ATOM 1 N ASN A 1 8.171 -12.594 -6.657 1.00 0.00 N ATOM 2 CA ASN A 1 8.651 -11.370 -5.952 1.00 0.00 C ATOM 3 C ASN A 1 7.922 -10.135 -6.488 1.00 0.00 C ATOM 4 O ASN A 1 6.885 -9.748 -5.987 1.00 0.00 O ATOM 5 CB ASN A 1 10.148 -11.276 -6.251 1.00 0.00 C ATOM 6 CG ASN A 1 10.936 -11.946 -5.125 1.00 0.00 C ATOM 7 OD1 ASN A 1 11.788 -11.332 -4.514 1.00 0.00 O ATOM 8 ND2 ASN A 1 10.688 -13.192 -4.823 1.00 0.00 N ATOM 9 H1 ASN A 1 7.228 -12.416 -7.056 1.00 0.00 H ATOM 10 H2 ASN A 1 8.119 -13.383 -5.981 1.00 0.00 H ATOM 11 H3 ASN A 1 8.831 -12.833 -7.423 1.00 0.00 H ATOM 12 HA ASN A 1 8.494 -11.464 -4.889 1.00 0.00 H ATOM 13 HB2 ASN A 1 10.359 -11.773 -7.187 1.00 0.00 H ATOM 14 HB3 ASN A 1 10.437 -10.238 -6.321 1.00 0.00 H ATOM 15 HD21 ASN A 1 10.001 -13.688 -5.316 1.00 0.00 H ATOM 16 HD22 ASN A 1 11.187 -13.630 -4.103 1.00 0.00 H ATOM 17 N GLU A 2 8.456 -9.513 -7.503 1.00 0.00 N ATOM 18 CA GLU A 2 7.794 -8.304 -8.071 1.00 0.00 C ATOM 19 C GLU A 2 6.768 -8.715 -9.131 1.00 0.00 C ATOM 20 O GLU A 2 5.837 -7.991 -9.421 1.00 0.00 O ATOM 21 CB GLU A 2 8.911 -7.475 -8.705 1.00 0.00 C ATOM 22 CG GLU A 2 9.068 -6.160 -7.940 1.00 0.00 C ATOM 23 CD GLU A 2 10.068 -5.261 -8.669 1.00 0.00 C ATOM 24 OE1 GLU A 2 10.420 -5.588 -9.791 1.00 0.00 O ATOM 25 OE2 GLU A 2 10.464 -4.260 -8.095 1.00 0.00 O ATOM 26 H GLU A 2 9.293 -9.842 -7.893 1.00 0.00 H ATOM 27 HA GLU A 2 7.315 -7.737 -7.287 1.00 0.00 H ATOM 28 HB2 GLU A 2 9.838 -8.030 -8.665 1.00 0.00 H ATOM 29 HB3 GLU A 2 8.662 -7.263 -9.733 1.00 0.00 H ATOM 30 HG2 GLU A 2 8.112 -5.662 -7.879 1.00 0.00 H ATOM 31 HG3 GLU A 2 9.433 -6.364 -6.944 1.00 0.00 H ATOM 32 N GLN A 3 6.932 -9.872 -9.710 1.00 0.00 N ATOM 33 CA GLN A 3 5.966 -10.329 -10.750 1.00 0.00 C ATOM 34 C GLN A 3 4.533 -10.200 -10.230 1.00 0.00 C ATOM 35 O GLN A 3 3.587 -10.143 -10.992 1.00 0.00 O ATOM 36 CB GLN A 3 6.305 -11.795 -11.020 1.00 0.00 C ATOM 37 CG GLN A 3 7.687 -11.891 -11.668 1.00 0.00 C ATOM 38 CD GLN A 3 8.546 -12.892 -10.894 1.00 0.00 C ATOM 39 OE1 GLN A 3 8.588 -12.862 -9.679 1.00 0.00 O ATOM 40 NE2 GLN A 3 9.239 -13.783 -11.549 1.00 0.00 N ATOM 41 H GLN A 3 7.690 -10.442 -9.462 1.00 0.00 H ATOM 42 HA GLN A 3 6.090 -9.752 -11.654 1.00 0.00 H ATOM 43 HB2 GLN A 3 6.305 -12.341 -10.087 1.00 0.00 H ATOM 44 HB3 GLN A 3 5.567 -12.219 -11.685 1.00 0.00 H ATOM 45 HG2 GLN A 3 7.582 -12.221 -12.692 1.00 0.00 H ATOM 46 HG3 GLN A 3 8.161 -10.921 -11.649 1.00 0.00 H ATOM 47 HE21 GLN A 3 9.204 -13.806 -12.528 1.00 0.00 H ATOM 48 HE22 GLN A 3 9.792 -14.428 -11.062 1.00 0.00 H ATOM 49 N LEU A 4 4.363 -10.153 -8.937 1.00 0.00 N ATOM 50 CA LEU A 4 2.990 -10.027 -8.369 1.00 0.00 C ATOM 51 C LEU A 4 2.501 -8.581 -8.490 1.00 0.00 C ATOM 52 O LEU A 4 1.328 -8.326 -8.676 1.00 0.00 O ATOM 53 CB LEU A 4 3.109 -10.427 -6.898 1.00 0.00 C ATOM 54 CG LEU A 4 2.997 -11.948 -6.771 1.00 0.00 C ATOM 55 CD1 LEU A 4 3.212 -12.356 -5.313 1.00 0.00 C ATOM 56 CD2 LEU A 4 1.606 -12.395 -7.225 1.00 0.00 C ATOM 57 H LEU A 4 5.138 -10.200 -8.339 1.00 0.00 H ATOM 58 HA LEU A 4 2.313 -10.696 -8.877 1.00 0.00 H ATOM 59 HB2 LEU A 4 4.065 -10.102 -6.513 1.00 0.00 H ATOM 60 HB3 LEU A 4 2.315 -9.962 -6.332 1.00 0.00 H ATOM 61 HG LEU A 4 3.749 -12.416 -7.390 1.00 0.00 H ATOM 62 HD11 LEU A 4 2.255 -12.503 -4.835 1.00 0.00 H ATOM 63 HD12 LEU A 4 3.756 -11.577 -4.798 1.00 0.00 H ATOM 64 HD13 LEU A 4 3.779 -13.275 -5.276 1.00 0.00 H ATOM 65 HD21 LEU A 4 1.659 -12.763 -8.238 1.00 0.00 H ATOM 66 HD22 LEU A 4 0.926 -11.557 -7.181 1.00 0.00 H ATOM 67 HD23 LEU A 4 1.251 -13.180 -6.574 1.00 0.00 H ATOM 68 N ALA A 5 3.392 -7.633 -8.384 1.00 0.00 N ATOM 69 CA ALA A 5 2.977 -6.205 -8.493 1.00 0.00 C ATOM 70 C ALA A 5 2.867 -5.802 -9.966 1.00 0.00 C ATOM 71 O ALA A 5 2.119 -4.912 -10.321 1.00 0.00 O ATOM 72 CB ALA A 5 4.075 -5.397 -7.801 1.00 0.00 C ATOM 73 H ALA A 5 4.333 -7.861 -8.234 1.00 0.00 H ATOM 74 HA ALA A 5 2.036 -6.050 -7.991 1.00 0.00 H ATOM 75 HB1 ALA A 5 4.414 -4.612 -8.461 1.00 0.00 H ATOM 76 HB2 ALA A 5 4.904 -6.049 -7.561 1.00 0.00 H ATOM 77 HB3 ALA A 5 3.685 -4.962 -6.893 1.00 0.00 H ATOM 78 N LYS A 6 3.606 -6.448 -10.825 1.00 0.00 N ATOM 79 CA LYS A 6 3.542 -6.100 -12.274 1.00 0.00 C ATOM 80 C LYS A 6 2.245 -6.635 -12.887 1.00 0.00 C ATOM 81 O LYS A 6 1.449 -5.891 -13.424 1.00 0.00 O ATOM 82 CB LYS A 6 4.754 -6.775 -12.919 1.00 0.00 C ATOM 83 CG LYS A 6 5.994 -5.902 -12.716 1.00 0.00 C ATOM 84 CD LYS A 6 6.888 -5.991 -13.954 1.00 0.00 C ATOM 85 CE LYS A 6 7.590 -7.350 -13.981 1.00 0.00 C ATOM 86 NZ LYS A 6 8.927 -7.128 -13.363 1.00 0.00 N ATOM 87 H LYS A 6 4.203 -7.162 -10.519 1.00 0.00 H ATOM 88 HA LYS A 6 3.605 -5.031 -12.405 1.00 0.00 H ATOM 89 HB2 LYS A 6 4.913 -7.740 -12.461 1.00 0.00 H ATOM 90 HB3 LYS A 6 4.574 -6.902 -13.975 1.00 0.00 H ATOM 91 HG2 LYS A 6 5.689 -4.876 -12.562 1.00 0.00 H ATOM 92 HG3 LYS A 6 6.541 -6.248 -11.853 1.00 0.00 H ATOM 93 HD2 LYS A 6 6.285 -5.877 -14.843 1.00 0.00 H ATOM 94 HD3 LYS A 6 7.629 -5.206 -13.918 1.00 0.00 H ATOM 95 HE2 LYS A 6 7.026 -8.071 -13.406 1.00 0.00 H ATOM 96 HE3 LYS A 6 7.706 -7.691 -14.998 1.00 0.00 H ATOM 97 HZ1 LYS A 6 9.504 -7.987 -13.466 1.00 0.00 H ATOM 98 HZ2 LYS A 6 8.810 -6.907 -12.353 1.00 0.00 H ATOM 99 HZ3 LYS A 6 9.402 -6.336 -13.839 1.00 0.00 H ATOM 100 N GLN A 7 2.027 -7.920 -12.810 1.00 0.00 N ATOM 101 CA GLN A 7 0.783 -8.501 -13.388 1.00 0.00 C ATOM 102 C GLN A 7 -0.439 -7.719 -12.897 1.00 0.00 C ATOM 103 O GLN A 7 -1.468 -7.687 -13.543 1.00 0.00 O ATOM 104 CB GLN A 7 0.725 -9.945 -12.889 1.00 0.00 C ATOM 105 CG GLN A 7 1.672 -10.811 -13.722 1.00 0.00 C ATOM 106 CD GLN A 7 1.574 -12.266 -13.261 1.00 0.00 C ATOM 107 OE1 GLN A 7 2.376 -12.719 -12.468 1.00 0.00 O ATOM 108 NE2 GLN A 7 0.617 -13.021 -13.726 1.00 0.00 N ATOM 109 H GLN A 7 2.683 -8.502 -12.372 1.00 0.00 H ATOM 110 HA GLN A 7 0.829 -8.485 -14.466 1.00 0.00 H ATOM 111 HB2 GLN A 7 1.024 -9.979 -11.851 1.00 0.00 H ATOM 112 HB3 GLN A 7 -0.282 -10.320 -12.987 1.00 0.00 H ATOM 113 HG2 GLN A 7 1.397 -10.744 -14.765 1.00 0.00 H ATOM 114 HG3 GLN A 7 2.686 -10.463 -13.594 1.00 0.00 H ATOM 115 HE21 GLN A 7 -0.030 -12.657 -14.365 1.00 0.00 H ATOM 116 HE22 GLN A 7 0.545 -13.955 -13.436 1.00 0.00 H ATOM 117 N LYS A 8 -0.333 -7.089 -11.760 1.00 0.00 N ATOM 118 CA LYS A 8 -1.489 -6.311 -11.229 1.00 0.00 C ATOM 119 C LYS A 8 -1.532 -4.924 -11.878 1.00 0.00 C ATOM 120 O LYS A 8 -2.545 -4.505 -12.401 1.00 0.00 O ATOM 121 CB LYS A 8 -1.252 -6.185 -9.723 1.00 0.00 C ATOM 122 CG LYS A 8 -2.197 -7.127 -8.976 1.00 0.00 C ATOM 123 CD LYS A 8 -2.005 -8.556 -9.490 1.00 0.00 C ATOM 124 CE LYS A 8 -3.367 -9.244 -9.609 1.00 0.00 C ATOM 125 NZ LYS A 8 -3.143 -10.442 -10.465 1.00 0.00 N ATOM 126 H LYS A 8 0.505 -7.127 -11.254 1.00 0.00 H ATOM 127 HA LYS A 8 -2.412 -6.838 -11.412 1.00 0.00 H ATOM 128 HB2 LYS A 8 -0.228 -6.447 -9.498 1.00 0.00 H ATOM 129 HB3 LYS A 8 -1.440 -5.168 -9.412 1.00 0.00 H ATOM 130 HG2 LYS A 8 -1.979 -7.091 -7.919 1.00 0.00 H ATOM 131 HG3 LYS A 8 -3.219 -6.821 -9.144 1.00 0.00 H ATOM 132 HD2 LYS A 8 -1.528 -8.529 -10.459 1.00 0.00 H ATOM 133 HD3 LYS A 8 -1.386 -9.107 -8.799 1.00 0.00 H ATOM 134 HE2 LYS A 8 -3.721 -9.541 -8.631 1.00 0.00 H ATOM 135 HE3 LYS A 8 -4.079 -8.583 -10.080 1.00 0.00 H ATOM 136 HZ1 LYS A 8 -4.053 -10.781 -10.833 1.00 0.00 H ATOM 137 HZ2 LYS A 8 -2.694 -11.193 -9.898 1.00 0.00 H ATOM 138 HZ3 LYS A 8 -2.521 -10.190 -11.259 1.00 0.00 H ATOM 139 N GLY A 9 -0.439 -4.212 -11.849 1.00 0.00 N ATOM 140 CA GLY A 9 -0.418 -2.855 -12.465 1.00 0.00 C ATOM 141 C GLY A 9 -0.353 -1.795 -11.365 1.00 0.00 C ATOM 142 O GLY A 9 -0.697 -0.648 -11.572 1.00 0.00 O ATOM 143 H GLY A 9 0.368 -4.569 -11.422 1.00 0.00 H ATOM 144 HA2 GLY A 9 0.447 -2.765 -13.106 1.00 0.00 H ATOM 145 HA3 GLY A 9 -1.315 -2.709 -13.046 1.00 0.00 H ATOM 146 N CYS A 10 0.087 -2.167 -10.193 1.00 0.00 N ATOM 147 CA CYS A 10 0.173 -1.179 -9.080 1.00 0.00 C ATOM 148 C CYS A 10 1.329 -0.207 -9.332 1.00 0.00 C ATOM 149 O CYS A 10 1.299 0.931 -8.908 1.00 0.00 O ATOM 150 CB CYS A 10 0.436 -1.995 -7.812 1.00 0.00 C ATOM 151 SG CYS A 10 -0.671 -3.427 -7.771 1.00 0.00 S ATOM 152 H CYS A 10 0.359 -3.097 -10.046 1.00 0.00 H ATOM 153 HA CYS A 10 -0.756 -0.641 -8.985 1.00 0.00 H ATOM 154 HB2 CYS A 10 1.461 -2.333 -7.807 1.00 0.00 H ATOM 155 HB3 CYS A 10 0.256 -1.377 -6.945 1.00 0.00 H ATOM 156 N MET A 11 2.348 -0.647 -10.019 1.00 0.00 N ATOM 157 CA MET A 11 3.505 0.251 -10.297 1.00 0.00 C ATOM 158 C MET A 11 3.034 1.508 -11.032 1.00 0.00 C ATOM 159 O MET A 11 3.734 2.499 -11.098 1.00 0.00 O ATOM 160 CB MET A 11 4.456 -0.557 -11.182 1.00 0.00 C ATOM 161 CG MET A 11 4.844 -1.852 -10.467 1.00 0.00 C ATOM 162 SD MET A 11 6.644 -1.936 -10.303 1.00 0.00 S ATOM 163 CE MET A 11 6.724 -1.634 -8.521 1.00 0.00 C ATOM 164 H MET A 11 2.353 -1.569 -10.351 1.00 0.00 H ATOM 165 HA MET A 11 4.000 0.519 -9.376 1.00 