ATOM 1 N GLY A 1 2.177 2.876 1.028 1.00 0.00 N ATOM 2 CA GLY A 1 2.997 4.117 0.944 1.00 0.00 C ATOM 3 C GLY A 1 4.367 3.867 1.565 1.00 0.00 C ATOM 4 O GLY A 1 5.150 4.796 1.757 1.00 0.00 O ATOM 5 H1 GLY A 1 2.531 2.180 0.343 1.00 0.00 H ATOM 6 H2 GLY A 1 1.184 3.102 0.813 1.00 0.00 H ATOM 7 H3 GLY A 1 2.243 2.480 1.987 1.00 0.00 H ATOM 8 HA2 GLY A 1 3.116 4.401 -0.092 1.00 0.00 H ATOM 9 HA3 GLY A 1 2.502 4.913 1.481 1.00 0.00 H ATOM 10 N ARG A 2 4.648 2.609 1.879 1.00 0.00 N ATOM 11 CA ARG A 2 5.927 2.251 2.481 1.00 0.00 C ATOM 12 C ARG A 2 7.076 2.526 1.509 1.00 0.00 C ATOM 13 O ARG A 2 8.128 3.033 1.902 1.00 0.00 O ATOM 14 CB ARG A 2 5.915 0.769 2.869 1.00 0.00 C ATOM 15 CG ARG A 2 4.910 0.548 4.003 1.00 0.00 C ATOM 16 CD ARG A 2 5.417 1.227 5.279 1.00 0.00 C ATOM 17 NE ARG A 2 4.413 1.130 6.334 1.00 0.00 N ATOM 18 CZ ARG A 2 4.382 0.088 7.158 1.00 0.00 C ATOM 19 NH1 ARG A 2 5.258 -0.870 7.032 1.00 0.00 N1+ ATOM 20 NH2 ARG A 2 3.472 0.022 8.092 1.00 0.00 N ATOM 21 H ARG A 2 3.984 1.908 1.706 1.00 0.00 H ATOM 22 HA ARG A 2 6.074 2.843 3.371 1.00 0.00 H ATOM 23 HB2 ARG A 2 5.627 0.176 2.013 1.00 0.00 H ATOM 24 HB3 ARG A 2 6.897 0.472 3.199 1.00 0.00 H ATOM 25 HG2 ARG A 2 3.956 0.971 3.725 1.00 0.00 H ATOM 26 HG3 ARG A 2 4.797 -0.510 4.183 1.00 0.00 H ATOM 27 HD2 ARG A 2 6.324 0.744 5.605 1.00 0.00 H ATOM 28 HD3 ARG A 2 5.621 2.268 5.073 1.00 0.00 H ATOM 29 HE ARG A 2 3.753 1.846 6.438 1.00 0.00 H ATOM 30 HH11 ARG A 2 5.955 -0.821 6.317 1.00 0.00 H ATOM 31 HH12 ARG A 2 5.234 -1.655 7.653 1.00 0.00 H ATOM 32 HH21 ARG A 2 2.800 0.756 8.189 1.00 0.00 H ATOM 33 HH22 ARG A 2 3.448 -0.763 8.712 1.00 0.00 H ATOM 34 N ILE A 3 6.863 2.194 0.240 1.00 0.00 N ATOM 35 CA ILE A 3 7.880 2.410 -0.787 1.00 0.00 C ATOM 36 C ILE A 3 8.018 3.895 -1.107 1.00 0.00 C ATOM 37 O ILE A 3 8.883 4.293 -1.889 1.00 0.00 O ATOM 38 CB ILE A 3 7.488 1.645 -2.047 1.00 0.00 C ATOM 39 CG1 ILE A 3 7.497 0.147 -1.742 1.00 0.00 C ATOM 40 CG2 ILE A 3 8.490 1.945 -3.163 1.00 0.00 C ATOM 41 CD1 ILE A 3 6.765 -0.599 -2.853 1.00 0.00 C ATOM 42 H ILE A 3 6.004 1.796 -0.014 1.00 0.00 H ATOM 43 HA ILE A 3 8.830 2.036 -0.434 1.00 0.00 H ATOM 44 HB ILE A 3 6.499 1.946 -2.360 1.00 0.00 H ATOM 45 HG12 ILE A 3 8.517 -0.202 -1.684 1.00 0.00 H ATOM 46 HG13 ILE A 3 6.999 -0.033 -0.802 1.00 0.00 H ATOM 47 HG21 ILE A 3 8.818 1.019 -3.611 1.00 0.00 H ATOM 48 HG22 ILE A 3 9.340 2.467 -2.751 1.00 0.00 H ATOM 49 HG23 ILE A 3 8.019 2.561 -3.914 1.00 