ATOM 1 N MET A 1 -18.521 -11.737 -4.008 1.00 3.07 N ATOM 2 CA MET A 1 -17.569 -10.836 -4.658 1.00 2.76 C ATOM 3 C MET A 1 -16.665 -10.150 -3.624 1.00 2.34 C ATOM 4 O MET A 1 -16.083 -9.102 -3.889 1.00 2.38 O ATOM 5 CB MET A 1 -18.286 -9.813 -5.574 1.00 2.93 C ATOM 6 CG MET A 1 -19.325 -8.926 -4.894 1.00 3.33 C ATOM 7 SD MET A 1 -20.176 -7.841 -6.069 1.00 4.18 S ATOM 8 CE MET A 1 -20.899 -9.035 -7.203 1.00 4.50 C ATOM 9 H1 MET A 1 -19.027 -11.216 -3.253 1.00 3.22 H ATOM 10 H2 MET A 1 -18.043 -12.552 -3.571 1.00 3.51 H ATOM 11 H3 MET A 1 -19.252 -12.074 -4.671 1.00 3.36 H ATOM 12 HA MET A 1 -16.924 -11.461 -5.261 1.00 3.37 H ATOM 13 HB2 MET A 1 -17.540 -9.162 -6.004 1.00 3.26 H ATOM 14 HB3 MET A 1 -18.770 -10.346 -6.380 1.00 3.26 H ATOM 15 HG2 MET A 1 -20.058 -9.541 -4.389 1.00 3.63 H ATOM 16 HG3 MET A 1 -18.819 -8.296 -4.174 1.00 3.51 H ATOM 17 HE1 MET A 1 -21.433 -8.521 -7.988 1.00 4.67 H ATOM 18 HE2 MET A 1 -21.575 -9.690 -6.674 1.00 4.75 H ATOM 19 HE3 MET A 1 -20.100 -9.618 -7.636 1.00 4.79 H ATOM 20 N ALA A 2 -16.504 -10.779 -2.468 1.00 2.23 N ATOM 21 CA ALA A 2 -15.676 -10.252 -1.420 1.00 1.97 C ATOM 22 C ALA A 2 -14.264 -10.786 -1.599 1.00 1.62 C ATOM 23 O ALA A 2 -14.037 -11.994 -1.561 1.00 1.83 O ATOM 24 CB ALA A 2 -16.233 -10.648 -0.055 1.00 2.32 C ATOM 25 H ALA A 2 -16.907 -11.661 -2.302 1.00 2.55 H ATOM 26 HA ALA A 2 -15.659 -9.175 -1.497 1.00 2.02 H ATOM 27 HB1 ALA A 2 -17.233 -10.267 0.066 1.00 2.39 H ATOM 28 HB2 ALA A 2 -15.605 -10.243 0.725 1.00 2.57 H ATOM 29 HB3 ALA A 2 -16.255 -11.725 0.019 1.00 2.91 H ATOM 30 N THR A 3 -13.344 -9.909 -1.862 1.00 1.33 N ATOM 31 CA THR A 3 -11.954 -10.275 -2.043 1.00 1.10 C ATOM 32 C THR A 3 -11.070 -9.283 -1.289 1.00 0.90 C ATOM 33 O THR A 3 -10.794 -8.185 -1.764 1.00 0.87 O ATOM 34 CB THR A 3 -11.595 -10.273 -3.552 1.00 1.27 C ATOM 35 OG1 THR A 3 -12.517 -11.128 -4.261 1.00 1.70 O ATOM 36 CG2 THR A 3 -10.173 -10.788 -3.782 1.00 1.78 C ATOM 37 H THR A 3 -13.589 -8.963 -1.945 1.00 1.46 H ATOM 38 HA THR A 3 -11.802 -11.265 -1.640 1.00 1.16 H ATOM 39 HB THR A 3 -11.675 -9.265 -3.933 1.00 1.61 H ATOM 40 HG1 THR A 3 -13.306 -11.244 -3.717 1.00 2.16 H ATOM 41 HG21 THR A 3 -9.966 -10.762 -4.842 1.00 2.24 H ATOM 42 HG22 THR A 3 -10.081 -11.800 -3.413 1.00 2.32 H ATOM 43 HG23 THR A 3 -9.465 -10.157 -3.265 1.00 2.10 H ATOM 44 N LEU A 4 -10.727 -9.630 -0.066 1.00 0.86 N ATOM 45 CA LEU A 4 -9.895 -8.771 0.751 1.00 0.72 C ATOM 46 C LEU A 4 -8.442 -9.045 0.459 1.00 0.67 C ATOM 47 O LEU A 4 -8.049 -10.192 0.260 1.00 0.83 O ATOM 48 CB LEU A 4 -10.133 -8.954 2.284 1.00 0.71 C ATOM 49 CG LEU A 4 -11.522 -8.625 2.866 1.00 0.87 C ATOM 50 CD1 LEU A 4 -11.991 -7.230 2.466 1.00 0.80 C ATOM 51 CD2 LEU A 4 -12.551 -9.692 2.526 1.00 1.75 C ATOM 52 H LEU A 4 -11.007 -10.499 0.297 1.00 1.00 H ATOM 53 HA LEU A 4 -10.119 -7.750 0.480 1.00 0.73 H ATOM 54 HB2 LEU A 4 -9.915 -9.979 2.542 1.00 0.79 H ATOM 55 HB3 LEU A 4 -9.421 -8.328 2.801 1.00 0.64 H ATOM 56 HG LEU A 4 -11.411 -8.594 3.940 1.00 1.34 H ATOM 57 HD11 LEU A 4 -11.278 -6.500 2.814 1.00 1.23 H ATOM 58 HD12 LEU A 4 -12.956 -7.036 2.908 1.00 1.38 H ATOM 59 HD13 LEU A 4 -12.082 -7.162 1.394 1.00 1.46 H ATOM 60 HD21 LEU A 4 -12.216 -10.631 2.935 1.00 2.19 H ATOM 61 HD22 LEU A 4 -12.657 -9.766 1.455 1.00 2.26 H ATOM 62 HD23 LEU A 4 -13.495 -9.415 2.965 1.00 2.25 H ATOM 63 N LEU A 5 -7.652 -8.010 0.429 1.00 0.55 N ATOM 64 CA LEU A 5 -6.240 -8.169 0.268 1.00 0.51 C ATOM 65 C LEU A 5 -5.639 -8.179 1.645 1.00 0.46 C ATOM 66 O LEU A 5 -5.940 -7.297 2.457 1.00 0.50 O ATOM 67 CB LEU A 5 -5.586 -7.073 -0.597 1.00 0.53 C ATOM 68 CG LEU A 5 -5.711 -5.620 -0.118 1.00 0.62 C ATOM 69 CD1 LEU A 5 -4.456 -4.862 -0.496 1.00 0.66 C ATOM 70 CD2 LEU A 5 -6.910 -4.941 -0.767 1.00 0.95 C ATOM 71 H LEU A 5 -8.011 -7.110 0.558 1.00 0.61 H ATOM 72 HA LEU A 5 -6.085 -9.140 -0.181 1.00 0.58 H ATOM 73 HB2 LEU A 5 -4.531 -7.294 -0.670 1.00 0.53 H ATOM 74 HB3 LEU A 5 -5.992 -7.120 -1.600 1.00 0.60 H ATOM 75 HG LEU A 5 -5.825 -5.584 0.954 1.00 0.90 H ATOM 76 HD11 LEU A 5 -4.342 -4.877 -1.569 1.00 1.08 H ATOM 77 HD12 LEU A 5 -3.606 -5.353 -0.044 1.00 1.41 H ATOM 78 HD13 LEU A 5 -4.524 -3.842 -0.142 1.00 1.22 H ATOM 79 HD21 LEU A 5 -7.835 -5.443 -0.525 1.00 1.46 H ATOM 80 HD22 LEU A 5 -6.769 -4.932 -1.838 1.00 1.57 H ATOM 81 HD23 LEU A 5 -6.956 -3.921 -0.415 1.00 1.37 H ATOM 82 N THR A 6 -4.872 -9.179 1.937 1.00 0.47 N ATOM 83 CA THR A 6 -4.266 -9.280 3.233 1.00 0.49 C ATOM 84 C THR A 6 -2.830 -8.746 3.231 1.00 0.40 C ATOM 85 O THR A 6 -2.365 -8.211 2.216 1.00 0.38 O ATOM 86 CB THR A 6 -4.357 -10.719 3.802 1.00 0.70 C ATOM 87 OG1 THR A 6 -3.974 -11.670 2.785 1.00 0.82 O ATOM 88 CG2 THR A 6 -5.777 -11.023 4.276 1.00 0.93 C ATOM 89 H THR A 6 -4.703 -9.876 1.266 1.00 0.54 H ATOM 90 HA THR A 6 -4.833 -8.626 3.882 1.00 0.55 H ATOM 91 HB THR A 6 -3.681 -10.805 4.642 1.00 0.73 H ATOM 92 HG1 THR A 6 -4.681 -11.712 2.119 1.00 1.33 H ATOM 93 HG21 THR A 6 -6.049 -10.329 5.059 1.00 1.33 H ATOM 94 HG22 THR A 6 -5.822 -12.031 4.661 1.00 1.32 H ATOM 95 HG23 THR A 6 -6.473 -10.931 3.454 1.00 1.55 H ATOM 96 N THR A 7 -2.123 -8.924 4.338 1.00 0.44 N ATOM 97 CA THR A 7 -0.781 -8.413 4.500 1.00 0.42 C ATOM 98 C THR A 7 0.193 -9.016 3.462 1.00 0.37 C ATOM 99 O THR A 7 1.095 -8.327 2.982 1.00 0.39 O ATOM 100 CB THR A 7 -0.309 -8.702 5.939 1.00 0.50 C ATOM 101 OG1 THR A 7 -1.418 -8.444 6.825 1.00 0.58 O ATOM 102 CG2 THR A 7 0.843 -7.774 6.306 1.00 0.54 C ATOM 103 H THR A 7 -2.499 -9.372 5.126 1.00 0.52 H ATOM 104 HA THR A 7 -0.809 -7.339 4.366 1.00 0.44 H ATOM 105 HB THR A 7 0.003 -9.733 6.022 1.00 0.53 H ATOM 106 HG1 THR A 7 -1.133 -8.026 7.648 1.00 0.94 H ATOM 107 HG21 THR A 7 1.157 -7.953 7.325 1.00 1.06 H ATOM 108 HG22 THR A 7 0.520 -6.746 6.198 1.00 1.24 H ATOM 109 HG23 THR A 7 1.673 -7.950 5.635 1.00 1.08 H ATOM 110 N ASP A 8 -0.040 -10.280 3.083 1.00 0.41 N ATOM 111 CA ASP A 8 0.786 -10.956 2.064 1.00 0.46 C ATOM 112 C ASP A 8 0.667 -10.269 0.723 1.00 0.42 C ATOM 113 O ASP A 8 1.670 -10.069 0.027 1.00 0.47 O ATOM 114 CB ASP A 8 0.412 -12.431 1.910 1.00 0.62 C ATOM 115 CG ASP A 8 0.826 -13.294 3.083 1.00 1.41 C ATOM 116 OD1 ASP A 8 0.125 -13.280 4.137 1.00 2.01 O ATOM 117 OD2 ASP A 8 1.856 -13.981 2.979 1.00 1.98 O ATOM 118 H ASP A 8 -0.768 -10.789 3.505 1.00 0.48 H ATOM 119 HA ASP A 8 1.812 -10.890 2.392 1.00 0.52 H ATOM 120 HB2 ASP A 8 -0.659 -12.506 1.797 1.00 0.86 H ATOM 121 HB3 ASP A 8 0.876 -12.812 1.011 1.00 1.09 H ATOM 122 N ASP A 9 -0.551 -9.860 0.385 1.00 0.41 N ATOM 123 CA ASP A 9 -0.799 -9.201 -0.896 1.00 0.46 C ATOM 124 C ASP A 9 -0.143 -7.857 -0.873 1.00 0.40 C ATOM 125 O ASP A 9 0.574 -7.505 -1.785 1.00 0.46 O ATOM 126 CB ASP A 9 -2.296 -9.017 -1.192 1.00 0.54 C ATOM 127 CG ASP A 9 -2.549 -8.543 -2.625 1.00 0.98 C ATOM 128 OD1 ASP A 9 -2.450 -7.351 -2.906 1.00 1.83 O ATOM 129 OD2 ASP A 9 -2.836 -9.397 -3.502 1.00 1.21 O ATOM 130 H ASP A 9 -1.285 -9.973 1.024 1.00 0.43 H ATOM 131 HA ASP A 9 -0.346 -9.803 -1.670 1.00 0.53 H ATOM 132 HB2 ASP A 9 -2.847 -9.927 -1.015 1.00 1.16 H ATOM 133 HB3 ASP A 9 -2.683 -8.267 -0.516 1.00 0.89 H ATOM 134 N LEU A 10 -0.344 -7.143 0.233 1.00 0.36 N ATOM 135 CA LEU A 10 0.216 -5.801 0.441 1.00 0.35 C ATOM 136 C LEU A 10 1.750 -5.804 0.282 1.00 0.33 C ATOM 137 O LEU A 10 2.319 -4.930 -0.378 1.00 0.36 O ATOM 138 CB LEU A 10 -0.182 -5.287 1.834 1.00 0.37 C ATOM 139 CG LEU A 10 0.221 -3.855 2.182 1.00 0.41 C ATOM 140 CD1 LEU A 10 -0.472 -2.866 1.267 1.00 0.51 C ATOM 141 CD2 LEU A 10 -0.102 -3.552 3.636 1.00 0.48 C ATOM 142 H LEU A 10 -0.924 -7.524 0.927 1.00 0.35 H ATOM 143 HA LEU A 10 -0.205 -5.151 -0.310 1.00 0.39 H ATOM 144 HB2 LEU A 10 -1.257 -5.362 1.915 1.00 0.42 H ATOM 145 HB3 LEU A 10 0.257 -5.946 2.571 1.00 0.36 H ATOM 146 HG LEU A 10 1.286 -3.745 2.044 1.00 0.39 H ATOM 147 HD11 LEU A 10 -1.543 -2.970 1.364 1.00 1.18 H ATOM 148 HD12 LEU A 10 -0.177 -3.054 0.246 1.00 0.95 H ATOM 149 HD13 LEU A 10 -0.179 -1.867 1.549 1.00 1.26 H ATOM 150 HD21 LEU A 10 -1.161 -3.678 3.808 1.00 1.12 H ATOM 151 HD22 LEU A 10 0.178 -2.533 3.856 1.00 1.06 H ATOM 152 HD23 LEU A 10 0.450 -4.221 4.280 1.00 1.05 H ATOM 153 N ARG A 11 2.392 -6.808 0.856 1.00 0.33 N ATOM 154 CA ARG A 11 3.833 -6.971 0.758 1.00 0.37 C ATOM 155 C ARG A 11 4.259 -7.191 -0.695 1.00 0.39 C ATOM 156 O ARG A 11 5.261 -6.637 -1.151 1.00 0.45 O ATOM 157 CB ARG A 11 4.287 -8.160 1.619 1.00 0.45 C ATOM 158 CG ARG A 11 5.783 -8.453 1.570 1.00 0.72 C ATOM 159 CD ARG A 11 6.142 -9.660 2.426 1.00 0.63 C ATOM 160 NE ARG A 11 5.421 -10.869 1.997 1.00 1.12 N ATOM 161 CZ ARG A 11 5.038 -11.871 2.807 1.00 1.36 C ATOM 162 NH1 ARG A 11 5.482 -11.939 4.070 1.00 1.47 N ATOM 163 NH2 ARG A 11 4.278 -12.832 2.326 1.00 2.27 N ATOM 164 H ARG A 11 1.876 -7.466 1.371 1.00 0.33 H ATOM 165 HA ARG A 11 4.300 -6.073 1.134 1.00 0.41 H ATOM 166 HB2 ARG A 11 4.013 -7.972 2.647 1.00 0.92 H ATOM 167 HB3 ARG A 11 3.765 -9.044 1.287 1.00 1.06 H ATOM 168 HG2 ARG A 11 6.037 -8.681 0.545 1.00 1.30 H ATOM 169 HG3 ARG A 11 6.332 -7.586 1.907 1.00 1.20 H ATOM 170 HD2 ARG A 11 7.203 -9.842 2.352 1.00 1.17 H ATOM 171 HD3 ARG A 11 5.896 -9.461 3.458 1.00 1.14 H ATOM 172 HE ARG A 11 5.171 -10.886 1.047 1.00 1.86 H ATOM 173 HH11 ARG A 11 6.114 -11.259 4.466 1.00 1.69 H ATOM 174 HH12 ARG A 11 5.231 -12.694 4.688 1.00 1.97 H ATOM 175 HH21 ARG A 11 4.013 -12.844 1.354 1.00 2.91 H ATOM 176 HH22 ARG A 11 3.853 -13.555 2.882 1.00 2.56 H ATOM 177 N ARG A 12 3.486 -7.982 -1.422 1.00 0.40 N ATOM 178 CA ARG A 12 3.821 -8.311 -2.795 1.00 0.48 C ATOM 179 C ARG A 12 3.573 -7.120 -3.680 1.00 0.47 C ATOM 180 O ARG A 12 4.382 -6.798 -4.517 1.00 0.50 O ATOM 181 CB ARG A 12 2.980 -9.452 -3.299 1.00 0.56 C ATOM 182 CG ARG A 12 3.471 -10.062 -4.626 1.00 0.94 C ATOM 183 CD ARG A 12 2.385 -10.881 -5.277 1.00 1.18 C ATOM 184 NE ARG A 12 1.242 -10.024 -5.580 1.00 1.76 N ATOM 185 CZ ARG A 12 -0.014 -10.256 -5.220 1.00 2.29 C ATOM 186 NH1 ARG A 12 -0.404 -11.467 -4.800 1.00 2.31 N ATOM 187 NH2 ARG A 12 -0.885 -9.293 -5.360 1.00 3.30 N ATOM 188 H ARG A 12 2.658 -8.338 -1.024 1.00 0.37 H ATOM 189 HA ARG A 12 4.862 -8.586 -2.843 1.00 0.54 H ATOM 190 HB2 ARG A 12 2.894 -10.193 -2.523 1.00 0.67 H ATOM 191 HB3 ARG A 12 1.987 -9.063 -3.463 1.00 0.85 H ATOM 192 HG2 ARG A 12 3.753 -9.273 -5.309 1.00 1.27 H ATOM 193 HG3 ARG A 12 4.316 -10.704 -4.428 1.00 1.35 H ATOM 194 HD2 ARG A 12 2.767 -11.318 -6.189 1.00 1.87 H ATOM 195 HD3 ARG A 12 2.068 -11.656 -4.595 1.00 1.53 H ATOM 196 HE ARG A 12 1.444 -9.151 -5.997 1.00 2.26 H ATOM 197 HH11 ARG A 12 0.230 -12.240 -4.734 1.00 2.24 H ATOM 198 HH12 ARG A 12 -1.360 -11.640 -4.530 1.00 2.84 H ATOM 199 HH21 ARG A 12 -0.572 -8.417 -5.744 1.00 3.81 H ATOM 200 HH22 ARG A 12 -1.827 -9.344 -4.995 1.00 3.77 H ATOM 201 N ALA A 13 2.441 -6.497 -3.468 1.00 0.47 N ATOM 202 CA ALA A 13 1.994 -5.332 -4.227 1.00 0.53 C ATOM 203 C ALA A 13 3.031 -4.223 -4.235 1.00 0.46 C ATOM 204 O ALA A 13 3.238 -3.555 -5.252 1.00 0.48 O ATOM 205 CB ALA A 13 0.684 -4.809 -3.675 1.00 0.63 C ATOM 206 H ALA A 13 1.848 -6.873 -2.775 1.00 0.47 H ATOM 207 HA ALA A 13 1.827 -5.653 -5.244 1.00 0.61 H ATOM 208 HB1 ALA A 13 0.329 -3.988 -4.279 1.00 1.11 H ATOM 209 HB2 ALA A 13 0.834 -4.449 -2.669 1.00 1.26 H ATOM 210 HB3 ALA A 13 -0.054 -5.597 -3.671 1.00 1.21 H ATOM 211 N LEU A 14 3.682 -4.037 -3.106 1.00 0.42 N ATOM 212 CA LEU A 14 4.728 -3.036 -2.962 1.00 0.39 C ATOM 213 C LEU A 14 5.894 -3.387 -3.900 1.00 0.40 C ATOM 214 O LEU A 14 6.455 -2.527 -4.592 1.00 0.46 O ATOM 215 CB LEU A 14 5.197 -3.024 -1.497 1.00 0.45 C ATOM 216 CG LEU A 14 6.083 -1.860 -1.046 1.00 0.54 C ATOM 217 CD1 LEU A 14 5.330 -0.542 -1.114 1.00 0.44 C ATOM 218 CD2 LEU A 14 6.591 -2.110 0.366 1.00 1.00 C ATOM 219 H LEU A 14 3.425 -4.582 -2.331 1.00 0.44 H ATOM 220 HA LEU A 14 4.324 -2.071 -3.225 1.00 0.41 H ATOM 221 HB2 LEU A 14 4.322 -3.061 -0.865 1.00 0.73 H ATOM 222 HB3 LEU A 14 5.760 -3.930 -1.323 1.00 0.77 H ATOM 223 HG LEU A 14 6.936 -1.793 -1.703 1.00 0.97 H ATOM 224 HD11 LEU A 14 5.000 -0.376 -2.131 1.00 1.04 H ATOM 225 HD12 LEU A 14 5.987 0.264 -0.816 1.00 1.18 H ATOM 226 HD13 LEU A 14 4.470 -0.579 -0.457 1.00 1.11 H ATOM 227 HD21 LEU A 14 7.211 -1.278 0.674 1.00 1.59 H ATOM 228 HD22 LEU A 14 7.170 -3.023 0.385 1.00 1.48 H ATOM 229 HD23 LEU A 14 5.764 -2.217 1.051 1.00 1.54 H ATOM 230 N VAL A 15 6.199 -4.679 -3.959 1.00 0.44 N ATOM 231 CA VAL A 15 7.252 -5.204 -4.797 1.00 0.53 C ATOM 232 C VAL A 15 6.822 -5.205 -6.275 1.00 0.55 C ATOM 233 O VAL A 15 7.646 -5.025 -7.152 1.00 0.64 O ATOM 234 CB VAL A 15 7.670 -6.641 -4.345 1.00 0.61 C ATOM 235 CG1 VAL A 15 8.760 -7.224 -5.241 1.00 0.74 C ATOM 236 CG2 VAL A 15 8.131 -6.624 -2.889 1.00 0.64 C ATOM 237 H VAL A 15 5.686 -5.313 -3.417 1.00 0.47 H ATOM 238 HA VAL A 15 8.108 -4.552 -4.705 1.00 0.60 H ATOM 239 HB VAL A 15 6.801 -7.280 -4.415 1.00 0.63 H ATOM 240 HG11 VAL A 15 9.635 -6.595 -5.214 1.00 1.14 H ATOM 241 HG12 VAL A 15 8.375 -7.277 -6.249 1.00 1.39 H ATOM 242 HG13 VAL A 15 9.009 -8.218 -4.901 1.00 1.29 H ATOM 243 HG21 VAL A 15 8.982 -5.968 -2.787 1.00 1.14 H ATOM 244 HG22 VAL A 15 8.399 -7.622 -2.571 1.00 1.34 H ATOM 245 HG23 VAL A 15 7.324 -6.258 -2.271 1.00 1.13 H ATOM 246 N GLU A 16 5.522 -5.347 -6.527 1.00 0.59 N ATOM 247 CA GLU A 16 4.965 -5.334 -7.893 1.00 0.69 C ATOM 248 C GLU A 16 5.217 -3.998 -8.575 1.00 0.65 C ATOM 249 O GLU A 16 5.275 -3.912 -9.805 1.00 0.77 O ATOM 250 CB GLU A 16 3.450 -5.645 -7.897 1.00 0.89 C ATOM 251 CG GLU A 16 3.090 -7.053 -7.438 1.00 1.11 C ATOM 252 CD GLU A 16 1.604 -7.341 -7.512 1.00 1.54 C ATOM 253 OE1 GLU A 16 1.104 -7.622 -8.614 1.00 1.95 O ATOM 254 OE2 GLU A 16 0.927 -7.352 -6.467 1.00 2.18 O ATOM 255 H GLU A 16 4.920 -5.487 -5.762 1.00 0.60 H ATOM 256 HA GLU A 16 5.476 -6.097 -8.461 1.00 0.80 H ATOM 257 HB2 GLU A 16 2.956 -4.947 -7.237 1.00 0.91 H ATOM 258 HB3 GLU A 16 3.068 -5.502 -8.897 1.00 0.98 H ATOM 259 HG2 GLU A 16 3.603 -7.761 -8.074 1.00 1.44 H ATOM 260 HG3 GLU A 16 3.421 -7.182 -6.418 1.00 1.45 H ATOM 261 N SER A 17 5.376 -2.970 -7.775 1.00 0.59 N ATOM 262 CA SER A 17 5.631 -1.659 -8.282 1.00 0.64 C ATOM 263 C SER A 17 7.107 -1.544 -8.726 1.00 0.74 C ATOM 264 O SER A 17 7.403 -1.284 -9.904 1.00 1.04 O ATOM 265 CB SER A 17 5.285 -0.623 -7.207 1.00 0.68 C ATOM 266 OG SER A 17 5.419 0.688 -7.689 1.00 1.27 O ATOM 267 H SER A 17 5.307 -3.111 -6.807 1.00 0.58 H ATOM 268 HA SER A 17 4.995 -1.505 -9.139 1.00 0.75 H ATOM 269 HB2 SER A 17 4.263 -0.765 -6.889 1.00 1.10 H ATOM 270 HB3 SER A 17 5.942 -0.746 -6.358 1.00 1.16 H ATOM 271 HG SER A 17 5.577 1.274 -6.944 1.00 1.65 H ATOM 272 N ALA A 18 8.018 -1.806 -7.802 1.00 0.70 N ATOM 273 CA ALA A 18 9.443 -1.664 -8.064 1.00 0.87 C ATOM 274 C ALA A 18 9.976 -2.761 -8.994 1.00 1.05 C ATOM 275 O ALA A 18 10.773 -2.487 -9.902 1.00 1.57 O ATOM 276 CB ALA A 18 10.217 -1.643 -6.756 1.00 0.95 C ATOM 277 H ALA A 18 7.726 -2.111 -6.917 1.00 0.73 H ATOM 278 HA ALA A 18 9.589 -0.711 -8.555 1.00 1.09 H ATOM 279 HB1 ALA A 18 11.257 -1.450 -6.964 1.00 1.36 H ATOM 280 HB2 ALA A 18 10.115 -2.595 -6.255 1.00 1.48 H ATOM 281 HB3 ALA A 18 9.835 -0.857 -6.124 1.00 1.41 H ATOM 282 N GLY A 19 9.538 -3.976 -8.765 1.00 0.98 N ATOM 283 CA GLY A 19 9.943 -5.113 -9.558 1.00 1.32 C ATOM 284 C GLY A 19 11.396 -5.508 -9.370 1.00 1.47 C ATOM 285 O GLY A 19 11.718 -6.322 -8.514 1.00 1.85 O ATOM 286 H GLY A 19 8.892 -4.130 -8.039 1.00 1.01 H ATOM 287 HA2 GLY A 19 9.334 -5.965 -9.296 1.00 1.77 H ATOM 288 HA3 GLY A 19 9.780 -4.889 -10.598 1.00 1.79 H ATOM 289 N GLU A 20 12.261 -4.895 -10.153 1.00 1.96 N ATOM 290 CA GLU A 20 13.693 -5.183 -10.161 1.00 2.68 C ATOM 291 C GLU A 20 14.396 -4.547 -8.981 1.00 2.91 C ATOM 292 O GLU A 20 15.521 -4.899 -8.643 1.00 3.66 O ATOM 293 CB GLU A 20 14.319 -4.680 -11.457 1.00 3.52 C ATOM 294 CG GLU A 20 13.792 -5.372 -12.708 1.00 4.20 C ATOM 295 CD GLU A 20 14.093 -6.848 -12.699 1.00 4.87 C ATOM 296 OE1 GLU A 20 15.237 -7.230 -13.001 1.00 5.31 O ATOM 297 OE2 GLU A 20 13.178 -7.645 -12.380 1.00 5.27 O ATOM 298 H GLU A 20 11.894 -4.215 -10.756 1.00 2.18 H ATOM 299 HA GLU A 20 13.821 -6.254 -10.120 1.00 2.87 H ATOM 300 HB2 GLU A 20 14.144 -3.619 -11.546 1.00 3.77 H ATOM 301 HB3 GLU A 20 15.381 -4.852 -11.392 1.00 3.84 H ATOM 302 HG2 GLU A 20 12.721 -5.243 -12.759 1.00 4.47 H ATOM 303 HG3 GLU A 20 14.255 -4.926 -13.577 1.00 4.44 H ATOM 304 N THR A 21 13.751 -3.601 -8.379 1.00 2.73 N ATOM 305 CA THR A 21 14.302 -2.938 -7.242 1.00 3.25 C ATOM 306 C THR A 21 13.881 -3.684 -5.976 1.00 3.14 C ATOM 307 O THR A 21 12.795 -3.451 -5.438 1.00 3.43 O ATOM 308 CB THR A 21 13.822 -1.479 -7.201 1.00 3.93 C ATOM 309 OG1 THR A 21 14.015 -0.914 -8.504 1.00 4.30 O ATOM 310 CG2 THR A 21 14.642 -0.669 -6.193 1.00 4.40 C ATOM 311 H THR A 21 12.859 -3.353 -8.698 1.00 2.62 H ATOM 312 HA THR A 21 15.379 -2.955 -7.328 1.00 3.74 H ATOM 313 HB THR A 21 12.777 -1.437 -6.932 1.00 4.40 H ATOM 314 HG1 THR A 21 14.536 -1.532 -9.024 1.00 4.42 H ATOM 315 HG21 THR A 21 14.276 0.346 -6.169 1.00 4.75 H ATOM 316 HG22 THR A 21 15.677 -0.667 -6.503 1.00 4.61 H ATOM 317 HG23 THR A 21 14.552 -1.110 -5.211 1.00 4.66 H ATOM 318 N ASP A 22 14.685 -4.684 -5.626 1.00 3.24 N ATOM 319 CA ASP A 22 14.506 -5.483 -4.405 1.00 3.46 C ATOM 320 C ASP A 22 14.554 -4.548 -3.197 1.00 3.15 C ATOM 321 O ASP A 22 15.602 -3.986 -2.881 1.00 3.71 O ATOM 322 CB ASP A 22 15.613 -6.536 -4.341 1.00 4.08 C ATOM 323 CG ASP A 22 15.533 -7.462 -3.151 1.00 4.82 C ATOM 324 OD1 ASP A 22 14.566 -8.256 -3.064 1.00 5.44 O ATOM 325 OD2 ASP A 22 16.384 -7.358 -2.243 1.00 5.14 O ATOM 326 H ASP A 22 15.435 -4.896 -6.223 1.00 3.52 H ATOM 327 HA ASP A 22 13.542 -5.967 -4.453 1.00 3.87 H ATOM 328 HB2 ASP A 22 15.572 -7.143 -5.232 1.00 4.24 H ATOM 329 HB3 ASP A 22 16.563 -6.026 -4.312 1.00 4.35 H ATOM 330 N GLY A 23 13.422 -4.360 -2.565 1.00 2.69 N ATOM 331 CA GLY A 23 13.286 -3.331 -1.560 1.00 2.70 C ATOM 332 C GLY A 23 13.449 -3.778 -0.122 1.00 2.24 C ATOM 333 O GLY A 23 12.548 -4.399 0.438 1.00 2.70 O ATOM 334 H GLY A 23 12.652 -4.924 -2.777 1.00 2.74 H ATOM 335 HA2 GLY A 23 14.029 -2.574 -1.754 1.00 3.05 H ATOM 336 HA3 GLY A 23 12.308 -2.885 -1.685 1.00 3.22 H ATOM 337 N THR A 24 14.624 -3.444 0.436 1.00 1.89 N ATOM 338 CA THR A 24 14.981 -3.582 1.869 1.00 1.88 