00 H new ATOM 1305 N LEU A 79 -18.563 3.807 -18.017 1.00 0.00 N ATOM 1306 CA LEU A 79 -18.225 2.488 -17.410 1.00 0.00 C ATOM 1307 C LEU A 79 -16.704 2.333 -17.324 1.00 0.00 C ATOM 1308 O LEU A 79 -16.109 1.544 -18.031 1.00 0.00 O ATOM 1309 CB LEU A 79 -18.807 1.367 -18.274 1.00 0.00 C ATOM 1310 CG LEU A 79 -19.898 0.635 -17.491 1.00 0.00 C ATOM 1311 CD1 LEU A 79 -20.640 -0.324 -18.423 1.00 0.00 C ATOM 1312 CD2 LEU A 79 -19.258 -0.159 -16.350 1.00 0.00 C ATOM 0 H LEU A 79 -17.769 4.336 -18.378 1.00 0.00 H new ATOM 0 HA LEU A 79 -18.648 2.432 -16.407 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -19.220 1.780 -19.195 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -18.021 0.669 -18.562 1.00 0.00 H new ATOM 0 HG LEU A 79 -20.601 1.361 -17.082 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -21.417 -0.845 -17.865 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -21.095 0.239 -19.238 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -19.938 -1.050 -18.832 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -20.034 -0.682 -15.790 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -18.556 -0.884 -16.761 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -18.728 0.523 -15.685 1.00 0.00 H new ATOM 1324 N VAL A 80 -16.072 3.083 -16.463 1.00 0.00 N ATOM 1325 CA VAL A 80 -14.590 2.985 -16.325 1.00 0.00 C ATOM 1326 C VAL A 80 -14.201 1.562 -15.920 1.00 0.00 C ATOM 1327 O VAL A 80 -13.250 0.995 -16.418 1.00 0.00 O ATOM 1328 CB VAL A 80 -14.120 3.977 -15.252 1.00 0.00 C ATOM 1329 CG1 VAL A 80 -14.297 3.373 -13.853 1.00 0.00 C ATOM 1330 CG2 VAL A 80 -12.645 4.314 -15.479 1.00 0.00 C ATOM 0 H VAL A 80 -16.519 3.762 -15.847 1.00 0.00 H new ATOM 0 HA VAL A 80 -14.117 3.224 -17.277 1.00 0.00 H new ATOM 0 HB VAL A 80 -14.720 4.884 -15.323 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -13.959 4.088 -13.103 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -15.349 3.142 -13.687 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -13.708 2.459 -13.774 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -12.311 5.018 -14.717 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -12.050 3.403 -15.417 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -12.522 4.761 -16.465 1.00 0.00 H new ATOM 1340 N GLY A 81 -14.928 0.993 -15.002 1.00 0.00 N ATOM 1341 CA GLY A 81 -14.613 -0.385 -14.529 1.00 0.00 C ATOM 1342 C GLY A 81 -15.035 -1.448 -15.550 1.00 0.00 C ATOM 1343 O GLY A 81 -15.103 -2.618 -15.230 1.00 0.00 O ATOM 0 H GLY A 81 -15.735 1.427 -14.554 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -13.543 -0.468 -14.339 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -15.120 -0.569 -13.582 1.00 0.00 H new ATOM 1347 N ARG A 82 -15.306 -1.068 -16.770 1.00 0.00 N ATOM 1348 CA ARG A 82 -15.706 -2.078 -17.794 1.00 0.00 C ATOM 1349 C ARG A 82 -14.701 -3.226 -17.805 1.00 0.00 C ATOM 1350 O ARG A 82 -13.798 -3.294 -16.994 1.00 0.00 O ATOM 1351 CB ARG A 82 -15.732 -1.415 -19.172 1.00 0.00 C ATOM 1352 CG ARG A 82 -16.943 -1.919 -19.958 1.00 0.00 C ATOM 1353 CD ARG A 82 -17.264 -0.939 -21.088 1.00 0.00 C ATOM 1354 NE ARG A 82 -16.222 -1.045 -22.148 1.00 0.00 N ATOM 1355 CZ ARG A 82 -16.443 -0.545 -23.334 1.00 0.00 C ATOM 1356 NH1 ARG A 82 -16.917 0.665 -23.454 1.00 