ATOM 1 N MET A 1 -20.228 -6.190 -2.319 1.00 3.07 N ATOM 2 CA MET A 1 -19.368 -7.355 -2.156 1.00 2.76 C ATOM 3 C MET A 1 -18.030 -6.903 -1.638 1.00 2.34 C ATOM 4 O MET A 1 -17.552 -5.845 -2.039 1.00 2.38 O ATOM 5 CB MET A 1 -19.194 -8.123 -3.473 1.00 2.93 C ATOM 6 CG MET A 1 -20.446 -8.841 -3.941 1.00 3.33 C ATOM 7 SD MET A 1 -20.979 -10.132 -2.790 1.00 4.18 S ATOM 8 CE MET A 1 -22.480 -10.678 -3.599 1.00 4.50 C ATOM 9 H1 MET A 1 -21.073 -6.350 -2.903 1.00 3.22 H ATOM 10 H2 MET A 1 -19.687 -5.363 -2.637 1.00 3.51 H ATOM 11 H3 MET A 1 -20.581 -5.929 -1.367 1.00 3.36 H ATOM 12 HA MET A 1 -19.825 -7.997 -1.415 1.00 3.37 H ATOM 13 HB2 MET A 1 -18.896 -7.424 -4.240 1.00 3.26 H ATOM 14 HB3 MET A 1 -18.415 -8.859 -3.338 1.00 3.26 H ATOM 15 HG2 MET A 1 -21.248 -8.124 -4.029 1.00 3.63 H ATOM 16 HG3 MET A 1 -20.256 -9.294 -4.902 1.00 3.51 H ATOM 17 HE1 MET A 1 -22.247 -11.028 -4.594 1.00 4.67 H ATOM 18 HE2 MET A 1 -23.163 -9.843 -3.666 1.00 4.75 H ATOM 19 HE3 MET A 1 -22.930 -11.480 -3.032 1.00 4.79 H ATOM 20 N ALA A 2 -17.418 -7.679 -0.779 1.00 2.23 N ATOM 21 CA ALA A 2 -16.131 -7.323 -0.232 1.00 1.97 C ATOM 22 C ALA A 2 -15.093 -8.379 -0.583 1.00 1.62 C ATOM 23 O ALA A 2 -15.437 -9.534 -0.849 1.00 1.83 O ATOM 24 CB ALA A 2 -16.235 -7.129 1.274 1.00 2.32 C ATOM 25 H ALA A 2 -17.819 -8.530 -0.489 1.00 2.55 H ATOM 26 HA ALA A 2 -15.826 -6.387 -0.678 1.00 2.02 H ATOM 27 HB1 ALA A 2 -15.282 -6.807 1.672 1.00 2.39 H ATOM 28 HB2 ALA A 2 -16.525 -8.059 1.745 1.00 2.57 H ATOM 29 HB3 ALA A 2 -16.982 -6.375 1.482 1.00 2.91 H ATOM 30 N THR A 3 -13.853 -7.967 -0.617 1.00 1.33 N ATOM 31 CA THR A 3 -12.741 -8.820 -0.931 1.00 1.10 C ATOM 32 C THR A 3 -11.465 -8.223 -0.280 1.00 0.90 C ATOM 33 O THR A 3 -10.717 -7.435 -0.879 1.00 0.87 O ATOM 34 CB THR A 3 -12.612 -9.032 -2.506 1.00 1.27 C ATOM 35 OG1 THR A 3 -11.501 -9.876 -2.848 1.00 1.70 O ATOM 36 CG2 THR A 3 -12.528 -7.715 -3.291 1.00 1.78 C ATOM 37 H THR A 3 -13.651 -7.028 -0.431 1.00 1.46 H ATOM 38 HA THR A 3 -12.946 -9.771 -0.459 1.00 1.16 H ATOM 39 HB THR A 3 -13.510 -9.556 -2.809 1.00 1.61 H ATOM 40 HG1 THR A 3 -11.761 -10.786 -2.670 1.00 2.16 H ATOM 41 HG21 THR A 3 -13.430 -7.140 -3.155 1.00 2.24 H ATOM 42 HG22 THR A 3 -12.416 -7.941 -4.342 1.00 2.32 H ATOM 43 HG23 THR A 3 -11.678 -7.149 -2.938 1.00 2.10 H ATOM 44 N LEU A 4 -11.317 -8.487 1.006 1.00 0.86 N ATOM 45 CA LEU A 4 -10.218 -7.930 1.785 1.00 0.72 C ATOM 46 C LEU A 4 -8.888 -8.593 1.483 1.00 0.67 C ATOM 47 O LEU A 4 -8.656 -9.735 1.876 1.00 0.83 O ATOM 48 CB LEU A 4 -10.491 -7.944 3.309 1.00 0.71 C ATOM 49 CG LEU A 4 -11.499 -6.909 3.870 1.00 0.87 C ATOM 50 CD1 LEU A 4 -12.921 -7.176 3.405 1.00 0.80 C ATOM 51 CD2 LEU A 4 -11.434 -6.872 5.387 1.00 1.75 C ATOM 52 H LEU A 4 -11.945 -9.098 1.447 1.00 1.00 H ATOM 53 HA LEU A 4 -10.131 -6.899 1.473 1.00 0.73 H ATOM 54 HB2 LEU A 4 -10.848 -8.928 3.581 1.00 0.79 H ATOM 55 HB3 LEU A 4 -9.549 -7.791 3.816 1.00 0.64 H ATOM 56 HG LEU A 4 -11.209 -5.933 3.509 1.00 1.34 H ATOM 57 HD11 LEU A 4 -13.243 -8.148 3.753 1.00 1.23 H ATOM 58 HD12 LEU A 4 -12.959 -7.143 2.326 1.00 1.38 H ATOM 59 HD13 LEU A 4 -13.570 -6.413 3.812 1.00 1.46 H ATOM 60 HD21 LEU A 4 -11.654 -7.850 5.794 1.00 2.19 H ATOM 61 HD22 LEU A 4 -12.155 -6.155 5.756 1.00 2.26 H ATOM 62 HD23 LEU A 4 -10.439 -6.572 5.687 1.00 2.25 H ATOM 63 N LEU A 5 -8.065 -7.884 0.713 1.00 0.55 N ATOM 64 CA LEU A 5 -6.686 -8.286 0.454 1.00 0.51 C ATOM 65 C LEU A 5 -5.926 -8.403 1.773 1.00 0.46 C ATOM 66 O LEU A 5 -6.214 -7.665 2.737 1.00 0.50 O ATOM 67 CB LEU A 5 -5.944 -7.280 -0.467 1.00 0.53 C ATOM 68 CG LEU A 5 -5.761 -5.823 0.051 1.00 0.62 C ATOM 69 CD1 LEU A 5 -4.483 -5.223 -0.523 1.00 0.66 C ATOM 70 CD2 LEU A 5 -6.942 -4.930 -0.360 1.00 0.95 C ATOM 71 H LEU A 5 -8.447 -7.099 0.275 1.00 0.61 H ATOM 72 HA LEU A 5 -6.707 -9.257 -0.021 1.00 0.58 H ATOM 73 HB2 LEU A 5 -4.965 -7.680 -0.690 1.00 0.53 H ATOM 74 HB3 LEU A 5 -6.500 -7.233 -1.392 1.00 0.60 H ATOM 75 HG LEU A 5 -5.691 -5.824 1.130 1.00 0.90 H ATOM 76 HD11 LEU A 5 -4.369 -4.215 -0.152 1.00 1.08 H ATOM 77 HD12 LEU A 5 -4.536 -5.200 -1.602 1.00 1.41 H ATOM 78 HD13 LEU A 5 -3.631 -5.808 -0.212 1.00 1.22 H ATOM 79 HD21 LEU A 5 -7.106 -5.018 -1.424 1.00 1.46 H ATOM 80 HD22 LEU A 5 -6.681 -3.902 -0.148 1.00 1.57 H ATOM 81 HD23 LEU A 5 -7.840 -5.182 0.181 1.00 1.37 H ATOM 82 N THR A 6 -4.969 -9.286 1.817 1.00 0.47 N ATOM 83 CA THR A 6 -4.235 -9.522 3.026 1.00 0.49 C ATOM 84 C THR A 6 -2.943 -8.700 3.064 1.00 0.40 C ATOM 85 O THR A 6 -2.648 -7.917 2.133 1.00 0.38 O ATOM 86 CB THR A 6 -3.892 -11.016 3.183 1.00 0.70 C ATOM 87 OG1 THR A 6 -3.094 -11.449 2.067 1.00 0.82 O ATOM 88 CG2 THR A 6 -5.159 -11.858 3.272 1.00 0.93 C ATOM 89 H THR A 6 -4.735 -9.792 1.004 1.00 0.54 H ATOM 90 HA THR A 6 -4.859 -9.233 3.860 1.00 0.55 H ATOM 91 HB THR A 6 -3.315 -11.147 4.087 1.00 0.73 H ATOM 92 HG1 THR A 6 -3.530 -11.244 1.220 1.00 1.33 H ATOM 93 HG21 THR A 6 -5.731 -11.734 2.364 1.00 1.33 H ATOM 94 HG22 THR A 6 -5.746 -11.532 4.118 1.00 1.32 H ATOM 95 HG23 THR A 6 -4.892 -12.897 3.392 1.00 1.55 H ATOM 96 N THR A 7 -2.147 -8.924 4.096 1.00 0.44 N ATOM 97 CA THR A 7 -0.886 -8.263 4.241 1.00 0.42 C ATOM 98 C THR A 7 0.122 -8.869 3.250 1.00 0.37 C ATOM 99 O THR A 7 1.079 -8.212 2.814 1.00 0.39 O ATOM 100 CB THR A 7 -0.380 -8.424 5.689 1.00 0.50 C ATOM 101 OG1 THR A 7 -1.485 -8.172 6.589 1.00 0.58 O ATOM 102 CG2 THR A 7 0.723 -7.415 5.965 1.00 0.54 C ATOM 103 H THR A 7 -2.414 -9.532 4.818 1.00 0.52 H ATOM 104 HA THR A 7 -1.013 -7.211 4.029 1.00 0.44 H ATOM 105 HB THR A 7 -0.003 -9.427 5.834 1.00 0.53 H ATOM 106 HG1 THR A 7 -1.218 -8.311 7.511 1.00 0.94 H ATOM 107 HG21 THR A 7 1.550 -7.604 5.297 1.00 1.06 H ATOM 108 HG22 THR A 7 1.062 -7.499 6.985 1.00 1.24 H ATOM 109 HG23 THR A 7 0.343 -6.420 5.783 1.00 1.08 H ATOM 110 N ASP A 8 -0.151 -10.102 2.843 1.00 0.41 N ATOM 111 CA ASP A 8 0.681 -10.809 1.890 1.00 0.46 C ATOM 112 C ASP A 8 0.508 -10.199 0.525 1.00 0.42 C ATOM 113 O ASP A 8 1.461 -10.072 -0.229 1.00 0.47 O ATOM 114 CB ASP A 8 0.354 -12.317 1.864 1.00 0.62 C ATOM 115 CG ASP A 8 0.758 -13.037 3.138 1.00 1.41 C ATOM 116 OD1 ASP A 8 0.060 -12.903 4.161 1.00 2.01 O ATOM 117 OD2 ASP A 8 1.806 -13.714 3.140 1.00 1.98 O ATOM 118 H ASP A 8 -0.940 -10.566 3.195 1.00 0.48 H ATOM 119 HA ASP A 8 1.706 -10.676 2.200 1.00 0.52 H ATOM 120 HB2 ASP A 8 -0.711 -12.446 1.739 1.00 0.86 H ATOM 121 HB3 ASP A 8 0.872 -12.783 1.036 1.00 1.09 H ATOM 122 N ASP A 9 -0.714 -9.774 0.232 1.00 0.41 N ATOM 123 CA ASP A 9 -1.024 -9.105 -1.027 1.00 0.46 C ATOM 124 C ASP A 9 -0.345 -7.763 -1.068 1.00 0.40 C ATOM 125 O ASP A 9 0.303 -7.406 -2.063 1.00 0.46 O ATOM 126 CB ASP A 9 -2.528 -8.914 -1.224 1.00 0.54 C ATOM 127 CG ASP A 9 -3.275 -10.199 -1.333 1.00 0.98 C ATOM 128 OD1 ASP A 9 -3.240 -10.804 -2.425 1.00 1.21 O ATOM 129 OD2 ASP A 9 -3.932 -10.599 -0.340 1.00 1.83 O ATOM 130 H ASP A 9 -1.434 -9.923 0.885 1.00 0.43 H ATOM 131 HA ASP A 9 -0.635 -9.714 -1.825 1.00 0.53 H ATOM 132 HB2 ASP A 9 -2.924 -8.371 -0.379 1.00 1.16 H ATOM 133 HB3 ASP A 9 -2.694 -8.341 -2.122 1.00 0.89 H ATOM 134 N LEU A 10 -0.463 -7.048 0.046 1.00 0.36 N ATOM 135 CA LEU A 10 0.119 -5.719 0.221 1.00 0.35 C ATOM 136 C LEU A 10 1.636 -5.780 0.011 1.00 0.33 C ATOM 137 O LEU A 10 2.212 -4.964 -0.691 1.00 0.36 O ATOM 138 CB LEU A 10 -0.198 -5.206 1.637 1.00 0.37 C ATOM 139 CG LEU A 10 0.242 -3.782 1.965 1.00 0.41 C ATOM 140 CD1 LEU A 10 -0.525 -2.774 1.122 1.00 0.51 C ATOM 141 CD2 LEU A 10 0.075 -3.500 3.444 1.00 0.48 C ATOM 142 H LEU A 10 -0.989 -7.438 0.780 1.00 0.35 H ATOM 143 HA LEU A 10 -0.323 -5.053 -0.506 1.00 0.39 H ATOM 144 HB2 LEU A 10 -1.269 -5.262 1.773 1.00 0.42 H ATOM 145 HB3 LEU A 10 0.268 -5.879 2.346 1.00 0.36 H ATOM 146 HG LEU A 10 1.288 -3.678 1.720 1.00 0.39 H ATOM 147 HD11 LEU A 10 -0.337 -2.966 0.077 1.00 1.18 H ATOM 148 HD12 LEU A 10 -0.200 -1.779 1.385 1.00 0.95 H ATOM 149 HD13 LEU A 10 -1.578 -2.878 1.333 1.00 1.26 H ATOM 150 HD21 LEU A 10 0.692 -4.182 4.010 1.00 1.12 H ATOM 151 HD22 LEU A 10 -0.962 -3.634 3.719 1.00 1.06 H ATOM 152 HD23 LEU A 10 0.372 -2.483 3.654 1.00 1.05 H ATOM 153 N ARG A 11 2.253 -6.793 0.607 1.00 0.33 N ATOM 154 CA ARG A 11 3.691 -7.014 0.516 1.00 0.37 C ATOM 155 C ARG A 11 4.116 -7.272 -0.925 1.00 0.39 C ATOM 156 O ARG A 11 5.124 -6.748 -1.383 1.00 0.45 O ATOM 157 CB ARG A 11 4.086 -8.206 1.393 1.00 0.45 C ATOM 158 CG ARG A 11 5.581 -8.499 1.450 1.00 0.72 C ATOM 159 CD ARG A 11 5.868 -9.692 2.354 1.00 0.63 C ATOM 160 NE ARG A 11 5.279 -10.942 1.842 1.00 1.12 N ATOM 161 CZ ARG A 11 4.362 -11.692 2.488 1.00 1.36 C ATOM 162 NH1 ARG A 11 3.913 -11.325 3.697 1.00 1.47 N ATOM 163 NH2 ARG A 11 3.932 -12.815 1.933 1.00 2.27 N ATOM 164 H ARG A 11 1.716 -7.411 1.150 1.00 0.33 H ATOM 165 HA ARG A 11 4.196 -6.135 0.885 1.00 0.41 H ATOM 166 HB2 ARG A 11 3.747 -8.013 2.401 1.00 0.92 H ATOM 167 HB3 ARG A 11 3.584 -9.088 1.020 1.00 1.06 H ATOM 168 HG2 ARG A 11 5.924 -8.737 0.454 1.00 1.30 H ATOM 169 HG3 ARG A 11 6.106 -7.634 1.829 1.00 1.20 H ATOM 170 HD2 ARG A 11 6.940 -9.814 2.428 1.00 1.17 H ATOM 171 HD3 ARG A 11 5.462 -9.481 3.332 1.00 1.14 