ATOM 1 N GLY A 1 5.913 0.274 -12.652 1.00 4.47 N ATOM 2 CA GLY A 1 6.053 -1.149 -12.260 1.00 3.97 C ATOM 3 C GLY A 1 7.341 -1.746 -12.779 1.00 3.37 C ATOM 4 O GLY A 1 8.039 -1.122 -13.580 1.00 3.50 O ATOM 5 H1 GLY A 1 6.716 0.826 -12.289 1.00 4.73 H ATOM 6 H2 GLY A 1 5.032 0.669 -12.267 1.00 4.85 H ATOM 7 H3 GLY A 1 5.892 0.356 -13.687 1.00 4.60 H ATOM 8 HA2 GLY A 1 6.042 -1.219 -11.182 1.00 4.22 H ATOM 9 HA3 GLY A 1 5.219 -1.708 -12.657 1.00 4.13 H ATOM 10 N ALA A 2 7.656 -2.954 -12.329 1.00 3.02 N ATOM 11 CA ALA A 2 8.900 -3.608 -12.702 1.00 2.58 C ATOM 12 C ALA A 2 8.817 -5.100 -12.426 1.00 2.13 C ATOM 13 O ALA A 2 7.806 -5.578 -11.908 1.00 2.41 O ATOM 14 CB ALA A 2 10.061 -2.999 -11.928 1.00 2.87 C ATOM 15 H ALA A 2 7.035 -3.424 -11.734 1.00 3.29 H ATOM 16 HA ALA A 2 9.068 -3.447 -13.756 1.00 2.69 H ATOM 17 HB1 ALA A 2 10.129 -1.945 -12.153 1.00 3.11 H ATOM 18 HB2 ALA A 2 10.979 -3.489 -12.211 1.00 3.07 H ATOM 19 HB3 ALA A 2 9.894 -3.130 -10.870 1.00 3.20 H ATOM 20 N ALA A 3 9.867 -5.831 -12.784 1.00 1.91 N ATOM 21 CA ALA A 3 9.967 -7.242 -12.436 1.00 1.62 C ATOM 22 C ALA A 3 9.983 -7.388 -10.931 1.00 1.42 C ATOM 23 O ALA A 3 9.021 -7.842 -10.307 1.00 1.97 O ATOM 24 CB ALA A 3 11.242 -7.844 -13.003 1.00 1.64 C ATOM 25 H ALA A 3 10.592 -5.409 -13.294 1.00 2.26 H ATOM 26 HA ALA A 3 9.117 -7.767 -12.848 1.00 1.83 H ATOM 27 HB1 ALA A 3 11.171 -8.921 -12.981 1.00 1.93 H ATOM 28 HB2 ALA A 3 12.082 -7.531 -12.387 1.00 1.98 H ATOM 29 HB3 ALA A 3 11.387 -7.506 -14.017 1.00 1.96 H ATOM 30 N SER A 4 11.102 -6.995 -10.365 1.00 0.96 N ATOM 31 CA SER A 4 11.281 -6.939 -8.942 1.00 0.76 C ATOM 32 C SER A 4 11.003 -5.525 -8.448 1.00 0.67 C ATOM 33 O SER A 4 11.913 -4.721 -8.287 1.00 0.72 O ATOM 34 CB SER A 4 12.706 -7.374 -8.630 1.00 0.82 C ATOM 35 OG SER A 4 13.581 -7.026 -9.691 1.00 1.73 O ATOM 36 H SER A 4 11.863 -6.744 -10.933 1.00 1.17 H ATOM 37 HA SER A 4 10.590 -7.618 -8.481 1.00 0.82 H ATOM 38 HB2 SER A 4 13.037 -6.883 -7.743 1.00 1.13 H ATOM 39 HB3 SER A 4 12.736 -8.443 -8.489 1.00 1.14 H ATOM 40 HG SER A 4 13.590 -6.065 -9.795 1.00 2.10 H ATOM 41 N ALA A 5 9.740 -5.219 -8.216 1.00 0.62 N ATOM 42 CA ALA A 5 9.338 -3.862 -7.884 1.00 0.56 C ATOM 43 C ALA A 5 9.717 -3.483 -6.459 1.00 0.49 C ATOM 44 O ALA A 5 9.570 -2.334 -6.068 1.00 0.45 O ATOM 45 CB ALA A 5 7.849 -3.684 -8.103 1.00 0.59 C ATOM 46 H ALA A 5 9.054 -5.920 -8.270 1.00 0.64 H ATOM 47 HA ALA A 5 9.854 -3.193 -8.560 1.00 0.57 H ATOM 48 HB1 ALA A 5 7.580 -2.654 -7.927 1.00 1.20 H ATOM 49 HB2 ALA A 5 7.306 -4.320 -7.420 1.00 1.10 H ATOM 50 HB3 ALA A 5 7.599 -3.953 -9.120 1.00 1.23 H ATOM 51 N ALA A 6 10.247 -4.425 -5.695 1.00 0.50 N ATOM 52 CA ALA A 6 10.683 -4.124 -4.337 1.00 0.46 C ATOM 53 C ALA A 6 12.036 -3.442 -4.370 1.00 0.48 C ATOM 54 O ALA A 6 12.465 -2.829 -3.394 1.00 0.56 O ATOM 55 CB ALA A 6 10.736 -5.385 -3.495 1.00 0.51 C ATOM 56 H ALA A 6 10.375 -5.333 -6.048 1.00 0.55 H ATOM 57 HA ALA A 6 9.965 -3.444 -3.896 1.00 0.42 H ATOM 58 HB1 ALA A 6 11.098 -5.140 -2.507 1.00 1.19 H ATOM 59 HB2 ALA A 6 11.397 -6.102 -3.957 1.00 1.07 H ATOM 60 HB3 ALA A 6 9.742 -5.802 -3.418 1.00 1.15 H ATOM 61 N THR A 7 12.692 -3.526 -5.515 1.00 0.52 N ATOM 62 CA THR A 7 13.937 -2.824 -5.711 1.00 0.52 C ATOM 63 C THR A 7 13.691 -1.610 -6.601 1.00 0.50 C ATOM 64 O THR A 7 14.614 -0.874 -6.944 1.00 0.51 O ATOM 65 CB THR A 7 15.050 -3.730 -6.288 1.00 0.61 C ATOM 66 OG1 THR A 7 16.288 -3.014 -6.369 1.00 0.64 O ATOM 67 CG2 THR A 7 14.686 -4.272 -7.660 1.00 0.69 C ATOM 68 H THR A 7 12.304 -4.047 -6.252 1.00 0.65 H ATOM 69 HA THR A 7 14.263 -2.477 -4.742 1.00 0.49 H ATOM 70 HB THR A 7 15.176 -4.558 -5.613 1.00 0.64 H ATOM 71 HG1 THR A 7 16.106 -2.075 -6.502 1.00 0.92 H ATOM 72 HG21 THR A 7 14.505 -3.449 -8.334 1.00 1.24 H ATOM 73 HG22 THR A 7 13.794 -4.881 -7.586 1.00 1.17 H ATOM 74 HG23 THR A 7 15.501 -4.873 -8.038 1.00 1.27 H ATOM 75 N ASP A 8 12.421 -1.394 -6.954 1.00 0.49 N ATOM 76 CA ASP A 8 12.005 -0.186 -7.651 1.00 0.48 C ATOM 77 C ASP A 8 11.315 0.719 -6.668 1.00 0.40 C ATOM 78 O ASP A 8 11.392 1.939 -6.746 1.00 0.40 O ATOM 79 CB ASP A 8 11.003 -0.488 -8.752 1.00 0.54 C ATOM 80 CG ASP A 8 11.514 -0.146 -10.140 1.00 0.64 C ATOM 81 OD1 ASP A 8 12.335 -0.908 -10.689 1.00 0.75 O ATOM 82 OD2 ASP A 8 11.092 0.897 -10.689 1.00 0.73 O ATOM 83 H ASP A 8 11.718 -2.036 -6.726 1.00 0.50 H ATOM 84 HA ASP A 8 12.868 0.301 -8.057 1.00 0.51 H ATOM 85 HB2 ASP A 8 10.739 -1.531 -8.715 1.00 0.57 H ATOM 86 HB3 ASP A 8 10.119 0.109 -8.560 1.00 0.56 H ATOM 87 N LEU A 9 10.616 0.095 -5.747 1.00 0.36 N ATOM 88 CA LEU A 9 9.913 0.813 -4.721 1.00 0.30 C ATOM 89 C LEU A 9 10.902 1.459 -3.793 1.00 0.28 C ATOM 90 O LEU A 9 10.894 2.668 -3.578 1.00 0.26 O ATOM 91 CB LEU A 9 9.058 -0.121 -3.902 1.00 0.29 C ATOM 92 CG LEU A 9 8.511 0.538 -2.648 1.00 0.25 C ATOM 93 CD1 LEU A 9 7.462 1.578 -3.010 1.00 0.24 C ATOM 94 CD2 LEU A 9 7.994 -0.510 -1.686 1.00 0.26 C ATOM 95 H LEU A 9 10.591 -0.886 -5.749 1.00 0.38 H ATOM 96 HA LEU A 9 9.297 1.561 -5.190 1.00 0.30 H ATOM 97 HB2 LEU A 9 8.248 -0.468 -4.518 1.00 0.30 H ATOM 98 HB3 LEU A 9 9.652 -0.970 -3.605 1.00 0.31 H ATOM 99 HG LEU A 9 9.322 1.060 -2.159 1.00 0.26 H ATOM 100 HD11 LEU A 9 7.912 2.325 -3.666 1.00 1.04 H ATOM 101 HD12 LEU A 9 7.106 2.058 -2.112 1.00 1.06 H ATOM 102 HD13 LEU A 9 6.637 1.099 -3.517 1.00 1.05 H ATOM 103 HD21 LEU A 9 7.133 -0.995 -2.107 1.00 1.04 H ATOM 104 HD22 LEU A 9 7.731 -0.043 -0.751 1.00 1.07 H ATOM 105 HD23 LEU A 9 8.771 -1.242 -1.516 1.00 1.02 H ATOM 106 N ALA A 10 11.755 0.610 -3.249 1.00 0.31 N ATOM 107 CA ALA A 10 12.865 1.054 -2.418 1.00 0.32 C ATOM 108 C ALA A 10 13.766 2.004 -3.194 1.00 0.35 C ATOM 109 O ALA A 10 14.634 2.633 -2.622 1.00 0.39 O ATOM 110 CB ALA A 10 13.658 -0.139 -1.909 1.00 0.42 C ATOM 111 H ALA A 10 11.612 -0.356 -3.407 1.00 0.33 H ATOM 112 HA ALA A 10 12.461 1.586 -1.563 1.00 0.29 H ATOM 113 HB1 ALA A 10 13.005 -0.797 -1.355 1.00 1.10 H ATOM 114 HB2 ALA A 10 14.453 0.206 -1.266 1.00 1.12 H ATOM 115 HB3 ALA A 10 14.079 -0.674 -2.748 1.00 1.07 H ATOM 116 N ALA A 11 13.515 2.140 -4.491 1.00 0.36 N ATOM 117 CA ALA A 11 14.258 3.063 -5.317 1.00 0.41 C ATOM 118 C ALA A 11 13.713 4.467 -5.125 1.00 0.39 C ATOM 119 O ALA A 11 14.471 5.434 -5.104 1.00 0.44 O ATOM 120 CB ALA A 11 14.179 2.653 -6.770 1.00 0.51 C ATOM 121 H ALA A 11 12.764 1.657 -4.886 1.00 0.35 H ATOM 122 HA ALA A 11 15.291 3.038 -5.010 1.00 0.42 H ATOM 123 HB1 ALA A 11 13.135 2.581 -7.059 1.00 1.03 H ATOM 124 HB2 ALA A 11 14.656 1.694 -6.897 1.00 1.26 H ATOM 125 HB3 ALA A 11 14.673 3.390 -7.381 1.00 1.10 H ATOM 126 N ARG A 12 12.387 4.582 -4.981 1.00 0.36 N ATOM 127 CA ARG A 12 11.767 5.851 -4.624 1.00 0.41 C ATOM 128 C ARG A 12 12.180 6.250 -3.215 1.00 0.34 C ATOM 129 O ARG A 12 12.338 7.428 -2.899 1.00 0.38 O ATOM 130 CB ARG A 12 10.243 5.719 -4.651 1.00 0.54 C ATOM 131 CG ARG A 12 9.597 5.759 -6.015 1.00 0.68 C ATOM 132 CD ARG A 12 9.744 4.439 -6.727 1.00 0.64 C ATOM 133 NE ARG A 12 8.739 4.265 -7.781 1.00 1.29 N ATOM 134 CZ ARG A 12 8.900 3.478 -8.847 1.00 1.49 C ATOM 135 NH1 ARG A 12 10.028 2.800 -9.009 1.00 1.30 N ATOM 136 NH2 ARG A 12 7.932 3.372 -9.753 1.00 2.35 N ATOM 137 H ARG A 12 11.785 3.810 -5.127 1.00 0.34 H ATOM 138 HA ARG A 12 12.080 6.603 -5.328 1.00 0.52 H ATOM 139 HB2 ARG A 12 9.994 4.770 -4.218 1.00 1.07 H ATOM 140 HB3 ARG A 12 9.812 6.499 -4.048 1.00 1.19 H ATOM 141 HG2 ARG A 12 8.546 5.976 -5.898 1.00 1.24 H ATOM 142 HG3 ARG A 12 10.069 6.527 -6.597 1.00 1.09 H ATOM 143 HD2 ARG A 12 10.728 4.388 -7.166 1.00 1.06 H ATOM 144 HD3 ARG A 12 9.635 3.653 -5.996 1.00 0.99 H ATOM 145 HE ARG A 12 7.896 4.764 -7.681 1.00 1.91 H ATOM 146 HH11 ARG A 12 10.763 2.879 -8.329 1.00 1.32 H ATOM 147 HH12 ARG A 12 10.154 2.201 -9.811 1.00 1.63 H ATOM 148 HH21 ARG A 12 7.074 3.883 -9.641 1.00 2.93 H ATOM 149 HH22 ARG A 12 8.054 2.781 -10.554 1.00 2.53 H ATOM 150 N LEU A 13 12.360 5.235 -2.385 1.00 0.29 N ATOM 151 CA LEU A 13 12.565 5.420 -0.957 1.00 0.28 C ATOM 152 C LEU A 13 14.008 5.737 -0.665 1.00 0.31 C ATOM 153 O LEU A 13 14.323 6.615 0.129 1.00 0.33 O ATOM 154 CB LEU A 13 12.153 4.157 -0.208 1.00 0.27 C ATOM 155 CG LEU A 13 10.657 4.033 0.115 1.00 0.27 C ATOM 156 CD1 LEU A 13 9.796 4.318 -1.091 1.00 0.74 C ATOM 157 CD2 LEU A 13 10.340 2.666 0.682 1.00 0.70 C ATOM 158 H LEU A 13 12.376 4.326 -2.755 1.00 0.29 H ATOM 159 HA LEU A 13 11.954 6.237 -0.634 1.00 0.30 H ATOM 160 HB2 LEU A 13 12.450 3.313 -0.808 1.00 0.29 H ATOM 161 HB3 LEU A 13 12.701 4.124 0.722 1.00 0.31 H ATOM 162 HG LEU A 13 10.400 4.758 0.856 1.00 0.78 H ATOM 163 HD11 LEU A 13 8.829 3.856 -0.956 1.00 1.40 H ATOM 164 HD12 LEU A 13 10.277 3.928 -1.980 1.00 1.35 H ATOM 165 HD13 LEU A 13 9.671 5.389 -1.184 1.00 1.33 H ATOM 166 HD21 LEU A 13 10.925 2.502 1.574 1.00 1.35 H ATOM 167 HD22 LEU A 13 10.578 1.909 -0.051 1.00 1.33 H ATOM 168 HD23 LEU A 13 9.289 2.613 0.925 1.00 1.33 H ATOM 169 N ASN A 14 14.868 4.983 -1.296 1.00 0.35 N ATOM 170 CA ASN A 14 16.301 5.211 -1.241 1.00 0.41 C ATOM 171 C ASN A 14 16.630 6.643 -1.628 1.00 0.43 C ATOM 172 O ASN A 14 16.287 7.102 -2.720 1.00 0.84 O ATOM 173 CB ASN A 14 16.987 4.226 -2.175 1.00 0.52 C ATOM 174 CG ASN A 14 17.403 2.944 -1.477 1.00 0.81 C ATOM 175 OD1 ASN A 14 17.723 2.938 -0.285 1.00 1.39 O ATOM 176 ND2 ASN A 14 17.390 1.844 -2.214 1.00 0.65 N ATOM 177 H ASN A 14 14.535 4.220 -1.819 1.00 0.35 H ATOM 178 HA ASN A 14 16.634 5.036 -0.230 1.00 0.46 H ATOM 179 HB2 ASN A 14 16.274 3.959 -2.951 1.00 0.39 H ATOM 180 HB3 ASN A 14 17.857 4.687 -2.619 1.00 0.78 H ATOM 181 HD21 ASN A 14 17.121 1.922 -3.155 1.00 0.61 H ATOM 182 HD22 ASN A 14 17.635 0.996 -1.789 1.00 0.90 H ATOM 183 N GLY A 15 17.285 7.346 -0.722 1.00 0.48 N ATOM 184 CA GLY A 15 17.541 8.754 -0.914 1.00 0.49 C ATOM 185 C GLY A 15 16.663 9.601 -0.024 1.00 0.46 C ATOM 186 O GLY A 15 16.918 10.787 0.180 1.00 0.56 O ATOM 187 H GLY A 15 17.612 6.897 0.090 1.00 0.80 H ATOM 188 HA2 GLY A 15 18.575 8.955 -0.686 1.00 0.54 H ATOM 189 HA3 GLY A 15 17.347 9.013 -1.944 1.00 0.50 H ATOM 190 N LEU A 16 15.625 8.981 0.510 1.00 0.38 N ATOM 191 CA LEU A 16 14.685 9.663 1.377 1.00 0.35 C ATOM 192 C LEU A 16 14.878 9.261 2.826 1.00 0.35 C ATOM 193 O LEU A 16 15.594 8.311 3.141 1.00 0.37 O ATOM 194 CB LEU A 16 13.248 9.347 0.959 1.00 0.32 C ATOM 195 CG LEU