USER MOD reduce.3.24.130724 H: found=0, std=0, add=833, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 833 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 83 GLN : amide:sc= 0.542 K(o=1.2,f=-0.34) USER MOD Set 1.2: A 85 SER OG : rot 180:sc= 0.684 USER MOD Set 2.1: A 48 MET CE :methyl 174:sc= -0.0361 (180deg=-0.088) USER MOD Set 2.2: A 58 ASN : amide:sc= 0.0472 X(o=0.011,f=-0.4) USER MOD Set 3.1: A 51 LYS NZ :NH3+ 158:sc= 0.847 (180deg=-0.0749) USER MOD Set 3.2: A 55 SER OG : rot -37:sc= 0.749 USER MOD Set 4.1: A 9 SER OG : rot -63:sc= 0.12 USER MOD Set 4.2: A 78 GLN : amide:sc= 0.777 K(o=0.9,f=-4.1!) USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.0854 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 MET CE :methyl -175:sc= 0 (180deg=-0.0361) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0267 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0.198 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 28 ASN : amide:sc=-0.00466 X(o=-0.0047,f=0) USER MOD Single : A 30 MET CE :methyl 166:sc= -0.0448 (180deg=-0.825) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 37 MET CE :methyl -163:sc= -0.441 (180deg=-1.41) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 164:sc= 1.31 (180deg=0.799) USER MOD Single : A 45 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.19) USER MOD Single : A 46 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0117) USER MOD Single : A 53 GLN : amide:sc= -0.0819 X(o=-0.082,f=-0.082) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -20:sc= 1.06 USER MOD Single : A 60 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.539) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 GLN : amide:sc= -0.0192 X(o=-0.019,f=-0.019) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0.0625 USER MOD Single : A 77 MET CE :methyl -174:sc= 0 (180deg=-0.0253) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 35:sc= 0.00933 USER MOD Single : A 87 GLN : amide:sc= -0.0213 X(o=-0.021,f=-0.021) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= -0.154 K(o=-0.15,f=-1.1) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.419 20.250 -18.037 1.00 0.00 N ATOM 2 CA GLY A 1 8.074 20.099 -16.716 1.00 0.00 C ATOM 3 C GLY A 1 9.542 19.710 -16.849 1.00 0.00 C ATOM 4 O GLY A 1 10.055 19.544 -17.958 1.00 0.00 O ATOM 0 H1 GLY A 1 7.105 21.234 -18.159 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.095 20.006 -18.789 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.597 19.615 -18.091 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.995 21.035 -16.163 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.549 19.341 -16.135 1.00 0.00 H new ATOM 10 N SER A 2 10.235 19.562 -15.714 1.00 0.00 N ATOM 11 CA SER A 2 11.617 19.054 -15.621 1.00 0.00 C ATOM 12 C SER A 2 11.848 18.313 -14.293 1.00 0.00 C ATOM 13 O SER A 2 11.141 18.552 -13.308 1.00 0.00 O ATOM 14 CB SER A 2 12.607 20.219 -15.753 1.00 0.00 C ATOM 15 OG SER A 2 13.915 19.738 -16.032 1.00 0.00 O ATOM 0 H SER A 2 9.841 19.799 -14.804 1.00 0.00 H new ATOM 0 HA SER A 2 11.778 18.346 -16.434 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.283 20.889 -16.549 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.617 20.800 -14.831 1.00 0.00 H new ATOM 0 HG SER A 2 14.531 20.495 -16.114 1.00 0.00 H new ATOM 21 N ALA A 3 12.836 17.415 -14.250 1.00 0.00 N ATOM 22 CA ALA A 3 13.226 16.669 -13.049 1.00 0.00 C ATOM 23 C ALA A 3 14.081 17.517 -12.079 1.00 0.00 C ATOM 24 O ALA A 3 14.807 18.423 -12.498 1.00 0.00 O ATOM 25 CB ALA A 3 13.977 15.408 -13.494 1.00 0.00 C ATOM 0 H ALA A 3 13.400 17.181 -15.067 1.00 0.00 H new ATOM 0 HA ALA A 3 12.329 16.398 -12.493 1.00 0.00 H new ATOM 0 HB1 ALA A 3 14.278 14.835 -12.617 1.00 0.00 H new ATOM 0 HB2 ALA A 3 13.325 14.798 -14.119 1.00 0.00 H new ATOM 0 HB3 ALA A 3 14.862 15.693 -14.062 1.00 0.00 H new ATOM 31 N MET A 4 14.032 17.184 -10.782 1.00 0.00 N ATOM 32 CA MET A 4 14.756 17.853 -9.688 1.00 0.00 C ATOM 33 C MET A 4 15.309 16.823 -8.688 1.00 0.00 C ATOM 34 O MET A 4 14.544 16.094 -8.052 1.00 0.00 O ATOM 35 CB MET A 4 13.829 18.847 -8.960 1.00 0.00 C ATOM 36 CG MET A 4 13.432 20.069 -9.802 1.00 0.00 C ATOM 37 SD MET A 4 14.788 21.162 -10.332 1.00 0.00 S ATOM 38 CE MET A 4 15.332 21.843 -8.740 1.00 0.00 C ATOM 0 H MET A 4 13.462 16.406 -10.450 1.00 0.00 H new ATOM 0 HA MET A 4 15.593 18.400 -10.121 1.00 0.00 H new ATOM 0 HB2 MET A 4 12.924 18.323 -8.651 1.00 0.00 H new ATOM 0 HB3 MET A 4 14.325 19.191 -8.052 1.00 0.00 H new ATOM 0 HG2 MET A 4 12.910 19.716 -10.692 1.00 0.00 H new ATOM 0 HG3 MET A 4 12.719 20.662 -9.229 1.00 0.00 H new ATOM 0 HE1 MET A 4 16.100 22.598 -8.910 1.00 0.00 H new ATOM 0 HE2 MET A 4 14.483 22.298 -8.230 1.00 0.00 H new ATOM 0 HE3 MET A 4 15.741 21.043 -8.123 1.00 0.00 H new ATOM 48 N ALA A 5 16.637 16.754 -8.547 1.00 0.00 N ATOM 49 CA ALA A 5 17.333 15.898 -7.581 1.00 0.00 C ATOM 50 C ALA A 5 17.241 16.461 -6.141 1.00 0.00 C ATOM 51 O ALA A 5 18.204 17.020 -5.608 1.00 0.00 O ATOM 52 CB ALA A 5 18.781 15.706 -8.059 1.00 0.00 C ATOM 0 H ALA A 5 17.275 17.308 -9.118 1.00 0.00 H new ATOM 0 HA ALA A 5 16.849 14.923 -7.533 1.00 0.00 H new ATOM 0 HB1 ALA A 5 19.316 15.071 -7.353 1.00 0.00 H new ATOM 0 HB2 ALA A 5 18.780 15.235 -9.042 1.00 0.00 H new ATOM 0 HB3 ALA A 5 19.275 16.676 -8.122 1.00 0.00 H new ATOM 58 N ASP A 6 16.070 16.329 -5.511 1.00 0.00 N ATOM 59 CA ASP A 6 15.765 16.855 -4.173 1.00 0.00 C ATOM 60 C ASP A 6 14.950 15.851 -3.333 1.00 0.00 C ATOM 61 O ASP A 6 13.718 15.895 -3.283 1.00 0.00 O ATOM 62 CB ASP A 6 15.075 18.224 -4.310 1.00 0.00 C ATOM 63 CG ASP A 6 14.820 18.908 -2.956 1.00 0.00 C ATOM 64 OD1 ASP A 6 15.532 18.609 -1.965 1.00 0.00 O ATOM 65 OD2 ASP A 6 13.918 19.775 -2.892 1.00 0.00 O ATOM 0 H ASP A 6 15.281 15.837 -5.930 1.00 0.00 H new ATOM 0 HA ASP A 6 16.695 17.000 -3.623 1.00 0.00 H new ATOM 0 HB2 ASP A 6 15.692 18.875 -4.929 1.00 0.00 H new ATOM 0 HB3 ASP A 6 14.126 18.096 -4.830 1.00 0.00 H new ATOM 70 N ILE A 7 15.660 14.916 -2.689 1.00 0.00 N ATOM 71 CA ILE A 7 15.105 13.800 -1.893 1.00 0.00 C ATOM 72 C ILE A 7 15.029 14.082 -0.377 1.00 0.00 C ATOM 73 O ILE A 7 14.560 13.234 0.387 1.00 0.00 O ATOM 74 CB ILE A 7 15.884 12.493 -2.187 1.00 0.00 C ATOM 75 CG1 ILE A 7 17.382 12.605 -1.814 1.00 0.00 C ATOM 76 CG2 ILE A 7 15.686 12.089 -3.660 1.00 0.00 C ATOM 77 CD1 ILE A 7 18.154 11.285 -1.933 1.00 0.00 C ATOM 0 H ILE A 7 16.680 14.911 -2.705 1.00 0.00 H new ATOM 0 HA ILE A 7 14.069 13.683 -2.211 1.00 0.00 H new ATOM 0 HB ILE A 7 15.478 11.705 -1.553 1.00 0.00 H new ATOM 0 HG12 ILE A 7 17.852 13.348 -2.458 1.00 0.00 H new ATOM 0 HG13 ILE A 7 17.465 12.972 -0.791 1.00 0.00 H new ATOM 0 HG21 ILE A 7 16.235 11.170 -3.862 1.00 0.00 H new ATOM 0 HG22 ILE A 7 14.626 11.928 -3.854 1.00 0.00 H new ATOM 0 HG23 ILE A 7 16.057 12.883 -4.308 1.00 0.00 H new ATOM 0 HD11 ILE A 7 19.196 11.446 -1.655 1.00 0.00 H new ATOM 0 HD12 ILE A 7 17.711 10.543 -1.268 1.00 0.00 H new ATOM 0 HD13 ILE A 7 18.104 10.926 -2.961 1.00 0.00 H new ATOM 89 N GLY A 8 15.490 15.252 0.077 1.00 0.00 N ATOM 90 CA GLY A 8 15.527 15.651 1.488 1.00 0.00 C ATOM 91 C GLY A 8 14.236 16.338 1.950 1.00 0.00 C ATOM 92 O GLY A 8 13.849 17.363 1.386 1.00 0.00 O ATOM 0 H GLY A 8 15.859 15.970 -0.547 1.00 0.00 H new ATOM 0 HA2 GLY A 8 15.704 14.770 2.105 1.00 0.00 H new ATOM 0 HA3 GLY A 8 16.368 16.326 1.647 1.00 0.00 H new ATOM 96 N SER A 9 13.588 15.786 2.980 1.00 0.00 N ATOM 97 CA SER A 9 12.438 16.374 3.695 1.00 0.00 C ATOM 98 C SER A 9 12.553 16.113 5.205 1.00 0.00 C ATOM 99 O SER A 9 13.168 15.128 5.623 1.00 0.00 O ATOM 100 CB SER A 9 11.112 15.795 3.173 1.00 0.00 C ATOM 101 OG SER A 9 10.980 15.974 1.771 1.00 0.00 O ATOM 0 H SER A 9 13.858 14.878 3.359 1.00 0.00 H new ATOM 0 HA SER A 9 12.447 17.449 3.514 1.00 0.00 H new ATOM 0 HB2 SER A 9 11.059 14.733 3.411 1.00 0.00 H new ATOM 0 HB3 SER A 9 10.278 16.278 3.682 1.00 0.00 H new ATOM 0 HG SER A 9 10.956 16.932 1.564 1.00 0.00 H new ATOM 107 N GLU A 10 11.946 16.970 6.036 1.00 0.00 N ATOM 108 CA GLU A 10 12.074 16.925 7.508 1.00 0.00 C ATOM 109 C GLU A 10 10.718 16.928 8.237 1.00 0.00 C ATOM 110 O GLU A 10 10.463 16.053 9.070 1.00 0.00 O ATOM 111 CB GLU A 10 12.945 18.087 8.026 1.00 0.00 C ATOM 112 CG GLU A 10 14.400 18.089 7.527 1.00 0.00 C ATOM 113 CD GLU A 10 14.578 18.742 6.140 1.00 0.00 C ATOM 114 OE1 GLU A 10 14.241 19.940 5.977 1.00 0.00 O ATOM 115 OE2 GLU A 10 15.103 18.077 5.214 1.00 0.00 O ATOM 0 H GLU A 10 11.344 17.725 5.707 1.00 0.00 H new ATOM 0 HA GLU A 10 12.560 15.976 7.733 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.477 19.028 7.736 1.00 0.00 H new ATOM 0 HB3 GLU A 10 12.952 18.057 9.116 1.00 0.00 H new ATOM 0 HG2 GLU A 10 15.022 18.617 8.250 1.00 0.00 H new ATOM 0 HG3 GLU A 10 14.762 17.062 7.485 1.00 0.00 H new ATOM 122 N PHE A 11 9.851 17.904 7.945 1.00 0.00 N ATOM 123 CA PHE A 11 8.483 17.990 8.471 1.00 0.00 C ATOM 124 C PHE A 11 7.528 17.015 7.740 1.00 0.00 C ATOM 125 O PHE A 11 7.930 16.306 6.811 1.00 0.00 O ATOM 126 CB PHE A 11 8.025 19.459 8.379 1.00 0.00 C ATOM 127 CG PHE A 11 6.935 19.872 9.349 1.00 0.00 C ATOM 128 CD1 PHE A 11 7.222 19.967 10.724 1.00 0.00 C ATOM 129 CD2 PHE A 11 5.652 20.212 8.878 1.00 0.00 C ATOM 130 CE1 PHE A 11 6.230 20.392 11.627 1.00 0.00 C ATOM 131 CE2 PHE A 11 4.661 20.639 9.781 1.00 0.00 C ATOM 132 CZ PHE A 11 4.950 20.729 11.154 1.00 0.00 C ATOM 0 H PHE A 11 10.087 18.675 7.321 1.00 0.00 H new ATOM 0 HA PHE A 11 8.462 17.679 9.516 1.00 0.00 H new ATOM 0 HB2 PHE A 11 8.891 20.101 8.540 1.00 0.00 H new ATOM 0 HB3 PHE A 11 7.673 19.647 7.365 1.00 0.00 H new ATOM 0 HD1 PHE A 11 8.207 19.713 11.087 1.00 0.00 H new ATOM 0 HD2 PHE A 11 5.429 20.145 7.823 1.00 0.00 H new ATOM 0 HE1 PHE A 11 6.452 20.459 12.682 1.00 0.00 H new ATOM 0 HE2 PHE A 11 3.677 20.898 9.419 1.00 0.00 H new ATOM 0 HZ PHE A 11 4.188 21.057 11.846 1.00 0.00 H new ATOM 142 N GLU A 12 6.262 16.955 8.167 1.00 0.00 N ATOM 143 CA GLU A 12 5.186 16.208 7.490 1.00 0.00 C ATOM 144 C GLU A 12 3.843 16.960 7.562 1.00 0.00 C ATOM 145 O GLU A 12 3.512 17.563 8.589 1.00 0.00 O ATOM 146 CB GLU A 12 5.007 14.813 8.116 1.00 0.00 C ATOM 147 CG GLU A 12 6.189 13.865 7.884 1.00 0.00 C ATOM 148 CD GLU A 12 5.878 12.466 8.445 1.00 0.00 C ATOM 149 OE1 GLU A 12 5.128 11.702 7.792 1.00 0.00 O ATOM 150 OE2 GLU A 12 6.372 12.131 9.551 1.00 0.00 O ATOM 0 H GLU A 12 5.946 17.433 9.011 1.00 0.00 H new ATOM 0 HA GLU A 12 5.481 16.107 6.446 1.00 0.00 H new ATOM 0 HB2 GLU A 12 4.851 14.926 9.189 1.00 0.00 H new ATOM 0 HB3 GLU A 12 4.105 14.357 7.709 1.00 0.00 H new ATOM 0 HG2 GLU A 12 6.403 13.796 6.817 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.083 14.265 8.363 1.00 0.00 H new ATOM 157 N LYS A 13 3.040 16.877 6.493 1.00 0.00 N ATOM 158 CA LYS A 13 1.664 17.408 6.424 1.00 0.00 C ATOM 159 C LYS A 13 0.625 16.363 6.862 1.00 0.00 C ATOM 160 O LYS A 13 0.892 15.158 6.855 1.00 0.00 O ATOM 161 CB LYS A 13 1.364 17.895 4.991 1.00 0.00 C ATOM 162 CG LYS A 13 2.303 19.031 4.545 1.00 0.00 C ATOM 163 CD LYS A 13 1.965 19.577 3.147 1.00 0.00 C ATOM 164 CE LYS A 13 0.612 20.304 3.055 1.00 0.00 C ATOM 165 NZ LYS A 13 0.601 21.585 3.811 1.00 0.00 N ATOM 0 H LYS A 13 3.334 16.427 5.626 1.00 0.00 H new ATOM 0 HA LYS A 13 1.593 18.247 7.116 1.00 0.00 H new ATOM 0 HB2 LYS A 13 1.458 17.058 4.299 1.00 0.00 H new ATOM 0 HB3 LYS A 13 0.331 18.239 4.937 1.00 0.00 H new ATOM 0 HG2 LYS A 13 2.250 19.844 5.269 1.00 0.00 H new ATOM 0 HG3 LYS A 13 3.331 18.668 4.548 1.00 0.00 H new ATOM 0 HD2 LYS A 13 2.754 20.264 2.839 1.00 0.00 H new ATOM 0 HD3 LYS A 13 1.967 18.750 2.437 1.00 0.00 H new ATOM 0 HE2 LYS A 13 0.380 20.501 2.008 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -0.174 19.653 3.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -0.332 22.035 3.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 0.796 21.397 4.