HETATM 1 C ACE A 0 5.739 11.508 -8.776 1.00 3.72 C HETATM 2 O ACE A 0 6.153 11.107 -7.684 1.00 3.60 O HETATM 3 CH3 ACE A 0 6.703 12.173 -9.742 1.00 4.58 C HETATM 4 H1 ACE A 0 6.642 11.685 -10.714 1.00 4.91 H HETATM 5 H2 ACE A 0 6.450 13.227 -9.837 1.00 5.86 H HETATM 6 H3 ACE A 0 7.724 12.086 -9.369 1.00 4.29 H ATOM 7 N MET A 1 4.465 11.385 -9.160 1.00 3.68 N ATOM 8 CA MET A 1 3.467 10.641 -8.394 1.00 3.09 C ATOM 9 C MET A 1 3.878 9.182 -8.203 1.00 2.59 C ATOM 10 O MET A 1 4.020 8.436 -9.173 1.00 2.97 O ATOM 11 CB MET A 1 2.084 10.716 -9.056 1.00 3.89 C ATOM 12 CG MET A 1 1.569 12.156 -9.082 1.00 4.94 C ATOM 13 SD MET A 1 -0.201 12.323 -8.748 1.00 6.80 S ATOM 14 CE MET A 1 -0.839 12.359 -10.441 1.00 7.58 C ATOM 15 H MET A 1 4.244 11.662 -10.111 1.00 4.38 H ATOM 16 HA MET A 1 3.388 11.104 -7.410 1.00 2.83 H ATOM 17 HB2 MET A 1 2.119 10.318 -10.070 1.00 4.00 H ATOM 18 HB3 MET A 1 1.398 10.105 -8.468 1.00 4.46 H ATOM 19 HG2 MET A 1 2.095 12.733 -8.322 1.00 5.18 H ATOM 20 HG3 MET A 1 1.801 12.595 -10.052 1.00 5.19 H ATOM 21 HE1 MET A 1 -0.359 13.162 -10.999 1.00 7.40 H ATOM 22 HE2 MET A 1 -0.643 11.402 -10.926 1.00 7.53 H ATOM 23 HE3 MET A 1 -1.913 12.543 -10.419 1.00 8.81 H ATOM 24 N ASN A 2 4.090 8.786 -6.954 1.00 1.97 N ATOM 25 CA ASN A 2 4.112 7.399 -6.502 1.00 1.69 C ATOM 26 C ASN A 2 2.675 6.960 -6.219 1.00 1.43 C ATOM 27 O ASN A 2 1.824 7.827 -6.004 1.00 1.55 O ATOM 28 CB ASN A 2 4.868 7.323 -5.172 1.00 1.77 C ATOM 29 CG ASN A 2 6.369 7.385 -5.344 1.00 2.21 C ATOM 30 OD1 ASN A 2 7.007 6.384 -5.644 1.00 2.15 O ATOM 31 ND2 ASN A 2 6.969 8.540 -5.132 1.00 2.93 N ATOM 32 H ASN A 2 3.941 9.472 -6.225 1.00 1.97 H ATOM 33 HA ASN A 2 4.575 6.751 -7.247 1.00 1.71 H ATOM 34 HB2 ASN A 2 4.517 8.133 -4.538 1.00 2.00 H ATOM 35 HB3 ASN A 2 4.638 6.392 -4.652 1.00 1.49 H ATOM 36 HD21 ASN A 2 6.423 9.369 -4.924 1.00 3.26 H ATOM 37 HD22 ASN A 2 7.983 8.551 -5.113 1.00 3.22 H ATOM 38 N PRO A 3 2.405 5.650 -6.105 1.00 1.14 N ATOM 39 CA PRO A 3 1.150 5.186 -5.540 1.00 0.84 C ATOM 40 C PRO A 3 1.115 5.482 -4.039 1.00 0.59 C ATOM 41 O PRO A 3 2.149 5.486 -3.358 1.00 0.64 O ATOM 42 CB PRO A 3 1.115 3.684 -5.810 1.00 0.88 C ATOM 43 CG PRO A 3 2.592 3.294 -5.837 1.00 1.06 C ATOM 44 CD PRO A 3 3.274 4.528 -6.429 1.00 1.21 C ATOM 45 HA PRO A 3 0.309 5.676 -6.036 1.00 1.02 H ATOM 46 HB2 PRO A 3 0.570 3.149 -5.034 1.00 0.91 H ATOM 47 HB3 PRO A 3 0.670 3.501 -6.789 1.00 0.99 H ATOM 48 HG2 PRO A 3 2.947 3.130 -4.818 1.00 1.15 H ATOM 49 HG3 PRO A 3 2.756 2.409 -6.448 1.00 1.18 H ATOM 50 HD2 PRO A 3 4.269 4.643 -6.002 1.00 1.42 H ATOM 51 HD3 PRO A 3 3.340 4.428 -7.512 1.00 1.30 H ATOM 52 N ASN A 4 -0.096 5.661 -3.514 1.00 0.54 N ATOM 53 CA ASN A 4 -0.348 5.899 -2.102 1.00 0.46 C ATOM 54 C ASN A 4 -1.276 4.813 -1.572 1.00 0.43 C ATOM 55 O ASN A 4 -1.972 4.137 -2.336 1.00 0.55 O ATOM 56 CB ASN A 4 -0.903 7.311 -1.870 1.00 0.71 C ATOM 57 CG ASN A 4 0.209 8.349 -1.931 1.00 0.97 C ATOM 58 OD1 ASN A 4 0.619 8.878 -0.904 1.00 1.61 O ATOM 59 ND2 ASN A 4 0.748 8.635 -3.103 1.00 1.20 N ATOM 60 H ASN A 4 -0.912 5.610 -4.109 1.00 0.73 H ATOM 61 HA ASN A 4 0.588 5.836 -1.549 1.00 0.54 H ATOM 62 HB2 ASN A 4 -1.686 7.539 -2.593 1.00 0.83 H ATOM 63 HB3 ASN A 4 -1.348 7.354 -0.876 1.00 0.82 H