ATOM 1 N MET A 1 -18.195 -14.519 -0.086 1.00 3.07 N ATOM 2 CA MET A 1 -17.542 -13.419 -0.777 1.00 2.76 C ATOM 3 C MET A 1 -17.170 -12.325 0.196 1.00 2.34 C ATOM 4 O MET A 1 -18.037 -11.697 0.801 1.00 2.38 O ATOM 5 CB MET A 1 -18.443 -12.835 -1.874 1.00 2.93 C ATOM 6 CG MET A 1 -17.781 -11.706 -2.669 1.00 3.33 C ATOM 7 SD MET A 1 -18.905 -10.889 -3.818 1.00 4.18 S ATOM 8 CE MET A 1 -20.073 -10.166 -2.663 1.00 4.50 C ATOM 9 H1 MET A 1 -19.131 -14.260 0.285 1.00 3.22 H ATOM 10 H2 MET A 1 -17.578 -14.785 0.711 1.00 3.51 H ATOM 11 H3 MET A 1 -18.261 -15.337 -0.726 1.00 3.36 H ATOM 12 HA MET A 1 -16.646 -13.809 -1.233 1.00 3.37 H ATOM 13 HB2 MET A 1 -18.706 -13.627 -2.559 1.00 3.26 H ATOM 14 HB3 MET A 1 -19.337 -12.446 -1.414 1.00 3.26 H ATOM 15 HG2 MET A 1 -17.417 -10.959 -1.974 1.00 3.63 H ATOM 16 HG3 MET A 1 -16.948 -12.113 -3.229 1.00 3.51 H ATOM 17 HE1 MET A 1 -20.565 -10.942 -2.094 1.00 4.67 H ATOM 18 HE2 MET A 1 -20.818 -9.604 -3.202 1.00 4.75 H ATOM 19 HE3 MET A 1 -19.536 -9.497 -2.003 1.00 4.79 H ATOM 20 N ALA A 2 -15.885 -12.141 0.357 1.00 2.23 N ATOM 21 CA ALA A 2 -15.306 -11.094 1.150 1.00 1.97 C ATOM 22 C ALA A 2 -13.876 -10.976 0.680 1.00 1.62 C ATOM 23 O ALA A 2 -12.992 -11.691 1.138 1.00 1.83 O ATOM 24 CB ALA A 2 -15.380 -11.405 2.645 1.00 2.32 C ATOM 25 H ALA A 2 -15.240 -12.740 -0.077 1.00 2.55 H ATOM 26 HA ALA A 2 -15.832 -10.174 0.931 1.00 2.02 H ATOM 27 HB1 ALA A 2 -14.901 -10.608 3.199 1.00 2.39 H ATOM 28 HB2 ALA A 2 -14.884 -12.343 2.847 1.00 2.57 H ATOM 29 HB3 ALA A 2 -16.421 -11.475 2.939 1.00 2.91 H ATOM 30 N THR A 3 -13.679 -10.160 -0.299 1.00 1.33 N ATOM 31 CA THR A 3 -12.410 -10.050 -0.958 1.00 1.10 C ATOM 32 C THR A 3 -11.465 -9.075 -0.229 1.00 0.90 C ATOM 33 O THR A 3 -11.297 -7.917 -0.631 1.00 0.87 O ATOM 34 CB THR A 3 -12.636 -9.597 -2.403 1.00 1.27 C ATOM 35 OG1 THR A 3 -13.883 -10.171 -2.888 1.00 1.70 O ATOM 36 CG2 THR A 3 -11.496 -10.079 -3.291 1.00 1.78 C ATOM 37 H THR A 3 -14.401 -9.602 -0.649 1.00 1.46 H ATOM 38 HA THR A 3 -11.951 -11.025 -0.981 1.00 1.16 H ATOM 39 HB THR A 3 -12.692 -8.521 -2.431 1.00 1.61 H ATOM 40 HG1 THR A 3 -14.321 -9.467 -3.392 1.00 2.16 H ATOM 41 HG21 THR A 3 -11.461 -11.159 -3.263 1.00 2.24 H ATOM 42 HG22 THR A 3 -10.560 -9.681 -2.921 1.00 2.32 H ATOM 43 HG23 THR A 3 -11.669 -9.755 -4.309 1.00 2.10 H ATOM 44 N LEU A 4 -10.937 -9.517 0.890 1.00 0.86 N ATOM 45 CA LEU A 4 -9.961 -8.736 1.623 1.00 0.72 C ATOM 46 C LEU A 4 -8.566 -9.113 1.171 1.00 0.67 C ATOM 47 O LEU A 4 -8.219 -10.295 1.152 1.00 0.83 O ATOM 48 CB LEU A 4 -10.058 -8.916 3.168 1.00 0.71 C ATOM 49 CG LEU A 4 -11.307 -8.374 3.903 1.00 0.87 C ATOM 50 CD1 LEU A 4 -11.573 -6.921 3.554 1.00 0.80 C ATOM 51 CD2 LEU A 4 -12.539 -9.228 3.661 1.00 1.75 C ATOM 52 H LEU A 4 -11.206 -10.400 1.222 1.00 1.00 H ATOM 53 HA LEU A 4 -10.121 -7.698 1.377 1.00 0.73 H ATOM 54 HB2 LEU A 4 -9.982 -9.970 3.388 1.00 0.79 H ATOM 55 HB3 LEU A 4 -9.188 -8.436 3.598 1.00 0.64 H ATOM 56 HG LEU A 4 -11.088 -8.390 4.962 1.00 1.34 H ATOM 57 HD11 LEU A 4 -12.455 -6.584 4.079 1.00 1.23 H ATOM 58 HD12 LEU A 4 -11.742 -6.847 2.487 1.00 1.38 H ATOM 59 HD13 LEU A 4 -10.719 -6.327 3.843 1.00 1.46 H ATOM 60 HD21 LEU A 4 -13.385 -8.804 4.177 1.00 2.19 H ATOM 61 HD22 LEU A 4 -12.370 -10.233 4.018 1.00 2.26 H ATOM 62 HD23 LEU A 4 -12.755 -9.257 2.605 1.00 2.25 H ATOM 63 N LEU A 5 -7.787 -8.124 0.779 1.00 0.55 N ATOM 64 CA LEU A 5 -6.406 -8.380 0.436 1.00 0.51 C ATOM 65 C LEU A 5 -5.621 -8.584 1.698 1.00 0.46 C ATOM 66 O LEU A 5 -5.877 -7.909 2.713 1.00 0.50 O ATOM 67 CB LEU A 5 -5.755 -7.281 -0.427 1.00 0.53 C ATOM 68 CG LEU A 5 -5.766 -5.847 0.100 1.00 0.62 C ATOM 69 CD1 LEU A 5 -4.474 -5.159 -0.255 1.00 0.66 C ATOM 70 CD2 LEU A 5 -6.908 -5.068 -0.520 1.00 0.95 C ATOM 71 H LEU A 5 -8.158 -7.222 0.747 1.00 0.61 H ATOM 72 HA LEU A 5 -6.399 -9.309 -0.109 1.00 0.58 H ATOM 73 HB2 LEU A 5 -4.728 -7.570 -0.588 1.00 0.53 H ATOM 74 HB3 LEU A 5 -6.258 -7.288 -1.383 1.00 0.60 H ATOM 75 HG LEU A 5 -5.898 -5.847 1.170 1.00 0.90 H ATOM 76 HD11 LEU A 5 -4.342 -5.148 -1.325 1.00 1.08 H ATOM 77 HD12 LEU A 5 -3.661 -5.699 0.201 1.00 1.41 H ATOM 78 HD13 LEU A 5 -4.484 -4.146 0.115 1.00 1.22 H ATOM 79 HD21 LEU A 5 -7.855 -5.527 -0.290 1.00 1.46 H ATOM 80 HD22 LEU A 5 -6.788 -5.044 -1.594 1.00 1.57 H ATOM 81 HD23 LEU A 5 -6.899 -4.058 -0.137 1.00 1.37 H ATOM 82 N THR A 6 -4.682 -9.490 1.652 1.00 0.47 N ATOM 83 CA THR A 6 -3.906 -9.813 2.806 1.00 0.49 C ATOM 84 C THR A 6 -2.716 -8.872 2.952 1.00 0.40 C ATOM 85 O THR A 6 -2.500 -7.977 2.116 1.00 0.38 O ATOM 86 CB THR A 6 -3.394 -11.268 2.750 1.00 0.70 C ATOM 87 OG1 THR A 6 -2.587 -11.455 1.564 1.00 0.82 O ATOM 88 CG2 THR A 6 -4.556 -12.253 2.746 1.00 0.93 C ATOM 89 H THR A 6 -4.493 -9.959 0.806 1.00 0.54 H ATOM 90 HA THR A 6 -4.555 -9.721 3.665 1.00 0.55 H ATOM 91 HB THR A 6 -2.769 -11.453 3.612 1.00 0.73 H ATOM 92 HG1 THR A 6 -3.124 -11.271 0.777 1.00 1.33 H ATOM 93 HG21 THR A 6 -5.150 -12.122 3.641 1.00 1.33 H ATOM 94 HG22 THR A 6 -4.173 -13.263 2.712 1.00 1.32 H ATOM 95 HG23 THR A 6 -5.166 -12.078 1.876 1.00 1.55 H ATOM 96 N THR A 7 -1.931 -9.099 3.971 1.00 0.44 N ATOM 97 CA THR A 7 -0.730 -8.360 4.204 1.00 0.42 C ATOM 98 C THR A 7 0.284 -8.692 3.093 1.00 0.37 C ATOM 99 O THR A 7 1.058 -7.835 2.652 1.00 0.39 O ATOM 100 CB THR A 7 -0.173 -8.785 5.552 1.00 0.50 C ATOM 101 OG1 THR A 7 -1.262 -8.869 6.486 1.00 0.58 O ATOM 102 CG2 THR A 7 0.833 -7.768 6.042 1.00 0.54 C ATOM 103 H THR A 7 -2.167 -9.751 4.665 1.00 0.52 H ATOM 104 HA THR A 7 -0.937 -7.301 4.216 1.00 0.44 H ATOM 105 HB THR A 7 0.298 -9.755 5.471 1.00 0.53 H ATOM 106 HG1 THR A 7 -1.318 -8.040 6.971 1.00 0.94 H ATOM 107 HG21 THR A 7 1.645 -7.708 5.336 1.00 1.06 H ATOM 108 HG22 THR A 7 1.217 -8.047 7.010 1.00 1.24 H ATOM 109 HG23 THR A 7 0.335 -6.812 6.087 1.00 1.08 H ATOM 110 N ASP A 8 0.218 -9.936 2.599 1.00 0.41 N ATOM 111 CA ASP A 8 1.109 -10.374 1.543 1.00 0.46 C ATOM 112 C ASP A 8 0.726 -9.777 0.228 1.00 0.42 C ATOM 113 O ASP A 8 1.552 -9.619 -0.653 1.00 0.47 O ATOM 114 CB ASP A 8 1.211 -11.890 1.436 1.00 0.62 C ATOM 115 CG ASP A 8 2.126 -12.478 2.472 1.00 1.41 C ATOM 116 OD1 ASP A 8 3.346 -12.518 2.254 1.00 1.98 O ATOM 117 OD2 ASP A 8 1.628 -12.899 3.544 1.00 2.01 O ATOM 118 H ASP A 8 -0.459 -10.558 2.941 1.00 0.48 H ATOM 119 HA ASP A 8 2.081 -9.986 1.809 1.00 0.52 H ATOM 120 HB2 ASP A 8 0.235 -12.342 1.545 1.00 0.86 H ATOM 121 HB3 ASP A 8 1.601 -12.150 0.462 1.00 1.09 H ATOM 122 N ASP A 9 -0.532 -9.422 0.095 1.00 0.41 N ATOM 123 CA ASP A 9 -0.995 -8.755 -1.111 1.00 0.46 C ATOM 124 C ASP A 9 -0.454 -7.362 -1.160 1.00 0.40 C ATOM 125 O ASP A 9 0.014 -6.911 -2.201 1.00 0.46 O ATOM 126 CB ASP A 9 -2.516 -8.747 -1.239 1.00 0.54 C ATOM 127 CG ASP A 9 -3.064 -10.106 -1.542 1.00 0.98 C ATOM 128 OD1 ASP A 9 -2.844 -10.614 -2.655 1.00 1.21 O ATOM 129 OD2 ASP A 9 -3.772 -10.667 -0.684 1.00 1.83 O ATOM 130 H ASP A 9 -1.151 -9.615 0.831 1.00 0.43 H ATOM 131 HA ASP A 9 -0.568 -9.285 -1.948 1.00 0.53 H ATOM 132 HB2 ASP A 9 -2.956 -8.397 -0.317 1.00 1.16 H ATOM 133 HB3 ASP A 9 -2.784 -8.085 -2.046 1.00 0.89 H ATOM 134 N LEU A 10 -0.503 -6.693 -0.022 1.00 0.36 N ATOM 135 CA LEU A 10 0.074 -5.374 0.129 1.00 0.35 C ATOM 136 C LEU A 10 1.579 -5.463 -0.129 1.00 0.33 C ATOM 137 O LEU A 10 2.136 -4.685 -0.897 1.00 0.36 O ATOM 138 CB LEU A 10 -0.185 -4.844 1.547 1.00 0.37 C ATOM 139 CG LEU A 10 0.383 -3.446 1.876 1.00 0.41 C ATOM 140 CD1 LEU A 10 -0.279 -2.367 1.028 1.00 0.51 C ATOM 141 CD2 LEU A 10 0.206 -3.154 3.346 1.00 0.48 C ATOM 142 H LEU A 10 -0.958 -7.102 0.744 1.00 0.35 H ATOM 143 HA LEU A 10 -0.384 -4.709 -0.589 1.00 0.39 H ATOM 144 HB2 LEU A 10 -1.255 -4.829 1.703 1.00 0.42 H ATOM 145 HB3 LEU A 10 0.246 -5.558 2.233 1.00 0.36 H ATOM 146 HG LEU A 10 1.442 -3.438 1.654 1.00 0.39 H ATOM 147 HD11 LEU A 10 -1.341 -2.354 1.220 1.00 1.18 H ATOM 148 HD12 LEU A 10 -0.100 -2.577 -0.016 1.00 0.95 H ATOM 149 HD13 LEU A 10 0.141 -1.403 1.280 1.00 1.26 H ATOM 150 HD21 LEU A 10 0.735 -3.902 3.918 1.00 1.12 H ATOM 151 HD22 LEU A 10 -0.841 -3.174 3.609 1.00 1.06 H ATOM 152 HD23 LEU A 10 0.611 -2.179 3.566 1.00 1.05 H ATOM 153 N ARG A 11 2.203 -6.459 0.505 1.00 0.33 N ATOM 154 CA ARG A 11 3.629 -6.766 0.346 1.00 0.37 C ATOM 155 C ARG A 11 3.981 -6.937 -1.144 1.00 0.39 C ATOM 156 O ARG A 11 4.869 -6.273 -1.650 1.00 0.45 O ATOM 157 CB ARG A 11 3.981 -8.045 1.168 1.00 0.45 C ATOM 158 CG ARG A 11 5.407 -8.583 1.009 1.00 0.72 C ATOM 159 CD ARG A 11 5.653 -9.830 1.893 1.00 0.63 C ATOM 160 NE ARG A 11 5.831 -9.508 3.327 1.00 1.12 N ATOM 161 CZ ARG A 11 5.403 -10.267 4.386 1.00 1.36 C ATOM 162 NH1 ARG A 11 4.606 -11.307 4.211 1.00 1.47 N ATOM 163 NH2 ARG A 11 5.805 -9.948 5.621 1.00 2.27 N ATOM 164 H ARG A 11 1.675 -7.012 1.121 1.00 0.33 H ATOM 165 HA ARG A 11 4.182 -5.929 0.744 1.00 0.41 H ATOM 166 HB2 ARG A 11 3.842 -7.829 2.217 1.00 0.92 H ATOM 167 HB3 ARG A 11 3.299 -8.830 0.876 1.00 1.06 H ATOM 168 HG2 ARG A 11 5.569 -8.863 -0.024 1.00 1.30 H ATOM 169 HG3 ARG A 11 6.106 -7.807 1.298 1.00 1.20 H ATOM 170 HD2 ARG A 11 4.820 -10.508 1.791 1.00 1.17 H ATOM 171 HD3 ARG A 11 6.549 -10.319 