ATOM 1 N GLY A 1 13.407 -2.487 -16.617 1.00 4.47 N ATOM 2 CA GLY A 1 12.647 -3.658 -16.120 1.00 3.97 C ATOM 3 C GLY A 1 12.517 -3.638 -14.615 1.00 3.37 C ATOM 4 O GLY A 1 13.343 -3.037 -13.928 1.00 3.50 O ATOM 5 H1 GLY A 1 13.502 -2.531 -17.652 1.00 4.73 H ATOM 6 H2 GLY A 1 14.355 -2.472 -16.193 1.00 4.85 H ATOM 7 H3 GLY A 1 12.915 -1.609 -16.361 1.00 4.60 H ATOM 8 HA2 GLY A 1 11.660 -3.649 -16.558 1.00 4.22 H ATOM 9 HA3 GLY A 1 13.157 -4.563 -16.419 1.00 4.13 H ATOM 10 N ALA A 2 11.482 -4.286 -14.098 1.00 3.02 N ATOM 11 CA ALA A 2 11.243 -4.315 -12.665 1.00 2.58 C ATOM 12 C ALA A 2 10.761 -5.691 -12.226 1.00 2.13 C ATOM 13 O ALA A 2 9.615 -5.856 -11.803 1.00 2.41 O ATOM 14 CB ALA A 2 10.239 -3.241 -12.275 1.00 2.87 C ATOM 15 H ALA A 2 10.866 -4.764 -14.695 1.00 3.29 H ATOM 16 HA ALA A 2 12.178 -4.098 -12.168 1.00 2.69 H ATOM 17 HB1 ALA A 2 10.101 -3.248 -11.203 1.00 3.11 H ATOM 18 HB2 ALA A 2 9.294 -3.438 -12.760 1.00 3.07 H ATOM 19 HB3 ALA A 2 10.607 -2.274 -12.583 1.00 3.20 H ATOM 20 N ALA A 3 11.637 -6.684 -12.350 1.00 1.91 N ATOM 21 CA ALA A 3 11.331 -8.036 -11.899 1.00 1.62 C ATOM 22 C ALA A 3 11.059 -8.032 -10.403 1.00 1.42 C ATOM 23 O ALA A 3 10.114 -8.662 -9.921 1.00 1.97 O ATOM 24 CB ALA A 3 12.478 -8.980 -12.231 1.00 1.64 C ATOM 25 H ALA A 3 12.512 -6.500 -12.752 1.00 2.26 H ATOM 26 HA ALA A 3 10.447 -8.374 -12.419 1.00 1.83 H ATOM 27 HB1 ALA A 3 13.378 -8.641 -11.740 1.00 1.93 H ATOM 28 HB2 ALA A 3 12.635 -8.995 -13.299 1.00 1.98 H ATOM 29 HB3 ALA A 3 12.237 -9.976 -11.890 1.00 1.96 H ATOM 30 N SER A 4 11.893 -7.305 -9.678 1.00 0.96 N ATOM 31 CA SER A 4 11.693 -7.090 -8.262 1.00 0.76 C ATOM 32 C SER A 4 11.344 -5.632 -8.017 1.00 0.67 C ATOM 33 O SER A 4 12.221 -4.784 -7.896 1.00 0.72 O ATOM 34 CB SER A 4 12.950 -7.477 -7.476 1.00 0.82 C ATOM 35 OG SER A 4 12.751 -7.322 -6.079 1.00 1.73 O ATOM 36 H SER A 4 12.676 -6.900 -10.113 1.00 1.17 H ATOM 37 HA SER A 4 10.872 -7.704 -7.941 1.00 0.82 H ATOM 38 HB2 SER A 4 13.196 -8.508 -7.679 1.00 1.13 H ATOM 39 HB3 SER A 4 13.769 -6.845 -7.780 1.00 1.14 H ATOM 40 HG SER A 4 11.992 -7.854 -5.805 1.00 2.10 H ATOM 41 N ALA A 5 10.060 -5.330 -7.944 1.00 0.62 N ATOM 42 CA ALA A 5 9.632 -3.963 -7.693 1.00 0.56 C ATOM 43 C ALA A 5 9.907 -3.565 -6.250 1.00 0.49 C ATOM 44 O ALA A 5 9.681 -2.427 -5.858 1.00 0.45 O ATOM 45 CB ALA A 5 8.162 -3.795 -8.025 1.00 0.59 C ATOM 46 H ALA A 5 9.384 -6.031 -8.072 1.00 0.64 H ATOM 47 HA ALA A 5 10.201 -3.313 -8.343 1.00 0.57 H ATOM 48 HB1 ALA A 5 7.574 -4.448 -7.398 1.00 1.20 H ATOM 49 HB2 ALA A 5 7.995 -4.046 -9.062 1.00 1.10 H ATOM 50 HB3 ALA A 5 7.869 -2.770 -7.853 1.00 1.23 H ATOM 51 N ALA A 6 10.438 -4.498 -5.474 1.00 0.50 N ATOM 52 CA ALA A 6 10.808 -4.229 -4.095 1.00 0.46 C ATOM 53 C ALA A 6 12.158 -3.540 -4.051 1.00 0.48 C ATOM 54 O ALA A 6 12.545 -2.953 -3.042 1.00 0.56 O ATOM 55 CB ALA A 6 10.835 -5.522 -3.304 1.00 0.51 C ATOM 56 H ALA A 6 10.613 -5.390 -5.843 1.00 0.55 H ATOM 57 HA ALA A 6 10.063 -3.569 -3.664 1.00 0.42 H ATOM 58 HB1 ALA A 6 11.540 -6.205 -3.753 1.00 1.19 H ATOM 59 HB2 ALA A 6 9.844 -5.962 -3.316 1.00 1.07 H ATOM 60 HB3 ALA A 6 11.124 -5.316 -2.285 1.00 1.15 H ATOM 61 N THR A 7 12.859 -3.592 -5.167 1.00 0.52 N ATOM 62 CA THR A 7 14.101 -2.872 -5.302 1.00 0.52 C ATOM 63 C THR A 7 13.879 -1.682 -6.222 1.00 0.50 C ATOM 64 O THR A 7 14.816 -0.984 -6.611 1.00 0.51 O ATOM 65 CB THR A 7 15.256 -3.768 -5.801 1.00 0.61 C ATOM 66 OG1 THR A 7 16.488 -3.031 -5.825 1.00 0.64 O ATOM 67 CG2 THR A 7 14.980 -4.339 -7.183 1.00 0.69 C ATOM 68 H THR A 7 12.503 -4.094 -5.931 1.00 0.65 H ATOM 69 HA THR A 7 14.364 -2.504 -4.322 1.00 0.49 H ATOM 70 HB THR A 7 15.360 -4.584 -5.107 1.00 0.64 H ATOM 71 HG1 THR A 7 16.290 -2.084 -5.868 1.00 0.92 H ATOM 72 HG21 THR A 7 15.799 -4.975 -7.481 1.00 1.24 H ATOM 73 HG22 THR A 7 14.875 -3.532 -7.891 1.00 1.17 H ATOM 74 HG23 THR A 7 14.064 -4.919 -7.158 1.00 1.27 H ATOM 75 N ASP A 8 12.612 -1.449 -6.561 1.00 0.49 N ATOM 76 CA ASP A 8 12.207 -0.253 -7.276 1.00 0.48 C ATOM 77 C ASP A 8 11.454 0.639 -6.335 1.00 0.40 C ATOM 78 O ASP A 8 11.519 1.861 -6.409 1.00 0.40 O ATOM 79 CB ASP A 8 11.276 -0.578 -8.425 1.00 0.54 C ATOM 80 CG ASP A 8 11.913 -0.347 -9.776 1.00 0.64 C ATOM 81 OD1 ASP A 8 12.702 -1.201 -10.224 1.00 0.75 O ATOM 82 OD2 ASP A 8 11.635 0.701 -10.391 1.00 0.73 O ATOM 83 H ASP A 8 11.903 -2.077 -6.314 1.00 0.50 H ATOM 84 HA ASP A 8 13.081 0.249 -7.640 1.00 0.51 H ATOM 85 HB2 ASP A 8 10.969 -1.607 -8.350 1.00 0.57 H ATOM 86 HB3 ASP A 8 10.406 0.062 -8.339 1.00 0.56 H ATOM 87 N LEU A 9 10.722 0.002 -5.448 1.00 0.36 N ATOM 88 CA LEU A 9 9.966 0.707 -4.455 1.00 0.30 C ATOM 89 C LEU A 9 10.908 1.362 -3.486 1.00 0.28 C ATOM 90 O LEU A 9 10.909 2.576 -3.302 1.00 0.26 O ATOM 91 CB LEU A 9 9.094 -0.236 -3.665 1.00 0.29 C ATOM 92 CG LEU A 9 8.495 0.419 -2.432 1.00 0.25 C ATOM 93 CD1 LEU A 9 7.472 1.468 -2.839 1.00 0.24 C ATOM 94 CD2 LEU A 9 7.925 -0.629 -1.501 1.00 0.26 C ATOM 95 H LEU A 9 10.714 -0.979 -5.451 1.00 0.38 H ATOM 96 HA LEU A 9 9.360 1.446 -4.950 1.00 0.30 H ATOM 97 HB2 LEU A 9 8.309 -0.598 -4.306 1.00 0.30 H ATOM 98 HB3 LEU A 9 9.692 -1.075 -3.345 1.00 0.31 H ATOM 99 HG LEU A 9 9.286 0.931 -1.901 1.00 0.26 H ATOM 100 HD11 LEU A 9 7.951 2.201 -3.492 1.00 1.04 H ATOM 101 HD12 LEU A 9 7.095 1.966 -1.957 1.00 1.06 H ATOM 102 HD13 LEU A 9 6.655 0.991 -3.363 1.00 1.05 H ATOM 103 HD21 LEU A 9 7.109 -1.136 -1.982 1.00 1.04 H ATOM 104 HD22 LEU A 9 7.579 -0.159 -0.596 1.00 1.07 H ATOM 105 HD23 LEU A 9 8.698 -1.345 -1.260 1.00 1.02 H ATOM 106 N ALA A 10 11.719 0.514 -2.877 1.00 0.31 N ATOM 107 CA ALA A 10 12.761 0.957 -1.967 1.00 0.32 C ATOM 108 C ALA A 10 13.754 1.846 -2.696 1.00 0.35 C ATOM 109 O ALA A 10 14.618 2.443 -2.083 1.00 0.39 O ATOM 110 CB ALA A 10 13.449 -0.238 -1.332 1.00 0.42 C ATOM 111 H ALA A 10 11.593 -0.452 -3.046 1.00 0.33 H ATOM 112 HA ALA A 10 12.299 1.539 -1.179 1.00 0.29 H ATOM 113 HB1 ALA A 10 13.848 -0.877 -2.107 1.00 1.10 H ATOM 114 HB2 ALA A 10 12.730 -0.791 -0.741 1.00 1.12 H ATOM 115 HB3 ALA A 10 14.251 0.103 -0.696 1.00 1.07 H ATOM 116 N ALA A 11 13.582 1.971 -4.004 1.00 0.36 N ATOM 117 CA ALA A 11 14.392 2.862 -4.799 1.00 0.41 C ATOM 118 C ALA A 11 13.878 4.284 -4.642 1.00 0.39 C ATOM 119 O ALA A 11 14.659 5.235 -4.624 1.00 0.44 O ATOM 120 CB ALA A 11 14.364 2.444 -6.248 1.00 0.51 C ATOM 121 H ALA A 11 12.843 1.497 -4.435 1.00 0.35 H ATOM 122 HA ALA A 11 15.408 2.807 -4.442 1.00 0.42 H ATOM 123 HB1 ALA A 11 14.906 3.164 -6.840 1.00 1.03 H ATOM 124 HB2 ALA A 11 13.335 2.396 -6.582 1.00 1.26 H ATOM 125 HB3 ALA A 11 14.821 1.473 -6.348 1.00 1.10 H ATOM 126 N ARG A 12 12.554 4.432 -4.527 1.00 0.36 N ATOM 127 CA ARG A 12 11.953 5.718 -4.204 1.00 0.41 C ATOM 128 C ARG A 12 12.315 6.125 -2.785 1.00 0.34 C ATOM 129 O ARG A 12 12.478 7.302 -2.479 1.00 0.38 O ATOM 130 CB ARG A 12 10.430 5.616 -4.287 1.00 0.54 C ATOM 131 CG ARG A 12 9.835 5.693 -5.671 1.00 0.68 C ATOM 132 CD ARG A 12 9.967 4.384 -6.408 1.00 0.64 C ATOM 133 NE ARG A 12 8.960 4.256 -7.459 1.00 1.29 N ATOM 134 CZ ARG A 12 9.097 3.513 -8.556 1.00 1.49 C ATOM 135 NH1 ARG A 12 10.205 2.806 -8.764 1.00 1.30 N ATOM 136 NH2 ARG A 12 8.116 3.475 -9.449 1.00 2.35 N ATOM 137 H ARG A 12 11.939 3.668 -4.673 1.00 0.34 H ATOM 138 HA ARG A 12 12.307 6.457 -4.903 1.00 0.52 H ATOM 139 HB2 ARG A 12 10.146 4.664 -3.880 1.00 1.07 H ATOM 140 HB3 ARG A 12 9.993 6.394 -3.687 1.00 1.19 H ATOM 141 HG2 ARG A 12 8.786 5.936 -5.585 1.00 1.24 H ATOM 142 HG3 ARG A 12 10.346 6.459 -6.220 1.00 1.09 H ATOM 143 HD2 ARG A 12 10.951 4.331 -6.852 1.00 1.06 H ATOM 144 HD3 ARG A 12 9.848 3.583 -5.694 1.00 0.99 H ATOM 145 HE ARG A 12 8.121 4.762 -7.336 1.00 1.91 H ATOM 146 HH11 ARG A 12 10.949 2.823 -8.091 1.00 1.32 H ATOM 147 HH12 ARG A 12 10.306 2.254 -9.599 1.00 1.63 H ATOM 148 HH21 ARG A 12 7.276 4.005 -9.297 1.00 2.93 H ATOM 149 HH22 ARG A 12 8.207 2.919 -10.278 1.00 2.53 H ATOM 150 N LEU A 13 12.442 5.118 -1.937 1.00 0.29 N ATOM 151 CA LEU A 13 12.572 5.312 -0.497 1.00 0.28 C ATOM 152 C LEU A 13 14.006 5.583 -0.123 1.00 0.31 C ATOM 153 O LEU A 13 14.307 6.466 0.673 1.00 0.33 O ATOM 154 CB LEU A 13 12.074 4.069 0.235 1.00 0.27 C ATOM 155 CG LEU A 13 10.550 3.943 0.406 1.00 0.27 C ATOM 156 CD1 LEU A 13 9.812 4.297 -0.862 1.00 0.74 C ATOM 157 CD2 LEU A 13 10.185 2.543 0.852 1.00 0.70 C ATOM 158 H LEU A 13 12.465 4.204 -2.297 1.00 0.29 H ATOM 159 HA LEU A 13 11.973 6.153 -0.215 1.00 0.30 H ATOM 160 HB2 LEU A 13 12.427 3.212 -0.312 1.00 0.29 H ATOM 161 HB3 LEU A 13 12.524 4.055 1.215 1.00 0.31 H ATOM 162 HG LEU A 13 10.219 4.625 1.165 1.00 0.78 H ATOM 163 HD11 LEU A 13 8.820 3.872 -0.832 1.00 1.40 H ATOM 164 HD12 LEU A 13 10.357 3.912 -1.714 1.00 1.35 H ATOM 165 HD13 LEU A 13 9.737 5.375 -0.935 1.00 1.33 H ATOM 166 HD21 LEU A 13 9.117 2.479 0.998 1.00 1.35 H ATOM 167 HD22 LEU A 13 10.691 2.318 1.780 1.00 1.33 H ATOM 168 HD23 LEU A 13 10.488 1.834 0.097 1.00 1.33 H ATOM 169 N ASN A 14 14.875 4.788 -0.690 1.00 0.35 N ATOM 170 CA ASN A 14 16.310 4.959 -0.545 1.00 0.41 C ATOM 171 C ASN A 14 16.722 6.382 -0.892 1.00 0.43 C ATOM 172 O ASN A 14 16.436 6.873 -1.984 1.00 0.84 O ATOM 173 CB ASN A 14 17.008 3.957 -1.453 1.00 0.52 C ATOM 174 CG ASN A 14 17.326 2.651 -0.751 1.00 0.81 C ATOM 175 OD1 ASN A 14 17.606 2.624 0.446 1.00 1.39 O ATOM 176 ND2 ASN A 14 17.274 1.555 -1.491 1.00 0.65 N ATOM 177 H ASN A 14 14.548 4.035 -1.229 1.00 0.35 H ATOM 178 HA ASN A 14 16.576 4.758 0.481 1.00 0.46 H ATOM 179 HB2 ASN A 14 16.334 3.731 -2.276 1.00 0.39 H ATOM 180 HB3 ASN A 14 17.922 4.386 -1.832 1.00 0.78 H ATOM 181 HD21 ASN A 14 17.042 1.649 -2.441 1.00 0.61 H ATOM 182 HD22 ASN A 14 17.449 0.696 -1.061 1.00 0.90 H ATOM 183 N GLY A 15 17.391 7.035 0.043 1.00 0.48 N ATOM 184 CA GLY A 15 17.724 8.431 -0.120 1.00 0.49 C ATOM 185 C GLY A 15 16.825 9.324 0.704 1.00 0.46 C ATOM 186 O GLY A 15 17.125 10.502 0.921 1.00 0.56 O ATOM 187 H GLY A 15 17.691 6.555 0.847 1.00 0.80 H ATOM 188 HA2 GLY A 15 18.746 8.582 0.183 1.00 0.54 H ATOM 189 HA3 GLY A 15 17.618 8.701 -1.160 1.00 0.50 H ATOM 190 N LEU A 16 15.719 8.765 1.163 1.00 0.38 N ATOM 191 CA LEU A 16 14.737 9.522 1.916 1.00 0.35 C ATOM 192 C LEU A 16 14.783 9.179 3.392 1.00 0.35 C ATOM 193 O LEU A 16 15.434 8.223 3.809 1.00 0.37 O ATOM 194 CB LEU A 16 13.322 9.266 1.381 1.00 0.32 C