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 Set 1.1: A 20 THR OG1 : rot 110:sc= -0.534 USER MOD Set 1.2: A 52 LYS NZ :NH3+ 150:sc= -2.91! (180deg=-3.64!) USER MOD Single : A 1 CYS N :NH3+ -164:sc= -0.0462 (180deg=-0.338) USER MOD Single : A 2 SER OG : rot 180:sc= -0.284 USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.411 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0761 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 76:sc= 0.777 USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.103 USER MOD Single : A 53 THR OG1 : rot 99:sc= 1.1 USER MOD Single : A 62 GLN : amide:sc= -0.215 X(o=-0.22,f=-0.45) USER MOD Single : A 63 ASN : amide:sc= -0.508 K(o=-0.51,f=-4.1!) USER MOD Single : B 1 CYS N :NH3+ 158:sc= 0.157 (180deg=-0.218) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 THR OG1 : rot -2:sc= 0.418 USER MOD Single : B 5 SER OG : rot 150:sc= -1.25 USER MOD Single : B 20 THR OG1 : rot 77:sc= 0.69 USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 1 72.194 20.052 -20.243 1.00 0.00 N ATOM 2 CA CYS A 1 71.530 19.992 -18.909 1.00 0.00 C ATOM 3 C CYS A 1 71.281 18.535 -18.535 1.00 0.00 C ATOM 4 O CYS A 1 71.308 18.173 -17.359 1.00 0.00 O ATOM 5 CB CYS A 1 70.204 20.751 -18.968 1.00 0.00 C ATOM 6 SG CYS A 1 69.389 20.671 -17.354 1.00 0.00 S ATOM 0 H1 CYS A 1 72.607 20.996 -20.383 1.00 0.00 H new ATOM 0 H2 CYS A 1 72.946 19.335 -20.289 1.00 0.00 H new ATOM 0 H3 CYS A 1 71.493 19.866 -20.988 1.00 0.00 H new ATOM 0 HA CYS A 1 72.171 20.451 -18.156 1.00 0.00 H new ATOM 0 HB2 CYS A 1 70.380 21.790 -19.247 1.00 0.00 H new ATOM 0 HB3 CYS A 1 69.560 20.320 -19.734 1.00 0.00 H new ATOM 10 N SER A 2 71.036 17.703 -19.542 1.00 0.00 N ATOM 11 CA SER A 2 70.782 16.287 -19.306 1.00 0.00 C ATOM 12 C SER A 2 72.085 15.546 -19.028 1.00 0.00 C ATOM 13 O SER A 2 73.162 15.996 -19.419 1.00 0.00 O ATOM 14 CB SER A 2 70.093 15.671 -20.523 1.00 0.00 C ATOM 15 OG SER A 2 71.007 15.632 -21.611 1.00 0.00 O ATOM 0 H SER A 2 71.008 17.982 -20.523 1.00 0.00 H new ATOM 0 HA SER A 2 70.133 16.195 -18.435 1.00 0.00 H new ATOM 0 HB2 SER A 2 69.746 14.665 -20.288 1.00 0.00 H new ATOM 0 HB3 SER A 2 69.214 16.256 -20.792 1.00 0.00 H new ATOM 0 HG SER A 2 70.568 15.236 -22.393 1.00 0.00 H new ATOM 21 N THR A 3 71.979 14.406 -18.350 1.00 0.00 N ATOM 22 CA THR A 3 73.156 13.605 -18.024 1.00 0.00 C ATOM 23 C THR A 3 73.560 12.744 -19.215 1.00 0.00 C ATOM 24 O THR A 3 72.816 12.635 -20.190 1.00 0.00 O ATOM 25 CB THR A 3 72.860 12.708 -16.821 1.00 0.00 C ATOM 26 OG1 THR A 3 72.069 11.604 -17.239 1.00 0.00 O ATOM 27 CG2 THR A 3 72.104 13.507 -15.758 1.00 0.00 C ATOM 0 H THR A 3 71.096 14.018 -18.017 1.00 0.00 H new ATOM 0 HA THR A 3 73.977 14.279 -17.780 1.00 0.00 H new ATOM 0 HB THR A 3 73.797 12.345 -16.399 1.00 0.00 H new ATOM 0 HG1 THR A 3 71.880 11.027 -16.470 1.00 0.00 H new ATOM 0 HG21 THR A 3 71.894 12.866 -14.902 1.00 0.00 H new ATOM 0 HG22 THR A 3 72.712 14.353 -15.438 1.00 0.00 H new ATOM 0 HG23 THR A 3 71.166 13.872 -16.176 1.00 0.00 H new ATOM 35 N VAL A 4 74.744 12.135 -19.124 1.00 0.00 N ATOM 36 CA VAL A 4 75.261 11.275 -20.193 1.00 0.00 C ATOM 37 C VAL A 4 74.846 11.789 -21.569 1.00 0.00 C ATOM 38 O VAL A 4 74.568 11.009 -22.481 1.00 0.00 O ATOM 39 CB VAL A 4 74.772 9.836 -19.997 1.00 0.00 C ATOM 40 CG1 VAL A 4 75.345 9.285 -18.690 1.00 0.00 C ATOM 41 CG2 VAL A 4 73.242 9.801 -19.931 1.00 0.00 C ATOM 0 H VAL A 4 75.365 12.221 -18.319 1.00 0.00 H new ATOM 0 HA VAL A 4 76.350 11.293 -20.142 1.00 0.00 H new ATOM 0 HB VAL A 4 75.106 9.228 -20.838 1.00 0.00 H new ATOM 0 HG11 VAL A 4 75.001 8.261 -18.545 1.00 0.00 H new ATOM 0 HG12 VAL A 4 76.434 9.298 -18.736 1.00 0.00 H new ATOM 0 HG13 VAL A 4 75.009 9.902 -17.857 1.00 0.00 H new ATOM 0 HG21 VAL A 4 72.907 8.773 -19.792 1.00 0.00 H new ATOM 0 HG22 VAL A 4 72.900 10.411 -19.095 1.00 0.00 H new ATOM 0 HG23 VAL A 4 72.829 10.194 -20.860 1.00 0.00 H new ATOM 51 N SER A 5 74.823 13.110 -21.709 1.00 0.00 N ATOM 52 CA SER A 5 74.459 13.735 -22.975 1.00 0.00 C ATOM 53 C SER A 5 75.649 13.702 -23.940 1.00 0.00 C ATOM 54 O SER A 5 75.502 13.309 -25.098 1.00 0.00 O ATOM 55 CB SER A 5 74.003 15.188 -22.732 1.00 0.00 C ATOM 56 OG SER A 5 74.772 16.080 -23.534 1.00 0.00 O ATOM 0 H SER A 5 75.052 13.767 -20.963 1.00 0.00 H new ATOM 0 HA SER A 5 73.635 13.180 -23.422 1.00 0.00 H new ATOM 0 HB2 SER A 5 72.945 15.291 -22.972 1.00 0.00 H new ATOM 0 HB3 SER A 5 74.117 15.443 -21.678 1.00 0.00 H new ATOM 0 HG SER A 5 74.476 17.001 -23.376 1.00 0.00 H new ATOM 62 N PRO A 6 76.816 14.096 -23.488 1.00 0.00 N ATOM 63 CA PRO A 6 78.047 14.101 -24.331 1.00 0.00 C ATOM 64 C PRO A 6 78.184 12.847 -25.179 1.00 0.00 C ATOM 65 O PRO A 6 78.537 12.927 -26.355 1.00 0.00 O ATOM 66 CB PRO A 6 79.163 14.210 -23.296 1.00 0.00 C ATOM 67 CG PRO A 6 78.562 15.049 -22.224 1.00 0.00 C ATOM 68 CD PRO A 6 77.107 14.590 -22.124 1.00 0.00 C ATOM 0 HA PRO A 6 78.051 14.909 -25.063 1.00 0.00 H new ATOM 0 HB2 PRO A 6 79.459 13.231 -22.920 1.00 0.00 H new ATOM 0 HB3 PRO A 6 80.056 14.674 -23.716 1.00 0.00 H new ATOM 0 HG2 PRO A 6 79.084 14.912 -21.277 1.00 0.00 H new ATOM 0 HG3 PRO A 6 78.625 16.109 -22.472 1.00 0.00 H new ATOM 0 HD2 PRO A 6 76.982 13.807 -21.376 1.00 0.00 H new ATOM 0 HD3 PRO A 6 76.445 15.408 -21.842 1.00 0.00 H new ATOM 76 N GLY A 7 77.914 11.691 -24.586 1.00 0.00 N ATOM 77 CA GLY A 7 78.042 10.439 -25.331 1.00 0.00 C ATOM 78 C GLY A 7 79.517 10.151 -25.557 1.00 0.00 C ATOM 79 O GLY A 7 79.996 9.042 -25.312 1.00 0.00 O ATOM 0 H GLY A 7 77.612 11.591 -23.617 1.00 0.00 H new ATOM 0 HA2 GLY A 7 77.579 9.622 -24.778 1.00 0.00 H new ATOM 0 HA3 GLY A 7 77.522 10.513 -26.286 1.00 0.00 H new ATOM 83 N VAL A 8 80.243 11.175 -25.991 1.00 0.00 N ATOM 84 CA VAL A 8 81.666 11.035 -26.205 1.00 0.00 C ATOM 85 C VAL A 8 82.301 10.597 -24.902 1.00 0.00 C ATOM 86 O VAL A 8 83.195 9.748 -24.888 1.00 0.00 O ATOM 87 CB VAL A 8 82.270 12.360 -26.669 1.00 0.00 C ATOM 88 CG1 VAL A 8 83.792 12.231 -26.745 1.00 0.00 C ATOM 89 CG2 VAL A 8 81.718 12.703 -28.053 1.00 0.00 C ATOM 0 H VAL A 8 79.868 12.101 -26.198 1.00 0.00 H new ATOM 0 HA VAL A 8 81.853 10.293 -26.981 1.00 0.00 H new ATOM 0 HB VAL A 8 82.011 13.149 -25.963 1.00 0.00 H new ATOM 0 HG11 VAL A 8 84.221 13.177 -27.076 1.00 0.00 H new ATOM 0 HG12 VAL A 8 84.185 11.979 -25.760 1.00 0.00 H new ATOM 0 HG13 VAL A 8 84.056 11.445 -27.453 1.00 0.00 H new ATOM 0 HG21 VAL A 8 82.144 13.647 -28.391 1.00 0.00 H new ATOM 0 HG22 VAL A 8 81.982 11.913 -28.756 1.00 0.00 H new ATOM 0 HG23 VAL A 8 80.633 12.793 -28.000 1.00 0.00 H new ATOM 99 N LEU A 9 81.810 11.149 -23.789 1.00 0.00 N ATOM 100 CA LEU A 9 82.347 10.746 -22.497 1.00 0.00 C ATOM 101 C LEU A 9 82.218 9.227 -22.378 1.00 0.00 C ATOM 102 O LEU A 9 83.119 8.542 -21.885 1.00 0.00 O ATOM 103 CB LEU A 9 81.612 11.429 -21.336 1.00 0.00 C ATOM 104 CG LEU A 9 81.939 12.933 -21.286 1.00 0.00 C ATOM 105 CD1 LEU A 9 81.159 13.566 -20.128 1.00 0.00 C ATOM 106 CD2 LEU A 9 83.451 13.158 -21.066 1.00 0.00 C ATOM 0 H LEU A 9 81.069 11.850 -23.758 1.00 0.00 H new ATOM 0 HA LEU A 9 83.392 11.050 -22.438 1.00 0.00 H new ATOM 0 HB2 LEU A 9 80.537 11.290 -21.449 1.00 0.00 H new ATOM 0 HB3 LEU A 9 81.896 10.960 -20.394 1.00 0.00 H new ATOM 0 HG LEU A 9 81.657 13.391 -22.234 1.00 0.00 H new ATOM 0 HD11 LEU A 9 81.381 14.632 -20.080 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.090 13.424 -20.289 1.00 0.00 H new ATOM 0 HD13 LEU A 9 81.451 13.092 -19.191 1.00 0.00 H new ATOM 0 HD21 LEU A 9 83.659 14.228 -21.034 1.00 0.00 H new ATOM 0 HD22 LEU A 9 83.753 12.701 -20.124 1.00 0.00 H new ATOM 0 HD23 LEU A 9 84.009 12.704 -21.885 1.00 0.00 H new ATOM 118 N ALA A 10 81.101 8.694 -22.875 1.00 0.00 N ATOM 119 CA ALA A 10 80.894 7.254 -22.853 1.00 0.00 C ATOM 120 C ALA A 10 82.010 6.597 -23.655 1.00 0.00 C ATOM 121 O ALA A 10 82.562 5.566 -23.258 1.00 0.00 O ATOM 122 CB ALA A 10 79.527 6.900 -23.454 1.00 0.00 C ATOM 0 H ALA A 10 80.340 9.231 -23.290 1.00 0.00 H new ATOM 0 HA ALA A 10 80.911 6.893 -21.825 1.00 0.00 H new ATOM 0 HB1 ALA A 10 79.388 5.819 -23.430 1.00 0.00 H new ATOM 0 HB2 ALA A 10 78.739 7.380 -22.874 1.00 0.00 H new ATOM 0 HB3 ALA A 10 79.482 7.249 -24.486 1.00 0.00 H new ATOM 128 N GLY A 11 82.359 7.228 -24.775 1.00 0.00 N ATOM 129 CA GLY A 11 83.436 6.722 -25.612 1.00 0.00 C ATOM 130 C GLY A 11 84.724 6.676 -24.802 1.00 0.00 C ATOM 131 O GLY A 11 85.594 5.839 -25.038 1.00 0.00 O ATOM 0 H GLY A 11 81.915 8.080 -25.118 1.00 0.00 H new ATOM 0 HA2 GLY A 11 83.189 5.726 -25.980 1.00 0.00 H new ATOM 0 HA3 GLY A 11 83.565 7.362 -26.485 1.00 0.00 H new ATOM 135 N ILE A 12 84.824 7.583 -23.829 1.00 0.00 N ATOM 136 CA ILE A 12 85.999 7.639 -22.961 1.00 0.00 C ATOM 137 C ILE A 12 86.039 6.375 -22.101 1.00 0.00 C ATOM 138 O ILE A 12 87.092 5.765 -21.929 1.00 0.00 O ATOM 139 CB ILE A 12 85.970 8.943 -22.089 1.00 0.00 C ATOM 140 CG1 ILE A 12 87.279 9.738 -22.251 1.00 0.00 C ATOM 141 CG2 ILE A 12 85.775 8.633 -20.592 1.00 0.00 C ATOM 142 CD1 ILE A 12 87.102 11.142 -21.662 1.00 0.00 C ATOM 0 H ILE A 12 84.111 8.283 -23.624 1.00 0.00 H new ATOM 0 HA ILE A 12 86.909 7.677 -23.560 1.00 0.00 H new ATOM 0 HB ILE A 12 85.124 9.532 -22.443 1.00 0.00 H new ATOM 0 HG12 ILE A 12 88.095 9.221 -21.747 1.00 0.00 H new ATOM 0 HG13 ILE A 12 87.547 9.806 -23.305 1.00 0.00 H new ATOM 0 HG21 ILE A 12 85.761 9.565 -20.026 1.00 0.00 H new ATOM 0 HG22 ILE A 12 84.831 8.108 -20.449 1.00 0.00 H new ATOM 0 HG23 ILE A 12 86.595 8.007 -20.240 1.00 0.00 H new ATOM 0 HD11 ILE A 12 88.029 11.704 -21.777 1.00 0.00 H new ATOM 0 HD12 ILE A 12 86.297 11.658 -22.186 1.00 0.00 H new ATOM 0 HD13 ILE A 12 86.854 11.064 -20.603 1.00 0.00 H new ATOM 154 N VAL A 13 84.881 5.985 -21.574 1.00 0.00 N ATOM 155 CA VAL A 13 84.806 4.784 -20.747 1.00 0.00 C ATOM 156 C VAL A 13 85.326 3.596 -21.543 1.00 0.00 C ATOM 157 O VAL A 13 86.204 2.855 -21.088 1.00 0.00 O ATOM 158 CB VAL A 13 83.362 4.524 -20.317 1.00 0.00 C ATOM 159 CG1 VAL A 13 83.293 3.214 -19.530 1.00 0.00 C ATOM 160 CG2 VAL A 13 82.874 5.673 -19.432 1.00 0.00 C ATOM 0 H VAL A 13 83.995 6.474 -21.702 1.00 0.00 H new ATOM 0 HA VAL A 13 85.415 4.926 -19.854 1.00 0.00 H new ATOM 0 HB VAL A 13 82.729 4.454 -21.202 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.264 3.028 -19.223 1.00 0.00 H new ATOM 0 HG12 VAL A 13 83.638 2.393 -20.159 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.928 3.286 -18.647 