USER MOD reduce.3.24.130724 H: found=0, std=0, add=763, rem=0, adj=17 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 Single : A 1 CYS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.373 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 120:sc= -0.232 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot -49:sc= 0.94 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -88:sc= 0.512 USER MOD Single : A 52 LYS NZ :NH3+ -119:sc= -1.4 (180deg=-5.18!) USER MOD Single : A 53 THR OG1 : rot -81:sc= 0.145 USER MOD Single : A 62 GLN :FLIP amide:sc= -0.433 F(o=-1.2,f=-0.43) USER MOD Single : A 63 ASN : amide:sc= -0.508 K(o=-0.51,f=-1.8) USER MOD Single : B 1 CYS N :NH3+ -158:sc= 0.641 (180deg=0.267) USER MOD Single : B 2 SER OG : rot 2:sc= 0.855 USER MOD Single : B 3 THR OG1 : rot -18:sc= -0.733! USER MOD Single : B 5 SER OG : rot -170:sc= -1.02 USER MOD Single : B 20 THR OG1 : rot 85:sc= 0.821 USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 1 73.591 22.099 -17.674 1.00 0.00 N ATOM 2 CA CYS A 1 73.151 20.678 -17.570 1.00 0.00 C ATOM 3 C CYS A 1 73.864 19.849 -18.632 1.00 0.00 C ATOM 4 O CYS A 1 75.018 19.456 -18.458 1.00 0.00 O ATOM 5 CB CYS A 1 71.638 20.600 -17.775 1.00 0.00 C ATOM 6 SG CYS A 1 71.130 18.864 -17.857 1.00 0.00 S ATOM 0 H1 CYS A 1 73.106 22.667 -16.950 1.00 0.00 H new ATOM 0 H2 CYS A 1 74.619 22.156 -17.527 1.00 0.00 H new ATOM 0 H3 CYS A 1 73.356 22.467 -18.618 1.00 0.00 H new ATOM 0 HA CYS A 1 73.399 20.286 -16.584 1.00 0.00 H new ATOM 0 HB2 CYS A 1 71.123 21.103 -16.957 1.00 0.00 H new ATOM 0 HB3 CYS A 1 71.357 21.116 -18.693 1.00 0.00 H new ATOM 10 N SER A 2 73.169 19.586 -19.735 1.00 0.00 N ATOM 11 CA SER A 2 73.746 18.801 -20.820 1.00 0.00 C ATOM 12 C SER A 2 74.319 17.491 -20.289 1.00 0.00 C ATOM 13 O SER A 2 75.491 17.181 -20.506 1.00 0.00 O ATOM 14 CB SER A 2 74.850 19.600 -21.512 1.00 0.00 C ATOM 15 OG SER A 2 74.314 20.829 -21.985 1.00 0.00 O ATOM 0 H SER A 2 72.213 19.902 -19.900 1.00 0.00 H new ATOM 0 HA SER A 2 72.958 18.574 -21.538 1.00 0.00 H new ATOM 0 HB2 SER A 2 75.668 19.790 -20.817 1.00 0.00 H new ATOM 0 HB3 SER A 2 75.264 19.027 -22.342 1.00 0.00 H new ATOM 0 HG SER A 2 75.020 21.345 -22.428 1.00 0.00 H new ATOM 21 N THR A 3 73.485 16.724 -19.594 1.00 0.00 N ATOM 22 CA THR A 3 73.918 15.448 -19.035 1.00 0.00 C ATOM 23 C THR A 3 74.214 14.450 -20.151 1.00 0.00 C ATOM 24 O THR A 3 73.552 14.455 -21.188 1.00 0.00 O ATOM 25 CB THR A 3 72.833 14.886 -18.115 1.00 0.00 C ATOM 26 OG1 THR A 3 73.105 13.517 -17.849 1.00 0.00 O ATOM 27 CG2 THR A 3 71.469 15.017 -18.792 1.00 0.00 C ATOM 0 H THR A 3 72.511 16.962 -19.405 1.00 0.00 H new ATOM 0 HA THR A 3 74.829 15.613 -18.460 1.00 0.00 H new ATOM 0 HB THR A 3 72.824 15.444 -17.178 1.00 0.00 H new ATOM 0 HG1 THR A 3 72.412 13.155 -17.258 1.00 0.00 H new ATOM 0 HG21 THR A 3 70.697 14.616 -18.135 1.00 0.00 H new ATOM 0 HG22 THR A 3 71.263 16.068 -18.995 1.00 0.00 H new ATOM 0 HG23 THR A 3 71.473 14.460 -19.729 1.00 0.00 H new ATOM 35 N VAL A 4 75.214 13.596 -19.921 1.00 0.00 N ATOM 36 CA VAL A 4 75.615 12.577 -20.902 1.00 0.00 C ATOM 37 C VAL A 4 75.400 13.061 -22.333 1.00 0.00 C ATOM 38 O VAL A 4 75.073 12.277 -23.224 1.00 0.00 O ATOM 39 CB VAL A 4 74.827 11.286 -20.667 1.00 0.00 C ATOM 40 CG1 VAL A 4 75.222 10.691 -19.313 1.00 0.00 C ATOM 41 CG2 VAL A 4 73.326 11.587 -20.671 1.00 0.00 C ATOM 0 H VAL A 4 75.764 13.588 -19.062 1.00 0.00 H new ATOM 0 HA VAL A 4 76.680 12.386 -20.768 1.00 0.00 H new ATOM 0 HB VAL A 4 75.054 10.575 -21.462 1.00 0.00 H new ATOM 0 HG11 VAL A 4 74.662 9.771 -19.143 1.00 0.00 H new ATOM 0 HG12 VAL A 4 76.290 10.472 -19.309 1.00 0.00 H new ATOM 0 HG13 VAL A 4 74.995 11.405 -18.522 1.00 0.00 H new ATOM 0 HG21 VAL A 4 72.770 10.665 -20.503 1.00 0.00 H new ATOM 0 HG22 VAL A 4 73.096 12.299 -19.879 1.00 0.00 H new ATOM 0 HG23 VAL A 4 73.043 12.012 -21.634 1.00 0.00 H new ATOM 51 N SER A 5 75.601 14.358 -22.542 1.00 0.00 N ATOM 52 CA SER A 5 75.444 14.950 -23.867 1.00 0.00 C ATOM 53 C SER A 5 76.739 14.807 -24.674 1.00 0.00 C ATOM 54 O SER A 5 76.698 14.514 -25.869 1.00 0.00 O ATOM 55 CB SER A 5 75.041 16.429 -23.741 1.00 0.00 C ATOM 56 OG SER A 5 74.052 16.726 -24.718 1.00 0.00 O ATOM 0 H SER A 5 75.872 15.018 -21.813 1.00 0.00 H new ATOM 0 HA SER A 5 74.653 14.420 -24.397 1.00 0.00 H new ATOM 0 HB2 SER A 5 74.655 16.630 -22.742 1.00 0.00 H new ATOM 0 HB3 SER A 5 75.912 17.069 -23.881 1.00 0.00 H new ATOM 0 HG SER A 5 73.789 17.667 -24.642 1.00 0.00 H new ATOM 62 N PRO A 6 77.878 15.004 -24.053 1.00 0.00 N ATOM 63 CA PRO A 6 79.202 14.888 -24.738 1.00 0.00 C ATOM 64 C PRO A 6 79.327 13.621 -25.567 1.00 0.00 C ATOM 65 O PRO A 6 79.831 13.664 -26.688 1.00 0.00 O ATOM 66 CB PRO A 6 80.197 14.918 -23.575 1.00 0.00 C ATOM 67 CG PRO A 6 79.518 15.772 -22.562 1.00 0.00 C ATOM 68 CD PRO A 6 78.052 15.363 -22.629 1.00 0.00 C ATOM 0 HA PRO A 6 79.368 15.684 -25.464 1.00 0.00 H new ATOM 0 HB2 PRO A 6 80.395 13.918 -23.190 1.00 0.00 H new ATOM 0 HB3 PRO A 6 81.156 15.339 -23.877 1.00 0.00 H new ATOM 0 HG2 PRO A 6 79.930 15.608 -21.566 1.00 0.00 H new ATOM 0 HG3 PRO A 6 79.644 16.831 -22.788 1.00 0.00 H new ATOM 0 HD2 PRO A 6 77.836 14.522 -21.970 1.00 0.00 H new ATOM 0 HD3 PRO A 6 77.391 16.177 -22.333 1.00 0.00 H new ATOM 76 N GLY A 7 78.874 12.496 -25.027 1.00 0.00 N ATOM 77 CA GLY A 7 78.975 11.238 -25.770 1.00 0.00 C ATOM 78 C GLY A 7 80.437 10.823 -25.849 1.00 0.00 C ATOM 79 O GLY A 7 80.806 9.708 -25.472 1.00 0.00 O ATOM 0 H GLY A 7 78.444 12.424 -24.105 1.00 0.00 H new ATOM 0 HA2 GLY A 7 78.390 10.462 -25.277 1.00 0.00 H new ATOM 0 HA3 GLY A 7 78.564 11.359 -26.772 1.00 0.00 H new ATOM 83 N VAL A 8 81.283 11.747 -26.306 1.00 0.00 N ATOM 84 CA VAL A 8 82.706 11.475 -26.382 1.00 0.00 C ATOM 85 C VAL A 8 83.149 10.944 -25.033 1.00 0.00 C ATOM 86 O VAL A 8 83.983 10.037 -24.944 1.00 0.00 O ATOM 87 CB VAL A 8 83.477 12.752 -26.731 1.00 0.00 C ATOM 88 CG1 VAL A 8 84.981 12.502 -26.594 1.00 0.00 C ATOM 89 CG2 VAL A 8 83.160 13.150 -28.172 1.00 0.00 C ATOM 0 H VAL A 8 81.006 12.676 -26.624 1.00 0.00 H new ATOM 0 HA VAL A 8 82.909 10.742 -27.163 1.00 0.00 H new ATOM 0 HB VAL A 8 83.182 13.552 -26.052 1.00 0.00 H new ATOM 0 HG11 VAL A 8 85.525 13.413 -26.843 1.00 0.00 H new ATOM 0 HG12 VAL A 8 85.210 12.212 -25.569 1.00 0.00 H new ATOM 0 HG13 VAL A 8 85.280 11.703 -27.273 1.00 0.00 H new ATOM 0 HG21 VAL A 8 83.706 14.058 -28.427 1.00 0.00 H new ATOM 0 HG22 VAL A 8 83.458 12.346 -28.845 1.00 0.00 H new ATOM 0 HG23 VAL A 8 82.090 13.329 -28.273 1.00 0.00 H new ATOM 99 N LEU A 9 82.546 11.485 -23.974 1.00 0.00 N ATOM 100 CA LEU A 9 82.876 10.999 -22.645 1.00 0.00 C ATOM 101 C LEU A 9 82.641 9.485 -22.627 1.00 0.00 C ATOM 102 O LEU A 9 83.449 8.712 -22.102 1.00 0.00 O ATOM 103 CB LEU A 9 82.027 11.691 -21.572 1.00 0.00 C ATOM 104 CG LEU A 9 82.589 13.097 -21.272 1.00 0.00 C ATOM 105 CD1 LEU A 9 81.628 13.838 -20.332 1.00 0.00 C ATOM 106 CD2 LEU A 9 83.985 12.999 -20.608 1.00 0.00 C ATOM 0 H LEU A 9 81.852 12.232 -24.010 1.00 0.00 H new ATOM 0 HA LEU A 9 83.918 11.225 -22.418 1.00 0.00 H new ATOM 0 HB2 LEU A 9 80.994 11.769 -21.910 1.00 0.00 H new ATOM 0 HB3 LEU A 9 82.020 11.092 -20.661 1.00 0.00 H new ATOM 0 HG LEU A 9 82.688 13.642 -22.211 1.00 0.00 H new ATOM 0 HD11 LEU A 9 82.022 14.831 -20.118 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.652 13.930 -20.808 1.00 0.00 H new ATOM 0 HD13 LEU A 9 81.527 13.280 -19.401 1.00 0.00 H new ATOM 0 HD21 LEU A 9 84.363 14.001 -20.405 1.00 0.00 H new ATOM 0 HD22 LEU A 9 83.905 12.445 -19.673 1.00 0.00 H new ATOM 0 HD23 LEU A 9 84.671 12.482 -21.278 1.00 0.00 H new ATOM 118 N ALA A 10 81.546 9.057 -23.261 1.00 0.00 N ATOM 119 CA ALA A 10 81.255 7.635 -23.354 1.00 0.00 C ATOM 120 C ALA A 10 82.451 6.954 -23.999 1.00 0.00 C ATOM 121 O ALA A 10 82.864 5.863 -23.597 1.00 0.00 O ATOM 122 CB ALA A 10 79.993 7.399 -24.193 1.00 0.00 C ATOM 0 H ALA A 10 80.861 9.667 -23.708 1.00 0.00 H new ATOM 0 HA ALA A 10 81.075 7.224 -22.361 1.00 0.00 H new ATOM 0 HB1 ALA A 10 79.790 6.330 -24.252 1.00 0.00 H new ATOM 0 HB2 ALA A 10 79.147 7.904 -23.727 1.00 0.00 H new ATOM 0 HB3 ALA A 10 80.144 7.796 -25.197 1.00 0.00 H new ATOM 128 N GLY A 11 83.020 7.636 -24.989 1.00 0.00 N ATOM 129 CA GLY A 11 84.197 7.124 -25.677 1.00 0.00 C ATOM 130 C GLY A 11 85.340 6.963 -24.684 1.00 0.00 C ATOM 131 O GLY A 11 86.218 6.123 -24.858 1.00 0.00 O ATOM 0 H GLY A 11 82.687 8.538 -25.330 1.00 0.00 H new ATOM 0 HA2 GLY A 11 83.970 6.165 -26.144 1.00 0.00 H new ATOM 0 HA3 GLY A 11 84.489 7.806 -26.476 1.00 0.00 H new ATOM 135 N ILE A 12 85.308 7.779 -23.632 1.00 0.00 N ATOM 136 CA ILE A 12 86.339 7.722 -22.593 1.00 0.00 C ATOM 137 C ILE A 12 86.190 6.419 -21.819 1.00 0.00 C ATOM 138 O ILE A 12 87.176 5.802 -21.426 1.00 0.00 O ATOM 139 CB ILE A 12 86.234 8.981 -21.660 1.00 0.00 C ATOM 140 CG1 ILE A 12 87.619 9.644 -21.465 1.00 0.00 C ATOM 141 CG2 ILE A 12 85.648 8.642 -20.261 1.00 0.00 C ATOM 142 CD1 ILE A 12 87.438 11.110 -21.050 1.00 0.00 C ATOM 0 H ILE A 12 84.586 8.483 -23.475 1.00 0.00 H new ATOM 0 HA ILE A 12 87.332 7.739 -23.042 1.00 0.00 H new ATOM 0 HB ILE A 12 85.554 9.669 -22.163 1.00 0.00 H new ATOM 0 HG12 ILE A 12 88.185 9.108 -20.703 1.00 0.00 H new ATOM 0 HG13 ILE A 12 88.194 9.586 -22.389 1.00 0.00 H new ATOM 0 HG21 ILE A 12 85.598 9.549 -19.658 1.00 0.00 H new ATOM 0 HG22 ILE A 12 84.647 8.228 -20.377 1.00 0.00 H new ATOM 0 HG23 ILE A 12 86.288 7.912 -19.766 1.00 0.00 H new ATOM 0 HD11 ILE A 12 88.415 11.573 -20.914 1.00 0.00 H new ATOM 0 HD12 ILE A 12 86.889 11.643 -21.826 1.00 0.00 H new ATOM 0 HD13 ILE A 12 86.881 11.157 -20.114 1.00 0.00 H new ATOM 154 N VAL A 13 84.946 6.010 -21.611 1.00 0.00 N ATOM 155 CA VAL A 13 84.677 4.771 -20.891 1.00 0.00 C ATOM 156 C VAL A 13 85.190 3.575 -21.689 1.00 0.00 C ATOM 157 O VAL A 13 85.956 2.745 -21.180 1.00 0.00 O ATOM 158 CB VAL A 13 83.171 4.631 -20.652 1.00 0.00 C ATOM 159 CG1 VAL A 13 82.884 3.325 -19.909 1.00 0.00 C ATOM 160 CG2 VAL A 13 82.680 5.812 -19.812 1.00 0.00 C ATOM 0 H VAL A 13 84.115 6.511 -21.926 1.00 0.00 H new ATOM 0 HA VAL A 13 85.193 4.799 -19.931 1.00 0.00 H new ATOM 0 HB VAL A 13 82.653 4.621 -21.611 1.00 0.00 H new ATOM 0 HG11 VAL A 13 81.811 3.230 -19.741 1.00 0.00 H new ATOM 0 HG12 VAL A 13 83.234 2.483 -20.506 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.402 3.331 -18.950 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.608 