ATOM 1 N ALA A 1 1.544 -0.732 -2.625 1.00 4.34 N ATOM 2 CA ALA A 1 2.285 0.050 -1.642 1.00 63.23 C ATOM 3 C ALA A 1 3.771 -0.293 -1.676 1.00 11.41 C ATOM 4 O ALA A 1 4.624 0.587 -1.556 1.00 2.11 O ATOM 5 CB ALA A 1 1.720 -0.181 -0.249 1.00 31.12 C ATOM 6 H1 ALA A 1 1.622 -1.708 -2.616 1.00 23.34 H ATOM 7 HA ALA A 1 2.162 1.095 -1.886 1.00 14.44 H ATOM 8 HB1 ALA A 1 2.438 0.146 0.489 1.00 40.51 H ATOM 9 HB2 ALA A 1 0.804 0.380 -0.135 1.00 23.24 H ATOM 10 HB3 ALA A 1 1.518 -1.233 -0.113 1.00 13.15 H ATOM 11 N CYS A 2 4.074 -1.576 -1.839 1.00 70.01 N ATOM 12 CA CYS A 2 5.457 -2.036 -1.887 1.00 54.43 C ATOM 13 C CYS A 2 6.258 -1.241 -2.914 1.00 65.22 C ATOM 14 O CYS A 2 7.064 -0.382 -2.559 1.00 0.03 O ATOM 15 CB CYS A 2 5.509 -3.527 -2.226 1.00 51.30 C ATOM 16 SG CYS A 2 5.544 -4.619 -0.769 1.00 32.42 S ATOM 17 H CYS A 2 3.349 -2.231 -1.929 1.00 64.12 H ATOM 18 HA CYS A 2 5.892 -1.882 -0.912 1.00 11.42 H ATOM 19 HB2 CYS A 2 4.637 -3.786 -2.809 1.00 63.23 H ATOM 20 HB3 CYS A 2 6.397 -3.725 -2.808 1.00 31.02 H ATOM 21 N GLY A 3 6.031 -1.535 -4.191 1.00 31.31 N ATOM 22 CA GLY A 3 6.739 -0.840 -5.250 1.00 20.11 C ATOM 23 C GLY A 3 7.674 -1.753 -6.019 1.00 13.14 C ATOM 24 O GLY A 3 8.592 -1.298 -6.701 1.00 63.53 O ATOM 25 H GLY A 3 5.377 -2.230 -4.415 1.00 70.04 H ATOM 26 HA2 GLY A 3 6.018 -0.421 -5.935 1.00 52.42 H ATOM 27 HA3 GLY A 3 7.316 -0.037 -4.815 1.00 22.54 H HETATM 28 N DBB A 4 7.447 -3.048 -5.912 1.00 11.33 N HETATM 29 CA DBB A 4 8.308 -3.985 -6.616 1.00 10.53 C HETATM 30 C DBB A 4 9.805 -3.788 -6.319 1.00 24.42 C HETATM 31 O DBB A 4 10.570 -3.599 -7.263 1.00 45.43 O HETATM 32 CB DBB A 4 7.844 -5.416 -6.279 1.00 61.23 C HETATM 33 CG DBB A 4 8.576 -6.411 -7.166 1.00 14.14 C HETATM 34 H DBB A 4 6.703 -3.376 -5.357 1.00 44.11 H HETATM 35 HA DBB A 4 8.153 -3.838 -7.666 1.00 45.11 H HETATM 36 HB2 DBB A 4 6.811 -5.452 -6.551 1.00 60.35 H HETATM 37 HG1 DBB A 4 9.628 -6.383 -6.926 1.00 74.03 H HETATM 38 HG2 DBB A 4 8.433 -6.144 -8.202 1.00 72.22 H HETATM 39 HG3 DBB A 4 8.191 -7.402 -6.988 1.00 32.11 H ATOM 40 N GLY A 5 10.206 -3.783 -5.051 1.00 2.31 N ATOM 41 CA GLY A 5 11.598 -3.547 -4.714 1.00 11.30 C ATOM 42 C GLY A 5 