ATOM 1 N MET A 1 -18.933 -9.750 -3.309 1.00 3.07 N ATOM 2 CA MET A 1 -18.729 -8.355 -3.699 1.00 2.76 C ATOM 3 C MET A 1 -17.454 -7.822 -3.065 1.00 2.34 C ATOM 4 O MET A 1 -16.504 -7.458 -3.781 1.00 2.38 O ATOM 5 CB MET A 1 -19.917 -7.499 -3.286 1.00 2.93 C ATOM 6 CG MET A 1 -21.195 -7.773 -4.046 1.00 3.33 C ATOM 7 SD MET A 1 -22.601 -6.841 -3.397 1.00 4.18 S ATOM 8 CE MET A 1 -23.857 -7.289 -4.592 1.00 4.50 C ATOM 9 H1 MET A 1 -19.097 -9.849 -2.283 1.00 3.22 H ATOM 10 H2 MET A 1 -18.056 -10.276 -3.520 1.00 3.51 H ATOM 11 H3 MET A 1 -19.714 -10.201 -3.830 1.00 3.36 H ATOM 12 HA MET A 1 -18.620 -8.330 -4.775 1.00 3.37 H ATOM 13 HB2 MET A 1 -20.121 -7.678 -2.242 1.00 3.26 H ATOM 14 HB3 MET A 1 -19.666 -6.458 -3.420 1.00 3.26 H ATOM 15 HG2 MET A 1 -21.046 -7.517 -5.088 1.00 3.63 H ATOM 16 HG3 MET A 1 -21.406 -8.830 -3.962 1.00 3.51 H ATOM 17 HE1 MET A 1 -23.546 -6.969 -5.575 1.00 4.67 H ATOM 18 HE2 MET A 1 -24.786 -6.798 -4.336 1.00 4.75 H ATOM 19 HE3 MET A 1 -24.009 -8.358 -4.582 1.00 4.79 H ATOM 20 N ALA A 2 -17.414 -7.778 -1.743 1.00 2.23 N ATOM 21 CA ALA A 2 -16.243 -7.326 -1.044 1.00 1.97 C ATOM 22 C ALA A 2 -15.206 -8.430 -1.014 1.00 1.62 C ATOM 23 O ALA A 2 -15.518 -9.589 -0.726 1.00 1.83 O ATOM 24 CB ALA A 2 -16.594 -6.875 0.373 1.00 2.32 C ATOM 25 H ALA A 2 -18.201 -8.021 -1.214 1.00 2.55 H ATOM 26 HA ALA A 2 -15.832 -6.482 -1.584 1.00 2.02 H ATOM 27 HB1 ALA A 2 -15.703 -6.507 0.861 1.00 2.39 H ATOM 28 HB2 ALA A 2 -17.002 -7.701 0.938 1.00 2.57 H ATOM 29 HB3 ALA A 2 -17.324 -6.081 0.324 1.00 2.91 H ATOM 30 N THR A 3 -14.001 -8.082 -1.356 1.00 1.33 N ATOM 31 CA THR A 3 -12.893 -9.009 -1.381 1.00 1.10 C ATOM 32 C THR A 3 -11.713 -8.366 -0.653 1.00 0.90 C ATOM 33 O THR A 3 -10.943 -7.598 -1.238 1.00 0.87 O ATOM 34 CB THR A 3 -12.508 -9.344 -2.843 1.00 1.27 C ATOM 35 OG1 THR A 3 -13.684 -9.765 -3.562 1.00 1.70 O ATOM 36 CG2 THR A 3 -11.480 -10.469 -2.885 1.00 1.78 C ATOM 37 H THR A 3 -13.827 -7.154 -1.616 1.00 1.46 H ATOM 38 HA THR A 3 -13.183 -9.913 -0.868 1.00 1.16 H ATOM 39 HB THR A 3 -12.097 -8.466 -3.317 1.00 1.61 H ATOM 40 HG1 THR A 3 -13.636 -9.402 -4.454 1.00 2.16 H ATOM 41 HG21 THR A 3 -10.600 -10.165 -2.337 1.00 2.24 H ATOM 42 HG22 THR A 3 -11.210 -10.671 -3.912 1.00 2.32 H ATOM 43 HG23 THR A 3 -11.891 -11.362 -2.432 1.00 2.10 H ATOM 44 N LEU A 4 -11.664 -8.585 0.638 1.00 0.86 N ATOM 45 CA LEU A 4 -10.631 -8.027 1.502 1.00 0.72 C ATOM 46 C LEU A 4 -9.268 -8.615 1.166 1.00 0.67 C ATOM 47 O LEU A 4 -9.087 -9.838 1.123 1.00 0.83 O ATOM 48 CB LEU A 4 -10.950 -8.266 2.994 1.00 0.71 C ATOM 49 CG LEU A 4 -12.141 -7.491 3.628 1.00 0.87 C ATOM 50 CD1 LEU A 4 -11.928 -5.995 3.578 1.00 0.80 C ATOM 51 CD2 LEU A 4 -13.486 -7.850 2.997 1.00 1.75 C ATOM 52 H LEU A 4 -12.332 -9.165 1.058 1.00 1.00 H ATOM 53 HA LEU A 4 -10.609 -6.961 1.321 1.00 0.73 H ATOM 54 HB2 LEU A 4 -11.136 -9.317 3.147 1.00 0.79 H ATOM 55 HB3 LEU A 4 -10.065 -8.011 3.558 1.00 0.64 H ATOM 56 HG LEU A 4 -12.177 -7.765 4.673 1.00 1.34 H ATOM 57 HD11 LEU A 4 -11.841 -5.687 2.547 1.00 1.23 H ATOM 58 HD12 LEU A 4 -11.038 -5.739 4.135 1.00 1.38 H ATOM 59 HD13 LEU A 4 -12.784 -5.508 4.019 1.00 1.46 H ATOM 60 HD21 LEU A 4 -13.445 -7.611 1.943 1.00 2.19 H ATOM 61 HD22 LEU A 4 -14.265 -7.260 3.462 1.00 2.26 H ATOM 62 HD23 LEU A 4 -13.689 -8.905 3.124 1.00 2.25 H ATOM 63 N LEU A 5 -8.333 -7.738 0.872 1.00 0.55 N ATOM 64 CA LEU A 5 -6.970 -8.124 0.578 1.00 0.51 C ATOM 65 C LEU A 5 -6.159 -8.190 1.871 1.00 0.46 C ATOM 66 O LEU A 5 -6.395 -7.398 2.800 1.00 0.50 O ATOM 67 CB LEU A 5 -6.268 -7.163 -0.430 1.00 0.53 C ATOM 68 CG LEU A 5 -5.873 -5.735 0.048 1.00 0.62 C ATOM 69 CD1 LEU A 5 -4.920 -5.099 -0.924 1.00 0.66 C ATOM 70 CD2 LEU A 5 -7.067 -4.816 0.224 1.00 0.95 C ATOM 71 H LEU A 5 -8.593 -6.801 0.842 1.00 0.61 H ATOM 72 HA LEU A 5 -7.005 -9.116 0.151 1.00 0.58 H ATOM 73 HB2 LEU A 5 -5.361 -7.648 -0.755 1.00 0.53 H ATOM 74 HB3 LEU A 5 -6.914 -7.066 -1.293 1.00 0.60 H ATOM 75 HG LEU A 5 -5.364 -5.820 0.996 1.00 0.90 H ATOM 76 HD11 LEU A 5 -4.000 -5.659 -0.950 1.00 1.08 H ATOM 77 HD12 LEU A 5 -4.699 -4.084 -0.623 1.00 1.41 H ATOM 78 HD13 LEU A 5 -5.365 -5.085 -1.908 1.00 1.22 H ATOM 79 HD21 LEU A 5 -7.618 -5.064 1.117 1.00 1.46 H ATOM 80 HD22 LEU A 5 -7.698 -4.910 -0.647 1.00 1.57 H ATOM 81 HD23 LEU A 5 -6.703 -3.801 0.284 1.00 1.37 H ATOM 82 N THR A 6 -5.220 -9.107 1.928 1.00 0.47 N ATOM 83 CA THR A 6 -4.384 -9.299 3.080 1.00 0.49 C ATOM 84 C THR A 6 -3.007 -8.627 2.925 1.00 0.40 C ATOM 85 O THR A 6 -2.712 -8.005 1.889 1.00 0.38 O ATOM 86 CB THR A 6 -4.241 -10.797 3.336 1.00 0.70 C ATOM 87 OG1 THR A 6 -4.224 -11.455 2.048 1.00 0.82 O ATOM 88 CG2 THR A 6 -5.418 -11.313 4.159 1.00 0.93 C ATOM 89 H THR A 6 -5.052 -9.731 1.190 1.00 0.54 H ATOM 90 HA THR A 6 -4.883 -8.864 3.933 1.00 0.55 H ATOM 91 HB THR A 6 -3.309 -10.984 3.851 1.00 0.73 H ATOM 92 HG1 THR A 6 -3.402 -11.967 1.902 1.00 1.33 H ATOM 93 HG21 THR A 6 -5.323 -12.376 4.320 1.00 1.33 H ATOM 94 HG22 THR A 6 -6.329 -11.116 3.613 1.00 1.32 H ATOM 95 HG23 THR A 6 -5.445 -10.797 5.107 1.00 1.55 H ATOM 96 N THR A 7 -2.164 -8.780 3.938 1.00 0.44 N ATOM 97 CA THR A 7 -0.841 -8.189 3.970 1.00 0.42 C ATOM 98 C THR A 7 0.082 -8.871 2.978 1.00 0.37 C ATOM 99 O THR A 7 0.967 -8.248 2.403 1.00 0.39 O ATOM 100 CB THR A 7 -0.264 -8.333 5.373 1.00 0.50 C ATOM 101 OG1 THR A 7 -1.333 -8.094 6.315 1.00 0.58 O ATOM 102 CG2 THR A 7 0.823 -7.307 5.578 1.00 0.54 C ATOM 103 H THR A 7 -2.439 -9.266 4.744 1.00 0.52 H ATOM 104 HA THR A 7 -0.907 -7.138 3.735 1.00 0.44 H ATOM 105 HB THR A 7 0.138 -9.329 5.497 1.00 0.53 H ATOM 106 HG1 THR A 7 -0.979 -7.881 7.182 1.00 0.94 H ATOM 107 HG21 THR A 7 1.220 -7.371 6.581 1.00 1.06 H ATOM 108 HG22 THR A 7 0.422 -6.317 5.409 1.00 1.24 H ATOM 109 HG23 THR A 7 1.606 -7.491 4.860 1.00 1.08 H ATOM 110 N ASP A 8 -0.134 -10.148 2.786 1.00 0.41 N ATOM 111 CA ASP A 8 0.624 -10.932 1.825 1.00 0.46 C ATOM 112 C ASP A 8 0.416 -10.421 0.410 1.00 0.42 C ATOM 113 O ASP A 8 1.369 -10.353 -0.378 1.00 0.47 O ATOM 114 CB ASP A 8 0.294 -12.438 1.949 1.00 0.62 C ATOM 115 CG ASP A 8 -1.169 -12.693 2.249 1.00 1.41 C ATOM 116 OD1 ASP A 8 -2.004 -12.635 1.343 1.00 1.98 O ATOM 117 OD2 ASP A 8 -1.498 -12.880 3.448 1.00 2.01 O ATOM 118 H ASP A 8 -0.837 -10.605 3.299 1.00 0.48 H ATOM 119 HA ASP A 8 1.671 -10.799 2.062 1.00 0.52 H ATOM 120 HB2 ASP A 8 0.534 -12.920 1.012 1.00 0.86 H ATOM 121 HB3 ASP A 8 0.892 -12.858 2.747 1.00 1.09 H ATOM 122 N ASP A 9 -0.799 -10.002 0.110 1.00 0.41 N ATOM 123 CA ASP A 9 -1.083 -9.461 -1.195 1.00 0.46 C ATOM 124 C ASP A 9 -0.509 -8.054 -1.304 1.00 0.40 C ATOM 125 O ASP A 9 0.003 -7.654 -2.356 1.00 0.46 O ATOM 126 CB ASP A 9 -2.567 -9.436 -1.501 1.00 0.54 C ATOM 127 CG ASP A 9 -2.819 -9.820 -2.934 1.00 0.98 C ATOM 128 OD1 ASP A 9 -1.910 -9.677 -3.783 1.00 1.21 O ATOM 129 OD2 ASP A 9 -3.899 -10.345 -3.249 1.00 1.83 O ATOM 130 H ASP A 9 -1.516 -10.094 0.771 1.00 0.43 H ATOM 131 HA ASP A 9 -0.575 -10.075 -1.926 1.00 0.53 H ATOM 132 HB2 ASP A 9 -3.118 -10.091 -0.843 1.00 1.16 H ATOM 133 HB3 ASP A 9 -2.963 -8.444 -1.351 1.00 0.89 H ATOM 134 N LEU A 10 -0.568 -7.314 -0.196 1.00 0.36 N ATOM 135 CA LEU A 10 0.007 -5.962 -0.109 1.00 0.35 C ATOM 136 C LEU A 10 1.502 -6.016 -0.385 1.00 0.33 C ATOM 137 O LEU A 10 2.039 -5.197 -1.127 1.00 0.36 O ATOM 138 CB LEU A 10 -0.227 -5.359 1.287 1.00 0.37 C ATOM 139 CG LEU A 10 0.340 -3.944 1.534 1.00 0.41 C ATOM 140 CD1 LEU A 10 -0.344 -2.906 0.666 1.00 0.51 C ATOM 141 CD2 LEU A 10 0.251 -3.572 3.008 1.00 0.48 C ATOM 142 H LEU A 10 -1.027 -7.690 0.586 1.00 0.35 H ATOM 143 HA LEU A 10 -0.471 -5.341 -0.850 1.00 0.39 H ATOM 144 HB2 LEU A 10 -1.288 -5.348 1.479 1.00 0.42 H ATOM 145 HB3 LEU A 10 0.243 -6.024 1.997 1.00 0.36 H ATOM 146 HG LEU A 10 1.380 -3.942 1.247 1.00 0.39 H ATOM 147 HD11 LEU A 10 -0.219 -3.138 -0.382 1.00 1.18 H ATOM 148 HD12 LEU A 10 0.090 -1.938 0.872 1.00 0.95 H ATOM 149 HD13 LEU A 10 -1.393 -2.861 0.919 1.00 1.26 H ATOM 150 HD21 LEU A 10 0.806 -4.280 3.605 1.00 1.12 H ATOM 151 HD22 LEU A 10 -0.787 -3.572 3.310 1.00 1.06 H ATOM 152 HD23 LEU A 10 0.661 -2.582 3.146 1.00 1.05 H ATOM 153 N ARG A 11 2.163 -7.014 0.205 1.00 0.33 N ATOM 154 CA ARG A 11 3.587 -7.195 0.039 1.00 0.37 C ATOM 155 C ARG A 11 3.913 -7.463 -1.418 1.00 0.39 C ATOM 156 O ARG A 11 4.867 -6.912 -1.948 1.00 0.45 O ATOM 157 CB ARG A 11 4.136 -8.322 0.942 1.00 0.45 C ATOM 158 CG ARG A 11 5.662 -8.373 0.974 1.00 0.72 C ATOM 159 CD ARG A 11 6.211 -9.324 2.058 1.00 0.63 C ATOM 160 NE ARG A 11 6.033 -10.769 1.770 1.00 1.12 N ATOM 161 CZ ARG A 11 6.158 -11.759 2.704 1.00 1.36 C ATOM 162 NH1 ARG A 11 6.172 -11.463 4.017 1.00 1.47 N ATOM 163 NH2 ARG A 11 6.254 -13.036 2.325 1.00 2.27 N ATOM 164 H ARG A 11 1.661 -7.630 0.784 1.00 0.33 H ATOM 165 HA ARG A 11 4.054 -6.260 0.315 1.00 0.41 H ATOM 166 HB2 ARG A 11 3.775 -8.155 1.942 1.00 0.92 H ATOM 167 HB3 ARG A 11 3.764 -9.272 0.581 1.00 1.06 H ATOM 168 HG2 ARG A 11 6.015 -8.714 0.015 1.00 1.30 H ATOM 169 HG3 ARG A 11 6.036 -7.376 1.159 1.00 1.20 H ATOM 170 HD2 ARG A 11 7.266 -9.121 2.157 1.00 1.17 H ATOM 171 HD3 ARG A 11 5.737 -9.088 3.000 1.00 