5.715 -19.640 1.00 0.00 H new ATOM 0 HG22 VAL A 13 83.202 5.820 -18.855 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.880 6.743 -20.342 1.00 0.00 H new ATOM 170 N VAL A 14 84.774 3.500 -22.949 1.00 0.00 N ATOM 171 CA VAL A 14 85.203 2.410 -23.818 1.00 0.00 C ATOM 172 C VAL A 14 86.721 2.413 -23.953 1.00 0.00 C ATOM 173 O VAL A 14 87.364 1.364 -23.910 1.00 0.00 O ATOM 174 CB VAL A 14 84.568 2.561 -25.200 1.00 0.00 C ATOM 175 CG1 VAL A 14 85.028 1.413 -26.100 1.00 0.00 C ATOM 176 CG2 VAL A 14 83.044 2.528 -25.070 1.00 0.00 C ATOM 0 H VAL A 14 84.146 4.174 -23.388 1.00 0.00 H new ATOM 0 HA VAL A 14 84.884 1.466 -23.376 1.00 0.00 H new ATOM 0 HB VAL A 14 84.874 3.511 -25.637 1.00 0.00 H new ATOM 0 HG11 VAL A 14 84.576 1.520 -27.086 1.00 0.00 H new ATOM 0 HG12 VAL A 14 86.114 1.437 -26.194 1.00 0.00 H new ATOM 0 HG13 VAL A 14 84.723 0.463 -25.662 1.00 0.00 H new ATOM 0 HG21 VAL A 14 82.592 2.636 -26.056 1.00 0.00 H new ATOM 0 HG22 VAL A 14 82.737 1.578 -24.632 1.00 0.00 H new ATOM 0 HG23 VAL A 14 82.716 3.346 -24.429 1.00 0.00 H new ATOM 186 N GLY A 15 87.283 3.604 -24.117 1.00 0.00 N ATOM 187 CA GLY A 15 88.724 3.755 -24.262 1.00 0.00 C ATOM 188 C GLY A 15 89.453 3.375 -22.980 1.00 0.00 C ATOM 189 O GLY A 15 90.606 2.965 -23.020 1.00 0.00 O ATOM 0 H GLY A 15 86.762 4.480 -24.153 1.00 0.00 H new ATOM 0 HA2 GLY A 15 89.076 3.129 -25.082 1.00 0.00 H new ATOM 0 HA3 GLY A 15 88.959 4.787 -24.524 1.00 0.00 H new ATOM 193 N ASP A 16 88.782 3.522 -21.842 1.00 0.00 N ATOM 194 CA ASP A 16 89.399 3.195 -20.559 1.00 0.00 C ATOM 195 C ASP A 16 89.585 1.687 -20.425 1.00 0.00 C ATOM 196 O ASP A 16 90.695 1.207 -20.170 1.00 0.00 O ATOM 197 CB ASP A 16 88.524 3.707 -19.412 1.00 0.00 C ATOM 198 CG ASP A 16 89.100 3.256 -18.074 1.00 0.00 C ATOM 199 OD1 ASP A 16 90.238 2.818 -18.058 1.00 0.00 O ATOM 200 OD2 ASP A 16 88.393 3.352 -17.084 1.00 0.00 O ATOM 0 H ASP A 16 87.822 3.861 -21.780 1.00 0.00 H new ATOM 0 HA ASP A 16 90.376 3.677 -20.513 1.00 0.00 H new ATOM 0 HB2 ASP A 16 88.468 4.795 -19.445 1.00 0.00 H new ATOM 0 HB3 ASP A 16 87.507 3.332 -19.524 1.00 0.00 H new ATOM 205 N LEU A 17 88.498 0.943 -20.604 1.00 0.00 N ATOM 206 CA LEU A 17 88.571 -0.511 -20.503 1.00 0.00 C ATOM 207 C LEU A 17 89.528 -1.055 -21.558 1.00 0.00 C ATOM 208 O LEU A 17 90.312 -1.970 -21.298 1.00 0.00 O ATOM 209 CB LEU A 17 87.179 -1.124 -20.701 1.00 0.00 C ATOM 210 CG LEU A 17 87.226 -2.650 -20.508 1.00 0.00 C ATOM 211 CD1 LEU A 17 87.601 -2.997 -19.056 1.00 0.00 C ATOM 212 CD2 LEU A 17 85.846 -3.232 -20.838 1.00 0.00 C ATOM 0 H LEU A 17 87.572 1.314 -20.816 1.00 0.00 H new ATOM 0 HA LEU A 17 88.938 -0.778 -19.512 1.00 0.00 H new ATOM 0 HB2 LEU A 17 86.478 -0.684 -19.992 1.00 0.00 H new ATOM 0 HB3 LEU A 17 86.811 -0.890 -21.700 1.00 0.00 H new ATOM 0 HG LEU A 17 87.980 -3.075 -21.170 1.00 0.00 H new ATOM 0 HD11 LEU A 17 87.630 -4.080 -18.937 1.00 0.00 H new ATOM 0 HD12 LEU A 17 88.581 -2.580 -18.824 1.00 0.00 H new ATOM 0 HD13 LEU A 17 86.858 -2.577 -18.378 1.00 0.00 H new ATOM 0 HD21 LEU A 17 85.866 -4.314 -20.705 1.00 0.00 H new ATOM 0 HD22 LEU A 17 85.100 -2.798 -20.172 1.00 0.00 H new ATOM 0 HD23 LEU A 17 85.590 -2.998 -21.871 1.00 0.00 H new ATOM 224 N VAL A 18 89.452 -0.480 -22.751 1.00 0.00 N ATOM 225 CA VAL A 18 90.302 -0.904 -23.854 1.00 0.00 C ATOM 226 C VAL A 18 91.760 -0.525 -23.607 1.00 0.00 C ATOM 227 O VAL A 18 92.665 -1.175 -24.121 1.00 0.00 O ATOM 228 CB VAL A 18 89.811 -0.261 -25.156 1.00 0.00 C ATOM 229 CG1 VAL A 18 90.785 -0.584 -26.294 1.00 0.00 C ATOM 230 CG2 VAL A 18 88.423 -0.808 -25.504 1.00 0.00 C ATOM 0 H VAL A 18 88.811 0.280 -22.979 1.00 0.00 H new ATOM 0 HA VAL A 18 90.244 -1.990 -23.933 1.00 0.00 H new ATOM 0 HB VAL A 18 89.756 0.820 -25.024 1.00 0.00 H new ATOM 0 HG11 VAL A 18 90.431 -0.125 -27.217 1.00 0.00 H new ATOM 0 HG12 VAL A 18 91.773 -0.193 -26.049 1.00 0.00 H new ATOM 0 HG13 VAL A 18 90.845 -1.664 -26.426 1.00 0.00 H new ATOM 0 HG21 VAL A 18 88.073 -0.351 -26.430 1.00 0.00 H new ATOM 0 HG22 VAL A 18 88.479 -1.889 -25.632 1.00 0.00 H new ATOM 0 HG23 VAL A 18 87.727 -0.574 -24.698 1.00 0.00 H new ATOM 240 N LEU A 19 91.991 0.536 -22.840 1.00 0.00 N ATOM 241 CA LEU A 19 93.358 0.969 -22.574 1.00 0.00 C ATOM 242 C LEU A 19 94.058 0.001 -21.625 1.00 0.00 C ATOM 243 O LEU A 19 95.121 -0.526 -21.947 1.00 0.00 O ATOM 244 CB LEU A 19 93.365 2.384 -21.976 1.00 0.00 C ATOM 245 CG LEU A 19 94.806 2.849 -21.698 1.00 0.00 C ATOM 246 CD1 LEU A 19 95.625 2.857 -23.001 1.00 0.00 C ATOM 247 CD2 LEU A 19 94.765 4.264 -21.109 1.00 0.00 C ATOM 0 H LEU A 19 91.266 1.102 -22.400 1.00 0.00 H new ATOM 0 HA LEU A 19 93.899 0.981 -23.520 1.00 0.00 H new ATOM 0 HB2 LEU A 19 92.880 3.077 -22.663 1.00 0.00 H new ATOM 0 HB3 LEU A 19 92.789 2.396 -21.051 1.00 0.00 H new ATOM 0 HG LEU A 19 95.278 2.163 -20.994 1.00 0.00 H new ATOM 0 HD11 LEU A 19 96.642 3.188 -22.790 1.00 0.00 H new ATOM 0 HD12 LEU A 19 95.650 1.851 -23.421 1.00 0.00 H new ATOM 0 HD13 LEU A 19 95.164 3.537 -23.717 1.00 0.00 H new ATOM 0 HD21 LEU A 19 95.781 4.604 -20.908 1.00 0.00 H new ATOM 0 HD22 LEU A 19 94.290 4.940 -21.820 1.00 0.00 H new ATOM 0 HD23 LEU A 19 94.195 4.255 -20.180 1.00 0.00 H new ATOM 259 N THR A 20 93.471 -0.232 -20.453 1.00 0.00 N ATOM 260 CA THR A 20 94.085 -1.137 -19.493 1.00 0.00 C ATOM 261 C THR A 20 94.181 -2.553 -20.060 1.00 0.00 C ATOM 262 O THR A 20 95.172 -3.250 -19.839 1.00 0.00 O ATOM 263 CB THR A 20 93.265 -1.146 -18.204 1.00 0.00 C ATOM 264 OG1 THR A 20 92.884 0.185 -17.896 1.00 0.00 O ATOM 265 CG2 THR A 20 94.106 -1.720 -17.059 1.00 0.00 C ATOM 0 H THR A 20 92.590 0.185 -20.152 1.00 0.00 H new ATOM 0 HA THR A 20 95.095 -0.787 -19.282 1.00 0.00 H new ATOM 0 HB THR A 20 92.377 -1.765 -18.335 1.00 0.00 H new ATOM 0 HG1 THR A 20 91.906 0.249 -17.876 1.00 0.00 H new ATOM 0 HG21 THR A 20 93.517 -1.724 -16.142 1.00 0.00 H new ATOM 0 HG22 THR A 20 94.405 -2.739 -17.303 1.00 0.00 H new ATOM 0 HG23 THR A 20 94.995 -1.105 -16.917 1.00 0.00 H new ATOM 273 N VAL A 21 93.148 -2.978 -20.782 1.00 0.00 N ATOM 274 CA VAL A 21 93.133 -4.319 -21.361 1.00 0.00 C ATOM 275 C VAL A 21 94.132 -4.444 -22.514 1.00 0.00 C ATOM 276 O VAL A 21 94.781 -5.478 -22.668 1.00 0.00 O ATOM 277 CB VAL A 21 91.724 -4.651 -21.859 1.00 0.00 C ATOM 278 CG1 VAL A 21 91.732 -6.012 -22.558 1.00 0.00 C ATOM 279 CG2 VAL A 21 90.763 -4.698 -20.667 1.00 0.00 C ATOM 0 H VAL A 21 92.317 -2.420 -20.979 1.00 0.00 H new ATOM 0 HA VAL A 21 93.426 -5.025 -20.584 1.00 0.00 H new ATOM 0 HB VAL A 21 91.399 -3.885 -22.563 1.00 0.00 H new ATOM 0 HG11 VAL A 21 90.728 -6.245 -22.911 1.00 0.00 H new ATOM 0 HG12 VAL A 21 92.417 -5.982 -23.405 1.00 0.00 H new ATOM 0 HG13 VAL A 21 92.057 -6.780 -21.856 1.00 0.00 H new ATOM 0 HG21 VAL A 21 89.759 -4.934 -21.018 1.00 0.00 H new ATOM 0 HG22 VAL A 21 91.091 -5.464 -19.965 1.00 0.00 H new ATOM 0 HG23 VAL A 21 90.754 -3.729 -20.168 1.00 0.00 H new ATOM 289 N LEU A 22 94.236 -3.402 -23.332 1.00 0.00 N ATOM 290 CA LEU A 22 95.145 -3.429 -24.477 1.00 0.00 C ATOM 291 C LEU A 22 96.603 -3.530 -24.029 1.00 0.00 C ATOM 292 O LEU A 22 97.336 -4.406 -24.485 1.00 0.00 O ATOM 293 CB LEU A 22 94.943 -2.167 -25.330 1.00 0.00 C ATOM 294 CG LEU A 22 96.005 -2.082 -26.439 1.00 0.00 C ATOM 295 CD1 LEU A 22 96.031 -3.389 -27.244 1.00 0.00 C ATOM 296 CD2 LEU A 22 95.660 -0.917 -27.371 1.00 0.00 C ATOM 0 H LEU A 22 93.709 -2.535 -23.227 1.00 0.00 H new ATOM 0 HA LEU A 22 94.916 -4.313 -25.072 1.00 0.00 H new ATOM 0 HB2 LEU A 22 93.947 -2.178 -25.774 1.00 0.00 H new ATOM 0 HB3 LEU A 22 95.000 -1.282 -24.697 1.00 0.00 H new ATOM 0 HG LEU A 22 96.985 -1.923 -25.990 1.00 0.00 H new ATOM 0 HD11 LEU A 22 96.786 -3.319 -28.027 1.00 0.00 H new ATOM 0 HD12 LEU A 22 96.272 -4.220 -26.581 1.00 0.00 H new ATOM 0 HD13 LEU A 22 95.054 -3.557 -27.696 1.00 0.00 H new ATOM 0 HD21 LEU A 22 96.408 -0.849 -28.161 1.00 0.00 H new ATOM 0 HD22 LEU A 22 94.678 -1.084 -27.814 1.00 0.00 H new ATOM 0 HD23 LEU A 22 95.648 0.013 -26.802 1.00 0.00 H new ATOM 308 N ILE A 23 97.024 -2.631 -23.143 1.00 0.00 N ATOM 309 CA ILE A 23 98.404 -2.648 -22.665 1.00 0.00 C ATOM 310 C ILE A 23 98.672 -3.918 -21.860 1.00 0.00 C ATOM 311 O ILE A 23 99.711 -4.557 -22.025 1.00 0.00 O ATOM 312 CB ILE A 23 98.686 -1.409 -21.806 1.00 0.00 C ATOM 313 CG1 ILE A 23 98.272 -0.152 -22.579 1.00 0.00 C ATOM 314 CG2 ILE A 23 100.184 -1.325 -21.480 1.00 0.00 C ATOM 315 CD1 ILE A 23 98.423 1.077 -21.679 1.00 0.00 C ATOM 0 H ILE A 23 96.441 -1.893 -22.747 1.00 0.00 H new ATOM 0 HA ILE A 23 99.069 -2.634 -23.528 1.00 0.00 H new ATOM 0 HB ILE A 23 98.118 -1.482 -20.878 1.00 0.00 H new ATOM 0 HG12 ILE A 23 98.890 -0.041 -23.470 1.00 0.00 H new ATOM 0 HG13 ILE A 23 97.240 -0.244 -22.916 1.00 0.00 H new ATOM 0 HG21 ILE A 23 100.375 -0.442 -20.870 1.00 0.00 H new ATOM 0 HG22 ILE A 23 100.488 -2.217 -20.932 1.00 0.00 H new ATOM 0 HG23 ILE A 23 100.755 -1.256 -22.406 1.00 0.00 H new ATOM 0 HD11 ILE A 23 98.128 1.970 -22.230 1.00 0.00 H new ATOM 0 HD12 ILE A 23 97.786 0.966 -20.801 1.00 0.00 H new ATOM 0 HD13 ILE A 23 99.462 1.172 -21.364 1.00 0.00 H new ATOM 327 N ALA A 24 97.733 -4.281 -20.992 1.00 0.00 N ATOM 328 CA ALA A 24 97.889 -5.479 -20.175 1.00 0.00 C ATOM 329 C ALA A 24 98.069 -6.707 -21.061 1.00 0.00 C ATOM 330 O ALA A 24 98.877 -7.589 -20.767 1.00 0.00 O ATOM 331 CB ALA A 24 96.663 -5.667 -19.276 1.00 0.00 C ATOM 0 H ALA A 24 96.865 -3.769 -20.837 1.00 0.00 H new ATOM 0 HA ALA A 24 98.776 -5.359 -19.552 1.00 0.00 H new ATOM 0 HB1 ALA A 24 96.790 -6.564 -18.670 1.00 0.00 H new ATOM 0 HB2 ALA A 24 96.554 -4.801 -18.623 1.00 0.00 H new ATOM 0 HB3 ALA A 24 95.771 -5.770 -19.894 1.00 0.00 H new ATOM 337 N LEU A 25 97.310 -6.755 -22.150 1.00 0.00 N ATOM 338 CA LEU A 25 97.392 -7.876 -23.079 1.00 0.00 C ATOM 339 C LEU A 25 98.709 -7.829 -23.849 1.00 0.00 C ATOM 340 O LEU A 25 99.298 -8.865 -24.156 1.00 0.00 O ATOM 341 CB LEU A 25 96.209 -7.822 -24.055 1.00 0.00 C ATOM 342 CG LEU A 25 96.339 -8.915 -25.127 1.00 0.00 C ATOM 343 CD1 LEU A 25 96.501 -10.292 -24.465 1.00 0.00 C ATOM 344 CD2 LEU A 25 95.074 -8.912 -25.992 1.00 0.00 C ATOM 0 H LEU A 25 96.635 -6.036 -22.410 1.00 0.00 H new ATOM 0 HA LEU A 25 97.352 -8.809 -22.516 1.00 0.00 H new ATOM 0 HB2 LEU A 25 95.274 -7.951 -23.509 1.00 0.00 H new ATOM 0 HB3 LEU A 25 96.168 -6.842 -24.531 1.00 0.00 H new ATOM 0 HG LEU A 25 97.216 -8.716 -25.742 1.00 0.00 H new ATOM 0 HD11 LEU A 25 