0.00 H ATOM 50 HD11 ILE A 3 5.856 -1.026 -2.456 1.00 0.00 H ATOM 51 HD12 ILE A 3 7.397 -1.385 -3.236 1.00 0.00 H ATOM 52 HD13 ILE A 3 6.522 0.090 -3.649 1.00 0.00 H ATOM 53 N ASP A 4 7.162 4.711 -0.501 1.00 0.00 N ATOM 54 CA ASP A 4 7.201 6.150 -0.735 1.00 0.00 C ATOM 55 C ASP A 4 8.537 6.726 -0.279 1.00 0.00 C ATOM 56 O ASP A 4 9.129 7.563 -0.961 1.00 0.00 O ATOM 57 CB ASP A 4 6.067 6.836 0.027 1.00 0.00 C ATOM 58 CG ASP A 4 4.728 6.520 -0.633 1.00 0.00 C ATOM 59 OD1 ASP A 4 4.741 6.054 -1.759 1.00 0.00 O ATOM 60 OD2 ASP A 4 3.710 6.750 0.000 1.00 0.00 O1- ATOM 61 H ASP A 4 6.493 4.340 0.111 1.00 0.00 H ATOM 62 HA ASP A 4 7.079 6.338 -1.791 1.00 0.00 H ATOM 63 HB2 ASP A 4 6.056 6.483 1.047 1.00 0.00 H ATOM 64 HB3 ASP A 4 6.225 7.904 0.019 1.00 0.00 H HETATM 65 N DBU A 5 9.005 6.271 0.877 1.00 0.00 N HETATM 66 CA DBU A 5 10.230 6.732 1.398 1.00 0.00 C HETATM 67 CB DBU A 5 10.463 7.581 2.487 1.00 0.00 C HETATM 68 CG DBU A 5 9.384 8.190 3.347 1.00 0.00 C HETATM 69 C DBU A 5 11.378 6.172 0.598 1.00 0.00 C HETATM 70 O DBU A 5 12.460 6.754 0.520 1.00 0.00 O HETATM 71 H DBU A 5 8.498 5.603 1.385 1.00 0.00 H HETATM 72 HB DBU A 5 11.482 7.829 2.744 1.00 0.00 H HETATM 73 HG1 DBU A 5 9.480 9.266 3.338 1.00 0.00 H HETATM 74 HG2 DBU A 5 8.415 7.912 2.960 1.00 0.00 H HETATM 75 HG3 DBU A 5 9.487 7.827 4.358 1.00 0.00 H ATOM 76 N CYS A 6 11.137 5.014 -0.007 1.00 0.00 N ATOM 77 CA CYS A 6 12.160 4.360 -0.810 1.00 0.00 C ATOM 78 C CYS A 6 11.553 3.740 -2.061 1.00 0.00 C ATOM 79 O CYS A 6 11.269 2.543 -2.098 1.00 0.00 O ATOM 80 CB CYS A 6 12.850 3.274 0.012 1.00 0.00 C ATOM 81 SG CYS A 6 11.608 2.185 0.748 1.00 0.00 S ATOM 82 H CYS A 6 10.257 4.592 0.091 1.00 0.00 H ATOM 83 HA CYS A 6 12.896 5.094 -1.104 1.00 0.00 H ATOM 84 HB2 CYS A 6 13.500 2.698 -0.628 1.00 0.00 H ATOM 85 HB3 CYS A 6 13.430 3.732 0.792 1.00 0.00 H ATOM 86 N PRO A 7 11.360 4.532 -3.080 1.00 0.00 N ATOM 87 CA PRO A 7 10.782 4.059 -4.368 1.00 0.00 C ATOM 88 C PRO A 7 11.767 3.195 -5.150 1.00 0.00 C ATOM 89 O PRO A 7 11.909 3.343 -6.364 1.00 0.00 O ATOM 90 CB PRO A 7 10.471 5.353 -5.123 1.00 0.00 C ATOM 91 CG PRO A 7 11.402 6.374 -4.559 1.00 0.00 C ATOM 92 CD PRO A 7 11.675 5.968 -3.111 1.00 0.00 C ATOM 93 HA PRO A 7 9.869 3.517 -4.192 1.00 0.00 H ATOM 94 HB2 PRO A 7 10.652 5.220 -6.180 1.00 0.00 H ATOM 95 HB3 PRO A 7 9.448 5.651 -4.951 1.00 0.00 H ATOM 96 HG2 PRO A 7 12.323 6.386 -5.125 1.00 0.00 H ATOM 97 HG3 PRO A 7 10.940 7.349 -4.581 1.00 