ATOM 80 N CYS A 5 -3.019 -4.028 -1.119 1.00 0.10 N ATOM 81 CA CYS A 5 -1.648 -4.222 -1.538 1.00 0.12 C ATOM 82 C CYS A 5 -1.391 -5.693 -1.839 1.00 0.17 C ATOM 83 O CYS A 5 -1.160 -6.500 -0.930 1.00 0.19 O ATOM 84 CB CYS A 5 -0.694 -3.735 -0.455 1.00 0.12 C ATOM 85 SG CYS A 5 1.045 -4.031 -0.823 1.00 0.17 S ATOM 86 H CYS A 5 -3.225 -4.025 -0.159 1.00 0.12 H ATOM 87 HA CYS A 5 -1.486 -3.646 -2.436 1.00 0.16 H ATOM 88 HB2 CYS A 5 -0.825 -2.671 -0.318 1.00 0.16 H ATOM 89 HB3 CYS A 5 -0.926 -4.241 0.468 1.00 0.16 H ATOM 90 N THR A 6 -1.416 -6.028 -3.118 1.00 0.27 N ATOM 91 CA THR A 6 -1.236 -7.398 -3.563 1.00 0.35 C ATOM 92 C THR A 6 0.253 -7.747 -3.676 1.00 0.37 C ATOM 93 O THR A 6 0.661 -8.554 -4.511 1.00 0.47 O ATOM 94 CB THR A 6 -1.937 -7.606 -4.921 1.00 0.47 C ATOM 95 OG1 THR A 6 -3.199 -6.920 -4.915 1.00 0.91 O ATOM 96 CG2 THR A 6 -2.174 -9.082 -5.201 1.00 1.03 C ATOM 97 H THR A 6 -1.569 -5.329 -3.792 1.00 0.34 H ATOM 98 HA THR A 6 -1.696 -8.051 -2.836 1.00 0.38 H ATOM 99 HB THR A 6 -1.313 -7.197 -5.701 1.00 0.95 H ATOM 100 HG1 THR A 6 -3.847 -7.442 -4.426 1.00 1.67 H ATOM 101 HG21 THR A 6 -1.226 -9.600 -5.222 1.00 1.85 H ATOM 102 HG22 THR A 6 -2.667 -9.194 -6.155 1.00 1.24 H ATOM 103 HG23 THR A 6 -2.796 -9.502 -4.423 1.00 1.51 H ATOM 104 N TRP A 7 1.064 -7.120 -2.833 1.00 0.31 N ATOM 105 CA TRP A 7 2.480 -7.424 -2.771 1.00 0.37 C ATOM 106 C TRP A 7 2.658 -8.831 -2.221 1.00 0.40 C ATOM 107 O TRP A 7 1.905 -9.249 -1.338 1.00 0.54 O ATOM 108 CB TRP A 7 3.196 -6.405 -1.884 1.00 0.39 C ATOM 109 CG TRP A 7 4.687 -6.487 -1.931 1.00 0.49 C ATOM 110 CD1 TRP A 7 5.485 -7.340 -1.228 1.00 0.60 C ATOM 111 CD2 TRP A 7 5.561 -5.665 -2.705 1.00 0.51 C ATOM 112 NE1 TRP A 7 6.803 -7.108 -1.528 1.00 0.66 N ATOM 113 CE2 TRP A 7 6.876 -6.080 -2.430 1.00 0.61 C ATOM 114 CE3 TRP A 7 5.358 -4.619 -3.605 1.00 0.51 C ATOM 115 CZ2 TRP A 7 7.983 -5.484 -3.026 1.00 0.68 C ATOM 116 CZ3 TRP A 7 6.458 -4.027 -4.195 1.00 0.61 C ATOM 117 CH2 TRP A 7 7.755 -4.460 -3.903 1.00 0.67 C ATOM 118 H TRP A 7 0.696 -6.445 -2.230 1.00 0.30 H ATOM 119 HA TRP A 7 2.883 -7.379 -3.771 1.00 0.41 H ATOM 120 HB2 TRP A 7 2.913 -5.413 -2.192 1.00 0.39 H ATOM 121 HB3 TRP A 7 2.888 -6.556 -0.864 1.00 0.37 H ATOM 122 HD1 TRP A 7 5.116 -8.091 -0.544 1.00 0.65 H ATOM 123 HE1 TRP A 7 7.568 -7.595 -1.154 1.00 0.75 H ATOM 124 HE3 TRP A 7 4.362 -4.274 -3.840 1.00 0.47 H ATOM 125 HZ2 TRP A 7 8.991 -5.808 -2.811 1.00 0.76 H ATOM 126 HZ3 TRP