C ATOM 339 C THR A 24 14.536 -4.917 2.543 1.00 1.65 C ATOM 340 O THR A 24 14.536 -5.990 1.908 1.00 2.03 O ATOM 341 CB THR A 24 14.498 -2.329 2.692 1.00 2.50 C ATOM 342 OG1 THR A 24 13.103 -2.050 2.452 1.00 3.09 O ATOM 343 CG2 THR A 24 15.328 -1.096 2.344 1.00 2.87 C ATOM 344 H THR A 24 15.310 -3.089 -0.163 1.00 2.13 H ATOM 345 HA THR A 24 16.063 -3.567 1.889 1.00 2.24 H ATOM 346 HB THR A 24 14.629 -2.550 3.741 1.00 3.01 H ATOM 347 HG1 THR A 24 13.016 -1.281 1.878 1.00 3.52 H ATOM 348 HG21 THR A 24 15.222 -0.886 1.289 1.00 3.16 H ATOM 349 HG22 THR A 24 16.365 -1.271 2.592 1.00 3.32 H ATOM 350 HG23 THR A 24 14.964 -0.255 2.916 1.00 3.05 H ATOM 351 N ASP A 25 14.208 -4.852 3.830 1.00 1.52 N ATOM 352 CA ASP A 25 13.720 -6.007 4.550 1.00 1.56 C ATOM 353 C ASP A 25 12.361 -5.717 5.105 1.00 1.29 C ATOM 354 O ASP A 25 12.209 -5.023 6.101 1.00 1.63 O ATOM 355 CB ASP A 25 14.679 -6.490 5.655 1.00 2.14 C ATOM 356 CG ASP A 25 14.108 -7.680 6.420 1.00 2.62 C ATOM 357 OD1 ASP A 25 13.563 -8.622 5.780 1.00 3.01 O ATOM 358 OD2 ASP A 25 14.195 -7.709 7.663 1.00 3.06 O ATOM 359 H ASP A 25 14.256 -4.002 4.315 1.00 1.75 H ATOM 360 HA ASP A 25 13.602 -6.797 3.819 1.00 1.73 H ATOM 361 HB2 ASP A 25 15.614 -6.784 5.203 1.00 2.49 H ATOM 362 HB3 ASP A 25 14.859 -5.694 6.362 1.00 2.44 H ATOM 363 N LEU A 26 11.393 -6.189 4.401 1.00 1.14 N ATOM 364 CA LEU A 26 9.999 -6.038 4.736 1.00 0.93 C ATOM 365 C LEU A 26 9.326 -7.383 4.563 1.00 0.97 C ATOM 366 O LEU A 26 8.128 -7.497 4.335 1.00 1.44 O ATOM 367 CB LEU A 26 9.397 -4.925 3.850 1.00 1.11 C ATOM 368 CG LEU A 26 9.750 -4.927 2.335 1.00 0.87 C ATOM 369 CD1 LEU A 26 8.996 -5.989 1.538 1.00 1.38 C ATOM 370 CD2 LEU A 26 9.546 -3.544 1.739 1.00 1.53 C ATOM 371 H LEU A 26 11.618 -6.676 3.581 1.00 1.49 H ATOM 372 HA LEU A 26 9.941 -5.754 5.773 1.00 0.96 H ATOM 373 HB2 LEU A 26 8.321 -4.941 3.942 1.00 1.64 H ATOM 374 HB3 LEU A 26 9.739 -3.989 4.270 1.00 1.87 H ATOM 375 HG LEU A 26 10.800 -5.172 2.243 1.00 1.73 H ATOM 376 HD11 LEU A 26 9.310 -5.942 0.501 1.00 1.91 H ATOM 377 HD12 LEU A 26 7.933 -5.817 1.609 1.00 1.94 H ATOM 378 HD13 LEU A 26 9.221 -6.967 1.935 1.00 1.97 H ATOM 379 HD21 LEU A 26 10.189 -2.847 2.253 1.00 2.11 H ATOM 380 HD22 LEU A 26 8.513 -3.241 1.851 1.00 1.91 H ATOM 381 HD23 LEU A 26 9.816 -3.564 0.694 1.00 2.02 H ATOM 382 N SER A 27 10.140 -8.391 4.719 1.00 1.01 N ATOM 383 CA SER A 27 9.784 -9.770 4.529 1.00 1.18 C ATOM 384 C SER A 27 8.745 -10.213 5.559 1.00 1.27 C ATOM 385 O SER A 27 7.658 -10.687 5.205 1.00 1.98 O ATOM 386 CB SER A 27 11.057 -10.587 4.703 1.00 1.52 C ATOM 387 OG SER A 27 12.137 -9.981 3.983 1.00 2.26 O ATOM 388 H SER A 27 11.061 -8.201 4.998 1.00 1.26 H ATOM 389 HA SER A 27 9.422 -9.918 3.521 1.00 1.31 H ATOM 390 HB2 SER A 27 11.323 -10.628 5.749 1.00 1.83 H ATOM 391 HB3 SER A 27 10.901 -11.586 4.323 1.00 1.77 H ATOM 392 HG SER A 27 12.683 -9.475 4.611 1.00 2.55 H ATOM 393 N GLY A 28 9.075 -10.032 6.824 1.00 1.18 N ATOM 394 CA GLY A 28 8.209 -10.470 7.887 1.00 1.46 C ATOM 395 C GLY A 28 7.352 -9.368 8.419 1.00 1.19 C ATOM 396 O GLY A 28 6.145 -9.560 8.635 1.00 1.73 O ATOM 397 H GLY A 28 9.930 -9.584 7.044 1.00 1.42 H ATOM 398 HA2 GLY A 28 7.549 -11.234 7.511 1.00 1.84 H ATOM 399 HA3 GLY A 28 8.808 -10.867 8.689 1.00 1.75 H ATOM 400 N ASP A 29 7.938 -8.216 8.657 1.00 0.90 N ATOM 401 CA ASP A 29 7.196 -7.119 9.169 1.00 0.83 C ATOM 402 C ASP A 29 7.654 -5.846 8.511 1.00 0.79 C ATOM 403 O ASP A 29 8.803 -5.726 8.119 1.00 1.33 O ATOM 404 CB ASP A 29 7.323 -7.013 10.689 1.00 1.20 C ATOM 405 CG ASP A 29 8.582 -6.308 11.184 1.00 1.95 C ATOM 406 OD1 ASP A 29 9.676 -6.920 11.126 1.00 2.44 O ATOM 407 OD2 ASP A 29 8.522 -5.120 11.533 1.00 2.68 O ATOM 408 H ASP A 29 8.889 -8.059 8.486 1.00 1.26 H ATOM 409 HA ASP A 29 6.160 -7.278 8.913 1.00 0.92 H ATOM 410 HB2 ASP A 29 6.467 -6.459 11.034 1.00 1.67 H ATOM 411 HB3 ASP A 29 7.276 -8.010 11.105 1.00 1.46 H ATOM 412 N PHE A 30 6.727 -4.936 8.357 1.00 0.42 N ATOM 413 CA PHE A 30 6.951 -3.659 7.757 1.00 0.36 C ATOM 414 C PHE A 30 5.746 -2.792 8.039 1.00 0.32 C ATOM 415 O PHE A 30 5.579 -1.745 7.456 1.00 0.35 O ATOM 416 CB PHE A 30 7.166 -3.774 6.230 1.00 0.37 C ATOM 417 CG PHE A 30 5.945 -4.230 5.415 1.00 0.35 C ATOM 418 CD1 PHE A 30 5.495 -5.542 5.497 1.00 0.40 C ATOM 419 CD2 PHE A 30 5.262 -3.353 4.573 1.00 0.38 C ATOM 420 CE1 PHE A 30 4.401 -5.970 4.768 1.00 0.46 C ATOM 421 CE2 PHE A 30 4.166 -3.783 3.843 1.00 0.42 C ATOM 422 CZ PHE A 30 3.718 -5.020 3.932 1.00 0.46 C ATOM 423 H PHE A 30 5.817 -5.111 8.655 1.00 0.67 H ATOM 424 HA PHE A 30 7.825 -3.222 8.215 1.00 0.43 H ATOM 425 HB2 PHE A 30 7.479 -2.793 5.904 1.00 0.40 H ATOM 426 HB3 PHE A 30 7.975 -4.466 6.044 1.00 0.41 H ATOM 427 HD1 PHE A 30 6.010 -6.238 6.141 1.00 0.43 H ATOM 428 HD2 PHE A 30 5.590 -2.329 4.488 1.00 0.43 H ATOM 429 HE1 PHE A 30 4.068 -6.996 4.845 1.00 0.55 H ATOM 430 HE2 PHE A 30 3.641 -3.098 3.196 1.00 0.47 H ATOM 431 HZ PHE A 30 2.856 -5.331 3.358 1.00 0.53 H ATOM 432 N LEU A 31 4.949 -3.207 8.994 1.00 0.35 N ATOM 433 CA LEU A 31 3.697 -2.546 9.261 1.00 0.36 C ATOM 434 C LEU A 31 3.903 -1.339 10.123 1.00 0.39 C ATOM 435 O LEU A 31 3.185 -0.372 10.001 1.00 0.46 O ATOM 436 CB LEU A 31 2.685 -3.494 9.859 1.00 0.40 C ATOM 437 CG LEU A 31 2.249 -4.634 8.942 1.00 0.39 C ATOM 438 CD1 LEU A 31 1.302 -5.562 9.667 1.00 0.45 C ATOM 439 CD2 LEU A 31 1.584 -4.097 7.680 1.00 0.38 C ATOM 440 H LEU A 31 5.247 -3.913 9.606 1.00 0.44 H ATOM 441 HA LEU A 31 3.322 -2.199 8.311 1.00 0.35 H ATOM 442 HB2 LEU A 31 3.091 -3.904 10.768 1.00 0.44 H ATOM 443 HB3 LEU A 31 1.803 -2.929 10.114 1.00 0.42 H ATOM 444 HG LEU A 31 3.122 -5.198 8.642 1.00 0.39 H ATOM 445 HD11 LEU A 31 1.801 -6.001 10.520 1.00 0.98 H ATOM 446 HD12 LEU A 31 0.986 -6.326 8.974 1.00 1.10 H ATOM 447 HD13 LEU A 31 0.438 -5.001 9.991 1.00 1.06 H ATOM 448 HD21 LEU A 31 1.265 -4.927 7.065 1.00 1.07 H ATOM 449 HD22 LEU A 31 2.291 -3.488 7.134 1.00 1.11 H ATOM 450 HD23 LEU A 31 0.726 -3.497 7.947 1.00 1.05 H ATOM 451 N ASP A 32 4.900 -1.408 10.992 1.00 0.43 N ATOM 452 CA ASP A 32 5.273 -0.267 11.814 1.00 0.52 C ATOM 453 C ASP A 32 6.511 0.381 11.231 1.00 0.50 C ATOM 454 O ASP A 32 7.073 1.315 11.788 1.00 0.66 O ATOM 455 CB ASP A 32 5.517 -0.646 13.286 1.00 0.69 C ATOM 456 CG ASP A 32 4.263 -1.078 14.021 1.00 1.46 C ATOM 457 OD1 ASP A 32 3.488 -0.188 14.496 1.00 1.95 O ATOM 458 OD2 ASP A 32 4.026 -2.302 14.146 1.00 2.20 O ATOM 459 H ASP A 32 5.398 -2.252 11.093 1.00 0.46 H ATOM 460 HA ASP A 32 4.459 0.441 11.753 1.00 0.59 H ATOM 461 HB2 ASP A 32 6.220 -1.464 13.307 1.00 1.12 H ATOM 462 HB3 ASP A 32 5.931 0.213 13.795 1.00 1.24 H ATOM 463 N LEU A 33 6.924 -0.121 10.094 1.00 0.42 N ATOM 464 CA LEU A 33 8.044 0.422 9.376 1.00 0.50 C ATOM 465 C LEU A 33 7.555 1.555 8.525 1.00 0.45 C ATOM 466 O LEU A 33 6.632 1.387 7.746 1.00 0.57 O ATOM 467 CB LEU A 33 8.706 -0.647 8.497 1.00 0.66 C ATOM 468 CG LEU A 33 9.450 -1.775 9.207 1.00 0.80 C ATOM 469 CD1 LEU A 33 10.219 -2.593 8.200 1.00 1.52 C ATOM 470 CD2 LEU A 33 10.391 -1.233 10.249 1.00 1.18 C ATOM 471 H LEU A 33 6.423 -0.862 9.701 1.00 0.43 H ATOM 472 HA LEU A 33 8.763 0.790 10.094 1.00 0.61 H ATOM 473 HB2 LEU A 33 7.906 -1.115 7.940 1.00 1.44 H ATOM 474 HB3 LEU A 33 9.359 -0.206 7.765 1.00 1.18 H ATOM 475 HG LEU A 33 8.725 -2.413 9.692 1.00 0.96 H ATOM 476 HD11 LEU A 33 10.755 -3.379 8.708 1.00 1.97 H ATOM 477 HD12 LEU A 33 10.912 -1.931 7.700 1.00 2.01 H ATOM 478 HD13 LEU A 33 9.530 -3.012 7.483 1.00 1.95 H ATOM 479 HD21 LEU A 33 10.910 -2.059 10.706 1.00 1.52 H ATOM 480 HD22 LEU A 33 9.840 -0.688 10.999 1.00 1.91 H ATOM 481 HD23 LEU A 33 11.101 -0.584 9.763 1.00 1.52 H ATOM 482 N ARG A 34 8.155 2.688 8.653 1.00 0.43 N ATOM 483 CA ARG A 34 7.682 3.835 7.943 1.00 0.42 C ATOM 484 C ARG A 34 8.236 3.914 6.539 1.00 0.36 C ATOM 485 O ARG A 34 9.364 3.495 6.267 1.00 0.45 O ATOM 486 CB ARG A 34 7.817 5.134 8.752 1.00 0.58 C ATOM 487 CG ARG A 34 6.924 5.128 9.995 1.00 0.77 C ATOM 488 CD ARG A 34 6.887 6.469 10.715 1.00 1.08 C ATOM 489 NE ARG A 34 8.154 6.837 11.350 1.00 1.82 N ATOM 490 CZ ARG A 34 8.438 8.074 11.796 1.00 2.41 C ATOM 491 NH1 ARG A 34 7.533 9.044 11.693 1.00 2.43 N ATOM 492 NH2 ARG A 34 9.621 8.343 12.328 1.00 3.44 N ATOM 493 H ARG A 34 8.965 2.737 9.214 1.00 0.55 H ATOM 494 HA ARG A 34 6.628 3.638 7.811 1.00 0.45 H ATOM 495 HB2 ARG A 34 8.841 5.251 9.081 1.00 0.77 H ATOM 496 HB3 ARG A 34 7.527 5.971 8.132 1.00 0.78 H ATOM 497 HG2 ARG A 34 5.911 4.900 9.702 1.00 0.95 H ATOM 498 HG3 ARG A 34 7.283 4.372 10.676 1.00 1.06 H ATOM 499 HD2 ARG A 34 6.653 7.237 9.994 1.00 1.67 H ATOM 500 HD3 ARG A 34 6.116 6.437 11.470 1.00 1.45 H ATOM 501 HE ARG A 34 8.789 6.084 11.461 1.00 2.30 H ATOM 502 HH11 ARG A 34 6.625 8.876 11.304 1.00 2.29 H ATOM 503 HH12 ARG A 34 7.738 9.969 12.041 1.00 3.00 H ATOM 504 HH21 ARG A 34 10.347 7.651 12.429 1.00 3.92 H ATOM 505 HH22 ARG A 34 9.806 9.268 12.684 1.00 3.95 H ATOM 506 N PHE A 35 7.420 4.454 5.655 1.00 0.33 N ATOM 507 CA PHE A 35 7.668 4.495 4.205 1.00 0.33 C ATOM 508 C PHE A 35 9.031 5.082 3.833 1.00 0.38 C ATOM 509 O PHE A 35 9.764 4.509 