ATOM 56 N LYS A 5 -2.714 15.661 7.026 1.00 0.00 N ATOM 57 CA LYS A 5 -1.663 14.939 7.760 1.00 0.00 C ATOM 58 C LYS A 5 -1.434 13.541 7.176 1.00 0.00 C ATOM 59 O LYS A 5 -2.376 12.809 6.864 1.00 0.00 O ATOM 60 CB LYS A 5 -1.993 14.852 9.280 1.00 0.00 C ATOM 61 CG LYS A 5 -1.537 16.085 10.083 1.00 0.00 C ATOM 62 CD LYS A 5 -1.908 16.015 11.582 1.00 0.00 C ATOM 63 CE LYS A 5 -1.433 17.255 12.363 1.00 0.00 C ATOM 64 NZ LYS A 5 -1.827 17.199 13.796 1.00 0.00 N1+ ATOM 65 H LYS A 5 -3.646 15.503 7.280 1.00 0.00 H ATOM 66 HA LYS A 5 -0.735 15.508 7.649 1.00 0.00 H ATOM 67 HB2 LYS A 5 -3.065 14.740 9.403 1.00 0.00 H ATOM 68 HB3 LYS A 5 -1.507 13.983 9.703 1.00 0.00 H ATOM 69 HG2 LYS A 5 -0.455 16.157 9.997 1.00 0.00 H ATOM 70 HG3 LYS A 5 -1.986 16.973 9.645 1.00 0.00 H ATOM 71 HD2 LYS A 5 -2.986 15.940 11.677 1.00 0.00 H ATOM 72 HD3 LYS A 5 -1.451 15.133 12.019 1.00 0.00 H ATOM 73 HE2 LYS A 5 -0.354 17.317 12.305 1.00 0.00 H ATOM 74 HE3 LYS A 5 -1.865 18.142 11.918 1.00 0.00 H ATOM 75 HZ1 LYS A 5 -1.426 16.350 14.244 1.00 0.00 H ATOM 76 HZ2 LYS A 5 -2.861 17.168 13.884 1.00 0.00 H ATOM 77 HZ3 LYS A 5 -1.474 18.040 14.298 1.00 0.00 H ATOM 78 N CYS A 6 -0.155 13.215 7.003 1.00 0.00 N ATOM 79 CA CYS A 6 0.314 11.854 6.760 1.00 0.00 C ATOM 80 C CYS A 6 0.561 11.225 8.135 1.00 0.00 C ATOM 81 O CYS A 6 1.539 11.584 8.786 1.00 0.00 O ATOM 82 CB CYS A 6 1.613 11.867 5.928 1.00 0.00 C ATOM 83 SG CYS A 6 2.365 10.224 5.741 1.00 0.00 S ATOM 84 H CYS A 6 0.515 13.931 7.058 1.00 0.00 H ATOM 85 HA CYS A 6 -0.455 11.302 6.222 1.00 0.00 H ATOM 86 HB2 CYS A 6 1.410 12.250 4.937 1.00 0.00 H ATOM 87 HB3 CYS A 6 2.338 12.513 6.405 1.00 0.00 H ATOM 88 N ASN A 7 -0.353 10.336 8.569 1.00 0.00 N ATOM 89 CA ASN A 7 -0.392 9.775 9.950 1.00 0.00 C ATOM 90 C ASN A 7 0.977 9.269 10.451 1.00 0.00 C ATOM 91 O ASN A 7 1.378 9.562 11.591 1.00 0.00 O ATOM 92 CB ASN A 7 -1.442 8.634 10.020 1.00 0.00 C ATOM 93 CG ASN A 7 -1.646 8.054 11.438 1.00 0.00 C ATOM 94 OD1 ASN A 7 -1.896 6.862 11.597 1.00 0.00 O ATOM 95 ND2 ASN A 7 -1.598 8.901 12.473 1.00 0.00 N ATOM 96 H ASN A 7 -1.060 10.067 7.946 1.00 0.00 H ATOM 97 HA ASN A 7 -0.715 10.577 10.602 1.00 0.00 H ATOM 98 HB2 ASN A 7 -2.395 9.018 9.675 1.00 0.00 H ATOM 99 HB3 ASN A 7 -1.137 7.825 9.356 1.00 0.00 H ATOM 100 HD21 ASN A 7 -1.435 9.848 12.293 1.00 0.00 H ATOM 101 HD22 ASN A 7 -1.733 8.539 13.378 1.00 0.00 H ATOM 102 N VAL A 8 1.686 8.551 9.569 1.00 0.00 N ATOM 103 CA VAL A 8 3.016 7.965 9.851 1.00 0.00 C ATOM 104 C VAL A 8 4.044 9.053 10.245 1.00 0.00 C ATOM 105 O VAL A 8 4.779 8.914 11.226 1.00 0.00 O ATOM 106 CB VAL A 8 3.561 7.192 8.590 1.00 0.00 C ATOM 107 CG1 VAL A 8 4.892 6.464 8.896 1.00 0.00 C ATOM 108 CG2 VAL A 8 2.501 6.219 8.029 1.00 0.00 C ATOM 109 H VAL A 8 1.294 8.394 8.689 1.00 0.00 H ATOM 110 HA VAL A 8 2.907 7.258 10.668 1.00 0.00 H ATOM 111 HB VAL A 8 3.767 7.933 7.813 1.00 0.00 H ATOM 112 HG11 VAL A 8 5.238 5.939 8.011 1.00 0.00 H ATOM 113 HG12 VAL A 8 4.751 5.753 9.698 1.00 0.00 H ATOM 114 HG13 VAL A 8 5.638 7.188 9.192 1.00 0.00 H ATOM 115 HG21 VAL A 8 2.260 5.463 8.764 1.00 0.00 H ATOM 116 HG22 VAL A 8 2.873 5.744 7.131 1.00 0.00 H ATOM 117 HG23 VAL A 8 1.604 6.776 7.784 1.00 0.00 H ATOM 118 N CYS A 9 4.043 10.137 9.467 1.00 0.00 N ATOM 119 CA CYS A 9 5.039 11.226 9.568 1.00 0.00 C ATOM 120 C CYS A 9 4.649 12.310 10.592 1.00 0.00 C ATOM 121 O CYS A 9 5.521 12.938 11.186 1.00 0.00 O ATOM 122 CB CYS A 9 5.195 11.886 8.197 1.00 0.00 C ATOM 123 SG CYS A 9 5.973 10.814 6.961 1.00 0.00 S ATOM 124 H CYS A 9 3.319 10.224 8.810 1.00 0.00 H ATOM 125 HA CYS A 9 5.992 10.794 9.851 1.00 0.00 H ATOM 126 HB2 CYS A 9 4.215 12.165 7.826 1.00 0.00 H ATOM 127 HB3 CYS A 9 5.797 12.774 8.292 1.00 0.00 H ATOM 128 N SER A 10 3.328 12.526 10.723 1.00 0.00 N ATOM 129 CA SER A 10 2.672 13.653 11.459 1.00 0.00 C ATOM 130 C SER A 10 2.944 15.031 10.792 1.00 0.00 C ATOM 131 O SER A 10 2.714 16.087 11.393 1.00 0.00 O ATOM 132 CB SER A 10 2.998 13.663 12.991 1.00 0.00 C ATOM 133 OG SER A 10 4.332 14.068 13.280 1.00 0.00 O ATOM 134 H SER A 10 2.739 11.903 10.280 1.00 0.00 H ATOM 135 HA SER A 10 1.605 13.474 11.357 1.00 0.00 H ATOM 136 HB2 SER A 10 2.321 14.345 13.490 1.00 0.00 H ATOM 137 HB3 SER A 10 2.846 12.670 13.390 1.00 0.00 H ATOM 138 HG SER A 10 4.927 13.329 13.127 1.00 0.00 H ATOM 139 N ARG A 11 3.410 14.993 9.522 1.00 0.00 N ATOM 140 CA ARG A 11 3.704 16.195 8.698 1.00 0.00 C ATOM 141 C ARG A 11 2.756 16.270 7.483 1.00 0.00 C ATOM 142 O ARG A 11 1.870 15.421 7.317 1.00 0.00 O ATOM 143 CB ARG A 11 5.196 16.164 8.245 1.00 0.00 C ATOM 144 CG ARG A 11 6.219 