ATOM 1 N THR A 1 4.175 2.617 9.514 1.00 0.00 N ATOM 2 CA THR A 1 3.432 3.619 8.798 1.00 0.00 C ATOM 3 C THR A 1 3.858 3.616 7.322 1.00 0.00 C ATOM 4 O THR A 1 4.994 3.998 6.983 1.00 0.00 O ATOM 5 CB THR A 1 3.675 4.990 9.442 1.00 0.00 C ATOM 6 OG1 THR A 1 3.531 4.858 10.875 1.00 0.00 O ATOM 7 CG2 THR A 1 2.652 5.993 8.946 1.00 0.00 C ATOM 8 H1 THR A 1 5.199 2.726 9.365 1.00 0.00 H ATOM 9 H2 THR A 1 3.874 1.661 9.247 1.00 0.00 H ATOM 10 H3 THR A 1 3.986 2.759 10.526 1.00 0.00 H ATOM 11 HA THR A 1 2.380 3.379 8.857 1.00 0.00 H ATOM 12 HB THR A 1 4.669 5.335 9.198 1.00 0.00 H ATOM 13 HG1 THR A 1 2.706 5.284 11.148 1.00 0.00 H ATOM 14 HG21 THR A 1 1.658 5.653 9.202 1.00 0.00 H ATOM 15 HG22 THR A 1 2.734 6.081 7.873 1.00 0.00 H ATOM 16 HG23 THR A 1 2.834 6.954 9.403 1.00 0.00 H ATOM 17 N GLN A 2 2.955 3.182 6.459 1.00 0.00 N ATOM 18 CA GLN A 2 3.220 3.031 5.043 1.00 0.00 C ATOM 19 C GLN A 2 3.400 4.398 4.387 1.00 0.00 C ATOM 20 O GLN A 2 2.557 5.284 4.527 1.00 0.00 O ATOM 21 CB GLN A 2 2.080 2.243 4.381 1.00 0.00 C ATOM 22 CG GLN A 2 2.299 1.945 2.908 1.00 0.00 C ATOM 23 CD GLN A 2 3.547 1.137 2.662 1.00 0.00 C ATOM 24 OE1 GLN A 2 4.625 1.684 2.460 1.00 0.00 O ATOM 25 NE2 GLN A 2 3.415 -0.148 2.669 1.00 0.00 N ATOM 26 H GLN A 2 2.042 2.995 6.778 1.00 0.00 H ATOM 27 HA GLN A 2 4.139 2.473 4.933 1.00 0.00 H ATOM 28 HB2 GLN A 2 1.964 1.301 4.895 1.00 0.00 H ATOM 29 HB3 GLN A 2 1.165 2.807 4.480 1.00 0.00 H ATOM 30 HG2 GLN A 2 1.453 1.387 2.536 1.00 0.00 H ATOM 31 HG3 GLN A 2 2.379 2.879 2.373 1.00 0.00 H ATOM 32 HE21 GLN A 2 2.513 -0.511 2.832 1.00 0.00 H ATOM 33 HE22 GLN A 2 4.186 -0.729 2.504 1.00 0.00 H ATOM 34 N SER A 3 4.510 4.562 3.707 1.00 0.00 N ATOM 35 CA SER A 3 4.848 5.807 3.083 1.00 0.00 C ATOM 36 C SER A 3 4.041 6.057 1.808 1.00 0.00 C ATOM 37 O SER A 3 3.331 5.163 1.303 1.00 0.00 O ATOM 38 CB SER A 3 6.368 5.893 2.808 1.00 0.00 C ATOM 39 OG SER A 3 6.851 5.020 1.731 1.00 0.00 O ATOM 40 H SER A 3 5.143 3.824 3.631 1.00 0.00 H ATOM 41 HA SER A 3 4.595 6.583 3.790 1.00 0.00 H ATOM 42 HB2 SER A 3 6.594 6.903 2.521 1.00 0.00 H ATOM 43 HB3 SER A 3 6.910 5.658 3.712 1.00 0.00 H ATOM 44 N HIS A 4 4.160 7.266 1.289 1.00 0.00 N ATOM 45 CA HIS A 4 3.476 7.680 0.081 1.00 0.00 C ATOM 46 C HIS A 4 3.927 6.785 -1.084 1.00 0.00 C ATOM 47 O HIS A 4 5.120 6.524 -1.242 1.00 0.00 O ATOM 48 CB HIS A 4 3.795 9.167 -0.196 1.00 0.00 C ATOM 49 CG HIS A 4 2.911 9.846 -1.214 1.00 0.00 C ATOM 50 ND1 HIS A 4 3.236 11.035 -1.809 1.00 0.00 N ATOM 51 CD2 HIS A 4 1.678 9.532 -1.680 1.00 0.00 C ATOM 52 CE1 HIS A 4 2.254 11.421 -2.587 1.00 0.00 C ATOM 53 NE2 HIS A 4 1.300 10.528 -2.529 1.00 0.00 N ATOM 54 H HIS A 4 4.744 7.908 1.748 1.00 0.00 H ATOM 55 HA HIS A 4 2.414 7.562 0.235 1.00 0.00 H ATOM 56 HB2 HIS A 4 3.712 9.720 0.726 1.00 0.00 H ATOM 57 HB3 HIS A 4 4.814 9.232 -0.545 1.00 0.00 H ATOM 58 HD1 HIS A 4 4.062 11.556 -1.669 1.00 0.00 H ATOM 59 HD2 HIS A 4 1.102 8.655 -1.415 1.00 0.00 H ATOM 60 HE1 HIS A 4 2.215 12.330 -3.166 1.00 0.00 H ATOM 61 HE2 HIS A 4 0.372 10.775 -2.746 1.00 0.00 H ATOM 62 N TYR A 5 2.947 6.287 -1.846 1.00 0.00 N ATOM 63 CA TYR A 5 3.138 5.372 -2.987 1.00 0.00 C ATOM 64 C TYR A 5 3.365 3.926 -2.562 1.00 0.00 C ATOM 65 O TYR A 5 3.501 3.043 -3.406 1.00 0.00 O ATOM 66 CB TYR A 5 4.207 5.832 -4.005 1.00 0.00 C ATOM 67 CG TYR A 5 3.834 7.073 -4.781 1.00 0.00 C ATOM 68 CD1 TYR A 5 4.264 8.323 -4.379 1.00 0.00 C ATOM 69 CD2 TYR A 5 3.046 6.989 -5.921 1.00 0.00 C ATOM 70 CE1 TYR A 5 3.923 9.453 -5.085 1.00 0.00 C ATOM 71 CE2 TYR A 5 2.702 8.118 -6.635 1.00 0.00 C ATOM 72 CZ TYR A 5 3.143 9.348 -6.211 1.00 0.00 C ATOM 73 OH TYR A 5 2.797 10.485 -6.911 1.00 0.00 O ATOM 74 H TYR A 5 2.014 6.519 -1.636 1.00 0.00 H ATOM 75 HA TYR A 5 2.178 5.376 -3.484 1.00 0.00 H ATOM 76 HB2 TYR A 5 5.125 6.038 -3.477 1.00 0.00 H ATOM 77 HB3 TYR A 5 4.382 5.032 -4.709 1.00 0.00 H ATOM 78 HD1 TYR A 5 4.877 8.406 -3.494 1.00 0.00 H ATOM 79 HD2 TYR A 5 2.700 6.020 -6.250 1.00 0.00 H ATOM 80 HE1 TYR A 5 4.271 10.418 -4.752 1.00 0.00 H ATOM 81 HE2 TYR A 5 2.087 8.031 -7.519 1.00 0.00 H ATOM 82 HH TYR A 5 3.613 10.990 -7.036 1.00 0.00 H ATOM 83 N GLY A 6 3.363 3.672 -1.275 1.00 0.00 N ATOM 84 CA GLY A 6 3.541 2.326 -0.807 1.00 0.00 C ATOM 85 C GLY A 6 2.249 1.540 -0.862 1.00 0.00 C ATOM 86 O GLY A 6 1.157 2.132 -0.796 1.00 0.00 O ATOM 87 H GLY A 6 3.244 4.388 -0.616 1.00 0.00 H ATOM 88 HA2 GLY A 6 4.283 1.839 -1.420 1.00 0.00 H ATOM 89 HA3 GLY A 6 3.890 2.353 0.215 1.00 0.00 H ATOM 90 N GLN A 7 2.360 0.230 -1.035 1.00 0.00 N ATOM 91 CA GLN A 7 1.217 -0.654 -1.029 1.00 0.00 C ATOM 92 C GLN A 7 0.611 -0.706 0.379 1.00 0.00 C ATOM 93 O GLN A 7 1.202 -1.242 1.298 1.00 0.00 O ATOM 94 CB GLN A 7 1.612 -2.051 -1.541 1.00 0.00 C ATOM 95 CG GLN A 7 0.482 -3.075 -1.541 1.00 0.00 C ATOM 96 CD GLN A 7 0.929 -4.434 -2.068 1.00 0.00 C ATOM 97 OE1 GLN A 7 2.098 -4.805 -1.962 1.00 0.00 O ATOM 98 NE2 GLN A 7 0.012 -5.197 -2.598 1.00 0.00 N ATOM 99 H GLN A 7 3.249 -0.153 -1.190 1.00 0.00 H ATOM 100 HA GLN A 7 0.483 -0.225 -1.695 1.00 0.00 H ATOM 101 HB2 GLN A 7 1.966 -1.952 -2.557 1.00 0.00 H ATOM 102 HB3 GLN A 7 2.417 -2.429 -0.926 1.00 0.00 H ATOM 103 HG2 GLN A 7 0.108 -3.171 -0.532 1.00 0.00 H ATOM 104 HG3 GLN A 7 -0.312 -2.704 -2.175 1.00 0.00 H ATOM 105 HE21 GLN A 7 -0.922 -4.907 -2.656 1.00 0.00 H ATOM 106 HE22 GLN A 7 0.283 -6.082 -2.929 1.00 0.00 H ATOM 107 N CYS A 8 -0.570 -0.160 0.517 1.00 0.00 N ATOM 108 CA CYS A 8 -1.210 0.023 1.828 1.00 0.00 C ATOM 109 C CYS A 8 -2.057 -1.147 2.274 1.00 0.00 C ATOM 110 O CYS A 8 -2.738 -1.069 3.279 1.00 0.00 O ATOM 111 CB CYS A 8 -2.055 1.272 1.816 1.00 0.00 C ATOM 112 SG CYS A 8 -3.248 1.343 0.442 1.00 0.00 S ATOM 113 H CYS A 8 -1.032 0.148 -0.291 1.00 0.00 H ATOM 114 HA CYS A 8 -0.425 0.170 2.555 1.00 0.00 H ATOM 115 HB2 CYS A 8 -2.612 1.325 2.740 1.00 0.00 H ATOM 116 HB3 CYS A 8 -1.410 2.134 1.745 1.00 0.00 H ATOM 117 N GLY A 9 -2.039 -2.216 1.551 1.00 0.00 N ATOM 118 CA GLY A 9 -2.804 -3.333 2.005 1.00 0.00 C ATOM 119 C GLY A 9 -3.765 -3.834 1.001 1.00 0.00 C ATOM 120 O GLY A 9 -4.969 -3.598 1.100 1.00 0.00 O ATOM 121 H GLY A 9 -1.513 -2.224 0.728 1.00 0.00 H ATOM 122 HA2 GLY A 9 -2.142 -4.142 2.267 1.00 0.00 H ATOM 123 HA3 GLY A 9 -3.353 -3.034 2.886 1.00 0.00 H ATOM 124 N GLY A 10 -3.237 -4.468 0.015 1.00 0.00 N ATOM 125 CA GLY A 10 -4.040 -5.159 -0.928 1.00 0.00 C ATOM 126 C GLY A 10 -4.018 -6.598 -0.543 1.00 0.00 C ATOM 127 O GLY A 10 -3.209 -6.975 0.325 1.00 0.00 O ATOM 128 H GLY A 10 -2.264 -4.526 -0.057 1.00 0.00 H ATOM 129 HA2 GLY A 10 -5.052 -4.779 -0.927 1.00 0.00 H ATOM 130 HA3 GLY A 10 -3.614 -5.060 -1.914 1.00 0.00 H ATOM 131 N ILE A 11 -4.864 -7.402 -1.126 1.00 0.00 N ATOM 132 CA ILE A 11 -4.867 -8.817 -0.820 1.00 0.00 C ATOM 133 C ILE A 11 -3.500 -9.439 -1.157 1.00 0.00 C ATOM 134 O ILE A 11 -2.997 -9.328 -2.294 1.00 0.00 O ATOM 135 CB ILE A 11 -6.003 -9.560 -1.556 1.00 0.00 C ATOM 136 CG1 ILE A 11 -7.366 -8.997 -1.116 1.00 0.00 C ATOM 137 CG2 ILE A 11 -5.920 -11.062 -1.279 1.00 0.00 C ATOM 138 CD1 ILE A 11 -8.550 -9.581 -1.857 1.00 0.00 C ATOM 139 H ILE A 11 -5.513 -7.040 -1.768 1.00 0.00 H ATOM 140 HA ILE A 11 -5.019 -8.908 0.248 1.00 0.00 H ATOM 141 HB ILE A 11 -5.883 -9.398 -2.616 1.00 0.00 H ATOM 142 HG12 ILE A 11 -7.510 -9.202 -0.066 1.00 0.00 H ATOM 143 HG13 ILE A 11 -7.373 -7.928 -1.268 1.00 0.00 H ATOM 144 HG21 ILE A 11 -4.958 -11.425 -1.613 1.00 0.00 H ATOM 145 HG22 ILE A 11 -6.708 -11.571 -1.814 1.00 0.00 H ATOM 146 HG23 ILE A 11 -6.021 -11.236 -0.218 1.00 0.00 H ATOM 147 HD11 ILE A 11 -8.459 -9.359 -2.910 1.00 0.00 H ATOM 148 HD12 ILE A 11 -9.464 -9.148 -1.477 1.00 0.00 H ATOM 149 HD13 ILE A 11 -8.570 -10.652 -1.718 1.00 0.00 H ATOM 150 N GLY A 12 -2.888 -10.025 -0.160 1.00 0.00 N ATOM 151 CA GLY A 12 -1.600 -10.633 -0.318 1.00 0.00 C ATOM 152 C GLY A 12 -0.520 -9.829 0.373 1.00 0.00 C ATOM 153 O GLY A 12 0.653 -10.220 0.394 1.00 0.00 O ATOM 154 H GLY A 12 -3.315 -10.042 0.726 1.00 0.00 H ATOM 155 HA2 GLY A 12 -1.629 -11.629 0.098 1.00 0.00 H ATOM 156 HA3 GLY A 12 -1.378 -10.694 -1.373 1.00 0.00 H ATOM 157 N TYR A 13 -0.895 -8.704 0.934 1.00 0.00 N ATOM 158 CA TYR A 13 0.049 -7.851 1.613 1.00 0.00 C ATOM 159 C TYR A 13 -0.183 -7.922 3.121 1.00 0.00 C ATOM 160 O TYR A 13 -1.279 -7.648 3.601 1.00 0.00 O ATOM 161 CB TYR A 13 -0.073 -6.409 1.099 1.00 0.00 C ATOM 162 CG TYR A 13 0.975 -5.470 1.638 1.00 0.00 C ATOM 163 CD1 TYR A 13 0.676 -4.541 2.615 1.00 0.00 C ATOM 164 CD2 TYR A 13 2.272 -5.527 1.169 1.00 0.00 C ATOM 165 CE1 TYR A 13 1.640 -3.697 3.106 1.00 0.00 C ATOM 166 CE2 TYR A 13 3.248 -4.684 1.653 1.00 0.00 C ATOM 167 CZ TYR A 13 2.924 -3.770 2.622 1.00 0.00 C ATOM 168 OH TYR A 13 3.889 -2.932 3.133 1.00 0.00 O ATOM 169 H TYR A 13 -1.841 -8.435 0.898 1.00 0.00 H ATOM 170 HA TYR A 13 1.040 -8.221 1.396 1.00 0.00 H ATOM 171 HB2 TYR A 13 0.013 -6.409 0.023 1.00 0.00 H ATOM 172 HB3 TYR A 13 -1.044 -6.025 1.374 1.00 0.00 H ATOM 173 HD1 TYR A 13 -0.331 -4.482 2.996 1.00 0.00 H ATOM 174 HD2 TYR A 13 2.497 -6.252 0.403 1.00 0.00 H ATOM 175 HE1 TYR A 13 1.387 -2.977 3.871 1.00 0.00 H ATOM 176 HE2 TYR A 13 4.256 -4.741 1.271 1.00 0.00 H ATOM 177 HH TYR A 13 3.655 -2.772 4.053 1.00 0.00 H ATOM 178 N SER A 14 0.848 -8.280 3.855 1.00 0.00 N ATOM 179 CA SER A 14 0.762 -8.451 5.297 1.00 0.00 C ATOM 180 C SER A 14 1.681 -7.453 6.024 1.00 0.00 C ATOM 181 O SER A 14 2.073 -7.665 7.171 1.00 0.00 O ATOM 182 CB SER A 14 1.184 -9.862 5.631 1.00 0.00 C ATOM 183 OG SER A 14 0.516 -10.809 4.794 1.00 0.00 O ATOM 184 H SER A 14 1.713 -8.463 3.432 1.00 0.00 H ATOM 185 HA SER A 14 -0.255 -8.317 5.614 1.00 0.00 H ATOM 186 HB2 SER A 14 2.240 -9.897 5.448 1.00 0.00 H ATOM 187 HB3 SER A 14 0.977 -10.076 6.669 1.00 0.00 H ATOM 188 HG SER A 14 -0.272 -11.098 5.274 1.00 0.00 H ATOM 189 N GLY A 15 2.005 -6.371 5.360 1.00 0.00 N ATOM 190 CA GLY A 15 2.882 -5.374 5.943 1.00 0.00 C ATOM 191 C GLY A 15 2.107 -4.181 6.476 1.00 0.00 C ATOM 192 O GLY A 15 0.904 -4.302 6.719 1.00 0.00 O ATOM 193 H GLY A 15 1.621 -6.242 4.469 1.00 0.00 H ATOM 194 HA2 GLY A 15 3.448 -5.823 6.746 1.00 0.00 H ATOM 195 HA3 GLY A 15 3.563 -5.035 5.178 1.00 0.00 H ATOM 196 N PRO A 16 2.771 -3.013 6.674 1.00 0.00 N ATOM 197 CA PRO A 16 2.116 -1.774 7.142 1.00 0.00 C ATOM 198 C PRO A 16 0.972 -1.350 6.225 1.00 0.00 C ATOM 199 O PRO A 16 1.157 -1.170 5.013 1.00 0.00 O ATOM 200 CB PRO A 16 3.246 -0.726 7.109 1.00 0.00 C ATOM 201 CG PRO A 16 4.299 -1.334 6.254 1.00 0.00 C ATOM 202 CD PRO A 16 4.210 -2.806 6.505 1.00 0.00 C ATOM 203 HA PRO A 16 1.742 -1.883 8.149 1.00 0.00 H ATOM 204 HB2 PRO A 16 2.870 0.193 6.683 1.00 0.00 H ATOM 205 HB3 PRO A 16 3.605 -0.544 8.111 1.00 0.00 H ATOM 206 HG2 PRO A 16 4.097 -1.119 5.215 1.00 0.00 H ATOM 207 HG3 PRO A 16 5.272 -0.960 6.533 1.00 0.00 H ATOM 208 HD2 PRO A 16 4.590 -3.358 5.660 1.00 0.00 H ATOM 209 HD3 PRO A 16 4.742 -3.073 7.406 1.00 0.00 H ATOM 210 N THR A 17 -0.184 -1.211 6.799 1.00 0.00 N ATOM 211 CA THR A 17 -1.371 -0.875 6.068 1.00 0.00 C ATOM 212 C THR A 17 -1.820 0.573 6.316 1.00 0.00 C ATOM 213 O THR A 17 -2.457 1.196 5.467 1.00 0.00 O ATOM 214 CB THR A 17 -2.494 -1.892 6.388 1.00 0.00 C ATOM 215 OG1 THR A 17 -2.557 -2.132 7.822 1.00 0.00 O ATOM 216 CG2 THR A 17 -2.227 -3.212 5.679 1.00 0.00 C ATOM 217 H THR A 17 -0.257 -1.332 7.770 1.00 0.00 H ATOM 218 HA THR A 17 -1.137 -0.963 5.016 1.00 0.00 H ATOM 219 HB THR A 17 -3.439 -1.492 6.051 1.00 0.00 H ATOM 220 HG1 THR A 17 -1.870 -2.779 8.030 1.00 0.00 H ATOM 221 HG21 THR A 17 -3.022 -3.905 5.906 1.00 0.00 H ATOM 222 HG22 THR A 17 -1.285 -3.616 6.017 1.00 0.00 H ATOM 223 HG23 THR A 17 -2.182 -3.048 4.613 1.00 0.00 H ATOM 224 N VAL A 18 -1.464 1.116 7.472 1.00 0.00 N ATOM 225 CA VAL A 18 -1.798 2.490 7.789 1.00 0.00 C ATOM 226 C VAL A 18 -0.830 3.422 7.082 1.00 0.00 C ATOM 227 O VAL A 18 0.387 3.364 7.312 1.00 0.00 O ATOM 228 CB VAL A 18 -1.781 2.767 9.324 1.00 0.00 C ATOM 229 CG1 VAL A 18 -2.041 4.247 9.614 1.00 0.00 C ATOM 230 CG2 VAL A 18 -2.820 1.912 10.034 1.00 0.00 C ATOM 231 H VAL A 18 -0.961 0.578 8.118 1.00 0.00 H ATOM 232 HA VAL A 18 -2.792 2.679 7.410 1.00 0.00 H ATOM 233 HB VAL A 18 -0.804 2.512 9.707 1.00 0.00 H ATOM 234 HG11 VAL A 18 -2.071 4.407 10.682 1.00 0.00 H ATOM 235 HG12 VAL A 18 -2.982 4.544 9.176 1.00 0.00 H ATOM 236 HG13 VAL A 18 -1.242 4.836 9.186 1.00 0.00 H ATOM 237 HG21 VAL A 18 -2.628 0.867 9.846 1.00 0.00 H ATOM 238 HG22 VAL A 18 -3.802 2.162 9.664 1.00 0.00 H ATOM 239 HG23 VAL A 18 -2.775 2.100 11.097 1.00 0.00 H ATOM 240 N CYS A 19 -1.363 4.242 6.215 1.00 0.00 N ATOM 241 CA CYS A 19 -0.584 5.198 5.459 1.00 0.00 C ATOM 242 C CYS A 19 -0.144 6.363 6.328 1.00 0.00 C ATOM 243 O CYS A 19 -0.713 6.614 7.396 1.00 0.00 O ATOM 244 CB CYS A 19 -1.396 5.711 4.283 1.00 0.00 C ATOM 245 SG CYS A 19 -1.971 4.395 3.187 1.00 0.00 S ATOM 246 H CYS A 19 -2.329 4.193 6.061 1.00 0.00 H ATOM 247 HA CYS A 19 0.292 4.698 5.074 1.00 0.00 H ATOM 248 HB2 CYS A 19 -2.261 6.253 4.638 1.00 0.00 H ATOM 249 HB3 CYS A 19 -0.770 6.364 3.690 1.00 0.00 H ATOM 250 N ALA A 20 0.883 7.042 5.885 1.00 0.00 N ATOM 251 CA ALA A 20 1.419 8.190 6.567 1.00 0.00 C ATOM 252 C ALA A 20 0.471 9.377 6.499 1.00 0.00 C ATOM 253 O ALA A 20 -0.437 9.432 5.644 1.00 0.00 O ATOM 254 CB ALA A 20 2.761 8.559 5.976 1.00 0.00 C ATOM 255 H ALA A 20 1.322 6.737 5.059 1.00 0.00 H ATOM 256 HA ALA A 20 1.573 7.927 7.603 1.00 0.00 H ATOM 257 HB1 ALA A 20 2.631 8.846 4.943 1.00 0.00 H ATOM 258 HB2 ALA A 20 3.427 7.711 6.033 1.00 0.00 H ATOM 259 HB3 ALA A 20 3.174 9.388 6.530 1.00 0.00 H ATOM 260 N SER A 21 0.680 10.304 7.394 1.00 0.00 N ATOM 261 CA SER A 21 -0.099 11.501 7.481 1.00 0.00 C ATOM 262 C SER A 21 -0.021 12.292 6.169 1.00 0.00 C ATOM 263 O SER A 21 1.075 12.576 5.656 1.00 0.00 O ATOM 264 CB SER A 21 