USER MOD reduce.3.24.130724 H: found=0, std=0, add=710, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 711 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 912 SER OG : rot 180:sc= 0 USER MOD Single : A 913 SER OG : rot 180:sc= 0 USER MOD Single : A 915 SER OG : rot 180:sc= 0 USER MOD Single : A 916 SER OG : rot 180:sc= 0 USER MOD Single : A 919 SER OG : rot 180:sc= 0 USER MOD Single : A 920 SER OG : rot 180:sc= 0 USER MOD Single : A 922 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.34) USER MOD Single : A 926 THR OG1 : rot 90:sc= -0.682 USER MOD Single : A 929 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0188) USER MOD Single : A 931 GLN : amide:sc= -0.109 X(o=-0.11,f=0) USER MOD Single : A 932 ASN : amide:sc= -0.561 X(o=-0.56,f=-0.39) USER MOD Single : A 933 MET CE :methyl -170:sc= -0.974 (180deg=-1.32) USER MOD Single : A 936 THR OG1 : rot 180:sc= 0 USER MOD Single : A 938 SER OG : rot 7:sc= 0.073 USER MOD Single : A 947 TYR OH : rot 180:sc= 0 USER MOD Single : A 949 TYR OH : rot 180:sc=-0.00128 USER MOD Single : A 950 GLN : amide:sc= -0.0643 X(o=-0.064,f=-0.13) USER MOD Single : A 955 SER OG : rot -115:sc= 0.759 USER MOD Single : A 957 CYS SG : rot 70:sc= 0.00213 USER MOD Single : A 959 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 960 TYR OH : rot 180:sc= 0 USER MOD Single : A 961 ASN :FLIP amide:sc= -7.69! C(o=-8.9!,f=-7.7!) USER MOD Single : A 963 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 965 MET CE :methyl -147:sc= -0.16 (180deg=-0.702) USER MOD Single : A 967 THR OG1 : rot -70:sc= 0.0312 USER MOD Single : A 971 MET CE :methyl -167:sc= 0 (180deg=-0.231) USER MOD Single : A 976 SER OG : rot 180:sc= -0.299 USER MOD Single : A 981 THR OG1 : rot 76:sc= 0.784 USER MOD Single : A 988 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 994 SER OG : rot -31:sc= 0.807 USER MOD Single : A 996 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 998 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0533) USER MOD Single : A1003 SER OG : rot 180:sc= 0 USER MOD Single : A1006 SER OG : rot 180:sc= 0 USER MOD Single : A1007 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 911 1.773 -19.257 2.731 1.00 0.00 N ATOM 2 CA GLY A 911 2.934 -18.685 2.075 1.00 0.00 C ATOM 3 C GLY A 911 4.025 -18.303 3.056 1.00 0.00 C ATOM 4 O GLY A 911 4.353 -19.072 3.961 1.00 0.00 O ATOM 0 HA2 GLY A 911 3.331 -19.402 1.356 1.00 0.00 H new ATOM 0 HA3 GLY A 911 2.631 -17.802 1.512 1.00 0.00 H new ATOM 8 N SER A 912 4.590 -17.114 2.877 1.00 0.00 N ATOM 9 CA SER A 912 5.654 -16.633 3.751 1.00 0.00 C ATOM 10 C SER A 912 5.101 -16.244 5.118 1.00 0.00 C ATOM 11 O SER A 912 4.483 -15.191 5.273 1.00 0.00 O ATOM 12 CB SER A 912 6.363 -15.435 3.115 1.00 0.00 C ATOM 13 OG SER A 912 7.404 -14.958 3.949 1.00 0.00 O ATOM 0 H SER A 912 4.329 -16.465 2.134 1.00 0.00 H new ATOM 0 HA SER A 912 6.372 -17.442 3.886 1.00 0.00 H new ATOM 0 HB2 SER A 912 6.772 -15.722 2.146 1.00 0.00 H new ATOM 0 HB3 SER A 912 5.643 -14.637 2.933 1.00 0.00 H new ATOM 0 HG SER A 912 7.843 -14.194 3.520 1.00 0.00 H new ATOM 19 N SER A 913 5.327 -17.103 6.107 1.00 0.00 N ATOM 20 CA SER A 913 4.848 -16.852 7.462 1.00 0.00 C ATOM 21 C SER A 913 5.585 -15.673 8.089 1.00 0.00 C ATOM 22 O SER A 913 6.727 -15.802 8.527 1.00 0.00 O ATOM 23 CB SER A 913 5.029 -18.100 8.328 1.00 0.00 C ATOM 24 OG SER A 913 4.646 -17.850 9.669 1.00 0.00 O ATOM 0 H SER A 913 5.838 -17.978 5.996 1.00 0.00 H new ATOM 0 HA SER A 913 3.787 -16.607 7.407 1.00 0.00 H new ATOM 0 HB2 SER A 913 4.433 -18.917 7.923 1.00 0.00 H new ATOM 0 HB3 SER A 913 6.071 -18.420 8.298 1.00 0.00 H new ATOM 0 HG SER A 913 4.770 -18.663 10.202 1.00 0.00 H new ATOM 30 N GLY A 914 4.921 -14.521 8.127 1.00 0.00 N ATOM 31 CA GLY A 914 5.527 -13.334 8.701 1.00 0.00 C ATOM 32 C GLY A 914 5.086 -13.092 10.131 1.00 0.00 C ATOM 33 O GLY A 914 3.891 -13.095 10.428 1.00 0.00 O ATOM 0 H GLY A 914 3.974 -14.389 7.770 1.00 0.00 H new ATOM 0 HA2 GLY A 914 6.612 -13.433 8.670 1.00 0.00 H new ATOM 0 HA3 GLY A 914 5.268 -12.467 8.093 1.00 0.00 H new ATOM 37 N SER A 915 6.052 -12.883 11.020 1.00 0.00 N ATOM 38 CA SER A 915 5.756 -12.643 12.428 1.00 0.00 C ATOM 39 C SER A 915 5.380 -11.183 12.663 1.00 0.00 C ATOM 40 O SER A 915 6.025 -10.273 12.144 1.00 0.00 O ATOM 41 CB SER A 915 6.960 -13.017 13.294 1.00 0.00 C ATOM 42 OG SER A 915 8.094 -12.237 12.956 1.00 0.00 O ATOM 0 H SER A 915 7.046 -12.875 10.791 1.00 0.00 H new ATOM 0 HA SER A 915 4.908 -13.268 12.708 1.00 0.00 H new ATOM 0 HB2 SER A 915 6.715 -12.871 14.346 1.00 0.00 H new ATOM 0 HB3 SER A 915 7.190 -14.074 13.165 1.00 0.00 H new ATOM 0 HG SER A 915 8.849 -12.494 13.525 1.00 0.00 H new ATOM 48 N SER A 916 4.330 -10.969 13.449 1.00 0.00 N ATOM 49 CA SER A 916 3.864 -9.621 13.751 1.00 0.00 C ATOM 50 C SER A 916 3.600 -9.459 15.245 1.00 0.00 C ATOM 51 O SER A 916 3.671 -10.422 16.007 1.00 0.00 O ATOM 52 CB SER A 916 2.591 -9.310 12.961 1.00 0.00 C ATOM 53 OG SER A 916 1.543 -10.197 13.311 1.00 0.00 O ATOM 0 H SER A 916 3.786 -11.712 13.888 1.00 0.00 H new ATOM 0 HA SER A 916 4.646 -8.919 13.459 1.00 0.00 H new ATOM 0 HB2 SER A 916 2.282 -8.283 13.154 1.00 0.00 H new ATOM 0 HB3 SER A 916 2.795 -9.386 11.893 1.00 0.00 H new ATOM 0 HG SER A 916 0.741 -9.976 12.794 1.00 0.00 H new ATOM 59 N GLY A 917 3.297 -8.231 15.657 1.00 0.00 N ATOM 60 CA GLY A 917 3.028 -7.964 17.058 1.00 0.00 C ATOM 61 C GLY A 917 1.761 -7.156 17.261 1.00 0.00 C ATOM 62 O GLY A 917 0.777 -7.659 17.801 1.00 0.00 O ATOM 0 H GLY A 917 3.233 -7.417 15.046 1.00 0.00 H new ATOM 0 HA2 GLY A 917 2.943 -8.909 17.595 1.00 0.00 H new ATOM 0 HA3 GLY A 917 3.872 -7.426 17.491 1.00 0.00 H new ATOM 66 N ALA A 918 1.787 -5.900 16.829 1.00 0.00 N ATOM 67 CA ALA A 918 0.632 -5.021 16.966 1.00 0.00 C ATOM 68 C ALA A 918 0.657 -3.914 15.918 1.00 0.00 C ATOM 69 O ALA A 918 1.626 -3.160 15.822 1.00 0.00 O ATOM 70 CB ALA A 918 0.585 -4.426 18.366 1.00 0.00 C ATOM 0 H ALA A 918 2.595 -5.468 16.381 1.00 0.00 H new ATOM 0 HA ALA A 918 -0.267 -5.616 16.806 1.00 0.00 H new ATOM 0 HB1 ALA A 918 -0.282 -3.772 18.454 1.00 0.00 H new ATOM 0 HB2 ALA A 918 0.511 -5.228 19.100 1.00 0.00 H new ATOM 0 HB3 ALA A 918 1.493 -3.851 18.548 1.00 0.00 H new ATOM 76 N SER A 919 -0.413 -3.822 15.135 1.00 0.00 N ATOM 77 CA SER A 919 -0.511 -2.808 14.091 1.00 0.00 C ATOM 78 C SER A 919 -1.958 -2.362 13.901 1.00 0.00 C ATOM 79 O SER A 919 -2.816 -3.153 13.510 1.00 0.00 O ATOM 80 CB SER A 919 0.045 -3.349 12.772 1.00 0.00 C ATOM 81 OG SER A 919 -0.356 -2.541 11.680 1.00 0.00 O ATOM 0 H SER A 919 -1.224 -4.437 15.203 1.00 0.00 H new ATOM 0 HA SER A 919 0.079 -1.945 14.400 1.00 0.00 H new ATOM 0 HB2 SER A 919 1.133 -3.386 12.821 1.00 0.00 H new ATOM 0 HB3 SER A 919 -0.302 -4.371 12.619 1.00 0.00 H new ATOM 0 HG SER A 919 0.013 -2.907 10.849 1.00 0.00 H new ATOM 87 N SER A 920 -2.220 -1.090 14.182 1.00 0.00 N ATOM 88 CA SER A 920 -3.563 -0.538 14.046 1.00 0.00 C ATOM 89 C SER A 920 -3.535 0.771 13.263 1.00 0.00 C ATOM 90 O SER A 920 -2.591 1.552 13.371 1.00 0.00 O ATOM 91 CB SER A 920 -4.184 -0.308 15.425 1.00 0.00 C ATOM 92 OG SER A 920 -3.687 0.879 16.017 1.00 0.00 O ATOM 0 H SER A 920 -1.520 -0.422 14.505 1.00 0.00 H new ATOM 0 HA SER A 920 -4.171 -1.257 13.497 1.00 0.00 H new ATOM 0 HB2 SER A 920 -5.268 -0.246 15.333 1.00 0.00 H new ATOM 0 HB3 SER A 920 -3.967 -1.159 16.071 1.00 0.00 H new ATOM 0 HG SER A 920 -4.101 1.004 16.897 1.00 0.00 H new ATOM 98 N GLY A 921 -4.580 1.004 12.474 1.00 0.00 N ATOM 99 CA GLY A 921 -4.657 2.219 11.684 1.00 0.00 C ATOM 100 C GLY A 921 -4.911 3.448 12.534 1.00 0.00 C ATOM 101 O GLY A 921 -5.298 3.339 13.698 1.00 0.00 O ATOM 0 H GLY A 921 -5.374 0.373 12.368 1.00 0.00 H new ATOM 0 HA2 GLY A 921 -3.726 2.349 11.132 1.00 0.00 H new ATOM 0 HA3 GLY A 921 -5.454 2.120 10.947 1.00 0.00 H new ATOM 105 N LYS A 922 -4.692 4.623 11.954 1.00 0.00 N ATOM 106 CA LYS A 922 -4.899 5.879 12.665 1.00 0.00 C ATOM 107 C LYS A 922 -5.334 6.982 11.705 1.00 0.00 C ATOM 108 O LYS A 922 -5.013 6.966 10.516 1.00 0.00 O ATOM 109 CB LYS A 922 -3.617 6.295 13.389 1.00 0.00 C ATOM 110 CG LYS A 922 -2.536 6.822 12.461 1.00 0.00 C ATOM 111 CD LYS A 922 -1.655 7.847 13.155 1.00 0.00 C ATOM 112 CE LYS A 922 -0.556 7.179 13.966 1.00 0.00 C ATOM 113 NZ LYS A 922 -1.037 6.759 15.312 1.00 0.00 N ATOM 0 H LYS A 922 -4.371 4.732 10.992 1.00 0.00 H new ATOM 0 HA LYS A 922 -5.691 5.727 13.399 1.00 0.00 H new ATOM 0 HB2 LYS A 922 -3.858 7.063 14.124 1.00 0.00 H new ATOM 0 HB3 LYS A 922 -3.226 5.439 13.938 1.00 0.00 H new ATOM 0 HG2 LYS A 922 -1.922 5.993 12.108 1.00 0.00 H new ATOM 0 HG3 LYS A 922 -2.998 7.273 11.583 1.00 0.00 H new ATOM 0 HD2 LYS A 922 -1.209 8.508 12.412 1.00 0.00 H new ATOM 0 HD3 LYS A 922 -2.265 8.469 13.810 1.00 0.00 H new ATOM 0 HE2 LYS A 922 -0.184 6.309 13.426 1.00 0.00 H new ATOM 0 HE3 LYS A 922 0.282 7.867 14.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 922 -0.223 6.627 15.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 922 -1.664 7.492 15.