USER MOD reduce.3.24.130724 H: found=0, std=0, add=789, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 787 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 46 TYR OH : rot 60:sc= 1.1 USER MOD Set 1.2: A 70 THR OG1 : rot 148:sc= 1.16 USER MOD Single : A 1 GLY N :NH3+ -119:sc= 0.0812 (180deg=0) USER MOD Single : A 2 SER OG : rot 37:sc= 0.775 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 39:sc= 0.312 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= -0.0386 USER MOD Single : A 13 LYS NZ :NH3+ -145:sc= -0.656 (180deg=-2.27!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -0.239 K(o=-0.24,f=-2.2!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl -154:sc= -2.3! (180deg=-2.62!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= -0.0113 (180deg=-0.0113) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0322) USER MOD Single : A 61 MET CE :methyl -124:sc= -6.75! (180deg=-12.4!) USER MOD Single : A 77 SER OG : rot 90:sc= 0.267 USER MOD Single : A 78 SER OG : rot 180:sc= -0.743 USER MOD Single : A 79 GLN : amide:sc= -0.54 K(o=-0.54,f=0) USER MOD Single : A 83 SER OG : rot -23:sc= 0.322 USER MOD Single : A 84 SER OG : rot -119:sc= 0.128 USER MOD Single : A 94 LYS NZ :NH3+ -131:sc= 0.631 (180deg=0.000336) USER MOD Single : A 98 ASN : amide:sc= -1.14 K(o=-1.1,f=-6.5!) USER MOD Single : A 101 HIS : no HD1:sc= -0.125 X(o=-0.13,f=-0.0011) USER MOD Single : A 103 SER OG : rot -49:sc= 0.389 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 30.631 13.026 16.427 1.00 0.00 N ATOM 2 CA GLY A 1 30.337 12.329 15.189 1.00 0.00 C ATOM 3 C GLY A 1 29.520 11.071 15.411 1.00 0.00 C ATOM 4 O GLY A 1 29.104 10.784 16.533 1.00 0.00 O ATOM 0 H1 GLY A 1 30.216 13.979 16.396 1.00 0.00 H new ATOM 0 H2 GLY A 1 30.227 12.499 17.227 1.00 0.00 H new ATOM 0 H3 GLY A 1 31.661 13.101 16.547 1.00 0.00 H new ATOM 0 HA2 GLY A 1 29.795 12.997 14.520 1.00 0.00 H new ATOM 0 HA3 GLY A 1 31.271 12.069 14.692 1.00 0.00 H new ATOM 8 N SER A 2 29.289 10.320 14.339 1.00 0.00 N ATOM 9 CA SER A 2 28.512 9.089 14.421 1.00 0.00 C ATOM 10 C SER A 2 29.406 7.868 14.224 1.00 0.00 C ATOM 11 O SER A 2 29.898 7.616 13.124 1.00 0.00 O ATOM 12 CB SER A 2 27.398 9.094 13.373 1.00 0.00 C ATOM 13 OG SER A 2 27.931 9.152 12.061 1.00 0.00 O ATOM 0 H SER A 2 29.629 10.543 13.403 1.00 0.00 H new ATOM 0 HA SER A 2 28.067 9.035 15.414 1.00 0.00 H new ATOM 0 HB2 SER A 2 26.788 8.197 13.482 1.00 0.00 H new ATOM 0 HB3 SER A 2 26.741 9.948 13.540 1.00 0.00 H new ATOM 0 HG SER A 2 28.752 8.618 12.017 1.00 0.00 H new ATOM 19 N SER A 3 29.611 7.114 15.299 1.00 0.00 N ATOM 20 CA SER A 3 30.449 5.921 15.246 1.00 0.00 C ATOM 21 C SER A 3 29.690 4.752 14.625 1.00 0.00 C ATOM 22 O SER A 3 30.143 4.151 13.651 1.00 0.00 O ATOM 23 CB SER A 3 30.926 5.546 16.650 1.00 0.00 C ATOM 24 OG SER A 3 31.599 6.629 17.267 1.00 0.00 O ATOM 0 H SER A 3 29.209 7.307 16.216 1.00 0.00 H new ATOM 0 HA SER A 3 31.315 6.142 14.622 1.00 0.00 H new ATOM 0 HB2 SER A 3 30.073 5.249 17.260 1.00 0.00 H new ATOM 0 HB3 SER A 3 31.592 4.685 16.593 1.00 0.00 H new ATOM 0 HG SER A 3 31.892 6.364 18.164 1.00 0.00 H new ATOM 30 N GLY A 4 28.533 4.434 15.197 1.00 0.00 N ATOM 31 CA GLY A 4 27.730 3.338 14.688 1.00 0.00 C ATOM 32 C GLY A 4 28.409 1.994 14.857 1.00 0.00 C ATOM 33 O GLY A 4 29.569 1.825 14.482 1.00 0.00 O ATOM 0 H GLY A 4 28.137 4.916 16.004 1.00 0.00 H new ATOM 0 HA2 GLY A 4 26.770 3.324 15.205 1.00 0.00 H new ATOM 0 HA3 GLY A 4 27.521 3.505 13.631 1.00 0.00 H new ATOM 37 N SER A 5 27.685 1.034 15.426 1.00 0.00 N ATOM 38 CA SER A 5 28.227 -0.301 15.649 1.00 0.00 C ATOM 39 C SER A 5 27.156 -1.365 15.433 1.00 0.00 C ATOM 40 O SER A 5 26.184 -1.446 16.184 1.00 0.00 O ATOM 41 CB SER A 5 28.795 -0.413 17.066 1.00 0.00 C ATOM 42 OG SER A 5 27.842 -0.003 18.031 1.00 0.00 O ATOM 0 H SER A 5 26.722 1.157 15.740 1.00 0.00 H new ATOM 0 HA SER A 5 29.029 -0.466 14.929 1.00 0.00 H new ATOM 0 HB2 SER A 5 29.095 -1.443 17.261 1.00 0.00 H new ATOM 0 HB3 SER A 5 29.691 0.201 17.152 1.00 0.00 H new ATOM 0 HG SER A 5 26.952 -0.313 17.764 1.00 0.00 H new ATOM 48 N SER A 6 27.341 -2.180 14.399 1.00 0.00 N ATOM 49 CA SER A 6 26.390 -3.238 14.080 1.00 0.00 C ATOM 50 C SER A 6 26.951 -4.169 13.010 1.00 0.00 C ATOM 51 O SER A 6 27.670 -3.737 12.110 1.00 0.00 O ATOM 52 CB SER A 6 25.066 -2.636 13.604 1.00 0.00 C ATOM 53 OG SER A 6 24.047 -3.619 13.556 1.00 0.00 O ATOM 0 H SER A 6 28.141 -2.128 13.768 1.00 0.00 H new ATOM 0 HA SER A 6 26.213 -3.818 14.986 1.00 0.00 H new ATOM 0 HB2 SER A 6 24.767 -1.830 14.275 1.00 0.00 H new ATOM 0 HB3 SER A 6 25.198 -2.196 12.616 1.00 0.00 H new ATOM 0 HG SER A 6 23.211 -3.209 13.251 1.00 0.00 H new ATOM 59 N GLY A 7 26.618 -5.452 13.116 1.00 0.00 N ATOM 60 CA GLY A 7 27.097 -6.425 12.152 1.00 0.00 C ATOM 61 C GLY A 7 26.669 -7.839 12.494 1.00 0.00 C ATOM 62 O GLY A 7 26.211 -8.104 13.605 1.00 0.00 O ATOM 0 H GLY A 7 26.025 -5.835 13.852 1.00 0.00 H new ATOM 0 HA2 GLY A 7 26.723 -6.165 11.162 1.00 0.00 H new ATOM 0 HA3 GLY A 7 28.185 -6.379 12.104 1.00 0.00 H new ATOM 66 N ASP A 8 26.818 -8.748 11.537 1.00 0.00 N ATOM 67 CA ASP A 8 26.444 -10.142 11.742 1.00 0.00 C ATOM 68 C ASP A 8 26.933 -11.012 10.587 1.00 0.00 C ATOM 69 O ASP A 8 27.260 -10.509 9.512 1.00 0.00 O ATOM 70 CB ASP A 8 24.926 -10.269 11.885 1.00 0.00 C ATOM 71 CG ASP A 8 24.212 -10.223 10.549 1.00 0.00 C ATOM 72 OD1 ASP A 8 24.586 -9.381 9.705 1.00 0.00 O ATOM 73 OD2 ASP A 8 23.280 -11.029 10.346 1.00 0.00 O ATOM 0 H ASP A 8 27.195 -8.544 10.611 1.00 0.00 H new ATOM 0 HA ASP A 8 26.918 -10.488 12.660 1.00 0.00 H new ATOM 0 HB2 ASP A 8 24.689 -11.206 12.388 1.00 0.00 H new ATOM 0 HB3 ASP A 8 24.555 -9.464 12.519 1.00 0.00 H new ATOM 78 N LYS A 9 26.981 -12.319 10.818 1.00 0.00 N ATOM 79 CA LYS A 9 27.429 -13.260 9.798 1.00 0.00 C ATOM 80 C LYS A 9 26.359 -14.311 9.519 1.00 0.00 C ATOM 81 O LYS A 9 25.962 -15.058 10.414 1.00 0.00 O ATOM 82 CB LYS A 9 28.726 -13.942 10.239 1.00 0.00 C ATOM 83 CG LYS A 9 29.958 -13.067 10.082 1.00 0.00 C ATOM 84 CD LYS A 9 30.409 -12.994 8.633 1.00 0.00 C ATOM 85 CE LYS A 9 31.109 -11.677 8.333 1.00 0.00 C ATOM 86 NZ LYS A 9 31.061 -11.342 6.882 1.00 0.00 N ATOM 0 H LYS A 9 26.715 -12.751 11.703 1.00 0.00 H new ATOM 0 HA LYS A 9 27.613 -12.702 8.880 1.00 0.00 H new ATOM 0 HB2 LYS A 9 28.633 -14.240 11.283 1.00 0.00 H new ATOM 0 HB3 LYS A 9 28.862 -14.854 9.658 1.00 0.00 H new ATOM 0 HG2 LYS A 9 29.741 -12.063 10.448 1.00 0.00 H new ATOM 0 HG3 LYS A 9 30.767 -13.462 10.696 1.00 0.00 H new ATOM 0 HD2 LYS A 9 31.084 -13.823 8.419 1.00 0.00 H new ATOM 0 HD3 LYS A 9 29.546 -13.107 7.976 1.00 0.00 H new ATOM 0 HE2 LYS A 9 30.640 -10.877 8.906 1.00 0.00 H new ATOM 0 HE3 LYS A 9 32.148 -11.735 8.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 31.548 -10.438 6.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 31.531 -12.093 6.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 30.070 -11.261 6.577 1.00 0.00 H new ATOM 100 N ILE A 10 25.899 -14.364 8.274 1.00 0.00 N ATOM 101 CA ILE A 10 24.877 -15.325 7.878 1.00 0.00 C ATOM 102 C ILE A 10 24.880 -15.540 6.368 1.00 0.00 C ATOM 103 O ILE A 10 24.925 -14.583 5.596 1.00 0.00 O ATOM 104 CB ILE A 10 23.474 -14.868 8.317 1.00 0.00 C ATOM 105 CG1 ILE A 10 22.488 -16.036 8.245 1.00 0.00 C ATOM 106 CG2 ILE A 10 22.998 -13.712 7.450 1.00 0.00 C ATOM 107 CD1 ILE A 10 22.421 -16.850 9.519 1.00 0.00 C ATOM 0 H ILE A 10 26.218 -13.753 7.522 1.00 0.00 H new ATOM 0 HA ILE A 10 25.117 -16.264 8.377 1.00 0.00 H new ATOM 0 HB ILE A 10 23.527 -14.524 9.350 1.00 0.00 H new ATOM 0 HG12 ILE A 10 21.495 -15.649 8.018 1.00 0.00 H new ATOM 0 HG13 ILE A 10 22.771 -16.690 7.420 1.00 0.00 H new ATOM 0 HG21 ILE A 10 22.005 -13.400 7.773 1.00 0.00 H new ATOM 0 HG22 ILE A 10 23.690 -12.876 7.547 1.00 0.00 H new ATOM 0 HG23 ILE A 10 22.958 -14.031 6.408 1.00 0.00 H new ATOM 0 HD11 ILE A 10 21.703 -17.660 9.396 1.00 0.00 H new ATOM 0 HD12 ILE A 10 23.404 -17.267 9.737 1.00 0.00 H new ATOM 0 HD13 ILE A 10 22.108 -16.210 10.344 1.00 0.00 H new ATOM 119 N GLU A 11 24.831 -16.803 5.955 1.00 0.00 N ATOM 120 CA GLU A 11 24.827 -17.143 4.537 1.00 0.00 C ATOM 121 C GLU A 11 23.439 -16.945 3.934 1.00 0.00 C ATOM 122 O GLU A 11 23.304 -16.614 2.756 1.00 0.00 O ATOM 123 CB GLU A 11 25.281 -18.590 4.336 1.00 0.00 C ATOM 124 CG GLU A 11 24.311 -19.616 4.897 1.00 0.00 C ATOM 125 CD GLU A 11 24.588 -19.946 6.351 1.00 0.00 C ATOM 126 OE1 GLU A 11 25.467 -20.795 6.610 1.00 0.00 O ATOM 127 OE2 GLU A 11 23.926 -19.356 7.230 1.00 0.00 O ATOM 0 H GLU A 11 24.794 -17.607 6.582 1.00 0.00 H new ATOM 0 HA GLU A 11 25.524 -16.477 4.028 1.00 0.00 H new ATOM 0 HB2 GLU A 11 25.416 -18.775 3.270 1.00 0.00 H new ATOM 0 HB3 GLU A 11 26.254 -18.726 4.809 1.00 0.00 H new ATOM 0 HG2 GLU A 11 23.293 -19.238 4.802 1.00 0.00 H new ATOM 0 HG3 GLU A 11 24.370 -20.528 4.304 1.00 0.00 H new ATOM 134 N SER A 12 22.411 -17.151 4.751 1.00 0.00 N ATOM 135 CA SER A 12 21.033 -17.000 4.298 1.00 0.00 C ATOM 136 C SER A 12 20.878 -17.483 2.859 1.00 0.00 C ATOM 137 O SER A 12 20.310 -16.788 2.016 1.00 0.00 O ATOM 138 CB SER A 12 20.595 -15.538 4.407 1.00 0.00 C ATOM 139 OG SER A 12 20.546 -15.120 5.760 1.00 0.00 O ATOM 0 H SER A 12 22.506 -17.423 5.730 1.00 0.00 H new ATOM 0 HA SER A 12 20.397 -17.611 4.939 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.288 -14.905 3.852 1.00 0.00 H new ATOM 0 HB3 SER A 12 19.614 -15.414 3.949 1.00 0.00 H new ATOM 0 HG SER A 12 20.265 -14.182 5.803 1.00 0.00 H new ATOM 145 N LYS A 13 21.388 -18.679 2.585 1.00 0.00 N ATOM 146 CA LYS A 13 21.307 -19.258 1.249 1.00 0.00 C ATOM 147 C LYS A 13 20.107 -20.193 1.134 1.00 0.00 C ATOM 148 O LYS A 13 20.199 -21.268 0.539 1.00 0.00 O ATOM 149 CB LYS A 13 22.593 -20.020 0.922 1.00 0.00 C ATOM 150 CG LYS A 13 23.838 -19.149 0.945 1.00 0.00 C ATOM 151 CD LYS A 13 25.099 -19.974 0.754 1.00 0.00 C ATOM 152 CE LYS A 13 25.416 -20.174 -0.720 1.00 0.00 C ATOM 153 NZ LYS A 13 24.478 -21.136 -1.364 1.00 0.00 N ATOM 0 H LYS A 13 21.862 -19.267 3.271 1.00 0.00 H new ATOM 0 HA LYS A 13 21.182 -18.444 0.534 1.00 0.00 H new ATOM 0 HB2 LYS A 13 22.715 -20.833 1.637 1.00 0.00 H new ATOM 0 HB3 LYS A 13 22.496 -20.474 -0.064 1.00 0.00 H new ATOM 0 HG2 LYS A 13 23.772 -18.397 0.159 1.00 0.00 H new ATOM 0 HG3 LYS A 13 23.892 -18.615 1.894 1.00 0.00 H new ATOM 0 HD2 LYS A 13 25.937 -19.478 1.244 1.00 0.00 H new ATOM 0 HD3 LYS A 13 24.977 -20.944 1.236 1.00 0.00 H new ATOM 0 HE2 LYS A 13 25.364 -19.215 -1.236 1.00 0.00 H new ATOM 0 HE3 LYS A 13 26.438 -20.538 -0.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 24.988 -21.690 -2.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 24.089 -21.777 -0.