ATOM 36 N LYS A 3 2.115 2.590 -4.525 1.00 22.13 N ATOM 37 CA LYS A 3 1.015 2.758 -5.466 1.00 53.13 C ATOM 38 C LYS A 3 -0.317 2.877 -4.731 1.00 62.35 C ATOM 39 O LYS A 3 -1.262 3.483 -5.235 1.00 15.21 O ATOM 40 CB LYS A 3 0.967 1.581 -6.443 1.00 23.33 C ATOM 41 CG LYS A 3 0.261 1.902 -7.749 1.00 24.43 C ATOM 42 CD LYS A 3 0.998 1.312 -8.940 1.00 52.31 C ATOM 43 CE LYS A 3 2.300 2.051 -9.211 1.00 74.54 C ATOM 44 NZ LYS A 3 2.833 1.753 -10.570 1.00 2.35 N ATOM 45 H LYS A 3 2.485 1.694 -4.377 1.00 61.21 H ATOM 46 HA LYS A 3 1.188 3.668 -6.021 1.00 25.23 H ATOM 47 HB2 LYS A 3 1.978 1.276 -6.669 1.00 62.35 H ATOM 48 HB3 LYS A 3 0.450 0.758 -5.971 1.00 35.12 H ATOM 49 HG2 LYS A 3 -0.737 1.492 -7.718 1.00 73.20 H ATOM 50 HG3 LYS A 3 0.209 2.975 -7.865 1.00 33.15 H ATOM 51 HD2 LYS A 3 1.221 0.275 -8.738 1.00 12.33 H ATOM 52 HD3 LYS A 3 0.365 1.383 -9.814 1.00 22.42 H ATOM 53 HE2 LYS A 3 2.121 3.112 -9.129 1.00 34.53 H ATOM 54 HE3 LYS A 3 3.029 1.750 -8.474 1.00 11.04 H ATOM 55 HZ1 LYS A 3 3.873 1.754 -10.553 1.00 71.43 H ATOM 56 HZ2 LYS A 3 2.507 2.473 -11.246 1.00 63.44 H ATOM 57 HZ3 LYS A 3 2.502 0.820 -10.887 1.00 42.01 H ATOM 58 N ASP A 4 -0.383 2.295 -3.539 1.00 2.31 N ATOM 59 CA ASP A 4 -1.598 2.338 -2.734 1.00 1.24 C ATOM 60 C ASP A 4 -1.820 3.734 -2.159 1.00 71.12 C ATOM 61 O ASP A 4 -2.957 4.150 -1.933 1.00 31.13 O ATOM 62 CB ASP A 4 -1.521 1.313 -1.601 1.00 10.30 C ATOM 63 CG ASP A 4 -2.577 0.233 -1.725 1.00 71.34 C ATOM 64 OD1 ASP A 4 -3.733 0.569 -2.058 1.00 23.30 O ATOM 65 OD2 ASP A 4 -2.248 -0.949 -1.489 1.00 52.12 O ATOM 66 H ASP A 4 0.405 1.827 -3.191 1.00 71.54 H ATOM 67 HA ASP A 4 -2.430 2.090 -3.375 1.00 41.22 H ATOM 68 HB2 ASP A 4 -0.548 0.843 -1.615 1.00 14.01 H ATOM 69 HB3 ASP A 4 -1.658 1.819 -0.657 1.00 13.13 H ATOM 70 N LEU A 5 -0.728 4.452 -1.925 1.00 5.24 N ATOM 71 CA LEU A 5 -0.802 5.802 -1.375 1.00 74.52 C ATOM 72 C LEU A 5 -1.261 6.797 -2.436 1.00 62.22 C ATOM 73 O LEU A 5 -1.863 7.823 -2.120 1.00 30.11 O ATOM 74 CB LEU A 5 0.559 6.223 -0.818 1.00 73.15 C ATOM 75 CG LEU A 5 0.530 7.205 0.354 1.00 73.45 C ATOM 76 CD1 LEU A 5 0.618 6.459 1.676 1.00 14.33 C ATOM 77 CD2 LEU A 5 1.662 8.214 0.232 1.00 52.12 C ATOM 78 H LEU A 5 0.151 4.067 -2.125 1.00 54.23 H ATOM 79 HA LEU A 5 -1.524 5.792 -0.572 1.00 3.43 H ATOM 80 HB2 LEU A 5 1.072 5.332 -0.491 1.00 11.13 H ATOM 81 HB3 LEU A 5 1.116 6.682 -1.623 1.00 0.34 H ATOM 82 