ATOM 1 N GLY A 1 3.082 3.806 4.771 1.00 0.00 N ATOM 2 CA GLY A 1 3.772 4.791 3.891 1.00 0.00 C ATOM 3 C GLY A 1 5.014 4.148 3.282 1.00 0.00 C ATOM 4 O GLY A 1 6.069 4.775 3.187 1.00 0.00 O ATOM 5 H1 GLY A 1 3.526 3.810 5.711 1.00 0.00 H ATOM 6 H2 GLY A 1 3.160 2.856 4.356 1.00 0.00 H ATOM 7 H3 GLY A 1 2.079 4.066 4.862 1.00 0.00 H ATOM 8 HA2 GLY A 1 3.103 5.100 3.102 1.00 0.00 H ATOM 9 HA3 GLY A 1 4.066 5.651 4.474 1.00 0.00 H ATOM 10 N ARG A 2 4.882 2.891 2.871 1.00 0.00 N ATOM 11 CA ARG A 2 5.999 2.174 2.271 1.00 0.00 C ATOM 12 C ARG A 2 6.321 2.737 0.891 1.00 0.00 C ATOM 13 O ARG A 2 5.429 3.171 0.162 1.00 0.00 O ATOM 14 CB ARG A 2 5.662 0.686 2.150 1.00 0.00 C ATOM 15 CG ARG A 2 5.585 0.064 3.545 1.00 0.00 C ATOM 16 CD ARG A 2 5.264 -1.426 3.424 1.00 0.00 C ATOM 17 NE ARG A 2 3.916 -1.612 2.897 1.00 0.00 N ATOM 18 CZ ARG A 2 2.854 -1.551 3.693 1.00 0.00 C ATOM 19 NH1 ARG A 2 3.006 -1.319 4.968 1.00 0.00 N1+ ATOM 20 NH2 ARG A 2 1.659 -1.720 3.197 1.00 0.00 N ATOM 21 H ARG A 2 4.018 2.441 2.970 1.00 0.00 H ATOM 22 HA ARG A 2 6.867 2.282 2.905 1.00 0.00 H ATOM 23 HB2 ARG A 2 4.708 0.574 1.652 1.00 0.00 H ATOM 24 HB3 ARG A 2 6.428 0.188 1.575 1.00 0.00 H ATOM 25 HG2 ARG A 2 6.534 0.190 4.047 1.00 0.00 H ATOM 26 HG3 ARG A 2 4.808 0.552 4.115 1.00 0.00 H ATOM 27 HD2 ARG A 2 5.974 -1.892 2.758 1.00 0.00 H ATOM 28 HD3 ARG A 2 5.336 -1.887 4.399 1.00 0.00 H ATOM 29 HE ARG A 2 3.795 -1.785 1.940 1.00 0.00 H ATOM 30 HH11 ARG A 2 3.922 -1.190 5.346 1.00 0.00 H ATOM 31 HH12 ARG A 2 2.205 -1.273 5.566 1.00 0.00 H ATOM 32 HH21 ARG A 2 1.543 -1.896 2.220 1.00 0.00 H ATOM 33 HH22 ARG A 2 0.858 -1.672 3.796 1.00 0.00 H ATOM 34 N ILE A 3 7.602 2.726 0.535 1.00 0.00 N ATOM 35 CA ILE A 3 8.029 3.237 -0.761 1.00 0.00 C ATOM 36 C ILE A 3 7.952 4.761 -0.789 1.00 0.00 C ATOM 37 O ILE A 3 8.374 5.395 -1.756 1.00 0.00 O ATOM 38 CB ILE A 3 7.147 2.658 -1.867 1.00 0.00 C ATOM 39 CG1 ILE A 3 6.913 1.168 -1.602 1.00 0.00 C ATOM 40 CG2 ILE A 3 7.844 2.829 -3.219 1.00 0.00 C ATOM 41 CD1 ILE A 3 5.431 0.929 -1.311 1.00 0.00 C ATOM 42 H ILE A 3 8.268 2.367 1.155 1.00 0.00 H ATOM 43 HA ILE A 3 9.054 2.936 -0.937 1.00 0.00 H ATOM 44 HB ILE A 3 6.201 3.176 -1.882 1.00 0.00 H ATOM 45 HG12 ILE A 3 7.206 0.597 -2.471 1.00 0.00 H ATOM 46 HG13 ILE A 3 7.500 0.857 -0.750 1.00 0.00 H ATOM 47 HG21 ILE A 3 8.269 3.819 -3.282 1.00 0.00 H ATOM 48 HG22 ILE A 3 7.125 2.693 -4.014 1.00 0.00 H ATOM 49 HG23 ILE A 3 8.630 2.094 -3.315 1.00 