A 16 12.754 10.072 -0.280 1.00 0.35 C ATOM 196 CD1 LEU A 16 11.358 9.600 -0.661 1.00 0.94 C ATOM 197 CD2 LEU A 16 12.764 11.557 -0.015 1.00 0.82 C ATOM 198 H LEU A 16 15.486 8.027 0.316 1.00 0.37 H ATOM 199 HA LEU A 16 14.852 10.724 1.281 1.00 0.37 H ATOM 200 HB2 LEU A 16 13.170 8.292 0.780 1.00 0.32 H ATOM 201 HB3 LEU A 16 12.595 9.602 1.779 1.00 0.30 H ATOM 202 HG LEU A 16 13.420 9.870 -1.107 1.00 0.68 H ATOM 203 HD11 LEU A 16 11.011 10.157 -1.517 1.00 1.56 H ATOM 204 HD12 LEU A 16 10.686 9.757 0.169 1.00 1.48 H ATOM 205 HD13 LEU A 16 11.389 8.548 -0.905 1.00 1.45 H ATOM 206 HD21 LEU A 16 12.218 12.069 -0.789 1.00 1.36 H ATOM 207 HD22 LEU A 16 13.785 11.906 0.002 1.00 1.32 H ATOM 208 HD23 LEU A 16 12.300 11.749 0.951 1.00 1.49 H ATOM 209 N SER A 17 14.249 10.021 3.698 1.00 0.35 N ATOM 210 CA SER A 17 14.144 9.680 5.098 1.00 0.37 C ATOM 211 C SER A 17 12.938 8.778 5.315 1.00 0.33 C ATOM 212 O SER A 17 11.960 8.878 4.582 1.00 0.31 O ATOM 213 CB SER A 17 14.004 10.958 5.913 1.00 0.39 C ATOM 214 OG SER A 17 15.159 11.773 5.783 1.00 1.08 O ATOM 215 H SER A 17 13.854 10.861 3.387 1.00 0.34 H ATOM 216 HA SER A 17 15.037 9.155 5.404 1.00 0.40 H ATOM 217 HB2 SER A 17 13.151 11.510 5.558 1.00 0.76 H ATOM 218 HB3 SER A 17 13.864 10.709 6.947 1.00 0.85 H ATOM 219 HG SER A 17 15.712 11.434 5.061 1.00 1.50 H ATOM 220 N PRO A 18 13.032 7.863 6.291 1.00 0.36 N ATOM 221 CA PRO A 18 11.965 6.957 6.709 1.00 0.35 C ATOM 222 C PRO A 18 10.538 7.459 6.437 1.00 0.31 C ATOM 223 O PRO A 18 9.771 6.797 5.738 1.00 0.29 O ATOM 224 CB PRO A 18 12.227 6.860 8.204 1.00 0.39 C ATOM 225 CG PRO A 18 13.714 6.980 8.339 1.00 0.42 C ATOM 226 CD PRO A 18 14.243 7.598 7.071 1.00 0.45 C ATOM 227 HA PRO A 18 12.091 5.983 6.274 1.00 0.34 H ATOM 228 HB2 PRO A 18 11.717 7.665 8.712 1.00 0.40 H ATOM 229 HB3 PRO A 18 11.873 5.912 8.575 1.00 0.40 H ATOM 230 HG2 PRO A 18 13.943 7.616 9.163 1.00 0.49 H ATOM 231 HG3 PRO A 18 14.148 6.002 8.487 1.00 0.47 H ATOM 232 HD2 PRO A 18 14.766 8.516 7.292 1.00 0.55 H ATOM 233 HD3 PRO A 18 14.892 6.906 6.555 1.00 0.54 H ATOM 234 N GLN A 19 10.194 8.625 6.974 1.00 0.32 N ATOM 235 CA GLN A 19 8.845 9.179 6.825 1.00 0.32 C ATOM 236 C GLN A 19 8.547 9.532 5.371 1.00 0.29 C ATOM 237 O GLN A 19 7.434 9.328 4.899 1.00 0.28 O ATOM 238 CB GLN A 19 8.683 10.417 7.700 1.00 0.36 C ATOM 239 CG GLN A 19 7.256 10.920 7.758 1.00 0.71 C ATOM 240 CD GLN A 19 6.349 10.055 8.615 1.00 1.28 C ATOM 241 OE1 GLN A 19 5.152 9.952 8.353 1.00 2.00 O ATOM 242 NE2 GLN A 19 6.902 9.432 9.646 1.00 2.04 N ATOM 243 H GLN A 19 10.867 9.130 7.483 1.00 0.35 H ATOM 244 HA GLN A 19 8.129 8.430 7.142 1.00 0.34 H ATOM 245 HB2 GLN A 19 9.007 10.184 8.703 1.00 0.63 H ATOM 246 HB3 GLN A 19 9.304 11.203 7.303 1.00 0.56 H ATOM 247 HG2 GLN A 19 7.252 11.925 8.150 1.00 1.29 H ATOM 248 HG3 GLN A 19 6.869 10.922 6.752 1.00 1.30 H ATOM 249 HE21 GLN A 19 7.862 9.559 9.807 1.00 2.37 H ATOM 250 HE22 GLN A 19 6.327 8.873 10.211 1.00 2.62 H ATOM 251 N GLN A 20 9.549 10.023 4.653 1.00 0.28 N ATOM 252 CA GLN A 20 9.378 10.364 3.243 1.00 0.27 C ATOM 253 C GLN A 20 9.224 9.097 2.431 1.00 0.24 C ATOM 254 O GLN A 20 8.418 9.017 1.502 1.00 0.23 O ATOM 255 CB GLN A 20 10.564 11.154 2.715 1.00 0.30 C ATOM 256 CG GLN A 20 10.584 12.587 3.200 1.00 0.37 C ATOM 257 CD GLN A 20 11.535 13.469 2.420 1.00 0.95 C ATOM 258 OE1 GLN A 20 11.159 14.065 1.412 1.00 1.78 O ATOM 259 NE2 GLN A 20 12.763 13.576 2.890 1.00 1.68 N ATOM 260 H GLN A 20 10.438 10.098 5.059 1.00 0.30 H ATOM 261 HA GLN A 20 8.484 10.961 3.150 1.00 0.28 H ATOM 262 HB2 GLN A 20 11.474 10.663 3.043 1.00 0.30 H ATOM 263 HB3 GLN A 20 10.533 11.156 1.636 1.00 0.31 H ATOM 264 HG2 GLN A 20 9.589 12.998 3.121 1.00 0.89 H ATOM 265 HG3 GLN A 20 10.888 12.583 4.224 1.00 0.94 H ATOM 266 HE21 GLN A 20 12.991 13.091 3.710 1.00 2.08 H ATOM 267 HE22 GLN A 20 13.401 14.137 2.397 1.00 2.22 H ATOM 268 N GLN A 21 10.020 8.110 2.802 1.00 0.24 N ATOM 269 CA GLN A 21 9.921 6.781 2.242 1.00 0.22 C ATOM 270 C GLN A 21 8.522 6.237 2.464 1.00 0.21 C ATOM 271 O GLN A 21 7.941 5.578 1.602 1.00 0.25 O ATOM 272 CB GLN A 21 10.945 5.871 2.918 1.00 0.25 C ATOM 273 CG GLN A 21 12.380 6.219 2.580 1.00 0.28 C ATOM 274 CD GLN A 21 13.381 5.314 3.272 1.00 0.35 C ATOM 275 OE1 GLN A 21 14.496 5.723 3.584 1.00 1.22 O ATOM 276 NE2 GLN A 21 12.995 4.070 3.509 1.00 1.06 N ATOM 277 H GLN A 21 10.709 8.290 3.481 1.00 0.25 H ATOM 278 HA GLN A 21 10.125 6.841 1.183 1.00 0.22 H ATOM 279 HB2 GLN A 21 10.825 5.950 3.989 1.00 0.28 H ATOM 280 HB3 GLN A 21 10.763 4.850 2.623 1.00 0.25 H ATOM 281 HG2 GLN A 21 12.510 6.119 1.514 1.00 0.28 H ATOM 282 HG3 GLN A 21 12.572 7.247 2.869 1.00 0.30 H ATOM 283 HE21 GLN A 21 12.094 3.799 3.234 1.00 1.83 H ATOM 284 HE22 GLN A 21 13.631 3.462 3.945 1.00 1.07 H ATOM 285 N GLN A 22 7.992 6.537 3.637 1.00 0.21 N ATOM 286 CA GLN A 22 6.654 6.134 4.001 1.00 0.21 C ATOM 287 C GLN A 22 5.639 6.856 3.132 1.00 0.18 C ATOM 288 O GLN A 22 4.710 6.244 2.641 1.00 0.17 O ATOM 289 CB GLN A 22 6.414 6.420 5.483 1.00 0.27 C ATOM 290 CG GLN A 22 5.522 5.412 6.151 1.00 0.46 C ATOM 291 CD GLN A 22 5.021 5.838 7.518 1.00 0.92 C ATOM 292 OE1 GLN A 22 4.793 5.001 8.394 1.00 1.56 O ATOM 293 NE2 GLN A 22 4.827 7.130 7.709 1.00 1.60 N ATOM 294 H GLN A 22 8.528 7.049 4.282 1.00 0.24 H ATOM 295 HA GLN A 22 6.560 5.079 3.829 1.00 0.22 H ATOM 296 HB2 GLN A 22 7.361 6.404 5.995 1.00 0.45 H ATOM 297 HB3 GLN A 22 5.977 7.383 5.585 1.00 0.37 H ATOM 298 HG2 GLN A 22 4.678 5.206 5.515 1.00 0.58 H ATOM 299 HG3 GLN A 22 6.107 4.528 6.274 1.00 0.62 H ATOM 300 HE21 GLN A 22 5.010 7.744 6.967 1.00 2.14 H ATOM 301 HE22 GLN A 22 4.515 7.427 8.592 1.00 1.88 H ATOM 302 N GLN A 23 5.859 8.151 2.919 1.00 0.19 N ATOM 303 CA GLN A 23 4.991 8.984 2.084 1.00 0.18 C ATOM 304 C GLN A 23 4.807 8.433 0.682 1.00 0.15 C ATOM 305 O GLN A 23 3.720 8.508 0.128 1.00 0.15 O ATOM 306 CB GLN A 23 5.573 10.365 1.975 1.00 0.20 C ATOM 307 CG GLN A 23 5.630 11.081 3.305 1.00 0.24 C ATOM 308 CD GLN A 23 6.410 12.377 3.250 1.00 0.30 C ATOM 309 OE1 GLN A 23 7.316 12.541 2.433 1.00 1.05 O ATOM 310 NE2 GLN A 23 6.079 13.301 4.133 1.00 1.24 N ATOM 311 H GLN A 23 6.628 8.575 3.360 1.00 0.22 H ATOM 312 HA GLN A 23 4.038 9.055 2.563 1.00 0.19 H ATOM 313 HB2 GLN A 23 6.567 10.264 1.584 1.00 0.20 H ATOM 314 HB3 GLN A 23 4.976 10.949 1.291 1.00 0.22 H ATOM 315 HG2 GLN A 23 4.623 11.299 3.615 1.00 0.27 H ATOM 316 HG3 GLN A 23 6.082 10.424 4.027 1.00 0.25 H ATOM 317 HE21 GLN A 23 5.356 13.099 4.767 1.00 2.00 H ATOM 318 HE22 GLN A 23 6.567 14.150 4.123 1.00 1.29 H ATOM 319 N THR A 24 5.878 7.920 0.100 1.00 0.15 N ATOM 320 CA THR A 24 5.810 7.322 -1.222 1.00 0.14 C ATOM 321 C THR A 24 4.792 6.188 -1.247 1.00 0.12 C ATOM 322 O THR A 24 3.969 6.104 -2.153 1.00 0.12 O ATOM 323 CB THR A 24 7.194 6.815 -1.635 1.00 0.16 C ATOM 324 OG1 THR A 24 8.019 7.919 -2.033 1.00 0.19 O ATOM 325 CG2 THR A 24 7.096 5.791 -2.759 1.00 0.17 C ATOM 326 H THR A 24 6.740 7.944 0.572 1.00 0.18 H ATOM 327 HA THR A 24 5.494 8.084 -1.928 1.00 0.14 H ATOM 328 HB THR A 24 7.642 6.350 -0.770 1.00 0.18 H ATOM 329 HG1 THR A 24 7.762 8.702 -1.534 1.00 0.62 H ATOM 330 HG21 THR A 24 8.072 5.369 -2.947 1.00 1.00 H ATOM 331 HG22 THR A 24 6.732 6.272 -3.655 1.00 1.00 H ATOM 332 HG23 THR A 24 6.410 5.004 -2.470 1.00 1.01 H ATOM 333 N LEU A 25 4.812 5.354 -0.222 1.00 0.12 N ATOM 334 CA LEU A 25 3.816 4.301 -0.095 1.00 0.11 C ATOM 335 C LEU A 25 2.504 4.929 0.313 1.00 0.11 C ATOM 336 O LEU A 25 1.451 4.606 -0.202 1.00 0.10 O ATOM 337 CB LEU A 25 4.225 3.313 0.971 1.00 0.12 C ATOM 338 CG LEU A 25 5.527 2.575 0.732 1.00 0.14 C ATOM 339 CD1 LEU A 25 6.136 2.195 2.066 1.00 0.32 C ATOM 340 CD2 LEU A 25 5.277 1.344 -0.118 1.00 0.39 C ATOM 341 H LEU A 25 5.471 5.487 0.500 1.00 0.13 H ATOM 342 HA LEU A 25 3.702 3.797 -1.045 1.00 0.11 H ATOM 343 HB2 LEU A 25 4.314 3.853 1.894 1.00 0.15 H ATOM 344 HB3 LEU A 25 3.437 2.583 1.073 1.00 0.15 H ATOM 345 HG LEU A 25 6.219 3.220 0.209 1.00 0.23 H ATOM 346 HD11 LEU A 25 5.521 1.445 2.545 1.00 1.04 H ATOM 347 HD12 LEU A 25 6.180 3.075 2.696 1.00 1.10 H ATOM 348 HD13 LEU A 25 7.131 1.806 1.915 1.00 1.10 H ATOM 349 HD21 LEU A 25 6.193 0.789 -0.221 1.00 1.15 H ATOM 350 HD22 LEU A 25 4.927 1.645 -1.095 1.00 1.10 H ATOM 351 HD23 LEU A 25 4.530 0.724 0.357 1.00 1.10 H ATOM 352 N ALA A 26 2.603 5.871 1.224 1.00 0.12 N ATOM 353 CA ALA A 26 1.459 6.600 1.746 1.00 0.13 C ATOM 354 C ALA A 26 0.829 7.496 0.679 1.00 0.13 C ATOM 355 O ALA A 26 -0.078 8.283 0.950 1.00 0.16 O ATOM 356 CB ALA A 26 1.917 7.408 2.952 1.00 0.16 C ATOM 357 H ALA A 26 3.495 6.075 1.589 1.00 0.14 H ATOM 358 HA ALA A 26 0.726 5.878 2.065 1.00 0.14 H ATOM 359 HB1 ALA A 26 1.072 7.653 3.574 1.00 1.07 H ATOM 360 HB2 ALA A 26 2.396 8.318 2.613 1.00 0.98 H ATOM 361 HB3 ALA A 26 2.637 6.823 3.519 1.00 1.02 H ATOM 362 N THR A 27 1.327 7.345 -0.528 1.00 0.12 N ATOM 363 CA THR A 27 0.825 8.021 -1.691 1.00 0.12 C ATOM 364 C THR A 27 0.436 6.978 -2.728 1.00 0.11 C ATOM 365 O THR A 27 -0.659 6.996 -3.275 1.00 0.11 O ATOM 366 CB THR A 27 1.914 8.950 -2.262 1.00 0.15 C ATOM 367 OG1 THR A 27 2.021 10.135 -1.466 1.00 0.20 O ATOM 368 CG2 THR A 27 1.651 9.298 -3.714 1.00 0.15 C ATOM 369 H THR A 27 2.073 6.728 -0.649 1.00 0.11 H ATOM 370 HA THR A 27 -0.037 8.603 -1.408 1.00 0.14 H ATOM 371 HB THR A 27 2.856 8.422 -2.210 1.00 0.16 H ATOM 372 HG1 THR A 27 2.548 9.937 -0.680 1.00 0.61 H ATOM 373 HG21 THR A 27 0.723 9.843 -3.795 1.00 0.99 H ATOM 374 HG22 THR A 27 1.588 8.380 -4.289 1.00 1.02 H ATOM 375 HG23 THR A 27 2.463 9.902 -4.088 1.00 0.99 H ATOM 376 N LEU A 28 1.352 6.051 -2.945 1.00 0.09 N ATOM 377 CA LEU A 28 1.195 4.975 -3.891 1.00 0.09 C ATOM 378 C LEU A 28 0.147 3.977 -3.448 1.00 0.08 C ATOM 379 O LEU A 28 -0.655 3.509 -4.239 1.00 0.08 O ATOM 380 CB LEU A 28 2.514 4.255 -4.045 1.00 0.10 C ATOM 381 CG LEU A 28 2.361 2.810 -4.469 1.00 0.11 C ATOM 382 CD1 LEU A 28 2.459 2.669 -5.975 1.00 0.42 C ATOM 383 CD2 LEU A 28 3.354 1.938 -3.731 1.00 0.49 C ATOM 384 H LEU A 28 2.180 6.099 -2.444 1.00 0.10 H ATOM 385 HA LEU A 28 0.912 5.394 -4.825 1.00 0.10 H ATOM 386 HB2 LEU A 28 3.111 4.782 -4.776 1.00 0.12 H ATOM 387 HB3 LEU A 28 3.023 4.279 -3.102 1.00 0.10 H ATOM 388 HG LEU A 28 1.376 2.487 -4.176 1.00 0.41 H ATOM 389 HD11 LEU A 28 3.484 2.794 -6.283 1.00 