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.845 5.485 -19.127 1.00 0.00 H new ATOM 0 HG22 VAL A 13 83.507 5.745 -18.548 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.922 6.608 -19.990 1.00 0.00 H new ATOM 170 N VAL A 14 84.795 3.438 -22.750 1.00 0.00 N ATOM 171 CA VAL A 14 85.231 2.354 -23.616 1.00 0.00 C ATOM 172 C VAL A 14 86.736 2.457 -23.841 1.00 0.00 C ATOM 173 O VAL A 14 87.443 1.449 -23.858 1.00 0.00 O ATOM 174 CB VAL A 14 84.503 2.425 -24.959 1.00 0.00 C ATOM 175 CG1 VAL A 14 85.064 1.360 -25.904 1.00 0.00 C ATOM 176 CG2 VAL A 14 83.009 2.175 -24.742 1.00 0.00 C ATOM 0 H VAL A 14 84.072 4.039 -23.145 1.00 0.00 H new ATOM 0 HA VAL A 14 84.997 1.402 -23.139 1.00 0.00 H new ATOM 0 HB VAL A 14 84.649 3.412 -25.398 1.00 0.00 H new ATOM 0 HG11 VAL A 14 84.544 1.412 -26.861 1.00 0.00 H new ATOM 0 HG12 VAL A 14 86.128 1.536 -26.060 1.00 0.00 H new ATOM 0 HG13 VAL A 14 84.920 0.372 -25.466 1.00 0.00 H new ATOM 0 HG21 VAL A 14 82.489 2.225 -25.699 1.00 0.00 H new ATOM 0 HG22 VAL A 14 82.865 1.188 -24.302 1.00 0.00 H new ATOM 0 HG23 VAL A 14 82.607 2.933 -24.070 1.00 0.00 H new ATOM 186 N GLY A 15 87.212 3.690 -24.009 1.00 0.00 N ATOM 187 CA GLY A 15 88.631 3.944 -24.233 1.00 0.00 C ATOM 188 C GLY A 15 89.475 3.446 -23.063 1.00 0.00 C ATOM 189 O GLY A 15 90.582 2.947 -23.252 1.00 0.00 O ATOM 0 H GLY A 15 86.633 4.529 -23.994 1.00 0.00 H new ATOM 0 HA2 GLY A 15 88.951 3.450 -25.151 1.00 0.00 H new ATOM 0 HA3 GLY A 15 88.794 5.013 -24.373 1.00 0.00 H new ATOM 193 N ASP A 16 88.948 3.590 -21.854 1.00 0.00 N ATOM 194 CA ASP A 16 89.667 3.153 -20.664 1.00 0.00 C ATOM 195 C ASP A 16 89.807 1.635 -20.654 1.00 0.00 C ATOM 196 O ASP A 16 90.896 1.098 -20.420 1.00 0.00 O ATOM 197 CB ASP A 16 88.916 3.611 -19.410 1.00 0.00 C ATOM 198 CG ASP A 16 89.774 3.380 -18.172 1.00 0.00 C ATOM 199 OD1 ASP A 16 90.728 2.625 -18.269 1.00 0.00 O ATOM 200 OD2 ASP A 16 89.464 3.961 -17.145 1.00 0.00 O ATOM 0 H ASP A 16 88.033 4.002 -21.672 1.00 0.00 H new ATOM 0 HA ASP A 16 90.663 3.596 -20.674 1.00 0.00 H new ATOM 0 HB2 ASP A 16 88.662 4.668 -19.494 1.00 0.00 H new ATOM 0 HB3 ASP A 16 87.977 3.064 -19.319 1.00 0.00 H new ATOM 205 N LEU A 17 88.698 0.948 -20.909 1.00 0.00 N ATOM 206 CA LEU A 17 88.705 -0.511 -20.923 1.00 0.00 C ATOM 207 C LEU A 17 89.753 -1.037 -21.901 1.00 0.00 C ATOM 208 O LEU A 17 90.586 -1.878 -21.543 1.00 0.00 O ATOM 209 CB LEU A 17 87.314 -1.030 -21.316 1.00 0.00 C ATOM 210 CG LEU A 17 87.321 -2.563 -21.440 1.00 0.00 C ATOM 211 CD1 LEU A 17 87.829 -3.199 -20.138 1.00 0.00 C ATOM 212 CD2 LEU A 17 85.893 -3.044 -21.721 1.00 0.00 C ATOM 0 H LEU A 17 87.792 1.372 -21.107 1.00 0.00 H new ATOM 0 HA LEU A 17 88.957 -0.868 -19.925 1.00 0.00 H new ATOM 0 HB2 LEU A 17 86.582 -0.724 -20.569 1.00 0.00 H new ATOM 0 HB3 LEU A 17 87.008 -0.585 -22.263 1.00 0.00 H new ATOM 0 HG LEU A 17 87.983 -2.857 -22.255 1.00 0.00 H new ATOM 0 HD11 LEU A 17 87.829 -4.284 -20.239 1.00 0.00 H new ATOM 0 HD12 LEU A 17 88.843 -2.853 -19.936 1.00 0.00 H new ATOM 0 HD13 LEU A 17 87.176 -2.911 -19.314 1.00 0.00 H new ATOM 0 HD21 LEU A 17 85.886 -4.130 -21.811 1.00 0.00 H new ATOM 0 HD22 LEU A 17 85.240 -2.744 -20.902 1.00 0.00 H new ATOM 0 HD23 LEU A 17 85.536 -2.601 -22.651 1.00 0.00 H new ATOM 224 N VAL A 18 89.714 -0.548 -23.137 1.00 0.00 N ATOM 225 CA VAL A 18 90.671 -1.001 -24.138 1.00 0.00 C ATOM 226 C VAL A 18 92.089 -0.589 -23.758 1.00 0.00 C ATOM 227 O VAL A 18 93.039 -1.269 -24.116 1.00 0.00 O ATOM 228 CB VAL A 18 90.326 -0.445 -25.521 1.00 0.00 C ATOM 229 CG1 VAL A 18 88.981 -1.012 -25.979 1.00 0.00 C ATOM 230 CG2 VAL A 18 90.235 1.073 -25.449 1.00 0.00 C ATOM 0 H VAL A 18 89.044 0.148 -23.464 1.00 0.00 H new ATOM 0 HA VAL A 18 90.616 -2.089 -24.175 1.00 0.00 H new ATOM 0 HB VAL A 18 91.102 -0.731 -26.230 1.00 0.00 H new ATOM 0 HG11 VAL A 18 88.736 -0.616 -26.964 1.00 0.00 H new ATOM 0 HG12 VAL A 18 89.043 -2.099 -26.030 1.00 0.00 H new ATOM 0 HG13 VAL A 18 88.205 -0.726 -25.269 1.00 0.00 H new ATOM 0 HG21 VAL A 18 89.989 1.470 -26.434 1.00 0.00 H new ATOM 0 HG22 VAL A 18 89.459 1.358 -24.739 1.00 0.00 H new ATOM 0 HG23 VAL A 18 91.192 1.480 -25.122 1.00 0.00 H new ATOM 240 N LEU A 19 92.237 0.520 -23.036 1.00 0.00 N ATOM 241 CA LEU A 19 93.575 0.965 -22.641 1.00 0.00 C ATOM 242 C LEU A 19 94.248 -0.114 -21.788 1.00 0.00 C ATOM 243 O LEU A 19 95.323 -0.619 -22.137 1.00 0.00 O ATOM 244 CB LEU A 19 93.481 2.285 -21.851 1.00 0.00 C ATOM 245 CG LEU A 19 94.778 3.108 -21.995 1.00 0.00 C ATOM 246 CD1 LEU A 19 95.987 2.243 -21.629 1.00 0.00 C ATOM 247 CD2 LEU A 19 94.931 3.638 -23.439 1.00 0.00 C ATOM 0 H LEU A 19 91.471 1.114 -22.719 1.00 0.00 H new ATOM 0 HA LEU A 19 94.174 1.135 -23.536 1.00 0.00 H new ATOM 0 HB2 LEU A 19 92.634 2.869 -22.211 1.00 0.00 H new ATOM 0 HB3 LEU A 19 93.297 2.071 -20.798 1.00 0.00 H new ATOM 0 HG LEU A 19 94.724 3.960 -21.317 1.00 0.00 H new ATOM 0 HD11 LEU A 19 96.899 2.830 -21.733 1.00 0.00 H new ATOM 0 HD12 LEU A 19 95.891 1.901 -20.599 1.00 0.00 H new ATOM 0 HD13 LEU A 19 96.033 1.381 -22.295 1.00 0.00 H new ATOM 0 HD21 LEU A 19 95.852 4.216 -23.519 1.00 0.00 H new ATOM 0 HD22 LEU A 19 94.968 2.798 -24.133 1.00 0.00 H new ATOM 0 HD23 LEU A 19 94.081 4.275 -23.685 1.00 0.00 H new ATOM 259 N THR A 20 93.604 -0.472 -20.677 1.00 0.00 N ATOM 260 CA THR A 20 94.149 -1.497 -19.794 1.00 0.00 C ATOM 261 C THR A 20 94.395 -2.798 -20.554 1.00 0.00 C ATOM 262 O THR A 20 95.412 -3.460 -20.353 1.00 0.00 O ATOM 263 CB THR A 20 93.172 -1.759 -18.648 1.00 0.00 C ATOM 264 OG1 THR A 20 93.033 -0.580 -17.875 1.00 0.00 O ATOM 265 CG2 THR A 20 93.701 -2.892 -17.766 1.00 0.00 C ATOM 0 H THR A 20 92.717 -0.072 -20.372 1.00 0.00 H new ATOM 0 HA THR A 20 95.100 -1.139 -19.399 1.00 0.00 H new ATOM 0 HB THR A 20 92.203 -2.047 -19.055 1.00 0.00 H new ATOM 0 HG1 THR A 20 92.139 -0.203 -18.012 1.00 0.00 H new ATOM 0 HG21 THR A 20 93.001 -3.075 -16.950 1.00 0.00 H new ATOM 0 HG22 THR A 20 93.808 -3.798 -18.363 1.00 0.00 H new ATOM 0 HG23 THR A 20 94.671 -2.611 -17.356 1.00 0.00 H new ATOM 273 N VAL A 21 93.449 -3.171 -21.410 1.00 0.00 N ATOM 274 CA VAL A 21 93.569 -4.412 -22.174 1.00 0.00 C ATOM 275 C VAL A 21 94.722 -4.362 -23.182 1.00 0.00 C ATOM 276 O VAL A 21 95.327 -5.390 -23.484 1.00 0.00 O ATOM 277 CB VAL A 21 92.259 -4.689 -22.913 1.00 0.00 C ATOM 278 CG1 VAL A 21 92.406 -5.957 -23.756 1.00 0.00 C ATOM 279 CG2 VAL A 21 91.131 -4.882 -21.895 1.00 0.00 C ATOM 0 H VAL A 21 92.598 -2.639 -21.593 1.00 0.00 H new ATOM 0 HA VAL A 21 93.782 -5.213 -21.466 1.00 0.00 H new ATOM 0 HB VAL A 21 92.024 -3.846 -23.563 1.00 0.00 H new ATOM 0 HG11 VAL A 21 91.472 -6.154 -24.283 1.00 0.00 H new ATOM 0 HG12 VAL A 21 93.209 -5.821 -24.480 1.00 0.00 H new ATOM 0 HG13 VAL A 21 92.641 -6.800 -23.107 1.00 0.00 H new ATOM 0 HG21 VAL A 21 90.197 -5.080 -22.420 1.00 0.00 H new ATOM 0 HG22 VAL A 21 91.367 -5.725 -21.246 1.00 0.00 H new ATOM 0 HG23 VAL A 21 91.025 -3.979 -21.294 1.00 0.00 H new ATOM 289 N LEU A 22 95.008 -3.181 -23.719 1.00 0.00 N ATOM 290 CA LEU A 22 96.073 -3.043 -24.711 1.00 0.00 C ATOM 291 C LEU A 22 97.453 -3.217 -24.076 1.00 0.00 C ATOM 292 O LEU A 22 98.250 -4.035 -24.533 1.00 0.00 O ATOM 293 CB LEU A 22 95.975 -1.661 -25.391 1.00 0.00 C ATOM 294 CG LEU A 22 96.538 -1.700 -26.828 1.00 0.00 C ATOM 295 CD1 LEU A 22 97.970 -2.246 -26.819 1.00 0.00 C ATOM 296 CD2 LEU A 22 95.649 -2.576 -27.740 1.00 0.00 C ATOM 0 H LEU A 22 94.524 -2.313 -23.489 1.00 0.00 H new ATOM 0 HA LEU A 22 95.947 -3.828 -25.457 1.00 0.00 H new ATOM 0 HB2 LEU A 22 94.934 -1.338 -25.415 1.00 0.00 H new ATOM 0 HB3 LEU A 22 96.523 -0.925 -24.803 1.00 0.00 H new ATOM 0 HG LEU A 22 96.544 -0.683 -27.221 1.00 0.00 H new ATOM 0 HD11 LEU A 22 98.357 -2.269 -27.838 1.00 0.00 H new ATOM 0 HD12 LEU A 22 98.601 -1.603 -26.206 1.00 0.00 H new ATOM 0 HD13 LEU A 22 97.972 -3.255 -26.407 1.00 0.00 H new ATOM 0 HD21 LEU A 22 96.064 -2.590 -28.748 1.00 0.00 H new ATOM 0 HD22 LEU A 22 95.615 -3.592 -27.348 1.00 0.00 H new ATOM 0 HD23 LEU A 22 94.640 -2.164 -27.768 1.00 0.00 H new ATOM 308 N ILE A 23 97.740 -2.449 -23.031 1.00 0.00 N ATOM 309 CA ILE A 23 99.044 -2.556 -22.383 1.00 0.00 C ATOM 310 C ILE A 23 99.181 -3.905 -21.686 1.00 0.00 C ATOM 311 O ILE A 23 100.223 -4.557 -21.776 1.00 0.00 O ATOM 312 CB ILE A 23 99.242 -1.415 -21.378 1.00 0.00 C ATOM 313 CG1 ILE A 23 98.948 -0.075 -22.067 1.00 0.00 C ATOM 314 CG2 ILE A 23 100.696 -1.415 -20.887 1.00 0.00 C ATOM 315 CD1 ILE A 23 98.958 1.058 -21.037 1.00 0.00 C ATOM 0 H ILE A 23 97.107 -1.762 -22.622 1.00 0.00 H new ATOM 0 HA ILE A 23 99.816 -2.479 -23.149 1.00 0.00 H new ATOM 0 HB ILE A 23 98.567 -1.554 -20.533 1.00 0.00 H new ATOM 0 HG12 ILE A 23 99.693 0.118 -22.839 1.00 0.00 H new ATOM 0 HG13 ILE A 23 97.979 -0.117 -22.564 1.00 0.00 H new ATOM 0 HG21 ILE A 23 100.839 -0.604 -20.172 1.00 0.00 H new ATOM 0 HG22 ILE A 23 100.917 -2.367 -20.405 1.00 0.00 H new ATOM 0 HG23 ILE A 23 101.366 -1.273 -21.735 1.00 0.00 H new ATOM 0 HD11 ILE A 23 98.748 2.005 -21.535 1.00 0.00 H new ATOM 0 HD12 ILE A 23 98.196 0.869 -20.281 1.00 0.00 H new ATOM 0 HD13 ILE A 23 99.937 1.108 -20.560 1.00 0.00 H new ATOM 327 N ALA A 24 98.126 -4.326 -20.999 1.00 0.00 N ATOM 328 CA ALA A 24 98.149 -5.607 -20.300 1.00 0.00 C ATOM 329 C ALA A 24 98.375 -6.743 -21.292 1.00 0.00 C ATOM 330 O ALA A 24 99.152 -7.662 -21.034 1.00 0.00 O ATOM 331 CB ALA A 24 96.829 -5.826 -19.560 1.00 0.00 C ATOM 0 H ALA A 24 97.253 -3.807 -20.911 1.00 0.00 H new ATOM 0 HA ALA A 24 98.966 -5.595 -19.578 1.00 0.00 H new ATOM 0 HB1 ALA A 24 96.857 -6.785 -19.042 1.00 0.00 H new ATOM 0 HB2 ALA A 24 96.681 -5.026 -18.835 1.00 0.00 H new ATOM 0 HB3 ALA A 24 96.006 -5.824 -20.275 1.00 0.00 H new ATOM 337 N LEU A 25 97.691 -6.670 -22.428 1.00 0.00 N ATOM 338 CA LEU A 25 97.823 -7.694 -23.459 1.00 0.00 C ATOM 339 C LEU A 25 99.235 -7.681 -24.036 1.00 0.00 C ATOM 340 O LEU A 25 99.835 -8.732 -24.260 1.00 0.00 O ATOM 341 CB LEU A 25 96.796 -7.440 -24.571 1.00 0.00 C ATOM 342 CG LEU A 25 97.021 -8.402 -25.748 1.00 0.00 C ATOM 343 CD1 LEU A 25 97.025 -9.853 -25.249 1.00 0.00 C ATOM 344 CD2 LEU A 25 95.891 -8.214 -26.764 1.00 0.00 C ATOM 0 H LEU A 25 97.043 -5.917 -22.658 1.00 0.00 H new ATOM 0 HA LEU A 25 97.637 -8.673 -23.016 1.00 0.00 H new ATOM 0 HB2 LEU A 25 95.788 -7.568 -24.178 1.00 0.00 H new ATOM 0 HB3 LEU A 25 96.875 -6.409 -24.917 1.00 0.00 H new ATOM 0 HG LEU A 25 97.983 -8.187 -26.214 1.00 0.00 