H ATOM 172 HE ARG A 11 5.625 -11.224 0.964 1.00 1.86 H ATOM 173 HH11 ARG A 11 4.229 -10.492 4.153 1.00 1.69 H ATOM 174 HH12 ARG A 11 3.229 -11.864 4.211 1.00 1.97 H ATOM 175 HH21 ARG A 11 4.249 -13.156 1.047 1.00 2.91 H ATOM 176 HH22 ARG A 11 3.218 -13.370 2.397 1.00 2.56 H ATOM 177 N ARG A 12 3.328 -8.060 -1.634 1.00 0.40 N ATOM 178 CA ARG A 12 3.647 -8.421 -3.000 1.00 0.48 C ATOM 179 C ARG A 12 3.587 -7.224 -3.928 1.00 0.47 C ATOM 180 O ARG A 12 4.530 -6.971 -4.674 1.00 0.50 O ATOM 181 CB ARG A 12 2.756 -9.558 -3.513 1.00 0.56 C ATOM 182 CG ARG A 12 2.979 -10.879 -2.790 1.00 0.94 C ATOM 183 CD ARG A 12 2.132 -12.020 -3.361 1.00 1.18 C ATOM 184 NE ARG A 12 0.655 -11.870 -3.186 1.00 1.76 N ATOM 185 CZ ARG A 12 -0.248 -12.695 -3.780 1.00 2.29 C ATOM 186 NH1 ARG A 12 0.176 -13.566 -4.712 1.00 2.31 N ATOM 187 NH2 ARG A 12 -1.559 -12.602 -3.517 1.00 3.30 N ATOM 188 H ARG A 12 2.494 -8.384 -1.235 1.00 0.37 H ATOM 189 HA ARG A 12 4.666 -8.778 -2.979 1.00 0.54 H ATOM 190 HB2 ARG A 12 1.718 -9.282 -3.408 1.00 0.67 H ATOM 191 HB3 ARG A 12 2.977 -9.715 -4.559 1.00 0.85 H ATOM 192 HG2 ARG A 12 4.020 -11.151 -2.887 1.00 1.27 H ATOM 193 HG3 ARG A 12 2.750 -10.756 -1.745 1.00 1.35 H ATOM 194 HD2 ARG A 12 2.328 -12.088 -4.420 1.00 1.87 H ATOM 195 HD3 ARG A 12 2.450 -12.942 -2.894 1.00 1.53 H ATOM 196 HE ARG A 12 0.360 -11.157 -2.578 1.00 2.26 H ATOM 197 HH11 ARG A 12 1.151 -13.607 -4.982 1.00 2.24 H ATOM 198 HH12 ARG A 12 -0.412 -14.223 -5.189 1.00 2.84 H ATOM 199 HH21 ARG A 12 -2.004 -11.938 -2.888 1.00 3.81 H ATOM 200 HH22 ARG A 12 -2.222 -13.222 -3.936 1.00 3.77 H ATOM 201 N ALA A 13 2.503 -6.469 -3.842 1.00 0.47 N ATOM 202 CA ALA A 13 2.294 -5.303 -4.706 1.00 0.53 C ATOM 203 C ALA A 13 3.357 -4.226 -4.464 1.00 0.46 C ATOM 204 O ALA A 13 3.791 -3.550 -5.404 1.00 0.48 O ATOM 205 CB ALA A 13 0.904 -4.736 -4.484 1.00 0.63 C ATOM 206 H ALA A 13 1.808 -6.702 -3.186 1.00 0.47 H ATOM 207 HA ALA A 13 2.365 -5.634 -5.733 1.00 0.61 H ATOM 208 HB1 ALA A 13 0.739 -3.922 -5.177 1.00 1.11 H ATOM 209 HB2 ALA A 13 0.808 -4.380 -3.466 1.00 1.26 H ATOM 210 HB3 ALA A 13 0.173 -5.512 -4.662 1.00 1.21 H ATOM 211 N LEU A 14 3.787 -4.100 -3.205 1.00 0.42 N ATOM 212 CA LEU A 14 4.800 -3.119 -2.811 1.00 0.39 C ATOM 213 C LEU A 14 6.114 -3.386 -3.577 1.00 0.40 C ATOM 214 O LEU A 14 6.737 -2.469 -4.146 1.00 0.46 O ATOM 215 CB LEU A 14 5.047 -3.225 -1.295 1.00 0.45 C ATOM 216 CG LEU A 14 5.881 -2.114 -0.644 1.00 0.54 C ATOM 217 CD1 LEU A 14 5.106 -0.795 -0.621 1.00 0.44 C ATOM 218 CD2 LEU A 14 6.308 -2.529 0.751 1.00 1.00 C ATOM 219 H LEU A 14 3.393 -4.679 -2.519 1.00 0.44 H ATOM 220 HA LEU A 14 4.418 -2.137 -3.047 1.00 0.41 H ATOM 221 HB2 LEU A 14 4.084 -3.248 -0.809 1.00 0.73 H ATOM 222 HB3 LEU A 14 5.540 -4.169 -1.110 1.00 0.77 H ATOM 223 HG LEU A 14 6.770 -1.950 -1.235 1.00 0.97 H ATOM 224 HD11 LEU A 14 5.703 -0.016 -0.168 1.00 1.04 H ATOM 225 HD12 LEU A 14 4.203 -0.925 -0.043 1.00 1.18 H ATOM 226 HD13 LEU A 14 4.848 -0.510 -1.632 1.00 1.11 H ATOM 227 HD21 LEU A 14 6.912 -3.422 0.687 1.00 1.59 H ATOM 228 HD22 LEU A 14 5.436 -2.734 1.348 1.00 1.48 H ATOM 229 HD23 LEU A 14 6.884 -1.743 1.211 1.00 1.54 H ATOM 230 N VAL A 15 6.493 -4.655 -3.638 1.00 0.44 N ATOM 231 CA VAL A 15 7.718 -5.074 -4.309 1.00 0.53 C ATOM 232 C VAL A 15 7.595 -4.853 -5.828 1.00 0.55 C ATOM 233 O VAL A 15 8.563 -4.428 -6.480 1.00 0.64 O ATOM 234 CB VAL A 15 8.051 -6.573 -4.020 1.00 0.61 C ATOM 235 CG1 VAL A 15 9.342 -7.010 -4.697 1.00 0.74 C ATOM 236 CG2 VAL A 15 8.133 -6.831 -2.522 1.00 0.64 C ATOM 237 H VAL A 15 5.914 -5.327 -3.218 1.00 0.47 H ATOM 238 HA VAL A 15 8.524 -4.454 -3.941 1.00 0.60 H ATOM 239 HB VAL A 15 7.244 -7.173 -4.415 1.00 0.63 H ATOM 240 HG11 VAL A 15 10.163 -6.417 -4.328 1.00 1.14 H ATOM 241 HG12 VAL A 15 9.261 -6.906 -5.767 1.00 1.39 H ATOM 242 HG13 VAL A 15 9.527 -8.046 -4.468 1.00 1.29 H ATOM 243 HG21 VAL A 15 8.383 -7.868 -2.360 1.00 1.14 H ATOM 244 HG22 VAL A 15 7.182 -6.603 -2.066 1.00 1.34 H ATOM 245 HG23 VAL A 15 8.889 -6.196 -2.095 1.00 1.13 H ATOM 246 N GLU A 16 6.399 -5.113 -6.380 1.00 0.59 N ATOM 247 CA GLU A 16 6.158 -4.966 -7.819 1.00 0.69 C ATOM 248 C GLU A 16 6.403 -3.517 -8.266 1.00 0.65 C ATOM 249 O GLU A 16 6.914 -3.282 -9.363 1.00 0.77 O ATOM 250 CB GLU A 16 4.727 -5.382 -8.216 1.00 0.89 C ATOM 251 CG GLU A 16 4.339 -6.830 -7.908 1.00 1.11 C ATOM 252 CD GLU A 16 2.974 -7.168 -8.474 1.00 1.54 C ATOM 253 OE1 GLU A 16 1.970 -6.570 -8.049 1.00 2.18 O ATOM 254 OE2 GLU A 16 2.897 -7.978 -9.434 1.00 1.95 O ATOM 255 H GLU A 16 5.663 -5.415 -5.802 1.00 0.60 H ATOM 256 HA GLU A 16 6.864 -5.606 -8.333 1.00 0.80 H ATOM 257 HB2 GLU A 16 4.030 -4.735 -7.701 1.00 0.91 H ATOM 258 HB3 GLU A 16 4.624 -5.226 -9.281 1.00 0.98 H ATOM 259 HG2 GLU A 16 5.060 -7.496 -8.360 1.00 1.44 H ATOM 260 HG3 GLU A 16 4.325 -6.992 -6.841 1.00 1.45 H ATOM 261 N SER A 17 6.044 -2.555 -7.404 1.00 0.59 N ATOM 262 CA SER A 17 6.246 -1.134 -7.693 1.00 0.64 C ATOM 263 C SER A 17 7.743 -0.770 -7.756 1.00 0.74 C ATOM 264 O SER A 17 8.160 0.044 -8.572 1.00 1.04 O ATOM 265 CB SER A 17 5.565 -0.297 -6.619 1.00 0.68 C ATOM 266 OG SER A 17 4.214 -0.688 -6.476 1.00 1.27 O ATOM 267 H SER A 17 5.614 -2.808 -6.556 1.00 0.58 H ATOM 268 HA SER A 17 5.782 -0.918 -8.643 1.00 0.75 H ATOM 269 HB2 SER A 17 6.081 -0.418 -5.679 1.00 1.10 H ATOM 270 HB3 SER A 17 5.614 0.742 -6.909 1.00 1.16 H ATOM 271 HG SER A 17 3.971 -1.177 -7.269 1.00 1.65 H ATOM 272 N ALA A 18 8.539 -1.381 -6.893 1.00 0.70 N ATOM 273 CA ALA A 18 9.961 -1.102 -6.846 1.00 0.87 C ATOM 274 C ALA A 18 10.668 -1.776 -8.016 1.00 1.05 C ATOM 275 O ALA A 18 11.367 -1.124 -8.795 1.00 1.57 O ATOM 276 CB ALA A 18 10.552 -1.563 -5.514 1.00 0.95 C ATOM 277 H ALA A 18 8.148 -2.049 -6.290 1.00 0.73 H ATOM 278 HA ALA A 18 10.092 -0.034 -6.930 1.00 1.09 H ATOM 279 HB1 ALA A 18 10.441 -2.631 -5.416 1.00 1.36 H ATOM 280 HB2 ALA A 18 10.031 -1.067 -4.710 1.00 1.48 H ATOM 281 HB3 ALA A 18 11.598 -1.306 -5.472 1.00 1.41 H ATOM 282 N GLY A 19 10.482 -3.088 -8.124 1.00 0.98 N ATOM 283 CA GLY A 19 11.071 -3.863 -9.208 1.00 1.32 C ATOM 284 C GLY A 19 12.593 -3.947 -9.158 1.00 1.47 C ATOM 285 O GLY A 19 13.227 -4.388 -10.126 1.00 1.85 O ATOM 286 H GLY A 19 9.905 -3.550 -7.475 1.00 1.01 H ATOM 287 HA2 GLY A 19 10.678 -4.869 -9.167 1.00 1.77 H ATOM 288 HA3 GLY A 19 10.776 -3.418 -10.149 1.00 1.79 H ATOM 289 N GLU A 20 13.190 -3.549 -8.049 1.00 1.96 N ATOM 290 CA GLU A 20 14.624 -3.576 -7.954 1.00 2.68 C ATOM 291 C GLU A 20 15.141 -4.901 -7.487 1.00 2.91 C ATOM 292 O GLU A 20 14.523 -5.575 -6.652 1.00 3.66 O ATOM 293 CB GLU A 20 15.209 -2.416 -7.168 1.00 3.52 C ATOM 294 CG GLU A 20 14.991 -1.097 -7.858 1.00 4.20 C ATOM 295 CD GLU A 20 15.844 0.006 -7.298 1.00 4.87 C ATOM 296 OE1 GLU A 20 17.038 0.035 -7.581 1.00 5.31 O ATOM 297 OE2 GLU A 20 15.317 0.828 -6.509 1.00 5.27 O ATOM 298 H GLU A 20 12.641 -3.249 -7.296 1.00 2.18 H ATOM 299 HA GLU A 20 14.951 -3.478 -8.978 1.00 2.87 H ATOM 300 HB2 GLU A 20 14.747 -2.374 -6.192 1.00 3.77 H ATOM 301 HB3 GLU A 20 16.276 -2.554 -7.062 1.00 3.84 H ATOM 302 HG2 GLU A 20 15.213 -1.207 -8.906 1.00 4.47 H ATOM 303 HG3 GLU A 20 13.955 -0.823 -7.743 1.00 4.44 H ATOM 304 N THR A 21 16.275 -5.253 -8.022 1.00 2.73 N ATOM 305 CA THR A 21 16.925 -6.511 -7.813 1.00 3.25 C ATOM 306 C THR A 21 17.461 -6.677 -6.395 1.00 3.14 C ATOM 307 O THR A 21 18.565 -6.195 -6.079 1.00 3.43 O ATOM 308 CB THR A 21 18.077 -6.607 -8.813 1.00 3.93 C ATOM 309 OG1 THR A 21 18.782 -5.344 -8.823 1.00 4.30 O ATOM 310 CG2 THR A 21 17.558 -6.926 -10.208 1.00 4.40 C ATOM 311 H THR A 21 16.768 -4.636 -8.606 1.00 2.62 H ATOM 312 HA THR A 21 16.238 -7.313 -8.037 1.00 3.74 H ATOM 313 HB THR A 21 18.755 -7.383 -8.491 1.00 4.40 H ATOM 314 HG1 THR A 21 19.376 -5.336 -8.060 1.00 4.42 H ATOM 315 HG21 THR A 21 16.890 -6.143 -10.528 1.00 4.75 H ATOM 316 HG22 THR A 21 17.016 -7.861 -10.195 1.00 4.61 H ATOM 317 HG23 THR A 21 18.387 -6.995 -10.898 1.00 4.66 H ATOM 318 N ASP A 22 16.611 -7.230 -5.522 1.00 3.24 N ATOM 319 CA ASP A 22 16.995 -7.634 -4.151 1.00 3.46 C ATOM 320 C ASP A 22 17.410 -6.397 -3.332 1.00 3.15 C ATOM 321 O ASP A 22 18.177 -6.489 -2.372 1.00 3.71 O ATOM 322 CB ASP A 22 18.152 -8.694 -4.205 1.00 4.08 C ATOM 323 CG ASP A 22 17.877 -9.864 -5.182 1.00 4.82 C ATOM 324 OD1 ASP A 22 17.026 -10.764 -4.852 1.00 5.44 O ATOM 325 OD2 ASP A 22 18.509 -9.930 -6.255 1.00 5.14 O ATOM 326 H ASP A 22 15.686 -7.374 -5.816 1.00 3.52 H ATOM 327 HA ASP A 22 16.130 -8.079 -3.684 1.00 3.87 H ATOM 328 HB2 ASP A 22 19.069 -8.212 -4.508 1.00 4.24 H ATOM 329 HB3 ASP A 22 18.274 -9.111 -3.214 1.00 4.35 H ATOM 330 N GLY A 23 16.827 -5.245 -3.707 1.00 2.69 N ATOM 331 CA GLY A 23 17.143 -3.964 -3.086 1.00 2.70 C ATOM 332 C GLY A 23 16.820 -3.925 -1.608 1.00 2.24 C ATOM 333 O GLY A 23 17.531 -3.303 -0.832 1.00 2.70 O ATOM 334 H GLY A 23 16.191 -5.303 -4.445 1.00 2.74 H ATOM 335 HA2 GLY A 23 18.194 -3.763 -3.220 1.00 3.05 H ATOM 336 HA3 GLY A 23 16.584 -3.189 -3.589 1.00 3.22 H ATOM 337 N THR A 24 15.767 -4.592 -1.234 1.00 1.89 N ATOM 338 CA THR A 24 15.340 -4.659 0.123 1.00 1.88 C ATOM 339 C