1.17 H ATOM 390 HD12 LEU A 28 1.847 3.427 -6.442 1.00 1.10 H ATOM 391 HD13 LEU A 28 2.101 1.687 -6.271 1.00 1.13 H ATOM 392 HD21 LEU A 28 3.082 1.911 -2.680 1.00 1.15 H ATOM 393 HD22 LEU A 28 4.347 2.350 -3.838 1.00 1.17 H ATOM 394 HD23 LEU A 28 3.327 0.939 -4.136 1.00 1.17 H ATOM 395 N VAL A 29 0.190 3.635 -2.184 1.00 0.08 N ATOM 396 CA VAL A 29 -0.747 2.689 -1.612 1.00 0.09 C ATOM 397 C VAL A 29 -2.142 3.273 -1.657 1.00 0.08 C ATOM 398 O VAL A 29 -3.143 2.576 -1.844 1.00 0.09 O ATOM 399 CB VAL A 29 -0.368 2.348 -0.161 1.00 0.10 C ATOM 400 CG1 VAL A 29 -1.499 1.614 0.540 1.00 0.11 C ATOM 401 CG2 VAL A 29 0.905 1.522 -0.148 1.00 0.10 C ATOM 402 H VAL A 29 0.870 4.048 -1.605 1.00 0.08 H ATOM 403 HA VAL A 29 -0.714 1.791 -2.201 1.00 0.09 H ATOM 404 HB VAL A 29 -0.177 3.275 0.367 1.00 0.10 H ATOM 405 HG11 VAL A 29 -1.651 0.654 0.072 1.00 1.02 H ATOM 406 HG12 VAL A 29 -2.406 2.201 0.461 1.00 0.99 H ATOM 407 HG13 VAL A 29 -1.249 1.475 1.581 1.00 1.04 H ATOM 408 HG21 VAL A 29 0.710 0.555 -0.582 1.00 0.92 H ATOM 409 HG22 VAL A 29 1.247 1.403 0.869 1.00 0.94 H ATOM 410 HG23 VAL A 29 1.664 2.030 -0.730 1.00 0.94 H ATOM 411 N ALA A 30 -2.188 4.572 -1.506 1.00 0.08 N ATOM 412 CA ALA A 30 -3.419 5.303 -1.620 1.00 0.08 C ATOM 413 C ALA A 30 -3.803 5.445 -3.071 1.00 0.09 C ATOM 414 O ALA A 30 -4.967 5.472 -3.411 1.00 0.10 O ATOM 415 CB ALA A 30 -3.261 6.653 -0.992 1.00 0.08 C ATOM 416 H ALA A 30 -1.361 5.062 -1.315 1.00 0.09 H ATOM 417 HA ALA A 30 -4.187 4.763 -1.098 1.00 0.09 H ATOM 418 HB1 ALA A 30 -2.950 6.531 0.033 1.00 1.01 H ATOM 419 HB2 ALA A 30 -4.201 7.173 -1.035 1.00 1.00 H ATOM 420 HB3 ALA A 30 -2.512 7.206 -1.536 1.00 1.00 H ATOM 421 N ALA A 31 -2.795 5.549 -3.908 1.00 0.08 N ATOM 422 CA ALA A 31 -2.969 5.578 -5.345 1.00 0.09 C ATOM 423 C ALA A 31 -3.546 4.248 -5.794 1.00 0.09 C ATOM 424 O ALA A 31 -4.410 4.173 -6.668 1.00 0.11 O ATOM 425 CB ALA A 31 -1.623 5.849 -5.997 1.00 0.10 C ATOM 426 H ALA A 31 -1.893 5.623 -3.542 1.00 0.08 H ATOM 427 HA ALA A 31 -3.651 6.377 -5.598 1.00 0.09 H ATOM 428 HB1 ALA A 31 -1.322 6.864 -5.785 1.00 1.03 H ATOM 429 HB2 ALA A 31 -1.695 5.703 -7.062 1.00 1.00 H ATOM 430 HB3 ALA A 31 -0.886 5.171 -5.582 1.00 0.99 H ATOM 431 N ALA A 32 -3.041 3.205 -5.168 1.00 0.09 N ATOM 432 CA ALA A 32 -3.566 1.863 -5.306 1.00 0.10 C ATOM 433 C ALA A 32 -5.038 1.810 -4.913 1.00 0.09 C ATOM 434 O ALA A 32 -5.865 1.273 -5.651 1.00 0.10 O ATOM 435 CB ALA A 32 -2.748 0.937 -4.432 1.00 0.12 C ATOM 436 H ALA A 32 -2.238 3.334 -4.612 1.00 0.09 H ATOM 437 HA ALA A 32 -3.454 1.555 -6.334 1.00 0.12 H ATOM 438 HB1 ALA A 32 -1.794 0.748 -4.900 1.00 1.02 H ATOM 439 HB2 ALA A 32 -3.277 0.008 -4.289 1.00 1.03 H ATOM 440 HB3 ALA A 32 -2.583 1.417 -3.473 1.00 1.02 H ATOM 441 N THR A 33 -5.374 2.380 -3.761 1.00 0.08 N ATOM 442 CA THR A 33 -6.758 2.383 -3.314 1.00 0.07 C ATOM 443 C THR A 33 -7.569 3.423 -4.095 1.00 0.08 C ATOM 444 O THR A 33 -8.794 3.369 -4.168 1.00 0.10 O ATOM 445 CB THR A 33 -6.853 2.668 -1.807 1.00 0.08 C ATOM 446 OG1 THR A 33 -5.875 1.893 -1.100 1.00 0.09 O ATOM 447 CG2 THR A 33 -8.242 2.333 -1.284 1.00 0.09 C ATOM 448 H THR A 33 -4.679 2.803 -3.197 1.00 0.08 H ATOM 449 HA THR A 33 -7.177 1.394 -3.507 1.00 0.08 H ATOM 450 HB THR A 33 -6.664 3.716 -1.641 1.00 0.09 H ATOM 451 HG1 THR A 33 -4.999 2.061 -1.466 1.00 0.09 H ATOM 452 HG21 THR A 33 -8.232 2.338 -0.206 1.00 0.99 H ATOM 453 HG22 THR A 33 -8.536 1.354 -1.642 1.00 1.01 H ATOM 454 HG23 THR A 33 -8.946 3.068 -1.643 1.00 0.98 H ATOM 455 N ALA A 34 -6.877 4.370 -4.692 1.00 0.08 N ATOM 456 CA ALA A 34 -7.517 5.333 -5.557 1.00 0.09 C ATOM 457 C ALA A 34 -7.973 4.643 -6.831 1.00 0.11 C ATOM 458 O ALA A 34 -8.954 5.040 -7.455 1.00 0.20 O ATOM 459 CB ALA A 34 -6.576 6.490 -5.852 1.00 0.10 C ATOM 460 H ALA A 34 -5.912 4.441 -4.523 1.00 0.09 H ATOM 461 HA ALA A 34 -8.380 5.721 -5.038 1.00 0.09 H ATOM 462 HB1 ALA A 34 -5.736 6.137 -6.433 1.00 1.02 H ATOM 463 HB2 ALA A 34 -6.217 6.905 -4.918 1.00 1.03 H ATOM 464 HB3 ALA A 34 -7.105 7.253 -6.405 1.00 1.00 H ATOM 465 N THR A 35 -7.267 3.585 -7.188 1.00 0.11 N ATOM 466 CA THR A 35 -7.633 2.759 -8.303 1.00 0.12 C ATOM 467 C THR A 35 -8.853 1.905 -7.958 1.00 0.11 C ATOM 468 O THR A 35 -9.848 1.912 -8.683 1.00 0.14 O ATOM 469 CB THR A 35 -6.449 1.853 -8.692 1.00 0.16 C ATOM 470 OG1 THR A 35 -5.628 2.493 -9.679 1.00 0.22 O ATOM 471 CG2 THR A 35 -6.939 0.511 -9.189 1.00 0.17 C ATOM 472 H THR A 35 -6.471 3.342 -6.671 1.00 0.14 H ATOM 473 HA THR A 35 -7.868 3.398 -9.140 1.00 0.14 H ATOM 474 HB THR A 35 -5.850 1.688 -7.807 1.00 0.16 H ATOM 475 HG1 THR A 35 -6.025 3.339 -9.932 1.00 0.81 H ATOM 476 HG21 THR A 35 -6.102 -0.155 -9.322 1.00 1.03 H ATOM 477 HG22 THR A 35 -7.458 0.641 -10.124 1.00 0.99 H ATOM 478 HG23 THR A 35 -7.619 0.101 -8.448 1.00 1.04 H ATOM 479 N VAL A 36 -8.776 1.204 -6.826 1.00 0.10 N ATOM 480 CA VAL A 36 -9.798 0.234 -6.445 1.00 0.11 C ATOM 481 C VAL A 36 -11.186 0.861 -6.361 1.00 0.13 C ATOM 482 O VAL A 36 -12.190 0.200 -6.622 1.00 0.17 O ATOM 483 CB VAL A 36 -9.472 -0.451 -5.099 1.00 0.09 C ATOM 484 CG1 VAL A 36 -8.259 -1.345 -5.201 1.00 0.18 C ATOM 485 CG2 VAL A 36 -9.293 0.552 -3.998 1.00 0.16 C ATOM 486 H VAL A 36 -8.003 1.337 -6.235 1.00 0.09 H ATOM 487 HA VAL A 36 -9.815 -0.530 -7.205 1.00 0.13 H ATOM 488 HB VAL A 36 -10.298 -1.061 -4.832 1.00 0.13 H ATOM 489 HG11 VAL A 36 -7.968 -1.665 -4.210 1.00 0.98 H ATOM 490 HG12 VAL A 36 -7.446 -0.807 -5.664 1.00 1.04 H ATOM 491 HG13 VAL A 36 -8.507 -2.213 -5.794 1.00 0.99 H ATOM 492 HG21 VAL A 36 -8.816 1.436 -4.392 1.00 1.06 H ATOM 493 HG22 VAL A 36 -8.677 0.123 -3.224 1.00 1.03 H ATOM 494 HG23 VAL A 36 -10.258 0.812 -3.589 1.00 1.01 H ATOM 495 N LEU A 37 -11.245 2.135 -6.010 1.00 0.12 N ATOM 496 CA LEU A 37 -12.525 2.804 -5.817 1.00 0.16 C ATOM 497 C LEU A 37 -12.910 3.669 -7.013 1.00 0.25 C ATOM 498 O LEU A 37 -13.960 4.310 -7.009 1.00 0.65 O ATOM 499 CB LEU A 37 -12.450 3.683 -4.580 1.00 0.15 C ATOM 500 CG LEU A 37 -11.744 3.050 -3.394 1.00 0.13 C ATOM 501 CD1 LEU A 37 -11.464 4.095 -2.341 1.00 0.18 C ATOM 502 CD2 LEU A 37 -12.568 1.910 -2.834 1.00 0.15 C ATOM 503 H LEU A 37 -10.417 2.641 -5.853 1.00 0.11 H ATOM 504 HA LEU A 37 -13.281 2.049 -5.667 1.00 0.18 H ATOM 505 HB2 LEU A 37 -11.931 4.590 -4.838 1.00 0.18 H ATOM 506 HB3 LEU A 37 -13.456 3.935 -4.279 1.00 0.19 H ATOM 507 HG LEU A 37 -10.796 2.651 -3.723 1.00 0.11 H ATOM 508 HD11 LEU A 37 -12.395 4.515 -1.990 1.00 1.03 H ATOM 509 HD12 LEU A 37 -10.856 4.874 -2.774 1.00 1.02 H ATOM 510 HD13 LEU A 37 -10.937 3.641 -1.518 1.00 1.03 H ATOM 511 HD21 LEU A 37 -12.677 1.146 -3.589 1.00 1.00 H ATOM 512 HD22 LEU A 37 -13.541 2.279 -2.552 1.00 1.01 H ATOM 513 HD23 LEU A 37 -12.073 1.495 -1.969 1.00 1.02 H ATOM 514 N GLY A 38 -12.062 3.688 -8.033 1.00 0.43 N ATOM 515 CA GLY A 38 -12.299 4.549 -9.179 1.00 0.49 C ATOM 516 C GLY A 38 -12.196 6.025 -8.834 1.00 0.51 C ATOM 517 O GLY A 38 -12.990 6.836 -9.304 1.00 0.62 O ATOM 518 H GLY A 38 -11.291 3.079 -8.030 1.00 0.76 H ATOM 519 HA2 GLY A 38 -11.574 4.320 -9.942 1.00 0.62 H ATOM 520 HA3 GLY A 38 -13.288 4.350 -9.565 1.00 0.48 H ATOM 521 N HIS A 39 -11.218 6.371 -8.007 1.00 0.57 N ATOM 522 CA HIS A 39 -11.011 7.758 -7.595 1.00 0.68 C ATOM 523 C HIS A 39 -9.814 8.367 -8.314 1.00 0.82 C ATOM 524 O HIS A 39 -9.815 9.551 -8.643 1.00 1.81 O ATOM 525 CB HIS A 39 -10.796 7.853 -6.077 1.00 0.65 C ATOM 526 CG HIS A 39 -12.061 7.787 -5.272 1.00 0.73 C ATOM 527 ND1 HIS A 39 -12.301 8.593 -4.179 1.00 1.09 N ATOM 528 CD2 HIS A 39 -13.152 6.994 -5.393 1.00 0.67 C ATOM 529 CE1 HIS A 39 -13.481 8.297 -3.667 1.00 1.15 C ATOM 530 NE2 HIS A 39 -14.018 7.331 -4.385 1.00 0.88 N ATOM 531 H HIS A 39 -10.608 5.676 -7.675 1.00 0.62 H ATOM 532 HA HIS A 39 -11.896 8.317 -7.859 1.00 0.79 H ATOM 533 HB2 HIS A 39 -10.165 7.036 -5.762 1.00 0.56 H ATOM 534 HB3 HIS A 39 -10.303 8.786 -5.849 1.00 0.74 H ATOM 535 HD1 HIS A 39 -11.692 9.285 -3.824 1.00 1.33 H ATOM 536 HD2 HIS A 39 -13.308 6.231 -6.143 1.00 0.69 H ATOM 537 HE1 HIS A 39 -13.932 8.768 -2.807 1.00 1.43 H ATOM 538 HE2 HIS A 39 -14.954 7.038 -4.320 1.00 0.94 H ATOM 539 N HIS A 40 -8.792 7.536 -8.536 1.00 0.53 N ATOM 540 CA HIS A 40 -7.535 7.938 -9.186 1.00 0.48 C ATOM 541 C HIS A 40 -6.693 8.855 -8.288 1.00 0.45 C ATOM 542 O HIS A 40 -5.466 8.788 -8.309 1.00 0.59 O ATOM 543 CB HIS A 40 -7.790 8.598 -10.551 1.00 0.58 C ATOM 544 CG HIS A 40 -6.534 8.908 -11.320 1.00 0.73 C ATOM 545 ND1 HIS A 40 -6.398 10.017 -12.124 1.00 1.35 N ATOM 546 CD2 HIS A 40 -5.356 8.242 -11.407 1.00 0.62 C ATOM 547 CE1 HIS A 40 -5.196 10.021 -12.669 1.00 1.46 C ATOM 548 NE2 HIS A 40 -4.542 8.955 -12.250 1.00 0.94 N ATOM 549 H HIS A 40 -8.886 6.601 -8.252 1.00 1.22 H ATOM 550 HA HIS A 40 -6.969 7.032 -9.350 1.00 0.53 H ATOM 551 HB2 HIS A 40 -8.392 7.936 -11.154 1.00 0.67 H ATOM 552 HB3 HIS A 40 -8.325 9.524 -10.398 1.00 0.65 H ATOM 553 HD1 HIS A 40 -7.090 10.697 -12.287 1.00 1.74 H ATOM 554 HD2 HIS A 40 -5.104 7.318 -10.904 1.00 0.79 H ATOM 555 HE1 HIS A 40 -4.813 10.771 -13.345 1.00 1.95 H ATOM 556 HE2 HIS A 40 -3.570 8.825 -12.340 1.00 0.99 H ATOM 557 N THR A 41 -7.347 9.690 -7.497 1.00 0.46 N ATOM 558 CA THR A 41 -6.653 10.605 -6.607 1.00 0.55 C ATOM 559 C THR A 41 -6.285 9.958 -5.278 1.00 0.37 C ATOM 560 O THR A 41 -7.156 9.516 -4.529 1.00 0.45 O ATOM 561 CB THR A 41 -7.507 11.831 -6.299 1.00 0.92 C ATOM 562 OG1 THR A 41 -8.880 11.452 -6.141 1.00 1.97 O ATOM 563 CG2 THR A 41 -7.385 12.880 -7.378 1.00 0.56 C ATOM 564 H THR A 41 -8.328 9.704 -7.517 1.00 0.53 H ATOM 565 HA THR A 41 -5.756 10.937 -7.101 1.00 0.68 H ATOM 566 HB THR A 41 -7.147 12.253 -5.373 1.00 1.69 H ATOM 567 HG1 THR A 41 -9.431 12.245 -6.119 1.00 2.35 H ATOM 568 HG21 THR A 41 -8.098 13.665 -7.184 1.00 1.17 H ATOM 569 HG22 THR A 41 -7.586 12.433 -8.338 1.00 1.23 H ATOM 570 HG23 THR A 41 -6.385 13.288 -7.364 1.00 1.34 H ATOM 571 N PRO A 42 -4.989 9.922 -4.954 1.00 0.24 N ATOM 572 CA PRO A 42 -4.510 9.478 -3.652 1.00 0.27 C ATOM 573 C PRO A 42 -4.738 10.567 -2.613 1.00 0.40 C ATOM 574 O PRO A 42 -4.647 10.336 -1.411 1.00 0.50 O ATOM 575 CB PRO A 42 -3.009 9.235 -3.865 1.00 0.31 C ATOM 576 CG PRO A 42 -2.774 9.424 -5.330 1.00 0.29 C ATOM 577 CD PRO A 42 -3.885 10.304 -5.824 1.00 0.27 C ATOM 578 HA PRO A 42 -4.993 8.564 -3.340 1.00 0.28 H ATOM 579 