1.14 H ATOM 172 HE ARG A 11 5.914 -10.992 0.821 1.00 1.86 H ATOM 173 HH11 ARG A 11 6.093 -10.527 4.359 1.00 1.69 H ATOM 174 HH12 ARG A 11 6.258 -12.187 4.720 1.00 1.97 H ATOM 175 HH21 ARG A 11 6.246 -13.320 1.352 1.00 2.91 H ATOM 176 HH22 ARG A 11 6.351 -13.788 2.989 1.00 2.56 H ATOM 177 N ARG A 12 3.076 -8.263 -2.073 1.00 0.40 N ATOM 178 CA ARG A 12 3.279 -8.574 -3.480 1.00 0.48 C ATOM 179 C ARG A 12 3.205 -7.313 -4.343 1.00 0.47 C ATOM 180 O ARG A 12 4.051 -7.092 -5.203 1.00 0.50 O ATOM 181 CB ARG A 12 2.277 -9.614 -3.981 1.00 0.56 C ATOM 182 CG ARG A 12 2.431 -10.991 -3.360 1.00 0.94 C ATOM 183 CD ARG A 12 1.590 -12.056 -4.066 1.00 1.18 C ATOM 184 NE ARG A 12 0.118 -11.880 -3.938 1.00 1.76 N ATOM 185 CZ ARG A 12 -0.769 -12.889 -4.064 1.00 2.29 C ATOM 186 NH1 ARG A 12 -0.349 -14.136 -4.291 1.00 2.31 N ATOM 187 NH2 ARG A 12 -2.076 -12.653 -3.970 1.00 3.30 N ATOM 188 H ARG A 12 2.286 -8.627 -1.614 1.00 0.37 H ATOM 189 HA ARG A 12 4.278 -8.971 -3.578 1.00 0.54 H ATOM 190 HB2 ARG A 12 1.279 -9.266 -3.779 1.00 0.67 H ATOM 191 HB3 ARG A 12 2.405 -9.703 -5.044 1.00 0.85 H ATOM 192 HG2 ARG A 12 3.472 -11.269 -3.448 1.00 1.27 H ATOM 193 HG3 ARG A 12 2.153 -10.947 -2.315 1.00 1.35 H ATOM 194 HD2 ARG A 12 1.838 -12.036 -5.119 1.00 1.87 H ATOM 195 HD3 ARG A 12 1.873 -13.016 -3.659 1.00 1.53 H ATOM 196 HE ARG A 12 -0.228 -10.969 -3.778 1.00 2.26 H ATOM 197 HH11 ARG A 12 0.623 -14.401 -4.383 1.00 2.24 H ATOM 198 HH12 ARG A 12 -1.006 -14.894 -4.371 1.00 2.84 H ATOM 199 HH21 ARG A 12 -2.443 -11.729 -3.810 1.00 3.81 H ATOM 200 HH22 ARG A 12 -2.752 -13.388 -4.025 1.00 3.77 H ATOM 201 N ALA A 13 2.210 -6.481 -4.075 1.00 0.47 N ATOM 202 CA ALA A 13 2.022 -5.255 -4.828 1.00 0.53 C ATOM 203 C ALA A 13 3.151 -4.259 -4.564 1.00 0.46 C ATOM 204 O ALA A 13 3.648 -3.607 -5.497 1.00 0.48 O ATOM 205 CB ALA A 13 0.682 -4.627 -4.492 1.00 0.63 C ATOM 206 H ALA A 13 1.582 -6.716 -3.355 1.00 0.47 H ATOM 207 HA ALA A 13 2.020 -5.510 -5.877 1.00 0.61 H ATOM 208 HB1 ALA A 13 0.672 -4.358 -3.447 1.00 1.11 H ATOM 209 HB2 ALA A 13 -0.118 -5.326 -4.689 1.00 1.26 H ATOM 210 HB3 ALA A 13 0.544 -3.743 -5.096 1.00 1.21 H ATOM 211 N LEU A 14 3.569 -4.161 -3.308 1.00 0.42 N ATOM 212 CA LEU A 14 4.606 -3.216 -2.891 1.00 0.39 C ATOM 213 C LEU A 14 5.963 -3.569 -3.534 1.00 0.40 C ATOM 214 O LEU A 14 6.635 -2.698 -4.092 1.00 0.46 O ATOM 215 CB LEU A 14 4.701 -3.195 -1.362 1.00 0.45 C ATOM 216 CG LEU A 14 5.608 -2.130 -0.715 1.00 0.54 C ATOM 217 CD1 LEU A 14 5.139 -0.712 -1.055 1.00 0.44 C ATOM 218 CD2 LEU A 14 5.655 -2.327 0.793 1.00 1.00 C ATOM 219 H LEU A 14 3.152 -4.746 -2.635 1.00 0.44 H ATOM 220 HA LEU A 14 4.308 -2.239 -3.241 1.00 0.41 H ATOM 221 HB2 LEU A 14 3.706 -3.098 -0.958 1.00 0.73 H ATOM 222 HB3 LEU A 14 5.066 -4.163 -1.052 1.00 0.77 H ATOM 223 HG LEU A 14 6.610 -2.248 -1.099 1.00 0.97 H ATOM 224 HD11 LEU A 14 5.801 0.003 -0.586 1.00 1.04 H ATOM 225 HD12 LEU A 14 4.140 -0.546 -0.680 1.00 1.18 H ATOM 226 HD13 LEU A 14 5.147 -0.563 -2.125 1.00 1.11 H ATOM 227 HD21 LEU A 14 4.660 -2.240 1.208 1.00 1.59 H ATOM 228 HD22 LEU A 14 6.301 -1.579 1.227 1.00 1.48 H ATOM 229 HD23 LEU A 14 6.052 -3.304 1.020 1.00 1.54 H ATOM 230 N VAL A 15 6.341 -4.857 -3.481 1.00 0.44 N ATOM 231 CA VAL A 15 7.612 -5.330 -4.077 1.00 0.53 C ATOM 232 C VAL A 15 7.668 -5.010 -5.568 1.00 0.55 C ATOM 233 O VAL A 15 8.626 -4.394 -6.036 1.00 0.64 O ATOM 234 CB VAL A 15 7.824 -6.860 -3.871 1.00 0.61 C ATOM 235 CG1 VAL A 15 9.084 -7.352 -4.597 1.00 0.74 C ATOM 236 CG2 VAL A 15 7.916 -7.191 -2.388 1.00 0.64 C ATOM 237 H VAL A 15 5.746 -5.506 -3.044 1.00 0.47 H ATOM 238 HA VAL A 15 8.408 -4.797 -3.579 1.00 0.60 H ATOM 239 HB VAL A 15 6.975 -7.380 -4.287 1.00 0.63 H ATOM 240 HG11 VAL A 15 9.197 -8.416 -4.443 1.00 1.14 H ATOM 241 HG12 VAL A 15 9.959 -6.836 -4.228 1.00 1.39 H ATOM 242 HG13 VAL A 15 8.967 -7.144 -5.650 1.00 1.29 H ATOM 243 HG21 VAL A 15 6.999 -6.906 -1.895 1.00 1.14 H ATOM 244 HG22 VAL A 15 8.746 -6.666 -1.938 1.00 1.34 H ATOM 245 HG23 VAL A 15 8.057 -8.256 -2.266 1.00 1.13 H ATOM 246 N GLU A 16 6.623 -5.396 -6.294 1.00 0.59 N ATOM 247 CA GLU A 16 6.529 -5.179 -7.749 1.00 0.69 C ATOM 248 C GLU A 16 6.639 -3.703 -8.161 1.00 0.65 C ATOM 249 O GLU A 16 6.914 -3.410 -9.318 1.00 0.77 O ATOM 250 CB GLU A 16 5.238 -5.801 -8.304 1.00 0.89 C ATOM 251 CG GLU A 16 5.249 -7.316 -8.325 1.00 1.11 C ATOM 252 CD GLU A 16 6.288 -7.864 -9.298 1.00 1.54 C ATOM 253 OE1 GLU A 16 5.974 -8.064 -10.487 1.00 1.95 O ATOM 254 OE2 GLU A 16 7.436 -8.125 -8.876 1.00 2.18 O ATOM 255 H GLU A 16 5.883 -5.866 -5.850 1.00 0.60 H ATOM 256 HA GLU A 16 7.362 -5.706 -8.193 1.00 0.80 H ATOM 257 HB2 GLU A 16 4.393 -5.484 -7.706 1.00 0.91 H ATOM 258 HB3 GLU A 16 5.094 -5.458 -9.322 1.00 0.98 H ATOM 259 HG2 GLU A 16 5.474 -7.673 -7.330 1.00 1.44 H ATOM 260 HG3 GLU A 16 4.269 -7.657 -8.626 1.00 1.45 H ATOM 261 N SER A 17 6.452 -2.793 -7.218 1.00 0.59 N ATOM 262 CA SER A 17 6.520 -1.375 -7.517 1.00 0.64 C ATOM 263 C SER A 17 7.987 -0.887 -7.565 1.00 0.74 C ATOM 264 O SER A 17 8.340 -0.001 -8.346 1.00 1.04 O ATOM 265 CB SER A 17 5.750 -0.597 -6.468 1.00 0.68 C ATOM 266 OG SER A 17 4.404 -1.086 -6.344 1.00 1.27 O ATOM 267 H SER A 17 6.301 -3.083 -6.294 1.00 0.58 H ATOM 268 HA SER A 17 6.067 -1.209 -8.485 1.00 0.75 H ATOM 269 HB2 SER A 17 6.256 -0.710 -5.517 1.00 1.10 H ATOM 270 HB3 SER A 17 5.726 0.442 -6.767 1.00 1.16 H ATOM 271 HG SER A 17 4.430 -2.046 -6.235 1.00 1.65 H ATOM 272 N ALA A 18 8.832 -1.486 -6.747 1.00 0.70 N ATOM 273 CA ALA A 18 10.227 -1.100 -6.711 1.00 0.87 C ATOM 274 C ALA A 18 11.038 -2.040 -7.585 1.00 1.05 C ATOM 275 O ALA A 18 11.953 -1.619 -8.317 1.00 1.57 O ATOM 276 CB ALA A 18 10.756 -1.110 -5.287 1.00 0.95 C ATOM 277 H ALA A 18 8.510 -2.223 -6.185 1.00 0.73 H ATOM 278 HA ALA A 18 10.298 -0.095 -7.103 1.00 1.09 H ATOM 279 HB1 ALA A 18 10.172 -0.424 -4.694 1.00 1.36 H ATOM 280 HB2 ALA A 18 11.792 -0.798 -5.286 1.00 1.48 H ATOM 281 HB3 ALA A 18 10.672 -2.112 -4.891 1.00 1.41 H ATOM 282 N GLY A 19 10.680 -3.294 -7.539 1.00 0.98 N ATOM 283 CA GLY A 19 11.370 -4.292 -8.290 1.00 1.32 C ATOM 284 C GLY A 19 12.161 -5.211 -7.392 1.00 1.47 C ATOM 285 O GLY A 19 12.394 -4.901 -6.214 1.00 1.85 O ATOM 286 H GLY A 19 9.929 -3.575 -6.970 1.00 1.01 H ATOM 287 HA2 GLY A 19 10.648 -4.878 -8.838 1.00 1.77 H ATOM 288 HA3 GLY A 19 12.051 -3.826 -8.990 1.00 1.79 H ATOM 289 N GLU A 20 12.580 -6.338 -7.940 1.00 1.96 N ATOM 290 CA GLU A 20 13.383 -7.322 -7.214 1.00 2.68 C ATOM 291 C GLU A 20 14.871 -6.932 -7.200 1.00 2.91 C ATOM 292 O GLU A 20 15.688 -7.546 -6.523 1.00 3.66 O ATOM 293 CB GLU A 20 13.174 -8.726 -7.817 1.00 3.52 C ATOM 294 CG GLU A 20 11.789 -9.316 -7.550 1.00 4.20 C ATOM 295 CD GLU A 20 11.497 -10.587 -8.319 1.00 4.87 C ATOM 296 OE1 GLU A 20 12.287 -11.542 -8.190 1.00 5.31 O ATOM 297 OE2 GLU A 20 10.509 -10.648 -9.082 1.00 5.27 O ATOM 298 H GLU A 20 12.311 -6.519 -8.870 1.00 2.18 H ATOM 299 HA GLU A 20 13.042 -7.327 -6.191 1.00 2.87 H ATOM 300 HB2 GLU A 20 13.312 -8.674 -8.888 1.00 3.77 H ATOM 301 HB3 GLU A 20 13.908 -9.404 -7.403 1.00 3.84 H ATOM 302 HG2 GLU A 20 11.719 -9.544 -6.502 1.00 4.47 H ATOM 303 HG3 GLU A 20 11.043 -8.578 -7.791 1.00 4.44 H ATOM 304 N THR A 21 15.219 -5.912 -7.935 1.00 2.73 N ATOM 305 CA THR A 21 16.581 -5.445 -7.960 1.00 3.25 C ATOM 306 C THR A 21 16.648 -3.938 -7.703 1.00 3.14 C ATOM 307 O THR A 21 16.647 -3.139 -8.638 1.00 3.43 O ATOM 308 CB THR A 21 17.272 -5.793 -9.299 1.00 3.93 C ATOM 309 OG1 THR A 21 17.142 -7.204 -9.541 1.00 4.30 O ATOM 310 CG2 THR A 21 18.754 -5.442 -9.245 1.00 4.40 C ATOM 311 H THR A 21 14.547 -5.446 -8.480 1.00 2.62 H ATOM 312 HA THR A 21 17.109 -5.947 -7.159 1.00 3.74 H ATOM 313 HB THR A 21 16.802 -5.250 -10.108 1.00 4.40 H ATOM 314 HG1 THR A 21 16.656 -7.587 -8.802 1.00 4.42 H ATOM 315 HG21 THR A 21 19.207 -5.991 -8.433 1.00 4.75 H ATOM 316 HG22 THR A 21 18.864 -4.386 -9.051 1.00 4.61 H ATOM 317 HG23 THR A 21 19.241 -5.683 -10.179 1.00 4.66 H ATOM 318 N ASP A 22 16.580 -3.557 -6.440 1.00 3.24 N ATOM 319 CA ASP A 22 16.754 -2.152 -6.068 1.00 3.46 C ATOM 320 C ASP A 22 17.167 -2.025 -4.595 1.00 3.15 C ATOM 321 O ASP A 22 18.153 -1.363 -4.284 1.00 3.71 O ATOM 322 CB ASP A 22 15.516 -1.261 -6.401 1.00 4.08 C ATOM 323 CG ASP A 22 15.783 0.213 -6.145 1.00 4.82 C ATOM 324 OD1 ASP A 22 16.471 0.858 -6.953 1.00 5.14 O ATOM 325 OD2 ASP A 22 15.318 0.730 -5.091 1.00 5.44 O ATOM 326 H ASP A 22 16.431 -4.234 -5.747 1.00 3.52 H ATOM 327 HA ASP A 22 17.600 -1.810 -6.652 1.00 3.87 H ATOM 328 HB2 ASP A 22 15.306 -1.359 -7.458 1.00 4.24 H ATOM 329 HB3 ASP A 22 14.618 -1.539 -5.869 1.00 4.35 H ATOM 330 N GLY A 23 16.465 -2.739 -3.704 1.00 2.69 N ATOM 331 CA GLY A 23 16.768 -2.644 -2.288 1.00 2.70 C ATOM 332 C GLY A 23 15.592 -3.064 -1.461 1.00 2.24 C ATOM 333 O GLY A 23 15.256 -2.443 -0.474 1.00 2.70 O ATOM 334 H GLY A 23 15.722 -3.322 -3.960 1.00 2.74 H ATOM 335 HA2 GLY A 23 17.613 -3.275 -2.056 1.00 3.05 H ATOM 336 HA3 GLY A 23 17.012 -1.617 -2.056 1.00 3.22 H ATOM 337 N THR A 24 15.001 -4.139 -1.857 1.00 1.89 N ATOM 338 CA THR A 24 13.784 -4.616 -1.290 1.00 1.88 C ATOM 