1.538 1.00 1.14 H ATOM 172 HE ARG A 11 6.395 -8.719 3.498 1.00 1.86 H ATOM 173 HH11 ARG A 11 4.259 -11.628 3.313 1.00 1.69 H ATOM 174 HH12 ARG A 11 4.276 -11.888 4.970 1.00 1.97 H ATOM 175 HH21 ARG A 11 6.421 -9.164 5.748 1.00 2.91 H ATOM 176 HH22 ARG A 11 5.572 -10.446 6.468 1.00 2.56 H ATOM 177 N ARG A 12 3.237 -7.791 -1.840 1.00 0.40 N ATOM 178 CA ARG A 12 3.473 -8.054 -3.251 1.00 0.48 C ATOM 179 C ARG A 12 3.281 -6.822 -4.124 1.00 0.47 C ATOM 180 O ARG A 12 4.112 -6.547 -4.976 1.00 0.50 O ATOM 181 CB ARG A 12 2.621 -9.228 -3.778 1.00 0.56 C ATOM 182 CG ARG A 12 3.050 -10.592 -3.260 1.00 0.94 C ATOM 183 CD ARG A 12 2.213 -11.731 -3.854 1.00 1.18 C ATOM 184 NE ARG A 12 0.791 -11.707 -3.441 1.00 1.76 N ATOM 185 CZ ARG A 12 -0.026 -12.790 -3.513 1.00 2.29 C ATOM 186 NH1 ARG A 12 0.439 -13.933 -3.990 1.00 2.31 N ATOM 187 NH2 ARG A 12 -1.304 -12.719 -3.157 1.00 3.30 N ATOM 188 H ARG A 12 2.513 -8.273 -1.382 1.00 0.37 H ATOM 189 HA ARG A 12 4.513 -8.331 -3.335 1.00 0.54 H ATOM 190 HB2 ARG A 12 1.590 -9.079 -3.489 1.00 0.67 H ATOM 191 HB3 ARG A 12 2.678 -9.239 -4.855 1.00 0.85 H ATOM 192 HG2 ARG A 12 4.088 -10.736 -3.527 1.00 1.27 H ATOM 193 HG3 ARG A 12 2.949 -10.600 -2.180 1.00 1.35 H ATOM 194 HD2 ARG A 12 2.249 -11.660 -4.932 1.00 1.87 H ATOM 195 HD3 ARG A 12 2.648 -12.678 -3.561 1.00 1.53 H ATOM 196 HE ARG A 12 0.458 -10.849 -3.104 1.00 2.26 H ATOM 197 HH11 ARG A 12 1.374 -14.047 -4.338 1.00 2.24 H ATOM 198 HH12 ARG A 12 -0.099 -14.782 -4.010 1.00 2.84 H ATOM 199 HH21 ARG A 12 -1.774 -11.882 -2.824 1.00 3.81 H ATOM 200 HH22 ARG A 12 -1.908 -13.526 -3.203 1.00 3.77 H ATOM 201 N ALA A 13 2.211 -6.080 -3.887 1.00 0.47 N ATOM 202 CA ALA A 13 1.906 -4.879 -4.674 1.00 0.53 C ATOM 203 C ALA A 13 2.973 -3.812 -4.490 1.00 0.46 C ATOM 204 O ALA A 13 3.363 -3.131 -5.455 1.00 0.48 O ATOM 205 CB ALA A 13 0.552 -4.331 -4.309 1.00 0.63 C ATOM 206 H ALA A 13 1.592 -6.347 -3.174 1.00 0.47 H ATOM 207 HA ALA A 13 1.891 -5.175 -5.711 1.00 0.61 H ATOM 208 HB1 ALA A 13 0.570 -4.010 -3.281 1.00 1.11 H ATOM 209 HB2 ALA A 13 -0.201 -5.095 -4.431 1.00 1.26 H ATOM 210 HB3 ALA A 13 0.314 -3.490 -4.941 1.00 1.21 H ATOM 211 N LEU A 14 3.465 -3.692 -3.266 1.00 0.42 N ATOM 212 CA LEU A 14 4.505 -2.730 -2.935 1.00 0.39 C ATOM 213 C LEU A 14 5.794 -3.114 -3.677 1.00 0.40 C ATOM 214 O LEU A 14 6.537 -2.258 -4.165 1.00 0.46 O ATOM 215 CB LEU A 14 4.698 -2.702 -1.401 1.00 0.45 C ATOM 216 CG LEU A 14 5.495 -1.534 -0.804 1.00 0.54 C ATOM 217 CD1 LEU A 14 4.820 -0.196 -1.099 1.00 0.44 C ATOM 218 CD2 LEU A 14 5.625 -1.710 0.696 1.00 1.00 C ATOM 219 H LEU A 14 3.096 -4.255 -2.550 1.00 0.44 H ATOM 220 HA LEU A 14 4.173 -1.759 -3.274 1.00 0.41 H ATOM 221 HB2 LEU A 14 3.716 -2.700 -0.954 1.00 0.73 H ATOM 222 HB3 LEU A 14 5.186 -3.622 -1.115 1.00 0.77 H ATOM 223 HG LEU A 14 6.491 -1.521 -1.226 1.00 0.97 H ATOM 224 HD11 LEU A 14 4.761 -0.028 -2.164 1.00 1.04 H ATOM 225 HD12 LEU A 14 5.394 0.602 -0.653 1.00 1.18 H ATOM 226 HD13 LEU A 14 3.828 -0.189 -0.674 1.00 1.11 H ATOM 227 HD21 LEU A 14 6.198 -0.895 1.115 1.00 1.59 H ATOM 228 HD22 LEU A 14 6.117 -2.648 0.915 1.00 1.48 H ATOM 229 HD23 LEU A 14 4.637 -1.712 1.132 1.00 1.54 H ATOM 230 N VAL A 15 6.009 -4.426 -3.810 1.00 0.44 N ATOM 231 CA VAL A 15 7.139 -4.970 -4.560 1.00 0.53 C ATOM 232 C VAL A 15 6.941 -4.747 -6.085 1.00 0.55 C ATOM 233 O VAL A 15 7.874 -4.317 -6.776 1.00 0.64 O ATOM 234 CB VAL A 15 7.355 -6.489 -4.256 1.00 0.61 C ATOM 235 CG1 VAL A 15 8.449 -7.098 -5.143 1.00 0.74 C ATOM 236 CG2 VAL A 15 7.733 -6.660 -2.792 1.00 0.64 C ATOM 237 H VAL A 15 5.379 -5.039 -3.369 1.00 0.47 H ATOM 238 HA VAL A 15 8.013 -4.419 -4.247 1.00 0.60 H ATOM 239 HB VAL A 15 6.425 -7.012 -4.427 1.00 0.63 H ATOM 240 HG11 VAL A 15 8.561 -8.147 -4.898 1.00 1.14 H ATOM 241 HG12 VAL A 15 9.385 -6.578 -4.982 1.00 1.39 H ATOM 242 HG13 VAL A 15 8.165 -6.999 -6.182 1.00 1.29 H ATOM 243 HG21 VAL A 15 8.652 -6.124 -2.603 1.00 1.14 H ATOM 244 HG22 VAL A 15 7.852 -7.711 -2.580 1.00 1.34 H ATOM 245 HG23 VAL A 15 6.939 -6.259 -2.179 1.00 1.13 H ATOM 246 N GLU A 16 5.722 -5.016 -6.601 1.00 0.59 N ATOM 247 CA GLU A 16 5.415 -4.801 -8.034 1.00 0.69 C ATOM 248 C GLU A 16 5.670 -3.351 -8.452 1.00 0.65 C ATOM 249 O GLU A 16 6.031 -3.077 -9.593 1.00 0.77 O ATOM 250 CB GLU A 16 3.968 -5.174 -8.383 1.00 0.89 C ATOM 251 CG GLU A 16 3.591 -6.628 -8.166 1.00 1.11 C ATOM 252 CD GLU A 16 2.163 -6.928 -8.612 1.00 1.54 C ATOM 253 OE1 GLU A 16 1.203 -6.434 -7.963 1.00 2.18 O ATOM 254 OE2 GLU A 16 1.976 -7.643 -9.610 1.00 1.95 O ATOM 255 H GLU A 16 5.019 -5.388 -6.016 1.00 0.60 H ATOM 256 HA GLU A 16 6.086 -5.424 -8.604 1.00 0.80 H ATOM 257 HB2 GLU A 16 3.314 -4.559 -7.783 1.00 0.91 H ATOM 258 HB3 GLU A 16 3.797 -4.928 -9.419 1.00 0.98 H ATOM 259 HG2 GLU A 16 4.270 -7.257 -8.723 1.00 1.44 H ATOM 260 HG3 GLU A 16 3.687 -6.851 -7.115 1.00 1.45 H ATOM 261 N SER A 17 5.511 -2.441 -7.515 1.00 0.59 N ATOM 262 CA SER A 17 5.716 -1.031 -7.770 1.00 0.64 C ATOM 263 C SER A 17 7.217 -0.701 -7.866 1.00 0.74 C ATOM 264 O SER A 17 7.607 0.288 -8.483 1.00 1.04 O ATOM 265 CB SER A 17 5.055 -0.227 -6.667 1.00 0.68 C ATOM 266 OG SER A 17 3.697 -0.636 -6.513 1.00 1.27 O ATOM 267 H SER A 17 5.242 -2.734 -6.619 1.00 0.58 H ATOM 268 HA SER A 17 5.237 -0.794 -8.710 1.00 0.75 H ATOM 269 HB2 SER A 17 5.580 -0.390 -5.738 1.00 1.10 H ATOM 270 HB3 SER A 17 5.085 0.823 -6.917 1.00 1.16 H ATOM 271 HG SER A 17 3.657 -1.563 -6.239 1.00 1.65 H ATOM 272 N ALA A 18 8.044 -1.534 -7.256 1.00 0.70 N ATOM 273 CA ALA A 18 9.472 -1.337 -7.293 1.00 0.87 C ATOM 274 C ALA A 18 10.030 -1.892 -8.596 1.00 1.05 C ATOM 275 O ALA A 18 10.974 -1.333 -9.174 1.00 1.57 O ATOM 276 CB ALA A 18 10.144 -1.987 -6.090 1.00 0.95 C ATOM 277 H ALA A 18 7.683 -2.311 -6.781 1.00 0.73 H ATOM 278 HA ALA A 18 9.659 -0.274 -7.270 1.00 1.09 H ATOM 279 HB1 ALA A 18 11.209 -1.815 -6.128 1.00 1.36 H ATOM 280 HB2 ALA A 18 9.951 -3.050 -6.096 1.00 1.48 H ATOM 281 HB3 ALA A 18 9.736 -1.551 -5.189 1.00 1.41 H ATOM 282 N GLY A 19 9.442 -2.979 -9.054 1.00 0.98 N ATOM 283 CA GLY A 19 9.815 -3.559 -10.314 1.00 1.32 C ATOM 284 C GLY A 19 9.980 -5.047 -10.228 1.00 1.47 C ATOM 285 O GLY A 19 9.389 -5.692 -9.366 1.00 1.85 O ATOM 286 H GLY A 19 8.763 -3.425 -8.505 1.00 1.01 H ATOM 287 HA2 GLY A 19 9.046 -3.336 -11.038 1.00 1.77 H ATOM 288 HA3 GLY A 19 10.745 -3.123 -10.646 1.00 1.79 H ATOM 289 N GLU A 20 10.757 -5.585 -11.134 1.00 1.96 N ATOM 290 CA GLU A 20 11.069 -6.996 -11.165 1.00 2.68 C ATOM 291 C GLU A 20 12.500 -7.161 -10.687 1.00 2.91 C ATOM 292 O GLU A 20 13.449 -7.144 -11.480 1.00 3.66 O ATOM 293 CB GLU A 20 10.922 -7.550 -12.601 1.00 3.52 C ATOM 294 CG GLU A 20 11.257 -9.030 -12.776 1.00 4.20 C ATOM 295 CD GLU A 20 10.268 -9.974 -12.135 1.00 4.87 C ATOM 296 OE1 GLU A 20 9.275 -10.340 -12.765 1.00 5.27 O ATOM 297 OE2 GLU A 20 10.467 -10.336 -10.950 1.00 5.31 O ATOM 298 H GLU A 20 11.185 -5.005 -11.800 1.00 2.18 H ATOM 299 HA GLU A 20 10.403 -7.525 -10.498 1.00 2.87 H ATOM 300 HB2 GLU A 20 9.900 -7.418 -12.921 1.00 3.77 H ATOM 301 HB3 GLU A 20 11.570 -6.979 -13.249 1.00 3.84 H ATOM 302 HG2 GLU A 20 11.294 -9.250 -13.832 1.00 4.47 H ATOM 303 HG3 GLU A 20 12.232 -9.196 -12.343 1.00 4.44 H ATOM 304 N THR A 21 12.664 -7.204 -9.398 1.00 2.73 N ATOM 305 CA THR A 21 13.958 -7.350 -8.818 1.00 3.25 C ATOM 306 C THR A 21 13.914 -8.398 -7.716 1.00 3.14 C ATOM 307 O THR A 21 12.883 -9.053 -7.509 1.00 3.43 O ATOM 308 CB THR A 21 14.504 -6.001 -8.255 1.00 3.93 C ATOM 309 OG1 THR A 21 13.555 -5.433 -7.340 1.00 4.30 O ATOM 310 CG2 THR A 21 14.797 -4.993 -9.364 1.00 4.40 C ATOM 311 H THR A 21 11.890 -7.143 -8.799 1.00 2.62 H ATOM 312 HA THR A 21 14.623 -7.693 -9.598 1.00 3.74 H ATOM 313 HB THR A 21 15.413 -6.198 -7.710 1.00 4.40 H ATOM 314 HG1 THR A 21 14.073 -4.946 -6.686 1.00 4.42 H ATOM 315 HG21 THR A 21 13.884 -4.788 -9.899 1.00 4.75 H ATOM 316 HG22 THR A 21 15.537 -5.397 -10.035 1.00 4.61 H ATOM 317 HG23 THR A 21 15.164 -4.084 -8.915 1.00 4.66 H ATOM 318 N ASP A 22 15.015 -8.547 -7.010 1.00 3.24 N ATOM 319 CA ASP A 22 15.085 -9.454 -5.877 1.00 3.46 C ATOM 320 C ASP A 22 14.374 -8.836 -4.682 1.00 3.15 C ATOM 321 O ASP A 22 13.770 -9.548 -3.870 1.00 3.71 O ATOM 322 CB ASP A 22 16.549 -9.805 -5.529 1.00 4.08 C ATOM 323 CG ASP A 22 17.259 -10.608 -6.602 1.00 4.82 C ATOM 324 OD1 ASP A 22 17.422 -10.096 -7.742 1.00 5.44 O ATOM 325 OD2 ASP A 22 17.683 -11.752 -6.328 1.00 5.14 O ATOM 326 H ASP A 22 15.833 -8.076 -7.275 1.00 3.52 H ATOM 327 HA ASP A 22 14.558 -10.353 -6.146 1.00 3.87 H ATOM 328 HB2 ASP A 22 17.118 -8.900 -5.378 1.00 4.24 H ATOM 329 HB3 ASP A 22 16.558 -10.382 -4.615 1.00 4.35 H ATOM 330 N GLY A 23 14.399 -7.500 -4.606 1.00 2.69 N ATOM 331 CA GLY A 23 13.783 -6.801 -3.507 1.00 2.70 C ATOM 332 C GLY A 23 14.665 -6.822 -2.281 1.00 2.24 C ATOM 333 O GLY A 23 15.813 -7.254 -2.350 1.00 2.70 O ATOM 334 H GLY A 23 14.849 -6.977 -5.302 1.00 2.74 H ATOM 335 HA2 GLY A 23 13.592 -5.776 -3.787 1.00 3.05 H ATOM 336 HA3 GLY A 23 12.851 -7.286 -3.266 1.00 3.22 H ATOM 337 N THR A 24 14.144 -6.355 -1.181 1.00 1.89 N ATOM 338 CA THR A 24 14.842 -6.362 0.071 