H new ATOM 0 HD11 LEU A 25 97.185 -10.527 -26.091 1.00 0.00 H new ATOM 0 HD12 LEU A 25 97.825 -9.985 -24.521 1.00 0.00 H new ATOM 0 HD13 LEU A 25 96.067 -10.079 -24.780 1.00 0.00 H new ATOM 0 HD21 LEU A 25 96.041 -8.892 -27.604 1.00 0.00 H new ATOM 0 HD22 LEU A 25 94.934 -8.431 -26.289 1.00 0.00 H new ATOM 0 HD23 LEU A 25 95.893 -7.185 -27.124 1.00 0.00 H new ATOM 356 N ALA A 26 99.758 -6.484 -24.277 1.00 0.00 N ATOM 357 CA ALA A 26 101.099 -6.342 -24.832 1.00 0.00 C ATOM 358 C ALA A 26 102.117 -7.091 -23.978 1.00 0.00 C ATOM 359 O ALA A 26 102.938 -7.847 -24.496 1.00 0.00 O ATOM 360 CB ALA A 26 101.481 -4.863 -24.900 1.00 0.00 C ATOM 0 H ALA A 26 99.277 -5.602 -24.098 1.00 0.00 H new ATOM 0 HA ALA A 26 101.102 -6.766 -25.836 1.00 0.00 H new ATOM 0 HB1 ALA A 26 102.484 -4.765 -25.316 1.00 0.00 H new ATOM 0 HB2 ALA A 26 100.772 -4.333 -25.535 1.00 0.00 H new ATOM 0 HB3 ALA A 26 101.460 -4.435 -23.898 1.00 0.00 H new ATOM 366 N VAL A 27 102.060 -6.874 -22.668 1.00 0.00 N ATOM 367 CA VAL A 27 102.988 -7.534 -21.757 1.00 0.00 C ATOM 368 C VAL A 27 102.773 -9.045 -21.769 1.00 0.00 C ATOM 369 O VAL A 27 103.732 -9.816 -21.813 1.00 0.00 O ATOM 370 CB VAL A 27 102.796 -6.999 -20.338 1.00 0.00 C ATOM 371 CG1 VAL A 27 103.790 -7.682 -19.396 1.00 0.00 C ATOM 372 CG2 VAL A 27 103.040 -5.489 -20.327 1.00 0.00 C ATOM 0 H VAL A 27 101.388 -6.253 -22.217 1.00 0.00 H new ATOM 0 HA VAL A 27 104.004 -7.323 -22.090 1.00 0.00 H new ATOM 0 HB VAL A 27 101.779 -7.207 -20.006 1.00 0.00 H new ATOM 0 HG11 VAL A 27 103.653 -7.301 -18.384 1.00 0.00 H new ATOM 0 HG12 VAL A 27 103.618 -8.758 -19.404 1.00 0.00 H new ATOM 0 HG13 VAL A 27 104.807 -7.474 -19.728 1.00 0.00 H new ATOM 0 HG21 VAL A 27 102.903 -5.106 -19.316 1.00 0.00 H new ATOM 0 HG22 VAL A 27 104.057 -5.282 -20.659 1.00 0.00 H new ATOM 0 HG23 VAL A 27 102.333 -5.001 -20.998 1.00 0.00 H new ATOM 382 N TYR A 28 101.513 -9.462 -21.729 1.00 0.00 N ATOM 383 CA TYR A 28 101.188 -10.884 -21.735 1.00 0.00 C ATOM 384 C TYR A 28 101.791 -11.569 -22.958 1.00 0.00 C ATOM 385 O TYR A 28 102.251 -12.708 -22.880 1.00 0.00 O ATOM 386 CB TYR A 28 99.670 -11.077 -21.737 1.00 0.00 C ATOM 387 CG TYR A 28 99.348 -12.549 -21.630 1.00 0.00 C ATOM 388 CD1 TYR A 28 99.285 -13.338 -22.785 1.00 0.00 C ATOM 389 CD2 TYR A 28 99.113 -13.124 -20.375 1.00 0.00 C ATOM 390 CE1 TYR A 28 98.988 -14.702 -22.684 1.00 0.00 C ATOM 391 CE2 TYR A 28 98.815 -14.488 -20.275 1.00 0.00 C ATOM 392 CZ TYR A 28 98.752 -15.277 -21.429 1.00 0.00 C ATOM 393 OH TYR A 28 98.460 -16.623 -21.331 1.00 0.00 O ATOM 0 H TYR A 28 100.705 -8.841 -21.692 1.00 0.00 H new ATOM 0 HA TYR A 28 101.609 -11.334 -20.836 1.00 0.00 H new ATOM 0 HB2 TYR A 28 99.223 -10.535 -20.904 1.00 0.00 H new ATOM 0 HB3 TYR A 28 99.242 -10.666 -22.651 1.00 0.00 H new ATOM 0 HD1 TYR A 28 99.465 -12.894 -23.753 1.00 0.00 H new ATOM 0 HD2 TYR A 28 99.162 -12.515 -19.484 1.00 0.00 H new ATOM 0 HE1 TYR A 28 98.941 -15.311 -23.574 1.00 0.00 H new ATOM 0 HE2 TYR A 28 98.634 -14.932 -19.307 1.00 0.00 H new ATOM 0 HH TYR A 28 98.325 -16.861 -20.390 1.00 0.00 H new ATOM 403 N PHE A 29 101.783 -10.868 -24.087 1.00 0.00 N ATOM 404 CA PHE A 29 102.330 -11.419 -25.322 1.00 0.00 C ATOM 405 C PHE A 29 103.808 -11.760 -25.151 1.00 0.00 C ATOM 406 O PHE A 29 104.246 -12.857 -25.498 1.00 0.00 O ATOM 407 CB PHE A 29 102.165 -10.409 -26.458 1.00 0.00 C ATOM 408 CG PHE A 29 102.560 -11.049 -27.768 1.00 0.00 C ATOM 409 CD1 PHE A 29 101.657 -11.886 -28.436 1.00 0.00 C ATOM 410 CD2 PHE A 29 103.825 -10.805 -28.315 1.00 0.00 C ATOM 411 CE1 PHE A 29 102.021 -12.479 -29.651 1.00 0.00 C ATOM 412 CE2 PHE A 29 104.188 -11.399 -29.531 1.00 0.00 C ATOM 413 CZ PHE A 29 103.285 -12.236 -30.199 1.00 0.00 C ATOM 0 H PHE A 29 101.407 -9.924 -24.173 1.00 0.00 H new ATOM 0 HA PHE A 29 101.786 -12.332 -25.564 1.00 0.00 H new ATOM 0 HB2 PHE A 29 101.131 -10.067 -26.506 1.00 0.00 H new ATOM 0 HB3 PHE A 29 102.783 -9.531 -26.270 1.00 0.00 H new ATOM 0 HD1 PHE A 29 100.681 -12.074 -28.014 1.00 0.00 H new ATOM 0 HD2 PHE A 29 104.521 -10.159 -27.800 1.00 0.00 H new ATOM 0 HE1 PHE A 29 101.325 -13.125 -30.166 1.00 0.00 H new ATOM 0 HE2 PHE A 29 105.164 -11.211 -29.953 1.00 0.00 H new ATOM 0 HZ PHE A 29 103.564 -12.693 -31.137 1.00 0.00 H new ATOM 423 N LEU A 30 104.571 -10.813 -24.614 1.00 0.00 N ATOM 424 CA LEU A 30 105.999 -11.025 -24.402 1.00 0.00 C ATOM 425 C LEU A 30 106.228 -12.080 -23.324 1.00 0.00 C ATOM 426 O LEU A 30 107.141 -12.899 -23.426 1.00 0.00 O ATOM 427 CB LEU A 30 106.667 -9.709 -23.982 1.00 0.00 C ATOM 428 CG LEU A 30 108.203 -9.833 -24.088 1.00 0.00 C ATOM 429 CD1 LEU A 30 108.664 -9.528 -25.520 1.00 0.00 C ATOM 430 CD2 LEU A 30 108.869 -8.837 -23.131 1.00 0.00 C ATOM 0 H LEU A 30 104.228 -9.898 -24.320 1.00 0.00 H new ATOM 0 HA LEU A 30 106.439 -11.373 -25.336 1.00 0.00 H new ATOM 0 HB2 LEU A 30 106.316 -8.896 -24.617 1.00 0.00 H new ATOM 0 HB3 LEU A 30 106.385 -9.460 -22.959 1.00 0.00 H new ATOM 0 HG LEU A 30 108.488 -10.852 -23.825 1.00 0.00 H new ATOM 0 HD11 LEU A 30 109.749 -9.619 -25.580 1.00 0.00 H new ATOM 0 HD12 LEU A 30 108.202 -10.234 -26.209 1.00 0.00 H new ATOM 0 HD13 LEU A 30 108.370 -8.513 -25.789 1.00 0.00 H new ATOM 0 HD21 LEU A 30 109.953 -8.927 -23.208 1.00 0.00 H new ATOM 0 HD22 LEU A 30 108.569 -7.823 -23.395 1.00 0.00 H new ATOM 0 HD23 LEU A 30 108.559 -9.052 -22.108 1.00 0.00 H new ATOM 442 N GLY A 31 105.392 -12.051 -22.289 1.00 0.00 N ATOM 443 CA GLY A 31 105.511 -13.007 -21.193 1.00 0.00 C ATOM 444 C GLY A 31 105.767 -14.416 -21.716 1.00 0.00 C ATOM 445 O GLY A 31 106.857 -14.964 -21.544 1.00 0.00 O ATOM 0 H GLY A 31 104.630 -11.381 -22.187 1.00 0.00 H new ATOM 0 HA2 GLY A 31 106.325 -12.708 -20.533 1.00 0.00 H new ATOM 0 HA3 GLY A 31 104.598 -12.997 -20.598 1.00 0.00 H new ATOM 449 N ARG A 32 104.757 -14.999 -22.353 1.00 0.00 N ATOM 450 CA ARG A 32 104.886 -16.347 -22.894 1.00 0.00 C ATOM 451 C ARG A 32 105.498 -17.284 -21.858 1.00 0.00 C ATOM 452 O ARG A 32 106.604 -17.791 -22.043 1.00 0.00 O ATOM 453 CB ARG A 32 105.763 -16.326 -24.148 1.00 0.00 C ATOM 454 CG ARG A 32 105.652 -17.670 -24.871 1.00 0.00 C ATOM 455 CD ARG A 32 106.613 -17.695 -26.059 1.00 0.00 C ATOM 456 NE ARG A 32 106.174 -16.758 -27.086 1.00 0.00 N ATOM 457 CZ ARG A 32 106.793 -16.684 -28.260 1.00 0.00 C ATOM 458 NH1 ARG A 32 107.810 -17.462 -28.510 1.00 0.00 N ATOM 459 NH2 ARG A 32 106.382 -15.836 -29.163 1.00 0.00 N ATOM 0 H ARG A 32 103.847 -14.564 -22.506 1.00 0.00 H new ATOM 0 HA ARG A 32 103.892 -16.710 -23.153 1.00 0.00 H new ATOM 0 HB2 ARG A 32 105.451 -15.518 -24.810 1.00 0.00 H new ATOM 0 HB3 ARG A 32 106.801 -16.132 -23.876 1.00 0.00 H new ATOM 0 HG2 ARG A 32 105.885 -18.484 -24.185 1.00 0.00 H new ATOM 0 HG3 ARG A 32 104.629 -17.826 -25.214 1.00 0.00 H new ATOM 0 HD2 ARG A 32 107.619 -17.436 -25.727 1.00 0.00 H new ATOM 0 HD3 ARG A 32 106.663 -18.702 -26.473 1.00 0.00 H new ATOM 0 HE ARG A 32 105.378 -16.148 -26.900 1.00 0.00 H new ATOM 0 HH11 ARG A 32 108.129 -18.126 -27.805 1.00 0.00 H new ATOM 0 HH12 ARG A 32 108.286 -17.406 -29.411 1.00 0.00 H new ATOM 0 HH21 ARG A 32 105.585 -15.230 -28.968 1.00 0.00 H new ATOM 0 HH22 ARG A 32 106.857 -15.780 -30.064 1.00 0.00 H new ATOM 473 N LEU A 33 104.772 -17.509 -20.769 1.00 0.00 N ATOM 474 CA LEU A 33 105.253 -18.389 -19.709 1.00 0.00 C ATOM 475 C LEU A 33 106.649 -17.961 -19.256 1.00 0.00 C ATOM 476 O LEU A 33 107.271 -17.093 -19.868 1.00 0.00 O ATOM 477 CB LEU A 33 105.295 -19.839 -20.209 1.00 0.00 C ATOM 478 CG LEU A 33 103.880 -20.428 -20.222 1.00 0.00 C ATOM 479 CD1 LEU A 33 102.978 -19.595 -21.139 1.00 0.00 C ATOM 480 CD2 LEU A 33 103.938 -21.870 -20.731 1.00 0.00 C ATOM 0 H LEU A 33 103.855 -17.098 -20.597 1.00 0.00 H new ATOM 0 HA LEU A 33 104.569 -18.320 -18.863 1.00 0.00 H new ATOM 0 HB2 LEU A 33 105.722 -19.875 -21.211 1.00 0.00 H new ATOM 0 HB3 LEU A 33 105.941 -20.436 -19.565 1.00 0.00 H new ATOM 0 HG LEU A 33 103.472 -20.412 -19.211 1.00 0.00 H new ATOM 0 HD11 LEU A 33 101.974 -20.019 -21.144 1.00 0.00 H new ATOM 0 HD12 LEU A 33 102.937 -18.569 -20.774 1.00 0.00 H new ATOM 0 HD13 LEU A 33 103.381 -19.604 -22.152 1.00 0.00 H new ATOM 0 HD21 LEU A 33 102.933 -22.293 -20.742 1.00 0.00 H new ATOM 0 HD22 LEU A 33 104.348 -21.883 -21.741 1.00 0.00 H new ATOM 0 HD23 LEU A 33 104.574 -22.463 -20.073 1.00 0.00 H new ATOM 492 N GLY A 34 107.130 -18.578 -18.182 1.00 0.00 N ATOM 493 CA GLY A 34 108.452 -18.255 -17.656 1.00 0.00 C ATOM 494 C GLY A 34 108.437 -16.922 -16.919 1.00 0.00 C ATOM 495 O GLY A 34 109.275 -16.670 -16.053 1.00 0.00 O ATOM 0 H GLY A 34 106.629 -19.299 -17.662 1.00 0.00 H new ATOM 0 HA2 GLY A 34 108.781 -19.044 -16.980 1.00 0.00 H new ATOM 0 HA3 GLY A 34 109.172 -18.214 -18.473 1.00 0.00 H new ATOM 499 N THR A 35 107.480 -16.068 -17.268 1.00 0.00 N ATOM 500 CA THR A 35 107.366 -14.761 -16.633 1.00 0.00 C ATOM 501 C THR A 35 107.044 -14.914 -15.150 1.00 0.00 C ATOM 502 O THR A 35 107.489 -14.118 -14.323 1.00 0.00 O ATOM 503 CB THR A 35 106.267 -13.942 -17.313 1.00 0.00 C ATOM 504 OG1 THR A 35 105.846 -12.902 -16.441 1.00 0.00 O ATOM 505 CG2 THR A 35 105.079 -14.848 -17.638 1.00 0.00 C ATOM 0 H THR A 35 106.777 -16.256 -17.982 1.00 0.00 H new ATOM 0 HA THR A 35 108.320 -14.244 -16.736 1.00 0.00 H new ATOM 0 HB THR A 35 106.654 -13.510 -18.236 1.00 0.00 H new ATOM 0 HG1 THR A 35 105.143 -12.375 -16.875 1.00 0.00 H new ATOM 0 HG21 THR A 35 104.297 -14.263 -18.122 1.00 0.00 H new ATOM 0 HG22 THR A 35 105.402 -15.646 -18.307 1.00 0.00 H new ATOM 0 HG23 THR A 35 104.690 -15.282 -16.717 1.00 0.00 H new ATOM 513 N ALA A 36 106.267 -15.940 -14.821 1.00 0.00 N ATOM 514 CA ALA A 36 105.890 -16.187 -13.434 1.00 0.00 C ATOM 515 C ALA A 36 105.307 -14.924 -12.807 1.00 0.00 C ATOM 516 O ALA A 36 105.025 -13.949 -13.502 1.00 0.00 O ATOM 517 CB ALA A 36 107.112 -16.640 -12.633 1.00 0.00 C ATOM 0 H ALA A 36 105.888 -16.610 -15.490 1.00 0.00 H new ATOM 0 HA ALA A 36 105.134 -16.972 -13.416 1.00 0.00 H new ATOM 0 HB1 ALA A 36 106.822 -16.822 -11.598 1.00 0.00 H new ATOM 0 HB2 ALA A 36 107.510 -17.558 -13.065 1.00 0.00 H new ATOM 0 HB3 ALA A 36 107.876 -15.863 -12.664 1.00 0.00 H new ATOM 523 N GLU A 37 105.128 -14.951 -11.490 1.00 0.00 N ATOM 524 CA GLU A 37 104.576 -13.800 -10.784 1.00 0.00 C ATOM 525 C GLU A 37 103.315 -13.301 -11.481 1.00 0.00 C ATOM 526 O GLU A 37 102.986 -12.116 -11.419 1.00 0.00 O ATOM 527 CB GLU A 37 105.612 -12.675 -10.730 1.00 0.00 C ATOM 528 CG GLU A 37 106.799 -13.109 -9.868 1.00 0.00 C ATOM 529 CD GLU A 37 106.372 -13.221 -8.408 1.00 0.00 C ATOM 530 OE1 GLU A 37 105.380 -12.605 -8.053 1.00 0.00 O ATOM 531 OE2 GLU A 37 107.043 -13.919 -7.667 1.00 0.00 O ATOM 0 H GLU A 37 105.354 -15.748 -10.895 1.00 0.00 H new ATOM 0 HA GLU A 37 104.320 -14.106 -9.770 1.00 0.00 H new ATOM 0 HB2 GLU A 37 105.951 -12.431 -11.737 1.00 0.00 H new ATOM 0 HB3 GLU A 37 105.162 -11.772 -10.318 1.00 0.00 H new ATOM 0 HG2 GLU A 37 107.181 -14.068 -10.218 1.00 0.00 H new ATOM 0 HG3 GLU A 37 107.611 -12.388 -9.963 1.00 0.00 H new ATOM 538 N VAL A 38 102.613 -14.214 -12.145 1.00 0.00 N ATOM 539 CA VAL A 38 101.389 -13.859 -12.853 1.00 0.00 C ATOM 540 C VAL A 38 100.378 -13.237 -11.896 1.00 0.00 C ATOM 541 O VAL A 38 99.543 -12.426 -12.298 1.00 0.00 O ATOM 542 CB VAL A 38 100.784 -15.104 -13.503 1.00 0.00 C ATOM 543 CG1 VAL A 38 101.781 -15.700 -14.498 1.00 0.00 C ATOM 544 CG2 VAL A 38 100.467 -16.138 -12.420 1.00 0.00 C ATOM 0 H VAL A 38 102.869 -15.199 -12.207 1.00 0.00 H new ATOM 0 HA VAL A 38 101.635 -13.130 -13.625 1.00 0.00 H new ATOM 0 HB VAL A 38 99.869 -14.831 -14.028 1.00 0.00 H new ATOM 0 HG11 VAL A 38 101.348 -16.587 -14.960 1.00 0.00 H new ATOM 0 HG12 VAL A 38 102.010 -14.964 -15.269 1.00 0.00 H new ATOM 0 HG13 VAL A 38 102.697 -15.974 -13.975 1.00 0.00 H new ATOM 0 HG21 VAL A 38 100.036 -17.027 -12.881 1.00 0.00 H new ATOM 0 HG22 VAL A 38 101.384 -16.409 -11.897 1.00 0.00 H new ATOM 0 HG23 VAL A 38 99.756 -15.715 -11.710 1.00 0.00 H new ATOM 554 N LEU A 39 100.459 -13.623 -10.628 1.00 0.00 N ATOM 555 CA LEU A 39 99.545 -13.101 -9.618 1.00 0.00 C ATOM 556 C LEU A 39 99.477 -11.578 -9.693 1.00 0.00 C ATOM 557 O LEU A 39 98.414 -10.986 -9.509 1.00 0.00 O ATOM 558 CB LEU A 39 100.013 -13.540 -8.221 1.00 0.00 C ATOM 559 CG LEU A 39 98.972 -13.133 -7.137 1.00 0.00 C ATOM 560 CD1 LEU A 39 98.860 -14.236 -6.076 1.00 0.00 C ATOM 561 CD2 LEU A 39 99.402 -11.830 -6.444 1.00 0.00 C ATOM 0 H LEU A 39 101.144 -14.292 -10.276 1.00 0.00 H new ATOM 0 HA LEU A 39 98.548 -13.500 -9.806 1.00 0.00 H new ATOM 0 HB2 LEU A 39 100.159 -14.620 -8.204 1.00 0.00 H new ATOM 0 HB3 LEU A 39 100.977 -13.084 -7.995 1.00 0.00 H new ATOM 0 HG LEU A 39 98.010 -12.987 -7.627 1.00 0.00 H new ATOM 0 HD11 LEU A 39 98.130 -13.943 -5.322 1.00 0.00 H new ATOM 0 HD12 LEU A 39 98.540 -15.165 -6.549 1.00 0.00 H new ATOM 0 HD13 LEU A 39 99.830 -14.385 -5.603 1.00 0.00 H new ATOM 0 HD21 LEU A 39 98.664 -11.559 -5.689 1.00 0.00 H new ATOM 0 HD22 LEU A 39 100.372 -11.974 -5.968 1.00 0.00 H new ATOM 0 HD23 LEU A 39 99.475 -11.032 -7.183 1.00 0.00 H new ATOM 573 N GLY A 40 100.618 -10.950 -9.962 1.00 0.00 N ATOM 574 CA GLY A 40 100.673 -9.495 -10.056 1.00 0.00 C ATOM 575 C GLY A 40 99.837 -8.989 -11.228 1.00 0.00 C ATOM 576 O GLY A 40 99.042 -8.061 -11.080 1.00 0.00 O ATOM 0 H GLY A 40 101.509 -11.421 -10.117 1.00 0.00 H new ATOM 0 HA2 GLY A 40 100.309 -9.053 -9.128 1.00 0.00 H new ATOM 0 HA3 GLY A 40 101.708 -9.174 -10.178 1.00 0.00 H new ATOM 580 N ILE A 41 100.024 -9.604 -12.391 1.00 0.00 N ATOM 581 CA ILE A 41 99.285 -9.209 -13.587 1.00 0.00 C ATOM 582 C ILE A 41 97.782 -9.360 -13.361 1.00 0.00 C ATOM 583 O ILE A 41 96.988 -8.518 -13.783 1.00 0.00 O ATOM 584 CB ILE A 41 99.719 -10.074 -14.772 1.00 0.00 C ATOM 585 CG1 ILE A 41 101.185 -9.789 -15.101 1.00 0.00 C ATOM 586 CG2 ILE A 41 98.853 -9.747 -15.992 1.00 0.00 C ATOM 587 CD1 ILE A 41 101.718 -10.865 -16.047 1.00 0.00 C ATOM 0 H ILE A 41 100.677 -10.374 -12.532 1.00 0.00 H new ATOM 0 HA ILE A 41 99.502 -8.163 -13.802 1.00 0.00 H new ATOM 0 HB ILE A 41 99.600 -11.126 -14.513 1.00 0.00 H new ATOM 0 HG12 ILE A 41 101.280 -8.806 -15.562 1.00 0.00 H new ATOM 0 HG13 ILE A 41 101.776 -9.770 -14.186 1.00 0.00 H new ATOM 0 HG21 ILE A 41 99.164 -10.364 -16.835 1.00 0.00 H new ATOM 0 HG22 ILE A 41 97.807 -9.949 -15.761 1.00 0.00 H new ATOM 0 HG23 ILE A 41 98.971 -8.695 -16.250 1.00 0.00 H new ATOM 0 HD11 ILE A 41 102.763 -10.660 -16.280 1.00 0.00 H new ATOM 0 HD12 ILE A 41 101.638 -11.842 -15.569 1.00 0.00 H new ATOM 0 HD13 ILE A 41 101.134 -10.862 -16.967 1.00 0.00 H new ATOM 599 N ILE A 42 97.400 -10.441 -12.696 1.00 0.00 N ATOM 600 CA ILE A 42 95.993 -10.696 -12.420 1.00 0.00 C ATOM 601 C ILE A 42 95.441 -9.652 -11.451 1.00 0.00 C ATOM 602 O ILE A 42 94.287 -9.244 -11.558 1.00 0.00 O ATOM 603 CB ILE A 42 95.830 -12.099 -11.826 1.00 0.00 C ATOM 604 CG1 ILE A 42 96.192 -13.141 -12.888 1.00 0.00 C ATOM 605 CG2 ILE A 42 94.379 -12.309 -11.379 1.00 0.00 C ATOM 606 CD1 ILE A 42 96.367 -14.510 -12.225 1.00 0.00 C ATOM 0 H ILE A 42 98.039 -11.151 -12.340 1.00 0.00 H new ATOM 0 HA ILE A 42 95.434 -10.632 -13.354 1.00 0.00 H new ATOM 0 HB ILE A 42 96.489 -12.206 -10.964 1.00 0.00 H new ATOM 0 HG12 ILE A 42 95.410 -13.190 -13.646 1.00 0.00 H new ATOM 0 HG13 ILE A 42 97.111 -12.852 -13.397 1.00 0.00 H new ATOM 0 HG21 ILE A 42 94.269 -13.308 -10.958 1.00 0.00 H new ATOM 0 HG22 ILE A 42 94.120 -11.566 -10.624 1.00 0.00 H new ATOM 0 HG23 ILE A 42 93.715 -12.202 -12.237 1.00 0.00 H new ATOM 0 HD11 ILE A 42 96.625 -15.251 -12.982 1.00 0.00 H new ATOM 0 HD12 ILE A 42 97.164 -14.456 -11.484 1.00 0.00 H new ATOM 0 HD13 ILE A 42 95.437 -14.799 -11.736 1.00 0.00 H new ATOM 618 N SER A 43 96.271 -9.230 -10.504 1.00 0.00 N ATOM 619 CA SER A 43 95.846 -8.243 -9.517 1.00 0.00 C ATOM 620 C SER A 43 95.522 -6.900 -10.170 1.00 0.00 C ATOM 621 O SER A 43 94.451 -6.336 -9.945 1.00 0.00 O ATOM 622 CB SER A 43 96.948 -8.044 -8.476 1.00 0.00 C ATOM 623 OG SER A 43 97.063 -9.220 -7.686 1.00 0.00 O ATOM 0 H SER A 43 97.233 -9.552 -10.398 1.00 0.00 H new ATOM 0 HA SER A 43 94.942 -8.619 -9.039 1.00 0.00 H new ATOM 0 HB2 SER A 43 97.896 -7.829 -8.969 1.00 0.00 H new ATOM 0 HB3 SER A 43 96.716 -7.187 -7.843 1.00 0.00 H new ATOM 0 HG SER A 43 97.530 -9.913 -8.198 1.00 0.00 H new ATOM 629 N ILE A 44 96.451 -6.384 -10.968 1.00 0.00 N ATOM 630 CA ILE A 44 96.242 -5.097 -11.626 1.00 0.00 C ATOM 631 C ILE A 44 95.038 -5.153 -12.568 1.00 0.00 C ATOM 632 O ILE A 44 94.203 -4.244 -12.575 1.00 0.00 O ATOM 633 CB ILE A 44 97.504 -4.681 -12.394 1.00 0.00 C ATOM 634 CG1 ILE A 44 97.947 -5.822 -13.315 1.00 0.00 C ATOM 635 CG2 ILE A 44 98.630 -4.368 -11.402 1.00 0.00 C ATOM 636 CD1 ILE A 44 99.302 -5.493 -13.953 1.00 0.00 C ATOM 0 H ILE A 44 97.345 -6.829 -11.174 1.00 0.00 H new ATOM 0 HA ILE A 44 96.036 -4.351 -10.858 1.00 0.00 H new ATOM 0 HB ILE A 44 97.284 -3.795 -12.990 1.00 0.00 H new ATOM 0 HG12 ILE A 44 98.020 -6.750 -12.747 1.00 0.00 H new ATOM 0 HG13 ILE A 44 97.200 -5.982 -14.093 1.00 0.00 H new ATOM 0 HG21 ILE A 44 99.525 -4.073 -11.949 1.00 0.00 H new ATOM 0 HG22 ILE A 44 98.321 -3.554 -10.746 1.00 0.00 H new ATOM 0 HG23 ILE A 44 98.845 -5.254 -10.805 1.00 0.00 H new ATOM 0 HD11 ILE A 44 99.606 -6.312 -14.605 1.00 0.00 H new ATOM 0 HD12 ILE A 44 99.216 -4.577 -14.537 1.00 0.00 H new ATOM 0 HD13 ILE A 44 100.049 -5.356 -13.171 1.00 0.00 H new ATOM 648 N VAL A 45 94.937 -6.223 -13.353 1.00 0.00 N ATOM 649 CA VAL A 45 93.814 -6.361 -14.274 1.00 0.00 C ATOM 650 C VAL A 45 92.498 -6.303 -13.499 1.00 0.00 C ATOM 651 O VAL A 45 91.540 -5.650 -13.921 1.00 0.00 O ATOM 652 CB VAL A 45 93.917 -7.691 -15.036 1.00 0.00 C ATOM 653 CG1 VAL A 45 92.616 -7.965 -15.797 1.00 0.00 C ATOM 654 CG2 VAL A 45 95.074 -7.616 -16.036 1.00 0.00 C ATOM 0 H VAL A 45 95.606 -6.993 -13.371 1.00 0.00 H new ATOM 0 HA VAL A 45 93.841 -5.541 -14.992 1.00 0.00 H new ATOM 0 HB VAL A 45 94.093 -8.495 -14.321 1.00 0.00 H new ATOM 0 HG11 VAL A 45 92.700 -8.910 -16.333 1.00 0.00 H new ATOM 0 HG12 VAL A 45 91.787 -8.021 -15.092 1.00 0.00 H new ATOM 0 HG13 VAL A 45 92.434 -7.159 -16.508 1.00 0.00 H new ATOM 0 HG21 VAL A 45 95.149 -8.559 -16.578 1.00 0.00 H new ATOM 0 HG22 VAL A 45 94.893 -6.805 -16.742 1.00 0.00 H new ATOM 0 HG23 VAL A 45 96.006 -7.430 -15.501 1.00 0.00 H new ATOM 664 N LEU A 46 92.458 -6.996 -12.366 1.00 0.00 N ATOM 665 CA LEU A 46 91.258 -7.028 -11.539 1.00 0.00 C ATOM 666 C LEU A 46 90.956 -5.651 -10.950 1.00 0.00 C ATOM 667 O LEU A 46 89.793 -5.307 -10.755 1.00 0.00 O ATOM 668 CB LEU A 46 91.424 -8.048 -10.407 1.00 0.00 C ATOM 669 CG LEU A 46 91.335 -9.479 -10.964 1.00 0.00 C ATOM 670 CD1 LEU A 46 91.795 -10.467 -9.886 1.00 0.00 C ATOM 671 CD2 LEU A 46 89.886 -9.814 -11.387 1.00 0.00 C ATOM 0 H LEU A 46 93.239 -7.541 -12.001 1.00 0.00 H new ATOM 0 HA LEU A 46 90.422 -7.322 -12.173 1.00 0.00 H new ATOM 0 HB2 LEU A 46 92.385 -7.901 -9.913 1.00 0.00 H new ATOM 0 HB3 LEU A 46 90.652 -7.895 -9.653 1.00 0.00 H new ATOM 0 HG LEU A 46 91.977 -9.556 -11.842 1.00 0.00 H new ATOM 0 HD11 LEU A 46 91.734 -11.484 -10.274 1.00 0.00 H new ATOM 0 HD12 LEU A 46 92.825 -10.246 -9.606 1.00 0.00 H new ATOM 0 HD13 LEU A 46 91.153 -10.374 -9.010 1.00 0.00 H new ATOM 0 HD21 LEU A 46 89.847 -10.831 -11.778 1.00 0.00 H new ATOM 0 HD22 LEU A 46 89.227 -9.732 -10.523 1.00 0.00 H new ATOM 0 HD23 LEU A 46 89.562 -9.116 -12.159 1.00 0.00 H new ATOM 683 N VAL A 47 91.995 -4.866 -10.671 1.00 0.00 N ATOM 684 CA VAL A 47 91.786 -3.537 -10.108 1.00 0.00 C ATOM 685 C VAL A 47 91.107 -2.643 -11.141 1.00 0.00 C ATOM 686 O VAL A 47 90.280 -1.798 -10.802 1.00 0.00 O ATOM 687 CB VAL A 47 93.125 -2.926 -9.669 1.00 0.00 C ATOM 688 CG1 VAL A 47 92.944 -1.437 -9.350 1.00 0.00 C ATOM 689 CG2 VAL A 47 93.622 -3.650 -8.413 1.00 0.00 C ATOM 0 H VAL A 47 92.971 -5.121 -10.822 1.00 0.00 H new ATOM 0 HA VAL A 47 91.143 -3.619 -9.231 1.00 0.00 H new ATOM 0 HB VAL A 47 93.849 -3.036 -10.476 1.00 0.00 H new ATOM 0 HG11 VAL A 47 93.899 -1.013 -9.040 1.00 0.00 H new ATOM 0 HG12 VAL A 47 92.587 -0.915 -10.238 1.00 0.00 H new ATOM 0 HG13 VAL A 47 92.218 -1.323 -8.545 1.00 0.00 H new ATOM 0 HG21 VAL A 47 94.572 -3.220 -8.097 1.00 0.00 H new ATOM 0 HG22 VAL A 47 92.889 -3.537 -7.614 1.00 0.00 H new ATOM 0 HG23 VAL A 47 93.758 -4.709 -8.633 1.00 0.00 H new ATOM 699 N ALA A 48 91.465 -2.836 -12.403 1.00 0.00 N ATOM 700 CA ALA A 48 90.886 -2.041 -13.477 1.00 0.00 C ATOM 701 C ALA A 48 89.418 -2.397 -13.700 1.00 0.00 C ATOM 702 O ALA A 48 88.564 -1.514 -13.783 1.00 0.00 O ATOM 703 CB ALA A 48 91.680 -2.263 -14.769 1.00 0.00 C ATOM 0 H ALA A 48 92.148 -3.530 -12.707 1.00 0.00 H new ATOM 0 HA ALA A 48 90.938 -0.990 -13.191 1.00 0.00 H new ATOM 0 HB1 ALA A 48 91.244 -1.667 -15.571 1.00 0.00 H new ATOM 0 HB2 ALA A 48 92.716 -1.962 -14.615 1.00 0.00 H new ATOM 0 HB3 ALA A 