0.00 H ATOM 50 HD11 ILE A 3 4.841 1.693 -1.795 1.00 0.00 H ATOM 51 HD12 ILE A 3 5.264 0.969 -0.244 1.00 0.00 H ATOM 52 HD13 ILE A 3 5.141 -0.041 -1.686 1.00 0.00 H ATOM 53 N ASP A 4 7.411 5.340 0.279 1.00 0.00 N ATOM 54 CA ASP A 4 7.289 6.792 0.368 1.00 0.00 C ATOM 55 C ASP A 4 8.669 7.444 0.331 1.00 0.00 C ATOM 56 O ASP A 4 8.858 8.482 -0.303 1.00 0.00 O ATOM 57 CB ASP A 4 6.576 7.178 1.663 1.00 0.00 C ATOM 58 CG ASP A 4 5.065 7.118 1.464 1.00 0.00 C ATOM 59 OD1 ASP A 4 4.645 6.896 0.340 1.00 0.00 O ATOM 60 OD2 ASP A 4 4.351 7.301 2.435 1.00 0.00 O1- ATOM 61 H ASP A 4 7.089 4.783 1.021 1.00 0.00 H ATOM 62 HA ASP A 4 6.711 7.148 -0.470 1.00 0.00 H ATOM 63 HB2 ASP A 4 6.861 6.489 2.446 1.00 0.00 H ATOM 64 HB3 ASP A 4 6.862 8.179 1.946 1.00 0.00 H HETATM 65 N DBU A 5 9.630 6.826 1.011 1.00 0.00 N HETATM 66 CA DBU A 5 10.943 7.335 1.041 1.00 0.00 C HETATM 67 CB DBU A 5 11.389 8.589 1.476 1.00 0.00 C HETATM 68 CG DBU A 5 10.497 9.676 2.019 1.00 0.00 C HETATM 69 C DBU A 5 11.919 6.310 0.510 1.00 0.00 C HETATM 70 O DBU A 5 13.089 6.602 0.256 1.00 0.00 O HETATM 71 H DBU A 5 9.433 6.002 1.501 1.00 0.00 H HETATM 72 HB DBU A 5 12.446 8.813 1.426 1.00 0.00 H HETATM 73 HG1 DBU A 5 11.071 10.321 2.666 1.00 0.00 H HETATM 74 HG2 DBU A 5 10.096 10.254 1.199 1.00 0.00 H HETATM 75 HG3 DBU A 5 9.687 9.232 2.577 1.00 0.00 H ATOM 76 N CYS A 6 11.430 5.087 0.339 1.00 0.00 N ATOM 77 CA CYS A 6 12.264 4.004 -0.168 1.00 0.00 C ATOM 78 C CYS A 6 11.714 3.490 -1.494 1.00 0.00 C ATOM 79 O CYS A 6 11.391 2.311 -1.626 1.00 0.00 O ATOM 80 CB CYS A 6 12.304 2.857 0.841 1.00 0.00 C ATOM 81 SG CYS A 6 13.722 1.789 0.485 1.00 0.00 S ATOM 82 H CYS A 6 10.491 4.909 0.554 1.00 0.00 H ATOM 83 HA CYS A 6 13.268 4.373 -0.321 1.00 0.00 H ATOM 84 HB2 CYS A 6 12.395 3.254 1.836 1.00 0.00 H ATOM 85 HB3 CYS A 6 11.394 2.281 0.767 1.00 0.00 H ATOM 86 N PRO A 7 11.596 4.354 -2.461 1.00 0.00 N ATOM 87 CA PRO A 7 11.062 3.992 -3.806 1.00 0.00 C ATOM 88 C PRO A 7 12.021 3.094 -4.582 1.00 0.00 C ATOM 89 O PRO A 7 11.798 2.801 -5.757 1.00 0.00 O ATOM 90 CB PRO A 7 10.891 5.343 -4.506 1.00 0.00 C ATOM 91 CG PRO A 7 11.834 6.272 -3.818 1.00 0.00 C ATOM 92 CD PRO A 7 11.961 5.776 -2.378 1.00 0.00 C ATOM 93 HA PRO A 7 10.100 3.514 -3.709 1.00 0.00 H ATOM 94 HB2 PRO A 7 11.145 5.256 -5.552 1.00 0.00 H ATOM 95 HB3 PRO A 7 9.878 5.696 -4.394 1.00 0.00 H ATOM 96 HG2 PRO A 7 12.797 6.250 -4.306 1.00 0.00 H ATOM 97 HG3 PRO A 7 11.437 7.274 -3.820 1.00 