HETATM 1 C ACE A 0 8.891 10.532 -7.619 1.00 2.89 C HETATM 2 O ACE A 0 8.436 11.479 -6.977 1.00 3.66 O HETATM 3 CH3 ACE A 0 10.324 10.577 -8.129 1.00 3.43 C HETATM 4 H1 ACE A 0 10.327 10.851 -9.184 1.00 3.64 H HETATM 5 H2 ACE A 0 10.890 11.323 -7.571 1.00 4.01 H HETATM 6 H3 ACE A 0 10.798 9.603 -8.002 1.00 3.93 H ATOM 7 N MET A 1 8.159 9.466 -7.942 1.00 2.59 N ATOM 8 CA MET A 1 6.801 9.206 -7.468 1.00 2.24 C ATOM 9 C MET A 1 6.708 7.745 -7.047 1.00 2.08 C ATOM 10 O MET A 1 7.512 6.913 -7.478 1.00 2.82 O ATOM 11 CB MET A 1 5.783 9.520 -8.579 1.00 2.33 C ATOM 12 CG MET A 1 5.444 11.012 -8.645 1.00 3.16 C ATOM 13 SD MET A 1 5.370 11.690 -10.324 1.00 4.07 S ATOM 14 CE MET A 1 6.723 12.888 -10.201 1.00 5.71 C ATOM 15 H MET A 1 8.616 8.679 -8.392 1.00 3.36 H ATOM 16 HA MET A 1 6.586 9.823 -6.594 1.00 2.49 H ATOM 17 HB2 MET A 1 6.182 9.183 -9.537 1.00 2.82 H ATOM 18 HB3 MET A 1 4.856 8.975 -8.397 1.00 2.76 H ATOM 19 HG2 MET A 1 4.481 11.166 -8.159 1.00 3.58 H ATOM 20 HG3 MET A 1 6.180 11.579 -8.080 1.00 4.20 H ATOM 21 HE1 MET A 1 7.647 12.374 -9.937 1.00 6.32 H ATOM 22 HE2 MET A 1 6.849 13.391 -11.158 1.00 6.15 H ATOM 23 HE3 MET A 1 6.492 13.627 -9.434 1.00 6.39 H ATOM 24 N ASN A 2 5.705 7.417 -6.239 1.00 1.39 N ATOM 25 CA ASN A 2 5.411 6.060 -5.785 1.00 1.21 C ATOM 26 C ASN A 2 3.888 5.926 -5.595 1.00 1.03 C ATOM 27 O ASN A 2 3.184 6.945 -5.604 1.00 1.09 O ATOM 28 CB ASN A 2 6.182 5.790 -4.478 1.00 1.35 C ATOM 29 CG ASN A 2 7.606 5.316 -4.715 1.00 1.59 C ATOM 30 OD1 ASN A 2 7.840 4.158 -5.042 1.00 1.84 O ATOM 31 ND2 ASN A 2 8.587 6.190 -4.554 1.00 1.82 N ATOM 32 H ASN A 2 5.036 8.131 -5.978 1.00 1.38 H ATOM 33 HA ASN A 2 5.733 5.344 -6.544 1.00 1.21 H ATOM 34 HB2 ASN A 2 6.216 6.694 -3.882 1.00 1.45 H ATOM 35 HB3 ASN A 2 5.671 5.028 -3.892 1.00 1.28 H ATOM 36 HD21 ASN A 2 8.397 7.182 -4.410 1.00 1.96 H ATOM 37 HD22 ASN A 2 9.546 5.852 -4.507 1.00 2.03 H ATOM 38 N PRO A 3 3.346 4.707 -5.416 1.00 0.96 N ATOM 39 CA PRO A 3 1.928 4.500 -5.113 1.00 0.88 C ATOM 40 C PRO A 3 1.473 5.181 -3.811 1.00 0.56 C ATOM 41 O PRO A 3 2.276 5.747 -3.066 1.00 0.59 O ATOM 42 CB PRO A 3 1.705 2.988 -5.118 1.00 1.11 C ATOM 43 CG PRO A 3 3.081 2.343 -5.210 1.00 1.14 C ATOM 44 CD PRO A 3 4.018 3.445 -5.686 1.00 1.05 C ATOM 45 HA PRO A 3 1.335 4.917 -5.926 1.00 1.05 H ATOM 46 HB2 PRO A 3 1.195 2.651 -4.216 1.00 1.32 H ATOM 47 HB3 PRO A 3 1.134 2.725 -6.006 1.00 1.26 H ATOM 48 HG2 PRO A 3 3.392 2.001 -4.225 1.00 1.33 H ATOM 49 HG3 PRO A 3 3.070 1.511 -5.914 1.00 1.19 H ATOM 50 HD2 PRO A 3 4.972 3.366 -5.167 1.00 1.18 H ATOM 51 HD3 PRO A 3 4.176 3.348 -6.761 1.00 1.03 H ATOM 52 N ASN A 4 0.169 5.164 -3.521 1.00 0.71 N ATOM 53 CA ASN A 4 -0.453 5.909 -2.420 1.00 0.54 C ATOM 54 C ASN A 4 -1.423 5.000 -1.676 1.00 0.50 C ATOM 55 O ASN A 4 -2.287 4.391 -2.303 1.00 0.66 O ATOM 56 CB ASN A 4 -1.231 7.124 -2.952 1.00 1.08 C ATOM 57 CG ASN A 4 -0.408 8.321 -3.419 1.00 1.43 C ATOM 58 OD1 ASN A 4 -0.972 9.259 -3.975 1.00 2.90 O ATOM 59 ND2 ASN A 4 0.901 8.350 -3.226 1.00 1.36 N ATOM 60 H ASN A 4 -0.455 4.633 -4.116 1.00 1.10 H ATOM 61 HA ASN A 4 0.301 6.255 -1.714 1.00 0.60 H ATOM 62 HB2 ASN A 4 -1.874 6.796 -3.768 1.00 1.25 H ATOM 63 HB3 ASN A 4 -1.884 7.482 -2.154 1.00 1.29 H ATOM 64 