THR A 24 14.424 -5.866 0.258 1.00 1.65 C ATOM 340 O THR A 24 14.203 -6.580 -0.738 1.00 2.03 O ATOM 341 CB THR A 24 14.630 -3.329 0.598 1.00 2.50 C ATOM 342 OG1 THR A 24 14.344 -3.384 2.010 1.00 3.09 O ATOM 343 CG2 THR A 24 13.328 -3.081 -0.172 1.00 2.87 C ATOM 344 H THR A 24 15.243 -5.112 -1.878 1.00 2.13 H ATOM 345 HA THR A 24 16.220 -4.834 0.725 1.00 2.24 H ATOM 346 HB THR A 24 15.304 -2.500 0.426 1.00 3.01 H ATOM 347 HG1 THR A 24 14.877 -2.717 2.451 1.00 3.52 H ATOM 348 HG21 THR A 24 12.644 -3.906 -0.022 1.00 3.16 H ATOM 349 HG22 THR A 24 13.547 -2.990 -1.227 1.00 3.32 H ATOM 350 HG23 THR A 24 12.869 -2.163 0.168 1.00 3.05 H ATOM 351 N ASP A 25 13.876 -6.086 1.420 1.00 1.52 N ATOM 352 CA ASP A 25 13.001 -7.208 1.657 1.00 1.56 C ATOM 353 C ASP A 25 12.060 -6.867 2.768 1.00 1.29 C ATOM 354 O ASP A 25 12.397 -6.095 3.683 1.00 1.63 O ATOM 355 CB ASP A 25 13.774 -8.519 1.990 1.00 2.14 C ATOM 356 CG ASP A 25 14.428 -8.544 3.364 1.00 2.62 C ATOM 357 OD1 ASP A 25 13.767 -8.942 4.361 1.00 3.06 O ATOM 358 OD2 ASP A 25 15.600 -8.147 3.476 1.00 3.01 O ATOM 359 H ASP A 25 14.031 -5.452 2.155 1.00 1.75 H ATOM 360 HA ASP A 25 12.416 -7.364 0.762 1.00 1.73 H ATOM 361 HB2 ASP A 25 13.085 -9.349 1.942 1.00 2.49 H ATOM 362 HB3 ASP A 25 14.547 -8.652 1.248 1.00 2.44 H ATOM 363 N LEU A 26 10.875 -7.390 2.675 1.00 1.14 N ATOM 364 CA LEU A 26 9.846 -7.160 3.664 1.00 0.93 C ATOM 365 C LEU A 26 9.457 -8.501 4.278 1.00 0.97 C ATOM 366 O LEU A 26 8.291 -8.885 4.266 1.00 1.44 O ATOM 367 CB LEU A 26 8.586 -6.488 3.031 1.00 1.11 C ATOM 368 CG LEU A 26 8.727 -5.136 2.323 1.00 0.87 C ATOM 369 CD1 LEU A 26 9.499 -4.161 3.163 1.00 1.38 C ATOM 370 CD2 LEU A 26 9.310 -5.278 0.932 1.00 1.53 C ATOM 371 H LEU A 26 10.677 -7.953 1.898 1.00 1.49 H ATOM 372 HA LEU A 26 10.253 -6.521 4.431 1.00 0.96 H ATOM 373 HB2 LEU A 26 8.218 -7.158 2.273 1.00 1.64 H ATOM 374 HB3 LEU A 26 7.824 -6.385 3.788 1.00 1.87 H ATOM 375 HG LEU A 26 7.731 -4.729 2.226 1.00 1.73 H ATOM 376 HD11 LEU A 26 9.589 -3.228 2.633 1.00 1.91 H ATOM 377 HD12 LEU A 26 10.473 -4.583 3.353 1.00 1.94 H ATOM 378 HD13 LEU A 26 8.967 -4.017 4.091 1.00 1.97 H ATOM 379 HD21 LEU A 26 8.663 -5.913 0.348 1.00 2.11 H ATOM 380 HD22 LEU A 26 10.285 -5.736 1.015 1.00 1.91 H ATOM 381 HD23 LEU A 26 9.393 -4.308 0.467 1.00 2.02 H ATOM 382 N SER A 27 10.439 -9.217 4.759 1.00 1.01 N ATOM 383 CA SER A 27 10.218 -10.532 5.340 1.00 1.18 C ATOM 384 C SER A 27 9.489 -10.446 6.693 1.00 1.27 C ATOM 385 O SER A 27 8.600 -11.254 6.990 1.00 1.98 O ATOM 386 CB SER A 27 11.564 -11.259 5.462 1.00 1.52 C ATOM 387 OG SER A 27 12.531 -10.424 6.100 1.00 2.26 O ATOM 388 H SER A 27 11.352 -8.858 4.715 1.00 1.26 H ATOM 389 HA SER A 27 9.587 -11.087 4.662 1.00 1.31 H ATOM 390 HB2 SER A 27 11.439 -12.157 6.046 1.00 1.83 H ATOM 391 HB3 SER A 27 11.926 -11.517 4.479 1.00 1.77 H ATOM 392 HG SER A 27 13.038 -9.946 5.413 1.00 2.55 H ATOM 393 N GLY A 28 9.865 -9.464 7.488 1.00 1.18 N ATOM 394 CA GLY A 28 9.271 -9.279 8.783 1.00 1.46 C ATOM 395 C GLY A 28 8.107 -8.314 8.751 1.00 1.19 C ATOM 396 O GLY A 28 7.406 -8.190 7.742 1.00 1.73 O ATOM 397 H GLY A 28 10.574 -8.859 7.186 1.00 1.42 H ATOM 398 HA2 GLY A 28 8.926 -10.234 9.153 1.00 1.84 H ATOM 399 HA3 GLY A 28 10.030 -8.892 9.447 1.00 1.75 H ATOM 400 N ASP A 29 7.899 -7.637 9.840 1.00 0.90 N ATOM 401 CA ASP A 29 6.815 -6.703 9.974 1.00 0.83 C ATOM 402 C ASP A 29 7.167 -5.332 9.407 1.00 0.79 C ATOM 403 O ASP A 29 7.831 -4.518 10.025 1.00 1.33 O ATOM 404 CB ASP A 29 6.327 -6.619 11.441 1.00 1.20 C ATOM 405 CG ASP A 29 7.424 -6.243 12.430 1.00 1.95 C ATOM 406 OD1 ASP A 29 8.405 -7.032 12.583 1.00 2.44 O ATOM 407 OD2 ASP A 29 7.328 -5.181 13.062 1.00 2.68 O ATOM 408 H ASP A 29 8.486 -7.731 10.623 1.00 1.26 H ATOM 409 HA ASP A 29 6.006 -7.099 9.379 1.00 0.92 H ATOM 410 HB2 ASP A 29 5.537 -5.884 11.509 1.00 1.67 H ATOM 411 HB3 ASP A 29 5.936 -7.582 11.732 1.00 1.46 H ATOM 412 N PHE A 30 6.733 -5.096 8.193 1.00 0.42 N ATOM 413 CA PHE A 30 6.948 -3.827 7.544 1.00 0.36 C ATOM 414 C PHE A 30 5.771 -2.908 7.797 1.00 0.32 C ATOM 415 O PHE A 30 5.690 -1.833 7.245 1.00 0.35 O ATOM 416 CB PHE A 30 7.170 -4.010 6.028 1.00 0.37 C ATOM 417 CG PHE A 30 5.943 -4.495 5.249 1.00 0.35 C ATOM 418 CD1 PHE A 30 5.552 -5.821 5.319 1.00 0.40 C ATOM 419 CD2 PHE A 30 5.193 -3.625 4.463 1.00 0.38 C ATOM 420 CE1 PHE A 30 4.454 -6.276 4.627 1.00 0.46 C ATOM 421 CE2 PHE A 30 4.095 -4.077 3.769 1.00 0.42 C ATOM 422 CZ PHE A 30 3.718 -5.343 3.826 1.00 0.46 C ATOM 423 H PHE A 30 6.293 -5.813 7.695 1.00 0.67 H ATOM 424 HA PHE A 30 7.838 -3.392 7.973 1.00 0.43 H ATOM 425 HB2 PHE A 30 7.483 -3.057 5.626 1.00 0.40 H ATOM 426 HB3 PHE A 30 7.969 -4.725 5.890 1.00 0.41 H ATOM 427 HD1 PHE A 30 6.129 -6.503 5.926 1.00 0.43 H ATOM 428 HD2 PHE A 30 5.475 -2.584 4.385 1.00 0.43 H ATOM 429 HE1 PHE A 30 4.167 -7.315 4.695 1.00 0.55 H ATOM 430 HE2 PHE A 30 3.522 -3.396 3.157 1.00 0.47 H ATOM 431 HZ PHE A 30 2.845 -5.667 3.276 1.00 0.53 H ATOM 432 N LEU A 31 4.889 -3.318 8.681 1.00 0.35 N ATOM 433 CA LEU A 31 3.666 -2.566 8.936 1.00 0.36 C ATOM 434 C LEU A 31 3.913 -1.313 9.747 1.00 0.39 C ATOM 435 O LEU A 31 3.227 -0.324 9.556 1.00 0.46 O ATOM 436 CB LEU A 31 2.574 -3.445 9.563 1.00 0.40 C ATOM 437 CG LEU A 31 2.077 -4.590 8.676 1.00 0.39 C ATOM 438 CD1 LEU A 31 1.030 -5.415 9.395 1.00 0.45 C ATOM 439 CD2 LEU A 31 1.520 -4.056 7.358 1.00 0.38 C ATOM 440 H LEU A 31 5.092 -4.131 9.183 1.00 0.44 H ATOM 441 HA LEU A 31 3.313 -2.234 7.970 1.00 0.35 H ATOM 442 HB2 LEU A 31 2.949 -3.860 10.487 1.00 0.44 H ATOM 443 HB3 LEU A 31 1.727 -2.813 9.789 1.00 0.42 H ATOM 444 HG LEU A 31 2.912 -5.236 8.451 1.00 0.39 H ATOM 445 HD11 LEU A 31 0.706 -6.211 8.740 1.00 0.98 H ATOM 446 HD12 LEU A 31 0.196 -4.778 9.645 1.00 1.10 H ATOM 447 HD13 LEU A 31 1.450 -5.828 10.298 1.00 1.06 H ATOM 448 HD21 LEU A 31 0.707 -3.372 7.551 1.00 1.07 H ATOM 449 HD22 LEU A 31 1.146 -4.880 6.771 1.00 1.11 H ATOM 450 HD23 LEU A 31 2.294 -3.550 6.800 1.00 1.05 H ATOM 451 N ASP A 32 4.879 -1.351 10.647 1.00 0.43 N ATOM 452 CA ASP A 32 5.240 -0.152 11.412 1.00 0.52 C ATOM 453 C ASP A 32 6.526 0.415 10.828 1.00 0.50 C ATOM 454 O ASP A 32 7.064 1.432 11.273 1.00 0.66 O ATOM 455 CB ASP A 32 5.391 -0.459 12.911 1.00 0.69 C ATOM 456 CG ASP A 32 5.601 0.794 13.777 1.00 1.46 C ATOM 457 OD1 ASP A 32 4.658 1.628 13.890 1.00 1.95 O ATOM 458 OD2 ASP A 32 6.692 0.948 14.386 1.00 2.20 O ATOM 459 H ASP A 32 5.370 -2.180 10.825 1.00 0.46 H ATOM 460 HA ASP A 32 4.450 0.570 11.261 1.00 0.59 H ATOM 461 HB2 ASP A 32 4.510 -0.979 13.260 1.00 1.12 H ATOM 462 HB3 ASP A 32 6.250 -1.102 13.042 1.00 1.24 H ATOM 463 N LEU A 33 7.011 -0.265 9.797 1.00 0.42 N ATOM 464 CA LEU A 33 8.160 0.184 9.069 1.00 0.50 C ATOM 465 C LEU A 33 7.806 1.403 8.274 1.00 0.45 C ATOM 466 O LEU A 33 6.964 1.378 7.377 1.00 0.57 O ATOM 467 CB LEU A 33 8.766 -0.915 8.185 1.00 0.66 C ATOM 468 CG LEU A 33 9.701 -1.919 8.867 1.00 0.80 C ATOM 469 CD1 LEU A 33 10.246 -2.867 7.832 1.00 1.52 C ATOM 470 CD2 LEU A 33 10.866 -1.217 9.534 1.00 1.18 C ATOM 471 H LEU A 33 6.554 -1.079 9.504 1.00 0.43 H ATOM 472 HA LEU A 33 8.897 0.490 9.797 1.00 0.61 H ATOM 473 HB2 LEU A 33 7.937 -1.490 7.796 1.00 1.44 H ATOM 474 HB3 LEU A 33 9.281 -0.513 7.328 1.00 1.18 H ATOM 475 HG LEU A 33 9.161 -2.479 9.618 1.00 0.96 H ATOM 476 HD11 LEU A 33 10.763 -2.271 7.094 1.00 1.97 H ATOM 477 HD12 LEU A 33 9.426 -3.400 7.377 1.00 2.01 H ATOM 478 HD13 LEU A 33 10.935 -3.551 8.299 1.00 1.95 H ATOM 479 HD21 LEU A 33 10.516 -0.572 10.325 1.00 1.52 H ATOM 480 HD22 LEU A 33 11.382 -0.636 8.784 1.00 1.91 H ATOM 481 HD23 LEU A 33 11.541 -1.959 9.933 1.00 1.52 H ATOM 482 N ARG A 34 8.446 2.452 8.629 1.00 0.43 N ATOM 483 CA ARG A 34 8.200 3.760 8.063 1.00 0.42 C ATOM 484 C ARG A 34 8.642 3.795 6.610 1.00 0.36 C ATOM 485 O ARG A 34 9.687 3.231 6.271 1.00 0.45 O ATOM 486 CB ARG A 34 8.929 4.813 8.907 1.00 0.58 C ATOM 487 CG ARG A 34 8.412 4.878 10.347 1.00 0.77 C ATOM 488 CD ARG A 34 9.229 5.817 11.203 1.00 1.08 C ATOM 489 NE ARG A 34 8.676 5.944 12.562 1.00 1.82 N ATOM 490 CZ ARG A 34 9.208 6.708 13.544 1.00 2.41 C ATOM 491 NH1 ARG A 34 10.452 7.148 13.446 1.00 2.43 N ATOM 492 NH2 ARG A 34 8.531 6.933 14.649 1.00 3.44 N ATOM 493 H ARG A 34 9.145 2.301 9.300 1.00 0.55 H ATOM 494 HA ARG A 34 7.138 3.950 8.112 1.00 0.45 H ATOM 495 HB2 ARG A 34 9.985 4.585 8.926 1.00 0.77 H ATOM 496 HB3 ARG A 34 8.790 5.786 8.460 1.00 0.78 H ATOM 497 HG2 ARG A 34 7.391 5.228 10.339 1.00 0.95 H ATOM 498 HG3 ARG A 34 8.447 3.894 10.787 1.00 1.06 H ATOM 499 HD2 ARG A 34 10.243 5.456 11.279 1.00 1.67 H ATOM 500 HD3 ARG A 34 9.230 6.792 10.742 1.00 1.45 H ATOM 501 HE ARG A 34 7.818 5.468 12.688 1.00 2.30 H ATOM 502 HH11 ARG A 34 11.045 6.915 12.668 1.00 2.29 H ATOM 503 HH12 ARG A 34 10.885 7.740 14.133 1.00 3.00 H ATOM 504 HH21 ARG A 34 7.609 6.550 14.785 1.00 3.92 H ATOM 505 HH22 ARG A 34 8.900 7.472 15.409 1.00 3.95 H ATOM 506 N PHE A 35 7.841 4.434 5.761 1.00 0.33 N ATOM 507 CA PHE A 35 8.089 4.464 4.309 1.00 0.33 C ATOM 508 C PHE A 35 9.503 4.944 3.931 1.00 0.38 C ATOM 509 O PHE A 35 10.167 4.327 3.091 1.00 