ATOM 195 CG LEU A 16 12.900 10.123 0.196 1.00 0.35 C ATOM 196 CD1 LEU A 16 13.062 11.576 0.557 1.00 0.94 C ATOM 197 CD2 LEU A 16 13.706 9.782 -1.046 1.00 0.82 C ATOM 198 H LEU A 16 15.558 7.807 0.995 1.00 0.37 H ATOM 199 HA LEU A 16 14.968 10.567 1.798 1.00 0.37 H ATOM 200 HB2 LEU A 16 13.251 8.237 1.089 1.00 0.32 H ATOM 201 HB3 LEU A 16 12.624 9.438 2.184 1.00 0.30 H ATOM 202 HG LEU A 16 11.855 9.945 -0.018 1.00 0.68 H ATOM 203 HD11 LEU A 16 14.113 11.818 0.592 1.00 1.56 H ATOM 204 HD12 LEU A 16 12.620 11.744 1.538 1.00 1.48 H ATOM 205 HD13 LEU A 16 12.567 12.191 -0.175 1.00 1.45 H ATOM 206 HD21 LEU A 16 13.515 8.758 -1.329 1.00 1.36 H ATOM 207 HD22 LEU A 16 14.758 9.908 -0.838 1.00 1.32 H ATOM 208 HD23 LEU A 16 13.418 10.438 -1.855 1.00 1.49 H ATOM 209 N SER A 17 14.104 9.995 4.174 1.00 0.35 N ATOM 210 CA SER A 17 13.912 9.739 5.585 1.00 0.37 C ATOM 211 C SER A 17 12.734 8.795 5.768 1.00 0.33 C ATOM 212 O SER A 17 11.887 8.706 4.884 1.00 0.31 O ATOM 213 CB SER A 17 13.657 11.060 6.298 1.00 0.39 C ATOM 214 OG SER A 17 14.726 11.969 6.081 1.00 1.08 O ATOM 215 H SER A 17 13.714 10.807 3.786 1.00 0.34 H ATOM 216 HA SER A 17 14.802 9.276 5.985 1.00 0.40 H ATOM 217 HB2 SER A 17 12.750 11.497 5.917 1.00 0.76 H ATOM 218 HB3 SER A 17 13.554 10.883 7.354 1.00 0.85 H ATOM 219 HG SER A 17 15.305 11.625 5.386 1.00 1.50 H ATOM 220 N PRO A 18 12.670 8.074 6.895 1.00 0.36 N ATOM 221 CA PRO A 18 11.631 7.061 7.145 1.00 0.35 C ATOM 222 C PRO A 18 10.219 7.551 6.811 1.00 0.31 C ATOM 223 O PRO A 18 9.477 6.879 6.086 1.00 0.29 O ATOM 224 CB PRO A 18 11.785 6.789 8.639 1.00 0.39 C ATOM 225 CG PRO A 18 13.234 7.016 8.890 1.00 0.42 C ATOM 226 CD PRO A 18 13.608 8.184 8.030 1.00 0.45 C ATOM 227 HA PRO A 18 11.829 6.154 6.593 1.00 0.34 H ATOM 228 HB2 PRO A 18 11.171 7.479 9.200 1.00 0.40 H ATOM 229 HB3 PRO A 18 11.498 5.772 8.859 1.00 0.40 H ATOM 230 HG2 PRO A 18 13.402 7.243 9.931 1.00 0.49 H ATOM 231 HG3 PRO A 18 13.802 6.148 8.594 1.00 0.47 H ATOM 232 HD2 PRO A 18 13.463 9.109 8.566 1.00 0.55 H ATOM 233 HD3 PRO A 18 14.631 8.095 7.695 1.00 0.54 H ATOM 234 N GLN A 19 9.874 8.734 7.311 1.00 0.32 N ATOM 235 CA GLN A 19 8.571 9.342 7.053 1.00 0.32 C ATOM 236 C GLN A 19 8.374 9.605 5.562 1.00 0.29 C ATOM 237 O GLN A 19 7.287 9.405 5.029 1.00 0.28 O ATOM 238 CB GLN A 19 8.438 10.649 7.825 1.00 0.36 C ATOM 239 CG GLN A 19 7.044 11.238 7.762 1.00 0.71 C ATOM 240 CD GLN A 19 6.043 10.469 8.601 1.00 1.28 C ATOM 241 OE1 GLN A 19 6.396 9.849 9.606 1.00 2.00 O ATOM 242 NE2 GLN A 19 4.784 10.511 8.198 1.00 2.04 N ATOM 243 H GLN A 19 10.522 9.212 7.878 1.00 0.35 H ATOM 244 HA GLN A 19 7.801 8.665 7.386 1.00 0.34 H ATOM 245 HB2 GLN A 19 8.688 10.471 8.861 1.00 0.63 H ATOM 246 HB3 GLN A 19 9.127 11.366 7.413 1.00 0.56 H ATOM 247 HG2 GLN A 19 7.076 12.260 8.105 1.00 1.29 H ATOM 248 HG3 GLN A 19 6.720 11.206 6.735 1.00 1.30 H ATOM 249 HE21 GLN A 19 4.573 11.029 7.388 1.00 2.37 H ATOM 250 HE22 GLN A 19 4.111 10.033 8.725 1.00 2.62 H ATOM 251 N GLN A 20 9.443 10.008 4.888 1.00 0.28 N ATOM 252 CA GLN A 20 9.383 10.325 3.465 1.00 0.27 C ATOM 253 C GLN A 20 9.231 9.050 2.654 1.00 0.24 C ATOM 254 O GLN A 20 8.475 8.990 1.683 1.00 0.23 O ATOM 255 CB GLN A 20 10.644 11.060 3.038 1.00 0.30 C ATOM 256 CG GLN A 20 10.769 12.427 3.678 1.00 0.37 C ATOM 257 CD GLN A 20 11.906 13.252 3.120 1.00 0.95 C ATOM 258 OE1 GLN A 20 13.042 13.158 3.588 1.00 1.78 O ATOM 259 NE2 GLN A 20 11.608 14.076 2.131 1.00 1.68 N ATOM 260 H GLN A 20 10.308 10.049 5.346 1.00 0.30 H ATOM 261 HA GLN A 20 8.529 10.960 3.299 1.00 0.28 H ATOM 262 HB2 GLN A 20 11.499 10.466 3.336 1.00 0.30 H ATOM 263 HB3 GLN A 20 10.648 11.173 1.965 1.00 0.31 H ATOM 264 HG2 GLN A 20 9.847 12.967 3.529 1.00 0.89 H ATOM 265 HG3 GLN A 20 10.933 12.287 4.726 1.00 0.94 H ATOM 266 HE21 GLN A 20 10.673 14.109 1.818 1.00 2.08 H ATOM 267 HE22 GLN A 20 12.326 14.624 1.748 1.00 2.22 H ATOM 268 N GLN A 21 9.978 8.040 3.069 1.00 0.24 N ATOM 269 CA GLN A 21 9.869 6.702 2.514 1.00 0.22 C ATOM 270 C GLN A 21 8.444 6.197 2.658 1.00 0.21 C ATOM 271 O GLN A 21 7.911 5.518 1.780 1.00 0.25 O ATOM 272 CB GLN A 21 10.824 5.772 3.265 1.00 0.25 C ATOM 273 CG GLN A 21 12.288 6.141 3.108 1.00 0.28 C ATOM 274 CD GLN A 21 13.197 5.333 4.019 1.00 0.35 C ATOM 275 OE1 GLN A 21 14.230 5.819 4.473 1.00 1.22 O ATOM 276 NE2 GLN A 21 12.828 4.088 4.285 1.00 1.06 N ATOM 277 H GLN A 21 10.646 8.206 3.772 1.00 0.25 H ATOM 278 HA GLN A 21 10.135 6.739 1.467 1.00 0.22 H ATOM 279 HB2 GLN A 21 10.582 5.806 4.316 1.00 0.28 H ATOM 280 HB3 GLN A 21 10.689 4.763 2.909 1.00 0.25 H ATOM 281 HG2 GLN A 21 12.576 5.953 2.086 1.00 0.28 H ATOM 282 HG3 GLN A 21 12.413 7.198 3.328 1.00 0.30 H ATOM 283 HE21 GLN A 21 11.999 3.749 3.884 1.00 1.83 H ATOM 284 HE22 GLN A 21 13.402 3.552 4.873 1.00 1.07 H ATOM 285 N GLN A 22 7.836 6.544 3.780 1.00 0.21 N ATOM 286 CA GLN A 22 6.466 6.173 4.054 1.00 0.21 C ATOM 287 C GLN A 22 5.531 6.899 3.102 1.00 0.18 C ATOM 288 O GLN A 22 4.652 6.286 2.529 1.00 0.17 O ATOM 289 CB GLN A 22 6.124 6.494 5.497 1.00 0.27 C ATOM 290 CG GLN A 22 4.879 5.798 5.993 1.00 0.46 C ATOM 291 CD GLN A 22 3.713 6.735 6.259 1.00 0.92 C ATOM 292 OE1 GLN A 22 2.550 6.350 6.123 1.00 1.56 O ATOM 293 NE2 GLN A 22 4.008 7.961 6.657 1.00 1.60 N ATOM 294 H GLN A 22 8.328 7.072 4.446 1.00 0.24 H ATOM 295 HA GLN A 22 6.361 5.116 3.906 1.00 0.22 H ATOM 296 HB2 GLN A 22 6.947 6.196 6.130 1.00 0.45 H ATOM 297 HB3 GLN A 22 5.981 7.546 5.583 1.00 0.37 H ATOM 298 HG2 GLN A 22 4.575 5.080 5.250 1.00 0.58 H ATOM 299 HG3 GLN A 22 5.130 5.283 6.900 1.00 0.62 H ATOM 300 HE21 GLN A 22 4.951 8.201 6.764 1.00 2.14 H ATOM 301 HE22 GLN A 22 3.266 8.581 6.828 1.00 1.88 H ATOM 302 N GLN A 23 5.767 8.196 2.915 1.00 0.19 N ATOM 303 CA GLN A 23 4.950 9.045 2.041 1.00 0.18 C ATOM 304 C GLN A 23 4.796 8.493 0.633 1.00 0.15 C ATOM 305 O GLN A 23 3.728 8.592 0.044 1.00 0.15 O ATOM 306 CB GLN A 23 5.569 10.412 1.954 1.00 0.20 C ATOM 307 CG GLN A 23 5.545 11.149 3.276 1.00 0.24 C ATOM 308 CD GLN A 23 6.273 12.476 3.232 1.00 0.30 C ATOM 309 OE1 GLN A 23 7.203 12.666 2.447 1.00 1.05 O ATOM 310 NE2 GLN A 23 5.866 13.402 4.085 1.00 1.24 N ATOM 311 H GLN A 23 6.513 8.612 3.401 1.00 0.22 H ATOM 312 HA GLN A 23 3.984 9.142 2.487 1.00 0.19 H ATOM 313 HB2 GLN A 23 6.587 10.284 1.638 1.00 0.20 H ATOM 314 HB3 GLN A 23 5.037 10.998 1.220 1.00 0.22 H ATOM 315 HG2 GLN A 23 4.518 11.330 3.545 1.00 0.27 H ATOM 316 HG3 GLN A 23 5.995 10.522 4.025 1.00 0.25 H ATOM 317 HE21 GLN A 23 5.125 13.179 4.693 1.00 2.00 H ATOM 318 HE22 GLN A 23 6.317 14.272 4.078 1.00 1.29 H ATOM 319 N THR A 24 5.871 7.953 0.086 1.00 0.15 N ATOM 320 CA THR A 24 5.832 7.324 -1.223 1.00 0.14 C ATOM 321 C THR A 24 4.775 6.224 -1.260 1.00 0.12 C ATOM 322 O THR A 24 3.975 6.155 -2.189 1.00 0.12 O ATOM 323 CB THR A 24 7.218 6.757 -1.550 1.00 0.16 C ATOM 324 OG1 THR A 24 8.097 7.811 -1.964 1.00 0.19 O ATOM 325 CG2 THR A 24 7.142 5.679 -2.620 1.00 0.17 C ATOM 326 H THR A 24 6.722 7.978 0.578 1.00 0.18 H ATOM 327 HA THR A 24 5.574 8.072 -1.966 1.00 0.14 H ATOM 328 HB THR A 24 7.613 6.323 -0.643 1.00 0.18 H ATOM 329 HG1 THR A 24 7.573 8.573 -2.241 1.00 0.62 H ATOM 330 HG21 THR A 24 6.417 4.932 -2.323 1.00 1.00 H ATOM 331 HG22 THR A 24 8.112 5.217 -2.729 1.00 1.00 H ATOM 332 HG23 THR A 24 6.841 6.121 -3.558 1.00 1.01 H ATOM 333 N LEU A 25 4.739 5.403 -0.227 1.00 0.12 N ATOM 334 CA LEU A 25 3.717 4.375 -0.122 1.00 0.11 C ATOM 335 C LEU A 25 2.412 5.027 0.280 1.00 0.11 C ATOM 336 O LEU A 25 1.358 4.719 -0.236 1.00 0.10 O ATOM 337 CB LEU A 25 4.102 3.362 0.929 1.00 0.12 C ATOM 338 CG LEU A 25 5.396 2.613 0.681 1.00 0.14 C ATOM 339 CD1 LEU A 25 6.050 2.296 2.010 1.00 0.32 C ATOM 340 CD2 LEU A 25 5.119 1.342 -0.101 1.00 0.39 C ATOM 341 H LEU A 25 5.378 5.526 0.514 1.00 0.13 H ATOM 342 HA LEU A 25 3.604 3.889 -1.078 1.00 0.11 H ATOM 343 HB2 LEU A 25 4.189 3.884 1.862 1.00 0.15 H ATOM 344 HB3 LEU A 25 3.304 2.640 1.011 1.00 0.15 H ATOM 345 HG LEU A 25 6.069 3.232 0.106 1.00 0.23 H ATOM 346 HD11 LEU A 25 7.024 1.865 1.842 1.00 1.04 H ATOM 347 HD12 LEU A 25 5.433 1.598 2.555 1.00 1.10 H ATOM 348 HD13 LEU A 25 6.149 3.210 2.583 1.00 1.10 H ATOM 349 HD21 LEU A 25 4.432 0.720 0.454 1.00 1.15 H ATOM 350 HD22 LEU A 25 6.040 0.808 -0.256 1.00 1.10 H ATOM 351 HD23 LEU A 25 4.683 1.595 -1.056 1.00 1.10 H ATOM 352 N ALA A 26 2.519 5.975 1.182 1.00 0.12 N ATOM 353 CA ALA A 26 1.384 6.732 1.680 1.00 0.13 C ATOM 354 C ALA A 26 0.791 7.627 0.591 1.00 0.13 C ATOM 355 O ALA A 26 -0.097 8.442 0.836 1.00 0.16 O ATOM 356 CB ALA A 26 1.837 7.540 2.887 1.00 0.16 C ATOM 357 H ALA A 26 3.411 6.170 1.553 1.00 0.14 H ATOM 358 HA ALA A 26 0.629 6.028 1.993 1.00 0.14 H ATOM 359 HB1 ALA A 26 0.986 7.812 3.489 1.00 1.07 H ATOM 360 HB2 ALA A 26 2.343 8.436 2.549 1.00 0.98 H ATOM 361 HB3 ALA A 26 2.530 6.944 3.474 1.00 1.02 H ATOM 362 N THR A 27 1.307 7.446 -0.607 1.00 0.12 N ATOM 363 CA THR A 27 0.836 8.110 -1.790 1.00 0.12 C ATOM 364 C THR A 27 0.437 7.058 -2.815 1.00 0.11 C ATOM 365 O THR A 27 -0.656 7.079 -3.363 1.00 0.11 O ATOM 366 CB THR A 27 1.956 8.998 -2.365 1.00 0.15 C ATOM 367 OG1 THR A 27 2.098 10.181 -1.574 1.00 0.20 O ATOM 368 CG2 THR A 27 1.708 9.347 -3.819 1.00 0.15 C ATOM 369 H THR A 27 2.049 6.819 -0.699 1.00 0.11 H ATOM 370 HA THR A 27 -0.014 8.718 -1.533 1.00 0.14 H ATOM 371 HB THR A 27 2.881 8.441 -2.307 1.00 0.16 H ATOM 372 HG1 THR A 27 2.626 9.971 -0.790 1.00 0.61 H ATOM 373 HG21 THR A 27 2.530 9.942 -4.187 1.00 0.99 H ATOM 374 HG22 THR A 27 0.787 9.901 -3.908 1.00 1.02 H ATOM 375 HG23 THR A 27 1.641 8.430 -4.394 1.00 0.99 H ATOM 376 N LEU A 28 1.349 6.124 -3.020 1.00 0.09 N ATOM 377 CA LEU A 28 1.187 5.037 -3.953 1.00 0.09 C ATOM 378 C LEU A 28 0.127 4.057 -3.501 1.00 0.08 C ATOM 379 O LEU A 28 -0.674 3.586 -4.291 1.00 0.08 O ATOM 380 CB LEU A 28 2.499 4.300 -4.088 1.00 0.10 C ATOM 381 CG LEU A 28 2.333 2.841 -4.466 1.00 0.11 C ATOM 382 CD1 LEU A 28 2.451 2.642 -5.965 1.00 0.42 C ATOM 383 CD2 LEU A 28 3.305 1.981 -3.683 1.00 0.49 C ATOM 384 H LEU A 28 2.173 6.176 -2.516 1.00 0.10 H ATOM 385 HA LEU A 28 0.914 5.444 -4.895 1.00 0.10 H ATOM 386 HB2 LEU A 28 3.103 4.801 -4.832 1.00 0.12 H ATOM 387 HB3 LEU A 28 3.010 4.348 -3.147 1.00 0.10 H ATOM 388 HG LEU A 28 1.338 2.541 -4.179 1.00 0.41 H ATOM 389 HD11 LEU A 28 1.800 3.340 -6.470 1.00 1.17 H ATOM 390 HD12 LEU A 28 2.153 1.631 -6.218 1.00 1.10 H ATOM 391 HD13 LEU A 28 3.472 2.810 -6.272 1.00 1.13 H ATOM 392 HD21 LEU A 28 3.049 2.031 -2.629 1.00 1.15 H ATOM 393 HD22 LEU A 28 4.311 2.345 -3.829 1.00 1.17 H ATOM 394 HD23 LEU A 28 3.234 0.960 -4.019 1.00 1.17 H ATOM 395 N VAL A 29 0.156 3.738 -2.229 1.00 0.08 N ATOM 396 CA VAL A 29 -0.791 2.807 -1.645 1.00 0.09 C ATOM 397 C VAL A 29 -2.180 3.404 -1.698 1.00 0.08 C ATOM 398 O VAL A 29 -3.184 2.714 -1.884 1.00 0.09 O ATOM 399 CB VAL A 29 -0.416 2.481 -0.189 1.00 0.10 C ATOM 400 CG1 VAL A 29 -1.550 1.761 0.524 1.00 0.11 C ATOM 401 CG2 VAL A 29 0.858 1.654 -0.162 1.00 0.10 C ATOM 402 H VAL A 29 0.833 4.160 -1.651 1.00 0.08 H ATOM 403 HA VAL A 29 -0.767 1.902 -2.223 1.00 0.09 H ATOM 404 HB VAL A 29 -0.224 3.415 0.328 1.00 0.10 H ATOM 405 HG11 VAL A 29 -2.447 2.362 0.459 1.00 1.02 H ATOM 406 HG12 VAL A 29 -1.288 1.614 1.561 1.00 0.99 H ATOM 407 HG13 VAL A 29 -1.722 0.805 0.055 1.00 1.04 H ATOM 408 HG21 VAL A 29 1.636 2.186 -0.695 1.00 0.92 H ATOM 409 HG22 VAL A 29 0.680 0.704 -0.639 1.00 0.94 H ATOM 410 HG23 VAL A 29 1.164 1.497 0.860 1.00 0.94 H ATOM 411 N ALA A 30 -2.215 4.707 -1.561 1.00 0.08 N ATOM 412 CA ALA A 30 -3.444 5.443 -1.672 1.00 0.08 C ATOM 413 C ALA A 30 -3.827 5.588 -3.123 1.00 0.09 C ATOM 414 O ALA A 30 -4.991 5.647 -3.459 1.00 0.10 O ATOM 415 CB ALA A 30 -3.279 6.792 -1.042 1.00 0.08 C ATOM 416 H ALA A 30 -1.384 5.196 -1.386 1.00 0.09 H ATOM 417 HA ALA A 30 -4.213 4.905 -1.151 1.00 0.09 H ATOM 418 HB1 ALA A 30 -2.464 7.305 -1.524 1.00 1.01 H ATOM 419 HB2 ALA A 30 -3.067 6.669 0.007 1.00 1.00 H ATOM 420 HB3 ALA A 30 -4.187 7.355 -1.172 1.00 1.00 H ATOM 421 N ALA A 31 -2.819 5.665 -3.965 1.00 0.08 N ATOM 422 CA ALA A 31 -2.999 5.685 -5.402 1.00 0.09 C ATOM 423 C ALA A 31 -3.573 4.351 -5.837 1.00 0.09 C ATOM 424 O ALA A 31 -4.437 4.265 -6.709 1.00 0.11 O ATOM 425 CB ALA A 31 -1.658 5.959 -6.068 1.00 0.10 C ATOM 426 H ALA A 31 -1.916 5.740 -3.599 1.00 0.08 H ATOM 427 HA ALA A 31 -3.686 6.479 -5.655 1.00 0.09 H ATOM 428 HB1 ALA A 31 -1.299 6.932 -5.764 1.00 1.03 H ATOM 429 HB2 ALA A 31 -1.769 5.930 -7.141 1.00 1.00 H ATOM 430 HB3 ALA A 31 -0.944 5.208 -5.752 1.00 0.99 H ATOM 431 N ALA A 32 -3.067 3.315 -5.197 1.00 0.09 N ATOM 432 CA ALA A 32 -3.583 1.970 -5.323 1.00 0.10 C ATOM 433 C ALA A 32 -5.045 1.903 -4.895 1.00 0.09 C ATOM 434 O ALA A 32 -5.878 1.325 -5.591 1.00 0.10 O ATOM 435 CB ALA A 32 -2.739 1.050 -4.468 1.00 0.12 C ATOM 436 H ALA A 32 -2.267 3.454 -4.637 1.00 0.09 H ATOM 437 HA ALA A 32 -3.494 1.660 -6.353 1.00 0.12 H ATOM 438 HB1 ALA A 32 -3.240 0.100 -4.351 1.00 1.02 H ATOM 439 HB2 ALA A 32 -2.589 1.510 -3.497 1.00 1.03 H ATOM 440 HB3 ALA A 32 -1.780 0.899 -4.940 1.00 1.02 H ATOM 441 N THR A 33 -5.362 2.505 -3.754 1.00 0.08 N ATOM 442 CA THR A 33 -6.734 2.499 -3.275 1.00 0.07 C ATOM 443 C THR A 33 -7.568 3.531 -4.040 1.00 0.08 C ATOM 444 O THR A 33 -8.794 3.473 -4.073 1.00 0.10 O ATOM 445 CB THR A 33 -6.801 2.776 -1.766 1.00 0.08 C ATOM 446 OG1 THR A 33 -5.806 2.003 -1.083 1.00 0.09 O ATOM 447 CG2 THR A 33 -8.176 2.424 -1.219 1.00 0.09 C ATOM 448 H THR A 33 -4.662 2.956 -3.221 1.00 0.08 H ATOM 449 HA THR A 33 -7.146 1.510 -3.463 1.00 0.08 H ATOM 450 HB THR A 33 -6.618 3.824 -1.595 1.00 0.09 H ATOM 451 HG1 THR A 33 -4.940 2.168 -1.474 1.00 0.09 H ATOM 452 HG21 THR A 33 -8.155 2.454 -0.141 1.00 0.99 H ATOM 453 HG22 THR A 33 -8.452 1.430 -1.550 1.00 1.01 H ATOM 454 HG23 THR A 33 -8.901 3.136 -1.587 1.00 0.98 H ATOM 455 N ALA A 34 -6.896 4.470 -4.667 1.00 0.08 N ATOM 456 CA ALA A 34 -7.556 5.408 -5.540 1.00 0.09 C ATOM 457 C ALA A 34 -7.995 4.683 -6.801 1.00 0.11 C ATOM 458 O ALA A 34 -8.995 5.031 -7.428 1.00 0.20 O ATOM 459 CB ALA A 34 -6.631 6.569 -5.859 1.00 0.10 C ATOM 460 H ALA A 34 -5.929 4.548 -4.519 1.00 0.09 H ATOM 461 HA ALA A 34 -8.425 5.790 -5.025 1.00 0.09 H ATOM 462 HB1 ALA A 34 -6.357 7.070 -4.938 1.00 1.02 H ATOM 463 HB2 ALA A 34 -7.137 7.265 -6.511 1.00 1.03 H ATOM 464 HB3 ALA A 34 -5.738 6.200 -6.343 1.00 1.00 H ATOM 465 N THR A 35 -7.242 3.649 -7.136 1.00 0.11 N ATOM 466 CA THR A 35 -7.553 2.777 -8.236 1.00 0.12 C ATOM 467 C THR A 35 -8.761 1.897 -7.904 1.00 0.11 C ATOM 468 O THR A 35 -9.725 1.831 -8.671 1.00 0.14 O ATOM 469 CB THR A 35 -6.327 1.896 -8.551 1.00 0.16 C ATOM 470 OG1 THR A 35 -5.516 2.503 -9.562 1.00 0.22 O ATOM 471 CG2 THR A 35 -6.748 0.507 -8.968 1.00 0.17 C ATOM 472 H THR A 35 -6.438 3.458 -6.612 1.00 0.14 H ATOM 473 HA THR A 35 -7.774 3.381 -9.102 1.00 0.14 H ATOM 474 HB THR A 35 -5.737 1.811 -7.648 1.00 0.16 H ATOM 475 HG1 THR A 35 -6.085 2.846 -10.261 1.00 0.81 H ATOM 476 HG21 THR A 35 -5.882 -0.129 -9.044 1.00 1.03 H ATOM 477 HG22 THR A 35 -7.252 0.556 -9.919 1.00 0.99 H ATOM 478 HG23 THR A 35 -7.427 0.115 -8.217 1.00 1.04 H ATOM 479 N VAL A 36 -8.707 1.240 -6.746 1.00 0.10 N ATOM 480 CA VAL A 36 -9.722 0.265 -6.364 1.00 0.11 C ATOM 481 C VAL A 36 -11.114 0.884 -6.299 1.00 0.13 C ATOM 482 O VAL A 36 -12.108 0.220 -6.586 1.00 0.17 O ATOM 483 CB VAL A 36 -9.399 -0.398 -5.007 1.00 0.09 C ATOM 484 CG1 VAL A 36 -8.197 -1.306 -5.099 1.00 0.18 C ATOM 485 CG2 VAL A 36 -9.201 0.624 -3.929 1.00 0.16 C ATOM 486 H VAL A 36 -7.955 1.409 -6.137 1.00 0.09 H ATOM 487 HA VAL A 36 -9.726 -0.508 -7.115 1.00 0.13 H ATOM 488 HB VAL A 36 -10.232 -0.994 -4.722 1.00 0.13 H ATOM 489 HG11 VAL A 36 -8.484 -2.223 -5.590 1.00 0.98 H ATOM 490 HG12 VAL A 36 -7.841 -1.529 -4.105 1.00 1.04 H ATOM 491 HG13 VAL A 36 -7.418 -0.819 -5.665 1.00 0.99 H ATOM 492 HG21 VAL A 36 -8.536 0.228 -3.178 1.00 1.06 H ATOM 493 HG22 VAL A 36 -10.155 0.853 -3.476 1.00 1.03 H ATOM 494 HG23 VAL A 36 -8.780 1.522 -4.355 1.00 1.01 H ATOM 495 N LEU A 37 -11.186 2.155 -5.942 1.00 0.12 N ATOM 496 CA LEU A 37 -12.472 2.815 -5.759 1.00 0.16 C ATOM 497 C LEU A 37 -12.843 3.676 -6.961 1.00 0.25 C ATOM 498 O LEU A 37 -13.838 4.398 -6.933 1.00 0.65 O ATOM 499 CB LEU A 37 -12.416 3.681 -4.513 1.00 0.15 C ATOM 500 CG LEU A 37 -11.713 3.038 -3.331 1.00 0.13 C ATOM 501 CD1 LEU A 37 -11.448 4.075 -2.265 1.00 0.18 C ATOM 502 CD2 LEU A 37 -12.532 1.882 -2.785 1.00 0.15 C ATOM 503 H LEU A 37 -10.361 2.668 -5.774 1.00 0.11 H ATOM 504 HA LEU A 37 -13.225 2.053 -5.624 1.00 0.18 H ATOM 505 HB2 LEU A 37 -11.902 4.594 -4.757 1.00 0.18 H ATOM 506 HB3 LEU A 37 -13.426 3.920 -4.217 1.00 0.19 H ATOM 507 HG LEU A 37 -10.760 2.650 -3.658 1.00 0.11 H ATOM 508 HD11 LEU A 37 -10.859 3.635 -1.478 1.00 1.03 H ATOM 509 HD12 LEU A 37 -12.385 4.429 -1.864 1.00 1.02 H ATOM 510 HD13 LEU A 37 -10.904 4.897 -2.704 1.00 1.03 H ATOM 511 HD21 LEU A 37 -12.670 1.147 -3.563 1.00 1.00 H ATOM 512 HD22 LEU A 37 -13.494 2.249 -2.462 1.00 1.01 H ATOM 513 HD23 LEU A 37 -12.016 1.432 -1.950 1.00 1.02 H ATOM 514 N GLY A 38 -12.035 3.603 -8.009 1.00 0.43 N ATOM 515 CA GLY A 38 -12.299 4.372 -9.211 1.00 0.49 C ATOM 516 C GLY A 38 -12.243 5.876 -8.992 1.00 0.51 C ATOM 517 O GLY A 38 -13.051 6.617 -9.548 1.00 0.62 O ATOM 518 H GLY A 38 -11.264 2.994 -7.982 1.00 0.76 H ATOM 519 HA2 GLY A 38 -11.571 4.104 -9.961 1.00 0.62 H ATOM 520 HA3 GLY A 38 -13.282 4.112 -9.577 1.00 0.48 H ATOM 521 N HIS A 39 -11.294 6.331 -8.186 1.00 0.57 N ATOM 522 CA HIS A 39 -11.127 7.762 -7.936 1.00 0.68 C ATOM 523 C HIS A 39 -9.887 8.294 -8.638 1.00 0.82 C ATOM 524 O HIS A 39 -9.767 9.496 -8.880 1.00 1.81 O ATOM 525 CB HIS A 39 -11.045 8.054 -6.438 1.00 0.65 C ATOM 526 CG HIS A 39 -12.380 8.102 -5.761 1.00 0.73 C ATOM 527 ND1 HIS A 39 -12.953 9.271 -5.311 1.00 1.09 N ATOM 528 CD2 HIS A 39 -13.255 7.116 -5.456 1.00 0.67 C ATOM 529 CE1 HIS A 39 -14.119 9.001 -4.759 1.00 1.15 C ATOM 530 NE2 HIS A 39 -14.328 7.702 -4.835 1.00 0.88 N ATOM 531 H HIS A 39 -10.680 5.693 -7.756 1.00 0.62 H ATOM 532 HA HIS A 39 -11.988 8.265 -8.337 1.00 0.79 H ATOM 533 HB2 HIS A 39 -10.461 7.284 -5.964 1.00 0.56 H ATOM 534 HB3 HIS A 39 -10.561 9.008 -6.289 1.00 0.74 H ATOM 535 HD1 HIS A 39 -12.565 10.173 -5.391 1.00 1.33 H ATOM 536 HD2 HIS A 39 -13.132 6.063 -5.666 1.00 0.69 H ATOM 537 HE1 HIS A 39 -14.789 9.722 -4.318 1.00 1.43 H ATOM 538 HE2 HIS A 39 -15.198 7.266 -4.686 1.00 0.94 H ATOM 539 N HIS A 40 -8.970 7.378 -8.946 1.00 0.53 N ATOM 540 CA HIS A 40 -7.728 7.674 -9.668 1.00 0.48 C ATOM 541 C HIS A 40 -6.731 8.451 -8.801 1.00 0.45 C ATOM 542 O HIS A 40 -5.562 8.075 -8.721 1.00 0.59 O ATOM 543 CB HIS A 40 -8.001 8.426 -10.978 1.00 0.58 C ATOM 544 CG HIS A 40 -6.888 8.323 -11.985 1.00 0.73 C ATOM 545 ND1 HIS A 40 -7.100 8.354 -13.347 1.00 1.35 N ATOM 546 CD2 HIS A 40 -5.547 8.190 -11.823 1.00 0.62 C ATOM 547 CE1 HIS A 40 -5.945 8.245 -13.975 1.00 1.46 C ATOM 548 NE2 HIS A 40 -4.987 8.145 -13.074 1.00 0.94 N ATOM 549 H HIS A 40 -9.135 6.449 -8.673 1.00 1.22 H ATOM 550 HA HIS A 40 -7.278 6.724 -9.914 1.00 0.53 H ATOM 551 HB2 HIS A 40 -8.896 8.028 -11.434 1.00 0.67 H ATOM 552 HB3 HIS A 40 -8.154 9.473 -10.758 1.00 0.65 H ATOM 553 HD1 HIS A 40 -7.976 8.433 -13.793 1.00 1.74 H ATOM 554 HD2 HIS A 40 -5.018 8.129 -10.880 1.00 0.79 H ATOM 555 HE1 HIS A 40 -5.805 8.243 -15.046 1.00 1.95 H ATOM 556 HE2 HIS A 40 -4.048 7.932 -13.268 1.00 0.99 H ATOM 557 N THR A 41 -7.172 9.524 -8.157 1.00 0.46 N ATOM 558 CA THR A 41 -6.265 10.319 -7.348 1.00 0.55 C ATOM 559 C THR A 41 -6.287 9.890 -5.883 1.00 0.37 C ATOM 560 O THR A 41 -7.337 9.577 -5.312 1.00 0.45 O ATOM 561 CB THR A 41 -6.552 11.833 -7.432 1.00 0.92 C ATOM 562 OG1 THR A 41 -5.574 12.566 -6.682 1.00 1.97 O ATOM 563 CG2 THR A 41 -7.923 12.160 -6.887 1.00 0.56 C ATOM 564 H THR A 41 -8.118 9.781 -8.228 1.00 0.53 H ATOM 565 HA THR A 41 -5.277 10.154 -7.739 1.00 0.68 H ATOM 566 HB THR A 41 -6.496 12.136 -8.458 1.00 1.69 H ATOM 567 HG1 THR A 41 -5.285 13.331 -7.195 1.00 2.35 H ATOM 568 HG21 THR A 41 -8.669 11.593 -7.418 1.00 1.17 H ATOM 569 HG22 THR A 41 -8.114 13.215 -7.005 1.00 1.23 H ATOM 570 HG23 THR A 41 -7.949 11.903 -5.838 1.00 1.34 H ATOM 571 N PRO A 42 -5.101 9.890 -5.267 1.00 0.24 N ATOM 572 CA PRO A 42 -4.909 9.572 -3.853 1.00 0.27 C ATOM 573 C PRO A 42 -5.427 10.683 -2.955 1.00 0.40 C ATOM 574 O PRO A 42 -5.487 10.538 -1.737 1.00 0.50 O ATOM 575 CB PRO A 42 -3.390 9.456 -3.688 1.00 0.31 C ATOM 576 CG PRO A 42 -2.816 9.573 -5.056 1.00 0.29 C ATOM 577 CD PRO A 42 -3.849 10.231 -5.922 1.00 0.27 C ATOM 578 HA PRO A 42 -5.377 8.638 -3.587 1.00 0.28 H ATOM 