USER MOD reduce.3.24.130724 H: found=0, std=0, add=763, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 757 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 62 GLN : amide:sc= -4.84! C(o=-6.1!,f=-7.9!) USER MOD Set 1.2: A 63 ASN : amide:sc= -1.22! X(o=-6.1!,f=-6.2) USER MOD Single : A 1 CYS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 170:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.428 USER MOD Single : A 5 SER OG : rot 180:sc= -0.403 USER MOD Single : A 20 THR OG1 : rot 75:sc= 0.438 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot -160:sc= -0.0793 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -85:sc= 0.456 USER MOD Single : A 52 LYS NZ :NH3+ 152:sc= -0.89 (180deg=-1.77!) USER MOD Single : A 53 THR OG1 : rot 74:sc= 0.821 USER MOD Single : B 1 CYS N :NH3+ 145:sc= 0.926 (180deg=0.375) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 THR OG1 : rot 2:sc= 0.424! USER MOD Single : B 5 SER OG : rot 180:sc= -1.15 USER MOD Single : B 20 THR OG1 : rot 79:sc= 1.08 USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 1 73.540 22.741 -20.954 1.00 0.00 N ATOM 2 CA CYS A 1 72.468 22.260 -20.037 1.00 0.00 C ATOM 3 C CYS A 1 71.958 20.907 -20.520 1.00 0.00 C ATOM 4 O CYS A 1 70.787 20.765 -20.874 1.00 0.00 O ATOM 5 CB CYS A 1 71.322 23.276 -20.020 1.00 0.00 C ATOM 6 SG CYS A 1 70.072 22.755 -18.819 1.00 0.00 S ATOM 0 H1 CYS A 1 73.889 23.664 -20.626 1.00 0.00 H new ATOM 0 H2 CYS A 1 74.323 22.057 -20.961 1.00 0.00 H new ATOM 0 H3 CYS A 1 73.156 22.838 -21.916 1.00 0.00 H new ATOM 0 HA CYS A 1 72.866 22.152 -19.028 1.00 0.00 H new ATOM 0 HB2 CYS A 1 71.702 24.264 -19.760 1.00 0.00 H new ATOM 0 HB3 CYS A 1 70.878 23.356 -21.012 1.00 0.00 H new ATOM 10 N SER A 2 72.844 19.915 -20.532 1.00 0.00 N ATOM 11 CA SER A 2 72.471 18.576 -20.974 1.00 0.00 C ATOM 12 C SER A 2 73.477 17.546 -20.469 1.00 0.00 C ATOM 13 O SER A 2 74.678 17.671 -20.704 1.00 0.00 O ATOM 14 CB SER A 2 72.410 18.528 -22.500 1.00 0.00 C ATOM 15 OG SER A 2 72.156 17.193 -22.919 1.00 0.00 O ATOM 0 H SER A 2 73.817 20.012 -20.243 1.00 0.00 H new ATOM 0 HA SER A 2 71.489 18.339 -20.565 1.00 0.00 H new ATOM 0 HB2 SER A 2 71.626 19.191 -22.865 1.00 0.00 H new ATOM 0 HB3 SER A 2 73.350 18.882 -22.924 1.00 0.00 H new ATOM 0 HG SER A 2 71.957 17.184 -23.878 1.00 0.00 H new ATOM 21 N THR A 3 72.977 16.528 -19.773 1.00 0.00 N ATOM 22 CA THR A 3 73.839 15.477 -19.237 1.00 0.00 C ATOM 23 C THR A 3 74.124 14.421 -20.301 1.00 0.00 C ATOM 24 O THR A 3 73.424 14.345 -21.310 1.00 0.00 O ATOM 25 CB THR A 3 73.164 14.818 -18.030 1.00 0.00 C ATOM 26 OG1 THR A 3 72.173 13.908 -18.484 1.00 0.00 O ATOM 27 CG2 THR A 3 72.514 15.892 -17.157 1.00 0.00 C ATOM 0 H THR A 3 71.985 16.408 -19.568 1.00 0.00 H new ATOM 0 HA THR A 3 74.782 15.927 -18.928 1.00 0.00 H new ATOM 0 HB THR A 3 73.909 14.281 -17.444 1.00 0.00 H new ATOM 0 HG1 THR A 3 71.741 13.484 -17.713 1.00 0.00 H new ATOM 0 HG21 THR A 3 72.034 15.422 -16.299 1.00 0.00 H new ATOM 0 HG22 THR A 3 73.277 16.589 -16.810 1.00 0.00 H new ATOM 0 HG23 THR A 3 71.767 16.432 -17.740 1.00 0.00 H new ATOM 35 N VAL A 4 75.156 13.607 -20.060 1.00 0.00 N ATOM 36 CA VAL A 4 75.545 12.543 -20.993 1.00 0.00 C ATOM 37 C VAL A 4 75.296 12.958 -22.439 1.00 0.00 C ATOM 38 O VAL A 4 74.953 12.136 -23.288 1.00 0.00 O ATOM 39 CB VAL A 4 74.780 11.256 -20.671 1.00 0.00 C ATOM 40 CG1 VAL A 4 75.183 10.767 -19.277 1.00 0.00 C ATOM 41 CG2 VAL A 4 73.271 11.523 -20.697 1.00 0.00 C ATOM 0 H VAL A 4 75.739 13.664 -19.225 1.00 0.00 H new ATOM 0 HA VAL A 4 76.613 12.362 -20.875 1.00 0.00 H new ATOM 0 HB VAL A 4 75.022 10.498 -21.416 1.00 0.00 H new ATOM 0 HG11 VAL A 4 74.641 9.851 -19.042 1.00 0.00 H new ATOM 0 HG12 VAL A 4 76.255 10.570 -19.256 1.00 0.00 H new ATOM 0 HG13 VAL A 4 74.940 11.531 -18.539 1.00 0.00 H new ATOM 0 HG21 VAL A 4 72.735 10.602 -20.467 1.00 0.00 H new ATOM 0 HG22 VAL A 4 73.023 12.282 -19.955 1.00 0.00 H new ATOM 0 HG23 VAL A 4 72.981 11.874 -21.687 1.00 0.00 H new ATOM 51 N SER A 5 75.488 14.245 -22.705 1.00 0.00 N ATOM 52 CA SER A 5 75.304 14.788 -24.045 1.00 0.00 C ATOM 53 C SER A 5 76.579 14.605 -24.873 1.00 0.00 C ATOM 54 O SER A 5 76.516 14.230 -26.043 1.00 0.00 O ATOM 55 CB SER A 5 74.935 16.282 -23.955 1.00 0.00 C ATOM 56 OG SER A 5 76.012 17.078 -24.437 1.00 0.00 O ATOM 0 H SER A 5 75.772 14.933 -22.008 1.00 0.00 H new ATOM 0 HA SER A 5 74.493 14.251 -24.537 1.00 0.00 H new ATOM 0 HB2 SER A 5 74.036 16.479 -24.539 1.00 0.00 H new ATOM 0 HB3 SER A 5 74.709 16.548 -22.922 1.00 0.00 H new ATOM 0 HG SER A 5 75.770 18.026 -24.378 1.00 0.00 H new ATOM 62 N PRO A 6 77.726 14.861 -24.290 1.00 0.00 N ATOM 63 CA PRO A 6 79.039 14.719 -24.991 1.00 0.00 C ATOM 64 C PRO A 6 79.157 13.414 -25.763 1.00 0.00 C ATOM 65 O PRO A 6 79.623 13.410 -26.901 1.00 0.00 O ATOM 66 CB PRO A 6 80.049 14.804 -23.846 1.00 0.00 C ATOM 67 CG PRO A 6 79.389 15.716 -22.871 1.00 0.00 C ATOM 68 CD PRO A 6 77.918 15.318 -22.898 1.00 0.00 C ATOM 0 HA PRO A 6 79.190 15.481 -25.756 1.00 0.00 H new ATOM 0 HB2 PRO A 6 80.246 13.824 -23.410 1.00 0.00 H new ATOM 0 HB3 PRO A 6 81.006 15.201 -24.183 1.00 0.00 H new ATOM 0 HG2 PRO A 6 79.812 15.600 -21.873 1.00 0.00 H new ATOM 0 HG3 PRO A 6 79.521 16.760 -23.154 1.00 0.00 H new ATOM 0 HD2 PRO A 6 77.700 14.528 -22.180 1.00 0.00 H new ATOM 0 HD3 PRO A 6 77.267 16.158 -22.655 1.00 0.00 H new ATOM 76 N GLY A 7 78.739 12.313 -25.153 1.00 0.00 N ATOM 77 CA GLY A 7 78.837 11.021 -25.834 1.00 0.00 C ATOM 78 C GLY A 7 80.301 10.621 -25.923 1.00 0.00 C ATOM 79 O GLY A 7 80.683 9.505 -25.561 1.00 0.00 O ATOM 0 H GLY A 7 78.339 12.282 -24.215 1.00 0.00 H new ATOM 0 HA2 GLY A 7 78.272 10.264 -25.290 1.00 0.00 H new ATOM 0 HA3 GLY A 7 78.403 11.087 -26.832 1.00 0.00 H new ATOM 83 N VAL A 8 81.133 11.561 -26.369 1.00 0.00 N ATOM 84 CA VAL A 8 82.558 11.309 -26.454 1.00 0.00 C ATOM 85 C VAL A 8 83.025 10.839 -25.091 1.00 0.00 C ATOM 86 O VAL A 8 83.874 9.949 -24.977 1.00 0.00 O ATOM 87 CB VAL A 8 83.303 12.584 -26.861 1.00 0.00 C ATOM 88 CG1 VAL A 8 84.812 12.363 -26.734 1.00 0.00 C ATOM 89 CG2 VAL A 8 82.964 12.926 -28.313 1.00 0.00 C ATOM 0 H VAL A 8 80.843 12.491 -26.672 1.00 0.00 H new ATOM 0 HA VAL A 8 82.764 10.550 -27.209 1.00 0.00 H new ATOM 0 HB VAL A 8 83.001 13.403 -26.208 1.00 0.00 H new ATOM 0 HG11 VAL A 8 85.339 13.272 -27.024 1.00 0.00 H new ATOM 0 HG12 VAL A 8 85.058 12.115 -25.701 1.00 0.00 H new ATOM 0 HG13 VAL A 8 85.116 11.544 -27.386 1.00 0.00 H new ATOM 0 HG21 VAL A 8 83.493 13.833 -28.606 1.00 0.00 H new ATOM 0 HG22 VAL A 8 83.268 12.104 -28.961 1.00 0.00 H new ATOM 0 HG23 VAL A 8 81.890 13.085 -28.408 1.00 0.00 H new ATOM 99 N LEU A 9 82.431 11.415 -24.046 1.00 0.00 N ATOM 100 CA LEU A 9 82.784 10.995 -22.700 1.00 0.00 C ATOM 101 C LEU A 9 82.581 9.477 -22.606 1.00 0.00 C ATOM 102 O LEU A 9 83.413 8.747 -22.052 1.00 0.00 O ATOM 103 CB LEU A 9 81.929 11.717 -21.652 1.00 0.00 C ATOM 104 CG LEU A 9 82.406 13.172 -21.470 1.00 0.00 C ATOM 105 CD1 LEU A 9 81.454 13.889 -20.507 1.00 0.00 C ATOM 106 CD2 LEU A 9 83.841 13.212 -20.894 1.00 0.00 C ATOM 0 H LEU A 9 81.726 12.150 -24.105 1.00 0.00 H new ATOM 0 HA LEU A 9 83.824 11.251 -22.498 1.00 0.00 H new ATOM 0 HB2 LEU A 9 80.883 11.707 -21.959 1.00 0.00 H new ATOM 0 HB3 LEU A 9 81.987 11.188 -20.701 1.00 0.00 H new ATOM 0 HG LEU A 9 82.409 13.667 -22.441 1.00 0.00 H new ATOM 0 HD11 LEU A 9 81.782 14.919 -20.371 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.445 13.881 -20.919 1.00 0.00 H new ATOM 0 HD13 LEU A 9 81.457 13.377 -19.545 1.00 0.00 H new ATOM 0 HD21 LEU A 9 84.156 14.249 -20.774 1.00 0.00 H new ATOM 0 HD22 LEU A 9 83.858 12.713 -19.925 1.00 0.00 H new ATOM 0 HD23 LEU A 9 84.521 12.702 -21.576 1.00 0.00 H new ATOM 118 N ALA A 10 81.490 8.993 -23.203 1.00 0.00 N ATOM 119 CA ALA A 10 81.232 7.563 -23.220 1.00 0.00 C ATOM 120 C ALA A 10 82.415 6.885 -23.891 1.00 0.00 C ATOM 121 O ALA A 10 82.869 5.815 -23.473 1.00 0.00 O ATOM 122 CB ALA A 10 79.939 7.261 -23.986 1.00 0.00 C ATOM 0 H ALA A 10 80.786 9.563 -23.672 1.00 0.00 H new ATOM 0 HA ALA A 10 81.109 7.190 -22.203 1.00 0.00 H new ATOM 0 HB1 ALA A 10 79.761 6.186 -23.989 1.00 0.00 H new ATOM 0 HB2 ALA A 10 79.103 7.766 -23.502 1.00 0.00 H new ATOM 0 HB3 ALA A 10 80.033 7.616 -25.012 1.00 0.00 H new ATOM 128 N GLY A 11 82.934 7.548 -24.921 1.00 0.00 N ATOM 129 CA GLY A 11 84.094 7.041 -25.635 1.00 0.00 C ATOM 130 C GLY A 11 85.269 6.922 -24.673 1.00 0.00 C ATOM 131 O GLY A 11 86.151 6.084 -24.851 1.00 0.00 O ATOM 0 H GLY A 11 82.570 8.432 -25.276 1.00 0.00 H new ATOM 0 HA2 GLY A 11 83.869 6.069 -26.073 1.00 0.00 H new ATOM 0 HA3 GLY A 11 84.349 7.709 -26.457 1.00 0.00 H new ATOM 135 N ILE A 12 85.261 7.769 -23.642 1.00 0.00 N ATOM 136 CA ILE A 12 86.322 7.754 -22.632 1.00 0.00 C ATOM 137 C ILE A 12 86.224 6.456 -21.838 1.00 0.00 C ATOM 138 O ILE A 12 87.235 5.821 -21.534 1.00 0.00 O ATOM 139 CB ILE A 12 86.220 9.028 -21.717 1.00 0.00 C ATOM 140 CG1 ILE A 12 87.602 9.717 -21.572 1.00 0.00 C ATOM 141 CG2 ILE A 12 85.679 8.705 -20.295 1.00 0.00 C ATOM 142 CD1 ILE A 12 87.414 11.197 -21.217 1.00 0.00 C ATOM 0 H ILE A 12 84.537 8.470 -23.484 1.00 0.00 H new ATOM 0 HA ILE A 12 87.302 7.789 -23.107 1.00 0.00 H new ATOM 0 HB ILE A 12 85.514 9.695 -22.211 1.00 0.00 H new ATOM 0 HG12 ILE A 12 88.186 9.220 -20.798 1.00 0.00 H new ATOM 0 HG13 ILE A 12 88.163 9.626 -22.502 1.00 0.00 H new ATOM 0 HG21 ILE A 12 85.630 9.622 -19.707 1.00 0.00 H new ATOM 0 HG22 ILE A 12 84.682 8.271 -20.375 1.00 0.00 H new ATOM 0 HG23 ILE A 12 86.345 7.995 -19.805 1.00 0.00 H new ATOM 0 HD11 ILE A 12 88.389 11.674 -21.117 1.00 0.00 H new ATOM 0 HD12 ILE A 12 86.848 11.691 -22.006 1.00 0.00 H new ATOM 0 HD13 ILE A 12 86.872 11.279 -20.275 1.00 0.00 H new ATOM 154 N VAL A 13 84.997 6.062 -21.522 1.00 0.00 N ATOM 155 CA VAL A 13 84.782 4.825 -20.780 1.00 0.00 C ATOM 156 C VAL A 13 85.342 3.650 -21.573 1.00 0.00 C ATOM 157 O VAL A 13 86.157 2.862 -21.073 1.00 0.00 O ATOM 158 CB VAL A 13 83.285 4.614 -20.543 1.00 0.00 C ATOM 159 CG1 VAL A 13 83.067 3.322 -19.753 1.00 0.00 C ATOM 160 CG2 VAL A 13 82.719 5.795 -19.752 1.00 0.00 C ATOM 0 H VAL A 13 84.147 6.571 -21.763 1.00 0.00 H new ATOM 0 HA VAL A 13 85.292 4.892 -19.819 1.00 0.00 H new ATOM 0 HB VAL A 13 82.775 4.543 -21.504 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.000 3.174 -19.585 1.00 0.00 H new ATOM 0 HG12 VAL A 13 83.466 2.479 -20.317 