0.00 H ATOM 166 HB2 MET A 11 3.965 -0.793 -12.115 1.00 0.00 H ATOM 167 HB3 MET A 11 5.345 0.023 -11.379 1.00 0.00 H ATOM 168 HG2 MET A 11 4.392 -1.871 -9.486 1.00 0.00 H ATOM 169 HG3 MET A 11 4.494 -2.699 -11.040 1.00 0.00 H ATOM 170 HE1 MET A 11 5.939 -0.946 -8.237 1.00 0.00 H ATOM 171 HE2 MET A 11 7.681 -1.206 -8.269 1.00 0.00 H ATOM 172 HE3 MET A 11 6.599 -2.570 -7.992 1.00 0.00 H ATOM 173 N ALA A 12 1.851 1.477 -11.584 1.00 0.00 N ATOM 174 CA ALA A 12 1.339 2.673 -12.312 1.00 0.00 C ATOM 175 C ALA A 12 1.498 3.923 -11.444 1.00 0.00 C ATOM 176 O ALA A 12 1.638 5.023 -11.940 1.00 0.00 O ATOM 177 CB ALA A 12 -0.141 2.397 -12.580 1.00 0.00 C ATOM 178 H ALA A 12 1.301 0.670 -11.519 1.00 0.00 H ATOM 179 HA ALA A 12 1.864 2.797 -13.245 1.00 0.00 H ATOM 180 HB1 ALA A 12 -0.687 3.328 -12.588 1.00 0.00 H ATOM 181 HB2 ALA A 12 -0.534 1.756 -11.804 1.00 0.00 H ATOM 182 HB3 ALA A 12 -0.248 1.909 -13.538 1.00 0.00 H ATOM 183 N CYS A 13 1.478 3.760 -10.150 1.00 0.00 N ATOM 184 CA CYS A 13 1.629 4.937 -9.246 1.00 0.00 C ATOM 185 C CYS A 13 2.663 4.637 -8.159 1.00 0.00 C ATOM 186 O CYS A 13 3.387 5.508 -7.719 1.00 0.00 O ATOM 187 CB CYS A 13 0.253 5.161 -8.617 1.00 0.00 C ATOM 188 SG CYS A 13 -1.021 5.091 -9.900 1.00 0.00 S ATOM 189 H CYS A 13 1.363 2.864 -9.772 1.00 0.00 H ATOM 190 HA CYS A 13 1.920 5.809 -9.812 1.00 0.00 H ATOM 191 HB2 CYS A 13 0.065 4.392 -7.882 1.00 0.00 H ATOM 192 HB3 CYS A 13 0.230 6.129 -8.138 1.00 0.00 H ATOM 193 N HIS A 14 2.734 3.411 -7.717 1.00 0.00 N ATOM 194 CA HIS A 14 3.716 3.056 -6.654 1.00 0.00 C ATOM 195 C HIS A 14 5.128 2.973 -7.238 1.00 0.00 C ATOM 196 O HIS A 14 5.341 3.195 -8.414 1.00 0.00 O ATOM 197 CB HIS A 14 3.278 1.690 -6.126 1.00 0.00 C ATOM 198 CG HIS A 14 2.027 1.850 -5.309 1.00 0.00 C ATOM 199 ND1 HIS A 14 2.053 2.321 -4.005 1.00 0.00 N ATOM 200 CD2 HIS A 14 0.706 1.613 -5.597 1.00 0.00 C ATOM 201 CE1 HIS A 14 0.784 2.350 -3.561 1.00 0.00 C ATOM 202 NE2 HIS A 14 -0.077 1.929 -4.491 1.00 0.00 N ATOM 203 H HIS A 14 2.138 2.725 -8.082 1.00 0.00 H ATOM 204 HA HIS A 14 3.683 3.783 -5.858 1.00 0.00 H ATOM 205 HB2 HIS A 14 3.085 1.028 -6.957 1.00 0.00 H ATOM 206 HB3 HIS A 14 4.061 1.275 -5.509 1.00 0.00 H ATOM 207 HD1 HIS A 14 2.850 2.582 -3.499 1.00 0.00 H ATOM 208 HD2 HIS A 14 0.333 1.238 -6.538 1.00 0.00 H ATOM 209 HE1 HIS A 14 0.497 2.673 -2.572 1.00 0.00 H ATOM 210 N ASP A 15 6.093 2.654 -6.421 1.00 0.00 N ATOM 211 CA ASP A 15 7.496 2.555 -6.918 1.00 0.00 C ATOM 212 C ASP A 15 8.457 2.431 -5.733 1.00 0.00 C ATOM 213 O ASP A 15 8.458 3.250 -4.838 1.00 0.00 O ATOM 214 CB ASP A 15 7.760 3.851 -7.687 1.00 0.00 C ATOM 215 CG ASP A 15 7.942 3.535 -9.172 1.00 0.00 C ATOM 216 OD1 ASP A 15 8.177 2.381 -9.488 1.00 0.00 O ATOM 217 OD2 ASP A 15 7.843 4.453 -9.969 1.00 0.00 O ATOM 218 H ASP A 15 5.897 2.479 -5.477 1.00 0.00 H ATOM 219 HA ASP A 15 7.601 1.707 -7.577 1.00 0.00 H ATOM 220 HB2 ASP A 15 6.924 4.521 -7.559 1.00 0.00 H ATOM 221 HB3 ASP A 15 8.657 4.317 -7.307 1.00 0.00 H ATOM 222 N LEU A 16 9.270 1.411 -5.719 1.00 0.00 N ATOM 223 CA LEU A 16 10.227 1.236 -4.589 1.00 0.00 C ATOM 224 C LEU A 16 10.855 2.578 -4.213 1.00 0.00 C ATOM 225 O LEU A 16 10.632 3.101 -3.139 1.00 0.00 O ATOM 226 CB LEU A 16 11.308 0.282 -5.098 1.00 0.00 C ATOM 227 CG LEU A 16 10.670 -1.041 -5.522 1.00 0.00 C ATOM 228 CD1 LEU A 16 11.763 -2.088 -5.738 1.00 0.00 C ATOM 229 CD2 LEU A 16 9.714 -1.521 -4.427 1.00 0.00 C ATOM 230 H LEU A 16 9.252 0.759 -6.451 1.00 0.00 H ATOM 231 HA LEU A 16 9.727 0.802 -3.738 1.00 0.00 H ATOM 232 HB2 LEU A 16 11.810 0.731 -5.943 1.00 0.00 H ATOM 233 HB3 LEU A 16 12.024 0.101 -4.311 1.00 0.00 H ATOM 234 HG LEU A 16 10.123 -0.897 -6.443 1.00 0.00 H ATOM 235 HD11 LEU A 16 11.897 -2.661 -4.832 1.00 0.00 H ATOM 236 HD12 LEU A 16 12.689 -1.595 -5.993 1.00 0.00 H ATOM 237 HD13 LEU A 16 11.474 -2.750 -6.542 1.00 0.00 H ATOM 238 HD21 LEU A 16 9.803 -2.592 -4.316 1.00 0.00 H ATOM 239 HD22 LEU A 16 8.699 -1.271 -4.700 1.00 0.00 H ATOM 240 HD23 LEU A 16 9.966 -1.040 -3.493 1.00 0.00 H ATOM 241 N LYS A 17 11.641 3.138 -5.090 1.00 0.00 N ATOM 242 CA LYS A 17 12.286 4.443 -4.783 1.00 0.00 C ATOM 243 C LYS A 17 11.913 5.473 -5.850 1.00 0.00 C ATOM 244 O LYS A 17 12.740 6.236 -6.309 1.00 0.00 O ATOM 245 CB LYS A 17 13.792 4.180 -4.796 1.00 0.00 C ATOM 246 CG LYS A 17 14.477 5.083 -3.768 1.00 0.00 C ATOM 247 CD LYS A 17 15.067 4.224 -2.647 1.00 0.00 C ATOM 248 CE LYS A 17 16.554 3.984 -2.916 1.00 0.00 C ATOM 249 NZ LYS A 17 17.214 3.989 -1.580 1.00 0.00 N ATOM 250 H LYS A 17 11.808 2.698 -5.948 1.00 0.00 H ATOM 251 HA LYS A 17 11.980 4.785 -3.810 1.00 0.00 H ATOM 252 HB2 LYS A 17 13.979 3.146 -4.549 1.00 0.00 H ATOM 253 HB3 LYS A 17 14.186 4.394 -5.778 1.00 0.00 H ATOM 254 HG2 LYS A 17 15.267 5.641 -4.249 1.00 0.00 H ATOM 255 HG3 LYS A 17 13.754 5.768 -3.351 1.00 0.00 H ATOM 256 HD2 LYS A 17 14.949 4.734 -1.702 1.00 0.00 H ATOM 257 HD3 LYS A 17 14.553 3.276 -2.611 1.00 0.00 H ATOM 258 HE2 LYS A 17 16.695 3.028 -3.401 1.00 0.00 H ATOM 259 HE3 LYS A 17 16.956 4.777 -3.527 1.00 0.00 H ATOM 260 HZ1 LYS A 17 17.642 4.920 -1.408 1.00 0.00 H ATOM 261 HZ2 LYS A 17 17.952 3.256 -1.556 1.00 0.00 H ATOM 262 HZ3 LYS A 17 16.507 3.795 -0.844 1.00 0.00 H ATOM 263 N ALA A 18 10.673 5.500 -6.246 1.00 0.00 N ATOM 264 CA ALA A 18 10.239 6.479 -7.284 1.00 0.00 C ATOM 265 C ALA A 18 8.789 6.898 -7.035 1.00 0.00 C ATOM 266 O ALA A 18 7.980 6.943 -7.940 1.00 0.00 O ATOM 267 CB ALA A 18 10.358 5.749 -8.621 1.00 0.00 C ATOM 268 H ALA A 18 10.024 4.874 -5.860 1.00 0.00 H ATOM 269 HA ALA A 18 10.885 7.342 -7.278 1.00 0.00 H ATOM 270 HB1 ALA A 18 11.383 5.781 -8.957 1.00 0.00 H ATOM 271 HB2 ALA A 18 9.723 6.229 -9.350 1.00 0.00 H ATOM 272 HB3 ALA A 18 10.051 4.721 -8.497 1.00 0.00 H ATOM 273 N LYS A 19 8.457 7.202 -5.812 1.00 0.00 N ATOM 274 CA LYS A 19 7.060 7.618 -5.497 1.00 0.00 C ATOM 275 C LYS A 19 6.538 8.576 -6.572 1.00 0.00 C ATOM 276 O LYS A 19 6.750 9.769 -6.509 1.00 0.00 O ATOM 277 CB LYS A 19 7.133 8.328 -4.144 1.00 0.00 C ATOM 278 CG LYS A 19 8.009 9.576 -4.268 1.00 0.00 C ATOM 279 CD LYS A 19 8.629 9.903 -2.909 1.00 0.00 C ATOM 280 CE LYS A 19 8.794 11.419 -2.774 1.00 0.00 C ATOM 281 NZ LYS A 19 9.814 11.622 -1.707 1.00 0.00 N ATOM 282 H LYS A 19 9.128 7.156 -5.100 1.00 0.00 H ATOM 283 HA LYS A 19 6.420 6.753 -5.423 1.00 0.00 H ATOM 284 HB2 LYS A 19 6.138 8.614 -3.834 1.00 0.00 H ATOM 285 HB3 LYS A 19 7.561 7.661 -3.410 1.00 0.00 H ATOM 286 HG2 LYS A 19 8.793 9.394 -4.989 1.00 0.00 H ATOM 287 HG3 LYS A 19 7.405 10.409 -4.596 1.00 0.00 H ATOM 288 HD2 LYS A 19 7.984 9.538 -2.122 1.00 0.00 H ATOM 289 HD3 LYS A 19 9.596 9.430 -2.831 1.00 0.00 H ATOM 290 HE2 LYS A 19 9.137 11.840 -3.708 1.00 0.00 H ATOM 291 HE3 LYS A 19 7.858 11.871 -2.479 1.00 0.00 H ATOM 292 HZ1 LYS A 19 9.339 11.742 -0.791 1.00 0.00 H ATOM 293 HZ2 LYS A 19 10.374 12.472 -1.923 1.00 0.00 H ATOM 294 HZ3 LYS A 19 10.441 10.794 -1.665 1.00 0.00 H ATOM 295 N LYS A 20 5.855 8.059 -7.557 1.00 0.00 N ATOM 296 CA LYS A 20 5.317 8.941 -8.632 1.00 0.00 C ATOM 297 C LYS A 20 3.917 9.430 -8.256 1.00 0.00 C ATOM 298 O LYS A 20 3.755 10.458 -7.630 1.00 0.00 O ATOM 299 CB LYS A 20 5.259 8.075 -9.892 1.00 0.00 C ATOM 300 CG LYS A 20 4.394 8.765 -10.947 1.00 0.00 C ATOM 301 CD LYS A 20 5.115 8.737 -12.297 1.00 0.00 C ATOM 302 CE LYS A 20 5.570 10.151 -12.663 1.00 0.00 C ATOM 303 NZ LYS A 20 4.780 10.532 -13.867 1.00 0.00 N ATOM 304 H LYS A 20 5.693 7.094 -7.589 1.00 0.00 H ATOM 305 HA LYS A 20 5.976 9.780 -8.794 1.00 0.00 H ATOM 306 HB2 LYS A 20 6.258 7.934 -10.279 1.00 0.00 H ATOM 307 HB3 LYS A 20 4.829 7.114 -9.648 1.00 0.00 H ATOM 308 HG2 LYS A 20 3.449 8.249 -11.033 1.00 0.00 H ATOM 309 HG3 LYS A 20 4.220 9.790 -10.656 1.00 0.00 H ATOM 310 HD2 LYS A 20 5.975 8.086 -12.231 1.00 0.00 H ATOM 311 HD3 LYS A 20 4.442 8.369 -13.057 1.00 0.00 H ATOM 312 HE2 LYS A 20 5.363 10.831 -11.848 1.00 0.00 H ATOM 313 HE3 LYS A 20 6.623 10.156 -12.897 1.00 0.00 H ATOM 314 HZ1 LYS A 20 3.771 10.358 -13.689 1.00 0.00 H ATOM 315 HZ2 LYS A 20 5.093 9.963 -14.680 1.00 0.00 H ATOM 316 HZ3 LYS A 20 4.924 11.540 -14.071 1.00 0.00 H ATOM 317 N VAL A 21 2.903 8.697 -8.628 1.00 0.00 N ATOM 318 CA VAL A 21 1.515 9.120 -8.287 1.00 0.00 C ATOM 319 C VAL A 21 1.180 8.699 -6.854 1.00 0.00 C ATOM 320 O VAL A 21 0.424 9.353 -6.163 1.00 0.00 O ATOM 321 CB VAL A 21 0.603 8.398 -9.281 1.00 0.00 C ATOM 322 CG1 VAL A 21 -0.844 8.461 -8.788 1.00 0.00 C ATOM 323 CG2 VAL A 21 0.704 9.077 -10.648 1.00 0.00 C ATOM 324 H VAL A 21 3.054 7.870 -9.130 1.00 0.00 H ATOM 325 HA VAL A 21 1.409 10.188 -8.399 1.00 0.00 H ATOM 326 HB VAL A 21 0.910 7.366 -9.366 1.00 0.00 H ATOM 327 HG11 VAL A 21 -1.489 7.973 -9.503 1.00 0.00 H ATOM 328 HG12 VAL A 21 -1.142 9.493 -8.679 1.00 0.00 H ATOM 329 HG13 VAL A 21 -0.921 7.961 -7.833 1.00 0.00 H ATOM 