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 1.332 22.219 3.430 1.00 0.00 H new ATOM 179 N THR A 14 -0.583 16.815 7.197 1.00 0.00 N ATOM 180 CA THR A 14 -1.768 15.958 7.406 1.00 0.00 C ATOM 181 C THR A 14 -2.303 15.375 6.083 1.00 0.00 C ATOM 182 O THR A 14 -2.091 15.964 5.015 1.00 0.00 O ATOM 183 CB THR A 14 -2.900 16.742 8.099 1.00 0.00 C ATOM 184 OG1 THR A 14 -3.019 18.048 7.566 1.00 0.00 O ATOM 185 CG2 THR A 14 -2.638 16.870 9.599 1.00 0.00 C ATOM 0 H THR A 14 -0.778 17.807 7.336 1.00 0.00 H new ATOM 0 HA THR A 14 -1.445 15.135 8.043 1.00 0.00 H new ATOM 0 HB THR A 14 -3.820 16.185 7.925 1.00 0.00 H new ATOM 0 HG1 THR A 14 -3.745 18.523 8.022 1.00 0.00 H new ATOM 0 HG21 THR A 14 -3.451 17.427 10.064 1.00 0.00 H new ATOM 0 HG22 THR A 14 -2.578 15.877 10.044 1.00 0.00 H new ATOM 0 HG23 THR A 14 -1.698 17.398 9.760 1.00 0.00 H new ATOM 193 N PRO A 15 -3.010 14.227 6.120 1.00 0.00 N ATOM 194 CA PRO A 15 -3.597 13.602 4.936 1.00 0.00 C ATOM 195 C PRO A 15 -4.829 14.363 4.418 1.00 0.00 C ATOM 196 O PRO A 15 -5.558 15.009 5.177 1.00 0.00 O ATOM 197 CB PRO A 15 -3.964 12.179 5.375 1.00 0.00 C ATOM 198 CG PRO A 15 -4.231 12.318 6.871 1.00 0.00 C ATOM 199 CD PRO A 15 -3.211 13.376 7.283 1.00 0.00 C ATOM 0 HA PRO A 15 -2.895 13.608 4.102 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -4.842 11.810 4.844 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -3.154 11.477 5.177 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -5.253 12.637 7.074 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -4.079 11.378 7.401 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -3.574 13.957 8.131 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -2.274 12.913 7.592 1.00 0.00 H new ATOM 207 N SER A 16 -5.083 14.238 3.113 1.00 0.00 N ATOM 208 CA SER A 16 -6.173 14.906 2.376 1.00 0.00 C ATOM 209 C SER A 16 -6.820 14.029 1.284 1.00 0.00 C ATOM 210 O SER A 16 -7.662 14.501 0.516 1.00 0.00 O ATOM 211 CB SER A 16 -5.631 16.211 1.774 1.00 0.00 C ATOM 212 OG SER A 16 -4.537 15.949 0.903 1.00 0.00 O ATOM 0 H SER A 16 -4.514 13.644 2.510 1.00 0.00 H new ATOM 0 HA SER A 16 -6.972 15.110 3.089 1.00 0.00 H new ATOM 0 HB2 SER A 16 -6.424 16.721 1.226 1.00 0.00 H new ATOM 0 HB3 SER A 16 -5.313 16.881 2.573 1.00 0.00 H new ATOM 0 HG SER A 16 -4.207 16.793 0.529 1.00 0.00 H new ATOM 218 N LEU A 17 -6.429 12.749 1.196 1.00 0.00 N ATOM 219 CA LEU A 17 -6.788 11.810 0.123 1.00 0.00 C ATOM 220 C LEU A 17 -8.299 11.508 0.041 1.00 0.00 C ATOM 221 O LEU A 17 -8.847 11.347 -1.052 1.00 0.00 O ATOM 222 CB LEU A 17 -5.976 10.520 0.357 1.00 0.00 C ATOM 223 CG LEU A 17 -6.001 9.518 -0.813 1.00 0.00 C ATOM 224 CD1 LEU A 17 -5.205 10.025 -2.018 1.00 0.00 C ATOM 225 CD2 LEU A 17 -5.383 8.202 -0.352 1.00 0.00 C ATOM 0 H LEU A 17 -5.828 12.322 1.901 1.00 0.00 H new ATOM 0 HA LEU A 17 -6.546 12.266 -0.837 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -4.940 10.792 0.562 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -6.358 10.024 1.249 1.00 0.00 H new ATOM 0 HG LEU A 17 -7.040 9.387 -1.116 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.249 9.288 -2.820 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.632 10.966 -2.366 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -4.166 10.183 -1.728 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -5.396 7.486 -1.174 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.354 8.374 -0.037 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.957 7.804 0.485 1.00 0.00 H new ATOM 237 N THR A 18 -8.970 11.425 1.192 1.00 0.00 N ATOM 238 CA THR A 18 -10.418 11.186 1.350 1.00 0.00 C ATOM 239 C THR A 18 -10.937 11.805 2.665 1.00 0.00 C ATOM 240 O THR A 18 -10.225 12.584 3.311 1.00 0.00 O ATOM 241 CB THR A 18 -10.728 9.679 1.204 1.00 0.00 C ATOM 242 OG1 THR A 18 -12.120 9.468 1.068 1.00 0.00 O ATOM 243 CG2 THR A 18 -10.237 8.806 2.359 1.00 0.00 C ATOM 0 H THR A 18 -8.498 11.527 2.091 1.00 0.00 H new ATOM 0 HA THR A 18 -10.963 11.691 0.552 1.00 0.00 H new ATOM 0 HB THR A 18 -10.180 9.377 0.311 1.00 0.00 H new ATOM 0 HG1 THR A 18 -12.298 8.509 0.975 1.00 0.00 H new ATOM 0 HG21 THR A 18 -10.501 7.766 2.167 1.00 0.00 H new ATOM 0 HG22 THR A 18 -9.154 8.895 2.448 1.00 0.00 H new ATOM 0 HG23 THR A 18 -10.706 9.133 3.287 1.00 0.00 H new ATOM 251 N ARG A 19 -12.182 11.501 3.060 1.00 0.00 N ATOM 252 CA ARG A 19 -12.821 11.904 4.331 1.00 0.00 C ATOM 253 C ARG A 19 -12.010 11.479 5.570 1.00 0.00 C ATOM 254 O ARG A 19 -11.148 10.605 5.484 1.00 0.00 O ATOM 255 CB ARG A 19 -14.255 11.330 4.363 1.00 0.00 C ATOM 256 CG ARG A 19 -14.305 9.835 4.742 1.00 0.00 C ATOM 257 CD ARG A 19 -15.614 9.158 4.317 1.00 0.00 C ATOM 258 NE ARG A 19 -15.630 8.862 2.868 1.00 0.00 N ATOM 259 CZ ARG A 19 -15.031 7.859 2.246 1.00 0.00 C ATOM 260 NH1 ARG A 19 -14.345 6.954 2.887 1.00 0.00 N ATOM 261 NH2 ARG A 19 -15.112 7.741 0.952 1.00 0.00 N ATOM 0 H ARG A 19 -12.804 10.941 2.477 1.00 0.00 H new ATOM 0 HA ARG A 19 -12.857 12.993 4.372 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -14.851 11.899 5.077 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -14.715 11.465 3.384 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -13.466 9.318 4.276 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -14.182 9.734 5.820 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -15.745 8.233 4.879 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -16.456 9.804 4.566 1.00 0.00 H new ATOM 0 HE ARG A 19 -16.163 9.504 2.281 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -14.256 7.005 3.902 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -13.897 6.195 2.374 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -15.640 8.425 0.410 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -14.647 6.965 0.481 1.00 0.00 H new ATOM 275 N ARG A 20 -12.350 12.021 6.747 1.00 0.00 N ATOM 276 CA ARG A 20 -11.759 11.641 8.046 1.00 0.00 C ATOM 277 C ARG A 20 -12.750 10.857 8.917 1.00 0.00 C ATOM 278 O ARG A 20 -13.768 11.399 9.344 1.00 0.00 O ATOM 279 CB ARG A 20 -11.102 12.843 8.765 1.00 0.00 C ATOM 280 CG ARG A 20 -11.911 14.138 8.962 1.00 0.00 C ATOM 281 CD ARG A 20 -11.886 15.073 7.741 1.00 0.00 C ATOM 282 NE ARG A 20 -12.240 16.459 8.109 1.00 0.00 N ATOM 283 CZ ARG A 20 -13.433 16.963 8.369 1.00 0.00 C ATOM 284 NH1 ARG A 20 -14.523 16.250 8.306 1.00 0.00 N ATOM 285 NH2 ARG A 20 -13.555 18.214 8.706 1.00 0.00 N ATOM 0 H ARG A 20 -13.058 12.751 6.829 1.00 0.00 H new ATOM 0 HA ARG A 20 -10.940 10.951 7.845 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.785 12.502 9.751 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.199 13.102 8.212 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -12.945 13.879 9.189 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -11.519 14.673 9.827 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -10.893 15.058 7.291 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -12.583 14.707 6.987 1.00 0.00 H new ATOM 0 HE ARG A 20 -11.460 17.113 8.170 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -14.473 15.264 8.048 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -15.425 16.678 8.515 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -12.728 18.808 8.770 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -14.477 18.601 8.906 1.00 0.00 H new ATOM 299 N ILE A 21 -12.439 9.581 9.171 1.00 0.00 N ATOM 300 CA ILE A 21 -13.217 8.643 10.000 1.00 0.00 C ATOM 301 C ILE A 21 -12.386 8.133 11.189 1.00 0.00 C ATOM 302 O ILE A 21 -11.388 7.432 11.027 1.00 0.00 O ATOM 303 CB ILE A 21 -13.840 7.521 9.133 1.00 0.00 C ATOM 304 CG1 ILE A 21 -14.750 6.628 10.007 1.00 0.00 C ATOM 305 CG2 ILE A 21 -12.814 6.679 8.348 1.00 0.00 C ATOM 306 CD1 ILE A 21 -15.622 5.652 9.206 1.00 0.00 C ATOM 0 H ILE A 21 -11.598 9.150 8.787 1.00 0.00 H new ATOM 0 HA ILE A 21 -14.060 9.174 10.442 1.00 0.00 H new ATOM 0 HB ILE A 21 -14.435 8.017 8.367 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -14.128 6.060 10.699 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -15.396 7.266 10.610 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -13.336 5.917 7.768 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -12.252 7.326 7.674 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.128 6.198 9.045 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -16.231 5.062 9.891 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -16.272 6.212 8.534 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -14.984 4.988 8.624 1.00 0.00 H new ATOM 318 N ASP A 22 -12.776 8.525 12.402 1.00 0.00 N ATOM 319 CA ASP A 22 -12.142 8.112 13.663 1.00 0.00 C ATOM 320 C ASP A 22 -12.798 6.877 14.317 1.00 0.00 C ATOM 321 O ASP A 22 -12.227 6.296 15.236 1.00 0.00 O ATOM 322 CB ASP A 22 -12.102 9.310 14.627 1.00 0.00 C ATOM 323 CG ASP A 22 -13.487 9.683 15.181 1.00 0.00 C ATOM 324 OD1 ASP A 22 -14.326 10.204 14.408 1.00 0.00 O ATOM 325 OD2 ASP A 22 -13.735 9.475 16.394 1.00 0.00 O ATOM 0 H ASP A 22 -13.564 9.157 12.543 1.00 0.00 H new ATOM 0 HA ASP A 22 -11.126 7.794 13.427 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -11.435 9.079 15.458 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -11.680 10.172 14.110 1.00 0.00 H new ATOM 330 N ASP A 23 -13.957 6.415 13.831 1.00 0.00 N ATOM 331 CA ASP A 23 -14.670 5.234 14.357 1.00 0.00 C ATOM 332 C ASP A 23 -13.820 3.945 14.347 1.00 0.00 C ATOM 333 O ASP A 23 -13.989 3.069 15.200 1.00 0.00 O ATOM 334 CB ASP A 23 -15.961 5.009 13.556 1.00 0.00 C ATOM 335 CG ASP A 23 -16.988 6.129 13.786 1.00 0.00 C ATOM 336 OD1 ASP A 23 -17.751 6.056 14.779 1.00 0.00 O ATOM 337 OD2 ASP A 23 -17.045 7.078 12.968 1.00 0.00 O ATOM 0 H ASP A 23 -14.438 6.856 13.047 1.00 0.00 H new ATOM 0 HA ASP A 23 -14.898 5.448 15.401 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -15.722 4.949 12.494 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -16.400 4.052 13.838 1.00 0.00 H new ATOM 342 N THR A 24 -12.862 3.846 13.420 1.00 0.00 N ATOM 343 CA THR A 24 -11.931 2.715 13.279 1.00 0.00 C ATOM 344 C THR A 24 -11.026 2.513 14.508 1.00 0.00 C ATOM 345 O THR A 24 -10.630 1.384 14.797 1.00 0.00 O ATOM 346 CB THR A 24 -11.086 2.871 12.002 1.00 0.00 C ATOM 347 OG1 THR A 24 -11.923 3.219 10.916 1.00 0.00 O ATOM 348 CG2 THR A 24 -10.371 1.578 11.606 1.00 0.00 C ATOM 0 H THR A 24 -12.706 4.574 12.723 1.00 0.00 H new ATOM 0 HA THR A 24 -12.544 1.817 13.201 1.00 0.00 H new ATOM 0 HB THR A 24 -10.346 3.641 12.219 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.382 3.319 10.105 1.00 0.00 H new ATOM 0 HG21 THR A 24 -9.790 1.746 10.699 1.00 0.00 H new ATOM 0 HG22 THR A 24 -9.705 1.269 12.411 1.00 0.00 H new ATOM 0 HG23 THR A 24 -11.108 0.796 11.425 1.00 0.00 H new ATOM 356 N ILE A 25 -10.755 3.571 15.286 1.00 0.00 N ATOM 357 CA ILE A 25 -10.050 3.501 16.582 1.00 0.00 C ATOM 358 C ILE A 25 -10.812 2.607 17.577 1.00 0.00 C ATOM 359 O ILE A 25 -10.202 1.785 18.263 1.00 0.00 O ATOM 360 CB ILE A 25 -9.833 4.934 17.136 1.00 0.00 C ATOM 361 CG1 ILE A 25 -8.747 5.679 16.321 1.00 0.00 C ATOM 362 CG2 ILE A 25 -9.441 4.951 18.623 1.00 0.00 C ATOM 363 CD1 ILE A 25 -8.953 7.194 16.253 1.00 0.00 C ATOM 0 H ILE A 25 -11.024 4.521 15.030 1.00 0.00 H new ATOM 0 HA ILE A 25 -9.072 3.043 16.434 1.00 0.00 H new ATOM 0 HB ILE A 25 -10.793 5.441 17.038 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -7.771 5.474 16.762 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -8.729 5.279 15.307 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -9.303 5.981 18.951 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -10.230 4.485 19.213 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -8.511 4.399 18.760 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -8.153 7.644 15.666 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -9.913 7.410 15.784 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -8.940 7.609 17.261 1.00 0.00 H new ATOM 375 N PHE A 26 -12.141 2.744 17.648 1.00 0.00 N ATOM 376 CA PHE A 26 -12.987 1.975 18.567 1.00 0.00 C ATOM 377 C PHE A 26 -13.149 0.509 18.126 1.00 0.00 C ATOM 378 O PHE A 26 -13.060 -0.398 18.956 1.00 0.00 O ATOM 379 CB PHE A 26 -14.357 2.665 18.735 1.00 0.00 C ATOM 380 CG PHE A 26 -14.780 2.889 20.182 1.00 0.00 C ATOM 381 CD1 PHE A 26 -14.753 1.832 21.114 1.00 0.00 C ATOM 382 CD2 PHE A 26 -15.204 4.166 20.601 1.00 0.00 C ATOM 383 CE1 PHE A 26 -15.123 2.055 22.454 1.00 0.00 C ATOM 384 CE2 PHE A 26 -15.582 4.387 21.939 1.00 0.00 C ATOM 385 CZ PHE A 26 -15.537 3.334 22.868 1.00 0.00 C ATOM 0 H PHE A 26 -12.664 3.397 17.064 1.00 0.00 H new ATOM 0 HA PHE A 26 -12.486 1.952 19.535 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -14.329 3.628 18.225 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -15.116 2.062 18.237 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -14.447 