ATOM 89 N ALA A 8 -2.110 -3.658 -2.795 1.00 0.38 N ATOM 90 CA ALA A 8 -2.431 -4.827 -3.589 1.00 0.26 C ATOM 91 C ALA A 8 -2.530 -6.065 -2.710 1.00 0.32 C ATOM 92 O ALA A 8 -2.403 -5.980 -1.486 1.00 0.44 O ATOM 93 CB ALA A 8 -1.381 -5.019 -4.661 1.00 0.28 C ATOM 94 H ALA A 8 -1.174 -3.446 -2.620 1.00 0.62 H ATOM 95 HA ALA A 8 -3.382 -4.659 -4.068 1.00 0.33 H ATOM 96 HB1 ALA A 8 -1.242 -4.090 -5.194 1.00 1.05 H ATOM 97 HB2 ALA A 8 -1.705 -5.785 -5.348 1.00 1.03 H ATOM 98 HB3 ALA A 8 -0.449 -5.315 -4.204 1.00 1.02 H ATOM 99 N THR A 9 -2.737 -7.211 -3.342 1.00 0.43 N ATOM 100 CA THR A 9 -2.815 -8.479 -2.637 1.00 0.60 C ATOM 101 C THR A 9 -1.489 -8.793 -1.939 1.00 0.52 C ATOM 102 O THR A 9 -1.455 -9.476 -0.910 1.00 0.95 O ATOM 103 CB THR A 9 -3.172 -9.618 -3.613 1.00 0.85 C ATOM 104 OG1 THR A 9 -4.207 -9.189 -4.512 1.00 1.36 O ATOM 105 CG2 THR A 9 -3.648 -10.852 -2.862 1.00 1.67 C ATOM 106 H THR A 9 -2.863 -7.198 -4.316 1.00 0.50 H ATOM 107 HA THR A 9 -3.595 -8.402 -1.896 1.00 0.73 H ATOM 108 HB THR A 9 -2.295 -9.878 -4.184 1.00 1.26 H ATOM 109 HG1 THR A 9 -4.383 -8.241 -4.384 1.00 1.73 H ATOM 110 HG21 THR A 9 -3.874 -11.634 -3.570 1.00 2.28 H ATOM 111 HG22 THR A 9 -4.537 -10.605 -2.298 1.00 2.19 H ATOM 112 HG23 THR A 9 -2.872 -11.186 -2.188 1.00 2.02 H ATOM 113 N GLY A 10 -0.406 -8.294 -2.514 1.00 0.26 N ATOM 114 CA GLY A 10 0.900 -8.434 -1.902 1.00 0.25 C ATOM 115 C GLY A 10 1.577 -7.092 -1.702 1.00 0.22 C ATOM 116 O GLY A 10 2.805 -6.991 -1.748 1.00 0.34 O ATOM 117 H GLY A 10 -0.490 -7.832 -3.377 1.00 0.54 H ATOM 118 HA2 GLY A 10 0.788 -8.921 -0.943 1.00 0.31 H ATOM 119 HA3 GLY A 10 1.520 -9.049 -2.537 1.00 0.41 H ATOM 120 N TYR A 11 0.774 -6.053 -1.494 1.00 0.14 N ATOM 121 CA TYR A 11 1.290 -4.702 -1.295 1.00 0.14 C ATOM 122 C TYR A 11 0.570 -4.008 -0.157 1.00 0.19 C ATOM 123 O TYR A 11 -0.539 -4.382 0.220 1.00 0.39 O ATOM 124 CB TYR A 11 1.134 -3.848 -2.550 1.00 0.17 C ATOM 125 CG TYR A 11 2.155 -4.112 -3.633 1.00 0.17 C ATOM 126 CD1 TYR A 11 2.085 -5.241 -4.442 1.00 0.33 C ATOM 127 CD2 TYR A 11 3.192 -3.222 -3.843 1.00 0.27 C ATOM 128 CE1 TYR A 11 3.025 -5.466 -5.426 1.00 0.39 C ATOM 129 CE2 TYR A 11 4.133 -3.439 -4.824 1.00 0.31 C ATOM 130 CZ TYR A 11 4.050 -4.563 -5.612 1.00 0.31 C ATOM 131 OH TYR A 11 4.993 -4.783 -6.589 1.00 0.41 O ATOM 132 H TYR A 11 -0.197 -6.204 -1.446 1.00 0.20 H ATOM 133 HA TYR A 11 2.340 -4.779 -1.051 1.00 0.17 H ATOM 134 HB2 TYR A 11 0.158 -4.022 -2.963 1.00 0.22 H ATOM 135 HB3 TYR A 11 1.214 -2.807 -2.271 1.00 0.23 H ATOM 136 HD1 TYR A 11 1.282 -5.944 -4.294 1.00 0.47 H ATOM 137 HD2 TYR A 11 3.260 -2.341 -3.222 1.00 0.41 H ATOM 138 HE1 TYR A 11 2.957 -6.348 -6.044 1.00 0.56 H ATOM 139 HE2 TYR A 11 4.932 -2.732 -4.966 1.00 0.44 H ATOM 140 HH TYR A 11 5.874 -4.669 -6.214 1.00 0.98 H ATOM 141 N GLN A 12 1.187 -2.967 0.360 1.00 0.15 N ATOM 142 CA GLN A 12 0.614 -2.221 1.454 1.00 0.21 C ATOM 143 C GLN A 12 0.923 -0.742 1.291 1.00 0.19 C ATOM 144 O GLN A 12 1.796 -0.379 0.496 1.00 0.23 O ATOM 145 CB GLN A 12 1.162 -2.766 2.766 1.00 0.34 C ATOM 146 CG GLN A 12 2.648 -2.511 2.974 1.00 1.14 C ATOM 147 CD GLN A 12 3.225 -3.286 4.144 1.00 1.18 C ATOM 148 OE1 GLN A 12 2.527 -3.586 5.113 1.00 1.35 O ATOM 149 NE2 GLN A 12 4.501 -3.617 4.061 1.00 1.89 N ATOM 150 H GLN A 12 2.061 -2.696 0.000 1.00 0.22 H ATOM 151 HA GLN A 12 -0.457 -2.362 1.430 1.00 0.26 H ATOM 152 HB2 GLN A 12 0.619 -2.321 3.583 1.00 0.90 H ATOM 153 HB3 GLN A 12 1.001 -3.837 2.774 1.00 1.02 H ATOM 154 HG2 GLN A 12 3.178 -2.792 2.081 1.00 1.75 H ATOM 155 HG3 GLN A 12 2.792 -1.453 3.159 1.00 1.67 H ATOM 156 HE21 GLN A 12 5.004 -3.343 3.260 1.00 2.54 H ATOM 157 HE22 GLN A 12 4.900 -4.114 4.803 1.00 1.96 H ATOM 158 N ARG A 13 0.209 0.108 2.014 1.00 0.29 N ATOM 159 CA ARG A 13 0.420 1.540 1.904 1.00 0.28 C ATOM 160 C ARG A 13 1.471 1.985 2.894 1.00 0.28 C ATOM 161 O ARG A 13 1.394 1.680 4.085 1.00 0.54 O ATOM 162 CB ARG A 13 -0.867 2.324 2.157 1.00 0.47 C ATOM 163 CG ARG A 13 -2.045 1.881 1.303 1.00 1.48 C ATOM 164 CD ARG A 13 -3.293 2.679 1.642 1.00 1.60 C ATOM 165 NE ARG A 13 -3.544 2.703 3.082 1.00 1.99 N ATOM 166 CZ ARG A 13 -3.960 3.782 3.747 1.00 2.42 C ATOM 167 NH1 ARG A 13 -4.284 4.887 3.083 1.00 2.41 N ATOM 168 NH2 ARG A 13 -4.065 3.755 5.070 1.00 3.36 N ATOM 169 H ARG A 13 -0.463 -0.233 2.644 1.00 0.43 H ATOM 170 HA ARG A 13 0.771 1.747 0.904 1.00 0.26 H ATOM 171 HB2 ARG A 13 -1.140 2.214 3.195 1.00 0.97 H ATOM 172 HB3 ARG A 13 -0.675 3.373 1.955 1.00 1.02 H ATOM 173 HG2 ARG A 13 -1.801 2.036 0.263 1.00 2.05 H ATOM 174 HG3 ARG A 13 -2.235 0.832 1.482 1.00 2.05 H ATOM 175 HD2 ARG A 13 -3.161 3.694 1.293 1.00 2.04 H ATOM 176 HD3 ARG A 13 -4.141 2.235 1.142 1.00 1.90 H ATOM 177 HE ARG A 13 -3.357 1.873 3.586 1.00 2.44 H ATOM 178 HH11 ARG A 13 -4.220 4.914 2.085 1.00 2.32 H ATOM 179 HH12 ARG A 13 -4.599 5.703 3.582 1.00 2.90 H ATOM 180 HH21 ARG A 13 -3.833 2.920 5.583 1.00 3.83 H ATOM 181 HH22 ARG A 13 -4.360 4.582 5.570 1.00 3.79 H ATOM 182 N THR A 14 2.458 2.689 2.389 1.00 0.17 N ATOM 183 CA THR A 14 3.475 3.286 3.226 1.00 0.31 C ATOM 184 C THR A 14 2.935 4.584 3.820 1.00 0.20 C ATOM 185 O THR A 14 1.771 4.926 3.590 1.00 0.18 O ATOM 186 CB THR A 14 4.752 3.540 2.405 1.00 0.50 C ATOM 187 OG1 THR A 14 4.443 4.342 1.256 1.00 0.51 O ATOM 188 CG2 THR A 14 5.352 2.214 1.950 1.00 0.70 C ATOM 189 H THR A 14 2.506 2.813 1.417 1.00 0.22 H ATOM 190 HA THR A 14 3.708 2.594 4.026 1.00 0.46 H ATOM 191 HB THR A 14 5.473 4.055 3.022 1.00 0.59 H ATOM 192 HG1 THR A 14 4.118 3.769 0.548 1.00 0.97 H ATOM 193 HG21 THR A 14 4.619 1.665 1.367 1.00 1.06 H ATOM 194 HG22 THR A 14 5.631 1.633 2.815 1.00 1.35 H ATOM 195 HG23 THR A 14 6.226 2.403 1.343 1.00 1.28 H ATOM 196 N ALA A 15 3.763 5.312 4.566 1.00 0.32 N ATOM 197 CA ALA A 15 3.338 6.557 5.216 1.00 0.33 C ATOM 198 C ALA A 15 3.189 7.692 4.198 1.00 0.35 C ATOM 199 O ALA A 15 3.671 8.805 4.408 1.00 0.73 O ATOM 200 CB ALA A 15 4.330 6.939 6.305 1.00 0.56 C ATOM 201 H ALA A 15 4.684 5.005 4.690 1.00 0.45 H ATOM 202 HA ALA A 15 2.377 6.380 5.681 1.00 0.39 H ATOM 203 HB1 ALA A 15 3.972 7.814 6.827 1.00 1.09 H ATOM 204 HB2 ALA A 15 5.290 7.156 5.859 1.00 1.19 H ATOM 205 HB3 ALA A 15 4.432 6.120 7.000 1.00 1.10 H ATOM 206 N ASP A 16 2.505 7.391 3.103 1.00 0.39 N ATOM 207 CA ASP A 16 2.312 8.334 2.009 1.00 0.54 C ATOM 208 C ASP A 16 1.145 7.914 1.134 1.00 0.52 C ATOM 209 O ASP A 16 0.385 8.748 0.637 1.00 0.85 O ATOM 210 CB ASP A 16 3.588 8.433 1.159 1.00 0.79 C ATOM 211 CG ASP A 16 3.394 9.220 -0.126 1.00 1.57 C ATOM 212 OD1 ASP A 16 3.589 10.451 -0.105 1.00 2.45 O ATOM 213 OD2 ASP A 16 3.031 8.604 -1.149 1.00 2.08 O ATOM 214 H ASP A 16 2.090 6.500 3.039 1.00 0.62 H ATOM 215 HA ASP A 16 2.092 9.291 2.437 1.00 0.63 H ATOM 216 HB2 ASP A 16 4.358 8.920 1.737 1.00 1.33 H ATOM 217 HB3 ASP A 16 3.917 7.436 0.902 1.00 1.34 H ATOM 218 N GLY A 17 0.992 6.615 0.970 1.00 0.25 N ATOM 219 CA GLY A 17 0.028 6.106 0.022 1.00 0.33 C ATOM 220 C GLY A 17 0.715 5.382 -1.110 1.00 0.29 C ATOM 221 O