ATOM 64 HD21 ASN A 4 0.378 8.197 -3.944 1.00 1.60 H ATOM 65 HD22 ASN A 4 1.498 9.310 -3.203 1.00 1.39 H ATOM 66 N CYS A 5 -1.236 4.643 -0.251 1.00 0.39 N ATOM 67 CA CYS A 5 -1.943 3.643 0.511 1.00 0.38 C ATOM 68 C CYS A 5 -3.423 3.876 0.299 1.00 0.45 C ATOM 69 O CYS A 5 -3.963 4.914 0.702 1.00 0.57 O ATOM 70 CB CYS A 5 -1.532 3.791 1.979 1.00 0.44 C ATOM 71 SG CYS A 5 -2.131 2.460 3.069 1.00 0.43 S ATOM 72 H CYS A 5 -0.608 5.239 0.273 1.00 0.36 H ATOM 73 HA CYS A 5 -1.655 2.654 0.152 1.00 0.50 H ATOM 74 HB2 CYS A 5 -0.447 3.800 2.019 1.00 0.60 H ATOM 75 HB3 CYS A 5 -1.879 4.753 2.352 1.00 0.50 H ATOM 76 N ALA A 6 -4.078 2.881 -0.284 1.00 0.62 N ATOM 77 CA ALA A 6 -5.520 2.847 -0.373 1.00 0.88 C ATOM 78 C ALA A 6 -6.181 2.834 1.016 1.00 0.79 C ATOM 79 O ALA A 6 -7.391 3.075 1.095 1.00 0.89 O ATOM 80 CB ALA A 6 -5.924 1.634 -1.208 1.00 1.23 C ATOM 81 H ALA A 6 -3.543 2.086 -0.623 1.00 0.69 H ATOM 82 HA ALA A 6 -5.852 3.745 -0.896 1.00 1.01 H ATOM 83 HB1 ALA A 6 -5.509 0.730 -0.768 1.00 2.51 H ATOM 84 HB2 ALA A 6 -7.010 1.566 -1.243 1.00 1.70 H ATOM 85 HB3 ALA A 6 -5.525 1.737 -2.214 1.00 2.01 H ATOM 86 N ARG A 7 -5.436 2.600 2.111 1.00 0.67 N ATOM 87 CA ARG A 7 -5.961 2.761 3.462 1.00 0.56 C ATOM 88 C ARG A 7 -5.627 4.155 3.976 1.00 0.56 C ATOM 89 O ARG A 7 -6.563 4.918 4.215 1.00 0.89 O ATOM 90 CB ARG A 7 -5.449 1.668 4.418 1.00 0.74 C ATOM 91 CG ARG A 7 -6.435 1.238 5.517 1.00 0.88 C ATOM 92 CD ARG A 7 -6.994 2.391 6.357 1.00 1.96 C ATOM 93 NE ARG A 7 -8.230 2.943 5.777 1.00 2.71 N ATOM 94 CZ ARG A 7 -9.478 2.804 6.239 1.00 3.43 C ATOM 95 NH1 ARG A 7 -9.737 2.136 7.359 1.00 3.71 N ATOM 96 NH2 ARG A 7 -10.467 3.354 5.548 1.00 4.72 N ATOM 97 H ARG A 7 -4.436 2.450 2.006 1.00 0.69 H ATOM 98 HA ARG A 7 -7.041 2.661 3.409 1.00 0.67 H ATOM 99 HB2 ARG A 7 -5.213 0.782 3.842 1.00 1.07 H ATOM 100 HB3 ARG A 7 -4.531 1.998 4.902 1.00 1.06 H ATOM 101 HG2 ARG A 7 -7.258 0.681 5.069 1.00 1.44 H ATOM 102 HG3 ARG A 7 -5.905 0.560 6.187 1.00 1.85 H ATOM 103 HD2 ARG A 7 -7.188 2.027 7.360 1.00 3.00 H ATOM 104 HD3 ARG A 7 -6.244 3.177 6.442 1.00 2.78 H ATOM 105 HE ARG A 7 -8.094 3.532 4.961 1.00 3.54 H ATOM 106 HH11 ARG A 7 -9.007 1.655 7.885 1.00 3.57 H ATOM 107 HH12 ARG A 7 -10.660 2.122 7.790 1.00 4.70 H ATOM 108 HH21 ARG A 7 -10.265 3.754 4.634 1.00 5.28 H ATOM 109 HH22 ARG A 7 -11.437 3.375 5.870 1.00 5.50 H ATOM 110 N CYS A 8 -4.348 4.457 4.233 1.00 0.45 N ATOM 111 CA CYS A 8 -3.984 5.554 5.124 1.00 0.49 C ATOM 112 C CYS A 8 -3.776 6.870 4.367 1.00 0.58 C ATOM 113 O CYS A 8 -3.759 7.937 4.990 1.00 0.90 O ATOM 114 CB CYS A 8 -2.737 5.162 5.937 1.00 0.44 C ATOM 115 SG CYS A 8 -1.240 5.135 4.911 1.00 0.50 S ATOM 116 H CYS A 8 -3.615 3.826 3.923 1.00 0.46 H ATOM 117 HA CYS A 8 -4.800 5.705 5.835 1.00 0.58 H ATOM 118 HB2 CYS A 8 -2.617 5.893 6.739 1.00 0.51 H ATOM 119 HB3 CYS A 8 -2.892 4.181 6.391 1.00 0.46 H ATOM 120 N GLY A 9 -3.478 6.791 3.067 1.00 0.58 N ATOM 121 CA GLY A 9 -3.146 7.920 2.218 1.00 0.71 C ATOM 122 C GLY A 9 -1.653 8.250 2.122 1.00 0.62 C ATOM 123 O GLY A 9 -1.326 9.239 1.465 1.00 0.78 O ATOM 124 H GLY A 9 -3.485 5.874 2.636 1.00 0.68 H ATOM 125 HA2 GLY A 9 -3.510 7.708 1.212 1.00 0.81 H ATOM 126 HA3 GLY A 9 -3.670 8.804 2.583 1.00 0.86 H ATOM 