0.00 N ATOM 1357 NH2 ARG A 82 -16.188 -1.254 -24.399 1.00 0.00 N ATOM 0 H ARG A 82 -15.268 -0.104 -17.102 1.00 0.00 H new ATOM 0 HA ARG A 82 -16.695 -2.467 -17.552 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -15.780 -0.331 -19.065 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -14.814 -1.642 -19.714 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -16.738 -2.908 -20.368 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -17.803 -2.021 -19.296 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -18.247 -1.158 -21.506 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -17.302 0.079 -20.701 1.00 0.00 H new ATOM 0 HE ARG A 82 -15.336 -1.508 -21.947 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -17.115 1.220 -22.621 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -17.090 1.056 -24.380 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -15.816 -2.199 -24.305 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -16.361 -0.863 -25.325 1.00 0.00 H new ATOM 1371 N VAL A 83 -14.849 -4.129 -18.726 1.00 0.00 N ATOM 1372 CA VAL A 83 -13.906 -5.279 -18.801 1.00 0.00 C ATOM 1373 C VAL A 83 -12.818 -4.958 -19.823 1.00 0.00 C ATOM 1374 O VAL A 83 -13.073 -4.839 -21.005 1.00 0.00 O ATOM 1375 CB VAL A 83 -14.664 -6.536 -19.232 1.00 0.00 C ATOM 1376 CG1 VAL A 83 -15.498 -7.056 -18.061 1.00 0.00 C ATOM 1377 CG2 VAL A 83 -15.589 -6.197 -20.403 1.00 0.00 C ATOM 0 H VAL A 83 -15.583 -4.123 -19.434 1.00 0.00 H new ATOM 0 HA VAL A 83 -13.455 -5.453 -17.824 1.00 0.00 H new ATOM 0 HB VAL A 83 -13.951 -7.301 -19.540 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -16.038 -7.952 -18.368 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -14.841 -7.297 -17.225 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -16.210 -6.290 -17.753 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -16.129 -7.092 -20.711 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -16.301 -5.431 -20.095 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -14.996 -5.826 -21.239 1.00 0.00 H new ATOM 1387 N ILE A 84 -11.606 -4.796 -19.369 1.00 0.00 N ATOM 1388 CA ILE A 84 -10.499 -4.455 -20.304 1.00 0.00 C ATOM 1389 C ILE A 84 -9.283 -5.339 -20.018 1.00 0.00 C ATOM 1390 O ILE A 84 -9.270 -6.117 -19.085 1.00 0.00 O ATOM 1391 CB ILE A 84 -10.117 -2.987 -20.105 1.00 0.00 C ATOM 1392 CG1 ILE A 84 -9.781 -2.742 -18.631 1.00 0.00 C ATOM 1393 CG2 ILE A 84 -11.297 -2.097 -20.503 1.00 0.00 C ATOM 1394 CD1 ILE A 84 -8.391 -3.296 -18.317 1.00 0.00 C ATOM 0 H ILE A 84 -11.335 -4.885 -18.390 1.00 0.00 H new ATOM 0 HA ILE A 84 -10.826 -4.621 -21.331 1.00 0.00 H new ATOM 0 HB ILE A 84 -9.251 -2.751 -20.724 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -9.815 -1.674 -18.414 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.525 -3.220 -17.995 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -11.027 -1.050 -20.362 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -11.546 -2.270 -21.550 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -12.159 -2.336 -19.881 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -8.157 -3.119 -17.267 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -8.373 -4.367 -18.517 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -7.651 -2.797 -18.943 1.00 0.00 