330 HG21 VAL A 21 0.539 8.346 -11.426 1.00 0.00 H ATOM 331 HG22 VAL A 21 1.686 9.510 -10.765 1.00 0.00 H ATOM 332 HG23 VAL A 21 -0.043 9.854 -10.721 1.00 0.00 H ATOM 333 N GLY A 22 1.740 7.611 -6.402 1.00 0.00 N ATOM 334 CA GLY A 22 1.458 7.147 -5.013 1.00 0.00 C ATOM 335 C GLY A 22 2.775 7.018 -4.241 1.00 0.00 C ATOM 336 O GLY A 22 3.840 7.105 -4.817 1.00 0.00 O ATOM 337 H GLY A 22 2.349 7.098 -6.975 1.00 0.00 H ATOM 338 HA2 GLY A 22 0.818 7.863 -4.519 1.00 0.00 H ATOM 339 HA3 GLY A 22 0.968 6.186 -5.046 1.00 0.00 H ATOM 340 N PRO A 23 2.657 6.811 -2.955 1.00 0.00 N ATOM 341 CA PRO A 23 3.833 6.662 -2.052 1.00 0.00 C ATOM 342 C PRO A 23 4.672 5.451 -2.469 1.00 0.00 C ATOM 343 O PRO A 23 4.168 4.354 -2.610 1.00 0.00 O ATOM 344 CB PRO A 23 3.226 6.445 -0.665 1.00 0.00 C ATOM 345 CG PRO A 23 1.700 6.472 -0.794 1.00 0.00 C ATOM 346 CD PRO A 23 1.342 6.706 -2.263 1.00 0.00 C ATOM 347 HA PRO A 23 4.431 7.558 -2.057 1.00 0.00 H ATOM 348 HB2 PRO A 23 3.543 5.488 -0.276 1.00 0.00 H ATOM 349 HB3 PRO A 23 3.545 7.232 -0.001 1.00 0.00 H ATOM 350 HG2 PRO A 23 1.291 5.527 -0.465 1.00 0.00 H ATOM 351 HG3 PRO A 23 1.298 7.273 -0.193 1.00 0.00 H ATOM 352 HD2 PRO A 23 0.774 5.871 -2.649 1.00 0.00 H ATOM 353 HD3 PRO A 23 0.789 7.626 -2.376 1.00 0.00 H ATOM 354 N ALA A 24 5.949 5.639 -2.664 1.00 0.00 N ATOM 355 CA ALA A 24 6.816 4.495 -3.070 1.00 0.00 C ATOM 356 C ALA A 24 6.600 3.314 -2.121 1.00 0.00 C ATOM 357 O ALA A 24 6.582 3.469 -0.916 1.00 0.00 O ATOM 358 CB ALA A 24 8.255 5.002 -2.970 1.00 0.00 C ATOM 359 H ALA A 24 6.338 6.530 -2.545 1.00 0.00 H ATOM 360 HA ALA A 24 6.599 4.203 -4.085 1.00 0.00 H ATOM 361 HB1 ALA A 24 8.653 5.156 -3.963 1.00 0.00 H ATOM 362 HB2 ALA A 24 8.859 4.272 -2.449 1.00 0.00 H ATOM 363 HB3 ALA A 24 8.272 5.935 -2.427 1.00 0.00 H ATOM 364 N TYR A 25 6.433 2.134 -2.653 1.00 0.00 N ATOM 365 CA TYR A 25 6.217 0.946 -1.780 1.00 0.00 C ATOM 366 C TYR A 25 7.280 0.901 -0.680 1.00 0.00 C ATOM 367 O TYR A 25 7.031 0.448 0.420 1.00 0.00 O ATOM 368 CB TYR A 25 6.341 -0.272 -2.695 1.00 0.00 C ATOM 369 CG TYR A 25 5.004 -0.558 -3.335 1.00 0.00 C ATOM 370 CD1 TYR A 25 3.840 -0.554 -2.557 1.00 0.00 C ATOM 371 CD2 TYR A 25 4.927 -0.829 -4.707 1.00 0.00 C ATOM 372 CE1 TYR A 25 2.600 -0.819 -3.150 1.00 0.00 C ATOM 373 CE2 TYR A 25 3.688 -1.094 -5.300 1.00 0.00 C ATOM 374 CZ TYR A 25 2.524 -1.089 -4.521 1.00 0.00 C ATOM 375 OH TYR A 25 1.302 -1.351 -5.106 1.00 0.00 O ATOM 376 H TYR A 25 6.450 2.029 -3.628 1.00 0.00 H ATOM 377 HA TYR A 25 5.229 0.977 -1.345 1.00 0.00 H ATOM 378 HB2 TYR A 25 7.074 -0.071 -3.463 1.00 0.00 H ATOM 379 HB3 TYR A 25 6.653 -1.128 -2.116 1.00 0.00 H ATOM 380 HD1 TYR A 25 3.898 -0.344 -1.498 1.00 0.00 H ATOM 381 HD2 TYR A 25 5.825 -0.832 -5.307 1.00 0.00 H ATOM 382 HE1 TYR A 25 1.703 -0.815 -2.550 1.00 0.00 H ATOM 383 HE2 TYR A 25 3.629 -1.303 -6.358 1.00 0.00 H ATOM 384 HH TYR A 25 0.989 -2.196 -4.775 1.00 0.00 H ATOM 385 N ALA A 26 8.464 1.369 -0.967 1.00 0.00 N ATOM 386 CA ALA A 26 9.540 1.355 0.064 1.00 0.00 C ATOM 387 C ALA A 26 9.238 2.391 1.150 1.00 0.00 C ATOM 388 O ALA A 26 9.340 2.117 2.330 1.00 0.00 O ATOM 389 CB ALA A 26 10.830 1.718 -0.673 1.00 0.00 C ATOM 390 H ALA A 26 8.645 1.732 -1.860 1.00 0.00 H ATOM 391 HA ALA A 26 9.630 0.371 0.499 1.00 0.00 H ATOM 392 HB1 ALA A 26 11.674 1.285 -0.155 1.00 0.00 H ATOM 393 HB2 ALA A 26 10.937 2.792 -0.702 1.00 0.00 H ATOM 394 HB3 ALA A 26 10.789 1.332 -1.681 1.00 0.00 H ATOM 395 N ASP A 27 8.863 3.579 0.761 1.00 0.00 N ATOM 396 CA ASP A 27 8.552 4.631 1.769 1.00 0.00 C ATOM 397 C ASP A 27 7.396 4.174 2.662 1.00 0.00 C ATOM 398 O ASP A 27 7.434 4.319 3.868 1.00 0.00 O ATOM 399 CB ASP A 27 8.151 5.871 0.969 1.00 0.00 C ATOM 400 CG ASP A 27 9.359 6.796 0.819 1.00 0.00 C ATOM 401 OD1 ASP A 27 10.266 6.689 1.629 1.00 0.00 O ATOM 402 OD2 ASP A 27 9.358 7.597 -0.102 1.00 0.00 O ATOM 403 H ASP A 27 8.786 3.779 -0.196 1.00 0.00 H ATOM 404 HA ASP A 27 9.424 4.846 2.367 1.00 0.00 H ATOM 405 HB2 ASP A 27 7.802 5.571 -0.009 1.00 0.00 H ATOM 406 HB3 ASP A 27 7.362 6.393 1.488 1.00 0.00 H ATOM 407 N VAL A 28 6.366 3.624 2.079 1.00 0.00 N ATOM 408 CA VAL A 28 5.210 3.158 2.893 1.00 0.00 C ATOM 409 C VAL A 28 5.680 2.137 3.931 1.00 0.00 C ATOM 410 O VAL A 28 5.318 2.202 5.089 1.00 0.00 O ATOM 411 CB VAL A 28 4.240 2.506 1.907 1.00 0.00 C ATOM 412 CG1 VAL A 28 3.206 1.680 2.675 1.00 0.00 C ATOM 413 CG2 VAL A 28 3.526 3.593 1.102 1.00 0.00 C ATOM 414 H VAL A 28 6.355 3.515 1.106 1.00 0.00 H ATOM 415 HA VAL A 28 4.734 3.994 3.378 1.00 0.00 H ATOM 416 HB VAL A 28 4.789 1.860 1.236 1.00 0.00 H ATOM 417 HG11 VAL A 28 3.585 0.681 2.828 1.00 0.00 H ATOM 418 HG12 VAL A 28 2.288 1.637 2.109 1.00 0.00 H ATOM 419 HG13 VAL A 28 3.016 2.143 3.633 1.00 0.00 H ATOM 420 HG21 VAL A 28 3.667 4.549 1.583 1.00 0.00 H ATOM 421 HG22 VAL A 28 2.471 3.368 1.049 1.00 0.00 H ATOM 422 HG23 VAL A 28 3.936 3.629 0.103 1.00 0.00 H ATOM 423 N ALA A 29 6.487 1.195 3.524 1.00 0.00 N ATOM 424 CA ALA A 29 6.982 0.171 4.488 1.00 0.00 C ATOM 425 C ALA A 29 7.602 0.859 5.705 1.00 0.00 C ATOM 426 O ALA A 29 7.245 0.586 6.834 1.00 0.00 O ATOM 427 CB ALA A 29 8.041 -0.634 3.734 1.00 0.00 C ATOM 428 H ALA A 29 6.767 1.161 2.586 1.00 0.00 H ATOM 429 HA ALA A 29 6.176 -0.476 4.793 1.00 0.00 H ATOM 430 HB1 ALA A 29 8.371 -1.459 4.349 1.00 0.00 H ATOM 431 HB2 ALA A 29 8.882 0.004 3.505 1.00 0.00 H ATOM 432 HB3 ALA A 29 7.618 -1.015 2.816 1.00 0.00 H ATOM 433 N LYS A 30 8.528 1.753 5.486 1.00 0.00 N ATOM 434 CA LYS A 30 9.167 2.459 6.633 1.00 0.00 C ATOM 435 C LYS A 30 8.096 3.125 7.499 1.00 0.00 C ATOM 436 O LYS A 30 8.118 3.035 8.711 1.00 0.00 O ATOM 437 CB LYS A 30 10.084 3.515 6.015 1.00 0.00 C ATOM 438 CG LYS A 30 11.024 4.067 7.088 1.00 0.00 C ATOM 439 CD LYS A 30 11.589 5.412 6.630 1.00 0.00 C ATOM 440 CE LYS A 30 12.586 5.186 5.490 1.00 0.00 C ATOM 441 NZ LYS A 30 12.619 6.463 4.723 1.00 0.00 N ATOM 442 H LYS A 30 8.801 1.960 4.568 1.00 0.00 H ATOM 443 HA LYS A 30 9.748 1.766 7.222 1.00 0.00 H ATOM 444 HB2 LYS A 30 10.666 3.067 5.221 1.00 0.00 H ATOM 445 HB3 LYS A 30 9.487 4.320 5.613 1.00 0.00 H ATOM 446 HG2 LYS A 30 10.477 4.200 8.010 1.00 0.00 H ATOM 447 HG3 LYS A 30 11.836 3.374 7.248 1.00 0.00 H ATOM 448 HD2 LYS A 30 10.782 6.042 6.284 1.00 0.00 H ATOM 449 HD3 LYS A 30 12.093 5.891 7.455 1.00 0.00 H ATOM 450 HE2 LYS A 30 13.565 4.963 5.891 1.00 0.00 H ATOM 451 HE3 LYS A 30 12.249 4.383 4.853 1.00 0.00 H ATOM 452 HZ1 LYS A 30 13.047 7.208 5.307 1.00 0.00 H ATOM 453 HZ2 LYS A 30 11.648 6.737 4.465 1.00 0.00 H ATOM 454 HZ3 LYS A 30 13.185 6.334 3.860 1.00 0.00 H ATOM 455 N LYS A 31 7.156 3.791 6.886 1.00 0.00 N ATOM 456 CA LYS A 31 6.083 4.461 7.674 1.00 0.00 C ATOM 457 C LYS A 31 5.365 3.438 8.558 1.00 0.00 C ATOM 458 O LYS A 31 4.932 3.744 9.652 1.00 0.00 O ATOM 459 CB LYS A 31 5.115 5.048 6.646 1.00 0.00 C ATOM 460 CG LYS A 31 4.746 6.476 7.048 1.00 0.00 C ATOM 461 CD LYS A 31 3.252 6.547 7.367 1.00 0.00 C ATOM 462 CE LYS A 31 2.587 7.598 6.475 1.00 0.00 C ATOM 463 NZ LYS A 31 1.754 8.434 7.385 1.00 0.00 N ATOM 464 H LYS A 31 7.155 3.852 5.909 1.00 0.00 H ATOM 465 HA LYS A 31 6.500 5.250 8.277 1.00 0.00 H ATOM 466 HB2 LYS A 31 5.585 5.057 5.673 1.00 0.00 H ATOM 467 HB3 LYS A 31 4.220 4.444 6.607 1.00 0.00 H ATOM 468 HG2 LYS A 31 5.316 6.762 7.921 1.00 0.00 H ATOM 469 HG3 LYS A 31 4.970 7.149 6.235 1.00 0.00 H ATOM 470 HD2 LYS A 31 2.799 5.583 7.188 1.00 0.00 H ATOM 471 HD3 LYS A 31 3.117 6.821 8.404 1.00 0.00 H ATOM 472 HE2 LYS A 31 3.340 8.206 5.992 1.00 0.00 H ATOM 473 HE3 LYS A 31 1.961 7.120 5.738 1.00 0.00 H ATOM 474 HZ1 LYS A 31 1.243 7.819 8.049 1.00 0.00 H ATOM 475 HZ2 LYS A 31 1.070 8.981 6.822 1.00 0.00 H ATOM 476 HZ3 LYS A 31 2.366 9.083 7.918 1.00 0.00 H ATOM 477 N TYR A 32 5.236 2.225 8.093 1.00 0.00 N ATOM 478 CA TYR A 32 4.546 1.185 8.908 1.00 0.00 C ATOM 479 C TYR A 32 5.576 0.247 9.545 1.00 0.00 C ATOM 480 O TYR A 32 5.233 -0.664 10.273 1.00 0.00 O ATOM 481 CB TYR A 32 3.657 0.413 7.932 1.00 0.00 C ATOM 482 CG TYR A 32 2.466 1.263 7.555 1.00 0.00 C ATOM 483 CD1 TYR A 32 2.626 2.339 6.674 1.00 0.00 C ATOM 484 CD2 TYR A 32 1.204 0.974 8.085 1.00 0.00 C ATOM 485 CE1 TYR A 32 1.524 3.126 6.323 1.00 0.00 C ATOM 486 CE2 TYR A 32 0.101 1.762 7.736 1.00 0.00 C ATOM 487 CZ TYR A 32 0.261 2.838 6.855 1.00 0.00 C ATOM 488 OH TYR A 32 -0.827 3.614 6.509 1.00 0.00 O ATOM 489 H TYR A 32 5.592 1.999 7.209 1.00 0.00 H ATOM 490 HA TYR A 32 3.939 1.647 9.671 1.00 0.00 H ATOM 491 HB2 TYR A 32 4.222 0.170 7.045 1.00 0.00 H ATOM 492 HB3 TYR A 32 3.313 -0.497 8.401 1.00 0.00 H ATOM 493 HD1 TYR A 32 3.601 2.562 6.264 1.00 0.00 H ATOM 494 HD2 TYR A 32 1.080 0.144 8.765 1.00 0.00 H ATOM 495 HE1 TYR A 32 1.647 3.957 5.644 1.00 0.00 H ATOM 496 HE2 TYR A 32 -0.873 1.539 8.145 1.00 0.00 H ATOM 497 HH TYR A 32 -1.009 4.211 7.239 