0.846 20.798 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -15.239 4.980 19.892 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -15.089 1.243 23.165 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -15.907 5.368 22.252 1.00 0.00 H new ATOM 0 HZ PHE A 26 -15.819 3.506 23.896 1.00 0.00 H new ATOM 395 N GLN A 27 -13.381 0.257 16.828 1.00 0.00 N ATOM 396 CA GLN A 27 -13.663 -1.095 16.314 1.00 0.00 C ATOM 397 C GLN A 27 -12.445 -2.044 16.313 1.00 0.00 C ATOM 398 O GLN A 27 -12.621 -3.262 16.222 1.00 0.00 O ATOM 399 CB GLN A 27 -14.320 -1.009 14.919 1.00 0.00 C ATOM 400 CG GLN A 27 -13.327 -0.941 13.741 1.00 0.00 C ATOM 401 CD GLN A 27 -13.982 -0.660 12.386 1.00 0.00 C ATOM 402 OE1 GLN A 27 -15.051 -0.074 12.266 1.00 0.00 O ATOM 403 NE2 GLN A 27 -13.361 -1.067 11.298 1.00 0.00 N ATOM 0 H GLN A 27 -13.379 0.979 16.108 1.00 0.00 H new ATOM 0 HA GLN A 27 -14.364 -1.548 17.015 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -14.965 -1.877 14.782 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -14.960 -0.127 14.888 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -12.591 -0.163 13.945 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -12.785 -1.885 13.682 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -12.470 -1.557 11.373 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -13.772 -0.892 10.381 1.00 0.00 H new ATOM 412 N ASN A 28 -11.220 -1.507 16.384 1.00 0.00 N ATOM 413 CA ASN A 28 -9.972 -2.231 16.125 1.00 0.00 C ATOM 414 C ASN A 28 -8.938 -1.981 17.256 1.00 0.00 C ATOM 415 O ASN A 28 -8.181 -1.010 17.192 1.00 0.00 O ATOM 416 CB ASN A 28 -9.484 -1.849 14.707 1.00 0.00 C ATOM 417 CG ASN A 28 -9.027 -3.058 13.912 1.00 0.00 C ATOM 418 OD1 ASN A 28 -9.780 -3.638 13.144 1.00 0.00 O ATOM 419 ND2 ASN A 28 -7.803 -3.494 14.087 1.00 0.00 N ATOM 0 H ASN A 28 -11.067 -0.529 16.630 1.00 0.00 H new ATOM 0 HA ASN A 28 -10.127 -3.310 16.138 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -10.289 -1.347 14.171 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -8.662 -1.137 14.787 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -7.478 -4.318 13.582 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -7.176 -3.009 14.728 1.00 0.00 H new ATOM 426 N PRO A 29 -8.875 -2.821 18.312 1.00 0.00 N ATOM 427 CA PRO A 29 -8.104 -2.524 19.531 1.00 0.00 C ATOM 428 C PRO A 29 -6.577 -2.494 19.333 1.00 0.00 C ATOM 429 O PRO A 29 -5.863 -1.896 20.140 1.00 0.00 O ATOM 430 CB PRO A 29 -8.525 -3.590 20.550 1.00 0.00 C ATOM 431 CG PRO A 29 -8.964 -4.765 19.679 1.00 0.00 C ATOM 432 CD PRO A 29 -9.591 -4.080 18.466 1.00 0.00 C ATOM 0 HA PRO A 29 -8.327 -1.512 19.868 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -7.700 -3.864 21.207 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -9.336 -3.238 21.187 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -8.120 -5.394 19.396 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -9.679 -5.405 20.196 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -9.493 -4.698 17.573 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -10.656 -3.909 18.620 1.00 0.00 H new ATOM 440 N MET A 30 -6.076 -3.056 18.225 1.00 0.00 N ATOM 441 CA MET A 30 -4.684 -2.922 17.763 1.00 0.00 C ATOM 442 C MET A 30 -4.233 -1.459 17.608 1.00 0.00 C ATOM 443 O MET A 30 -3.043 -1.169 17.736 1.00 0.00 O ATOM 444 CB MET A 30 -4.528 -3.620 16.405 1.00 0.00 C ATOM 445 CG MET A 30 -4.640 -5.148 16.474 1.00 0.00 C ATOM 446 SD MET A 30 -4.759 -5.987 14.863 1.00 0.00 S ATOM 447 CE MET A 30 -3.436 -5.173 13.926 1.00 0.00 C ATOM 0 H MET A 30 -6.643 -3.634 17.605 1.00 0.00 H new ATOM 0 HA MET A 30 -4.058 -3.383 18.527 1.00 0.00 H new ATOM 0 HB2 MET A 30 -5.289 -3.240 15.723 1.00 0.00 H new ATOM 0 HB3 MET A 30 -3.559 -3.355 15.981 1.00 0.00 H new ATOM 0 HG2 MET A 30 -3.771 -5.537 17.005 1.00 0.00 H new ATOM 0 HG3 MET A 30 -5.518 -5.406 17.066 1.00 0.00 H new ATOM 0 HE1 MET A 30 -3.226 -5.744 13.021 1.00 0.00 H new ATOM 0 HE2 MET A 30 -3.750 -4.165 13.654 1.00 0.00 H new ATOM 0 HE3 MET A 30 -2.536 -5.120 14.538 1.00 0.00 H new ATOM 457 N VAL A 31 -5.165 -0.530 17.351 1.00 0.00 N ATOM 458 CA VAL A 31 -4.874 0.903 17.209 1.00 0.00 C ATOM 459 C VAL A 31 -4.203 1.459 18.465 1.00 0.00 C ATOM 460 O VAL A 31 -3.104 1.999 18.376 1.00 0.00 O ATOM 461 CB VAL A 31 -6.135 1.707 16.827 1.00 0.00 C ATOM 462 CG1 VAL A 31 -5.867 3.214 16.797 1.00 0.00 C ATOM 463 CG2 VAL A 31 -6.620 1.312 15.428 1.00 0.00 C ATOM 0 H VAL A 31 -6.153 -0.756 17.235 1.00 0.00 H new ATOM 0 HA VAL A 31 -4.168 1.014 16.386 1.00 0.00 H new ATOM 0 HB VAL A 31 -6.883 1.479 17.586 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -6.781 3.741 16.524 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.538 3.545 17.782 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -5.090 3.431 16.064 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -7.510 1.889 15.175 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.835 1.517 14.700 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.860 0.249 15.413 1.00 0.00 H new ATOM 473 N GLN A 32 -4.811 1.282 19.641 1.00 0.00 N ATOM 474 CA GLN A 32 -4.308 1.835 20.907 1.00 0.00 C ATOM 475 C GLN A 32 -2.862 1.394 21.205 1.00 0.00 C ATOM 476 O GLN A 32 -2.027 2.206 21.608 1.00 0.00 O ATOM 477 CB GLN A 32 -5.246 1.444 22.066 1.00 0.00 C ATOM 478 CG GLN A 32 -6.737 1.777 21.860 1.00 0.00 C ATOM 479 CD GLN A 32 -7.009 3.265 21.645 1.00 0.00 C ATOM 480 OE1 GLN A 32 -6.703 3.839 20.610 1.00 0.00 O ATOM 481 NE2 GLN A 32 -7.604 3.952 22.597 1.00 0.00 N ATOM 0 H GLN A 32 -5.673 0.747 19.745 1.00 0.00 H new ATOM 0 HA GLN A 32 -4.294 2.920 20.807 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -5.153 0.372 22.239 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -4.903 1.944 22.972 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -7.109 1.221 21.000 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -7.300 1.435 22.729 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -7.868 3.493 23.469 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -7.801 4.944 22.463 1.00 0.00 H new ATOM 490 N GLU A 33 -2.546 0.121 20.953 1.00 0.00 N ATOM 491 CA GLU A 33 -1.201 -0.454 21.086 1.00 0.00 C ATOM 492 C GLU A 33 -0.175 0.178 20.123 1.00 0.00 C ATOM 493 O GLU A 33 0.981 0.366 20.505 1.00 0.00 O ATOM 494 CB GLU A 33 -1.309 -1.977 20.894 1.00 0.00 C ATOM 495 CG GLU A 33 0.018 -2.753 20.966 1.00 0.00 C ATOM 496 CD GLU A 33 0.781 -2.591 22.300 1.00 0.00 C ATOM 497 OE1 GLU A 33 0.148 -2.359 23.359 1.00 0.00 O ATOM 498 OE2 GLU A 33 2.027 -2.735 22.306 1.00 0.00 O ATOM 0 H GLU A 33 -3.238 -0.560 20.641 1.00 0.00 H new ATOM 0 HA GLU A 33 -0.820 -0.230 22.083 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.983 -2.374 21.653 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.770 -2.171 19.926 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.185 -3.812 20.804 1.00 0.00 H new ATOM 0 HG3 GLU A 33 0.662 -2.424 20.151 1.00 0.00 H new ATOM 505 N ALA A 34 -0.575 0.560 18.905 1.00 0.00 N ATOM 506 CA ALA A 34 0.289 1.284 17.970 1.00 0.00 C ATOM 507 C ALA A 34 0.656 2.687 18.494 1.00 0.00 C ATOM 508 O ALA A 34 1.844 3.008 18.583 1.00 0.00 O ATOM 509 CB ALA A 34 -0.364 1.322 16.584 1.00 0.00 C ATOM 0 H ALA A 34 -1.509 0.375 18.540 1.00 0.00 H new ATOM 0 HA ALA A 34 1.234 0.749 17.880 1.00 0.00 H new ATOM 0 HB1 ALA A 34 0.282 1.862 15.892 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.512 0.304 16.224 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.328 1.827 16.649 1.00 0.00 H new ATOM 515 N ILE A 35 -0.323 3.509 18.911 1.00 0.00 N ATOM 516 CA ILE A 35 -0.039 4.812 19.554 1.00 0.00 C ATOM 517 C ILE A 35 0.876 4.645 20.778 1.00 0.00 C ATOM 518 O ILE A 35 1.826 5.413 20.946 1.00 0.00 O ATOM 519 CB ILE A 35 -1.329 5.595 19.913 1.00 0.00 C ATOM 520 CG1 ILE A 35 -2.049 6.124 18.650 1.00 0.00 C ATOM 521 CG2 ILE A 35 -1.032 6.809 20.819 1.00 0.00 C ATOM 522 CD1 ILE A 35 -3.282 5.296 18.293 1.00 0.00 C ATOM 0 H ILE A 35 -1.317 3.298 18.816 1.00 0.00 H new ATOM 0 HA ILE A 35 0.493 5.413 18.817 1.00 0.00 H new ATOM 0 HB ILE A 35 -1.966 4.884 20.439 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -2.345 7.161 18.811 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.355 6.118 17.810 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -1.962 7.329 21.047 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -0.571 6.467 21.746 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -0.352 7.489 20.305 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -3.751 5.708 17.400 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -2.985 4.264 18.104 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -3.991 5.324 19.121 1.00 0.00 H new ATOM 534 N ARG A 36 0.643 3.619 21.608 1.00 0.00 N ATOM 535 CA ARG A 36 1.439 3.318 22.812 1.00 0.00 C ATOM 536 C ARG A 36 2.944 3.130 22.538 1.00 0.00 C ATOM 537 O ARG A 36 3.753 3.466 23.404 1.00 0.00 O ATOM 538 CB ARG A 36 0.814 2.106 23.526 1.00 0.00 C ATOM 539 CG ARG A 36 1.404 1.848 24.917 1.00 0.00 C ATOM 540 CD ARG A 36 0.708 0.656 25.585 1.00 0.00 C ATOM 541 NE ARG A 36 1.322 0.342 26.890 1.00 0.00 N ATOM 542 CZ ARG A 36 2.428 -0.348 27.112 1.00 0.00 C ATOM 543 NH1 ARG A 36 3.104 -0.907 26.147 1.00 0.00 N ATOM 544 NH2 ARG A 36 2.886 -0.486 28.323 1.00 0.00 N ATOM 0 H ARG A 36 -0.120 2.959 21.460 1.00 0.00 H new ATOM 0 HA ARG A 36 1.401 4.189 23.467 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -0.261 2.263 23.619 1.00 0.00 H new ATOM 0 HB3 ARG A 36 0.955 1.218 22.909 1.00 0.00 H new ATOM 0 HG2 ARG A 36 2.473 1.652 24.834 1.00 0.00 H new ATOM 0 HG3 ARG A 36 1.290 2.737 25.537 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -0.350 0.880 25.722 1.00 0.00 H new ATOM 0 HD3 ARG A 36 0.768 -0.215 24.933 1.00 0.00 H new ATOM 0 HE ARG A 36 0.838 0.698 27.714 1.00 0.00 H new ATOM 0 HH11 ARG A 36 2.784 -0.819 25.183 1.00 0.00 H new ATOM 0 HH12 ARG A 36 3.953 -1.432 26.357 1.00 0.00 H new ATOM 0 HH21 ARG A 36 2.391 -0.061 29.107 1.00 0.00 H new ATOM 0 HH22 ARG A 36 3.740 -1.019 28.488 1.00 0.00 H new ATOM 558 N MET A 37 3.341 2.660 21.348 1.00 0.00 N ATOM 559 CA MET A 37 4.760 2.557 20.954 1.00 0.00 C ATOM 560 C MET A 37 5.415 3.900 20.559 1.00 0.00 C ATOM 561 O MET A 37 6.642 3.963 20.449 1.00 0.00 O ATOM 562 CB MET A 37 4.952 1.559 19.802 1.00 0.00 C ATOM 563 CG MET A 37 4.458 0.141 20.115 1.00 0.00 C ATOM 564 SD MET A 37 5.435 -1.204 19.373 1.00 0.00 S ATOM 565 CE MET A 37 5.692 -0.577 17.690 1.00 0.00 C ATOM 0 H MET A 37 2.692 2.340 20.629 1.00 0.00 H new ATOM 0 HA MET A 37 5.263 2.205 21.855 1.00 0.00 H new ATOM 0 HB2 MET A 37 4.426 1.930 18.922 1.00 0.00 H new ATOM 0 HB3 MET A 37 6.010 1.515 19.546 1.00 0.00 H new ATOM 0 HG2 MET A 37 4.449 0.007 21.197 1.00 0.00 H new ATOM 0 HG3 MET A 37 3.427 0.050 19.774 1.00 0.00 H new ATOM 0 HE1 MET A 37 6.000 -1.396 17.040 1.00 0.00 H new ATOM 0 HE2 MET A 37 4.763 -0.147 17.316 1.00 0.00 H new ATOM 0 HE3 MET A 37 6.468 0.189 17.701 1.00 0.00 H new ATOM 575 N GLY A 38 4.635 4.966 20.351 1.00 0.00 N ATOM 576 CA GLY A 38 5.111 6.329 20.058 1.00 0.00 C ATOM 577 C GLY A 38 4.590 6.955 18.753 1.00 0.00 C ATOM 578 O GLY A 38 4.862 8.132 18.501 1.00 0.00 O ATOM 0 H GLY A 38 3.617 4.905 20.382 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.830 6.978 20.887 1.00 0.00 H new ATOM 0 HA3 GLY A 38 6.200 6.313 20.021 1.00 0.00 H new ATOM 582 N PHE A 39 3.845 6.214 17.924 1.00 0.00 N ATOM 583 CA PHE A 39 3.155 6.758 16.742 1.00 0.00 C ATOM 584 C PHE A 39 2.025 7.739 17.132 1.00 0.00 C ATOM 585 O PHE A 39 1.460 7.648 18.225 1.00 0.00 O ATOM 586 CB PHE A 39 2.568 5.599 15.926 1.00 0.00 C ATOM 587 CG PHE A 39 3.570 4.676 15.250 1.00 0.00 C ATOM 588 CD1 PHE A 39 4.236 5.092 14.081 1.00 0.00 C ATOM 589 CD2 PHE A 39 3.793 3.377 15.748 1.00 0.00 C ATOM 590 CE1 PHE A 39 5.122 4.220 13.423 1.00 0.00 C ATOM 591 CE2 PHE A 39 4.671 2.502 15.088 1.00 0.00 C ATOM 592 CZ PHE A 39 5.334 2.922 13.924 1.00 0.00 C ATOM 0 H PHE A 39 3.701 5.212 18.053 1.00 0.00 H new ATOM 0 HA PHE A 39 3.884 7.312 16.151 1.00 0.00 H new ATOM 0 HB2 PHE A 39 1.941 4.999 16.586 1.00 0.00 H new ATOM 0 HB3 PHE A 39 1.916 6.016 15.159 1.00 0.00 H new ATOM 0 HD1 PHE A 39 4.066 6.084 13.689 1.00 0.00 H new ATOM 0 HD2 PHE A 39 3.285 3.052 16.644 1.00 0.00 H new ATOM 0 HE1 PHE A 39 5.640 4.547 12.533 1.00 0.00 