A 7 6.321 -3.214 -4.891 1.00 0.66 H ATOM 127 HH2 TRP A 7 8.584 -3.966 -4.387 1.00 0.75 H ATOM 141 N GLY A 9 2.929 -11.628 -0.258 1.00 0.71 N ATOM 142 CA GLY A 9 2.953 -11.923 1.161 1.00 0.81 C ATOM 143 C GLY A 9 2.515 -10.758 2.027 1.00 0.65 C ATOM 144 O GLY A 9 2.656 -10.804 3.250 1.00 0.80 O ATOM 145 H GLY A 9 2.123 -11.826 -0.780 1.00 0.78 H ATOM 146 HA2 GLY A 9 2.299 -12.758 1.351 1.00 0.97 H ATOM 147 HA3 GLY A 9 3.959 -12.201 1.437 1.00 0.92 H ATOM 148 N CYS A 10 1.979 -9.715 1.412 1.00 0.45 N ATOM 149 CA CYS A 10 1.553 -8.548 2.162 1.00 0.31 C ATOM 150 C CYS A 10 0.041 -8.576 2.400 1.00 0.19 C ATOM 151 O CYS A 10 -0.408 -8.977 3.476 1.00 0.27 O ATOM 152 CB CYS A 10 1.975 -7.272 1.440 1.00 0.28 C ATOM 153 SG CYS A 10 1.794 -5.777 2.432 1.00 0.24 S ATOM 154 H CYS A 10 1.871 -9.730 0.434 1.00 0.46 H ATOM 155 HA CYS A 10 2.049 -8.580 3.119 1.00 0.39 H ATOM 156 HB2 CYS A 10 3.013 -7.355 1.161 1.00 0.39 H ATOM 157 HB3 CYS A 10 1.377 -7.153 0.552 1.00 0.28 H ATOM 158 N GLY A 11 -0.746 -8.164 1.409 1.00 0.15 N ATOM 159 CA GLY A 11 -2.189 -8.197 1.557 1.00 0.16 C ATOM 160 C GLY A 11 -2.697 -7.201 2.585 1.00 0.15 C ATOM 161 O GLY A 11 -3.621 -7.497 3.344 1.00 0.28 O ATOM 162 H GLY A 11 -0.351 -7.834 0.571 1.00 0.22 H ATOM 163 HA2 GLY A 11 -2.640 -7.971 0.602 1.00 0.25 H ATOM 164 HA3 GLY A 11 -2.485 -9.189 1.857 1.00 0.22 H ATOM 165 N LYS A 12 -2.076 -6.032 2.628 1.00 0.11 N ATOM 166 CA LYS A 12 -2.528 -4.954 3.500 1.00 0.15 C ATOM 167 C LYS A 12 -3.657 -4.194 2.810 1.00 0.12 C ATOM 168 O LYS A 12 -3.532 -3.836 1.642 1.00 0.17 O ATOM 169 CB LYS A 12 -1.362 -4.009 3.811 1.00 0.24 C ATOM 170 CG LYS A 12 -1.665 -2.973 4.878 1.00 0.75 C ATOM 171 CD LYS A 12 -1.669 -3.575 6.269 1.00 1.23 C ATOM 172 CE LYS A 12 -1.892 -2.507 7.325 1.00 1.80 C ATOM 173 NZ LYS A 12 -1.764 -3.049 8.703 1.00 2.23 N1+ ATOM 174 H LYS A 12 -1.290 -5.890 2.065 1.00 0.15 H ATOM 175 HA LYS A 12 -2.897 -5.388 4.416 1.00 0.21 H ATOM 176 HB2 LYS A 12 -0.519 -4.594 4.144 1.00 0.68 H ATOM 177 HB3 LYS A 12 -1.088 -3.487 2.906 1.00 0.68 H ATOM 178 HG2 LYS A 12 -0.914 -2.200 4.836 1.00 1.34 H ATOM 179 HG3 LYS A 12 -2.634 -2.542 4.678 1.00 1.16 H ATOM 180 HD2 LYS A 12 -2.460 -4.305 6.336 1.00 1.41 H ATOM 181 HD3 LYS A 12 -0.717 -4.052 6.448 1.00 1.66 H ATOM 182 HE2 LYS A 12 -1.160 -1.726 7.186 1.00 2.19 H ATOM 183 HE3 LYS A 12 -2.883 -2.096 7.199 1.00 2.31 H ATOM 184 HZ1 LYS A 12 -0.835 -3.502 8.823 1.00 2.62 H ATOM 185 HZ2 