0.00 H ATOM 98 HD2 PRO A 7 12.713 6.138 -2.860 1.00 0.00 H ATOM 99 HD3 PRO A 7 11.026 6.505 -2.436 1.00 0.00 H ATOM 100 N ALA A 8 12.445 2.292 -4.446 1.00 0.00 N ATOM 101 CA ALA A 8 13.412 1.411 -5.091 1.00 0.00 C ATOM 102 C ALA A 8 12.938 -0.036 -5.028 1.00 0.00 C ATOM 103 O ALA A 8 13.231 -0.836 -5.917 1.00 0.00 O ATOM 104 CB ALA A 8 14.774 1.532 -4.405 1.00 0.00 C ATOM 105 H ALA A 8 12.290 2.215 -3.476 1.00 0.00 H ATOM 106 HA ALA A 8 13.515 1.701 -6.125 1.00 0.00 H ATOM 107 HB1 ALA A 8 14.632 1.666 -3.342 1.00 0.00 H ATOM 108 HB2 ALA A 8 15.305 2.383 -4.807 1.00 0.00 H ATOM 109 HB3 ALA A 8 15.348 0.634 -4.581 1.00 0.00 H ATOM 110 N GLY A 9 12.199 -0.363 -3.974 1.00 0.00 N ATOM 111 CA GLY A 9 11.686 -1.716 -3.806 1.00 0.00 C ATOM 112 C GLY A 9 10.638 -1.768 -2.701 1.00 0.00 C ATOM 113 O GLY A 9 10.567 -0.876 -1.856 1.00 0.00 O ATOM 114 H GLY A 9 11.995 0.317 -3.297 1.00 0.00 H ATOM 115 HA2 GLY A 9 11.242 -2.045 -4.735 1.00 0.00 H ATOM 116 HA3 GLY A 9 12.502 -2.375 -3.549 1.00 0.00 H ATOM 117 N GLY A 10 9.830 -2.823 -2.710 1.00 0.00 N ATOM 118 CA GLY A 10 8.791 -2.986 -1.699 1.00 0.00 C ATOM 119 C GLY A 10 9.403 -3.164 -0.316 1.00 0.00 C ATOM 120 O GLY A 10 8.818 -2.759 0.688 1.00 0.00 O ATOM 121 H GLY A 10 9.935 -3.504 -3.405 1.00 0.00 H ATOM 122 HA2 GLY A 10 8.159 -2.108 -1.697 1.00 0.00 H ATOM 123 HA3 GLY A 10 8.195 -3.851 -1.934 1.00 0.00 H ATOM 124 N GLY A 11 10.581 -3.778 -0.269 1.00 0.00 N ATOM 125 CA GLY A 11 11.252 -4.007 1.003 1.00 0.00 C ATOM 126 C GLY A 11 11.421 -2.696 1.754 1.00 0.00 C ATOM 127 O GLY A 11 11.176 -2.618 2.957 1.00 0.00 O ATOM 128 H GLY A 11 11.001 -4.084 -1.101 1.00 0.00 H ATOM 129 HA2 GLY A 11 10.667 -4.691 1.600 1.00 0.00 H ATOM 130 HA3 GLY A 11 12.227 -4.432 0.818 1.00 0.00 H HETATM 131 N DBB A 12 11.842 -1.668 1.032 1.00 0.00 N HETATM 132 CA DBB A 12 12.044 -0.360 1.629 1.00 0.00 C HETATM 133 C DBB A 12 13.064 -0.464 2.752 1.00 0.00 C HETATM 134 O DBB A 12 13.131 0.391 3.632 1.00 0.00 O HETATM 135 CB DBB A 12 12.518 0.631 0.558 1.00 0.00 C HETATM 136 CG DBB A 12 14.031 0.855 0.685 1.00 0.00 C HETATM 137 H DBB A 12 12.024 -1.795 0.083 1.00 0.00 H HETATM 138 HA DBB A 12 11.109 -0.012 2.036 1.00 0.00 H HETATM 139 HB2 DBB A 12 12.306 0.218 -0.416 1.00 0.00 H HETATM 140 HG1 DBB A 12 14.492 -0.030 1.099 1.00 0.00 H HETATM 141 HG2 DBB A 12 14.217 1.695 1.337 1.00 0.00 H HETATM 142 HG3 DBB A 12 14.448 1.056 -0.290 1.00 0.00 H HETATM 143 N DAL A 13 13.856 -1.525 