H new ATOM 1406 N LYS A 85 -8.257 -5.218 -20.817 1.00 0.00 N ATOM 1407 CA LYS A 85 -7.035 -6.042 -20.596 1.00 0.00 C ATOM 1408 C LYS A 85 -5.999 -5.206 -19.843 1.00 0.00 C ATOM 1409 O LYS A 85 -5.966 -3.996 -19.955 1.00 0.00 O ATOM 1410 CB LYS A 85 -6.456 -6.472 -21.946 1.00 0.00 C ATOM 1411 CG LYS A 85 -7.523 -7.222 -22.746 1.00 0.00 C ATOM 1412 CD LYS A 85 -6.922 -7.712 -24.065 1.00 0.00 C ATOM 1413 CE LYS A 85 -6.417 -9.145 -23.897 1.00 0.00 C ATOM 1414 NZ LYS A 85 -5.131 -9.133 -23.144 1.00 0.00 N ATOM 0 H LYS A 85 -8.213 -4.583 -21.614 1.00 0.00 H new ATOM 0 HA LYS A 85 -7.290 -6.928 -20.014 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -6.117 -5.598 -22.503 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -5.586 -7.110 -21.793 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -7.898 -8.067 -22.169 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -8.372 -6.568 -22.942 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -7.671 -7.670 -24.856 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.103 -7.060 -24.367 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -7.157 -9.743 -23.365 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -6.275 -9.609 -24.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -4.539 -9.929 -23.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -4.631 -8.239 -23.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -5.324 -9.222 -22.126 1.00 0.00 H new ATOM 1428 N THR A 86 -5.154 -5.837 -19.077 1.00 0.00 N ATOM 1429 CA THR A 86 -4.125 -5.072 -18.318 1.00 0.00 C ATOM 1430 C THR A 86 -2.928 -5.978 -18.026 1.00 0.00 C ATOM 1431 O THR A 86 -2.973 -7.172 -18.248 1.00 0.00 O ATOM 1432 CB THR A 86 -4.726 -4.581 -16.999 1.00 0.00 C ATOM 1433 OG1 THR A 86 -6.094 -4.961 -16.934 1.00 0.00 O ATOM 1434 CG2 THR A 86 -4.614 -3.059 -16.920 1.00 0.00 C ATOM 0 H THR A 86 -5.131 -6.848 -18.943 1.00 0.00 H new ATOM 0 HA THR A 86 -3.798 -4.217 -18.910 1.00 0.00 H new ATOM 0 HB THR A 86 -4.184 -5.026 -16.165 1.00 0.00 H new ATOM 0 HG1 THR A 86 -6.480 -4.649 -16.089 1.00 0.00 H new ATOM 0 HG21 THR A 86 -5.042 -2.711 -15.980 1.00 0.00 H new ATOM 0 HG22 THR A 86 -3.565 -2.768 -16.970 1.00 0.00 H new ATOM 0 HG23 THR A 86 -5.155 -2.611 -17.753 1.00 0.00 H new ATOM 1442 N ARG A 87 -1.857 -5.423 -17.529 1.00 0.00 N ATOM 1443 CA ARG A 87 -0.663 -6.258 -17.226 1.00 0.00 C ATOM 1444 C ARG A 87 -0.632 -6.569 -15.728 1.00 0.00 C ATOM 1445 O ARG A 87 -1.158 -5.829 -14.921 1.00 0.00 O ATOM 1446 CB ARG A 87 0.603 -5.494 -17.619 1.00 0.00 C ATOM 1447 CG ARG A 87 0.357 -4.743 -18.929 1.00 0.00 C ATOM 1448 CD ARG A 87 -0.068 -5.734 -20.015 1.00 0.00 C ATOM 1449 NE ARG A 87 0.414 -5.254 -21.340 1.00 0.00 N ATOM 1450 CZ ARG A 87 -0.402 -5.219 -22.358 1.00 0.00 C ATOM 1451 NH1 ARG A 87 -1.571 -4.651 -22.239 1.00 0.00 N ATOM 1452 NH2 ARG A 87 -0.048 -5.749 -23.496 1.00 0.00 N ATOM 0 H ARG A 87 -1.758 -4.429 -17.320 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.712 -7.190 -17.790 1.00 0.00 H new ATOM 0 HB2 ARG A 87 0.877 -4.793 -16.831 1.00 0.00 H new ATOM 0 HB3 ARG A 87 1.437 -6.186 -17.735 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -0.417 -3.988 -18.788 1.00 0.00 H new ATOM 0 HG3 ARG A 87 1.262 -4.218 -19.235 1.00 0.00 H new ATOM 0 HD2 ARG A 87 