48 91.645 -3.318 -15.041 1.00 0.00 H new ATOM 709 N THR A 49 89.132 -3.686 -13.809 1.00 0.00 N ATOM 710 CA THR A 49 87.763 -4.132 -14.038 1.00 0.00 C ATOM 711 C THR A 49 86.828 -3.667 -12.922 1.00 0.00 C ATOM 712 O THR A 49 85.744 -3.146 -13.189 1.00 0.00 O ATOM 713 CB THR A 49 87.722 -5.658 -14.132 1.00 0.00 C ATOM 714 OG1 THR A 49 88.378 -6.217 -13.002 1.00 0.00 O ATOM 715 CG2 THR A 49 88.427 -6.109 -15.411 1.00 0.00 C ATOM 0 H THR A 49 89.821 -4.436 -13.744 1.00 0.00 H new ATOM 0 HA THR A 49 87.422 -3.692 -14.975 1.00 0.00 H new ATOM 0 HB THR A 49 86.686 -5.996 -14.154 1.00 0.00 H new ATOM 0 HG1 THR A 49 88.352 -7.195 -13.059 1.00 0.00 H new ATOM 0 HG21 THR A 49 88.398 -7.197 -15.478 1.00 0.00 H new ATOM 0 HG22 THR A 49 87.922 -5.678 -16.276 1.00 0.00 H new ATOM 0 HG23 THR A 49 89.464 -5.774 -15.392 1.00 0.00 H new ATOM 723 N VAL A 50 87.240 -3.875 -11.676 1.00 0.00 N ATOM 724 CA VAL A 50 86.413 -3.487 -10.536 1.00 0.00 C ATOM 725 C VAL A 50 86.358 -1.971 -10.372 1.00 0.00 C ATOM 726 O VAL A 50 85.375 -1.440 -9.861 1.00 0.00 O ATOM 727 CB VAL A 50 86.947 -4.119 -9.245 1.00 0.00 C ATOM 728 CG1 VAL A 50 87.077 -5.635 -9.423 1.00 0.00 C ATOM 729 CG2 VAL A 50 88.313 -3.512 -8.904 1.00 0.00 C ATOM 0 H VAL A 50 88.131 -4.305 -11.430 1.00 0.00 H new ATOM 0 HA VAL A 50 85.404 -3.850 -10.730 1.00 0.00 H new ATOM 0 HB VAL A 50 86.252 -3.918 -8.430 1.00 0.00 H new ATOM 0 HG11 VAL A 50 87.457 -6.078 -8.502 1.00 0.00 H new ATOM 0 HG12 VAL A 50 86.100 -6.059 -9.654 1.00 0.00 H new ATOM 0 HG13 VAL A 50 87.767 -5.848 -10.240 1.00 0.00 H new ATOM 0 HG21 VAL A 50 88.692 -3.962 -7.986 1.00 0.00 H new ATOM 0 HG22 VAL A 50 89.011 -3.706 -9.718 1.00 0.00 H new ATOM 0 HG23 VAL A 50 88.208 -2.436 -8.765 1.00 0.00 H new ATOM 739 N LEU A 51 87.408 -1.268 -10.788 1.00 0.00 N ATOM 740 CA LEU A 51 87.418 0.183 -10.649 1.00 0.00 C ATOM 741 C LEU A 51 86.373 0.821 -11.550 1.00 0.00 C ATOM 742 O LEU A 51 85.544 1.599 -11.087 1.00 0.00 O ATOM 743 CB LEU A 51 88.812 0.732 -10.983 1.00 0.00 C ATOM 744 CG LEU A 51 88.810 2.287 -10.951 1.00 0.00 C ATOM 745 CD1 LEU A 51 90.093 2.803 -10.288 1.00 0.00 C ATOM 746 CD2 LEU A 51 88.735 2.852 -12.379 1.00 0.00 C ATOM 0 H LEU A 51 88.244 -1.668 -11.214 1.00 0.00 H new ATOM 0 HA LEU A 51 87.174 0.432 -9.616 1.00 0.00 H new ATOM 0 HB2 LEU A 51 89.540 0.349 -10.268 1.00 0.00 H new ATOM 0 HB3 LEU A 51 89.119 0.384 -11.969 1.00 0.00 H new ATOM 0 HG LEU A 51 87.940 2.613 -10.381 1.00 0.00 H new ATOM 0 HD11 LEU A 51 90.081 3.893 -10.271 1.00 0.00 H new ATOM 0 HD12 LEU A 51 90.153 2.425 -9.267 1.00 0.00 H new ATOM 0 HD13 LEU A 51 90.959 2.459 -10.854 1.00 0.00 H new ATOM 0 HD21 LEU A 51 88.734 3.941 -12.340 1.00 0.00 H new ATOM 0 HD22 LEU A 51 89.597 2.510 -12.951 1.00 0.00 H new ATOM 0 HD23 LEU A 51 87.820 2.506 -12.860 1.00 0.00 H new ATOM 758 N LYS A 52 86.411 0.490 -12.832 1.00 0.00 N ATOM 759 CA LYS A 52 85.451 1.048 -13.777 1.00 0.00 C ATOM 760 C LYS A 52 84.039 0.571 -13.454 1.00 0.00 C ATOM 761 O LYS A 52 83.094 1.351 -13.469 1.00 0.00 O ATOM 762 CB LYS A 52 85.812 0.624 -15.202 1.00 0.00 C ATOM 763 CG LYS A 52 87.262 1.014 -15.506 1.00 0.00 C ATOM 764 CD LYS A 52 87.602 0.654 -16.959 1.00 0.00 C ATOM 765 CE LYS A 52 89.123 0.564 -17.133 1.00 0.00 C ATOM 766 NZ LYS A 52 89.596 -0.766 -16.655 1.00 0.00 N ATOM 0 H LYS A 52 87.088 -0.155 -13.240 1.00 0.00 H new ATOM 0 HA LYS A 52 85.486 2.134 -13.697 1.00 0.00 H new ATOM 0 HB2 LYS A 52 85.684 -0.453 -15.315 1.00 0.00 H new ATOM 0 HB3 LYS A 52 85.140 1.102 -15.915 1.00 0.00 H new ATOM 0 HG2 LYS A 52 87.403 2.083 -15.344 1.00 0.00 H new ATOM 0 HG3 LYS A 52 87.938 0.496 -14.825 1.00 0.00 H new ATOM 0 HD2 LYS A 52 87.140 -0.297 -17.225 1.00 0.00 H new ATOM 0 HD3 LYS A 52 87.194 1.406 -17.634 1.00 0.00 H new ATOM 0 HE2 LYS A 52 89.389 0.702 -18.181 1.00 0.00 H new ATOM 0 HE3 LYS A 52 89.612 1.360 -16.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 90.442 -1.047 -17.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 89.831 -0.708 -15.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 88.846 -1.472 -16.796 1.00 0.00 H new ATOM 780 N THR A 53 83.899 -0.717 -13.180 1.00 0.00 N ATOM 781 CA THR A 53 82.590 -1.283 -12.882 1.00 0.00 C ATOM 782 C THR A 53 81.974 -0.693 -11.610 1.00 0.00 C ATOM 783 O THR A 53 80.777 -0.427 -11.565 1.00 0.00 O ATOM 784 CB THR A 53 82.710 -2.801 -12.729 1.00 0.00 C ATOM 785 OG1 THR A 53 83.383 -3.337 -13.860 1.00 0.00 O ATOM 786 CG2 THR A 53 81.315 -3.419 -12.622 1.00 0.00 C ATOM 0 H THR A 53 84.668 -1.386 -13.157 1.00 0.00 H new ATOM 0 HA THR A 53 81.932 -1.033 -13.714 1.00 0.00 H new ATOM 0 HB THR A 53 83.275 -3.031 -11.826 1.00 0.00 H new ATOM 0 HG1 THR A 53 84.325 -3.490 -13.638 1.00 0.00 H new ATOM 0 HG21 THR A 53 81.403 -4.500 -12.513 1.00 0.00 H new ATOM 0 HG22 THR A 53 80.800 -3.008 -11.754 1.00 0.00 H new ATOM 0 HG23 THR A 53 80.746 -3.190 -13.523 1.00 0.00 H new ATOM 794 N ILE A 54 82.774 -0.526 -10.562 1.00 0.00 N ATOM 795 CA ILE A 54 82.244 -0.011 -9.299 1.00 0.00 C ATOM 796 C ILE A 54 81.969 1.490 -9.329 1.00 0.00 C ATOM 797 O ILE A 54 80.967 1.940 -8.790 1.00 0.00 O ATOM 798 CB ILE A 54 83.204 -0.348 -8.152 1.00 0.00 C ATOM 799 CG1 ILE A 54 83.273 -1.869 -7.981 1.00 0.00 C ATOM 800 CG2 ILE A 54 82.704 0.282 -6.849 1.00 0.00 C ATOM 801 CD1 ILE A 54 84.451 -2.228 -7.074 1.00 0.00 C ATOM 0 H ILE A 54 83.773 -0.734 -10.557 1.00 0.00 H new ATOM 0 HA ILE A 54 81.283 -0.500 -9.139 1.00 0.00 H new ATOM 0 HB ILE A 54 84.193 0.046 -8.386 1.00 0.00 H new ATOM 0 HG12 ILE A 54 82.343 -2.240 -7.550 1.00 0.00 H new ATOM 0 HG13 ILE A 54 83.389 -2.350 -8.952 1.00 0.00 H new ATOM 0 HG21 ILE A 54 83.392 0.038 -6.039 1.00 0.00 H new ATOM 0 HG22 ILE A 54 82.650 1.364 -6.965 1.00 0.00 H new ATOM 0 HG23 ILE A 54 81.713 -0.107 -6.613 1.00 0.00 H new ATOM 0 HD11 ILE A 54 84.500 -3.310 -6.952 1.00 0.00 H new ATOM 0 HD12 ILE A 54 85.378 -1.871 -7.523 1.00 0.00 H new ATOM 0 HD13 ILE A 54 84.316 -1.759 -6.099 1.00 0.00 H new ATOM 813 N VAL A 55 82.857 2.271 -9.914 1.00 0.00 N ATOM 814 CA VAL A 55 82.648 3.718 -9.950 1.00 0.00 C ATOM 815 C VAL A 55 81.605 4.103 -11.001 1.00 0.00 C ATOM 816 O VAL A 55 80.948 5.135 -10.885 1.00 0.00 O ATOM 817 CB VAL A 55 83.969 4.440 -10.247 1.00 0.00 C ATOM 818 CG1 VAL A 55 85.036 3.978 -9.246 1.00 0.00 C ATOM 819 CG2 VAL A 55 84.428 4.136 -11.690 1.00 0.00 C ATOM 0 H VAL A 55 83.713 1.945 -10.363 1.00 0.00 H new ATOM 0 HA VAL A 55 82.280 4.024 -8.971 1.00 0.00 H new ATOM 0 HB VAL A 55 83.823 5.516 -10.149 1.00 0.00 H new ATOM 0 HG11 VAL A 55 85.976 4.489 -9.454 1.00 0.00 H new ATOM 0 HG12 VAL A 55 84.711 4.215 -8.233 1.00 0.00 H new ATOM 0 HG13 VAL A 55 85.180 2.902 -9.339 1.00 0.00 H new ATOM 0 HG21 VAL A 55 85.366 4.653 -11.890 1.00 0.00 H new ATOM 0 HG22 VAL A 55 84.574 3.062 -11.807 1.00 0.00 H new ATOM 0 HG23 VAL A 55 83.668 4.478 -12.393 1.00 0.00 H new ATOM 829 N LEU A 56 81.494 3.297 -12.051 1.00 0.00 N ATOM 830 CA LEU A 56 80.569 3.584 -13.146 1.00 0.00 C ATOM 831 C LEU A 56 79.127 3.099 -12.913 1.00 0.00 C ATOM 832 O LEU A 56 78.186 3.830 -13.202 1.00 0.00 O ATOM 833 CB LEU A 56 81.114 2.944 -14.424 1.00 0.00 C ATOM 834 CG LEU A 56 80.378 3.493 -15.667 1.00 0.00 C ATOM 835 CD1 LEU A 56 81.072 4.768 -16.166 1.00 0.00 C ATOM 836 CD2 LEU A 56 80.403 2.443 -16.786 1.00 0.00 C ATOM 0 H LEU A 56 82.032 2.439 -12.169 1.00 0.00 H new ATOM 0 HA LEU A 56 80.508 4.670 -13.222 1.00 0.00 H new ATOM 0 HB2 LEU A 56 82.182 3.144 -14.510 1.00 0.00 H new ATOM 0 HB3 LEU A 56 80.995 1.862 -14.374 1.00 0.00 H new ATOM 0 HG LEU A 56 79.348 3.721 -15.394 1.00 0.00 H new ATOM 0 HD11 LEU A 56 80.547 5.149 -17.042 1.00 0.00 H new ATOM 0 HD12 LEU A 56 81.058 5.522 -15.379 1.00 0.00 H new ATOM 0 HD13 LEU A 56 82.104 4.540 -16.432 1.00 0.00 H new ATOM 0 HD21 LEU A 56 79.883 2.832 -17.662 1.00 0.00 H new ATOM 0 HD22 LEU A 56 81.436 2.215 -17.048 1.00 0.00 H new ATOM 0 HD23 LEU A 56 79.907 1.535 -16.444 1.00 0.00 H new ATOM 848 N ILE A 57 78.937 1.856 -12.466 1.00 0.00 N ATOM 849 CA ILE A 57 77.569 1.329 -12.321 1.00 0.00 C ATOM 850 C ILE A 57 76.709 2.104 -11.307 1.00 0.00 C ATOM 851 O ILE A 57 75.654 2.619 -11.677 1.00 0.00 O ATOM 852 CB ILE A 57 77.615 -0.186 -11.982 1.00 0.00 C ATOM 853 CG1 ILE A 57 77.767 -1.023 -13.270 1.00 0.00 C ATOM 854 CG2 ILE A 57 76.322 -0.638 -11.280 1.00 0.00 C ATOM 855 CD1 ILE A 57 78.872 -0.459 -14.171 1.00 0.00 C ATOM 0 H ILE A 57 79.682 1.210 -12.205 1.00 0.00 H new ATOM 0 HA ILE A 57 77.076 1.470 -13.283 1.00 0.00 H new ATOM 0 HB ILE A 57 78.468 -0.340 -11.322 1.00 0.00 H new ATOM 0 HG12 ILE A 57 77.998 -2.056 -13.010 1.00 0.00 H new ATOM 0 HG13 ILE A 57 76.822 -1.034 -13.813 1.00 0.00 H new ATOM 0 HG21 ILE A 57 76.383 -1.703 -11.055 1.00 0.00 H new ATOM 0 HG22 ILE A 57 76.196 -0.078 -10.353 1.00 0.00 H new ATOM 0 HG23 ILE A 57 75.470 -0.454 -11.934 1.00 0.00 H new ATOM 0 HD11 ILE A 57 78.955 -1.070 -15.070 1.00 0.00 H new ATOM 0 HD12 ILE A 57 78.627 0.566 -14.450 1.00 0.00 H new ATOM 0 HD13 ILE A 57 79.821 -0.472 -13.635 1.00 0.00 H new ATOM 867 N PRO A 58 77.092 2.192 -10.064 1.00 0.00 N ATOM 868 CA PRO A 58 76.271 2.911 -9.047 1.00 0.00 C ATOM 869 C PRO A 58 75.905 4.320 -9.501 1.00 0.00 C ATOM 870 O PRO A 58 74.876 4.862 -9.097 1.00 0.00 O ATOM 871 CB PRO A 58 77.150 2.915 -7.777 1.00 0.00 C ATOM 872 CG PRO A 58 78.518 2.505 -8.233 1.00 0.00 C ATOM 873 CD PRO A 58 78.316 1.642 -9.480 1.00 0.00 C ATOM 0 HA PRO A 58 75.310 2.425 -8.875 1.00 0.00 H new ATOM 0 HB2 PRO A 58 77.170 3.903 -7.317 1.00 0.00 H new ATOM 0 HB3 PRO A 58 76.762 2.223 -7.029 1.00 0.00 H new ATOM 0 HG2 PRO A 58 79.130 3.378 -8.460 1.00 0.00 H new ATOM 0 HG3 PRO A 58 79.036 1.946 -7.454 1.00 0.00 H new ATOM 0 HD2 PRO A 58 79.160 1.718 -10.165 1.00 0.00 H new ATOM 0 HD3 PRO A 58 78.205 0.587 -9.228 1.00 0.00 H new ATOM 881 N PHE A 59 76.744 4.907 -10.347 1.00 0.00 N ATOM 882 CA PHE A 59 76.496 6.239 -10.851 1.00 0.00 C ATOM 883 C PHE A 59 75.680 6.167 -12.146 1.00 0.00 C ATOM 884 O PHE A 59 74.529 6.604 -12.175 1.00 0.00 O ATOM 885 CB PHE A 59 77.837 6.953 -11.075 1.00 0.00 C ATOM 886 CG PHE A 59 78.312 7.569 -9.771 1.00 0.00 C ATOM 887 CD1 PHE A 59 77.871 8.845 -9.397 1.00 0.00 C ATOM 888 CD2 PHE A 59 79.189 6.863 -8.937 1.00 0.00 C ATOM 889 CE1 PHE A 59 78.308 9.414 -8.195 1.00 0.00 C ATOM 890 CE2 PHE A 59 79.625 7.433 -7.734 1.00 0.00 C ATOM 891 CZ PHE A 59 79.185 8.708 -7.364 1.00 0.00 C ATOM 0 H PHE A 59 77.600 4.475 -10.694 