HD21 ASN A 4 1.414 7.525 -2.941 1.00 2.36 H ATOM 65 HD22 ASN A 4 1.409 9.203 -3.451 1.00 1.38 H ATOM 66 N CYS A 5 -1.265 4.896 -0.354 1.00 0.50 N ATOM 67 CA CYS A 5 -2.136 4.146 0.525 1.00 0.71 C ATOM 68 C CYS A 5 -3.503 4.815 0.537 1.00 1.00 C ATOM 69 O CYS A 5 -3.688 5.891 1.116 1.00 1.10 O ATOM 70 CB CYS A 5 -1.506 4.070 1.916 1.00 0.59 C ATOM 71 SG CYS A 5 -2.316 2.812 2.948 1.00 0.61 S ATOM 72 H CYS A 5 -0.551 5.447 0.108 1.00 0.48 H ATOM 73 HA CYS A 5 -2.223 3.133 0.130 1.00 0.84 H ATOM 74 HB2 CYS A 5 -0.465 3.793 1.796 1.00 0.56 H ATOM 75 HB3 CYS A 5 -1.554 5.049 2.396 1.00 0.66 H ATOM 76 N ALA A 6 -4.472 4.151 -0.078 1.00 1.25 N ATOM 77 CA ALA A 6 -5.863 4.547 -0.007 1.00 1.56 C ATOM 78 C ALA A 6 -6.475 4.292 1.384 1.00 1.35 C ATOM 79 O ALA A 6 -7.630 4.673 1.599 1.00 1.63 O ATOM 80 CB ALA A 6 -6.621 3.842 -1.130 1.00 1.96 C ATOM 81 H ALA A 6 -4.217 3.304 -0.567 1.00 1.30 H ATOM 82 HA ALA A 6 -5.924 5.617 -0.202 1.00 1.75 H ATOM 83 HB1 ALA A 6 -6.499 2.763 -1.062 1.00 1.72 H ATOM 84 HB2 ALA A 6 -7.675 4.089 -1.065 1.00 3.01 H ATOM 85 HB3 ALA A 6 -6.240 4.185 -2.093 1.00 2.57 H ATOM 86 N ARG A 7 -5.751 3.686 2.341 1.00 0.94 N ATOM 87 CA ARG A 7 -6.208 3.506 3.724 1.00 0.83 C ATOM 88 C ARG A 7 -5.687 4.645 4.586 1.00 0.86 C ATOM 89 O ARG A 7 -6.494 5.444 5.066 1.00 1.13 O ATOM 90 CB ARG A 7 -5.763 2.139 4.288 1.00 0.74 C ATOM 91 CG ARG A 7 -6.814 1.029 4.130 1.00 1.19 C ATOM 92 CD ARG A 7 -7.740 0.856 5.339 1.00 1.73 C ATOM 93 NE ARG A 7 -8.634 2.009 5.531 1.00 2.45 N ATOM 94 CZ ARG A 7 -8.590 2.915 6.511 1.00 3.25 C ATOM 95 NH1 ARG A 7 -7.622 2.903 7.420 1.00 3.68 N ATOM 96 NH2 ARG A 7 -9.535 3.841 6.584 1.00 4.50 N ATOM 97 H ARG A 7 -4.789 3.430 2.137 1.00 0.81 H ATOM 98 HA ARG A 7 -7.298 3.557 3.755 1.00 0.96 H ATOM 99 HB2 ARG A 7 -4.856 1.830 3.775 1.00 1.61 H ATOM 100 HB3 ARG A 7 -5.515 2.231 5.347 1.00 1.47 H ATOM 101 HG2 ARG A 7 -7.419 1.200 3.243 1.00 2.33 H ATOM 102 HG3 ARG A 7 -6.281 0.091 4.000 1.00 2.11 H ATOM 103 HD2 ARG A 7 -8.355 -0.028 5.172 1.00 2.94 H ATOM 104 HD3 ARG A 7 -7.143 0.667 6.228 1.00 2.12 H ATOM 105 HE ARG A 7 -9.387 2.091 4.853 1.00 3.28 H ATOM 106 HH11 ARG A 7 -6.902 2.179 7.438 1.00 3.36 H ATOM 107 HH12 ARG A 7 -7.555 3.592 8.158 1.00 4.86 H ATOM 108 HH21 ARG A 7 -10.341 3.813 5.959 1.00 4.87 H ATOM 109 HH22 ARG A 7 -9.565 4.481 7.371 1.00 5.35 H ATOM 110 N CYS A 8 -4.374 4.735 4.802 1.00 0.72 N ATOM 111 CA CYS A 8 -3.839 5.658 5.793 1.00 0.80 C ATOM 112 C CYS A 8 -3.685 7.063 5.199 1.00 0.93 C ATOM 113 O CYS A 8 -4.014 8.054 5.855 1.00 1.08 O ATOM 114 CB CYS A 8 -2.529 5.088 6.346 1.00 0.68 C ATOM 115 SG CYS A 8 -1.244 5.089 5.073 1.00 0.56 S ATOM 116 H CYS A 8 -3.734 4.108 4.327 1.00 0.65 H ATOM 117 HA CYS A 8 -4.539 5.718 6.627 1.00 0.90 H ATOM 118 HB2 CYS A 8 -2.212 5.709 7.186 1.00 0.80 H ATOM 119 HB3 CYS A 8 -2.690 4.069 6.710 1.00 0.63 H ATOM 120 N GLY A 9 -3.204 7.150 3.957 1.00 1.01 N ATOM 121 CA GLY A 9 -2.929 8.386 3.244 1.00 1.14 C ATOM 122 C GLY A 9 -1.453 8.627 2.918 1.00 0.92 C ATOM 123 O GLY A 9 -1.175 9.669 2.320 1.00 0.97 O ATOM 124 H GLY A 9 -2.915 6.276 3.532 1.00 1.05 H ATOM 125 HA2 GLY A 9 -3.469 8.365 2.301 1.00 1.24 H ATOM 126 HA3 GLY A 9 -3.300 9.237 3.815 1.00 1.40 H ATOM 127 N