HG LEU A 5 -0.406 7.746 0.338 1.00 0.50 H ATOM 83 HD11 LEU A 5 0.981 7.127 2.442 1.00 14.54 H ATOM 84 HD12 LEU A 5 1.296 5.625 1.575 1.00 41.20 H ATOM 85 HD13 LEU A 5 -0.362 6.095 1.950 1.00 62.12 H ATOM 86 HD21 LEU A 5 1.265 9.162 -0.099 1.00 14.21 H ATOM 87 HD22 LEU A 5 2.386 7.857 -0.485 1.00 63.02 H ATOM 88 HD23 LEU A 5 2.138 8.338 1.194 1.00 44.25 H ATOM 89 N ARG A 6 -0.974 6.485 -3.696 1.00 5.31 N ATOM 90 CA ARG A 6 -1.357 7.352 -4.804 1.00 33.22 C ATOM 91 C ARG A 6 -2.862 7.604 -4.801 1.00 32.30 C ATOM 92 O ARG A 6 -3.325 8.670 -5.208 1.00 63.00 O ATOM 93 CB ARG A 6 -0.936 6.729 -6.136 1.00 31.21 C ATOM 94 CG ARG A 6 0.566 6.742 -6.367 1.00 2.33 C ATOM 95 CD ARG A 6 0.902 6.962 -7.833 1.00 65.14 C ATOM 96 NE ARG A 6 2.338 6.873 -8.085 1.00 4.31 N ATOM 97 CZ ARG A 6 2.928 7.378 -9.163 1.00 61.41 C ATOM 98 NH1 ARG A 6 2.209 8.003 -10.085 1.00 11.44 N ATOM 99 NH2 ARG A 6 4.240 7.257 -9.321 1.00 20.21 N ATOM 100 H ARG A 6 -0.491 5.653 -3.885 1.00 13.22 H ATOM 101 HA ARG A 6 -0.846 8.295 -4.680 1.00 32.20 H ATOM 102 HB2 ARG A 6 -1.273 5.703 -6.163 1.00 22.22 H ATOM 103 HB3 ARG A 6 -1.407 7.275 -6.939 1.00 62.25 H ATOM 104 HG2 ARG A 6 1.003 7.541 -5.785 1.00 62.24 H ATOM 105 HG3 ARG A 6 0.978 5.796 -6.049 1.00 41.04 H ATOM 106 HD2 ARG A 6 0.397 6.210 -8.421 1.00 51.43 H ATOM 107 HD3 ARG A 6 0.555 7.941 -8.126 1.00 13.43 H ATOM 108 HE ARG A 6 2.889 6.415 -7.417 1.00 33.13 H ATOM 109 HH11 ARG A 6 1.220 8.097 -9.968 1.00 24.22 H ATOM 110 HH12 ARG A 6 2.656 8.383 -10.895 1.00 13.30 H ATOM 111 HH21 ARG A 6 4.785 6.786 -8.628 1.00 65.12 H ATOM 112 HH22 ARG A 6 4.683 7.636 -10.133 1.00 12.55 H ATOM 113 N HIS A 7 -3.622 6.615 -4.340 1.00 23.10 N ATOM 114 CA HIS A 7 -5.075 6.729 -4.284 1.00 43.21 C ATOM 115 C HIS A 7 -5.505 7.621 -3.124 1.00 13.14 C ATOM 116 O HIS A 7 -6.627 8.127 -3.100 1.00 42.21 O ATOM 117 CB HIS A 7 -5.711 5.346 -4.143 1.00 52.22 C ATOM 118 CG HIS A 7 -6.983 5.190 -4.919 1.00 0.23 C ATOM 119 ND1 HIS A 7 -7.022 5.129 -6.296 1.00 11.53 N ATOM 120 CD2 HIS A 7 -8.266 5.081 -4.502 1.00 72.42 C ATOM 121 CE1 HIS A 7 -8.274 4.991 -6.693 1.00 14.13 C ATOM 122 NE2 HIS A 7 -9.049 4.958 -5.624 1.00 13.25 N ATOM 123 H HIS A 7 -3.195 5.789 -4.030 1.00 2.43 H ATOM 124 HA HIS A 7 -5.408 7.177 -5.208 1.00 61.42 H ATOM 125 HB2 HIS A 7 -5.015 4.599 -4.495 1.00 41.31 H ATOM 126 HB3 HIS A 7 -5.932 5.163 -3.101 1.00 52.14 H ATOM 127 HD1 HIS