96.592 -11.058 -25.235 1.00 0.00 H new ATOM 0 HD12 LEU A 25 97.397 -10.294 -23.844 1.00 0.00 H new ATOM 0 HD13 LEU A 25 95.629 -10.503 -23.845 1.00 0.00 H new ATOM 0 HD21 LEU A 25 95.155 -9.684 -26.757 1.00 0.00 H new ATOM 0 HD22 LEU A 25 94.204 -9.111 -25.366 1.00 0.00 H new ATOM 0 HD23 LEU A 25 94.962 -7.939 -26.469 1.00 0.00 H new ATOM 356 N ALA A 26 99.160 -6.619 -24.162 1.00 0.00 N ATOM 357 CA ALA A 26 100.403 -6.441 -24.904 1.00 0.00 C ATOM 358 C ALA A 26 101.595 -6.957 -24.105 1.00 0.00 C ATOM 359 O ALA A 26 102.408 -7.727 -24.617 1.00 0.00 O ATOM 360 CB ALA A 26 100.608 -4.961 -25.231 1.00 0.00 C ATOM 0 H ALA A 26 98.686 -5.750 -23.915 1.00 0.00 H new ATOM 0 HA ALA A 26 100.331 -7.014 -25.829 1.00 0.00 H new ATOM 0 HB1 ALA A 26 101.538 -4.836 -25.785 1.00 0.00 H new ATOM 0 HB2 ALA A 26 99.775 -4.603 -25.836 1.00 0.00 H new ATOM 0 HB3 ALA A 26 100.657 -4.387 -24.305 1.00 0.00 H new ATOM 366 N VAL A 27 101.700 -6.531 -22.849 1.00 0.00 N ATOM 367 CA VAL A 27 102.806 -6.966 -22.005 1.00 0.00 C ATOM 368 C VAL A 27 102.665 -8.446 -21.667 1.00 0.00 C ATOM 369 O VAL A 27 103.658 -9.162 -21.540 1.00 0.00 O ATOM 370 CB VAL A 27 102.845 -6.142 -20.716 1.00 0.00 C ATOM 371 CG1 VAL A 27 103.003 -4.660 -21.063 1.00 0.00 C ATOM 372 CG2 VAL A 27 101.542 -6.347 -19.942 1.00 0.00 C ATOM 0 H VAL A 27 101.042 -5.894 -22.399 1.00 0.00 H new ATOM 0 HA VAL A 27 103.737 -6.815 -22.552 1.00 0.00 H new ATOM 0 HB VAL A 27 103.687 -6.464 -20.104 1.00 0.00 H new ATOM 0 HG11 VAL A 27 103.031 -4.072 -20.145 1.00 0.00 H new ATOM 0 HG12 VAL A 27 103.930 -4.513 -21.616 1.00 0.00 H new ATOM 0 HG13 VAL A 27 102.160 -4.338 -21.675 1.00 0.00 H new ATOM 0 HG21 VAL A 27 101.568 -5.761 -19.024 1.00 0.00 H new ATOM 0 HG22 VAL A 27 100.700 -6.024 -20.555 1.00 0.00 H new ATOM 0 HG23 VAL A 27 101.427 -7.403 -19.695 1.00 0.00 H new ATOM 382 N TYR A 28 101.423 -8.899 -21.526 1.00 0.00 N ATOM 383 CA TYR A 28 101.164 -10.298 -21.208 1.00 0.00 C ATOM 384 C TYR A 28 101.658 -11.201 -22.334 1.00 0.00 C ATOM 385 O TYR A 28 102.302 -12.221 -22.088 1.00 0.00 O ATOM 386 CB TYR A 28 99.665 -10.518 -20.995 1.00 0.00 C ATOM 387 CG TYR A 28 99.406 -11.980 -20.721 1.00 0.00 C ATOM 388 CD1 TYR A 28 99.267 -12.878 -21.785 1.00 0.00 C ATOM 389 CD2 TYR A 28 99.305 -12.437 -19.401 1.00 0.00 C ATOM 390 CE1 TYR A 28 99.027 -14.234 -21.531 1.00 0.00 C ATOM 391 CE2 TYR A 28 99.065 -13.793 -19.147 1.00 0.00 C ATOM 392 CZ TYR A 28 98.927 -14.691 -20.211 1.00 0.00 C ATOM 393 OH TYR A 28 98.690 -16.028 -19.961 1.00 0.00 O ATOM 0 H TYR A 28 100.587 -8.323 -21.626 1.00 0.00 H new ATOM 0 HA TYR A 28 101.700 -10.549 -20.293 1.00 0.00 H new ATOM 0 HB2 TYR A 28 99.312 -9.912 -20.160 1.00 0.00 H new ATOM 0 HB3 TYR A 28 99.110 -10.198 -21.877 1.00 0.00 H new ATOM 0 HD1 TYR A 28 99.345 -12.525 -22.803 1.00 0.00 H new ATOM 0 HD2 TYR A 28 99.412 -11.744 -18.580 1.00 0.00 H new ATOM 0 HE1 TYR A 28 98.919 -14.927 -22.352 1.00 0.00 H new ATOM 0 HE2 TYR A 28 98.986 -14.146 -18.129 1.00 0.00 H new ATOM 0 HH TYR A 28 98.650 -16.178 -18.993 1.00 0.00 H new ATOM 403 N PHE A 29 101.352 -10.820 -23.571 1.00 0.00 N ATOM 404 CA PHE A 29 101.770 -11.606 -24.727 1.00 0.00 C ATOM 405 C PHE A 29 103.292 -11.691 -24.791 1.00 0.00 C ATOM 406 O PHE A 29 103.859 -12.778 -24.909 1.00 0.00 O ATOM 407 CB PHE A 29 101.238 -10.968 -26.012 1.00 0.00 C ATOM 408 CG PHE A 29 101.714 -11.763 -27.205 1.00 0.00 C ATOM 409 CD1 PHE A 29 101.105 -12.982 -27.522 1.00 0.00 C ATOM 410 CD2 PHE A 29 102.766 -11.280 -27.995 1.00 0.00 C ATOM 411 CE1 PHE A 29 101.545 -13.719 -28.629 1.00 0.00 C ATOM 412 CE2 PHE A 29 103.207 -12.017 -29.101 1.00 0.00 C ATOM 413 CZ PHE A 29 102.596 -13.236 -29.418 1.00 0.00 C ATOM 0 H PHE A 29 100.821 -9.979 -23.797 1.00 0.00 H new ATOM 0 HA PHE A 29 101.364 -12.612 -24.627 1.00 0.00 H new ATOM 0 HB2 PHE A 29 100.149 -10.939 -25.992 1.00 0.00 H new ATOM 0 HB3 PHE A 29 101.583 -9.937 -26.088 1.00 0.00 H new ATOM 0 HD1 PHE A 29 100.295 -13.355 -26.913 1.00 0.00 H new ATOM 0 HD2 PHE A 29 103.237 -10.339 -27.751 1.00 0.00 H new ATOM 0 HE1 PHE A 29 101.074 -14.659 -28.874 1.00 0.00 H new ATOM 0 HE2 PHE A 29 104.018 -11.645 -29.709 1.00 0.00 H new ATOM 0 HZ PHE A 29 102.935 -13.804 -30.271 1.00 0.00 H new ATOM 423 N LEU A 30 103.948 -10.538 -24.705 1.00 0.00 N ATOM 424 CA LEU A 30 105.405 -10.494 -24.749 1.00 0.00 C ATOM 425 C LEU A 30 105.990 -11.089 -23.472 1.00 0.00 C ATOM 426 O LEU A 30 107.042 -11.726 -23.497 1.00 0.00 O ATOM 427 CB LEU A 30 105.887 -9.048 -24.907 1.00 0.00 C ATOM 428 CG LEU A 30 105.244 -8.411 -26.148 1.00 0.00 C ATOM 429 CD1 LEU A 30 105.436 -6.893 -26.093 1.00 0.00 C ATOM 430 CD2 LEU A 30 105.896 -8.954 -27.427 1.00 0.00 C ATOM 0 H LEU A 30 103.498 -9.628 -24.605 1.00 0.00 H new ATOM 0 HA LEU A 30 105.742 -11.080 -25.604 1.00 0.00 H new ATOM 0 HB2 LEU A 30 105.630 -8.472 -24.018 1.00 0.00 H new ATOM 0 HB3 LEU A 30 106.973 -9.026 -24.999 1.00 0.00 H new ATOM 0 HG LEU A 30 104.182 -8.655 -26.160 1.00 0.00 H new ATOM 0 HD11 LEU A 30 104.981 -6.437 -26.972 1.00 0.00 H new ATOM 0 HD12 LEU A 30 104.963 -6.499 -25.194 1.00 0.00 H new ATOM 0 HD13 LEU A 30 106.501 -6.661 -26.074 1.00 0.00 H new ATOM 0 HD21 LEU A 30 105.429 -8.493 -28.297 1.00 0.00 H new ATOM 0 HD22 LEU A 30 106.961 -8.721 -27.420 1.00 0.00 H new ATOM 0 HD23 LEU A 30 105.762 -10.035 -27.473 1.00 0.00 H new ATOM 442 N GLY A 31 105.299 -10.873 -22.358 1.00 0.00 N ATOM 443 CA GLY A 31 105.756 -11.391 -21.073 1.00 0.00 C ATOM 444 C GLY A 31 105.953 -12.901 -21.135 1.00 0.00 C ATOM 445 O GLY A 31 106.092 -13.475 -22.215 1.00 0.00 O ATOM 0 H GLY A 31 104.426 -10.347 -22.318 1.00 0.00 H new ATOM 0 HA2 GLY A 31 106.693 -10.909 -20.794 1.00 0.00 H new ATOM 0 HA3 GLY A 31 105.029 -11.146 -20.298 1.00 0.00 H new ATOM 449 N ARG A 32 105.967 -13.541 -19.969 1.00 0.00 N ATOM 450 CA ARG A 32 106.151 -14.986 -19.906 1.00 0.00 C ATOM 451 C ARG A 32 105.646 -15.537 -18.576 1.00 0.00 C ATOM 452 O ARG A 32 106.037 -15.065 -17.508 1.00 0.00 O ATOM 453 CB ARG A 32 107.631 -15.331 -20.073 1.00 0.00 C ATOM 454 CG ARG A 32 107.804 -16.850 -20.105 1.00 0.00 C ATOM 455 CD ARG A 32 109.266 -17.192 -20.398 1.00 0.00 C ATOM 456 NE ARG A 32 109.446 -18.637 -20.439 1.00 0.00 N ATOM 457 CZ ARG A 32 109.087 -19.344 -21.506 1.00 0.00 C ATOM 458 NH1 ARG A 32 108.559 -18.743 -22.538 1.00 0.00 N ATOM 459 NH2 ARG A 32 109.260 -20.637 -21.522 1.00 0.00 N ATOM 0 H ARG A 32 105.854 -13.086 -19.063 1.00 0.00 H new ATOM 0 HA ARG A 32 105.577 -15.440 -20.714 1.00 0.00 H new ATOM 0 HB2 ARG A 32 108.015 -14.892 -20.994 1.00 0.00 H new ATOM 0 HB3 ARG A 32 108.209 -14.906 -19.252 1.00 0.00 H new ATOM 0 HG2 ARG A 32 107.503 -17.281 -19.150 1.00 0.00 H new ATOM 0 HG3 ARG A 32 107.158 -17.284 -20.868 1.00 0.00 H new ATOM 0 HD2 ARG A 32 109.566 -16.754 -21.350 1.00 0.00 H new ATOM 0 HD3 ARG A 32 109.909 -16.760 -19.631 1.00 0.00 H new ATOM 0 HE ARG A 32 109.854 -19.114 -19.635 1.00 0.00 H new ATOM 0 HH11 ARG A 32 108.422 -17.732 -22.525 1.00 0.00 H new ATOM 0 HH12 ARG A 32 108.283 -19.284 -23.357 1.00 0.00 H new ATOM 0 HH21 ARG A 32 109.671 -21.107 -20.715 1.00 0.00 H new ATOM 0 HH22 ARG A 32 108.984 -21.178 -22.341 1.00 0.00 H new ATOM 473 N LEU A 33 104.776 -16.540 -18.649 1.00 0.00 N ATOM 474 CA LEU A 33 104.220 -17.155 -17.447 1.00 0.00 C ATOM 475 C LEU A 33 105.175 -18.221 -16.912 1.00 0.00 C ATOM 476 O LEU A 33 106.260 -18.427 -17.458 1.00 0.00 O ATOM 477 CB LEU A 33 102.849 -17.787 -17.762 1.00 0.00 C ATOM 478 CG LEU A 33 102.862 -18.418 -19.176 1.00 0.00 C ATOM 479 CD1 LEU A 33 101.926 -19.633 -19.217 1.00 0.00 C ATOM 480 CD2 LEU A 33 102.392 -17.388 -20.219 1.00 0.00 C ATOM 0 H LEU A 33 104.441 -16.943 -19.524 1.00 0.00 H new ATOM 0 HA LEU A 33 104.089 -16.385 -16.687 1.00 0.00 H new ATOM 0 HB2 LEU A 33 102.612 -18.548 -17.019 1.00 0.00 H new ATOM 0 HB3 LEU A 33 102.068 -17.029 -17.702 1.00 0.00 H new ATOM 0 HG LEU A 33 103.880 -18.732 -19.406 1.00 0.00 H new ATOM 0 HD11 LEU A 33 101.941 -20.071 -20.215 1.00 0.00 H new ATOM 0 HD12 LEU A 33 102.260 -20.374 -18.491 1.00 0.00 H new ATOM 0 HD13 LEU A 33 100.911 -19.319 -18.974 1.00 0.00 H new ATOM 0 HD21 LEU A 33 102.405 -17.842 -21.210 1.00 0.00 H new ATOM 0 HD22 LEU A 33 101.378 -17.065 -19.981 1.00 0.00 H new ATOM 0 HD23 LEU A 33 103.059 -16.526 -20.206 1.00 0.00 H new ATOM 492 N GLY A 34 104.764 -18.895 -15.843 1.00 0.00 N ATOM 493 CA GLY A 34 105.592 -19.937 -15.245 1.00 0.00 C ATOM 494 C GLY A 34 106.754 -19.329 -14.468 1.00 0.00 C ATOM 495 O GLY A 34 107.394 -20.003 -13.661 1.00 0.00 O ATOM 0 H GLY A 34 103.870 -18.741 -15.376 1.00 0.00 H new ATOM 0 HA2 GLY A 34 104.986 -20.551 -14.579 1.00 0.00 H new ATOM 0 HA3 GLY A 34 105.975 -20.595 -16.025 1.00 0.00 H new ATOM 499 N THR A 35 107.023 -18.052 -14.719 1.00 0.00 N ATOM 500 CA THR A 35 108.112 -17.360 -14.038 1.00 0.00 C ATOM 501 C THR A 35 107.676 -16.917 -12.646 1.00 0.00 C ATOM 502 O THR A 35 108.234 -15.978 -12.080 1.00 0.00 O ATOM 503 CB THR A 35 108.544 -16.138 -14.851 1.00 0.00 C ATOM 504 OG1 THR A 35 109.675 -15.538 -14.236 1.00 0.00 O ATOM 505 CG2 THR A 35 107.395 -15.129 -14.908 1.00 0.00 C ATOM 0 H THR A 35 106.506 -17.478 -15.385 1.00 0.00 H new ATOM 0 HA THR A 35 108.952 -18.048 -13.943 1.00 0.00 H new ATOM 0 HB THR A 35 108.803 -16.447 -15.864 1.00 0.00 H new ATOM 0 HG1 THR A 35 109.504 -15.422 -13.278 1.00 0.00 H new ATOM 0 HG21 THR A 35 107.703 -14.259 -15.487 1.00 0.00 H new ATOM 0 HG22 THR A 35 106.528 -15.591 -15.381 1.00 0.00 H new ATOM 0 HG23 THR A 35 107.134 -14.818 -13.897 1.00 0.00 H new ATOM 513 N ALA A 36 106.673 -17.599 -12.101 1.00 0.00 N ATOM 514 CA ALA A 36 106.169 -17.264 -10.775 1.00 0.00 C ATOM 515 C ALA A 36 105.858 -15.773 -10.683 1.00 0.00 C ATOM 516 O ALA A 36 105.891 -15.060 -11.686 1.00 0.00 O ATOM 517 CB ALA A 36 107.203 -17.639 -9.713 1.00 0.00 C ATOM 0 H ALA A 36 106.197 -18.380 -12.553 1.00 0.00 H new ATOM 0 HA ALA A 36 105.252 -17.827 -10.601 1.00 0.00 H new ATOM 0 HB1 ALA A 36 106.818 -17.385 -8.725 1.00 0.00 H new ATOM 0 HB2 ALA A 36 107.402 -18.710 -9.761 1.00 0.00 H new ATOM 0 HB3 ALA A 36 108.127 -17.090 -9.895 1.00 0.00 H new ATOM 523 N GLU A 37 105.556 -15.309 -9.476 1.00 0.00 N ATOM 524 CA GLU A 37 105.241 -13.900 -9.267 1.00 0.00 C ATOM 525 C GLU A 37 104.050 -13.493 -10.135 1.00 0.00 C ATOM 526 O GLU A 37 103.697 -12.317 -10.215 1.00 0.00 O ATOM 527 CB GLU A 37 106.467 -13.039 -9.613 1.00 0.00 C ATOM 528 CG