12.542 -4.451 -5.481 1.00 73.24 C ATOM 43 O GLY A 5 13.005 -4.168 -6.582 1.00 64.14 O ATOM 44 H GLY A 5 9.551 -3.940 -4.339 1.00 4.13 H ATOM 45 HA2 GLY A 5 11.841 -2.518 -4.936 1.00 23.43 H ATOM 46 HA3 GLY A 5 11.734 -3.718 -3.656 1.00 63.42 H HETATM 47 N IAS A 6 12.865 -5.614 -4.892 1.00 10.13 N HETATM 48 CA IAS A 6 13.679 -6.593 -5.592 1.00 5.04 C HETATM 49 C IAS A 6 12.866 -7.587 -6.400 1.00 33.10 C HETATM 50 O IAS A 6 12.853 -7.641 -7.603 1.00 64.34 O HETATM 51 CB IAS A 6 14.673 -7.326 -4.671 1.00 51.24 C HETATM 52 CG IAS A 6 14.013 -7.974 -3.462 1.00 32.22 C HETATM 53 OD1 IAS A 6 13.858 -9.192 -3.387 1.00 21.31 O HETATM 54 OXT IAS A 6 12.056 -8.318 -5.618 1.00 40.33 O HETATM 55 H IAS A 6 12.494 -5.854 -3.998 1.00 44.43 H HETATM 56 HA IAS A 6 14.243 -6.057 -6.346 1.00 61.34 H HETATM 57 HB2 IAS A 6 15.366 -6.596 -4.279 1.00 23.33 H HETATM 58 HB3 IAS A 6 15.213 -8.057 -5.253 1.00 74.40 H HETATM 59 HXT IAS A 6 11.767 -9.136 -6.050 1.00 23.04 H ATOM 60 N GLY A 7 13.616 -7.135 -2.510 1.00 50.30 N ATOM 61 CA GLY A 7 12.966 -7.628 -1.310 1.00 4.13 C ATOM 62 C GLY A 7 11.461 -7.455 -1.352 1.00 41.41 C ATOM 63 O GLY A 7 10.823 -7.250 -0.319 1.00 72.11 O ATOM 64 H GLY A 7 13.766 -6.173 -2.624 1.00 14.31 H ATOM 65 HA2 GLY A 7 13.195 -8.677 -1.195 1.00 54.01 H ATOM 66 HA3 GLY A 7 13.355 -7.090 -0.457 1.00 71.12 H ATOM 67 N CYS A 8 10.891 -7.535 -2.550 1.00 5.41 N ATOM 68 CA CYS A 8 9.452 -7.383 -2.724 1.00 60.14 C ATOM 69 C CYS A 8 8.741 -8.724 -2.568 1.00 61.43 C ATOM 70 O CYS A 8 8.913 -9.628 -3.385 1.00 72.35 O ATOM 71 CB CYS A 8 9.144 -6.787 -4.099 1.00 73.03 C ATOM 72 SG CYS A 8 7.583 -5.850 -4.171 1.00 31.45 S ATOM 73 H CYS A 8 11.453 -7.699 -3.337 1.00 23.41 H ATOM 74 HA CYS A 8 9.094 -6.709 -1.961 1.00 62.20 H ATOM 75 HB2 CYS A 8 9.942 -6.115 -4.379 1.00 1.01 H ATOM 76 HB3 CYS A 8 9.082 -7.585 -4.824 1.00 21.52 H ATOM 77 N ALA A 9 7.942 -8.845 -1.513 1.00 42.01 N ATOM 78 CA ALA A 9 7.203 -10.074 -1.251 1.00 5.23 C ATOM 79 C ALA A 9 6.359 -10.475 -2.456 1.00 3.23 C ATOM 80 O ALA A 9 6.060 -9.650 -3.319 1.00 71.05 O ATOM 81 CB ALA A 9 6.325 -9.909 -0.020 1.00 13.23 C ATOM 82 H ALA A 9 7.846 -8.089 -0.897 1.00 44.03 H ATOM 83 