Metal binding site automatically extracted from 1hca, number: 1 1hca_s1 first shell HIS N -11.092 -0.465 11.018 1.0 4.3 1HCA N 12.0 CA -10.13 -1.409 10.416 1.0 4.08 1HCA C 13.0 C -10.251 -2.729 11.162 1.0 4.16 1HCA C 14.0 O -11.002 -2.837 12.134 1.0 4.26 1HCA O 15.0 CB -8.652 -0.977 10.396 1.0 3.74 1HCA C 16.0 CG -8.251 -0.327 11.676 1.0 3.6 1HCA C 17.0 ND1 -8.414 1.025 11.94 1.0 3.41 1HCA N 18.0 CD2 -7.684 -0.873 12.779 1.0 3.6 1HCA C 19.0 CE1 -7.968 1.278 13.153 1.0 3.44 1HCA C 20.0 NE2 -7.519 0.168 13.687 1.0 3.61 1HCA N 21.0 HIS N -7.974 -6.531 12.33 1.0 4.31 1HCA N 33.0 CA -6.821 -7.297 12.731 1.0 3.95 1HCA C 34.0 C -7.32 -8.748 12.579 1.0 3.83 1HCA C 35.0 O -8.33 -9.037 13.241 1.0 3.62 1HCA O 36.0 CB -6.284 -7.17 14.179 1.0 3.7 1HCA C 37.0 CG -5.921 -5.734 14.397 1.0 3.36 1HCA C 38.0 ND1 -4.678 -5.215 14.145 1.0 3.25 1HCA N 39.0 CD2 -6.691 -4.709 14.813 1.0 3.23 1HCA C 40.0 CE1 -4.705 -3.919 14.405 1.0 3.11 1HCA C 41.0 NE2 -5.907 -3.603 14.811 1.0 2.75 1HCA N 42.0 HIS N -11.967 -2.581 15.018 1.0 3.98 1HCA N 13.0 CA -11.765 -1.354 15.777 1.0 4.26 1HCA C 14.0 C -12.422 -0.168 15.051 1.0 4.27 1HCA C 15.0 O -12.128 0.104 13.883 1.0 4.06 1HCA O 16.0 CB -10.301 -1.0 16.127 1.0 4.44 1HCA C 17.0 CG -9.705 -2.055 17.02 1.0 4.85 1HCA C 18.0 ND1 -8.411 -2.469 17.024 1.0 4.74 1HCA N 19.0 CD2 -10.344 -2.854 17.927 1.0 4.89 1HCA C 20.0 CE1 -8.236 -3.431 17.883 1.0 4.92 1HCA C 21.0 NE2 -9.4 -3.698 18.441 1.0 5.04 1HCA N 22.0 ZN ZN -6.682 -1.541 15.563 1.0 8.34 1HCA ZN 30.0 HOH O -5.411 0.221 16.976 1.0 2.0 1HCA O 45.0 second shell PHE N -6.463 -2.482 6.12 1.0 14.12 1HCA N 88.0 CA -7.34 -1.674 5.246 1.0 13.58 1HCA C 89.0 C -8.257 -0.894 6.2 1.0 13.38 1HCA C 90.0 O -8.781 -1.474 7.157 1.0 13.53 1HCA O 91.0 CB -8.104 -2.46 4.197 1.0 13.05 1HCA C 92.0 CG -9.175 -3.364 4.732 1.0 12.75 1HCA C 93.0 CD1 -10.423 -2.837 5.079 1.0 12.65 1HCA C 94.0 CD2 -8.939 -4.728 4.895 1.0 12.68 1HCA C 95.0 CE1 -11.43 -3.638 5.584 1.0 12.45 1HCA C 96.0 CE2 -9.938 -5.566 5.411 1.0 12.59 1HCA C 97.0 CZ -11.183 -4.997 5.743 1.0 12.57 1HCA C 98.0 ASN N -8.403 0.361 5.914 1.0 13.21 1HCA N 99.0 CA -9.186 1.353 6.596 1.0 13.09 1HCA C 0.0 C -10.327 1.904 5.706 1.0 13.13 1HCA C 1.0 O -10.144 2.215 4.528 1.0 13.0 1HCA O 2.0 CB -8.312 2.537 7.011 1.0 13.15 1HCA C 3.0 CG -7.428 2.348 8.212 1.0 13.32 1HCA C 4.0 OD1 -7.086 3.333 8.9 1.0 13.44 1HCA O 5.0 ND2 -7.027 1.119 8.491 1.0 13.29 1HCA N 6.0 GLN N -12.542 6.364 11.328 1.0 5.36 1HCA N 92.0 CA -12.185 5.149 10.572 1.0 5.15 1HCA C 93.0 C -12.404 3.867 11.357 