127 N LYS A 10 -0.729 7.497 2.735 1.00 0.48 N ATOM 128 CA LYS A 10 0.709 7.797 2.643 1.00 0.51 C ATOM 129 C LYS A 10 1.347 7.009 1.503 1.00 0.48 C ATOM 130 O LYS A 10 0.809 5.990 1.076 1.00 0.43 O ATOM 131 CB LYS A 10 1.430 7.474 3.959 1.00 0.60 C ATOM 132 CG LYS A 10 0.727 8.121 5.153 1.00 0.70 C ATOM 133 CD LYS A 10 1.529 7.981 6.453 1.00 1.10 C ATOM 134 CE LYS A 10 0.647 7.514 7.617 1.00 2.66 C ATOM 135 NZ LYS A 10 0.212 6.112 7.467 1.00 4.38 N ATOM 136 H LYS A 10 -1.014 6.752 3.361 1.00 0.46 H ATOM 137 HA LYS A 10 0.838 8.860 2.440 1.00 0.58 H ATOM 138 HB2 LYS A 10 1.467 6.396 4.110 1.00 0.64 H ATOM 139 HB3 LYS A 10 2.452 7.851 3.896 1.00 0.66 H ATOM 140 HG2 LYS A 10 0.551 9.169 4.930 1.00 0.95 H ATOM 141 HG3 LYS A 10 -0.246 7.656 5.279 1.00 0.79 H ATOM 142 HD2 LYS A 10 2.349 7.275 6.322 1.00 2.04 H ATOM 143 HD3 LYS A 10 1.958 8.953 6.700 1.00 1.37 H ATOM 144 HE2 LYS A 10 1.220 7.595 8.541 1.00 3.29 H ATOM 145 HE3 LYS A 10 -0.230 8.160 7.692 1.00 3.21 H ATOM 146 HZ1 LYS A 10 -0.325 5.969 6.613 1.00 5.02 H ATOM 147 HZ2 LYS A 10 1.024 5.500 7.451 1.00 4.77 H ATOM 148 HZ3 LYS A 10 -0.378 5.851 8.255 1.00 5.40 H ATOM 149 N ILE A 11 2.485 7.491 1.010 1.00 0.54 N ATOM 150 CA ILE A 11 3.224 6.917 -0.111 1.00 0.53 C ATOM 151 C ILE A 11 3.566 5.447 0.174 1.00 0.52 C ATOM 152 O ILE A 11 3.810 5.105 1.332 1.00 0.58 O ATOM 153 CB ILE A 11 4.443 7.836 -0.367 1.00 0.63 C ATOM 154 CG1 ILE A 11 4.609 8.157 -1.855 1.00 0.75 C ATOM 155 CG2 ILE A 11 5.754 7.291 0.208 1.00 0.96 C ATOM 156 CD1 ILE A 11 5.612 9.298 -2.084 1.00 1.31 C ATOM 157 H ILE A 11 2.903 8.289 1.462 1.00 0.63 H ATOM 158 HA ILE A 11 2.568 6.940 -0.981 1.00 0.51 H ATOM 159 HB ILE A 11 4.250 8.793 0.122 1.00 0.87 H ATOM 160 HG12 ILE A 11 4.938 7.260 -2.380 1.00 0.96 H ATOM 161 HG13 ILE A 11 3.645 8.468 -2.260 1.00 1.02 H ATOM 162 HG21 ILE A 11 5.618 6.997 1.248 1.00 1.78 H ATOM 163 HG22 ILE A 11 6.098 6.431 -0.370 1.00 2.27 H ATOM 164 HG23 ILE A 11 6.511 8.067 0.174 1.00 1.59 H ATOM 165 HD11 ILE A 11 5.394 10.136 -1.423 1.00 2.20 H ATOM 166 HD12 ILE A 11 6.631 8.952 -1.912 1.00 2.43 H ATOM 167 HD13 ILE A 11 5.531 9.651 -3.106 1.00 2.00 H ATOM 168 N VAL A 12 3.639 4.584 -0.844 1.00 0.52 N ATOM 169 CA VAL A 12 3.926 3.159 -0.651 1.00 0.52 C ATOM 170 C VAL A 12 5.257 2.835 -1.331 1.00 0.69 C ATOM 171 O VAL A 12 5.301 2.560 -2.533 1.00 1.63 O ATOM 172 CB VAL A 12 2.748 2.283 -1.132 1.00 0.56 C ATOM 173 CG1 VAL A 12 2.873 0.863 -0.574 1.00 0.89 C ATOM 174 CG2 VAL A 12 1.376 2.818 -0.712 1.00 0.71 C ATOM 175 H VAL A 12 3.396 4.887 -1.783 1.00 0.54 H ATOM 176 HA VAL A 12 4.059 2.956 0.408 1.00 0.51 H ATOM 177 HB VAL A 12 2.759 2.237 -2.221 1.00 0.84 H ATOM 178 HG11 VAL A 12 3.891 0.502 -0.688 1.00 1.37 H ATOM 179 HG12 VAL A 12 2.620 0.846 0.485 1.00 1.90 H ATOM 180 HG13 VAL A 12 2.185 0.204 -1.099 1.00 1.63 H ATOM 181 HG21 VAL A 12 1.340 2.995 0.361 1.00 1.35 H ATOM 182 HG22 VAL A 12 1.194 3.748 -1.238 1.00 1.68 H ATOM 183 HG23 VAL A 12 0.588 2.115 -0.984 1.00 1.57 H ATOM 184 N TYR A 13 6.356 2.903 -0.574 1.00 0.51 N ATOM 185 CA TYR A 13 7.686 2.660 -1.125 1.00 0.55 C ATOM 186 C TYR A 13 7.898 1.163 -1.388 1.00 0.51 C ATOM 187 O TYR A 13 7.295 0.320 -0.708 1.00 0.65 O ATOM 188 CB TYR A 13 8.772 3.171 -0.170 1.00 0.91 C ATOM 189 CG TYR A 13 8.937 4.677 -0.143 1.00 1.28 C ATOM 190 CD1 TYR A 13 9.536 5.330 -1.237 1.00 3.20 C ATOM 191 CD2 TYR A 13 8.521 5.425 0.974 1.00 1.46 C ATOM 192 CE1 TYR A 13 9.710 6.723 -1.225 1.00 3.63 C ATOM 193 CE2 TYR A 13 8.706 6.818 0.998 1.00 1.53 C ATOM 194 CZ TYR A 13 9.292 7.474 -0.107 1.00 2.18 C ATOM 195 OH TYR A 13 9.455 8.826 -0.091 1.00 2.64 O ATOM 196 H TYR A 13 6.270 3.022 0.432 1.00 1.16 H ATOM 197 HA TYR A 13 7.763 3.206 -2.066 1.00 0.63 H ATOM 198 HB2 TYR A 13 8.564 2.794 0.826 1.00 1.06 H ATOM 199 HB3 TYR A 13 9.731 2.750 -0.469 1.00 0.95 H ATOM 200 HD1 TYR A 13 9.867 4.772 -2.102 1.00 4.54 H ATOM 201 HD2 TYR A 13 8.044 4.939 1.813 1.00 2.82 H ATOM 202 HE1 TYR A 13 10.166 7.198 -2.083 1.00 5.25 H ATOM 203 HE2 TYR A 13 8.372 7.388 1.853 1.00 2.55 H ATOM 204 HH TYR A 13 10.358 9.041 -0.406 1.00 3.37 H ATOM 205 N PRO A 14 8.799 0.800 -2.321 1.00 0.56 N ATOM 206 CA PRO A 14 9.181 -0.579 -2.580 1.00 0.76 C ATOM 207 C PRO A 14 10.064 -1.138 -1.463 1.00 1.23 C ATOM 208 O PRO A 14 11.287 -1.249 -1.570 1.00 2.82 O ATOM 209 CB PRO A 14 9.849 -0.572 -3.945 1.00 0.86 C ATOM 210 CG PRO A 14 10.463 0.823 -4.038 1.00 0.99 C ATOM 211 CD PRO A 14 9.478 1.690 -3.257 1.00 0.79 C ATOM 212 HA PRO A 14 8.287 -1.196 -2.642 1.00 1.05 H ATOM 213 HB2 PRO A 14 10.587 -1.368 -4.031 1.00 0.98 H ATOM 214 HB3 PRO A 14 9.068 -0.679 -4.693 1.00 1.13 H ATOM 215 HG2 PRO A 14 11.437 0.834 -3.548 1.00 1.14 H ATOM 216 HG3 PRO A 14 10.546 1.155 -5.072 1.00 1.33 H ATOM 217 HD2 PRO A 14 10.017 2.484 -2.739 1.00 0.92 H ATOM 218 HD3 PRO A 14 8.746 2.122 -3.941 1.00 0.95 H ATOM 219 N THR A 15 9.403 -1.480 -0.374 1.00 0.85 N ATOM 220 CA THR A 15 9.764 -2.349 0.744 1.00 0.92 C ATOM 221 C THR A 15 8.473 -2.712 1.490 1.00 0.95 C ATOM 222 O THR A 15 8.413 -3.756 2.135 1.00 1.29 O ATOM 223 CB THR A 15 10.798 -1.677 1.675 1.00 1.02 C ATOM 224 OG1 THR A 15 11.998 -1.444 0.970 1.00 1.65 O ATOM 225 CG2 THR A 15 11.185 -2.525 2.888 1.00 2.27 C ATOM 226 H THR A 15 8.417 -1.336 -0.540 1.00 1.82 H ATOM 227 HA THR A 15 10.184 -3.274 0.357 1.00 1.02 H ATOM 228 HB THR A 15 10.399 -0.724 2.022 1.00 1.57 H ATOM 229 HG1 THR A 15 11.746 -1.352 0.035 1.00 2.31 H ATOM 230 HG21 THR A 15 11.483 -3.524 2.567 1.00 2.81 H ATOM 231 HG22 THR A 15 12.017 -2.056 3.410 1.00 3.11 H ATOM 232 HG23 THR A 15 10.345 -2.602 3.578 1.00 3.17 H ATOM 233 N GLU A 16 7.413 -1.899 1.387 1.00 0.78 N ATOM 234 CA GLU A 16 6.192 -2.062 2.170 1.00 0.85 C ATOM 235 C GLU A 16 4.956 -2.242 1.278 1.00 0.91 C ATOM 236 O GLU A 16 3.877 -2.515 1.803 1.00 1.34 O ATOM 237 CB GLU A 16 6.098 -0.865 3.125 1.00 0.86 C ATOM 238 CG GLU A 16 5.052 -0.980 4.231 1.00 1.57 C ATOM 239 CD GLU A 16 5.088 0.216 5.187 1.00 2.25 C ATOM 240 OE1 GLU A 16 5.477 1.344 4.798 1.00 3.05 O ATOM 241 OE2 GLU A 16 4.658 0.044 6.348 1.00 3.12 O ATOM 242 H GLU A 16 7.492 -1.026 0.875 1.00 0.80 H ATOM 243 HA GLU A 16 6.271 -2.960 2.784 1.00 0.99 H ATOM 244 HB2 GLU A 16 7.036 -0.790 3.659 1.00 0.93 H ATOM 245 HB3 GLU A 16 5.935 0.039 2.534 1.00 1.06 H ATOM 246 HG2 GLU A 16 4.061 -1.049 3.801 1.00 1.98 H ATOM 247 HG3 GLU A 16 5.240 -1.893 4.792 1.00 2.29 H ATOM 248 N LYS A 17 5.094 -2.161 -0.052 1.00 0.80 N ATOM 249 CA LYS A 17 4.004 -2.447 -0.987 1.00 0.80 C ATOM 250 C LYS A 17 3.469 -3.857 -0.769 1.00 0.80 C ATOM 251 O LYS A 17 4.245 -4.794 -0.567 1.00 1.65 O ATOM 252 CB LYS A 17 4.501 -2.330 -2.437 1.00 0.97 C ATOM 253 CG LYS A 17 4.746 -0.902 -2.948 1.00 2.04 C ATOM 254 CD LYS A 17 5.574 -0.964 -4.234 1.00 2.14 C ATOM 255 CE LYS A 17 5.553 0.336 -5.046 1.00 3.71 C ATOM 256 NZ LYS A 17 4.578 0.259 -6.152 1.00 4.38 N ATOM 257 H LYS A 17 6.014 -1.980 -0.426 1.00 0.93 H ATOM 258 HA LYS A 17 3.188 -1.750 -0.803 1.00 0.84 H ATOM 259 HB2 LYS A 17 5.423 -2.903 -2.518 1.00 1.65 H ATOM 260 HB3 LYS A 17 3.767 -2.795 -3.098 1.00 1.65 H ATOM 261 HG2 LYS A 17 3.789 -0.415 -3.138 1.00 2.86 H ATOM 262 HG3 LYS A 17 5.300 -0.327 -2.212 1.00 2.91 H ATOM 263 HD2 LYS A 17 6.604 -1.179 -3.962 1.00 2.56 H ATOM 264 HD3 LYS A 17 5.225 -1.791 -4.851 1.00 2.18 H ATOM 265 HE2 LYS A 17 5.333 1.184 -4.393 1.00 4.89 H ATOM 266 HE3 LYS A 17 6.545 0.485 -5.479 1.00 4.10 H ATOM 267 HZ1 LYS A 17 4.782 -0.546 -6.741 1.00 3.91 H ATOM 268 HZ2 LYS A 17 3.627 0.171 -5.820 1.00 5.10 H ATOM 269 HZ3 LYS A 17 4.646 1.073 -6.758 1.00 5.28 H ATOM 270 N VAL A 18 2.165 -4.025 -0.941 1.00 0.67 N ATOM 271 CA VAL A 18 1.479 -5.269 -1.155 1.00 0.87 C ATOM 272 C VAL A 18 0.586 -5.056 -2.371 1.00 0.93 C ATOM 273 O VAL A 18 0.233 -3.910 -2.668 1.00 1.04 O ATOM 274 CB VAL A 18 0.679 -5.714 0.093 1.00 1.10 C ATOM 275 CG1 VAL A 18 1.439 -5.472 1.402 1.00 1.87 C ATOM 276 CG2 VAL A 18 -0.679 -5.022 0.197 1.00 2.32 C ATOM 277 H VAL A 18 1.567 -3.278 -1.215 1.00 1.48 H ATOM 278 HA VAL A 18 2.238 -5.987 -1.396 1.00 1.24 H ATOM 279 HB VAL A 18 0.476 -6.776 0.003 1.00 2.59 H ATOM 280 HG11 VAL A 18 2.404 -5.976 1.338 1.00 2.82 H ATOM 281 HG12 VAL A 18 1.572 -4.401 1.565 1.00 2.69 H ATOM 282 HG13 VAL A 18 0.873 -5.880 2.239 1.00 2.52 H ATOM 283 HG21 VAL A 18 -0.541 -3.954 0.053 1.00 2.91 H ATOM 284 HG22 VAL A 18 -1.353 -5.415 -0.564 1.00 3.64 H ATOM 285 HG23 VAL A 18 -1.123 -5.228 1.166 1.00 2.74 H ATOM 286 N ASN A 19 0.192 -6.138 -3.033 1.00 1.16 N ATOM 287 CA ASN A 19 -0.941 -6.167 -3.946 1.00 1.34 C ATOM 288 C ASN A 19 -1.600 -7.539 -3.856 1.00 1.13 C ATOM 289 O ASN A 19 -0.897 -8.538 -3.739 1.00 1.89 O ATOM 290 CB ASN A 19 -0.517 -5.755 -5.349 1.00 2.61 C ATOM 291 CG ASN A 19 -1.668 -6.023 -6.292 1.00 3.81 C ATOM 292 OD1 ASN A 19 -2.631 -5.276 -6.400 1.00 5.39 O ATOM 293 ND2 ASN A 19 -1.650 -7.216 -6.830 1.00 3.91 N ATOM 294 H ASN A 19 0.507 -7.051 -2.713 1.00 1.33 H ATOM 295 HA ASN A 19 -1.695 -5.450 -3.690 1.00 1.64 H ATOM 296 HB2 ASN A 19 -0.290 -4.688 -5.355 1.00 3.66 H ATOM 297 HB3 ASN A 19 0.375 -6.300 -5.660 1.00 2.68 H ATOM 298 HD21 ASN A 19 -0.908 -7.791 -6.447 1.00 3.40 H ATOM 299 HD22 ASN A 19 -2.198 -7.472 -7.653 1.00 5.03 H ATOM 300 N CYS A 20 -2.927 -7.615 -3.942 1.00 1.21 N ATOM 301 CA CYS A 20 -3.648 -8.863 -4.204 1.00 1.93 C ATOM 302 C CYS A 20 -4.860 -8.597 -5.105 1.00 1.70 C ATOM 303 O CYS A 20 -5.826 -9.365 -5.134 1.00 2.84 O ATOM 304 CB CYS A 20 -4.040 -9.525 -2.873 1.00 3.20 C ATOM 305 SG CYS A 20 -4.270 -11.312 -3.089 1.00 5.22 S ATOM 306 H CYS A 20 -3.462 -6.760 -4.017 1.00 1.52 H ATOM 307 HA CYS A 20 -2.985 -9.522 -4.763 1.00 2.37 H ATOM 308 HB2 CYS A 20 -3.253 -9.371 -2.135 1.00 3.51 H ATOM 309 HB3 CYS A 20 -4.969 -9.083 -2.514 1.00 3.37 H ATOM 310 HG CYS A 20 -4.641 -11.577 -1.829 1.00 5.37 H ATOM 311 N LEU A 21 -4.854 -7.471 -5.812 1.00 1.34 N ATOM 312 CA LEU A 21 -6.000 -6.987 -6.553 1.00 0.94 C ATOM 313 C LEU A 21 -5.465 -6.105 -7.672 1.00 0.95 C ATOM 314 O LEU A 21 -5.096 -6.600 -8.730 1.00 1.61 O ATOM 315 CB LEU A 21 -6.944 -6.267 -5.566 1.00 1.22 C ATOM 316 CG LEU A 21 -8.236 -5.752 -6.215 1.00 2.06 C ATOM 317 CD1 LEU A 21 -9.178 -6.910 -6.542 1.00 3.01 C ATOM 318 CD2 LEU A 21 -8.943 -4.806 -5.246 1.00 2.54 C ATOM 319 H LEU A 21 -3.982 -6.965 -5.915 1.00 2.37 H ATOM 320 HA LEU A 21 -6.520 -7.831 -7.009 1.00 1.12 H ATOM 321 HB2 LEU A 21 -7.214 -6.959 -4.766 1.00 1.99 H ATOM 322 HB3 LEU A 21 -6.409 -5.436 -5.103 1.00 2.49 H ATOM 323 HG LEU A 21 -8.003 -5.203 -7.126 1.00 3.55 H ATOM 324 HD11 LEU A 21 -8.709 -7.612 -7.229 1.00 3.98 H ATOM 325 HD12 LEU A 21 -9.441 -7.435 -5.627 1.00 2.91 H ATOM 326 HD13 LEU A 21 -10.080 -6.526 -7.018 1.00 4.14 H ATOM 327 HD21 LEU A 21 -8.274 -4.012 -4.924 1.00 3.61 H ATOM 328 HD22 LEU A 21 -9.795 -4.356 -5.755 1.00 3.31 H ATOM 329 HD23 LEU A 21 -9.291 -5.349 -4.367 1.00 2.52 H ATOM 330 N ASP A 22 -5.359 -4.804 -7.433 1.00 0.74 N ATOM 331 CA ASP A 22 -4.811 -3.846 -8.384 1.00 0.93 C ATOM 332 C ASP A 22 -4.258 -2.617 -7.653 1.00 0.84 C ATOM 333 O ASP A 22 -4.025 -1.570 -8.250 1.00 1.15 O ATOM 334 CB ASP A 22 -5.944 -3.458 -9.344 1.00 1.31 C ATOM 335 CG ASP A 22 -5.443 -2.659 -10.537 1.00 2.58 C ATOM 336 OD1 ASP A 22 -4.496 -3.138 -11.207 1.00 3.67 O ATOM 337 OD2 ASP A 22 -6.039 -1.591 -10.824 1.00 3.46 O ATOM 338 H ASP A 22 -5.666 -4.448 -6.543 1.00 1.02 H ATOM 339 HA ASP A 22 -4.000 -4.312 -8.943 1.00 1.17 H ATOM 340 HB2 ASP A 22 -6.429 -4.356 -9.728 1.00 1.79 H ATOM 341 HB3 ASP A 22 -6.690 -2.883 -8.795 1.00 2.01 H ATOM 342 N LYS A 23 -4.129 -2.699 -6.327 1.00 0.62 N ATOM 343 CA LYS A 23 -4.050 -1.557 -5.421 1.00 0.78 C ATOM 344 C LYS A 23 -2.862 -1.747 -4.496 1.00 0.65 C ATOM 345 O LYS A 23 -2.415 -2.881 -4.304 1.00 0.66 O ATOM 346 CB LYS A 23 -5.345 -1.441 -4.588 1.00 1.25 C ATOM 347 CG LYS A 23 -6.664 -1.588 -5.362 1.00 1.35 C ATOM 348 CD LYS A 23 -6.860 -0.530 -6.453 1.00 2.02 C ATOM 349 CE LYS A 23 -8.152 -0.772 -7.233 1.00 2.58 C ATOM 350 NZ LYS A 23 -9.362 -0.435 -6.458 1.00 2.50 N ATOM 351 H LYS A 23 -3.976 -3.619 -5.930 1.00 0.68 H ATOM 352 HA LYS A 23 -3.903 -0.640 -5.995 1.00 1.17 H ATOM 353 HB2 LYS A 23 -5.331 -2.222 -3.827 1.00 2.19 H ATOM 354 HB3 LYS A 23 -5.343 -0.483 -4.067 1.00 1.95 H ATOM 355 HG2 LYS A 23 -6.708 -2.575 -5.819 1.00 1.66 H ATOM 356 HG3 LYS A 23 -7.484 -1.517 -4.648 1.00 1.99 H ATOM 357 HD2 LYS A 23 -6.869 0.464 -6.016 1.00 2.54 H ATOM 358 HD3 LYS A 23 -6.037 -0.566 -7.159 1.00 2.84 H ATOM 359 HE2 LYS A 23 -8.134 -0.153 -8.133 1.00 3.48 H ATOM 360 HE3 LYS A 23 -8.198 -1.814 -7.552 1.00 3.56 H ATOM 361 HZ1 LYS A 23 -9.283 0.506 -6.084 1.00 2.69 H ATOM 362 HZ2 LYS A 23 -10.161 -0.444 -7.087 1.00 3.34 H ATOM 363 HZ3 LYS A 23 -9.518 -1.083 -5.690 1.00 3.05 H ATOM 364 N PHE A 24 -2.416 -0.665 -3.869 1.00 0.75 N ATOM 365 CA PHE A 24 -1.263 -0.670 -2.992 1.00 0.77 C ATOM 366 C PHE A 24 -1.723 -0.376 -1.577 1.00 0.68 C ATOM 367 O PHE A 24 -2.528 0.526 -1.335 1.00 0.82 O ATOM 368 CB PHE A 