HETATM 1 C ACE A 0 8.247 9.178 -7.924 1.00 2.60 C HETATM 2 O ACE A 0 8.273 7.951 -7.944 1.00 3.34 O HETATM 3 CH3 ACE A 0 9.556 9.944 -7.929 1.00 3.13 C HETATM 4 H1 ACE A 0 9.649 10.535 -7.022 1.00 3.45 H HETATM 5 H2 ACE A 0 10.388 9.240 -7.971 1.00 3.77 H HETATM 6 H3 ACE A 0 9.594 10.592 -8.805 1.00 3.54 H ATOM 7 N MET A 1 7.119 9.892 -8.029 1.00 2.15 N ATOM 8 CA MET A 1 5.771 9.371 -8.289 1.00 1.75 C ATOM 9 C MET A 1 5.490 8.032 -7.587 1.00 1.52 C ATOM 10 O MET A 1 5.027 7.070 -8.212 1.00 1.97 O ATOM 11 CB MET A 1 5.502 9.287 -9.807 1.00 2.23 C ATOM 12 CG MET A 1 5.515 10.622 -10.562 1.00 2.91 C ATOM 13 SD MET A 1 7.153 11.336 -10.862 1.00 4.68 S ATOM 14 CE MET A 1 6.842 12.185 -12.435 1.00 5.54 C ATOM 15 H MET A 1 7.213 10.902 -8.049 1.00 2.75 H ATOM 16 HA MET A 1 5.064 10.086 -7.878 1.00 1.81 H ATOM 17 HB2 MET A 1 6.224 8.612 -10.267 1.00 3.08 H ATOM 18 HB3 MET A 1 4.510 8.859 -9.952 1.00 2.65 H ATOM 19 HG2 MET A 1 5.045 10.449 -11.530 1.00 3.43 H ATOM 20 HG3 MET A 1 4.905 11.350 -10.029 1.00 3.41 H ATOM 21 HE1 MET A 1 5.903 12.732 -12.379 1.00 5.61 H ATOM 22 HE2 MET A 1 7.655 12.880 -12.647 1.00 6.38 H ATOM 23 HE3 MET A 1 6.784 11.455 -13.241 1.00 5.84 H ATOM 24 N ASN A 2 5.732 7.957 -6.276 1.00 1.33 N ATOM 25 CA ASN A 2 5.529 6.703 -5.553 1.00 1.21 C ATOM 26 C ASN A 2 4.045 6.608 -5.191 1.00 1.10 C ATOM 27 O ASN A 2 3.393 7.645 -5.032 1.00 1.20 O ATOM 28 CB ASN A 2 6.399 6.628 -4.285 1.00 1.32 C ATOM 29 CG ASN A 2 7.693 5.876 -4.553 1.00 1.53 C ATOM 30 OD1 ASN A 2 7.677 4.681 -4.834 1.00 1.67 O ATOM 31 ND2 ASN A 2 8.831 6.543 -4.498 1.00 1.87 N ATOM 32 H ASN A 2 6.034 8.777 -5.774 1.00 1.67 H ATOM 33 HA ASN A 2 5.795 5.871 -6.206 1.00 1.22 H ATOM 34 HB2 ASN A 2 6.597 7.619 -3.884 1.00 1.48 H ATOM 35 HB3 ASN A 2 5.859 6.072 -3.519 1.00 1.24 H ATOM 36 HD21 ASN A 2 8.861 7.540 -4.297 1.00 2.12 H ATOM 37 HD22 ASN A 2 9.676 6.034 -4.724 1.00 2.03 H ATOM 38 N PRO A 3 3.485 5.389 -5.111 1.00 0.99 N ATOM 39 CA PRO A 3 2.071 5.194 -4.827 1.00 0.90 C ATOM 40 C PRO A 3 1.728 5.693 -3.427 1.00 0.81 C ATOM 41 O PRO A 3 2.614 5.945 -2.613 1.00 0.91 O ATOM 42 CB PRO A 3 1.821 3.692 -4.992 1.00 1.05 C ATOM 43 CG PRO A 3 3.189 3.057 -4.764 1.00 1.17 C ATOM 44 CD PRO A 3 4.158 4.112 -5.285 1.00 1.09 C ATOM 45 HA PRO A 3 1.475 5.747 -5.551 1.00 0.93 H ATOM 46 HB2 PRO A 3 1.075 3.310 -4.293 1.00 1.13 H ATOM 47 HB3 PRO A 3 1.510 3.498 -6.017 1.00 1.11 H ATOM 48 HG2 PRO A 3 3.359 2.908 -3.701 1.00 1.26 H ATOM 49 HG3 PRO A 3 3.289 2.116 -5.300 1.00 1.31 H ATOM 50 HD2 PRO A 3 5.091 4.067 -4.723 1.00 1.21 H ATOM 51 HD3 PRO A 3 4.347 3.953 -6.345 1.00 1.09 H ATOM 52 N ASN A 4 0.438 5.811 -3.120 1.00 0.75 N ATOM 53 CA ASN A 4 -0.023 6.137 -1.775 1.00 0.72 C ATOM 54 C ASN A 4 -1.053 5.086 -1.394 1.00 0.59 C ATOM 55 O ASN A 4 -1.809 4.608 -2.246 1.00 0.71 O ATOM 56 CB ASN A 4 -0.574 7.574 -1.660 1.00 1.02 C ATOM 57 CG ASN A 4 0.463 8.669 -1.910 1.00 1.16 C ATOM 58 OD1 ASN A 4 0.888 9.379 -0.999 1.00 1.71 O ATOM 59 ND2 ASN A 4 0.889 8.844 -3.150 1.00 1.27 N ATOM 60 H ASN A 4 -0.268 5.493 -3.776 1.00 0.84 H ATOM 61 HA ASN A 4 0.807 6.042 -1.077 1.00 0.72 H ATOM 62 HB2 ASN A 4 -1.409 7.699 -2.347 1.00 1.11 H ATOM 63 HB3 ASN A 4 -0.970 7.707 -0.652 1.00 1.18 H ATOM 64 