ATOM 1 N GLY A 1 3.662 -10.208 -11.326 1.00 4.47 N ATOM 2 CA GLY A 1 4.949 -9.711 -10.783 1.00 3.97 C ATOM 3 C GLY A 1 5.665 -8.811 -11.768 1.00 3.37 C ATOM 4 O GLY A 1 5.152 -8.547 -12.858 1.00 3.50 O ATOM 5 H1 GLY A 1 3.034 -9.410 -11.549 1.00 4.73 H ATOM 6 H2 GLY A 1 3.190 -10.822 -10.631 1.00 4.85 H ATOM 7 H3 GLY A 1 3.830 -10.754 -12.194 1.00 4.60 H ATOM 8 HA2 GLY A 1 4.757 -9.156 -9.879 1.00 4.22 H ATOM 9 HA3 GLY A 1 5.581 -10.555 -10.553 1.00 4.13 H ATOM 10 N ALA A 2 6.847 -8.343 -11.389 1.00 3.02 N ATOM 11 CA ALA A 2 7.637 -7.461 -12.237 1.00 2.58 C ATOM 12 C ALA A 2 9.121 -7.600 -11.914 1.00 2.13 C ATOM 13 O ALA A 2 9.833 -6.600 -11.790 1.00 2.41 O ATOM 14 CB ALA A 2 7.187 -6.017 -12.063 1.00 2.87 C ATOM 15 H ALA A 2 7.207 -8.603 -10.510 1.00 3.29 H ATOM 16 HA ALA A 2 7.472 -7.748 -13.266 1.00 2.69 H ATOM 17 HB1 ALA A 2 6.136 -5.938 -12.295 1.00 3.11 H ATOM 18 HB2 ALA A 2 7.751 -5.382 -12.730 1.00 3.07 H ATOM 19 HB3 ALA A 2 7.355 -5.708 -11.043 1.00 3.20 H ATOM 20 N ALA A 3 9.565 -8.850 -11.770 1.00 1.91 N ATOM 21 CA ALA A 3 10.955 -9.183 -11.431 1.00 1.62 C ATOM 22 C ALA A 3 11.268 -8.822 -9.981 1.00 1.42 C ATOM 23 O ALA A 3 11.533 -9.697 -9.159 1.00 1.97 O ATOM 24 CB ALA A 3 11.941 -8.517 -12.387 1.00 1.64 C ATOM 25 H ALA A 3 8.927 -9.586 -11.885 1.00 2.26 H ATOM 26 HA ALA A 3 11.063 -10.253 -11.542 1.00 1.83 H ATOM 27 HB1 ALA A 3 12.944 -8.844 -12.157 1.00 1.93 H ATOM 28 HB2 ALA A 3 11.879 -7.444 -12.276 1.00 1.98 H ATOM 29 HB3 ALA A 3 11.698 -8.789 -13.403 1.00 1.96 H ATOM 30 N SER A 4 11.209 -7.535 -9.676 1.00 0.96 N ATOM 31 CA SER A 4 11.431 -7.041 -8.330 1.00 0.76 C ATOM 32 C SER A 4 11.183 -5.546 -8.289 1.00 0.67 C ATOM 33 O SER A 4 12.111 -4.743 -8.361 1.00 0.72 O ATOM 34 CB SER A 4 12.846 -7.347 -7.830 1.00 0.82 C ATOM 35 OG SER A 4 12.979 -7.027 -6.453 1.00 1.73 O ATOM 36 H SER A 4 10.970 -6.893 -10.383 1.00 1.17 H ATOM 37 HA SER A 4 10.719 -7.524 -7.679 1.00 0.82 H ATOM 38 HB2 SER A 4 13.059 -8.396 -7.967 1.00 1.13 H ATOM 39 HB3 SER A 4 13.555 -6.759 -8.388 1.00 1.14 H ATOM 40 HG SER A 4 13.141 -7.834 -5.949 1.00 2.10 H ATOM 41 N ALA A 5 9.921 -5.170 -8.194 1.00 0.62 N ATOM 42 CA ALA A 5 9.569 -3.775 -8.014 1.00 0.56 C ATOM 43 C ALA A 5 9.785 -3.380 -6.563 1.00 0.49 C ATOM 44 O ALA A 5 9.576 -2.238 -6.179 1.00 0.45 O ATOM 45 CB ALA A 5 8.137 -3.523 -8.442 1.00 0.59 C ATOM 46 H ALA A 5 9.211 -5.847 -8.252 1.00 0.64 H ATOM 47 HA ALA A 5 10.224 -3.181 -8.638 1.00 0.57 H ATOM 48 HB1 ALA A 5 7.469 -4.104 -7.824 1.00 1.20 H ATOM 49 HB2 ALA A 5 8.013 -3.810 -9.475 1.00 1.10 H ATOM 50 HB3 ALA A 5 7.907 -2.473 -8.331 1.00 1.23 H ATOM 51 N ALA A 6 10.232 -4.343 -5.768 1.00 0.50 N ATOM 52 CA ALA A 6 10.600 -4.096 -4.386 1.00 0.46 C ATOM 53 C ALA A 6 11.853 -3.254 -4.336 1.00 0.48 C ATOM 54 O ALA A 6 11.866 -2.182 -3.739 1.00 0.56 O ATOM 55 CB ALA A 6 10.814 -5.414 -3.664 1.00 0.51 C ATOM 56 H ALA A 6 10.333 -5.247 -6.126 1.00 0.55 H ATOM 57 HA ALA A 6 9.798 -3.557 -3.902 1.00 0.42 H ATOM 58 HB1 ALA A 6 9.877 -5.947 -3.611 1.00 1.19 H ATOM 59 HB2 ALA A 6 11.180 -5.223 -2.666 1.00 1.07 H ATOM 60 HB3 ALA A 6 11.537 -6.008 -4.210 1.00 1.15 H ATOM 61 N THR A 7 12.913 -3.738 -4.970 1.00 0.52 N ATOM 62 CA THR A 7 14.130 -2.962 -5.108 1.00 0.52 C ATOM 63 C THR A 7 13.921 -1.716 -5.978 1.00 0.50 C ATOM 64 O THR A 7 14.837 -0.911 -6.138 1.00 0.51 O ATOM 65 CB THR A 7 15.272 -3.830 -5.676 1.00 0.61 C ATOM 66 OG1 THR A 7 16.495 -3.083 -5.743 1.00 0.64 O ATOM 67 CG2 THR A 7 14.923 -4.368 -7.054 1.00 0.69 C ATOM 68 H THR A 7 12.918 -4.669 -5.279 1.00 0.65 H ATOM 69 HA THR A 7 14.424 -2.646 -4.119 1.00 0.49 H ATOM 70 HB THR A 7 15.415 -4.663 -5.008 1.00 0.64 H ATOM 71 HG1 THR A 7 16.398 -2.364 -6.385 1.00 0.92 H ATOM 72 HG21 THR A 7 14.017 -4.958 -6.993 1.00 1.24 H ATOM 73 HG22 THR A 7 15.731 -4.986 -7.415 1.00 1.17 H ATOM 74 HG23 THR A 7 14.768 -3.544 -7.735 1.00 1.27 H ATOM 75 N ASP A 8 12.717 -1.537 -6.521 1.00 0.49 N ATOM 76 CA ASP A 8 12.382 -0.314 -7.235 1.00 0.48 C ATOM 77 C ASP A 8 11.622 0.600 -6.311 1.00 0.40 C ATOM 78 O ASP A 8 11.718 1.821 -6.381 1.00 0.40 O ATOM 79 CB ASP A 8 11.493 -0.583 -8.431 1.00 0.54 C ATOM 80 CG ASP A 8 12.224 -0.480 -9.754 1.00 0.64 C ATOM 81 OD1 ASP A 8 13.016 -1.386 -10.078 1.00 0.75 O ATOM 82 OD2 ASP A 8 11.999 0.508 -10.489 1.00 0.73 O ATOM 83 H ASP A 8 12.005 -2.200 -6.408 1.00 0.50 H ATOM 84 HA ASP A 8 13.289 0.159 -7.556 1.00 0.51 H ATOM 85 HB2 ASP A 8 11.077 -1.571 -8.341 1.00 0.57 H ATOM 86 HB3 ASP A 8 10.690 0.146 -8.417 1.00 0.56 H ATOM 87 N LEU A 9 10.824 -0.012 -5.464 1.00 0.36 N ATOM 88 CA LEU A 9 10.061 0.716 -4.488 1.00 0.30 C ATOM 89 C LEU A 9 10.993 1.298 -3.461 1.00 0.28 C ATOM 90 O LEU A 9 11.022 2.501 -3.220 1.00 0.26 O ATOM 91 CB LEU A 9 9.093 -0.189 -3.765 1.00 0.29 C ATOM 92 CG LEU A 9 8.477 0.463 -2.539 1.00 0.25 C ATOM 93 CD1 LEU A 9 7.460 1.512 -2.951 1.00 0.24 C ATOM 94 CD2 LEU A 9 7.891 -0.588 -1.625 1.00 0.26 C ATOM 95 H LEU A 9 10.756 -0.990 -5.494 1.00 0.38 H ATOM 96 HA LEU A 9 9.527 1.498 -4.998 1.00 0.30 H ATOM 97 HB2 LEU A 9 8.315 -0.473 -4.448 1.00 0.30 H ATOM 98 HB3 LEU A 9 9.614 -1.079 -3.447 1.00 0.31 H ATOM 99 HG LEU A 9 9.259 0.971 -1.993 1.00 0.26 H ATOM 100 HD11 LEU A 9 7.942 2.234 -3.611 1.00 1.04 H ATOM 101 HD12 LEU A 9 7.091 2.018 -2.072 1.00 1.06 H ATOM 102 HD13 LEU A 9 6.639 1.034 -3.468 1.00 1.05 H ATOM 103 HD21 LEU A 9 8.649 -1.322 -1.394 1.00 1.04 H ATOM 104 HD22 LEU A 9 7.063 -1.071 -2.112 1.00 1.07 H ATOM 105 HD23 LEU A 9 7.554 -0.124 -0.714 1.00 1.02 H ATOM 106 N ALA A 10 11.762 0.401 -2.870 1.00 0.31 N ATOM 107 CA ALA A 10 12.801 0.772 -1.918 1.00 0.32 C ATOM 108 C ALA A 10 13.867 1.630 -2.592 1.00 0.35 C ATOM 109 O ALA A 10 14.824 2.055 -1.954 1.00 0.39 O ATOM 110 CB ALA A 10 13.414 -0.473 -1.293 1.00 0.42 C ATOM 111 H ALA A 10 11.599 -0.560 -3.083 1.00 0.33 H ATOM 112 HA ALA A 10 12.342 1.356 -1.131 1.00 0.29 H ATOM 113 HB1 ALA A 10 13.896 -1.061 -2.060 1.00 1.10 H ATOM 114 HB2 ALA A 10 12.635 -1.059 -0.825 1.00 1.12 H ATOM 115 HB3 ALA A 10 14.140 -0.183 -0.550 1.00 1.07 H ATOM 116 N ALA A 11 13.676 1.892 -3.882 1.00 0.36 N ATOM 117 CA ALA A 11 14.502 2.822 -4.614 1.00 0.41 C ATOM 118 C ALA A 11 13.942 4.228 -4.460 1.00 0.39 C ATOM 119 O ALA A 11 14.701 5.183 -4.312 1.00 0.44 O ATOM 120 CB ALA A 11 14.569 2.432 -6.072 1.00 0.51 C ATOM 121 H ALA A 11 12.930 1.465 -4.345 1.00 0.35 H ATOM 122 HA ALA A 11 15.494 2.787 -4.202 1.00 0.42 H ATOM 123 HB1 ALA A 11 15.068 1.480 -6.162 1.00 1.03 H ATOM 124 HB2 ALA A 11 15.113 3.184 -6.621 1.00 1.26 H ATOM 125 HB3 ALA A 11 13.561 2.349 -6.461 1.00 1.10 H ATOM 126 N ARG A 12 12.605 4.360 -4.473 1.00 0.36 N ATOM 127 CA ARG A 12 11.964 5.634 -4.172 1.00 0.41 C ATOM 128 C ARG A 12 12.274 6.030 -2.741 1.00 0.34 C ATOM 129 O ARG A 12 12.390 7.206 -2.407 1.00 0.38 O ATOM 130 CB ARG A 12 10.446 5.511 -4.304 1.00 0.54 C ATOM 131 CG ARG A 12 9.888 5.625 -5.704 1.00 0.68 C ATOM 132 CD ARG A 12 9.920 4.298 -6.427 1.00 0.64 C ATOM 133 NE ARG A 12 8.806 4.170 -7.368 1.00 1.29 N ATOM 134 CZ ARG A 12 8.434 3.023 -7.938 1.00 1.49 C ATOM 135 NH1 ARG A 12 9.126 1.917 -7.715 1.00 1.30 N ATOM 136 NH2 ARG A 12 7.379 2.987 -8.742 1.00 2.35 N ATOM 137 H ARG A 12 12.012 3.595 -4.683 1.00 0.34 H ATOM 138 HA ARG A 12 12.333 6.383 -4.851 1.00 0.52 H ATOM 139 HB2 ARG A 12 10.168 4.543 -3.935 1.00 1.07 H ATOM 140 HB3 ARG A 12 9.981 6.265 -3.692 1.00 1.19 H ATOM 141 HG2 ARG A 12 8.863 5.957 -5.640 1.00 1.24 H ATOM 142 HG3 ARG A 12 10.472 6.340 -6.252 1.00 1.09 H ATOM 143 HD2 ARG A 12 10.852 4.216 -6.966 1.00 1.06 H ATOM 144 HD3 ARG A 12 9.857 3.510 -5.693 1.00 0.99 H ATOM 145 HE ARG A 12 8.294 4.988 -7.569 1.00 1.91 H ATOM 146 HH11 ARG A 12 9.934 1.939 -7.123 1.00 1.32 H ATOM 147 HH12 ARG A 12 8.840 1.049 -8.135 1.00 1.63 H ATOM 148 HH21 ARG A 12 6.854 3.824 -8.928 1.00 2.93 H ATOM 149 HH22 ARG A 12 7.100 2.124 -9.171 1.00 2.53 H ATOM 150 N LEU A 13 12.391 5.012 -1.909 1.00 0.29 N ATOM 151 CA LEU A 13 12.575 5.183 -0.479 1.00 0.28 C ATOM 152 C LEU A 13 14.029 5.434 -0.164 1.00 0.31 C ATOM 153 O LEU A 13 14.368 6.155 0.770 1.00 0.33 O ATOM 154 CB LEU A 13 12.094 3.930 0.247 1.00 0.27 C ATOM 155 CG LEU A 13 10.574 3.794 0.435 1.00 0.27 C ATOM 156 CD1 LEU A 13 9.821 4.111 -0.836 1.00 0.74 C ATOM 157 CD2 LEU A 13 10.227 2.404 0.923 1.00 0.70 C ATOM 158 H LEU A 13 12.345 4.103 -2.277 1.00 0.29 H ATOM 159 HA LEU A 13 11.994 6.024 -0.160 1.00 0.30 H ATOM 160 HB2 LEU A 13 12.443 3.078 -0.311 1.00 0.29 H ATOM 161 HB3 LEU A 13 12.556 3.907 1.222 1.00 0.31 H ATOM 162 HG LEU A 13 10.248 4.493 1.179 1.00 0.78 H ATOM 163 HD11 LEU A 13 9.784 5.186 -0.964 1.00 1.40 H ATOM 164 HD12 LEU A 13 8.817 3.719 -0.772 1.00 1.35 H ATOM 165 HD13 LEU A 13 10.338 3.668 -1.678 1.00 1.33 H ATOM 166 HD21 LEU A 13 10.722 2.219 1.865 1.00 1.35 H ATOM 167 HD22 LEU A 13 10.553 1.675 0.196 1.00 1.33 H ATOM 168 HD23 LEU A 13 9.159 2.326 1.058 1.00 1.33 H ATOM 169 N ASN A 14 14.872 4.798 -0.939 1.00 0.35 N ATOM 170 CA ASN A 14 16.315 4.949 -0.840 1.00 0.41 C ATOM 171 C ASN A 14 16.733 6.410 -0.900 1.00 0.43 C ATOM 172 O ASN A 14 16.381 7.134 -1.835 1.00 0.84 O ATOM 173 CB ASN A 14 16.947 4.165 -1.980 1.00 0.52 C ATOM 174 CG ASN A 14 17.909 3.095 -1.510 1.00 0.81 C ATOM 175 OD1 ASN A 14 18.650 3.283 -0.546 1.00 1.39 O ATOM 176 ND2 ASN A 14 17.868 1.943 -2.165 1.00 0.65 N ATOM 177 H ASN A 14 14.530 4.164 -1.601 1.00 0.35 H ATOM 178 HA ASN A 14 16.638 4.529 0.098 1.00 0.46 H ATOM 179 HB2 ASN A 14 16.153 3.682 -2.535 1.00 0.39 H ATOM 180 HB3 ASN A 14 17.476 4.846 -2.631 1.00 0.78 H ATOM 181 HD21 ASN A 14 17.220 1.850 -2.900 1.00 0.61 H ATOM 182 HD22 ASN A 14 18.488 1.235 -1.899 1.00 0.90 H ATOM 183 N GLY A 15 17.476 6.832 0.111 1.00 0.48 N ATOM 184 CA GLY A 15 17.912 8.210 0.196 1.00 0.49 C ATOM 185 C GLY A 15 16.960 9.069 1.003 1.00 0.46 C ATOM 186 O GLY A 15 17.281 10.205 1.353 1.00 0.56 O ATOM 187 H GLY A 15 17.750 6.193 0.803 1.00 0.80 H ATOM 188 HA2 GLY A 15 18.886 8.238 0.657 1.00 0.54 H ATOM 189 HA3 GLY A 15 17.983 8.616 -0.802 1.00 0.50 H ATOM 190 N LEU A 16 15.787 8.530 1.303 1.00 0.38 N ATOM 191 CA LEU A 16 14.764 9.282 2.011 1.00 0.35 C ATOM 192 C LEU A 16 14.701 8.903 3.481 1.00 0.35 C ATOM 193 O LEU A 16 15.244 7.881 3.903 1.00 0.37 O ATOM 194 CB LEU A 16 13.390 9.062 1.369 1.00 0.32 C ATOM 195 CG LEU