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 922 -1.560 5.864 15.230 1.00 0.00 H new ATOM 127 N PRO A 923 -6.080 7.964 12.231 1.00 0.00 N ATOM 128 CA PRO A 923 -6.573 9.095 11.438 1.00 0.00 C ATOM 129 C PRO A 923 -5.452 10.039 11.015 1.00 0.00 C ATOM 130 O PRO A 923 -4.273 9.734 11.187 1.00 0.00 O ATOM 131 CB PRO A 923 -7.537 9.803 12.393 1.00 0.00 C ATOM 132 CG PRO A 923 -7.057 9.440 13.755 1.00 0.00 C ATOM 133 CD PRO A 923 -6.499 8.048 13.640 1.00 0.00 C ATOM 0 HA PRO A 923 -7.036 8.769 10.507 1.00 0.00 H new ATOM 0 HB2 PRO A 923 -7.521 10.882 12.243 1.00 0.00 H new ATOM 0 HB3 PRO A 923 -8.564 9.474 12.235 1.00 0.00 H new ATOM 0 HG2 PRO A 923 -6.295 10.139 14.099 1.00 0.00 H new ATOM 0 HG3 PRO A 923 -7.872 9.475 14.478 1.00 0.00 H new ATOM 0 HD2 PRO A 923 -5.660 7.894 14.319 1.00 0.00 H new ATOM 0 HD3 PRO A 923 -7.248 7.294 13.882 1.00 0.00 H new ATOM 141 N GLY A 924 -5.829 11.187 10.462 1.00 0.00 N ATOM 142 CA GLY A 924 -4.844 12.158 10.024 1.00 0.00 C ATOM 143 C GLY A 924 -4.758 12.256 8.514 1.00 0.00 C ATOM 144 O GLY A 924 -5.701 11.926 7.794 1.00 0.00 O ATOM 0 H GLY A 924 -6.799 11.462 10.309 1.00 0.00 H new ATOM 0 HA2 GLY A 924 -5.095 13.136 10.435 1.00 0.00 H new ATOM 0 HA3 GLY A 924 -3.867 11.886 10.424 1.00 0.00 H new ATOM 148 N PRO A 925 -3.604 12.720 8.012 1.00 0.00 N ATOM 149 CA PRO A 925 -3.371 12.872 6.572 1.00 0.00 C ATOM 150 C PRO A 925 -3.254 11.529 5.859 1.00 0.00 C ATOM 151 O PRO A 925 -3.291 10.473 6.491 1.00 0.00 O ATOM 152 CB PRO A 925 -2.043 13.630 6.506 1.00 0.00 C ATOM 153 CG PRO A 925 -1.352 13.296 7.783 1.00 0.00 C ATOM 154 CD PRO A 925 -2.437 13.132 8.810 1.00 0.00 C ATOM 0 HA PRO A 925 -4.196 13.385 6.077 1.00 0.00 H new ATOM 0 HB2 PRO A 925 -1.453 13.320 5.644 1.00 0.00 H new ATOM 0 HB3 PRO A 925 -2.204 14.704 6.412 1.00 0.00 H new ATOM 0 HG2 PRO A 925 -0.768 12.381 7.683 1.00 0.00 H new ATOM 0 HG3 PRO A 925 -0.659 14.087 8.070 1.00 0.00 H new ATOM 0 HD2 PRO A 925 -2.175 12.381 9.555 1.00 0.00 H new ATOM 0 HD3 PRO A 925 -2.626 14.062 9.347 1.00 0.00 H new ATOM 162 N THR A 926 -3.112 11.576 4.538 1.00 0.00 N ATOM 163 CA THR A 926 -2.991 10.364 3.739 1.00 0.00 C ATOM 164 C THR A 926 -1.529 9.975 3.548 1.00 0.00 C ATOM 165 O THR A 926 -0.752 10.719 2.950 1.00 0.00 O ATOM 166 CB THR A 926 -3.649 10.533 2.357 1.00 0.00 C ATOM 167 OG1 THR A 926 -5.015 10.935 2.511 1.00 0.00 O ATOM 168 CG2 THR A 926 -3.583 9.238 1.563 1.00 0.00 C ATOM 0 H THR A 926 -3.078 12.441 3.999 1.00 0.00 H new ATOM 0 HA THR A 926 -3.507 9.574 4.285 1.00 0.00 H new ATOM 0 HB THR A 926 -3.103 11.303 1.811 1.00 0.00 H new ATOM 0 HG1 THR A 926 -5.068 11.913 2.533 1.00 0.00 H new ATOM 0 HG21 THR A 926 -4.054 9.383 0.591 1.00 0.00 H new ATOM 0 HG22 THR A 926 -2.541 8.950 1.422 1.00 0.00 H new ATOM 0 HG23 THR A 926 -4.106 8.451 2.106 1.00 0.00 H new ATOM 176 N ILE A 927 -1.162 8.805 4.060 1.00 0.00 N ATOM 177 CA ILE A 927 0.207 8.317 3.944 1.00 0.00 C ATOM 178 C ILE A 927 0.352 7.364 2.762 1.00 0.00 C ATOM 179 O ILE A 927 -0.397 6.395 2.637 1.00 0.00 O ATOM 180 CB ILE A 927 0.659 7.597 5.228 1.00 0.00 C ATOM 181 CG1 ILE A 927 0.558 8.539 6.429 1.00 0.00 C ATOM 182 CG2 ILE A 927 2.080 7.078 5.072 1.00 0.00 C ATOM 183 CD1 ILE A 927 1.378 9.801 6.277 1.00 0.00 C ATOM 0 H ILE A 927 -1.793 8.178 4.559 1.00 0.00 H new ATOM 0 HA ILE A 927 0.841 9.189 3.785 1.00 0.00 H new ATOM 0 HB ILE A 927 0.000 6.746 5.401 1.00 0.00 H new ATOM 0 HG12 ILE A 927 -0.487 8.810 6.581 1.00 0.00 H new ATOM 0 HG13 ILE A 927 0.883 8.009 7.324 1.00 0.00 H new ATOM 0 HG21 ILE A 927 2.385 6.572 5.988 1.00 0.00 H new ATOM 0 HG22 ILE A 927 2.122 6.377 4.238 1.00 0.00 H new ATOM 0 HG23 ILE A 927 2.753 7.913 4.878 1.00 0.00 H new ATOM 0 HD11 ILE A 927 1.259 10.422 7.165 1.00 0.00 H new ATOM 0 HD12 ILE A 927 2.429 9.539 6.155 1.00 0.00 H new ATOM 0 HD13 ILE A 927 1.038 10.353 5.401 1.00 0.00 H new ATOM 195 N ILE A 928 1.322 7.645 1.898 1.00 0.00 N ATOM 196 CA ILE A 928 1.568 6.812 0.728 1.00 0.00 C ATOM 197 C ILE A 928 2.819 5.960 0.913 1.00 0.00 C ATOM 198 O ILE A 928 3.770 6.370 1.579 1.00 0.00 O ATOM 199 CB ILE A 928 1.724 7.662 -0.546 1.00 0.00 C ATOM 200 CG1 ILE A 928 0.405 8.361 -0.884 1.00 0.00 C ATOM 201 CG2 ILE A 928 2.183 6.795 -1.709 1.00 0.00 C ATOM 202 CD1 ILE A 928 0.527 9.377 -1.998 1.00 0.00 C ATOM 0 H ILE A 928 1.950 8.444 1.987 1.00 0.00 H new ATOM 0 HA ILE A 928 0.701 6.161 0.617 1.00 0.00 H new ATOM 0 HB ILE A 928 2.482 8.424 -0.365 1.00 0.00 H new ATOM 0 HG12 ILE A 928 -0.332 7.610 -1.167 1.00 0.00 H new ATOM 0 HG13 ILE A 928 0.027 8.858 0.010 1.00 0.00 H new ATOM 0 HG21 ILE A 928 2.289 7.411 -2.602 1.00 0.00 H new ATOM 0 HG22 ILE A 928 3.143 6.340 -1.467 1.00 0.00 H new ATOM 0 HG23 ILE A 928 1.446 6.013 -1.892 1.00 0.00 H new ATOM 0 HD11 ILE A 928 -0.446 9.832 -2.183 1.00 0.00 H new ATOM 0 HD12 ILE A 928 1.240 10.149 -1.710 1.00 0.00 H new ATOM 0 HD13 ILE A 928 0.875 8.883 -2.905 1.00 0.00 H new ATOM 214 N LYS A 929 2.813 4.772 0.319 1.00 0.00 N ATOM 215 CA LYS A 929 3.947 3.861 0.414 1.00 0.00 C ATOM 216 C LYS A 929 4.618 3.684 -0.944 1.00 0.00 C ATOM 217 O LYS A 929 3.972 3.308 -1.922 1.00 0.00 O ATOM 218 CB LYS A 929 3.494 2.503 0.952 1.00 0.00 C ATOM 219 CG LYS A 929 3.546 2.400 2.467 1.00 0.00 C ATOM 220 CD LYS A 929 2.604 1.327 2.986 1.00 0.00 C ATOM 221 CE LYS A 929 3.000 -0.053 2.485 1.00 0.00 C ATOM 222 NZ LYS A 929 4.242 -0.547 3.142 1.00 0.00 N ATOM 0 H LYS A 929 2.033 4.417 -0.235 1.00 0.00 H new ATOM 0 HA LYS A 929 4.671 4.294 1.104 1.00 0.00 H new ATOM 0 HB2 LYS A 929 2.474 2.311 0.618 1.00 0.00 H new ATOM 0 HB3 LYS A 929 4.122 1.723 0.522 1.00 0.00 H new ATOM 0 HG2 LYS A 929 4.565 2.174 2.782 1.00 0.00 H new ATOM 0 HG3 LYS A 929 3.281 3.361 2.907 1.00 0.00 H new ATOM 0 HD2 LYS A 929 2.608 1.334 4.076 1.00 0.00 H new ATOM 0 HD3 LYS A 929 1.585 1.552 2.669 1.00 0.00 H new ATOM 0 HE2 LYS A 929 2.187 -0.754 2.672 1.00 0.00 H new ATOM 0 HE3 LYS A 929 3.149 -0.018 1.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 4.431 -1.523 2.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 5.042 0.061 2.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 4.121 -0.524 4.175 1.00 0.00 H new ATOM 236 N VAL A 930 5.919 3.955 -0.997 1.00 0.00 N ATOM 237 CA VAL A 930 6.677 3.823 -2.235 1.00 0.00 C ATOM 238 C VAL A 930 7.579 2.594 -2.198 1.00 0.00 C ATOM 239 O VAL A 930 8.322 2.386 -1.239 1.00 0.00 O ATOM 240 CB VAL A 930 7.540 5.071 -2.501 1.00 0.00 C ATOM 241 CG1 VAL A 930 8.254 4.952 -3.839 1.00 0.00 C ATOM 242 CG2 VAL A 930 6.686 6.329 -2.453 1.00 0.00 C ATOM 0 H VAL A 930 6.469 4.267 -0.197 1.00 0.00 H new ATOM 0 HA VAL A 930 5.951 3.714 -3.041 1.00 0.00 H new ATOM 0 HB VAL A 930 8.296 5.142 -1.719 1.00 0.00 H new ATOM 0 HG11 VAL A 930 8.859 5.843 -4.009 1.00 0.00 H new ATOM 0 HG12 VAL A 930 8.898 4.073 -3.831 1.00 0.00 H new ATOM 0 HG13 VAL A 930 7.518 4.855 -4.637 1.00 0.00 H new ATOM 0 HG21 VAL A 930 7.312 7.201 -2.643 1.00 0.00 H new ATOM 0 HG22 VAL A 930 5.907 6.269 -3.213 1.00 0.00 H new ATOM 0 HG23 VAL A 930 6.227 6.420 -1.469 1.00 0.00 H new ATOM 252 N GLN A 931 7.508 1.783 -3.249 1.00 0.00 N ATOM 253 CA GLN A 931 8.318 0.574 -3.336 1.00 0.00 C ATOM 254 C GLN A 931 8.904 0.411 -4.735 1.00 0.00 C ATOM 255 O GLN A 931 8.539 1.135 -5.659 1.00 0.00 O ATOM 256 CB GLN A 931 7.480 -0.654 -2.975 1.00 0.00 C ATOM 257 CG GLN A 931 8.205 -1.641 -2.074 1.00 0.00 C ATOM 258 CD GLN A 931 7.304 -2.222 -1.002 1.00 0.00 C ATOM 259 OE1 GLN A 931 6.822 -3.349 -1.123 1.00 0.00 O ATOM 260 NE2 GLN A 931 7.073 -1.454 0.056 1.00 0.00 N ATOM 0 H GLN A 931 6.898 1.941 -4.051 1.00 0.00 H new ATOM 0 HA GLN A 931 9.140 0.666 -2.626 1.00 0.00 H new ATOM 0 HB2 GLN A 931 6.565 -0.327 -2.480 1.00 0.00 H new ATOM 0 HB3 GLN A 931 7.182 -1.163 -3.892 1.00 0.00 H new ATOM 0 HG2 GLN A 931 8.611 -2.451 -2.681 1.00 0.00 H new ATOM 0 HG3 GLN A 931 9.051 -1.142 -1.601 1.00 0.00 H new ATOM 0 HE21 GLN A 931 7.493 -0.526 0.114 1.00 0.00 H new ATOM 0 HE22 GLN A 931 6.475 -1.792 0.810 1.00 0.00 H new ATOM 269 N ASN A 932 9.816 -0.545 -4.881 1.00 0.00 N ATOM 270 CA ASN A 932 10.453 -0.802 -6.167 1.00 0.00 C ATOM 271 C ASN A 932 11.335 0.372 -6.582 1.00 0.00 C ATOM 272 O ASN A 932 11.236 0.869 -7.703 1.00 0.00 O ATOM 273 CB ASN A 932 9.396 -1.065 -7.241 1.00 0.00 C ATOM 274 CG ASN A 932 9.919 -1.934 -8.368 1.00 0.00 C ATOM 275 OD1 ASN A 932 9.317 -2.951 -8.714 1.00 0.00 O ATOM 276 ND2 ASN A 932 11.046 -1.536 -8.947 1.00 0.00 N ATOM 0 H ASN A 932 10.130 -1.154 -4.125 1.00 0.00 H new ATOM 0 HA ASN A 932 11.082 -1.686 -6.062 1.00 0.00 H new ATOM 0 HB2 ASN A 932 8.531 -1.548 -6.785 1.00 0.00 H new ATOM 0 HB3 ASN A 932 9.052 -0.114 -7.649 1.00 0.00 H new ATOM 0 HD21 ASN A 932 11.447 -2.080 -9.711 1.00 0.00 H new ATOM 0 HD22 ASN A 932 11.511 -0.686 -8.628 1.00 0.00 H new ATOM 283 N MET A 933 12.197 0.809 -5.670 1.00 0.00 N ATOM 284 CA MET A 933 13.097 1.923 -5.941 1.00 0.00 C ATOM 285 C MET A 933 14.553 1.472 -5.882 1.00 0.00 C ATOM 286 O MET A 933 14.979 0.788 -4.951 1.00 0.00 O ATOM 287 CB MET A 933 12.860 3.054 -4.939 1.00 0.00 C ATOM 288 CG MET A 933 11.830 4.071 -5.403 1.00 0.00 C ATOM 289 SD MET A 933 11.782 5.538 -4.356 1.00 0.00 S ATOM 290 CE MET A 933 12.326 4.856 -2.792 1.00 0.00 C ATOM 0 H MET A 933 12.291 0.408 -4.737 1.00 0.00 H new ATOM 0 HA MET A 933 12.889 2.289 -6.946 1.00 0.00 H new ATOM 0 HB2 MET A 933 12.534 2.626 -3.991 1.00 0.00 H new ATOM 0 HB3 MET A 933 13.804 3.565 -4.751 1.00 0.00 H new ATOM 0 HG2 MET A 933 12.054 4.368 -6.428 1.00 0.00 H new ATOM 0 HG3 MET A 933 10.845 3.605 -5.414 1.00 0.00 H new ATOM 0 HE1 MET A 933 12.180 5.594 -2.003 1.00 0.00 H new ATOM 0 HE2 MET A 933 11.746 3.962 -2.564 1.00 0.00 H new ATOM 0 HE3 MET A 933 13.383 4.597 -2.856 1.00 0.00 H new ATOM 300 N PRO A 934 15.337 1.863 -6.898 1.00 0.00 N ATOM 301 CA PRO A 934 16.757 1.511 -6.984 1.00 0.00 C ATOM 302 C PRO A 934 17.597 2.227 -5.933 1.00 0.00 C ATOM 303 O PRO A 934 17.129 3.161 -5.281 1.00 0.00 O ATOM 304 CB PRO A 934 17.152 1.971 -8.390 1.00 0.00 C ATOM 305 CG PRO A 934 16.185 3.055 -8.719 1.00 0.00 C ATOM 306 CD PRO A 934 14.896 2.680 -8.042 1.00 0.00 C ATOM 0 HA PRO A 934 16.925 0.449 -6.805 1.00 0.00 H new ATOM 0 HB2 PRO A 934 18.179 2.336 -8.413 1.00 0.00 H new ATOM 0 HB3 PRO A 934 17.088 1.152 -9.107 1.00 0.00 H new ATOM 0 HG2 PRO A 934 16.546 4.020 -8.364 1.00 0.00 H new ATOM 0 HG3 PRO A 934 16.049 3.142 -9.797 1.00 0.00 H new ATOM 0 HD2 PRO A 934 14.342 3.561 -7.717 1.00 0.00 H new ATOM 0 HD3 PRO A 934 14.241 2.119 -8.708 1.00 0.00 H new ATOM 314 N PHE A 935 18.840 1.785 -5.772 1.00 0.00 N ATOM 315 CA PHE A 935 19.745 2.385 -4.799 1.00 0.00 C ATOM 316 C PHE A 935 20.091 3.819 -5.189 1.00 0.00 C ATOM 317 O PHE A 935 20.352 4.663 -4.332 1.00 0.00 O ATOM 318 CB PHE A 935 21.024 1.554 -4.681 1.00 0.00 C ATOM 319 CG PHE A 935 20.785 0.072 -4.751 1.00 0.00 C ATOM 320 CD1 PHE A 935 20.061 -0.573 -3.761 1.00 0.00 C ATOM 321 CD2 PHE A 935 21.284 -0.674 -5.806 1.00 0.00 C ATOM 322 CE1 PHE A 935 19.840 -1.936 -3.823 1.00 0.00 C ATOM 323 CE2 PHE A 935 21.066 -2.038 -5.873 1.00 0.00 C ATOM 324 CZ PHE A 935 20.342 -2.669 -4.881 1.00 0.00 C ATOM 0 H PHE A 935 19.243 1.013 -6.303 1.00 0.00 H new ATOM 0 HA PHE A 935 19.240 2.402 -3.833 1.00 0.00 H new ATOM 0 HB2 PHE A 935 21.709 1.841 -5.478 1.00 0.00 H new ATOM 0 HB3 PHE A 935 21.516 1.790 -3.737 1.00 0.00 H new ATOM 0 HD1 PHE A 935 19.665 -0.005 -2.932 1.00 0.00 H new ATOM 0 HD2 PHE A 935 21.850 -0.185 -6.585 1.00 0.00 H new ATOM 0 HE1 PHE A 935 19.275 -2.428 -3.045 1.00 0.00 H new ATOM 0 HE2 PHE A 935 21.462 -2.609 -6.700 1.00 0.00 H new ATOM 0 HZ PHE A 935 20.168 -3.734 -4.932 1.00 0.00 H new ATOM 334 N THR A 936 20.092 4.088 -6.492 1.00 0.00 N ATOM 335 CA THR A 936 20.407 5.418 -6.997 1.00 0.00 C ATOM 336 C THR A 936 19.440 6.459 -6.446 1.00 0.00 C ATOM 337 O THR A 936 19.780 7.636 -6.329 1.00 0.00 O ATOM 338 CB THR A 936 20.365 5.458 -8.536 1.00 0.00 C ATOM 339 OG1 THR A 936 19.052 5.124 -9.000 1.00 0.00 O ATOM 340 CG2 THR A 936 21.379 4.492 -9.131 1.00 0.00 C ATOM 0 H THR A 936 19.878 3.402 -7.216 1.00 0.00 H new ATOM 0 HA THR A 936 21.417 5.652 -6.662 1.00 0.00 H new ATOM 0 HB THR A 936 20.617 6.469 -8.857 1.00 0.00 H new ATOM 0 HG1 THR A 936 19.034 5.154 -9.979 1.00 0.00 H new ATOM 0 HG21 THR A 936 21.331 4.538 -10.219 1.00 0.00 H new ATOM 0 HG22 THR A 936 22.381 4.767 -8.800 1.00 0.00 H new ATOM 0 HG23 THR A 936 21.153 3.478 -8.800 1.00 0.00 H new ATOM 348 N VAL A 937 18.232 6.018 -6.108 1.00 0.00 N ATOM 349 CA VAL A 937 17.215 6.912 -5.568 1.00 0.00 C ATOM 350 C VAL A 937 17.766 7.733 -4.407 1.00 0.00 C ATOM 351 O VAL A 937 18.533 7.229 -3.586 1.00 0.00 O ATOM 352 CB VAL A 937 15.978 6.130 -5.088 1.00 0.00 C ATOM 353 CG1 VAL A 937 14.989 7.062 -4.404 1.00 0.00 C ATOM 354 CG2 VAL A 937 15.321 5.405 -6.253 1.00 0.00 C ATOM 0 H VAL A 937 17.934 5.047 -6.199 1.00 0.00 H new ATOM 0 HA VAL A 937 16.921 7.582 -6.376 1.00 0.00 H new ATOM 0 HB VAL A 937 16.301 5.385 -4.361 1.00 0.00 H new ATOM 0 HG11 VAL A 937 14.122 6.492 -4.072 1.00 0.00 H new ATOM 0 HG12 VAL A 937 15.466 7.531 -3.544 1.00 0.00 H new ATOM 0 HG13 VAL A 937 14.670 7.832 -5.106 1.00 0.00 H new ATOM 0 HG21 VAL A 937 14.449 4.858 -5.896 1.00 0.00 H new ATOM 0 HG22 VAL A 937 15.011 6.131 -7.005 1.00 0.00 H new ATOM 0 HG23 VAL A 937 16.032 4.706 -6.694 1.00 0.00 H new ATOM 364 N SER A 938 17.370 9.000 -4.344 1.00 0.00 N ATOM 365 CA SER A 938 17.826 9.892 -3.285 1.00 0.00 C ATOM 366 C SER A 938 16.715 10.848 -2.863 1.00 0.00 C ATOM 367 O SER A 938 15.687 10.956 -3.532 1.00 0.00 O ATOM 368 CB SER A 938 19.048 10.686 -3.750 1.00 0.00 C ATOM 369 OG SER A 938 20.210 9.875 -3.760 1.00 0.00 O ATOM 0 H SER A 938 16.734 9.432 -5.014 1.00 0.00 H new ATOM 0 HA SER A 938 18.103 9.283 -2.425 1.00 0.00 H new ATOM 0 HB2 SER A 938 18.869 11.083 -4.749 1.00 0.00 H new ATOM 0 HB3 SER A 938 19.203 11.540 -3.091 1.00 0.00 H new ATOM 0 HG SER A 938 19.963 8.947 -3.565 1.00 0.00 H new ATOM 375 N ILE A 939 16.929 11.540 -1.749 1.00 0.00 N ATOM 376 CA ILE A 939 15.947 12.487 -1.238 1.00 0.00 C ATOM 377 C ILE A 939 15.615 13.551 -2.279 1.00 0.00 C ATOM 378 O ILE A 939 14.454 13.919 -2.458 1.00 0.00 O ATOM 379 CB ILE A 939 16.445 13.178 0.045 1.00 0.00 C ATOM 380 CG1 ILE A 939 16.608 12.155 1.171 1.00 0.00 C ATOM 381 CG2 ILE A 939 15.484 14.283 0.460 1.00 0.00 C ATOM 382 CD1 ILE A 939 17.519 12.623 2.285 1.00 0.00 C ATOM 0 H ILE A 939 17.774 11.462 -1.183 1.00 0.00 H new ATOM 0 HA ILE A 939 15.048 11.915 -1.007 1.00 0.00 H new ATOM 0 HB ILE A 939 17.418 13.627 -0.156 1.00 0.00 H new ATOM 0 HG12 ILE A 939 15.627 11.925 1.587 1.00 0.00 H new ATOM 0 HG13 ILE A 939 17.003 11.228 0.755 1.00 0.00 H new ATOM 0 HG21 ILE A 939 15.850 14.761 1.368 1.00 0.00 H new ATOM 0 HG22 ILE A 939 15.414 15.023 -0.337 1.00 0.00 H new ATOM 0 HG23 ILE A 939 14.498 13.857 0.647 1.00 0.00 H new ATOM 0 HD11 ILE A 939 17.588 11.848 3.048 1.00 0.00 H new ATOM 0 HD12 ILE A 939 18.512 12.826 1.883 1.00 0.00 H new ATOM 0 HD13 ILE A 939 17.114 13.533 2.728 1.00 0.00 H new ATOM 394 N ASP A 940 16.643 14.040 -2.964 1.00 0.00 N ATOM 395 CA ASP A 940 16.462 15.060 -3.991 1.00 0.00 C ATOM 396 C ASP A 940 15.605 14.531 -5.137 1.00 0.00 C ATOM 397 O ASP A 940 14.692 15.209 -5.606 1.00 0.00 O ATOM 398 CB ASP A 940 17.818 15.526 -4.523 1.00 0.00 C ATOM 399 CG ASP A 940 17.696 16.713 -5.458 1.00 0.00 C ATOM 400 OD1 ASP A 940 16.981 16.597 -6.475 1.00 0.00 O ATOM 401 OD2 ASP A 940 18.316 17.758 -5.172 1.00 0.00 O ATOM 0 H ASP A 940 17.610 13.747 -2.827 1.00 0.00 H new ATOM 0 HA ASP A 940 15.948 15.908 -3.539 1.00 0.00 H new ATOM 0 HB2 ASP A 940 18.462 15.792 -3.685 1.00 0.00 H new ATOM 0 HB3 ASP A 940 18.302 14.702 -5.048 1.00 0.00 H new ATOM 406 N GLU A 941 15.909 13.316 -5.584 1.00 0.00 N ATOM 407 CA GLU A 941 15.168 12.698 -6.677 1.00 0.00 C ATOM 408 C GLU A 941 13.702 12.502 -6.298 1.00 0.00 C ATOM 409 O GLU A 941 12.803 12.765 -7.098 1.00 0.00 O ATOM 410 CB GLU A 941 15.793 11.352 -7.050 1.00 0.00 C ATOM 411 CG GLU A 941 17.222 11.464 -7.554 1.00 0.00 C ATOM 412 CD GLU A 941 17.295 11.758 -9.040 1.00 0.00 C ATOM 413 OE1 GLU A 941 16.746 10.961 -9.829 1.00 0.00 O ATOM 414 OE2 GLU A 941 17.900 12.785 -9.413 1.00 0.00 O ATOM 0 H GLU A 941 16.662 12.741 -5.206 1.00 0.00 H new ATOM 0 HA GLU A 941 15.218 13.365 -7.538 1.00 0.00 H new ATOM 0 HB2 GLU A 941 15.774 10.698 -6.178 1.00 0.00 H new ATOM 0 HB3 GLU A 941 15.182 10.877 -7.818 1.00 0.00 H new ATOM 0 HG2 GLU A 941 17.736 12.253 -7.006 1.00 0.00 H new ATOM 0 HG3 GLU A 941 17.751 10.534 -7.345 1.00 0.00 H new ATOM 421 N ILE A 942 13.470 12.039 -5.075 1.00 0.00 N ATOM 422 CA ILE A 942 12.115 11.808 -4.590 1.00 0.00 C ATOM 423 C ILE A 942 11.308 13.102 -4.579 1.00 0.00 C ATOM 424 O ILE A 942 10.186 13.151 -5.085 1.00 0.00 O ATOM 425 CB ILE A 942 12.119 11.206 -3.173 1.00 0.00 C ATOM 426 CG1 ILE A 942 12.719 9.799 -3.194 1.00 0.00 C ATOM 427 CG2 ILE A 942 10.707 11.177 -2.606 1.00 0.00 C ATOM 428 CD1 ILE A 942 13.289 9.365 -1.861 1.00 0.00 C ATOM 0 H ILE A 942 14.203 11.816 -4.401 1.00 0.00 H new ATOM 0 HA ILE A 942 11.651 11.099 -5.275 1.00 0.00 H new ATOM 0 HB ILE A 942 12.736 11.834 -2.530 1.00 0.00 H new ATOM 0 HG12 ILE A 942 11.950 9.089 -3.500 1.00 0.00 H new ATOM 0 HG13 ILE A 942 13.506 9.760 -3.947 1.00 0.00 H new ATOM 0 HG21 ILE A 942 10.726 10.749 -1.604 1.00 0.00 H new ATOM 0 HG22 ILE A 942 10.313 12.192 -2.559 1.00 0.00 H new ATOM 0 HG23 ILE A 942 10.069 10.569 -3.248 1.00 0.00 H new ATOM 0 HD11 ILE A 942 13.697 8.358 -1.950 1.00 0.00 H new ATOM 0 HD12 ILE A 942 14.081 10.052 -1.563 1.00 0.00 H new ATOM 0 HD13 ILE A 942 12.500 9.372 -1.109 1.00 0.00 H new ATOM 440 N LEU A 943 11.886 14.149 -4.001 1.00 0.00 N ATOM 441 CA LEU A 943 11.221 15.445 -3.925 1.00 0.00 C ATOM 442 C LEU A 943 10.826 15.936 -5.314 1.00 0.00 C ATOM 443 O LEU A 943 9.735 16.473 -5.506 1.00 0.00 O ATOM 444 CB LEU A 943 12.135 16.470 -3.250 1.00 0.00 C ATOM 445 CG LEU A 943 12.055 16.539 -1.725 1.00 0.00 C ATOM 446 CD1 LEU A 943 12.966 17.634 -1.191 1.00 0.00 C ATOM 447 CD2 LEU A 943 10.619 16.772 -1.276 1.00 0.00 C ATOM 0 H LEU A 943 12.814 14.126 -3.578 1.00 0.00 H new ATOM 0 HA LEU A 943 10.315 15.327 -3.330 1.00 0.00 H new ATOM 0 HB2 LEU A 943 13.165 16.249 -3.530 1.00 0.00 H new ATOM 0 HB3 LEU A 943 11.900 17.456 -3.651 1.00 0.00 H new ATOM 0 HG LEU A 943 12.392 15.585 -1.320 1.00 0.00 H new ATOM 0 HD11 LEU A 943 12.896 17.668 -0.104 1.00 0.00 H new ATOM 0 HD12 LEU A 943 13.995 17.425 -1.482 1.00 0.00 H new ATOM 0 HD13 LEU A 943 12.661 18.595 -1.605 1.00 0.00 H new ATOM 0 HD21 LEU A 943 10.581 16.818 -0.188 1.00 0.00 H new ATOM 0 HD22 LEU A 943 10.256 17.712 -1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 943 9.991 15.953 -1.626 1.00 0.00 H new ATOM 459 N ASP A 944 11.719 15.747 -6.279 1.00 0.00 N ATOM 460 CA ASP A 944 11.462 16.167 -7.651 1.00 0.00 C ATOM 461 C ASP A 944 10.421 15.267 -8.310 1.00 0.00 C ATOM 462 O ASP A 944 9.654 15.710 -9.165 1.00 0.00 O ATOM 463 CB ASP A 944 12.757 16.149 -8.464 1.00 0.00 C ATOM 464 CG ASP A 944 12.716 17.102 -9.642 1.00 0.00 C ATOM 465 OD1 ASP A 944 11.635 17.243 -10.252 1.00 0.00 O ATOM 466 OD2 ASP A 944 13.763 17.707 -9.954 1.00 0.00 O ATOM 0 H ASP A 944 12.627 15.306 -6.136 1.00 0.00 H new ATOM 0 HA ASP A 944 11.072 17.185 -7.625 1.00 0.00 H new ATOM 0 HB2 ASP A 944 13.593 16.413 -7.816 1.00 0.00 H new ATOM 0 HB3 ASP A 944 12.941 15.137 -8.825 1.00 0.00 H new ATOM 471 N PHE A 945 10.401 14.001 -7.906 1.00 0.00 N ATOM 472 CA PHE A 945 9.455 13.038 -8.458 1.00 0.00 C ATOM 473 C PHE A 945 8.020 13.426 -8.115 1.00 0.00 C ATOM 474 O PHE A 945 7.109 13.257 -8.925 1.00 0.00 O ATOM 475 CB PHE A 945 9.757 11.634 -7.928 1.00 0.00 C ATOM 476 CG PHE A 945 8.740 10.608 -8.337 1.00 0.00 C ATOM 477 CD1 PHE A 945 7.504 10.551 -7.715 1.00 0.00 C ATOM 478 CD2 PHE A 945 9.020 9.700 -9.346 1.00 0.00 C ATOM 479 CE1 PHE A 945 6.567 9.607 -8.089 1.00 0.00 C ATOM 480 CE2 PHE A 945 8.087 8.753 -9.725 1.00 0.00 C ATOM 481 CZ PHE A 945 6.858 8.708 -9.096 1.00 0.00 C ATOM 0 H PHE A 945 11.029 13.618 -7.199 1.00 0.00 H new ATOM 0 HA PHE A 945 9.563 13.041 -9.543 1.00 0.00 H new ATOM 0 HB2 PHE A 945 10.739 11.323 -8.285 1.00 0.00 H new ATOM 0 HB3 PHE A 945 9.809 11.668 -6.840 1.00 0.00 H new ATOM 0 HD1 PHE A 945 7.270 11.253 -6.928 1.00 0.00 H new ATOM 0 HD2 PHE A 945 9.979 9.733 -9.842 1.00 0.00 H new ATOM 0 HE1 PHE A 945 5.608 9.572 -7.594 1.00 0.00 H new ATOM 0 HE2 PHE A 945 8.318 8.050 -10.511 1.00 0.00 H new ATOM 0 HZ PHE A 945 6.126 7.971 -9.391 1.00 0.00 H new ATOM 491 N PHE A 946 7.827 13.947 -6.908 1.00 0.00 N ATOM 492 CA PHE A 946 6.503 14.358 -6.455 1.00 0.00 C ATOM 493 C PHE A 946 6.253 15.829 -6.772 1.00 0.00 C ATOM 494 O PHE A 946 5.352 16.453 -6.209 1.00 0.00 O ATOM 495 CB PHE A 946 6.357 14.117 -4.951 1.00 0.00 C ATOM 496 CG PHE A 946 6.120 12.677 -4.596 1.00 0.00 C ATOM 497 CD1 PHE A 946 7.185 11.826 -4.350 1.00 0.00 C ATOM 498 CD2 PHE A 946 4.832 12.175 -4.506 1.00 0.00 C ATOM 499 CE1 PHE A 946 6.970 10.500 -4.023 1.00 0.00 C ATOM 500 CE2 PHE A 946 4.610 10.850 -4.179 1.00 0.00 C ATOM 501 CZ PHE A 946 5.681 10.012 -3.936 1.00 0.00 C ATOM 0 H PHE A 946 8.571 14.095 -6.226 1.00 0.00 H new ATOM 0 HA PHE A 946 5.763 13.759 -6.985 1.00 0.00 H new ATOM 0 HB2 PHE A 946 7.259 14.464 -4.446 1.00 0.00 H new ATOM 0 HB3 PHE A 946 5.529 14.717 -4.573 1.00 0.00 H new ATOM 0 HD1 PHE A 946 8.195 12.203 -4.414 1.00 0.00 H new ATOM 0 HD2 PHE A 946 3.991 12.826 -4.693 1.00 0.00 H new ATOM 0 HE1 PHE A 946 7.809 9.846 -3.836 1.00 0.00 H new ATOM 0 HE2 PHE A 946 3.601 10.471 -4.114 1.00 0.00 H new ATOM 0 HZ PHE A 946 5.511 8.977 -3.678 1.00 0.00 H new ATOM 511 N TYR A 947 7.056 16.378 -7.677 1.00 0.00 N ATOM 512 CA TYR A 947 6.924 17.777 -8.067 1.00 0.00 C ATOM 513 