HD21 ASN A 4 0.531 8.252 -3.880 1.00 1.64 H ATOM 65 HD22 ASN A 4 1.663 9.462 -3.360 1.00 1.47 H ATOM 66 N CYS A 5 -1.048 4.727 -0.115 1.00 0.48 N ATOM 67 CA CYS A 5 -1.835 3.692 0.515 1.00 0.41 C ATOM 68 C CYS A 5 -3.289 3.996 0.214 1.00 0.44 C ATOM 69 O CYS A 5 -3.802 5.050 0.605 1.00 0.52 O ATOM 70 CB CYS A 5 -1.503 3.741 2.008 1.00 0.43 C ATOM 71 SG CYS A 5 -2.264 2.433 3.016 1.00 0.40 S ATOM 72 H CYS A 5 -0.413 5.220 0.502 1.00 0.49 H ATOM 73 HA CYS A 5 -1.555 2.720 0.105 1.00 0.53 H ATOM 74 HB2 CYS A 5 -0.423 3.658 2.118 1.00 0.59 H ATOM 75 HB3 CYS A 5 -1.805 4.716 2.386 1.00 0.47 H ATOM 76 N ALA A 6 -3.945 3.091 -0.504 1.00 0.63 N ATOM 77 CA ALA A 6 -5.356 3.242 -0.809 1.00 0.87 C ATOM 78 C ALA A 6 -6.219 3.211 0.464 1.00 0.80 C ATOM 79 O ALA A 6 -7.397 3.569 0.389 1.00 1.00 O ATOM 80 CB ALA A 6 -5.769 2.179 -1.828 1.00 1.16 C ATOM 81 H ALA A 6 -3.448 2.260 -0.802 1.00 0.71 H ATOM 82 HA ALA A 6 -5.500 4.220 -1.272 1.00 1.00 H ATOM 83 HB1 ALA A 6 -5.493 1.191 -1.462 1.00 2.04 H ATOM 84 HB2 ALA A 6 -6.846 2.223 -1.992 1.00 1.56 H ATOM 85 HB3 ALA A 6 -5.256 2.361 -2.772 1.00 2.43 H ATOM 86 N ARG A 7 -5.674 2.844 1.635 1.00 0.64 N ATOM 87 CA ARG A 7 -6.407 2.889 2.894 1.00 0.64 C ATOM 88 C ARG A 7 -6.133 4.214 3.583 1.00 0.81 C ATOM 89 O ARG A 7 -7.055 5.020 3.690 1.00 1.30 O ATOM 90 CB ARG A 7 -6.049 1.681 3.781 1.00 0.55 C ATOM 91 CG ARG A 7 -7.003 1.439 4.951 1.00 0.81 C ATOM 92 CD ARG A 7 -8.440 1.151 4.474 1.00 2.43 C ATOM 93 NE ARG A 7 -9.351 2.239 4.856 1.00 3.11 N ATOM 94 CZ ARG A 7 -9.719 2.495 6.113 1.00 3.45 C ATOM 95 NH1 ARG A 7 -9.614 1.559 7.045 1.00 3.53 N ATOM 96 NH2 ARG A 7 -10.165 3.696 6.441 1.00 4.58 N ATOM 97 H ARG A 7 -4.687 2.609 1.663 1.00 0.62 H ATOM 98 HA ARG A 7 -7.472 2.856 2.678 1.00 0.78 H ATOM 99 HB2 ARG A 7 -6.079 0.779 3.187 1.00 0.78 H ATOM 100 HB3 ARG A 7 -5.042 1.801 4.172 1.00 0.80 H ATOM 101 HG2 ARG A 7 -6.644 0.569 5.503 1.00 1.58 H ATOM 102 HG3 ARG A 7 -6.973 2.294 5.627 1.00 2.04 H ATOM 103 HD2 ARG A 7 -8.462 1.017 3.394 1.00 3.63 H ATOM 104 HD3 ARG A 7 -8.786 0.221 4.917 1.00 3.12 H ATOM 105 HE ARG A 7 -9.628 2.897 4.127 1.00 3.98 H ATOM 106 HH11 ARG A 7 -9.288 0.615 6.844 1.00 3.46 H ATOM 107 HH12 ARG A 7 -9.723 1.776 8.036 1.00 4.27 H ATOM 108 HH21 ARG A 7 -10.031 4.475 5.792 1.00 5.22 H ATOM 109 HH22 ARG A 7 -10.295 3.963 7.417 1.00 5.15 H ATOM 110 N CYS A 8 -4.916 4.434 4.080 1.00 0.57 N ATOM 111 CA CYS A 8 -4.672 5.497 5.042 1.00 0.71 C ATOM 112 C CYS A 8 -4.425 6.848 4.351 1.00 0.64 C ATOM 113 O CYS A 8 -4.590 7.889 4.989 1.00 0.73 O ATOM 114 CB CYS A 8 -3.492 5.075 5.920 1.00 0.76 C ATOM 115 SG CYS A 8 -1.998 5.146 4.911 1.00 0.66 S ATOM 116 H CYS A 8 -4.154 3.796 3.880 1.00 0.47 H ATOM 117 HA CYS A 8 -5.549 5.594 5.685 1.00 0.90 H ATOM 118 HB2 CYS A 8 -3.400 5.763 6.759 1.00 0.91 H ATOM 119 HB3 CYS A 8 -3.646 4.064 6.308 1.00 0.80 H ATOM 120 N GLY A 9 -3.964 6.838 3.094 1.00 0.63 N ATOM 121 CA GLY A 9 -3.586 8.013 2.323 1.00 0.65 C ATOM 122 C GLY A 9 -2.090 8.349 2.319 1.00 0.52 C ATOM 123 O GLY A 9 -1.723 9.342 1.692 1.00 0.63 O ATOM 124 H GLY A 9 -3.772 5.931 2.682 1.00 0.75 H ATOM 125 HA2 GLY A 9 -3.892 7.856 1.293 1.00 0.74 H ATOM 126 HA3 GLY A 9 -4.128 8.883 2.697 1.00 0.82 H ATOM 127 N