H new ATOM 0 HE2 PHE A 39 4.836 1.507 15.475 1.00 0.00 H new ATOM 0 HZ PHE A 39 6.007 2.249 13.413 1.00 0.00 H new ATOM 602 N SER A 40 1.647 8.653 16.233 1.00 0.00 N ATOM 603 CA SER A 40 0.504 9.565 16.434 1.00 0.00 C ATOM 604 C SER A 40 -0.832 8.893 16.086 1.00 0.00 C ATOM 605 O SER A 40 -0.899 8.087 15.156 1.00 0.00 O ATOM 606 CB SER A 40 0.661 10.820 15.565 1.00 0.00 C ATOM 607 OG SER A 40 1.872 11.506 15.849 1.00 0.00 O ATOM 0 H SER A 40 2.123 8.786 15.341 1.00 0.00 H new ATOM 0 HA SER A 40 0.497 9.835 17.490 1.00 0.00 H new ATOM 0 HB2 SER A 40 0.640 10.539 14.512 1.00 0.00 H new ATOM 0 HB3 SER A 40 -0.184 11.488 15.734 1.00 0.00 H new ATOM 0 HG SER A 40 1.941 12.299 15.277 1.00 0.00 H new ATOM 613 N PHE A 41 -1.922 9.285 16.760 1.00 0.00 N ATOM 614 CA PHE A 41 -3.292 8.795 16.502 1.00 0.00 C ATOM 615 C PHE A 41 -3.691 8.885 15.026 1.00 0.00 C ATOM 616 O PHE A 41 -4.147 7.900 14.440 1.00 0.00 O ATOM 617 CB PHE A 41 -4.305 9.546 17.389 1.00 0.00 C ATOM 618 CG PHE A 41 -4.767 8.758 18.598 1.00 0.00 C ATOM 619 CD1 PHE A 41 -5.744 7.758 18.438 1.00 0.00 C ATOM 620 CD2 PHE A 41 -4.226 9.010 19.874 1.00 0.00 C ATOM 621 CE1 PHE A 41 -6.170 7.004 19.545 1.00 0.00 C ATOM 622 CE2 PHE A 41 -4.654 8.254 20.982 1.00 0.00 C ATOM 623 CZ PHE A 41 -5.623 7.248 20.817 1.00 0.00 C ATOM 0 H PHE A 41 -1.880 9.967 17.518 1.00 0.00 H new ATOM 0 HA PHE A 41 -3.304 7.736 16.760 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -3.855 10.480 17.727 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.174 9.811 16.787 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -6.167 7.569 17.463 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -3.483 9.783 20.002 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -6.919 6.236 19.418 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -4.238 8.447 21.960 1.00 0.00 H new ATOM 0 HZ PHE A 41 -5.946 6.664 21.666 1.00 0.00 H new ATOM 633 N LYS A 42 -3.465 10.062 14.426 1.00 0.00 N ATOM 634 CA LYS A 42 -3.687 10.381 13.008 1.00 0.00 C ATOM 635 C LYS A 42 -3.088 9.335 12.064 1.00 0.00 C ATOM 636 O LYS A 42 -3.743 8.928 11.108 1.00 0.00 O ATOM 637 CB LYS A 42 -3.153 11.806 12.751 1.00 0.00 C ATOM 638 CG LYS A 42 -3.267 12.280 11.292 1.00 0.00 C ATOM 639 CD LYS A 42 -2.064 11.935 10.391 1.00 0.00 C ATOM 640 CE LYS A 42 -0.926 12.970 10.414 1.00 0.00 C ATOM 641 NZ LYS A 42 -0.011 12.790 11.571 1.00 0.00 N ATOM 0 H LYS A 42 -3.102 10.861 14.945 1.00 0.00 H new ATOM 0 HA LYS A 42 -4.755 10.353 12.790 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -3.696 12.504 13.389 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -2.106 11.847 13.052 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -4.165 11.843 10.854 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.404 13.361 11.288 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -1.664 10.968 10.697 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.416 11.824 9.365 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -0.354 12.896 9.489 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.353 13.973 10.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.870 13.317 11.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.468 13.147 12.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 0.207 11.780 11.687 1.00 0.00 H new ATOM 655 N ASP A 43 -1.855 8.901 12.330 1.00 0.00 N ATOM 656 CA ASP A 43 -1.111 7.977 11.465 1.00 0.00 C ATOM 657 C ASP A 43 -1.815 6.615 11.390 1.00 0.00 C ATOM 658 O ASP A 43 -1.953 6.035 10.311 1.00 0.00 O ATOM 659 CB ASP A 43 0.330 7.770 11.968 1.00 0.00 C ATOM 660 CG ASP A 43 1.159 9.047 12.192 1.00 0.00 C ATOM 661 OD1 ASP A 43 0.793 10.139 11.691 1.00 0.00 O ATOM 662 OD2 ASP A 43 2.184 8.953 12.906 1.00 0.00 O ATOM 0 H ASP A 43 -1.337 9.183 13.162 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.077 8.426 10.472 1.00 0.00 H new ATOM 0 HB2 ASP A 43 0.290 7.218 12.907 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.857 7.141 11.251 1.00 0.00 H new ATOM 667 N ILE A 44 -2.291 6.116 12.538 1.00 0.00 N ATOM 668 CA ILE A 44 -2.912 4.793 12.642 1.00 0.00 C ATOM 669 C ILE A 44 -4.274 4.774 11.949 1.00 0.00 C ATOM 670 O ILE A 44 -4.510 3.941 11.074 1.00 0.00 O ATOM 671 CB ILE A 44 -3.052 4.296 14.095 1.00 0.00 C ATOM 672 CG1 ILE A 44 -1.912 4.683 15.057 1.00 0.00 C ATOM 673 CG2 ILE A 44 -3.200 2.763 14.043 1.00 0.00 C ATOM 674 CD1 ILE A 44 -0.500 4.352 14.582 1.00 0.00 C ATOM 0 H ILE A 44 -2.255 6.622 13.423 1.00 0.00 H new ATOM 0 HA ILE A 44 -2.236 4.104 12.136 1.00 0.00 H new ATOM 0 HB ILE A 44 -3.925 4.797 14.513 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.969 5.755 15.245 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -2.081 4.182 16.010 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -3.302 2.373 15.056 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.085 2.502 13.463 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.318 2.328 13.574 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.221 4.668 15.336 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.412 3.277 14.423 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.299 4.874 13.647 1.00 0.00 H new ATOM 686 N LYS A 45 -5.174 5.705 12.298 1.00 0.00 N ATOM 687 CA LYS A 45 -6.488 5.809 11.640 1.00 0.00 C ATOM 688 C LYS A 45 -6.356 5.994 10.123 1.00 0.00 C ATOM 689 O LYS A 45 -7.097 5.345 9.386 1.00 0.00 O ATOM 690 CB LYS A 45 -7.398 6.839 12.345 1.00 0.00 C ATOM 691 CG LYS A 45 -6.862 8.279 12.438 1.00 0.00 C ATOM 692 CD LYS A 45 -7.158 9.172 11.227 1.00 0.00 C ATOM 693 CE LYS A 45 -8.609 9.647 11.219 1.00 0.00 C ATOM 694 NZ LYS A 45 -8.889 10.398 9.972 1.00 0.00 N ATOM 0 H LYS A 45 -5.018 6.397 13.031 1.00 0.00 H new ATOM 0 HA LYS A 45 -7.005 4.856 11.754 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -8.354 6.864 11.822 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -7.597 6.483 13.356 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -7.284 8.749 13.326 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.782 8.238 12.582 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -6.492 10.035 11.239 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.950 8.622 10.309 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -9.281 8.792 11.297 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -8.798 10.281 12.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -9.916 10.527 9.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -8.426 11.328 10.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -8.522 9.867 9.157 1.00 0.00 H new ATOM 708 N LYS A 46 -5.364 6.771 9.653 1.00 0.00 N ATOM 709 CA LYS A 46 -5.039 6.947 8.225 1.00 0.00 C ATOM 710 C LYS A 46 -4.615 5.632 7.568 1.00 0.00 C ATOM 711 O LYS A 46 -5.166 5.271 6.527 1.00 0.00 O ATOM 712 CB LYS A 46 -3.984 8.057 8.034 1.00 0.00 C ATOM 713 CG LYS A 46 -3.417 8.173 6.603 1.00 0.00 C ATOM 714 CD LYS A 46 -4.465 8.415 5.499 1.00 0.00 C ATOM 715 CE LYS A 46 -3.907 8.103 4.102 1.00 0.00 C ATOM 716 NZ LYS A 46 -2.835 9.037 3.662 1.00 0.00 N ATOM 0 H LYS A 46 -4.752 7.306 10.269 1.00 0.00 H new ATOM 0 HA LYS A 46 -5.948 7.266 7.715 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -4.428 9.013 8.312 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.159 7.877 8.723 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -2.694 8.989 6.581 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -2.872 7.258 6.370 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -5.341 7.794 5.687 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -4.797 9.453 5.534 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.515 7.086 4.096 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -4.723 8.134 3.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.472 8.736 2.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -3.222 9.999 3.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.061 9.029 4.357 1.00 0.00 H new ATOM 730 N ILE A 47 -3.644 4.911 8.134 1.00 0.00 N ATOM 731 CA ILE A 47 -3.203 3.655 7.516 1.00 0.00 C ATOM 732 C ILE A 47 -4.298 2.578 7.549 1.00 0.00 C ATOM 733 O ILE A 47 -4.414 1.812 6.599 1.00 0.00 O ATOM 734 CB ILE A 47 -1.843 3.178 8.066 1.00 0.00 C ATOM 735 CG1 ILE A 47 -1.156 2.314 6.991 1.00 0.00 C ATOM 736 CG2 ILE A 47 -1.947 2.440 9.410 1.00 0.00 C ATOM 737 CD1 ILE A 47 0.314 2.032 7.297 1.00 0.00 C ATOM 0 H ILE A 47 -3.159 5.164 8.995 1.00 0.00 H new ATOM 0 HA ILE A 47 -3.029 3.859 6.460 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.237 4.058 8.282 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -1.689 1.368 6.898 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -1.230 2.817 6.027 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -0.953 2.134 9.735 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.385 3.103 10.156 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -2.577 1.559 9.293 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.740 1.419 6.502 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.859 2.974 7.361 1.00 0.00 H new ATOM 0 HD13 ILE A 47 0.393 1.502 8.246 1.00 0.00 H new ATOM 749 N MET A 48 -5.153 2.553 8.581 1.00 0.00 N ATOM 750 CA MET A 48 -6.305 1.646 8.649 1.00 0.00 C ATOM 751 C MET A 48 -7.374 1.949 7.591 1.00 0.00 C ATOM 752 O MET A 48 -7.775 1.030 6.873 1.00 0.00 O ATOM 753 CB MET A 48 -6.924 1.634 10.052 1.00 0.00 C ATOM 754 CG MET A 48 -6.000 0.971 11.080 1.00 0.00 C ATOM 755 SD MET A 48 -6.857 -0.117 12.246 1.00 0.00 S ATOM 756 CE MET A 48 -5.415 -0.875 13.037 1.00 0.00 C ATOM 0 H MET A 48 -5.064 3.163 9.394 1.00 0.00 H new ATOM 0 HA MET A 48 -5.917 0.652 8.429 1.00 0.00 H new ATOM 0 HB2 MET A 48 -7.138 2.657 10.363 1.00 0.00 H new ATOM 0 HB3 MET A 48 -7.876 1.103 10.024 1.00 0.00 H new ATOM 0 HG2 MET A 48 -5.240 0.395 10.552 1.00 0.00 H new ATOM 0 HG3 MET A 48 -5.479 1.748 11.639 1.00 0.00 H new ATOM 0 HE1 MET A 48 -5.743 -1.503 13.865 1.00 0.00 H new ATOM 0 HE2 MET A 48 -4.879 -1.484 12.309 1.00 0.00 H new ATOM 0 HE3 MET A 48 -4.754 -0.094 13.413 1.00 0.00 H new ATOM 766 N GLU A 49 -7.842 3.199 7.469 1.00 0.00 N ATOM 767 CA GLU A 49 -8.837 3.570 6.445 1.00 0.00 C ATOM 768 C GLU A 49 -8.317 3.300 5.017 1.00 0.00 C ATOM 769 O GLU A 49 -9.059 2.776 4.187 1.00 0.00 O ATOM 770 CB GLU A 49 -9.366 5.013 6.643 1.00 0.00 C ATOM 771 CG GLU A 49 -8.326 6.109 6.373 1.00 0.00 C ATOM 772 CD GLU A 49 -8.784 7.551 6.685 1.00 0.00 C ATOM 773 OE1 GLU A 49 -9.223 7.858 7.822 1.00 0.00 O ATOM 774 OE2 GLU A 49 -8.615 8.420 5.799 1.00 0.00 O ATOM 0 H GLU A 49 -7.549 3.973 8.066 1.00 0.00 H new ATOM 0 HA GLU A 49 -9.701 2.919 6.578 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -10.220 5.168 5.984 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -9.730 5.117 7.665 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -7.435 5.894 6.963 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -8.034 6.058 5.324 1.00 0.00 H new ATOM 781 N GLU A 50 -7.028 3.556 4.741 1.00 0.00 N ATOM 782 CA GLU A 50 -6.382 3.176 3.476 1.00 0.00 C ATOM 783 C GLU A 50 -6.281 1.659 3.284 1.00 0.00 C ATOM 784 O GLU A 50 -6.665 1.160 2.228 1.00 0.00 O ATOM 785 CB GLU A 50 -4.982 3.803 3.352 1.00 0.00 C ATOM 786 CG GLU A 50 -5.006 5.160 2.642 1.00 0.00 C ATOM 787 CD GLU A 50 -5.286 5.004 1.133 1.00 0.00 C ATOM 788 OE1 GLU A 50 -4.315 4.837 0.357 1.00 0.00 O ATOM 789 OE2 GLU A 50 -6.471 5.052 0.724 1.00 0.00 O ATOM 0 H GLU A 50 -6.404 4.034 5.391 1.00 0.00 H new ATOM 0 HA GLU A 50 -7.027 3.566 2.689 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -4.553 3.925 4.347 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.330 3.122 2.805 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -5.771 5.793 3.091 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -4.050 5.664 2.786 1.00 0.00 H new ATOM 796 N LYS A 51 -5.783 0.905 4.273 1.00 0.00 N ATOM 797 CA LYS A 51 -5.633 -0.558 4.194 1.00 0.00 C ATOM 798 C LYS A 51 -6.958 -1.241 3.847 1.00 0.00 C ATOM 799 O LYS A 51 -7.000 -2.045 2.916 1.00 0.00 O ATOM 800 CB LYS A 51 -5.010 -1.083 5.503 1.00 0.00 C ATOM 801 CG LYS A 51 -4.843 -2.609 5.574 1.00 0.00 C ATOM 802 CD LYS A 51 -3.952 -3.196 4.469 1.00 0.00 C ATOM 803 CE LYS A 51 -3.820 -4.713 4.659 1.00 0.00 C ATOM 804 NZ LYS A 51 -3.101 -5.358 3.527 1.00 0.00 N ATOM 0 H LYS A 51 -5.469 1.296 5.161 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.954 -0.807 3.379 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -4.033 -0.619 5.635 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.631 -0.761 6.339 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.421 -2.873 6.544 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.827 -3.074 5.517 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.380 -2.979 3.490 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -2.967 -2.730 4.497 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -3.289 -4.917 5.589 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -4.812 -5.154 4.