USER MOD reduce.3.24.130724 H: found=0, std=0, add=826, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 824 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 51 THR OG1 : rot -48:sc= 1.45 USER MOD Set 1.2: A 55 THR OG1 : rot -7:sc= 0.224 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -109:sc= 1.31 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= -0.936 USER MOD Single : A 13 LYS NZ :NH3+ 173:sc= 0.687 (180deg=0.638) USER MOD Single : A 14 CYS SG : rot 1:sc= -3.06! USER MOD Single : A 17 THR OG1 : rot 31:sc= 0.216 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 35:sc= 0.128 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.476 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -160:sc= -1.6 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.115) USER MOD Single : A 46 THR OG1 : rot 37:sc= 0.0321 USER MOD Single : A 47 CYS SG : rot 100:sc= -1.37 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0.00453 X(o=0.0045,f=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.0736 USER MOD Single : A 69 TYR OH : rot 77:sc= 0.00108 USER MOD Single : A 73 TYR OH : rot 180:sc= 0.276 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.17) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 41:sc= 0.271 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 SER OG : rot 51:sc= -0.825 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.0236 USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 117 CYS SG : rot 22:sc= 0.115 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0.094 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.865 -23.130 -8.887 1.00 0.00 N ATOM 2 CA GLY A 1 11.554 -22.667 -8.474 1.00 0.00 C ATOM 3 C GLY A 1 10.695 -22.235 -9.645 1.00 0.00 C ATOM 4 O GLY A 1 11.060 -21.325 -10.389 1.00 0.00 O ATOM 0 H1 GLY A 1 13.413 -23.414 -8.050 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.760 -23.945 -9.525 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.363 -22.364 -9.383 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.046 -23.463 -7.929 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.668 -21.831 -7.784 1.00 0.00 H new ATOM 8 N SER A 2 9.551 -22.891 -9.812 1.00 0.00 N ATOM 9 CA SER A 2 8.640 -22.573 -10.905 1.00 0.00 C ATOM 10 C SER A 2 8.505 -21.064 -11.079 1.00 0.00 C ATOM 11 O SER A 2 8.547 -20.310 -10.106 1.00 0.00 O ATOM 12 CB SER A 2 7.265 -23.194 -10.648 1.00 0.00 C ATOM 13 OG SER A 2 7.243 -24.560 -11.025 1.00 0.00 O ATOM 0 H SER A 2 9.233 -23.646 -9.204 1.00 0.00 H new ATOM 0 HA SER A 2 9.054 -22.991 -11.823 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.012 -23.101 -9.592 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.505 -22.647 -11.207 1.00 0.00 H new ATOM 0 HG SER A 2 6.354 -24.934 -10.849 1.00 0.00 H new ATOM 19 N SER A 3 8.341 -20.631 -12.325 1.00 0.00 N ATOM 20 CA SER A 3 8.203 -19.211 -12.627 1.00 0.00 C ATOM 21 C SER A 3 6.733 -18.807 -12.684 1.00 0.00 C ATOM 22 O SER A 3 6.285 -17.943 -11.931 1.00 0.00 O ATOM 23 CB SER A 3 8.885 -18.883 -13.957 1.00 0.00 C ATOM 24 OG SER A 3 10.248 -18.552 -13.764 1.00 0.00 O ATOM 0 H SER A 3 8.300 -21.242 -13.141 1.00 0.00 H new ATOM 0 HA SER A 3 8.686 -18.647 -11.829 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.807 -19.737 -14.629 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.370 -18.051 -14.438 1.00 0.00 H new ATOM 0 HG SER A 3 10.661 -18.348 -14.629 1.00 0.00 H new ATOM 30 N GLY A 4 5.986 -19.441 -13.583 1.00 0.00 N ATOM 31 CA GLY A 4 4.574 -19.135 -13.722 1.00 0.00 C ATOM 32 C GLY A 4 3.743 -19.703 -12.588 1.00 0.00 C ATOM 33 O GLY A 4 3.952 -20.840 -12.166 1.00 0.00 O ATOM 0 H GLY A 4 6.333 -20.161 -14.217 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.442 -18.054 -13.759 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.211 -19.533 -14.669 1.00 0.00 H new ATOM 37 N SER A 5 2.799 -18.910 -12.093 1.00 0.00 N ATOM 38 CA SER A 5 1.937 -19.339 -10.997 1.00 0.00 C ATOM 39 C SER A 5 0.494 -19.491 -11.469 1.00 0.00 C ATOM 40 O SER A 5 -0.094 -18.556 -12.014 1.00 0.00 O ATOM 41 CB SER A 5 2.006 -18.337 -9.844 1.00 0.00 C ATOM 42 OG SER A 5 1.267 -18.795 -8.725 1.00 0.00 O ATOM 0 H SER A 5 2.611 -17.967 -12.433 1.00 0.00 H new ATOM 0 HA SER A 5 2.291 -20.309 -10.647 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.046 -18.179 -9.557 1.00 0.00 H new ATOM 0 HB3 SER A 5 1.616 -17.373 -10.172 1.00 0.00 H new ATOM 0 HG SER A 5 0.457 -18.253 -8.624 1.00 0.00 H new ATOM 48 N SER A 6 -0.071 -20.674 -11.254 1.00 0.00 N ATOM 49 CA SER A 6 -1.444 -20.951 -11.660 1.00 0.00 C ATOM 50 C SER A 6 -2.417 -20.647 -10.525 1.00 0.00 C ATOM 51 O SER A 6 -2.110 -20.864 -9.354 1.00 0.00 O ATOM 52 CB SER A 6 -1.586 -22.412 -12.091 1.00 0.00 C ATOM 53 OG SER A 6 -2.821 -22.631 -12.752 1.00 0.00 O ATOM 0 H SER A 6 0.401 -21.457 -10.801 1.00 0.00 H new ATOM 0 HA SER A 6 -1.685 -20.306 -12.505 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.763 -22.681 -12.753 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.517 -23.060 -11.218 1.00 0.00 H new ATOM 0 HG SER A 6 -2.887 -23.572 -13.019 1.00 0.00 H new ATOM 59 N GLY A 7 -3.595 -20.143 -10.883 1.00 0.00 N ATOM 60 CA GLY A 7 -4.596 -19.816 -9.884 1.00 0.00 C ATOM 61 C GLY A 7 -5.304 -21.046 -9.349 1.00 0.00 C ATOM 62 O GLY A 7 -6.384 -21.404 -9.821 1.00 0.00 O ATOM 0 H GLY A 7 -3.873 -19.956 -11.846 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.121 -19.286 -9.058 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.330 -19.138 -10.318 1.00 0.00 H new ATOM 66 N THR A 8 -4.695 -21.696 -8.362 1.00 0.00 N ATOM 67 CA THR A 8 -5.272 -22.894 -7.766 1.00 0.00 C ATOM 68 C THR A 8 -6.662 -22.615 -7.208 1.00 0.00 C ATOM 69 O THR A 8 -7.591 -23.397 -7.407 1.00 0.00 O ATOM 70 CB THR A 8 -4.379 -23.445 -6.638 1.00 0.00 C ATOM 71 OG1 THR A 8 -3.019 -23.519 -7.081 1.00 0.00 O ATOM 72 CG2 THR A 8 -4.850 -24.824 -6.201 1.00 0.00 C ATOM 0 H THR A 8 -3.802 -21.412 -7.959 1.00 0.00 H new ATOM 0 HA THR A 8 -5.345 -23.639 -8.559 1.00 0.00 H new ATOM 0 HB THR A 8 -4.447 -22.767 -5.787 1.00 0.00 H new ATOM 0 HG1 THR A 8 -2.458 -23.869 -6.358 1.00 0.00 H new ATOM 0 HG21 THR A 8 -4.205 -25.193 -5.404 1.00 0.00 H new ATOM 0 HG22 THR A 8 -5.876 -24.760 -5.837 1.00 0.00 H new ATOM 0 HG23 THR A 8 -4.808 -25.508 -7.048 1.00 0.00 H new ATOM 80 N GLY A 9 -6.800 -21.493 -6.506 1.00 0.00 N ATOM 81 CA GLY A 9 -8.081 -21.130 -5.930 1.00 0.00 C ATOM 82 C GLY A 9 -8.825 -20.109 -6.767 1.00 0.00 C ATOM 83 O GLY A 9 -9.296 -20.419 -7.862 1.00 0.00 O ATOM 0 H GLY A 9 -6.046 -20.829 -6.326 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -8.695 -22.025 -5.824 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -7.925 -20.730 -4.928 1.00 0.00 H new ATOM 87 N ASP A 10 -8.933 -18.890 -6.252 1.00 0.00 N ATOM 88 CA ASP A 10 -9.626 -17.819 -6.960 1.00 0.00 C ATOM 89 C ASP A 10 -9.247 -16.456 -6.388 1.00 0.00 C ATOM 90 O ASP A 10 -8.768 -16.357 -5.259 1.00 0.00 O ATOM 91 CB ASP A 10 -11.140 -18.019 -6.875 1.00 0.00 C ATOM 92 CG ASP A 10 -11.870 -17.415 -8.059 1.00 0.00 C ATOM 93 OD1 ASP A 10 -11.914 -18.065 -9.125 1.00 0.00 O ATOM 94 OD2 ASP A 10 -12.399 -16.293 -7.918 1.00 0.00 O ATOM 0 H ASP A 10 -8.550 -18.618 -5.347 1.00 0.00 H new ATOM 0 HA ASP A 10 -9.322 -17.851 -8.006 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -11.360 -19.085 -6.821 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -11.512 -17.570 -5.954 1.00 0.00 H new ATOM 99 N ALA A 11 -9.466 -15.408 -7.176 1.00 0.00 N ATOM 100 CA ALA A 11 -9.150 -14.051 -6.748 1.00 0.00 C ATOM 101 C ALA A 11 -10.419 -13.259 -6.451 1.00 0.00 C ATOM 102 O ALA A 11 -10.511 -12.575 -5.432 1.00 0.00 O ATOM 103 CB ALA A 11 -8.318 -13.344 -7.808 1.00 0.00 C ATOM 0 H ALA A 11 -9.861 -15.473 -8.114 1.00 0.00 H new ATOM 0 HA ALA A 11 -8.569 -14.112 -5.828 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -8.089 -12.332 -7.475 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -7.389 -13.892 -7.967 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -8.879 -13.301 -8.742 1.00 0.00 H new ATOM 109 N SER A 12 -11.393 -13.355 -7.349 1.00 0.00 N ATOM 110 CA SER A 12 -12.656 -12.643 -7.187 1.00 0.00 C ATOM 111 C SER A 12 -13.275 -12.942 -5.825 1.00 0.00 C ATOM 112 O SER A 12 -13.992 -12.114 -5.260 1.00 0.00 O ATOM 113 CB SER A 12 -13.632 -13.030 -8.300 1.00 0.00 C ATOM 114 OG SER A 12 -13.398 -12.268 -9.471 1.00 0.00 O ATOM 0 H SER A 12 -11.333 -13.919 -8.197 1.00 0.00 H new ATOM 0 HA SER A 12 -12.453 -11.574 -7.249 1.00 0.00 H new ATOM 0 HB2 SER A 12 -13.528 -14.091 -8.526 1.00 0.00 H new ATOM 0 HB3 SER A 12 -14.656 -12.875 -7.960 1.00 0.00 H new ATOM 0 HG SER A 12 -14.033 -12.535 -10.168 1.00 0.00 H new ATOM 120 N LYS A 13 -12.996 -14.131 -5.302 1.00 0.00 N ATOM 121 CA LYS A 13 -13.523 -14.542 -4.006 1.00 0.00 C ATOM 122 C LYS A 13 -12.875 -13.746 -2.878 1.00 0.00 C ATOM 123 O LYS A 13 -13.507 -13.471 -1.857 1.00 0.00 O ATOM 124 CB LYS A 13 -13.290 -16.038 -3.788 1.00 0.00 C ATOM 125 CG LYS A 13 -13.721 -16.898 -4.963 1.00 0.00 C ATOM 126 CD LYS A 13 -15.227 -16.858 -5.160 1.00 0.00 C ATOM 127 CE LYS A 13 -15.636 -15.750 -6.118 1.00 0.00 C ATOM 128 NZ LYS A 13 -15.355 -16.110 -7.535 1.00 0.00 N ATOM 0 H LYS A 13 -12.407 -14.828 -5.757 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.595 -14.343 -3.998 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.231 -16.208 -3.593 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -13.833 -16.356 -2.898 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -13.225 -16.552 -5.870 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -13.402 -17.927 -4.798 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -15.570 -17.818 -5.545 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -15.717 -16.707 -4.198 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -16.700 -15.542 -6.000 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -15.102 -14.834 -5.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -15.754 -15.384 -8.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -14.327 -16.167 -7.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -15.787 -17.031 -7.752 1.00 0.00 H new ATOM 142 N CYS A 14 -11.614 -13.376 -3.069 1.00 0.00 N ATOM 143 CA CYS A 14 -10.880 -12.611 -2.067 1.00 0.00 C ATOM 144 C CYS A 14 -11.442 -11.197 -1.944 1.00 0.00 C ATOM 145 O CYS A 14 -11.868 -10.599 -2.933 1.00 0.00 O ATOM 146 CB CYS A 14 -9.395 -12.552 -2.426 1.00 0.00 C ATOM 147 SG CYS A 14 -8.299 -12.353 -1.003 1.00 0.00 S ATOM 0 H CYS A 14 -11.078 -13.593 -3.909 1.00 0.00 H new ATOM 0 HA CYS A 14 -10.994 -13.114 -1.107 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -9.124 -13.466 -2.955 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -9.232 -11.724 -3.116 1.00 0.00 H new ATOM 0 HG CYS A 14 -9.005 -12.322 0.088 1.00 0.00 H new ATOM 153 N LEU A 15 -11.442 -10.671 -0.725 1.00 0.00 N ATOM 154 CA LEU A 15 -11.953 -9.329 -0.472 1.00 0.00 C ATOM 155 C LEU A 15 -10.903 -8.468 0.222 1.00 0.00 C ATOM 156 O LEU A 15 -10.214 -8.926 1.134 1.00 0.00 O ATOM 157 CB LEU A 15 -13.220 -9.397 0.384 1.00 0.00 C ATOM 158 CG LEU A 15 -14.519 -9.700 -0.364 1.00 0.00 C ATOM 159 CD1 LEU A 15 -14.724 -8.712 -1.499 1.00 0.00 C ATOM 160 CD2 LEU A 15 -14.509 -11.128 -0.891 1.00 0.00 C ATOM 0 H LEU A 15 -11.094 -11.153 0.104 1.00 0.00 H new ATOM 0 HA LEU A 15 -12.194 -8.872 -1.432 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -13.078 -10.161 1.148 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -13.336 -8.445 0.902 1.00 0.00 H new ATOM 0 HG LEU A 15 -15.351 -9.597 0.333 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -15.653 -8.944 -2.020 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -14.776 -7.701 -1.096 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -13.890 -8.782 -2.197 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -15.441 -11.327 -1.421 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -13.669 -11.258 -1.573 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -14.410 -11.823 -0.057 1.00 0.00 H new ATOM 172 N ALA A 16 -10.787 -7.218 -0.214 1.00 0.00 N ATOM 173 CA ALA A 16 -9.823 -6.292 0.368 1.00 0.00 C ATOM 174 C ALA A 16 -10.528 -5.138 1.073 1.00 0.00 C ATOM 175 O ALA A 16 -11.136 -4.280 0.431 1.00 0.00 O ATOM 176 CB ALA A 16 -8.884 -5.762 -0.706 1.00 0.00 C ATOM 0 H ALA A 16 -11.349 -6.823 -0.968 1.00 0.00 H new ATOM 0 HA ALA A 16 -9.238 -6.835 1.110 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.170 -5.072 -0.257 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -8.347 -6.594 -1.162 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -9.462 -5.240 -1.469 1.00 0.00 H new ATOM 182 N THR A 17 -10.444 -5.122 2.400 1.00 0.00 N ATOM 183 CA THR A 17 -11.076 -4.074 3.193 1.00 0.00 C ATOM 184 C THR A 17 -10.060 -3.372 4.086 1.00 0.00 C ATOM 185 O THR A 17 -9.332 -4.017 4.841 1.00 0.00 O ATOM 186 CB THR A 17 -12.210 -4.639 4.070 1.00 0.00 C ATOM 187 OG1 THR A 17 -11.712 -5.705 4.888 1.00 0.00 O ATOM 188 CG2 THR A 17 -13.357 -5.146 3.210 1.00 0.00 C ATOM 0 H THR A 17 -9.945 -5.823 2.948 1.00 0.00 H new ATOM 0 HA THR A 17 -11.495 -3.355 2.489 1.00 0.00 H new ATOM 0 HB THR A 17 -12.582 -3.836 4.707 1.00 0.00 H new ATOM 0 HG1 THR A 17 -10.770 -5.540 5.102 1.00 0.00 H new ATOM 0 HG21 THR A 17 -14.146 -5.540 3.851 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.752 -4.326 2.611 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.996 -5.936 2.551 1.00 0.00 H new ATOM 196 N GLY A 18 -10.015 -2.047 3.997 1.00 0.00 N ATOM 197 CA GLY A 18 -9.084 -1.280 4.804 1.00 0.00 C ATOM 198 C GLY A 18 -9.017 0.176 4.385 1.00 0.00 C ATOM 199 O GLY A 18 -9.330 0.532 3.249 1.00 0.00 O ATOM 0 H GLY A 18 -10.607 -1.490 3.380 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.380 -1.340 5.851 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.091 -1.723 4.728 1.00 0.00 H new ATOM 203 N PRO A 19 -8.602 1.046 5.318 1.00 0.00 N ATOM 204 CA PRO A 19 -8.487 2.484 5.064 1.00 0.00 C ATOM 205 C PRO A 19 -7.345 2.814 4.109 1.00 0.00 C ATOM 206 O PRO A 19 -7.324 3.881 3.496 1.00 0.00 O ATOM 207 CB PRO A 19 -8.209 3.069 6.452 1.00 0.00 C ATOM 208 CG PRO A 19 -7.583 1.952 7.214 1.00 0.00 C ATOM 209 CD PRO A 19 -8.213 0.690 6.693 1.00 0.00 C ATOM 0 HA PRO A 19 -9.381 2.886 4.588 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -7.543 3.930 6.393 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -9.128 3.409 6.930 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -6.503 1.938 7.068 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -7.759 2.063 8.284 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -7.513 -0.145 6.709 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -9.075 0.395 7.291 1.00 0.00 H new ATOM 217 N GLY A 20 -6.396 1.892 3.986 1.00 0.00 N ATOM 218 CA GLY A 20 -5.264 2.103 3.103 1.00 0.00 C ATOM 219 C GLY A 20 -5.654 2.055 1.639 1.00 0.00 C ATOM 220 O GLY A 20 -5.069 2.754 0.811 1.00 0.00 O ATOM 0 H GLY A 20 -6.391 1.001 4.483 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.810 3.069 3.323 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.507 1.343 3.299 1.00 0.00 H new ATOM 224 N ILE A 21 -6.644 1.229 1.319 1.00 0.00 N ATOM 225 CA ILE A 21 -7.111 1.093 -0.055 1.00 0.00 C ATOM 226 C ILE A 21 -8.233 2.080 -0.356 1.00 0.00 C ATOM 227 O ILE A 21 -8.702 2.176 -1.489 1.00 0.00 O ATOM 228 CB ILE A 21 -7.609 -0.336 -0.342 1.00 0.00 C ATOM 229 CG1 ILE A 21 -8.824 -0.660 0.529 1.00 0.00 C ATOM 230 CG2 ILE A 21 -6.494 -1.344 -0.101 1.00 0.00 C ATOM 231 CD1 ILE A 21 -9.729 -1.717 -0.066 1.00 0.00 C ATOM 0 H ILE A 21 -7.138 0.644 1.993 1.00 0.00 H new ATOM 0 HA ILE A 21 -6.259 1.309 -0.700 1.00 0.00 H new ATOM 0 HB ILE A 21 -7.908 -0.398 -1.388 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -8.480 -0.996 1.507 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -9.400 0.252 0.689 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -6.861 -2.349 -0.308 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.654 -1.122 -0.759 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -6.167 -1.284 0.937 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -10.569 -1.896 0.605 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -10.102 -1.375 -1.031 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -9.168 -2.642 -0.201 1.00 0.00 H new ATOM 243 N ALA A 22 -8.658 2.813 0.668 1.00 0.00 N ATOM 244 CA ALA A 22 -9.723 3.796 0.513 1.00 0.00 C ATOM 245 C ALA A 22 -9.482 4.680 -0.706 1.00 0.00 C ATOM 246 O ALA A 22 -8.373 5.169 -0.920 1.00 0.00 O ATOM 247 CB ALA A 22 -9.843 4.647 1.769 1.00 0.00 C ATOM 0 H ALA A 22 -8.281 2.745 1.613 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.659 3.259 0.360 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -10.642 5.377 1.639 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -10.071 4.007 2.622 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.902 5.167 1.947 1.00 0.00 H new ATOM 253 N SER A 23 -10.527 4.879 -1.504 1.00 0.00 N ATOM 254 CA SER A 23 -10.426 5.701 -2.704 1.00 0.00 C ATOM 255 C SER A 23 -9.559 6.929 -2.451 1.00 0.00 C ATOM 256 O SER A 23 -8.736 7.308 -3.286 1.00 0.00 O ATOM 257 CB SER A 23 -11.818 6.131 -3.170 1.00 0.00 C ATOM 258 OG SER A 23 -12.569 6.677 -2.099 1.00 0.00 O ATOM 0 H SER A 23 -11.452 4.482 -1.341 1.00 0.00 H new ATOM 0 HA SER A 23 -9.957 5.104 -3.486 1.00 0.00 H new ATOM 0 HB2 SER A 23 -11.726 6.869 -3.967 1.00 0.00 H new ATOM 0 HB3 SER A 23 -12.346 5.274 -3.588 1.00 0.00 H new ATOM 0 HG SER A 23 -13.454 6.946 -2.423 1.00 0.00 H new ATOM 264 N THR A 24 -9.749 7.551 -1.290 1.00 0.00 N ATOM 265 CA THR A 24 -8.986 8.738 -0.927 1.00 0.00 C ATOM 266 C THR A 24 -8.383 8.598 0.466 1.00 0.00 C ATOM 267 O THR A 24 -9.073 8.238 1.420 1.00 0.00 O ATOM 268 CB THR A 24 -9.863 10.004 -0.968 1.00 0.00 C ATOM 269 OG1 THR A 24 -10.895 9.918 0.021 1.00 0.00 O ATOM 270 CG2 THR A 24 -10.486 10.185 -2.344 1.00 0.00 C ATOM 0 H THR A 24 -10.424 7.252 -0.587 1.00 0.00 H new ATOM 0 HA THR A 24 -8.185 8.835 -1.660 1.00 0.00 H new ATOM 0 HB THR A 24 -9.230 10.865 -0.757 1.00 0.00 H new ATOM 0 HG1 THR A 24 -10.552 9.453 0.812 1.00 0.00 H new ATOM 0 HG21 THR A 24 -11.101 11.085 -2.349 1.00 0.00 H new ATOM 0 HG22 THR A 24 -9.698 10.280 -3.091 1.00 0.00 H new ATOM 0 HG23 THR A 24 -11.107 9.320 -2.579 1.00 0.00 H new ATOM 278 N VAL A 25 -7.089 8.884 0.578 1.00 0.00 N ATOM 279 CA VAL A 25 -6.393 8.792 1.856 1.00 0.00 C ATOM 280 C VAL A 25 -5.627 10.075 2.159 1.00 0.00 C ATOM 281 O VAL A 25 -5.700 11.047 1.407 1.00 0.00 O ATOM 282 CB VAL A 25 -5.412 7.605 1.876 1.00 0.00 C ATOM 283 CG1 VAL A 25 -6.160 6.291 1.707 1.00 0.00 C ATOM 284 CG2 VAL A 25 -4.355 7.769 0.794 1.00 0.00 C ATOM 0 H VAL A 25 -6.502 9.181 -0.201 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.154 8.638 2.621 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.910 7.588 2.843 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.450 5.464 1.724 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.875 6.172 2.521 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.691 6.294 0.755 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.670 6.921 0.823 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.838 7.813 -0.182 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.799 8.691 0.965 1.00 0.00 H new ATOM 294 N LYS A 26 -4.893 10.071 3.266 1.00 0.00 N ATOM 295 CA LYS A 26 -4.111 11.234 3.669 1.00 0.00 C ATOM 296 C LYS A 26 -2.617 10.933 3.611 1.00 0.00 C ATOM 297 O LYS A 26 -2.161 9.902 4.106 1.00 0.00 O ATOM 298 CB LYS A 26 -4.499 11.669 5.085 1.00 0.00 C ATOM 299 CG LYS A 26 -5.732 12.554 5.133 1.00 0.00 C ATOM 300 CD LYS A 26 -6.408 12.496 6.493 1.00 0.00 C ATOM 301 CE LYS A 26 -7.418 11.361 6.566 1.00 0.00 C ATOM 302 NZ LYS A 26 -8.440 11.594 7.623 1.00 0.00 N ATOM 0 H LYS A 26 -4.823 9.275 3.900 1.00 0.00 H new ATOM 0 HA LYS A 26 -4.328 12.044 2.973 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.675 10.782 5.693 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.661 12.202 5.534 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -5.451 13.583 4.909 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.436 12.241 4.362 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -5.655 12.364 7.270 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.909 13.443 6.692 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -7.912 11.253 5.601 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.897 10.424 6.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -9.109 10.798 7.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -7.971 11.672 8.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.955 12.475 7.420 1.00 0.00 H new ATOM 316 N THR A 27 -1.859 11.839 3.002 1.00 0.00 N ATOM 317 CA THR A 27 -0.416 11.670 2.879 1.00 0.00 C ATOM 318 C THR A 27 0.263 11.733 4.242 1.00 0.00 C ATOM 319 O THR A 27 -0.195 12.433 5.143 1.00 0.00 O ATOM 320 CB THR A 27 0.198 12.743 1.961 1.00 0.00 C ATOM 321 OG1 THR A 27 -0.274 14.041 2.339 1.00 0.00 O ATOM 322 CG2 THR A 27 -0.150 12.476 0.505 1.00 0.00 C ATOM 0 H THR A 27 -2.220 12.698 2.586 1.00 0.00 H new ATOM 0 HA THR A 27 -0.249 10.687 2.439 1.00 0.00 H new ATOM 0 HB THR A 27 1.282 12.704 2.071 1.00 0.00 H new ATOM 0 HG1 THR A 27 0.123 14.717 1.751 1.00 0.00 H new ATOM 0 HG21 THR A 27 0.295 13.248 -0.123 1.00 0.00 H new ATOM 0 HG22 THR A 27 0.238 11.501 0.211 1.00 0.00 H new ATOM 0 HG23 THR A 27 -1.233 12.488 0.382 1.00 0.00 H new ATOM 330 N GLY A 28 1.361 10.996 4.385 1.00 0.00 N ATOM 331 CA GLY A 28 2.086 10.984 5.643 1.00 0.00 C ATOM 332 C GLY A 28 1.538 9.960 6.618 1.00 0.00 C ATOM 333 O GLY A 28 2.299 9.248 7.272 1.00 0.00 O ATOM 0 H GLY A 28 1.761 10.408 3.654 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.138 10.772 5.451 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.038 11.974 6.096 1.00 0.00 H new ATOM 337 N GLU A 29 0.214 9.889 6.717 1.00 0.00 N ATOM 338 CA GLU A 29 -0.434 8.948 7.622 1.00 0.00 C ATOM 339 C GLU A 29 -0.146 7.508 7.206 1.00 0.00 C ATOM 340 O GLU A 29 -0.169 7.177 6.021 1.00 0.00 O ATOM 341 CB GLU A 29 -1.944 9.190 7.650 1.00 0.00 C ATOM 342 CG GLU A 29 -2.357 10.353 8.536 1.00 0.00 C ATOM 343 CD GLU A 29 -2.434 9.970 10.002 1.00 0.00 C ATOM 344 OE1 GLU A 29 -1.392 10.030 10.686 1.00 0.00 O ATOM 345 OE2 GLU A 29 -3.537 9.610 10.465 1.00 0.00 O ATOM 0 H GLU A 29 -0.430 10.472 6.182 1.00 0.00 H new ATOM 0 HA GLU A 29 -0.030 9.107 8.622 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.293 9.376 6.634 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.442 8.285 7.997 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -1.644 11.169 8.414 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -3.328 10.726 8.210 1.00 0.00 H new ATOM 352 N GLU A 30 0.126 6.656 8.190 1.00 0.00 N ATOM 353 CA GLU A 30 0.419 5.253 7.927 1.00 0.00 C ATOM 354 C GLU A 30 -0.861 4.422 7.916 1.00 0.00 C ATOM 355 O GLU A 30 -1.448 4.150 8.963 1.00 0.00 O ATOM 356 CB GLU A 30 1.386 4.705 8.979 1.00 0.00 C ATOM 357 CG GLU A 30 1.420 3.187 9.042 1.00 0.00 C ATOM 358 CD GLU A 30 0.353 2.617 9.954 1.00 0.00 C ATOM 359 OE1 GLU A 30 0.436 2.845 11.180 1.00 0.00 O ATOM 360 OE2 GLU A 30 -0.566 1.943 9.444 1.00 0.00 O ATOM 0 H GLU A 30 0.149 6.914 9.177 1.00 0.00 H new ATOM 0 HA GLU A 30 0.885 5.184 6.944 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.389 5.074 8.766 1.00 0.00 H new ATOM 0 HB3 GLU A 30 1.104 5.095 9.957 1.00 0.00 H new ATOM 0 HG2 GLU A 30 1.289 2.783 8.038 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.401 2.864 9.390 1.00 0.00 H new ATOM 367 N VAL A 31 -1.290 4.023 6.722 1.00 0.00 N ATOM 368 CA VAL A 31 -2.499 3.223 6.572 1.00 0.00 C ATOM 369 C VAL A 31 -2.216 1.746 6.822 1.00 0.00 C ATOM 370 O VAL A 31 -1.064 1.341 6.976 1.00 0.00 O ATOM 371 CB VAL A 31 -3.111 3.387 5.168 1.00 0.00 C ATOM 372 CG1 VAL A 31 -3.545 4.827 4.940 1.00 0.00 C ATOM 373 CG2 VAL A 31 -2.122 2.944 4.102 1.00 0.00 C ATOM 0 H VAL A 31 -0.817 4.241 5.845 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.211 3.584 7.314 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.994 2.752 5.098 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.975 4.924 3.943 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.290 5.105 5.685 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.681 5.486 5.028 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.571 3.066 3.116 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.219 3.552 4.168 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.866 1.896 4.256 1.00 0.00 H new ATOM 383 N GLY A 32 -3.275 0.943 6.859 1.00 0.00 N ATOM 384 CA GLY A 32 -3.120 -0.481 7.090 1.00 0.00 C ATOM 385 C GLY A 32 -4.366 -1.266 6.731 1.00 0.00 C ATOM 386 O GLY A 32 -5.342 -1.272 7.481 1.00 0.00 O ATOM 0 H GLY A 32 -4.238 1.254 6.733 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.279 -0.852 6.503 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.877 -0.651 8.139 1.00 0.00 H new ATOM 390 N PHE A 33 -4.334 -1.930 5.580 1.00 0.00 N ATOM 391 CA PHE A 33 -5.471 -2.720 5.122 1.00 0.00 C ATOM 392 C PHE A 33 -5.198 -4.212 5.287 1.00 0.00 C ATOM 393 O PHE A 33 -4.046 -4.641 5.350 1.00 0.00 O ATOM 394 CB PHE A 33 -5.781 -2.406 3.657 1.00 0.00 C ATOM 395 CG PHE A 33 -4.683 -2.807 2.713 1.00 0.00 C ATOM 396 CD1 PHE A 33 -4.629 -4.093 2.200 1.00 0.00 C ATOM 397 CD2 PHE A 33 -3.707 -1.898 2.338 1.00 0.00 C ATOM 398 CE1 PHE A 33 -3.619 -4.465 1.332 1.00 0.00 C ATOM 399 CE2 PHE A 33 -2.695 -2.265 1.470 1.00 0.00 C ATOM 400 CZ PHE A 33 -2.652 -3.550 0.965 1.00 0.00 C ATOM 0 H PHE A 33 -3.534 -1.937 4.948 1.00 0.00 H new ATOM 0 HA PHE A 33 -6.334 -2.456 5.733 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.700 -2.917 3.371 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -5.965 -1.337 3.554 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -5.384 -4.812 2.481 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -3.737 -0.891 2.728 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -3.586 -5.471 0.941 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -1.939 -1.548 1.187 1.00 0.00 H new ATOM 0 HZ PHE A 33 -1.864 -3.838 0.285 1.00 0.00 H new ATOM 410 N VAL A 34 -6.268 -4.999 5.357 1.00 0.00 N ATOM 411 CA VAL A 34 -6.145 -6.444 5.514 1.00 0.00 C ATOM 412 C VAL A 34 -6.972 -7.182 4.468 1.00 0.00 C ATOM 413 O VAL A 34 -8.049 -6.729 4.080 1.00 0.00 O ATOM 414 CB VAL A 34 -6.589 -6.895 6.918 1.00 0.00 C ATOM 415 CG1 VAL A 34 -8.067 -6.602 7.130 1.00 0.00 C ATOM 416 CG2 VAL A 34 -6.296 -8.374 7.119 1.00 0.00 C ATOM 0 H VAL A 34 -7.229 -4.660 5.307 1.00 0.00 H new ATOM 0 HA VAL A 34 -5.092 -6.690 5.379 1.00 0.00 H new ATOM 0 HB VAL A 34 -6.022 -6.332 7.659 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -8.363 -6.927 8.127 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -8.244 -5.531 7.030 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -8.655 -7.137 6.384 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -6.616 -8.676 8.116 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.836 -8.957 6.373 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -5.226 -8.551 7.012 1.00 0.00 H new ATOM 426 N VAL A 35 -6.462 -8.324 4.017 1.00 0.00 N ATOM 427 CA VAL A 35 -7.156 -9.128 3.017 1.00 0.00 C ATOM 428 C VAL A 35 -7.946 -10.256 3.670 1.00 0.00 C ATOM 429 O VAL A 35 -7.468 -10.905 4.601 1.00 0.00 O ATOM 430 CB VAL A 35 -6.168 -9.730 1.999 1.00 0.00 C ATOM 431 CG1 VAL A 35 -6.906 -10.589 0.984 1.00 0.00 C ATOM 432 CG2 VAL A 35 -5.382 -8.628 1.305 1.00 0.00 C ATOM 0 H VAL A 35 -5.572 -8.713 4.328 1.00 0.00 H new ATOM 0 HA VAL A 35 -7.844 -8.462 2.496 1.00 0.00 H new ATOM 0 HB VAL A 35 -5.463 -10.366 2.534 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.193 -11.006 0.273 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.421 -11.400 1.499 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.634 -9.978 0.451 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.689 -9.071 0.590 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.070 -7.965 0.781 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -4.823 -8.058 2.047 1.00 0.00 H new ATOM 442 N ASP A 36 -9.157 -10.485 3.176 1.00 0.00 N ATOM 443 CA ASP A 36 -10.015 -11.537 3.712 1.00 0.00 C ATOM 444 C ASP A 36 -10.337 -12.572 2.639 1.00 0.00 C ATOM 445 O ASP A 36 -10.705 -12.226 1.517 1.00 0.00 O ATOM 446 CB ASP A 36 -11.309 -10.937 4.264 1.00 0.00 C ATOM 447 CG ASP A 36 -11.898 -11.767 5.388 1.00 0.00 C ATOM 448 OD1 ASP A 36 -12.497 -12.823 5.094 1.00 0.00 O ATOM 449 OD2 ASP A 36 -11.761 -11.361 6.561 1.00 0.00 O ATOM 0 H ASP A 36 -9.568 -9.957 2.406 1.00 0.00 H new ATOM 0 HA ASP A 36 -9.480 -12.033 4.522 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -11.113 -9.928 4.626 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.039 -10.851 3.459 1.00 0.00 H new ATOM 454 N ALA A 37 -10.194 -13.846 2.991 1.00 0.00 N ATOM 455 CA ALA A 37 -10.470 -14.933 2.060 1.00 0.00 C ATOM 456 C ALA A 37 -11.441 -15.940 2.665 1.00 0.00 C ATOM 457 O ALA A 37 -11.219 -16.450 3.763 1.00 0.00 O ATOM 458 CB ALA A 37 -9.175 -15.621 1.655 1.00 0.00 C ATOM 0 H ALA A 37 -9.888 -14.150 3.915 1.00 0.00 H new ATOM 0 HA ALA A 37 -10.936 -14.509 1.171 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.395 -16.431 0.960 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.515 -14.899 1.174 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.686 -16.026 2.541 1.00 0.00 H new ATOM 464 N LYS A 38 -12.519 -16.224 1.941 1.00 0.00 N ATOM 465 CA LYS A 38 -13.524 -17.172 2.406 1.00 0.00 C ATOM 466 C LYS A 38 -13.634 -18.358 1.453 1.00 0.00 C ATOM 467 O LYS A 38 -13.628 -19.514 1.880 1.00 0.00 O ATOM 468 CB LYS A 38 -14.884 -16.482 2.535 1.00 0.00 C ATOM 469 CG LYS A 38 -15.247 -15.622 1.337 1.00 0.00 C ATOM 470 CD LYS A 38 -16.534 -14.849 1.573 1.00 0.00 C ATOM 471 CE LYS A 38 -17.757 -15.733 1.385 1.00 0.00 C ATOM 472 NZ LYS A 38 -19.005 -15.055 1.833 1.00 0.00 N ATOM 0 H LYS A 38 -12.719 -15.811 1.030 1.00 0.00 H new ATOM 0 HA LYS A 38 -13.215 -17.540 3.384 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -15.655 -17.240 2.674 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -14.883 -15.861 3.431 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.436 -14.924 1.130 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.357 -16.253 0.455 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -16.533 -14.438 2.582 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -16.584 -14.005 0.885 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -17.849 -16.006 0.334 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -17.626 -16.659 1.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -19.816 -15.690 1.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -18.927 -14.816 2.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -19.144 -14.184 1.281 1.00 0.00 H new ATOM 486 N THR A 39 -13.733 -18.066 0.160 1.00 0.00 N ATOM 487 CA THR A 39 -13.843 -19.110 -0.852 1.00 0.00 C ATOM 488 C THR A 39 -12.762 -18.961 -1.915 1.00 0.00 C ATOM 489 O THR A 39 -12.849 -19.552 -2.991 1.00 0.00 O ATOM 490 CB THR A 39 -15.225 -19.086 -1.535 1.00 0.00 C ATOM 491 OG1 THR A 39 -15.388 -17.869 -2.269 1.00 0.00 O ATOM 492 CG2 THR A 39 -16.338 -19.218 -0.506 1.00 0.00 C ATOM 0 H THR A 39 -13.739 -17.116 -0.211 1.00 0.00 H new ATOM 0 HA THR A 39 -13.715 -20.063 -0.339 1.00 0.00 H new ATOM 0 HB THR A 39 -15.283 -19.932 -2.220 1.00 0.00 H new ATOM 0 HG1 THR A 39 -16.341 -17.709 -2.429 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.304 -19.199 -1.010 1.00 0.00 H new ATOM 0 HG22 THR A 39 -16.228 -20.160 0.030 1.00 0.00 H new ATOM 0 HG23 THR A 39 -16.281 -18.390 0.200 1.00 0.00 H new ATOM 500 N ALA A 40 -11.741 -18.167 -1.608 1.00 0.00 N ATOM 501 CA ALA A 40 -10.641 -17.943 -2.536 1.00 0.00 C ATOM 502 C ALA A 40 -9.599 -19.051 -2.431 1.00 0.00 C ATOM 503 O ALA A 40 -8.402 -18.806 -2.572 1.00 0.00 O ATOM 504 CB ALA A 40 -10.000 -16.587 -2.277 1.00 0.00 C ATOM 0 H ALA A 40 -11.654 -17.668 -0.723 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.045 -17.955 -3.548 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.179 -16.433 -2.978 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -10.744 -15.801 -2.411 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.617 -16.554 -1.257 1.00 0.00 H new ATOM 510 N GLY A 41 -10.063 -20.271 -2.182 1.00 0.00 N ATOM 511 CA GLY A 41 -9.158 -21.399 -2.060 1.00 0.00 C ATOM 512 C GLY A 41 -7.876 -21.039 -1.336 1.00 0.00 C ATOM 513 O GLY A 41 -7.904 -20.362 -0.307 1.00 0.00 O ATOM 0 H GLY A 41 -11.050 -20.499 -2.062 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.659 -22.206 -1.526 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -8.917 -21.776 -3.054 1.00 0.00 H new ATOM 517 N LYS A 42 -6.748 -21.492 -1.872 1.00 0.00 N ATOM 518 CA LYS A 42 -5.449 -21.215 -1.271 1.00 0.00 C ATOM 519 C LYS A 42 -4.566 -20.418 -2.227 1.00 0.00 C ATOM 520 O LYS A 42 -4.727 -20.493 -3.444 1.00 0.00 O ATOM 521 CB LYS A 42 -4.752 -22.521 -0.885 1.00 0.00 C ATOM 522 CG LYS A 42 -3.330 -22.329 -0.386 1.00 0.00 C ATOM 523 CD LYS A 42 -2.867 -23.512 0.448 1.00 0.00 C ATOM 524 CE LYS A 42 -1.360 -23.492 0.653 1.00 0.00 C ATOM 525 NZ LYS A 42 -0.644 -24.232 -0.423 1.00 0.00 N ATOM 0 H LYS A 42 -6.707 -22.053 -2.723 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.613 -20.619 -0.373 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -5.335 -23.019 -0.111 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -4.738 -23.185 -1.750 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -2.660 -22.197 -1.236 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.272 -21.418 0.210 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -3.367 -23.494 1.416 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -3.156 -24.441 -0.044 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.011 -22.460 0.678 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.119 -23.934 1.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.380 -24.195 -0.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.958 -25.223 -0.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.853 -23.795 -1.343 1.00 0.00 H new ATOM 539 N GLY A 43 -3.631 -19.657 -1.665 1.00 0.00 N ATOM 540 CA GLY A 43 -2.736 -18.858 -2.483 1.00 0.00 C ATOM 541 C GLY A 43 -1.976 -17.826 -1.674 1.00 0.00 C ATOM 542 O GLY A 43 -1.846 -17.955 -0.456 1.00 0.00 O ATOM 0 H GLY A 43 -3.477 -19.580 -0.660 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.026 -19.514 -2.987 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -3.311 -18.354 -3.260 1.00 0.00 H new ATOM 546 N LYS A 44 -1.473 -16.800 -2.350 1.00 0.00 N ATOM 547 CA LYS A 44 -0.721 -15.741 -1.687 1.00 0.00 C ATOM 548 C LYS A 44 -1.173 -14.367 -2.171 1.00 0.00 C ATOM 549 O LYS A 44 -1.680 -14.226 -3.285 1.00 0.00 O ATOM 550 CB LYS A 44 0.778 -15.915 -1.941 1.00 0.00 C ATOM 551 CG LYS A 44 1.394 -17.075 -1.177 1.00 0.00 C ATOM 552 CD LYS A 44 1.767 -16.673 0.240 1.00 0.00 C ATOM 553 CE LYS A 44 2.348 -17.846 1.017 1.00 0.00 C ATOM 554 NZ LYS A 44 1.328 -18.899 1.275 1.00 0.00 N ATOM 0 H LYS A 44 -1.572 -16.679 -3.358 1.00 0.00 H new ATOM 0 HA LYS A 44 -0.912 -15.811 -0.616 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.942 -16.066 -3.008 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.294 -14.995 -1.666 1.00 0.00 H new ATOM 0 HG2 LYS A 44 0.690 -17.907 -1.147 1.00 0.00 H new ATOM 0 HG3 LYS A 44 2.282 -17.427 -1.702 1.00 0.00 H new ATOM 0 HD2 LYS A 44 2.492 -15.860 0.210 1.00 0.00 H new ATOM 0 HD3 LYS A 44 0.885 -16.294 0.756 1.00 0.00 H new ATOM 0 HE2 LYS A 44 3.180 -18.275 0.459 1.00 0.00 H new ATOM 0 HE3 LYS A 44 2.750 -17.490 1.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 1.698 -19.577 1.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 0.462 -18.460 1.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.111 -19.397 0.388 1.00 0.00 H new ATOM 568 N VAL A 45 -0.985 -13.357 -1.329 1.00 0.00 N ATOM 569 CA VAL A 45 -1.371 -11.992 -1.674 1.00 0.00 C ATOM 570 C VAL A 45 -0.170 -11.055 -1.634 1.00 0.00 C ATOM 571 O VAL A 45 0.458 -10.874 -0.590 1.00 0.00 O ATOM 572 CB VAL A 45 -2.457 -11.459 -0.720 1.00 0.00 C ATOM 573 CG1 VAL A 45 -2.822 -10.026 -1.074 1.00 0.00 C ATOM 574 CG2 VAL A 45 -3.685 -12.356 -0.759 1.00 0.00 C ATOM 0 H VAL A 45 -0.568 -13.457 -0.403 1.00 0.00 H new ATOM 0 HA VAL A 45 -1.771 -12.022 -2.688 1.00 0.00 H new ATOM 0 HB VAL A 45 -2.061 -11.467 0.295 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.590 -9.667 -0.390 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -1.938 -9.394 -0.991 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -3.200 -9.989 -2.096 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -4.443 -11.965 -0.080 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -4.085 -12.381 -1.773 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -3.408 -13.365 -0.453 1.00 0.00 H new ATOM 584 N THR A 46 0.144 -10.457 -2.779 1.00 0.00 N ATOM 585 CA THR A 46 1.271 -9.537 -2.876 1.00 0.00 C ATOM 586 C THR A 46 0.796 -8.111 -3.130 1.00 0.00 C ATOM 587 O THR A 46 -0.068 -7.876 -3.976 1.00 0.00 O ATOM 588 CB THR A 46 2.239 -9.952 -4.000 1.00 0.00 C ATOM 589 OG1 THR A 46 1.526 -10.098 -5.233 1.00 0.00 O ATOM 590 CG2 THR A 46 2.941 -11.257 -3.656 1.00 0.00 C ATOM 0 H THR A 46 -0.366 -10.593 -3.652 1.00 0.00 H new ATOM 0 HA THR A 46 1.796 -9.577 -1.921 1.00 0.00 H new ATOM 0 HB THR A 46 2.991 -9.171 -4.107 1.00 0.00 H new ATOM 0 HG1 THR A 46 0.826 -9.415 -5.289 1.00 0.00 H new ATOM 0 HG21 THR A 46 3.619 -11.529 -4.465 1.00 0.00 H new ATOM 0 HG22 THR A 46 3.508 -11.133 -2.733 1.00 0.00 H new ATOM 0 HG23 THR A 46 2.200 -12.045 -3.523 1.00 0.00 H new ATOM 598 N CYS A 47 1.365 -7.164 -2.394 1.00 0.00 N ATOM 599 CA CYS A 47 0.999 -5.759 -2.540 1.00 0.00 C ATOM 600 C CYS A 47 2.170 -4.945 -3.080 1.00 0.00 C ATOM 601 O CYS A 47 3.320 -5.162 -2.697 1.00 0.00 O ATOM 602 CB CYS A 47 0.541 -5.188 -1.198 1.00 0.00 C ATOM 603 SG CYS A 47 0.353 -3.389 -1.186 1.00 0.00 S ATOM 0 H CYS A 47 2.081 -7.342 -1.690 1.00 0.00 H new ATOM 0 HA CYS A 47 0.177 -5.696 -3.253 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -0.411 -5.644 -0.927 1.00 