LYS A 10 -1.211 7.617 3.015 1.00 0.46 N ATOM 128 CA LYS A 10 0.211 7.989 3.123 1.00 0.58 C ATOM 129 C LYS A 10 1.036 7.276 2.049 1.00 0.57 C ATOM 130 O LYS A 10 0.623 6.218 1.577 1.00 0.52 O ATOM 131 CB LYS A 10 0.708 7.664 4.538 1.00 0.83 C ATOM 132 CG LYS A 10 -0.065 8.445 5.617 1.00 0.97 C ATOM 133 CD LYS A 10 0.714 9.661 6.133 1.00 1.79 C ATOM 134 CE LYS A 10 -0.096 10.553 7.082 1.00 2.98 C ATOM 135 NZ LYS A 10 -0.648 9.818 8.236 1.00 3.71 N ATOM 136 H LYS A 10 -1.536 6.828 3.570 1.00 0.51 H ATOM 137 HA LYS A 10 0.305 9.062 2.967 1.00 0.64 H ATOM 138 HB2 LYS A 10 0.576 6.598 4.720 1.00 0.91 H ATOM 139 HB3 LYS A 10 1.773 7.885 4.613 1.00 0.95 H ATOM 140 HG2 LYS A 10 -1.022 8.792 5.232 1.00 1.45 H ATOM 141 HG3 LYS A 10 -0.271 7.760 6.439 1.00 1.06 H ATOM 142 HD2 LYS A 10 1.604 9.309 6.646 1.00 2.00 H ATOM 143 HD3 LYS A 10 1.021 10.271 5.283 1.00 2.70 H ATOM 144 HE2 LYS A 10 0.552 11.353 7.444 1.00 3.64 H ATOM 145 HE3 LYS A 10 -0.917 11.007 6.524 1.00 3.88 H ATOM 146 HZ1 LYS A 10 0.084 9.392 8.803 1.00 3.65 H ATOM 147 HZ2 LYS A 10 -1.152 10.446 8.852 1.00 4.93 H ATOM 148 HZ3 LYS A 10 -1.293 9.103 7.921 1.00 4.12 H ATOM 149 N ILE A 11 2.170 7.846 1.626 1.00 0.67 N ATOM 150 CA ILE A 11 2.998 7.285 0.549 1.00 0.68 C ATOM 151 C ILE A 11 3.436 5.839 0.844 1.00 0.61 C ATOM 152 O ILE A 11 3.615 5.472 2.006 1.00 0.62 O ATOM 153 CB ILE A 11 4.146 8.251 0.178 1.00 0.75 C ATOM 154 CG1 ILE A 11 4.492 8.139 -1.321 1.00 0.86 C ATOM 155 CG2 ILE A 11 5.389 8.072 1.065 1.00 0.90 C ATOM 156 CD1 ILE A 11 5.408 9.260 -1.814 1.00 1.32 C ATOM 157 H ILE A 11 2.478 8.703 2.064 1.00 0.73 H ATOM 158 HA ILE A 11 2.340 7.239 -0.315 1.00 0.69 H ATOM 159 HB ILE A 11 3.766 9.261 0.327 1.00 0.84 H ATOM 160 HG12 ILE A 11 4.954 7.174 -1.532 1.00 1.00 H ATOM 161 HG13 ILE A 11 3.570 8.215 -1.897 1.00 0.99 H ATOM 162 HG21 ILE A 11 5.101 8.101 2.114 1.00 2.19 H ATOM 163 HG22 ILE A 11 5.874 7.117 0.856 1.00 1.59 H ATOM 164 HG23 ILE A 11 6.107 8.870 0.881 1.00 1.70 H ATOM 165 HD11 ILE A 11 5.016 10.217 -1.481 1.00 2.29 H ATOM 166 HD12 ILE A 11 6.419 9.121 -1.432 1.00 2.18 H ATOM 167 HD13 ILE A 11 5.432 9.260 -2.903 1.00 1.67 H ATOM 168 N VAL A 12 3.665 5.049 -0.201 1.00 0.60 N ATOM 169 CA VAL A 12 4.000 3.631 -0.188 1.00 0.51 C ATOM 170 C VAL A 12 5.295 3.496 -0.993 1.00 0.47 C ATOM 171 O VAL A 12 5.380 4.000 -2.115 1.00 0.96 O ATOM 172 CB VAL A 12 2.811 2.847 -0.792 1.00 0.68 C ATOM 173 CG1 VAL A 12 3.103 1.399 -1.215 1.00 0.79 C ATOM 174 CG2 VAL A 12 1.619 2.834 0.173 1.00 0.87 C ATOM 175 H VAL A 12 3.551 5.428 -1.136 1.00 0.69 H ATOM 176 HA VAL A 12 4.166 3.302 0.836 1.00 0.50 H ATOM 177 HB VAL A 12 2.490 3.375 -1.689 1.00 1.04 H ATOM 178 HG11 VAL A 12 4.049 1.324 -1.748 1.00 1.86 H ATOM 179 HG12 VAL A 12 3.136 0.746 -0.349 1.00 1.47 H ATOM 180 HG13 VAL A 12 2.300 1.051 -1.856 1.00 1.98 H ATOM 181 HG21 VAL A 12 1.369 3.848 0.470 1.00 1.68 H ATOM 182 HG22 VAL A 12 0.757 2.373 -0.309 1.00 1.26 H ATOM 183 HG23 VAL A 12 1.865 2.268 1.071 1.00 1.79 H ATOM 184 N TYR A 13 6.316 2.858 -0.423 1.00 0.47 N ATOM 185 CA TYR A 13 7.633 2.710 -1.044 1.00 0.53 C ATOM 186 C TYR A 13 7.654 1.445 -1.928 1.00 0.84 C ATOM 187 O TYR A 13 6.713 0.655 -1.872 1.00 1.26 O ATOM 188 CB TYR A 13 8.663 