LYS A 10 -0.499 7.751 3.269 1.00 0.75 N ATOM 128 CA LYS A 10 0.921 7.959 2.944 1.00 0.65 C ATOM 129 C LYS A 10 1.329 7.285 1.636 1.00 0.45 C ATOM 130 O LYS A 10 0.702 6.321 1.195 1.00 0.41 O ATOM 131 CB LYS A 10 1.820 7.459 4.082 1.00 0.85 C ATOM 132 CG LYS A 10 1.628 8.293 5.354 1.00 1.32 C ATOM 133 CD LYS A 10 2.911 8.408 6.195 1.00 1.80 C ATOM 134 CE LYS A 10 3.976 9.264 5.502 1.00 3.50 C ATOM 135 NZ LYS A 10 5.221 9.340 6.288 1.00 4.67 N ATOM 136 H LYS A 10 -0.741 6.979 3.880 1.00 0.82 H ATOM 137 HA LYS A 10 1.104 9.024 2.834 1.00 0.75 H ATOM 138 HB2 LYS A 10 1.605 6.416 4.302 1.00 0.71 H ATOM 139 HB3 LYS A 10 2.854 7.527 3.746 1.00 0.99 H ATOM 140 HG2 LYS A 10 1.265 9.282 5.083 1.00 1.46 H ATOM 141 HG3 LYS A 10 0.848 7.829 5.954 1.00 1.37 H ATOM 142 HD2 LYS A 10 2.669 8.866 7.154 1.00 2.14 H ATOM 143 HD3 LYS A 10 3.308 7.414 6.387 1.00 2.09 H ATOM 144 HE2 LYS A 10 4.208 8.845 4.522 1.00 4.48 H ATOM 145 HE3 LYS A 10 3.585 10.275 5.367 1.00 3.86 H ATOM 146 HZ1 LYS A 10 5.037 9.684 7.226 1.00 4.50 H ATOM 147 HZ2 LYS A 10 5.694 8.443 6.357 1.00 5.31 H ATOM 148 HZ3 LYS A 10 5.866 9.998 5.862 1.00 5.78 H ATOM 149 N ILE A 11 2.401 7.789 1.022 1.00 0.47 N ATOM 150 CA ILE A 11 3.066 7.168 -0.117 1.00 0.45 C ATOM 151 C ILE A 11 3.497 5.729 0.230 1.00 0.44 C ATOM 152 O ILE A 11 3.784 5.433 1.391 1.00 0.49 O ATOM 153 CB ILE A 11 4.213 8.102 -0.575 1.00 0.57 C ATOM 154 CG1 ILE A 11 4.455 7.954 -2.084 1.00 0.75 C ATOM 155 CG2 ILE A 11 5.503 7.903 0.242 1.00 0.66 C ATOM 156 CD1 ILE A 11 5.436 8.991 -2.642 1.00 1.26 C ATOM 157 H ILE A 11 2.871 8.588 1.425 1.00 0.56 H ATOM 158 HA ILE A 11 2.325 7.111 -0.914 1.00 0.43 H ATOM 159 HB ILE A 11 3.881 9.130 -0.423 1.00 0.69 H ATOM 160 HG12 ILE A 11 4.812 6.947 -2.284 1.00 0.94 H ATOM 161 HG13 ILE A 11 3.511 8.093 -2.607 1.00 0.91 H ATOM 162 HG21 ILE A 11 5.269 7.861 1.305 1.00 1.56 H ATOM 163 HG22 ILE A 11 5.999 6.975 -0.043 1.00 1.79 H ATOM 164 HG23 ILE A 11 6.186 8.735 0.073 1.00 1.83 H ATOM 165 HD11 ILE A 11 5.129 9.995 -2.344 1.00 1.79 H ATOM 166 HD12 ILE A 11 6.443 8.792 -2.276 1.00 1.86 H ATOM 167 HD13 ILE A 11 5.440 8.939 -3.730 1.00 2.06 H ATOM 168 N VAL A 12 3.576 4.834 -0.756 1.00 0.42 N ATOM 169 CA VAL A 12 3.827 3.407 -0.568 1.00 0.44 C ATOM 170 C VAL A 12 5.143 3.059 -1.253 1.00 0.57 C ATOM 171 O VAL A 12 5.191 2.834 -2.462 1.00 1.44 O ATOM 172 CB VAL A 12 2.643 2.549 -1.067 1.00 0.57 C ATOM 173 CG1 VAL A 12 2.800 1.094 -0.614 1.00 0.90 C ATOM 174 CG2 VAL A 12 1.289 3.037 -0.550 1.00 0.78 C ATOM 175 H VAL A 12 3.341 5.134 -1.697 1.00 0.45 H ATOM 176 HA VAL A 12 3.943 3.203 0.492 1.00 0.44 H ATOM 177 HB VAL A 12 2.606 2.583 -2.154 1.00 0.70 H ATOM 178 HG11 VAL A 12 3.764 0.706 -0.941 1.00 1.27 H ATOM 179 HG12 VAL A 12 2.742 1.019 0.472 1.00 1.87 H ATOM 180 HG13 VAL A 12 2.007 0.487 -1.053 1.00 1.70 H ATOM 181 HG21 VAL A 12 1.132 4.062 -0.869 1.00 1.91 H ATOM 182 HG22 VAL A 12 0.486 2.420 -0.956 1.00 1.38 H ATOM 183 HG23 VAL A 12 1.258 2.992 0.536 1.00 1.47 H ATOM 184 N TYR A 13 6.223 3.049 -0.473 1.00 0.57 N ATOM 185 CA TYR A 13 7.527 2.626 -0.958 1.00 0.49 C ATOM 186 C TYR A 13 7.526 1.119 -1.265 1.00 0.56 C ATOM 187 O TYR A 13 6.788 0.371 -0.611 1.00 0.71 O ATOM 188 CB TYR A 13 8.587 2.988 0.085 