A 16 13.083 9.920 0.147 1.00 0.35 C ATOM 196 CD1 LEU A 16 13.252 11.376 0.505 1.00 0.94 C ATOM 197 CD2 LEU A 16 13.970 9.550 -1.031 1.00 0.82 C ATOM 198 H LEU A 16 15.603 7.601 1.040 1.00 0.37 H ATOM 199 HA LEU A 16 15.017 10.327 1.936 1.00 0.37 H ATOM 200 HB2 LEU A 16 13.315 8.032 1.078 1.00 0.32 H ATOM 201 HB3 LEU A 16 12.635 9.259 2.115 1.00 0.30 H ATOM 202 HG LEU A 16 12.054 9.767 -0.143 1.00 0.68 H ATOM 203 HD11 LEU A 16 14.302 11.591 0.631 1.00 1.56 H ATOM 204 HD12 LEU A 16 12.728 11.573 1.437 1.00 1.48 H ATOM 205 HD13 LEU A 16 12.845 11.993 -0.280 1.00 1.45 H ATOM 206 HD21 LEU A 16 13.724 10.176 -1.877 1.00 1.36 H ATOM 207 HD22 LEU A 16 13.809 8.514 -1.290 1.00 1.32 H ATOM 208 HD23 LEU A 16 15.005 9.697 -0.762 1.00 1.49 H ATOM 209 N SER A 17 14.033 9.749 4.248 1.00 0.35 N ATOM 210 CA SER A 17 13.800 9.509 5.659 1.00 0.37 C ATOM 211 C SER A 17 12.601 8.591 5.822 1.00 0.33 C ATOM 212 O SER A 17 11.786 8.496 4.911 1.00 0.31 O ATOM 213 CB SER A 17 13.555 10.846 6.359 1.00 0.39 C ATOM 214 OG SER A 17 12.411 11.497 5.833 1.00 1.08 O ATOM 215 H SER A 17 13.678 10.569 3.849 1.00 0.34 H ATOM 216 HA SER A 17 14.670 9.028 6.084 1.00 0.40 H ATOM 217 HB2 SER A 17 13.408 10.682 7.412 1.00 0.76 H ATOM 218 HB3 SER A 17 14.408 11.483 6.205 1.00 0.85 H ATOM 219 HG SER A 17 11.928 11.928 6.553 1.00 1.50 H ATOM 220 N PRO A 18 12.477 7.904 6.964 1.00 0.36 N ATOM 221 CA PRO A 18 11.410 6.920 7.193 1.00 0.35 C ATOM 222 C PRO A 18 10.028 7.436 6.789 1.00 0.31 C ATOM 223 O PRO A 18 9.274 6.739 6.109 1.00 0.29 O ATOM 224 CB PRO A 18 11.496 6.678 8.697 1.00 0.39 C ATOM 225 CG PRO A 18 12.938 6.887 9.005 1.00 0.42 C ATOM 226 CD PRO A 18 13.370 8.024 8.131 1.00 0.45 C ATOM 227 HA PRO A 18 11.610 5.997 6.669 1.00 0.34 H ATOM 228 HB2 PRO A 18 10.870 7.389 9.218 1.00 0.40 H ATOM 229 HB3 PRO A 18 11.184 5.670 8.926 1.00 0.40 H ATOM 230 HG2 PRO A 18 13.065 7.137 10.047 1.00 0.49 H ATOM 231 HG3 PRO A 18 13.501 6.002 8.755 1.00 0.47 H ATOM 232 HD2 PRO A 18 13.224 8.966 8.637 1.00 0.55 H ATOM 233 HD3 PRO A 18 14.403 7.906 7.840 1.00 0.54 H ATOM 234 N GLN A 19 9.734 8.674 7.161 1.00 0.32 N ATOM 235 CA GLN A 19 8.448 9.290 6.853 1.00 0.32 C ATOM 236 C GLN A 19 8.339 9.648 5.370 1.00 0.29 C ATOM 237 O GLN A 19 7.255 9.602 4.799 1.00 0.28 O ATOM 238 CB GLN A 19 8.236 10.531 7.705 1.00 0.36 C ATOM 239 CG GLN A 19 6.834 11.077 7.574 1.00 0.71 C ATOM 240 CD GLN A 19 6.646 12.421 8.252 1.00 1.28 C ATOM 241 OE1 GLN A 19 5.557 12.736 8.734 1.00 2.00 O ATOM 242 NE2 GLN A 19 7.695 13.226 8.294 1.00 2.04 N ATOM 243 H GLN A 19 10.415 9.183 7.656 1.00 0.35 H ATOM 244 HA GLN A 19 7.663 8.580 7.080 1.00 0.34 H ATOM 245 HB2 GLN A 19 8.418 10.285 8.741 1.00 0.63 H ATOM 246 HB3 GLN A 19 8.930 11.292 7.392 1.00 0.56 H ATOM 247 HG2 GLN A 19 6.615 11.174 6.525 1.00 1.29 H ATOM 248 HG3 GLN A 19 6.148 10.368 8.016 1.00 1.30 H ATOM 249 HE21 GLN A 19 8.535 12.919 7.889 1.00 2.37 H ATOM 250 HE22 GLN A 19 7.591 14.103 8.724 1.00 2.62 H ATOM 251 N GLN A 20 9.460 9.968 4.737 1.00 0.28 N ATOM 252 CA GLN A 20 9.462 10.273 3.308 1.00 0.27 C ATOM 253 C GLN A 20 9.328 8.986 2.515 1.00 0.24 C ATOM 254 O GLN A 20 8.568 8.902 1.550 1.00 0.23 O ATOM 255 CB GLN A 20 10.738 10.999 2.903 1.00 0.30 C ATOM 256 CG GLN A 20 10.791 12.430 3.406 1.00 0.37 C ATOM 257 CD GLN A 20 11.966 13.218 2.868 1.00 0.95 C ATOM 258 OE1 GLN A 20 11.874 13.855 1.818 1.00 1.78 O ATOM 259 NE2 GLN A 20 13.071 13.194 3.592 1.00 1.68 N ATOM 260 H GLN A 20 10.310 9.948 5.220 1.00 0.30 H ATOM 261 HA GLN A 20 8.612 10.907 3.101 1.00 0.28 H ATOM 262 HB2 GLN A 20 11.589 10.455 3.309 1.00 0.30 H ATOM 263 HB3 GLN A 20 10.809 11.011 1.825 1.00 0.31 H ATOM 264 HG2 GLN A 20 9.881 12.935 3.126 1.00 0.89 H ATOM 265 HG3 GLN A 20 10.869 12.402 4.475 1.00 0.94 H ATOM 266 HE21 GLN A 20 13.065 12.676 4.430 1.00 2.08 H ATOM 267 HE22 GLN A 20 13.850 13.697 3.269 1.00 2.22 H ATOM 268 N GLN A 21 10.085 7.987 2.944 1.00 0.24 N ATOM 269 CA GLN A 21 9.960 6.631 2.436 1.00 0.22 C ATOM 270 C GLN A 21 8.527 6.154 2.582 1.00 0.21 C ATOM 271 O GLN A 21 8.015 5.390 1.766 1.00 0.25 O ATOM 272 CB GLN A 21 10.882 5.706 3.234 1.00 0.25 C ATOM 273 CG GLN A 21 12.355 6.036 3.101 1.00 0.28 C ATOM 274 CD GLN A 21 13.216 5.216 4.043 1.00 0.35 C ATOM 275 OE1 GLN A 21 13.456 5.606 5.182 1.00 1.22 O ATOM 276 NE2 GLN A 21 13.687 4.073 3.578 1.00 1.06 N ATOM 277 H GLN A 21 10.783 8.171 3.614 1.00 0.25 H ATOM 278 HA GLN A 21 10.240 6.626 1.393 1.00 0.22 H ATOM 279 HB2 GLN A 21 10.619 5.776 4.279 1.00 0.28 H ATOM 280 HB3 GLN A 21 10.732 4.689 2.907 1.00 0.25 H ATOM 281 HG2 GLN A 21 12.661 5.829 2.087 1.00 0.28 H ATOM 282 HG3 GLN A 21 12.503 7.089 3.313 1.00 0.30 H ATOM 283 HE21 GLN A 21 13.462 3.817 2.661 1.00 1.83 H ATOM 284 HE22 GLN A 21 14.245 3.528 4.172 1.00 1.07 H ATOM 285 N GLN A 22 7.895 6.614 3.645 1.00 0.21 N ATOM 286 CA GLN A 22 6.522 6.299 3.928 1.00 0.21 C ATOM 287 C GLN A 22 5.632 6.954 2.895 1.00 0.18 C ATOM 288 O GLN A 22 4.850 6.289 2.239 1.00 0.17 O ATOM 289 CB GLN A 22 6.185 6.827 5.301 1.00 0.27 C ATOM 290 CG GLN A 22 5.271 5.948 6.100 1.00 0.46 C ATOM 291 CD GLN A 22 5.004 6.471 7.498 1.00 0.92 C ATOM 292 OE1 GLN A 22 4.784 5.697 8.429 1.00 1.56 O ATOM 293 NE2 GLN A 22 5.005 7.786 7.653 1.00 1.60 N ATOM 294 H GLN A 22 8.373 7.205 4.265 1.00 0.24 H ATOM 295 HA GLN A 22 6.389 5.238 3.902 1.00 0.22 H ATOM 296 HB2 GLN A 22 7.086 6.978 5.848 1.00 0.45 H ATOM 297 HB3 GLN A 22 5.702 7.763 5.172 1.00 0.37 H ATOM 298 HG2 GLN A 22 4.353 5.908 5.578 1.00 0.58 H ATOM 299 HG3 GLN A 22 5.699 4.959 6.169 1.00 0.62 H ATOM 300 HE21 GLN A 22 5.177 8.345 6.869 1.00 2.14 H ATOM 301 HE22 GLN A 22 4.830 8.147 8.549 1.00 1.88 H ATOM 302 N GLN A 23 5.791 8.266 2.771 1.00 0.19 N ATOM 303 CA GLN A 23 5.057 9.097 1.804 1.00 0.18 C ATOM 304 C GLN A 23 4.894 8.453 0.435 1.00 0.15 C ATOM 305 O GLN A 23 3.824 8.523 -0.154 1.00 0.15 O ATOM 306 CB GLN A 23 5.773 10.407 1.632 1.00 0.20 C ATOM 307 CG GLN A 23 5.718 11.268 2.876 1.00 0.24 C ATOM 308 CD GLN A 23 6.660 12.458 2.838 1.00 0.30 C ATOM 309 OE1 GLN A 23 7.135 12.913 3.878 1.00 1.05 O ATOM 310 NE2 GLN A 23 6.943 12.970 1.651 1.00 1.24 N ATOM 311 H GLN A 23 6.424 8.712 3.386 1.00 0.22 H ATOM 312 HA GLN A 23 4.090 9.299 2.212 1.00 0.19 H ATOM 313 HB2 GLN A 23 6.797 10.190 1.397 1.00 0.20 H ATOM 314 HB3 GLN A 23 5.324 10.950 0.815 1.00 0.22 H ATOM 315 HG2 GLN A 23 4.713 11.629 2.996 1.00 0.27 H ATOM 316 HG3 GLN A 23 5.971 10.651 3.722 1.00 0.25 H ATOM 317 HE21 GLN A 23 6.536 12.561 0.856 1.00 2.00 H ATOM 318 HE22 GLN A 23 7.547 13.743 1.614 1.00 1.29 H ATOM 319 N THR A 24 5.955 7.858 -0.078 1.00 0.15 N ATOM 320 CA THR A 24 5.905 7.168 -1.356 1.00 0.14 C ATOM 321 C THR A 24 4.823 6.091 -1.360 1.00 0.12 C ATOM 322 O THR A 24 3.998 6.031 -2.269 1.00 0.12 O ATOM 323 CB THR A 24 7.279 6.554 -1.644 1.00 0.16 C ATOM 324 OG1 THR A 24 8.188 7.573 -2.078 1.00 0.19 O ATOM 325 CG2 THR A 24 7.192 5.445 -2.677 1.00 0.17 C ATOM 326 H THR A 24 6.805 7.867 0.417 1.00 0.18 H ATOM 327 HA THR A 24 5.676 7.887 -2.136 1.00 0.14 H ATOM 328 HB THR A 24 7.652 6.142 -0.716 1.00 0.18 H ATOM 329 HG1 THR A 24 7.700 8.394 -2.225 1.00 0.62 H ATOM 330 HG21 THR A 24 8.153 4.957 -2.756 1.00 1.00 H ATOM 331 HG22 THR A 24 6.918 5.863 -3.633 1.00 1.00 H ATOM 332 HG23 THR A 24 6.445 4.725 -2.370 1.00 1.01 H ATOM 333 N LEU A 25 4.797 5.278 -0.318 1.00 0.12 N ATOM 334 CA LEU A 25 3.762 4.266 -0.176 1.00 0.11 C ATOM 335 C LEU A 25 2.472 4.951 0.203 1.00 0.11 C ATOM 336 O LEU A 25 1.407 4.628 -0.287 1.00 0.10 O ATOM 337 CB LEU A 25 4.132 3.290 0.917 1.00 0.12 C ATOM 338 CG LEU A 25 5.428 2.528 0.715 1.00 0.14 C ATOM 339 CD1 LEU A 25 6.095 2.307 2.056 1.00 0.32 C ATOM 340 CD2 LEU A 25 5.149 1.203 0.031 1.00 0.39 C ATOM 341 H LEU A 25 5.458 5.396 0.403 1.00 0.13 H ATOM 342 HA LEU A 25 3.640 3.744 -1.113 1.00 0.11 H ATOM 343 HB2 LEU A 25 4.210 3.846 1.831 1.00 0.15 H ATOM 344 HB3 LEU A 25 3.330 2.574 1.019 1.00 0.15 H ATOM 345 HG LEU A 25 6.093 3.105 0.090 1.00 0.23 H ATOM 346 HD11 LEU A 25 7.060 1.844 1.911 1.00 1.04 H ATOM 347 HD12 LEU A 25 5.473 1.665 2.664 1.00 1.10 H ATOM 348 HD13 LEU A 25 6.220 3.261 2.552 1.00 1.10 H ATOM 349 HD21 LEU A 25 6.052 0.619 -0.001 1.00 1.15 H ATOM 350 HD22 LEU A 25 4.800 1.383 -0.975 1.00 1.10 H ATOM 351 HD23 LEU A 25 4.392 0.665 0.582 1.00 1.10 H ATOM 352 N ALA A 26 2.602 5.947 1.051 1.00 0.12 N ATOM 353 CA ALA A 26 1.478 6.721 1.536 1.00 0.13 C ATOM 354 C ALA A 26 0.925 7.625 0.434 1.00 0.13 C ATOM 355 O ALA A 26 0.118 8.519 0.677 1.00 0.16 O ATOM 356 CB ALA A 26 1.935 7.523 2.744 1.00 0.16 C ATOM 357 H ALA A 26 3.504 6.171 1.377 1.00 0.14 H ATOM 358 HA ALA A 26 0.705 6.032 1.844 1.00 0.14 H ATOM 359 HB1 ALA A 26 2.371 6.851 3.472 1.00 1.07 H ATOM 360 HB2 ALA A 26 1.095 8.040 3.180 1.00 0.98 H ATOM 361 HB3 ALA A 26 2.685 8.240 2.434 1.00 1.02 H ATOM 362 N THR A 27 1.399 7.375 -0.769 1.00 0.12 N ATOM 363 CA THR A 27 0.925 8.015 -1.966 1.00 0.12 C ATOM 364 C THR A 27 0.524 6.935 -2.966 1.00 0.11 C ATOM 365 O THR A 27 -0.553 6.971 -3.540 1.00 0.11 O ATOM 366 CB THR A 27 2.026 8.921 -2.560 1.00 0.15 C ATOM 367 OG1 THR A 27 2.051 10.184 -1.880 1.00 0.20 O ATOM 368 CG2 THR A 27 1.847 9.131 -4.053 1.00 0.15 C ATOM 369 H THR A 27 2.108 6.709 -0.858 1.00 0.11 H ATOM 370 HA THR A 27 0.063 8.614 -1.715 1.00 0.14 H ATOM 371 HB THR A 27 2.978 8.433 -2.402 1.00 0.16 H ATOM 372 HG1 THR A 27 1.457 10.150 -1.121 1.00 0.61 H ATOM 373 HG21 THR A 27 2.683 9.698 -4.435 1.00 0.99 H ATOM 374 HG22 THR A 27 0.929 9.667 -4.235 1.00 1.02 H ATOM 375 HG23 THR A 27 1.811 8.166 -4.544 1.00 0.99 H ATOM 376 N LEU A 28 1.406 5.957 -3.120 1.00 0.09 N ATOM 377 CA LEU A 28 1.217 4.837 -4.014 1.00 0.09 C ATOM 378 C LEU A 28 0.129 3.902 -3.531 1.00 0.08 C ATOM 379 O LEU A 28 -0.701 3.447 -4.304 1.00 0.08 O ATOM 380 CB LEU A 28 2.513 4.061 -4.114 1.00 0.10 C ATOM 381 CG LEU A 28 2.326 2.600 -4.481 1.00 0.11 C ATOM 382 CD1 LEU A 28 2.416 2.396 -5.978 1.00 0.42 C ATOM 383 CD2 LEU A 28 3.303 1.728 -3.721 1.00 0.49 C ATOM 384 H LEU A 28 2.233 5.994 -2.617 1.00 0.10 H ATOM 385 HA LEU A 28 0.957 5.214 -4.972 1.00 0.10 H ATOM 386 HB2 LEU A 28 3.143 4.537 -4.852 1.00 0.12 H ATOM 387 HB3 LEU A 28 3.005 4.108 -3.164 1.00 0.10 H ATOM 388 HG LEU A 28 1.334 2.312 -4.176 1.00 0.41 H ATOM 389 HD11 LEU A 28 2.244 1.351 -6.211 1.00 