ATOM 1 N MET A 1 -17.456 -7.912 -2.698 1.00 3.07 N ATOM 2 CA MET A 1 -17.849 -7.080 -1.563 1.00 2.76 C ATOM 3 C MET A 1 -16.625 -6.740 -0.735 1.00 2.34 C ATOM 4 O MET A 1 -16.165 -5.608 -0.726 1.00 2.38 O ATOM 5 CB MET A 1 -18.878 -7.816 -0.684 1.00 2.93 C ATOM 6 CG MET A 1 -19.336 -7.033 0.539 1.00 3.33 C ATOM 7 SD MET A 1 -20.547 -7.937 1.530 1.00 4.18 S ATOM 8 CE MET A 1 -21.871 -8.152 0.332 1.00 4.50 C ATOM 9 H1 MET A 1 -17.087 -8.829 -2.369 1.00 3.22 H ATOM 10 H2 MET A 1 -16.680 -7.443 -3.207 1.00 3.51 H ATOM 11 H3 MET A 1 -18.227 -8.068 -3.380 1.00 3.36 H ATOM 12 HA MET A 1 -18.288 -6.168 -1.942 1.00 3.37 H ATOM 13 HB2 MET A 1 -19.748 -8.041 -1.285 1.00 3.26 H ATOM 14 HB3 MET A 1 -18.441 -8.744 -0.346 1.00 3.26 H ATOM 15 HG2 MET A 1 -18.475 -6.827 1.156 1.00 3.63 H ATOM 16 HG3 MET A 1 -19.778 -6.103 0.211 1.00 3.51 H ATOM 17 HE1 MET A 1 -21.509 -8.709 -0.519 1.00 4.67 H ATOM 18 HE2 MET A 1 -22.219 -7.183 0.004 1.00 4.75 H ATOM 19 HE3 MET A 1 -22.689 -8.686 0.791 1.00 4.79 H ATOM 20 N ALA A 2 -16.071 -7.733 -0.085 1.00 2.23 N ATOM 21 CA ALA A 2 -14.946 -7.543 0.766 1.00 1.97 C ATOM 22 C ALA A 2 -13.909 -8.598 0.481 1.00 1.62 C ATOM 23 O ALA A 2 -14.181 -9.791 0.578 1.00 1.83 O ATOM 24 CB ALA A 2 -15.375 -7.586 2.227 1.00 2.32 C ATOM 25 H ALA A 2 -16.401 -8.655 -0.200 1.00 2.55 H ATOM 26 HA ALA A 2 -14.527 -6.570 0.562 1.00 2.02 H ATOM 27 HB1 ALA A 2 -15.790 -8.557 2.451 1.00 2.39 H ATOM 28 HB2 ALA A 2 -16.127 -6.829 2.401 1.00 2.57 H ATOM 29 HB3 ALA A 2 -14.520 -7.398 2.859 1.00 2.91 H ATOM 30 N THR A 3 -12.766 -8.152 0.061 1.00 1.33 N ATOM 31 CA THR A 3 -11.626 -8.985 -0.187 1.00 1.10 C ATOM 32 C THR A 3 -10.426 -8.252 0.388 1.00 0.90 C ATOM 33 O THR A 3 -9.752 -7.477 -0.292 1.00 0.87 O ATOM 34 CB THR A 3 -11.448 -9.260 -1.711 1.00 1.27 C ATOM 35 OG1 THR A 3 -12.659 -9.874 -2.224 1.00 1.70 O ATOM 36 CG2 THR A 3 -10.271 -10.203 -1.968 1.00 1.78 C ATOM 37 H THR A 3 -12.657 -7.194 -0.107 1.00 1.46 H ATOM 38 HA THR A 3 -11.768 -9.915 0.346 1.00 1.16 H ATOM 39 HB THR A 3 -11.282 -8.319 -2.217 1.00 1.61 H ATOM 40 HG1 THR A 3 -12.800 -10.647 -1.650 1.00 2.16 H ATOM 41 HG21 THR A 3 -10.440 -11.141 -1.457 1.00 2.24 H ATOM 42 HG22 THR A 3 -9.362 -9.752 -1.598 1.00 2.32 H ATOM 43 HG23 THR A 3 -10.174 -10.384 -3.029 1.00 2.10 H ATOM 44 N LEU A 4 -10.272 -8.387 1.676 1.00 0.86 N ATOM 45 CA LEU A 4 -9.255 -7.687 2.413 1.00 0.72 C ATOM 46 C LEU A 4 -7.907 -8.307 2.177 1.00 0.67 C ATOM 47 O LEU A 4 -7.604 -9.376 2.711 1.00 0.83 O ATOM 48 CB LEU A 4 -9.567 -7.627 3.930 1.00 0.71 C ATOM 49 CG LEU A 4 -10.671 -6.648 4.407 1.00 0.87 C ATOM 50 CD1 LEU A 4 -12.045 -6.994 3.856 1.00 0.80 C ATOM 51 CD2 LEU A 4 -10.709 -6.594 5.927 1.00 1.75 C ATOM 52 H LEU A 4 -10.832 -9.047 2.147 1.00 1.00 H ATOM 53 HA LEU A 4 -9.225 -6.675 2.035 1.00 0.73 H ATOM 54 HB2 LEU A 4 -9.851 -8.620 4.244 1.00 0.79 H ATOM 55 HB3 LEU A 4 -8.649 -7.364 4.438 1.00 0.64 H ATOM 56 HG LEU A 4 -10.423 -5.659 4.051 1.00 1.34 H ATOM 57 HD11 LEU A 4 -12.761 -6.270 4.219 1.00 1.23 H ATOM 58 HD12 LEU A 4 -12.327 -7.985 4.182 1.00 1.38 H ATOM 59 HD13 LEU A 4 -12.013 -6.963 2.777 1.00 1.46 H ATOM 60 HD21 LEU A 4 -11.485 -5.913 6.244 1.00 2.19 H ATOM 61 HD22 LEU A 4 -9.754 -6.243 6.293 1.00 2.26 H ATOM 62 HD23 LEU A 4 -10.909 -7.578 6.323 1.00 2.25 H ATOM 63 N LEU A 5 -7.140 -7.680 1.312 1.00 0.55 N ATOM 64 CA LEU A 5 -5.786 -8.103 1.057 1.00 0.51 C ATOM 65 C LEU A 5 -4.977 -8.021 2.333 1.00 0.46 C ATOM 66 O LEU A 5 -5.060 -7.029 3.086 1.00 0.50 O ATOM 67 CB LEU A 5 -5.080 -7.280 -0.056 1.00 0.53 C ATOM 68 CG LEU A 5 -4.749 -5.786 0.212 1.00 0.62 C ATOM 69 CD1 LEU A 5 -3.746 -5.291 -0.804 1.00 0.66 C ATOM 70 CD2 LEU A 5 -5.987 -4.899 0.149 1.00 0.95 C ATOM 71 H LEU A 5 -7.533 -6.944 0.805 1.00 0.61 H ATOM 72 HA LEU A 5 -5.824 -9.139 0.755 1.00 0.58 H ATOM 73 HB2 LEU A 5 -4.147 -7.774 -0.280 1.00 0.53 H ATOM 74 HB3 LEU A 5 -5.698 -7.328 -0.941 1.00 0.60 H ATOM 75 HG LEU A 5 -4.304 -5.695 1.192 1.00 0.90 H ATOM 76 HD11 LEU A 5 -3.570 -4.237 -0.647 1.00 1.08 H ATOM 77 HD12 LEU A 5 -4.128 -5.452 -1.801 1.00 1.41 H ATOM 78 HD13 LEU A 5 -2.813 -5.821 -0.691 1.00 1.22 H ATOM 79 HD21 LEU A 5 -6.646 -5.118 0.975 1.00 1.46 H ATOM 80 HD22 LEU A 5 -6.499 -5.070 -0.787 1.00 1.57 H ATOM 81 HD23 LEU A 5 -5.682 -3.865 0.197 1.00 1.37 H ATOM 82 N THR A 6 -4.250 -9.048 2.598 1.00 0.47 N ATOM 83 CA THR A 6 -3.409 -9.092 3.738 1.00 0.49 C ATOM 84 C THR A 6 -2.035 -8.504 3.404 1.00 0.40 C ATOM 85 O THR A 6 -1.819 -7.995 2.283 1.00 0.38 O ATOM 86 CB THR A 6 -3.289 -10.527 4.281 1.00 0.70 C ATOM 87 OG1 THR A 6 -2.901 -11.420 3.210 1.00 0.82 O ATOM 88 CG2 THR A 6 -4.614 -10.984 4.885 1.00 0.93 C ATOM 89 H THR A 6 -4.283 -9.830 2.002 1.00 0.54 H ATOM 90 HA THR A 6 -3.861 -8.472 4.496 1.00 0.55 H ATOM 91 HB THR A 6 -2.526 -10.540 5.045 1.00 0.73 H ATOM 92 HG1 THR A 6 -2.240 -12.029 3.580 1.00 1.33 H ATOM 93 HG21 THR A 6 -4.514 -11.989 5.265 1.00 1.33 H ATOM 94 HG22 THR A 6 -5.384 -10.957 4.126 1.00 1.32 H ATOM 95 HG23 THR A 6 -4.888 -10.320 5.691 1.00 1.55 H ATOM 96 N THR A 7 -1.101 -8.612 4.314 1.00 0.44 N ATOM 97 CA THR A 7 0.203 -8.060 4.120 1.00 0.42 C ATOM 98 C THR A 7 0.956 -8.873 3.069 1.00 0.37 C ATOM 99 O THR A 7 1.805 -8.347 2.348 1.00 0.39 O ATOM 100 CB THR A 7 0.978 -8.080 5.431 1.00 0.50 C ATOM 101 OG1 THR A 7 0.092 -7.726 6.499 1.00 0.58 O ATOM 102 CG2 THR A 7 2.093 -7.064 5.378 1.00 0.54 C ATOM 103 H THR A 7 -1.246 -9.068 5.173 1.00 0.52 H ATOM 104 HA THR A 7 0.102 -7.038 3.787 1.00 0.44 H ATOM 105 HB THR A 7 1.396 -9.062 5.594 1.00 0.53 H ATOM 106 HG1 THR A 7 0.481 -8.112 7.297 1.00 0.94 H ATOM 107 HG21 THR A 7 1.655 -6.096 5.179 1.00 1.06 H ATOM 108 HG22 THR A 7 2.777 -7.315 4.582 1.00 1.24 H ATOM 109 HG23 THR A 7 2.617 -7.034 6.321 1.00 1.08 H ATOM 110 N ASP A 8 0.575 -10.145 2.958 1.00 0.41 N ATOM 111 CA ASP A 8 1.168 -11.097 2.007 1.00 0.46 C ATOM 112 C ASP A 8 0.992 -10.578 0.596 1.00 0.42 C ATOM 113 O ASP A 8 1.893 -10.654 -0.242 1.00 0.47 O ATOM 114 CB ASP A 8 0.472 -12.468 2.101 1.00 0.62 C ATOM 115 CG ASP A 8 0.365 -13.007 3.505 1.00 1.41 C ATOM 116 OD1 ASP A 8 1.341 -13.596 4.020 1.00 1.98 O ATOM 117 OD2 ASP A 8 -0.716 -12.840 4.122 1.00 2.01 O ATOM 118 H ASP A 8 -0.131 -10.450 3.567 1.00 0.48 H ATOM 119 HA ASP A 8 2.217 -11.215 2.235 1.00 0.52 H ATOM 120 HB2 ASP A 8 -0.529 -12.375 1.707 1.00 0.86 H ATOM 121 HB3 ASP A 8 1.022 -13.177 1.500 1.00 1.09 H ATOM 122 N ASP A 9 -0.166 -10.017 0.354 1.00 0.41 N ATOM 123 CA ASP A 9 -0.505 -9.500 -0.952 1.00 0.46 C ATOM 124 C ASP A 9 0.068 -8.105 -1.127 1.00 0.40 C ATOM 125 O ASP A 9 0.580 -7.762 -2.194 1.00 0.46 O ATOM 126 CB ASP A 9 -2.017 -9.488 -1.148 1.00 0.54 C ATOM 127 CG ASP A 9 -2.407 -9.102 -2.548 1.00 0.98 C ATOM 128 OD1 ASP A 9 -2.234 -9.946 -3.465 1.00 1.21 O ATOM 129 OD2 ASP A 9 -2.920 -7.995 -2.757 1.00 1.83 O ATOM 130 H ASP A 9 -0.818 -9.939 1.083 1.00 0.43 H ATOM 131 HA ASP A 9 -0.061 -10.152 -1.690 1.00 0.53 H ATOM 132 HB2 ASP A 9 -2.418 -10.467 -0.943 1.00 1.16 H ATOM 133 HB3 ASP A 9 -2.471 -8.807 -0.448 1.00 0.89 H ATOM 134 N LEU A 10 0.036 -7.321 -0.044 1.00 0.36 N ATOM 135 CA LEU A 10 0.585 -5.962 -0.040 1.00 0.35 C ATOM 136 C LEU A 10 2.066 -5.972 -0.427 1.00 0.33 C ATOM 137 O LEU A 10 2.520 -5.105 -1.177 1.00 0.36 O ATOM 138 CB LEU A 10 0.415 -5.307 1.338 1.00 0.37 C ATOM 139 CG LEU A 10 0.879 -3.848 1.450 1.00 0.41 C ATOM 140 CD1 LEU A 10 0.040 -2.937 0.564 1.00 0.51 C ATOM 141 CD2 LEU A 10 0.841 -3.378 2.894 1.00 0.48 C ATOM 142 H LEU A 10 -0.401 -7.663 0.766 1.00 0.35 H ATOM 143 HA LEU A 10 0.042 -5.383 -0.771 1.00 0.39 H ATOM 144 HB2 LEU A 10 -0.630 -5.359 1.607 1.00 0.42 H ATOM 145 HB3 LEU A 10 0.974 -5.893 2.051 1.00 0.36 H ATOM 146 HG LEU A 10 1.900 -3.790 1.101 1.00 0.39 H ATOM 147 HD11 LEU A 10 0.382 -1.917 0.663 1.00 1.18 H ATOM 148 HD12 LEU A 10 -0.996 -3.001 0.861 1.00 0.95 H ATOM 149 HD13 LEU A 10 0.132 -3.249 -0.466 1.00 1.26 H ATOM 150 HD21 LEU A 10 1.495 -3.994 3.493 1.00 1.12 H ATOM 151 HD22 LEU A 10 -0.167 -3.448 3.277 1.00 1.06 H ATOM 152 HD23 LEU A 10 1.175 -2.353 2.942 1.00 1.05 H ATOM 153 N ARG A 11 2.805 -6.974 0.088 1.00 0.33 N ATOM 154 CA ARG A 11 4.236 -7.156 -0.222 1.00 0.37 C ATOM 155 C ARG A 11 4.450 -7.211 -1.732 1.00 0.39 C ATOM 156 O ARG A 11 5.350 -6.570 -2.260 1.00 0.45 O ATOM 157 CB ARG A 11 4.779 -8.461 0.393 1.00 0.45 C ATOM 158 CG ARG A 11 4.798 -8.521 1.906 1.00 0.72 C ATOM 159 CD ARG A 11 5.178 -9.913 2.394 1.00 0.63 C ATOM 160 NE ARG A 11 5.121 -10.036 3.863 1.00 1.12 N ATOM 161 CZ ARG A 11 4.390 -10.958 4.528 1.00 1.36 C ATOM 162 NH1 ARG A 11 3.757 -11.916 3.859 1.00 1.47 N ATOM 163 NH2 ARG A 11 4.346 -10.950 5.854 1.00 2.27 N ATOM 164 H ARG A 11 2.360 -7.596 0.708 1.00 0.33 H ATOM 165 HA ARG A 11 4.785 -6.319 0.186 1.00 0.41 H ATOM 166 HB2 ARG A 11 4.168 -9.281 0.048 1.00 0.92 H ATOM 167 HB3 ARG A 11 5.789 -8.598 0.038 1.00 1.06 H ATOM 168 HG2 ARG A 11 5.529 -7.810 2.263 1.00 1.30 H ATOM 169 HG3 ARG A 11 3.820 -8.264 2.286 1.00 1.20 H ATOM 170 HD2 ARG A 11 4.496 -10.631 1.960 1.00 1.17 H ATOM 171 HD3 ARG A 11 6.183 -10.132 2.066 1.00 1.14 H ATOM 172 HE ARG