ATOM 1 N ALA A 1 -2.238 -11.738 -8.443 1.00 0.00 N ATOM 2 CA ALA A 1 -3.328 -11.051 -9.161 1.00 0.00 C ATOM 3 C ALA A 1 -2.801 -9.655 -9.428 1.00 0.00 C ATOM 4 O ALA A 1 -1.668 -9.420 -8.999 1.00 0.00 O ATOM 5 CB ALA A 1 -4.612 -10.983 -8.324 1.00 0.00 C ATOM 6 H1 ALA A 1 -1.408 -11.756 -9.025 1.00 0.00 H ATOM 7 H2 ALA A 1 -2.036 -11.243 -7.582 1.00 0.00 H ATOM 8 H3 ALA A 1 -2.521 -12.688 -8.228 1.00 0.00 H ATOM 9 HA ALA A 1 -3.522 -11.550 -10.111 1.00 0.00 H ATOM 10 HB1 ALA A 1 -4.383 -10.586 -7.335 1.00 0.00 H ATOM 11 HB2 ALA A 1 -5.344 -10.316 -8.791 1.00 0.00 H ATOM 12 HB3 ALA A 1 -5.043 -11.979 -8.220 1.00 0.00 H ATOM 13 N ASP A 2 -3.589 -8.789 -10.067 1.00 0.00 N ATOM 14 CA ASP A 2 -3.406 -7.357 -9.934 1.00 0.00 C ATOM 15 C ASP A 2 -3.861 -6.964 -8.528 1.00 0.00 C ATOM 16 O ASP A 2 -3.053 -6.738 -7.642 1.00 0.00 O ATOM 17 CB ASP A 2 -4.219 -6.618 -11.004 1.00 0.00 C ATOM 18 CG ASP A 2 -4.244 -5.113 -10.745 1.00 0.00 C ATOM 19 OD1 ASP A 2 -3.373 -4.640 -9.977 1.00 0.00 O ATOM 20 OD2 ASP A 2 -5.110 -4.458 -11.353 1.00 0.00 O ATOM 21 H ASP A 2 -4.482 -9.100 -10.417 1.00 0.00 H ATOM 22 HA ASP A 2 -2.352 -7.100 -10.062 1.00 0.00 H ATOM 23 HB2 ASP A 2 -3.783 -6.794 -11.986 1.00 0.00 H ATOM 24 HB3 ASP A 2 -5.251 -6.970 -11.026 1.00 0.00 H ATOM 25 N VAL A 3 -5.167 -6.914 -8.304 1.00 0.00 N ATOM 26 CA VAL A 3 -5.706 -6.454 -7.036 1.00 0.00 C ATOM 27 C VAL A 3 -5.612 -7.555 -5.979 1.00 0.00 C ATOM 28 O VAL A 3 -5.852 -8.724 -6.279 1.00 0.00 O ATOM 29 CB VAL A 3 -7.123 -5.888 -7.209 1.00 0.00 C ATOM 30 CG1 VAL A 3 -7.075 -4.591 -8.027 1.00 0.00 C ATOM 31 CG2 VAL A 3 -8.103 -6.877 -7.853 1.00 0.00 C ATOM 32 H VAL A 3 -5.782 -7.154 -9.054 1.00 0.00 H ATOM 33 HA VAL A 3 -5.086 -5.631 -6.692 1.00 0.00 H ATOM 34 HB VAL A 3 -7.494 -5.640 -6.218 1.00 0.00 H ATOM 35 HG11 VAL A 3 -6.408 -3.872 -7.550 1.00 0.00 H ATOM 36 HG12 VAL A 3 -6.718 -4.786 -9.039 1.00 0.00 H ATOM 37 HG13 VAL A 3 -8.071 -4.152 -8.082 1.00 0.00 H ATOM 38 HG21 VAL A 3 -8.131 -7.806 -7.286 1.00 0.00 H ATOM 39 HG22 VAL A 3 -9.102 -6.439 -7.852 1.00 0.00 H ATOM 40 HG23 VAL A 3 -7.820 -7.090 -8.883 1.00 0.00 H ATOM 41 N VAL A 4 -5.242 -7.178 -4.751 1.00 0.00 N ATOM 42 CA VAL A 4 -5.148 -8.079 -3.601 1.00 0.00 C ATOM 43 C VAL A 4 -5.772 -7.417 -2.360 1.00 0.00 C ATOM 44 O VAL A 4 -5.186 -7.415 -1.281 1.00 0.00 O ATOM 45 CB VAL A 4 -3.685 -8.520 -3.358 1.00 0.00 C ATOM 46 CG1 VAL A 4 -3.650 -9.823 -2.545 1.00 0.00 C ATOM 47 CG2 VAL A 4 -2.890 -8.755 -4.651 1.00 0.00 C ATOM 48 H VAL A 4 -5.033 -6.193 -4.616 1.00 0.00 H ATOM 49 HA VAL A 4 -5.738 -8.973 -3.807 1.00 0.00 H ATOM 50 HB VAL A 4 -3.170 -7.745 -2.793 1.00 0.00 H ATOM 51 HG11 VAL A 4 -4.221 -9.720 -1.625 1.00 0.00 H ATOM 52 HG12 VAL A 4 -4.075 -10.640 -3.130 1.00 0.00 H ATOM 53 HG13 VAL A 4 -2.620 -10.070 -2.288 1.00 0.00 H ATOM 54 HG21 VAL A 4 -3.395 -9.492 -5.275 1.00 0.00 H ATOM 55 HG22 VAL A 4 -2.779 -7.823 -5.203 1.00 0.00 H ATOM 56 HG23 VAL A 4 -1.894 -9.122 -4.404 1.00 0.00 H ATOM 57 N THR A 5 -6.958 -6.826 -2.525 1.00 0.00 N ATOM 58 CA THR A 5 -7.788 -6.277 -1.456 1.00 0.00 C ATOM 59 C THR A 5 -7.839 -7.195 -0.227 1.00 0.00 C ATOM 60 O THR A 5 -7.946 -8.408 -0.393 1.00 0.00 O ATOM 61 CB THR A 5 -9.192 -6.107 -2.048 1.00 0.00 C ATOM 62 OG1 THR A 5 -9.083 -5.260 -3.177 1.00 0.00 O ATOM 63 CG2 THR A 5 -10.190 -5.526 -1.045 1.00 0.00 C ATOM 64 H THR A 5 -7.355 -6.784 -3.452 1.00 0.00 H ATOM 65 HA THR A 5 -7.398 -5.298 -1.169 1.00 0.00 H ATOM 66 HB THR A 5 -9.564 -7.082 -2.373 1.00 0.00 H ATOM 67 HG1 THR A 5 -9.945 -5.190 -3.597 1.00 0.00 H ATOM 68 HG21 THR A 5 -9.750 -4.660 -0.563 1.00 0.00 H ATOM 69 HG22 THR A 5 -11.110 -5.236 -1.552 1.00 0.00 H ATOM 70 HG23 THR A 5 -10.433 -6.269 -0.284 1.00 0.00 H ATOM 71 N TYR A 6 -7.811 -6.619 0.985 1.00 0.00 N ATOM 72 CA TYR A 6 -7.922 -7.379 2.230 1.00 0.00 C ATOM 73 C TYR A 6 -8.942 -6.756 3.194 1.00 0.00 C ATOM 74 O TYR A 6 -8.824 -5.594 3.591 1.00 0.00 O ATOM 75 CB TYR A 6 -6.544 -7.509 2.894 1.00 0.00 C ATOM 76 CG TYR A 6 -5.540 -8.387 2.163 1.00 0.00 C ATOM 77 CD1 TYR A 6 -5.856 -9.734 1.898 1.00 0.00 C ATOM 78 CD2 TYR A 6 -4.241 -7.914 1.888 1.00 0.00 C ATOM 79 CE1 TYR A 6 -4.888 -10.594 1.352 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.262 -8.787 1.376 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.585 -10.131 1.117 1.00 0.00 C ATOM 82 OH TYR A 6 -2.643 -11.003 0.658 1.00 0.00 O ATOM 83 H TYR A 6 -7.704 -5.610 1.054 1.00 0.00 H ATOM 84 HA TYR A 6 -8.285 -8.383 2.010 1.00 0.00 H ATOM 85 HB2 TYR A 6 -6.129 -6.511 3.040 1.00 0.00 H ATOM 86 HB3 TYR A 6 -6.694 -7.954 3.878 1.00 0.00 H ATOM 87 HD1 TYR A 6 -6.830 -10.128 2.146 1.00 0.00 H ATOM 88 HD2 TYR A 6 -3.979 -6.889 2.105 1.00 0.00 H ATOM 89 HE1 TYR A 6 -5.134 -11.628 1.161 1.00 0.00 H ATOM 90 HE2 TYR A 6 -2.264 -8.422 1.181 1.00 0.00 H ATOM 91 HH TYR A 6 -1.729 -10.730 0.841 1.00 0.00 H ATOM 92 N GLU A 7 -9.949 -7.539 3.584 1.00 0.00 N ATOM 93 CA GLU A 7 -10.957 -7.200 4.572 1.00 0.00 C ATOM 94 C GLU A 7 -10.341 -7.147 5.975 1.00 0.00 C ATOM 95 O GLU A 7 -9.727 -8.112 6.425 1.00 0.00 O ATOM 96 CB GLU A 7 -12.101 -8.221 4.506 1.00 0.00 C ATOM 97 CG GLU A 7 -12.735 -8.302 3.103 1.00 0.00 C ATOM 98 CD GLU A 7 -12.152 -9.407 2.223 1.00 0.00 C ATOM 99 OE1 GLU A 7 -10.932 -9.656 2.337 1.00 0.00 O ATOM 100 OE2 GLU A 7 -12.944 -9.978 1.444 1.00 0.00 O ATOM 101 H GLU A 7 -10.053 -8.460 3.152 1.00 0.00 H ATOM 102 HA GLU A 7 -11.384 -6.233 4.321 1.00 0.00 H ATOM 103 HB2 GLU A 7 -11.742 -9.208 4.808 1.00 0.00 H ATOM 104 HB3 GLU A 7 -12.866 -7.906 5.216 1.00 0.00 H ATOM 105 HG2 GLU A 7 -13.796 -8.524 3.226 1.00 0.00 H ATOM 106 HG3 GLU A 7 -12.645 -7.348 2.583 1.00 0.00 H ATOM 107 N ASN A 8 -10.511 -6.016 6.663 1.00 0.00 N ATOM 108 CA ASN A 8 -10.047 -5.748 8.019 1.00 0.00 C ATOM 109 C ASN A 8 -11.272 -5.364 8.861 1.00 0.00 C ATOM 110 O ASN A 8 -12.385 -5.293 8.340 1.00 0.00 O ATOM 111 CB ASN A 8 -9.018 -4.602 7.995 1.00 0.00 C ATOM 112 CG ASN A 8 -7.670 -5.005 7.405 1.00 0.00 C ATOM 113 OD1 ASN A 8 -6.664 -4.961 8.105 1.00 0.00 O ATOM 114 ND2 ASN A 8 -7.621 -5.368 6.126 1.00 0.00 N ATOM 115 H ASN A 8 -11.090 -5.282 6.269 1.00 0.00 H ATOM 116 HA ASN A 8 -9.587 -6.633 8.461 1.00 0.00 H ATOM 117 HB2 ASN A 8 -9.392 -3.741 7.445 1.00 0.00 H ATOM 118 HB3 ASN A 8 -8.841 -4.281 9.019 1.00 0.00 H ATOM 119 HD21 ASN A 8 -8.426 -5.366 5.512 1.00 0.00 H ATOM 120 HD22 ASN A 8 -6.762 -5.813 5.802 1.00 0.00 H ATOM 121 N LYS A 9 -11.104 -5.094 10.162 1.00 0.00 N ATOM 122 CA LYS A 9 -12.199 -4.539 10.955 1.00 0.00 C ATOM 123 C LYS A 9 -12.408 -3.069 10.579 1.00 0.00 C ATOM 124 O LYS A 9 -13.540 -2.640 10.362 1.00 0.00 O ATOM 125 CB LYS A 9 -11.948 -4.740 12.455 1.00 0.00 C ATOM 126 CG LYS A 9 -12.067 -6.229 12.836 1.00 0.00 C ATOM 127 CD LYS A 9 -10.845 -6.828 13.549 1.00 0.00 C ATOM 128 CE LYS A 9 -10.385 -6.010 14.766 1.00 0.00 C ATOM 129 NZ LYS A 9 -9.138 -5.268 14.487 1.00 0.00 N ATOM 130 H LYS A 9 -10.183 -5.169 10.594 1.00 0.00 H ATOM 131 HA LYS A 9 -13.125 -5.062 10.713 1.00 0.00 H ATOM 132 HB2 LYS A 9 -10.985 -4.318 12.719 1.00 0.00 H ATOM 133 HB3 LYS A 9 -12.714 -4.189 13.004 1.00 0.00 H ATOM 134 HG2 LYS A 9 -12.943 -6.349 13.478 1.00 0.00 H ATOM 135 HG3 LYS A 9 -12.243 -6.828 11.940 1.00 0.00 H ATOM 136 HD2 LYS A 9 -11.130 -7.826 13.889 1.00 0.00 H ATOM 137 HD3 LYS A 9 -10.035 -6.953 12.828 1.00 0.00 H ATOM 138 HE2 LYS A 9 -11.171 -5.317 15.072 1.00 0.00 H ATOM 139 HE3 LYS A 9 -10.194 -6.692 15.597 1.00 0.00 H ATOM 140 HZ1 LYS A 9 -9.229 -4.647 13.680 1.00 0.00 H ATOM 141 HZ2 LYS A 9 -8.860 -4.698 15.270 1.00 0.00 H ATOM 142 HZ3 LYS A 9 -8.391 -5.903 14.250 1.00 0.00 H ATOM 143 N LYS A 10 -11.323 -2.300 10.436 1.00 0.00 N ATOM 144 CA LYS A 10 -11.341 -0.999 9.789 1.00 0.00 C ATOM 145 C LYS A 10 -11.439 -1.203 8.283 1.00 0.00 C ATOM 146 O LYS A 10 -10.496 -0.955 7.534 1.00 0.00 O ATOM 147 CB LYS A 10 -10.123 -0.167 10.218 1.00 0.00 C ATOM 148 CG LYS A 10 -10.251 0.254 11.686 1.00 0.00 C ATOM 149 CD LYS A 10 -11.458 1.163 11.980 1.00 0.00 C ATOM 150 CE LYS A 10 -11.465 2.441 11.127 1.00 0.00 C ATOM 151 NZ LYS A 10 -12.192 2.338 9.839 1.00 0.00 N ATOM 152 H LYS A 10 -10.421 -2.708 10.588 1.00 0.00 H ATOM 153 HA LYS A 10 -12.249 -0.468 10.068 1.00 0.00 H ATOM 154 HB2 LYS A 10 -9.214 -0.759 10.097 1.00 0.00 H ATOM 155 HB3 LYS A 10 -10.013 0.726 9.601 1.00 0.00 H ATOM 156 