ATOM 1 N MET A 1 -18.425 -8.933 -4.148 1.00 3.07 N ATOM 2 CA MET A 1 -18.321 -7.479 -4.052 1.00 2.76 C ATOM 3 C MET A 1 -16.992 -7.079 -3.421 1.00 2.34 C ATOM 4 O MET A 1 -15.988 -6.862 -4.124 1.00 2.38 O ATOM 5 CB MET A 1 -19.501 -6.875 -3.261 1.00 2.93 C ATOM 6 CG MET A 1 -20.867 -7.089 -3.883 1.00 3.33 C ATOM 7 SD MET A 1 -22.196 -6.285 -2.961 1.00 4.18 S ATOM 8 CE MET A 1 -22.006 -7.063 -1.365 1.00 4.50 C ATOM 9 H1 MET A 1 -19.333 -9.222 -4.567 1.00 3.22 H ATOM 10 H2 MET A 1 -18.260 -9.404 -3.236 1.00 3.51 H ATOM 11 H3 MET A 1 -17.663 -9.249 -4.786 1.00 3.36 H ATOM 12 HA MET A 1 -18.332 -7.092 -5.060 1.00 3.37 H ATOM 13 HB2 MET A 1 -19.513 -7.323 -2.279 1.00 3.26 H ATOM 14 HB3 MET A 1 -19.341 -5.813 -3.157 1.00 3.26 H ATOM 15 HG2 MET A 1 -20.865 -6.714 -4.895 1.00 3.63 H ATOM 16 HG3 MET A 1 -21.060 -8.152 -3.893 1.00 3.51 H ATOM 17 HE1 MET A 1 -22.136 -8.130 -1.465 1.00 4.67 H ATOM 18 HE2 MET A 1 -22.747 -6.670 -0.686 1.00 4.75 H ATOM 19 HE3 MET A 1 -21.021 -6.854 -0.975 1.00 4.79 H ATOM 20 N ALA A 2 -16.952 -7.075 -2.092 1.00 2.23 N ATOM 21 CA ALA A 2 -15.770 -6.669 -1.382 1.00 1.97 C ATOM 22 C ALA A 2 -14.925 -7.872 -1.023 1.00 1.62 C ATOM 23 O ALA A 2 -15.331 -8.724 -0.227 1.00 1.83 O ATOM 24 CB ALA A 2 -16.140 -5.876 -0.132 1.00 2.32 C ATOM 25 H ALA A 2 -17.746 -7.343 -1.585 1.00 2.55 H ATOM 26 HA ALA A 2 -15.204 -6.020 -2.036 1.00 2.02 H ATOM 27 HB1 ALA A 2 -15.241 -5.535 0.360 1.00 2.39 H ATOM 28 HB2 ALA A 2 -16.698 -6.500 0.551 1.00 2.57 H ATOM 29 HB3 ALA A 2 -16.738 -5.024 -0.418 1.00 2.91 H ATOM 30 N THR A 3 -13.794 -7.980 -1.650 1.00 1.33 N ATOM 31 CA THR A 3 -12.850 -9.017 -1.346 1.00 1.10 C ATOM 32 C THR A 3 -11.612 -8.340 -0.749 1.00 0.90 C ATOM 33 O THR A 3 -10.858 -7.680 -1.460 1.00 0.87 O ATOM 34 CB THR A 3 -12.480 -9.794 -2.632 1.00 1.27 C ATOM 35 OG1 THR A 3 -13.691 -10.264 -3.259 1.00 1.70 O ATOM 36 CG2 THR A 3 -11.579 -10.996 -2.314 1.00 1.78 C ATOM 37 H THR A 3 -13.569 -7.330 -2.348 1.00 1.46 H ATOM 38 HA THR A 3 -13.281 -9.688 -0.619 1.00 1.16 H ATOM 39 HB THR A 3 -11.965 -9.120 -3.296 1.00 1.61 H ATOM 40 HG1 THR A 3 -14.458 -9.954 -2.759 1.00 2.16 H ATOM 41 HG21 THR A 3 -10.662 -10.659 -1.857 1.00 2.24 H ATOM 42 HG22 THR A 3 -11.356 -11.514 -3.232 1.00 2.32 H ATOM 43 HG23 THR A 3 -12.092 -11.671 -1.647 1.00 2.10 H ATOM 44 N LEU A 4 -11.507 -8.383 0.572 1.00 0.86 N ATOM 45 CA LEU A 4 -10.404 -7.756 1.289 1.00 0.72 C ATOM 46 C LEU A 4 -9.082 -8.434 0.982 1.00 0.67 C ATOM 47 O LEU A 4 -9.030 -9.636 0.766 1.00 0.83 O ATOM 48 CB LEU A 4 -10.638 -7.711 2.825 1.00 0.71 C ATOM 49 CG LEU A 4 -11.696 -6.711 3.373 1.00 0.87 C ATOM 50 CD1 LEU A 4 -13.114 -7.040 2.922 1.00 0.80 C ATOM 51 CD2 LEU A 4 -11.630 -6.654 4.890 1.00 1.75 C ATOM 52 H LEU A 4 -12.175 -8.879 1.086 1.00 1.00 H ATOM 53 HA LEU A 4 -10.330 -6.739 0.931 1.00 0.73 H ATOM 54 HB2 LEU A 4 -10.927 -8.703 3.132 1.00 0.79 H ATOM 55 HB3 LEU A 4 -9.691 -7.483 3.294 1.00 0.64 H ATOM 56 HG LEU A 4 -11.470 -5.720 3.003 1.00 1.34 H ATOM 57 HD11 LEU A 4 -13.776 -6.289 3.330 1.00 1.23 H ATOM 58 HD12 LEU A 4 -13.383 -8.019 3.290 1.00 1.38 H ATOM 59 HD13 LEU A 4 -13.147 -7.027 1.842 1.00 1.46 H ATOM 60 HD21 LEU A 4 -10.645 -6.327 5.190 1.00 2.19 H ATOM 61 HD22 LEU A 4 -11.818 -7.641 5.288 1.00 2.26 H ATOM 62 HD23 LEU A 4 -12.371 -5.964 5.269 1.00 2.25 H ATOM 63 N LEU A 5 -8.039 -7.643 0.954 1.00 0.55 N ATOM 64 CA LEU A 5 -6.704 -8.119 0.684 1.00 0.51 C ATOM 65 C LEU A 5 -5.990 -8.368 1.998 1.00 0.46 C ATOM 66 O LEU A 5 -6.304 -7.724 3.016 1.00 0.50 O ATOM 67 CB LEU A 5 -5.884 -7.138 -0.210 1.00 0.53 C ATOM 68 CG LEU A 5 -5.782 -5.663 0.244 1.00 0.62 C ATOM 69 CD1 LEU A 5 -4.458 -5.073 -0.202 1.00 0.66 C ATOM 70 CD2 LEU A 5 -6.907 -4.835 -0.379 1.00 0.95 C ATOM 71 H LEU A 5 -8.173 -6.705 1.182 1.00 0.61 H ATOM 72 HA LEU A 5 -6.796 -9.071 0.177 1.00 0.58 H ATOM 73 HB2 LEU A 5 -4.877 -7.517 -0.296 1.00 0.53 H ATOM 74 HB3 LEU A 5 -6.317 -7.147 -1.199 1.00 0.60 H ATOM 75 HG LEU A 5 -5.858 -5.600 1.317 1.00 0.90 H ATOM 76 HD11 LEU A 5 -3.642 -5.619 0.247 1.00 1.08 H ATOM 77 HD12 LEU A 5 -4.416 -4.043 0.120 1.00 1.41 H ATOM 78 HD13 LEU A 5 -4.380 -5.102 -1.280 1.00 1.22 H ATOM 79 HD21 LEU A 5 -6.812 -3.803 -0.072 1.00 1.46 H ATOM 80 HD22 LEU A 5 -7.875 -5.217 -0.091 1.00 1.57 H ATOM 81 HD23 LEU A 5 -6.813 -4.887 -1.453 1.00 1.37 H ATOM 82 N THR A 6 -5.045 -9.275 1.987 1.00 0.47 N ATOM 83 CA THR A 6 -4.336 -9.619 3.183 1.00 0.49 C ATOM 84 C THR A 6 -3.077 -8.774 3.320 1.00 0.40 C ATOM 85 O THR A 6 -2.818 -7.866 2.506 1.00 0.38 O ATOM 86 CB THR A 6 -3.965 -11.121 3.235 1.00 0.70 C ATOM 87 OG1 THR A 6 -3.105 -11.456 2.133 1.00 0.82 O ATOM 88 CG2 THR A 6 -5.205 -12.009 3.212 1.00 0.93 C ATOM 89 H THR A 6 -4.798 -9.721 1.138 1.00 0.54 H ATOM 90 HA THR A 6 -4.983 -9.402 4.020 1.00 0.55 H ATOM 91 HB THR A 6 -3.426 -11.285 4.156 1.00 0.73 H ATOM 92 HG1 THR A 6 -3.546 -11.235 1.290 1.00 1.33 H ATOM 93 HG21 THR A 6 -4.903 -13.047 3.239 1.00 1.33 H ATOM 94 HG22 THR A 6 -5.768 -11.825 2.308 1.00 1.32 H ATOM 95 HG23 THR A 6 -5.824 -11.780 4.070 1.00 1.55 H ATOM 96 N THR A 7 -2.263 -9.101 4.301 1.00 0.44 N ATOM 97 CA THR A 7 -1.038 -8.409 4.525 1.00 0.42 C ATOM 98 C THR A 7 -0.016 -8.813 3.448 1.00 0.37 C ATOM 99 O THR A 7 0.856 -8.031 3.064 1.00 0.39 O ATOM 100 CB THR A 7 -0.497 -8.726 5.934 1.00 0.50 C ATOM 101 OG1 THR A 7 -1.532 -8.482 6.911 1.00 0.58 O ATOM 102 CG2 THR A 7 0.697 -7.850 6.264 1.00 0.54 C ATOM 103 H THR A 7 -2.490 -9.836 4.909 1.00 0.52 H ATOM 104 HA THR A 7 -1.227 -7.350 4.453 1.00 0.44 H ATOM 105 HB THR A 7 -0.203 -9.766 5.968 1.00 0.53 H ATOM 106 HG1 THR A 7 -2.384 -8.338 6.482 1.00 0.94 H ATOM 107 HG21 THR A 7 1.483 -8.035 5.549 1.00 1.06 H ATOM 108 HG22 THR A 7 1.057 -8.085 7.255 1.00 1.24 H ATOM 109 HG23 THR A 7 0.405 -6.812 6.208 1.00 1.08 H ATOM 110 N ASP A 8 -0.195 -10.007 2.906 1.00 0.41 N ATOM 111 CA ASP A 8 0.714 -10.526 1.903 1.00 0.46 C ATOM 112 C ASP A 8 0.436 -9.930 0.555 1.00 0.42 C ATOM 113 O ASP A 8 1.338 -9.805 -0.270 1.00 0.47 O ATOM 114 CB ASP A 8 0.713 -12.053 1.856 1.00 0.62 C ATOM 115 CG ASP A 8 1.287 -12.660 3.117 1.00 1.41 C ATOM 116 OD1 ASP A 8 2.493 -12.467 3.395 1.00 1.98 O ATOM 117 OD2 ASP A 8 0.543 -13.347 3.834 1.00 2.01 O ATOM 118 H ASP A 8 -0.962 -10.553 3.187 1.00 0.48 H ATOM 119 HA ASP A 8 1.699 -10.197 2.203 1.00 0.52 H ATOM 120 HB2 ASP A 8 -0.298 -12.410 1.748 1.00 0.86 H ATOM 121 HB3 ASP A 8 1.311 -12.385 1.022 1.00 1.09 H ATOM 122 N ASP A 9 -0.813 -9.540 0.332 1.00 0.41 N ATOM 123 CA ASP A 9 -1.189 -8.867 -0.910 1.00 0.46 C ATOM 124 C ASP A 9 -0.502 -7.528 -0.978 1.00 0.40 C ATOM 125 O ASP A 9 0.065 -7.151 -2.014 1.00 0.46 O ATOM 126 CB ASP A 9 -2.700 -8.657 -1.025 1.00 0.54 C ATOM 127 CG ASP A 9 -3.478 -9.936 -1.157 1.00 0.98 C ATOM 128 OD1 ASP A 9 -3.643 -10.427 -2.295 1.00 1.21 O ATOM 129 OD2 ASP A 9 -3.924 -10.460 -0.133 1.00 1.83 O ATOM 130 H ASP A 9 -1.497 -9.732 1.007 1.00 0.43 H ATOM 131 HA ASP A 9 -0.848 -9.476 -1.734 1.00 0.53 H ATOM 132 HB2 ASP A 9 -3.067 -8.139 -0.150 1.00 1.16 H ATOM 133 HB3 ASP A 9 -2.898 -8.062 -1.905 1.00 0.89 H ATOM 134 N LEU A 10 -0.525 -6.822 0.148 1.00 0.36 N ATOM 135 CA LEU A 10 0.130 -5.518 0.268 1.00 0.35 C ATOM 136 C LEU A 10 1.633 -5.702 0.113 1.00 0.33 C ATOM 137 O LEU A 10 2.304 -4.920 -0.557 1.00 0.36 O ATOM 138 CB LEU A 10 -0.204 -4.870 1.622 1.00 0.37 C ATOM 139 CG LEU A 10 0.383 -3.469 1.881 1.00 0.41 C ATOM 140 CD1 LEU A 10 -0.137 -2.458 0.865 1.00 0.51 C ATOM 141 CD2 LEU A 10 0.048 -3.018 3.285 1.00 0.48 C ATOM 142 H LEU A 10 -0.997 -7.213 0.917 1.00 0.35 H ATOM 143 HA LEU A 10 -0.218 -4.887 -0.536 1.00 0.39 H ATOM 144 HB2 LEU A 10 -1.279 -4.824 1.730 1.00 0.42 H ATOM 145 HB3 LEU A 10 0.179 -5.523 2.391 1.00 0.36 H ATOM 146 HG LEU A 10 1.459 -3.515 1.794 1.00 0.39 H ATOM 147 HD11 LEU A 10 -1.215 -2.401 0.932 1.00 1.18 H ATOM 148 HD12 LEU A 10 0.143 -2.777 -0.129 1.00 0.95 H ATOM 149 HD13 LEU A 10 0.301 -1.493 1.081 1.00 1.26 H ATOM 150 HD21 LEU A 10 -1.024 -2.998 3.405 1.00 1.12 H ATOM 151 HD22 LEU A 10 0.470 -2.037 3.443 1.00 1.06 H ATOM 152 HD23 LEU A 10 0.483 -3.700 4.003 1.00 1.05 H ATOM 153 N ARG A 11 2.142 -6.772 0.724 1.00 0.33 N ATOM 154 CA ARG A 11 3.538 -7.152 0.602 1.00 0.37 C ATOM 155 C ARG A 11 3.942 -7.335 -0.870 1.00 0.39 C ATOM 156 O ARG A 11 4.990 -6.846 -1.291 1.00 0.45 O ATOM 157 CB ARG A 11 3.841 -8.394 1.481 1.00 0.45 C ATOM 158 CG ARG A 11 5.186 -9.067 1.241 1.00 0.72 C ATOM 159 CD ARG A 11 5.782 -9.644 2.534 1.00 0.63 C ATOM 160 NE ARG A 11 4.874 -10.536 3.306 1.00 1.12 N ATOM 161 CZ ARG A 11 5.019 -10.821 4.632 1.00 1.36 C ATOM 162 NH1 ARG A 11 6.046 -10.309 5.331 1.00 1.47 N ATOM 163 NH2 ARG A 11 4.153 -11.634 5.219 1.00 2.27 N ATOM 164 H ARG A 11 1.554 -7.304 1.306 1.00 0.33 H ATOM 165 HA ARG A 11 4.097 -6.316 0.993 1.00 0.41 H ATOM 166 HB2 ARG A 11 3.815 -8.082 2.515 1.00 0.92 H ATOM 167 HB3 ARG A 11 3.058 -9.124 1.323 1.00 1.06 H ATOM 168 HG2 ARG A 11 5.046 -9.871 0.537 1.00 1.30 H ATOM 169 HG3 ARG A 11 5.873 -8.344 0.831 1.00 1.20 H ATOM 170 HD2 ARG A 11 6.666 -10.209 2.280 1.00 1.17 H ATOM 171 HD3 ARG A 11 6.073 -8.821 3.169 1.00 1.14 