2.693 0.100 1.00 0.65 C ATOM 189 CG TYR A 13 8.707 3.998 0.882 1.00 0.81 C ATOM 190 CD1 TYR A 13 7.819 4.219 1.951 1.00 2.03 C ATOM 191 CD2 TYR A 13 9.613 5.012 0.525 1.00 1.47 C ATOM 192 CE1 TYR A 13 7.811 5.440 2.640 1.00 2.40 C ATOM 193 CE2 TYR A 13 9.621 6.237 1.215 1.00 1.57 C ATOM 194 CZ TYR A 13 8.712 6.460 2.268 1.00 1.61 C ATOM 195 OH TYR A 13 8.704 7.653 2.918 1.00 2.05 O ATOM 196 H TYR A 13 6.177 2.403 0.483 1.00 0.87 H ATOM 197 HA TYR A 13 7.831 3.576 -1.677 1.00 0.65 H ATOM 198 HB2 TYR A 13 8.425 1.875 0.782 1.00 0.87 H ATOM 199 HB3 TYR A 13 9.655 2.503 -0.298 1.00 0.78 H ATOM 200 HD1 TYR A 13 7.128 3.452 2.252 1.00 2.98 H ATOM 201 HD2 TYR A 13 10.319 4.847 -0.269 1.00 2.51 H ATOM 202 HE1 TYR A 13 7.112 5.577 3.452 1.00 3.56 H ATOM 203 HE2 TYR A 13 10.334 7.005 0.956 1.00 2.45 H ATOM 204 HH TYR A 13 7.983 7.674 3.570 1.00 2.93 H ATOM 205 N PRO A 14 8.683 1.169 -2.753 1.00 0.84 N ATOM 206 CA PRO A 14 8.782 -0.116 -3.455 1.00 1.00 C ATOM 207 C PRO A 14 9.022 -1.287 -2.490 1.00 1.05 C ATOM 208 O PRO A 14 8.549 -2.403 -2.719 1.00 1.76 O ATOM 209 CB PRO A 14 9.910 0.040 -4.472 1.00 1.10 C ATOM 210 CG PRO A 14 10.759 1.165 -3.894 1.00 0.98 C ATOM 211 CD PRO A 14 9.762 2.054 -3.154 1.00 0.83 C ATOM 212 HA PRO A 14 7.870 -0.299 -4.008 1.00 1.21 H ATOM 213 HB2 PRO A 14 10.486 -0.878 -4.597 1.00 1.18 H ATOM 214 HB3 PRO A 14 9.493 0.355 -5.429 1.00 1.32 H ATOM 215 HG2 PRO A 14 11.468 0.751 -3.179 1.00 0.95 H ATOM 216 HG3 PRO A 14 11.275 1.704 -4.685 1.00 1.18 H ATOM 217 HD2 PRO A 14 10.249 2.523 -2.303 1.00 0.73 H ATOM 218 HD3 PRO A 14 9.370 2.816 -3.828 1.00 1.02 H ATOM 219 N THR A 15 9.711 -1.018 -1.385 1.00 1.05 N ATOM 220 CA THR A 15 10.129 -1.938 -0.337 1.00 1.12 C ATOM 221 C THR A 15 8.970 -2.642 0.370 1.00 1.07 C ATOM 222 O THR A 15 9.186 -3.696 0.973 1.00 1.39 O ATOM 223 CB THR A 15 10.971 -1.141 0.690 1.00 1.22 C ATOM 224 OG1 THR A 15 10.743 0.256 0.565 1.00 2.29 O ATOM 225 CG2 THR A 15 12.458 -1.368 0.449 1.00 2.53 C ATOM 226 H THR A 15 10.043 -0.077 -1.212 1.00 1.54 H ATOM 227 HA THR A 15 10.745 -2.715 -0.789 1.00 1.29 H ATOM 228 HB THR A 15 10.726 -1.460 1.704 1.00 1.30 H ATOM 229 HG1 THR A 15 10.830 0.672 1.449 1.00 2.79 H ATOM 230 HG21 THR A 15 12.709 -1.065 -0.565 1.00 3.81 H ATOM 231 HG22 THR A 15 13.041 -0.783 1.163 1.00 3.24 H ATOM 232 HG23 THR A 15 12.696 -2.424 0.577 1.00 2.75 H ATOM 233 N GLU A 16 7.753 -2.100 0.303 1.00 0.92 N ATOM 234 CA GLU A 16 6.661 -2.477 1.194 1.00 0.92 C ATOM 235 C GLU A 16 5.494 -3.185 0.497 1.00 1.10 C ATOM 236 O GLU A 16 4.617 -3.670 1.207 1.00 1.58 O ATOM 237 CB GLU A 16 6.160 -1.225 1.931 1.00 1.08 C ATOM 238 CG GLU A 16 5.462 -0.263 0.986 1.00 3.01 C ATOM 239 CD GLU A 16 4.787 0.819 1.787 1.00 3.73 C ATOM 240 OE1 GLU A 16 5.485 1.777 2.189 1.00 4.55 O ATOM 241 OE2 GLU A 16 3.578 0.680 2.014 1.00 4.41 O ATOM 242 H GLU A 16 7.636 -1.240 -0.217 1.00 0.97 H ATOM 243 HA GLU A 16 7.040 -3.155 1.960 1.00 1.01 H ATOM 244 HB2 GLU A 16 5.469 -1.532 2.718 1.00 1.77 H ATOM 245 HB3 GLU A 16 6.969 -0.651 2.380 1.00 1.19 H ATOM 246 HG2 GLU A 16 6.226 0.190 0.371 1.00 3.89 H ATOM 247 HG3 GLU A 16 4.729 -0.768 0.356 1.00 3.77 H ATOM 248 N LYS A 17 5.441 -3.219 -0.846 1.00 1.10 N ATOM 249 CA LYS A 17 4.223 -3.493 -1.619 1.00 1.11 C ATOM 250 C LYS A 17 3.434 -4.705 -1.129 1.00 1.04 C ATOM 251 O LYS A 17 3.674 -5.835 -1.566 1.00 1.55 O ATOM 252 CB LYS A 17 4.523 -3.641 -3.125 1.00 1.47 C ATOM 253 CG LYS A 17 4.339 -2.356 -3.926 1.00 1.85 C ATOM 254 CD LYS A 17 5.566 -1.459 -3.945 1.00 1.95 C ATOM 255 CE LYS A 17 5.239 -0.093 -4.569 1.00 3.47 C ATOM 256 NZ LYS A 17 4.775 -0.215 -5.968 1.00 3.99 N ATOM 257 H LYS A 17 6.223 -2.841 -1.360 1.00 1.20 H ATOM 258 HA LYS A 17 3.568 -2.633 -1.485 1.00 1.05 H ATOM 259 HB2 LYS A 17 5.523 -4.040 -3.277 1.00 2.02 H ATOM 260 HB3 LYS A 17 3.819 -4.355 -3.558 1.00 2.55 H ATOM 261 HG2 LYS A 17 4.132 -2.643 -4.953 1.00 3.03 H ATOM 262 HG3 LYS A 17 3.497 -1.800 -3.520 1.00 3.00 H ATOM 263 HD2 LYS A 17 5.900 -1.324 -2.921 1.00 2.89 H ATOM 264 HD3 LYS A 17 6.363 -1.949 -4.509 1.00 2.00 H ATOM 265 HE2 LYS A 17 4.474 0.400 -3.966 1.00 4.55 H ATOM 266 HE3 LYS A 17 6.134 0.533 -4.546 1.00 4.08 H ATOM 267 HZ1 LYS A 17 5.463 -0.702 -6.538 1.00 3.65 H ATOM 268 HZ2 LYS A 17 3.898 -0.713 -6.034 1.00 4.49 H ATOM 269 HZ3 LYS A 17 4.656 0.695 -6.409 1.00 4.96 H ATOM 270 N VAL A 18 2.424 -4.466 -0.297 1.00 0.68 N ATOM 271 CA VAL A 18 1.346 -5.395 -0.099 1.00 0.71 C ATOM 272 C VAL A 18 0.689 -5.590 -1.461 1.00 0.85 C ATOM 273 O VAL A 18 0.393 -4.615 -2.157 1.00 0.99 O ATOM 274 CB VAL A 18 0.381 -4.859 0.966 1.00 0.76 C ATOM 275 CG1 VAL A 18 -0.881 -5.713 1.101 1.00 1.57 C ATOM 276 CG2 VAL A 18 1.075 -4.828 2.330 1.00 1.73 C ATOM 277 H VAL A 18 2.329 -3.582 0.170 1.00 0.82 H ATOM 278 HA VAL A 18 1.789 -6.316 0.253 1.00 1.01 H ATOM 279 HB VAL A 18 0.077 -3.852 0.690 1.00 1.79 H ATOM 280 HG11 VAL A 18 -0.623 -6.744 1.346 1.00 2.31 H ATOM 281 HG12 VAL A 18 -1.508 -5.300 1.889 1.00 2.40 H ATOM 282 HG13 VAL A 18 -1.451 -5.694 0.172 1.00 2.70 H ATOM 283 HG21 VAL A 18 1.487 -5.809 2.569 1.00 2.65 H ATOM 284 HG22 VAL A 18 1.874 -4.086 2.330 1.00 2.44 H ATOM 285 HG23 VAL A 18 0.352 -4.565 3.099 1.00 2.45 H ATOM 286 N ASN A 19 0.470 -6.845 -1.833 1.00 1.05 N ATOM 287 CA ASN A 19 -0.284 -7.230 -3.013 1.00 1.27 C ATOM 288 C ASN A 19 -1.711 -7.434 -2.515 1.00 1.20 C ATOM 289 O ASN A 19 -1.930 -7.882 -1.386 1.00 2.18 O ATOM 290 CB ASN A 19 0.273 -8.544 -3.599 1.00 2.27 C ATOM 291 CG ASN A 19 1.599 -8.432 -4.354 1.00 2.68 C ATOM 292 OD1 ASN A 19 1.920 -9.290 -5.172 1.00 3.67 O ATOM 293 ND2 ASN A 19 2.410 -7.412 -4.115 1.00 3.36 N ATOM 294 H ASN A 19 0.759 -7.598 -1.217 1.00 1.20 H ATOM 295 HA ASN A 19 -0.257 -6.443 -3.771 1.00 1.30 H ATOM 296 HB2 ASN A 19 0.384 -9.280 -2.802 1.00 3.53 H ATOM 297 HB3 ASN A 19 -0.466 -8.938 -4.299 1.00 2.79 H ATOM 298 HD21 ASN A 19 2.183 -6.750 -3.389 1.00 3.55 H ATOM 299 HD22 ASN A 19 3.264 -7.294 -4.652 1.00 4.33 H ATOM 300 N CYS A 20 -2.691 -7.039 -3.314 1.00 0.78 N ATOM 301 CA CYS A 20 -4.104 -7.067 -2.981 1.00 1.31 C ATOM 302 C CYS A 20 -4.867 -7.266 -4.294 1.00 1.19 C ATOM 303 O CYS A 20 -4.381 -7.982 -5.175 1.00 1.93 O ATOM 304 CB CYS A 20 -4.412 -5.758 -2.242 1.00 2.14 C ATOM 305 SG CYS A 20 -5.998 -5.783 -1.364 1.00 3.35 S ATOM 306 H CYS A 20 -2.460 -6.641 -4.220 1.00 1.10 H ATOM 307 HA CYS A 20 -4.307 -7.914 -2.329 1.00 1.85 H ATOM 308 HB2 CYS A 20 -3.634 -5.593 -1.495 1.00 2.24 H ATOM 309 HB3 CYS A 20 -4.392 -4.943 -2.963 1.00 3.04 H ATOM 310 HG CYS A 20 -5.776 -4.724 -0.568 1.00 3.92 H ATOM 311 N LEU A 21 -6.036 -6.632 -4.427 1.00 1.42 N ATOM 312 CA LEU A 21 -6.868 -6.610 -5.629 1.00 1.27 C ATOM 313 C LEU A 21 -5.980 -6.358 -6.849 1.00 1.02 C ATOM 314 O LEU A 21 -5.700 -7.296 -7.595 1.00 1.69 O ATOM 315 CB LEU A 21 -8.011 -5.579 -5.516 1.00 1.57 C ATOM 316 CG LEU A 21 -9.255 -6.089 -4.758 1.00 1.76 C ATOM 317 CD1 LEU A 21 -9.008 -6.283 -3.258 1.00 2.13 C ATOM 318 CD2 LEU A 21 -10.400 -5.086 -4.927 1.00 2.53 C ATOM 319 H LEU A 21 -6.377 -6.193 -3.584 1.00 2.31 H ATOM 320 HA LEU A 21 -7.323 -7.592 -5.749 1.00 1.58 H ATOM 321 HB2 LEU A 21 -7.646 -4.658 -5.060 1.00 1.96 H ATOM 322 HB3 LEU A 21 -8.332 -5.341 -6.533 1.00 1.94 H ATOM 323 HG LEU A 21 -9.570 -7.039 -5.190 1.00 2.16 H ATOM 324 HD11 LEU A 21 -8.647 -5.361 -2.803 1.00 3.21 H ATOM 325 HD12 LEU A 21 -9.934 -6.584 -2.766 1.00 2.79 H ATOM 326 HD13 LEU A 21 -8.285 -7.080 -3.100 1.00 2.12 H ATOM 327 HD21 LEU A 21 -10.611 -4.947 -5.987 1.00 2.90 H ATOM 328 HD22 LEU A 21 -11.302 -5.465 -4.444 1.00 3.03 H ATOM 329 HD23 LEU A 21 -10.134 -4.125 -4.488 1.00 3.57 H ATOM 330 N ASP A 22 -5.506 -5.121 -7.024 1.00 0.73 N ATOM 331 CA ASP A 22 -4.541 -4.723 -8.059 1.00 1.11 C ATOM 332 C ASP A 22 -3.777 -3.451 -7.629 1.00 1.11 C ATOM 333 O ASP A 22 -3.289 -2.686 -8.462 1.00 1.52 O ATOM 334 CB ASP A 22 -5.288 -4.569 -9.401 1.00 1.62 C ATOM 335 CG ASP A 22 -4.402 -4.181 -10.587 1.00 3.28 C ATOM 336 OD1 ASP A 22 -3.307 -4.766 -10.772 1.00 5.02 O ATOM 337 OD2 ASP A 22 -4.801 -3.271 -11.353 1.00 3.65 O ATOM 338 H ASP A 22 -5.829 -4.396 -6.406 1.00 1.03 H ATOM 339 HA ASP A 22 -3.806 -5.517 -8.175 1.00 1.53 H ATOM 340 HB2 ASP A 22 -5.763 -5.516 -9.648 1.00 2.34 H ATOM 341 HB3 ASP A 22 -6.077 -3.828 -9.289 1.00 1.59 H ATOM 342 N LYS A 23 -3.717 -3.163 -6.323 1.00 0.82 N ATOM 343 CA LYS A 23 -3.169 -1.922 -5.761 1.00 0.94 C ATOM 344 C LYS A 23 -2.437 -2.188 -4.460 1.00 0.65 C ATOM 345 O LYS A 23 -2.540 -3.279 -3.897 1.00 0.79 O ATOM 346 CB LYS A 23 -4.251 -0.844 -5.553 1.00 1.37 C ATOM 347 CG LYS A 23 -5.603 -1.380 -5.062 1.00 1.25 C ATOM 348 CD LYS A 23 -6.552 -0.231 -4.698 1.00 1.74 C ATOM 349 CE LYS A 23 -7.997 -0.724 -4.579 1.00 2.12 C ATOM 350 NZ LYS A 23 -8.610 -0.930 -5.904 1.00 2.30 N ATOM 351 H LYS A 23 -3.888 -3.916 -5.668 1.00 0.77 H ATOM 352 HA LYS A 23 -2.430 -1.529 -6.462 1.00 1.40 H ATOM 353 HB2 LYS A 23 -3.901 -0.091 -4.845 1.00 2.12 H ATOM 354 HB3 LYS A 23 -4.370 -0.317 -6.491 1.00 2.08 H ATOM 355 HG2 LYS A 23 -6.049 -1.990 -5.846 1.00 1.56 H ATOM 356 HG3 LYS A 23 -5.450 -2.007 -4.185 1.00 1.88 H ATOM 357 HD2 LYS A 23 -6.239 0.184 -3.740 1.00 2.60 H ATOM 358 HD3 LYS A 23 -6.498 0.559 -5.450 1.00 2.43 H ATOM 359 HE2 LYS A 23 -8.024 -1.656 -4.011 1.00 3.11 H ATOM 360 HE3 LYS A 23 -8.585 0.021 -4.038 1.00 3.01 H ATOM 361 HZ1 LYS A 23 -8.049 -1.518 -6.514 1.00 3.10 H ATOM 362 HZ2 LYS A 23 -9.539 -1.332 -5.825 1.00 2.78 H ATOM 363 HZ3 LYS A 23 -8.708 -0.046 -6.395 1.00 2.73 H ATOM 364 N PHE A 24 -1.760 -1.149 -3.979 1.00 0.71 N ATOM 365 CA PHE A 24 -0.733 -1.242 -2.947 1.00 0.70 C ATOM 366 C PHE A 24 -1.158 -0.549 -1.658 1.00 0.59 C ATOM 367 O PHE A 24 -1.872 0.458 -1.677 1.00 0.68 O ATOM 368 CB PHE A 24 