HG2 LYS A 10 -10.318 -0.639 12.312 1.00 0.00 H ATOM 157 HG3 LYS A 10 -9.343 0.790 11.960 1.00 0.00 H ATOM 158 HD2 LYS A 10 -12.406 0.627 11.908 1.00 0.00 H ATOM 159 HD3 LYS A 10 -11.359 1.467 13.025 1.00 0.00 H ATOM 160 HE2 LYS A 10 -11.956 3.220 11.710 1.00 0.00 H ATOM 161 HE3 LYS A 10 -10.436 2.740 10.935 1.00 0.00 H ATOM 162 HZ1 LYS A 10 -13.139 1.956 9.878 1.00 0.00 H ATOM 163 HZ2 LYS A 10 -12.297 3.242 9.407 1.00 0.00 H ATOM 164 HZ3 LYS A 10 -11.774 1.775 9.097 1.00 0.00 H ATOM 165 N GLY A 11 -12.620 -1.669 7.884 1.00 0.00 N ATOM 166 CA GLY A 11 -13.065 -1.725 6.512 1.00 0.00 C ATOM 167 C GLY A 11 -12.241 -2.718 5.723 1.00 0.00 C ATOM 168 O GLY A 11 -11.499 -3.502 6.303 1.00 0.00 O ATOM 169 H GLY A 11 -13.225 -2.023 8.611 1.00 0.00 H ATOM 170 HA2 GLY A 11 -14.108 -2.032 6.478 1.00 0.00 H ATOM 171 HA3 GLY A 11 -12.937 -0.735 6.081 1.00 0.00 H ATOM 172 N ASN A 12 -12.343 -2.688 4.397 1.00 0.00 N ATOM 173 CA ASN A 12 -11.359 -3.384 3.583 1.00 0.00 C ATOM 174 C ASN A 12 -10.305 -2.370 3.186 1.00 0.00 C ATOM 175 O ASN A 12 -10.633 -1.224 2.886 1.00 0.00 O ATOM 176 CB ASN A 12 -12.003 -4.071 2.368 1.00 0.00 C ATOM 177 CG ASN A 12 -12.340 -3.112 1.224 1.00 0.00 C ATOM 178 OD1 ASN A 12 -13.481 -2.688 1.080 1.00 0.00 O ATOM 179 ND2 ASN A 12 -11.354 -2.787 0.392 1.00 0.00 N ATOM 180 H ASN A 12 -12.924 -1.975 3.967 1.00 0.00 H ATOM 181 HA ASN A 12 -10.846 -4.143 4.179 1.00 0.00 H ATOM 182 HB2 ASN A 12 -11.308 -4.821 1.988 1.00 0.00 H ATOM 183 HB3 ASN A 12 -12.909 -4.587 2.687 1.00 0.00 H ATOM 184 HD21 ASN A 12 -10.426 -3.142 0.536 1.00 0.00 H ATOM 185 HD22 ASN A 12 -11.500 -2.137 -0.374 1.00 0.00 H ATOM 186 N VAL A 13 -9.044 -2.794 3.173 1.00 0.00 N ATOM 187 CA VAL A 13 -8.004 -2.030 2.527 1.00 0.00 C ATOM 188 C VAL A 13 -7.895 -2.584 1.110 1.00 0.00 C ATOM 189 O VAL A 13 -7.460 -3.716 0.892 1.00 0.00 O ATOM 190 CB VAL A 13 -6.714 -2.037 3.359 1.00 0.00 C ATOM 191 CG1 VAL A 13 -5.988 -3.380 3.424 1.00 0.00 C ATOM 192 CG2 VAL A 13 -5.753 -0.974 2.831 1.00 0.00 C ATOM 193 H VAL A 13 -8.841 -3.761 3.409 1.00 0.00 H ATOM 194 HA VAL A 13 -8.299 -0.982 2.463 1.00 0.00 H ATOM 195 HB VAL A 13 -6.979 -1.755 4.380 1.00 0.00 H ATOM 196 HG11 VAL A 13 -6.655 -4.161 3.784 1.00 0.00 H ATOM 197 HG12 VAL A 13 -5.572 -3.661 2.457 1.00 0.00 H ATOM 198 HG13 VAL A 13 -5.169 -3.260 4.122 1.00 0.00 H ATOM 199 HG21 VAL A 13 -6.236 0.000 2.886 1.00 0.00 H ATOM 200 HG22 VAL A 13 -4.855 -0.954 3.444 1.00 0.00 H ATOM 201 HG23 VAL A 13 -5.487 -1.190 1.797 1.00 0.00 H ATOM 202 N THR A 14 -8.393 -1.817 0.143 1.00 0.00 N ATOM 203 CA THR A 14 -8.140 -2.075 -1.258 1.00 0.00 C ATOM 204 C THR A 14 -6.626 -1.987 -1.464 1.00 0.00 C ATOM 205 O THR A 14 -5.964 -1.125 -0.884 1.00 0.00 O ATOM 206 CB THR A 14 -8.945 -1.078 -2.103 1.00 0.00 C ATOM 207 OG1 THR A 14 -10.302 -1.120 -1.693 1.00 0.00 O ATOM 208 CG2 THR A 14 -8.855 -1.412 -3.596 1.00 0.00 C ATOM 209 H THR A 14 -8.835 -0.943 0.379 1.00 0.00 H ATOM 210 HA THR A 14 -8.481 -3.079 -1.503 1.00 0.00 H ATOM 211 HB THR A 14 -8.565 -0.070 -1.936 1.00 0.00 H ATOM 212 HG1 THR A 14 -10.790 -0.461 -2.196 1.00 0.00 H ATOM 213 HG21 THR A 14 -9.222 -2.423 -3.777 1.00 0.00 H ATOM 214 HG22 THR A 14 -9.458 -0.707 -4.170 1.00 0.00 H ATOM 215 HG23 THR A 14 -7.823 -1.339 -3.943 1.00 0.00 H ATOM 216 N PHE A 15 -6.070 -2.928 -2.223 1.00 0.00 N ATOM 217 CA PHE A 15 -4.643 -3.069 -2.429 1.00 0.00 C ATOM 218 C PHE A 15 -4.487 -3.473 -3.884 1.00 0.00 C ATOM 219 O PHE A 15 -5.168 -4.399 -4.325 1.00 0.00 O ATOM 220 CB PHE A 15 -4.123 -4.153 -1.479 1.00 0.00 C ATOM 221 CG PHE A 15 -2.658 -4.535 -1.605 1.00 0.00 C ATOM 222 CD1 PHE A 15 -2.189 -5.199 -2.758 1.00 0.00 C ATOM 223 CD2 PHE A 15 -1.829 -4.454 -0.472 1.00 0.00 C ATOM 224 CE1 PHE A 15 -0.890 -5.726 -2.796 1.00 0.00 C ATOM 225 CE2 PHE A 15 -0.560 -5.056 -0.482 1.00 0.00 C ATOM 226 CZ PHE A 15 -0.089 -5.686 -1.647 1.00 0.00 C ATOM 227 H PHE A 15 -6.654 -3.601 -2.705 1.00 0.00 H ATOM 228 HA PHE A 15 -4.118 -2.129 -2.244 1.00 0.00 H ATOM 229 HB2 PHE A 15 -4.331 -3.830 -0.458 1.00 0.00 H ATOM 230 HB3 PHE A 15 -4.708 -5.051 -1.649 1.00 0.00 H ATOM 231 HD1 PHE A 15 -2.836 -5.408 -3.595 1.00 0.00 H ATOM 232 HD2 PHE A 15 -2.205 -4.039 0.452 1.00 0.00 H ATOM 233 HE1 PHE A 15 -0.546 -6.247 -3.679 1.00 0.00 H ATOM 234 HE2 PHE A 15 0.005 -5.104 0.436 1.00 0.00 H ATOM 235 HZ PHE A 15 0.844 -6.222 -1.650 1.00 0.00 H ATOM 236 N ASP A 16 -3.588 -2.809 -4.608 1.00 0.00 N ATOM 237 CA ASP A 16 -3.388 -3.018 -6.027 1.00 0.00 C ATOM 238 C ASP A 16 -1.972 -3.541 -6.196 1.00 0.00 C ATOM 239 O ASP A 16 -1.113 -3.226 -5.371 1.00 0.00 O ATOM 240 CB ASP A 16 -3.596 -1.700 -6.781 1.00 0.00 C ATOM 241 CG ASP A 16 -4.822 -0.934 -6.298 1.00 0.00 C ATOM 242 OD1 ASP A 16 -4.660 -0.179 -5.314 1.00 0.00 O ATOM 243 OD2 ASP A 16 -5.899 -1.137 -6.897 1.00 0.00 O ATOM 244 H ASP A 16 -3.009 -2.099 -4.184 1.00 0.00 H ATOM 245 HA ASP A 16 -4.099 -3.737 -6.422 1.00 0.00 H ATOM 246 HB2 ASP A 16 -2.736 -1.047 -6.681 1.00 0.00 H ATOM 247 HB3 ASP A 16 -3.717 -1.946 -7.831 1.00 0.00 H ATOM 248 N HIS A 17 -1.705 -4.326 -7.236 1.00 0.00 N ATOM 249 CA HIS A 17 -0.369 -4.842 -7.476 1.00 0.00 C ATOM 250 C HIS A 17 0.058 -4.474 -8.886 1.00 0.00 C ATOM 251 O HIS A 17 1.092 -3.827 -9.049 1.00 0.00 O ATOM 252 CB HIS A 17 -0.341 -6.348 -7.173 1.00 0.00 C ATOM 253 CG HIS A 17 0.975 -6.941 -6.758 1.00 0.00 C ATOM 254 ND1 HIS A 17 1.363 -8.242 -6.974 1.00 0.00 N ATOM 255 CD2 HIS A 17 1.943 -6.340 -6.003 1.00 0.00 C ATOM 256 CE1 HIS A 17 2.574 -8.398 -6.417 1.00 0.00 C ATOM 257 NE2 HIS A 17 2.981 -7.261 -5.824 1.00 0.00 N ATOM 258 H HIS A 17 -2.457 -4.665 -7.827 1.00 0.00 H ATOM 259 HA HIS A 17 0.333 -4.322 -6.830 1.00 0.00 H ATOM 260 HB2 HIS A 17 -1.016 -6.532 -6.338 1.00 0.00 H ATOM 261 HB3 HIS A 17 -0.695 -6.890 -8.049 1.00 0.00 H ATOM 262 HD1 HIS A 17 0.844 -8.956 -7.463 1.00 0.00 H ATOM 263 HD2 HIS A 17 1.903 -5.329 -5.631 1.00 0.00 H ATOM 264 HE1 HIS A 17 3.137 -9.316 -6.488 1.00 0.00 H ATOM 265 N LYS A 18 -0.750 -4.802 -9.900 1.00 0.00 N ATOM 266 CA LYS A 18 -0.441 -4.301 -11.234 1.00 0.00 C ATOM 267 C LYS A 18 -0.787 -2.817 -11.291 1.00 0.00 C ATOM 268 O LYS A 18 0.077 -2.009 -11.620 1.00 0.00 O ATOM 269 CB LYS A 18 -1.118 -5.108 -12.350 1.00 0.00 C ATOM 270 CG LYS A 18 -0.640 -4.613 -13.729 1.00 0.00 C ATOM 271 CD LYS A 18 -1.085 -5.521 -14.886 1.00 0.00 C ATOM 272 CE LYS A 18 -0.060 -6.612 -15.235 1.00 0.00 C ATOM 273 NZ LYS A 18 0.250 -7.489 -14.090 1.00 0.00 N ATOM 274 H LYS A 18 -1.718 -5.094 -9.698 1.00 0.00 H ATOM 275 HA LYS A 18 0.630 -4.417 -11.392 1.00 0.00 H ATOM 276 HB2 LYS A 18 -0.892 -6.159 -12.197 1.00 0.00 H ATOM 277 HB3 LYS A 18 -2.195 -4.974 -12.312 1.00 0.00 H ATOM 278 HG2 LYS A 18 -1.088 -3.629 -13.904 1.00 0.00 H ATOM 279 HG3 LYS A 18 0.444 -4.475 -13.752 1.00 0.00 H ATOM 280 HD2 LYS A 18 -2.066 -5.947 -14.668 1.00 0.00 H ATOM 281 HD3 LYS A 18 -1.198 -4.885 -15.770 1.00 0.00 H ATOM 282 HE2 LYS A 18 -0.459 -7.216 -16.053 1.00 0.00 H ATOM 283 HE3 LYS A 18 0.860 -6.137 -15.581 1.00 0.00 H ATOM 284 HZ1 LYS A 18 -0.596 -7.929 -13.754 1.00 0.00 H ATOM 285 HZ2 LYS A 18 0.911 -8.203 -14.367 1.00 0.00 H ATOM 286 HZ3 LYS A 18 0.653 -6.940 -13.344 1.00 0.00 H ATOM 287 N ALA A 19 -2.031 -2.456 -10.961 1.00 0.00 N ATOM 288 CA ALA A 19 -2.507 -1.088 -11.131 1.00 0.00 C ATOM 289 C ALA A 19 -1.651 -0.087 -10.348 1.00 0.00 C ATOM 290 O ALA A 19 -1.373 1.003 -10.845 1.00 0.00 O ATOM 291 CB ALA A 19 -3.999 -0.981 -10.807 1.00 0.00 C ATOM 292 H ALA A 19 -2.685 -3.180 -10.648 1.00 0.00 H ATOM 293 HA ALA A 19 -2.412 -0.840 -12.190 1.00 0.00 H ATOM 294 HB1 ALA A 19 -4.561 -1.682 -11.427 1.00 0.00 H ATOM 295 HB2 ALA A 19 -4.190 -1.206 -9.762 1.00 0.00 H ATOM 296 HB3 ALA A 19 -4.345 0.031 -11.015 1.00 0.00 H ATOM 297 N HIS A 20 -1.167 -0.459 -9.154 1.00 0.00 N ATOM 298 CA HIS A 20 -0.139 0.333 -8.487 1.00 0.00 C ATOM 299 C HIS A 20 1.118 0.385 -9.371 1.00 0.00 C ATOM 300 O HIS A 20 1.609 1.466 -9.710 1.00 0.00 O ATOM 301 CB HIS A 20 0.233 -0.266 -7.121 1.00 0.00 C ATOM 302 CG HIS A 20 -0.458 0.268 -5.886 1.00 0.00 C ATOM 303 ND1 HIS A 20 -0.979 -0.518 -4.889 1.00 0.00 N ATOM 304 CD2 HIS A 20 -0.339 1.531 -5.364 1.00 0.00 C ATOM 305 CE1 HIS A 20 -1.211 0.250 -3.817 1.00 0.00 C ATOM 306 NE2 HIS A 20 -0.812 1.511 -4.043 1.00 0.00 N ATOM 307 H HIS A 20 -1.413 -1.368 -8.781 1.00 0.00 H ATOM 308 HA