0.342 -6.721 -19.802 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -1.153 -5.835 -20.026 1.00 0.00 H new ATOM 0 HE ARG A 87 1.382 -4.953 -21.452 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -1.847 -4.234 -21.350 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -2.208 -4.624 -23.035 1.00 0.00 H new ATOM 0 HH21 ARG A 87 0.867 -6.191 -23.590 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -0.686 -5.722 -24.292 1.00 0.00 H new ATOM 1466 N VAL A 88 -0.015 -7.652 -15.347 1.00 0.00 N ATOM 1467 CA VAL A 88 0.047 -8.000 -13.901 1.00 0.00 C ATOM 1468 C VAL A 88 1.389 -7.538 -13.338 1.00 0.00 C ATOM 1469 O VAL A 88 2.438 -7.863 -13.859 1.00 0.00 O ATOM 1470 CB VAL A 88 -0.089 -9.513 -13.731 1.00 0.00 C ATOM 1471 CG1 VAL A 88 -0.250 -9.846 -12.246 1.00 0.00 C ATOM 1472 CG2 VAL A 88 -1.321 -10.002 -14.497 1.00 0.00 C ATOM 0 H VAL A 88 0.448 -8.310 -15.973 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.766 -7.507 -13.367 1.00 0.00 H new ATOM 0 HB VAL A 88 0.802 -10.005 -14.121 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -0.347 -10.925 -12.123 1.00 0.00 H new ATOM 0 HG12 VAL A 88 0.625 -9.496 -11.698 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -1.142 -9.355 -11.858 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.420 -11.081 -14.377 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -2.212 -9.510 -14.106 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.210 -9.763 -15.555 1.00 0.00 H new ATOM 1482 N VAL A 89 1.365 -6.764 -12.290 1.00 0.00 N ATOM 1483 CA VAL A 89 2.639 -6.264 -11.710 1.00 0.00 C ATOM 1484 C VAL A 89 3.217 -7.293 -10.734 1.00 0.00 C ATOM 1485 O VAL A 89 4.418 -7.435 -10.615 1.00 0.00 O ATOM 1486 CB VAL A 89 2.372 -4.953 -10.972 1.00 0.00 C ATOM 1487 CG1 VAL A 89 3.629 -4.523 -10.212 1.00 0.00 C ATOM 1488 CG2 VAL A 89 1.996 -3.869 -11.985 1.00 0.00 C ATOM 0 H VAL A 89 0.518 -6.457 -11.811 1.00 0.00 H new ATOM 0 HA VAL A 89 3.358 -6.099 -12.512 1.00 0.00 H new ATOM 0 HB VAL A 89 1.554 -5.096 -10.266 1.00 0.00 H new ATOM 0 HG11 VAL A 89 3.435 -3.588 -9.687 1.00 0.00 H new ATOM 0 HG12 VAL A 89 3.900 -5.294 -9.491 1.00 0.00 H new ATOM 0 HG13 VAL A 89 4.449 -4.380 -10.916 1.00 0.00 H new ATOM 0 HG21 VAL A 89 1.805 -2.932 -11.461 1.00 0.00 H new ATOM 0 HG22 VAL A 89 2.816 -3.730 -12.690 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.099 -4.172 -12.526 1.00 0.00 H new ATOM 1498 N ARG A 90 2.381 -8.013 -10.034 1.00 0.00 N ATOM 1499 CA ARG A 90 2.899 -9.024 -9.070 1.00 0.00 C ATOM 1500 C ARG A 90 1.766 -9.483 -8.149 1.00 0.00 C ATOM 1501 O ARG A 90 1.322 -8.754 -7.284 1.00 0.00 O ATOM 1502 CB ARG A 90 4.013 -8.402 -8.223 1.00 0.00 C ATOM 1503 CG ARG A 90 3.598 -6.995 -7.791 1.00 0.00 C ATOM 1504 CD ARG A 90 4.505 -6.518 -6.655 1.00 0.00 C ATOM 1505 NE ARG A 90 5.049 -5.172 -6.988 1.00 0.00 N ATOM 1506 CZ ARG A 90 6.004 -4.654 -6.263 1.00 0.00 C ATOM 1507 NH1 ARG A 90 5.711 -3.982 -5.182 1.00 0.00 N ATOM 1508 NH2 ARG A 90 7.250 -4.807 -6.618 1.00 0.00 N ATOM 0 H ARG A 90 1.365 -7.944 -10.089 1.00 0.00 H new ATOM 0 HA ARG A 90 3.291 -9.878 -9.622 1.00 0.00 H new ATOM 0 HB2 ARG A 90 4.207 -9.021 -7.347 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.940 -8.360 -8.795 1.00 0.00 H new ATOM 0 HG2 ARG A 90 3.665 -6.310 -8.636 