1.17 H ATOM 390 HD12 LEU A 28 3.398 2.683 -6.320 1.00 1.10 H ATOM 391 HD13 LEU A 28 1.669 3.001 -6.469 1.00 1.13 H ATOM 392 HD21 LEU A 28 3.346 0.750 -4.179 1.00 1.15 H ATOM 393 HD22 LEU A 28 2.960 1.634 -2.695 1.00 1.17 H ATOM 394 HD23 LEU A 28 4.281 2.184 -3.735 1.00 1.17 H ATOM 395 N VAL A 29 0.167 3.601 -2.257 1.00 0.08 N ATOM 396 CA VAL A 29 -0.798 2.710 -1.643 1.00 0.09 C ATOM 397 C VAL A 29 -2.174 3.336 -1.702 1.00 0.08 C ATOM 398 O VAL A 29 -3.197 2.666 -1.864 1.00 0.09 O ATOM 399 CB VAL A 29 -0.420 2.415 -0.181 1.00 0.10 C ATOM 400 CG1 VAL A 29 -1.565 1.740 0.555 1.00 0.11 C ATOM 401 CG2 VAL A 29 0.835 1.561 -0.140 1.00 0.10 C ATOM 402 H VAL A 29 0.865 4.011 -1.697 1.00 0.08 H ATOM 403 HA VAL A 29 -0.797 1.789 -2.196 1.00 0.09 H ATOM 404 HB VAL A 29 -0.202 3.358 0.309 1.00 0.10 H ATOM 405 HG11 VAL A 29 -1.734 0.760 0.137 1.00 1.02 H ATOM 406 HG12 VAL A 29 -2.461 2.337 0.441 1.00 0.99 H ATOM 407 HG13 VAL A 29 -1.320 1.652 1.602 1.00 1.04 H ATOM 408 HG21 VAL A 29 1.605 2.033 -0.736 1.00 0.92 H ATOM 409 HG22 VAL A 29 0.618 0.583 -0.540 1.00 0.94 H ATOM 410 HG23 VAL A 29 1.174 1.469 0.880 1.00 0.94 H ATOM 411 N ALA A 30 -2.178 4.641 -1.597 1.00 0.08 N ATOM 412 CA ALA A 30 -3.389 5.402 -1.707 1.00 0.08 C ATOM 413 C ALA A 30 -3.785 5.545 -3.154 1.00 0.09 C ATOM 414 O ALA A 30 -4.952 5.622 -3.477 1.00 0.10 O ATOM 415 CB ALA A 30 -3.187 6.751 -1.090 1.00 0.08 C ATOM 416 H ALA A 30 -1.334 5.112 -1.441 1.00 0.09 H ATOM 417 HA ALA A 30 -4.167 4.888 -1.173 1.00 0.09 H ATOM 418 HB1 ALA A 30 -2.971 6.631 -0.042 1.00 1.01 H ATOM 419 HB2 ALA A 30 -4.080 7.335 -1.219 1.00 1.00 H ATOM 420 HB3 ALA A 30 -2.359 7.237 -1.579 1.00 1.00 H ATOM 421 N ALA A 31 -2.787 5.599 -4.010 1.00 0.08 N ATOM 422 CA ALA A 31 -2.988 5.613 -5.445 1.00 0.09 C ATOM 423 C ALA A 31 -3.614 4.296 -5.856 1.00 0.09 C ATOM 424 O ALA A 31 -4.510 4.234 -6.697 1.00 0.11 O ATOM 425 CB ALA A 31 -1.649 5.830 -6.132 1.00 0.10 C ATOM 426 H ALA A 31 -1.878 5.651 -3.658 1.00 0.08 H ATOM 427 HA ALA A 31 -3.652 6.429 -5.696 1.00 0.09 H ATOM 428 HB1 ALA A 31 -1.760 5.707 -7.199 1.00 1.03 H ATOM 429 HB2 ALA A 31 -0.930 5.114 -5.749 1.00 1.00 H ATOM 430 HB3 ALA A 31 -1.296 6.828 -5.917 1.00 0.99 H ATOM 431 N ALA A 32 -3.120 3.252 -5.223 1.00 0.09 N ATOM 432 CA ALA A 32 -3.678 1.923 -5.323 1.00 0.10 C ATOM 433 C ALA A 32 -5.145 1.912 -4.906 1.00 0.09 C ATOM 434 O ALA A 32 -5.999 1.400 -5.629 1.00 0.10 O ATOM 435 CB ALA A 32 -2.868 0.994 -4.443 1.00 0.12 C ATOM 436 H ALA A 32 -2.303 3.373 -4.685 1.00 0.09 H ATOM 437 HA ALA A 32 -3.591 1.589 -6.346 1.00 0.12 H ATOM 438 HB1 ALA A 32 -1.898 0.834 -4.888 1.00 1.02 H ATOM 439 HB2 ALA A 32 -3.384 0.053 -4.334 1.00 1.03 H ATOM 440 HB3 ALA A 32 -2.740 1.457 -3.470 1.00 1.02 H ATOM 441 N THR A 33 -5.446 2.494 -3.748 1.00 0.08 N ATOM 442 CA THR A 33 -6.821 2.518 -3.274 1.00 0.07 C ATOM 443 C THR A 33 -7.630 3.576 -4.030 1.00 0.08 C ATOM 444 O THR A 33 -8.858 3.534 -4.084 1.00 0.10 O ATOM 445 CB THR A 33 -6.895 2.782 -1.762 1.00 0.08 C ATOM 446 OG1 THR A 33 -5.926 1.975 -1.077 1.00 0.09 O ATOM 447 CG2 THR A 33 -8.287 2.462 -1.233 1.00 0.09 C ATOM 448 H THR A 33 -4.732 2.913 -3.204 1.00 0.08 H ATOM 449 HA THR A 33 -7.255 1.540 -3.474 1.00 0.08 H ATOM 450 HB THR A 33 -6.685 3.823 -1.580 1.00 0.09 H ATOM 451 HG1 THR A 33 -5.043 2.186 -1.398 1.00 0.09 H ATOM 452 HG21 THR A 33 -8.620 1.514 -1.642 1.00 0.99 H ATOM 453 HG22 THR A 33 -8.973 3.243 -1.532 1.00 1.01 H ATOM 454 HG23 THR A 33 -8.259 2.401 -0.158 1.00 0.98 H ATOM 455 N ALA A 34 -6.937 4.524 -4.623 1.00 0.08 N ATOM 456 CA ALA A 34 -7.577 5.490 -5.486 1.00 0.09 C ATOM 457 C ALA A 34 -8.056 4.787 -6.744 1.00 0.11 C ATOM 458 O ALA A 34 -9.091 5.132 -7.311 1.00 0.20 O ATOM 459 CB ALA A 34 -6.620 6.628 -5.812 1.00 0.10 C ATOM 460 H ALA A 34 -5.971 4.592 -4.457 1.00 0.09 H ATOM 461 HA ALA A 34 -8.426 5.897 -4.956 1.00 0.09 H ATOM 462 HB1 ALA A 34 -5.754 6.238 -6.327 1.00 1.02 H ATOM 463 HB2 ALA A 34 -6.306 7.105 -4.892 1.00 1.03 H ATOM 464 HB3 ALA A 34 -7.119 7.352 -6.440 1.00 1.00 H ATOM 465 N THR A 35 -7.306 3.765 -7.135 1.00 0.11 N ATOM 466 CA THR A 35 -7.637 2.935 -8.265 1.00 0.12 C ATOM 467 C THR A 35 -8.827 2.028 -7.947 1.00 0.11 C ATOM 468 O THR A 35 -9.806 1.995 -8.694 1.00 0.14 O ATOM 469 CB THR A 35 -6.415 2.079 -8.652 1.00 0.16 C ATOM 470 OG1 THR A 35 -5.636 2.735 -9.663 1.00 0.22 O ATOM 471 CG2 THR A 35 -6.838 0.699 -9.115 1.00 0.17 C ATOM 472 H THR A 35 -6.494 3.554 -6.630 1.00 0.14 H ATOM 473 HA THR A 35 -7.886 3.576 -9.097 1.00 0.14 H ATOM 474 HB THR A 35 -5.799 1.962 -7.771 1.00 0.16 H ATOM 475 HG1 THR A 35 -5.774 3.691 -9.606 1.00 0.81 H ATOM 476 HG21 THR A 35 -7.381 0.782 -10.043 1.00 1.03 H ATOM 477 HG22 THR A 35 -7.485 0.269 -8.357 1.00 0.99 H ATOM 478 HG23 THR A 35 -5.968 0.079 -9.248 1.00 1.04 H ATOM 479 N VAL A 36 -8.736 1.309 -6.824 1.00 0.10 N ATOM 480 CA VAL A 36 -9.737 0.309 -6.459 1.00 0.11 C ATOM 481 C VAL A 36 -11.139 0.905 -6.423 1.00 0.13 C ATOM 482 O VAL A 36 -12.115 0.247 -6.777 1.00 0.17 O ATOM 483 CB VAL A 36 -9.424 -0.349 -5.094 1.00 0.09 C ATOM 484 CG1 VAL A 36 -8.168 -1.191 -5.148 1.00 0.18 C ATOM 485 CG2 VAL A 36 -9.330 0.674 -3.998 1.00 0.16 C ATOM 486 H VAL A 36 -7.964 1.448 -6.231 1.00 0.09 H ATOM 487 HA VAL A 36 -9.713 -0.464 -7.212 1.00 0.13 H ATOM 488 HB VAL A 36 -10.232 -0.995 -4.847 1.00 0.13 H ATOM 489 HG11 VAL A 36 -7.402 -0.668 -5.701 1.00 0.98 H ATOM 490 HG12 VAL A 36 -8.390 -2.135 -5.629 1.00 1.04 H ATOM 491 HG13 VAL A 36 -7.823 -1.379 -4.143 1.00 0.99 H ATOM 492 HG21 VAL A 36 -8.879 1.574 -4.384 1.00 1.06 H ATOM 493 HG22 VAL A 36 -8.724 0.281 -3.197 1.00 1.03 H ATOM 494 HG23 VAL A 36 -10.319 0.896 -3.626 1.00 1.01 H ATOM 495 N LEU A 37 -11.233 2.157 -6.016 1.00 0.12 N ATOM 496 CA LEU A 37 -12.522 2.814 -5.899 1.00 0.16 C ATOM 497 C LEU A 37 -12.858 3.594 -7.165 1.00 0.25 C ATOM 498 O LEU A 37 -14.001 3.605 -7.614 1.00 0.65 O ATOM 499 CB LEU A 37 -12.507 3.739 -4.691 1.00 0.15 C ATOM 500 CG LEU A 37 -11.875 3.133 -3.444 1.00 0.13 C ATOM 501 CD1 LEU A 37 -11.660 4.202 -2.396 1.00 0.18 C ATOM 502 CD2 LEU A 37 -12.734 1.999 -2.908 1.00 0.15 C ATOM 503 H LEU A 37 -10.418 2.650 -5.774 1.00 0.11 H ATOM 504 HA LEU A 37 -13.272 2.053 -5.749 1.00 0.18 H ATOM 505 HB2 LEU A 37 -11.959 4.629 -4.950 1.00 0.18 H ATOM 506 HB3 LEU A 37 -13.523 4.014 -4.456 1.00 0.19 H ATOM 507 HG LEU A 37 -10.909 2.728 -3.704 1.00 0.11 H ATOM 508 HD11 LEU A 37 -11.014 4.965 -2.803 1.00 1.03 H ATOM 509 HD12 LEU A 37 -11.196 3.762 -1.528 1.00 1.02 H ATOM 510 HD13 LEU A 37 -12.607 4.637 -2.123 1.00 1.03 H ATOM 511 HD21 LEU A 37 -13.710 2.379 -2.651 1.00 1.00 H ATOM 512 HD22 LEU A 37 -12.267 1.571 -2.030 1.00 1.01 H ATOM 513 HD23 LEU A 37 -12.832 1.237 -3.667 1.00 1.02 H ATOM 514 N GLY A 38 -11.857 4.257 -7.728 1.00 0.43 N ATOM 515 CA GLY A 38 -12.052 4.976 -8.972 1.00 0.49 C ATOM 516 C GLY A 38 -11.891 6.470 -8.801 1.00 0.51 C ATOM 517 O GLY A 38 -12.409 7.257 -9.591 1.00 0.62 O ATOM 518 H GLY A 38 -10.985 4.279 -7.285 1.00 0.76 H ATOM 519 HA2 GLY A 38 -11.330 4.626 -9.694 1.00 0.62 H ATOM 520 HA3 GLY A 38 -13.045 4.771 -9.343 1.00 0.48 H ATOM 521 N HIS A 39 -11.158 6.862 -7.767 1.00 0.57 N ATOM 522 CA HIS A 39 -10.938 8.272 -7.471 1.00 0.68 C ATOM 523 C HIS A 39 -9.732 8.793 -8.237 1.00 0.82 C ATOM 524 O HIS A 39 -9.678 9.971 -8.596 1.00 1.81 O ATOM 525 CB HIS A 39 -10.715 8.493 -5.969 1.00 0.65 C ATOM 526 CG HIS A 39 -11.928 8.267 -5.114 1.00 0.73 C ATOM 527 ND1 HIS A 39 -12.237 9.050 -4.020 1.00 1.09 N ATOM 528 CD2 HIS A 39 -12.895 7.323 -5.179 1.00 0.67 C ATOM 529 CE1 HIS A 39 -13.338 8.594 -3.452 1.00 1.15 C ATOM 530 NE2 HIS A 39 -13.757 7.548 -4.136 1.00 0.88 N ATOM 531 H HIS A 39 -10.733 6.182 -7.204 1.00 0.62 H ATOM 532 HA HIS A 39 -11.812 8.817 -7.779 1.00 0.79 H ATOM 533 HB2 HIS A 39 -9.949 7.819 -5.633 1.00 0.56 H ATOM 534 HB3 HIS A 39 -10.382 9.510 -5.812 1.00 0.74 H ATOM 535 HD1 HIS A 39 -11.727 9.840 -3.709 1.00 1.33 H ATOM 536 HD2 HIS A 39 -12.973 6.537 -5.915 1.00 0.69 H ATOM 537 HE1 HIS A 39 -13.816 9.010 -2.576 1.00 1.43 H ATOM 538 HE2 HIS A 39 -14.636 7.116 -4.026 1.00 0.94 H ATOM 539 N HIS A 40 -8.770 7.895 -8.472 1.00 0.53 N ATOM 540 CA HIS A 40 -7.484 8.220 -9.109 1.00 0.48 C ATOM 541 C HIS A 40 -6.599 9.073 -8.197 1.00 0.45 C ATOM 542 O HIS A 40 -5.381 8.905 -8.173 1.00 0.59 O ATOM 543 CB HIS A 40 -7.681 8.916 -10.463 1.00 0.58 C ATOM 544 CG HIS A 40 -6.394 9.245 -11.163 1.00 0.73 C ATOM 545 ND1 HIS A 40 -6.133 10.475 -11.730 1.00 1.35 N ATOM 546 CD2 HIS A 40 -5.293 8.488 -11.394 1.00 0.62 C ATOM 547 CE1 HIS A 40 -4.935 10.457 -12.282 1.00 1.46 C ATOM 548 NE2 HIS A 40 -4.405 9.265 -12.091 1.00 0.94 N ATOM 549 H HIS A 40 -8.936 6.960 -8.220 1.00 1.22 H ATOM 550 HA HIS A 40 -6.974 7.283 -9.281 1.00 0.53 H ATOM 551 HB2 HIS A 40 -8.257 8.273 -11.111 1.00 0.67 H ATOM 552 HB3 HIS A 40 -8.221 9.839 -10.308 1.00 0.65 H ATOM 553 HD1 HIS A 40 -6.740 11.251 -11.726 1.00 1.74 H ATOM 554 HD2 HIS A 40 -5.137 7.467 -11.073 1.00 0.79 H ATOM 555 HE1 HIS A 40 -4.467 11.278 -12.805 1.00 1.95 H ATOM 556 HE2 HIS A 40 -3.508 8.987 -12.389 1.00 0.99 H ATOM 557 N THR A 41 -7.207 9.978 -7.451 1.00 0.46 N ATOM 558 CA THR A 41 -6.472 10.845 -6.556 1.00 0.55 C ATOM 559 C THR A 41 -6.156 10.168 -5.227 1.00 0.37 C ATOM 560 O THR A 41 -7.054 9.749 -4.496 1.00 0.45 O ATOM 561 CB THR A 41 -7.254 12.120 -6.257 1.00 0.92 C ATOM 562 OG1 THR A 41 -8.660 11.840 -6.238 1.00 1.97 O ATOM 563 CG2 THR A 41 -6.960 13.205 -7.266 1.00 0.56 C ATOM 564 H THR A 41 -8.182 10.069 -7.510 1.00 0.53 H ATOM 565 HA THR A 41 -5.552 11.124 -7.041 1.00 0.68 H ATOM 566 HB THR A 41 -6.945 12.467 -5.284 1.00 1.69 H ATOM 567 HG1 THR A 41 -9.050 12.104 -7.080 1.00 2.35 H ATOM 568 HG21 THR A 41 -5.913 13.469 -7.216 1.00 1.17 H ATOM 569 HG22 THR A 41 -7.562 14.069 -7.035 1.00 1.23 H ATOM 570 HG23 THR A 41 -7.198 12.851 -8.257 1.00 1.34 H ATOM 571 N PRO A 42 -4.866 10.068 -4.896 1.00 0.24 N ATOM 572 CA PRO A 42 -4.411 9.586 -3.597 1.00 0.27 C ATOM 573 C PRO A 42 -4.633 10.649 -2.530 1.00 0.40 C ATOM 574 O PRO A 42 -4.619 10.365 -1.336 1.00 0.50 O ATOM 575 CB PRO A 42 -2.913 9.318 -3.801 1.00 0.31 C ATOM 576 CG PRO A 42 -2.667 9.490 -5.266 1.00 0.29 C ATOM 577 CD PRO A 42 -3.747 10.404 -5.766 1.00 0.27 C ATOM 578 HA PRO A 42 -4.914 8.674 -3.314 1.00 0.28 H ATOM 579 