HIS A 20 -0.500 1.353 -8.343 1.00 0.00 H ATOM 309 HB2 HIS A 20 0.152 -1.354 -7.153 1.00 0.00 H ATOM 310 HB3 HIS A 20 1.274 -0.020 -6.962 1.00 0.00 H ATOM 311 HD1 HIS A 20 -1.114 -1.517 -4.938 1.00 0.00 H ATOM 312 HD2 HIS A 20 0.099 2.376 -5.866 1.00 0.00 H ATOM 313 HE1 HIS A 20 -1.632 -0.123 -2.898 1.00 0.00 H ATOM 314 N ALA A 21 1.682 -0.788 -9.694 1.00 0.00 N ATOM 315 CA ALA A 21 2.950 -0.902 -10.404 1.00 0.00 C ATOM 316 C ALA A 21 3.040 0.007 -11.627 1.00 0.00 C ATOM 317 O ALA A 21 4.111 0.553 -11.874 1.00 0.00 O ATOM 318 CB ALA A 21 3.237 -2.349 -10.802 1.00 0.00 C ATOM 319 H ALA A 21 1.200 -1.649 -9.461 1.00 0.00 H ATOM 320 HA ALA A 21 3.736 -0.601 -9.712 1.00 0.00 H ATOM 321 HB1 ALA A 21 3.264 -2.980 -9.917 1.00 0.00 H ATOM 322 HB2 ALA A 21 2.481 -2.719 -11.493 1.00 0.00 H ATOM 323 HB3 ALA A 21 4.207 -2.384 -11.296 1.00 0.00 H ATOM 324 N GLU A 22 1.948 0.184 -12.374 1.00 0.00 N ATOM 325 CA GLU A 22 1.938 1.071 -13.535 1.00 0.00 C ATOM 326 C GLU A 22 2.468 2.473 -13.211 1.00 0.00 C ATOM 327 O GLU A 22 3.143 3.074 -14.045 1.00 0.00 O ATOM 328 CB GLU A 22 0.544 1.133 -14.173 1.00 0.00 C ATOM 329 CG GLU A 22 -0.007 -0.284 -14.371 1.00 0.00 C ATOM 330 CD GLU A 22 -1.115 -0.391 -15.409 1.00 0.00 C ATOM 331 OE1 GLU A 22 -1.637 0.668 -15.815 1.00 0.00 O ATOM 332 OE2 GLU A 22 -1.414 -1.551 -15.771 1.00 0.00 O ATOM 333 H GLU A 22 1.111 -0.348 -12.149 1.00 0.00 H ATOM 334 HA GLU A 22 2.612 0.636 -14.274 1.00 0.00 H ATOM 335 HB2 GLU A 22 -0.147 1.702 -13.549 1.00 0.00 H ATOM 336 HB3 GLU A 22 0.632 1.631 -15.140 1.00 0.00 H ATOM 337 HG2 GLU A 22 0.798 -0.959 -14.658 1.00 0.00 H ATOM 338 HG3 GLU A 22 -0.435 -0.603 -13.430 1.00 0.00 H ATOM 339 N LYS A 23 2.183 2.995 -12.012 1.00 0.00 N ATOM 340 CA LYS A 23 2.791 4.234 -11.541 1.00 0.00 C ATOM 341 C LYS A 23 4.102 3.941 -10.798 1.00 0.00 C ATOM 342 O LYS A 23 5.106 4.603 -11.048 1.00 0.00 O ATOM 343 CB LYS A 23 1.798 5.050 -10.696 1.00 0.00 C ATOM 344 CG LYS A 23 0.596 5.530 -11.530 1.00 0.00 C ATOM 345 CD LYS A 23 -0.208 6.631 -10.815 1.00 0.00 C ATOM 346 CE LYS A 23 0.418 8.025 -11.007 1.00 0.00 C ATOM 347 NZ LYS A 23 -0.210 9.071 -10.164 1.00 0.00 N ATOM 348 H LYS A 23 1.672 2.424 -11.344 1.00 0.00 H ATOM 349 HA LYS A 23 3.055 4.863 -12.393 1.00 0.00 H ATOM 350 HB2 LYS A 23 1.427 4.448 -9.867 1.00 0.00 H ATOM 351 HB3 LYS A 23 2.330 5.911 -10.292 1.00 0.00 H ATOM 352 HG2 LYS A 23 0.931 5.892 -12.503 1.00 0.00 H ATOM 353 HG3 LYS A 23 -0.054 4.667 -11.700 1.00 0.00 H ATOM 354 HD2 LYS A 23 -1.218 6.644 -11.234 1.00 0.00 H ATOM 355 HD3 LYS A 23 -0.284 6.373 -9.760 1.00 0.00 H ATOM 356 HE2 LYS A 23 1.483 7.996 -10.772 1.00 0.00 H ATOM 357 HE3 LYS A 23 0.308 8.309 -12.056 1.00 0.00 H ATOM 358 HZ1 LYS A 23 -1.227 9.018 -10.108 1.00 0.00 H ATOM 359 HZ2 LYS A 23 0.061 8.981 -9.185 1.00 0.00 H ATOM 360 HZ3 LYS A 23 0.049 9.998 -10.460 1.00 0.00 H ATOM 361 N LEU A 24 4.103 2.992 -9.855 1.00 0.00 N ATOM 362 CA LEU A 24 5.220 2.805 -8.941 1.00 0.00 C ATOM 363 C LEU A 24 6.467 2.177 -9.566 1.00 0.00 C ATOM 364 O LEU A 24 7.572 2.651 -9.320 1.00 0.00 O ATOM 365 CB LEU A 24 4.782 1.929 -7.774 1.00 0.00 C ATOM 366 CG LEU A 24 3.915 2.675 -6.765 1.00 0.00 C ATOM 367 CD1 LEU A 24 2.492 2.973 -7.222 1.00 0.00 C ATOM 368 CD2 LEU A 24 3.770 1.753 -5.564 1.00 0.00 C ATOM 369 H LEU A 24 3.238 2.514 -9.625 1.00 0.00 H ATOM 370 HA LEU A 24 5.518 3.778 -8.547 1.00 0.00 H ATOM 371 HB2 LEU A 24 4.220 1.068 -8.106 1.00 0.00 H ATOM 372 HB3 LEU A 24 5.704 1.579 -7.304 1.00 0.00 H ATOM 373 HG LEU A 24 4.396 3.616 -6.543 1.00 0.00 H ATOM 374 HD11 LEU A 24 1.992 2.030 -7.418 1.00 0.00 H ATOM 375 HD12 LEU A 24 1.964 3.479 -6.425 1.00 0.00 H ATOM 376 HD13 LEU A 24 2.471 3.622 -8.088 1.00 0.00 H ATOM 377 HD21 LEU A 24 4.734 1.416 -5.194 1.00 0.00 H ATOM 378 HD22 LEU A 24 3.202 2.223 -4.783 1.00 0.00 H ATOM 379 HD23 LEU A 24 3.182 0.904 -5.871 1.00 0.00 H ATOM 380 N GLY A 25 6.307 1.062 -10.284 1.00 0.00 N ATOM 381 CA GLY A 25 7.419 0.373 -10.926 1.00 0.00 C ATOM 382 C GLY A 25 8.090 -0.719 -10.081 1.00 0.00 C ATOM 383 O GLY A 25 9.288 -0.941 -10.232 1.00 0.00 O ATOM 384 H GLY A 25 5.369 0.810 -10.569 1.00 0.00 H ATOM 385 HA2 GLY A 25 7.067 -0.070 -11.858 1.00 0.00 H ATOM 386 HA3 GLY A 25 8.173 1.120 -11.155 1.00 0.00 H ATOM 387 N CYS A 26 7.329 -1.413 -9.224 1.00 0.00 N ATOM 388 CA CYS A 26 7.765 -2.518 -8.353 1.00 0.00 C ATOM 389 C CYS A 26 8.716 -2.044 -7.247 1.00 0.00 C ATOM 390 O CYS A 26 8.380 -2.102 -6.056 1.00 0.00 O ATOM 391 CB CYS A 26 8.381 -3.708 -9.080 1.00 0.00 C ATOM 392 SG CYS A 26 7.612 -4.257 -10.635 1.00 0.00 S ATOM 393 H CYS A 26 6.363 -1.133 -9.162 1.00 0.00 H ATOM 394 HA CYS A 26 6.872 -2.878 -7.853 1.00 0.00 H ATOM 395 HB2 CYS A 26 9.422 -3.493 -9.321 1.00 0.00 H ATOM 396 HB3 CYS A 26 8.390 -4.553 -8.390 1.00 0.00 H ATOM 397 N ASP A 27 9.909 -1.603 -7.660 1.00 0.00 N ATOM 398 CA ASP A 27 11.072 -1.262 -6.851 1.00 0.00 C ATOM 399 C ASP A 27 10.838 0.087 -6.166 1.00 0.00 C ATOM 400 O ASP A 27 11.508 1.083 -6.422 1.00 0.00 O ATOM 401 CB ASP A 27 12.303 -1.270 -7.771 1.00 0.00 C ATOM 402 CG ASP A 27 13.613 -1.258 -6.998 1.00 0.00 C ATOM 403 OD1 ASP A 27 13.815 -2.221 -6.228 1.00 0.00 O ATOM 404 OD2 ASP A 27 14.418 -0.333 -7.238 1.00 0.00 O ATOM 405 H ASP A 27 10.031 -1.542 -8.665 1.00 0.00 H ATOM 406 HA ASP A 27 11.204 -2.031 -6.088 1.00 0.00 H ATOM 407 HB2 ASP A 27 12.299 -2.180 -8.369 1.00 0.00 H ATOM 408 HB3 ASP A 27 12.269 -0.412 -8.444 1.00 0.00 H ATOM 409 N ALA A 28 9.795 0.117 -5.338 1.00 0.00 N ATOM 410 CA ALA A 28 9.288 1.281 -4.641 1.00 0.00 C ATOM 411 C ALA A 28 8.593 0.796 -3.372 1.00 0.00 C ATOM 412 O ALA A 28 8.867 1.284 -2.280 1.00 0.00 O ATOM 413 CB ALA A 28 8.328 2.044 -5.557 1.00 0.00 C ATOM 414 H ALA A 28 9.302 -0.759 -5.224 1.00 0.00 H ATOM 415 HA ALA A 28 10.115 1.937 -4.366 1.00 0.00 H ATOM 416 HB1 ALA A 28 8.832 2.307 -6.488 1.00 0.00 H ATOM 417 HB2 ALA A 28 7.456 1.430 -5.781 1.00 0.00 H ATOM 418 HB3 ALA A 28 8.015 2.960 -5.062 1.00 0.00 H ATOM 419 N CYS A 29 7.708 -0.197 -3.524 1.00 0.00 N ATOM 420 CA CYS A 29 7.253 -1.011 -2.408 1.00 0.00 C ATOM 421 C CYS A 29 8.337 -2.041 -2.091 1.00 0.00 C ATOM 422 O CYS A 29 8.684 -2.250 -0.930 1.00 0.00 O ATOM 423 CB CYS A 29 5.972 -1.720 -2.757 1.00 0.00 C ATOM 424 SG CYS A 29 4.601 -0.574 -3.069 1.00 0.00 S ATOM 425 H CYS A 29 7.491 -0.526 -4.453 1.00 0.00 H ATOM 426 HA CYS A 29 7.076 -0.390 -1.527 1.00 0.00 H ATOM 427 HB2 CYS A 29 6.143 -2.340 -3.638 1.00 0.00 H ATOM 428 HB3 CYS A 29 5.697 -2.363 -1.921 1.00 0.00 H ATOM 429 N HIS A 30 8.848 -2.710 -3.132 1.00 0.00 N ATOM 430 CA HIS A 30 9.899 -3.702 -3.016 1.00 0.00 C ATOM 431 C HIS A 30 11.283 -3.057 -3.103 1.00 0.00 C ATOM 432 O HIS A 30 11.405 -1.863 -3.368 1.00 0.00 O ATOM 433 CB HIS A 30 9.714 -4.728 -4.135 1.00 0.00 C ATOM 434 CG HIS A 30 8.474 -5.556 -3.967 1.00 0.00 C ATOM 435 ND1 HIS A 30 8.300 -6.568 -3.051 1.00 0.00 N ATOM 436 CD2 HIS A 30 7.353 -5.491 -4.744 1.00 0.00 C ATOM 437 CE1 HIS A 30 7.091 -7.104 -3.279 1.00 0.00 C ATOM 438 NE2 HIS A 30 6.479 -6.484 -4.299 1.00 0.00 N ATOM 439 H HIS A 30 8.526 -2.505 -4.071 1.00 0.00 H ATOM 440 HA HIS A 30 9.825 -4.215 -2.055 1.00 0.00 H ATOM 441 HB2 HIS A 30 9.695 -4.219 -5.100 1.00 0.00 H ATOM 442 HB3 HIS A 30 10.553 -5.415 -4.150 1.00 0.00 H ATOM 443 HD1 HIS A 30 8.951 -6.845 -2.331 1.00 0.00 H ATOM 444 HD2 HIS A 30 7.194 -4.810 -5.568 1.00 0.00 H ATOM 445 HE1 HIS A 30 6.671 -7.927 -2.724 1.00 0.00 H ATOM 446 N GLU A 31 12.301 -3.896 -2.902 1.00 0.00 N ATOM 447 CA GLU A 31 13.694 -3.645 -3.230 1.00 0.00 C ATOM 448 C GLU A 31 14.132 -4.813 -4.133 1.00 0.00 C ATOM 449 O GLU A 31 13.283 -5.560 -4.629 1.00 0.00 O ATOM 450 CB GLU A 31 14.504 -3.550 -1.921 1.00 0.00 C ATOM 451 CG GLU A 31 15.689 -2.576 -2.007 1.00 0.00 C ATOM 452 CD GLU A 31 16.474 -2.571 -0.704 1.00 0.00 C ATOM 453 OE1 GLU A 31 16.075 -1.805 0.199 1.00 0.00 O ATOM 454 OE2 GLU A 31 17.445 -3.353 -0.631 1.00 0.00 O ATOM 455 H GLU A 31 12.080 -4.871 -2.770 1.00 0.00 H ATOM 456 HA GLU A 31 13.785 -2.708 -3.780 1.00 0.00 H ATOM 457 HB2 GLU A 31 13.859 -3.164 -1.130 1.00 0.00 H ATOM 458 HB3 GLU A 31 14.857 -4.536 -1.616 1.00 0.00 H ATOM 459 HG2 GLU A 31 16.373 -2.833 -2.812 1.00 0.00 H ATOM 460 HG3 GLU A 31 15.313 -1.568 -2.190 1.00 0.00 H ATOM 461 N GLY A 32 15.441 -5.022 -4.293 1.00 0.00 N ATOM 462 CA GLY A 32 16.011 -6.095 -5.097 1.00 0.00 C ATOM 463 C GLY A 32 15.372 -7.456 -4.801 1.00 0.00 C ATOM 464 O GLY A 32 15.397 -7.912 -3.661 1.00 0.00 O ATOM 465 H GLY A 32 16.075 -4.397 -3.820 1.00 0.00 H ATOM 466 HA2 GLY A 32 15.895 -5.841 -6.152 1.00 0.00 H ATOM 467 HA3 GLY A 32 17.076 -6.162 -4.874 1.00 0.00 H ATOM 468 N THR A 33 14.823 -8.100 -5.839 1.00 0.00 N ATOM 469 CA THR A 33 14.198 -9.417 -5.783 1.00 0.00 C ATOM 470 C THR A 33 12.909 -9.381 -4.943 1.00 0.00 C ATOM 471 O THR A 33 12.948 -9.636 -3.741 1.00 0.00 O ATOM 472 CB THR A 33 15.202 -10.475 -5.294 1.00 0.00 C ATOM 473 OG1 THR A 33 16.413 -10.352 -6.017 1.00 0.00 O ATOM 474 CG2 THR A 33 14.660 -11.894 -5.502 1.00 0.00 C ATOM 475 H THR A 33 14.837 -7.633 -6.731 1.00 0.00 H ATOM 476 HA THR A 33 13.959 -9.688 -6.809 1.00 0.00 H ATOM 477 HB THR A 33 15.414 -10.332 -4.234 1.00 0.00 H ATOM 478 HG1 THR A 33 16.220 -10.388 -6.957 1.00 0.00 H ATOM 479 HG21 THR A 33 14.434 -12.066 -6.555 1.00 0.00 H ATOM 480 HG22 THR A 33 15.409 -12.617 -5.178 1.00 0.00 H ATOM 481 HG23 THR A 33 13.755 -12.043 -4.913 1.00 0.00 H ATOM 482 N PRO A 34 11.750 -9.084 -5.552 1.00 0.00 N ATOM 483 CA PRO A 34 10.508 -8.951 -4.815 1.00 0.00 C ATOM 484 C PRO A 34 10.026 -10.322 -4.334 1.00 0.00 C ATOM 485 O PRO A 34 10.212 -11.333 -5.010 1.00 0.00 O ATOM 486 CB PRO A 34 9.530 -8.303 -5.794 1.00 0.00 C ATOM 487 CG PRO A 34 10.001 -8.827 -7.148 1.00 0.00 C ATOM 488 CD PRO A 34 11.520 -8.894 -6.977 1.00 0.00 C ATOM 489 HA PRO A 34 10.654 -8.289 -3.959 1.00 0.00 H ATOM 490 HB2 PRO A 34 8.493 -8.551 -5.573 1.00 0.00 H ATOM 491 HB3 PRO A 34 9.670 -7.223 -5.782 1.00 0.00 H ATOM 492 HG2 PRO A 34 9.606 -9.832 -7.304 1.00 0.00 H ATOM 493 HG3 PRO A 34 9.708 -8.171 -7.968 1.00 0.00 H ATOM 494 HD2 PRO A 34 11.895 -9.729 -7.570 1.00 0.00 H ATOM 495 HD3 PRO A 34 11.975 -7.956 -7.298 1.00 0.00 H ATOM 496 N ALA A 35 9.397 -10.346 -3.159 1.00 0.00 N ATOM 497 CA ALA A 35 8.848 -11.523 -2.510 1.00 0.00 C ATOM 498 C ALA A 35 7.777 -11.019 -1.546 1.00 0.00 C ATOM 499 O ALA A 35 7.575 -9.807 -1.449 1.00 0.00 O ATOM 500 CB ALA A 35 9.961 -12.278 -1.775 1.00 0.00 C ATOM 501 H ALA A 35 9.207 -9.478 -2.678 1.00 0.00 H ATOM 502 HA ALA A 35 8.385 -12.177 -3.252 1.00 0.00 H ATOM 503 HB1 ALA A 35 10.729 -12.586 -2.485 1.00 0.00 H ATOM 504 HB2 ALA A 35 10.411 -11.634 -1.020 1.00 0.00 H ATOM 505 HB3 ALA A 35 9.556 -13.168 -1.291 1.00 0.00 H ATOM 506 N LYS A 36 7.074 -11.914 -0.845 1.00 0.00 N ATOM 507 CA LYS A 36 5.972 -11.479 0.000 1.00 0.00 C ATOM 508 C LYS A 36 6.471 -10.619 1.169 1.00 0.00 C ATOM 509 O LYS A 36 7.209 -11.092 2.031 1.00 0.00 O ATOM 510 CB LYS A 36 5.040 -12.644 0.374 1.00 0.00 C ATOM 511 CG LYS A 36 5.524 -13.527 1.530 1.00 0.00 C ATOM 512 CD LYS A 36 4.955 -13.068 2.886 1.00 0.00 C ATOM 513 CE LYS A 36 3.462 -13.410 3.045 1.00 0.00 C ATOM 514 NZ LYS A 36 2.724 -12.361 3.785 1.00 0.00 N ATOM 515 H LYS A 36 7.285 -12.897 -0.920 1.00 0.00 H ATOM 516 HA LYS A 36 5.363 -10.848 -0.632 1.00 0.00 H ATOM 517 HB2 LYS A 36 4.064 -12.226 0.620 1.00 0.00 H ATOM 518 HB3 LYS A 36 4.910 -13.270 -0.511 1.00 0.00 H ATOM 519 HG2 LYS A 36 5.217 -14.556 1.345 1.00 0.00 H ATOM 520 HG3 LYS A 36 6.615 -13.499 1.547 1.00 0.00 H ATOM 521 HD2 LYS A 36 5.520 -13.557 3.681 1.00 0.00 H ATOM 522 HD3 LYS A 36 5.101 -11.994 2.992 1.00 0.00 H ATOM 523 HE2 LYS A 36 2.982 -13.513 2.071 1.00 0.00 H ATOM 524 HE3 LYS A 36 3.370 -14.368 3.564 1.00 0.00 H ATOM 525 HZ1 LYS A 36 3.173 -12.126 4.658 1.00 0.00 H ATOM 526 HZ2 LYS A 36 2.663 -11.526 3.201 1.00 0.00 H ATOM 527 HZ3 LYS A 36 1.774 -12.652 3.955 1.00 0.00 H ATOM 528 N ILE A 37 6.080 -9.345 1.189 1.00 0.00 N ATOM 529 CA ILE A 37 6.410 -8.418 2.261 1.00 0.00 C ATOM 530 C ILE A 37 5.582 -8.773 3.508 1.00 0.00 C ATOM 531 O ILE A 37 4.454 -9.259 3.407 1.00 0.00 O ATOM 532 CB ILE A 37 6.180 -6.974 1.766 1.00 0.00 C ATOM 533 CG1 ILE A 37 7.100 -6.668 0.562 1.00 0.00 C ATOM 534 CG2 ILE A 37 6.384 -5.944 2.889 1.00 0.00 C ATOM 535 CD1 ILE A 37 6.937 -5.253 -0.007 1.00 0.00 C ATOM 536 H ILE A 37 5.524 -8.999 0.422 1.00 0.00 H ATOM 537 HA ILE A 37 7.469 -8.531 2.503 1.00 0.00 H ATOM 538 HB ILE A 37 5.145 -6.909 1.439 1.00 0.00 H ATOM 539 HG12 ILE A 37 8.144 -6.803 0.850 1.00 0.00 H ATOM 540 HG13 ILE A 37 6.884 -7.361 -0.250 1.00 0.00 H ATOM 541 HG21 ILE A 37 5.700 -6.131 3.716 1.00 0.00 H ATOM 542 HG22 ILE A 37 7.412 -5.985 3.251 1.00 0.00 H ATOM 543 HG23 ILE A 37 6.168 -4.940 2.529 1.00 0.00 H ATOM 544 HD11 ILE A 37 5.894 -5.060 -0.253 1.00 0.00 H ATOM 545 HD12 ILE A 37 7.296 -4.505 0.696 1.00 0.00 H ATOM 546 HD13 ILE A 37 7.528 -5.159 -0.917 1.00 0.00 H ATOM 547 N ALA A 38 6.138 -8.534 4.700 1.00 0.00 N ATOM 548 CA ALA A 38 5.468 -8.799 5.967 1.00 0.00 C ATOM 549 C ALA A 38 4.426 -7.719 6.277 1.00 0.00 C ATOM 550 O ALA A 38 4.611 -6.905 7.183 1.00 0.00 O ATOM 551 CB ALA A 38 6.516 -8.923 7.079 1.00 0.00 C ATOM 552 H ALA A 38 7.062 -8.131 4.730 1.00 0.00 H ATOM 553 HA ALA A 38 4.949 -9.758 5.905 1.00 0.00 H ATOM 554 HB1 ALA A 38 7.208 -9.732 6.846 1.00 0.00 H ATOM 555 HB2 ALA A 38 7.073 -7.991 7.179 1.00 0.00 H ATOM 556 HB3 ALA A 38 6.020 -9.145 8.025 1.00 0.00 H ATOM 557 N ILE A 39 3.325 -7.720 5.522 1.00 0.00 N ATOM 558 CA ILE A 39 2.129 -6.952 5.853 1.00 0.00 C ATOM 559 C ILE A 39 1.298 -7.731 6.881 1.00 0.00 C ATOM 560 O ILE A 39 1.335 -8.961 6.902 1.00 0.00 O ATOM 561 CB ILE A 39 1.338 -6.625 4.573 1.00 0.00 C ATOM 562 CG1 ILE A 39 2.177 -5.810 3.573 1.00 0.00 C ATOM 563 CG2 ILE A 39 0.025 -5.887 4.870 1.00 0.00 C ATOM 564 CD1 ILE A 39 2.768 -4.501 4.113 1.00 0.00 C ATOM 565 H ILE A 39 3.270 -8.397 4.768 1.00 0.00 H ATOM 566 HA ILE A 39 2.424 -6.014 6.324 1.00 0.00 H ATOM 567 HB ILE A 39 1.076 -7.567 4.087 1.00 0.00 H ATOM 568 HG12 ILE A 39 2.998 -6.429 3.210 1.00 0.00 H ATOM 569 HG13 ILE A 39 1.535 -5.557 2.731 1.00 0.00 H ATOM 570 HG21 ILE A 39 0.209 -5.009 5.487 1.00 0.00 H ATOM 571 HG22 ILE A 39 -0.446 -5.578 3.937 1.00 0.00 H ATOM 572 HG23 ILE A 39 -0.671 -6.547 5.386 1.00 0.00 H ATOM 573 HD11 ILE A 39 1.984 -3.863 4.518 1.00 0.00 H ATOM 574 HD12 ILE A 39 3.514 -4.703 4.880 1.00 0.00 H ATOM 575 HD13 ILE A 39 3.257 -3.973 3.294 1.00 0.00 H ATOM 576 N ASP A 40 0.591 -6.982 7.735 1.00 0.00 N ATOM 577 CA ASP A 40 -0.226 -7.433 8.860 1.00 0.00 C ATOM 578 C ASP A 40 -0.769 -6.167 9.519 1.00 0.00 C ATOM 579 O ASP A 40 -1.942 -5.818 9.447 1.00 0.00 O ATOM 580 CB ASP A 40 0.640 -8.212 9.867 1.00 0.00 C ATOM 581 CG ASP A 40 -0.014 -8.294 11.242 1.00 0.00 C ATOM 582 OD1 ASP A 40 -0.959 -9.097 11.381 1.00 0.00 O ATOM 583 OD2 ASP A 40 0.436 -7.529 12.124 1.00 0.00 O ATOM 584 H ASP A 40 0.610 -5.984 7.590 1.00 0.00 H ATOM 585 HA ASP A 40 -1.058 -8.050 8.514 1.00 0.00 H ATOM 586 HB2 ASP A 40 0.787 -9.221 9.499 1.00 0.00 H ATOM 587 HB3 ASP A 40 1.622 -7.754 9.978 1.00 0.00 H ATOM 588 N LYS A 41 0.170 -5.438 10.107 1.00 0.00 N ATOM 589 CA LYS A 41 0.022 -4.174 10.778 1.00 0.00 C ATOM 590 C LYS A 41 1.464 -3.705 10.983 1.00 0.00 C ATOM 591 O LYS A 41 2.406 -4.424 10.652 1.00 0.00 O ATOM 592 CB LYS A 41 -0.711 -4.369 12.118 1.00 0.00 C ATOM 593 CG LYS A 41 -1.498 -3.126 12.566 1.00 0.00 C ATOM 594 CD LYS A 41 -1.506 -3.048 14.098 1.00 0.00 C ATOM 595 CE LYS A 41 -2.301 -1.829 14.585 1.00 0.00 C ATOM 596 NZ LYS A 41 -2.266 -1.703 16.058 1.00 0.00 N ATOM 597 H LYS A 41 1.102 -5.833 10.161 1.00 0.00 H ATOM 598 HA LYS A 41 -0.523 -3.489 10.126 1.00 0.00 H ATOM 599 HB2 LYS A 41 -1.425 -5.190 12.039 1.00 0.00 H ATOM 600 HB3 LYS A 41 0.025 -4.657 12.871 1.00 0.00 H ATOM 601 HG2 LYS A 41 -1.068 -2.215 12.157 1.00 0.00 H ATOM 602 HG3 LYS A 41 -2.516 -3.213 12.185 1.00 0.00 H ATOM 603 HD2 LYS A 41 -1.943 -3.970 14.487 1.00 0.00 H ATOM 604 HD3 LYS A 41 -0.471 -2.979 14.443 1.00 0.00 H ATOM 605 HE2 LYS A 41 -1.882 -0.923 14.142 1.00 0.00 H ATOM 606 HE3 LYS A 41 -3.339 -1.924 14.257 1.00 0.00 H ATOM 607 HZ1 LYS A 41 -2.661 -2.528 16.490 1.00 0.00 H ATOM 608 HZ2 LYS A 41 -1.315 -1.592 16.378 1.00 0.00 H ATOM 609 HZ3 LYS A 41 -2.802 -0.897 16.349 1.00 0.00 H ATOM 610 N LYS A 42 1.634 -2.498 11.515 1.00 0.00 N ATOM 611 CA LYS A 42 2.908 -1.848 11.780 1.00 0.00 C ATOM 612 C LYS A 42 3.641 -1.533 10.475 1.00 0.00 C ATOM 613 O LYS A 42 3.766 -0.360 10.139 1.00 0.00 O ATOM 614 CB LYS A 42 3.755 -2.643 12.792 1.00 0.00 C ATOM 615 CG LYS A 42 4.951 -1.844 13.335 1.00 0.00 C ATOM 616 CD LYS A 42 4.533 -0.783 14.369 1.00 0.00 C ATOM 617 CE LYS A 42 5.761 0.004 14.853 1.00 0.00 C ATOM 618 NZ LYS A 42 5.422 0.980 15.911 1.00 0.00 N ATOM 619 H LYS A 42 0.798 -1.984 11.708 1.00 0.00 H ATOM 620 HA LYS A 42 2.646 -0.896 12.236 1.00 0.00 H ATOM 621 HB2 LYS A 42 3.127 -2.952 13.629 1.00 0.00 H ATOM 622 HB3 LYS A 42 4.142 -3.542 12.313 1.00 0.00 H ATOM 623 HG2 LYS A 42 5.625 -2.553 13.819 1.00 0.00 H ATOM 624 HG3 LYS A 42 5.490 -1.379 12.508 1.00 0.00 H ATOM 625 HD2 LYS A 42 3.818 -0.091 13.923 1.00 0.00 H ATOM 626 HD3 LYS A 42 4.056 -1.294 15.209 1.00 0.00 H ATOM 627 HE2 LYS A 42 6.506 -0.693 15.243 1.00 0.00 H ATOM 628 HE3 LYS A 42 6.197 0.537 14.005 1.00 0.00 H ATOM 629 HZ1 LYS A 42 4.734 1.641 15.575 1.00 0.00 H ATOM 630 HZ2 LYS A 42 5.056 0.504 16.724 1.00 0.00 H ATOM 631 HZ3 LYS A 42 6.252 1.489 16.184 1.00 0.00 H ATOM 632 N SER A 43 4.094 -2.549 9.734 1.00 0.00 N ATOM 633 CA SER A 43 4.828 -2.411 8.483 1.00 0.00 C ATOM 634 C SER A 43 4.108 -1.430 7.557 1.00 0.00 C ATOM 635 O SER A 43 4.619 -0.350 7.267 1.00 0.00 O ATOM 636 CB SER A 43 4.983 -3.795 7.832 1.00 0.00 C ATOM 637 OG SER A 43 5.311 -4.761 8.811 1.00 0.00 O ATOM 638 H SER A 43 3.904 -3.498 10.052 1.00 0.00 H ATOM 639 HA SER A 43 5.820 -2.023 8.715 1.00 0.00 H ATOM 640 HB2 SER A 43 4.054 -4.119 7.364 1.00 0.00 H ATOM 641 HB3 SER A 43 5.758 -3.755 7.065 1.00 0.00 H ATOM 642 HG SER A 43 5.171 -5.639 8.423 1.00 0.00 H ATOM 643 N ALA A 44 2.881 -1.799 7.166 1.00 0.00 N ATOM 644 CA ALA A 44 1.932 -0.996 6.403 1.00 0.00 C ATOM 645 C ALA A 44 1.915 0.461 6.875 1.00 0.00 C ATOM 646 O ALA A 44 1.924 1.409 6.097 1.00 0.00 O ATOM 647 CB ALA A 44 0.540 -1.609 6.584 1.00 0.00 C ATOM 648 H ALA A 44 2.550 -2.693 7.489 1.00 0.00 H ATOM 649 HA ALA A 44 2.178 -1.043 5.344 1.00 0.00 H ATOM 650 HB1 ALA A 44 0.276 -1.657 7.641 1.00 0.00 H ATOM 651 HB2 ALA A 44 -0.192 -0.989 6.070 1.00 0.00 H ATOM 652 HB3 ALA A 44 0.515 -2.617 6.169 1.00 0.00 H ATOM 653 N HIS A 45 1.891 0.623 8.189 1.00 0.00 N ATOM 654 CA HIS A 45 1.685 1.885 8.869 1.00 0.00 C ATOM 655 C HIS A 45 2.998 2.604 9.176 1.00 0.00 C ATOM 656 O HIS A 45 2.980 3.603 9.898 1.00 0.00 O ATOM 657 CB HIS A 45 0.918 1.585 10.154 1.00 0.00 C ATOM 658 CG HIS A 45 -0.579 1.553 10.000 1.00 0.00 C ATOM 659 ND1 HIS A 45 -1.437 1.969 10.984 1.00 0.00 N ATOM 660 CD2 HIS A 45 -1.331 1.218 8.894 1.00 0.00 C ATOM 661 CE1 HIS A 45 -2.676 1.875 10.495 1.00 0.00 C ATOM 662 NE2 HIS A 45 -2.677 1.428 9.226 1.00 0.00 N ATOM 663 H HIS A 45 2.132 -0.182 8.747 1.00 0.00 H ATOM 664 HA HIS A 45 1.088 2.557 8.252 1.00 0.00 H ATOM 665 HB2 HIS A 45 1.277 0.641 10.566 1.00 0.00 H ATOM 666 HB3 HIS A 45 1.139 2.360 10.886 1.00 0.00 H ATOM 667 HD1 HIS A 45 -1.181 2.296 11.904 1.00 0.00 H ATOM 668 HD2 HIS A 45 -0.963 0.869 7.941 1.00 0.00 H ATOM 669 HE1 HIS A 45 -3.548 2.127 11.074 1.00 0.00 H ATOM 670 N LYS A 46 4.114 2.140 8.616 1.00 0.00 N ATOM 671 CA LYS A 46 5.371 2.859 8.671 1.00 0.00 C ATOM 672 C LYS A 46 5.575 3.472 7.290 1.00 0.00 C ATOM 673 O LYS A 46 4.777 4.307 6.877 1.00 0.00 O ATOM 674 CB LYS A 46 6.506 1.945 9.167 1.00 0.00 C ATOM 675 CG LYS A 46 7.744 2.796 9.490 1.00 0.00 C ATOM 676 CD LYS A 46 8.989 1.933 9.728 1.00 0.00 C ATOM 677 CE LYS A 46 10.248 2.789 9.950 1.00 0.00 C ATOM 678 NZ LYS A 46 10.719 3.440 8.707 1.00 0.00 N ATOM 679 H LYS A 46 4.049 1.344 7.989 1.00 0.00 H ATOM 680 HA LYS A 46 5.307 3.689 9.375 1.00 0.00 H ATOM 681 HB2 LYS A 46 6.183 1.450 10.085 1.00 0.00 H ATOM 682 HB3 LYS A 46 6.726 1.166 8.435 1.00 0.00 H ATOM 683 HG2 LYS A 46 7.938 3.487 8.674 1.00 0.00 H ATOM 684 HG3 LYS A 46 7.525 3.385 10.381 1.00 0.00 H ATOM 685 HD2 LYS A 46 8.818 1.315 10.613 1.00 0.00 H ATOM 686 HD3 LYS A 46 9.146 1.268 8.874 1.00 0.00 H ATOM 687 HE2 LYS A 46 10.058 3.545 10.713 1.00 0.00 H ATOM 688 HE3 LYS A 46 11.045 2.133 10.305 1.00 0.00 H ATOM 689 HZ1 LYS A 46 10.769 2.766 7.939 1.00 0.00 H ATOM 690 HZ2 LYS A 46 10.056 4.110 8.309 1.00 0.00 H ATOM 691 HZ3 LYS A 46 11.611 3.894 8.810 1.00 0.00 H ATOM 692 N ASP A 47 6.621 3.069 6.571 1.00 0.00 N ATOM 693 CA ASP A 47 6.967 3.677 5.302 1.00 0.00 C ATOM 694 C ASP A 47 5.955 3.175 4.281 1.00 0.00 C ATOM 695 O ASP A 47 5.269 3.968 3.633 1.00 0.00 O ATOM 696 CB ASP A 47 8.417 3.328 4.925 1.00 0.00 C ATOM 697 CG ASP A 47 9.361 3.449 6.111 1.00 0.00 C ATOM 698 OD1 ASP A 47 9.384 4.508 6.779 1.00 0.00 O ATOM 699 OD2 ASP A 47 9.986 2.428 6.472 1.00 0.00 O ATOM 700 H ASP A 47 7.229 2.347 6.922 1.00 0.00 H ATOM 701 HA ASP A 47 6.901 4.757 5.403 1.00 0.00 H ATOM 702 HB2 ASP A 47 8.482 2.308 4.547 1.00 0.00 H ATOM 703 HB3 ASP A 47 8.752 4.004 4.138 1.00 0.00 H ATOM 704 N ALA A 48 5.870 1.839 4.226 1.00 0.00 N ATOM 705 CA ALA A 48 5.044 1.008 3.367 1.00 0.00 C ATOM 706 C ALA A 48 3.858 1.749 2.763 1.00 0.00 C ATOM 707 O ALA A 48 3.888 2.050 1.576 1.00 0.00 O ATOM 708 CB ALA A 48 4.589 -0.225 4.151 1.00 0.00 C ATOM 709 H ALA A 48 6.490 1.345 4.849 1.00 0.00 H ATOM 710 HA ALA A 48 5.674 0.663 2.545 1.00 0.00 H ATOM 711 HB1 ALA A 48 5.450 -0.793 4.505 1.00 0.00 H ATOM 712 HB2 ALA A 48 4.009 0.100 5.010 1.00 0.00 H ATOM 713 HB3 ALA A 48 3.971 -0.867 3.523 1.00 0.00 H ATOM 714 N CYS A 49 2.800 2.002 3.539 1.00 0.00 N ATOM 715 CA CYS A 49 1.588 2.584 2.991 1.00 0.00 C ATOM 716 C CYS A 49 1.552 4.103 3.208 1.00 0.00 C ATOM 717 O CYS A 49 1.296 4.855 2.269 1.00 0.00 O ATOM 718 CB CYS A 49 0.332 1.892 3.462 1.00 0.00 C ATOM 719 SG CYS A 49 0.276 0.073 3.347 1.00 0.00 S ATOM 720 H CYS A 49 2.797 1.740 4.517 1.00 0.00 H ATOM 721 HA CYS A 49 1.607 2.426 1.926 1.00 0.00 H ATOM 722 HB2 CYS A 49 0.099 2.186 4.485 1.00 0.00 H ATOM 723 HB3 CYS A 49 -0.452 2.253 2.814 1.00 0.00 H ATOM 724 N LYS A 50 1.776 4.566 4.443 1.00 0.00 N ATOM 725 CA LYS A 50 1.668 5.978 4.800 1.00 0.00 C ATOM 726 C LYS A 50 2.383 6.954 3.857 1.00 0.00 C ATOM 727 O LYS A 50 1.834 8.020 3.608 1.00 0.00 O ATOM 728 CB LYS A 50 2.194 6.243 6.214 1.00 0.00 C ATOM 729 CG LYS A 50 1.540 5.378 7.299 1.00 0.00 C ATOM 730 CD LYS A 50 0.795 6.221 8.342 1.00 0.00 C ATOM 731 CE LYS A 50 1.772 6.996 9.243 1.00 0.00 C ATOM 732 NZ LYS A 50 1.068 7.922 10.152 1.00 0.00 N ATOM 733 H LYS A 50 1.851 3.899 5.199 1.00 0.00 H ATOM 734 HA LYS A 50 0.607 6.231 4.790 1.00 0.00 H ATOM 735 HB2 LYS A 50 3.271 6.079 6.218 1.00 0.00 H ATOM 736 HB3 LYS A 50 2.031 7.298 6.428 1.00 0.00 H ATOM 737 HG2 LYS A 50 0.831 4.679 6.854 1.00 0.00 H ATOM 738 HG3 LYS A 50 2.328 4.805 7.783 1.00 0.00 H ATOM 739 HD2 LYS A 50 0.120 6.899 7.815 1.00 0.00 H ATOM 740 HD3 LYS A 50 0.202 5.542 8.956 1.00 0.00 H ATOM 741 HE2 LYS A 50 2.349 6.281 9.835 1.00 0.00 H ATOM 742 HE3 LYS A 50 2.472 7.572 8.636 1.00 0.00 H ATOM 743 HZ1 LYS A 50 0.421 7.415 10.740 1.00 0.00 H ATOM 744 HZ2 LYS A 50 1.737 8.398 10.742 1.00 0.00 H ATOM 745 HZ3 LYS A 50 0.559 8.614 9.619 1.00 0.00 H ATOM 746 N THR A 51 3.633 6.701 3.456 1.00 0.00 N ATOM 747 CA THR A 51 4.453 7.779 2.899 1.00 0.00 C ATOM 748 C THR A 51 3.991 8.220 1.514 1.00 0.00 C ATOM 749 O THR A 51 3.848 9.418 1.258 1.00 0.00 O ATOM 750 CB THR A 51 5.936 7.393 2.898 1.00 0.00 C ATOM 751 OG1 THR A 51 6.141 6.167 2.226 1.00 0.00 O ATOM 752 CG2 THR A 51 6.477 7.321 4.327 1.00 0.00 C ATOM 753 H THR A 51 4.064 5.806 3.656 1.00 0.00 H ATOM 754 HA THR A 51 4.326 8.661 3.528 1.00 0.00 H ATOM 755 HB THR A 51 6.492 8.164 2.363 1.00 0.00 H ATOM 756 HG1 THR A 51 5.800 5.435 2.753 1.00 0.00 H ATOM 757 HG21 THR A 51 5.860 6.660 4.936 1.00 0.00 H ATOM 758 HG22 THR A 51 7.503 6.953 4.313 1.00 0.00 H ATOM 759 HG23 THR A 51 6.465 8.316 4.772 1.00 0.00 H ATOM 760 N CYS A 52 3.767 7.253 0.625 1.00 0.00 N ATOM 761 CA CYS A 52 3.141 7.498 -0.663 1.00 0.00 C ATOM 762 C CYS A 52 1.707 7.995 -0.442 1.00 0.00 C ATOM 763 O CYS A 52 1.239 8.108 0.693 1.00 0.00 O ATOM 764 CB CYS A 52 3.186 6.232 -1.480 1.00 0.00 C ATOM 765 SG CYS A 52 4.809 5.989 -2.263 1.00 0.00 S ATOM 766 H CYS A 52 3.943 6.299 0.905 1.00 0.00 H ATOM 767 HA CYS A 52 3.690 8.278 -1.193 1.00 0.00 H ATOM 768 HB2 CYS A 52 2.933 5.382 -0.844 1.00 0.00 H ATOM 769 HB3 CYS A 52 2.463 6.286 -2.280 1.00 0.00 H ATOM 770 N HIS A 53 0.990 8.303 -1.526 1.00 0.00 N ATOM 771 CA HIS A 53 -0.359 8.866 -1.507 1.00 0.00 C ATOM 772 C HIS A 53 -0.293 10.326 -1.062 1.00 0.00 C ATOM 773 O HIS A 53 -0.491 11.231 -1.876 1.00 0.00 O ATOM 774 CB HIS A 53 -1.347 8.057 -0.642 1.00 0.00 C ATOM 775 CG HIS A 53 -1.148 