H ATOM 172 HE ARG A 11 4.124 -10.958 2.826 1.00 1.86 H ATOM 173 HH11 ARG A 11 6.728 -9.703 4.906 1.00 1.69 H ATOM 174 HH12 ARG A 11 6.217 -10.495 6.303 1.00 1.97 H ATOM 175 HH21 ARG A 11 3.409 -12.023 4.647 1.00 2.91 H ATOM 176 HH22 ARG A 11 4.150 -11.881 6.198 1.00 2.56 H ATOM 177 N ARG A 12 3.080 -7.981 -1.653 1.00 0.40 N ATOM 178 CA ARG A 12 3.341 -8.172 -3.077 1.00 0.48 C ATOM 179 C ARG A 12 3.354 -6.860 -3.836 1.00 0.47 C ATOM 180 O ARG A 12 4.326 -6.549 -4.504 1.00 0.50 O ATOM 181 CB ARG A 12 2.329 -9.085 -3.746 1.00 0.56 C ATOM 182 CG ARG A 12 2.403 -10.548 -3.366 1.00 0.94 C ATOM 183 CD ARG A 12 1.572 -11.392 -4.325 1.00 1.18 C ATOM 184 NE ARG A 12 2.071 -11.295 -5.730 1.00 1.76 N ATOM 185 CZ ARG A 12 2.226 -12.314 -6.570 1.00 2.29 C ATOM 186 NH1 ARG A 12 1.992 -13.563 -6.173 1.00 2.31 N ATOM 187 NH2 ARG A 12 2.647 -12.079 -7.801 1.00 3.30 N ATOM 188 H ARG A 12 2.254 -8.344 -1.262 1.00 0.37 H ATOM 189 HA ARG A 12 4.317 -8.626 -3.169 1.00 0.54 H ATOM 190 HB2 ARG A 12 1.340 -8.735 -3.494 1.00 0.67 H ATOM 191 HB3 ARG A 12 2.469 -8.984 -4.807 1.00 0.85 H ATOM 192 HG2 ARG A 12 3.431 -10.887 -3.405 1.00 1.27 H ATOM 193 HG3 ARG A 12 2.012 -10.685 -2.365 1.00 1.35 H ATOM 194 HD2 ARG A 12 1.605 -12.429 -4.022 1.00 1.87 H ATOM 195 HD3 ARG A 12 0.551 -11.036 -4.299 1.00 1.53 H ATOM 196 HE ARG A 12 2.307 -10.400 -6.089 1.00 2.26 H ATOM 197 HH11 ARG A 12 1.698 -13.782 -5.241 1.00 2.24 H ATOM 198 HH12 ARG A 12 2.103 -14.352 -6.784 1.00 2.84 H ATOM 199 HH21 ARG A 12 2.843 -11.130 -8.093 1.00 3.81 H ATOM 200 HH22 ARG A 12 2.781 -12.838 -8.445 1.00 3.77 H ATOM 201 N ALA A 13 2.277 -6.093 -3.705 1.00 0.47 N ATOM 202 CA ALA A 13 2.102 -4.844 -4.438 1.00 0.53 C ATOM 203 C ALA A 13 3.220 -3.852 -4.176 1.00 0.46 C ATOM 204 O ALA A 13 3.565 -3.045 -5.048 1.00 0.48 O ATOM 205 CB ALA A 13 0.752 -4.222 -4.130 1.00 0.63 C ATOM 206 H ALA A 13 1.569 -6.385 -3.091 1.00 0.47 H ATOM 207 HA ALA A 13 2.120 -5.093 -5.487 1.00 0.61 H ATOM 208 HB1 ALA A 13 0.723 -3.932 -3.091 1.00 1.11 H ATOM 209 HB2 ALA A 13 -0.031 -4.940 -4.326 1.00 1.26 H ATOM 210 HB3 ALA A 13 0.604 -3.353 -4.752 1.00 1.21 H ATOM 211 N LEU A 14 3.783 -3.907 -2.992 1.00 0.42 N ATOM 212 CA LEU A 14 4.855 -3.017 -2.652 1.00 0.39 C ATOM 213 C LEU A 14 6.151 -3.518 -3.322 1.00 0.40 C ATOM 214 O LEU A 14 6.820 -2.767 -4.042 1.00 0.46 O ATOM 215 CB LEU A 14 4.991 -2.909 -1.120 1.00 0.45 C ATOM 216 CG LEU A 14 5.707 -1.670 -0.589 1.00 0.54 C ATOM 217 CD1 LEU A 14 4.955 -0.417 -0.976 1.00 0.44 C ATOM 218 CD2 LEU A 14 5.843 -1.727 0.915 1.00 1.00 C ATOM 219 H LEU A 14 3.455 -4.556 -2.331 1.00 0.44 H ATOM 220 HA LEU A 14 4.623 -2.048 -3.069 1.00 0.41 H ATOM 221 HB2 LEU A 14 4.000 -2.933 -0.695 1.00 0.73 H ATOM 222 HB3 LEU A 14 5.520 -3.783 -0.767 1.00 0.77 H ATOM 223 HG LEU A 14 6.697 -1.629 -1.018 1.00 0.97 H ATOM 224 HD11 LEU A 14 3.957 -0.460 -0.566 1.00 1.04 H ATOM 225 HD12 LEU A 14 4.898 -0.340 -2.050 1.00 1.18 H ATOM 226 HD13 LEU A 14 5.461 0.449 -0.575 1.00 1.11 H ATOM 227 HD21 LEU A 14 6.413 -2.601 1.201 1.00 1.59 H ATOM 228 HD22 LEU A 14 4.853 -1.778 1.348 1.00 1.48 H ATOM 229 HD23 LEU A 14 6.345 -0.836 1.269 1.00 1.54 H ATOM 230 N VAL A 15 6.455 -4.815 -3.141 1.00 0.44 N ATOM 231 CA VAL A 15 7.655 -5.431 -3.731 1.00 0.53 C ATOM 232 C VAL A 15 7.641 -5.318 -5.257 1.00 0.55 C ATOM 233 O VAL A 15 8.627 -4.881 -5.863 1.00 0.64 O ATOM 234 CB VAL A 15 7.810 -6.925 -3.301 1.00 0.61 C ATOM 235 CG1 VAL A 15 8.947 -7.622 -4.060 1.00 0.74 C ATOM 236 CG2 VAL A 15 8.077 -7.015 -1.804 1.00 0.64 C ATOM 237 H VAL A 15 5.847 -5.379 -2.611 1.00 0.47 H ATOM 238 HA VAL A 15 8.505 -4.875 -3.373 1.00 0.60 H ATOM 239 HB VAL A 15 6.885 -7.438 -3.512 1.00 0.63 H ATOM 240 HG11 VAL A 15 9.885 -7.128 -3.856 1.00 1.14 H ATOM 241 HG12 VAL A 15 8.752 -7.611 -5.123 1.00 1.39 H ATOM 242 HG13 VAL A 15 9.001 -8.649 -3.725 1.00 1.29 H ATOM 243 HG21 VAL A 15 7.256 -6.563 -1.265 1.00 1.14 H ATOM 244 HG22 VAL A 15 8.994 -6.492 -1.581 1.00 1.34 H ATOM 245 HG23 VAL A 15 8.184 -8.052 -1.524 1.00 1.13 H ATOM 246 N GLU A 16 6.507 -5.675 -5.866 1.00 0.59 N ATOM 247 CA GLU A 16 6.345 -5.662 -7.322 1.00 0.69 C ATOM 248 C GLU A 16 6.431 -4.242 -7.922 1.00 0.65 C ATOM 249 O GLU A 16 6.518 -4.092 -9.132 1.00 0.77 O ATOM 250 CB GLU A 16 5.046 -6.394 -7.760 1.00 0.89 C ATOM 251 CG GLU A 16 5.057 -7.904 -7.457 1.00 1.11 C ATOM 252 CD GLU A 16 3.863 -8.675 -8.011 1.00 1.54 C ATOM 253 OE1 GLU A 16 3.789 -8.854 -9.249 1.00 1.95 O ATOM 254 OE2 GLU A 16 3.015 -9.178 -7.212 1.00 2.18 O ATOM 255 H GLU A 16 5.741 -5.968 -5.319 1.00 0.60 H ATOM 256 HA GLU A 16 7.191 -6.215 -7.707 1.00 0.80 H ATOM 257 HB2 GLU A 16 4.211 -5.953 -7.237 1.00 0.91 H ATOM 258 HB3 GLU A 16 4.887 -6.252 -8.817 1.00 0.98 H ATOM 259 HG2 GLU A 16 5.954 -8.328 -7.880 1.00 1.44 H ATOM 260 HG3 GLU A 16 5.083 -8.031 -6.385 1.00 1.45 H ATOM 261 N SER A 17 6.423 -3.220 -7.066 1.00 0.59 N ATOM 262 CA SER A 17 6.565 -1.845 -7.497 1.00 0.64 C ATOM 263 C SER A 17 8.065 -1.506 -7.660 1.00 0.74 C ATOM 264 O SER A 17 8.461 -0.819 -8.602 1.00 1.04 O ATOM 265 CB SER A 17 5.903 -0.918 -6.455 1.00 0.68 C ATOM 266 OG SER A 17 5.917 0.449 -6.852 1.00 1.27 O ATOM 267 H SER A 17 6.304 -3.403 -6.110 1.00 0.58 H ATOM 268 HA SER A 17 6.062 -1.726 -8.448 1.00 0.75 H ATOM 269 HB2 SER A 17 4.880 -1.230 -6.305 1.00 1.10 H ATOM 270 HB3 SER A 17 6.430 -1.018 -5.517 1.00 1.16 H ATOM 271 HG SER A 17 5.766 1.031 -6.095 1.00 1.65 H ATOM 272 N ALA A 18 8.898 -2.024 -6.755 1.00 0.70 N ATOM 273 CA ALA A 18 10.330 -1.772 -6.828 1.00 0.87 C ATOM 274 C ALA A 18 10.971 -2.764 -7.779 1.00 1.05 C ATOM 275 O ALA A 18 11.830 -2.412 -8.584 1.00 1.57 O ATOM 276 CB ALA A 18 10.969 -1.839 -5.434 1.00 0.95 C ATOM 277 H ALA A 18 8.529 -2.603 -6.057 1.00 0.73 H ATOM 278 HA ALA A 18 10.464 -0.775 -7.225 1.00 1.09 H ATOM 279 HB1 ALA A 18 12.025 -1.612 -5.484 1.00 1.36 H ATOM 280 HB2 ALA A 18 10.872 -2.830 -5.016 1.00 1.48 H ATOM 281 HB3 ALA A 18 10.495 -1.129 -4.772 1.00 1.41 H ATOM 282 N GLY A 19 10.519 -4.000 -7.695 1.00 0.98 N ATOM 283 CA GLY A 19 10.964 -5.042 -8.588 1.00 1.32 C ATOM 284 C GLY A 19 12.384 -5.478 -8.344 1.00 1.47 C ATOM 285 O GLY A 19 12.679 -6.225 -7.397 1.00 1.85 O ATOM 286 H GLY A 19 9.858 -4.218 -7.000 1.00 1.01 H ATOM 287 HA2 GLY A 19 10.316 -5.900 -8.480 1.00 1.77 H ATOM 288 HA3 GLY A 19 10.891 -4.686 -9.605 1.00 1.79 H ATOM 289 N GLU A 20 13.271 -5.002 -9.174 1.00 1.96 N ATOM 290 CA GLU A 20 14.644 -5.393 -9.130 1.00 2.68 C ATOM 291 C GLU A 20 15.491 -4.233 -8.661 1.00 2.91 C ATOM 292 O GLU A 20 15.755 -3.290 -9.402 1.00 3.66 O ATOM 293 CB GLU A 20 15.087 -5.930 -10.505 1.00 3.52 C ATOM 294 CG GLU A 20 16.502 -6.484 -10.552 1.00 4.20 C ATOM 295 CD GLU A 20 16.780 -7.218 -11.843 1.00 4.87 C ATOM 296 OE1 GLU A 20 16.442 -8.421 -11.959 1.00 5.27 O ATOM 297 OE2 GLU A 20 17.334 -6.604 -12.767 1.00 5.31 O ATOM 298 H GLU A 20 12.997 -4.321 -9.822 1.00 2.18 H ATOM 299 HA GLU A 20 14.739 -6.179 -8.400 1.00 2.87 H ATOM 300 HB2 GLU A 20 14.409 -6.714 -10.804 1.00 3.77 H ATOM 301 HB3 GLU A 20 15.020 -5.117 -11.213 1.00 3.84 H ATOM 302 HG2 GLU A 20 17.194 -5.659 -10.473 1.00 4.47 H ATOM 303 HG3 GLU A 20 16.644 -7.161 -9.720 1.00 4.44 H ATOM 304 N THR A 21 15.844 -4.288 -7.406 1.00 2.73 N ATOM 305 CA THR A 21 16.632 -3.291 -6.764 1.00 3.25 C ATOM 306 C THR A 21 17.202 -3.913 -5.481 1.00 3.14 C ATOM 307 O THR A 21 17.224 -5.148 -5.357 1.00 3.43 O ATOM 308 CB THR A 21 15.787 -1.990 -6.480 1.00 3.93 C ATOM 309 OG1 THR A 21 16.574 -0.960 -5.854 1.00 4.30 O ATOM 310 CG2 THR A 21 14.573 -2.291 -5.615 1.00 4.40 C ATOM 311 H THR A 21 15.583 -5.057 -6.860 1.00 2.62 H ATOM 312 HA THR A 21 17.456 -3.047 -7.417 1.00 3.74 H ATOM 313 HB THR A 21 15.442 -1.599 -7.427 1.00 4.40 H ATOM 314 HG1 THR A 21 17.012 -0.458 -6.566 1.00 4.42 H ATOM 315 HG21 THR A 21 13.937 -3.002 -6.120 1.00 4.75 H ATOM 316 HG22 THR A 21 14.022 -1.378 -5.448 1.00 4.61 H ATOM 317 HG23 THR A 21 14.904 -2.710 -4.675 1.00 4.66 H ATOM 318 N ASP A 22 17.605 -3.102 -4.546 1.00 3.24 N ATOM 319 CA ASP A 22 18.201 -3.577 -3.316 1.00 3.46 C ATOM 320 C ASP A 22 17.618 -2.821 -2.133 1.00 3.15 C ATOM 321 O ASP A 22 17.984 -1.675 -1.871 1.00 3.71 O ATOM 322 CB ASP A 22 19.729 -3.428 -3.382 1.00 4.08 C ATOM 323 CG ASP A 22 20.458 -3.944 -2.156 1.00 4.82 C ATOM 324 OD1 ASP A 22 20.330 -5.152 -1.833 1.00 5.14 O ATOM 325 OD2 ASP A 22 21.236 -3.164 -1.559 1.00 5.44 O ATOM 326 H ASP A 22 17.474 -2.135 -4.695 1.00 3.52 H ATOM 327 HA ASP A 22 17.953 -4.622 -3.212 1.00 3.87 H ATOM 328 HB2 ASP A 22 20.101 -3.966 -4.243 1.00 4.24 H ATOM 329 HB3 ASP A 22 19.950 -2.376 -3.493 1.00 4.35 H ATOM 330 N GLY A 23 16.650 -3.435 -1.479 1.00 2.69 N ATOM 331 CA GLY A 23 16.012 -2.805 -0.336 1.00 2.70 C ATOM 332 C GLY A 23 14.565 -3.224 -0.154 1.00 2.24 C ATOM 333 O GLY A 23 13.794 -2.538 0.503 1.00 2.70 O ATOM 334 H GLY A 23 16.385 -4.320 -1.795 1.00 2.74 H ATOM 335 HA2 GLY A 23 16.555 -3.039 0.567 1.00 3.05 H ATOM 336 HA3 GLY A 23 16.015 -1.739 -0.517 1.00 3.22 H ATOM 337 N THR A 24 14.196 -4.365 -0.700 1.00 1.89 N ATOM 338 CA THR A 24 12.816 -4.797 -0.668 1.00 1.88 C ATOM 339 C THR