HA ALA A 9 7.920 -10.857 -1.049 1.00 72.30 H ATOM 84 HB1 ALA A 9 5.555 -9.178 -0.223 1.00 63.11 H ATOM 85 HB2 ALA A 9 5.867 -10.856 0.225 1.00 0.52 H ATOM 86 HB3 ALA A 9 6.928 -9.575 0.811 1.00 43.42 H ATOM 87 N LYS A 10 5.978 -11.747 -2.509 1.00 4.45 N ATOM 88 CA LYS A 10 5.168 -12.258 -3.607 1.00 71.13 C ATOM 89 C LYS A 10 3.755 -12.584 -3.135 1.00 74.01 C ATOM 90 O LYS A 10 3.516 -12.841 -1.955 1.00 13.23 O ATOM 91 CB LYS A 10 5.817 -13.507 -4.209 1.00 12.23 C ATOM 92 CG LYS A 10 5.981 -14.645 -3.216 1.00 51.22 C ATOM 93 CD LYS A 10 4.862 -15.664 -3.347 1.00 32.33 C ATOM 94 CE LYS A 10 5.231 -16.776 -4.317 1.00 31.23 C ATOM 95 NZ LYS A 10 4.937 -16.402 -5.728 1.00 2.53 N ATOM 96 H LYS A 10 6.249 -12.357 -1.790 1.00 15.54 H ATOM 97 HA LYS A 10 5.114 -11.491 -4.365 1.00 15.24 H ATOM 98 HB2 LYS A 10 5.206 -13.856 -5.028 1.00 32.42 H ATOM 99 HB3 LYS A 10 6.794 -13.243 -4.587 1.00 21.21 H ATOM 100 HG2 LYS A 10 6.925 -15.137 -3.399 1.00 54.03 H ATOM 101 HG3 LYS A 10 5.972 -14.240 -2.214 1.00 62.30 H ATOM 102 HD2 LYS A 10 4.667 -16.098 -2.377 1.00 74.13 H ATOM 103 HD3 LYS A 10 3.972 -15.166 -3.706 1.00 4.43 H ATOM 104 HE2 LYS A 10 6.285 -16.984 -4.221 1.00 24.53 H ATOM 105 HE3 LYS A 10 4.665 -17.660 -4.062 1.00 71.25 H ATOM 106 HZ1 LYS A 10 4.150 -15.722 -5.760 1.00 70.52 H ATOM 107 HZ2 LYS A 10 4.674 -17.246 -6.274 1.00 61.13 H ATOM 108 HZ3 LYS A 10 5.775 -15.966 -6.164 1.00 31.31 H HETATM 109 N DBB A 11 2.814 -12.575 -4.060 1.00 65.22 N HETATM 110 CA DBB A 11 1.441 -12.872 -3.686 1.00 61.41 C HETATM 111 C DBB A 11 0.747 -11.727 -2.927 1.00 60.15 C HETATM 112 O DBB A 11 1.051 -10.568 -3.209 1.00 4.51 O HETATM 113 CB DBB A 11 0.665 -13.263 -4.960 1.00 43.04 C HETATM 114 CG DBB A 11 -0.708 -13.791 -4.580 1.00 31.14 C HETATM 115 H DBB A 11 3.041 -12.366 -4.994 1.00 43.54 H HETATM 116 HA DBB A 11 1.460 -13.733 -3.048 1.00 34.13 H HETATM 117 HB2 DBB A 11 1.209 -14.079 -5.386 1.00 43.43 H HETATM 118 HG1 DBB A 11 -1.229 -14.086 -5.477 1.00 72.45 H HETATM 119 HG2 DBB A 11 -1.266 -13.016 -4.075 1.00 71.25 H HETATM 120 HG3 DBB A 11 -0.598 -14.643 -3.929 1.00 33.42 H ATOM 121 N CYS A 12 -0.188 -12.032 -2.034 1.00 60.40 N ATOM 122 