339 C THR A 24 14.022 -5.367 0.042 1.00 1.65 C ATOM 340 O THR A 24 14.159 -6.592 0.060 1.00 2.03 O ATOM 341 CB THR A 24 13.146 -5.549 -2.321 1.00 2.50 C ATOM 342 OG1 THR A 24 13.528 -5.074 -3.654 1.00 3.09 O ATOM 343 CG2 THR A 24 11.630 -5.504 -2.188 1.00 2.87 C ATOM 344 H THR A 24 15.366 -4.680 -2.584 1.00 2.13 H ATOM 345 HA THR A 24 13.112 -3.790 -1.129 1.00 2.24 H ATOM 346 HB THR A 24 13.505 -6.554 -2.161 1.00 3.01 H ATOM 347 HG1 THR A 24 12.808 -5.178 -4.287 1.00 3.52 H ATOM 348 HG21 THR A 24 11.183 -6.178 -2.903 1.00 3.16 H ATOM 349 HG22 THR A 24 11.285 -4.493 -2.359 1.00 3.32 H ATOM 350 HG23 THR A 24 11.358 -5.799 -1.185 1.00 3.05 H ATOM 351 N ASP A 25 14.167 -4.624 1.124 1.00 1.52 N ATOM 352 CA ASP A 25 14.361 -5.223 2.442 1.00 1.56 C ATOM 353 C ASP A 25 13.116 -5.007 3.301 1.00 1.29 C ATOM 354 O ASP A 25 13.019 -4.062 4.063 1.00 1.63 O ATOM 355 CB ASP A 25 15.628 -4.669 3.121 1.00 2.14 C ATOM 356 CG ASP A 25 16.010 -5.401 4.397 1.00 2.62 C ATOM 357 OD1 ASP A 25 16.327 -6.600 4.336 1.00 3.01 O ATOM 358 OD2 ASP A 25 15.951 -4.784 5.490 1.00 3.06 O ATOM 359 H ASP A 25 14.151 -3.645 1.029 1.00 1.75 H ATOM 360 HA ASP A 25 14.466 -6.287 2.293 1.00 1.73 H ATOM 361 HB2 ASP A 25 16.463 -4.735 2.441 1.00 2.49 H ATOM 362 HB3 ASP A 25 15.470 -3.628 3.362 1.00 2.44 H ATOM 363 N LEU A 26 12.125 -5.851 3.070 1.00 1.14 N ATOM 364 CA LEU A 26 10.816 -5.798 3.744 1.00 0.93 C ATOM 365 C LEU A 26 10.323 -7.219 3.952 1.00 0.97 C ATOM 366 O LEU A 26 9.121 -7.493 4.081 1.00 1.44 O ATOM 367 CB LEU A 26 9.825 -4.929 2.898 1.00 1.11 C ATOM 368 CG LEU A 26 9.738 -5.212 1.363 1.00 0.87 C ATOM 369 CD1 LEU A 26 9.079 -6.548 1.050 1.00 1.38 C ATOM 370 CD2 LEU A 26 8.993 -4.078 0.659 1.00 1.53 C ATOM 371 H LEU A 26 12.277 -6.551 2.405 1.00 1.49 H ATOM 372 HA LEU A 26 10.940 -5.352 4.722 1.00 0.96 H ATOM 373 HB2 LEU A 26 8.827 -5.042 3.302 1.00 1.64 H ATOM 374 HB3 LEU A 26 10.122 -3.899 3.027 1.00 1.87 H ATOM 375 HG LEU A 26 10.745 -5.241 0.966 1.00 1.73 H ATOM 376 HD11 LEU A 26 9.045 -6.671 -0.022 1.00 1.91 H ATOM 377 HD12 LEU A 26 8.080 -6.552 1.462 1.00 1.94 H ATOM 378 HD13 LEU A 26 9.656 -7.343 1.498 1.00 1.97 H ATOM 379 HD21 LEU A 26 8.943 -4.310 -0.395 1.00 2.11 H ATOM 380 HD22 LEU A 26 9.524 -3.145 0.798 1.00 1.91 H ATOM 381 HD23 LEU A 26 7.989 -4.009 1.053 1.00 2.02 H ATOM 382 N SER A 27 11.275 -8.112 4.005 1.00 1.01 N ATOM 383 CA SER A 27 11.038 -9.521 4.100 1.00 1.18 C ATOM 384 C SER A 27 10.578 -9.898 5.520 1.00 1.27 C ATOM 385 O SER A 27 11.386 -10.030 6.444 1.00 1.98 O ATOM 386 CB SER A 27 12.329 -10.230 3.722 1.00 1.52 C ATOM 387 OG SER A 27 12.900 -9.584 2.581 1.00 2.26 O ATOM 388 H SER A 27 12.212 -7.826 3.998 1.00 1.26 H ATOM 389 HA SER A 27 10.268 -9.792 3.393 1.00 1.31 H ATOM 390 HB2 SER A 27 13.027 -10.172 4.544 1.00 1.83 H ATOM 391 HB3 SER A 27 12.138 -11.264 3.474 1.00 1.77 H ATOM 392 HG SER A 27 13.245 -10.238 1.947 1.00 2.55 H ATOM 393 N GLY A 28 9.284 -9.997 5.679 1.00 1.18 N ATOM 394 CA GLY A 28 8.713 -10.355 6.933 1.00 1.46 C ATOM 395 C GLY A 28 7.856 -9.244 7.478 1.00 1.19 C ATOM 396 O GLY A 28 6.768 -8.976 6.955 1.00 1.73 O ATOM 397 H GLY A 28 8.694 -9.770 4.935 1.00 1.42 H ATOM 398 HA2 GLY A 28 8.106 -11.242 6.823 1.00 1.84 H ATOM 399 HA3 GLY A 28 9.510 -10.549 7.637 1.00 1.75 H ATOM 400 N ASP A 29 8.369 -8.574 8.477 1.00 0.90 N ATOM 401 CA ASP A 29 7.681 -7.467 9.144 1.00 0.83 C ATOM 402 C ASP A 29 7.946 -6.158 8.459 1.00 0.79 C ATOM 403 O ASP A 29 9.092 -5.753 8.331 1.00 1.33 O ATOM 404 CB ASP A 29 8.103 -7.343 10.614 1.00 1.20 C ATOM 405 CG ASP A 29 7.407 -8.301 11.539 1.00 1.95 C ATOM 406 OD1 ASP A 29 7.768 -9.493 11.528 1.00 2.44 O ATOM 407 OD2 ASP A 29 6.486 -7.889 12.263 1.00 2.68 O ATOM 408 H ASP A 29 9.265 -8.810 8.796 1.00 1.26 H ATOM 409 HA ASP A 29 6.626 -7.682 9.114 1.00 0.92 H ATOM 410 HB2 ASP A 29 9.163 -7.531 10.690 1.00 1.67 H ATOM 411 HB3 ASP A 29 7.895 -6.336 10.942 1.00 1.46 H ATOM 412 N PHE A 30 6.898 -5.498 8.014 1.00 0.42 N ATOM 413 CA PHE A 30 7.042 -4.194 7.398 1.00 0.36 C ATOM 414 C PHE A 30 5.845 -3.305 7.737 1.00 0.32 C ATOM 415 O PHE A 30 5.732 -2.207 7.246 1.00 0.35 O ATOM 416 CB PHE A 30 7.219 -4.306 5.851 1.00 0.37 C ATOM 417 CG PHE A 30 5.992 -4.813 5.105 1.00 0.35 C ATOM 418 CD1 PHE A 30 5.740 -6.173 4.981 1.00 0.40 C ATOM 419 CD2 PHE A 30 5.095 -3.917 4.515 1.00 0.38 C ATOM 420 CE1 PHE A 30 4.625 -6.629 4.295 1.00 0.46 C ATOM 421 CE2 PHE A 30 3.981 -4.374 3.829 1.00 0.42 C ATOM 422 CZ PHE A 30 3.747 -5.726 3.719 1.00 0.46 C ATOM 423 H PHE A 30 6.018 -5.913 8.085 1.00 0.67 H ATOM 424 HA PHE A 30 7.928 -3.740 7.815 1.00 0.43 H ATOM 425 HB2 PHE A 30 7.476 -3.344 5.427 1.00 0.40 H ATOM 426 HB3 PHE A 30 8.035 -4.984 5.649 1.00 0.41 H ATOM 427 HD1 PHE A 30 6.428 -6.867 5.436 1.00 0.43 H ATOM 428 HD2 PHE A 30 5.266 -2.853 4.597 1.00 0.43 H ATOM 429 HE1 PHE A 30 4.439 -7.687 4.205 1.00 0.55 H ATOM 430 HE2 PHE A 30 3.295 -3.669 3.383 1.00 0.47 H ATOM 431 HZ PHE A 30 2.869 -6.071 3.194 1.00 0.53 H ATOM 432 N LEU A 31 4.969 -3.763 8.611 1.00 0.35 N ATOM 433 CA LEU A 31 3.744 -3.011 8.885 1.00 0.36 C ATOM 434 C LEU A 31 3.929 -1.884 9.877 1.00 0.39 C ATOM 435 O LEU A 31 3.259 -0.866 9.777 1.00 0.46 O ATOM 436 CB LEU A 31 2.615 -3.930 9.333 1.00 0.40 C ATOM 437 CG LEU A 31 2.107 -4.923 8.286 1.00 0.39 C ATOM 438 CD1 LEU A 31 1.008 -5.788 8.877 1.00 0.45 C ATOM 439 CD2 LEU A 31 1.601 -4.181 7.052 1.00 0.38 C ATOM 440 H LEU A 31 5.147 -4.596 9.089 1.00 0.44 H ATOM 441 HA LEU A 31 3.442 -2.557 7.952 1.00 0.35 H ATOM 442 HB2 LEU A 31 2.956 -4.489 10.193 1.00 0.44 H ATOM 443 HB3 LEU A 31 1.786 -3.307 9.640 1.00 0.42 H ATOM 444 HG LEU A 31 2.916 -5.573 7.982 1.00 0.39 H ATOM 445 HD11 LEU A 31 0.188 -5.166 9.204 1.00 0.98 H ATOM 446 HD12 LEU A 31 1.406 -6.332 9.719 1.00 1.10 H ATOM 447 HD13 LEU A 31 0.660 -6.485 8.130 1.00 1.06 H ATOM 448 HD21 LEU A 31 2.419 -3.656 6.582 1.00 1.07 H ATOM 449 HD22 LEU A 31 0.839 -3.476 7.349 1.00 1.11 H ATOM 450 HD23 LEU A 31 1.187 -4.889 6.351 1.00 1.05 H ATOM 451 N ASP A 32 4.836 -2.053 10.811 1.00 0.43 N ATOM 452 CA ASP A 32 5.008 -1.062 11.872 1.00 0.52 C ATOM 453 C ASP A 32 6.249 -0.213 11.602 1.00 0.50 C ATOM 454 O ASP A 32 6.745 0.511 12.458 1.00 0.66 O ATOM 455 CB ASP A 32 5.090 -1.765 13.240 1.00 0.69 C ATOM 456 CG ASP A 32 5.006 -0.812 14.421 1.00 1.46 C ATOM 457 OD1 ASP A 32 3.954 -0.136 14.578 1.00 1.95 O ATOM 458 OD2 ASP A 32 5.971 -0.724 15.208 1.00 2.20 O ATOM 459 H ASP A 32 5.415 -2.841 10.811 1.00 0.46 H ATOM 460 HA ASP A 32 4.136 -0.424 11.847 1.00 0.59 H ATOM 461 HB2 ASP A 32 4.278 -2.473 13.328 1.00 1.12 H ATOM 462 HB3 ASP A 32 6.022 -2.310 13.301 1.00 1.24 H ATOM 463 N LEU A 33 6.727 -0.285 10.388 1.00 0.42 N ATOM 464 CA LEU A 33 7.856 0.499 9.982 1.00 0.50 C ATOM 465 C LEU A 33 7.349 1.633 9.074 1.00 0.45 C ATOM 466 O LEU A 33 6.235 1.539 8.575 1.00 0.57 O ATOM 467 CB LEU A 33 8.964 -0.417 9.364 1.00 0.66 C ATOM 468 CG LEU A 33 8.645 -1.275 8.135 1.00 0.80 C ATOM 469 CD1 LEU A 33 8.357 -0.442 6.897 1.00 1.52 C ATOM 470 CD2 LEU A 33 9.809 -2.217 7.897 1.00 1.18 C ATOM 471 H LEU A 33 6.265 -0.842 9.733 1.00 0.43 H ATOM 472 HA LEU A 33 8.228 0.946 10.891 1.00 0.61 H ATOM 473 HB2 LEU A 33 9.873 0.116 9.153 1.00 1.44 H ATOM 474 HB3 LEU A 33 9.181 -1.128 10.151 1.00 1.18 H ATOM 475 HG LEU A 33 7.774 -1.885 8.332 1.00 0.96 H ATOM 476 HD11 LEU A 33 9.226 0.155 6.668 1.00 1.97 H ATOM 477 HD12 LEU A 33 7.516 0.210 7.078 1.00 2.01 H ATOM 478 HD13 LEU A 33 8.132 -1.085 6.060 1.00 1.95 H ATOM 479 HD21 LEU A 33 10.694 -1.624 7.721 1.00 1.52 H ATOM 480 HD22 LEU A 33 9.612 -2.859 7.052 1.00 1.91 H ATOM 481 HD23 LEU A 33 9.954 -2.812 8.788 1.00 1.52 H ATOM 482 N ARG A 34 8.109 2.682 8.859 1.00 0.43 N ATOM 483 CA ARG A 34 7.602 3.819 8.087 1.00 0.42 C ATOM 484 C ARG A 34 8.013 3.720 6.604 1.00 0.36 C ATOM 485 O ARG A 34 9.041 3.133 6.285 1.00 0.45 O ATOM 486 CB ARG A 34 8.088 5.131 8.706 1.00 0.58 C ATOM 487 CG ARG A 34 7.738 5.261 10.193 1.00 0.77 C ATOM 488 CD ARG A 34 8.131 6.600 10.750 1.00 1.08 C ATOM 489 NE ARG A 34 7.380 7.656 10.096 1.00 1.82 N ATOM 490 CZ ARG A 34 7.920 8.667 9.409 1.00 2.41 C ATOM 491 NH1 ARG A 34 9.240 8.870 9.444 1.00 2.43 N ATOM 492 NH2 ARG A 34 7.136 9.496 8.744 1.00 3.44 N ATOM 493 H ARG A 34 9.028 2.713 9.195 1.00 0.55 H ATOM 494 HA ARG A 34 6.526 3.785 8.140 1.00 0.45 H ATOM 495 HB2 ARG A 34 9.162 5.187 8.601 1.00 0.77 H ATOM 496 HB3 ARG A 34 7.631 5.955 8.175 1.00 0.78 H ATOM 497 HG2 ARG A 34 6.667 5.153 10.293 1.00 0.95 H ATOM 498 HG3 ARG A 34 8.239 4.478 10.747 1.00 1.06 H ATOM 499 HD2 ARG A 34 7.946 6.615 11.815 1.00 1.67 H ATOM 500 HD3 ARG A 34 9.181 6.739 10.552 1.00 1.45 H ATOM 501 HE ARG A 34 6.393 7.536 10.151 1.00 2.30 H ATOM 502 HH11 ARG A 34 9.841 8.297 9.992 1.00 2.29 H ATOM 503 HH12 ARG A 34 9.683 9.598 8.897 1.00 3.00 H ATOM 504 HH21 ARG A 34 6.135 9.363 8.786 1.00 3.92 H ATOM 505 HH22 ARG A 34 7.505 10.230 8.160 1.00 3.95 H ATOM 506 N PHE A 35 7.206 4.304 5.708 1.00 0.33 N ATOM 507 CA PHE A 35 7.466 4.249 4.240 1.00 0.33 C ATOM 508 C PHE A 35 8.829 4.825 3.876 1.00 0.38 C ATOM 509 O PHE A 35 9.646 4.178 3.215 1.00 