LYS A 12 -2.505 -3.753 8.885 1.00 2.55 H ATOM 186 HZ3 LYS A 12 -1.851 -2.279 9.397 1.00 2.63 H ATOM 187 N ARG A 13 -4.751 -3.956 3.514 1.00 0.13 N ATOM 188 CA ARG A 13 -5.934 -3.371 2.891 1.00 0.13 C ATOM 189 C ARG A 13 -6.161 -1.931 3.335 1.00 0.12 C ATOM 190 O ARG A 13 -5.865 -1.559 4.472 1.00 0.16 O ATOM 191 CB ARG A 13 -7.167 -4.223 3.190 1.00 0.18 C ATOM 192 CG ARG A 13 -7.089 -5.616 2.590 1.00 0.84 C ATOM 193 CD ARG A 13 -8.330 -6.432 2.904 1.00 0.77 C ATOM 194 NE ARG A 13 -8.511 -6.630 4.343 1.00 1.57 N ATOM 195 CZ ARG A 13 -9.539 -7.283 4.878 1.00 2.12 C ATOM 196 NH1 ARG A 13 -10.472 -7.812 4.097 1.00 1.97 N1+ ATOM 197 NH2 ARG A 13 -9.636 -7.403 6.195 1.00 3.21 N ATOM 198 H ARG A 13 -4.764 -4.161 4.475 1.00 0.18 H ATOM 199 HA ARG A 13 -5.766 -3.374 1.823 1.00 0.13 H ATOM 200 HB2 ARG A 13 -7.276 -4.319 4.260 1.00 0.71 H ATOM 201 HB3 ARG A 13 -8.040 -3.729 2.789 1.00 0.73 H ATOM 202 HG2 ARG A 13 -6.990 -5.528 1.518 1.00 1.32 H ATOM 203 HG3 ARG A 13 -6.223 -6.121 2.993 1.00 1.33 H ATOM 204 HD2 ARG A 13 -9.194 -5.914 2.512 1.00 0.97 H ATOM 205 HD3 ARG A 13 -8.243 -7.397 2.425 1.00 1.41 H ATOM 206 HE ARG A 13 -7.827 -6.251 4.942 1.00 2.13 H ATOM 207 HH11 ARG A 13 -11.249 -8.305 4.501 1.00 2.51 H ATOM 208 HH12 ARG A 13 -10.405 -7.726 3.101 1.00 1.72 H ATOM 209 HH21 ARG A 13 -8.933 -7.002 6.793 1.00 3.71 H ATOM 210 HH22 ARG A 13 -10.409 -7.896 6.601 1.00 3.66 H ATOM 211 N PHE A 14 -6.682 -1.128 2.412 1.00 0.11 N ATOM 212 CA PHE A 14 -6.940 0.286 2.653 1.00 0.12 C ATOM 213 C PHE A 14 -8.240 0.700 1.973 1.00 0.14 C ATOM 214 O PHE A 14 -8.797 -0.046 1.167 1.00 0.23 O ATOM 215 CB PHE A 14 -5.794 1.142 2.102 1.00 0.15 C ATOM 216 CG PHE A 14 -4.450 0.747 2.619 1.00 0.14 C ATOM 217 CD1 PHE A 14 -3.966 1.277 3.799 1.00 0.22 C ATOM 218 CD2 PHE A 14 -3.670 -0.151 1.917 1.00 0.13 C ATOM 219 CE1 PHE A 14 -2.722 0.920 4.271 1.00 0.25 C ATOM 220 CE2 PHE A 14 -2.427 -0.514 2.383 1.00 0.13 C ATOM 221 CZ PHE A 14 -1.969 0.006 3.589 1.00 0.19 C ATOM 222 H PHE A 14 -6.908 -1.501 1.531 1.00 0.15 H ATOM 223 HA PHE A 14 -7.025 0.440 3.717 1.00 0.12 H ATOM 224 HB2 PHE A 14 -5.772 1.060 1.029 1.00 0.16 H ATOM 225 HB3 PHE A 14 -5.961 2.173 2.374 1.00 0.19 H ATOM 226 HD1 PHE A 14 -4.569 1.982 4.351 1.00 0.28 H ATOM 227 HD2 PHE A 14 -4.043 -0.569 0.996 1.00 0.17 H ATOM 228 HE1 PHE A 14 -2.351 1.341 5.196 1.00 0.34 H ATOM 229 HE2 PHE A 14 -1.826 -1.215 1.827 1.00 0.16 H ATOM 230 HZ PHE A 14 -1.000 -0.285 