A 11 5.669 -9.377 4.344 1.00 1.86 H ATOM 173 HH11 ARG A 11 3.797 -12.008 2.855 1.00 1.69 H ATOM 174 HH12 ARG A 11 3.191 -12.610 4.318 1.00 1.97 H ATOM 175 HH21 ARG A 11 4.842 -10.275 6.411 1.00 2.91 H ATOM 176 HH22 ARG A 11 3.819 -11.629 6.377 1.00 2.56 H ATOM 177 N ARG A 12 3.567 -7.934 -2.410 1.00 0.40 N ATOM 178 CA ARG A 12 3.657 -8.140 -3.846 1.00 0.48 C ATOM 179 C ARG A 12 3.492 -6.826 -4.577 1.00 0.47 C ATOM 180 O ARG A 12 4.418 -6.365 -5.231 1.00 0.50 O ATOM 181 CB ARG A 12 2.585 -9.121 -4.322 1.00 0.56 C ATOM 182 CG ARG A 12 2.646 -10.483 -3.671 1.00 0.94 C ATOM 183 CD ARG A 12 1.523 -11.369 -4.173 1.00 1.18 C ATOM 184 NE ARG A 12 1.567 -12.704 -3.564 1.00 1.76 N ATOM 185 CZ ARG A 12 1.044 -13.813 -4.110 1.00 2.29 C ATOM 186 NH1 ARG A 12 0.429 -13.759 -5.298 1.00 2.31 N ATOM 187 NH2 ARG A 12 1.146 -14.968 -3.463 1.00 3.30 N ATOM 188 H ARG A 12 2.803 -8.313 -1.928 1.00 0.37 H ATOM 189 HA ARG A 12 4.630 -8.550 -4.067 1.00 0.54 H ATOM 190 HB2 ARG A 12 1.614 -8.698 -4.111 1.00 0.67 H ATOM 191 HB3 ARG A 12 2.681 -9.252 -5.390 1.00 0.85 H ATOM 192 HG2 ARG A 12 3.594 -10.945 -3.899 1.00 1.27 H ATOM 193 HG3 ARG A 12 2.546 -10.363 -2.603 1.00 1.35 H ATOM 194 HD2 ARG A 12 0.581 -10.900 -3.929 1.00 1.87 H ATOM 195 HD3 ARG A 12 1.610 -11.466 -5.247 1.00 1.53 H ATOM 196 HE ARG A 12 2.021 -12.743 -2.690 1.00 2.26 H ATOM 197 HH11 ARG A 12 0.336 -12.903 -5.814 1.00 2.24 H ATOM 198 HH12 ARG A 12 0.033 -14.578 -5.735 1.00 2.84 H ATOM 199 HH21 ARG A 12 1.612 -15.007 -2.570 1.00 3.81 H ATOM 200 HH22 ARG A 12 0.769 -15.839 -3.808 1.00 3.77 H ATOM 201 N ALA A 13 2.337 -6.193 -4.383 1.00 0.47 N ATOM 202 CA ALA A 13 1.985 -4.947 -5.068 1.00 0.53 C ATOM 203 C ALA A 13 3.017 -3.848 -4.832 1.00 0.46 C ATOM 204 O ALA A 13 3.324 -3.053 -5.740 1.00 0.48 O ATOM 205 CB ALA A 13 0.618 -4.480 -4.622 1.00 0.63 C ATOM 206 H ALA A 13 1.690 -6.590 -3.758 1.00 0.47 H ATOM 207 HA ALA A 13 1.939 -5.156 -6.126 1.00 0.61 H ATOM 208 HB1 ALA A 13 0.654 -4.231 -3.571 1.00 1.11 H ATOM 209 HB2 ALA A 13 -0.108 -5.265 -4.786 1.00 1.26 H ATOM 210 HB3 ALA A 13 0.335 -3.604 -5.186 1.00 1.21 H ATOM 211 N LEU A 14 3.555 -3.817 -3.627 1.00 0.42 N ATOM 212 CA LEU A 14 4.563 -2.848 -3.244 1.00 0.39 C ATOM 213 C LEU A 14 5.836 -3.065 -4.094 1.00 0.40 C ATOM 214 O LEU A 14 6.287 -2.157 -4.813 1.00 0.46 O ATOM 215 CB LEU A 14 4.864 -3.012 -1.741 1.00 0.45 C ATOM 216 CG LEU A 14 5.680 -1.914 -1.052 1.00 0.54 C ATOM 217 CD1 LEU A 14 4.913 -0.593 -1.030 1.00 0.44 C ATOM 218 CD2 LEU A 14 6.051 -2.338 0.360 1.00 1.00 C ATOM 219 H LEU A 14 3.250 -4.471 -2.960 1.00 0.44 H ATOM 220 HA LEU A 14 4.177 -1.856 -3.427 1.00 0.41 H ATOM 221 HB2 LEU A 14 3.918 -3.085 -1.228 1.00 0.73 H ATOM 222 HB3 LEU A 14 5.387 -3.948 -1.612 1.00 0.77 H ATOM 223 HG LEU A 14 6.593 -1.755 -1.608 1.00 0.97 H ATOM 224 HD11 LEU A 14 5.501 0.169 -0.542 1.00 1.04 H ATOM 225 HD12 LEU A 14 3.984 -0.721 -0.496 1.00 1.18 H ATOM 226 HD13 LEU A 14 4.698 -0.286 -2.043 1.00 1.11 H ATOM 227 HD21 LEU A 14 6.633 -3.246 0.324 1.00 1.59 H ATOM 228 HD22 LEU A 14 5.151 -2.508 0.932 1.00 1.48 H ATOM 229 HD23 LEU A 14 6.634 -1.558 0.828 1.00 1.54 H ATOM 230 N VAL A 15 6.339 -4.302 -4.094 1.00 0.44 N ATOM 231 CA VAL A 15 7.562 -4.643 -4.823 1.00 0.53 C ATOM 232 C VAL A 15 7.330 -4.618 -6.347 1.00 0.55 C ATOM 233 O VAL A 15 8.256 -4.393 -7.120 1.00 0.64 O ATOM 234 CB VAL A 15 8.157 -6.021 -4.372 1.00 0.61 C ATOM 235 CG1 VAL A 15 9.462 -6.349 -5.102 1.00 0.74 C ATOM 236 CG2 VAL A 15 8.395 -6.026 -2.875 1.00 0.64 C ATOM 237 H VAL A 15 5.871 -5.008 -3.596 1.00 0.47 H ATOM 238 HA VAL A 15 8.277 -3.867 -4.592 1.00 0.60 H ATOM 239 HB VAL A 15 7.436 -6.793 -4.603 1.00 0.63 H ATOM 240 HG11 VAL A 15 9.276 -6.387 -6.165 1.00 1.14 H ATOM 241 HG12 VAL A 15 9.843 -7.301 -4.762 1.00 1.39 H ATOM 242 HG13 VAL A 15 10.189 -5.578 -4.891 1.00 1.29 H ATOM 243 HG21 VAL A 15 7.457 -5.863 -2.367 1.00 1.14 H ATOM 244 HG22 VAL A 15 9.080 -5.233 -2.618 1.00 1.34 H ATOM 245 HG23 VAL A 15 8.808 -6.977 -2.577 1.00 1.13 H ATOM 246 N GLU A 16 6.096 -4.816 -6.772 1.00 0.59 N ATOM 247 CA GLU A 16 5.746 -4.735 -8.192 1.00 0.69 C ATOM 248 C GLU A 16 5.849 -3.304 -8.694 1.00 0.65 C ATOM 249 O GLU A 16 6.166 -3.064 -9.857 1.00 0.77 O ATOM 250 CB GLU A 16 4.343 -5.282 -8.465 1.00 0.89 C ATOM 251 CG GLU A 16 4.205 -6.781 -8.279 1.00 1.11 C ATOM 252 CD GLU A 16 2.801 -7.262 -8.535 1.00 1.54 C ATOM 253 OE1 GLU A 16 2.393 -7.334 -9.709 1.00 1.95 O ATOM 254 OE2 GLU A 16 2.088 -7.605 -7.578 1.00 2.18 O ATOM 255 H GLU A 16 5.401 -5.059 -6.117 1.00 0.60 H ATOM 256 HA GLU A 16 6.464 -5.333 -8.735 1.00 0.80 H ATOM 257 HB2 GLU A 16 3.643 -4.797 -7.800 1.00 0.91 H ATOM 258 HB3 GLU A 16 4.071 -5.043 -9.483 1.00 0.98 H ATOM 259 HG2 GLU A 16 4.873 -7.286 -8.960 1.00 1.44 H ATOM 260 HG3 GLU A 16 4.475 -7.025 -7.262 1.00 1.45 H ATOM 261 N SER A 17 5.611 -2.362 -7.812 1.00 0.59 N ATOM 262 CA SER A 17 5.658 -0.963 -8.166 1.00 0.64 C ATOM 263 C SER A 17 7.101 -0.455 -8.170 1.00 0.74 C ATOM 264 O SER A 17 7.505 0.322 -9.047 1.00 1.04 O ATOM 265 CB SER A 17 4.817 -0.176 -7.181 1.00 0.68 C ATOM 266 OG SER A 17 3.495 -0.691 -7.133 1.00 1.27 O ATOM 267 H SER A 17 5.392 -2.615 -6.888 1.00 0.58 H ATOM 268 HA SER A 17 5.234 -0.850 -9.153 1.00 0.75 H ATOM 269 HB2 SER A 17 5.257 -0.249 -6.198 1.00 1.10 H ATOM 270 HB3 SER A 17 4.784 0.857 -7.490 1.00 1.16 H ATOM 271 HG SER A 17 3.501 -1.569 -6.725 1.00 1.65 H ATOM 272 N ALA A 18 7.877 -0.908 -7.197 1.00 0.70 N ATOM 273 CA ALA A 18 9.271 -0.527 -7.101 1.00 0.87 C ATOM 274 C ALA A 18 10.100 -1.280 -8.140 1.00 1.05 C ATOM 275 O ALA A 18 11.070 -0.756 -8.694 1.00 1.57 O ATOM 276 CB ALA A 18 9.787 -0.787 -5.703 1.00 0.95 C ATOM 277 H ALA A 18 7.491 -1.497 -6.512 1.00 0.73 H ATOM 278 HA ALA A 18 9.336 0.533 -7.302 1.00 1.09 H ATOM 279 HB1 ALA A 18 10.812 -0.459 -5.625 1.00 1.36 H ATOM 280 HB2 ALA A 18 9.727 -1.845 -5.496 1.00 1.48 H ATOM 281 HB3 ALA A 18 9.182 -0.248 -4.990 1.00 1.41 H ATOM 282 N GLY A 19 9.721 -2.505 -8.389 1.00 0.98 N ATOM 283 CA GLY A 19 10.365 -3.303 -9.387 1.00 1.32 C ATOM 284 C GLY A 19 11.482 -4.135 -8.824 1.00 1.47 C ATOM 285 O GLY A 19 11.306 -5.327 -8.545 1.00 1.85 O ATOM 286 H GLY A 19 8.990 -2.905 -7.869 1.00 1.01 H ATOM 287 HA2 GLY A 19 9.637 -3.961 -9.840 1.00 1.77 H ATOM 288 HA3 GLY A 19 10.768 -2.651 -10.148 1.00 1.79 H ATOM 289 N GLU A 20 12.603 -3.501 -8.608 1.00 1.96 N ATOM 290 CA GLU A 20 13.806 -4.180 -8.184 1.00 2.68 C ATOM 291 C GLU A 20 14.033 -4.080 -6.676 1.00 2.91 C ATOM 292 O GLU A 20 14.433 -5.055 -6.025 1.00 3.66 O ATOM 293 CB GLU A 20 14.993 -3.612 -8.966 1.00 3.52 C ATOM 294 CG GLU A 20 16.339 -4.167 -8.574 1.00 4.20 C ATOM 295 CD GLU A 20 17.439 -3.711 -9.489 1.00 4.87 C ATOM 296 OE1 GLU A 20 17.866 -2.554 -9.395 1.00 5.31 O ATOM 297 OE2 GLU A 20 17.892 -4.526 -10.331 1.00 5.27 O ATOM 298 H GLU A 20 12.606 -2.530 -8.746 1.00 2.18 H ATOM 299 HA GLU A 20 13.706 -5.222 -8.444 1.00 2.87 H ATOM 300 HB2 GLU A 20 14.842 -3.828 -10.013 1.00 3.77 H ATOM 301 HB3 GLU A 20 15.014 -2.540 -8.834 1.00 3.84 H ATOM 302 HG2 GLU A 20 16.574 -3.846 -7.569 1.00 4.47 H ATOM 303 HG3 GLU A 20 16.294 -5.246 -8.603 1.00 4.44 H ATOM 304 N THR A 21 13.759 -2.940 -6.137 1.00 2.73 N ATOM 305 CA THR A 21 14.021 -2.642 -4.759 1.00 3.25 C ATOM 306 C THR A 21 12.854 -3.038 -3.842 1.00 3.14 C ATOM 307 O THR A 21 11.838 -2.351 -3.804 1.00 3.43 O ATOM 308 CB THR A 21 14.262 -1.133 -4.667 1.00 3.93 C ATOM 309 OG1 THR A 21 13.225 -0.466 -5.408 1.00 4.30 O ATOM 310 CG2 THR A 21 15.608 -0.769 -5.261 1.00 4.40 C ATOM 311 H THR A 21 13.354 -2.218 -6.662 1.00 2.62 H ATOM 312 HA THR A 21 14.930 -3.135 -4.448 1.00 3.74 H ATOM 313 HB THR A 21 14.226 -0.829 -3.631 1.00 4.40 H ATOM 314 HG1 THR A 21 12.423 -0.546 -4.876 1.00 4.42 H ATOM 315 HG21 THR A 21 15.627 -1.057 -6.302 1.00 4.75 H ATOM 316 HG22 THR A 21 16.390 -1.290 -4.729 1.00 4.61 H ATOM 317 HG23 THR A 21 15.759 0.296 -5.180 1.00 4.66 H ATOM 318 N ASP A 22 12.974 -4.174 -3.144 1.00 3.24 N ATOM 319 CA ASP A 22 11.928 -4.571 -2.172 1.00 3.46 C ATOM 320 C ASP A 22 12.080 -3.768 -0.877 1.00 3.15 C ATOM 321 O ASP A 22 11.238 -3.825 0.015 1.00 3.71 O ATOM 322 CB ASP A 22 11.903 -6.099 -1.889 1.00 4.08 C ATOM 323 CG ASP A 22 13.080 -6.634 -1.098 1.00 4.82 C ATOM 324 OD1 ASP A 22 14.254 -6.375 -1.479 1.00 5.14 O ATOM 325 OD2 ASP A 22 12.872 -7.254 -0.035 1.00 5.44 O ATOM 326 H ASP A 22 13.745 -4.768 -3.275 1.00 3.52 H ATOM 327 HA ASP A 22 10.990 -4.273 -2.622 1.00 3.87 H ATOM 328 HB2 ASP A 22 11.005 -6.334 -1.338 1.00 4.24 H ATOM 329 HB3 ASP A 22 11.861 -6.619 -2.836 1.00 4.35 H ATOM 330 N GLY A 23 13.178 -3.026 -0.793 1.00 2.69 N ATOM 331 CA GLY A 23 13.382 -2.088 0.286 1.00 2.70 C ATOM 332 C GLY A 23 14.345 -2.578 1.337 1.00 2.24 C ATOM 333 O GLY A 23 15.542 -2.273 1.304 1.00 2.70 O ATOM 334 H GLY A 23 13.864 -3.142 -1.479 1.00 2.74 H ATOM 335 HA2 GLY A 23 13.762 -1.166 -0.126 1.00 3.05 H ATOM 336 HA3 GLY A 23 12.428 -1.890 0.750 1.00 3.22 H ATOM 337 N THR A 24 13.831 -3.345 2.235 1.00 1.89 N ATOM 338 CA THR A 24 14.566 -3.859 3.357 1.00 1.88 C ATOM 339 C THR A 24 13.945 -5.215 3.693 