0.00 H new ATOM 0 HB3 CYS A 47 1.260 -5.473 -0.430 1.00 0.00 H new ATOM 0 HG CYS A 47 -0.903 -3.083 -1.324 1.00 0.00 H new ATOM 609 N THR A 48 1.871 -4.009 -3.975 1.00 0.00 N ATOM 610 CA THR A 48 2.899 -3.164 -4.570 1.00 0.00 C ATOM 611 C THR A 48 2.406 -1.731 -4.735 1.00 0.00 C ATOM 612 O THR A 48 1.523 -1.457 -5.547 1.00 0.00 O ATOM 613 CB THR A 48 3.343 -3.703 -5.944 1.00 0.00 C ATOM 614 OG1 THR A 48 3.786 -5.059 -5.818 1.00 0.00 O ATOM 615 CG2 THR A 48 4.461 -2.850 -6.524 1.00 0.00 C ATOM 0 H THR A 48 0.925 -3.817 -4.304 1.00 0.00 H new ATOM 0 HA THR A 48 3.751 -3.176 -3.890 1.00 0.00 H new ATOM 0 HB THR A 48 2.489 -3.662 -6.620 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.065 -5.395 -6.695 1.00 0.00 H new ATOM 0 HG21 THR A 48 4.758 -3.250 -7.494 1.00 0.00 H new ATOM 0 HG22 THR A 48 4.111 -1.825 -6.646 1.00 0.00 H new ATOM 0 HG23 THR A 48 5.317 -2.863 -5.849 1.00 0.00 H new ATOM 623 N VAL A 49 2.983 -0.819 -3.959 1.00 0.00 N ATOM 624 CA VAL A 49 2.603 0.587 -4.020 1.00 0.00 C ATOM 625 C VAL A 49 3.377 1.319 -5.111 1.00 0.00 C ATOM 626 O VAL A 49 4.605 1.410 -5.062 1.00 0.00 O ATOM 627 CB VAL A 49 2.845 1.294 -2.672 1.00 0.00 C ATOM 628 CG1 VAL A 49 2.445 2.759 -2.758 1.00 0.00 C ATOM 629 CG2 VAL A 49 2.087 0.588 -1.558 1.00 0.00 C ATOM 0 H VAL A 49 3.715 -1.029 -3.281 1.00 0.00 H new ATOM 0 HA VAL A 49 1.538 0.617 -4.251 1.00 0.00 H new ATOM 0 HB VAL A 49 3.909 1.247 -2.442 1.00 0.00 H new ATOM 0 HG11 VAL A 49 2.623 3.242 -1.797 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.038 3.253 -3.528 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.387 2.833 -3.011 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.269 1.100 -0.613 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.020 0.602 -1.779 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.429 -0.444 -1.483 1.00 0.00 H new ATOM 639 N LEU A 50 2.653 1.839 -6.095 1.00 0.00 N ATOM 640 CA LEU A 50 3.272 2.565 -7.199 1.00 0.00 C ATOM 641 C LEU A 50 3.102 4.070 -7.025 1.00 0.00 C ATOM 642 O LEU A 50 2.015 4.612 -7.234 1.00 0.00 O ATOM 643 CB LEU A 50 2.662 2.122 -8.531 1.00 0.00 C ATOM 644 CG LEU A 50 3.531 2.335 -9.771 1.00 0.00 C ATOM 645 CD1 LEU A 50 3.124 1.377 -10.879 1.00 0.00 C ATOM 646 CD2 LEU A 50 3.435 3.777 -10.248 1.00 0.00 C ATOM 0 H LEU A 50 1.637 1.772 -6.152 1.00 0.00 H new ATOM 0 HA LEU A 50 4.338 2.337 -7.200 1.00 0.00 H new ATOM 0 HB2 LEU A 50 2.417 1.062 -8.461 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.723 2.657 -8.674 1.00 0.00 H new ATOM 0 HG LEU A 50 4.568 2.130 -9.504 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.753 1.543 -11.753 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.245 0.350 -10.535 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.081 1.550 -11.145 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.060 3.910 -11.131 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.400 4.010 -10.497 1.00 0.00 H new ATOM 0 HD23 LEU A 50 3.777 4.445 -9.458 1.00 0.00 H new ATOM 658 N THR A 51 4.183 4.743 -6.644 1.00 0.00 N ATOM 659 CA THR A 51 4.155 6.185 -6.442 1.00 0.00 C ATOM 660 C THR A 51 3.892 6.919 -7.753 1.00 0.00 C ATOM 661 O THR A 51 4.268 6.463 -8.833 1.00 0.00 O ATOM 662 CB THR A 51 5.477 6.696 -5.839 1.00 0.00 C ATOM 663 OG1 THR A 51 6.549 6.488 -6.764 1.00 0.00 O ATOM 664 CG2 THR A 51 5.785 5.983 -4.531 1.00 0.00 C ATOM 0 H THR A 51 5.090 4.311 -6.469 1.00 0.00 H new ATOM 0 HA THR A 51 3.343 6.389 -5.744 1.00 0.00 H new ATOM 0 HB THR A 51 5.372 7.762 -5.638 1.00 0.00 H new ATOM 0 HG1 THR A 51 6.514 5.570 -7.105 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.723 6.360 -4.123 1.00 0.00 H new ATOM 0 HG22 THR A 51 4.980 6.166 -3.819 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.873 4.912 -4.712 1.00 0.00 H new ATOM 672 N PRO A 52 3.232 8.082 -7.659 1.00 0.00 N ATOM 673 CA PRO A 52 2.906 8.903 -8.829 1.00 0.00 C ATOM 674 C PRO A 52 4.141 9.543 -9.451 1.00 0.00 C ATOM 675 O PRO A 52 4.047 10.251 -10.455 1.00 0.00 O ATOM 676 CB PRO A 52 1.976 9.978 -8.259 1.00 0.00 C ATOM 677 CG PRO A 52 2.345 10.073 -6.819 1.00 0.00 C ATOM 678 CD PRO A 52 2.753 8.686 -6.405 1.00 0.00 C ATOM 0 HA PRO A 52 2.459 8.313 -9.629 1.00 0.00 H new ATOM 0 HB2 PRO A 52 2.115 10.932 -8.767 1.00 0.00 H new ATOM 0 HB3 PRO A 52 0.929 9.701 -8.382 1.00 0.00 H new ATOM 0 HG2 PRO A 52 3.161 10.781 -6.671 1.00 0.00 H new ATOM 0 HG3 PRO A 52 1.504 10.427 -6.223 1.00 0.00 H new ATOM 0 HD2 PRO A 52 3.534 8.707 -5.645 1.00 0.00 H new ATOM 0 HD3 PRO A 52 1.915 8.129 -5.985 1.00 0.00 H new ATOM 686 N ASP A 53 5.299 9.289 -8.852 1.00 0.00 N ATOM 687 CA ASP A 53 6.554 9.839 -9.348 1.00 0.00 C ATOM 688 C ASP A 53 7.117 8.978 -10.474 1.00 0.00 C ATOM 689 O ASP A 53 7.841 9.467 -11.342 1.00 0.00 O ATOM 690 CB ASP A 53 7.574 9.945 -8.214 1.00 0.00 C ATOM 691 CG ASP A 53 8.581 11.055 -8.441 1.00 0.00 C ATOM 692 OD1 ASP A 53 8.158 12.180 -8.779 1.00 0.00 O ATOM 693 OD2 ASP A 53 9.793 10.799 -8.283 1.00 0.00 O ATOM 0 H ASP A 53 5.394 8.705 -8.021 1.00 0.00 H new ATOM 0 HA ASP A 53 6.354 10.836 -9.741 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.051 10.120 -7.274 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.101 8.996 -8.113 1.00 0.00 H new ATOM 698 N GLY A 54 6.779 7.692 -10.455 1.00 0.00 N ATOM 699 CA GLY A 54 7.259 6.783 -11.479 1.00 0.00 C ATOM 700 C GLY A 54 8.193 5.726 -10.924 1.00 0.00 C ATOM 701 O GLY A 54 8.966 5.117 -11.664 1.00 0.00 O ATOM 0 H GLY A 54 6.181 7.264 -9.748 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.408 6.297 -11.957 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.777 7.352 -12.252 1.00 0.00 H new ATOM 705 N THR A 55 8.123 5.505 -9.615 1.00 0.00 N ATOM 706 CA THR A 55 8.970 4.516 -8.960 1.00 0.00 C ATOM 707 C THR A 55 8.158 3.632 -8.021 1.00 0.00 C ATOM 708 O THR A 55 7.119 4.046 -7.508 1.00 0.00 O ATOM 709 CB THR A 55 10.103 5.187 -8.162 1.00 0.00 C ATOM 710 OG1 THR A 55 9.553 6.017 -7.133 1.00 0.00 O ATOM 711 CG2 THR A 55 10.987 6.023 -9.076 1.00 0.00 C ATOM 0 H THR A 55 7.488 5.998 -8.987 1.00 0.00 H new ATOM 0 HA THR A 55 9.405 3.901 -9.748 1.00 0.00 H new ATOM 0 HB THR A 55 10.712 4.404 -7.710 1.00 0.00 H new ATOM 0 HG1 THR A 55 8.579 6.062 -7.234 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.780 6.487 -8.490 1.00 0.00 H new ATOM 0 HG22 THR A 55 11.428 5.383 -9.841 1.00 0.00 H new ATOM 0 HG23 THR A 55 10.387 6.798 -9.553 1.00 0.00 H new ATOM 719 N GLU A 56 8.638 2.412 -7.801 1.00 0.00 N ATOM 720 CA GLU A 56 7.954 1.470 -6.923 1.00 0.00 C ATOM 721 C GLU A 56 8.414 1.640 -5.477 1.00 0.00 C ATOM 722 O GLU A 56 9.565 1.987 -5.218 1.00 0.00 O ATOM 723 CB GLU A 56 8.208 0.033 -7.384 1.00 0.00 C ATOM 724 CG GLU A 56 7.547 -0.308 -8.708 1.00 0.00 C ATOM 725 CD GLU A 56 8.420 0.031 -9.900 1.00 0.00 C ATOM 726 OE1 GLU A 56 8.553 1.231 -10.218 1.00 0.00 O ATOM 727 OE2 GLU A 56 8.973 -0.905 -10.516 1.00 0.00 O ATOM 0 H GLU A 56 9.497 2.053 -8.218 1.00 0.00 H new ATOM 0 HA GLU A 56 6.885 1.677 -6.973 1.00 0.00 H new ATOM 0 HB2 GLU A 56 9.283 -0.126 -7.473 1.00 0.00 H new ATOM 0 HB3 GLU A 56 7.846 -0.654 -6.619 1.00 0.00 H new ATOM 0 HG2 GLU A 56 7.309 -1.371 -8.728 1.00 0.00 H new ATOM 0 HG3 GLU A 56 6.603 0.232 -8.788 1.00 0.00 H new ATOM 734 N ALA A 57 7.503 1.398 -4.541 1.00 0.00 N ATOM 735 CA ALA A 57 7.814 1.522 -3.122 1.00 0.00 C ATOM 736 C ALA A 57 7.798 0.162 -2.434 1.00 0.00 C ATOM 737 O ALA A 57 7.623 -0.869 -3.083 1.00 0.00 O ATOM 738 CB ALA A 57 6.832 2.469 -2.448 1.00 0.00 C ATOM 0 H ALA A 57 6.543 1.115 -4.739 1.00 0.00 H new ATOM 0 HA ALA A 57 8.820 1.933 -3.031 1.00 0.00 H new ATOM 0 HB1 ALA A 57 7.076 2.552 -1.389 1.00 0.00 H new ATOM 0 HB2 ALA A 57 6.897 3.452 -2.914 1.00 0.00 H new ATOM 0 HB3 ALA A 57 5.819 2.082 -2.558 1.00 0.00 H new ATOM 744 N GLU A 58 7.982 0.167 -1.117 1.00 0.00 N ATOM 745 CA GLU A 58 7.990 -1.068 -0.343 1.00 0.00 C ATOM 746 C GLU A 58 6.746 -1.167 0.535 1.00 0.00 C ATOM 747 O GLU A 58 6.354 -0.199 1.185 1.00 0.00 O ATOM 748 CB GLU A 58 9.248 -1.143 0.525 1.00 0.00 C ATOM 749 CG GLU A 58 10.524 -1.361 -0.270 1.00 0.00 C ATOM 750 CD GLU A 58 11.668 -1.866 0.588 1.00 0.00 C ATOM 751 OE1 GLU A 58 11.581 -3.011 1.078 1.00 0.00 O ATOM 752 OE2 GLU A 58 12.650 -1.116 0.769 1.00 0.00 O ATOM 0 H GLU A 58 8.127 1.012 -0.565 1.00 0.00 H new ATOM 0 HA GLU A 58 7.988 -1.905 -1.041 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.340 -0.220 1.097 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.135 -1.954 1.244 1.00 0.00 H new ATOM 0 HG2 GLU A 58 10.331 -2.076 -1.070 1.00 0.00 H new ATOM 0 HG3 GLU A 58 10.817 -0.424 -0.744 1.00 0.00 H new ATOM 759 N ALA A 59 6.132 -2.345 0.549 1.00 0.00 N ATOM 760 CA ALA A 59 4.933 -2.572 1.348 1.00 0.00 C ATOM 761 C ALA A 59 5.058 -3.846 2.175 1.00 0.00 C ATOM 762 O ALA A 59 5.383 -4.911 1.648 1.00 0.00 O ATOM 763 CB ALA A 59 3.706 -2.641 0.450 1.00 0.00 C ATOM 0 H ALA A 59 6.444 -3.157 0.017 1.00 0.00 H new ATOM 0 HA ALA A 59 4.820 -1.734 2.035 1.00 0.00 H new ATOM 0 HB1 ALA A 59 2.818 -2.811 1.059 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.599 -1.702 -0.093 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.821 -3.460 -0.260 1.00 0.00 H new ATOM 769 N ASP A 60 4.798 -3.732 3.473 1.00 0.00 N ATOM 770 CA ASP A 60 4.882 -4.876 4.374 1.00 0.00 C ATOM 771 C ASP A 60 3.697 -5.814 4.171 1.00 0.00 C ATOM 772 O ASP A 60 2.567 -5.369 3.960 1.00 0.00 O ATOM 773 CB ASP A 60 4.933 -4.405 5.827 1.00 0.00 C ATOM 774 CG ASP A 60 5.713 -5.354 6.717 1.00 0.00 C ATOM 775 OD1 ASP A 60 5.685 -6.573 6.450 1.00 0.00 O ATOM 776 OD2 ASP A 60 6.352 -4.876 7.678 1.00 0.00 O ATOM 0 H ASP A 60 4.527 -2.859 3.925 1.00 0.00 H new ATOM 0 HA ASP A 60 5.798 -5.421 4.146 1.00 0.00 H new ATOM 0 HB2 ASP A 60 5.388 -3.415 5.869 1.00 0.00 H new ATOM 0 HB3 ASP A 60 3.917 -4.305 6.209 1.00 0.00 H new ATOM 781 N VAL A 61 3.961 -7.115 4.235 1.00 0.00 N ATOM 782 CA VAL A 61 2.915 -8.117 4.059 1.00 0.00 C ATOM 783 C VAL A 61 2.978 -9.175 5.156 1.00 0.00 C ATOM 784 O VAL A 61 3.884 -10.008 5.177 1.00 0.00 O ATOM 785 CB VAL A 61 3.026 -8.809 2.687 1.00 0.00 C ATOM 786 CG1 VAL A 61 1.920 -9.838 2.518 1.00 0.00 C ATOM 787 CG2 VAL A 61 2.984 -7.780 1.568 1.00 0.00 C ATOM 0 H VAL A 61 4.890 -7.500 4.407 1.00 0.00 H new ATOM 0 HA VAL A 61 1.961 -7.593 4.117 1.00 0.00 H new ATOM 0 HB VAL A 61 3.983 -9.328 2.637 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.014 -10.317 1.543 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.001 -10.591 3.302 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.950 -9.345 2.588 1.00 0.00 H new ATOM 0 HG21 VAL A 61 3.064 -8.286 0.606 1.00 0.00 H new ATOM 0 HG22 VAL A 61 2.043 -7.232 1.613 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.815 -7.084 1.682 1.00 0.00 H new ATOM 797 N ILE A 62 2.009 -9.135 6.063 1.00 0.00 N ATOM 798 CA ILE A 62 1.953 -10.092 7.163 1.00 0.00 C ATOM 799 C ILE A 62 0.919 -11.179 6.892 1.00 0.00 C ATOM 800 O ILE A 62 -0.284 -10.944 6.992 1.00 0.00 O ATOM 801 CB ILE A 62 1.616 -9.398 8.495 1.00 0.00 C ATOM 802 CG1 ILE A 62 2.769 -8.492 8.930 1.00 0.00 C ATOM 803 CG2 ILE A 62 1.316 -10.433 9.570 1.00 0.00 C ATOM 804 CD1 ILE A 62 2.665 -7.081 8.396 1.00 0.00 C ATOM 0 H ILE A 62 1.252 -8.451 6.059 1.00 0.00 H new ATOM 0 HA ILE A 62 2.941 -10.545 7.239 1.00 0.00 H new ATOM 0 HB ILE A 62 0.728 -8.782 8.352 1.00 0.00 H new ATOM 0 HG12 ILE A 62 2.802 -8.458 10.019 1.00 0.00 H new ATOM 0 HG13 ILE A 62 3.710 -8.930 8.596 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.079 -9.927 10.506 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.466 -11.042 9.262 1.00 0.00 H new ATOM 0 HG23 ILE A 62 2.187 -11.072 9.713 1.00 0.00 H new ATOM 0 HD11 ILE A 62 3.516 -6.496 8.745 1.00 0.00 H new ATOM 0 HD12 ILE A 62 2.663 -7.104 7.306 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.741 -6.625 8.751 1.00 0.00 H new ATOM 816 N GLU A 63 1.398 -12.372 6.551 1.00 0.00 N ATOM 817 CA GLU A 63 0.514 -13.497 6.268 1.00 0.00 C ATOM 818 C GLU A 63 -0.016 -14.111 7.560 1.00 0.00 C ATOM 819 O GLU A 63 0.729 -14.300 8.522 1.00 0.00 O ATOM 820 CB GLU A 63 1.250 -14.559 5.449 1.00 0.00 C ATOM 821 CG GLU A 63 2.414 -15.199 6.189 1.00 0.00 C ATOM 822 CD GLU A 63 3.061 -16.320 5.399 1.00 0.00 C ATOM 823 OE1 GLU A 63 2.431 -17.388 5.260 1.00 0.00 O ATOM 824 OE2 GLU A 63 4.198 -16.128 4.920 1.00 0.00 O ATOM 0 H GLU A 63 2.392 -12.584 6.464 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.332 -13.125 5.690 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.543 -15.336 5.159 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.620 -14.105 4.530 1.00 0.00 H new ATOM 0 HG2 GLU A 63 3.162 -14.437 6.411 1.00 0.00 H new ATOM 0 HG3 GLU A 63 2.062 -15.589 7.144 1.00 0.00 H new ATOM 831 N ASN