0.43 O ATOM 510 CB PHE A 35 7.002 5.252 3.562 1.00 0.34 C ATOM 511 CG PHE A 35 5.633 4.614 3.607 1.00 0.36 C ATOM 512 CD1 PHE A 35 5.397 3.372 3.018 1.00 0.43 C ATOM 513 CD2 PHE A 35 4.580 5.252 4.250 1.00 0.40 C ATOM 514 CE1 PHE A 35 4.150 2.789 3.076 1.00 0.50 C ATOM 515 CE2 PHE A 35 3.330 4.668 4.304 1.00 0.48 C ATOM 516 CZ PHE A 35 3.113 3.443 3.664 1.00 0.51 C ATOM 517 H PHE A 35 7.034 4.874 6.108 1.00 0.40 H ATOM 518 HA PHE A 35 8.030 3.433 3.992 1.00 0.36 H ATOM 519 HB2 PHE A 35 6.918 6.241 3.989 1.00 0.35 H ATOM 520 HB3 PHE A 35 7.275 5.343 2.522 1.00 0.39 H ATOM 521 HD1 PHE A 35 6.187 2.840 2.508 1.00 0.47 H ATOM 522 HD2 PHE A 35 4.732 6.212 4.722 1.00 0.41 H ATOM 523 HE1 PHE A 35 3.982 1.826 2.615 1.00 0.57 H ATOM 524 HE2 PHE A 35 2.525 5.179 4.810 1.00 0.55 H ATOM 525 HZ PHE A 35 2.137 2.983 3.687 1.00 0.58 H ATOM 526 N GLU A 36 9.991 5.987 4.590 1.00 0.48 N ATOM 527 CA GLU A 36 11.340 6.498 4.325 1.00 0.62 C ATOM 528 C GLU A 36 12.428 5.450 4.691 1.00 0.63 C ATOM 529 O GLU A 36 13.480 5.368 4.036 1.00 0.72 O ATOM 530 CB GLU A 36 11.598 7.828 5.074 1.00 0.83 C ATOM 531 CG GLU A 36 12.995 8.398 4.816 1.00 1.40 C ATOM 532 CD GLU A 36 13.320 9.653 5.599 1.00 1.83 C ATOM 533 OE1 GLU A 36 13.254 9.627 6.851 1.00 1.89 O ATOM 534 OE2 GLU A 36 13.568 10.696 4.978 1.00 2.73 O ATOM 535 H GLU A 36 9.434 6.444 5.251 1.00 0.52 H ATOM 536 HA GLU A 36 11.398 6.672 3.263 1.00 0.69 H ATOM 537 HB2 GLU A 36 10.857 8.556 4.777 1.00 1.43 H ATOM 538 HB3 GLU A 36 11.495 7.646 6.134 1.00 1.37 H ATOM 539 HG2 GLU A 36 13.723 7.653 5.093 1.00 1.99 H ATOM 540 HG3 GLU A 36 13.096 8.605 3.760 1.00 2.11 H ATOM 541 N ASP A 37 12.132 4.609 5.677 1.00 0.61 N ATOM 542 CA ASP A 37 13.099 3.619 6.174 1.00 0.70 C ATOM 543 C ASP A 37 13.264 2.507 5.151 1.00 0.69 C ATOM 544 O ASP A 37 14.354 1.987 4.949 1.00 0.82 O ATOM 545 CB ASP A 37 12.637 3.030 7.520 1.00 0.77 C ATOM 546 CG ASP A 37 13.698 2.191 8.221 1.00 0.98 C ATOM 547 OD1 ASP A 37 13.862 1.006 7.904 1.00 1.36 O ATOM 548 OD2 ASP A 37 14.348 2.712 9.152 1.00 1.27 O ATOM 549 H ASP A 37 11.230 4.621 6.062 1.00 0.57 H ATOM 550 HA ASP A 37 14.042 4.128 6.311 1.00 0.80 H ATOM 551 HB2 ASP A 37 12.358 3.841 8.176 1.00 1.07 H ATOM 552 HB3 ASP A 37 11.764 2.415 7.356 1.00 0.95 H ATOM 553 N ILE A 38 12.176 2.189 4.468 1.00 0.59 N ATOM 554 CA ILE A 38 12.192 1.144 3.459 1.00 0.63 C ATOM 555 C ILE A 38 12.499 1.680 2.043 1.00 0.63 C ATOM 556 O ILE A 38 12.418 0.950 1.065 1.00 0.66 O ATOM 557 CB ILE A 38 10.889 0.263 3.461 1.00 0.59 C ATOM 558 CG1 ILE A 38 9.628 1.137 3.271 1.00 0.48 C ATOM 559 CG2 ILE A 38 10.802 -0.541 4.761 1.00 0.67 C ATOM 560 CD1 ILE A 38 8.322 0.373 3.189 1.00 0.54 C ATOM 561 H ILE A 38 11.341 2.671 4.647 1.00 0.56 H ATOM 562 HA ILE A 38 13.022 0.506 3.726 1.00 0.73 H ATOM 563 HB ILE A 38 10.961 -0.444 2.647 1.00 0.66 H ATOM 564 HG12 ILE A 38 9.545 1.828 4.095 1.00 0.43 H ATOM 565 HG13 ILE A 38 9.740 1.688 2.351 1.00 0.48 H ATOM 566 HG21 ILE A 38 11.672 -1.179 4.828 1.00 1.43 H ATOM 567 HG22 ILE A 38 9.913 -1.152 4.744 1.00 1.12 H ATOM 568 HG23 ILE A 38 10.765 0.118 5.617 1.00 1.13 H ATOM 569 HD11 ILE A 38 7.513 1.073 3.040 1.00 1.13 H ATOM 570 HD12 ILE A 38 8.160 -0.183 4.099 1.00 1.03 H ATOM 571 HD13 ILE A 38 8.365 -0.307 2.350 1.00 1.00 H ATOM 572 N GLY A 39 12.911 2.941 1.968 1.00 0.63 N ATOM 573 CA GLY A 39 13.313 3.532 0.693 1.00 0.68 C ATOM 574 C GLY A 39 12.156 3.882 -0.235 1.00 0.59 C ATOM 575 O GLY A 39 12.300 3.837 -1.454 1.00 0.70 O ATOM 576 H GLY A 39 12.937 3.466 2.797 1.00 0.63 H ATOM 577 HA2 GLY A 39 13.844 4.446 0.906 1.00 0.71 H ATOM 578 HA3 GLY A 39 13.981 2.856 0.179 1.00 0.81 H ATOM 579 N TYR A 40 11.018 4.226 0.328 1.00 0.45 N ATOM 580 CA TYR A 40 9.875 4.643 -0.461 1.00 0.45 C ATOM 581 C TYR A 40 9.544 6.088 -0.150 1.00 0.47 C ATOM 582 O TYR A 40 9.193 6.406 0.985 1.00 0.62 O ATOM 583 CB TYR A 40 8.637 3.756 -0.189 1.00 0.42 C ATOM 584 CG TYR A 40 8.693 2.347 -0.784 1.00 0.46 C ATOM 585 CD1 TYR A 40 9.610 1.406 -0.314 1.00 0.53 C ATOM 586 CD2 TYR A 40 7.862 1.972 -1.828 1.00 0.57 C ATOM 587 CE1 TYR A 40 9.681 0.138 -0.869 1.00 0.60 C ATOM 588 CE2 TYR A 40 7.932 0.710 -2.390 1.00 0.68 C ATOM 589 CZ TYR A 40 8.754 -0.239 -1.824 1.00 0.67 C ATOM 590 OH TYR A 40 8.927 -1.452 -2.480 1.00 0.78 O ATOM 591 H TYR A 40 10.926 4.220 1.308 1.00 0.42 H ATOM 592 HA TYR A 40 10.142 4.562 -1.506 1.00 0.56 H ATOM 593 HB2 TYR A 40 8.542 3.637 0.880 1.00 0.43 H ATOM 594 HB3 TYR A 40 7.754 4.252 -0.568 1.00 0.44 H ATOM 595 HD1 TYR A 40 10.269 1.669 0.501 1.00 0.63 H ATOM 596 HD2 TYR A 40 7.141 2.686 -2.203 1.00 0.66 H ATOM 597 HE1 TYR A 40 10.392 -0.584 -0.496 1.00 0.69 H ATOM 598 HE2 TYR A 40 7.274 0.446 -3.205 1.00 0.85 H ATOM 599 HH TYR A 40 9.271 -2.072 -1.832 1.00 1.25 H ATOM 600 N ASP A 41 9.686 6.970 -1.147 1.00 0.55 N ATOM 601 CA ASP A 41 9.310 8.388 -0.965 1.00 0.69 C ATOM 602 C ASP A 41 7.807 8.530 -1.008 1.00 0.85 C ATOM 603 O ASP A 41 7.124 8.548 0.009 1.00 1.62 O ATOM 604 CB ASP A 41 9.899 9.319 -2.077 1.00 0.82 C ATOM 605 CG ASP A 41 11.388 9.508 -2.063 1.00 0.99 C ATOM 606 OD1 ASP A 41 11.888 10.367 -1.299 1.00 1.27 O ATOM 607 OD2 ASP A 41 12.073 8.861 -2.869 1.00 1.32 O ATOM 608 H ASP A 41 10.058 6.673 -2.004 1.00 0.64 H ATOM 609 HA ASP A 41 9.662 8.728 -0.002 1.00 0.70 H ATOM 610 HB2 ASP A 41 9.643 8.891 -3.034 1.00 1.07 H ATOM 611 HB3 ASP A 41 9.424 10.286 -2.007 1.00 1.03 H ATOM 612 N SER A 42 7.310 8.575 -2.208 1.00 0.50 N ATOM 613 CA SER A 42 5.921 8.776 -2.485 1.00 0.53 C ATOM 614 C SER A 42 5.642 8.257 -3.872 1.00 0.51 C ATOM 615 O SER A 42 4.664 7.570 -4.112 1.00 0.48 O ATOM 616 CB SER A 42 5.660 10.260 -2.451 1.00 0.69 C ATOM 617 OG SER A 42 6.635 10.885 -3.351 1.00 1.05 O ATOM 618 H SER A 42 7.932 8.502 -2.956 1.00 0.83 H ATOM 619 HA SER A 42 5.341 8.250 -1.741 1.00 0.54 H ATOM 620 HB2 SER A 42 4.658 10.466 -2.799 1.00 1.09 H ATOM 621 HB3 SER A 42 5.791 10.639 -1.448 1.00 1.08 H ATOM 622 N LEU A 43 6.543 8.613 -4.790 1.00 0.57 N ATOM 623 CA LEU A 43 6.501 8.184 -6.192 1.00 0.62 C ATOM 624 C LEU A 43 6.339 6.663 -6.288 1.00 0.56 C ATOM 625 O LEU A 43 5.402 6.169 -6.888 1.00 0.58 O ATOM 626 CB LEU A 43 7.808 8.598 -6.873 1.00 0.74 C ATOM 627 CG LEU A 43 7.953 8.281 -8.355 1.00 0.86 C ATOM 628 CD1 LEU A 43 6.958 9.082 -9.190 1.00 1.40 C ATOM 629 CD2 LEU A 43 9.379 8.535 -8.810 1.00 1.19 C ATOM 630 H LEU A 43 7.208 9.277 -4.503 1.00 0.63 H ATOM 631 HA LEU A 43 5.675 8.678 -6.683 1.00 0.68 H ATOM 632 HB2 LEU A 43 7.913 9.665 -6.739 1.00 0.80 H ATOM 633 HB3 LEU A 43 8.622 8.116 -6.348 1.00 0.74 H ATOM 634 HG LEU A 43 7.740 7.232 -8.495 1.00 1.21 H ATOM 635 HD11 LEU A 43 7.134 10.139 -9.051 1.00 2.04 H ATOM 636 HD12 LEU A 43 5.955 8.833 -8.874 1.00 1.94 H ATOM 637 HD13 LEU A 43 7.080 8.821 -10.230 1.00 1.66 H ATOM 638 HD21 LEU A 43 9.632 9.568 -8.630 1.00 1.69 H ATOM 639 HD22 LEU A 43 9.473 8.312 -9.862 1.00 1.62 H ATOM 640 HD23 LEU A 43 10.049 7.898 -8.250 1.00 1.71 H ATOM 641 N ALA A 44 7.239 5.942 -5.636 1.00 0.54 N ATOM 642 CA ALA A 44 7.208 4.483 -5.632 1.00 0.54 C ATOM 643 C ALA A 44 6.023 3.955 -4.826 1.00 0.47 C ATOM 644 O ALA A 44 5.583 2.838 -5.023 1.00 0.53 O ATOM 645 CB ALA A 44 8.509 3.932 -5.060 1.00 0.59 C ATOM 646 H ALA A 44 7.953 6.403 -5.151 1.00 0.57 H ATOM 647 HA ALA A 44 7.132 4.159 -6.657 1.00 0.62 H ATOM 648 HB1 ALA A 44 9.348 4.307 -5.625 1.00 1.28 H ATOM 649 HB2 ALA A 44 8.506 2.855 -5.123 1.00 1.12 H ATOM 650 HB3 ALA A 44 8.600 4.229 -4.026 1.00 1.13 H ATOM 651 N LEU A 45 5.499 4.796 -3.952 1.00 0.42 N ATOM 652 CA LEU A 45 4.428 4.408 -3.071 1.00 0.38 C ATOM 653 C LEU A 45 3.087 4.523 -3.817 1.00 0.37 C ATOM 654 O LEU A 45 2.221 3.660 -3.668 1.00 0.39 O ATOM 655 CB LEU A 45 4.478 5.289 -1.800 1.00 0.35 C ATOM 656 CG LEU A 45 3.757 4.792 -0.532 1.00 0.37 C ATOM 657 CD1 LEU A 45 4.073 5.718 0.610 1.00 0.38 C ATOM 658 CD2 LEU A 45 2.254 4.705 -0.700 1.00 0.53 C ATOM 659 H LEU A 45 5.814 5.718 -3.940 1.00 0.46 H ATOM 660 HA LEU A 45 4.576 3.380 -2.789 1.00 0.42 H ATOM 661 HB2 LEU A 45 5.512 5.436 -1.522 1.00 0.34 H ATOM 662 HB3 LEU A 45 4.078 6.257 -2.058 1.00 0.40 H ATOM 663 HG LEU A 45 4.139 3.813 -0.280 1.00 0.43 H ATOM 664 HD11 LEU A 45 3.561 5.357 1.489 1.00 1.04 H ATOM 665 HD12 LEU A 45 3.730 6.712 0.368 1.00 1.10 H ATOM 666 HD13 LEU A 45 5.138 5.720 0.793 1.00 1.14 H ATOM 667 HD21 LEU A 45 2.025 4.001 -1.485 1.00 0.97 H ATOM 668 HD22 LEU A 45 1.897 5.685 -0.975 1.00 1.13 H ATOM 669 HD23 LEU A 45 1.801 4.388 0.228 1.00 1.32 H ATOM 670 N MET A 46 2.918 5.570 -4.639 1.00 0.37 N ATOM 671 CA MET A 46 1.683 5.713 -5.426 1.00 0.40 C ATOM 672 C MET A 46 1.446 4.523 -6.340 1.00 0.35 C ATOM 673 O MET A 46 0.319 4.056 -6.468 1.00 0.36 O ATOM 674 CB MET A 46 1.677 6.975 -6.257 1.00 0.52 C ATOM 675 CG MET A 46 1.650 8.262 -5.475 1.00 0.70 C ATOM 676 SD MET A 46 1.301 9.662 -6.547 1.00 0.96 S ATOM 677 CE MET A 46 -0.270 9.196 -7.282 1.00 2.41 C ATOM 678 H MET A 46 3.602 6.286 -4.697 1.00 0.38 H ATOM 679 HA MET A 46 0.861 5.764 -4.724 1.00 0.47 H ATOM 680 HB2 MET A 46 2.568 6.996 -6.862 1.00 0.53 H ATOM 681 HB3 MET A 46 0.819 6.950 -6.907 1.00 