6.567 -0.705 1.00 0.00 C ATOM 776 ND1 HIS A 53 -0.343 5.839 0.143 1.00 0.00 N ATOM 777 CD2 HIS A 53 -1.517 5.750 -1.737 1.00 0.00 C ATOM 778 CE1 HIS A 53 -0.209 4.618 -0.389 1.00 0.00 C ATOM 779 NE2 HIS A 53 -0.904 4.510 -1.532 1.00 0.00 N ATOM 780 H HIS A 53 1.419 8.152 -2.427 1.00 0.00 H ATOM 781 HA HIS A 53 -0.722 8.834 -2.535 1.00 0.00 H ATOM 782 HB2 HIS A 53 -1.271 8.342 0.407 1.00 0.00 H ATOM 783 HB3 HIS A 53 -2.358 8.302 -0.968 1.00 0.00 H ATOM 784 HD1 HIS A 53 0.200 6.195 0.926 1.00 0.00 H ATOM 785 HD2 HIS A 53 -2.095 6.050 -2.598 1.00 0.00 H ATOM 786 HE1 HIS A 53 0.431 3.858 0.030 1.00 0.00 H ATOM 787 N LYS A 54 0.046 10.555 0.214 1.00 0.00 N ATOM 788 CA LYS A 54 0.134 11.876 0.828 1.00 0.00 C ATOM 789 C LYS A 54 1.395 12.592 0.348 1.00 0.00 C ATOM 790 O LYS A 54 2.330 12.826 1.115 1.00 0.00 O ATOM 791 CB LYS A 54 0.038 11.787 2.350 1.00 0.00 C ATOM 792 CG LYS A 54 0.941 10.708 2.926 1.00 0.00 C ATOM 793 CD LYS A 54 1.283 11.017 4.388 1.00 0.00 C ATOM 794 CE LYS A 54 2.662 11.675 4.533 1.00 0.00 C ATOM 795 NZ LYS A 54 2.790 12.916 3.744 1.00 0.00 N ATOM 796 H LYS A 54 0.349 9.750 0.759 1.00 0.00 H ATOM 797 HA LYS A 54 -0.728 12.458 0.539 1.00 0.00 H ATOM 798 HB2 LYS A 54 0.248 12.770 2.772 1.00 0.00 H ATOM 799 HB3 LYS A 54 -0.977 11.507 2.629 1.00 0.00 H ATOM 800 HG2 LYS A 54 0.361 9.786 2.868 1.00 0.00 H ATOM 801 HG3 LYS A 54 1.837 10.575 2.321 1.00 0.00 H ATOM 802 HD2 LYS A 54 0.493 11.638 4.814 1.00 0.00 H ATOM 803 HD3 LYS A 54 1.300 10.074 4.938 1.00 0.00 H ATOM 804 HE2 LYS A 54 2.838 11.897 5.588 1.00 0.00 H ATOM 805 HE3 LYS A 54 3.424 10.967 4.199 1.00 0.00 H ATOM 806 HZ1 LYS A 54 2.089 13.588 4.014 1.00 0.00 H ATOM 807 HZ2 LYS A 54 3.707 13.321 3.862 1.00 0.00 H ATOM 808 HZ3 LYS A 54 2.666 12.713 2.754 1.00 0.00 H ATOM 809 N SER A 55 1.411 12.894 -0.944 1.00 0.00 N ATOM 810 CA SER A 55 2.562 13.297 -1.732 1.00 0.00 C ATOM 811 C SER A 55 2.059 13.573 -3.152 1.00 0.00 C ATOM 812 O SER A 55 2.395 14.592 -3.749 1.00 0.00 O ATOM 813 CB SER A 55 3.624 12.183 -1.720 1.00 0.00 C ATOM 814 OG SER A 55 4.788 12.606 -2.398 1.00 0.00 O ATOM 815 H SER A 55 0.552 12.693 -1.445 1.00 0.00 H ATOM 816 HA SER A 55 2.988 14.211 -1.313 1.00 0.00 H ATOM 817 HB2 SER A 55 3.903 11.934 -0.695 1.00 0.00 H ATOM 818 HB3 SER A 55 3.230 11.287 -2.204 1.00 0.00 H ATOM 819 HG SER A 55 5.437 11.897 -2.388 1.00 0.00 H ATOM 820 N ASN A 56 1.213 12.670 -3.669 1.00 0.00 N ATOM 821 CA ASN A 56 0.585 12.802 -4.974 1.00 0.00 C ATOM 822 C ASN A 56 -0.855 13.276 -4.793 1.00 0.00 C ATOM 823 O ASN A 56 -1.197 14.393 -5.171 1.00 0.00 O ATOM 824 CB ASN A 56 0.623 11.457 -5.720 1.00 0.00 C ATOM 825 CG ASN A 56 2.041 10.967 -5.975 1.00 0.00 C ATOM 826 OD1 ASN A 56 2.489 9.999 -5.367 1.00 0.00 O ATOM 827 ND2 ASN A 56 2.770 11.631 -6.868 1.00 0.00 N ATOM 828 H ASN A 56 0.906 11.897 -3.092 1.00 0.00 H ATOM 829 HA ASN A 56 1.111 13.540 -5.582 1.00 0.00 H ATOM 830 HB2 ASN A 56 0.096 10.691 -5.151 1.00 0.00 H ATOM 831 HB3 ASN A 56 0.122 11.573 -6.681 1.00 0.00 H ATOM 832 HD21 ASN A 56 2.390 12.441 -7.334 1.00 0.00 H ATOM 833 HD22 ASN A 56 3.721 11.339 -7.029 1.00 0.00 H ATOM 834 N ASN A 57 -1.695 12.406 -4.227 1.00 0.00 N ATOM 835 CA ASN A 57 -3.151 12.469 -4.194 1.00 0.00 C ATOM 836 C ASN A 57 -3.630 11.092 -3.724 1.00 0.00 C ATOM 837 O ASN A 57 -2.810 10.200 -3.512 1.00 0.00 O ATOM 838 CB ASN A 57 -3.761 12.844 -5.562 1.00 0.00 C ATOM 839 CG ASN A 57 -3.255 11.983 -6.719 1.00 0.00 C ATOM 840 OD1 ASN A 57 -2.281 12.335 -7.378 1.00 0.00 O ATOM 841 ND2 ASN A 57 -3.910 10.863 -7.003 1.00 0.00 N ATOM 842 H ASN A 57 -1.318 11.553 -3.821 1.00 0.00 H ATOM 843 HA ASN A 57 -3.452 13.213 -3.455 1.00 0.00 H ATOM 844 HB2 ASN A 57 -4.848 12.770 -5.513 1.00 0.00 H ATOM 845 HB3 ASN A 57 -3.532 13.886 -5.787 1.00 0.00 H ATOM 846 HD21 ASN A 57 -4.707 10.556 -6.468 1.00 0.00 H ATOM 847 HD22 ASN A 57 -3.523 10.278 -7.747 1.00 0.00 H ATOM 848 N GLY A 58 -4.942 10.922 -3.545 1.00 0.00 N ATOM 849 CA GLY A 58 -5.521 9.681 -3.043 1.00 0.00 C ATOM 850 C GLY A 58 -5.676 9.747 -1.519 1.00 0.00 C ATOM 851 O GLY A 58 -5.978 10.821 -0.997 1.00 0.00 O ATOM 852 H GLY A 58 -5.565 11.705 -3.667 1.00 0.00 H ATOM 853 HA2 GLY A 58 -6.513 9.568 -3.478 1.00 0.00 H ATOM 854 HA3 GLY A 58 -4.917 8.834 -3.366 1.00 0.00 H ATOM 855 N PRO A 59 -5.513 8.640 -0.776 1.00 0.00 N ATOM 856 CA PRO A 59 -5.820 8.593 0.646 1.00 0.00 C ATOM 857 C PRO A 59 -4.781 9.362 1.464 1.00 0.00 C ATOM 858 O PRO A 59 -3.614 8.981 1.498 1.00 0.00 O ATOM 859 CB PRO A 59 -5.830 7.104 0.992 1.00 0.00 C ATOM 860 CG PRO A 59 -4.864 6.484 -0.014 1.00 0.00 C ATOM 861 CD PRO A 59 -5.156 7.317 -1.260 1.00 0.00 C ATOM 862 HA PRO A 59 -6.812 9.004 0.843 1.00 0.00 H ATOM 863 HB2 PRO A 59 -5.548 6.911 2.027 1.00 0.00 H ATOM 864 HB3 PRO A 59 -6.820 6.710 0.775 1.00 0.00 H ATOM 865 HG2 PRO A 59 -3.836 6.640 0.312 1.00 0.00 H ATOM 866 HG3 PRO A 59 -5.052 5.421 -0.175 1.00 0.00 H ATOM 867 HD2 PRO A 59 -4.295 7.307 -1.929 1.00 0.00 H ATOM 868 HD3 PRO A 59 -6.025 6.893 -1.755 1.00 0.00 H ATOM 869 N THR A 60 -5.197 10.445 2.133 1.00 0.00 N ATOM 870 CA THR A 60 -4.248 11.344 2.785 1.00 0.00 C ATOM 871 C THR A 60 -4.858 12.125 3.958 1.00 0.00 C ATOM 872 O THR A 60 -4.311 13.154 4.350 1.00 0.00 O ATOM 873 CB THR A 60 -3.699 12.302 1.706 1.00 0.00 C ATOM 874 OG1 THR A 60 -2.692 13.147 2.224 1.00 0.00 O ATOM 875 CG2 THR A 60 -4.783 13.209 1.107 1.00 0.00 C ATOM 876 H THR A 60 -6.143 10.764 1.997 1.00 0.00 H ATOM 877 HA THR A 60 -3.443 10.725 3.204 1.00 0.00 H ATOM 878 HB THR A 60 -3.282 11.692 0.903 1.00 0.00 H ATOM 879 HG1 THR A 60 -3.038 13.557 3.029 1.00 0.00 H ATOM 880 HG21 THR A 60 -5.604 12.624 0.701 1.00 0.00 H ATOM 881 HG22 THR A 60 -5.173 13.895 1.860 1.00 0.00 H ATOM 882 HG23 THR A 60 -4.344 13.796 0.299 1.00 0.00 H ATOM 883 N LYS A 61 -5.982 11.666 4.515 1.00 0.00 N ATOM 884 CA LYS A 61 -6.676 12.363 5.599 1.00 0.00 C ATOM 885 C LYS A 61 -7.254 11.355 6.594 1.00 0.00 C ATOM 886 O LYS A 61 -8.339 11.551 7.137 1.00 0.00 O ATOM 887 CB LYS A 61 -7.706 13.346 5.034 1.00 0.00 C ATOM 888 CG LYS A 61 -8.659 12.630 4.088 1.00 0.00 C ATOM 889 CD LYS A 61 -9.738 13.598 3.584 1.00 0.00 C ATOM 890 CE LYS A 61 -10.634 12.964 2.511 1.00 0.00 C ATOM 891 NZ LYS A 61 -11.407 11.816 3.030 1.00 0.00 N ATOM 892 H LYS A 61 -6.367 10.791 4.194 1.00 0.00 H ATOM 893 HA LYS A 61 -5.984 12.975 6.150 1.00 0.00 H ATOM 894 HB2 LYS A 61 -8.264 13.802 5.852 1.00 0.00 H ATOM 895 HB3 LYS A 61 -7.183 14.130 4.485 1.00 0.00 H ATOM 896 HG2 LYS A 61 -8.064 12.260 3.257 1.00 0.00 H ATOM 897 HG3 LYS A 61 -9.080 11.798 4.646 1.00 0.00 H ATOM 898 HD2 LYS A 61 -10.338 13.952 4.427 1.00 0.00 H ATOM 899 HD3 LYS A 61 -9.242 14.466 3.142 1.00 0.00 H ATOM 900 HE2 LYS A 61 -11.329 13.723 2.146 1.00 0.00 H ATOM 901 HE3 LYS A 61 -10.015 12.639 1.671 1.00 0.00 H ATOM 902 HZ1 LYS A 61 -12.000 12.112 3.792 1.00 0.00 H ATOM 903 HZ2 LYS A 61 -11.986 11.435 2.294 1.00 0.00 H ATOM 904 HZ3 LYS A 61 -10.782 11.095 3.360 1.00 0.00 H ATOM 905 N CYS A 62 -6.523 10.249 6.763 1.00 0.00 N ATOM 906 CA CYS A 62 -6.996 8.998 7.338 1.00 0.00 C ATOM 907 C CYS A 62 -8.326 8.557 6.692 1.00 0.00 C ATOM 908 O CYS A 62 -8.768 9.143 5.698 1.00 0.00 O ATOM 909 CB CYS A 62 -6.966 9.066 8.854 1.00 0.00 C ATOM 910 SG CYS A 62 -7.085 7.458 9.714 1.00 0.00 S ATOM 911 H CYS A 62 -5.620 10.229 6.316 1.00 0.00 H ATOM 912 HA CYS A 62 -6.251 8.288 6.998 1.00 0.00 H ATOM 913 HB2 CYS A 62 -6.042 9.551 9.165 1.00 0.00 H ATOM 914 HB3 CYS A 62 -7.797 9.688 9.184 1.00 0.00 H ATOM 915 N GLY A 63 -8.925 7.462 7.164 1.00 0.00 N ATOM 916 CA GLY A 63 -9.999 6.785 6.460 1.00 0.00 C ATOM 917 C GLY A 63 -9.472 6.277 5.119 1.00 0.00 C ATOM 918 O GLY A 63 -8.958 5.169 5.058 1.00 0.00 O ATOM 919 H GLY A 63 -8.532 6.997 7.967 1.00 0.00 H ATOM 920 HA2 GLY A 63 -10.333 5.935 7.057 1.00 0.00 H ATOM 921 HA3 GLY A 63 -10.842 7.462 6.312 1.00 0.00 H ATOM 922 N GLY A 64 -9.544 7.140 4.099 1.00 0.00 N ATOM 923 CA GLY A 64 -9.165 6.995 2.697 1.00 0.00 C ATOM 924 C GLY A 64 -8.825 5.574 2.244 1.00 0.00 C ATOM 925 O GLY A 64 -9.564 4.955 1.484 1.00 0.00 O ATOM 926 H GLY A 64 -9.745 8.083 4.399 1.00 0.00 H ATOM 927 HA2 GLY A 64 -9.987 7.368 2.084 1.00 0.00 H ATOM 928 HA3 GLY A 64 -8.304 7.646 2.521 1.00 0.00 H ATOM 929 N CYS A 65 -7.653 5.109 2.670 1.00 0.00 N ATOM 930 CA CYS A 65 -7.044 3.852 2.253 1.00 