1.00 0.00 H new ATOM 0 HG3 ARG A 90 2.558 -6.996 -7.464 1.00 0.00 H new ATOM 0 HD2 ARG A 90 3.945 -6.475 -5.721 1.00 0.00 H new ATOM 0 HD3 ARG A 90 5.321 -7.225 -6.505 1.00 0.00 H new ATOM 0 HE ARG A 90 4.675 -4.654 -7.783 1.00 0.00 H new ATOM 0 HH11 ARG A 90 4.737 -3.862 -4.904 1.00 0.00 H new ATOM 0 HH12 ARG A 90 6.456 -3.577 -4.615 1.00 0.00 H new ATOM 0 HH21 ARG A 90 7.479 -5.331 -7.462 1.00 0.00 H new ATOM 0 HH22 ARG A 90 7.995 -4.402 -6.051 1.00 0.00 H new ATOM 1522 N ALA A 91 1.300 -10.687 -8.327 1.00 0.00 N ATOM 1523 CA ALA A 91 0.203 -11.198 -7.458 1.00 0.00 C ATOM 1524 C ALA A 91 0.809 -11.918 -6.252 1.00 0.00 C ATOM 1525 O ALA A 91 1.459 -12.935 -6.387 1.00 0.00 O ATOM 1526 CB ALA A 91 -0.665 -12.175 -8.253 1.00 0.00 C ATOM 0 H ALA A 91 1.631 -11.340 -9.037 1.00 0.00 H new ATOM 0 HA ALA A 91 -0.411 -10.365 -7.116 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -1.468 -12.549 -7.617 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.093 -11.663 -9.115 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -0.053 -13.010 -8.594 1.00 0.00 H new ATOM 1532 N ASP A 92 0.607 -11.398 -5.071 1.00 0.00 N ATOM 1533 CA ASP A 92 1.178 -12.056 -3.862 1.00 0.00 C ATOM 1534 C ASP A 92 0.099 -12.187 -2.785 1.00 0.00 C ATOM 1535 O ASP A 92 0.190 -11.597 -1.728 1.00 0.00 O ATOM 1536 CB ASP A 92 2.334 -11.211 -3.322 1.00 0.00 C ATOM 1537 CG ASP A 92 3.523 -12.119 -3.000 1.00 0.00 C ATOM 1538 OD1 ASP A 92 3.463 -12.806 -1.993 1.00 0.00 O ATOM 1539 OD2 ASP A 92 4.472 -12.113 -3.766 1.00 0.00 O ATOM 0 H ASP A 92 0.072 -10.548 -4.892 1.00 0.00 H new ATOM 0 HA ASP A 92 1.542 -13.048 -4.130 1.00 0.00 H new ATOM 0 HB2 ASP A 92 2.624 -10.461 -4.057 1.00 0.00 H new ATOM 0 HB3 ASP A 92 2.019 -10.675 -2.427 1.00 0.00 H new ATOM 1544 N GLY A 93 -0.921 -12.960 -3.041 1.00 0.00 N ATOM 1545 CA GLY A 93 -1.999 -13.129 -2.026 1.00 0.00 C ATOM 1546 C GLY A 93 -3.296 -12.499 -2.538 1.00 0.00 C ATOM 1547 O GLY A 93 -3.433 -12.194 -3.705 1.00 0.00 O ATOM 0 H GLY A 93 -1.054 -13.481 -3.908 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -2.155 -14.188 -1.820 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -1.703 -12.662 -1.087 1.00 0.00 H new ATOM 1551 N LEU A 94 -4.251 -12.304 -1.668 1.00 0.00 N ATOM 1552 CA LEU A 94 -5.543 -11.696 -2.097 1.00 0.00 C ATOM 1553 C LEU A 94 -5.285 -10.321 -2.715 1.00 0.00 C ATOM 1554 O LEU A 94 -6.050 -9.842 -3.529 1.00 0.00 O ATOM 1555 CB LEU A 94 -6.459 -11.547 -0.880 1.00 0.00 C ATOM 1556 CG LEU A 94 -7.888 -11.935 -1.264 1.00 0.00 C ATOM 1557 CD1 LEU A 94 -8.049 -13.452 -1.157 1.00 0.00 C ATOM 1558 CD2 LEU A 94 -8.873 -11.250 -0.315 1.00 0.00 C ATOM 0 H LEU A 94 -4.191 -12.540 -0.677 1.00 0.00 H new ATOM 0 HA LEU A 94 -6.020 -12.338 -2.838 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.106 -12.180 -0.066 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.435 -10.519 -0.518 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.089 -11.619 -2.288 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -9.067 -13.730 -1.430 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.346 -13.941 -1.831 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -7.849 -13.768 -0.133 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.892 -11.525 -0.587 