3.968 1.00 0.22 H ATOM 231 N THR A 15 -8.725 1.880 2.311 1.00 0.13 N ATOM 232 CA THR A 15 -9.893 2.439 1.661 1.00 0.16 C ATOM 233 C THR A 15 -9.536 3.778 1.014 1.00 0.14 C ATOM 234 O THR A 15 -10.358 4.414 0.356 1.00 0.28 O ATOM 235 CB THR A 15 -11.035 2.618 2.680 1.00 0.25 C ATOM 236 OG1 THR A 15 -11.145 1.433 3.481 1.00 1.03 O ATOM 237 CG2 THR A 15 -12.366 2.874 1.984 1.00 1.16 C ATOM 238 H THR A 15 -8.297 2.385 3.033 1.00 0.17 H ATOM 239 HA THR A 15 -10.217 1.747 0.896 1.00 0.21 H ATOM 240 HB THR A 15 -10.805 3.460 3.318 1.00 0.94 H ATOM 241 HG1 THR A 15 -10.795 0.680 2.981 1.00 1.65 H ATOM 242 HG21 THR A 15 -12.624 2.021 1.375 1.00 1.64 H ATOM 243 HG22 THR A 15 -12.280 3.749 1.358 1.00 1.79 H ATOM 244 HG23 THR A 15 -13.135 3.034 2.724 1.00 1.78 H ATOM 245 N ARG A 16 -8.289 4.197 1.206 1.00 0.12 N ATOM 246 CA ARG A 16 -7.799 5.441 0.635 1.00 0.14 C ATOM 247 C ARG A 16 -6.587 5.182 -0.258 1.00 0.12 C ATOM 248 O ARG A 16 -5.650 4.469 0.122 1.00 0.13 O ATOM 249 CB ARG A 16 -7.441 6.422 1.752 1.00 0.24 C ATOM 250 CG ARG A 16 -8.627 6.793 2.628 1.00 0.36 C ATOM 251 CD ARG A 16 -9.719 7.498 1.838 1.00 1.34 C ATOM 252 NE ARG A 16 -10.896 7.780 2.658 1.00 2.17 N ATOM 253 CZ ARG A 16 -11.876 8.606 2.297 1.00 3.16 C ATOM 254 NH1 ARG A 16 -11.818 9.239 1.133 1.00 3.58 N1+ ATOM 255 NH2 ARG A 16 -12.913 8.795 3.103 1.00 4.11 N ATOM 256 H ARG A 16 -7.684 3.655 1.751 1.00 0.20 H ATOM 257 HA ARG A 16 -8.590 5.861 0.037 1.00 0.21 H ATOM 258 HB2 ARG A 16 -6.687 5.972 2.380 1.00 0.30 H ATOM 259 HB3 ARG A 16 -7.044 7.324 1.315 1.00 0.30 H ATOM 260 HG2 ARG A 16 -9.037 5.893 3.055 1.00 0.83 H ATOM 261 HG3 ARG A 16 -8.286 7.446 3.418 1.00 0.87 H ATOM 262 HD2 ARG A 16 -9.327 8.429 1.456 1.00 1.89 H ATOM 263 HD3 ARG A 16 -10.012 6.867 1.012 1.00 1.81 H ATOM 264 HE ARG A 16 -10.962 7.318 3.526 1.00 2.42 H ATOM 265 HH11 ARG A 16 -11.042 9.093 0.518 1.00 3.48 H ATOM 266 HH12 ARG A 16 -12.559 9.860 0.859 1.00 4.31 H ATOM 267 HH21 ARG A 16 -12.963 8.310 3.982 1.00 4.27 H ATOM 268 HH22 ARG A 16 -13.653 9.422 2.841 1.00 4.85 H ATOM 269 N SER A 17 -6.620 5.778 -1.445 1.00 0.15 N ATOM 270 CA SER A 17 -5.613 5.545 -2.472 1.00 0.18 C ATOM 271 C SER A 17 -4.264 6.137 -2.087 1.00 0.15 C ATOM 272 O SER A 17 -3.217 5.541 -2.352 1.00 0.17 O ATOM 273 CB SER A 17 -6.095 6.140 -3.796 1.00 0.27 C ATOM 274 OG SER A 17 -6.642 7.434 -3.596 1.00 0.75 O ATOM 275 H SER A 17 -7.349 6.408 -1.639 1.00 0.18 H ATOM 276 HA SER A 17 -5.501 4.477 -2.588 1.00 0.21 H ATOM 277 HB2 SER A 17 -5.264 6.213 -4.480 1.00 0.72 H ATOM 278 HB3 SER A 17 -6.858 5.501 -4.219 1.00 0.59 H ATOM 279 HG SER A 17 -6.474 7.976 -4.378 1.00 1.36 H ATOM 280 N ASP A 18 -4.292 7.310 -1.465 1.00 0.14 N ATOM 281 CA ASP A 18 -3.066 7.960 -1.009 1.00 0.16 C ATOM 282 C ASP A 18 -2.462 7.186 0.150 1.00 0.11 C ATOM 283 O ASP A 18 -1.248 7.198 0.354 1.00 0.12 O ATOM 284 CB ASP A 18 -3.321 9.408 -0.581 1.00 0.25 C ATOM 285 CG ASP A 18 -3.735 10.298 -1.734 1.00 1.21 C ATOM 286 OD1 ASP A 18 -4.953 10.483 -1.947 1.00 1.91 O ATOM 287 OD2 ASP A 18 -2.844 10.813 -2.441 1.00 1.79 O1- ATOM 288 H ASP A 18 -5.158 7.753 -1.323 1.00 0.15 H ATOM 289 HA ASP A 18 -2.366 7.955 -1.830 1.00 0.20 H ATOM 290 HB2 ASP A 18 -4.104 9.425 0.160 1.00 0.97 H ATOM 291 HB3 ASP A 18 -2.418 9.808 -0.150 1.00 1.05 H ATOM 292 N GLU A 19 -3.322 6.507 0.898 1.00 0.10 N ATOM 293 CA GLU A 19 -2.886 5.690 2.016 1.00 0.10 C ATOM 294 C GLU A 19 -2.166 4.455 1.493 1.00 0.08 C ATOM 295 O GLU A 19 -1.086 4.105 1.973 1.00 0.10 O ATOM 296 CB GLU A 19 -4.080 5.286 2.882 1.00 0.16 C ATOM 297 CG GLU A 19 -3.692 4.859 4.283 1.00 0.63 C ATOM 298 CD GLU A 19 -2.973 5.957 5.039 1.00 0.72 C ATOM 299 OE1 GLU A 19 -3.629 6.944 5.437 1.00 0.94 O ATOM 300 OE2 GLU A 19 -1.749 5.835 5.250 1.00 1.38 O1- ATOM 301 H GLU A 19 -4.275 6.560 0.688 1.00 0.12 H ATOM 302 HA GLU A 19 -2.197 6.272 2.608 1.00 0.13 H ATOM 303 HB2 GLU A 19 -4.756 6.123 2.959 1.00 0.63 H ATOM 304 HB3 GLU A 19 -4.594 4.462 2.407 1.00 0.62 H ATOM 305 HG2 GLU A 19 -4.587 4.593 4.825 1.00 1.27 H ATOM 306 HG3 GLU A 19 -3.042 3.999 4.216 1.00 1.19 H ATOM 307 N LEU A 20 -2.765 3.806 0.495 1.00 0.07 N ATOM 308 CA LEU A 20 -2.117 2.693 -0.189 1.00 0.08 C ATOM 309 C LEU A 20 -0.804 3.147 -0.814 1.00 0.08 C ATOM 310 O LEU A 20 0.188 2.434 -0.767 1.00 0.09 O ATOM 311 CB LEU A 20 -3.035 2.110 -1.269 1.00 0.10 C ATOM 312 CG LEU A 20 -2.378 1.068 -2.185 1.00 0.10 C ATOM 313 CD1 LEU A 20 -1.991 -0.177 -1.401 1.00 0.13 C ATOM 314 CD2 LEU A 20 -3.300 0.703 -3.337 1.00 0.17 C ATOM 315 H LEU A 20 -3.671 4.075 0.223 1.00 0.08 H ATOM 316 HA LEU A 20 -1.904 1.930 0.545 1.00 0.10 H ATOM 317 HB2 LEU A 20 -3.881 1.648 -0.780 1.00 0.12 H ATOM 318 HB3 LEU A 20 -3.393 2.921 -1.883 1.00 0.11 H ATOM 319 HG LEU A 20 -1.474 1.489 -2.601 1.00 0.09 H ATOM 320 HD11 LEU A 20 -1.255 0.082 -0.654 1.00 0.84 H ATOM 321 HD12 LEU A 20 -1.577 -0.913 -2.074 1.00 0.94 H ATOM 322 HD13 