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 23.702 -20.613 -1.817 1.00 0.00 H new ATOM 167 N LEU A 14 18.982 -19.778 1.705 1.00 0.00 N ATOM 168 CA LEU A 14 17.762 -20.578 1.665 1.00 0.00 C ATOM 169 C LEU A 14 16.643 -19.829 0.949 1.00 0.00 C ATOM 170 O LEU A 14 15.800 -19.195 1.585 1.00 0.00 O ATOM 171 CB LEU A 14 17.321 -20.943 3.083 1.00 0.00 C ATOM 172 CG LEU A 14 18.159 -22.007 3.794 1.00 0.00 C ATOM 173 CD1 LEU A 14 19.352 -21.370 4.490 1.00 0.00 C ATOM 174 CD2 LEU A 14 17.307 -22.778 4.791 1.00 0.00 C ATOM 0 H LEU A 14 18.889 -18.892 2.202 1.00 0.00 H new ATOM 0 HA LEU A 14 17.975 -21.492 1.111 1.00 0.00 H new ATOM 0 HB2 LEU A 14 17.330 -20.037 3.689 1.00 0.00 H new ATOM 0 HB3 LEU A 14 16.288 -21.289 3.043 1.00 0.00 H new ATOM 0 HG LEU A 14 18.532 -22.707 3.047 1.00 0.00 H new ATOM 0 HD11 LEU A 14 19.936 -22.142 4.990 1.00 0.00 H new ATOM 0 HD12 LEU A 14 19.975 -20.864 3.753 1.00 0.00 H new ATOM 0 HD13 LEU A 14 19.000 -20.647 5.226 1.00 0.00 H new ATOM 0 HD21 LEU A 14 17.919 -23.531 5.287 1.00 0.00 H new ATOM 0 HD22 LEU A 14 16.904 -22.090 5.534 1.00 0.00 H new ATOM 0 HD23 LEU A 14 16.486 -23.267 4.267 1.00 0.00 H new ATOM 186 N LEU A 15 16.640 -19.907 -0.377 1.00 0.00 N ATOM 187 CA LEU A 15 15.623 -19.238 -1.181 1.00 0.00 C ATOM 188 C LEU A 15 14.361 -20.089 -1.280 1.00 0.00 C ATOM 189 O LEU A 15 14.410 -21.309 -1.129 1.00 0.00 O ATOM 190 CB LEU A 15 16.163 -18.942 -2.581 1.00 0.00 C ATOM 191 CG LEU A 15 16.549 -20.159 -3.422 1.00 0.00 C ATOM 192 CD1 LEU A 15 15.344 -20.682 -4.188 1.00 0.00 C ATOM 193 CD2 LEU A 15 17.681 -19.810 -4.378 1.00 0.00 C ATOM 0 H LEU A 15 17.331 -20.427 -0.918 1.00 0.00 H new ATOM 0 HA LEU A 15 15.369 -18.298 -0.691 1.00 0.00 H new ATOM 0 HB2 LEU A 15 15.410 -18.373 -3.126 1.00 0.00 H new ATOM 0 HB3 LEU A 15 17.039 -18.301 -2.483 1.00 0.00 H new ATOM 0 HG LEU A 15 16.896 -20.945 -2.751 1.00 0.00 H new ATOM 0 HD11 LEU A 15 15.638 -21.548 -4.781 1.00 0.00 H new ATOM 0 HD12 LEU A 15 14.563 -20.972 -3.485 1.00 0.00 H new ATOM 0 HD13 LEU A 15 14.966 -19.902 -4.848 1.00 0.00 H new ATOM 0 HD21 LEU A 15 17.942 -20.688 -4.968 1.00 0.00 H new ATOM 0 HD22 LEU A 15 17.361 -19.008 -5.043 1.00 0.00 H new ATOM 0 HD23 LEU A 15 18.551 -19.484 -3.808 1.00 0.00 H new ATOM 205 N ALA A 16 13.232 -19.436 -1.536 1.00 0.00 N ATOM 206 CA ALA A 16 11.958 -20.133 -1.659 1.00 0.00 C ATOM 207 C ALA A 16 11.484 -20.158 -3.109 1.00 0.00 C ATOM 208 O ALA A 16 11.238 -21.224 -3.674 1.00 0.00 O ATOM 209 CB ALA A 16 10.910 -19.480 -0.771 1.00 0.00 C ATOM 0 H ALA A 16 13.174 -18.425 -1.662 1.00 0.00 H new ATOM 0 HA ALA A 16 12.103 -21.163 -1.333 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.964 -20.011 -0.874 1.00 0.00 H new ATOM 0 HB2 ALA A 16 11.238 -19.519 0.268 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.776 -18.440 -1.070 1.00 0.00 H new ATOM 215 N LYS A 17 11.357 -18.978 -3.705 1.00 0.00 N ATOM 216 CA LYS A 17 10.913 -18.863 -5.089 1.00 0.00 C ATOM 217 C LYS A 17 9.514 -19.446 -5.262 1.00 0.00 C ATOM 218 O LYS A 17 9.273 -20.253 -6.160 1.00 0.00 O ATOM 219 CB LYS A 17 11.893 -19.577 -6.022 1.00 0.00 C ATOM 220 CG LYS A 17 13.198 -18.826 -6.223 1.00 0.00 C ATOM 221 CD LYS A 17 14.151 -19.594 -7.124 1.00 0.00 C ATOM 222 CE LYS A 17 13.732 -19.504 -8.583 1.00 0.00 C ATOM 223 NZ LYS A 17 14.530 -20.419 -9.447 1.00 0.00 N ATOM 0 H LYS A 17 11.555 -18.087 -3.251 1.00 0.00 H new ATOM 0 HA LYS A 17 10.881 -17.804 -5.347 1.00 0.00 H new ATOM 0 HB2 LYS A 17 12.111 -20.566 -5.618 1.00 0.00 H new ATOM 0 HB3 LYS A 17 11.416 -19.726 -6.991 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.993 -17.848 -6.659 1.00 0.00 H new ATOM 0 HG3 LYS A 17 13.671 -18.651 -5.257 1.00 0.00 H new ATOM 0 HD2 LYS A 17 15.160 -19.199 -7.009 1.00 0.00 H new ATOM 0 HD3 LYS A 17 14.181 -20.639 -6.817 1.00 0.00 H new ATOM 0 HE2 LYS A 17 12.674 -19.750 -8.673 1.00 0.00 H new ATOM 0 HE3 LYS A 17 13.851 -18.478 -8.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 14.214 -20.328 -10.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 15.537 -20.168 -9.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 14.396 -21.400 -9.130 1.00 0.00 H new ATOM 237 N LYS A 18 8.594 -19.032 -4.397 1.00 0.00 N ATOM 238 CA LYS A 18 7.218 -19.510 -4.455 1.00 0.00 C ATOM 239 C LYS A 18 6.289 -18.430 -4.998 1.00 0.00 C ATOM 240 O LYS A 18 5.145 -18.306 -4.562 1.00 0.00 O ATOM 241 CB LYS A 18 6.750 -19.949 -3.065 1.00 0.00 C ATOM 242 CG LYS A 18 7.031 -21.411 -2.762 1.00 0.00 C ATOM 243 CD LYS A 18 8.436 -21.607 -2.216 1.00 0.00 C ATOM 244 CE LYS A 18 8.629 -23.011 -1.665 1.00 0.00 C ATOM 245 NZ LYS A 18 9.805 -23.094 -0.756 1.00 0.00 N ATOM 0 H LYS A 18 8.777 -18.366 -3.647 1.00 0.00 H new ATOM 0 HA LYS A 18 7.185 -20.365 -5.130 1.00 0.00 H new ATOM 0 HB2 LYS A 18 7.240 -19.330 -2.314 1.00 0.00 H new ATOM 0 HB3 LYS A 18 5.679 -19.768 -2.978 1.00 0.00 H new ATOM 0 HG2 LYS A 18 6.304 -21.780 -2.039 1.00 0.00 H new ATOM 0 HG3 LYS A 18 6.906 -22.002 -3.669 1.00 0.00 H new ATOM 0 HD2 LYS A 18 9.164 -21.422 -3.006 1.00 0.00 H new ATOM 0 HD3 LYS A 18 8.627 -20.877 -1.429 1.00 0.00 H new ATOM 0 HE2 LYS A 18 7.732 -23.316 -1.127 1.00 0.00 H new ATOM 0 HE3 LYS A 18 8.758 -23.710 -2.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 9.902 -24.067 -0.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 10.665 -22.827 -1.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 9.670 -22.446 0.046 1.00 0.00 H new ATOM 259 N ALA A 19 6.788 -17.652 -5.953 1.00 0.00 N ATOM 260 CA ALA A 19 6.001 -16.585 -6.558 1.00 0.00 C ATOM 261 C ALA A 19 6.528 -16.233 -7.945 1.00 0.00 C ATOM 262 O ALA A 19 7.715 -15.960 -8.117 1.00 0.00 O ATOM 263 CB ALA A 19 6.003 -15.355 -5.663 1.00 0.00 C ATOM 0 H ALA A 19 7.734 -17.741 -6.324 1.00 0.00 H new ATOM 0 HA ALA A 19 4.976 -16.940 -6.667 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.411 -14.566 -6.127 1.00 0.00 H new ATOM 0 HB2 ALA A 19 5.572 -15.609 -4.694 1.00 0.00 H new ATOM 0 HB3 ALA A 19 7.027 -15.007 -5.525 1.00 0.00 H new ATOM 269 N GLU A 20 5.637 -16.243 -8.932 1.00 0.00 N ATOM 270 CA GLU A 20 6.014 -15.926 -10.304 1.00 0.00 C ATOM 271 C GLU A 20 5.394 -14.603 -10.747 1.00 0.00 C ATOM 272 O GLU A 20 4.317 -14.578 -11.343 1.00 0.00 O ATOM 273 CB GLU A 20 5.577 -17.048 -11.248 1.00 0.00 C ATOM 274 CG GLU A 20 6.281 -17.019 -12.595 1.00 0.00 C ATOM 275 CD GLU A 20 7.613 -17.743 -12.572 1.00 0.00 C ATOM 276 OE1 GLU A 20 7.611 -18.982 -12.419 1.00 0.00 O ATOM 277 OE2 GLU A 20 8.657 -17.071 -12.708 1.00 0.00 O ATOM 0 H GLU A 20 4.650 -16.467 -8.807 1.00 0.00 H new ATOM 0 HA GLU A 20 7.099 -15.830 -10.343 1.00 0.00 H new ATOM 0 HB2 GLU A 20 5.766 -18.009 -10.769 1.00 0.00 H new ATOM 0 HB3 GLU A 20 4.501 -16.978 -11.408 1.00 0.00 H new ATOM 0 HG2 GLU A 20 5.637 -17.474 -13.347 1.00 0.00 H new ATOM 0 HG3 GLU A 20 6.440 -15.983 -12.896 1.00 0.00 H new ATOM 284 N VAL A 21 6.083 -13.506 -10.451 1.00 0.00 N ATOM 285 CA VAL A 21 5.602 -12.179 -10.819 1.00 0.00 C ATOM 286 C VAL A 21 4.081 -12.108 -10.753 1.00 0.00 C ATOM 287 O VAL A 21 3.426 -11.695 -11.709 1.00 0.00 O ATOM 288 CB VAL A 21 6.062 -11.788 -12.236 1.00 0.00 C ATOM 289 CG1 VAL A 21 5.971 -10.282 -12.430 1.00 0.00 C ATOM 290 CG2 VAL A 21 7.477 -12.283 -12.492 1.00 0.00 C ATOM 0 H VAL A 21 6.976 -13.509 -9.958 1.00 0.00 H new ATOM 0 HA VAL A 21 6.027 -11.478 -10.101 1.00 0.00 H new ATOM 0 HB VAL A 21 5.399 -12.264 -12.959 1.00 0.00 H new ATOM 0 HG11 VAL A 21 6.300 -10.024 -13.437 1.00 0.00 H new ATOM 0 HG12 VAL A 21 4.939 -9.959 -12.292 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.609 -9.782 -11.701 1.00 0.00 H new ATOM 0 HG21 VAL A 21 7.786 -11.998 -13.498 1.00 0.00 H new ATOM 0 HG22 VAL A 21 8.155 -11.838 -11.764 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.505 -13.369 -12.398 1.00 0.00 H new ATOM 300 N ASN A 22 3.524 -12.514 -9.616 1.00 0.00 N ATOM 301 CA ASN A 22 2.078 -12.497 -9.424 1.00 0.00 C ATOM 302 C ASN A 22 1.601 -11.108 -9.012 1.00 0.00 C ATOM 303 O ASN A 22 0.900 -10.430 -9.765 1.00 0.00 O ATOM 304 CB ASN A 22 1.671 -13.523 -8.365 1.00 0.00 C ATOM 305 CG ASN A 22 1.405 -14.893 -8.960 1.00 0.00 C ATOM 306 OD1 ASN A 22 1.129 -15.021 -10.153 1.00 0.00 O ATOM 307 ND2 ASN A 22 1.489 -15.925 -8.128 1.00 0.00 N ATOM 0 H ASN A 22 4.052 -12.859 -8.814 1.00 0.00 H new ATOM 0 HA ASN A 22 1.607 -12.757 -10.372 1.00 0.00 H new ATOM 0 HB2 ASN A 22 2.460 -13.602 -7.617 1.00 0.00 H new ATOM 0 HB3 ASN A 22 0.776 -13.174 -7.849 1.00 0.00 H new ATOM 0 HD21 ASN A 22 1.322 -16.871 -8.470 1.00 0.00 H new ATOM 0 HD22 ASN A 22 1.721 -15.771 -7.147 1.00 0.00 H new ATOM 314 N THR A 23 1.985 -10.688 -7.810 1.00 0.00 N ATOM 315 CA THR A 23 1.596 -9.381 -7.297 1.00 0.00 C ATOM 316 C THR A 23 2.820 -8.538 -6.955 1.00 0.00 C ATOM 317 O THR A 23 3.956 -8.955 -7.186 1.00 0.00 O ATOM 318 CB THR A 23 0.711 -9.510 -6.043 1.00 0.00 C ATOM 319 OG1 THR A 23 1.283 -10.457 -5.134 1.00 0.00 O ATOM 320 CG2 THR A 23 -0.697 -9.947 -6.418 1.00 0.00 C ATOM 0 H THR A 23 2.565 -11.235 -7.174 1.00 0.00 H new ATOM 0 HA THR A 23 1.027 -8.889 -8.086 1.00 0.00 H new ATOM 0 HB THR A 23 0.656 -8.533 -5.562 1.00 0.00 H new ATOM 0 HG1 THR A 23 0.715 -10.532 -4.339 1.00 0.00 H new ATOM 0 HG21 THR A 23 -1.304 -10.031 -5.517 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.141 -9.209 -7.087 1.00 0.00 H new ATOM 0 HG23 THR A 23 -0.656 -10.914 -6.920 1.00 0.00 H new ATOM 328 N ILE A 24 2.582 -7.353 -6.405 1.00 0.00 N ATOM 329 CA ILE A 24 3.666 -6.453 -6.030 1.00 0.00 C ATOM 330 C ILE A 24 4.113 -6.699 -4.594 1.00 0.00 C ATOM 331 O ILE A 24 3.300 -6.861 -3.683 1.00 0.00 O ATOM 332 CB ILE A 24 3.250 -4.978 -6.181 1.00 0.00 C ATOM 333 CG1 ILE A 24 2.436 -4.783 -7.462 1.00 0.00 C ATOM 334 CG2 ILE A 24 4.478 -4.079 -6.185 1.00 0.00 C ATOM 335 CD1 ILE A 24 1.600 -3.521 -7.460 1.00 0.00 C ATOM 0 H ILE A 24 1.648 -6.993 -6.209 1.00 0.00 H new ATOM 0 HA ILE A 24 4.496 -6.659 -6.706 1.00 0.00 H new ATOM 0 HB ILE A 24 2.625 -4.703 -5.331 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.115 -4.758 -8.314 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.781 -5.643 -7.601 1.00 0.00 H new ATOM 0 HG21 ILE A 24 4.168 -3.040 -6.292 1.00 0.00 H new ATOM 0 HG22 ILE A 24 5.021 -4.201 -5.248 1.00 0.00 H new ATOM 0 HG23 ILE A 24 5.126 -4.352 -7.018 1.00 0.00 H new ATOM 0 HD11 ILE A 24 1.050 -3.447 -8.398 1.00 0.00 H new ATOM 0 HD12 ILE A 24 0.896 -3.552 -6.628 1.00 0.00 H new ATOM 0 HD13 ILE A 24 2.251 -2.653 -7.352 1.00 0.00 H new ATOM 347 N PRO A 25 5.437 -6.727 -4.383 1.00 0.00 N ATOM 348 CA PRO A 25 6.024 -6.950 -3.058 1.00 0.00 C ATOM 349 C PRO A 25 5.800 -5.770 -2.119 1.00 0.00 C ATOM 350 O PRO A 25 6.277 -5.768 -0.985 1.00 0.00 O ATOM 351 CB PRO A 25 7.515 -7.122 -3.355 1.00 0.00 C ATOM 352 CG PRO A 25 7.735 -6.387 -4.632 1.00 0.00 C ATOM 353 CD PRO A 25 6.464 -6.541 -5.422 1.00 0.00 C ATOM 0 HA PRO A 25 5.575 -7.805 -2.552 1.00 0.00 H new ATOM 0 HB2 PRO A 25 8.128 -6.713 -2.552 1.00 0.00 H new ATOM 0 HB3 PRO A 25 7.780 -8.175 -3.454 1.00 0.00 H new ATOM 0 HG2 PRO A 25 7.953 -5.336 -4.445 1.00 0.00 H new ATOM 0 HG3 PRO A 25 8.585 -6.797 -5.177 1.00 0.00 H new ATOM 0 HD2 PRO A 25 6.262 -5.662 -6.034 1.00 0.00 H new ATOM 0 HD3 PRO A 25 6.512 -7.395 -6.097 1.00 0.00 H new ATOM 361 N GLY A 26 5.069 -4.768 -2.598 1.00 0.00 N ATOM 362 CA GLY A 26 4.795 -3.596 -1.787 1.00 0.00 C ATOM 363 C GLY A 26 3.966 -2.562 -2.524 1.00 0.00 C ATOM 364 O GLY A 26 3.458 -2.826 -3.614 1.00 0.00 O ATOM 0 H GLY A 26 4.662 -4.747 -3.533 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.270 -3.899 -0.881 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.737 -3.146 -1.474 1.00 0.00 H new ATOM 368 N PHE A 27 3.828 -1.383 -1.928 1.00 0.00 N ATOM 369 CA PHE A 27 3.053 -0.306 -2.533 1.00 0.00 C ATOM 370 C PHE A 27 3.326 1.021 -1.832 1.00 0.00 C ATOM 371 O PHE A 27 3.099 1.160 -0.630 1.00 0.00 O ATOM 372 CB PHE A 27 1.559 -0.629 -2.474 1.00 0.00 C ATOM 373 CG PHE A 27 0.707 0.324 -3.262 1.00 0.00 C ATOM 374 CD1 PHE A 27 0.767 0.344 -4.647 1.00 0.00 C ATOM 375 CD2 PHE A 27 -0.153 1.200 -2.620 1.00 0.00 C ATOM 376 CE1 PHE A 27 -0.015 1.220 -5.375 1.00 0.00 C ATOM 377 CE2 PHE A 27 -0.937 2.079 -3.343 1.00 0.00 C ATOM 378 CZ PHE A 27 -0.869 2.088 -4.722 1.00 0.00 C ATOM 0 H PHE A 27 4.243 -1.149 -1.026 1.00 0.00 H new ATOM 0 HA PHE A 27 3.357 -0.215 -3.576 1.00 0.00 H new ATOM 0 HB2 PHE A 27 1.399 -1.640 -2.848 1.00 0.00 H new ATOM 0 HB3 PHE A 27 1.234 -0.619 -1.434 1.00 0.00 H new ATOM 0 HD1 PHE A 27 1.432 -0.333 -5.163 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -0.211 1.196 -1.542 1.00 0.00 H new ATOM 0 HE1 PHE A 27 0.041 1.226 -6.454 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -1.602 2.758 -2.830 1.00 0.00 H new ATOM 0 HZ PHE A 27 -1.482 2.772 -5.289 1.00 0.00 H new ATOM 388 N ASP A 28 3.816 1.995 -2.592 1.00 0.00 N ATOM 389 CA ASP A 28 4.120 3.312 -2.046 1.00 0.00 C ATOM 390 C ASP A 28 3.120 4.351 -2.542 1.00 0.00 C ATOM 391 O ASP A 28 3.194 5.523 -2.177 1.00 0.00 O ATOM 392 