C TYR A 947 5.489 18.096 -8.474 1.00 0.00 C ATOM 514 O TYR A 947 4.755 17.226 -8.941 1.00 0.00 O ATOM 515 CB TYR A 947 7.876 18.098 -9.221 1.00 0.00 C ATOM 516 CG TYR A 947 7.953 19.572 -9.550 1.00 0.00 C ATOM 517 CD1 TYR A 947 8.592 20.462 -8.696 1.00 0.00 C ATOM 518 CD2 TYR A 947 7.386 20.074 -10.715 1.00 0.00 C ATOM 519 CE1 TYR A 947 8.664 21.809 -8.992 1.00 0.00 C ATOM 520 CE2 TYR A 947 7.454 21.420 -11.020 1.00 0.00 C ATOM 521 CZ TYR A 947 8.095 22.283 -10.156 1.00 0.00 C ATOM 522 OH TYR A 947 8.164 23.624 -10.455 1.00 0.00 O ATOM 0 H TYR A 947 7.805 15.876 -8.154 1.00 0.00 H new ATOM 0 HA TYR A 947 7.184 18.394 -7.207 1.00 0.00 H new ATOM 0 HB2 TYR A 947 8.873 17.738 -8.969 1.00 0.00 H new ATOM 0 HB3 TYR A 947 7.555 17.552 -10.108 1.00 0.00 H new ATOM 0 HD1 TYR A 947 9.040 20.094 -7.785 1.00 0.00 H new ATOM 0 HD2 TYR A 947 6.884 19.401 -11.394 1.00 0.00 H new ATOM 0 HE1 TYR A 947 9.163 22.488 -8.316 1.00 0.00 H new ATOM 0 HE2 TYR A 947 7.008 21.794 -11.930 1.00 0.00 H new ATOM 0 HH TYR A 947 7.716 23.792 -11.310 1.00 0.00 H new ATOM 532 N GLY A 948 5.095 19.353 -8.292 1.00 0.00 N ATOM 533 CA GLY A 948 3.749 19.767 -8.645 1.00 0.00 C ATOM 534 C GLY A 948 2.772 19.601 -7.498 1.00 0.00 C ATOM 535 O GLY A 948 1.896 20.442 -7.293 1.00 0.00 O ATOM 0 H GLY A 948 5.683 20.092 -7.907 1.00 0.00 H new ATOM 0 HA2 GLY A 948 3.764 20.811 -8.958 1.00 0.00 H new ATOM 0 HA3 GLY A 948 3.405 19.183 -9.499 1.00 0.00 H new ATOM 539 N TYR A 949 2.920 18.513 -6.750 1.00 0.00 N ATOM 540 CA TYR A 949 2.040 18.237 -5.621 1.00 0.00 C ATOM 541 C TYR A 949 2.655 18.738 -4.317 1.00 0.00 C ATOM 542 O TYR A 949 3.869 18.676 -4.127 1.00 0.00 O ATOM 543 CB TYR A 949 1.758 16.737 -5.522 1.00 0.00 C ATOM 544 CG TYR A 949 1.314 16.117 -6.827 1.00 0.00 C ATOM 545 CD1 TYR A 949 0.004 16.250 -7.271 1.00 0.00 C ATOM 546 CD2 TYR A 949 2.203 15.398 -7.616 1.00 0.00 C ATOM 547 CE1 TYR A 949 -0.408 15.685 -8.463 1.00 0.00 C ATOM 548 CE2 TYR A 949 1.800 14.830 -8.810 1.00 0.00 C ATOM 549 CZ TYR A 949 0.495 14.977 -9.229 1.00 0.00 C ATOM 550 OH TYR A 949 0.090 14.412 -10.416 1.00 0.00 O ATOM 0 H TYR A 949 3.641 17.808 -6.905 1.00 0.00 H new ATOM 0 HA TYR A 949 1.101 18.766 -5.786 1.00 0.00 H new ATOM 0 HB2 TYR A 949 2.658 16.229 -5.176 1.00 0.00 H new ATOM 0 HB3 TYR A 949 0.988 16.570 -4.769 1.00 0.00 H new ATOM 0 HD1 TYR A 949 -0.705 16.805 -6.674 1.00 0.00 H new ATOM 0 HD2 TYR A 949 3.226 15.281 -7.291 1.00 0.00 H new ATOM 0 HE1 TYR A 949 -1.430 15.797 -8.793 1.00 0.00 H new ATOM 0 HE2 TYR A 949 2.504 14.274 -9.411 1.00 0.00 H new ATOM 0 HH TYR A 949 0.847 13.950 -10.833 1.00 0.00 H new ATOM 560 N GLN A 950 1.806 19.232 -3.422 1.00 0.00 N ATOM 561 CA GLN A 950 2.264 19.743 -2.136 1.00 0.00 C ATOM 562 C GLN A 950 2.587 18.600 -1.179 1.00 0.00 C ATOM 563 O GLN A 950 1.690 18.008 -0.578 1.00 0.00 O ATOM 564 CB GLN A 950 1.204 20.657 -1.518 1.00 0.00 C ATOM 565 CG GLN A 950 1.032 21.974 -2.256 1.00 0.00 C ATOM 566 CD GLN A 950 2.238 22.883 -2.118 1.00 0.00 C ATOM 567 OE1 GLN A 950 2.705 23.148 -1.010 1.00 0.00 O ATOM 568 NE2 GLN A 950 2.749 23.365 -3.245 1.00 0.00 N ATOM 0 H GLN A 950 0.798 19.289 -3.564 1.00 0.00 H new ATOM 0 HA GLN A 950 3.174 20.318 -2.307 1.00 0.00 H new ATOM 0 HB2 GLN A 950 0.249 20.132 -1.501 1.00 0.00 H new ATOM 0 HB3 GLN A 950 1.473 20.863 -0.482 1.00 0.00 H new ATOM 0 HG2 GLN A 950 0.852 21.773 -3.312 1.00 0.00 H new ATOM 0 HG3 GLN A 950 0.149 22.487 -1.874 1.00 0.00 H new ATOM 0 HE21 GLN A 950 2.329 23.119 -4.142 1.00 0.00 H new ATOM 0 HE22 GLN A 950 3.561 23.981 -3.214 1.00 0.00 H new ATOM 577 N VAL A 951 3.873 18.294 -1.043 1.00 0.00 N ATOM 578 CA VAL A 951 4.314 17.222 -0.158 1.00 0.00 C ATOM 579 C VAL A 951 4.659 17.758 1.226 1.00 0.00 C ATOM 580 O VAL A 951 5.469 18.675 1.363 1.00 0.00 O ATOM 581 CB VAL A 951 5.541 16.489 -0.733 1.00 0.00 C ATOM 582 CG1 VAL A 951 6.113 15.521 0.291 1.00 0.00 C ATOM 583 CG2 VAL A 951 5.174 15.763 -2.019 1.00 0.00 C ATOM 0 H VAL A 951 4.628 18.773 -1.534 1.00 0.00 H new ATOM 0 HA VAL A 951 3.485 16.519 -0.075 1.00 0.00 H new ATOM 0 HB VAL A 951 6.307 17.228 -0.966 1.00 0.00 H new ATOM 0 HG11 VAL A 951 6.979 15.013 -0.133 1.00 0.00 H new ATOM 0 HG12 VAL A 951 6.415 16.071 1.182 1.00 0.00 H new ATOM 0 HG13 VAL A 951 5.355 14.785 0.559 1.00 0.00 H new ATOM 0 HG21 VAL A 951 6.053 15.251 -2.411 1.00 0.00 H new ATOM 0 HG22 VAL A 951 4.390 15.034 -1.814 1.00 0.00 H new ATOM 0 HG23 VAL A 951 4.816 16.484 -2.754 1.00 0.00 H new ATOM 593 N ILE A 952 4.040 17.180 2.250 1.00 0.00 N ATOM 594 CA ILE A 952 4.282 17.599 3.624 1.00 0.00 C ATOM 595 C ILE A 952 5.766 17.523 3.969 1.00 0.00 C ATOM 596 O ILE A 952 6.465 16.576 3.606 1.00 0.00 O ATOM 597 CB ILE A 952 3.490 16.737 4.624 1.00 0.00 C ATOM 598 CG1 ILE A 952 1.989 16.844 4.346 1.00 0.00 C ATOM 599 CG2 ILE A 952 3.800 17.161 6.052 1.00 0.00 C ATOM 600 CD1 ILE A 952 1.136 16.068 5.325 1.00 0.00 C ATOM 0 H ILE A 952 3.367 16.420 2.153 1.00 0.00 H new ATOM 0 HA ILE A 952 3.945 18.633 3.702 1.00 0.00 H new ATOM 0 HB ILE A 952 3.791 15.697 4.501 1.00 0.00 H new ATOM 0 HG12 ILE A 952 1.696 17.894 4.374 1.00 0.00 H new ATOM 0 HG13 ILE A 952 1.788 16.484 3.337 1.00 0.00 H new ATOM 0 HG21 ILE A 952 3.232 16.542 6.747 1.00 0.00 H new ATOM 0 HG22 ILE A 952 4.866 17.039 6.245 1.00 0.00 H new ATOM 0 HG23 ILE A 952 3.524 18.207 6.189 1.00 0.00 H new ATOM 0 HD11 ILE A 952 0.084 16.190 5.067 1.00 0.00 H new ATOM 0 HD12 ILE A 952 1.401 15.012 5.281 1.00 0.00 H new ATOM 0 HD13 ILE A 952 1.308 16.443 6.334 1.00 0.00 H new ATOM 612 N PRO A 953 6.260 18.542 4.687 1.00 0.00 N ATOM 613 CA PRO A 953 7.665 18.613 5.099 1.00 0.00 C ATOM 614 C PRO A 953 8.013 17.570 6.156 1.00 0.00 C ATOM 615 O PRO A 953 7.237 17.327 7.080 1.00 0.00 O ATOM 616 CB PRO A 953 7.795 20.024 5.676 1.00 0.00 C ATOM 617 CG PRO A 953 6.418 20.381 6.119 1.00 0.00 C ATOM 618 CD PRO A 953 5.485 19.704 5.154 1.00 0.00 C ATOM 0 HA PRO A 953 8.343 18.413 4.270 1.00 0.00 H new ATOM 0 HB2 PRO A 953 8.497 20.048 6.509 1.00 0.00 H new ATOM 0 HB3 PRO A 953 8.164 20.725 4.928 1.00 0.00 H new ATOM 0 HG2 PRO A 953 6.236 20.044 7.139 1.00 0.00 H new ATOM 0 HG3 PRO A 953 6.273 21.461 6.110 1.00 0.00 H new ATOM 0 HD2 PRO A 953 4.557 19.400 5.639 1.00 0.00 H new ATOM 0 HD3 PRO A 953 5.213 20.363 4.329 1.00 0.00 H new ATOM 626 N GLY A 954 9.184 16.958 6.015 1.00 0.00 N ATOM 627 CA GLY A 954 9.613 15.949 6.966 1.00 0.00 C ATOM 628 C GLY A 954 8.908 14.623 6.762 1.00 0.00 C ATOM 629 O GLY A 954 9.271 13.618 7.374 1.00 0.00 O ATOM 0 H GLY A 954 9.844 17.143 5.259 1.00 0.00 H new ATOM 0 HA2 GLY A 954 10.689 15.803 6.875 1.00 0.00 H new ATOM 0 HA3 GLY A 954 9.424 16.305 7.979 1.00 0.00 H new ATOM 633 N SER A 955 7.896 14.619 5.901 1.00 0.00 N ATOM 634 CA SER A 955 7.134 13.407 5.622 1.00 0.00 C ATOM 635 C SER A 955 8.019 12.344 4.979 1.00 0.00 C ATOM 636 O SER A 955 8.140 11.230 5.487 1.00 0.00 O ATOM 637 CB SER A 955 5.949 13.723 4.706 1.00 0.00 C ATOM 638 OG SER A 955 6.385 13.994 3.385 1.00 0.00 O ATOM 0 H SER A 955 7.584 15.441 5.384 1.00 0.00 H new ATOM 0 HA SER A 955 6.759 13.018 6.569 1.00 0.00 H new ATOM 0 HB2 SER A 955 5.256 12.881 4.698 1.00 0.00 H new ATOM 0 HB3 SER A 955 5.403 14.582 5.096 1.00 0.00 H new ATOM 0 HG SER A 955 6.178 14.924 3.157 1.00 0.00 H new ATOM 644 N VAL A 956 8.637 12.698 3.856 1.00 0.00 N ATOM 645 CA VAL A 956 9.512 11.776 3.142 1.00 0.00 C ATOM 646 C VAL A 956 10.386 10.987 4.111 1.00 0.00 C ATOM 647 O VAL A 956 11.401 11.488 4.596 1.00 0.00 O ATOM 648 CB VAL A 956 10.417 12.522 2.143 1.00 0.00 C ATOM 649 CG1 VAL A 956 11.412 11.564 1.506 1.00 0.00 C ATOM 650 CG2 VAL A 956 9.577 13.216 1.081 1.00 0.00 C ATOM 0 H VAL A 956 8.548 13.617 3.422 1.00 0.00 H new ATOM 0 HA VAL A 956 8.868 11.088 2.594 1.00 0.00 H new ATOM 0 HB VAL A 956 10.978 13.283 2.685 1.00 0.00 H new ATOM 0 HG11 VAL A 956 12.043 12.109 0.803 1.00 0.00 H new ATOM 0 HG12 VAL A 956 12.034 11.117 2.281 1.00 0.00 H new ATOM 0 HG13 VAL A 956 10.873 10.779 0.976 1.00 0.00 H new ATOM 0 HG21 VAL A 956 10.232 13.738 0.383 1.00 0.00 H new ATOM 0 HG22 VAL A 956 8.988 12.475 0.541 1.00 0.00 H new ATOM 0 HG23 VAL A 956 8.908 13.933 1.557 1.00 0.00 H new ATOM 660 N CYS A 957 9.986 9.751 4.387 1.00 0.00 N ATOM 661 CA CYS A 957 10.733 8.892 5.299 1.00 0.00 C ATOM 662 C CYS A 957 11.330 7.701 4.557 1.00 0.00 C ATOM 663 O CYS A 957 10.609 6.806 4.115 1.00 0.00 O ATOM 664 CB CYS A 957 9.826 8.401 6.429 1.00 0.00 C ATOM 665 SG CYS A 957 9.775 9.500 7.864 1.00 0.00 S ATOM 0 H CYS A 957 9.149 9.321 3.993 1.00 0.00 H new ATOM 0 HA CYS A 957 11.548 9.478 5.725 1.00 0.00 H new ATOM 0 HB2 CYS A 957 8.814 8.279 6.042 1.00 0.00 H new ATOM 0 HB3 CYS A 957 10.165 7.416 6.751 1.00 0.00 H new ATOM 0 HG CYS A 957 9.144 10.593 7.552 1.00 0.00 H new ATOM 671 N LEU A 958 12.652 7.697 4.421 1.00 0.00 N ATOM 672 CA LEU A 958 13.347 6.617 3.730 1.00 0.00 C ATOM 673 C LEU A 958 13.665 5.473 4.689 1.00 0.00 C ATOM 674 O LEU A 958 14.175 5.693 5.787 1.00 0.00 O ATOM 675 CB LEU A 958 14.637 7.138 3.095 1.00 0.00 C ATOM 676 CG LEU A 958 14.465 8.116 1.932 1.00 0.00 C ATOM 677 CD1 LEU A 958 15.787 8.790 1.601 1.00 0.00 C ATOM 678 CD2 LEU A 958 13.909 7.399 0.710 1.00 0.00 C ATOM 0 H LEU A 958 13.264 8.430 4.780 1.00 0.00 H new ATOM 0 HA LEU A 958 12.691 6.239 2.946 1.00 0.00 H new ATOM 0 HB2 LEU A 958 15.228 7.626 3.870 1.00 0.00 H new ATOM 0 HB3 LEU A 958 15.216 6.284 2.743 1.00 0.00 H new ATOM 0 HG LEU A 958 13.754 8.886 2.232 1.00 0.00 H new ATOM 0 HD11 LEU A 958 15.645 9.482 0.771 1.00 0.00 H new ATOM 0 HD12 LEU A 958 16.145 9.338 2.473 1.00 0.00 H new ATOM 0 HD13 LEU A 958 16.521 8.034 1.321 1.00 0.00 H new ATOM 0 HD21 LEU A 958 13.793 8.110 -0.108 1.00 0.00 H new ATOM 0 HD22 LEU A 958 14.596 6.608 0.408 1.00 0.00 H new ATOM 0 HD23 LEU A 958 12.939 6.964 0.953 1.00 0.00 H new ATOM 690 N LYS A 959 13.362 4.251 4.264 1.00 0.00 N ATOM 691 CA LYS A 959 13.618 3.071 5.082 1.00 0.00 C ATOM 692 C LYS A 959 14.934 2.410 4.686 1.00 0.00 C ATOM 693 O LYS A 959 15.246 2.287 3.501 1.00 0.00 O ATOM 694 CB LYS A 959 12.469 2.070 4.942 1.00 0.00 C ATOM 695 CG LYS A 959 12.270 1.198 6.169 1.00 0.00 C ATOM 696 CD LYS A 959 11.422 -0.023 5.854 1.00 0.00 C ATOM 697 CE LYS A 959 10.993 -0.746 7.122 1.00 0.00 C ATOM 698 NZ LYS A 959 10.721 -2.189 6.873 1.00 0.00 N ATOM 0 H LYS A 959 12.939 4.052 3.358 1.00 0.00 H new ATOM 0 HA LYS A 959 13.690 3.389 6.122 1.00 0.00 H new ATOM 0 HB2 LYS A 959 11.547 2.614 4.740 1.00 0.00 H new ATOM 0 HB3 LYS A 959 12.658 1.431 4.079 1.00 0.00 H new ATOM 0 HG2 LYS A 959 13.240 0.880 6.551 1.00 0.00 H new ATOM 0 HG3 LYS A 959 11.792 1.780 6.957 1.00 0.00 H new ATOM 0 HD2 LYS A 959 10.540 0.281 5.291 1.00 0.00 H new ATOM 0 HD3 LYS A 959 11.986 -0.705 5.218 1.00 0.00 H new ATOM 0 HE2 LYS A 959 11.773 -0.649 7.877 1.00 0.00 H new ATOM 0 HE3 LYS A 959 10.098 -0.272 7.