1.00 1.65 C ATOM 340 O THR A 24 13.464 -5.907 2.779 1.00 2.03 O ATOM 341 CB THR A 24 14.487 -2.839 4.573 1.00 2.50 C ATOM 342 OG1 THR A 24 15.171 -3.330 5.753 1.00 3.09 O ATOM 343 CG2 THR A 24 13.038 -2.499 4.923 1.00 2.87 C ATOM 344 H THR A 24 12.897 -3.623 2.125 1.00 2.13 H ATOM 345 HA THR A 24 15.594 -4.000 3.058 1.00 2.24 H ATOM 346 HB THR A 24 14.987 -1.932 4.264 1.00 3.01 H ATOM 347 HG1 THR A 24 15.925 -2.750 5.954 1.00 3.52 H ATOM 348 HG21 THR A 24 12.510 -3.400 5.200 1.00 3.16 H ATOM 349 HG22 THR A 24 12.554 -2.052 4.067 1.00 3.32 H ATOM 350 HG23 THR A 24 13.020 -1.802 5.748 1.00 3.05 H ATOM 351 N ASP A 25 13.954 -5.605 4.938 1.00 1.52 N ATOM 352 CA ASP A 25 13.266 -6.802 5.336 1.00 1.56 C ATOM 353 C ASP A 25 11.778 -6.548 5.273 1.00 1.29 C ATOM 354 O ASP A 25 11.238 -5.737 6.042 1.00 1.63 O ATOM 355 CB ASP A 25 13.657 -7.266 6.733 1.00 2.14 C ATOM 356 CG ASP A 25 12.854 -8.476 7.138 1.00 2.62 C ATOM 357 OD1 ASP A 25 13.126 -9.581 6.600 1.00 3.01 O ATOM 358 OD2 ASP A 25 11.924 -8.338 7.959 1.00 3.06 O ATOM 359 H ASP A 25 14.445 -5.051 5.587 1.00 1.75 H ATOM 360 HA ASP A 25 13.511 -7.571 4.618 1.00 1.73 H ATOM 361 HB2 ASP A 25 14.705 -7.525 6.746 1.00 2.49 H ATOM 362 HB3 ASP A 25 13.467 -6.475 7.444 1.00 2.44 H ATOM 363 N LEU A 26 11.143 -7.176 4.330 1.00 1.14 N ATOM 364 CA LEU A 26 9.731 -7.012 4.101 1.00 0.93 C ATOM 365 C LEU A 26 9.054 -8.357 4.385 1.00 0.97 C ATOM 366 O LEU A 26 7.860 -8.547 4.132 1.00 1.44 O ATOM 367 CB LEU A 26 9.531 -6.644 2.620 1.00 1.11 C ATOM 368 CG LEU A 26 8.324 -5.781 2.278 1.00 0.87 C ATOM 369 CD1 LEU A 26 8.541 -4.363 2.782 1.00 1.38 C ATOM 370 CD2 LEU A 26 8.061 -5.787 0.784 1.00 1.53 C ATOM 371 H LEU A 26 11.644 -7.771 3.724 1.00 1.49 H ATOM 372 HA LEU A 26 9.333 -6.231 4.731 1.00 0.96 H ATOM 373 HB2 LEU A 26 10.418 -6.128 2.282 1.00 1.64 H ATOM 374 HB3 LEU A 26 9.449 -7.569 2.068 1.00 1.87 H ATOM 375 HG LEU A 26 7.455 -6.175 2.784 1.00 1.73 H ATOM 376 HD11 LEU A 26 7.684 -3.755 2.538 1.00 1.91 H ATOM 377 HD12 LEU A 26 9.423 -3.951 2.314 1.00 1.94 H ATOM 378 HD13 LEU A 26 8.682 -4.381 3.853 1.00 1.97 H ATOM 379 HD21 LEU A 26 7.864 -6.796 0.454 1.00 2.11 H ATOM 380 HD22 LEU A 26 8.926 -5.398 0.268 1.00 1.91 H ATOM 381 HD23 LEU A 26 7.206 -5.163 0.569 1.00 2.02 H ATOM 382 N SER A 27 9.841 -9.265 4.948 1.00 1.01 N ATOM 383 CA SER A 27 9.452 -10.645 5.174 1.00 1.18 C ATOM 384 C SER A 27 8.304 -10.770 6.170 1.00 1.27 C ATOM 385 O SER A 27 7.301 -11.422 5.888 1.00 1.98 O ATOM 386 CB SER A 27 10.653 -11.411 5.698 1.00 1.52 C ATOM 387 OG SER A 27 11.817 -11.082 4.950 1.00 2.26 O ATOM 388 H SER A 27 10.739 -8.996 5.236 1.00 1.26 H ATOM 389 HA SER A 27 9.163 -11.083 4.232 1.00 1.31 H ATOM 390 HB2 SER A 27 10.819 -11.160 6.736 1.00 1.83 H ATOM 391 HB3 SER A 27 10.469 -12.471 5.604 1.00 1.77 H ATOM 392 HG SER A 27 12.390 -10.617 5.587 1.00 2.55 H ATOM 393 N GLY A 28 8.453 -10.146 7.318 1.00 1.18 N ATOM 394 CA GLY A 28 7.462 -10.281 8.338 1.00 1.46 C ATOM 395 C GLY A 28 6.506 -9.133 8.360 1.00 1.19 C ATOM 396 O GLY A 28 5.509 -9.126 7.625 1.00 1.73 O ATOM 397 H GLY A 28 9.233 -9.574 7.473 1.00 1.42 H ATOM 398 HA2 GLY A 28 6.906 -11.191 8.170 1.00 1.84 H ATOM 399 HA3 GLY A 28 7.955 -10.340 9.297 1.00 1.75 H ATOM 400 N ASP A 29 6.823 -8.136 9.148 1.00 0.90 N ATOM 401 CA ASP A 29 5.944 -7.006 9.340 1.00 0.83 C ATOM 402 C ASP A 29 6.689 -5.737 9.130 1.00 0.79 C ATOM 403 O ASP A 29 7.753 -5.517 9.702 1.00 1.33 O ATOM 404 CB ASP A 29 5.317 -6.983 10.735 1.00 1.20 C ATOM 405 CG ASP A 29 4.443 -8.165 11.018 1.00 1.95 C ATOM 406 OD1 ASP A 29 3.267 -8.168 10.615 1.00 2.68 O ATOM 407 OD2 ASP A 29 4.908 -9.105 11.692 1.00 2.44 O ATOM 408 H ASP A 29 7.704 -8.123 9.585 1.00 1.26 H ATOM 409 HA ASP A 29 5.152 -7.069 8.608 1.00 0.92 H ATOM 410 HB2 ASP A 29 6.104 -6.966 11.474 1.00 1.67 H ATOM 411 HB3 ASP A 29 4.728 -6.083 10.835 1.00 1.46 H ATOM 412 N PHE A 30 6.123 -4.907 8.339 1.00 0.42 N ATOM 413 CA PHE A 30 6.667 -3.637 7.996 1.00 0.36 C ATOM 414 C PHE A 30 5.545 -2.636 8.021 1.00 0.32 C ATOM 415 O PHE A 30 5.653 -1.551 7.492 1.00 0.35 O ATOM 416 CB PHE A 30 7.271 -3.718 6.595 1.00 0.37 C ATOM 417 CG PHE A 30 6.297 -4.208 5.535 1.00 0.35 C ATOM 418 CD1 PHE A 30 5.502 -3.324 4.823 1.00 0.38 C ATOM 419 CD2 PHE A 30 6.190 -5.559 5.256 1.00 0.40 C ATOM 420 CE1 PHE A 30 4.626 -3.775 3.859 1.00 0.42 C ATOM 421 CE2 PHE A 30 5.322 -6.015 4.294 1.00 0.46 C ATOM 422 CZ PHE A 30 4.538 -5.122 3.591 1.00 0.46 C ATOM 423 H PHE A 30 5.268 -5.123 7.923 1.00 0.67 H ATOM 424 HA PHE A 30 7.435 -3.363 8.704 1.00 0.43 H ATOM 425 HB2 PHE A 30 7.635 -2.735 6.331 1.00 0.40 H ATOM 426 HB3 PHE A 30 8.112 -4.394 6.625 1.00 0.41 H ATOM 427 HD1 PHE A 30 5.567 -2.269 5.047 1.00 0.43 H ATOM 428 HD2 PHE A 30 6.800 -6.256 5.811 1.00 0.43 H ATOM 429 HE1 PHE A 30 4.013 -3.073 3.314 1.00 0.47 H ATOM 430 HE2 PHE A 30 5.252 -7.072 4.093 1.00 0.55 H ATOM 431 HZ PHE A 30 3.856 -5.483 2.834 1.00 0.53 H ATOM 432 N LEU A 31 4.478 -3.012 8.670 1.00 0.35 N ATOM 433 CA LEU A 31 3.287 -2.207 8.693 1.00 0.36 C ATOM 434 C LEU A 31 3.417 -1.113 9.720 1.00 0.39 C ATOM 435 O LEU A 31 2.912 -0.017 9.527 1.00 0.46 O ATOM 436 CB LEU A 31 2.078 -3.079 8.972 1.00 0.40 C ATOM 437 CG LEU A 31 1.831 -4.182 7.952 1.00 0.39 C ATOM 438 CD1 LEU A 31 0.686 -5.050 8.388 1.00 0.45 C ATOM 439 CD2 LEU A 31 1.555 -3.588 6.578 1.00 0.38 C ATOM 440 H LEU A 31 4.507 -3.837 9.198 1.00 0.44 H ATOM 441 HA LEU A 31 3.171 -1.762 7.713 1.00 0.35 H ATOM 442 HB2 LEU A 31 2.201 -3.531 9.946 1.00 0.44 H ATOM 443 HB3 LEU A 31 1.205 -2.443 8.993 1.00 0.42 H ATOM 444 HG LEU A 31 2.713 -4.804 7.877 1.00 0.39 H ATOM 445 HD11 LEU A 31 -0.205 -4.447 8.482 1.00 0.98 H ATOM 446 HD12 LEU A 31 0.934 -5.504 9.337 1.00 1.10 H ATOM 447 HD13 LEU A 31 0.535 -5.817 7.643 1.00 1.06 H ATOM 448 HD21 LEU A 31 0.682 -2.953 6.627 1.00 1.07 H ATOM 449 HD22 LEU A 31 1.385 -4.388 5.873 1.00 1.11 H ATOM 450 HD23 LEU A 31 2.410 -3.009 6.259 1.00 1.05 H ATOM 451 N ASP A 32 4.100 -1.418 10.809 1.00 0.43 N ATOM 452 CA ASP A 32 4.368 -0.425 11.837 1.00 0.52 C ATOM 453 C ASP A 32 5.688 0.244 11.550 1.00 0.50 C ATOM 454 O ASP A 32 6.072 1.221 12.180 1.00 0.66 O ATOM 455 CB ASP A 32 4.324 -1.020 13.244 1.00 0.69 C ATOM 456 CG ASP A 32 2.929 -1.453 13.641 1.00 1.46 C ATOM 457 OD1 ASP A 32 2.137 -0.599 14.112 1.00 1.95 O ATOM 458 OD2 ASP A 32 2.598 -2.652 13.474 1.00 2.20 O ATOM 459 H ASP A 32 4.434 -2.338 10.929 1.00 0.46 H ATOM 460 HA ASP A 32 3.597 0.326 11.738 1.00 0.59 H ATOM 461 HB2 ASP A 32 4.971 -1.884 13.287 1.00 1.12 H ATOM 462 HB3 ASP A 32 4.673 -0.284 13.952 1.00 1.24 H ATOM 463 N LEU A 33 6.387 -0.318 10.605 1.00 0.42 N ATOM 464 CA LEU A 33 7.557 0.291 10.038 1.00 0.50 C ATOM 465 C LEU A 33 7.061 1.397 9.131 1.00 0.45 C ATOM 466 O LEU A 33 5.995 1.282 8.583 1.00 0.57 O ATOM 467 CB LEU A 33 8.352 -0.751 9.230 1.00 0.66 C ATOM 468 CG LEU A 33 9.179 -1.761 10.022 1.00 0.80 C ATOM 469 CD1 LEU A 33 9.883 -2.714 9.077 1.00 1.52 C ATOM 470 CD2 LEU A 33 10.200 -1.046 10.873 1.00 1.18 C ATOM 471 H LEU A 33 6.074 -1.179 10.262 1.00 0.43 H ATOM 472 HA LEU A 33 8.167 0.707 10.825 1.00 0.61 H ATOM 473 HB2 LEU A 33 7.602 -1.325 8.703 1.00 1.44 H ATOM 474 HB3 LEU A 33 8.967 -0.296 8.473 1.00 1.18 H ATOM 475 HG LEU A 33 8.528 -2.329 10.670 1.00 0.96 H ATOM 476 HD11 LEU A 33 9.145 -3.254 8.504 1.00 1.97 H ATOM 477 HD12 LEU A 33 10.475 -3.415 9.645 1.00 2.01 H ATOM 478 HD13 LEU A 33 10.518 -2.151 8.407 1.00 1.95 H ATOM 479 HD21 LEU A 33 10.791 -1.773 11.408 1.00 1.52 H ATOM 480 HD22 LEU A 33 9.691 -0.394 11.567 1.00 1.91 H ATOM 481 HD23 LEU A 33 10.839 -0.475 10.217 1.00 1.52 H ATOM 482 N ARG A 34 7.770 2.469 9.015 1.00 0.43 N ATOM 483 CA ARG A 34 7.301 3.541 8.160 1.00 0.42 C ATOM 484 C ARG A 34 7.827 3.378 6.745 1.00 0.36 C ATOM 485 O ARG A 34 8.664 2.509 6.480 1.00 0.45 O ATOM 486 CB ARG A 34 7.651 4.914 8.720 1.00 0.58 C ATOM 487 CG ARG A 34 6.752 5.426 9.850 1.00 0.77 C ATOM 488 CD ARG A 34 6.859 4.621 11.139 1.00 1.08 C ATOM 489 NE ARG A 34 6.081 5.243 12.221 1.00 1.82 N ATOM 490 CZ ARG A 34 5.839 4.696 13.422 1.00 2.41 C ATOM 491 NH1 ARG A 34 6.136 3.436 13.659 1.00 2.43 N ATOM 492 NH2 ARG A 34 5.225 5.391 14.354 1.00 3.44 N ATOM 493 H ARG A 34 8.633 2.573 9.476 1.00 0.55 H ATOM 494 HA ARG A 34 6.227 3.449 8.105 1.00 0.45 H ATOM 495 HB2 ARG A 34 8.658 4.864 9.104 1.00 0.77 H ATOM 496 HB3 ARG A 34 7.637 5.626 7.911 1.00 0.78 H ATOM 497 HG2 ARG A 34 7.029 6.445 10.071 1.00 0.95 H ATOM 498 HG3 ARG A 34 5.729 5.406 9.506 1.00 1.06 H ATOM 499 HD2 ARG A 34 6.484 3.621 10.972 1.00 1.67 H ATOM 500 HD3 ARG A 34 7.896 4.577 11.438 1.00 1.45 H ATOM 501 HE ARG A 34 5.778 6.162 12.012 1.00 2.30 H ATOM 502 HH11 ARG A 34 6.534 2.826 12.967 1.00 2.29 H ATOM 503 HH12 ARG A 34 5.987 3.018 14.564 1.00 3.00 H ATOM 504 HH21 ARG A 34 4.914 6.337 14.176 1.00 3.92 H ATOM 505 HH22 ARG A 34 5.048 5.033 15.274 1.00 3.95 H ATOM 506 N PHE A 35 7.363 4.224 5.842 1.00 0.33 N ATOM 507 CA PHE A 35 7.751 4.150 4.440 1.00 0.33 C ATOM 508 C PHE A 35 9.211 4.528 4.279 1.00 0.38 C ATOM 509 O PHE A 35 9.920 4.006 3.411 1.00 0.43 O ATOM 510 CB PHE