CA CYS A 12 -0.927 -11.001 -1.317 1.00 11.41 C ATOM 123 C CYS A 12 -0.082 -10.407 -0.193 1.00 61.34 C ATOM 124 O CYS A 12 -0.468 -10.446 0.974 1.00 21.14 O ATOM 125 CB CYS A 12 -2.224 -11.577 -0.745 1.00 24.14 C ATOM 126 SG CYS A 12 -3.112 -12.685 -1.886 1.00 13.42 S ATOM 127 H CYS A 12 -0.386 -12.976 -1.852 1.00 53.33 H ATOM 128 HA CYS A 12 -1.171 -10.218 -2.019 1.00 44.11 H ATOM 129 HB2 CYS A 12 -1.994 -12.141 0.148 1.00 75.43 H ATOM 130 HB3 CYS A 12 -2.888 -10.765 -0.490 1.00 11.23 H ATOM 131 N ALA A 13 1.073 -9.859 -0.556 1.00 0.41 N ATOM 132 CA ALA A 13 1.972 -9.255 0.420 1.00 32.32 C ATOM 133 C ALA A 13 2.415 -7.866 -0.027 1.00 21.42 C ATOM 134 O ALA A 13 2.580 -6.979 0.810 1.00 60.14 O ATOM 135 CB ALA A 13 3.181 -10.150 0.647 1.00 4.25 C ATOM 136 H ALA A 13 1.326 -9.858 -1.503 1.00 33.45 H ATOM 137 HA ALA A 13 1.438 -9.168 1.356 1.00 64.11 H ATOM 138 HB1 ALA A 13 2.860 -11.084 1.085 1.00 71.13 H ATOM 139 HB2 ALA A 13 3.669 -10.342 -0.297 1.00 32.45 H ATOM 140 HB3 ALA A 13 3.872 -9.658 1.316 1.00 11.01 H ATOM 141 N ALA A 14 2.599 -7.702 -1.323 1.00 64.31 N ATOM 142 CA ALA A 14 3.016 -6.444 -1.915 1.00 3.13 C ATOM 143 C ALA A 14 2.733 -6.531 -3.481 1.00 21.45 C ATOM 144 O ALA A 14 2.102 -5.647 -4.058 1.00 53.41 O ATOM 145 CB ALA A 14 4.454 -6.139 -1.707 1.00 72.51 C ATOM 146 H ALA A 14 2.443 -8.469 -1.913 1.00 72.13 H ATOM 147 HA ALA A 14 2.373 -5.658 -1.567 1.00 3.30 H ATOM 148 HB1 ALA A 14 4.937 -6.964 -1.203 1.00 50.10 H ATOM 149 HB2 ALA A 14 4.894 -6.015 -2.686 1.00 34.34 H ATOM 150 N SER A 15 3.233 -7.591 -4.108 1.00 73.30 N ATOM 151 CA SER A 15 3.067 -7.778 -5.545 1.00 12.52 C ATOM 152 C SER A 15 1.592 -7.932 -5.906 1.00 5.41 C ATOM 153 O SER A 15 0.998 -7.051 -6.528 1.00 42.24 O ATOM 154 CB SER A 15 3.850 -9.005 -6.015 1.00 53.22 C ATOM 155 OG SER A 15 3.486 -10.157 -5.274 1.00 53.34 O ATOM 156 H SER A 15 3.727 -8.263 -3.592 1.00 51.24 H ATOM 157 HA SER A 15 3.457 -6.901 -6.040 1.00 11.21 H ATOM 158 HB2 SER A 15 3.642 -9.183 -7.059 1.00 50.33 H ATOM 159 HB3 SER A 15 4.907 -8.826 -5.884 1.00 1.23 H ATOM 160 HG SER A 15 3.743 -10.042 -4.357 1.00 22.03 H ATOM 161 N CYS A 16 1.008 -9.057 -5.511 1.00 34.43 N ATOM 