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.673 -11.567 0.708 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.757 -10.169 -0.389 1.00 0.00 H new ATOM 1570 N TYR A 95 -4.213 -9.680 -2.337 1.00 0.00 N ATOM 1571 CA TYR A 95 -3.909 -8.336 -2.906 1.00 0.00 C ATOM 1572 C TYR A 95 -2.868 -8.480 -4.019 1.00 0.00 C ATOM 1573 O TYR A 95 -1.943 -9.260 -3.916 1.00 0.00 O ATOM 1574 CB TYR A 95 -3.357 -7.429 -1.805 1.00 0.00 C ATOM 1575 CG TYR A 95 -4.490 -6.648 -1.181 1.00 0.00 C ATOM 1576 CD1 TYR A 95 -5.375 -7.280 -0.298 1.00 0.00 C ATOM 1577 CD2 TYR A 95 -4.656 -5.291 -1.487 1.00 0.00 C ATOM 1578 CE1 TYR A 95 -6.426 -6.554 0.280 1.00 0.00 C ATOM 1579 CE2 TYR A 95 -5.706 -4.565 -0.910 1.00 0.00 C ATOM 1580 CZ TYR A 95 -6.591 -5.198 -0.026 1.00 0.00 C ATOM 1581 OH TYR A 95 -7.626 -4.484 0.541 1.00 0.00 O ATOM 0 H TYR A 95 -3.535 -10.028 -1.659 1.00 0.00 H new ATOM 0 HA TYR A 95 -4.820 -7.898 -3.313 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -2.852 -8.026 -1.046 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -2.615 -6.746 -2.219 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.248 -8.326 -0.063 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -3.974 -4.804 -2.168 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -7.108 -7.041 0.961 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -5.834 -3.519 -1.146 1.00 0.00 H new ATOM 0 HH TYR A 95 -8.381 -4.451 -0.083 1.00 0.00 H new ATOM 1591 N VAL A 96 -3.013 -7.740 -5.085 1.00 0.00 N ATOM 1592 CA VAL A 96 -2.027 -7.848 -6.200 1.00 0.00 C ATOM 1593 C VAL A 96 -1.766 -6.465 -6.802 1.00 0.00 C ATOM 1594 O VAL A 96 -2.526 -5.538 -6.607 1.00 0.00 O ATOM 1595 CB VAL A 96 -2.588 -8.774 -7.279 1.00 0.00 C ATOM 1596 CG1 VAL A 96 -1.648 -8.783 -8.485 1.00 0.00 C ATOM 1597 CG2 VAL A 96 -2.711 -10.192 -6.717 1.00 0.00 C ATOM 0 H VAL A 96 -3.767 -7.069 -5.232 1.00 0.00 H new ATOM 0 HA VAL A 96 -1.091 -8.252 -5.815 1.00 0.00 H new ATOM 0 HB VAL A 96 -3.570 -8.418 -7.589 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -2.049 -9.444 -9.254 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -1.559 -7.773 -8.885 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -0.665 -9.139 -8.177 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.111 -10.854 -7.485 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.728 -10.547 -6.407 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.382 -10.186 -5.858 1.00 0.00 H new ATOM 1607 N ASP A 97 -0.696 -6.323 -7.541 1.00 0.00 N ATOM 1608 CA ASP A 97 -0.389 -5.003 -8.165 1.00 0.00 C ATOM 1609 C ASP A 97 -0.800 -5.041 -9.640 1.00 0.00 C ATOM 1610 O ASP A 97 -0.918 -6.097 -10.232 1.00 0.00 O ATOM 1611 CB ASP A 97 1.111 -4.722 -8.052 1.00 0.00 C ATOM 1612 CG ASP A 97 1.445 -4.286 -6.625 1.00 0.00 C ATOM 1613 OD1 ASP A 97 0.589 -4.427 -5.767 1.00 0.00 O ATOM 1614 OD2 ASP A 97 2.551 -3.817 -6.414 1.00 0.00 O ATOM 0 H ASP A 97 -0.023 -7.063 -7.739 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.939 -4.214 -7.653 1.00 0.00 H new ATOM 0 HB2 ASP A 97 1.679 -5.615 -8.313 1.00 0.00 H new ATOM 0 HB3 ASP A 97 1.400 -3.943 -8.758 1.00 0.00 H new ATOM 1619 N LEU A 98 -1.043 -3.904 -10.240 1.00 0.00 N ATOM 1620 CA LEU A 98 -1.470 -3.903 -11.670 1.00 0.00 C ATOM 1621 C LEU A 98 -0.810 -2.758 -12.439 