HB2 PRO A 42 -2.338 10.021 -3.218 1.00 0.38 H ATOM 580 HB3 PRO A 42 -2.682 8.313 -3.483 1.00 0.39 H ATOM 581 HG2 PRO A 42 -1.696 9.934 -5.426 1.00 0.37 H ATOM 582 HG3 PRO A 42 -2.730 8.532 -5.759 1.00 0.37 H ATOM 583 HD2 PRO A 42 -3.463 11.438 -5.647 1.00 0.30 H ATOM 584 HD3 PRO A 42 -3.988 10.188 -6.793 1.00 0.40 H ATOM 585 N GLU A 43 -4.838 11.882 -2.990 1.00 0.43 N ATOM 586 CA GLU A 43 -5.196 12.992 -2.120 1.00 0.55 C ATOM 587 C GLU A 43 -6.589 12.764 -1.556 1.00 0.52 C ATOM 588 O GLU A 43 -6.877 13.067 -0.398 1.00 0.61 O ATOM 589 CB GLU A 43 -5.178 14.296 -2.906 1.00 0.68 C ATOM 590 CG GLU A 43 -3.835 14.606 -3.511 1.00 0.69 C ATOM 591 CD GLU A 43 -3.892 15.771 -4.473 1.00 1.18 C ATOM 592 OE1 GLU A 43 -3.816 16.930 -4.015 1.00 1.38 O ATOM 593 OE2 GLU A 43 -4.026 15.534 -5.692 1.00 1.82 O ATOM 594 H GLU A 43 -4.735 12.047 -3.949 1.00 0.39 H ATOM 595 HA GLU A 43 -4.476 13.046 -1.323 1.00 0.60 H ATOM 596 HB2 GLU A 43 -5.890 14.225 -3.710 1.00 0.68 H ATOM 597 HB3 GLU A 43 -5.457 15.109 -2.253 1.00 0.85 H ATOM 598 HG2 GLU A 43 -3.137 14.839 -2.718 1.00 1.04 H ATOM 599 HG3 GLU A 43 -3.505 13.731 -4.038 1.00 1.01 H ATOM 600 N SER A 44 -7.442 12.215 -2.408 1.00 0.44 N ATOM 601 CA SER A 44 -8.806 11.888 -2.048 1.00 0.43 C ATOM 602 C SER A 44 -8.812 10.702 -1.088 1.00 0.35 C ATOM 603 O SER A 44 -9.715 10.547 -0.266 1.00 0.49 O ATOM 604 CB SER A 44 -9.598 11.569 -3.318 1.00 0.50 C ATOM 605 OG SER A 44 -10.971 11.328 -3.045 1.00 0.97 O ATOM 606 H SER A 44 -7.132 12.015 -3.314 1.00 0.45 H ATOM 607 HA SER A 44 -9.241 12.740 -1.565 1.00 0.47 H ATOM 608 HB2 SER A 44 -9.519 12.401 -4.010 1.00 0.83 H ATOM 609 HB3 SER A 44 -9.178 10.693 -3.774 1.00 0.87 H ATOM 610 HG SER A 44 -11.423 12.173 -2.907 1.00 1.40 H ATOM 611 N ILE A 45 -7.775 9.884 -1.189 1.00 0.19 N ATOM 612 CA ILE A 45 -7.627 8.704 -0.354 1.00 0.13 C ATOM 613 C ILE A 45 -6.955 9.067 0.966 1.00 0.13 C ATOM 614 O ILE A 45 -5.732 9.210 1.035 1.00 0.19 O ATOM 615 CB ILE A 45 -6.788 7.634 -1.079 1.00 0.11 C ATOM 616 CG1 ILE A 45 -7.395 7.331 -2.447 1.00 0.12 C ATOM 617 CG2 ILE A 45 -6.666 6.356 -0.256 1.00 0.10 C ATOM 618 CD1 ILE A 45 -8.822 6.829 -2.402 1.00 0.11 C ATOM 619 H ILE A 45 -7.081 10.085 -1.848 1.00 0.25 H ATOM 620 HA ILE A 45 -8.607 8.297 -0.159 1.00 0.15 H ATOM 621 HB ILE A 45 -5.797 8.033 -1.220 1.00 0.13 H ATOM 622 HG12 ILE A 45 -7.381 8.228 -3.045 1.00 0.15 H ATOM 623 HG13 ILE A 45 -6.797 6.576 -2.930 1.00 0.13 H ATOM 624 HG21 ILE A 45 -6.324 6.596 0.741 1.00 1.01 H ATOM 625 HG22 ILE A 45 -5.952 5.695 -0.730 1.00 1.04 H ATOM 626 HG23 ILE A 45 -7.629 5.868 -0.204 1.00 1.00 H ATOM 627 HD11 ILE A 45 -8.854 5.881 -1.886 1.00 0.98 H ATOM 628 HD12 ILE A 45 -9.185 6.704 -3.410 1.00 1.03 H ATOM 629 HD13 ILE A 45 -9.441 7.545 -1.882 1.00 1.04 H ATOM 630 N SER A 46 -7.756 9.242 2.001 1.00 0.11 N ATOM 631 CA SER A 46 -7.229 9.543 3.321 1.00 0.12 C ATOM 632 C SER A 46 -6.605 8.281 3.911 1.00 0.11 C ATOM 633 O SER A 46 -7.109 7.178 3.699 1.00 0.12 O ATOM 634 CB SER A 46 -8.347 10.064 4.225 1.00 0.16 C ATOM 635 OG SER A 46 -7.834 10.790 5.328 1.00 1.18 O ATOM 636 H SER A 46 -8.727 9.163 1.879 1.00 0.13 H ATOM 637 HA SER A 46 -6.472 10.299 3.218 1.00 0.13 H ATOM 638 HB2 SER A 46 -9.000 10.708 3.658 1.00 0.81 H ATOM 639 HB3 SER A 46 -8.904 9.226 4.600 1.00 0.90 H ATOM 640 HG SER A 46 -7.433 11.611 5.008 1.00 1.49 H ATOM 641 N PRO A 47 -5.531 8.422 4.704 1.00 0.12 N ATOM 642 CA PRO A 47 -4.743 7.299 5.180 1.00 0.12 C ATOM 643 C PRO A 47 -5.278 6.792 6.492 1.00 0.10 C ATOM 644 O PRO A 47 -4.806 5.795 7.031 1.00 0.11 O ATOM 645 CB PRO A 47 -3.376 7.940 5.380 1.00 0.15 C ATOM 646 CG PRO A 47 -3.686 9.319 5.857 1.00 0.17 C ATOM 647 CD PRO A 47 -5.040 9.683 5.282 1.00 0.16 C ATOM 648 HA PRO A 47 -4.686 6.494 4.467 1.00 0.11 H ATOM 649 HB2 PRO A 47 -2.815 7.382 6.113 1.00 0.16 H ATOM 650 HB3 PRO A 47 -2.841 7.958 4.447 1.00 0.16 H ATOM 651 HG2 PRO A 47 -3.727 9.328 6.936 1.00 0.17 H ATOM 652 HG3 PRO A 47 -2.935 10.005 5.508 1.00 0.19 H ATOM 653 HD2 PRO A 47 -5.707 10.002 6.076 1.00 0.17 H ATOM 654 HD3 PRO A 47 -4.943 10.449 4.529 1.00 0.19 H ATOM 655 N ALA A 48 -6.282 7.484 6.980 1.00 0.12 N ATOM 656 CA ALA A 48 -6.776 7.258 8.306 1.00 0.13 C ATOM 657 C ALA A 48 -8.289 7.072 8.307 1.00 0.13 C ATOM 658 O ALA A 48 -8.925 7.019 9.359 1.00 0.17 O ATOM 659 CB ALA A 48 -6.344 8.415 9.175 1.00 0.18 C ATOM 660 H ALA A 48 -6.694 8.182 6.428 1.00 0.15 H ATOM 661 HA ALA A 48 -6.308 6.370 8.677 1.00 0.13 H ATOM 662 HB1 ALA A 48 -6.893 9.297 8.891 1.00 1.07 H ATOM 663 HB2 ALA A 48 -5.285 8.586 9.021 1.00 1.02 H ATOM 664 HB3 ALA A 48 -6.529 8.182 10.212 1.00 1.02 H ATOM 665 N THR A 49 -8.851 6.978 7.111 1.00 0.12 N ATOM 666 CA THR A 49 -10.266 6.725 6.934 1.00 0.12 C ATOM 667 C THR A 49 -10.595 5.257 7.200 1.00 0.10 C ATOM 668 O THR A 49 -11.571 4.953 7.887 1.00 0.10 O ATOM 669 CB THR A 49 -10.688 7.082 5.499 1.00 0.14 C ATOM 670 OG1 THR A 49 -10.758 8.504 5.339 1.00 0.20 O ATOM 671 CG2 THR A 49 -12.010 6.444 5.142 1.00 0.13 C ATOM 672 H THR A 49 -8.296 7.089 6.315 1.00 0.15 H ATOM 673 HA THR A 49 -10.817 7.348 7.622 1.00 0.14 H ATOM 674 HB THR A 49 -9.936 6.696 4.826 1.00 0.15 H ATOM 675 HG1 THR A 49 -11.422 8.861 5.941 1.00 0.82 H ATOM 676 HG21 THR A 49 -12.266 6.685 4.122 1.00 0.98 H ATOM 677 HG22 THR A 49 -12.777 6.807 5.808 1.00 1.00 H ATOM 678 HG23 THR A 49 -11.914 5.371 5.250 1.00 0.98 H ATOM 679 N ALA A 50 -9.729 4.393 6.650 1.00 0.09 N ATOM 680 CA ALA A 50 -9.832 2.925 6.681 1.00 0.08 C ATOM 681 C ALA A 50 -10.356 2.407 5.368 1.00 0.08 C ATOM 682 O ALA A 50 -11.283 2.953 4.792 1.00 0.09 O ATOM 683 CB ALA A 50 -10.671 2.389 7.830 1.00 0.09 C ATOM 684 H ALA A 50 -8.973 4.768 6.182 1.00 0.10 H ATOM 685 HA ALA A 50 -8.827 2.537 6.801 1.00 0.09 H ATOM 686 HB1 ALA A 50 -10.220 2.671 8.768 1.00 1.02 H ATOM 687 HB2 ALA A 50 -10.729 1.311 7.762 1.00 1.02 H ATOM 688 HB3 ALA A 50 -11.667 2.807 7.765 1.00 1.01 H ATOM 689 N PHE A 51 -9.708 1.359 4.898 1.00 0.08 N ATOM 690 CA PHE A 51 -10.085 0.677 3.668 1.00 0.09 C ATOM 691 C PHE A 51 -11.545 0.287 3.668 1.00 0.10 C ATOM 692 O PHE A 51 -12.249 0.490 2.682 1.00 0.10 O ATOM 693 CB PHE A 51 -9.226 -0.558 3.495 1.00 0.11 C ATOM 694 CG PHE A 51 -7.810 -0.205 3.218 1.00 0.11 C ATOM 695 CD1 PHE A 51 -7.503 0.694 2.217 1.00 0.11 C ATOM 696 CD2 PHE A 51 -6.796 -0.760 3.959 1.00 0.12 C ATOM 697 CE1 PHE A 51 -6.199 1.035 1.959 1.00 0.12 C ATOM 698 CE2 PHE A 51 -5.489 -0.427 3.709 1.00 0.13 C ATOM 699 CZ PHE A 51 -5.187 0.474 2.705 1.00 0.13 C ATOM 700 H PHE A 51 -8.917 1.037 5.400 1.00 0.08 H ATOM 701 HA PHE A 51 -9.900 1.347 2.844 1.00 0.10 H ATOM 702 HB2 PHE A 51 -9.254 -1.140 4.406 1.00 0.11 H ATOM 703 HB3 PHE A 51 -9.598 -1.156 2.674 1.00 0.11 H ATOM 704 HD1 PHE A 51 -8.301 1.130 1.638 1.00 0.12 H ATOM 705 HD2 PHE A 51 -7.038 -1.463 4.743 1.00 0.12 H ATOM 706 HE1 PHE A 51 -5.969 1.740 1.175 1.00 0.13 H ATOM 707 HE2 PHE A 51 -4.701 -0.868 4.299 1.00 0.14 H ATOM 708 HZ PHE A 51 -4.160 0.738 2.507 1.00 0.14 H ATOM 709 N LYS A 52 -11.990 -0.282 4.775 1.00 0.11 N ATOM 710 CA LYS A 52 -13.389 -0.610 4.951 1.00 0.13 C ATOM 711 C LYS A 52 -14.254 0.605 4.690 1.00 0.12 C ATOM 712 O LYS A 52 -15.280 0.535 4.015 1.00 0.15 O ATOM 713 CB LYS A 52 -13.630 -1.079 6.377 1.00 0.17 C ATOM 714 CG LYS A 52 -12.930 -2.383 6.693 1.00 0.53 C ATOM 715 CD LYS A 52 -13.408 -2.996 7.995 1.00 0.64 C ATOM 716 CE LYS A 52 -12.929 -2.226 9.207 1.00 0.59 C ATOM 717 NZ LYS A 52 -11.449 -2.283 9.360 1.00 1.22 N ATOM 718 H LYS A 52 -11.357 -0.502 5.489 1.00 0.12 H ATOM 719 HA LYS A 52 -13.637 -1.401 4.256 1.00 0.15 H ATOM 720 HB2 LYS A 52 -13.255 -0.319 7.055 1.00 0.45 H ATOM 721 HB3 LYS A 52 -14.691 -1.199 6.531 1.00 0.45 H ATOM 722 HG2 LYS A 52 -13.117 -3.077 5.896 1.00 0.76 H ATOM 723 HG3 LYS A 52 -11.873 -2.185 6.763 1.00 0.76 H ATOM 724 HD2 LYS A 52 -14.479 -2.992 7.993 1.00 0.75 H ATOM 725 HD3 LYS A 52 -13.048 -4.013 8.059 1.00 0.98 H ATOM 726 HE2 LYS A 52 -13.237 -1.202 9.098 1.00 1.18 H ATOM 727 HE3 LYS A 52 -13.390 -2.646 10.090 1.00 1.08 H ATOM 728 HZ1 LYS A 52 -11.150 -1.703 10.173 1.00 1.55 H ATOM 729 HZ2 LYS A 52 -10.984 -1.928 8.504 1.00 1.84 H ATOM 730 HZ3 LYS A 52 -11.145 -3.263 9.521 1.00 1.84 H ATOM 731 N ASP A 53 -13.800 1.721 5.223 1.00 0.11 N ATOM 732 CA ASP A 53 -14.530 2.974 5.149 1.00 0.11 C ATOM 733 C ASP A 53 -14.318 3.653 3.797 1.00 0.10 C ATOM 734 O ASP A 53 -14.972 4.645 3.468 1.00 0.18 O ATOM 735 CB ASP A 53 -14.087 3.905 6.277 1.00 0.12 C ATOM 736 CG ASP A 53 -14.504 3.400 7.642 1.00 0.58 C ATOM 737 OD1 ASP A 53 -13.908 2.414 8.128 1.00 1.14 O ATOM 738 OD2 ASP A 53 -15.426 3.991 8.247 1.00 0.67 O ATOM 739 H ASP A 53 -12.933 1.701 5.686 1.00 0.11 H ATOM 740 HA ASP A 53 -15.575 2.743 5.273 1.00 0.12 H ATOM 741 HB2 ASP A 53 -13.003 3.994 6.261 1.00 0.42 H ATOM 742 HB3 ASP A 53 -14.526 4.880 6.123 1.00 0.47 H ATOM 743 N LEU A 54 -13.394 3.105 3.024 1.00 0.08 N ATOM 744 CA LEU A 54 -13.042 3.640 1.720 1.00 0.08 C ATOM 745 C LEU A 54 -13.855 2.976 0.624 1.00 0.08 C ATOM 746 O LEU A 54 -14.125 3.580 -0.412 1.00 0.10 O ATOM 747 CB LEU A 54 -11.547 3.431 1.465 1.00 0.08 C ATOM 748 CG LEU A 54 -10.639 4.493 2.079 1.00 0.09 C ATOM 749 CD1 LEU A 54 -9.208 4.003 2.150 1.00 0.10 C ATOM 750 CD2 LEU A 54 -10.711 5.767 1.271 1.00 0.12 C ATOM 751 H LEU A 54 -12.928 2.307 3.348 1.00 0.11 H ATOM 752 HA LEU A 54 -13.255 4.698 1.723 1.00 0.10 H ATOM 753 HB2 LEU A 54 -11.270 2.478 1.876 1.00 0.08 H ATOM 754 HB3 LEU A 54 -11.376 3.402 0.398 1.00 0.08 H ATOM 755 HG LEU A 54 -10.971 4.710 3.083 1.00 0.09 H ATOM 756 HD11 LEU A 54 -9.150 3.160 2.824 1.00 1.03 H ATOM 757 HD12 LEU A 54 -8.575 4.800 2.511 1.00 1.02 H ATOM 758 HD13 LEU A 54 -8.882 3.702 1.168 1.00 1.02 H ATOM 759 HD21 LEU A 54 -10.448 5.553 0.247 1.00 1.01 H ATOM 760 HD22 LEU A 54 -10.020 6.489 1.679 1.00 1.00 H ATOM 761 HD23 LEU A 54 -11.715 6.162 1.311 1.00 1.05 H ATOM 762 N GLY A 55 -14.262 1.741 0.867 1.00 0.09 N ATOM 763 CA GLY A 55 -14.993 1.002 -0.137 1.00 0.10 C ATOM 764 C GLY A 55 -14.339 -0.322 -0.441 1.00 0.10 C ATOM 765 O GLY A 55 -14.809 -1.077 -1.294 1.00 0.15 O ATOM 766 H GLY A 55 -14.089 1.334 1.747 1.00 0.09 H ATOM 767 HA2 GLY A 55 -15.996 0.826 0.219 1.00 0.12 H ATOM 768 HA3 GLY A 55 -15.039 1.588 -1.043 1.00 0.11 H ATOM 769 N ILE A 56 -13.242 -0.590 0.254 