A 35 6.867 5.050 3.578 1.00 0.34 C ATOM 511 CG PHE A 35 5.416 4.666 3.608 1.00 0.36 C ATOM 512 CD1 PHE A 35 4.979 3.498 3.001 1.00 0.43 C ATOM 513 CD2 PHE A 35 4.487 5.465 4.261 1.00 0.40 C ATOM 514 CE1 PHE A 35 3.648 3.140 3.041 1.00 0.50 C ATOM 515 CE2 PHE A 35 3.155 5.106 4.301 1.00 0.48 C ATOM 516 CZ PHE A 35 2.729 3.969 3.632 1.00 0.51 C ATOM 517 H PHE A 35 6.764 4.948 6.129 1.00 0.40 H ATOM 518 HA PHE A 35 7.615 3.127 4.126 1.00 0.36 H ATOM 519 HB2 PHE A 35 6.945 6.071 3.924 1.00 0.35 H ATOM 520 HB3 PHE A 35 7.203 5.001 2.553 1.00 0.39 H ATOM 521 HD1 PHE A 35 5.690 2.865 2.492 1.00 0.47 H ATOM 522 HD2 PHE A 35 4.810 6.378 4.738 1.00 0.41 H ATOM 523 HE1 PHE A 35 3.316 2.229 2.564 1.00 0.57 H ATOM 524 HE2 PHE A 35 2.442 5.735 4.812 1.00 0.55 H ATOM 525 HZ PHE A 35 1.683 3.699 3.644 1.00 0.58 H ATOM 526 N GLU A 36 9.649 5.423 5.133 1.00 0.48 N ATOM 527 CA GLU A 36 11.019 5.858 5.181 1.00 0.62 C ATOM 528 C GLU A 36 11.893 4.692 5.645 1.00 0.63 C ATOM 529 O GLU A 36 12.991 4.468 5.121 1.00 0.72 O ATOM 530 CB GLU A 36 11.191 7.047 6.159 1.00 0.83 C ATOM 531 CG GLU A 36 10.167 8.181 6.010 1.00 1.40 C ATOM 532 CD GLU A 36 8.881 7.955 6.803 1.00 1.83 C ATOM 533 OE1 GLU A 36 8.079 7.065 6.452 1.00 2.73 O ATOM 534 OE2 GLU A 36 8.645 8.693 7.782 1.00 1.89 O ATOM 535 H GLU A 36 8.995 5.855 5.736 1.00 0.52 H ATOM 536 HA GLU A 36 11.323 6.162 4.190 1.00 0.69 H ATOM 537 HB2 GLU A 36 11.116 6.673 7.169 1.00 1.43 H ATOM 538 HB3 GLU A 36 12.178 7.464 6.019 1.00 1.37 H ATOM 539 HG2 GLU A 36 10.615 9.103 6.350 1.00 1.99 H ATOM 540 HG3 GLU A 36 9.912 8.275 4.964 1.00 2.11 H ATOM 541 N ASP A 37 11.351 3.915 6.582 1.00 0.61 N ATOM 542 CA ASP A 37 12.049 2.776 7.179 1.00 0.70 C ATOM 543 C ASP A 37 12.230 1.661 6.183 1.00 0.69 C ATOM 544 O ASP A 37 13.219 0.934 6.224 1.00 0.82 O ATOM 545 CB ASP A 37 11.312 2.230 8.413 1.00 0.77 C ATOM 546 CG ASP A 37 11.282 3.179 9.573 1.00 0.98 C ATOM 547 OD1 ASP A 37 12.355 3.554 10.078 1.00 1.27 O ATOM 548 OD2 ASP A 37 10.189 3.600 9.985 1.00 1.36 O ATOM 549 H ASP A 37 10.436 4.115 6.872 1.00 0.57 H ATOM 550 HA ASP A 37 13.024 3.122 7.490 1.00 0.80 H ATOM 551 HB2 ASP A 37 10.287 2.022 8.141 1.00 1.07 H ATOM 552 HB3 ASP A 37 11.780 1.312 8.732 1.00 0.95 H ATOM 553 N ILE A 38 11.279 1.517 5.287 1.00 0.59 N ATOM 554 CA ILE A 38 11.362 0.475 4.279 1.00 0.63 C ATOM 555 C ILE A 38 12.051 0.960 2.998 1.00 0.63 C ATOM 556 O ILE A 38 12.109 0.238 2.012 1.00 0.66 O ATOM 557 CB ILE A 38 9.992 -0.176 3.944 1.00 0.59 C ATOM 558 CG1 ILE A 38 9.020 0.881 3.411 1.00 0.48 C ATOM 559 CG2 ILE A 38 9.422 -0.881 5.177 1.00 0.67 C ATOM 560 CD1 ILE A 38 7.651 0.357 3.030 1.00 0.54 C ATOM 561 H ILE A 38 10.502 2.114 5.326 1.00 0.56 H ATOM 562 HA ILE A 38 12.000 -0.288 4.699 1.00 0.73 H ATOM 563 HB ILE A 38 10.157 -0.920 3.179 1.00 0.66 H ATOM 564 HG12 ILE A 38 8.893 1.621 4.186 1.00 0.43 H ATOM 565 HG13 ILE A 38 9.460 1.351 2.543 1.00 0.48 H ATOM 566 HG21 ILE A 38 8.473 -1.333 4.927 1.00 1.43 H ATOM 567 HG22 ILE A 38 9.276 -0.161 5.970 1.00 1.12 H ATOM 568 HG23 ILE A 38 10.113 -1.645 5.506 1.00 1.13 H ATOM 569 HD11 ILE A 38 7.062 1.156 2.606 1.00 1.13 H ATOM 570 HD12 ILE A 38 7.162 -0.006 3.921 1.00 1.03 H ATOM 571 HD13 ILE A 38 7.755 -0.441 2.309 1.00 1.00 H ATOM 572 N GLY A 39 12.619 2.160 3.056 1.00 0.63 N ATOM 573 CA GLY A 39 13.352 2.712 1.925 1.00 0.68 C ATOM 574 C GLY A 39 12.478 3.015 0.715 1.00 0.59 C ATOM 575 O GLY A 39 12.883 2.786 -0.418 1.00 0.70 O ATOM 576 H GLY A 39 12.544 2.679 3.884 1.00 0.63 H ATOM 577 HA2 GLY A 39 13.835 3.625 2.237 1.00 0.71 H ATOM 578 HA3 GLY A 39 14.114 2.004 1.632 1.00 0.81 H ATOM 579 N TYR A 40 11.292 3.520 0.948 1.00 0.45 N ATOM 580 CA TYR A 40 10.398 3.857 -0.140 1.00 0.45 C ATOM 581 C TYR A 40 10.222 5.336 -0.307 1.00 0.47 C ATOM 582 O TYR A 40 10.406 6.120 0.635 1.00 0.62 O ATOM 583 CB TYR A 40 9.023 3.184 -0.002 1.00 0.42 C ATOM 584 CG TYR A 40 8.931 1.832 -0.658 1.00 0.46 C ATOM 585 CD1 TYR A 40 9.648 0.740 -0.191 1.00 0.53 C ATOM 586 CD2 TYR A 40 8.127 1.661 -1.771 1.00 0.57 C ATOM 587 CE1 TYR A 40 9.562 -0.487 -0.816 1.00 0.60 C ATOM 588 CE2 TYR A 40 8.032 0.449 -2.406 1.00 0.68 C ATOM 589 CZ TYR A 40 8.756 -0.632 -1.924 1.00 0.67 C ATOM 590 OH TYR A 40 8.675 -1.854 -2.552 1.00 0.78 O ATOM 591 H TYR A 40 11.001 3.681 1.873 1.00 0.42 H ATOM 592 HA TYR A 40 10.857 3.480 -1.042 1.00 0.56 H ATOM 593 HB2 TYR A 40 8.746 3.078 1.037 1.00 0.43 H ATOM 594 HB3 TYR A 40 8.291 3.821 -0.479 1.00 0.44 H ATOM 595 HD1 TYR A 40 10.277 0.861 0.677 1.00 0.63 H ATOM 596 HD2 TYR A 40 7.566 2.506 -2.143 1.00 0.66 H ATOM 597 HE1 TYR A 40 10.128 -1.326 -0.437 1.00 0.69 H ATOM 598 HE2 TYR A 40 7.381 0.376 -3.266 1.00 0.85 H ATOM 599 HH TYR A 40 8.657 -2.542 -1.882 1.00 1.25 H ATOM 600 N ASP A 41 9.925 5.720 -1.521 1.00 0.55 N ATOM 601 CA ASP A 41 9.559 7.075 -1.836 1.00 0.69 C ATOM 602 C ASP A 41 8.102 7.085 -2.130 1.00 0.85 C ATOM 603 O ASP A 41 7.491 6.032 -2.372 1.00 1.62 O ATOM 604 CB ASP A 41 10.293 7.652 -3.054 1.00 0.82 C ATOM 605 CG ASP A 41 11.770 7.899 -2.851 1.00 0.99 C ATOM 606 OD1 ASP A 41 12.551 6.947 -2.787 1.00 1.32 O ATOM 607 OD2 ASP A 41 12.165 9.082 -2.765 1.00 1.27 O ATOM 608 H ASP A 41 9.940 5.057 -2.243 1.00 0.64 H ATOM 609 HA ASP A 41 9.753 7.687 -0.968 1.00 0.70 H ATOM 610 HB2 ASP A 41 10.103 7.021 -3.901 1.00 1.07 H ATOM 611 HB3 ASP A 41 9.839 8.601 -3.299 1.00 1.03 H ATOM 612 N SER A 42 7.580 8.236 -2.209 1.00 0.50 N ATOM 613 CA SER A 42 6.179 8.470 -2.390 1.00 0.53 C ATOM 614 C SER A 42 5.759 8.136 -3.821 1.00 0.51 C ATOM 615 O SER A 42 4.668 7.626 -4.070 1.00 0.48 O ATOM 616 CB SER A 42 5.970 9.923 -2.131 1.00 0.69 C ATOM 617 OG SER A 42 6.816 10.660 -3.066 1.00 1.05 O ATOM 618 H SER A 42 8.188 9.002 -2.162 1.00 0.83 H ATOM 619 HA SER A 42 5.621 7.869 -1.687 1.00 0.54 H ATOM 620 HB2 SER A 42 4.937 10.185 -2.299 1.00 1.09 H ATOM 621 HB3 SER A 42 6.257 10.169 -1.119 1.00 1.08 H ATOM 622 N LEU A 43 6.666 8.416 -4.744 1.00 0.57 N ATOM 623 CA LEU A 43 6.469 8.198 -6.163 1.00 0.62 C ATOM 624 C LEU A 43 6.110 6.741 -6.456 1.00 0.56 C ATOM 625 O LEU A 43 5.187 6.460 -7.218 1.00 0.58 O ATOM 626 CB LEU A 43 7.736 8.600 -6.922 1.00 0.74 C ATOM 627 CG LEU A 43 7.664 8.514 -8.440 1.00 0.86 C ATOM 628 CD1 LEU A 43 6.591 9.446 -8.966 1.00 1.40 C ATOM 629 CD2 LEU A 43 9.012 8.844 -9.052 1.00 1.19 C ATOM 630 H LEU A 43 7.494 8.837 -4.428 1.00 0.63 H ATOM 631 HA LEU A 43 5.657 8.830 -6.492 1.00 0.68 H ATOM 632 HB2 LEU A 43 7.980 9.620 -6.656 1.00 0.80 H ATOM 633 HB3 LEU A 43 8.544 7.965 -6.592 1.00 0.74 H ATOM 634 HG LEU A 43 7.400 7.505 -8.724 1.00 1.21 H ATOM 635 HD11 LEU A 43 6.821 10.461 -8.679 1.00 2.04 H ATOM 636 HD12 LEU A 43 5.631 9.165 -8.557 1.00 1.94 H ATOM 637 HD13 LEU A 43 6.552 9.379 -10.043 1.00 1.66 H ATOM 638 HD21 LEU A 43 9.301 9.844 -8.764 1.00 1.69 H ATOM 639 HD22 LEU A 43 8.941 8.785 -10.129 1.00 1.62 H ATOM 640 HD23 LEU A 43 9.749 8.140 -8.696 1.00 1.71 H ATOM 641 N ALA A 44 6.825 5.829 -5.815 1.00 0.54 N ATOM 642 CA ALA A 44 6.594 4.407 -5.997 1.00 0.54 C ATOM 643 C ALA A 44 5.384 3.975 -5.193 1.00 0.47 C ATOM 644 O ALA A 44 4.634 3.087 -5.595 1.00 0.53 O ATOM 645 CB ALA A 44 7.821 3.613 -5.573 1.00 0.59 C ATOM 646 H ALA A 44 7.519 6.137 -5.199 1.00 0.57 H ATOM 647 HA ALA A 44 6.413 4.230 -7.046 1.00 0.62 H ATOM 648 HB1 ALA A 44 7.645 2.563 -5.746 1.00 1.28 H ATOM 649 HB2 ALA A 44 8.002 3.778 -4.521 1.00 1.12 H ATOM 650 HB3 ALA A 44 8.680 3.936 -6.143 1.00 1.13 H ATOM 651 N LEU A 45 5.188 4.653 -4.083 1.00 0.42 N ATOM 652 CA LEU A 45 4.116 4.373 -3.152 1.00 0.38 C ATOM 653 C LEU A 45 2.761 4.629 -3.843 1.00 0.37 C ATOM 654 O LEU A 45 1.825 3.821 -3.722 1.00 0.39 O ATOM 655 CB LEU A 45 4.315 5.281 -1.931 1.00 0.35 C ATOM 656 CG LEU A 45 3.744 4.848 -0.581 1.00 0.37 C ATOM 657 CD1 LEU A 45 4.164 5.842 0.466 1.00 0.38 C ATOM 658 CD2 LEU A 45 2.236 4.729 -0.600 1.00 0.53 C ATOM 659 H LEU A 45 5.799 5.387 -3.864 1.00 0.46 H ATOM 660 HA LEU A 45 4.190 3.340 -2.851 1.00 0.42 H ATOM 661 HB2 LEU A 45 5.379 5.409 -1.795 1.00 0.34 H ATOM 662 HB3 LEU A 45 3.894 6.246 -2.180 1.00 0.40 H ATOM 663 HG LEU A 45 4.170 3.892 -0.312 1.00 0.43 H ATOM 664 HD11 LEU A 45 5.243 5.864 0.503 1.00 1.04 H ATOM 665 HD12 LEU A 45 3.777 5.521 1.422 1.00 1.10 H ATOM 666 HD13 LEU A 45 3.783 6.822 0.221 1.00 1.14 H ATOM 667 HD21 LEU A 45 1.959 3.980 -1.327 1.00 0.97 H ATOM 668 HD22 LEU A 45 1.801 5.680 -0.866 1.00 1.13 H ATOM 669 HD23 LEU A 45 1.898 4.428 0.379 1.00 1.32 H ATOM 670 N MET A 46 2.663 5.751 -4.574 1.00 0.37 N ATOM 671 CA MET A 46 1.452 6.062 -5.350 1.00 0.40 C ATOM 672 C MET A 46 1.107 4.940 -6.327 1.00 0.35 C ATOM 673 O MET A 46 -0.065 4.584 -6.494 1.00 0.36 O ATOM 674 CB MET A 46 1.591 7.375 -6.121 1.00 0.52 C ATOM 675 CG MET A 46 1.738 8.598 -5.250 1.00 0.70 C ATOM 676 SD MET A 46 1.624 10.139 -6.199 1.00 0.96 S ATOM 677 CE MET A 46 3.090 10.029 -7.225 1.00 2.41 C ATOM 678 H MET A 46 3.399 6.410 -4.549 1.00 0.38 H ATOM 679 HA MET A 46 0.637 6.159 -4.646 1.00 0.47 H ATOM 680 HB2 MET A 46 2.462 7.314 -6.757 1.00 0.53 H ATOM 681 HB3 MET A 46 0.717 7.503 -6.742 1.00 0.59 H ATOM 