0.59 H ATOM 682 HG2 MET A 46 0.924 8.225 -4.678 1.00 0.73 H ATOM 683 HG3 MET A 46 2.638 8.408 -5.062 1.00 0.73 H ATOM 684 HE1 MET A 46 -0.146 8.271 -7.823 1.00 2.94 H ATOM 685 HE2 MET A 46 -0.580 9.976 -7.962 1.00 2.88 H ATOM 686 HE3 MET A 46 -0.998 9.073 -6.495 1.00 2.92 H ATOM 687 N GLU A 47 2.519 4.004 -6.921 1.00 0.37 N ATOM 688 CA GLU A 47 2.439 2.861 -7.809 1.00 0.39 C ATOM 689 C GLU A 47 1.885 1.628 -7.063 1.00 0.37 C ATOM 690 O GLU A 47 1.168 0.818 -7.634 1.00 0.43 O ATOM 691 CB GLU A 47 3.806 2.572 -8.456 1.00 0.48 C ATOM 692 CG GLU A 47 4.314 3.683 -9.388 1.00 0.68 C ATOM 693 CD GLU A 47 3.471 3.861 -10.646 1.00 1.41 C ATOM 694 OE1 GLU A 47 2.316 4.303 -10.548 1.00 2.15 O ATOM 695 OE2 GLU A 47 3.963 3.542 -11.769 1.00 1.84 O ATOM 696 H GLU A 47 3.399 4.400 -6.752 1.00 0.40 H ATOM 697 HA GLU A 47 1.731 3.116 -8.584 1.00 0.42 H ATOM 698 HB2 GLU A 47 4.529 2.441 -7.665 1.00 0.57 H ATOM 699 HB3 GLU A 47 3.731 1.654 -9.019 1.00 0.68 H ATOM 700 HG2 GLU A 47 4.321 4.618 -8.849 1.00 1.01 H ATOM 701 HG3 GLU A 47 5.329 3.444 -9.671 1.00 1.05 H ATOM 702 N THR A 48 2.196 1.523 -5.783 1.00 0.36 N ATOM 703 CA THR A 48 1.701 0.443 -4.947 1.00 0.39 C ATOM 704 C THR A 48 0.184 0.598 -4.728 1.00 0.35 C ATOM 705 O THR A 48 -0.579 -0.351 -4.898 1.00 0.40 O ATOM 706 CB THR A 48 2.440 0.472 -3.602 1.00 0.43 C ATOM 707 OG1 THR A 48 3.844 0.393 -3.856 1.00 0.51 O ATOM 708 CG2 THR A 48 2.018 -0.689 -2.707 1.00 0.51 C ATOM 709 H THR A 48 2.796 2.184 -5.377 1.00 0.38 H ATOM 710 HA THR A 48 1.910 -0.495 -5.441 1.00 0.44 H ATOM 711 HB THR A 48 2.221 1.409 -3.112 1.00 0.39 H ATOM 712 HG1 THR A 48 3.976 0.034 -4.743 1.00 0.77 H ATOM 713 HG21 THR A 48 2.231 -1.629 -3.198 1.00 1.01 H ATOM 714 HG22 THR A 48 0.957 -0.628 -2.516 1.00 1.20 H ATOM 715 HG23 THR A 48 2.556 -0.632 -1.769 1.00 1.19 H ATOM 716 N ALA A 49 -0.240 1.807 -4.375 1.00 0.31 N ATOM 717 CA ALA A 49 -1.661 2.094 -4.152 1.00 0.32 C ATOM 718 C ALA A 49 -2.459 1.866 -5.441 1.00 0.30 C ATOM 719 O ALA A 49 -3.479 1.168 -5.437 1.00 0.32 O ATOM 720 CB ALA A 49 -1.848 3.521 -3.653 1.00 0.38 C ATOM 721 H ALA A 49 0.421 2.529 -4.278 1.00 0.32 H ATOM 722 HA ALA A 49 -2.019 1.409 -3.396 1.00 0.36 H ATOM 723 HB1 ALA A 49 -1.281 3.653 -2.744 1.00 1.14 H ATOM 724 HB2 ALA A 49 -2.897 3.686 -3.453 1.00 1.07 H ATOM 725 HB3 ALA A 49 -1.509 4.225 -4.403 1.00 1.05 H ATOM 726 N ALA A 50 -1.929 2.389 -6.549 1.00 0.29 N ATOM 727 CA ALA A 50 -2.559 2.273 -7.863 1.00 0.31 C ATOM 728 C ALA A 50 -2.655 0.815 -8.297 1.00 0.31 C ATOM 729 O ALA A 50 -3.624 0.409 -8.932 1.00 0.35 O ATOM 730 CB ALA A 50 -1.795 3.087 -8.899 1.00 0.39 C ATOM 731 H ALA A 50 -1.074 2.878 -6.480 1.00 0.31 H ATOM 732 HA ALA A 50 -3.559 2.674 -7.789 1.00 0.32 H ATOM 733 HB1 ALA A 50 -2.310 3.043 -9.846 1.00 1.16 H ATOM 734 HB2 ALA A 50 -0.797 2.690 -9.009 1.00 1.05 H ATOM 735 HB3 ALA A 50 -1.738 4.111 -8.568 1.00 1.05 H ATOM 736 N ARG A 51 -1.657 0.024 -7.914 1.00 0.32 N ATOM 737 CA ARG A 51 -1.595 -1.417 -8.220 1.00 0.38 C ATOM 738 C ARG A 51 -2.789 -2.132 -7.571 1.00 0.37 C ATOM 739 O ARG A 51 -3.354 -3.071 -8.132 1.00 0.47 O ATOM 740 CB ARG A 51 -0.274 -1.987 -7.644 1.00 0.49 C ATOM 741 CG ARG A 51 0.088 -3.431 -8.019 1.00 0.97 C ATOM 742 CD ARG A 51 0.390 -3.560 -9.508 1.00 0.98 C ATOM 743 NE ARG A 51 0.951 -4.867 -9.864 1.00 1.92 N ATOM 744 CZ ARG A 51 1.184 -5.298 -11.116 1.00 2.31 C ATOM 745 NH1 ARG A 51 0.881 -4.520 -12.166 1.00 2.05 N ATOM 746 NH2 ARG A 51 1.748 -6.495 -11.317 1.00 3.40 N ATOM 747 H ARG A 51 -0.916 0.426 -7.409 1.00 0.33 H ATOM 748 HA ARG A 51 -1.611 -1.551 -9.294 1.00 0.43 H ATOM 749 HB2 ARG A 51 0.545 -1.373 -7.986 1.00 1.08 H ATOM 750 HB3 ARG A 51 -0.318 -1.922 -6.566 1.00 1.12 H ATOM 751 HG2 ARG A 51 0.957 -3.745 -7.457 1.00 1.56 H ATOM 752 HG3 ARG A 51 -0.751 -4.063 -7.773 1.00 1.50 H ATOM 753 HD2 ARG A 51 -0.534 -3.428 -10.049 1.00 1.17 H ATOM 754 HD3 ARG A 51 1.091 -2.788 -9.785 1.00 1.40 H ATOM 755 HE ARG A 51 1.200 -5.455 -9.097 1.00 2.58 H ATOM 756 HH11 ARG A 51 0.483 -3.612 -12.026 1.00 1.81 H ATOM 757 HH12 ARG A 51 1.038 -4.794 -13.119 1.00 2.55 H ATOM 758 HH21 ARG A 51 2.016 -7.079 -10.526 1.00 4.01 H ATOM 759 HH22 ARG A 51 1.944 -6.892 -12.212 1.00 3.78 H ATOM 760 N LEU A 52 -3.177 -1.657 -6.405 1.00 0.32 N ATOM 761 CA LEU A 52 -4.279 -2.238 -5.673 1.00 0.34 C ATOM 762 C LEU A 52 -5.611 -1.747 -6.209 1.00 0.33 C ATOM 763 O LEU A 52 -6.516 -2.562 -6.471 1.00 0.40 O ATOM 764 CB LEU A 52 -4.150 -1.922 -4.175 1.00 0.35 C ATOM 765 CG LEU A 52 -2.873 -2.447 -3.514 1.00 0.38 C ATOM 766 CD1 LEU A 52 -2.802 -2.006 -2.068 1.00 0.43 C ATOM 767 CD2 LEU A 52 -2.806 -3.960 -3.621 1.00 0.39 C ATOM 768 H LEU A 52 -2.692 -0.892 -6.023 1.00 0.30 H ATOM 769 HA LEU A 52 -4.224 -3.311 -5.799 1.00 0.39 H ATOM 770 HB2 LEU A 52 -4.181 -0.851 -4.039 1.00 0.35 H ATOM 771 HB3 LEU A 52 -4.990 -2.365 -3.658 1.00 0.38 H ATOM 772 HG LEU A 52 -2.025 -2.029 -4.036 1.00 0.41 H ATOM 773 HD11 LEU A 52 -2.811 -0.928 -2.020 1.00 1.04 H ATOM 774 HD12 LEU A 52 -1.892 -2.368 -1.614 1.00 1.06 H ATOM 775 HD13 LEU A 52 -3.658 -2.391 -1.536 1.00 1.06 H ATOM 776 HD21 LEU A 52 -3.671 -4.395 -3.139 1.00 1.11 H ATOM 777 HD22 LEU A 52 -1.905 -4.323 -3.149 1.00 0.96 H ATOM 778 HD23 LEU A 52 -2.797 -4.241 -4.666 1.00 1.10 H ATOM 779 N GLU A 53 -5.731 -0.425 -6.408 1.00 0.28 N ATOM 780 CA GLU A 53 -6.973 0.170 -6.898 1.00 0.29 C ATOM 781 C GLU A 53 -7.386 -0.423 -8.243 1.00 0.31 C ATOM 782 O GLU A 53 -8.535 -0.771 -8.421 1.00 0.35 O ATOM 783 CB GLU A 53 -6.878 1.682 -7.053 1.00 0.29 C ATOM 784 CG GLU A 53 -6.593 2.470 -5.795 1.00 0.35 C ATOM 785 CD GLU A 53 -6.657 3.963 -6.063 1.00 0.41 C ATOM 786 OE1 GLU A 53 -5.658 4.541 -6.604 1.00 0.53 O ATOM 787 OE2 GLU A 53 -7.671 4.589 -5.696 1.00 0.51 O ATOM 788 H GLU A 53 -4.975 0.174 -6.202 1.00 0.27 H ATOM 789 HA GLU A 53 -7.746 -0.057 -6.177 1.00 0.33 H ATOM 790 HB2 GLU A 53 -6.108 1.905 -7.773 1.00 0.29 H ATOM 791 HB3 GLU A 53 -7.818 2.020 -7.460 1.00 0.32 H ATOM 792 HG2 GLU A 53 -7.323 2.214 -5.041 1.00 0.41 H ATOM 793 HG3 GLU A 53 -5.597 2.225 -5.457 1.00 0.33 H ATOM 794 N SER A 54 -6.438 -0.553 -9.163 1.00 0.35 N ATOM 795 CA SER A 54 -6.719 -1.040 -10.508 1.00 0.43 C ATOM 796 C SER A 54 -7.152 -2.512 -10.536 1.00 0.47 C ATOM 797 O SER A 54 -7.894 -2.923 -11.425 1.00 0.61 O ATOM 798 CB SER A 54 -5.517 -0.788 -11.430 1.00 0.49 C ATOM 799 OG SER A 54 -4.317 -1.272 -10.839 1.00 1.16 O ATOM 800 H SER A 54 -5.518 -0.298 -8.931 1.00 0.36 H ATOM 801 HA SER A 54 -7.545 -0.446 -10.871 1.00 0.45 H ATOM 802 HB2 SER A 54 -5.670 -1.311 -12.362 1.00 1.13 H ATOM 803 HB3 SER A 54 -5.424 0.272 -11.621 1.00 1.14 H ATOM 804 HG SER A 54 -3.958 -0.586 -10.257 1.00 1.39 H ATOM 805 N ARG A 55 -6.703 -3.290 -9.556 1.00 0.40 N ATOM 806 CA ARG A 55 -7.046 -4.706 -9.490 1.00 0.46 C ATOM 807 C ARG A 55 -8.455 -4.911 -8.922 1.00 0.47 C ATOM 808 O ARG A 55 -9.228 -5.748 -9.410 1.00 0.57 O ATOM 809 CB ARG A 55 -6.029 -5.470 -8.624 1.00 0.50 C ATOM 810 CG ARG A 55 -6.284 -6.971 -8.603 1.00 0.61 C ATOM 811 CD ARG A 55 -5.352 -7.713 -7.661 1.00 0.75 C ATOM 812 NE ARG A 55 -5.595 -9.172 -7.726 1.00 1.28 N ATOM 813 CZ ARG A 55 -5.210 -10.102 -6.820 1.00 1.65 C ATOM 814 NH1 ARG A 55 -4.756 -9.731 -5.603 1.00 1.46 N ATOM 815 NH2 ARG A 55 -5.354 -11.395 -7.115 1.00 2.65 N ATOM 816 H ARG A 55 -6.106 -2.896 -8.886 1.00 0.37 H ATOM 817 HA ARG A 55 -7.023 -5.122 -10.486 1.00 0.51 H ATOM 818 HB2 ARG A 55 -5.031 -5.289 -8.999 1.00 0.54 H ATOM 819 HB3 ARG A 55 -6.085 -5.107 -7.609 1.00 0.52 H ATOM 820 HG2 ARG A 55 -7.300 -7.149 -8.283 1.00 0.74 H ATOM 821 HG3 ARG A 55 -6.158 -7.361 -9.603 1.00 0.63 H ATOM 822 HD2 ARG A 55 -4.328 -7.505 -7.934 1.00 1.34 H ATOM 823 HD3 ARG A 55 -5.533 -7.371 -6.654 1.00 1.29 H ATOM 824 HE ARG A 55 -6.056 -9.440 -8.558 1.00 1.84 H ATOM 825 HH11 ARG A 55 -4.714 -8.764 -5.346 1.00 1.47 H ATOM 826 HH12 ARG A 55 -4.464 -10.363 -4.876 1.00 1.85 H ATOM 827 HH21 ARG A 55 -5.747 -11.673 -8.004 1.00 3.22 H ATOM 828 HH22 ARG A 55 -5.107 -12.155 -6.506 1.00 3.00 H ATOM 829 N TYR A 56 -8.783 -4.175 -7.885 1.00 0.42 N ATOM 830 CA TYR A 56 -10.064 -4.380 -7.212 1.00 0.47 C ATOM 831 C TYR A 56 -11.142 -3.416 -7.707 1.00 0.50 C ATOM 832 O TYR A 56 -12.319 -3.763 -7.759 1.00 0.67 O ATOM 833 CB TYR A 56 -9.904 -4.299 -5.685 1.00 0.52 C ATOM 834 CG TYR A 56 -8.895 -5.294 -5.136 1.00 0.53 C ATOM 835 CD1 TYR A 56 -9.167 -6.657 -5.137 1.00 0.62 C ATOM 836 CD2 TYR A 56 -7.672 -4.871 -4.638 1.00 0.59 C ATOM 837 CE1 TYR A 56 -8.247 -7.567 -4.663 1.00 0.70 C ATOM 838 CE2 TYR A 56 -6.749 -5.775 -4.154 1.00 0.65 C ATOM 839 CZ TYR A 56 -7.038 -7.118 -4.173 1.00 0.67 C ATOM 840 OH TYR A 56 -6.114 -8.020 -3.696 1.00 0.79 O ATOM 841 H TYR A 56 -8.148 -3.501 -7.561 1.00 0.39 H ATOM 842 HA TYR A 56 -10.384 -5.379 -7.473 1.00 0.51 H ATOM 843 HB2 TYR A 56 -9.594 -3.303 -5.401 1.00 0.53 H ATOM 844 HB3 TYR A 56 -10.860 -4.527 -5.240 1.00 0.56 H ATOM 845 HD1 TYR A 56 -10.118 -7.004 -5.513 1.00 0.70 H ATOM 846 HD2 TYR A 56 -7.456 -3.813 -4.618 1.00 0.66 H ATOM 847 HE1 TYR A 56 -8.465 -8.625 -4.670 1.00 0.83 H ATOM 848 HE2 TYR A 56 -5.807 -5.418 -3.767 