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.579 3.392 -18.793 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.653 5.643 -19.584 1.00 0.00 H new ATOM 0 HG22 VAL A 13 83.231 5.869 -18.792 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.870 6.716 -20.315 1.00 0.00 H new ATOM 170 N VAL A 14 84.910 3.549 -22.825 1.00 0.00 N ATOM 171 CA VAL A 14 85.380 2.481 -23.693 1.00 0.00 C ATOM 172 C VAL A 14 86.897 2.548 -23.826 1.00 0.00 C ATOM 173 O VAL A 14 87.568 1.523 -23.931 1.00 0.00 O ATOM 174 CB VAL A 14 84.738 2.606 -25.076 1.00 0.00 C ATOM 175 CG1 VAL A 14 85.095 1.380 -25.920 1.00 0.00 C ATOM 176 CG2 VAL A 14 83.218 2.693 -24.923 1.00 0.00 C ATOM 0 H VAL A 14 84.242 4.188 -23.256 1.00 0.00 H new ATOM 0 HA VAL A 14 85.099 1.524 -23.254 1.00 0.00 H new ATOM 0 HB VAL A 14 85.109 3.505 -25.569 1.00 0.00 H new ATOM 0 HG11 VAL A 14 84.637 1.470 -26.905 1.00 0.00 H new ATOM 0 HG12 VAL A 14 86.178 1.315 -26.028 1.00 0.00 H new ATOM 0 HG13 VAL A 14 84.725 0.480 -25.429 1.00 0.00 H new ATOM 0 HG21 VAL A 14 82.758 2.782 -25.907 1.00 0.00 H new ATOM 0 HG22 VAL A 14 82.850 1.793 -24.430 1.00 0.00 H new ATOM 0 HG23 VAL A 14 82.962 3.566 -24.322 1.00 0.00 H new ATOM 186 N GLY A 15 87.430 3.767 -23.822 1.00 0.00 N ATOM 187 CA GLY A 15 88.867 3.969 -23.944 1.00 0.00 C ATOM 188 C GLY A 15 89.607 3.403 -22.738 1.00 0.00 C ATOM 189 O GLY A 15 90.722 2.895 -22.860 1.00 0.00 O ATOM 0 H GLY A 15 86.888 4.627 -23.736 1.00 0.00 H new ATOM 0 HA2 GLY A 15 89.228 3.490 -24.854 1.00 0.00 H new ATOM 0 HA3 GLY A 15 89.081 5.034 -24.038 1.00 0.00 H new ATOM 193 N ASP A 16 88.985 3.497 -21.571 1.00 0.00 N ATOM 194 CA ASP A 16 89.603 2.994 -20.352 1.00 0.00 C ATOM 195 C ASP A 16 89.673 1.473 -20.368 1.00 0.00 C ATOM 196 O ASP A 16 90.694 0.886 -20.010 1.00 0.00 O ATOM 197 CB ASP A 16 88.806 3.456 -19.132 1.00 0.00 C ATOM 198 CG ASP A 16 89.604 3.190 -17.859 1.00 0.00 C ATOM 199 OD1 ASP A 16 90.520 2.388 -17.914 1.00 0.00 O ATOM 200 OD2 ASP A 16 89.285 3.793 -16.848 1.00 0.00 O ATOM 0 H ASP A 16 88.062 3.912 -21.442 1.00 0.00 H new ATOM 0 HA ASP A 16 90.617 3.390 -20.296 1.00 0.00 H new ATOM 0 HB2 ASP A 16 88.581 4.519 -19.215 1.00 0.00 H new ATOM 0 HB3 ASP A 16 87.852 2.931 -19.090 1.00 0.00 H new ATOM 205 N LEU A 17 88.578 0.836 -20.770 1.00 0.00 N ATOM 206 CA LEU A 17 88.538 -0.625 -20.805 1.00 0.00 C ATOM 207 C LEU A 17 89.493 -1.186 -21.865 1.00 0.00 C ATOM 208 O LEU A 17 90.315 -2.069 -21.572 1.00 0.00 O ATOM 209 CB LEU A 17 87.108 -1.096 -21.091 1.00 0.00 C ATOM 210 CG LEU A 17 87.010 -2.625 -20.962 1.00 0.00 C ATOM 211 CD1 LEU A 17 87.268 -3.063 -19.506 1.00 0.00 C ATOM 212 CD2 LEU A 17 85.607 -3.067 -21.395 1.00 0.00 C ATOM 0 H LEU A 17 87.719 1.297 -21.072 1.00 0.00 H new ATOM 0 HA LEU A 17 88.860 -0.996 -19.832 1.00 0.00 H new ATOM 0 HB2 LEU A 17 86.416 -0.621 -20.395 1.00 0.00 H new ATOM 0 HB3 LEU A 17 86.812 -0.790 -22.094 1.00 0.00 H new ATOM 0 HG LEU A 17 87.763 -3.090 -21.598 1.00 0.00 H new ATOM 0 HD11 LEU A 17 87.194 -4.148 -19.434 1.00 0.00 H new ATOM 0 HD12 LEU A 17 88.266 -2.746 -19.202 1.00 0.00 H new ATOM 0 HD13 LEU A 17 86.527 -2.605 -18.851 1.00 0.00 H new ATOM 0 HD21 LEU A 17 85.524 -4.150 -21.308 1.00 0.00 H new ATOM 0 HD22 LEU A 17 84.863 -2.594 -20.755 1.00 0.00 H new ATOM 0 HD23 LEU A 17 85.436 -2.772 -22.430 1.00 0.00 H new ATOM 224 N VAL A 18 89.390 -0.679 -23.094 1.00 0.00 N ATOM 225 CA VAL A 18 90.252 -1.160 -24.165 1.00 0.00 C ATOM 226 C VAL A 18 91.716 -0.932 -23.809 1.00 0.00 C ATOM 227 O VAL A 18 92.573 -1.738 -24.155 1.00 0.00 O ATOM 228 CB VAL A 18 89.928 -0.451 -25.481 1.00 0.00 C ATOM 229 CG1 VAL A 18 88.449 -0.661 -25.834 1.00 0.00 C ATOM 230 CG2 VAL A 18 90.221 1.039 -25.330 1.00 0.00 C ATOM 0 H VAL A 18 88.731 0.050 -23.366 1.00 0.00 H new ATOM 0 HA VAL A 18 90.074 -2.228 -24.288 1.00 0.00 H new ATOM 0 HB VAL A 18 90.542 -0.864 -26.281 1.00 0.00 H new ATOM 0 HG11 VAL A 18 88.223 -0.154 -26.772 1.00 0.00 H new ATOM 0 HG12 VAL A 18 88.248 -1.727 -25.940 1.00 0.00 H new ATOM 0 HG13 VAL A 18 87.824 -0.251 -25.041 1.00 0.00 H new ATOM 0 HG21 VAL A 18 89.992 1.551 -26.265 1.00 0.00 H new ATOM 0 HG22 VAL A 18 89.606 1.452 -24.530 1.00 0.00 H new ATOM 0 HG23 VAL A 18 91.274 1.180 -25.087 1.00 0.00 H new ATOM 240 N LEU A 19 92.003 0.169 -23.116 1.00 0.00 N ATOM 241 CA LEU A 19 93.380 0.463 -22.735 1.00 0.00 C ATOM 242 C LEU A 19 93.908 -0.599 -21.771 1.00 0.00 C ATOM 243 O LEU A 19 94.968 -1.182 -22.002 1.00 0.00 O ATOM 244 CB LEU A 19 93.467 1.847 -22.079 1.00 0.00 C ATOM 245 CG LEU A 19 94.933 2.219 -21.799 1.00 0.00 C ATOM 246 CD1 LEU A 19 95.706 2.397 -23.120 1.00 0.00 C ATOM 247 CD2 LEU A 19 94.969 3.528 -21.001 1.00 0.00 C ATOM 0 H LEU A 19 91.315 0.858 -22.813 1.00 0.00 H new ATOM 0 HA LEU A 19 93.993 0.456 -23.636 1.00 0.00 H new ATOM 0 HB2 LEU A 19 93.014 2.594 -22.731 1.00 0.00 H new ATOM 0 HB3 LEU A 19 92.900 1.851 -21.148 1.00 0.00 H new ATOM 0 HG LEU A 19 95.404 1.419 -21.228 1.00 0.00 H new ATOM 0 HD11 LEU A 19 96.741 2.660 -22.903 1.00 0.00 H new ATOM 0 HD12 LEU A 19 95.679 1.466 -23.686 1.00 0.00 H new ATOM 0 HD13 LEU A 19 95.245 3.191 -23.707 1.00 0.00 H new ATOM 0 HD21 LEU A 19 96.004 3.801 -20.797 1.00 0.00 H new ATOM 0 HD22 LEU A 19 94.492 4.320 -21.579 1.00 0.00 H new ATOM 0 HD23 LEU A 19 94.436 3.395 -20.059 1.00 0.00 H new ATOM 259 N THR A 20 93.173 -0.847 -20.689 1.00 0.00 N ATOM 260 CA THR A 20 93.596 -1.838 -19.708 1.00 0.00 C ATOM 261 C THR A 20 93.951 -3.165 -20.373 1.00 0.00 C ATOM 262 O THR A 20 95.001 -3.742 -20.089 1.00 0.00 O ATOM 263 CB THR A 20 92.480 -2.077 -18.686 1.00 0.00 C ATOM 264 OG1 THR A 20 91.995 -0.826 -18.222 1.00 0.00 O ATOM 265 CG2 THR A 20 93.015 -2.891 -17.495 1.00 0.00 C ATOM 0 H THR A 20 92.292 -0.380 -20.473 1.00 0.00 H new ATOM 0 HA THR A 20 94.483 -1.448 -19.209 1.00 0.00 H new ATOM 0 HB THR A 20 91.674 -2.635 -19.162 1.00 0.00 H new ATOM 0 HG1 THR A 20 91.433 -0.416 -18.913 1.00 0.00 H new ATOM 0 HG21 THR A 20 92.212 -3.054 -16.776 1.00 0.00 H new ATOM 0 HG22 THR A 20 93.386 -3.853 -17.849 1.00 0.00 H new ATOM 0 HG23 THR A 20 93.826 -2.344 -17.015 1.00 0.00 H new ATOM 273 N VAL A 21 93.065 -3.669 -21.229 1.00 0.00 N ATOM 274 CA VAL A 21 93.317 -4.958 -21.876 1.00 0.00 C ATOM 275 C VAL A 21 94.442 -4.882 -22.915 1.00 0.00 C ATOM 276 O VAL A 21 95.148 -5.865 -23.129 1.00 0.00 O ATOM 277 CB VAL A 21 92.038 -5.482 -22.531 1.00 0.00 C ATOM 278 CG1 VAL A 21 91.516 -4.447 -23.521 1.00 0.00 C ATOM 279 CG2 VAL A 21 92.336 -6.793 -23.266 1.00 0.00 C ATOM 0 H VAL A 21 92.187 -3.219 -21.487 1.00 0.00 H new ATOM 0 HA VAL A 21 93.640 -5.648 -21.096 1.00 0.00 H new ATOM 0 HB VAL A 21 91.285 -5.664 -21.764 1.00 0.00 H new ATOM 0 HG11 VAL A 21 90.604 -4.819 -23.989 1.00 0.00 H new ATOM 0 HG12 VAL A 21 91.301 -3.517 -22.995 1.00 0.00 H new ATOM 0 HG13 VAL A 21 92.269 -4.265 -24.288 1.00 0.00 H new ATOM 0 HG21 VAL A 21 91.423 -7.165 -23.732 1.00 0.00 H new ATOM 0 HG22 VAL A 21 93.089 -6.617 -24.034 1.00 0.00 H new ATOM 0 HG23 VAL A 21 92.708 -7.532 -22.556 1.00 0.00 H new ATOM 289 N LEU A 22 94.611 -3.733 -23.568 1.00 0.00 N ATOM 290 CA LEU A 22 95.664 -3.607 -24.581 1.00 0.00 C ATOM 291 C LEU A 22 97.047 -3.670 -23.930 1.00 0.00 C ATOM 292 O LEU A 22 97.885 -4.488 -24.310 1.00 0.00 O ATOM 293 CB LEU A 22 95.503 -2.283 -25.353 1.00 0.00 C ATOM 294 CG LEU A 22 96.124 -2.371 -26.765 1.00 0.00 C ATOM 295 CD1 LEU A 22 97.598 -2.785 -26.675 1.00 0.00 C ATOM 296 CD2 LEU A 22 95.348 -3.380 -27.642 1.00 0.00 C ATOM 0 H LEU A 22 94.049 -2.894 -23.421 1.00 0.00 H new ATOM 0 HA LEU A 22 95.571 -4.438 -25.280 1.00 0.00 H new ATOM 0 HB2 LEU A 22 94.445 -2.035 -25.435 1.00 0.00 H new ATOM 0 HB3 LEU A 22 95.978 -1.476 -24.795 1.00 0.00 H new ATOM 0 HG LEU A 22 96.059 -1.386 -27.226 1.00 0.00 H new ATOM 0 HD11 LEU A 22 98.022 -2.843 -27.678 1.00 0.00 H new ATOM 0 HD12 LEU A 22 98.148 -2.047 -26.091 1.00 0.00 H new ATOM 0 HD13 LEU A 22 97.673 -3.760 -26.193 1.00 0.00 H new ATOM 0 HD21 LEU A 22 95.802 -3.426 -28.632 1.00 0.00 H new ATOM 0 HD22 LEU A 22 95.384 -4.367 -27.180 1.00 0.00 H new ATOM 0 HD23 LEU A 22 94.310 -3.060 -27.734 1.00 0.00 H new ATOM 308 N ILE A 23 97.284 -2.806 -22.947 1.00 0.00 N ATOM 309 CA ILE A 23 98.573 -2.784 -22.268 1.00 0.00 C ATOM 310 C ILE A 23 98.808 -4.100 -21.530 1.00 0.00 C ATOM 311 O ILE A 23 99.854 -4.731 -21.685 1.00 0.00 O ATOM 312 CB ILE A 23 98.618 -1.610 -21.286 1.00 0.00 C ATOM 313 CG1 ILE A 23 98.190 -0.332 -22.010 1.00 0.00 C ATOM 314 CG2 ILE A 23 100.042 -1.432 -20.755 1.00 0.00 C ATOM 315 CD1 ILE A 23 98.272 0.853 -21.045 1.00 0.00 C ATOM 0 H ILE A 23 96.609 -2.121 -22.607 1.00 0.00 H new ATOM 0 HA ILE A 23 99.362 -2.660 -23.009 1.00 0.00 H new ATOM 0 HB ILE A 23 97.944 -1.811 -20.453 1.00 0.00 H new ATOM 0 HG12 ILE A 23 98.833 -0.157 -22.873 1.00 0.00 H new ATOM 0 HG13 ILE A 23 97.173 -0.438 -22.387 1.00 0.00 H new ATOM 0 HG21 ILE A 23 100.068 -0.595 -20.057 1.00 0.00 H new ATOM 0 HG22 ILE A 23 100.356 -2.342 -20.243 1.00 0.00 H new ATOM 0 HG23 ILE A 23 100.718 -1.232 -21.586 1.00 0.00 H new ATOM 0 HD11 ILE A 23 97.967 1.764 -21.560 1.00 0.00 H new ATOM 0 HD12 ILE A 23 97.611 0.678 -20.196 1.00 0.00 H new ATOM 0 HD13 ILE A 23 99.297 0.963 -20.690 1.00 0.00 H new ATOM 327 N ALA A 24 97.825 -4.514 -20.736 1.00 0.00 N ATOM 328 CA ALA A 24 97.936 -5.761 -19.988 1.00 0.00 C ATOM 329 C ALA A 24 98.260 -6.917 -20.929 1.00 0.00 C ATOM 330 O ALA A 24 99.084 -7.776 -20.614 1.00 0.00 O ATOM 331 CB ALA A 24 96.624 -6.050 -19.255 1.00 0.00 C ATOM 0 H ALA A 24 96.950 -4.009 -20.595 1.00 0.00 H new ATOM 0 HA ALA A 24 98.742 -5.659 -19.261 1.00 0.00 H new ATOM 0 HB1 ALA A 24 96.716 -6.983 -18.699 1.00 0.00 H new ATOM 0 HB2 ALA A 24 96.406 -5.236 -18.564 1.00 0.00 H new ATOM 0 HB3 ALA A 24 95.814 -6.137 -19.979 1.00 0.00 H new ATOM 337 N LEU A 25 97.609 -6.927 -22.086 1.00 0.00 N ATOM 338 CA LEU A 25 97.834 -7.975 -23.074 1.00 0.00 C ATOM 339 C LEU A 25 99.274 -7.924 -23.573 1.00 0.00 C ATOM 340 O LEU A 25 99.928 -8.955 -23.724 1.00 0.00 O ATOM 341 CB LEU A 25 96.860 -7.798 -24.248 1.00 0.00 C ATOM 342 CG LEU A 25 97.186 -8.785 -25.377 1.00 0.00 C ATOM 343 CD1 LEU A 25 97.224 -10.220 -24.832 1.00 0.00 C ATOM 344 CD2 LEU A 25 96.102 -8.679 -26.456 1.00 0.00 C ATOM 0 H LEU A 25 96.924 -6.224 -22.363 1.00 0.00 H new ATOM 0 HA LEU A 25 97.660 -8.946 -22.611 1.00 0.00 H new ATOM 0 HB2 LEU A 25 95.837 -7.955 -23.905 1.00 0.00 H new ATOM 0 HB3 LEU A 25 96.917 -6.776 -24.624 