0.400 12.311 8.676 1.00 0.00 C ATOM 265 OG SER A 21 1.824 12.428 8.649 1.00 0.00 O ATOM 266 H SER A 21 1.404 10.187 8.044 1.00 0.00 H ATOM 267 HA SER A 21 -1.126 11.218 7.659 1.00 0.00 H ATOM 268 HB2 SER A 21 -0.034 13.298 8.648 1.00 0.00 H ATOM 269 HB3 SER A 21 0.112 11.813 9.590 1.00 0.00 H ATOM 270 HG SER A 21 2.013 12.945 7.853 1.00 0.00 H ATOM 271 N GLY A 22 -1.169 12.594 5.613 1.00 0.00 N ATOM 272 CA GLY A 22 -1.220 13.298 4.366 1.00 0.00 C ATOM 273 C GLY A 22 -1.536 12.375 3.210 1.00 0.00 C ATOM 274 O GLY A 22 -1.845 12.828 2.119 1.00 0.00 O ATOM 275 H GLY A 22 -2.010 12.367 6.063 1.00 0.00 H ATOM 276 HA2 GLY A 22 -1.976 14.068 4.425 1.00 0.00 H ATOM 277 HA3 GLY A 22 -0.260 13.760 4.188 1.00 0.00 H ATOM 278 N THR A 23 -1.464 11.073 3.444 1.00 0.00 N ATOM 279 CA THR A 23 -1.741 10.107 2.398 1.00 0.00 C ATOM 280 C THR A 23 -2.866 9.185 2.835 1.00 0.00 C ATOM 281 O THR A 23 -3.038 8.940 4.035 1.00 0.00 O ATOM 282 CB THR A 23 -0.486 9.254 2.053 1.00 0.00 C ATOM 283 OG1 THR A 23 -0.049 8.494 3.183 1.00 0.00 O ATOM 284 CG2 THR A 23 0.650 10.137 1.600 1.00 0.00 C ATOM 285 H THR A 23 -1.234 10.747 4.341 1.00 0.00 H ATOM 286 HA THR A 23 -2.040 10.653 1.513 1.00 0.00 H ATOM 287 HB THR A 23 -0.733 8.572 1.252 1.00 0.00 H ATOM 288 HG1 THR A 23 -0.351 8.916 4.001 1.00 0.00 H ATOM 289 HG21 THR A 23 0.895 10.841 2.383 1.00 0.00 H ATOM 290 HG22 THR A 23 0.358 10.674 0.709 1.00 0.00 H ATOM 291 HG23 THR A 23 1.514 9.527 1.385 1.00 0.00 H ATOM 292 N THR A 24 -3.633 8.696 1.902 1.00 0.00 N ATOM 293 CA THR A 24 -4.693 7.775 2.214 1.00 0.00 C ATOM 294 C THR A 24 -4.573 6.523 1.361 1.00 0.00 C ATOM 295 O THR A 24 -4.111 6.584 0.226 1.00 0.00 O ATOM 296 CB THR A 24 -6.082 8.426 2.038 1.00 0.00 C ATOM 297 OG1 THR A 24 -6.134 9.159 0.803 1.00 0.00 O ATOM 298 CG2 THR A 24 -6.417 9.351 3.200 1.00 0.00 C ATOM 299 H THR A 24 -3.493 8.953 0.962 1.00 0.00 H ATOM 300 HA THR A 24 -4.570 7.495 3.249 1.00 0.00 H ATOM 301 HB THR A 24 -6.816 7.633 1.996 1.00 0.00 H ATOM 302 HG1 THR A 24 -5.284 9.090 0.340 1.00 0.00 H ATOM 303 HG21 THR A 24 -7.387 9.796 3.037 1.00 0.00 H ATOM 304 HG22 THR A 24 -5.670 10.127 3.268 1.00 0.00 H ATOM 305 HG23 THR A 24 -6.431 8.785 4.118 1.00 0.00 H ATOM 306 N CYS A 25 -4.945 5.407 1.909 1.00 0.00 N ATOM 307 CA CYS A 25 -4.872 4.150 1.200 1.00 0.00 C ATOM 308 C CYS A 25 -5.890 4.126 0.061 1.00 0.00 C ATOM 309 O CYS A 25 -7.099 4.286 0.288 1.00 0.00 O ATOM 310 CB CYS A 25 -5.113 2.977 2.163 1.00 0.00 C ATOM 311 SG CYS A 25 -5.050 1.336 1.370 1.00 0.00 S ATOM 312 H CYS A 25 -5.278 5.416 2.833 1.00 0.00 H ATOM 313 HA CYS A 25 -3.877 4.068 0.787 1.00 0.00 H ATOM 314 HB2 CYS A 25 -4.360 2.995 2.937 1.00 0.00 H ATOM 315 HB3 CYS A 25 -6.087 3.091 2.614 1.00 0.00 H ATOM 316 N GLN A 26 -5.407 4.001 -1.153 1.00 0.00 N ATOM 317 CA GLN A 26 -6.259 3.916 -2.314 1.00 0.00 C ATOM 318 C GLN A 26 -6.292 2.489 -2.784 1.00 0.00 C ATOM 319 O GLN A 26 -5.240 1.917 -3.095 1.00 0.00 O ATOM 320 CB GLN A 26 -5.716 4.757 -3.478 1.00 0.00 C ATOM 321 CG GLN A 26 -5.425 6.208 -3.173 1.00 0.00 C ATOM 322 CD GLN A 26 -6.610 6.988 -2.692 1.00 0.00 C ATOM 323 OE1 GLN A 26 -7.767 6.697 -3.034 1.00 0.00 O ATOM 324 NE2 GLN A 26 -6.351 8.005 -1.934 1.00 0.00 N ATOM 325 H GLN A 26 -4.432 3.963 -1.291 1.00 0.00 H ATOM 326 HA GLN A 26 -7.252 4.258 -2.063 1.00 0.00 H ATOM 327 HB2 GLN A 26 -4.793 4.310 -3.820 1.00 0.00 H ATOM 328 HB3 GLN A 26 -6.430 4.718 -4.288 1.00 0.00 H ATOM 329 