682 HG2 MET A 46 0.988 8.569 -4.473 1.00 0.73 H ATOM 683 HG3 MET A 46 2.714 8.554 -4.785 1.00 0.73 H ATOM 684 HE1 MET A 46 3.162 10.905 -7.852 1.00 2.94 H ATOM 685 HE2 MET A 46 3.031 9.147 -7.846 1.00 2.88 H ATOM 686 HE3 MET A 46 3.966 9.962 -6.595 1.00 2.92 H ATOM 687 N GLU A 47 2.133 4.366 -6.930 1.00 0.37 N ATOM 688 CA GLU A 47 1.971 3.284 -7.893 1.00 0.39 C ATOM 689 C GLU A 47 1.419 2.038 -7.200 1.00 0.37 C ATOM 690 O GLU A 47 0.568 1.340 -7.750 1.00 0.43 O ATOM 691 CB GLU A 47 3.308 2.968 -8.556 1.00 0.48 C ATOM 692 CG GLU A 47 3.944 4.147 -9.262 1.00 0.68 C ATOM 693 CD GLU A 47 3.109 4.682 -10.398 1.00 1.41 C ATOM 694 OE1 GLU A 47 2.242 5.554 -10.167 1.00 2.15 O ATOM 695 OE2 GLU A 47 3.324 4.259 -11.547 1.00 1.84 O ATOM 696 H GLU A 47 3.039 4.679 -6.721 1.00 0.40 H ATOM 697 HA GLU A 47 1.271 3.611 -8.647 1.00 0.42 H ATOM 698 HB2 GLU A 47 3.994 2.645 -7.789 1.00 0.57 H ATOM 699 HB3 GLU A 47 3.169 2.171 -9.272 1.00 0.68 H ATOM 700 HG2 GLU A 47 4.097 4.941 -8.546 1.00 1.01 H ATOM 701 HG3 GLU A 47 4.901 3.835 -9.653 1.00 1.05 H ATOM 702 N THR A 48 1.890 1.791 -5.983 1.00 0.36 N ATOM 703 CA THR A 48 1.432 0.673 -5.175 1.00 0.39 C ATOM 704 C THR A 48 -0.075 0.789 -4.932 1.00 0.35 C ATOM 705 O THR A 48 -0.840 -0.149 -5.216 1.00 0.40 O ATOM 706 CB THR A 48 2.185 0.671 -3.834 1.00 0.43 C ATOM 707 OG1 THR A 48 3.594 0.624 -4.099 1.00 0.51 O ATOM 708 CG2 THR A 48 1.784 -0.528 -2.983 1.00 0.51 C ATOM 709 H THR A 48 2.581 2.384 -5.614 1.00 0.38 H ATOM 710 HA THR A 48 1.652 -0.243 -5.703 1.00 0.44 H ATOM 711 HB THR A 48 1.952 1.583 -3.306 1.00 0.39 H ATOM 712 HG1 THR A 48 3.697 0.542 -5.053 1.00 0.77 H ATOM 713 HG21 THR A 48 0.724 -0.487 -2.778 1.00 1.01 H ATOM 714 HG22 THR A 48 2.336 -0.511 -2.053 1.00 1.20 H ATOM 715 HG23 THR A 48 2.011 -1.440 -3.514 1.00 1.19 H ATOM 716 N ALA A 49 -0.493 1.945 -4.437 1.00 0.31 N ATOM 717 CA ALA A 49 -1.896 2.215 -4.174 1.00 0.32 C ATOM 718 C ALA A 49 -2.721 2.081 -5.451 1.00 0.30 C ATOM 719 O ALA A 49 -3.797 1.482 -5.442 1.00 0.32 O ATOM 720 CB ALA A 49 -2.055 3.597 -3.589 1.00 0.38 C ATOM 721 H ALA A 49 0.172 2.645 -4.252 1.00 0.32 H ATOM 722 HA ALA A 49 -2.257 1.496 -3.452 1.00 0.36 H ATOM 723 HB1 ALA A 49 -3.096 3.774 -3.358 1.00 1.14 H ATOM 724 HB2 ALA A 49 -1.717 4.334 -4.302 1.00 1.07 H ATOM 725 HB3 ALA A 49 -1.469 3.679 -2.686 1.00 1.05 H ATOM 726 N ALA A 50 -2.173 2.586 -6.554 1.00 0.29 N ATOM 727 CA ALA A 50 -2.830 2.538 -7.864 1.00 0.31 C ATOM 728 C ALA A 50 -3.118 1.098 -8.305 1.00 0.31 C ATOM 729 O ALA A 50 -4.197 0.805 -8.858 1.00 0.35 O ATOM 730 CB ALA A 50 -1.983 3.246 -8.901 1.00 0.39 C ATOM 731 H ALA A 50 -1.292 3.017 -6.487 1.00 0.31 H ATOM 732 HA ALA A 50 -3.770 3.065 -7.775 1.00 0.32 H ATOM 733 HB1 ALA A 50 -1.779 4.255 -8.574 1.00 1.16 H ATOM 734 HB2 ALA A 50 -2.515 3.273 -9.841 1.00 1.05 H ATOM 735 HB3 ALA A 50 -1.053 2.711 -9.030 1.00 1.05 H ATOM 736 N ARG A 51 -2.164 0.206 -8.054 1.00 0.32 N ATOM 737 CA ARG A 51 -2.322 -1.219 -8.367 1.00 0.38 C ATOM 738 C ARG A 51 -3.488 -1.793 -7.577 1.00 0.37 C ATOM 739 O ARG A 51 -4.344 -2.507 -8.111 1.00 0.47 O ATOM 740 CB ARG A 51 -1.049 -2.002 -8.002 1.00 0.49 C ATOM 741 CG ARG A 51 0.199 -1.614 -8.779 1.00 0.97 C ATOM 742 CD ARG A 51 0.056 -1.924 -10.253 1.00 0.98 C ATOM 743 NE ARG A 51 1.274 -1.596 -11.007 1.00 1.92 N ATOM 744 CZ ARG A 51 1.834 -2.384 -11.929 1.00 2.31 C ATOM 745 NH1 ARG A 51 1.327 -3.592 -12.172 1.00 2.05 N ATOM 746 NH2 ARG A 51 2.903 -1.962 -12.583 1.00 3.40 N ATOM 747 H ARG A 51 -1.323 0.526 -7.658 1.00 0.33 H ATOM 748 HA ARG A 51 -2.514 -1.322 -9.424 1.00 0.43 H ATOM 749 HB2 ARG A 51 -0.845 -1.849 -6.953 1.00 1.08 H ATOM 750 HB3 ARG A 51 -1.238 -3.053 -8.166 1.00 1.12 H ATOM 751 HG2 ARG A 51 0.370 -0.556 -8.660 1.00 1.56 H ATOM 752 HG3 ARG A 51 1.040 -2.163 -8.381 1.00 1.50 H ATOM 753 HD2 ARG A 51 -0.150 -2.979 -10.367 1.00 1.17 H ATOM 754 HD3 ARG A 51 -0.768 -1.354 -10.652 1.00 1.40 H ATOM 755 HE ARG A 51 1.666 -0.713 -10.811 1.00 2.58 H ATOM 756 HH11 ARG A 51 0.530 -3.933 -11.668 1.00 1.81 H ATOM 757 HH12 ARG A 51 1.687 -4.224 -12.871 1.00 2.55 H ATOM 758 HH21 ARG A 51 3.282 -1.047 -12.384 1.00 4.01 H ATOM 759 HH22 ARG A 51 3.393 -2.487 -13.290 1.00 3.78 H ATOM 760 N LEU A 52 -3.540 -1.429 -6.318 1.00 0.32 N ATOM 761 CA LEU A 52 -4.545 -1.925 -5.403 1.00 0.34 C ATOM 762 C LEU A 52 -5.933 -1.419 -5.776 1.00 0.33 C ATOM 763 O LEU A 52 -6.895 -2.193 -5.793 1.00 0.40 O ATOM 764 CB LEU A 52 -4.179 -1.551 -3.971 1.00 0.35 C ATOM 765 CG LEU A 52 -2.801 -2.045 -3.514 1.00 0.38 C ATOM 766 CD1 LEU A 52 -2.506 -1.620 -2.091 1.00 0.43 C ATOM 767 CD2 LEU A 52 -2.698 -3.551 -3.658 1.00 0.39 C ATOM 768 H LEU A 52 -2.870 -0.789 -5.991 1.00 0.30 H ATOM 769 HA LEU A 52 -4.549 -3.002 -5.486 1.00 0.39 H ATOM 770 HB2 LEU A 52 -4.204 -0.474 -3.884 1.00 0.35 H ATOM 771 HB3 LEU A 52 -4.922 -1.967 -3.309 1.00 0.38 H ATOM 772 HG LEU A 52 -2.052 -1.596 -4.150 1.00 0.41 H ATOM 773 HD11 LEU A 52 -2.539 -0.542 -2.028 1.00 1.04 H ATOM 774 HD12 LEU A 52 -1.523 -1.964 -1.805 1.00 1.06 H ATOM 775 HD13 LEU A 52 -3.247 -2.039 -1.427 1.00 1.06 H ATOM 776 HD21 LEU A 52 -2.835 -3.820 -4.694 1.00 1.11 H ATOM 777 HD22 LEU A 52 -3.457 -4.027 -3.055 1.00 0.96 H ATOM 778 HD23 LEU A 52 -1.721 -3.872 -3.333 1.00 1.10 H ATOM 779 N GLU A 53 -6.025 -0.140 -6.117 1.00 0.28 N ATOM 780 CA GLU A 53 -7.288 0.457 -6.550 1.00 0.29 C ATOM 781 C GLU A 53 -7.803 -0.250 -7.799 1.00 0.31 C ATOM 782 O GLU A 53 -8.970 -0.560 -7.894 1.00 0.35 O ATOM 783 CB GLU A 53 -7.113 1.935 -6.899 1.00 0.29 C ATOM 784 CG GLU A 53 -6.634 2.842 -5.783 1.00 0.35 C ATOM 785 CD GLU A 53 -6.494 4.266 -6.272 1.00 0.41 C ATOM 786 OE1 GLU A 53 -5.443 4.601 -6.860 1.00 0.53 O ATOM 787 OE2 GLU A 53 -7.394 5.093 -6.006 1.00 0.51 O ATOM 788 H GLU A 53 -5.225 0.432 -6.059 1.00 0.27 H ATOM 789 HA GLU A 53 -8.027 0.361 -5.762 1.00 0.33 H ATOM 790 HB2 GLU A 53 -6.398 2.010 -7.705 1.00 0.29 H ATOM 791 HB3 GLU A 53 -8.064 2.306 -7.249 1.00 0.32 H ATOM 792 HG2 GLU A 53 -7.349 2.816 -4.974 1.00 0.41 H ATOM 793 HG3 GLU A 53 -5.672 2.495 -5.436 1.00 0.33 H ATOM 794 N SER A 54 -6.916 -0.521 -8.729 1.00 0.35 N ATOM 795 CA SER A 54 -7.295 -1.119 -9.994 1.00 0.43 C ATOM 796 C SER A 54 -7.681 -2.600 -9.852 1.00 0.47 C ATOM 797 O SER A 54 -8.664 -3.056 -10.439 1.00 0.61 O ATOM 798 CB SER A 54 -6.172 -0.919 -11.005 1.00 0.49 C ATOM 799 OG SER A 54 -5.845 0.470 -11.102 1.00 1.16 O ATOM 800 H SER A 54 -5.976 -0.291 -8.569 1.00 0.36 H ATOM 801 HA SER A 54 -8.164 -0.584 -10.349 1.00 0.45 H ATOM 802 HB2 SER A 54 -5.300 -1.469 -10.683 1.00 1.13 H ATOM 803 HB3 SER A 54 -6.484 -1.271 -11.976 1.00 1.14 H ATOM 804 HG SER A 54 -5.172 0.646 -10.430 1.00 1.39 H ATOM 805 N ARG A 55 -6.937 -3.332 -9.053 1.00 0.40 N ATOM 806 CA ARG A 55 -7.192 -4.753 -8.867 1.00 0.46 C ATOM 807 C ARG A 55 -8.377 -5.018 -7.920 1.00 0.47 C ATOM 808 O ARG A 55 -9.159 -5.951 -8.137 1.00 0.57 O ATOM 809 CB ARG A 55 -5.913 -5.454 -8.383 1.00 0.50 C ATOM 810 CG ARG A 55 -6.078 -6.918 -8.015 1.00 0.61 C ATOM 811 CD ARG A 55 -4.752 -7.516 -7.600 1.00 0.75 C ATOM 812 NE ARG A 55 -4.913 -8.799 -6.927 1.00 1.28 N ATOM 813 CZ ARG A 55 -4.082 -9.248 -5.982 1.00 1.65 C ATOM 814 NH1 ARG A 55 -2.933 -8.623 -5.746 1.00 1.46 N ATOM 815 NH2 ARG A 55 -4.364 -10.352 -5.307 1.00 2.65 N ATOM 816 H ARG A 55 -6.174 -2.916 -8.591 1.00 0.37 H ATOM 817 HA ARG A 55 -7.448 -5.154 -9.836 1.00 0.51 H ATOM 818 HB2 ARG A 55 -5.174 -5.395 -9.168 1.00 0.54 H ATOM 819 HB3 ARG A 55 -5.539 -4.930 -7.516 1.00 0.52 H ATOM 820 HG2 ARG A 55 -6.773 -6.999 -7.193 1.00 0.74 H ATOM 821 HG3 ARG A 55 -6.456 -7.454 -8.871 1.00 0.63 H ATOM 822 HD2 ARG A 55 -4.147 -7.659 -8.483 1.00 1.34 H ATOM 823 HD3 ARG A 55 -4.257 -6.826 -6.931 1.00 1.29 H ATOM 824 HE ARG A 55 -5.719 -9.320 -7.151 1.00 1.84 H ATOM 825 HH11 ARG A 55 -2.598 -7.820 -6.243 1.00 1.47 H ATOM 826 HH12 ARG A 55 -2.368 -8.952 -4.975 1.00 1.85 H ATOM 827 HH21 ARG A 55 -5.179 -10.917 -5.453 1.00 3.22 H ATOM 828 HH22 ARG A 55 -3.730 -10.628 -4.574 1.00 3.00 H ATOM 829 N TYR A 56 -8.520 -4.216 -6.886 1.00 0.42 N ATOM 830 CA TYR A 56 -9.598 -4.426 -5.919 1.00 0.47 C ATOM 831 C TYR A 56 -10.820 -3.564 -6.211 1.00 0.50 C ATOM 832 O TYR A 56 -11.889 -3.773 -5.637 1.00 0.67 O ATOM 833 CB TYR A 56 -9.090 -4.263 -4.474 1.00 0.52 C ATOM 834 CG TYR A 56 -8.106 -5.351 -4.083 1.00 0.53 C ATOM 835 CD1 TYR A 56 -6.758 -5.213 -4.367 1.00 0.59 C ATOM 836 CD2 TYR A 56 -8.518 -6.490 -3.395 1.00 0.62 C ATOM 837 CE1 TYR A 56 -5.848 -6.175 -3.986 1.00 0.65 C ATOM 838 CE2 TYR A 56 -7.608 -7.453 -3.001 1.00 0.70 C ATOM 839 CZ TYR A 56 -6.338 -7.394 -3.436 1.00 0.67 C ATOM 840 OH TYR A 56 -5.359 -8.226 -2.902 1.00 0.79 O ATOM 841 H TYR A 56 -7.892 -3.471 -6.743 1.00 0.39 H ATOM 842 HA TYR A 56 -9.908 -5.452 -6.052 1.00 0.51 H ATOM 843 HB2 TYR A 56 -8.591 -3.311 -4.376 1.00 0.53 H ATOM 844 HB3 TYR A 56 -9.926 -4.307 -3.790 1.00 0.56 H ATOM 845 HD1 TYR A 56 -6.421 -4.340 -4.908 1.00 0.66 H ATOM 846 HD2 TYR A 56 -9.565 -6.612 -3.163 1.00 0.70 H ATOM 847 HE1 TYR A 56 -4.801 -6.047 -4.218 1.00 0.75 H ATOM 848 HE2 TYR A 56 -7.949 -8.331 -2.470 1.00 0.83 