0.567 -0.604 -3.439 1.00 1.02 C ATOM 369 CG PHE A 24 1.050 -1.057 -4.799 1.00 1.55 C ATOM 370 CD1 PHE A 24 1.302 -2.419 -5.045 1.00 3.25 C ATOM 371 CD2 PHE A 24 1.288 -0.106 -5.808 1.00 1.76 C ATOM 372 CE1 PHE A 24 1.830 -2.817 -6.283 1.00 4.05 C ATOM 373 CE2 PHE A 24 1.807 -0.511 -7.047 1.00 2.30 C ATOM 374 CZ PHE A 24 2.082 -1.868 -7.285 1.00 3.23 C ATOM 375 H PHE A 24 -1.906 -0.276 -4.470 1.00 0.94 H ATOM 376 HA PHE A 24 -0.546 -2.297 -2.739 1.00 0.70 H ATOM 377 HB2 PHE A 24 0.436 0.480 -3.452 1.00 1.06 H ATOM 378 HB3 PHE A 24 1.345 -0.834 -2.712 1.00 1.50 H ATOM 379 HD1 PHE A 24 1.120 -3.163 -4.280 1.00 4.23 H ATOM 380 HD2 PHE A 24 1.066 0.938 -5.643 1.00 2.64 H ATOM 381 HE1 PHE A 24 2.064 -3.856 -6.460 1.00 5.53 H ATOM 382 HE2 PHE A 24 1.985 0.225 -7.819 1.00 2.89 H ATOM 383 HZ PHE A 24 2.477 -2.191 -8.240 1.00 3.93 H ATOM 384 N TRP A 25 -0.724 -1.138 -0.545 1.00 0.51 N ATOM 385 CA TRP A 25 -1.054 -0.755 0.818 1.00 0.44 C ATOM 386 C TRP A 25 0.233 -0.812 1.641 1.00 0.48 C ATOM 387 O TRP A 25 1.155 -1.540 1.253 1.00 0.79 O ATOM 388 CB TRP A 25 -2.097 -1.753 1.352 1.00 0.37 C ATOM 389 CG TRP A 25 -3.188 -2.077 0.373 1.00 0.39 C ATOM 390 CD1 TRP A 25 -3.064 -2.934 -0.666 1.00 0.51 C ATOM 391 CD2 TRP A 25 -4.514 -1.493 0.239 1.00 0.49 C ATOM 392 NE1 TRP A 25 -4.161 -2.819 -1.484 1.00 0.71 N ATOM 393 CE2 TRP A 25 -5.119 -1.997 -0.946 1.00 0.65 C ATOM 394 CE3 TRP A 25 -5.268 -0.586 0.998 1.00 0.66 C ATOM 395 CZ2 TRP A 25 -6.408 -1.631 -1.349 1.00 0.85 C ATOM 396 CZ3 TRP A 25 -6.584 -0.239 0.631 1.00 0.87 C ATOM 397 CH2 TRP A 25 -7.155 -0.757 -0.543 1.00 0.92 C ATOM 398 H TRP A 25 -0.059 -1.896 -0.601 1.00 0.58 H ATOM 399 HA TRP A 25 -1.464 0.258 0.833 1.00 0.48 H ATOM 400 HB2 TRP A 25 -1.604 -2.680 1.639 1.00 0.39 H ATOM 401 HB3 TRP A 25 -2.545 -1.332 2.250 1.00 0.41 H ATOM 402 HD1 TRP A 25 -2.183 -3.516 -0.906 1.00 0.61 H ATOM 403 HE1 TRP A 25 -4.172 -3.258 -2.395 1.00 1.03 H ATOM 404 HE3 TRP A 25 -4.801 -0.199 1.888 1.00 0.71 H ATOM 405 HZ2 TRP A 25 -6.836 -2.055 -2.241 1.00 1.00 H ATOM 406 HZ3 TRP A 25 -7.167 0.424 1.248 1.00 1.05 H ATOM 407 HH2 TRP A 25 -8.166 -0.488 -0.814 1.00 1.09 H ATOM 408 N HIS A 26 0.241 -0.184 2.820 1.00 0.58 N ATOM 409 CA HIS A 26 1.220 -0.547 3.851 1.00 0.60 C ATOM 410 C HIS A 26 0.932 -1.951 4.355 1.00 0.44 C ATOM 411 O HIS A 26 -0.200 -2.432 4.259 1.00 0.39 O ATOM 412 CB HIS A 26 1.219 0.421 5.044 1.00 0.70 C ATOM 413 CG HIS A 26 1.647 1.803 4.662 1.00 0.86 C ATOM 414 ND1 HIS A 26 0.782 2.864 4.476 1.00 0.73 N ATOM 415 CD2 HIS A 26 2.902 2.172 4.276 1.00 1.04 C ATOM 416 CE1 HIS A 26 1.506 3.828 3.895 1.00 0.73 C ATOM 417 NE2 HIS A 26 2.788 3.443 3.767 1.00 0.91 N ATOM 418 H HIS A 26 -0.553 0.393 3.050 1.00 0.93 H ATOM 419 HA HIS A 26 2.209 -0.550 3.396 1.00 0.79 H ATOM 420 HB2 HIS A 26 0.229 0.448 5.492 1.00 0.62 H ATOM 421 HB3 HIS A 26 1.905 0.062 5.807 1.00 0.81 H ATOM 422 HD2 HIS A 26 3.773 1.530 4.195 1.00 1.09 H ATOM 423 HE1 HIS A 26 1.105 4.775 3.564 1.00 0.62 H ATOM 424 HE2 HIS A 26 3.494 3.932 3.216 1.00 0.82 H ATOM 425 N LYS A 27 1.936 -2.552 5.001 1.00 0.46 N ATOM 426 CA LYS A 27 1.920 -3.887 5.596 1.00 0.51 C ATOM 427 C LYS A 27 0.607 -4.140 6.344 1.00 0.57 C ATOM 428 O LYS A 27 -0.067 -5.136 6.077 