1.00 0.75 H ATOM 849 HH TYR A 56 -5.879 -7.785 -2.791 1.00 0.95 H ATOM 850 N GLY A 57 -10.736 -2.238 -8.103 1.00 0.41 N ATOM 851 CA GLY A 57 -11.675 -1.245 -8.576 1.00 0.45 C ATOM 852 C GLY A 57 -12.130 -0.322 -7.471 1.00 0.46 C ATOM 853 O GLY A 57 -13.293 0.099 -7.443 1.00 0.61 O ATOM 854 H GLY A 57 -9.778 -2.015 -8.104 1.00 0.38 H ATOM 855 HA2 GLY A 57 -11.203 -0.673 -9.359 1.00 0.47 H ATOM 856 HA3 GLY A 57 -12.538 -1.746 -8.989 1.00 0.50 H ATOM 857 N VAL A 58 -11.213 0.036 -6.584 1.00 0.38 N ATOM 858 CA VAL A 58 -11.564 0.851 -5.432 1.00 0.42 C ATOM 859 C VAL A 58 -11.339 2.333 -5.743 1.00 0.45 C ATOM 860 O VAL A 58 -11.040 2.675 -6.890 1.00 0.51 O ATOM 861 CB VAL A 58 -10.854 0.415 -4.095 1.00 0.42 C ATOM 862 CG1 VAL A 58 -10.900 -1.082 -3.914 1.00 0.59 C ATOM 863 CG2 VAL A 58 -9.424 0.919 -3.950 1.00 0.57 C ATOM 864 H VAL A 58 -10.284 -0.223 -6.733 1.00 0.34 H ATOM 865 HA VAL A 58 -12.630 0.727 -5.316 1.00 0.50 H ATOM 866 HB VAL A 58 -11.455 0.841 -3.310 1.00 0.56 H ATOM 867 HG11 VAL A 58 -10.452 -1.343 -2.967 1.00 1.23 H ATOM 868 HG12 VAL A 58 -10.320 -1.514 -4.719 1.00 1.25 H ATOM 869 HG13 VAL A 58 -11.920 -1.435 -3.955 1.00 1.06 H ATOM 870 HG21 VAL A 58 -9.056 0.588 -2.987 1.00 1.05 H ATOM 871 HG22 VAL A 58 -9.426 2.001 -3.983 1.00 1.24 H ATOM 872 HG23 VAL A 58 -8.811 0.514 -4.742 1.00 1.24 H ATOM 873 N SER A 59 -11.513 3.201 -4.763 1.00 0.51 N ATOM 874 CA SER A 59 -11.364 4.619 -4.983 1.00 0.61 C ATOM 875 C SER A 59 -10.784 5.265 -3.709 1.00 0.56 C ATOM 876 O SER A 59 -11.466 5.339 -2.667 1.00 0.63 O ATOM 877 CB SER A 59 -12.753 5.221 -5.339 1.00 0.84 C ATOM 878 OG SER A 59 -12.665 6.527 -5.897 1.00 1.59 O ATOM 879 H SER A 59 -11.737 2.911 -3.855 1.00 0.54 H ATOM 880 HA SER A 59 -10.686 4.769 -5.809 1.00 0.62 H ATOM 881 HB2 SER A 59 -13.248 4.580 -6.053 1.00 1.32 H ATOM 882 HB3 SER A 59 -13.348 5.270 -4.438 1.00 1.36 H ATOM 883 HG SER A 59 -13.441 7.027 -5.591 1.00 2.14 H ATOM 884 N ILE A 60 -9.521 5.632 -3.759 1.00 0.50 N ATOM 885 CA ILE A 60 -8.861 6.294 -2.639 1.00 0.48 C ATOM 886 C ILE A 60 -9.139 7.826 -2.674 1.00 0.53 C ATOM 887 O ILE A 60 -9.103 8.434 -3.746 1.00 0.63 O ATOM 888 CB ILE A 60 -7.315 6.004 -2.660 1.00 0.48 C ATOM 889 CG1 ILE A 60 -7.056 4.494 -2.504 1.00 0.64 C ATOM 890 CG2 ILE A 60 -6.558 6.797 -1.590 1.00 0.53 C ATOM 891 CD1 ILE A 60 -7.599 3.883 -1.209 1.00 0.75 C ATOM 892 H ILE A 60 -8.993 5.444 -4.573 1.00 0.50 H ATOM 893 HA ILE A 60 -9.276 5.877 -1.732 1.00 0.59 H ATOM 894 HB ILE A 60 -6.945 6.313 -3.626 1.00 0.50 H ATOM 895 HG12 ILE A 60 -7.516 3.983 -3.335 1.00 1.29 H ATOM 896 HG13 ILE A 60 -5.993 4.307 -2.542 1.00 1.27 H ATOM 897 HG21 ILE A 60 -5.505 6.559 -1.638 1.00 1.01 H ATOM 898 HG22 ILE A 60 -6.937 6.525 -0.615 1.00 1.13 H ATOM 899 HG23 ILE A 60 -6.703 7.855 -1.754 1.00 1.23 H ATOM 900 HD11 ILE A 60 -7.137 4.358 -0.355 1.00 1.11 H ATOM 901 HD12 ILE A 60 -7.376 2.824 -1.190 1.00 1.35 H ATOM 902 HD13 ILE A 60 -8.670 4.025 -1.162 1.00 1.64 H ATOM 903 N PRO A 61 -9.488 8.448 -1.518 1.00 0.65 N ATOM 904 CA PRO A 61 -9.741 9.894 -1.437 1.00 0.77 C ATOM 905 C PRO A 61 -8.428 10.696 -1.470 1.00 0.65 C ATOM 906 O PRO A 61 -7.393 10.237 -0.954 1.00 0.57 O ATOM 907 CB PRO A 61 -10.431 10.075 -0.070 1.00 0.97 C ATOM 908 CG PRO A 61 -10.677 8.695 0.447 1.00 1.08 C ATOM 909 CD PRO A 61 -9.685 7.800 -0.220 1.00 0.83 C ATOM 910 HA PRO A 61 -10.393 10.235 -2.230 1.00 0.88 H ATOM 911 HB2 PRO A 61 -9.776 10.622 0.594 1.00 0.93 H ATOM 912 HB3 PRO A 61 -11.352 10.622 -0.201 1.00 1.15 H ATOM 913 HG2 PRO A 61 -10.522 8.677 1.515 1.00 1.24 H ATOM 914 HG3 PRO A 61 -11.685 8.385 0.214 1.00 1.25 H ATOM 915 HD2 PRO A 61 -8.774 7.770 0.360 1.00 0.83 H ATOM 916 HD3 PRO A 61 -10.096 6.807 -0.333 1.00 0.88 H ATOM 917 N ASP A 62 -8.490 11.906 -2.003 1.00 0.74 N ATOM 918 CA ASP A 62 -7.300 12.736 -2.237 1.00 0.73 C ATOM 919 C ASP A 62 -6.620 13.183 -0.938 1.00 0.62 C ATOM 920 O ASP A 62 -5.399 13.101 -0.812 1.00 0.64 O ATOM 921 CB ASP A 62 -7.630 13.965 -3.128 1.00 0.93 C ATOM 922 CG ASP A 62 -8.577 14.976 -2.492 1.00 1.44 C ATOM 923 OD1 ASP A 62 -9.766 14.663 -2.322 1.00 1.92 O ATOM 924 OD2 ASP A 62 -8.136 16.104 -2.173 1.00 2.07 O ATOM 925 H ASP A 62 -9.364 12.288 -2.236 1.00 0.89 H ATOM 926 HA ASP A 62 -6.596 12.119 -2.775 1.00 0.74 H ATOM 927 HB2 ASP A 62 -6.718 14.490 -3.374 1.00 1.42 H ATOM 928 HB3 ASP A 62 -8.079 13.617 -4.046 1.00 1.50 H ATOM 929 N ASP A 63 -7.396 13.601 0.043 1.00 0.63 N ATOM 930 CA ASP A 63 -6.820 14.091 1.298 1.00 0.61 C ATOM 931 C ASP A 63 -6.463 12.944 2.233 1.00 0.59 C ATOM 932 O ASP A 63 -5.505 13.029 3.007 1.00 0.64 O ATOM 933 CB ASP A 63 -7.764 15.078 2.012 1.00 0.77 C ATOM 934 CG ASP A 63 -9.046 14.428 2.501 1.00 1.36 C ATOM 935 OD1 ASP A 63 -9.898 14.103 1.653 1.00 2.00 O ATOM 936 OD2 ASP A 63 -9.210 14.246 3.734 1.00 2.10 O ATOM 937 H ASP A 63 -8.373 13.616 -0.058 1.00 0.73 H ATOM 938 HA ASP A 63 -5.910 14.612 1.037 1.00 0.64 H ATOM 939 HB2 ASP A 63 -7.245 15.472 2.873 1.00 1.22 H ATOM 940 HB3 ASP A 63 -8.017 15.883 1.333 1.00 1.43 H ATOM 941 N VAL A 64 -7.189 11.845 2.124 1.00 0.62 N ATOM 942 CA VAL A 64 -6.990 10.727 3.028 1.00 0.69 C ATOM 943 C VAL A 64 -5.750 9.895 2.648 1.00 0.67 C ATOM 944 O VAL A 64 -5.204 9.156 3.463 1.00 0.78 O ATOM 945 CB VAL A 64 -8.270 9.835 3.165 1.00 0.82 C ATOM 946 CG1 VAL A 64 -8.098 8.770 4.242 1.00 0.98 C ATOM 947 CG2 VAL A 64 -9.488 10.697 3.472 1.00 0.90 C ATOM 948 H VAL A 64 -7.872 11.816 1.425 1.00 0.65 H ATOM 949 HA VAL A 64 -6.778 11.161 3.992 1.00 0.75 H ATOM 950 HB VAL A 64 -8.437 9.326 2.227 1.00 0.81 H ATOM 951 HG11 VAL A 64 -7.919 9.257 5.188 1.00 1.47 H ATOM 952 HG12 VAL A 64 -7.244 8.154 3.999 1.00 1.46 H ATOM 953 HG13 VAL A 64 -8.982 8.153 4.310 1.00 1.30 H ATOM 954 HG21 VAL A 64 -10.361 10.068 3.564 1.00 1.40 H ATOM 955 HG22 VAL A 64 -9.632 11.404 2.670 1.00 1.21 H ATOM 956 HG23 VAL A 64 -9.325 11.224 4.400 1.00 1.47 H ATOM 957 N ALA A 65 -5.255 10.085 1.438 1.00 0.61 N ATOM 958 CA ALA A 65 -4.077 9.359 0.971 1.00 0.67 C ATOM 959 C ALA A 65 -2.802 9.851 1.680 1.00 0.64 C ATOM 960 O ALA A 65 -1.810 9.144 1.761 1.00 0.74 O ATOM 961 CB ALA A 65 -3.956 9.497 -0.527 1.00 0.77 C ATOM 962 H ALA A 65 -5.700 10.713 0.828 1.00 0.61 H ATOM 963 HA ALA A 65 -4.196 8.314 1.216 1.00 0.76 H ATOM 964 HB1 ALA A 65 -4.852 9.134 -1.011 1.00 1.31 H ATOM 965 HB2 ALA A 65 -3.103 8.920 -0.858 1.00 1.30 H ATOM 966 HB3 ALA A 65 -3.803 10.536 -0.780 1.00 1.19 H ATOM 967 N GLY A 66 -2.867 11.052 2.229 1.00 0.58 N ATOM 968 CA GLY A 66 -1.724 11.620 2.905 1.00 0.66 C ATOM 969 C GLY A 66 -1.856 11.561 4.406 1.00 0.68 C ATOM 970 O GLY A 66 -1.292 12.387 5.119 1.00 0.86 O ATOM 971 H GLY A 66 -3.709 11.552 2.186 1.00 0.56 H ATOM 972 HA2 GLY A 66 -0.845 11.057 2.628 1.00 0.71 H ATOM 973 HA3 GLY A 66 -1.599 12.650 2.593 1.00 0.76 H ATOM 974 N ARG A 67 -2.613 10.592 4.900 1.00 0.64 N ATOM 975 CA ARG A 67 -2.838 10.467 6.339 1.00 0.79 C ATOM 976 C ARG A 67 -2.234 9.165 6.846 1.00 0.77 C ATOM 977 O ARG A 67 -2.551 8.702 7.950 1.00 0.95 O ATOM 978 CB ARG A 67 -4.342 10.504 6.661 1.00 0.94 C ATOM 979 CG ARG A 67 -5.090 11.667 6.033 1.00 1.12 C ATOM 980 CD ARG A 67 -6.553 11.713 6.463 1.00 1.40 C ATOM 981 NE ARG A 67 -6.753 12.376 7.763 1.00 1.89 N ATOM 982 CZ ARG A 67 -7.820 12.198 8.549 1.00 2.51 C ATOM 983 NH1 ARG A 67 -8.559 11.088 8.443 1.00 2.93 N ATOM 984 NH2 ARG A 67 -8.088 13.080 9.505 1.00 3.22 N ATOM 985 H ARG A 67 -3.032 9.949 4.286 1.00 0.62 H ATOM 986 HA ARG A 67 -2.348 11.295 6.825 1.00 0.90 H ATOM 987 HB2 ARG A 67 -4.793 9.586 6.315 1.00 1.03 H ATOM 988 HB3 ARG A 67 -4.469 10.565 7.731 1.00 1.14 H ATOM 989 HG2 ARG A 67 -4.605 12.582 6.341 1.00 1.53 H ATOM 990 HG3 ARG A 67 -5.032 11.582 4.956 1.00 1.58 H ATOM 991 HD2 ARG A 67 -7.123 12.239 5.711 1.00 1.87 H ATOM 992 HD3 ARG A 67 -6.914 10.699 6.540 1.00 1.90 H ATOM 993 HE ARG A 67 -6.096 13.074 7.976 1.00 2.27 H ATOM 994 HH11 ARG A 67 -8.350 10.344 7.805 1.00 2.92 H ATOM 995 HH12 ARG A 67 -9.370 10.940 9.022 1.00 3.61 H ATOM 996 HH21 ARG A 67 -7.502 13.883 9.675 1.00 3.51 H ATOM 997 HH22 ARG A 67 -8.916 13.023 10.080 1.00 3.77 H ATOM 998 N VAL A 68 -1.356 8.593 6.041 1.00 0.62 N ATOM 999 CA VAL A 68 -0.692 7.340 6.375 1.00 0.66 C ATOM 1000 C VAL A 68 0.807 7.558 6.562 1.00 0.67 C ATOM 1001 O VAL A 68 1.460 8.213 5.733 1.00 1.00 O ATOM 1002 CB VAL A 68 -0.939 6.238 5.296 1.00 0.68 C ATOM 1003 CG1 VAL A 68 -2.394 5.838 5.276 1.00 0.77 C ATOM 1004 CG2 VAL A 68 -0.504 6.693 3.901 1.00 0.64 C ATOM 1005 H VAL A 68 -1.104 9.038 5.202 1.00 0.55 H ATOM 1006 HA VAL A 68 -1.107 7.003 7.315 1.00 0.78 H ATOM 1007 HB VAL A 68 -0.356 5.373 5.574 1.00 0.78 H ATOM 1008 HG11 VAL A 68 -2.990 6.706 5.037 1.00 1.27 H ATOM 1009 HG12 VAL A 68 -2.667 5.462 6.252 1.00 1.31 H ATOM 1010 HG13 VAL A 68 -2.547 5.069 4.535 1.00 1.26 H ATOM 1011 HG21 VAL A 68 -0.660 5.895 3.189 1.00 1.20 H ATOM 1012 HG22 VAL A 68 0.545 6.943 3.914 1.00 1.23 H ATOM 1013 HG23 VAL A 68 -1.083 7.555 3.605 1.00 1.15 H ATOM 1014 N ASP A 69 1.331 7.077 7.664 1.00 0.54 N ATOM 1015 CA ASP A 69 2.759 7.193 7.951 1.00 0.64 C ATOM 1016 C ASP A 69 3.396 