16.204 9.405 1.00 0.00 C ATOM 145 CD ARG A 11 6.110 17.493 10.239 1.00 0.00 C ATOM 146 NE ARG A 11 7.065 17.498 11.363 1.00 0.00 N ATOM 147 CZ ARG A 11 7.111 18.419 12.340 1.00 0.00 C ATOM 148 NH1 ARG A 11 6.311 19.475 12.317 1.00 0.00 N1+ ATOM 149 NH2 ARG A 11 7.980 18.287 13.327 1.00 0.00 N ATOM 150 H ARG A 11 3.581 14.120 9.122 1.00 0.00 H ATOM 151 HA ARG A 11 3.540 17.080 9.307 1.00 0.00 H ATOM 152 HB2 ARG A 11 5.368 15.255 7.672 1.00 0.00 H ATOM 153 HB3 ARG A 11 5.384 17.014 7.598 1.00 0.00 H ATOM 154 HG2 ARG A 11 6.053 15.351 10.054 1.00 0.00 H ATOM 155 HG3 ARG A 11 7.222 16.143 8.990 1.00 0.00 H ATOM 156 HD2 ARG A 11 6.311 18.342 9.598 1.00 0.00 H ATOM 157 HD3 ARG A 11 5.098 17.576 10.634 1.00 0.00 H ATOM 158 HE ARG A 11 7.701 16.749 11.404 1.00 0.00 H ATOM 159 HH11 ARG A 11 5.654 19.591 11.573 1.00 0.00 H ATOM 160 HH12 ARG A 11 6.369 20.164 13.043 1.00 0.00 H ATOM 161 HH21 ARG A 11 8.600 17.500 13.350 1.00 0.00 H ATOM 162 HH22 ARG A 11 8.022 18.976 14.056 1.00 0.00 H ATOM 163 N THR A 12 2.970 17.287 6.623 1.00 0.00 N ATOM 164 CA THR A 12 2.131 17.548 5.446 1.00 0.00 C ATOM 165 C THR A 12 2.956 18.162 4.299 1.00 0.00 C ATOM 166 O THR A 12 4.084 18.633 4.498 1.00 0.00 O ATOM 167 CB THR A 12 0.926 18.494 5.793 1.00 0.00 C ATOM 168 OG1 THR A 12 0.114 18.717 4.623 1.00 0.00 O ATOM 169 CG2 THR A 12 1.379 19.853 6.364 1.00 0.00 C ATOM 170 H THR A 12 3.738 17.872 6.777 1.00 0.00 H ATOM 171 HA THR A 12 1.724 16.598 5.101 1.00 0.00 H ATOM 172 HB THR A 12 0.317 17.997 6.538 1.00 0.00 H ATOM 173 HG1 THR A 12 0.538 19.376 4.063 1.00 0.00 H ATOM 174 HG21 THR A 12 1.988 20.372 5.639 1.00 0.00 H ATOM 175 HG22 THR A 12 1.955 19.699 7.272 1.00 0.00 H ATOM 176 HG23 THR A 12 0.511 20.457 6.595 1.00 0.00 H ATOM 177 N PHE A 13 2.365 18.126 3.095 1.00 0.00 N ATOM 178 CA PHE A 13 2.893 18.769 1.872 1.00 0.00 C ATOM 179 C PHE A 13 2.044 20.000 1.523 1.00 0.00 C ATOM 180 O PHE A 13 0.849 20.028 1.833 1.00 0.00 O ATOM 181 CB PHE A 13 2.906 17.739 0.701 1.00 0.00 C ATOM 182 CG PHE A 13 4.182 16.895 0.659 1.00 0.00 C ATOM 183 CD1 PHE A 13 4.446 15.954 1.653 1.00 0.00 C ATOM 184 CD2 PHE A 13 5.133 17.076 -0.348 1.00 0.00 C ATOM 185 CE1 PHE A 13 5.614 15.214 1.634 1.00 0.00 C ATOM 186 CE2 PHE A 13 6.301 16.336 -0.363 1.00 0.00 C ATOM 187 CZ PHE A 13 6.540 15.402 0.626 1.00 0.00 C ATOM 188 H PHE A 13 1.523 17.635 3.017 1.00 0.00 H ATOM 189 HA PHE A 13 3.914 19.103 2.070 1.00 0.00 H ATOM 190 HB2 PHE A 13 2.058 17.059 0.811 1.00 0.00 H ATOM 191 HB3 PHE A 13 2.802 18.256 -0.246 1.00 0.00 H ATOM 192 HD1 PHE A 13 3.727 15.801 2.452 1.00 0.00 H ATOM 193 HD2 PHE A 13 4.950 17.807 -1.127 1.00 0.00 H ATOM 194 HE1 PHE A 13 5.800 14.476 2.403 1.00 0.00 H ATOM 195 HE2 PHE A 13 7.026 16.486 -1.149 1.00 0.00 H ATOM 196 HZ PHE A 13 7.452 14.816 0.612 1.00 0.00 H ATOM 197 N PHE A 14 2.695 21.013 0.897 1.00 0.00 N ATOM 198 CA PHE A 14 2.053 22.261 0.409 1.00 0.00 C ATOM 199 C PHE A 14 0.844 22.002 -0.532 1.00 0.00 C ATOM 200 O PHE A 14 -0.047 22.852 -0.660 1.00 0.00 O ATOM 201 CB PHE A 14 3.124 23.152 -0.293 1.00 0.00 C ATOM 202 CG PHE A 14 2.638 24.547 -0.715 1.00 0.00 C ATOM 203 CD1 PHE A 14 2.501 25.566 0.229 1.00 0.00 C ATOM 204 CD2 PHE A 14 2.317 24.834 -2.042 1.00 0.00 C ATOM 205 CE1 PHE A 14 2.057 26.823 -0.139 1.00 0.00 C ATOM 206 CE2 PHE A 14 1.872 26.091 -2.407 1.00 0.00 C ATOM 207 CZ PHE A 14 1.745 27.086 -1.455 1.00 0.00 C ATOM 208 H PHE A 14 3.670 20.966 0.827 1.00 0.00 H ATOM 209 HA PHE A 14 1.692 22.787 1.287 1.00 0.00 H ATOM 210 HB2 PHE A 14 3.962 23.287 0.384 1.00 0.00 H ATOM 211 HB3 PHE A 14 3.487 22.637 -1.177 1.00 0.00 H ATOM 212 HD1 PHE A 14 2.747 25.365 1.265 1.00 0.00 H ATOM 213 HD2 PHE A 14 2.413 24.060 -2.793 1.00 0.00 H ATOM 214 HE1 PHE A 14 1.958 27.600 0.607 1.00 0.00 H ATOM 215 HE2 PHE A 14 1.629 26.302 -3.442 1.00 0.00 H ATOM 216 HZ PHE A 14 1.397 28.073 -1.744 1.00 0.00 H ATOM 217 N SER A 15 0.846 20.843 -1.195 1.00 0.00 N ATOM 218 CA SER A 15 -0.295 20.355 -1.977 1.00 0.00 C ATOM 219 C SER A 15 -0.893 19.147 -1.243 1.00 0.00 C ATOM 220 O SER A 15 -0.148 18.277 -0.771 1.00 0.00 O ATOM 221 CB SER A 15 0.166 19.953 -3.401 1.00 0.00 C ATOM 222 OG SER A 15 0.926 20.983 -4.003 1.00 0.00 O ATOM 223 H SER A 15 1.643 20.282 -1.141 1.00 0.00 H ATOM 224 HA SER A 15 -1.041 21.143 -2.049 1.00 0.00 H ATOM 225 HB2 SER A 15 0.783 19.063 -3.353 1.00 0.00 H ATOM 226 HB3 SER A 15 -0.697 19.754 -4.022 1.00 0.00 H ATOM 227 HG SER A 15 1.654 21.215 -3.417 1.00 0.00 H ATOM 228 N GLU A 16 -2.232 19.106 -1.155 1.00 0.00 N ATOM 229 CA GLU A 16 -2.973 17.952 -0.596 1.00 0.00 C ATOM 230 C GLU A 16 -2.749 16.712 -1.482 1.00 0.00 C ATOM 231 O GLU A 16 -2.617 15.600 -0.978 1.00 0.00 O ATOM 232 CB GLU A 16 -4.506 18.259 -0.445 1.00 0.00 C ATOM 233 CG GLU A 16 -5.312 18.435 -1.763 1.00 0.00 C ATOM 234 CD GLU A 16 -4.909 19.680 -2.573 1.00 0.00 C ATOM 235 OE1 GLU A 16 -5.414 20.777 -2.282 1.00 0.00 O ATOM 236 OE2 GLU A 16 -4.065 19.572 -3.491 1.00 0.00 O1- ATOM 237 H GLU A 16 -2.742 19.876 -1.482 1.00 0.00 H ATOM 238 HA GLU A 16 -2.561 17.753 0.388 1.00 0.00 H ATOM 239 HB2 GLU A 16 -4.958 17.449 0.110 1.00 0.00 H ATOM 240 HB3 GLU A 16 -4.617 19.172 0.138 1.00 0.00 H ATOM 241 HG2 GLU A 16 -5.169 17.550 -2.379 1.00 0.00 H ATOM 242 HG3 GLU A 16 -6.367 18.506 -1.513 1.00 0.00 H ATOM 243 N ASN A 17 -2.663 16.952 -2.809 1.00 0.00 N ATOM 244 CA ASN A 17 -2.404 15.914 -3.826 1.00 0.00 C ATOM 245 C ASN A 17 -0.938 15.447 -3.783 1.00 0.00 C ATOM 246 O ASN A 17 -0.626 14.314 -4.159 1.00 0.00 O ATOM 247 CB ASN A 17 -2.741 16.467 -5.235 1.00 0.00 C ATOM 248 CG ASN A 17 -4.218 16.819 -5.412 1.00 0.00 C ATOM 249 OD1 ASN A 17 -5.088 16.200 -4.804 1.00 0.00 O ATOM 250 ND2 ASN A 17 -4.516 17.800 -6.253 1.00 0.00 N ATOM 251 H ASN A 17 -2.774 17.880 -3.120 1.00 0.00 H ATOM 252 HA ASN A 17 -3.055 15.071 -3.612 1.00 0.00 H ATOM 253 HB2 ASN A 17 -2.146 17.356 -5.417 1.00 0.00 H ATOM 254 HB3 ASN A 17 -2.482 15.721 -5.979 1.00 0.00 H ATOM 255 HD21 ASN A 17 -3.778 18.250 -6.721 1.00 0.00 H ATOM 256 HD22 ASN A 17 -5.457 18.036 -6.371 1.00 0.00 H ATOM 257 N GLY A 18 -0.053 16.357 -3.341 1.00 0.00 N ATOM 258 CA GLY A 18 1.365 16.054 -3.130 1.00 0.00 C ATOM 259 C GLY A 18 1.552 15.150 -1.920 1.00 0.00 C ATOM 260 O GLY A 18 2.413 14.273 -1.914 1.00 0.00 O ATOM 261 H GLY A 18 -0.394 17.245 -3.126 1.00 0.00 H ATOM 262 HA2 GLY A 18 1.769 15.571 -4.014 1.00 0.00 H ATOM 263 HA3 GLY A 18 1.899 16.980 -2.963 1.00 0.00 H ATOM 264 N LEU A 19 0.702 15.376 -0.900 1.00 0.00 N ATOM 265 CA LEU A 19 0.659 14.578 0.335 1.00 0.00 C ATOM 266 C LEU A 19 0.106 13.166 0.046 1.00 0.00 C ATOM 267 O LEU A 19 0.637 12.170 0.547 1.00 0.00 O ATOM 268 CB LEU A 19 -0.194 15.351 1.390 1.00 0.00 C ATOM 269 CG LEU A 19 -0.231 14.816 2.874 1.00 0.00 C ATOM 270 CD1 LEU A 19 -1.209 13.624 3.081 1.00 0.00 C ATOM 271 CD2 LEU A 19 1.190 14.468 3.374 1.00 0.00 C ATOM 272 H LEU A 19 0.078 16.128 -0.979 1.00 0.00 H ATOM 273 HA LEU A 19 1.674 14.491 0.705 1.00 0.00 H ATOM 274 HB2 LEU A 19 0.182 16.364 1.412 1.00 0.00 H ATOM 275 HB3 LEU A 19 -1.210 15.405 1.022 1.00 0.00 H ATOM 276 HG LEU A 19 -0.596 15.615 3.509 1.00 0.00 H ATOM 277 HD11 LEU A 19 -0.885 12.774 2.490 1.00 0.00 H ATOM 278 HD12 LEU A 19 -2.202 13.913 2.771 1.00 0.00 H ATOM 279 HD13 LEU A 19 -1.233 13.344 4.129 1.00 0.00 H ATOM 280 HD21 LEU A 19 1.145 14.178 4.416 1.00 0.00 H ATOM 281 HD22 LEU A 19 1.836 15.331 3.276 1.00 0.00 H ATOM 282 HD23 LEU A 19 1.598 13.647 2.794 1.00 0.00 H ATOM 283 N ARG A 20 -0.988 13.111 -0.722 1.00 0.00 N ATOM 284 CA ARG A 20 -1.605 11.841 -1.180 1.00 0.00 C ATOM 285 C ARG A 20 -0.626 10.997 -2.025 1.00 0.00 C ATOM 286 O ARG A 20 -0.524 9.777 -1.837 1.00 0.00 O ATOM 287 CB ARG A 20 -2.914 12.111 -1.958 1.00 0.00 C ATOM 288 CG ARG A 20 -4.028 12.739 -1.087 1.00 0.00 C ATOM 289 CD ARG A 20 -5.421 12.570 -1.687 1.00 0.00 C ATOM 290 NE ARG A 20 -5.559 13.215 -3.003 1.00 0.00 N ATOM 291 CZ ARG A 20 -6.692 13.260 -3.719 1.00 0.00 C ATOM 292 NH1 ARG A 20 -7.824 12.780 -3.236 1.00 0.00 N1+ ATOM 293 NH2 ARG A 20 -6.689 13.810 -4.918 1.00 0.00 N ATOM 294 H ARG A 20 -1.427 13.957 -0.937 1.00 0.00 H ATOM 295 HA ARG A 20 -1.866 11.274 -0.291 1.00 0.00 H ATOM 296 HB2 ARG A 20 -2.696 12.785 -2.785 1.00 0.00 H ATOM 297 HB3 ARG A 20 -3.280 11.173 -2.363 1.00 0.00 H ATOM 298 HG2 ARG A 20 -4.019 12.269 -0.108 1.00 0.00 H ATOM 299 HG3 ARG A 20 -3.826 13.798 -0.966 1.00 0.00 H ATOM 300 HD2 ARG A 20 -5.613 11.508 -1.794 1.00 0.00 H ATOM 301 HD3 ARG A 20 -6.148 12.995 -1.006 1.00 0.00 H ATOM 302 HE ARG A 20 -4.749 13.608 -3.391 1.00 0.00 H ATOM 303 HH11 ARG A 20 -7.848 12.364 -2.328 1.00 0.00 H ATOM 304 HH12 ARG A 20 -8.663 12.824 -3.785 1.00 0.00 H ATOM 305 HH21 ARG A 20 -5.839 14.184 -5.301 1.00 0.00 H ATOM 306 HH22 ARG A 20 -7.537 13.855 -5.447 1.00 0.00 H ATOM 307 N GLU A 21 0.094 11.672 -2.945 1.00 0.00 N ATOM 308 CA GLU A 21 1.180 11.060 -3.744 1.00 0.00 C ATOM 309 C GLU A 21 2.270 10.496 -2.806 1.00 0.00 C ATOM 310 O GLU A 21 2.762 9.382 -2.992 1.00 0.00 O ATOM 311 CB GLU A 21 1.807 12.108 -4.710 1.00 0.00 C ATOM 312 CG GLU A 21 2.988 11.576 -5.560 1.00 0.00 C ATOM 313 CD GLU A 21 3.743 12.678 -6.325 1.00 0.00 C ATOM 314 OE1 GLU A 21 4.428 13.500 -5.680 1.00 