579 HB2 PRO A 42 -3.037 10.246 -3.043 1.00 0.38 H ATOM 580 HB3 PRO A 42 -3.151 8.501 -3.246 1.00 0.39 H ATOM 581 HG2 PRO A 42 -1.914 10.165 -5.032 1.00 0.37 H ATOM 582 HG3 PRO A 42 -2.609 8.586 -5.430 1.00 0.37 H ATOM 583 HD2 PRO A 42 -3.733 11.308 -5.960 1.00 0.30 H ATOM 584 HD3 PRO A 42 -3.810 9.814 -6.912 1.00 0.40 H ATOM 585 N GLU A 43 -5.767 11.807 -3.566 1.00 0.43 N ATOM 586 CA GLU A 43 -6.314 12.944 -2.837 1.00 0.55 C ATOM 587 C GLU A 43 -7.627 12.583 -2.156 1.00 0.52 C ATOM 588 O GLU A 43 -7.939 13.086 -1.079 1.00 0.61 O ATOM 589 CB GLU A 43 -6.518 14.125 -3.776 1.00 0.68 C ATOM 590 CG GLU A 43 -5.229 14.822 -4.139 1.00 0.69 C ATOM 591 CD GLU A 43 -4.521 15.402 -2.933 1.00 1.18 C ATOM 592 OE1 GLU A 43 -4.951 16.469 -2.443 1.00 1.38 O ATOM 593 OE2 GLU A 43 -3.528 14.799 -2.470 1.00 1.82 O ATOM 594 H GLU A 43 -5.635 11.875 -4.541 1.00 0.39 H ATOM 595 HA GLU A 43 -5.595 13.224 -2.084 1.00 0.60 H ATOM 596 HB2 GLU A 43 -6.973 13.771 -4.686 1.00 0.68 H ATOM 597 HB3 GLU A 43 -7.173 14.841 -3.303 1.00 0.85 H ATOM 598 HG2 GLU A 43 -4.580 14.101 -4.606 1.00 1.04 H ATOM 599 HG3 GLU A 43 -5.445 15.619 -4.834 1.00 1.01 H ATOM 600 N SER A 44 -8.383 11.697 -2.782 1.00 0.44 N ATOM 601 CA SER A 44 -9.653 11.253 -2.231 1.00 0.43 C ATOM 602 C SER A 44 -9.440 10.081 -1.275 1.00 0.35 C ATOM 603 O SER A 44 -10.388 9.543 -0.698 1.00 0.49 O ATOM 604 CB SER A 44 -10.577 10.849 -3.369 1.00 0.50 C ATOM 605 OG SER A 44 -10.616 11.857 -4.368 1.00 0.97 O ATOM 606 H SER A 44 -8.085 11.334 -3.643 1.00 0.45 H ATOM 607 HA SER A 44 -10.095 12.071 -1.696 1.00 0.47 H ATOM 608 HB2 SER A 44 -10.214 9.938 -3.806 1.00 0.83 H ATOM 609 HB3 SER A 44 -11.573 10.695 -2.987 1.00 0.87 H ATOM 610 HG SER A 44 -10.428 12.713 -3.963 1.00 1.40 H ATOM 611 N ILE A 45 -8.181 9.700 -1.111 1.00 0.19 N ATOM 612 CA ILE A 45 -7.821 8.548 -0.301 1.00 0.13 C ATOM 613 C ILE A 45 -7.090 8.989 0.959 1.00 0.13 C ATOM 614 O ILE A 45 -5.871 9.170 0.949 1.00 0.19 O ATOM 615 CB ILE A 45 -6.915 7.583 -1.085 1.00 0.11 C ATOM 616 CG1 ILE A 45 -7.497 7.312 -2.472 1.00 0.12 C ATOM 617 CG2 ILE A 45 -6.716 6.275 -0.326 1.00 0.10 C ATOM 618 CD1 ILE A 45 -8.884 6.712 -2.463 1.00 0.11 C ATOM 619 H ILE A 45 -7.471 10.220 -1.543 1.00 0.25 H ATOM 620 HA ILE A 45 -8.723 8.024 -0.032 1.00 0.15 H ATOM 621 HB ILE A 45 -5.950 8.052 -1.198 1.00 0.13 H ATOM 622 HG12 ILE A 45 -7.543 8.239 -3.023 1.00 0.15 H ATOM 623 HG13 ILE A 45 -6.846 6.627 -2.987 1.00 0.13 H ATOM 624 HG21 ILE A 45 -6.322 6.480 0.660 1.00 1.01 H ATOM 625 HG22 ILE A 45 -6.018 5.653 -0.867 1.00 1.04 H ATOM 626 HG23 ILE A 45 -7.662 5.762 -0.238 1.00 1.00 H ATOM 627 HD11 ILE A 45 -9.560 7.371 -1.939 1.00 0.98 H ATOM 628 HD12 ILE A 45 -8.858 5.751 -1.971 1.00 1.03 H ATOM 629 HD13 ILE A 45 -9.220 6.587 -3.481 1.00 1.04 H ATOM 630 N SER A 46 -7.830 9.185 2.035 1.00 0.11 N ATOM 631 CA SER A 46 -7.224 9.506 3.311 1.00 0.12 C ATOM 632 C SER A 46 -6.598 8.238 3.883 1.00 0.11 C ATOM 633 O SER A 46 -7.134 7.144 3.700 1.00 0.12 O ATOM 634 CB SER A 46 -8.269 10.071 4.271 1.00 0.16 C ATOM 635 OG SER A 46 -7.674 10.704 5.389 1.00 1.18 O ATOM 636 H SER A 46 -8.805 9.102 1.972 1.00 0.13 H ATOM 637 HA SER A 46 -6.456 10.240 3.147 1.00 0.13 H ATOM 638 HB2 SER A 46 -8.884 10.788 3.753 1.00 0.81 H ATOM 639 HB3 SER A 46 -8.880 9.263 4.625 1.00 0.90 H ATOM 640 HG SER A 46 -7.453 11.616 5.160 1.00 1.49 H ATOM 641 N PRO A 47 -5.487 8.363 4.618 1.00 0.12 N ATOM 642 CA PRO A 47 -4.718 7.227 5.084 1.00 0.12 C ATOM 643 C PRO A 47 -5.242 6.748 6.407 1.00 0.10 C ATOM 644 O PRO A 47 -4.786 5.751 6.958 1.00 0.11 O ATOM 645 CB PRO A 47 -3.331 7.833 5.243 1.00 0.15 C ATOM 646 CG PRO A 47 -3.599 9.216 5.728 1.00 0.17 C ATOM 647 CD PRO A 47 -4.938 9.619 5.152 1.00 0.16 C ATOM 648 HA PRO A 47 -4.701 6.417 4.379 1.00 0.11 H ATOM 649 HB2 PRO A 47 -2.762 7.263 5.958 1.00 0.16 H ATOM 650 HB3 PRO A 47 -2.827 7.841 4.293 1.00 0.16 H ATOM 651 HG2 PRO A 47 -3.641 9.223 6.807 1.00 0.17 H ATOM 652 HG3 PRO A 47 -2.827 9.883 5.382 1.00 0.19 H ATOM 653 HD2 PRO A 47 -5.585 9.991 5.940 1.00 0.17 H ATOM 654 HD3 PRO A 47 -4.815 10.355 4.372 1.00 0.19 H ATOM 655 N ALA A 48 -6.229 7.469 6.889 1.00 0.12 N ATOM 656 CA ALA A 48 -6.732 7.267 8.211 1.00 0.13 C ATOM 657 C ALA A 48 -8.240 7.036 8.200 1.00 0.13 C ATOM 658 O ALA A 48 -8.850 6.772 9.234 1.00 0.17 O ATOM 659 CB ALA A 48 -6.336 8.457 9.052 1.00 0.18 C ATOM 660 H ALA A 48 -6.620 8.177 6.332 1.00 0.15 H ATOM 661 HA ALA A 48 -6.243 6.403 8.610 1.00 0.13 H ATOM 662 HB1 ALA A 48 -5.290 8.680 8.863 1.00 1.07 H ATOM 663 HB2 ALA A 48 -6.477 8.229 10.096 1.00 1.02 H ATOM 664 HB3 ALA A 48 -6.938 9.307 8.777 1.00 1.02 H ATOM 665 N THR A 49 -8.830 7.124 7.010 1.00 0.12 N ATOM 666 CA THR A 49 -10.244 6.857 6.821 1.00 0.12 C ATOM 667 C THR A 49 -10.559 5.391 7.087 1.00 0.10 C ATOM 668 O THR A 49 -11.535 5.073 7.769 1.00 0.10 O ATOM 669 CB THR A 49 -10.656 7.207 5.380 1.00 0.14 C ATOM 670 OG1 THR A 49 -10.762 8.627 5.215 1.00 0.20 O ATOM 671 CG2 THR A 49 -11.958 6.536 5.006 1.00 0.13 C ATOM 672 H THR A 49 -8.297 7.374 6.234 1.00 0.15 H ATOM 673 HA THR A 49 -10.806 7.476 7.504 1.00 0.14 H ATOM 674 HB THR A 49 -9.887 6.839 4.719 1.00 0.15 H ATOM 675 HG1 THR A 49 -11.135 8.818 4.343 1.00 0.82 H ATOM 676 HG21 THR A 49 -12.218 6.790 3.992 1.00 0.98 H ATOM 677 HG22 THR A 49 -12.737 6.863 5.676 1.00 1.00 H ATOM 678 HG23 THR A 49 -11.831 5.465 5.090 1.00 0.98 H ATOM 679 N ALA A 50 -9.684 4.541 6.536 1.00 0.09 N ATOM 680 CA ALA A 50 -9.759 3.077 6.575 1.00 0.08 C ATOM 681 C ALA A 50 -10.275 2.542 5.268 1.00 0.08 C ATOM 682 O ALA A 50 -11.206 3.078 4.681 1.00 0.09 O ATOM 683 CB ALA A 50 -10.592 2.533 7.721 1.00 0.09 C ATOM 684 H ALA A 50 -8.941 4.929 6.055 1.00 0.10 H ATOM 685 HA ALA A 50 -8.748 2.705 6.699 1.00 0.09 H ATOM 686 HB1 ALA A 50 -10.504 1.456 7.748 1.00 1.02 H ATOM 687 HB2 ALA A 50 -11.628 2.808 7.570 1.00 1.02 H ATOM 688 HB3 ALA A 50 -10.238 2.949 8.652 1.00 1.01 H ATOM 689 N PHE A 51 -9.626 1.488 4.819 1.00 0.08 N ATOM 690 CA PHE A 51 -10.000 0.788 3.603 1.00 0.09 C ATOM 691 C PHE A 51 -11.461 0.406 3.616 1.00 0.10 C ATOM 692 O PHE A 51 -12.163 0.576 2.624 1.00 0.10 O ATOM 693 CB PHE A 51 -9.149 -0.453 3.464 1.00 0.11 C ATOM 694 CG PHE A 51 -7.730 -0.129 3.176 1.00 0.11 C ATOM 695 CD1 PHE A 51 -7.405 0.736 2.161 1.00 0.11 C ATOM 696 CD2 PHE A 51 -6.721 -0.704 3.922 1.00 0.12 C ATOM 697 CE1 PHE A 51 -6.096 1.036 1.892 1.00 0.12 C ATOM 698 CE2 PHE A 51 -5.406 -0.413 3.660 1.00 0.13 C ATOM 699 CZ PHE A 51 -5.096 0.486 2.640 1.00 0.13 C ATOM 700 H PHE A 51 -8.844 1.166 5.333 1.00 0.08 H ATOM 701 HA PHE A 51 -9.810 1.439 2.765 1.00 0.10 H ATOM 702 HB2 PHE A 51 -9.183 -1.010 4.389 1.00 0.11 H ATOM 703 HB3 PHE A 51 -9.528 -1.070 2.661 1.00 0.11 H ATOM 704 HD1 PHE A 51 -8.195 1.182 1.574 1.00 0.12 H ATOM 705 HD2 PHE A 51 -6.975 -1.390 4.715 1.00 0.12 H ATOM 706 HE1 PHE A 51 -5.855 1.716 1.089 1.00 0.13 H ATOM 707 HE2 PHE A 51 -4.625 -0.868 4.249 1.00 0.14 H ATOM 708 HZ PHE A 51 -4.064 0.721 2.430 1.00 0.14 H ATOM 709 N LYS A 52 -11.906 -0.110 4.749 1.00 0.11 N ATOM 710 CA LYS A 52 -13.304 -0.443 4.937 1.00 0.13 C ATOM 711 C LYS A 52 -14.177 0.748 4.587 1.00 0.12 C ATOM 712 O LYS A 52 -15.156 0.642 3.847 1.00 0.15 O ATOM 713 CB LYS A 52 -13.565 -0.788 6.397 1.00 0.17 C ATOM 714 CG LYS A 52 -12.783 -1.979 6.909 1.00 0.53 C ATOM 715 CD LYS A 52 -13.248 -2.430 8.290 1.00 0.64 C ATOM 716 CE LYS A 52 -12.938 -1.426 9.389 1.00 0.59 C ATOM 717 NZ LYS A 52 -13.818 -0.223 9.373 1.00 1.22 N ATOM 718 H LYS A 52 -11.274 -0.282 5.476 1.00 0.12 H ATOM 719 HA LYS A 52 -13.540 -1.290 4.305 1.00 0.15 H ATOM 720 HB2 LYS A 52 -13.292 0.069 6.995 1.00 0.45 H ATOM 721 HB3 LYS A 52 -14.620 -0.979 6.523 1.00 0.45 H ATOM 722 HG2 LYS A 52 -12.903 -2.798 6.218 1.00 0.76 H ATOM 723 HG3 LYS A 52 -11.740 -1.708 6.964 1.00 0.76 H ATOM 724 HD2 LYS A 52 -14.311 -2.600 8.266 1.00 0.75 H ATOM 725 HD3 LYS A 52 -12.745 -3.350 8.527 1.00 0.98 H ATOM 726 HE2 LYS A 52 -13.052 -1.920 10.342 1.00 1.18 H ATOM 727 HE3 LYS A 52 -11.915 -1.120 9.273 1.00 1.08 H ATOM 728 HZ1 LYS A 52 -13.625 0.368 10.209 1.00 1.55 H ATOM 729 HZ2 LYS A 52 -14.819 -0.505 9.393 1.00 1.84 H ATOM 730 HZ3 LYS A 52 -13.647 0.344 8.522 1.00 1.84 H ATOM 731 N ASP A 53 -13.766 1.891 5.115 1.00 0.11 N ATOM 732 CA ASP A 53 -14.525 3.122 5.018 1.00 0.11 C ATOM 733 C ASP A 53 -14.317 3.769 3.655 1.00 0.10 C ATOM 734 O ASP A 53 -14.965 4.757 3.303 1.00 0.18 O ATOM 735 CB ASP A 53 -14.094 4.080 6.131 1.00 0.12 C ATOM 736 CG ASP A 53 -14.488 3.584 7.510 1.00 0.58 C ATOM 737 OD1 ASP A 53 -13.926 2.565 7.962 1.00 1.14 O ATOM 738 OD2 ASP A 53 -15.366 4.205 8.151 1.00 0.67 O ATOM 739 H ASP A 53 -12.903 1.910 5.581 1.00 0.11 H ATOM 740 HA ASP A 53 -15.563 2.875 5.145 1.00 0.12 H ATOM 741 HB2 ASP A 53 -13.013 4.196 6.105 1.00 0.42 H ATOM 742 HB3 ASP A 53 -14.559 5.042 5.968 1.00 0.47 H ATOM 743 N LEU A 54 -13.394 3.196 2.906 1.00 0.08 N ATOM 744 CA LEU A 54 -13.051 3.671 1.581 1.00 0.08 C ATOM 745 C LEU A 54 -13.850 2.934 0.522 1.00 0.08 C ATOM 746 O LEU A 54 -14.152 3.486 -0.534 1.00 0.10 O ATOM 747 CB LEU A 54 -11.551 3.481 1.345 1.00 0.08 C ATOM 748 CG LEU A 54 -10.663 4.557 1.963 1.00 0.09 C ATOM 749 CD1 LEU A 54 -9.214 4.116 1.987 1.00 0.10 C ATOM 750 CD2 LEU A 54 -10.799 5.852 1.193 1.00 0.12 C ATOM 751 H LEU A 54 -12.920 2.418 3.262 1.00 0.11 H ATOM 752 HA LEU A 54 -13.286 4.723 1.531 1.00 0.10 H ATOM 753 HB2 LEU A 54 -11.266 2.535 1.767 1.00 0.08 H ATOM 754 HB3 LEU A 54 -11.367 3.448 0.283 1.00 0.08 H ATOM 755 HG LEU A 54 -10.975 4.735 2.981 1.00 0.09 H ATOM 756 HD11 LEU A 54 -9.116 3.243 2.614 1.00 1.03 H ATOM 757 HD12 LEU A 54 -8.606 4.915 2.384 1.00 1.02 H ATOM 758 HD13 LEU A 54 -8.893 3.883 0.986 1.00 1.02 H ATOM 759 HD21 LEU A 54 -10.122 6.584 1.602 1.00 1.01 H ATOM 760 HD22 LEU A 54 -11.812 6.210 1.271 1.00 1.00 H ATOM 761 HD23 LEU A 54 -10.557 5.674 0.157 1.00 1.05 H ATOM 762 N GLY A 55 -14.221 1.697 0.818 1.00 0.09 N ATOM 763 CA GLY A 55 -14.940 0.900 -0.149 1.00 0.10 C ATOM 764 C GLY A 55 -14.277 -0.431 -0.378 1.00 0.10 C ATOM 765 O GLY A 55 -14.736 -1.234 -1.191 1.00 0.15 O ATOM 766 H GLY A 55 -14.044 1.334 1.717 1.00 0.09 H ATOM 767 HA2 GLY A 55 -15.945 0.735 0.210 1.00 0.12 H ATOM 768 HA3 GLY A 55 -14.985 1.436 -1.085 1.00 0.11 H ATOM 769 N ILE A 56 -13.184 -0.657 0.334 