HG2 GLN A 26 -4.663 6.255 -2.408 1.00 0.00 H ATOM 330 HG3 GLN A 26 -5.056 6.671 -4.075 1.00 0.00 H ATOM 331 HE21 GLN A 26 -5.409 8.210 -1.718 1.00 0.00 H ATOM 332 HE22 GLN A 26 -7.081 8.560 -1.588 1.00 0.00 H ATOM 333 N VAL A 27 -7.451 1.901 -2.821 1.00 0.00 N ATOM 334 CA VAL A 27 -7.585 0.582 -3.383 1.00 0.00 C ATOM 335 C VAL A 27 -7.679 0.737 -4.894 1.00 0.00 C ATOM 336 O VAL A 27 -8.720 1.125 -5.430 1.00 0.00 O ATOM 337 CB VAL A 27 -8.828 -0.175 -2.834 1.00 0.00 C ATOM 338 CG1 VAL A 27 -8.919 -1.575 -3.432 1.00 0.00 C ATOM 339 CG2 VAL A 27 -8.777 -0.256 -1.314 1.00 0.00 C ATOM 340 H VAL A 27 -8.249 2.352 -2.469 1.00 0.00 H ATOM 341 HA VAL A 27 -6.684 0.032 -3.145 1.00 0.00 H ATOM 342 HB VAL A 27 -9.715 0.372 -3.118 1.00 0.00 H ATOM 343 HG11 VAL A 27 -8.033 -2.134 -3.168 1.00 0.00 H ATOM 344 HG12 VAL A 27 -8.978 -1.500 -4.508 1.00 0.00 H ATOM 345 HG13 VAL A 27 -9.794 -2.081 -3.051 1.00 0.00 H ATOM 346 HG21 VAL A 27 -7.883 -0.783 -1.012 1.00 0.00 H ATOM 347 HG22 VAL A 27 -9.645 -0.782 -0.950 1.00 0.00 H ATOM 348 HG23 VAL A 27 -8.761 0.740 -0.899 1.00 0.00 H ATOM 349 N LEU A 28 -6.568 0.532 -5.556 1.00 0.00 N ATOM 350 CA LEU A 28 -6.482 0.688 -6.998 1.00 0.00 C ATOM 351 C LEU A 28 -6.959 -0.573 -7.677 1.00 0.00 C ATOM 352 O LEU A 28 -7.635 -0.538 -8.710 1.00 0.00 O ATOM 353 CB LEU A 28 -5.033 1.005 -7.407 1.00 0.00 C ATOM 354 CG LEU A 28 -4.439 2.302 -6.831 1.00 0.00 C ATOM 355 CD1 LEU A 28 -2.982 2.437 -7.202 1.00 0.00 C ATOM 356 CD2 LEU A 28 -5.195 3.501 -7.341 1.00 0.00 C ATOM 357 H LEU A 28 -5.779 0.253 -5.045 1.00 0.00 H ATOM 358 HA LEU A 28 -7.118 1.510 -7.291 1.00 0.00 H ATOM 359 HB2 LEU A 28 -4.407 0.183 -7.092 1.00 0.00 H ATOM 360 HB3 LEU A 28 -4.997 1.067 -8.485 1.00 0.00 H ATOM 361 HG LEU A 28 -4.517 2.287 -5.754 1.00 0.00 H ATOM 362 HD11 LEU A 28 -2.593 3.362 -6.802 1.00 0.00 H ATOM 363 HD12 LEU A 28 -2.885 2.435 -8.276 1.00 0.00 H ATOM 364 HD13 LEU A 28 -2.426 1.608 -6.790 1.00 0.00 H ATOM 365 HD21 LEU A 28 -6.232 3.438 -7.044 1.00 0.00 H ATOM 366 HD22 LEU A 28 -5.112 3.503 -8.418 1.00 0.00 H ATOM 367 HD23 LEU A 28 -4.743 4.397 -6.940 1.00 0.00 H ATOM 368 N ASN A 29 -6.615 -1.675 -7.084 1.00 0.00 N ATOM 369 CA ASN A 29 -6.988 -2.982 -7.547 1.00 0.00 C ATOM 370 C ASN A 29 -7.253 -3.791 -6.306 1.00 0.00 C ATOM 371 O ASN A 29 -6.846 -3.370 -5.239 1.00 0.00 O ATOM 372 CB ASN A 29 -5.847 -3.647 -8.361 1.00 0.00 C ATOM 373 CG ASN A 29 -5.469 -2.911 -9.631 1.00 0.00 C ATOM 374 OD1 ASN A 29 -6.061 -3.133 -10.687 1.00 0.00 O ATOM 375 ND2 ASN A 29 -4.472 -2.068 -9.554 1.00 0.00 N ATOM 376 H ASN A 29 -6.099 -1.643 -6.245 1.00 0.00 H ATOM 377 HA ASN A 29 -7.882 -2.903 -8.146 1.00 0.00 H ATOM 378 HB2 ASN A 29 -4.972 -3.724 -7.737 1.00 0.00 H ATOM 379 HB3 ASN A 29 -6.171 -4.643 -8.626 1.00 0.00 H ATOM 380 HD21 ASN A 29 -4.030 -1.960 -8.688 1.00 0.00 H ATOM 381 HD22 ASN A 29 -4.193 -1.583 -10.361 1.00 0.00 H ATOM 382 N PRO A 30 -7.924 -4.951 -6.395 1.00 0.00 N ATOM 383 CA PRO A 30 -8.212 -5.776 -5.208 1.00 0.00 C ATOM 384 C PRO A 30 -6.934 -6.191 -4.458 1.00 0.00 C ATOM 385 O PRO A 30 -6.924 -6.318 -3.227 1.00 0.00 O ATOM 386 CB PRO A 30 -8.914 -7.010 -5.790 1.00 0.00 C ATOM 387 CG PRO A 30 -9.473 -6.548 -7.092 1.00 0.00 C ATOM 388 CD PRO A 30 -8.494 -5.543 -7.622 1.00 0.00 C ATOM 389 HA PRO A 30 -8.873 -5.263 -4.525 1.00 0.00 H ATOM 390 HB2 PRO A 30 -8.186 -7.797 -5.925 1.00 0.00 H ATOM 391 HB3 PRO A 30 -9.696 -7.340 -5.120 1.00 0.00 H