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 10.432 -2.646 7.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 9.959 -2.283 6.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 11.582 -2.647 6.512 1.00 0.00 H new ATOM 712 N TYR A 960 15.701 1.985 5.684 1.00 0.00 N ATOM 713 CA TYR A 960 16.984 1.337 5.439 1.00 0.00 C ATOM 714 C TYR A 960 17.055 -0.013 6.146 1.00 0.00 C ATOM 715 O TYR A 960 16.347 -0.253 7.122 1.00 0.00 O ATOM 716 CB TYR A 960 18.130 2.234 5.911 1.00 0.00 C ATOM 717 CG TYR A 960 18.144 3.595 5.253 1.00 0.00 C ATOM 718 CD1 TYR A 960 17.395 4.645 5.768 1.00 0.00 C ATOM 719 CD2 TYR A 960 18.909 3.830 4.117 1.00 0.00 C ATOM 720 CE1 TYR A 960 17.405 5.890 5.169 1.00 0.00 C ATOM 721 CE2 TYR A 960 18.926 5.072 3.512 1.00 0.00 C ATOM 722 CZ TYR A 960 18.172 6.099 4.042 1.00 0.00 C ATOM 723 OH TYR A 960 18.185 7.338 3.443 1.00 0.00 O ATOM 0 H TYR A 960 15.457 2.078 6.670 1.00 0.00 H new ATOM 0 HA TYR A 960 17.080 1.171 4.366 1.00 0.00 H new ATOM 0 HB2 TYR A 960 18.058 2.363 6.991 1.00 0.00 H new ATOM 0 HB3 TYR A 960 19.078 1.734 5.712 1.00 0.00 H new ATOM 0 HD1 TYR A 960 16.795 4.486 6.652 1.00 0.00 H new ATOM 0 HD2 TYR A 960 19.500 3.028 3.700 1.00 0.00 H new ATOM 0 HE1 TYR A 960 16.815 6.695 5.581 1.00 0.00 H new ATOM 0 HE2 TYR A 960 19.526 5.238 2.629 1.00 0.00 H new ATOM 0 HH TYR A 960 18.776 7.317 2.662 1.00 0.00 H new ATOM 733 N ASN A 961 17.917 -0.891 5.643 1.00 0.00 N ATOM 734 CA ASN A 961 18.083 -2.218 6.225 1.00 0.00 C ATOM 735 C ASN A 961 18.718 -2.130 7.610 1.00 0.00 C ATOM 736 O ASN A 961 18.995 -1.039 8.107 1.00 0.00 O ATOM 737 CB ASN A 961 18.944 -3.094 5.312 1.00 0.00 C ATOM 738 CG ASN A 961 18.628 -2.885 3.844 1.00 0.00 C ATOM 739 OD1 ASN A 961 19.345 -1.965 3.210 1.00 0.00 O flip ATOM 740 ND2 ASN A 961 17.749 -3.543 3.287 1.00 0.00 N flip ATOM 0 H ASN A 961 18.511 -0.708 4.834 1.00 0.00 H new ATOM 0 HA ASN A 961 17.096 -2.669 6.326 1.00 0.00 H new ATOM 0 HB2 ASN A 961 19.997 -2.874 5.489 1.00 0.00 H new ATOM 0 HB3 ASN A 961 18.790 -4.142 5.568 1.00 0.00 H new ATOM 0 HD21 ASN A 961 17.223 -4.240 3.814 1.00 0.00 H new ATOM 0 HD22 ASN A 961 17.547 -3.391 2.299 1.00 0.00 H new ATOM 747 N GLU A 962 18.944 -3.286 8.226 1.00 0.00 N ATOM 748 CA GLU A 962 19.546 -3.338 9.553 1.00 0.00 C ATOM 749 C GLU A 962 20.932 -2.699 9.548 1.00 0.00 C ATOM 750 O GLU A 962 21.343 -2.072 10.524 1.00 0.00 O ATOM 751 CB GLU A 962 19.641 -4.786 10.038 1.00 0.00 C ATOM 752 CG GLU A 962 20.629 -4.984 11.175 1.00 0.00 C ATOM 753 CD GLU A 962 20.206 -4.272 12.445 1.00 0.00 C ATOM 754 OE1 GLU A 962 20.131 -3.025 12.429 1.00 0.00 O ATOM 755 OE2 GLU A 962 19.951 -4.961 13.455 1.00 0.00 O ATOM 0 H GLU A 962 18.720 -4.198 7.828 1.00 0.00 H new ATOM 0 HA GLU A 962 18.909 -2.775 10.235 1.00 0.00 H new ATOM 0 HB2 GLU A 962 18.655 -5.117 10.363 1.00 0.00 H new ATOM 0 HB3 GLU A 962 19.930 -5.422 9.202 1.00 0.00 H new ATOM 0 HG2 GLU A 962 20.735 -6.050 11.378 1.00 0.00 H new ATOM 0 HG3 GLU A 962 21.609 -4.619 10.868 1.00 0.00 H new ATOM 762 N LYS A 963 21.649 -2.865 8.442 1.00 0.00 N ATOM 763 CA LYS A 963 22.988 -2.306 8.306 1.00 0.00 C ATOM 764 C LYS A 963 22.931 -0.791 8.138 1.00 0.00 C ATOM 765 O LYS A 963 23.789 -0.067 8.641 1.00 0.00 O ATOM 766 CB LYS A 963 23.708 -2.935 7.112 1.00 0.00 C ATOM 767 CG LYS A 963 23.861 -4.443 7.219 1.00 0.00 C ATOM 768 CD LYS A 963 24.981 -4.955 6.329 1.00 0.00 C ATOM 769 CE LYS A 963 24.834 -6.442 6.048 1.00 0.00 C ATOM 770 NZ LYS A 963 25.129 -7.266 7.254 1.00 0.00 N ATOM 0 H LYS A 963 21.324 -3.383 7.626 1.00 0.00 H new ATOM 0 HA LYS A 963 23.542 -2.533 9.217 1.00 0.00 H new ATOM 0 HB2 LYS A 963 23.159 -2.698 6.201 1.00 0.00 H new ATOM 0 HB3 LYS A 963 24.696 -2.484 7.015 1.00 0.00 H new ATOM 0 HG2 LYS A 963 24.064 -4.716 8.254 1.00 0.00 H new ATOM 0 HG3 LYS A 963 22.924 -4.925 6.940 1.00 0.00 H new ATOM 0 HD2 LYS A 963 24.980 -4.404 5.388 1.00 0.00 H new ATOM 0 HD3 LYS A 963 25.942 -4.767 6.808 1.00 0.00 H new ATOM 0 HE2 LYS A 963 23.820 -6.649 5.706 1.00 0.00 H new ATOM 0 HE3 LYS A 963 25.507 -6.727 5.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 963 25.018 -8.274 7.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 963 26.105 -7.088 7.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 963 24.470 -7.012 8.018 1.00 0.00 H new ATOM 784 N GLY A 964 21.912 -0.317 7.427 1.00 0.00 N ATOM 785 CA GLY A 964 21.761 1.110 7.207 1.00 0.00 C ATOM 786 C GLY A 964 21.576 1.453 5.742 1.00 0.00 C ATOM 787 O GLY A 964 21.184 2.570 5.404 1.00 0.00 O ATOM 0 H GLY A 964 21.189 -0.895 7.000 1.00 0.00 H new ATOM 0 HA2 GLY A 964 20.904 1.473 7.773 1.00 0.00 H new ATOM 0 HA3 GLY A 964 22.639 1.629 7.591 1.00 0.00 H new ATOM 791 N MET A 965 21.862 0.492 4.870 1.00 0.00 N ATOM 792 CA MET A 965 21.725 0.700 3.433 1.00 0.00 C ATOM 793 C MET A 965 20.262 0.890 3.047 1.00 0.00 C ATOM 794 O MET A 965 19.348 0.467 3.756 1.00 0.00 O ATOM 795 CB MET A 965 22.316 -0.485 2.666 1.00 0.00 C ATOM 796 CG MET A 965 23.830 -0.434 2.541 1.00 0.00 C ATOM 797 SD MET A 965 24.409 1.067 1.727 1.00 0.00 S ATOM 798 CE MET A 965 24.967 2.022 3.135 1.00 0.00 C ATOM 0 H MET A 965 22.190 -0.437 5.133 1.00 0.00 H new ATOM 0 HA MET A 965 22.272 1.605 3.169 1.00 0.00 H new ATOM 0 HB2 MET A 965 22.032 -1.410 3.168 1.00 0.00 H new ATOM 0 HB3 MET A 965 21.878 -0.516 1.668 1.00 0.00 H new ATOM 0 HG2 MET A 965 24.275 -0.499 3.534 1.00 0.00 H new ATOM 0 HG3 MET A 965 24.174 -1.303 1.980 1.00 0.00 H new ATOM 0 HE1 MET A 965 24.800 3.082 2.945 1.00 0.00 H new ATOM 0 HE2 MET A 965 24.411 1.721 4.023 1.00 0.00 H new ATOM 0 HE3 MET A 965 26.030 1.845 3.296 1.00 0.00 H new ATOM 808 N PRO A 966 20.031 1.543 1.899 1.00 0.00 N ATOM 809 CA PRO A 966 18.680 1.805 1.394 1.00 0.00 C ATOM 810 C PRO A 966 17.980 0.533 0.925 1.00 0.00 C ATOM 811 O PRO A 966 18.535 -0.243 0.147 1.00 0.00 O ATOM 812 CB PRO A 966 18.919 2.749 0.213 1.00 0.00 C ATOM 813 CG PRO A 966 20.308 2.451 -0.236 1.00 0.00 C ATOM 814 CD PRO A 966 21.072 2.076 1.004 1.00 0.00 C ATOM 0 HA PRO A 966 18.031 2.220 2.165 1.00 0.00 H new ATOM 0 HB2 PRO A 966 18.199 2.574 -0.586 1.00 0.00 H new ATOM 0 HB3 PRO A 966 18.815 3.792 0.513 1.00 0.00 H new ATOM 0 HG2 PRO A 966 20.318 1.637 -0.961 1.00 0.00 H new ATOM 0 HG3 PRO A 966 20.755 3.318 -0.723 1.00 0.00 H new ATOM 0 HD2 PRO A 966 21.840 1.332 0.793 1.00 0.00 H new ATOM 0 HD3 PRO A 966 21.575 2.938 1.442 1.00 0.00 H new ATOM 822 N THR A 967 16.757 0.326 1.403 1.00 0.00 N ATOM 823 CA THR A 967 15.982 -0.851 1.034 1.00 0.00 C ATOM 824 C THR A 967 15.092 -0.568 -0.171 1.00 0.00 C ATOM 825 O THR A 967 14.283 -1.406 -0.568 1.00 0.00 O ATOM 826 CB THR A 967 15.104 -1.336 2.204 1.00 0.00 C ATOM 827 OG1 THR A 967 13.983 -0.460 2.370 1.00 0.00 O ATOM 828 CG2 THR A 967 15.906 -1.391 3.495 1.00 0.00 C ATOM 0 H THR A 967 16.282 0.959 2.047 1.00 0.00 H new ATOM 0 HA THR A 967 16.697 -1.633 0.778 1.00 0.00 H new ATOM 0 HB THR A 967 14.749 -2.340 1.972 1.00 0.00 H new ATOM 0 HG1 THR A 967 14.291 0.404 2.716 1.00 0.00 H new ATOM 0 HG21 THR A 967 15.266 -1.736 4.307 1.00 0.00 H new ATOM 0 HG22 THR A 967 16.742 -2.080 3.375 1.00 0.00 H new ATOM 0 HG23 THR A 967 16.286 -0.397 3.730 1.00 0.00 H new ATOM 836 N GLY A 968 15.247 0.619 -0.749 1.00 0.00 N ATOM 837 CA GLY A 968 14.450 0.991 -1.904 1.00 0.00 C ATOM 838 C GLY A 968 13.006 1.279 -1.544 1.00 0.00 C ATOM 839 O GLY A 968 12.117 1.174 -2.388 1.00 0.00 O ATOM 0 H GLY A 968 15.910 1.330 -0.439 1.00 0.00 H new ATOM 0 HA2 GLY A 968 14.887 1.872 -2.374 1.00 0.00 H new ATOM 0 HA3 GLY A 968 14.484 0.187 -2.639 1.00 0.00 H new ATOM 843 N GLU A 969 12.772 1.640 -0.286 1.00 0.00 N ATOM 844 CA GLU A 969 11.425 1.941 0.183 1.00 0.00 C ATOM 845 C GLU A 969 11.358 3.341 0.786 1.00 0.00 C ATOM 846 O GLU A 969 12.317 3.811 1.398 1.00 0.00 O ATOM 847 CB GLU A 969 10.979 0.906 1.218 1.00 0.00 C ATOM 848 CG GLU A 969 10.485 -0.394 0.606 1.00 0.00 C ATOM 849 CD GLU A 969 10.336 -1.502 1.631 1.00 0.00 C ATOM 850 OE1 GLU A 969 9.514 -1.344 2.558 1.00 0.00 O ATOM 851 OE2 GLU A 969 11.041 -2.525 1.506 1.00 0.00 O ATOM 0 H GLU A 969 13.497 1.731 0.426 1.00 0.00 H new ATOM 0 HA GLU A 969 10.752 1.901 -0.674 1.00 0.00 H new ATOM 0 HB2 GLU A 969 11.813 0.689 1.885 1.00 0.00 H new ATOM 0 HB3 GLU A 969 10.185 1.335 1.829 1.00 0.00 H new ATOM 0 HG2 GLU A 969 9.524 -0.221 0.121 1.00 0.00 H new ATOM 0 HG3 GLU A 969 11.181 -0.713 -0.170 1.00 0.00 H new ATOM 858 N ALA A 970 10.219 4.002 0.608 1.00 0.00 N ATOM 859 CA ALA A 970 10.026 5.348 1.135 1.00 0.00 C ATOM 860 C ALA A 970 8.559 5.603 1.463 1.00 0.00 C ATOM 861 O ALA A 970 7.666 5.005 0.863 1.00 0.00 O ATOM 862 CB ALA A 970 10.535 6.382 0.141 1.00 0.00 C ATOM 0 H ALA A 970 9.416 3.628 0.103 1.00 0.00 H new ATOM 0 HA ALA A 970 10.598 5.436 2.058 1.00 0.00 H new ATOM 0 HB1 ALA A 970 10.385 7.382 0.547 1.00 0.00 H new ATOM 0 HB2 ALA A 970 11.598 6.220 -0.041 1.00 0.00 H new ATOM 0 HB3 ALA A 970 9.988 6.285 -0.797 1.00 0.00 H new ATOM 868 N MET A 971 8.318 6.495 2.418 1.00 0.00 N ATOM 869 CA MET A 971 6.958 6.830 2.825 1.00 0.00 C ATOM 870 C MET A 971 6.731 8.338 2.773 1.00 0.00 C ATOM 871 O MET A 971 7.629 9.122 3.081 1.00 0.00 O ATOM 872 CB MET A 971 6.682 6.309 4.236 1.00 0.00 C ATOM 873 CG MET A 971 6.123 4.896 4.264 1.00 0.00 C ATOM 874 SD MET A 971 5.050 4.601 5.682 1.00 0.00 S ATOM 875 CE MET A 971 6.125 5.089 7.028 1.00 0.00 C ATOM 0 H MET A 971 9.046 6.999 2.924 1.00 0.00 H new ATOM 0 HA MET A 971 6.269 6.352 2.128 1.00 0.00 H new ATOM 0 HB2 MET A 971 7.607 6.336 4.812 1.00 0.00 H new ATOM 0 HB3 MET A 971 5.979 6.979 4.731 1.00 0.00 H new ATOM 0 HG2 MET A 971 5.564 4.712 3.346 1.00 0.00 H new ATOM 0 HG3 MET A 971 6.948 4.184 4.283 1.00 0.00 