0.00 H ATOM 98 HD2 PRO A 7 12.978 5.890 -2.029 1.00 0.00 H ATOM 99 HD3 PRO A 7 11.274 6.303 -1.736 1.00 0.00 H ATOM 100 N ALA A 8 13.086 2.660 -3.918 1.00 0.00 N ATOM 101 CA ALA A 8 14.070 1.793 -4.554 1.00 0.00 C ATOM 102 C ALA A 8 13.443 0.452 -4.926 1.00 0.00 C ATOM 103 O ALA A 8 13.749 -0.117 -5.974 1.00 0.00 O ATOM 104 CB ALA A 8 15.251 1.561 -3.610 1.00 0.00 C ATOM 105 H ALA A 8 13.209 2.924 -2.979 1.00 0.00 H ATOM 106 HA ALA A 8 14.432 2.272 -5.452 1.00 0.00 H ATOM 107 HB1 ALA A 8 14.910 1.621 -2.587 1.00 0.00 H ATOM 108 HB2 ALA A 8 16.004 2.315 -3.783 1.00 0.00 H ATOM 109 HB3 ALA A 8 15.671 0.583 -3.791 1.00 0.00 H ATOM 110 N GLY A 9 12.565 -0.044 -4.061 1.00 0.00 N ATOM 111 CA GLY A 9 11.901 -1.319 -4.310 1.00 0.00 C ATOM 112 C GLY A 9 11.138 -1.786 -3.074 1.00 0.00 C ATOM 113 O GLY A 9 11.008 -1.047 -2.099 1.00 0.00 O ATOM 114 H GLY A 9 12.360 0.453 -3.243 1.00 0.00 H ATOM 115 HA2 GLY A 9 11.210 -1.204 -5.134 1.00 0.00 H ATOM 116 HA3 GLY A 9 12.643 -2.060 -4.566 1.00 0.00 H ATOM 117 N GLY A 10 10.639 -3.018 -3.123 1.00 0.00 N ATOM 118 CA GLY A 10 9.893 -3.574 -2.000 1.00 0.00 C ATOM 119 C GLY A 10 10.764 -3.644 -0.752 1.00 0.00 C ATOM 120 O GLY A 10 11.992 -3.595 -0.834 1.00 0.00 O ATOM 121 H GLY A 10 10.774 -3.560 -3.928 1.00 0.00 H ATOM 122 HA2 GLY A 10 9.034 -2.951 -1.801 1.00 0.00 H ATOM 123 HA3 GLY A 10 9.560 -4.564 -2.249 1.00 0.00 H ATOM 124 N GLY A 11 10.121 -3.750 0.407 1.00 0.00 N ATOM 125 CA GLY A 11 10.847 -3.815 1.670 1.00 0.00 C ATOM 126 C GLY A 11 11.377 -2.441 2.064 1.00 0.00 C ATOM 127 O GLY A 11 11.592 -2.161 3.242 1.00 0.00 O ATOM 128 H GLY A 11 9.142 -3.783 0.412 1.00 0.00 H ATOM 129 HA2 GLY A 11 10.184 -4.175 2.443 1.00 0.00 H ATOM 130 HA3 GLY A 11 11.686 -4.489 1.565 1.00 0.00 H HETATM 131 N DBB A 12 11.590 -1.584 1.067 1.00 0.00 N HETATM 132 CA DBB A 12 12.101 -0.242 1.317 1.00 0.00 C HETATM 133 C DBB A 12 13.087 -0.257 2.480 1.00 0.00 C HETATM 134 O DBB A 12 13.259 0.745 3.175 1.00 0.00 O HETATM 135 CB DBB A 12 12.787 0.299 0.064 1.00 0.00 C HETATM 136 CG DBB A 12 13.741 -0.760 -0.490 1.00 0.00 C HETATM 137 H DBB A 12 11.400 -1.862 0.151 1.00 0.00 H HETATM 138 HA DBB A 12 11.278 0.404 1.567 1.00 0.00 H HETATM 139 HB2 DBB A 12 12.042 0.539 -0.679 1.00 0.00 H HETATM 140 HG1 DBB A 12 14.459 -0.288 -1.142 1.00 0.00 H HETATM 141 HG2 DBB A 12 13.179 -1.494 -1.048 1.00 0.00 H HETATM 142 HG3 DBB A 12 14.254 -1.245 0.327 1.00 0.00 H HETATM 143 N DAL A 13 13.731 -1.400 