GLU A 37 106.391 -11.696 -8.879 1.00 0.00 C ATOM 529 CD GLU A 37 106.643 -11.902 -7.390 1.00 0.00 C ATOM 530 OE1 GLU A 37 107.229 -12.914 -7.042 1.00 0.00 O ATOM 531 OE2 GLU A 37 106.247 -11.045 -6.618 1.00 0.00 O ATOM 0 H GLU A 37 105.522 -15.882 -8.633 1.00 0.00 H new ATOM 0 HA GLU A 37 104.979 -13.744 -8.221 1.00 0.00 H new ATOM 0 HB2 GLU A 37 107.380 -13.564 -9.333 1.00 0.00 H new ATOM 0 HB3 GLU A 37 106.512 -12.872 -10.689 1.00 0.00 H new ATOM 0 HG2 GLU A 37 107.128 -11.006 -9.289 1.00 0.00 H new ATOM 0 HG3 GLU A 37 105.411 -11.244 -9.031 1.00 0.00 H new ATOM 538 N VAL A 38 103.435 -14.478 -10.780 1.00 0.00 N ATOM 539 CA VAL A 38 102.285 -14.219 -11.639 1.00 0.00 C ATOM 540 C VAL A 38 101.182 -13.511 -10.858 1.00 0.00 C ATOM 541 O VAL A 38 100.368 -12.787 -11.431 1.00 0.00 O ATOM 542 CB VAL A 38 101.747 -15.536 -12.202 1.00 0.00 C ATOM 543 CG1 VAL A 38 102.812 -16.184 -13.089 1.00 0.00 C ATOM 544 CG2 VAL A 38 101.404 -16.481 -11.047 1.00 0.00 C ATOM 0 H VAL A 38 103.711 -15.458 -10.725 1.00 0.00 H new ATOM 0 HA VAL A 38 102.605 -13.576 -12.459 1.00 0.00 H new ATOM 0 HB VAL A 38 100.851 -15.340 -12.792 1.00 0.00 H new ATOM 0 HG11 VAL A 38 102.429 -17.122 -13.490 1.00 0.00 H new ATOM 0 HG12 VAL A 38 103.059 -15.512 -13.911 1.00 0.00 H new ATOM 0 HG13 VAL A 38 103.707 -16.380 -12.499 1.00 0.00 H new ATOM 0 HG21 VAL A 38 101.021 -17.420 -11.447 1.00 0.00 H new ATOM 0 HG22 VAL A 38 102.300 -16.676 -10.458 1.00 0.00 H new ATOM 0 HG23 VAL A 38 100.647 -16.020 -10.413 1.00 0.00 H new ATOM 554 N LEU A 39 101.162 -13.729 -9.548 1.00 0.00 N ATOM 555 CA LEU A 39 100.155 -13.113 -8.690 1.00 0.00 C ATOM 556 C LEU A 39 100.032 -11.621 -8.990 1.00 0.00 C ATOM 557 O LEU A 39 98.951 -11.041 -8.872 1.00 0.00 O ATOM 558 CB LEU A 39 100.538 -13.324 -7.219 1.00 0.00 C ATOM 559 CG LEU A 39 99.561 -12.587 -6.290 1.00 0.00 C ATOM 560 CD1 LEU A 39 98.117 -13.019 -6.587 1.00 0.00 C ATOM 561 CD2 LEU A 39 99.907 -12.928 -4.837 1.00 0.00 C ATOM 0 H LEU A 39 101.829 -14.325 -9.058 1.00 0.00 H new ATOM 0 HA LEU A 39 99.191 -13.582 -8.885 1.00 0.00 H new ATOM 0 HB2 LEU A 39 100.535 -14.389 -6.987 1.00 0.00 H new ATOM 0 HB3 LEU A 39 101.552 -12.964 -7.047 1.00 0.00 H new ATOM 0 HG LEU A 39 99.646 -11.513 -6.454 1.00 0.00 H new ATOM 0 HD11 LEU A 39 97.435 -12.490 -5.922 1.00 0.00 H new ATOM 0 HD12 LEU A 39 97.872 -12.782 -7.622 1.00 0.00 H new ATOM 0 HD13 LEU A 39 98.018 -14.093 -6.428 1.00 0.00 H new ATOM 0 HD21 LEU A 39 99.220 -12.410 -4.168 1.00 0.00 H new ATOM 0 HD22 LEU A 39 99.820 -14.004 -4.685 1.00 0.00 H new ATOM 0 HD23 LEU A 39 100.928 -12.613 -4.623 1.00 0.00 H new ATOM 573 N GLY A 40 101.144 -11.002 -9.372 1.00 0.00 N ATOM 574 CA GLY A 40 101.142 -9.575 -9.676 1.00 0.00 C ATOM 575 C GLY A 40 100.239 -9.261 -10.866 1.00 0.00 C ATOM 576 O GLY A 40 99.359 -8.408 -10.776 1.00 0.00 O ATOM 0 H GLY A 40 102.049 -11.460 -9.478 1.00 0.00 H new ATOM 0 HA2 GLY A 40 100.804 -9.016 -8.803 1.00 0.00 H new ATOM 0 HA3 GLY A 40 102.158 -9.246 -9.892 1.00 0.00 H new ATOM 580 N ILE A 41 100.460 -9.956 -11.978 1.00 0.00 N ATOM 581 CA ILE A 41 99.658 -9.733 -13.178 1.00 0.00 C ATOM 582 C ILE A 41 98.175 -9.924 -12.871 1.00 0.00 C ATOM 583 O ILE A 41 97.332 -9.105 -13.259 1.00 0.00 O ATOM 584 CB ILE A 41 100.081 -10.712 -14.276 1.00 0.00 C ATOM 585 CG1 ILE A 41 101.611 -10.735 -14.393 1.00 0.00 C ATOM 586 CG2 ILE A 41 99.474 -10.276 -15.612 1.00 0.00 C ATOM 587 CD1 ILE A 41 102.154 -9.308 -14.519 1.00 0.00 C ATOM 0 H ILE A 41 101.180 -10.672 -12.074 1.00 0.00 H new ATOM 0 HA ILE A 41 99.821 -8.710 -13.518 1.00 0.00 H new ATOM 0 HB ILE A 41 99.725 -11.710 -14.022 1.00 0.00 H new ATOM 0 HG12 ILE A 41 102.043 -11.220 -13.517 1.00 0.00 H new ATOM 0 HG13 ILE A 41 101.908 -11.323 -15.262 1.00 0.00 H new ATOM 0 HG21 ILE A 41 99.776 -10.973 -16.394 1.00 0.00 H new ATOM 0 HG22 ILE A 41 98.387 -10.268 -15.532 1.00 0.00 H new ATOM 0 HG23 ILE A 41 99.827 -9.276 -15.863 1.00 0.00 H new ATOM 0 HD11 ILE A 41 103.240 -9.338 -14.601 1.00 0.00 H new ATOM 0 HD12 ILE A 41 101.736 -8.837 -15.408 1.00 0.00 H new ATOM 0 HD13 ILE A 41 101.873 -8.732 -13.637 1.00 0.00 H new ATOM 599 N ILE A 42 97.862 -11.008 -12.171 1.00 0.00 N ATOM 600 CA ILE A 42 96.482 -11.297 -11.817 1.00 0.00 C ATOM 601 C ILE A 42 95.869 -10.111 -11.077 1.00 0.00 C ATOM 602 O ILE A 42 94.748 -9.703 -11.368 1.00 0.00 O ATOM 603 CB ILE A 42 96.418 -12.553 -10.942 1.00 0.00 C ATOM 604 CG1 ILE A 42 96.819 -13.772 -11.778 1.00 0.00 C ATOM 605 CG2 ILE A 42 94.992 -12.747 -10.418 1.00 0.00 C ATOM 606 CD1 ILE A 42 97.026 -14.984 -10.866 1.00 0.00 C ATOM 0 H ILE A 42 98.540 -11.695 -11.841 1.00 0.00 H new ATOM 0 HA ILE A 42 95.913 -11.472 -12.730 1.00 0.00 H new ATOM 0 HB ILE A 42 97.100 -12.441 -10.099 1.00 0.00 H new ATOM 0 HG12 ILE A 42 96.046 -13.989 -12.515 1.00 0.00 H new ATOM 0 HG13 ILE A 42 97.735 -13.560 -12.330 1.00 0.00 H new ATOM 0 HG21 ILE A 42 94.951 -13.641 -9.796 1.00 0.00 H new ATOM 0 HG22 ILE A 42 94.701 -11.880 -9.825 1.00 0.00 H new ATOM 0 HG23 ILE A 42 94.307 -12.858 -11.259 1.00 0.00 H new ATOM 0 HD11 ILE A 42 97.311 -15.847 -11.467 1.00 0.00 H new ATOM 0 HD12 ILE A 42 97.815 -14.767 -10.146 1.00 0.00 H new ATOM 0 HD13 ILE A 42 96.100 -15.202 -10.335 1.00 0.00 H new ATOM 618 N SER A 43 96.614 -9.564 -10.124 1.00 0.00 N ATOM 619 CA SER A 43 96.131 -8.425 -9.349 1.00 0.00 C ATOM 620 C SER A 43 95.835 -7.231 -10.255 1.00 0.00 C ATOM 621 O SER A 43 94.840 -6.532 -10.066 1.00 0.00 O ATOM 622 CB SER A 43 97.173 -8.026 -8.305 1.00 0.00 C ATOM 623 OG SER A 43 96.674 -6.940 -7.536 1.00 0.00 O ATOM 0 H SER A 43 97.548 -9.887 -9.870 1.00 0.00 H new ATOM 0 HA SER A 43 95.207 -8.721 -8.852 1.00 0.00 H new ATOM 0 HB2 SER A 43 97.398 -8.873 -7.657 1.00 0.00 H new ATOM 0 HB3 SER A 43 98.105 -7.743 -8.794 1.00 0.00 H new ATOM 0 HG SER A 43 97.339 -6.682 -6.864 1.00 0.00 H new ATOM 629 N ILE A 44 96.707 -6.996 -11.231 1.00 0.00 N ATOM 630 CA ILE A 44 96.529 -5.874 -12.150 1.00 0.00 C ATOM 631 C ILE A 44 95.181 -5.958 -12.868 1.00 0.00 C ATOM 632 O ILE A 44 94.380 -5.010 -12.848 1.00 0.00 O ATOM 633 CB ILE A 44 97.658 -5.875 -13.186 1.00 0.00 C ATOM 634 CG1 ILE A 44 99.026 -5.709 -12.480 1.00 0.00 C ATOM 635 CG2 ILE A 44 97.437 -4.742 -14.194 1.00 0.00 C ATOM 636 CD1 ILE A 44 99.349 -4.228 -12.223 1.00 0.00 C ATOM 0 H ILE A 44 97.538 -7.562 -11.406 1.00 0.00 H new ATOM 0 HA ILE A 44 96.554 -4.951 -11.571 1.00 0.00 H new ATOM 0 HB ILE A 44 97.655 -6.826 -13.719 1.00 0.00 H new ATOM 0 HG12 ILE A 44 99.017 -6.250 -11.534 1.00 0.00 H new ATOM 0 HG13 ILE A 44 99.810 -6.153 -13.094 1.00 0.00 H new ATOM 0 HG21 ILE A 44 98.242 -4.746 -14.929 1.00 0.00 H new ATOM 0 HG22 ILE A 44 96.483 -4.887 -14.700 1.00 0.00 H new ATOM 0 HG23 ILE A 44 97.429 -3.786 -13.671 1.00 0.00 H new ATOM 0 HD11 ILE A 44 100.316 -4.147 -11.726 1.00 0.00 H new ATOM 0 HD12 ILE A 44 99.383 -3.693 -13.172 1.00 0.00 H new ATOM 0 HD13 ILE A 44 98.578 -3.792 -11.588 1.00 0.00 H new ATOM 648 N VAL A 45 94.922 -7.094 -13.503 1.00 0.00 N ATOM 649 CA VAL A 45 93.662 -7.264 -14.217 1.00 0.00 C ATOM 650 C VAL A 45 92.490 -7.236 -13.237 1.00 0.00 C ATOM 651 O VAL A 45 91.372 -6.864 -13.598 1.00 0.00 O ATOM 652 CB VAL A 45 93.671 -8.578 -15.002 1.00 0.00 C ATOM 653 CG1 VAL A 45 94.013 -9.729 -14.064 1.00 0.00 C ATOM 654 CG2 VAL A 45 92.294 -8.815 -15.627 1.00 0.00 C ATOM 0 H VAL A 45 95.552 -7.896 -13.539 1.00 0.00 H new ATOM 0 HA VAL A 45 93.545 -6.440 -14.921 1.00 0.00 H new ATOM 0 HB VAL A 45 94.419 -8.521 -15.793 1.00 0.00 H new ATOM 0 HG11 VAL A 45 94.019 -10.665 -14.623 1.00 0.00 H new ATOM 0 HG12 VAL A 45 94.997 -9.561 -13.626 1.00 0.00 H new ATOM 0 HG13 VAL A 45 93.268 -9.786 -13.271 1.00 0.00 H new ATOM 0 HG21 VAL A 45 92.304 -9.751 -16.185 1.00 0.00 H new ATOM 0 HG22 VAL A 45 91.542 -8.870 -14.840 1.00 0.00 H new ATOM 0 HG23 VAL A 45 92.054 -7.993 -16.302 1.00 0.00 H new ATOM 664 N LEU A 46 92.754 -7.636 -11.995 1.00 0.00 N ATOM 665 CA LEU A 46 91.716 -7.659 -10.969 1.00 0.00 C ATOM 666 C LEU A 46 91.250 -6.241 -10.617 1.00 0.00 C ATOM 667 O LEU A 46 90.048 -5.983 -10.526 1.00 0.00 O ATOM 668 CB LEU A 46 92.251 -8.369 -9.704 1.00 0.00 C ATOM 669 CG LEU A 46 91.123 -9.103 -8.951 1.00 0.00 C ATOM 670 CD1 LEU A 46 89.965 -8.140 -8.675 1.00 0.00 C ATOM 671 CD2 LEU A 46 90.613 -10.312 -9.770 1.00 0.00 C ATOM 0 H LEU A 46 93.672 -7.947 -11.677 1.00 0.00 H new ATOM 0 HA LEU A 46 90.859 -8.206 -11.361 1.00 0.00 H new ATOM 0 HB2 LEU A 46 93.026 -9.082 -9.985 1.00 0.00 H new ATOM 0 HB3 LEU A 46 92.715 -7.637 -9.043 1.00 0.00 H new ATOM 0 HG LEU A 46 91.523 -9.468 -8.005 1.00 0.00 H new ATOM 0 HD11 LEU A 46 89.173 -8.667 -8.143 1.00 0.00 H new ATOM 0 HD12 LEU A 46 90.320 -7.309 -8.066 1.00 0.00 H new ATOM 0 HD13 LEU A 46 89.576 -7.758 -9.619 1.00 0.00 H new ATOM 0 HD21 LEU A 46 89.818 -10.815 -9.220 1.00 0.00 H new ATOM 0 HD22 LEU A 46 90.228 -9.965 -10.729 1.00 0.00 H new ATOM 0 HD23 LEU A 46 91.434 -11.009 -9.939 1.00 0.00 H new ATOM 683 N VAL A 47 92.199 -5.322 -10.410 1.00 0.00 N ATOM 684 CA VAL A 47 91.840 -3.955 -10.057 1.00 0.00 C ATOM 685 C VAL A 47 91.149 -3.263 -11.225 1.00 0.00 C ATOM 686 O VAL A 47 90.270 -2.427 -11.024 1.00 0.00 O ATOM 687 CB VAL A 47 93.080 -3.163 -9.621 1.00 0.00 C ATOM 688 CG1 VAL A 47 94.172 -3.274 -10.679 1.00 0.00 C ATOM 689 CG2 VAL A 47 92.708 -1.689 -9.426 1.00 0.00 C ATOM 0 H VAL A 47 93.201 -5.499 -10.480 1.00 0.00 H new ATOM 0 HA VAL A 47 91.145 -3.992 -9.218 1.00 0.00 H new ATOM 0 HB VAL A 47 93.449 -3.575 -8.682 1.00 0.00 H new ATOM 0 HG11 VAL A 47 95.047 -2.708 -10.359 1.00 0.00 H new ATOM 0 HG12 VAL A 47 94.445 -4.321 -10.812 1.00 0.00 H new ATOM 0 HG13 VAL A 47 93.806 -2.872 -11.624 1.00 0.00 H new ATOM 0 HG21 VAL A 47 93.590 -1.129 -9.116 1.00 0.00 H new ATOM 0 HG22 VAL A 47 92.330 -1.282 -10.364 1.00 0.00 H new ATOM 0 HG23 VAL A 47 91.938 -1.606 -8.659 1.00 0.00 H new ATOM 699 N ALA A 48 91.548 -3.605 -12.449 1.00 0.00 N ATOM 700 CA ALA A 48 90.938 -2.983 -13.623 1.00 0.00 C ATOM 701 C ALA A 48 89.474 -3.397 -13.784 1.00 0.00 C ATOM 702 O ALA A 48 88.617 -2.561 -14.071 1.00 0.00 O ATOM 703 CB ALA A 48 91.715 -3.358 -14.885 1.00 0.00 C ATOM 0 H ALA A 48 92.273 -4.293 -12.652 1.00 0.00 H new ATOM 0 HA ALA A 48 90.974 -1.903 -13.477 1.00 0.00 H new ATOM 0 HB1 ALA A 48 91.250 -2.888 -15.752 1.00 0.00 H new ATOM 0 HB2 ALA A 48 92.745 -3.013 -14.794 1.00 0.00 H new ATOM 0 HB3 ALA A 48 91.705 -4.441 -15.010 1.00 0.00 H