1.00 0.09 N ATOM 770 CA ILE A 56 -12.560 -1.865 0.148 1.00 0.09 C ATOM 771 C ILE A 56 -13.481 -2.989 0.619 1.00 0.14 C ATOM 772 O ILE A 56 -14.050 -2.915 1.714 1.00 0.32 O ATOM 773 CB ILE A 56 -11.257 -1.884 0.984 1.00 0.10 C ATOM 774 CG1 ILE A 56 -10.150 -1.036 0.362 1.00 0.11 C ATOM 775 CG2 ILE A 56 -10.776 -3.289 1.204 1.00 0.15 C ATOM 776 CD1 ILE A 56 -10.190 -0.949 -1.142 1.00 0.10 C ATOM 777 H ILE A 56 -12.883 0.092 0.861 1.00 0.10 H ATOM 778 HA ILE A 56 -12.303 -2.029 -0.890 1.00 0.09 H ATOM 779 HB ILE A 56 -11.484 -1.474 1.952 1.00 0.10 H ATOM 780 HG12 ILE A 56 -10.206 -0.041 0.761 1.00 0.13 H ATOM 781 HG13 ILE A 56 -9.199 -1.464 0.639 1.00 0.16 H ATOM 782 HG21 ILE A 56 -10.944 -3.866 0.310 1.00 1.07 H ATOM 783 HG22 ILE A 56 -11.320 -3.724 2.031 1.00 1.03 H ATOM 784 HG23 ILE A 56 -9.722 -3.269 1.429 1.00 0.99 H ATOM 785 HD11 ILE A 56 -9.300 -0.454 -1.493 1.00 1.00 H ATOM 786 HD12 ILE A 56 -11.059 -0.379 -1.444 1.00 0.96 H ATOM 787 HD13 ILE A 56 -10.241 -1.944 -1.563 1.00 1.00 H ATOM 788 N ASP A 57 -13.623 -4.024 -0.200 1.00 0.19 N ATOM 789 CA ASP A 57 -14.492 -5.144 0.143 1.00 0.28 C ATOM 790 C ASP A 57 -14.098 -6.399 -0.631 1.00 0.28 C ATOM 791 O ASP A 57 -14.681 -6.705 -1.670 1.00 0.67 O ATOM 792 CB ASP A 57 -15.958 -4.797 -0.125 1.00 0.52 C ATOM 793 CG ASP A 57 -16.905 -5.865 0.384 1.00 1.48 C ATOM 794 OD1 ASP A 57 -17.054 -5.991 1.621 1.00 2.34 O ATOM 795 OD2 ASP A 57 -17.514 -6.574 -0.441 1.00 1.95 O ATOM 796 H ASP A 57 -13.113 -4.042 -1.039 1.00 0.42 H ATOM 797 HA ASP A 57 -14.369 -5.340 1.197 1.00 0.44 H ATOM 798 HB2 ASP A 57 -16.198 -3.866 0.367 1.00 0.99 H ATOM 799 HB3 ASP A 57 -16.108 -4.687 -1.189 1.00 0.75 H ATOM 800 N SER A 58 -13.093 -7.105 -0.113 1.00 0.23 N ATOM 801 CA SER A 58 -12.599 -8.358 -0.693 1.00 0.26 C ATOM 802 C SER A 58 -11.959 -8.154 -2.067 1.00 0.19 C ATOM 803 O SER A 58 -10.743 -8.226 -2.200 1.00 0.17 O ATOM 804 CB SER A 58 -13.708 -9.394 -0.782 1.00 0.36 C ATOM 805 OG SER A 58 -14.331 -9.590 0.478 1.00 1.25 O ATOM 806 H SER A 58 -12.661 -6.769 0.706 1.00 0.45 H ATOM 807 HA SER A 58 -11.850 -8.734 -0.035 1.00 0.35 H ATOM 808 HB2 SER A 58 -14.436 -9.056 -1.485 1.00 0.92 H ATOM 809 HB3 SER A 58 -13.294 -10.334 -1.116 1.00 0.87 H ATOM 810 HG SER A 58 -14.234 -8.788 1.010 1.00 1.39 H ATOM 811 N LEU A 59 -12.781 -7.883 -3.071 1.00 0.22 N ATOM 812 CA LEU A 59 -12.313 -7.732 -4.444 1.00 0.20 C ATOM 813 C LEU A 59 -11.304 -6.615 -4.539 1.00 0.14 C ATOM 814 O LEU A 59 -10.196 -6.799 -5.031 1.00 0.14 O ATOM 815 CB LEU A 59 -13.459 -7.391 -5.387 1.00 0.23 C ATOM 816 CG LEU A 59 -14.480 -8.496 -5.669 1.00 0.30 C ATOM 817 CD1 LEU A 59 -15.162 -8.974 -4.398 1.00 1.12 C ATOM 818 CD2 LEU A 59 -15.507 -7.984 -6.658 1.00 1.18 C ATOM 819 H LEU A 59 -13.741 -7.769 -2.881 1.00 0.29 H ATOM 820 HA LEU A 59 -11.855 -8.660 -4.753 1.00 0.23 H ATOM 821 HB2 LEU A 59 -13.981 -6.541 -4.976 1.00 0.22 H ATOM 822 HB3 LEU A 59 -13.023 -7.090 -6.324 1.00 0.24 H ATOM 823 HG LEU A 59 -13.978 -9.341 -6.114 1.00 0.93 H ATOM 824 HD11 LEU A 59 -15.699 -8.153 -3.947 1.00 1.60 H ATOM 825 HD12 LEU A 59 -14.411 -9.336 -3.710 1.00 1.77 H ATOM 826 HD13 LEU A 59 -15.851 -9.771 -4.634 1.00 1.74 H ATOM 827 HD21 LEU A 59 -16.281 -8.724 -6.795 1.00 1.74 H ATOM 828 HD22 LEU A 59 -15.025 -7.784 -7.604 1.00 1.76 H ATOM 829 HD23 LEU A 59 -15.940 -7.071 -6.275 1.00 1.79 H ATOM 830 N THR A 60 -11.691 -5.458 -4.040 1.00 0.12 N ATOM 831 CA THR A 60 -10.835 -4.298 -4.111 1.00 0.10 C ATOM 832 C THR A 60 -9.755 -4.369 -3.057 1.00 0.09 C ATOM 833 O THR A 60 -8.774 -3.646 -3.119 1.00 0.10 O ATOM 834 CB THR A 60 -11.615 -2.995 -3.964 1.00 0.12 C ATOM 835 OG1 THR A 60 -12.667 -3.163 -3.004 1.00 0.16 O ATOM 836 CG2 THR A 60 -12.168 -2.572 -5.311 1.00 0.16 C ATOM 837 H THR A 60 -12.550 -5.401 -3.565 1.00 0.13 H ATOM 838 HA THR A 60 -10.370 -4.300 -5.084 1.00 0.11 H ATOM 839 HB THR A 60 -10.937 -2.228 -3.612 1.00 0.14 H ATOM 840 HG1 THR A 60 -13.518 -3.176 -3.462 1.00 0.35 H ATOM 841 HG21 THR A 60 -11.351 -2.512 -6.025 1.00 1.02 H ATOM 842 HG22 THR A 60 -12.639 -1.606 -5.221 1.00 0.99 H ATOM 843 HG23 THR A 60 -12.890 -3.300 -5.650 1.00 0.98 H ATOM 844 N ALA A 61 -9.943 -5.248 -2.086 1.00 0.09 N ATOM 845 CA ALA A 61 -8.906 -5.496 -1.102 1.00 0.09 C ATOM 846 C ALA A 61 -7.821 -6.354 -1.722 1.00 0.09 C ATOM 847 O ALA A 61 -6.636 -6.189 -1.433 1.00 0.12 O ATOM 848 CB ALA A 61 -9.470 -6.159 0.142 1.00 0.10 C ATOM 849 H ALA A 61 -10.798 -5.730 -2.039 1.00 0.10 H ATOM 850 HA ALA A 61 -8.481 -4.541 -0.815 1.00 0.10 H ATOM 851 HB1 ALA A 61 -10.345 -5.617 0.471 1.00 1.01 H ATOM 852 HB2 ALA A 61 -8.720 -6.140 0.926 1.00 1.04 H ATOM 853 HB3 ALA A 61 -9.736 -7.181 -0.080 1.00 1.02 H ATOM 854 N LEU A 62 -8.235 -7.266 -2.590 1.00 0.10 N ATOM 855 CA LEU A 62 -7.307 -8.091 -3.321 1.00 0.11 C ATOM 856 C LEU A 62 -6.706 -7.293 -4.467 1.00 0.11 C ATOM 857 O LEU A 62 -5.528 -7.405 -4.742 1.00 0.13 O ATOM 858 CB LEU A 62 -8.012 -9.313 -3.887 1.00 0.14 C ATOM 859 CG LEU A 62 -7.174 -10.594 -4.010 1.00 0.20 C ATOM 860 CD1 LEU A 62 -5.681 -10.291 -4.000 1.00 0.53 C ATOM 861 CD2 LEU A 62 -7.542 -11.566 -2.904 1.00 0.52 C ATOM 862 H LEU A 62 -9.196 -7.413 -2.724 1.00 0.11 H ATOM 863 HA LEU A 62 -6.524 -8.403 -2.648 1.00 0.12 H ATOM 864 HB2 LEU A 62 -8.870 -9.528 -3.269 1.00 0.14 H ATOM 865 HB3 LEU A 62 -8.354 -9.047 -4.863 1.00 0.16 H ATOM 866 HG LEU A 62 -7.402 -11.066 -4.955 1.00 0.46 H ATOM 867 HD11 LEU A 62 -5.126 -11.189 -4.219 1.00 1.21 H ATOM 868 HD12 LEU A 62 -5.392 -9.918 -3.026 1.00 1.16 H ATOM 869 HD13 LEU A 62 -5.466 -9.539 -4.748 1.00 1.19 H ATOM 870 HD21 LEU A 62 -6.839 -12.385 -2.894 1.00 1.20 H ATOM 871 HD22 LEU A 62 -8.536 -11.950 -3.080 1.00 1.10 H ATOM 872 HD23 LEU A 62 -7.518 -11.056 -1.954 1.00 1.27 H ATOM 873 N GLU A 63 -7.514 -6.496 -5.151 1.00 0.10 N ATOM 874 CA GLU A 63 -7.029 -5.636 -6.203 1.00 0.11 C ATOM 875 C GLU A 63 -6.102 -4.582 -5.604 1.00 0.10 C ATOM 876 O GLU A 63 -5.097 -4.201 -6.212 1.00 0.12 O ATOM 877 CB GLU A 63 -8.250 -5.019 -6.887 1.00 0.14 C ATOM 878 CG GLU A 63 -7.998 -3.682 -7.514 1.00 0.41 C ATOM 879 CD GLU A 63 -7.248 -3.766 -8.829 1.00 0.59 C ATOM 880 OE1 GLU A 63 -6.001 -3.703 -8.801 1.00 0.72 O ATOM 881 OE2 GLU A 63 -7.889 -3.897 -9.890 1.00 0.83 O ATOM 882 H GLU A 63 -8.479 -6.465 -4.978 1.00 0.10 H ATOM 883 HA GLU A 63 -6.476 -6.238 -6.915 1.00 0.13 H ATOM 884 HB2 GLU A 63 -8.597 -5.691 -7.657 1.00 0.42 H ATOM 885 HB3 GLU A 63 -9.028 -4.899 -6.153 1.00 0.37 H ATOM 886 HG2 GLU A 63 -8.947 -3.192 -7.685 1.00 0.58 H ATOM 887 HG3 GLU A 63 -7.423 -3.116 -6.806 1.00 0.55 H ATOM 888 N LEU A 64 -6.427 -4.141 -4.388 1.00 0.09 N ATOM 889 CA LEU A 64 -5.517 -3.314 -3.618 1.00 0.09 C ATOM 890 C LEU A 64 -4.211 -4.060 -3.491 1.00 0.12 C ATOM 891 O LEU A 64 -3.137 -3.557 -3.815 1.00 0.17 O ATOM 892 CB LEU A 64 -6.065 -3.050 -2.208 1.00 0.12 C ATOM 893 CG LEU A 64 -6.041 -1.597 -1.759 1.00 0.17 C ATOM 894 CD1 LEU A 64 -6.520 -1.484 -0.318 1.00 0.43 C ATOM 895 CD2 LEU A 64 -4.641 -1.036 -1.909 1.00 0.44 C ATOM 896 H LEU A 64 -7.293 -4.389 -3.999 1.00 0.08 H ATOM 897 HA LEU A 64 -5.360 -2.390 -4.135 1.00 0.10 H ATOM 898 HB2 LEU A 64 -7.085 -3.407 -2.153 1.00 0.30 H ATOM 899 HB3 LEU A 64 -5.464 -3.619 -1.512 1.00 0.28 H ATOM 900 HG LEU A 64 -6.709 -1.020 -2.382 1.00 0.51 H ATOM 901 HD11 LEU A 64 -5.908 -2.112 0.318 1.00 1.11 H ATOM 902 HD12 LEU A 64 -7.553 -1.802 -0.249 1.00 1.20 H ATOM 903 HD13 LEU A 64 -6.438 -0.457 0.009 1.00 1.10 H ATOM 904 HD21 LEU A 64 -4.318 -1.148 -2.935 1.00 1.13 H ATOM 905 HD22 LEU A 64 -3.971 -1.581 -1.261 1.00 1.14 H ATOM 906 HD23 LEU A 64 -4.637 0.009 -1.639 1.00 1.09 H ATOM 907 N ARG A 65 -4.363 -5.299 -3.081 1.00 0.12 N ATOM 908 CA ARG A 65 -3.249 -6.187 -2.789 1.00 0.15 C ATOM 909 C ARG A 65 -2.421 -6.414 -4.040 1.00 0.16 C ATOM 910 O ARG A 65 -1.199 -6.314 -4.024 1.00 0.19 O ATOM 911 CB ARG A 65 -3.776 -7.515 -2.227 1.00 0.18 C ATOM 912 CG ARG A 65 -2.690 -8.431 -1.672 1.00 0.33 C ATOM 913 CD ARG A 65 -2.141 -9.404 -2.707 1.00 0.43 C ATOM 914 NE ARG A 65 -1.201 -10.351 -2.102 1.00 0.78 N ATOM 915 CZ ARG A 65 -0.418 -11.181 -2.791 1.00 1.35 C ATOM 916 NH1 ARG A 65 -0.468 -11.207 -4.117 1.00 1.63 N ATOM 917 NH2 ARG A 65 0.407 -11.995 -2.146 1.00 1.72 N ATOM 918 H ARG A 65 -5.279 -5.636 -2.995 1.00 0.11 H ATOM 919 HA ARG A 65 -2.636 -5.716 -2.046 1.00 0.17 H ATOM 920 HB2 ARG A 65 -4.466 -7.294 -1.425 1.00 0.25 H ATOM 921 HB3 ARG A 65 -4.315 -8.046 -3.013 1.00 0.20 H ATOM 922 HG2 ARG A 65 -1.875 -7.819 -1.315 1.00 0.64 H ATOM 923 HG3 ARG A 65 -3.097 -8.990 -0.849 1.00 0.65 H ATOM 924 HD2 ARG A 65 -2.963 -9.953 -3.143 1.00 0.56 H ATOM 925 HD3 ARG A 65 -1.630 -8.845 -3.476 1.00 0.59 H ATOM 926 HE ARG A 65 -1.149 -10.365 -1.119 1.00 0.71 H ATOM 927 HH11 ARG A 65 -1.095 -10.604 -4.611 1.00 1.41 H ATOM 928 HH12 ARG A 65 0.123 -11.834 -4.632 1.00 2.09 H ATOM 929 HH21 ARG A 65 0.436 -11.990 -1.145 1.00 1.59 H ATOM 930 HH22 ARG A 65 1.017 -12.619 -2.663 1.00 2.17 H ATOM 931 N ASN A 66 -3.120 -6.698 -5.118 1.00 0.14 N ATOM 932 CA ASN A 66 -2.524 -6.929 -6.417 1.00 0.16 C ATOM 933 C ASN A 66 -1.693 -5.737 -6.873 1.00 0.16 C ATOM 934 O ASN A 66 -0.638 -5.912 -7.482 1.00 0.21 O ATOM 935 CB ASN A 66 -3.629 -7.257 -7.423 1.00 0.20 C ATOM 936 CG ASN A 66 -4.044 -8.712 -7.342 1.00 0.32 C ATOM 937 OD1 ASN A 66 -3.233 -9.576 -7.017 1.00 0.83 O ATOM 938 ND2 ASN A 66 -5.306 -8.998 -7.621 1.00 0.34 N ATOM 939 H ASN A 66 -4.097 -6.780 -5.029 1.00 0.14 H ATOM 940 HA ASN A 66 -1.875 -7.786 -6.330 1.00 0.19 H ATOM 941 HB2 ASN A 66 -4.493 -6.646 -7.207 1.00 0.16 H ATOM 942 HB3 ASN A 66 -3.288 -7.047 -8.422 1.00 0.29 H ATOM 943 HD21 ASN A 66 -5.910 -8.264 -7.863 1.00 0.68 H ATOM 944 HD22 ASN A 66 -5.584 -9.939 -7.582 1.00 0.33 H ATOM 945 N THR A 67 -2.149 -4.530 -6.566 1.00 0.14 N ATOM 946 CA THR A 67 -1.390 -3.343 -6.911 1.00 0.15 C ATOM 947 C THR A 67 -0.216 -3.154 -5.954 1.00 0.16 C ATOM 948 O THR A 67 0.924 -2.999 -6.390 1.00 0.21 O ATOM 949 CB THR A 67 -2.277 -2.087 -6.912 1.00 0.17 C ATOM 950 OG1 THR A 67 -3.318 -2.231 -7.891 1.00 0.22 O ATOM 951 CG2 THR A 67 -1.457 -0.835 -7.207 1.00 0.19 C ATOM 952 H THR A 67 -3.020 -4.433 -6.109 1.00 0.13 H ATOM 953 HA THR A 67 -1.000 -3.482 -7.907 1.00 0.17 H ATOM 954 HB THR A 67 -2.722 -1.989 -5.940 1.00 0.19 H ATOM 955 HG1 THR A 67 -4.019 -2.802 -7.542 1.00 0.29 H ATOM 956 HG21 THR A 67 -2.105 0.029 -7.218 1.00 1.03 H ATOM 957 HG22 THR A 67 -0.976 -0.936 -8.169 1.00 1.04 H ATOM 958 HG23 THR A 67 -0.701 -0.707 -6.442 1.00 1.03 H ATOM 959 N LEU A 68 -0.492 -3.188 -4.654 1.00 0.17 N ATOM 960 CA LEU A 68 0.553 -3.042 -3.642 1.00 0.20 C ATOM 961 C LEU A 68 1.689 -3.996 -3.920 1.00 0.20 C ATOM 962 O LEU A 68 2.838 -3.594 -4.066 1.00 0.23 O ATOM 963 CB LEU A 68 0.024 -3.391 -2.259 1.00 0.30 C ATOM 964 CG LEU A 68 -1.275 -2.734 -1.854 1.00 0.79 C ATOM 965 CD1 LEU A 68 -1.863 -3.493 -0.684 1.00 1.38 C ATOM 966 CD2 LEU A 68 -1.047 -1.276 -1.496 1.00 1.40 C ATOM 967 H LEU A 68 -1.425 -3.315 -4.366 1.00 0.16 H ATOM 968 HA LEU A 68 0.913 -2.024 -3.658 1.00 0.25 H ATOM 969 HB2 LEU A 68 -0.116 -4.460 -2.217 1.00 0.82 H ATOM 970 HB3 LEU A 68 0.775 -3.120 -1.537 1.00 0.85 H ATOM 971 HG LEU A 68 -1.974 -2.780 -2.676 1.00 0.98 H ATOM 972 HD11 LEU A 68 -1.351 -3.210 0.224 1.00 1.76 H ATOM 973 HD12 LEU A 68 -1.742 -4.553 -0.846 1.00 1.88 H ATOM 974 HD13 LEU A 68 -2.912 -3.262 -0.596 1.00 1.92 H ATOM 975 HD21 LEU A 68 -0.600 -0.764 -2.335 1.00 2.06 H ATOM 976 HD22 LEU A 68 -0.388 -1.215 -0.642 1.00 1.88 H ATOM 977 HD23 LEU A 68 -1.991 -0.813 -1.254 1.00 1.68 H ATOM 978 N THR A 69 1.334 -5.266 -3.980 1.00 0.22 N ATOM 979 CA THR A 69 2.263 -6.338 -4.214 1.00 0.25 C ATOM 980 C THR A 69 3.126 -6.084 -5.443 1.00 0.25 C ATOM 981 O THR A 69 4.310 -6.410 -5.464 1.00 0.33 O ATOM 982 CB THR A 69 1.464 -7.648 -4.393 1.00 0.34 C ATOM 983 OG1 THR A 69 1.268 -8.290 -3.131 1.00 1.01 O ATOM 984 CG2 THR A 69 2.131 -8.587 -5.382 1.00 0.65 C ATOM 985 H THR A 69 0.389 -5.507 -3.851 1.00 0.23 H ATOM 986 HA THR A 69 2.893 -6.424 -3.339 1.00 0.25 H ATOM 987 HB THR A 69 0.492 -7.387 -4.789 1.00 0.80 H ATOM 988 HG1 THR A 69 2.113 -8.647 -2.823 1.00 0.95 H ATOM 989 HG21 THR A 69 1.536 -9.479 -5.491 1.00 1.27 H ATOM 990 HG22 THR A 69 3.116 -8.847 -5.023 1.00 1.28 H ATOM 991 HG23 THR A 69 2.212 -8.083 -6.339 1.00 1.25 H ATOM 992 N HIS A 70 2.533 -5.491 -6.456 1.00 0.21 N ATOM 993 CA HIS A 70 3.233 -5.261 -7.698 1.00 0.22 C ATOM 994 C HIS A 70 4.206 -4.102 -7.564 1.00 0.21 C ATOM 995 O HIS A 70 5.270 -4.113 -8.164 1.00 0.28 O ATOM 996 CB HIS A 70 2.225 -4.996 -8.819 1.00 0.24 C ATOM 997 CG HIS A 70 2.848 -4.785 -10.169 1.00 0.30 C ATOM 998 ND1 HIS A 70 3.042 -5.802 -11.078 1.00 0.39 N ATOM 999 CD2 HIS A 70 3.319 -3.664 -10.761 1.00 0.34 C ATOM 1000 CE1 HIS A 70 3.607 -5.316 -12.167 1.00 0.45 C ATOM 1001 NE2 HIS A 70 3.786 -4.020 -12.001 1.00 0.41 N ATOM 1002 H HIS A 70 1.601 -5.200 -6.363 1.00 0.22 H ATOM 1003 HA HIS A 70 3.794 -6.150 -7.922 1.00 0.25 H ATOM 1004 HB2 HIS A 70 1.545 -5.830 -8.889 1.00 0.25 H ATOM 1005 HB3 HIS A 70 1.662 -4.117 -8.568 1.00 0.25 H ATOM 1006 HD1 HIS A 70 2.796 -6.746 -10.946 1.00 0.44 H ATOM 1007 HD2 HIS A 70 3.329 -2.672 -10.332 1.00 0.37 H ATOM 1008 HE1 HIS A 70 3.876 -5.883 -13.045 1.00 0.54 H ATOM 1009 HE2 HIS A 70 4.351 -3.455 -12.573 1.00 0.50 H ATOM 1010 N ASN A 71 3.830 -3.103 -6.787 1.00 0.19 N ATOM 1011 CA ASN A 71 4.665 -1.922 -6.607 1.00 0.22 C ATOM 1012 C ASN A 71 5.679 -2.094 -5.483 1.00 0.20 C ATOM 1013 O ASN A 71 6.647 -1.344 -5.401 1.00 0.25 O ATOM 1014 CB ASN A 71 3.802 -0.701 -6.347 1.00 0.32 C ATOM 1015 CG ASN A 71 2.992 -0.314 -7.564 1.00 0.61 C ATOM 1016 OD1 ASN A 71 3.432 0.472 -8.403 1.00 1.44 O ATOM 1017 ND2 ASN A 71 1.808 -0.879 -7.674 1.00 0.22 N ATOM 1018 H ASN A 71 2.949 -3.137 -6.358 1.00 0.20 H ATOM 1019 HA ASN A 71 5.194 -1.757 -7.525 1.00 0.29 H ATOM 1020 HB2 ASN A 71 3.122 -0.914 -5.534 1.00 0.39 H ATOM 1021 HB3 ASN A 71 4.435 0.132 -6.077 1.00 0.27 H ATOM 1022 HD21 ASN A 71 1.536 -1.512 -6.976 1.00 0.75 H ATOM 1023 HD22 ASN A 71 1.246 -0.643 -8.437 1.00 0.26 H ATOM 1024 N THR A 72 5.461 -3.071 -4.610 1.00 0.18 N ATOM 1025 CA THR A 72 6.330 -3.260 -3.467 1.00 0.19 C ATOM 1026 C THR A 72 7.053 -4.588 -3.527 1.00 0.23 C ATOM 1027 O THR A 72 8.027 -4.797 -2.812 1.00 0.25 O ATOM 1028 CB THR A 72 5.531 -3.178 -2.163 1.00 0.19 C ATOM 1029 OG1 THR A 72 4.584 -4.254 -2.115 1.00 0.21 O ATOM 1030 CG2 THR A 72 4.784 -1.853 -2.084 1.00 0.16 C ATOM 1031 H THR A 72 4.691 -3.663 -4.723 1.00 0.18 H ATOM 1032 HA THR A 72 7.065 -2.471 -3.469 1.00 0.21 H ATOM 1033 HB THR A 72 6.209 -3.256 -1.327 1.00 0.22 H ATOM 1034 HG1 THR A 72 3.825 -4.031 -2.668 1.00 0.21 H ATOM 1035 HG21 THR A 72 3.817 -1.966 -2.553 1.00 0.99 H ATOM 1036 HG22 THR A 72 5.346 -1.084 -2.604 1.00 0.99 H ATOM 1037 HG23 THR A 72 4.657 -1.571 -1.050 1.00 1.01 H ATOM 1038 N GLY A 73 6.558 -5.498 -4.351 1.00 0.27 N ATOM 1039 CA GLY A 73 7.263 -6.739 -4.566 1.00 0.35 C ATOM 1040 C GLY A 73 6.988 -7.760 -3.488 1.00 0.39 C ATOM 1041 O GLY A 73 7.599 -8.829 -3.458 1.00 0.46 O ATOM 1042 H GLY A 73 5.695 -5.337 -4.802 1.00 0.26 H ATOM 1043 HA2 GLY A 73 6.980 -7.149 -5.521 1.00 0.40 H ATOM 1044 HA3 GLY A 73 8.314 -6.525 -4.575 1.00 0.37 H ATOM 1045 N LEU A 74 6.065 -7.438 -2.603 1.00 0.39 N ATOM 1046 CA LEU A 74 5.757 -8.295 -1.483 1.00 0.45 C ATOM 1047 C LEU A 74 4.650 -9.256 -1.826 1.00 0.62 C ATOM 1048 O LEU A 74 3.695 -8.907 -2.507 1.00 1.10 O ATOM 1049 CB LEU A 74 5.362 -7.451 -0.276 1.00 0.46 C ATOM 1050 CG LEU A 74 6.080 -7.810 1.018 1.00 0.53 C ATOM 1051 CD1 LEU A 74 5.845 -9.262 1.408 1.00 1.12 C ATOM 1052 CD2 LEU A 74 7.560 -7.526 0.847 1.00 0.94 C ATOM 1053 H LEU A 74 5.565 -6.605 -2.713 1.00 0.36 H ATOM 1054 HA LEU A 74 6.638 -8.872 -1.247 1.00 0.46 H ATOM 1055 HB2 LEU A 74 5.581 -6.417 -0.506 1.00 0.45 H ATOM 1056 HB3 LEU A 74 4.302 -7.545 -0.119 1.00 0.56 H ATOM 1057 HG LEU A 74 5.699 -7.195 1.812 1.00 0.94 H ATOM 1058 HD11 LEU A 74 4.784 -9.442 1.500 1.00 1.74 H ATOM 1059 HD12 LEU A 74 6.329 -9.464 2.352 1.00 1.64 H ATOM 1060 HD13 LEU A 74 6.254 -9.910 0.648 1.00 1.61 H ATOM 1061 HD21 LEU A 74 7.707 -6.465 0.709 1.00 1.57 H ATOM 1062 HD22 LEU A 74 7.921 -8.051 -0.028 1.00 1.43 H ATOM 1063 HD23 LEU A 74 8.100 -7.859 1.720 1.00 1.53 H ATOM 1064 N ASP A 75 4.788 -10.465 -1.335 1.00 0.54 N ATOM 1065 CA ASP A 75 3.818 -11.502 -1.596 1.00 0.72 C ATOM 1066 C ASP A 75 3.323 -12.108 -0.294 1.00 0.78 C ATOM 1067 O ASP A 75 3.510 -13.292 -0.024 1.00 0.98 O ATOM 1068 CB ASP A 75 4.441 -12.567 -2.478 1.00 1.04 C ATOM 1069 CG ASP A 75 3.455 -13.653 -2.872 1.00 1.31 C ATOM 1070 OD1 ASP A 75 3.757 -14.845 -2.653 1.00 1.45 O ATOM 1071 OD2 ASP A 75 2.370 -13.321 -3.402 1.00 1.55 O ATOM 1072 H ASP A 75 5.576 -10.673 -0.782 1.00 0.71 H ATOM 1073 HA ASP A 75 2.986 -11.057 -2.117 1.00 0.90 H ATOM 1074 HB2 ASP A 75 4.827 -12.099 -3.372 1.00 1.20 H ATOM 1075 HB3 ASP A 75 5.252 -13.015 -1.936 1.00 1.12 H ATOM 1076 N LEU A 76 2.721 -11.279 0.534 1.00 0.91 N ATOM 1077 CA LEU A 76 2.086 -11.766 1.748 1.00 1.31 C ATOM 1078 C LEU A 76 0.566 -11.842 1.536 1.00 0.97 C ATOM 1079 O LEU A 76 0.021 -11.064 0.747 1.00 0.95 O ATOM 1080 CB LEU A 76 2.436 -10.854 2.933 1.00 1.98 C ATOM 1081 CG LEU A 76 2.428 -11.529 4.310 1.00 2.77 C ATOM 1082 CD1 LEU A 76 3.523 -12.584 4.401 1.00 3.54 C ATOM 1083 CD2 LEU A 76 2.606 -10.504 5.409 1.00 3.31 C ATOM 1084 H LEU A 76 2.702 -10.320 0.326 1.00 0.87 H ATOM 1085 HA LEU A 76 2.460 -12.760 1.939 1.00 1.67 H ATOM 1086 HB2 LEU A 76 3.422 -10.448 2.762 1.00 2.18 H ATOM 1087 HB3 LEU A 76 1.730 -10.041 2.952 1.00 2.29 H ATOM 1088 HG LEU A 76 1.477 -12.016 4.461 1.00 3.11 H ATOM 1089 HD11 LEU A 76 4.486 -12.113 4.273 1.00 3.96 H ATOM 1090 HD12 LEU A 76 3.379 -13.324 3.629 1.00 3.87 H ATOM 1091 HD13 LEU A 76 3.482 -13.062 5.368 1.00 3.94 H ATOM 1092 HD21 LEU A 76 3.541 -9.984 5.269 1.00 3.71 H ATOM 1093 HD22 LEU A 76 2.611 -11.003 6.367 1.00 3.62 H ATOM 1094 HD23 LEU A 76 1.791 -9.797 5.377 1.00 3.63 H ATOM 1095 N PRO A 77 -0.110 -12.822 2.183 1.00 1.11 N ATOM 1096 CA PRO A 77 -1.561 -13.044 2.135 1.00 1.07 C ATOM 1097 C PRO A 77 -2.431 -11.808 1.857 1.00 0.78 C ATOM 1098 O PRO A 77 -2.230 -10.742 2.431 1.00 0.84 O ATOM 1099 CB PRO A 77 -1.852 -13.573 3.546 1.00 1.63 C ATOM 1100 CG PRO A 77 -0.542 -14.076 4.085 1.00 1.97 C ATOM 1101 CD PRO A 77 0.493 -13.866 3.011 1.00 1.67 C ATOM 1102 HA PRO A 77 -1.809 -13.813 1.422 1.00 1.11 H ATOM 1103 HB2 PRO A 77 -2.243 -12.770 4.154 1.00 1.72 H ATOM 1104 HB3 PRO A 77 -2.581 -14.366 3.487 1.00 1.92 H ATOM 1105 HG2 PRO A 77 -0.275 -13.519 4.970 1.00 2.26 H ATOM 1106 HG3 PRO A 77 -0.627 -15.127 4.320 1.00 2.42 H ATOM 1107 HD2 PRO A 77 1.424 -13.537 3.439 1.00 1.89 H ATOM 1108 HD3 PRO A 77 0.636 -14.773 2.442 1.00 1.89 H ATOM 1109 N PRO A 78 -3.432 -11.980 0.969 1.00 0.60 N ATOM 1110 CA PRO A 78 -4.467 -10.963 0.631 1.00 0.50 C ATOM 1111 C PRO A 78 -5.233 -10.398 1.807 1.00 0.67 C ATOM 1112 O PRO A 78 -6.052 -9.494 1.646 1.00 1.62 O ATOM 1113 CB PRO A 78 -5.440 -11.761 -0.212 1.00 0.60 C ATOM 1114 CG PRO A 78 -4.603 -12.785 -0.878 1.00 0.76 C ATOM 1115 CD PRO A 78 -3.614 -13.207 0.165 1.00 0.75 C ATOM 1116 HA PRO A 78 -4.073 -10.149 0.058 1.00 0.54 H ATOM 1117 HB2 PRO A 78 -6.171 -12.213 0.445 1.00 0.64 H ATOM 1118 HB3 PRO A 78 -5.928 -11.115 -0.918 1.00 0.66 H ATOM 1119 HG2 PRO A 78 -5.212 -13.621 -1.185 1.00 0.95 H ATOM 1120 HG3 PRO A 78 -4.094 -12.353 -1.727 1.00 1.20 H ATOM 1121 HD2 PRO A 78 -4.017 -14.007 0.767 1.00 0.99 H ATOM 1122 HD3 PRO A 78 -2.686 -13.506 -0.297 1.00 1.12 H ATOM 1123 N THR A 79 -4.956 -10.891 2.977 1.00 0.55 N ATOM 1124 CA THR A 79 -5.668 -10.459 4.148 1.00 0.40 C ATOM 1125 C THR A 79 -4.897 -9.330 4.817 1.00 0.33 C ATOM 1126 O THR A 79 -4.952 -9.138 6.034 1.00 0.37 O ATOM 1127 CB THR A 79 -5.902 -11.638 5.097 1.00 0.45 C ATOM 1128 OG1 THR A 79 -4.683 -12.371 5.283 1.00 0.52 O ATOM 1129 CG2 THR A 79 -6.966 -12.554 4.516 1.00 0.53 C ATOM 1130 H THR A 79 -4.191 -11.486 3.075 1.00 1.28 H ATOM 1131 HA THR A 79 -6.630 -10.081 3.828 1.00 0.42 H ATOM 1132 HB THR A 79 -6.245 -11.261 6.046 1.00 0.42 H ATOM 1133 HG1 THR A 79 -4.886 -13.312 5.353 1.00 0.95 H ATOM 1134 HG21 THR A 79 -7.908 -12.028 4.471 1.00 1.16 H ATOM 1135 HG22 THR A 79 -7.070 -13.430 5.136 1.00 0.99 H ATOM 1136 HG23 THR A 79 -6.674 -12.850 3.514 1.00 1.28 H ATOM 1137 N LEU A 80 -4.197 -8.569 3.978 1.00 0.32 N ATOM 1138 CA LEU A 80 -3.397 -7.444 4.428 1.00 0.32 C ATOM 1139 C LEU A 80 -4.291 -6.286 4.810 1.00 0.22 C ATOM 1140 O LEU A 80 -3.967 -5.528 5.714 1.00 0.21 O ATOM 1141 CB LEU A 80 -2.415 -6.999 3.340 1.00 0.43 C ATOM 