0.00 C ATOM 931 C CYS A 65 -7.902 2.655 2.672 1.00 0.00 C ATOM 932 O CYS A 65 -8.070 1.695 1.921 1.00 0.00 O ATOM 933 CB CYS A 65 -5.666 3.804 2.854 1.00 0.00 C ATOM 934 SG CYS A 65 -4.764 2.341 2.295 1.00 0.00 S ATOM 935 H CYS A 65 -7.198 5.652 3.387 1.00 0.00 H ATOM 936 HA CYS A 65 -6.949 3.849 1.165 1.00 0.00 H ATOM 937 HB2 CYS A 65 -5.132 4.688 2.528 1.00 0.00 H ATOM 938 HB3 CYS A 65 -5.725 3.797 3.942 1.00 0.00 H ATOM 939 N HIS A 66 -8.461 2.747 3.879 1.00 0.00 N ATOM 940 CA HIS A 66 -9.428 1.822 4.431 1.00 0.00 C ATOM 941 C HIS A 66 -10.835 2.234 4.015 1.00 0.00 C ATOM 942 O HIS A 66 -11.362 3.253 4.466 1.00 0.00 O ATOM 943 CB HIS A 66 -9.317 1.837 5.953 1.00 0.00 C ATOM 944 CG HIS A 66 -8.068 1.163 6.435 1.00 0.00 C ATOM 945 ND1 HIS A 66 -7.979 -0.160 6.786 1.00 0.00 N ATOM 946 CD2 HIS A 66 -6.877 1.766 6.724 1.00 0.00 C ATOM 947 CE1 HIS A 66 -6.756 -0.348 7.305 1.00 0.00 C ATOM 948 NE2 HIS A 66 -6.050 0.801 7.306 1.00 0.00 N ATOM 949 H HIS A 66 -8.330 3.614 4.384 1.00 0.00 H ATOM 950 HA HIS A 66 -9.221 0.809 4.083 1.00 0.00 H ATOM 951 HB2 HIS A 66 -9.359 2.860 6.328 1.00 0.00 H ATOM 952 HB3 HIS A 66 -10.171 1.297 6.361 1.00 0.00 H ATOM 953 HD1 HIS A 66 -8.766 -0.805 6.818 1.00 0.00 H ATOM 954 HD2 HIS A 66 -6.661 2.817 6.610 1.00 0.00 H ATOM 955 HE1 HIS A 66 -6.439 -1.279 7.747 1.00 0.00 H ATOM 956 N ILE A 67 -11.473 1.409 3.191 1.00 0.00 N ATOM 957 CA ILE A 67 -12.875 1.560 2.864 1.00 0.00 C ATOM 958 C ILE A 67 -13.683 1.051 4.063 1.00 0.00 C ATOM 959 O ILE A 67 -14.141 -0.094 4.054 1.00 0.00 O ATOM 960 CB ILE A 67 -13.185 0.826 1.546 1.00 0.00 C ATOM 961 CG1 ILE A 67 -12.198 1.181 0.414 1.00 0.00 C ATOM 962 CG2 ILE A 67 -14.630 1.092 1.101 1.00 0.00 C ATOM 963 CD1 ILE A 67 -12.074 2.682 0.128 1.00 0.00 C ATOM 964 H ILE A 67 -11.011 0.556 2.894 1.00 0.00 H ATOM 965 HA ILE A 67 -13.106 2.617 2.719 1.00 0.00 H ATOM 966 HB ILE A 67 -13.082 -0.245 1.718 1.00 0.00 H ATOM 967 HG12 ILE A 67 -11.207 0.798 0.661 1.00 0.00 H ATOM 968 HG13 ILE A 67 -12.521 0.681 -0.499 1.00 0.00 H ATOM 969 HG21 ILE A 67 -14.809 2.161 0.993 1.00 0.00 H ATOM 970 HG22 ILE A 67 -14.819 0.599 0.147 1.00 0.00 H ATOM 971 HG23 ILE A 67 -15.330 0.693 1.835 1.00 0.00 H ATOM 972 HD11 ILE A 67 -13.042 3.106 -0.140 1.00 0.00 H ATOM 973 HD12 ILE A 67 -11.675 3.208 0.995 1.00 0.00 H ATOM 974 HD13 ILE A 67 -11.387 2.829 -0.706 1.00 0.00 H ATOM 975 N LYS A 68 -13.821 1.919 5.077 1.00 0.00 N ATOM 976 CA LYS A 68 -14.632 1.814 6.296 1.00 0.00 C ATOM 977 C LYS A 68 -13.737 1.592 7.530 1.00 0.00 C ATOM 978 O LYS A 68 -12.493 1.645 7.408 1.00 0.00 O ATOM 979 CB LYS A 68 -15.771 0.784 6.163 1.00 0.00 C ATOM 980 CG LYS A 68 -16.919 0.965 7.167 1.00 0.00 C ATOM 981 CD LYS A 68 -17.537 -0.408 7.462 1.00 0.00 C ATOM 982 CE LYS A 68 -18.715 -0.287 8.436 1.00 0.00 C ATOM 983 NZ LYS A 68 -19.216 -1.613 8.852 1.00 0.00 N ATOM 984 OXT LYS A 68 -14.269 1.465 8.658 1.00 0.00 O ATOM 985 H LYS A 68 -13.199 2.721 5.035 1.00 0.00 H ATOM 986 HA LYS A 68 -15.100 2.790 6.421 1.00 0.00 H ATOM 987 HB2 LYS A 68 -16.214 0.848 5.169 1.00 0.00 H ATOM 988 HB3 LYS A 68 -15.341 -0.205 6.288 1.00 0.00 H ATOM 989 HG2 LYS A 68 -16.557 1.397 8.098 1.00 0.00 H ATOM 990 HG3 LYS A 68 -17.660 1.644 6.740 1.00 0.00 H ATOM 991 HD2 LYS A 68 -17.862 -0.858 6.521 1.00 0.00 H ATOM 992 HD3 LYS A 68 -16.757 -1.033 7.904 1.00 0.00 H ATOM 993 HE2 LYS A 68 -18.391 0.261 9.325 1.00 0.00 H ATOM 994 HE3 LYS A 68 -19.521 0.273 7.957 1.00 0.00 H ATOM 995 HZ1 LYS A 68 -19.520 -2.141 8.045 1.00 0.00 H ATOM 996 HZ2 LYS A 68 -18.483 -2.127 9.324 1.00 0.00 H ATOM 997 HZ3 LYS A 68 -19.996 -1.504 9.485 1.00 0.00 H TER 998 LYS A 68 HETATM 999 FE HEC A 69 4.753 -6.920 -5.055 1.00 0.00 FE HETATM 1000 CHA HEC A 69 4.161 -9.615 -2.948 1.00 0.00 C HETATM 1001 CHB HEC A 69 6.355 -8.933 -7.324 1.00 0.00 C HETATM 1002 CHC HEC A 69 4.726 -4.315 -7.266 1.00 0.00 C HETATM 1003 CHD HEC A 69 3.673 -4.783 -2.527 1.00 0.00 C HETATM 1004 NA HEC A 69 5.235 -8.901 -5.094 1.00 0.00 N HETATM 1005 C1A HEC A 69 4.858 -9.818 -4.150 1.00 0.00 C HETATM 1006 C2A HEC A 69 5.267 -11.111 -4.641 1.00 0.00 C HETATM 1007 C3A HEC A 69 6.014 -10.909 -5.782 1.00 0.00 C HETATM 1008 C4A HEC A 69 5.897 -9.511 -6.128 1.00 0.00 C HETATM 1009 CMA HEC A 69 6.737 -11.989 -6.553 1.00 0.00 C HETATM 1010 CAA HEC A 69 4.784 -12.443 -4.119 1.00 0.00 C HETATM 1011 CBA HEC A 69 3.264 -12.622 -4.269 1.00 0.00 C HETATM 1012 CGA HEC A 69 2.803 -12.396 -5.709 1.00 0.00 C HETATM 1013 O1A HEC A 69 1.910 -11.541 -5.906 1.00 0.00 O HETATM 1014 O2A HEC A 69 3.359 -13.083 -6.592 1.00 0.00 O HETATM 1015 NB HEC A 69 5.455 -6.657 -6.948 1.00 0.00 N HETATM 1016 C1B HEC A 69 6.092 -7.606 -7.682 1.00 0.00 C HETATM 1017 C2B HEC A 69 6.417 -7.016 -8.962 1.00 0.00 C HETATM 1018 C3B HEC A 69 5.913 -5.730 -8.967 1.00 0.00 C HETATM 1019 C4B HEC A 69 5.314 -5.511 -7.670 1.00 0.00 C HETATM 1020 CMB HEC A 69 7.114 -7.722 -10.100 1.00 0.00 C HETATM 1021 CAB HEC A 69 5.944 -4.725 -10.110 1.00 0.00 C HETATM 1022 CBB HEC A 69 5.098 -5.157 -11.308 1.00 0.00 C HETATM 1023 NC HEC A 69 4.285 -4.912 -4.918 1.00 0.00 N HETATM 1024 C1C HEC A 69 4.324 -4.057 -5.965 1.00 0.00 C HETATM 1025 C2C HEC A 69 3.882 -2.770 -5.495 1.00 0.00 C HETATM 1026 C3C HEC A 69 3.621 -2.885 -4.149 1.00 0.00 C HETATM 1027 C4C HEC A 69 3.869 -4.261 -3.795 1.00 0.00 C HETATM 1028 CMC HEC A 69 3.759 -1.515 -6.306 1.00 0.00 C HETATM 1029 CAC HEC A 69 3.246 -1.766 -3.193 1.00 0.00 C HETATM 1030 CBC HEC A 69 1.906 -1.087 -3.481 1.00 0.00 C HETATM 1031 ND HEC A 69 4.033 -7.157 -3.075 1.00 0.00 N HETATM 1032 C1D HEC A 69 3.704 -6.134 -2.253 1.00 0.00 C HETATM 1033 C2D HEC A 69 3.331 -6.683 -0.979 1.00 0.00 C HETATM 1034 C3D HEC A 69 3.339 -8.056 -1.114 1.00 0.00 C HETATM 1035 C4D HEC A 69 3.864 -8.347 -2.436 1.00 0.00 C HETATM 1036 CMD HEC A 69 2.915 -5.858 0.222 1.00 0.00 C HETATM 1037 CAD HEC A 69 2.933 -9.052 -0.047 1.00 0.00 C HETATM 1038 CBD HEC A 69 1.419 -9.192 0.150 1.00 0.00 C HETATM 1039 CGD HEC A 69 1.088 -10.237 1.210 1.00 0.00 C HETATM 1040 O1D HEC A 69 -0.103 -10.602 1.293 1.00 0.00 O HETATM 1041 O2D HEC A 69 2.023 -10.665 1.921 1.00 0.00 O HETATM 1042 HHA HEC A 69 3.934 -10.480 -2.352 1.00 0.00 H HETATM 1043 HHB HEC A 69 6.849 -9.557 -8.049 1.00 0.00 H HETATM 1044 HHC HEC A 69 4.662 -3.509 -7.965 1.00 0.00 H HETATM 1045 HHD HEC A 69 3.375 -4.132 -1.728 1.00 0.00 H HETATM 1046 HMA1 HEC A 69 7.420 -12.509 -5.880 1.00 0.00 H HETATM 1047 HMA2 HEC A 69 6.009 -12.698 -6.950 1.00 0.00 H HETATM 1048 HMA3 HEC A 69 7.323 -11.585 -7.375 1.00 0.00 H HETATM 1049 HAA1 HEC A 69 5.266 -13.243 -4.679 1.00 0.00 H HETATM 1050 HAA2 HEC A 69 5.063 -12.548 -3.071 1.00 0.00 H HETATM 1051 HBA1 HEC A 69 2.998 -13.638 -3.980 1.00 0.00 H HETATM 1052 HBA2 HEC A 69 2.732 -11.932 -3.613 1.00 0.00 H HETATM 1053 HMB1 HEC A 69 7.441 -7.017 -10.862 1.00 0.00 H HETATM 1054 HMB2 HEC A 69 7.996 -8.241 -9.728 1.00 0.00 H HETATM 1055 HMB3 HEC A 69 6.433 -8.442 -10.552 1.00 0.00 H HETATM 1056 HAB HEC A 69 5.538 -3.775 -9.797 1.00 0.00 H HETATM 1057 HBB1 HEC A 69 4.060 -5.252 -10.986 1.00 0.00 H HETATM 1058 HBB2 HEC A 69 5.166 -4.397 -12.086 1.00 0.00 H HETATM 1059 HBB3 HEC A 69 5.450 -6.105 -11.705 1.00 0.00 H HETATM 1060 HMC1 HEC A 69 4.550 -0.819 -6.007 1.00 0.00 H HETATM 1061 HMC2 HEC A 69 3.801 -1.679 -7.379 1.00 0.00 H HETATM 1062 HMC3 HEC A 69 2.772 -1.130 -6.082 1.00 0.00 H HETATM 1063 HAC HEC A 69 3.155 -2.146 -2.184 1.00 0.00 H HETATM 1064 HBC1 HEC A 69 2.008 -0.317 -4.240 1.00 0.00 H HETATM 1065 HBC2 HEC A 69 1.180 -1.836 -3.797 1.00 0.00 H HETATM 1066 HBC3 HEC A 69 1.545 -0.609 -2.573 1.00 0.00 H HETATM 1067 HMD1 HEC A 69 3.780 -5.366 0.666 1.00 0.00 H HETATM 1068 HMD2 HEC A 69 2.226 -5.057 -0.052 1.00 0.00 H HETATM 1069 HMD3 HEC A 69 2.440 -6.505 0.951 1.00 0.00 H HETATM 1070 HAD1 HEC A 69 3.297 -10.045 -0.299 1.00 0.00 H HETATM 1071 HAD2 HEC A 69 3.373 -8.759 0.906 1.00 0.00 H HETATM 1072 HBD1 HEC A 69 0.986 -8.243 0.461 1.00 0.00 H HETATM 1073 HBD2 HEC A 69 0.960 -9.496 -0.791 1.00 0.00 H HETATM 1074 FE HEC A 70 -0.906 2.984 -2.740 1.00 0.00 FE HETATM 1075 CHA HEC A 70 -3.261 4.397 -4.842 1.00 0.00 C HETATM 1076 CHB HEC A 70 -3.378 1.393 -0.938 1.00 0.00 C HETATM 1077 CHC HEC A 70 1.543 1.443 -0.797 1.00 0.00 C HETATM 1078 CHD HEC A 70 1.580 4.855 -4.291 1.00 0.00 C HETATM 1079 NA HEC A 70 -2.952 