1.00 1.88 C ATOM 339 C THR A 24 13.876 -5.936 1.167 1.00 1.65 C ATOM 340 O THR A 24 13.133 -4.947 1.006 1.00 2.03 O ATOM 341 CB THR A 24 16.118 -5.418 0.059 1.00 2.50 C ATOM 342 OG1 THR A 24 16.867 -5.526 1.304 1.00 3.09 O ATOM 343 CG2 THR A 24 15.758 -3.945 -0.196 1.00 2.87 C ATOM 344 H THR A 24 13.239 -5.977 -1.165 1.00 2.13 H ATOM 345 HA THR A 24 15.161 -7.381 0.243 1.00 2.24 H ATOM 346 HB THR A 24 16.762 -5.766 -0.734 1.00 3.01 H ATOM 347 HG1 THR A 24 16.372 -5.137 2.041 1.00 3.52 H ATOM 348 HG21 THR A 24 15.254 -3.858 -1.147 1.00 3.16 H ATOM 349 HG22 THR A 24 16.653 -3.340 -0.188 1.00 3.32 H ATOM 350 HG23 THR A 24 15.092 -3.609 0.587 1.00 3.05 H ATOM 351 N ASP A 25 13.804 -6.747 2.202 1.00 1.52 N ATOM 352 CA ASP A 25 13.044 -6.433 3.399 1.00 1.56 C ATOM 353 C ASP A 25 11.553 -6.661 3.222 1.00 1.29 C ATOM 354 O ASP A 25 11.141 -7.308 2.262 1.00 1.63 O ATOM 355 CB ASP A 25 13.427 -5.052 3.993 1.00 2.14 C ATOM 356 CG ASP A 25 14.802 -5.097 4.594 1.00 2.62 C ATOM 357 OD1 ASP A 25 14.960 -5.591 5.743 1.00 3.06 O ATOM 358 OD2 ASP A 25 15.755 -4.618 3.930 1.00 3.01 O ATOM 359 H ASP A 25 14.241 -7.627 2.151 1.00 1.75 H ATOM 360 HA ASP A 25 13.348 -7.195 4.104 1.00 1.73 H ATOM 361 HB2 ASP A 25 13.444 -4.322 3.196 1.00 2.49 H ATOM 362 HB3 ASP A 25 12.749 -4.710 4.757 1.00 2.44 H ATOM 363 N LEU A 26 10.753 -6.200 4.205 1.00 1.14 N ATOM 364 CA LEU A 26 9.301 -6.464 4.288 1.00 0.93 C ATOM 365 C LEU A 26 9.086 -7.875 4.800 1.00 0.97 C ATOM 366 O LEU A 26 7.965 -8.359 4.873 1.00 1.44 O ATOM 367 CB LEU A 26 8.509 -6.249 2.948 1.00 1.11 C ATOM 368 CG LEU A 26 8.249 -4.811 2.452 1.00 0.87 C ATOM 369 CD1 LEU A 26 9.529 -4.047 2.108 1.00 1.38 C ATOM 370 CD2 LEU A 26 7.316 -4.846 1.253 1.00 1.53 C ATOM 371 H LEU A 26 11.143 -5.683 4.940 1.00 1.49 H ATOM 372 HA LEU A 26 8.926 -5.793 5.048 1.00 0.96 H ATOM 373 HB2 LEU A 26 9.045 -6.754 2.156 1.00 1.64 H ATOM 374 HB3 LEU A 26 7.555 -6.745 3.053 1.00 1.87 H ATOM 375 HG LEU A 26 7.749 -4.259 3.235 1.00 1.73 H ATOM 376 HD11 LEU A 26 9.272 -3.053 1.765 1.00 1.91 H ATOM 377 HD12 LEU A 26 10.062 -4.567 1.326 1.00 1.94 H ATOM 378 HD13 LEU A 26 10.155 -3.968 2.985 1.00 1.97 H ATOM 379 HD21 LEU A 26 6.377 -5.304 1.528 1.00 2.11 H ATOM 380 HD22 LEU A 26 7.781 -5.418 0.466 1.00 1.91 H ATOM 381 HD23 LEU A 26 7.138 -3.836 0.915 1.00 2.02 H ATOM 382 N SER A 27 10.184 -8.508 5.185 1.00 1.01 N ATOM 383 CA SER A 27 10.210 -9.878 5.645 1.00 1.18 C ATOM 384 C SER A 27 9.800 -9.951 7.126 1.00 1.27 C ATOM 385 O SER A 27 8.853 -10.667 7.495 1.00 1.98 O ATOM 386 CB SER A 27 11.631 -10.409 5.456 1.00 1.52 C ATOM 387 OG SER A 27 12.075 -10.164 4.124 1.00 2.26 O ATOM 388 H SER A 27 11.035 -8.019 5.160 1.00 1.26 H ATOM 389 HA SER A 27 9.538 -10.461 5.034 1.00 1.31 H ATOM 390 HB2 SER A 27 12.301 -9.904 6.140 1.00 1.83 H ATOM 391 HB3 SER A 27 11.646 -11.472 5.643 1.00 1.77 H ATOM 392 HG SER A 27 11.324 -10.300 3.535 1.00 2.55 H ATOM 393 N GLY A 28 10.499 -9.195 7.963 1.00 1.18 N ATOM 394 CA GLY A 28 10.214 -9.168 9.390 1.00 1.46 C ATOM 395 C GLY A 28 9.199 -8.099 9.679 1.00 1.19 C ATOM 396 O GLY A 28 9.470 -7.152 10.426 1.00 1.73 O ATOM 397 H GLY A 28 11.219 -8.626 7.610 1.00 1.42 H ATOM 398 HA2 GLY A 28 9.817 -10.129 9.687 1.00 1.84 H ATOM 399 HA3 GLY A 28 11.117 -8.954 9.946 1.00 1.75 H ATOM 400 N ASP A 29 8.016 -8.281 9.080 1.00 0.90 N ATOM 401 CA ASP A 29 6.901 -7.327 9.097 1.00 0.83 C ATOM 402 C ASP A 29 7.320 -6.082 8.288 1.00 0.79 C ATOM 403 O ASP A 29 8.352 -6.116 7.599 1.00 1.33 O ATOM 404 CB ASP A 29 6.453 -6.957 10.546 1.00 1.20 C ATOM 405 CG ASP A 29 5.028 -6.393 10.622 1.00 1.95 C ATOM 406 OD1 ASP A 29 4.831 -5.180 10.346 1.00 2.68 O ATOM 407 OD2 ASP A 29 4.108 -7.161 10.952 1.00 2.44 O ATOM 408 H ASP A 29 7.895 -9.122 8.592 1.00 1.26 H ATOM 409 HA ASP A 29 6.090 -7.800 8.561 1.00 0.92 H ATOM 410 HB2 ASP A 29 6.498 -7.840 11.167 1.00 1.67 H ATOM 411 HB3 ASP A 29 7.136 -6.217 10.943 1.00 1.46 H ATOM 412 N PHE A 30 6.530 -5.029 8.347 1.00 0.42 N ATOM 413 CA PHE A 30 6.741 -3.786 7.605 1.00 0.36 C ATOM 414 C PHE A 30 5.552 -2.857 7.757 1.00 0.32 C ATOM 415 O PHE A 30 5.608 -1.714 7.345 1.00 0.35 O ATOM 416 CB PHE A 30 7.006 -4.000 6.109 1.00 0.37 C ATOM 417 CG PHE A 30 5.824 -4.521 5.311 1.00 0.35 C ATOM 418 CD1 PHE A 30 5.398 -5.835 5.462 1.00 0.40 C ATOM 419 CD2 PHE A 30 5.161 -3.702 4.407 1.00 0.38 C ATOM 420 CE1 PHE A 30 4.341 -6.319 4.738 1.00 0.46 C ATOM 421 CE2 PHE A 30 4.088 -4.183 3.672 1.00 0.42 C ATOM 422 CZ PHE A 30 3.676 -5.499 3.840 1.00 0.46 C ATOM 423 H PHE A 30 5.795 -5.070 8.998 1.00 0.67 H ATOM 424 HA PHE A 30 7.598 -3.298 8.043 1.00 0.43 H ATOM 425 HB2 PHE A 30 7.347 -3.040 5.754 1.00 0.40 H ATOM 426 HB3 PHE A 30 7.825 -4.696 6.004 1.00 0.41 H ATOM 427 HD1 PHE A 30 5.921 -6.463 6.170 1.00 0.43 H ATOM 428 HD2 PHE A 30 5.482 -2.680 4.276 1.00 0.43 H ATOM 429 HE1 PHE A 30 4.020 -7.343 4.865 1.00 0.55 H ATOM 430 HE2 PHE A 30 3.578 -3.535 2.970 1.00 0.47 H ATOM 431 HZ PHE A 30 2.841 -5.884 3.275 1.00 0.53 H ATOM 432 N LEU A 31 4.482 -3.350 8.375 1.00 0.35 N ATOM 433 CA LEU A 31 3.272 -2.594 8.516 1.00 0.36 C ATOM 434 C LEU A 31 3.487 -1.452 9.450 1.00 0.39 C ATOM 435 O LEU A 31 3.134 -0.316 9.144 1.00 0.46 O ATOM 436 CB LEU A 31 2.130 -3.478 9.028 1.00 0.40 C ATOM 437 CG LEU A 31 1.688 -4.611 8.114 1.00 0.39 C ATOM 438 CD1 LEU A 31 0.577 -5.399 8.775 1.00 0.45 C ATOM 439 CD2 LEU A 31 1.221 -4.056 6.781 1.00 0.38 C ATOM 440 H LEU A 31 4.495 -4.234 8.807 1.00 0.44 H ATOM 441 HA LEU A 31 2.988 -2.203 7.553 1.00 0.35 H ATOM 442 HB2 LEU A 31 2.420 -3.908 9.974 1.00 0.44 H ATOM 443 HB3 LEU A 31 1.270 -2.850 9.199 1.00 0.42 H ATOM 444 HG LEU A 31 2.527 -5.268 7.942 1.00 0.39 H ATOM 445 HD11 LEU A 31 0.939 -5.817 9.702 1.00 0.98 H ATOM 446 HD12 LEU A 31 0.260 -6.193 8.116 1.00 1.10 H ATOM 447 HD13 LEU A 31 -0.249 -4.732 8.971 1.00 1.06 H ATOM 448 HD21 LEU A 31 2.030 -3.516 6.316 1.00 1.07 H ATOM 449 HD22 LEU A 31 0.391 -3.384 6.937 1.00 1.11 H ATOM 450 HD23 LEU A 31 0.906 -4.866 6.142 1.00 1.05 H ATOM 451 N ASP A 32 4.114 -1.742 10.568 1.00 0.43 N ATOM 452 CA ASP A 32 4.329 -0.737 11.598 1.00 0.52 C ATOM 453 C ASP A 32 5.707 -0.083 11.379 1.00 0.50 C ATOM 454 O ASP A 32 6.281 0.548 12.263 1.00 0.66 O ATOM 455 CB ASP A 32 4.205 -1.384 12.988 1.00 0.69 C ATOM 456 CG ASP A 32 3.688 -0.427 14.065 1.00 1.46 C ATOM 457 OD1 ASP A 32 2.456 -0.155 14.095 1.00 1.95 O ATOM 458 OD2 ASP A 32 4.474 0.031 14.924 1.00 2.20 O ATOM 459 H ASP A 32 4.450 -2.656 10.703 1.00 0.46 H ATOM 460 HA ASP A 32 3.574 0.026 11.479 1.00 0.59 H ATOM 461 HB2 ASP A 32 3.535 -2.228 12.926 1.00 1.12 H ATOM 462 HB3 ASP A 32 5.176 -1.741 13.295 1.00 1.24 H ATOM 463 N LEU A 33 6.232 -0.268 10.176 1.00 0.42 N ATOM 464 CA LEU A 33 7.454 0.368 9.730 1.00 0.50 C ATOM 465 C LEU A 33 7.023 1.580 8.919 1.00 0.45 C ATOM 466 O LEU A 33 5.930 1.587 8.393 1.00 0.57 O ATOM 467 CB LEU A 33 8.296 -0.577 8.826 1.00 0.66 C ATOM 468 CG LEU A 33 8.819 -1.878 9.439 1.00 0.80 C ATOM 469 CD1 LEU A 33 9.723 -2.608 8.454 1.00 1.52 C ATOM 470 CD2 LEU A 33 9.592 -1.601 10.686 1.00 1.18 C ATOM 471 H LEU A 33 5.742 -0.822 9.536 1.00 0.43 H ATOM 472 HA LEU A 33 8.026 0.674 10.595 1.00 0.61 H ATOM 473 HB2 LEU A 33 7.688 -0.845 7.974 1.00 1.44 H ATOM 474 HB3 LEU A 33 9.150 -0.037 8.450 1.00 1.18 H ATOM 475 HG LEU A 33 7.980 -2.512 9.695 1.00 0.96 H ATOM 476 HD11 LEU A 33 10.063 -3.526 8.903 1.00 1.97 H ATOM 477 HD12 LEU A 33 10.577 -2.002 8.197 1.00 2.01 H ATOM 478 HD13 LEU A 33 9.162 -2.846 7.566 1.00 1.95 H ATOM 479 HD21 LEU A 33 10.418 -0.953 10.430 1.00 1.52 H ATOM 480 HD22 LEU A 33 9.961 -2.540 11.072 1.00 1.91 H ATOM 481 HD23 LEU A 33 8.945 -1.110 11.393 1.00 1.52 H ATOM 482 N ARG A 34 7.838 2.590 8.810 1.00 0.43 N ATOM 483 CA ARG A 34 7.432 3.752 8.026 1.00 0.42 C ATOM 484 C ARG A 34 7.947 3.589 6.615 1.00 0.36 C ATOM 485 O ARG A 34 8.916 2.858 6.392 1.00 0.45 O ATOM 486 CB ARG A 34 7.986 5.069 8.578 1.00 0.58 C ATOM 487 CG ARG A 34 7.713 5.360 10.036 1.00 0.77 C ATOM 488 CD ARG A 34 8.123 6.785 10.354 1.00 1.08 C ATOM 489 NE ARG A 34 8.229 7.049 11.784 1.00 1.82 N ATOM 490 CZ ARG A 34 8.226 8.269 12.334 1.00 2.41 C ATOM 491 NH1 ARG A 34 7.958 9.344 11.595 1.00 2.43 N ATOM 492 NH2 ARG A 34 8.481 8.413 13.631 1.00 3.44 N ATOM 493 H ARG A 34 8.728 2.540 9.215 1.00 0.55 H ATOM 494 HA ARG A 34 6.354 3.795 7.992 1.00 0.45 H ATOM 495 HB2 ARG A 34 9.057 5.073 8.438 1.00 0.77 H ATOM 496 HB3 ARG A 34 7.561 5.869 7.992 1.00 0.78 H ATOM 497 HG2 ARG A 34 6.655 5.265 10.220 1.00 0.95 H ATOM 498 HG3 ARG A 34 8.275 4.683 10.661 1.00 1.06 H ATOM 499 HD2 ARG A 34 9.083 6.973 9.894 1.00 1.67 H ATOM 500 HD3 ARG A 34 7.386 7.454 9.929 1.00 1.45 H ATOM 501 HE ARG A 34 8.369 6.248 12.353 1.00 2.30 H ATOM 502 HH11 ARG A 34 7.749 9.306 10.610 1.00 2.29 H ATOM 503 HH12 ARG A 34 7.942 10.272 11.990 1.00 3.00 H ATOM 504 HH21 ARG A 34 8.674 7.615 14.209 1.00 3.92 H ATOM 505 HH22 ARG A 34 8.493 9.312 14.078 1.00 3.95 H ATOM 506 N PHE A 35 7.345 4.282 5.670 1.00 0.33 N ATOM 507 CA PHE A 35 7.831 4.246 4.287 1.00 0.33 C ATOM 508 C PHE A 35 9.220 4.882 4.222 1.00 0.38 C ATOM 509 O PHE A 35 10.076 