1.00 0.09 N ATOM 770 CA ILE A 56 -12.473 -1.917 0.265 1.00 0.09 C ATOM 771 C ILE A 56 -13.328 -3.052 0.824 1.00 0.14 C ATOM 772 O ILE A 56 -13.487 -3.185 2.040 1.00 0.32 O ATOM 773 CB ILE A 56 -11.141 -1.861 1.045 1.00 0.10 C ATOM 774 CG1 ILE A 56 -10.093 -0.987 0.360 1.00 0.11 C ATOM 775 CG2 ILE A 56 -10.604 -3.244 1.269 1.00 0.15 C ATOM 776 CD1 ILE A 56 -10.204 -0.936 -1.141 1.00 0.10 C ATOM 777 H ILE A 56 -12.844 0.046 0.927 1.00 0.10 H ATOM 778 HA ILE A 56 -12.250 -2.122 -0.773 1.00 0.09 H ATOM 779 HB ILE A 56 -11.348 -1.438 2.011 1.00 0.10 H ATOM 780 HG12 ILE A 56 -10.169 0.014 0.741 1.00 0.13 H ATOM 781 HG13 ILE A 56 -9.115 -1.374 0.603 1.00 0.16 H ATOM 782 HG21 ILE A 56 -11.098 -3.673 2.132 1.00 1.07 H ATOM 783 HG22 ILE A 56 -9.542 -3.192 1.438 1.00 1.03 H ATOM 784 HG23 ILE A 56 -10.807 -3.847 0.401 1.00 0.99 H ATOM 785 HD11 ILE A 56 -10.176 -1.940 -1.539 1.00 1.00 H ATOM 786 HD12 ILE A 56 -9.376 -0.370 -1.537 1.00 0.96 H ATOM 787 HD13 ILE A 56 -11.132 -0.458 -1.416 1.00 1.00 H ATOM 788 N ASP A 57 -13.905 -3.844 -0.063 1.00 0.19 N ATOM 789 CA ASP A 57 -14.660 -5.015 0.356 1.00 0.28 C ATOM 790 C ASP A 57 -14.216 -6.257 -0.408 1.00 0.28 C ATOM 791 O ASP A 57 -14.758 -6.571 -1.468 1.00 0.67 O ATOM 792 CB ASP A 57 -16.159 -4.779 0.157 1.00 0.52 C ATOM 793 CG ASP A 57 -16.999 -5.957 0.606 1.00 1.48 C ATOM 794 OD1 ASP A 57 -17.068 -6.215 1.827 1.00 2.34 O ATOM 795 OD2 ASP A 57 -17.610 -6.620 -0.256 1.00 1.95 O ATOM 796 H ASP A 57 -13.880 -3.603 -1.014 1.00 0.42 H ATOM 797 HA ASP A 57 -14.468 -5.170 1.406 1.00 0.44 H ATOM 798 HB2 ASP A 57 -16.457 -3.910 0.726 1.00 0.99 H ATOM 799 HB3 ASP A 57 -16.353 -4.601 -0.889 1.00 0.75 H ATOM 800 N SER A 58 -13.203 -6.935 0.134 1.00 0.23 N ATOM 801 CA SER A 58 -12.713 -8.216 -0.391 1.00 0.26 C ATOM 802 C SER A 58 -12.055 -8.079 -1.769 1.00 0.19 C ATOM 803 O SER A 58 -10.834 -8.173 -1.892 1.00 0.17 O ATOM 804 CB SER A 58 -13.846 -9.228 -0.448 1.00 0.36 C ATOM 805 OG SER A 58 -14.603 -9.214 0.753 1.00 1.25 O ATOM 806 H SER A 58 -12.769 -6.564 0.930 1.00 0.45 H ATOM 807 HA SER A 58 -11.980 -8.581 0.291 1.00 0.35 H ATOM 808 HB2 SER A 58 -14.483 -8.980 -1.267 1.00 0.92 H ATOM 809 HB3 SER A 58 -13.439 -10.216 -0.593 1.00 0.87 H ATOM 810 HG SER A 58 -15.541 -9.308 0.539 1.00 1.39 H ATOM 811 N LEU A 59 -12.867 -7.840 -2.791 1.00 0.22 N ATOM 812 CA LEU A 59 -12.393 -7.744 -4.171 1.00 0.20 C ATOM 813 C LEU A 59 -11.371 -6.646 -4.304 1.00 0.14 C ATOM 814 O LEU A 59 -10.275 -6.852 -4.817 1.00 0.14 O ATOM 815 CB LEU A 59 -13.535 -7.410 -5.122 1.00 0.23 C ATOM 816 CG LEU A 59 -14.568 -8.510 -5.390 1.00 0.30 C ATOM 817 CD1 LEU A 59 -15.219 -9.000 -4.109 1.00 1.12 C ATOM 818 CD2 LEU A 59 -15.617 -7.981 -6.343 1.00 1.18 C ATOM 819 H LEU A 59 -13.826 -7.708 -2.610 1.00 0.29 H ATOM 820 HA LEU A 59 -11.949 -8.688 -4.451 1.00 0.23 H ATOM 821 HB2 LEU A 59 -14.050 -6.548 -4.727 1.00 0.22 H ATOM 822 HB3 LEU A 59 -13.096 -7.129 -6.066 1.00 0.24 H ATOM 823 HG LEU A 59 -14.081 -9.349 -5.860 1.00 0.93 H ATOM 824 HD11 LEU A 59 -15.740 -8.183 -3.634 1.00 1.60 H ATOM 825 HD12 LEU A 59 -14.456 -9.377 -3.444 1.00 1.77 H ATOM 826 HD13 LEU A 59 -15.917 -9.789 -4.342 1.00 1.74 H ATOM 827 HD21 LEU A 59 -15.157 -7.749 -7.291 1.00 1.74 H ATOM 828 HD22 LEU A 59 -16.052 -7.084 -5.926 1.00 1.76 H ATOM 829 HD23 LEU A 59 -16.385 -8.726 -6.484 1.00 1.79 H ATOM 830 N THR A 60 -11.735 -5.477 -3.816 1.00 0.12 N ATOM 831 CA THR A 60 -10.871 -4.326 -3.924 1.00 0.10 C ATOM 832 C THR A 60 -9.772 -4.389 -2.888 1.00 0.09 C ATOM 833 O THR A 60 -8.804 -3.645 -2.952 1.00 0.10 O ATOM 834 CB THR A 60 -11.648 -3.018 -3.786 1.00 0.12 C ATOM 835 OG1 THR A 60 -12.698 -3.179 -2.823 1.00 0.16 O ATOM 836 CG2 THR A 60 -12.214 -2.607 -5.132 1.00 0.16 C ATOM 837 H THR A 60 -12.583 -5.400 -3.328 1.00 0.13 H ATOM 838 HA THR A 60 -10.425 -4.348 -4.904 1.00 0.11 H ATOM 839 HB THR A 60 -10.967 -2.250 -3.447 1.00 0.14 H ATOM 840 HG1 THR A 60 -13.509 -2.782 -3.166 1.00 0.35 H ATOM 841 HG21 THR A 60 -12.711 -1.654 -5.040 1.00 1.02 H ATOM 842 HG22 THR A 60 -12.917 -3.352 -5.470 1.00 0.99 H ATOM 843 HG23 THR A 60 -11.403 -2.525 -5.849 1.00 0.98 H ATOM 844 N ALA A 61 -9.928 -5.290 -1.933 1.00 0.09 N ATOM 845 CA ALA A 61 -8.871 -5.554 -0.978 1.00 0.09 C ATOM 846 C ALA A 61 -7.812 -6.424 -1.634 1.00 0.09 C ATOM 847 O ALA A 61 -6.620 -6.285 -1.365 1.00 0.12 O ATOM 848 CB ALA A 61 -9.417 -6.217 0.275 1.00 0.10 C ATOM 849 H ALA A 61 -10.775 -5.787 -1.877 1.00 0.10 H ATOM 850 HA ALA A 61 -8.428 -4.607 -0.698 1.00 0.10 H ATOM 851 HB1 ALA A 61 -10.257 -5.646 0.643 1.00 1.01 H ATOM 852 HB2 ALA A 61 -8.640 -6.242 1.030 1.00 1.04 H ATOM 853 HB3 ALA A 61 -9.732 -7.223 0.045 1.00 1.02 H ATOM 854 N LEU A 62 -8.259 -7.329 -2.500 1.00 0.10 N ATOM 855 CA LEU A 62 -7.354 -8.148 -3.272 1.00 0.11 C ATOM 856 C LEU A 62 -6.784 -7.338 -4.428 1.00 0.11 C ATOM 857 O LEU A 62 -5.603 -7.422 -4.718 1.00 0.13 O ATOM 858 CB LEU A 62 -8.080 -9.367 -3.825 1.00 0.14 C ATOM 859 CG LEU A 62 -7.244 -10.645 -4.006 1.00 0.20 C ATOM 860 CD1 LEU A 62 -5.772 -10.334 -4.245 1.00 0.53 C ATOM 861 CD2 LEU A 62 -7.412 -11.556 -2.807 1.00 0.52 C ATOM 862 H LEU A 62 -9.225 -7.486 -2.593 1.00 0.11 H ATOM 863 HA LEU A 62 -6.551 -8.469 -2.627 1.00 0.12 H ATOM 864 HB2 LEU A 62 -8.905 -9.595 -3.166 1.00 0.14 H ATOM 865 HB3 LEU A 62 -8.478 -9.090 -4.779 1.00 0.16 H ATOM 866 HG LEU A 62 -7.606 -11.173 -4.877 1.00 0.46 H ATOM 867 HD11 LEU A 62 -5.361 -9.829 -3.379 1.00 1.21 H ATOM 868 HD12 LEU A 62 -5.680 -9.690 -5.107 1.00 1.16 H ATOM 869 HD13 LEU A 62 -5.231 -11.251 -4.418 1.00 1.19 H ATOM 870 HD21 LEU A 62 -6.770 -12.417 -2.913 1.00 1.20 H ATOM 871 HD22 LEU A 62 -8.441 -11.879 -2.741 1.00 1.10 H ATOM 872 HD23 LEU A 62 -7.148 -11.018 -1.911 1.00 1.27 H ATOM 873 N GLU A 63 -7.616 -6.559 -5.100 1.00 0.10 N ATOM 874 CA GLU A 63 -7.162 -5.705 -6.168 1.00 0.11 C ATOM 875 C GLU A 63 -6.212 -4.644 -5.615 1.00 0.10 C ATOM 876 O GLU A 63 -5.254 -4.243 -6.282 1.00 0.12 O ATOM 877 CB GLU A 63 -8.401 -5.094 -6.819 1.00 0.14 C ATOM 878 CG GLU A 63 -8.158 -3.767 -7.472 1.00 0.41 C ATOM 879 CD GLU A 63 -7.399 -3.877 -8.777 1.00 0.59 C ATOM 880 OE1 GLU A 63 -6.550 -3.001 -9.048 1.00 0.72 O ATOM 881 OE2 GLU A 63 -7.620 -4.849 -9.523 1.00 0.83 O ATOM 882 H GLU A 63 -8.579 -6.545 -4.915 1.00 0.10 H ATOM 883 HA GLU A 63 -6.633 -6.311 -6.895 1.00 0.13 H ATOM 884 HB2 GLU A 63 -8.774 -5.775 -7.568 1.00 0.42 H ATOM 885 HB3 GLU A 63 -9.153 -4.962 -6.060 1.00 0.37 H ATOM 886 HG2 GLU A 63 -9.107 -3.285 -7.657 1.00 0.58 H ATOM 887 HG3 GLU A 63 -7.582 -3.186 -6.774 1.00 0.55 H ATOM 888 N LEU A 64 -6.472 -4.209 -4.380 1.00 0.09 N ATOM 889 CA LEU A 64 -5.517 -3.388 -3.655 1.00 0.09 C ATOM 890 C LEU A 64 -4.206 -4.133 -3.591 1.00 0.12 C ATOM 891 O LEU A 64 -3.147 -3.624 -3.954 1.00 0.17 O ATOM 892 CB LEU A 64 -5.994 -3.116 -2.222 1.00 0.12 C ATOM 893 CG LEU A 64 -6.047 -1.649 -1.821 1.00 0.17 C ATOM 894 CD1 LEU A 64 -6.467 -1.517 -0.364 1.00 0.43 C ATOM 895 CD2 LEU A 64 -4.694 -1.006 -2.057 1.00 0.44 C ATOM 896 H LEU A 64 -7.324 -4.442 -3.952 1.00 0.08 H ATOM 897 HA LEU A 64 -5.384 -2.465 -4.181 1.00 0.10 H ATOM 898 HB2 LEU A 64 -6.982 -3.541 -2.090 1.00 0.30 H ATOM 899 HB3 LEU A 64 -5.310 -3.618 -1.549 1.00 0.28 H ATOM 900 HG LEU A 64 -6.777 -1.138 -2.430 1.00 0.51 H ATOM 901 HD11 LEU A 64 -6.474 -0.473 -0.084 1.00 1.11 H ATOM 902 HD12 LEU A 64 -5.765 -2.052 0.266 1.00 1.20 H ATOM 903 HD13 LEU A 64 -7.458 -1.934 -0.228 1.00 1.10 H ATOM 904 HD21 LEU A 64 -4.398 -1.158 -3.088 1.00 1.13 H ATOM 905 HD22 LEU A 64 -3.966 -1.465 -1.407 1.00 1.14 H ATOM 906 HD23 LEU A 64 -4.753 0.051 -1.849 1.00 1.09 H ATOM 907 N ARG A 65 -4.336 -5.377 -3.188 1.00 0.12 N ATOM 908 CA ARG A 65 -3.207 -6.275 -2.977 1.00 0.15 C ATOM 909 C ARG A 65 -2.443 -6.455 -4.278 1.00 0.16 C ATOM 910 O ARG A 65 -1.218 -6.355 -4.322 1.00 0.19 O ATOM 911 CB ARG A 65 -3.713 -7.629 -2.434 1.00 0.18 C ATOM 912 CG ARG A 65 -2.624 -8.677 -2.202 1.00 0.33 C ATOM 913 CD ARG A 65 -2.267 -9.433 -3.475 1.00 0.43 C ATOM 914 NE ARG A 65 -1.134 -10.333 -3.278 1.00 0.78 N ATOM 915 CZ ARG A 65 -0.496 -10.957 -4.265 1.00 1.35 C ATOM 916 NH1 ARG A 65 -0.901 -10.817 -5.522 1.00 1.63 N ATOM 917 NH2 ARG A 65 0.539 -11.739 -3.987 1.00 1.72 N ATOM 918 H ARG A 65 -5.246 -5.711 -3.058 1.00 0.11 H ATOM 919 HA ARG A 65 -2.560 -5.826 -2.248 1.00 0.17 H ATOM 920 HB2 ARG A 65 -4.210 -7.453 -1.492 1.00 0.25 H ATOM 921 HB3 ARG A 65 -4.437 -8.037 -3.138 1.00 0.20 H ATOM 922 HG2 ARG A 65 -1.739 -8.181 -1.835 1.00 0.64 H ATOM 923 HG3 ARG A 65 -2.974 -9.382 -1.462 1.00 0.65 H ATOM 924 HD2 ARG A 65 -3.123 -10.012 -3.786 1.00 0.56 H ATOM 925 HD3 ARG A 65 -2.018 -8.717 -4.245 1.00 0.59 H ATOM 926 HE ARG A 65 -0.822 -10.471 -2.350 1.00 0.71 H ATOM 927 HH11 ARG A 65 -1.693 -10.243 -5.735 1.00 1.41 H ATOM 928 HH12 ARG A 65 -0.414 -11.286 -6.263 1.00 2.09 H ATOM 929 HH21 ARG A 65 0.835 -11.859 -3.037 1.00 1.59 H ATOM 930 HH22 ARG A 65 1.033 -12.207 -4.726 1.00 2.17 H ATOM 931 N ASN A 66 -3.198 -6.709 -5.328 1.00 0.14 N ATOM 932 CA ASN A 66 -2.665 -6.925 -6.658 1.00 0.16 C ATOM 933 C ASN A 66 -1.860 -5.726 -7.149 1.00 0.16 C ATOM 934 O ASN A 66 -0.896 -5.889 -7.896 1.00 0.21 O ATOM 935 CB ASN A 66 -3.813 -7.267 -7.608 1.00 0.20 C ATOM 936 CG ASN A 66 -4.176 -8.738 -7.532 1.00 0.32 C ATOM 937 OD1 ASN A 66 -3.307 -9.588 -7.329 1.00 0.83 O ATOM 938 ND2 ASN A 66 -5.455 -9.055 -7.660 1.00 0.34 N ATOM 939 H ASN A 66 -4.171 -6.779 -5.194 1.00 0.14 H ATOM 940 HA ASN A 66 -2.002 -7.775 -6.604 1.00 0.19 H ATOM 941 HB2 ASN A 66 -4.681 -6.686 -7.334 1.00 0.16 H ATOM 942 HB3 ASN A 66 -3.534 -7.029 -8.620 1.00 0.29 H ATOM 943 HD21 ASN A 66 -6.105 -8.332 -7.794 1.00 0.68 H ATOM 944 HD22 ASN A 66 -5.703 -10.001 -7.613 1.00 0.33 H ATOM 945 N THR A 67 -2.245 -4.525 -6.738 1.00 0.14 N ATOM 946 CA THR A 67 -1.438 -3.354 -7.038 1.00 0.15 C ATOM 947 C THR A 67 -0.223 -3.291 -6.123 1.00 0.16 C ATOM 948 O THR A 67 0.909 -3.307 -6.594 1.00 0.21 O ATOM 949 CB THR A 67 -2.246 -2.054 -6.897 1.00 0.17 C ATOM 950 OG1 THR A 67 -3.440 -2.131 -7.688 1.00 0.22 O ATOM 951 CG2 THR A 67 -1.420 -0.845 -7.323 1.00 0.19 C ATOM 952 H THR A 67 -3.105 -4.414 -6.265 1.00 0.13 H ATOM 953 HA THR A 67 -1.095 -3.438 -8.057 1.00 0.17 H ATOM 954 HB THR A 67 -2.516 -1.939 -5.864 1.00 0.19 H ATOM 955 HG1 THR A 67 -4.117 -2.620 -7.200 1.00 0.29 H ATOM 956 HG21 THR A 67 -1.087 -0.975 -8.343 1.00 1.03 H ATOM 957 HG22 THR A 67 -0.556 -0.745 -6.675 1.00 1.04 H ATOM 958 HG23 THR A 67 -2.024 0.048 -7.253 1.00 1.03 H ATOM 959 N LEU A 68 -0.472 -3.256 -4.819 1.00 0.17 N ATOM 960 CA LEU A 68 0.581 -3.099 -3.816 1.00 0.20 C ATOM 961 C LEU A 68 1.717 -4.072 -4.037 1.00 0.20 C ATOM 962 O LEU A 68 2.875 -3.678 -4.104 1.00 0.23 O ATOM 963 CB LEU A 68 0.031 -3.366 -2.426 1.00 0.30 C ATOM 964 CG LEU A 68 -1.240 -2.631 -2.064 1.00 0.79 C ATOM 965 CD1 LEU A 68 -1.897 -3.334 -0.898 1.00 1.38 C ATOM 966 CD2 LEU A 68 -0.943 -1.182 -1.725 1.00 1.40 C ATOM 967 H LEU A 68 -1.405 -3.332 -4.517 1.00 0.16 H ATOM 968 HA LEU A 68 0.962 -2.087 -3.876 1.00 0.25 H ATOM 969 HB2 LEU A 68 -0.161 -4.425 -2.343 1.00 0.82 H ATOM 970 HB3 LEU A 68 0.787 -3.103 -1.707 1.00 0.85 H ATOM 971 HG LEU A 68 -1.921 -2.654 -2.903 1.00 0.98 H ATOM 972 HD11 LEU A 68 -1.315 -3.168 -0.004 1.00 1.76 H ATOM 973 HD12 LEU A 68 -1.947 -4.392 -1.100 1.00 1.88 H ATOM 974 HD13 LEU A 68 -2.892 -2.948 -0.759 1.00 1.92 H ATOM 975 HD21 LEU A 68 -1.867 -0.664 -1.513 1.00 2.06 H ATOM 976 HD22 LEU A 68 -0.451 -0.709 -2.562 1.00 1.88 H ATOM 977 HD23 LEU A 68 -0.300 -1.140 -0.859 1.00 1.68 H ATOM 978 N THR A 69 1.379 -5.347 -4.104 1.00 0.22 N ATOM 979 CA THR A 69 2.352 -6.390 -4.317 1.00 0.25 C ATOM 980 C THR A 69 3.206 -6.109 -5.551 1.00 0.25 C ATOM 981 O THR A 69 4.404 -6.388 -5.574 1.00 0.33 O ATOM 982 CB THR A 69 1.621 -7.743 -4.462 1.00 0.34 C ATOM 983 OG1 THR A 69 1.584 -8.425 -3.205 1.00 1.01 O ATOM 984 CG2 THR A 69 2.254 -8.617 -5.532 1.00 0.65 C ATOM 985 H THR A 69 0.441 -5.612 -3.983 1.00 0.23 H ATOM 986 HA THR A 69 2.988 -6.425 -3.440 1.00 0.25 H ATOM 987 HB THR A 69 0.602 -7.535 -4.761 1.00 0.80 H ATOM 988 HG1 THR A 69 2.477 -8.722 -2.979 1.00 0.95 H ATOM 989 HG21 THR A 69 1.692 -9.531 -5.632 1.00 1.27 H ATOM 990 HG22 THR A 69 3.273 -8.843 -5.259 1.00 1.28 H ATOM 991 HG23 THR A 69 2.242 -8.077 -6.474 1.00 1.25 H ATOM 992 N HIS A 70 2.582 -5.539 -6.561 1.00 0.21 N ATOM 993 CA HIS A 70 3.267 -5.201 -7.790 1.00 0.22 C ATOM 994 C HIS A 70 4.151 -3.981 -7.572 1.00 0.21 C ATOM 995 O HIS A 70 5.219 -3.866 -8.158 1.00 0.28 O ATOM 996 CB HIS A 70 2.235 -4.923 -8.887 1.00 0.24 C ATOM 997 CG HIS A 70 2.814 -4.629 -10.241 1.00 0.30 C ATOM 998 ND1 HIS A 70 2.839 -5.546 -11.271 1.00 0.39 N ATOM 999 CD2 HIS A 70 3.365 -3.498 -10.739 1.00 0.34 C ATOM 1000 CE1 HIS A 70 3.380 -4.990 -12.340 1.00 0.45 C ATOM 1001 NE2 HIS A 70 3.707 -3.748 -12.044 1.00 0.41 N ATOM 1002 H HIS A 70 1.629 -5.327 -6.474 1.00 0.22 H ATOM 1003 HA HIS A 70 3.886 -6.036 -8.070 1.00 0.25 H ATOM 1004 HB2 HIS A 70 1.577 -5.768 -8.981 1.00 0.25 H ATOM 1005 HB3 HIS A 70 1.649 -4.074 -8.586 1.00 0.25 H ATOM 1006 HD1 HIS A 70 2.516 -6.474 -11.222 1.00 0.44 H ATOM 1007 HD2 HIS A 70 3.521 -2.575 -10.200 1.00 0.37 H ATOM 1008 HE1 HIS A 70 3.528 -5.472 -13.295 1.00 0.54 H ATOM 1009 HE2 HIS A 70 4.232 -3.147 -12.619 1.00 0.50 H ATOM 1010 N ASN A 71 3.678 -3.067 -6.739 1.00 0.19 N ATOM 1011 CA ASN A 71 4.409 -1.843 -6.430 1.00 0.22 C ATOM 1012 C ASN A 71 5.614 -2.127 -5.546 1.00 0.20 C ATOM 1013 O ASN A 71 6.668 -1.513 -5.699 1.00 0.25 O ATOM 1014 CB ASN A 71 3.517 -0.839 -5.688 1.00 0.32 C ATOM 1015 CG ASN A 71 2.147 -0.635 -6.312 1.00 0.61 C ATOM 1016 OD1 ASN A 71 1.185 -0.307 -5.621 1.00 1.44 O ATOM 1017 ND2 ASN A 71 2.043 -0.845 -7.608 1.00 0.22 N ATOM 1018 H ASN A 71 2.785 -3.200 -6.347 1.00 0.20 H ATOM 1019 HA ASN A 71 4.743 -1.405 -7.355 1.00 0.29 H ATOM 1020 HB2 ASN A 71 3.372 -1.184 -4.677 1.00 0.39 H ATOM 1021 HB3 ASN A 71 4.021 0.117 -5.663 1.00 0.27 H ATOM 1022 HD21 ASN A 71 2.842 -1.122 -8.088 1.00 0.75 H ATOM 1023 HD22 ASN A 71 1.169 -0.722 -8.032 1.00 0.26 H ATOM 1024 N THR A 72 5.444 -3.065 -4.629 1.00 0.18 N ATOM 1025 CA THR A 72 6.369 -3.239 -3.534 1.00 0.19 C ATOM 1026 C THR A 72 7.136 -4.527 -3.653 1.00 0.23 C ATOM 1027 O THR A 72 8.075 -4.755 -2.904 1.00 0.25 O ATOM 1028 CB THR A 72 5.605 -3.220 -2.209 1.00 0.19 C ATOM 1029 OG1 THR A 72 4.667 -4.306 -2.184 1.00 0.21 O ATOM 1030 CG2 THR A 72 4.852 -1.905 -2.060 1.00 0.16 C ATOM 1031 H THR A 72 4.677 -3.668 -4.692 1.00 0.18 H ATOM 1032 HA THR A 72 7.070 -2.421 -3.539 1.00 0.21 H ATOM 1033 HB THR A 72 6.303 -3.329 -1.392 1.00 0.22 H ATOM 1034 HG1 THR A 72 3.880 -4.055 -2.685 1.00 0.21 H ATOM 1035 HG21 THR A 72 4.746 -1.666 -1.014 1.00 0.99 H ATOM 1036 HG22 THR A 72 3.873 -2.009 -2.506 1.00 0.99 H ATOM 1037 HG23 THR A 72 5.393 -1.113 -2.564 1.00 1.01 H ATOM 1038 N GLY A 73 6.711 -5.388 -4.561 1.00 0.27 N ATOM 1039 CA GLY A 73 7.500 -6.556 -4.862 1.00 0.35 C ATOM 1040 C GLY A 73 7.308 -7.658 -3.854 1.00 0.39 C ATOM 1041 O GLY A 73 8.008 -8.672 -3.885 1.00 0.46 O ATOM 1042 H GLY A 73 5.847 -5.247 -5.009 1.00 0.26 H ATOM 1043 HA2 GLY A 73 7.242 -6.920 -5.841 1.00 0.40 H ATOM 1044 HA3 GLY A 73 8.531 -6.264 -4.857 1.00 0.37 H ATOM 1045 N LEU A 74 6.366 -7.460 -2.959 1.00 0.39 N ATOM 1046 CA LEU A 74 6.148 -8.384 -1.878 1.00 0.45 C ATOM 1047 C LEU A 74 5.165 -9.465 -2.261 1.00 0.62 C ATOM 1048 O LEU A 74 4.035 -9.200 -2.668 1.00 1.10 O ATOM 1049 CB LEU A 74 5.672 -7.626 -0.650 1.00 0.46 C ATOM 1050 CG LEU A 74 6.397 -8.006 0.626 1.00 0.53 C ATOM 1051 CD1 LEU A 74 7.853 -7.595 0.511 1.00 1.12 C ATOM 1052 CD2 LEU A 74 5.739 -7.356 1.824 1.00 0.94 C ATOM 1053 H LEU A 74 5.808 -6.662 -3.019 1.00 0.36 H ATOM 1054 HA LEU A 74 7.090 -8.865 -1.656 1.00 0.46 H ATOM 1055 HB2 LEU A 74 5.825 -6.570 -0.826 1.00 0.45 H ATOM 1056 HB3 LEU A 74 4.620 -7.800 -0.516 1.00 0.56 H ATOM 1057 HG LEU A 74 6.358 -9.078 0.755 1.00 0.94 H ATOM 1058 HD11 LEU A 74 7.915 -6.518 0.429 1.00 1.74 H ATOM 1059 HD12 LEU A 74 8.280 -8.044 -0.377 1.00 1.64 H ATOM 1060 HD13 LEU A 74 8.396 -7.925 1.386 1.00 1.61 H ATOM 1061 HD21 LEU A 74 4.681 -7.573 1.818 1.00 1.57 H ATOM 1062 HD22 LEU A 74 5.889 -6.288 1.782 1.00 1.43 H ATOM 1063 HD23 LEU A 74 6.180 -7.746 2.729 1.00 1.53 H ATOM 1064 N ASP A 75 5.619 -10.688 -2.102 1.00 0.54 N ATOM 1065 CA ASP A 75 4.855 -11.858 -2.483 1.00 0.72 C ATOM 1066 C ASP A 75 4.039 -12.361 -1.300 1.00 0.78 C ATOM 1067 O ASP A 75 4.308 -13.420 -0.736 1.00 0.98 O ATOM 1068 CB ASP A 75 5.812 -12.931 -2.966 1.00 1.04 C ATOM 1069 CG ASP A 75 5.106 -14.172 -3.484 1.00 1.31 C ATOM 1070 OD1 ASP A 75 5.099 -15.201 -2.775 1.00 1.45 O ATOM 1071 OD2 ASP A 75 4.552 -14.130 -4.602 1.00 1.55 O ATOM 1072 H ASP A 75 6.510 -10.811 -1.707 1.00 0.71 H ATOM 1073 HA ASP A 75 4.190 -11.586 -3.284 1.00 0.90 H ATOM 1074 HB2 ASP A 75 6.424 -12.521 -3.755 1.00 1.20 H ATOM 1075 HB3 ASP A 75 6.441 -13.210 -2.142 1.00 1.12 H ATOM 1076 N LEU A 76 3.085 -11.557 -0.891 1.00 0.91 N ATOM 1077 CA LEU A 76 2.198 -11.921 0.203 1.00 1.31 C ATOM 1078 C LEU A 76 0.749 -11.999 -0.263 1.00 0.97 C ATOM 1079 O LEU A 76 0.330 -11.257 -1.152 1.00 0.95 O ATOM 1080 CB LEU A 76 2.339 -10.924 1.357 1.00 1.98 C ATOM 1081 CG LEU A 76 3.691 -10.955 2.076 1.00 2.77 C ATOM 1082 CD1 LEU A 76 3.707 -9.962 3.222 1.00 3.54 C ATOM 1083 CD2 LEU A 76 3.998 -12.354 2.589 1.00 3.31 C ATOM 1084 H LEU A 76 3.000 -10.681 -1.316 1.00 0.87 H ATOM 1085 HA LEU A 76 2.497 -12.897 0.552 1.00 1.67 H ATOM 1086 HB2 LEU A 76 2.183 -9.929 0.966 1.00 2.18 H ATOM 1087 HB3 LEU A 76 1.566 -11.133 2.082 1.00 2.29 H ATOM 1088 HG LEU A 76 4.468 -10.674 1.380 1.00 3.11 H ATOM 1089 HD11 LEU A 76 4.673 -9.984 3.704 1.00 3.96 H ATOM 1090 HD12 LEU A 76 2.942 -10.225 3.936 1.00 3.87 H ATOM 1091 HD13 LEU A 76 3.518 -8.969 2.841 1.00 3.94 H ATOM 1092 HD21 LEU A 76 4.087 -13.033 1.754 1.00 3.71 H ATOM 1093 HD22 LEU A 76 3.199 -12.685 3.237 1.00 3.62 H ATOM 1094 HD23 LEU A 76 4.925 -12.339 3.141 1.00 3.63 H ATOM 1095 N PRO A 77 -0.016 -12.930 0.327 1.00 1.11 N ATOM 1096 CA PRO A 77 -1.435 -13.148 -0.001 1.00 1.07 C ATOM 1097 C PRO A 77 -2.349 -12.029 0.520 1.00 0.78 C ATOM 1098 O PRO A 77 -1.859 -11.026 1.041 1.00 0.84 O ATOM 1099 CB PRO A 77 -1.745 -14.469 0.716 1.00 1.63 C ATOM 1100 CG PRO A 77 -0.799 -14.506 1.860 1.00 1.97 C ATOM 1101 CD PRO A 77 0.460 -13.864 1.366 1.00 1.67 C ATOM 1102 HA PRO A 77 -1.583 -13.268 -1.062 1.00 1.11 H ATOM 1103 HB2 PRO A 77 -2.770 -14.466 1.056 1.00 1.72 H ATOM 1104 HB3 PRO A 77 -1.584 -15.295 0.043 1.00 1.92 H ATOM 1105 HG2 PRO A 77 -1.205 -13.947 2.689 1.00 2.26 H ATOM 1106 HG3 PRO A 77 -0.610 -15.528 2.149 1.00 2.42 H ATOM 1107 HD2 PRO A 77 0.951 -13.332 2.167 1.00 1.89 H ATOM 1108 HD3 PRO A 77 1.119 -14.606 0.942 1.00 1.89 H ATOM 1109 N PRO A 78 -3.689 -12.168 0.347 1.00 0.60 N ATOM 1110 CA PRO A 78 -4.690 -11.255 0.938 1.00 0.50 C ATOM 1111 C PRO A 78 -4.566 -11.095 2.460 1.00 0.67 C ATOM 1112 O PRO A 78 -3.508 -11.327 3.041 1.00 1.62 O ATOM 1113 CB PRO A 78 -6.034 -11.922 0.600 1.00 0.60 C ATOM 1114 CG PRO A 78 -5.694 -13.297 0.135 1.00 0.76 C ATOM 1115 CD PRO A 78 -4.343 -13.182 -0.495 1.00 0.75 C ATOM 1116 HA PRO A 78 -4.651 -10.279 0.478 1.00 0.54 H ATOM 1117 HB2 PRO A 78 -6.655 -11.950 1.483 1.00 0.64 H ATOM 1118 HB3 PRO A 78 -6.530 -11.360 -0.172 1.00 0.66 H ATOM 1119 HG2 PRO A 78 -5.661 -13.973 0.976 1.00 0.95 H ATOM 1120 HG3 PRO A 78 -6.420 -13.632 -0.591 1.00 1.20 H ATOM 1121 HD2 PRO A 78 -3.822 -14.126 -0.453 1.00 0.99 H ATOM 1122 HD3 PRO A 78 -4.428 -12.841 -1.515 1.00 1.12 H ATOM 1123 N THR A 79 -5.667 -10.667 3.088 1.00 0.55 N ATOM 1124 CA THR A 79 -5.744 -10.386 4.529 1.00 0.40 C ATOM 1125 C THR A 79 -4.819 -9.242 4.942 1.00 0.33 C ATOM 1126 O THR A 79 -4.656 -8.958 6.127 1.00 0.37 O ATOM 1127 CB THR A 79 -5.515 -11.628 5.434 1.00 0.45 C ATOM 1128 OG1 THR A 79 -4.187 -12.150 5.308 1.00 0.52 O ATOM 1129 CG2 THR A 79 -6.525 -12.719 5.108 1.00 0.53 C ATOM 1130 H THR A 79 -6.485 -10.510 2.571 1.00 1.28 H ATOM 1131 HA THR A 79 -6.756 -10.051 4.709 1.00 0.42 H ATOM 1132 HB THR A 79 -5.672 -11.325 6.459 1.00 0.42 H ATOM 1133 HG1 THR A 79 -3.809 -11.866 4.464 1.00 0.95 H ATOM 1134 HG21 THR A 79 -6.406 -13.021 4.079 1.00 1.16 H ATOM 1135 HG22 THR A 79 -7.525 -12.341 5.260 1.00 0.99 H ATOM 1136 HG23 THR A 79 -6.358 -13.569 5.755 1.00 1.28 H ATOM 1137 N LEU A 80 -4.249 -8.561 3.955 1.00 0.32 N ATOM 1138 CA LEU A 80 -3.414 -7.400 4.215 1.00 0.32 C ATOM 1139 C LEU A 80 -4.268 -6.247 4.710 1.00 0.22 C ATOM 1140 O LEU A 80 -3.879 -5.529 5.623 1.00 0.21 O ATOM 1141 CB LEU A 80 -2.654 -6.984 2.952 1.00 0.43 C ATOM 1142 