2.954 -2.833 1.00 0.00 N HETATM 1080 C1A HEC A 70 -3.702 3.594 -3.786 1.00 0.00 C HETATM 1081 C2A HEC A 70 -5.089 3.284 -3.522 1.00 0.00 C HETATM 1082 C3A HEC A 70 -5.120 2.476 -2.408 1.00 0.00 C HETATM 1083 C4A HEC A 70 -3.756 2.238 -1.993 1.00 0.00 C HETATM 1084 CMA HEC A 70 -6.357 1.856 -1.813 1.00 0.00 C HETATM 1085 CAA HEC A 70 -6.292 3.665 -4.365 1.00 0.00 C HETATM 1086 CBA HEC A 70 -7.161 4.805 -3.805 1.00 0.00 C HETATM 1087 CGA HEC A 70 -6.664 6.213 -4.127 1.00 0.00 C HETATM 1088 O1A HEC A 70 -5.470 6.362 -4.460 1.00 0.00 O HETATM 1089 O2A HEC A 70 -7.490 7.141 -3.994 1.00 0.00 O HETATM 1090 NB HEC A 70 -0.914 1.681 -1.130 1.00 0.00 N HETATM 1091 C1B HEC A 70 -2.043 1.167 -0.564 1.00 0.00 C HETATM 1092 C2B HEC A 70 -1.620 0.261 0.480 1.00 0.00 C HETATM 1093 C3B HEC A 70 -0.246 0.342 0.582 1.00 0.00 C HETATM 1094 C4B HEC A 70 0.201 1.183 -0.507 1.00 0.00 C HETATM 1095 CMB HEC A 70 -2.531 -0.677 1.229 1.00 0.00 C HETATM 1096 CAB HEC A 70 0.658 -0.325 1.612 1.00 0.00 C HETATM 1097 CBB HEC A 70 0.795 -1.844 1.416 1.00 0.00 C HETATM 1098 NC HEC A 70 1.195 3.069 -2.624 1.00 0.00 N HETATM 1099 C1C HEC A 70 1.964 2.343 -1.768 1.00 0.00 C HETATM 1100 C2C HEC A 70 3.345 2.711 -1.988 1.00 0.00 C HETATM 1101 C3C HEC A 70 3.350 3.736 -2.903 1.00 0.00 C HETATM 1102 C4C HEC A 70 1.979 3.926 -3.332 1.00 0.00 C HETATM 1103 CMC HEC A 70 4.548 2.193 -1.245 1.00 0.00 C HETATM 1104 CAC HEC A 70 4.540 4.560 -3.371 1.00 0.00 C HETATM 1105 CBC HEC A 70 5.885 3.846 -3.521 1.00 0.00 C HETATM 1106 ND HEC A 70 -0.843 4.350 -4.319 1.00 0.00 N HETATM 1107 C1D HEC A 70 0.278 4.980 -4.753 1.00 0.00 C HETATM 1108 C2D HEC A 70 -0.095 5.821 -5.859 1.00 0.00 C HETATM 1109 C3D HEC A 70 -1.455 5.697 -6.032 1.00 0.00 C HETATM 1110 C4D HEC A 70 -1.926 4.755 -5.040 1.00 0.00 C HETATM 1111 CMD HEC A 70 0.856 6.639 -6.698 1.00 0.00 C HETATM 1112 CAD HEC A 70 -2.296 6.508 -6.991 1.00 0.00 C HETATM 1113 CBD HEC A 70 -2.361 7.996 -6.622 1.00 0.00 C HETATM 1114 CGD HEC A 70 -1.708 8.856 -7.691 1.00 0.00 C HETATM 1115 O1D HEC A 70 -2.401 9.177 -8.682 1.00 0.00 O HETATM 1116 O2D HEC A 70 -0.496 9.137 -7.571 1.00 0.00 O HETATM 1117 HHA HEC A 70 -4.002 4.807 -5.502 1.00 0.00 H HETATM 1118 HHB HEC A 70 -4.156 0.873 -0.402 1.00 0.00 H HETATM 1119 HHC HEC A 70 2.303 0.968 -0.211 1.00 0.00 H HETATM 1120 HHD HEC A 70 2.325 5.486 -4.744 1.00 0.00 H HETATM 1121 HMA1 HEC A 70 -7.228 2.485 -1.994 1.00 0.00 H HETATM 1122 HMA2 HEC A 70 -6.505 0.895 -2.302 1.00 0.00 H HETATM 1123 HMA3 HEC A 70 -6.252 1.716 -0.738 1.00 0.00 H HETATM 1124 HAA1 HEC A 70 -6.002 3.907 -5.386 1.00 0.00 H HETATM 1125 HAA2 HEC A 70 -6.915 2.773 -4.433 1.00 0.00 H HETATM 1126 HBA1 HEC A 70 -8.156 4.715 -4.241 1.00 0.00 H HETATM 1127 HBA2 HEC A 70 -7.252 4.710 -2.723 1.00 0.00 H HETATM 1128 HMB1 HEC A 70 -2.882 -1.452 0.547 1.00 0.00 H HETATM 1129 HMB2 HEC A 70 -2.007 -1.139 2.057 1.00 0.00 H HETATM 1130 HMB3 HEC A 70 -3.386 -0.132 1.614 1.00 0.00 H HETATM 1131 HAB HEC A 70 1.656 0.080 1.530 1.00 0.00 H HETATM 1132 HBB1 HEC A 70 1.515 -2.242 2.132 1.00 0.00 H HETATM 1133 HBB2 HEC A 70 -0.160 -2.343 1.570 1.00 0.00 H HETATM 1134 HBB3 HEC A 70 1.149 -2.071 0.409 1.00 0.00 H HETATM 1135 HMC1 HEC A 70 5.339 1.930 -1.936 1.00 0.00 H HETATM 1136 HMC2 HEC A 70 4.879 2.994 -0.582 1.00 0.00 H HETATM 1137 HMC3 HEC A 70 4.336 1.283 -0.685 1.00 0.00 H HETATM 1138 HAC HEC A 70 4.324 4.883 -4.389 1.00 0.00 H HETATM 1139 HBC1 HEC A 70 6.368 3.731 -2.550 1.00 0.00 H HETATM 1140 HBC2 HEC A 70 5.765 2.878 -4.004 1.00 0.00 H HETATM 1141 HBC3 HEC A 70 6.532 4.472 -4.134 1.00 0.00 H HETATM 1142 HMD1 HEC A 70 0.409 6.855 -7.661 1.00 0.00 H HETATM 1143 HMD2 HEC A 70 1.081 7.574 -6.184 1.00 0.00 H HETATM 1144 HMD3 HEC A 70 1.779 6.090 -6.879 1.00 0.00 H HETATM 1145 HAD1 HEC A 70 -1.891 6.392 -7.995 1.00 0.00 H HETATM 1146 HAD2 HEC A 70 -3.316 6.132 -7.033 1.00 0.00 H HETATM 1147 HBD1 HEC A 70 -3.409 8.280 -6.523 1.00 0.00 H HETATM 1148 HBD2 HEC A 70 -1.875 8.180 -5.662 1.00 0.00 H HETATM 1149 FE HEC A 71 -4.358 1.126 8.228 1.00 0.00 FE HETATM 1150 CHA HEC A 71 -4.177 -2.217 9.113 1.00 0.00 C HETATM 1151 CHB HEC A 71 -6.268 1.838 11.000 1.00 0.00 C HETATM 1152 CHC HEC A 71 -4.272 4.481 7.360 1.00 0.00 C HETATM 1153 CHD HEC A 71 -2.962 0.379 5.084 1.00 0.00 C HETATM 1154 NA HEC A 71 -5.041 0.022 9.812 1.00 0.00 N HETATM 1155 C1A HEC A 71 -4.826 -1.320 9.981 1.00 0.00 C HETATM 1156 C2A HEC A 71 -5.487 -1.701 11.209 1.00 0.00 C HETATM 1157 C3A HEC A 71 -6.066 -0.570 11.741 1.00 0.00 C HETATM 1158 C4A HEC A 71 -5.813 0.521 10.826 1.00 0.00 C HETATM 1159 CMA HEC A 71 -6.823 -0.502 13.047 1.00 0.00 C HETATM 1160 CAA HEC A 71 -5.696 -3.116 11.700 1.00 0.00 C HETATM 1161 CBA HEC A 71 -6.903 -3.783 11.029 1.00 0.00 C HETATM 1162 CGA HEC A 71 -8.083 -4.029 11.960 1.00 0.00 C HETATM 1163 O1A HEC A 71 -8.245 -3.302 12.963 1.00 0.00 O HETATM 1164 O2A HEC A 71 -8.827 -4.997 11.708 1.00 0.00 O HETATM 1165 NB HEC A 71 -5.136 2.846 9.029 1.00 0.00 N HETATM 1166 C1B HEC A 71 -5.901 2.903 10.160 1.00 0.00 C HETATM 1167 C2B HEC A 71 -6.237 4.296 10.382 1.00 0.00 C HETATM 1168 C3B HEC A 71 -5.643 5.028 9.370 1.00 0.00 C HETATM 1169 C4B HEC A 71 -4.951 4.093 8.518 1.00 0.00 C HETATM 1170 CMB HEC A 71 -7.065 4.830 11.526 1.00 0.00 C HETATM 1171 CAB HEC A 71 -5.652 6.521 9.090 1.00 0.00 C HETATM 1172 CBB HEC A 71 -4.302 7.174 9.432 1.00 0.00 C HETATM 1173 NC HEC A 71 -3.683 2.249 6.534 1.00 0.00 N HETATM 1174 C1C HEC A 71 -3.759 3.598 6.435 1.00 0.00 C HETATM 1175 C2C HEC A 71 -3.230 3.994 5.151 1.00 0.00 C HETATM 1176 C3C HEC A 71 -3.073 2.830 4.424 1.00 0.00 C HETATM 1177 C4C HEC A 71 -3.201 1.729 5.368 1.00 0.00 C HETATM 1178 CMC HEC A 71 -2.988 5.424 4.685 1.00 0.00 C HETATM 1179 CAC HEC A 71 -3.081 2.691 2.905 1.00 0.00 C HETATM 1180 CBC HEC A 71 -2.468 3.833 2.073 1.00 0.00 C HETATM 1181 ND HEC A 71 -3.613 -0.601 7.300 1.00 0.00 N HETATM 1182 C1D HEC A 71 -3.120 -0.659 6.021 1.00 0.00 C HETATM 1183 C2D HEC A 71 -2.778 -2.040 5.770 1.00 0.00 C HETATM 1184 C3D HEC A 71 -3.121 -2.775 6.882 1.00 0.00 C HETATM 1185 C4D HEC A 71 -3.649 -1.850 7.864 1.00 0.00 C HETATM 1186 CMD HEC A 71 -2.160 -2.594 4.509 1.00 0.00 C HETATM 1187 CAD HEC A 71 -3.134 -4.290 6.945 1.00 0.00 C HETATM 1188 CBD HEC A 71 -4.054 -4.895 5.886 1.00 0.00 C HETATM 1189 CGD HEC A 71 -4.208 -6.398 6.020 1.00 0.00 C HETATM 1190 O1D HEC A 71 -5.348 -6.853 5.793 1.00 0.00 O HETATM 1191 O2D HEC A 71 -3.183 -7.050 6.312 1.00 0.00 O HETATM 1192 HHA HEC A 71 -4.156 -3.258 9.389 1.00 0.00 H HETATM 1193 HHB HEC A 71 -6.885 2.048 11.855 1.00 0.00 H HETATM 1194 HHC HEC A 71 -4.240 5.520 7.092 1.00 0.00 H HETATM 1195 HHD HEC A 71 -2.586 0.124 4.108 1.00 0.00 H HETATM 1196 HMA1 HEC A 71 -6.382 -1.184 13.772 1.00 0.00 H HETATM 1197 HMA2 HEC A 71 -6.800 0.499 13.473 1.00 0.00 H HETATM 1198 HMA3 HEC A 71 -7.855 -0.803 12.876 1.00 0.00 H HETATM 1199 HAA1 HEC A 71 -4.813 -3.712 11.473 1.00 0.00 H HETATM 1200 HAA2 HEC A 71 -5.807 -3.134 12.783 1.00 0.00 H HETATM 1201 HBA1 HEC A 71 -7.240 -3.174 10.192 1.00 0.00 H HETATM 1202 HBA2 HEC A 71 -6.587 -4.752 10.642 1.00 0.00 H HETATM 1203 HMB1 HEC A 71 -7.018 4.168 12.388 1.00 0.00 H HETATM 1204 HMB2 HEC A 71 -6.691 5.802 11.843 1.00 0.00 H HETATM 1205 HMB3 HEC A 71 -8.104 4.910 11.201 1.00 0.00 H HETATM 1206 HAB HEC A 71 -5.800 6.573 8.023 1.00 0.00 H HETATM 1207 HBB1 HEC A 71 -4.246 8.174 9.007 1.00 0.00 H HETATM 1208 HBB2 HEC A 71 -4.203 7.237 10.516 1.00 0.00 H HETATM 1209 HBB3 HEC A 71 -3.466 6.589 9.032 1.00 0.00 H HETATM 1210 HMC1 HEC A 71 -2.809 6.098 5.520 1.00 0.00 H HETATM 1211 HMC2 HEC A 71 -2.095 5.480 4.065 1.00 0.00 H HETATM 1212 HMC3 HEC A 71 -3.837 5.811 4.119 1.00 0.00 H HETATM 1213 HAC HEC A 71 -2.518 1.801 2.653 1.00 0.00 H HETATM 1214 HBC1 HEC A 71 -1.462 4.076 2.402 1.00 0.00 H HETATM 1215 HBC2 HEC A 71 -2.426 3.511 1.032 1.00 0.00 H HETATM 1216 HBC3 HEC A 71 -3.068 4.735 2.102 1.00 0.00 H HETATM 1217 HMD1 HEC A 71 -2.915 -2.671 3.729 1.00 0.00 H HETATM 1218 HMD2 HEC A 71 -1.355 -1.949 4.176 1.00 0.00 H HETATM 1219 HMD3 HEC A 71 -1.735 -3.578 4.695 1.00 0.00 H HETATM 1220 HAD1 HEC A 71 -2.126 -4.681 6.812 1.00 0.00 H HETATM 1221 HAD2 HEC A 71 -3.497 -4.649 7.903 1.00 0.00 H HETATM 1222 HBD1 HEC A 71 -5.036 -4.440 5.998 1.00 0.00 H HETATM 1223 HBD2 HEC A 71 -3.675 -4.717 4.885 1.00 0.00 H