HB2 PRO A 42 -2.443 9.940 -3.278 1.00 0.38 H ATOM 580 HB3 PRO A 42 -2.762 8.229 -3.556 1.00 0.39 H ATOM 581 HG2 PRO A 42 -1.817 9.898 -5.493 1.00 0.37 H ATOM 582 HG3 PRO A 42 -2.809 8.467 -5.829 1.00 0.37 H ATOM 583 HD2 PRO A 42 -3.634 11.346 -5.694 1.00 0.30 H ATOM 584 HD3 PRO A 42 -4.118 10.093 -6.853 1.00 0.40 H ATOM 585 N GLU A 43 -5.034 11.765 -3.110 1.00 0.43 N ATOM 586 CA GLU A 43 -5.375 12.898 -2.266 1.00 0.55 C ATOM 587 C GLU A 43 -6.755 12.697 -1.663 1.00 0.52 C ATOM 588 O GLU A 43 -7.029 13.101 -0.536 1.00 0.61 O ATOM 589 CB GLU A 43 -5.353 14.180 -3.083 1.00 0.68 C ATOM 590 CG GLU A 43 -4.012 14.440 -3.714 1.00 0.69 C ATOM 591 CD GLU A 43 -4.013 15.647 -4.625 1.00 1.18 C ATOM 592 OE1 GLU A 43 -3.482 16.700 -4.220 1.00 1.38 O ATOM 593 OE2 GLU A 43 -4.553 15.553 -5.748 1.00 1.82 O ATOM 594 H GLU A 43 -5.013 11.889 -4.081 1.00 0.39 H ATOM 595 HA GLU A 43 -4.638 12.965 -1.486 1.00 0.60 H ATOM 596 HB2 GLU A 43 -6.082 14.102 -3.871 1.00 0.68 H ATOM 597 HB3 GLU A 43 -5.603 15.014 -2.444 1.00 0.85 H ATOM 598 HG2 GLU A 43 -3.280 14.591 -2.935 1.00 1.04 H ATOM 599 HG3 GLU A 43 -3.753 13.571 -4.288 1.00 1.01 H ATOM 600 N SER A 44 -7.622 12.066 -2.439 1.00 0.44 N ATOM 601 CA SER A 44 -8.969 11.759 -2.000 1.00 0.43 C ATOM 602 C SER A 44 -8.968 10.495 -1.138 1.00 0.35 C ATOM 603 O SER A 44 -9.898 10.241 -0.370 1.00 0.49 O ATOM 604 CB SER A 44 -9.884 11.621 -3.222 1.00 0.50 C ATOM 605 OG SER A 44 -11.000 10.784 -2.966 1.00 0.97 O ATOM 606 H SER A 44 -7.343 11.794 -3.338 1.00 0.45 H ATOM 607 HA SER A 44 -9.310 12.586 -1.404 1.00 0.47 H ATOM 608 HB2 SER A 44 -10.252 12.600 -3.491 1.00 0.83 H ATOM 609 HB3 SER A 44 -9.317 11.221 -4.050 1.00 0.87 H ATOM 610 HG SER A 44 -11.389 11.026 -2.115 1.00 1.40 H ATOM 611 N ILE A 45 -7.904 9.716 -1.262 1.00 0.19 N ATOM 612 CA ILE A 45 -7.725 8.519 -0.454 1.00 0.13 C ATOM 613 C ILE A 45 -7.047 8.873 0.862 1.00 0.13 C ATOM 614 O ILE A 45 -5.819 8.893 0.951 1.00 0.19 O ATOM 615 CB ILE A 45 -6.864 7.478 -1.189 1.00 0.11 C ATOM 616 CG1 ILE A 45 -7.457 7.173 -2.561 1.00 0.12 C ATOM 617 CG2 ILE A 45 -6.722 6.195 -0.373 1.00 0.10 C ATOM 618 CD1 ILE A 45 -8.869 6.638 -2.529 1.00 0.11 C ATOM 619 H ILE A 45 -7.223 9.951 -1.924 1.00 0.25 H ATOM 620 HA ILE A 45 -8.694 8.089 -0.259 1.00 0.15 H ATOM 621 HB ILE A 45 -5.882 7.898 -1.322 1.00 0.13 H ATOM 622 HG12 ILE A 45 -7.462 8.077 -3.151 1.00 0.15 H ATOM 623 HG13 ILE A 45 -6.838 6.438 -3.047 1.00 0.13 H ATOM 624 HG21 ILE A 45 -7.686 5.721 -0.273 1.00 1.01 H ATOM 625 HG22 ILE A 45 -6.330 6.431 0.608 1.00 1.04 H ATOM 626 HG23 ILE A 45 -6.039 5.525 -0.877 1.00 1.00 H ATOM 627 HD11 ILE A 45 -9.506 7.332 -2.007 1.00 0.98 H ATOM 628 HD12 ILE A 45 -8.881 5.683 -2.026 1.00 1.03 H ATOM 629 HD13 ILE A 45 -9.224 6.515 -3.542 1.00 1.04 H ATOM 630 N SER A 46 -7.838 9.180 1.875 1.00 0.11 N ATOM 631 CA SER A 46 -7.283 9.494 3.176 1.00 0.12 C ATOM 632 C SER A 46 -6.685 8.235 3.796 1.00 0.11 C ATOM 633 O SER A 46 -7.212 7.137 3.616 1.00 0.12 O ATOM 634 CB SER A 46 -8.352 10.081 4.084 1.00 0.16 C ATOM 635 OG SER A 46 -9.128 11.049 3.396 1.00 1.18 O ATOM 636 H SER A 46 -8.812 9.188 1.749 1.00 0.13 H ATOM 637 HA SER A 46 -6.502 10.219 3.037 1.00 0.13 H ATOM 638 HB2 SER A 46 -8.991 9.293 4.432 1.00 0.81 H ATOM 639 HB3 SER A 46 -7.878 10.555 4.930 1.00 0.90 H ATOM 640 HG SER A 46 -10.020 10.700 3.254 1.00 1.49 H ATOM 641 N PRO A 47 -5.605 8.385 4.571 1.00 0.12 N ATOM 642 CA PRO A 47 -4.815 7.272 5.065 1.00 0.12 C ATOM 643 C PRO A 47 -5.322 6.795 6.397 1.00 0.10 C ATOM 644 O PRO A 47 -4.875 5.783 6.927 1.00 0.11 O ATOM 645 CB PRO A 47 -3.443 7.913 5.219 1.00 0.15 C ATOM 646 CG PRO A 47 -3.741 9.306 5.662 1.00 0.17 C ATOM 647 CD PRO A 47 -5.106 9.658 5.110 1.00 0.16 C ATOM 648 HA PRO A 47 -4.772 6.450 4.373 1.00 0.11 H ATOM 649 HB2 PRO A 47 -2.870 7.376 5.958 1.00 0.16 H ATOM 650 HB3 PRO A 47 -2.928 7.902 4.277 1.00 0.16 H ATOM 651 HG2 PRO A 47 -3.756 9.349 6.740 1.00 0.17 H ATOM 652 HG3 PRO A 47 -2.997 9.981 5.275 1.00 0.19 H ATOM 653 HD2 PRO A 47 -5.758 9.995 5.909 1.00 0.17 H ATOM 654 HD3 PRO A 47 -5.026 10.406 4.336 1.00 0.19 H ATOM 655 N ALA A 48 -6.277 7.531 6.915 1.00 0.12 N ATOM 656 CA ALA A 48 -6.752 7.316 8.249 1.00 0.13 C ATOM 657 C ALA A 48 -8.257 7.092 8.260 1.00 0.13 C ATOM 658 O ALA A 48 -8.876 6.931 9.313 1.00 0.17 O ATOM 659 CB ALA A 48 -6.337 8.497 9.094 1.00 0.18 C ATOM 660 H ALA A 48 -6.663 8.257 6.381 1.00 0.15 H ATOM 661 HA ALA A 48 -6.258 6.445 8.629 1.00 0.13 H ATOM 662 HB1 ALA A 48 -5.303 8.736 8.864 1.00 1.07 H ATOM 663 HB2 ALA A 48 -6.430 8.247 10.138 1.00 1.02 H ATOM 664 HB3 ALA A 48 -6.961 9.345 8.862 1.00 1.02 H ATOM 665 N THR A 49 -8.833 7.074 7.065 1.00 0.12 N ATOM 666 CA THR A 49 -10.241 6.800 6.880 1.00 0.12 C ATOM 667 C THR A 49 -10.549 5.332 7.148 1.00 0.10 C ATOM 668 O THR A 49 -11.514 5.018 7.837 1.00 0.10 O ATOM 669 CB THR A 49 -10.650 7.145 5.441 1.00 0.14 C ATOM 670 OG1 THR A 49 -10.720 8.564 5.274 1.00 0.20 O ATOM 671 CG2 THR A 49 -11.967 6.502 5.081 1.00 0.13 C ATOM 672 H THR A 49 -8.293 7.257 6.274 1.00 0.15 H ATOM 673 HA THR A 49 -10.807 7.419 7.559 1.00 0.14 H ATOM 674 HB THR A 49 -9.891 6.756 4.778 1.00 0.15 H ATOM 675 HG1 THR A 49 -11.621 8.815 5.032 1.00 0.82 H ATOM 676 HG21 THR A 49 -12.200 6.708 4.049 1.00 0.98 H ATOM 677 HG22 THR A 49 -12.747 6.892 5.716 1.00 1.00 H ATOM 678 HG23 THR A 49 -11.881 5.433 5.227 1.00 0.98 H ATOM 679 N ALA A 50 -9.674 4.481 6.595 1.00 0.09 N ATOM 680 CA ALA A 50 -9.749 3.012 6.637 1.00 0.08 C ATOM 681 C ALA A 50 -10.257 2.477 5.325 1.00 0.08 C ATOM 682 O ALA A 50 -11.167 3.029 4.726 1.00 0.09 O ATOM 683 CB ALA A 50 -10.582 2.465 7.785 1.00 0.09 C ATOM 684 H ALA A 50 -8.936 4.867 6.111 1.00 0.10 H ATOM 685 HA ALA A 50 -8.737 2.644 6.761 1.00 0.09 H ATOM 686 HB1 ALA A 50 -10.193 2.834 8.720 1.00 1.02 H ATOM 687 HB2 ALA A 50 -10.541 1.384 7.775 1.00 1.02 H ATOM 688 HB3 ALA A 50 -11.608 2.788 7.665 1.00 1.01 H ATOM 689 N PHE A 51 -9.622 1.409 4.885 1.00 0.08 N ATOM 690 CA PHE A 51 -9.988 0.718 3.661 1.00 0.09 C ATOM 691 C PHE A 51 -11.450 0.345 3.660 1.00 0.10 C ATOM 692 O PHE A 51 -12.153 0.552 2.672 1.00 0.10 O ATOM 693 CB PHE A 51 -9.138 -0.527 3.516 1.00 0.11 C ATOM 694 CG PHE A 51 -7.719 -0.206 3.214 1.00 0.11 C ATOM 695 CD1 PHE A 51 -7.400 0.657 2.195 1.00 0.11 C ATOM 696 CD2 PHE A 51 -6.707 -0.781 3.952 1.00 0.12 C ATOM 697 CE1 PHE A 51 -6.091 0.953 1.912 1.00 0.12 C ATOM 698 CE2 PHE A 51 -5.390 -0.495 3.678 1.00 0.13 C ATOM 699 CZ PHE A 51 -5.087 0.405 2.651 1.00 0.13 C ATOM 700 H PHE A 51 -8.860 1.068 5.415 1.00 0.08 H ATOM 701 HA PHE A 51 -9.789 1.376 2.831 1.00 0.10 H ATOM 702 HB2 PHE A 51 -9.166 -1.082 4.444 1.00 0.11 H ATOM 703 HB3 PHE A 51 -9.526 -1.147 2.718 1.00 0.11 H ATOM 704 HD1 PHE A 51 -8.195 1.105 1.616 1.00 0.12 H ATOM 705 HD2 PHE A 51 -6.957 -1.463 4.749 1.00 0.12 H ATOM 706 HE1 PHE A 51 -5.856 1.630 1.106 1.00 0.13 H ATOM 707 HE2 PHE A 51 -4.606 -0.951 4.262 1.00 0.14 H ATOM 708 HZ PHE A 51 -4.057 0.640 2.430 1.00 0.14 H ATOM 709 N LYS A 52 -11.898 -0.209 4.773 1.00 0.11 N ATOM 710 CA LYS A 52 -13.297 -0.519 4.966 1.00 0.13 C ATOM 711 C LYS A 52 -14.153 0.694 4.664 1.00 0.12 C ATOM 712 O LYS A 52 -15.143 0.621 3.936 1.00 0.15 O ATOM 713 CB LYS A 52 -13.526 -0.930 6.414 1.00 0.17 C ATOM 714 CG LYS A 52 -12.765 -2.181 6.805 1.00 0.53 C ATOM 715 CD LYS A 52 -13.091 -2.638 8.215 1.00 0.64 C ATOM 716 CE LYS A 52 -12.682 -1.613 9.253 1.00 0.59 C ATOM 717 NZ LYS A 52 -12.859 -2.122 10.639 1.00 1.22 N ATOM 718 H LYS A 52 -11.266 -0.428 5.488 1.00 0.12 H ATOM 719 HA LYS A 52 -13.557 -1.335 4.305 1.00 0.15 H ATOM 720 HB2 LYS A 52 -13.195 -0.120 7.055 1.00 0.45 H ATOM 721 HB3 LYS A 52 -14.581 -1.091 6.568 1.00 0.45 H ATOM 722 HG2 LYS A 52 -13.020 -2.967 6.119 1.00 0.76 H ATOM 723 HG3 LYS A 52 -11.708 -1.972 6.737 1.00 0.76 H ATOM 724 HD2 LYS A 52 -14.151 -2.793 8.285 1.00 0.75 H ATOM 725 HD3 LYS A 52 -12.574 -3.565 8.412 1.00 0.98 H ATOM 726 HE2 LYS A 52 -11.645 -1.354 9.102 1.00 1.18 H ATOM 727 HE3 LYS A 52 -13.296 -0.736 9.122 1.00 1.08 H ATOM 728 HZ1 LYS A 52 -12.245 -2.948 10.800 1.00 1.55 H ATOM 729 HZ2 LYS A 52 -13.847 -2.409 10.793 1.00 1.84 H ATOM 730 HZ3 LYS A 52 -12.612 -1.384 11.327 1.00 1.84 H ATOM 731 N ASP A 53 -13.718 1.820 5.207 1.00 0.11 N ATOM 732 CA ASP A 53 -14.460 3.062 5.115 1.00 0.11 C ATOM 733 C ASP A 53 -14.205 3.750 3.776 1.00 0.10 C ATOM 734 O ASP A 53 -14.801 4.780 3.460 1.00 0.18 O ATOM 735 CB ASP A 53 -14.073 3.995 6.268 1.00 0.12 C ATOM 736 CG ASP A 53 -14.569 3.496 7.611 1.00 0.58 C ATOM 737 OD1 ASP A 53 -13.780 2.857 8.342 1.00 1.14 O ATOM 738 OD2 ASP A 53 -15.748 3.736 7.950 1.00 0.67 O ATOM 739 H ASP A 53 -12.855 1.816 5.675 1.00 0.11 H ATOM 740 HA ASP A 53 -15.505 2.814 5.198 1.00 0.12 H ATOM 741 HB2 ASP A 53 -12.988 4.078 6.311 1.00 0.42 H ATOM 742 HB3 ASP A 53 -14.497 4.973 6.086 1.00 0.47 H ATOM 743 N LEU A 54 -13.307 3.170 2.998 1.00 0.08 N ATOM 744 CA LEU A 54 -12.934 3.706 1.699 1.00 0.08 C ATOM 745 C LEU A 54 -13.745 3.060 0.593 1.00 0.08 C ATOM 746 O LEU A 54 -14.025 3.681 -0.430 1.00 0.10 O ATOM 747 CB LEU A 54 -11.441 3.475 1.455 1.00 0.08 C ATOM 748 CG LEU A 54 -10.519 4.523 2.072 1.00 0.09 C ATOM 749 CD1 LEU A 54 -9.093 4.018 2.120 1.00 0.10 C ATOM 750 CD2 LEU A 54 -10.592 5.810 1.283 1.00 0.12 C ATOM 751 H LEU A 54 -12.874 2.350 3.314 1.00 0.11 H ATOM 752 HA LEU A 54 -13.130 4.766 1.704 1.00 0.10 H ATOM 753 HB2 LEU A 54 -11.180 2.519 1.872 1.00 0.08 H ATOM 754 HB3 LEU A 54 -11.262 3.440 0.391 1.00 0.08 H ATOM 755 HG LEU A 54 -10.837 4.727 3.083 1.00 0.09 H ATOM 756 HD11 LEU A 54 -8.786 3.717 1.131 1.00 1.03 H ATOM 757 HD12 LEU A 54 -9.035 3.174 2.793 1.00 1.02 H ATOM 758 HD13 LEU A 54 -8.446 4.808 2.474 1.00 1.02 H ATOM 759 HD21 LEU A 54 -10.330 5.609 0.255 1.00 1.01 H ATOM 760 HD22 LEU A 54 -9.899 6.525 1.700 1.00 1.00 H ATOM 761 HD23 LEU A 54 -11.594 6.205 1.330 1.00 1.05 H ATOM 762 N GLY A 55 -14.141 1.819 0.810 1.00 0.09 N ATOM 763 CA GLY A 55 -14.850 1.089 -0.215 1.00 0.10 C ATOM 764 C GLY A 55 -14.204 -0.242 -0.495 1.00 0.10 C ATOM 765 O GLY A 55 -14.625 -0.972 -1.394 1.00 0.15 O ATOM 766 H GLY A 55 -13.978 1.401 1.686 1.00 0.09 H ATOM 767 HA2 GLY A 55 -15.866 0.927 0.110 1.00 0.12 H ATOM 768 HA3 GLY A 55 -14.859 1.675 -1.121 1.00 0.11 H ATOM 769 N ILE A 56 -13.159 -0.544 0.260 1.00 