1.00 0.79 O ATOM 429 CB LYS A 27 3.163 -3.997 6.496 1.00 0.64 C ATOM 430 CG LYS A 27 3.518 -5.399 7.004 1.00 1.06 C ATOM 431 CD LYS A 27 4.568 -6.090 6.132 1.00 1.88 C ATOM 432 CE LYS A 27 5.079 -7.377 6.786 1.00 2.79 C ATOM 433 NZ LYS A 27 4.109 -8.483 6.683 1.00 3.89 N ATOM 434 H LYS A 27 2.801 -2.029 5.090 1.00 0.60 H ATOM 435 HA LYS A 27 2.010 -4.623 4.797 1.00 0.72 H ATOM 436 HB2 LYS A 27 4.023 -3.590 5.963 1.00 1.13 H ATOM 437 HB3 LYS A 27 3.011 -3.364 7.362 1.00 1.03 H ATOM 438 HG2 LYS A 27 3.946 -5.286 8.000 1.00 2.05 H ATOM 439 HG3 LYS A 27 2.623 -6.015 7.070 1.00 1.95 H ATOM 440 HD2 LYS A 27 4.138 -6.311 5.159 1.00 2.61 H ATOM 441 HD3 LYS A 27 5.420 -5.422 5.996 1.00 2.61 H ATOM 442 HE2 LYS A 27 5.998 -7.679 6.282 1.00 3.62 H ATOM 443 HE3 LYS A 27 5.313 -7.190 7.837 1.00 3.17 H ATOM 444 HZ1 LYS A 27 3.831 -8.632 5.719 1.00 4.70 H ATOM 445 HZ2 LYS A 27 4.515 -9.351 7.021 1.00 4.49 H ATOM 446 HZ3 LYS A 27 3.279 -8.301 7.239 1.00 4.32 H ATOM 447 N ALA A 28 0.246 -3.247 7.271 1.00 0.63 N ATOM 448 CA ALA A 28 -0.969 -3.334 8.073 1.00 0.87 C ATOM 449 C ALA A 28 -2.198 -2.621 7.480 1.00 0.71 C ATOM 450 O ALA A 28 -3.263 -2.688 8.100 1.00 0.89 O ATOM 451 CB ALA A 28 -0.679 -2.809 9.481 1.00 1.23 C ATOM 452 H ALA A 28 0.865 -2.462 7.438 1.00 0.64 H ATOM 453 HA ALA A 28 -1.232 -4.388 8.172 1.00 1.11 H ATOM 454 HB1 ALA A 28 0.156 -3.351 9.920 1.00 2.30 H ATOM 455 HB2 ALA A 28 -0.458 -1.741 9.453 1.00 1.52 H ATOM 456 HB3 ALA A 28 -1.549 -2.982 10.108 1.00 2.36 H ATOM 457 N CYS A 29 -2.096 -1.934 6.337 1.00 0.44 N ATOM 458 CA CYS A 29 -3.201 -1.193 5.722 1.00 0.41 C ATOM 459 C CYS A 29 -3.967 -2.017 4.666 1.00 0.47 C ATOM 460 O CYS A 29 -5.029 -1.563 4.242 1.00 0.62 O ATOM 461 CB CYS A 29 -2.667 0.106 5.096 1.00 0.39 C ATOM 462 SG CYS A 29 -2.305 1.402 6.337 1.00 0.60 S ATOM 463 H CYS A 29 -1.223 -1.956 5.826 1.00 0.40 H ATOM 464 HA CYS A 29 -3.920 -0.916 6.493 1.00 0.47 H ATOM 465 HB2 CYS A 29 -1.781 -0.112 4.503 1.00 0.41 H ATOM 466 HB3 CYS A 29 -3.420 0.482 4.406 1.00 0.44 H ATOM 467 N PHE A 30 -3.577 -3.273 4.406 1.00 0.51 N ATOM 468 CA PHE A 30 -4.116 -4.185 3.381 1.00 0.59 C ATOM 469 C PHE A 30 -5.617 -4.013 3.121 1.00 1.54 C ATOM 470 O PHE A 30 -6.051 -3.840 1.978 1.00 3.38 O ATOM 471 CB PHE A 30 -3.829 -5.628 3.832 1.00 0.96 C ATOM 472 CG PHE A 30 -4.586 -6.706 3.072 1.00 1.05 C ATOM 473 CD1 PHE A 30 -4.175 -7.097 1.784 1.00 1.65 C ATOM 474 CD2 PHE A 30 -5.719 -7.316 3.647 1.00 2.40 C ATOM 475 CE1 PHE A 30 -4.880 -8.087 1.082 1.00 1.69 C ATOM 476 CE2 PHE A 30 -6.438 -8.292 2.935 1.00 2.53 C ATOM 477 CZ PHE A 30 -6.021 -8.676 1.651 1.00 1.37 C ATOM 478 OXT PHE A 30 -6.374 -4.058 4.115 1.00 1.21 O ATOM 479 H PHE A 30 -2.706 -3.551 4.835 1.00 0.60 H ATOM 480 HA PHE A 30 -3.598 -4.004 2.440 1.00 1.02 H ATOM 481 HB2 PHE A 30 -2.760 -5.823 3.760 1.00 1.41 H ATOM 482 HB3 PHE A 30 -4.095 -5.713 4.885 1.00 1.45 H ATOM 483 HD1 PHE A 30 -3.319 -6.646 1.315 1.00 2.83 H ATOM 484 HD2 PHE A 30 -6.049 -7.041 4.637 1.00 3.61 H ATOM 485 HE1 PHE A 30 -4.545 -8.388 0.100 1.00 2.81 H ATOM 486 HE2 PHE A 30 -7.313 -8.750 3.371 1.00 3.81 H ATOM 487 HZ PHE A 30 -6.575 -9.423 1.099 1.00 1.53 H TER 488 PHE A 30 HETATM 489 ZN ZN A 31 -1.179 2.980 5.007 1.00 0.59 ZN