A 24 12.621 -6.070 0.144 1.00 1.65 C ATOM 340 O THR A 24 11.767 -6.913 -0.183 1.00 2.03 O ATOM 341 CB THR A 24 12.303 -5.016 -2.089 1.00 2.50 C ATOM 342 OG1 THR A 24 13.280 -5.780 -2.837 1.00 3.09 O ATOM 343 CG2 THR A 24 12.050 -3.691 -2.770 1.00 2.87 C ATOM 344 H THR A 24 14.838 -4.962 -1.133 1.00 2.13 H ATOM 345 HA THR A 24 12.232 -4.002 -0.229 1.00 2.24 H ATOM 346 HB THR A 24 11.375 -5.571 -2.028 1.00 3.01 H ATOM 347 HG1 THR A 24 13.062 -6.708 -2.707 1.00 3.52 H ATOM 348 HG21 THR A 24 11.300 -3.137 -2.223 1.00 3.16 H ATOM 349 HG22 THR A 24 11.701 -3.864 -3.779 1.00 3.32 H ATOM 350 HG23 THR A 24 12.965 -3.120 -2.808 1.00 3.05 H ATOM 351 N ASP A 25 13.339 -6.189 1.230 1.00 1.52 N ATOM 352 CA ASP A 25 13.233 -7.363 2.071 1.00 1.56 C ATOM 353 C ASP A 25 12.086 -7.253 3.052 1.00 1.29 C ATOM 354 O ASP A 25 12.265 -7.040 4.247 1.00 1.63 O ATOM 355 CB ASP A 25 14.565 -7.729 2.749 1.00 2.14 C ATOM 356 CG ASP A 25 15.588 -8.249 1.744 1.00 2.62 C ATOM 357 OD1 ASP A 25 16.270 -7.444 1.084 1.00 3.06 O ATOM 358 OD2 ASP A 25 15.690 -9.490 1.574 1.00 3.01 O ATOM 359 H ASP A 25 13.963 -5.473 1.470 1.00 1.75 H ATOM 360 HA ASP A 25 12.967 -8.173 1.407 1.00 1.73 H ATOM 361 HB2 ASP A 25 14.974 -6.852 3.234 1.00 2.49 H ATOM 362 HB3 ASP A 25 14.393 -8.497 3.490 1.00 2.44 H ATOM 363 N LEU A 26 10.892 -7.374 2.501 1.00 1.14 N ATOM 364 CA LEU A 26 9.637 -7.324 3.251 1.00 0.93 C ATOM 365 C LEU A 26 9.269 -8.693 3.776 1.00 0.97 C ATOM 366 O LEU A 26 8.172 -8.892 4.302 1.00 1.44 O ATOM 367 CB LEU A 26 8.479 -6.806 2.373 1.00 1.11 C ATOM 368 CG LEU A 26 8.273 -5.286 2.230 1.00 0.87 C ATOM 369 CD1 LEU A 26 9.504 -4.561 1.712 1.00 1.38 C ATOM 370 CD2 LEU A 26 7.088 -5.032 1.318 1.00 1.53 C ATOM 371 H LEU A 26 10.875 -7.493 1.525 1.00 1.49 H ATOM 372 HA LEU A 26 9.765 -6.650 4.085 1.00 0.96 H ATOM 373 HB2 LEU A 26 8.612 -7.204 1.379 1.00 1.64 H ATOM 374 HB3 LEU A 26 7.570 -7.229 2.773 1.00 1.87 H ATOM 375 HG LEU A 26 8.030 -4.866 3.195 1.00 1.73 H ATOM 376 HD11 LEU A 26 9.271 -3.507 1.656 1.00 1.91 H ATOM 377 HD12 LEU A 26 9.772 -4.919 0.729 1.00 1.94 H ATOM 378 HD13 LEU A 26 10.327 -4.711 2.396 1.00 1.97 H ATOM 379 HD21 LEU A 26 7.276 -5.457 0.341 1.00 2.11 H ATOM 380 HD22 LEU A 26 6.914 -3.970 1.227 1.00 1.91 H ATOM 381 HD23 LEU A 26 6.213 -5.502 1.743 1.00 2.02 H ATOM 382 N SER A 27 10.195 -9.615 3.672 1.00 1.01 N ATOM 383 CA SER A 27 10.011 -10.987 4.063 1.00 1.18 C ATOM 384 C SER A 27 9.704 -11.136 5.556 1.00 1.27 C ATOM 385 O SER A 27 9.060 -12.085 5.963 1.00 1.98 O ATOM 386 CB SER A 27 11.251 -11.757 3.638 1.00 1.52 C ATOM 387 OG SER A 27 12.409 -10.917 3.777 1.00 2.26 O ATOM 388 H SER A 27 11.082 -9.373 3.335 1.00 1.26 H ATOM 389 HA SER A 27 9.177 -11.374 3.497 1.00 1.31 H ATOM 390 HB2 SER A 27 11.353 -12.630 4.266 1.00 1.83 H ATOM 391 HB3 SER A 27 11.157 -12.063 2.606 1.00 1.77 H ATOM 392 HG SER A 27 13.055 -11.229 3.123 1.00 2.55 H ATOM 393 N GLY A 28 10.153 -10.181 6.350 1.00 1.18 N ATOM 394 CA GLY A 28 9.831 -10.192 7.751 1.00 1.46 C ATOM 395 C GLY A 28 8.628 -9.317 8.033 1.00 1.19 C ATOM 396 O GLY A 28 7.481 -9.724 7.798 1.00 1.73 O ATOM 397 H GLY A 28 10.695 -9.468 5.953 1.00 1.42 H ATOM 398 HA2 GLY A 28 9.595 -11.207 8.036 1.00 1.84 H ATOM 399 HA3 GLY A 28 10.673 -9.826 8.318 1.00 1.75 H ATOM 400 N ASP A 29 8.885 -8.110 8.474 1.00 0.90 N ATOM 401 CA ASP A 29 7.831 -7.149 8.748 1.00 0.83 C ATOM 402 C ASP A 29 8.072 -5.885 7.977 1.00 0.79 C ATOM 403 O ASP A 29 9.216 -5.550 7.660 1.00 1.33 O ATOM 404 CB ASP A 29 7.709 -6.822 10.254 1.00 1.20 C ATOM 405 CG ASP A 29 6.729 -5.667 10.518 1.00 1.95 C ATOM 406 OD1 ASP A 29 5.521 -5.812 10.257 1.00 2.44 O ATOM 407 OD2 ASP A 29 7.158 -4.638 11.079 1.00 2.68 O ATOM 408 H ASP A 29 9.810 -7.811 8.592 1.00 1.26 H ATOM 409 HA ASP A 29 6.901 -7.583 8.414 1.00 0.92 H ATOM 410 HB2 ASP A 29 7.350 -7.695 10.775 1.00 1.67 H ATOM 411 HB3 ASP A 29 8.686 -6.556 10.627 1.00 1.46 H ATOM 412 N PHE A 30 7.007 -5.210 7.668 1.00 0.42 N ATOM 413 CA PHE A 30 7.038 -3.959 7.002 1.00 0.36 C ATOM 414 C PHE A 30 5.859 -3.124 7.470 1.00 0.32 C ATOM 415 O PHE A 30 5.620 -2.054 6.966 1.00 0.35 O ATOM 416 CB PHE A 30 7.010 -4.120 5.460 1.00 0.37 C ATOM 417 CG PHE A 30 5.721 -4.704 4.897 1.00 0.35 C ATOM 418 CD1 PHE A 30 5.360 -6.029 5.112 1.00 0.40 C ATOM 419 CD2 PHE A 30 4.866 -3.906 4.151 1.00 0.38 C ATOM 420 CE1 PHE A 30 4.177 -6.533 4.602 1.00 0.46 C ATOM 421 CE2 PHE A 30 3.685 -4.410 3.638 1.00 0.42 C ATOM 422 CZ PHE A 30 3.345 -5.719 3.867 1.00 0.46 C ATOM 423 H PHE A 30 6.138 -5.569 7.941 1.00 0.67 H ATOM 424 HA PHE A 30 7.956 -3.473 7.285 1.00 0.43 H ATOM 425 HB2 PHE A 30 7.112 -3.117 5.069 1.00 0.40 H ATOM 426 HB3 PHE A 30 7.864 -4.682 5.111 1.00 0.41 H ATOM 427 HD1 PHE A 30 6.002 -6.675 5.691 1.00 0.43 H ATOM 428 HD2 PHE A 30 5.143 -2.876 3.969 1.00 0.43 H ATOM 429 HE1 PHE A 30 3.910 -7.568 4.774 1.00 0.55 H ATOM 430 HE2 PHE A 30 3.026 -3.777 3.062 1.00 0.47 H ATOM 431 HZ PHE A 30 2.421 -6.112 3.468 1.00 0.53 H ATOM 432 N LEU A 31 5.145 -3.603 8.470 1.00 0.35 N ATOM 433 CA LEU A 31 3.948 -2.937 8.898 1.00 0.36 C ATOM 434 C LEU A 31 4.238 -1.804 9.847 1.00 0.39 C ATOM 435 O LEU A 31 3.544 -0.802 9.823 1.00 0.46 O ATOM 436 CB LEU A 31 2.966 -3.914 9.533 1.00 0.40 C ATOM 437 CG LEU A 31 2.435 -5.027 8.616 1.00 0.39 C ATOM 438 CD1 LEU A 31 1.491 -5.924 9.387 1.00 0.45 C ATOM 439 CD2 LEU A 31 1.732 -4.426 7.400 1.00 0.38 C ATOM 440 H LEU A 31 5.421 -4.398 8.985 1.00 0.44 H ATOM 441 HA LEU A 31 3.482 -2.530 8.011 1.00 0.35 H ATOM 442 HB2 LEU A 31 3.458 -4.367 10.383 1.00 0.44 H ATOM 443 HB3 LEU A 31 2.120 -3.355 9.909 1.00 0.42 H ATOM 444 HG LEU A 31 3.258 -5.634 8.267 1.00 0.39 H ATOM 445 HD11 LEU A 31 0.663 -5.329 9.748 1.00 0.98 H ATOM 446 HD12 LEU A 31 2.017 -6.367 10.221 1.00 1.10 H ATOM 447 HD13 LEU A 31 1.122 -6.694 8.726 1.00 1.06 H ATOM 448 HD21 LEU A 31 1.361 -5.222 6.771 1.00 1.07 H ATOM 449 HD22 LEU A 31 2.441 -3.835 6.839 1.00 1.11 H ATOM 450 HD23 LEU A 31 0.908 -3.810 7.728 1.00 1.05 H ATOM 451 N ASP A 32 5.259 -1.953 10.673 1.00 0.43 N ATOM 452 CA ASP A 32 5.563 -0.927 11.686 1.00 0.52 C ATOM 453 C ASP A 32 6.744 -0.039 11.233 1.00 0.50 C ATOM 454 O ASP A 32 7.339 0.714 12.016 1.00 0.66 O ATOM 455 CB ASP A 32 5.832 -1.597 13.055 1.00 0.69 C ATOM 456 CG ASP A 32 5.932 -0.603 14.222 1.00 1.46 C ATOM 457 OD1 ASP A 32 4.952 0.129 14.488 1.00 1.95 O ATOM 458 OD2 ASP A 32 7.021 -0.488 14.843 1.00 2.20 O ATOM 459 H ASP A 32 5.811 -2.770 10.630 1.00 0.46 H ATOM 460 HA ASP A 32 4.686 -0.298 11.770 1.00 0.59 H ATOM 461 HB2 ASP A 32 5.023 -2.279 13.270 1.00 1.12 H ATOM 462 HB3 ASP A 32 6.756 -2.153 12.999 1.00 1.24 H ATOM 463 N LEU A 33 7.049 -0.106 9.964 1.00 0.42 N ATOM 464 CA LEU A 33 8.132 0.677 9.419 1.00 0.50 C ATOM 465 C LEU A 33 7.607 1.784 8.497 1.00 0.45 C ATOM 466 O LEU A 33 6.546 1.632 7.886 1.00 0.57 O ATOM 467 CB LEU A 33 9.223 -0.229 8.784 1.00 0.66 C ATOM 468 CG LEU A 33 8.835 -1.209 7.689 1.00 0.80 C ATOM 469 CD1 LEU A 33 8.413 -0.527 6.401 1.00 1.52 C ATOM 470 CD2 LEU A 33 9.981 -2.152 7.450 1.00 1.18 C ATOM 471 H LEU A 33 6.505 -0.667 9.374 1.00 0.43 H ATOM 472 HA LEU A 33 8.563 1.175 10.275 1.00 0.61 H ATOM 473 HB2 LEU A 33 10.051 0.342 8.400 1.00 1.44 H ATOM 474 HB3 LEU A 33 9.601 -0.850 9.585 1.00 1.18 H ATOM 475 HG LEU A 33 8.006 -1.795 8.053 1.00 0.96 H ATOM 476 HD11 LEU A 33 9.230 0.070 6.019 1.00 1.97 H ATOM 477 HD12 LEU A 33 7.558 0.103 6.592 1.00 2.01 H ATOM 478 HD13 LEU A 33 8.142 -1.287 5.683 1.00 1.95 H ATOM 479 HD21 LEU A 33 10.849 -1.591 7.134 1.00 1.52 H ATOM 480 HD22 LEU A 33 9.713 -2.865 6.686 1.00 1.91 H ATOM 481 HD23 LEU A 33 10.202 -2.675 8.369 1.00 1.52 H ATOM 482 N ARG A 34 8.331 2.882 8.410 1.00 0.43 N ATOM 483 CA ARG A 34 7.894 4.023 7.625 1.00 0.42 C ATOM 484 C ARG A 34 8.275 3.846 6.183 1.00 0.36 C ATOM 485 O ARG A 34 9.252 3.165 5.868 1.00 0.45 O ATOM 486 CB ARG A 34 8.536 5.319 8.118 1.00 0.58 C ATOM 487 CG ARG A 34 8.222 5.703 9.544 1.00 0.77 C ATOM 488 CD ARG A 34 8.945 6.991 9.903 1.00 1.08 C ATOM 489 NE ARG A 34 10.400 6.850 9.739 1.00 1.82 N ATOM 490 CZ ARG A 34 11.284 7.841 9.752 1.00 2.41 C ATOM 491 NH1 ARG A 34 10.889 9.111 9.815 1.00 2.43 N ATOM 492 NH2 ARG A 34 12.574 7.548 9.661 1.00 3.44 N ATOM 493 H ARG A 34 9.201 2.921 8.860 1.00 0.55 H ATOM 494 HA ARG A 34 6.823 4.120 7.698 1.00 0.45 H ATOM 495 HB2 ARG A 34 9.607 5.218 8.025 1.00 0.77 H ATOM 496 HB3 ARG A 34 8.216 6.120 7.470 1.00 0.78 H ATOM 497 HG2 ARG A 34 7.158 5.858 9.647 1.00 0.95 H ATOM 498 HG3 ARG A 34 8.546 4.919 10.215 1.00 1.06 H ATOM 499 HD2 ARG A 34 8.595 7.776 9.252 1.00 1.67 H ATOM 500 HD3 ARG A 34 8.730 7.250 10.930 1.00 1.45 H ATOM 501 HE ARG A 34 10.753 5.934 9.625 1.00 2.30 H ATOM 502 HH11 ARG A 34 9.923 9.387 9.837 1.00 2.29 H ATOM 503 HH12 ARG A 34 11.539 9.879 9.862 1.00 3.00 H ATOM 504 HH21 ARG A 34 12.837 6.575 9.570 1.00 3.92 H ATOM 505 HH22 ARG A 34 13.301 8.239 9.677 1.00 3.95 H ATOM 506 N PHE A 35 7.540 4.501 5.308 1.00 0.33 N ATOM 507 CA PHE A 35 7.857 4.484 3.889 1.00 0.33 C ATOM 508 C PHE A 35 9.173 5.218 3.631 1.00 0.38 C ATOM 509 O PHE A 35 9.995 4.778 2.813 1.00 0.43 O