A 64 -1.309 -14.421 7.575 1.00 0.00 N ATOM 832 CA ASN A 64 -1.940 -15.013 8.749 1.00 0.00 C ATOM 833 C ASN A 64 -2.237 -16.492 8.519 1.00 0.00 C ATOM 834 O ASN A 64 -2.348 -16.942 7.379 1.00 0.00 O ATOM 835 CB ASN A 64 -3.231 -14.268 9.090 1.00 0.00 C ATOM 836 CG ASN A 64 -3.004 -13.140 10.077 1.00 0.00 C ATOM 837 OD1 ASN A 64 -3.211 -13.302 11.281 1.00 0.00 O ATOM 838 ND2 ASN A 64 -2.577 -11.988 9.572 1.00 0.00 N ATOM 0 H ASN A 64 -1.940 -14.272 6.787 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.247 -14.926 9.586 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -3.667 -13.865 8.176 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -3.954 -14.970 9.505 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -2.407 -11.193 10.188 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.419 -11.899 8.568 1.00 0.00 H new ATOM 845 N GLU A 65 -2.366 -17.241 9.609 1.00 0.00 N ATOM 846 CA GLU A 65 -2.651 -18.668 9.526 1.00 0.00 C ATOM 847 C GLU A 65 -4.154 -18.927 9.584 1.00 0.00 C ATOM 848 O GLU A 65 -4.592 -20.062 9.773 1.00 0.00 O ATOM 849 CB GLU A 65 -1.949 -19.419 10.659 1.00 0.00 C ATOM 850 CG GLU A 65 -2.382 -18.972 12.045 1.00 0.00 C ATOM 851 CD GLU A 65 -1.548 -17.820 12.573 1.00 0.00 C ATOM 852 OE1 GLU A 65 -0.393 -17.669 12.125 1.00 0.00 O ATOM 853 OE2 GLU A 65 -2.052 -17.072 13.437 1.00 0.00 O ATOM 0 H GLU A 65 -2.278 -16.883 10.560 1.00 0.00 H new ATOM 0 HA GLU A 65 -2.273 -19.032 8.571 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -2.145 -20.486 10.553 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -0.872 -19.282 10.562 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.430 -18.674 12.016 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -2.309 -19.814 12.734 1.00 0.00 H new ATOM 860 N ASP A 66 -4.938 -17.867 9.421 1.00 0.00 N ATOM 861 CA ASP A 66 -6.391 -17.978 9.455 1.00 0.00 C ATOM 862 C ASP A 66 -6.987 -17.733 8.072 1.00 0.00 C ATOM 863 O ASP A 66 -8.114 -18.138 7.789 1.00 0.00 O ATOM 864 CB ASP A 66 -6.977 -16.985 10.460 1.00 0.00 C ATOM 865 CG ASP A 66 -8.447 -16.709 10.211 1.00 0.00 C ATOM 866 OD1 ASP A 66 -9.240 -17.673 10.221 1.00 0.00 O ATOM 867 OD2 ASP A 66 -8.804 -15.531 10.006 1.00 0.00 O ATOM 0 H ASP A 66 -4.591 -16.921 9.264 1.00 0.00 H new ATOM 0 HA ASP A 66 -6.646 -18.991 9.767 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.850 -17.376 11.469 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -6.421 -16.049 10.408 1.00 0.00 H new ATOM 872 N GLY A 67 -6.221 -17.065 7.213 1.00 0.00 N ATOM 873 CA GLY A 67 -6.691 -16.777 5.870 1.00 0.00 C ATOM 874 C GLY A 67 -6.788 -15.289 5.598 1.00 0.00 C ATOM 875 O GLY A 67 -7.716 -14.831 4.929 1.00 0.00 O ATOM 0 H GLY A 67 -5.285 -16.719 7.423 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -6.015 -17.233 5.146 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -7.670 -17.235 5.725 1.00 0.00 H new ATOM 879 N THR A 68 -5.829 -14.530 6.119 1.00 0.00 N ATOM 880 CA THR A 68 -5.812 -13.084 5.930 1.00 0.00 C ATOM 881 C THR A 68 -4.386 -12.568 5.770 1.00 0.00 C ATOM 882 O THR A 68 -3.422 -13.291 6.021 1.00 0.00 O ATOM 883 CB THR A 68 -6.480 -12.356 7.111 1.00 0.00 C ATOM 884 OG1 THR A 68 -5.893 -12.784 8.346 1.00 0.00 O ATOM 885 CG2 THR A 68 -7.976 -12.624 7.136 1.00 0.00 C ATOM 0 H THR A 68 -5.054 -14.892 6.675 1.00 0.00 H new ATOM 0 HA THR A 68 -6.375 -12.877 5.020 1.00 0.00 H new ATOM 0 HB THR A 68 -6.321 -11.285 6.985 1.00 0.00 H new ATOM 0 HG1 THR A 68 -6.322 -12.315 9.092 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.426 -12.099 7.979 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.425 -12.271 6.208 1.00 0.00 H new ATOM 0 HG23 THR A 68 -8.152 -13.695 7.239 1.00 0.00 H new ATOM 893 N TYR A 69 -4.260 -11.314 5.352 1.00 0.00 N ATOM 894 CA TYR A 69 -2.952 -10.701 5.157 1.00 0.00 C ATOM 895 C TYR A 69 -2.996 -9.209 5.474 1.00 0.00 C ATOM 896 O TYR A 69 -3.749 -8.454 4.859 1.00 0.00 O ATOM 897 CB TYR A 69 -2.475 -10.914 3.720 1.00 0.00 C ATOM 898 CG TYR A 69 -2.257 -12.366 3.362 1.00 0.00 C ATOM 899 CD1 TYR A 69 -3.334 -13.225 3.178 1.00 0.00 C ATOM 900 CD2 TYR A 69 -0.976 -12.881 3.210 1.00 0.00 C ATOM 901 CE1 TYR A 69 -3.140 -14.554 2.853 1.00 0.00 C ATOM 902 CE2 TYR A 69 -0.773 -14.208 2.884 1.00 0.00 C ATOM 903 CZ TYR A 69 -1.858 -15.040 2.706 1.00 0.00 C ATOM 904 OH TYR A 69 -1.660 -16.364 2.382 1.00 0.00 O ATOM 0 H TYR A 69 -5.048 -10.702 5.142 1.00 0.00 H new ATOM 0 HA TYR A 69 -2.250 -11.179 5.841 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -3.208 -10.486 3.036 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -1.543 -10.368 3.571 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -4.340 -12.847 3.291 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -0.124 -12.233 3.349 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -3.988 -15.209 2.715 1.00 0.00 H new ATOM 0 HE2 TYR A 69 0.230 -14.592 2.769 1.00 0.00 H new ATOM 0 HH TYR A 69 -1.834 -16.497 1.427 1.00 0.00 H new ATOM 914 N ASP A 70 -2.182 -8.792 6.438 1.00 0.00 N ATOM 915 CA ASP A 70 -2.126 -7.390 6.838 1.00 0.00 C ATOM 916 C ASP A 70 -1.026 -6.654 6.080 1.00 0.00 C ATOM 917 O ASP A 70 0.133 -7.068 6.091 1.00 0.00 O ATOM 918 CB ASP A 70 -1.888 -7.277 8.345 1.00 0.00 C ATOM 919 CG ASP A 70 -2.505 -8.426 9.117 1.00 0.00 C ATOM 920 OD1 ASP A 70 -3.615 -8.862 8.745 1.00 0.00 O ATOM 921 OD2 ASP A 70 -1.880 -8.890 10.093 1.00 0.00 O ATOM 0 H ASP A 70 -1.552 -9.404 6.957 1.00 0.00 H new ATOM 0 HA ASP A 70 -3.083 -6.928 6.594 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.816 -7.247 8.539 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -2.304 -6.336 8.706 1.00 0.00 H new ATOM 926 N ILE A 71 -1.399 -5.561 5.422 1.00 0.00 N ATOM 927 CA ILE A 71 -0.444 -4.767 4.659 1.00 0.00 C ATOM 928 C ILE A 71 -0.532 -3.291 5.034 1.00 0.00 C ATOM 929 O ILE A 71 -1.619 -2.762 5.265 1.00 0.00 O ATOM 930 CB ILE A 71 -0.673 -4.914 3.143 1.00 0.00 C ATOM 931 CG1 ILE A 71 -0.474 -6.369 2.714 1.00 0.00 C ATOM 932 CG2 ILE A 71 0.264 -3.996 2.374 1.00 0.00 C ATOM 933 CD1 ILE A 71 -0.963 -6.658 1.313 1.00 0.00 C ATOM 0 H ILE A 71 -2.355 -5.206 5.402 1.00 0.00 H new ATOM 0 HA ILE A 71 0.548 -5.144 4.907 1.00 0.00 H new ATOM 0 HB ILE A 71 -1.699 -4.625 2.916 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.586 -6.617 2.779 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.997 -7.020 3.414 1.00 0.00 H new ATOM 0 HG21 ILE A 71 0.090 -4.112 1.304 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.077 -2.961 2.662 1.00 0.00 H new ATOM 0 HG23 ILE A 71 1.297 -4.256 2.603 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -0.790 -7.708 1.077 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -2.029 -6.442 1.248 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.423 -6.032 0.603 1.00 0.00 H new ATOM 945 N PHE A 72 0.620 -2.631 5.090 1.00 0.00 N ATOM 946 CA PHE A 72 0.673 -1.215 5.437 1.00 0.00 C ATOM 947 C PHE A 72 1.531 -0.443 4.438 1.00 0.00 C ATOM 948 O PHE A 72 2.497 -0.976 3.891 1.00 0.00 O ATOM 949 CB PHE A 72 1.229 -1.035 6.851 1.00 0.00 C ATOM 950 CG PHE A 72 0.603 -1.952 7.862 1.00 0.00 C ATOM 951 CD1 PHE A 72 0.887 -3.308 7.857 1.00 0.00 C ATOM 952 CD2 PHE A 72 -0.271 -1.458 8.818 1.00 0.00 C ATOM 953 CE1 PHE A 72 0.314 -4.155 8.786 1.00 0.00 C ATOM 954 CE2 PHE A 72 -0.847 -2.300 9.750 1.00 0.00 C ATOM 955 CZ PHE A 72 -0.556 -3.649 9.734 1.00 0.00 C ATOM 0 H PHE A 72 1.529 -3.053 4.900 1.00 0.00 H new ATOM 0 HA PHE A 72 -0.342 -0.819 5.401 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.305 -1.206 6.834 1.00 0.00 H new ATOM 0 HB3 PHE A 72 1.075 -0.002 7.165 1.00 0.00 H new ATOM 0 HD1 PHE A 72 1.565 -3.708 7.118 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -0.504 -0.404 8.835 1.00 0.00 H new ATOM 0 HE1 PHE A 72 0.545 -5.210 8.772 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -1.525 -1.902 10.491 1.00 0.00 H new ATOM 0 HZ PHE A 72 -1.007 -4.308 10.461 1.00 0.00 H new ATOM 965 N TYR A 73 1.173 0.814 4.207 1.00 0.00 N ATOM 966 CA TYR A 73 1.907 1.660 3.273 1.00 0.00 C ATOM 967 C TYR A 73 1.676 3.137 3.577 1.00 0.00 C ATOM 968 O TYR A 73 0.580 3.538 3.972 1.00 0.00 O ATOM 969 CB TYR A 73 1.486 1.352 1.834 1.00 0.00 C ATOM 970 CG TYR A 73 0.263 2.118 1.384 1.00 0.00 C ATOM 971 CD1 TYR A 73 0.339 3.473 1.083 1.00 0.00 C ATOM 972 CD2 TYR A 73 -0.969 1.487 1.257 1.00 0.00 C ATOM 973 CE1 TYR A 73 -0.775 4.176 0.672 1.00 0.00 C ATOM 974 CE2 TYR A 73 -2.089 2.184 0.845 1.00 0.00 C ATOM 975 CZ TYR A 73 -1.987 3.527 0.555 1.00 0.00 C ATOM 976 OH TYR A 73 -3.100 4.226 0.144 1.00 0.00 O ATOM 0 H TYR A 73 0.378 1.271 4.654 1.00 0.00 H new ATOM 0 HA TYR A 73 2.970 1.446 3.388 1.00 0.00 H new ATOM 0 HB2 TYR A 73 2.315 1.582 1.165 1.00 0.00 H new ATOM 0 HB3 TYR A 73 1.289 0.284 1.743 1.00 0.00 H new ATOM 0 HD1 TYR A 73 1.286 3.984 1.172 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -1.052 0.434 1.484 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -0.699 5.229 0.443 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -3.039 1.679 0.751 1.00 0.00 H new ATOM 0 HH TYR A 73 -3.872 3.623 0.113 1.00 0.00 H new ATOM 986 N THR A 74 2.715 3.942 3.389 1.00 0.00 N ATOM 987 CA THR A 74 2.628 5.375 3.643 1.00 0.00 C ATOM 988 C THR A 74 2.808 6.173 2.357 1.00 0.00 C ATOM 989 O THR A 74 3.387 5.683 1.387 1.00 0.00 O ATOM 990 CB THR A 74 3.685 5.829 4.669 1.00 0.00 C ATOM 991 OG1 THR A 74 3.547 5.077 5.879 1.00 0.00 O ATOM 992 CG2 THR A 74 3.543 7.314 4.970 1.00 0.00 C ATOM 0 H THR A 74 3.628 3.627 3.061 1.00 0.00 H new ATOM 0 HA THR A 74 1.634 5.565 4.049 1.00 0.00 H new ATOM 0 HB THR A 74 4.673 5.653 4.243 1.00 0.00 H new ATOM 0 HG1 THR A 74 4.223 5.370 6.525 1.00 0.00 H new ATOM 0 HG21 THR A 74 4.299 7.612 5.696 1.00 0.00 H new ATOM 0 HG22 THR A 74 3.677 7.886 4.052 1.00 0.00 H new ATOM 0 HG23 THR A 74 2.551 7.509 5.378 1.00 0.00 H new ATOM 1000 N ALA A 75 2.310 7.405 2.357 1.00 0.00 N ATOM 1001 CA ALA A 75 2.420 8.272 1.190 1.00 0.00 C ATOM 1002 C ALA A 75 3.170 9.557 1.529 1.00 0.00 C ATOM 1003 O ALA A 75 2.592 10.499 2.070 1.00 0.00 O ATOM 1004 CB ALA A 75 1.038 8.596 0.641 1.00 0.00 C ATOM 0 H ALA A 75 1.827 7.825 3.151 1.00 0.00 H new ATOM 0 HA ALA A 75 2.988 7.741 0.426 1.00 0.00 H new ATOM 0 HB1 ALA A 75 1.135 9.244 -0.230 1.00 0.00 H new ATOM 0 HB2 ALA A 75 0.536 7.673 0.352 1.00 0.00 H new ATOM 0 HB3 ALA A 75 0.452 9.104 1.407 1.00 0.00 H new ATOM 1010 N ALA A 76 4.458 9.587 1.208 1.00 0.00 N ATOM 1011 CA ALA A 76 5.286 10.755 1.477 1.00 0.00 C ATOM 1012 C ALA A 76 4.677 12.012 0.864 1.00 0.00 C ATOM 1013 O ALA A 76 4.426 12.996 1.561 1.00 0.00 O ATOM 1014 CB ALA A 76 6.695 10.537 0.948 1.00 0.00 C ATOM 0 H ALA A 76 4.952 8.815 0.761 1.00 0.00 H new ATOM 0 HA ALA A 76 5.334 10.895 2.557 1.00 0.00 H new ATOM 0 HB1 ALA A 76 7.302 11.418 1.156 1.00 0.00 H new ATOM 0 HB2 ALA A 76 7.137 9.668 1.436 1.00 0.00 H new ATOM 0 HB3 ALA A 76 6.658 10.368 -0.128 1.00 0.00 H new ATOM 1020 N LYS A 77 4.443 11.974 -0.443 1.00 0.00 N ATOM 1021 CA LYS A 77 3.863 13.109 -1.150 1.00 0.00 C ATOM 1022 C LYS A 77 2.530 12.730 -1.788 1.00 0.00 C ATOM 1023 O LYS A 77 2.275 11.568 -2.105 1.00 0.00 O ATOM 1024 CB LYS A 77 4.828 13.613 -2.226 1.00 0.00 C ATOM 1025 CG LYS A 77 4.730 12.853 -3.537 1.00 0.00 C ATOM 1026 CD LYS A 77 5.206 11.419 -3.386 1.00 0.00 C ATOM 1027 CE LYS A 77 5.798 10.889 -4.683 1.00 0.00 C ATOM 1028 NZ LYS A 77 6.856 9.870 -4.435 1.00 0.00 N ATOM 0 H LYS A 77 4.646 11.168 -1.035 1.00 0.00 H new ATOM 0 HA LYS A 77 3.687 13.904 -0.425 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.631 14.669 -2.413 1.00 0.00 H new ATOM 0 HB3 LYS A 77 5.848 13.541 -1.849 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.698 12.860 -3.886 1.00 0.00 H new ATOM 0 HG3 LYS A 77 5.327 13.358 -4.297 1.00 0.00 H new ATOM 0 HD2 LYS A 77 5.953 11.364 -2.594 1.00 0.00 H new ATOM 0 HD3 LYS A 77 4.371 10.788 -3.081 1.00 0.00 H new ATOM 0 HE2 LYS A 77 5.007 10.450 -5.291 1.00 0.00 H new ATOM 0 HE3 LYS A 77 6.218 11.716 -5.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 6.994 9.298 -5.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 7.747 10.347 -4.