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -2.708 -6.269 3.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -3.763 -5.518 2.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -2.329 -4.739 3.208 1.00 0.00 H new ATOM 818 N ILE A 52 -8.042 -0.883 4.537 1.00 0.00 N ATOM 819 CA ILE A 52 -9.398 -1.384 4.257 1.00 0.00 C ATOM 820 C ILE A 52 -9.835 -1.024 2.824 1.00 0.00 C ATOM 821 O ILE A 52 -10.296 -1.898 2.091 1.00 0.00 O ATOM 822 CB ILE A 52 -10.398 -0.876 5.325 1.00 0.00 C ATOM 823 CG1 ILE A 52 -10.030 -1.430 6.722 1.00 0.00 C ATOM 824 CG2 ILE A 52 -11.838 -1.303 4.976 1.00 0.00 C ATOM 825 CD1 ILE A 52 -10.718 -0.696 7.883 1.00 0.00 C ATOM 0 H ILE A 52 -8.007 -0.228 5.318 1.00 0.00 H new ATOM 0 HA ILE A 52 -9.388 -2.472 4.318 1.00 0.00 H new ATOM 0 HB ILE A 52 -10.341 0.212 5.340 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -10.295 -2.486 6.765 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.950 -1.367 6.854 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -12.522 -0.935 5.740 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -12.117 -0.886 4.008 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -11.894 -2.391 4.932 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -10.410 -1.142 8.829 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.433 0.356 7.868 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.800 -0.781 7.777 1.00 0.00 H new ATOM 837 N GLN A 53 -9.675 0.236 2.402 1.00 0.00 N ATOM 838 CA GLN A 53 -10.092 0.720 1.078 1.00 0.00 C ATOM 839 C GLN A 53 -9.319 0.064 -0.086 1.00 0.00 C ATOM 840 O GLN A 53 -9.926 -0.418 -1.044 1.00 0.00 O ATOM 841 CB GLN A 53 -9.955 2.254 1.053 1.00 0.00 C ATOM 842 CG GLN A 53 -10.613 2.927 -0.164 1.00 0.00 C ATOM 843 CD GLN A 53 -12.122 2.688 -0.239 1.00 0.00 C ATOM 844 OE1 GLN A 53 -12.648 2.127 -1.191 1.00 0.00 O ATOM 845 NE2 GLN A 53 -12.881 3.089 0.762 1.00 0.00 N ATOM 0 H GLN A 53 -9.246 0.960 2.979 1.00 0.00 H new ATOM 0 HA GLN A 53 -11.132 0.432 0.923 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -10.397 2.662 1.962 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -8.896 2.513 1.069 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -10.423 4.000 -0.126 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -10.146 2.553 -1.075 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -12.461 3.558 1.564 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -13.888 2.930 0.734 1.00 0.00 H new ATOM 854 N ILE A 54 -7.983 0.054 -0.017 1.00 0.00 N ATOM 855 CA ILE A 54 -7.069 -0.453 -1.052 1.00 0.00 C ATOM 856 C ILE A 54 -7.046 -1.990 -1.086 1.00 0.00 C ATOM 857 O ILE A 54 -7.241 -2.592 -2.145 1.00 0.00 O ATOM 858 CB ILE A 54 -5.648 0.130 -0.831 1.00 0.00 C ATOM 859 CG1 ILE A 54 -5.609 1.676 -0.914 1.00 0.00 C ATOM 860 CG2 ILE A 54 -4.615 -0.468 -1.804 1.00 0.00 C ATOM 861 CD1 ILE A 54 -5.968 2.289 -2.277 1.00 0.00 C ATOM 0 H ILE A 54 -7.485 0.415 0.797 1.00 0.00 H new ATOM 0 HA ILE A 54 -7.434 -0.123 -2.025 1.00 0.00 H new ATOM 0 HB ILE A 54 -5.378 -0.158 0.185 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -6.293 2.077 -0.166 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -4.608 2.009 -0.641 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -3.636 -0.029 -1.610 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -4.563 -1.547 -1.662 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -4.913 -0.251 -2.830 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -5.907 3.375 -2.215 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.270 1.929 -3.033 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -6.982 1.998 -2.551 1.00 0.00 H new ATOM 873 N SER A 55 -6.784 -2.633 0.058 1.00 0.00 N ATOM 874 CA SER A 55 -6.541 -4.083 0.164 1.00 0.00 C ATOM 875 C SER A 55 -7.819 -4.917 0.357 1.00 0.00 C ATOM 876 O SER A 55 -7.817 -6.121 0.089 1.00 0.00 O ATOM 877 CB SER A 55 -5.595 -4.332 1.342 1.00 0.00 C ATOM 878 OG SER A 55 -4.882 -5.551 1.222 1.00 0.00 O ATOM 0 H SER A 55 -6.733 -2.153 0.957 1.00 0.00 H new ATOM 0 HA SER A 55 -6.106 -4.404 -0.783 1.00 0.00 H new ATOM 0 HB2 SER A 55 -4.886 -3.507 1.414 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.169 -4.341 2.268 1.00 0.00 H new ATOM 0 HG SER A 55 -5.466 -6.235 0.832 1.00 0.00 H new ATOM 884 N GLY A 56 -8.910 -4.297 0.819 1.00 0.00 N ATOM 885 CA GLY A 56 -10.229 -4.914 1.028 1.00 0.00 C ATOM 886 C GLY A 56 -10.499 -5.424 2.454 1.00 0.00 C ATOM 887 O GLY A 56 -11.650 -5.718 2.786 1.00 0.00 O ATOM 0 H GLY A 56 -8.900 -3.308 1.069 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -10.997 -4.186 0.769 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -10.335 -5.749 0.335 1.00 0.00 H new ATOM 891 N SER A 57 -9.476 -5.516 3.310 1.00 0.00 N ATOM 892 CA SER A 57 -9.565 -5.936 4.721 1.00 0.00 C ATOM 893 C SER A 57 -8.484 -5.269 5.585 1.00 0.00 C ATOM 894 O SER A 57 -7.435 -4.865 5.077 1.00 0.00 O ATOM 895 CB SER A 57 -9.457 -7.467 4.828 1.00 0.00 C ATOM 896 OG SER A 57 -8.241 -7.952 4.274 1.00 0.00 O ATOM 0 H SER A 57 -8.521 -5.291 3.031 1.00 0.00 H new ATOM 0 HA SER A 57 -10.536 -5.615 5.099 1.00 0.00 H new ATOM 0 HB2 SER A 57 -9.523 -7.763 5.875 1.00 0.00 H new ATOM 0 HB3 SER A 57 -10.300 -7.927 4.313 1.00 0.00 H new ATOM 0 HG SER A 57 -8.208 -8.927 4.362 1.00 0.00 H new ATOM 902 N ASN A 58 -8.734 -5.135 6.893 1.00 0.00 N ATOM 903 CA ASN A 58 -7.798 -4.542 7.860 1.00 0.00 C ATOM 904 C ASN A 58 -6.673 -5.522 8.281 1.00 0.00 C ATOM 905 O ASN A 58 -6.749 -6.730 8.039 1.00 0.00 O ATOM 906 CB ASN A 58 -8.612 -4.052 9.077 1.00 0.00 C ATOM 907 CG ASN A 58 -7.829 -3.094 9.959 1.00 0.00 C ATOM 908 OD1 ASN A 58 -7.305 -3.444 11.001 1.00 0.00 O ATOM 909 ND2 ASN A 58 -7.663 -1.859 9.548 1.00 0.00 N ATOM 0 H ASN A 58 -9.609 -5.441 7.319 1.00 0.00 H new ATOM 0 HA ASN A 58 -7.286 -3.703 7.390 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -9.519 -3.559 8.727 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -8.925 -4.912 9.670 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -7.102 -1.209 10.099 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -8.095 -1.549 8.677 1.00 0.00 H new ATOM 916 N TYR A 59 -5.644 -5.003 8.958 1.00 0.00 N ATOM 917 CA TYR A 59 -4.589 -5.775 9.624 1.00 0.00 C ATOM 918 C TYR A 59 -5.130 -6.701 10.738 1.00 0.00 C ATOM 919 O TYR A 59 -6.170 -6.429 11.344 1.00 0.00 O ATOM 920 CB TYR A 59 -3.565 -4.782 10.203 1.00 0.00 C ATOM 921 CG TYR A 59 -2.956 -3.839 9.180 1.00 0.00 C ATOM 922 CD1 TYR A 59 -2.138 -4.357 8.157 1.00 0.00 C ATOM 923 CD2 TYR A 59 -3.213 -2.453 9.235 1.00 0.00 C ATOM 924 CE1 TYR A 59 -1.561 -3.497 7.206 1.00 0.00 C ATOM 925 CE2 TYR A 59 -2.642 -1.590 8.278 1.00 0.00 C ATOM 926 CZ TYR A 59 -1.808 -2.110 7.265 1.00 0.00 C ATOM 927 OH TYR A 59 -1.277 -1.283 6.327 1.00 0.00 O ATOM 0 H TYR A 59 -5.518 -3.996 9.061 1.00 0.00 H new ATOM 0 HA TYR A 59 -4.126 -6.431 8.887 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -4.050 -4.191 10.980 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -2.764 -5.344 10.683 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -1.953 -5.420 8.103 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -3.848 -2.053 10.011 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -0.928 -3.899 6.429 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -2.843 -0.530 8.320 1.00 0.00 H new ATOM 0 HH TYR A 59 -0.518 -1.726 5.893 1.00 0.00 H new ATOM 937 N LYS A 60 -4.390 -7.781 11.045 1.00 0.00 N ATOM 938 CA LYS A 60 -4.738 -8.802 12.063 1.00 0.00 C ATOM 939 C LYS A 60 -3.640 -9.071 13.109 1.00 0.00 C ATOM 940 O LYS A 60 -3.865 -9.828 14.054 1.00 0.00 O ATOM 941 CB LYS A 60 -5.149 -10.111 11.360 1.00 0.00 C ATOM 942 CG LYS A 60 -6.495 -10.002 10.624 1.00 0.00 C ATOM 943 CD LYS A 60 -6.861 -11.246 9.797 1.00 0.00 C ATOM 944 CE LYS A 60 -7.065 -12.540 10.606 1.00 0.00 C ATOM 945 NZ LYS A 60 -5.798 -13.287 10.844 1.00 0.00 N ATOM 0 H LYS A 60 -3.504 -7.978 10.580 1.00 0.00 H new ATOM 0 HA LYS A 60 -5.573 -8.391 12.631 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -4.374 -10.393 10.648 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -5.209 -10.910 12.099 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -7.283 -9.820 11.355 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -6.467 -9.135 9.964 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -7.776 -11.036 9.242 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -6.074 -11.417 9.062 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -7.520 -12.294 11.565 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -7.766 -13.185 10.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -5.986 -14.309 10.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -5.105 -13.037 10.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -5.418 -13.037 11.779 1.00 0.00 H new ATOM 959 N SER A 61 -2.464 -8.459 12.957 1.00 0.00 N ATOM 960 CA SER A 61 -1.336 -8.522 13.896 1.00 0.00 C ATOM 961 C SER A 61 -0.617 -7.175 13.946 1.00 0.00 C ATOM 962 O SER A 61 -0.559 -6.461 12.941 1.00 0.00 O ATOM 963 CB SER A 61 -0.361 -9.621 13.456 1.00 0.00 C ATOM 964 OG SER A 61 0.763 -9.667 14.321 1.00 0.00 O ATOM 0 H SER A 61 -2.260 -7.880 12.142 1.00 0.00 H new ATOM 0 HA SER A 61 -1.713 -8.754 14.892 1.00 0.00 H new ATOM 0 HB2 SER A 61 -0.868 -10.586 13.458 1.00 0.00 H new ATOM 0 HB3 SER A 61 -0.032 -9.435 12.433 1.00 0.00 H new ATOM 0 HG SER A 61 1.374 -10.375 14.027 1.00 0.00 H new ATOM 970 N LEU A 62 -0.038 -6.830 15.099 1.00 0.00 N ATOM 971 CA LEU A 62 0.780 -5.625 15.249 1.00 0.00 C ATOM 972 C LEU A 62 2.013 -5.663 14.336 1.00 0.00 C ATOM 973 O LEU A 62 2.431 -4.615 13.861 1.00 0.00 O ATOM 974 CB LEU A 62 1.206 -5.422 16.719 1.00 0.00 C ATOM 975 CG LEU A 62 0.139 -4.923 17.716 1.00 0.00 C ATOM 976 CD1 LEU A 62 -0.558 -3.649 17.236 1.00 0.00 C ATOM 977 CD2 LEU A 62 -0.930 -5.967 18.043 1.00 0.00 C ATOM 0 H LEU A 62 -0.123 -7.379 15.955 1.00 0.00 H new ATOM 0 HA LEU A 62 0.164 -4.778 14.948 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.592 -6.371 17.090 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.034 -4.714 16.733 1.00 0.00 H new ATOM 0 HG LEU A 62 0.703 -4.712 18.625 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.299 -3.340 17.973 1.00 0.00 H new ATOM 0 HD12 LEU A 62 0.180 -2.857 17.109 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -1.052 -3.841 16.284 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.646 -5.546 18.749 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.449 -6.255 17.129 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.458 -6.845 18.484 1.00 0.00 H new ATOM 989 N GLU A 63 2.564 -6.845 14.040 1.00 0.00 N ATOM 990 CA GLU A 63 3.759 -7.021 13.200 1.00 0.00 C ATOM 991 C GLU A 63 3.601 -6.375 11.814 1.00 0.00 C ATOM 992 O GLU A 63 4.408 -5.525 11.427 1.00 0.00 O ATOM 993 CB GLU A 63 4.085 -8.517 13.051 1.00 0.00 C ATOM 994 CG GLU A 63 4.488 -9.206 14.363 1.00 0.00 C ATOM 995 CD GLU A 63 5.821 -8.664 14.916 1.00 0.00 C ATOM 996 OE1 GLU A 63 6.899 -9.049 14.401 1.00 0.00 O ATOM 997 OE2 GLU A 63 5.803 -7.855 15.876 1.00 0.00 O ATOM 0 H GLU A 63 2.185 -7.727 14.384 1.00 0.00 H new ATOM 0 HA GLU A 63 4.583 -6.514 13.701 1.00 0.00 H new ATOM 0 HB2 GLU A 63 3.215 -9.028 12.637 1.00 0.00 H new ATOM 0 HB3 GLU A 63 4.894 -8.631 12.330 1.00 0.00 H new ATOM 0 HG2 GLU A 63 3.702 -9.061 15.105 1.00 0.00 H new ATOM 0 HG3 GLU A 63 4.575 -10.280 14.197 1.00 0.00 H new ATOM 1004 N VAL A 64 2.550 -6.748 11.073 1.00 0.00 N ATOM 1005 CA VAL A 64 2.226 -6.145 9.769 1.00 0.00 C ATOM 1006 C VAL A 64 1.833 -4.668 9.906 1.00 0.00 C ATOM 1007 O VAL A 64 2.244 -3.850 9.082 1.00 0.00 O ATOM 1008 CB VAL A 64 1.172 -6.978 9.007 1.00 0.00 C ATOM 1009 CG1 VAL A 64 -0.174 -7.106 9.731 1.00 0.00 C ATOM 1010 CG2 VAL A 64 