0.43 O ATOM 510 CB PHE A 35 6.387 5.004 3.447 1.00 0.34 C ATOM 511 CG PHE A 35 5.003 4.459 3.596 1.00 0.36 C ATOM 512 CD1 PHE A 35 4.682 3.193 3.129 1.00 0.43 C ATOM 513 CD2 PHE A 35 4.031 5.200 4.228 1.00 0.40 C ATOM 514 CE1 PHE A 35 3.409 2.689 3.284 1.00 0.50 C ATOM 515 CE2 PHE A 35 2.753 4.696 4.386 1.00 0.48 C ATOM 516 CZ PHE A 35 2.432 3.459 3.831 1.00 0.51 C ATOM 517 H PHE A 35 6.404 4.758 6.054 1.00 0.40 H ATOM 518 HA PHE A 35 7.438 3.209 3.951 1.00 0.36 H ATOM 519 HB2 PHE A 35 6.361 6.036 3.768 1.00 0.35 H ATOM 520 HB3 PHE A 35 6.651 4.975 2.401 1.00 0.39 H ATOM 521 HD1 PHE A 35 5.431 2.594 2.627 1.00 0.47 H ATOM 522 HD2 PHE A 35 4.268 6.190 4.594 1.00 0.41 H ATOM 523 HE1 PHE A 35 3.171 1.702 2.915 1.00 0.57 H ATOM 524 HE2 PHE A 35 1.997 5.287 4.882 1.00 0.55 H ATOM 525 HZ PHE A 35 1.432 3.067 3.931 1.00 0.58 H ATOM 526 N GLU A 36 9.070 6.028 4.344 1.00 0.48 N ATOM 527 CA GLU A 36 10.321 6.755 4.092 1.00 0.62 C ATOM 528 C GLU A 36 11.535 6.044 4.738 1.00 0.63 C ATOM 529 O GLU A 36 12.677 6.241 4.333 1.00 0.72 O ATOM 530 CB GLU A 36 10.184 8.233 4.568 1.00 0.83 C ATOM 531 CG GLU A 36 9.721 8.371 6.027 1.00 1.40 C ATOM 532 CD GLU A 36 9.522 9.803 6.512 1.00 1.83 C ATOM 533 OE1 GLU A 36 8.487 10.420 6.180 1.00 2.73 O ATOM 534 OE2 GLU A 36 10.316 10.254 7.347 1.00 1.89 O ATOM 535 H GLU A 36 8.358 6.466 4.856 1.00 0.52 H ATOM 536 HA GLU A 36 10.475 6.750 3.020 1.00 0.69 H ATOM 537 HB2 GLU A 36 11.144 8.718 4.463 1.00 1.43 H ATOM 538 HB3 GLU A 36 9.464 8.731 3.932 1.00 1.37 H ATOM 539 HG2 GLU A 36 8.780 7.867 6.181 1.00 1.99 H ATOM 540 HG3 GLU A 36 10.473 7.920 6.658 1.00 2.11 H ATOM 541 N ASP A 37 11.251 5.189 5.704 1.00 0.61 N ATOM 542 CA ASP A 37 12.280 4.461 6.451 1.00 0.70 C ATOM 543 C ASP A 37 12.805 3.280 5.624 1.00 0.69 C ATOM 544 O ASP A 37 13.992 2.932 5.693 1.00 0.82 O ATOM 545 CB ASP A 37 11.673 3.975 7.781 1.00 0.77 C ATOM 546 CG ASP A 37 12.641 3.289 8.727 1.00 0.98 C ATOM 547 OD1 ASP A 37 13.340 3.998 9.509 1.00 1.27 O ATOM 548 OD2 ASP A 37 12.648 2.047 8.792 1.00 1.36 O ATOM 549 H ASP A 37 10.309 5.020 5.909 1.00 0.57 H ATOM 550 HA ASP A 37 13.100 5.134 6.663 1.00 0.80 H ATOM 551 HB2 ASP A 37 11.242 4.818 8.297 1.00 1.07 H ATOM 552 HB3 ASP A 37 10.874 3.283 7.557 1.00 0.95 H ATOM 553 N ILE A 38 11.918 2.694 4.800 1.00 0.59 N ATOM 554 CA ILE A 38 12.283 1.571 3.933 1.00 0.63 C ATOM 555 C ILE A 38 12.670 2.014 2.530 1.00 0.63 C ATOM 556 O ILE A 38 12.722 1.204 1.603 1.00 0.66 O ATOM 557 CB ILE A 38 11.239 0.426 3.871 1.00 0.59 C ATOM 558 CG1 ILE A 38 9.819 0.987 3.641 1.00 0.48 C ATOM 559 CG2 ILE A 38 11.317 -0.414 5.129 1.00 0.67 C ATOM 560 CD1 ILE A 38 8.766 -0.070 3.354 1.00 0.54 C ATOM 561 H ILE A 38 10.995 3.036 4.771 1.00 0.56 H ATOM 562 HA ILE A 38 13.186 1.174 4.386 1.00 0.73 H ATOM 563 HB ILE A 38 11.503 -0.215 3.039 1.00 0.66 H ATOM 564 HG12 ILE A 38 9.509 1.519 4.526 1.00 0.43 H ATOM 565 HG13 ILE A 38 9.834 1.684 2.818 1.00 0.48 H ATOM 566 HG21 ILE A 38 12.309 -0.830 5.217 1.00 1.43 H ATOM 567 HG22 ILE A 38 10.599 -1.220 5.079 1.00 1.12 H ATOM 568 HG23 ILE A 38 11.117 0.210 5.990 1.00 1.13 H ATOM 569 HD11 ILE A 38 9.024 -0.610 2.455 1.00 1.13 H ATOM 570 HD12 ILE A 38 7.809 0.411 3.227 1.00 1.03 H ATOM 571 HD13 ILE A 38 8.709 -0.755 4.187 1.00 1.00 H ATOM 572 N GLY A 39 12.990 3.287 2.397 1.00 0.63 N ATOM 573 CA GLY A 39 13.471 3.811 1.135 1.00 0.68 C ATOM 574 C GLY A 39 12.399 4.044 0.092 1.00 0.59 C ATOM 575 O GLY A 39 12.626 3.811 -1.101 1.00 0.70 O ATOM 576 H GLY A 39 12.905 3.865 3.182 1.00 0.63 H ATOM 577 HA2 GLY A 39 13.974 4.750 1.311 1.00 0.71 H ATOM 578 HA3 GLY A 39 14.182 3.102 0.731 1.00 0.81 H ATOM 579 N TYR A 40 11.234 4.458 0.507 1.00 0.45 N ATOM 580 CA TYR A 40 10.191 4.777 -0.446 1.00 0.45 C ATOM 581 C TYR A 40 9.860 6.239 -0.449 1.00 0.47 C ATOM 582 O TYR A 40 9.682 6.850 0.609 1.00 0.62 O ATOM 583 CB TYR A 40 8.903 3.983 -0.213 1.00 0.42 C ATOM 584 CG TYR A 40 8.906 2.571 -0.732 1.00 0.46 C ATOM 585 CD1 TYR A 40 9.462 1.542 0.000 1.00 0.53 C ATOM 586 CD2 TYR A 40 8.313 2.268 -1.951 1.00 0.57 C ATOM 587 CE1 TYR A 40 9.440 0.244 -0.452 1.00 0.60 C ATOM 588 CE2 TYR A 40 8.274 0.976 -2.415 1.00 0.68 C ATOM 589 CZ TYR A 40 8.839 -0.037 -1.662 1.00 0.67 C ATOM 590 OH TYR A 40 8.787 -1.323 -2.108 1.00 0.78 O ATOM 591 H TYR A 40 11.045 4.549 1.465 1.00 0.42 H ATOM 592 HA TYR A 40 10.560 4.523 -1.427 1.00 0.56 H ATOM 593 HB2 TYR A 40 8.695 3.951 0.844 1.00 0.43 H ATOM 594 HB3 TYR A 40 8.096 4.512 -0.693 1.00 0.44 H ATOM 595 HD1 TYR A 40 9.935 1.771 0.943 1.00 0.63 H ATOM 596 HD2 TYR A 40 7.871 3.066 -2.534 1.00 0.66 H ATOM 597 HE1 TYR A 40 9.884 -0.538 0.143 1.00 0.69 H ATOM 598 HE2 TYR A 40 7.807 0.759 -3.364 1.00 0.85 H ATOM 599 HH TYR A 40 8.430 -1.871 -1.402 1.00 1.25 H ATOM 600 N ASP A 41 9.812 6.807 -1.629 1.00 0.55 N ATOM 601 CA ASP A 41 9.313 8.146 -1.788 1.00 0.69 C ATOM 602 C ASP A 41 7.862 7.992 -2.183 1.00 0.85 C ATOM 603 O ASP A 41 7.391 6.865 -2.427 1.00 1.62 O ATOM 604 CB ASP A 41 10.023 8.949 -2.916 1.00 0.82 C ATOM 605 CG ASP A 41 11.534 9.046 -2.802 1.00 0.99 C ATOM 606 OD1 ASP A 41 12.048 9.863 -2.023 1.00 1.27 O ATOM 607 OD2 ASP A 41 12.234 8.332 -3.560 1.00 1.32 O ATOM 608 H ASP A 41 10.115 6.306 -2.419 1.00 0.64 H ATOM 609 HA ASP A 41 9.390 8.657 -0.838 1.00 0.70 H ATOM 610 HB2 ASP A 41 9.792 8.506 -3.873 1.00 1.07 H ATOM 611 HB3 ASP A 41 9.605 9.944 -2.893 1.00 1.03 H ATOM 612 N SER A 42 7.179 9.089 -2.312 1.00 0.50 N ATOM 613 CA SER A 42 5.784 9.118 -2.687 1.00 0.53 C ATOM 614 C SER A 42 5.582 8.574 -4.122 1.00 0.51 C ATOM 615 O SER A 42 4.528 8.016 -4.454 1.00 0.48 O ATOM 616 CB SER A 42 5.383 10.553 -2.650 1.00 0.69 C ATOM 617 OG SER A 42 6.437 11.264 -3.356 1.00 1.05 O ATOM 618 H SER A 42 7.607 9.965 -2.187 1.00 0.83 H ATOM 619 HA SER A 42 5.208 8.551 -1.969 1.00 0.54 H ATOM 620 HB2 SER A 42 4.435 10.674 -3.150 1.00 1.09 H ATOM 621 HB3 SER A 42 5.313 10.906 -1.633 1.00 1.08 H ATOM 622 N LEU A 43 6.627 8.725 -4.946 1.00 0.57 N ATOM 623 CA LEU A 43 6.602 8.352 -6.356 1.00 0.62 C ATOM 624 C LEU A 43 6.306 6.863 -6.499 1.00 0.56 C ATOM 625 O LEU A 43 5.271 6.479 -7.039 1.00 0.58 O ATOM 626 CB LEU A 43 7.965 8.750 -7.003 1.00 0.74 C ATOM 627 CG LEU A 43 8.113 8.693 -8.560 1.00 0.86 C ATOM 628 CD1 LEU A 43 8.093 7.272 -9.114 1.00 1.40 C ATOM 629 CD2 LEU A 43 7.050 9.544 -9.230 1.00 1.19 C ATOM 630 H LEU A 43 7.436 9.120 -4.558 1.00 0.63 H ATOM 631 HA LEU A 43 5.813 8.915 -6.836 1.00 0.68 H ATOM 632 HB2 LEU A 43 8.177 9.757 -6.684 1.00 0.80 H ATOM 633 HB3 LEU A 43 8.723 8.115 -6.574 1.00 0.74 H ATOM 634 HG LEU A 43 9.078 9.095 -8.823 1.00 1.21 H ATOM 635 HD11 LEU A 43 7.149 6.823 -8.846 1.00 2.04 H ATOM 636 HD12 LEU A 43 8.911 6.705 -8.695 1.00 1.94 H ATOM 637 HD13 LEU A 43 8.198 7.306 -10.187 1.00 1.66 H ATOM 638 HD21 LEU A 43 7.157 9.481 -10.301 1.00 1.69 H ATOM 639 HD22 LEU A 43 7.156 10.567 -8.906 1.00 1.62 H ATOM 640 HD23 LEU A 43 6.080 9.174 -8.938 1.00 1.71 H ATOM 641 N ALA A 44 7.201 6.035 -5.977 1.00 0.54 N ATOM 642 CA ALA A 44 7.056 4.592 -6.047 1.00 0.54 C ATOM 643 C ALA A 44 5.848 4.129 -5.264 1.00 0.47 C ATOM 644 O ALA A 44 5.245 3.115 -5.590 1.00 0.53 O ATOM 645 CB ALA A 44 8.314 3.906 -5.554 1.00 0.59 C ATOM 646 H ALA A 44 8.002 6.397 -5.548 1.00 0.57 H ATOM 647 HA ALA A 44 6.910 4.332 -7.083 1.00 0.62 H ATOM 648 HB1 ALA A 44 9.177 4.257 -6.104 1.00 1.28 H ATOM 649 HB2 ALA A 44 8.224 2.837 -5.674 1.00 1.12 H ATOM 650 HB3 ALA A 44 8.443 4.129 -4.506 1.00 1.13 H ATOM 651 N LEU A 45 5.477 4.900 -4.253 1.00 0.42 N ATOM 652 CA LEU A 45 4.373 4.551 -3.414 1.00 0.38 C ATOM 653 C LEU A 45 3.073 4.685 -4.198 1.00 0.37 C ATOM 654 O LEU A 45 2.176 3.836 -4.062 1.00 0.39 O ATOM 655 CB LEU A 45 4.387 5.403 -2.134 1.00 0.35 C ATOM 656 CG LEU A 45 3.684 4.837 -0.893 1.00 0.37 C ATOM 657 CD1 LEU A 45 4.004 5.687 0.306 1.00 0.38 C ATOM 658 CD2 LEU A 45 2.186 4.784 -1.068 1.00 0.53 C ATOM 659 H LEU A 45 5.976 5.722 -4.070 1.00 0.46 H ATOM 660 HA LEU A 45 4.481 3.514 -3.151 1.00 0.42 H ATOM 661 HB2 LEU A 45 5.417 5.588 -1.867 1.00 0.34 H ATOM 662 HB3 LEU A 45 3.927 6.352 -2.373 1.00 0.40 H ATOM 663 HG LEU A 45 4.045 3.835 -0.712 1.00 0.43 H ATOM 664 HD11 LEU A 45 3.664 6.691 0.112 1.00 1.04 H ATOM 665 HD12 LEU A 45 5.070 5.676 0.481 1.00 1.10 H ATOM 666 HD13 LEU A 45 3.484 5.293 1.168 1.00 1.14 H ATOM 667 HD21 LEU A 45 1.829 5.783 -1.276 1.00 0.97 H ATOM 668 HD22 LEU A 45 1.733 4.406 -0.165 1.00 1.13 H ATOM 669 HD23 LEU A 45 1.950 4.138 -1.899 1.00 1.32 H ATOM 670 N MET A 46 2.960 5.717 -5.047 1.00 0.37 N ATOM 671 CA MET A 46 1.764 5.835 -5.872 1.00 0.40 C ATOM 672 C MET A 46 1.563 4.636 -6.787 1.00 0.35 C ATOM 673 O MET A 46 0.416 4.186 -6.986 1.00 0.36 O ATOM 674 CB MET A 46 1.745 7.101 -6.694 1.00 0.52 C ATOM 675 CG MET A 46 1.445 8.333 -5.895 1.00 0.70 C ATOM 676 SD MET A 46 1.021 9.716 -6.958 1.00 0.96 S ATOM 677 CE MET A 46 -0.365 9.023 -7.873 1.00 2.41 C ATOM 678 H MET A 46 3.638 6.441 -5.099 1.00 0.38 H ATOM 679 HA MET A 46 0.930 5.874 -5.182 1.00 0.47 H ATOM 680 HB2 MET A 46 2.708 7.222 -7.167 1.00 0.53 H ATOM 681 HB3 MET A 46 0.994 6.995 -7.461 1.00 0.59 