ATOM 392 HG2 PRO A 30 -9.563 -7.384 -7.772 1.00 0.00 H ATOM 393 HG3 PRO A 30 -10.436 -6.088 -6.937 1.00 0.00 H ATOM 394 HD2 PRO A 30 -7.724 -6.031 -8.201 1.00 0.00 H ATOM 395 HD3 PRO A 30 -8.990 -4.790 -8.215 1.00 0.00 H ATOM 396 N TYR A 31 -5.853 -6.389 -5.189 1.00 0.00 N ATOM 397 CA TYR A 31 -4.625 -6.798 -4.555 1.00 0.00 C ATOM 398 C TYR A 31 -3.631 -5.628 -4.498 1.00 0.00 C ATOM 399 O TYR A 31 -2.754 -5.582 -3.630 1.00 0.00 O ATOM 400 CB TYR A 31 -4.009 -7.970 -5.338 1.00 0.00 C ATOM 401 CG TYR A 31 -4.962 -9.140 -5.604 1.00 0.00 C ATOM 402 CD1 TYR A 31 -5.024 -10.220 -4.745 1.00 0.00 C ATOM 403 CD2 TYR A 31 -5.793 -9.154 -6.725 1.00 0.00 C ATOM 404 CE1 TYR A 31 -5.878 -11.281 -4.982 1.00 0.00 C ATOM 405 CE2 TYR A 31 -6.651 -10.210 -6.968 1.00 0.00 C ATOM 406 CZ TYR A 31 -6.689 -11.269 -6.093 1.00 0.00 C ATOM 407 OH TYR A 31 -7.546 -12.323 -6.327 1.00 0.00 O ATOM 408 H TYR A 31 -5.900 -6.262 -6.158 1.00 0.00 H ATOM 409 HA TYR A 31 -4.842 -7.127 -3.549 1.00 0.00 H ATOM 410 HB2 TYR A 31 -3.657 -7.607 -6.292 1.00 0.00 H ATOM 411 HB3 TYR A 31 -3.165 -8.351 -4.781 1.00 0.00 H ATOM 412 HD1 TYR A 31 -4.391 -10.229 -3.870 1.00 0.00 H ATOM 413 HD2 TYR A 31 -5.759 -8.321 -7.412 1.00 0.00 H ATOM 414 HE1 TYR A 31 -5.906 -12.113 -4.294 1.00 0.00 H ATOM 415 HE2 TYR A 31 -7.287 -10.200 -7.841 1.00 0.00 H ATOM 416 HH TYR A 31 -7.962 -12.561 -5.488 1.00 0.00 H ATOM 417 N TYR A 32 -3.748 -4.694 -5.417 1.00 0.00 N ATOM 418 CA TYR A 32 -2.895 -3.527 -5.379 1.00 0.00 C ATOM 419 C TYR A 32 -3.563 -2.322 -4.712 1.00 0.00 C ATOM 420 O TYR A 32 -4.503 -1.747 -5.258 1.00 0.00 O ATOM 421 CB TYR A 32 -2.352 -3.169 -6.754 1.00 0.00 C ATOM 422 CG TYR A 32 -1.310 -2.074 -6.711 1.00 0.00 C ATOM 423 CD1 TYR A 32 -0.153 -2.232 -5.950 1.00 0.00 C ATOM 424 CD2 TYR A 32 -1.463 -0.900 -7.434 1.00 0.00 C ATOM 425 CE1 TYR A 32 0.816 -1.259 -5.918 1.00 0.00 C ATOM 426 CE2 TYR A 32 -0.497 0.078 -7.402 1.00 0.00 C ATOM 427 CZ TYR A 32 0.639 -0.106 -6.645 1.00 0.00 C ATOM 428 OH TYR A 32 1.612 0.855 -6.642 1.00 0.00 O ATOM 429 H TYR A 32 -4.426 -4.783 -6.114 1.00 0.00 H ATOM 430 HA TYR A 32 -2.060 -3.801 -4.751 1.00 0.00 H ATOM 431 HB2 TYR A 32 -1.901 -4.042 -7.199 1.00 0.00 H ATOM 432 HB3 TYR A 32 -3.166 -2.829 -7.374 1.00 0.00 H ATOM 433 HD1 TYR A 32 -0.022 -3.140 -5.380 1.00 0.00 H ATOM 434 HD2 TYR A 32 -2.354 -0.740 -8.026 1.00 0.00 H ATOM 435 HE1 TYR A 32 1.701 -1.401 -5.313 1.00 0.00 H ATOM 436 HE2 TYR A 32 -0.639 0.987 -7.969 1.00 0.00 H ATOM 437 HH TYR A 32 1.202 1.722 -6.544 1.00 0.00 H ATOM 438 N SER A 33 -3.044 -1.910 -3.608 1.00 0.00 N ATOM 439 CA SER A 33 -3.535 -0.741 -2.927 1.00 0.00 C ATOM 440 C SER A 33 -2.332 0.166 -2.700 1.00 0.00 C ATOM 441 O SER A 33 -1.253 -0.339 -2.448 1.00 0.00 O ATOM 442 CB SER A 33 -4.180 -1.157 -1.601 1.00 0.00 C ATOM 443 OG SER A 33 -5.166 -2.157 -1.816 1.00 0.00 O ATOM 444 H SER A 33 -2.294 -2.389 -3.208 1.00 0.00 H ATOM 445 HA SER A 33 -4.256 -0.245 -3.558 1.00 0.00 H ATOM 446 HB2 SER A 33 -3.423 -1.550 -0.939 1.00 0.00 H ATOM 447 HB3 SER A 33 -4.651 -0.300 -1.144 1.00 0.00 H ATOM 448 HG SER A 33 -5.660 -2.300 -1.002 1.00 0.00 H ATOM 449 N GLN A 34 -2.494 1.466 -2.811 1.00 0.00 N ATOM 450 CA GLN A 34 -1.366 2.392 -2.685 1.00 0.00 C ATOM 451 C GLN A 34 -1.746 3.648 -1.891 1.00 0.00 C ATOM 452 O GLN A 34 -2.832 4.175 -2.056 1.00 0.00 O ATOM 453 CB GLN A 34 -0.845 2.759 -4.087 1.00 0.00 C ATOM 454 CG GLN A 34 0.199 3.859 -4.109 1.00 