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 6.566 9.253 -3.650 1.00 0.00 H new ATOM 1042 N PRO A 78 1.659 13.731 -1.979 1.00 0.00 N ATOM 1043 CA PRO A 78 0.338 13.527 -2.582 1.00 0.00 C ATOM 1044 C PRO A 78 0.424 13.186 -4.066 1.00 0.00 C ATOM 1045 O PRO A 78 1.451 13.408 -4.705 1.00 0.00 O ATOM 1046 CB PRO A 78 -0.355 14.878 -2.383 1.00 0.00 C ATOM 1047 CG PRO A 78 0.757 15.864 -2.288 1.00 0.00 C ATOM 1048 CD PRO A 78 1.896 15.141 -1.625 1.00 0.00 C ATOM 0 HA PRO A 78 -0.192 12.689 -2.129 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -1.019 15.109 -3.216 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -0.965 14.881 -1.480 1.00 0.00 H new ATOM 0 HG2 PRO A 78 1.045 16.223 -3.276 1.00 0.00 H new ATOM 0 HG3 PRO A 78 0.457 16.736 -1.707 1.00 0.00 H new ATOM 0 HD2 PRO A 78 2.861 15.490 -1.992 1.00 0.00 H new ATOM 0 HD3 PRO A 78 1.892 15.290 -0.545 1.00 0.00 H new ATOM 1056 N GLY A 79 -0.663 12.644 -4.608 1.00 0.00 N ATOM 1057 CA GLY A 79 -0.688 12.281 -6.013 1.00 0.00 C ATOM 1058 C GLY A 79 -1.518 11.041 -6.275 1.00 0.00 C ATOM 1059 O GLY A 79 -2.260 10.584 -5.406 1.00 0.00 O ATOM 0 H GLY A 79 -1.526 12.450 -4.100 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -1.089 13.112 -6.593 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.331 12.112 -6.360 1.00 0.00 H new ATOM 1063 N THR A 80 -1.396 10.493 -7.482 1.00 0.00 N ATOM 1064 CA THR A 80 -2.143 9.300 -7.858 1.00 0.00 C ATOM 1065 C THR A 80 -1.342 8.036 -7.567 1.00 0.00 C ATOM 1066 O THR A 80 -0.394 7.711 -8.282 1.00 0.00 O ATOM 1067 CB THR A 80 -2.521 9.322 -9.351 1.00 0.00 C ATOM 1068 OG1 THR A 80 -3.233 10.525 -9.658 1.00 0.00 O ATOM 1069 CG2 THR A 80 -3.376 8.116 -9.711 1.00 0.00 C ATOM 0 H THR A 80 -0.787 10.857 -8.214 1.00 0.00 H new ATOM 0 HA THR A 80 -3.054 9.295 -7.260 1.00 0.00 H new ATOM 0 HB THR A 80 -1.602 9.284 -9.936 1.00 0.00 H new ATOM 0 HG1 THR A 80 -3.468 10.532 -10.609 1.00 0.00 H new ATOM 0 HG21 THR A 80 -3.630 8.154 -10.770 1.00 0.00 H new ATOM 0 HG22 THR A 80 -2.821 7.201 -9.503 1.00 0.00 H new ATOM 0 HG23 THR A 80 -4.290 8.128 -9.118 1.00 0.00 H new ATOM 1077 N TYR A 81 -1.731 7.324 -6.514 1.00 0.00 N ATOM 1078 CA TYR A 81 -1.047 6.095 -6.128 1.00 0.00 C ATOM 1079 C TYR A 81 -1.754 4.874 -6.708 1.00 0.00 C ATOM 1080 O TYR A 81 -2.978 4.761 -6.642 1.00 0.00 O ATOM 1081 CB TYR A 81 -0.978 5.983 -4.604 1.00 0.00 C ATOM 1082 CG TYR A 81 0.133 6.804 -3.986 1.00 0.00 C ATOM 1083 CD1 TYR A 81 0.152 8.188 -4.113 1.00 0.00 C ATOM 1084 CD2 TYR A 81 1.162 6.195 -3.279 1.00 0.00 C ATOM 1085 CE1 TYR A 81 1.165 8.942 -3.552 1.00 0.00 C ATOM 1086 CE2 TYR A 81 2.177 6.942 -2.712 1.00 0.00 C ATOM 1087 CZ TYR A 81 2.174 8.314 -2.851 1.00 0.00 C ATOM 1088 OH TYR A 81 3.185 9.060 -2.291 1.00 0.00 O ATOM 0 H TYR A 81 -2.516 7.577 -5.913 1.00 0.00 H new ATOM 0 HA TYR A 81 -0.034 6.130 -6.529 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.931 6.300 -4.181 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -0.841 4.937 -4.331 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.638 8.682 -4.659 1.00 0.00 H new ATOM 0 HD2 TYR A 81 1.169 5.120 -3.171 1.00 0.00 H new ATOM 0 HE1 TYR A 81 1.167 10.016 -3.662 1.00 0.00 H new ATOM 0 HE2 TYR A 81 2.969 6.454 -2.163 1.00 0.00 H new ATOM 0 HH TYR A 81 2.811 9.877 -1.899 1.00 0.00 H new ATOM 1098 N VAL A 82 -0.973 3.960 -7.274 1.00 0.00 N ATOM 1099 CA VAL A 82 -1.523 2.744 -7.863 1.00 0.00 C ATOM 1100 C VAL A 82 -1.004 1.503 -7.146 1.00 0.00 C ATOM 1101 O VAL A 82 0.180 1.177 -7.224 1.00 0.00 O ATOM 1102 CB VAL A 82 -1.176 2.640 -9.361 1.00 0.00 C ATOM 1103 CG1 VAL A 82 -1.735 1.355 -9.950 1.00 0.00 C ATOM 1104 CG2 VAL A 82 -1.700 3.855 -10.113 1.00 0.00 C ATOM 0 H VAL A 82 0.042 4.038 -7.337 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.606 2.799 -7.751 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.091 2.616 -9.466 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.480 1.299 -11.008 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.307 0.499 -9.428 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.819 1.344 -9.837 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -1.447 3.766 -11.169 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -2.783 3.912 -10.003 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.246 4.759 -9.706 1.00 0.00 H new ATOM 1114 N ILE A 83 -1.900 0.814 -6.446 1.00 0.00 N ATOM 1115 CA ILE A 83 -1.533 -0.393 -5.716 1.00 0.00 C ATOM 1116 C ILE A 83 -1.941 -1.646 -6.484 1.00 0.00 C ATOM 1117 O ILE A 83 -3.082 -1.768 -6.932 1.00 0.00 O ATOM 1118 CB ILE A 83 -2.183 -0.426 -4.320 1.00 0.00 C ATOM 1119 CG1 ILE A 83 -1.687 0.749 -3.475 1.00 0.00 C ATOM 1120 CG2 ILE A 83 -1.884 -1.748 -3.628 1.00 0.00 C ATOM 1121 CD1 ILE A 83 -2.553 1.033 -2.268 1.00 0.00 C ATOM 0 H ILE A 83 -2.884 1.071 -6.369 1.00 0.00 H new ATOM 0 HA ILE A 83 -0.449 -0.376 -5.603 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.263 -0.335 -4.435 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -0.670 0.543 -3.142 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -1.643 1.642 -4.099 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -2.350 -1.756 -2.643 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -2.282 -2.569 -4.224 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -0.806 -1.867 -3.521 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -2.142 1.878 -1.716 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.565 1.271 -2.594 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -2.577 0.155 -1.623 1.00 0.00 H new ATOM 1133 N TYR A 84 -1.004 -2.575 -6.631 1.00 0.00 N ATOM 1134 CA TYR A 84 -1.265 -3.818 -7.345 1.00 0.00 C ATOM 1135 C TYR A 84 -1.401 -4.987 -6.373 1.00 0.00 C ATOM 1136 O TYR A 84 -0.553 -5.188 -5.503 1.00 0.00 O ATOM 1137 CB TYR A 84 -0.144 -4.102 -8.347 1.00 0.00 C ATOM 1138 CG TYR A 84 -0.221 -3.255 -9.598 1.00 0.00 C ATOM 1139 CD1 TYR A 84 -1.299 -3.363 -10.467 1.00 0.00 C ATOM 1140 CD2 TYR A 84 0.783 -2.347 -9.909 1.00 0.00 C ATOM 1141 CE1 TYR A 84 -1.375 -2.592 -11.611 1.00 0.00 C ATOM 1142 CE2 TYR A 84 0.716 -1.572 -11.050 1.00 0.00 C ATOM 1143 CZ TYR A 84 -0.364 -1.698 -11.898 1.00 0.00 C ATOM 1144 OH TYR A 84 -0.434 -0.927 -13.036 1.00 0.00 O ATOM 0 H TYR A 84 -0.056 -2.491 -6.265 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.205 -3.706 -7.885 1.00 0.00 H new ATOM 0 HB2 TYR A 84 0.817 -3.932 -7.862 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.177 -5.155 -8.628 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -2.092 -4.062 -10.245 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.630 -2.245 -9.247 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -2.220 -2.688 -12.276 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.505 -0.871 -11.277 1.00 0.00 H new ATOM 0 HH TYR A 84 0.356 -0.350 -13.089 1.00 0.00 H new ATOM 1154 N VAL A 85 -2.474 -5.756 -6.529 1.00 0.00 N ATOM 1155 CA VAL A 85 -2.722 -6.906 -5.667 1.00 0.00 C ATOM 1156 C VAL A 85 -3.226 -8.097 -6.473 1.00 0.00 C ATOM 1157 O VAL A 85 -3.974 -7.935 -7.438 1.00 0.00 O ATOM 1158 CB VAL A 85 -3.747 -6.573 -4.566 1.00 0.00 C ATOM 1159 CG1 VAL A 85 -3.861 -7.722 -3.577 1.00 0.00 C ATOM 1160 CG2 VAL A 85 -3.364 -5.283 -3.855 1.00 0.00 C ATOM 0 H VAL A 85 -3.185 -5.604 -7.244 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.771 -7.163 -5.200 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.722 -6.429 -5.033 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -4.589 -7.468 -2.807 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -4.185 -8.622 -4.100 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -2.891 -7.901 -3.114 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -4.099 -5.063 -3.080 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.380 -5.397 -3.400 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.339 -4.465 -4.575 1.00 0.00 H new ATOM 1170 N ARG A 86 -2.814 -9.294 -6.070 1.00 0.00 N ATOM 1171 CA ARG A 86 -3.224 -10.514 -6.755 1.00 0.00 C ATOM 1172 C ARG A 86 -3.310 -11.684 -5.778 1.00 0.00 C ATOM 1173 O ARG A 86 -2.831 -11.598 -4.647 1.00 0.00 O ATOM 1174 CB ARG A 86 -2.243 -10.847 -7.880 1.00 0.00 C ATOM 1175 CG ARG A 86 -0.880 -11.303 -7.385 1.00 0.00 C ATOM 1176 CD ARG A 86 0.221 -10.937 -8.368 1.00 0.00 C ATOM 1177 NE ARG A 86 0.477 -9.498 -8.393 1.00 0.00 N ATOM 1178 CZ ARG A 86 1.170 -8.892 -9.349 1.00 0.00 C ATOM 1179 NH1 ARG A 86 1.674 -9.594 -10.355 1.00 0.00 N ATOM 1180 NH2 ARG A 86 1.360 -7.580 -9.301 1.00 0.00 N ATOM 0 H ARG A 86 -2.196 -9.445 -5.272 1.00 0.00 H new ATOM 0 HA ARG A 86 -4.213 -10.346 -7.182 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -2.673 -11.629 -8.506 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.115 -9.968 -8.511 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.672 -10.846 -6.417 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -0.889 -12.382 -7.233 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.137 -11.463 -8.099 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -0.058 -11.273 -9.367 1.00 0.00 H new ATOM 0 HE ARG A 86 0.103 -8.928 -7.634 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.530 -10.603 -10.396 1.00 0.00 H new ATOM 0 HH12 ARG A 86 2.206 -9.125 -11.088 1.00 0.00 H new ATOM 0 HH21 ARG A 86 0.973 -7.037 -8.529 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.893 -7.115 -10.036 1.00 0.00 H new ATOM 1194 N PHE A 87 -3.925 -12.775 -6.223 1.00 0.00 N ATOM 1195 CA PHE A 87 -4.076 -13.961 -5.388 1.00 0.00 C ATOM 1196 C PHE A 87 -3.606 -15.210 -6.128 1.00 0.00 C ATOM 1197 O PHE A 87 -4.256 -15.672 -7.065 1.00 0.00 O ATOM 1198 CB PHE A 87 -5.535 -14.127 -4.959 1.00 0.00 C ATOM 1199 CG PHE A 87 -5.765 -15.309 -4.061 1.00 0.00 C ATOM 1200 CD1 PHE A 87 -5.477 -15.234 -2.707 1.00 0.00 C ATOM 1201 CD2 PHE A 87 -6.270 -16.494 -4.570 1.00 0.00 C ATOM 1202 CE1 PHE A 87 -5.688 -16.320 -1.879 1.00 0.00 C ATOM 1203 CE2 PHE A 87 -6.483 -17.584 -3.746 1.00 0.00 C ATOM 1204 CZ PHE A 87 -6.192 -17.496 -2.398 1.00 0.00 C ATOM 0 H PHE A 87 -4.327 -12.862 -7.157 1.00 0.00 H new ATOM 0 HA PHE A 87 -3.457 -13.831 -4.500 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.860 -13.222 -4.445 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.157 -14.230 -5.848 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -5.083 -14.317 -2.295 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.500 -16.568 -5.623 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.459 -16.249 -0.826 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -6.876 -18.503 -4.155 1.00 0.00 H new ATOM 0 HZ PHE A 87 -6.358 -18.345 -1.752 1.00 0.00 H new ATOM 1214 N GLY A 88 -2.470 -15.752 -5.700 1.00 0.00 N ATOM 1215 CA GLY A 88 -1.931 -16.943 -6.331 1.00 0.00 C ATOM 1216 C GLY A 88 -1.402 -16.669 -7.725 1.00 0.00 C ATOM 1217 O GLY A 88 -1.151 -17.595 -8.494 1.00 0.00 O ATOM 0 H GLY A 88 -1.913 -15.387 -4.927 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.128 -17.347 -5.714 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.707 -17.706 -6.383 1.00 0.00 H new ATOM 1221 N GLY A 89 -1.233 -15.391 -8.053 1.00 0.00 N ATOM 1222 CA GLY A 89 -0.733 -15.021 -9.364 1.00 0.00 C ATOM 1223 C GLY A 89 -1.828 -14.509 -10.279 1.00 0.00 C ATOM 1224 O GLY A 89 -1.635 -14.402 -11.490 1.00 0.00 O ATOM 0 H GLY A 89 -1.434 -14.606 -7.434 1.00 0.00 H new ATOM 0 HA2 GLY A 89 0.033 -14.253 -9.254 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.254 -15.885 -9.824 1.00 0.00 H new ATOM 1228 N VAL A 90 -2.981 -14.193 -9.699 1.00 0.00 N ATOM 1229 CA VAL A 90 -4.113 -13.690 -10.470 1.00 0.00 C ATOM 1230 C VAL A 90 -4.521 -12.298 -10.001 1.00 0.00 C ATOM 1231 O VAL A 90 -4.914 -12.109 -8.851 1.00 0.00 O ATOM 1232 CB VAL A 90 -5.327 -14.632 -10.365 1.00 0.00 C ATOM 1233 CG1 VAL A 90 -6.409 -14.219 -11.350 1.00 0.00 C ATOM 1234 CG2 VAL A 90 -4.903 -16.075 -10.598 1.00 0.00 C ATOM 0 H VAL A 90 -3.157 -14.276 -8.698 1.00 0.00 H new ATOM 0 HA VAL A 90 -3.791 -13.640 -11.510 1.00 0.00 H new ATOM 0 HB VAL A 90 -5.738 -14.557 -9.358 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -7.259 -14.896 -11.262 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -6.731 -13.201 -11.131 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -6.014 -14.264 -12.365 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -5.773 -16.727 -10.520 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -4.466 -16.170 -11.592 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.166 -16.363 -9.849 1.00 0.00 H new ATOM 1244 N ASP A 91 -4.426 -11.326 -10.902 1.00 0.00 N ATOM 1245 CA ASP A 91 -4.787 -9.950 -10.582 1.00 0.00 C ATOM 1246 C ASP A 91 -6.286 -9.827 -10.326 1.00 0.00 C ATOM 1247 O ASP A 91 -7.087 -9.822 -11.260 1.00 0.00 O ATOM 1248 CB ASP A 91 -4.374 -9.014 -11.719 1.00 0.00 C ATOM 1249 CG ASP A 91 -4.623 -7.556 -11.388 1.00 0.00 C ATOM 1250 OD1 ASP A 91 -5.731 -7.061 -11.681 1.00 0.00 O ATOM 1251 OD2 ASP A 91 -3.708 -6.908 -10.836 1.00 0.00 O ATOM 0 H ASP A 91 -4.102 -11.466 -11.859 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.256 -9.663 -9.674 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.316 -9.158 -11.938 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.925 -9.278 -12.621 1.00 0.00 H new ATOM 1256 N ILE A 92 -6.656 -9.729 -9.053 1.00 0.00 N ATOM 1257 CA ILE A 92 -8.059 -9.607 -8.674 1.00 0.00 C ATOM 1258 