1.00 0.00 H new ATOM 0 HG LEU A 25 98.161 -8.543 -25.799 1.00 0.00 H new ATOM 0 HD11 LEU A 25 97.456 -10.911 -25.642 1.00 0.00 H new ATOM 0 HD12 LEU A 25 97.990 -10.296 -24.060 1.00 0.00 H new ATOM 0 HD13 LEU A 25 96.253 -10.473 -24.406 1.00 0.00 H new ATOM 0 HD21 LEU A 25 96.323 -9.376 -27.264 1.00 0.00 H new ATOM 0 HD22 LEU A 25 95.132 -8.922 -26.022 1.00 0.00 H new ATOM 0 HD23 LEU A 25 96.079 -7.663 -26.850 1.00 0.00 H new ATOM 356 N ALA A 26 99.762 -6.714 -23.822 1.00 0.00 N ATOM 357 CA ALA A 26 101.128 -6.537 -24.298 1.00 0.00 C ATOM 358 C ALA A 26 102.109 -7.231 -23.362 1.00 0.00 C ATOM 359 O ALA A 26 102.988 -7.971 -23.804 1.00 0.00 O ATOM 360 CB ALA A 26 101.463 -5.047 -24.381 1.00 0.00 C ATOM 0 H ALA A 26 99.237 -5.848 -23.703 1.00 0.00 H new ATOM 0 HA ALA A 26 101.211 -6.981 -25.290 1.00 0.00 H new ATOM 0 HB1 ALA A 26 102.486 -4.923 -24.738 1.00 0.00 H new ATOM 0 HB2 ALA A 26 100.776 -4.558 -25.072 1.00 0.00 H new ATOM 0 HB3 ALA A 26 101.366 -4.597 -23.393 1.00 0.00 H new ATOM 366 N VAL A 27 101.952 -6.989 -22.064 1.00 0.00 N ATOM 367 CA VAL A 27 102.831 -7.602 -21.074 1.00 0.00 C ATOM 368 C VAL A 27 102.671 -9.118 -21.080 1.00 0.00 C ATOM 369 O VAL A 27 103.648 -9.856 -20.952 1.00 0.00 O ATOM 370 CB VAL A 27 102.512 -7.063 -19.677 1.00 0.00 C ATOM 371 CG1 VAL A 27 103.596 -7.518 -18.697 1.00 0.00 C ATOM 372 CG2 VAL A 27 102.460 -5.531 -19.715 1.00 0.00 C ATOM 0 H VAL A 27 101.232 -6.379 -21.676 1.00 0.00 H new ATOM 0 HA VAL A 27 103.860 -7.352 -21.332 1.00 0.00 H new ATOM 0 HB VAL A 27 101.545 -7.446 -19.352 1.00 0.00 H new ATOM 0 HG11 VAL A 27 103.371 -7.135 -17.702 1.00 0.00 H new ATOM 0 HG12 VAL A 27 103.627 -8.607 -18.668 1.00 0.00 H new ATOM 0 HG13 VAL A 27 104.564 -7.136 -19.022 1.00 0.00 H new ATOM 0 HG21 VAL A 27 102.233 -5.150 -18.719 1.00 0.00 H new ATOM 0 HG22 VAL A 27 103.425 -5.142 -20.041 1.00 0.00 H new ATOM 0 HG23 VAL A 27 101.685 -5.210 -20.412 1.00 0.00 H new ATOM 382 N TYR A 28 101.433 -9.576 -21.222 1.00 0.00 N ATOM 383 CA TYR A 28 101.153 -11.008 -21.235 1.00 0.00 C ATOM 384 C TYR A 28 101.909 -11.701 -22.365 1.00 0.00 C ATOM 385 O TYR A 28 102.545 -12.734 -22.153 1.00 0.00 O ATOM 386 CB TYR A 28 99.651 -11.241 -21.405 1.00 0.00 C ATOM 387 CG TYR A 28 99.364 -12.722 -21.359 1.00 0.00 C ATOM 388 CD1 TYR A 28 99.511 -13.501 -22.513 1.00 0.00 C ATOM 389 CD2 TYR A 28 98.950 -13.317 -20.160 1.00 0.00 C ATOM 390 CE1 TYR A 28 99.244 -14.875 -22.469 1.00 0.00 C ATOM 391 CE2 TYR A 28 98.684 -14.691 -20.117 1.00 0.00 C ATOM 392 CZ TYR A 28 98.831 -15.470 -21.271 1.00 0.00 C ATOM 393 OH TYR A 28 98.568 -16.824 -21.228 1.00 0.00 O ATOM 0 H TYR A 28 100.611 -8.982 -21.329 1.00 0.00 H new ATOM 0 HA TYR A 28 101.485 -11.430 -20.286 1.00 0.00 H new ATOM 0 HB2 TYR A 28 99.101 -10.728 -20.616 1.00 0.00 H new ATOM 0 HB3 TYR A 28 99.312 -10.823 -22.353 1.00 0.00 H new ATOM 0 HD1 TYR A 28 99.830 -13.042 -23.437 1.00 0.00 H new ATOM 0 HD2 TYR A 28 98.836 -12.716 -19.270 1.00 0.00 H new ATOM 0 HE1 TYR A 28 99.357 -15.476 -23.359 1.00 0.00 H new ATOM 0 HE2 TYR A 28 98.365 -15.150 -19.193 1.00 0.00 H new ATOM 0 HH TYR A 28 98.294 -17.075 -20.321 1.00 0.00 H new ATOM 403 N PHE A 29 101.833 -11.134 -23.565 1.00 0.00 N ATOM 404 CA PHE A 29 102.513 -11.717 -24.716 1.00 0.00 C ATOM 405 C PHE A 29 104.020 -11.763 -24.485 1.00 0.00 C ATOM 406 O PHE A 29 104.658 -12.793 -24.700 1.00 0.00 O ATOM 407 CB PHE A 29 102.215 -10.896 -25.973 1.00 0.00 C ATOM 408 CG PHE A 29 102.813 -11.585 -27.177 1.00 0.00 C ATOM 409 CD1 PHE A 29 102.064 -12.532 -27.886 1.00 0.00 C ATOM 410 CD2 PHE A 29 104.118 -11.278 -27.582 1.00 0.00 C ATOM 411 CE1 PHE A 29 102.620 -13.172 -29.000 1.00 0.00 C ATOM 412 CE2 PHE A 29 104.673 -11.919 -28.697 1.00 0.00 C ATOM 413 CZ PHE A 29 103.923 -12.865 -29.406 1.00 0.00 C ATOM 0 H PHE A 29 101.313 -10.280 -23.765 1.00 0.00 H new ATOM 0 HA PHE A 29 102.146 -12.734 -24.850 1.00 0.00 H new ATOM 0 HB2 PHE A 29 101.138 -10.785 -26.101 1.00 0.00 H new ATOM 0 HB3 PHE A 29 102.629 -9.893 -25.872 1.00 0.00 H new ATOM 0 HD1 PHE A 29 101.058 -12.769 -27.574 1.00 0.00 H new ATOM 0 HD2 PHE A 29 104.696 -10.548 -27.035 1.00 0.00 H new ATOM 0 HE1 PHE A 29 102.043 -13.903 -29.546 1.00 0.00 H new ATOM 0 HE2 PHE A 29 105.680 -11.683 -29.010 1.00 0.00 H new ATOM 0 HZ PHE A 29 104.351 -13.358 -30.267 1.00 0.00 H new ATOM 423 N LEU A 30 104.582 -10.642 -24.049 1.00 0.00 N ATOM 424 CA LEU A 30 106.016 -10.564 -23.795 1.00 0.00 C ATOM 425 C LEU A 30 106.402 -11.458 -22.619 1.00 0.00 C ATOM 426 O LEU A 30 107.447 -12.109 -22.639 1.00 0.00 O ATOM 427 CB LEU A 30 106.413 -9.114 -23.490 1.00 0.00 C ATOM 428 CG LEU A 30 107.949 -8.964 -23.502 1.00 0.00 C ATOM 429 CD1 LEU A 30 108.460 -8.780 -24.938 1.00 0.00 C ATOM 430 CD2 LEU A 30 108.352 -7.740 -22.672 1.00 0.00 C ATOM 0 H LEU A 30 104.071 -9.779 -23.865 1.00 0.00 H new ATOM 0 HA LEU A 30 106.544 -10.907 -24.685 1.00 0.00 H new ATOM 0 HB2 LEU A 30 105.970 -8.446 -24.228 1.00 0.00 H new ATOM 0 HB3 LEU A 30 106.020 -8.819 -22.517 1.00 0.00 H new ATOM 0 HG LEU A 30 108.388 -9.867 -23.078 1.00 0.00 H new ATOM 0 HD11 LEU A 30 109.545 -8.676 -24.928 1.00 0.00 H new ATOM 0 HD12 LEU A 30 108.185 -9.649 -25.536 1.00 0.00 H new ATOM 0 HD13 LEU A 30 108.014 -7.885 -25.371 1.00 0.00 H new ATOM 0 HD21 LEU A 30 109.437 -7.635 -22.681 1.00 0.00 H new ATOM 0 HD22 LEU A 30 107.897 -6.846 -23.098 1.00 0.00 H new ATOM 0 HD23 LEU A 30 108.009 -7.867 -21.645 1.00 0.00 H new ATOM 442 N GLY A 31 105.554 -11.481 -21.596 1.00 0.00 N ATOM 443 CA GLY A 31 105.819 -12.293 -20.414 1.00 0.00 C ATOM 444 C GLY A 31 105.522 -13.765 -20.678 1.00 0.00 C ATOM 445 O GLY A 31 106.276 -14.447 -21.373 1.00 0.00 O ATOM 0 H GLY A 31 104.683 -10.951 -21.561 1.00 0.00 H new ATOM 0 HA2 GLY A 31 106.861 -12.177 -20.116 1.00 0.00 H new ATOM 0 HA3 GLY A 31 105.209 -11.940 -19.583 1.00 0.00 H new ATOM 449 N ARG A 32 104.420 -14.250 -20.114 1.00 0.00 N ATOM 450 CA ARG A 32 104.032 -15.646 -20.287 1.00 0.00 C ATOM 451 C ARG A 32 105.111 -16.572 -19.735 1.00 0.00 C ATOM 452 O ARG A 32 105.929 -17.105 -20.484 1.00 0.00 O ATOM 453 CB ARG A 32 103.805 -15.950 -21.770 1.00 0.00 C ATOM 454 CG ARG A 32 103.080 -17.291 -21.908 1.00 0.00 C ATOM 455 CD ARG A 32 102.805 -17.574 -23.386 1.00 0.00 C ATOM 456 NE ARG A 32 101.861 -16.599 -23.919 1.00 0.00 N ATOM 457 CZ ARG A 32 101.406 -16.692 -25.163 1.00 0.00 C ATOM 458 NH1 ARG A 32 101.798 -17.674 -25.930 1.00 0.00 N ATOM 459 NH2 ARG A 32 100.565 -15.805 -25.618 1.00 0.00 N ATOM 0 H ARG A 32 103.783 -13.701 -19.537 1.00 0.00 H new ATOM 0 HA ARG A 32 103.105 -15.816 -19.739 1.00 0.00 H new ATOM 0 HB2 ARG A 32 103.216 -15.156 -22.229 1.00 0.00 H new ATOM 0 HB3 ARG A 32 104.759 -15.984 -22.296 1.00 0.00 H new ATOM 0 HG2 ARG A 32 103.686 -18.090 -21.481 1.00 0.00 H new ATOM 0 HG3 ARG A 32 102.143 -17.269 -21.351 1.00 0.00 H new ATOM 0 HD2 ARG A 32 103.737 -17.535 -23.951 1.00 0.00 H new ATOM 0 HD3 ARG A 32 102.404 -18.581 -23.502 1.00 0.00 H new ATOM 0 HE ARG A 32 101.545 -15.832 -23.326 1.00 0.00 H new ATOM 0 HH11 ARG A 32 102.454 -18.369 -25.573 1.00 0.00 H new ATOM 0 HH12 ARG A 32 101.449 -17.746 -26.886 1.00 0.00 H new ATOM 0 HH21 ARG A 32 100.257 -15.040 -25.018 1.00 0.00 H new ATOM 0 HH22 ARG A 32 100.216 -15.877 -26.574 1.00 0.00 H new ATOM 473 N LEU A 33 105.105 -16.757 -18.419 1.00 0.00 N ATOM 474 CA LEU A 33 106.088 -17.621 -17.771 1.00 0.00 C ATOM 475 C LEU A 33 107.504 -17.177 -18.128 1.00 0.00 C ATOM 476 O LEU A 33 107.695 -16.219 -18.876 1.00 0.00 O ATOM 477 CB LEU A 33 105.876 -19.077 -18.208 1.00 0.00 C ATOM 478 CG LEU A 33 104.679 -19.678 -17.461 1.00 0.00 C ATOM 479 CD1 LEU A 33 103.414 -18.869 -17.769 1.00 0.00 C ATOM 480 CD2 LEU A 33 104.483 -21.129 -17.907 1.00 0.00 C ATOM 0 H LEU A 33 104.436 -16.324 -17.783 1.00 0.00 H new ATOM 0 HA LEU A 33 105.957 -17.547 -16.691 1.00 0.00 H new ATOM 0 HB2 LEU A 33 105.704 -19.122 -19.283 1.00 0.00 H new ATOM 0 HB3 LEU A 33 106.773 -19.661 -18.004 1.00 0.00 H new ATOM 0 HG LEU A 33 104.868 -19.647 -16.388 1.00 0.00 H new ATOM 0 HD11 LEU A 33 102.567 -19.301 -17.236 1.00 0.00 H new ATOM 0 HD12 LEU A 33 103.556 -17.836 -17.450 1.00 0.00 H new ATOM 0 HD13 LEU A 33 103.218 -18.894 -18.841 1.00 0.00 H new ATOM 0 HD21 LEU A 33 103.633 -21.560 -17.378 1.00 0.00 H new ATOM 0 HD22 LEU A 33 104.295 -21.158 -18.980 1.00 0.00 H new ATOM 0 HD23 LEU A 33 105.381 -21.704 -17.680 1.00 0.00 H new ATOM 492 N GLY A 34 108.493 -17.881 -17.585 1.00 0.00 N ATOM 493 CA GLY A 34 109.891 -17.554 -17.849 1.00 0.00 C ATOM 494 C GLY A 34 110.367 -16.425 -16.942 1.00 0.00 C ATOM 495 O GLY A 34 111.514 -15.989 -17.028 1.00 0.00 O ATOM 0 H GLY A 34 108.354 -18.677 -16.963 1.00 0.00 H new ATOM 0 HA2 GLY A 34 110.511 -18.437 -17.693 1.00 0.00 H new ATOM 0 HA3 GLY A 34 110.009 -17.262 -18.892 1.00 0.00 H new ATOM 499 N THR A 35 109.477 -15.956 -16.070 1.00 0.00 N ATOM 500 CA THR A 35 109.813 -14.874 -15.145 1.00 0.00 C ATOM 501 C THR A 35 108.981 -14.983 -13.871 1.00 0.00 C ATOM 502 O THR A 35 109.165 -14.209 -12.931 1.00 0.00 O ATOM 503 CB THR A 35 109.556 -13.518 -15.808 1.00 0.00 C ATOM 504 OG1 THR A 35 108.197 -13.443 -16.214 1.00 0.00 O ATOM 505 CG2 THR A 35 110.466 -13.359 -17.027 1.00 0.00 C ATOM 0 H THR A 35 108.523 -16.305 -15.984 1.00 0.00 H new ATOM 0 HA THR A 35 110.869 -14.957 -14.887 1.00 0.00 H new ATOM 0 HB THR A 35 109.768 -12.720 -15.097 1.00 0.00 H new ATOM 0 HG1 THR A 35 108.098 -12.749 -16.898 1.00 0.00 H new ATOM 0 HG21 THR A 35 110.280 -12.393 -17.496 1.00 0.00 H new ATOM 0 HG22 THR A 35 111.508 -13.415 -16.713 1.00 0.00 H new ATOM 0 HG23 THR A 35 110.259 -14.155 -17.742 1.00 0.00 H new ATOM 513 N ALA A 36 108.064 -15.944 -13.849 1.00 0.00 N ATOM 514 CA ALA A 36 107.206 -16.142 -12.686 1.00 0.00 C ATOM 515 C ALA A 36 106.641 -14.810 -12.203 1.00 0.00 C ATOM 516 O ALA A 36 106.642 -13.821 -12.936 1.00 0.00 O ATOM 517 CB ALA A 36 108.000 -16.801 -11.556 1.00 0.00 C ATOM 0 H ALA A 36 107.896 -16.594 -14.617 1.00 0.00 H new ATOM 0 HA ALA A 36 106.379 -16.791 -12.975 1.00 0.00 H new ATOM 0 HB1 ALA A 36 107.352 -16.945 -10.692 1.00 0.00 H new ATOM 0 HB2 ALA A 36 108.377 -17.767 -11.892 1.00 0.00 H new ATOM 0 HB3 ALA A 36 108.838 -16.161 -11.279 1.00 0.00 H new ATOM 523 N GLU A 37 106.158 -14.792 -10.964 1.00 0.00 N ATOM 524 CA GLU A 37 105.591 -13.576 -10.393 1.00 0.00 C ATOM 525 C GLU A 37 104.496 -13.022 -11.299 1.00 0.00 C ATOM 526 O GLU A 37 104.281 -11.813 -11.367 1.00 0.00 O ATOM 527 CB GLU A 37 106.687 -12.524 -10.207 1.00 0.00 C ATOM 528 CG GLU A 37 107.815 -13.109 -9.354 1.00 0.00 C ATOM 529 CD GLU A 37 107.303 -13.420 -7.952 1.00 0.00 C ATOM 530 OE1 GLU A 37 106.281 -12.867 -7.579 1.00 0.00 O ATOM 531 OE2 GLU A 37 107.939 -14.207 -7.270 1.00 0.00 O ATOM 0 H GLU A 37 106.148 -15.599 -10.341 1.00 0.00 H new ATOM 0 HA GLU A 37 105.157 -13.819 -9.423 1.00 0.00 H new ATOM 0 HB2 GLU A 37 107.074 -12.211 -11.177 1.00 0.00 H new ATOM 0 HB3 GLU A 37 106.276 -11.636 -9.727 1.00 0.00 H new ATOM 0 HG2 GLU A 37 108.200 -14.017 -9.819 1.00 0.00 H new ATOM 0 HG3 GLU A 37 108.644 -12.403 -9.299 1.00 0.00 H new ATOM 538 N VAL A 38 103.806 -13.923 -11.991 1.00 0.00 N ATOM 539 CA VAL A 38 102.730 -13.529 -12.894 1.00 0.00 C ATOM 540 C VAL A 38 101.592 -12.865 -12.123 1.00 0.00 C ATOM 541 O VAL A 38 100.808 -12.103 -12.688 1.00 0.00 O ATOM 542 CB VAL A 38 102.197 -14.757 -13.634 1.00 0.00 C ATOM 543 CG1 VAL A 38 103.255 -15.258 -14.619 1.00 0.00 C ATOM 544 CG2 VAL A 38 101.878 -15.863 -12.625 1.00 0.00 C ATOM 0 H VAL A 38 103.972 -14.928 -11.944 1.00 0.00 H new ATOM 0 HA VAL A 38 103.130 -12.813 -13.612 1.00 0.00 H new ATOM 0 HB VAL A 38 101.291 -14.488 -14.178 1.00 0.00 H new ATOM 0 HG11 VAL A 38 102.876 -16.133 -15.147 1.00 0.00 H new ATOM 0 HG12 VAL A 38 103.484 -14.472 -15.338 1.00 0.00 H new ATOM 0 HG13 VAL A 38 104.160 -15.527 -14.075 1.00 0.00 H new ATOM 0 HG21 VAL A 38 101.498 -16.738 -13.152 1.00 0.00 H new ATOM 0 HG22 VAL A 38 102.784 -16.132 -12.081 1.00 0.00 H new ATOM 0 HG23 VAL A 38 101.125 -15.508 -11.922 1.00 0.00 H new ATOM 554 N LEU A 39 101.505 -13.172 -10.834 1.00 0.00 N ATOM 555 CA LEU A 39 100.453 -12.616 -9.988 1.00 0.00 C ATOM 556 C LEU A 39 100.268 -11.122 -10.249 1.00 0.00 C ATOM 557 O LEU A 39 99.177 -10.586 -10.063 1.00 0.00 O ATOM 558 CB LEU A 39 100.807 -12.850 -8.513 1.00 0.00 C ATOM 559 CG LEU A 39 99.735 -12.245 -7.591 1.00 0.00 C ATOM 560 CD1 LEU A 39 98.356 -12.846 -7.909 1.00 0.00 C ATOM 561 CD2 LEU A 39 100.105 -12.553 -6.136 1.00 0.00 C ATOM 0 H LEU A 39 102.147 -13.801 -10.352 1.00 0.00 H new ATOM 0 HA LEU A 39 99.515 -13.118 -10.226 1.00 0.00 H new ATOM 0 HB2 LEU A 39 100.897 -13.919 -8.321 1.00 0.00 H new ATOM 0 HB3 LEU A 39 101.777 -12.404 -8.292 1.00 0.00 H new ATOM 0 HG LEU A 39 99.690 -11.167 -7.747 1.00 0.00 H new ATOM 0 HD11 LEU A 39 97.607 -12.408 -7.249 1.00 0.00 H new ATOM 0 HD12 LEU A 39 98.096 -12.631 -8.945 1.00 0.00 H new ATOM 0 HD13 LEU A 39 98.386 -13.925 -7.759 1.00 0.00 H new ATOM 0 HD21 LEU A 39 99.352 -12.129 -5.472 1.00 0.00 H new ATOM 0 HD22 LEU A 39 100.149 -13.633 -5.992 1.00 0.00 H new ATOM 0 HD23 LEU A 39 101.077 -12.117 -5.908 1.00 0.00 H new ATOM 573 N GLY A 40 101.335 -10.454 -10.676 1.00 0.00 N ATOM 574 CA GLY A 40 101.261 -9.020 -10.953 1.00 0.00 C ATOM 575 C GLY A 40 100.243 -8.725 -12.053 1.00 0.00 C ATOM 576 O GLY A 40 99.380 -7.856 -11.903 1.00 0.00 O ATOM 0 H GLY A 40 102.251 -10.874 -10.837 1.00 0.00 H new ATOM 0 HA2 GLY A 40 100.985 -8.485 -10.045 1.00 0.00 H new ATOM 0 HA3 GLY A 40 102.242 -8.653 -11.253 1.00 0.00 H new ATOM 580 N ILE A 41 100.348 -9.456 -13.157 1.00 0.00 N ATOM 581 CA ILE A 41 99.431 -9.267 -14.277 1.00 0.00 C ATOM 582 C ILE A 41 97.986 -9.420 -13.801 1.00 0.00 C ATOM 583 O ILE A 41 97.130 -8.578 -14.083 1.00 0.00 O ATOM 584 CB ILE A 41 99.737 -10.289 -15.384 1.00 0.00 C ATOM 585 CG1 ILE A 41 101.054 -9.916 -16.079 1.00 0.00 C ATOM 586 CG2 ILE A 41 98.610 -10.291 -16.422 1.00 0.00 C ATOM 587 CD1 ILE A 41 102.231 -10.058 -15.108 1.00 0.00 C ATOM 0 H ILE A 41 101.052 -10.179 -13.301 1.00 0.00 H new ATOM 0 HA ILE A 41 99.563 -8.263 -14.680 1.00 0.00 H new ATOM 0 HB ILE A 41 99.821 -11.279 -14.936 1.00 0.00 H new ATOM 0 HG12 ILE A 41 101.210 -10.559 -16.945 1.00 0.00 H new ATOM 0 HG13 ILE A 41 101.000 -8.892 -16.448 1.00 0.00 H new ATOM 0 HG21 ILE A 41 98.835 -11.018 -17.202 1.00 0.00 H new ATOM 0 HG22 ILE A 41 97.670 -10.557 -15.938 1.00 0.00 H new ATOM 0 HG23 ILE A 41 98.522 -9.299 -16.865 1.00 0.00 H new ATOM 0 HD11 ILE A 41 103.157 -9.790 -15.617 1.00 0.00 H new ATOM 0 HD12 ILE A 41 102.081 -9.396 -14.255 1.00 0.00 H new ATOM 0 HD13 ILE A 41 102.294 -11.089 -14.761 1.00 0.00 H new ATOM 599 N ILE A 42 97.722 -10.495 -13.072 1.00 0.00 N ATOM 600 CA ILE A 42 96.382 -10.739 -12.561 1.00 0.00 C ATOM 601 C ILE A 42 95.965 -9.605 -11.628 1.00 0.00 C ATOM 602 O ILE A 42 94.787 -9.278 -11.528 1.00 0.00 O ATOM 603 CB ILE A 42 96.341 -12.080 -11.812 1.00 0.00 C ATOM 604 CG1 ILE A 42 96.470 -13.235 -12.815 1.00 0.00 C ATOM 605 CG2 ILE A 42 95.011 -12.219 -11.063 1.00 0.00 C ATOM 606 CD1 ILE A 42 97.861 -13.231 -13.463 1.00 0.00 C ATOM 0 H ILE A 42 98.411 -11.205 -12.823 1.00 0.00 H new ATOM 0 HA ILE A 42 95.686 -10.781 -13.399 1.00 0.00 H new ATOM 0 HB ILE A 42 97.166 -12.112 -11.101 1.00 0.00 H new ATOM 0 HG12 ILE A 42 96.301 -14.185 -12.308 1.00 0.00 H new ATOM 0 HG13 ILE A 42 95.704 -13.144 -13.585 1.00 0.00 H new ATOM 0 HG21 ILE A 42 94.989 -13.172 -10.534 1.00 0.00 H new ATOM 0 HG22 ILE A 42 94.910 -11.404 -10.346 1.00 0.00 H new ATOM 0 HG23 ILE A 42 94.187 -12.180 -11.775 1.00 0.00 H new ATOM 0 HD11 ILE A 42 97.935 -14.056 -14.171 1.00 0.00 H new ATOM 0 HD12 ILE A 42 98.015 -12.288 -13.987 1.00 0.00 H new ATOM 0 HD13 ILE A 42 98.622 -13.346 -12.691 1.00 0.00 H new ATOM 618 N SER A 43 96.940 -9.020 -10.940 1.00 0.00 N ATOM 619 CA SER A 43 96.661 -7.932 -10.006 1.00 0.00 C ATOM 620 C SER A 43 96.063 -6.722 -10.721 1.00 0.00 C ATOM 621 O SER A 43 95.034 -6.192 -10.299 1.00 0.00 O ATOM 622 CB SER A 43 97.948 -7.521 -9.288 1.00 0.00 C ATOM 623 OG SER A 43 97.616 -6.824 -8.094 1.00 0.00 O ATOM 0 H SER A 43 97.924 -9.278 -11.010 1.00 0.00 H new ATOM 0 HA SER A 43 95.932 -8.292 -9.280 1.00 0.00 H new ATOM 0 HB2 SER A 43 98.545 -8.402 -9.054 1.00 0.00 H new ATOM 0 HB3 SER A 43 98.554 -6.888 -9.936 1.00 0.00 H new ATOM 0 HG SER A 43 98.438 -6.560 -7.630 1.00 0.00 H new ATOM 629 N ILE A 44 96.714 -6.275 -11.792 1.00 0.00 N ATOM 630 CA ILE A 44 96.221 -5.113 -12.530 1.00 0.00 C ATOM 631 C ILE A 44 94.880 -5.414 -13.201 1.00 0.00 C ATOM 632 O ILE A 44 94.005 -4.549 -13.285 1.00 0.00 O ATOM 633 CB ILE A 44 97.251 -4.670 -13.575 1.00 0.00 C ATOM 634 CG1 ILE A 44 97.680 -5.869 -14.422 1.00 0.00 C ATOM 635 CG2 ILE A 44 98.473 -4.093 -12.858 1.00 0.00 C ATOM 636 CD1 ILE A 44 98.523 -5.397 -15.612 1.00 0.00 C ATOM 0 H ILE A 44 97.568 -6.690 -12.164 1.00 0.00 H new ATOM 0 HA ILE A 44 96.068 -4.301 -11.819 1.00 0.00 H new ATOM 0 HB ILE A 44 96.808 -3.914 -14.223 1.00 0.00 H new ATOM 0 HG12 ILE A 44 98.254 -6.567 -13.813 1.00 0.00 H new ATOM 0 HG13 ILE A 44 96.801 -6.406 -14.779 1.00 0.00 H new ATOM 0 HG21 ILE A 44 99.211 -3.775 -13.595 1.00 0.00 H new ATOM 0 HG22 ILE A 44 98.170 -3.237 -12.255 1.00 0.00 H new ATOM 0 HG23 ILE A 44 98.910 -4.855 -12.213 1.00 0.00 H new ATOM 0 HD11 ILE A 44 98.824 -6.258 -16.209 1.00 0.00 H new ATOM 0 HD12 ILE A 44 97.935 -4.716 -16.227 1.00 0.00 H new ATOM 0 HD13 ILE A 44 99.411 -4.881 -15.247 1.00 0.00 H new ATOM 648 N VAL A 45 94.708 -6.642 -13.674 1.00 0.00 N ATOM 649 CA VAL A 45 93.455 -7.013 -14.322 1.00 0.00 C ATOM 650 C VAL A 45 92.308 -7.013 -13.308 1.00 0.00 C ATOM 651 O VAL A 45 91.190 -6.592 -13.617 1.00 0.00 O ATOM 652 CB VAL A 45 93.586 -8.400 -14.962 1.00 0.00 C ATOM 653 CG1 VAL A 45 92.220 -8.866 -15.475 1.00 0.00 C ATOM 654 CG2 VAL A 45 94.566 -8.327 -16.135 1.00 0.00 C ATOM 0 H VAL A 45 95.405 -7.385 -13.624 1.00 0.00 H new ATOM 0 HA VAL A 45 93.235 -6.280 -15.098 1.00 0.00 H new ATOM 0 HB VAL A 45 93.953 -9.106 -14.217 1.00 0.00 H new ATOM 0 HG11 VAL A 45 92.319 -9.852 -15.929 1.00 0.00 H new ATOM 0 HG12 VAL A 45 91.517 -8.918 -14.643 1.00 0.00 H new ATOM 0 HG13 VAL A 45 91.850 -8.160 -16.218 1.00 0.00 H new ATOM 0 HG21 VAL A 45 94.661 -9.312 -16.592 1.00 0.00 H new ATOM 0 HG22 VAL A 45 94.195 -7.618 -16.875 1.00 0.00 H new ATOM 0 HG23 VAL A 45 95.541 -7.999 -15.775 1.00 0.00 H new ATOM 664 N LEU A 46 92.591 -7.505 -12.107 1.00 0.00 N ATOM 665 CA LEU A 46 91.579 -7.584 -11.054 1.00 0.00 C ATOM 666 C LEU A 46 91.164 -6.194 -10.556 1.00 0.00 C ATOM 667 O LEU A 46 89.975 -5.928 -10.372 1.00 0.00 O ATOM 668 CB LEU A 46 92.128 -8.425 -9.880 1.00 0.00 C ATOM 669 CG LEU A 46 91.001 -9.208 -9.190 1.00 0.00 C ATOM 670 CD1 LEU A 46 91.563 -9.922 -7.958 1.00 0.00 C ATOM 671 CD2 LEU A 46 89.882 -8.250 -8.764 1.00 0.00 C ATOM 0 H LEU A 46 93.510 -7.855 -11.836 1.00 0.00 H new ATOM 0 HA LEU A 46 90.691 -8.059 -11.471 1.00 0.00 H new ATOM 0 HB2 LEU A 46 92.885 -9.118 -10.247 1.00 0.00 H new ATOM 0 HB3 LEU A 46 92.617 -7.772 -9.157 1.00 0.00 H new ATOM 0 HG LEU A 46 90.593 -9.942 -9.886 1.00 0.00 H new ATOM 0 HD11 LEU A 46 90.766 -10.479 -7.465 1.00 0.00 H new ATOM 0 HD12 LEU A 46 92.351 -10.610 -8.264 1.00 0.00 H new ATOM 0 HD13 LEU A 46 91.973 -9.186 -7.266 1.00 0.00 H new ATOM 0 HD21 LEU A 46 89.087 -8.813 -8.276 1.00 0.00 H new ATOM 0 HD22 LEU A 46 90.281 -7.510 -8.070 1.00 0.00 H new ATOM 0 HD23 LEU A 46 89.481 -7.745 -9.643 1.00 0.00 H new ATOM 683 N VAL A 47 92.135 -5.311 -10.324 1.00 0.00 N ATOM 684 CA VAL A 47 91.813 -3.978 -9.826 1.00 0.00 C ATOM 685 C VAL A 47 91.104 -3.156 -10.897 1.00 0.00 C ATOM 686 O VAL A 47 90.305 -2.277 -10.581 1.00 0.00 O ATOM 687 CB VAL A 47 93.083 -3.258 -9.334 1.00 0.00 C ATOM 688 CG1 VAL A 47 93.874 -2.691 -10.515 1.00 0.00 C ATOM 689 CG2 VAL A 47 92.690 -2.110 -8.398 1.00 0.00 C ATOM 0 H VAL A 47 93.129 -5.490 -10.469 1.00 0.00 H new ATOM 0 HA VAL A 47 91.135 -4.086 -8.979 1.00 0.00 H new ATOM 0 HB VAL A 47 93.706 -3.978 -8.804 1.00 0.00 H new ATOM 0 HG11 VAL A 47 94.767 -2.187 -10.146 1.00 0.00 H new ATOM 0 HG12 VAL A 47 94.165 -3.503 -11.181 1.00 0.00 H new ATOM 0 HG13 VAL A 47 93.254 -1.979 -11.060 1.00 0.00 H new ATOM 0 HG21 VAL A 47 93.589 -1.601 -8.050 1.00 0.00 H new ATOM 0 HG22 VAL A 47 92.057 -1.403 -8.935 1.00 0.00 H new ATOM 0 HG23 VAL A 47 92.144 -2.508 -7.543 1.00 0.00 H new ATOM 699 N ALA A 48 91.391 -3.446 -12.162 1.00 0.00 N ATOM 700 CA ALA A 48 90.755 -2.716 -13.251 1.00 0.00 C ATOM 701 C ALA A 48 89.282 -3.088 -13.363 1.00 0.00 C ATOM 702 O ALA A 48 88.415 -2.218 -13.392 1.00 0.00 O ATOM 703 CB ALA A 48 91.458 -3.024 -14.572 1.00 0.00 C ATOM 0 H ALA A 48 92.048 -4.169 -12.455 1.00 0.00 H new ATOM 0 HA ALA A 48 90.834 -1.650 -13.036 1.00 0.00 H new ATOM 0 HB1 ALA A 48 90.974 -2.473 -15.379 1.00 0.00 H new ATOM 0 HB2 ALA A 