24 -0.227 0.353 -3.471 1.00 1.09 C ATOM 369 CG PHE A 24 0.502 -0.081 -4.724 1.00 1.18 C ATOM 370 CD1 PHE A 24 1.434 -1.133 -4.656 1.00 2.61 C ATOM 371 CD2 PHE A 24 0.225 0.525 -5.963 1.00 1.80 C ATOM 372 CE1 PHE A 24 2.095 -1.565 -5.817 1.00 3.49 C ATOM 373 CE2 PHE A 24 0.911 0.114 -7.117 1.00 2.08 C ATOM 374 CZ PHE A 24 1.841 -0.938 -7.048 1.00 2.80 C ATOM 375 H PHE A 24 -2.898 0.222 -3.985 1.00 0.89 H ATOM 376 HA PHE A 24 -0.801 -1.658 -3.011 1.00 0.70 H ATOM 377 HB2 PHE A 24 -0.711 1.319 -3.628 1.00 1.44 H ATOM 378 HB3 PHE A 24 0.516 0.482 -2.687 1.00 1.74 H ATOM 379 HD1 PHE A 24 1.610 -1.642 -3.719 1.00 3.47 H ATOM 380 HD2 PHE A 24 -0.530 1.296 -6.040 1.00 2.91 H ATOM 381 HE1 PHE A 24 2.769 -2.407 -5.769 1.00 4.93 H ATOM 382 HE2 PHE A 24 0.682 0.573 -8.071 1.00 2.74 H ATOM 383 HZ PHE A 24 2.318 -1.295 -7.952 1.00 3.52 H ATOM 384 N TRP A 25 -1.181 -1.150 -0.644 1.00 0.53 N ATOM 385 CA TRP A 25 -1.392 -0.999 0.782 1.00 0.50 C ATOM 386 C TRP A 25 -0.021 -1.155 1.443 1.00 0.51 C ATOM 387 O TRP A 25 0.931 -1.619 0.805 1.00 0.71 O ATOM 388 CB TRP A 25 -2.359 -2.086 1.282 1.00 0.46 C ATOM 389 CG TRP A 25 -3.569 -2.361 0.435 1.00 0.48 C ATOM 390 CD1 TRP A 25 -3.638 -3.187 -0.635 1.00 0.55 C ATOM 391 CD2 TRP A 25 -4.897 -1.799 0.572 1.00 0.60 C ATOM 392 NE1 TRP A 25 -4.915 -3.158 -1.168 1.00 0.64 N ATOM 393 CE2 TRP A 25 -5.714 -2.256 -0.499 1.00 0.63 C ATOM 394 CE3 TRP A 25 -5.478 -0.937 1.510 1.00 0.82 C ATOM 395 CZ2 TRP A 25 -7.027 -1.796 -0.681 1.00 0.77 C ATOM 396 CZ3 TRP A 25 -6.800 -0.479 1.360 1.00 0.98 C ATOM 397 CH2 TRP A 25 -7.555 -0.873 0.243 1.00 0.92 C ATOM 398 H TRP A 25 -0.485 -1.833 -0.905 1.00 0.51 H ATOM 399 HA TRP A 25 -1.801 -0.008 0.995 1.00 0.61 H ATOM 400 HB2 TRP A 25 -1.826 -3.012 1.454 1.00 0.45 H ATOM 401 HB3 TRP A 25 -2.707 -1.769 2.264 1.00 0.54 H ATOM 402 HD1 TRP A 25 -2.814 -3.775 -1.017 1.00 0.61 H ATOM 403 HE1 TRP A 25 -5.222 -3.753 -1.928 1.00 0.80 H ATOM 404 HE3 TRP A 25 -4.853 -0.644 2.335 1.00 0.91 H ATOM 405 HZ2 TRP A 25 -7.619 -2.140 -1.518 1.00 0.83 H ATOM 406 HZ3 TRP A 25 -7.225 0.196 2.090 1.00 1.19 H ATOM 407 HH2 TRP A 25 -8.548 -0.473 0.110 1.00 1.08 H ATOM 408 N HIS A 26 0.065 -0.833 2.729 1.00 0.48 N ATOM 409 CA HIS A 26 1.231 -1.103 3.568 1.00 0.39 C ATOM 410 C HIS A 26 1.005 -2.333 4.441 1.00 0.43 C ATOM 411 O HIS A 26 -0.117 -2.841 4.490 1.00 0.50 O ATOM 412 CB HIS A 26 1.495 0.091 4.486 1.00 0.38 C ATOM 413 CG HIS A 26 1.831 1.358 3.767 1.00 0.49 C ATOM 414 ND1 HIS A 26 1.078 2.517 3.828 1.00 0.39 N ATOM 415 CD2 HIS A 26 2.958 1.593 3.031 1.00 0.71 C ATOM 416 CE1 HIS A 26 1.782 3.446 3.176 1.00 0.46 C ATOM 417 NE2 HIS A 26 2.916 2.921 2.692 1.00 0.66 N ATOM 418 H HIS A 26 -0.778 -0.511 3.178 1.00 0.60 H ATOM 419 HA HIS A 26 2.095 -1.272 2.927 1.00 0.49 H ATOM 420 HB2 HIS A 26 0.630 0.255 5.126 1.00 0.37 H ATOM 421 HB3 HIS A 26 2.325 -0.138 5.148 1.00 0.47 H ATOM 422 HD2 HIS A 26 3.757 0.911 2.789 1.00 0.88 H ATOM 423 HE1 HIS A 26 1.482 4.478 3.066 1.00 0.43 H ATOM 424 HE2 HIS A 26 3.617 3.476 2.195 1.00 0.72 H ATOM 425 N LYS A 27 2.035 -2.723 5.214 1.00 0.51 N ATOM 426 CA LYS A 27 1.987 -3.706 6.298 1.00 0.82 C ATOM 427 C LYS A 27 0.650 -3.675 7.054 1.00 0.75 C ATOM 428 O LYS A 27 -0.229 -4.498 6.785 