1.00 0.00 H ATOM 498 N ALA A 33 6.835 0.463 9.278 1.00 0.00 N ATOM 499 CA ALA A 33 7.884 -0.416 9.869 1.00 0.00 C ATOM 500 C ALA A 33 7.813 -0.363 11.396 1.00 0.00 C ATOM 501 O ALA A 33 8.143 -1.314 12.077 1.00 0.00 O ATOM 502 CB ALA A 33 9.220 0.139 9.377 1.00 0.00 C ATOM 503 H ALA A 33 7.091 1.203 8.689 1.00 0.00 H ATOM 504 HA ALA A 33 7.758 -1.431 9.524 1.00 0.00 H ATOM 505 HB1 ALA A 33 9.418 1.083 9.863 1.00 0.00 H ATOM 506 HB2 ALA A 33 9.178 0.287 8.309 1.00 0.00 H ATOM 507 HB3 ALA A 33 10.009 -0.560 9.613 1.00 0.00 H ATOM 508 N GLY A 34 7.387 0.743 11.942 1.00 0.00 N ATOM 509 CA GLY A 34 7.295 0.856 13.425 1.00 0.00 C ATOM 510 C GLY A 34 5.942 0.321 13.896 1.00 0.00 C ATOM 511 O GLY A 34 5.524 0.557 15.011 1.00 0.00 O ATOM 512 H GLY A 34 7.126 1.499 11.376 1.00 0.00 H ATOM 513 HA2 GLY A 34 8.090 0.279 13.879 1.00 0.00 H ATOM 514 HA3 GLY A 34 7.390 1.890 13.715 1.00 0.00 H ATOM 515 N ARG A 35 5.253 -0.399 13.052 1.00 0.00 N ATOM 516 CA ARG A 35 3.926 -0.948 13.452 1.00 0.00 C ATOM 517 C ARG A 35 3.896 -2.463 13.229 1.00 0.00 C ATOM 518 O ARG A 35 4.601 -2.991 12.393 1.00 0.00 O ATOM 519 CB ARG A 35 2.901 -0.259 12.551 1.00 0.00 C ATOM 520 CG ARG A 35 1.489 -0.575 13.047 1.00 0.00 C ATOM 521 CD ARG A 35 0.508 0.464 12.497 1.00 0.00 C ATOM 522 NE ARG A 35 -0.192 1.029 13.684 1.00 0.00 N ATOM 523 CZ ARG A 35 -0.943 2.090 13.559 1.00 0.00 C ATOM 524 NH1 ARG A 35 -1.084 2.661 12.393 1.00 0.00 N ATOM 525 NH2 ARG A 35 -1.555 2.580 14.602 1.00 0.00 N ATOM 526 H ARG A 35 5.608 -0.578 12.157 1.00 0.00 H ATOM 527 HA ARG A 35 3.721 -0.718 14.485 1.00 0.00 H ATOM 528 HB2 ARG A 35 3.061 0.810 12.576 1.00 0.00 H ATOM 529 HB3 ARG A 35 3.013 -0.616 11.538 1.00 0.00 H ATOM 530 HG2 ARG A 35 1.200 -1.559 12.707 1.00 0.00 H ATOM 531 HG3 ARG A 35 1.471 -0.547 14.127 1.00 0.00 H ATOM 532 HD2 ARG A 35 1.046 1.241 11.972 1.00 0.00 H ATOM 533 HD3 ARG A 35 -0.204 -0.009 11.839 1.00 0.00 H ATOM 534 HE ARG A 35 -0.088 0.603 14.560 1.00 0.00 H ATOM 535 HH11 ARG A 35 -0.618 2.287 11.592 1.00 0.00 H ATOM 536 HH12 ARG A 35 -1.660 3.473 12.302 1.00 0.00 H ATOM 537 HH21 ARG A 35 -1.447 2.144 15.496 1.00 0.00 H ATOM 538 HH22 ARG A 35 -2.130 3.392 14.508 1.00 0.00 H ATOM 539 N LYS A 36 3.083 -3.165 13.972 1.00 0.00 N ATOM 540 CA LYS A 36 3.010 -4.644 13.802 1.00 0.00 C ATOM 541 C LYS A 36 1.699 -5.028 13.110 1.00 0.00 C ATOM 542 O LYS A 36 1.575 -6.095 12.540 1.00 0.00 O ATOM 543 CB LYS A 36 3.057 -5.229 15.214 1.00 0.00 C ATOM 544 CG LYS A 36 3.938 -6.480 15.220 1.00 0.00 C ATOM 545 CD LYS A 36 3.335 -7.525 16.162 1.00 0.00 C ATOM 546 CE LYS A 36 4.062 -7.478 17.508 1.00 0.00 C ATOM 547 NZ LYS A 36 4.900 -8.707 17.558 1.00 0.00 N ATOM 548 H LYS A 36 2.523 -2.720 14.641 1.00 0.00 H ATOM 549 HA LYS A 36 3.852 -4.999 13.230 1.00 0.00 H ATOM 550 HB2 LYS A 36 3.467 -4.496 15.894 1.00 0.00 H ATOM 551 HB3 LYS A 36 2.058 -5.493 15.528 1.00 0.00 H ATOM 552 HG2 LYS A 36 3.993 -6.885 14.219 1.00 0.00 H ATOM 553 HG3 LYS A 36 4.929 -6.221 15.560 1.00 0.00 H ATOM 554 HD2 LYS A 36 2.287 -7.314 16.310 1.00 0.00 H ATOM 555 HD3 LYS A 36 3.448 -8.507 15.729 1.00 0.00 H ATOM 556 HE2 LYS A 36 4.683 -6.595 17.565 1.00 0.00 H ATOM 557 HE3 LYS A 36 3.348 -7.486 18.318 1.00 0.00 H ATOM 558 HZ1 LYS A 36 4.357 -9.481 17.988 1.00 0.00 H ATOM 559 HZ2 LYS A 36 5.752 -8.521 18.129 1.00 0.00 H ATOM 560 HZ3 LYS A 36 5.180 -8.976 16.595 1.00 0.00 H ATOM 561 N ASP A 37 0.718 -4.168 13.155 1.00 0.00 N ATOM 562 CA ASP A 37 -0.582 -4.485 12.500 1.00 0.00 C ATOM 563 C ASP A 37 -0.635 -3.858 11.104 1.00 0.00 C ATOM 564 O ASP A 37 -1.682 -3.759 10.497 1.00 0.00 O ATOM 565 CB ASP A 37 -1.661 -3.875 13.396 1.00 0.00 C ATOM 566 CG ASP A 37 -1.919 -4.802 14.585 1.00 0.00 C ATOM 567 OD1 ASP A 37 -1.367 -5.890 14.595 1.00 0.00 O ATOM 568 OD2 ASP A 37 -2.667 -4.410 15.467 1.00 0.00 O ATOM 569 H ASP A 37 0.839 -3.313 13.619 1.00 0.00 H ATOM 570 HA ASP A 37 -0.718 -5.553 12.436 1.00 0.00 H ATOM 571 HB2 ASP A 37 -1.328 -2.912 13.756 1.00 0.00 H ATOM 572 HB3 ASP A 37 -2.573 -3.754 12.832 1.00 0.00 H ATOM 573 N ALA A 38 0.488 -3.433 10.592 1.00 0.00 N ATOM 574 CA ALA A 38 0.502 -2.814 9.235 1.00 0.00 C ATOM 575 C ALA A 38 -0.022 -3.809 8.198 1.00 0.00 C ATOM 576 O ALA A 38 -0.468 -3.431 7.131 1.00 0.00 O ATOM 577 CB ALA A 38 1.963 -2.468 8.950 1.00 0.00 C ATOM 578 H ALA A 38 1.322 -3.522 11.098 1.00 0.00 H ATOM 579 HA ALA A 38 -0.096 -1.916 9.229 1.00 0.00 H ATOM 580 HB1 ALA A 38 2.554 -3.372 8.948 1.00 0.00 H ATOM 581 HB2 ALA A 38 2.331 -1.798 9.714 1.00 0.00 H ATOM 582 HB3 ALA A 38 2.038 -1.987 7.985 1.00 0.00 H ATOM 583 N VAL A 39 0.027 -5.077 8.500 1.00 0.00 N ATOM 584 CA VAL A 39 -0.468 -6.095 7.529 1.00 0.00 C ATOM 585 C VAL A 39 -1.990 -5.992 7.393 1.00 0.00 C ATOM 586 O VAL A 39 -2.514 -5.804 6.313 1.00 0.00 O ATOM 587 CB VAL A 39 -0.078 -7.452 8.113 1.00 0.00 C ATOM 588 CG1 VAL A 39 -0.198 -8.528 7.030 1.00 0.00 C ATOM 589 CG2 VAL A 39 1.367 -7.394 8.613 1.00 0.00 C ATOM 590 H VAL A 39 0.390 -5.361 9.364 1.00 0.00 H ATOM 591 HA VAL A 39 0.003 -5.958 6.569 1.00 0.00 H ATOM 592 HB VAL A 39 -0.737 -7.695 8.934 1.00 0.00 H ATOM 593 HG11 VAL A 39 0.480 -9.339 7.252 1.00 0.00 H ATOM 594 HG12 VAL A 39 0.054 -8.101 6.071 1.00 0.00 H ATOM 595 HG13 VAL A 39 -1.210 -8.901 7.005 1.00 0.00 H ATOM 596 HG21 VAL A 39 1.825 -6.474 8.283 1.00 0.00 H ATOM 597 HG22 VAL A 39 1.920 -8.234 8.218 1.00 0.00 H ATOM 598 HG23 VAL A 39 1.376 -7.434 9.693 1.00 0.00 H ATOM 599 N ASP A 40 -2.703 -6.114 8.479 1.00 0.00 N ATOM 600 CA ASP A 40 -4.189 -6.023 8.410 1.00 0.00 C ATOM 601 C ASP A 40 -4.606 -4.674 7.821 1.00 0.00 C ATOM 602 O ASP A 40 -5.365 -4.607 6.874 1.00 0.00 O ATOM 603 CB ASP A 40 -4.683 -6.149 9.852 1.00 0.00 C ATOM 604 CG ASP A 40 -5.810 -7.181 9.919 1.00 0.00 C ATOM 605 OD1 ASP A 40 -6.488 -7.354 8.920 1.00 0.00 O ATOM 606 OD2 ASP A 40 -5.975 -7.782 10.968 1.00 0.00 O ATOM 607 H ASP A 40 -2.260 -6.266 9.340 1.00 0.00 H ATOM 608 HA ASP A 40 -4.586 -6.831 7.814 1.00 0.00 H ATOM 609 HB2 ASP A 40 -3.865 -6.465 10.485 1.00 0.00 H ATOM 610 HB3 ASP A 40 -5.051 -5.193 10.190 1.00 0.00 H ATOM 611 N TYR A 41 -4.116 -3.598 8.373 1.00 0.00 N ATOM 612 CA TYR A 41 -4.484 -2.254 7.843 1.00 0.00 C ATOM 613 C TYR A 41 -4.246 -2.202 6.332 1.00 0.00 C ATOM 614 O TYR A 41 -5.167 -2.047 5.554 1.00 0.00 O ATOM 615 CB TYR A 41 -3.571 -1.258 8.559 1.00 0.00 C ATOM 616 CG TYR A 41 -4.177 0.122 8.490 1.00 0.00 C ATOM 617 CD1 TYR A 41 -4.042 0.889 7.327 1.00 0.00 C ATOM 618 CD2 TYR A 41 -4.874 0.636 9.590 1.00 0.00 C ATOM 619 CE1 TYR A 41 -4.605 2.169 7.264 1.00 0.00 C ATOM 620 CE2 TYR A 41 -5.437 1.916 9.527 1.00 0.00 C ATOM 621 CZ TYR A 41 -5.303 2.683 8.363 1.00 0.00 C ATOM 622 OH TYR A 41 -5.858 3.944 8.301 1.00 0.00 O ATOM 623 H TYR A 41 -3.504 -3.673 9.135 1.00 0.00 H ATOM 624 HA TYR A 41 -5.516 -2.033 8.068 1.00 0.00 H ATOM 625 HB2 TYR A 41 -3.458 -1.552 9.593 1.00 0.00 H ATOM 626 HB3 TYR A 41 -2.602 -1.249 8.080 1.00 0.00 H ATOM 627 HD1 TYR A 41 -3.505 0.493 6.479 1.00 0.00 H ATOM 628 HD2 TYR A 41 -4.978 0.044 10.488 1.00 0.00 H ATOM 629 HE1 TYR A 41 -4.502 2.761 6.366 1.00 0.00 H ATOM 630 HE2 TYR A 41 -5.975 2.313 10.376 1.00 0.00 H ATOM 631 HH TYR A 41 -6.812 3.847 8.259 1.00 0.00 H ATOM 632 N LEU A 42 -3.018 -2.330 5.910 1.00 0.00 N ATOM 633 CA LEU A 42 -2.724 -2.289 4.449 1.00 0.00 C ATOM 634 C LEU A 42 -3.759 -3.111 3.681 1.00 0.00 C ATOM 635 O LEU A 42 -4.629 -2.575 3.024 1.00 0.00 O ATOM 636 CB LEU A 42 -1.331 -2.902 4.287 1.00 0.00 C ATOM 637 CG LEU A 42 -0.278 -1.924 4.812 1.00 0.00 C ATOM 638 CD1 LEU A 42 1.086 -2.614 4.852 1.00 0.00 C ATOM 639 CD2 LEU A 42 -0.206 -0.709 3.884 1.00 0.00 C ATOM 640 H LEU A 42 -2.289 -2.454 6.554 1.00 0.00 H ATOM 641 HA LEU A 42 -2.719 -1.272 4.097 1.00 0.00 H ATOM 642 HB2 LEU A 42 -1.277 -3.825 4.847 1.00 0.00 H ATOM 643 HB3 LEU A 42 -1.144 -3.102 3.243 1.00 0.00 H ATOM 644 HG LEU A 42 -0.549 -1.603 5.807 1.00 0.00 H ATOM 645 HD11 LEU A 42 1.247 -3.038 5.832 1.00 0.00 H ATOM 646 HD12 LEU A 42 1.861 -1.893 4.640 1.00 0.00 H ATOM 647 HD13 LEU A 42 1.114 -3.401 4.112 1.00 0.00 H ATOM 648 HD21 LEU A 42 -0.129 0.192 4.475 1.00 0.00 H ATOM 649 HD22 LEU A 42 -1.097 -0.666 3.276 1.00 0.00 H ATOM 650 HD23 LEU A 42 0.661 -0.794 3.246 1.00 0.00 H ATOM 651 N ALA A 43 -3.669 -4.407 3.759 1.00 0.00 N ATOM 652 CA ALA A 43 -4.646 -5.271 3.034 1.00 0.00 C ATOM 653 C ALA A 43 -6.061 -4.707 3.189 1.00 0.00 C ATOM 654 O ALA A 43 -6.833 -4.676 2.252 1.00 0.00 O ATOM 655 CB ALA A 43 -4.549 -6.649 3.688 1.00 0.00 C ATOM 656 H ALA A 43 -2.958 -4.814 4.295 1.00 0.00 H ATOM 657 HA ALA A 43 -4.382 -5.339 1.992 1.00 0.00 H ATOM 658 HB1 ALA A 43 -3.574 -7.072 3.494 1.00 0.00 H ATOM 659 HB2 ALA A 43 -5.310 -7.296 3.277 1.00 0.00 H ATOM 660 HB3 ALA A 43 -4.693 -6.554 4.754 1.00 0.00 H ATOM 661 N GLY A 44 -6.406 -4.261 4.366 1.00 