2.701 1.00 0.00 N HETATM 144 CA DAL A 13 14.874 -1.747 3.710 1.00 0.00 C HETATM 145 CB DAL A 13 14.218 -1.807 5.085 1.00 0.00 C HETATM 146 C DAL A 13 15.913 -0.626 3.666 1.00 0.00 C HETATM 147 O DAL A 13 15.666 0.424 3.074 1.00 0.00 O HETATM 148 H DAL A 13 13.752 -2.169 1.970 1.00 0.00 H HETATM 149 HA DAL A 13 15.351 -2.694 3.508 1.00 0.00 H HETATM 150 HB1 DAL A 13 13.278 -1.277 5.062 1.00 0.00 H HETATM 151 HB2 DAL A 13 14.039 -2.838 5.347 1.00 0.00 H ATOM 152 N GLU A 14 17.075 -0.841 4.286 1.00 0.00 N ATOM 153 CA GLU A 14 18.115 0.178 4.283 1.00 0.00 C ATOM 154 C GLU A 14 18.224 0.825 2.904 1.00 0.00 C ATOM 155 O GLU A 14 18.786 1.909 2.761 1.00 0.00 O ATOM 156 CB GLU A 14 19.459 -0.446 4.666 1.00 0.00 C ATOM 157 CG GLU A 14 19.400 -0.943 6.112 1.00 0.00 C ATOM 158 CD GLU A 14 19.195 0.234 7.060 1.00 0.00 C ATOM 159 OE1 GLU A 14 19.458 1.353 6.650 1.00 0.00 O ATOM 160 OE2 GLU A 14 18.781 0.000 8.183 1.00 0.00 O1- ATOM 161 H GLU A 14 17.236 -1.690 4.750 1.00 0.00 H ATOM 162 HA GLU A 14 17.865 0.938 5.008 1.00 0.00 H ATOM 163 HB2 GLU A 14 19.669 -1.276 4.007 1.00 0.00 H ATOM 164 HB3 GLU A 14 20.238 0.294 4.573 1.00 0.00 H ATOM 165 HG2 GLU A 14 18.578 -1.637 6.220 1.00 0.00 H ATOM 166 HG3 GLU A 14 20.325 -1.442 6.358 1.00 0.00 H ATOM 167 N GLN A 15 17.678 0.156 1.890 1.00 0.00 N ATOM 168 CA GLN A 15 17.721 0.686 0.531 1.00 0.00 C ATOM 169 C GLN A 15 17.150 2.101 0.493 1.00 0.00 C ATOM 170 O GLN A 15 17.240 2.792 -0.522 1.00 0.00 O ATOM 171 CB GLN A 15 16.927 -0.223 -0.417 1.00 0.00 C ATOM 172 CG GLN A 15 17.587 -1.601 -0.462 1.00 0.00 C ATOM 173 CD GLN A 15 18.999 -1.483 -1.024 1.00 0.00 C ATOM 174 OE1 GLN A 15 19.184 -0.993 -2.138 1.00 0.00 O ATOM 175 NE2 GLN A 15 20.011 -1.901 -0.316 1.00 0.00 N ATOM 176 H GLN A 15 17.241 -0.704 2.057 1.00 0.00 H ATOM 177 HA GLN A 15 18.750 0.718 0.202 1.00 0.00 H ATOM 178 HB2 GLN A 15 15.911 -0.320 -0.064 1.00 0.00 H ATOM 179 HB3 GLN A 15 16.924 0.203 -1.408 1.00 0.00 H ATOM 180 HG2 GLN A 15 17.631 -2.009 0.539 1.00 0.00 H ATOM 181 HG3 GLN A 15 17.004 -2.258 -1.090 1.00 0.00 H ATOM 182 HE21 GLN A 15 19.862 -2.287 0.572 1.00 0.00 H ATOM 183 HE22 GLN A 15 20.922 -1.826 -0.671 1.00 0.00 H HETATM 184 N DBB A 16 16.560 2.527 1.607 1.00 0.00 N HETATM 185 CA DBB A 16 15.978 3.860 1.693 1.00 0.00 C HETATM 186 C DBB A 16 14.723 3.835 2.561 1.00 0.00 C HETATM 187 O DBB A 16 14.335 2.784 3.071 1.00 0.00 O HETATM 188 CB DBB A 16 16.991 4.844 2.282 1.00 0.00 C HETATM 