0.09 N ATOM 770 CA ILE A 56 -12.512 -1.837 0.183 1.00 0.09 C ATOM 771 C ILE A 56 -13.480 -2.923 0.640 1.00 0.14 C ATOM 772 O ILE A 56 -13.988 -2.880 1.762 1.00 0.32 O ATOM 773 CB ILE A 56 -11.221 -1.877 1.034 1.00 0.10 C ATOM 774 CG1 ILE A 56 -10.099 -1.047 0.418 1.00 0.11 C ATOM 775 CG2 ILE A 56 -10.763 -3.289 1.255 1.00 0.15 C ATOM 776 CD1 ILE A 56 -10.130 -0.963 -1.088 1.00 0.10 C ATOM 777 H ILE A 56 -12.815 0.123 0.890 1.00 0.10 H ATOM 778 HA ILE A 56 -12.244 -2.023 -0.848 1.00 0.09 H ATOM 779 HB ILE A 56 -11.449 -1.464 2.000 1.00 0.10 H ATOM 780 HG12 ILE A 56 -10.145 -0.049 0.812 1.00 0.13 H ATOM 781 HG13 ILE A 56 -9.156 -1.486 0.702 1.00 0.16 H ATOM 782 HG21 ILE A 56 -10.958 -3.866 0.367 1.00 1.07 H ATOM 783 HG22 ILE A 56 -11.297 -3.709 2.094 1.00 1.03 H ATOM 784 HG23 ILE A 56 -9.702 -3.287 1.459 1.00 0.99 H ATOM 785 HD11 ILE A 56 -10.240 -1.954 -1.505 1.00 1.00 H ATOM 786 HD12 ILE A 56 -9.207 -0.529 -1.439 1.00 0.96 H ATOM 787 HD13 ILE A 56 -10.959 -0.342 -1.396 1.00 1.00 H ATOM 788 N ASP A 57 -13.740 -3.882 -0.238 1.00 0.19 N ATOM 789 CA ASP A 57 -14.698 -4.944 0.047 1.00 0.28 C ATOM 790 C ASP A 57 -14.251 -6.264 -0.564 1.00 0.28 C ATOM 791 O ASP A 57 -14.798 -6.704 -1.575 1.00 0.67 O ATOM 792 CB ASP A 57 -16.098 -4.578 -0.464 1.00 0.52 C ATOM 793 CG ASP A 57 -16.942 -3.879 0.583 1.00 1.48 C ATOM 794 OD1 ASP A 57 -17.216 -2.668 0.437 1.00 2.34 O ATOM 795 OD2 ASP A 57 -17.347 -4.546 1.563 1.00 1.95 O ATOM 796 H ASP A 57 -13.255 -3.886 -1.094 1.00 0.42 H ATOM 797 HA ASP A 57 -14.741 -5.061 1.120 1.00 0.44 H ATOM 798 HB2 ASP A 57 -16.002 -3.922 -1.316 1.00 0.99 H ATOM 799 HB3 ASP A 57 -16.608 -5.481 -0.768 1.00 0.75 H ATOM 800 N SER A 58 -13.249 -6.882 0.063 1.00 0.23 N ATOM 801 CA SER A 58 -12.706 -8.178 -0.364 1.00 0.26 C ATOM 802 C SER A 58 -12.008 -8.095 -1.726 1.00 0.19 C ATOM 803 O SER A 58 -10.783 -8.174 -1.811 1.00 0.17 O ATOM 804 CB SER A 58 -13.800 -9.238 -0.400 1.00 0.36 C ATOM 805 OG SER A 58 -14.535 -9.257 0.813 1.00 1.25 O ATOM 806 H SER A 58 -12.861 -6.453 0.860 1.00 0.45 H ATOM 807 HA SER A 58 -11.984 -8.477 0.362 1.00 0.35 H ATOM 808 HB2 SER A 58 -14.462 -9.016 -1.207 1.00 0.92 H ATOM 809 HB3 SER A 58 -13.355 -10.209 -0.555 1.00 0.87 H ATOM 810 HG SER A 58 -14.562 -8.366 1.186 1.00 1.39 H ATOM 811 N LEU A 59 -12.794 -7.913 -2.780 1.00 0.22 N ATOM 812 CA LEU A 59 -12.282 -7.876 -4.146 1.00 0.20 C ATOM 813 C LEU A 59 -11.299 -6.748 -4.310 1.00 0.14 C ATOM 814 O LEU A 59 -10.191 -6.934 -4.799 1.00 0.14 O ATOM 815 CB LEU A 59 -13.401 -7.644 -5.149 1.00 0.23 C ATOM 816 CG LEU A 59 -14.399 -8.784 -5.366 1.00 0.30 C ATOM 817 CD1 LEU A 59 -15.070 -9.204 -4.073 1.00 1.12 C ATOM 818 CD2 LEU A 59 -15.439 -8.346 -6.374 1.00 1.18 C ATOM 819 H LEU A 59 -13.758 -7.785 -2.631 1.00 0.29 H ATOM 820 HA LEU A 59 -11.792 -8.815 -4.357 1.00 0.23 H ATOM 821 HB2 LEU A 59 -13.947 -6.769 -4.833 1.00 0.22 H ATOM 822 HB3 LEU A 59 -12.940 -7.419 -6.097 1.00 0.24 H ATOM 823 HG LEU A 59 -13.883 -9.640 -5.768 1.00 0.93 H ATOM 824 HD11 LEU A 59 -15.752 -10.019 -4.268 1.00 1.60 H ATOM 825 HD12 LEU A 59 -15.615 -8.367 -3.662 1.00 1.77 H ATOM 826 HD13 LEU A 59 -14.316 -9.524 -3.369 1.00 1.74 H ATOM 827 HD21 LEU A 59 -16.168 -9.129 -6.508 1.00 1.74 H ATOM 828 HD22 LEU A 59 -14.958 -8.131 -7.316 1.00 1.76 H ATOM 829 HD23 LEU A 59 -15.928 -7.453 -6.009 1.00 1.79 H ATOM 830 N THR A 60 -11.710 -5.575 -3.869 1.00 0.12 N ATOM 831 CA THR A 60 -10.880 -4.401 -4.001 1.00 0.10 C ATOM 832 C THR A 60 -9.795 -4.409 -2.947 1.00 0.09 C ATOM 833 O THR A 60 -8.844 -3.649 -3.022 1.00 0.10 O ATOM 834 CB THR A 60 -11.692 -3.111 -3.901 1.00 0.12 C ATOM 835 OG1 THR A 60 -12.754 -3.275 -2.951 1.00 0.16 O ATOM 836 CG2 THR A 60 -12.242 -2.738 -5.266 1.00 0.16 C ATOM 837 H THR A 60 -12.563 -5.516 -3.385 1.00 0.13 H ATOM 838 HA THR A 60 -10.422 -4.435 -4.977 1.00 0.11 H ATOM 839 HB THR A 60 -11.035 -2.320 -3.565 1.00 0.14 H ATOM 840 HG1 THR A 60 -13.597 -3.059 -3.373 1.00 0.35 H ATOM 841 HG21 THR A 60 -11.420 -2.643 -5.969 1.00 1.02 H ATOM 842 HG22 THR A 60 -12.770 -1.800 -5.199 1.00 0.99 H ATOM 843 HG23 THR A 60 -12.916 -3.510 -5.604 1.00 0.98 H ATOM 844 N ALA A 61 -9.951 -5.278 -1.962 1.00 0.09 N ATOM 845 CA ALA A 61 -8.903 -5.494 -0.978 1.00 0.09 C ATOM 846 C ALA A 61 -7.814 -6.358 -1.586 1.00 0.09 C ATOM 847 O ALA A 61 -6.630 -6.204 -1.281 1.00 0.12 O ATOM 848 CB ALA A 61 -9.453 -6.141 0.284 1.00 0.10 C ATOM 849 H ALA A 61 -10.796 -5.776 -1.896 1.00 0.10 H ATOM 850 HA ALA A 61 -8.485 -4.528 -0.716 1.00 0.10 H ATOM 851 HB1 ALA A 61 -8.678 -6.168 1.041 1.00 1.01 H ATOM 852 HB2 ALA A 61 -9.778 -7.147 0.064 1.00 1.04 H ATOM 853 HB3 ALA A 61 -10.291 -5.564 0.649 1.00 1.02 H ATOM 854 N LEU A 62 -8.221 -7.281 -2.448 1.00 0.10 N ATOM 855 CA LEU A 62 -7.285 -8.113 -3.160 1.00 0.11 C ATOM 856 C LEU A 62 -6.740 -7.365 -4.369 1.00 0.11 C ATOM 857 O LEU A 62 -5.573 -7.499 -4.710 1.00 0.13 O ATOM 858 CB LEU A 62 -7.968 -9.393 -3.616 1.00 0.14 C ATOM 859 CG LEU A 62 -7.102 -10.662 -3.604 1.00 0.20 C ATOM 860 CD1 LEU A 62 -5.673 -10.367 -4.037 1.00 0.53 C ATOM 861 CD2 LEU A 62 -7.121 -11.306 -2.230 1.00 0.52 C ATOM 862 H LEU A 62 -9.181 -7.441 -2.582 1.00 0.11 H ATOM 863 HA LEU A 62 -6.474 -8.357 -2.492 1.00 0.12 H ATOM 864 HB2 LEU A 62 -8.824 -9.562 -2.981 1.00 0.14 H ATOM 865 HB3 LEU A 62 -8.316 -9.228 -4.616 1.00 0.16 H ATOM 866 HG LEU A 62 -7.516 -11.372 -4.306 1.00 0.46 H ATOM 867 HD11 LEU A 62 -5.660 -10.069 -5.077 1.00 1.21 H ATOM 868 HD12 LEU A 62 -5.067 -11.249 -3.901 1.00 1.16 H ATOM 869 HD13 LEU A 62 -5.272 -9.560 -3.433 1.00 1.19 H ATOM 870 HD21 LEU A 62 -6.715 -10.616 -1.506 1.00 1.20 H ATOM 871 HD22 LEU A 62 -6.522 -12.204 -2.245 1.00 1.10 H ATOM 872 HD23 LEU A 62 -8.137 -11.554 -1.962 1.00 1.27 H ATOM 873 N GLU A 63 -7.577 -6.589 -5.038 1.00 0.10 N ATOM 874 CA GLU A 63 -7.134 -5.764 -6.129 1.00 0.11 C ATOM 875 C GLU A 63 -6.230 -4.659 -5.592 1.00 0.10 C ATOM 876 O GLU A 63 -5.259 -4.264 -6.242 1.00 0.12 O ATOM 877 CB GLU A 63 -8.371 -5.207 -6.831 1.00 0.14 C ATOM 878 CG GLU A 63 -8.121 -3.939 -7.591 1.00 0.41 C ATOM 879 CD GLU A 63 -7.325 -4.154 -8.867 1.00 0.59 C ATOM 880 OE1 GLU A 63 -6.134 -3.770 -8.896 1.00 0.72 O ATOM 881 OE2 GLU A 63 -7.870 -4.705 -9.844 1.00 0.83 O ATOM 882 H GLU A 63 -8.538 -6.562 -4.840 1.00 0.10 H ATOM 883 HA GLU A 63 -6.575 -6.382 -6.817 1.00 0.13 H ATOM 884 HB2 GLU A 63 -8.743 -5.947 -7.523 1.00 0.42 H ATOM 885 HB3 GLU A 63 -9.125 -5.010 -6.090 1.00 0.37 H ATOM 886 HG2 GLU A 63 -9.070 -3.488 -7.842 1.00 0.58 H ATOM 887 HG3 GLU A 63 -7.576 -3.292 -6.931 1.00 0.55 H ATOM 888 N LEU A 64 -6.540 -4.189 -4.381 1.00 0.09 N ATOM 889 CA LEU A 64 -5.646 -3.296 -3.659 1.00 0.09 C ATOM 890 C LEU A 64 -4.290 -3.941 -3.612 1.00 0.12 C ATOM 891 O LEU A 64 -3.262 -3.327 -3.894 1.00 0.17 O ATOM 892 CB LEU A 64 -6.114 -3.080 -2.217 1.00 0.12 C ATOM 893 CG LEU A 64 -6.006 -1.652 -1.710 1.00 0.17 C ATOM 894 CD1 LEU A 64 -6.467 -1.574 -0.265 1.00 0.43 C ATOM 895 CD2 LEU A 64 -4.579 -1.159 -1.858 1.00 0.44 C ATOM 896 H LEU A 64 -7.392 -4.446 -3.965 1.00 0.08 H ATOM 897 HA LEU A 64 -5.588 -2.361 -4.177 1.00 0.10 H ATOM 898 HB2 LEU A 64 -7.143 -3.402 -2.123 1.00 0.30 H ATOM 899 HB3 LEU A 64 -5.498 -3.702 -1.580 1.00 0.28 H ATOM 900 HG LEU A 64 -6.649 -1.019 -2.301 1.00 0.51 H ATOM 901 HD11 LEU A 64 -7.529 -1.779 -0.210 1.00 1.11 H ATOM 902 HD12 LEU A 64 -6.269 -0.585 0.123 1.00 1.20 H ATOM 903 HD13 LEU A 64 -5.931 -2.307 0.325 1.00 1.10 H ATOM 904 HD21 LEU A 64 -3.936 -1.741 -1.215 1.00 1.13 H ATOM 905 HD22 LEU A 64 -4.522 -0.117 -1.583 1.00 1.14 H ATOM 906 HD23 LEU A 64 -4.262 -1.284 -2.886 1.00 1.09 H ATOM 907 N ARG A 65 -4.333 -5.213 -3.288 1.00 0.12 N ATOM 908 CA ARG A 65 -3.140 -6.013 -3.167 1.00 0.15 C ATOM 909 C ARG A 65 -2.454 -6.124 -4.490 1.00 0.16 C ATOM 910 O ARG A 65 -1.266 -5.861 -4.608 1.00 0.19 O ATOM 911 CB ARG A 65 -3.422 -7.415 -2.699 1.00 0.18 C ATOM 912 CG ARG A 65 -2.227 -8.312 -2.960 1.00 0.33 C ATOM 913 CD ARG A 65 -2.498 -9.738 -2.604 1.00 0.43 C ATOM 914 NE ARG A 65 -2.520 -9.921 -1.152 1.00 0.78 N ATOM 915 CZ ARG A 65 -3.534 -9.581 -0.363 1.00 1.35 C ATOM 916 NH1 ARG A 65 -4.738 -9.338 -0.870 1.00 1.63 N ATOM 917 NH2 ARG A 65 -3.360 -9.544 0.942 1.00 1.72 N ATOM 918 H ARG A 65 -5.210 -5.624 -3.164 1.00 0.11 H ATOM 919 HA ARG A 65 -2.489 -5.542 -2.464 1.00 0.17 H ATOM 920 HB2 ARG A 65 -3.630 -7.403 -1.637 1.00 0.25 H ATOM 921 HB3 ARG A 65 -4.283 -7.811 -3.235 1.00 0.20 H ATOM 922 HG2 ARG A 65 -1.974 -8.259 -4.008 1.00 0.64 H ATOM 923 HG3 ARG A 65 -1.392 -7.956 -2.373 1.00 0.65 H ATOM 924 HD2 ARG A 65 -3.441 -10.022 -3.040 1.00 0.56 H ATOM 925 HD3 ARG A 65 -1.716 -10.333 -3.025 1.00 0.59 H ATOM 926 HE ARG A 65 -1.682 -10.242 -0.735 1.00 0.71 H ATOM 927 HH11 ARG A 65 -4.888 -9.412 -1.855 1.00 1.41 H ATOM 928 HH12 ARG A 65 -5.501 -9.082 -0.271 1.00 2.09 H ATOM 929 HH21 ARG A 65 -2.465 -9.783 1.337 1.00 1.59 H ATOM 930 HH22 ARG A 65 -4.108 -9.267 1.542 1.00 2.17 H ATOM 931 N ASN A 66 -3.227 -6.531 -5.476 1.00 0.14 N ATOM 932 CA ASN A 66 -2.705 -6.804 -6.787 1.00 0.16 C ATOM 933 C ASN A 66 -1.896 -5.615 -7.289 1.00 0.16 C ATOM 934 O ASN A 66 -0.933 -5.783 -8.033 1.00 0.21 O ATOM 935 CB ASN A 66 -3.840 -7.132 -7.756 1.00 0.20 C ATOM 936 CG ASN A 66 -4.049 -8.616 -7.925 1.00 0.32 C ATOM 937 OD1 ASN A 66 -3.407 -9.257 -8.758 1.00 0.83 O ATOM 938 ND2 ASN A 66 -4.961 -9.168 -7.149 1.00 0.34 N ATOM 939 H ASN A 66 -4.190 -6.627 -5.320 1.00 0.14 H ATOM 940 HA ASN A 66 -2.062 -7.672 -6.689 1.00 0.19 H ATOM 941 HB2 ASN A 66 -4.757 -6.714 -7.372 1.00 0.16 H ATOM 942 HB3 ASN A 66 -3.629 -6.706 -8.719 1.00 0.29 H ATOM 943 HD21 ASN A 66 -5.444 -8.594 -6.518 1.00 0.68 H ATOM 944 HD22 ASN A 66 -5.120 -10.125 -7.242 1.00 0.33 H ATOM 945 N THR A 67 -2.288 -4.409 -6.873 1.00 0.14 N ATOM 946 CA THR A 67 -1.489 -3.233 -7.151 1.00 0.15 C ATOM 947 C THR A 67 -0.350 -3.103 -6.145 1.00 0.16 C ATOM 948 O THR A 67 0.809 -3.171 -6.528 1.00 0.21 O ATOM 949 CB THR A 67 -2.326 -1.945 -7.141 1.00 0.17 C ATOM 950 OG1 THR A 67 -3.443 -2.080 -8.032 1.00 0.22 O ATOM 951 CG2 THR A 67 -1.477 -0.744 -7.555 1.00 0.19 C ATOM 952 H THR A 67 -3.148 -4.307 -6.396 1.00 0.13 H ATOM 953 HA THR A 67 -1.066 -3.349 -8.134 1.00 0.17 H ATOM 954 HB THR A 67 -2.690 -1.785 -6.142 1.00 0.19 H ATOM 955 HG1 THR A 67 -4.083 -2.699 -7.657 