ATOM 510 CB PHE A 35 6.717 5.079 3.055 1.00 0.34 C ATOM 511 CG PHE A 35 5.443 4.277 3.124 1.00 0.36 C ATOM 512 CD1 PHE A 35 5.349 3.065 2.464 1.00 0.43 C ATOM 513 CD2 PHE A 35 4.350 4.719 3.861 1.00 0.40 C ATOM 514 CE1 PHE A 35 4.193 2.314 2.538 1.00 0.50 C ATOM 515 CE2 PHE A 35 3.202 3.972 3.940 1.00 0.48 C ATOM 516 CZ PHE A 35 3.121 2.774 3.283 1.00 0.51 C ATOM 517 H PHE A 35 6.742 4.975 5.624 1.00 0.40 H ATOM 518 HA PHE A 35 7.992 3.448 3.613 1.00 0.36 H ATOM 519 HB2 PHE A 35 6.522 6.077 3.416 1.00 0.35 H ATOM 520 HB3 PHE A 35 7.036 5.129 2.023 1.00 0.39 H ATOM 521 HD1 PHE A 35 6.187 2.713 1.884 1.00 0.47 H ATOM 522 HD2 PHE A 35 4.395 5.660 4.387 1.00 0.41 H ATOM 523 HE1 PHE A 35 4.116 1.368 2.023 1.00 0.57 H ATOM 524 HE2 PHE A 35 2.369 4.331 4.525 1.00 0.55 H ATOM 525 HZ PHE A 35 2.218 2.190 3.368 1.00 0.58 H ATOM 526 N GLU A 36 9.403 6.274 4.415 1.00 0.48 N ATOM 527 CA GLU A 36 10.637 7.086 4.349 1.00 0.62 C ATOM 528 C GLU A 36 11.863 6.216 4.689 1.00 0.63 C ATOM 529 O GLU A 36 12.975 6.452 4.216 1.00 0.72 O ATOM 530 CB GLU A 36 10.535 8.242 5.367 1.00 0.83 C ATOM 531 CG GLU A 36 9.310 9.132 5.181 1.00 1.40 C ATOM 532 CD GLU A 36 9.221 10.241 6.217 1.00 1.83 C ATOM 533 OE1 GLU A 36 8.647 10.016 7.313 1.00 2.73 O ATOM 534 OE2 GLU A 36 9.697 11.366 5.947 1.00 1.89 O ATOM 535 H GLU A 36 8.703 6.531 5.051 1.00 0.52 H ATOM 536 HA GLU A 36 10.733 7.502 3.355 1.00 0.69 H ATOM 537 HB2 GLU A 36 10.500 7.831 6.365 1.00 1.43 H ATOM 538 HB3 GLU A 36 11.418 8.857 5.282 1.00 1.37 H ATOM 539 HG2 GLU A 36 9.348 9.586 4.203 1.00 1.99 H ATOM 540 HG3 GLU A 36 8.427 8.515 5.261 1.00 2.11 H ATOM 541 N ASP A 37 11.612 5.176 5.475 1.00 0.61 N ATOM 542 CA ASP A 37 12.645 4.250 5.944 1.00 0.70 C ATOM 543 C ASP A 37 13.018 3.242 4.877 1.00 0.69 C ATOM 544 O ASP A 37 14.173 2.834 4.760 1.00 0.82 O ATOM 545 CB ASP A 37 12.141 3.480 7.168 1.00 0.77 C ATOM 546 CG ASP A 37 12.802 3.866 8.466 1.00 0.98 C ATOM 547 OD1 ASP A 37 12.477 4.943 9.019 1.00 1.27 O ATOM 548 OD2 ASP A 37 13.738 3.151 8.896 1.00 1.36 O ATOM 549 H ASP A 37 10.682 5.025 5.742 1.00 0.57 H ATOM 550 HA ASP A 37 13.513 4.822 6.240 1.00 0.80 H ATOM 551 HB2 ASP A 37 11.086 3.685 7.277 1.00 1.07 H ATOM 552 HB3 ASP A 37 12.283 2.423 7.000 1.00 0.95 H ATOM 553 N ILE A 38 12.044 2.849 4.099 1.00 0.59 N ATOM 554 CA ILE A 38 12.241 1.799 3.117 1.00 0.63 C ATOM 555 C ILE A 38 12.459 2.325 1.699 1.00 0.63 C ATOM 556 O ILE A 38 12.372 1.577 0.734 1.00 0.66 O ATOM 557 CB ILE A 38 11.098 0.745 3.151 1.00 0.59 C ATOM 558 CG1 ILE A 38 9.722 1.422 2.995 1.00 0.48 C ATOM 559 CG2 ILE A 38 11.162 -0.068 4.445 1.00 0.67 C ATOM 560 CD1 ILE A 38 8.556 0.457 2.886 1.00 0.54 C ATOM 561 H ILE A 38 11.165 3.272 4.178 1.00 0.56 H ATOM 562 HA ILE A 38 13.152 1.292 3.390 1.00 0.73 H ATOM 563 HB ILE A 38 11.246 0.060 2.331 1.00 0.66 H ATOM 564 HG12 ILE A 38 9.543 2.033 3.869 1.00 0.43 H ATOM 565 HG13 ILE A 38 9.738 2.059 2.124 1.00 0.48 H ATOM 566 HG21 ILE A 38 10.992 0.578 5.296 1.00 1.43 H ATOM 567 HG22 ILE A 38 12.126 -0.542 4.549 1.00 1.12 H ATOM 568 HG23 ILE A 38 10.395 -0.835 4.424 1.00 1.13 H ATOM 569 HD11 ILE A 38 8.697 -0.169 2.020 1.00 1.13 H ATOM 570 HD12 ILE A 38 7.633 1.008 2.782 1.00 1.03 H ATOM 571 HD13 ILE A 38 8.512 -0.161 3.772 1.00 1.00 H ATOM 572 N GLY A 39 12.798 3.595 1.590 1.00 0.63 N ATOM 573 CA GLY A 39 13.102 4.191 0.289 1.00 0.68 C ATOM 574 C GLY A 39 11.872 4.493 -0.564 1.00 0.59 C ATOM 575 O GLY A 39 11.985 4.777 -1.754 1.00 0.70 O ATOM 576 H GLY A 39 12.846 4.134 2.404 1.00 0.63 H ATOM 577 HA2 GLY A 39 13.637 5.118 0.438 1.00 0.71 H ATOM 578 HA3 GLY A 39 13.735 3.512 -0.260 1.00 0.81 H ATOM 579 N TYR A 40 10.714 4.446 0.028 1.00 0.45 N ATOM 580 CA TYR A 40 9.506 4.757 -0.688 1.00 0.45 C ATOM 581 C TYR A 40 9.131 6.193 -0.467 1.00 0.47 C ATOM 582 O TYR A 40 8.662 6.577 0.598 1.00 0.62 O ATOM 583 CB TYR A 40 8.348 3.819 -0.364 1.00 0.42 C ATOM 584 CG TYR A 40 8.460 2.448 -0.987 1.00 0.46 C ATOM 585 CD1 TYR A 40 9.393 1.531 -0.547 1.00 0.53 C ATOM 586 CD2 TYR A 40 7.621 2.081 -2.028 1.00 0.57 C ATOM 587 CE1 TYR A 40 9.496 0.286 -1.111 1.00 0.60 C ATOM 588 CE2 TYR A 40 7.708 0.837 -2.603 1.00 0.68 C ATOM 589 CZ TYR A 40 8.655 -0.065 -2.136 1.00 0.67 C ATOM 590 OH TYR A 40 8.759 -1.308 -2.684 1.00 0.78 O ATOM 591 H TYR A 40 10.662 4.241 0.985 1.00 0.42 H ATOM 592 HA TYR A 40 9.744 4.664 -1.738 1.00 0.56 H ATOM 593 HB2 TYR A 40 8.271 3.711 0.703 1.00 0.43 H ATOM 594 HB3 TYR A 40 7.435 4.268 -0.724 1.00 0.44 H ATOM 595 HD1 TYR A 40 10.051 1.803 0.262 1.00 0.63 H ATOM 596 HD2 TYR A 40 6.881 2.787 -2.379 1.00 0.66 H ATOM 597 HE1 TYR A 40 10.238 -0.406 -0.742 1.00 0.69 H ATOM 598 HE2 TYR A 40 7.032 0.591 -3.409 1.00 0.85 H ATOM 599 HH TYR A 40 8.544 -1.277 -3.620 1.00 1.25 H ATOM 600 N ASP A 41 9.405 6.968 -1.469 1.00 0.55 N ATOM 601 CA ASP A 41 9.118 8.374 -1.481 1.00 0.69 C ATOM 602 C ASP A 41 7.633 8.663 -1.589 1.00 0.85 C ATOM 603 O ASP A 41 6.915 8.785 -0.596 1.00 1.62 O ATOM 604 CB ASP A 41 9.884 9.090 -2.637 1.00 0.82 C ATOM 605 CG ASP A 41 10.011 8.296 -3.955 1.00 0.99 C ATOM 606 OD1 ASP A 41 9.012 7.682 -4.383 1.00 1.32 O ATOM 607 OD2 ASP A 41 11.101 8.265 -4.554 1.00 1.27 O ATOM 608 H ASP A 41 9.820 6.565 -2.260 1.00 0.64 H ATOM 609 HA ASP A 41 9.478 8.785 -0.548 1.00 0.70 H ATOM 610 HB2 ASP A 41 9.353 9.995 -2.892 1.00 1.07 H ATOM 611 HB3 ASP A 41 10.866 9.338 -2.299 1.00 1.03 H ATOM 612 N SER A 42 7.218 8.724 -2.783 1.00 0.50 N ATOM 613 CA SER A 42 5.878 9.073 -3.179 1.00 0.53 C ATOM 614 C SER A 42 5.609 8.465 -4.541 1.00 0.51 C ATOM 615 O SER A 42 4.576 7.838 -4.767 1.00 0.48 O ATOM 616 CB SER A 42 5.790 10.602 -3.167 1.00 0.69 C ATOM 617 OG SER A 42 4.767 11.168 -4.019 1.00 1.05 O ATOM 618 H SER A 42 7.934 8.511 -3.434 1.00 0.83 H ATOM 619 HA SER A 42 5.186 8.679 -2.451 1.00 0.54 H ATOM 620 HB2 SER A 42 5.592 10.933 -2.162 1.00 1.09 H ATOM 621 HB3 SER A 42 6.743 10.989 -3.483 1.00 1.08 H ATOM 622 N LEU A 43 6.593 8.575 -5.413 1.00 0.57 N ATOM 623 CA LEU A 43 6.519 8.049 -6.761 1.00 0.62 C ATOM 624 C LEU A 43 6.447 6.534 -6.705 1.00 0.56 C ATOM 625 O LEU A 43 5.552 5.923 -7.283 1.00 0.58 O ATOM 626 CB LEU A 43 7.756 8.485 -7.565 1.00 0.74 C ATOM 627 CG LEU A 43 7.788 8.127 -9.052 1.00 0.86 C ATOM 628 CD1 LEU A 43 6.729 8.906 -9.800 1.00 1.40 C ATOM 629 CD2 LEU A 43 9.176 8.372 -9.638 1.00 1.19 C ATOM 630 H LEU A 43 7.416 9.034 -5.145 1.00 0.63 H ATOM 631 HA LEU A 43 5.629 8.436 -7.236 1.00 0.68 H ATOM 632 HB2 LEU A 43 7.821 9.560 -7.493 1.00 0.80 H ATOM 633 HB3 LEU A 43 8.634 8.056 -7.106 1.00 0.74 H ATOM 634 HG LEU A 43 7.551 7.078 -9.160 1.00 1.21 H ATOM 635 HD11 LEU A 43 6.738 8.642 -10.847 1.00 2.04 H ATOM 636 HD12 LEU A 43 6.940 9.960 -9.695 1.00 1.94 H ATOM 637 HD13 LEU A 43 5.759 8.685 -9.379 1.00 1.66 H ATOM 638 HD21 LEU A 43 9.459 9.408 -9.523 1.00 1.69 H ATOM 639 HD22 LEU A 43 9.171 8.139 -10.694 1.00 1.62 H ATOM 640 HD23 LEU A 43 9.902 7.748 -9.135 1.00 1.71 H ATOM 641 N ALA A 44 7.361 5.951 -5.950 1.00 0.54 N ATOM 642 CA ALA A 44 7.447 4.503 -5.784 1.00 0.54 C ATOM 643 C ALA A 44 6.232 3.973 -5.036 1.00 0.47 C ATOM 644 O ALA A 44 5.840 2.816 -5.190 1.00 0.53 O ATOM 645 CB ALA A 44 8.719 4.149 -5.018 1.00 0.59 C ATOM 646 H ALA A 44 8.018 6.522 -5.488 1.00 0.57 H ATOM 647 HA ALA A 44 7.490 4.038 -6.758 1.00 0.62 H ATOM 648 HB1 ALA A 44 8.667 4.573 -4.022 1.00 1.28 H ATOM 649 HB2 ALA A 44 9.570 4.563 -5.542 1.00 1.12 H ATOM 650 HB3 ALA A 44 8.821 3.074 -4.946 1.00 1.13 H ATOM 651 N LEU A 45 5.644 4.842 -4.249 1.00 0.42 N ATOM 652 CA LEU A 45 4.536 4.512 -3.385 1.00 0.38 C ATOM 653 C LEU A 45 3.210 4.544 -4.176 1.00 0.37 C ATOM 654 O LEU A 45 2.361 3.667 -4.012 1.00 0.39 O ATOM 655 CB LEU A 45 4.569 5.483 -2.172 1.00 0.35 C ATOM 656 CG LEU A 45 3.648 5.213 -0.967 1.00 0.37 C ATOM 657 CD1 LEU A 45 4.104 6.034 0.220 1.00 0.38 C ATOM 658 CD2 LEU A 45 2.220 5.572 -1.282 1.00 0.53 C ATOM 659 H LEU A 45 5.971 5.766 -4.277 1.00 0.46 H ATOM 660 HA LEU A 45 4.686 3.504 -3.027 1.00 0.42 H ATOM 661 HB2 LEU A 45 5.576 5.510 -1.784 1.00 0.34 H ATOM 662 HB3 LEU A 45 4.337 6.466 -2.548 1.00 0.40 H ATOM 663 HG LEU A 45 3.690 4.170 -0.689 1.00 0.43 H ATOM 664 HD11 LEU A 45 5.111 5.741 0.476 1.00 1.04 H ATOM 665 HD12 LEU A 45 3.455 5.846 1.062 1.00 1.10 H ATOM 666 HD13 LEU A 45 4.096 7.083 -0.027 1.00 1.14 H ATOM 667 HD21 LEU A 45 1.608 5.386 -0.412 1.00 0.97 H ATOM 668 HD22 LEU A 45 1.891 4.971 -2.117 1.00 1.13 H ATOM 669 HD23 LEU A 45 2.195 6.621 -1.538 1.00 1.32 H ATOM 670 N MET A 46 3.038 5.543 -5.050 1.00 0.37 N ATOM 671 CA MET A 46 1.807 5.635 -5.834 1.00 0.40 C ATOM 672 C MET A 46 1.627 4.494 -6.802 1.00 0.35 C ATOM 673 O MET A 46 0.496 4.088 -7.059 1.00 0.36 O ATOM 674 CB MET A 46 1.621 6.970 -6.532 1.00 0.52 C ATOM 675 CG MET A 46 1.358 8.123 -5.585 1.00 0.70 C ATOM 676 SD MET A 46 0.799 9.603 -6.434 1.00 0.96 S ATOM 677 CE MET A 46 -0.723 9.020 -7.184 1.00 2.41 C ATOM 678 H MET A 46 3.727 6.243 -5.150 1.00 0.38 H ATOM 679 HA MET A 46 1.012 5.527 -5.111 1.00 0.47 H ATOM 680 HB2 MET A 46 2.516 7.186 -7.099 1.00 0.53 H ATOM 681 HB3 MET A 46 0.788 6.884 -7.213 1.00 0.59 H ATOM 