new ATOM 709 N THR A 49 89.195 -4.685 -13.619 1.00 0.00 N ATOM 710 CA THR A 49 87.829 -5.182 -13.774 1.00 0.00 C ATOM 711 C THR A 49 86.900 -4.642 -12.685 1.00 0.00 C ATOM 712 O THR A 49 85.832 -4.106 -12.983 1.00 0.00 O ATOM 713 CB THR A 49 87.828 -6.713 -13.736 1.00 0.00 C ATOM 714 OG1 THR A 49 88.595 -7.157 -12.626 1.00 0.00 O ATOM 715 CG2 THR A 49 88.434 -7.260 -15.031 1.00 0.00 C ATOM 0 H THR A 49 89.885 -5.398 -13.381 1.00 0.00 H new ATOM 0 HA THR A 49 87.456 -4.832 -14.736 1.00 0.00 H new ATOM 0 HB THR A 49 86.804 -7.074 -13.638 1.00 0.00 H new ATOM 0 HG1 THR A 49 89.535 -7.239 -12.890 1.00 0.00 H new ATOM 0 HG21 THR A 49 88.432 -8.350 -15.002 1.00 0.00 H new ATOM 0 HG22 THR A 49 87.844 -6.919 -15.881 1.00 0.00 H new ATOM 0 HG23 THR A 49 89.458 -6.901 -15.133 1.00 0.00 H new ATOM 723 N VAL A 50 87.300 -4.796 -11.426 1.00 0.00 N ATOM 724 CA VAL A 50 86.471 -4.327 -10.315 1.00 0.00 C ATOM 725 C VAL A 50 86.339 -2.808 -10.327 1.00 0.00 C ATOM 726 O VAL A 50 85.283 -2.272 -10.006 1.00 0.00 O ATOM 727 CB VAL A 50 87.078 -4.768 -8.981 1.00 0.00 C ATOM 728 CG1 VAL A 50 87.208 -6.297 -8.953 1.00 0.00 C ATOM 729 CG2 VAL A 50 88.458 -4.114 -8.814 1.00 0.00 C ATOM 0 H VAL A 50 88.179 -5.234 -11.150 1.00 0.00 H new ATOM 0 HA VAL A 50 85.480 -4.765 -10.433 1.00 0.00 H new ATOM 0 HB VAL A 50 86.432 -4.457 -8.160 1.00 0.00 H new ATOM 0 HG11 VAL A 50 87.640 -6.608 -8.002 1.00 0.00 H new ATOM 0 HG12 VAL A 50 86.222 -6.748 -9.068 1.00 0.00 H new ATOM 0 HG13 VAL A 50 87.854 -6.622 -9.769 1.00 0.00 H new ATOM 0 HG21 VAL A 50 88.895 -4.425 -7.865 1.00 0.00 H new ATOM 0 HG22 VAL A 50 89.109 -4.423 -9.632 1.00 0.00 H new ATOM 0 HG23 VAL A 50 88.350 -3.029 -8.826 1.00 0.00 H new ATOM 739 N LEU A 51 87.412 -2.115 -10.688 1.00 0.00 N ATOM 740 CA LEU A 51 87.379 -0.659 -10.721 1.00 0.00 C ATOM 741 C LEU A 51 86.412 -0.171 -11.784 1.00 0.00 C ATOM 742 O LEU A 51 85.657 0.769 -11.555 1.00 0.00 O ATOM 743 CB LEU A 51 88.787 -0.107 -10.994 1.00 0.00 C ATOM 744 CG LEU A 51 88.754 1.444 -11.116 1.00 0.00 C ATOM 745 CD1 LEU A 51 89.987 2.053 -10.433 1.00 0.00 C ATOM 746 CD2 LEU A 51 88.753 1.865 -12.597 1.00 0.00 C ATOM 0 H LEU A 51 88.303 -2.530 -10.958 1.00 0.00 H new ATOM 0 HA LEU A 51 87.037 -0.298 -9.751 1.00 0.00 H new ATOM 0 HB2 LEU A 51 89.460 -0.399 -10.188 1.00 0.00 H new ATOM 0 HB3 LEU A 51 89.182 -0.541 -11.913 1.00 0.00 H new ATOM 0 HG LEU A 51 87.846 1.804 -10.632 1.00 0.00 H new ATOM 0 HD11 LEU A 51 89.954 3.139 -10.524 1.00 0.00 H new ATOM 0 HD12 LEU A 51 89.992 1.777 -9.378 1.00 0.00 H new ATOM 0 HD13 LEU A 51 90.891 1.676 -10.911 1.00 0.00 H new ATOM 0 HD21 LEU A 51 88.730 2.953 -12.666 1.00 0.00 H new ATOM 0 HD22 LEU A 51 89.654 1.490 -13.083 1.00 0.00 H new ATOM 0 HD23 LEU A 51 87.875 1.451 -13.092 1.00 0.00 H new ATOM 758 N LYS A 52 86.435 -0.810 -12.942 1.00 0.00 N ATOM 759 CA LYS A 52 85.550 -0.418 -14.027 1.00 0.00 C ATOM 760 C LYS A 52 84.088 -0.610 -13.633 1.00 0.00 C ATOM 761 O LYS A 52 83.283 0.302 -13.768 1.00 0.00 O ATOM 762 CB LYS A 52 85.860 -1.254 -15.275 1.00 0.00 C ATOM 763 CG LYS A 52 85.113 -0.691 -16.502 1.00 0.00 C ATOM 764 CD LYS A 52 85.949 0.407 -17.175 1.00 0.00 C ATOM 765 CE LYS A 52 85.056 1.231 -18.104 1.00 0.00 C ATOM 766 NZ LYS A 52 84.494 0.350 -19.167 1.00 0.00 N ATOM 0 H LYS A 52 87.050 -1.595 -13.154 1.00 0.00 H new ATOM 0 HA LYS A 52 85.715 0.638 -14.241 1.00 0.00 H new ATOM 0 HB2 LYS A 52 86.934 -1.253 -15.463 1.00 0.00 H new ATOM 0 HB3 LYS A 52 85.567 -2.290 -15.108 1.00 0.00 H new ATOM 0 HG2 LYS A 52 84.912 -1.492 -17.213 1.00 0.00 H new ATOM 0 HG3 LYS A 52 84.148 -0.287 -16.195 1.00 0.00 H new ATOM 0 HD2 LYS A 52 86.398 1.051 -16.419 1.00 0.00 H new ATOM 0 HD3 LYS A 52 86.767 -0.039 -17.741 1.00 0.00 H new ATOM 0 HE2 LYS A 52 84.249 1.692 -17.535 1.00 0.00 H new ATOM 0 HE3 LYS A 52 85.631 2.040 -18.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 84.809 0.687 -20.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 84.826 -0.625 -19.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 83.455 0.373 -19.123 1.00 0.00 H new ATOM 780 N THR A 53 83.747 -1.802 -13.168 1.00 0.00 N ATOM 781 CA THR A 53 82.366 -2.098 -12.792 1.00 0.00 C ATOM 782 C THR A 53 81.892 -1.284 -11.584 1.00 0.00 C ATOM 783 O THR A 53 80.763 -0.788 -11.568 1.00 0.00 O ATOM 784 CB THR A 53 82.231 -3.588 -12.474 1.00 0.00 C ATOM 785 OG1 THR A 53 83.127 -3.930 -11.425 1.00 0.00 O ATOM 786 CG2 THR A 53 82.565 -4.410 -13.719 1.00 0.00 C ATOM 0 H THR A 53 84.398 -2.577 -13.041 1.00 0.00 H new ATOM 0 HA THR A 53 81.739 -1.823 -13.640 1.00 0.00 H new ATOM 0 HB THR A 53 81.208 -3.802 -12.164 1.00 0.00 H new ATOM 0 HG1 THR A 53 84.025 -4.067 -11.793 1.00 0.00 H new ATOM 0 HG21 THR A 53 82.468 -5.471 -13.491 1.00 0.00 H new ATOM 0 HG22 THR A 53 81.878 -4.148 -14.523 1.00 0.00 H new ATOM 0 HG23 THR A 53 83.587 -4.198 -14.032 1.00 0.00 H new ATOM 794 N ILE A 54 82.733 -1.181 -10.560 1.00 0.00 N ATOM 795 CA ILE A 54 82.352 -0.467 -9.342 1.00 0.00 C ATOM 796 C ILE A 54 82.128 1.022 -9.575 1.00 0.00 C ATOM 797 O ILE A 54 81.152 1.574 -9.079 1.00 0.00 O ATOM 798 CB ILE A 54 83.418 -0.678 -8.260 1.00 0.00 C ATOM 799 CG1 ILE A 54 83.424 -2.149 -7.835 1.00 0.00 C ATOM 800 CG2 ILE A 54 83.108 0.197 -7.040 1.00 0.00 C ATOM 801 CD1 ILE A 54 84.697 -2.445 -7.039 1.00 0.00 C ATOM 0 H ILE A 54 83.673 -1.577 -10.546 1.00 0.00 H new ATOM 0 HA ILE A 54 81.399 -0.881 -9.012 1.00 0.00 H new ATOM 0 HB ILE A 54 84.393 -0.403 -8.661 1.00 0.00 H new ATOM 0 HG12 ILE A 54 82.545 -2.367 -7.229 1.00 0.00 H new ATOM 0 HG13 ILE A 54 83.374 -2.793 -8.713 1.00 0.00 H new ATOM 0 HG21 ILE A 54 83.870 0.040 -6.277 1.00 0.00 H new ATOM 0 HG22 ILE A 54 83.102 1.246 -7.337 1.00 0.00 H new ATOM 0 HG23 ILE A 54 82.131 -0.072 -6.638 1.00 0.00 H new ATOM 0 HD11 ILE A 54 84.702 -3.492 -6.736 1.00 0.00 H new ATOM 0 HD12 ILE A 54 85.570 -2.243 -7.660 1.00 0.00 H new ATOM 0 HD13 ILE A 54 84.728 -1.811 -6.153 1.00 0.00 H new ATOM 813 N VAL A 55 83.030 1.681 -10.292 1.00 0.00 N ATOM 814 CA VAL A 55 82.877 3.116 -10.535 1.00 0.00 C ATOM 815 C VAL A 55 81.838 3.383 -11.625 1.00 0.00 C ATOM 816 O VAL A 55 81.103 4.366 -11.563 1.00 0.00 O ATOM 817 CB VAL A 55 84.220 3.744 -10.933 1.00 0.00 C ATOM 818 CG1 VAL A 55 85.298 3.335 -9.922 1.00 0.00 C ATOM 819 CG2 VAL A 55 84.616 3.287 -12.352 1.00 0.00 C ATOM 0 H VAL A 55 83.860 1.259 -10.709 1.00 0.00 H new ATOM 0 HA VAL A 55 82.532 3.573 -9.607 1.00 0.00 H new ATOM 0 HB VAL A 55 84.125 4.830 -10.931 1.00 0.00 H new ATOM 0 HG11 VAL A 55 86.251 3.781 -10.206 1.00 0.00 H new ATOM 0 HG12 VAL A 55 85.016 3.683 -8.928 1.00 0.00 H new ATOM 0 HG13 VAL A 55 85.395 2.249 -9.912 1.00 0.00 H new ATOM 0 HG21 VAL A 55 85.570 3.737 -12.626 1.00 0.00 H new ATOM 0 HG22 VAL A 55 84.708 2.201 -12.372 1.00 0.00 H new ATOM 0 HG23 VAL A 55 83.850 3.599 -13.062 1.00 0.00 H new ATOM 829 N LEU A 56 81.796 2.516 -12.631 1.00 0.00 N ATOM 830 CA LEU A 56 80.866 2.678 -13.744 1.00 0.00 C ATOM 831 C LEU A 56 79.402 2.499 -13.331 1.00 0.00 C ATOM 832 O LEU A 56 78.517 3.105 -13.932 1.00 0.00 O ATOM 833 CB LEU A 56 81.214 1.675 -14.851 1.00 0.00 C ATOM 834 CG LEU A 56 80.305 1.885 -16.096 1.00 0.00 C ATOM 835 CD1 LEU A 56 81.132 1.715 -17.376 1.00 0.00 C ATOM 836 CD2 LEU A 56 79.166 0.851 -16.111 1.00 0.00 C ATOM 0 H LEU A 56 82.395 1.693 -12.699 1.00 0.00 H new ATOM 0 HA LEU A 56 80.972 3.701 -14.104 1.00 0.00 H new ATOM 0 HB2 LEU A 56 82.260 1.790 -15.136 1.00 0.00 H new ATOM 0 HB3 LEU A 56 81.095 0.658 -14.476 1.00 0.00 H new ATOM 0 HG LEU A 56 79.885 2.890 -16.048 1.00 0.00 H new ATOM 0 HD11 LEU A 56 80.491 1.863 -18.245 1.00 0.00 H new ATOM 0 HD12 LEU A 56 81.937 2.450 -17.389 1.00 0.00 H new ATOM 0 HD13 LEU A 56 81.556 0.711 -17.404 1.00 0.00 H new ATOM 0 HD21 LEU A 56 78.540 1.012 -16.988 1.00 0.00 H new ATOM 0 HD22 LEU A 56 79.587 -0.154 -16.145 1.00 0.00 H new ATOM 0 HD23 LEU A 56 78.563 0.961 -15.210 1.00 0.00 H new ATOM 848 N ILE A 57 79.125 1.646 -12.341 1.00 0.00 N ATOM 849 CA ILE A 57 77.730 1.417 -11.949 1.00 0.00 C ATOM 850 C ILE A 57 77.084 2.658 -11.296 1.00 0.00 C ATOM 851 O ILE A 57 76.030 3.102 -11.754 1.00 0.00 O ATOM 852 CB ILE A 57 77.642 0.166 -11.034 1.00 0.00 C ATOM 853 CG1 ILE A 57 77.528 -1.116 -11.891 1.00 0.00 C ATOM 854 CG2 ILE A 57 76.438 0.245 -10.080 1.00 0.00 C ATOM 855 CD1 ILE A 57 76.197 -1.172 -12.674 1.00 0.00 C ATOM 0 H ILE A 57 79.820 1.119 -11.812 1.00 0.00 H new ATOM 0 HA ILE A 57 77.152 1.230 -12.854 1.00 0.00 H new ATOM 0 HB ILE A 57 78.554 0.134 -10.437 1.00 0.00 H new ATOM 0 HG12 ILE A 57 78.363 -1.160 -12.591 1.00 0.00 H new ATOM 0 HG13 ILE A 57 77.607 -1.991 -11.246 1.00 0.00 H new ATOM 0 HG21 ILE A 57 76.409 -0.648 -9.456 1.00 0.00 H new ATOM 0 HG22 ILE A 57 76.532 1.127 -9.447 1.00 0.00 H new ATOM 0 HG23 ILE A 57 75.518 0.312 -10.660 1.00 0.00 H new ATOM 0 HD11 ILE A 57 76.159 -2.089 -13.262 1.00 0.00 H new ATOM 0 HD12 ILE A 57 75.362 -1.156 -11.974 1.00 0.00 H new ATOM 0 HD13 ILE A 57 76.130 -0.311 -13.339 1.00 0.00 H new ATOM 867 N PRO A 58 77.658 3.232 -10.265 1.00 0.00 N ATOM 868 CA PRO A 58 77.067 4.435 -9.606 1.00 0.00 C ATOM 869 C PRO A 58 77.163 5.659 -10.514 1.00 0.00 C ATOM 870 O PRO A 58 76.349 6.578 -10.433 1.00 0.00 O ATOM 871 CB PRO A 58 77.905 4.605 -8.330 1.00 0.00 C ATOM 872 CG PRO A 58 79.218 3.963 -8.645 1.00 0.00 C ATOM 873 CD PRO A 58 78.912 2.822 -9.620 1.00 0.00 C ATOM 0 HA PRO A 58 76.005 4.322 -9.389 1.00 0.00 H new ATOM 0 HB2 PRO A 58 78.030 5.658 -8.077 1.00 0.00 H new ATOM 0 HB3 PRO A 58 77.426 4.127 -7.476 1.00 0.00 H new ATOM 0 HG2 PRO A 58 79.906 4.682 -9.090 1.00 0.00 H new ATOM 0 HG3 PRO A 58 79.694 3.585 -7.740 1.00 0.00 H new ATOM 0 HD2 PRO A 58 79.712 2.694 -10.349 1.00 0.00 H new ATOM 0 HD3 PRO A 58 78.801 1.871 -9.099 1.00 0.00 H new ATOM 881 N PHE A 59 78.175 5.654 -11.372 1.00 0.00 N ATOM 882 CA PHE A 59 78.404 6.742 -12.297 1.00 0.00 C ATOM 883 C PHE A 59 77.231 6.879 -13.267 1.00 0.00 C ATOM 884 O PHE A 59 76.646 7.954 -13.397 1.00 0.00 O ATOM 885 CB PHE A 59 79.700 6.465 -13.073 1.00 0.00 C ATOM 886 CG PHE A 59 80.934 6.862 -12.271 1.00 0.00 C ATOM 887 CD1 PHE A 59 80.918 6.902 -10.861 1.00 0.00 C ATOM 888 CD2 PHE A 59 82.115 7.175 -12.956 1.00 0.00 C ATOM 889 CE1 PHE A 59 82.077 7.254 -10.158 1.00 0.00 C ATOM 890 CE2 PHE A 59 83.271 7.527 -12.245 1.00 0.00 C ATOM 891 CZ PHE A 59 83.250 7.566 -10.848 1.00 0.00 C ATOM 0 H PHE A 59 78.854 4.896 -11.442 1.00 0.00 H