5.811 7.811 1.00 0.50 C ATOM 1017 O ASP A 69 4.607 5.668 7.528 1.00 0.54 O ATOM 1018 CB ASP A 69 2.972 7.762 9.374 1.00 0.99 C ATOM 1019 CG ASP A 69 4.410 8.190 9.675 1.00 1.11 C ATOM 1020 OD1 ASP A 69 4.859 9.252 9.184 1.00 1.37 O ATOM 1021 OD2 ASP A 69 5.149 7.413 10.337 1.00 1.84 O ATOM 1022 H ASP A 69 0.752 6.608 8.315 1.00 0.66 H ATOM 1023 HA ASP A 69 3.188 7.865 7.222 1.00 0.75 H ATOM 1024 HB2 ASP A 69 2.342 8.627 9.516 1.00 1.65 H ATOM 1025 HB3 ASP A 69 2.700 6.998 10.087 1.00 1.55 H ATOM 1026 N THR A 70 2.552 4.784 7.964 1.00 0.43 N ATOM 1027 CA THR A 70 2.978 3.404 7.882 1.00 0.37 C ATOM 1028 C THR A 70 2.008 2.580 7.008 1.00 0.33 C ATOM 1029 O THR A 70 0.839 2.974 6.818 1.00 0.34 O ATOM 1030 CB THR A 70 3.020 2.786 9.285 1.00 0.42 C ATOM 1031 OG1 THR A 70 1.751 2.985 9.926 1.00 0.51 O ATOM 1032 CG2 THR A 70 4.144 3.375 10.126 1.00 0.44 C ATOM 1033 H THR A 70 1.605 4.968 8.157 1.00 0.50 H ATOM 1034 HA THR A 70 3.967 3.361 7.454 1.00 0.40 H ATOM 1035 HB THR A 70 3.173 1.722 9.177 1.00 0.46 H ATOM 1036 HG1 THR A 70 1.419 3.872 9.721 1.00 0.52 H ATOM 1037 HG21 THR A 70 3.998 4.441 10.222 1.00 1.19 H ATOM 1038 HG22 THR A 70 5.087 3.185 9.633 1.00 1.03 H ATOM 1039 HG23 THR A 70 4.152 2.913 11.104 1.00 1.11 H ATOM 1040 N PRO A 71 2.472 1.416 6.447 1.00 0.32 N ATOM 1041 CA PRO A 71 1.630 0.504 5.629 1.00 0.31 C ATOM 1042 C PRO A 71 0.408 -0.009 6.398 1.00 0.29 C ATOM 1043 O PRO A 71 -0.606 -0.370 5.805 1.00 0.33 O ATOM 1044 CB PRO A 71 2.586 -0.664 5.314 1.00 0.34 C ATOM 1045 CG PRO A 71 3.920 -0.036 5.361 1.00 0.38 C ATOM 1046 CD PRO A 71 3.865 0.926 6.507 1.00 0.36 C ATOM 1047 HA PRO A 71 1.313 0.974 4.708 1.00 0.35 H ATOM 1048 HB2 PRO A 71 2.498 -1.428 6.074 1.00 0.33 H ATOM 1049 HB3 PRO A 71 2.374 -1.076 4.338 1.00 0.41 H ATOM 1050 HG2 PRO A 71 4.667 -0.790 5.547 1.00 0.40 H ATOM 1051 HG3 PRO A 71 4.125 0.483 4.436 1.00 0.43 H ATOM 1052 HD2 PRO A 71 4.059 0.415 7.438 1.00 0.36 H ATOM 1053 HD3 PRO A 71 4.564 1.732 6.351 1.00 0.41 H ATOM 1054 N ARG A 72 0.525 -0.006 7.722 1.00 0.30 N ATOM 1055 CA ARG A 72 -0.530 -0.422 8.657 1.00 0.34 C ATOM 1056 C ARG A 72 -1.820 0.344 8.392 1.00 0.36 C ATOM 1057 O ARG A 72 -2.895 -0.230 8.255 1.00 0.43 O ATOM 1058 CB ARG A 72 -0.040 -0.099 10.085 1.00 0.41 C ATOM 1059 CG ARG A 72 -1.051 -0.297 11.216 1.00 0.54 C ATOM 1060 CD ARG A 72 -0.482 0.222 12.549 1.00 0.69 C ATOM 1061 NE ARG A 72 -0.241 1.686 12.540 1.00 0.75 N ATOM 1062 CZ ARG A 72 0.950 2.298 12.846 1.00 0.98 C ATOM 1063 NH1 ARG A 72 2.014 1.558 13.207 1.00 1.38 N ATOM 1064 NH2 ARG A 72 1.065 3.639 12.762 1.00 1.16 N ATOM 1065 H ARG A 72 1.377 0.309 8.095 1.00 0.31 H ATOM 1066 HA ARG A 72 -0.719 -1.482 8.582 1.00 0.37 H ATOM 1067 HB2 ARG A 72 0.818 -0.719 10.305 1.00 0.47 H ATOM 1068 HB3 ARG A 72 0.281 0.935 10.110 1.00 0.43 H ATOM 1069 HG2 ARG A 72 -1.948 0.254 10.982 1.00 0.56 H ATOM 1070 HG3 ARG A 72 -1.268 -1.349 11.315 1.00 0.63 H ATOM 1071 HD2 ARG A 72 -1.166 -0.018 13.348 1.00 0.82 H ATOM 1072 HD3 ARG A 72 0.460 -0.272 12.735 1.00 0.79 H ATOM 1073 HE ARG A 72 -1.034 2.212 12.282 1.00 0.96 H ATOM 1074 HH11 ARG A 72 1.971 0.561 13.264 1.00 1.51 H ATOM 1075 HH12 ARG A 72 2.927 1.943 13.420 1.00 1.75 H ATOM 1076 HH21 ARG A 72 0.300 4.224 12.467 1.00 1.26 H ATOM 1077 HH22 ARG A 72 1.917 4.127 12.961 1.00 1.42 H ATOM 1078 N GLU A 73 -1.675 1.626 8.290 1.00 0.37 N ATOM 1079 CA GLU A 73 -2.781 2.536 8.164 1.00 0.42 C ATOM 1080 C GLU A 73 -3.319 2.518 6.733 1.00 0.40 C ATOM 1081 O GLU A 73 -4.505 2.703 6.496 1.00 0.44 O ATOM 1082 CB GLU A 73 -2.258 3.902 8.567 1.00 0.50 C ATOM 1083 CG GLU A 73 -1.607 3.844 9.946 1.00 0.63 C ATOM 1084 CD GLU A 73 -0.653 4.957 10.240 1.00 0.74 C ATOM 1085 OE1 GLU A 73 0.201 5.273 9.366 1.00 0.69 O ATOM 1086 OE2 GLU A 73 -0.692 5.483 11.373 1.00 1.33 O ATOM 1087 H GLU A 73 -0.766 2.000 8.293 1.00 0.36 H ATOM 1088 HA GLU A 73 -3.552 2.241 8.858 1.00 0.45 H ATOM 1089 HB2 GLU A 73 -1.531 4.229 7.839 1.00 0.50 H ATOM 1090 HB3 GLU A 73 -3.086 4.593 8.610 1.00 0.58 H ATOM 1091 HG2 GLU A 73 -2.384 3.880 10.693 1.00 1.01 H ATOM 1092 HG3 GLU A 73 -1.083 2.905 10.048 1.00 0.99 H ATOM 1093 N LEU A 74 -2.437 2.235 5.799 1.00 0.40 N ATOM 1094 CA LEU A 74 -2.772 2.168 4.385 1.00 0.43 C ATOM 1095 C LEU A 74 -3.671 0.922 4.133 1.00 0.41 C ATOM 1096 O LEU A 74 -4.690 0.999 3.424 1.00 0.42 O ATOM 1097 CB LEU A 74 -1.435 2.083 3.579 1.00 0.44 C ATOM 1098 CG LEU A 74 -1.437 2.473 2.073 1.00 0.50 C ATOM 1099 CD1 LEU A 74 -0.033 2.389 1.516 1.00 1.04 C ATOM 1100 CD2 LEU A 74 -2.371 1.610 1.245 1.00 1.10 C ATOM 1101 H LEU A 74 -1.511 2.077 6.077 1.00 0.42 H ATOM 1102 HA LEU A 74 -3.309 3.060 4.095 1.00 0.46 H ATOM 1103 HB2 LEU A 74 -0.711 2.722 4.067 1.00 0.46 H ATOM 1104 HB3 LEU A 74 -1.088 1.065 3.676 1.00 0.45 H ATOM 1105 HG LEU A 74 -1.747 3.504 1.992 1.00 0.90 H ATOM 1106 HD11 LEU A 74 0.626 3.053 2.056 1.00 1.74 H ATOM 1107 HD12 LEU A 74 -0.033 2.666 0.473 1.00 1.51 H ATOM 1108 HD13 LEU A 74 0.316 1.373 1.627 1.00 1.48 H ATOM 1109 HD21 LEU A 74 -2.349 1.924 0.211 1.00 1.61 H ATOM 1110 HD22 LEU A 74 -3.370 1.707 1.652 1.00 1.53 H ATOM 1111 HD23 LEU A 74 -2.045 0.583 1.325 1.00 1.77 H ATOM 1112 N LEU A 75 -3.288 -0.205 4.740 1.00 0.41 N ATOM 1113 CA LEU A 75 -4.001 -1.479 4.563 1.00 0.41 C ATOM 1114 C LEU A 75 -5.444 -1.375 5.047 1.00 0.39 C ATOM 1115 O LEU A 75 -6.395 -1.648 4.286 1.00 0.37 O ATOM 1116 CB LEU A 75 -3.291 -2.613 5.325 1.00 0.46 C ATOM 1117 CG LEU A 75 -3.861 -4.027 5.113 1.00 0.48 C ATOM 1118 CD1 LEU A 75 -3.660 -4.489 3.675 1.00 0.51 C ATOM 1119 CD2 LEU A 75 -3.225 -5.006 6.086 1.00 0.54 C ATOM 1120 H LEU A 75 -2.494 -0.172 5.320 1.00 0.44 H ATOM 1121 HA LEU A 75 -3.993 -1.716 3.511 1.00 0.43 H ATOM 1122 HB2 LEU A 75 -2.252 -2.614 5.032 1.00 0.49 H ATOM 1123 HB3 LEU A 75 -3.342 -2.381 6.378 1.00 0.48 H ATOM 1124 HG LEU A 75 -4.931 -4.025 5.285 1.00 0.46 H ATOM 1125 HD11 LEU A 75 -4.153 -3.806 3.000 1.00 1.20 H ATOM 1126 HD12 LEU A 75 -4.077 -5.477 3.551 1.00 1.09 H ATOM 1127 HD13 LEU A 75 -2.605 -4.528 3.447 1.00 1.04 H ATOM 1128 HD21 LEU A 75 -3.431 -4.696 7.099 1.00 1.17 H ATOM 1129 HD22 LEU A 75 -2.162 -5.039 5.918 1.00 1.16 H ATOM 1130 HD23 LEU A 75 -3.628 -5.991 5.919 1.00 1.11 H ATOM 1131 N ASP A 76 -5.608 -0.937 6.301 1.00 0.44 N ATOM 1132 CA ASP A 76 -6.936 -0.839 6.926 1.00 0.48 C ATOM 1133 C ASP A 76 -7.847 0.125 6.168 1.00 0.40 C ATOM 1134 O ASP A 76 -9.044 -0.102 6.042 1.00 0.44 O ATOM 1135 CB ASP A 76 -6.830 -0.433 8.400 1.00 0.66 C ATOM 1136 CG ASP A 76 -8.168 -0.450 9.127 1.00 1.06 C ATOM 1137 OD1 ASP A 76 -8.564 -1.520 9.639 1.00 1.08 O ATOM 1138 OD2 ASP A 76 -8.830 0.605 9.224 1.00 1.89 O ATOM 1139 H ASP A 76 -4.816 -0.683 6.824 1.00 0.49 H ATOM 1140 HA ASP A 76 -7.378 -1.820 6.867 1.00 0.53 H ATOM 1141 HB2 ASP A 76 -6.169 -1.124 8.902 1.00 1.10 H ATOM 1142 HB3 ASP A 76 -6.427 0.566 8.468 1.00 1.09 H ATOM 1143 N LEU A 77 -7.255 1.167 5.617 1.00 0.37 N ATOM 1144 CA LEU A 77 -7.976 2.165 4.855 1.00 0.38 C ATOM 1145 C LEU A 77 -8.639 1.548 3.625 1.00 0.33 C ATOM 1146 O LEU A 77 -9.793 1.837 3.320 1.00 0.34 O ATOM 1147 CB LEU A 77 -7.028 3.302 4.433 1.00 0.46 C ATOM 1148 CG LEU A 77 -7.643 4.426 3.599 1.00 0.57 C ATOM 1149 CD1 LEU A 77 -8.728 5.123 4.382 1.00 1.37 C ATOM 1150 CD2 LEU A 77 -6.569 5.414 3.162 1.00 1.24 C ATOM 1151 H LEU A 77 -6.286 1.259 5.731 1.00 0.40 H ATOM 1152 HA LEU A 77 -8.743 2.577 5.493 1.00 0.45 H ATOM 1153 HB2 LEU A 77 -6.612 3.743 5.326 1.00 0.58 H ATOM 1154 HB3 LEU A 77 -6.216 2.885 3.861 1.00 0.49 H ATOM 1155 HG LEU A 77 -8.093 4.000 2.712 1.00 1.09 H ATOM 1156 HD11 LEU A 77 -9.155 5.921 3.798 1.00 1.82 H ATOM 1157 HD12 LEU A 77 -8.295 5.525 5.285 1.00 1.74 H ATOM 1158 HD13 LEU A 77 -9.489 4.398 4.629 1.00 2.11 H ATOM 1159 HD21 LEU A 77 -6.089 5.847 4.026 1.00 1.84 H ATOM 1160 HD22 LEU A 77 -7.021 6.196 2.572 1.00 1.74 H ATOM 1161 HD23 LEU A 77 -5.835 4.903 2.556 1.00 1.79 H ATOM 1162 N ILE A 78 -7.918 0.685 2.934 1.00 0.31 N ATOM 1163 CA ILE A 78 -8.442 0.065 1.738 1.00 0.32 C ATOM 1164 C ILE A 78 -9.444 -1.016 2.112 1.00 0.29 C ATOM 1165 O ILE A 78 -10.544 -1.073 1.546 1.00 0.33 O ATOM 1166 CB ILE A 78 -7.311 -0.499 0.834 1.00 0.39 C ATOM 1167 CG1 ILE A 78 -6.393 0.650 0.373 1.00 0.53 C ATOM 1168 CG2 ILE A 78 -7.887 -1.250 -0.370 1.00 0.44 C ATOM 1169 CD1 ILE A 78 -5.311 0.245 -0.607 1.00 0.63 C ATOM 1170 H ILE A 78 -7.020 0.452 3.257 1.00 0.33 H ATOM 1171 HA ILE A 78 -8.975 0.831 1.194 1.00 0.39 H ATOM 1172 HB ILE A 78 -6.724 -1.188 1.424 1.00 0.40 H ATOM 1173 HG12 ILE A 78 -6.983 1.410 -0.120 1.00 1.11 H ATOM 1174 HG13 ILE A 78 -5.918 1.086 1.242 1.00 1.01 H ATOM 1175 HG21 ILE A 78 -8.474 -2.090 -0.025 1.00 1.18 H ATOM 1176 HG22 ILE A 78 -7.068 -1.623 -0.968 1.00 0.99 H ATOM 1177 HG23 ILE A 78 -8.500 -0.592 -0.970 1.00 1.11 H ATOM 1178 HD11 ILE A 78 -4.724 1.113 -0.864 1.00 1.29 H ATOM 1179 HD12 ILE A 78 -5.764 -0.142 -1.509 1.00 1.27 H ATOM 1180 HD13 ILE A 78 -4.671 -0.504 -0.164 1.00 1.30 H ATOM 1181 N ASN A 79 -9.083 -1.838 3.099 1.00 0.30 N ATOM 1182 CA ASN A 79 -9.958 -2.907 3.584 1.00 0.33 C ATOM 1183 C ASN A 79 -11.273 -2.323 4.085 1.00 0.37 