CB ASP A 28 5.541 3.731 -2.428 1.00 0.00 C ATOM 393 CG ASP A 28 5.740 3.798 -3.930 1.00 0.00 C ATOM 394 OD1 ASP A 28 5.703 2.733 -4.581 1.00 0.00 O ATOM 395 OD2 ASP A 28 5.935 4.915 -4.453 1.00 0.00 O ATOM 0 H ASP A 28 4.011 1.897 -3.588 1.00 0.00 H new ATOM 0 HA ASP A 28 4.046 3.253 -0.960 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.759 4.706 -1.992 1.00 0.00 H new ATOM 0 HB3 ASP A 28 6.252 3.024 -2.001 1.00 0.00 H new ATOM 400 N GLY A 29 2.184 3.911 -3.378 1.00 0.00 N ATOM 401 CA GLY A 29 1.182 4.816 -3.912 1.00 0.00 C ATOM 402 C GLY A 29 0.366 5.485 -2.824 1.00 0.00 C ATOM 403 O GLY A 29 0.845 5.674 -1.706 1.00 0.00 O ATOM 0 H GLY A 29 2.102 2.945 -3.695 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.672 5.580 -4.516 1.00 0.00 H new ATOM 0 HA3 GLY A 29 0.515 4.265 -4.575 1.00 0.00 H new ATOM 407 N VAL A 30 -0.871 5.846 -3.152 1.00 0.00 N ATOM 408 CA VAL A 30 -1.756 6.498 -2.194 1.00 0.00 C ATOM 409 C VAL A 30 -3.194 6.019 -2.360 1.00 0.00 C ATOM 410 O VAL A 30 -3.636 5.719 -3.469 1.00 0.00 O ATOM 411 CB VAL A 30 -1.716 8.030 -2.346 1.00 0.00 C ATOM 412 CG1 VAL A 30 -2.836 8.676 -1.546 1.00 0.00 C ATOM 413 CG2 VAL A 30 -0.361 8.573 -1.916 1.00 0.00 C ATOM 0 H VAL A 30 -1.283 5.698 -4.073 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.399 6.229 -1.200 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.864 8.277 -3.397 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.791 9.758 -1.666 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.798 8.311 -1.906 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.723 8.423 -0.492 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.351 9.657 -2.030 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.181 8.316 -0.872 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.420 8.135 -2.537 1.00 0.00 H new ATOM 423 N VAL A 31 -3.920 5.950 -1.249 1.00 0.00 N ATOM 424 CA VAL A 31 -5.310 5.509 -1.270 1.00 0.00 C ATOM 425 C VAL A 31 -6.258 6.689 -1.456 1.00 0.00 C ATOM 426 O VAL A 31 -5.993 7.793 -0.981 1.00 0.00 O ATOM 427 CB VAL A 31 -5.682 4.764 0.025 1.00 0.00 C ATOM 428 CG1 VAL A 31 -7.087 4.190 -0.074 1.00 0.00 C ATOM 429 CG2 VAL A 31 -4.669 3.669 0.319 1.00 0.00 C ATOM 0 H VAL A 31 -3.569 6.194 -0.323 1.00 0.00 H new ATOM 0 HA VAL A 31 -5.413 4.827 -2.114 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.664 5.475 0.851 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -7.332 3.667 0.850 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -7.800 4.999 -0.234 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -7.137 3.492 -0.910 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -4.948 3.153 1.238 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -4.653 2.957 -0.506 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.680 4.111 0.437 1.00 0.00 H new ATOM 439 N LYS A 32 -7.365 6.447 -2.150 1.00 0.00 N ATOM 440 CA LYS A 32 -8.355 7.488 -2.398 1.00 0.00 C ATOM 441 C LYS A 32 -9.556 7.328 -1.471 1.00 0.00 C ATOM 442 O LYS A 32 -10.005 8.292 -0.849 1.00 0.00 O ATOM 443 CB LYS A 32 -8.814 7.447 -3.857 1.00 0.00 C ATOM 444 CG LYS A 32 -7.669 7.384 -4.853 1.00 0.00 C ATOM 445 CD LYS A 32 -7.044 8.752 -5.071 1.00 0.00 C ATOM 446 CE LYS A 32 -5.916 9.012 -4.085 1.00 0.00 C ATOM 447 NZ LYS A 32 -5.776 10.462 -3.772 1.00 0.00 N ATOM 0 H LYS A 32 -7.599 5.539 -2.551 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.889 8.453 -2.197 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.459 6.580 -4.002 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -9.417 8.331 -4.065 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.910 6.689 -4.493 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -8.033 6.994 -5.803 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.662 8.821 -6.089 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -7.807 9.523 -4.964 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -6.103 8.458 -3.165 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -4.979 8.637 -4.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -4.997 10.598 -3.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -5.572 10.988 -4.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -6.661 10.814 -3.355 1.00 0.00 H new ATOM 461 N ASP A 33 -10.071 6.107 -1.383 1.00 0.00 N ATOM 462 CA ASP A 33 -11.219 5.821 -0.530 1.00 0.00 C ATOM 463 C ASP A 33 -11.095 4.437 0.101 1.00 0.00 C ATOM 464 O ASP A 33 -10.394 3.569 -0.417 1.00 0.00 O ATOM 465 CB ASP A 33 -12.516 5.913 -1.336 1.00 0.00 C ATOM 466 CG ASP A 33 -12.341 5.449 -2.769 1.00 0.00 C ATOM 467 OD1 ASP A 33 -11.564 4.498 -2.994 1.00 0.00 O ATOM 468 OD2 ASP A 33 -12.982 6.037 -3.664 1.00 0.00 O ATOM 0 H ASP A 33 -9.712 5.299 -1.892 1.00 0.00 H new ATOM 0 HA ASP A 33 -11.242 6.564 0.267 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -13.284 5.309 -0.853 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -12.871 6.944 -1.332 1.00 0.00 H new ATOM 473 N ALA A 34 -11.780 4.241 1.223 1.00 0.00 N ATOM 474 CA ALA A 34 -11.748 2.964 1.924 1.00 0.00 C ATOM 475 C ALA A 34 -11.796 1.797 0.943 1.00 0.00 C ATOM 476 O ALA A 34 -11.025 0.845 1.058 1.00 0.00 O ATOM 477 CB ALA A 34 -12.902 2.874 2.911 1.00 0.00 C ATOM 0 H ALA A 34 -12.364 4.951 1.666 1.00 0.00 H new ATOM 0 HA ALA A 34 -10.809 2.904 2.474 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -12.865 1.915 3.427 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -12.822 3.681 3.639 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -13.847 2.961 2.375 1.00 0.00 H new ATOM 483 N GLU A 35 -12.707 1.879 -0.022 1.00 0.00 N ATOM 484 CA GLU A 35 -12.856 0.828 -1.022 1.00 0.00 C ATOM 485 C GLU A 35 -11.534 0.570 -1.741 1.00 0.00 C ATOM 486 O GLU A 35 -11.108 -0.576 -1.884 1.00 0.00 O ATOM 487 CB GLU A 35 -13.935 1.209 -2.037 1.00 0.00 C ATOM 488 CG GLU A 35 -15.317 1.365 -1.426 1.00 0.00 C ATOM 489 CD GLU A 35 -15.973 0.034 -1.117 1.00 0.00 C ATOM 490 OE1 GLU A 35 -15.500 -0.661 -0.194 1.00 0.00 O ATOM 491 OE2 GLU A 35 -16.960 -0.313 -1.799 1.00 0.00 O ATOM 0 H GLU A 35 -13.352 2.661 -0.132 1.00 0.00 H new ATOM 0 HA GLU A 35 -13.156 -0.086 -0.510 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -13.653 2.144 -2.521 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -13.975 0.447 -2.815 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -15.241 1.949 -0.509 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -15.951 1.928 -2.111 1.00 0.00 H new ATOM 498 N GLU A 36 -10.892 1.644 -2.190 1.00 0.00 N ATOM 499 CA GLU A 36 -9.620 1.533 -2.894 1.00 0.00 C ATOM 500 C GLU A 36 -8.563 0.880 -2.009 1.00 0.00 C ATOM 501 O GLU A 36 -7.806 0.020 -2.459 1.00 0.00 O ATOM 502 CB GLU A 36 -9.141 2.914 -3.347 1.00 0.00 C ATOM 503 CG GLU A 36 -7.750 2.905 -3.958 1.00 0.00 C ATOM 504 CD GLU A 36 -7.739 2.375 -5.379 1.00 0.00 C ATOM 505 OE1 GLU A 36 -8.406 2.983 -6.242 1.00 0.00 O ATOM 506 OE2 GLU A 36 -7.066 1.354 -5.627 1.00 0.00 O ATOM 0 H GLU A 36 -11.231 2.599 -2.079 1.00 0.00 H new ATOM 0 HA GLU A 36 -9.773 0.904 -3.771 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -9.846 3.313 -4.076 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -9.149 3.591 -2.492 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -7.347 3.918 -3.949 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -7.091 2.294 -3.341 1.00 0.00 H new ATOM 513 N ALA A 37 -8.517 1.296 -0.748 1.00 0.00 N ATOM 514 CA ALA A 37 -7.554 0.752 0.201 1.00 0.00 C ATOM 515 C ALA A 37 -7.696 -0.762 0.320 1.00 0.00 C ATOM 516 O ALA A 37 -6.702 -1.483 0.415 1.00 0.00 O ATOM 517 CB ALA A 37 -7.726 1.408 1.563 1.00 0.00 C ATOM 0 H ALA A 37 -9.136 2.008 -0.360 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.553 0.969 -0.171 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.000 0.992 2.262 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.567 2.483 1.472 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.734 1.220 1.933 1.00 0.00 H new ATOM 523 N VAL A 38 -8.937 -1.238 0.315 1.00 0.00 N ATOM 524 CA VAL A 38 -9.209 -2.666 0.422 1.00 0.00 C ATOM 525 C VAL A 38 -8.632 -3.426 -0.768 1.00 0.00 C ATOM 526 O VAL A 38 -7.952 -4.438 -0.600 1.00 0.00 O ATOM 527 CB VAL A 38 -10.721 -2.945 0.510 1.00 0.00 C ATOM 528 CG1 VAL A 38 -10.988 -4.442 0.528 1.00 0.00 C ATOM 529 CG2 VAL A 38 -11.315 -2.274 1.740 1.00 0.00 C ATOM 0 H VAL A 38 -9.770 -0.655 0.238 1.00 0.00 H new ATOM 0 HA VAL A 38 -8.730 -3.011 1.338 1.00 0.00 H new ATOM 0 HB VAL A 38 -11.203 -2.526 -0.373 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.062 -4.619 0.590 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -10.598 -4.892 -0.385 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -10.496 -4.889 1.392 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -12.384 -2.481 1.787 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -10.830 -2.662 2.636 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -11.156 -1.197 1.679 1.00 0.00 H new ATOM 539 N ARG A 39 -8.907 -2.930 -1.969 1.00 0.00 N ATOM 540 CA ARG A 39 -8.416 -3.562 -3.188 1.00 0.00 C ATOM 541 C ARG A 39 -6.892 -3.618 -3.195 1.00 0.00 C ATOM 542 O ARG A 39 -6.300 -4.651 -3.511 1.00 0.00 O ATOM 543 CB ARG A 39 -8.915 -2.803 -4.419 1.00 0.00 C ATOM 544 CG ARG A 39 -10.409 -2.946 -4.658 1.00 0.00 C ATOM 545 CD ARG A 39 -10.928 -1.868 -5.597 1.00 0.00 C ATOM 546 NE ARG A 39 -10.496 -2.088 -6.975 1.00 0.00 N ATOM 547 CZ ARG A 39 -10.865 -1.319 -7.993 1.00 0.00 C ATOM 548 NH1 ARG A 39 -11.669 -0.284 -7.788 1.00 0.00 N ATOM 549 NH2 ARG A 39 -10.430 -1.583 -9.218 1.00 0.00 N ATOM 0 H ARG A 39 -9.467 -2.092 -2.125 1.00 0.00 H new ATOM 0 HA ARG A 39 -8.800 -4.582 -3.218 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -8.673 -1.746 -4.307 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -8.379 -3.161 -5.298 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -10.619 -3.929 -5.079 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -10.938 -2.887 -3.707 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -12.017 -1.847 -5.558 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -10.578 -0.893 -5.259 1.00 0.00 H new ATOM 0 HE ARG A 39 -9.877 -2.876 -7.166 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -12.005 -0.078 -6.847 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -11.951 0.305 -8.571 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -9.811 -2.378 -9.379 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -10.714 -0.991 -9.999 1.00 0.00 H new ATOM 563 N ILE A 40 -6.262 -2.502 -2.845 1.00 0.00 N ATOM 564 CA ILE A 40 -4.807 -2.424 -2.810 1.00 0.00 C ATOM 565 C ILE A 40 -4.231 -3.364 -1.757 1.00 0.00 C ATOM 566 O ILE A 40 -3.226 -4.034 -1.990 1.00 0.00 O ATOM 567 CB ILE A 40 -4.326 -0.990 -2.521 1.00 0.00 C ATOM 568 CG1 ILE A 40 -4.716 -0.057 -3.668 1.00 0.00 C ATOM 569 CG2 ILE A 40 -2.821 -0.970 -2.303 1.00 0.00 C ATOM 570 CD1 ILE A 40 -4.578 1.411 -3.327 1.00 0.00 C ATOM 0 H ILE A 40 -6.737 -1.639 -2.581 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.452 -2.725 -3.795 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.810 -0.637 -1.610 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.094 -0.280 -4.535 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.748 -0.259 -3.955 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.496 0.050 -2.100 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.568 -1.607 -1.455 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.319 -1.339 -3.197 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -4.872 2.013 -4.187 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.221 1.650 -2.480 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.542 1.629 -3.068 1.00 0.00 H new ATOM 582 N ALA A 41 -4.877 -3.410 -0.596 1.00 0.00 N ATOM 583 CA ALA A 41 -4.432 -4.271 0.493 1.00 0.00 C ATOM 584 C ALA A 41 -4.514 -5.741 0.098 1.00 0.00 C ATOM 585 O ALA A 41 -3.531 -6.476 0.195 1.00 0.00 O ATOM 586 CB ALA A 41 -5.259 -4.011 1.743 1.00 0.00 C ATOM 0 H ALA A 41 -5.710 -2.861 -0.386 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.389 -4.037 0.706 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -4.916 -4.661 2.548 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.146 -2.970 2.044 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -6.309 -4.216 1.534 1.00 0.00 H new ATOM 592 N ARG A 42 -5.693 -6.165 -0.346 1.00 0.00 N ATOM 593 CA ARG A 42 -5.903 -7.550 -0.753 1.00 0.00 C ATOM 594 C ARG A 42 -4.805 -8.008 -1.708 1.00 0.00 C ATOM 595 O ARG A 42 -4.346 -9.147 -1.639 1.00 0.00 O ATOM 596 CB ARG A 42 -7.272 -7.705 -1.419 1.00 0.00 C ATOM 597 CG ARG A 42 -8.438 -7.562 -0.454 1.00 0.00 C ATOM 598 CD ARG A 42 -9.741 -7.295 -1.192 1.00 0.00 C ATOM 599 NE ARG A 42 -10.395 -8.532 -1.612 1.00 0.00 N ATOM 600 CZ ARG A 42 -10.098 -9.174 -2.737 1.00 0.00 C ATOM 601 NH1 ARG A 42 -9.163 -8.700 -3.548 1.00 0.00 N ATOM 602 NH2 ARG A 42 -10.738 -10.294 -3.051 1.00 0.00 N ATOM 0 H ARG A 42 -6.517 -5.570 -0.433 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.868 -8.175 0.139 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -7.370 -6.958 -2.207 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.325 -8.683 -1.898 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -8.534 -8.471 0.140 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -8.239 -6.747 0.241 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -10.414 -6.730 -0.547 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.542 -6.675 -2.066 1.00 0.00 H new ATOM 0 HE ARG A 42 -11.119 -8.924 -1.009 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -8.669 -7.840 -3.309 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -8.937 -9.195 -4.411 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.458 -10.662 -2.429 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -10.510 -10.787 -3.915 1.00 0.00 H new ATOM 616 N GLU A 43 -4.391 -7.112 -2.599 1.00 0.00 N ATOM 617 CA GLU A 43 -3.349 -7.426 -3.569 1.00 0.00 C ATOM 618 C GLU A 43 -2.028 -7.733 -2.868 1.00 0.00 C ATOM 619 O GLU A 43 -1.344 -8.699 -3.206 1.00 0.00 O ATOM 620 CB GLU A 43 -3.163 -6.263 -4.546 1.00 0.00 C ATOM 621 CG GLU A 43 -4.055 -6.350 -5.772 1.00 0.00 C ATOM 622 CD GLU A 43 -3.453 -5.661 -6.982 1.00 0.00 C ATOM 623 OE1 GLU A 43 -3.487 -4.414 -7.033 1.00 0.00 O ATOM 624 OE2 GLU A 43 -2.947 -6.370 -7.877 1.00 0.00 O ATOM 0 H GLU A 43 -4.761 -6.164 -2.669 1.00 0.00 H new ATOM 0 HA GLU A 43 -3.660 -8.311 -4.124 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -3.365 -5.327 -4.026 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -2.122 -6.232 -4.866 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -4.239 -7.398 -6.009 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.022 -5.900 -5.546 1.00 0.00 H new ATOM 631 N ILE A 44 -1.677 -6.903 -1.892 1.00 0.00 N ATOM 632 CA ILE A 44 -0.439 -7.085 -1.144 1.00 0.00 C ATOM 633 C ILE A 44 -0.479 -8.367 -0.320 1.00 0.00 C ATOM 634 O ILE A 44 0.498 -9.114 -0.267 1.00 0.00 O ATOM 635 CB ILE A 44 -0.168 -5.894 -0.206 1.00 0.00 C ATOM 636 CG1 ILE A 44 -0.081 -4.594 -1.008 1.00 0.00 C ATOM 637 CG2 ILE A 44 1.112 -6.122 0.584 1.00 0.00 C ATOM 638 CD1 ILE A 44 0.061 -3.359 -0.146 1.00 0.00 C ATOM 0 H ILE A 44 -2.232 -6.098 -1.601 1.00 0.00 H new ATOM 0 HA ILE A 44 0.366 -7.151 -1.876 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.996 -5.810 0.498 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.769 -4.652 -1.688 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.975 -4.496 -1.624 1.00 0.00 H new ATOM 0 HG21 ILE A 44 1.290 -5.272 1.242 1.00 0.00 H new ATOM 0 HG22 ILE A 44 1.014 -7.029 1.181 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.950 -6.229 -0.104 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.117 -2.476 -0.782 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.801 -3.276 0.515 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.970 -3.434 0.451 1.00 0.00 H new ATOM 650 N GLY A 45 -1.616 -8.618 0.321 1.00 0.00 N ATOM 651 CA GLY A 45 -1.763 -9.812 1.133 1.00 0.00 C ATOM 652 C GLY A 45 -1.821 -9.502 2.616 1.00 0.00 C ATOM 653 O GLY A 45 -0.830 -9.072 3.206 1.00 0.00 O ATOM 0 H GLY A 45 -2.439 -8.016 0.293 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -2.672 -10.338 0.839 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.928 -10.485 0.938 1.00 0.00 H new ATOM 657 N TYR A 46 -2.985 -9.718 3.218 1.00 0.00 N ATOM 658 CA TYR A 46 -3.170 -9.455 4.640 1.00 0.00 C ATOM 659 C TYR A 46 -2.288 -10.371 5.483 1.00 0.00 C ATOM 660 O TYR A 46 -1.912 -11.468 5.068 1.00 0.00 O ATOM 661 CB TYR A 46 -4.637 -9.642 5.028 1.00 0.00 C ATOM 662 CG TYR A 46 -5.546 -8.553 4.505 1.00 0.00 C ATOM 663 CD1 TYR A 46 -6.142 -8.659 3.254 1.00 0.00 C ATOM 664 CD2 TYR A 46 -5.810 -7.418 5.261 1.00 0.00 C ATOM 665 CE1 TYR A 46 -6.972 -7.666 2.771 1.00 0.00 C ATOM 666 CE2 TYR A 46 -6.640 -6.420 4.787 1.00 0.00 C ATOM 667 CZ TYR A 46 -7.218 -6.549 3.542 1.00 0.00 C ATOM 668 OH TYR A 46 -8.045 -5.558 3.065 1.00 0.00 O ATOM 0 H TYR A 46 -3.815 -10.074 2.743 1.00 0.00 H new ATOM 0 HA TYR A 46 -2.879 -8.422 4.833 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -4.984 -10.605 4.652 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -4.715 -9.678 6.115 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -5.953 -9.533 2.649 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -5.359 -7.314 6.237 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -7.426 -7.764 1.796 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -6.835 -5.544 5.388 1.00 0.00 H new ATOM 0 HH TYR A 46 -8.935 -5.930 2.892 1.00 0.00 H new ATOM 678 N PRO A 47 -1.951 -9.913 6.698 1.00 0.00 N ATOM 679 CA PRO A 47 -2.392 -8.610 7.202 1.00 0.00 C ATOM 680 C PRO A 47 -1.726 -7.449 6.471 1.00 0.00 C ATOM 681 O PRO A 47 -0.663 -7.608 5.872 1.00 0.00 O ATOM 682 CB PRO A 47 -1.962 -8.634 8.671 1.00 0.00 C ATOM 683 CG PRO A 47 -0.820 -9.590 8.716 1.00 0.00 C ATOM 684 CD PRO A 47 -1.112 -10.632 7.671 1.00 0.00 C ATOM 0 HA PRO A 47 -3.462 -8.459 7.059 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -1.662 -7.643 9.012 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -2.777 -8.960 9.317 1.00 0.00 H new ATOM 0 HG2 PRO A 47 0.122 -9.083 8.509 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.728 -10.042 9.703 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -0.198 -11.009 7.212 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -1.633 -11.491 8.094 1.00 0.00 H new ATOM 692 N VAL A 48 -2.358 -6.281 6.525 1.00 0.00 N ATOM 693 CA VAL A 48 -1.826 -5.092 5.869 1.00 0.00 C ATOM 694 C VAL A 48 -1.895 -3.879 6.789 1.00 0.00 C ATOM 695 O VAL A 48 -2.944 -3.578 7.358 1.00 0.00 O ATOM 696 CB VAL A 48 -2.588 -4.780 4.568 1.00 0.00 C ATOM 697 CG1 VAL A 48 -2.449 -5.928 3.579 1.00 0.00 C ATOM 698 CG2 VAL A 48 -4.053 -4.496 4.864 1.00 0.00 C ATOM 0 H VAL A 48 -3.239 -6.133 7.016 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.784 -5.303 5.629 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.152 -3.888 4.117 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.994 -5.689 2.666 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.396 -6.080 3.344 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.858 -6.838 4.018 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.577 -4.277 3.933 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.504 -5.368 5.338 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.129 -3.639 5.533 1.00 0.00 H new ATOM 708 N MET A 49 -0.770 -3.186 6.931 1.00 0.00 N ATOM 709 CA MET A 49 -0.704 -2.003 7.782 1.00 0.00 C ATOM 710 C MET A 49 -1.018 -0.741 6.984 1.00 0.00 C ATOM 711 O MET A 49 -0.736 -0.666 5.788 1.00 0.00 O ATOM 712 CB MET A 49 0.681 -1.885 8.421 1.00 0.00 C ATOM 713 CG MET A 49 0.839 -0.660 9.307 1.00 0.00 C ATOM 714 SD MET A 49 1.985 -0.933 10.672 1.00 0.00 S ATOM 715 CE MET A 49 3.324 -1.771 9.827 1.00 0.00 C ATOM 0 H MET A 49 0.108 -3.423 6.468 1.00 0.00 H new ATOM 0 HA MET A 49 -1.451 -2.110 8.568 1.00 0.00 H new ATOM 0 HB2 MET A 49 0.876 -2.779 9.013 1.00 0.00 H new ATOM 0 HB3 MET A 49 1.434 -1.853 7.634 1.00 0.00 H new ATOM 0 HG2 MET A 49 1.191 0.177 8.704 1.00 0.00 H new ATOM 0 HG3 MET A 49 -0.135 -0.377 9.706 1.00 0.00 H new ATOM 0 HE1 MET A 49 3.866 -2.398 10.535 1.00 0.00 H new ATOM 0 HE2 MET A 49 2.918 -2.393 9.029 1.00 0.00 H new ATOM 0 HE3 MET A 49 4.004 -1.033 9.402 1.00 0.00 H new ATOM 725 N ILE A 50 -1.604 0.246 7.653 1.00 0.00 N ATOM 726 CA ILE A 50 -1.955 1.504 7.006 1.00 0.00 C ATOM 727 C ILE A 50 -1.367 2.693 7.759 1.00 0.00 C ATOM 728 O ILE A 50 -1.655 2.899 8.938 1.00 0.00 O ATOM 729 CB ILE A 50 -3.482 1.678 6.905 1.00 0.00 C ATOM 730 CG1 ILE A 50 -4.105 0.489 6.170 1.00 0.00 C ATOM 731 CG2 ILE A 50 -3.820 2.982 6.197 1.00 0.00 C ATOM 732 CD1 ILE A 50 -5.554 0.247 6.533 1.00 0.00 C ATOM 0 H ILE A 50 -1.846 0.199 8.643 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.534 1.470 6.001 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.897 1.716 7.912 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.031 0.657 5.096 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.528 -0.409 6.393 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.903 3.091 6.133 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -3.403 3.819 6.757 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.396 2.971 5.193 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.931 -0.610 5.975 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.633 0.047 7.602 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -6.144 1.129 6.284 1.00 0.00 H new ATOM 744 N LYS A 51 -0.543 3.474 7.070 1.00 0.00 N ATOM 745 CA LYS A 51 0.083 4.645 7.671 1.00 0.00 C ATOM 746 C LYS A 51 -0.426 5.928 7.023 1.00 0.00 C ATOM 747 O LYS A 51 -1.059 5.893 5.968 1.00 0.00 O ATOM 748 CB LYS A 51 1.605 4.562 7.534 1.00 0.00 C ATOM 749 CG LYS A 51 2.182 3.222 7.956 1.00 0.00 C ATOM 750 CD LYS A 51 2.242 2.249 6.790 1.00 0.00 C ATOM 751 CE LYS A 51 3.546 2.383 6.019 1.00 0.00 C ATOM 752 NZ LYS A 51 4.644 1.594 6.644 1.00 0.00 N ATOM 0 H LYS A 51 -0.293 3.317 6.094 1.00 0.00 H new ATOM 0 HA LYS A 51 -0.181 4.664 8.728 1.00 0.00 H new ATOM 0 HB2 LYS A 51 1.879 4.756 6.497 1.00 0.00 H new ATOM 0 HB3 LYS A 51 2.059 5.349 8.136 1.00 0.00 H new ATOM 0 HG2 LYS A 51 3.183 3.367 8.362 1.00 0.00 H new ATOM 0 HG3 LYS A 51 1.573 2.798 8.754 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.140 1.229 7.160 1.00 0.00 H new ATOM 0 HD3 LYS A 51 1.402 2.430 6.120 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.397 2.048 4.993 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.834 3.433 5.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 5.516 1.712 6.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.804 1.930 7.