0.00 N ATOM 662 CA GLY A 44 -7.771 -3.699 4.578 1.00 0.00 C ATOM 663 C GLY A 44 -8.010 -2.552 3.596 1.00 0.00 C ATOM 664 O GLY A 44 -9.079 -2.412 3.038 1.00 0.00 O ATOM 665 H GLY A 44 -5.769 -4.293 5.109 1.00 0.00 H ATOM 666 HA2 GLY A 44 -8.506 -4.474 4.416 1.00 0.00 H ATOM 667 HA3 GLY A 44 -7.854 -3.328 5.588 1.00 0.00 H ATOM 668 N LYS A 45 -7.020 -1.729 3.378 1.00 0.00 N ATOM 669 CA LYS A 45 -7.191 -0.591 2.430 1.00 0.00 C ATOM 670 C LYS A 45 -6.867 -1.042 1.004 1.00 0.00 C ATOM 671 O LYS A 45 -7.169 -0.363 0.043 1.00 0.00 O ATOM 672 CB LYS A 45 -6.204 0.484 2.887 1.00 0.00 C ATOM 673 CG LYS A 45 -6.678 1.854 2.397 1.00 0.00 C ATOM 674 CD LYS A 45 -7.192 2.671 3.584 1.00 0.00 C ATOM 675 CE LYS A 45 -8.354 3.556 3.130 1.00 0.00 C ATOM 676 NZ LYS A 45 -7.754 4.592 2.245 1.00 0.00 N ATOM 677 H LYS A 45 -6.163 -1.860 3.837 1.00 0.00 H ATOM 678 HA LYS A 45 -8.199 -0.210 2.482 1.00 0.00 H ATOM 679 HB2 LYS A 45 -6.148 0.486 3.965 1.00 0.00 H ATOM 680 HB3 LYS A 45 -5.229 0.275 2.475 1.00 0.00 H ATOM 681 HG2 LYS A 45 -5.854 2.374 1.930 1.00 0.00 H ATOM 682 HG3 LYS A 45 -7.475 1.725 1.680 1.00 0.00 H ATOM 683 HD2 LYS A 45 -7.528 2.002 4.363 1.00 0.00 H ATOM 684 HD3 LYS A 45 -6.395 3.294 3.964 1.00 0.00 H ATOM 685 HE2 LYS A 45 -9.079 2.967 2.584 1.00 0.00 H ATOM 686 HE3 LYS A 45 -8.821 4.026 3.983 1.00 0.00 H ATOM 687 HZ1 LYS A 45 -6.869 4.230 1.837 1.00 0.00 H ATOM 688 HZ2 LYS A 45 -7.556 5.450 2.799 1.00 0.00 H ATOM 689 HZ3 LYS A 45 -8.418 4.819 1.477 1.00 0.00 H ATOM 690 N ILE A 46 -6.253 -2.185 0.859 1.00 0.00 N ATOM 691 CA ILE A 46 -5.911 -2.680 -0.506 1.00 0.00 C ATOM 692 C ILE A 46 -7.187 -3.065 -1.259 1.00 0.00 C ATOM 693 O ILE A 46 -7.376 -2.707 -2.405 1.00 0.00 O ATOM 694 CB ILE A 46 -5.025 -3.908 -0.295 1.00 0.00 C ATOM 695 CG1 ILE A 46 -3.626 -3.460 0.131 1.00 0.00 C ATOM 696 CG2 ILE A 46 -4.928 -4.701 -1.600 1.00 0.00 C ATOM 697 CD1 ILE A 46 -2.763 -4.688 0.428 1.00 0.00 C ATOM 698 H ILE A 46 -6.018 -2.719 1.646 1.00 0.00 H ATOM 699 HA ILE A 46 -5.367 -1.925 -1.052 1.00 0.00 H ATOM 700 HB ILE A 46 -5.455 -4.534 0.474 1.00 0.00 H ATOM 701 HG12 ILE A 46 -3.174 -2.886 -0.665 1.00 0.00 H ATOM 702 HG13 ILE A 46 -3.697 -2.850 1.020 1.00 0.00 H ATOM 703 HG21 ILE A 46 -5.840 -5.263 -1.748 1.00 0.00 H ATOM 704 HG22 ILE A 46 -4.091 -5.380 -1.547 1.00 0.00 H ATOM 705 HG23 ILE A 46 -4.788 -4.019 -2.425 1.00 0.00 H ATOM 706 HD11 ILE A 46 -1.799 -4.575 -0.047 1.00 0.00 H ATOM 707 HD12 ILE A 46 -3.251 -5.571 0.045 1.00 0.00 H ATOM 708 HD13 ILE A 46 -2.629 -4.784 1.495 1.00 0.00 H ATOM 709 N LYS A 47 -8.064 -3.793 -0.623 1.00 0.00 N ATOM 710 CA LYS A 47 -9.327 -4.201 -1.303 1.00 0.00 C ATOM 711 C LYS A 47 -10.362 -3.077 -1.207 1.00 0.00 C ATOM 712 O LYS A 47 -11.375 -3.094 -1.877 1.00 0.00 O ATOM 713 CB LYS A 47 -9.820 -5.442 -0.558 1.00 0.00 C ATOM 714 CG LYS A 47 -10.973 -6.080 -1.334 1.00 0.00 C ATOM 715 CD LYS A 47 -12.137 -6.360 -0.382 1.00 0.00 C ATOM 716 CE LYS A 47 -11.722 -7.429 0.632 1.00 0.00 C ATOM 717 NZ LYS A 47 -12.438 -7.091 1.893 1.00 0.00 N ATOM 718 H LYS A 47 -7.893 -4.072 0.300 1.00 0.00 H ATOM 719 HA LYS A 47 -9.134 -4.445 -2.336 1.00 0.00 H ATOM 720 HB2 LYS A 47 -9.010 -6.151 -0.465 1.00 0.00 H ATOM 721 HB3 LYS A 47 -10.164 -5.158 0.426 1.00 0.00 H ATOM 722 HG2 LYS A 47 -11.298 -5.407 -2.113 1.00 0.00 H ATOM 723 HG3 LYS A 47 -10.640 -7.008 -1.774 1.00 0.00 H ATOM 724 HD2 LYS A 47 -12.401 -5.451 0.140 1.00 0.00 H ATOM 725 HD3 LYS A 47 -12.987 -6.712 -0.946 1.00 0.00 H ATOM 726 HE2 LYS A 47 -12.020 -8.408 0.282 1.00 0.00 H ATOM 727 HE3 LYS A 47 -10.656 -7.398 0.794 1.00 0.00 H ATOM 728 HZ1 LYS A 47 -11.847 -6.457 2.467 1.00 0.00 H ATOM 729 HZ2 LYS A 47 -12.632 -7.964 2.426 1.00 0.00 H ATOM 730 HZ3 LYS A 47 -13.335 -6.616 1.667 1.00 0.00 H ATOM 731 N LYS A 48 -10.114 -2.100 -0.380 1.00 0.00 N ATOM 732 CA LYS A 48 -11.083 -0.976 -0.240 1.00 0.00 C ATOM 733 C LYS A 48 -10.658 0.198 -1.127 1.00 0.00 C ATOM 734 O LYS A 48 -11.478 0.879 -1.708 1.00 0.00 O ATOM 735 CB LYS A 48 -11.044 -0.570 1.233 1.00 0.00 C ATOM 736 CG LYS A 48 -12.287 0.255 1.570 1.00 0.00 C ATOM 737 CD LYS A 48 -12.554 0.185 3.075 1.00 0.00 C ATOM 738 CE LYS A 48 -14.063 0.155 3.326 1.00 0.00 C ATOM 739 NZ LYS A 48 -14.343 1.288 4.250 1.00 0.00 N ATOM 740 H LYS A 48 -9.290 -2.105 0.152 1.00 0.00 H ATOM 741 HA LYS A 48 -12.076 -1.303 -0.505 1.00 0.00 H ATOM 742 HB2 LYS A 48 -11.021 -1.458 1.850 1.00 0.00 H ATOM 743 HB3 LYS A 48 -10.161 0.022 1.421 1.00 0.00 H ATOM 744 HG2 LYS A 48 -12.126 1.283 1.278 1.00 0.00 H ATOM 745 HG3 LYS A 48 -13.138 -0.142 1.037 1.00 0.00 H ATOM 746 HD2 LYS A 48 -12.102 -0.709 3.480 1.00 0.00 H ATOM 747 HD3 LYS A 48 -12.129 1.054 3.556 1.00 0.00 H ATOM 748 HE2 LYS A 48 -14.598 0.289 2.395 1.00 0.00 H ATOM 749 HE3 LYS A 48 -14.347 -0.777 3.789 1.00 0.00 H ATOM 750 HZ1 LYS A 48 -13.663 1.272 5.036 1.00 0.00 H ATOM 751 HZ2 LYS A 48 -15.310 1.198 4.625 1.00 0.00 H ATOM 752 HZ3 LYS A 48 -14.253 2.187 3.736 1.00 0.00 H ATOM 753 N GLY A 49 -9.379 0.439 -1.234 1.00 0.00 N ATOM 754 CA GLY A 49 -8.902 1.568 -2.083 1.00 0.00 C ATOM 755 C GLY A 49 -9.237 2.896 -1.402 1.00 0.00 C ATOM 756 O GLY A 49 -9.507 2.947 -0.218 1.00 0.00 O ATOM 757 H GLY A 49 -8.733 -0.122 -0.757 1.00 0.00 H ATOM 758 HA2 GLY A 49 -7.833 1.489 -2.217 1.00 0.00 H ATOM 759 HA3 GLY A 49 -9.391 1.528 -3.044 1.00 0.00 H ATOM 760 N GLY A 50 -9.222 3.972 -2.140 1.00 0.00 N ATOM 761 CA GLY A 50 -9.539 5.296 -1.533 1.00 0.00 C ATOM 762 C GLY A 50 -8.241 6.001 -1.135 1.00 0.00 C ATOM 763 O GLY A 50 -7.250 5.939 -1.835 1.00 0.00 O ATOM 764 H GLY A 50 -9.001 3.910 -3.093 1.00 0.00 H ATOM 765 HA2 GLY A 50 -10.074 5.901 -2.252 1.00 0.00 H ATOM 766 HA3 GLY A 50 -10.151 5.153 -0.656 1.00 0.00 H ATOM 767 N SER A 51 -8.238 6.671 -0.015 1.00 0.00 N ATOM 768 CA SER A 51 -7.003 7.379 0.428 1.00 0.00 C ATOM 769 C SER A 51 -7.318 8.289 1.619 1.00 0.00 C ATOM 770 O SER A 51 -8.423 8.307 2.122 1.00 0.00 O ATOM 771 CB SER A 51 -6.546 8.211 -0.770 1.00 0.00 C ATOM 772 OG SER A 51 -7.684 8.730 -1.443 1.00 0.00 O ATOM 773 H SER A 51 -9.048 6.708 0.535 1.00 0.00 H ATOM 774 HA SER A 51 -6.240 6.666 0.694 1.00 0.00 H ATOM 775 HB2 SER A 51 -5.930 9.027 -0.430 1.00 0.00 H ATOM 776 HB3 SER A 51 -5.971 7.586 -1.441 1.00 0.00 H ATOM 777 HG SER A 51 -7.676 9.687 -1.345 1.00 0.00 H ATOM 778 N GLY A 52 -6.354 9.043 2.071 1.00 0.00 N ATOM 779 CA GLY A 52 -6.600 9.951 3.228 1.00 0.00 C ATOM 780 C GLY A 52 -5.400 9.907 4.175 1.00 0.00 C ATOM 781 O GLY A 52 -5.270 10.723 5.067 1.00 0.00 O ATOM 782 H GLY A 52 -5.470 9.014 1.650 1.00 0.00 H ATOM 783 HA2 GLY A 52 -6.741 10.960 2.869 1.00 0.00 H ATOM 784 HA3 GLY A 52 -7.483 9.629 3.757 1.00 0.00 H ATOM 785 N VAL A 53 -4.520 8.962 3.990 1.00 0.00 N ATOM 786 CA VAL A 53 -3.328 8.867 4.881 1.00 0.00 C ATOM 787 C VAL A 53 -2.080 9.362 4.145 1.00 0.00 C ATOM 788 O VAL A 53 -1.111 9.772 4.752 1.00 0.00 O ATOM 789 CB VAL A 53 -3.186 7.387 5.234 1.00 0.00 C ATOM 790 CG1 VAL A 53 -1.930 7.181 6.082 1.00 0.00 C ATOM 791 CG2 VAL A 53 -4.415 6.932 6.025 1.00 0.00 C ATOM 792 H VAL A 53 -4.642 8.314 3.266 1.00 0.00 H ATOM 793 HA VAL A 53 -3.486 9.445 5.780 1.00 0.00 H ATOM 794 HB VAL A 53 -3.106 6.807 4.325 1.00 0.00 H ATOM 795 HG11 VAL A 53 -1.398 6.308 5.732 1.00 0.00 H ATOM 796 HG12 VAL A 53 -2.213 7.040 7.115 1.00 0.00 H ATOM 797 HG13 VAL A 53 -1.293 8.049 5.999 1.00 0.00 H ATOM 798 HG21 VAL A 53 -4.124 6.695 7.037 1.00 0.00 H ATOM 799 HG22 VAL A 53 -4.839 6.055 5.558 1.00 0.00 H ATOM 800 HG23 VAL A 53 -5.149 7.724 6.036 1.00 0.00 H ATOM 801 N TRP A 54 -2.097 9.325 2.841 1.00 0.00 N ATOM 802 CA TRP A 54 -0.911 9.793 2.067 1.00 0.00 C ATOM 803 C TRP A 54 -1.256 11.072 1.300 1.00 0.00 C ATOM 804 O TRP A 54 -0.393 11.864 0.975 1.00 0.00 O ATOM 805 CB TRP A 54 -0.575 8.663 1.095 1.00 0.00 C ATOM 806 CG TRP A 54 0.055 7.531 1.843 1.00 0.00 C ATOM 807 CD1 TRP A 54 -0.594 6.421 2.262 1.00 0.00 C ATOM 808 CD2 TRP A 54 1.441 7.381 2.265 1.00 0.00 C ATOM 809 NE1 TRP A 54 0.307 5.599 2.917 1.00 0.00 N ATOM 810 CE2 TRP A 54 1.574 6.147 2.944 1.00 0.00 C ATOM 811 CE3 TRP A 54 2.585 8.188 2.128 1.00 0.00 C ATOM 812 CZ2 TRP A 54 2.797 5.727 3.468 1.00 0.00 C ATOM 813 CZ3 TRP A 54 3.818 7.769 2.653 1.00 0.00 C ATOM 814 CH2 TRP A 54 3.924 6.541 3.322 1.00 0.00 C ATOM 815 H TRP A 54 -2.888 8.991 2.370 1.00 0.00 H ATOM 816 HA TRP A 54 -0.078 9.968 2.729 1.00 0.00 H ATOM 817 HB2 TRP A 54 -1.481 8.317 0.616 1.00 0.00 H ATOM 818 HB3 TRP A 54 0.112 9.025 0.345 1.00 0.00 H ATOM 819 HD1 TRP A 54 -1.642 6.211 2.113 1.00 0.00 H ATOM 820 HE1 TRP A 54 0.091 4.730 3.317 1.00 0.00 H ATOM 821 HE3 TRP A 54 2.515 9.135 1.614 1.00 0.00 H ATOM 822 HZ2 TRP A 54 2.873 4.781 3.982 1.00 0.00 H ATOM 823 HZ3 TRP A 54 4.690 8.396 2.541 1.00 0.00 H ATOM 824 HH2 TRP A 54 4.876 6.225 3.723 1.00 0.00 H ATOM 825 N GLY A 55 -2.510 