H ATOM 849 HH TYR A 56 -5.762 -9.116 -2.896 1.00 0.95 H ATOM 850 N GLY A 57 -10.661 -2.619 -7.107 1.00 0.41 N ATOM 851 CA GLY A 57 -11.770 -1.799 -7.526 1.00 0.45 C ATOM 852 C GLY A 57 -12.110 -0.717 -6.531 1.00 0.46 C ATOM 853 O GLY A 57 -13.254 -0.619 -6.090 1.00 0.61 O ATOM 854 H GLY A 57 -9.778 -2.447 -7.496 1.00 0.38 H ATOM 855 HA2 GLY A 57 -11.532 -1.340 -8.473 1.00 0.47 H ATOM 856 HA3 GLY A 57 -12.635 -2.434 -7.654 1.00 0.50 H ATOM 857 N VAL A 58 -11.138 0.108 -6.175 1.00 0.38 N ATOM 858 CA VAL A 58 -11.373 1.169 -5.200 1.00 0.42 C ATOM 859 C VAL A 58 -10.825 2.501 -5.713 1.00 0.45 C ATOM 860 O VAL A 58 -10.285 2.566 -6.815 1.00 0.51 O ATOM 861 CB VAL A 58 -10.765 0.855 -3.770 1.00 0.42 C ATOM 862 CG1 VAL A 58 -11.056 -0.555 -3.348 1.00 0.59 C ATOM 863 CG2 VAL A 58 -9.266 1.114 -3.666 1.00 0.57 C ATOM 864 H VAL A 58 -10.264 0.028 -6.616 1.00 0.34 H ATOM 865 HA VAL A 58 -12.445 1.265 -5.105 1.00 0.50 H ATOM 866 HB VAL A 58 -11.274 1.517 -3.085 1.00 0.56 H ATOM 867 HG11 VAL A 58 -10.524 -1.173 -4.057 1.00 1.23 H ATOM 868 HG12 VAL A 58 -12.117 -0.745 -3.396 1.00 1.25 H ATOM 869 HG13 VAL A 58 -10.674 -0.735 -2.354 1.00 1.06 H ATOM 870 HG21 VAL A 58 -9.064 2.153 -3.878 1.00 1.05 H ATOM 871 HG22 VAL A 58 -8.731 0.485 -4.362 1.00 1.24 H ATOM 872 HG23 VAL A 58 -8.959 0.892 -2.652 1.00 1.24 H ATOM 873 N SER A 59 -10.954 3.540 -4.914 1.00 0.51 N ATOM 874 CA SER A 59 -10.380 4.817 -5.218 1.00 0.61 C ATOM 875 C SER A 59 -10.027 5.562 -3.941 1.00 0.56 C ATOM 876 O SER A 59 -10.835 5.636 -2.990 1.00 0.63 O ATOM 877 CB SER A 59 -11.286 5.633 -6.137 1.00 0.84 C ATOM 878 OG SER A 59 -12.646 5.585 -5.717 1.00 1.59 O ATOM 879 H SER A 59 -11.465 3.485 -4.081 1.00 0.54 H ATOM 880 HA SER A 59 -9.453 4.616 -5.736 1.00 0.62 H ATOM 881 HB2 SER A 59 -10.962 6.663 -6.121 1.00 1.32 H ATOM 882 HB3 SER A 59 -11.214 5.243 -7.141 1.00 1.36 H ATOM 883 HG SER A 59 -13.063 4.923 -6.296 1.00 2.14 H ATOM 884 N ILE A 60 -8.819 6.037 -3.889 1.00 0.50 N ATOM 885 CA ILE A 60 -8.325 6.774 -2.753 1.00 0.48 C ATOM 886 C ILE A 60 -8.283 8.271 -3.090 1.00 0.53 C ATOM 887 O ILE A 60 -7.540 8.688 -3.966 1.00 0.63 O ATOM 888 CB ILE A 60 -6.906 6.269 -2.346 1.00 0.48 C ATOM 889 CG1 ILE A 60 -6.957 4.763 -2.014 1.00 0.64 C ATOM 890 CG2 ILE A 60 -6.351 7.064 -1.162 1.00 0.53 C ATOM 891 CD1 ILE A 60 -5.617 4.150 -1.654 1.00 0.75 C ATOM 892 H ILE A 60 -8.217 5.874 -4.655 1.00 0.50 H ATOM 893 HA ILE A 60 -9.004 6.616 -1.928 1.00 0.59 H ATOM 894 HB ILE A 60 -6.245 6.412 -3.187 1.00 0.50 H ATOM 895 HG12 ILE A 60 -7.619 4.611 -1.175 1.00 1.29 H ATOM 896 HG13 ILE A 60 -7.346 4.228 -2.868 1.00 1.27 H ATOM 897 HG21 ILE A 60 -5.385 6.656 -0.903 1.00 1.01 H ATOM 898 HG22 ILE A 60 -7.023 6.985 -0.320 1.00 1.13 H ATOM 899 HG23 ILE A 60 -6.238 8.102 -1.441 1.00 1.23 H ATOM 900 HD11 ILE A 60 -5.750 3.098 -1.444 1.00 1.11 H ATOM 901 HD12 ILE A 60 -5.226 4.644 -0.776 1.00 1.35 H ATOM 902 HD13 ILE A 60 -4.927 4.278 -2.474 1.00 1.64 H ATOM 903 N PRO A 61 -9.149 9.078 -2.456 1.00 0.65 N ATOM 904 CA PRO A 61 -9.169 10.541 -2.651 1.00 0.77 C ATOM 905 C PRO A 61 -7.863 11.201 -2.169 1.00 0.65 C ATOM 906 O PRO A 61 -7.160 10.644 -1.325 1.00 0.57 O ATOM 907 CB PRO A 61 -10.357 10.997 -1.790 1.00 0.97 C ATOM 908 CG PRO A 61 -11.179 9.767 -1.610 1.00 1.08 C ATOM 909 CD PRO A 61 -10.202 8.641 -1.536 1.00 0.83 C ATOM 910 HA PRO A 61 -9.338 10.793 -3.687 1.00 0.88 H ATOM 911 HB2 PRO A 61 -9.996 11.379 -0.847 1.00 0.93 H ATOM 912 HB3 PRO A 61 -10.911 11.766 -2.310 1.00 1.15 H ATOM 913 HG2 PRO A 61 -11.755 9.828 -0.698 1.00 1.24 H ATOM 914 HG3 PRO A 61 -11.833 9.632 -2.459 1.00 1.25 H ATOM 915 HD2 PRO A 61 -9.824 8.538 -0.530 1.00 0.83 H ATOM 916 HD3 PRO A 61 -10.648 7.716 -1.870 1.00 0.88 H ATOM 917 N ASP A 62 -7.578 12.399 -2.685 1.00 0.74 N ATOM 918 CA ASP A 62 -6.322 13.133 -2.412 1.00 0.73 C ATOM 919 C ASP A 62 -6.125 13.375 -0.913 1.00 0.62 C ATOM 920 O ASP A 62 -5.046 13.138 -0.372 1.00 0.64 O ATOM 921 CB ASP A 62 -6.283 14.495 -3.155 1.00 0.93 C ATOM 922 CG ASP A 62 -6.418 14.392 -4.668 1.00 1.44 C ATOM 923 OD1 ASP A 62 -5.402 14.260 -5.391 1.00 2.07 O ATOM 924 OD2 ASP A 62 -7.562 14.469 -5.178 1.00 1.92 O ATOM 925 H ASP A 62 -8.245 12.827 -3.262 1.00 0.89 H ATOM 926 HA ASP A 62 -5.504 12.525 -2.765 1.00 0.74 H ATOM 927 HB2 ASP A 62 -7.089 15.116 -2.793 1.00 1.42 H ATOM 928 HB3 ASP A 62 -5.346 14.982 -2.929 1.00 1.50 H ATOM 929 N ASP A 63 -7.186 13.808 -0.243 1.00 0.63 N ATOM 930 CA ASP A 63 -7.146 14.088 1.210 1.00 0.61 C ATOM 931 C ASP A 63 -6.857 12.819 1.974 1.00 0.59 C ATOM 932 O ASP A 63 -6.051 12.787 2.905 1.00 0.64 O ATOM 933 CB ASP A 63 -8.492 14.646 1.686 1.00 0.77 C ATOM 934 CG ASP A 63 -8.507 14.968 3.175 1.00 1.36 C ATOM 935 OD1 ASP A 63 -8.761 14.051 3.982 1.00 2.10 O ATOM 936 OD2 ASP A 63 -8.242 16.129 3.567 1.00 2.00 O ATOM 937 H ASP A 63 -8.026 13.961 -0.739 1.00 0.73 H ATOM 938 HA ASP A 63 -6.373 14.816 1.401 1.00 0.64 H ATOM 939 HB2 ASP A 63 -8.709 15.554 1.143 1.00 1.22 H ATOM 940 HB3 ASP A 63 -9.265 13.919 1.485 1.00 1.43 H ATOM 941 N VAL A 64 -7.462 11.759 1.509 1.00 0.62 N ATOM 942 CA VAL A 64 -7.393 10.469 2.148 1.00 0.69 C ATOM 943 C VAL A 64 -6.021 9.808 1.907 1.00 0.67 C ATOM 944 O VAL A 64 -5.603 8.912 2.637 1.00 0.78 O ATOM 945 CB VAL A 64 -8.573 9.558 1.675 1.00 0.82 C ATOM 946 CG1 VAL A 64 -8.594 8.218 2.387 1.00 0.98 C ATOM 947 CG2 VAL A 64 -9.902 10.274 1.880 1.00 0.90 C ATOM 948 H VAL A 64 -7.963 11.858 0.675 1.00 0.65 H ATOM 949 HA VAL A 64 -7.497 10.642 3.210 1.00 0.75 H ATOM 950 HB VAL A 64 -8.457 9.378 0.617 1.00 0.81 H ATOM 951 HG11 VAL A 64 -9.413 7.626 2.009 1.00 1.47 H ATOM 952 HG12 VAL A 64 -8.720 8.375 3.447 1.00 1.46 H ATOM 953 HG13 VAL A 64 -7.660 7.704 2.207 1.00 1.30 H ATOM 954 HG21 VAL A 64 -10.030 10.505 2.928 1.00 1.40 H ATOM 955 HG22 VAL A 64 -10.710 9.638 1.547 1.00 1.21 H ATOM 956 HG23 VAL A 64 -9.906 11.189 1.304 1.00 1.47 H ATOM 957 N ALA A 65 -5.291 10.327 0.938 1.00 0.61 N ATOM 958 CA ALA A 65 -3.963 9.832 0.635 1.00 0.67 C ATOM 959 C ALA A 65 -2.952 10.429 1.605 1.00 0.64 C ATOM 960 O ALA A 65 -1.851 9.937 1.753 1.00 0.74 O ATOM 961 CB ALA A 65 -3.587 10.153 -0.799 1.00 0.77 C ATOM 962 H ALA A 65 -5.659 11.064 0.401 1.00 0.61 H ATOM 963 HA ALA A 65 -3.973 8.759 0.762 1.00 0.76 H ATOM 964 HB1 ALA A 65 -2.614 9.740 -1.022 1.00 1.31 H ATOM 965 HB2 ALA A 65 -3.565 11.224 -0.938 1.00 1.30 H ATOM 966 HB3 ALA A 65 -4.320 9.723 -1.466 1.00 1.19 H ATOM 967 N GLY A 66 -3.366 11.469 2.308 1.00 0.58 N ATOM 968 CA GLY A 66 -2.500 12.111 3.270 1.00 0.66 C ATOM 969 C GLY A 66 -2.591 11.460 4.635 1.00 0.68 C ATOM 970 O GLY A 66 -2.076 11.980 5.614 1.00 0.86 O ATOM 971 H GLY A 66 -4.279 11.808 2.178 1.00 0.56 H ATOM 972 HA2 GLY A 66 -1.481 12.051 2.918 1.00 0.71 H ATOM 973 HA3 GLY A 66 -2.781 13.149 3.361 1.00 0.76 H ATOM 974 N ARG A 67 -3.219 10.307 4.684 1.00 0.64 N ATOM 975 CA ARG A 67 -3.450 9.586 5.926 1.00 0.79 C ATOM 976 C ARG A 67 -2.466 8.433 6.080 1.00 0.77 C ATOM 977 O ARG A 67 -2.623 7.594 6.949 1.00 0.95 O ATOM 978 CB ARG A 67 -4.875 9.040 5.931 1.00 0.94 C ATOM 979 CG ARG A 67 -5.941 10.113 5.823 1.00 1.12 C ATOM 980 CD ARG A 67 -7.331 9.518 5.693 1.00 1.40 C ATOM 981 NE ARG A 67 -7.685 8.661 6.822 1.00 1.89 N ATOM 982 CZ ARG A 67 -8.717 8.860 7.635 1.00 2.51 C ATOM 983 NH1 ARG A 67 -9.531 9.903 7.456 1.00 2.93 N ATOM 984 NH2 ARG A 67 -8.940 7.998 8.619 1.00 3.22 N ATOM 985 H ARG A 67 -3.547 9.921 3.844 1.00 0.62 H ATOM 986 HA ARG A 67 -3.344 10.273 6.750 1.00 0.90 H ATOM 987 HB2 ARG A 67 -4.990 8.365 5.096 1.00 1.03 H ATOM 988 HB3 ARG A 67 -5.040 8.493 6.848 1.00 1.14 H ATOM 989 HG2 ARG A 67 -5.910 10.733 6.707 1.00 1.53 H ATOM 990 HG3 ARG A 67 -5.737 10.718 4.952 1.00 1.58 H ATOM 991 HD2 ARG A 67 -8.052 10.319 5.634 1.00 1.87 H ATOM 992 HD3 ARG A 67 -7.375 8.934 4.785 1.00 1.90 H ATOM 993 HE ARG A 67 -7.114 7.869 6.977 1.00 2.27 H ATOM 994 HH11 ARG A 67 -9.399 10.567 6.708 1.00 2.92 H ATOM 995 HH12 ARG A 67 -10.311 10.064 8.071 1.00 3.61 H ATOM 996 HH21 ARG A 67 -8.331 7.201 8.727 1.00 3.51 H ATOM 997 HH22 ARG A 67 -9.675 8.097 9.302 1.00 3.77 H ATOM 998 N VAL A 68 -1.453 8.396 5.246 1.00 0.62 N ATOM 999 CA VAL A 68 -0.501 7.295 5.278 1.00 0.66 C ATOM 1000 C VAL A 68 0.847 7.683 5.911 1.00 0.67 C ATOM 1001 O VAL A 68 1.632 8.456 5.352 1.00 1.00 O ATOM 1002 CB VAL A 68 -0.298 6.654 3.865 1.00 0.68 C ATOM 1003 CG1 VAL A 68 -1.580 5.978 3.398 1.00 0.77 C ATOM 1004 CG2 VAL A 68 0.150 7.685 2.829 1.00 0.64 C ATOM 1005 H VAL A 68 -1.333 9.127 4.600 1.00 0.55 H ATOM 1006 HA VAL A 68 -0.944 6.542 5.919 1.00 0.78 H ATOM 1007 HB VAL A 68 0.464 5.894 3.954 1.00 0.78 H ATOM 1008 HG11 VAL A 68 -1.423 5.547 2.420 1.00 1.27 H ATOM 1009 HG12 VAL A 68 -2.374 6.708 3.343 1.00 1.31 H ATOM 1010 HG13 VAL A 68 -1.852 5.199 4.096 1.00 1.26 H ATOM 1011 HG21 VAL A 68 1.094 8.112 3.137 1.00 1.20 H ATOM 1012 HG22 VAL A 68 -0.590 8.466 2.753 1.00 1.23 H ATOM 1013 HG23 VAL A 68 0.268 7.203 1.869 1.00 1.15 H ATOM 1014 N ASP A 69 1.055 7.224 7.119 1.00 0.54 N ATOM 1015 CA ASP A 69 2.334 7.383 7.826 1.00 0.64 C ATOM 1016 C ASP A 69 3.034 6.031 7.836 