4.484 3.420 1.00 0.43 O ATOM 510 CB PHE A 35 6.872 4.957 3.330 1.00 0.34 C ATOM 511 CG PHE A 35 5.499 4.367 3.298 1.00 0.36 C ATOM 512 CD1 PHE A 35 5.264 3.150 2.675 1.00 0.43 C ATOM 513 CD2 PHE A 35 4.446 5.020 3.896 1.00 0.40 C ATOM 514 CE1 PHE A 35 4.001 2.606 2.656 1.00 0.50 C ATOM 515 CE2 PHE A 35 3.183 4.477 3.883 1.00 0.48 C ATOM 516 CZ PHE A 35 2.962 3.275 3.265 1.00 0.51 C ATOM 517 H PHE A 35 6.543 4.804 5.910 1.00 0.40 H ATOM 518 HA PHE A 35 7.912 3.203 4.012 1.00 0.36 H ATOM 519 HB2 PHE A 35 6.794 5.998 3.608 1.00 0.35 H ATOM 520 HB3 PHE A 35 7.287 4.894 2.335 1.00 0.39 H ATOM 521 HD1 PHE A 35 6.080 2.627 2.193 1.00 0.47 H ATOM 522 HD2 PHE A 35 4.598 5.974 4.387 1.00 0.41 H ATOM 523 HE1 PHE A 35 3.826 1.657 2.170 1.00 0.57 H ATOM 524 HE2 PHE A 35 2.365 5.002 4.357 1.00 0.55 H ATOM 525 HZ PHE A 35 1.962 2.870 3.284 1.00 0.58 H ATOM 526 N GLU A 36 9.432 5.856 5.113 1.00 0.48 N ATOM 527 CA GLU A 36 10.724 6.527 5.294 1.00 0.62 C ATOM 528 C GLU A 36 11.817 5.480 5.593 1.00 0.63 C ATOM 529 O GLU A 36 12.878 5.461 4.975 1.00 0.72 O ATOM 530 CB GLU A 36 10.642 7.448 6.517 1.00 0.83 C ATOM 531 CG GLU A 36 9.551 8.506 6.477 1.00 1.40 C ATOM 532 CD GLU A 36 9.751 9.521 5.388 1.00 1.83 C ATOM 533 OE1 GLU A 36 10.702 10.319 5.465 1.00 1.89 O ATOM 534 OE2 GLU A 36 8.987 9.493 4.406 1.00 2.73 O ATOM 535 H GLU A 36 8.665 6.152 5.642 1.00 0.52 H ATOM 536 HA GLU A 36 10.967 7.115 4.422 1.00 0.69 H ATOM 537 HB2 GLU A 36 10.463 6.829 7.384 1.00 1.43 H ATOM 538 HB3 GLU A 36 11.598 7.941 6.641 1.00 1.37 H ATOM 539 HG2 GLU A 36 8.595 8.028 6.322 1.00 1.99 H ATOM 540 HG3 GLU A 36 9.542 9.020 7.427 1.00 2.11 H ATOM 541 N ASP A 37 11.485 4.602 6.522 1.00 0.61 N ATOM 542 CA ASP A 37 12.372 3.562 7.057 1.00 0.70 C ATOM 543 C ASP A 37 12.793 2.584 5.981 1.00 0.69 C ATOM 544 O ASP A 37 13.984 2.315 5.797 1.00 0.82 O ATOM 545 CB ASP A 37 11.634 2.841 8.213 1.00 0.77 C ATOM 546 CG ASP A 37 12.399 1.693 8.857 1.00 0.98 C ATOM 547 OD1 ASP A 37 13.213 1.939 9.779 1.00 1.27 O ATOM 548 OD2 ASP A 37 12.146 0.539 8.509 1.00 1.36 O ATOM 549 H ASP A 37 10.571 4.633 6.865 1.00 0.57 H ATOM 550 HA ASP A 37 13.242 4.048 7.472 1.00 0.80 H ATOM 551 HB2 ASP A 37 11.415 3.557 8.994 1.00 1.07 H ATOM 552 HB3 ASP A 37 10.697 2.462 7.829 1.00 0.95 H ATOM 553 N ILE A 38 11.823 2.120 5.212 1.00 0.59 N ATOM 554 CA ILE A 38 12.083 1.142 4.171 1.00 0.63 C ATOM 555 C ILE A 38 12.529 1.776 2.830 1.00 0.63 C ATOM 556 O ILE A 38 12.678 1.083 1.825 1.00 0.66 O ATOM 557 CB ILE A 38 10.893 0.156 3.953 1.00 0.59 C ATOM 558 CG1 ILE A 38 9.594 0.936 3.645 1.00 0.48 C ATOM 559 CG2 ILE A 38 10.721 -0.742 5.185 1.00 0.67 C ATOM 560 CD1 ILE A 38 8.372 0.062 3.417 1.00 0.54 C ATOM 561 H ILE A 38 10.907 2.442 5.354 1.00 0.56 H ATOM 562 HA ILE A 38 12.925 0.571 4.535 1.00 0.73 H ATOM 563 HB ILE A 38 11.140 -0.467 3.105 1.00 0.66 H ATOM 564 HG12 ILE A 38 9.374 1.585 4.480 1.00 0.43 H ATOM 565 HG13 ILE A 38 9.738 1.538 2.760 1.00 0.48 H ATOM 566 HG21 ILE A 38 10.515 -0.129 6.053 1.00 1.43 H ATOM 567 HG22 ILE A 38 11.625 -1.313 5.352 1.00 1.12 H ATOM 568 HG23 ILE A 38 9.887 -1.413 5.016 1.00 1.13 H ATOM 569 HD11 ILE A 38 8.189 -0.524 4.306 1.00 1.13 H ATOM 570 HD12 ILE A 38 8.567 -0.600 2.584 1.00 1.03 H ATOM 571 HD13 ILE A 38 7.511 0.681 3.212 1.00 1.00 H ATOM 572 N GLY A 39 12.808 3.078 2.855 1.00 0.63 N ATOM 573 CA GLY A 39 13.311 3.784 1.677 1.00 0.68 C ATOM 574 C GLY A 39 12.318 3.817 0.525 1.00 0.59 C ATOM 575 O GLY A 39 12.653 3.462 -0.596 1.00 0.70 O ATOM 576 H GLY A 39 12.671 3.572 3.692 1.00 0.63 H ATOM 577 HA2 GLY A 39 13.535 4.799 1.971 1.00 0.71 H ATOM 578 HA3 GLY A 39 14.218 3.302 1.338 1.00 0.81 H ATOM 579 N TYR A 40 11.111 4.220 0.803 1.00 0.45 N ATOM 580 CA TYR A 40 10.094 4.327 -0.217 1.00 0.45 C ATOM 581 C TYR A 40 9.660 5.754 -0.439 1.00 0.47 C ATOM 582 O TYR A 40 9.129 6.391 0.466 1.00 0.62 O ATOM 583 CB TYR A 40 8.872 3.477 0.128 1.00 0.42 C ATOM 584 CG TYR A 40 8.888 2.097 -0.476 1.00 0.46 C ATOM 585 CD1 TYR A 40 9.712 1.116 0.057 1.00 0.53 C ATOM 586 CD2 TYR A 40 8.102 1.775 -1.571 1.00 0.57 C ATOM 587 CE1 TYR A 40 9.750 -0.145 -0.478 1.00 0.60 C ATOM 588 CE2 TYR A 40 8.132 0.507 -2.119 1.00 0.68 C ATOM 589 CZ TYR A 40 8.876 -0.434 -1.608 1.00 0.67 C ATOM 590 OH TYR A 40 9.007 -1.712 -2.114 1.00 0.78 O ATOM 591 H TYR A 40 10.863 4.466 1.724 1.00 0.42 H ATOM 592 HA TYR A 40 10.514 3.946 -1.136 1.00 0.56 H ATOM 593 HB2 TYR A 40 8.813 3.366 1.200 1.00 0.43 H ATOM 594 HB3 TYR A 40 7.983 3.982 -0.211 1.00 0.44 H ATOM 595 HD1 TYR A 40 10.332 1.346 0.911 1.00 0.63 H ATOM 596 HD2 TYR A 40 7.460 2.533 -1.995 1.00 0.66 H ATOM 597 HE1 TYR A 40 10.408 -0.880 -0.038 1.00 0.69 H ATOM 598 HE2 TYR A 40 7.511 0.282 -2.975 1.00 0.85 H ATOM 599 HH TYR A 40 9.165 -2.350 -1.411 1.00 1.25 H ATOM 600 N ASP A 41 9.885 6.254 -1.639 1.00 0.55 N ATOM 601 CA ASP A 41 9.387 7.572 -1.998 1.00 0.69 C ATOM 602 C ASP A 41 7.955 7.434 -2.413 1.00 0.85 C ATOM 603 O ASP A 41 7.446 6.302 -2.606 1.00 1.62 O ATOM 604 CB ASP A 41 10.141 8.234 -3.164 1.00 0.82 C ATOM 605 CG ASP A 41 11.570 8.589 -2.872 1.00 0.99 C ATOM 606 OD1 ASP A 41 11.810 9.662 -2.251 1.00 1.27 O ATOM 607 OD2 ASP A 41 12.479 7.862 -3.310 1.00 1.32 O ATOM 608 H ASP A 41 10.393 5.727 -2.290 1.00 0.64 H ATOM 609 HA ASP A 41 9.445 8.202 -1.124 1.00 0.70 H ATOM 610 HB2 ASP A 41 10.063 7.616 -4.039 1.00 1.07 H ATOM 611 HB3 ASP A 41 9.642 9.157 -3.419 1.00 1.03 H ATOM 612 N SER A 42 7.324 8.551 -2.642 1.00 0.50 N ATOM 613 CA SER A 42 5.947 8.583 -3.027 1.00 0.53 C ATOM 614 C SER A 42 5.757 7.966 -4.405 1.00 0.51 C ATOM 615 O SER A 42 4.721 7.397 -4.686 1.00 0.48 O ATOM 616 CB SER A 42 5.458 9.995 -3.003 1.00 0.69 C ATOM 617 OG SER A 42 6.311 10.800 -3.855 1.00 1.05 O ATOM 618 H SER A 42 7.812 9.399 -2.562 1.00 0.83 H ATOM 619 HA SER A 42 5.402 8.009 -2.296 1.00 0.54 H ATOM 620 HB2 SER A 42 4.440 10.036 -3.367 1.00 1.09 H ATOM 621 HB3 SER A 42 5.480 10.409 -2.009 1.00 1.08 H ATOM 622 N LEU A 43 6.785 8.101 -5.257 1.00 0.57 N ATOM 623 CA LEU A 43 6.802 7.510 -6.603 1.00 0.62 C ATOM 624 C LEU A 43 6.435 6.035 -6.544 1.00 0.56 C ATOM 625 O LEU A 43 5.508 5.602 -7.192 1.00 0.58 O ATOM 626 CB LEU A 43 8.198 7.698 -7.253 1.00 0.74 C ATOM 627 CG LEU A 43 8.453 6.974 -8.588 1.00 0.86 C ATOM 628 CD1 LEU A 43 7.469 7.411 -9.656 1.00 1.40 C ATOM 629 CD2 LEU A 43 9.877 7.228 -9.045 1.00 1.19 C ATOM 630 H LEU A 43 7.539 8.650 -4.957 1.00 0.63 H ATOM 631 HA LEU A 43 6.068 8.017 -7.210 1.00 0.68 H ATOM 632 HB2 LEU A 43 8.363 8.752 -7.412 1.00 0.80 H ATOM 633 HB3 LEU A 43 8.935 7.364 -6.542 1.00 0.74 H ATOM 634 HG LEU A 43 8.338 5.908 -8.440 1.00 1.21 H ATOM 635 HD11 LEU A 43 6.465 7.173 -9.338 1.00 2.04 H ATOM 636 HD12 LEU A 43 7.687 6.879 -10.570 1.00 1.94 H ATOM 637 HD13 LEU A 43 7.545 8.474 -9.834 1.00 1.66 H ATOM 638 HD21 LEU A 43 10.031 8.290 -9.169 1.00 1.69 H ATOM 639 HD22 LEU A 43 10.044 6.733 -9.987 1.00 1.62 H ATOM 640 HD23 LEU A 43 10.561 6.841 -8.304 1.00 1.71 H ATOM 641 N ALA A 44 7.136 5.298 -5.719 1.00 0.54 N ATOM 642 CA ALA A 44 6.918 3.879 -5.607 1.00 0.54 C ATOM 643 C ALA A 44 5.623 3.600 -4.858 1.00 0.47 C ATOM 644 O ALA A 44 4.856 2.723 -5.233 1.00 0.53 O ATOM 645 CB ALA A 44 8.097 3.214 -4.913 1.00 0.59 C ATOM 646 H ALA A 44 7.810 5.725 -5.151 1.00 0.57 H ATOM 647 HA ALA A 44 6.841 3.490 -6.608 1.00 0.62 H ATOM 648 HB1 ALA A 44 7.945 2.146 -4.854 1.00 1.28 H ATOM 649 HB2 ALA A 44 8.181 3.615 -3.913 1.00 1.12 H ATOM 650 HB3 ALA A 44 9.009 3.419 -5.454 1.00 1.13 H ATOM 651 N LEU A 45 5.379 4.403 -3.846 1.00 0.42 N ATOM 652 CA LEU A 45 4.255 4.237 -2.940 1.00 0.38 C ATOM 653 C LEU A 45 2.909 4.449 -3.664 1.00 0.37 C ATOM 654 O LEU A 45 1.982 3.642 -3.528 1.00 0.39 O ATOM 655 CB LEU A 45 4.409 5.271 -1.823 1.00 0.35 C ATOM 656 CG LEU A 45 3.818 4.960 -0.444 1.00 0.37 C ATOM 657 CD1 LEU A 45 4.189 6.064 0.506 1.00 0.38 C ATOM 658 CD2 LEU A 45 2.313 4.793 -0.470 1.00 0.53 C ATOM 659 H LEU A 45 6.003 5.144 -3.693 1.00 0.46 H ATOM 660 HA LEU A 45 4.294 3.251 -2.500 1.00 0.42 H ATOM 661 HB2 LEU A 45 5.458 5.493 -1.691 1.00 0.34 H ATOM 662 HB3 LEU A 45 3.923 6.164 -2.185 1.00 0.40 H ATOM 663 HG LEU A 45 4.263 4.051 -0.065 1.00 0.43 H ATOM 664 HD11 LEU A 45 3.799 7.003 0.145 1.00 1.04 H ATOM 665 HD12 LEU A 45 5.267 6.109 0.564 1.00 1.10 H ATOM 666 HD13 LEU A 45 3.802 5.849 1.490 1.00 1.14 H ATOM 667 HD21 LEU A 45 2.071 3.980 -1.137 1.00 0.97 H ATOM 668 HD22 LEU A 45 1.862 5.702 -0.840 1.00 1.13 H ATOM 669 HD23 LEU A 45 1.945 4.569 0.523 1.00 1.32 H ATOM 670 N MET A 46 2.795 5.530 -4.433 1.00 0.37 N ATOM 671 CA MET A 46 1.527 5.834 -5.073 1.00 0.40 C ATOM 672 C MET A 46 1.195 4.864 -6.191 1.00 0.35 C ATOM 673 O MET A 46 0.022 4.598 -6.448 1.00 0.36 O ATOM 674 CB MET A 46 1.425 7.294 -5.520 1.00 0.52 C ATOM 675 CG MET A 46 1.498 8.278 -4.364 1.00 0.70 C ATOM 676 SD MET A 46 1.174 9.982 -4.870 1.00 0.96 S ATOM 677 CE MET A 46 1.473 10.845 -3.321 1.00 2.41 C ATOM 678 H MET A 46 3.550 6.152 -4.583 1.00 0.38 H ATOM 679 HA MET A 46 0.787 5.663 -4.307 1.00 0.47 H ATOM 680 HB2 MET A 46 2.239 7.502 -6.199 1.00 0.53 H ATOM 681 HB3 MET A 46 0.482 7.444 -6.025 1.00 0.59 H ATOM 682 HG2 MET A 46 0.776 7.986 -3.618 1.00 0.73 H ATOM 683 HG3 MET A 46 2.491 8.228 -3.947 1.00 0.73 H ATOM 684 HE1 MET A 46 0.797 10.487 -2.558 1.00 2.94 H ATOM 685 HE2 MET A 46 1.317 11.905 -3.458 1.00 2.88 H ATOM 686 HE3 MET A 46 2.488 10.669 -2.997 1.00 2.92 H ATOM 687 N GLU A 47 2.218 4.284 -6.808 1.00 0.37 N ATOM 688 CA GLU A 47 1.995 3.275 -7.831 1.00 0.39 C ATOM 689 C GLU A 47 1.418 2.000 -7.188 1.00 0.37 C ATOM 690 O GLU A 47 0.599 1.292 -7.800 1.00 0.43 O ATOM 691 CB GLU A 47 3.281 2.976 -8.609 1.00 0.48 C ATOM 692 CG GLU A 47 3.837 4.191 -9.343 1.00 0.68 C ATOM 693 CD GLU A 47 2.865 4.775 -10.350 1.00 1.41 C ATOM 694 OE1 GLU A 47 2.785 4.277 -11.477 1.00 1.84 O ATOM 695 OE2 GLU A 47 2.147 5.743 -10.006 1.00 2.15 O ATOM 696 H GLU A 47 3.137 4.545 -6.585 1.00 0.40 H ATOM 697 HA GLU A 47 1.250 3.676 -8.503 1.00 0.42 H ATOM 698 HB2 GLU A 47 4.042 2.611 -7.931 1.00 0.57 H ATOM 699 HB3 GLU A 47 3.074 2.210 -9.342 1.00 0.68 H ATOM 700 HG2 GLU A 47 4.059 4.956 -8.612 1.00 1.01 H ATOM 701 HG3 GLU A 47 4.744 3.911 -9.858 1.00 1.05 H ATOM 702 N THR A 48 1.815 1.749 -5.932 1.00 0.36 N ATOM 703 CA THR A 48 1.282 0.640 -5.132 1.00 0.39 C ATOM 704 C THR A 48 -0.216 0.859 -4.894 1.00 0.35 C ATOM 705 O THR A 48 -1.026 -0.067 -5.054 1.00 0.40 O ATOM 706 CB THR A 48 2.010 0.577 -3.772 1.00 0.43 C ATOM 707 OG1 THR A 48 3.406 0.444 -3.999 1.00 0.51 O ATOM 708 CG2 THR A 48 1.515 -0.587 -2.922 1.00 0.51 C ATOM 709 H THR A 48 2.500 2.331 -5.534 1.00 0.38 H ATOM 710 HA THR A 48 1.433 -0.291 -5.663 1.00 0.44 H ATOM 711 HB THR A 48 1.831 1.504 -3.248 1.00 0.39 H ATOM 712 HG1 THR A 48 3.532 0.316 -4.952 1.00 0.77 H ATOM 713 HG21 THR A 48 2.050 -0.587 -1.982 1.00 1.01 H ATOM 714 HG22 THR A 48 1.698 -1.525 -3.434 1.00 1.20 H ATOM 715 HG23 THR A 48 0.455 -0.483 -2.725 1.00 1.19 H ATOM 716 N ALA A 49 -0.571 2.085 -4.529 1.00 0.31 N ATOM 717 CA ALA A 49 -1.955 2.452 -4.294 1.00 0.32 C ATOM 718 C ALA A 49 -2.777 2.199 -5.547 1.00 0.30 C ATOM 719 O ALA A 49 -3.763 1.473 -5.501 1.00 0.32 O ATOM 720 CB ALA A 49 -2.045 3.906 -3.860 1.00 0.38 C ATOM 721 H ALA A 49 0.142 2.753 -4.425 1.00 0.32 H ATOM 722 HA ALA A 49 -2.337 1.828 -3.503 1.00 0.36 H ATOM 723 HB1 ALA A 49 -3.075 4.163 -3.652 1.00 1.14 H ATOM 724 HB2 ALA A 49 -1.672 4.544 -4.646 1.00 1.07 H ATOM 725 HB3 ALA A 49 -1.456 4.062 -2.967 1.00 1.05 H ATOM 726 N ALA A 50 -2.294 2.733 -6.673 1.00 0.29 N ATOM 727 CA ALA A 50 -2.951 2.562 -7.968 1.00 0.31 C ATOM 728 C ALA A 50 -3.090 1.068 -8.326 1.00 0.31 C ATOM 729 O ALA A 50 -4.120 0.632 -8.818 1.00 0.35 O ATOM 730 CB ALA A 50 -2.181 3.301 -9.054 1.00 0.39 C ATOM 731 H ALA A 50 -1.464 3.261 -6.635 1.00 0.31 H ATOM 732 HA ALA A 50 -3.941 2.989 -7.889 1.00 0.32 H ATOM 733 HB1 ALA A 50 -2.695 3.216 -9.999 1.00 1.16 H ATOM 734 HB2 ALA A 50 -1.202 2.863 -9.141 1.00 1.05 H ATOM 735 HB3 ALA A 50 -2.075 4.342 -8.792 1.00 1.05 H ATOM 736 N ARG A 51 -2.043 0.300 -8.044 1.00 0.32 N ATOM 737 CA ARG A 51 -2.010 -1.136 -8.276 1.00 0.38 C ATOM 738 C ARG A 51 -3.137 -1.833 -7.513 1.00 0.37 C ATOM 739 O ARG A 51 -3.863 -2.663 -8.065 1.00 0.47 O ATOM 740 CB ARG A 51 -0.637 -1.702 -7.870 1.00 0.49 C ATOM 741 CG ARG A 51 -0.488 -3.217 -8.012 1.00 0.97 C ATOM 742 CD ARG A 51 -0.703 -3.697 -9.439 1.00 0.98 C ATOM 743 NE ARG A 51 -0.547 -5.146 -9.518 1.00 1.92 N ATOM 744 CZ ARG A 51 -1.326 -5.983 -10.186 1.00 2.31 C ATOM 745 NH1 ARG A 51 -2.409 -5.537 -10.834 1.00 2.05 N ATOM 746 NH2 ARG A 51 -1.009 -7.280 -10.221 1.00 3.40 N ATOM 747 H ARG A 51 -1.236 0.727 -7.683 1.00 0.33 H ATOM 748 HA ARG A 51 -2.163 -1.311 -9.330 1.00 0.43 H ATOM 749 HB2 ARG A 51 0.124 -1.226 -8.470 1.00 1.08 H ATOM 750 HB3 ARG A 51 -0.462 -1.443 -6.835 1.00 1.12 H ATOM 751 HG2 ARG A 51 0.507 -3.516 -7.716 1.00 1.56 H ATOM 752 HG3 ARG A 51 -1.208 -3.709 -7.374 1.00 1.50 H ATOM 753 HD2 ARG A 51 -1.697 -3.408 -9.745 1.00 1.17 H ATOM 754 HD3 ARG A 51 0.028 -3.225 -10.079 1.00 1.40 H ATOM 755 HE ARG A 51 0.233 -5.518 -9.025 1.00 2.58 H ATOM 756 HH11 ARG A 51 -2.685 -4.571 -10.874 1.00 1.81 H ATOM 757 HH12 ARG A 51 -3.048 -6.163 -11.292 1.00 2.55 H ATOM 758 HH21 ARG A 51 -0.173 -7.597 -9.749 1.00 4.01 H ATOM 759 HH22 ARG A 51 -1.562 -7.971 -10.708 1.00 3.78 H ATOM 760 N LEU A 52 -3.294 -1.477 -6.268 1.00 0.32 N ATOM 761 CA LEU A 52 -4.321 -2.057 -5.428 1.00 0.34 C ATOM 762 C LEU A 52 -5.715 -1.618 -5.874 1.00 0.33 C ATOM 763 O LEU A 52 -6.633 -2.443 -5.952 1.00 0.40 O ATOM 764 CB LEU A 52 -4.065 -1.711 -3.961 1.00 0.35 C ATOM 765 CG LEU A 52 -2.796 -2.321 -3.367 1.00 0.38 C ATOM 766 CD1 LEU A 52 -2.565 -1.823 -1.956 1.00 0.43 C ATOM 767 CD2 LEU A 52 -2.888 -3.838 -3.379 1.00 0.39 C ATOM 768 H LEU A 52 -2.701 -0.786 -5.895 1.00 0.30 H ATOM 769 HA LEU A 52 -4.261 -3.131 -5.544 1.00 0.39 H ATOM 770 HB2 LEU A 52 -4.017 -0.636 -3.854 1.00 0.35 H ATOM 771 HB3 LEU A 52 -4.898 -2.087 -3.386 1.00 0.38 H ATOM 772 HG LEU A 52 -1.954 -2.025 -3.975 1.00 0.41 H ATOM 773 HD11 LEU A 52 -1.661 -2.264 -1.555 1.00 1.04 H ATOM 774 HD12 LEU A 52 -3.408 -2.101 -1.339 1.00 1.06 H ATOM 775 HD13 LEU A 52 -2.472 -0.745 -1.973 1.00 1.06 H ATOM 776 HD21 LEU A 52 -1.984 -4.257 -2.968 1.00 1.11 H ATOM 777 HD22 LEU A 52 -3.019 -4.181 -4.390 1.00 0.96 H ATOM 778 HD23 LEU A 52 -3.727 -4.161 -2.783 1.00 1.10 H ATOM 779 N GLU A 53 -5.862 -0.338 -6.199 1.00 0.28 N ATOM 780 CA GLU A 53 -7.137 0.205 -6.664 1.00 0.29 C ATOM 781 C GLU A 53 -7.536 -0.467 -7.974 1.00 0.31 C ATOM 782 O GLU A 53 -8.681 -0.831 -8.147 1.00 0.35 O ATOM 783 CB GLU A 53 -7.050 1.712 -6.932 1.00 0.29 C ATOM 784 CG GLU A 53 -6.670 2.594 -5.759 1.00 0.35 C ATOM 785 CD GLU A 53 -6.613 4.045 -6.177 1.00 0.41 C ATOM 786 OE1 GLU A 53 -5.589 4.477 -6.745 1.00 0.53 O ATOM 787 OE2 GLU A 53 -7.548 4.793 -5.879 1.00 0.51 O ATOM 788 H GLU A 53 -5.096 0.273 -6.110 1.00 0.27 H ATOM 789 HA GLU A 53 -7.899 0.013 -5.917 1.00 0.33 H ATOM 790 HB2 GLU A 53 -6.323 1.878 -7.713 1.00 0.29 H ATOM 791 HB3 GLU A 53 -8.020 2.023 -7.286 1.00 0.32 H ATOM 792 HG2 GLU A 53 -7.400 2.472 -4.971 1.00 0.41 H ATOM 793 HG3 GLU A 53 -5.694 2.292 -5.407 1.00 0.33 H ATOM 794 N SER A 54 -6.576 -0.648 -8.867 1.00 0.35 N ATOM 795 CA SER A 54 -6.839 -1.219 -10.176 1.00 0.43 C ATOM 796 C SER A 54 -7.173 -2.701 -10.080 1.00 0.47 C ATOM 797 O SER A 54 -7.989 -3.208 -10.832 1.00 0.61 O ATOM 798 CB SER A 54 -5.627 -1.001 -11.089 1.00 0.49 C ATOM 799 OG SER A 54 -5.879 -1.434 -12.432 1.00 1.16 O ATOM 800 H SER A 54 -5.661 -0.352 -8.646 1.00 0.36 H ATOM 801 HA SER A 54 -7.680 -0.694 -10.598 1.00 0.45 H ATOM 802 HB2 SER A 54 -5.362 0.044 -11.079 1.00 1.13 H ATOM 803 HB3 SER A 54 -4.785 -1.553 -10.696 1.00 1.14 H ATOM 804 HG SER A 54 -6.648 -2.022 -12.416 1.00 1.39 H ATOM 805 N ARG A 55 -6.516 -3.384 -9.175 1.00 0.40 N ATOM 806 CA ARG A 55 -6.743 -4.805 -8.990 1.00 0.46 C ATOM 807 C ARG A 55 -8.097 -5.095 -8.316 1.00 0.47 C ATOM 808 O ARG A 55 -8.796 -6.028 -8.698 1.00 0.57 O ATOM 809 CB ARG A 55 -5.573 -5.440 -8.219 1.00 0.50 C ATOM 810 CG ARG A 55 -5.761 -6.896 -7.834 1.00 0.61 C ATOM 811 CD ARG A 55 -4.503 -7.451 -7.173 1.00 0.75 C ATOM 812 NE ARG A 55 -4.757 -8.698 -6.436 1.00 1.28 N ATOM 813 CZ ARG A 55 -3.920 -9.252 -5.541 1.00 1.65 C ATOM 814 NH1 ARG A 55 -2.649 -8.853 -5.470 1.00 1.46 N ATOM 815 NH2 ARG A 55 -4.336 -10.241 -4.773 1.00 2.65 N ATOM 816 H ARG A 55 -5.836 -2.919 -8.637 1.00 0.37 H ATOM 817 HA ARG A 55 -6.783 -5.247 -9.973 1.00 0.51 H ATOM 818 HB2 ARG A 55 -4.675 -5.371 -8.813 1.00 0.54 H ATOM 819 HB3 ARG A 55 -5.410 -4.870 -7.316 1.00 0.52 H ATOM 820 HG2 ARG A 55 -6.579 -6.966 -7.135 1.00 0.74 H ATOM 821 HG3 ARG A 55 -5.982 -7.474 -8.721 1.00 0.63 H ATOM 822 HD2 ARG A 55 -3.776 -7.641 -7.949 1.00 1.34 H ATOM 823 HD3 ARG A 55 -4.110 -6.719 -6.485 1.00 1.29 H ATOM 824 HE ARG A 55 -5.644 -9.105 -6.579 1.00 1.84 H ATOM 825 HH11 ARG A 55 -2.289 -8.145 -6.078 1.00 1.47 H ATOM 826 HH12 ARG A 55 -2.021 -9.263 -4.808 1.00 1.85 H ATOM 827 HH21 ARG A 55 -5.279 -10.589 -4.875 1.00 3.22 H ATOM 828 HH22 ARG A 55 -3.779 -10.651 -4.032 1.00 3.00 H ATOM 829 N TYR A 56 -8.469 -4.291 -7.330 1.00 0.42 N ATOM 830 CA TYR A 56 -9.705 -4.555 -6.593 1.00 0.47 C ATOM 831 C TYR A 56 -10.897 -3.698 -7.016 1.00 0.50 C ATOM 832 O TYR A 56 -12.045 -4.060 -6.731 1.00 0.67 O ATOM 833 CB TYR A 56 -9.489 -4.523 -5.078 1.00 0.52 C ATOM 834 CG TYR A 56 -8.682 -5.694 -4.582 1.00 0.53 C ATOM 835 CD1 TYR A 56 -9.301 -6.904 -4.325 1.00 0.62 C ATOM 836 CD2 TYR A 56 -7.313 -5.602 -4.391 1.00 0.59 C ATOM 837 CE1 TYR A 56 -8.579 -7.993 -3.889 1.00 0.70 C ATOM 838 CE2 TYR A 56 -6.582 -6.695 -3.949 1.00 0.65 C ATOM 839 CZ TYR A 56 -7.231 -7.883 -3.704 1.00 0.67 C ATOM 840 OH TYR A 56 -6.521 -8.975 -3.272 1.00 0.79 O ATOM 841 H TYR A 56 -7.906 -3.527 -7.080 1.00 0.39 H ATOM 842 HA TYR A 56 -9.967 -5.569 -6.861 1.00 0.51 H ATOM 843 HB2 TYR A 56 -8.961 -3.618 -4.819 1.00 0.53 H ATOM 844 HB3 TYR A 56 -10.445 -4.537 -4.578 1.00 0.56 H ATOM 845 HD1 TYR A 56 -10.368 -6.986 -4.475 1.00 0.70 H ATOM 846 HD2 TYR A 56 -6.825 -4.660 -4.593 1.00 0.66 H ATOM 847 HE1 TYR A 56 -9.078 -8.930 -3.688 1.00 0.83 H ATOM 848 HE2 TYR A 56 -5.514 -6.618 -3.801 1.00 0.75 H ATOM 849 HH TYR A 56 -5.925 -8.729 -2.561 1.00 0.95 H ATOM 850 N GLY A 57 -10.647 -2.609 -7.697 1.00 0.41 N ATOM 851 CA GLY A 57 -11.726 -1.736 -8.128 1.00 0.45 C ATOM 852 C GLY A 57 -12.102 -0.713 -7.071 1.00 0.46 C ATOM 853 O GLY A 57 -13.288 -0.467 -6.819 1.00 0.61 O ATOM 854 H GLY A 57 -9.724 -2.368 -7.924 1.00 0.38 H ATOM 855 HA2 GLY A 57 -11.425 -1.210 -9.023 1.00 0.47 H ATOM 856 HA3 GLY A 57 -12.592 -2.345 -8.353 1.00 0.50 H ATOM 857 N VAL A 58 -11.105 -0.109 -6.454 1.00 0.38 N ATOM 858 CA VAL A 58 -11.371 0.853 -5.386 1.00 0.42 C ATOM 859 C VAL A 58 -10.869 2.237 -5.778 1.00 0.45 C ATOM 860 O VAL A 58 -10.365 2.401 -6.888 1.00 0.51 O ATOM 861 CB VAL A 58 -10.797 0.399 -3.983 1.00 0.42 C ATOM 862 CG1 VAL A 58 -11.062 -1.055 -3.749 1.00 0.59 C ATOM 863 CG2 VAL A 58 -9.309 0.686 -3.792 1.00 0.57 C ATOM 864 H VAL A 58 -10.184 -0.294 -6.746 1.00 0.34 H ATOM 865 HA VAL A 58 -12.444 0.934 -5.310 1.00 0.50 H ATOM 866 HB VAL A 58 -11.355 0.957 -3.249 1.00 0.56 H ATOM 867 HG11 VAL A 58 -12.118 -1.262 -3.841 1.00 1.23 H ATOM 868 HG12 VAL A 58 -10.715 -1.332 -2.763 1.00 1.25 H ATOM 869 HG13 VAL A 58 -10.498 -1.595 -4.500 1.00 1.06 H ATOM 870 HG21 VAL A 58 -8.714 0.150 -4.515 1.00 1.05 H ATOM 871 HG22 VAL A 58 -9.031 0.376 -2.795 1.00 1.24 H ATOM 872 HG23 VAL A 58 -9.132 1.746 -3.892 1.00 1.24 H ATOM 873 N SER A 59 -10.995 3.206 -4.884 1.00 0.51 N ATOM 874 CA SER A 59 -10.548 4.544 -5.141 1.00 0.61 C ATOM 875 C SER A 59 -10.120 5.217 -3.834 1.00 0.56 C ATOM 876 O SER A 59 -10.910 5.311 -2.891 1.00 0.63 O ATOM 877 CB SER A 59 -11.669 5.334 -5.815 1.00 0.84 C ATOM 878 OG SER A 59 -12.880 5.254 -5.053 1.00 1.59 O ATOM 879 H SER A 59 -11.410 3.043 -4.011 1.00 0.54 H ATOM 880 HA SER A 59 -9.702 4.504 -5.807 1.00 0.62 H ATOM 881 HB2 SER A 59 -11.358 6.365 -5.871 1.00 1.32 H ATOM 882 HB3 SER A 59 -11.840 4.948 -6.808 1.00 1.36 H ATOM 883 HG SER A 59 -12.651 5.416 -4.132 1.00 2.14 H ATOM 884 N ILE A 60 -8.883 5.627 -3.769 1.00 0.50 N ATOM 885 CA ILE A 60 -8.367 6.336 -2.626 1.00 0.48 C ATOM 886 C ILE A 60 -8.388 7.849 -2.920 1.00 0.53 C ATOM 887 O ILE A 60 -7.763 8.313 -3.879 1.00 0.63 O ATOM 888 CB ILE A 60 -6.925 5.866 -2.248 1.00 0.48 C ATOM 889 CG1 ILE A 60 -6.936 4.356 -1.897 1.00 0.64 C ATOM 890 CG2 ILE A 60 -6.378 6.695 -1.075 1.00 0.53 C ATOM 891 CD1 ILE A 60 -5.571 3.783 -1.547 1.00 0.75 C ATOM 892 H ILE A 60 -8.289 5.443 -4.539 1.00 0.50 H ATOM 893 HA ILE A 60 -9.034 6.144 -1.799 1.00 0.59 H ATOM 894 HB ILE A 60 -6.278 6.021 -3.100 1.00 0.50 H ATOM 895 HG12 ILE A 60 -7.582 4.202 -1.047 1.00 1.29 H ATOM 896 HG13 ILE A 60 -7.333 3.808 -2.739 1.00 1.27 H ATOM 897 HG21 ILE A 60 -6.361 7.734 -1.375 1.00 1.01 H ATOM 898 HG22 ILE A 60 -5.376 6.369 -0.829 1.00 1.13 H ATOM 899 HG23 ILE A 60 -7.022 6.581 -0.214 1.00 1.23 H ATOM 900 HD11 ILE A 60 -5.669 2.740 -1.280 1.00 1.11 H ATOM 901 HD12 ILE A 60 -5.157 4.330 -0.711 1.00 1.35 H ATOM 902 HD13 ILE A 60 -4.912 3.870 -2.399 1.00 1.64 H ATOM 903 N PRO A 61 -9.125 8.631 -2.120 1.00 0.65 N ATOM 904 CA PRO A 61 -9.266 10.077 -2.322 1.00 0.77 C ATOM 905 C PRO A 61 -7.987 10.862 -1.998 1.00 0.65 C ATOM 906 O PRO A 61 -7.301 10.582 -0.995 1.00 0.57 O ATOM 907 CB PRO A 61 -10.402 10.483 -1.363 1.00 0.97 C ATOM 908 CG PRO A 61 -10.979 9.185 -0.865 1.00 1.08 C ATOM 909 CD PRO A 61 -9.874 8.180 -0.960 1.00 0.83 C ATOM 910 HA PRO A 61 -9.566 10.290 -3.338 1.00 0.88 H ATOM 911 HB2 PRO A 61 -9.983 11.070 -0.556 1.00 0.93 H ATOM 912 HB3 PRO A 61 -11.131 11.069 -1.909 1.00 1.15 H ATOM 913 HG2 PRO A 61 -11.287 9.291 0.166 1.00 1.24 H ATOM 914 HG3 PRO A 61 -11.814 8.884 -1.483 1.00 1.25 H ATOM 915 HD2 PRO A 61 -9.256 8.225 -0.079 1.00 0.83 H ATOM 916 HD3 PRO A 61 -10.256 7.181 -1.098 1.00 0.88 H ATOM 917 N ASP A 62 -7.734 11.879 -2.828 1.00 0.74 N ATOM 918 CA ASP A 62 -6.552 12.797 -2.752 1.00 0.73 C ATOM 919 C ASP A 62 -6.179 13.235 -1.325 1.00 0.62 C ATOM 920 O ASP A 62 -5.035 13.072 -0.900 1.00 0.64 O ATOM 921 CB ASP A 62 -6.821 14.042 -3.617 1.00 0.93 C ATOM 922 CG ASP A 62 -5.740 15.105 -3.529 1.00 1.44 C ATOM 923 OD1 ASP A 62 -4.738 15.026 -4.280 1.00 2.07 O ATOM 924 OD2 ASP A 62 -5.879 16.041 -2.720 1.00 1.92 O ATOM 925 H ASP A 62 -8.364 12.016 -3.568 1.00 0.89 H ATOM 926 HA ASP A 62 -5.707 12.284 -3.183 1.00 0.74 H ATOM 927 HB2 ASP A 62 -6.887 13.732 -4.649 1.00 1.42 H ATOM 928 HB3 ASP A 62 -7.764 14.479 -3.323 1.00 1.50 H ATOM 929 N ASP A 63 -7.149 13.766 -0.596 1.00 0.63 N ATOM 930 CA ASP A 63 -6.931 14.289 0.772 1.00 0.61 C ATOM 931 C ASP A 63 -6.445 13.214 1.727 1.00 0.59 C ATOM 932 O ASP A 63 -5.635 13.462 2.610 1.00 0.64 O ATOM 933 CB ASP A 63 -8.223 14.885 1.344 1.00 0.77 C ATOM 934 CG ASP A 63 -8.692 16.126 0.640 1.00 1.36 C ATOM 935 OD1 ASP A 63 -9.269 16.008 -0.473 1.00 2.00 O ATOM 936 OD2 ASP A 63 -8.449 17.246 1.158 1.00 2.10 O ATOM 937 H ASP A 63 -8.038 13.843 -0.999 1.00 0.73 H ATOM 938 HA ASP A 63 -6.192 15.079 0.716 1.00 0.64 H ATOM 939 HB2 ASP A 63 -9.015 14.154 1.278 1.00 1.22 H ATOM 940 HB3 ASP A 63 -8.063 15.127 2.384 1.00 1.43 H ATOM 941 N VAL A 64 -6.883 12.004 1.508 1.00 0.62 N ATOM 942 CA VAL A 64 -6.605 10.918 2.430 1.00 0.69 C ATOM 943 C VAL A 64 -5.154 10.417 2.303 1.00 0.67 C ATOM 944 O VAL A 64 -4.635 9.729 3.189 1.00 0.78 O ATOM 945 CB VAL A 64 -7.648 9.759 2.296 1.00 0.82 C ATOM 946 CG1 VAL A 64 -7.483 8.728 3.400 1.00 0.98 C ATOM 947 CG2 VAL A 64 -9.055 10.315 2.310 1.00 0.90 C ATOM 948 H VAL A 64 -7.372 11.821 0.679 1.00 0.65 H ATOM 949 HA VAL A 64 -6.708 11.353 3.415 1.00 0.75 H ATOM 950 HB VAL A 64 -7.487 9.269 1.346 1.00 0.81 H ATOM 951 HG11 VAL A 64 -8.220 7.952 3.274 1.00 1.47 H ATOM 952 HG12 VAL A 64 -7.607 9.200 4.360 1.00 1.46 H ATOM 953 HG13 VAL A 64 -6.501 8.286 3.328 1.00 1.30 H ATOM 954 HG21 VAL A 64 -9.173 11.000 1.484 1.00 1.40 H ATOM 955 HG22 VAL A 64 -9.208 10.838 3.242 1.00 1.21 H ATOM 956 HG23 VAL A 64 -9.760 9.501 2.224 1.00 1.47 H ATOM 957 N ALA A 65 -4.493 10.819 1.225 1.00 0.61 N ATOM 958 CA ALA A 65 -3.106 10.434 0.963 1.00 0.67 C ATOM 959 C ALA A 65 -2.182 10.912 2.080 1.00 0.64 C ATOM 960 O ALA A 65 -1.299 10.183 2.518 1.00 0.74 O ATOM 961 CB ALA A 65 -2.637 10.997 -0.374 1.00 0.77 C ATOM 962 H ALA A 65 -4.941 11.410 0.583 1.00 0.61 H ATOM 963 HA ALA A 65 -3.073 9.355 0.912 1.00 0.76 H ATOM 964 HB1 ALA A 65 -1.621 10.684 -0.571 1.00 1.31 H ATOM 965 HB2 ALA A 65 -2.672 12.079 -0.351 1.00 1.30 H ATOM 966 HB3 ALA A 65 -3.279 10.635 -1.166 1.00 1.19 H ATOM 967 N GLY A 66 -2.439 12.103 2.585 1.00 0.58 N ATOM 968 CA GLY A 66 -1.588 12.676 3.600 1.00 0.66 C ATOM 969 C GLY A 66 -1.973 12.269 5.011 1.00 0.68 C ATOM 970 O GLY A 66 -1.810 13.048 5.950 1.00 0.86 O ATOM 971 H GLY A 66 -3.217 12.601 2.255 1.00 0.56 H ATOM 972 HA2 GLY A 66 -0.574 12.357 3.412 1.00 0.71 H ATOM 973 HA3 GLY A 66 -1.635 13.752 3.523 1.00 0.76 H ATOM 974 N ARG A 67 -2.527 11.080 5.158 1.00 0.64 N ATOM 975 CA ARG A 67 -2.896 10.560 6.476 1.00 0.79 C ATOM 976 C ARG A 67 -2.146 9.282 6.812 1.00 0.77 C ATOM 977 O ARG A 67 -2.389 8.670 7.847 1.00 0.95 O ATOM 978 CB ARG A 67 -4.417 10.294 6.598 1.00 0.94 C ATOM 979 CG ARG A 67 -5.309 11.512 6.892 1.00 1.12 C ATOM 980 CD ARG A 67 -5.322 12.552 5.781 1.00 1.40 C ATOM 981 NE ARG A 67 -6.319 13.622 6.029 1.00 1.89 N ATOM 982 CZ ARG A 67 -6.286 14.870 5.486 1.00 2.51 C ATOM 983 NH1 ARG A 67 -5.242 15.257 4.764 1.00 2.93 N ATOM 984 NH2 ARG A 67 -7.306 15.728 5.673 1.00 3.22 N ATOM 985 H ARG A 67 -2.697 10.534 4.360 1.00 0.62 H ATOM 986 HA ARG A 67 -2.626 11.317 7.197 1.00 0.90 H ATOM 987 HB2 ARG A 67 -4.772 9.856 5.675 1.00 1.03 H ATOM 988 HB3 ARG A 67 -4.558 9.570 7.387 1.00 1.14 H ATOM 989 HG2 ARG A 67 -6.322 11.175 7.058 1.00 1.53 H ATOM 990 HG3 ARG A 67 -4.930 11.982 7.788 1.00 1.58 H ATOM 991 HD2 ARG A 67 -4.343 13.004 5.710 1.00 1.87 H ATOM 992 HD3 ARG A 67 -5.549 12.066 4.845 1.00 1.90 H ATOM 993 HE ARG A 67 -7.084 13.349 6.597 1.00 2.27 H ATOM 994 HH11 ARG A 67 -4.458 14.665 4.592 1.00 2.92 H ATOM 995 HH12 ARG A 67 -5.192 16.163 4.329 1.00 3.61 H ATOM 996 HH21 ARG A 67 -8.124 15.520 6.224 1.00 3.51 H ATOM 997 HH22 ARG A 67 -7.333 16.639 5.238 1.00 3.77 H ATOM 998 N VAL A 68 -1.234 8.872 5.958 1.00 0.62 N ATOM 999 CA VAL A 68 -0.515 7.623 6.184 1.00 0.66 C ATOM 1000 C VAL A 68 0.989 7.819 6.113 1.00 0.67 C ATOM 1001 O VAL A 68 1.482 8.678 5.363 1.00 1.00 O ATOM 1002 CB VAL A 68 -0.924 6.503 5.148 1.00 0.68 C ATOM 1003 CG1 VAL A 68 -2.401 6.174 5.226 1.00 0.77 C ATOM 1004 CG2 VAL A 68 -0.548 6.893 3.716 1.00 0.64 C ATOM 1005 H VAL A 68 -1.000 9.398 5.164 1.00 0.55 H ATOM 1006 HA VAL A 68 -0.763 7.269 7.173 1.00 0.78 H ATOM 1007 HB VAL A 68 -0.374 5.610 5.408 1.00 0.78 H ATOM 1008 HG11 VAL A 68 -2.637 5.425 4.482 1.00 1.27 H ATOM 1009 HG12 VAL A 68 -2.961 7.073 5.019 1.00 1.31 H ATOM 1010 HG13 VAL A 68 -2.633 5.810 6.217 1.00 1.26 H ATOM 1011 HG21 VAL A 68 -1.054 7.807 3.437 1.00 1.20 H ATOM 1012 HG22 VAL A 68 -0.844 6.110 3.032 1.00 1.23 H ATOM 1013 HG23 VAL A 68 0.524 7.029 3.648 1.00 1.15 H ATOM 1014 N ASP A 69 1.711 7.080 6.936 1.00 0.54 N ATOM 1015 CA ASP A 69 3.166 6.996 6.807 1.00 0.64 C ATOM 