0.00 O1- ATOM 315 OE2 GLU A 21 3.649 12.744 -7.569 1.00 0.00 O ATOM 316 H GLU A 21 -0.127 12.609 -3.092 1.00 0.00 H ATOM 317 HA GLU A 21 0.747 10.254 -4.325 1.00 0.00 H ATOM 318 HB2 GLU A 21 1.038 12.468 -5.387 1.00 0.00 H ATOM 319 HB3 GLU A 21 2.165 12.948 -4.122 1.00 0.00 H ATOM 320 HG2 GLU A 21 3.693 11.080 -4.899 1.00 0.00 H ATOM 321 HG3 GLU A 21 2.606 10.847 -6.267 1.00 0.00 H ATOM 322 N HIS A 22 2.599 11.296 -1.777 1.00 0.00 N ATOM 323 CA HIS A 22 3.617 10.974 -0.769 1.00 0.00 C ATOM 324 C HIS A 22 3.210 9.741 0.078 1.00 0.00 C ATOM 325 O HIS A 22 4.068 8.959 0.468 1.00 0.00 O ATOM 326 CB HIS A 22 3.859 12.226 0.131 1.00 0.00 C ATOM 327 CG HIS A 22 4.521 11.946 1.450 1.00 0.00 C ATOM 328 ND1 HIS A 22 5.865 11.779 1.611 1.00 0.00 N ATOM 329 CD2 HIS A 22 3.966 11.735 2.668 1.00 0.00 C ATOM 330 CE1 HIS A 22 6.082 11.464 2.891 1.00 0.00 C ATOM 331 NE2 HIS A 22 4.955 11.417 3.580 1.00 0.00 N ATOM 332 H HIS A 22 2.113 12.140 -1.683 1.00 0.00 H ATOM 333 HA HIS A 22 4.535 10.745 -1.298 1.00 0.00 H ATOM 334 HB2 HIS A 22 4.485 12.931 -0.401 1.00 0.00 H ATOM 335 HB3 HIS A 22 2.908 12.704 0.336 1.00 0.00 H ATOM 336 HD1 HIS A 22 6.548 11.880 0.914 1.00 0.00 H ATOM 337 HD2 HIS A 22 2.911 11.808 2.906 1.00 0.00 H ATOM 338 HE1 HIS A 22 7.059 11.272 3.313 1.00 0.00 H ATOM 339 N LEU A 23 1.904 9.597 0.379 1.00 0.00 N ATOM 340 CA LEU A 23 1.384 8.508 1.243 1.00 0.00 C ATOM 341 C LEU A 23 1.674 7.094 0.668 1.00 0.00 C ATOM 342 O LEU A 23 1.778 6.110 1.411 1.00 0.00 O ATOM 343 CB LEU A 23 -0.136 8.698 1.479 1.00 0.00 C ATOM 344 CG LEU A 23 -0.719 7.881 2.673 1.00 0.00 C ATOM 345 CD1 LEU A 23 -0.132 8.372 4.020 1.00 0.00 C ATOM 346 CD2 LEU A 23 -2.270 7.907 2.685 1.00 0.00 C ATOM 347 H LEU A 23 1.263 10.258 0.036 1.00 0.00 H ATOM 348 HA LEU A 23 1.883 8.589 2.198 1.00 0.00 H ATOM 349 HB2 LEU A 23 -0.327 9.754 1.656 1.00 0.00 H ATOM 350 HB3 LEU A 23 -0.664 8.412 0.574 1.00 0.00 H ATOM 351 HG LEU A 23 -0.403 6.851 2.553 1.00 0.00 H ATOM 352 HD11 LEU A 23 -0.539 7.783 4.833 1.00 0.00 H ATOM 353 HD12 LEU A 23 -0.389 9.415 4.173 1.00 0.00 H ATOM 354 HD13 LEU A 23 0.947 8.270 4.012 1.00 0.00 H ATOM 355 HD21 LEU A 23 -2.654 7.498 1.759 1.00 0.00 H ATOM 356 HD22 LEU A 23 -2.619 8.926 2.796 1.00 0.00 H ATOM 357 HD23 LEU A 23 -2.636 7.313 3.513 1.00 0.00 H ATOM 358 N GLN A 24 1.840 7.039 -0.666 1.00 0.00 N ATOM 359 CA GLN A 24 2.147 5.811 -1.423 1.00 0.00 C ATOM 360 C GLN A 24 3.480 5.152 -0.994 1.00 0.00 C ATOM 361 O GLN A 24 3.647 3.945 -1.167 1.00 0.00 O ATOM 362 CB GLN A 24 2.155 6.137 -2.936 1.00 0.00 C ATOM 363 CG GLN A 24 0.795 6.624 -3.476 1.00 0.00 C ATOM 364 CD GLN A 24 0.803 6.982 -4.965 1.00 0.00 C ATOM 365 OE1 GLN A 24 1.811 7.435 -5.513 1.00 0.00 O ATOM 366 NE2 GLN A 24 -0.310 6.756 -5.645 1.00 0.00 N ATOM 367 H GLN A 24 1.737 7.871 -1.168 1.00 0.00 H ATOM 368 HA GLN A 24 1.346 5.109 -1.228 1.00 0.00 H ATOM 369 HB2 GLN A 24 2.899 6.910 -3.130 1.00 0.00 H ATOM 370 HB3 GLN A 24 2.435 5.248 -3.488 1.00 0.00 H ATOM 371 HG2 GLN A 24 0.063 5.845 -3.310 1.00 0.00 H ATOM 372 HG3 GLN A 24 0.496 7.509 -2.916 1.00 0.00 H ATOM 373 HE21 GLN A 24 -1.079 6.382 -5.166 1.00 0.00 H ATOM 374 HE22 GLN A 24 -0.325 6.983 -6.600 1.00 0.00 H ATOM 375 N THR A 25 4.389 5.945 -0.383 1.00 0.00 N ATOM 376 CA THR A 25 5.718 5.473 0.057 1.00 0.00 C ATOM 377 C THR A 25 5.605 4.549 1.293 1.00 0.00 C ATOM 378 O THR A 25 6.543 3.821 1.620 1.00 0.00 O ATOM 379 CB THR A 25 6.647 6.679 0.409 1.00 0.00 C ATOM 380 OG1 THR A 25 6.087 7.429 1.504 1.00 0.00 O ATOM 381 CG2 THR A 25 6.876 7.616 -0.790 1.00 0.00 C ATOM 382 H THR A 25 4.129 6.868 -0.184 1.00 0.00 H ATOM 383 HA THR A 25 6.167 4.914 -0.759 1.00 0.00 H ATOM 384 HB THR A 25 7.605 6.291 0.724 1.00 0.00 H ATOM 385 HG1 THR A 25 5.887 8.325 1.209 1.00 0.00 H ATOM 386 HG21 THR A 25 5.930 8.033 -1.110 1.00 0.00 H ATOM 387 HG22 THR A 25 7.317 7.064 -1.608 1.00 0.00 H ATOM 388 HG23 THR A 25 7.540 8.422 -0.504 1.00 0.00 H ATOM 389 N HIS A 26 4.440 4.602 1.976 1.00 0.00 N ATOM 390 CA HIS A 26 4.199 3.863 3.236 1.00 0.00 C ATOM 391 C HIS A 26 3.300 2.632 3.014 1.00 0.00 C ATOM 392 O HIS A 26 2.895 1.982 3.987 1.00 0.00 O ATOM 393 CB HIS A 26 3.533 4.797 4.282 1.00 0.00 C ATOM 394 CG HIS A 26 4.301 6.051 4.575 1.00 0.00 C ATOM 395 ND1 HIS A 26 5.387 6.102 5.407 1.00 0.00 N ATOM 396 CD2 HIS A 26 4.084 7.322 4.166 1.00 0.00 C ATOM 397 CE1 HIS A 26 5.790 7.370 5.473 1.00 0.00 C ATOM 398 NE2 HIS A 26 5.025 8.164 4.744 1.00 0.00 N ATOM 399 H HIS A 26 3.714 5.159 1.618 1.00 0.00 H ATOM 400 HA HIS A 26 5.154 3.523 3.629 1.00 0.00 H ATOM 401 HB2 HIS A 26 2.556 5.090 3.924 1.00 