1.00 0.00 C ATOM 1622 O LEU A 98 -0.750 -1.630 -11.978 1.00 0.00 O ATOM 1623 CB LEU A 98 -2.990 -3.733 -11.737 1.00 0.00 C ATOM 1624 CG LEU A 98 -3.600 -4.831 -12.613 1.00 0.00 C ATOM 1625 CD1 LEU A 98 -3.233 -4.580 -14.076 1.00 0.00 C ATOM 1626 CD2 LEU A 98 -3.058 -6.196 -12.177 1.00 0.00 C ATOM 0 H LEU A 98 -0.965 -2.984 -9.806 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.168 -4.847 -12.122 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -3.414 -3.779 -10.734 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.237 -2.752 -12.143 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.684 -4.820 -12.504 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.667 -5.362 -14.699 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -3.621 -3.610 -14.387 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -2.149 -4.589 -14.186 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.493 -6.976 -12.801 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.973 -6.208 -12.284 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -3.322 -6.376 -11.135 1.00 0.00 H new ATOM 1638 N ARG A 99 -0.336 -3.048 -13.622 1.00 0.00 N ATOM 1639 CA ARG A 99 0.304 -2.000 -14.465 1.00 0.00 C ATOM 1640 C ARG A 99 -0.471 -1.894 -15.784 1.00 0.00 C ATOM 1641 O ARG A 99 -0.509 -2.822 -16.568 1.00 0.00 O ATOM 1642 CB ARG A 99 1.758 -2.390 -14.750 1.00 0.00 C ATOM 1643 CG ARG A 99 2.372 -1.398 -15.739 1.00 0.00 C ATOM 1644 CD ARG A 99 2.965 -2.160 -16.927 1.00 0.00 C ATOM 1645 NE ARG A 99 4.153 -2.940 -16.474 1.00 0.00 N ATOM 1646 CZ ARG A 99 5.245 -2.941 -17.191 1.00 0.00 C ATOM 1647 NH1 ARG A 99 5.172 -2.851 -18.490 1.00 0.00 N ATOM 1648 NH2 ARG A 99 6.408 -3.032 -16.607 1.00 0.00 N ATOM 0 H ARG A 99 -0.366 -3.977 -14.043 1.00 0.00 H new ATOM 0 HA ARG A 99 0.289 -1.041 -13.947 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.331 -2.397 -13.823 1.00 0.00 H new ATOM 0 HB3 ARG A 99 1.801 -3.400 -15.159 1.00 0.00 H new ATOM 0 HG2 ARG A 99 1.613 -0.697 -16.086 1.00 0.00 H new ATOM 0 HG3 ARG A 99 3.147 -0.811 -15.247 1.00 0.00 H new ATOM 0 HD2 ARG A 99 2.218 -2.830 -17.353 1.00 0.00 H new ATOM 0 HD3 ARG A 99 3.253 -1.462 -17.713 1.00 0.00 H new ATOM 0 HE ARG A 99 4.113 -3.472 -15.605 1.00 0.00 H new ATOM 0 HH11 ARG A 99 4.262 -2.780 -18.946 1.00 0.00 H new ATOM 0 HH12 ARG A 99 6.025 -2.852 -19.050 1.00 0.00 H new ATOM 0 HH21 ARG A 99 6.464 -3.102 -15.591 1.00 0.00 H new ATOM 0 HH22 ARG A 99 7.261 -3.033 -17.166 1.00 0.00 H new ATOM 1662 N ARG A 100 -1.101 -0.777 -16.025 1.00 0.00 N ATOM 1663 CA ARG A 100 -1.886 -0.620 -17.283 1.00 0.00 C ATOM 1664 C ARG A 100 -0.939 -0.539 -18.481 1.00 0.00 C ATOM 1665 O ARG A 100 0.243 -0.298 -18.339 1.00 0.00 O ATOM 1666 CB ARG A 100 -2.721 0.661 -17.208 1.00 0.00 C ATOM 1667 CG ARG A 100 -4.204 0.299 -17.104 1.00 0.00 C ATOM 1668 CD ARG A 100 -4.995 1.072 -18.160 1.00 0.00 C ATOM 1669 NE ARG A 100 -6.286 1.534 -17.576 1.00 0.00 N ATOM 1670 CZ ARG A 100 -6.920 2.544 -18.108 1.00 0.00 C ATOM 1671 NH1 ARG A 100 -7.542 2.398 -19.245 1.00 0.00 N ATOM 1672 NH2 ARG A 100 -6.934 3.699 -17.500 1.00 0.00 N ATOM 0 H ARG A 100 -1.106 0.034 -15.406 1.00 0.00 H new ATOM 0 HA ARG A 100 -2.544 -1.480 -17.403 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -2.419 1.254 -16.345 