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.380 0.588 6.665 1.00 0.00 H new ATOM 766 N ALA A 52 -0.146 7.060 7.661 1.00 0.00 N ATOM 767 CA ALA A 52 -0.574 8.354 7.144 1.00 0.00 C ATOM 768 C ALA A 52 0.465 8.935 6.190 1.00 0.00 C ATOM 769 O ALA A 52 1.556 9.323 6.606 1.00 0.00 O ATOM 770 CB ALA A 52 -0.838 9.319 8.290 1.00 0.00 C ATOM 0 H ALA A 52 0.375 7.107 8.537 1.00 0.00 H new ATOM 0 HA ALA A 52 -1.499 8.207 6.587 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -1.157 10.281 7.889 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -1.621 8.916 8.932 1.00 0.00 H new ATOM 0 HB3 ALA A 52 0.075 9.452 8.871 1.00 0.00 H new ATOM 776 N SER A 53 0.118 8.990 4.908 1.00 0.00 N ATOM 777 CA SER A 53 1.023 9.519 3.893 1.00 0.00 C ATOM 778 C SER A 53 1.671 10.816 4.367 1.00 0.00 C ATOM 779 O SER A 53 2.880 11.002 4.235 1.00 0.00 O ATOM 780 CB SER A 53 0.269 9.760 2.584 1.00 0.00 C ATOM 781 OG SER A 53 1.165 9.859 1.491 1.00 0.00 O ATOM 0 H SER A 53 -0.783 8.675 4.547 1.00 0.00 H new ATOM 0 HA SER A 53 1.808 8.783 3.721 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.434 8.945 2.410 1.00 0.00 H new ATOM 0 HB3 SER A 53 -0.318 10.675 2.662 1.00 0.00 H new ATOM 0 HG SER A 53 0.659 10.011 0.666 1.00 0.00 H new ATOM 787 N ALA A 54 0.857 11.710 4.919 1.00 0.00 N ATOM 788 CA ALA A 54 1.350 12.989 5.414 1.00 0.00 C ATOM 789 C ALA A 54 2.365 12.789 6.535 1.00 0.00 C ATOM 790 O ALA A 54 3.270 13.602 6.719 1.00 0.00 O ATOM 791 CB ALA A 54 0.192 13.851 5.895 1.00 0.00 C ATOM 0 H ALA A 54 -0.147 11.572 5.035 1.00 0.00 H new ATOM 0 HA ALA A 54 1.851 13.500 4.592 1.00 0.00 H new ATOM 0 HB1 ALA A 54 0.575 14.803 6.262 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.496 14.031 5.069 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -0.334 13.337 6.700 1.00 0.00 H new ATOM 797 N GLY A 55 2.207 11.701 7.284 1.00 0.00 N ATOM 798 CA GLY A 55 3.116 11.415 8.378 1.00 0.00 C ATOM 799 C GLY A 55 3.222 9.932 8.671 1.00 0.00 C ATOM 800 O GLY A 55 2.809 9.471 9.735 1.00 0.00 O ATOM 0 H GLY A 55 1.466 11.013 7.152 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.104 11.806 8.137 1.00 0.00 H new ATOM 0 HA3 GLY A 55 2.777 11.936 9.274 1.00 0.00 H new ATOM 804 N GLY A 56 3.775 9.181 7.724 1.00 0.00 N ATOM 805 CA GLY A 56 3.922 7.748 7.904 1.00 0.00 C ATOM 806 C GLY A 56 5.094 7.394 8.798 1.00 0.00 C ATOM 807 O GLY A 56 5.947 8.235 9.078 1.00 0.00 O ATOM 0 H GLY A 56 4.124 9.539 6.835 1.00 0.00 H new ATOM 0 HA2 GLY A 56 3.006 7.343 8.334 1.00 0.00 H new ATOM 0 HA3 GLY A 56 4.055 7.274 6.931 1.00 0.00 H new ATOM 811 N GLY A 57 5.135 6.144 9.249 1.00 0.00 N ATOM 812 CA GLY A 57 6.214 5.702 10.114 1.00 0.00 C ATOM 813 C GLY A 57 5.801 4.560 11.020 1.00 0.00 C ATOM 814 O GLY A 57 6.562 3.616 11.228 1.00 0.00 O ATOM 0 H GLY A 57 4.441 5.429 9.031 1.00 0.00 H new ATOM 0 HA2 GLY A 57 7.060 5.389 9.503 1.00 0.00 H new ATOM 0 HA3 GLY A 57 6.554 6.540 10.723 1.00 0.00 H new ATOM 818 N GLY A 58 4.590 4.645 11.563 1.00 0.00 N ATOM 819 CA GLY A 58 4.098 3.605 12.447 1.00 0.00 C ATOM 820 C GLY A 58 4.007 4.065 13.889 1.00 0.00 C ATOM 821 O GLY A 58 3.383 3.405 14.721 1.00 0.00 O ATOM 0 H GLY A 58 3.941 5.416 11.406 1.00 0.00 H new ATOM 0 HA2 GLY A 58 3.114 3.281 12.109 1.00 0.00 H new ATOM 0 HA3 GLY A 58 4.757 2.739 12.386 1.00 0.00 H new ATOM 825 N LYS A 59 4.632 5.199 14.187 1.00 0.00 N ATOM 826 CA LYS A 59 4.619 5.747 15.538 1.00 0.00 C ATOM 827 C LYS A 59 3.222 5.667 16.145 1.00 0.00 C ATOM 828 O LYS A 59 3.065 5.371 17.329 1.00 0.00 O ATOM 829 CB LYS A 59 5.099 7.200 15.525 1.00 0.00 C ATOM 830 CG LYS A 59 5.550 7.704 16.885 1.00 0.00 C ATOM 831 CD LYS A 59 5.317 9.198 17.032 1.00 0.00 C ATOM 832 CE LYS A 59 6.492 10.001 16.495 1.00 0.00 C ATOM 833 NZ LYS A 59 7.651 9.980 17.430 1.00 0.00 N ATOM 0 H LYS A 59 5.154 5.757 13.511 1.00 0.00 H new ATOM 0 HA LYS A 59 5.296 5.152 16.151 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.925 7.295 14.820 1.00 0.00 H new ATOM 0 HB3 LYS A 59 4.293 7.837 15.160 1.00 0.00 H new ATOM 0 HG2 LYS A 59 5.010 7.172 17.668 1.00 0.00 H new ATOM 0 HG3 LYS A 59 6.609 7.485 17.022 1.00 0.00 H new ATOM 0 HD2 LYS A 59 4.409 9.480 16.499 1.00 0.00 H new ATOM 0 HD3 LYS A 59 5.159 9.441 18.083 1.00 0.00 H new ATOM 0 HE2 LYS A 59 6.797 9.597 15.529 1.00 0.00 H new ATOM 0 HE3 LYS A 59 6.180 11.032 16.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 8.364 10.669 17.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 7.329 10.228 18.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 8.071 9.029 17.441 1.00 0.00 H new ATOM 847 N GLY A 60 2.209 5.932 15.325 1.00 0.00 N ATOM 848 CA GLY A 60 0.839 5.884 15.799 1.00 0.00 C ATOM 849 C GLY A 60 -0.149 5.591 14.688 1.00 0.00 C ATOM 850 O GLY A 60 -1.182 6.251 14.576 1.00 0.00 O ATOM 0 H GLY A 60 2.313 6.179 14.341 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.751 5.119 16.570 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.585 6.836 16.265 1.00 0.00 H new ATOM 854 N MET A 61 0.168 4.599 13.862 1.00 0.00 N ATOM 855 CA MET A 61 -0.700 4.220 12.753 1.00 0.00 C ATOM 856 C MET A 61 -1.597 3.049 13.140 1.00 0.00 C ATOM 857 O MET A 61 -1.591 2.603 14.287 1.00 0.00 O ATOM 858 CB MET A 61 0.136 3.854 11.525 1.00 0.00 C ATOM 859 CG MET A 61 0.523 2.385 11.470 1.00 0.00 C ATOM 860 SD MET A 61 1.197 1.785 13.031 1.00 0.00 S ATOM 861 CE MET A 61 -0.037 0.571 13.489 1.00 0.00 C ATOM 0 H MET A 61 1.020 4.043 13.940 1.00 0.00 H new ATOM 0 HA MET A 61 -1.333 5.074 12.511 1.00 0.00 H new ATOM 0 HB2 MET A 61 -0.424 4.108 10.625 1.00 0.00 H new ATOM 0 HB3 MET A 61 1.042 4.461 11.518 1.00 0.00 H new ATOM 0 HG2 MET A 61 -0.353 1.792 11.205 1.00 0.00 H new ATOM 0 HG3 MET A 61 1.259 2.237 10.680 1.00 0.00 H new ATOM 0 HE1 MET A 61 -0.428 0.805 14.479 1.00 0.00 H new ATOM 0 HE2 MET A 61 -0.851 0.588 12.764 1.00 0.00 H new ATOM 0 HE3 MET A 61 0.416 -0.420 13.503 1.00 0.00 H new ATOM 871 N ARG A 62 -2.367 2.556 12.176 1.00 0.00 N ATOM 872 CA ARG A 62 -3.271 1.437 12.417 1.00 0.00 C ATOM 873 C ARG A 62 -3.048 0.328 11.393 1.00 0.00 C ATOM 874 O ARG A 62 -2.533 0.572 10.302 1.00 0.00 O ATOM 875 CB ARG A 62 -4.725 1.909 12.365 1.00 0.00 C ATOM 876 CG ARG A 62 -5.689 0.992 13.101 1.00 0.00 C ATOM 877 CD ARG A 62 -7.133 1.280 12.719 1.00 0.00 C ATOM 878 NE ARG A 62 -8.070 0.416 13.431 1.00 0.00 N ATOM 879 CZ ARG A 62 -8.411 0.592 14.703 1.00 0.00 C ATOM 880 NH1 ARG A 62 -7.894 1.596 15.399 1.00 0.00 N ATOM 881 NH2 ARG A 62 -9.270 -0.237 15.282 1.00 0.00 N ATOM 0 H ARG A 62 -2.383 2.913 11.221 1.00 0.00 H new ATOM 0 HA ARG A 62 -3.060 1.039 13.410 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -4.789 2.909 12.794 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.036 1.988 11.323 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -5.451 -0.047 12.872 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.564 1.118 14.176 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.364 2.323 12.936 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.258 1.143 11.645 1.00 0.00 H new ATOM 0 HE ARG A 62 -8.486 -0.366 12.924 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -7.233 2.235 14.958 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -8.158 1.729 16.375 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -9.669 -1.011 14.751 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -9.531 -0.101 16.259 1.00 0.00 H new ATOM 895 N ILE A 63 -3.438 -0.890 11.754 1.00 0.00 N ATOM 896 CA ILE A 63 -3.281 -2.036 10.867 1.00 0.00 C ATOM 897 C ILE A 63 -4.616 -2.733 10.628 1.00 0.00 C ATOM 898 O ILE A 63 -5.544 -2.609 11.426 1.00 0.00 O ATOM 899 CB ILE A 63 -2.277 -3.056 11.437 1.00 0.00 C ATOM 900 CG1 ILE A 63 -0.942 -2.374 11.741 1.00 0.00 C ATOM 901 CG2 ILE A 63 -2.081 -4.207 10.462 1.00 0.00 C ATOM 902 CD1 ILE A 63 -0.009 -3.220 12.580 1.00 0.00 C ATOM 0 H ILE A 63 -3.865 -1.108 12.654 1.00 0.00 H new ATOM 0 HA ILE A 63 -2.899 -1.653 9.921 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.678 -3.458 12.367 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.448 -2.125 10.802 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.133 -1.434 12.260 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.369 -4.919 10.879 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.035 -4.705 10.291 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.698 -3.822 9.517 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.918 -2.674 12.757 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -0.484 -3.448 13.535 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.212 -4.149 12.054 1.00 0.00 H new ATOM 914 N ALA A 64 -4.704 -3.468 9.524 1.00 0.00 N ATOM 915 CA ALA A 64 -5.924 -4.188 9.181 1.00 0.00 C ATOM 916 C ALA A 64 -5.614 -5.615 8.741 1.00 0.00 C ATOM 917 O ALA A 64 -4.526 -5.897 8.240 1.00 0.00 O ATOM 918 CB ALA A 64 -6.683 -3.450 8.088 1.00 0.00 C ATOM 0 H ALA A 64 -3.945 -3.580 8.852 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.550 -4.238 10.072 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.592 -3.999 7.842 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -6.946 -2.452 8.438 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -6.056 -3.370 7.200 1.00 0.00 H new ATOM 924 N TRP A 65 -6.576 -6.510 8.932 1.00 0.00 N ATOM 925 CA TRP A 65 -6.405 -7.908 8.555 1.00 0.00 C ATOM 926 C TRP A 65 -7.449 -8.327 7.527 1.00 0.00 C ATOM 927 O TRP A 65 -7.206 -9.211 6.705 1.00 0.00 O ATOM 928 CB TRP A 65 -6.498 -8.806 9.790 1.00 0.00 C ATOM 929 CG TRP A 65 -5.386 -8.587 10.770 1.00 0.00 C ATOM 930 CD1 TRP A 65 -5.193 -7.488 11.559 1.00 0.00 C ATOM 931 CD2 TRP A 65 -4.312 -9.487 11.063 1.00 0.00 C ATOM 932 NE1 TRP A 65 -4.064 -7.652 12.325 1.00 0.00 N ATOM 933 CE2 TRP A 65 -3.506 -8.870 12.040 1.00 0.00 C ATOM 934 CE3 TRP A 65 -3.954 -10.755 10.597 1.00 0.00 C ATOM 935 CZ2 TRP A 65 -2.365 -9.479 12.556 1.00 0.00 C ATOM 936 CZ3 TRP A 65 -2.821 -11.358 11.110 1.00 0.00 C ATOM 937 CH2 TRP A 65 -2.038 -10.721 12.082 1.00 0.00 C ATOM 0 H TRP A 65 -7.483 -6.293 9.346 1.00 0.00 H new ATOM 0 HA TRP A 65 -5.417 -8.019 8.107 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -7.451 -8.629 10.288 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -6.493 -9.849 9.473 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -5.833 -6.619 11.578 1.00 0.00 H new ATOM 0 HE1 TRP A 65 -3.700 -6.976 12.997 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -4.552 -11.255 9.849 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 -1.759 -8.989 13.304 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -2.534 -12.337 10.756 1.00 0.00 H new ATOM 0 HH2 TRP A 65 -1.160 -11.219 12.465 1.00 0.00 H new ATOM 948 N ASP A 66 -8.612 -7.687 7.577 1.00 0.00 N ATOM 949 CA ASP A 66 -9.694 -7.993 6.648 1.00 0.00 C ATOM 950 C ASP A 66 -10.291 -6.714 6.069 1.00 0.00 C ATOM 951 O ASP A 66 -10.158 -5.637 6.650 1.00 0.00 O ATOM 952 CB ASP A 66 -10.783 -8.807 7.349 1.00 0.00 C ATOM 953 CG ASP A 66 -10.210 -9.876 8.258 1.00 0.00 C ATOM 954 OD1 ASP A 66 -9.546 -10.800 7.743 1.00 0.00 O ATOM 955 OD2 ASP A 66 -10.426 -9.789 9.485 1.00 0.00 O ATOM 0 H ASP A 66 -8.830 -6.953 8.251 1.00 0.00 H new ATOM 0 HA ASP A 66 -9.281 -8.583 5.830 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -11.414 -8.137 7.933 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -11.422 -9.275 6.600 1.00 0.00 H new ATOM 960 N ASP A 67 -10.948 -6.840 4.922 1.00 0.00 N ATOM 961 CA ASP A 67 -11.566 -5.695 4.264 1.00 0.00 C ATOM 962 C ASP A 67 -12.264 -4.796 5.280 1.00 0.00 C ATOM 963 O ASP A 67 -12.092 -3.577 5.266 1.00 0.00 O ATOM 964 CB ASP A 67 -12.568 -6.165 3.208 1.00 0.00 C ATOM 965 CG ASP A 67 -13.688 -6.996 3.802 1.00 0.00 C ATOM 966 OD1 ASP A 67 -13.406 -8.111 4.289 1.00 0.00 O ATOM 967 OD2 ASP A 67 -14.847 -6.531 3.781 1.00 0.00 O ATOM 0 H ASP A 67 -11.067 -7.724 4.428 1.00 0.00 H new ATOM 0 HA ASP A 67 -10.779 -5.120 3.776 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -12.992 -5.298 2.702 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -12.046 -6.751 2.452 1.00 0.00 H new ATOM 972 N GLU A 68 -13.052 -5.406 6.160 1.00 0.00 N ATOM 973 CA GLU A 68 -13.777 -4.659 7.181 1.00 0.00 C ATOM 974 C GLU A 68 -12.824 -3.796 8.003 1.00 0.00 C ATOM 975 O GLU A 68 -13.147 -2.662 8.357 1.00 0.00 O ATOM 976 CB GLU A 68 -14.537 -5.617 8.102 1.00 0.00 C ATOM 977 CG GLU A 68 -13.642 -6.627 8.802 1.00 0.00 C ATOM 978 CD GLU A 68 -14.392 -7.461 9.822 1.00 0.00 C ATOM 979 OE1 GLU A 68 -14.713 -6.927 10.904 1.00 0.00 O ATOM 980 OE2 GLU A 68 -14.657 -8.648 9.538 1.00 0.00 O ATOM 0 H GLU A 68 -13.204 -6.414 6.186 1.00 0.00 H new ATOM 0 HA GLU A 68 -14.491 -4.006 6.679 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -15.073 -5.037 8.853 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -15.286 -6.151 7.518 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.193 -7.286 8.059 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.825 -6.102 9.297 1.00 0.00 H new ATOM 987 N GLU A 69 -11.650 -4.342 8.303 1.00 0.00 N ATOM 988 CA GLU A 69 -10.651 -3.622 9.084 1.00 0.00 C ATOM 989 C GLU A 69 -9.993 -2.526 8.249 1.00 0.00 C ATOM 990 O GLU A 69 -9.748 -1.421 8.735 1.00 0.00 O ATOM 991 CB GLU A 69 -9.586 -4.588 9.607 1.00 0.00 C ATOM 992 CG GLU A 69 -10.065 -5.458 10.756 1.00 0.00 C ATOM 993 CD GLU A 69 -8.943 -5.852 11.697 1.00 0.00 C ATOM 994 OE1 GLU A 69 -8.303 -4.946 12.271 1.00 0.00 O ATOM 995 OE2 GLU A 69 -8.705 -7.067 11.860 1.00 0.00 O ATOM 0 H GLU A 69 -11.367 -5.280 8.017 1.00 0.00 H new ATOM 0 HA GLU A 69 -11.156 -3.157 9.930 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.257 -5.229 8.790 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.717 -4.016 9.933 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.833 -4.924 11.316 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.531 -6.358 10.355 1.00 0.00 H new ATOM 1002 N THR A 70 -9.709 -2.841 6.989 1.00 0.00 N ATOM 1003 CA THR A 70 -9.079 -1.886 6.087 1.00 0.00 C ATOM 1004 C THR A 70 -9.894 -0.601 5.988 1.00 0.00 C ATOM 1005 O THR A 70 -9.354 0.498 6.109 1.00 0.00 O ATOM 1006 CB THR A 70 -8.903 -2.478 4.676 1.00 0.00 C ATOM 1007 OG1 THR A 70 -8.104 -3.665 4.739 1.00 0.00 O ATOM 1008 CG2 THR A 70 -8.249 -1.470 3.743 1.00 0.00 C ATOM 0 H THR A 70 -9.906 -3.750 6.571 1.00 0.00 H new ATOM 0 HA THR A 70 -8.098 -1.659 6.504 1.00 0.00 H new ATOM 0 HB THR A 70 -9.890 -2.725 4.284 1.00 0.00 H new ATOM 0 HG1 THR A 70 -8.388 -4.288 4.038 1.00 0.00 H new ATOM 0 HG21 THR A 70 -8.135 -1.911 2.753 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.874 -0.579 3.674 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.269 -1.196 4.133 1.00 0.00 H new ATOM 1016 N ARG A 71 -11.197 -0.748 5.769 1.00 0.00 N ATOM 1017 CA ARG A 71 -12.086 0.401 5.654 1.00 0.00 C ATOM 1018 C ARG A 71 -12.183 1.148 6.980 1.00 0.00 C ATOM 1019 O ARG A 71 -11.992 2.363 7.035 1.00 0.00 O ATOM 1020 CB ARG A 71 -13.479 -0.048 5.206 1.00 0.00 C ATOM 1021 CG ARG A 71 -13.463 -0.959 3.989 1.00 0.00 C ATOM 1022 CD ARG A 71 -14.638 -1.924 4.000 1.00 0.00 C ATOM 1023 NE ARG A 71 -15.820 -1.354 3.359 1.00 0.00 N ATOM 1024 CZ ARG A 71 -17.014 -1.938 3.367 1.00 0.00 C ATOM 1025 NH1 ARG A 71 -17.182 -3.102 3.978 1.00 0.00 N ATOM 1026 NH2 ARG A 71 -18.042 -1.357 2.761 1.00 0.00 N ATOM 0 H ARG A 71 -11.660 -1.651 5.668 1.00 0.00 H new ATOM 0 HA ARG A 71 -11.671 1.076 4.906 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -13.967 -0.567 6.031 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -14.081 0.833 4.982 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -13.494 -0.356 3.081 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -12.529 -1.521 3.966 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -14.356 -2.844 3.488 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -14.877 -2.192 5.029 1.00 0.00 H new ATOM 0 HE ARG A 71 -15.724 -0.459 2.879 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -16.394 -3.552 4.444 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -18.099 -3.548 3.983 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -17.916 -0.462 2.289 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -18.958 -1.806 2.768 1.00 0.00 H new ATOM 1040 N ASP A 72 -12.481 0.414 8.046 1.00 0.00 N ATOM 1041 CA ASP A 72 -12.603 1.007 9.373 1.00 0.00 C ATOM 1042 C ASP A 72 -11.331 1.759 9.752 1.00 0.00 C ATOM 1043 O ASP A 72 -11.387 2.841 10.334 1.00 0.00 O ATOM 1044 CB ASP A 72 -12.900 -0.074 10.413 1.00 0.00 C ATOM 1045 CG ASP A 72 -14.358 -0.489 10.417 1.00 0.00 C ATOM 1046 OD1 ASP A 72 -15.201 0.307 10.880 1.00 0.00 O ATOM 1047 OD2 ASP A 72 -14.657 -1.611 9.955 1.00 0.00 O ATOM 0 H ASP A 72 -12.643 -0.593 8.018 1.00 0.00 H new ATOM 0 HA ASP A 72 -13.430 1.717 9.352 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -12.278 -0.946 10.214 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -12.627 0.293 11.402 1.00 0.00 H new ATOM 1052 N GLY A 73 -10.183 1.175 9.417 1.00 0.00 N ATOM 1053 CA GLY A 73 -8.913 1.803 9.731 1.00 0.00 C ATOM 1054 C GLY A 73 -8.567 2.922 8.769 1.00 0.00 C ATOM 1055 O GLY A 73 -7.851 3.859 9.126 1.00 0.00 O ATOM 0 H GLY A 73 -10.111 0.279 8.934 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -8.948 2.198 10.746 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -8.124 1.051 9.708 1.00 0.00 H new ATOM 1059 N PHE A 74 -9.073 2.826 7.544 1.00 0.00 N ATOM 1060 CA PHE A 74 -8.811 3.837 6.527 1.00 0.00 C ATOM 1061 C PHE A 74 -9.538 5.138 6.852 1.00 0.00 C ATOM 1062 O PHE A 74 -9.034 6.228 6.582 1.00 0.00 O ATOM 1063 CB PHE A 74 -9.242 3.329 5.149 1.00 0.00 C ATOM 1064 CG PHE A 74 -9.366 4.417 4.121 1.00 0.00 C ATOM 1065 CD1 PHE A 74 -10.555 5.111 3.967 1.00 0.00 C ATOM 1066 CD2 PHE A 74 -8.293 4.745 3.308 1.00 0.00 C ATOM 1067 CE1 PHE A 74 -10.672 6.113 3.022 1.00 0.00 C ATOM 1068 CE2 PHE A 74 -8.404 5.746 2.361 1.00 0.00 C ATOM 1069 CZ PHE A 74 -9.595 6.430 2.217 1.00 0.00 C ATOM 0 H PHE A 74 -9.667 2.058 7.232 1.00 0.00 H new ATOM 0 HA PHE A 74 -7.739 4.034 6.515 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -8.519 2.591 4.800 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -10.200 2.817 5.242 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -11.401 4.866 4.593 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -7.359 4.213 3.415 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -11.604 6.647 2.913 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -7.560 5.993 1.734 1.00 0.00 H new ATOM 0 HZ PHE A 74 -9.684 7.211 1.477 1.00 0.00 H new ATOM 1079 N ARG A 75 -10.726 5.015 7.434 1.00 0.00 N ATOM 1080 CA ARG A 75 -11.525 6.180 7.795 1.00 0.00 C ATOM 1081 C ARG A 75 -10.858 6.969 8.919 1.00 0.00 C ATOM 1082 O ARG A 75 -10.804 8.199 8.881 1.00 0.00 O ATOM 1083 CB ARG A 75 -12.929 5.750 8.223 1.00 0.00 C ATOM 1084 CG ARG A 75 -13.724 5.077 7.117 1.00 0.00 C ATOM 1085 CD ARG A 75 -15.061 4.562 7.625 1.00 0.00 C ATOM 1086 NE ARG A 75 -16.005 5.647 7.880 1.00 0.00 N ATOM 1087 CZ ARG A 75 -16.047 6.332 9.017 1.00 0.00 C ATOM 1088 NH1 ARG A 75 -15.203 6.046 9.999 1.00 0.00 N ATOM 1089 NH2 ARG A 75 -16.934 7.306 9.174 1.00 0.00 N ATOM 0 H ARG A 75 -11.157 4.120 7.666 1.00 0.00 H new ATOM 0 HA ARG A 75 -11.601 6.823 6.918 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -12.848 5.067 9.068 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -13.477 6.625 8.572 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -13.890 5.785 6.305 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -13.147 4.249 6.705 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -15.487 3.876 6.893 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -14.906 3.994 8.542 1.00 0.00 H new ATOM 0 HE ARG A 75 -16.668 5.892 7.145 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -14.519 5.298 9.882 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -15.238 6.574 10.871 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -17.585 7.529 8.421 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -16.965 7.831 10.048 1.00 0.00 H new ATOM 1103 N LEU A 76 -10.353 6.254 9.917 1.00 0.00 N ATOM 1104 CA LEU A 76 -9.690 6.886 11.053 1.00 0.00 C ATOM 1105 C LEU A 76 -8.301 7.383 10.664 1.00 0.00 C ATOM 1106 O LEU A 76 -7.964 8.547 10.881 1.00 0.00 O ATOM 1107 CB LEU A 76 -9.584 5.903 12.219 1.00 0.00 C ATOM 1108 CG LEU A 76 -10.821 5.045 12.488 1.00 0.00 C ATOM 1109 CD1 LEU A 76 -10.427 3.733 13.149 1.00 0.00 C ATOM 1110 CD2 LEU A 76 -11.818 5.802 13.353 1.00 0.00 C ATOM 0 H LEU A 76 -10.390 5.236 9.963 1.00 0.00 H new ATOM 0 HA LEU A 76 -10.290 7.742 11.362 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -8.740 5.239 12.033 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -9.354 6.466 13.123 1.00 0.00 H new ATOM 0 HG LEU A 76 -11.297 4.819 11.534 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -11.320 3.136 13.333 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -9.752 3.184 12.493 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -9.927 3.938 14.095 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -12.692 5.176 13.534 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -11.353 6.059 14.304 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.125 6.714 12.841 1.00 0.00 H new ATOM 1122 N SER A 77 -7.499 6.493 10.087 1.00 0.00 N ATOM 1123 CA SER A 77 -6.146 6.841 9.669 1.00 0.00 C ATOM 1124 C SER A 77 -6.160 8.041 8.727 1.00 0.00 C ATOM 1125 O SER A 77 -5.230 8.848 8.719 1.00 0.00 O ATOM 1126 CB SER A 77 -5.479 5.647 8.984 1.00 0.00 C ATOM 1127 OG SER A 77 -5.168 4.630 9.920 1.00 0.00 O ATOM 0 H SER A 77 -7.763 5.526 9.899 1.00 0.00 H new ATOM 0 HA SER A 77 -5.574 7.107 10.558 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.141 5.248 8.216 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.569 5.974 8.482 1.00 0.00 H new ATOM 0 HG SER A 77 -5.927 4.016 10.000 1.00 0.00 H new ATOM 1133 N SER A 78 -7.221 8.151 7.934 1.00 0.00 N ATOM 1134 CA SER A 78 -7.355 9.249 6.985 1.00 0.00 C ATOM 1135 C SER A 78 -7.693 10.551 7.705 1.00 0.00 C ATOM 1136 O SER A 78 -6.922 11.510 7.669 1.00 0.00 O ATOM 1137 CB SER A 78 -8.437 8.929 5.952 1.00 0.00 C ATOM 1138 OG SER A 78 -8.597 9.996 5.033 1.00 0.00 O ATOM 0 H SER A 78 -8.000 7.493 7.930 1.00 0.00 H new ATOM 0 HA SER A 78 -6.400 9.374 6.474 1.00 0.00 H new ATOM 0 HB2 SER A 78 -8.173 8.018 5.414 1.00 0.00 H new ATOM 0 HB3 SER A 78 -9.383 8.737 6.459 1.00 0.00 H new ATOM 0 HG SER A 78 -9.293 9.766 4.382 1.00 0.00 H new ATOM 1144 N GLN A 79 -8.850 10.576 8.357 1.00 0.00 N ATOM 1145 CA GLN A 79 -9.291 11.760 9.085 1.00 0.00 C ATOM 1146 C GLN A 79 -8.163 12.322 9.944 1.00 0.00 C ATOM 1147 O GLN A 79 -8.092 13.528 10.179 1.00 0.00 O ATOM 1148 CB GLN A 79 -10.498 11.425 9.963 1.00 0.00 C ATOM 1149 CG GLN A 79 -10.123 10.930 11.350 1.00 0.00 C ATOM 1150 CD GLN A 79 -11.331 10.726 12.243 1.00 0.00 C ATOM 1151 OE1 GLN A 79 -11.290 11.021 13.438 1.00 0.00 O ATOM 1152 NE2 GLN A 79 -12.414 10.218 11.668 1.00 0.00 N ATOM 0 H GLN A 79 -9.499 9.790 8.396 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.580 12.517 8.356 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -11.124 12.312 10.060 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -11.099 10.664 9.465 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -9.579 9.990 11.261 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -9.447 11.647 11.817 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -12.404 9.988 10.674 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -13.257 10.058 12.220 1.00 0.00 H new ATOM 1161 N GLU A 80 -7.284 11.440 10.409 1.00 0.00 N ATOM 1162 CA GLU A 80 -6.161 11.850 11.243 1.00 0.00 C ATOM 1163 C GLU A 80 -5.172 12.697 10.447 1.00 0.00 C ATOM 1164 O GLU A 80 -4.938 13.862 10.768 1.00 0.00 O ATOM 1165 CB GLU A 80 -5.450 10.623 11.819 1.00 0.00 C ATOM 1166 CG GLU A 80 -6.192 9.977 12.976 1.00 0.00 C ATOM 1167 CD GLU A 80 -5.689 8.580 13.284 1.00 0.00 C ATOM 1168 OE1 GLU A 80 -6.146 7.625 12.622 1.00 0.00 O ATOM 1169 OE2 GLU A 80 -4.839 8.442 14.189 1.00 0.00 O ATOM 0 H GLU A 80 -7.328 10.438 10.222 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.552 12.453 12.063 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.317 9.886 11.027 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.455 10.914 12.154 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.087 10.601 13.864 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.256 9.933 12.741 1.00 0.00 H new ATOM 1176 N ALA A 81 -4.596 12.102 9.408 1.00 0.00 N ATOM 1177 CA ALA A 81 -3.634 12.801 8.564 1.00 0.00 C ATOM 1178 C ALA A 81 -4.149 14.182 8.173 1.00 0.00 C ATOM 1179 O ALA A 81 -3.378 15.136 8.068 1.00 0.00 O ATOM 1180 CB ALA A 81 -3.326 11.979 7.322 1.00 0.00 C ATOM 0 H ALA A 