0.00 H ATOM 402 HB3 HIS A 26 3.415 4.256 5.215 1.00 0.00 H ATOM 403 HD1 HIS A 26 5.799 5.340 5.869 1.00 0.00 H ATOM 404 HD2 HIS A 26 3.308 7.647 3.485 1.00 0.00 H ATOM 405 HE1 HIS A 26 6.641 7.706 6.049 1.00 0.00 H ATOM 501 N TYR A 33 14.863 -3.712 -7.113 1.00 0.00 N ATOM 502 CA TYR A 33 16.074 -4.496 -7.409 1.00 0.00 C ATOM 503 C TYR A 33 16.408 -4.407 -8.912 1.00 0.00 C ATOM 504 O TYR A 33 15.504 -4.389 -9.762 1.00 0.00 O ATOM 505 CB TYR A 33 15.903 -5.981 -6.965 1.00 0.00 C ATOM 506 CG TYR A 33 17.241 -6.692 -6.633 1.00 0.00 C ATOM 507 CD1 TYR A 33 17.847 -6.547 -5.383 1.00 0.00 C ATOM 508 CD2 TYR A 33 17.903 -7.492 -7.568 1.00 0.00 C ATOM 509 CE1 TYR A 33 19.043 -7.186 -5.091 1.00 0.00 C ATOM 510 CE2 TYR A 33 19.094 -8.126 -7.273 1.00 0.00 C ATOM 511 CZ TYR A 33 19.659 -7.968 -6.042 1.00 0.00 C ATOM 512 OH TYR A 33 20.839 -8.602 -5.746 1.00 0.00 O ATOM 513 H TYR A 33 13.999 -4.180 -7.082 1.00 0.00 H ATOM 514 HA TYR A 33 16.894 -4.059 -6.845 1.00 0.00 H ATOM 515 HB2 TYR A 33 15.273 -6.023 -6.087 1.00 0.00 H ATOM 516 HB3 TYR A 33 15.405 -6.540 -7.753 1.00 0.00 H ATOM 517 HD1 TYR A 33 17.366 -5.938 -4.629 1.00 0.00 H ATOM 518 HD2 TYR A 33 17.471 -7.620 -8.548 1.00 0.00 H ATOM 519 HE1 TYR A 33 19.497 -7.059 -4.117 1.00 0.00 H ATOM 520 HE2 TYR A 33 19.578 -8.741 -8.023 1.00 0.00 H ATOM 521 HH TYR A 33 20.743 -9.076 -4.913 1.00 0.00 H ATOM 522 N MET A 34 17.711 -4.350 -9.213 1.00 0.00 N ATOM 523 CA MET A 34 18.250 -4.247 -10.577 1.00 0.00 C ATOM 524 C MET A 34 18.665 -5.649 -11.030 1.00 0.00 C ATOM 525 O MET A 34 19.190 -6.421 -10.226 1.00 0.00 O ATOM 526 CB MET A 34 19.472 -3.283 -10.568 1.00 0.00 C ATOM 527 CG MET A 34 20.150 -3.050 -11.927 1.00 0.00 C ATOM 528 SD MET A 34 21.518 -1.864 -11.847 1.00 0.00 S ATOM 529 CE MET A 34 20.692 -0.373 -11.287 1.00 0.00 C ATOM 530 H MET A 34 18.360 -4.432 -8.480 1.00 0.00 H ATOM 531 HA MET A 34 17.476 -3.859 -11.240 1.00 0.00 H ATOM 532 HB2 MET A 34 19.145 -2.318 -10.194 1.00 0.00 H ATOM 533 HB3 MET A 34 20.217 -3.672 -9.889 1.00 0.00 H ATOM 534 HG2 MET A 34 20.539 -3.992 -12.297 1.00 0.00 H ATOM 535 HG3 MET A 34 19.411 -2.679 -12.629 1.00 0.00 H ATOM 536 HE1 MET A 34 19.909 -0.109 -11.983 1.00 0.00 H ATOM 537 HE2 MET A 34 21.407 0.434 -11.227 1.00 0.00 H ATOM 538 HE3 MET A 34 20.266 -0.545 -10.310 1.00 0.00 H ATOM 539 N CYS A 35 18.415 -5.991 -12.298 1.00 0.00 N ATOM 540 CA CYS A 35 18.761 -7.314 -12.836 1.00 0.00 C ATOM 541 C CYS A 35 20.288 -7.480 -12.930 1.00 0.00 C ATOM 542 O CYS A 35 20.949 -6.624 -13.524 1.00 0.00 O ATOM 543 CB CYS A 35 18.134 -7.509 -14.216 1.00 0.00 C ATOM 544 SG CYS A 35 18.361 -9.170 -14.914 1.00 0.00 S ATOM 545 H CYS A 35 17.986 -5.340 -12.888 1.00 0.00 H ATOM 546 HA CYS A 35 18.350 -8.065 -12.169 1.00 0.00 H ATOM 547 HB2 CYS A 35 17.083 -7.299 -14.171 1.00 0.00 H ATOM 548 HB3 CYS A 35 18.579 -6.815 -14.908 1.00 0.00 H ATOM 549 N PRO A 36 20.874 -8.575 -12.344 1.00 0.00 N ATOM 550 CA PRO A 36 22.318 -8.887 -12.484 1.00 0.00 C ATOM 551 C PRO A 36 22.725 -9.072 -13.958 1.00 0.00 C ATOM 552 O PRO A 36 23.800 -8.646 -14.371 1.00 0.00 O ATOM 553 CB PRO A 36 22.489 -10.202 -11.667 1.00 0.00 C ATOM 554 CG PRO A 36 21.339 -10.195 -10.709 1.00 0.00 C ATOM 555 CD PRO A 36 20.196 -9.568 -11.465 1.00 0.00 C ATOM 556 HA PRO A 36 22.927 -8.105 -12.046 1.00 0.00 H ATOM 557 HB2 PRO A 36 22.450 -11.068 -12.329 1.00 0.00 H ATOM 558 HB3 PRO A 36 23.441 -10.197 -11.146 1.00 0.00 H ATOM 559 HG2 PRO A 36 21.089 -11.213 -10.415 1.00 0.00 H ATOM 560 HG3 PRO A 36 21.584 -9.608 -9.830 1.00 0.00 H ATOM 561 HD2 PRO A 36 19.667 -10.310 -12.059 1.00 0.00 H ATOM 562 HD3 PRO A 36 19.507 -9.080 -10.781 1.00 0.00 H ATOM 563 N ILE A 37 21.820 -9.688 -14.744 1.00 0.00 N ATOM 564 CA ILE A 37 22.096 -10.085 -16.124 1.00 0.00 C ATOM 565 C ILE A 37 21.875 -8.918 -17.129 1.00 0.00 C ATOM 566 O ILE A 37 22.787 -8.584 -17.891 1.00 0.00 O ATOM 567 CB ILE A 37 21.159 -11.299 -16.486 1.00 0.00 C ATOM 568 CG1 ILE A 37 21.287 -12.443 -15.416 1.00 0.00 C ATOM 569 CG2 ILE A 37 21.458 -11.834 -17.905 1.00 0.00 C ATOM 570 CD1 ILE A 37 20.325 -13.605 -15.597 1.00 0.00 C ATOM 571 H ILE A 37 20.952 -9.929 -14.369 1.00 0.00 H ATOM 572 HA ILE A 37 23.130 -10.421 -16.185 1.00 0.00 H ATOM 573 HB ILE A 37 20.130 -10.932 -16.483 1.00 0.00 H ATOM 574 HG12 ILE A 37 22.287 -12.854 -15.453 1.00 0.00 H ATOM 575 HG13 ILE A 37 21.120 -12.029 -14.428 1.00 0.00 H ATOM 576 HG21 ILE A 37 20.798 -12.662 -18.131 1.00 0.00 H ATOM 577 HG22 ILE A 37 22.485 -12.174 -17.963 1.00 0.00 H ATOM 578 HG23 ILE A 37 21.305 -11.049 -18.630 1.00 0.00 H ATOM 579 HD11 ILE A 37 20.501 -14.338 -14.824 1.00 0.00 H ATOM 580 HD12 ILE A 37 20.485 -14.061 -16.562 1.00 0.00 H ATOM 581 HD13 ILE A 37 19.303 -13.253 -15.529 1.00 0.00 H ATOM 582 N CYS A 38 20.670 -8.284 -17.118 1.00 0.00 N ATOM 583 CA CYS A 38 20.330 -7.244 -18.127 1.00 0.00 C ATOM 584 C CYS A 38 19.779 -5.918 -17.546 1.00 0.00 C ATOM 585 O CYS A 38 19.263 -5.088 -18.300 1.00 0.00 O ATOM 586 CB CYS A 38 19.336 -7.850 -19.135 1.00 0.00 C ATOM 587 SG CYS A 38 17.618 -8.013 -18.531 1.00 0.00 S ATOM 588 H CYS A 38 19.979 -8.619 -16.539 1.00 0.00 H ATOM 589 HA CYS A 38 21.239 -6.997 -18.665 1.00 0.00 H ATOM 590 HB2 CYS A 38 19.306 -7.227 -20.003 1.00 0.00 H ATOM 591 HB3 CYS A 38 19.680 -8.834 -19.432 1.00 0.00 H ATOM 592 N GLY A 39 19.890 -5.727 -16.222 1.00 0.00 N ATOM 593 CA GLY A 39 19.549 -4.457 -15.543 1.00 0.00 C ATOM 594 C GLY A 39 18.102 -3.957 -15.666 1.00 0.00 C ATOM 595 O GLY A 39 17.856 -2.757 -15.525 1.00 0.00 O ATOM 596 H GLY A 39 20.254 -6.442 -15.669 1.00 0.00 H ATOM 597 HA2 GLY A 39 19.720 -4.618 -14.489 1.00 0.00 H ATOM 598 HA3 GLY A 39 20.236 -3.691 -15.884 1.00 0.00 H ATOM 599 N GLU A 40 17.152 -4.871 -15.945 1.00 0.00 N ATOM 600 CA GLU A 40 15.707 -4.584 -15.842 1.00 0.00 C ATOM 601 C GLU A 40 15.327 -4.220 -14.397 1.00 0.00 C ATOM 602 O GLU A 40 15.752 -4.899 -13.450 1.00 0.00 O ATOM 603 CB GLU A 40 14.889 -5.799 -16.334 1.00 0.00 C ATOM 604 CG GLU A 40 15.153 -6.182 -17.799 1.00 0.00 C ATOM 605 CD GLU A 40 14.751 -5.094 -18.811 1.00 0.00 C ATOM 606 OE1 GLU A 40 13.564 -5.042 -19.198 1.00 0.00 O ATOM 607 OE2 GLU A 40 15.617 -4.303 -19.231 1.00 0.00 O1- ATOM 608 H GLU A 40 17.425 -5.725 -16.318 1.00 0.00 H ATOM 609 HA GLU A 40 15.488 -3.736 -16.493 1.00 0.00 H ATOM 610 HB2 GLU A 40 15.126 -6.658 -15.713 1.00 0.00 H ATOM 611 HB3 GLU A 40 13.835 -5.582 -16.232 1.00 0.00 H ATOM 612 HG2 GLU A 40 16.213 -6.388 -17.909 1.00 0.00 H ATOM 613 HG3 GLU A 40 14.608 -7.094 -18.024 1.00 0.00 H ATOM 614 N ARG A 41 14.548 -3.133 -14.249 1.00 0.00 N ATOM 615 CA ARG A 41 14.089 -2.633 -12.945 1.00 0.00 C ATOM 616 C ARG A 41 12.752 -3.289 -12.546 1.00 0.00 C ATOM 617 O ARG A 41 11.784 -3.291 -13.318 1.00 0.00 O ATOM 618 CB ARG A 41 13.968 -1.072 -12.965 1.00 0.00 C ATOM 619 CG ARG A 41 12.997 -0.484 -14.014 1.00 0.00 C ATOM 620 CD ARG A 41 12.887 1.054 -13.947 1.00 0.00 C ATOM 621 NE ARG A 41 12.460 1.528 -12.613 1.00 0.00 N ATOM 622 CZ ARG A 41 12.014 2.758 -12.332 1.00 0.00 C ATOM 623 NH1 ARG A 41 11.845 3.656 -13.285 1.00 0.00 N1+ ATOM 624 NH2 ARG A 41 11.738 3.080 -11.081 1.00 0.00 N ATOM 625 H ARG A 41 14.269 -2.647 -15.053 1.00 0.00 H ATOM 626 HA ARG A 41 14.843 -2.903 -12.203 1.00 0.00 H ATOM 627 HB2 ARG A 41 13.645 -0.737 -11.983 1.00 0.00 H ATOM 628 HB3 ARG A 41 14.955 -0.658 -13.154 1.00 0.00 H ATOM 629 HG2 ARG A 41 13.339 -0.763 -15.001 1.00 0.00 H ATOM 630 HG3 ARG A 41 12.011 -0.910 -13.851 1.00 0.00 H ATOM 631 HD2 ARG A 41 13.851 1.489 -14.177 1.00 0.00 H ATOM 632 HD3 ARG A 41 12.163 1.386 -14.687 1.00 0.00 H ATOM 633 HE ARG A 41 12.546 0.892 -11.873 1.00 0.00 H ATOM 634 HH11 ARG A 41 12.054 3.429 -14.238 1.00 0.00 H ATOM 635 HH12 ARG A 41 11.510 4.572 -13.055 1.00 0.00 H ATOM 636 HH21 ARG A 41 11.867 2.411 -10.345 1.00 0.00 H ATOM 637 HH22 ARG A 41 11.405 4.004 -10.863 1.00 0.00 H ATOM 638 N PHE A 42 12.726 -3.888 -11.346 1.00 0.00 N ATOM 639 CA PHE A 42 11.514 -4.479 -10.745 1.00 0.00 C ATOM 640 C PHE A 42 11.378 -4.003 -9.290 1.00 0.00 C ATOM 641 O PHE A 42 12.402 -3.824 -8.623 1.00 0.00 O ATOM 642 CB PHE A 42 11.558 -6.030 -10.817 1.00 0.00 C ATOM 643 CG PHE A 42 11.272 -6.580 -12.222 1.00 0.00 C ATOM 644 CD1 PHE A 42 12.282 -6.709 -13.170 1.00 0.00 C ATOM 645 CD2 PHE A 42 9.976 -6.934 -12.596 1.00 0.00 C ATOM 646 CE1 PHE A 42 12.008 -7.171 -14.438 1.00 0.00 C ATOM 647 CE2 PHE A 42 9.706 -7.402 -13.866 1.00 0.00 C ATOM 648 CZ PHE A 42 10.721 -7.522 -14.786 1.00 0.00 C ATOM 649 H PHE A 42 13.561 -3.949 -10.837 1.00 0.00 H ATOM 650 HA PHE A 42 10.645 -4.123 -11.307 1.00 0.00 H ATOM 651 HB2 PHE A 42 12.531 -6.376 -10.492 1.00 0.00 H ATOM 652 HB3 PHE A 42 10.812 -6.440 -10.140 1.00 0.00 H ATOM 653 HD1 PHE A 42 13.296 -6.437 -12.906 1.00 0.00 H ATOM 654 HD2 PHE A 42 9.170 -6.837 -11.876 1.00 0.00 H ATOM 655 HE1 PHE A 42 12.807 -7.270 -15.163 1.00 0.00 H ATOM 656 HE2 PHE A 42 8.698 -7.681 -14.136 1.00 0.00 H ATOM 657 HZ PHE A 42 10.511 -7.893 -15.784 1.00 0.00 H ATOM 658 N PRO A 43 10.111 -3.815 -8.773 1.00 0.00 N ATOM 659 CA PRO A 43 9.841 -3.196 -7.450 1.00 0.00 C ATOM 660 C PRO A 43 10.462 -3.933 -6.244 1.00 0.00 C ATOM 661 O PRO A 43 10.640 -3.319 -5.188 1.00 0.00 O ATOM 662 