2.691 1.00 0.00 N HETATM 144 CA DAL A 13 14.690 -1.535 3.783 1.00 0.00 C HETATM 145 CB DAL A 13 13.962 -1.458 5.126 1.00 0.00 C HETATM 146 C DAL A 13 15.744 -0.435 3.706 1.00 0.00 C HETATM 147 O DAL A 13 15.496 0.630 3.145 1.00 0.00 O HETATM 148 H DAL A 13 13.554 -2.165 2.106 1.00 0.00 H HETATM 149 HA DAL A 13 15.163 -2.503 3.703 1.00 0.00 H HETATM 150 HB1 DAL A 13 13.154 -0.747 5.060 1.00 0.00 H HETATM 151 HB2 DAL A 13 13.565 -2.431 5.374 1.00 0.00 H ATOM 152 N GLU A 14 16.924 -0.692 4.276 1.00 0.00 N ATOM 153 CA GLU A 14 18.002 0.294 4.255 1.00 0.00 C ATOM 154 C GLU A 14 18.119 0.928 2.873 1.00 0.00 C ATOM 155 O GLU A 14 18.756 1.968 2.707 1.00 0.00 O ATOM 156 CB GLU A 14 19.326 -0.373 4.628 1.00 0.00 C ATOM 157 CG GLU A 14 19.276 -0.829 6.087 1.00 0.00 C ATOM 158 CD GLU A 14 20.607 -1.457 6.482 1.00 0.00 C ATOM 159 OE1 GLU A 14 20.760 -2.651 6.280 1.00 0.00 O ATOM 160 OE2 GLU A 14 21.456 -0.735 6.981 1.00 0.00 O1- ATOM 161 H GLU A 14 17.079 -1.550 4.720 1.00 0.00 H ATOM 162 HA GLU A 14 17.786 1.067 4.978 1.00 0.00 H ATOM 163 HB2 GLU A 14 19.490 -1.228 3.986 1.00 0.00 H ATOM 164 HB3 GLU A 14 20.132 0.333 4.500 1.00 0.00 H ATOM 165 HG2 GLU A 14 19.078 0.024 6.720 1.00 0.00 H ATOM 166 HG3 GLU A 14 18.488 -1.556 6.208 1.00 0.00 H ATOM 167 N GLN A 15 17.497 0.298 1.881 1.00 0.00 N ATOM 168 CA GLN A 15 17.534 0.812 0.518 1.00 0.00 C ATOM 169 C GLN A 15 17.054 2.262 0.485 1.00 0.00 C ATOM 170 O GLN A 15 17.535 3.065 -0.315 1.00 0.00 O ATOM 171 CB GLN A 15 16.641 -0.042 -0.387 1.00 0.00 C ATOM 172 CG GLN A 15 17.515 -0.930 -1.272 1.00 0.00 C ATOM 173 CD GLN A 15 18.000 -2.139 -0.480 1.00 0.00 C ATOM 174 OE1 GLN A 15 19.033 -2.073 0.186 1.00 0.00 O ATOM 175 NE2 GLN A 15 17.311 -3.247 -0.511 1.00 0.00 N ATOM 176 H GLN A 15 17.006 -0.529 2.068 1.00 0.00 H ATOM 177 HA GLN A 15 18.547 0.769 0.150 1.00 0.00 H ATOM 178 HB2 GLN A 15 15.991 -0.665 0.225 1.00 0.00 H ATOM 179 HB3 GLN A 15 16.039 0.603 -1.011 1.00 0.00 H ATOM 180 HG2 GLN A 15 16.939 -1.265 -2.122 1.00 0.00 H ATOM 181 HG3 GLN A 15 18.367 -0.364 -1.617 1.00 0.00 H ATOM 182 HE21 GLN A 15 16.488 -3.298 -1.041 1.00 0.00 H ATOM 183 HE22 GLN A 15 17.615 -4.028 -0.003 1.00 0.00 H HETATM 184 N DBB A 16 16.105 2.588 1.356 1.00 0.00 N HETATM 185 CA DBB A 16 15.570 3.944 1.414 1.00 0.00 C HETATM 186 C DBB A 16 14.450 4.031 2.444 1.00 0.00 C HETATM 187 O DBB A 16 14.412 3.249 3.396 1.00 0.00 O HETATM 188 CB DBB A 16 16.683 4.928 1.782 1.00 0.00 C HETATM 