1.00 0.29 H ATOM 956 HG21 THR A 67 -2.095 0.138 -7.597 1.00 1.03 H ATOM 957 HG22 THR A 67 -1.043 -0.929 -8.527 1.00 1.04 H ATOM 958 HG23 THR A 67 -0.682 -0.593 -6.832 1.00 1.03 H ATOM 959 N LEU A 68 -0.685 -2.960 -4.859 1.00 0.17 N ATOM 960 CA LEU A 68 0.314 -2.690 -3.820 1.00 0.20 C ATOM 961 C LEU A 68 1.454 -3.702 -3.872 1.00 0.20 C ATOM 962 O LEU A 68 2.623 -3.332 -3.803 1.00 0.23 O ATOM 963 CB LEU A 68 -0.339 -2.674 -2.420 1.00 0.30 C ATOM 964 CG LEU A 68 -0.711 -4.035 -1.819 1.00 0.79 C ATOM 965 CD1 LEU A 68 0.428 -4.617 -0.990 1.00 1.38 C ATOM 966 CD2 LEU A 68 -1.958 -3.914 -0.965 1.00 1.40 C ATOM 967 H LEU A 68 -1.631 -3.035 -4.602 1.00 0.16 H ATOM 968 HA LEU A 68 0.727 -1.713 -4.027 1.00 0.25 H ATOM 969 HB2 LEU A 68 0.336 -2.190 -1.740 1.00 0.82 H ATOM 970 HB3 LEU A 68 -1.241 -2.085 -2.481 1.00 0.85 H ATOM 971 HG LEU A 68 -0.917 -4.718 -2.622 1.00 0.98 H ATOM 972 HD11 LEU A 68 0.570 -4.019 -0.105 1.00 1.76 H ATOM 973 HD12 LEU A 68 1.336 -4.617 -1.576 1.00 1.88 H ATOM 974 HD13 LEU A 68 0.184 -5.629 -0.706 1.00 1.92 H ATOM 975 HD21 LEU A 68 -2.181 -4.870 -0.516 1.00 2.06 H ATOM 976 HD22 LEU A 68 -2.788 -3.601 -1.581 1.00 1.88 H ATOM 977 HD23 LEU A 68 -1.789 -3.183 -0.189 1.00 1.68 H ATOM 978 N THR A 69 1.108 -4.974 -3.974 1.00 0.22 N ATOM 979 CA THR A 69 2.064 -6.037 -4.137 1.00 0.25 C ATOM 980 C THR A 69 2.954 -5.792 -5.339 1.00 0.25 C ATOM 981 O THR A 69 4.169 -5.902 -5.263 1.00 0.33 O ATOM 982 CB THR A 69 1.295 -7.359 -4.321 1.00 0.34 C ATOM 983 OG1 THR A 69 0.936 -7.907 -3.050 1.00 1.01 O ATOM 984 CG2 THR A 69 2.087 -8.357 -5.138 1.00 0.65 C ATOM 985 H THR A 69 0.167 -5.239 -3.897 1.00 0.23 H ATOM 986 HA THR A 69 2.665 -6.099 -3.242 1.00 0.25 H ATOM 987 HB THR A 69 0.383 -7.137 -4.859 1.00 0.80 H ATOM 988 HG1 THR A 69 1.724 -8.287 -2.638 1.00 0.95 H ATOM 989 HG21 THR A 69 3.024 -8.564 -4.647 1.00 1.27 H ATOM 990 HG22 THR A 69 2.276 -7.930 -6.118 1.00 1.28 H ATOM 991 HG23 THR A 69 1.521 -9.268 -5.242 1.00 1.25 H ATOM 992 N HIS A 70 2.331 -5.449 -6.439 1.00 0.21 N ATOM 993 CA HIS A 70 3.034 -5.225 -7.680 1.00 0.22 C ATOM 994 C HIS A 70 3.903 -3.973 -7.582 1.00 0.21 C ATOM 995 O HIS A 70 4.886 -3.832 -8.300 1.00 0.28 O ATOM 996 CB HIS A 70 2.005 -5.091 -8.801 1.00 0.24 C ATOM 997 CG HIS A 70 2.574 -5.083 -10.181 1.00 0.30 C ATOM 998 ND1 HIS A 70 2.610 -6.202 -10.985 1.00 0.39 N ATOM 999 CD2 HIS A 70 3.119 -4.083 -10.904 1.00 0.34 C ATOM 1000 CE1 HIS A 70 3.156 -5.888 -12.142 1.00 0.45 C ATOM 1001 NE2 HIS A 70 3.473 -4.608 -12.119 1.00 0.41 N ATOM 1002 H HIS A 70 1.355 -5.348 -6.415 1.00 0.22 H ATOM 1003 HA HIS A 70 3.668 -6.076 -7.865 1.00 0.25 H ATOM 1004 HB2 HIS A 70 1.311 -5.906 -8.737 1.00 0.25 H ATOM 1005 HB3 HIS A 70 1.467 -4.174 -8.656 1.00 0.25 H ATOM 1006 HD1 HIS A 70 2.283 -7.098 -10.743 1.00 0.44 H ATOM 1007 HD2 HIS A 70 3.243 -3.057 -10.584 1.00 0.37 H ATOM 1008 HE1 HIS A 70 3.318 -6.563 -12.970 1.00 0.54 H ATOM 1009 HE2 HIS A 70 3.793 -4.093 -12.895 1.00 0.50 H ATOM 1010 N ASN A 71 3.502 -3.055 -6.719 1.00 0.19 N ATOM 1011 CA ASN A 71 4.266 -1.836 -6.477 1.00 0.22 C ATOM 1012 C ASN A 71 5.464 -2.084 -5.571 1.00 0.20 C ATOM 1013 O ASN A 71 6.510 -1.457 -5.731 1.00 0.25 O ATOM 1014 CB ASN A 71 3.393 -0.770 -5.811 1.00 0.32 C ATOM 1015 CG ASN A 71 2.048 -0.552 -6.475 1.00 0.61 C ATOM 1016 OD1 ASN A 71 1.088 -0.141 -5.827 1.00 1.44 O ATOM 1017 ND2 ASN A 71 1.955 -0.856 -7.756 1.00 0.22 N ATOM 1018 H ASN A 71 2.622 -3.158 -6.292 1.00 0.20 H ATOM 1019 HA ASN A 71 4.611 -1.463 -7.428 1.00 0.29 H ATOM 1020 HB2 ASN A 71 3.216 -1.057 -4.786 1.00 0.39 H ATOM 1021 HB3 ASN A 71 3.929 0.169 -5.822 1.00 0.27 H ATOM 1022 HD21 ASN A 71 2.747 -1.208 -8.197 1.00 0.75 H ATOM 1023 HD22 ASN A 71 1.096 -0.717 -8.205 1.00 0.26 H ATOM 1024 N THR A 72 5.306 -2.985 -4.614 1.00 0.18 N ATOM 1025 CA THR A 72 6.257 -3.113 -3.532 1.00 0.19 C ATOM 1026 C THR A 72 7.000 -4.423 -3.589 1.00 0.23 C ATOM 1027 O THR A 72 7.979 -4.615 -2.878 1.00 0.25 O ATOM 1028 CB THR A 72 5.536 -3.003 -2.186 1.00 0.19 C ATOM 1029 OG1 THR A 72 4.577 -4.066 -2.073 1.00 0.21 O ATOM 1030 CG2 THR A 72 4.812 -1.670 -2.078 1.00 0.16 C ATOM 1031 H THR A 72 4.535 -3.588 -4.637 1.00 0.18 H ATOM 1032 HA THR A 72 6.970 -2.308 -3.605 1.00 0.21 H ATOM 1033 HB THR A 72 6.260 -3.083 -1.389 1.00 0.22 H ATOM 1034 HG1 THR A 72 3.765 -3.809 -2.532 1.00 0.21 H ATOM 1035 HG21 THR A 72 5.384 -0.900 -2.579 1.00 0.99 H ATOM 1036 HG22 THR A 72 4.697 -1.408 -1.037 1.00 0.99 H ATOM 1037 HG23 THR A 72 3.838 -1.754 -2.539 1.00 1.01 H ATOM 1038 N GLY A 73 6.514 -5.335 -4.407 1.00 0.27 N ATOM 1039 CA GLY A 73 7.216 -6.569 -4.609 1.00 0.35 C ATOM 1040 C GLY A 73 6.857 -7.616 -3.582 1.00 0.39 C ATOM 1041 O GLY A 73 7.431 -8.706 -3.574 1.00 0.46 O ATOM 1042 H GLY A 73 5.654 -5.177 -4.865 1.00 0.26 H ATOM 1043 HA2 GLY A 73 6.995 -6.946 -5.593 1.00 0.40 H ATOM 1044 HA3 GLY A 73 8.265 -6.367 -4.538 1.00 0.37 H ATOM 1045 N LEU A 74 5.893 -7.302 -2.734 1.00 0.39 N ATOM 1046 CA LEU A 74 5.543 -8.165 -1.632 1.00 0.45 C ATOM 1047 C LEU A 74 4.385 -9.057 -1.984 1.00 0.62 C ATOM 1048 O LEU A 74 3.290 -8.597 -2.280 1.00 1.10 O ATOM 1049 CB LEU A 74 5.195 -7.337 -0.406 1.00 0.46 C ATOM 1050 CG LEU A 74 5.775 -7.869 0.891 1.00 0.53 C ATOM 1051 CD1 LEU A 74 5.385 -9.320 1.132 1.00 1.12 C ATOM 1052 CD2 LEU A 74 7.279 -7.710 0.833 1.00 0.94 C ATOM 1053 H LEU A 74 5.379 -6.487 -2.868 1.00 0.36 H ATOM 1054 HA LEU A 74 6.391 -8.795 -1.415 1.00 0.46 H ATOM 1055 HB2 LEU A 74 5.571 -6.335 -0.560 1.00 0.45 H ATOM 1056 HB3 LEU A 74 4.124 -7.288 -0.311 1.00 0.56 H ATOM 1057 HG LEU A 74 5.396 -7.291 1.711 1.00 0.94 H ATOM 1058 HD11 LEU A 74 4.309 -9.405 1.140 1.00 1.74 H ATOM 1059 HD12 LEU A 74 5.780 -9.646 2.083 1.00 1.64 H ATOM 1060 HD13 LEU A 74 5.789 -9.937 0.343 1.00 1.61 H ATOM 1061 HD21 LEU A 74 7.622 -8.009 -0.153 1.00 1.57 H ATOM 1062 HD22 LEU A 74 7.740 -8.333 1.583 1.00 1.43 H ATOM 1063 HD23 LEU A 74 7.539 -6.677 1.004 1.00 1.53 H ATOM 1064 N ASP A 75 4.636 -10.335 -1.891 1.00 0.54 N ATOM 1065 CA ASP A 75 3.660 -11.331 -2.259 1.00 0.72 C ATOM 1066 C ASP A 75 3.134 -12.044 -1.019 1.00 0.78 C ATOM 1067 O ASP A 75 3.273 -13.257 -0.868 1.00 0.98 O ATOM 1068 CB ASP A 75 4.307 -12.313 -3.215 1.00 1.04 C ATOM 1069 CG ASP A 75 3.324 -13.307 -3.811 1.00 1.31 C ATOM 1070 OD1 ASP A 75 3.456 -14.521 -3.539 1.00 1.45 O ATOM 1071 OD2 ASP A 75 2.401 -12.876 -4.537 1.00 1.55 O ATOM 1072 H ASP A 75 5.517 -10.623 -1.556 1.00 0.71 H ATOM 1073 HA ASP A 75 2.844 -10.837 -2.759 1.00 0.90 H ATOM 1074 HB2 ASP A 75 4.774 -11.759 -4.017 1.00 1.20 H ATOM 1075 HB3 ASP A 75 5.063 -12.852 -2.674 1.00 1.12 H ATOM 1076 N LEU A 76 2.547 -11.277 -0.118 1.00 0.91 N ATOM 1077 CA LEU A 76 1.939 -11.847 1.075 1.00 1.31 C ATOM 1078 C LEU A 76 0.423 -11.999 0.854 1.00 0.97 C ATOM 1079 O LEU A 76 -0.238 -11.060 0.393 1.00 0.95 O ATOM 1080 CB LEU A 76 2.244 -10.965 2.295 1.00 1.98 C ATOM 1081 CG LEU A 76 1.993 -11.615 3.659 1.00 2.77 C ATOM 1082 CD1 LEU A 76 2.890 -12.829 3.847 1.00 3.54 C ATOM 1083 CD2 LEU A 76 2.237 -10.615 4.775 1.00 3.31 C ATOM 1084 H LEU A 76 2.493 -10.307 -0.272 1.00 0.87 H ATOM 1085 HA LEU A 76 2.371 -12.824 1.227 1.00 1.67 H ATOM 1086 HB2 LEU A 76 3.283 -10.676 2.248 1.00 2.18 H ATOM 1087 HB3 LEU A 76 1.639 -10.076 2.228 1.00 2.29 H ATOM 1088 HG LEU A 76 0.965 -11.942 3.717 1.00 3.11 H ATOM 1089 HD11 LEU A 76 3.924 -12.520 3.817 1.00 3.96 H ATOM 1090 HD12 LEU A 76 2.705 -13.541 3.060 1.00 3.87 H ATOM 1091 HD13 LEU A 76 2.680 -13.286 4.803 1.00 3.94 H ATOM 1092 HD21 LEU A 76 1.939 -11.048 5.718 1.00 3.71 H ATOM 1093 HD22 LEU A 76 1.662 -9.720 4.590 1.00 3.62 H ATOM 1094 HD23 LEU A 76 3.288 -10.366 4.811 1.00 3.63 H ATOM 1095 N PRO A 77 -0.126 -13.201 1.159 1.00 1.11 N ATOM 1096 CA PRO A 77 -1.546 -13.559 0.914 1.00 1.07 C ATOM 1097 C PRO A 77 -2.563 -12.567 1.501 1.00 0.78 C ATOM 1098 O PRO A 77 -2.188 -11.668 2.258 1.00 0.84 O ATOM 1099 CB PRO A 77 -1.681 -14.924 1.602 1.00 1.63 C ATOM 1100 CG PRO A 77 -0.313 -15.492 1.580 1.00 1.97 C ATOM 1101 CD PRO A 77 0.612 -14.328 1.758 1.00 1.67 C ATOM 1102 HA PRO A 77 -1.741 -13.674 -0.141 1.00 1.11 H ATOM 1103 HB2 PRO A 77 -2.037 -14.788 2.611 1.00 1.72 H ATOM 1104 HB3 PRO A 77 -2.370 -15.544 1.051 1.00 1.92 H ATOM 1105 HG2 PRO A 77 -0.192 -16.195 2.390 1.00 2.26 H ATOM 1106 HG3 PRO A 77 -0.131 -15.974 0.632 1.00 2.42 H ATOM 1107 HD2 PRO A 77 0.798 -14.153 2.808 1.00 1.89 H ATOM 1108 HD3 PRO A 77 1.540 -14.505 1.234 1.00 1.89 H ATOM 1109 N PRO A 78 -3.871 -12.718 1.145 1.00 0.60 N ATOM 1110 CA PRO A 78 -4.964 -11.819 1.587 1.00 0.50 C ATOM 1111 C PRO A 78 -5.056 -11.635 3.109 1.00 0.67 C ATOM 1112 O PRO A 78 -4.168 -12.048 3.845 1.00 1.62 O ATOM 1113 CB PRO A 78 -6.232 -12.479 1.028 1.00 0.60 C ATOM 1114 CG PRO A 78 -5.827 -13.863 0.660 1.00 0.76 C ATOM 1115 CD PRO A 78 -4.390 -13.768 0.253 1.00 0.75 C ATOM 1116 HA PRO A 78 -4.854 -10.841 1.137 1.00 0.54 H ATOM 1117 HB2 PRO A 78 -7.003 -12.481 1.783 1.00 0.64 H ATOM 1118 HB3 PRO A 78 -6.569 -11.927 0.157 1.00 0.66 H ATOM 1119 HG2 PRO A 78 -5.934 -14.516 1.513 1.00 0.95 H ATOM 1120 HG3 PRO A 78 -6.429 -14.216 -0.163 1.00 1.20 H ATOM 1121 HD2 PRO A 78 -3.888 -14.707 0.421 1.00 0.99 H ATOM 1122 HD3 PRO A 78 -4.307 -13.471 -0.782 1.00 1.12 H ATOM 1123 N THR A 79 -6.141 -11.001 3.576 1.00 0.55 N ATOM 1124 CA THR A 79 -6.298 -10.559 4.969 1.00 0.40 C ATOM 1125 C THR A 79 -5.239 -9.544 5.397 1.00 0.33 C ATOM 1126 O THR A 79 -5.006 -9.348 6.586 1.00 0.37 O ATOM 1127 CB THR A 79 -6.395 -11.720 5.997 1.00 0.45 C ATOM 1128 OG1 THR A 79 -5.167 -12.452 6.111 1.00 0.52 O ATOM 1129 CG2 THR A 79 -7.520 -12.669 5.616 1.00 0.53 C ATOM 1130 H THR A 79 -6.924 -10.840 3.007 1.00 1.28 H ATOM 1131 HA THR A 79 -7.249 -10.044 5.001 1.00 0.42 H ATOM 1132 HB THR A 79 -6.632 -11.293 6.960 1.00 0.42 H ATOM 1133 HG1 THR A 79 -4.701 -12.435 5.261 1.00 0.95 H ATOM 1134 HG21 THR A 79 -7.552 -13.493 6.314 1.00 1.16 H ATOM 1135 HG22 THR A 79 -7.350 -13.048 4.619 1.00 0.99 H ATOM 1136 HG23 THR A 79 -8.461 -12.138 5.642 1.00 1.28 H ATOM 1137 N LEU A 80 -4.626 -8.866 4.428 1.00 0.32 N ATOM 1138 CA LEU A 80 -3.695 -7.784 4.736 1.00 0.32 C ATOM 1139 C LEU A 80 -4.439 -6.488 5.004 1.00 0.22 C ATOM 1140 O LEU A 80 -4.003 -5.683 5.816 1.00 0.21 O ATOM 1141 CB LEU A 80 -2.684 -7.571 3.609 1.00 0.43 C ATOM 1142 CG LEU