H new ATOM 0 HE1 MET A 971 5.700 4.752 7.974 1.00 0.00 H new ATOM 0 HE2 MET A 971 7.108 4.638 6.891 1.00 0.00 H new ATOM 0 HE3 MET A 971 6.223 6.175 7.040 1.00 0.00 H new ATOM 885 N VAL A 972 5.525 8.737 2.382 1.00 0.00 N ATOM 886 CA VAL A 972 5.180 10.151 2.291 1.00 0.00 C ATOM 887 C VAL A 972 3.784 10.412 2.845 1.00 0.00 C ATOM 888 O VAL A 972 2.988 9.488 3.013 1.00 0.00 O ATOM 889 CB VAL A 972 5.245 10.652 0.836 1.00 0.00 C ATOM 890 CG1 VAL A 972 6.685 10.921 0.428 1.00 0.00 C ATOM 891 CG2 VAL A 972 4.594 9.647 -0.103 1.00 0.00 C ATOM 0 H VAL A 972 4.771 8.101 2.123 1.00 0.00 H new ATOM 0 HA VAL A 972 5.912 10.695 2.888 1.00 0.00 H new ATOM 0 HB VAL A 972 4.692 11.589 0.767 1.00 0.00 H new ATOM 0 HG11 VAL A 972 6.711 11.274 -0.603 1.00 0.00 H new ATOM 0 HG12 VAL A 972 7.113 11.680 1.083 1.00 0.00 H new ATOM 0 HG13 VAL A 972 7.265 10.002 0.511 1.00 0.00 H new ATOM 0 HG21 VAL A 972 4.649 10.017 -1.127 1.00 0.00 H new ATOM 0 HG22 VAL A 972 5.116 8.693 -0.034 1.00 0.00 H new ATOM 0 HG23 VAL A 972 3.550 9.510 0.178 1.00 0.00 H new ATOM 901 N ALA A 973 3.492 11.678 3.127 1.00 0.00 N ATOM 902 CA ALA A 973 2.191 12.062 3.660 1.00 0.00 C ATOM 903 C ALA A 973 1.571 13.186 2.837 1.00 0.00 C ATOM 904 O ALA A 973 2.277 13.945 2.172 1.00 0.00 O ATOM 905 CB ALA A 973 2.320 12.481 5.116 1.00 0.00 C ATOM 0 H ALA A 973 4.140 12.455 2.995 1.00 0.00 H new ATOM 0 HA ALA A 973 1.531 11.196 3.600 1.00 0.00 H new ATOM 0 HB1 ALA A 973 1.341 12.765 5.501 1.00 0.00 H new ATOM 0 HB2 ALA A 973 2.712 11.649 5.701 1.00 0.00 H new ATOM 0 HB3 ALA A 973 3.000 13.330 5.192 1.00 0.00 H new ATOM 911 N PHE A 974 0.247 13.287 2.885 1.00 0.00 N ATOM 912 CA PHE A 974 -0.469 14.319 2.142 1.00 0.00 C ATOM 913 C PHE A 974 -1.584 14.924 2.989 1.00 0.00 C ATOM 914 O PHE A 974 -2.296 14.212 3.696 1.00 0.00 O ATOM 915 CB PHE A 974 -1.051 13.736 0.852 1.00 0.00 C ATOM 916 CG PHE A 974 -0.044 13.606 -0.255 1.00 0.00 C ATOM 917 CD1 PHE A 974 0.819 12.524 -0.300 1.00 0.00 C ATOM 918 CD2 PHE A 974 0.038 14.567 -1.250 1.00 0.00 C ATOM 919 CE1 PHE A 974 1.746 12.402 -1.318 1.00 0.00 C ATOM 920 CE2 PHE A 974 0.963 14.450 -2.270 1.00 0.00 C ATOM 921 CZ PHE A 974 1.818 13.366 -2.305 1.00 0.00 C ATOM 0 H PHE A 974 -0.352 12.667 3.430 1.00 0.00 H new ATOM 0 HA PHE A 974 0.239 15.108 1.889 1.00 0.00 H new ATOM 0 HB2 PHE A 974 -1.474 12.754 1.065 1.00 0.00 H new ATOM 0 HB3 PHE A 974 -1.871 14.370 0.514 1.00 0.00 H new ATOM 0 HD1 PHE A 974 0.767 11.767 0.469 1.00 0.00 H new ATOM 0 HD2 PHE A 974 -0.628 15.417 -1.228 1.00 0.00 H new ATOM 0 HE1 PHE A 974 2.414 11.553 -1.342 1.00 0.00 H new ATOM 0 HE2 PHE A 974 1.017 15.206 -3.039 1.00 0.00 H new ATOM 0 HZ PHE A 974 2.541 13.272 -3.102 1.00 0.00 H new ATOM 931 N GLU A 975 -1.727 16.244 2.912 1.00 0.00 N ATOM 932 CA GLU A 975 -2.755 16.945 3.673 1.00 0.00 C ATOM 933 C GLU A 975 -4.139 16.684 3.087 1.00 0.00 C ATOM 934 O GLU A 975 -5.136 16.662 3.809 1.00 0.00 O ATOM 935 CB GLU A 975 -2.471 18.449 3.689 1.00 0.00 C ATOM 936 CG GLU A 975 -1.123 18.808 4.291 1.00 0.00 C ATOM 937 CD GLU A 975 -0.913 20.306 4.400 1.00 0.00 C ATOM 938 OE1 GLU A 975 -0.813 20.969 3.348 1.00 0.00 O ATOM 939 OE2 GLU A 975 -0.850 20.814 5.539 1.00 0.00 O ATOM 0 H GLU A 975 -1.145 16.848 2.332 1.00 0.00 H new ATOM 0 HA GLU A 975 -2.736 16.567 4.695 1.00 0.00 H new ATOM 0 HB2 GLU A 975 -2.517 18.830 2.669 1.00 0.00 H new ATOM 0 HB3 GLU A 975 -3.257 18.952 4.252 1.00 0.00 H new ATOM 0 HG2 GLU A 975 -1.041 18.360 5.281 1.00 0.00 H new ATOM 0 HG3 GLU A 975 -0.330 18.377 3.680 1.00 0.00 H new ATOM 946 N SER A 976 -4.192 16.486 1.774 1.00 0.00 N ATOM 947 CA SER A 976 -5.454 16.230 1.090 1.00 0.00 C ATOM 948 C SER A 976 -5.450 14.849 0.441 1.00 0.00 C ATOM 949 O SER A 976 -4.515 14.491 -0.276 1.00 0.00 O ATOM 950 CB SER A 976 -5.711 17.303 0.030 1.00 0.00 C ATOM 951 OG SER A 976 -7.097 17.447 -0.225 1.00 0.00 O ATOM 0 H SER A 976 -3.376 16.498 1.163 1.00 0.00 H new ATOM 0 HA SER A 976 -6.253 16.262 1.831 1.00 0.00 H new ATOM 0 HB2 SER A 976 -5.299 18.255 0.365 1.00 0.00 H new ATOM 0 HB3 SER A 976 -5.194 17.038 -0.892 1.00 0.00 H new ATOM 0 HG SER A 976 -7.234 18.139 -0.905 1.00 0.00 H new ATOM 957 N ARG A 977 -6.502 14.079 0.697 1.00 0.00 N ATOM 958 CA ARG A 977 -6.620 12.737 0.139 1.00 0.00 C ATOM 959 C ARG A 977 -6.695 12.786 -1.384 1.00 0.00 C ATOM 960 O ARG A 977 -6.094 11.961 -2.072 1.00 0.00 O ATOM 961 CB ARG A 977 -7.859 12.036 0.699 1.00 0.00 C ATOM 962 CG ARG A 977 -7.730 10.523 0.756 1.00 0.00 C ATOM 963 CD ARG A 977 -9.021 9.870 1.224 1.00 0.00 C ATOM 964 NE ARG A 977 -9.399 10.305 2.566 1.00 0.00 N ATOM 965 CZ ARG A 977 -10.582 10.053 3.115 1.00 0.00 C ATOM 966 NH1 ARG A 977 -11.498 9.372 2.440 1.00 0.00 N ATOM 967 NH2 ARG A 977 -10.851 10.481 4.341 1.00 0.00 N ATOM 0 H ARG A 977 -7.285 14.361 1.287 1.00 0.00 H new ATOM 0 HA ARG A 977 -5.732 12.173 0.424 1.00 0.00 H new ATOM 0 HB2 ARG A 977 -8.057 12.413 1.702 1.00 0.00 H new ATOM 0 HB3 ARG A 977 -8.721 12.296 0.085 1.00 0.00 H new ATOM 0 HG2 ARG A 977 -7.465 10.142 -0.230 1.00 0.00 H new ATOM 0 HG3 ARG A 977 -6.918 10.251 1.431 1.00 0.00 H new ATOM 0 HD2 ARG A 977 -9.823 10.110 0.526 1.00 0.00 H new ATOM 0 HD3 ARG A 977 -8.904 8.786 1.214 1.00 0.00 H new ATOM 0 HE ARG A 977 -8.717 10.831 3.112 1.00 0.00 H new ATOM 0 HH11 ARG A 977 -11.295 9.040 1.497 1.00 0.00 H new ATOM 0 HH12 ARG A 977 -12.406 9.180 2.864 1.00 0.00 H new ATOM 0 HH21 ARG A 977 -10.149 11.005 4.864 1.00 0.00 H new ATOM 0 HH22 ARG A 977 -11.760 10.287 4.761 1.00 0.00 H new ATOM 981 N ASP A 978 -7.438 13.757 -1.904 1.00 0.00 N ATOM 982 CA ASP A 978 -7.591 13.914 -3.345 1.00 0.00 C ATOM 983 C ASP A 978 -6.235 14.099 -4.019 1.00 0.00 C ATOM 984 O ASP A 978 -5.989 13.559 -5.097 1.00 0.00 O ATOM 985 CB ASP A 978 -8.496 15.107 -3.656 1.00 0.00 C ATOM 986 CG ASP A 978 -8.267 16.270 -2.711 1.00 0.00 C ATOM 987 OD1 ASP A 978 -7.194 16.903 -2.799 1.00 0.00 O ATOM 988 OD2 ASP A 978 -9.160 16.547 -1.883 1.00 0.00 O ATOM 0 H ASP A 978 -7.944 14.447 -1.349 1.00 0.00 H new ATOM 0 HA ASP A 978 -8.051 13.007 -3.738 1.00 0.00 H new ATOM 0 HB2 ASP A 978 -8.320 15.435 -4.680 1.00 0.00 H new ATOM 0 HB3 ASP A 978 -9.538 14.794 -3.596 1.00 0.00 H new ATOM 993 N GLU A 979 -5.360 14.867 -3.377 1.00 0.00 N ATOM 994 CA GLU A 979 -4.030 15.125 -3.916 1.00 0.00 C ATOM 995 C GLU A 979 -3.189 13.851 -3.920 1.00 0.00 C ATOM 996 O GLU A 979 -2.526 13.536 -4.908 1.00 0.00 O ATOM 997 CB GLU A 979 -3.327 16.211 -3.100 1.00 0.00 C ATOM 998 CG GLU A 979 -3.597 17.620 -3.601 1.00 0.00 C ATOM 999 CD GLU A 979 -5.074 17.889 -3.816 1.00 0.00 C ATOM 1000 OE1 GLU A 979 -5.673 17.237 -4.697 1.00 0.00 O ATOM 1001 OE2 GLU A 979 -5.630 18.752 -3.105 1.00 0.00 O ATOM 0 H GLU A 979 -5.548 15.321 -2.483 1.00 0.00 H new ATOM 0 HA GLU A 979 -4.142 15.469 -4.944 1.00 0.00 H new ATOM 0 HB2 GLU A 979 -3.647 16.137 -2.061 1.00 0.00 H new ATOM 0 HB3 GLU A 979 -2.253 16.028 -3.117 1.00 0.00 H new ATOM 0 HG2 GLU A 979 -3.201 18.339 -2.884 1.00 0.00 H new ATOM 0 HG3 GLU A 979 -3.063 17.777 -4.538 1.00 0.00 H new ATOM 1008 N ALA A 980 -3.222 13.124 -2.808 1.00 0.00 N ATOM 1009 CA ALA A 980 -2.465 11.885 -2.684 1.00 0.00 C ATOM 1010 C ALA A 980 -2.868 10.884 -3.762 1.00 0.00 C ATOM 1011 O ALA A 980 -2.016 10.305 -4.436 1.00 0.00 O ATOM 1012 CB ALA A 980 -2.663 11.282 -1.301 1.00 0.00 C ATOM 0 H ALA A 980 -3.765 13.372 -1.981 1.00 0.00 H new ATOM 0 HA ALA A 980 -1.409 12.119 -2.819 1.00 0.00 H new ATOM 0 HB1 ALA A 980 -2.092 10.357 -1.222 1.00 0.00 H new ATOM 0 HB2 ALA A 980 -2.319 11.987 -0.544 1.00 0.00 H new ATOM 0 HB3 ALA A 980 -3.721 11.070 -1.145 1.00 0.00 H new ATOM 1018 N THR A 981 -4.173 10.684 -3.919 1.00 0.00 N ATOM 1019 CA THR A 981 -4.688 9.752 -4.914 1.00 0.00 C ATOM 1020 C THR A 981 -4.327 10.199 -6.326 1.00 0.00 C ATOM 1021 O THR A 981 -3.910 9.391 -7.155 1.00 0.00 O ATOM 1022 CB THR A 981 -6.218 9.609 -4.809 1.00 0.00 C ATOM 1023 OG1 THR A 981 -6.611 9.539 -3.434 1.00 0.00 O ATOM 1024 CG2 THR A 981 -6.697 8.364 -5.542 1.00 0.00 C ATOM 0 H THR A 981 -4.892 11.155 -3.370 1.00 0.00 H new ATOM 0 HA THR A 981 -4.224 8.786 -4.712 1.00 0.00 H new ATOM 0 HB THR A 981 -6.675 10.483 -5.273 1.00 0.00 H new ATOM 0 HG1 THR A 981 -6.567 10.433 -3.035 1.00 0.00 H new ATOM 0 HG21 THR A 981 -7.780 8.284 -5.454 1.00 0.00 H new ATOM 0 HG22 THR A 981 -6.423 8.433 -6.595 1.00 0.00 H new ATOM 0 HG23 THR A 981 -6.231 7.482 -5.103 1.00 0.00 H new ATOM 1032 N ALA A 982 -4.488 11.491 -6.592 1.00 0.00 N ATOM 1033 CA ALA A 982 -4.176 12.046 -7.903 1.00 0.00 C ATOM 1034 C ALA A 982 -2.698 11.867 -8.237 1.00 0.00 C ATOM 1035 O ALA A 982 -2.349 11.423 -9.331 1.00 0.00 O ATOM 1036 CB ALA A 982 -4.557 13.518 -7.958 1.00 0.00 C ATOM 0 H ALA A 982 -4.833 12.173 -5.917 1.00 0.00 H new ATOM 0 HA ALA A 982 -4.759 11.504 -8.648 1.00 0.00 H new ATOM 0 HB1 ALA A 982 -4.318 13.919 -8.943 1.00 0.00 H new ATOM 0 HB2 ALA A 982 -5.626 13.624 -7.772 1.00 0.00 H new ATOM 0 HB3 ALA A 982 -4.000 14.067 -7.198 1.00 0.00 H new ATOM 1042 N ALA A 983 -1.836 12.216 -7.289 1.00 0.00 N ATOM 1043 CA ALA A 983 -0.396 12.093 -7.482 1.00 0.00 C ATOM 1044 C ALA A 983 0.004 10.639 -7.715 1.00 0.00 C ATOM 1045 O ALA A 983 0.829 10.343 -8.579 1.00 0.00 O ATOM 1046 CB ALA A 983 0.348 12.662 -6.284 1.00 0.00 C ATOM 0 H ALA A 983 -2.109 12.586 -6.379 1.00 0.00 H new ATOM 0 HA ALA A 983 -0.123 12.664 -8.369 1.00 0.00 H new ATOM 0 HB1 ALA A 983 1.422 12.563 -6.442 1.00 0.00 H new ATOM 0 HB2 ALA A 983 0.094 13.715 -6.165 1.00 0.00 H new ATOM 0 HB3 ALA A 983 0.062 12.116 -5.385 1.00 0.00 H new ATOM 1052 N VAL A 984 -0.585 9.737 -6.937 1.00 0.00 N ATOM 1053 CA VAL A 984 -0.291 8.314 -7.058 1.00 0.00 C ATOM 1054 C VAL A 984 -0.672 7.790 -8.438 1.00 0.00 C ATOM 1055 O VAL A 984 0.118 7.110 -9.095 1.00 0.00 O ATOM 1056 CB VAL A 984 -1.032 7.494 -5.986 1.00 0.00 C ATOM 1057 CG1 VAL A 984 -0.750 6.009 -6.159 1.00 0.00 C ATOM 1058 CG2 VAL A 984 -0.640 7.960 -4.593 1.00 0.00 C ATOM 0 H VAL A 984 -1.269 9.966 -6.216 1.00 0.00 H new ATOM 0 HA VAL A 984 0.783 8.199 -6.913 1.00 0.00 H new ATOM 0 HB VAL A 984 -2.103 7.653 -6.109 1.00 0.00 H new ATOM 0 HG11 VAL A 984 -1.282 5.446 -5.392 1.00 0.00 H new ATOM 0 HG12 VAL A 984 -1.086 5.687 -7.145 1.00 0.00 H new ATOM 0 HG13 VAL A 984 0.321 5.829 -6.064 1.00 