GLY A 17 0.069 4.855 -2.013 1.00 0.41 O ATOM 222 H GLY A 17 1.520 5.993 1.513 1.00 0.27 H ATOM 223 HA2 GLY A 17 -0.639 5.423 0.529 1.00 0.38 H ATOM 224 HA3 GLY A 17 -0.539 6.930 -0.382 1.00 0.47 H ATOM 225 N ARG A 18 2.040 5.348 -1.043 1.00 0.25 N ATOM 226 CA ARG A 18 2.844 4.608 -1.996 1.00 0.29 C ATOM 227 C ARG A 18 2.808 3.125 -1.645 1.00 0.24 C ATOM 228 O ARG A 18 2.963 2.751 -0.479 1.00 0.40 O ATOM 229 CB ARG A 18 4.292 5.117 -1.976 1.00 0.41 C ATOM 230 CG ARG A 18 5.217 4.360 -2.912 1.00 1.25 C ATOM 231 CD ARG A 18 5.002 4.761 -4.362 1.00 1.66 C ATOM 232 NE ARG A 18 5.718 5.994 -4.696 1.00 2.09 N ATOM 233 CZ ARG A 18 5.826 6.480 -5.930 1.00 2.82 C ATOM 234 NH1 ARG A 18 5.147 5.929 -6.928 1.00 3.23 N ATOM 235 NH2 ARG A 18 6.595 7.537 -6.161 1.00 3.63 N ATOM 236 H ARG A 18 2.493 5.847 -0.331 1.00 0.29 H ATOM 237 HA ARG A 18 2.426 4.750 -2.982 1.00 0.36 H ATOM 238 HB2 ARG A 18 4.299 6.158 -2.264 1.00 0.78 H ATOM 239 HB3 ARG A 18 4.681 5.029 -0.974 1.00 1.06 H ATOM 240 HG2 ARG A 18 6.240 4.572 -2.637 1.00 2.01 H ATOM 241 HG3 ARG A 18 5.026 3.302 -2.808 1.00 1.76 H ATOM 242 HD2 ARG A 18 5.353 3.965 -5.001 1.00 2.12 H ATOM 243 HD3 ARG A 18 3.943 4.914 -4.525 1.00 2.22 H ATOM 244 HE ARG A 18 6.179 6.462 -3.964 1.00 2.38 H ATOM 245 HH11 ARG A 18 4.546 5.140 -6.760 1.00 3.16 H ATOM 246 HH12 ARG A 18 5.231 6.298 -7.862 1.00 3.93 H ATOM 247 HH21 ARG A 18 7.101 7.972 -5.403 1.00 3.87 H ATOM 248 HH22 ARG A 18 6.690 7.905 -7.095 1.00 4.23 H ATOM 249 N CYS A 19 2.598 2.292 -2.648 1.00 0.15 N ATOM 250 CA CYS A 19 2.452 0.861 -2.440 1.00 0.19 C ATOM 251 C CYS A 19 3.807 0.165 -2.424 1.00 0.21 C ATOM 252 O CYS A 19 4.612 0.333 -3.340 1.00 0.37 O ATOM 253 CB CYS A 19 1.558 0.279 -3.529 1.00 0.27 C ATOM 254 SG CYS A 19 -0.087 1.054 -3.588 1.00 0.32 S ATOM 255 H CYS A 19 2.534 2.645 -3.558 1.00 0.23 H ATOM 256 HA CYS A 19 1.969 0.712 -1.482 1.00 0.20 H ATOM 257 HB2 CYS A 19 2.029 0.421 -4.493 1.00 0.30 H ATOM 258 HB3 CYS A 19 1.417 -0.775 -3.349 1.00 0.32 H ATOM 259 N LYS A 20 4.057 -0.591 -1.362 1.00 0.17 N ATOM 260 CA LYS A 20 5.282 -1.370 -1.236 1.00 0.23 C ATOM 261 C LYS A 20 4.930 -2.839 -1.003 1.00 0.15 C ATOM 262 O LYS A 20 3.954 -3.135 -0.317 1.00 0.14 O ATOM 263 CB LYS A 20 6.154 -0.826 -0.090 1.00 0.38 C ATOM 264 CG LYS A 20 7.387 -1.673 0.191 1.00 0.90 C ATOM 265 CD LYS