C ILE A 92 -8.770 -8.559 -9.525 1.00 0.00 C ATOM 1259 O ILE A 92 -8.148 -7.661 -10.096 1.00 0.00 O ATOM 1260 CB ILE A 92 -8.210 -9.232 -7.188 1.00 0.00 C ATOM 1261 CG1 ILE A 92 -7.125 -8.233 -6.779 1.00 0.00 C ATOM 1262 CG2 ILE A 92 -8.144 -10.479 -6.318 1.00 0.00 C ATOM 1263 CD1 ILE A 92 -7.383 -7.575 -5.440 1.00 0.00 C ATOM 0 H ILE A 92 -6.005 -9.732 -8.268 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.517 -10.581 -8.844 1.00 0.00 H new ATOM 0 HB ILE A 92 -9.183 -8.763 -7.044 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -6.164 -8.747 -6.743 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -7.046 -7.461 -7.545 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -8.252 -10.198 -5.270 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -8.949 -11.160 -6.596 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.184 -10.974 -6.464 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.574 -6.880 -5.214 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.328 -7.033 -5.477 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.433 -8.338 -4.663 1.00 0.00 H new ATOM 1275 N PRO A 93 -10.103 -8.672 -9.612 1.00 0.00 N ATOM 1276 CA PRO A 93 -10.928 -7.742 -10.389 1.00 0.00 C ATOM 1277 C PRO A 93 -10.988 -6.356 -9.758 1.00 0.00 C ATOM 1278 O PRO A 93 -11.688 -5.471 -10.249 1.00 0.00 O ATOM 1279 CB PRO A 93 -12.311 -8.398 -10.375 1.00 0.00 C ATOM 1280 CG PRO A 93 -12.321 -9.234 -9.142 1.00 0.00 C ATOM 1281 CD PRO A 93 -10.909 -9.717 -8.958 1.00 0.00 C ATOM 0 HA PRO A 93 -10.529 -7.581 -11.390 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -13.104 -7.650 -10.353 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.470 -9.005 -11.266 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -12.651 -8.654 -8.280 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.010 -10.072 -9.244 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.654 -9.820 -7.903 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -10.754 -10.692 -9.420 1.00 0.00 H new ATOM 1289 N ASN A 94 -10.250 -6.173 -8.668 1.00 0.00 N ATOM 1290 CA ASN A 94 -10.220 -4.893 -7.970 1.00 0.00 C ATOM 1291 C ASN A 94 -8.904 -4.166 -8.224 1.00 0.00 C ATOM 1292 O ASN A 94 -8.724 -3.022 -7.803 1.00 0.00 O ATOM 1293 CB ASN A 94 -10.418 -5.103 -6.467 1.00 0.00 C ATOM 1294 CG ASN A 94 -11.880 -5.255 -6.092 1.00 0.00 C ATOM 1295 OD1 ASN A 94 -12.509 -4.315 -5.607 1.00 0.00 O ATOM 1296 ND2 ASN A 94 -12.428 -6.444 -6.317 1.00 0.00 N ATOM 0 H ASN A 94 -9.664 -6.895 -8.249 1.00 0.00 H new ATOM 0 HA ASN A 94 -11.034 -4.279 -8.355 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.871 -5.991 -6.152 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.993 -4.258 -5.926 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -13.408 -6.606 -6.086 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -11.869 -7.195 -6.721 1.00 0.00 H new ATOM 1303 N SER A 95 -7.988 -4.835 -8.914 1.00 0.00 N ATOM 1304 CA SER A 95 -6.686 -4.254 -9.222 1.00 0.00 C ATOM 1305 C SER A 95 -6.642 -3.750 -10.661 1.00 0.00 C ATOM 1306 O SER A 95 -7.221 -4.343 -11.571 1.00 0.00 O ATOM 1307 CB SER A 95 -5.578 -5.285 -8.997 1.00 0.00 C ATOM 1308 OG SER A 95 -4.389 -4.664 -8.539 1.00 0.00 O ATOM 0 H SER A 95 -8.123 -5.781 -9.271 1.00 0.00 H new ATOM 0 HA SER A 95 -6.527 -3.407 -8.554 1.00 0.00 H new ATOM 0 HB2 SER A 95 -5.909 -6.026 -8.269 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.379 -5.818 -9.927 1.00 0.00 H new ATOM 0 HG SER A 95 -4.595 -4.087 -7.774 1.00 0.00 H new ATOM 1314 N PRO A 96 -5.940 -2.628 -10.873 1.00 0.00 N ATOM 1315 CA PRO A 96 -5.246 -1.912 -9.798 1.00 0.00 C ATOM 1316 C PRO A 96 -6.215 -1.240 -8.831 1.00 0.00 C ATOM 1317 O PRO A 96 -7.431 -1.378 -8.958 1.00 0.00 O ATOM 1318 CB PRO A 96 -4.420 -0.862 -10.544 1.00 0.00 C ATOM 1319 CG PRO A 96 -5.151 -0.645 -11.824 1.00 0.00 C ATOM 1320 CD PRO A 96 -5.767 -1.970 -12.179 1.00 0.00 C ATOM 0 HA PRO A 96 -4.648 -2.583 -9.181 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -4.343 0.062 -9.971 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.403 -1.212 -10.723 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.916 0.123 -11.711 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -4.473 -0.307 -12.608 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.719 -1.845 -12.695 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -5.121 -2.550 -12.838 1.00 0.00 H new ATOM 1328 N PHE A 97 -5.667 -0.511 -7.864 1.00 0.00 N ATOM 1329 CA PHE A 97 -6.484 0.184 -6.874 1.00 0.00 C ATOM 1330 C PHE A 97 -6.229 1.688 -6.918 1.00 0.00 C ATOM 1331 O PHE A 97 -5.235 2.177 -6.382 1.00 0.00 O ATOM 1332 CB PHE A 97 -6.190 -0.354 -5.473 1.00 0.00 C ATOM 1333 CG PHE A 97 -6.838 -1.680 -5.191 1.00 0.00 C ATOM 1334 CD1 PHE A 97 -6.525 -2.794 -5.954 1.00 0.00 C ATOM 1335 CD2 PHE A 97 -7.759 -1.812 -4.165 1.00 0.00 C ATOM 1336 CE1 PHE A 97 -7.119 -4.015 -5.698 1.00 0.00 C ATOM 1337 CE2 PHE A 97 -8.355 -3.031 -3.904 1.00 0.00 C ATOM 1338 CZ PHE A 97 -8.035 -4.134 -4.672 1.00 0.00 C ATOM 0 H PHE A 97 -4.662 -0.386 -7.744 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.532 0.004 -7.112 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.112 -0.452 -5.349 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -6.531 0.372 -4.735 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -5.809 -2.707 -6.758 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -8.014 -0.953 -3.562 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -6.867 -4.875 -6.300 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -9.071 -3.122 -3.100 1.00 0.00 H new ATOM 0 HZ PHE A 97 -8.501 -5.087 -4.470 1.00 0.00 H new ATOM 1348 N THR A 98 -7.135 2.417 -7.563 1.00 0.00 N ATOM 1349 CA THR A 98 -7.009 3.864 -7.680 1.00 0.00 C ATOM 1350 C THR A 98 -7.095 4.535 -6.314 1.00 0.00 C ATOM 1351 O THR A 98 -8.171 4.630 -5.723 1.00 0.00 O ATOM 1352 CB THR A 98 -8.100 4.451 -8.596 1.00 0.00 C ATOM 1353 OG1 THR A 98 -8.004 3.873 -9.903 1.00 0.00 O ATOM 1354 CG2 THR A 98 -7.968 5.963 -8.693 1.00 0.00 C ATOM 0 H THR A 98 -7.964 2.028 -8.012 1.00 0.00 H new ATOM 0 HA THR A 98 -6.031 4.061 -8.119 1.00 0.00 H new ATOM 0 HB THR A 98 -9.073 4.214 -8.165 1.00 0.00 H new ATOM 0 HG1 THR A 98 -8.702 4.250 -10.479 1.00 0.00 H new ATOM 0 HG21 THR A 98 -8.749 6.355 -9.345 1.00 0.00 H new ATOM 0 HG22 THR A 98 -8.070 6.402 -7.700 1.00 0.00 H new ATOM 0 HG23 THR A 98 -6.991 6.217 -9.104 1.00 0.00 H new ATOM 1362 N VAL A 99 -5.954 4.999 -5.815 1.00 0.00 N ATOM 1363 CA VAL A 99 -5.899 5.664 -4.518 1.00 0.00 C ATOM 1364 C VAL A 99 -5.455 7.115 -4.663 1.00 0.00 C ATOM 1365 O VAL A 99 -4.466 7.408 -5.334 1.00 0.00 O ATOM 1366 CB VAL A 99 -4.941 4.938 -3.555 1.00 0.00 C ATOM 1367 CG1 VAL A 99 -4.791 5.721 -2.260 1.00 0.00 C ATOM 1368 CG2 VAL A 99 -5.432 3.525 -3.280 1.00 0.00 C ATOM 0 H VAL A 99 -5.054 4.927 -6.290 1.00 0.00 H new ATOM 0 HA VAL A 99 -6.907 5.636 -4.105 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.961 4.872 -4.027 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -4.111 5.193 -1.592 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -4.390 6.711 -2.478 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -5.765 5.821 -1.781 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -4.743 3.027 -2.598 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -6.423 3.566 -2.829 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.482 2.968 -4.216 1.00 0.00 H new ATOM 1378 N MET A 100 -6.192 8.020 -4.027 1.00 0.00 N ATOM 1379 CA MET A 100 -5.873 9.442 -4.083 1.00 0.00 C ATOM 1380 C MET A 100 -5.390 9.944 -2.726 1.00 0.00 C ATOM 1381 O MET A 100 -6.155 9.989 -1.763 1.00 0.00 O ATOM 1382 CB MET A 100 -7.095 10.244 -4.532 1.00 0.00 C ATOM 1383 CG MET A 100 -6.773 11.679 -4.913 1.00 0.00 C ATOM 1384 SD MET A 100 -7.982 12.384 -6.051 1.00 0.00 S ATOM 1385 CE MET A 100 -7.202 12.044 -7.627 1.00 0.00 C ATOM 0 H MET A 100 -7.014 7.794 -3.467 1.00 0.00 H new ATOM 0 HA MET A 100 -5.071 9.581 -4.808 1.00 0.00 H new ATOM 0 HB2 MET A 100 -7.554 9.744 -5.385 1.00 0.00 H new ATOM 0 HB3 MET A 100 -7.833 10.247 -3.730 1.00 0.00 H new ATOM 0 HG2 MET A 100 -6.730 12.289 -4.011 1.00 0.00 H new ATOM 0 HG3 MET A 100 -5.784 11.716 -5.371 1.00 0.00 H new ATOM 0 HE1 MET A 100 -7.831 12.421 -8.433 1.00 0.00 H new ATOM 0 HE2 MET A 100 -6.230 12.535 -7.665 1.00 0.00 H new ATOM 0 HE3 MET A 100 -7.070 10.968 -7.743 1.00 0.00 H new ATOM 1395 N ALA A 101 -4.118 10.322 -2.657 1.00 0.00 N ATOM 1396 CA ALA A 101 -3.536 10.824 -1.419 1.00 0.00 C ATOM 1397 C ALA A 101 -3.609 12.345 -1.354 1.00 0.00 C ATOM 1398 O ALA A 101 -3.049 13.042 -2.202 1.00 0.00 O ATOM 1399 CB ALA A 101 -2.094 10.356 -1.287 1.00 0.00 C ATOM 0 H ALA A 101 -3.471 10.290 -3.445 1.00 0.00 H new ATOM 0 HA ALA A 101 -4.114 10.424 -0.586 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.671 10.738 -0.358 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.064 9.266 -1.278 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.512 10.728 -2.130 1.00 0.00 H new ATOM 1405 N THR A 102 -4.303 12.857 -0.342 1.00 0.00 N ATOM 1406 CA THR A 102 -4.451 14.296 -0.167 1.00 0.00 C ATOM 1407 C THR A 102 -3.662 14.788 1.040 1.00 0.00 C ATOM 1408 O THR A 102 -3.466 14.052 2.008 1.00 0.00 O ATOM 1409 CB THR A 102 -5.929 14.692 0.004 1.00 0.00 C ATOM 1410 OG1 THR A 102 -6.538 13.886 1.019 1.00 0.00 O ATOM 1411 CG2 THR A 102 -6.689 14.528 -1.304 1.00 0.00 C ATOM 0 H THR A 102 -4.772 12.296 0.369 1.00 0.00 H new ATOM 0 HA THR A 102 -4.059 14.765 -1.069 1.00 0.00 H new ATOM 0 HB THR A 102 -5.969 15.740 0.300 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.477 14.145 1.123 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.731 14.814 -1.158 1.00 0.00 H new ATOM 0 HG22 THR A 102 -6.242 15.165 -2.067 1.00 0.00 H new ATOM 0 HG23 THR A 102 -6.640 13.488 -1.625 1.00 0.00 H new ATOM 1419 N ASP A 103 -3.210 16.036 0.978 1.00 0.00 N ATOM 1420 CA ASP A 103 -2.442 16.627 2.068 1.00 0.00 C ATOM 1421 C ASP A 103 -3.328 16.867 3.287 1.00 0.00 C ATOM 1422 O ASP A 103 -2.855 16.850 4.423 1.00 0.00 O ATOM 1423 CB ASP A 103 -1.805 17.943 1.617 1.00 0.00 C ATOM 1424 CG ASP A 103 -2.838 18.997 1.271 1.00 0.00 C ATOM 1425 OD1 ASP A 103 -3.399 19.607 2.205 1.00 0.00 O ATOM 1426 OD2 ASP A 103 -3.084 19.213 0.066 1.00 0.00 O ATOM 0 H ASP A 103 -3.362 16.658 0.184 1.00 0.00 H new ATOM 0 HA ASP A 103 -1.653 15.928 2.346 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -1.157 18.320 2.408 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -1.173 17.759 0.748 1.00 0.00 H new ATOM 1431 N GLY A 104 -4.614 17.094 3.043 1.00 0.00 N ATOM 1432 CA GLY A 104 -5.544 17.337 4.130 1.00 0.00 C ATOM 1433 C GLY A 104 -4.923 18.138 5.256 1.00 0.00 C ATOM 1434 O GLY A 104 -4.089 19.011 5.017 1.00 0.00 O ATOM 0 H GLY A 104 -5.029 17.114 2.112 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -6.415 17.869 3.747 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.900 16.383 4.520 1.00 0.00 H new ATOM 1438 N GLU A 105 -5.332 17.844 6.486 1.00 0.00 N ATOM 1439 CA GLU A 105 -4.811 18.547 7.653 1.00 0.00 C ATOM 1440 C GLU A 105 -3.285 18.524 7.665 1.00 0.00 C ATOM 1441 O GLU A 105 -2.658 17.798 6.895 1.00 0.00 O ATOM 1442 CB GLU A 105 -5.353 17.918 8.938 1.00 0.00 C ATOM 1443 CG GLU A 105 -4.931 16.471 9.132 1.00 0.00 C ATOM 1444 CD GLU A 105 -5.820 15.731 10.112 1.00 0.00 C ATOM 1445 OE1 GLU A 105 -7.057 15.798 9.958 1.00 0.00 O ATOM 1446 OE2 GLU A 105 -5.279 15.084 11.034 1.00 0.00 O ATOM 0 H GLU A 105 -6.022 17.124 6.700 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.140 19.585 7.599 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.013 18.505 9.791 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -6.442 17.972 8.928 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -4.951 15.958 8.170 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -3.901 16.441 9.487 1.00 0.00 H new ATOM 1453 N VAL A 106 -2.695 19.326 8.545 1.00 0.00 N ATOM 1454 CA VAL A 106 -1.243 19.400 8.659 1.00 0.00 C ATOM 1455 C VAL A 106 -0.817 19.658 10.100 1.00 0.00 C ATOM 1456 O VAL A 106 -1.049 20.738 10.644 1.00 0.00 O ATOM 1457 CB VAL A 106 -0.664 20.506 7.758 1.00 0.00 C ATOM 1458 CG1 VAL A 106 -0.544 20.018 6.323 1.00 0.00 C ATOM 1459 CG2 VAL A 106 -1.525 21.758 7.834 1.00 0.00 C ATOM 0 H VAL A 106 -3.200 19.934 9.190 1.00 0.00 H new ATOM 0 HA VAL A 106 -0.851 18.436 8.334 1.00 0.00 H new ATOM 0 HB VAL A 106 0.335 20.756 8.115 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -0.133 20.813 5.701 1.00 0.00 H new ATOM 0 HG12 VAL A 106 0.116 19.152 6.287 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -1.529 19.739 5.950 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -1.102 22.530 7.191 