A 80 -1.661 -8.690 3.431 1.00 1.21 C ATOM 1143 CD1 LEU A 80 -0.648 -8.309 2.364 1.00 1.91 C ATOM 1144 CD2 LEU A 80 -0.963 -8.993 4.748 1.00 1.97 C ATOM 1145 H LEU A 80 -4.777 -9.119 3.497 1.00 0.36 H ATOM 1146 HA LEU A 80 -3.163 -8.060 5.633 1.00 0.38 H ATOM 1147 HB2 LEU A 80 -3.230 -7.460 2.684 1.00 1.16 H ATOM 1148 HB3 LEU A 80 -2.150 -6.654 3.804 1.00 1.17 H ATOM 1149 HG LEU A 80 -2.169 -9.587 3.106 1.00 1.98 H ATOM 1150 HD11 LEU A 80 0.023 -9.135 2.195 1.00 2.46 H ATOM 1151 HD12 LEU A 80 -0.084 -7.449 2.693 1.00 2.33 H ATOM 1152 HD13 LEU A 80 -1.165 -8.070 1.446 1.00 2.39 H ATOM 1153 HD21 LEU A 80 -1.694 -9.286 5.486 1.00 2.26 H ATOM 1154 HD22 LEU A 80 -0.438 -8.113 5.089 1.00 2.53 H ATOM 1155 HD23 LEU A 80 -0.260 -9.799 4.603 1.00 2.52 H ATOM 1156 N ILE A 81 -5.557 -6.284 4.318 1.00 0.18 N ATOM 1157 CA ILE A 81 -6.404 -5.120 4.586 1.00 0.13 C ATOM 1158 C ILE A 81 -7.062 -5.290 5.942 1.00 0.15 C ATOM 1159 O ILE A 81 -7.278 -4.337 6.685 1.00 0.16 O ATOM 1160 CB ILE A 81 -7.498 -4.928 3.507 1.00 0.12 C ATOM 1161 CG1 ILE A 81 -6.885 -4.819 2.129 1.00 0.13 C ATOM 1162 CG2 ILE A 81 -8.302 -3.675 3.755 1.00 0.13 C ATOM 1163 CD1 ILE A 81 -5.739 -3.857 2.076 1.00 0.13 C ATOM 1164 H ILE A 81 -5.811 -6.920 3.615 1.00 0.20 H ATOM 1165 HA ILE A 81 -5.776 -4.241 4.608 1.00 0.13 H ATOM 1166 HB ILE A 81 -8.164 -5.774 3.536 1.00 0.14 H ATOM 1167 HG12 ILE A 81 -6.534 -5.773 1.808 1.00 0.15 H ATOM 1168 HG13 ILE A 81 -7.643 -4.467 1.448 1.00 0.13 H ATOM 1169 HG21 ILE A 81 -9.182 -3.685 3.131 1.00 0.98 H ATOM 1170 HG22 ILE A 81 -7.696 -2.815 3.491 1.00 1.03 H ATOM 1171 HG23 ILE A 81 -8.586 -3.618 4.792 1.00 1.01 H ATOM 1172 HD11 ILE A 81 -5.017 -4.111 2.840 1.00 1.02 H ATOM 1173 HD12 ILE A 81 -6.108 -2.857 2.249 1.00 1.04 H ATOM 1174 HD13 ILE A 81 -5.273 -3.912 1.106 1.00 1.01 H ATOM 1175 N PHE A 82 -7.377 -6.531 6.242 1.00 0.20 N ATOM 1176 CA PHE A 82 -7.964 -6.905 7.507 1.00 0.25 C ATOM 1177 C PHE A 82 -6.946 -6.768 8.641 1.00 0.25 C ATOM 1178 O PHE A 82 -7.306 -6.489 9.787 1.00 0.30 O ATOM 1179 CB PHE A 82 -8.481 -8.340 7.396 1.00 0.32 C ATOM 1180 CG PHE A 82 -9.563 -8.511 6.356 1.00 0.36 C ATOM 1181 CD1 PHE A 82 -10.867 -8.767 6.745 1.00 0.46 C ATOM 1182 CD2 PHE A 82 -9.283 -8.406 4.996 1.00 0.34 C ATOM 1183 CE1 PHE A 82 -11.869 -8.917 5.806 1.00 0.52 C ATOM 1184 CE2 PHE A 82 -10.282 -8.556 4.056 1.00 0.40 C ATOM 1185 CZ PHE A 82 -11.575 -8.812 4.460 1.00 0.49 C ATOM 1186 H PHE A 82 -7.247 -7.223 5.569 1.00 0.21 H ATOM 1187 HA PHE A 82 -8.796 -6.246 7.699 1.00 0.28 H ATOM 1188 HB2 PHE A 82 -7.662 -8.992 7.131 1.00 0.33 H ATOM 1189 HB3 PHE A 82 -8.882 -8.643 8.345 1.00 0.35 H ATOM 1190 HD1 PHE A 82 -11.099 -8.850 7.794 1.00 0.49 H ATOM 1191 HD2 PHE A 82 -8.272 -8.204 4.671 1.00 0.30 H ATOM 1192 HE1 PHE A 82 -12.880 -9.117 6.125 1.00 0.61 H ATOM 1193 HE2 PHE A 82 -10.051 -8.473 3.006 1.00 0.40 H ATOM 1194 HZ PHE A 82 -12.357 -8.928 3.723 1.00 0.55 H ATOM 1195 N ASP A 83 -5.675 -6.957 8.309 1.00 0.23 N ATOM 1196 CA ASP A 83 -4.588 -6.832 9.282 1.00 0.25 C ATOM 1197 C ASP A 83 -4.105 -5.384 9.367 1.00 0.24 C ATOM 1198 O ASP A 83 -3.678 -4.913 10.419 1.00 0.38 O ATOM 1199 CB ASP A 83 -3.429 -7.751 8.880 1.00 0.29 C ATOM 1200 CG ASP A 83 -2.349 -7.849 9.939 1.00 0.34 C ATOM 1201 OD1 ASP A 83 -2.687 -8.125 11.110 1.00 0.48 O ATOM 1202 OD2 ASP A 83 -1.164 -7.635 9.613 1.00 0.47 O ATOM 1203 H ASP A 83 -5.459 -7.199 7.386 1.00 0.23 H ATOM 1204 HA ASP A 83 -4.964 -7.136 10.247 1.00 0.28 H ATOM 1205 HB2 ASP A 83 -3.811 -8.741 8.695 1.00 0.33 H ATOM 1206 HB3 ASP A 83 -2.980 -7.372 7.973 1.00 0.28 H ATOM 1207 N HIS A 84 -4.181 -4.691 8.243 1.00 0.14 N ATOM 1208 CA HIS A 84 -3.778 -3.293 8.144 1.00 0.12 C ATOM 1209 C HIS A 84 -4.884 -2.509 7.454 1.00 0.11 C ATOM 1210 O HIS A 84 -4.891 -2.376 6.233 1.00 0.14 O ATOM 1211 CB HIS A 84 -2.477 -3.164 7.349 1.00 0.14 C ATOM 1212 CG HIS A 84 -1.265 -3.656 8.081 1.00 0.19 C ATOM 1213 ND1 HIS A 84 -0.417 -2.831 8.787 1.00 0.22 N ATOM 1214 CD2 HIS A 84 -0.757 -4.903 8.205 1.00 0.25 C ATOM 1215 CE1 HIS A 84 0.559 -3.548 9.309 1.00 0.27 C ATOM 1216 NE2 HIS A 84 0.378 -4.808 8.972 1.00 0.29 N ATOM 1217 H HIS A 84 -4.536 -5.130 7.438 1.00 0.21 H ATOM 1218 HA HIS A 84 -3.634 -2.906 9.142 1.00 0.13 H ATOM 1219 HB2 HIS A 84 -2.570 -3.741 6.445 1.00 0.16 H ATOM 1220 HB3 HIS A 84 -2.322 -2.130 7.085 1.00 0.14 H ATOM 1221 HD1 HIS A 84 -0.518 -1.858 8.902 1.00 0.24 H ATOM 1222 HD2 HIS A 84 -1.177 -5.810 7.789 1.00 0.30 H ATOM 1223 HE1 HIS A 84 1.367 -3.166 9.914 1.00 0.32 H ATOM 1224 HE2 HIS A 84 0.836 -5.571 9.396 1.00 0.33 H ATOM 1225 N PRO A 85 -5.832 -1.976 8.231 1.00 0.10 N ATOM 1226 CA PRO A 85 -7.096 -1.477 7.698 1.00 0.09 C ATOM 1227 C PRO A 85 -7.082 -0.032 7.205 1.00 0.08 C ATOM 1228 O PRO A 85 -8.136 0.502 6.876 1.00 0.09 O ATOM 1229 CB PRO A 85 -8.021 -1.609 8.903 1.00 0.12 C ATOM 1230 CG PRO A 85 -7.138 -1.333 10.073 1.00 0.14 C ATOM 1231 CD PRO A 85 -5.765 -1.837 9.699 1.00 0.13 C ATOM 1232 HA PRO A 85 -7.456 -2.111 6.903 1.00 0.10 H ATOM 1233 HB2 PRO A 85 -8.820 -0.887 8.829 1.00 0.15 H ATOM 1234 HB3 PRO A 85 -8.428 -2.608 8.944 1.00 0.16 H ATOM 1235 HG2 PRO A 85 -7.105 -0.269 10.262 1.00 0.15 H ATOM 1236 HG3 PRO A 85 -7.507 -1.858 10.942 1.00 0.17 H ATOM 1237 HD2 PRO A 85 -5.009 -1.120 9.983 1.00 0.14 H ATOM 1238 HD3 PRO A 85 -5.576 -2.791 10.168 1.00 0.16 H ATOM 1239 N THR A 86 -5.930 0.615 7.139 1.00 0.07 N ATOM 1240 CA THR A 86 -5.881 1.971 6.610 1.00 0.07 C ATOM 1241 C THR A 86 -4.764 2.098 5.577 1.00 0.07 C ATOM 1242 O THR A 86 -3.820 1.309 5.607 1.00 0.07 O ATOM 1243 CB THR A 86 -5.662 3.018 7.720 1.00 0.08 C ATOM 1244 OG1 THR A 86 -4.386 2.822 8.337 1.00 0.09 O ATOM 1245 CG2 THR A 86 -6.752 2.950 8.781 1.00 0.09 C ATOM 1246 H THR A 86 -5.097 0.192 7.426 1.00 0.07 H ATOM 1247 HA THR A 86 -6.822 2.171 6.132 1.00 0.07 H ATOM 1248 HB THR A 86 -5.689 3.998 7.267 1.00 0.09 H ATOM 1249 HG1 THR A 86 -4.493 2.813 9.297 1.00 0.27 H ATOM 1250 HG21 THR A 86 -6.806 1.947 9.176 1.00 0.96 H ATOM 1251 HG22 THR A 86 -7.701 3.216 8.341 1.00 0.99 H ATOM 1252 HG23 THR A 86 -6.521 3.638 9.579 1.00 1.00 H ATOM 1253 N PRO A 87 -4.850 3.057 4.628 1.00 0.08 N ATOM 1254 CA PRO A 87 -3.756 3.306 3.684 1.00 0.09 C ATOM 1255 C PRO A 87 -2.443 3.568 4.413 1.00 0.09 C ATOM 1256 O PRO A 87 -1.372 3.204 3.931 1.00 0.11 O ATOM 1257 CB PRO A 87 -4.213 4.531 2.894 1.00 0.09 C ATOM 1258 CG PRO A 87 -5.698 4.531 3.024 1.00 0.09 C ATOM 1259 CD PRO A 87 -6.008 3.928 4.371 1.00 0.08 C ATOM 1260 HA PRO A 87 -3.627 2.480 3.015 1.00 0.10 H ATOM 1261 HB2 PRO A 87 -3.774 5.422 3.311 1.00 0.09 H ATOM 1262 HB3 PRO A 87 -3.911 4.427 1.862 1.00 0.11 H ATOM 1263 HG2 PRO A 87 -6.071 5.543 2.971 1.00 0.10 H ATOM 1264 HG3 PRO A 87 -6.132 3.930 2.239 1.00 0.10 H ATOM 1265 HD2 PRO A 87 -6.086 4.701 5.122 1.00 0.08 H ATOM 1266 HD3 PRO A 87 -6.921 3.355 4.322 1.00 0.08 H ATOM 1267 N HIS A 88 -2.544 4.179 5.589 1.00 0.09 N ATOM 1268 CA HIS A 88 -1.398 4.352 6.472 1.00 0.09 C ATOM 1269 C HIS A 88 -0.897 2.989 6.935 1.00 0.08 C ATOM 1270 O HIS A 88 0.288 2.693 6.838 1.00 0.09 O ATOM 1271 CB HIS A 88 -1.801 5.215 7.671 1.00 0.12 C ATOM 1272 CG HIS A 88 -0.678 5.541 8.606 1.00 0.19 C ATOM 1273 ND1 HIS A 88 0.416 6.295 8.241 1.00 0.28 N ATOM 1274 CD2 HIS A 88 -0.492 5.217 9.904 1.00 0.23 C ATOM 1275 CE1 HIS A 88 1.226 6.418 9.275 1.00 0.33 C ATOM 1276 NE2 HIS A 88 0.698 5.775 10.296 1.00 0.30 N ATOM 1277 H HIS A 88 -3.422 4.519 5.875 1.00 0.09 H ATOM 1278 HA HIS A 88 -0.610 4.846 5.924 1.00 0.11 H ATOM 1279 HB2 HIS A 88 -2.214 6.143 7.313 1.00 0.13 H ATOM 1280 HB3 HIS A 88 -2.559 4.691 8.236 1.00 0.12 H ATOM 1281 HD1 HIS A 88 0.575 6.693 7.357 1.00 0.34 H ATOM 1282 HD2 HIS A 88 -1.160 4.628 10.517 1.00 0.27 H ATOM 1283 HE1 HIS A 88 2.163 6.954 9.282 1.00 0.42 H ATOM 1284 HE2 HIS A 88 0.992 5.872 11.232 1.00 0.36 H ATOM 1285 N ALA A 89 -1.818 2.166 7.423 1.00 0.09 N ATOM 1286 CA ALA A 89 -1.501 0.822 7.897 1.00 0.10 C ATOM 1287 C ALA A 89 -0.838 -0.038 6.828 1.00 0.09 C ATOM 1288 O ALA A 89 0.231 -0.598 7.064 1.00 0.10 O ATOM 1289 CB ALA A 89 -2.759 0.142 8.391 1.00 0.12 C ATOM 1290 H ALA A 89 -2.747 2.485 7.497 1.00 0.09 H ATOM 1291 HA ALA A 89 -0.825 0.916 8.732 1.00 0.10 H ATOM 1292 HB1 ALA A 89 -3.212 0.739 9.170 1.00 1.03 H ATOM 1293 HB2 ALA A 89 -2.508 -0.835 8.780 1.00 1.03 H ATOM 1294 HB3 ALA A 89 -3.452 0.035 7.567 1.00 1.03 H ATOM 1295 N LEU A 90 -1.488 -0.190 5.675 1.00 0.10 N ATOM 1296 CA LEU A 90 -0.919 -0.963 4.570 1.00 0.11 C ATOM 1297 C LEU A 90 0.451 -0.446 4.215 1.00 0.11 C ATOM 1298 O LEU A 90 1.376 -1.219 3.954 1.00 0.12 O ATOM 1299 CB LEU A 90 -1.800 -0.866 3.336 1.00 0.13 C ATOM 1300 CG LEU A 90 -2.149 -2.192 2.666 1.00 0.25 C ATOM 1301 CD1 LEU A 90 -2.793 -3.144 3.656 1.00 0.73 C ATOM 1302 CD2 LEU A 90 -3.075 -1.952 1.491 1.00 0.68 C ATOM 1303 H LEU A 90 -2.391 0.192 5.564 1.00 0.10 H ATOM 1304 HA LEU A 90 -0.843 -1.993 4.878 1.00 0.12 H ATOM 1305 HB2 LEU A 90 -2.704 -0.359 3.604 1.00 0.27 H ATOM 1306 HB3 LEU A 90 -1.283 -0.262 2.611 1.00 0.25 H ATOM 1307 HG LEU A 90 -1.247 -2.653 2.294 1.00 0.83 H ATOM 1308 HD11 LEU A 90 -3.005 -4.082 3.165 1.00 1.27 H ATOM 1309 HD12 LEU A 90 -3.716 -2.714 4.019 1.00 1.34 H ATOM 1310 HD13 LEU A 90 -2.123 -3.313 4.482 1.00 1.41 H ATOM 1311 HD21 LEU A 90 -3.295 -2.893 1.007 1.00 1.37 H ATOM 1312 HD22 LEU A 90 -2.601 -1.286 0.785 1.00 1.25 H ATOM 1313 HD23 LEU A 90 -3.998 -1.510 1.844 1.00 1.32 H ATOM 1314 N THR A 91 0.562 0.866 4.200 1.00 0.11 N ATOM 1315 CA THR A 91 1.818 1.510 3.931 1.00 0.12 C ATOM 1316 C THR A 91 2.862 1.071 4.949 1.00 0.12 C ATOM 1317 O THR A 91 3.966 0.668 4.590 1.00 0.13 O ATOM 1318 CB THR A 91 1.669 3.044 3.962 1.00 0.12 C ATOM 1319 OG1 THR A 91 1.015 3.499 2.774 1.00 0.13 O ATOM 1320 CG2 THR A 91 3.012 3.735 4.126 1.00 0.13 C ATOM 1321 H THR A 91 -0.230 1.418 4.373 1.00 0.11 H ATOM 1322 HA THR A 91 2.121 1.201 2.944 1.00 0.14 H ATOM 1323 HB THR A 91 1.051 3.302 4.811 1.00 0.10 H ATOM 1324 HG1 THR A 91 0.059 3.434 2.895 1.00 0.13 H ATOM 1325 HG21 THR A 91 2.923 4.772 3.839 1.00 1.01 H ATOM 1326 HG22 THR A 91 3.747 3.247 3.506 1.00 1.00 H ATOM 1327 HG23 THR A 91 3.320 3.675 5.159 1.00 1.03 H ATOM 1328 N GLN A 92 2.482 1.137 6.221 1.00 0.11 N ATOM 1329 CA GLN A 92 3.330 0.694 7.314 1.00 0.12 C ATOM 1330 C GLN A 92 3.813 -0.732 