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -2.547 1.274 -18.093 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -4.338 -0.773 -17.247 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -4.578 0.537 -16.108 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -4.416 1.926 -18.510 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -5.182 0.437 -19.026 1.00 0.00 H new ATOM 0 HE ARG A 100 -6.675 1.061 -16.760 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -7.533 1.495 -19.719 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -8.037 3.187 -19.660 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -6.450 3.812 -16.609 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -7.429 4.488 -17.915 1.00 0.00 H new ATOM 1686 N PHE A 101 -1.456 -0.738 -19.664 1.00 0.00 N ATOM 1687 CA PHE A 101 -0.596 -0.672 -20.878 1.00 0.00 C ATOM 1688 C PHE A 101 -1.384 -0.023 -22.019 1.00 0.00 C ATOM 1689 O PHE A 101 -1.716 -0.661 -22.999 1.00 0.00 O ATOM 1690 CB PHE A 101 -0.177 -2.086 -21.286 1.00 0.00 C ATOM 1691 CG PHE A 101 1.209 -2.051 -21.883 1.00 0.00 C ATOM 1692 CD1 PHE A 101 1.378 -1.790 -23.249 1.00 0.00 C ATOM 1693 CD2 PHE A 101 2.327 -2.277 -21.069 1.00 0.00 C ATOM 1694 CE1 PHE A 101 2.665 -1.756 -23.802 1.00 0.00 C ATOM 1695 CE2 PHE A 101 3.614 -2.243 -21.622 1.00 0.00 C ATOM 1696 CZ PHE A 101 3.783 -1.983 -22.989 1.00 0.00 C ATOM 0 H PHE A 101 -2.439 -0.944 -19.841 1.00 0.00 H new ATOM 0 HA PHE A 101 0.294 -0.080 -20.664 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.194 -2.746 -20.418 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -0.885 -2.492 -22.009 1.00 0.00 H new ATOM 0 HD1 PHE A 101 0.516 -1.615 -23.876 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.197 -2.477 -20.016 1.00 0.00 H new ATOM 0 HE1 PHE A 101 2.795 -1.555 -24.855 1.00 0.00 H new ATOM 0 HE2 PHE A 101 4.476 -2.417 -20.995 1.00 0.00 H new ATOM 0 HZ PHE A 101 4.775 -1.958 -23.415 1.00 0.00 H new ATOM 1706 N PHE A 102 -1.687 1.239 -21.896 1.00 0.00 N ATOM 1707 CA PHE A 102 -2.455 1.931 -22.969 1.00 0.00 C ATOM 1708 C PHE A 102 -1.683 3.167 -23.433 1.00 0.00 C ATOM 1709 O PHE A 102 -1.850 3.550 -24.580 1.00 0.00 O ATOM 1710 CB PHE A 102 -3.821 2.355 -22.423 1.00 0.00 C ATOM 1711 CG PHE A 102 -4.636 2.985 -23.528 1.00 0.00 C ATOM 1712 CD1 PHE A 102 -5.460 2.186 -24.334 1.00 0.00 C ATOM 1713 CD2 PHE A 102 -4.572 4.367 -23.747 1.00 0.00 C ATOM 1714 CE1 PHE A 102 -6.217 2.771 -25.357 1.00 0.00 C ATOM 1715 CE2 PHE A 102 -5.331 4.952 -24.770 1.00 0.00 C ATOM 1716 CZ PHE A 102 -6.153 4.153 -25.575 1.00 0.00 C ATOM 1717 OXT PHE A 102 -0.937 3.709 -22.635 1.00 0.00 O ATOM 0 H PHE A 102 -1.436 1.822 -21.098 1.00 0.00 H new ATOM 0 HA PHE A 102 -2.595 1.254 -23.812 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -4.346 1.490 -22.018 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -3.693 3.062 -21.604 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -5.511 1.120 -24.166 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -3.937 4.983 -23.127 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -6.851 2.156 -25.978 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -5.282 6.018 -24.937 1.00 0.00 H new ATOM 0 HZ PHE A 102 -6.738 4.603 -26.364 1.00 0.00 H new TER 1727 PHE A 102