682 HG2 MET A 46 0.596 7.810 -4.892 1.00 0.73 H ATOM 683 HG3 MET A 46 2.268 8.334 -5.047 1.00 0.73 H ATOM 684 HE1 MET A 46 -0.504 8.190 -7.842 1.00 2.94 H ATOM 685 HE2 MET A 46 -1.184 9.822 -7.744 1.00 2.88 H ATOM 686 HE3 MET A 46 -1.390 8.693 -6.400 1.00 2.92 H ATOM 687 N GLU A 47 2.734 3.969 -7.325 1.00 0.37 N ATOM 688 CA GLU A 47 2.685 2.807 -8.223 1.00 0.39 C ATOM 689 C GLU A 47 1.998 1.626 -7.514 1.00 0.37 C ATOM 690 O GLU A 47 1.182 0.914 -8.108 1.00 0.43 O ATOM 691 CB GLU A 47 4.094 2.404 -8.676 1.00 0.48 C ATOM 692 CG GLU A 47 4.833 3.484 -9.471 1.00 0.68 C ATOM 693 CD GLU A 47 4.164 3.788 -10.796 1.00 1.41 C ATOM 694 OE1 GLU A 47 3.230 4.617 -10.822 1.00 2.15 O ATOM 695 OE2 GLU A 47 4.544 3.189 -11.827 1.00 1.84 O ATOM 696 H GLU A 47 3.603 4.387 -7.136 1.00 0.40 H ATOM 697 HA GLU A 47 2.092 3.078 -9.089 1.00 0.42 H ATOM 698 HB2 GLU A 47 4.681 2.135 -7.809 1.00 0.57 H ATOM 699 HB3 GLU A 47 3.990 1.534 -9.309 1.00 0.68 H ATOM 700 HG2 GLU A 47 4.864 4.394 -8.889 1.00 1.01 H ATOM 701 HG3 GLU A 47 5.844 3.152 -9.660 1.00 1.05 H ATOM 702 N THR A 48 2.312 1.462 -6.236 1.00 0.36 N ATOM 703 CA THR A 48 1.725 0.439 -5.392 1.00 0.39 C ATOM 704 C THR A 48 0.231 0.731 -5.149 1.00 0.35 C ATOM 705 O THR A 48 -0.613 -0.149 -5.339 1.00 0.40 O ATOM 706 CB THR A 48 2.455 0.440 -4.040 1.00 0.43 C ATOM 707 OG1 THR A 48 3.847 0.239 -4.267 1.00 0.51 O ATOM 708 CG2 THR A 48 1.915 -0.652 -3.116 1.00 0.51 C ATOM 709 H THR A 48 2.995 2.046 -5.844 1.00 0.38 H ATOM 710 HA THR A 48 1.859 -0.524 -5.867 1.00 0.44 H ATOM 711 HB THR A 48 2.305 1.406 -3.579 1.00 0.39 H ATOM 712 HG1 THR A 48 3.955 -0.565 -4.785 1.00 0.77 H ATOM 713 HG21 THR A 48 2.437 -0.609 -2.175 1.00 1.01 H ATOM 714 HG22 THR A 48 2.078 -1.615 -3.574 1.00 1.20 H ATOM 715 HG23 THR A 48 0.859 -0.511 -2.947 1.00 1.19 H ATOM 716 N ALA A 49 -0.074 1.959 -4.726 1.00 0.31 N ATOM 717 CA ALA A 49 -1.446 2.368 -4.412 1.00 0.32 C ATOM 718 C ALA A 49 -2.377 2.136 -5.606 1.00 0.30 C ATOM 719 O ALA A 49 -3.352 1.373 -5.506 1.00 0.32 O ATOM 720 CB ALA A 49 -1.479 3.836 -3.975 1.00 0.38 C ATOM 721 H ALA A 49 0.659 2.608 -4.645 1.00 0.32 H ATOM 722 HA ALA A 49 -1.782 1.762 -3.583 1.00 0.36 H ATOM 723 HB1 ALA A 49 -0.839 3.978 -3.116 1.00 1.14 H ATOM 724 HB2 ALA A 49 -2.492 4.098 -3.710 1.00 1.07 H ATOM 725 HB3 ALA A 49 -1.146 4.460 -4.791 1.00 1.05 H ATOM 726 N ALA A 50 -2.008 2.712 -6.747 1.00 0.29 N ATOM 727 CA ALA A 50 -2.809 2.610 -7.965 1.00 0.31 C ATOM 728 C ALA A 50 -2.912 1.167 -8.453 1.00 0.31 C ATOM 729 O ALA A 50 -3.881 0.785 -9.106 1.00 0.35 O ATOM 730 CB ALA A 50 -2.233 3.492 -9.053 1.00 0.39 C ATOM 731 H ALA A 50 -1.170 3.230 -6.786 1.00 0.31 H ATOM 732 HA ALA A 50 -3.797 2.969 -7.723 1.00 0.32 H ATOM 733 HB1 ALA A 50 -2.156 4.505 -8.691 1.00 1.16 H ATOM 734 HB2 ALA A 50 -2.878 3.458 -9.917 1.00 1.05 H ATOM 735 HB3 ALA A 50 -1.251 3.127 -9.310 1.00 1.05 H ATOM 736 N ARG A 51 -1.905 0.372 -8.127 1.00 0.32 N ATOM 737 CA ARG A 51 -1.854 -1.034 -8.500 1.00 0.38 C ATOM 738 C ARG A 51 -2.985 -1.785 -7.806 1.00 0.37 C ATOM 739 O ARG A 51 -3.712 -2.585 -8.437 1.00 0.47 O ATOM 740 CB ARG A 51 -0.511 -1.643 -8.088 1.00 0.49 C ATOM 741 CG ARG A 51 -0.192 -3.004 -8.672 1.00 0.97 C ATOM 742 CD ARG A 51 0.139 -2.933 -10.164 1.00 0.98 C ATOM 743 NE ARG A 51 -1.009 -2.547 -11.010 1.00 1.92 N ATOM 744 CZ ARG A 51 -0.933 -1.748 -12.099 1.00 2.31 C ATOM 745 NH1 ARG A 51 0.191 -1.076 -12.374 1.00 2.05 N ATOM 746 NH2 ARG A 51 -2.002 -1.573 -12.874 1.00 3.40 N ATOM 747 H ARG A 51 -1.169 0.766 -7.612 1.00 0.33 H ATOM 748 HA ARG A 51 -1.969 -1.112 -9.568 1.00 0.43 H ATOM 749 HB2 ARG A 51 0.289 -0.977 -8.376 1.00 1.08 H ATOM 750 HB3 ARG A 51 -0.499 -1.743 -7.013 1.00 1.12 H ATOM 751 HG2 ARG A 51 0.659 -3.405 -8.143 1.00 1.56 H ATOM 752 HG3 ARG A 51 -1.046 -3.650 -8.526 1.00 1.50 H ATOM 753 HD2 ARG A 51 0.941 -2.228 -10.315 1.00 1.17 H ATOM 754 HD3 ARG A 51 0.482 -3.912 -10.454 1.00 1.40 H ATOM 755 HE ARG A 51 -1.857 -2.969 -10.746 1.00 2.58 H ATOM 756 HH11 ARG A 51 1.015 -1.111 -11.807 1.00 1.81 H ATOM 757 HH12 ARG A 51 0.261 -0.518 -13.212 1.00 2.55 H ATOM 758 HH21 ARG A 51 -2.887 -2.002 -12.697 1.00 4.01 H ATOM 759 HH22 ARG A 51 -1.951 -0.995 -13.697 1.00 3.78 H ATOM 760 N LEU A 52 -3.161 -1.492 -6.525 1.00 0.32 N ATOM 761 CA LEU A 52 -4.199 -2.117 -5.722 1.00 0.34 C ATOM 762 C LEU A 52 -5.576 -1.612 -6.114 1.00 0.33 C ATOM 763 O LEU A 52 -6.527 -2.415 -6.235 1.00 0.40 O ATOM 764 CB LEU A 52 -3.938 -1.889 -4.226 1.00 0.35 C ATOM 765 CG LEU A 52 -2.718 -2.614 -3.649 1.00 0.38 C ATOM 766 CD1 LEU A 52 -2.478 -2.206 -2.193 1.00 0.43 C ATOM 767 CD2 LEU A 52 -2.915 -4.122 -3.756 1.00 0.39 C ATOM 768 H LEU A 52 -2.575 -0.820 -6.108 1.00 0.30 H ATOM 769 HA LEU A 52 -4.175 -3.180 -5.916 1.00 0.39 H ATOM 770 HB2 LEU A 52 -3.797 -0.827 -4.084 1.00 0.35 H ATOM 771 HB3 LEU A 52 -4.818 -2.200 -3.681 1.00 0.38 H ATOM 772 HG LEU A 52 -1.845 -2.342 -4.225 1.00 0.41 H ATOM 773 HD11 LEU A 52 -2.291 -1.142 -2.138 1.00 1.04 H ATOM 774 HD12 LEU A 52 -1.614 -2.729 -1.807 1.00 1.06 H ATOM 775 HD13 LEU A 52 -3.341 -2.448 -1.592 1.00 1.06 H ATOM 776 HD21 LEU A 52 -2.040 -4.624 -3.369 1.00 1.11 H ATOM 777 HD22 LEU A 52 -3.055 -4.382 -4.794 1.00 0.96 H ATOM 778 HD23 LEU A 52 -3.786 -4.418 -3.190 1.00 1.10 H ATOM 779 N GLU A 53 -5.680 -0.305 -6.352 1.00 0.28 N ATOM 780 CA GLU A 53 -6.934 0.309 -6.771 1.00 0.29 C ATOM 781 C GLU A 53 -7.421 -0.345 -8.066 1.00 0.31 C ATOM 782 O GLU A 53 -8.608 -0.604 -8.221 1.00 0.35 O ATOM 783 CB GLU A 53 -6.771 1.818 -7.014 1.00 0.29 C ATOM 784 CG GLU A 53 -6.315 2.647 -5.827 1.00 0.35 C ATOM 785 CD GLU A 53 -6.226 4.110 -6.208 1.00 0.41 C ATOM 786 OE1 GLU A 53 -5.223 4.510 -6.840 1.00 0.53 O ATOM 787 OE2 GLU A 53 -7.189 4.870 -5.928 1.00 0.51 O ATOM 788 H GLU A 53 -4.892 0.273 -6.225 1.00 0.27 H ATOM 789 HA GLU A 53 -7.688 0.149 -6.007 1.00 0.33 H ATOM 790 HB2 GLU A 53 -6.049 1.969 -7.804 1.00 0.29 H ATOM 791 HB3 GLU A 53 -7.727 2.202 -7.339 1.00 0.32 H ATOM 792 HG2 GLU A 53 -7.039 2.540 -5.030 1.00 0.41 H ATOM 793 HG3 GLU A 53 -5.342 2.316 -5.489 1.00 0.33 H ATOM 794 N SER A 54 -6.485 -0.637 -8.972 1.00 0.35 N ATOM 795 CA SER A 54 -6.805 -1.269 -10.250 1.00 0.43 C ATOM 796 C SER A 54 -7.329 -2.704 -10.060 1.00 0.47 C ATOM 797 O SER A 54 -8.270 -3.112 -10.709 1.00 0.61 O ATOM 798 CB SER A 54 -5.563 -1.301 -11.158 1.00 0.49 C ATOM 799 OG SER A 54 -5.035 -0.006 -11.402 1.00 1.16 O ATOM 800 H SER A 54 -5.557 -0.395 -8.773 1.00 0.36 H ATOM 801 HA SER A 54 -7.568 -0.678 -10.735 1.00 0.45 H ATOM 802 HB2 SER A 54 -4.786 -1.872 -10.674 1.00 1.13 H ATOM 803 HB3 SER A 54 -5.821 -1.761 -12.101 1.00 1.14 H ATOM 804 HG SER A 54 -4.791 0.410 -10.562 1.00 1.39 H ATOM 805 N ARG A 55 -6.711 -3.451 -9.164 1.00 0.40 N ATOM 806 CA ARG A 55 -7.086 -4.845 -8.961 1.00 0.46 C ATOM 807 C ARG A 55 -8.374 -5.001 -8.160 1.00 0.47 C ATOM 808 O ARG A 55 -9.180 -5.867 -8.458 1.00 0.57 O ATOM 809 CB ARG A 55 -5.928 -5.680 -8.343 1.00 0.50 C ATOM 810 CG ARG A 55 -6.320 -7.129 -8.021 1.00 0.61 C ATOM 811 CD ARG A 55 -5.157 -7.955 -7.474 1.00 0.75 C ATOM 812 NE ARG A 55 -4.153 -8.272 -8.501 1.00 1.28 N ATOM 813 CZ ARG A 55 -3.074 -9.036 -8.300 1.00 1.65 C ATOM 814 NH1 ARG A 55 -2.839 -9.577 -7.092 1.00 1.46 N ATOM 815 NH2 ARG A 55 -2.266 -9.295 -9.315 1.00 2.65 N ATOM 816 H ARG A 55 -5.981 -3.067 -8.635 1.00 0.37 H ATOM 817 HA ARG A 55 -7.294 -5.241 -9.943 1.00 0.51 H ATOM 818 HB2 ARG A 55 -5.100 -5.704 -9.039 1.00 0.54 H ATOM 819 HB3 ARG A 55 -5.597 -5.208 -7.429 1.00 0.52 H ATOM 820 HG2 ARG A 55 -7.121 -7.141 -7.295 1.00 0.74 H ATOM 821 HG3 ARG A 55 -6.675 -7.595 -8.929 1.00 0.63 H ATOM 822 HD2 ARG A 55 -4.681 -7.386 -6.691 1.00 1.34 H ATOM 823 HD3 ARG A 55 -5.547 -8.874 -7.062 1.00 1.29 H ATOM 824 HE ARG A 55 -4.308 -7.904 -9.405 1.00 1.84 H ATOM 825 HH11 ARG A 55 -3.459 -9.416 -6.319 1.00 1.47 H ATOM 826 HH12 ARG A 55 -2.048 -10.164 -6.904 1.00 1.85 H ATOM 827 HH21 ARG A 55 -2.490 -8.910 -10.218 1.00 3.22 H ATOM 828 HH22 ARG A 55 -1.438 -9.856 -9.249 1.00 3.00 H ATOM 829 N TYR A 56 -8.566 -4.176 -7.157 1.00 0.42 N ATOM 830 CA TYR A 56 -9.734 -4.338 -6.310 1.00 0.47 C ATOM 831 C TYR A 56 -10.878 -3.390 -6.667 1.00 0.50 C ATOM 832 O TYR A 56 -11.998 -3.549 -6.191 1.00 0.67 O ATOM 833 CB TYR A 56 -9.344 -4.323 -4.816 1.00 0.52 C ATOM 834 CG TYR A 56 -8.465 -5.519 -4.460 1.00 0.53 C ATOM 835 CD1 TYR A 56 -9.011 -6.785 -4.259 1.00 0.62 C ATOM 836 CD2 TYR A 56 -7.097 -5.361 -4.258 1.00 0.59 C ATOM 837 CE1 TYR A 56 -8.217 -7.858 -3.865 1.00 0.70 C ATOM 838 CE2 TYR A 56 -6.298 -6.431 -3.879 1.00 0.65 C ATOM 839 CZ TYR A 56 -6.849 -7.737 -3.943 1.00 0.67 C ATOM 840 OH TYR A 56 -6.081 -8.718 -3.255 1.00 0.79 O ATOM 841 H TYR A 56 -7.916 -3.459 -6.974 1.00 0.39 H ATOM 842 HA TYR A 56 -10.089 -5.329 -6.546 1.00 0.51 H ATOM 843 HB2 TYR A 56 -8.790 -3.418 -4.616 1.00 0.53 H ATOM 844 HB3 TYR A 56 -10.228 -4.358 -4.196 1.00 0.56 H ATOM 845 HD1 TYR A 56 -10.073 -6.928 -4.407 1.00 0.70 H ATOM 846 HD2 TYR A 56 -6.650 -4.389 -4.410 1.00 0.66 H ATOM 847 HE1 TYR A 56 -8.662 -8.832 -3.720 1.00 0.83 H ATOM 848 HE2 TYR A 56 -5.236 -6.302 -3.734 1.00 