0.939 -6.440 7.592 1.00 0.00 C ATOM 0 H VAL A 64 1.897 -7.478 11.359 1.00 0.00 H new ATOM 0 HA VAL A 64 3.131 -6.162 9.162 1.00 0.00 H new ATOM 0 HB VAL A 64 1.602 -7.978 8.955 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.856 -7.706 9.128 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -0.023 -7.589 10.697 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -0.601 -6.115 9.884 1.00 0.00 H new ATOM 0 HG21 VAL A 64 0.191 -7.053 7.088 1.00 0.00 H new ATOM 0 HG22 VAL A 64 0.587 -5.410 7.648 1.00 0.00 H new ATOM 0 HG23 VAL A 64 1.873 -6.474 7.031 1.00 0.00 H new ATOM 1020 N LEU A 65 1.106 -4.301 10.971 1.00 0.00 N ATOM 1021 CA LEU A 65 0.673 -2.927 11.242 1.00 0.00 C ATOM 1022 C LEU A 65 1.876 -1.969 11.357 1.00 0.00 C ATOM 1023 O LEU A 65 1.954 -0.981 10.630 1.00 0.00 O ATOM 1024 CB LEU A 65 -0.195 -2.891 12.521 1.00 0.00 C ATOM 1025 CG LEU A 65 -1.443 -1.984 12.488 1.00 0.00 C ATOM 1026 CD1 LEU A 65 -1.860 -1.700 13.932 1.00 0.00 C ATOM 1027 CD2 LEU A 65 -1.273 -0.638 11.785 1.00 0.00 C ATOM 0 H LEU A 65 0.798 -4.966 11.681 1.00 0.00 H new ATOM 0 HA LEU A 65 0.070 -2.584 10.401 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.520 -3.908 12.740 1.00 0.00 H new ATOM 0 HB3 LEU A 65 0.435 -2.572 13.351 1.00 0.00 H new ATOM 0 HG LEU A 65 -2.185 -2.533 11.909 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -2.742 -1.059 13.937 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -2.091 -2.639 14.435 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -1.045 -1.199 14.454 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.212 -0.086 11.823 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.494 -0.063 12.284 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.992 -0.804 10.745 1.00 0.00 H new ATOM 1039 N VAL A 66 2.823 -2.257 12.261 1.00 0.00 N ATOM 1040 CA VAL A 66 3.980 -1.390 12.559 1.00 0.00 C ATOM 1041 C VAL A 66 5.005 -1.357 11.423 1.00 0.00 C ATOM 1042 O VAL A 66 5.595 -0.306 11.169 1.00 0.00 O ATOM 1043 CB VAL A 66 4.645 -1.714 13.912 1.00 0.00 C ATOM 1044 CG1 VAL A 66 3.610 -1.664 15.048 1.00 0.00 C ATOM 1045 CG2 VAL A 66 5.406 -3.045 13.938 1.00 0.00 C ATOM 0 H VAL A 66 2.810 -3.112 12.817 1.00 0.00 H new ATOM 0 HA VAL A 66 3.569 -0.384 12.645 1.00 0.00 H new ATOM 0 HB VAL A 66 5.398 -0.940 14.063 1.00 0.00 H new ATOM 0 HG11 VAL A 66 4.098 -1.895 15.995 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.173 -0.667 15.099 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.824 -2.395 14.857 1.00 0.00 H new ATOM 0 HG21 VAL A 66 5.843 -3.195 14.925 1.00 0.00 H new ATOM 0 HG22 VAL A 66 4.719 -3.862 13.717 1.00 0.00 H new ATOM 0 HG23 VAL A 66 6.199 -3.026 13.190 1.00 0.00 H new ATOM 1055 N ALA A 67 5.172 -2.465 10.692 1.00 0.00 N ATOM 1056 CA ALA A 67 5.972 -2.521 9.470 1.00 0.00 C ATOM 1057 C ALA A 67 5.400 -1.597 8.377 1.00 0.00 C ATOM 1058 O ALA A 67 6.120 -0.767 7.817 1.00 0.00 O ATOM 1059 CB ALA A 67 6.050 -3.977 8.996 1.00 0.00 C ATOM 0 H ALA A 67 4.748 -3.359 10.939 1.00 0.00 H new ATOM 0 HA ALA A 67 6.978 -2.159 9.681 1.00 0.00 H new ATOM 0 HB1 ALA A 67 6.645 -4.031 8.084 1.00 0.00 H new ATOM 0 HB2 ALA A 67 6.516 -4.587 9.770 1.00 0.00 H new ATOM 0 HB3 ALA A 67 5.045 -4.349 8.796 1.00 0.00 H new ATOM 1065 N ASP A 68 4.097 -1.705 8.094 1.00 0.00 N ATOM 1066 CA ASP A 68 3.416 -0.835 7.132 1.00 0.00 C ATOM 1067 C ASP A 68 3.384 0.633 7.593 1.00 0.00 C ATOM 1068 O ASP A 68 3.557 1.519 6.757 1.00 0.00 O ATOM 1069 CB ASP A 68 2.000 -1.350 6.833 1.00 0.00 C ATOM 1070 CG ASP A 68 1.945 -2.471 5.776 1.00 0.00 C ATOM 1071 OD1 ASP A 68 2.933 -3.221 5.579 1.00 0.00 O ATOM 1072 OD2 ASP A 68 0.894 -2.579 5.097 1.00 0.00 O ATOM 0 H ASP A 68 3.486 -2.398 8.526 1.00 0.00 H new ATOM 0 HA ASP A 68 3.995 -0.865 6.209 1.00 0.00 H new ATOM 0 HB2 ASP A 68 1.556 -1.717 7.758 1.00 0.00 H new ATOM 0 HB3 ASP A 68 1.386 -0.516 6.494 1.00 0.00 H new ATOM 1077 N LEU A 69 3.236 0.912 8.896 1.00 0.00 N ATOM 1078 CA LEU A 69 3.332 2.262 9.470 1.00 0.00 C ATOM 1079 C LEU A 69 4.672 2.924 9.142 1.00 0.00 C ATOM 1080 O LEU A 69 4.673 3.964 8.488 1.00 0.00 O ATOM 1081 CB LEU A 69 3.093 2.245 10.990 1.00 0.00 C ATOM 1082 CG LEU A 69 1.611 2.223 11.394 1.00 0.00 C ATOM 1083 CD1 LEU A 69 1.480 1.811 12.859 1.00 0.00 C ATOM 1084 CD2 LEU A 69 0.966 3.605 11.239 1.00 0.00 C ATOM 0 H LEU A 69 3.043 0.193 9.593 1.00 0.00 H new ATOM 0 HA LEU A 69 2.545 2.859 9.010 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.587 1.371 11.414 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.565 3.123 11.431 1.00 0.00 H new ATOM 0 HG LEU A 69 1.107 1.512 10.739 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.427 1.797 13.140 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.906 0.817 12.997 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.014 2.525 13.487 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.082 3.552 11.533 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.486 4.322 11.874 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.035 3.924 10.199 1.00 0.00 H new ATOM 1096 N VAL A 70 5.810 2.349 9.562 1.00 0.00 N ATOM 1097 CA VAL A 70 7.122 2.959 9.264 1.00 0.00 C ATOM 1098 C VAL A 70 7.351 3.115 7.757 1.00 0.00 C ATOM 1099 O VAL A 70 7.828 4.162 7.326 1.00 0.00 O ATOM 1100 CB VAL A 70 8.322 2.263 9.940 1.00 0.00 C ATOM 1101 CG1 VAL A 70 8.178 2.284 11.464 1.00 0.00 C ATOM 1102 CG2 VAL A 70 8.566 0.817 9.497 1.00 0.00 C ATOM 0 H VAL A 70 5.853 1.482 10.097 1.00 0.00 H new ATOM 0 HA VAL A 70 7.071 3.952 9.712 1.00 0.00 H new ATOM 0 HB VAL A 70 9.185 2.844 9.615 1.00 0.00 H new ATOM 0 HG11 VAL A 70 9.036 1.788 11.917 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.131 3.316 11.811 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.264 1.763 11.750 1.00 0.00 H new ATOM 0 HG21 VAL A 70 9.429 0.415 10.027 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.687 0.214 9.724 1.00 0.00 H new ATOM 0 HG23 VAL A 70 8.755 0.792 8.424 1.00 0.00 H new ATOM 1112 N ASN A 71 6.937 2.135 6.945 1.00 0.00 N ATOM 1113 CA ASN A 71 7.002 2.194 5.483 1.00 0.00 C ATOM 1114 C ASN A 71 6.191 3.371 4.896 1.00 0.00 C ATOM 1115 O ASN A 71 6.713 4.134 4.084 1.00 0.00 O ATOM 1116 CB ASN A 71 6.545 0.836 4.926 1.00 0.00 C ATOM 1117 CG ASN A 71 6.592 0.791 3.408 1.00 0.00 C ATOM 1118 OD1 ASN A 71 7.644 0.888 2.792 1.00 0.00 O ATOM 1119 ND2 ASN A 71 5.460 0.651 2.754 1.00 0.00 N ATOM 0 H ASN A 71 6.540 1.263 7.294 1.00 0.00 H new ATOM 0 HA ASN A 71 8.031 2.386 5.179 1.00 0.00 H new ATOM 0 HB2 ASN A 71 7.180 0.048 5.331 1.00 0.00 H new ATOM 0 HB3 ASN A 71 5.529 0.631 5.262 1.00 0.00 H new ATOM 0 HD21 ASN A 71 5.460 0.623 1.734 1.00 0.00 H new ATOM 0 HD22 ASN A 71 4.582 0.570 3.266 1.00 0.00 H new ATOM 1126 N ALA A 72 4.932 3.544 5.314 1.00 0.00 N ATOM 1127 CA ALA A 72 4.056 4.639 4.885 1.00 0.00 C ATOM 1128 C ALA A 72 4.507 6.024 5.402 1.00 0.00 C ATOM 1129 O ALA A 72 4.244 7.038 4.753 1.00 0.00 O ATOM 1130 CB ALA A 72 2.629 4.322 5.346 1.00 0.00 C ATOM 0 H ALA A 72 4.484 2.911 5.976 1.00 0.00 H new ATOM 0 HA ALA A 72 4.105 4.706 3.798 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.960 5.125 5.037 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.302 3.384 4.898 1.00 0.00 H new ATOM 0 HB3 ALA A 72 2.609 4.231 6.432 1.00 0.00 H new ATOM 1136 N GLN A 73 5.197 6.076 6.550 1.00 0.00 N ATOM 1137 CA GLN A 73 5.816 7.289 7.099 1.00 0.00 C ATOM 1138 C GLN A 73 7.092 7.722 6.345 1.00 0.00 C ATOM 1139 O GLN A 73 7.460 8.898 6.414 1.00 0.00 O ATOM 1140 CB GLN A 73 6.125 7.079 8.594 1.00 0.00 C ATOM 1141 CG GLN A 73 4.874 7.048 9.492 1.00 0.00 C ATOM 1142 CD GLN A 73 4.198 8.412 9.613 1.00 0.00 C ATOM 1143 OE1 GLN A 73 3.158 8.677 9.021 1.00 0.00 O ATOM 1144 NE2 GLN A 73 4.758 9.324 10.378 1.00 0.00 N ATOM 0 H GLN A 73 5.343 5.255 7.137 1.00 0.00 H new ATOM 0 HA GLN A 73 5.097 8.099 6.971 1.00 0.00 H new ATOM 0 HB2 GLN A 73 6.670 6.143 8.714 1.00 0.00 H new ATOM 0 HB3 GLN A 73 6.785 7.877 8.934 1.00 0.00 H new ATOM 0 HG2 GLN A 73 4.161 6.329 9.089 1.00 0.00 H new ATOM 0 HG3 GLN A 73 5.154 6.697 10.485 1.00 0.00 H new ATOM 0 HE21 GLN A 73 5.624 9.112 10.874 1.00 0.00 H new ATOM 0 HE22 GLN A 73 4.327 10.243 10.475 1.00 0.00 H new ATOM 1153 N LYS A 74 7.765 6.820 5.610 1.00 0.00 N ATOM 1154 CA LYS A 74 8.857 7.162 4.669 1.00 0.00 C ATOM 1155 C LYS A 74 8.315 7.770 3.362 1.00 0.00 C ATOM 1156 O LYS A 74 7.105 7.810 3.132 1.00 0.00 O ATOM 1157 CB LYS A 74 9.749 5.933 4.383 1.00 0.00 C ATOM 1158 CG LYS A 74 10.319 5.275 5.653 1.00 0.00 C ATOM 1159 CD LYS A 74 11.809 4.932 5.544 1.00 0.00 C ATOM 1160 CE LYS A 74 12.269 4.267 6.848 1.00 0.00 C ATOM 1161 NZ LYS A 74 13.724 3.967 6.831 1.00 0.00 N ATOM 0 H LYS A 74 7.567 5.820 5.650 1.00 0.00 H new ATOM 0 HA LYS A 74 9.473 7.922 5.149 1.00 0.00 H new ATOM 0 HB2 LYS A 74 9.169 5.194 3.831 1.00 0.00 H new ATOM 0 HB3 LYS A 74 10.575 6.236 3.739 1.00 0.00 H new ATOM 0 HG2 LYS A 74 10.169 5.945 6.499 1.00 0.00 H new ATOM 0 HG3 LYS A 74 9.759 4.364 5.864 1.00 0.00 H new ATOM 0 HD2 LYS A 74 11.980 4.263 4.700 1.00 0.00 H new ATOM 0 HD3 LYS A 74 12.390 5.835 5.357 1.00 0.00 H new ATOM 0 HE2 LYS A 74 12.043 4.922 7.689 1.00 0.00 H new ATOM 0 HE3 LYS A 74 11.709 3.344 7.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 13.996 3.518 7.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 13.936 3.322 6.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.259 4.850 6.709 1.00 0.00 H new ATOM 1175 N ASP A 75 9.218 8.219 2.484 1.00 0.00 N ATOM 1176 CA ASP A 75 8.909 8.833 1.175 1.00 0.00 C ATOM 1177 C ASP A 75 7.947 10.049 1.274 1.00 0.00 C ATOM 1178 O ASP A 75 7.075 10.270 0.428 1.00 0.00 O ATOM 1179 CB ASP A 75 8.497 7.731 0.166 1.00 0.00 C ATOM 1180 CG ASP A 75 9.593 7.482 -0.882 1.00 0.00 C ATOM 1181 OD1 ASP A 75 10.631 6.865 -0.540 1.00 0.00 O ATOM 1182 OD2 ASP A 75 9.424 7.898 -2.054 1.00 0.00 O ATOM 0 H ASP A 75 10.220 8.166 2.665 1.00 0.00 H new ATOM 0 HA ASP A 75 9.813 9.293 0.776 1.00 0.00 H new ATOM 0 HB2 ASP A 75 8.290 6.805 0.703 1.00 0.00 H new ATOM 0 HB3 ASP A 75 7.574 8.023 -0.335 1.00 0.00 H new ATOM 1187 N SER A 76 8.098 10.838 2.343 1.00 0.00 N ATOM 1188 CA SER A 76 7.255 11.985 2.725 1.00 0.00 C ATOM 1189 C SER A 76 7.168 13.082 1.648 1.00 0.00 C ATOM 1190 O SER A 76 8.079 13.251 0.830 1.00 0.00 O ATOM 1191 CB SER A 76 7.773 12.621 4.033 1.00 0.00 C ATOM 1192 OG SER A 76 8.498 11.700 4.842 1.00 0.00 O ATOM 0 H SER A 76 8.857 10.687 3.007 1.00 0.00 H new ATOM 0 HA SER A 76 6.253 11.577 2.856 1.00 0.00 H new ATOM 0 HB2 SER A 76 8.414 13.469 3.791 1.00 0.00 H new ATOM 0 HB3 SER A 76 6.929 13.012 4.601 1.00 0.00 H new ATOM 0 HG SER A 76 8.805 12.151 5.656 1.00 0.00 H new ATOM 1198 N MET A 77 6.093 13.878 1.680 1.00 0.00 N ATOM 1199 CA MET A 77 5.919 15.055 0.812 1.00 0.00 C ATOM 1200 C MET A 77 6.918 16.177 1.147 1.00 0.00 C ATOM 1201 O MET A 77 7.340 16.324 2.298 1.00 0.00 O ATOM 1202 CB MET A 77 4.482 15.592 0.936 1.00 0.00 C ATOM 1203 CG MET A 77 3.438 14.634 0.345 1.00 0.00 C ATOM 1204 SD MET A 77 3.580 14.308 -1.440 1.00 0.00 S ATOM 1205 CE MET A 77 3.100 15.921 -2.119 1.00 0.00 C ATOM 0 H MET A 77 5.310 13.724 2.315 1.00 0.00 H new ATOM 0 HA MET A 77 6.111 14.734 -0.212 1.00 0.00 H new ATOM 0 HB2 MET A 77 4.254 15.768 1.987 1.00 0.00 H new ATOM 0 HB3 MET A 77 4.413 16.555 0.430 1.00 0.00 H new ATOM 0 HG2 MET A 77 3.504 13.684 0.875 1.00 0.00 H new ATOM 0 HG3 MET A 77 2.446 15.041 0.543 1.00 0.00 H new ATOM 0 HE1 MET A 77 3.034 15.853 -3.205 1.00 0.00 H new ATOM 0 HE2 MET A 77 2.131 16.213 -1.714 1.00 0.00 H new ATOM 0 HE3 MET A 77 3.847 16.667 -1.847 1.00 0.00 H new ATOM 1215 N GLN A 78 7.268 16.995 0.148 1.00 0.00 N ATOM 1216 CA GLN A 78 8.190 18.124 0.312 1.00 0.00 C ATOM 1217 C GLN A 78 7.518 19.327 1.004 1.00 0.00 C ATOM 1218 O GLN A 78 6.387 19.699 0.676 1.00 0.00 O ATOM 1219 CB GLN A 78 8.783 18.507 -1.057 1.00 0.00 C ATOM 1220 CG GLN A 78 9.945 19.510 -0.969 1.00 0.00 C ATOM 1221 CD GLN A 78 11.089 18.991 -0.096 1.00 0.00 C ATOM 1222 OE1 GLN A 78 11.066 19.087 1.124 1.00 0.00 O ATOM 1223 NE2 GLN A 78 12.103 18.380 -0.660 1.00 0.00 N ATOM 0 H GLN A 78 6.917 16.891 -0.804 1.00 0.00 H new ATOM 0 HA GLN A 78 9.001 17.815 0.971 1.00 0.00 H new ATOM 0 HB2 GLN A 78 9.132 17.604 -1.557 1.00 0.00 H new ATOM 0 HB3 GLN A 78 7.995 18.932 -1.679 1.00 0.00 H new ATOM 0 HG2 GLN A 78 10.320 19.718 -1.971 1.00 