LEU A 20 -2.865 -0.584 -0.918 1.00 0.89 H ATOM 323 HD21 LEU A 20 -4.176 0.204 -2.954 1.00 1.00 H ATOM 324 HD22 LEU A 20 -2.780 0.045 -4.018 1.00 1.07 H ATOM 325 HD23 LEU A 20 -3.596 1.601 -3.859 1.00 0.98 H ATOM 326 N GLN A 21 -0.814 4.340 -1.400 1.00 0.10 N ATOM 327 CA GLN A 21 0.388 4.918 -1.997 1.00 0.12 C ATOM 328 C GLN A 21 1.501 5.057 -0.959 1.00 0.09 C ATOM 329 O GLN A 21 2.642 4.633 -1.188 1.00 0.11 O ATOM 330 CB GLN A 21 0.065 6.279 -2.610 1.00 0.19 C ATOM 331 CG GLN A 21 1.285 7.032 -3.109 1.00 1.06 C ATOM 332 CD GLN A 21 0.923 8.351 -3.755 1.00 1.66 C ATOM 333 OE1 GLN A 21 0.847 9.383 -3.086 1.00 2.34 O ATOM 334 NE2 GLN A 21 0.703 8.327 -5.058 1.00 2.22 N ATOM 335 H GLN A 21 -1.658 4.842 -1.442 1.00 0.11 H ATOM 336 HA GLN A 21 0.721 4.249 -2.777 1.00 0.14 H ATOM 337 HB2 GLN A 21 -0.607 6.136 -3.444 1.00 0.71 H ATOM 338 HB3 GLN A 21 -0.426 6.889 -1.866 1.00 0.89 H ATOM 339 HG2 GLN A 21 1.940 7.225 -2.273 1.00 1.72 H ATOM 340 HG3 GLN A 21 1.799 6.421 -3.835 1.00 1.75 H ATOM 341 HE21 GLN A 21 0.790 7.467 -5.528 1.00 2.35 H ATOM 342 HE22 GLN A 21 0.454 9.165 -5.502 1.00 2.82 H ATOM 343 N ARG A 22 1.159 5.651 0.182 1.00 0.11 N ATOM 344 CA ARG A 22 2.094 5.775 1.292 1.00 0.15 C ATOM 345 C ARG A 22 2.637 4.407 1.666 1.00 0.11 C ATOM 346 O ARG A 22 3.848 4.211 1.766 1.00 0.15 O ATOM 347 CB ARG A 22 1.405 6.406 2.502 1.00 0.25 C ATOM 348 CG ARG A 22 2.247 6.372 3.769 1.00 0.37 C ATOM 349 CD ARG A 22 1.520 7.018 4.932 1.00 0.51 C ATOM 350 NE ARG A 22 1.376 8.459 4.748 1.00 1.09 N ATOM 351 CZ ARG A 22 0.233 9.123 4.895 1.00 1.51 C ATOM 352 NH1 ARG A 22 -0.894 8.477 5.172 1.00 1.42 N1+ ATOM 353 NH2 ARG A 22 0.214 10.439 4.744 1.00 2.47 N ATOM 354 H ARG A 22 0.251 6.012 0.280 1.00 0.13 H ATOM 355 HA ARG A 22 2.910 6.406 0.977 1.00 0.19 H ATOM 356 HB2 ARG A 22 1.175 7.436 2.274 1.00 0.29 H ATOM 357 HB3 ARG A 22 0.485 5.876 2.693 1.00 0.25 H ATOM 358 HG2 ARG A 22 2.465 5.344 4.017 1.00 0.34 H ATOM 359 HG3 ARG A 22 3.171 6.904 3.592 1.00 0.44 H ATOM 360 HD2 ARG A 22 0.539 6.575 5.019 1.00 1.09 H ATOM 361 HD3 ARG A 22 2.079 6.833 5.837 1.00 1.23 H ATOM 362 HE ARG A 22 2.192 8.963 4.518 1.00 1.66 H ATOM 363 HH11 ARG A 22 -1.751 8.984 5.282 1.00 1.85 H ATOM 364 HH12 ARG A 22 -0.897 7.472 5.270 1.00 1.43 H ATOM 365 HH21 ARG A 22 -0.642 10.946 4.854 1.00 2.80 H ATOM 366 HH22 ARG A 22 1.060 10.932 4.522 1.00 2.99 H ATOM 367 N HIS A 23 1.725 3.463 1.834 1.00 0.10 N ATOM 368 CA HIS A 23 2.083 