3.020 1.00 0.43 O ATOM 510 CB PHE A 35 6.552 5.270 3.498 1.00 0.34 C ATOM 511 CG PHE A 35 5.172 4.700 3.725 1.00 0.36 C ATOM 512 CD1 PHE A 35 4.743 3.594 3.005 1.00 0.43 C ATOM 513 CD2 PHE A 35 4.306 5.267 4.659 1.00 0.40 C ATOM 514 CE1 PHE A 35 3.482 3.066 3.209 1.00 0.50 C ATOM 515 CE2 PHE A 35 3.043 4.740 4.865 1.00 0.48 C ATOM 516 CZ PHE A 35 2.633 3.644 4.140 1.00 0.51 C ATOM 517 H PHE A 35 6.590 4.846 6.002 1.00 0.40 H ATOM 518 HA PHE A 35 7.639 3.475 3.849 1.00 0.36 H ATOM 519 HB2 PHE A 35 6.548 6.285 3.862 1.00 0.35 H ATOM 520 HB3 PHE A 35 6.740 5.268 2.435 1.00 0.39 H ATOM 521 HD1 PHE A 35 5.409 3.149 2.279 1.00 0.47 H ATOM 522 HD2 PHE A 35 4.617 6.129 5.230 1.00 0.41 H ATOM 523 HE1 PHE A 35 3.164 2.207 2.637 1.00 0.57 H ATOM 524 HE2 PHE A 35 2.380 5.183 5.594 1.00 0.55 H ATOM 525 HZ PHE A 35 1.648 3.231 4.299 1.00 0.58 H ATOM 526 N GLU A 36 9.367 6.193 4.437 1.00 0.48 N ATOM 527 CA GLU A 36 10.625 6.884 4.153 1.00 0.62 C ATOM 528 C GLU A 36 11.846 6.047 4.584 1.00 0.63 C ATOM 529 O GLU A 36 12.892 6.033 3.914 1.00 0.72 O ATOM 530 CB GLU A 36 10.621 8.247 4.846 1.00 0.83 C ATOM 531 CG GLU A 36 10.465 8.179 6.364 1.00 1.40 C ATOM 532 CD GLU A 36 10.367 9.534 6.986 1.00 1.83 C ATOM 533 OE1 GLU A 36 11.411 10.172 7.214 1.00 1.89 O ATOM 534 OE2 GLU A 36 9.243 9.978 7.276 1.00 2.73 O ATOM 535 H GLU A 36 8.748 6.576 5.097 1.00 0.52 H ATOM 536 HA GLU A 36 10.667 7.044 3.086 1.00 0.69 H ATOM 537 HB2 GLU A 36 11.541 8.765 4.620 1.00 1.43 H ATOM 538 HB3 GLU A 36 9.794 8.817 4.451 1.00 1.37 H ATOM 539 HG2 GLU A 36 9.570 7.624 6.606 1.00 1.99 H ATOM 540 HG3 GLU A 36 11.318 7.665 6.787 1.00 2.11 H ATOM 541 N ASP A 37 11.664 5.301 5.659 1.00 0.61 N ATOM 542 CA ASP A 37 12.715 4.495 6.264 1.00 0.70 C ATOM 543 C ASP A 37 13.040 3.303 5.381 1.00 0.69 C ATOM 544 O ASP A 37 14.208 2.979 5.152 1.00 0.82 O ATOM 545 CB ASP A 37 12.279 4.083 7.680 1.00 0.77 C ATOM 546 CG ASP A 37 13.231 3.145 8.412 1.00 0.98 C ATOM 547 OD1 ASP A 37 14.456 3.380 8.341 1.00 1.27 O ATOM 548 OD2 ASP A 37 12.786 2.138 8.990 1.00 1.36 O ATOM 549 H ASP A 37 10.767 5.265 6.051 1.00 0.57 H ATOM 550 HA ASP A 37 13.600 5.111 6.333 1.00 0.80 H ATOM 551 HB2 ASP A 37 12.177 4.974 8.278 1.00 1.07 H ATOM 552 HB3 ASP A 37 11.310 3.613 7.612 1.00 0.95 H ATOM 553 N ILE A 38 12.005 2.711 4.796 1.00 0.59 N ATOM 554 CA ILE A 38 12.179 1.552 3.913 1.00 0.63 C ATOM 555 C ILE A 38 12.507 1.936 2.455 1.00 0.63 C ATOM 556 O ILE A 38 12.506 1.081 1.567 1.00 0.66 O ATOM 557 CB ILE A 38 10.984 0.556 3.953 1.00 0.59 C ATOM 558 CG1 ILE A 38 9.663 1.264 3.606 1.00 0.48 C ATOM 559 CG2 ILE A 38 10.901 -0.122 5.317 1.00 0.67 C ATOM 560 CD1 ILE A 38 8.444 0.359 3.608 1.00 0.54 C ATOM 561 H ILE A 38 11.102 3.052 4.980 1.00 0.56 H ATOM 562 HA ILE A 38 13.050 1.034 4.293 1.00 0.73 H ATOM 563 HB ILE A 38 11.181 -0.203 3.212 1.00 0.66 H ATOM 564 HG12 ILE A 38 9.497 2.041 4.337 1.00 0.43 H ATOM 565 HG13 ILE A 38 9.756 1.710 2.624 1.00 0.48 H ATOM 566 HG21 ILE A 38 10.762 0.634 6.078 1.00 1.43 H ATOM 567 HG22 ILE A 38 11.807 -0.679 5.508 1.00 1.12 H ATOM 568 HG23 ILE A 38 10.070 -0.810 5.341 1.00 1.13 H ATOM 569 HD11 ILE A 38 7.563 0.932 3.356 1.00 1.13 H ATOM 570 HD12 ILE A 38 8.320 -0.071 4.592 1.00 1.03 H ATOM 571 HD13 ILE A 38 8.587 -0.425 2.878 1.00 1.00 H ATOM 572 N GLY A 39 12.825 3.207 2.239 1.00 0.63 N ATOM 573 CA GLY A 39 13.275 3.670 0.933 1.00 0.68 C ATOM 574 C GLY A 39 12.171 3.868 -0.089 1.00 0.59 C ATOM 575 O GLY A 39 12.346 3.551 -1.259 1.00 0.70 O ATOM 576 H GLY A 39 12.738 3.839 2.983 1.00 0.63 H ATOM 577 HA2 GLY A 39 13.775 4.619 1.061 1.00 0.71 H ATOM 578 HA3 GLY A 39 13.984 2.953 0.544 1.00 0.81 H ATOM 579 N TYR A 40 11.048 4.377 0.334 1.00 0.45 N ATOM 580 CA TYR A 40 9.961 4.628 -0.582 1.00 0.45 C ATOM 581 C TYR A 40 9.553 6.075 -0.600 1.00 0.47 C ATOM 582 O TYR A 40 9.368 6.700 0.454 1.00 0.62 O ATOM 583 CB TYR A 40 8.741 3.742 -0.296 1.00 0.42 C ATOM 584 CG TYR A 40 8.853 2.361 -0.875 1.00 0.46 C ATOM 585 CD1 TYR A 40 9.554 1.353 -0.216 1.00 0.53 C ATOM 586 CD2 TYR A 40 8.266 2.062 -2.099 1.00 0.57 C ATOM 587 CE1 TYR A 40 9.662 0.087 -0.754 1.00 0.60 C ATOM 588 CE2 TYR A 40 8.375 0.798 -2.636 1.00 0.68 C ATOM 589 CZ TYR A 40 9.077 -0.184 -1.957 1.00 0.67 C ATOM 590 OH TYR A 40 9.188 -1.446 -2.495 1.00 0.78 O ATOM 591 H TYR A 40 10.914 4.604 1.278 1.00 0.42 H ATOM 592 HA TYR A 40 10.332 4.373 -1.564 1.00 0.56 H ATOM 593 HB2 TYR A 40 8.624 3.629 0.772 1.00 0.43 H ATOM 594 HB3 TYR A 40 7.857 4.207 -0.703 1.00 0.44 H ATOM 595 HD1 TYR A 40 10.017 1.566 0.737 1.00 0.63 H ATOM 596 HD2 TYR A 40 7.715 2.826 -2.630 1.00 0.66 H ATOM 597 HE1 TYR A 40 10.200 -0.698 -0.244 1.00 0.69 H ATOM 598 HE2 TYR A 40 7.908 0.582 -3.584 1.00 0.85 H ATOM 599 HH TYR A 40 9.057 -2.100 -1.802 1.00 1.25 H ATOM 600 N ASP A 41 9.447 6.620 -1.791 1.00 0.55 N ATOM 601 CA ASP A 41 8.926 7.963 -1.968 1.00 0.69 C ATOM 602 C ASP A 41 7.521 7.834 -2.451 1.00 0.85 C ATOM 603 O ASP A 41 7.080 6.724 -2.789 1.00 1.62 O ATOM 604 CB ASP A 41 9.717 8.808 -2.989 1.00 0.82 C ATOM 605 CG ASP A 41 11.168 9.005 -2.634 1.00 0.99 C ATOM 606 OD1 ASP A 41 11.453 9.636 -1.602 1.00 1.27 O ATOM 607 OD2 ASP A 41 12.043 8.515 -3.379 1.00 1.32 O ATOM 608 H ASP A 41 9.725 6.106 -2.577 1.00 0.64 H ATOM 609 HA ASP A 41 8.930 8.445 -1.003 1.00 0.70 H ATOM 610 HB2 ASP A 41 9.631 8.338 -3.957 1.00 1.07 H ATOM 611 HB3 ASP A 41 9.263 9.786 -3.060 1.00 1.03 H ATOM 612 N SER A 42 6.844 8.950 -2.562 1.00 0.50 N ATOM 613 CA SER A 42 5.451 9.001 -2.948 1.00 0.53 C ATOM 614 C SER A 42 5.232 8.430 -4.336 1.00 0.51 C ATOM 615 O SER A 42 4.286 7.702 -4.559 1.00 0.48 O ATOM 616 CB SER A 42 4.986 10.439 -2.896 1.00 0.69 C ATOM 617 OG SER A 42 5.881 11.259 -3.719 1.00 1.05 O ATOM 618 H SER A 42 7.307 9.795 -2.388 1.00 0.83 H ATOM 619 HA SER A 42 4.872 8.429 -2.239 1.00 0.54 H ATOM 620 HB2 SER A 42 3.977 10.499 -3.275 1.00 1.09 H ATOM 621 HB3 SER A 42 5.006 10.797 -1.879 1.00 1.08 H ATOM 622 N LEU A 43 6.155 8.750 -5.247 1.00 0.57 N ATOM 623 CA LEU A 43 6.092 8.342 -6.659 1.00 0.62 C ATOM 624 C LEU A 43 5.873 6.825 -6.786 1.00 0.56 C ATOM 625 O LEU A 43 4.838 6.376 -7.265 1.00 0.58 O ATOM 626 CB LEU A 43 7.396 8.761 -7.373 1.00 0.74 C ATOM 627 CG LEU A 43 7.455 8.541 -8.889 1.00 0.86 C ATOM 628 CD1 LEU A 43 6.429 9.401 -9.616 1.00 1.40 C ATOM 629 CD2 LEU A 43 8.853 8.819 -9.409 1.00 1.19 C ATOM 630 H LEU A 43 6.893 9.317 -4.934 1.00 0.63 H ATOM 631 HA LEU A 43 5.263 8.863 -7.116 1.00 0.68 H ATOM 632 HB2 LEU A 43 7.550 9.814 -7.180 1.00 0.80 H ATOM 633 HB3 LEU A 43 8.215 8.217 -6.922 1.00 0.74 H ATOM 634 HG LEU A 43 7.216 7.510 -9.105 1.00 1.21 H ATOM 635 HD11 LEU A 43 6.484 9.220 -10.680 1.00 2.04 H ATOM 636 HD12 LEU A 43 6.629 10.445 -9.413 1.00 1.94 H ATOM 637 HD13 LEU A 43 5.441 9.154 -9.258 1.00 1.66 H ATOM 638 HD21 LEU A 43 9.552 8.155 -8.921 1.00 1.69 H ATOM 639 HD22 LEU A 43 9.121 9.843 -9.194 1.00 1.62 H ATOM 640 HD23 LEU A 43 8.881 8.665 -10.476 1.00 1.71 H ATOM 641 N ALA A 44 6.812 6.055 -6.242 1.00 0.54 N ATOM 642 CA ALA A 44 6.765 4.598 -6.327 1.00 0.54 C ATOM 643 C ALA A 44 5.675 4.022 -5.431 1.00 0.47 C ATOM 644 O ALA A 44 5.155 2.927 -5.670 1.00 0.53 O ATOM 645 CB ALA A 44 8.120 4.010 -5.969 1.00 0.59 C ATOM 646 H ALA A 44 7.549 6.483 -5.763 1.00 0.57 H ATOM 647 HA ALA A 44 6.539 4.332 -7.347 1.00 0.62 H ATOM 648 HB1 ALA A 44 8.099 2.938 -6.091 1.00 1.28 H ATOM 649 HB2 ALA A 44 8.349 4.247 -4.941 1.00 1.12 H ATOM 650 HB3 ALA A 44 8.872 4.439 -6.616 1.00 1.13 H ATOM 651 N LEU A 45 5.310 4.773 -4.421 1.00 0.42 N ATOM 652 CA LEU A 45 4.311 4.356 -3.467 1.00 0.38 C ATOM 653 C LEU A 45 2.929 4.454 -4.143 1.00 0.37 C ATOM 654 O LEU A 45 2.071 3.600 -3.961 1.00 0.39 O ATOM 655 CB LEU A 45 4.401 5.274 -2.222 1.00 0.35 C ATOM 656 CG LEU A 45 3.826 4.767 -0.889 1.00 0.37 C ATOM 657 CD1 LEU A 45 4.163 5.740 0.206 1.00 0.38 C ATOM 658 CD2 LEU A 45 2.325 4.555 -0.957 1.00 0.53 C ATOM 659 H LEU A 45 5.732 5.652 -4.315 1.00 0.46 H ATOM 660 HA LEU A 45 4.529 3.334 -3.187 1.00 0.42 H ATOM 661 HB2 LEU A 45 5.448 5.471 -2.044 1.00 0.34 H ATOM 662 HB3 LEU A 45 3.921 6.210 -2.478 1.00 0.40 H ATOM 663 HG LEU A 45 4.299 3.832 -0.639 1.00 0.43 H ATOM 664 HD11 LEU A 45 3.717 6.696 -0.023 1.00 1.04 H ATOM 665 HD12 LEU A 45 5.235 5.844 0.286 1.00 1.10 H ATOM 666 HD13 LEU A 45 3.780 5.374 1.146 1.00 1.14 H ATOM 667 HD21 LEU A 45 1.985 4.198 0.001 1.00 0.97 H ATOM 668 HD22 LEU A 45 2.115 3.838 -1.737 1.00 1.13 H ATOM 669 HD23 LEU A 45 1.853 5.495 -1.194 1.00 1.32 H ATOM 670 N MET A 46 2.735 5.476 -4.944 1.00 0.37 N ATOM 671 CA MET A 46 1.457 5.660 -5.624 1.00 0.40 C ATOM 672 C MET A 46 1.314 4.696 -6.783 1.00 0.35 C ATOM 673 O MET A 46 0.207 4.299 -7.149 1.00 0.36 O ATOM 674 CB MET A 46 1.224 7.114 -6.032 1.00 0.52 C ATOM 675 CG MET A 46 1.100 8.043 -4.833 1.00 0.70 C ATOM 676 SD MET A 46 0.695 9.734 -5.266 1.00 0.96 S ATOM 677 CE MET A 46 0.726 10.501 -3.643 1.00 2.41 C ATOM 678 H MET A 46 3.457 6.135 -5.077 1.00 0.38 H ATOM 679 HA MET A 46 0.703 5.375 -4.903 1.00 0.47 H ATOM 680 HB2 MET A 46 2.053 7.442 -6.641 1.00 0.53 H ATOM 681 HB3 MET A 46 0.310 7.176 -6.604 