1.0 5.04 1HCA C 94.0 O -12.532 3.874 12.592 1.0 5.47 1HCA O 95.0 CB -10.738 5.24 10.089 1.0 5.16 1HCA C 96.0 CG -9.634 5.478 11.101 1.0 5.08 1HCA C 97.0 CD -8.909 4.25 11.557 1.0 5.2 1HCA C 98.0 OE1 -9.362 3.103 11.449 1.0 5.33 1HCA O 99.0 NE2 -7.714 4.446 12.105 1.0 5.23 1HCA N 0.0 PHE N -12.433 2.77 10.639 1.0 4.84 1HCA N 1.0 CA -12.576 1.412 11.201 1.0 4.7 1HCA C 2.0 C -11.567 0.569 10.384 1.0 4.57 1HCA C 3.0 O -11.258 0.933 9.23 1.0 4.55 1HCA O 4.0 CB -13.936 0.798 11.251 1.0 4.75 1HCA C 5.0 CG -14.724 0.322 10.083 1.0 5.12 1HCA C 6.0 CD1 -14.318 -0.799 9.351 1.0 5.21 1HCA C 7.0 CD2 -15.926 0.945 9.721 1.0 5.14 1HCA C 8.0 CE1 -15.056 -1.282 8.281 1.0 5.21 1HCA C 9.0 CE2 -16.681 0.475 8.646 1.0 5.35 1HCA C 10.0 CZ -16.234 -0.663 7.923 1.0 5.13 1HCA C 11.0 GLY N -6.01 -13.883 15.611 1.0 7.38 1HCA N 96.0 CA -6.314 -12.665 14.888 1.0 6.95 1HCA C 97.0 C -6.67 -11.5 15.784 1.0 6.71 1HCA C 98.0 O -6.225 -10.379 15.494 1.0 6.79 1HCA O 99.0 GLU N -6.727 -9.017 18.977 1.0 5.6 1HCA N 6.0 CA -5.659 -8.348 19.71 1.0 5.46 1HCA C 7.0 C -5.877 -8.542 21.21 1.0 5.45 1HCA C 8.0 O -4.987 -8.971 21.954 1.0 5.36 1HCA O 9.0 CB -5.584 -6.863 19.369 1.0 5.33 1HCA C 10.0 CG -5.309 -6.479 17.924 1.0 5.25 1HCA C 11.0 CD -4.623 -5.162 17.704 1.0 5.4 1HCA C 12.0 OE1 -5.09 -4.034 17.746 1.0 5.29 1HCA O 13.0 OE2 -3.42 -5.379 17.454 1.0 5.57 1HCA O 14.0 ALA N -10.829 -12.614 14.425 1.0 6.41 1HCA N 91.0 CA -10.424 -11.242 14.044 1.0 5.91 1HCA C 92.0 C -11.014 -10.263 15.041 1.0 5.48 1HCA C 93.0 O -11.803 -10.698 15.904 1.0 5.61 1HCA O 94.0 CB -10.823 -10.922 12.604 1.0 5.98 1HCA C 95.0 GLU N -10.626 -9.014 14.894 1.0 4.98 1HCA N 96.0 CA -11.115 -7.949 15.784 1.0 4.54 1HCA C 97.0 C -11.277 -6.642 15.018 1.0 4.38 1HCA C 98.0 O -10.399 -6.184 14.289 1.0 4.29 1HCA O 99.0 CB -10.199 -7.682 16.959 1.0 4.35 1HCA C 0.0 CG -10.689 -6.68 18.037 1.0 3.98 1HCA C 1.0 CD -9.822 -6.751 19.273 1.0 3.72 1HCA C 2.0 OE1 -9.295 -7.809 19.577 1.0 3.4 1HCA O 3.0 OE2 -9.719 -5.657 19.861 1.0 3.55 1HCA O 4.0 LEU N -12.429 -6.036 15.221 1.0 4.23 1HCA N 5.0 CA -12.845 -4.791 14.624 1.0 3.87 1HCA C 6.0 C -12.641 -3.592 15.525 1.0 3.98 1HCA C 7.0 O -13.139 -3.607 16.679 1.0 4.33 1HCA O 8.0 CB -14.357 -4.989 14.275 1.0 3.74 1HCA C 9.0 CG -15.075 -3.719 13.83 1.0 3.42 1HCA C 10.0 CD1 -14.281 -2.981 12.764 1.0 3.26 1HCA C 11.0 CD2 -16.442 -4.135 13.293 1.0 3.63 1HCA C 12.0 VAL N -12.542 3.683 15.45 1.0 3.79 1HCA N 31.0 CA -11.789 4.781 16.075 1.0 3.34 1HCA C 32.0 C -12.594 6.076 16.041 1.0 3.31 1HCA C 33.0 O -13.179 6.433 