0.00 H new ATOM 0 HG21 VAL A 984 -1.173 7.369 -3.848 1.00 0.00 H new ATOM 0 HG22 VAL A 984 0.434 7.833 -4.456 1.00 0.00 H new ATOM 0 HG23 VAL A 984 -0.899 9.012 -4.475 1.00 0.00 H new ATOM 1068 N ILE A 985 -1.886 8.110 -8.872 1.00 0.00 N ATOM 1069 CA ILE A 985 -2.371 7.672 -10.175 1.00 0.00 C ATOM 1070 C ILE A 985 -1.558 8.297 -11.303 1.00 0.00 C ATOM 1071 O ILE A 985 -1.220 7.631 -12.281 1.00 0.00 O ATOM 1072 CB ILE A 985 -3.857 8.027 -10.371 1.00 0.00 C ATOM 1073 CG1 ILE A 985 -4.693 7.473 -9.215 1.00 0.00 C ATOM 1074 CG2 ILE A 985 -4.360 7.489 -11.702 1.00 0.00 C ATOM 1075 CD1 ILE A 985 -5.985 8.226 -8.989 1.00 0.00 C ATOM 0 H ILE A 985 -2.552 8.671 -8.341 1.00 0.00 H new ATOM 0 HA ILE A 985 -2.257 6.588 -10.206 1.00 0.00 H new ATOM 0 HB ILE A 985 -3.958 9.112 -10.380 1.00 0.00 H new ATOM 0 HG12 ILE A 985 -4.922 6.426 -9.412 1.00 0.00 H new ATOM 0 HG13 ILE A 985 -4.100 7.503 -8.301 1.00 0.00 H new ATOM 0 HG21 ILE A 985 -5.412 7.748 -11.825 1.00 0.00 H new ATOM 0 HG22 ILE A 985 -3.780 7.928 -12.514 1.00 0.00 H new ATOM 0 HG23 ILE A 985 -4.249 6.405 -11.722 1.00 0.00 H new ATOM 0 HD11 ILE A 985 -6.526 7.779 -8.155 1.00 0.00 H new ATOM 0 HD12 ILE A 985 -5.763 9.268 -8.760 1.00 0.00 H new ATOM 0 HD13 ILE A 985 -6.598 8.174 -9.889 1.00 0.00 H new ATOM 1087 N ASP A 986 -1.245 9.580 -11.158 1.00 0.00 N ATOM 1088 CA ASP A 986 -0.468 10.295 -12.164 1.00 0.00 C ATOM 1089 C ASP A 986 0.999 9.879 -12.115 1.00 0.00 C ATOM 1090 O ASP A 986 1.723 9.998 -13.104 1.00 0.00 O ATOM 1091 CB ASP A 986 -0.590 11.806 -11.954 1.00 0.00 C ATOM 1092 CG ASP A 986 -1.781 12.397 -12.682 1.00 0.00 C ATOM 1093 OD1 ASP A 986 -2.756 11.656 -12.923 1.00 0.00 O ATOM 1094 OD2 ASP A 986 -1.737 13.601 -13.011 1.00 0.00 O ATOM 0 H ASP A 986 -1.517 10.146 -10.354 1.00 0.00 H new ATOM 0 HA ASP A 986 -0.867 10.039 -13.145 1.00 0.00 H new ATOM 0 HB2 ASP A 986 -0.679 12.016 -10.888 1.00 0.00 H new ATOM 0 HB3 ASP A 986 0.322 12.293 -12.300 1.00 0.00 H new ATOM 1099 N LEU A 987 1.431 9.391 -10.957 1.00 0.00 N ATOM 1100 CA LEU A 987 2.813 8.958 -10.778 1.00 0.00 C ATOM 1101 C LEU A 987 2.880 7.464 -10.478 1.00 0.00 C ATOM 1102 O LEU A 987 3.870 6.974 -9.936 1.00 0.00 O ATOM 1103 CB LEU A 987 3.472 9.747 -9.645 1.00 0.00 C ATOM 1104 CG LEU A 987 3.495 11.267 -9.811 1.00 0.00 C ATOM 1105 CD1 LEU A 987 3.978 11.936 -8.533 1.00 0.00 C ATOM 1106 CD2 LEU A 987 4.375 11.662 -10.987 1.00 0.00 C ATOM 0 H LEU A 987 0.845 9.285 -10.129 1.00 0.00 H new ATOM 0 HA LEU A 987 3.351 9.148 -11.706 1.00 0.00 H new ATOM 0 HB2 LEU A 987 2.954 9.511 -8.715 1.00 0.00 H new ATOM 0 HB3 LEU A 987 4.499 9.398 -9.535 1.00 0.00 H new ATOM 0 HG LEU A 987 2.479 11.607 -10.013 1.00 0.00 H new ATOM 0 HD11 LEU A 987 3.988 13.017 -8.670 1.00 0.00 H new ATOM 0 HD12 LEU A 987 3.308 11.680 -7.713 1.00 0.00 H new ATOM 0 HD13 LEU A 987 4.985 11.591 -8.300 1.00 0.00 H new ATOM 0 HD21 LEU A 987 4.379 12.747 -11.090 1.00 0.00 H new ATOM 0 HD22 LEU A 987 5.392 11.310 -10.815 1.00 0.00 H new ATOM 0 HD23 LEU A 987 3.985 11.213 -11.900 1.00 0.00 H new ATOM 1118 N ASN A 988 1.821 6.745 -10.837 1.00 0.00 N ATOM 1119 CA ASN A 988 1.761 5.306 -10.609 1.00 0.00 C ATOM 1120 C ASN A 988 2.529 4.551 -11.689 1.00 0.00 C ATOM 1121 O ASN A 988 2.217 4.656 -12.875 1.00 0.00 O ATOM 1122 CB ASN A 988 0.306 4.834 -10.577 1.00 0.00 C ATOM 1123 CG ASN A 988 0.165 3.369 -10.944 1.00 0.00 C ATOM 1124 OD1 ASN A 988 -0.215 3.033 -12.065 1.00 0.00 O ATOM 1125 ND2 ASN A 988 0.472 2.491 -9.997 1.00 0.00 N ATOM 0 H ASN A 988 0.993 7.136 -11.287 1.00 0.00 H new ATOM 0 HA ASN A 988 2.225 5.097 -9.645 1.00 0.00 H new ATOM 0 HB2 ASN A 988 -0.104 4.997 -9.580 1.00 0.00 H new ATOM 0 HB3 ASN A 988 -0.284 5.437 -11.267 1.00 0.00 H new ATOM 0 HD21 ASN A 988 0.397 1.491 -10.185 1.00 0.00 H new ATOM 0 HD22 ASN A 988 0.783 2.816 -9.082 1.00 0.00 H new ATOM 1132 N ASP A 989 3.534 3.790 -11.270 1.00 0.00 N ATOM 1133 CA ASP A 989 4.346 3.016 -12.201 1.00 0.00 C ATOM 1134 C ASP A 989 5.281 3.925 -12.993 1.00 0.00 C ATOM 1135 O ASP A 989 5.498 3.720 -14.188 1.00 0.00 O ATOM 1136 CB ASP A 989 3.451 2.227 -13.158 1.00 0.00 C ATOM 1137 CG ASP A 989 4.125 0.974 -13.682 1.00 0.00 C ATOM 1138 OD1 ASP A 989 4.028 -0.076 -13.014 1.00 0.00 O ATOM 1139 OD2 ASP A 989 4.750 1.044 -14.761 1.00 0.00 O ATOM 0 H ASP A 989 3.806 3.693 -10.292 1.00 0.00 H new ATOM 0 HA ASP A 989 4.951 2.318 -11.623 1.00 0.00 H new ATOM 0 HB2 ASP A 989 2.529 1.953 -12.645 1.00 0.00 H new ATOM 0 HB3 ASP A 989 3.172 2.864 -13.997 1.00 0.00 H new ATOM 1144 N ARG A 990 5.832 4.929 -12.319 1.00 0.00 N ATOM 1145 CA ARG A 990 6.742 5.871 -12.960 1.00 0.00 C ATOM 1146 C ARG A 990 8.162 5.313 -13.000 1.00 0.00 C ATOM 1147 O ARG A 990 8.713 4.877 -11.988 1.00 0.00 O ATOM 1148 CB ARG A 990 6.729 7.209 -12.220 1.00 0.00 C ATOM 1149 CG ARG A 990 5.539 8.088 -12.571 1.00 0.00 C ATOM 1150 CD ARG A 990 5.845 8.994 -13.754 1.00 0.00 C ATOM 1151 NE ARG A 990 4.823 10.020 -13.936 1.00 0.00 N ATOM 1152 CZ ARG A 990 4.762 10.817 -14.997 1.00 0.00 C ATOM 1153 NH1 ARG A 990 5.660 10.705 -15.966 1.00 0.00 N ATOM 1154 NH2 ARG A 990 3.801 11.727 -15.091 1.00 0.00 N ATOM 0 H ARG A 990 5.664 5.111 -11.330 1.00 0.00 H new ATOM 0 HA ARG A 990 6.402 6.027 -13.984 1.00 0.00 H new ATOM 0 HB2 ARG A 990 6.727 7.021 -11.146 1.00 0.00 H new ATOM 0 HB3 ARG A 990 7.648 7.749 -12.447 1.00 0.00 H new ATOM 0 HG2 ARG A 990 4.679 7.461 -12.805 1.00 0.00 H new ATOM 0 HG3 ARG A 990 5.266 8.695 -11.708 1.00 0.00 H new ATOM 0 HD2 ARG A 990 6.814 9.470 -13.605 1.00 0.00 H new ATOM 0 HD3 ARG A 990 5.921 8.393 -14.660 1.00 0.00 H new ATOM 0 HE ARG A 990 4.117 10.131 -13.208 1.00 0.00 H new ATOM 0 HH11 ARG A 990 6.400 10.006 -15.898 1.00 0.00 H new ATOM 0 HH12 ARG A 990 5.611 11.318 -16.780 1.00 0.00 H new ATOM 0 HH21 ARG A 990 3.108 11.815 -14.348 1.00 0.00 H new ATOM 0 HH22 ARG A 990 3.755 12.338 -15.906 1.00 0.00 H new ATOM 1168 N PRO A 991 8.770 5.326 -14.195 1.00 0.00 N ATOM 1169 CA PRO A 991 10.133 4.826 -14.396 1.00 0.00 C ATOM 1170 C PRO A 991 11.181 5.721 -13.743 1.00 0.00 C ATOM 1171 O PRO A 991 11.720 6.627 -14.380 1.00 0.00 O ATOM 1172 CB PRO A 991 10.295 4.835 -15.918 1.00 0.00 C ATOM 1173 CG PRO A 991 9.339 5.874 -16.393 1.00 0.00 C ATOM 1174 CD PRO A 991 8.174 5.831 -15.443 1.00 0.00 C ATOM 0 HA PRO A 991 10.277 3.844 -13.945 1.00 0.00 H new ATOM 0 HB2 PRO A 991 11.318 5.077 -16.206 1.00 0.00 H new ATOM 0 HB3 PRO A 991 10.065 3.860 -16.347 1.00 0.00 H new ATOM 0 HG2 PRO A 991 9.804 6.860 -16.396 1.00 0.00 H new ATOM 0 HG3 PRO A 991 9.017 5.670 -17.414 1.00 0.00 H new ATOM 0 HD2 PRO A 991 7.730 6.817 -15.306 1.00 0.00 H new ATOM 0 HD3 PRO A 991 7.384 5.174 -15.806 1.00 0.00 H new ATOM 1182 N ILE A 992 11.466 5.461 -12.472 1.00 0.00 N ATOM 1183 CA ILE A 992 12.451 6.244 -11.735 1.00 0.00 C ATOM 1184 C ILE A 992 13.859 5.698 -11.951 1.00 0.00 C ATOM 1185 O ILE A 992 14.130 4.528 -11.686 1.00 0.00 O ATOM 1186 CB ILE A 992 12.144 6.258 -10.226 1.00 0.00 C ATOM 1187 CG1 ILE A 992 10.967 7.191 -9.932 1.00 0.00 C ATOM 1188 CG2 ILE A 992 13.374 6.684 -9.439 1.00 0.00 C ATOM 1189 CD1 ILE A 992 10.723 7.408 -8.455 1.00 0.00 C ATOM 0 H ILE A 992 11.029 4.715 -11.931 1.00 0.00 H new ATOM 0 HA ILE A 992 12.396 7.263 -12.118 1.00 0.00 H new ATOM 0 HB ILE A 992 11.870 5.249 -9.916 1.00 0.00 H new ATOM 0 HG12 ILE A 992 11.150 8.155 -10.407 1.00 0.00 H new ATOM 0 HG13 ILE A 992 10.065 6.779 -10.384 1.00 0.00 H new ATOM 0 HG21 ILE A 992 13.141 6.689 -8.374 1.00 0.00 H new ATOM 0 HG22 ILE A 992 14.188 5.984 -9.629 1.00 0.00 H new ATOM 0 HG23 ILE A 992 13.676 7.684 -9.749 1.00 0.00 H new ATOM 0 HD11 ILE A 992 9.875 8.079 -8.321 1.00 0.00 H new ATOM 0 HD12 ILE A 992 10.508 6.452 -7.977 1.00 0.00 H new ATOM 0 HD13 ILE A 992 11.610 7.849 -8.001 1.00 0.00 H new ATOM 1201 N GLY A 993 14.753 6.557 -12.432 1.00 0.00 N ATOM 1202 CA GLY A 993 16.123 6.143 -12.673 1.00 0.00 C ATOM 1203 C GLY A 993 16.221 5.037 -13.705 1.00 0.00 C ATOM 1204 O GLY A 993 16.271 5.301 -14.906 1.00 0.00 O ATOM 0 H GLY A 993 14.553 7.531 -12.659 1.00 0.00 H new ATOM 0 HA2 GLY A 993 16.705 7.001 -13.008 1.00 0.00 H new ATOM 0 HA3 GLY A 993 16.567 5.803 -11.737 1.00 0.00 H new ATOM 1208 N SER A 994 16.251 3.794 -13.235 1.00 0.00 N ATOM 1209 CA SER A 994 16.351 2.643 -14.126 1.00 0.00 C ATOM 1210 C SER A 994 15.275 1.610 -13.800 1.00 0.00 C ATOM 1211 O SER A 994 15.154 0.590 -14.479 1.00 0.00 O ATOM 1212 CB SER A 994 17.737 2.004 -14.016 1.00 0.00 C ATOM 1213 OG SER A 994 17.829 0.844 -14.825 1.00 0.00 O ATOM 0 H SER A 994 16.208 3.558 -12.244 1.00 0.00 H new ATOM 0 HA SER A 994 16.200 2.991 -15.148 1.00 0.00 H new ATOM 0 HB2 SER A 994 18.498 2.724 -14.319 1.00 0.00 H new ATOM 0 HB3 SER A 994 17.940 1.744 -12.977 1.00 0.00 H new ATOM 0 HG SER A 994 16.949 0.416 -14.885 1.00 0.00 H new ATOM 1219 N ARG A 995 14.497 1.884 -12.758 1.00 0.00 N ATOM 1220 CA ARG A 995 13.433 0.979 -12.341 1.00 0.00 C ATOM 1221 C ARG A 995 12.140 1.745 -12.079 1.00 0.00 C ATOM 1222 O ARG A 995 12.161 2.945 -11.804 1.00 0.00 O ATOM 1223 CB ARG A 995 13.849 0.213 -11.084 1.00 0.00 C ATOM 1224 CG ARG A 995 15.241 -0.391 -11.171 1.00 0.00 C ATOM 1225 CD ARG A 995 15.472 -1.417 -10.073 1.00 0.00 C ATOM 1226 NE ARG A 995 16.393 -2.470 -10.492 1.00 0.00 N ATOM 1227 CZ ARG A 995 17.701 -2.287 -10.638 1.00 0.00 C ATOM 1228 NH1 ARG A 995 18.239 -1.099 -10.398 1.00 0.00 N ATOM 1229 NH2 ARG A 995 18.474 -3.294 -11.023 1.00 0.00 N ATOM 0 H ARG A 995 14.584 2.725 -12.187 1.00 0.00 H new ATOM 0 HA ARG A 995 13.257 0.269 -13.149 1.00 0.00 H new ATOM 0 HB2 ARG A 995 13.807 0.887 -10.228 1.00 0.00 H new ATOM 0 HB3 ARG A 995 13.128 -0.583 -10.899 1.00 0.00 H new ATOM 0 HG2 ARG A 995 15.374 -0.862 -12.145 1.00 0.00 H new ATOM 0 HG3 ARG A 995 15.987 0.400 -11.095 1.00 0.00 H new ATOM 0 HD2 ARG A 995 15.870 -0.918 -9.189 1.00 0.00 H new ATOM 0 HD3 ARG A 995 14.519 -1.862 -9.786 1.00 0.00 H new ATOM 0 HE ARG A 995 16.011 -3.396 -10.683 1.00 0.00 H new ATOM 0 HH11 ARG A 995 17.648 -0.322 -10.100 1.00 0.00 H new ATOM 0 HH12 ARG A 995 19.243 -0.962 -10.511 1.00 0.00 H new ATOM 0 HH21 ARG A 995 18.064 -4.210 -11.207 1.00 0.00 H new ATOM 0 HH22 ARG A 995 19.478 -3.152 -11.135 1.00 0.00 H new ATOM 1243 N LYS A 996 11.015 1.044 -12.167 1.00 0.00 N ATOM 1244 CA LYS A 996 9.711 1.656 -11.939 1.00 0.00 C ATOM 1245 C LYS A 996 9.346 1.623 -10.458 1.00 0.00 C ATOM 1246 O LYS A 996 9.650 0.660 -9.755 1.00 0.00 O ATOM 1247 CB LYS A 996 8.636 0.936 -12.756 1.00 0.00 C ATOM 1248 CG LYS A 996 8.689 1.250 -14.241 1.00 0.00 C ATOM 1249 CD LYS A 996 7.685 0.420 -15.023 1.00 0.00 C ATOM 1250 CE LYS A 996 8.242 -0.953 -15.364 1.00 0.00 C ATOM 1251 NZ LYS A 996 7.163 -1.968 -15.516 1.00 0.00 N ATOM 0 H LYS A 996 10.980 0.050 -12.395 1.00 0.00 H new ATOM 0 HA LYS A 996 9.765 2.697 -12.259 1.00 0.00 H new ATOM 0 HB2 LYS A 996 8.745 -0.140 -12.616 1.00 0.00 H new ATOM 0 HB3 LYS A 996 7.654 1.210 -12.370 1.00 0.00 H new ATOM 0 HG2 LYS A 996 8.486 2.310 -14.397 1.00 0.00 H new ATOM 0 HG3 LYS A 996 9.693 1.058 -14.619 1.00 0.00 H new ATOM 0 HD2 LYS A 996 6.771 0.308 -14.440 1.00 0.00 H new ATOM 0 HD3 LYS A 996 7.416 0.943 -15.941 1.00 0.00 H new ATOM 0 HE2 LYS A 996 8.816 -0.892 -16.288 1.00 0.00 H new ATOM 0 HE3 LYS A 996 8.931 -1.270 -14.