new ATOM 0 HA PHE A 59 78.495 7.676 -11.743 1.00 0.00 H new ATOM 0 HB2 PHE A 59 79.754 5.406 -13.324 1.00 0.00 H new ATOM 0 HB3 PHE A 59 79.685 7.015 -14.014 1.00 0.00 H new ATOM 0 HD1 PHE A 59 80.012 6.661 -10.324 1.00 0.00 H new ATOM 0 HD2 PHE A 59 82.135 7.145 -14.035 1.00 0.00 H new ATOM 0 HE1 PHE A 59 82.063 7.284 -9.079 1.00 0.00 H new ATOM 0 HE2 PHE A 59 84.179 7.768 -12.778 1.00 0.00 H new ATOM 0 HZ PHE A 59 84.141 7.838 -10.302 1.00 0.00 H new ATOM 901 N LEU A 60 76.898 5.787 -13.949 1.00 0.00 N ATOM 902 CA LEU A 60 75.797 5.810 -14.907 1.00 0.00 C ATOM 903 C LEU A 60 74.454 5.784 -14.180 1.00 0.00 C ATOM 904 O LEU A 60 73.429 6.178 -14.739 1.00 0.00 O ATOM 905 CB LEU A 60 75.906 4.605 -15.857 1.00 0.00 C ATOM 906 CG LEU A 60 76.925 4.887 -16.981 1.00 0.00 C ATOM 907 CD1 LEU A 60 76.361 5.907 -17.991 1.00 0.00 C ATOM 908 CD2 LEU A 60 78.228 5.427 -16.375 1.00 0.00 C ATOM 0 H LEU A 60 77.368 4.886 -13.858 1.00 0.00 H new ATOM 0 HA LEU A 60 75.858 6.730 -15.488 1.00 0.00 H new ATOM 0 HB2 LEU A 60 76.210 3.721 -15.297 1.00 0.00 H new ATOM 0 HB3 LEU A 60 74.930 4.388 -16.290 1.00 0.00 H new ATOM 0 HG LEU A 60 77.124 3.954 -17.507 1.00 0.00 H new ATOM 0 HD11 LEU A 60 77.097 6.089 -18.774 1.00 0.00 H new ATOM 0 HD12 LEU A 60 75.448 5.511 -18.437 1.00 0.00 H new ATOM 0 HD13 LEU A 60 76.138 6.842 -17.478 1.00 0.00 H new ATOM 0 HD21 LEU A 60 78.945 5.625 -17.172 1.00 0.00 H new ATOM 0 HD22 LEU A 60 78.022 6.351 -15.834 1.00 0.00 H new ATOM 0 HD23 LEU A 60 78.643 4.689 -15.688 1.00 0.00 H new ATOM 920 N GLU A 61 74.466 5.321 -12.932 1.00 0.00 N ATOM 921 CA GLU A 61 73.241 5.250 -12.130 1.00 0.00 C ATOM 922 C GLU A 61 73.160 6.435 -11.175 1.00 0.00 C ATOM 923 O GLU A 61 73.985 6.575 -10.272 1.00 0.00 O ATOM 924 CB GLU A 61 73.217 3.948 -11.327 1.00 0.00 C ATOM 925 CG GLU A 61 73.208 2.755 -12.285 1.00 0.00 C ATOM 926 CD GLU A 61 71.897 2.719 -13.063 1.00 0.00 C ATOM 927 OE1 GLU A 61 70.855 2.742 -12.430 1.00 0.00 O ATOM 928 OE2 GLU A 61 71.955 2.670 -14.280 1.00 0.00 O ATOM 0 H GLU A 61 75.304 4.990 -12.454 1.00 0.00 H new ATOM 0 HA GLU A 61 72.385 5.278 -12.804 1.00 0.00 H new ATOM 0 HB2 GLU A 61 74.088 3.896 -10.673 1.00 0.00 H new ATOM 0 HB3 GLU A 61 72.335 3.920 -10.687 1.00 0.00 H new ATOM 0 HG2 GLU A 61 74.048 2.827 -12.976 1.00 0.00 H new ATOM 0 HG3 GLU A 61 73.334 1.828 -11.725 1.00 0.00 H new ATOM 935 N GLN A 62 72.161 7.286 -11.380 1.00 0.00 N ATOM 936 CA GLN A 62 71.982 8.457 -10.530 1.00 0.00 C ATOM 937 C GLN A 62 71.600 8.038 -9.114 1.00 0.00 C ATOM 938 O GLN A 62 72.371 8.224 -8.172 1.00 0.00 O ATOM 939 CB GLN A 62 70.891 9.361 -11.109 1.00 0.00 C ATOM 940 CG GLN A 62 71.254 9.743 -12.545 1.00 0.00 C ATOM 941 CD GLN A 62 72.541 10.561 -12.559 1.00 0.00 C ATOM 942 OE1 GLN A 62 73.557 10.149 -13.267 1.00 0.00 O flip ATOM 943 NE2 GLN A 62 72.624 11.601 -11.906 1.00 0.00 N flip ATOM 0 H GLN A 62 71.467 7.188 -12.122 1.00 0.00 H new ATOM 0 HA GLN A 62 72.924 9.003 -10.493 1.00 0.00 H new ATOM 0 HB2 GLN A 62 69.930 8.847 -11.090 1.00 0.00 H new ATOM 0 HB3 GLN A 62 70.785 10.258 -10.499 1.00 0.00 H new ATOM 0 HG2 GLN A 62 71.379 8.844 -13.149 1.00 0.00 H new ATOM 0 HG3 GLN A 62 70.443 10.318 -12.993 1.00 0.00 H new ATOM 0 HE21 GLN A 62 71.829 11.921 -11.353 1.00 0.00 H new ATOM 0 HE22 GLN A 62 73.488 12.143 -11.917 1.00 0.00 H new ATOM 952 N ASN A 63 70.407 7.470 -8.972 1.00 0.00 N ATOM 953 CA ASN A 63 69.932 7.027 -7.665 1.00 0.00 C ATOM 954 C ASN A 63 70.549 5.681 -7.300 1.00 0.00 C ATOM 955 CB ASN A 63 68.408 6.904 -7.678 1.00 0.00 C ATOM 956 CG ASN A 63 67.974 5.905 -8.745 1.00 0.00 C ATOM 957 OD1 ASN A 63 68.190 4.703 -8.594 1.00 0.00 O ATOM 958 ND2 ASN A 63 67.373 6.333 -9.822 1.00 0.00 N ATOM 0 H ASN A 63 69.755 7.306 -9.739 1.00 0.00 H new ATOM 0 HA ASN A 63 70.231 7.765 -6.921 1.00 0.00 H new ATOM 0 HB2 ASN A 63 68.053 6.581 -6.700 1.00 0.00 H new ATOM 0 HB3 ASN A 63 67.958 7.877 -7.875 1.00 0.00 H new ATOM 0 HD21 ASN A 63 67.081 5.671 -10.541 1.00 0.00 H new ATOM 0 HD22 ASN A 63 67.195 7.330 -9.945 1.00 0.00 H new TER 965 ASN A 63 ATOM 966 N CYS B 1 68.700 18.351 -13.700 1.00 0.00 N ATOM 967 CA CYS B 1 70.070 17.816 -13.941 1.00 0.00 C ATOM 968 C CYS B 1 71.098 18.901 -13.641 1.00 0.00 C ATOM 969 O CYS B 1 70.774 20.089 -13.623 1.00 0.00 O ATOM 970 CB CYS B 1 70.190 17.371 -15.401 1.00 0.00 C ATOM 971 SG CYS B 1 69.653 18.715 -16.487 1.00 0.00 S ATOM 0 H1 CYS B 1 68.043 17.562 -13.536 1.00 0.00 H new ATOM 0 H2 CYS B 1 68.711 18.971 -12.865 1.00 0.00 H new ATOM 0 H3 CYS B 1 68.388 18.894 -14.530 1.00 0.00 H new ATOM 0 HA CYS B 1 70.252 16.962 -13.289 1.00 0.00 H new ATOM 0 HB2 CYS B 1 71.221 17.098 -15.625 1.00 0.00 H new ATOM 0 HB3 CYS B 1 69.580 16.484 -15.573 1.00 0.00 H new ATOM 975 N SER B 2 72.338 18.485 -13.407 1.00 0.00 N ATOM 976 CA SER B 2 73.408 19.430 -13.110 1.00 0.00 C ATOM 977 C SER B 2 74.769 18.765 -13.288 1.00 0.00 C ATOM 978 O SER B 2 75.206 17.994 -12.436 1.00 0.00 O ATOM 979 CB SER B 2 73.270 19.940 -11.674 1.00 0.00 C ATOM 980 OG SER B 2 73.737 18.942 -10.775 1.00 0.00 O ATOM 0 H SER B 2 72.626 17.506 -13.417 1.00 0.00 H new ATOM 0 HA SER B 2 73.332 20.269 -13.801 1.00 0.00 H new ATOM 0 HB2 SER B 2 73.843 20.859 -11.545 1.00 0.00 H new ATOM 0 HB3 SER B 2 72.229 20.181 -11.460 1.00 0.00 H new ATOM 0 HG SER B 2 74.071 18.174 -11.284 1.00 0.00 H new ATOM 986 N THR B 3 75.427 19.071 -14.404 1.00 0.00 N ATOM 987 CA THR B 3 76.740 18.502 -14.704 1.00 0.00 C ATOM 988 C THR B 3 76.682 16.974 -14.714 1.00 0.00 C ATOM 989 O THR B 3 76.226 16.374 -15.685 1.00 0.00 O ATOM 990 CB THR B 3 77.778 18.988 -13.682 1.00 0.00 C ATOM 991 OG1 THR B 3 77.479 18.463 -12.398 1.00 0.00 O ATOM 992 CG2 THR B 3 77.762 20.515 -13.625 1.00 0.00 C ATOM 0 H THR B 3 75.073 19.710 -15.116 1.00 0.00 H new ATOM 0 HA THR B 3 77.039 18.839 -15.697 1.00 0.00 H new ATOM 0 HB THR B 3 78.766 18.643 -13.987 1.00 0.00 H new ATOM 0 HG1 THR B 3 76.549 18.155 -12.379 1.00 0.00 H new ATOM 0 HG21 THR B 3 78.499 20.860 -12.900 1.00 0.00 H new ATOM 0 HG22 THR B 3 78.004 20.918 -14.608 1.00 0.00 H new ATOM 0 HG23 THR B 3 76.771 20.858 -13.327 1.00 0.00 H new ATOM 1000 N VAL B 4 77.153 16.356 -13.633 1.00 0.00 N ATOM 1001 CA VAL B 4 77.159 14.896 -13.518 1.00 0.00 C ATOM 1002 C VAL B 4 78.111 14.265 -14.531 1.00 0.00 C ATOM 1003 O VAL B 4 79.227 13.878 -14.189 1.00 0.00 O ATOM 1004 CB VAL B 4 75.747 14.326 -13.721 1.00 0.00 C ATOM 1005 CG1 VAL B 4 75.723 12.863 -13.274 1.00 0.00 C ATOM 1006 CG2 VAL B 4 74.731 15.135 -12.901 1.00 0.00 C ATOM 0 H VAL B 4 77.536 16.842 -12.823 1.00 0.00 H new ATOM 0 HA VAL B 4 77.503 14.652 -12.513 1.00 0.00 H new ATOM 0 HB VAL B 4 75.481 14.390 -14.776 1.00 0.00 H new ATOM 0 HG11 VAL B 4 74.722 12.455 -13.417 1.00 0.00 H new ATOM 0 HG12 VAL B 4 76.436 12.290 -13.866 1.00 0.00 H new ATOM 0 HG13 VAL B 4 75.993 12.800 -12.220 1.00 0.00 H new ATOM 0 HG21 VAL B 4 73.733 14.724 -13.051 1.00 0.00 H new ATOM 0 HG22 VAL B 4 74.991 15.081 -11.844 1.00 0.00 H new ATOM 0 HG23 VAL B 4 74.747 16.175 -13.226 1.00 0.00 H new ATOM 1016 N SER B 5 77.656 14.148 -15.775 1.00 0.00 N ATOM 1017 CA SER B 5 78.466 13.543 -16.826 1.00 0.00 C ATOM 1018 C SER B 5 79.936 13.969 -16.728 1.00 0.00 C ATOM 1019 O SER B 5 80.809 13.130 -16.506 1.00 0.00 O ATOM 1020 CB SER B 5 77.888 13.909 -18.202 1.00 0.00 C ATOM 1021 OG SER B 5 78.945 14.181 -19.109 1.00 0.00 O ATOM 0 H SER B 5 76.735 14.463 -16.079 1.00 0.00 H new ATOM 0 HA SER B 5 78.435 12.461 -16.697 1.00 0.00 H new ATOM 0 HB2 SER B 5 77.275 13.090 -18.579 1.00 0.00 H new ATOM 0 HB3 SER B 5 77.238 14.780 -18.114 1.00 0.00 H new ATOM 0 HG SER B 5 78.578 14.564 -19.933 1.00 0.00 H new ATOM 1027 N PRO B 6 80.234 15.234 -16.897 1.00 0.00 N ATOM 1028 CA PRO B 6 81.642 15.735 -16.829 1.00 0.00 C ATOM 1029 C PRO B 6 82.271 15.494 -15.455 1.00 0.00 C ATOM 1030 O PRO B 6 83.423 15.857 -15.220 1.00 0.00 O ATOM 1031 CB PRO B 6 81.516 17.239 -17.140 1.00 0.00 C ATOM 1032 CG PRO B 6 80.094 17.581 -16.834 1.00 0.00 C ATOM 1033 CD PRO B 6 79.284 16.329 -17.164 1.00 0.00 C ATOM 0 HA PRO B 6 82.299 15.216 -17.527 1.00 0.00 H new ATOM 0 HB2 PRO B 6 82.203 17.827 -16.531 1.00 0.00 H new ATOM 0 HB3 PRO B 6 81.756 17.448 -18.183 1.00 0.00 H new ATOM 0 HG2 PRO B 6 79.975 17.859 -15.787 1.00 0.00 H new ATOM 0 HG3 PRO B 6 79.760 18.431 -17.429 1.00 0.00 H new ATOM 0 HD2 PRO B 6 78.393 16.250 -16.541 1.00 0.00 H new ATOM 0 HD3 PRO B 6 78.949 16.328 -18.201 1.00 0.00 H new ATOM 1041 N GLY B 7 81.508 14.880 -14.551 1.00 0.00 N ATOM 1042 CA GLY B 7 82.001 14.593 -13.200 1.00 0.00 C ATOM 1043 C GLY B 7 82.280 13.105 -13.019 1.00 0.00 C ATOM 1044 O GLY B 7 83.422 12.696 -12.805 1.00 0.00 O ATOM 0 H GLY B 7 80.551 14.572 -14.726 1.00 0.00 H new ATOM 0 HA2 GLY B 7 82.912 15.162 -13.014 1.00 0.00 H new ATOM 0 HA3 GLY B 7 81.266 14.920 -12.465 1.00 0.00 H new ATOM 1048 N VAL B 8 81.236 12.293 -13.104 1.00 0.00 N ATOM 1049 CA VAL B 8 81.402 10.855 -12.945 1.00 0.00 C ATOM 1050 C VAL B 8 82.276 10.303 -14.078 1.00 0.00 C ATOM 1051 O VAL B 8 83.272 9.612 -13.837 1.00 0.00 O ATOM 1052 CB VAL B 8 80.018 10.170 -12.927 1.00 0.00 C ATOM 1053 CG1 VAL B 8 79.472 10.125 -11.489 1.00 0.00 C ATOM 1054 CG2 VAL B 8 79.036 10.955 -13.814 1.00 0.00 C ATOM 0 H VAL B 8 80.279 12.599 -13.279 1.00 0.00 H new ATOM 0 HA VAL B 8 81.900 10.647 -11.998 1.00 0.00 H new ATOM 0 HB VAL B 8 80.124 9.154 -13.308 1.00 0.00 H new ATOM 0 HG11 VAL B 8 78.496 9.640 -11.486 1.00 0.00 H new ATOM 0 HG12 VAL B 8 80.159 9.562 -10.857 1.00 0.00 H new ATOM 0 HG13 VAL B 8 79.374 11.140 -11.105 1.00 0.00 H new ATOM 0 HG21 VAL B 8 78.061 10.467 -13.798 1.00 0.00 H new ATOM 0 HG22 VAL B 8 78.939 11.973 -13.437 1.00 0.00 H new ATOM 0 HG23 VAL B 8 79.411 10.982 -14.837 1.00 0.00 H new ATOM 1064 N LEU B 9 81.925 10.633 -15.313 1.00 0.00 N ATOM 1065 CA LEU B 9 82.710 10.175 -16.447 1.00 0.00 C ATOM 1066 C LEU B 9 84.140 10.692 -16.305 1.00 0.00 C ATOM 1067 O LEU B 9 85.110 9.966 -16.569 1.00 0.00 O ATOM 1068 CB LEU B 9 82.068 10.655 -17.753 1.00 0.00 C ATOM 1069 CG LEU B 9 80.563 10.336 -17.715 1.00 0.00 C ATOM 1070 CD1 LEU B 9 79.902 10.762 -19.031 1.00 0.00 C ATOM 1071 CD2 LEU B 9 80.353 8.828 -17.494 1.00 0.00 C ATOM 0 H LEU B 9 81.116 11.206 -15.552 1.00 0.00 H new ATOM 0 HA LEU B 9 82.736 9.086 -16.471 1.00 0.00 H new ATOM 0 HB2 LEU B 9 82.223 11.727 -17.878 1.00 0.00 H new ATOM 0 HB3 LEU B 9 82.536 10.164 -18.606 1.00 0.00 H new ATOM 0 HG LEU B 9 80.107 