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -2.537 21.524 7.503 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -1.554 22.118 8.863 1.00 0.00 H new ATOM 1469 N THR A 107 -0.191 18.658 10.714 1.00 0.00 N ATOM 1470 CA THR A 107 0.267 18.776 12.093 1.00 0.00 C ATOM 1471 C THR A 107 1.518 19.642 12.184 1.00 0.00 C ATOM 1472 O THR A 107 2.188 19.889 11.182 1.00 0.00 O ATOM 1473 CB THR A 107 0.567 17.395 12.705 1.00 0.00 C ATOM 1474 OG1 THR A 107 1.279 16.585 11.763 1.00 0.00 O ATOM 1475 CG2 THR A 107 -0.720 16.693 13.114 1.00 0.00 C ATOM 0 H THR A 107 0.010 17.758 10.278 1.00 0.00 H new ATOM 0 HA THR A 107 -0.540 19.247 12.655 1.00 0.00 H new ATOM 0 HB THR A 107 1.181 17.542 13.594 1.00 0.00 H new ATOM 0 HG1 THR A 107 1.467 15.709 12.161 1.00 0.00 H new ATOM 0 HG21 THR A 107 -0.483 15.720 13.544 1.00 0.00 H new ATOM 0 HG22 THR A 107 -1.245 17.298 13.853 1.00 0.00 H new ATOM 0 HG23 THR A 107 -1.355 16.558 12.238 1.00 0.00 H new ATOM 1483 N ALA A 108 1.828 20.101 13.392 1.00 0.00 N ATOM 1484 CA ALA A 108 3.000 20.938 13.614 1.00 0.00 C ATOM 1485 C ALA A 108 3.876 20.371 14.727 1.00 0.00 C ATOM 1486 O ALA A 108 3.443 19.512 15.495 1.00 0.00 O ATOM 1487 CB ALA A 108 2.578 22.362 13.945 1.00 0.00 C ATOM 0 H ALA A 108 1.283 19.907 14.232 1.00 0.00 H new ATOM 0 HA ALA A 108 3.587 20.950 12.695 1.00 0.00 H new ATOM 0 HB1 ALA A 108 3.464 22.975 14.108 1.00 0.00 H new ATOM 0 HB2 ALA A 108 2.000 22.772 13.117 1.00 0.00 H new ATOM 0 HB3 ALA A 108 1.967 22.360 14.848 1.00 0.00 H new ATOM 1493 N VAL A 109 5.110 20.857 14.809 1.00 0.00 N ATOM 1494 CA VAL A 109 6.047 20.400 15.828 1.00 0.00 C ATOM 1495 C VAL A 109 7.062 21.486 16.168 1.00 0.00 C ATOM 1496 O VAL A 109 7.581 22.163 15.281 1.00 0.00 O ATOM 1497 CB VAL A 109 6.797 19.134 15.373 1.00 0.00 C ATOM 1498 CG1 VAL A 109 7.807 19.473 14.288 1.00 0.00 C ATOM 1499 CG2 VAL A 109 7.479 18.466 16.557 1.00 0.00 C ATOM 0 H VAL A 109 5.485 21.568 14.181 1.00 0.00 H new ATOM 0 HA VAL A 109 5.460 20.165 16.716 1.00 0.00 H new ATOM 0 HB VAL A 109 6.073 18.433 14.956 1.00 0.00 H new ATOM 0 HG11 VAL A 109 8.327 18.566 13.979 1.00 0.00 H new ATOM 0 HG12 VAL A 109 7.289 19.904 13.431 1.00 0.00 H new ATOM 0 HG13 VAL A 109 8.529 20.192 14.675 1.00 0.00 H new ATOM 0 HG21 VAL A 109 8.004 17.573 16.218 1.00 0.00 H new ATOM 0 HG22 VAL A 109 8.192 19.159 17.004 1.00 0.00 H new ATOM 0 HG23 VAL A 109 6.730 18.187 17.298 1.00 0.00 H new ATOM 1509 N GLU A 110 7.342 21.643 17.458 1.00 0.00 N ATOM 1510 CA GLU A 110 8.296 22.647 17.914 1.00 0.00 C ATOM 1511 C GLU A 110 9.605 21.994 18.353 1.00 0.00 C ATOM 1512 O GLU A 110 9.609 21.096 19.195 1.00 0.00 O ATOM 1513 CB GLU A 110 7.705 23.457 19.070 1.00 0.00 C ATOM 1514 CG GLU A 110 8.306 24.845 19.211 1.00 0.00 C ATOM 1515 CD GLU A 110 7.421 25.786 20.005 1.00 0.00 C ATOM 1516 OE1 GLU A 110 6.357 26.181 19.483 1.00 0.00 O ATOM 1517 OE2 GLU A 110 7.792 26.129 21.147 1.00 0.00 O ATOM 0 H GLU A 110 6.923 21.089 18.205 1.00 0.00 H new ATOM 0 HA GLU A 110 8.505 23.317 17.080 1.00 0.00 H new ATOM 0 HB2 GLU A 110 6.629 23.549 18.925 1.00 0.00 H new ATOM 0 HB3 GLU A 110 7.855 22.909 20.000 1.00 0.00 H new ATOM 0 HG2 GLU A 110 9.278 24.768 19.699 1.00 0.00 H new ATOM 0 HG3 GLU A 110 8.479 25.264 18.220 1.00 0.00 H new ATOM 1524 N GLU A 111 10.710 22.453 17.776 1.00 0.00 N ATOM 1525 CA GLU A 111 12.024 21.913 18.107 1.00 0.00 C ATOM 1526 C GLU A 111 13.128 22.693 17.398 1.00 0.00 C ATOM 1527 O GLU A 111 12.921 23.231 16.311 1.00 0.00 O ATOM 1528 CB GLU A 111 12.103 20.433 17.723 1.00 0.00 C ATOM 1529 CG GLU A 111 13.158 19.660 18.496 1.00 0.00 C ATOM 1530 CD GLU A 111 12.617 19.063 19.781 1.00 0.00 C ATOM 1531 OE1 GLU A 111 12.456 19.817 20.763 1.00 0.00 O ATOM 1532 OE2 GLU A 111 12.357 17.842 19.805 1.00 0.00 O ATOM 0 H GLU A 111 10.722 23.197 17.078 1.00 0.00 H new ATOM 0 HA GLU A 111 12.168 22.011 19.183 1.00 0.00 H new ATOM 0 HB2 GLU A 111 11.130 19.970 17.890 1.00 0.00 H new ATOM 0 HB3 GLU A 111 12.315 20.354 16.657 1.00 0.00 H new ATOM 0 HG2 GLU A 111 13.553 18.862 17.867 1.00 0.00 H new ATOM 0 HG3 GLU A 111 13.991 20.323 18.730 1.00 0.00 H new ATOM 1539 N ALA A 112 14.299 22.749 18.023 1.00 0.00 N ATOM 1540 CA ALA A 112 15.436 23.462 17.452 1.00 0.00 C ATOM 1541 C ALA A 112 16.623 22.527 17.247 1.00 0.00 C ATOM 1542 O ALA A 112 17.110 21.889 18.181 1.00 0.00 O ATOM 1543 CB ALA A 112 15.829 24.629 18.345 1.00 0.00 C ATOM 0 H ALA A 112 14.486 22.310 18.924 1.00 0.00 H new ATOM 0 HA ALA A 112 15.139 23.849 16.477 1.00 0.00 H new ATOM 0 HB1 ALA A 112 16.679 25.152 17.907 1.00 0.00 H new ATOM 0 HB2 ALA A 112 14.988 25.316 18.437 1.00 0.00 H new ATOM 0 HB3 ALA A 112 16.102 24.256 19.332 1.00 0.00 H new ATOM 1549 N PRO A 113 17.100 22.441 15.997 1.00 0.00 N ATOM 1550 CA PRO A 113 18.236 21.587 15.639 1.00 0.00 C ATOM 1551 C PRO A 113 19.552 22.102 16.211 1.00 0.00 C ATOM 1552 O PRO A 113 20.038 23.163 15.817 1.00 0.00 O ATOM 1553 CB PRO A 113 18.258 21.644 14.110 1.00 0.00 C ATOM 1554 CG PRO A 113 17.607 22.941 13.772 1.00 0.00 C ATOM 1555 CD PRO A 113 16.568 23.173 14.834 1.00 0.00 C ATOM 0 HA PRO A 113 18.128 20.579 16.039 1.00 0.00 H new ATOM 0 HB2 PRO A 113 19.277 21.600 13.726 1.00 0.00 H new ATOM 0 HB3 PRO A 113 17.717 20.804 13.674 1.00 0.00 H new ATOM 0 HG2 PRO A 113 18.336 23.751 13.756 1.00 0.00 H new ATOM 0 HG3 PRO A 113 17.152 22.903 12.782 1.00 0.00 H new ATOM 0 HD2 PRO A 113 16.444 24.234 15.050 1.00 0.00 H new ATOM 0 HD3 PRO A 113 15.592 22.793 14.532 1.00 0.00 H new ATOM 1563 N VAL A 114 20.125 21.346 17.143 1.00 0.00 N ATOM 1564 CA VAL A 114 21.386 21.726 17.767 1.00 0.00 C ATOM 1565 C VAL A 114 22.574 21.304 16.910 1.00 0.00 C ATOM 1566 O VAL A 114 23.229 20.301 17.191 1.00 0.00 O ATOM 1567 CB VAL A 114 21.530 21.102 19.168 1.00 0.00 C ATOM 1568 CG1 VAL A 114 22.876 21.462 19.777 1.00 0.00 C ATOM 1569 CG2 VAL A 114 20.390 21.551 20.070 1.00 0.00 C ATOM 0 H VAL A 114 19.735 20.467 17.482 1.00 0.00 H new ATOM 0 HA VAL A 114 21.377 22.812 17.860 1.00 0.00 H new ATOM 0 HB VAL A 114 21.481 20.017 19.071 1.00 0.00 H new ATOM 0 HG11 VAL A 114 22.960 21.012 20.766 1.00 0.00 H new ATOM 0 HG12 VAL A 114 23.676 21.087 19.139 1.00 0.00 H new ATOM 0 HG13 VAL A 114 22.958 22.545 19.863 1.00 0.00 H new ATOM 0 HG21 VAL A 114 20.507 21.101 21.056 1.00 0.00 H new ATOM 0 HG22 VAL A 114 20.405 22.637 20.163 1.00 0.00 H new ATOM 0 HG23 VAL A 114 19.439 21.237 19.639 1.00 0.00 H new ATOM 1579 N ASN A 115 22.846 22.077 15.862 1.00 0.00 N ATOM 1580 CA ASN A 115 23.956 21.782 14.963 1.00 0.00 C ATOM 1581 C ASN A 115 25.263 21.649 15.738 1.00 0.00 C ATOM 1582 O ASN A 115 25.616 22.519 16.534 1.00 0.00 O ATOM 1583 CB ASN A 115 24.085 22.879 13.905 1.00 0.00 C ATOM 1584 CG ASN A 115 25.027 22.489 12.781 1.00 0.00 C ATOM 1585 OD1 ASN A 115 26.247 22.553 12.928 1.00 0.00 O ATOM 1586 ND2 ASN A 115 24.462 22.082 11.650 1.00 0.00 N ATOM 0 H ASN A 115 22.313 22.911 15.615 1.00 0.00 H new ATOM 0 HA ASN A 115 23.750 20.832 14.469 1.00 0.00 H new ATOM 0 HB2 ASN A 115 23.101 23.099 13.491 1.00 0.00 H new ATOM 0 HB3 ASN A 115 24.444 23.794 14.376 1.00 0.00 H new ATOM 0 HD21 ASN A 115 25.044 21.807 10.859 1.00 0.00 H new ATOM 0 HD22 ASN A 115 23.446 22.045 11.572 1.00 0.00 H new ATOM 1593 N ALA A 116 25.978 20.555 15.499 1.00 0.00 N ATOM 1594 CA ALA A 116 27.247 20.310 16.171 1.00 0.00 C ATOM 1595 C ALA A 116 28.423 20.730 15.297 1.00 0.00 C ATOM 1596 O ALA A 116 28.299 20.818 14.074 1.00 0.00 O ATOM 1597 CB ALA A 116 27.368 18.841 16.550 1.00 0.00 C ATOM 0 H ALA A 116 25.699 19.824 14.844 1.00 0.00 H new ATOM 0 HA ALA A 116 27.270 20.913 17.079 1.00 0.00 H new ATOM 0 HB1 ALA A 116 28.321 18.672 17.051 1.00 0.00 H new ATOM 0 HB2 ALA A 116 26.552 18.570 17.220 1.00 0.00 H new ATOM 0 HB3 ALA A 116 27.318 18.228 15.650 1.00 0.00 H new ATOM 1603 N CYS A 117 29.561 20.991 15.929 1.00 0.00 N ATOM 1604 CA CYS A 117 30.759 21.406 15.207 1.00 0.00 C ATOM 1605 C CYS A 117 31.977 20.620 15.680 1.00 0.00 C ATOM 1606 O CYS A 117 32.121 20.301 16.860 1.00 0.00 O ATOM 1607 CB CYS A 117 30.999 22.905 15.394 1.00 0.00 C ATOM 1608 SG CYS A 117 31.451 23.375 17.080 1.00 0.00 S ATOM 0 H CYS A 117 29.680 20.923 16.940 1.00 0.00 H new ATOM 0 HA CYS A 117 30.605 21.200 14.148 1.00 0.00 H new ATOM 0 HB2 CYS A 117 31.790 23.223 14.715 1.00 0.00 H new ATOM 0 HB3 CYS A 117 30.097 23.445 15.107 1.00 0.00 H new ATOM 0 HG CYS A 117 31.931 22.341 17.705 1.00 0.00 H new ATOM 1614 N PRO A 118 32.877 20.299 14.738 1.00 0.00 N ATOM 1615 CA PRO A 118 34.099 19.546 15.034 1.00 0.00 C ATOM 1616 C PRO A 118 35.098 20.359 15.850 1.00 0.00 C ATOM 1617 O PRO A 118 35.007 21.585 15.918 1.00 0.00 O ATOM 1618 CB PRO A 118 34.668 19.234 13.648 1.00 0.00 C ATOM 1619 CG PRO A 118 34.130 20.308 12.768 1.00 0.00 C ATOM 1620 CD PRO A 118 32.771 20.648 13.311 1.00 0.00 C ATOM 0 HA PRO A 118 33.896 18.660 15.636 1.00 0.00 H new ATOM 0 HB2 PRO A 118 35.758 19.239 13.657 1.00 0.00 H new ATOM 0 HB3 PRO A 118 34.356 18.248 13.305 1.00 0.00 H new ATOM 0 HG2 PRO A 118 34.782 21.181 12.775 1.00 0.00 H new ATOM 0 HG3 PRO A 118 34.063 19.968 11.734 1.00 0.00 H new ATOM 0 HD2 PRO A 118 32.535 21.703 13.172 1.00 0.00 H new ATOM 0 HD3 PRO A 118 31.986 20.078 12.815 1.00 0.00 H new ATOM 1628 N SER A 119 36.051 19.669 16.468 1.00 0.00 N ATOM 1629 CA SER A 119 37.066 20.327 17.282 1.00 0.00 C ATOM 1630 C SER A 119 38.435 20.245 16.615 1.00 0.00 C ATOM 1631 O SER A 119 38.673 19.392 15.761 1.00 0.00 O ATOM 1632 CB SER A 119 37.126 19.692 18.673 1.00 0.00 C ATOM 1633 OG SER A 119 37.503 18.329 18.595 1.00 0.00 O ATOM 0 H SER A 119 36.141 18.654 16.420 1.00 0.00 H new ATOM 0 HA SER A 119 36.791 21.377 17.381 1.00 0.00 H new ATOM 0 HB2 SER A 119 37.839 20.235 19.294 1.00 0.00 H new ATOM 0 HB3 SER A 119 36.153 19.776 19.157 1.00 0.00 H new ATOM 0 HG SER A 119 37.536 17.947 19.497 1.00 0.00 H new ATOM 1639 N GLY A 120 39.335 21.141 17.012 1.00 0.00 N ATOM 1640 CA GLY A 120 40.670 21.154 16.443 1.00 0.00 C ATOM 1641 C GLY A 120 41.668 21.881 17.322 1.00 0.00 C ATOM 1642 O GLY A 120 41.455 22.061 18.521 1.00 0.00 O ATOM 0 H GLY A 120 39.163 21.858 17.717 1.00 0.00 H new ATOM 0 HA2 GLY A 120 41.006 20.129 16.289 1.00 0.00 H new ATOM 0 HA3 GLY A 120 40.639 21.630 15.463 1.00 0.00 H new ATOM 1646 N PRO A 121 42.789 22.310 16.722 1.00 0.00 N ATOM 1647 CA PRO A 121 43.847 23.026 17.441 1.00 0.00 C ATOM 1648 C PRO A 121 43.416 24.429 17.859 1.00 0.00 C ATOM 1649 O PRO A 121 42.507 25.010 17.267 1.00 0.00 O ATOM 1650 CB PRO A 121 44.984 23.098 16.419 1.00 0.00 C ATOM 1651 CG PRO A 121 44.308 23.013 15.094 1.00 0.00 C ATOM 1652 CD PRO A 121 43.109 22.128 15.297 1.00 0.00 C ATOM 0 HA PRO A 121 44.121 22.524 18.369 1.00 0.00 H new ATOM 0 HB2 PRO A 121 45.547 24.026 16.518 1.00 0.00 H new ATOM 0 HB3 PRO A 121 45.692 22.280 16.556 1.00 0.00 H new ATOM 0 HG2 PRO A 121 44.009 24.001 14.744 1.00 0.00 H new ATOM 0 HG3 PRO A 121 44.977 22.597 14.341 1.00 0.00 H new ATOM 0 HD2 PRO A 121 42.278 22.424 14.657 1.00 0.00 H new ATOM 0 HD3 PRO A 121 43.334 21.087 15.065 1.00 0.00 H new ATOM 1660 N SER A 122 44.076 24.966 18.880 1.00 0.00 N ATOM 1661 CA SER A 122 43.759 26.299 19.378 1.00 0.00 C ATOM 1662 C SER A 122 45.020 27.017 19.849 1.00 0.00 C ATOM 1663 O SER A 122 46.128 26.498 19.719 1.00 0.00 O ATOM 1664 CB SER A 122 42.749 26.211 20.524 1.00 0.00 C ATOM 1665 OG SER A 122 42.065 27.441 20.695 1.00 0.00 O ATOM 0 H SER A 122 44.833 24.499 19.378 1.00 0.00 H new ATOM 0 HA SER A 122 43.321 26.871 18.560 1.00 0.00 H new ATOM 0 HB2 SER A 122 42.031 25.417 20.320 1.00 0.00 H new ATOM 0 HB3 SER A 122 43.264 25.946 21.447 1.00 0.00 H new ATOM 0 HG SER A 122 41.424 27.359 21.432 1.00 0.00 H new ATOM 1671 N SER A 123 44.842 28.215 20.397 1.00 0.00 N ATOM 1672 CA SER A 123 45.965 29.006 20.886 1.00 0.00 C ATOM 1673 C SER A 123 47.044 29.136 19.815 1.00 0.00 C ATOM 1674 O SER A 123 48.235 29.028 20.103 1.00 0.00 O ATOM 1675 CB SER A 123 46.554 28.371 22.147 1.00 0.00 C ATOM 1676 OG SER A 123 45.777 28.689 23.289 1.00 0.00 O ATOM 0 H SER A 123 43.931 28.659 20.513 1.00 0.00 H new ATOM 0 HA SER A 123 45.597 30.003 21.129 1.00 0.00 H new ATOM 0 HB2 SER A 123 46.601 27.289 22.025 1.00 0.00 H new ATOM 0 HB3 SER A 123 47.577 28.720 22.290 1.00 0.00 H new ATOM 0 HG SER A 123 46.173 28.270 24.081 1.00 0.00 H new ATOM 1682 N GLY A 124 46.616 29.368 18.578 1.00 0.00 N ATOM 1683 CA GLY A 124 47.558 29.509 17.482 1.00 0.00 C ATOM 1684 C GLY A 124 46.938 30.167 16.265 1.00 0.00 C ATOM 1685 O GLY A 124 45.719 30.149 16.096 1.00 0.00 O ATOM 0 H GLY A 124 45.635 29.461 18.315 1.00 0.00 H new ATOM 0 HA2 GLY A 124 48.412 30.099 17.815 1.00 0.00 H new ATOM 0 HA3 GLY A 124 47.938 28.526 17.205 1.00 0.00 H new TER 1689 GLY A 124