H ATOM 682 HG2 MET A 46 0.640 8.123 -5.204 1.00 0.73 H ATOM 683 HG3 MET A 46 2.337 8.581 -5.339 1.00 0.73 H ATOM 684 HE1 MET A 46 -0.744 9.765 -8.559 1.00 2.94 H ATOM 685 HE2 MET A 46 -1.151 8.742 -7.189 1.00 2.88 H ATOM 686 HE3 MET A 46 -0.052 8.151 -8.425 1.00 2.92 H ATOM 687 N GLU A 47 2.653 4.091 -7.322 1.00 0.37 N ATOM 688 CA GLU A 47 2.553 2.948 -8.221 1.00 0.39 C ATOM 689 C GLU A 47 2.028 1.683 -7.498 1.00 0.37 C ATOM 690 O GLU A 47 1.369 0.840 -8.109 1.00 0.43 O ATOM 691 CB GLU A 47 3.862 2.694 -9.015 1.00 0.48 C ATOM 692 CG GLU A 47 4.181 3.819 -10.017 1.00 0.68 C ATOM 693 CD GLU A 47 5.341 3.521 -10.965 1.00 1.41 C ATOM 694 OE1 GLU A 47 5.169 2.658 -11.866 1.00 1.84 O ATOM 695 OE2 GLU A 47 6.386 4.204 -10.911 1.00 2.15 O ATOM 696 H GLU A 47 3.538 4.444 -7.093 1.00 0.40 H ATOM 697 HA GLU A 47 1.776 3.230 -8.918 1.00 0.42 H ATOM 698 HB2 GLU A 47 4.683 2.630 -8.314 1.00 0.57 H ATOM 699 HB3 GLU A 47 3.783 1.761 -9.555 1.00 0.68 H ATOM 700 HG2 GLU A 47 3.303 3.997 -10.621 1.00 1.01 H ATOM 701 HG3 GLU A 47 4.412 4.708 -9.452 1.00 1.05 H ATOM 702 N THR A 48 2.271 1.598 -6.196 1.00 0.36 N ATOM 703 CA THR A 48 1.744 0.511 -5.367 1.00 0.39 C ATOM 704 C THR A 48 0.233 0.710 -5.147 1.00 0.35 C ATOM 705 O THR A 48 -0.552 -0.229 -5.288 1.00 0.40 O ATOM 706 CB THR A 48 2.439 0.533 -4.003 1.00 0.43 C ATOM 707 OG1 THR A 48 3.845 0.528 -4.200 1.00 0.51 O ATOM 708 CG2 THR A 48 2.039 -0.678 -3.171 1.00 0.51 C ATOM 709 H THR A 48 2.842 2.273 -5.760 1.00 0.38 H ATOM 710 HA THR A 48 1.927 -0.439 -5.854 1.00 0.44 H ATOM 711 HB THR A 48 2.151 1.431 -3.474 1.00 0.39 H ATOM 712 HG1 THR A 48 4.033 0.064 -5.030 1.00 0.77 H ATOM 713 HG21 THR A 48 2.337 -1.573 -3.697 1.00 1.01 H ATOM 714 HG22 THR A 48 0.967 -0.673 -3.019 1.00 1.20 H ATOM 715 HG23 THR A 48 2.551 -0.621 -2.222 1.00 1.19 H ATOM 716 N ALA A 49 -0.152 1.932 -4.791 1.00 0.31 N ATOM 717 CA ALA A 49 -1.552 2.271 -4.527 1.00 0.32 C ATOM 718 C ALA A 49 -2.426 1.914 -5.730 1.00 0.30 C ATOM 719 O ALA A 49 -3.388 1.135 -5.613 1.00 0.32 O ATOM 720 CB ALA A 49 -1.682 3.746 -4.186 1.00 0.38 C ATOM 721 H ALA A 49 0.537 2.626 -4.701 1.00 0.32 H ATOM 722 HA ALA A 49 -1.880 1.689 -3.676 1.00 0.36 H ATOM 723 HB1 ALA A 49 -1.069 3.979 -3.326 1.00 1.14 H ATOM 724 HB2 ALA A 49 -2.712 3.974 -3.949 1.00 1.07 H ATOM 725 HB3 ALA A 49 -1.360 4.346 -5.025 1.00 1.05 H ATOM 726 N ALA A 50 -2.032 2.406 -6.895 1.00 0.29 N ATOM 727 CA ALA A 50 -2.779 2.163 -8.126 1.00 0.31 C ATOM 728 C ALA A 50 -2.709 0.698 -8.541 1.00 0.31 C ATOM 729 O ALA A 50 -3.591 0.200 -9.240 1.00 0.35 O ATOM 730 CB ALA A 50 -2.275 3.056 -9.229 1.00 0.39 C ATOM 731 H ALA A 50 -1.215 2.952 -6.927 1.00 0.31 H ATOM 732 HA ALA A 50 -3.819 2.390 -7.947 1.00 0.32 H ATOM 733 HB1 ALA A 50 -2.325 4.087 -8.909 1.00 1.16 H ATOM 734 HB2 ALA A 50 -2.877 2.918 -10.115 1.00 1.05 H ATOM 735 HB3 ALA A 50 -1.252 2.796 -9.452 1.00 1.05 H ATOM 736 N ARG A 51 -1.682 0.002 -8.090 1.00 0.32 N ATOM 737 CA ARG A 51 -1.520 -1.399 -8.383 1.00 0.38 C ATOM 738 C ARG A 51 -2.630 -2.207 -7.717 1.00 0.37 C ATOM 739 O ARG A 51 -3.107 -3.210 -8.270 1.00 0.47 O ATOM 740 CB ARG A 51 -0.149 -1.888 -7.904 1.00 0.49 C ATOM 741 CG ARG A 51 0.191 -3.324 -8.262 1.00 0.97 C ATOM 742 CD ARG A 51 0.351 -3.514 -9.767 1.00 0.98 C ATOM 743 NE ARG A 51 -0.912 -3.358 -10.520 1.00 1.92 N ATOM 744 CZ ARG A 51 -0.999 -3.277 -11.858 1.00 2.31 C ATOM 745 NH1 ARG A 51 0.093 -3.450 -12.612 1.00 2.05 N ATOM 746 NH2 ARG A 51 -2.176 -3.002 -12.437 1.00 3.40 N ATOM 747 H ARG A 51 -1.001 0.466 -7.556 1.00 0.33 H ATOM 748 HA ARG A 51 -1.587 -1.536 -9.452 1.00 0.43 H ATOM 749 HB2 ARG A 51 0.623 -1.251 -8.313 1.00 1.08 H ATOM 750 HB3 ARG A 51 -0.131 -1.800 -6.828 1.00 1.12 H ATOM 751 HG2 ARG A 51 1.117 -3.599 -7.780 1.00 1.56 H ATOM 752 HG3 ARG A 51 -0.615 -3.957 -7.914 1.00 1.50 H ATOM 753 HD2 ARG A 51 1.057 -2.785 -10.137 1.00 1.17 H ATOM 754 HD3 ARG A 51 0.756 -4.498 -9.927 1.00 1.40 H ATOM 755 HE ARG A 51 -1.720 -3.273 -9.962 1.00 2.58 H ATOM 756 HH11 ARG A 51 0.994 -3.634 -12.218 1.00 1.81 H ATOM 757 HH12 ARG A 51 0.107 -3.415 -13.616 1.00 2.55 H ATOM 758 HH21 ARG A 51 -3.007 -2.838 -11.894 1.00 4.01 H ATOM 759 HH22 ARG A 51 -2.266 -2.944 -13.430 1.00 3.78 H ATOM 760 N LEU A 52 -3.034 -1.763 -6.546 1.00 0.32 N ATOM 761 CA LEU A 52 -4.106 -2.387 -5.820 1.00 0.34 C ATOM 762 C LEU A 52 -5.450 -1.903 -6.328 1.00 0.33 C ATOM 763 O LEU A 52 -6.369 -2.717 -6.543 1.00 0.40 O ATOM 764 CB LEU A 52 -3.972 -2.137 -4.323 1.00 0.35 C ATOM 765 CG LEU A 52 -2.762 -2.776 -3.651 1.00 0.38 C ATOM 766 CD1 LEU A 52 -2.701 -2.382 -2.189 1.00 0.43 C ATOM 767 CD2 LEU A 52 -2.830 -4.292 -3.788 1.00 0.39 C ATOM 768 H LEU A 52 -2.590 -0.976 -6.153 1.00 0.30 H ATOM 769 HA LEU A 52 -4.045 -3.454 -6.004 1.00 0.39 H ATOM 770 HB2 LEU A 52 -3.924 -1.067 -4.173 1.00 0.35 H ATOM 771 HB3 LEU A 52 -4.865 -2.505 -3.836 1.00 0.38 H ATOM 772 HG LEU A 52 -1.857 -2.431 -4.127 1.00 0.41 H ATOM 773 HD11 LEU A 52 -2.600 -1.310 -2.104 1.00 1.04 H ATOM 774 HD12 LEU A 52 -1.855 -2.867 -1.718 1.00 1.06 H ATOM 775 HD13 LEU A 52 -3.610 -2.687 -1.689 1.00 1.06 H ATOM 776 HD21 LEU A 52 -2.828 -4.556 -4.835 1.00 1.11 H ATOM 777 HD22 LEU A 52 -3.742 -4.649 -3.328 1.00 0.96 H ATOM 778 HD23 LEU A 52 -1.971 -4.725 -3.295 1.00 1.10 H ATOM 779 N GLU A 53 -5.562 -0.587 -6.552 1.00 0.28 N ATOM 780 CA GLU A 53 -6.800 -0.001 -7.022 1.00 0.29 C ATOM 781 C GLU A 53 -7.236 -0.587 -8.368 1.00 0.31 C ATOM 782 O GLU A 53 -8.412 -0.779 -8.586 1.00 0.35 O ATOM 783 CB GLU A 53 -6.741 1.525 -7.127 1.00 0.29 C ATOM 784 CG GLU A 53 -6.488 2.255 -5.826 1.00 0.35 C ATOM 785 CD GLU A 53 -6.697 3.753 -5.979 1.00 0.41 C ATOM 786 OE1 GLU A 53 -5.809 4.441 -6.558 1.00 0.53 O ATOM 787 OE2 GLU A 53 -7.707 4.271 -5.468 1.00 0.51 O ATOM 788 H GLU A 53 -4.800 0.011 -6.388 1.00 0.27 H ATOM 789 HA GLU A 53 -7.547 -0.264 -6.286 1.00 0.33 H ATOM 790 HB2 GLU A 53 -5.970 1.817 -7.823 1.00 0.29 H ATOM 791 HB3 GLU A 53 -7.699 1.860 -7.495 1.00 0.32 H ATOM 792 HG2 GLU A 53 -7.178 1.882 -5.082 1.00 0.41 H ATOM 793 HG3 GLU A 53 -5.470 2.073 -5.510 1.00 0.33 H ATOM 794 N SER A 54 -6.286 -0.902 -9.231 1.00 0.35 N ATOM 795 CA SER A 54 -6.598 -1.456 -10.537 1.00 0.43 C ATOM 796 C SER A 54 -7.075 -2.913 -10.474 1.00 0.47 C ATOM 797 O SER A 54 -7.857 -3.346 -11.311 1.00 0.61 O ATOM 798 CB SER A 54 -5.404 -1.307 -11.488 1.00 0.49 C ATOM 799 OG SER A 54 -4.189 -1.794 -10.900 1.00 1.16 O ATOM 800 H SER A 54 -5.348 -0.739 -9.000 1.00 0.36 H ATOM 801 HA SER A 54 -7.410 -0.861 -10.930 1.00 0.45 H ATOM 802 HB2 SER A 54 -5.604 -1.883 -12.377 1.00 1.13 H ATOM 803 HB3 SER A 54 -5.294 -0.263 -11.736 1.00 1.14 H ATOM 804 HG SER A 54 -3.806 -1.008 -10.482 1.00 1.39 H ATOM 805 N ARG A 55 -6.634 -3.656 -9.476 1.00 0.40 N ATOM 806 CA ARG A 55 -7.019 -5.046 -9.405 1.00 0.46 C ATOM 807 C ARG A 55 -8.380 -5.221 -8.721 1.00 0.47 C ATOM 808 O ARG A 55 -9.199 -6.038 -9.155 1.00 0.57 O ATOM 809 CB ARG A 55 -5.995 -5.899 -8.655 1.00 0.50 C ATOM 810 CG ARG A 55 -6.268 -7.382 -8.848 1.00 0.61 C ATOM 811 CD ARG A 55 -5.783 -8.237 -7.718 1.00 0.75 C ATOM 812 NE ARG A 55 -4.338 -8.162 -7.468 1.00 1.28 N ATOM 813 CZ ARG A 55 -3.769 -8.738 -6.403 1.00 1.65 C ATOM 814 NH1 ARG A 55 -4.488 -9.561 -5.654 1.00 1.46 N ATOM 815 NH2 ARG A 55 -2.492 -8.544 -6.113 1.00 2.65 N ATOM 816 H ARG A 55 -6.047 -3.246 -8.810 1.00 0.37 H ATOM 817 HA ARG A 55 -7.104 -5.421 -10.416 1.00 0.51 H ATOM 818 HB2 ARG A 55 -4.997 -5.677 -9.007 1.00 0.54 H ATOM 819 HB3 ARG A 55 -6.044 -5.682 -7.597 1.00 0.52 H ATOM 820 HG2 ARG A 55 -7.326 -7.550 -8.965 1.00 0.74 H ATOM 821 HG3 ARG A 55 -5.767 -7.692 -9.751 1.00 0.63 H ATOM 822 HD2 ARG A 55 -6.314 -7.928 -6.830 1.00 1.34 H ATOM 823 HD3 ARG A 55 -6.061 -9.257 -7.939 1.00 1.29 H ATOM 824 HE ARG A 55 -3.819 -7.633 -8.112 1.00 1.84 H ATOM 825 HH11 ARG A 55 -5.440 -9.790 -5.853 1.00 1.47 H ATOM 826 HH12 ARG A 55 -4.128 -9.972 -4.803 1.00 1.85 H ATOM 827 HH21 ARG A 55 -1.861 -7.982 -6.651 1.00 3.22 H ATOM 828 HH22 ARG A 55 -2.122 -8.976 -5.265 1.00 3.00 H ATOM 829 N TYR A 56 -8.593 -4.492 -7.638 1.00 0.42 N ATOM 830 CA TYR A 56 -9.814 -4.644 -6.857 1.00 0.47 C ATOM 831 C TYR A 56 -10.880 -3.595 -7.191 1.00 0.50 C ATOM 832 O TYR A 56 -12.072 -3.830 -6.977 1.00 0.67 O ATOM 833 CB TYR A 56 -9.502 -4.687 -5.342 1.00 0.52 C ATOM 834 CG TYR A 56 -8.754 -5.946 -4.923 1.00 0.53 C ATOM 835 CD1 TYR A 56 -9.441 -7.125 -4.700 1.00 0.62 C ATOM 836 CD2 TYR A 56 -7.368 -5.967 -4.772 1.00 0.59 C ATOM 837 CE1 TYR A 56 -8.791 -8.288 -4.347 1.00 0.70 C ATOM 838 CE2 TYR A 56 -6.704 -7.134 -4.408 1.00 0.65 C ATOM 839 CZ TYR A 56 -7.426 -8.294 -4.199 1.00 0.67 C ATOM 840 OH TYR A 56 -6.774 -9.476 -3.877 1.00 0.79 O ATOM 841 H TYR A 56 -7.917 -3.839 -7.358 1.00 0.39 H ATOM 842 HA TYR A 56 -10.212 -5.608 -7.139 1.00 0.51 H ATOM 843 HB2 TYR A 56 -8.904 -3.828 -5.069 1.00 0.53 H ATOM 844 HB3 TYR A 56 -10.436 -4.661 -4.796 1.00 0.56 H ATOM 845 HD1 TYR A 56 -10.512 -7.127 -4.811 1.00 0.70 H ATOM 846 HD2 TYR A 56 -6.813 -5.059 -4.937 1.00 0.66 H ATOM 847 HE1 TYR A 56 -9.365 -9.186 -4.177 1.00 0.83 H ATOM 848 HE2 TYR A 56 -5.629 -7.123 -4.293 