1016 C ASP A 69 3.677 5.602 7.121 1.00 0.50 C ATOM 1017 O ASP A 69 4.889 5.320 7.005 1.00 0.54 O ATOM 1018 CB ASP A 69 3.989 8.107 7.523 1.00 0.99 C ATOM 1019 CG ASP A 69 3.912 8.139 9.040 1.00 1.11 C ATOM 1020 OD1 ASP A 69 4.519 7.245 9.687 1.00 1.84 O ATOM 1021 OD2 ASP A 69 3.178 8.972 9.589 1.00 1.37 O ATOM 1022 H ASP A 69 1.261 6.601 7.672 1.00 0.66 H ATOM 1023 HA ASP A 69 3.314 7.087 5.741 1.00 0.75 H ATOM 1024 HB2 ASP A 69 5.029 7.970 7.269 1.00 1.65 H ATOM 1025 HB3 ASP A 69 3.672 9.066 7.141 1.00 1.55 H ATOM 1026 N THR A 70 2.750 4.701 7.433 1.00 0.43 N ATOM 1027 CA THR A 70 3.070 3.307 7.624 1.00 0.37 C ATOM 1028 C THR A 70 2.121 2.449 6.749 1.00 0.33 C ATOM 1029 O THR A 70 0.923 2.795 6.585 1.00 0.34 O ATOM 1030 CB THR A 70 2.934 2.887 9.118 1.00 0.42 C ATOM 1031 OG1 THR A 70 1.615 3.143 9.596 1.00 0.51 O ATOM 1032 CG2 THR A 70 3.920 3.628 9.987 1.00 0.44 C ATOM 1033 H THR A 70 1.813 4.972 7.550 1.00 0.50 H ATOM 1034 HA THR A 70 4.086 3.151 7.292 1.00 0.40 H ATOM 1035 HB THR A 70 3.132 1.825 9.189 1.00 0.46 H ATOM 1036 HG1 THR A 70 1.402 4.077 9.430 1.00 0.52 H ATOM 1037 HG21 THR A 70 4.919 3.406 9.643 1.00 1.19 H ATOM 1038 HG22 THR A 70 3.808 3.303 11.012 1.00 1.03 H ATOM 1039 HG23 THR A 70 3.741 4.690 9.895 1.00 1.11 H ATOM 1040 N PRO A 71 2.617 1.338 6.144 1.00 0.32 N ATOM 1041 CA PRO A 71 1.800 0.410 5.320 1.00 0.31 C ATOM 1042 C PRO A 71 0.619 -0.176 6.119 1.00 0.29 C ATOM 1043 O PRO A 71 -0.369 -0.642 5.552 1.00 0.33 O ATOM 1044 CB PRO A 71 2.793 -0.698 4.948 1.00 0.34 C ATOM 1045 CG PRO A 71 4.116 -0.043 5.026 1.00 0.38 C ATOM 1046 CD PRO A 71 4.031 0.920 6.169 1.00 0.36 C ATOM 1047 HA PRO A 71 1.439 0.904 4.429 1.00 0.35 H ATOM 1048 HB2 PRO A 71 2.714 -1.522 5.644 1.00 0.33 H ATOM 1049 HB3 PRO A 71 2.594 -1.047 3.944 1.00 0.41 H ATOM 1050 HG2 PRO A 71 4.862 -0.798 5.219 1.00 0.40 H ATOM 1051 HG3 PRO A 71 4.330 0.483 4.109 1.00 0.43 H ATOM 1052 HD2 PRO A 71 4.277 0.425 7.100 1.00 0.36 H ATOM 1053 HD3 PRO A 71 4.686 1.764 5.987 1.00 0.41 H ATOM 1054 N ARG A 72 0.755 -0.131 7.430 1.00 0.30 N ATOM 1055 CA ARG A 72 -0.275 -0.534 8.381 1.00 0.34 C ATOM 1056 C ARG A 72 -1.581 0.193 8.069 1.00 0.36 C ATOM 1057 O ARG A 72 -2.644 -0.416 7.907 1.00 0.43 O ATOM 1058 CB ARG A 72 0.212 -0.112 9.765 1.00 0.41 C ATOM 1059 CG ARG A 72 -0.715 -0.349 10.930 1.00 0.54 C ATOM 1060 CD ARG A 72 -0.137 0.304 12.177 1.00 0.69 C ATOM 1061 NE ARG A 72 -0.046 1.780 12.043 1.00 0.75 N ATOM 1062 CZ ARG A 72 0.366 2.617 13.010 1.00 0.98 C ATOM 1063 NH1 ARG A 72 1.091 2.149 14.026 1.00 1.38 N ATOM 1064 NH2 ARG A 72 0.179 3.952 12.892 1.00 1.16 N ATOM 1065 H ARG A 72 1.614 0.197 7.784 1.00 0.31 H ATOM 1066 HA ARG A 72 -0.424 -1.603 8.365 1.00 0.37 H ATOM 1067 HB2 ARG A 72 1.131 -0.638 9.980 1.00 0.47 H ATOM 1068 HB3 ARG A 72 0.456 0.939 9.739 1.00 0.43 H ATOM 1069 HG2 ARG A 72 -1.675 0.098 10.713 1.00 0.56 H ATOM 1070 HG3 ARG A 72 -0.823 -1.411 11.096 1.00 0.63 H ATOM 1071 HD2 ARG A 72 -0.783 0.079 13.012 1.00 0.82 H ATOM 1072 HD3 ARG A 72 0.849 -0.095 12.368 1.00 0.79 H ATOM 1073 HE ARG A 72 -0.384 2.143 11.196 1.00 0.96 H ATOM 1074 HH11 ARG A 72 1.378 1.178 14.100 1.00 1.51 H ATOM 1075 HH12 ARG A 72 1.376 2.755 14.772 1.00 1.75 H ATOM 1076 HH21 ARG A 72 -0.252 4.411 12.104 1.00 1.26 H ATOM 1077 HH22 ARG A 72 0.453 4.568 13.644 1.00 1.42 H ATOM 1078 N GLU A 73 -1.452 1.483 7.910 1.00 0.37 N ATOM 1079 CA GLU A 73 -2.562 2.391 7.728 1.00 0.42 C ATOM 1080 C GLU A 73 -3.073 2.307 6.306 1.00 0.40 C ATOM 1081 O GLU A 73 -4.256 2.486 6.051 1.00 0.44 O ATOM 1082 CB GLU A 73 -2.074 3.786 8.055 1.00 0.50 C ATOM 1083 CG GLU A 73 -1.425 3.825 9.410 1.00 0.63 C ATOM 1084 CD GLU A 73 -0.673 5.084 9.698 1.00 0.74 C ATOM 1085 OE1 GLU A 73 0.253 5.433 8.914 1.00 0.69 O ATOM 1086 OE2 GLU A 73 -0.966 5.708 10.745 1.00 1.33 O ATOM 1087 H GLU A 73 -0.550 1.869 7.895 1.00 0.36 H ATOM 1088 HA GLU A 73 -3.338 2.110 8.421 1.00 0.45 H ATOM 1089 HB2 GLU A 73 -1.339 4.073 7.319 1.00 0.50 H ATOM 1090 HB3 GLU A 73 -2.895 4.487 8.024 1.00 0.58 H ATOM 1091 HG2 GLU A 73 -2.203 3.725 10.150 1.00 1.01 H ATOM 1092 HG3 GLU A 73 -0.745 2.988 9.497 1.00 0.99 H ATOM 1093 N LEU A 74 -2.171 1.980 5.395 1.00 0.40 N ATOM 1094 CA LEU A 74 -2.501 1.837 3.985 1.00 0.43 C ATOM 1095 C LEU A 74 -3.424 0.599 3.845 1.00 0.41 C ATOM 1096 O LEU A 74 -4.466 0.652 3.194 1.00 0.42 O ATOM 1097 CB LEU A 74 -1.181 1.639 3.178 1.00 0.44 C ATOM 1098 CG LEU A 74 -1.138 2.077 1.687 1.00 0.50 C ATOM 1099 CD1 LEU A 74 0.222 1.775 1.082 1.00 1.04 C ATOM 1100 CD2 LEU A 74 -2.221 1.417 0.863 1.00 1.10 C ATOM 1101 H LEU A 74 -1.251 1.819 5.685 1.00 0.42 H ATOM 1102 HA LEU A 74 -3.007 2.729 3.643 1.00 0.46 H ATOM 1103 HB2 LEU A 74 -0.409 2.186 3.696 1.00 0.46 H ATOM 1104 HB3 LEU A 74 -0.934 0.588 3.224 1.00 0.45 H ATOM 1105 HG LEU A 74 -1.274 3.148 1.645 1.00 0.90 H ATOM 1106 HD11 LEU A 74 0.407 0.713 1.121 1.00 1.74 H ATOM 1107 HD12 LEU A 74 0.993 2.297 1.628 1.00 1.51 H ATOM 1108 HD13 LEU A 74 0.238 2.100 0.053 1.00 1.48 H ATOM 1109 HD21 LEU A 74 -3.188 1.669 1.276 1.00 1.61 H ATOM 1110 HD22 LEU A 74 -2.082 0.346 0.891 1.00 1.53 H ATOM 1111 HD23 LEU A 74 -2.172 1.765 -0.159 1.00 1.77 H ATOM 1112 N LEU A 75 -3.028 -0.495 4.504 1.00 0.41 N ATOM 1113 CA LEU A 75 -3.783 -1.746 4.488 1.00 0.41 C ATOM 1114 C LEU A 75 -5.144 -1.543 5.137 1.00 0.39 C ATOM 1115 O LEU A 75 -6.180 -1.852 4.537 1.00 0.37 O ATOM 1116 CB LEU A 75 -3.015 -2.854 5.237 1.00 0.46 C ATOM 1117 CG LEU A 75 -3.638 -4.256 5.216 1.00 0.48 C ATOM 1118 CD1 LEU A 75 -3.579 -4.849 3.824 1.00 0.51 C ATOM 1119 CD2 LEU A 75 -2.939 -5.164 6.220 1.00 0.54 C ATOM 1120 H LEU A 75 -2.189 -0.456 5.010 1.00 0.44 H ATOM 1121 HA LEU A 75 -3.909 -2.043 3.458 1.00 0.43 H ATOM 1122 HB2 LEU A 75 -2.024 -2.920 4.812 1.00 0.49 H ATOM 1123 HB3 LEU A 75 -2.921 -2.553 6.269 1.00 0.48 H ATOM 1124 HG LEU A 75 -4.683 -4.186 5.488 1.00 0.46 H ATOM 1125 HD11 LEU A 75 -4.090 -4.202 3.124 1.00 1.20 H ATOM 1126 HD12 LEU A 75 -4.037 -5.828 3.840 1.00 1.09 H ATOM 1127 HD13 LEU A 75 -2.540 -4.947 3.538 1.00 1.04 H ATOM 1128 HD21 LEU A 75 -1.893 -5.247 5.957 1.00 1.17 H ATOM 1129 HD22 LEU A 75 -3.394 -6.143 6.189 1.00 1.16 H ATOM 1130 HD23 LEU A 75 -3.027 -4.750 7.213 1.00 1.11 H ATOM 1131 N ASP A 76 -5.118 -0.979 6.349 1.00 0.44 N ATOM 1132 CA ASP A 76 -6.321 -0.715 7.183 1.00 0.48 C ATOM 1133 C ASP A 76 -7.384 0.049 6.402 1.00 0.40 C ATOM 1134 O ASP A 76 -8.535 -0.391 6.284 1.00 0.44 O ATOM 1135 CB ASP A 76 -5.904 0.107 8.415 1.00 0.66 C ATOM 1136 CG ASP A 76 -7.044 0.452 9.374 1.00 1.06 C ATOM 1137 OD1 ASP A 76 -7.754 1.451 9.151 1.00 1.89 O ATOM 1138 OD2 ASP A 76 -7.191 -0.243 10.402 1.00 1.08 O ATOM 1139 H ASP A 76 -4.246 -0.721 6.722 1.00 0.49 H ATOM 1140 HA ASP A 76 -6.714 -1.663 7.519 1.00 0.53 H ATOM 1141 HB2 ASP A 76 -5.170 -0.457 8.971 1.00 1.10 H ATOM 1142 HB3 ASP A 76 -5.447 1.026 8.078 1.00 1.09 H ATOM 1143 N LEU A 77 -6.955 1.145 5.814 1.00 0.37 N ATOM 1144 CA LEU A 77 -7.807 2.051 5.063 1.00 0.38 C ATOM 1145 C LEU A 77 -8.464 1.355 3.860 1.00 0.33 C ATOM 1146 O LEU A 77 -9.670 1.514 3.612 1.00 0.34 O ATOM 1147 CB LEU A 77 -6.967 3.232 4.597 1.00 0.46 C ATOM 1148 CG LEU A 77 -7.682 4.327 3.831 1.00 0.57 C ATOM 1149 CD1 LEU A 77 -8.744 4.975 4.691 1.00 1.37 C ATOM 1150 CD2 LEU A 77 -6.679 5.348 3.348 1.00 1.24 C ATOM 1151 H LEU A 77 -6.003 1.376 5.889 1.00 0.40 H ATOM 1152 HA LEU A 77 -8.573 2.426 5.726 1.00 0.45 H ATOM 1153 HB2 LEU A 77 -6.515 3.689 5.465 1.00 0.58 H ATOM 1154 HB3 LEU A 77 -6.181 2.844 3.970 1.00 0.49 H ATOM 1155 HG LEU A 77 -8.177 3.907 2.967 1.00 1.09 H ATOM 1156 HD11 LEU A 77 -9.465 4.226 4.973 1.00 1.82 H ATOM 1157 HD12 LEU A 77 -9.234 5.767 4.146 1.00 1.74 H ATOM 1158 HD13 LEU A 77 -8.286 5.370 5.583 1.00 2.11 H ATOM 1159 HD21 LEU A 77 -5.956 4.871 2.708 1.00 1.84 H ATOM 1160 HD22 LEU A 77 -6.182 5.778 4.202 1.00 1.74 H ATOM 1161 HD23 LEU A 77 -7.181 6.130 2.799 1.00 1.79 H ATOM 1162 N ILE A 78 -7.691 0.554 3.138 1.00 0.31 N ATOM 1163 CA ILE A 78 -8.217 -0.115 1.971 1.00 0.32 C ATOM 1164 C ILE A 78 -9.166 -1.221 2.391 1.00 0.29 C ATOM 1165 O ILE A 78 -10.262 -1.350 1.842 1.00 0.33 O ATOM 1166 CB ILE A 78 -7.109 -0.662 1.031 1.00 0.39 C ATOM 1167 CG1 ILE A 78 -6.316 0.515 0.447 1.00 0.53 C ATOM 1168 CG2 ILE A 78 -7.716 -1.518 -0.096 1.00 0.44 C ATOM 1169 CD1 ILE A 78 -5.280 0.124 -0.587 1.00 0.63 C ATOM 1170 H ILE A 78 -6.768 0.403 3.435 1.00 0.33 H ATOM 1171 HA ILE A 78 -8.776 0.640 1.436 1.00 0.39 H ATOM 1172 HB ILE A 78 -6.437 -1.285 1.598 1.00 0.40 H ATOM 1173 HG12 ILE A 78 -7.018 1.190 -0.020 1.00 1.11 H ATOM 1174 HG13 ILE A 78 -5.817 1.029 1.255 1.00 1.01 H ATOM 1175 HG21 ILE A 78 -6.918 -1.869 -0.733 1.00 1.18 H ATOM 1176 HG22 ILE A 78 -8.419 -0.925 -0.666 1.00 0.99 H ATOM 1177 HG23 ILE A 78 -8.230 -2.356 0.356 1.00 1.11 H ATOM 1178 HD11 ILE A 78 -4.771 1.003 -0.951 1.00 1.29 H ATOM 1179 HD12 ILE A 78 -5.769 -0.365 -1.418 1.00 1.27 H ATOM 1180 HD13 ILE A 78 -4.560 -0.550 -0.147 1.00 1.30 H ATOM 1181 N ASN A 79 -8.760 -1.987 3.406 1.00 0.30 N ATOM 1182 CA ASN A 79 -9.587 -3.077 3.922 1.00 0.33 C ATOM 1183 C ASN A 79 -10.940 -2.552 4.394 