1.00 0.50 C ATOM 1017 O ASP A 69 4.261 5.927 7.708 1.00 0.54 O ATOM 1018 CB ASP A 69 2.088 7.895 9.265 1.00 0.99 C ATOM 1019 CG ASP A 69 3.328 7.936 10.154 1.00 1.11 C ATOM 1020 OD1 ASP A 69 4.314 8.611 9.785 1.00 1.37 O ATOM 1021 OD2 ASP A 69 3.362 7.267 11.210 1.00 1.84 O ATOM 1022 H ASP A 69 0.338 6.732 7.592 1.00 0.66 H ATOM 1023 HA ASP A 69 2.936 8.092 7.276 1.00 0.75 H ATOM 1024 HB2 ASP A 69 1.686 8.895 9.216 1.00 1.65 H ATOM 1025 HB3 ASP A 69 1.356 7.254 9.733 1.00 1.55 H ATOM 1026 N THR A 70 2.228 4.996 7.922 1.00 0.43 N ATOM 1027 CA THR A 70 2.686 3.631 7.929 1.00 0.37 C ATOM 1028 C THR A 70 1.934 2.798 6.856 1.00 0.33 C ATOM 1029 O THR A 70 0.791 3.135 6.479 1.00 0.34 O ATOM 1030 CB THR A 70 2.427 3.002 9.319 1.00 0.42 C ATOM 1031 OG1 THR A 70 1.049 3.187 9.686 1.00 0.51 O ATOM 1032 CG2 THR A 70 3.317 3.619 10.382 1.00 0.44 C ATOM 1033 H THR A 70 1.261 5.164 8.010 1.00 0.50 H ATOM 1034 HA THR A 70 3.748 3.612 7.735 1.00 0.40 H ATOM 1035 HB THR A 70 2.635 1.944 9.253 1.00 0.46 H ATOM 1036 HG1 THR A 70 0.803 4.113 9.534 1.00 0.52 H ATOM 1037 HG21 THR A 70 3.112 4.678 10.440 1.00 1.19 H ATOM 1038 HG22 THR A 70 4.350 3.466 10.112 1.00 1.03 H ATOM 1039 HG23 THR A 70 3.110 3.159 11.337 1.00 1.11 H ATOM 1040 N PRO A 71 2.560 1.708 6.323 1.00 0.32 N ATOM 1041 CA PRO A 71 1.911 0.794 5.373 1.00 0.31 C ATOM 1042 C PRO A 71 0.707 0.095 5.999 1.00 0.29 C ATOM 1043 O PRO A 71 -0.170 -0.401 5.289 1.00 0.33 O ATOM 1044 CB PRO A 71 3.002 -0.237 5.035 1.00 0.34 C ATOM 1045 CG PRO A 71 4.276 0.426 5.401 1.00 0.38 C ATOM 1046 CD PRO A 71 3.955 1.323 6.558 1.00 0.36 C ATOM 1047 HA PRO A 71 1.603 1.313 4.478 1.00 0.35 H ATOM 1048 HB2 PRO A 71 2.854 -1.147 5.602 1.00 0.33 H ATOM 1049 HB3 PRO A 71 2.969 -0.462 3.980 1.00 0.41 H ATOM 1050 HG2 PRO A 71 4.994 -0.324 5.700 1.00 0.40 H ATOM 1051 HG3 PRO A 71 4.657 0.998 4.567 1.00 0.43 H ATOM 1052 HD2 PRO A 71 4.046 0.773 7.484 1.00 0.36 H ATOM 1053 HD3 PRO A 71 4.601 2.189 6.568 1.00 0.41 H ATOM 1054 N ARG A 72 0.672 0.069 7.341 1.00 0.30 N ATOM 1055 CA ARG A 72 -0.440 -0.498 8.095 1.00 0.34 C ATOM 1056 C ARG A 72 -1.706 0.226 7.701 1.00 0.36 C ATOM 1057 O ARG A 72 -2.712 -0.396 7.380 1.00 0.43 O ATOM 1058 CB ARG A 72 -0.218 -0.303 9.594 1.00 0.41 C ATOM 1059 CG ARG A 72 -1.246 -0.991 10.484 1.00 0.54 C ATOM 1060 CD ARG A 72 -1.079 -0.562 11.930 1.00 0.69 C ATOM 1061 NE ARG A 72 -1.424 0.858 12.110 1.00 0.75 N ATOM 1062 CZ ARG A 72 -0.756 1.731 12.868 1.00 0.98 C ATOM 1063 NH1 ARG A 72 0.360 1.369 13.496 1.00 1.38 N ATOM 1064 NH2 ARG A 72 -1.211 2.981 12.998 1.00 1.16 N ATOM 1065 H ARG A 72 1.436 0.445 7.832 1.00 0.31 H ATOM 1066 HA ARG A 72 -0.524 -1.552 7.874 1.00 0.37 H ATOM 1067 HB2 ARG A 72 0.757 -0.688 9.851 1.00 0.47 H ATOM 1068 HB3 ARG A 72 -0.240 0.755 9.806 1.00 0.43 H ATOM 1069 HG2 ARG A 72 -2.236 -0.723 10.148 1.00 0.56 H ATOM 1070 HG3 ARG A 72 -1.114 -2.060 10.410 1.00 0.63 H ATOM 1071 HD2 ARG A 72 -1.727 -1.163 12.551 1.00 0.82 H ATOM 1072 HD3 ARG A 72 -0.052 -0.718 12.223 1.00 0.79 H ATOM 1073 HE ARG A 72 -2.247 1.146 11.638 1.00 0.96 H ATOM 1074 HH11 ARG A 72 0.781 0.451 13.457 1.00 1.51 H ATOM 1075 HH12 ARG A 72 0.854 2.028 14.075 1.00 1.75 H ATOM 1076 HH21 ARG A 72 -2.051 3.289 12.542 1.00 1.26 H ATOM 1077 HH22 ARG A 72 -0.737 3.667 13.557 1.00 1.42 H ATOM 1078 N GLU A 73 -1.609 1.548 7.679 1.00 0.37 N ATOM 1079 CA GLU A 73 -2.713 2.423 7.341 1.00 0.42 C ATOM 1080 C GLU A 73 -3.075 2.279 5.888 1.00 0.40 C ATOM 1081 O GLU A 73 -4.224 2.240 5.564 1.00 0.44 O ATOM 1082 CB GLU A 73 -2.334 3.853 7.628 1.00 0.50 C ATOM 1083 CG GLU A 73 -1.985 4.101 9.069 1.00 0.63 C ATOM 1084 CD GLU A 73 -1.373 5.438 9.257 1.00 0.74 C ATOM 1085 OE1 GLU A 73 -0.215 5.605 8.857 1.00 0.69 O ATOM 1086 OE2 GLU A 73 -2.034 6.351 9.795 1.00 1.33 O ATOM 1087 H GLU A 73 -0.749 1.966 7.902 1.00 0.36 H ATOM 1088 HA GLU A 73 -3.564 2.163 7.951 1.00 0.45 H ATOM 1089 HB2 GLU A 73 -1.479 4.115 7.021 1.00 0.50 H ATOM 1090 HB3 GLU A 73 -3.162 4.496 7.365 1.00 0.58 H ATOM 1091 HG2 GLU A 73 -2.889 4.049 9.660 1.00 1.01 H ATOM 1092 HG3 GLU A 73 -1.289 3.343 9.395 1.00 0.99 H ATOM 1093 N LEU A 74 -2.068 2.183 5.023 1.00 0.40 N ATOM 1094 CA LEU A 74 -2.282 2.024 3.572 1.00 0.43 C ATOM 1095 C LEU A 74 -3.152 0.773 3.348 1.00 0.41 C ATOM 1096 O LEU A 74 -4.183 0.820 2.666 1.00 0.42 O ATOM 1097 CB LEU A 74 -0.903 1.857 2.870 1.00 0.44 C ATOM 1098 CG LEU A 74 -0.792 2.125 1.339 1.00 0.50 C ATOM 1099 CD1 LEU A 74 0.626 1.881 0.879 1.00 1.04 C ATOM 1100 CD2 LEU A 74 -1.750 1.283 0.507 1.00 1.10 C ATOM 1101 H LEU A 74 -1.156 2.238 5.381 1.00 0.42 H ATOM 1102 HA LEU A 74 -2.790 2.895 3.187 1.00 0.46 H ATOM 1103 HB2 LEU A 74 -0.207 2.521 3.359 1.00 0.46 H ATOM 1104 HB3 LEU A 74 -0.574 0.845 3.054 1.00 0.45 H ATOM 1105 HG LEU A 74 -1.003 3.170 1.165 1.00 0.90 H ATOM 1106 HD11 LEU A 74 1.299 2.524 1.426 1.00 1.74 H ATOM 1107 HD12 LEU A 74 0.701 2.103 -0.176 1.00 1.51 H ATOM 1108 HD13 LEU A 74 0.889 0.848 1.053 1.00 1.48 H ATOM 1109 HD21 LEU A 74 -1.637 1.529 -0.538 1.00 1.61 H ATOM 1110 HD22 LEU A 74 -2.762 1.495 0.821 1.00 1.53 H ATOM 1111 HD23 LEU A 74 -1.537 0.237 0.661 1.00 1.77 H ATOM 1112 N LEU A 75 -2.734 -0.313 3.966 1.00 0.41 N ATOM 1113 CA LEU A 75 -3.419 -1.591 3.889 1.00 0.41 C ATOM 1114 C LEU A 75 -4.838 -1.457 4.473 1.00 0.39 C ATOM 1115 O LEU A 75 -5.844 -1.721 3.796 1.00 0.37 O ATOM 1116 CB LEU A 75 -2.613 -2.620 4.709 1.00 0.46 C ATOM 1117 CG LEU A 75 -3.062 -4.078 4.647 1.00 0.48 C ATOM 1118 CD1 LEU A 75 -2.799 -4.655 3.274 1.00 0.51 C ATOM 1119 CD2 LEU A 75 -2.349 -4.895 5.711 1.00 0.54 C ATOM 1120 H LEU A 75 -1.912 -0.256 4.501 1.00 0.44 H ATOM 1121 HA LEU A 75 -3.458 -1.913 2.860 1.00 0.43 H ATOM 1122 HB2 LEU A 75 -1.587 -2.579 4.375 1.00 0.49 H ATOM 1123 HB3 LEU A 75 -2.640 -2.304 5.742 1.00 0.48 H ATOM 1124 HG LEU A 75 -4.124 -4.132 4.835 1.00 0.46 H ATOM 1125 HD11 LEU A 75 -1.735 -4.635 3.087 1.00 1.20 H ATOM 1126 HD12 LEU A 75 -3.316 -4.071 2.526 1.00 1.09 H ATOM 1127 HD13 LEU A 75 -3.147 -5.677 3.243 1.00 1.04 H ATOM 1128 HD21 LEU A 75 -1.283 -4.845 5.549 1.00 1.17 H ATOM 1129 HD22 LEU A 75 -2.677 -5.923 5.659 1.00 1.16 H ATOM 1130 HD23 LEU A 75 -2.583 -4.491 6.686 1.00 1.11 H ATOM 1131 N ASP A 76 -4.888 -0.977 5.703 1.00 0.44 N ATOM 1132 CA ASP A 76 -6.124 -0.839 6.495 1.00 0.48 C ATOM 1133 C ASP A 76 -7.152 0.086 5.835 1.00 0.40 C ATOM 1134 O ASP A 76 -8.338 -0.231 5.799 1.00 0.44 O ATOM 1135 CB ASP A 76 -5.774 -0.328 7.893 1.00 0.66 C ATOM 1136 CG ASP A 76 -6.966 -0.129 8.790 1.00 1.06 C ATOM 1137 OD1 ASP A 76 -7.437 -1.106 9.403 1.00 1.08 O ATOM 1138 OD2 ASP A 76 -7.490 1.004 8.862 1.00 1.89 O ATOM 1139 H ASP A 76 -4.043 -0.684 6.112 1.00 0.49 H ATOM 1140 HA ASP A 76 -6.562 -1.821 6.597 1.00 0.53 H ATOM 1141 HB2 ASP A 76 -5.121 -1.043 8.369 1.00 1.10 H ATOM 1142 HB3 ASP A 76 -5.252 0.614 7.801 1.00 1.09 H ATOM 1143 N LEU A 77 -6.679 1.200 5.303 1.00 0.37 N ATOM 1144 CA LEU A 77 -7.509 2.212 4.638 1.00 0.38 C ATOM 1145 C LEU A 77 -8.314 1.583 3.514 1.00 0.33 C ATOM 1146 O LEU A 77 -9.532 1.785 3.406 1.00 0.34 O ATOM 1147 CB LEU A 77 -6.606 3.309 4.061 1.00 0.46 C ATOM 1148 CG LEU A 77 -7.286 4.513 3.433 1.00 0.57 C ATOM 1149 CD1 LEU A 77 -8.042 5.292 4.487 1.00 1.37 C ATOM 1150 CD2 LEU A 77 -6.259 5.392 2.736 1.00 1.24 C ATOM 1151 H LEU A 77 -5.714 1.383 5.370 1.00 0.40 H ATOM 1152 HA LEU A 77 -8.172 2.653 5.368 1.00 0.45 H ATOM 1153 HB2 LEU A 77 -5.970 3.674 4.852 1.00 0.58 H ATOM 1154 HB3 LEU A 77 -5.978 2.858 3.310 1.00 0.49 H ATOM 1155 HG LEU A 77 -7.999 4.174 2.698 1.00 1.09 H ATOM 1156 HD11 LEU A 77 -8.503 6.159 4.039 1.00 1.82 H ATOM 1157 HD12 LEU A 77 -7.349 5.595 5.256 1.00 1.74 H ATOM 1158 HD13 LEU A 77 -8.800 4.648 4.909 1.00 2.11 H ATOM 1159 HD21 LEU A 77 -6.748 6.254 2.307 1.00 1.84 H ATOM 1160 HD22 LEU A 77 -5.775 4.829 1.950 1.00 1.74 H ATOM 1161 HD23 LEU A 77 -5.517 5.715 3.453 1.00 1.79 H ATOM 1162 N ILE A 78 -7.635 0.797 2.702 1.00 0.31 N ATOM 1163 CA ILE A 78 -8.257 0.113 1.596 1.00 0.32 C ATOM 1164 C ILE A 78 -9.176 -0.976 2.127 1.00 0.29 C ATOM 1165 O ILE A 78 -10.328 -1.067 1.714 1.00 0.33 O ATOM 1166 CB ILE A 78 -7.186 -0.474 0.635 1.00 0.39 C ATOM 1167 CG1 ILE A 78 -6.381 0.681 0.017 1.00 0.53 C ATOM 1168 CG2 ILE A 78 -7.827 -1.346 -0.455 1.00 0.44 C ATOM 1169 CD1 ILE A 78 -5.291 0.247 -0.929 1.00 0.63 C ATOM 1170 H ILE A 78 -6.674 0.674 2.868 1.00 0.33 H ATOM 1171 HA ILE A 78 -8.853 0.836 1.057 1.00 0.39 H ATOM 1172 HB ILE A 78 -6.512 -1.093 1.209 1.00 0.40 H ATOM 1173 HG12 ILE A 78 -7.049 1.324 -0.538 1.00 1.11 H ATOM 1174 HG13 ILE A 78 -5.931 1.255 0.812 1.00 1.01 H ATOM 1175 HG21 ILE A 78 -7.052 -1.726 -1.104 1.00 1.18 H ATOM 1176 HG22 ILE A 78 -8.518 -0.754 -1.035 1.00 0.99 H ATOM 1177 HG23 ILE A 78 -8.342 -2.174 0.011 1.00 1.11 H ATOM 1178 HD11 ILE A 78 -4.780 1.117 -1.316 1.00 1.29 H ATOM 1179 HD12 ILE A 78 -5.733 -0.296 -1.751 1.00 1.27 H ATOM 1180 HD13 ILE A 78 -4.589 -0.386 -0.408 1.00 1.30 H ATOM 1181 N ASN A 79 -8.663 -1.769 3.072 1.00 0.30 N ATOM 1182 CA ASN A 79 -9.431 -2.867 3.702 1.00 0.33 C ATOM 1183 C ASN A 79 -10.767 -2.386 4.244 1.00 0.37 