0.75 H ATOM 849 HH TYR A 56 -6.158 -9.512 -3.797 1.00 0.95 H ATOM 850 N GLY A 57 -10.598 -2.434 -7.540 1.00 0.41 N ATOM 851 CA GLY A 57 -11.633 -1.538 -8.034 1.00 0.45 C ATOM 852 C GLY A 57 -11.979 -0.430 -7.053 1.00 0.46 C ATOM 853 O GLY A 57 -13.165 -0.156 -6.805 1.00 0.61 O ATOM 854 H GLY A 57 -9.677 -2.318 -7.853 1.00 0.38 H ATOM 855 HA2 GLY A 57 -11.293 -1.094 -8.956 1.00 0.47 H ATOM 856 HA3 GLY A 57 -12.521 -2.123 -8.225 1.00 0.50 H ATOM 857 N VAL A 58 -10.965 0.235 -6.513 1.00 0.38 N ATOM 858 CA VAL A 58 -11.220 1.275 -5.532 1.00 0.42 C ATOM 859 C VAL A 58 -10.718 2.630 -6.036 1.00 0.45 C ATOM 860 O VAL A 58 -10.220 2.718 -7.156 1.00 0.51 O ATOM 861 CB VAL A 58 -10.656 0.938 -4.090 1.00 0.42 C ATOM 862 CG1 VAL A 58 -10.918 -0.490 -3.732 1.00 0.59 C ATOM 863 CG2 VAL A 58 -9.184 1.270 -3.884 1.00 0.57 C ATOM 864 H VAL A 58 -10.048 0.061 -6.819 1.00 0.34 H ATOM 865 HA VAL A 58 -12.295 1.341 -5.465 1.00 0.50 H ATOM 866 HB VAL A 58 -11.245 1.536 -3.414 1.00 0.56 H ATOM 867 HG11 VAL A 58 -11.969 -0.716 -3.814 1.00 1.23 H ATOM 868 HG12 VAL A 58 -10.588 -0.681 -2.722 1.00 1.25 H ATOM 869 HG13 VAL A 58 -10.356 -1.096 -4.429 1.00 1.06 H ATOM 870 HG21 VAL A 58 -8.581 0.697 -4.571 1.00 1.05 H ATOM 871 HG22 VAL A 58 -8.947 1.023 -2.858 1.00 1.24 H ATOM 872 HG23 VAL A 58 -9.033 2.328 -4.028 1.00 1.24 H ATOM 873 N SER A 59 -10.868 3.669 -5.237 1.00 0.51 N ATOM 874 CA SER A 59 -10.363 4.982 -5.566 1.00 0.61 C ATOM 875 C SER A 59 -10.009 5.712 -4.264 1.00 0.56 C ATOM 876 O SER A 59 -10.888 5.951 -3.422 1.00 0.63 O ATOM 877 CB SER A 59 -11.413 5.787 -6.370 1.00 0.84 C ATOM 878 OG SER A 59 -11.762 5.121 -7.584 1.00 1.59 O ATOM 879 H SER A 59 -11.327 3.579 -4.379 1.00 0.54 H ATOM 880 HA SER A 59 -9.476 4.852 -6.165 1.00 0.62 H ATOM 881 HB2 SER A 59 -12.309 5.915 -5.778 1.00 1.32 H ATOM 882 HB3 SER A 59 -11.003 6.758 -6.613 1.00 1.36 H ATOM 883 HG SER A 59 -11.135 4.389 -7.677 1.00 2.14 H ATOM 884 N ILE A 60 -8.749 6.012 -4.077 1.00 0.50 N ATOM 885 CA ILE A 60 -8.291 6.729 -2.897 1.00 0.48 C ATOM 886 C ILE A 60 -8.116 8.222 -3.176 1.00 0.53 C ATOM 887 O ILE A 60 -7.328 8.624 -4.039 1.00 0.63 O ATOM 888 CB ILE A 60 -6.988 6.098 -2.279 1.00 0.48 C ATOM 889 CG1 ILE A 60 -7.335 4.766 -1.594 1.00 0.64 C ATOM 890 CG2 ILE A 60 -6.259 7.052 -1.318 1.00 0.53 C ATOM 891 CD1 ILE A 60 -6.163 4.066 -0.934 1.00 0.75 C ATOM 892 H ILE A 60 -8.087 5.729 -4.758 1.00 0.50 H ATOM 893 HA ILE A 60 -9.082 6.651 -2.166 1.00 0.59 H ATOM 894 HB ILE A 60 -6.316 5.888 -3.095 1.00 0.50 H ATOM 895 HG12 ILE A 60 -8.068 4.968 -0.827 1.00 1.29 H ATOM 896 HG13 ILE A 60 -7.763 4.101 -2.331 1.00 1.27 H ATOM 897 HG21 ILE A 60 -5.386 6.554 -0.915 1.00 1.01 H ATOM 898 HG22 ILE A 60 -6.921 7.340 -0.513 1.00 1.13 H ATOM 899 HG23 ILE A 60 -5.947 7.930 -1.869 1.00 1.23 H ATOM 900 HD11 ILE A 60 -5.420 3.816 -1.674 1.00 1.11 H ATOM 901 HD12 ILE A 60 -6.517 3.155 -0.477 1.00 1.35 H ATOM 902 HD13 ILE A 60 -5.729 4.711 -0.183 1.00 1.64 H ATOM 903 N PRO A 61 -8.869 9.063 -2.452 1.00 0.65 N ATOM 904 CA PRO A 61 -8.765 10.510 -2.561 1.00 0.77 C ATOM 905 C PRO A 61 -7.479 11.023 -1.899 1.00 0.65 C ATOM 906 O PRO A 61 -7.084 10.542 -0.820 1.00 0.57 O ATOM 907 CB PRO A 61 -10.004 11.030 -1.791 1.00 0.97 C ATOM 908 CG PRO A 61 -10.847 9.826 -1.527 1.00 1.08 C ATOM 909 CD PRO A 61 -9.901 8.670 -1.481 1.00 0.83 C ATOM 910 HA PRO A 61 -8.797 10.857 -3.583 1.00 0.88 H ATOM 911 HB2 PRO A 61 -9.681 11.491 -0.870 1.00 0.93 H ATOM 912 HB3 PRO A 61 -10.534 11.756 -2.390 1.00 1.15 H ATOM 913 HG2 PRO A 61 -11.342 9.947 -0.575 1.00 1.24 H ATOM 914 HG3 PRO A 61 -11.579 9.694 -2.311 1.00 1.25 H ATOM 915 HD2 PRO A 61 -9.479 8.552 -0.493 1.00 0.83 H ATOM 916 HD3 PRO A 61 -10.397 7.767 -1.795 1.00 0.88 H ATOM 917 N ASP A 62 -6.863 11.997 -2.538 1.00 0.74 N ATOM 918 CA ASP A 62 -5.603 12.642 -2.084 1.00 0.73 C ATOM 919 C ASP A 62 -5.597 13.010 -0.590 1.00 0.62 C ATOM 920 O ASP A 62 -4.645 12.680 0.124 1.00 0.64 O ATOM 921 CB ASP A 62 -5.277 13.870 -2.960 1.00 0.93 C ATOM 922 CG ASP A 62 -6.447 14.832 -3.132 1.00 1.44 C ATOM 923 OD1 ASP A 62 -7.242 14.652 -4.096 1.00 1.92 O ATOM 924 OD2 ASP A 62 -6.604 15.767 -2.325 1.00 2.07 O ATOM 925 H ASP A 62 -7.258 12.304 -3.387 1.00 0.89 H ATOM 926 HA ASP A 62 -4.821 11.913 -2.227 1.00 0.74 H ATOM 927 HB2 ASP A 62 -4.456 14.412 -2.513 1.00 1.42 H ATOM 928 HB3 ASP A 62 -4.969 13.514 -3.929 1.00 1.50 H ATOM 929 N ASP A 63 -6.650 13.663 -0.128 1.00 0.63 N ATOM 930 CA ASP A 63 -6.794 14.047 1.295 1.00 0.61 C ATOM 931 C ASP A 63 -6.681 12.836 2.238 1.00 0.59 C ATOM 932 O ASP A 63 -6.049 12.903 3.287 1.00 0.64 O ATOM 933 CB ASP A 63 -8.155 14.745 1.513 1.00 0.77 C ATOM 934 CG ASP A 63 -8.403 15.185 2.959 1.00 1.36 C ATOM 935 OD1 ASP A 63 -8.901 14.369 3.776 1.00 2.10 O ATOM 936 OD2 ASP A 63 -8.080 16.347 3.304 1.00 2.00 O ATOM 937 H ASP A 63 -7.322 13.962 -0.775 1.00 0.73 H ATOM 938 HA ASP A 63 -6.008 14.751 1.535 1.00 0.64 H ATOM 939 HB2 ASP A 63 -8.197 15.626 0.889 1.00 1.22 H ATOM 940 HB3 ASP A 63 -8.949 14.066 1.226 1.00 1.43 H ATOM 941 N VAL A 64 -7.216 11.714 1.804 1.00 0.62 N ATOM 942 CA VAL A 64 -7.282 10.519 2.629 1.00 0.69 C ATOM 943 C VAL A 64 -5.957 9.738 2.567 1.00 0.67 C ATOM 944 O VAL A 64 -5.659 8.913 3.434 1.00 0.78 O ATOM 945 CB VAL A 64 -8.485 9.598 2.216 1.00 0.82 C ATOM 946 CG1 VAL A 64 -8.641 8.405 3.154 1.00 0.98 C ATOM 947 CG2 VAL A 64 -9.781 10.406 2.171 1.00 0.90 C ATOM 948 H VAL A 64 -7.544 11.689 0.884 1.00 0.65 H ATOM 949 HA VAL A 64 -7.425 10.836 3.651 1.00 0.75 H ATOM 950 HB VAL A 64 -8.291 9.221 1.222 1.00 0.81 H ATOM 951 HG11 VAL A 64 -9.470 7.785 2.840 1.00 1.47 H ATOM 952 HG12 VAL A 64 -8.825 8.753 4.160 1.00 1.46 H ATOM 953 HG13 VAL A 64 -7.736 7.813 3.155 1.00 1.30 H ATOM 954 HG21 VAL A 64 -9.977 10.823 3.146 1.00 1.40 H ATOM 955 HG22 VAL A 64 -10.597 9.761 1.892 1.00 1.21 H ATOM 956 HG23 VAL A 64 -9.692 11.197 1.446 1.00 1.47 H ATOM 957 N ALA A 65 -5.139 10.055 1.582 1.00 0.61 N ATOM 958 CA ALA A 65 -3.860 9.392 1.423 1.00 0.67 C ATOM 959 C ALA A 65 -2.891 9.865 2.506 1.00 0.64 C ATOM 960 O ALA A 65 -2.114 9.094 3.039 1.00 0.74 O ATOM 961 CB ALA A 65 -3.295 9.651 0.036 1.00 0.77 C ATOM 962 H ALA A 65 -5.403 10.765 0.957 1.00 0.61 H ATOM 963 HA ALA A 65 -4.008 8.328 1.546 1.00 0.76 H ATOM 964 HB1 ALA A 65 -3.119 10.708 -0.069 1.00 1.31 H ATOM 965 HB2 ALA A 65 -3.985 9.302 -0.717 1.00 1.30 H ATOM 966 HB3 ALA A 65 -2.368 9.110 -0.068 1.00 1.19 H ATOM 967 N GLY A 66 -3.020 11.123 2.891 1.00 0.58 N ATOM 968 CA GLY A 66 -2.154 11.686 3.902 1.00 0.66 C ATOM 969 C GLY A 66 -2.668 11.436 5.307 1.00 0.68 C ATOM 970 O GLY A 66 -2.521 12.274 6.196 1.00 0.86 O ATOM 971 H GLY A 66 -3.726 11.676 2.491 1.00 0.56 H ATOM 972 HA2 GLY A 66 -1.173 11.241 3.823 1.00 0.71 H ATOM 973 HA3 GLY A 66 -2.079 12.754 3.749 1.00 0.76 H ATOM 974 N ARG A 67 -3.284 10.300 5.513 1.00 0.64 N ATOM 975 CA ARG A 67 -3.797 9.946 6.823 1.00 0.79 C ATOM 976 C ARG A 67 -3.033 8.745 7.368 1.00 0.77 C ATOM 977 O ARG A 67 -3.325 8.246 8.463 1.00 0.95 O ATOM 978 CB ARG A 67 -5.306 9.645 6.765 1.00 0.94 C ATOM 979 CG ARG A 67 -6.159 10.764 6.147 1.00 1.12 C ATOM 980 CD ARG A 67 -6.069 12.083 6.906 1.00 1.40 C ATOM 981 NE ARG A 67 -6.647 12.017 8.260 1.00 1.89 N ATOM 982 CZ ARG A 67 -6.993 13.100 8.996 1.00 2.51 C ATOM 983 NH1 ARG A 67 -6.826 14.326 8.515 1.00 2.93 N ATOM 984 NH2 ARG A 67 -7.545 12.951 10.194 1.00 3.22 N ATOM 985 H ARG A 67 -3.381 9.684 4.755 1.00 0.62 H ATOM 986 HA ARG A 67 -3.633 10.790 7.475 1.00 0.90 H ATOM 987 HB2 ARG A 67 -5.457 8.748 6.186 1.00 1.03 H ATOM 988 HB3 ARG A 67 -5.649 9.474 7.773 1.00 1.14 H ATOM 989 HG2 ARG A 67 -5.843 10.933 5.128 1.00 1.53 H ATOM 990 HG3 ARG A 67 -7.188 10.442 6.137 1.00 1.58 H ATOM 991 HD2 ARG A 67 -5.026 12.346 6.997 1.00 1.87 H ATOM 992 HD3 ARG A 67 -6.589 12.845 6.343 1.00 1.90 H ATOM 993 HE ARG A 67 -6.797 11.111 8.611 1.00 2.27 H ATOM 994 HH11 ARG A 67 -6.468 14.525 7.597 1.00 2.92 H ATOM 995 HH12 ARG A 67 -7.067 15.134 9.065 1.00 3.61 H ATOM 996 HH21 ARG A 67 -7.740 12.053 10.612 1.00 3.51 H ATOM 997 HH22 ARG A 67 -7.825 13.753 10.736 1.00 3.77 H ATOM 998 N VAL A 68 -2.036 8.288 6.618 1.00 0.62 N ATOM 999 CA VAL A 68 -1.248 7.128 7.019 1.00 0.66 C ATOM 1000 C VAL A 68 0.192 7.508 7.318 1.00 0.67 C ATOM 1001 O VAL A 68 0.584 8.673 7.158 1.00 1.00 O ATOM 1002 CB VAL A 68 -1.250 5.980 5.957 1.00 0.68 C ATOM 1003 CG1 VAL A 68 -2.630 5.409 5.753 1.00 0.77 C ATOM 1004 CG2 VAL A 68 -0.674 6.451 4.615 1.00 0.64 C ATOM 1005 H VAL A 68 -1.779 8.745 5.791 1.00 0.55 H ATOM 1006 HA VAL A 68 -1.677 6.747 7.934 1.00 0.78 H ATOM 1007 HB VAL A 68 -0.619 5.184 6.324 1.00 0.78 H ATOM 1008 HG11 VAL A 68 -3.305 6.180 5.412 1.00 1.27 H ATOM 1009 HG12 VAL A 68 -2.984 4.973 6.676 1.00 1.31 H ATOM 1010 HG13 VAL A 68 -2.556 4.640 5.000 1.00 1.26 H ATOM 1011 HG21 VAL A 68 0.337 6.803 4.761 1.00 1.20 H ATOM 1012 HG22 VAL A 68 -1.282 7.245 4.204 1.00 1.23 H ATOM 1013 HG23 VAL A 68 -0.661 5.626 3.915 1.00 1.15 H ATOM 1014 N ASP A 69 0.965 6.516 7.730 1.00 0.54 N ATOM 1015 CA ASP A 69 2.394 6.660 7.961 1.00 0.64 C ATOM 1016 C ASP A 69 3.058 5.327 