14.968 1.0 3.29 1HCA O 34.0 CB -10.422 4.941 15.384 1.0 3.16 1HCA C 35.0 CG1 -9.511 5.9 16.143 1.0 3.01 1HCA C 36.0 CG2 -9.745 3.607 15.106 1.0 2.93 1HCA C 37.0 VAL N -12.029 3.966 21.261 1.0 8.36 1HCA N 96.0 CA -12.066 2.893 20.247 1.0 8.41 1HCA C 97.0 C -13.075 1.845 20.708 1.0 8.51 1HCA C 98.0 O -13.133 1.527 21.896 1.0 8.37 1HCA O 99.0 CB -10.652 2.344 20.007 1.0 8.29 1HCA C 0.0 CG1 -10.681 1.224 18.973 1.0 8.16 1HCA C 1.0 CG2 -9.67 3.437 19.663 1.0 8.13 1HCA C 2.0 LEU N -13.85 1.36 19.75 1.0 8.92 1HCA N 3.0 CA -14.892 0.348 20.019 1.0 8.99 1HCA C 4.0 C -14.348 -0.975 19.51 1.0 9.15 1HCA C 5.0 O -14.139 -1.076 18.289 1.0 9.39 1HCA O 6.0 CB -16.158 0.839 19.348 1.0 9.06 1HCA C 7.0 CG -17.514 0.599 20.003 1.0 9.1 1HCA C 8.0 CD1 -18.629 0.612 18.953 1.0 9.1 1HCA C 9.0 CD2 -17.485 -0.708 20.759 1.0 9.03 1HCA C 10.0 GLY N -14.124 -1.928 20.387 1.0 9.17 1HCA N 11.0 CA -13.575 -3.228 20.018 1.0 9.18 1HCA C 12.0 C -14.662 -4.273 19.801 1.0 9.37 1HCA C 13.0 O -15.556 -4.443 20.648 1.0 9.48 1HCA O 14.0 THR N -2.87 0.227 19.052 1.0 4.48 1HCA N 26.0 CA -2.144 -1.055 19.08 1.0 5.11 1HCA C 27.0 C -1.186 -1.219 17.923 1.0 5.69 1HCA C 28.0 O -0.71 -2.344 17.649 1.0 6.06 1HCA O 29.0 CB -3.141 -2.252 19.288 1.0 5.24 1HCA C 30.0 OG1 -4.131 -2.213 18.222 1.0 5.47 1HCA O 31.0 CG2 -3.824 -2.216 20.672 1.0 5.15 1HCA C 32.0 TRP N -10.527 2.253 25.934 1.0 7.58 1HCA N 99.0 CA -11.042 1.057 25.243 1.0 8.13 1HCA C 0.0 C -12.402 0.627 25.777 1.0 8.69 1HCA C 1.0 O -12.676 0.611 26.985 1.0 8.86 1HCA O 2.0 CB -10.017 -0.08 25.327 1.0 8.05 1HCA C 3.0 CG -8.965 0.0070 24.279 1.0 7.92 1HCA C 4.0 CD1 -7.717 0.553 24.379 1.0 7.95 1HCA C 5.0 CD2 -9.1 -0.475 22.931 1.0 7.84 1HCA C 6.0 NE1 -7.063 0.448 23.17 1.0 7.95 1HCA N 7.0 CE2 -7.882 -0.182 22.271 1.0 7.92 1HCA C 8.0 CE3 -10.129 -1.091 22.231 1.0 7.8 1HCA C 9.0 CZ2 -7.665 -0.512 20.936 1.0 7.84 1HCA C 10.0 CZ3 -9.933 -1.423 20.905 1.0 7.87 1HCA C 11.0 CH2 -8.712 -1.135 20.279 1.0 8.0 1HCA C 12.0 ASN N -1.827 -9.547 11.554 1.0 10.44 1HCA N 84.0 CA -1.549 -8.098 11.667 1.0 10.11 1HCA C 85.0 C -2.039 -7.678 13.066 1.0 9.86 1HCA C 86.0 O -2.746 -6.669 13.189 1.0 9.72 1HCA O 87.0 CB -2.189 -7.287 10.548 1.0 10.06 1HCA C 88.0 CG -3.704 -7.43 10.469 1.0 9.95 1HCA C 89.0 OD1 -4.289 -8.384 10.998 1.0 9.96 1HCA O 90.0 ND2 -4.401 -6.494 9.82 1.0 9.88 1HCA N 91.0 HOH O -1.411 -4.179 15.733 1.0 8.77 1HCA O 86.0 HOH O -9.081 -3.803 8.041 1.0 5.14 1HCA O 90.0 HOH O -2.268 -3.188 11.352 1.0 27.25 1HCA O 97.0 HOH O -4.179 -1.027 12.023 1.0 20.28 1HCA O 99.0