C ATOM 1184 O ASN A 79 -11.812 -3.004 3.997 1.00 0.46 O ATOM 1185 CB ASN A 79 -8.653 -3.520 4.852 1.00 0.42 C ATOM 1186 CG ASN A 79 -7.593 -4.530 4.442 1.00 0.53 C ATOM 1187 OD1 ASN A 79 -7.347 -5.469 5.164 1.00 1.21 O ATOM 1188 ND2 ASN A 79 -6.948 -4.350 3.318 1.00 0.55 N ATOM 1189 H ASN A 79 -7.745 -1.584 3.375 1.00 0.32 H ATOM 1190 HA ASN A 79 -9.616 -3.614 2.945 1.00 0.39 H ATOM 1191 HB2 ASN A 79 -8.162 -2.745 5.420 1.00 0.48 H ATOM 1192 HB3 ASN A 79 -9.360 -4.016 5.501 1.00 0.47 H ATOM 1193 HD21 ASN A 79 -7.157 -3.567 2.768 1.00 1.07 H ATOM 1194 HD22 ASN A 79 -6.267 -5.015 3.076 1.00 0.51 H ATOM 1195 N GLY A 80 -10.729 -1.285 4.958 1.00 0.37 N ATOM 1196 CA GLY A 80 -11.915 -0.731 5.539 1.00 0.46 C ATOM 1197 C GLY A 80 -12.852 -0.139 4.510 1.00 0.47 C ATOM 1198 O GLY A 80 -14.079 -0.268 4.630 1.00 0.57 O ATOM 1199 H GLY A 80 -9.865 -0.839 5.117 1.00 0.36 H ATOM 1200 HA2 GLY A 80 -12.436 -1.508 6.077 1.00 0.53 H ATOM 1201 HA3 GLY A 80 -11.632 0.043 6.237 1.00 0.49 H ATOM 1202 N ALA A 81 -12.288 0.485 3.488 1.00 0.43 N ATOM 1203 CA ALA A 81 -13.081 1.134 2.456 1.00 0.49 C ATOM 1204 C ALA A 81 -13.835 0.108 1.619 1.00 0.54 C ATOM 1205 O ALA A 81 -14.931 0.383 1.126 1.00 0.68 O ATOM 1206 CB ALA A 81 -12.205 2.015 1.591 1.00 0.49 C ATOM 1207 H ALA A 81 -11.307 0.512 3.419 1.00 0.39 H ATOM 1208 HA ALA A 81 -13.807 1.761 2.955 1.00 0.55 H ATOM 1209 HB1 ALA A 81 -12.825 2.527 0.870 1.00 1.19 H ATOM 1210 HB2 ALA A 81 -11.461 1.405 1.100 1.00 1.14 H ATOM 1211 HB3 ALA A 81 -11.712 2.742 2.218 1.00 1.01 H ATOM 1212 N LEU A 82 -13.237 -1.070 1.469 1.00 0.48 N ATOM 1213 CA LEU A 82 -13.841 -2.198 0.747 1.00 0.57 C ATOM 1214 C LEU A 82 -15.246 -2.513 1.249 1.00 0.70 C ATOM 1215 O LEU A 82 -16.175 -2.624 0.469 1.00 0.87 O ATOM 1216 CB LEU A 82 -12.975 -3.452 0.904 1.00 0.54 C ATOM 1217 CG LEU A 82 -11.603 -3.424 0.241 1.00 0.55 C ATOM 1218 CD1 LEU A 82 -10.779 -4.605 0.704 1.00 0.61 C ATOM 1219 CD2 LEU A 82 -11.747 -3.453 -1.269 1.00 0.63 C ATOM 1220 H LEU A 82 -12.329 -1.172 1.830 1.00 0.42 H ATOM 1221 HA LEU A 82 -13.884 -1.945 -0.303 1.00 0.62 H ATOM 1222 HB2 LEU A 82 -12.832 -3.629 1.959 1.00 0.56 H ATOM 1223 HB3 LEU A 82 -13.527 -4.287 0.497 1.00 0.59 H ATOM 1224 HG LEU A 82 -11.088 -2.516 0.515 1.00 0.57 H ATOM 1225 HD11 LEU A 82 -10.667 -4.568 1.777 1.00 1.16 H ATOM 1226 HD12 LEU A 82 -9.803 -4.573 0.241 1.00 1.10 H ATOM 1227 HD13 LEU A 82 -11.275 -5.523 0.429 1.00 1.22 H ATOM 1228 HD21 LEU A 82 -10.769 -3.431 -1.724 1.00 1.12 H ATOM 1229 HD22 LEU A 82 -12.319 -2.599 -1.598 1.00 1.26 H ATOM 1230 HD23 LEU A 82 -12.254 -4.360 -1.560 1.00 1.22 H ATOM 1231 N ALA A 83 -15.407 -2.586 2.558 1.00 0.69 N ATOM 1232 CA ALA A 83 -16.681 -3.001 3.147 1.00 0.87 C ATOM 1233 C ALA A 83 -17.717 -1.886 3.162 1.00 1.01 C ATOM 1234 O ALA A 83 -18.851 -2.091 3.604 1.00 1.25 O ATOM 1235 CB ALA A 83 -16.473 -3.576 4.536 1.00 0.90 C ATOM 1236 H ALA A 83 -14.658 -2.340 3.145 1.00 0.62 H ATOM 1237 HA ALA A 83 -17.093 -3.780 2.521 1.00 0.97 H ATOM 1238 HB1 ALA A 83 -16.134 -2.796 5.202 1.00 1.39 H ATOM 1239 HB2 ALA A 83 -15.732 -4.360 4.485 1.00 1.30 H ATOM 1240 HB3 ALA A 83 -17.405 -3.983 4.898 1.00 1.25 H ATOM 1241 N GLU A 84 -17.352 -0.721 2.668 1.00 0.95 N ATOM 1242 CA GLU A 84 -18.296 0.376 2.593 1.00 1.11 C ATOM 1243 C GLU A 84 -19.121 0.234 1.316 1.00 1.18 C ATOM 1244 O GLU A 84 -20.138 0.907 1.133 1.00 1.36 O ATOM 1245 CB GLU A 84 -17.581 1.722 2.618 1.00 1.15 C ATOM 1246 CG GLU A 84 -16.648 1.899 3.797 1.00 1.57 C ATOM 1247 CD GLU A 84 -16.067 3.280 3.861 1.00 1.76 C ATOM 1248 OE1 GLU A 84 -15.340 3.681 2.926 1.00 1.86 O ATOM 1249 OE2 GLU A 84 -16.356 4.008 4.833 1.00 2.49 O ATOM 1250 H GLU A 84 -16.433 -0.593 2.346 1.00 0.84 H ATOM 1251 HA GLU A 84 -18.958 0.299 3.443 1.00 1.28 H ATOM 1252 HB2 GLU A 84 -17.001 1.826 1.712 1.00 1.60 H ATOM 1253 HB3 GLU A 84 -18.318 2.510 2.649 1.00 1.38 H ATOM 1254 HG2 GLU A 84 -17.193 1.709 4.711 1.00 2.14 H ATOM 1255 HG3 GLU A 84 -15.840 1.190 3.703 1.00 2.20 H ATOM 1256 N ALA A 85 -18.660 -0.637 0.444 1.00 1.15 N ATOM 1257 CA ALA A 85 -19.333 -0.945 -0.785 1.00 1.34 C ATOM 1258 C ALA A 85 -19.539 -2.451 -0.864 1.00 1.47 C ATOM 1259 O ALA A 85 -18.593 -3.216 -1.022 1.00 1.86 O ATOM 1260 CB ALA A 85 -18.535 -0.435 -1.978 1.00 1.37 C ATOM 1261 H ALA A 85 -17.828 -1.118 0.646 1.00 1.07 H ATOM 1262 HA ALA A 85 -20.299 -0.461 -0.771 1.00 1.54 H ATOM 1263 HB1 ALA A 85 -18.414 0.636 -1.901 1.00 1.61 H ATOM 1264 HB2 ALA A 85 -19.061 -0.676 -2.890 1.00 1.71 H ATOM 1265 HB3 ALA A 85 -17.566 -0.910 -1.991 1.00 1.82 H ATOM 1266 N ALA A 86 -20.750 -2.864 -0.688 1.00 1.53 N ATOM 1267 CA ALA A 86 -21.091 -4.257 -0.705 1.00 1.70 C ATOM 1268 C ALA A 86 -21.396 -4.711 -2.128 1.00 2.36 C ATOM 1269 O ALA A 86 -22.520 -4.465 -2.607 1.00 2.86 O ATOM 1270 CB ALA A 86 -22.264 -4.530 0.229 1.00 2.39 C ATOM 1271 OXT ALA A 86 -20.518 -5.320 -2.772 1.00 3.03 O ATOM 1272 H ALA A 86 -21.443 -2.184 -0.559 1.00 1.73 H ATOM 1273 HA ALA A 86 -20.232 -4.803 -0.342 1.00 1.65 H ATOM 1274 HB1 ALA A 86 -22.015 -4.203 1.229 1.00 2.96 H ATOM 1275 HB2 ALA A 86 -22.472 -5.590 0.239 1.00 2.75 H ATOM 1276 HB3 ALA A 86 -23.137 -3.998 -0.120 1.00 2.71 H TER 1277 ALA A 86 HETATM 1278 P24 SXR A 101 6.377 12.055 -3.599 1.00 1.19 P HETATM 1279 O26 SXR A 101 6.254 11.987 -5.136 1.00 1.72 O HETATM 1280 O23 SXR A 101 7.405 13.077 -3.042 1.00 1.83 O HETATM 1281 O27 SXR A 101 4.978 12.414 -2.964 1.00 1.31 O HETATM 1282 C28 SXR A 101 3.715 11.730 -3.419 1.00 1.24 C HETATM 1283 C29 SXR A 101 2.536 12.064 -2.468 1.00 1.82 C HETATM 1284 C30 SXR A 101 2.563 13.564 -2.246 1.00 2.42 C HETATM 1285 C31 SXR A 101 1.200 11.674 -3.110 1.00 1.85 C HETATM 1286 C32 SXR A 101 2.725 11.287 -1.083 1.00 2.74 C HETATM 1287 O33 SXR A 101 2.743 9.881 -1.324 1.00 3.00 O HETATM 1288 C34 SXR A 101 1.546 11.517 -0.142 1.00 3.44 C HETATM 1289 O35 SXR A 101 0.589 10.738 -0.174 1.00 3.88 O HETATM 1290 N36 SXR A 101 1.601 12.533 0.694 1.00 3.90 N HETATM 1291 C37 SXR A 101 0.530 12.841 1.656 1.00 4.60 C HETATM 1292 C38 SXR A 101 0.131 14.328 1.673 1.00 4.73 C HETATM 1293 C39 SXR A 101 -0.447 14.867 0.349 1.00 4.02 C HETATM 1294 O40 SXR A 101 -0.657 16.084 0.188 1.00 4.42 O HETATM 1295 N41 SXR A 101 -0.673 13.960 -0.590 1.00 3.33 N HETATM 1296 C42 SXR A 101 -1.189 14.247 -1.913 1.00 2.88 C HETATM 1297 C43 SXR A 101 -2.390 13.403 -2.256 1.00 2.85 C HETATM 1298 S1 SXR A 101 -2.665 13.421 -3.949 1.00 3.15 S HETATM 1299 C11 SXR A 101 -2.763 6.711 -2.198 1.00 2.09 C HETATM 1300 C10 SXR A 101 -2.389 6.522 -0.866 1.00 2.05 C HETATM 1301 C9 SXR A 101 -1.113 6.902 -0.444 1.00 1.91 C HETATM 1302 C8 SXR A 101 -0.215 7.470 -1.349 1.00 2.19 C HETATM 1303 C7 SXR A 101 -0.594 7.657 -2.673 1.00 2.18 C HETATM 1304 C6 SXR A 101 -1.872 7.279 -3.117 1.00 1.95 C HETATM 1305 C5 SXR A 101 -2.273 7.482 -4.543 1.00 2.57 C HETATM 1306 C4 SXR A 101 -2.303 8.932 -4.923 1.00 2.29 C HETATM 1307 C3 SXR A 101 -3.677 9.584 -4.860 1.00 2.88 C HETATM 1308 O3 SXR A 101 -4.698 8.916 -5.043 1.00 3.69 O HETATM 1309 C2 SXR A 101 -3.781 11.065 -4.591 1.00 2.88 C HETATM 1310 C1 SXR A 101 -2.471 11.738 -4.248 1.00 2.84 C HETATM 1311 H28A SXR A 101 3.475 12.084 -4.410 1.00 1.41 H HETATM 1312 H28B SXR A 101 3.858 10.657 -3.441 1.00 0.99 H HETATM 1313 H30A SXR A 101 1.788 13.838 -1.544 1.00 2.99 H HETATM 1314 H30B SXR A 101 2.392 14.060 -3.190 1.00 2.62 H HETATM 1315 H30C SXR A 101 3.531 13.836 -1.855 1.00 2.79 H HETATM 1316 H31A SXR A 101 0.477 12.460 -2.928 1.00 2.21 H HETATM 1317 H31B SXR A 101 0.846 10.754 -2.671 1.00 2.37 H HETATM 1318 H31C SXR A 101 1.334 11.544 -4.174 1.00 1.95 H HETATM 1319 H32A SXR A 101 3.652 11.588 -0.615 1.00 3.10 H HETATM 1320 H33A SXR A 101 1.893 9.603 -0.956 1.00 3.40 H HETATM 1321 H36A SXR A 101 2.399 13.110 0.695 1.00 3.96 H HETATM 1322 H37A SXR A 101 -0.343 12.252 1.416 1.00 4.70 H HETATM 1323 H37B SXR A 101 0.869 12.573 2.645 1.00 5.21 H HETATM 1324 H38A SXR A 101 -0.622 14.468 2.436 1.00 5.22 H HETATM 1325 H38B SXR A 101 1.003 14.911 1.934 1.00 5.25 H HETATM 1326 H41A SXR A 101 -0.473 13.018 -0.395 1.00 3.43 H HETATM 1327 H42A SXR A 101 -1.381 15.297 -2.039 1.00 3.18 H HETATM 1328 H42B SXR A 101 -0.425 13.983 -2.631 1.00 2.75 H HETATM 1329 H43A SXR A 101 -3.267 13.738 -1.722 1.00 3.20 H HETATM 1330 H43B SXR A 101 -2.164 12.385 -1.968 1.00 2.98 H HETATM 1331 H11A SXR A 101 -3.749 6.416 -2.527 1.00 2.81 H HETATM 1332 H10A SXR A 101 -3.080 6.084 -0.161 1.00 2.73 H HETATM 1333 H9A SXR A 101 -0.818 6.759 0.585 1.00 2.32 H HETATM 1334 H8A SXR A 101 0.771 7.766 -1.022 1.00 2.94 H HETATM 1335 H7A SXR A 101 0.098 8.097 -3.377 1.00 2.89 H HETATM 1336 H5A SXR A 101 -2.210 6.768 -5.343 1.00 3.45 H HETATM 1337 H5B SXR A 101 -3.265 7.100 -4.315 1.00 2.83 H HETATM 1338 H4A SXR A 101 -1.480 9.603 -4.770 1.00 2.15 H HETATM 1339 H4B SXR A 101 -1.898 8.698 -5.911 1.00 2.47 H HETATM 1340 H2A SXR A 101 -4.558 11.719 -4.942 1.00 3.20 H HETATM 1341 H2B SXR A 101 -4.397 10.899 -3.709 1.00 3.39 H HETATM 1342 H1A SXR A 101 -1.555 11.283 -3.913 1.00 3.11 H HETATM 1343 H1B SXR A 101 -2.150 11.606 -5.280 1.00 2.74 H