1.00 0.59 H ATOM 682 HG2 MET A 46 0.314 7.670 -4.191 1.00 0.73 H ATOM 683 HG3 MET A 46 2.028 8.045 -4.280 1.00 0.73 H ATOM 684 HE1 MET A 46 0.468 11.546 -3.719 1.00 2.94 H ATOM 685 HE2 MET A 46 1.721 10.424 -3.232 1.00 2.88 H ATOM 686 HE3 MET A 46 0.030 10.005 -2.983 1.00 2.92 H ATOM 687 N GLU A 47 2.447 4.267 -7.330 1.00 0.37 N ATOM 688 CA GLU A 47 2.433 3.212 -8.339 1.00 0.39 C ATOM 689 C GLU A 47 1.983 1.906 -7.660 1.00 0.37 C ATOM 690 O GLU A 47 1.247 1.100 -8.240 1.00 0.43 O ATOM 691 CB GLU A 47 3.815 3.029 -8.971 1.00 0.48 C ATOM 692 CG GLU A 47 4.401 4.267 -9.638 1.00 0.68 C ATOM 693 CD GLU A 47 5.749 3.968 -10.278 1.00 1.41 C ATOM 694 OE1 GLU A 47 6.771 3.905 -9.566 1.00 2.15 O ATOM 695 OE2 GLU A 47 5.798 3.744 -11.522 1.00 1.84 O ATOM 696 H GLU A 47 3.295 4.691 -7.081 1.00 0.40 H ATOM 697 HA GLU A 47 1.702 3.469 -9.092 1.00 0.42 H ATOM 698 HB2 GLU A 47 4.501 2.724 -8.196 1.00 0.57 H ATOM 699 HB3 GLU A 47 3.753 2.237 -9.705 1.00 0.68 H ATOM 700 HG2 GLU A 47 3.718 4.618 -10.398 1.00 1.01 H ATOM 701 HG3 GLU A 47 4.530 5.041 -8.895 1.00 1.05 H ATOM 702 N THR A 48 2.412 1.741 -6.412 1.00 0.36 N ATOM 703 CA THR A 48 2.018 0.619 -5.582 1.00 0.39 C ATOM 704 C THR A 48 0.490 0.657 -5.366 1.00 0.35 C ATOM 705 O THR A 48 -0.209 -0.336 -5.615 1.00 0.40 O ATOM 706 CB THR A 48 2.726 0.708 -4.212 1.00 0.43 C ATOM 707 OG1 THR A 48 4.157 0.711 -4.382 1.00 0.51 O ATOM 708 CG2 THR A 48 2.309 -0.444 -3.301 1.00 0.51 C ATOM 709 H THR A 48 3.029 2.407 -6.044 1.00 0.38 H ATOM 710 HA THR A 48 2.301 -0.301 -6.070 1.00 0.44 H ATOM 711 HB THR A 48 2.434 1.642 -3.756 1.00 0.39 H ATOM 712 HG1 THR A 48 4.458 1.539 -4.778 1.00 0.77 H ATOM 713 HG21 THR A 48 2.535 -1.384 -3.781 1.00 1.01 H ATOM 714 HG22 THR A 48 1.248 -0.388 -3.115 1.00 1.20 H ATOM 715 HG23 THR A 48 2.843 -0.377 -2.368 1.00 1.19 H ATOM 716 N ALA A 49 -0.012 1.810 -4.912 1.00 0.31 N ATOM 717 CA ALA A 49 -1.435 2.021 -4.676 1.00 0.32 C ATOM 718 C ALA A 49 -2.246 1.677 -5.917 1.00 0.30 C ATOM 719 O ALA A 49 -3.228 0.937 -5.839 1.00 0.32 O ATOM 720 CB ALA A 49 -1.680 3.452 -4.295 1.00 0.38 C ATOM 721 H ALA A 49 0.609 2.551 -4.729 1.00 0.32 H ATOM 722 HA ALA A 49 -1.763 1.400 -3.852 1.00 0.36 H ATOM 723 HB1 ALA A 49 -2.732 3.581 -4.103 1.00 1.14 H ATOM 724 HB2 ALA A 49 -1.389 4.085 -5.118 1.00 1.07 H ATOM 725 HB3 ALA A 49 -1.112 3.696 -3.411 1.00 1.05 H ATOM 726 N ALA A 50 -1.768 2.143 -7.073 1.00 0.29 N ATOM 727 CA ALA A 50 -2.420 1.918 -8.358 1.00 0.31 C ATOM 728 C ALA A 50 -2.567 0.422 -8.693 1.00 0.31 C ATOM 729 O ALA A 50 -3.405 0.049 -9.510 1.00 0.35 O ATOM 730 CB ALA A 50 -1.668 2.631 -9.475 1.00 0.39 C ATOM 731 H ALA A 50 -0.956 2.699 -7.049 1.00 0.31 H ATOM 732 HA ALA A 50 -3.408 2.353 -8.298 1.00 0.32 H ATOM 733 HB1 ALA A 50 -0.684 2.195 -9.582 1.00 1.16 H ATOM 734 HB2 ALA A 50 -1.586 3.683 -9.242 1.00 1.05 H ATOM 735 HB3 ALA A 50 -2.205 2.519 -10.406 1.00 1.05 H ATOM 736 N ARG A 51 -1.738 -0.433 -8.081 1.00 0.32 N ATOM 737 CA ARG A 51 -1.818 -1.877 -8.317 1.00 0.38 C ATOM 738 C ARG A 51 -3.052 -2.410 -7.650 1.00 0.37 C ATOM 739 O ARG A 51 -3.784 -3.218 -8.204 1.00 0.47 O ATOM 740 CB ARG A 51 -0.587 -2.619 -7.755 1.00 0.49 C ATOM 741 CG ARG A 51 0.784 -2.093 -8.197 1.00 0.97 C ATOM 742 CD ARG A 51 1.028 -2.196 -9.698 1.00 0.98 C ATOM 743 NE ARG A 51 0.074 -1.417 -10.495 1.00 1.92 N ATOM 744 CZ ARG A 51 -0.070 -1.519 -11.820 1.00 2.31 C ATOM 745 NH1 ARG A 51 0.823 -2.196 -12.544 1.00 2.05 N ATOM 746 NH2 ARG A 51 -1.095 -0.919 -12.421 1.00 3.40 N ATOM 747 H ARG A 51 -1.070 -0.077 -7.452 1.00 0.33 H ATOM 748 HA ARG A 51 -1.885 -2.049 -9.381 1.00 0.43 H ATOM 749 HB2 ARG A 51 -0.619 -2.571 -6.676 1.00 1.08 H ATOM 750 HB3 ARG A 51 -0.656 -3.656 -8.045 1.00 1.12 H ATOM 751 HG2 ARG A 51 0.869 -1.058 -7.903 1.00 1.56 H ATOM 752 HG3 ARG A 51 1.542 -2.667 -7.685 1.00 1.50 H ATOM 753 HD2 ARG A 51 2.016 -1.806 -9.881 1.00 1.17 H ATOM 754 HD3 ARG A 51 0.978 -3.231 -10.002 1.00 1.40 H ATOM 755 HE ARG A 51 -0.512 -0.844 -9.954 1.00 2.58 H ATOM 756 HH11 ARG A 51 1.611 -2.646 -12.115 1.00 1.81 H ATOM 757 HH12 ARG A 51 0.756 -2.264 -13.544 1.00 2.55 H ATOM 758 HH21 ARG A 51 -1.772 -0.369 -11.929 1.00 4.01 H ATOM 759 HH22 ARG A 51 -1.254 -1.044 -13.408 1.00 3.78 H ATOM 760 N LEU A 52 -3.296 -1.892 -6.479 1.00 0.32 N ATOM 761 CA LEU A 52 -4.389 -2.325 -5.639 1.00 0.34 C ATOM 762 C LEU A 52 -5.701 -1.714 -6.104 1.00 0.33 C ATOM 763 O LEU A 52 -6.675 -2.440 -6.362 1.00 0.40 O ATOM 764 CB LEU A 52 -4.084 -1.959 -4.186 1.00 0.35 C ATOM 765 CG LEU A 52 -2.798 -2.563 -3.610 1.00 0.38 C ATOM 766 CD1 LEU A 52 -2.563 -2.077 -2.191 1.00 0.43 C ATOM 767 CD2 LEU A 52 -2.861 -4.082 -3.640 1.00 0.39 C ATOM 768 H LEU A 52 -2.706 -1.165 -6.178 1.00 0.30 H ATOM 769 HA LEU A 52 -4.463 -3.398 -5.720 1.00 0.39 H ATOM 770 HB2 LEU A 52 -4.003 -0.882 -4.134 1.00 0.35 H ATOM 771 HB3 LEU A 52 -4.909 -2.285 -3.567 1.00 0.38 H ATOM 772 HG LEU A 52 -1.964 -2.244 -4.219 1.00 0.41 H ATOM 773 HD11 LEU A 52 -1.654 -2.509 -1.799 1.00 1.04 H ATOM 774 HD12 LEU A 52 -3.393 -2.367 -1.563 1.00 1.06 H ATOM 775 HD13 LEU A 52 -2.482 -1.000 -2.185 1.00 1.06 H ATOM 776 HD21 LEU A 52 -2.988 -4.422 -4.657 1.00 1.11 H ATOM 777 HD22 LEU A 52 -3.693 -4.420 -3.037 1.00 0.96 H ATOM 778 HD23 LEU A 52 -1.935 -4.474 -3.246 1.00 1.10 H ATOM 779 N GLU A 53 -5.700 -0.389 -6.281 1.00 0.28 N ATOM 780 CA GLU A 53 -6.893 0.355 -6.698 1.00 0.29 C ATOM 781 C GLU A 53 -7.466 -0.218 -7.978 1.00 0.31 C ATOM 782 O GLU A 53 -8.641 -0.555 -8.030 1.00 0.35 O ATOM 783 CB GLU A 53 -6.580 1.820 -6.965 1.00 0.29 C ATOM 784 CG GLU A 53 -6.004 2.614 -5.821 1.00 0.35 C ATOM 785 CD GLU A 53 -5.718 4.038 -6.255 1.00 0.41 C ATOM 786 OE1 GLU A 53 -4.747 4.248 -7.002 1.00 0.53 O ATOM 787 OE2 GLU A 53 -6.495 4.947 -5.893 1.00 0.51 O ATOM 788 H GLU A 53 -4.867 0.115 -6.129 1.00 0.27 H ATOM 789 HA GLU A 53 -7.659 0.288 -5.932 1.00 0.33 H ATOM 790 HB2 GLU A 53 -5.879 1.887 -7.784 1.00 0.29 H ATOM 791 HB3 GLU A 53 -7.509 2.290 -7.263 1.00 0.32 H ATOM 792 HG2 GLU A 53 -6.722 2.635 -5.015 1.00 0.41 H ATOM 793 HG3 GLU A 53 -5.084 2.161 -5.487 1.00 0.33 H ATOM 794 N SER A 54 -6.621 -0.380 -8.978 1.00 0.35 N ATOM 795 CA SER A 54 -7.056 -0.824 -10.295 1.00 0.43 C ATOM 796 C SER A 54 -7.497 -2.284 -10.302 1.00 0.47 C ATOM 797 O SER A 54 -8.359 -2.674 -11.097 1.00 0.61 O ATOM 798 CB SER A 54 -5.942 -0.620 -11.310 1.00 0.49 C ATOM 799 OG SER A 54 -5.526 0.743 -11.355 1.00 1.16 O ATOM 800 H SER A 54 -5.674 -0.183 -8.823 1.00 0.36 H ATOM 801 HA SER A 54 -7.887 -0.197 -10.576 1.00 0.45 H ATOM 802 HB2 SER A 54 -5.107 -1.245 -11.034 1.00 1.13 H ATOM 803 HB3 SER A 54 -6.307 -0.914 -12.284 1.00 1.14 H ATOM 804 HG SER A 54 -4.825 0.845 -10.702 1.00 1.39 H ATOM 805 N ARG A 55 -6.929 -3.073 -9.399 1.00 0.40 N ATOM 806 CA ARG A 55 -7.204 -4.499 -9.345 1.00 0.46 C ATOM 807 C ARG A 55 -8.604 -4.766 -8.794 1.00 0.47 C ATOM 808 O ARG A 55 -9.324 -5.644 -9.286 1.00 0.57 O ATOM 809 CB ARG A 55 -6.162 -5.202 -8.467 1.00 0.50 C ATOM 810 CG ARG A 55 -6.257 -6.725 -8.462 1.00 0.61 C ATOM 811 CD ARG A 55 -5.347 -7.330 -7.409 1.00 0.75 C ATOM 812 NE ARG A 55 -3.930 -6.955 -7.590 1.00 1.28 N ATOM 813 CZ ARG A 55 -3.027 -6.878 -6.600 1.00 1.65 C ATOM 814 NH1 ARG A 55 -3.400 -7.107 -5.337 1.00 1.46 N ATOM 815 NH2 ARG A 55 -1.763 -6.580 -6.893 1.00 2.65 N ATOM 816 H ARG A 55 -6.302 -2.684 -8.752 1.00 0.37 H ATOM 817 HA ARG A 55 -7.146 -4.901 -10.345 1.00 0.51 H ATOM 818 HB2 ARG A 55 -5.180 -4.918 -8.816 1.00 0.54 H ATOM 819 HB3 ARG A 55 -6.268 -4.845 -7.454 1.00 0.52 H ATOM 820 HG2 ARG A 55 -7.276 -7.023 -8.261 1.00 0.74 H ATOM 821 HG3 ARG A 55 -5.960 -7.086 -9.437 1.00 0.63 H ATOM 822 HD2 ARG A 55 -5.669 -6.977 -6.440 1.00 1.34 H ATOM 823 HD3 ARG A 55 -5.442 -8.407 -7.447 1.00 1.29 H ATOM 824 HE ARG A 55 -3.626 -6.775 -8.516 1.00 1.84 H ATOM 825 HH11 ARG A 55 -4.333 -7.346 -5.064 1.00 1.47 H ATOM 826 HH12 ARG A 55 -2.798 -7.082 -4.518 1.00 1.85 H ATOM 827 HH21 ARG A 55 -1.498 -6.423 -7.848 1.00 3.22 H ATOM 828 HH22 ARG A 55 -1.020 -6.519 -6.218 1.00 3.00 H ATOM 829 N TYR A 56 -8.970 -4.015 -7.786 1.00 0.42 N ATOM 830 CA TYR A 56 -10.236 -4.218 -7.115 1.00 0.47 C ATOM 831 C TYR A 56 -11.310 -3.251 -7.594 1.00 0.50 C ATOM 832 O TYR A 56 -12.498 -3.591 -7.602 1.00 0.67 O ATOM 833 CB TYR A 56 -10.048 -4.163 -5.590 1.00 0.52 C ATOM 834 CG TYR A 56 -9.115 -5.241 -5.082 1.00 0.53 C ATOM 835 CD1 TYR A 56 -9.566 -6.538 -4.871 1.00 0.62 C ATOM 836 CD2 TYR A 56 -7.787 -4.956 -4.785 1.00 0.59 C ATOM 837 CE1 TYR A 56 -8.732 -7.508 -4.377 1.00 0.70 C ATOM 838 CE2 TYR A 56 -6.940 -5.933 -4.292 1.00 0.65 C ATOM 839 CZ TYR A 56 -7.386 -7.234 -4.214 1.00 0.67 C ATOM 840 OH TYR A 56 -6.590 -8.175 -3.583 1.00 0.79 O ATOM 841 H TYR A 56 -8.368 -3.300 -7.486 1.00 0.39 H ATOM 842 HA TYR A 56 -10.557 -5.213 -7.374 1.00 0.51 H ATOM 843 HB2 TYR A 56 -9.597 -3.214 -5.334 1.00 0.53 H ATOM 844 HB3 TYR A 56 -10.998 -4.268 -5.085 1.00 0.56 H ATOM 845 HD1 TYR A 56 -10.594 -6.779 -5.093 1.00 0.70 H ATOM 846 HD2 TYR A 56 -7.411 -3.957 -4.946 1.00 0.66 H ATOM 847 HE1 TYR A 56 -9.100 -8.510 -4.227 1.00 0.83 H ATOM 848 HE2 TYR A 56 -5.912 -5.693 -4.066 1.00 0.75 H ATOM 849 HH TYR A 56 -6.048 -7.822 -2.870 1.00 0.95 H ATOM 850 N GLY A 57 -10.897 -2.077 -8.019 1.00 0.41 N ATOM 851 CA GLY A 57 -11.838 -1.079 -8.480 1.00 0.45 C ATOM 852 C GLY A 57 -12.058 0.007 -7.447 1.00 0.46 C ATOM 853 O GLY A 57 -13.181 0.454 -7.238 1.00 0.61 O ATOM 854 H GLY A 57 -9.941 -1.858 -8.038 1.00 0.38 H ATOM 855 HA2 GLY A 57 -11.450 -0.634 -9.386 1.00 0.47 H ATOM 856 HA3 GLY A 57 -12.785 -1.556 -8.691 1.00 0.50 H ATOM 857 N VAL A 58 -10.977 0.436 -6.793 1.00 0.38 N ATOM 858 CA VAL A 58 -11.085 1.443 -5.751 1.00 0.42 C ATOM 859 C VAL A 58 -10.313 2.706 -6.140 1.00 0.45 C ATOM 860 O VAL A 58 -9.733 2.773 -7.227 1.00 0.51 O ATOM 861 CB VAL A 58 -10.640 0.934 -4.314 1.00 0.42 C ATOM 862 CG1 VAL A 58 -11.099 -0.479 -4.079 1.00 0.59 C ATOM 863 CG2 VAL A 58 -9.132 1.035 -4.043 1.00 0.57 C ATOM 864 H VAL A 58 -10.099 0.095 -7.069 1.00 0.34 H ATOM 865 HA VAL A 58 -12.133 1.705 -5.710 1.00 0.50 H ATOM 866 HB VAL A 58 -11.164 1.565 -3.613 1.00 0.56 H ATOM 867 HG11 VAL A 58 -10.567 -1.075 -4.810 1.00 1.23 H ATOM 868 HG12 VAL A 58 -12.166 -0.563 -4.226 1.00 1.25 H ATOM 869 HG13 VAL A 58 -10.828 -0.802 -3.085 1.00 1.06 H ATOM 870 HG21 VAL A 58 -8.947 0.697 -3.033 1.00 1.05 H ATOM 871 HG22 VAL A 58 -8.813 2.061 -4.134 1.00 1.24 H ATOM 872 HG23 VAL A 58 -8.589 0.413 -4.739 1.00 1.24 H ATOM 873 N SER A 59 -10.347 3.705 -5.298 1.00 0.51 N ATOM 874 CA SER A 59 -9.571 4.909 -5.482 1.00 0.61 C ATOM 875 C SER A 59 -9.270 5.466 -4.104 1.00 0.56 C ATOM 876 O SER A 59 -10.171 5.530 -3.255 1.00 0.63 O ATOM 877 CB SER A 59 -10.358 5.941 -6.310 1.00 0.84 C ATOM 878 OG SER A 59 -10.815 5.374 -7.545 1.00 1.59 O ATOM 879 H SER A 59 -10.902 3.683 -4.491 1.00 0.54 H ATOM 880 HA SER A 59 -8.637 4.671 -5.972 1.00 0.62 H ATOM 881 HB2 SER A 59 -11.210 6.277 -5.739 1.00 1.32 H ATOM 882 HB3 SER A 59 -9.723 6.788 -6.521 1.00 1.36 H ATOM 883 HG SER A 59 -10.305 4.555 -7.642 1.00 2.14 H ATOM 884 N ILE A 60 -8.047 5.806 -3.859 1.00 0.50 N ATOM 885 CA ILE A 60 -7.671 6.381 -2.592 1.00 0.48 C ATOM 886 C ILE A 60 -7.733 7.901 -2.716 1.00 0.53 C ATOM 887 O ILE A 60 -6.996 8.486 -3.501 1.00 0.63 O ATOM 888 CB ILE A 60 -6.247 5.934 -2.151 1.00 0.48 C ATOM 889 CG1 ILE A 60 -6.139 4.393 -2.089 1.00 0.64 C ATOM 890 CG2 ILE A 60 -5.879 6.538 -0.797 1.00 0.53 C ATOM 891 CD1 ILE A 60 -7.112 3.728 -1.128 1.00 0.75 C ATOM 892 H ILE A 60 -7.358 5.660 -4.555 1.00 0.50 H ATOM 893 HA ILE A 60 -8.400 6.053 -1.863 1.00 0.59 H ATOM 894 HB ILE A 60 -5.531 6.297 -2.877 1.00 0.50 H ATOM 895 HG12 ILE A 60 -6.316 3.997 -3.077 1.00 1.29 H ATOM 896 HG13 ILE A 60 -5.136 4.140 -1.776 1.00 1.27 H ATOM 897 HG21 ILE A 60 -4.889 6.202 -0.529 1.00 1.01 H ATOM 898 HG22 ILE A 60 -6.582 6.195 -0.057 1.00 1.13 H ATOM 899 HG23 ILE A 60 -5.892 7.616 -0.856 1.00 1.23 H ATOM 900 HD11 ILE A 60 -6.929 4.103 -0.132 1.00 1.11 H ATOM 901 HD12 ILE A 60 -6.943 2.663 -1.154 1.00 1.35 H ATOM 902 HD13 ILE A 60 -8.131 3.941 -1.419 1.00 1.64 H ATOM 903 N PRO A 61 -8.649 8.549 -1.982 1.00 0.65 N ATOM 904 CA PRO A 61 -8.828 10.003 -2.042 1.00 0.77 C ATOM 905 C PRO A 61 -7.561 10.773 -1.653 1.00 0.65 C ATOM 906 O PRO A 61 -6.837 10.381 -0.724 1.00 0.57 O ATOM 907 CB PRO A 61 -9.951 10.268 -1.034 1.00 0.97 C ATOM 908 CG PRO A 61 -10.650 8.964 -0.901 1.00 1.08 C ATOM 909 CD PRO A 61 -9.596 7.921 -1.050 1.00 0.83 C ATOM 910 HA PRO A 61 -9.143 10.324 -3.024 1.00 0.88 H ATOM 911 HB2 PRO A 61 -9.538 10.589 -0.089 1.00 0.93 H ATOM 912 HB3 PRO A 61 -10.606 11.032 -1.428 1.00 1.15 H ATOM 913 HG2 PRO A 61 -11.138 8.884 0.058 1.00 1.24 H ATOM 914 HG3 PRO A 61 -11.381 8.864 -1.684 1.00 1.25 H ATOM 915 HD2 PRO A 61 -9.138 7.726 -0.091 1.00 0.83 H ATOM 916 HD3 PRO A 61 -10.009 7.016 -1.473 1.00 0.88 H ATOM 917 N ASP A 62 -7.346 11.884 -2.346 1.00 0.74 N ATOM 918 CA ASP A 62 -6.152 12.763 -2.206 1.00 0.73 C ATOM 919 C ASP A 62 -5.842 13.101 -0.753 1.00 0.62 C ATOM 920 O ASP A 62 -4.714 12.921 -0.286 1.00 0.64 O ATOM 921 CB ASP A 62 -6.363 14.076 -2.967 1.00 0.93 C ATOM 922 CG ASP A 62 -6.518 13.913 -4.458 1.00 1.44 C ATOM 923 OD1 ASP A 62 -7.626 13.538 -4.916 1.00 1.92 O ATOM 924 OD2 ASP A 62 -5.559 14.219 -5.198 1.00 2.07 O ATOM 925 H ASP A 62 -8.034 12.135 -3.002 1.00 0.89 H ATOM 926 HA ASP A 62 -5.307 12.255 -2.646 1.00 0.74 H ATOM 927 HB2 ASP A 62 -7.256 14.554 -2.588 1.00 1.42 H ATOM 928 HB3 ASP A 62 -5.511 14.718 -2.789 1.00 1.50 H ATOM 929 N ASP A 63 -6.842 13.600 -0.053 1.00 0.63 N ATOM 930 CA ASP A 63 -6.713 14.001 1.359 1.00 0.61 C ATOM 931 C ASP A 63 -6.476 12.797 2.239 1.00 0.59 C ATOM 932 O ASP A 63 -5.627 12.803 3.129 1.00 0.64 O ATOM 933 CB ASP A 63 -7.999 14.669 1.859 1.00 0.77 C ATOM 934 CG ASP A 63 -8.415 15.892 1.076 1.00 1.36 C ATOM 935 OD1 ASP A 63 -8.909 15.739 -0.064 1.00 2.00 O ATOM 936 OD2 ASP A 63 -8.216 17.030 1.594 1.00 2.10 O ATOM 937 H ASP A 63 -7.698 13.746 -0.505 1.00 0.73 H ATOM 938 HA ASP A 63 -5.899 14.702 1.455 1.00 0.64 H ATOM 939 HB2 ASP A 63 -8.806 13.952 1.827 1.00 1.22 H ATOM 940 HB3 ASP A 63 -7.826 14.956 2.886 1.00 1.43 H ATOM 941 N VAL A 64 -7.215 11.753 1.956 1.00 0.62 N ATOM 942 CA VAL A 64 -7.242 10.562 2.778 1.00 0.69 C ATOM 943 C VAL A 64 -5.952 9.733 2.639 1.00 0.67 C ATOM 944 O VAL A 64 -5.649 8.876 3.469 1.00 0.78 O ATOM 945 CB VAL A 64 -8.519 9.722 2.504 1.00 0.82 C ATOM 946 CG1 VAL A 64 -8.642 8.558 3.458 1.00 0.98 C ATOM 947 CG2 VAL A 64 -9.753 10.603 2.597 1.00 0.90 C ATOM 948 H VAL A 64 -7.754 11.784 1.137 1.00 0.65 H ATOM 949 HA VAL A 64 -7.286 10.911 3.801 1.00 0.75 H ATOM 950 HB VAL A 64 -8.471 9.322 1.503 1.00 0.81 H ATOM 951 HG11 VAL A 64 -9.554 8.022 3.250 1.00 1.47 H ATOM 952 HG12 VAL A 64 -8.664 8.923 4.474 1.00 1.46 H ATOM 953 HG13 VAL A 64 -7.795 7.901 3.338 1.00 1.30 H ATOM 954 HG21 VAL A 64 -9.835 11.034 3.585 1.00 1.40 H ATOM 955 HG22 VAL A 64 -10.627 10.005 2.386 1.00 1.21 H ATOM 956 HG23 VAL A 64 -9.682 11.392 1.863 1.00 1.47 H ATOM 957 N ALA A 65 -5.176 10.029 1.607 1.00 0.61 N ATOM 958 CA ALA A 65 -3.887 9.387 1.401 1.00 0.67 C ATOM 959 C ALA A 65 -2.895 9.858 2.478 1.00 0.64 C ATOM 960 O ALA A 65 -2.007 9.117 2.898 1.00 0.74 O ATOM 961 CB ALA A 65 -3.365 9.690 0.000 1.00 0.77 C ATOM 962 H ALA A 65 -5.492 10.692 0.954 1.00 0.61 H ATOM 963 HA ALA A 65 -4.018 8.318 1.504 1.00 0.76 H ATOM 964 HB1 ALA A 65 -2.427 9.180 -0.153 1.00 1.31 H ATOM 965 HB2 ALA A 65 -3.227 10.757 -0.104 1.00 1.30 H ATOM 966 HB3 ALA A 65 -4.085 9.349 -0.731 1.00 1.19 H ATOM 967 N GLY A 66 -3.116 11.065 2.991 1.00 0.58 N ATOM 968 CA GLY A 66 -2.240 11.625 4.004 1.00 0.66 C ATOM 969 C GLY A 66 -2.649 11.205 5.401 1.00 0.68 C ATOM 970 O GLY A 66 -2.662 12.014 6.345 1.00 0.86 O ATOM 971 H GLY A 66 -3.899 11.573 2.689 1.00 0.56 H ATOM 972 HA2 GLY A 66 -1.238 11.266 3.819 1.00 0.71 H ATOM 973 HA3 GLY A 66 -2.259 12.703 3.936 1.00 0.76 H ATOM 974 N ARG A 67 -3.018 9.948 5.536 1.00 0.64 N ATOM 975 CA ARG A 67 -3.423 9.386 6.810 1.00 0.79 C ATOM 976 C ARG A 67 -2.606 8.156 7.120 1.00 0.77 C ATOM 977 O ARG A 67 -2.795 7.513 8.143 1.00 0.95 O ATOM 978 CB ARG A 67 -4.930 9.034 6.800 1.00 0.94 C ATOM 979 CG ARG A 67 -5.857 10.213 6.537 1.00 1.12 C ATOM 980 CD ARG A 67 -5.668 11.294 7.580 1.00 1.40 C ATOM 981 NE ARG A 67 -6.460 12.494 7.320 1.00 1.89 N ATOM 982 CZ ARG A 67 -5.942 13.735 7.244 1.00 2.51 C ATOM 983 NH1 ARG A 67 -4.616 13.913 7.156 1.00 2.93 N ATOM 984 NH2 ARG A 67 -6.732 14.780 7.204 1.00 3.22 N ATOM 985 H ARG A 67 -3.029 9.375 4.738 1.00 0.62 H ATOM 986 HA ARG A 67 -3.242 10.125 7.574 1.00 0.90 H ATOM 987 HB2 ARG A 67 -5.101 8.303 6.023 1.00 1.03 H ATOM 988 HB3 ARG A 67 -5.194 8.591 7.748 1.00 1.14 H ATOM 989 HG2 ARG A 67 -5.646 10.627 5.561 1.00 1.53 H ATOM 990 HG3 ARG A 67 -6.873 9.851 6.580 1.00 1.58 H ATOM 991 HD2 ARG A 67 -5.950 10.919 8.554 1.00 1.87 H ATOM 992 HD3 ARG A 67 -4.623 11.572 7.586 1.00 1.90 H ATOM 993 HE ARG A 67 -7.429 12.327 7.268 1.00 2.27 H ATOM 994 HH11 ARG A 67 -3.975 13.139 7.125 1.00 2.92 H ATOM 995 HH12 ARG A 67 -4.220 14.834 7.112 1.00 3.61 H ATOM 996 HH21 ARG A 67 -7.736 14.716 7.217 1.00 3.51 H ATOM 997 HH22 ARG A 67 -6.345 15.712 7.164 1.00 3.77 H ATOM 998 N VAL A 68 -1.691 7.833 6.234 1.00 0.62 N ATOM 999 CA VAL A 68 -0.876 6.657 6.417 1.00 0.66 C ATOM 1000 C VAL A 68 0.536 7.034 6.894 1.00 0.67 C ATOM 1001 O VAL A 68 1.306 7.701 6.193 1.00 1.00 O ATOM 1002 CB VAL A 68 -0.814 5.769 5.119 1.00 0.68 C ATOM 1003 CG1 VAL A 68 -2.189 5.220 4.785 1.00 0.77 C ATOM 1004 CG2 VAL A 68 -0.255 6.529 3.916 1.00 0.64 C ATOM 1005 H VAL A 68 -1.537 8.395 5.445 1.00 0.55 H ATOM 1006 HA VAL A 68 -1.338 6.075 7.204 1.00 0.78 H ATOM 1007 HB VAL A 68 -0.172 4.925 5.329 1.00 0.78 H ATOM 1008 HG11 VAL A 68 -2.137 4.613 3.894 1.00 1.27 H ATOM 1009 HG12 VAL A 68 -2.875 6.034 4.605 1.00 1.31 H ATOM 1010 HG13 VAL A 68 -2.542 4.620 5.611 1.00 1.26 H ATOM 1011 HG21 VAL A 68 0.748 6.876 4.122 1.00 1.20 H ATOM 1012 HG22 VAL A 68 -0.886 7.371 3.673 1.00 1.23 H ATOM 1013 HG23 VAL A 68 -0.222 5.856 3.072 1.00 1.15 H ATOM 1014 N ASP A 69 0.817 6.709 8.118 1.00 0.54 N ATOM 1015 CA ASP A 69 2.145 6.891 8.701 1.00 0.64 C ATOM 1016 C ASP A 69 2.896 5.593 