7.692 1.00 0.50 C ATOM 1017 O ASP A 69 4.097 5.248 7.028 1.00 0.54 O ATOM 1018 CB ASP A 69 2.697 7.123 9.401 1.00 0.99 C ATOM 1019 CG ASP A 69 4.199 7.239 9.692 1.00 1.11 C ATOM 1020 OD1 ASP A 69 4.816 8.265 9.337 1.00 1.37 O ATOM 1021 OD2 ASP A 69 4.758 6.317 10.321 1.00 1.84 O ATOM 1022 H ASP A 69 0.580 5.633 7.917 1.00 0.66 H ATOM 1023 HA ASP A 69 2.767 7.385 7.254 1.00 0.75 H ATOM 1024 HB2 ASP A 69 2.238 8.087 9.569 1.00 1.65 H ATOM 1025 HB3 ASP A 69 2.269 6.410 10.090 1.00 1.55 H ATOM 1026 N THR A 70 2.427 4.265 8.171 1.00 0.43 N ATOM 1027 CA THR A 70 2.926 2.928 7.965 1.00 0.37 C ATOM 1028 C THR A 70 1.938 2.080 7.133 1.00 0.33 C ATOM 1029 O THR A 70 0.727 2.392 7.067 1.00 0.34 O ATOM 1030 CB THR A 70 3.181 2.230 9.313 1.00 0.42 C ATOM 1031 OG1 THR A 70 1.983 2.240 10.089 1.00 0.51 O ATOM 1032 CG2 THR A 70 4.298 2.919 10.070 1.00 0.44 C ATOM 1033 H THR A 70 1.607 4.391 8.703 1.00 0.50 H ATOM 1034 HA THR A 70 3.864 3.004 7.438 1.00 0.40 H ATOM 1035 HB THR A 70 3.460 1.203 9.120 1.00 0.46 H ATOM 1036 HG1 THR A 70 1.611 3.138 10.064 1.00 0.52 H ATOM 1037 HG21 THR A 70 4.473 2.421 11.013 1.00 1.19 H ATOM 1038 HG22 THR A 70 4.015 3.948 10.231 1.00 1.03 H ATOM 1039 HG23 THR A 70 5.184 2.891 9.453 1.00 1.11 H ATOM 1040 N PRO A 71 2.429 0.997 6.466 1.00 0.32 N ATOM 1041 CA PRO A 71 1.600 0.051 5.682 1.00 0.31 C ATOM 1042 C PRO A 71 0.464 -0.554 6.513 1.00 0.29 C ATOM 1043 O PRO A 71 -0.587 -0.906 5.981 1.00 0.33 O ATOM 1044 CB PRO A 71 2.603 -1.036 5.296 1.00 0.34 C ATOM 1045 CG PRO A 71 3.884 -0.300 5.200 1.00 0.38 C ATOM 1046 CD PRO A 71 3.865 0.643 6.362 1.00 0.36 C ATOM 1047 HA PRO A 71 1.196 0.514 4.794 1.00 0.35 H ATOM 1048 HB2 PRO A 71 2.634 -1.780 6.079 1.00 0.33 H ATOM 1049 HB3 PRO A 71 2.341 -1.480 4.347 1.00 0.41 H ATOM 1050 HG2 PRO A 71 4.720 -0.981 5.267 1.00 0.40 H ATOM 1051 HG3 PRO A 71 3.931 0.256 4.273 1.00 0.43 H ATOM 1052 HD2 PRO A 71 4.226 0.156 7.256 1.00 0.36 H ATOM 1053 HD3 PRO A 71 4.460 1.517 6.140 1.00 0.41 H ATOM 1054 N ARG A 72 0.689 -0.656 7.823 1.00 0.30 N ATOM 1055 CA ARG A 72 -0.294 -1.168 8.780 1.00 0.34 C ATOM 1056 C ARG A 72 -1.602 -0.389 8.674 1.00 0.36 C ATOM 1057 O ARG A 72 -2.693 -0.957 8.640 1.00 0.43 O ATOM 1058 CB ARG A 72 0.281 -1.006 10.198 1.00 0.41 C ATOM 1059 CG ARG A 72 -0.657 -1.372 11.345 1.00 0.54 C ATOM 1060 CD ARG A 72 -0.023 -1.022 12.682 1.00 0.69 C ATOM 1061 NE ARG A 72 0.319 0.418 12.756 1.00 0.75 N ATOM 1062 CZ ARG A 72 1.467 0.924 13.250 1.00 0.98 C ATOM 1063 NH1 ARG A 72 2.398 0.099 13.745 1.00 1.38 N ATOM 1064 NH2 ARG A 72 1.672 2.245 13.218 1.00 1.16 N ATOM 1065 H ARG A 72 1.568 -0.373 8.155 1.00 0.31 H ATOM 1066 HA ARG A 72 -0.464 -2.215 8.590 1.00 0.37 H ATOM 1067 HB2 ARG A 72 1.157 -1.634 10.277 1.00 0.47 H ATOM 1068 HB3 ARG A 72 0.583 0.025 10.318 1.00 0.43 H ATOM 1069 HG2 ARG A 72 -1.577 -0.819 11.232 1.00 0.56 H ATOM 1070 HG3 ARG A 72 -0.864 -2.430 11.320 1.00 0.63 H ATOM 1071 HD2 ARG A 72 -0.707 -1.270 13.479 1.00 0.82 H ATOM 1072 HD3 ARG A 72 0.885 -1.596 12.794 1.00 0.79 H ATOM 1073 HE ARG A 72 -0.362 1.031 12.399 1.00 0.96 H ATOM 1074 HH11 ARG A 72 2.262 -0.893 13.769 1.00 1.51 H ATOM 1075 HH12 ARG A 72 3.304 0.393 14.104 1.00 1.75 H ATOM 1076 HH21 ARG A 72 1.001 2.899 12.839 1.00 1.26 H ATOM 1077 HH22 ARG A 72 2.509 2.668 13.566 1.00 1.42 H ATOM 1078 N GLU A 73 -1.465 0.900 8.575 1.00 0.37 N ATOM 1079 CA GLU A 73 -2.586 1.816 8.571 1.00 0.42 C ATOM 1080 C GLU A 73 -3.186 1.930 7.164 1.00 0.40 C ATOM 1081 O GLU A 73 -4.375 2.158 6.995 1.00 0.44 O ATOM 1082 CB GLU A 73 -2.055 3.134 9.101 1.00 0.50 C ATOM 1083 CG GLU A 73 -1.486 2.954 10.501 1.00 0.63 C ATOM 1084 CD GLU A 73 -0.376 3.910 10.854 1.00 0.74 C ATOM 1085 OE1 GLU A 73 0.207 4.504 9.916 1.00 0.69 O ATOM 1086 OE2 GLU A 73 -0.171 4.189 12.065 1.00 1.33 O ATOM 1087 H GLU A 73 -0.562 1.281 8.493 1.00 0.36 H ATOM 1088 HA GLU A 73 -3.339 1.447 9.249 1.00 0.45 H ATOM 1089 HB2 GLU A 73 -1.269 3.499 8.451 1.00 0.50 H ATOM 1090 HB3 GLU A 73 -2.847 3.869 9.154 1.00 0.58 H ATOM 1091 HG2 GLU A 73 -2.285 3.102 11.215 1.00 1.01 H ATOM 1092 HG3 GLU A 73 -1.112 1.945 10.610 1.00 0.99 H ATOM 1093 N LEU A 74 -2.341 1.708 6.172 1.00 0.40 N ATOM 1094 CA LEU A 74 -2.727 1.749 4.761 1.00 0.43 C ATOM 1095 C LEU A 74 -3.660 0.553 4.467 1.00 0.41 C ATOM 1096 O LEU A 74 -4.692 0.698 3.819 1.00 0.42 O ATOM 1097 CB LEU A 74 -1.425 1.678 3.890 1.00 0.44 C ATOM 1098 CG LEU A 74 -1.486 2.138 2.400 1.00 0.50 C ATOM 1099 CD1 LEU A 74 -0.112 2.031 1.747 1.00 1.04 C ATOM 1100 CD2 LEU A 74 -2.492 1.350 1.584 1.00 1.10 C ATOM 1101 H LEU A 74 -1.410 1.511 6.400 1.00 0.42 H ATOM 1102 HA LEU A 74 -3.254 2.667 4.545 1.00 0.46 H ATOM 1103 HB2 LEU A 74 -0.670 2.280 4.376 1.00 0.46 H ATOM 1104 HB3 LEU A 74 -1.094 0.650 3.901 1.00 0.45 H ATOM 1105 HG LEU A 74 -1.759 3.185 2.374 1.00 0.90 H ATOM 1106 HD11 LEU A 74 -0.182 2.371 0.723 1.00 1.74 H ATOM 1107 HD12 LEU A 74 0.233 1.005 1.760 1.00 1.51 H ATOM 1108 HD13 LEU A 74 0.584 2.664 2.275 1.00 1.48 H ATOM 1109 HD21 LEU A 74 -3.457 1.478 2.051 1.00 1.61 H ATOM 1110 HD22 LEU A 74 -2.237 0.301 1.568 1.00 1.53 H ATOM 1111 HD23 LEU A 74 -2.525 1.739 0.577 1.00 1.77 H ATOM 1112 N LEU A 75 -3.281 -0.605 4.985 1.00 0.41 N ATOM 1113 CA LEU A 75 -3.997 -1.869 4.762 1.00 0.41 C ATOM 1114 C LEU A 75 -5.471 -1.764 5.167 1.00 0.39 C ATOM 1115 O LEU A 75 -6.380 -1.906 4.327 1.00 0.37 O ATOM 1116 CB LEU A 75 -3.322 -2.977 5.577 1.00 0.46 C ATOM 1117 CG LEU A 75 -3.871 -4.400 5.404 1.00 0.48 C ATOM 1118 CD1 LEU A 75 -3.600 -4.927 4.003 1.00 0.51 C ATOM 1119 CD2 LEU A 75 -3.287 -5.324 6.462 1.00 0.54 C ATOM 1120 H LEU A 75 -2.471 -0.620 5.541 1.00 0.44 H ATOM 1121 HA LEU A 75 -3.924 -2.125 3.714 1.00 0.43 H ATOM 1122 HB2 LEU A 75 -2.271 -2.977 5.330 1.00 0.49 H ATOM 1123 HB3 LEU A 75 -3.423 -2.712 6.619 1.00 0.48 H ATOM 1124 HG LEU A 75 -4.944 -4.374 5.531 1.00 0.46 H ATOM 1125 HD11 LEU A 75 -4.018 -5.919 3.903 1.00 1.20 H ATOM 1126 HD12 LEU A 75 -2.531 -4.983 3.855 1.00 1.09 H ATOM 1127 HD13 LEU A 75 -4.041 -4.256 3.280 1.00 1.04 H ATOM 1128 HD21 LEU A 75 -2.211 -5.365 6.380 1.00 1.17 H ATOM 1129 HD22 LEU A 75 -3.694 -6.313 6.325 1.00 1.16 H ATOM 1130 HD23 LEU A 75 -3.565 -4.959 7.439 1.00 1.11 H ATOM 1131 N ASP A 76 -5.695 -1.443 6.442 1.00 0.44 N ATOM 1132 CA ASP A 76 -7.057 -1.394 7.017 1.00 0.48 C ATOM 1133 C ASP A 76 -7.888 -0.305 6.357 1.00 0.40 C ATOM 1134 O ASP A 76 -9.103 -0.443 6.192 1.00 0.44 O ATOM 1135 CB ASP A 76 -7.005 -1.176 8.534 1.00 0.66 C ATOM 1136 CG ASP A 76 -8.361 -1.339 9.214 1.00 1.06 C ATOM 1137 OD1 ASP A 76 -8.800 -2.485 9.456 1.00 1.08 O ATOM 1138 OD2 ASP A 76 -9.036 -0.311 9.459 1.00 1.89 O ATOM 1139 H ASP A 76 -4.930 -1.246 7.024 1.00 0.49 H ATOM 1140 HA ASP A 76 -7.530 -2.342 6.811 1.00 0.53 H ATOM 1141 HB2 ASP A 76 -6.320 -1.889 8.968 1.00 1.10 H ATOM 1142 HB3 ASP A 76 -6.643 -0.176 8.725 1.00 1.09 H ATOM 1143 N LEU A 77 -7.207 0.748 5.918 1.00 0.37 N ATOM 1144 CA LEU A 77 -7.844 1.869 5.233 1.00 0.38 C ATOM 1145 C LEU A 77 -8.525 1.396 3.953 1.00 0.33 C ATOM 1146 O LEU A 77 -9.679 1.743 3.682 1.00 0.34 O ATOM 1147 CB LEU A 77 -6.804 2.965 4.920 1.00 0.46 C ATOM 1148 CG LEU A 77 -7.301 4.219 4.193 1.00 0.57 C ATOM 1149 CD1 LEU A 77 -8.303 4.960 5.036 1.00 1.37 C ATOM 1150 CD2 LEU A 77 -6.128 5.126 3.825 1.00 1.24 C ATOM 1151 H LEU A 77 -6.237 0.758 6.059 1.00 0.40 H ATOM 1152 HA LEU A 77 -8.593 2.271 5.896 1.00 0.45 H ATOM 1153 HB2 LEU A 77 -6.366 3.285 5.852 1.00 0.58 H ATOM 1154 HB3 LEU A 77 -6.011 2.544 4.321 1.00 0.49 H ATOM 1155 HG LEU A 77 -7.798 3.925 3.279 1.00 1.09 H ATOM 1156 HD11 LEU A 77 -8.645 5.838 4.512 1.00 1.82 H ATOM 1157 HD12 LEU A 77 -7.834 5.244 5.965 1.00 1.74 H ATOM 1158 HD13 LEU A 77 -9.136 4.300 5.224 1.00 2.11 H ATOM 1159 HD21 LEU A 77 -5.618 5.442 4.722 1.00 1.84 H ATOM 1160 HD22 LEU A 77 -6.500 5.993 3.302 1.00 1.74 H ATOM 1161 HD23 LEU A 77 -5.438 4.598 3.186 1.00 1.79 H ATOM 1162 N ILE A 78 -7.826 0.558 3.197 1.00 0.31 N ATOM 1163 CA ILE A 78 -8.371 0.035 1.958 1.00 0.32 C ATOM 1164 C ILE A 78 -9.430 -1.016 2.246 1.00 0.29 C ATOM 1165 O ILE A 78 -10.475 -1.044 1.595 1.00 0.33 O ATOM 1166 CB ILE A 78 -7.269 -0.523 1.003 1.00 0.39 C ATOM 1167 CG1 ILE A 78 -6.355 0.616 0.536 1.00 0.53 C ATOM 1168 CG2 ILE A 78 -7.877 -1.273 -0.191 1.00 0.44 C ATOM 1169 CD1 ILE A 78 -5.321 0.211 -0.504 1.00 0.63 C ATOM 1170 H ILE A 78 -6.932 0.275 3.494 1.00 0.33 H ATOM 1171 HA ILE A 78 -8.868 0.859 1.465 1.00 0.39 H ATOM 1172 HB ILE A 78 -6.679 -1.233 1.561 1.00 0.40 H ATOM 1173 HG12 ILE A 78 -6.962 1.396 0.099 1.00 1.11 H ATOM 1174 HG13 ILE A 78 -5.836 1.012 1.396 1.00 1.01 H ATOM 1175 HG21 ILE A 78 -8.521 -0.612 -0.748 1.00 1.18 H ATOM 1176 HG22 ILE A 78 -8.442 -2.119 0.177 1.00 0.99 H ATOM 1177 HG23 ILE A 78 -7.076 -1.629 -0.821 1.00 1.11 H ATOM 1178 HD11 ILE A 78 -5.820 -0.167 -1.386 1.00 1.29 H ATOM 1179 HD12 ILE A 78 -4.660 -0.548 -0.110 1.00 1.27 H ATOM 1180 HD13 ILE A 78 -4.747 1.083 -0.783 1.00 1.30 H ATOM 1181 N ASN A 79 -9.171 -1.848 3.248 1.00 0.30 N ATOM 1182 CA ASN A 79 -10.095 -2.920 3.636 1.00 0.33 C ATOM 1183 C ASN A 79 -11.457 -2.347 3.987 1.00 0.37 