189 CG DBB A 16 16.066 6.252 2.240 1.00 0.00 C HETATM 190 H DBB A 16 15.758 1.907 1.969 1.00 0.00 H HETATM 191 HA DBB A 16 15.177 4.209 0.447 1.00 0.00 H HETATM 192 HB2 DBB A 16 17.309 5.103 0.920 1.00 0.00 H HETATM 193 HG1 DBB A 16 16.833 6.873 2.679 1.00 0.00 H HETATM 194 HG2 DBB A 16 15.299 6.057 2.973 1.00 0.00 H HETATM 195 HG3 DBB A 16 15.630 6.758 1.393 1.00 0.00 H ATOM 196 N GLY A 17 13.549 4.989 2.252 1.00 0.00 N ATOM 197 CA GLY A 17 12.431 5.172 3.174 1.00 0.00 C ATOM 198 C GLY A 17 12.241 3.944 4.053 1.00 0.00 C ATOM 199 O GLY A 17 12.957 3.773 5.040 1.00 0.00 O ATOM 200 H GLY A 17 13.637 5.581 1.479 1.00 0.00 H ATOM 201 HA2 GLY A 17 12.629 6.030 3.802 1.00 0.00 H ATOM 202 HA3 GLY A 17 11.529 5.343 2.609 1.00 0.00 H HETATM 203 N DBU A 18 11.286 3.095 3.682 1.00 0.00 N HETATM 204 CA DBU A 18 11.023 1.922 4.417 1.00 0.00 C HETATM 205 CB DBU A 18 10.196 0.845 4.077 1.00 0.00 C HETATM 206 CG DBU A 18 9.397 0.739 2.800 1.00 0.00 C HETATM 207 C DBU A 18 11.777 1.923 5.725 1.00 0.00 C HETATM 208 O DBU A 18 11.250 2.298 6.773 1.00 0.00 O HETATM 209 H DBU A 18 10.751 3.279 2.882 1.00 0.00 H HETATM 210 HB DBU A 18 10.107 0.017 4.764 1.00 0.00 H HETATM 211 HG1 DBU A 18 8.349 0.873 3.018 1.00 0.00 H HETATM 212 HG2 DBU A 18 9.722 1.503 2.108 1.00 0.00 H HETATM 213 HG3 DBU A 18 9.552 -0.236 2.353 1.00 0.00 H ATOM 214 N CYS A 19 13.043 1.512 5.660 1.00 0.00 N ATOM 215 CA CYS A 19 13.884 1.475 6.856 1.00 0.00 C ATOM 216 C CYS A 19 15.299 1.961 6.564 1.00 0.00 C ATOM 217 O CYS A 19 16.275 1.293 6.910 1.00 0.00 O ATOM 218 CB CYS A 19 13.943 0.041 7.387 1.00 0.00 C ATOM 219 SG CYS A 19 15.121 -0.923 6.406 1.00 0.00 S ATOM 220 H CYS A 19 13.414 1.236 4.797 1.00 0.00 H ATOM 221 HA CYS A 19 13.447 2.106 7.610 1.00 0.00 H ATOM 222 HB2 CYS A 19 14.262 0.053 8.412 1.00 0.00 H ATOM 223 HB3 CYS A 19 12.969 -0.415 7.317 1.00 0.00 H ATOM 224 N CYS A 20 15.412 3.130 5.940 1.00 0.00 N ATOM 225 CA CYS A 20 16.723 3.690 5.621 1.00 0.00 C ATOM 226 C CYS A 20 17.331 4.366 6.849 1.00 0.00 C ATOM 227 O CYS A 20 16.573 4.775 7.712 1.00 0.00 O ATOM 228 CB CYS A 20 16.594 4.709 4.491 1.00 0.00 C ATOM 229 SG CYS A 20 17.684 4.237 3.125 1.00 0.00 S ATOM 230 OXT CYS A 20 18.546 4.463 6.903 1.00 0.00 O ATOM 231 H CYS A 20 14.605 3.628 5.695 1.00 0.00 H ATOM 232 HA CYS A 20 17.377 2.894 5.301 1.00 0.00 H ATOM 233 HB2 CYS A 20 15.576 4.733 4.151 1.00 0.00 H ATOM 234 HB3 CYS A 20 16.871 5.688 4.849 1.00 0.00 H TER 235 CYS A 20