1.00 0.69 C ATOM 189 CG TYR A 13 8.861 4.475 0.160 1.00 1.00 C ATOM 190 CD1 TYR A 13 9.479 5.107 -0.934 1.00 2.11 C ATOM 191 CD2 TYR A 13 8.512 5.228 1.298 1.00 1.75 C ATOM 192 CE1 TYR A 13 9.778 6.476 -0.892 1.00 2.50 C ATOM 193 CE2 TYR A 13 8.807 6.602 1.347 1.00 1.98 C ATOM 194 CZ TYR A 13 9.452 7.227 0.256 1.00 1.91 C ATOM 195 OH TYR A 13 9.804 8.537 0.311 1.00 2.42 O ATOM 196 H TYR A 13 6.132 3.239 0.511 1.00 1.30 H ATOM 197 HA TYR A 13 7.730 3.175 -1.878 1.00 0.54 H ATOM 198 HB2 TYR A 13 8.290 2.605 1.063 1.00 0.86 H ATOM 199 HB3 TYR A 13 9.520 2.498 -0.184 1.00 0.74 H ATOM 200 HD1 TYR A 13 9.739 4.540 -1.817 1.00 3.04 H ATOM 201 HD2 TYR A 13 8.028 4.757 2.144 1.00 2.72 H ATOM 202 HE1 TYR A 13 10.272 6.935 -1.737 1.00 3.61 H ATOM 203 HE2 TYR A 13 8.549 7.172 2.229 1.00 2.88 H ATOM 204 HH TYR A 13 9.791 8.893 1.222 1.00 2.26 H ATOM 205 N PRO A 14 8.353 0.653 -2.221 1.00 0.68 N ATOM 206 CA PRO A 14 8.310 -0.705 -2.750 1.00 0.89 C ATOM 207 C PRO A 14 8.418 -1.816 -1.709 1.00 1.20 C ATOM 208 O PRO A 14 7.702 -2.808 -1.841 1.00 2.22 O ATOM 209 CB PRO A 14 9.394 -0.802 -3.828 1.00 1.06 C ATOM 210 CG PRO A 14 10.176 0.506 -3.754 1.00 1.04 C ATOM 211 CD PRO A 14 9.240 1.468 -3.034 1.00 0.82 C ATOM 212 HA PRO A 14 7.353 -0.836 -3.240 1.00 0.95 H ATOM 213 HB2 PRO A 14 10.055 -1.653 -3.660 1.00 1.21 H ATOM 214 HB3 PRO A 14 8.923 -0.889 -4.805 1.00 1.27 H ATOM 215 HG2 PRO A 14 11.077 0.357 -3.162 1.00 1.01 H ATOM 216 HG3 PRO A 14 10.435 0.877 -4.745 1.00 1.32 H ATOM 217 HD2 PRO A 14 9.813 2.159 -2.424 1.00 0.79 H ATOM 218 HD3 PRO A 14 8.649 2.022 -3.763 1.00 0.97 H ATOM 219 N THR A 15 9.245 -1.641 -0.678 1.00 0.83 N ATOM 220 CA THR A 15 9.417 -2.624 0.385 1.00 0.96 C ATOM 221 C THR A 15 8.086 -2.893 1.097 1.00 0.97 C ATOM 222 O THR A 15 7.829 -4.025 1.502 1.00 1.35 O ATOM 223 CB THR A 15 10.499 -2.142 1.375 1.00 1.09 C ATOM 224 OG1 THR A 15 11.721 -1.884 0.702 1.00 1.75 O ATOM 225 CG2 THR A 15 10.804 -3.160 2.474 1.00 2.42 C ATOM 226 H THR A 15 9.811 -0.800 -0.649 1.00 1.23 H ATOM 227 HA THR A 15 9.746 -3.556 -0.072 1.00 1.13 H ATOM 228 HB THR A 15 10.162 -1.216 1.843 1.00 1.47 H ATOM 229 HG1 THR A 15 11.549 -1.108 0.126 1.00 2.23 H ATOM 230 HG21 THR A 15 11.102 -4.113 2.036 1.00 3.17 H ATOM 231 HG22 THR A 15 11.607 -2.788 3.107 1.00 2.76 H ATOM 232 HG23 THR A 15 9.926 -3.314 3.102 1.00 3.33 H ATOM 233 N GLU A 16 7.235 -1.877 1.254 1.00 0.80 N ATOM 234 CA GLU A 16 6.032 -1.993 2.065 1.00 0.89 C ATOM 235 C GLU A 16 4.801 -2.306 1.211 1.00 0.93 C ATOM 236 O GLU A 16 3.815 -2.825 1.737 1.00 1.33 O ATOM 237 CB GLU A 16 5.881 -0.696 2.874 1.00 0.94 C ATOM 238 CG GLU A 16 5.029 -0.843 4.137 1.00 1.56 C ATOM 239 CD GLU A 16 5.726 -1.595 5.274 1.00 2.24 C ATOM 240 OE1 GLU A 16 6.628 -2.421 5.023 1.00 3.14 O ATOM 241 OE2 GLU A 16 5.363 -1.350 6.445 1.00 3.16 O ATOM 242 H GLU A 16 7.430 -0.988 0.812 1.00 0.81 H ATOM 243 HA GLU A 16 6.164 -2.827 2.753 1.00 1.06 H ATOM 244 HB2 GLU A 16 6.857 -0.364 3.211 1.00 1.18 H ATOM 245 HB3 GLU A 16 5.469 0.081 2.227 1.00 1.32 H ATOM 246 HG2 GLU A 16 4.793 0.156 4.501 1.00 2.42 H ATOM 247 HG3 GLU A 16 4.101 -1.340 3.884 1.00 2.02 H ATOM 248 N LYS A 17 4.866 -2.021 -0.094 1.00 0.93 N ATOM 249 CA LYS A 17 3.890 -2.231 -1.129 1.00 0.87 C ATOM 250 C LYS A 17 3.397 -3.673 -1.196 1.00 0.76 C ATOM 251 O LYS A 17 4.002 -4.507 -1.881 1.00 1.33 O ATOM 252 CB LYS A 17 4.591 -1.776 -2.422 1.00 1.23 C ATOM 253 CG LYS A 17 3.593 -1.232 -3.422 1.00 2.43 C ATOM 254 CD LYS A 17 4.175 -1.163 -4.842 1.00 2.57 C ATOM 255 CE LYS A 17 5.358 -0.187 -4.946 1.00 3.34 C ATOM 256 NZ LYS A 17 6.362 -0.632 -5.929 1.00 3.67 N ATOM 257 H LYS A 17 5.652 -1.529 -0.490 1.00 1.26 H ATOM 258 HA LYS A 17 3.036 -1.587 -0.925 1.00 0.90 H ATOM 259 HB2 LYS A 17 5.290 -0.971 -2.205 1.00 2.62 H ATOM 260 HB3 LYS A 17 5.157 -2.599 -2.856 1.00 1.63 H ATOM 261 HG2 LYS A 17 2.735 -1.897 -3.405 1.00 3.21 H ATOM 262 HG3 LYS A 17 3.314 -0.240 -3.072 1.00 3.65 H ATOM 263 HD2 LYS A 17 4.482 -2.168 -5.136 1.00 2.56 H ATOM 264 HD3 LYS A 17 3.396 -0.836 -5.530 1.00 3.74 H ATOM 265 HE2 LYS A 17 4.995 0.795 -5.244 1.00 4.49 H ATOM 266 HE3 LYS A 17 5.830 -0.079 -3.974 1.00 3.81 H ATOM 267 HZ1 LYS A 17 6.743 -1.544 -5.688 1.00 3.90 H ATOM 268 HZ2 LYS A 17 5.948 -0.650 -6.857 1.00 4.08 H ATOM 269 HZ3 LYS A 17 7.119 0.048 -5.992 1.00 4.35 H ATOM 270 N VAL A 18 2.297 -3.981 -0.515 1.00 0.47 N ATOM 271 CA VAL A 18 1.499 -5.136 -0.830 1.00 0.61 C ATOM 272 C VAL A 18 0.902 -4.908 -2.224 1.00 0.84 C ATOM 273 O VAL A 18 0.642 -3.763 -2.609 1.00 1.05 O ATOM 274 CB VAL A 18 0.425 -5.447 0.248 1.00 0.87 C ATOM 275 CG1 VAL A 18 0.908 -5.170 1.678 1.00 1.63 C ATOM 276 CG2 VAL A 18 -0.899 -4.710 0.035 1.00 2.54 C ATOM 277 H VAL A 18 1.862 -3.329 0.101 1.00 0.80 H ATOM 278 HA VAL A 18 2.206 -5.942 -0.837 1.00 0.78 H ATOM 279 HB VAL A 18 0.199 -6.509 0.190 1.00 2.32 H ATOM 280 HG11 VAL A 18 1.842 -5.702 1.835 1.00 2.48 H ATOM 281 HG12 VAL A 18 1.066 -4.104 1.836 1.00 2.56 H ATOM 282 HG13 VAL A 18 0.177 -5.532 2.401 1.00 2.34 H ATOM 283 HG21 VAL A 18 -0.694 -3.653 -0.081 1.00 3.17 H ATOM 284 HG22 VAL A 18 -1.387 -5.088 -0.863 1.00 3.84 H ATOM 285 HG23 VAL A 18 -1.566 -4.881 0.878 1.00 3.12 H ATOM 286 N ASN A 19 0.593 -5.982 -2.937 1.00 1.06 N ATOM 287 CA ASN A 19 -0.347 -5.994 -4.043 1.00 1.23 C ATOM 288 C ASN A 19 -1.104 -7.302 -3.921 1.00 1.13 C ATOM 289 O ASN A 19 -0.589 -8.353 -4.306 1.00 2.29 O ATOM 290 CB ASN A 19 0.321 -5.822 -5.408 1.00 2.38 C ATOM 291 CG ASN A 19 -0.740 -5.974 -6.488 1.00 3.39 C ATOM 292 OD1 ASN A 19 -1.347 -5.008 -6.934 1.00 5.01 O ATOM 293 ND2 ASN A 19 -1.056 -7.198 -6.848 1.00 3.54 N ATOM 294 H ASN A 19 0.830 -6.894 -2.548 1.00 1.17 H ATOM 295 HA ASN A 19 -1.059 -5.182 -3.950 1.00 1.30 H ATOM 296 HB2 ASN A 19 0.753 -4.823 -5.466 1.00 3.43 H ATOM 297 HB3 ASN A 19 1.110 -6.561 -5.547 1.00 2.56 H ATOM 298 HD21 ASN A 19 -0.608 -7.950 -6.338 1.00 3.24 H ATOM 299 HD22 ASN A 19 -1.803 -7.379 -7.511 1.00 4.72 H ATOM 300 N CYS A 20 -2.318 -7.247 -3.375 1.00 0.80 N ATOM 301 CA CYS A 20 -3.108 -8.445 -3.097 1.00 1.54 C ATOM 302 C CYS A 20 -4.256 -8.664 -4.077 1.00 1.68 C ATOM 303 O CYS A 20 -5.029 -9.604 -3.916 1.00 2.89 O ATOM 304 CB CYS A 20 -3.603 -8.408 -1.647 1.00 2.42 C ATOM 305 SG CYS A 20 -2.221 -8.192 -0.489 1.00 3.63 S ATOM 306 H CYS A 20 -2.665 -6.357 -3.047 1.00 1.31 H ATOM 307 HA CYS A 20 -2.474 -9.305 -3.242 1.00 1.87 H ATOM 308 HB2 CYS A 20 -4.315 -7.592 -1.524 1.00 2.29 H ATOM 309 HB3 CYS A 20 -4.111 -9.346 -1.422 1.00 3.68 H ATOM 310 HG CYS A 20 -2.943 -8.345 0.632 1.00 3.88 H ATOM 311 N LEU A 21 -4.369 -7.775 -5.055 1.00 1.47 N ATOM 312 CA LEU A 21 -5.289 -7.814 -6.188 1.00 1.47 C ATOM 313 C LEU A 21 -4.584 -7.032 -7.302 1.00 1.47 C ATOM 314 O LEU A 21 -3.676 -7.539 -7.955 1.00 2.01 O ATOM 315 CB LEU A 21 -6.683 -7.208 -5.861 1.00 1.60 C ATOM 316 CG LEU A 21 -7.606 -8.019 -4.929 1.00 1.85 C ATOM 317 CD1 LEU A 21 -7.487 -7.578 -3.464 1.00 2.26 C ATOM 318 CD2 LEU A 21 -9.071 -7.797 -5.318 1.00 2.05 C ATOM 319 H LEU A 21 -3.526 -7.227 -5.120 1.00 2.37 H ATOM 320 HA LEU A 21 -5.417 -8.848 -6.517 1.00 1.65 H ATOM 321 HB2 LEU A 21 -6.571 -6.204 -5.450 1.00 1.75 H ATOM 322 HB3 LEU A 21 -7.195 -7.110 -6.821 1.00 2.07 H ATOM 323 HG LEU A 21 -7.384 -9.082 -5.021 1.00 2.59 H ATOM 324 HD11 LEU A 21 -6.461 -7.644 -3.118 1.00 3.30 H ATOM 325 HD12 LEU A 21 -7.819 -6.546 -3.366 1.00 2.21 H ATOM 326 HD13 LEU A 21 -8.106 -8.221 -2.838 1.00 3.17 H ATOM 327 HD21 LEU A 21 -9.222 -8.108 -6.348 1.00 2.94 H ATOM 328 HD22 LEU A 21 -9.718 -8.399 -4.682 1.00 2.84 H ATOM 329 HD23 LEU A 21 -9.343 -6.745 -5.222 1.00 2.13 H ATOM 330 N ASP A 22 -4.917 -5.750 -7.425 1.00 1.17 N ATOM 331 CA ASP A 22 -4.316 -4.737 -8.291 1.00 1.22 C ATOM 332 C ASP A 22 -4.084 -3.440 -7.503 1.00 0.97 C ATOM 333 O ASP A 22 -3.623 -2.431 -8.038 1.00 1.26 O ATOM 334 CB ASP A 22 -5.271 -4.494 -9.465 1.00 1.60 C ATOM 335 CG ASP A 22 -4.795 -3.396 -10.415 1.00 2.79 C ATOM 336 OD1 ASP A 22 -3.863 -3.645 -11.215 1.00 4.11 O ATOM 337 OD2 ASP A 22 -5.357 -2.277 -10.379 1.00 3.24 O ATOM 338 H ASP A 22 -5.717 -5.436 -6.904 1.00 1.22 H ATOM 339 HA ASP A 22 -3.362 -5.093 -8.676 1.00 1.45 H ATOM 340 HB2 ASP A 22 -5.372 -5.422 -10.019 1.00 2.33 H ATOM 341 HB3 ASP A 22 -6.258 -4.230 -9.080 1.00 1.51 H ATOM 342 N LYS A 23 -4.455 -3.422 -6.219 1.00 0.86 N ATOM 343 CA LYS A 23 -4.445 -2.223 -5.398 1.00 1.11 C ATOM 344 C LYS A 23 -3.283 -2.344 -4.417 1.00 0.89 C ATOM 345 O LYS A 23 -2.976 -3.456 -3.969 1.00 0.95 O ATOM 346 CB LYS A 23 -5.810 -2.006 -4.713 1.00 1.71 C ATOM 347 CG LYS A 23 -7.093 -2.176 -5.562 1.00 1.84 C ATOM 348 CD LYS A 23 -7.077 -1.719 -7.033 1.00 2.72 C ATOM 349 CE LYS A 23 -6.543 -0.305 -7.263 1.00 2.87 C ATOM 350 NZ LYS A 23 -5.573 -0.256 -8.379 1.00 4.56 N ATOM 351 H LYS A 23 -4.639 -4.299 -5.760 1.00 0.96 H ATOM 352 HA LYS A 23 -4.245 -1.361 -6.029 1.00 1.31 H ATOM 353 HB2 LYS A 23 -5.890 -2.702 -3.880 1.00 2.70 H ATOM 354 HB3 LYS A 23 -5.815 -1.002 -4.291 1.00 2.06 H ATOM 355 HG2 LYS A 23 -7.356 -3.235 -5.560 1.00 2.18 H ATOM 356 HG3 LYS A 23 -7.900 -1.650 -5.049 1.00 2.39 H ATOM 357 HD2 LYS A 23 -6.510 -2.433 -7.621 1.00 4.11 H ATOM 358 HD3 LYS A 23 -8.093 -1.755 -7.419 1.00 3.55 H ATOM 359 HE2 LYS A 23 -7.378 0.365 -7.477 1.00 3.19 H ATOM 360 HE3 LYS A 23 -6.055 0.047 -6.354 1.00 3.03 H ATOM 361 HZ1 LYS A 23 -4.801 -0.899 -8.235 1.00 5.29 H ATOM 362 HZ2 LYS A 23 -5.997 -0.503 -9.267 1.00 4.96 H ATOM 363 HZ3 LYS A 23 -5.159 0.670 -8.457 1.00 5.38 H ATOM 364 N PHE A 24 -2.671 -1.215 -4.072 1.00 0.81 N ATOM 365 CA PHE A 24 -1.402 -1.133 -3.368 1.00 0.71 C ATOM 366 C PHE A 24 -1.644 -0.534 -1.991 1.00 0.58 C ATOM 367 O PHE A 24 -2.342 0.472 -1.844 1.00 0.63 O ATOM 368 CB PHE A 24 -0.356 -0.337 -4.174 1.00 1.00 C ATOM 369 CG PHE A 24 -0.856 0.811 -5.045 1.00 2.02 C ATOM 370 CD1 PHE A 24 -1.392 1.985 -4.476 1.00 3.75 C ATOM 371 CD2 PHE A 24 -0.757 0.716 -6.448 1.00 2.32 C ATOM 372 CE1 PHE A 24 -1.847 3.032 -5.297 1.00 5.24 C ATOM 373 CE2 PHE A 24 -1.198 1.767 -7.270 1.00 3.57 C ATOM 374 CZ PHE A 24 -1.748 2.923 -6.694 1.00 4.99 C ATOM 375 H PHE A 24 -3.084 -0.330 -4.342 1.00 0.89 H ATOM 376 HA PHE A 24 -1.015 -2.142 -3.239 1.00 0.65 H ATOM 377 HB2 PHE A 24 0.399 0.049 -3.487 1.00 1.19 H ATOM 378 HB3 PHE A 24 0.154 -1.053 -4.817 1.00 2.11 H ATOM 379 HD1 PHE A 24 -1.469 2.099 -3.405 1.00 4.21 H ATOM 380 HD2 PHE A 24 -0.334 -0.165 -6.907 1.00 2.49 H ATOM 381 HE1 PHE A 24 -2.300 3.909 -4.855 1.00 6.74 H ATOM 382 HE2 PHE A 24 -1.126 1.677 -8.346 1.00 3.89 H ATOM 383 HZ PHE A 24 -2.123 3.712 -7.326 1.00 6.17 H ATOM 384 N TRP A 25 -1.124 -1.207 -0.970 1.00 0.50 N ATOM 385 CA TRP A 25 -1.271 -0.814 0.423 1.00 0.40 C ATOM 386 C TRP A 25 0.085 -0.980 1.114 1.00 0.44 C ATOM 387 O TRP A 25 0.990 -1.608 0.562 1.00 0.72 O ATOM 388 CB TRP A 25 -2.374 -1.663 1.077 1.00 0.44 C ATOM 389 CG TRP A 25 -3.614 -1.854 0.247 1.00 0.58 C ATOM 390 CD1 TRP A 25 -3.800 -2.807 -0.695 1.00 0.71 C ATOM 391 CD2 TRP A 25 -4.806 -1.021 0.198 1.00 0.81 C ATOM 392 NE1 TRP A 25 -5.011 -2.611 -1.325 1.00 0.84 N ATOM 393 CE2 TRP A 25 -5.668 -1.511 -0.826 1.00 0.92 C ATOM 394 CE3 TRP A 25 -5.237 0.104 0.919 1.00 1.07 C ATOM 395 CZ2 TRP A 25 -6.900 -0.913 -1.123 1.00 1.20 C ATOM 396 CZ3 TRP A 25 -6.482 0.703 0.640 1.00 1.40 C ATOM 397 CH2 TRP A 25 -7.312 0.200 -0.376 1.00 1.43 C ATOM 398 H TRP A 25 -0.502 -1.984 -1.155 1.00 0.56 H ATOM 399 HA TRP A 25 -1.565 0.238 0.470 1.00 0.46 H ATOM 400 HB2 TRP A 25 -1.983 -2.632 1.374 1.00 0.50 H ATOM 401 HB3 TRP A 25 -2.661 -1.156 1.993 1.00 0.50 H ATOM 402 HD1 TRP A 25 -3.086 -3.572 -0.965 1.00 0.81 H ATOM 403 HE1 TRP A 25 -5.349 -3.193 -2.083 1.00 1.00 H ATOM 404 HE3 TRP A 25 -4.576 0.470 1.693 1.00 1.08 H ATOM 405 HZ2 TRP A 25 -7.529 -1.300 -1.910 1.00 1.30 H ATOM 406 HZ3 TRP A 25 -6.812 1.565 1.192 1.00 1.66 H ATOM 407 HH2 TRP A 25 -8.262 0.672 -0.591 1.00 1.68 H ATOM 408 N HIS A 26 0.220 -0.481 2.340 1.00 0.46 N ATOM 409 CA HIS A 26 1.321 -0.859 3.231 1.00 0.45 C ATOM 410 C HIS A 26 1.018 -2.181 3.935 1.00 0.46 C ATOM 411 O HIS A 26 -0.116 -2.661 3.896 1.00 0.49 O ATOM 412 CB HIS A 26 1.540 0.214 4.304 1.00 0.46 C ATOM 413 CG HIS A 26 1.829 1.568 3.737 1.00 0.49 C ATOM 414 ND1 HIS A 26 0.951 2.634 3.782 1.00 0.40 N ATOM 415 CD2 HIS A 26 2.986 1.967 3.125 1.00 0.63 C ATOM 416 CE1 HIS A 26 1.598 3.667 3.239 1.00 0.44 C ATOM 417 NE2 HIS A 26 2.822 3.301 2.834 1.00 0.58 N ATOM 418 H HIS A 26 -0.581 -0.010 2.732 1.00 0.68 H ATOM 419 HA HIS A 26 2.228 -0.976 2.635 1.00 0.54 H ATOM 420 HB2 HIS A 26 0.655 0.270 4.938 1.00 0.42 H ATOM 421 HB3 HIS A 26 2.375 -0.064 4.947 1.00 0.57 H ATOM 422 HD2 HIS A 26 3.866 1.377 2.938 1.00 0.75 H ATOM 423 HE1 HIS A 26 1.182 4.662 3.164 1.00 0.42 H ATOM 424 HE2 HIS A 26 3.477 3.953 2.399 1.00 0.64 H ATOM 425 N LYS A 27 2.007 -2.681 4.687 1.00 0.48 N ATOM 426 CA LYS A 27 1.963 -3.872 5.531 1.00 0.55 C ATOM 427 C LYS A 27 0.597 -4.097 6.174 1.00 0.64 C ATOM 428 O LYS A 27 -0.056 -5.088 5.844 1.00 