189 CG DBB A 16 16.829 6.207 1.604 1.00 0.00 C HETATM 190 H DBB A 16 16.517 1.934 2.385 1.00 0.00 H HETATM 191 HA DBB A 16 15.708 4.188 0.700 1.00 0.00 H HETATM 192 HB2 DBB A 16 17.992 4.476 2.116 1.00 0.00 H HETATM 193 HG1 DBB A 16 15.857 6.264 1.135 1.00 0.00 H HETATM 194 HG2 DBB A 16 17.598 6.331 0.856 1.00 0.00 H HETATM 195 HG3 DBB A 16 16.919 6.990 2.343 1.00 0.00 H ATOM 196 N GLY A 17 14.092 4.998 2.709 1.00 0.00 N ATOM 197 CA GLY A 17 12.870 5.112 3.503 1.00 0.00 C ATOM 198 C GLY A 17 12.610 3.843 4.305 1.00 0.00 C ATOM 199 O GLY A 17 13.456 3.402 5.082 1.00 0.00 O ATOM 200 H GLY A 17 14.449 5.796 2.267 1.00 0.00 H ATOM 201 HA2 GLY A 17 12.965 5.949 4.181 1.00 0.00 H ATOM 202 HA3 GLY A 17 12.036 5.286 2.841 1.00 0.00 H HETATM 203 N DBU A 18 11.435 3.255 4.102 1.00 0.00 N HETATM 204 CA DBU A 18 11.063 2.070 4.766 1.00 0.00 C HETATM 205 CB DBU A 18 10.156 1.089 4.340 1.00 0.00 C HETATM 206 CG DBU A 18 9.368 1.096 3.050 1.00 0.00 C HETATM 207 C DBU A 18 11.786 1.935 6.087 1.00 0.00 C HETATM 208 O DBU A 18 11.392 2.515 7.098 1.00 0.00 O HETATM 209 H DBU A 18 10.797 3.643 3.468 1.00 0.00 H HETATM 210 HB DBU A 18 9.992 0.238 4.983 1.00 0.00 H HETATM 211 HG1 DBU A 18 9.248 0.084 2.687 1.00 0.00 H HETATM 212 HG2 DBU A 18 8.396 1.527 3.234 1.00 0.00 H HETATM 213 HG3 DBU A 18 9.886 1.683 2.306 1.00 0.00 H ATOM 214 N CYS A 19 12.859 1.150 6.078 1.00 0.00 N ATOM 215 CA CYS A 19 13.641 0.927 7.288 1.00 0.00 C ATOM 216 C CYS A 19 14.942 1.728 7.264 1.00 0.00 C ATOM 217 O CYS A 19 15.622 1.845 8.284 1.00 0.00 O ATOM 218 CB CYS A 19 13.949 -0.566 7.434 1.00 0.00 C ATOM 219 SG CYS A 19 15.287 -1.036 6.317 1.00 0.00 S ATOM 220 H CYS A 19 13.124 0.708 5.246 1.00 0.00 H ATOM 221 HA CYS A 19 13.058 1.242 8.140 1.00 0.00 H ATOM 222 HB2 CYS A 19 14.240 -0.778 8.446 1.00 0.00 H ATOM 223 HB3 CYS A 19 13.067 -1.138 7.188 1.00 0.00 H ATOM 224 N CYS A 20 15.288 2.281 6.101 1.00 0.00 N ATOM 225 CA CYS A 20 16.511 3.069 5.982 1.00 0.00 C ATOM 226 C CYS A 20 16.344 4.415 6.681 1.00 0.00 C ATOM 227 O CYS A 20 17.288 4.851 7.318 1.00 0.00 O ATOM 228 CB CYS A 20 16.861 3.279 4.503 1.00 0.00 C ATOM 229 SG CYS A 20 16.697 5.029 4.060 1.00 0.00 S ATOM 230 OXT CYS A 20 15.274 4.990 6.567 1.00 0.00 O ATOM 231 H CYS A 20 14.711 2.162 5.316 1.00 0.00 H ATOM 232 HA CYS A 20 17.319 2.531 6.455 1.00 0.00 H ATOM 233 HB2 CYS A 20 17.879 2.963 4.326 1.00 0.00 H ATOM 234 HB3 CYS A 20 16.195 2.691 3.892 1.00 0.00 H TER 235 CYS A 20