0.00 H new ATOM 0 HG3 GLN A 78 9.579 20.453 -0.563 1.00 0.00 H new ATOM 0 HE21 GLN A 78 12.143 18.288 -1.675 1.00 0.00 H new ATOM 0 HE22 GLN A 78 12.852 17.996 -0.084 1.00 0.00 H new ATOM 1232 N ASP A 79 8.218 19.937 1.961 1.00 0.00 N ATOM 1233 CA ASP A 79 7.772 21.040 2.829 1.00 0.00 C ATOM 1234 C ASP A 79 8.962 21.738 3.540 1.00 0.00 C ATOM 1235 O ASP A 79 10.128 21.468 3.239 1.00 0.00 O ATOM 1236 CB ASP A 79 6.717 20.521 3.829 1.00 0.00 C ATOM 1237 CG ASP A 79 7.158 19.319 4.684 1.00 0.00 C ATOM 1238 OD1 ASP A 79 8.374 19.143 4.943 1.00 0.00 O ATOM 1239 OD2 ASP A 79 6.253 18.577 5.132 1.00 0.00 O ATOM 0 H ASP A 79 9.177 19.659 2.168 1.00 0.00 H new ATOM 0 HA ASP A 79 7.307 21.805 2.207 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.439 21.338 4.495 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.821 20.243 3.275 1.00 0.00 H new ATOM 1244 N GLU A 80 8.686 22.668 4.463 1.00 0.00 N ATOM 1245 CA GLU A 80 9.690 23.412 5.243 1.00 0.00 C ATOM 1246 C GLU A 80 9.259 23.595 6.714 1.00 0.00 C ATOM 1247 O GLU A 80 8.077 23.798 7.007 1.00 0.00 O ATOM 1248 CB GLU A 80 9.925 24.774 4.561 1.00 0.00 C ATOM 1249 CG GLU A 80 11.088 25.572 5.165 1.00 0.00 C ATOM 1250 CD GLU A 80 11.303 26.893 4.402 1.00 0.00 C ATOM 1251 OE1 GLU A 80 12.024 26.898 3.373 1.00 0.00 O ATOM 1252 OE2 GLU A 80 10.758 27.942 4.827 1.00 0.00 O ATOM 0 H GLU A 80 7.729 22.933 4.697 1.00 0.00 H new ATOM 0 HA GLU A 80 10.618 22.841 5.265 1.00 0.00 H new ATOM 0 HB2 GLU A 80 10.119 24.611 3.501 1.00 0.00 H new ATOM 0 HB3 GLU A 80 9.013 25.368 4.631 1.00 0.00 H new ATOM 0 HG2 GLU A 80 10.883 25.783 6.215 1.00 0.00 H new ATOM 0 HG3 GLU A 80 12.000 24.976 5.132 1.00 0.00 H new ATOM 1259 N SER A 81 10.227 23.574 7.638 1.00 0.00 N ATOM 1260 CA SER A 81 10.079 23.996 9.042 1.00 0.00 C ATOM 1261 C SER A 81 11.396 24.551 9.612 1.00 0.00 C ATOM 1262 O SER A 81 12.479 24.289 9.076 1.00 0.00 O ATOM 1263 CB SER A 81 9.584 22.825 9.907 1.00 0.00 C ATOM 1264 OG SER A 81 10.529 21.765 9.952 1.00 0.00 O ATOM 0 H SER A 81 11.171 23.251 7.424 1.00 0.00 H new ATOM 0 HA SER A 81 9.340 24.797 9.065 1.00 0.00 H new ATOM 0 HB2 SER A 81 9.386 23.179 10.919 1.00 0.00 H new ATOM 0 HB3 SER A 81 8.640 22.453 9.509 1.00 0.00 H new ATOM 0 HG SER A 81 10.181 21.040 10.512 1.00 0.00 H new ATOM 1270 N SER A 82 11.318 25.304 10.714 1.00 0.00 N ATOM 1271 CA SER A 82 12.470 25.711 11.538 1.00 0.00 C ATOM 1272 C SER A 82 12.746 24.706 12.672 1.00 0.00 C ATOM 1273 O SER A 82 11.878 23.909 13.046 1.00 0.00 O ATOM 1274 CB SER A 82 12.233 27.120 12.103 1.00 0.00 C ATOM 1275 OG SER A 82 11.021 27.187 12.842 1.00 0.00 O ATOM 0 H SER A 82 10.430 25.659 11.070 1.00 0.00 H new ATOM 0 HA SER A 82 13.355 25.725 10.901 1.00 0.00 H new ATOM 0 HB2 SER A 82 13.068 27.401 12.745 1.00 0.00 H new ATOM 0 HB3 SER A 82 12.203 27.841 11.286 1.00 0.00 H new ATOM 0 HG SER A 82 10.900 28.095 13.190 1.00 0.00 H new ATOM 1281 N GLN A 83 13.961 24.735 13.231 1.00 0.00 N ATOM 1282 CA GLN A 83 14.422 23.842 14.307 1.00 0.00 C ATOM 1283 C GLN A 83 15.467 24.554 15.193 1.00 0.00 C ATOM 1284 O GLN A 83 16.255 25.364 14.694 1.00 0.00 O ATOM 1285 CB GLN A 83 14.978 22.559 13.647 1.00 0.00 C ATOM 1286 CG GLN A 83 15.139 21.347 14.584 1.00 0.00 C ATOM 1287 CD GLN A 83 16.364 21.396 15.501 1.00 0.00 C ATOM 1288 OE1 GLN A 83 17.408 21.951 15.184 1.00 0.00 O ATOM 1289 NE2 GLN A 83 16.278 20.829 16.683 1.00 0.00 N ATOM 0 H GLN A 83 14.676 25.401 12.939 1.00 0.00 H new ATOM 0 HA GLN A 83 13.600 23.572 14.970 1.00 0.00 H new ATOM 0 HB2 GLN A 83 14.317 22.277 12.828 1.00 0.00 H new ATOM 0 HB3 GLN A 83 15.949 22.789 13.208 1.00 0.00 H new ATOM 0 HG2 GLN A 83 14.245 21.263 15.202 1.00 0.00 H new ATOM 0 HG3 GLN A 83 15.194 20.443 13.978 1.00 0.00 H new ATOM 0 HE21 GLN A 83 15.415 20.362 16.963 1.00 0.00 H new ATOM 0 HE22 GLN A 83 17.074 20.856 17.321 1.00 0.00 H new ATOM 1298 N THR A 84 15.486 24.256 16.496 1.00 0.00 N ATOM 1299 CA THR A 84 16.400 24.850 17.497 1.00 0.00 C ATOM 1300 C THR A 84 16.976 23.801 18.461 1.00 0.00 C ATOM 1301 O THR A 84 16.231 23.014 19.049 1.00 0.00 O ATOM 1302 CB THR A 84 15.702 25.959 18.314 1.00 0.00 C ATOM 1303 OG1 THR A 84 14.450 25.537 18.827 1.00 0.00 O ATOM 1304 CG2 THR A 84 15.437 27.212 17.477 1.00 0.00 C ATOM 0 H THR A 84 14.848 23.573 16.904 1.00 0.00 H new ATOM 0 HA THR A 84 17.223 25.283 16.928 1.00 0.00 H new ATOM 0 HB THR A 84 16.391 26.183 19.128 1.00 0.00 H new ATOM 0 HG1 THR A 84 14.497 24.587 19.065 1.00 0.00 H new ATOM 0 HG21 THR A 84 14.945 27.964 18.094 1.00 0.00 H new ATOM 0 HG22 THR A 84 16.382 27.608 17.106 1.00 0.00 H new ATOM 0 HG23 THR A 84 14.795 26.957 16.634 1.00 0.00 H new ATOM 1312 N SER A 85 18.301 23.817 18.655 1.00 0.00 N ATOM 1313 CA SER A 85 19.062 22.935 19.565 1.00 0.00 C ATOM 1314 C SER A 85 20.148 23.699 20.346 1.00 0.00 C ATOM 1315 O SER A 85 20.509 24.826 19.993 1.00 0.00 O ATOM 1316 CB SER A 85 19.722 21.794 18.773 1.00 0.00 C ATOM 1317 OG SER A 85 18.753 20.900 18.244 1.00 0.00 O ATOM 0 H SER A 85 18.905 24.474 18.161 1.00 0.00 H new ATOM 0 HA SER A 85 18.349 22.531 20.283 1.00 0.00 H new ATOM 0 HB2 SER A 85 20.317 22.210 17.960 1.00 0.00 H new ATOM 0 HB3 SER A 85 20.407 21.248 19.422 1.00 0.00 H new ATOM 0 HG SER A 85 19.204 20.187 17.745 1.00 0.00 H new ATOM 1323 N LEU A 86 20.697 23.075 21.397 1.00 0.00 N ATOM 1324 CA LEU A 86 21.766 23.607 22.256 1.00 0.00 C ATOM 1325 C LEU A 86 23.144 23.031 21.880 1.00 0.00 C ATOM 1326 O LEU A 86 23.366 21.822 21.970 1.00 0.00 O ATOM 1327 CB LEU A 86 21.439 23.293 23.731 1.00 0.00 C ATOM 1328 CG LEU A 86 20.317 24.157 24.336 1.00 0.00 C ATOM 1329 CD1 LEU A 86 19.893 23.578 25.687 1.00 0.00 C ATOM 1330 CD2 LEU A 86 20.769 25.603 24.567 1.00 0.00 C ATOM 0 H LEU A 86 20.395 22.144 21.685 1.00 0.00 H new ATOM 0 HA LEU A 86 21.816 24.686 22.109 1.00 0.00 H new ATOM 0 HB2 LEU A 86 21.155 22.244 23.811 1.00 0.00 H new ATOM 0 HB3 LEU A 86 22.343 23.425 24.326 1.00 0.00 H new ATOM 0 HG LEU A 86 19.490 24.153 23.626 1.00 0.00 H new ATOM 0 HD11 LEU A 86 19.099 24.191 26.113 1.00 0.00 H new ATOM 0 HD12 LEU A 86 19.530 22.560 25.549 1.00 0.00 H new ATOM 0 HD13 LEU A 86 20.747 23.570 26.364 1.00 0.00 H new ATOM 0 HD21 LEU A 86 19.947 26.177 24.995 1.00 0.00 H new ATOM 0 HD22 LEU A 86 21.615 25.614 25.254 1.00 0.00 H new ATOM 0 HD23 LEU A 86 21.066 26.047 23.617 1.00 0.00 H new ATOM 1342 N GLN A 87 24.075 23.904 21.479 1.00 0.00 N ATOM 1343 CA GLN A 87 25.474 23.557 21.174 1.00 0.00 C ATOM 1344 C GLN A 87 26.411 23.681 22.396 1.00 0.00 C ATOM 1345 O GLN A 87 27.334 22.876 22.552 1.00 0.00 O ATOM 1346 CB GLN A 87 25.983 24.463 20.037 1.00 0.00 C ATOM 1347 CG GLN A 87 25.271 24.237 18.691 1.00 0.00 C ATOM 1348 CD GLN A 87 25.582 22.870 18.080 1.00 0.00 C ATOM 1349 OE1 GLN A 87 24.827 21.913 18.202 1.00 0.00 O ATOM 1350 NE2 GLN A 87 26.703 22.719 17.404 1.00 0.00 N ATOM 0 H GLN A 87 23.875 24.896 21.353 1.00 0.00 H new ATOM 0 HA GLN A 87 25.489 22.510 20.873 1.00 0.00 H new ATOM 0 HB2 GLN A 87 25.858 25.505 20.332 1.00 0.00 H new ATOM 0 HB3 GLN A 87 27.052 24.296 19.904 1.00 0.00 H new ATOM 0 HG2 GLN A 87 24.194 24.330 18.834 1.00 0.00 H new ATOM 0 HG3 GLN A 87 25.568 25.019 17.992 1.00 0.00 H new ATOM 0 HE21 GLN A 87 27.342 23.506 17.294 1.00 0.00 H new ATOM 0 HE22 GLN A 87 26.932 21.815 16.991 1.00 0.00 H new ATOM 1359 N LYS A 88 26.195 24.687 23.259 1.00 0.00 N ATOM 1360 CA LYS A 88 27.019 25.000 24.442 1.00 0.00 C ATOM 1361 C LYS A 88 26.805 23.963 25.557 1.00 0.00 C ATOM 1362 O LYS A 88 25.695 23.808 26.068 1.00 0.00 O ATOM 1363 CB LYS A 88 26.706 26.443 24.897 1.00 0.00 C ATOM 1364 CG LYS A 88 27.788 27.121 25.760 1.00 0.00 C ATOM 1365 CD LYS A 88 27.918 26.584 27.193 1.00 0.00 C ATOM 1366 CE LYS A 88 28.836 27.501 28.011 1.00 0.00 C ATOM 1367 NZ LYS A 88 29.010 27.009 29.403 1.00 0.00 N ATOM 0 H LYS A 88 25.411 25.331 23.149 1.00 0.00 H new ATOM 0 HA LYS A 88 28.077 24.944 24.186 1.00 0.00 H new ATOM 0 HB2 LYS A 88 26.538 27.055 24.011 1.00 0.00 H new ATOM 0 HB3 LYS A 88 25.772 26.433 25.459 1.00 0.00 H new ATOM 0 HG2 LYS A 88 28.750 27.010 25.260 1.00 0.00 H new ATOM 0 HG3 LYS A 88 27.574 28.189 25.808 1.00 0.00 H new ATOM 0 HD2 LYS A 88 26.935 26.528 27.660 1.00 0.00 H new ATOM 0 HD3 LYS A 88 28.321 25.572 27.176 1.00 0.00 H new ATOM 0 HE2 LYS A 88 29.809 27.568 27.525 1.00 0.00 H new ATOM 0 HE3 LYS A 88 28.420 28.508 28.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 29.637 27.655 29.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 28.084 26.969 29.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 29.431 26.058 29.385 1.00 0.00 H new ATOM 1381 N GLU A 89 27.872 23.263 25.934 1.00 0.00 N ATOM 1382 CA GLU A 89 27.916 22.255 27.009 1.00 0.00 C ATOM 1383 C GLU A 89 29.257 22.330 27.780 1.00 0.00 C ATOM 1384 O GLU A 89 30.152 23.102 27.416 1.00 0.00 O ATOM 1385 CB GLU A 89 27.665 20.871 26.371 1.00 0.00 C ATOM 1386 CG GLU A 89 27.252 19.773 27.365 1.00 0.00 C ATOM 1387 CD GLU A 89 26.723 18.525 26.630 1.00 0.00 C ATOM 1388 OE1 GLU A 89 27.519 17.815 25.968 1.00 0.00 O ATOM 1389 OE2 GLU A 89 25.504 18.233 26.722 1.00 0.00 O ATOM 0 H GLU A 89 28.778 23.384 25.481 1.00 0.00 H new ATOM 0 HA GLU A 89 27.140 22.444 27.751 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.886 20.970 25.615 1.00 0.00 H new ATOM 0 HB3 GLU A 89 28.571 20.554 25.855 1.00 0.00 H new ATOM 0 HG2 GLU A 89 28.107 19.499 27.984 1.00 0.00 H new ATOM 0 HG3 GLU A 89 26.483 20.156 28.036 1.00 0.00 H new ATOM 1396 N ILE A 90 29.418 21.537 28.846 1.00 0.00 N ATOM 1397 CA ILE A 90 30.688 21.350 29.573 1.00 0.00 C ATOM 1398 C ILE A 90 31.796 20.863 28.617 1.00 0.00 C ATOM 1399 O ILE A 90 31.563 20.003 27.762 1.00 0.00 O ATOM 1400 CB ILE A 90 30.488 20.364 30.753 1.00 0.00 C ATOM 1401 CG1 ILE A 90 29.365 20.798 31.730 1.00 0.00 C ATOM 1402 CG2 ILE A 90 31.792 20.132 31.538 1.00 0.00 C ATOM 1403 CD1 ILE A 90 29.546 22.173 32.390 1.00 0.00 C ATOM 0 H ILE A 90 28.651 20.992 29.240 1.00 0.00 H new ATOM 0 HA ILE A 90 31.004 22.310 29.982 1.00 0.00 H new ATOM 0 HB ILE A 90 30.180 19.427 30.289 1.00 0.00 H new ATOM 0 HG12 ILE A 90 28.419 20.798 31.189 1.00 0.00 H new ATOM 0 HG13 ILE A 90 29.283 20.047 32.516 1.00 0.00 H new ATOM 0 HG21 ILE A 90 31.606 19.435 32.355 1.00 0.00 H new ATOM 0 HG22 ILE A 90 32.548 19.717 30.872 1.00 0.00 H new ATOM 0 HG23 ILE A 90 32.146 21.080 31.943 1.00 0.00 H new ATOM 0 HD11 ILE A 90 28.703 22.373 33.052 1.00 0.00 H new ATOM 0 HD12 ILE A 90 30.471 22.181 32.967 1.00 0.00 H new ATOM 0 HD13 ILE A 90 29.593 22.943 31.620 1.00 0.00 H new ATOM 1415 N SER A 91 33.010 21.396 28.784 1.00 0.00 N ATOM 1416 CA SER A 91 34.213 21.052 28.012 1.00 0.00 C ATOM 1417 C SER A 91 35.411 20.822 28.938 1.00 0.00 C ATOM 1418 O SER A 91 35.628 21.586 29.883 1.00 0.00 O ATOM 1419 CB SER A 91 34.528 22.171 27.014 1.00 0.00 C ATOM 1420 OG SER A 91 35.701 21.849 26.283 1.00 0.00 O ATOM 0 H SER A 91 33.191 22.109 29.490 1.00 0.00 H new ATOM 0 HA SER A 91 34.020 20.127 27.469 1.00 0.00 H new ATOM 0 HB2 SER A 91 33.689 22.308 26.331 1.00 0.00 H new ATOM 0 HB3 SER A 91 34.666 23.114 27.543 1.00 0.00 H new ATOM 0 HG SER A 91 35.897 22.567 25.645 1.00 0.00 H new ATOM 1426 N THR A 92 36.210 19.790 28.647 1.00 0.00 N ATOM 1427 CA THR A 92 37.362 19.351 29.461 1.00 0.00 C ATOM 1428 C THR A 92 38.431 20.431 29.676 1.00 0.00 C ATOM 1429 O THR A 92 39.178 20.369 30.651 1.00 0.00 O ATOM 1430 CB THR A 92 37.978 18.068 28.872 1.00 0.00 C ATOM 1431 OG1 THR A 92 38.864 17.457 29.788 1.00 0.00 O ATOM 1432 CG2 THR A 92 38.724 18.280 27.551 1.00 0.00 C ATOM 0 H THR A 92 36.074 19.216 27.815 1.00 0.00 H new ATOM 0 HA THR A 92 36.965 19.141 30.454 1.00 0.00 H new ATOM 0 HB THR A 92 37.123 17.423 28.671 1.00 0.00 H new ATOM 0 HG1 THR A 92 39.239 16.645 29.388 1.00 0.00 H new ATOM 0 HG21 THR A 92 39.127 17.329 27.204 1.00 0.00 H new ATOM 0 HG22 THR A 92 38.036 18.677 26.804 1.00 0.00 H new ATOM 0 HG23 THR A 92 39.540 18.986 27.703 1.00 0.00 H new ATOM 1440 N GLU A 93 38.486 21.460 28.824 1.00 0.00 N ATOM 1441 CA GLU A 93 39.365 22.626 28.999 1.00 0.00 C ATOM 1442 C GLU A 93 39.087 23.391 30.308 1.00 0.00 C ATOM 1443 O GLU A 93 40.003 23.974 30.890 1.00 0.00 O ATOM 1444 CB GLU A 93 39.221 23.572 27.795 1.00 0.00 C ATOM 1445 CG GLU A 93 39.745 22.951 26.492 1.00 0.00 C ATOM 1446 CD GLU A 93 39.603 23.931 25.311 1.00 