10.887 -16.892 1.00 0.00 H new ATOM 0 HD11 LEU B 9 78.837 10.532 -18.994 1.00 0.00 H new ATOM 0 HD12 LEU B 9 80.037 11.834 -19.176 1.00 0.00 H new ATOM 0 HD13 LEU B 9 80.361 10.223 -19.860 1.00 0.00 H new ATOM 0 HD21 LEU B 9 79.285 8.609 -17.468 1.00 0.00 H new ATOM 0 HD22 LEU B 9 80.818 8.273 -18.309 1.00 0.00 H new ATOM 0 HD23 LEU B 9 80.807 8.532 -16.548 1.00 0.00 H new ATOM 1083 N ALA B 10 84.272 11.936 -15.831 1.00 0.00 N ATOM 1084 CA ALA B 10 85.592 12.502 -15.604 1.00 0.00 C ATOM 1085 C ALA B 10 86.335 11.576 -14.638 1.00 0.00 C ATOM 1086 O ALA B 10 87.560 11.400 -14.705 1.00 0.00 O ATOM 1087 CB ALA B 10 85.472 13.912 -15.005 1.00 0.00 C ATOM 0 H ALA B 10 83.493 12.554 -15.603 1.00 0.00 H new ATOM 0 HA ALA B 10 86.136 12.585 -16.545 1.00 0.00 H new ATOM 0 HB1 ALA B 10 86.468 14.323 -14.840 1.00 0.00 H new ATOM 0 HB2 ALA B 10 84.923 14.554 -15.694 1.00 0.00 H new ATOM 0 HB3 ALA B 10 84.939 13.860 -14.055 1.00 0.00 H new ATOM 1093 N GLY B 11 85.555 10.972 -13.744 1.00 0.00 N ATOM 1094 CA GLY B 11 86.091 10.049 -12.755 1.00 0.00 C ATOM 1095 C GLY B 11 86.647 8.787 -13.407 1.00 0.00 C ATOM 1096 O GLY B 11 87.674 8.265 -12.971 1.00 0.00 O ATOM 0 H GLY B 11 84.546 11.108 -13.687 1.00 0.00 H new ATOM 0 HA2 GLY B 11 86.879 10.542 -12.186 1.00 0.00 H new ATOM 0 HA3 GLY B 11 85.308 9.778 -12.047 1.00 0.00 H new ATOM 1100 N ILE B 12 85.981 8.283 -14.450 1.00 0.00 N ATOM 1101 CA ILE B 12 86.475 7.080 -15.104 1.00 0.00 C ATOM 1102 C ILE B 12 87.820 7.373 -15.769 1.00 0.00 C ATOM 1103 O ILE B 12 88.748 6.572 -15.666 1.00 0.00 O ATOM 1104 CB ILE B 12 85.424 6.541 -16.108 1.00 0.00 C ATOM 1105 CG1 ILE B 12 84.438 5.629 -15.351 1.00 0.00 C ATOM 1106 CG2 ILE B 12 86.098 5.732 -17.229 1.00 0.00 C ATOM 1107 CD1 ILE B 12 83.179 5.388 -16.185 1.00 0.00 C ATOM 0 H ILE B 12 85.127 8.677 -14.845 1.00 0.00 H new ATOM 0 HA ILE B 12 86.636 6.296 -14.364 1.00 0.00 H new ATOM 0 HB ILE B 12 84.901 7.385 -16.557 1.00 0.00 H new ATOM 0 HG12 ILE B 12 84.917 4.677 -15.122 1.00 0.00 H new ATOM 0 HG13 ILE B 12 84.168 6.087 -14.399 1.00 0.00 H new ATOM 0 HG21 ILE B 12 85.339 5.365 -17.920 1.00 0.00 H new ATOM 0 HG22 ILE B 12 86.800 6.370 -17.766 1.00 0.00 H new ATOM 0 HG23 ILE B 12 86.634 4.887 -16.796 1.00 0.00 H new ATOM 0 HD11 ILE B 12 82.496 4.742 -15.634 1.00 0.00 H new ATOM 0 HD12 ILE B 12 82.691 6.341 -16.391 1.00 0.00 H new ATOM 0 HD13 ILE B 12 83.452 4.909 -17.125 1.00 0.00 H new ATOM 1119 N VAL B 13 87.940 8.525 -16.422 1.00 0.00 N ATOM 1120 CA VAL B 13 89.219 8.869 -17.052 1.00 0.00 C ATOM 1121 C VAL B 13 90.316 8.816 -15.990 1.00 0.00 C ATOM 1122 O VAL B 13 91.385 8.254 -16.220 1.00 0.00 O ATOM 1123 CB VAL B 13 89.166 10.261 -17.759 1.00 0.00 C ATOM 1124 CG1 VAL B 13 87.721 10.703 -17.891 1.00 0.00 C ATOM 1125 CG2 VAL B 13 89.928 11.349 -16.978 1.00 0.00 C ATOM 0 H VAL B 13 87.199 9.217 -16.530 1.00 0.00 H new ATOM 0 HA VAL B 13 89.438 8.144 -17.836 1.00 0.00 H new ATOM 0 HB VAL B 13 89.640 10.142 -18.733 1.00 0.00 H new ATOM 0 HG11 VAL B 13 87.681 11.674 -18.384 1.00 0.00 H new ATOM 0 HG12 VAL B 13 87.170 9.973 -18.483 1.00 0.00 H new ATOM 0 HG13 VAL B 13 87.272 10.780 -16.901 1.00 0.00 H new ATOM 0 HG21 VAL B 13 89.860 12.296 -17.513 1.00 0.00 H new ATOM 0 HG22 VAL B 13 89.489 11.460 -15.986 1.00 0.00 H new ATOM 0 HG23 VAL B 13 90.975 11.062 -16.881 1.00 0.00 H new ATOM 1135 N VAL B 14 90.040 9.397 -14.820 1.00 0.00 N ATOM 1136 CA VAL B 14 91.026 9.384 -13.744 1.00 0.00 C ATOM 1137 C VAL B 14 91.470 7.949 -13.471 1.00 0.00 C ATOM 1138 O VAL B 14 92.667 7.658 -13.431 1.00 0.00 O ATOM 1139 CB VAL B 14 90.438 10.001 -12.471 1.00 0.00 C ATOM 1140 CG1 VAL B 14 91.435 9.850 -11.319 1.00 0.00 C ATOM 1141 CG2 VAL B 14 90.161 11.487 -12.706 1.00 0.00 C ATOM 0 H VAL B 14 89.164 9.870 -14.599 1.00 0.00 H new ATOM 0 HA VAL B 14 91.888 9.977 -14.050 1.00 0.00 H new ATOM 0 HB VAL B 14 89.509 9.490 -12.219 1.00 0.00 H new ATOM 0 HG11 VAL B 14 91.015 10.290 -10.414 1.00 0.00 H new ATOM 0 HG12 VAL B 14 91.637 8.792 -11.149 1.00 0.00 H new ATOM 0 HG13 VAL B 14 92.364 10.360 -11.573 1.00 0.00 H new ATOM 0 HG21 VAL B 14 89.743 11.927 -11.801 1.00 0.00 H new ATOM 0 HG22 VAL B 14 91.092 11.995 -12.960 1.00 0.00 H new ATOM 0 HG23 VAL B 14 89.451 11.600 -13.526 1.00 0.00 H new ATOM 1151 N GLY B 15 90.493 7.057 -13.300 1.00 0.00 N ATOM 1152 CA GLY B 15 90.783 5.646 -13.047 1.00 0.00 C ATOM 1153 C GLY B 15 91.632 5.059 -14.173 1.00 0.00 C ATOM 1154 O GLY B 15 92.443 4.159 -13.951 1.00 0.00 O ATOM 0 H GLY B 15 89.499 7.285 -13.332 1.00 0.00 H new ATOM 0 HA2 GLY B 15 91.308 5.542 -12.097 1.00 0.00 H new ATOM 0 HA3 GLY B 15 89.851 5.088 -12.959 1.00 0.00 H new ATOM 1158 N ASP B 16 91.442 5.577 -15.381 1.00 0.00 N ATOM 1159 CA ASP B 16 92.198 5.100 -16.534 1.00 0.00 C ATOM 1160 C ASP B 16 93.658 5.541 -16.442 1.00 0.00 C ATOM 1161 O ASP B 16 94.567 4.778 -16.766 1.00 0.00 O ATOM 1162 CB ASP B 16 91.580 5.641 -17.825 1.00 0.00 C ATOM 1163 CG ASP B 16 92.140 4.888 -19.027 1.00 0.00 C ATOM 1164 OD1 ASP B 16 92.463 3.721 -18.873 1.00 0.00 O ATOM 1165 OD2 ASP B 16 92.238 5.489 -20.084 1.00 0.00 O ATOM 0 H ASP B 16 90.776 6.322 -15.587 1.00 0.00 H new ATOM 0 HA ASP B 16 92.160 4.011 -16.542 1.00 0.00 H new ATOM 0 HB2 ASP B 16 90.496 5.534 -17.791 1.00 0.00 H new ATOM 0 HB3 ASP B 16 91.793 6.706 -17.921 1.00 0.00 H new ATOM 1170 N LEU B 17 93.873 6.777 -16.000 1.00 0.00 N ATOM 1171 CA LEU B 17 95.227 7.308 -15.871 1.00 0.00 C ATOM 1172 C LEU B 17 96.031 6.480 -14.873 1.00 0.00 C ATOM 1173 O LEU B 17 97.139 6.029 -15.172 1.00 0.00 O ATOM 1174 CB LEU B 17 95.165 8.771 -15.409 1.00 0.00 C ATOM 1175 CG LEU B 17 96.571 9.300 -15.089 1.00 0.00 C ATOM 1176 CD1 LEU B 17 97.513 9.049 -16.274 1.00 0.00 C ATOM 1177 CD2 LEU B 17 96.486 10.805 -14.815 1.00 0.00 C ATOM 0 H LEU B 17 93.134 7.425 -15.727 1.00 0.00 H new ATOM 0 HA LEU B 17 95.721 7.256 -16.841 1.00 0.00 H new ATOM 0 HB2 LEU B 17 94.709 9.384 -16.186 1.00 0.00 H new ATOM 0 HB3 LEU B 17 94.531 8.852 -14.526 1.00 0.00 H new ATOM 0 HG LEU B 17 96.961 8.782 -14.213 1.00 0.00 H new ATOM 0 HD11 LEU B 17 98.507 9.428 -16.036 1.00 0.00 H new ATOM 0 HD12 LEU B 17 97.571 7.979 -16.472 1.00 0.00 H new ATOM 0 HD13 LEU B 17 97.131 9.561 -17.157 1.00 0.00 H new ATOM 0 HD21 LEU B 17 97.480 11.190 -14.587 1.00 0.00 H new ATOM 0 HD22 LEU B 17 96.093 11.314 -15.696 1.00 0.00 H new ATOM 0 HD23 LEU B 17 95.824 10.984 -13.968 1.00 0.00 H new ATOM 1189 N VAL B 18 95.463 6.281 -13.688 1.00 0.00 N ATOM 1190 CA VAL B 18 96.134 5.501 -12.651 1.00 0.00 C ATOM 1191 C VAL B 18 96.420 4.085 -13.152 1.00 0.00 C ATOM 1192 O VAL B 18 97.518 3.565 -12.954 1.00 0.00 O ATOM 1193 CB VAL B 18 95.269 5.461 -11.380 1.00 0.00 C ATOM 1194 CG1 VAL B 18 93.848 5.065 -11.735 1.00 0.00 C ATOM 1195 CG2 VAL B 18 95.812 4.439 -10.385 1.00 0.00 C ATOM 0 H VAL B 18 94.548 6.645 -13.422 1.00 0.00 H new ATOM 0 HA VAL B 18 97.085 5.977 -12.411 1.00 0.00 H new ATOM 0 HB VAL B 18 95.289 6.454 -10.932 1.00 0.00 H new ATOM 0 HG11 VAL B 18 93.241 5.039 -10.830 1.00 0.00 H new ATOM 0 HG12 VAL B 18 93.431 5.793 -12.431 1.00 0.00 H new ATOM 0 HG13 VAL B 18 93.850 4.079 -12.199 1.00 0.00 H new ATOM 0 HG21 VAL B 18 95.184 4.429 -9.494 1.00 0.00 H new ATOM 0 HG22 VAL B 18 95.810 3.449 -10.842 1.00 0.00 H new ATOM 0 HG23 VAL B 18 96.831 4.708 -10.107 1.00 0.00 H new ATOM 1205 N LEU B 19 95.438 3.465 -13.807 1.00 0.00 N ATOM 1206 CA LEU B 19 95.639 2.114 -14.325 1.00 0.00 C ATOM 1207 C LEU B 19 96.820 2.098 -15.292 1.00 0.00 C ATOM 1208 O LEU B 19 97.733 1.291 -15.150 1.00 0.00 O ATOM 1209 CB LEU B 19 94.377 1.614 -15.052 1.00 0.00 C ATOM 1210 CG LEU B 19 93.335 1.086 -14.051 1.00 0.00 C ATOM 1211 CD1 LEU B 19 92.028 0.822 -14.810 1.00 0.00 C ATOM 1212 CD2 LEU B 19 93.828 -0.224 -13.383 1.00 0.00 C ATOM 0 H LEU B 19 94.517 3.865 -13.988 1.00 0.00 H new ATOM 0 HA LEU B 19 95.845 1.453 -13.483 1.00 0.00 H new ATOM 0 HB2 LEU B 19 93.945 2.426 -15.637 1.00 0.00 H new ATOM 0 HB3 LEU B 19 94.646 0.824 -15.753 1.00 0.00 H new ATOM 0 HG LEU B 19 93.178 1.826 -13.266 1.00 0.00 H new ATOM 0 HD11 LEU B 19 91.275 0.446 -14.118 1.00 0.00 H new ATOM 0 HD12 LEU B 19 91.676 1.749 -15.261 1.00 0.00 H new ATOM 0 HD13 LEU B 19 92.204 0.082 -15.591 1.00 0.00 H new ATOM 0 HD21 LEU B 19 93.075 -0.579 -12.679 1.00 0.00 H new ATOM 0 HD22 LEU B 19 93.995 -0.982 -14.148 1.00 0.00 H new ATOM 0 HD23 LEU B 19 94.760 -0.033 -12.851 1.00 0.00 H new ATOM 1224 N THR B 20 96.796 2.997 -16.270 1.00 0.00 N ATOM 1225 CA THR B 20 97.875 3.067 -17.251 1.00 0.00 C ATOM 1226 C THR B 20 99.230 3.056 -16.554 1.00 0.00 C ATOM 1227 O THR B 20 100.110 2.261 -16.894 1.00 0.00 O ATOM 1228 CB THR B 20 97.740 4.342 -18.087 1.00 0.00 C ATOM 1229 OG1 THR B 20 96.423 4.421 -18.616 1.00 0.00 O ATOM 1230 CG2 THR B 20 98.751 4.313 -19.233 1.00 0.00 C ATOM 0 H THR B 20 96.051 3.680 -16.405 1.00 0.00 H new ATOM 0 HA THR B 20 97.806 2.197 -17.904 1.00 0.00 H new ATOM 0 HB THR B 20 97.933 5.211 -17.459 1.00 0.00 H new ATOM 0 HG1 THR B 20 95.828 4.829 -17.953 1.00 0.00 H new ATOM 0 HG21 THR B 20 98.654 5.222 -19.827 1.00 0.00 H new ATOM 0 HG22 THR B 20 99.760 4.252 -18.826 1.00 0.00 H new ATOM 0 HG23 THR B 20 98.561 3.445 -19.864 1.00 0.00 H new ATOM 1238 N VAL B 21 99.390 3.934 -15.571 1.00 0.00 N ATOM 1239 CA VAL B 21 100.641 4.007 -14.830 1.00 0.00 C ATOM 1240 C VAL B 21 100.917 2.678 -14.133 1.00 0.00 C ATOM 1241 O VAL B 21 102.070 2.291 -13.948 1.00 0.00 O ATOM 1242 CB VAL B 21 100.569 5.128 -13.791 1.00 0.00 C ATOM 1243 CG1 VAL B 21 101.846 5.128 -12.948 1.00 0.00 C ATOM 1244 CG2 VAL B 21 100.430 6.475 -14.504 1.00 0.00 C ATOM 0 H VAL B 21 98.677 4.599 -15.271 1.00 0.00 H new ATOM 0 HA VAL B 21 101.450 4.217 -15.529 1.00 0.00 H new ATOM 0 HB VAL B 21 99.707 4.967 -13.144 1.00 0.00 H new ATOM 0 HG11 VAL B 21 101.794 5.927 -12.208 1.00 0.00 H new ATOM 0 HG12 VAL B 21 101.947 4.169 -12.440 1.00 0.00 H new ATOM 0 HG13 VAL B 21 102.709 5.288 -13.595 1.00 0.00 H new ATOM 0 HG21 VAL B 21 100.379 7.274 -13.765 1.00 0.00 H new ATOM 0 HG22 VAL B 21 101.292 6.635 -15.152 1.00 0.00 H new ATOM 0 HG23 VAL B 21 99.520 6.477 -15.104 1.00 0.00 H new ATOM 1254 N LEU B 22 99.848 1.986 -13.748 1.00 0.00 N ATOM 1255 CA LEU B 22 99.986 0.702 -13.069 1.00 0.00 C ATOM 1256 C LEU B 22 100.554 -0.357 -14.015 1.00 0.00 C ATOM 1257 O LEU B 22 101.448 -1.116 -13.639 1.00 0.00 O ATOM 1258 CB LEU B 22 98.624 0.247 -12.531 1.00 0.00 C ATOM 1259 CG LEU B 22 98.809 -0.822 -11.441 1.00 0.00 C ATOM 1260 CD1 LEU B 22 99.411 -0.203 -10.159 1.00 0.00 C ATOM 1261 CD2 LEU B 22 97.441 -1.441 -11.124 1.00 0.00 C ATOM 0 H LEU B 22 98.885 2.290 -13.893 1.00 0.00 H new ATOM 0 HA LEU B 22 100.680 0.826 -12.237 1.00 0.00 H new ATOM 0 HB2 LEU B 22 98.083 1.101 -12.124 1.00 0.00 H new ATOM 0 HB3 LEU B 22 98.020 -0.155 -13.345 1.00 0.00 H new ATOM 0 HG LEU B 22 99.496 -1.587 -11.802 1.00 0.00 H new ATOM 0 HD11 LEU B 22 99.532 -0.979 -9.403 1.00 0.00 H new ATOM 0 HD12 LEU B 22 100.382 0.236 -10.388 1.00 0.00 H new ATOM 0 HD13 LEU B 22 98.743 0.571 -9.781 1.00 0.00 H new ATOM 0 HD21 LEU B 22 97.556 -2.202 -10.352 1.00 0.00 H new ATOM 0 HD22 LEU B 22 96.763 -0.664 -10.770 1.00 0.00 H new ATOM 0 HD23 LEU B 22 97.031 -1.897 -12.025 1.00 0.00 H new ATOM 1273 N ILE B 23 100.035 -0.408 -15.241 1.00 0.00 N ATOM 1274 CA ILE B 23 100.515 -1.387 -16.213 1.00 0.00 C ATOM 1275 C ILE B 23 101.994 -1.156 -16.500 1.00 0.00 C ATOM 1276 O ILE B 23 102.803 -2.080 -16.418 1.00 0.00 O ATOM 1277 CB ILE B 23 99.724 -1.281 -17.524 1.00 0.00 C ATOM 1278 CG1 ILE B 23 98.215 -1.307 -17.240 1.00 0.00 C ATOM 1279 CG2 ILE B 23 100.092 -2.450 -18.445 1.00 0.00 C ATOM 1280 CD1 ILE B 23 97.854 -2.522 -16.381 1.00 0.00 C ATOM 0 H ILE B 23 99.295 0.206 -15.580 1.00 0.00 H new ATOM 0 HA ILE B 23 100.374 -2.382 -15.792 1.00 0.00 H new ATOM 0 HB ILE B 23 99.976 -0.339 -18.011 1.00 0.00 H new ATOM 0 HG12 ILE B 23 97.919 -0.391 -16.728 1.00 0.00 H new ATOM 0 HG13 ILE B 23 97.662 -1.340 -18.179 1.00 0.00 H new ATOM 0 HG21 ILE B 23 99.529 -2.372 -19.375 1.00 0.00 H new ATOM 0 HG22 ILE B 23 101.159 -2.419 -18.664 1.00 0.00 H new ATOM 0 HG23 ILE B 23 99.850 -3.392 -17.952 1.00 0.00 H new ATOM 0 HD11 ILE B 23 96.781 -2.526 -16.189 1.00 0.00 H new ATOM 0 HD12 ILE B 23 98.132 -3.435 -16.907 1.00 0.00 H new ATOM 0 HD13 ILE B 23 98.392 -2.471 -15.434 1.00 0.00 H new ATOM 1292 N ALA B 24 102.343 0.085 -16.826 1.00 0.00 N ATOM 1293 CA ALA B 24 103.733 0.419 -17.110 1.00 0.00 C ATOM 1294 C ALA B 24 104.614 0.026 -15.928 1.00 0.00 C ATOM 1295 O ALA B 24 105.702 -0.527 -16.100 1.00 0.00 O ATOM 1296 CB ALA B 24 103.869 1.919 -17.378 1.00 0.00 C ATOM 0 H ALA B 24 101.691 0.866 -16.899 1.00 0.00 H new ATOM 0 HA ALA B 24 104.053 -0.131 -17.995 1.00 0.00 H new ATOM 0 HB1 ALA B 24 104.911 2.158 -17.589 1.00 0.00 H new ATOM 0 HB2 ALA B 24 103.253 2.193 -18.235 1.00 0.00 H new ATOM 0 HB3 ALA B 24 103.539 2.477 -16.501 1.00 0.00 H new ATOM 1302 N LEU B 25 104.124 0.308 -14.724 1.00 0.00 N ATOM 1303 CA LEU B 25 104.862 -0.026 -13.514 1.00 0.00 C ATOM 1304 C LEU B 25 105.093 -1.530 -13.452 1.00 0.00 C ATOM 1305 O LEU B 25 106.150 -1.991 -13.021 1.00 0.00 O ATOM 1306 CB LEU B 25 104.074 0.439 -12.282 1.00 0.00 C ATOM 1307 CG LEU B 25 104.787 0.010 -10.989 1.00 0.00 C ATOM 1308 CD1 LEU B 25 106.227 0.548 -10.970 1.00 0.00 C ATOM 1309 CD2 LEU B 25 104.016 0.571 -9.789 1.00 0.00 C ATOM 0 H LEU B 25 103.226 0.764 -14.563 1.00 0.00 H new ATOM 0 HA LEU B 25 105.827 0.480 -13.528 1.00 0.00 H new ATOM 0 HB2 LEU B 25 103.966 1.523 -12.301 1.00 0.00 H new ATOM 0 HB3 LEU B 25 103.069 0.018 -12.306 1.00 0.00 H new ATOM 0 HG LEU B 25 104.820 -1.078 -10.939 1.00 0.00 H new ATOM 0 HD11 LEU B 25 106.720 0.237 -10.049 1.00 0.00 H new ATOM 0 HD12 LEU B 25 106.774 0.153 -11.826 1.00 0.00 H new ATOM 0 HD13 LEU B 25 106.209 1.637 -11.022 1.00 0.00 H new ATOM 0 HD21 LEU B 25 104.513 0.273 -8.866 1.00 0.00 H new ATOM 0 HD22 LEU B 25 103.988 1.659 -9.851 1.00 0.00 H new ATOM 0 HD23 LEU B 25 102.998 0.181 -9.796 1.00 0.00 H new ATOM 1321 N ALA B 26 104.096 -2.291 -13.894 1.00 0.00 N ATOM 1322 CA ALA B 26 104.200 -3.745 -13.895 1.00 0.00 C ATOM 1323 C ALA B 26 105.304 -4.193 -14.845 1.00 0.00 C ATOM 1324 O ALA B 26 106.058 -5.118 -14.544 1.00 0.00 O ATOM 1325 CB ALA B 26 102.870 -4.365 -14.327 1.00 0.00 C ATOM 0 H ALA B 26 103.213 -1.928 -14.253 1.00 0.00 H new ATOM 0 HA ALA B 26 104.441 -4.078 -12.885 1.00 0.00 H new ATOM 0 HB1 ALA B 26 102.957 -5.451 -14.325 1.00 0.00 H new ATOM 0 HB2 ALA B 26 102.085 -4.063 -13.634 1.00 0.00 H new ATOM 0 HB3 ALA B 26 102.618 -4.023 -15.331 1.00 0.00 H new ATOM 1331 N VAL B 27 105.397 -3.526 -15.991 1.00 0.00 N ATOM 1332 CA VAL B 27 106.418 -3.862 -16.974 1.00 0.00 C ATOM 1333 C VAL B 27 107.805 -3.692 -16.366 1.00 0.00 C ATOM 1334 O VAL B 27 108.655 -4.576 -16.476 1.00 0.00 O ATOM 1335 CB VAL B 27 106.278 -2.963 -18.205 1.00 0.00 C ATOM 1336 CG1 VAL B 27 107.427 -3.240 -19.177 1.00 0.00 C ATOM 1337 CG2 VAL B 27 104.946 -3.254 -18.899 1.00 0.00 C ATOM 0 H VAL B 27 104.783 -2.757 -16.259 1.00 0.00 H new ATOM 0 HA VAL B 27 106.286 -4.901 -17.275 1.00 0.00 H new ATOM 0 HB VAL B 27 106.309 -1.919 -17.895 1.00 0.00 H new ATOM 0 HG11 VAL B 27 107.325 -2.599 -20.053 1.00 0.00 H new ATOM 0 HG12 VAL B 27 108.378 -3.034 -18.685 1.00 0.00 H new ATOM 0 HG13 VAL B 27 107.398 -4.285 -19.487 1.00 0.00 H new ATOM 0 HG21 VAL B 27 104.845 -2.614 -19.776 1.00 0.00 H new ATOM 0 HG22 VAL B 27 104.917 -4.299 -19.207 1.00 0.00 H new ATOM 0 HG23 VAL B 27 104.126 -3.056 -18.209 1.00 0.00 H new ATOM 1347 N TYR B 28 108.025 -2.553 -15.716 1.00 0.00 N ATOM 1348 CA TYR B 28 109.313 -2.287 -15.086 1.00 0.00 C ATOM 1349 C TYR B 28 109.572 -3.294 -13.970 1.00 0.00 C ATOM 1350 O TYR B 28 110.697 -3.758 -13.784 1.00 0.00 O ATOM 1351 CB TYR B 28 109.337 -0.868 -14.514 1.00 0.00 C ATOM 1352 CG TYR B 28 110.685 -0.603 -13.886 1.00 0.00 C ATOM 1353 CD1 TYR B 28 110.916 -0.951 -12.550 1.00 0.00 C ATOM 1354 CD2 TYR B 28 111.705 -0.011 -14.641 1.00 0.00 C ATOM 1355 CE1 TYR B 28 112.166 -0.707 -11.969 1.00 0.00 C ATOM 1356 CE2 TYR B 28 112.954 0.233 -14.060 1.00 0.00 C ATOM 1357 CZ TYR B 28 113.185 -0.114 -12.724 1.00 0.00 C ATOM 1358 OH TYR B 28 114.418 0.127 -12.151 1.00 0.00 O ATOM 0 H TYR B 28 107.337 -1.807 -15.612 1.00 0.00 H new ATOM 0 HA TYR B 28 110.094 -2.382 -15.840 1.00 0.00 H new ATOM 0 HB2 TYR B 28 109.142 -0.142 -15.304 1.00 0.00 H new ATOM 0 HB3 TYR B 28 108.548 -0.750 -13.771 1.00 0.00 H new ATOM 0 HD1 TYR B 28 110.130 -1.408 -11.967 1.00 0.00 H new ATOM 0 HD2 TYR B 28 111.527 0.257 -15.672 1.00 0.00 H new ATOM 0 HE1 TYR B 28 112.344 -0.976 -10.938 1.00 0.00 H new ATOM 0 HE2 TYR B 28 113.740 0.689 -14.643 1.00 0.00 H new ATOM 0 HH TYR B 28 115.011 0.542 -12.812 1.00 0.00 H new ATOM 1368 N PHE B 29 108.518 -3.626 -13.230 1.00 0.00 N ATOM 1369 CA PHE B 29 108.630 -4.580 -12.133 1.00 0.00 C ATOM 1370 C PHE B 29 109.154 -5.920 -12.644 1.00 0.00 C ATOM 1371 O PHE B 29 110.064 -6.505 -12.057 1.00 0.00 O ATOM 1372 CB PHE B 29 107.257 -4.770 -11.479 1.00 0.00 C ATOM 1373 CG PHE B 29 107.320 -5.886 -10.457 1.00 0.00 C ATOM 1374 CD1 PHE B 29 108.166 -5.770 -9.348 1.00 0.00 C ATOM 1375 CD2 PHE B 29 106.532 -7.035 -10.617 1.00 0.00 C ATOM 1376 CE1 PHE B 29 108.225 -6.800 -8.400 1.00 0.00 C ATOM 1377 CE2 PHE B 29 106.592 -8.064 -9.670 1.00 0.00 C ATOM 1378 CZ PHE B 29 107.438 -7.947 -8.562 1.00 0.00 C ATOM 0 H PHE B 29 107.580 -3.250 -13.370 1.00 0.00 H new ATOM 0 HA PHE B 29 109.333 -4.192 -11.396 1.00 0.00 H new ATOM 0 HB2 PHE B 29 106.942 -3.843 -10.999 1.00 0.00 H new ATOM 0 HB3 PHE B 29 106.512 -5.004 -12.240 1.00 0.00 H new ATOM 0 HD1 PHE B 29 108.774 -4.886 -9.223 1.00 0.00 H new ATOM 0 HD2 PHE B 29 105.878 -7.126 -11.472 1.00 0.00 H new ATOM 0 HE1 PHE B 29 108.878 -6.709 -7.544 1.00 0.00 H new ATOM 0 HE2 PHE B 29 105.985 -8.949 -9.795 1.00 0.00 H new ATOM 0 HZ PHE B 29 107.484 -8.741 -7.832 1.00 0.00 H new ATOM 1388 N LEU B 30 108.576 -6.398 -13.741 1.00 0.00 N ATOM 1389 CA LEU B 30 108.995 -7.669 -14.320 1.00 0.00 C ATOM 1390 C LEU B 30 110.451 -7.590 -14.768 1.00 0.00 C ATOM 1391 O LEU B 30 111.218 -8.536 -14.591 1.00 0.00 O ATOM 1392 CB LEU B 30 108.094 -8.018 -15.514 1.00 0.00 C ATOM 1393 CG LEU B 30 108.604 -9.280 -16.226 1.00 0.00 C ATOM 1394 CD1 LEU B 30 108.753 -10.433 -15.223 1.00 0.00 C ATOM 1395 CD2 LEU B 30 107.599 -9.677 -17.312 1.00 0.00 C ATOM 0 H LEU B 30 107.822 -5.929 -14.243 1.00 0.00 H new ATOM 0 HA LEU B 30 108.905 -8.449 -13.564 1.00 0.00 H new ATOM 0 HB2 LEU B 30 107.071 -8.176 -15.171 1.00 0.00 H new ATOM 0 HB3 LEU B 30 108.070 -7.183 -16.215 1.00 0.00 H new ATOM 0 HG LEU B 30 109.577 -9.074 -16.672 1.00 0.00 H new ATOM 0 HD11 LEU B 30 109.115 -11.321 -15.741 1.00 0.00 H new ATOM 0 HD12 LEU B 30 109.464 -10.150 -14.447 1.00 0.00 H new ATOM 0 HD13 LEU B 30 107.786 -10.647 -14.768 1.00 0.00 H new ATOM 0 HD21 LEU B 30 107.951 -10.572 -17.824 1.00 0.00 H new ATOM 0 HD22 LEU B 30 106.630 -9.878 -16.855 1.00 0.00 H new ATOM 0 HD23 LEU B 30 107.500 -8.863 -18.031 1.00 0.00 H new ATOM 1407 N GLY B 31 110.825 -6.454 -15.350 1.00 0.00 N ATOM 1408 CA GLY B 31 112.192 -6.258 -15.822 1.00 0.00 C ATOM 1409 C GLY B 31 112.372 -6.834 -17.221 1.00 0.00 C ATOM 1410 O GLY B 31 111.451 -7.426 -17.783 1.00 0.00 O ATOM 0 H GLY B 31 110.205 -5.659 -15.505 1.00 0.00 H new ATOM 0 HA2 GLY B 31 112.430 -5.194 -15.829 1.00 0.00 H new ATOM 0 HA3 GLY B 31 112.890 -6.736 -15.135 1.00 0.00 H new ATOM 1414 N ARG B 32 113.565 -6.657 -17.779 1.00 0.00 N ATOM 1415 CA ARG B 32 113.856 -7.163 -19.115 1.00 0.00 C ATOM 1416 C ARG B 32 113.958 -8.685 -19.102 1.00 0.00 C ATOM 1417 O ARG B 32 115.037 -9.242 -18.898 1.00 0.00 O ATOM 1418 CB ARG B 32 115.169 -6.566 -19.625 1.00 0.00 C ATOM 1419 CG ARG B 32 115.033 -5.044 -19.720 1.00 0.00 C ATOM 1420 CD ARG B 32 116.350 -4.445 -20.216 1.00 0.00 C ATOM 1421 NE ARG B 32 116.259 -2.989 -20.254 1.00 0.00 N ATOM 1422 CZ ARG B 32 116.461 -2.256 -19.163 1.00 0.00 C ATOM 1423 NH1 ARG B 32 116.750 -2.837 -18.031 1.00 0.00 N ATOM 1424 NH2 ARG B 32 116.372 -0.956 -19.225 1.00 0.00 N ATOM 0 H ARG B 32 114.341 -6.170 -17.330 1.00 0.00 H new ATOM 0 HA ARG B 32 113.042 -6.871 -19.779 1.00 0.00 H new ATOM 0 HB2 ARG B 32 115.986 -6.828 -18.952 1.00 0.00 H new ATOM 0 HB3 ARG B 32 115.415 -6.982 -20.602 1.00 0.00 H new ATOM 0 HG2 ARG B 32 114.223 -4.782 -20.401 1.00 0.00 H new ATOM 0 HG3 ARG B 32 114.777 -4.629 -18.745 1.00 0.00 H new ATOM 0 HD2 ARG B 32 117.166 -4.749 -19.560 1.00 0.00 H new ATOM 0 HD3 ARG B 32 116.581 -4.828 -21.210 1.00 0.00 H new ATOM 0 HE ARG B 32 116.036 -2.525 -21.134 1.00 0.00 H new ATOM 0 HH11 ARG B 32 116.821 -3.853 -17.983 1.00 0.00 H new ATOM 0 HH12 ARG B 32 116.905 -2.275 -17.194 1.00 0.00 H new ATOM 0 HH21 ARG B 32 116.147 -0.502 -20.110 1.00 0.00 H new ATOM 0 HH22 ARG B 32 116.527 -0.394 -18.388 1.00 0.00 H new TER 1438 ARG B 32