1.00 0.75 H ATOM 849 HH TYR A 56 -6.049 -9.330 -3.254 1.00 0.95 H ATOM 850 N GLY A 57 -10.456 -2.465 -7.729 1.00 0.41 N ATOM 851 CA GLY A 57 -11.389 -1.410 -8.096 1.00 0.45 C ATOM 852 C GLY A 57 -11.822 -0.605 -6.901 1.00 0.46 C ATOM 853 O GLY A 57 -12.987 -0.646 -6.506 1.00 0.61 O ATOM 854 H GLY A 57 -9.502 -2.310 -7.899 1.00 0.38 H ATOM 855 HA2 GLY A 57 -10.889 -0.748 -8.788 1.00 0.47 H ATOM 856 HA3 GLY A 57 -12.261 -1.843 -8.563 1.00 0.50 H ATOM 857 N VAL A 58 -10.893 0.121 -6.311 1.00 0.38 N ATOM 858 CA VAL A 58 -11.216 0.904 -5.145 1.00 0.42 C ATOM 859 C VAL A 58 -11.057 2.396 -5.439 1.00 0.45 C ATOM 860 O VAL A 58 -10.812 2.774 -6.588 1.00 0.51 O ATOM 861 CB VAL A 58 -10.459 0.458 -3.833 1.00 0.42 C ATOM 862 CG1 VAL A 58 -10.455 -1.052 -3.680 1.00 0.59 C ATOM 863 CG2 VAL A 58 -9.051 1.016 -3.698 1.00 0.57 C ATOM 864 H VAL A 58 -9.993 0.165 -6.694 1.00 0.34 H ATOM 865 HA VAL A 58 -12.275 0.749 -4.997 1.00 0.50 H ATOM 866 HB VAL A 58 -11.058 0.830 -3.016 1.00 0.56 H ATOM 867 HG11 VAL A 58 -9.930 -1.320 -2.774 1.00 1.23 H ATOM 868 HG12 VAL A 58 -9.932 -1.474 -4.523 1.00 1.25 H ATOM 869 HG13 VAL A 58 -11.465 -1.438 -3.646 1.00 1.06 H ATOM 870 HG21 VAL A 58 -9.096 2.095 -3.728 1.00 1.05 H ATOM 871 HG22 VAL A 58 -8.434 0.632 -4.493 1.00 1.24 H ATOM 872 HG23 VAL A 58 -8.662 0.709 -2.735 1.00 1.24 H ATOM 873 N SER A 59 -11.215 3.230 -4.436 1.00 0.51 N ATOM 874 CA SER A 59 -11.109 4.646 -4.619 1.00 0.61 C ATOM 875 C SER A 59 -10.468 5.265 -3.387 1.00 0.56 C ATOM 876 O SER A 59 -11.075 5.297 -2.313 1.00 0.63 O ATOM 877 CB SER A 59 -12.511 5.246 -4.880 1.00 0.84 C ATOM 878 OG SER A 59 -12.465 6.634 -5.181 1.00 1.59 O ATOM 879 H SER A 59 -11.398 2.904 -3.532 1.00 0.54 H ATOM 880 HA SER A 59 -10.483 4.828 -5.478 1.00 0.62 H ATOM 881 HB2 SER A 59 -12.968 4.728 -5.708 1.00 1.32 H ATOM 882 HB3 SER A 59 -13.126 5.094 -4.006 1.00 1.36 H ATOM 883 HG SER A 59 -11.601 6.876 -5.526 1.00 2.14 H ATOM 884 N ILE A 60 -9.229 5.674 -3.521 1.00 0.50 N ATOM 885 CA ILE A 60 -8.533 6.379 -2.458 1.00 0.48 C ATOM 886 C ILE A 60 -8.741 7.893 -2.644 1.00 0.53 C ATOM 887 O ILE A 60 -8.302 8.456 -3.646 1.00 0.63 O ATOM 888 CB ILE A 60 -7.002 6.065 -2.460 1.00 0.48 C ATOM 889 CG1 ILE A 60 -6.736 4.555 -2.298 1.00 0.64 C ATOM 890 CG2 ILE A 60 -6.290 6.847 -1.356 1.00 0.53 C ATOM 891 CD1 ILE A 60 -7.290 3.963 -1.021 1.00 0.75 C ATOM 892 H ILE A 60 -8.734 5.475 -4.350 1.00 0.50 H ATOM 893 HA ILE A 60 -8.954 6.075 -1.505 1.00 0.59 H ATOM 894 HB ILE A 60 -6.600 6.387 -3.411 1.00 0.50 H ATOM 895 HG12 ILE A 60 -7.192 4.020 -3.119 1.00 1.29 H ATOM 896 HG13 ILE A 60 -5.667 4.390 -2.306 1.00 1.27 H ATOM 897 HG21 ILE A 60 -6.444 7.905 -1.515 1.00 1.01 H ATOM 898 HG22 ILE A 60 -5.236 6.619 -1.381 1.00 1.13 H ATOM 899 HG23 ILE A 60 -6.697 6.571 -0.394 1.00 1.23 H ATOM 900 HD11 ILE A 60 -6.858 4.469 -0.171 1.00 1.11 H ATOM 901 HD12 ILE A 60 -7.038 2.914 -0.966 1.00 1.35 H ATOM 902 HD13 ILE A 60 -8.366 4.062 -0.986 1.00 1.64 H ATOM 903 N PRO A 61 -9.435 8.564 -1.701 1.00 0.65 N ATOM 904 CA PRO A 61 -9.663 10.003 -1.785 1.00 0.77 C ATOM 905 C PRO A 61 -8.376 10.789 -1.540 1.00 0.65 C ATOM 906 O PRO A 61 -7.651 10.504 -0.584 1.00 0.57 O ATOM 907 CB PRO A 61 -10.673 10.281 -0.659 1.00 0.97 C ATOM 908 CG PRO A 61 -11.169 8.945 -0.236 1.00 1.08 C ATOM 909 CD PRO A 61 -10.058 7.991 -0.513 1.00 0.83 C ATOM 910 HA PRO A 61 -10.093 10.274 -2.741 1.00 0.88 H ATOM 911 HB2 PRO A 61 -10.162 10.775 0.154 1.00 0.93 H ATOM 912 HB3 PRO A 61 -11.475 10.906 -1.022 1.00 1.15 H ATOM 913 HG2 PRO A 61 -11.394 8.976 0.819 1.00 1.24 H ATOM 914 HG3 PRO A 61 -12.050 8.685 -0.803 1.00 1.25 H ATOM 915 HD2 PRO A 61 -9.376 7.971 0.322 1.00 0.83 H ATOM 916 HD3 PRO A 61 -10.461 7.014 -0.723 1.00 0.88 H ATOM 917 N ASP A 62 -8.131 11.767 -2.400 1.00 0.74 N ATOM 918 CA ASP A 62 -6.942 12.688 -2.375 1.00 0.73 C ATOM 919 C ASP A 62 -6.590 13.146 -0.951 1.00 0.62 C ATOM 920 O ASP A 62 -5.486 12.906 -0.447 1.00 0.64 O ATOM 921 CB ASP A 62 -7.290 13.900 -3.272 1.00 0.93 C ATOM 922 CG ASP A 62 -6.332 15.083 -3.214 1.00 1.44 C ATOM 923 OD1 ASP A 62 -5.378 15.134 -3.993 1.00 2.07 O ATOM 924 OD2 ASP A 62 -6.617 16.047 -2.456 1.00 1.92 O ATOM 925 H ASP A 62 -8.777 11.898 -3.127 1.00 0.89 H ATOM 926 HA ASP A 62 -6.099 12.174 -2.809 1.00 0.74 H ATOM 927 HB2 ASP A 62 -7.335 13.571 -4.298 1.00 1.42 H ATOM 928 HB3 ASP A 62 -8.272 14.248 -2.983 1.00 1.50 H ATOM 929 N ASP A 63 -7.575 13.725 -0.302 1.00 0.63 N ATOM 930 CA ASP A 63 -7.454 14.267 1.064 1.00 0.61 C ATOM 931 C ASP A 63 -7.121 13.186 2.105 1.00 0.59 C ATOM 932 O ASP A 63 -6.397 13.427 3.075 1.00 0.64 O ATOM 933 CB ASP A 63 -8.781 14.949 1.416 1.00 0.77 C ATOM 934 CG ASP A 63 -8.872 15.518 2.818 1.00 1.36 C ATOM 935 OD1 ASP A 63 -9.303 14.792 3.741 1.00 2.10 O ATOM 936 OD2 ASP A 63 -8.586 16.718 2.998 1.00 2.00 O ATOM 937 H ASP A 63 -8.428 13.821 -0.776 1.00 0.73 H ATOM 938 HA ASP A 63 -6.680 15.020 1.062 1.00 0.64 H ATOM 939 HB2 ASP A 63 -8.921 15.773 0.728 1.00 1.22 H ATOM 940 HB3 ASP A 63 -9.583 14.240 1.270 1.00 1.43 H ATOM 941 N VAL A 64 -7.645 12.000 1.902 1.00 0.62 N ATOM 942 CA VAL A 64 -7.469 10.914 2.849 1.00 0.69 C ATOM 943 C VAL A 64 -6.150 10.118 2.614 1.00 0.67 C ATOM 944 O VAL A 64 -5.667 9.404 3.505 1.00 0.78 O ATOM 945 CB VAL A 64 -8.717 9.969 2.878 1.00 0.82 C ATOM 946 CG1 VAL A 64 -8.595 8.887 3.947 1.00 0.98 C ATOM 947 CG2 VAL A 64 -9.977 10.785 3.099 1.00 0.90 C ATOM 948 H VAL A 64 -8.125 11.850 1.062 1.00 0.65 H ATOM 949 HA VAL A 64 -7.383 11.383 3.818 1.00 0.75 H ATOM 950 HB VAL A 64 -8.799 9.489 1.915 1.00 0.81 H ATOM 951 HG11 VAL A 64 -8.488 9.341 4.920 1.00 1.47 H ATOM 952 HG12 VAL A 64 -7.724 8.283 3.747 1.00 1.46 H ATOM 953 HG13 VAL A 64 -9.471 8.255 3.946 1.00 1.30 H ATOM 954 HG21 VAL A 64 -9.923 11.304 4.047 1.00 1.40 H ATOM 955 HG22 VAL A 64 -10.834 10.127 3.095 1.00 1.21 H ATOM 956 HG23 VAL A 64 -10.062 11.496 2.288 1.00 1.47 H ATOM 957 N ALA A 65 -5.555 10.288 1.444 1.00 0.61 N ATOM 958 CA ALA A 65 -4.334 9.566 1.084 1.00 0.67 C ATOM 959 C ALA A 65 -3.153 9.990 1.947 1.00 0.64 C ATOM 960 O ALA A 65 -2.410 9.152 2.463 1.00 0.74 O ATOM 961 CB ALA A 65 -4.028 9.737 -0.404 1.00 0.77 C ATOM 962 H ALA A 65 -5.941 10.910 0.788 1.00 0.61 H ATOM 963 HA ALA A 65 -4.479 8.514 1.283 1.00 0.76 H ATOM 964 HB1 ALA A 65 -3.179 9.128 -0.678 1.00 1.31 H ATOM 965 HB2 ALA A 65 -3.818 10.776 -0.624 1.00 1.30 H ATOM 966 HB3 ALA A 65 -4.888 9.417 -0.972 1.00 1.19 H ATOM 967 N GLY A 66 -3.025 11.280 2.173 1.00 0.58 N ATOM 968 CA GLY A 66 -1.926 11.789 2.975 1.00 0.66 C ATOM 969 C GLY A 66 -2.217 11.749 4.471 1.00 0.68 C ATOM 970 O GLY A 66 -1.891 12.686 5.191 1.00 0.86 O ATOM 971 H GLY A 66 -3.686 11.891 1.781 1.00 0.56 H ATOM 972 HA2 GLY A 66 -1.032 11.216 2.777 1.00 0.71 H ATOM 973 HA3 GLY A 66 -1.754 12.815 2.692 1.00 0.76 H ATOM 974 N ARG A 67 -2.841 10.680 4.926 1.00 0.64 N ATOM 975 CA ARG A 67 -3.180 10.544 6.335 1.00 0.79 C ATOM 976 C ARG A 67 -2.551 9.298 6.949 1.00 0.77 C ATOM 977 O ARG A 67 -2.740 9.010 8.126 1.00 0.95 O ATOM 978 CB ARG A 67 -4.702 10.529 6.550 1.00 0.94 C ATOM 979 CG ARG A 67 -5.409 11.786 6.084 1.00 1.12 C ATOM 980 CD ARG A 67 -6.885 11.727 6.422 1.00 1.40 C ATOM 981 NE ARG A 67 -7.597 12.942 6.001 1.00 1.89 N ATOM 982 CZ ARG A 67 -8.308 13.733 6.815 1.00 2.51 C ATOM 983 NH1 ARG A 67 -8.273 13.553 8.128 1.00 2.93 N ATOM 984 NH2 ARG A 67 -9.014 14.728 6.326 1.00 3.22 N ATOM 985 H ARG A 67 -3.069 9.967 4.291 1.00 0.62 H ATOM 986 HA ARG A 67 -2.775 11.407 6.847 1.00 0.90 H ATOM 987 HB2 ARG A 67 -5.128 9.695 6.010 1.00 1.03 H ATOM 988 HB3 ARG A 67 -4.900 10.400 7.608 1.00 1.14 H ATOM 989 HG2 ARG A 67 -4.975 12.649 6.563 1.00 1.53 H ATOM 990 HG3 ARG A 67 -5.285 11.882 5.016 1.00 1.58 H ATOM 991 HD2 ARG A 67 -7.333 10.875 5.928 1.00 1.87 H ATOM 992 HD3 ARG A 67 -6.993 11.628 7.493 1.00 1.90 H ATOM 993 HE ARG A 67 -7.552 13.152 5.039 1.00 2.27 H ATOM 994 HH11 ARG A 67 -7.730 12.838 8.575 1.00 2.92 H ATOM 995 HH12 ARG A 67 -8.818 14.175 8.710 1.00 3.61 H ATOM 996 HH21 ARG A 67 -9.054 14.916 5.329 1.00 3.51 H ATOM 997 HH22 ARG A 67 -9.538 15.335 6.932 1.00 3.77 H ATOM 998 N VAL A 68 -1.814 8.565 6.141 1.00 0.62 N ATOM 999 CA VAL A 68 -1.158 7.331 6.584 1.00 0.66 C ATOM 1000 C VAL A 68 0.337 7.567 6.823 1.00 0.67 C ATOM 1001 O VAL A 68 0.919 8.457 6.197 1.00 1.00 O ATOM 1002 CB VAL A 68 -1.370 6.148 5.576 1.00 0.68 C ATOM 1003 CG1 VAL A 68 -2.815 5.696 5.578 1.00 0.77 C ATOM 1004 CG2 VAL A 68 -0.970 6.544 4.143 1.00 0.64 C ATOM 1005 H VAL A 68 -1.659 8.867 5.222 1.00 0.55 H ATOM 1006 HA VAL A 68 -1.608 7.073 7.529 1.00 0.78 H ATOM 1007 HB VAL A 68 -0.755 5.313 5.878 1.00 0.78 H ATOM 1008 HG11 VAL A 68 -3.461 6.511 5.281 1.00 1.27 H ATOM 1009 HG12 VAL A 68 -3.096 5.354 6.565 1.00 1.31 H ATOM 1010 HG13 VAL A 68 -2.920 4.884 4.872 1.00 1.26 H ATOM 1011 HG21 VAL A 68 -1.605 7.343 3.780 1.00 1.20 H ATOM 1012 HG22 VAL A 68 -1.076 5.689 3.488 1.00 1.23 H ATOM 1013 HG23 VAL A 68 0.060 6.870 4.147 1.00 1.15 H ATOM 1014 N ASP A 69 0.954 6.801 7.718 1.00 0.54 N ATOM 1015 CA ASP A 69 2.401 6.940 7.975 1.00 0.64 C ATOM 1016 C ASP A 69 3.090 