0.00 C ATOM 1447 OE1 GLU A 93 40.406 24.893 25.211 1.00 0.00 O ATOM 1448 OE2 GLU A 93 38.695 23.746 24.462 1.00 0.00 O ATOM 0 H GLU A 93 37.914 21.509 27.981 1.00 0.00 H new ATOM 0 HA GLU A 93 40.387 22.252 29.061 1.00 0.00 H new ATOM 0 HB2 GLU A 93 38.171 23.838 27.670 1.00 0.00 H new ATOM 0 HB3 GLU A 93 39.763 24.496 27.997 1.00 0.00 H new ATOM 0 HG2 GLU A 93 40.792 22.673 26.614 1.00 0.00 H new ATOM 0 HG3 GLU A 93 39.195 22.035 26.276 1.00 0.00 H new ATOM 1455 N GLU A 94 37.851 23.370 30.818 1.00 0.00 N ATOM 1456 CA GLU A 94 37.517 23.915 32.140 1.00 0.00 C ATOM 1457 C GLU A 94 38.033 23.012 33.274 1.00 0.00 C ATOM 1458 O GLU A 94 38.566 23.511 34.264 1.00 0.00 O ATOM 1459 CB GLU A 94 35.997 24.130 32.239 1.00 0.00 C ATOM 1460 CG GLU A 94 35.543 24.828 33.533 1.00 0.00 C ATOM 1461 CD GLU A 94 36.185 26.216 33.761 1.00 0.00 C ATOM 1462 OE1 GLU A 94 36.389 26.976 32.783 1.00 0.00 O ATOM 1463 OE2 GLU A 94 36.464 26.571 34.932 1.00 0.00 O ATOM 0 H GLU A 94 37.051 22.974 30.325 1.00 0.00 H new ATOM 0 HA GLU A 94 38.017 24.877 32.256 1.00 0.00 H new ATOM 0 HB2 GLU A 94 35.669 24.723 31.385 1.00 0.00 H new ATOM 0 HB3 GLU A 94 35.499 23.163 32.167 1.00 0.00 H new ATOM 0 HG2 GLU A 94 34.459 24.940 33.511 1.00 0.00 H new ATOM 0 HG3 GLU A 94 35.780 24.186 34.382 1.00 0.00 H new ATOM 1470 N GLN A 95 37.944 21.685 33.128 1.00 0.00 N ATOM 1471 CA GLN A 95 38.447 20.725 34.123 1.00 0.00 C ATOM 1472 C GLN A 95 39.973 20.805 34.325 1.00 0.00 C ATOM 1473 O GLN A 95 40.449 20.508 35.422 1.00 0.00 O ATOM 1474 CB GLN A 95 38.010 19.289 33.774 1.00 0.00 C ATOM 1475 CG GLN A 95 36.572 18.967 34.220 1.00 0.00 C ATOM 1476 CD GLN A 95 35.501 19.763 33.476 1.00 0.00 C ATOM 1477 OE1 GLN A 95 35.243 19.554 32.300 1.00 0.00 O ATOM 1478 NE2 GLN A 95 34.834 20.697 34.122 1.00 0.00 N ATOM 0 H GLN A 95 37.519 21.243 32.313 1.00 0.00 H new ATOM 0 HA GLN A 95 37.997 21.006 35.075 1.00 0.00 H new ATOM 0 HB2 GLN A 95 38.091 19.143 32.697 1.00 0.00 H new ATOM 0 HB3 GLN A 95 38.696 18.583 34.243 1.00 0.00 H new ATOM 0 HG2 GLN A 95 36.387 17.903 34.075 1.00 0.00 H new ATOM 0 HG3 GLN A 95 36.481 19.164 35.288 1.00 0.00 H new ATOM 0 HE21 GLN A 95 35.038 20.883 35.104 1.00 0.00 H new ATOM 0 HE22 GLN A 95 34.113 21.234 33.640 1.00 0.00 H new ATOM 1487 N LEU A 96 40.746 21.290 33.342 1.00 0.00 N ATOM 1488 CA LEU A 96 42.179 21.578 33.524 1.00 0.00 C ATOM 1489 C LEU A 96 42.450 22.629 34.622 1.00 0.00 C ATOM 1490 O LEU A 96 43.479 22.547 35.295 1.00 0.00 O ATOM 1491 CB LEU A 96 42.836 21.993 32.191 1.00 0.00 C ATOM 1492 CG LEU A 96 43.439 20.819 31.395 1.00 0.00 C ATOM 1493 CD1 LEU A 96 42.385 19.892 30.794 1.00 0.00 C ATOM 1494 CD2 LEU A 96 44.297 21.356 30.249 1.00 0.00 C ATOM 0 H LEU A 96 40.400 21.493 32.404 1.00 0.00 H new ATOM 0 HA LEU A 96 42.637 20.649 33.864 1.00 0.00 H new ATOM 0 HB2 LEU A 96 42.092 22.494 31.572 1.00 0.00 H new ATOM 0 HB3 LEU A 96 43.621 22.720 32.396 1.00 0.00 H new ATOM 0 HG LEU A 96 44.031 20.244 32.107 1.00 0.00 H new ATOM 0 HD11 LEU A 96 42.877 19.088 30.247 1.00 0.00 H new ATOM 0 HD12 LEU A 96 41.775 19.468 31.592 1.00 0.00 H new ATOM 0 HD13 LEU A 96 41.749 20.457 30.113 1.00 0.00 H new ATOM 0 HD21 LEU A 96 44.721 20.522 29.690 1.00 0.00 H new ATOM 0 HD22 LEU A 96 43.680 21.962 29.585 1.00 0.00 H new ATOM 0 HD23 LEU A 96 45.103 21.968 30.654 1.00 0.00 H new ATOM 1506 N ARG A 97 41.530 23.579 34.864 1.00 0.00 N ATOM 1507 CA ARG A 97 41.632 24.558 35.968 1.00 0.00 C ATOM 1508 C ARG A 97 41.363 23.943 37.352 1.00 0.00 C ATOM 1509 O ARG A 97 41.810 24.495 38.359 1.00 0.00 O ATOM 1510 CB ARG A 97 40.691 25.759 35.735 1.00 0.00 C ATOM 1511 CG ARG A 97 41.170 26.775 34.684 1.00 0.00 C ATOM 1512 CD ARG A 97 41.070 26.325 33.219 1.00 0.00 C ATOM 1513 NE ARG A 97 41.393 27.456 32.323 1.00 0.00 N ATOM 1514 CZ ARG A 97 41.067 27.615 31.053 1.00 0.00 C ATOM 1515 NH1 ARG A 97 40.479 26.686 30.357 1.00 0.00 N ATOM 1516 NH2 ARG A 97 41.333 28.735 30.444 1.00 0.00 N ATOM 0 H ARG A 97 40.689 23.692 34.298 1.00 0.00 H new ATOM 0 HA ARG A 97 42.666 24.902 35.965 1.00 0.00 H new ATOM 0 HB2 ARG A 97 39.714 25.381 35.432 1.00 0.00 H new ATOM 0 HB3 ARG A 97 40.552 26.280 36.682 1.00 0.00 H new ATOM 0 HG2 ARG A 97 40.591 27.691 34.802 1.00 0.00 H new ATOM 0 HG3 ARG A 97 42.209 27.025 34.897 1.00 0.00 H new ATOM 0 HD2 ARG A 97 41.755 25.497 33.036 1.00 0.00 H new ATOM 0 HD3 ARG A 97 40.065 25.959 33.009 1.00 0.00 H new ATOM 0 HE ARG A 97 41.938 28.211 32.739 1.00 0.00 H new ATOM 0 HH11 ARG A 97 40.252 25.791 30.790 1.00 0.00 H new ATOM 0 HH12 ARG A 97 40.246 26.853 29.378 1.00 0.00 H new ATOM 0 HH21 ARG A 97 41.794 29.492 30.948 1.00 0.00 H new ATOM 0 HH22 ARG A 97 41.080 28.855 29.463 1.00 0.00 H new ATOM 1530 N ARG A 98 40.675 22.794 37.423 1.00 0.00 N ATOM 1531 CA ARG A 98 40.400 22.029 38.660 1.00 0.00 C ATOM 1532 C ARG A 98 41.646 21.292 39.177 1.00 0.00 C ATOM 1533 O ARG A 98 41.789 21.116 40.386 1.00 0.00 O ATOM 1534 CB ARG A 98 39.217 21.070 38.390 1.00 0.00 C ATOM 1535 CG ARG A 98 38.354 20.685 39.607 1.00 0.00 C ATOM 1536 CD ARG A 98 38.960 19.611 40.522 1.00 0.00 C ATOM 1537 NE ARG A 98 37.957 19.069 41.463 1.00 0.00 N ATOM 1538 CZ ARG A 98 37.612 19.545 42.647 1.00 0.00 C ATOM 1539 NH1 ARG A 98 38.147 20.624 43.148 1.00 0.00 N ATOM 1540 NH2 ARG A 98 36.709 18.936 43.363 1.00 0.00 N ATOM 0 H ARG A 98 40.278 22.352 36.594 1.00 0.00 H new ATOM 0 HA ARG A 98 40.126 22.719 39.458 1.00 0.00 H new ATOM 0 HB2 ARG A 98 38.569 21.529 37.643 1.00 0.00 H new ATOM 0 HB3 ARG A 98 39.613 20.155 37.949 1.00 0.00 H new ATOM 0 HG2 ARG A 98 38.168 21.581 40.199 1.00 0.00 H new ATOM 0 HG3 ARG A 98 37.387 20.332 39.250 1.00 0.00 H new ATOM 0 HD2 ARG A 98 39.365 18.801 39.915 1.00 0.00 H new ATOM 0 HD3 ARG A 98 39.793 20.037 41.082 1.00 0.00 H new ATOM 0 HE ARG A 98 37.472 18.224 41.162 1.00 0.00 H new ATOM 0 HH11 ARG A 98 38.858 21.132 42.622 1.00 0.00 H new ATOM 0 HH12 ARG A 98 37.854 20.960 44.065 1.00 0.00 H new ATOM 0 HH21 ARG A 98 36.265 18.088 43.010 1.00 0.00 H new ATOM 0 HH22 ARG A 98 36.446 19.307 44.276 1.00 0.00 H new ATOM 1554 N LEU A 99 42.566 20.908 38.284 1.00 0.00 N ATOM 1555 CA LEU A 99 43.791 20.150 38.594 1.00 0.00 C ATOM 1556 C LEU A 99 44.685 20.841 39.640 1.00 0.00 C ATOM 1557 O LEU A 99 45.143 20.190 40.581 1.00 0.00 O ATOM 1558 CB LEU A 99 44.599 19.900 37.304 1.00 0.00 C ATOM 1559 CG LEU A 99 43.880 19.086 36.212 1.00 0.00 C ATOM 1560 CD1 LEU A 99 44.771 19.000 34.971 1.00 0.00 C ATOM 1561 CD2 LEU A 99 43.549 17.663 36.665 1.00 0.00 C ATOM 0 H LEU A 99 42.478 21.122 37.291 1.00 0.00 H new ATOM 0 HA LEU A 99 43.468 19.204 39.028 1.00 0.00 H new ATOM 0 HB2 LEU A 99 44.885 20.864 36.884 1.00 0.00 H new ATOM 0 HB3 LEU A 99 45.521 19.382 37.569 1.00 0.00 H new ATOM 0 HG LEU A 99 42.944 19.601 35.994 1.00 0.00 H new ATOM 0 HD11 LEU A 99 44.263 18.424 34.198 1.00 0.00 H new ATOM 0 HD12 LEU A 99 44.976 20.004 34.600 1.00 0.00 H new ATOM 0 HD13 LEU A 99 45.710 18.510 35.230 1.00 0.00 H new ATOM 0 HD21 LEU A 99 43.043 17.133 35.858 1.00 0.00 H new ATOM 0 HD22 LEU A 99 44.470 17.139 36.922 1.00 0.00 H new ATOM 0 HD23 LEU A 99 42.898 17.701 37.538 1.00 0.00 H new ATOM 1573 N GLN A 100 44.923 22.150 39.475 1.00 0.00 N ATOM 1574 CA GLN A 100 45.729 23.012 40.362 1.00 0.00 C ATOM 1575 C GLN A 100 47.143 22.451 40.668 1.00 0.00 C ATOM 1576 O GLN A 100 47.707 22.676 41.741 1.00 0.00 O ATOM 1577 CB GLN A 100 44.904 23.376 41.618 1.00 0.00 C ATOM 1578 CG GLN A 100 43.619 24.148 41.263 1.00 0.00 C ATOM 1579 CD GLN A 100 42.711 24.448 42.456 1.00 0.00 C ATOM 1580 OE1 GLN A 100 43.055 24.290 43.623 1.00 0.00 O ATOM 1581 NE2 GLN A 100 41.498 24.898 42.206 1.00 0.00 N ATOM 0 H GLN A 100 44.542 22.665 38.681 1.00 0.00 H new ATOM 0 HA GLN A 100 45.948 23.937 39.829 1.00 0.00 H new ATOM 0 HB2 GLN A 100 44.642 22.465 42.156 1.00 0.00 H new ATOM 0 HB3 GLN A 100 45.515 23.979 42.290 1.00 0.00 H new ATOM 0 HG2 GLN A 100 43.895 25.089 40.787 1.00 0.00 H new ATOM 0 HG3 GLN A 100 43.055 23.572 40.529 1.00 0.00 H new ATOM 0 HE21 GLN A 100 41.194 25.036 41.242 1.00 0.00 H new ATOM 0 HE22 GLN A 100 40.863 25.109 42.976 1.00 0.00 H new ATOM 1590 N GLU A 101 47.724 21.709 39.718 1.00 0.00 N ATOM 1591 CA GLU A 101 49.006 20.999 39.830 1.00 0.00 C ATOM 1592 C GLU A 101 50.107 21.721 39.027 1.00 0.00 C ATOM 1593 O GLU A 101 50.298 21.488 37.831 1.00 0.00 O ATOM 1594 CB GLU A 101 48.810 19.530 39.408 1.00 0.00 C ATOM 1595 CG GLU A 101 50.059 18.672 39.656 1.00 0.00 C ATOM 1596 CD GLU A 101 49.826 17.218 39.203 1.00 0.00 C ATOM 1597 OE1 GLU A 101 50.094 16.899 38.018 1.00 0.00 O ATOM 1598 OE2 GLU A 101 49.384 16.382 40.031 1.00 0.00 O ATOM 0 H GLU A 101 47.292 21.580 38.803 1.00 0.00 H new ATOM 0 HA GLU A 101 49.346 21.001 40.866 1.00 0.00 H new ATOM 0 HB2 GLU A 101 47.969 19.107 39.957 1.00 0.00 H new ATOM 0 HB3 GLU A 101 48.552 19.491 38.350 1.00 0.00 H new ATOM 0 HG2 GLU A 101 50.908 19.093 39.117 1.00 0.00 H new ATOM 0 HG3 GLU A 101 50.313 18.691 40.716 1.00 0.00 H new ATOM 1605 N GLU A 102 50.817 22.641 39.684 1.00 0.00 N ATOM 1606 CA GLU A 102 51.948 23.397 39.124 1.00 0.00 C ATOM 1607 C GLU A 102 53.127 22.463 38.768 1.00 0.00 C ATOM 1608 O GLU A 102 53.610 21.712 39.625 1.00 0.00 O ATOM 1609 CB GLU A 102 52.347 24.487 40.139 1.00 0.00 C ATOM 1610 CG GLU A 102 53.212 25.622 39.570 1.00 0.00 C ATOM 1611 CD GLU A 102 54.687 25.234 39.337 1.00 0.00 C ATOM 1612 OE1 GLU A 102 55.384 24.841 40.304 1.00 0.00 O ATOM 1613 OE2 GLU A 102 55.171 25.360 38.187 1.00 0.00 O ATOM 0 H GLU A 102 50.617 22.891 40.652 1.00 0.00 H new ATOM 0 HA GLU A 102 51.655 23.873 38.188 1.00 0.00 H new ATOM 0 HB2 GLU A 102 51.439 24.919 40.560 1.00 0.00 H new ATOM 0 HB3 GLU A 102 52.887 24.016 40.961 1.00 0.00 H new ATOM 0 HG2 GLU A 102 52.781 25.954 38.625 1.00 0.00 H new ATOM 0 HG3 GLU A 102 53.174 26.471 40.253 1.00 0.00 H new ATOM 1620 N LYS A 103 53.585 22.494 37.507 1.00 0.00 N ATOM 1621 CA LYS A 103 54.727 21.711 36.994 1.00 0.00 C ATOM 1622 C LYS A 103 55.586 22.487 35.983 1.00 0.00 C ATOM 1623 O LYS A 103 55.114 23.441 35.354 1.00 0.00 O ATOM 1624 CB LYS A 103 54.223 20.374 36.409 1.00 0.00 C ATOM 1625 CG LYS A 103 53.391 20.528 35.119 1.00 0.00 C ATOM 1626 CD LYS A 103 52.906 19.182 34.558 1.00 0.00 C ATOM 1627 CE LYS A 103 51.855 18.532 35.468 1.00 0.00 C ATOM 1628 NZ LYS A 103 51.390 17.226 34.933 1.00 0.00 N ATOM 0 H LYS A 103 53.159 23.083 36.791 1.00 0.00 H new ATOM 0 HA LYS A 103 55.388 21.504 37.836 1.00 0.00 H new ATOM 0 HB2 LYS A 103 55.080 19.734 36.202 1.00 0.00 H new ATOM 0 HB3 LYS A 103 53.619 19.865 37.160 1.00 0.00 H new ATOM 0 HG2 LYS A 103 52.529 21.163 35.322 1.00 0.00 H new ATOM 0 HG3 LYS A 103 53.991 21.036 34.364 1.00 0.00 H new ATOM 0 HD2 LYS A 103 52.484 19.333 33.565 1.00 0.00 H new ATOM 0 HD3 LYS A 103 53.755 18.508 34.444 1.00 0.00 H new ATOM 0 HE2 LYS A 103 52.276 18.388 36.463 1.00 0.00 H new ATOM 0 HE3 LYS A 103 51.003 19.204 35.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 50.681 16.820 35.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 50.965 17.367 33.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 52.198 16.576 34.853 1.00 0.00 H new ATOM 1642 N LEU A 104 56.831 22.032 35.798 1.00 0.00 N ATOM 1643 CA LEU A 104 57.834 22.557 34.852 1.00 0.00 C ATOM 1644 C LEU A 104 57.808 21.760 33.530 1.00 0.00 C ATOM 1645 O LEU A 104 57.436 22.348 32.490 1.00 0.00 O ATOM 1646 CB LEU A 104 59.205 22.581 35.574 1.00 0.00 C ATOM 1647 CG LEU A 104 60.268 23.518 34.967 1.00 0.00 C ATOM 1648 CD1 LEU A 104 61.456 23.610 35.926 1.00 0.00 C ATOM 1649 CD2 LEU A 104 60.800 23.047 33.615 1.00 0.00 C ATOM 1650 OXT LEU A 104 58.117 20.544 33.548 1.00 0.00 O ATOM 0 H LEU A 104 57.190 21.242 36.334 1.00 0.00 H new ATOM 0 HA LEU A 104 57.609 23.581 34.552 1.00 0.00 H new ATOM 0 HB2 LEU A 104 59.042 22.871 36.612 1.00 0.00 H new ATOM 0 HB3 LEU A 104 59.606 21.567 35.586 1.00 0.00 H new ATOM 0 HG LEU A 104 59.779 24.480 34.815 1.00 0.00 H new ATOM 0 HD11 LEU A 104 62.213 24.271 35.505 1.00 0.00 H new ATOM 0 HD12 LEU A 104 61.120 24.007 36.884 1.00 0.00 H new ATOM 0 HD13 LEU A 104 61.882 22.618 36.074 1.00 0.00 H new ATOM 0 HD21 LEU A 104 61.543 23.755 33.250 1.00 0.00 H new ATOM 0 HD22 LEU A 104 61.259 22.065 33.727 1.00 0.00 H new ATOM 0 HD23 LEU A 104 59.978 22.984 32.902 1.00 0.00 H new TER 1662 LEU A 104