A 7 -6.247 5.182 -6.893 1.00 74.10 H ATOM 128 HD2 HIS A 7 -8.611 5.088 -3.478 1.00 13.44 H ATOM 129 HE1 HIS A 7 -8.609 4.917 -7.717 1.00 23.23 H ATOM 130 N ALA A 8 -4.607 7.808 -2.162 1.00 42.34 N ATOM 131 CA ALA A 8 -4.894 8.640 -1.000 1.00 25.40 C ATOM 132 C ALA A 8 -4.837 10.121 -1.357 1.00 55.03 C ATOM 133 O ALA A 8 -5.435 10.957 -0.679 1.00 33.41 O ATOM 134 CB ALA A 8 -3.917 8.329 0.125 1.00 73.31 C ATOM 135 H ALA A 8 -3.730 7.378 -2.238 1.00 2.02 H ATOM 136 HA ALA A 8 -5.889 8.400 -0.656 1.00 14.12 H ATOM 137 HB1 ALA A 8 -3.551 7.319 0.013 1.00 24.31 H ATOM 138 HB2 ALA A 8 -3.089 9.020 0.083 1.00 22.25 H ATOM 139 HB3 ALA A 8 -4.421 8.426 1.075 1.00 2.01 H ATOM 140 N PHE A 9 -4.115 10.440 -2.426 1.00 50.20 N ATOM 141 CA PHE A 9 -3.980 11.822 -2.872 1.00 64.14 C ATOM 142 C PHE A 9 -5.334 12.398 -3.276 1.00 4.44 C ATOM 143 O PHE A 9 -5.552 13.608 -3.202 1.00 60.22 O ATOM 144 CB PHE A 9 -3.006 11.907 -4.049 1.00 65.33 C ATOM 145 CG PHE A 9 -2.529 13.302 -4.334 1.00 0.43 C ATOM 146 CD1 PHE A 9 -3.256 14.142 -5.162 1.00 73.44 C ATOM 147 CD2 PHE A 9 -1.354 13.776 -3.772 1.00 32.51 C ATOM 148 CE1 PHE A 9 -2.819 15.426 -5.426 1.00 55.02 C ATOM 149 CE2 PHE A 9 -0.913 15.059 -4.032 1.00 5.33 C ATOM 150 CZ PHE A 9 -1.647 15.886 -4.859 1.00 61.12 C ATOM 151 H PHE A 9 -3.662 9.729 -2.926 1.00 45.31 H ATOM 152 HA PHE A 9 -3.587 12.398 -2.049 1.00 50.30 H ATOM 153 HB2 PHE A 9 -2.140 11.298 -3.835 1.00 42.35 H ATOM 154 HB3 PHE A 9 -3.492 11.533 -4.938 1.00 14.44 H ATOM 155 HD1 PHE A 9 -4.174 13.784 -5.606 1.00 30.03 H ATOM 156 HD2 PHE A 9 -0.779 13.129 -3.124 1.00 2.33 H ATOM 157 HE1 PHE A 9 -3.396 16.070 -6.073 1.00 44.53 H ATOM 158 HE2 PHE A 9 0.005 15.415 -3.587 1.00 13.34 H ATOM 159 HZ PHE A 9 -1.303 16.889 -5.064 1.00 74.21 H ATOM 160 N ARG A 10 -6.239 11.524 -3.702 1.00 60.01 N ATOM 161 CA ARG A 10 -7.571 11.945 -4.119 1.00 0.31 C ATOM 162 C ARG A 10 -8.433 12.297 -2.910 1.00 50.10 C ATOM 163 O ARG A 10 -9.350 13.107 -3.039 1.00 61.24 O ATOM 164 CB ARG A 10 -8.246 10.842 -4.936 1.00 64.11 C ATOM 165 CG ARG A 10 -8.988 11.357 -6.158 1.00 72.23 C ATOM 166 CD ARG A 10 -9.943 10.311 -6.711 1.00 73.34 C ATOM 167 NE ARG A 10 -11.314 10.524 -6.253 1.00 65.40 N ATOM 168 CZ ARG A 10 -12.376 9.979 -6.835 1.00 52.33 C ATOM 169 NH1 ARG A 10 -12.227 9.193 -7.893 1.00 11.34 N ATOM 170 NH2 ARG A 10 -13.591 10.220 -6.360 1.00 12.54 N ATOM 171 H ARG A 10 -6.006 10.573 -3.738 1.00 65.21 H ATOM 172 HA ARG A 10 -7.463 12.824 -4.737 1.00 61.10 H ATOM 173 HB2 ARG A 10 -7.492 10.144 -5.268 1.00 64.43 H ATOM 174 HB3 ARG A 10 -8.951 10.324 -4.305 1.00 35.33 H ATOM 175 HG2 ARG A 10 -9.554 12.234 -5.881 1.00 72.02 H ATOM 176 HG3 ARG A 10 -8.270 11.616 -6.922 1.00 22.44 H ATOM 177 HD2 ARG A 10 -9.923 10.359 -7.790 1.00 33.31 H ATOM 178 HD3 ARG A 10 -9.613 9.335 -6.389 1.00 21.25 H ATOM 179 HE ARG A 10 -11.447 11.101 -5.473 1.00 44.21 H ATOM 180 HH11 ARG A 10 -11.313 9.009 -8.253 1.00 3.15 H ATOM 181 HH12 ARG A 10 -13.029 8.784 -8.328 1.00 61.34 H ATOM 182 HH21 ARG A 10 -13.707 10.812 -5.563 1.00 15.35 H ATOM 183 HH22 ARG A 10 -14.390 9.811 -6.798 1.00 72.44 H ATOM 198 N MET A 12 -7.635 13.976 -0.427 1.00 74.22 N ATOM 199 CA MET A 12 -7.386 15.386 -0.153 1.00 55.45 C ATOM 200 C MET A 12 -8.123 16.272 -1.153 1.00 41.43 C ATOM 201 O MET A 12 -8.445 17.423 -0.858 1.00 40.42 O ATOM 202 CB MET A 12 -5.886 15.680 -0.202 1.00 41.43 C ATOM 203 CG MET A 12 -5.146 15.278 1.063 1.00 14.24 C ATOM 204 SD MET A 12 -3.847 16.446 1.509 1.00 23.22 S ATOM 205 CE MET A 12 -4.499 17.110 3.039 1.00 10.52 C ATOM 206 H MET A 12 -6.914 13.428 -0.802 1.00 34.42 H ATOM 207 HA MET A 12 -7.754 15.601 0.839 1.00 70.13 H ATOM 208 HB2 MET A 12 -5.453 15.143 -1.033 1.00 3.23 H ATOM 209 HB3 MET A 12 -5.743 16.740 -0.355 1.00 71.21 H ATOM 210 HG2 MET A 12 -5.855 15.223 1.877 1.00 44.04 H ATOM 211 HG3 MET A 12 -4.701 14.306 0.910 1.00 55.21 H ATOM 212 HE1 MET A 12 -5.563 16.927 3.086 1.00 2.41 H ATOM 213 HE2 MET A 12 -4.014 16.630 3.876 1.00 1.52 H ATOM 214 HE3 MET A 12 -4.314 18.174 3.077 1.00 31.21 H ATOM 215 N PHE A 13 -8.386 15.729 -2.337 1.00 71.20 N ATOM 216 CA PHE A 13 -9.083 16.471 -3.381 1.00 34.21 C ATOM 217 C PHE A 13 -10.547 16.687 -3.009 1.00 13.52 C ATOM 218 O PHE A 13 -11.097 16.019 -2.133 1.00 72.34 O ATOM 219 CB PHE A 13 -8.989 15.727 -4.715 1.00 33.24 C ATOM 220 CG PHE A 13 -8.073 16.386 -5.705 1.00 50.14 C ATOM 221 CD1 PHE A 13 -6.818 16.829 -5.320 1.00 63.42 C ATOM 222 CD2 PHE A 13 -8.467 16.563 -7.022 1.00 64.21 C ATOM 223 CE1 PHE A 13 -5.973 17.436 -6.230 1.00 11.22 C ATOM 224 CE2 PHE A 13 -7.626 17.169 -7.936 1.00 40.44 C ATOM 225 CZ PHE A 13 -6.377 17.606 -7.540 1.00 31.33 C ATOM 226 H PHE A 13 -8.104 14.807 -2.513 1.00 21.51 H ATOM 227 HA PHE A 13 -8.604 17.432 -3.480 1.00 45.10 H ATOM 228 HB2 PHE A 13 -8.621 14.728 -4.536 1.00 64.12 H ATOM 229 HB3 PHE A 13 -9.973 15.670 -5.157 1.00 25.33 H ATOM 230 HD1 PHE A 13 -6.500 16.696 -4.297 1.00 22.25 H ATOM 231 HD2 PHE A 13 -9.444 16.221 -7.334 1.00 1.35 H ATOM 232 HE1 PHE A 13 -4.997 17.776 -5.917 1.00 40.23 H ATOM 233 HE2 PHE A 13 -7.945 17.300 -8.960 1.00 13.24 H ATOM 234 HZ PHE A 13 -5.719 18.080 -8.252 1.00 51.51 H ATOM 235 N PRO A 14 -11.195 17.646 -3.689 1.00 25.43 N ATOM 236 CA PRO A 14 -12.603 17.974 -3.448 1.00 22.54 C ATOM 237 C PRO A 14 -13.548 16.918 -4.010 1.00 74.04 C ATOM 238 O PRO A 14 -14.724 16.868 -3.649 1.00 51.11 O ATOM 239 CB PRO A 14 -12.788 19.304 -4.182 1.00 70.43 C ATOM 240 CG PRO A 14 -11.752 19.292 -5.253 1.00 55.22 C ATOM 241 CD PRO A 14 -10.602 18.482 -4.746 1.00 5.14 C ATOM 242 HA PRO A 14 -12.804 18.111 -2.395 1.00 64.31 H ATOM 243 HB2 PRO A 14 -13.785 19.353 -4.596 1.00 53.23 H ATOM 244 HB3 PRO A 14 -12.636 20.123 -3.495 1.00 73.44 H ATOM 245 HG2 PRO A 14 -12.153 18.838 -6.147 1.00 12.52 H ATOM 246 HG3 PRO A 14 -11.425 20.301 -5.457 1.00 60.03 H ATOM 247 HD2 PRO A 14 -10.204 17.872 -5.543 1.00 23.33 H ATOM 248 HD3 PRO A 14 -9.834 19.126 -4.342 1.00 20.34 H ATOM 249 N SER A 15 -13.027 16.075 -4.897 1.00 13.44 N ATOM 250 CA SER A 15 -13.827 15.022 -5.512 1.00 4.31 C ATOM 251 C SER A 15 -14.177 13.941 -4.494 1.00 1.20 C ATOM 252 O SER A 15 -15.188 13.251 -4.628 1.00 4.34 O ATOM 253 CB SER A 15 -13.073 14.404 -6.691 1.00 30.21 C ATOM 254 OG SER A 15 -13.064 15.279 -7.806 1.00 21.53 O ATOM 255 H SER A 15 -12.083 16.166 -5.144 1.00 52.12 H ATOM 256 HA SER A 15 -14.741 15.469 -5.874 1.00 64.22 H ATOM 257 HB2 SER A 15 -12.054 14.203 -6.398 1.00 2.01 H ATOM 258 HB3 SER A 15 -13.554 13.480 -6.977 1.00 72.30 H ATOM 259 HG SER A 15 -12.158 15.513 -8.021 1.00 53.42 H ATOM 260 N SER A 16 -13.334 13.800 -3.476 1.00 65.24 N ATOM 261 CA SER A 16 -13.551 12.801 -2.437 1.00 24.52 C ATOM 262 C SER A 16 -14.635 13.255 -1.464 1.00 61.25 C ATOM 263 O SER A 16 -15.383 12.439 -0.927 1.00 65.51 O ATOM 264 CB SER A 16 -12.249 12.532 -1.678 1.00 74.03 C ATOM 265 OG SER A 16 -12.508 12.181 -0.330 1.00 72.41 O ATOM 266 H SER A 16 -12.545 14.380 -3.425 1.00 51.12 H ATOM 267 HA SER A 16 -13.873 11.888 -2.916 1.00 43.12 H ATOM 268 HB2 SER A 16 -11.719 11.721 -2.154 1.00 35.34 H ATOM 269 HB3 SER A 16 -11.636 13.421 -1.695 1.00 13.50 H ATOM 270 HG SER A 16 -12.654 12.977 0.186 1.00 31.21 H