11.279 1.007 1.00 0.00 N ATOM 826 CA GLY A 55 -2.909 12.506 0.259 1.00 0.00 C ATOM 827 C GLY A 55 -4.370 12.387 -0.176 1.00 0.00 C ATOM 828 O GLY A 55 -5.144 11.654 0.406 1.00 0.00 O ATOM 829 H GLY A 55 -3.191 10.628 1.277 1.00 0.00 H ATOM 830 HA2 GLY A 55 -2.790 13.369 0.899 1.00 0.00 H ATOM 831 HA3 GLY A 55 -2.284 12.615 -0.614 1.00 0.00 H ATOM 832 N SER A 56 -4.755 13.105 -1.196 1.00 0.00 N ATOM 833 CA SER A 56 -6.168 13.033 -1.668 1.00 0.00 C ATOM 834 C SER A 56 -6.233 12.326 -3.025 1.00 0.00 C ATOM 835 O SER A 56 -6.769 12.848 -3.982 1.00 0.00 O ATOM 836 CB SER A 56 -6.638 14.480 -1.799 1.00 0.00 C ATOM 837 OG SER A 56 -8.053 14.505 -1.924 1.00 0.00 O ATOM 838 H SER A 56 -4.115 13.691 -1.652 1.00 0.00 H ATOM 839 HA SER A 56 -6.776 12.513 -0.946 1.00 0.00 H ATOM 840 HB2 SER A 56 -6.349 15.036 -0.923 1.00 0.00 H ATOM 841 HB3 SER A 56 -6.180 14.928 -2.673 1.00 0.00 H ATOM 842 HG SER A 56 -8.288 15.237 -2.500 1.00 0.00 H ATOM 843 N VAL A 57 -5.693 11.141 -3.114 1.00 0.00 N ATOM 844 CA VAL A 57 -5.725 10.403 -4.409 1.00 0.00 C ATOM 845 C VAL A 57 -6.465 9.072 -4.237 1.00 0.00 C ATOM 846 O VAL A 57 -5.888 8.095 -3.803 1.00 0.00 O ATOM 847 CB VAL A 57 -4.264 10.152 -4.782 1.00 0.00 C ATOM 848 CG1 VAL A 57 -4.187 9.608 -6.209 1.00 0.00 C ATOM 849 CG2 VAL A 57 -3.484 11.467 -4.696 1.00 0.00 C ATOM 850 H VAL A 57 -5.265 10.738 -2.330 1.00 0.00 H ATOM 851 HA VAL A 57 -6.200 11.002 -5.170 1.00 0.00 H ATOM 852 HB VAL A 57 -3.836 9.433 -4.098 1.00 0.00 H ATOM 853 HG11 VAL A 57 -4.721 10.268 -6.876 1.00 0.00 H ATOM 854 HG12 VAL A 57 -4.631 8.624 -6.243 1.00 0.00 H ATOM 855 HG13 VAL A 57 -3.153 9.547 -6.516 1.00 0.00 H ATOM 856 HG21 VAL A 57 -3.323 11.724 -3.660 1.00 0.00 H ATOM 857 HG22 VAL A 57 -4.049 12.253 -5.178 1.00 0.00 H ATOM 858 HG23 VAL A 57 -2.531 11.353 -5.192 1.00 0.00 H ATOM 859 N PRO A 58 -7.727 9.078 -4.584 1.00 0.00 N ATOM 860 CA PRO A 58 -8.596 7.873 -4.482 1.00 0.00 C ATOM 861 C PRO A 58 -8.043 6.743 -5.355 1.00 0.00 C ATOM 862 O PRO A 58 -8.398 6.605 -6.508 1.00 0.00 O ATOM 863 CB PRO A 58 -9.959 8.336 -4.998 1.00 0.00 C ATOM 864 CG PRO A 58 -9.851 9.812 -5.393 1.00 0.00 C ATOM 865 CD PRO A 58 -8.422 10.284 -5.115 1.00 0.00 C ATOM 866 HA PRO A 58 -8.680 7.552 -3.456 1.00 0.00 H ATOM 867 HB2 PRO A 58 -10.240 7.747 -5.860 1.00 0.00 H ATOM 868 HB3 PRO A 58 -10.700 8.223 -4.223 1.00 0.00 H ATOM 869 HG2 PRO A 58 -10.076 9.925 -6.444 1.00 0.00 H ATOM 870 HG3 PRO A 58 -10.544 10.397 -4.806 1.00 0.00 H ATOM 871 HD2 PRO A 58 -7.953 10.622 -6.029 1.00 0.00 H ATOM 872 HD3 PRO A 58 -8.420 11.069 -4.374 1.00 0.00 H ATOM 873 N MET A 59 -7.174 5.933 -4.813 1.00 0.00 N ATOM 874 CA MET A 59 -6.598 4.813 -5.611 1.00 0.00 C ATOM 875 C MET A 59 -7.719 3.878 -6.082 1.00 0.00 C ATOM 876 O MET A 59 -8.637 3.595 -5.340 1.00 0.00 O ATOM 877 CB MET A 59 -5.648 4.079 -4.664 1.00 0.00 C ATOM 878 CG MET A 59 -5.263 2.724 -5.263 1.00 0.00 C ATOM 879 SD MET A 59 -4.365 1.757 -4.023 1.00 0.00 S ATOM 880 CE MET A 59 -4.958 0.125 -4.530 1.00 0.00 C ATOM 881 H MET A 59 -6.899 6.062 -3.880 1.00 0.00 H ATOM 882 HA MET A 59 -6.050 5.202 -6.453 1.00 0.00 H ATOM 883 HB2 MET A 59 -4.760 4.673 -4.517 1.00 0.00 H ATOM 884 HB3 MET A 59 -6.137 3.923 -3.714 1.00 0.00 H ATOM 885 HG2 MET A 59 -6.157 2.193 -5.557 1.00 0.00 H ATOM 886 HG3 MET A 59 -4.635 2.877 -6.127 1.00 0.00 H ATOM 887 HE1 MET A 59 -4.705 -0.042 -5.568 1.00 0.00 H ATOM 888 HE2 MET A 59 -6.027 0.076 -4.410 1.00 0.00 H ATOM 889 HE3 MET A 59 -4.492 -0.632 -3.913 1.00 0.00 H ATOM 890 N PRO A 60 -7.610 3.428 -7.307 1.00 0.00 N ATOM 891 CA PRO A 60 -8.616 2.513 -7.921 1.00 0.00 C ATOM 892 C PRO A 60 -8.661 1.183 -7.159 1.00 0.00 C ATOM 893 O PRO A 60 -7.645 0.702 -6.696 1.00 0.00 O ATOM 894 CB PRO A 60 -8.115 2.296 -9.349 1.00 0.00 C ATOM 895 CG PRO A 60 -6.821 3.092 -9.536 1.00 0.00 C ATOM 896 CD PRO A 60 -6.480 3.780 -8.212 1.00 0.00 C ATOM 897 HA PRO A 60 -9.587 2.978 -7.936 1.00 0.00 H ATOM 898 HB2 PRO A 60 -7.925 1.245 -9.512 1.00 0.00 H ATOM 899 HB3 PRO A 60 -8.857 2.645 -10.052 1.00 0.00 H ATOM 900 HG2 PRO A 60 -6.021 2.423 -9.817 1.00 0.00 H ATOM 901 HG3 PRO A 60 -6.959 3.838 -10.304 1.00 0.00 H ATOM 902 HD2 PRO A 60 -5.547 3.399 -7.820 1.00 0.00 H ATOM 903 HD3 PRO A 60 -6.430 4.849 -8.342 1.00 0.00 H ATOM 904 N PRO A 61 -9.842 0.629 -7.054 1.00 0.00 N ATOM 905 CA PRO A 61 -10.064 -0.665 -6.350 1.00 0.00 C ATOM 906 C PRO A 61 -9.300 -1.788 -7.057 1.00 0.00 C ATOM 907 O PRO A 61 -8.850 -1.635 -8.175 1.00 0.00 O ATOM 908 CB PRO A 61 -11.572 -0.900 -6.442 1.00 0.00 C ATOM 909 CG PRO A 61 -12.199 0.270 -7.205 1.00 0.00 C ATOM 910 CD PRO A 61 -11.081 1.228 -7.624 1.00 0.00 C ATOM 911 HA PRO A 61 -9.763 -0.592 -5.317 1.00 0.00 H ATOM 912 HB2 PRO A 61 -11.764 -1.824 -6.968 1.00 0.00 H ATOM 913 HB3 PRO A 61 -11.994 -0.950 -5.451 1.00 0.00 H ATOM 914 HG2 PRO A 61 -12.710 -0.100 -8.082 1.00 0.00 H ATOM 915 HG3 PRO A 61 -12.896 0.789 -6.567 1.00 0.00 H ATOM 916 HD2 PRO A 61 -11.016 1.282 -8.703 1.00 0.00 H ATOM 917 HD3 PRO A 61 -11.245 2.208 -7.205 1.00 0.00 H ATOM 918 N GLN A 62 -9.149 -2.914 -6.415 1.00 0.00 N ATOM 919 CA GLN A 62 -8.414 -4.041 -7.056 1.00 0.00 C ATOM 920 C GLN A 62 -9.156 -5.358 -6.817 1.00 0.00 C ATOM 921 O GLN A 62 -10.021 -5.450 -5.968 1.00 0.00 O ATOM 922 CB GLN A 62 -7.040 -4.075 -6.387 1.00 0.00 C ATOM 923 CG GLN A 62 -6.481 -2.653 -6.299 1.00 0.00 C ATOM 924 CD GLN A 62 -6.355 -2.067 -7.707 1.00 0.00 C ATOM 925 OE1 GLN A 62 -6.588 -2.750 -8.685 1.00 0.00 O ATOM 926 NE2 GLN A 62 -5.995 -0.821 -7.853 1.00 0.00 N ATOM 927 H GLN A 62 -9.519 -3.019 -5.514 1.00 0.00 H ATOM 928 HA GLN A 62 -8.303 -3.862 -8.114 1.00 0.00 H ATOM 929 HB2 GLN A 62 -7.134 -4.488 -5.393 1.00 0.00 H ATOM 930 HB3 GLN A 62 -6.370 -4.688 -6.971 1.00 0.00 H ATOM 931 HG2 GLN A 62 -7.149 -2.041 -5.711 1.00 0.00 H ATOM 932 HG3 GLN A 62 -5.508 -2.677 -5.834 1.00 0.00 H ATOM 933 HE21 GLN A 62 -5.808 -0.270 -7.064 1.00 0.00 H ATOM 934 HE22 GLN A 62 -5.912 -0.437 -8.750 1.00 0.00 H ATOM 935 N ASN A 63 -8.824 -6.380 -7.557 1.00 0.00 N ATOM 936 CA ASN A 63 -9.510 -7.690 -7.373 1.00 0.00 C ATOM 937 C ASN A 63 -8.588 -8.665 -6.637 1.00 0.00 C ATOM 938 O ASN A 63 -8.216 -9.698 -7.160 1.00 0.00 O ATOM 939 CB ASN A 63 -9.814 -8.205 -8.780 1.00 0.00 C ATOM 940 CG ASN A 63 -11.320 -8.122 -9.041 1.00 0.00 C ATOM 941 OD1 ASN A 63 -11.806 -7.131 -9.548 1.00 0.00 O ATOM 942 ND2 ASN A 63 -12.083 -9.128 -8.713 1.00 0.00 N ATOM 943 H ASN A 63 -8.124 -6.284 -8.236 1.00 0.00 H ATOM 944 HA ASN A 63 -10.429 -7.558 -6.824 1.00 0.00 H ATOM 945 HB2 ASN A 63 -9.288 -7.600 -9.506 1.00 0.00 H ATOM 946 HB3 ASN A 63 -9.492 -9.231 -8.866 1.00 0.00 H ATOM 947 HD21 ASN A 63 -11.690 -9.928 -8.304 1.00 0.00 H ATOM 948 HD22 ASN A 63 -13.048 -9.086 -8.876 1.00 0.00 H ATOM 949 N VAL A 64 -8.216 -8.346 -5.429 1.00 0.00 N ATOM 950 CA VAL A 64 -7.318 -9.255 -4.660 1.00 0.00 C ATOM 951 C VAL A 64 -8.056 -9.821 -3.446 1.00 0.00 C ATOM 952 O VAL A 64 -9.003 -9.239 -2.954 1.00 0.00 O ATOM 953 CB VAL A 64 -6.137 -8.394 -4.210 1.00 0.00 C ATOM 954 CG1 VAL A 64 -5.192 -8.162 -5.391 1.00 0.00 C ATOM 955 CG2 VAL A 64 -6.652 -7.047 -3.699 1.00 0.00 C ATOM 956 H VAL A 64 -8.527 -7.509 -5.025 1.00 0.00 H ATOM 957 HA VAL A 64 -6.967 -10.057 -5.292 1.00 0.00 H ATOM 958 HB VAL A 64 -5.604 -8.902 -3.418 1.00 0.00 H ATOM 959 HG11 VAL A 64 -4.737 -7.187 -5.302 1.00 0.00 H ATOM 960 HG12 VAL A 64 -5.751 -8.217 -6.314 1.00 0.00 H ATOM 961 HG13 VAL A 64 -4.423 -8.920 -5.391 1.00 0.00 H ATOM 962 HG21 VAL A 64 -6.866 -6.401 -4.538 1.00 0.00 H ATOM 963 HG22 VAL A 64 -5.901 -6.587 -3.074 1.00 0.00 H ATOM 964 HG23 VAL A 64 -7.554 -7.201 -3.125 1.00 0.00 H ATOM 965 N THR A 65 -7.629 -10.953 -2.956 1.00 0.00 N ATOM 966 CA THR A 65 -8.305 -11.555 -1.771 1.00 0.00 C ATOM 967 C THR A 65 -7.457 -11.333 -0.517 1.00 0.00 C ATOM 968 O THR A 65 -6.317 -10.921 -0.592 1.00 0.00 O ATOM 969 CB THR A 65 -8.425 -13.050 -2.075 1.00 0.00 C ATOM 970 OG1 THR A 65 -7.256 -13.488 -2.753 1.00 0.00 O ATOM 971 CG2 THR A 65 -9.651 -13.297 -2.955 1.00 0.00 C ATOM 972 H THR A 65 -6.862 -11.406 -3.366 1.00 0.00 H ATOM 973 HA THR A 65 -9.286 -11.126 -1.642 1.00 0.00 H ATOM 974 HB THR A 65 -8.534 -13.598 -1.152 1.00 0.00 H ATOM 975 HG1 THR A 65 -7.448 -14.340 -3.154 1.00 0.00 H ATOM 976 HG21 THR A 65 -10.335 -12.467 -2.860 1.00 0.00 H ATOM 977 HG22 THR A 65 -10.142 -14.207 -2.642 1.00 0.00 H ATOM 978 HG23 THR A 65 -9.342 -13.392 -3.986 1.00 0.00 H ATOM 979 N ASP A 66 -8.004 -11.603 0.637 1.00 0.00 N ATOM 980 CA ASP A 66 -7.225 -11.406 1.893 1.00 0.00 C ATOM 981 C ASP A 66 -5.801 -11.936 1.715 1.00 0.00 C ATOM 982 O ASP A 66 -4.837 -11.215 1.869 1.00 0.00 O ATOM 983 CB ASP A 66 -7.961 -12.203 2.970 1.00 0.00 C ATOM 984 CG ASP A 66 -7.509 -11.732 4.353 1.00 0.00 C ATOM 985 OD1 ASP A 66 -6.354 -11.360 4.483 1.00 0.00 O ATOM 986 