C ATOM 1184 O ASN A 79 -12.484 -2.881 3.573 1.00 0.46 O ATOM 1185 CB ASN A 79 -9.568 -3.750 4.832 1.00 0.42 C ATOM 1186 CG ASN A 79 -8.241 -4.497 4.600 1.00 0.53 C ATOM 1187 OD1 ASN A 79 -7.493 -4.740 5.530 1.00 1.21 O ATOM 1188 ND2 ASN A 79 -7.940 -4.848 3.369 1.00 0.55 N ATOM 1189 H ASN A 79 -8.335 -1.727 3.746 1.00 0.32 H ATOM 1190 HA ASN A 79 -10.242 -3.577 2.790 1.00 0.39 H ATOM 1191 HB2 ASN A 79 -9.468 -3.119 5.702 1.00 0.48 H ATOM 1192 HB3 ASN A 79 -10.321 -4.490 5.056 1.00 0.47 H ATOM 1193 HD21 ASN A 79 -8.562 -4.608 2.657 1.00 1.07 H ATOM 1194 HD22 ASN A 79 -7.105 -5.347 3.235 1.00 0.51 H ATOM 1195 N GLY A 80 -11.449 -1.250 4.725 1.00 0.37 N ATOM 1196 CA GLY A 80 -12.681 -0.596 5.107 1.00 0.46 C ATOM 1197 C GLY A 80 -13.351 0.128 3.951 1.00 0.47 C ATOM 1198 O GLY A 80 -14.571 0.095 3.827 1.00 0.57 O ATOM 1199 H GLY A 80 -10.587 -0.893 5.040 1.00 0.36 H ATOM 1200 HA2 GLY A 80 -13.371 -1.341 5.478 1.00 0.53 H ATOM 1201 HA3 GLY A 80 -12.480 0.127 5.887 1.00 0.49 H ATOM 1202 N ALA A 81 -12.543 0.727 3.078 1.00 0.43 N ATOM 1203 CA ALA A 81 -13.045 1.539 1.966 1.00 0.49 C ATOM 1204 C ALA A 81 -13.836 0.702 0.966 1.00 0.54 C ATOM 1205 O ALA A 81 -14.765 1.197 0.323 1.00 0.68 O ATOM 1206 CB ALA A 81 -11.900 2.266 1.283 1.00 0.49 C ATOM 1207 H ALA A 81 -11.570 0.610 3.149 1.00 0.39 H ATOM 1208 HA ALA A 81 -13.719 2.277 2.372 1.00 0.55 H ATOM 1209 HB1 ALA A 81 -12.305 2.915 0.519 1.00 1.19 H ATOM 1210 HB2 ALA A 81 -11.225 1.541 0.849 1.00 1.14 H ATOM 1211 HB3 ALA A 81 -11.371 2.861 2.017 1.00 1.01 H ATOM 1212 N LEU A 82 -13.465 -0.568 0.854 1.00 0.48 N ATOM 1213 CA LEU A 82 -14.137 -1.541 -0.023 1.00 0.57 C ATOM 1214 C LEU A 82 -15.658 -1.575 0.215 1.00 0.70 C ATOM 1215 O LEU A 82 -16.452 -1.543 -0.726 1.00 0.87 O ATOM 1216 CB LEU A 82 -13.558 -2.949 0.233 1.00 0.54 C ATOM 1217 CG LEU A 82 -12.121 -3.195 -0.229 1.00 0.55 C ATOM 1218 CD1 LEU A 82 -11.604 -4.506 0.339 1.00 0.61 C ATOM 1219 CD2 LEU A 82 -12.059 -3.241 -1.741 1.00 0.63 C ATOM 1220 H LEU A 82 -12.686 -0.846 1.384 1.00 0.42 H ATOM 1221 HA LEU A 82 -13.938 -1.279 -1.052 1.00 0.62 H ATOM 1222 HB2 LEU A 82 -13.598 -3.139 1.294 1.00 0.56 H ATOM 1223 HB3 LEU A 82 -14.200 -3.664 -0.263 1.00 0.59 H ATOM 1224 HG LEU A 82 -11.485 -2.396 0.121 1.00 0.57 H ATOM 1225 HD11 LEU A 82 -12.236 -5.315 0.004 1.00 1.16 H ATOM 1226 HD12 LEU A 82 -11.617 -4.467 1.420 1.00 1.10 H ATOM 1227 HD13 LEU A 82 -10.591 -4.688 0.014 1.00 1.22 H ATOM 1228 HD21 LEU A 82 -11.043 -3.421 -2.061 1.00 1.12 H ATOM 1229 HD22 LEU A 82 -12.405 -2.304 -2.144 1.00 1.26 H ATOM 1230 HD23 LEU A 82 -12.676 -4.050 -2.103 1.00 1.22 H ATOM 1231 N ALA A 83 -16.051 -1.539 1.484 1.00 0.69 N ATOM 1232 CA ALA A 83 -17.444 -1.739 1.867 1.00 0.87 C ATOM 1233 C ALA A 83 -18.314 -0.487 1.708 1.00 1.01 C ATOM 1234 O ALA A 83 -19.520 -0.523 1.946 1.00 1.25 O ATOM 1235 CB ALA A 83 -17.518 -2.274 3.282 1.00 0.90 C ATOM 1236 H ALA A 83 -15.395 -1.339 2.189 1.00 0.62 H ATOM 1237 HA ALA A 83 -17.841 -2.500 1.212 1.00 0.97 H ATOM 1238 HB1 ALA A 83 -18.540 -2.540 3.504 1.00 1.39 H ATOM 1239 HB2 ALA A 83 -17.180 -1.507 3.963 1.00 1.30 H ATOM 1240 HB3 ALA A 83 -16.875 -3.135 3.366 1.00 1.25 H ATOM 1241 N GLU A 84 -17.704 0.611 1.310 1.00 0.95 N ATOM 1242 CA GLU A 84 -18.433 1.856 1.095 1.00 1.11 C ATOM 1243 C GLU A 84 -18.850 1.977 -0.364 1.00 1.18 C ATOM 1244 O GLU A 84 -19.610 2.885 -0.758 1.00 1.36 O ATOM 1245 CB GLU A 84 -17.577 3.047 1.480 1.00 1.15 C ATOM 1246 CG GLU A 84 -17.227 3.127 2.957 1.00 1.57 C ATOM 1247 CD GLU A 84 -18.422 3.387 3.870 1.00 1.76 C ATOM 1248 OE1 GLU A 84 -19.228 4.286 3.577 1.00 1.86 O ATOM 1249 OE2 GLU A 84 -18.566 2.715 4.902 1.00 2.49 O ATOM 1250 H GLU A 84 -16.735 0.580 1.172 1.00 0.84 H ATOM 1251 HA GLU A 84 -19.318 1.835 1.711 1.00 1.28 H ATOM 1252 HB2 GLU A 84 -16.654 3.001 0.917 1.00 1.60 H ATOM 1253 HB3 GLU A 84 -18.096 3.952 1.196 1.00 1.38 H ATOM 1254 HG2 GLU A 84 -16.762 2.195 3.244 1.00 2.14 H ATOM 1255 HG3 GLU A 84 -16.512 3.927 3.046 1.00 2.20 H ATOM 1256 N ALA A 85 -18.324 1.096 -1.159 1.00 1.15 N ATOM 1257 CA ALA A 85 -18.661 1.064 -2.562 1.00 1.34 C ATOM 1258 C ALA A 85 -19.585 -0.124 -2.877 1.00 1.47 C ATOM 1259 O ALA A 85 -20.821 0.037 -2.842 1.00 1.86 O ATOM 1260 CB ALA A 85 -17.405 1.103 -3.442 1.00 1.37 C ATOM 1261 H ALA A 85 -17.701 0.455 -0.755 1.00 1.07 H ATOM 1262 HA ALA A 85 -19.236 1.962 -2.750 1.00 1.54 H ATOM 1263 HB1 ALA A 85 -16.753 0.262 -3.251 1.00 1.61 H ATOM 1264 HB2 ALA A 85 -16.858 2.015 -3.247 1.00 1.71 H ATOM 1265 HB3 ALA A 85 -17.696 1.094 -4.485 1.00 1.82 H ATOM 1266 N ALA A 86 -18.989 -1.300 -3.107 1.00 1.53 N ATOM 1267 CA ALA A 86 -19.670 -2.556 -3.429 1.00 1.70 C ATOM 1268 C ALA A 86 -18.609 -3.527 -3.905 1.00 2.36 C ATOM 1269 O ALA A 86 -17.963 -4.143 -3.058 1.00 2.86 O ATOM 1270 CB ALA A 86 -20.733 -2.394 -4.529 1.00 2.39 C ATOM 1271 OXT ALA A 86 -18.393 -3.639 -5.136 1.00 3.03 O ATOM 1272 H ALA A 86 -18.017 -1.406 -3.050 1.00 1.73 H ATOM 1273 HA ALA A 86 -20.121 -2.938 -2.523 1.00 1.65 H ATOM 1274 HB1 ALA A 86 -20.257 -2.014 -5.419 1.00 2.96 H ATOM 1275 HB2 ALA A 86 -21.507 -1.713 -4.208 1.00 2.75 H ATOM 1276 HB3 ALA A 86 -21.168 -3.356 -4.746 1.00 2.71 H TER 1277 ALA A 86 HETATM 1278 P24 SXR A 101 5.285 12.221 -5.053 1.00 1.19 P HETATM 1279 O26 SXR A 101 6.678 12.769 -4.590 1.00 1.72 O HETATM 1280 O23 SXR A 101 4.206 13.244 -5.346 1.00 1.83 O HETATM 1281 O27 SXR A 101 5.525 11.370 -6.333 1.00 1.31 O HETATM 1282 C28 SXR A 101 4.402 10.661 -7.002 1.00 1.24 C HETATM 1283 C29 SXR A 101 3.731 11.480 -8.154 1.00 1.82 C HETATM 1284 C30 SXR A 101 3.035 10.472 -9.054 1.00 2.42 C HETATM 1285 C31 SXR A 101 2.666 12.445 -7.605 1.00 1.85 C HETATM 1286 C32 SXR A 101 4.842 12.294 -8.973 1.00 2.74 C HETATM 1287 O33 SXR A 101 5.201 13.481 -8.217 1.00 3.00 O HETATM 1288 C34 SXR A 101 4.294 12.794 -10.313 1.00 3.44 C HETATM 1289 O35 SXR A 101 4.312 12.086 -11.344 1.00 3.88 O HETATM 1290 N36 SXR A 101 3.832 14.014 -10.281 1.00 3.90 N HETATM 1291 C37 SXR A 101 3.254 14.714 -11.418 1.00 4.60 C HETATM 1292 C38 SXR A 101 1.828 15.173 -11.096 1.00 4.73 C HETATM 1293 C39 SXR A 101 0.932 14.010 -10.661 1.00 4.02 C HETATM 1294 O40 SXR A 101 0.911 12.935 -11.272 1.00 4.42 O HETATM 1295 N41 SXR A 101 0.219 14.249 -9.580 1.00 3.33 N HETATM 1296 C42 SXR A 101 -0.687 13.292 -8.958 1.00 2.88 C HETATM 1297 C43 SXR A 101 -1.524 13.955 -7.870 1.00 2.85 C HETATM 1298 S1 SXR A 101 -2.317 12.768 -6.886 1.00 3.15 S HETATM 1299 C11 SXR A 101 0.210 8.655 -0.432 1.00 2.09 C HETATM 1300 C10 SXR A 101 0.289 8.098 0.846 1.00 2.05 C HETATM 1301 C9 SXR A 101 1.282 8.528 1.741 1.00 1.91 C HETATM 1302 C8 SXR A 101 2.183 9.519 1.343 1.00 2.19 C HETATM 1303 C7 SXR A 101 2.096 10.070 0.068 1.00 2.18 C HETATM 1304 C6 SXR A 101 1.114 9.653 -0.833 1.00 1.95 C HETATM 1305 C5 SXR A 101 1.044 10.268 -2.203 1.00 2.57 C HETATM 1306 C4 SXR A 101 -0.350 10.470 -2.746 1.00 2.29 C HETATM 1307 C3 SXR A 101 -0.615 11.875 -3.293 1.00 2.88 C HETATM 1308 O3 SXR A 101 0.019 12.854 -2.865 1.00 3.69 O HETATM 1309 C2 SXR A 101 -1.658 12.072 -4.358 1.00 2.88 C HETATM 1310 C1 SXR A 101 -1.092 12.557 -5.679 1.00 2.84 C HETATM 1311 H28A SXR A 101 4.786 9.711 -7.338 1.00 1.41 H HETATM 1312 H28B SXR A 101 3.657 10.444 -6.251 1.00 0.99 H HETATM 1313 H30A SXR A 101 3.376 10.622 -10.069 1.00 2.99 H HETATM 1314 H30B SXR A 101 1.969 10.659 -9.017 1.00 2.62 H HETATM 1315 H30C SXR A 101 3.240 9.461 -8.733 1.00 2.79 H HETATM 1316 H31A SXR A 101 1.825 12.496 -8.284 1.00 2.21 H HETATM 1317 H31B SXR A 101 3.103 13.426 -7.481 1.00 2.37 H HETATM 1318 H31C SXR A 101 2.317 12.100 -6.642 1.00 1.95 H HETATM 1319 H32A SXR A 101 5.709 11.668 -9.130 1.00 3.10 H HETATM 1320 H33A SXR A 101 4.861 13.349 -7.319 1.00 3.40 H HETATM 1321 H36A SXR A 101 3.915 14.443 -9.402 1.00 3.96 H HETATM 1322 H37A SXR A 101 3.859 15.572 -11.661 1.00 4.70 H HETATM 1323 H37B SXR A 101 3.230 14.050 -12.270 1.00 5.21 H HETATM 1324 H38A SXR A 101 1.868 15.890 -10.290 1.00 5.22 H HETATM 1325 H38B SXR A 101 1.385 15.639 -11.965 1.00 5.25 H HETATM 1326 H41A SXR A 101 0.293 15.117 -9.134 1.00 3.43 H HETATM 1327 H42A SXR A 101 -1.310 12.823 -9.702 1.00 3.18 H HETATM 1328 H42B SXR A 101 -0.064 12.532 -8.493 1.00 2.75 H HETATM 1329 H43A SXR A 101 -2.256 14.630 -8.290 1.00 3.20 H HETATM 1330 H43B SXR A 101 -0.853 14.510 -7.227 1.00 2.98 H HETATM 1331 H11A SXR A 101 -0.554 8.317 -1.113 1.00 2.81 H HETATM 1332 H10A SXR A 101 -0.399 7.327 1.151 1.00 2.73 H HETATM 1333 H9A SXR A 101 1.346 8.090 2.729 1.00 2.32 H HETATM 1334 H8A SXR A 101 2.948 9.858 2.025 1.00 2.94 H HETATM 1335 H7A SXR A 101 2.794 10.836 -0.231 1.00 2.89 H HETATM 1336 H5A SXR A 101 1.817 10.827 -2.694 1.00 3.45 H HETATM 1337 H5B SXR A 101 1.459 9.349 -2.609 1.00 2.83 H HETATM 1338 H4A SXR A 101 -0.948 9.687 -3.176 1.00 2.15 H HETATM 1339 H4B SXR A 101 -0.774 10.213 -1.773 1.00 2.47 H HETATM 1340 H2A SXR A 101 -2.622 11.598 -4.416 1.00 3.20 H HETATM 1341 H2B SXR A 101 -2.143 12.865 -3.793 1.00 3.39 H HETATM 1342 H1A SXR A 101 -0.139 13.020 -5.869 1.00 3.11 H HETATM 1343 H1B SXR A 101 -0.632 11.582 -5.829 1.00 2.74 H