8.531 1.00 0.50 C ATOM 1017 O ASP A 69 4.111 5.566 8.284 1.00 0.54 O ATOM 1018 CB ASP A 69 2.006 7.257 10.195 1.00 0.99 C ATOM 1019 CG ASP A 69 3.310 7.291 10.991 1.00 1.11 C ATOM 1020 OD1 ASP A 69 4.115 8.257 10.834 1.00 1.37 O ATOM 1021 OD2 ASP A 69 3.481 6.427 11.878 1.00 1.84 O ATOM 1022 H ASP A 69 0.127 6.280 8.682 1.00 0.66 H ATOM 1023 HA ASP A 69 2.660 7.678 8.172 1.00 0.75 H ATOM 1024 HB2 ASP A 69 1.553 8.233 10.278 1.00 1.65 H ATOM 1025 HB3 ASP A 69 1.348 6.533 10.651 1.00 1.55 H ATOM 1026 N THR A 70 2.138 4.519 8.587 1.00 0.43 N ATOM 1027 CA THR A 70 2.658 3.197 8.459 1.00 0.37 C ATOM 1028 C THR A 70 1.808 2.373 7.469 1.00 0.33 C ATOM 1029 O THR A 70 0.623 2.673 7.254 1.00 0.34 O ATOM 1030 CB THR A 70 2.637 2.508 9.835 1.00 0.42 C ATOM 1031 OG1 THR A 70 1.325 2.642 10.405 1.00 0.51 O ATOM 1032 CG2 THR A 70 3.675 3.095 10.784 1.00 0.44 C ATOM 1033 H THR A 70 1.171 4.635 8.733 1.00 0.50 H ATOM 1034 HA THR A 70 3.680 3.257 8.117 1.00 0.40 H ATOM 1035 HB THR A 70 2.838 1.457 9.684 1.00 0.46 H ATOM 1036 HG1 THR A 70 1.050 3.564 10.312 1.00 0.52 H ATOM 1037 HG21 THR A 70 3.613 2.601 11.744 1.00 1.19 H ATOM 1038 HG22 THR A 70 3.493 4.152 10.917 1.00 1.03 H ATOM 1039 HG23 THR A 70 4.658 2.947 10.360 1.00 1.11 H ATOM 1040 N PRO A 71 2.406 1.328 6.826 1.00 0.32 N ATOM 1041 CA PRO A 71 1.693 0.384 5.929 1.00 0.31 C ATOM 1042 C PRO A 71 0.538 -0.324 6.624 1.00 0.29 C ATOM 1043 O PRO A 71 -0.353 -0.857 5.974 1.00 0.33 O ATOM 1044 CB PRO A 71 2.773 -0.630 5.567 1.00 0.34 C ATOM 1045 CG PRO A 71 4.011 0.165 5.629 1.00 0.38 C ATOM 1046 CD PRO A 71 3.846 1.037 6.839 1.00 0.36 C ATOM 1047 HA PRO A 71 1.333 0.869 5.033 1.00 0.35 H ATOM 1048 HB2 PRO A 71 2.769 -1.419 6.307 1.00 0.33 H ATOM 1049 HB3 PRO A 71 2.582 -1.031 4.585 1.00 0.41 H ATOM 1050 HG2 PRO A 71 4.862 -0.490 5.739 1.00 0.40 H ATOM 1051 HG3 PRO A 71 4.114 0.763 4.734 1.00 0.43 H ATOM 1052 HD2 PRO A 71 4.137 0.494 7.726 1.00 0.36 H ATOM 1053 HD3 PRO A 71 4.428 1.945 6.745 1.00 0.41 H ATOM 1054 N ARG A 72 0.578 -0.329 7.955 1.00 0.30 N ATOM 1055 CA ARG A 72 -0.499 -0.865 8.786 1.00 0.34 C ATOM 1056 C ARG A 72 -1.797 -0.151 8.413 1.00 0.36 C ATOM 1057 O ARG A 72 -2.786 -0.766 8.055 1.00 0.43 O ATOM 1058 CB ARG A 72 -0.177 -0.576 10.264 1.00 0.41 C ATOM 1059 CG ARG A 72 -1.247 -1.002 11.264 1.00 0.54 C ATOM 1060 CD ARG A 72 -0.938 -0.440 12.651 1.00 0.69 C ATOM 1061 NE ARG A 72 -0.955 1.042 12.648 1.00 0.75 N ATOM 1062 CZ ARG A 72 0.032 1.839 13.123 1.00 0.98 C ATOM 1063 NH1 ARG A 72 1.143 1.300 13.624 1.00 1.38 N ATOM 1064 NH2 ARG A 72 -0.085 3.171 13.064 1.00 1.16 N ATOM 1065 H ARG A 72 1.381 0.043 8.381 1.00 0.31 H ATOM 1066 HA ARG A 72 -0.590 -1.931 8.637 1.00 0.37 H ATOM 1067 HB2 ARG A 72 0.740 -1.082 10.537 1.00 0.47 H ATOM 1068 HB3 ARG A 72 -0.016 0.487 10.381 1.00 0.43 H ATOM 1069 HG2 ARG A 72 -2.214 -0.661 10.927 1.00 0.56 H ATOM 1070 HG3 ARG A 72 -1.260 -2.079 11.319 1.00 0.63 H ATOM 1071 HD2 ARG A 72 -1.682 -0.816 13.339 1.00 0.82 H ATOM 1072 HD3 ARG A 72 0.045 -0.777 12.953 1.00 0.79 H ATOM 1073 HE ARG A 72 -1.763 1.436 12.251 1.00 0.96 H ATOM 1074 HH11 ARG A 72 1.322 0.312 13.684 1.00 1.51 H ATOM 1075 HH12 ARG A 72 1.899 1.869 13.973 1.00 1.75 H ATOM 1076 HH21 ARG A 72 -0.875 3.670 12.682 1.00 1.26 H ATOM 1077 HH22 ARG A 72 0.658 3.783 13.372 1.00 1.42 H ATOM 1078 N GLU A 73 -1.710 1.158 8.407 1.00 0.37 N ATOM 1079 CA GLU A 73 -2.841 2.037 8.165 1.00 0.42 C ATOM 1080 C GLU A 73 -3.212 2.034 6.696 1.00 0.40 C ATOM 1081 O GLU A 73 -4.342 2.323 6.333 1.00 0.44 O ATOM 1082 CB GLU A 73 -2.466 3.429 8.641 1.00 0.50 C ATOM 1083 CG GLU A 73 -2.028 3.403 10.090 1.00 0.63 C ATOM 1084 CD GLU A 73 -1.294 4.631 10.522 1.00 0.74 C ATOM 1085 OE1 GLU A 73 -0.391 5.084 9.780 1.00 0.69 O ATOM 1086 OE2 GLU A 73 -1.698 5.231 11.547 1.00 1.33 O ATOM 1087 H GLU A 73 -0.834 1.572 8.570 1.00 0.36 H ATOM 1088 HA GLU A 73 -3.672 1.680 8.751 1.00 0.45 H ATOM 1089 HB2 GLU A 73 -1.657 3.808 8.033 1.00 0.50 H ATOM 1090 HB3 GLU A 73 -3.327 4.076 8.552 1.00 0.58 H ATOM 1091 HG2 GLU A 73 -2.905 3.298 10.710 1.00 1.01 H ATOM 1092 HG3 GLU A 73 -1.395 2.538 10.234 1.00 0.99 H ATOM 1093 N LEU A 74 -2.243 1.689 5.860 1.00 0.40 N ATOM 1094 CA LEU A 74 -2.455 1.558 4.421 1.00 0.43 C ATOM 1095 C LEU A 74 -3.436 0.391 4.210 1.00 0.41 C ATOM 1096 O LEU A 74 -4.390 0.489 3.426 1.00 0.42 O ATOM 1097 CB LEU A 74 -1.086 1.278 3.728 1.00 0.44 C ATOM 1098 CG LEU A 74 -0.943 1.542 2.211 1.00 0.50 C ATOM 1099 CD1 LEU A 74 0.470 1.229 1.772 1.00 1.04 C ATOM 1100 CD2 LEU A 74 -1.924 0.739 1.385 1.00 1.10 C ATOM 1101 H LEU A 74 -1.358 1.521 6.242 1.00 0.42 H ATOM 1102 HA LEU A 74 -2.896 2.466 4.038 1.00 0.46 H ATOM 1103 HB2 LEU A 74 -0.326 1.868 4.221 1.00 0.46 H ATOM 1104 HB3 LEU A 74 -0.836 0.239 3.898 1.00 0.45 H ATOM 1105 HG LEU A 74 -1.111 2.596 2.035 1.00 0.90 H ATOM 1106 HD11 LEU A 74 0.688 0.195 1.985 1.00 1.74 H ATOM 1107 HD12 LEU A 74 1.153 1.853 2.328 1.00 1.51 H ATOM 1108 HD13 LEU A 74 0.573 1.410 0.713 1.00 1.48 H ATOM 1109 HD21 LEU A 74 -1.769 -0.315 1.559 1.00 1.61 H ATOM 1110 HD22 LEU A 74 -1.797 0.954 0.334 1.00 1.53 H ATOM 1111 HD23 LEU A 74 -2.927 1.004 1.695 1.00 1.77 H ATOM 1112 N LEU A 75 -3.211 -0.685 4.959 1.00 0.41 N ATOM 1113 CA LEU A 75 -4.049 -1.873 4.899 1.00 0.41 C ATOM 1114 C LEU A 75 -5.447 -1.516 5.403 1.00 0.39 C ATOM 1115 O LEU A 75 -6.445 -1.725 4.693 1.00 0.37 O ATOM 1116 CB LEU A 75 -3.447 -2.990 5.771 1.00 0.46 C ATOM 1117 CG LEU A 75 -4.104 -4.363 5.664 1.00 0.48 C ATOM 1118 CD1 LEU A 75 -3.829 -5.003 4.306 1.00 0.51 C ATOM 1119 CD2 LEU A 75 -3.636 -5.262 6.794 1.00 0.54 C ATOM 1120 H LEU A 75 -2.454 -0.676 5.583 1.00 0.44 H ATOM 1121 HA LEU A 75 -4.114 -2.206 3.875 1.00 0.43 H ATOM 1122 HB2 LEU A 75 -2.402 -3.103 5.521 1.00 0.49 H ATOM 1123 HB3 LEU A 75 -3.511 -2.671 6.800 1.00 0.48 H ATOM 1124 HG LEU A 75 -5.176 -4.247 5.744 1.00 0.46 H ATOM 1125 HD11 LEU A 75 -4.336 -5.956 4.267 1.00 1.20 H ATOM 1126 HD12 LEU A 75 -2.766 -5.169 4.193 1.00 1.09 H ATOM 1127 HD13 LEU A 75 -4.197 -4.367 3.515 1.00 1.04 H ATOM 1128 HD21 LEU A 75 -4.106 -6.230 6.703 1.00 1.17 H ATOM 1129 HD22 LEU A 75 -3.921 -4.809 7.732 1.00 1.16 H ATOM 1130 HD23 LEU A 75 -2.563 -5.376 6.755 1.00 1.11 H ATOM 1131 N ASP A 76 -5.493 -0.927 6.615 1.00 0.44 N ATOM 1132 CA ASP A 76 -6.748 -0.455 7.249 1.00 0.48 C ATOM 1133 C ASP A 76 -7.584 0.361 6.292 1.00 0.40 C ATOM 1134 O ASP A 76 -8.773 0.097 6.111 1.00 0.44 O ATOM 1135 CB ASP A 76 -6.475 0.432 8.484 1.00 0.66 C ATOM 1136 CG ASP A 76 -6.183 -0.291 9.783 1.00 1.06 C ATOM 1137 OD1 ASP A 76 -5.121 -0.952 9.871 1.00 1.89 O ATOM 1138 OD2 ASP A 76 -7.027 -0.294 10.692 1.00 1.08 O ATOM 1139 H ASP A 76 -4.652 -0.831 7.115 1.00 0.49 H ATOM 1140 HA ASP A 76 -7.298 -1.326 7.564 1.00 0.53 H ATOM 1141 HB2 ASP A 76 -5.620 1.054 8.273 1.00 1.10 H ATOM 1142 HB3 ASP A 76 -7.330 1.076 8.626 1.00 1.09 H ATOM 1143 N LEU A 77 -6.950 1.348 5.681 1.00 0.37 N ATOM 1144 CA LEU A 77 -7.598 2.280 4.784 1.00 0.38 C ATOM 1145 C LEU A 77 -8.269 1.570 3.604 1.00 0.33 C ATOM 1146 O LEU A 77 -9.431 1.829 3.301 1.00 0.34 O ATOM 1147 CB LEU A 77 -6.581 3.318 4.288 1.00 0.46 C ATOM 1148 CG LEU A 77 -7.124 4.446 3.426 1.00 0.57 C ATOM 1149 CD1 LEU A 77 -8.173 5.213 4.189 1.00 1.37 C ATOM 1150 CD2 LEU A 77 -5.996 5.369 2.985 1.00 1.24 C ATOM 1151 H LEU A 77 -5.987 1.457 5.858 1.00 0.40 H ATOM 1152 HA LEU A 77 -8.358 2.801 5.350 1.00 0.45 H ATOM 1153 HB2 LEU A 77 -6.111 3.766 5.152 1.00 0.58 H ATOM 1154 HB3 LEU A 77 -5.827 2.801 3.717 1.00 0.49 H ATOM 1155 HG LEU A 77 -7.593 4.035 2.547 1.00 1.09 H ATOM 1156 HD11 LEU A 77 -8.550 6.019 3.577 1.00 1.82 H ATOM 1157 HD12 LEU A 77 -7.716 5.619 5.079 1.00 1.74 H ATOM 1158 HD13 LEU A 77 -8.978 4.541 4.452 1.00 2.11 H ATOM 1159 HD21 LEU A 77 -6.401 6.159 2.371 1.00 1.84 H ATOM 1160 HD22 LEU A 77 -5.266 4.810 2.417 1.00 1.74 H ATOM 1161 HD23 LEU A 77 -5.520 5.807 3.850 1.00 1.79 H ATOM 1162 N ILE A 78 -7.569 0.645 2.986 1.00 0.31 N ATOM 1163 CA ILE A 78 -8.096 -0.015 1.824 1.00 0.32 C ATOM 1164 C ILE A 78 -9.154 -1.039 2.208 1.00 0.29 C ATOM 1165 O ILE A 78 -10.218 -1.106 1.577 1.00 0.33 O ATOM 1166 CB ILE A 78 -6.981 -0.632 0.931 1.00 0.39 C ATOM 1167 CG1 ILE A 78 -6.057 0.490 0.431 1.00 0.53 C ATOM 1168 CG2 ILE A 78 -7.582 -1.399 -0.247 1.00 0.44 C ATOM 1169 CD1 ILE A 78 -5.004 0.052 -0.561 1.00 0.63 C ATOM 1170 H ILE A 78 -6.685 0.383 3.327 1.00 0.33 H ATOM 1171 HA ILE A 78 -8.600 0.756 1.260 1.00 0.39 H ATOM 1172 HB ILE A 78 -6.403 -1.319 1.529 1.00 0.40 H ATOM 1173 HG12 ILE A 78 -6.669 1.229 -0.066 1.00 1.11 H ATOM 1174 HG13 ILE A 78 -5.562 0.939 1.283 1.00 1.01 H ATOM 1175 HG21 ILE A 78 -8.177 -0.725 -0.847 1.00 1.18 H ATOM 1176 HG22 ILE A 78 -8.210 -2.200 0.117 1.00 0.99 H ATOM 1177 HG23 ILE A 78 -6.788 -1.809 -0.856 1.00 1.11 H ATOM 1178 HD11 ILE A 78 -4.367 -0.700 -0.119 1.00 1.29 H ATOM 1179 HD12 ILE A 78 -4.416 0.918 -0.832 1.00 1.27 H ATOM 1180 HD13 ILE A 78 -5.484 -0.343 -1.447 1.00 1.30 H ATOM 1181 N ASN A 79 -8.891 -1.795 3.266 1.00 0.30 N ATOM 1182 CA ASN A 79 -9.847 -2.787 3.754 1.00 0.33 C ATOM 1183 C ASN A 79 -11.141 -2.109 4.187 