48 92.504 -2.726 -14.505 1.00 0.00 H new ATOM 0 HB3 ALA A 48 91.398 -4.093 -14.776 1.00 0.00 H new ATOM 709 N THR A 49 89.002 -4.383 -13.429 1.00 0.00 N ATOM 710 CA THR A 49 87.623 -4.837 -13.542 1.00 0.00 C ATOM 711 C THR A 49 86.801 -4.374 -12.342 1.00 0.00 C ATOM 712 O THR A 49 85.649 -3.968 -12.487 1.00 0.00 O ATOM 713 CB THR A 49 87.582 -6.364 -13.640 1.00 0.00 C ATOM 714 OG1 THR A 49 88.400 -6.924 -12.623 1.00 0.00 O ATOM 715 CG2 THR A 49 88.096 -6.804 -15.013 1.00 0.00 C ATOM 0 H THR A 49 89.699 -5.127 -13.407 1.00 0.00 H new ATOM 0 HA THR A 49 87.192 -4.405 -14.445 1.00 0.00 H new ATOM 0 HB THR A 49 86.556 -6.709 -13.512 1.00 0.00 H new ATOM 0 HG1 THR A 49 89.328 -6.968 -12.936 1.00 0.00 H new ATOM 0 HG21 THR A 49 88.066 -7.891 -15.081 1.00 0.00 H new ATOM 0 HG22 THR A 49 87.466 -6.374 -15.792 1.00 0.00 H new ATOM 0 HG23 THR A 49 89.122 -6.460 -15.145 1.00 0.00 H new ATOM 723 N VAL A 50 87.398 -4.447 -11.158 1.00 0.00 N ATOM 724 CA VAL A 50 86.707 -4.043 -9.937 1.00 0.00 C ATOM 725 C VAL A 50 86.510 -2.525 -9.875 1.00 0.00 C ATOM 726 O VAL A 50 85.453 -2.053 -9.457 1.00 0.00 O ATOM 727 CB VAL A 50 87.501 -4.528 -8.717 1.00 0.00 C ATOM 728 CG1 VAL A 50 86.927 -3.917 -7.434 1.00 0.00 C ATOM 729 CG2 VAL A 50 87.406 -6.056 -8.634 1.00 0.00 C ATOM 0 H VAL A 50 88.352 -4.779 -11.017 1.00 0.00 H new ATOM 0 HA VAL A 50 85.717 -4.500 -9.936 1.00 0.00 H new ATOM 0 HB VAL A 50 88.541 -4.221 -8.822 1.00 0.00 H new ATOM 0 HG11 VAL A 50 87.499 -4.269 -6.576 1.00 0.00 H new ATOM 0 HG12 VAL A 50 86.988 -2.830 -7.490 1.00 0.00 H new ATOM 0 HG13 VAL A 50 85.885 -4.217 -7.323 1.00 0.00 H new ATOM 0 HG21 VAL A 50 87.968 -6.409 -7.769 1.00 0.00 H new ATOM 0 HG22 VAL A 50 86.361 -6.351 -8.533 1.00 0.00 H new ATOM 0 HG23 VAL A 50 87.821 -6.496 -9.541 1.00 0.00 H new ATOM 739 N LEU A 51 87.525 -1.764 -10.276 1.00 0.00 N ATOM 740 CA LEU A 51 87.422 -0.308 -10.236 1.00 0.00 C ATOM 741 C LEU A 51 86.364 0.184 -11.206 1.00 0.00 C ATOM 742 O LEU A 51 85.447 0.896 -10.813 1.00 0.00 O ATOM 743 CB LEU A 51 88.779 0.319 -10.584 1.00 0.00 C ATOM 744 CG LEU A 51 88.747 1.842 -10.354 1.00 0.00 C ATOM 745 CD1 LEU A 51 88.763 2.165 -8.850 1.00 0.00 C ATOM 746 CD2 LEU A 51 89.972 2.470 -11.026 1.00 0.00 C ATOM 0 H LEU A 51 88.413 -2.123 -10.626 1.00 0.00 H new ATOM 0 HA LEU A 51 87.132 -0.010 -9.229 1.00 0.00 H new ATOM 0 HB2 LEU A 51 89.561 -0.130 -9.972 1.00 0.00 H new ATOM 0 HB3 LEU A 51 89.027 0.108 -11.624 1.00 0.00 H new ATOM 0 HG LEU A 51 87.831 2.248 -10.783 1.00 0.00 H new ATOM 0 HD11 LEU A 51 88.740 3.246 -8.710 1.00 0.00 H new ATOM 0 HD12 LEU A 51 87.891 1.718 -8.373 1.00 0.00 H new ATOM 0 HD13 LEU A 51 89.670 1.760 -8.401 1.00 0.00 H new ATOM 0 HD21 LEU A 51 89.960 3.549 -10.870 1.00 0.00 H new ATOM 0 HD22 LEU A 51 90.880 2.051 -10.592 1.00 0.00 H new ATOM 0 HD23 LEU A 51 89.949 2.258 -12.095 1.00 0.00 H new ATOM 758 N LYS A 52 86.492 -0.200 -12.468 1.00 0.00 N ATOM 759 CA LYS A 52 85.530 0.218 -13.477 1.00 0.00 C ATOM 760 C LYS A 52 84.126 -0.235 -13.103 1.00 0.00 C ATOM 761 O LYS A 52 83.174 0.514 -13.241 1.00 0.00 O ATOM 762 CB LYS A 52 85.916 -0.365 -14.838 1.00 0.00 C ATOM 763 CG LYS A 52 87.335 0.087 -15.217 1.00 0.00 C ATOM 764 CD LYS A 52 87.378 1.617 -15.497 1.00 0.00 C ATOM 765 CE LYS A 52 88.069 2.359 -14.342 1.00 0.00 C ATOM 766 NZ LYS A 52 89.546 2.224 -14.480 1.00 0.00 N ATOM 0 H LYS A 52 87.245 -0.794 -12.815 1.00 0.00 H new ATOM 0 HA LYS A 52 85.540 1.307 -13.533 1.00 0.00 H new ATOM 0 HB2 LYS A 52 85.869 -1.453 -14.804 1.00 0.00 H new ATOM 0 HB3 LYS A 52 85.206 -0.039 -15.598 1.00 0.00 H new ATOM 0 HG2 LYS A 52 88.026 -0.158 -14.410 1.00 0.00 H new ATOM 0 HG3 LYS A 52 87.670 -0.457 -16.100 1.00 0.00 H new ATOM 0 HD2 LYS A 52 87.911 1.807 -16.429 1.00 0.00 H new ATOM 0 HD3 LYS A 52 86.365 1.997 -15.626 1.00 0.00 H new ATOM 0 HE2 LYS A 52 87.787 3.412 -14.351 1.00 0.00 H new ATOM 0 HE3 LYS A 52 87.743 1.950 -13.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 90.012 3.047 -14.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 89.862 1.357 -14.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 89.797 2.174 -15.488 1.00 0.00 H new ATOM 780 N THR A 53 83.996 -1.464 -12.638 1.00 0.00 N ATOM 781 CA THR A 53 82.684 -1.985 -12.272 1.00 0.00 C ATOM 782 C THR A 53 82.023 -1.163 -11.159 1.00 0.00 C ATOM 783 O THR A 53 80.856 -0.781 -11.267 1.00 0.00 O ATOM 784 CB THR A 53 82.817 -3.440 -11.810 1.00 0.00 C ATOM 785 OG1 THR A 53 83.331 -4.228 -12.873 1.00 0.00 O ATOM 786 CG2 THR A 53 81.445 -3.974 -11.393 1.00 0.00 C ATOM 0 H THR A 53 84.769 -2.116 -12.505 1.00 0.00 H new ATOM 0 HA THR A 53 82.051 -1.921 -13.157 1.00 0.00 H new ATOM 0 HB THR A 53 83.497 -3.490 -10.959 1.00 0.00 H new ATOM 0 HG1 THR A 53 84.286 -4.042 -12.986 1.00 0.00 H new ATOM 0 HG21 THR A 53 81.542 -5.009 -11.065 1.00 0.00 H new ATOM 0 HG22 THR A 53 81.052 -3.369 -10.576 1.00 0.00 H new ATOM 0 HG23 THR A 53 80.762 -3.925 -12.241 1.00 0.00 H new ATOM 794 N ILE A 54 82.753 -0.928 -10.073 1.00 0.00 N ATOM 795 CA ILE A 54 82.192 -0.200 -8.937 1.00 0.00 C ATOM 796 C ILE A 54 81.937 1.279 -9.224 1.00 0.00 C ATOM 797 O ILE A 54 80.905 1.805 -8.825 1.00 0.00 O ATOM 798 CB ILE A 54 83.114 -0.340 -7.723 1.00 0.00 C ATOM 799 CG1 ILE A 54 83.192 -1.813 -7.313 1.00 0.00 C ATOM 800 CG2 ILE A 54 82.558 0.481 -6.555 1.00 0.00 C ATOM 801 CD1 ILE A 54 84.306 -2.000 -6.281 1.00 0.00 C ATOM 0 H ILE A 54 83.721 -1.226 -9.954 1.00 0.00 H new ATOM 0 HA ILE A 54 81.220 -0.649 -8.733 1.00 0.00 H new ATOM 0 HB ILE A 54 84.108 0.024 -7.981 1.00 0.00 H new ATOM 0 HG12 ILE A 54 82.238 -2.136 -6.896 1.00 0.00 H new ATOM 0 HG13 ILE A 54 83.384 -2.435 -8.187 1.00 0.00 H new ATOM 0 HG21 ILE A 54 83.217 0.379 -5.693 1.00 0.00 H new ATOM 0 HG22 ILE A 54 82.498 1.530 -6.844 1.00 0.00 H new ATOM 0 HG23 ILE A 54 81.563 0.118 -6.297 1.00 0.00 H new ATOM 0 HD11 ILE A 54 84.360 -3.049 -5.990 1.00 0.00 H new ATOM 0 HD12 ILE A 54 85.258 -1.694 -6.714 1.00 0.00 H new ATOM 0 HD13 ILE A 54 84.094 -1.390 -5.403 1.00 0.00 H new ATOM 813 N VAL A 55 82.873 1.961 -9.869 1.00 0.00 N ATOM 814 CA VAL A 55 82.688 3.388 -10.140 1.00 0.00 C ATOM 815 C VAL A 55 81.709 3.627 -11.294 1.00 0.00 C ATOM 816 O VAL A 55 81.022 4.646 -11.328 1.00 0.00 O ATOM 817 CB VAL A 55 84.032 4.053 -10.459 1.00 0.00 C ATOM 818 CG1 VAL A 55 85.055 3.696 -9.376 1.00 0.00 C ATOM 819 CG2 VAL A 55 84.535 3.578 -11.828 1.00 0.00 C ATOM 0 H VAL A 55 83.750 1.566 -10.209 1.00 0.00 H new ATOM 0 HA VAL A 55 82.266 3.834 -9.240 1.00 0.00 H new ATOM 0 HB VAL A 55 83.900 5.135 -10.484 1.00 0.00 H new ATOM 0 HG11 VAL A 55 86.009 4.170 -9.606 1.00 0.00 H new ATOM 0 HG12 VAL A 55 84.698 4.049 -8.408 1.00 0.00 H new ATOM 0 HG13 VAL A 55 85.186 2.614 -9.342 1.00 0.00 H new ATOM 0 HG21 VAL A 55 85.490 4.054 -12.050 1.00 0.00 H new ATOM 0 HG22 VAL A 55 84.663 2.496 -11.813 1.00 0.00 H new ATOM 0 HG23 VAL A 55 83.809 3.847 -12.596 1.00 0.00 H new ATOM 829 N LEU A 56 81.672 2.702 -12.248 1.00 0.00 N ATOM 830 CA LEU A 56 80.800 2.844 -13.412 1.00 0.00 C ATOM 831 C LEU A 56 79.325 2.557 -13.101 1.00 0.00 C ATOM 832 O LEU A 56 78.444 3.204 -13.667 1.00 0.00 O ATOM 833 CB LEU A 56 81.281 1.910 -14.529 1.00 0.00 C ATOM 834 CG LEU A 56 80.542 2.210 -15.853 1.00 0.00 C ATOM 835 CD1 LEU A 56 81.252 3.342 -16.606 1.00 0.00 C ATOM 836 CD2 LEU A 56 80.539 0.956 -16.735 1.00 0.00 C ATOM 0 H LEU A 56 82.232 1.850 -12.240 1.00 0.00 H new ATOM 0 HA LEU A 56 80.859 3.886 -13.728 1.00 0.00 H new ATOM 0 HB2 LEU A 56 82.355 2.030 -14.672 1.00 0.00 H new ATOM 0 HB3 LEU A 56 81.112 0.873 -14.240 1.00 0.00 H new ATOM 0 HG LEU A 56 79.519 2.509 -15.625 1.00 0.00 H new ATOM 0 HD11 LEU A 56 80.724 3.546 -17.538 1.00 0.00 H new ATOM 0 HD12 LEU A 56 81.260 4.240 -15.989 1.00 0.00 H new ATOM 0 HD13 LEU A 56 82.277 3.045 -16.827 1.00 0.00 H new ATOM 0 HD21 LEU A 56 80.018 1.169 -17.668 1.00 0.00 H new ATOM 0 HD22 LEU A 56 81.566 0.661 -16.952 1.00 0.00 H new ATOM 0 HD23 LEU A 56 80.031 0.145 -16.213 1.00 0.00 H new ATOM 848 N ILE A 57 79.037 1.571 -12.252 1.00 0.00 N ATOM 849 CA ILE A 57 77.635 1.237 -11.976 1.00 0.00 C ATOM 850 C ILE A 57 76.859 2.413 -11.349 1.00 0.00 C ATOM 851 O ILE A 57 75.783 2.758 -11.836 1.00 0.00 O ATOM 852 CB ILE A 57 77.552 -0.050 -11.100 1.00 0.00 C ATOM 853 CG1 ILE A 57 77.398 -1.307 -11.990 1.00 0.00 C ATOM 854 CG2 ILE A 57 76.346 0.000 -10.144 1.00 0.00 C ATOM 855 CD1 ILE A 57 78.376 -1.281 -13.175 1.00 0.00 C ATOM 0 H ILE A 57 79.727 1.005 -11.757 1.00 0.00 H new ATOM 0 HA ILE A 57 77.147 1.036 -12.930 1.00 0.00 H new ATOM 0 HB ILE A 57 78.477 -0.101 -10.525 1.00 0.00 H new ATOM 0 HG12 ILE A 57 77.573 -2.201 -11.392 1.00 0.00 H new ATOM 0 HG13 ILE A 57 76.375 -1.368 -12.362 1.00 0.00 H new ATOM 0 HG21 ILE A 57 76.317 -0.912 -9.547 1.00 0.00 H new ATOM 0 HG22 ILE A 57 76.440 0.862 -9.484 1.00 0.00 H new ATOM 0 HG23 ILE A 57 75.426 0.085 -10.723 1.00 0.00 H new ATOM 0 HD11 ILE A 57 78.240 -2.178 -13.779 1.00 0.00 H new ATOM 0 HD12 ILE A 57 78.183 -0.400 -13.787 1.00 0.00 H new ATOM 0 HD13 ILE A 57 79.399 -1.246 -12.801 1.00 0.00 H new ATOM 867 N PRO A 58 77.345 3.025 -10.298 1.00 0.00 N ATOM 868 CA PRO A 58 76.622 4.157 -9.651 1.00 0.00 C ATOM 869 C PRO A 58 76.691 5.418 -10.505 1.00 0.00 C ATOM 870 O PRO A 58 75.796 6.262 -10.467 1.00 0.00 O ATOM 871 CB PRO A 58 77.343 4.332 -8.308 1.00 0.00 C ATOM 872 CG PRO A 58 78.731 3.826 -8.548 1.00 0.00 C ATOM 873 CD PRO A 58 78.618 2.733 -9.622 1.00 0.00 C ATOM 0 HA PRO A 58 75.557 3.963 -9.524 1.00 0.00 H new ATOM 0 HB2 PRO A 58 77.351 5.377 -7.997 1.00 0.00 H new ATOM 0 HB3 PRO A 58 76.848 3.768 -7.517 1.00 0.00 H new ATOM 0 HG2 PRO A 58 79.385 4.632 -8.882 1.00 0.00 H new ATOM 0 HG3 PRO A 58 79.162 3.425 -7.630 1.00 0.00 H new ATOM 0 HD2 PRO A 58 79.456 2.769 -10.318 1.00 0.00 H new ATOM 0 HD3 PRO A 58 78.615 1.737 -9.179 1.00 0.00 H new ATOM 881 N PHE A 59 77.765 5.530 -11.274 1.00 0.00 N ATOM 882 CA PHE A 59 77.967 6.669 -12.139 1.00 0.00 C ATOM 883 C PHE A 59 76.926 6.670 -13.260 1.00 0.00 C ATOM 884 O PHE A 59 76.223 7.658 -13.463 1.00 0.00 O ATOM 885 CB PHE A 59 79.381 6.602 -12.734 1.00 0.00 C ATOM 886 CG PHE A 59 80.422 7.156 -11.771 1.00 0.00 C ATOM 887 CD1 PHE A 59 80.222 7.131 -10.377 1.00 0.00 C ATOM 888 CD2 PHE A 59 81.606 7.698 -12.288 1.00 0.00 C ATOM 889 CE1 PHE A 59 81.203 7.647 -9.520 1.00 0.00 C ATOM 890 CE2 PHE A 59 82.583 8.213 -11.429 1.00 0.00 C ATOM 891 CZ PHE A 59 82.381 8.187 -10.045 