5.571 7.846 1.00 0.50 C ATOM 1017 O ASP A 69 4.246 5.463 7.392 1.00 0.54 O ATOM 1018 CB ASP A 69 2.639 7.531 9.382 1.00 0.99 C ATOM 1019 CG ASP A 69 4.092 7.851 9.678 1.00 1.11 C ATOM 1020 OD1 ASP A 69 4.555 8.946 9.337 1.00 1.37 O ATOM 1021 OD2 ASP A 69 4.820 6.969 10.206 1.00 1.84 O ATOM 1022 H ASP A 69 0.445 6.144 8.253 1.00 0.66 H ATOM 1023 HA ASP A 69 2.802 7.614 7.231 1.00 0.75 H ATOM 1024 HB2 ASP A 69 2.080 8.448 9.492 1.00 1.65 H ATOM 1025 HB3 ASP A 69 2.298 6.822 10.118 1.00 1.55 H ATOM 1026 N THR A 70 2.371 4.524 8.229 1.00 0.43 N ATOM 1027 CA THR A 70 2.874 3.157 8.147 1.00 0.37 C ATOM 1028 C THR A 70 2.002 2.278 7.197 1.00 0.33 C ATOM 1029 O THR A 70 0.793 2.554 7.008 1.00 0.34 O ATOM 1030 CB THR A 70 2.914 2.516 9.550 1.00 0.42 C ATOM 1031 OG1 THR A 70 1.646 2.670 10.197 1.00 0.51 O ATOM 1032 CG2 THR A 70 4.005 3.142 10.400 1.00 0.44 C ATOM 1033 H THR A 70 1.470 4.676 8.595 1.00 0.50 H ATOM 1034 HA THR A 70 3.879 3.197 7.759 1.00 0.40 H ATOM 1035 HB THR A 70 3.122 1.464 9.432 1.00 0.46 H ATOM 1036 HG1 THR A 70 1.338 3.583 10.094 1.00 0.52 H ATOM 1037 HG21 THR A 70 4.959 2.984 9.917 1.00 1.19 H ATOM 1038 HG22 THR A 70 4.016 2.676 11.374 1.00 1.03 H ATOM 1039 HG23 THR A 70 3.824 4.203 10.496 1.00 1.11 H ATOM 1040 N PRO A 71 2.594 1.215 6.577 1.00 0.32 N ATOM 1041 CA PRO A 71 1.887 0.276 5.670 1.00 0.31 C ATOM 1042 C PRO A 71 0.667 -0.388 6.313 1.00 0.29 C ATOM 1043 O PRO A 71 -0.292 -0.740 5.623 1.00 0.33 O ATOM 1044 CB PRO A 71 2.955 -0.779 5.336 1.00 0.34 C ATOM 1045 CG PRO A 71 4.235 -0.060 5.514 1.00 0.38 C ATOM 1046 CD PRO A 71 4.022 0.874 6.669 1.00 0.36 C ATOM 1047 HA PRO A 71 1.577 0.768 4.760 1.00 0.35 H ATOM 1048 HB2 PRO A 71 2.880 -1.645 5.982 1.00 0.33 H ATOM 1049 HB3 PRO A 71 2.834 -1.082 4.306 1.00 0.41 H ATOM 1050 HG2 PRO A 71 5.024 -0.763 5.741 1.00 0.40 H ATOM 1051 HG3 PRO A 71 4.471 0.494 4.619 1.00 0.43 H ATOM 1052 HD2 PRO A 71 4.225 0.379 7.607 1.00 0.36 H ATOM 1053 HD3 PRO A 71 4.623 1.768 6.575 1.00 0.41 H ATOM 1054 N ARG A 72 0.716 -0.552 7.629 1.00 0.30 N ATOM 1055 CA ARG A 72 -0.387 -1.144 8.377 1.00 0.34 C ATOM 1056 C ARG A 72 -1.639 -0.312 8.184 1.00 0.36 C ATOM 1057 O ARG A 72 -2.714 -0.835 7.929 1.00 0.43 O ATOM 1058 CB ARG A 72 -0.045 -1.202 9.868 1.00 0.41 C ATOM 1059 CG ARG A 72 -1.137 -1.797 10.768 1.00 0.54 C ATOM 1060 CD ARG A 72 -0.760 -1.715 12.239 1.00 0.69 C ATOM 1061 NE ARG A 72 -0.580 -0.322 12.681 1.00 0.75 N ATOM 1062 CZ ARG A 72 0.538 0.169 13.248 1.00 0.98 C ATOM 1063 NH1 ARG A 72 1.573 -0.639 13.501 1.00 1.38 N ATOM 1064 NH2 ARG A 72 0.610 1.452 13.569 1.00 1.16 N ATOM 1065 H ARG A 72 1.519 -0.259 8.116 1.00 0.31 H ATOM 1066 HA ARG A 72 -0.545 -2.146 8.007 1.00 0.37 H ATOM 1067 HB2 ARG A 72 0.843 -1.799 9.994 1.00 0.47 H ATOM 1068 HB3 ARG A 72 0.158 -0.199 10.207 1.00 0.43 H ATOM 1069 HG2 ARG A 72 -2.053 -1.236 10.638 1.00 0.56 H ATOM 1070 HG3 ARG A 72 -1.281 -2.832 10.486 1.00 0.63 H ATOM 1071 HD2 ARG A 72 -1.552 -2.155 12.827 1.00 0.82 H ATOM 1072 HD3 ARG A 72 0.156 -2.261 12.402 1.00 0.79 H ATOM 1073 HE ARG A 72 -1.364 0.259 12.527 1.00 0.96 H ATOM 1074 HH11 ARG A 72 1.577 -1.616 13.284 1.00 1.51 H ATOM 1075 HH12 ARG A 72 2.429 -0.306 13.939 1.00 1.75 H ATOM 1076 HH21 ARG A 72 -0.142 2.094 13.413 1.00 1.26 H ATOM 1077 HH22 ARG A 72 1.454 1.835 13.973 1.00 1.42 H ATOM 1078 N GLU A 73 -1.458 0.988 8.266 1.00 0.37 N ATOM 1079 CA GLU A 73 -2.541 1.942 8.149 1.00 0.42 C ATOM 1080 C GLU A 73 -3.018 2.028 6.730 1.00 0.40 C ATOM 1081 O GLU A 73 -4.195 2.160 6.492 1.00 0.44 O ATOM 1082 CB GLU A 73 -2.062 3.301 8.603 1.00 0.50 C ATOM 1083 CG GLU A 73 -1.513 3.283 10.002 1.00 0.63 C ATOM 1084 CD GLU A 73 -0.946 4.589 10.379 1.00 0.74 C ATOM 1085 OE1 GLU A 73 0.109 4.975 9.790 1.00 0.69 O ATOM 1086 OE2 GLU A 73 -1.549 5.255 11.241 1.00 1.33 O ATOM 1087 H GLU A 73 -0.555 1.343 8.406 1.00 0.36 H ATOM 1088 HA GLU A 73 -3.358 1.632 8.785 1.00 0.45 H ATOM 1089 HB2 GLU A 73 -1.277 3.636 7.937 1.00 0.50 H ATOM 1090 HB3 GLU A 73 -2.873 4.013 8.559 1.00 0.58 H ATOM 1091 HG2 GLU A 73 -2.312 3.039 10.685 1.00 1.01 H ATOM 1092 HG3 GLU A 73 -0.738 2.536 10.062 1.00 0.99 H ATOM 1093 N LEU A 74 -2.083 1.956 5.783 1.00 0.40 N ATOM 1094 CA LEU A 74 -2.423 2.015 4.361 1.00 0.43 C ATOM 1095 C LEU A 74 -3.342 0.833 4.041 1.00 0.41 C ATOM 1096 O LEU A 74 -4.398 1.007 3.432 1.00 0.42 O ATOM 1097 CB LEU A 74 -1.128 1.983 3.503 1.00 0.44 C ATOM 1098 CG LEU A 74 -1.207 2.501 2.037 1.00 0.50 C ATOM 1099 CD1 LEU A 74 0.157 2.496 1.380 1.00 1.04 C ATOM 1100 CD2 LEU A 74 -2.174 1.700 1.187 1.00 1.10 C ATOM 1101 H LEU A 74 -1.150 1.878 6.076 1.00 0.42 H ATOM 1102 HA LEU A 74 -2.971 2.923 4.166 1.00 0.46 H ATOM 1103 HB2 LEU A 74 -0.394 2.569 4.032 1.00 0.46 H ATOM 1104 HB3 LEU A 74 -0.772 0.966 3.474 1.00 0.45 H ATOM 1105 HG LEU A 74 -1.544 3.526 2.071 1.00 0.90 H ATOM 1106 HD11 LEU A 74 0.063 2.852 0.365 1.00 1.74 H ATOM 1107 HD12 LEU A 74 0.556 1.494 1.391 1.00 1.51 H ATOM 1108 HD13 LEU A 74 0.817 3.148 1.929 1.00 1.48 H ATOM 1109 HD21 LEU A 74 -1.860 0.668 1.123 1.00 1.61 H ATOM 1110 HD22 LEU A 74 -2.236 2.134 0.202 1.00 1.53 H ATOM 1111 HD23 LEU A 74 -3.142 1.743 1.660 1.00 1.77 H ATOM 1112 N LEU A 75 -2.950 -0.345 4.497 1.00 0.41 N ATOM 1113 CA LEU A 75 -3.724 -1.558 4.276 1.00 0.41 C ATOM 1114 C LEU A 75 -5.099 -1.431 4.946 1.00 0.39 C ATOM 1115 O LEU A 75 -6.153 -1.621 4.298 1.00 0.37 O ATOM 1116 CB LEU A 75 -2.970 -2.761 4.866 1.00 0.46 C ATOM 1117 CG LEU A 75 -3.611 -4.138 4.665 1.00 0.48 C ATOM 1118 CD1 LEU A 75 -3.596 -4.533 3.192 1.00 0.51 C ATOM 1119 CD2 LEU A 75 -2.890 -5.171 5.505 1.00 0.54 C ATOM 1120 H LEU A 75 -2.108 -0.407 4.999 1.00 0.44 H ATOM 1121 HA LEU A 75 -3.855 -1.710 3.212 1.00 0.43 H ATOM 1122 HB2 LEU A 75 -1.988 -2.783 4.417 1.00 0.49 H ATOM 1123 HB3 LEU A 75 -2.854 -2.580 5.923 1.00 0.48 H ATOM 1124 HG LEU A 75 -4.643 -4.102 4.986 1.00 0.46 H ATOM 1125 HD11 LEU A 75 -4.119 -3.811 2.579 1.00 1.20 H ATOM 1126 HD12 LEU A 75 -4.066 -5.500 3.095 1.00 1.09 H ATOM 1127 HD13 LEU A 75 -2.562 -4.607 2.886 1.00 1.04 H ATOM 1128 HD21 LEU A 75 -2.959 -4.878 6.545 1.00 1.17 H ATOM 1129 HD22 LEU A 75 -1.860 -5.206 5.181 1.00 1.16 H ATOM 1130 HD23 LEU A 75 -3.349 -6.141 5.364 1.00 1.11 H ATOM 1131 N ASP A 76 -5.081 -1.068 6.221 1.00 0.44 N ATOM 1132 CA ASP A 76 -6.290 -0.931 7.036 1.00 0.48 C ATOM 1133 C ASP A 76 -7.247 0.118 6.465 1.00 0.40 C ATOM 1134 O ASP A 76 -8.461 -0.097 6.429 1.00 0.44 O ATOM 1135 CB ASP A 76 -5.912 -0.606 8.489 1.00 0.66 C ATOM 1136 CG ASP A 76 -7.098 -0.494 9.414 1.00 1.06 C ATOM 1137 OD1 ASP A 76 -7.840 -1.504 9.572 1.00 1.08 O ATOM 1138 OD2 ASP A 76 -7.270 0.576 10.044 1.00 1.89 O ATOM 1139 H ASP A 76 -4.211 -0.890 6.644 1.00 0.49 H ATOM 1140 HA ASP A 76 -6.800 -1.884 7.023 1.00 0.53 H ATOM 1141 HB2 ASP A 76 -5.265 -1.385 8.865 1.00 1.10 H ATOM 1142 HB3 ASP A 76 -5.372 0.329 8.513 1.00 1.09 H ATOM 1143 N LEU A 77 -6.699 1.218 5.960 1.00 0.37 N ATOM 1144 CA LEU A 77 -7.502 2.280 5.376 1.00 0.38 C ATOM 1145 C LEU A 77 -8.220 1.778 4.113 1.00 0.33 C ATOM 1146 O LEU A 77 -9.392 2.110 3.881 1.00 0.34 O ATOM 1147 CB LEU A 77 -6.628 3.503 5.041 1.00 0.46 C ATOM 1148 CG LEU A 77 -7.365 4.750 4.581 1.00 0.57 C ATOM 1149 CD1 LEU A 77 -8.234 5.281 5.713 1.00 1.37 C ATOM 1150 CD2 LEU A 77 -6.372 5.799 4.105 1.00 1.24 C ATOM 1151 H LEU A 77 -5.721 1.320 5.997 1.00 0.40 H ATOM 1152 HA LEU A 77 -8.243 2.577 6.103 1.00 0.45 H ATOM 1153 HB2 LEU A 77 -6.082 3.771 5.930 1.00 0.58 H ATOM 1154 HB3 LEU A 77 -5.925 3.233 4.272 1.00 0.49 H ATOM 1155 HG LEU A 77 -8.019 4.491 3.759 1.00 1.09 H ATOM 1156 HD11 LEU A 77 -8.945 4.515 5.981 1.00 1.82 H ATOM 1157 HD12 LEU A 77 -8.755 6.169 5.389 1.00 1.74 H ATOM 1158 HD13 LEU A 77 -7.607 5.499 6.564 1.00 2.11 H ATOM 1159 HD21 LEU A 77 -6.904 6.682 3.788 1.00 1.84 H ATOM 1160 HD22 LEU A 77 -5.806 5.397 3.279 1.00 1.74 H ATOM 1161 HD23 LEU A 77 -5.696 6.044 4.912 1.00 1.79 H ATOM 1162 N ILE A 78 -7.530 0.956 3.322 1.00 0.31 N ATOM 1163 CA ILE A 78 -8.132 0.407 2.109 1.00 0.32 C ATOM 1164 C ILE A 78 -9.196 -0.605 2.498 1.00 0.29 C ATOM 1165 O ILE A 78 -10.282 -0.635 1.910 1.00 0.33 O ATOM 1166 CB ILE A 78 -7.082 -0.234 1.141 1.00 0.39 C ATOM 1167 CG1 ILE A 78 -6.143 0.854 0.584 1.00 0.53 C ATOM 1168 CG2 ILE A 78 -7.784 -0.995 0.000 1.00 0.44 C ATOM 1169 CD1 ILE A 78 -5.169 0.384 -0.492 1.00 0.63 C ATOM 1170 H ILE A 78 -6.611 0.712 3.584 1.00 0.33 H ATOM 1171 HA ILE A 78 -8.630 1.225 1.605 1.00 0.39 H ATOM 1172 HB ILE A 78 -6.507 -0.936 1.728 1.00 0.40 H ATOM 1173 HG12 ILE A 78 -6.737 1.646 0.149 1.00 1.11 H ATOM 1174 HG13 ILE A 78 -5.553 1.256 1.399 1.00 1.01 H ATOM 1175 HG21 ILE A 78 -8.413 -0.305 -0.545 1.00 1.18 H ATOM 1176 HG22 ILE A 78 -8.389 -1.780 0.431 1.00 0.99 H ATOM 1177 HG23 ILE A 78 -7.048 -1.422 -0.663 1.00 1.11 H ATOM 1178 HD11 ILE A 78 -4.540 -0.409 -0.114 1.00 1.29 H ATOM 1179 HD12 ILE A 78 -4.562 1.228 -0.791 1.00 1.27 H ATOM 1180 HD13 ILE A 78 -5.725 0.038 -1.351 1.00 1.30 H ATOM 1181 N ASN A 79 -8.907 -1.396 3.518 1.00 0.30 N ATOM 1182 CA ASN A 79 -9.871 -2.367 4.035 1.00 0.33 C ATOM 1183 C ASN A 79 -11.140 -1.652 4.494 1.00 