C ATOM 1184 O ASN A 79 -12.356 -2.847 3.799 1.00 0.46 O ATOM 1185 CB ASN A 79 -9.316 -3.718 4.725 1.00 0.42 C ATOM 1186 CG ASN A 79 -8.026 -4.474 4.365 1.00 0.53 C ATOM 1187 OD1 ASN A 79 -7.190 -4.695 5.209 1.00 1.21 O ATOM 1188 ND2 ASN A 79 -7.867 -4.868 3.127 1.00 0.55 N ATOM 1189 H ASN A 79 -8.202 -1.712 3.520 1.00 0.32 H ATOM 1190 HA ASN A 79 -10.161 -3.567 2.754 1.00 0.39 H ATOM 1191 HB2 ASN A 79 -9.106 -3.043 5.540 1.00 0.48 H ATOM 1192 HB3 ASN A 79 -10.047 -4.429 5.068 1.00 0.47 H ATOM 1193 HD21 ASN A 79 -8.549 -4.667 2.464 1.00 1.07 H ATOM 1194 HD22 ASN A 79 -7.039 -5.367 2.947 1.00 0.51 H ATOM 1195 N GLY A 80 -11.167 -1.221 4.803 1.00 0.37 N ATOM 1196 CA GLY A 80 -12.316 -0.544 5.348 1.00 0.46 C ATOM 1197 C GLY A 80 -13.199 0.082 4.294 1.00 0.47 C ATOM 1198 O GLY A 80 -14.414 0.073 4.434 1.00 0.57 O ATOM 1199 H GLY A 80 -10.274 -0.854 5.007 1.00 0.36 H ATOM 1200 HA2 GLY A 80 -12.909 -1.255 5.911 1.00 0.53 H ATOM 1201 HA3 GLY A 80 -11.964 0.227 6.021 1.00 0.49 H ATOM 1202 N ALA A 81 -12.607 0.614 3.218 1.00 0.43 N ATOM 1203 CA ALA A 81 -13.404 1.233 2.165 1.00 0.49 C ATOM 1204 C ALA A 81 -14.219 0.156 1.436 1.00 0.54 C ATOM 1205 O ALA A 81 -15.363 0.377 1.047 1.00 0.68 O ATOM 1206 CB ALA A 81 -12.531 2.016 1.203 1.00 0.49 C ATOM 1207 H ALA A 81 -11.628 0.592 3.122 1.00 0.39 H ATOM 1208 HA ALA A 81 -14.095 1.907 2.651 1.00 0.55 H ATOM 1209 HB1 ALA A 81 -13.167 2.471 0.456 1.00 1.19 H ATOM 1210 HB2 ALA A 81 -11.805 1.363 0.742 1.00 1.14 H ATOM 1211 HB3 ALA A 81 -12.019 2.799 1.743 1.00 1.01 H ATOM 1212 N LEU A 82 -13.615 -1.013 1.283 1.00 0.48 N ATOM 1213 CA LEU A 82 -14.294 -2.187 0.724 1.00 0.57 C ATOM 1214 C LEU A 82 -15.529 -2.581 1.562 1.00 0.70 C ATOM 1215 O LEU A 82 -16.552 -2.987 1.030 1.00 0.87 O ATOM 1216 CB LEU A 82 -13.321 -3.361 0.665 1.00 0.54 C ATOM 1217 CG LEU A 82 -12.165 -3.232 -0.321 1.00 0.55 C ATOM 1218 CD1 LEU A 82 -11.137 -4.328 -0.075 1.00 0.61 C ATOM 1219 CD2 LEU A 82 -12.689 -3.326 -1.746 1.00 0.63 C ATOM 1220 H LEU A 82 -12.666 -1.081 1.529 1.00 0.42 H ATOM 1221 HA LEU A 82 -14.612 -1.951 -0.279 1.00 0.62 H ATOM 1222 HB2 LEU A 82 -12.917 -3.510 1.656 1.00 0.56 H ATOM 1223 HB3 LEU A 82 -13.883 -4.244 0.397 1.00 0.59 H ATOM 1224 HG LEU A 82 -11.696 -2.270 -0.195 1.00 0.57 H ATOM 1225 HD11 LEU A 82 -10.753 -4.242 0.928 1.00 1.16 H ATOM 1226 HD12 LEU A 82 -10.329 -4.220 -0.781 1.00 1.10 H ATOM 1227 HD13 LEU A 82 -11.616 -5.287 -0.203 1.00 1.22 H ATOM 1228 HD21 LEU A 82 -13.404 -2.538 -1.938 1.00 1.12 H ATOM 1229 HD22 LEU A 82 -13.168 -4.285 -1.892 1.00 1.26 H ATOM 1230 HD23 LEU A 82 -11.866 -3.238 -2.444 1.00 1.22 H ATOM 1231 N ALA A 83 -15.429 -2.408 2.869 1.00 0.69 N ATOM 1232 CA ALA A 83 -16.493 -2.781 3.800 1.00 0.87 C ATOM 1233 C ALA A 83 -17.696 -1.833 3.718 1.00 1.01 C ATOM 1234 O ALA A 83 -18.801 -2.170 4.149 1.00 1.25 O ATOM 1235 CB ALA A 83 -15.950 -2.816 5.210 1.00 0.90 C ATOM 1236 H ALA A 83 -14.608 -2.009 3.222 1.00 0.62 H ATOM 1237 HA ALA A 83 -16.818 -3.779 3.540 1.00 0.97 H ATOM 1238 HB1 ALA A 83 -16.720 -3.167 5.880 1.00 1.39 H ATOM 1239 HB2 ALA A 83 -15.660 -1.817 5.498 1.00 1.30 H ATOM 1240 HB3 ALA A 83 -15.097 -3.477 5.251 1.00 1.25 H ATOM 1241 N GLU A 84 -17.484 -0.663 3.149 1.00 0.95 N ATOM 1242 CA GLU A 84 -18.558 0.325 2.978 1.00 1.11 C ATOM 1243 C GLU A 84 -19.454 -0.087 1.800 1.00 1.18 C ATOM 1244 O GLU A 84 -20.591 0.397 1.640 1.00 1.36 O ATOM 1245 CB GLU A 84 -17.962 1.708 2.704 1.00 1.15 C ATOM 1246 CG GLU A 84 -17.063 2.251 3.807 1.00 1.57 C ATOM 1247 CD GLU A 84 -17.795 2.546 5.101 1.00 1.76 C ATOM 1248 OE1 GLU A 84 -18.464 3.584 5.182 1.00 1.86 O ATOM 1249 OE2 GLU A 84 -17.677 1.773 6.064 1.00 2.49 O ATOM 1250 H GLU A 84 -16.577 -0.449 2.836 1.00 0.84 H ATOM 1251 HA GLU A 84 -19.154 0.359 3.879 1.00 1.28 H ATOM 1252 HB2 GLU A 84 -17.368 1.648 1.802 1.00 1.60 H ATOM 1253 HB3 GLU A 84 -18.768 2.410 2.553 1.00 1.38 H ATOM 1254 HG2 GLU A 84 -16.297 1.518 4.010 1.00 2.14 H ATOM 1255 HG3 GLU A 84 -16.601 3.160 3.454 1.00 2.20 H ATOM 1256 N ALA A 85 -18.933 -0.984 0.988 1.00 1.15 N ATOM 1257 CA ALA A 85 -19.624 -1.477 -0.188 1.00 1.34 C ATOM 1258 C ALA A 85 -19.787 -2.997 -0.097 1.00 1.47 C ATOM 1259 O ALA A 85 -19.876 -3.694 -1.126 1.00 1.86 O ATOM 1260 CB ALA A 85 -18.844 -1.096 -1.439 1.00 1.37 C ATOM 1261 H ALA A 85 -18.041 -1.338 1.197 1.00 1.07 H ATOM 1262 HA ALA A 85 -20.597 -1.014 -0.227 1.00 1.54 H ATOM 1263 HB1 ALA A 85 -18.735 -0.022 -1.491 1.00 1.61 H ATOM 1264 HB2 ALA A 85 -19.387 -1.448 -2.305 1.00 1.71 H ATOM 1265 HB3 ALA A 85 -17.869 -1.562 -1.404 1.00 1.82 H ATOM 1266 N ALA A 86 -19.836 -3.493 1.135 1.00 1.53 N ATOM 1267 CA ALA A 86 -20.002 -4.916 1.398 1.00 1.70 C ATOM 1268 C ALA A 86 -21.395 -5.380 1.001 1.00 2.36 C ATOM 1269 O ALA A 86 -21.531 -5.958 -0.093 1.00 2.86 O ATOM 1270 CB ALA A 86 -19.740 -5.234 2.858 1.00 2.39 C ATOM 1271 OXT ALA A 86 -22.349 -5.145 1.770 1.00 3.03 O ATOM 1272 H ALA A 86 -19.770 -2.871 1.891 1.00 1.73 H ATOM 1273 HA ALA A 86 -19.283 -5.449 0.794 1.00 1.65 H ATOM 1274 HB1 ALA A 86 -18.755 -4.892 3.135 1.00 2.96 H ATOM 1275 HB2 ALA A 86 -19.826 -6.303 2.992 1.00 2.75 H ATOM 1276 HB3 ALA A 86 -20.487 -4.738 3.458 1.00 2.71 H TER 1277 ALA A 86 HETATM 1278 P24 SXR A 101 6.421 12.336 -3.767 1.00 1.19 P HETATM 1279 O26 SXR A 101 7.442 12.699 -4.858 1.00 1.72 O HETATM 1280 O23 SXR A 101 6.374 13.222 -2.496 1.00 1.83 O HETATM 1281 O27 SXR A 101 5.001 12.402 -4.402 1.00 1.31 O HETATM 1282 C28 SXR A 101 4.681 11.635 -5.640 1.00 1.24 C HETATM 1283 C29 SXR A 101 3.688 12.480 -6.442 1.00 1.82 C HETATM 1284 C30 SXR A 101 2.455 12.656 -5.573 1.00 2.42 C HETATM 1285 C31 SXR A 101 4.330 13.852 -6.696 1.00 1.85 C HETATM 1286 C32 SXR A 101 3.316 11.810 -7.856 1.00 2.74 C HETATM 1287 O33 SXR A 101 4.475 11.810 -8.717 1.00 3.00 O HETATM 1288 C34 SXR A 101 2.232 12.649 -8.558 1.00 3.44 C HETATM 1289 O35 SXR A 101 1.035 12.440 -8.389 1.00 3.88 O HETATM 1290 N36 SXR A 101 2.682 13.617 -9.330 1.00 3.90 N HETATM 1291 C37 SXR A 101 1.839 14.566 -10.063 1.00 4.60 C HETATM 1292 C38 SXR A 101 2.253 16.023 -9.778 1.00 4.73 C HETATM 1293 C39 SXR A 101 2.149 16.442 -8.292 1.00 4.02 C HETATM 1294 O40 SXR A 101 2.753 17.446 -7.857 1.00 4.42 O HETATM 1295 N41 SXR A 101 1.414 15.651 -7.520 1.00 3.33 N HETATM 1296 C42 SXR A 101 1.201 15.846 -6.090 1.00 2.88 C HETATM 1297 C43 SXR A 101 -0.172 16.409 -5.799 1.00 2.85 C HETATM 1298 S1 SXR A 101 -1.352 15.523 -6.695 1.00 3.15 S HETATM 1299 C11 SXR A 101 0.703 10.421 -1.480 1.00 2.09 C HETATM 1300 C10 SXR A 101 1.588 9.579 -0.802 1.00 2.05 C HETATM 1301 C9 SXR A 101 1.264 8.233 -0.618 1.00 1.91 C HETATM 1302 C8 SXR A 101 0.063 7.730 -1.118 1.00 2.19 C HETATM 1303 C7 SXR A 101 -0.810 8.571 -1.794 1.00 2.18 C HETATM 1304 C6 SXR A 101 -0.508 9.922 -1.988 1.00 1.95 C HETATM 1305 C5 SXR A 101 -1.460 10.810 -2.723 1.00 2.57 C HETATM 1306 C4 SXR A 101 -0.851 11.528 -3.891 1.00 2.29 C HETATM 1307 C3 SXR A 101 -1.825 11.858 -5.016 1.00 2.88 C HETATM 1308 O3 SXR A 101 -2.885 11.245 -5.131 1.00 3.69 O HETATM 1309 C2 SXR A 101 -1.482 12.938 -5.988 1.00 2.88 C HETATM 1310 C1 SXR A 101 -1.781 14.333 -5.513 1.00 2.84 C HETATM 1311 H28A SXR A 101 5.585 11.532 -6.215 1.00 1.41 H HETATM 1312 H28B SXR A 101 4.271 10.654 -5.396 1.00 0.99 H HETATM 1313 H30A SXR A 101 2.587 12.086 -4.663 1.00 2.99 H HETATM 1314 H30B SXR A 101 1.586 12.312 -6.116 1.00 2.62 H HETATM 1315 H30C SXR A 101 2.334 13.702 -5.332 1.00 2.79 H HETATM 1316 H31A SXR A 101 4.832 13.850 -7.654 1.00 2.21 H HETATM 1317 H31B SXR A 101 5.038 14.057 -5.910 1.00 2.37 H HETATM 1318 H31C SXR A 101 3.559 14.607 -6.688 1.00 1.95 H HETATM 1319 H32A SXR A 101 2.969 10.798 -7.703 1.00 3.10 H HETATM 1320 H33A SXR A 101 4.186 11.450 -9.565 1.00 3.40 H HETATM 1321 H36A SXR A 101 3.662 13.690 -9.366 1.00 3.96 H HETATM 1322 H37A SXR A 101 1.940 14.377 -11.123 1.00 4.70 H HETATM 1323 H37B SXR A 101 0.813 14.431 -9.753 1.00 5.21 H HETATM 1324 H38A SXR A 101 3.280 16.155 -10.081 1.00 5.22 H HETATM 1325 H38B SXR A 101 1.630 16.683 -10.363 1.00 5.25 H HETATM 1326 H41A SXR A 101 0.983 14.864 -7.920 1.00 3.43 H HETATM 1327 H42A SXR A 101 1.244 14.864 -5.637 1.00 3.18 H HETATM 1328 H42B SXR A 101 1.988 16.452 -5.671 1.00 2.75 H HETATM 1329 H43A SXR A 101 -0.199 17.429 -6.150 1.00 3.20 H HETATM 1330 H43B SXR A 101 -0.396 16.356 -4.744 1.00 2.98 H HETATM 1331 H11A SXR A 101 0.954 11.463 -1.622 1.00 2.81 H HETATM 1332 H10A SXR A 101 2.518 9.962 -0.412 1.00 2.73 H HETATM 1333 H9A SXR A 101 1.941 7.578 -0.092 1.00 2.32 H HETATM 1334 H8A SXR A 101 -0.203 6.694 -0.984 1.00 2.94 H HETATM 1335 H7A SXR A 101 -1.738 8.185 -2.182 1.00 2.89 H HETATM 1336 H5A SXR A 101 -2.534 10.738 -2.701 1.00 3.45 H HETATM 1337 H5B SXR A 101 -1.507 11.453 -1.841 1.00 2.83 H HETATM 1338 H4A SXR A 101 0.055 12.104 -3.872 1.00 2.15 H HETATM 1339 H4B SXR A 101 -0.249 10.643 -4.111 1.00 2.47 H HETATM 1340 H2A SXR A 101 -0.753 12.871 -6.777 1.00 3.20 H HETATM 1341 H2B SXR A 101 -2.214 12.573 -6.711 1.00 3.39 H HETATM 1342 H1A SXR A 101 -2.428 14.647 -4.715 1.00 3.11 H HETATM 1343 H1B SXR A 101 -0.962 14.250 -4.797 1.00 2.74 H