1.00 0.37 C ATOM 1184 O ASN A 79 -12.242 -2.611 3.929 1.00 0.46 O ATOM 1185 CB ASN A 79 -9.289 -3.608 4.931 1.00 0.42 C ATOM 1186 CG ASN A 79 -8.092 -4.498 4.603 1.00 0.53 C ATOM 1187 OD1 ASN A 79 -7.275 -4.771 5.455 1.00 1.21 O ATOM 1188 ND2 ASN A 79 -7.981 -4.952 3.380 1.00 0.55 N ATOM 1189 H ASN A 79 -8.038 -1.683 3.746 1.00 0.32 H ATOM 1190 HA ASN A 79 -10.067 -3.450 2.929 1.00 0.39 H ATOM 1191 HB2 ASN A 79 -8.970 -2.929 5.706 1.00 0.48 H ATOM 1192 HB3 ASN A 79 -10.087 -4.222 5.316 1.00 0.47 H ATOM 1193 HD21 ASN A 79 -8.656 -4.712 2.717 1.00 1.07 H ATOM 1194 HD22 ASN A 79 -7.195 -5.514 3.204 1.00 0.51 H ATOM 1195 N GLY A 80 -11.000 -0.966 4.824 1.00 0.37 N ATOM 1196 CA GLY A 80 -12.138 -0.209 5.276 1.00 0.46 C ATOM 1197 C GLY A 80 -12.924 0.356 4.118 1.00 0.47 C ATOM 1198 O GLY A 80 -14.150 0.260 4.104 1.00 0.57 O ATOM 1199 H GLY A 80 -10.100 -0.612 5.009 1.00 0.36 H ATOM 1200 HA2 GLY A 80 -12.779 -0.850 5.860 1.00 0.53 H ATOM 1201 HA3 GLY A 80 -11.804 0.608 5.896 1.00 0.49 H ATOM 1202 N ALA A 81 -12.217 0.895 3.118 1.00 0.43 N ATOM 1203 CA ALA A 81 -12.858 1.473 1.962 1.00 0.49 C ATOM 1204 C ALA A 81 -13.611 0.410 1.175 1.00 0.54 C ATOM 1205 O ALA A 81 -14.666 0.680 0.620 1.00 0.68 O ATOM 1206 CB ALA A 81 -11.839 2.185 1.094 1.00 0.49 C ATOM 1207 H ALA A 81 -11.233 0.920 3.140 1.00 0.39 H ATOM 1208 HA ALA A 81 -13.576 2.201 2.312 1.00 0.55 H ATOM 1209 HB1 ALA A 81 -11.141 1.466 0.697 1.00 1.19 H ATOM 1210 HB2 ALA A 81 -11.305 2.914 1.684 1.00 1.14 H ATOM 1211 HB3 ALA A 81 -12.351 2.685 0.289 1.00 1.01 H ATOM 1212 N LEU A 82 -13.075 -0.803 1.158 1.00 0.48 N ATOM 1213 CA LEU A 82 -13.728 -1.932 0.498 1.00 0.57 C ATOM 1214 C LEU A 82 -15.084 -2.218 1.128 1.00 0.70 C ATOM 1215 O LEU A 82 -16.048 -2.497 0.430 1.00 0.87 O ATOM 1216 CB LEU A 82 -12.850 -3.197 0.542 1.00 0.54 C ATOM 1217 CG LEU A 82 -11.600 -3.220 -0.337 1.00 0.55 C ATOM 1218 CD1 LEU A 82 -10.792 -4.478 -0.052 1.00 0.61 C ATOM 1219 CD2 LEU A 82 -11.987 -3.199 -1.801 1.00 0.63 C ATOM 1220 H LEU A 82 -12.204 -0.926 1.596 1.00 0.42 H ATOM 1221 HA LEU A 82 -13.885 -1.657 -0.534 1.00 0.62 H ATOM 1222 HB2 LEU A 82 -12.515 -3.351 1.559 1.00 0.56 H ATOM 1223 HB3 LEU A 82 -13.458 -4.045 0.258 1.00 0.59 H ATOM 1224 HG LEU A 82 -10.989 -2.353 -0.130 1.00 0.57 H ATOM 1225 HD11 LEU A 82 -10.494 -4.479 0.985 1.00 1.16 H ATOM 1226 HD12 LEU A 82 -9.923 -4.511 -0.692 1.00 1.10 H ATOM 1227 HD13 LEU A 82 -11.412 -5.339 -0.242 1.00 1.22 H ATOM 1228 HD21 LEU A 82 -12.588 -4.069 -2.016 1.00 1.12 H ATOM 1229 HD22 LEU A 82 -11.089 -3.221 -2.402 1.00 1.26 H ATOM 1230 HD23 LEU A 82 -12.552 -2.303 -2.005 1.00 1.22 H ATOM 1231 N ALA A 83 -15.168 -2.079 2.440 1.00 0.69 N ATOM 1232 CA ALA A 83 -16.404 -2.350 3.143 1.00 0.87 C ATOM 1233 C ALA A 83 -17.386 -1.200 3.026 1.00 1.01 C ATOM 1234 O ALA A 83 -18.561 -1.362 3.299 1.00 1.25 O ATOM 1235 CB ALA A 83 -16.156 -2.708 4.589 1.00 0.90 C ATOM 1236 H ALA A 83 -14.384 -1.775 2.945 1.00 0.62 H ATOM 1237 HA ALA A 83 -16.851 -3.207 2.661 1.00 0.97 H ATOM 1238 HB1 ALA A 83 -17.103 -3.001 5.018 1.00 1.39 H ATOM 1239 HB2 ALA A 83 -15.764 -1.849 5.112 1.00 1.30 H ATOM 1240 HB3 ALA A 83 -15.467 -3.537 4.639 1.00 1.25 H ATOM 1241 N GLU A 84 -16.921 -0.029 2.601 1.00 0.95 N ATOM 1242 CA GLU A 84 -17.840 1.088 2.393 1.00 1.11 C ATOM 1243 C GLU A 84 -18.564 0.925 1.061 1.00 1.18 C ATOM 1244 O GLU A 84 -19.548 1.618 0.773 1.00 1.36 O ATOM 1245 CB GLU A 84 -17.149 2.458 2.485 1.00 1.15 C ATOM 1246 CG GLU A 84 -16.560 2.759 3.856 1.00 1.57 C ATOM 1247 CD GLU A 84 -16.261 4.229 4.062 1.00 1.76 C ATOM 1248 OE1 GLU A 84 -15.141 4.664 3.699 1.00 1.86 O ATOM 1249 OE2 GLU A 84 -17.121 4.981 4.571 1.00 2.49 O ATOM 1250 H GLU A 84 -15.962 0.086 2.428 1.00 0.84 H ATOM 1251 HA GLU A 84 -18.585 1.009 3.172 1.00 1.28 H ATOM 1252 HB2 GLU A 84 -16.335 2.478 1.774 1.00 1.60 H ATOM 1253 HB3 GLU A 84 -17.856 3.237 2.231 1.00 1.38 H ATOM 1254 HG2 GLU A 84 -17.266 2.447 4.610 1.00 2.14 H ATOM 1255 HG3 GLU A 84 -15.648 2.197 3.978 1.00 2.20 H ATOM 1256 N ALA A 85 -18.071 -0.005 0.262 1.00 1.15 N ATOM 1257 CA ALA A 85 -18.690 -0.357 -0.994 1.00 1.34 C ATOM 1258 C ALA A 85 -19.556 -1.594 -0.793 1.00 1.47 C ATOM 1259 O ALA A 85 -20.279 -2.028 -1.705 1.00 1.86 O ATOM 1260 CB ALA A 85 -17.627 -0.623 -2.054 1.00 1.37 C ATOM 1261 H ALA A 85 -17.257 -0.484 0.534 1.00 1.07 H ATOM 1262 HA ALA A 85 -19.314 0.465 -1.315 1.00 1.54 H ATOM 1263 HB1 ALA A 85 -17.005 -1.443 -1.729 1.00 1.61 H ATOM 1264 HB2 ALA A 85 -17.022 0.261 -2.186 1.00 1.71 H ATOM 1265 HB3 ALA A 85 -18.100 -0.882 -2.990 1.00 1.82 H ATOM 1266 N ALA A 86 -19.495 -2.141 0.414 1.00 1.53 N ATOM 1267 CA ALA A 86 -20.225 -3.322 0.769 1.00 1.70 C ATOM 1268 C ALA A 86 -21.480 -2.933 1.542 1.00 2.36 C ATOM 1269 O ALA A 86 -22.492 -2.546 0.901 1.00 2.86 O ATOM 1270 CB ALA A 86 -19.340 -4.262 1.589 1.00 2.39 C ATOM 1271 OXT ALA A 86 -21.471 -2.981 2.780 1.00 3.03 O ATOM 1272 H ALA A 86 -18.967 -1.710 1.116 1.00 1.73 H ATOM 1273 HA ALA A 86 -20.497 -3.822 -0.143 1.00 1.65 H ATOM 1274 HB1 ALA A 86 -19.032 -3.765 2.496 1.00 2.96 H ATOM 1275 HB2 ALA A 86 -18.473 -4.514 0.998 1.00 2.75 H ATOM 1276 HB3 ALA A 86 -19.885 -5.162 1.826 1.00 2.71 H TER 1277 ALA A 86 HETATM 1278 P24 SXR A 101 5.303 12.535 -4.405 1.00 1.19 P HETATM 1279 O26 SXR A 101 6.219 12.930 -5.566 1.00 1.72 O HETATM 1280 O23 SXR A 101 5.023 13.623 -3.308 1.00 1.83 O HETATM 1281 O27 SXR A 101 3.910 12.144 -5.020 1.00 1.31 O HETATM 1282 C28 SXR A 101 3.820 11.113 -6.090 1.00 1.24 C HETATM 1283 C29 SXR A 101 3.298 11.687 -7.430 1.00 1.82 C HETATM 1284 C30 SXR A 101 3.105 10.510 -8.361 1.00 2.42 C HETATM 1285 C31 SXR A 101 1.933 12.361 -7.183 1.00 1.85 C HETATM 1286 C32 SXR A 101 4.361 12.725 -8.054 1.00 2.74 C HETATM 1287 O33 SXR A 101 4.532 13.858 -7.194 1.00 3.00 O HETATM 1288 C34 SXR A 101 3.952 13.240 -9.443 1.00 3.44 C HETATM 1289 O35 SXR A 101 4.572 12.895 -10.457 1.00 3.88 O HETATM 1290 N36 SXR A 101 2.942 14.075 -9.469 1.00 3.90 N HETATM 1291 C37 SXR A 101 2.387 14.699 -10.673 1.00 4.60 C HETATM 1292 C38 SXR A 101 0.872 14.763 -10.598 1.00 4.73 C HETATM 1293 C39 SXR A 101 0.254 13.379 -10.572 1.00 4.02 C HETATM 1294 O40 SXR A 101 0.366 12.589 -11.539 1.00 4.42 O HETATM 1295 N41 SXR A 101 -0.404 13.091 -9.450 1.00 3.33 N HETATM 1296 C42 SXR A 101 -1.075 11.822 -9.190 1.00 2.88 C HETATM 1297 C43 SXR A 101 -2.112 11.953 -8.092 1.00 2.85 C HETATM 1298 S1 SXR A 101 -3.185 10.587 -8.140 1.00 3.15 S HETATM 1299 C11 SXR A 101 -0.956 7.317 -1.871 1.00 2.09 C HETATM 1300 C10 SXR A 101 -0.191 7.361 -0.696 1.00 2.05 C HETATM 1301 C9 SXR A 101 -0.562 6.576 0.399 1.00 1.91 C HETATM 1302 C8 SXR A 101 -1.687 5.753 0.318 1.00 2.19 C HETATM 1303 C7 SXR A 101 -2.436 5.714 -0.849 1.00 2.18 C HETATM 1304 C6 SXR A 101 -2.089 6.488 -1.957 1.00 1.95 C HETATM 1305 C5 SXR A 101 -2.920 6.420 -3.201 1.00 2.57 C HETATM 1306 C4 SXR A 101 -3.031 7.717 -3.964 1.00 2.29 C HETATM 1307 C3 SXR A 101 -2.766 7.568 -5.467 1.00 2.88 C HETATM 1308 O3 SXR A 101 -2.063 6.635 -5.899 1.00 3.69 O HETATM 1309 C2 SXR A 101 -3.357 8.566 -6.420 1.00 2.88 C HETATM 1310 C1 SXR A 101 -2.374 9.500 -7.077 1.00 2.84 C HETATM 1311 H28A SXR A 101 4.797 10.679 -6.235 1.00 1.41 H HETATM 1312 H28B SXR A 101 3.142 10.336 -5.770 1.00 0.99 H HETATM 1313 H30A SXR A 101 3.963 10.421 -9.011 1.00 2.99 H HETATM 1314 H30B SXR A 101 2.212 10.665 -8.949 1.00 2.62 H HETATM 1315 H30C SXR A 101 2.993 9.608 -7.778 1.00 2.79 H HETATM 1316 H31A SXR A 101 1.234 12.081 -7.962 1.00 2.21 H HETATM 1317 H31B SXR A 101 2.064 13.430 -7.198 1.00 2.37 H HETATM 1318 H31C SXR A 101 1.545 12.060 -6.222 1.00 1.95 H HETATM 1319 H32A SXR A 101 5.317 12.229 -8.149 1.00 3.10 H HETATM 1320 H33A SXR A 101 5.285 13.587 -6.635 1.00 3.40 H HETATM 1321 H36A SXR A 101 2.545 14.293 -8.599 1.00 3.96 H HETATM 1322 H37A SXR A 101 2.762 15.705 -10.752 1.00 4.70 H HETATM 1323 H37B SXR A 101 2.686 14.130 -11.543 1.00 5.21 H HETATM 1324 H38A SXR A 101 0.583 15.319 -9.717 1.00 5.22 H HETATM 1325 H38B SXR A 101 0.509 15.281 -11.474 1.00 5.25 H HETATM 1326 H41A SXR A 101 -0.449 13.783 -8.748 1.00 3.43 H HETATM 1327 H42A SXR A 101 -1.563 11.538 -10.103 1.00 3.18 H HETATM 1328 H42B SXR A 101 -0.336 11.082 -8.920 1.00 2.75 H HETATM 1329 H43A SXR A 101 -2.704 12.830 -8.300 1.00 3.20 H HETATM 1330 H43B SXR A 101 -1.637 12.015 -7.127 1.00 2.98 H HETATM 1331 H11A SXR A 101 -0.672 7.926 -2.720 1.00 2.81 H HETATM 1332 H10A SXR A 101 0.680 7.999 -0.647 1.00 2.73 H HETATM 1333 H9A SXR A 101 0.021 6.607 1.307 1.00 2.32 H HETATM 1334 H8A SXR A 101 -1.997 5.137 1.149 1.00 2.94 H HETATM 1335 H7A SXR A 101 -3.305 5.078 -0.903 1.00 2.89 H HETATM 1336 H5A SXR A 101 -3.185 5.531 -3.739 1.00 3.45 H HETATM 1337 H5B SXR A 101 -3.806 6.276 -2.588 1.00 2.83 H HETATM 1338 H4A SXR A 101 -3.641 8.554 -3.680 1.00 2.15 H HETATM 1339 H4B SXR A 101 -2.217 8.141 -3.376 1.00 2.47 H HETATM 1340 H2A SXR A 101 -4.302 8.469 -6.922 1.00 3.20 H HETATM 1341 H2B SXR A 101 -3.895 9.060 -5.610 1.00 3.39 H HETATM 1342 H1A SXR A 101 -1.367 9.740 -6.781 1.00 3.11 H HETATM 1343 H1B SXR A 101 -1.989 8.668 -7.670 1.00 2.74 H