81 -4.779 11.138 9.130 1.00 0.00 H new ATOM 0 HA ALA A 81 -2.715 12.933 9.135 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.607 12.513 6.701 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.907 11.017 7.617 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.243 11.817 6.756 1.00 0.00 H new ATOM 1186 N ALA A 82 -5.457 14.282 7.959 1.00 0.00 N ATOM 1187 CA ALA A 82 -6.074 15.547 7.580 1.00 0.00 C ATOM 1188 C ALA A 82 -6.068 16.531 8.746 1.00 0.00 C ATOM 1189 O ALA A 82 -5.891 17.734 8.554 1.00 0.00 O ATOM 1190 CB ALA A 82 -7.496 15.315 7.090 1.00 0.00 C ATOM 0 H ALA A 82 -6.109 13.502 8.042 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.488 15.980 6.769 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -7.945 16.268 6.810 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.479 14.654 6.224 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.084 14.856 7.885 1.00 0.00 H new ATOM 1196 N SER A 83 -6.264 16.012 9.953 1.00 0.00 N ATOM 1197 CA SER A 83 -6.286 16.846 11.150 1.00 0.00 C ATOM 1198 C SER A 83 -4.878 17.033 11.707 1.00 0.00 C ATOM 1199 O SER A 83 -4.649 17.877 12.573 1.00 0.00 O ATOM 1200 CB SER A 83 -7.190 16.222 12.215 1.00 0.00 C ATOM 1201 OG SER A 83 -7.268 17.048 13.364 1.00 0.00 O ATOM 0 H SER A 83 -6.410 15.018 10.129 1.00 0.00 H new ATOM 0 HA SER A 83 -6.682 17.824 10.875 1.00 0.00 H new ATOM 0 HB2 SER A 83 -8.188 16.068 11.805 1.00 0.00 H new ATOM 0 HB3 SER A 83 -6.806 15.241 12.494 1.00 0.00 H new ATOM 0 HG SER A 83 -6.483 17.633 13.400 1.00 0.00 H new ATOM 1207 N SER A 84 -3.939 16.239 11.203 1.00 0.00 N ATOM 1208 CA SER A 84 -2.553 16.314 11.653 1.00 0.00 C ATOM 1209 C SER A 84 -1.752 17.281 10.786 1.00 0.00 C ATOM 1210 O SER A 84 -1.298 18.324 11.257 1.00 0.00 O ATOM 1211 CB SER A 84 -1.909 14.927 11.619 1.00 0.00 C ATOM 1212 OG SER A 84 -0.713 14.901 12.379 1.00 0.00 O ATOM 0 H SER A 84 -4.112 15.537 10.484 1.00 0.00 H new ATOM 0 HA SER A 84 -2.549 16.684 12.678 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.608 14.188 12.010 1.00 0.00 H new ATOM 0 HB3 SER A 84 -1.694 14.648 10.588 1.00 0.00 H new ATOM 0 HG SER A 84 0.042 14.680 11.794 1.00 0.00 H new ATOM 1218 N PHE A 85 -1.584 16.927 9.517 1.00 0.00 N ATOM 1219 CA PHE A 85 -0.837 17.762 8.583 1.00 0.00 C ATOM 1220 C PHE A 85 -1.783 18.556 7.687 1.00 0.00 C ATOM 1221 O PHE A 85 -1.583 19.748 7.457 1.00 0.00 O ATOM 1222 CB PHE A 85 0.092 16.900 7.725 1.00 0.00 C ATOM 1223 CG PHE A 85 1.027 16.042 8.530 1.00 0.00 C ATOM 1224 CD1 PHE A 85 0.611 14.817 9.026 1.00 0.00 C ATOM 1225 CD2 PHE A 85 2.322 16.461 8.790 1.00 0.00 C ATOM 1226 CE1 PHE A 85 1.469 14.027 9.767 1.00 0.00 C ATOM 1227 CE2 PHE A 85 3.184 15.675 9.531 1.00 0.00 C ATOM 1228 CZ PHE A 85 2.757 14.456 10.019 1.00 0.00 C ATOM 0 H PHE A 85 -1.955 16.068 9.111 1.00 0.00 H new ATOM 0 HA PHE A 85 -0.238 18.464 9.162 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.511 16.261 7.080 1.00 0.00 H new ATOM 0 HB3 PHE A 85 0.677 17.549 7.073 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -0.395 14.476 8.831 1.00 0.00 H new ATOM 0 HD2 PHE A 85 2.662 17.413 8.409 1.00 0.00 H new ATOM 0 HE1 PHE A 85 1.132 13.075 10.149 1.00 0.00 H new ATOM 0 HE2 PHE A 85 4.190 16.014 9.728 1.00 0.00 H new ATOM 0 HZ PHE A 85 3.429 13.839 10.597 1.00 0.00 H new ATOM 1238 N GLY A 86 -2.815 17.885 7.184 1.00 0.00 N ATOM 1239 CA GLY A 86 -3.776 18.543 6.318 1.00 0.00 C ATOM 1240 C GLY A 86 -4.247 17.648 5.189 1.00 0.00 C ATOM 1241 O GLY A 86 -5.387 17.755 4.738 1.00 0.00 O ATOM 0 H GLY A 86 -3.003 16.898 7.361 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -4.635 18.860 6.909 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.327 19.444 5.900 1.00 0.00 H new ATOM 1245 N ASP A 87 -3.367 16.765 4.730 1.00 0.00 N ATOM 1246 CA ASP A 87 -3.699 15.848 3.645 1.00 0.00 C ATOM 1247 C ASP A 87 -4.256 14.538 4.193 1.00 0.00 C ATOM 1248 O ASP A 87 -3.822 14.056 5.239 1.00 0.00 O ATOM 1249 CB ASP A 87 -2.463 15.572 2.787 1.00 0.00 C ATOM 1250 CG ASP A 87 -2.296 16.584 1.670 1.00 0.00 C ATOM 1251 OD1 ASP A 87 -3.272 16.812 0.926 1.00 0.00 O ATOM 1252 OD2 ASP A 87 -1.189 17.148 1.540 1.00 0.00 O ATOM 0 H ASP A 87 -2.419 16.665 5.092 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.464 16.317 3.026 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.575 15.583 3.419 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -2.537 14.572 2.359 1.00 0.00 H new ATOM 1257 N ASP A 88 -5.221 13.968 3.479 1.00 0.00 N ATOM 1258 CA ASP A 88 -5.838 12.713 3.893 1.00 0.00 C ATOM 1259 C ASP A 88 -5.158 11.525 3.221 1.00 0.00 C ATOM 1260 O ASP A 88 -5.590 10.382 3.373 1.00 0.00 O ATOM 1261 CB ASP A 88 -7.330 12.719 3.557 1.00 0.00 C ATOM 1262 CG ASP A 88 -7.593 12.476 2.084 1.00 0.00 C ATOM 1263 OD1 ASP A 88 -6.680 12.725 1.269 1.00 0.00 O ATOM 1264 OD2 ASP A 88 -8.712 12.037 1.746 1.00 0.00 O ATOM 0 H ASP A 88 -5.593 14.355 2.611 1.00 0.00 H new ATOM 0 HA ASP A 88 -5.716 12.615 4.972 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -7.835 11.952 4.144 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -7.761 13.677 3.847 1.00 0.00 H new ATOM 1269 N ARG A 89 -4.092 11.803 2.477 1.00 0.00 N ATOM 1270 CA ARG A 89 -3.354 10.757 1.780 1.00 0.00 C ATOM 1271 C ARG A 89 -2.897 9.673 2.752 1.00 0.00 C ATOM 1272 O ARG A 89 -2.261 9.962 3.767 1.00 0.00 O ATOM 1273 CB ARG A 89 -2.143 11.353 1.059 1.00 0.00 C ATOM 1274 CG ARG A 89 -2.509 12.192 -0.155 1.00 0.00 C ATOM 1275 CD ARG A 89 -1.271 12.639 -0.917 1.00 0.00 C ATOM 1276 NE ARG A 89 -1.585 13.641 -1.931 1.00 0.00 N ATOM 1277 CZ ARG A 89 -0.672 14.209 -2.711 1.00 0.00 C ATOM 1278 NH1 ARG A 89 0.606 13.874 -2.593 1.00 0.00 N ATOM 1279 NH2 ARG A 89 -1.036 15.114 -3.611 1.00 0.00 N ATOM 0 H ARG A 89 -3.721 12.743 2.342 1.00 0.00 H new ATOM 0 HA ARG A 89 -4.021 10.305 1.046 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -1.581 11.970 1.760 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -1.483 10.544 0.746 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -3.156 11.615 -0.816 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -3.077 13.066 0.163 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -0.542 13.048 -0.217 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -0.806 11.775 -1.393 1.00 0.00 H new ATOM 0 HE ARG A 89 -2.559 13.920 -2.047 1.00 0.00 H new ATOM 0 HH11 ARG A 89 0.889 13.179 -1.902 1.00 0.00 H new ATOM 0 HH12 ARG A 89 1.305 14.311 -3.193 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -2.018 15.374 -3.704 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -0.334 15.549 -4.209 1.00 0.00 H new ATOM 1293 N LEU A 90 -3.227 8.426 2.436 1.00 0.00 N ATOM 1294 CA LEU A 90 -2.851 7.298 3.282 1.00 0.00 C ATOM 1295 C LEU A 90 -1.879 6.373 2.556 1.00 0.00 C ATOM 1296 O LEU A 90 -1.621 6.539 1.363 1.00 0.00 O ATOM 1297 CB LEU A 90 -4.096 6.516 3.705 1.00 0.00 C ATOM 1298 CG LEU A 90 -4.907 7.116 4.854 1.00 0.00 C ATOM 1299 CD1 LEU A 90 -5.870 6.086 5.423 1.00 0.00 C ATOM 1300 CD2 LEU A 90 -3.982 7.642 5.942 1.00 0.00 C ATOM 0 H LEU A 90 -3.754 8.170 1.601 1.00 0.00 H new ATOM 0 HA LEU A 90 -2.356 7.691 4.170 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.750 6.416 2.839 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -3.789 5.510 3.990 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.489 7.951 4.465 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.438 6.531 6.240 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.555 5.757 4.641 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.308 5.230 5.797 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -4.576 8.065 6.752 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.373 6.825 6.328 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -3.333 8.413 5.527 1.00 0.00 H new ATOM 1312 N LEU A 91 -1.343 5.399 3.283 1.00 0.00 N ATOM 1313 CA LEU A 91 -0.400 4.446 2.709 1.00 0.00 C ATOM 1314 C LEU A 91 -0.709 3.027 3.173 1.00 0.00 C ATOM 1315 O LEU A 91 -1.285 2.825 4.243 1.00 0.00 O ATOM 1316 CB LEU A 91 1.033 4.820 3.094 1.00 0.00 C ATOM 1317 CG LEU A 91 1.602 6.072 2.425 1.00 0.00 C ATOM 1318 CD1 LEU A 91 2.954 6.428 3.023 1.00 0.00 C ATOM 1319 CD2 LEU A 91 1.719 5.867 0.922 1.00 0.00 C ATOM 0 H LEU A 91 -1.545 5.248 4.271 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.500 4.484 1.624 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.073 4.959 4.174 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.683 3.978 2.857 1.00 0.00 H new ATOM 0 HG LEU A 91 0.918 6.901 2.606 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.344 7.321 2.535 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.841 6.618 4.090 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.648 5.601 2.873 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.126 6.768 0.462 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.382 5.026 0.720 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.733 5.660 0.505 1.00 0.00 H new ATOM 1331 N ILE A 92 -0.321 2.047 2.364 1.00 0.00 N ATOM 1332 CA ILE A 92 -0.554 0.646 2.694 1.00 0.00 C ATOM 1333 C ILE A 92 0.700 -0.189 2.465 1.00 0.00 C ATOM 1334 O ILE A 92 1.204 -0.274 1.345 1.00 0.00 O ATOM 1335 CB ILE A 92 -1.709 0.057 1.863 1.00 0.00 C ATOM 1336 CG1 ILE A 92 -2.946 0.953 1.960 1.00 0.00 C ATOM 1337 CG2 ILE A 92 -2.033 -1.354 2.333 1.00 0.00 C ATOM 1338 CD1 ILE A 92 -4.184 0.343 1.342 1.00 0.00 C ATOM 0 H ILE A 92 0.156 2.197 1.475 1.00 0.00 H new ATOM 0 HA ILE A 92 -0.822 0.611 3.750 1.00 0.00 H new ATOM 0 HB ILE A 92 -1.399 0.010 0.819 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -3.144 1.173 3.009 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -2.736 1.903 1.470 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -2.851 -1.757 1.736 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -1.153 -1.987 2.217 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -2.327 -1.329 3.382 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -5.021 1.033 1.447 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -4.005 0.149 0.285 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -4.420 -0.593 1.848 1.00 0.00 H new ATOM 1350 N GLU A 93 1.199 -0.805 3.532 1.00 0.00 N ATOM 1351 CA GLU A 93 2.395 -1.634 3.446 1.00 0.00 C ATOM 1352 C GLU A 93 2.142 -3.016 4.042 1.00 0.00 C ATOM 1353 O GLU A 93 1.379 -3.164 4.997 1.00 0.00 O ATOM 1354 CB GLU A 93 3.563 -0.961 4.169 1.00 0.00 C ATOM 1355 CG GLU A 93 4.180 0.188 3.389 1.00 0.00 C ATOM 1356 CD GLU A 93 5.104 -0.286 2.284 1.00 0.00 C ATOM 1357 OE1 GLU A 93 4.844 -1.368 1.718 1.00 0.00 O ATOM 1358 OE2 GLU A 93 6.086 0.425 1.986 1.00 0.00 O ATOM 0 H GLU A 93 0.793 -0.745 4.466 1.00 0.00 H new ATOM 0 HA GLU A 93 2.649 -1.752 2.393 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.217 -0.590 5.134 1.00 0.00 H new ATOM 0 HB3 GLU A 93 4.332 -1.706 4.371 1.00 0.00 H new ATOM 0 HG2 GLU A 93 3.386 0.797 2.957 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.737 0.829 4.073 1.00 0.00 H new ATOM 1365 N LYS A 94 2.788 -4.027 3.471 1.00 0.00 N ATOM 1366 CA LYS A 94 2.636 -5.398 3.944 1.00 0.00 C ATOM 1367 C LYS A 94 3.011 -5.509 5.418 1.00 0.00 C ATOM 1368 O LYS A 94 4.071 -5.044 5.837 1.00 0.00 O ATOM 1369 CB LYS A 94 3.504 -6.346 3.113 1.00 0.00 C ATOM 1370 CG LYS A 94 3.729 -7.697 3.769 1.00 0.00 C ATOM 1371 CD LYS A 94 2.462 -8.536 3.767 1.00 0.00 C ATOM 1372 CE LYS A 94 2.778 -10.022 3.712 1.00 0.00 C ATOM 1373 NZ LYS A 94 1.614 -10.819 3.235 1.00 0.00 N ATOM 0 H LYS A 94 3.422 -3.923 2.679 1.00 0.00 H new ATOM 0 HA LYS A 94 1.589 -5.681 3.831 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.034 -6.497 2.141 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.470 -5.875 2.930 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.521 -8.231 3.243 1.00 0.00 H new ATOM 0 HG3 LYS A 94 4.069 -7.552 4.794 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.880 -8.320 4.663 1.00 0.00 H new ATOM 0 HD3 LYS A 94 1.844 -8.262 2.912 1.00 0.00 H new ATOM 0 HE2 LYS A 94 3.628 -10.188 3.050 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.073 -10.367 4.