1142 CG LEU A 80 -1.336 -8.016 2.977 1.00 1.21 C ATOM 1143 CD1 LEU A 80 -0.412 -7.457 1.906 1.00 1.91 C ATOM 1144 CD2 LEU A 80 -0.545 -8.419 4.212 1.00 1.97 C ATOM 1145 H LEU A 80 -4.244 -8.764 3.019 1.00 0.36 H ATOM 1146 HA LEU A 80 -2.841 -7.759 5.298 1.00 0.38 H ATOM 1147 HB2 LEU A 80 -2.980 -6.771 2.448 1.00 1.16 H ATOM 1148 HB3 LEU A 80 -1.928 -6.096 3.675 1.00 1.17 H ATOM 1149 HG LEU A 80 -1.808 -8.903 2.577 1.00 1.98 H ATOM 1150 HD11 LEU A 80 0.339 -8.193 1.661 1.00 2.46 H ATOM 1151 HD12 LEU A 80 0.067 -6.563 2.276 1.00 2.33 H ATOM 1152 HD13 LEU A 80 -0.986 -7.220 1.024 1.00 2.39 H ATOM 1153 HD21 LEU A 80 0.244 -9.098 3.928 1.00 2.26 H ATOM 1154 HD22 LEU A 80 -1.202 -8.909 4.916 1.00 2.53 H ATOM 1155 HD23 LEU A 80 -0.118 -7.539 4.669 1.00 2.52 H ATOM 1156 N ILE A 81 -5.416 -6.147 4.117 1.00 0.18 N ATOM 1157 CA ILE A 81 -6.381 -5.093 4.460 1.00 0.13 C ATOM 1158 C ILE A 81 -7.026 -5.404 5.802 1.00 0.15 C ATOM 1159 O ILE A 81 -7.278 -4.521 6.620 1.00 0.16 O ATOM 1160 CB ILE A 81 -7.490 -4.938 3.389 1.00 0.12 C ATOM 1161 CG1 ILE A 81 -6.885 -4.763 2.016 1.00 0.13 C ATOM 1162 CG2 ILE A 81 -8.352 -3.729 3.669 1.00 0.13 C ATOM 1163 CD1 ILE A 81 -5.782 -3.752 2.003 1.00 0.13 C ATOM 1164 H ILE A 81 -5.597 -6.754 3.354 1.00 0.20 H ATOM 1165 HA ILE A 81 -5.845 -4.158 4.540 1.00 0.13 H ATOM 1166 HB ILE A 81 -8.112 -5.815 3.400 1.00 0.14 H ATOM 1167 HG12 ILE A 81 -6.492 -5.693 1.665 1.00 0.15 H ATOM 1168 HG13 ILE A 81 -7.656 -4.417 1.344 1.00 0.13 H ATOM 1169 HG21 ILE A 81 -7.804 -2.835 3.391 1.00 0.98 H ATOM 1170 HG22 ILE A 81 -8.602 -3.692 4.717 1.00 1.03 H ATOM 1171 HG23 ILE A 81 -9.253 -3.788 3.078 1.00 1.01 H ATOM 1172 HD11 ILE A 81 -5.306 -3.757 1.038 1.00 1.02 H ATOM 1173 HD12 ILE A 81 -5.060 -3.998 2.772 1.00 1.04 H ATOM 1174 HD13 ILE A 81 -6.195 -2.775 2.202 1.00 1.01 H ATOM 1175 N PHE A 82 -7.290 -6.680 6.001 1.00 0.20 N ATOM 1176 CA PHE A 82 -7.875 -7.182 7.227 1.00 0.25 C ATOM 1177 C PHE A 82 -6.926 -7.006 8.419 1.00 0.25 C ATOM 1178 O PHE A 82 -7.369 -6.846 9.556 1.00 0.30 O ATOM 1179 CB PHE A 82 -8.232 -8.656 7.028 1.00 0.32 C ATOM 1180 CG PHE A 82 -9.269 -8.898 5.957 1.00 0.36 C ATOM 1181 CD1 PHE A 82 -10.541 -9.326 6.302 1.00 0.46 C ATOM 1182 CD2 PHE A 82 -8.978 -8.702 4.609 1.00 0.34 C ATOM 1183 CE1 PHE A 82 -11.498 -9.554 5.334 1.00 0.52 C ATOM 1184 CE2 PHE A 82 -9.935 -8.929 3.639 1.00 0.40 C ATOM 1185 CZ PHE A 82 -11.195 -9.356 4.002 1.00 0.49 C ATOM 1186 H PHE A 82 -7.133 -7.307 5.271 1.00 0.21 H ATOM 1187 HA PHE A 82 -8.780 -6.625 7.415 1.00 0.28 H ATOM 1188 HB2 PHE A 82 -7.340 -9.201 6.753 1.00 0.33 H ATOM 1189 HB3 PHE A 82 -8.613 -9.049 7.952 1.00 0.35 H ATOM 1190 HD1 PHE A 82 -10.783 -9.482 7.340 1.00 0.49 H ATOM 1191 HD2 PHE A 82 -7.994 -8.361 4.317 1.00 0.30 H ATOM 1192 HE1 PHE A 82 -12.483 -9.888 5.620 1.00 0.61 H ATOM 1193 HE2 PHE A 82 -9.696 -8.773 2.599 1.00 0.40 H ATOM 1194 HZ PHE A 82 -11.945 -9.535 3.245 1.00 0.55 H ATOM 1195 N ASP A 83 -5.624 -7.031 8.152 1.00 0.23 N ATOM 1196 CA ASP A 83 -4.614 -6.866 9.205 1.00 0.25 C ATOM 1197 C ASP A 83 -4.168 -5.409 9.307 1.00 0.24 C ATOM 1198 O ASP A 83 -3.786 -4.931 10.374 1.00 0.38 O ATOM 1199 CB ASP A 83 -3.401 -7.758 8.923 1.00 0.29 C ATOM 1200 CG ASP A 83 -2.389 -7.753 10.057 1.00 0.34 C ATOM 1201 OD1 ASP A 83 -2.764 -8.083 11.201 1.00 0.48 O ATOM 1202 OD2 ASP A 83 -1.204 -7.438 9.805 1.00 0.47 O ATOM 1203 H ASP A 83 -5.332 -7.177 7.230 1.00 0.23 H ATOM 1204 HA ASP A 83 -5.059 -7.162 10.142 1.00 0.28 H ATOM 1205 HB2 ASP A 83 -3.735 -8.768 8.769 1.00 0.33 H ATOM 1206 HB3 ASP A 83 -2.911 -7.407 8.029 1.00 0.28 H ATOM 1207 N HIS A 84 -4.222 -4.709 8.187 1.00 0.14 N ATOM 1208 CA HIS A 84 -3.821 -3.308 8.112 1.00 0.12 C ATOM 1209 C HIS A 84 -4.926 -2.515 7.436 1.00 0.11 C ATOM 1210 O HIS A 84 -4.964 -2.403 6.214 1.00 0.14 O ATOM 1211 CB HIS A 84 -2.515 -3.159 7.330 1.00 0.14 C ATOM 1212 CG HIS A 84 -1.304 -3.629 8.078 1.00 0.19 C ATOM 1213 ND1 HIS A 84 -0.472 -2.788 8.787 1.00 0.22 N ATOM 1214 CD2 HIS A 84 -0.783 -4.868 8.218 1.00 0.25 C ATOM 1215 CE1 HIS A 84 0.506 -3.491 9.326 1.00 0.27 C ATOM 1216 NE2 HIS A 84 0.342 -4.756 8.997 1.00 0.29 N ATOM 1217 H HIS A 84 -4.576 -5.139 7.373 1.00 0.21 H ATOM 1218 HA HIS A 84 -3.683 -2.941 9.117 1.00 0.13 H ATOM 1219 HB2 HIS A 84 -2.586 -3.739 6.426 1.00 0.16 H ATOM 1220 HB3 HIS A 84 -2.374 -2.123 7.067 1.00 0.14 H ATOM 1221 HD1 HIS A 84 -0.579 -1.816 8.887 1.00 0.24 H ATOM 1222 HD2 HIS A 84 -1.183 -5.783 7.800 1.00 0.30 H ATOM 1223 HE1 HIS A 84 1.306 -3.095 9.933 1.00 0.32 H ATOM 1224 HE2 HIS A 84 0.801 -5.508 9.437 1.00 0.33 H ATOM 1225 N PRO A 85 -5.837 -1.950 8.230 1.00 0.10 N ATOM 1226 CA PRO A 85 -7.106 -1.444 7.727 1.00 0.09 C ATOM 1227 C PRO A 85 -7.080 -0.014 7.196 1.00 0.08 C ATOM 1228 O PRO A 85 -8.124 0.510 6.827 1.00 0.09 O ATOM 1229 CB PRO A 85 -7.992 -1.524 8.964 1.00 0.12 C ATOM 1230 CG PRO A 85 -7.067 -1.236 10.097 1.00 0.14 C ATOM 1231 CD PRO A 85 -5.718 -1.779 9.692 1.00 0.13 C ATOM 1232 HA PRO A 85 -7.503 -2.093 6.957 1.00 0.10 H ATOM 1233 HB2 PRO A 85 -8.780 -0.789 8.897 1.00 0.15 H ATOM 1234 HB3 PRO A 85 -8.417 -2.513 9.046 1.00 0.16 H ATOM 1235 HG2 PRO A 85 -7.006 -0.171 10.259 1.00 0.15 H ATOM 1236 HG3 PRO A 85 -7.414 -1.732 10.991 1.00 0.17 H ATOM 1237 HD2 PRO A 85 -4.940 -1.072 9.934 1.00 0.14 H ATOM 1238 HD3 PRO A 85 -5.534 -2.726 10.176 1.00 0.16 H ATOM 1239 N THR A 86 -5.926 0.629 7.138 1.00 0.07 N ATOM 1240 CA THR A 86 -5.870 1.980 6.601 1.00 0.07 C ATOM 1241 C THR A 86 -4.746 2.111 5.578 1.00 0.07 C ATOM 1242 O THR A 86 -3.803 1.320 5.609 1.00 0.07 O ATOM 1243 CB THR A 86 -5.666 3.031 7.706 1.00 0.08 C ATOM 1244 OG1 THR A 86 -4.406 2.822 8.354 1.00 0.09 O ATOM 1245 CG2 THR A 86 -6.781 2.984 8.740 1.00 0.09 C ATOM 1246 H THR A 86 -5.098 0.201 7.434 1.00 0.07 H ATOM 1247 HA THR A 86 -6.807 2.177 6.114 1.00 0.07 H ATOM 1248 HB THR A 86 -5.670 4.005 7.243 1.00 0.09 H ATOM 1249 HG1 THR A 86 -4.491 3.026 9.293 1.00 0.27 H ATOM 1250 HG21 THR A 86 -6.849 1.987 9.149 1.00 0.96 H ATOM 1251 HG22 THR A 86 -7.717 3.248 8.273 1.00 0.99 H ATOM 1252 HG23 THR A 86 -6.565 3.684 9.533 1.00 1.00 H ATOM 1253 N PRO A 87 -4.826 3.081 4.640 1.00 0.08 N ATOM 1254 CA PRO A 87 -3.733 3.336 3.696 1.00 0.09 C ATOM 1255 C PRO A 87 -2.417 3.582 4.422 1.00 0.09 C ATOM 1256 O PRO A 87 -1.346 3.210 3.940 1.00 0.11 O ATOM 1257 CB PRO A 87 -4.185 4.574 2.924 1.00 0.09 C ATOM 1258 CG PRO A 87 -5.669 4.579 3.058 1.00 0.09 C ATOM 1259 CD PRO A 87 -5.976 3.967 4.399 1.00 0.08 C ATOM 1260 HA PRO A 87 -3.611 2.518 3.016 1.00 0.10 H ATOM 1261 HB2 PRO A 87 -3.740 5.455 3.355 1.00 0.09 H ATOM 1262 HB3 PRO A 87 -3.885 4.483 1.891 1.00 0.11 H ATOM 1263 HG2 PRO A 87 -6.037 5.594 3.017 1.00 0.10 H ATOM 1264 HG3 PRO A 87 -6.110 3.989 2.269 1.00 0.10 H ATOM 1265 HD2 PRO A 87 -6.040 4.733 5.158 1.00 0.08 H ATOM 1266 HD3 PRO A 87 -6.895 3.404 4.353 1.00 0.08 H ATOM 1267 N HIS A 88 -2.518 4.191 5.599 1.00 0.09 N ATOM 1268 CA HIS A 88 -1.380 4.343 6.490 1.00 0.09 C ATOM 1269 C HIS A 88 -0.885 2.970 6.928 1.00 0.08 C ATOM 1270 O HIS A 88 0.287 2.650 6.775 1.00 0.09 O ATOM 1271 CB HIS A 88 -1.791 5.176 7.708 1.00 0.12 C ATOM 1272 CG HIS A 88 -0.695 5.414 8.702 1.00 0.19 C ATOM 1273 ND1 HIS A 88 0.433 6.157 8.430 1.00 0.28 N ATOM 1274 CD2 HIS A 88 -0.570 4.999 9.981 1.00 0.23 C ATOM 1275 CE1 HIS A 88 1.206 6.184 9.501 1.00 0.33 C ATOM 1276 NE2 HIS A 88 0.618 5.490 10.457 1.00 0.30 N ATOM 1277 H HIS A 88 -3.391 4.543 5.882 1.00 0.09 H ATOM 1278 HA HIS A 88 -0.588 4.850 5.959 1.00 0.11 H ATOM 1279 HB2 HIS A 88 -2.149 6.135 7.374 1.00 0.13 H ATOM 1280 HB3 HIS A 88 -2.593 4.665 8.220 1.00 0.12 H ATOM 1281 HD1 HIS A 88 0.635 6.614 7.582 1.00 0.34 H ATOM 1282 HD2 HIS A 88 -1.279 4.395 10.530 1.00 0.27 H ATOM 1283 HE1 HIS A 88 2.156 6.691 9.581 1.00 0.42 H ATOM 1284 HE2 HIS A 88 0.873 5.517 11.405 1.00 0.36 H ATOM 1285 N ALA A 89 -1.803 2.164 7.451 1.00 0.09 N ATOM 1286 CA ALA A 89 -1.492 0.819 7.922 1.00 0.10 C ATOM 1287 C ALA A 89 -0.845 -0.037 6.844 1.00 0.09 C ATOM 1288 O ALA A 89 0.217 -0.615 7.067 1.00 0.10 O ATOM 1289 CB ALA A 89 -2.750 0.139 8.419 1.00 0.12 C ATOM 1290 H ALA A 89 -2.728 2.492 7.541 1.00 0.09 H ATOM 1291 HA ALA A 89 -0.809 0.905 8.753 1.00 0.10 H ATOM 1292 HB1 ALA A 89 -2.504 -0.851 8.775 1.00 1.03 H ATOM 1293 HB2 ALA A 89 -3.461 0.063 7.605 1.00 1.03 H ATOM 1294 HB3 ALA A 89 -3.183 0.717 9.222 1.00 1.03 H ATOM 1295 N LEU A 90 -1.502 -0.156 5.694 1.00 0.10 N ATOM 1296 CA LEU A 90 -0.963 -0.924 4.575 1.00 0.11 C ATOM 1297 C LEU A 90 0.423 -0.449 4.226 1.00 0.11 C ATOM 1298 O LEU A 90 1.329 -1.249 3.976 1.00 0.12 O ATOM 1299 CB LEU A 90 -1.847 -0.762 3.351 1.00 0.13 C ATOM 1300 CG LEU A 90 -2.260 -2.053 2.659 1.00 0.25 C ATOM 1301 CD1 LEU A 90 -2.883 -3.027 3.642 1.00 0.73 C ATOM 1302 CD2 LEU A 90 -3.236 -1.741 1.547 1.00 0.68 C ATOM 1303 H LEU A 90 -2.394 0.251 5.594 1.00 0.10 H ATOM 1304 HA LEU A 90 -0.923 -1.961 4.859 1.00 0.12 H ATOM 1305 HB2 LEU A 90 -2.728 -0.223 3.636 1.00 0.27 H ATOM 1306 HB3 LEU A 90 -1.308 -0.166 2.635 1.00 0.25 H ATOM 1307 HG LEU A 90 -1.390 -2.520 2.224 1.00 0.83 H ATOM 1308 HD11 LEU A 90 -3.111 -3.951 3.134 1.00 1.27 H ATOM 1309 HD12 LEU A 90 -3.794 -2.603 4.039 1.00 1.34 H ATOM 1310 HD13 LEU A 90 -2.194 -3.220 4.447 1.00 1.41 H ATOM 1311 HD21 LEU A 90 -3.534 -2.658 1.066 1.00 1.37 H ATOM 1312 HD22 LEU A 90 -2.766 -1.089 0.825 1.00 1.25 H ATOM 1313 HD23 LEU A 90 -4.109 -1.255 1.959 1.00 1.32 H ATOM 1314 N THR A 91 0.575 0.858 4.208 1.00 0.11 N ATOM 1315 CA THR A 91 1.849 1.461 3.939 1.00 0.12 C ATOM 1316 C THR A 91 2.873 1.017 4.978 1.00 0.12 C ATOM 1317 O THR A 91 3.968 0.580 4.633 1.00 0.13 O ATOM 1318 CB THR A 91 1.735 3.002 3.932 1.00 0.12 C ATOM 1319 OG1 THR A 91 1.098 3.444 2.732 1.00 0.13 O ATOM 1320 CG2 THR A 91 3.091 3.673 4.090 1.00 0.13 C ATOM 1321 H THR A 91 -0.201 1.434 4.377 1.00 0.11 H ATOM 1322 HA THR A 91 2.154 1.118 2.959 1.00 0.14 H ATOM 1323 HB THR A 91 1.117 3.292 4.770 1.00 0.10 H ATOM 1324 HG1 THR A 91 0.140 3.418 2.855 1.00 0.13 H ATOM 1325 HG21 THR A 91 3.818 3.160 3.481 1.00 1.01 H ATOM 1326 HG22 THR A 91 3.394 3.630 5.126 1.00 1.00 H ATOM 1327 HG23 THR A 91 3.020 4.703 3.778 1.00 1.03 H ATOM 1328 N GLN A 92 2.488 1.114 6.248 1.00 0.11 N ATOM 1329 CA GLN A 92 3.327 0.680 7.357 1.00 0.12 C ATOM 1330 C GLN A 92 3.785 -0.759 7.159 1.00 0.13 C ATOM 1331 O GLN A 92 4.916 -1.115 7.483 1.00 0.16 O ATOM 1332 CB GLN A 92 2.557 0.799 8.671 1.00 0.12 C ATOM 1333 CG GLN A 92 2.150 2.216 9.024 1.00 0.16 C ATOM 1334 CD GLN A 92 1.692 2.335 10.461 1.00 0.47 C ATOM 1335 OE1 GLN A 92 0.512 2.154 10.764 1.00 1.42 O ATOM 1336 NE2 GLN A 92 2.617 2.644 11.352 1.00 1.06 N ATOM 1337 H GLN A 92 1.605 1.498 6.446 1.00 0.12 H ATOM 1338 HA GLN A 92 4.192 1.320 7.393 1.00 0.13 H ATOM 1339 HB2 GLN A 92 1.659 0.204 8.596 1.00 0.14 H ATOM 1340 HB3 GLN A 92 3.162 0.410 9.471 1.00 0.13 H ATOM 1341 HG2 GLN A 92 2.986 2.876 8.864 1.00 0.29 H ATOM 1342 HG3 GLN A 92 1.335 2.510 8.378 1.00 0.26 H ATOM 1343 HE21 GLN A 92 3.538 2.778 11.039 1.00 1.80 H ATOM 1344 HE22 GLN A 92 2.348 2.718 12.293 1.00 1.13 H ATOM 1345 N HIS A 93 2.893 -1.571 6.614 1.00 0.14 N ATOM 1346 CA HIS A 93 3.185 -2.969 6.343 1.00 0.17 C ATOM 1347 C HIS A 93 4.330 -3.113 5.346 1.00 0.19 C ATOM 1348 O HIS A 93 5.329 -3.764 5.636 1.00 0.21 O ATOM 1349 CB HIS A 93 1.925 -3.672 5.820 1.00 0.20 C ATOM 1350 CG HIS A 93 2.172 -5.048 5.288 1.00 0.27 C ATOM 1351 ND1 HIS A 93 2.444 -6.130 6.091 1.00 0.31 N ATOM 1352 CD2 HIS A 93 2.204 -5.509 4.014 1.00 0.36 C ATOM 1353 CE1 HIS A 93 2.637 -7.193 5.342 1.00 0.38 C ATOM 1354 NE2 HIS A 93 2.496 -6.848 4.074 1.00 0.41 N ATOM 1355 H HIS A 93 2.006 -1.215 6.385 1.00 0.16 H ATOM 1356 HA HIS A 93 3.482 -3.431 7.273 1.00 0.18 H ATOM 1357 HB2 HIS A 93 1.209 -3.751 6.622 1.00 0.20 H ATOM 1358 HB3 HIS A 93 1.500 -3.080 5.023 1.00 0.23 H ATOM 1359 HD1 HIS A 93 2.487 -6.125 7.077 1.00 0.32 H ATOM 1360 HD2 HIS A 93 2.032 -4.927 3.115 1.00 0.42 H ATOM 1361 HE1 HIS A 93 2.876 -8.180 5.703 1.00 0.44 H ATOM 1362 HE2 HIS A 93 2.392 -7.481 3.333 1.00 0.59 H ATOM 1363 N LEU A 94 4.196 -2.496 4.182 1.00 0.18 N ATOM 1364 CA LEU A 94 5.195 -2.635 3.132 1.00 0.21 C ATOM 1365 C LEU A 94 6.433 -1.811 3.453 1.00 0.22 C ATOM 1366 O LEU A 94 7.531 -2.157 3.040 1.00 0.31 O ATOM 1367 CB LEU A 94 4.582 -2.218 1.800 1.00 0.19 C ATOM 1368 CG LEU A 94 3.339 -3.027 1.420 1.00 0.21 C ATOM 1369 CD1 LEU A 94 2.553 -2.346 0.326 1.00 0.21 C ATOM 1370 CD2 LEU A 94 3.728 -4.433 0.981 1.00 0.27 C ATOM 1371 H LEU A 94 3.420 -1.905 4.026 1.00 0.18 H ATOM 1372 HA LEU A 94 5.486 -3.678 3.078 1.00 0.25 H ATOM 1373 HB2 LEU A 94 4.310 -1.174 1.860 1.00 0.17 H ATOM 1374 HB3 LEU A 94 5.323 -2.342 1.028 1.00 0.21 H ATOM 1375 HG LEU A 94 2.698 -3.102 2.286 1.00 0.22 H ATOM 1376 HD11 LEU A 94 3.041 -2.511 -0.632 1.00 1.07 H ATOM 1377 HD12 LEU A 94 2.500 -1.287 0.537 1.00 1.01 H ATOM 1378 HD13 LEU A 94 1.558 -2.761 0.300 1.00 1.03 H ATOM 1379 HD21 LEU A 94 2.837 -5.003 0.770 1.00 1.09 H ATOM 1380 HD22 LEU A 94 4.289 -4.916 1.766 1.00 1.02 H ATOM 1381 HD23 LEU A 94 4.338 -4.377 0.083 1.00 1.04 H ATOM 1382 N HIS A 95 6.257 -0.768 4.257 1.00 0.18 N ATOM 1383 CA HIS A 95 7.362 0.102 4.652 1.00 0.20 C ATOM 1384 C HIS A 95 8.256 -0.646 5.627 1.00 0.26 C ATOM 1385 O HIS A 95 9.459 -0.406 5.706 1.00 0.39 O ATOM 1386 CB HIS A 95 6.828 1.383 5.313 1.00 0.20 C ATOM 1387 CG HIS A 95 7.890 2.379 5.671 1.00 0.25 C ATOM 1388 ND1 HIS A 95 8.547 2.378 6.879 1.00 0.37 N ATOM 1389 CD2 HIS A 95 8.395 3.423 4.974 1.00 0.26 C ATOM 1390 CE1 HIS A 95 9.407 3.374 6.911 1.00 0.43 C ATOM 1391 NE2 HIS A 95 9.338 4.028 5.768 1.00 0.36 N ATOM 1392 H HIS A 95 5.373 -0.613 4.654 1.00 0.16 H ATOM 1393 HA HIS A 95 7.932 0.360 3.769 1.00 0.23 H ATOM 1394 HB2 HIS A 95 6.136 1.870 4.641 1.00 0.19 H ATOM 1395 HB3 HIS A 95 6.307 1.115 6.220 1.00 0.24 H ATOM 1396 HD1 HIS A 95 8.398 1.745 7.617 1.00 0.42 H ATOM 1397 HD2 HIS A 95 8.109 3.730 3.975 1.00 0.24 H ATOM 1398 HE1 HIS A 95 10.062 3.613 7.736 1.00 0.53 H ATOM 1399 HE2 HIS A 95 9.645 4.954 5.653 1.00 0.54 H ATOM 1400 N THR A 96 7.645 -1.564 6.358 1.00 0.22 N ATOM 1401 CA THR A 96 8.333 -2.371 7.328 1.00 0.27 C ATOM 1402 C THR A 96 8.863 -3.651 6.671 1.00 0.32 C ATOM 1403 O THR A 96 9.990 -4.077 6.924 1.00 0.40 O ATOM 1404 CB THR A 96 7.357 -2.687 8.483 1.00 0.35 C ATOM 1405 OG1 THR A 96 7.492 -1.715 9.526 1.00 0.62 O ATOM 1406 CG2 THR A 96 7.547 -4.087 9.029 1.00 0.31 C ATOM 1407 H THR A 96 6.687 -1.731 6.233 1.00 0.24 H ATOM 1408 HA THR A 96 9.161 -1.800 7.722 1.00 0.36 H ATOM 1409 HB THR A 96 6.351 -2.617 8.089 1.00 0.49 H ATOM 1410 HG1 THR A 96 8.361 -1.806 9.937 1.00 1.27 H ATOM 1411 HG21 THR A 96 8.560 -4.206 9.374 1.00 1.05 H ATOM 1412 HG22 THR A 96 7.343 -4.795 8.241 1.00 1.08 H ATOM 1413 HG23 THR A 96 6.861 -4.249 9.847 1.00 1.00 H ATOM 1414 N ARG A 97 8.053 -4.241 5.796 1.00 0.34 N ATOM 1415 CA ARG A 97 8.421 -5.480 5.121 1.00 0.45 C ATOM 1416 C ARG A 97 9.557 -5.277 4.131 1.00 0.57 C ATOM 1417 O ARG A 97 10.212 -6.236 3.737 1.00 0.67 O ATOM 1418 CB ARG A 97 7.210 -6.078 4.413 1.00 0.58 C ATOM 1419 CG ARG A 97 6.251 -6.752 5.369 1.00 1.52 C ATOM 1420 CD ARG A 97 6.868 -7.991 5.997 1.00 2.27 C ATOM 1421 NE ARG A 97 5.957 -8.662 6.925 1.00 3.09 N ATOM 1422 CZ ARG A 97 6.078 -9.942 7.286 1.00 3.77 C ATOM 1423 NH1 ARG A 97 7.059 -10.685 6.795 1.00 3.78 N ATOM 1424 NH2 ARG A 97 5.218 -10.475 8.144 1.00 4.68 N ATOM 1425 H ARG A 97 7.173 -3.843 5.613 1.00 0.32 H ATOM 1426 HA ARG A 97 8.751 -6.168 5.879 1.00 0.43 H ATOM 1427 HB2 ARG A 97 6.681 -5.289 3.900 1.00 0.92 H ATOM 1428 HB3 ARG A 97 7.543 -6.805 3.691 1.00 0.76 H ATOM 1429 HG2 ARG A 97 6.011 -6.051 6.147 1.00 1.69 H ATOM 1430 HG3 ARG A 97 5.353 -7.032 4.836 1.00 1.86 H ATOM 1431 HD2 ARG A 97 7.131 -8.676 5.211 1.00 2.47 H ATOM 1432 HD3 ARG A 97 7.759 -7.702 6.532 1.00 2.48 H ATOM 1433 HE ARG A 97 5.224 -8.126 7.304 1.00 3.36 H ATOM 1434 HH11 ARG A 97 7.717 -10.291 6.147 1.00 3.41 H ATOM 1435 HH12 ARG A 97 7.148 -11.647 7.065 1.00 4.35 H ATOM 1436 HH21 ARG A 97 4.469 -9.923 8.522 1.00 4.96 H ATOM 1437 HH22 ARG A 97 5.313 -11.435 8.422 1.00 5.19 H ATOM 1438 N LEU A 98 9.767 -4.035 3.722 1.00 0.62 N ATOM 1439 CA LEU A 98 10.905 -3.696 2.863 1.00 0.78 C ATOM 1440 C LEU A 98 12.198 -4.298 3.399 1.00 0.92 C ATOM 1441 O LEU A 98 13.006 -4.851 2.650 1.00 1.19 O ATOM 1442 CB LEU A 98 11.080 -2.183 2.750 1.00 0.78 C ATOM 1443 CG LEU A 98 10.783 -1.576 1.372 1.00 0.68 C ATOM 1444 CD1 LEU A 98 10.685 -2.647 0.293 1.00 1.14 C ATOM 1445 CD2 LEU A 98 9.512 -0.765 1.422 1.00 1.00 C ATOM 1446 H LEU A 98 9.115 -3.342 3.965 1.00 0.61 H ATOM 1447 HA LEU A 98 10.710 -4.100 1.886 1.00 0.89 H ATOM 1448 HB2 LEU A 98 10.428 -1.720 3.475 1.00 1.00 H ATOM 1449 HB3 LEU A 98 12.095 -1.940 3.011 1.00 0.89 H ATOM 1450 HG LEU A 98 11.590 -0.910 1.103 1.00 1.13 H ATOM 1451 HD11 LEU A 98 10.603 -2.175 -0.675 1.00 1.73 H ATOM 1452 HD12 LEU A 98 9.806 -3.254 0.470 1.00 1.70 H ATOM 1453 HD13 LEU A 98 11.567 -3.270 0.318 1.00 1.50 H ATOM 1454 HD21 LEU A 98 9.609 0.008 2.168 1.00 1.44 H ATOM 1455 HD22 LEU A 98 8.686 -1.413 1.675 1.00 1.56 H ATOM 1456 HD23 LEU A 98 9.336 -0.314 0.457 1.00 1.66 H ATOM 1457 N THR A 99 12.383 -4.177 4.700 1.00 0.85 N ATOM 1458 CA THR A 99 13.538 -4.744 5.366 1.00 1.08 C ATOM 1459 C THR A 99 13.200 -6.115 5.946 1.00 1.13 C ATOM 1460 O THR A 99 13.971 -7.068 5.814 1.00 1.66 O ATOM 1461 CB THR A 99 14.061 -3.798 6.474 1.00 1.19 C ATOM 1462 OG1 THR A 99 14.770 -4.537 7.475 1.00 1.61 O ATOM 1463 CG2 THR A 99 12.924 -3.011 7.114 1.00 1.07 C ATOM 1464 H THR A 99 11.716 -3.694 5.231 1.00 0.74 H ATOM 1465 HA THR A 99 14.317 -4.863 4.627 1.00 1.25 H ATOM 1466 HB THR A 99 14.744 -3.095 6.019 1.00 1.39 H ATOM 1467 HG1 THR A 99 15.707 -4.576 7.242 1.00 1.79 H ATOM 1468 HG21 THR A 99 13.325 -2.329 7.849 1.00 1.39 H ATOM 1469 HG22 THR A 99 12.240 -3.695 7.594 1.00 1.56 H ATOM 1470 HG23 THR A 99 12.397 -2.452 6.350 1.00 1.45 H ATOM 1471 N GLN A 100 12.035 -6.210 6.577 1.00 0.75 N ATOM 1472 CA GLN A 100 11.584 -7.457 7.191 1.00 0.85 C ATOM 1473 C GLN A 100 11.076 -8.457 6.149 1.00 1.01 C ATOM 1474 O GLN A 100 9.943 -8.938 6.237 1.00 1.19 O ATOM 1475 CB GLN A 100 10.482 -7.164 8.202 1.00 0.77 C ATOM 1476 CG GLN A 100 10.852 -6.095 9.215 1.00 0.81 C ATOM 1477 CD GLN A 100 12.025 -6.488 10.094 1.00 1.52 C ATOM 1478 OE1 GLN A 100 11.847 -7.096 11.150 1.00 2.10 O ATOM 1479 NE2 GLN A 100 13.230 -6.129 9.680 1.00 2.19 N ATOM 1480 H GLN A 100 11.483 -5.403 6.668 1.00 0.67 H ATOM 1481 HA GLN A 100 12.420 -7.891 7.709 1.00 0.97 H ATOM 1482 HB2 GLN A 100 9.606 -6.838 7.671 1.00 1.04 H ATOM 1483 HB3 GLN A 100 10.251 -8.072 8.739 1.00 1.03 H ATOM 1484 HG2 GLN A 100 11.110 -5.191 8.684 1.00 0.94 H ATOM 1485 HG3 GLN A 100 9.994 -5.906 9.841 1.00 0.98 H ATOM 1486 HE21 GLN A 100 13.306 -5.632 8.836 1.00 2.50 H ATOM 1487 HE22 GLN A 100 14.002 -6.370 10.236 1.00 2.66 H ATOM 1488 N SER A 101 11.919 -8.769 5.174 1.00 1.26 N ATOM 1489 CA SER A 101 11.582 -9.725 4.135 1.00 1.48 C ATOM 1490 C SER A 101 12.807 -10.012 3.274 1.00 1.84 C ATOM 1491 O SER A 101 13.904 -9.513 3.543 1.00 2.05 O ATOM 1492 CB SER A 101 10.430 -9.196 3.273 1.00 1.64 C ATOM 1493 OG SER A 101 9.979 -10.161 2.335 1.00 2.32 O ATOM 1494 H SER A 101 12.805 -8.342 5.154 1.00 1.44 H ATOM 1495 HA SER A 101 11.266 -10.638 4.615 1.00 1.52 H ATOM 1496 HB2 SER A 101 9.608 -8.940 3.915 1.00 2.00 H ATOM 1497 HB3 SER A 101 10.757 -8.316 2.737 1.00 1.72 H ATOM 1498 HG SER A 101 10.030 -9.788 1.445 1.00 2.64 H ATOM 1499 N HIS A 102 12.611 -10.811 2.244 1.00 2.10 N ATOM 1500 CA HIS A 102 13.679 -11.175 1.328 1.00 2.55 C ATOM 1501 C HIS A 102 13.117 -11.353 -0.075 1.00 2.90 C ATOM 1502 O HIS A 102 12.459 -12.379 -0.330 1.00 3.23 O ATOM 1503 CB HIS A 102 14.429 -12.440 1.792 1.00 2.94 C ATOM 1504 CG HIS A 102 13.557 -13.631 2.045 1.00 3.11 C ATOM 1505 ND1 HIS A 102 13.785 -14.871 1.493 1.00 3.76 N ATOM 1506 CD2 HIS A 102 12.462 -13.763 2.821 1.00 3.06 C ATOM 1507 CE1 HIS A 102 12.865 -15.716 1.920 1.00 4.18 C ATOM 1508 NE2 HIS A 102 12.050 -15.068 2.729 1.00 3.79 N ATOM 1509 OXT HIS A 102 13.309 -10.448 -0.910 1.00 3.31 O ATOM 1510 H HIS A 102 11.701 -11.148 2.074 1.00 2.08 H ATOM 1511 HA HIS A 102 14.372 -10.353 1.313 1.00 2.65 H ATOM 1512 HB2 HIS A 102 15.146 -12.716 1.039 1.00 3.36 H ATOM 1513 HB3 HIS A 102 14.957 -12.217 2.701 1.00 3.21 H ATOM 1514 HD1 HIS A 102 14.513 -15.099 0.873 1.00 4.00 H ATOM 1515 HD2 HIS A 102 11.995 -12.976 3.395 1.00 2.70 H ATOM 1516 HE1 HIS A 102 12.795 -16.761 1.656 1.00 4.86 H ATOM 1517 HE2 HIS A 102 11.193 -15.418 3.065 1.00 4.07 H TER 1518 HIS A 102