CG LEU A 80 -1.729 -8.049 2.358 1.00 1.21 C ATOM 1143 CD1 LEU A 80 -1.044 -7.521 1.107 1.00 1.91 C ATOM 1144 CD2 LEU A 80 -0.695 -8.495 3.381 1.00 1.97 C ATOM 1145 H LEU A 80 -4.379 -8.861 3.030 1.00 0.36 H ATOM 1146 HA LEU A 80 -2.706 -7.662 4.987 1.00 0.38 H ATOM 1147 HB2 LEU A 80 -3.378 -6.707 2.199 1.00 1.16 H ATOM 1148 HB3 LEU A 80 -2.059 -6.115 3.188 1.00 1.17 H ATOM 1149 HG LEU A 80 -2.317 -8.911 2.077 1.00 1.98 H ATOM 1150 HD11 LEU A 80 -1.790 -7.252 0.375 1.00 2.46 H ATOM 1151 HD12 LEU A 80 -0.400 -8.286 0.700 1.00 2.33 H ATOM 1152 HD13 LEU A 80 -0.455 -6.652 1.359 1.00 2.39 H ATOM 1153 HD21 LEU A 80 -0.031 -9.218 2.931 1.00 2.26 H ATOM 1154 HD22 LEU A 80 -1.196 -8.944 4.225 1.00 2.53 H ATOM 1155 HD23 LEU A 80 -0.125 -7.640 3.713 1.00 2.52 H ATOM 1156 N ILE A 81 -5.440 -6.089 4.108 1.00 0.18 N ATOM 1157 CA ILE A 81 -6.372 -5.035 4.507 1.00 0.13 C ATOM 1158 C ILE A 81 -6.988 -5.378 5.853 1.00 0.15 C ATOM 1159 O ILE A 81 -7.318 -4.510 6.658 1.00 0.16 O ATOM 1160 CB ILE A 81 -7.495 -4.850 3.461 1.00 0.12 C ATOM 1161 CG1 ILE A 81 -6.910 -4.721 2.071 1.00 0.13 C ATOM 1162 CG2 ILE A 81 -8.307 -3.608 3.739 1.00 0.13 C ATOM 1163 CD1 ILE A 81 -5.787 -3.733 2.000 1.00 0.13 C ATOM 1164 H ILE A 81 -5.678 -6.694 3.371 1.00 0.20 H ATOM 1165 HA ILE A 81 -5.822 -4.110 4.594 1.00 0.13 H ATOM 1166 HB ILE A 81 -8.149 -5.704 3.497 1.00 0.14 H ATOM 1167 HG12 ILE A 81 -6.543 -5.665 1.738 1.00 0.15 H ATOM 1168 HG13 ILE A 81 -7.688 -4.384 1.406 1.00 0.13 H ATOM 1169 HG21 ILE A 81 -7.723 -2.739 3.456 1.00 0.98 H ATOM 1170 HG22 ILE A 81 -8.554 -3.556 4.786 1.00 1.03 H ATOM 1171 HG23 ILE A 81 -9.210 -3.632 3.148 1.00 1.01 H ATOM 1172 HD11 ILE A 81 -5.320 -3.792 1.030 1.00 1.02 H ATOM 1173 HD12 ILE A 81 -5.059 -3.958 2.772 1.00 1.04 H ATOM 1174 HD13 ILE A 81 -6.175 -2.738 2.156 1.00 1.01 H ATOM 1175 N PHE A 82 -7.148 -6.666 6.071 1.00 0.20 N ATOM 1176 CA PHE A 82 -7.680 -7.185 7.311 1.00 0.25 C ATOM 1177 C PHE A 82 -6.717 -6.947 8.472 1.00 0.25 C ATOM 1178 O PHE A 82 -7.143 -6.630 9.581 1.00 0.30 O ATOM 1179 CB PHE A 82 -7.975 -8.672 7.136 1.00 0.32 C ATOM 1180 CG PHE A 82 -9.033 -8.955 6.102 1.00 0.36 C ATOM 1181 CD1 PHE A 82 -10.272 -9.426 6.488 1.00 0.46 C ATOM 1182 CD2 PHE A 82 -8.791 -8.747 4.746 1.00 0.34 C ATOM 1183 CE1 PHE A 82 -11.253 -9.687 5.553 1.00 0.52 C ATOM 1184 CE2 PHE A 82 -9.769 -9.006 3.808 1.00 0.40 C ATOM 1185 CZ PHE A 82 -11.001 -9.477 4.211 1.00 0.49 C ATOM 1186 H PHE A 82 -6.949 -7.293 5.352 1.00 0.21 H ATOM 1187 HA PHE A 82 -8.604 -6.669 7.515 1.00 0.28 H ATOM 1188 HB2 PHE A 82 -7.070 -9.179 6.834 1.00 0.33 H ATOM 1189 HB3 PHE A 82 -8.312 -9.075 8.073 1.00 0.35 H ATOM 1190 HD1 PHE A 82 -10.472 -9.593 7.536 1.00 0.49 H ATOM 1191 HD2 PHE A 82 -7.828 -8.373 4.425 1.00 0.30 H ATOM 1192 HE1 PHE A 82 -12.215 -10.056 5.871 1.00 0.61 H ATOM 1193 HE2 PHE A 82 -9.570 -8.842 2.759 1.00 0.40 H ATOM 1194 HZ PHE A 82 -11.767 -9.681 3.479 1.00 0.55 H ATOM 1195 N ASP A 83 -5.422 -7.086 8.215 1.00 0.23 N ATOM 1196 CA ASP A 83 -4.411 -6.850 9.243 1.00 0.25 C ATOM 1197 C ASP A 83 -4.035 -5.373 9.298 1.00 0.24 C ATOM 1198 O ASP A 83 -3.655 -4.849 10.345 1.00 0.38 O ATOM 1199 CB ASP A 83 -3.163 -7.693 8.970 1.00 0.29 C ATOM 1200 CG ASP A 83 -2.153 -7.633 10.104 1.00 0.34 C ATOM 1201 OD1 ASP A 83 -2.536 -7.871 11.269 1.00 0.48 O ATOM 1202 OD2 ASP A 83 -0.963 -7.367 9.833 1.00 0.47 O ATOM 1203 H ASP A 83 -5.139 -7.370 7.318 1.00 0.23 H ATOM 1204 HA ASP A 83 -4.829 -7.140 10.195 1.00 0.28 H ATOM 1205 HB2 ASP A 83 -3.452 -8.718 8.824 1.00 0.33 H ATOM 1206 HB3 ASP A 83 -2.687 -7.329 8.073 1.00 0.28 H ATOM 1207 N HIS A 84 -4.147 -4.706 8.159 1.00 0.14 N ATOM 1208 CA HIS A 84 -3.812 -3.291 8.050 1.00 0.12 C ATOM 1209 C HIS A 84 -4.941 -2.545 7.360 1.00 0.11 C ATOM 1210 O HIS A 84 -4.973 -2.442 6.136 1.00 0.14 O ATOM 1211 CB HIS A 84 -2.509 -3.111 7.276 1.00 0.14 C ATOM 1212 CG HIS A 84 -1.306 -3.612 8.013 1.00 0.19 C ATOM 1213 ND1 HIS A 84 -0.549 -2.830 8.860 1.00 0.22 N ATOM 1214 CD2 HIS A 84 -0.735 -4.837 8.029 1.00 0.25 C ATOM 1215 CE1 HIS A 84 0.434 -3.553 9.359 1.00 0.27 C ATOM 1216 NE2 HIS A 84 0.344 -4.774 8.872 1.00 0.29 N ATOM 1217 H HIS A 84 -4.488 -5.173 7.359 1.00 0.21 H ATOM 1218 HA HIS A 84 -3.691 -2.899 9.046 1.00 0.13 H ATOM 1219 HB2 HIS A 84 -2.578 -3.654 6.350 1.00 0.16 H ATOM 1220 HB3 HIS A 84 -2.366 -2.064 7.056 1.00 0.14 H ATOM 1221 HD1 HIS A 84 -0.713 -1.884 9.079 1.00 0.24 H ATOM 1222 HD2 HIS A 84 -1.076 -5.709 7.488 1.00 0.30 H ATOM 1223 HE1 HIS A 84 1.185 -3.204 10.052 1.00 0.32 H ATOM 1224 HE2 HIS A 84 0.821 -5.555 9.234 1.00 0.33 H ATOM 1225 N PRO A 85 -5.880 -2.008 8.145 1.00 0.10 N ATOM 1226 CA PRO A 85 -7.136 -1.486 7.624 1.00 0.09 C ATOM 1227 C PRO A 85 -7.097 -0.034 7.150 1.00 0.08 C ATOM 1228 O PRO A 85 -8.136 0.509 6.787 1.00 0.09 O ATOM 1229 CB PRO A 85 -8.062 -1.620 8.827 1.00 0.12 C ATOM 1230 CG PRO A 85 -7.174 -1.373 10.000 1.00 0.14 C ATOM 1231 CD PRO A 85 -5.810 -1.893 9.617 1.00 0.13 C ATOM 1232 HA PRO A 85 -7.507 -2.104 6.820 1.00 0.10 H ATOM 1233 HB2 PRO A 85 -8.851 -0.884 8.763 1.00 0.15 H ATOM 1234 HB3 PRO A 85 -8.485 -2.612 8.854 1.00 0.16 H ATOM 1235 HG2 PRO A 85 -7.123 -0.314 10.206 1.00 0.15 H ATOM 1236 HG3 PRO A 85 -7.548 -1.906 10.862 1.00 0.17 H ATOM 1237 HD2 PRO A 85 -5.044 -1.192 9.912 1.00 0.14 H ATOM 1238 HD3 PRO A 85 -5.635 -2.858 10.069 1.00 0.16 H ATOM 1239 N THR A 86 -5.938 0.613 7.138 1.00 0.07 N ATOM 1240 CA THR A 86 -5.869 1.973 6.625 1.00 0.07 C ATOM 1241 C THR A 86 -4.741 2.099 5.605 1.00 0.07 C ATOM 1242 O THR A 86 -3.795 1.314 5.650 1.00 0.07 O ATOM 1243 CB THR A 86 -5.656 3.005 7.751 1.00 0.08 C ATOM 1244 OG1 THR A 86 -4.407 2.770 8.409 1.00 0.09 O ATOM 1245 CG2 THR A 86 -6.783 2.956 8.774 1.00 0.09 C ATOM 1246 H THR A 86 -5.112 0.186 7.452 1.00 0.07 H ATOM 1247 HA THR A 86 -6.802 2.186 6.140 1.00 0.07 H ATOM 1248 HB THR A 86 -5.642 3.989 7.306 1.00 0.09 H ATOM 1249 HG1 THR A 86 -4.502 2.959 9.353 1.00 0.27 H ATOM 1250 HG21 THR A 86 -6.862 1.956 9.173 1.00 0.96 H ATOM 1251 HG22 THR A 86 -7.713 3.230 8.300 1.00 0.99 H ATOM 1252 HG23 THR A 86 -6.571 3.647 9.576 1.00 1.00 H ATOM 1253 N PRO A 87 -4.821 3.050 4.647 1.00 0.08 N ATOM 1254 CA PRO A 87 -3.729 3.281 3.696 1.00 0.09 C ATOM 1255 C PRO A 87 -2.408 3.533 4.412 1.00 0.09 C ATOM 1256 O PRO A 87 -1.342 3.152 3.927 1.00 0.11 O ATOM 1257 CB PRO A 87 -4.176 4.501 2.894 1.00 0.09 C ATOM 1258 CG PRO A 87 -5.661 4.522 3.033 1.00 0.09 C ATOM 1259 CD PRO A 87 -5.972 3.933 4.385 1.00 0.08 C ATOM 1260 HA PRO A 87 -3.610 2.445 3.033 1.00 0.10 H ATOM 1261 HB2 PRO A 87 -3.722 5.390 3.296 1.00 0.09 H ATOM 1262 HB3 PRO A 87 -3.884 4.380 1.861 1.00 0.11 H ATOM 1263 HG2 PRO A 87 -6.020 5.539 2.978 1.00 0.10 H ATOM 1264 HG3 PRO A 87 -6.109 3.924 2.254 1.00 0.10 H ATOM 1265 HD2 PRO A 87 -6.038 4.711 5.131 1.00 0.08 H ATOM 1266 HD3 PRO A 87 -6.891 3.368 4.343 1.00 0.08 H ATOM 1267 N HIS A 88 -2.499 4.158 5.581 1.00 0.09 N ATOM 1268 CA HIS A 88 -1.349 4.323 6.456 1.00 0.09 C ATOM 1269 C HIS A 88 -0.855 2.956 6.917 1.00 0.08 C ATOM 1270 O HIS A 88 0.321 2.636 6.784 1.00 0.09 O ATOM 1271 CB HIS A 88 -1.735 5.186 7.661 1.00 0.12 C ATOM 1272 CG HIS A 88 -0.602 5.504 8.590 1.00 0.19 C ATOM 1273 ND1 HIS A 88 0.523 6.207 8.211 1.00 0.28 N ATOM 1274 CD2 HIS A 88 -0.435 5.216 9.902 1.00 0.23 C ATOM 1275 CE1 HIS A 88 1.326 6.339 9.248 1.00 0.33 C ATOM 1276 NE2 HIS A 88 0.769 5.748 10.288 1.00 0.30 N ATOM 1277 H HIS A 88 -3.371 4.516 5.859 1.00 0.09 H ATOM 1278 HA HIS A 88 -0.563 4.813 5.900 1.00 0.11 H ATOM 1279 HB2 HIS A 88 -2.143 6.118 7.310 1.00 0.13 H ATOM 1280 HB3 HIS A 88 -2.491 4.665 8.230 1.00 0.12 H ATOM 1281 HD1 HIS A 88 0.710 6.557 7.310 1.00 0.34 H ATOM 1282 HD2 HIS A 88 -1.127 4.669 10.528 1.00 0.27 H ATOM 1283 HE1 HIS A 88 2.278 6.849 9.247 1.00 0.42 H ATOM 1284 HE2 HIS A 88 1.050 5.882 11.222 1.00 0.36 H ATOM 1285 N ALA A 89 -1.778 2.153 7.437 1.00 0.09 N ATOM 1286 CA ALA A 89 -1.473 0.812 7.926 1.00 0.10 C ATOM 1287 C ALA A 89 -0.835 -0.065 6.855 1.00 0.09 C ATOM 1288 O ALA A 89 0.233 -0.632 7.075 1.00 0.10 O ATOM 1289 CB ALA A 89 -2.733 0.149 8.441 1.00 0.12 C ATOM 1290 H ALA A 89 -2.704 2.479 7.511 1.00 0.09 H ATOM 1291 HA ALA A 89 -0.784 0.904 8.751 1.00 0.10 H ATOM 1292 HB1 ALA A 89 -3.451 0.073 7.633 1.00 1.03 H ATOM 1293 HB2 ALA A 89 -3.151 0.740 9.243 1.00 1.03 H ATOM 1294 HB3 ALA A 89 -2.494 -0.841 8.802 1.00 1.03 H ATOM 1295 N LEU A 90 -1.508 -0.216 5.717 1.00 0.10 N ATOM 1296 CA LEU A 90 -0.977 -1.001 4.605 1.00 0.11 C ATOM 1297 C LEU A 90 0.415 -0.554 4.253 1.00 0.11 C ATOM 1298 O LEU A 90 1.307 -1.369 4.007 1.00 0.12 O ATOM 1299 CB LEU A 90 -1.847 -0.828 3.375 1.00 0.13 C ATOM 1300 CG LEU A 90 -2.209 -2.107 2.640 1.00 0.25 C ATOM 1301 CD1 LEU A 90 -2.823 -3.119 3.586 1.00 0.73 C ATOM 1302 CD2 LEU A 90 -3.172 -1.793 1.518 1.00 0.68 C ATOM 1303 H LEU A 90 -2.410 0.170 5.620 1.00 0.10 H ATOM 1304 HA LEU A 90 -0.959 -2.038 4.894 1.00 0.12 H ATOM 1305 HB2 LEU A 90 -2.747 -0.326 3.665 1.00 0.27 H ATOM 1306 HB3 LEU A 90 -1.318 -0.194 2.687 1.00 0.25 H ATOM 1307 HG LEU A 90 -1.319 -2.539 2.210 1.00 0.83 H ATOM 1308 HD11 LEU A 90 -3.707 -2.695 4.041 1.00 1.27 H ATOM 1309 HD12 LEU A 90 -2.110 -3.375 4.352 1.00 1.34 H ATOM 1310 HD13 LEU A 90 -3.093 -4.006 3.036 1.00 1.41 H ATOM 1311 HD21 LEU A 90 -3.454 -2.708 1.021 1.00 1.37 H ATOM 1312 HD22 LEU A 90 -2.699 -1.128 0.809 1.00 1.25 H ATOM 1313 HD23 LEU A 90 -4.055 -1.319 1.924 1.00 1.32 H ATOM 1314 N THR A 91 0.580 0.749 4.217 1.00 0.11 N ATOM 1315 CA THR A 91 1.854 1.335 3.928 1.00 0.12 C ATOM 1316 C THR A 91 2.889 0.885 4.953 1.00 0.12 C ATOM 1317 O THR A 91 3.982 0.452 4.598 1.00 0.13 O ATOM 1318 CB THR A 91 1.752 2.874 3.923 1.00 0.12 C ATOM 1319 OG1 THR A 91 1.113 3.323 2.724 1.00 0.13 O ATOM 1320 CG2 THR A 91 3.113 3.526 4.074 1.00 0.13 C ATOM 1321 H THR A 91 -0.188 1.336 4.385 1.00 0.11 H ATOM 1322 HA THR A 91 2.140 0.989 2.945 1.00 0.14 H ATOM 1323 HB THR A 91 1.141 3.170 4.765 1.00 0.10 H ATOM 1324 HG1 THR A 91 0.158 3.327 2.856 1.00 0.13 H ATOM 1325 HG21 THR A 91 3.047 4.569 3.799 1.00 1.01 H ATOM 1326 HG22 THR A 91 3.825 3.025 3.438 1.00 1.00 H ATOM 1327 HG23 THR A 91 3.433 3.446 5.102 1.00 1.03 H ATOM 1328 N GLN A 92 2.509 0.965 6.222 1.00 0.11 N ATOM 1329 CA GLN A 92 3.365 0.555 7.325 1.00 0.12 C ATOM 1330 C GLN A 92 3.811 -0.896 7.158 1.00 0.13 C ATOM 1331 O GLN A 92 4.929 -1.260 7.517 1.00 0.16 O ATOM 1332 CB GLN A 92 2.622 0.743 8.649 1.00 0.12 C ATOM 1333 CG GLN A 92 2.286 2.192 8.950 1.00 0.16 C ATOM 1334 CD GLN A 92 2.074 2.453 10.425 1.00 0.47 C ATOM 1335 OE1 GLN A 92 3.007 2.826 11.138 1.00 1.42 O ATOM 1336 NE2 GLN A 92 0.857 2.245 10.898 1.00 1.06 N ATOM 1337 H GLN A 92 1.614 1.319 6.425 1.00 0.12 H ATOM 1338 HA GLN A 92 4.235 1.189 7.320 1.00 0.13 H ATOM 1339 HB2 GLN A 92 1.694 0.187 8.603 1.00 0.14 H ATOM 1340 HB3 GLN A 92 3.219 0.357 9.452 1.00 0.13 H ATOM 1341 HG2 GLN A 92 3.095 2.817 8.601 1.00 0.29 H ATOM 1342 HG3 GLN A 92 1.380 2.453 8.421 1.00 0.26 H ATOM 1343 HE21 GLN A 92 0.164 1.931 10.278 1.00 1.80 H ATOM 1344 HE22 GLN A 92 0.694 2.410 11.852 1.00 1.13 H ATOM 1345 N HIS A 93 2.934 -1.706 6.585 1.00 0.14 N ATOM 1346 CA HIS A 93 3.234 -3.104 6.306 1.00 0.17 C ATOM 1347 C HIS A 93 4.389 -3.234 5.313 1.00 0.19 C ATOM 1348 O HIS A 93 5.394 -3.876 5.604 1.00 0.21 O ATOM 1349 CB HIS A 93 1.972 -3.801 5.774 1.00 0.20 C ATOM 1350 CG HIS A 93 2.194 -5.174 5.216 1.00 0.27 C ATOM 1351 ND1 HIS A 93 2.493 -6.269 5.991 1.00 0.31 N ATOM 1352 CD2 HIS A 93 2.136 -5.625 3.939 1.00 0.36 C ATOM 1353 CE1 HIS A 93 2.606 -7.333 5.222 1.00 0.38 C ATOM 1354 NE2 HIS A 93 2.394 -6.971 3.970 1.00 0.41 N ATOM 1355 H HIS A 93 2.052 -1.349 6.342 1.00 0.16 H ATOM 1356 HA HIS A 93 3.526 -3.568 7.235 1.00 0.18 H ATOM 1357 HB2 HIS A 93 1.259 -3.889 6.579 1.00 0.20 H ATOM 1358 HB3 HIS A 93 1.542 -3.191 4.992 1.00 0.23 H ATOM 1359 HD1 HIS A 93 2.608 -6.272 6.973 1.00 0.32 H ATOM 1360 HD2 HIS A 93 1.929 -5.030 3.055 1.00 0.42 H ATOM 1361 HE1 HIS A 93 2.834 -8.333 5.558 1.00 0.44 H ATOM 1362 HE2 HIS A 93 2.223 -7.595 3.233 1.00 0.59 H ATOM 1363 N LEU A 94 4.255 -2.609 4.151 1.00 0.18 N ATOM 1364 CA LEU A 94 5.266 -2.721 3.106 1.00 0.21 C ATOM 1365 C LEU A 94 6.496 -1.884 3.441 1.00 0.22 C ATOM 1366 O LEU A 94 7.599 -2.211 3.023 1.00 0.31 O ATOM 1367 CB LEU A 94 4.652 -2.297 1.772 1.00 0.19 C ATOM 1368 CG LEU A 94 3.418 -3.112 1.371 1.00 0.21 C ATOM 1369 CD1 LEU A 94 2.605 -2.408 0.310 1.00 0.21 C ATOM 1370 CD2 LEU A 94 3.824 -4.492 0.870 1.00 0.27 C ATOM 1371 H LEU A 94 3.463 -2.043 3.989 1.00 0.18 H ATOM 1372 HA LEU A 94 5.573 -3.759 3.041 1.00 0.25 H ATOM 1373 HB2 LEU A 94 4.373 -1.255 1.840 1.00 0.17 H ATOM 1374 HB3 LEU A 94 5.399 -2.405 1.003 1.00 0.21 H ATOM 1375 HG LEU A 94 2.786 -3.234 2.240 1.00 0.22 H ATOM 1376 HD11 LEU A 94 1.614 -2.838 0.283 1.00 1.07 H ATOM 1377 HD12 LEU A 94 3.077 -2.543 -0.658 1.00 1.01 H ATOM 1378 HD13 LEU A 94 2.540 -1.356 0.548 1.00 1.03 H ATOM 1379 HD21 LEU A 94 4.406 -4.392 -0.043 1.00 1.09 H ATOM 1380 HD22 LEU A 94 2.940 -5.078 0.666 1.00 1.02 H ATOM 1381 HD23 LEU A 94 4.418 -4.989 1.621 1.00 1.04 H ATOM 1382 N HIS A 95 6.307 -0.854 4.255 1.00 0.18 N ATOM 1383 CA HIS A 95 7.398 0.038 4.653 1.00 0.20 C ATOM 1384 C HIS A 95 8.298 -0.678 5.649 1.00 0.26 C ATOM 1385 O HIS A 95 9.500 -0.419 5.718 1.00 0.39 O ATOM 1386 CB HIS A 95 6.827 1.318 5.281 1.00 0.20 C ATOM 1387 CG HIS A 95 7.853 2.348 5.657 1.00 0.25 C ATOM 1388 ND1 HIS A 95 8.476 2.377 6.884 1.00 0.37 N ATOM 1389 CD2 HIS A 95 8.340 3.409 4.969 1.00 0.26 C ATOM 1390 CE1 HIS A 95 9.297 3.406 6.936 1.00 0.43 C ATOM 1391 NE2 HIS A 95 9.235 4.054 5.788 1.00 0.36 N ATOM 1392 H HIS A 95 5.420 -0.716 4.654 1.00 0.16 H ATOM 1393 HA HIS A 95 7.976 0.293 3.773 1.00 0.23 H ATOM 1394 HB2 HIS A 95 6.148 1.778 4.579 1.00 0.19 H ATOM 1395 HB3 HIS A 95 6.281 1.054 6.174 1.00 0.24 H ATOM 1396 HD1 HIS A 95 8.331 1.737 7.619 1.00 0.42 H ATOM 1397 HD2 HIS A 95 8.073 3.700 3.959 1.00 0.24 H ATOM 1398 HE1 HIS A 95 9.921 3.673 7.775 1.00 0.53 H ATOM 1399 HE2 HIS A 95 9.521 4.986 5.671 1.00 0.54 H ATOM 1400 N THR A 96 7.711 -1.600 6.398 1.00 0.22 N ATOM 1401 CA THR A 96 8.437 -2.377 7.372 1.00 0.27 C ATOM 1402 C THR A 96 9.036 -3.609 6.700 1.00 0.32 C ATOM 1403 O THR A 96 10.134 -4.050 7.034 1.00 0.40 O ATOM 1404 CB THR A 96 7.487 -2.776 8.530 1.00 0.35 C ATOM 1405 OG1 THR A 96 7.724 -1.948 9.677 1.00 0.62 O ATOM 1406 CG2 THR A 96 7.621 -4.243 8.903 1.00 0.31 C ATOM 1407 H THR A 96 6.759 -1.797 6.274 1.00 0.24 H ATOM 1408 HA THR A 96 9.233 -1.765 7.772 1.00 0.36 H ATOM 1409 HB THR A 96 6.472 -2.607 8.196 1.00 0.49 H ATOM 1410 HG1 THR A 96 7.220 -2.292 10.427 1.00 1.27 H ATOM 1411 HG21 THR A 96 7.384 -4.845 8.036 1.00 1.05 H ATOM 1412 HG22 THR A 96 6.936 -4.476 9.703 1.00 1.08 H ATOM 1413 HG23 THR A 96 8.633 -4.447 9.218 1.00 1.00 H ATOM 1414 N ARG A 97 8.313 -4.148 5.729 1.00 0.34 N ATOM 1415 CA ARG A 97 8.761 -5.332 5.015 1.00 0.45 C ATOM 1416 C ARG A 97 9.935 -5.038 4.102 1.00 0.57 C ATOM 1417 O ARG A 97 10.637 -5.950 3.684 1.00 0.67 O ATOM 1418 CB ARG A 97 7.613 -5.942 4.229 1.00 0.58 C ATOM 1419 CG ARG A 97 6.665 -6.725 5.109 1.00 1.52 C ATOM 1420 CD ARG A 97 7.332 -7.983 5.638 1.00 2.27 C ATOM 1421 NE ARG A 97 6.427 -8.827 6.412 1.00 3.09 N ATOM 1422 CZ ARG A 97 6.827 -9.858 7.156 1.00 3.77 C ATOM 1423 NH1 ARG A 97 8.118 -10.151 7.254 1.00 3.78 N ATOM 1424 NH2 ARG A 97 5.934 -10.589 7.807 1.00 4.68 N ATOM 1425 H ARG A 97 7.441 -3.758 5.503 1.00 0.32 H ATOM 1426 HA ARG A 97 9.083 -6.043 5.756 1.00 0.43 H ATOM 1427 HB2 ARG A 97 7.059 -5.152 3.744 1.00 0.92 H ATOM 1428 HB3 ARG A 97 8.009 -6.607 3.478 1.00 0.76 H ATOM 1429 HG2 ARG A 97 6.389 -6.100 5.939 1.00 1.69 H ATOM 1430 HG3 ARG A 97 5.787 -6.996 4.542 1.00 1.86 H ATOM 1431 HD2 ARG A 97 7.700 -8.549 4.801 1.00 2.47 H ATOM 1432 HD3 ARG A 97 8.162 -7.696 6.266 1.00 2.48 H ATOM 1433 HE ARG A 97 5.466 -8.618 6.373 1.00 3.36 H ATOM 1434 HH11 ARG A 97 8.802 -9.596 6.769 1.00 3.41 H ATOM 1435 HH12 ARG A 97 8.419 -10.926 7.819 1.00 4.35 H ATOM 1436 HH21 ARG A 97 4.956 -10.369 7.739 1.00 4.96 H ATOM 1437 HH22 ARG A 97 6.230 -11.363 8.370 1.00 5.19 H ATOM 1438 N LEU A 98 10.134 -3.771 3.782 1.00 0.62 N ATOM 1439 CA LEU A 98 11.319 -3.364 3.023 1.00 0.78 C ATOM 1440 C LEU A 98 12.596 -3.877 3.678 1.00 0.92 C ATOM 1441 O LEU A 98 13.566 -4.218 2.998 1.00 1.19 O ATOM 1442 CB LEU A 98 11.402 -1.848 2.871 1.00 0.78 C ATOM 1443 CG LEU A 98 10.950 -1.297 1.514 1.00 0.68 C ATOM 1444 CD1 LEU A 98 10.867 -2.393 0.459 1.00 1.14 C ATOM 1445 CD2 LEU A 98 9.622 -0.602 1.645 1.00 1.00 C ATOM 1446 H LEU A 98 9.448 -3.110 4.016 1.00 0.61 H ATOM 1447 HA LEU A 98 11.235 -3.802 2.046 1.00 0.89 H ATOM 1448 HB2 LEU A 98 10.795 -1.404 3.641 1.00 1.00 H ATOM 1449 HB3 LEU A 98 12.420 -1.545 3.032 1.00 0.89 H ATOM 1450 HG LEU A 98 11.672 -0.569 1.175 1.00 1.13 H ATOM 1451 HD11 LEU A 98 10.657 -1.949 -0.503 1.00 1.73 H ATOM 1452 HD12 LEU A 98 10.070 -3.079 0.718 1.00 1.70 H ATOM 1453 HD13 LEU A 98 11.806 -2.925 0.414 1.00 1.50 H ATOM 1454 HD21 LEU A 98 8.879 -1.312 1.972 1.00 1.44 H ATOM 1455 HD22 LEU A 98 9.340 -0.193 0.686 1.00 1.56 H ATOM 1456 HD23 LEU A 98 9.705 0.194 2.368 1.00 1.66 H ATOM 1457 N THR A 99 12.590 -3.919 4.999 1.00 0.85 N ATOM 1458 CA THR A 99 13.706 -4.414 5.755 1.00 1.08 C ATOM 1459 C THR A 99 13.477 -5.866 6.161 1.00 1.13 C ATOM 1460 O THR A 99 14.297 -6.747 5.903 1.00 1.66 O ATOM 1461 CB THR A 99 13.882 -3.550 7.010 1.00 1.19 C ATOM 1462 OG1 THR A 99 12.675 -3.536 7.779 1.00 1.61 O ATOM 1463 CG2 THR A 99 14.235 -2.127 6.631 1.00 1.07 C ATOM 1464 H THR A 99 11.811 -3.593 5.489 1.00 0.74 H ATOM 1465 HA THR A 99 14.596 -4.339 5.151 1.00 1.25 H ATOM 1466 HB THR A 99 14.664 -3.962 7.604 1.00 1.39 H ATOM 1467 HG1 THR A 99 12.793 -2.964 8.547 1.00 1.79 H ATOM 1468 HG21 THR A 99 13.452 -1.720 6.001 1.00 1.39 H ATOM 1469 HG22 THR A 99 15.172 -2.119 6.096 1.00 1.56 H ATOM 1470 HG23 THR A 99 14.323 -1.532 7.527 1.00 1.45 H ATOM 1471 N GLN A 100 12.343 -6.090 6.800 1.00 0.75 N ATOM 1472 CA GLN A 100 11.996 -7.386 7.356 1.00 0.85 C ATOM 1473 C GLN A 100 11.401 -8.317 6.303 1.00 1.01 C ATOM 1474 O GLN A 100 10.194 -8.555 6.285 1.00 1.19 O ATOM 1475 CB GLN A 100 11.004 -7.167 8.488 1.00 0.77 C ATOM 1476 CG GLN A 100 11.425 -6.069 9.434 1.00 0.81 C ATOM 1477 CD GLN A 100 12.594 -6.459 10.318 1.00 1.52 C ATOM 1478 OE1 GLN A 100 12.410 -6.990 11.414 1.00 2.10 O ATOM 1479 NE2 GLN A 100 13.804 -6.191 9.855 1.00 2.19 N ATOM 1480 H GLN A 100 11.731 -5.333 6.942 1.00 0.67 H ATOM 1481 HA GLN A 100 12.889 -7.830 7.757 1.00 0.97 H ATOM 1482 HB2 GLN A 100 10.046 -6.913 8.071 1.00 1.04 H ATOM 1483 HB3 GLN A 100 10.917 -8.062 9.049 1.00 1.03 H ATOM 1484 HG2 GLN A 100 11.717 -5.236 8.837 1.00 0.94 H ATOM 1485 HG3 GLN A 100 10.591 -5.795 10.054 1.00 0.98 H ATOM 1486 HE21 GLN A 100 13.879 -5.761 8.977 1.00 2.50 H ATOM 1487 HE22 GLN A 100 14.577 -6.431 10.409 1.00 2.66 H ATOM 1488 N SER A 101 12.248 -8.845 5.432 1.00 1.26 N ATOM 1489 CA SER A 101 11.803 -9.773 4.404 1.00 1.48 C ATOM 1490 C SER A 101 12.976 -10.584 3.864 1.00 1.84 C ATOM 1491 O SER A 101 14.099 -10.462 4.353 1.00 2.05 O ATOM 1492 CB SER A 101 11.118 -9.009 3.273 1.00 1.64 C ATOM 1493 OG SER A 101 11.962 -7.992 2.761 1.00 2.32 O ATOM 1494 H SER A 101 13.197 -8.603 5.478 1.00 1.44 H ATOM 1495 HA SER A 101 11.090 -10.448 4.853 1.00 1.52 H ATOM 1496 HB2 SER A 101 10.872 -9.693 2.475 1.00 2.00 H ATOM 1497 HB3 SER A 101 10.215 -8.554 3.653 1.00 1.72 H ATOM 1498 HG SER A 101 11.581 -7.127 2.978 1.00 2.64 H ATOM 1499 N HIS A 102 12.716 -11.402 2.852 1.00 2.10 N ATOM 1500 CA HIS A 102 13.750 -12.248 2.269 1.00 2.55 C ATOM 1501 C HIS A 102 13.826 -12.042 0.761 1.00 2.90 C ATOM 1502 O HIS A 102 14.821 -11.458 0.292 1.00 3.23 O ATOM 1503 CB HIS A 102 13.533 -13.733 2.606 1.00 2.94 C ATOM 1504 CG HIS A 102 12.179 -14.260 2.250 1.00 3.11 C ATOM 1505 ND1 HIS A 102 11.974 -15.330 1.407 1.00 3.76 N ATOM 1506 CD2 HIS A 102 10.956 -13.863 2.654 1.00 3.06 C ATOM 1507 CE1 HIS A 102 10.679 -15.567 1.310 1.00 4.18 C ATOM 1508 NE2 HIS A 102 10.038 -14.689 2.060 1.00 3.79 N ATOM 1509 OXT HIS A 102 12.875 -12.432 0.053 1.00 3.31 O ATOM 1510 H HIS A 102 11.813 -11.421 2.472 1.00 2.08 H ATOM 1511 HA HIS A 102 14.682 -11.937 2.699 1.00 2.65 H ATOM 1512 HB2 HIS A 102 14.261 -14.321 2.078 1.00 3.36 H ATOM 1513 HB3 HIS A 102 13.677 -13.875 3.662 1.00 3.21 H ATOM 1514 HD1 HIS A 102 12.676 -15.842 0.945 1.00 4.00 H ATOM 1515 HD2 HIS A 102 10.749 -13.031 3.311 1.00 2.70 H ATOM 1516 HE1 HIS A 102 10.221 -16.346 0.721 1.00 4.86 H ATOM 1517 HE2 HIS A 102 9.082 -14.737 2.291 1.00 4.07 H TER 1518 HIS A 102