162 CA CYS A 16 -0.397 -9.330 -5.792 1.00 2.42 C ATOM 163 C CYS A 16 -1.298 -8.656 -4.761 1.00 73.30 C ATOM 164 O CYS A 16 -0.896 -8.435 -3.620 1.00 4.45 O ATOM 165 CB CYS A 16 -0.653 -10.838 -5.802 1.00 53.11 C ATOM 166 SG CYS A 16 0.680 -11.814 -6.570 1.00 12.33 S ATOM 167 H CYS A 16 1.534 -9.722 -5.018 1.00 33.45 H ATOM 168 HA CYS A 16 -0.624 -8.928 -6.767 1.00 61.05 H ATOM 169 HB2 CYS A 16 -0.768 -11.183 -4.785 1.00 4.34 H ATOM 170 HB3 CYS A 16 -1.563 -11.037 -6.348 1.00 55.23 H ATOM 171 N ALA A 17 -2.520 -8.334 -5.173 1.00 11.24 N ATOM 172 CA ALA A 17 -3.480 -7.688 -4.285 1.00 64.23 C ATOM 173 C ALA A 17 -4.644 -8.619 -3.966 1.00 34.02 C ATOM 174 O ALA A 17 -5.686 -8.540 -4.617 1.00 23.25 O ATOM 175 CB ALA A 17 -3.989 -6.397 -4.908 1.00 42.04 C ATOM 176 H ALA A 17 -2.783 -8.536 -6.095 1.00 22.24 H ATOM 177 HA ALA A 17 -2.969 -7.439 -3.366 1.00 42.43 H ATOM 178 HB1 ALA A 17 -3.208 -5.957 -5.511 1.00 42.24 H ATOM 179 HB2 ALA A 17 -4.846 -6.611 -5.529 1.00 51.31 H ATOM 180 HB3 ALA A 17 -4.272 -5.708 -4.127 1.00 52.10 H ATOM 181 N ALA A 18 -4.453 -9.476 -2.981 1.00 25.11 N ATOM 182 CA ALA A 18 -5.459 -10.428 -2.547 1.00 11.13 C ATOM 183 C ALA A 18 -6.458 -9.660 -1.572 1.00 15.32 C ATOM 184 O ALA A 18 -6.110 -9.339 -0.435 1.00 60.25 O ATOM 185 CB ALA A 18 -4.897 -11.597 -1.827 1.00 24.40 C ATOM 186 H ALA A 18 -3.588 -9.465 -2.520 1.00 2.45 H ATOM 187 HA ALA A 18 -6.065 -10.712 -3.386 1.00 41.23 H ATOM 188 HB1 ALA A 18 -4.888 -11.408 -0.763 1.00 53.34 H ATOM 189 HB2 ALA A 18 -5.546 -12.435 -2.033 1.00 31.43 H ATOM 190 N SER A 19 -7.659 -9.377 -2.067 1.00 72.31 N ATOM 191 CA SER A 19 -8.657 -8.655 -1.287 1.00 53.02 C ATOM 192 C SER A 19 -9.809 -9.575 -0.894 1.00 53.30 C ATOM 193 O SER A 19 -10.776 -9.142 -0.268 1.00 62.43 O ATOM 194 CB SER A 19 -9.191 -7.462 -2.082 1.00 41.22 C ATOM 195 OG SER A 19 -10.227 -7.859 -2.963 1.00 54.54 O ATOM 196 H SER A 19 -7.878 -9.659 -2.980 1.00 63.51 H ATOM 197 HA SER A 19 -8.178 -8.293 -0.389 1.00 74.35 H ATOM 198 HB2 SER A 19 -9.579 -6.722 -1.399 1.00 53.10 H ATOM 199 HB3 SER A 19 -8.387 -7.030 -2.661 1.00 73.44 H ATOM 200 HG SER A 19 -10.007 -8.706 -3.356 1.00 31.52 H TER 201 SER A 19