1.00 0.00 C ATOM 0 H PHE A 59 78.512 4.836 -11.312 1.00 0.00 H new ATOM 0 HA PHE A 59 77.856 7.588 -11.563 1.00 0.00 H new ATOM 0 HB2 PHE A 59 79.625 5.568 -12.979 1.00 0.00 H new ATOM 0 HB3 PHE A 59 79.411 7.166 -13.666 1.00 0.00 H new ATOM 0 HD1 PHE A 59 79.313 6.714 -9.969 1.00 0.00 H new ATOM 0 HD2 PHE A 59 81.766 7.718 -13.356 1.00 0.00 H new ATOM 0 HE1 PHE A 59 81.049 7.628 -8.451 1.00 0.00 H new ATOM 0 HE2 PHE A 59 83.493 8.630 -11.834 1.00 0.00 H new ATOM 0 HZ PHE A 59 83.135 8.584 -9.382 1.00 0.00 H new ATOM 901 N LEU A 60 76.836 5.556 -13.985 1.00 0.00 N ATOM 902 CA LEU A 60 75.878 5.451 -15.081 1.00 0.00 C ATOM 903 C LEU A 60 74.476 5.181 -14.538 1.00 0.00 C ATOM 904 O LEU A 60 73.611 4.674 -15.251 1.00 0.00 O ATOM 905 CB LEU A 60 76.297 4.322 -16.036 1.00 0.00 C ATOM 906 CG LEU A 60 77.426 4.796 -16.974 1.00 0.00 C ATOM 907 CD1 LEU A 60 76.889 5.784 -18.029 1.00 0.00 C ATOM 908 CD2 LEU A 60 78.533 5.471 -16.151 1.00 0.00 C ATOM 0 H LEU A 60 77.407 4.724 -13.835 1.00 0.00 H new ATOM 0 HA LEU A 60 75.865 6.395 -15.626 1.00 0.00 H new ATOM 0 HB2 LEU A 60 76.632 3.458 -15.462 1.00 0.00 H new ATOM 0 HB3 LEU A 60 75.439 3.999 -16.625 1.00 0.00 H new ATOM 0 HG LEU A 60 77.830 3.926 -17.491 1.00 0.00 H new ATOM 0 HD11 LEU A 60 77.705 6.103 -18.678 1.00 0.00 H new ATOM 0 HD12 LEU A 60 76.120 5.295 -18.627 1.00 0.00 H new ATOM 0 HD13 LEU A 60 76.462 6.653 -17.529 1.00 0.00 H new ATOM 0 HD21 LEU A 60 79.329 5.805 -16.817 1.00 0.00 H new ATOM 0 HD22 LEU A 60 78.120 6.329 -15.620 1.00 0.00 H new ATOM 0 HD23 LEU A 60 78.937 4.759 -15.431 1.00 0.00 H new ATOM 920 N GLU A 61 74.257 5.529 -13.271 1.00 0.00 N ATOM 921 CA GLU A 61 72.953 5.325 -12.636 1.00 0.00 C ATOM 922 C GLU A 61 72.693 6.404 -11.590 1.00 0.00 C ATOM 923 O GLU A 61 73.623 7.046 -11.101 1.00 0.00 O ATOM 924 CB GLU A 61 72.901 3.949 -11.970 1.00 0.00 C ATOM 925 CG GLU A 61 72.925 2.857 -13.041 1.00 0.00 C ATOM 926 CD GLU A 61 72.681 1.495 -12.401 1.00 0.00 C ATOM 927 OE1 GLU A 61 72.398 1.463 -11.214 1.00 0.00 O ATOM 928 OE2 GLU A 61 72.778 0.505 -13.106 1.00 0.00 O ATOM 0 H GLU A 61 74.961 5.951 -12.665 1.00 0.00 H new ATOM 0 HA GLU A 61 72.184 5.384 -13.407 1.00 0.00 H new ATOM 0 HB2 GLU A 61 73.748 3.829 -11.295 1.00 0.00 H new ATOM 0 HB3 GLU A 61 71.998 3.860 -11.366 1.00 0.00 H new ATOM 0 HG2 GLU A 61 72.162 3.057 -13.793 1.00 0.00 H new ATOM 0 HG3 GLU A 61 73.887 2.860 -13.554 1.00 0.00 H new ATOM 935 N GLN A 62 71.423 6.596 -11.249 1.00 0.00 N ATOM 936 CA GLN A 62 71.049 7.600 -10.258 1.00 0.00 C ATOM 937 C GLN A 62 71.548 7.193 -8.875 1.00 0.00 C ATOM 938 O GLN A 62 72.044 8.023 -8.114 1.00 0.00 O ATOM 939 CB GLN A 62 69.525 7.763 -10.231 1.00 0.00 C ATOM 940 CG GLN A 62 69.143 9.018 -9.436 1.00 0.00 C ATOM 941 CD GLN A 62 69.345 8.776 -7.944 1.00 0.00 C ATOM 942 OE1 GLN A 62 68.813 7.813 -7.392 1.00 0.00 O ATOM 943 NE2 GLN A 62 70.089 9.597 -7.255 1.00 0.00 N ATOM 0 H GLN A 62 70.639 6.074 -11.641 1.00 0.00 H new ATOM 0 HA GLN A 62 71.509 8.549 -10.532 1.00 0.00 H new ATOM 0 HB2 GLN A 62 69.141 7.837 -11.249 1.00 0.00 H new ATOM 0 HB3 GLN A 62 69.065 6.884 -9.780 1.00 0.00 H new ATOM 0 HG2 GLN A 62 69.751 9.862 -9.761 1.00 0.00 H new ATOM 0 HG3 GLN A 62 68.103 9.280 -9.632 1.00 0.00 H new ATOM 0 HE21 GLN A 62 70.529 10.394 -7.714 1.00 0.00 H new ATOM 0 HE22 GLN A 62 70.231 9.441 -6.257 1.00 0.00 H new ATOM 952 N ASN A 63 71.412 5.909 -8.555 1.00 0.00 N ATOM 953 CA ASN A 63 71.852 5.405 -7.259 1.00 0.00 C ATOM 954 C ASN A 63 72.024 3.890 -7.304 1.00 0.00 C ATOM 955 CB ASN A 63 70.831 5.774 -6.181 1.00 0.00 C ATOM 956 CG ASN A 63 69.529 5.015 -6.414 1.00 0.00 C ATOM 957 OD1 ASN A 63 69.214 4.081 -5.679 1.00 0.00 O ATOM 958 ND2 ASN A 63 68.751 5.364 -7.402 1.00 0.00 N ATOM 0 H ASN A 63 71.004 5.205 -9.170 1.00 0.00 H new ATOM 0 HA ASN A 63 72.813 5.861 -7.020 1.00 0.00 H new ATOM 0 HB2 ASN A 63 71.229 5.536 -5.195 1.00 0.00 H new ATOM 0 HB3 ASN A 63 70.644 6.848 -6.198 1.00 0.00 H new ATOM 0 HD21 ASN A 63 67.879 4.862 -7.566 1.00 0.00 H new ATOM 0 HD22 ASN A 63 69.015 6.139 -8.010 1.00 0.00 H new TER 965 ASN A 63 ATOM 966 N CYS B 1 72.528 23.034 -14.656 1.00 0.00 N ATOM 967 CA CYS B 1 71.673 21.826 -14.828 1.00 0.00 C ATOM 968 C CYS B 1 72.417 20.602 -14.304 1.00 0.00 C ATOM 969 O CYS B 1 72.515 19.585 -14.990 1.00 0.00 O ATOM 970 CB CYS B 1 71.346 21.642 -16.312 1.00 0.00 C ATOM 971 SG CYS B 1 70.874 23.236 -17.028 1.00 0.00 S ATOM 0 H1 CYS B 1 72.372 23.686 -15.451 1.00 0.00 H new ATOM 0 H2 CYS B 1 72.282 23.510 -13.764 1.00 0.00 H new ATOM 0 H3 CYS B 1 73.528 22.751 -14.632 1.00 0.00 H new ATOM 0 HA CYS B 1 70.745 21.948 -14.269 1.00 0.00 H new ATOM 0 HB2 CYS B 1 72.210 21.236 -16.838 1.00 0.00 H new ATOM 0 HB3 CYS B 1 70.535 20.924 -16.430 1.00 0.00 H new ATOM 975 N SER B 2 72.937 20.708 -13.085 1.00 0.00 N ATOM 976 CA SER B 2 73.671 19.603 -12.477 1.00 0.00 C ATOM 977 C SER B 2 74.915 19.269 -13.296 1.00 0.00 C ATOM 978 O SER B 2 76.040 19.533 -12.870 1.00 0.00 O ATOM 979 CB SER B 2 72.773 18.369 -12.379 1.00 0.00 C ATOM 980 OG SER B 2 73.332 17.454 -11.445 1.00 0.00 O ATOM 0 H SER B 2 72.865 21.542 -12.502 1.00 0.00 H new ATOM 0 HA SER B 2 73.981 19.905 -11.477 1.00 0.00 H new ATOM 0 HB2 SER B 2 71.770 18.659 -12.066 1.00 0.00 H new ATOM 0 HB3 SER B 2 72.678 17.896 -13.356 1.00 0.00 H new ATOM 0 HG SER B 2 72.758 16.663 -11.379 1.00 0.00 H new ATOM 986 N THR B 3 74.704 18.690 -14.473 1.00 0.00 N ATOM 987 CA THR B 3 75.813 18.326 -15.348 1.00 0.00 C ATOM 988 C THR B 3 76.775 17.376 -14.639 1.00 0.00 C ATOM 989 O THR B 3 77.939 17.708 -14.415 1.00 0.00 O ATOM 990 CB THR B 3 76.568 19.582 -15.787 1.00 0.00 C ATOM 991 OG1 THR B 3 77.418 20.016 -14.734 1.00 0.00 O ATOM 992 CG2 THR B 3 75.567 20.688 -16.125 1.00 0.00 C ATOM 0 H THR B 3 73.780 18.463 -14.842 1.00 0.00 H new ATOM 0 HA THR B 3 75.404 17.821 -16.223 1.00 0.00 H new ATOM 0 HB THR B 3 77.168 19.355 -16.668 1.00 0.00 H new ATOM 0 HG1 THR B 3 77.344 19.397 -13.978 1.00 0.00 H new ATOM 0 HG21 THR B 3 76.105 21.583 -16.438 1.00 0.00 H new ATOM 0 HG22 THR B 3 74.916 20.355 -16.933 1.00 0.00 H new ATOM 0 HG23 THR B 3 74.965 20.916 -15.245 1.00 0.00 H new ATOM 1000 N VAL B 4 76.281 16.191 -14.294 1.00 0.00 N ATOM 1001 CA VAL B 4 77.108 15.197 -13.617 1.00 0.00 C ATOM 1002 C VAL B 4 78.072 14.549 -14.604 1.00 0.00 C ATOM 1003 O VAL B 4 79.201 14.207 -14.255 1.00 0.00 O ATOM 1004 CB VAL B 4 76.221 14.123 -12.985 1.00 0.00 C ATOM 1005 CG1 VAL B 4 75.245 14.778 -12.006 1.00 0.00 C ATOM 1006 CG2 VAL B 4 75.432 13.404 -14.083 1.00 0.00 C ATOM 0 H VAL B 4 75.320 15.897 -14.470 1.00 0.00 H new ATOM 0 HA VAL B 4 77.683 15.696 -12.837 1.00 0.00 H new ATOM 0 HB VAL B 4 76.844 13.405 -12.452 1.00 0.00 H new ATOM 0 HG11 VAL B 4 74.613 14.013 -11.556 1.00 0.00 H new ATOM 0 HG12 VAL B 4 75.804 15.293 -11.225 1.00 0.00 H new ATOM 0 HG13 VAL B 4 74.622 15.496 -12.539 1.00 0.00 H new ATOM 0 HG21 VAL B 4 74.799 12.638 -13.634 1.00 0.00 H new ATOM 0 HG22 VAL B 4 74.809 14.124 -14.614 1.00 0.00 H new ATOM 0 HG23 VAL B 4 76.125 12.938 -14.783 1.00 0.00 H new ATOM 1016 N SER B 5 77.614 14.382 -15.841 1.00 0.00 N ATOM 1017 CA SER B 5 78.435 13.776 -16.883 1.00 0.00 C ATOM 1018 C SER B 5 79.893 14.247 -16.793 1.00 0.00 C ATOM 1019 O SER B 5 80.794 13.435 -16.582 1.00 0.00 O ATOM 1020 CB SER B 5 77.850 14.109 -18.265 1.00 0.00 C ATOM 1021 OG SER B 5 78.901 14.420 -19.172 1.00 0.00 O ATOM 0 H SER B 5 76.680 14.657 -16.146 1.00 0.00 H new ATOM 0 HA SER B 5 78.428 12.696 -16.738 1.00 0.00 H new ATOM 0 HB2 SER B 5 77.273 13.263 -18.639 1.00 0.00 H new ATOM 0 HB3 SER B 5 77.164 14.953 -18.186 1.00 0.00 H new ATOM 0 HG SER B 5 78.523 14.630 -20.051 1.00 0.00 H new ATOM 1027 N PRO B 6 80.150 15.525 -16.952 1.00 0.00 N ATOM 1028 CA PRO B 6 81.542 16.072 -16.886 1.00 0.00 C ATOM 1029 C PRO B 6 82.189 15.857 -15.514 1.00 0.00 C ATOM 1030 O PRO B 6 83.251 16.410 -15.227 1.00 0.00 O ATOM 1031 CB PRO B 6 81.369 17.570 -17.206 1.00 0.00 C ATOM 1032 CG PRO B 6 79.937 17.870 -16.897 1.00 0.00 C ATOM 1033 CD PRO B 6 79.163 16.590 -17.210 1.00 0.00 C ATOM 0 HA PRO B 6 82.212 15.568 -17.582 1.00 0.00 H new ATOM 0 HB2 PRO B 6 82.039 18.182 -16.603 1.00 0.00 H new ATOM 0 HB3 PRO B 6 81.599 17.779 -18.251 1.00 0.00 H new ATOM 0 HG2 PRO B 6 79.814 18.155 -15.852 1.00 0.00 H new ATOM 0 HG3 PRO B 6 79.574 18.703 -17.499 1.00 0.00 H new ATOM 0 HD2 PRO B 6 78.284 16.486 -16.574 1.00 0.00 H new ATOM 0 HD3 PRO B 6 78.814 16.573 -18.242 1.00 0.00 H new ATOM 1041 N GLY B 7 81.543 15.048 -14.672 1.00 0.00 N ATOM 1042 CA GLY B 7 82.062 14.755 -13.330 1.00 0.00 C ATOM 1043 C GLY B 7 82.334 13.261 -13.163 1.00 0.00 C ATOM 1044 O GLY B 7 83.480 12.839 -13.004 1.00 0.00 O ATOM 0 H GLY B 7 80.662 14.584 -14.893 1.00 0.00 H new ATOM 0 HA2 GLY B 7 82.981 15.317 -13.161 1.00 0.00 H new ATOM 0 HA3 GLY B 7 81.344 15.084 -12.579 1.00 0.00 H new ATOM 1048 N VAL B 8 81.274 12.463 -13.201 1.00 0.00 N ATOM 1049 CA VAL B 8 81.409 11.017 -13.052 1.00 0.00 C ATOM 1050 C VAL B 8 82.288 10.446 -14.174 1.00 0.00 C ATOM 1051 O VAL B 8 83.270 9.733 -13.921 1.00 0.00 O ATOM 1052 CB VAL B 8 80.004 10.370 -13.072 1.00 0.00 C ATOM 1053 CG1 VAL B 8 79.449 10.267 -11.644 1.00 0.00 C ATOM 1054 CG2 VAL B 8 79.049 11.230 -13.913 1.00 0.00 C ATOM 0 H VAL B 8 80.316 12.789 -13.333 1.00 0.00 H new ATOM 0 HA VAL B 8 81.891 10.792 -12.101 1.00 0.00 H new ATOM 0 HB VAL B 8 80.086 9.373 -13.505 1.00 0.00 H new ATOM 0 HG11 VAL B 8 78.460 9.810 -11.670 1.00 0.00 H new ATOM 0 HG12 VAL B 8 80.116 9.654 -11.038 1.00 0.00 H new ATOM 0 HG13 VAL B 8 79.377 11.264 -11.209 1.00 0.00 H new ATOM 0 HG21 VAL B 8 78.061 10.771 -13.925 1.00 0.00 H new ATOM 0 HG22 VAL B 8 78.981 12.228 -13.479 1.00 0.00 H new ATOM 0 HG23 VAL B 8 79.427 11.303 -14.933 1.00 0.00 H new ATOM 1064 N LEU B 9 81.946 10.775 -15.411 1.00 0.00 N ATOM 1065 CA LEU B 9 82.723 10.301 -16.545 1.00 0.00 C ATOM 1066 C LEU B 9 84.157 10.820 -16.418 1.00 0.00 C ATOM 1067 O LEU B 9 85.129 10.121 -16.752 1.00 0.00 O ATOM 1068 CB LEU B 9 82.060 10.754 -17.848 1.00 0.00 C ATOM 1069 CG LEU B 9 80.543 10.496 -17.754 1.00 0.00 C ATOM 1070 CD1 LEU B 9 79.870 10.783 -19.101 1.00 0.00 C ATOM 1071 CD2 LEU B 9 80.282 9.034 -17.353 1.00 0.00 C ATOM 0 H LEU B 9 81.146 11.360 -15.653 1.00 0.00 H new ATOM 0 HA LEU B 9 82.758 9.212 -16.558 1.00 0.00 H new ATOM 0 HB2 LEU B 9 82.252 11.813 -18.020 1.00 0.00 H new ATOM 0 HB3 LEU B 9 82.483 10.212 -18.694 1.00 0.00 