1.00 0.75 O ATOM 429 CB LYS A 27 3.180 -3.436 7.236 1.00 1.17 C ATOM 430 CG LYS A 27 4.498 -4.053 6.756 1.00 1.94 C ATOM 431 CD LYS A 27 5.757 -3.426 7.375 1.00 3.41 C ATOM 432 CE LYS A 27 5.950 -3.640 8.884 1.00 4.32 C ATOM 433 NZ LYS A 27 5.136 -2.736 9.726 1.00 5.55 N ATOM 434 H LYS A 27 2.941 -2.267 5.111 1.00 0.51 H ATOM 435 HA LYS A 27 2.092 -4.705 5.875 1.00 1.08 H ATOM 436 HB2 LYS A 27 3.301 -2.359 7.365 1.00 2.10 H ATOM 437 HB3 LYS A 27 2.955 -3.864 8.203 1.00 1.23 H ATOM 438 HG2 LYS A 27 4.484 -5.119 6.983 1.00 2.04 H ATOM 439 HG3 LYS A 27 4.572 -3.935 5.677 1.00 2.83 H ATOM 440 HD2 LYS A 27 6.612 -3.886 6.882 1.00 3.88 H ATOM 441 HD3 LYS A 27 5.796 -2.362 7.144 1.00 4.29 H ATOM 442 HE2 LYS A 27 5.743 -4.682 9.140 1.00 4.01 H ATOM 443 HE3 LYS A 27 7.002 -3.446 9.102 1.00 5.33 H ATOM 444 HZ1 LYS A 27 5.177 -1.778 9.391 1.00 6.14 H ATOM 445 HZ2 LYS A 27 4.161 -3.025 9.775 1.00 5.71 H ATOM 446 HZ3 LYS A 27 5.466 -2.740 10.686 1.00 6.41 H ATOM 447 N ALA A 28 0.479 -2.717 7.968 1.00 0.80 N ATOM 448 CA ALA A 28 -0.692 -2.616 8.830 1.00 0.84 C ATOM 449 C ALA A 28 -1.914 -1.991 8.143 1.00 0.71 C ATOM 450 O ALA A 28 -2.899 -1.715 8.831 1.00 0.89 O ATOM 451 CB ALA A 28 -0.318 -1.796 10.069 1.00 1.09 C ATOM 452 H ALA A 28 1.245 -2.086 8.164 1.00 0.92 H ATOM 453 HA ALA A 28 -0.970 -3.620 9.157 1.00 0.94 H ATOM 454 HB1 ALA A 28 0.531 -2.256 10.569 1.00 1.76 H ATOM 455 HB2 ALA A 28 -0.069 -0.774 9.782 1.00 1.87 H ATOM 456 HB3 ALA A 28 -1.157 -1.774 10.764 1.00 1.86 H ATOM 457 N CYS A 29 -1.858 -1.688 6.843 1.00 0.52 N ATOM 458 CA CYS A 29 -2.928 -1.006 6.123 1.00 0.49 C ATOM 459 C CYS A 29 -3.751 -1.954 5.248 1.00 0.55 C ATOM 460 O CYS A 29 -4.858 -1.589 4.853 1.00 0.69 O ATOM 461 CB CYS A 29 -2.309 0.112 5.280 1.00 0.43 C ATOM 462 SG CYS A 29 -1.738 1.455 6.366 1.00 0.43 S ATOM 463 H CYS A 29 -1.046 -1.964 6.312 1.00 0.49 H ATOM 464 HA CYS A 29 -3.624 -0.550 6.827 1.00 0.53 H ATOM 465 HB2 CYS A 29 -1.484 -0.283 4.699 1.00 0.52 H ATOM 466 HB3 CYS A 29 -3.053 0.487 4.581 1.00 0.46 H ATOM 467 N PHE A 30 -3.215 -3.114 4.861 1.00 0.53 N ATOM 468 CA PHE A 30 -3.916 -3.994 3.939 1.00 0.53 C ATOM 469 C PHE A 30 -5.174 -4.539 4.609 1.00 0.90 C ATOM 470 O PHE A 30 -6.261 -4.506 4.020 1.00 2.07 O ATOM 471 CB PHE A 30 -3.011 -5.133 3.453 1.00 0.93 C ATOM 472 CG PHE A 30 -3.609 -6.022 2.366 1.00 1.14 C ATOM 473 CD1 PHE A 30 -4.638 -5.558 1.518 1.00 2.61 C ATOM 474 CD2 PHE A 30 -3.109 -7.326 2.172 1.00 2.21 C ATOM 475 CE1 PHE A 30 -5.165 -6.379 0.513 1.00 2.84 C ATOM 476 CE2 PHE A 30 -3.635 -8.149 1.156 1.00 2.30 C ATOM 477 CZ PHE A 30 -4.663 -7.671 0.323 1.00 1.74 C ATOM 478 OXT PHE A 30 -5.045 -5.008 5.760 1.00 2.14 O ATOM 479 H PHE A 30 -2.298 -3.377 5.195 1.00 0.61 H ATOM 480 HA PHE A 30 -4.217 -3.386 3.088 1.00 0.85 H ATOM 481 HB2 PHE A 30 -2.084 -4.702 3.084 1.00 1.31 H ATOM 482 HB3 PHE A 30 -2.757 -5.758 4.311 1.00 1.18 H ATOM 483 HD1 PHE A 30 -5.056 -4.567 1.601 1.00 4.03 H ATOM 484 HD2 PHE A 30 -2.312 -7.701 2.800 1.00 3.65 H ATOM 485 HE1 PHE A 30 -5.960 -6.005 -0.112 1.00 4.34 H ATOM 486 HE2 PHE A 30 -3.246 -9.149 1.013 1.00 3.64 H ATOM 487 HZ PHE A 30 -5.086 -8.275 -0.468 1.00 2.01 H TER 488 PHE A 30 HETATM 489 ZN ZN A 31 -0.670 2.888 4.827 1.00 0.42 ZN