OD2 ASP A 66 -8.326 -11.750 5.260 1.00 0.00 O ATOM 987 H ASP A 66 -8.925 -11.935 0.677 1.00 0.00 H ATOM 988 HA ASP A 66 -7.205 -10.361 2.159 1.00 0.00 H ATOM 989 HB2 ASP A 66 -9.026 -12.052 2.867 1.00 0.00 H ATOM 990 HB3 ASP A 66 -7.735 -13.253 2.859 1.00 0.00 H ATOM 991 N ALA A 67 -5.661 -13.192 1.391 1.00 0.00 N ATOM 992 CA ALA A 67 -4.298 -13.764 1.202 1.00 0.00 C ATOM 993 C ALA A 67 -3.467 -12.842 0.306 1.00 0.00 C ATOM 994 O ALA A 67 -2.393 -12.407 0.673 1.00 0.00 O ATOM 995 CB ALA A 67 -4.502 -15.121 0.527 1.00 0.00 C ATOM 996 H ALA A 67 -6.451 -13.759 1.270 1.00 0.00 H ATOM 997 HA ALA A 67 -3.812 -13.897 2.156 1.00 0.00 H ATOM 998 HB1 ALA A 67 -5.415 -15.102 -0.050 1.00 0.00 H ATOM 999 HB2 ALA A 67 -4.570 -15.891 1.282 1.00 0.00 H ATOM 1000 HB3 ALA A 67 -3.667 -15.328 -0.125 1.00 0.00 H ATOM 1001 N GLU A 68 -3.955 -12.540 -0.866 1.00 0.00 N ATOM 1002 CA GLU A 68 -3.193 -11.645 -1.780 1.00 0.00 C ATOM 1003 C GLU A 68 -2.878 -10.326 -1.074 1.00 0.00 C ATOM 1004 O GLU A 68 -1.785 -9.803 -1.167 1.00 0.00 O ATOM 1005 CB GLU A 68 -4.103 -11.402 -2.984 1.00 0.00 C ATOM 1006 CG GLU A 68 -4.144 -12.659 -3.856 1.00 0.00 C ATOM 1007 CD GLU A 68 -5.069 -12.422 -5.051 1.00 0.00 C ATOM 1008 OE1 GLU A 68 -5.109 -11.302 -5.531 1.00 0.00 O ATOM 1009 OE2 GLU A 68 -5.722 -13.366 -5.465 1.00 0.00 O ATOM 1010 H GLU A 68 -4.823 -12.898 -1.143 1.00 0.00 H ATOM 1011 HA GLU A 68 -2.284 -12.125 -2.096 1.00 0.00 H ATOM 1012 HB2 GLU A 68 -5.101 -11.169 -2.640 1.00 0.00 H ATOM 1013 HB3 GLU A 68 -3.721 -10.576 -3.565 1.00 0.00 H ATOM 1014 HG2 GLU A 68 -3.148 -12.885 -4.209 1.00 0.00 H ATOM 1015 HG3 GLU A 68 -4.516 -13.489 -3.274 1.00 0.00 H ATOM 1016 N ALA A 69 -3.829 -9.788 -0.365 1.00 0.00 N ATOM 1017 CA ALA A 69 -3.586 -8.505 0.353 1.00 0.00 C ATOM 1018 C ALA A 69 -2.405 -8.662 1.311 1.00 0.00 C ATOM 1019 O ALA A 69 -1.634 -7.746 1.519 1.00 0.00 O ATOM 1020 CB ALA A 69 -4.870 -8.210 1.131 1.00 0.00 C ATOM 1021 H ALA A 69 -4.701 -10.229 -0.302 1.00 0.00 H ATOM 1022 HA ALA A 69 -3.394 -7.712 -0.352 1.00 0.00 H ATOM 1023 HB1 ALA A 69 -5.716 -8.611 0.593 1.00 0.00 H ATOM 1024 HB2 ALA A 69 -4.986 -7.143 1.243 1.00 0.00 H ATOM 1025 HB3 ALA A 69 -4.813 -8.672 2.106 1.00 0.00 H ATOM 1026 N LYS A 70 -2.259 -9.819 1.893 1.00 0.00 N ATOM 1027 CA LYS A 70 -1.130 -10.042 2.836 1.00 0.00 C ATOM 1028 C LYS A 70 0.202 -9.968 2.086 1.00 0.00 C ATOM 1029 O LYS A 70 1.097 -9.238 2.463 1.00 0.00 O ATOM 1030 CB LYS A 70 -1.340 -11.443 3.414 1.00 0.00 C ATOM 1031 CG LYS A 70 -2.153 -11.347 4.705 1.00 0.00 C ATOM 1032 CD LYS A 70 -1.437 -12.113 5.819 1.00 0.00 C ATOM 1033 CE LYS A 70 -1.710 -13.611 5.667 1.00 0.00 C ATOM 1034 NZ LYS A 70 -1.763 -14.155 7.053 1.00 0.00 N ATOM 1035 H LYS A 70 -2.892 -10.540 1.710 1.00 0.00 H ATOM 1036 HA LYS A 70 -1.157 -9.312 3.627 1.00 0.00 H ATOM 1037 HB2 LYS A 70 -1.871 -12.052 2.696 1.00 0.00 H ATOM 1038 HB3 LYS A 70 -0.381 -11.892 3.628 1.00 0.00 H ATOM 1039 HG2 LYS A 70 -2.257 -10.309 4.989 1.00 0.00 H ATOM 1040 HG3 LYS A 70 -3.132 -11.777 4.548 1.00 0.00 H ATOM 1041 HD2 LYS A 70 -0.374 -11.931 5.754 1.00 0.00 H ATOM 1042 HD3 LYS A 70 -1.802 -11.778 6.779 1.00 0.00 H ATOM 1043 HE2 LYS A 70 -2.654 -13.767 5.165 1.00 0.00 H ATOM 1044 HE3 LYS A 70 -0.911 -14.083 5.116 1.00 0.00 H ATOM 1045 HZ1 LYS A 70 -2.160 -13.438 7.692 1.00 0.00 H ATOM 1046 HZ2 LYS A 70 -0.802 -14.405 7.364 1.00 0.00 H ATOM 1047 HZ3 LYS A 70 -2.365 -15.003 7.069 1.00 0.00 H ATOM 1048 N GLN A 71 0.340 -10.718 1.027 1.00 0.00 N ATOM 1049 CA GLN A 71 1.614 -10.688 0.255 1.00 0.00 C ATOM 1050 C GLN A 71 1.950 -9.252 -0.143 1.00 0.00 C ATOM 1051 O GLN A 71 3.101 -8.890 -0.275 1.00 0.00 O ATOM 1052 CB GLN A 71 1.372 -11.545 -0.988 1.00 0.00 C ATOM 1053 CG GLN A 71 2.456 -11.256 -2.031 1.00 0.00 C ATOM 1054 CD GLN A 71 1.927 -10.246 -3.053 1.00 0.00 C ATOM 1055 OE1 GLN A 71 1.047 -10.558 -3.830 1.00 0.00 O ATOM 1056 NE2 GLN A 71 2.429 -9.041 -3.083 1.00 0.00 N ATOM 1057 H GLN A 71 -0.394 -11.300 0.739 1.00 0.00 H ATOM 1058 HA GLN A 71 2.415 -11.108 0.841 1.00 0.00 H ATOM 1059 HB2 GLN A 71 1.403 -12.590 -0.717 1.00 0.00 H ATOM 1060 HB3 GLN A 71 0.404 -11.311 -1.405 1.00 0.00 H ATOM 1061 HG2 GLN A 71 3.328 -10.849 -1.540 1.00 0.00 H ATOM 1062 HG3 GLN A 71 2.722 -12.172 -2.538 1.00 0.00 H ATOM 1063 HE21 GLN A 71 3.138 -8.789 -2.456 1.00 0.00 H ATOM 1064 HE22 GLN A 71 2.096 -8.389 -3.735 1.00 0.00 H ATOM 1065 N LEU A 72 0.958 -8.431 -0.337 1.00 0.00 N ATOM 1066 CA LEU A 72 1.233 -7.019 -0.726 1.00 0.00 C ATOM 1067 C LEU A 72 1.847 -6.265 0.453 1.00 0.00 C ATOM 1068 O LEU A 72 2.879 -5.635 0.329 1.00 0.00 O ATOM 1069 CB LEU A 72 -0.120 -6.415 -1.104 1.00 0.00 C ATOM 1070 CG LEU A 72 -0.431 -6.733 -2.568 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -1.891 -6.389 -2.867 1.00 0.00 C ATOM 1072 CD2 LEU A 72 0.483 -5.904 -3.473 1.00 0.00 C ATOM 1073 H LEU A 72 0.035 -8.740 -0.226 1.00 0.00 H ATOM 1074 HA LEU A 72 1.900 -6.990 -1.572 1.00 0.00 H ATOM 1075 HB2 LEU A 72 -0.891 -6.834 -0.472 1.00 0.00 H ATOM 1076 HB3 LEU A 72 -0.087 -5.344 -0.970 1.00 0.00 H ATOM 1077 HG LEU A 72 -0.265 -7.785 -2.750 1.00 0.00 H ATOM 1078 HD11 LEU A 72 -2.528 -6.854 -2.129 1.00 0.00 H ATOM 1079 HD12 LEU A 72 -2.153 -6.753 -3.850 1.00 0.00 H ATOM 1080 HD13 LEU A 72 -2.022 -5.318 -2.833 1.00 0.00 H ATOM 1081 HD21 LEU A 72 0.735 -4.978 -2.979 1.00 0.00 H ATOM 1082 HD22 LEU A 72 -0.027 -5.690 -4.400 1.00 0.00 H ATOM 1083 HD23 LEU A 72 1.386 -6.460 -3.679 1.00 0.00 H ATOM 1084 N ALA A 73 1.228 -6.327 1.599 1.00 0.00 N ATOM 1085 CA ALA A 73 1.791 -5.616 2.780 1.00 0.00 C ATOM 1086 C ALA A 73 3.077 -6.311 3.226 1.00 0.00 C ATOM 1087 O ALA A 73 3.994 -5.686 3.721 1.00 0.00 O ATOM 1088 CB ALA A 73 0.726 -5.705 3.874 1.00 0.00 C ATOM 1089 H ALA A 73 0.399 -6.843 1.685 1.00 0.00 H ATOM 1090 HA ALA A 73 1.989 -4.584 2.536 1.00 0.00 H ATOM 1091 HB1 ALA A 73 -0.014 -4.934 3.718 1.00 0.00 H ATOM 1092 HB2 ALA A 73 1.189 -5.569 4.839 1.00 0.00 H ATOM 1093 HB3 ALA A 73 0.250 -6.673 3.836 1.00 0.00 H ATOM 1094 N GLN A 74 3.154 -7.601 3.045 1.00 0.00 N ATOM 1095 CA GLN A 74 4.385 -8.336 3.447 1.00 0.00 C ATOM 1096 C GLN A 74 5.496 -8.065 2.434 1.00 0.00 C ATOM 1097 O GLN A 74 6.654 -7.946 2.781 1.00 0.00 O ATOM 1098 CB GLN A 74 4.009 -9.819 3.444 1.00 0.00 C ATOM 1099 CG GLN A 74 3.771 -10.287 4.881 1.00 0.00 C ATOM 1100 CD GLN A 74 3.473 -11.788 4.886 1.00 0.00 C ATOM 1101 OE1 GLN A 74 4.150 -12.551 5.545 1.00 0.00 O ATOM 1102 NE2 GLN A 74 2.481 -12.247 4.172 1.00 0.00 N ATOM 1103 H GLN A 74 2.406 -8.084 2.637 1.00 0.00 H ATOM 1104 HA GLN A 74 4.696 -8.036 4.433 1.00 0.00 H ATOM 1105 HB2 GLN A 74 3.109 -9.960 2.864 1.00 0.00 H ATOM 1106 HB3 GLN A 74 4.813 -10.394 3.009 1.00 0.00 H ATOM 1107 HG2 GLN A 74 4.653 -10.092 5.474 1.00 0.00 H ATOM 1108 HG3 GLN A 74 2.930 -9.755 5.299 1.00 0.00 H ATOM 1109 HE21 GLN A 74 1.935 -11.631 3.641 1.00 0.00 H ATOM 1110 HE22 GLN A 74 2.282 -13.207 4.169 1.00 0.00 H ATOM 1111 N TRP A 75 5.149 -7.958 1.181 1.00 0.00 N ATOM 1112 CA TRP A 75 6.181 -7.686 0.142 1.00 0.00 C ATOM 1113 C TRP A 75 6.529 -6.194 0.133 1.00 0.00 C ATOM 1114 O TRP A 75 7.671 -5.815 -0.036 1.00 0.00 O ATOM 1115 CB TRP A 75 5.551 -8.098 -1.190 1.00 0.00 C ATOM 1116 CG TRP A 75 6.344 -7.527 -2.322 1.00 0.00 C ATOM 1117 CD1 TRP A 75 7.639 -7.810 -2.588 1.00 0.00 C ATOM 1118 CD2 TRP A 75 5.913 -6.581 -3.341 1.00 0.00 C ATOM 1119 NE1 TRP A 75 8.030 -7.097 -3.707 1.00 0.00 N ATOM 1120 CE2 TRP A 75 7.001 -6.325 -4.207 1.00 0.00 C ATOM 1121 CE3 TRP A 75 4.694 -5.928 -3.594 1.00 0.00 C ATOM 1122 CZ2 TRP A 75 6.884 -5.451 -5.288 1.00 0.00 C ATOM 1123 CZ3 TRP A 75 4.572 -5.046 -4.680 1.00 0.00 C ATOM 1124 CH2 TRP A 75 5.666 -4.808 -5.526 1.00 0.00 C ATOM 1125 H TRP A 75 4.205 -8.054 0.924 1.00 0.00 H ATOM 1126 HA TRP A 75 7.065 -8.276 0.329 1.00 0.00 H ATOM 1127 HB2 TRP A 75 5.542 -9.175 -1.266 1.00 0.00 H ATOM 1128 HB3 TRP A 75 4.539 -7.725 -1.239 1.00 0.00 H ATOM 1129 HD1 TRP A 75 8.265 -8.483 -2.020 1.00 0.00 H ATOM 1130 HE1 TRP A 75 8.923 -7.124 -4.111 1.00 0.00 H ATOM 1131 HE3 TRP A 75 3.847 -6.105 -2.947 1.00 0.00 H ATOM 1132 HZ2 TRP A 75 7.729 -5.271 -5.936 1.00 0.00 H ATOM 1133 HZ3 TRP A 75 3.632 -4.549 -4.866 1.00 0.00 H ATOM 1134 HH2 TRP A 75 5.566 -4.130 -6.360 1.00 0.00 H ATOM 1135 N ILE A 76 5.554 -5.345 0.318 1.00 0.00 N ATOM 1136 CA ILE A 76 5.835 -3.882 0.322 1.00 0.00 C ATOM 1137 C ILE A 76 6.609 -3.501 1.586 1.00 0.00 C ATOM 1138 O ILE A 76 7.516 -2.691 1.550 1.00 0.00 O ATOM 1139 CB ILE A 76 4.469 -3.194 0.307 1.00 0.00 C ATOM 1140 CG1 ILE A 76 3.814 -3.394 -1.061 1.00 0.00 C ATOM 1141 CG2 ILE A 76 4.647 -1.698 0.572 1.00 0.00 C ATOM 1142 CD1 ILE A 76 2.351 -2.950 -0.997 1.00 0.00 C ATOM 1143 H ILE A 76 4.638 -5.669 0.454 1.00 0.00 H ATOM 1144 HA ILE A 76 6.395 -3.605 -0.558 1.00 0.00 H ATOM 1145 HB ILE A 76 