H new ATOM 0 HG LEU B 9 80.125 11.160 -16.997 1.00 0.00 H new ATOM 0 HD11 LEU B 9 78.799 10.597 -19.020 1.00 0.00 H new ATOM 0 HD12 LEU B 9 80.037 11.824 -19.377 1.00 0.00 H new ATOM 0 HD13 LEU B 9 80.295 10.133 -19.866 1.00 0.00 H new ATOM 0 HD21 LEU B 9 79.208 8.861 -17.289 1.00 0.00 H new ATOM 0 HD22 LEU B 9 80.713 8.369 -18.101 1.00 0.00 H new ATOM 0 HD23 LEU B 9 80.740 8.835 -16.384 1.00 0.00 H new ATOM 1083 N ALA B 10 84.286 12.032 -15.872 1.00 0.00 N ATOM 1084 CA ALA B 10 85.602 12.610 -15.643 1.00 0.00 C ATOM 1085 C ALA B 10 86.382 11.665 -14.728 1.00 0.00 C ATOM 1086 O ALA B 10 87.596 11.476 -14.862 1.00 0.00 O ATOM 1087 CB ALA B 10 85.468 13.990 -14.985 1.00 0.00 C ATOM 0 H ALA B 10 83.504 12.621 -15.586 1.00 0.00 H new ATOM 0 HA ALA B 10 86.126 12.736 -16.590 1.00 0.00 H new ATOM 0 HB1 ALA B 10 86.459 14.412 -14.819 1.00 0.00 H new ATOM 0 HB2 ALA B 10 84.897 14.651 -15.638 1.00 0.00 H new ATOM 0 HB3 ALA B 10 84.952 13.889 -14.030 1.00 0.00 H new ATOM 1093 N GLY B 11 85.647 11.059 -13.798 1.00 0.00 N ATOM 1094 CA GLY B 11 86.236 10.121 -12.858 1.00 0.00 C ATOM 1095 C GLY B 11 86.774 8.896 -13.586 1.00 0.00 C ATOM 1096 O GLY B 11 87.848 8.399 -13.256 1.00 0.00 O ATOM 0 H GLY B 11 84.644 11.204 -13.679 1.00 0.00 H new ATOM 0 HA2 GLY B 11 87.042 10.607 -12.309 1.00 0.00 H new ATOM 0 HA3 GLY B 11 85.489 9.816 -12.125 1.00 0.00 H new ATOM 1100 N ILE B 12 86.031 8.408 -14.581 1.00 0.00 N ATOM 1101 CA ILE B 12 86.486 7.245 -15.325 1.00 0.00 C ATOM 1102 C ILE B 12 87.847 7.525 -15.947 1.00 0.00 C ATOM 1103 O ILE B 12 88.755 6.698 -15.862 1.00 0.00 O ATOM 1104 CB ILE B 12 85.472 6.887 -16.414 1.00 0.00 C ATOM 1105 CG1 ILE B 12 84.084 6.723 -15.771 1.00 0.00 C ATOM 1106 CG2 ILE B 12 85.892 5.588 -17.130 1.00 0.00 C ATOM 1107 CD1 ILE B 12 84.103 5.644 -14.687 1.00 0.00 C ATOM 0 H ILE B 12 85.135 8.792 -14.881 1.00 0.00 H new ATOM 0 HA ILE B 12 86.578 6.401 -14.641 1.00 0.00 H new ATOM 0 HB ILE B 12 85.435 7.685 -17.156 1.00 0.00 H new ATOM 0 HG12 ILE B 12 83.766 7.672 -15.339 1.00 0.00 H new ATOM 0 HG13 ILE B 12 83.354 6.461 -16.537 1.00 0.00 H new ATOM 0 HG21 ILE B 12 85.162 5.346 -17.902 1.00 0.00 H new ATOM 0 HG22 ILE B 12 86.872 5.725 -17.588 1.00 0.00 H new ATOM 0 HG23 ILE B 12 85.940 4.773 -16.407 1.00 0.00 H new ATOM 0 HD11 ILE B 12 83.109 5.550 -14.250 1.00 0.00 H new ATOM 0 HD12 ILE B 12 84.398 4.691 -15.127 1.00 0.00 H new ATOM 0 HD13 ILE B 12 84.816 5.921 -13.910 1.00 0.00 H new ATOM 1119 N VAL B 13 87.999 8.696 -16.564 1.00 0.00 N ATOM 1120 CA VAL B 13 89.290 9.033 -17.171 1.00 0.00 C ATOM 1121 C VAL B 13 90.382 8.966 -16.103 1.00 0.00 C ATOM 1122 O VAL B 13 91.452 8.402 -16.335 1.00 0.00 O ATOM 1123 CB VAL B 13 89.256 10.425 -17.876 1.00 0.00 C ATOM 1124 CG1 VAL B 13 87.810 10.858 -18.062 1.00 0.00 C ATOM 1125 CG2 VAL B 13 89.987 11.512 -17.068 1.00 0.00 C ATOM 0 H VAL B 13 87.273 9.407 -16.657 1.00 0.00 H new ATOM 0 HA VAL B 13 89.512 8.304 -17.950 1.00 0.00 H new ATOM 0 HB VAL B 13 89.765 10.314 -18.834 1.00 0.00 H new ATOM 0 HG11 VAL B 13 87.782 11.830 -18.554 1.00 0.00 H new ATOM 0 HG12 VAL B 13 87.287 10.125 -18.676 1.00 0.00 H new ATOM 0 HG13 VAL B 13 87.324 10.930 -17.089 1.00 0.00 H new ATOM 0 HG21 VAL B 13 89.934 12.460 -17.603 1.00 0.00 H new ATOM 0 HG22 VAL B 13 89.515 11.619 -16.091 1.00 0.00 H new ATOM 0 HG23 VAL B 13 91.031 11.228 -16.937 1.00 0.00 H new ATOM 1135 N VAL B 14 90.102 9.530 -14.927 1.00 0.00 N ATOM 1136 CA VAL B 14 91.079 9.498 -13.842 1.00 0.00 C ATOM 1137 C VAL B 14 91.450 8.050 -13.537 1.00 0.00 C ATOM 1138 O VAL B 14 92.619 7.725 -13.321 1.00 0.00 O ATOM 1139 CB VAL B 14 90.509 10.169 -12.585 1.00 0.00 C ATOM 1140 CG1 VAL B 14 91.475 9.976 -11.413 1.00 0.00 C ATOM 1141 CG2 VAL B 14 90.323 11.667 -12.843 1.00 0.00 C ATOM 0 H VAL B 14 89.226 10.004 -14.706 1.00 0.00 H new ATOM 0 HA VAL B 14 91.970 10.045 -14.150 1.00 0.00 H new ATOM 0 HB VAL B 14 89.548 9.716 -12.343 1.00 0.00 H new ATOM 0 HG11 VAL B 14 91.067 10.454 -10.522 1.00 0.00 H new ATOM 0 HG12 VAL B 14 91.610 8.911 -11.224 1.00 0.00 H new ATOM 0 HG13 VAL B 14 92.438 10.426 -11.657 1.00 0.00 H new ATOM 0 HG21 VAL B 14 89.918 12.143 -11.950 1.00 0.00 H new ATOM 0 HG22 VAL B 14 91.285 12.116 -13.089 1.00 0.00 H new ATOM 0 HG23 VAL B 14 89.633 11.810 -13.675 1.00 0.00 H new ATOM 1151 N GLY B 15 90.442 7.184 -13.537 1.00 0.00 N ATOM 1152 CA GLY B 15 90.661 5.768 -13.274 1.00 0.00 C ATOM 1153 C GLY B 15 91.604 5.173 -14.312 1.00 0.00 C ATOM 1154 O GLY B 15 92.494 4.389 -13.982 1.00 0.00 O ATOM 0 H GLY B 15 89.470 7.437 -13.715 1.00 0.00 H new ATOM 0 HA2 GLY B 15 91.080 5.638 -12.276 1.00 0.00 H new ATOM 0 HA3 GLY B 15 89.709 5.237 -13.292 1.00 0.00 H new ATOM 1158 N ASP B 16 91.407 5.558 -15.570 1.00 0.00 N ATOM 1159 CA ASP B 16 92.250 5.062 -16.651 1.00 0.00 C ATOM 1160 C ASP B 16 93.703 5.452 -16.407 1.00 0.00 C ATOM 1161 O ASP B 16 94.615 4.655 -16.623 1.00 0.00 O ATOM 1162 CB ASP B 16 91.781 5.643 -17.987 1.00 0.00 C ATOM 1163 CG ASP B 16 92.415 4.873 -19.139 1.00 0.00 C ATOM 1164 OD1 ASP B 16 92.563 3.669 -19.009 1.00 0.00 O ATOM 1165 OD2 ASP B 16 92.741 5.497 -20.135 1.00 0.00 O ATOM 0 H ASP B 16 90.677 6.207 -15.863 1.00 0.00 H new ATOM 0 HA ASP B 16 92.174 3.975 -16.683 1.00 0.00 H new ATOM 0 HB2 ASP B 16 90.695 5.588 -18.056 1.00 0.00 H new ATOM 0 HB3 ASP B 16 92.052 6.697 -18.050 1.00 0.00 H new ATOM 1170 N LEU B 17 93.907 6.682 -15.951 1.00 0.00 N ATOM 1171 CA LEU B 17 95.253 7.171 -15.674 1.00 0.00 C ATOM 1172 C LEU B 17 95.908 6.316 -14.593 1.00 0.00 C ATOM 1173 O LEU B 17 97.074 5.935 -14.705 1.00 0.00 O ATOM 1174 CB LEU B 17 95.183 8.635 -15.221 1.00 0.00 C ATOM 1175 CG LEU B 17 96.561 9.126 -14.752 1.00 0.00 C ATOM 1176 CD1 LEU B 17 97.611 8.867 -15.840 1.00 0.00 C ATOM 1177 CD2 LEU B 17 96.483 10.629 -14.465 1.00 0.00 C ATOM 0 H LEU B 17 93.164 7.355 -15.766 1.00 0.00 H new ATOM 0 HA LEU B 17 95.854 7.105 -16.581 1.00 0.00 H new ATOM 0 HB2 LEU B 17 94.830 9.258 -16.042 1.00 0.00 H new ATOM 0 HB3 LEU B 17 94.461 8.736 -14.411 1.00 0.00 H new ATOM 0 HG LEU B 17 96.849 8.588 -13.849 1.00 0.00 H new ATOM 0 HD11 LEU B 17 98.584 9.219 -15.498 1.00 0.00 H new ATOM 0 HD12 LEU B 17 97.664 7.798 -16.048 1.00 0.00 H new ATOM 0 HD13 LEU B 17 97.332 9.400 -16.749 1.00 0.00 H new ATOM 0 HD21 LEU B 17 97.457 10.987 -14.131 1.00 0.00 H new ATOM 0 HD22 LEU B 17 96.194 11.158 -15.373 1.00 0.00 H new ATOM 0 HD23 LEU B 17 95.743 10.813 -13.686 1.00 0.00 H new ATOM 1189 N VAL B 18 95.146 6.011 -13.548 1.00 0.00 N ATOM 1190 CA VAL B 18 95.665 5.195 -12.461 1.00 0.00 C ATOM 1191 C VAL B 18 96.142 3.849 -12.999 1.00 0.00 C ATOM 1192 O VAL B 18 97.248 3.408 -12.693 1.00 0.00 O ATOM 1193 CB VAL B 18 94.582 4.991 -11.396 1.00 0.00 C ATOM 1194 CG1 VAL B 18 95.060 3.974 -10.355 1.00 0.00 C ATOM 1195 CG2 VAL B 18 94.303 6.326 -10.702 1.00 0.00 C ATOM 0 H VAL B 18 94.179 6.313 -13.433 1.00 0.00 H new ATOM 0 HA VAL B 18 96.512 5.707 -12.004 1.00 0.00 H new ATOM 0 HB VAL B 18 93.674 4.620 -11.872 1.00 0.00 H new ATOM 0 HG11 VAL B 18 94.285 3.834 -9.601 1.00 0.00 H new ATOM 0 HG12 VAL B 18 95.267 3.022 -10.844 1.00 0.00 H new ATOM 0 HG13 VAL B 18 95.969 4.341 -9.878 1.00 0.00 H new ATOM 0 HG21 VAL B 18 93.533 6.188 -9.943 1.00 0.00 H new ATOM 0 HG22 VAL B 18 95.216 6.689 -10.231 1.00 0.00 H new ATOM 0 HG23 VAL B 18 93.961 7.054 -11.438 1.00 0.00 H new ATOM 1205 N LEU B 19 95.311 3.206 -13.813 1.00 0.00 N ATOM 1206 CA LEU B 19 95.684 1.918 -14.387 1.00 0.00 C ATOM 1207 C LEU B 19 96.928 2.073 -15.250 1.00 0.00 C ATOM 1208 O LEU B 19 97.778 1.191 -15.287 1.00 0.00 O ATOM 1209 CB LEU B 19 94.541 1.350 -15.237 1.00 0.00 C ATOM 1210 CG LEU B 19 93.398 0.851 -14.342 1.00 0.00 C ATOM 1211 CD1 LEU B 19 92.215 0.454 -15.233 1.00 0.00 C ATOM 1212 CD2 LEU B 19 93.855 -0.364 -13.498 1.00 0.00 C ATOM 0 H LEU B 19 94.390 3.548 -14.087 1.00 0.00 H new ATOM 0 HA LEU B 19 95.890 1.228 -13.569 1.00 0.00 H new ATOM 0 HB2 LEU B 19 94.170 2.117 -15.916 1.00 0.00 H new ATOM 0 HB3 LEU B 19 94.911 0.531 -15.853 1.00 0.00 H new ATOM 0 HG LEU B 19 93.101 1.646 -13.657 1.00 0.00 H new ATOM 0 HD11 LEU B 19 91.394 0.097 -14.611 1.00 0.00 H new ATOM 0 HD12 LEU B 19 91.885 1.320 -15.807 1.00 0.00 H new ATOM 0 HD13 LEU B 19 92.523 -0.338 -15.916 1.00 0.00 H new ATOM 0 HD21 LEU B 19 93.030 -0.702 -12.871 1.00 0.00 H new ATOM 0 HD22 LEU B 19 94.162 -1.173 -14.161 1.00 0.00 H new ATOM 0 HD23 LEU B 19 94.695 -0.073 -12.867 1.00 0.00 H new ATOM 1224 N THR B 20 97.037 3.197 -15.943 1.00 0.00 N ATOM 1225 CA THR B 20 98.196 3.434 -16.791 1.00 0.00 C ATOM 1226 C THR B 20 99.478 3.356 -15.966 1.00 0.00 C ATOM 1227 O THR B 20 100.468 2.758 -16.389 1.00 0.00 O ATOM 1228 CB THR B 20 98.094 4.812 -17.449 1.00 0.00 C ATOM 1229 OG1 THR B 20 96.805 4.968 -18.024 1.00 0.00 O ATOM 1230 CG2 THR B 20 99.160 4.938 -18.539 1.00 0.00 C ATOM 0 H THR B 20 96.348 3.949 -15.936 1.00 0.00 H new ATOM 0 HA THR B 20 98.222 2.667 -17.565 1.00 0.00 H new ATOM 0 HB THR B 20 98.252 5.586 -16.698 1.00 0.00 H new ATOM 0 HG1 THR B 20 96.158 5.191 -17.322 1.00 0.00 H new ATOM 0 HG21 THR B 20 99.087 5.919 -19.007 1.00 0.00 H new ATOM 0 HG22 THR B 20 100.149 4.820 -18.096 1.00 0.00 H new ATOM 0 HG23 THR B 20 99.005 4.165 -19.291 1.00 0.00 H new ATOM 1238 N VAL B 21 99.449 3.971 -14.788 1.00 0.00 N ATOM 1239 CA VAL B 21 100.615 3.978 -13.907 1.00 0.00 C ATOM 1240 C VAL B 21 100.897 2.589 -13.329 1.00 0.00 C ATOM 1241 O VAL B 21 102.041 2.136 -13.322 1.00 0.00 O ATOM 1242 CB VAL B 21 100.395 4.968 -12.763 1.00 0.00 C ATOM 1243 CG1 VAL B 21 101.600 4.936 -11.818 1.00 0.00 C ATOM 1244 CG2 VAL B 21 100.234 6.380 -13.335 1.00 0.00 C ATOM 0 H VAL B 21 98.637 4.468 -14.422 1.00 0.00 H new ATOM 0 HA VAL B 21 101.477 4.279 -14.502 1.00 0.00 H new ATOM 0 HB VAL B 21 99.495 4.692 -12.213 1.00 0.00 H new ATOM 0 HG11 VAL B 21 101.442 5.642 -11.003 1.00 0.00 H new ATOM 0 HG12 VAL B 21 101.716 3.932 -11.411 1.00 0.00 H new ATOM 0 HG13 VAL B 21 102.500 5.211 -12.367 1.00 0.00 H new ATOM 0 HG21 VAL B 21 100.077 7.087 -12.520 1.00 0.00 H new ATOM 0 HG22 VAL B 21 101.134 6.654 -13.885 1.00 0.00 H new ATOM 0 HG23 VAL B 21 99.376 6.405 -14.007 1.00 0.00 H new ATOM 1254 N LEU B 22 99.857 1.926 -12.825 1.00 0.00 N ATOM 1255 CA LEU B 22 100.029 0.601 -12.228 1.00 0.00 C ATOM 1256 C LEU B 22 100.545 -0.408 -13.262 1.00 0.00 C ATOM 1257 O LEU B 22 101.540 -1.093 -13.022 1.00 0.00 O ATOM 1258 CB LEU B 22 98.689 0.116 -11.630 1.00 0.00 C ATOM 