7.079 1.00 0.13 C ATOM 1331 O GLN A 92 4.980 -1.046 7.292 1.00 0.16 O ATOM 1332 CB GLN A 92 2.558 0.775 8.632 1.00 0.12 C ATOM 1333 CG GLN A 92 2.225 2.190 9.071 1.00 0.16 C ATOM 1334 CD GLN A 92 1.946 2.272 10.559 1.00 0.47 C ATOM 1335 OE1 GLN A 92 1.436 1.325 11.159 1.00 1.42 O ATOM 1336 NE2 GLN A 92 2.304 3.388 11.173 1.00 1.06 N ATOM 1337 H GLN A 92 1.594 1.505 6.431 1.00 0.12 H ATOM 1338 HA GLN A 92 4.185 1.347 7.361 1.00 0.13 H ATOM 1339 HB2 GLN A 92 1.629 0.237 8.516 1.00 0.14 H ATOM 1340 HB3 GLN A 92 3.134 0.306 9.409 1.00 0.13 H ATOM 1341 HG2 GLN A 92 3.045 2.844 8.824 1.00 0.29 H ATOM 1342 HG3 GLN A 92 1.341 2.515 8.540 1.00 0.26 H ATOM 1343 HE21 GLN A 92 2.727 4.095 10.642 1.00 1.80 H ATOM 1344 HE22 GLN A 92 2.130 3.463 12.136 1.00 1.13 H ATOM 1345 N HIS A 93 2.904 -1.578 6.610 1.00 0.14 N ATOM 1346 CA HIS A 93 3.221 -2.967 6.301 1.00 0.17 C ATOM 1347 C HIS A 93 4.378 -3.062 5.308 1.00 0.19 C ATOM 1348 O HIS A 93 5.380 -3.707 5.586 1.00 0.21 O ATOM 1349 CB HIS A 93 1.974 -3.675 5.749 1.00 0.20 C ATOM 1350 CG HIS A 93 2.234 -5.032 5.159 1.00 0.27 C ATOM 1351 ND1 HIS A 93 2.454 -6.160 5.916 1.00 0.31 N ATOM 1352 CD2 HIS A 93 2.307 -5.433 3.865 1.00 0.36 C ATOM 1353 CE1 HIS A 93 2.652 -7.192 5.121 1.00 0.38 C ATOM 1354 NE2 HIS A 93 2.568 -6.779 3.872 1.00 0.41 N ATOM 1355 H HIS A 93 1.987 -1.254 6.470 1.00 0.16 H ATOM 1356 HA HIS A 93 3.520 -3.449 7.221 1.00 0.18 H ATOM 1357 HB2 HIS A 93 1.261 -3.798 6.548 1.00 0.20 H ATOM 1358 HB3 HIS A 93 1.536 -3.057 4.978 1.00 0.23 H ATOM 1359 HD1 HIS A 93 2.460 -6.203 6.903 1.00 0.32 H ATOM 1360 HD2 HIS A 93 2.181 -4.806 2.989 1.00 0.42 H ATOM 1361 HE1 HIS A 93 2.852 -8.204 5.440 1.00 0.44 H ATOM 1362 HE2 HIS A 93 2.759 -7.328 3.082 1.00 0.59 H ATOM 1363 N LEU A 94 4.248 -2.411 4.163 1.00 0.18 N ATOM 1364 CA LEU A 94 5.251 -2.518 3.106 1.00 0.21 C ATOM 1365 C LEU A 94 6.477 -1.668 3.409 1.00 0.22 C ATOM 1366 O LEU A 94 7.558 -1.932 2.903 1.00 0.31 O ATOM 1367 CB LEU A 94 4.629 -2.090 1.784 1.00 0.19 C ATOM 1368 CG LEU A 94 3.363 -2.857 1.408 1.00 0.21 C ATOM 1369 CD1 LEU A 94 2.573 -2.111 0.357 1.00 0.21 C ATOM 1370 CD2 LEU A 94 3.712 -4.253 0.911 1.00 0.27 C ATOM 1371 H LEU A 94 3.461 -1.832 4.017 1.00 0.18 H ATOM 1372 HA LEU A 94 5.559 -3.560 3.038 1.00 0.25 H ATOM 1373 HB2 LEU A 94 4.387 -1.038 1.846 1.00 0.17 H ATOM 1374 HB3 LEU A 94 5.358 -2.230 1.004 1.00 0.21 H ATOM 1375 HG LEU A 94 2.738 -2.952 2.283 1.00 0.22 H ATOM 1376 HD11 LEU A 94 2.585 -1.058 0.587 1.00 1.07 H ATOM 1377 HD12 LEU A 94 1.556 -2.468 0.364 1.00 1.01 H ATOM 1378 HD13 LEU A 94 3.011 -2.281 -0.620 1.00 1.03 H ATOM 1379 HD21 LEU A 94 4.304 -4.764 1.655 1.00 1.09 H ATOM 1380 HD22 LEU A 94 4.277 -4.179 -0.014 1.00 1.02 H ATOM 1381 HD23 LEU A 94 2.805 -4.808 0.730 1.00 1.04 H ATOM 1382 N HIS A 95 6.309 -0.670 4.260 1.00 0.18 N ATOM 1383 CA HIS A 95 7.413 0.200 4.662 1.00 0.20 C ATOM 1384 C HIS A 95 8.268 -0.530 5.677 1.00 0.26 C ATOM 1385 O HIS A 95 9.451 -0.246 5.848 1.00 0.39 O ATOM 1386 CB HIS A 95 6.856 1.495 5.272 1.00 0.20 C ATOM 1387 CG HIS A 95 7.891 2.491 5.696 1.00 0.25 C ATOM 1388 ND1 HIS A 95 8.363 2.568 6.988 1.00 0.37 N ATOM 1389 CD2 HIS A 95 8.521 3.478 5.009 1.00 0.26 C ATOM 1390 CE1 HIS A 95 9.231 3.554 7.080 1.00 0.43 C ATOM 1391 NE2 HIS A 95 9.346 4.124 5.895 1.00 0.36 N ATOM 1392 H HIS A 95 5.426 -0.533 4.669 1.00 0.16 H ATOM 1393 HA HIS A 95 8.014 0.426 3.790 1.00 0.23 H ATOM 1394 HB2 HIS A 95 6.217 1.975 4.550 1.00 0.19 H ATOM 1395 HB3 HIS A 95 6.269 1.241 6.142 1.00 0.24 H ATOM 1396 HD1 HIS A 95 8.102 1.979 7.735 1.00 0.42 H ATOM 1397 HD2 HIS A 95 8.382 3.731 3.959 1.00 0.24 H ATOM 1398 HE1 HIS A 95 9.759 3.846 7.974 1.00 0.53 H ATOM 1399 HE2 HIS A 95 9.758 5.002 5.741 1.00 0.54 H ATOM 1400 N THR A 96 7.650 -1.488 6.334 1.00 0.22 N ATOM 1401 CA THR A 96 8.315 -2.315 7.297 1.00 0.27 C ATOM 1402 C THR A 96 8.846 -3.575 6.609 1.00 0.32 C ATOM 1403 O THR A 96 10.017 -3.929 6.747 1.00 0.40 O ATOM 1404 CB THR A 96 7.321 -2.673 8.425 1.00 0.35 C ATOM 1405 OG1 THR A 96 7.383 -1.698 9.476 1.00 0.62 O ATOM 1406 CG2 THR A 96 7.562 -4.059 8.974 1.00 0.31 C ATOM 1407 H THR A 96 6.707 -1.677 6.145 1.00 0.24 H ATOM 1408 HA THR A 96 9.138 -1.761 7.720 1.00 0.36 H ATOM 1409 HB THR A 96 6.324 -2.648 8.004 1.00 0.49 H ATOM 1410 HG1 THR A 96 8.244 -1.255 9.452 1.00 1.27 H ATOM 1411 HG21 THR A 96 8.552 -4.111 9.398 1.00 1.05 H ATOM 1412 HG22 THR A 96 7.473 -4.770 8.167 1.00 1.08 H ATOM 1413 HG23 THR A 96 6.827 -4.278 9.732 1.00 1.00 H ATOM 1414 N ARG A 97 7.987 -4.214 5.822 1.00 0.34 N ATOM 1415 CA ARG A 97 8.318 -5.475 5.172 1.00 0.45 C ATOM 1416 C ARG A 97 9.342 -5.305 4.069 1.00 0.57 C ATOM 1417 O ARG A 97 10.020 -6.260 3.694 1.00 0.67 O ATOM 1418 CB ARG A 97 7.061 -6.126 4.619 1.00 0.58 C ATOM 1419 CG ARG A 97 6.221 -6.756 5.703 1.00 1.52 C ATOM 1420 CD ARG A 97 7.055 -7.684 6.571 1.00 2.27 C ATOM 1421 NE ARG A 97 6.348 -8.917 6.904 1.00 3.09 N ATOM 1422 CZ ARG A 97 6.810 -10.137 6.628 1.00 3.77 C ATOM 1423 NH1 ARG A 97 7.982 -10.289 6.021 1.00 3.78 N ATOM 1424 NH2 ARG A 97 6.102 -11.205 6.967 1.00 4.68 N ATOM 1425 H ARG A 97 7.090 -3.835 5.683 1.00 0.32 H ATOM 1426 HA ARG A 97 8.729 -6.119 5.928 1.00 0.43 H ATOM 1427 HB2 ARG A 97 6.468 -5.372 4.122 1.00 0.92 H ATOM 1428 HB3 ARG A 97 7.334 -6.884 3.905 1.00 0.76 H ATOM 1429 HG2 ARG A 97 5.828 -5.965 6.317 1.00 1.69 H ATOM 1430 HG3 ARG A 97 5.413 -7.313 5.253 1.00 1.86 H ATOM 1431 HD2 ARG A 97 7.964 -7.926 6.044 1.00 2.47 H ATOM 1432 HD3 ARG A 97 7.303 -7.166 7.486 1.00 2.48 H ATOM 1433 HE ARG A 97 5.480 -8.830 7.365 1.00 3.36 H ATOM 1434 HH11 ARG A 97 8.533 -9.487 5.773 1.00 3.41 H ATOM 1435 HH12 ARG A 97 8.320 -11.205 5.797 1.00 4.35 H ATOM 1436 HH21 ARG A 97 5.219 -11.099 7.435 1.00 4.96 H ATOM 1437 HH22 ARG A 97 6.445 -12.126 6.761 1.00 5.19 H ATOM 1438 N LEU A 98 9.421 -4.100 3.534 1.00 0.62 N ATOM 1439 CA LEU A 98 10.428 -3.764 2.550 1.00 0.78 C ATOM 1440 C LEU A 98 11.826 -4.191 2.993 1.00 0.92 C ATOM 1441 O LEU A 98 12.660 -4.576 2.173 1.00 1.19 O ATOM 1442 CB LEU A 98 10.405 -2.288 2.268 1.00 0.78 C ATOM 1443 CG LEU A 98 11.051 -1.933 0.945 1.00 0.68 C ATOM 1444 CD1 LEU A 98 10.597 -2.914 -0.121 1.00 1.14 C ATOM 1445 CD2 LEU A 98 10.659 -0.548 0.561 1.00 1.00 C ATOM 1446 H LEU A 98 8.745 -3.431 3.766 1.00 0.61 H ATOM 1447 HA LEU A 98 10.183 -4.266 1.635 1.00 0.89 H ATOM 1448 HB2 LEU A 98 9.373 -1.962 2.247 1.00 1.00 H ATOM 1449 HB3 LEU A 98 10.915 -1.771 3.060 1.00 0.89 H ATOM 1450 HG LEU A 98 12.126 -1.983 1.031 1.00 1.13 H ATOM 1451 HD11 LEU A 98 9.535 -3.095 -0.003 1.00 1.73 H ATOM 1452 HD12 LEU A 98 11.135 -3.844 -0.009 1.00 1.70 H ATOM 1453 HD13 LEU A 98 10.785 -2.500 -1.099 1.00 1.50 H ATOM 1454 HD21 LEU A 98 11.022 0.146 1.300 1.00 1.44 H ATOM 1455 HD22 LEU A 98 9.582 -0.499 0.516 1.00 1.56 H ATOM 1456 HD23 LEU A 98 11.075 -0.309 -0.404 1.00 1.66 H ATOM 1457 N THR A 99 12.079 -4.113 4.287 1.00 0.85 N ATOM 1458 CA THR A 99 13.340 -4.569 4.835 1.00 1.08 C ATOM 1459 C THR A 99 13.136 -5.852 5.644 1.00 1.13 C ATOM 1460 O THR A 99 13.938 -6.781 5.560 1.00 1.66 O ATOM 1461 CB THR A 99 14.013 -3.473 5.698 1.00 1.19 C ATOM 1462 OG1 THR A 99 15.200 -3.980 6.324 1.00 1.61 O ATOM 1463 CG2 THR A 99 13.059 -2.931 6.752 1.00 1.07 C ATOM 1464 H THR A 99 11.399 -3.742 4.887 1.00 0.74 H ATOM 1465 HA THR A 99 13.995 -4.791 4.003 1.00 1.25 H ATOM 1466 HB THR A 99 14.288 -2.660 5.048 1.00 1.39 H ATOM 1467 HG1 THR A 99 15.828 -4.257 5.638 1.00 1.79 H ATOM 1468 HG21 THR A 99 13.554 -2.160 7.325 1.00 1.39 H ATOM 1469 HG22 THR A 99 12.758 -3.731 7.411 1.00 1.56 H ATOM 1470 HG23 THR A 99 12.186 -2.515 6.265 1.00 1.45 H ATOM 1471 N GLN A 100 12.048 -5.900 6.412 1.00 0.75 N ATOM 1472 CA GLN A 100 11.719 -7.068 7.216 1.00 0.85 C ATOM 1473 C GLN A 100 11.294 -8.231 6.335 1.00 1.01 C ATOM 1474 O GLN A 100 10.112 -8.399 6.024 1.00 1.19 O ATOM 1475 CB GLN A 100 10.621 -6.725 8.212 1.00 0.77 C ATOM 1476 CG GLN A 100 11.024 -5.641 9.195 1.00 0.81 C ATOM 1477 CD GLN A 100 12.077 -6.107 10.180 1.00 1.52 C ATOM 1478 OE1 GLN A 100 11.760 -6.622 11.254 1.00 2.10 O ATOM 1479 NE2 GLN A 100 13.339 -5.929 9.827 1.00 2.19 N ATOM 1480 H GLN A 100 11.473 -5.108 6.467 1.00 0.67 H ATOM 1481 HA GLN A 100 12.603 -7.351 7.760 1.00 0.97 H ATOM 1482 HB2 GLN A 100 9.756 -6.388 7.668 1.00 1.04 H ATOM 1483 HB3 GLN A 100 10.365 -7.612 8.770 1.00 1.03 H ATOM 1484 HG2 GLN A 100 11.421 -4.800 8.638 1.00 0.94 H ATOM 1485 HG3 GLN A 100 10.147 -5.329 9.741 1.00 0.98 H ATOM 1486 HE21 GLN A 100 13.523 -5.514 8.960 1.00 2.50 H ATOM 1487 HE22 GLN A 100 14.042 -6.219 10.449 1.00 2.66 H ATOM 1488 N SER A 101 12.274 -9.019 5.939 1.00 1.26 N ATOM 1489 CA SER A 101 12.059 -10.155 5.070 1.00 1.48 C ATOM 1490 C SER A 101 13.318 -11.008 5.041 1.00 1.84 C ATOM 1491 O SER A 101 14.232 -10.791 5.838 1.00 2.05 O ATOM 1492 CB SER A 101 11.698 -9.672 3.662 1.00 1.64 C ATOM 1493 OG SER A 101 12.674 -8.767 3.161 1.00 2.32 O ATOM 1494 H SER A 101 13.190 -8.830 6.249 1.00 1.44 H ATOM 1495 HA SER A 101 11.243 -10.738 5.469 1.00 1.52 H ATOM 1496 HB2 SER A 101 11.635 -10.520 2.997 1.00 2.00 H ATOM 1497 HB3 SER A 101 10.745 -9.169 3.697 1.00 1.72 H ATOM 1498 HG SER A 101 13.158 -8.379 3.901 1.00 2.64 H ATOM 1499 N HIS A 102 13.372 -11.970 4.141 1.00 2.10 N ATOM 1500 CA HIS A 102 14.560 -12.792 4.002 1.00 2.55 C ATOM 1501 C HIS A 102 15.497 -12.184 2.969 1.00 2.90 C ATOM 1502 O HIS A 102 16.467 -11.510 3.372 1.00 3.23 O ATOM 1503 CB HIS A 102 14.193 -14.228 3.634 1.00 2.94 C ATOM 1504 CG HIS A 102 13.701 -15.035 4.797 1.00 3.11 C ATOM 1505 ND1 HIS A 102 14.262 -16.239 5.168 1.00 3.76 N ATOM 1506 CD2 HIS A 102 12.697 -14.807 5.676 1.00 3.06 C ATOM 1507 CE1 HIS A 102 13.625 -16.713 6.223 1.00 4.18 C ATOM 1508 NE2 HIS A 102 12.672 -15.863 6.550 1.00 3.79 N ATOM 1509 OXT HIS A 102 15.242 -12.349 1.761 1.00 3.31 O ATOM 1510 H HIS A 102 12.608 -12.120 3.544 1.00 2.08 H ATOM 1511 HA HIS A 102 15.059 -12.799 4.954 1.00 2.65 H ATOM 1512 HB2 HIS A 102 13.421 -14.209 2.893 1.00 3.36 H ATOM 1513 HB3 HIS A 102 15.057 -14.721 3.226 1.00 3.21 H ATOM 1514 HD1 HIS A 102 15.015 -16.684 4.721 1.00 4.00 H ATOM 1515 HD2 HIS A 102 12.042 -13.948 5.689 1.00 2.70 H ATOM 1516 HE1 HIS A 102 13.847 -17.639 6.733 1.00 4.86 H ATOM 1517 HE2 HIS A 102 11.973 -16.028 7.222 1.00 4.07 H TER 1518 HIS A 102