1.00 0.37 C ATOM 1184 O ASN A 79 -11.980 -3.160 4.115 1.00 0.46 O ATOM 1185 CB ASN A 79 -8.916 -3.860 5.072 1.00 0.42 C ATOM 1186 CG ASN A 79 -7.736 -4.745 4.676 1.00 0.53 C ATOM 1187 OD1 ASN A 79 -6.860 -5.028 5.491 1.00 1.21 O ATOM 1188 ND2 ASN A 79 -7.693 -5.183 3.435 1.00 0.55 N ATOM 1189 H ASN A 79 -7.891 -1.793 3.830 1.00 0.32 H ATOM 1190 HA ASN A 79 -9.767 -3.758 3.101 1.00 0.39 H ATOM 1191 HB2 ASN A 79 -8.543 -3.152 5.800 1.00 0.48 H ATOM 1192 HB3 ASN A 79 -9.669 -4.476 5.539 1.00 0.47 H ATOM 1193 HD21 ASN A 79 -8.403 -4.927 2.815 1.00 1.07 H ATOM 1194 HD22 ASN A 79 -6.927 -5.750 3.201 1.00 0.51 H ATOM 1195 N GLY A 80 -10.922 -1.409 5.067 1.00 0.37 N ATOM 1196 CA GLY A 80 -12.140 -0.799 5.543 1.00 0.46 C ATOM 1197 C GLY A 80 -13.081 -0.389 4.405 1.00 0.47 C ATOM 1198 O GLY A 80 -14.296 -0.594 4.485 1.00 0.57 O ATOM 1199 H GLY A 80 -10.058 -0.976 5.258 1.00 0.36 H ATOM 1200 HA2 GLY A 80 -12.658 -1.501 6.182 1.00 0.53 H ATOM 1201 HA3 GLY A 80 -11.866 0.084 6.106 1.00 0.49 H ATOM 1202 N ALA A 81 -12.522 0.149 3.335 1.00 0.43 N ATOM 1203 CA ALA A 81 -13.324 0.597 2.215 1.00 0.49 C ATOM 1204 C ALA A 81 -13.875 -0.595 1.427 1.00 0.54 C ATOM 1205 O ALA A 81 -14.964 -0.522 0.852 1.00 0.68 O ATOM 1206 CB ALA A 81 -12.519 1.514 1.330 1.00 0.49 C ATOM 1207 H ALA A 81 -11.546 0.248 3.280 1.00 0.39 H ATOM 1208 HA ALA A 81 -14.164 1.148 2.612 1.00 0.55 H ATOM 1209 HB1 ALA A 81 -11.681 0.967 0.923 1.00 1.19 H ATOM 1210 HB2 ALA A 81 -12.163 2.336 1.934 1.00 1.14 H ATOM 1211 HB3 ALA A 81 -13.149 1.897 0.538 1.00 1.01 H ATOM 1212 N LEU A 82 -13.125 -1.690 1.414 1.00 0.48 N ATOM 1213 CA LEU A 82 -13.566 -2.939 0.782 1.00 0.57 C ATOM 1214 C LEU A 82 -14.857 -3.440 1.421 1.00 0.70 C ATOM 1215 O LEU A 82 -15.740 -3.948 0.738 1.00 0.87 O ATOM 1216 CB LEU A 82 -12.502 -4.027 0.928 1.00 0.54 C ATOM 1217 CG LEU A 82 -11.174 -3.808 0.224 1.00 0.55 C ATOM 1218 CD1 LEU A 82 -10.220 -4.921 0.582 1.00 0.61 C ATOM 1219 CD2 LEU A 82 -11.367 -3.755 -1.280 1.00 0.63 C ATOM 1220 H LEU A 82 -12.226 -1.650 1.809 1.00 0.42 H ATOM 1221 HA LEU A 82 -13.728 -2.744 -0.268 1.00 0.62 H ATOM 1222 HB2 LEU A 82 -12.303 -4.152 1.981 1.00 0.56 H ATOM 1223 HB3 LEU A 82 -12.918 -4.953 0.560 1.00 0.59 H ATOM 1224 HG LEU A 82 -10.752 -2.867 0.548 1.00 0.57 H ATOM 1225 HD11 LEU A 82 -9.274 -4.753 0.087 1.00 1.16 H ATOM 1226 HD12 LEU A 82 -10.621 -5.878 0.279 1.00 1.10 H ATOM 1227 HD13 LEU A 82 -10.067 -4.929 1.652 1.00 1.22 H ATOM 1228 HD21 LEU A 82 -12.035 -2.940 -1.523 1.00 1.12 H ATOM 1229 HD22 LEU A 82 -11.774 -4.692 -1.635 1.00 1.26 H ATOM 1230 HD23 LEU A 82 -10.406 -3.585 -1.746 1.00 1.22 H ATOM 1231 N ALA A 83 -14.976 -3.252 2.728 1.00 0.69 N ATOM 1232 CA ALA A 83 -16.132 -3.713 3.482 1.00 0.87 C ATOM 1233 C ALA A 83 -17.389 -2.904 3.165 1.00 1.01 C ATOM 1234 O ALA A 83 -18.502 -3.295 3.544 1.00 1.25 O ATOM 1235 CB ALA A 83 -15.839 -3.690 4.975 1.00 0.90 C ATOM 1236 H ALA A 83 -14.250 -2.795 3.207 1.00 0.62 H ATOM 1237 HA ALA A 83 -16.314 -4.740 3.196 1.00 0.97 H ATOM 1238 HB1 ALA A 83 -14.952 -4.278 5.164 1.00 1.39 H ATOM 1239 HB2 ALA A 83 -16.685 -4.125 5.487 1.00 1.30 H ATOM 1240 HB3 ALA A 83 -15.703 -2.670 5.307 1.00 1.25 H ATOM 1241 N GLU A 84 -17.221 -1.784 2.500 1.00 0.95 N ATOM 1242 CA GLU A 84 -18.343 -0.962 2.100 1.00 1.11 C ATOM 1243 C GLU A 84 -18.550 -1.091 0.569 1.00 1.18 C ATOM 1244 O GLU A 84 -19.404 -0.444 -0.037 1.00 1.36 O ATOM 1245 CB GLU A 84 -18.109 0.501 2.587 1.00 1.15 C ATOM 1246 CG GLU A 84 -19.252 1.467 2.318 1.00 1.57 C ATOM 1247 CD GLU A 84 -19.198 2.707 3.180 1.00 1.76 C ATOM 1248 OE1 GLU A 84 -18.090 3.179 3.459 1.00 1.86 O ATOM 1249 OE2 GLU A 84 -20.258 3.253 3.576 1.00 2.49 O ATOM 1250 H GLU A 84 -16.309 -1.503 2.278 1.00 0.84 H ATOM 1251 HA GLU A 84 -19.232 -1.362 2.568 1.00 1.28 H ATOM 1252 HB2 GLU A 84 -17.928 0.483 3.652 1.00 1.60 H ATOM 1253 HB3 GLU A 84 -17.227 0.887 2.095 1.00 1.38 H ATOM 1254 HG2 GLU A 84 -19.224 1.768 1.280 1.00 2.14 H ATOM 1255 HG3 GLU A 84 -20.172 0.938 2.507 1.00 2.20 H ATOM 1256 N ALA A 85 -17.774 -1.973 -0.033 1.00 1.15 N ATOM 1257 CA ALA A 85 -17.872 -2.226 -1.451 1.00 1.34 C ATOM 1258 C ALA A 85 -18.405 -3.632 -1.702 1.00 1.47 C ATOM 1259 O ALA A 85 -19.371 -3.806 -2.456 1.00 1.86 O ATOM 1260 CB ALA A 85 -16.508 -2.043 -2.124 1.00 1.37 C ATOM 1261 H ALA A 85 -17.120 -2.471 0.503 1.00 1.07 H ATOM 1262 HA ALA A 85 -18.569 -1.519 -1.879 1.00 1.54 H ATOM 1263 HB1 ALA A 85 -16.132 -1.049 -1.936 1.00 1.61 H ATOM 1264 HB2 ALA A 85 -16.595 -2.216 -3.188 1.00 1.71 H ATOM 1265 HB3 ALA A 85 -15.826 -2.770 -1.703 1.00 1.82 H ATOM 1266 N ALA A 86 -17.766 -4.615 -1.050 1.00 1.53 N ATOM 1267 CA ALA A 86 -18.084 -6.045 -1.153 1.00 1.70 C ATOM 1268 C ALA A 86 -17.761 -6.598 -2.545 1.00 2.36 C ATOM 1269 O ALA A 86 -18.624 -6.526 -3.456 1.00 2.86 O ATOM 1270 CB ALA A 86 -19.530 -6.361 -0.730 1.00 2.39 C ATOM 1271 OXT ALA A 86 -16.637 -7.066 -2.755 1.00 3.03 O ATOM 1272 H ALA A 86 -17.012 -4.389 -0.464 1.00 1.73 H ATOM 1273 HA ALA A 86 -17.413 -6.525 -0.454 1.00 1.65 H ATOM 1274 HB1 ALA A 86 -19.710 -5.976 0.262 1.00 2.96 H ATOM 1275 HB2 ALA A 86 -19.674 -7.431 -0.722 1.00 2.75 H ATOM 1276 HB3 ALA A 86 -20.230 -5.918 -1.422 1.00 2.71 H TER 1277 ALA A 86 HETATM 1278 P24 SXR A 101 5.669 12.054 -4.496 1.00 1.19 P HETATM 1279 O26 SXR A 101 6.739 13.180 -4.519 1.00 1.72 O HETATM 1280 O23 SXR A 101 4.340 12.345 -3.784 1.00 1.83 O HETATM 1281 O27 SXR A 101 5.395 11.654 -5.978 1.00 1.31 O HETATM 1282 C28 SXR A 101 4.556 10.479 -6.309 1.00 1.24 C HETATM 1283 C29 SXR A 101 4.232 10.444 -7.819 1.00 1.82 C HETATM 1284 C30 SXR A 101 3.266 9.272 -8.015 1.00 2.42 C HETATM 1285 C31 SXR A 101 3.530 11.747 -8.210 1.00 1.85 C HETATM 1286 C32 SXR A 101 5.596 10.269 -8.695 1.00 2.74 C HETATM 1287 O33 SXR A 101 6.467 11.379 -8.525 1.00 3.00 O HETATM 1288 C34 SXR A 101 5.338 10.187 -10.214 1.00 3.44 C HETATM 1289 O35 SXR A 101 5.779 11.077 -10.953 1.00 3.88 O HETATM 1290 N36 SXR A 101 4.674 9.146 -10.664 1.00 3.90 N HETATM 1291 C37 SXR A 101 4.332 8.891 -12.065 1.00 4.60 C HETATM 1292 C38 SXR A 101 3.041 8.101 -12.157 1.00 4.73 C HETATM 1293 C39 SXR A 101 1.884 8.859 -11.528 1.00 4.02 C HETATM 1294 O40 SXR A 101 1.608 10.019 -11.875 1.00 4.42 O HETATM 1295 N41 SXR A 101 1.221 8.219 -10.585 1.00 3.33 N HETATM 1296 C42 SXR A 101 0.106 8.823 -9.873 1.00 2.88 C HETATM 1297 C43 SXR A 101 -1.229 8.100 -10.055 1.00 2.85 C HETATM 1298 S1 SXR A 101 -1.328 6.737 -9.003 1.00 3.15 S HETATM 1299 C11 SXR A 101 -0.871 8.080 -1.568 1.00 2.09 C HETATM 1300 C10 SXR A 101 -0.286 7.361 -0.536 1.00 2.05 C HETATM 1301 C9 SXR A 101 -0.965 6.305 0.059 1.00 1.91 C HETATM 1302 C8 SXR A 101 -2.241 5.960 -0.377 1.00 2.19 C HETATM 1303 C7 SXR A 101 -2.830 6.687 -1.420 1.00 2.18 C HETATM 1304 C6 SXR A 101 -2.166 7.750 -2.031 1.00 1.95 C HETATM 1305 C5 SXR A 101 -2.801 8.543 -3.166 1.00 2.57 C HETATM 1306 C4 SXR A 101 -3.113 7.714 -4.422 1.00 2.29 C HETATM 1307 C3 SXR A 101 -2.980 8.488 -5.716 1.00 2.88 C HETATM 1308 O3 SXR A 101 -2.937 9.730 -5.700 1.00 3.69 O HETATM 1309 C2 SXR A 101 -2.862 7.744 -7.024 1.00 2.88 C HETATM 1310 C1 SXR A 101 -1.446 7.591 -7.500 1.00 2.84 C HETATM 1311 H28A SXR A 101 5.153 9.598 -6.110 1.00 1.41 H HETATM 1312 H28B SXR A 101 3.666 10.415 -5.694 1.00 0.99 H HETATM 1313 H30A SXR A 101 3.781 8.466 -8.509 1.00 2.99 H HETATM 1314 H30B SXR A 101 2.428 9.571 -8.633 1.00 2.62 H HETATM 1315 H30C SXR A 101 2.896 8.929 -7.062 1.00 2.79 H HETATM 1316 H31A SXR A 101 2.482 11.549 -8.395 1.00 2.21 H HETATM 1317 H31B SXR A 101 4.001 12.167 -9.087 1.00 2.37 H HETATM 1318 H31C SXR A 101 3.629 12.435 -7.382 1.00 1.95 H HETATM 1319 H32A SXR A 101 6.115 9.374 -8.384 1.00 3.10 H HETATM 1320 H33A SXR A 101 6.487 11.750 -9.419 1.00 3.40 H HETATM 1321 H36A SXR A 101 4.361 8.484 -10.009 1.00 3.96 H HETATM 1322 H37A SXR A 101 4.208 9.830 -12.579 1.00 4.70 H HETATM 1323 H37B SXR A 101 5.131 8.321 -12.529 1.00 5.21 H HETATM 1324 H38A SXR A 101 2.809 7.916 -13.200 1.00 5.22 H HETATM 1325 H38B SXR A 101 3.160 7.158 -11.645 1.00 5.25 H HETATM 1326 H41A SXR A 101 1.488 7.294 -10.335 1.00 3.43 H HETATM 1327 H42A SXR A 101 0.350 8.897 -8.817 1.00 3.18 H HETATM 1328 H42B SXR A 101 0.026 9.844 -10.215 1.00 2.75 H HETATM 1329 H43A SXR A 101 -1.422 7.822 -11.081 1.00 3.20 H HETATM 1330 H43B SXR A 101 -1.993 8.797 -9.744 1.00 2.98 H HETATM 1331 H11A SXR A 101 -0.334 8.906 -2.026 1.00 2.81 H HETATM 1332 H10A SXR A 101 0.702 7.630 -0.193 1.00 2.73 H HETATM 1333 H9A SXR A 101 -0.515 5.744 0.866 1.00 2.32 H HETATM 1334 H8A SXR A 101 -2.757 5.143 0.094 1.00 2.94 H HETATM 1335 H7A SXR A 101 -3.813 6.419 -1.748 1.00 2.89 H HETATM 1336 H5A SXR A 101 -3.363 9.461 -3.110 1.00 3.45 H HETATM 1337 H5B SXR A 101 -1.880 9.126 -3.255 1.00 2.83 H HETATM 1338 H4A SXR A 101 -3.112 6.649 -4.530 1.00 2.15 H HETATM 1339 H4B SXR A 101 -4.154 7.649 -4.123 1.00 2.47 H HETATM 1340 H2A SXR A 101 -3.557 7.029 -7.426 1.00 3.20 H HETATM 1341 H2B SXR A 101 -3.420 8.513 -7.556 1.00 3.39 H HETATM 1342 H1A SXR A 101 -0.582 8.165 -7.214 1.00 3.11 H HETATM 1343 H1B SXR A 101 -1.270 6.908 -6.673 1.00 2.74 H