A 20 8.342 -1.000 1.161 1.00 1.14 C ATOM 266 CE LYS A 20 9.010 0.214 0.541 1.00 1.79 C ATOM 267 NZ LYS A 20 10.097 0.749 1.401 1.00 2.61 N ATOM 268 H LYS A 20 3.392 -0.629 -0.639 1.00 0.22 H ATOM 269 HA LYS A 20 5.823 -1.288 -2.163 1.00 0.32 H ATOM 270 HB2 LYS A 20 6.483 0.174 -0.340 1.00 0.61 H ATOM 271 HB3 LYS A 20 5.562 -0.783 0.813 1.00 0.85 H ATOM 272 HG2 LYS A 20 7.070 -2.614 0.615 1.00 1.46 H ATOM 273 HG3 LYS A 20 7.908 -1.857 -0.739 1.00 1.29 H ATOM 274 HD2 LYS A 20 7.787 -0.689 2.035 1.00 1.51 H ATOM 275 HD3 LYS A 20 9.101 -1.712 1.448 1.00 1.55 H ATOM 276 HE2 LYS A 20 9.427 -0.068 -0.416 1.00 2.17 H ATOM 277 HE3 LYS A 20 8.264 0.983 0.398 1.00 2.24 H ATOM 278 HZ1 LYS A 20 10.588 1.531 0.920 1.00 2.97 H ATOM 279 HZ2 LYS A 20 10.791 -0.005 1.604 1.00 3.02 H ATOM 280 HZ3 LYS A 20 9.706 1.102 2.305 1.00 3.14 H ATOM 281 N PRO A 21 5.685 -3.769 -1.624 1.00 0.17 N ATOM 282 CA PRO A 21 5.484 -5.210 -1.447 1.00 0.19 C ATOM 283 C PRO A 21 5.535 -5.618 0.021 1.00 0.27 C ATOM 284 O PRO A 21 6.283 -5.042 0.817 1.00 0.42 O ATOM 285 CB PRO A 21 6.647 -5.844 -2.215 1.00 0.33 C ATOM 286 CG PRO A 21 7.071 -4.809 -3.195 1.00 0.41 C ATOM 287 CD PRO A 21 6.789 -3.481 -2.556 1.00 0.29 C ATOM 288 HA PRO A 21 4.548 -5.533 -1.876 1.00 0.22 H ATOM 289 HB2 PRO A 21 7.445 -6.093 -1.530 1.00 0.39 H ATOM 290 HB3 PRO A 21 6.307 -6.734 -2.717 1.00 0.47 H ATOM 291 HG2 PRO A 21 8.127 -4.911 -3.402 1.00 0.56 H ATOM 292 HG3 PRO A 21 6.499 -4.918 -4.102 1.00 0.57 H ATOM 293 HD2 PRO A 21 7.660 -3.127 -2.026 1.00 0.36 H ATOM 294 HD3 PRO A 21 6.481 -2.764 -3.301 1.00 0.37 H ATOM 295 N THR A 22 4.730 -6.598 0.378 1.00 0.37 N ATOM 296 CA THR A 22 4.641 -7.036 1.752 1.00 0.53 C ATOM 297 C THR A 22 5.671 -8.115 2.068 1.00 0.70 C ATOM 298 O THR A 22 5.696 -9.177 1.441 1.00 1.32 O ATOM 299 CB THR A 22 3.222 -7.543 2.054 1.00 0.67 C ATOM 300 OG1 THR A 22 2.776 -8.419 1.003 1.00 0.84 O ATOM 301 CG2 THR A 22 2.264 -6.371 2.174 1.00 0.81 C ATOM 302 H THR A 22 4.168 -7.032 -0.301 1.00 0.43 H ATOM 303 HA THR A 22 4.831 -6.180 2.385 1.00 0.62 H ATOM 304 HB THR A 22 3.237 -8.083 2.992 1.00 0.78 H ATOM 305 HG1 THR A 22 2.871 -9.338 1.280 1.00 1.36 H ATOM 306 HG21 THR A 22 1.263 -6.740 2.324 1.00 1.39 H ATOM 307 HG22 THR A 22 2.301 -5.786 1.264 1.00 1.22 H ATOM 308 HG23 THR A 22 2.553 -5.752 3.010 1.00 1.30 H