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 996 7.584 -2.890 -15.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 996 6.631 -2.045 -14.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 996 6.520 -1.679 -16.280 1.00 0.00 H new ATOM 1265 N VAL A 997 8.691 2.681 -9.991 1.00 0.00 N ATOM 1266 CA VAL A 997 8.282 2.772 -8.594 1.00 0.00 C ATOM 1267 C VAL A 997 6.803 2.440 -8.432 1.00 0.00 C ATOM 1268 O VAL A 997 6.003 2.657 -9.343 1.00 0.00 O ATOM 1269 CB VAL A 997 8.547 4.176 -8.021 1.00 0.00 C ATOM 1270 CG1 VAL A 997 10.011 4.328 -7.636 1.00 0.00 C ATOM 1271 CG2 VAL A 997 8.138 5.246 -9.023 1.00 0.00 C ATOM 0 H VAL A 997 8.432 3.487 -10.560 1.00 0.00 H new ATOM 0 HA VAL A 997 8.878 2.045 -8.042 1.00 0.00 H new ATOM 0 HB VAL A 997 7.944 4.302 -7.122 1.00 0.00 H new ATOM 0 HG11 VAL A 997 10.179 5.327 -7.233 1.00 0.00 H new ATOM 0 HG12 VAL A 997 10.268 3.584 -6.882 1.00 0.00 H new ATOM 0 HG13 VAL A 997 10.636 4.182 -8.517 1.00 0.00 H new ATOM 0 HG21 VAL A 997 8.332 6.232 -8.602 1.00 0.00 H new ATOM 0 HG22 VAL A 997 8.713 5.124 -9.941 1.00 0.00 H new ATOM 0 HG23 VAL A 997 7.075 5.149 -9.245 1.00 0.00 H new ATOM 1281 N LYS A 998 6.444 1.913 -7.266 1.00 0.00 N ATOM 1282 CA LYS A 998 5.060 1.553 -6.982 1.00 0.00 C ATOM 1283 C LYS A 998 4.495 2.410 -5.854 1.00 0.00 C ATOM 1284 O LYS A 998 5.065 2.472 -4.763 1.00 0.00 O ATOM 1285 CB LYS A 998 4.964 0.071 -6.609 1.00 0.00 C ATOM 1286 CG LYS A 998 3.556 -0.377 -6.258 1.00 0.00 C ATOM 1287 CD LYS A 998 2.606 -0.199 -7.430 1.00 0.00 C ATOM 1288 CE LYS A 998 1.163 -0.452 -7.021 1.00 0.00 C ATOM 1289 NZ LYS A 998 0.961 -1.842 -6.528 1.00 0.00 N ATOM 0 H LYS A 998 7.093 1.726 -6.502 1.00 0.00 H new ATOM 0 HA LYS A 998 4.471 1.734 -7.881 1.00 0.00 H new ATOM 0 HB2 LYS A 998 5.330 -0.529 -7.442 1.00 0.00 H new ATOM 0 HB3 LYS A 998 5.621 -0.125 -5.761 1.00 0.00 H new ATOM 0 HG2 LYS A 998 3.571 -1.424 -5.956 1.00 0.00 H new ATOM 0 HG3 LYS A 998 3.193 0.195 -5.404 1.00 0.00 H new ATOM 0 HD2 LYS A 998 2.701 0.812 -7.827 1.00 0.00 H new ATOM 0 HD3 LYS A 998 2.883 -0.883 -8.232 1.00 0.00 H new ATOM 0 HE2 LYS A 998 0.877 0.255 -6.242 1.00 0.00 H new ATOM 0 HE3 LYS A 998 0.507 -0.270 -7.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 998 -0.053 -2.011 -6.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 998 1.320 -2.516 -7.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 998 1.475 -1.971 -5.633 1.00 0.00 H new ATOM 1303 N LEU A 999 3.373 3.067 -6.122 1.00 0.00 N ATOM 1304 CA LEU A 999 2.729 3.920 -5.128 1.00 0.00 C ATOM 1305 C LEU A 999 1.409 3.313 -4.663 1.00 0.00 C ATOM 1306 O LEU A 999 0.565 2.938 -5.477 1.00 0.00 O ATOM 1307 CB LEU A 999 2.487 5.316 -5.705 1.00 0.00 C ATOM 1308 CG LEU A 999 3.737 6.113 -6.081 1.00 0.00 C ATOM 1309 CD1 LEU A 999 3.373 7.282 -6.982 1.00 0.00 C ATOM 1310 CD2 LEU A 999 4.453 6.603 -4.831 1.00 0.00 C ATOM 0 H LEU A 999 2.889 3.026 -7.019 1.00 0.00 H new ATOM 0 HA LEU A 999 3.394 4.000 -4.268 1.00 0.00 H new ATOM 0 HB2 LEU A 999 1.863 5.217 -6.593 1.00 0.00 H new ATOM 0 HB3 LEU A 999 1.917 5.894 -4.978 1.00 0.00 H new ATOM 0 HG LEU A 999 4.413 5.456 -6.628 1.00 0.00 H new ATOM 0 HD11 LEU A 999 4.275 7.838 -7.239 1.00 0.00 H new ATOM 0 HD12 LEU A 999 2.905 6.908 -7.893 1.00 0.00 H new ATOM 0 HD13 LEU A 999 2.678 7.940 -6.461 1.00 0.00 H new ATOM 0 HD21 LEU A 999 5.340 7.168 -5.118 1.00 0.00 H new ATOM 0 HD22 LEU A 999 3.784 7.244 -4.256 1.00 0.00 H new ATOM 0 HD23 LEU A 999 4.748 5.748 -4.222 1.00 0.00 H new ATOM 1322 N VAL A1000 1.237 3.222 -3.348 1.00 0.00 N ATOM 1323 CA VAL A1000 0.018 2.665 -2.774 1.00 0.00 C ATOM 1324 C VAL A1000 -0.530 3.563 -1.670 1.00 0.00 C ATOM 1325 O VAL A1000 0.225 4.095 -0.856 1.00 0.00 O ATOM 1326 CB VAL A1000 0.261 1.256 -2.201 1.00 0.00 C ATOM 1327 CG1 VAL A1000 -1.027 0.681 -1.633 1.00 0.00 C ATOM 1328 CG2 VAL A1000 0.838 0.339 -3.269 1.00 0.00 C ATOM 0 H VAL A1000 1.926 3.527 -2.661 1.00 0.00 H new ATOM 0 HA VAL A1000 -0.711 2.600 -3.581 1.00 0.00 H new ATOM 0 HB VAL A1000 0.985 1.333 -1.390 1.00 0.00 H new ATOM 0 HG11 VAL A1000 -0.836 -0.315 -1.233 1.00 0.00 H new ATOM 0 HG12 VAL A1000 -1.394 1.328 -0.836 1.00 0.00 H new ATOM 0 HG13 VAL A1000 -1.776 0.617 -2.422 1.00 0.00 H new ATOM 0 HG21 VAL A1000 1.003 -0.652 -2.847 1.00 0.00 H new ATOM 0 HG22 VAL A1000 0.139 0.266 -4.102 1.00 0.00 H new ATOM 0 HG23 VAL A1000 1.785 0.745 -3.624 1.00 0.00 H new ATOM 1338 N LEU A1001 -1.848 3.726 -1.649 1.00 0.00 N ATOM 1339 CA LEU A1001 -2.499 4.560 -0.644 1.00 0.00 C ATOM 1340 C LEU A1001 -2.518 3.862 0.713 1.00 0.00 C ATOM 1341 O LEU A1001 -2.705 2.649 0.796 1.00 0.00 O ATOM 1342 CB LEU A1001 -3.927 4.894 -1.078 1.00 0.00 C ATOM 1343 CG LEU A1001 -4.083 6.106 -1.998 1.00 0.00 C ATOM 1344 CD1 LEU A1001 -5.503 6.190 -2.535 1.00 0.00 C ATOM 1345 CD2 LEU A1001 -3.712 7.385 -1.261 1.00 0.00 C ATOM 0 H LEU A1001 -2.487 3.292 -2.316 1.00 0.00 H new ATOM 0 HA LEU A1001 -1.929 5.484 -0.549 1.00 0.00 H new ATOM 0 HB2 LEU A1001 -4.345 4.023 -1.583 1.00 0.00 H new ATOM 0 HB3 LEU A1001 -4.527 5.062 -0.184 1.00 0.00 H new ATOM 0 HG LEU A1001 -3.405 5.987 -2.843 1.00 0.00 H new ATOM 0 HD11 LEU A1001 -5.595 7.058 -3.187 1.00 0.00 H new ATOM 0 HD12 LEU A1001 -5.733 5.286 -3.100 1.00 0.00 H new ATOM 0 HD13 LEU A1001 -6.201 6.286 -1.704 1.00 0.00 H new ATOM 0 HD21 LEU A1001 -3.829 8.237 -1.930 1.00 0.00 H new ATOM 0 HD22 LEU A1001 -4.365 7.510 -0.397 1.00 0.00 H new ATOM 0 HD23 LEU A1001 -2.676 7.325 -0.927 1.00 0.00 H new ATOM 1357 N GLY A1002 -2.326 4.639 1.775 1.00 0.00 N ATOM 1358 CA GLY A1002 -2.327 4.079 3.113 1.00 0.00 C ATOM 1359 C GLY A1002 -3.701 3.601 3.541 1.00 0.00 C ATOM 1360 O GLY A1002 -3.964 2.399 3.575 1.00 0.00 O ATOM 0 H GLY A1002 -2.170 5.646 1.732 1.00 0.00 H new ATOM 0 HA2 GLY A1002 -1.626 3.245 3.155 1.00 0.00 H new ATOM 0 HA3 GLY A1002 -1.971 4.830 3.818 1.00 0.00 H new ATOM 1364 N SER A1003 -4.578 4.544 3.870 1.00 0.00 N ATOM 1365 CA SER A1003 -5.930 4.212 4.303 1.00 0.00 C ATOM 1366 C SER A1003 -6.705 3.523 3.183 1.00 0.00 C ATOM 1367 O SER A1003 -6.435 3.737 2.003 1.00 0.00 O ATOM 1368 CB SER A1003 -6.670 5.474 4.748 1.00 0.00 C ATOM 1369 OG SER A1003 -6.640 6.467 3.737 1.00 0.00 O ATOM 0 H SER A1003 -4.376 5.544 3.845 1.00 0.00 H new ATOM 0 HA SER A1003 -5.857 3.526 5.147 1.00 0.00 H new ATOM 0 HB2 SER A1003 -7.704 5.227 4.989 1.00 0.00 H new ATOM 0 HB3 SER A1003 -6.215 5.864 5.659 1.00 0.00 H new ATOM 0 HG SER A1003 -7.121 7.263 4.046 1.00 0.00 H new ATOM 1375 N GLY A1004 -7.672 2.693 3.565 1.00 0.00 N ATOM 1376 CA GLY A1004 -8.472 1.984 2.583 1.00 0.00 C ATOM 1377 C GLY A1004 -8.260 0.484 2.636 1.00 0.00 C ATOM 1378 O GLY A1004 -7.502 -0.028 3.460 1.00 0.00 O ATOM 0 H GLY A1004 -7.915 2.499 4.536 1.00 0.00 H new ATOM 0 HA2 GLY A1004 -9.526 2.205 2.750 1.00 0.00 H new ATOM 0 HA3 GLY A1004 -8.224 2.348 1.586 1.00 0.00 H new ATOM 1382 N PRO A1005 -8.942 -0.246 1.741 1.00 0.00 N ATOM 1383 CA PRO A1005 -9.848 0.354 0.756 1.00 0.00 C ATOM 1384 C PRO A1005 -11.108 0.924 1.399 1.00 0.00 C ATOM 1385 O PRO A1005 -11.918 1.568 0.733 1.00 0.00 O ATOM 1386 CB PRO A1005 -10.199 -0.819 -0.162 1.00 0.00 C ATOM 1387 CG PRO A1005 -10.013 -2.032 0.684 1.00 0.00 C ATOM 1388 CD PRO A1005 -8.883 -1.712 1.623 1.00 0.00 C ATOM 0 HA PRO A1005 -9.388 1.196 0.238 1.00 0.00 H new ATOM 0 HB2 PRO A1005 -11.224 -0.744 -0.526 1.00 0.00 H new ATOM 0 HB3 PRO A1005 -9.551 -0.844 -1.038 1.00 0.00 H new ATOM 0 HG2 PRO A1005 -10.924 -2.267 1.235 1.00 0.00 H new ATOM 0 HG3 PRO A1005 -9.777 -2.902 0.072 1.00 0.00 H new ATOM 0 HD2 PRO A1005 -9.014 -2.198 2.590 1.00 0.00 H new ATOM 0 HD3 PRO A1005 -7.924 -2.045 1.226 1.00 0.00 H new ATOM 1396 N SER A1006 -11.266 0.682 2.696 1.00 0.00 N ATOM 1397 CA SER A1006 -12.430 1.168 3.428 1.00 0.00 C ATOM 1398 C SER A1006 -12.299 2.658 3.728 1.00 0.00 C ATOM 1399 O SER A1006 -11.311 3.099 4.316 1.00 0.00 O ATOM 1400 CB SER A1006 -12.603 0.387 4.731 1.00 0.00 C ATOM 1401 OG SER A1006 -13.864 0.652 5.321 1.00 0.00 O ATOM 0 H SER A1006 -10.603 0.152 3.262 1.00 0.00 H new ATOM 0 HA SER A1006 -13.310 1.017 2.803 1.00 0.00 H new ATOM 0 HB2 SER A1006 -12.507 -0.681 4.534 1.00 0.00 H new ATOM 0 HB3 SER A1006 -11.809 0.655 5.428 1.00 0.00 H new ATOM 0 HG SER A1006 -13.951 0.139 6.152 1.00 0.00 H new ATOM 1407 N SER A1007 -13.302 3.429 3.321 1.00 0.00 N ATOM 1408 CA SER A1007 -13.298 4.870 3.542 1.00 0.00 C ATOM 1409 C SER A1007 -14.135 5.234 4.765 1.00 0.00 C ATOM 1410 O SER A1007 -15.318 4.906 4.842 1.00 0.00 O ATOM 1411 CB SER A1007 -13.834 5.599 2.308 1.00 0.00 C ATOM 1412 OG SER A1007 -12.802 5.833 1.366 1.00 0.00 O ATOM 0 H SER A1007 -14.128 3.079 2.836 1.00 0.00 H new ATOM 0 HA SER A1007 -12.269 5.182 3.721 1.00 0.00 H new ATOM 0 HB2 SER A1007 -14.624 5.007 1.847 1.00 0.00 H new ATOM 0 HB3 SER A1007 -14.280 6.548 2.607 1.00 0.00 H new ATOM 0 HG SER A1007 -13.170 6.298 0.586 1.00 0.00 H new ATOM 1418 N GLY A1008 -13.510 5.915 5.721 1.00 0.00 N ATOM 1419 CA GLY A1008 -14.211 6.313 6.928 1.00 0.00 C ATOM 1420 C GLY A1008 -15.198 7.436 6.682 1.00 0.00 C ATOM 1421 O GLY A1008 -15.678 8.067 7.623 1.00 0.00 O ATOM 0 H GLY A1008 -12.531 6.198 5.681 1.00 0.00 H new ATOM 0 HA2 GLY A1008 -14.740 5.452 7.338 1.00 0.00 H new ATOM 0 HA3 GLY A1008 -13.486 6.629 7.678 1.00 0.00 H new TER 1425 GLY A1008