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.454 -11.620 3.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 0.766 -10.217 3.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.808 -11.178 2.278 1.00 0.00 H new ATOM 1387 N PHE A 95 2.135 -6.130 6.202 1.00 0.00 N ATOM 1388 CA PHE A 95 2.374 -6.303 7.630 1.00 0.00 C ATOM 1389 C PHE A 95 2.841 -7.723 7.935 1.00 0.00 C ATOM 1390 O PHE A 95 2.160 -8.696 7.609 1.00 0.00 O ATOM 1391 CB PHE A 95 1.104 -5.990 8.423 1.00 0.00 C ATOM 1392 CG PHE A 95 1.321 -5.942 9.908 1.00 0.00 C ATOM 1393 CD1 PHE A 95 2.107 -4.952 10.475 1.00 0.00 C ATOM 1394 CD2 PHE A 95 0.741 -6.888 10.738 1.00 0.00 C ATOM 1395 CE1 PHE A 95 2.308 -4.904 11.842 1.00 0.00 C ATOM 1396 CE2 PHE A 95 0.939 -6.846 12.105 1.00 0.00 C ATOM 1397 CZ PHE A 95 1.724 -5.853 12.658 1.00 0.00 C ATOM 0 H PHE A 95 1.253 -6.522 5.872 1.00 0.00 H new ATOM 0 HA PHE A 95 3.160 -5.609 7.928 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.705 -5.031 8.091 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.350 -6.744 8.198 1.00 0.00 H new ATOM 0 HD1 PHE A 95 2.568 -4.209 9.842 1.00 0.00 H new ATOM 0 HD2 PHE A 95 0.127 -7.667 10.311 1.00 0.00 H new ATOM 0 HE1 PHE A 95 2.921 -4.125 12.271 1.00 0.00 H new ATOM 0 HE2 PHE A 95 0.480 -7.589 12.741 1.00 0.00 H new ATOM 0 HZ PHE A 95 1.881 -5.819 13.726 1.00 0.00 H new ATOM 1407 N ILE A 96 4.008 -7.834 8.561 1.00 0.00 N ATOM 1408 CA ILE A 96 4.566 -9.135 8.911 1.00 0.00 C ATOM 1409 C ILE A 96 4.744 -9.269 10.419 1.00 0.00 C ATOM 1410 O ILE A 96 5.703 -8.750 10.990 1.00 0.00 O ATOM 1411 CB ILE A 96 5.924 -9.368 8.222 1.00 0.00 C ATOM 1412 CG1 ILE A 96 5.790 -9.188 6.709 1.00 0.00 C ATOM 1413 CG2 ILE A 96 6.453 -10.756 8.551 1.00 0.00 C ATOM 1414 CD1 ILE A 96 5.280 -10.422 5.996 1.00 0.00 C ATOM 0 H ILE A 96 4.585 -7.039 8.836 1.00 0.00 H new ATOM 0 HA ILE A 96 3.857 -9.887 8.563 1.00 0.00 H new ATOM 0 HB ILE A 96 6.636 -8.631 8.595 1.00 0.00 H new ATOM 0 HG12 ILE A 96 5.114 -8.357 6.509 1.00 0.00 H new ATOM 0 HG13 ILE A 96 6.761 -8.915 6.296 1.00 0.00 H new ATOM 0 HG21 ILE A 96 7.413 -10.906 8.057 1.00 0.00 H new ATOM 0 HG22 ILE A 96 6.581 -10.850 9.629 1.00 0.00 H new ATOM 0 HG23 ILE A 96 5.744 -11.507 8.203 1.00 0.00 H new ATOM 0 HD11 ILE A 96 5.210 -10.222 4.927 1.00 0.00 H new ATOM 0 HD12 ILE A 96 5.968 -11.251 6.166 1.00 0.00 H new ATOM 0 HD13 ILE A 96 4.295 -10.684 6.381 1.00 0.00 H new ATOM 1426 N ASP A 97 3.815 -9.970 11.059 1.00 0.00 N ATOM 1427 CA ASP A 97 3.870 -10.176 12.502 1.00 0.00 C ATOM 1428 C ASP A 97 4.934 -11.208 12.863 1.00 0.00 C ATOM 1429 O ASP A 97 5.706 -11.015 13.802 1.00 0.00 O ATOM 1430 CB ASP A 97 2.506 -10.627 13.027 1.00 0.00 C ATOM 1431 CG ASP A 97 2.547 -11.004 14.494 1.00 0.00 C ATOM 1432 OD1 ASP A 97 3.349 -10.403 15.240 1.00 0.00 O ATOM 1433 OD2 ASP A 97 1.776 -11.899 14.898 1.00 0.00 O ATOM 0 H ASP A 97 3.014 -10.406 10.601 1.00 0.00 H new ATOM 0 HA ASP A 97 4.135 -9.228 12.970 1.00 0.00 H new ATOM 0 HB2 ASP A 97 1.781 -9.827 12.881 1.00 0.00 H new ATOM 0 HB3 ASP A 97 2.160 -11.481 12.445 1.00 0.00 H new ATOM 1438 N ASN A 98 4.969 -12.303 12.111 1.00 0.00 N ATOM 1439 CA ASN A 98 5.938 -13.366 12.353 1.00 0.00 C ATOM 1440 C ASN A 98 7.153 -13.212 11.444 1.00 0.00 C ATOM 1441 O ASN A 98 7.045 -12.819 10.282 1.00 0.00 O ATOM 1442 CB ASN A 98 5.291 -14.735 12.131 1.00 0.00 C ATOM 1443 CG ASN A 98 4.790 -14.913 10.710 1.00 0.00 C ATOM 1444 OD1 ASN A 98 5.568 -15.183 9.795 1.00 0.00 O ATOM 1445 ND2 ASN A 98 3.484 -14.762 10.521 1.00 0.00 N ATOM 0 H ASN A 98 4.338 -12.478 11.329 1.00 0.00 H new ATOM 0 HA ASN A 98 6.270 -13.292 13.389 1.00 0.00 H new ATOM 0 HB2 ASN A 98 6.015 -15.517 12.359 1.00 0.00 H new ATOM 0 HB3 ASN A 98 4.459 -14.858 12.825 1.00 0.00 H new ATOM 0 HD21 ASN A 98 3.088 -14.870 9.587 1.00 0.00 H new ATOM 0 HD22 ASN A 98 2.877 -14.538 11.310 1.00 0.00 H new ATOM 1452 N PRO A 99 8.340 -13.528 11.984 1.00 0.00 N ATOM 1453 CA PRO A 99 9.599 -13.434 11.239 1.00 0.00 C ATOM 1454 C PRO A 99 9.705 -14.490 10.145 1.00 0.00 C ATOM 1455 O PRO A 99 10.667 -14.506 9.376 1.00 0.00 O ATOM 1456 CB PRO A 99 10.665 -13.667 12.313 1.00 0.00 C ATOM 1457 CG PRO A 99 9.974 -14.465 13.365 1.00 0.00 C ATOM 1458 CD PRO A 99 8.544 -14.002 13.363 1.00 0.00 C ATOM 0 HA PRO A 99 9.697 -12.479 10.722 1.00 0.00 H new ATOM 0 HB2 PRO A 99 11.524 -14.203 11.909 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.038 -12.724 12.712 1.00 0.00 H new ATOM 0 HG2 PRO A 99 10.039 -15.532 13.151 1.00 0.00 H new ATOM 0 HG3 PRO A 99 10.434 -14.307 14.340 1.00 0.00 H new ATOM 0 HD2 PRO A 99 7.859 -14.812 13.615 1.00 0.00 H new ATOM 0 HD3 PRO A 99 8.378 -13.207 14.090 1.00 0.00 H new ATOM 1466 N ARG A 100 8.712 -15.370 10.080 1.00 0.00 N ATOM 1467 CA ARG A 100 8.695 -16.430 9.079 1.00 0.00 C ATOM 1468 C ARG A 100 8.724 -15.848 7.669 1.00 0.00 C ATOM 1469 O ARG A 100 9.716 -15.980 6.952 1.00 0.00 O ATOM 1470 CB ARG A 100 7.453 -17.307 9.255 1.00 0.00 C ATOM 1471 CG ARG A 100 7.653 -18.744 8.803 1.00 0.00 C ATOM 1472 CD ARG A 100 8.542 -19.514 9.768 1.00 0.00 C ATOM 1473 NE ARG A 100 7.896 -19.717 11.062 1.00 0.00 N ATOM 1474 CZ ARG A 100 8.463 -20.368 12.072 1.00 0.00 C ATOM 1475 NH1 ARG A 100 9.680 -20.876 11.937 1.00 0.00 N ATOM 1476 NH2 ARG A 100 7.812 -20.511 13.219 1.00 0.00 N ATOM 0 H ARG A 100 7.909 -15.370 10.708 1.00 0.00 H new ATOM 0 HA ARG A 100 9.586 -17.041 9.219 1.00 0.00 H new ATOM 0 HB2 ARG A 100 7.161 -17.303 10.305 1.00 0.00 H new ATOM 0 HB3 ARG A 100 6.627 -16.870 8.693 1.00 0.00 H new ATOM 0 HG2 ARG A 100 6.685 -19.240 8.724 1.00 0.00 H new ATOM 0 HG3 ARG A 100 8.099 -18.755 7.808 1.00 0.00 H new ATOM 0 HD2 ARG A 100 8.796 -20.481 9.334 1.00 0.00 H new ATOM 0 HD3 ARG A 100 9.477 -18.973 9.910 1.00 0.00 H new ATOM 0 HE ARG A 100 6.959 -19.338 11.198 1.00 0.00 H new ATOM 0 HH11 ARG A 100 10.183 -20.767 11.056 1.00 0.00 H new ATOM 0 HH12 ARG A 100 10.113 -21.375 12.714 1.00 0.00 H new ATOM 0 HH21 ARG A 100 6.876 -20.121 13.326 1.00 0.00 H new ATOM 0 HH22 ARG A 100 8.248 -21.011 13.994 1.00 0.00 H new ATOM 1490 N HIS A 101 7.629 -15.203 7.278 1.00 0.00 N ATOM 1491 CA HIS A 101 7.529 -14.600 5.954 1.00 0.00 C ATOM 1492 C HIS A 101 8.406 -13.355 5.856 1.00 0.00 C ATOM 1493 O HIS A 101 7.943 -12.238 6.090 1.00 0.00 O ATOM 1494 CB HIS A 101 6.076 -14.240 5.643 1.00 0.00 C ATOM 1495 CG HIS A 101 5.772 -14.189 4.177 1.00 0.00 C ATOM 1496 ND1 HIS A 101 4.981 -13.214 3.606 1.00 0.00 N ATOM 1497 CD2 HIS A 101 6.160 -14.998 3.164 1.00 0.00 C ATOM 1498 CE1 HIS A 101 4.894 -13.427 2.305 1.00 0.00 C ATOM 1499 NE2 HIS A 101 5.601 -14.503 2.011 1.00 0.00 N ATOM 0 H HIS A 101 6.799 -15.085 7.859 1.00 0.00 H new ATOM 0 HA HIS A 101 7.880 -15.328 5.223 1.00 0.00 H new ATOM 0 HB2 HIS A 101 5.420 -14.970 6.116 1.00 0.00 H new ATOM 0 HB3 HIS A 101 5.847 -13.271 6.087 1.00 0.00 H new ATOM 0 HD2 HIS A 101 6.791 -15.870 3.247 1.00 0.00 H new ATOM 0 HE1 HIS A 101 4.339 -12.824 1.602 1.00 0.00 H new ATOM 0 HE2 HIS A 101 5.714 -14.902 1.079 1.00 0.00 H new ATOM 1508 N ILE A 102 9.673 -13.556 5.510 1.00 0.00 N ATOM 1509 CA ILE A 102 10.613 -12.450 5.381 1.00 0.00 C ATOM 1510 C ILE A 102 10.507 -11.795 4.009 1.00 0.00 C ATOM 1511 O ILE A 102 11.429 -11.112 3.562 1.00 0.00 O ATOM 1512 CB ILE A 102 12.064 -12.915 5.605 1.00 0.00 C ATOM 1513 CG1 ILE A 102 12.459 -13.949 4.548 1.00 0.00 C ATOM 1514 CG2 ILE A 102 12.226 -13.491 7.003 1.00 0.00 C ATOM 1515 CD1 ILE A 102 12.997 -13.336 3.274 1.00 0.00 C ATOM 0 H ILE A 102 10.072 -14.474 5.314 1.00 0.00 H new ATOM 0 HA ILE A 102 10.351 -11.722 6.149 1.00 0.00 H new ATOM 0 HB ILE A 102 12.725 -12.054 5.510 1.00 0.00 H new ATOM 0 HG12 ILE A 102 13.213 -14.615 4.967 1.00 0.00 H new ATOM 0 HG13 ILE A 102 11.590 -14.561 4.308 1.00 0.00 H new ATOM 0 HG21 ILE A 102 13.257 -13.815 7.146 1.00 0.00 H new ATOM 0 HG22 ILE A 102 11.980 -12.728 7.742 1.00 0.00 H new ATOM 0 HG23 ILE A 102 11.558 -14.343 7.125 1.00 0.00 H new ATOM 0 HD11 ILE A 102 13.256 -14.127 2.571 1.00 0.00 H new ATOM 0 HD12 ILE A 102 12.237 -12.692 2.831 1.00 0.00 H new ATOM 0 HD13 ILE A 102 13.885 -12.747 3.501 1.00 0.00 H new ATOM 1527 N SER A 103 9.375 -12.005 3.344 1.00 0.00 N ATOM 1528 CA SER A 103 9.148 -11.437 2.021 1.00 0.00 C ATOM 1529 C SER A 103 10.133 -12.011 1.007 1.00 0.00 C ATOM 1530 O SER A 103 10.672 -11.288 0.170 1.00 0.00 O ATOM 1531 CB SER A 103 9.277 -9.913 2.068 1.00 0.00 C ATOM 1532 OG SER A 103 8.857 -9.328 0.848 1.00 0.00 O ATOM 0 H SER A 103 8.601 -12.565 3.701 1.00 0.00 H new ATOM 0 HA SER A 103 8.137 -11.700 1.709 1.00 0.00 H new ATOM 0 HB2 SER A 103 8.678 -9.519 2.889 1.00 0.00 H new ATOM 0 HB3 SER A 103 10.313 -9.639 2.269 1.00 0.00 H new ATOM 0 HG SER A 103 9.291 -9.787 0.099 1.00 0.00 H new ATOM 1538 N GLY A 104 10.363 -13.318 1.089 1.00 0.00 N ATOM 1539 CA GLY A 104 11.282 -13.969 0.174 1.00 0.00 C ATOM 1540 C GLY A 104 12.641 -13.296 0.142 1.00 0.00 C ATOM 1541 O GLY A 104 12.838 -12.220 0.705 1.00 0.00 O ATOM 0 H GLY A 104 9.929 -13.938 1.773 1.00 0.00 H new ATOM 0 HA2 GLY A 104 11.403 -15.012 0.466 1.00 0.00 H new ATOM 0 HA3 GLY A 104 10.855 -13.966 -0.829 1.00 0.00 H new ATOM 1545 N PRO A 105 13.607 -13.939 -0.530 1.00 0.00 N ATOM 1546 CA PRO A 105 14.971 -13.415 -0.649 1.00 0.00 C ATOM 1547 C PRO A 105 15.042 -12.178 -1.536 1.00 0.00 C ATOM 1548 O PRO A 105 14.024 -11.706 -2.042 1.00 0.00 O ATOM 1549 CB PRO A 105 15.742 -14.575 -1.285 1.00 0.00 C ATOM 1550 CG PRO A 105 14.711 -15.355 -2.025 1.00 0.00 C ATOM 1551 CD PRO A 105 13.443 -15.226 -1.226 1.00 0.00 C ATOM 0 HA PRO A 105 15.371 -13.096 0.314 1.00 0.00 H new ATOM 0 HB2 PRO A 105 16.521 -14.212 -1.956 1.00 0.00 H new ATOM 0 HB3 PRO A 105 16.233 -15.186 -0.528 1.00 0.00 H new ATOM 0 HG2 PRO A 105 14.578 -14.966 -3.035 1.00 0.00 H new ATOM 0 HG3 PRO A 105 15.007 -16.400 -2.122 1.00 0.00 H new ATOM 0 HD2 PRO A 105 12.562 -15.226 -1.868 1.00 0.00 H new ATOM 0 HD3 PRO A 105 13.325 -16.051 -0.523 1.00 0.00 H new ATOM 1559 N SER A 106 16.251 -11.657 -1.723 1.00 0.00 N ATOM 1560 CA SER A 106 16.453 -10.471 -2.547 1.00 0.00 C ATOM 1561 C SER A 106 16.931 -10.856 -3.944 1.00 0.00 C ATOM 1562 O SER A 106 17.112 -12.036 -4.247 1.00 0.00 O ATOM 1563 CB SER A 106 17.467 -9.534 -1.889 1.00 0.00 C ATOM 1564 OG SER A 106 16.966 -9.015 -0.670 1.00 0.00 O ATOM 0 H SER A 106 17.105 -12.038 -1.315 1.00 0.00 H new ATOM 0 HA SER A 106 15.498 -9.954 -2.638 1.00 0.00 H new ATOM 0 HB2 SER A 106 18.397 -10.072 -1.704 1.00 0.00 H new ATOM 0 HB3 SER A 106 17.703 -8.714 -2.567 1.00 0.00 H new ATOM 0 HG SER A 106 17.634 -8.421 -0.269 1.00 0.00 H new ATOM 1570 N SER A 107 17.134 -9.852 -4.791 1.00 0.00 N ATOM 1571 CA SER A 107 17.588 -10.084 -6.157 1.00 0.00 C ATOM 1572 C SER A 107 18.730 -9.139 -6.519 1.00 0.00 C ATOM 1573 O SER A 107 19.843 -9.575 -6.808 1.00 0.00 O ATOM 1574 CB SER A 107 16.429 -9.902 -7.140 1.00 0.00 C ATOM 1575 OG SER A 107 16.645 -10.645 -8.327 1.00 0.00 O ATOM 0 H SER A 107 16.991 -8.870 -4.555 1.00 0.00 H new ATOM 0 HA SER A 107 17.954 -11.109 -6.223 1.00 0.00 H new ATOM 0 HB2 SER A 107 15.498 -10.221 -6.672 1.00 0.00 H new ATOM 0 HB3 SER A 107 16.317 -8.846 -7.384 1.00 0.00 H new ATOM 0 HG SER A 107 15.890 -10.513 -8.937 1.00 0.00 H new ATOM 1581 N GLY A 108 18.443 -7.841 -6.500 1.00 0.00 N ATOM 1582 CA GLY A 108 19.455 -6.853 -6.828 1.00 0.00 C ATOM 1583 C GLY A 108 18.857 -5.558 -7.339 1.00 0.00 C ATOM 1584 O GLY A 108 19.206 -5.090 -8.422 1.00 0.00 O ATOM 0 H GLY A 108 17.529 -7.456 -6.264 1.00 0.00 H new ATOM 0 HA2 GLY A 108 20.057 -6.647 -5.943 1.00 0.00 H new ATOM 0 HA3 GLY A 108 20.127 -7.262 -7.583 1.00 0.00 H new TER 1588 GLY A 108