0.00 C ATOM 455 CD GLN A 34 0.745 4.134 -5.494 1.00 0.00 C ATOM 456 OE1 GLN A 34 0.194 4.923 -6.244 1.00 0.00 O ATOM 457 NE2 GLN A 34 1.864 3.539 -5.815 1.00 0.00 N ATOM 458 H GLN A 34 -3.396 1.833 -2.967 1.00 0.00 H ATOM 459 HA GLN A 34 -0.580 1.876 -2.153 1.00 0.00 H ATOM 460 HB2 GLN A 34 -0.408 1.881 -4.540 1.00 0.00 H ATOM 461 HB3 GLN A 34 -1.682 3.074 -4.693 1.00 0.00 H ATOM 462 HG2 GLN A 34 -0.241 4.769 -3.728 1.00 0.00 H ATOM 463 HG3 GLN A 34 1.016 3.560 -3.470 1.00 0.00 H ATOM 464 HE21 GLN A 34 2.303 2.955 -5.157 1.00 0.00 H ATOM 465 HE22 GLN A 34 2.245 3.707 -6.702 1.00 0.00 H ATOM 466 N CYS A 35 -0.860 4.093 -1.010 1.00 0.00 N ATOM 467 CA CYS A 35 -1.095 5.305 -0.227 1.00 0.00 C ATOM 468 C CYS A 35 -0.895 6.552 -1.066 1.00 0.00 C ATOM 469 O CYS A 35 0.230 6.851 -1.510 1.00 0.00 O ATOM 470 CB CYS A 35 -0.179 5.376 0.995 1.00 0.00 C ATOM 471 SG CYS A 35 -0.318 3.968 2.105 1.00 0.00 S ATOM 472 H CYS A 35 -0.037 3.570 -0.865 1.00 0.00 H ATOM 473 HA CYS A 35 -2.119 5.282 0.113 1.00 0.00 H ATOM 474 HB2 CYS A 35 0.853 5.477 0.701 1.00 0.00 H ATOM 475 HB3 CYS A 35 -0.451 6.256 1.558 1.00 0.00 H ATOM 476 N LEU A 36 -1.965 7.259 -1.274 1.00 0.00 N ATOM 477 CA LEU A 36 -2.000 8.492 -1.994 1.00 0.00 C ATOM 478 C LEU A 36 -2.807 9.466 -1.163 1.00 0.00 C ATOM 479 O LEU A 36 -4.022 9.227 -0.950 1.00 0.00 O ATOM 480 CB LEU A 36 -2.626 8.304 -3.382 1.00 0.00 C ATOM 481 CG LEU A 36 -1.880 7.359 -4.343 1.00 0.00 C ATOM 482 CD1 LEU A 36 -2.661 7.178 -5.632 1.00 0.00 C ATOM 483 CD2 LEU A 36 -0.491 7.892 -4.652 1.00 0.00 C ATOM 484 OXT LEU A 36 -2.234 10.430 -0.658 1.00 0.00 O ATOM 485 H LEU A 36 -2.826 6.955 -0.906 1.00 0.00 H ATOM 486 HA LEU A 36 -0.989 8.863 -2.090 1.00 0.00 H ATOM 487 HB2 LEU A 36 -3.627 7.928 -3.245 1.00 0.00 H ATOM 488 HB3 LEU A 36 -2.697 9.272 -3.853 1.00 0.00 H ATOM 489 HG LEU A 36 -1.778 6.390 -3.879 1.00 0.00 H ATOM 490 HD11 LEU A 36 -3.611 6.715 -5.415 1.00 0.00 H ATOM 491 HD12 LEU A 36 -2.103 6.548 -6.309 1.00 0.00 H ATOM 492 HD13 LEU A 36 -2.826 8.142 -6.090 1.00 0.00 H ATOM 493 HD21 LEU A 36 0.015 7.212 -5.323 1.00 0.00 H ATOM 494 HD22 LEU A 36 0.080 7.979 -3.740 1.00 0.00 H ATOM 495 HD23 LEU A 36 -0.575 8.860 -5.122 1.00 0.00 H TER 496 LEU A 36 HETATM 497 C2 BGC A 101 7.295 2.908 0.768 1.00 0.00 C HETATM 498 C3 BGC A 101 7.084 1.421 0.948 1.00 0.00 C HETATM 499 C4 BGC A 101 7.779 0.980 2.225 1.00 0.00 C HETATM 500 C5 BGC A 101 7.189 1.760 3.420 1.00 0.00 C HETATM 501 C6 BGC A 101 7.907 1.486 4.730 1.00 0.00 C HETATM 502 C1 BGC A 101 6.677 3.650 1.950 1.00 0.00 C HETATM 503 O2 BGC A 101 6.709 3.361 -0.448 1.00 0.00 O HETATM 504 O3 BGC A 101 7.598 0.717 -0.172 1.00 0.00 O HETATM 505 O4 BGC A 101 7.590 -0.412 2.381 1.00 0.00 O HETATM 506 O5 BGC A 101 7.302 3.200 3.179 1.00 0.00 O HETATM 507 O6 BGC A 101 7.485 2.405 5.748 1.00 0.00 O HETATM 508 H2 BGC A 101 8.369 3.144 0.778 1.00 0.00 H HETATM 509 H3 BGC A 101 6.000 1.257 1.049 1.00 0.00 H HETATM 510 H4 BGC A 101 8.850 1.206 2.124 1.00 0.00 H HETATM 511 H5 BGC A 101 6.115 1.546 3.522 1.00 0.00 H HETATM 512 H6C1 BGC A 101 8.987 1.581 4.543 1.00 0.00 H HETATM 513 H6C2 BGC A 101 7.705 0.450 5.045 1.00 0.00 H HETATM 514 H1 BGC A 101 5.610 3.387 1.990 1.00 0.00 H HETATM 515 HB BGC A 101 6.769 4.323 -0.404 1.00 0.00 H HETATM 516 HC BGC A 101 7.182 1.118 -0.948 1.00 0.00 H HETATM 517 HD BGC A 101 7.891 -0.819 1.561 1.00 0.00 H HETATM 518 H6 BGC A 101 7.160 3.196 5.299 1.00 0.00 H