1.00 0.00 H new ATOM 0 HA PHE A 59 75.917 6.809 -10.124 1.00 0.00 H new ATOM 0 HB2 PHE A 59 78.579 6.246 -11.446 1.00 0.00 H new ATOM 0 HB3 PHE A 59 77.726 7.727 -11.835 1.00 0.00 H new ATOM 0 HD1 PHE A 59 77.193 9.390 -10.037 1.00 0.00 H new ATOM 0 HD2 PHE A 59 79.529 5.878 -9.222 1.00 0.00 H new ATOM 0 HE1 PHE A 59 77.968 10.398 -7.909 1.00 0.00 H new ATOM 0 HE2 PHE A 59 80.301 6.888 -7.092 1.00 0.00 H new ATOM 0 HZ PHE A 59 79.522 9.148 -6.437 1.00 0.00 H new ATOM 901 N LEU A 60 76.258 5.610 -13.213 1.00 0.00 N ATOM 902 CA LEU A 60 75.523 5.502 -14.470 1.00 0.00 C ATOM 903 C LEU A 60 74.252 4.673 -14.272 1.00 0.00 C ATOM 904 O LEU A 60 73.338 4.726 -15.094 1.00 0.00 O ATOM 905 CB LEU A 60 76.393 4.851 -15.558 1.00 0.00 C ATOM 906 CG LEU A 60 77.395 5.869 -16.136 1.00 0.00 C ATOM 907 CD1 LEU A 60 76.678 6.895 -17.035 1.00 0.00 C ATOM 908 CD2 LEU A 60 78.113 6.599 -14.994 1.00 0.00 C ATOM 0 H LEU A 60 77.207 5.237 -13.232 1.00 0.00 H new ATOM 0 HA LEU A 60 75.253 6.509 -14.789 1.00 0.00 H new ATOM 0 HB2 LEU A 60 76.931 4.001 -15.140 1.00 0.00 H new ATOM 0 HB3 LEU A 60 75.758 4.465 -16.356 1.00 0.00 H new ATOM 0 HG LEU A 60 78.124 5.328 -16.740 1.00 0.00 H new ATOM 0 HD11 LEU A 60 77.406 7.603 -17.431 1.00 0.00 H new ATOM 0 HD12 LEU A 60 76.189 6.377 -17.860 1.00 0.00 H new ATOM 0 HD13 LEU A 60 75.931 7.432 -16.450 1.00 0.00 H new ATOM 0 HD21 LEU A 60 78.820 7.317 -15.409 1.00 0.00 H new ATOM 0 HD22 LEU A 60 77.381 7.124 -14.380 1.00 0.00 H new ATOM 0 HD23 LEU A 60 78.649 5.875 -14.380 1.00 0.00 H new ATOM 920 N GLU A 61 74.194 3.904 -13.178 1.00 0.00 N ATOM 921 CA GLU A 61 73.020 3.070 -12.899 1.00 0.00 C ATOM 922 C GLU A 61 72.702 3.067 -11.407 1.00 0.00 C ATOM 923 O GLU A 61 73.598 3.180 -10.569 1.00 0.00 O ATOM 924 CB GLU A 61 73.271 1.632 -13.370 1.00 0.00 C ATOM 925 CG GLU A 61 73.210 1.567 -14.899 1.00 0.00 C ATOM 926 CD GLU A 61 71.778 1.785 -15.377 1.00 0.00 C ATOM 927 OE1 GLU A 61 70.872 1.575 -14.587 1.00 0.00 O ATOM 928 OE2 GLU A 61 71.609 2.161 -16.526 1.00 0.00 O ATOM 0 H GLU A 61 74.936 3.842 -12.480 1.00 0.00 H new ATOM 0 HA GLU A 61 72.170 3.487 -13.440 1.00 0.00 H new ATOM 0 HB2 GLU A 61 74.246 1.291 -13.021 1.00 0.00 H new ATOM 0 HB3 GLU A 61 72.526 0.963 -12.939 1.00 0.00 H new ATOM 0 HG2 GLU A 61 73.864 2.325 -15.329 1.00 0.00 H new ATOM 0 HG3 GLU A 61 73.573 0.599 -15.244 1.00 0.00 H new ATOM 935 N GLN A 62 71.419 2.935 -11.083 1.00 0.00 N ATOM 936 CA GLN A 62 70.985 2.916 -9.690 1.00 0.00 C ATOM 937 C GLN A 62 71.446 1.634 -9.003 1.00 0.00 C ATOM 938 O GLN A 62 71.754 1.632 -7.811 1.00 0.00 O ATOM 939 CB GLN A 62 69.460 3.013 -9.616 1.00 0.00 C ATOM 940 CG GLN A 62 69.012 4.402 -10.075 1.00 0.00 C ATOM 941 CD GLN A 62 69.423 5.449 -9.046 1.00 0.00 C ATOM 942 OE1 GLN A 62 69.147 5.293 -7.856 1.00 0.00 O ATOM 943 NE2 GLN A 62 70.070 6.515 -9.434 1.00 0.00 N ATOM 0 H GLN A 62 70.665 2.840 -11.763 1.00 0.00 H new ATOM 0 HA GLN A 62 71.429 3.771 -9.180 1.00 0.00 H new ATOM 0 HB2 GLN A 62 69.006 2.247 -10.245 1.00 0.00 H new ATOM 0 HB3 GLN A 62 69.123 2.830 -8.596 1.00 0.00 H new ATOM 0 HG2 GLN A 62 69.458 4.636 -11.042 1.00 0.00 H new ATOM 0 HG3 GLN A 62 67.931 4.418 -10.210 1.00 0.00 H new ATOM 0 HE21 GLN A 62 70.298 6.643 -10.420 1.00 0.00 H new ATOM 0 HE22 GLN A 62 70.348 7.220 -8.751 1.00 0.00 H new ATOM 952 N ASN A 63 71.490 0.545 -9.763 1.00 0.00 N ATOM 953 CA ASN A 63 71.914 -0.740 -9.218 1.00 0.00 C ATOM 954 C ASN A 63 73.315 -0.634 -8.627 1.00 0.00 C ATOM 955 CB ASN A 63 71.900 -1.804 -10.316 1.00 0.00 C ATOM 956 CG ASN A 63 72.043 -3.191 -9.699 1.00 0.00 C ATOM 957 OD1 ASN A 63 72.508 -3.322 -8.567 1.00 0.00 O ATOM 958 ND2 ASN A 63 71.669 -4.239 -10.379 1.00 0.00 N ATOM 0 H ASN A 63 71.239 0.526 -10.751 1.00 0.00 H new ATOM 0 HA ASN A 63 71.219 -1.026 -8.428 1.00 0.00 H new ATOM 0 HB2 ASN A 63 70.970 -1.743 -10.882 1.00 0.00 H new ATOM 0 HB3 ASN A 63 72.713 -1.624 -11.019 1.00 0.00 H new ATOM 0 HD21 ASN A 63 71.761 -5.170 -9.973 1.00 0.00 H new ATOM 0 HD22 ASN A 63 71.284 -4.128 -11.317 1.00 0.00 H new TER 965 ASN A 63 ATOM 966 N CYS B 1 73.238 21.811 -14.364 1.00 0.00 N ATOM 967 CA CYS B 1 72.113 20.945 -13.916 1.00 0.00 C ATOM 968 C CYS B 1 72.651 19.838 -13.017 1.00 0.00 C ATOM 969 O CYS B 1 72.154 18.712 -13.038 1.00 0.00 O ATOM 970 CB CYS B 1 71.424 20.336 -15.139 1.00 0.00 C ATOM 971 SG CYS B 1 70.649 21.650 -16.113 1.00 0.00 S ATOM 0 H1 CYS B 1 72.966 22.311 -15.234 1.00 0.00 H new ATOM 0 H2 CYS B 1 73.460 22.504 -13.621 1.00 0.00 H new ATOM 0 H3 CYS B 1 74.076 21.223 -14.550 1.00 0.00 H new ATOM 0 HA CYS B 1 71.391 21.540 -13.356 1.00 0.00 H new ATOM 0 HB2 CYS B 1 72.150 19.798 -15.748 1.00 0.00 H new ATOM 0 HB3 CYS B 1 70.673 19.612 -14.823 1.00 0.00 H new ATOM 975 N SER B 2 73.671 20.165 -12.229 1.00 0.00 N ATOM 976 CA SER B 2 74.273 19.191 -11.325 1.00 0.00 C ATOM 977 C SER B 2 74.822 18.001 -12.107 1.00 0.00 C ATOM 978 O SER B 2 76.032 17.875 -12.296 1.00 0.00 O ATOM 979 CB SER B 2 73.236 18.706 -10.312 1.00 0.00 C ATOM 980 OG SER B 2 73.894 18.006 -9.264 1.00 0.00 O ATOM 0 H SER B 2 74.096 21.092 -12.198 1.00 0.00 H new ATOM 0 HA SER B 2 75.095 19.674 -10.797 1.00 0.00 H new ATOM 0 HB2 SER B 2 72.682 19.553 -9.907 1.00 0.00 H new ATOM 0 HB3 SER B 2 72.511 18.055 -10.800 1.00 0.00 H new ATOM 0 HG SER B 2 73.232 17.695 -8.612 1.00 0.00 H new ATOM 986 N THR B 3 73.923 17.133 -12.562 1.00 0.00 N ATOM 987 CA THR B 3 74.328 15.959 -13.327 1.00 0.00 C ATOM 988 C THR B 3 75.507 15.260 -12.659 1.00 0.00 C ATOM 989 O THR B 3 75.874 15.579 -11.528 1.00 0.00 O ATOM 990 CB THR B 3 74.716 16.371 -14.748 1.00 0.00 C ATOM 991 OG1 THR B 3 75.951 17.072 -14.714 1.00 0.00 O ATOM 992 CG2 THR B 3 73.631 17.273 -15.336 1.00 0.00 C ATOM 0 H THR B 3 72.917 17.219 -12.416 1.00 0.00 H new ATOM 0 HA THR B 3 73.486 15.267 -13.365 1.00 0.00 H new ATOM 0 HB THR B 3 74.819 15.481 -15.369 1.00 0.00 H new ATOM 0 HG1 THR B 3 76.253 17.158 -13.786 1.00 0.00 H new ATOM 0 HG21 THR B 3 73.910 17.565 -16.348 1.00 0.00 H new ATOM 0 HG22 THR B 3 72.684 16.734 -15.362 1.00 0.00 H new ATOM 0 HG23 THR B 3 73.524 18.164 -14.718 1.00 0.00 H new ATOM 1000 N VAL B 4 76.098 14.304 -13.371 1.00 0.00 N ATOM 1001 CA VAL B 4 77.240 13.555 -12.850 1.00 0.00 C ATOM 1002 C VAL B 4 78.136 13.095 -13.995 1.00 0.00 C ATOM 1003 O VAL B 4 79.346 12.947 -13.829 1.00 0.00 O ATOM 1004 CB VAL B 4 76.752 12.341 -12.058 1.00 0.00 C ATOM 1005 CG1 VAL B 4 75.924 12.809 -10.859 1.00 0.00 C ATOM 1006 CG2 VAL B 4 75.885 11.460 -12.961 1.00 0.00 C ATOM 0 H VAL B 4 75.806 14.029 -14.309 1.00 0.00 H new ATOM 0 HA VAL B 4 77.813 14.207 -12.191 1.00 0.00 H new ATOM 0 HB VAL B 4 77.611 11.770 -11.705 1.00 0.00 H new ATOM 0 HG11 VAL B 4 75.577 11.943 -10.296 1.00 0.00 H new ATOM 0 HG12 VAL B 4 76.539 13.438 -10.215 1.00 0.00 H new ATOM 0 HG13 VAL B 4 75.065 13.381 -11.211 1.00 0.00 H new ATOM 0 HG21 VAL B 4 75.536 10.594 -12.398 1.00 0.00 H new ATOM 0 HG22 VAL B 4 75.027 12.033 -13.314 1.00 0.00 H new ATOM 0 HG23 VAL B 4 76.473 11.125 -13.815 1.00 0.00 H new ATOM 1016 N SER B 5 77.531 12.875 -15.159 1.00 0.00 N ATOM 1017 CA SER B 5 78.278 12.436 -16.334 1.00 0.00 C ATOM 1018 C SER B 5 79.611 13.188 -16.448 1.00 0.00 C ATOM 1019 O SER B 5 80.675 12.574 -16.376 1.00 0.00 O ATOM 1020 CB SER B 5 77.420 12.639 -17.600 1.00 0.00 C ATOM 1021 OG SER B 5 76.385 13.571 -17.313 1.00 0.00 O ATOM 0 H SER B 5 76.530 12.993 -15.314 1.00 0.00 H new ATOM 0 HA SER B 5 78.507 11.375 -16.230 1.00 0.00 H new ATOM 0 HB2 SER B 5 78.039 13.004 -18.420 1.00 0.00 H new ATOM 0 HB3 SER B 5 76.993 11.689 -17.922 1.00 0.00 H new ATOM 0 HG SER B 5 76.154 14.064 -18.128 1.00 0.00 H new ATOM 1027 N PRO B 6 79.584 14.491 -16.617 1.00 0.00 N ATOM 1028 CA PRO B 6 80.833 15.306 -16.733 1.00 0.00 C ATOM 1029 C PRO B 6 81.684 15.236 -15.461 1.00 0.00 C ATOM 1030 O PRO B 6 82.620 16.017 -15.289 1.00 0.00 O ATOM 1031 CB PRO B 6 80.320 16.737 -16.992 1.00 0.00 C ATOM 1032 CG PRO B 6 78.914 16.742 -16.483 1.00 0.00 C ATOM 1033 CD PRO B 6 78.379 15.333 -16.723 1.00 0.00 C ATOM 0 HA PRO B 6 81.489 14.945 -17.525 1.00 0.00 H new ATOM 0 HB2 PRO B 6 80.931 17.475 -16.472 1.00 0.00 H new ATOM 0 HB3 PRO B 6 80.356 16.983 -18.053 1.00 0.00 H new ATOM 0 HG2 PRO B 6 78.883 16.997 -15.424 1.00 0.00 H new ATOM 0 HG3 PRO B 6 78.311 17.484 -17.007 1.00 0.00 H new ATOM 0 HD2 PRO B 6 77.628 15.056 -15.983 1.00 0.00 H new ATOM 0 HD3 PRO B 6 77.910 15.242 -17.703 1.00 0.00 H new ATOM 1041 N GLY B 7 81.350 14.297 -14.572 1.00 0.00 N ATOM 1042 CA GLY B 7 82.084 14.130 -13.314 1.00 0.00 C ATOM 1043 C GLY B 7 82.584 12.698 -13.145 1.00 0.00 C ATOM 1044 O GLY B 7 83.788 12.456 -13.129 1.00 0.00 O ATOM 0 H GLY B 7 80.578 13.642 -14.699 1.00 0.00 H new ATOM 0 HA2 GLY B 7 82.930 14.817 -13.291 1.00 0.00 H new ATOM 0 HA3 GLY B 7 81.437 14.392 -12.477 1.00 0.00 H new ATOM 1048 N VAL B 8 81.660 11.753 -13.007 1.00 0.00 N ATOM 1049 CA VAL B 8 82.040 10.356 -12.828 1.00 0.00 C ATOM 1050 C VAL B 8 82.851 9.865 -14.027 1.00 0.00 C ATOM 1051 O VAL B 8 83.933 9.287 -13.872 1.00 0.00 O ATOM 1052 CB VAL B 8 80.786 9.490 -12.650 1.00 0.00 C ATOM 1053 CG1 VAL B 8 79.941 10.027 -11.484 1.00 0.00 C ATOM 1054 CG2 VAL B 8 79.958 9.512 -13.940 1.00 0.00 C ATOM 0 H VAL B 8 80.655 11.925 -13.015 1.00 0.00 H new ATOM 0 HA VAL B 8 82.658 10.275 -11.934 1.00 0.00 H new ATOM 0 HB VAL B 8 81.087 8.466 -12.431 1.00 0.00 H new ATOM 0 HG11 VAL B 8 79.052 9.408 -11.363 1.00 0.00 H new ATOM 0 HG12 VAL B 8 80.529 10.001 -10.566 1.00 0.00 H new ATOM 0 HG13 VAL B 8 79.642 11.054 -11.694 1.00 0.00 H new ATOM 0 HG21 VAL B 8 79.068 8.896 -13.811 1.00 0.00 H new ATOM 0 HG22 VAL B 8 79.661 10.537 -14.164 1.00 0.00 H new ATOM 0 HG23 VAL B 8 80.555 9.119 -14.763 1.00 0.00 H new ATOM 1064 N LEU B 9 82.339 10.113 -15.227 1.00 0.00 N ATOM 1065 CA LEU B 9 83.047 9.699 -16.429 1.00 0.00 C ATOM 1066 C LEU B 9 84.438 10.334 -16.419 1.00 0.00 C ATOM 1067 O LEU B 9 85.448 9.671 -16.690 1.00 0.00 O ATOM 1068 CB LEU B 9 82.255 10.104 -17.682 1.00 0.00 C ATOM 1069 CG LEU B 9 80.783 9.666 -17.532 1.00 0.00 C ATOM 1070 CD1 LEU B 9 79.957 10.215 -18.698 1.00 0.00 C ATOM 1071 CD2 LEU B 9 80.683 8.132 -17.522 1.00 0.00 C ATOM 0 H LEU B 9 81.452 10.590 -15.391 1.00 0.00 H new ATOM 0 HA LEU B 9 83.151 8.614 -16.448 1.00 0.00 H new ATOM 0 HB2 LEU B 9 82.310 11.183 -17.826 1.00 0.00 H new ATOM 0 HB3 LEU B 9 82.694 9.642 -18.566 1.00 0.00 H new ATOM 0 HG LEU B 9 80.397 10.058 -16.591 1.00 0.00 H new ATOM 0 HD11 LEU B 9 78.919 9.903 -18.587 1.00 0.00 H new ATOM 0 HD12 LEU B 9 80.010 11.304 -18.701 1.00 0.00 H new ATOM 0 HD13 LEU B 9 80.353 9.830 -19.638 1.00 0.00 H new ATOM 0 HD21 LEU B 9 79.639 7.836 -17.416 1.00 0.00 H new ATOM 0 HD22 LEU B 9 81.079 7.735 -18.457 1.00 0.00 H new ATOM 0 HD23 LEU B 9 81.260 7.735 -16.686 1.00 0.00 H new ATOM 1083 N ALA B 10 84.507 11.611 -16.041 1.00 0.00 N ATOM 1084 CA ALA B 10 85.798 12.273 -15.942 1.00 0.00 C ATOM 1085 C ALA B 10 86.678 11.436 -15.021 1.00 0.00 C ATOM 1086 O ALA B 10 87.881 11.264 -15.238 1.00 0.00 O ATOM 1087 CB ALA B 10 85.636 13.684 -15.368 1.00 0.00 C ATOM 0 H ALA B 10 83.703 12.192 -15.805 1.00 0.00 H new ATOM 0 HA ALA B 10 86.249 12.363 -16.930 1.00 0.00 H new ATOM 0 HB1 ALA B 10 86.612 14.164 -15.301 1.00 0.00 H new ATOM 0 HB2 ALA B 10 84.988 14.270 -16.020 1.00 0.00 H new ATOM 0 HB3 ALA B 10 85.193 13.624 -14.374 1.00 0.00 H new ATOM 1093 N GLY B 11 86.034 10.888 -13.998 1.00 0.00 N ATOM 1094 CA GLY B 11 86.716 10.042 -13.042 1.00 0.00 C ATOM 1095 C GLY B 11 87.230 8.784 -13.722 1.00 0.00 C ATOM 1096 O GLY B 11 88.232 8.210 -13.296 1.00 0.00 O ATOM 0 H GLY B 11 85.039 11.018 -13.814 1.00 0.00 H new ATOM 0 HA2 GLY B 11 87.547 10.586 -12.593 1.00 0.00 H new ATOM 0 HA3 GLY B 11 86.036 9.774 -12.233 1.00 0.00 H new ATOM 1100 N ILE B 12 86.549 8.346 -14.785 1.00 0.00 N ATOM 1101 CA ILE B 12 86.987 7.151 -15.482 1.00 0.00 C ATOM 1102 C ILE B 12 88.320 7.432 -16.185 1.00 0.00 C ATOM 1103 O ILE B 12 89.239 6.616 -16.118 1.00 0.00 O ATOM 1104 CB ILE B 12 85.879 6.659 -16.458 1.00 0.00 C ATOM 1105 CG1 ILE B 12 85.715 5.124 -16.359 1.00 0.00 C ATOM 1106 CG2 ILE B 12 86.209 7.027 -17.907 1.00 0.00 C ATOM 1107 CD1 ILE B 12 84.860 4.756 -15.141 1.00 0.00 C ATOM 0 H ILE B 12 85.715 8.792 -15.168 1.00 0.00 H new ATOM 0 HA ILE B 12 87.156 6.341 -14.772 1.00 0.00 H new ATOM 0 HB ILE B 12 84.950 7.152 -16.169 1.00 0.00 H new ATOM 0 HG12 ILE B 12 85.249 4.742 -17.267 1.00 0.00 H new ATOM 0 HG13 ILE B 12 86.694 4.651 -16.280 1.00 0.00 H new ATOM 0 HG21 ILE B 12 85.415 6.669 -18.563 1.00 0.00 H new ATOM 0 HG22 ILE B 12 86.294 8.110 -17.997 1.00 0.00 H new ATOM 0 HG23 ILE B 12 87.153 6.564 -18.194 1.00 0.00 H new ATOM 0 HD11 ILE B 12 84.754 3.673 -15.085 1.00 0.00 H new ATOM 0 HD12 ILE B 12 85.343 5.121 -14.234 1.00 0.00 H new ATOM 0 HD13 ILE B 12 83.875 5.213 -15.237 1.00 0.00 H new ATOM 1119 N VAL B 13 88.441 8.595 -16.840 1.00 0.00 N ATOM 1120 CA VAL B 13 89.710 8.912 -17.502 1.00 0.00 C ATOM 1121 C VAL B 13 90.822 8.907 -16.458 1.00 0.00 C ATOM 1122 O VAL B 13 91.908 8.379 -16.696 1.00 0.00 O ATOM 1123 CB VAL B 13 89.661 10.268 -18.266 1.00 0.00 C ATOM 1124 CG1 VAL B 13 88.221 10.611 -18.613 1.00 0.00 C ATOM 1125 CG2 VAL B 13 90.260 11.422 -17.438 1.00 0.00 C ATOM 0 H VAL B 13 87.711 9.302 -16.924 1.00 0.00 H new ATOM 0 HA VAL B 13 89.907 8.150 -18.257 1.00 0.00 H new ATOM 0 HB VAL B 13 90.257 10.151 -19.171 1.00 0.00 H new ATOM 0 HG11 VAL B 13 88.192 11.561 -19.147 1.00 0.00 H new ATOM 0 HG12 VAL B 13 87.802 9.827 -19.243 1.00 0.00 H new ATOM 0 HG13 VAL B 13 87.635 10.692 -17.697 1.00 0.00 H new ATOM 0 HG21 VAL B 13 90.204 12.348 -18.011 1.00 0.00 H new ATOM 0 HG22 VAL B 13 89.698 11.535 -16.511 1.00 0.00 H new ATOM 0 HG23 VAL B 13 91.302 11.201 -17.206 1.00 0.00 H new ATOM 1135 N VAL B 14 90.535 9.487 -15.292 1.00 0.00 N ATOM 1136 CA VAL B 14 91.523 9.523 -14.222 1.00 0.00 C ATOM 1137 C VAL B 14 91.971 8.103 -13.894 1.00 0.00 C ATOM 1138 O VAL B 14 93.167 7.825 -13.799 1.00 0.00 O ATOM 1139 CB VAL B 14 90.928 10.180 -12.973 1.00 0.00 C ATOM 1140 CG1 VAL B 14 91.924 10.080 -11.814 1.00 0.00 C ATOM 1141 CG2 VAL B 14 90.636 11.654 -13.265 1.00 0.00 C ATOM 0 H VAL B 14 89.643 9.929 -15.070 1.00 0.00 H new ATOM 0 HA VAL B 14 92.382 10.108 -14.551 1.00 0.00 H new ATOM 0 HB VAL B 14 90.004 9.669 -12.701 1.00 0.00 H new ATOM 0 HG11 VAL B 14 91.498 10.548 -10.927 1.00 0.00 H new ATOM 0 HG12 VAL B 14 92.135 9.031 -11.605 1.00 0.00 H new ATOM 0 HG13 VAL B 14 92.849 10.589 -12.084 1.00 0.00 H new ATOM 0 HG21 VAL B 14 90.212 12.124 -12.377 1.00 0.00 H new ATOM 0 HG22 VAL B 14 91.562 12.161 -13.537 1.00 0.00 H new ATOM 0 HG23 VAL B 14 89.926 11.728 -14.089 1.00 0.00 H new ATOM 1151 N GLY B 15 90.994 7.207 -13.741 1.00 0.00 N ATOM 1152 CA GLY B 15 91.279 5.807 -13.441 1.00 0.00 C ATOM 1153 C GLY B 15 92.169 5.196 -14.521 1.00 0.00 C ATOM 1154 O GLY B 15 92.987 4.317 -14.245 1.00 0.00 O ATOM 0 H GLY B 15 90.001 7.428 -13.820 1.00 0.00 H new ATOM 0 HA2 GLY B 15 91.770 5.730 -12.471 1.00 0.00 H new ATOM 0 HA3 GLY B 15 90.346 5.247 -13.371 1.00 0.00 H new ATOM 1158 N ASP B 16 92.005 5.670 -15.752 1.00 0.00 N ATOM 1159 CA ASP B 16 92.800 5.168 -16.868 1.00 0.00 C ATOM 1160 C ASP B 16 94.258 5.598 -16.728 1.00 0.00 C ATOM 1161 O ASP B 16 95.173 4.816 -16.984 1.00 0.00 O ATOM 1162 CB ASP B 16 92.238 5.697 -18.190 1.00 0.00 C ATOM 1163 CG ASP B 16 92.832 4.920 -19.360 1.00 0.00 C ATOM 1164 OD1 ASP B 16 93.433 3.886 -19.117 1.00 0.00 O ATOM 1165 OD2 ASP B 16 92.680 5.371 -20.484 1.00 0.00 O ATOM 0 H ASP B 16 91.334 6.396 -16.001 1.00 0.00 H new ATOM 0 HA ASP B 16 92.752 4.079 -16.860 1.00 0.00 H new ATOM 0 HB2 ASP B 16 91.152 5.604 -18.196 1.00 0.00 H new ATOM 0 HB3 ASP B 16 92.468 6.757 -18.293 1.00 0.00 H new ATOM 1170 N LEU B 17 94.465 6.848 -16.325 1.00 0.00 N ATOM 1171 CA LEU B 17 95.815 7.378 -16.158 1.00 0.00 C ATOM 1172 C LEU B 17 96.577 6.578 -15.102 1.00 0.00 C ATOM 1173 O LEU B 17 97.681 6.079 -15.353 1.00 0.00 O ATOM 1174 CB LEU B 17 95.725 8.853 -15.741 1.00 0.00 C ATOM 1175 CG LEU B 17 97.116 9.417 -15.418 1.00 0.00 C ATOM 1176 CD1 LEU B 17 98.060 9.206 -16.609 1.00 0.00 C ATOM 1177 CD2 LEU B 17 96.987 10.917 -15.126 1.00 0.00 C ATOM 0 H LEU B 17 93.720 7.510 -16.109 1.00 0.00 H new ATOM 0 HA LEU B 17 96.354 7.296 -17.102 1.00 0.00 H new ATOM 0 HB2 LEU B 17 95.270 9.435 -16.543 1.00 0.00 H new ATOM 0 HB3 LEU B 17 95.078 8.950 -14.869 1.00 0.00 H new ATOM 0 HG LEU B 17 97.525 8.901 -14.549 1.00 0.00 H new ATOM 0 HD11 LEU B 17 99.044 9.610 -16.369 1.00 0.00 H new ATOM 0 HD12 LEU B 17 98.147 8.140 -16.820 1.00 0.00 H new ATOM 0 HD13 LEU B 17 97.661 9.718 -17.485 1.00 0.00 H new ATOM 0 HD21 LEU B 17 97.970 11.329 -14.895 1.00 0.00 H new ATOM 0 HD22 LEU B 17 96.577 11.424 -16.000 1.00 0.00 H new ATOM 0 HD23 LEU B 17 96.322 11.066 -14.275 1.00 0.00 H new ATOM 1189 N VAL B 18 95.976 6.448 -13.925 1.00 0.00 N ATOM 1190 CA VAL B 18 96.600 5.698 -12.839 1.00 0.00 C ATOM 1191 C VAL B 18 96.866 4.261 -13.278 1.00 0.00 C ATOM 1192 O VAL B 18 97.910 3.692 -12.959 1.00 0.00 O ATOM 1193 CB VAL B 18 95.696 5.718 -11.599 1.00 0.00 C ATOM 1194 CG1 VAL B 18 94.290 5.305 -11.988 1.00 0.00 C ATOM 1195 CG2 VAL B 18 96.204 4.745 -10.540 1.00 0.00 C ATOM 0 H VAL B 18 95.065 6.848 -13.698 1.00 0.00 H new ATOM 0 HA VAL B 18 97.551 6.167 -12.586 1.00 0.00 H new ATOM 0 HB VAL B 18 95.702 6.730 -11.193 1.00 0.00 H new ATOM 0 HG11 VAL B 18 93.649 5.320 -11.106 1.00 0.00 H new ATOM 0 HG12 VAL B 18 93.899 5.999 -12.732 1.00 0.00 H new ATOM 0 HG13 VAL B 18 94.309 4.298 -12.406 1.00 0.00 H new ATOM 0 HG21 VAL B 18 95.547 4.777 -9.671 1.00 0.00 H new ATOM 0 HG22 VAL B 18 96.215 3.735 -10.949 1.00 0.00 H new ATOM 0 HG23 VAL B 18 97.214 5.027 -10.242 1.00 0.00 H new ATOM 1205 N LEU B 19 95.924 3.677 -14.016 1.00 0.00 N ATOM 1206 CA LEU B 19 96.099 2.308 -14.483 1.00 0.00 C ATOM 1207 C LEU B 19 97.335 2.221 -15.370 1.00 0.00 C ATOM 1208 O LEU B 19 98.211 1.397 -15.138 1.00 0.00 O ATOM 1209 CB LEU B 19 94.865 1.842 -15.276 1.00 0.00 C ATOM 1210 CG LEU B 19 93.738 1.403 -14.324 1.00 0.00 C ATOM 1211 CD1 LEU B 19 92.426 1.310 -15.119 1.00 0.00 C ATOM 1212 CD2 LEU B 19 94.054 0.026 -13.697 1.00 0.00 C ATOM 0 H LEU B 19 95.050 4.121 -14.298 1.00 0.00 H new ATOM 0 HA LEU B 19 96.223 1.660 -13.615 1.00 0.00 H new ATOM 0 HB2 LEU B 19 94.512 2.650 -15.916 1.00 0.00 H new ATOM 0 HB3 LEU B 19 95.139 1.014 -15.930 1.00 0.00 H new ATOM 0 HG LEU B 19 93.647 2.135 -13.522 1.00 0.00 H new ATOM 0 HD11 LEU B 19 91.619 1.000 -14.455 1.00 0.00 H new ATOM 0 HD12 LEU B 19 92.190 2.285 -15.546 1.00 0.00 H new ATOM 0 HD13 LEU B 19 92.537 0.580 -15.921 1.00 0.00 H new ATOM 0 HD21 LEU B 19 93.244 -0.264 -13.028 1.00 0.00 H new ATOM 0 HD22 LEU B 19 94.156 -0.718 -14.487 1.00 0.00 H new ATOM 0 HD23 LEU B 19 94.985 0.088 -13.134 1.00 0.00 H new ATOM 1224 N THR B 20 97.405 3.081 -16.380 1.00 0.00 N ATOM 1225 CA THR B 20 98.546 3.079 -17.286 1.00 0.00 C ATOM 1226 C THR B 20 99.847 3.031 -16.494 1.00 0.00 C ATOM 1227 O THR B 20 100.714 2.192 -16.751 1.00 0.00 O ATOM 1228 CB THR B 20 98.520 4.333 -18.162 1.00 0.00 C ATOM 1229 OG1 THR B 20 97.298 4.378 -18.886 1.00 0.00 O ATOM 1230 CG2 THR B 20 99.695 4.297 -19.140 1.00 0.00 C ATOM 0 H THR B 20 96.693 3.781 -16.590 1.00 0.00 H new ATOM 0 HA THR B 20 98.486 2.196 -17.922 1.00 0.00 H new ATOM 0 HB THR B 20 98.601 5.219 -17.533 1.00 0.00 H new ATOM 0 HG1 THR B 20 96.575 4.666 -18.290 1.00 0.00 H new ATOM 0 HG21 THR B 20 99.676 5.190 -19.764 1.00 0.00 H new ATOM 0 HG22 THR B 20 100.631 4.263 -18.583 1.00 0.00 H new ATOM 0 HG23 THR B 20 99.616 3.412 -19.771 1.00 0.00 H new ATOM 1238 N VAL B 21 99.973 3.925 -15.520 1.00 0.00 N ATOM 1239 CA VAL B 21 101.173 3.957 -14.694 1.00 0.00 C ATOM 1240 C VAL B 21 101.329 2.643 -13.929 1.00 0.00 C ATOM 1241 O VAL B 21 102.445 2.207 -13.645 1.00 0.00 O ATOM 1242 CB VAL B 21 101.096 5.123 -13.704 1.00 0.00 C ATOM 1243 CG1 VAL B 21 102.373 5.162 -12.861 1.00 0.00 C ATOM 1244 CG2 VAL B 21 100.957 6.436 -14.476 1.00 0.00 C ATOM 0 H VAL B 21 99.271 4.627 -15.285 1.00 0.00 H new ATOM 0 HA VAL B 21 102.038 4.092 -15.344 1.00 0.00 H new ATOM 0 HB VAL B 21 100.233 4.990 -13.051 1.00 0.00 H new ATOM 0 HG11 VAL B 21 102.319 5.992 -12.156 1.00 0.00 H new ATOM 0 HG12 VAL B 21 102.475 4.226 -12.312 1.00 0.00 H new ATOM 0 HG13 VAL B 21 103.236 5.296 -13.513 1.00 0.00 H new ATOM 0 HG21 VAL B 21 100.902 7.267 -13.773 1.00 0.00 H new ATOM 0 HG22 VAL B 21 101.821 6.568 -15.128 1.00 0.00 H new ATOM 0 HG23 VAL B 21 100.049 6.410 -15.078 1.00 0.00 H new ATOM 1254 N LEU B 22 100.200 2.021 -13.594 1.00 0.00 N ATOM 1255 CA LEU B 22 100.218 0.760 -12.852 1.00 0.00 C ATOM 1256 C LEU B 22 100.781 -0.379 -13.704 1.00 0.00 C ATOM 1257 O LEU B 22 101.643 -1.130 -13.251 1.00 0.00 O ATOM 1258 CB LEU B 22 98.798 0.412 -12.394 1.00 0.00 C ATOM 1259 CG LEU B 22 98.836 -0.642 -11.273 1.00 0.00 C ATOM 1260 CD1 LEU B 22 99.447 -0.051 -9.983 1.00 0.00 C ATOM 1261 CD2 LEU B 22 97.404 -1.121 -10.997 1.00 0.00 C ATOM 0 H LEU B 22 99.267 2.366 -13.822 1.00 0.00 H new ATOM 0 HA LEU B 22 100.866 0.885 -11.984 1.00 0.00 H new ATOM 0 HB2 LEU B 22 98.294 1.311 -12.039 1.00 0.00 H new ATOM 0 HB3 LEU B 22 98.220 0.034 -13.237 1.00 0.00 H new ATOM 0 HG LEU B 22 99.459 -1.479 -11.590 1.00 0.00 H new ATOM 0 HD11 LEU B 22 99.463 -0.814 -9.205 1.00 0.00 H new ATOM 0 HD12 LEU B 22 100.464 0.285 -10.183 1.00 0.00 H new ATOM 0 HD13 LEU B 22 98.845 0.794 -9.649 1.00 0.00 H new ATOM 0 HD21 LEU B 22 97.417 -1.869 -10.204 1.00 0.00 H new ATOM 0 HD22 LEU B 22 96.791 -0.275 -10.688 1.00 0.00 H new ATOM 0 HD23 LEU B 22 96.986 -1.560 -11.903 1.00 0.00 H new ATOM 1273 N ILE B 23 100.289 -0.507 -14.936 1.00 0.00 N ATOM 1274 CA ILE B 23 100.760 -1.567 -15.822 1.00 0.00 C ATOM 1275 C ILE B 23 102.256 -1.410 -16.070 1.00 0.00 C ATOM 1276 O ILE B 23 103.007 -2.385 -16.018 1.00 0.00 O ATOM 1277 CB ILE B 23 100.005 -1.530 -17.158 1.00 0.00 C ATOM 1278 CG1 ILE B 23 98.496 -1.422 -16.911 1.00 0.00 C ATOM 1279 CG2 ILE B 23 100.288 -2.809 -17.952 1.00 0.00 C ATOM 1280 CD1 ILE B 23 98.048 -2.483 -15.901 1.00 0.00 C ATOM 0 H ILE B 23 99.575 0.101 -15.337 1.00 0.00 H new ATOM 0 HA ILE B 23 100.572 -2.528 -15.342 1.00 0.00 H new ATOM 0 HB ILE B 23 100.344 -0.662 -17.723 1.00 0.00 H new ATOM 0 HG12 ILE B 23 98.252 -0.428 -16.537 1.00 0.00 H new ATOM 0 HG13 ILE B 23 97.956 -1.552 -17.849 1.00 0.00 H new ATOM 0 HG21 ILE B 23 99.749 -2.776 -18.899 1.00 0.00 H new ATOM 0 HG22 ILE B 23 101.358 -2.888 -18.146 1.00 0.00 H new ATOM 0 HG23 ILE B 23 99.959 -3.675 -17.377 1.00 0.00 H new ATOM 0 HD11 ILE B 23 96.974 -2.396 -15.734 1.00 0.00 H new ATOM 0 HD12 ILE B 23 98.275 -3.475 -16.291 1.00 0.00 H new ATOM 0 HD13 ILE B 23 98.575 -2.334 -14.959 1.00 0.00 H new ATOM 1292 N ALA B 24 102.689 -0.179 -16.327 1.00 0.00 N ATOM 1293 CA ALA B 24 104.105 0.080 -16.562 1.00 0.00 C ATOM 1294 C ALA B 24 104.922 -0.397 -15.365 1.00 0.00 C ATOM 1295 O ALA B 24 105.922 -1.106 -15.515 1.00 0.00 O ATOM 1296 CB ALA B 24 104.338 1.576 -16.783 1.00 0.00 C ATOM 0 H ALA B 24 102.089 0.644 -16.377 1.00 0.00 H new ATOM 0 HA ALA B 24 104.420 -0.462 -17.453 1.00 0.00 H new ATOM 0 HB1 ALA B 24 105.399 1.757 -16.957 1.00 0.00 H new ATOM 0 HB2 ALA B 24 103.766 1.909 -17.649 1.00 0.00 H new ATOM 0 HB3 ALA B 24 104.016 2.129 -15.900 1.00 0.00 H new ATOM 1302 N LEU B 25 104.479 -0.015 -14.172 1.00 0.00 N ATOM 1303 CA LEU B 25 105.164 -0.419 -12.953 1.00 0.00 C ATOM 1304 C LEU B 25 105.226 -1.941 -12.883 1.00 0.00 C ATOM 1305 O LEU B 25 106.204 -2.512 -12.401 1.00 0.00 O ATOM 1306 CB LEU B 25 104.424 0.138 -11.730 1.00 0.00 C ATOM 1307 CG LEU B 25 105.056 -0.383 -10.429 1.00 0.00 C ATOM 1308 CD1 LEU B 25 106.557 -0.057 -10.402 1.00 0.00 C ATOM 1309 CD2 LEU B 25 104.365 0.289 -9.238 1.00 0.00 C ATOM 0 H LEU B 25 103.656 0.569 -14.025 1.00 0.00 H new ATOM 0 HA LEU B 25 106.179 -0.021 -12.959 1.00 0.00 H new ATOM 0 HB2 LEU B 25 104.456 1.227 -11.745 1.00 0.00 H new ATOM 0 HB3 LEU B 25 103.374 -0.151 -11.771 1.00 0.00 H new ATOM 0 HG LEU B 25 104.930 -1.464 -10.373 1.00 0.00 H new ATOM 0 HD11 LEU B 25 106.994 -0.431 -9.476 1.00 0.00 H new ATOM 0 HD12 LEU B 25 107.048 -0.531 -11.252 1.00 0.00 H new ATOM 0 HD13 LEU B 25 106.696 1.023 -10.459 1.00 0.00 H new ATOM 0 HD21 LEU B 25 104.806 -0.074 -8.309 1.00 0.00 H new ATOM 0 HD22 LEU B 25 104.495 1.369 -9.304 1.00 0.00 H new ATOM 0 HD23 LEU B 25 103.302 0.050 -9.252 1.00 0.00 H new ATOM 1321 N ALA B 26 104.175 -2.590 -13.379 1.00 0.00 N ATOM 1322 CA ALA B 26 104.120 -4.046 -13.379 1.00 0.00 C ATOM 1323 C ALA B 26 105.212 -4.611 -14.280 1.00 0.00 C ATOM 1324 O ALA B 26 105.845 -5.615 -13.950 1.00 0.00 O ATOM 1325 CB ALA B 26 102.749 -4.522 -13.865 1.00 0.00 C ATOM 0 H ALA B 26 103.357 -2.133 -13.783 1.00 0.00 H new ATOM 0 HA ALA B 26 104.279 -4.402 -12.361 1.00 0.00 H new ATOM 0 HB1 ALA B 26 102.720 -5.612 -13.861 1.00 0.00 H new ATOM 0 HB2 ALA B 26 101.974 -4.136 -13.203 1.00 0.00 H new ATOM 0 HB3 ALA B 26 102.576 -4.158 -14.878 1.00 0.00 H new ATOM 1331 N VAL B 27 105.437 -3.956 -15.416 1.00 0.00 N ATOM 1332 CA VAL B 27 106.465 -4.403 -16.346 1.00 0.00 C ATOM 1333 C VAL B 27 107.823 -4.374 -15.662 1.00 0.00 C ATOM 1334 O VAL B 27 108.598 -5.326 -15.756 1.00 0.00 O ATOM 1335 CB VAL B 27 106.494 -3.502 -17.583 1.00 0.00 C ATOM 1336 CG1 VAL B 27 107.639 -3.934 -18.500 1.00 0.00 C ATOM 1337 CG2 VAL B 27 105.166 -3.625 -18.333 1.00 0.00 C ATOM 0 H VAL B 27 104.927 -3.123 -15.711 1.00 0.00 H new ATOM 0 HA VAL B 27 106.235 -5.422 -16.658 1.00 0.00 H new ATOM 0 HB VAL B 27 106.644 -2.467 -17.277 1.00 0.00 H new ATOM 0 HG11 VAL B 27 107.661 -3.293 -19.381 1.00 0.00 H new ATOM 0 HG12 VAL B 27 108.585 -3.848 -17.966 1.00 0.00 H new ATOM 0 HG13 VAL B 27 107.488 -4.969 -18.807 1.00 0.00 H new ATOM 0 HG21 VAL B 27 105.185 -2.984 -19.214 1.00 0.00 H new ATOM 0 HG22 VAL B 27 105.016 -4.660 -18.640 1.00 0.00 H new ATOM 0 HG23 VAL B 27 104.349 -3.319 -17.679 1.00 0.00 H new ATOM 1347 N TYR B 28 108.102 -3.278 -14.962 1.00 0.00 N ATOM 1348 CA TYR B 28 109.369 -3.145 -14.254 1.00 0.00 C ATOM 1349 C TYR B 28 109.489 -4.221 -13.179 1.00 0.00 C ATOM 1350 O TYR B 28 110.563 -4.781 -12.960 1.00 0.00 O ATOM 1351 CB TYR B 28 109.472 -1.762 -13.608 1.00 0.00 C ATOM 1352 CG TYR B 28 110.807 -1.631 -12.913 1.00 0.00 C ATOM 1353 CD1 TYR B 28 111.956 -1.335 -13.655 1.00 0.00 C ATOM 1354 CD2 TYR B 28 110.896 -1.807 -11.526 1.00 0.00 C ATOM 1355 CE1 TYR B 28 113.195 -1.215 -13.013 1.00 0.00 C ATOM 1356 CE2 TYR B 28 112.134 -1.687 -10.883 1.00 0.00 C ATOM 1357 CZ TYR B 28 113.283 -1.391 -11.626 1.00 0.00 C ATOM 1358 OH TYR B 28 114.504 -1.273 -10.993 1.00 0.00 O ATOM 0 H TYR B 28 107.475 -2.478 -14.871 1.00 0.00 H new ATOM 0 HA TYR B 28 110.180 -3.265 -14.973 1.00 0.00 H new ATOM 0 HB2 TYR B 28 109.366 -0.986 -14.366 1.00 0.00 H new ATOM 0 HB3 TYR B 28 108.662 -1.621 -12.893 1.00 0.00 H new ATOM 0 HD1 TYR B 28 111.887 -1.199 -14.724 1.00 0.00 H new ATOM 0 HD2 TYR B 28 110.010 -2.035 -10.953 1.00 0.00 H new ATOM 0 HE1 TYR B 28 114.081 -0.987 -13.586 1.00 0.00 H new ATOM 0 HE2 TYR B 28 112.203 -1.823 -9.814 1.00 0.00 H new ATOM 0 HH TYR B 28 114.390 -1.423 -10.031 1.00 0.00 H new ATOM 1368 N PHE B 29 108.374 -4.502 -12.511 1.00 0.00 N ATOM 1369 CA PHE B 29 108.352 -5.512 -11.457 1.00 0.00 C ATOM 1370 C PHE B 29 108.747 -6.878 -12.013 1.00 0.00 C ATOM 1371 O PHE B 29 109.532 -7.603 -11.401 1.00 0.00 O ATOM 1372 CB PHE B 29 106.950 -5.583 -10.844 1.00 0.00 C ATOM 1373 CG PHE B 29 106.873 -6.730 -9.856 1.00 0.00 C ATOM 1374 CD1 PHE B 29 107.693 -6.731 -8.721 1.00 0.00 C ATOM 1375 CD2 PHE B 29 105.979 -7.789 -10.075 1.00 0.00 C ATOM 1376 CE1 PHE B 29 107.619 -7.788 -7.806 1.00 0.00 C ATOM 1377 CE2 PHE B 29 105.907 -8.844 -9.159 1.00 0.00 C ATOM 1378 CZ PHE B 29 106.727 -8.844 -8.024 1.00 0.00 C ATOM 0 H PHE B 29 107.477 -4.047 -12.680 1.00 0.00 H new ATOM 0 HA PHE B 29 109.072 -5.232 -10.688 1.00 0.00 H new ATOM 0 HB2 PHE B 29 106.716 -4.644 -10.343 1.00 0.00 H new ATOM 0 HB3 PHE B 29 106.207 -5.719 -11.630 1.00 0.00 H new ATOM 0 HD1 PHE B 29 108.382 -5.917 -8.552 1.00 0.00 H new ATOM 0 HD2 PHE B 29 105.347 -7.790 -10.950 1.00 0.00 H new ATOM 0 HE1 PHE B 29 108.251 -7.788 -6.930 1.00 0.00 H new ATOM 0 HE2 PHE B 29 105.219 -9.659 -9.327 1.00 0.00 H new ATOM 0 HZ PHE B 29 106.671 -9.659 -7.317 1.00 0.00 H new ATOM 1388 N LEU B 30 108.196 -7.225 -13.171 1.00 0.00 N ATOM 1389 CA LEU B 30 108.498 -8.509 -13.795 1.00 0.00 C ATOM 1390 C LEU B 30 109.996 -8.629 -14.066 1.00 0.00 C ATOM 1391 O LEU B 30 110.598 -9.674 -13.820 1.00 0.00 O ATOM 1392 CB LEU B 30 107.714 -8.644 -15.108 1.00 0.00 C ATOM 1393 CG LEU B 30 108.129 -9.918 -15.860 1.00 0.00 C ATOM 1394 CD1 LEU B 30 108.002 -11.142 -14.941 1.00 0.00 C ATOM 1395 CD2 LEU B 30 107.214 -10.097 -17.076 1.00 0.00 C ATOM 0 H LEU B 30 107.543 -6.641 -13.693 1.00 0.00 H new ATOM 0 HA LEU B 30 108.203 -9.309 -13.116 1.00 0.00 H new ATOM 0 HB2 LEU B 30 106.645 -8.672 -14.898 1.00 0.00 H new ATOM 0 HB3 LEU B 30 107.893 -7.771 -15.735 1.00 0.00 H new ATOM 0 HG LEU B 30 109.166 -9.826 -16.181 1.00 0.00 H new ATOM 0 HD11 LEU B 30 108.299 -12.038 -15.486 1.00 0.00 H new ATOM 0 HD12 LEU B 30 108.649 -11.014 -14.073 1.00 0.00 H new ATOM 0 HD13 LEU B 30 106.968 -11.244 -14.611 1.00 0.00 H new ATOM 0 HD21 LEU B 30 107.500 -10.999 -17.617 1.00 0.00 H new ATOM 0 HD22 LEU B 30 106.180 -10.186 -16.743 1.00 0.00 H new ATOM 0 HD23 LEU B 30 107.310 -9.233 -17.734 1.00 0.00 H new ATOM 1407 N GLY B 31 110.591 -7.553 -14.572 1.00 0.00 N ATOM 1408 CA GLY B 31 112.018 -7.552 -14.870 1.00 0.00 C ATOM 1409 C GLY B 31 112.297 -8.250 -16.197 1.00 0.00 C ATOM 1410 O GLY B 31 112.052 -9.448 -16.342 1.00 0.00 O ATOM 0 H GLY B 31 110.111 -6.678 -14.783 1.00 0.00 H new ATOM 0 HA2 GLY B 31 112.385 -6.526 -14.910 1.00 0.00 H new ATOM 0 HA3 GLY B 31 112.561 -8.054 -14.069 1.00 0.00 H new ATOM 1414 N ARG B 32 112.810 -7.496 -17.162 1.00 0.00 N ATOM 1415 CA ARG B 32 113.118 -8.053 -18.473 1.00 0.00 C ATOM 1416 C ARG B 32 114.428 -8.834 -18.430 1.00 0.00 C ATOM 1417 O ARG B 32 115.462 -8.355 -18.897 1.00 0.00 O ATOM 1418 CB ARG B 32 113.226 -6.930 -19.506 1.00 0.00 C ATOM 1419 CG ARG B 32 113.211 -7.527 -20.915 1.00 0.00 C ATOM 1420 CD ARG B 32 113.525 -6.432 -21.936 1.00 0.00 C ATOM 1421 NE ARG B 32 112.649 -5.284 -21.730 1.00 0.00 N ATOM 1422 CZ ARG B 32 111.401 -5.282 -22.184 1.00 0.00 C ATOM 1423 NH1 ARG B 32 110.936 -6.320 -22.824 1.00 0.00 N ATOM 1424 NH2 ARG B 32 110.638 -4.241 -21.989 1.00 0.00 N ATOM 0 H ARG B 32 113.020 -6.503 -17.062 1.00 0.00 H new ATOM 0 HA ARG B 32 112.313 -8.731 -18.756 1.00 0.00 H new ATOM 0 HB2 ARG B 32 112.398 -6.232 -19.387 1.00 0.00 H new ATOM 0 HB3 ARG B 32 114.145 -6.365 -19.349 1.00 0.00 H new ATOM 0 HG2 ARG B 32 113.945 -8.330 -20.989 1.00 0.00 H new ATOM 0 HG3 ARG B 32 112.236 -7.966 -21.125 1.00 0.00 H new ATOM 0 HD2 ARG B 32 114.567 -6.125 -21.842 1.00 0.00 H new ATOM 0 HD3 ARG B 32 113.397 -6.820 -22.947 1.00 0.00 H new ATOM 0 HE ARG B 32 113.001 -4.469 -21.229 1.00 0.00 H new ATOM 0 HH11 ARG B 32 111.531 -7.134 -22.976 1.00 0.00 H new ATOM 0 HH12 ARG B 32 109.977 -6.317 -23.172 1.00 0.00 H new ATOM 0 HH21 ARG B 32 111.000 -3.430 -21.488 1.00 0.00 H new ATOM 0 HH22 ARG B 32 109.679 -4.239 -22.337 1.00 0.00 H new TER 1438 ARG B 32