0.91 O ATOM 429 CB LYS A 27 3.087 -3.756 6.581 1.00 0.73 C ATOM 430 CG LYS A 27 3.193 -4.941 7.554 1.00 1.40 C ATOM 431 CD LYS A 27 3.806 -6.192 6.904 1.00 1.73 C ATOM 432 CE LYS A 27 3.013 -7.463 7.218 1.00 3.18 C ATOM 433 NZ LYS A 27 1.714 -7.500 6.516 1.00 4.72 N ATOM 434 H LYS A 27 2.916 -2.232 4.617 1.00 0.53 H ATOM 435 HA LYS A 27 2.173 -4.727 4.889 1.00 0.77 H ATOM 436 HB2 LYS A 27 4.038 -3.648 6.066 1.00 1.11 H ATOM 437 HB3 LYS A 27 2.933 -2.850 7.169 1.00 1.38 H ATOM 438 HG2 LYS A 27 3.837 -4.643 8.382 1.00 2.41 H ATOM 439 HG3 LYS A 27 2.215 -5.163 7.978 1.00 2.53 H ATOM 440 HD2 LYS A 27 3.899 -6.071 5.824 1.00 2.25 H ATOM 441 HD3 LYS A 27 4.811 -6.315 7.304 1.00 2.47 H ATOM 442 HE2 LYS A 27 3.604 -8.327 6.913 1.00 3.72 H ATOM 443 HE3 LYS A 27 2.852 -7.524 8.295 1.00 3.69 H ATOM 444 HZ1 LYS A 27 1.167 -6.670 6.688 1.00 5.32 H ATOM 445 HZ2 LYS A 27 1.850 -7.588 5.511 1.00 5.18 H ATOM 446 HZ3 LYS A 27 1.161 -8.286 6.844 1.00 5.57 H ATOM 447 N ALA A 28 0.217 -3.266 7.142 1.00 0.68 N ATOM 448 CA ALA A 28 -1.048 -3.376 7.864 1.00 1.00 C ATOM 449 C ALA A 28 -2.194 -2.563 7.237 1.00 0.80 C ATOM 450 O ALA A 28 -3.268 -2.489 7.835 1.00 0.92 O ATOM 451 CB ALA A 28 -0.826 -3.060 9.345 1.00 1.44 C ATOM 452 H ALA A 28 0.817 -2.485 7.372 1.00 0.67 H ATOM 453 HA ALA A 28 -1.365 -4.419 7.823 1.00 1.35 H ATOM 454 HB1 ALA A 28 -0.020 -3.680 9.737 1.00 2.20 H ATOM 455 HB2 ALA A 28 -0.580 -2.010 9.484 1.00 1.48 H ATOM 456 HB3 ALA A 28 -1.729 -3.292 9.910 1.00 2.56 H ATOM 457 N CYS A 29 -2.000 -1.960 6.057 1.00 0.59 N ATOM 458 CA CYS A 29 -3.042 -1.256 5.308 1.00 0.64 C ATOM 459 C CYS A 29 -3.706 -2.195 4.280 1.00 0.74 C ATOM 460 O CYS A 29 -4.699 -1.813 3.663 1.00 0.99 O ATOM 461 CB CYS A 29 -2.444 0.001 4.652 1.00 0.55 C ATOM 462 SG CYS A 29 -2.038 1.242 5.923 1.00 0.51 S ATOM 463 H CYS A 29 -1.109 -2.065 5.595 1.00 0.53 H ATOM 464 HA CYS A 29 -3.820 -0.921 5.992 1.00 0.72 H ATOM 465 HB2 CYS A 29 -1.557 -0.271 4.094 1.00 0.51 H ATOM 466 HB3 CYS A 29 -3.173 0.421 3.958 1.00 0.66 H ATOM 467 N PHE A 30 -3.241 -3.444 4.148 1.00 0.64 N ATOM 468 CA PHE A 30 -3.914 -4.484 3.371 1.00 0.67 C ATOM 469 C PHE A 30 -5.370 -4.618 3.818 1.00 0.94 C ATOM 470 O PHE A 30 -5.651 -5.003 4.957 1.00 1.92 O ATOM 471 CB PHE A 30 -3.166 -5.819 3.506 1.00 0.90 C ATOM 472 CG PHE A 30 -3.895 -7.041 2.957 1.00 1.01 C ATOM 473 CD1 PHE A 30 -4.562 -7.001 1.716 1.00 1.59 C ATOM 474 CD2 PHE A 30 -3.911 -8.236 3.702 1.00 2.03 C ATOM 475 CE1 PHE A 30 -5.250 -8.134 1.244 1.00 1.65 C ATOM 476 CE2 PHE A 30 -4.576 -9.375 3.217 1.00 2.31 C ATOM 477 CZ PHE A 30 -5.247 -9.326 1.985 1.00 1.55 C ATOM 478 OXT PHE A 30 -6.250 -4.322 2.983 1.00 1.76 O ATOM 479 H PHE A 30 -2.408 -3.689 4.660 1.00 0.64 H ATOM 480 HA PHE A 30 -3.913 -4.183 2.324 1.00 1.00 H ATOM 481 HB2 PHE A 30 -2.200 -5.736 3.010 1.00 1.30 H ATOM 482 HB3 PHE A 30 -2.980 -5.985 4.568 1.00 1.11 H ATOM 483 HD1 PHE A 30 -4.544 -6.108 1.109 1.00 2.58 H ATOM 484 HD2 PHE A 30 -3.399 -8.290 4.651 1.00 2.96 H ATOM 485 HE1 PHE A 30 -5.770 -8.103 0.297 1.00 2.49 H ATOM 486 HE2 PHE A 30 -4.563 -10.293 3.790 1.00 3.39 H ATOM 487 HZ PHE A 30 -5.755 -10.203 1.606 1.00 1.82 H TER 488 PHE A 30 HETATM 489 ZN ZN A 31 -0.840 2.843 4.737 1.00 0.35 ZN