0.37 C ATOM 1184 O ASN A 79 -12.254 -2.102 4.219 1.00 0.46 O ATOM 1185 CB ASN A 79 -9.305 -3.190 5.200 1.00 0.42 C ATOM 1186 CG ASN A 79 -8.140 -4.111 4.847 1.00 0.53 C ATOM 1187 OD1 ASN A 79 -7.292 -4.397 5.696 1.00 1.21 O ATOM 1188 ND2 ASN A 79 -8.088 -4.594 3.619 1.00 0.55 N ATOM 1189 H ASN A 79 -8.019 -1.310 3.938 1.00 0.32 H ATOM 1190 HA ASN A 79 -10.123 -3.029 3.218 1.00 0.39 H ATOM 1191 HB2 ASN A 79 -8.966 -2.515 5.970 1.00 0.48 H ATOM 1192 HB3 ASN A 79 -10.106 -3.787 5.608 1.00 0.47 H ATOM 1193 HD21 ASN A 79 -8.780 -4.358 2.971 1.00 1.07 H ATOM 1194 HD22 ASN A 79 -7.325 -5.177 3.417 1.00 0.51 H ATOM 1195 N GLY A 80 -10.958 -0.533 5.167 1.00 0.37 N ATOM 1196 CA GLY A 80 -12.071 0.277 5.611 1.00 0.46 C ATOM 1197 C GLY A 80 -12.857 0.864 4.453 1.00 0.47 C ATOM 1198 O GLY A 80 -14.093 0.887 4.482 1.00 0.57 O ATOM 1199 H GLY A 80 -10.039 -0.264 5.392 1.00 0.36 H ATOM 1200 HA2 GLY A 80 -12.732 -0.324 6.218 1.00 0.53 H ATOM 1201 HA3 GLY A 80 -11.696 1.095 6.208 1.00 0.49 H ATOM 1202 N ALA A 81 -12.153 1.315 3.409 1.00 0.43 N ATOM 1203 CA ALA A 81 -12.797 1.893 2.256 1.00 0.49 C ATOM 1204 C ALA A 81 -13.585 0.835 1.488 1.00 0.54 C ATOM 1205 O ALA A 81 -14.617 1.133 0.892 1.00 0.68 O ATOM 1206 CB ALA A 81 -11.782 2.592 1.368 1.00 0.49 C ATOM 1207 H ALA A 81 -11.173 1.274 3.400 1.00 0.39 H ATOM 1208 HA ALA A 81 -13.497 2.626 2.624 1.00 0.55 H ATOM 1209 HB1 ALA A 81 -11.269 3.347 1.945 1.00 1.19 H ATOM 1210 HB2 ALA A 81 -12.289 3.048 0.532 1.00 1.14 H ATOM 1211 HB3 ALA A 81 -11.066 1.867 1.008 1.00 1.01 H ATOM 1212 N LEU A 82 -13.093 -0.397 1.525 1.00 0.48 N ATOM 1213 CA LEU A 82 -13.783 -1.549 0.948 1.00 0.57 C ATOM 1214 C LEU A 82 -15.137 -1.746 1.622 1.00 0.70 C ATOM 1215 O LEU A 82 -16.137 -1.960 0.958 1.00 0.87 O ATOM 1216 CB LEU A 82 -12.939 -2.833 1.098 1.00 0.54 C ATOM 1217 CG LEU A 82 -11.637 -2.897 0.291 1.00 0.55 C ATOM 1218 CD1 LEU A 82 -10.868 -4.153 0.641 1.00 0.61 C ATOM 1219 CD2 LEU A 82 -11.942 -2.884 -1.193 1.00 0.63 C ATOM 1220 H LEU A 82 -12.212 -0.523 1.940 1.00 0.42 H ATOM 1221 HA LEU A 82 -13.934 -1.350 -0.103 1.00 0.62 H ATOM 1222 HB2 LEU A 82 -12.698 -2.965 2.142 1.00 0.56 H ATOM 1223 HB3 LEU A 82 -13.554 -3.670 0.798 1.00 0.59 H ATOM 1224 HG LEU A 82 -11.012 -2.046 0.524 1.00 0.57 H ATOM 1225 HD11 LEU A 82 -10.662 -4.156 1.700 1.00 1.16 H ATOM 1226 HD12 LEU A 82 -9.938 -4.175 0.092 1.00 1.10 H ATOM 1227 HD13 LEU A 82 -11.451 -5.024 0.387 1.00 1.22 H ATOM 1228 HD21 LEU A 82 -11.024 -2.925 -1.760 1.00 1.12 H ATOM 1229 HD22 LEU A 82 -12.464 -1.972 -1.435 1.00 1.26 H ATOM 1230 HD23 LEU A 82 -12.559 -3.730 -1.458 1.00 1.22 H ATOM 1231 N ALA A 83 -15.157 -1.628 2.942 1.00 0.69 N ATOM 1232 CA ALA A 83 -16.377 -1.805 3.728 1.00 0.87 C ATOM 1233 C ALA A 83 -17.381 -0.696 3.455 1.00 1.01 C ATOM 1234 O ALA A 83 -18.590 -0.919 3.517 1.00 1.25 O ATOM 1235 CB ALA A 83 -16.054 -1.892 5.219 1.00 0.90 C ATOM 1236 H ALA A 83 -14.320 -1.412 3.403 1.00 0.62 H ATOM 1237 HA ALA A 83 -16.823 -2.740 3.424 1.00 0.97 H ATOM 1238 HB1 ALA A 83 -16.972 -2.092 5.754 1.00 1.39 H ATOM 1239 HB2 ALA A 83 -15.636 -0.954 5.555 1.00 1.30 H ATOM 1240 HB3 ALA A 83 -15.347 -2.690 5.391 1.00 1.25 H ATOM 1241 N GLU A 84 -16.878 0.501 3.144 1.00 0.95 N ATOM 1242 CA GLU A 84 -17.749 1.618 2.823 1.00 1.11 C ATOM 1243 C GLU A 84 -18.290 1.525 1.397 1.00 1.18 C ATOM 1244 O GLU A 84 -19.234 2.237 1.034 1.00 1.36 O ATOM 1245 CB GLU A 84 -17.061 2.974 3.068 1.00 1.15 C ATOM 1246 CG GLU A 84 -16.841 3.283 4.547 1.00 1.57 C ATOM 1247 CD GLU A 84 -16.172 4.619 4.799 1.00 1.76 C ATOM 1248 OE1 GLU A 84 -16.391 5.566 4.005 1.00 1.86 O ATOM 1249 OE2 GLU A 84 -15.381 4.746 5.765 1.00 2.49 O ATOM 1250 H GLU A 84 -15.902 0.621 3.163 1.00 0.84 H ATOM 1251 HA GLU A 84 -18.591 1.544 3.500 1.00 1.28 H ATOM 1252 HB2 GLU A 84 -16.095 2.982 2.583 1.00 1.60 H ATOM 1253 HB3 GLU A 84 -17.669 3.763 2.648 1.00 1.38 H ATOM 1254 HG2 GLU A 84 -17.802 3.292 5.039 1.00 2.14 H ATOM 1255 HG3 GLU A 84 -16.227 2.497 4.965 1.00 2.20 H ATOM 1256 N ALA A 85 -17.690 0.672 0.596 1.00 1.15 N ATOM 1257 CA ALA A 85 -18.148 0.453 -0.763 1.00 1.34 C ATOM 1258 C ALA A 85 -19.161 -0.696 -0.788 1.00 1.47 C ATOM 1259 O ALA A 85 -20.292 -0.523 -1.285 1.00 1.86 O ATOM 1260 CB ALA A 85 -16.971 0.164 -1.693 1.00 1.37 C ATOM 1261 H ALA A 85 -16.917 0.168 0.925 1.00 1.07 H ATOM 1262 HA ALA A 85 -18.638 1.359 -1.088 1.00 1.54 H ATOM 1263 HB1 ALA A 85 -16.453 -0.730 -1.375 1.00 1.61 H ATOM 1264 HB2 ALA A 85 -16.295 1.005 -1.679 1.00 1.71 H ATOM 1265 HB3 ALA A 85 -17.337 0.027 -2.700 1.00 1.82 H ATOM 1266 N ALA A 86 -18.755 -1.831 -0.182 1.00 1.53 N ATOM 1267 CA ALA A 86 -19.540 -3.080 -0.062 1.00 1.70 C ATOM 1268 C ALA A 86 -19.534 -3.920 -1.338 1.00 2.36 C ATOM 1269 O ALA A 86 -20.197 -3.551 -2.326 1.00 2.86 O ATOM 1270 CB ALA A 86 -20.956 -2.878 0.486 1.00 2.39 C ATOM 1271 OXT ALA A 86 -18.900 -4.991 -1.328 1.00 3.03 O ATOM 1272 H ALA A 86 -17.851 -1.850 0.200 1.00 1.73 H ATOM 1273 HA ALA A 86 -18.986 -3.670 0.658 1.00 1.65 H ATOM 1274 HB1 ALA A 86 -21.565 -2.362 -0.240 1.00 2.96 H ATOM 1275 HB2 ALA A 86 -20.907 -2.283 1.385 1.00 2.75 H ATOM 1276 HB3 ALA A 86 -21.388 -3.844 0.711 1.00 2.71 H TER 1277 ALA A 86 HETATM 1278 P24 SXR A 101 6.233 12.704 -3.785 1.00 1.19 P HETATM 1279 O26 SXR A 101 7.480 13.106 -4.613 1.00 1.72 O HETATM 1280 O23 SXR A 101 5.901 13.519 -2.549 1.00 1.83 O HETATM 1281 O27 SXR A 101 4.998 12.704 -4.740 1.00 1.31 O HETATM 1282 C28 SXR A 101 4.951 11.796 -5.921 1.00 1.24 C HETATM 1283 C29 SXR A 101 4.019 12.411 -6.969 1.00 1.82 C HETATM 1284 C30 SXR A 101 3.918 11.424 -8.107 1.00 2.42 C HETATM 1285 C31 SXR A 101 2.630 12.636 -6.348 1.00 1.85 C HETATM 1286 C32 SXR A 101 4.657 13.799 -7.511 1.00 2.74 C HETATM 1287 O33 SXR A 101 4.974 14.681 -6.420 1.00 3.00 O HETATM 1288 C34 SXR A 101 3.704 14.520 -8.479 1.00 3.44 C HETATM 1289 O35 SXR A 101 2.676 15.077 -8.073 1.00 3.88 O HETATM 1290 N36 SXR A 101 4.061 14.555 -9.740 1.00 3.90 N HETATM 1291 C37 SXR A 101 3.268 15.211 -10.785 1.00 4.60 C HETATM 1292 C38 SXR A 101 2.683 14.230 -11.801 1.00 4.73 C HETATM 1293 C39 SXR A 101 1.609 13.257 -11.232 1.00 4.02 C HETATM 1294 O40 SXR A 101 1.194 12.315 -11.915 1.00 4.42 O HETATM 1295 N41 SXR A 101 1.194 13.485 -9.972 1.00 3.33 N HETATM 1296 C42 SXR A 101 0.213 12.666 -9.250 1.00 2.88 C HETATM 1297 C43 SXR A 101 -1.006 13.475 -8.800 1.00 2.85 C HETATM 1298 S1 SXR A 101 -2.272 12.392 -8.281 1.00 3.15 S HETATM 1299 C11 SXR A 101 -0.677 8.778 -1.450 1.00 2.09 C HETATM 1300 C10 SXR A 101 -0.010 7.831 -0.676 1.00 2.05 C HETATM 1301 C9 SXR A 101 1.205 8.150 -0.084 1.00 1.91 C HETATM 1302 C8 SXR A 101 1.745 9.413 -0.267 1.00 2.19 C HETATM 1303 C7 SXR A 101 1.072 10.359 -1.048 1.00 2.18 C HETATM 1304 C6 SXR A 101 -0.142 10.053 -1.643 1.00 1.95 C HETATM 1305 C5 SXR A 101 -0.847 11.068 -2.469 1.00 2.57 C HETATM 1306 C4 SXR A 101 -1.045 10.626 -3.894 1.00 2.29 C HETATM 1307 C3 SXR A 101 -2.394 10.995 -4.452 1.00 2.88 C HETATM 1308 O3 SXR A 101 -3.336 11.184 -3.702 1.00 3.69 O HETATM 1309 C2 SXR A 101 -2.592 11.101 -5.936 1.00 2.88 C HETATM 1310 C1 SXR A 101 -2.002 12.353 -6.569 1.00 2.84 C HETATM 1311 H28A SXR A 101 5.944 11.691 -6.331 1.00 1.41 H HETATM 1312 H28B SXR A 101 4.561 10.814 -5.655 1.00 0.99 H HETATM 1313 H30A SXR A 101 2.881 11.168 -8.265 1.00 2.99 H HETATM 1314 H30B SXR A 101 4.478 10.534 -7.863 1.00 2.62 H HETATM 1315 H30C SXR A 101 4.316 11.876 -9.004 1.00 2.79 H HETATM 1316 H31A SXR A 101 1.894 12.719 -7.139 1.00 2.21 H HETATM 1317 H31B SXR A 101 2.654 13.520 -5.724 1.00 2.37 H HETATM 1318 H31C SXR A 101 2.396 11.772 -5.741 1.00 1.95 H HETATM 1319 H32A SXR A 101 5.571 13.567 -8.037 1.00 3.10 H HETATM 1320 H33A SXR A 101 4.840 14.145 -5.625 1.00 3.40 H HETATM 1321 H36A SXR A 101 4.909 14.127 -9.993 1.00 3.96 H HETATM 1322 H37A SXR A 101 2.461 15.764 -10.335 1.00 4.70 H HETATM 1323 H37B SXR A 101 3.914 15.899 -11.312 1.00 5.21 H HETATM 1324 H38A SXR A 101 2.213 14.801 -12.591 1.00 5.22 H HETATM 1325 H38B SXR A 101 3.490 13.642 -12.212 1.00 5.25 H HETATM 1326 H41A SXR A 101 1.576 14.247 -9.483 1.00 3.43 H HETATM 1327 H42A SXR A 101 -0.096 11.873 -9.908 1.00 3.18 H HETATM 1328 H42B SXR A 101 0.717 12.235 -8.393 1.00 2.75 H HETATM 1329 H43A SXR A 101 -1.389 14.008 -9.662 1.00 3.20 H HETATM 1330 H43B SXR A 101 -0.777 14.162 -7.994 1.00 2.98 H HETATM 1331 H11A SXR A 101 -1.625 8.522 -1.906 1.00 2.81 H HETATM 1332 H10A SXR A 101 -0.436 6.847 -0.536 1.00 2.73 H HETATM 1333 H9A SXR A 101 1.732 7.420 0.520 1.00 2.32 H HETATM 1334 H8A SXR A 101 2.696 9.673 0.177 1.00 2.94 H HETATM 1335 H7A SXR A 101 1.497 11.339 -1.191 1.00 2.89 H HETATM 1336 H5A SXR A 101 -1.469 11.878 -2.125 1.00 3.45 H HETATM 1337 H5B SXR A 101 0.032 11.696 -2.379 1.00 2.83 H HETATM 1338 H4A SXR A 101 -0.271 10.455 -4.621 1.00 2.15 H HETATM 1339 H4B SXR A 101 -0.966 9.589 -3.573 1.00 2.47 H HETATM 1340 H2A SXR A 101 -2.753 10.273 -6.602 1.00 3.20 H HETATM 1341 H2B SXR A 101 -3.673 11.151 -5.823 1.00 3.39 H HETATM 1342 H1A SXR A 101 -1.727 13.280 -6.099 1.00 3.11 H HETATM 1343 H1B SXR A 101 -1.002 11.963 -6.372 1.00 2.74 H