2.101 2.181 1.00 0.10 C ATOM 369 C HIS A 23 3.033 1.499 1.140 1.00 0.11 C ATOM 370 O HIS A 23 3.981 0.798 1.484 1.00 0.17 O ATOM 371 CB HIS A 23 0.816 1.252 2.311 1.00 0.12 C ATOM 372 CG HIS A 23 1.103 -0.202 2.456 1.00 0.12 C ATOM 373 ND1 HIS A 23 1.226 -0.870 3.670 1.00 0.17 N ATOM 374 CD2 HIS A 23 1.378 -1.108 1.495 1.00 0.12 C ATOM 375 CE1 HIS A 23 1.586 -2.136 3.399 1.00 0.19 C ATOM 376 NE2 HIS A 23 1.684 -2.291 2.104 1.00 0.15 N ATOM 377 H HIS A 23 0.774 3.690 1.720 1.00 0.14 H ATOM 378 HA HIS A 23 2.586 2.126 3.135 1.00 0.13 H ATOM 379 HB2 HIS A 23 0.259 1.573 3.176 1.00 0.14 H ATOM 380 HB3 HIS A 23 0.210 1.386 1.427 1.00 0.12 H ATOM 381 HD1 HIS A 23 1.087 -0.484 4.563 1.00 0.21 H ATOM 382 HD2 HIS A 23 1.342 -0.942 0.430 1.00 0.12 H ATOM 383 HE1 HIS A 23 1.753 -2.906 4.135 1.00 0.24 H ATOM 384 N LYS A 24 2.773 1.768 -0.131 1.00 0.10 N ATOM 385 CA LYS A 24 3.639 1.288 -1.199 1.00 0.14 C ATOM 386 C LYS A 24 5.044 1.848 -1.037 1.00 0.15 C ATOM 387 O LYS A 24 6.034 1.175 -1.345 1.00 0.17 O ATOM 388 CB LYS A 24 3.083 1.663 -2.575 1.00 0.22 C ATOM 389 CG LYS A 24 1.842 0.881 -2.983 1.00 0.28 C ATOM 390 CD LYS A 24 2.134 -0.608 -3.092 1.00 1.08 C ATOM 391 CE LYS A 24 0.988 -1.358 -3.747 1.00 1.23 C ATOM 392 NZ LYS A 24 1.293 -2.805 -3.901 1.00 1.43 N1+ ATOM 393 H LYS A 24 1.975 2.296 -0.355 1.00 0.09 H ATOM 394 HA LYS A 24 3.689 0.214 -1.122 1.00 0.17 H ATOM 395 HB2 LYS A 24 2.832 2.713 -2.573 1.00 0.23 H ATOM 396 HB3 LYS A 24 3.848 1.489 -3.316 1.00 0.26 H ATOM 397 HG2 LYS A 24 1.072 1.032 -2.242 1.00 0.94 H ATOM 398 HG3 LYS A 24 1.498 1.242 -3.940 1.00 0.90 H ATOM 399 HD2 LYS A 24 3.026 -0.748 -3.682 1.00 1.64 H ATOM 400 HD3 LYS A 24 2.290 -1.005 -2.100 1.00 1.77 H ATOM 401 HE2 LYS A 24 0.105 -1.248 -3.136 1.00 1.51 H ATOM 402 HE3 LYS A 24 0.805 -0.931 -4.722 1.00 1.51 H ATOM 403 HZ1 LYS A 24 1.442 -3.242 -2.971 1.00 2.01 H ATOM 404 HZ2 LYS A 24 2.152 -2.931 -4.474 1.00 1.71 H ATOM 405 HZ3 LYS A 24 0.504 -3.290 -4.378 1.00 1.73 H ATOM 406 N ARG A 25 5.133 3.066 -0.513 1.00 0.17 N ATOM 407 CA ARG A 25 6.424 3.696 -0.270 1.00 0.22 C ATOM 408 C ARG A 25 7.155 2.999 0.875 1.00 0.25 C ATOM 409 O ARG A 25 8.333 3.247 1.116 1.00 0.39 O ATOM 410 CB ARG A 25 6.248 5.182 0.033 1.00 0.33 C ATOM 411 CG ARG A 25 5.595 5.953 -1.103 1.00 0.46 C ATOM 412 CD ARG A 25 5.519 7.440 -0.804 1.00 0.63 C ATOM 413 NE ARG A 25 4.923 8.182 -1.913 1.00 1.40 N ATOM 414 CZ ARG A 25 4.779 9.507 -1.941 1.00 