1259 CG LEU B 22 98.565 0.557 -10.162 1.00 0.00 C ATOM 1260 CD1 LEU B 22 98.539 2.084 -10.074 1.00 0.00 C ATOM 1261 CD2 LEU B 22 97.268 -0.006 -9.575 1.00 0.00 C ATOM 0 H LEU B 22 98.899 2.277 -12.817 1.00 0.00 H new ATOM 0 HA LEU B 22 100.771 0.677 -11.433 1.00 0.00 H new ATOM 0 HB2 LEU B 22 97.858 0.520 -12.209 1.00 0.00 H new ATOM 0 HB3 LEU B 22 98.626 -0.970 -11.696 1.00 0.00 H new ATOM 0 HG LEU B 22 99.421 0.182 -9.601 1.00 0.00 H new ATOM 0 HD11 LEU B 22 98.451 2.387 -9.031 1.00 0.00 H new ATOM 0 HD12 LEU B 22 99.461 2.488 -10.493 1.00 0.00 H new ATOM 0 HD13 LEU B 22 97.687 2.466 -10.636 1.00 0.00 H new ATOM 0 HD21 LEU B 22 97.175 0.304 -8.534 1.00 0.00 H new ATOM 0 HD22 LEU B 22 96.418 0.371 -10.143 1.00 0.00 H new ATOM 0 HD23 LEU B 22 97.286 -1.094 -9.629 1.00 0.00 H new ATOM 1273 N ILE B 23 99.873 -0.497 -14.405 1.00 0.00 N ATOM 1274 CA ILE B 23 100.293 -1.428 -15.446 1.00 0.00 C ATOM 1275 C ILE B 23 101.734 -1.132 -15.854 1.00 0.00 C ATOM 1276 O ILE B 23 102.576 -2.028 -15.886 1.00 0.00 O ATOM 1277 CB ILE B 23 99.371 -1.319 -16.662 1.00 0.00 C ATOM 1278 CG1 ILE B 23 97.926 -1.624 -16.239 1.00 0.00 C ATOM 1279 CG2 ILE B 23 99.811 -2.327 -17.724 1.00 0.00 C ATOM 1280 CD1 ILE B 23 96.960 -1.112 -17.310 1.00 0.00 C ATOM 0 H ILE B 23 99.047 0.056 -14.632 1.00 0.00 H new ATOM 0 HA ILE B 23 100.233 -2.444 -15.055 1.00 0.00 H new ATOM 0 HB ILE B 23 99.426 -0.310 -17.070 1.00 0.00 H new ATOM 0 HG12 ILE B 23 97.796 -2.697 -16.100 1.00 0.00 H new ATOM 0 HG13 ILE B 23 97.709 -1.150 -15.282 1.00 0.00 H new ATOM 0 HG21 ILE B 23 99.155 -2.251 -18.591 1.00 0.00 H new ATOM 0 HG22 ILE B 23 100.837 -2.114 -18.025 1.00 0.00 H new ATOM 0 HG23 ILE B 23 99.755 -3.335 -17.314 1.00 0.00 H new ATOM 0 HD11 ILE B 23 95.935 -1.329 -17.009 1.00 0.00 H new ATOM 0 HD12 ILE B 23 97.084 -0.035 -17.427 1.00 0.00 H new ATOM 0 HD13 ILE B 23 97.172 -1.607 -18.258 1.00 0.00 H new ATOM 1292 N ALA B 24 102.015 0.134 -16.149 1.00 0.00 N ATOM 1293 CA ALA B 24 103.365 0.535 -16.533 1.00 0.00 C ATOM 1294 C ALA B 24 104.379 -0.026 -15.536 1.00 0.00 C ATOM 1295 O ALA B 24 105.420 -0.569 -15.918 1.00 0.00 O ATOM 1296 CB ALA B 24 103.466 2.061 -16.561 1.00 0.00 C ATOM 0 H ALA B 24 101.334 0.893 -16.130 1.00 0.00 H new ATOM 0 HA ALA B 24 103.581 0.141 -17.526 1.00 0.00 H new ATOM 0 HB1 ALA B 24 104.476 2.354 -16.848 1.00 0.00 H new ATOM 0 HB2 ALA B 24 102.753 2.460 -17.283 1.00 0.00 H new ATOM 0 HB3 ALA B 24 103.241 2.459 -15.572 1.00 0.00 H new ATOM 1302 N LEU B 25 104.061 0.105 -14.253 1.00 0.00 N ATOM 1303 CA LEU B 25 104.939 -0.395 -13.203 1.00 0.00 C ATOM 1304 C LEU B 25 105.031 -1.918 -13.276 1.00 0.00 C ATOM 1305 O LEU B 25 106.046 -2.508 -12.910 1.00 0.00 O ATOM 1306 CB LEU B 25 104.402 0.031 -11.828 1.00 0.00 C ATOM 1307 CG LEU B 25 105.523 -0.042 -10.767 1.00 0.00 C ATOM 1308 CD1 LEU B 25 106.305 1.278 -10.735 1.00 0.00 C ATOM 1309 CD2 LEU B 25 104.912 -0.289 -9.382 1.00 0.00 C ATOM 0 H LEU B 25 103.207 0.550 -13.917 1.00 0.00 H new ATOM 0 HA LEU B 25 105.935 0.025 -13.344 1.00 0.00 H new ATOM 0 HB2 LEU B 25 104.009 1.046 -11.882 1.00 0.00 H new ATOM 0 HB3 LEU B 25 103.574 -0.616 -11.537 1.00 0.00 H new ATOM 0 HG LEU B 25 106.196 -0.859 -11.027 1.00 0.00 H new ATOM 0 HD11 LEU B 25 107.093 1.216 -9.984 1.00 0.00 H new ATOM 0 HD12 LEU B 25 106.750 1.461 -11.713 1.00 0.00 H new ATOM 0 HD13 LEU B 25 105.629 2.096 -10.485 1.00 0.00 H new ATOM 0 HD21 LEU B 25 105.707 -0.340 -8.638 1.00 0.00 H new ATOM 0 HD22 LEU B 25 104.233 0.527 -9.133 1.00 0.00 H new ATOM 0 HD23 LEU B 25 104.362 -1.230 -9.390 1.00 0.00 H new ATOM 1321 N ALA B 26 103.955 -2.542 -13.746 1.00 0.00 N ATOM 1322 CA ALA B 26 103.909 -3.996 -13.861 1.00 0.00 C ATOM 1323 C ALA B 26 104.924 -4.502 -14.884 1.00 0.00 C ATOM 1324 O ALA B 26 105.701 -5.412 -14.598 1.00 0.00 O ATOM 1325 CB ALA B 26 102.503 -4.446 -14.266 1.00 0.00 C ATOM 0 H ALA B 26 103.106 -2.066 -14.052 1.00 0.00 H new ATOM 0 HA ALA B 26 104.162 -4.418 -12.888 1.00 0.00 H new ATOM 0 HB1 ALA B 26 102.479 -5.533 -14.349 1.00 0.00 H new ATOM 0 HB2 ALA B 26 101.786 -4.124 -13.511 1.00 0.00 H new ATOM 0 HB3 ALA B 26 102.242 -4.003 -15.227 1.00 0.00 H new ATOM 1331 N VAL B 27 104.921 -3.914 -16.078 1.00 0.00 N ATOM 1332 CA VAL B 27 105.860 -4.337 -17.112 1.00 0.00 C ATOM 1333 C VAL B 27 107.289 -4.049 -16.664 1.00 0.00 C ATOM 1334 O VAL B 27 108.194 -4.849 -16.904 1.00 0.00 O ATOM 1335 CB VAL B 27 105.554 -3.636 -18.441 1.00 0.00 C ATOM 1336 CG1 VAL B 27 105.425 -2.133 -18.219 1.00 0.00 C ATOM 1337 CG2 VAL B 27 106.679 -3.910 -19.446 1.00 0.00 C ATOM 0 H VAL B 27 104.292 -3.158 -16.350 1.00 0.00 H new ATOM 0 HA VAL B 27 105.752 -5.410 -17.268 1.00 0.00 H new ATOM 0 HB VAL B 27 104.615 -4.023 -18.836 1.00 0.00 H new ATOM 0 HG11 VAL B 27 105.208 -1.642 -19.168 1.00 0.00 H new ATOM 0 HG12 VAL B 27 104.616 -1.937 -17.516 1.00 0.00 H new ATOM 0 HG13 VAL B 27 106.359 -1.743 -17.815 1.00 0.00 H new ATOM 0 HG21 VAL B 27 106.455 -3.409 -20.388 1.00 0.00 H new ATOM 0 HG22 VAL B 27 107.621 -3.532 -19.049 1.00 0.00 H new ATOM 0 HG23 VAL B 27 106.761 -4.983 -19.616 1.00 0.00 H new ATOM 1347 N TYR B 28 107.487 -2.916 -15.994 1.00 0.00 N ATOM 1348 CA TYR B 28 108.817 -2.568 -15.505 1.00 0.00 C ATOM 1349 C TYR B 28 109.284 -3.631 -14.516 1.00 0.00 C ATOM 1350 O TYR B 28 110.433 -4.072 -14.550 1.00 0.00 O ATOM 1351 CB TYR B 28 108.786 -1.200 -14.818 1.00 0.00 C ATOM 1352 CG TYR B 28 110.198 -0.744 -14.531 1.00 0.00 C ATOM 1353 CD1 TYR B 28 110.933 -0.079 -15.520 1.00 0.00 C ATOM 1354 CD2 TYR B 28 110.770 -0.982 -13.275 1.00 0.00 C ATOM 1355 CE1 TYR B 28 112.241 0.346 -15.253 1.00 0.00 C ATOM 1356 CE2 TYR B 28 112.078 -0.557 -13.009 1.00 0.00 C ATOM 1357 CZ TYR B 28 112.812 0.108 -13.998 1.00 0.00 C ATOM 1358 OH TYR B 28 114.101 0.529 -13.735 1.00 0.00 O ATOM 0 H TYR B 28 106.758 -2.235 -15.781 1.00 0.00 H new ATOM 0 HA TYR B 28 109.508 -2.522 -16.347 1.00 0.00 H new ATOM 0 HB2 TYR B 28 108.281 -0.474 -15.455 1.00 0.00 H new ATOM 0 HB3 TYR B 28 108.217 -1.261 -13.890 1.00 0.00 H new ATOM 0 HD1 TYR B 28 110.492 0.106 -16.488 1.00 0.00 H new ATOM 0 HD2 TYR B 28 110.203 -1.493 -12.511 1.00 0.00 H new ATOM 0 HE1 TYR B 28 112.809 0.858 -16.016 1.00 0.00 H new ATOM 0 HE2 TYR B 28 112.520 -0.742 -12.041 1.00 0.00 H new ATOM 0 HH TYR B 28 114.344 0.286 -12.817 1.00 0.00 H new ATOM 1368 N PHE B 29 108.369 -4.040 -13.642 1.00 0.00 N ATOM 1369 CA PHE B 29 108.653 -5.056 -12.639 1.00 0.00 C ATOM 1370 C PHE B 29 109.052 -6.375 -13.304 1.00 0.00 C ATOM 1371 O PHE B 29 110.036 -7.004 -12.912 1.00 0.00 O ATOM 1372 CB PHE B 29 107.400 -5.247 -11.773 1.00 0.00 C ATOM 1373 CG PHE B 29 107.493 -6.521 -10.955 1.00 0.00 C ATOM 1374 CD1 PHE B 29 108.583 -6.731 -10.102 1.00 0.00 C ATOM 1375 CD2 PHE B 29 106.484 -7.493 -11.051 1.00 0.00 C ATOM 1376 CE1 PHE B 29 108.665 -7.909 -9.347 1.00 0.00 C ATOM 1377 CE2 PHE B 29 106.567 -8.668 -10.298 1.00 0.00 C ATOM 1378 CZ PHE B 29 107.658 -8.877 -9.446 1.00 0.00 C ATOM 0 H PHE B 29 107.416 -3.678 -13.610 1.00 0.00 H new ATOM 0 HA PHE B 29 109.488 -4.735 -12.016 1.00 0.00 H new ATOM 0 HB2 PHE B 29 107.279 -4.392 -11.108 1.00 0.00 H new ATOM 0 HB3 PHE B 29 106.516 -5.283 -12.409 1.00 0.00 H new ATOM 0 HD1 PHE B 29 109.361 -5.985 -10.026 1.00 0.00 H new ATOM 0 HD2 PHE B 29 105.642 -7.332 -11.708 1.00 0.00 H new ATOM 0 HE1 PHE B 29 109.506 -8.070 -8.688 1.00 0.00 H new ATOM 0 HE2 PHE B 29 105.790 -9.414 -10.374 1.00 0.00 H new ATOM 0 HZ PHE B 29 107.723 -9.785 -8.865 1.00 0.00 H new ATOM 1388 N LEU B 30 108.282 -6.792 -14.304 1.00 0.00 N ATOM 1389 CA LEU B 30 108.568 -8.040 -15.004 1.00 0.00 C ATOM 1390 C LEU B 30 109.943 -7.978 -15.666 1.00 0.00 C ATOM 1391 O LEU B 30 110.696 -8.952 -15.649 1.00 0.00 O ATOM 1392 CB LEU B 30 107.488 -8.310 -16.066 1.00 0.00 C ATOM 1393 CG LEU B 30 107.473 -9.808 -16.445 1.00 0.00 C ATOM 1394 CD1 LEU B 30 106.565 -10.587 -15.483 1.00 0.00 C ATOM 1395 CD2 LEU B 30 106.942 -9.977 -17.875 1.00 0.00 C ATOM 0 H LEU B 30 107.463 -6.290 -14.646 1.00 0.00 H new ATOM 0 HA LEU B 30 108.565 -8.853 -14.278 1.00 0.00 H new ATOM 0 HB2 LEU B 30 106.511 -8.014 -15.684 1.00 0.00 H new ATOM 0 HB3 LEU B 30 107.680 -7.705 -16.952 1.00 0.00 H new ATOM 0 HG LEU B 30 108.490 -10.194 -16.379 1.00 0.00 H new ATOM 0 HD11 LEU B 30 106.562 -11.641 -15.759 1.00 0.00 H new ATOM 0 HD12 LEU B 30 106.937 -10.480 -14.464 1.00 0.00 H new ATOM 0 HD13 LEU B 30 105.550 -10.194 -15.542 1.00 0.00 H new ATOM 0 HD21 LEU B 30 106.933 -11.035 -18.137 1.00 0.00 H new ATOM 0 HD22 LEU B 30 105.929 -9.580 -17.936 1.00 0.00 H new ATOM 0 HD23 LEU B 30 107.586 -9.436 -18.569 1.00 0.00 H new ATOM 1407 N GLY B 31 110.262 -6.827 -16.249 1.00 0.00 N ATOM 1408 CA GLY B 31 111.549 -6.649 -16.913 1.00 0.00 C ATOM 1409 C GLY B 31 111.816 -5.174 -17.188 1.00 0.00 C ATOM 1410 O GLY B 31 112.411 -4.477 -16.366 1.00 0.00 O ATOM 0 H GLY B 31 109.653 -6.009 -16.276 1.00 0.00 H new ATOM 0 HA2 GLY B 31 112.345 -7.057 -16.290 1.00 0.00 H new ATOM 0 HA3 GLY B 31 111.560 -7.206 -17.850 1.00 0.00 H new ATOM 1414 N ARG B 32 111.371 -4.705 -18.348 1.00 0.00 N ATOM 1415 CA ARG B 32 111.566 -3.309 -18.723 1.00 0.00 C ATOM 1416 C ARG B 32 110.665 -2.941 -19.898 1.00 0.00 C ATOM 1417 O ARG B 32 111.054 -3.079 -21.057 1.00 0.00 O ATOM 1418 CB ARG B 32 113.029 -3.070 -19.101 1.00 0.00 C ATOM 1419 CG ARG B 32 113.249 -1.582 -19.383 1.00 0.00 C ATOM 1420 CD ARG B 32 114.725 -1.334 -19.690 1.00 0.00 C ATOM 1421 NE ARG B 32 114.957 0.087 -19.935 1.00 0.00 N ATOM 1422 CZ ARG B 32 115.113 0.941 -18.927 1.00 0.00 C ATOM 1423 NH1 ARG B 32 115.059 0.514 -17.695 1.00 0.00 N ATOM 1424 NH2 ARG B 32 115.319 2.206 -19.171 1.00 0.00 N ATOM 0 H ARG B 32 110.876 -5.266 -19.041 1.00 0.00 H new ATOM 0 HA ARG B 32 111.306 -2.681 -17.871 1.00 0.00 H new ATOM 0 HB2 ARG B 32 113.682 -3.398 -18.292 1.00 0.00 H new ATOM 0 HB3 ARG B 32 113.289 -3.660 -19.980 1.00 0.00 H new ATOM 0 HG2 ARG B 32 112.633 -1.266 -20.225 1.00 0.00 H new ATOM 0 HG3 ARG B 32 112.941 -0.988 -18.522 1.00 0.00 H new ATOM 0 HD2 ARG B 32 115.339 -1.672 -18.855 1.00 0.00 H new ATOM 0 HD3 ARG B 32 115.025 -1.915 -20.562 1.00 0.00 H new ATOM 0 HE ARG B 32 115.000 0.430 -20.895 1.00 0.00 H new ATOM 0 HH11 ARG B 32 114.897 -0.475 -17.505 1.00 0.00 H new ATOM 0 HH12 ARG B 32 115.179 1.169 -16.922 1.00 0.00 H new ATOM 0 HH21 ARG B 32 115.360 2.540 -20.134 1.00 0.00 H new ATOM 0 HH22 ARG B 32 115.439 2.861 -18.399 1.00 0.00 H new TER 1438 ARG B 32