3.842 -3.623 1.076 1.00 0.00 H ATOM 1146 HG12 ILE A 76 4.337 -2.805 -1.800 1.00 0.00 H ATOM 1147 HG13 ILE A 76 3.860 -4.437 -1.334 1.00 0.00 H ATOM 1148 HG21 ILE A 76 4.804 -1.535 1.629 1.00 0.00 H ATOM 1149 HG22 ILE A 76 3.762 -1.168 0.253 1.00 0.00 H ATOM 1150 HG23 ILE A 76 5.502 -1.335 0.022 1.00 0.00 H ATOM 1151 HD11 ILE A 76 1.888 -3.365 -0.115 1.00 0.00 H ATOM 1152 HD12 ILE A 76 1.830 -3.300 -1.876 1.00 0.00 H ATOM 1153 HD13 ILE A 76 2.304 -1.872 -0.956 1.00 0.00 H ATOM 1154 N LEU A 77 6.262 -4.079 2.703 1.00 0.00 N ATOM 1155 CA LEU A 77 6.982 -3.750 3.967 1.00 0.00 C ATOM 1156 C LEU A 77 8.422 -4.263 3.899 1.00 0.00 C ATOM 1157 O LEU A 77 9.355 -3.574 4.261 1.00 0.00 O ATOM 1158 CB LEU A 77 6.215 -4.464 5.083 1.00 0.00 C ATOM 1159 CG LEU A 77 5.057 -3.583 5.551 1.00 0.00 C ATOM 1160 CD1 LEU A 77 4.067 -4.426 6.356 1.00 0.00 C ATOM 1161 CD2 LEU A 77 5.601 -2.456 6.434 1.00 0.00 C ATOM 1162 H LEU A 77 5.530 -4.730 2.711 1.00 0.00 H ATOM 1163 HA LEU A 77 6.971 -2.685 4.138 1.00 0.00 H ATOM 1164 HB2 LEU A 77 5.829 -5.401 4.710 1.00 0.00 H ATOM 1165 HB3 LEU A 77 6.880 -4.653 5.912 1.00 0.00 H ATOM 1166 HG LEU A 77 4.556 -3.160 4.692 1.00 0.00 H ATOM 1167 HD11 LEU A 77 4.603 -5.014 7.085 1.00 0.00 H ATOM 1168 HD12 LEU A 77 3.529 -5.083 5.688 1.00 0.00 H ATOM 1169 HD13 LEU A 77 3.367 -3.776 6.861 1.00 0.00 H ATOM 1170 HD21 LEU A 77 4.812 -1.748 6.640 1.00 0.00 H ATOM 1171 HD22 LEU A 77 6.409 -1.956 5.923 1.00 0.00 H ATOM 1172 HD23 LEU A 77 5.964 -2.870 7.363 1.00 0.00 H ATOM 1173 N SER A 78 8.611 -5.469 3.435 1.00 0.00 N ATOM 1174 CA SER A 78 9.991 -6.024 3.343 1.00 0.00 C ATOM 1175 C SER A 78 10.847 -5.152 2.422 1.00 0.00 C ATOM 1176 O SER A 78 12.040 -5.018 2.610 1.00 0.00 O ATOM 1177 CB SER A 78 9.837 -7.427 2.753 1.00 0.00 C ATOM 1178 OG SER A 78 10.126 -7.385 1.362 1.00 0.00 O ATOM 1179 H SER A 78 7.845 -6.009 3.147 1.00 0.00 H ATOM 1180 HA SER A 78 10.436 -6.085 4.323 1.00 0.00 H ATOM 1181 HB2 SER A 78 10.523 -8.100 3.238 1.00 0.00 H ATOM 1182 HB3 SER A 78 8.824 -7.773 2.911 1.00 0.00 H ATOM 1183 HG SER A 78 10.183 -8.290 1.045 1.00 0.00 H ATOM 1184 N ILE A 79 10.248 -4.554 1.429 1.00 0.00 N ATOM 1185 CA ILE A 79 11.028 -3.690 0.497 1.00 0.00 C ATOM 1186 C ILE A 79 11.516 -2.437 1.230 1.00 0.00 C ATOM 1187 O ILE A 79 10.734 -1.611 1.657 1.00 0.00 O ATOM 1188 CB ILE A 79 10.061 -3.308 -0.625 1.00 0.00 C ATOM 1189 CG1 ILE A 79 9.860 -4.507 -1.553 1.00 0.00 C ATOM 1190 CG2 ILE A 79 10.642 -2.139 -1.424 1.00 0.00 C ATOM 1191 CD1 ILE A 79 8.844 -4.148 -2.639 1.00 0.00 C ATOM 1192 H ILE A 79 9.284 -4.675 1.294 1.00 0.00 H ATOM 1193 HA ILE A 79 11.864 -4.236 0.091 1.00 0.00 H ATOM 1194 HB ILE A 79 9.113 -3.015 -0.199 1.00 0.00 H ATOM 1195 HG12 ILE A 79 10.802 -4.769 -2.013 1.00 0.00 H ATOM 1196 HG13 ILE A 79 9.492 -5.346 -0.982 1.00 0.00 H ATOM 1197 HG21 ILE A 79 10.714 -2.417 -2.466 1.00 0.00 H ATOM 1198 HG22 ILE A 79 11.626 -1.899 -1.047 1.00 0.00 H ATOM 1199 HG23 ILE A 79 9.998 -1.279 -1.324 1.00 0.00 H ATOM 1200 HD11 ILE A 79 8.551 -3.114 -2.528 1.00 0.00 H ATOM 1201 HD12 ILE A 79 7.975 -4.781 -2.544 1.00 0.00 H ATOM 1202 HD13 ILE A 79 9.291 -4.292 -3.611 1.00 0.00 H ATOM 1203 N LYS A 80 12.804 -2.291 1.379 1.00 0.00 N ATOM 1204 CA LYS A 80 13.342 -1.091 2.084 1.00 0.00 C ATOM 1205 C LYS A 80 13.911 -0.096 1.069 1.00 0.00 C ATOM 1206 O LYS A 80 13.647 -0.266 -0.109 1.00 0.00 O ATOM 1207 CB LYS A 80 14.450 -1.608 3.002 1.00 0.00 C ATOM 1208 CG LYS A 80 13.865 -1.928 4.379 1.00 0.00 C ATOM 1209 CD LYS A 80 14.612 -3.116 4.988 1.00 0.00 C ATOM 1210 CE LYS A 80 14.363 -3.157 6.497 1.00 0.00 C ATOM 1211 NZ LYS A 80 15.707 -3.280 7.127 1.00 0.00 N ATOM 1212 OXT LYS A 80 14.602 0.817 1.489 1.00 0.00 O ATOM 1213 H LYS A 80 13.419 -2.968 1.028 1.00 0.00 H ATOM 1214 HA LYS A 80 12.566 -0.624 2.672 1.00 0.00 H ATOM 1215 HB2 LYS A 80 14.881 -2.503 2.576 1.00 0.00 H ATOM 1216 HB3 LYS A 80 15.214 -0.853 3.104 1.00 0.00 H ATOM 1217 HG2 LYS A 80 13.970 -1.066 5.023 1.00 0.00 H ATOM 1218 HG3 LYS A 80 12.819 -2.176 4.278 1.00 0.00 H ATOM 1219 HD2 LYS A 80 14.256 -4.032 4.539 1.00 0.00 H ATOM 1220 HD3 LYS A 80 15.670 -3.010 4.803 1.00 0.00 H ATOM 1221 HE2 LYS A 80 13.879 -2.245 6.820 1.00 0.00 H ATOM 1222 HE3 LYS A 80 13.757 -4.013 6.753 1.00 0.00 H ATOM 1223 HZ1 LYS A 80 15.657 -2.968 8.118 1.00 0.00 H ATOM 1224 HZ2 LYS A 80 16.387 -2.684 6.610 1.00 0.00 H ATOM 1225 HZ3 LYS A 80 16.018 -4.271 7.093 1.00 0.00 H TER 1226 LYS A 80 HETATM 1227 FE HEC A 81 -2.269 1.890 -4.356 1.00 0.00 FE HETATM 1228 CHA HEC A 81 -2.157 3.313 -1.303 1.00 0.00 C HETATM 1229 CHB HEC A 81 -1.902 -1.167 -2.964 1.00 0.00 C HETATM 1230 CHC HEC A 81 -2.479 0.473 -7.423 1.00 0.00 C HETATM 1231 CHD HEC A 81 -2.330 4.966 -5.792 1.00 0.00 C HETATM 1232 NA HEC A 81 -2.062 1.221 -2.538 1.00 0.00 N HETATM 1233 C1A HEC A 81 -2.058 1.949 -1.367 1.00 0.00 C HETATM 1234 C2A HEC A 81 -1.890 1.099 -0.217 1.00 0.00 C HETATM 1235 C3A HEC A 81 -1.790 -0.173 -0.690 1.00 0.00 C HETATM 1236 C4A HEC A 81 -1.904 -0.085 -2.123 1.00 0.00 C HETATM 1237 CMA HEC A 81 -1.602 -1.303 0.047 1.00 0.00 C HETATM 1238 CAA HEC A 81 -1.827 1.495 1.085 1.00 0.00 C HETATM 1239 CBA HEC A 81 -2.925 0.798 1.888 1.00 0.00 C HETATM 1240 CGA HEC A 81 -3.093 1.497 3.238 1.00 0.00 C HETATM 1241 O1A HEC A 81 -3.997 2.308 3.354 1.00 0.00 O HETATM 1242 O2A HEC A 81 -2.315 1.210 4.132 1.00 0.00 O HETATM 1243 NB HEC A 81 -2.248 0.055 -5.037 1.00 0.00 N HETATM 1244 C1B HEC A 81 -2.061 -1.110 -4.323 1.00 0.00 C HETATM 1245 C2B HEC A 81 -2.041 -2.262 -5.187 1.00 0.00 C HETATM 1246 C3B HEC A 81 -2.212 -1.797 -6.456 1.00 0.00 C HETATM 1247 C4B HEC A 81 -2.341 -0.367 -6.348 1.00 0.00 C HETATM 1248 CMB HEC A 81 -1.884 -3.560 -4.804 1.00 0.00 C HETATM 1249 CAB HEC A 81 -2.222 -2.516 -7.593 1.00 0.00 C HETATM 1250 CBB HEC A 81 -3.380 -3.523 -7.529 1.00 0.00 C HETATM 1251 NC HEC A 81 -2.444 2.571 -6.195 1.00 0.00 N HETATM 1252 C1C HEC A 81 -2.525 1.840 -7.360 1.00 0.00 C HETATM 1253 C2C HEC A 81 -2.564 2.691 -8.521 1.00 0.00 C HETATM 1254 C3C HEC A 81 -2.485 3.973 -8.065 1.00 0.00 C HETATM 1255 C4C HEC A 81 -2.411 3.883 -6.628 1.00 0.00 C HETATM 1256 CMC HEC A 81 -2.691 2.282 -9.815 1.00 0.00 C HETATM 1257 CAC HEC A 81 -2.450 5.104 -8.795 1.00 0.00 C HETATM 1258 CBC HEC A 81 -3.729 5.184 -9.642 1.00 0.00 C HETATM 1259 ND HEC A 81 -2.263 3.729 -3.693 1.00 0.00 N HETATM 1260 C1D HEC A 81 -2.268 4.902 -4.423 1.00 0.00 C HETATM 1261 C2D HEC A 81 -2.259 6.058 -3.565 1.00 0.00 C HETATM 1262 C3D HEC A 81 -2.256 5.589 -2.288 1.00 0.00 C HETATM 1263 C4D HEC A 81 -2.247 4.153 -2.382 1.00 0.00 C HETATM 1264 CMD HEC A 81 -2.257 7.364 -3.954 1.00 0.00 C HETATM 1265 CAD HEC A 81 -2.293 6.333 -1.147 1.00 0.00 C HETATM 1266 CBD HEC A 81 -3.714 6.852 -0.917 1.00 0.00 C HETATM 1267 CGD HEC A 81 -3.751 7.690 0.361 1.00 0.00 C HETATM 1268 O1D HEC A 81 -3.937 7.113 1.420 1.00 0.00 O HETATM 1269 O2D HEC A 81 -3.592 8.896 0.260 1.00 0.00 O HETATM 1270 HHA HEC A 81 -2.204 3.762 -0.315 1.00 0.00 H HETATM 1271 HHB HEC A 81 -1.761 -2.151 -2.515 1.00 0.00 H HETATM 1272 HHC HEC A 81 -2.561 0.017 -8.409 1.00 0.00 H HETATM 1273 HHD HEC A 81 -2.309 5.954 -6.250 1.00 0.00 H HETATM 1274 HMA1 HEC A 81 -0.736 -1.184 0.677 1.00 0.00 H HETATM 1275 HMA2 HEC A 81 -1.453 -2.144 -0.619 1.00 0.00 H HETATM 1276 HMA3 HEC A 81 -2.467 -1.481 0.664 1.00 0.00 H HETATM 1277 HAA1 HEC A 81 -1.972 2.562 1.145 1.00 0.00 H HETATM 1278 HAA2 HEC A 81 -0.857 1.237 1.491 1.00 0.00 H HETATM 1279 HBA1 HEC A 81 -2.652 -0.234 2.051 1.00 0.00 H HETATM 1280 HBA2 HEC A 81 -3.855 0.843 1.340 1.00 0.00 H HETATM 1281 HMB1 HEC A 81 -1.672 -3.603 -3.748 1.00 0.00 H HETATM 1282 HMB2 HEC A 81 -1.065 -4.001 -5.357 1.00 0.00 H HETATM 1283 HMB3 HEC A 81 -2.792 -4.108 -5.003 1.00 0.00 H HETATM 1284 HAB HEC A 81 -2.335 -1.841 -8.438 1.00 0.00 H HETATM 1285 HBB1 HEC A 81 -3.544 -3.945 -8.509 1.00 0.00 H HETATM 1286 HBB2 HEC A 81 -4.276 -3.019 -7.201 1.00 0.00 H HETATM 1287 HBB3 HEC A 81 -3.134 -4.310 -6.833 1.00 0.00 H HETATM 1288 HMC1 HEC A 81 -2.409 3.083 -10.478 1.00 0.00 H HETATM 1289 HMC2 HEC A 81 -3.719 2.000 -10.002 1.00 0.00 H HETATM 1290 HMC3 HEC A 81 -2.046 1.435 -9.990 1.00 0.00 H HETATM 1291 HAC HEC A 81 -2.372 5.956 -8.123 1.00 0.00 H HETATM 1292 HBC1 HEC A 81 -3.680 4.457 -10.438 1.00 0.00 H HETATM 1293 HBC2 HEC A 81 -3.820 6.175 -10.064 1.00 0.00 H HETATM 1294 HBC3 HEC A 81 -4.587 4.979 -9.019 1.00 0.00 H HETATM 1295 HMD1 HEC A 81 -1.926 7.983 -3.135 1.00 0.00 H HETATM 1296 HMD2 HEC A 81 -3.256 7.653 -4.247 1.00 0.00 H HETATM 1297 HMD3 HEC A 81 -1.583 7.491 -4.786 1.00 0.00 H HETATM 1298 HAD1 HEC A 81 -1.625 7.173 -1.242 1.00 0.00 H HETATM 1299 HAD2 HEC A 81 -1.988 5.720 -0.309 1.00 0.00 H HETATM 1300 HBD1 HEC A 81 -4.389 6.016 -0.817 1.00 0.00 H HETATM 1301 HBD2 HEC A 81 -4.014 7.461 -1.758 1.00 0.00 H