2.00 C ATOM 415 NH1 ARG A 25 5.165 10.247 -0.911 1.00 1.85 N1+ ATOM 416 NH2 ARG A 25 4.239 10.087 -3.004 1.00 2.90 N ATOM 417 H ARG A 25 4.304 3.555 -0.272 1.00 0.16 H ATOM 418 HA ARG A 25 7.011 3.588 -1.169 1.00 0.26 H ATOM 419 HB2 ARG A 25 5.631 5.289 0.913 1.00 0.40 H ATOM 420 HB3 ARG A 25 7.217 5.618 0.225 1.00 0.34 H ATOM 421 HG2 ARG A 25 6.170 5.804 -2.004 1.00 0.50 H ATOM 422 HG3 ARG A 25 4.594 5.574 -1.249 1.00 0.50 H ATOM 423 HD2 ARG A 25 4.918 7.587 0.080 1.00 0.84 H ATOM 424 HD3 ARG A 25 6.518 7.811 -0.627 1.00 1.09 H ATOM 425 HE ARG A 25 4.623 7.660 -2.691 1.00 1.71 H ATOM 426 HH11 ARG A 25 5.054 11.243 -0.935 1.00 2.34 H ATOM 427 HH12 ARG A 25 5.569 9.814 -0.101 1.00 1.42 H ATOM 428 HH21 ARG A 25 3.945 9.530 -3.787 1.00 3.18 H ATOM 429 HH22 ARG A 25 4.135 11.083 -3.038 1.00 3.37 H ATOM 430 N THR A 26 6.444 2.123 1.574 1.00 0.25 N ATOM 431 CA THR A 26 7.032 1.319 2.630 1.00 0.32 C ATOM 432 C THR A 26 7.728 0.086 2.037 1.00 0.33 C ATOM 433 O THR A 26 8.600 -0.517 2.666 1.00 0.47 O ATOM 434 CB THR A 26 5.959 0.892 3.652 1.00 0.41 C ATOM 435 OG1 THR A 26 5.165 2.031 4.017 1.00 0.83 O ATOM 436 CG2 THR A 26 6.592 0.303 4.901 1.00 0.59 C ATOM 437 H THR A 26 5.486 2.017 1.377 1.00 0.26 H ATOM 438 HA THR A 26 7.768 1.926 3.139 1.00 0.36 H ATOM 439 HB THR A 26 5.323 0.147 3.198 1.00 0.80 H ATOM 440 HG1 THR A 26 5.527 2.822 3.597 1.00 0.87 H ATOM 441 HG21 THR A 26 7.222 1.044 5.368 1.00 1.25 H ATOM 442 HG22 THR A 26 7.187 -0.557 4.631 1.00 1.23 H ATOM 443 HG23 THR A 26 5.817 0.002 5.589 1.00 1.11 H ATOM 444 N HIS A 27 7.343 -0.287 0.815 1.00 0.28 N ATOM 445 CA HIS A 27 8.044 -1.343 0.090 1.00 0.30 C ATOM 446 C HIS A 27 9.143 -0.722 -0.760 1.00 0.34 C ATOM 447 O HIS A 27 10.221 -1.291 -0.929 1.00 0.38 O ATOM 448 CB HIS A 27 7.099 -2.145 -0.817 1.00 0.30 C ATOM 449 CG HIS A 27 6.054 -2.943 -0.099 1.00 0.27 C ATOM 450 ND1 HIS A 27 6.299 -4.128 0.592 1.00 0.36 N ATOM 451 CD2 HIS A 27 4.721 -2.727 -0.008 1.00 0.21 C ATOM 452 CE1 HIS A 27 5.121 -4.582 1.063 1.00 0.34 C ATOM 453 NE2 HIS A 27 4.167 -3.761 0.716 1.00 0.24 N ATOM 454 H HIS A 27 6.577 0.163 0.392 1.00 0.30 H ATOM 455 HA HIS A 27 8.493 -2.005 0.815 1.00 0.32 H ATOM 456 HB2 HIS A 27 6.586 -1.459 -1.475 1.00 0.29 H ATOM 457 HB3 HIS A 27 7.686 -2.831 -1.413 1.00 0.36 H ATOM 458 HD1 HIS A 27 7.178 -4.559 0.712 1.00 0.43 H ATOM 459 HD2 HIS A 27 4.177 -1.899 -0.435 1.00 0.20 H ATOM 460 HE1 HIS A 27 4.983 -5.492 1.630 1.00 0.42 H