CB PRO A 43 8.287 -3.202 -7.352 1.00 0.00 C ATOM 663 CG PRO A 43 7.849 -4.260 -8.312 1.00 0.00 C ATOM 664 CD PRO A 43 8.830 -4.176 -9.451 1.00 0.00 C ATOM 665 HA PRO A 43 10.191 -2.167 -7.438 1.00 0.00 H ATOM 666 HB2 PRO A 43 7.962 -3.425 -6.340 1.00 0.00 H ATOM 667 HB3 PRO A 43 7.896 -2.226 -7.639 1.00 0.00 H ATOM 668 HG2 PRO A 43 7.891 -5.240 -7.840 1.00 0.00 H ATOM 669 HG3 PRO A 43 6.838 -4.056 -8.658 1.00 0.00 H ATOM 670 HD2 PRO A 43 8.914 -5.133 -9.958 1.00 0.00 H ATOM 671 HD3 PRO A 43 8.539 -3.407 -10.155 1.00 0.00 H ATOM 672 N SER A 44 10.819 -5.224 -6.397 1.00 0.00 N ATOM 673 CA SER A 44 11.235 -6.053 -5.248 1.00 0.00 C ATOM 674 C SER A 44 12.223 -7.141 -5.662 1.00 0.00 C ATOM 675 O SER A 44 12.456 -7.391 -6.855 1.00 0.00 O ATOM 676 CB SER A 44 9.988 -6.694 -4.578 1.00 0.00 C ATOM 677 OG SER A 44 9.246 -7.480 -5.503 1.00 0.00 O ATOM 678 H SER A 44 10.836 -5.624 -7.301 1.00 0.00 H ATOM 679 HA SER A 44 11.729 -5.409 -4.522 1.00 0.00 H ATOM 680 HB2 SER A 44 10.296 -7.327 -3.754 1.00 0.00 H ATOM 681 HB3 SER A 44 9.345 -5.913 -4.197 1.00 0.00 H ATOM 682 HG SER A 44 8.303 -7.325 -5.364 1.00 0.00 H ATOM 683 N LEU A 45 12.762 -7.814 -4.631 1.00 0.00 N ATOM 684 CA LEU A 45 13.663 -8.977 -4.766 1.00 0.00 C ATOM 685 C LEU A 45 12.789 -10.259 -4.805 1.00 0.00 C ATOM 686 O LEU A 45 13.096 -11.278 -4.176 1.00 0.00 O ATOM 687 CB LEU A 45 14.674 -8.982 -3.555 1.00 0.00 C ATOM 688 CG LEU A 45 16.150 -9.423 -3.835 1.00 0.00 C ATOM 689 CD1 LEU A 45 17.010 -9.328 -2.552 1.00 0.00 C ATOM 690 CD2 LEU A 45 16.232 -10.835 -4.451 1.00 0.00 C ATOM 691 H LEU A 45 12.538 -7.506 -3.722 1.00 0.00 H ATOM 692 HA LEU A 45 14.206 -8.891 -5.706 1.00 0.00 H ATOM 693 HB2 LEU A 45 14.714 -7.974 -3.151 1.00 0.00 H ATOM 694 HB3 LEU A 45 14.273 -9.623 -2.775 1.00 0.00 H ATOM 695 HG LEU A 45 16.577 -8.736 -4.554 1.00 0.00 H ATOM 696 HD11 LEU A 45 16.997 -8.311 -2.179 1.00 0.00 H ATOM 697 HD12 LEU A 45 18.032 -9.605 -2.772 1.00 0.00 H ATOM 698 HD13 LEU A 45 16.617 -9.992 -1.791 1.00 0.00 H ATOM 699 HD21 LEU A 45 17.267 -11.089 -4.640 1.00 0.00 H ATOM 700 HD22 LEU A 45 15.690 -10.856 -5.386 1.00 0.00 H ATOM 701 HD23 LEU A 45 15.800 -11.563 -3.772 1.00 0.00 H ATOM 702 N LEU A 46 11.699 -10.181 -5.578 1.00 0.00 N ATOM 703 CA LEU A 46 10.696 -11.245 -5.743 1.00 0.00 C ATOM 704 C LEU A 46 10.294 -11.206 -7.218 1.00 0.00 C ATOM 705 O LEU A 46 10.373 -12.208 -7.932 1.00 0.00 O ATOM 706 CB LEU A 46 9.415 -11.053 -4.847 1.00 0.00 C ATOM 707 CG LEU A 46 9.523 -11.313 -3.297 1.00 0.00 C ATOM 708 CD1 LEU A 46 10.252 -12.638 -2.990 1.00 0.00 C ATOM 709 CD2 LEU A 46 10.152 -10.121 -2.539 1.00 0.00 C ATOM 710 H LEU A 46 11.616 -9.406 -6.163 1.00 0.00 H ATOM 711 HA LEU A 46 11.164 -12.205 -5.526 1.00 0.00 H ATOM 712 HB2 LEU A 46 9.066 -10.038 -4.988 1.00 0.00 H ATOM 713 HB3 LEU A 46 8.644 -11.717 -5.232 1.00 0.00 H ATOM 714 HG LEU A 46 8.514 -11.427 -2.909 1.00 0.00 H ATOM 715 HD11 LEU A 46 10.266 -12.809 -1.922 1.00 0.00 H ATOM 716 HD12 LEU A 46 11.270 -12.591 -3.355 1.00 0.00 H ATOM 717 HD13 LEU A 46 9.738 -13.458 -3.474 1.00 0.00 H ATOM 718 HD21 LEU A 46 11.165 -9.960 -2.879 1.00 0.00 H ATOM 719 HD22 LEU A 46 10.158 -10.321 -1.475 1.00 0.00 H ATOM 720 HD23 LEU A 46 9.570 -9.227 -2.724 1.00 0.00 H ATOM 721 N THR A 47 9.887 -10.001 -7.652 1.00 0.00 N ATOM 722 CA THR A 47 9.569 -9.702 -9.049 1.00 0.00 C ATOM 723 C THR A 47 10.824 -9.722 -9.941 1.00 0.00 C ATOM 724 O THR A 47 10.744 -10.078 -11.124 1.00 0.00 O ATOM 725 CB THR A 47 8.844 -8.324 -9.141 1.00 0.00 C ATOM 726 OG1 THR A 47 9.602 -7.331 -8.413 1.00 0.00 O ATOM 727 CG2 THR A 47 7.413 -8.401 -8.576 1.00 0.00 C ATOM 728 H THR A 47 9.748 -9.287 -6.990 1.00 0.00 H ATOM 729 HA THR A 47 8.887 -10.475 -9.407 1.00 0.00 H ATOM 730 HB THR A 47 8.790 -8.018 -10.182 1.00 0.00 H ATOM 731 HG1 THR A 47 9.077 -7.000 -7.678 1.00 0.00 H ATOM 732 HG21 THR A 47 6.931 -7.435 -8.660 1.00 0.00 H ATOM 733 HG22 THR A 47 7.447 -8.691 -7.533 1.00 0.00 H ATOM 734 HG23 THR A 47 6.838 -9.135 -9.130 1.00 0.00 H ATOM 735 N LEU A 48 11.981 -9.311 -9.385 1.00 0.00 N ATOM 736 CA LEU A 48 13.266 -9.450 -10.087 1.00 0.00 C ATOM 737 C LEU A 48 13.667 -10.935 -10.160 1.00 0.00 C ATOM 738 O LEU A 48 14.188 -11.387 -11.183 1.00 0.00 O ATOM 739 CB LEU A 48 14.361 -8.579 -9.395 1.00 0.00 C ATOM 740 CG LEU A 48 15.649 -8.242 -10.236 1.00 0.00 C ATOM 741 CD1 LEU A 48 16.633 -9.436 -10.358 1.00 0.00 C ATOM 742 CD2 LEU A 48 15.274 -7.681 -11.625 1.00 0.00 C ATOM 743 H LEU A 48 11.954 -8.831 -8.523 1.00 0.00 H ATOM 744 HA LEU A 48 13.119 -9.086 -11.100 1.00 0.00 H ATOM 745 HB2 LEU A 48 13.905 -7.634 -9.091 1.00 0.00 H ATOM 746 HB3 LEU A 48 14.671 -9.087 -8.487 1.00 0.00 H ATOM 747 HG LEU A 48 16.190 -7.455 -9.720 1.00 0.00 H ATOM 748 HD11 LEU A 48 16.161 -10.260 -10.879 1.00 0.00 H ATOM 749 HD12 LEU A 48 16.931 -9.765 -9.370 1.00 0.00 H ATOM 750 HD13 LEU A 48 17.515 -9.125 -10.904 1.00 0.00 H ATOM 751 HD21 LEU A 48 16.172 -7.405 -12.160 1.00 0.00 H ATOM 752 HD22 LEU A 48 14.650 -6.803 -11.511 1.00 0.00 H ATOM 753 HD23 LEU A 48 14.738 -8.428 -12.197 1.00 0.00 H ATOM 754 N THR A 49 13.403 -11.674 -9.070 1.00 0.00 N ATOM 755 CA THR A 49 13.756 -13.098 -8.950 1.00 0.00 C ATOM 756 C THR A 49 13.019 -13.949 -10.004 1.00 0.00 C ATOM 757 O THR A 49 13.630 -14.779 -10.690 1.00 0.00 O ATOM 758 CB THR A 49 13.428 -13.617 -7.511 1.00 0.00 C ATOM 759 OG1 THR A 49 14.043 -12.748 -6.544 1.00 0.00 O ATOM 760 CG2 THR A 49 13.916 -15.059 -7.277 1.00 0.00 C ATOM 761 H THR A 49 12.940 -11.249 -8.322 1.00 0.00 H ATOM 762 HA THR A 49 14.829 -13.188 -9.107 1.00 0.00 H ATOM 763 HB THR A 49 12.356 -13.583 -7.360 1.00 0.00 H ATOM 764 HG1 THR A 49 13.739 -12.986 -5.660 1.00 0.00 H ATOM 765 HG21 THR A 49 13.655 -15.378 -6.274 1.00 0.00 H ATOM 766 HG22 THR A 49 14.992 -15.109 -7.392 1.00 0.00 H ATOM 767 HG23 THR A 49 13.453 -15.723 -7.995 1.00 0.00 H ATOM 768 N GLU A 50 11.700 -13.692 -10.141 1.00 0.00 N ATOM 769 CA GLU A 50 10.840 -14.413 -11.098 1.00 0.00 C ATOM 770 C GLU A 50 11.286 -14.123 -12.555 1.00 0.00 C ATOM 771 O GLU A 50 11.285 -15.021 -13.391 1.00 0.00 O ATOM 772 CB GLU A 50 9.332 -14.073 -10.887 1.00 0.00 C ATOM 773 CG GLU A 50 8.921 -12.650 -11.298 1.00 0.00 C ATOM 774 CD GLU A 50 7.408 -12.393 -11.233 1.00 0.00 C ATOM 775 OE1 GLU A 50 6.676 -12.887 -12.120 1.00 0.00 O ATOM 776 OE2 GLU A 50 6.951 -11.664 -10.330 1.00 0.00 O1- ATOM 777 H GLU A 50 11.313 -12.994 -9.576 1.00 0.00 H ATOM 778 HA GLU A 50 10.978 -15.477 -10.906 1.00 0.00 H ATOM 779 HB2 GLU A 50 8.734 -14.776 -11.455 1.00 0.00 H ATOM 780 HB3 GLU A 50 9.093 -14.198 -9.834 1.00 0.00 H ATOM 781 HG2 GLU A 50 9.430 -11.941 -10.649 1.00 0.00 H ATOM 782 HG3 GLU A 50 9.256 -12.473 -12.314 1.00 0.00 H ATOM 783 N HIS A 51 11.689 -12.859 -12.818 1.00 0.00 N ATOM 784 CA HIS A 51 12.233 -12.415 -14.122 1.00 0.00 C ATOM 785 C HIS A 51 13.554 -13.144 -14.443 1.00 0.00 C ATOM 786 O HIS A 51 13.781 -13.593 -15.569 1.00 0.00 O ATOM 787 CB HIS A 51 12.445 -10.863 -14.097 1.00 0.00 C ATOM 788 CG HIS A 51 13.375 -10.316 -15.167 1.00 0.00 C ATOM 789 ND1 HIS A 51 13.052 -10.235 -16.494 1.00 0.00 N ATOM 790 CD2 HIS A 51 14.648 -9.848 -15.068 1.00 0.00 C ATOM 791 CE1 HIS A 51 14.108 -9.738 -17.149 1.00 0.00 C ATOM 792 NE2 HIS A 51 15.122 -9.487 -16.332 1.00 0.00 N ATOM 793 H HIS A 51 11.616 -12.195 -12.101 1.00 0.00 H ATOM 794 HA HIS A 51 11.506 -12.655 -14.882 1.00 0.00 H ATOM 795 HB2 HIS A 51 11.486 -10.379 -14.225 1.00 0.00 H ATOM 796 HB3 HIS A 51 12.846 -10.571 -13.130 1.00 0.00 H ATOM 797 HD1 HIS A 51 12.199 -10.502 -16.897 1.00 0.00 H ATOM 798 HD2 HIS A 51 15.222 -9.775 -14.146 1.00 0.00 H ATOM 799 HE1 HIS A 51 14.140 -9.574 -18.213 1.00 0.00 H ATOM 800 N LYS A 52 14.405 -13.240 -13.417 1.00 0.00 N ATOM 801 CA LYS A 52 15.778 -13.742 -13.534 1.00 0.00 C ATOM 802 C LYS A 52 15.820 -15.254 -13.840 1.00 0.00 C ATOM 803 O LYS A 52 16.716 -15.719 -14.551 1.00 0.00 O ATOM 804 CB LYS A 52 16.555 -13.419 -12.232 1.00 0.00 C ATOM 805 CG LYS A 52 18.083 -13.680 -12.313 1.00 0.00 C ATOM 806 CD LYS A 52 18.799 -13.466 -10.959 1.00 0.00 C ATOM 807 CE LYS A 52 18.257 -14.392 -9.852 1.00 0.00 C ATOM 808 NZ LYS A 52 18.985 -14.214 -8.576 1.00 0.00 N1+ ATOM 809 H LYS A 52 14.091 -12.947 -12.532 1.00 0.00 H ATOM 810 HA LYS A 52 16.246 -13.209 -14.353 1.00 0.00 H ATOM 811 HB2 LYS A 52 16.403 -12.373 -11.990 1.00 0.00 H ATOM 812 HB3 LYS A 52 16.144 -14.018 -11.423 1.00 0.00 H ATOM 813 HG2 LYS A 52 18.253 -14.700 -12.646 1.00 0.00 H ATOM 814 HG3 LYS A 52 18.509 -12.999 -13.042 1.00 0.00 H ATOM 815 HD2 LYS A 52 19.858 -13.666 -11.091 1.00 0.00 H ATOM 816 HD3 LYS A 52 18.668 -12.436 -10.654 1.00 0.00 H ATOM 817 HE2 LYS A 52 17.213 -14.164 -9.679 1.00 0.00 H ATOM 818 HE3 LYS A 52 18.350 -15.423 -10.165 1.00 0.00 H ATOM 819 HZ1 LYS A 52 18.646 -14.891 -7.867 1.00 0.00 H ATOM 820 HZ2 LYS A 52 18.839 -13.254 -8.213 1.00 0.00 H ATOM 821 HZ3 LYS A 52 20.002 -14.366 -8.723 1.00 0.00 H ATOM 822 N VAL A 53 14.864 -16.018 -13.276 1.00 0.00 N ATOM 823 CA VAL A 53 14.794 -17.477 -13.464 1.00 0.00 C ATOM 824 C VAL A 53 14.146 -17.863 -14.826 1.00 0.00 C ATOM 825 O VAL A 53 14.557 -18.835 -15.459 1.00 0.00 O ATOM 826 CB VAL A 53 14.066 -18.173 -12.250 1.00 0.00 C ATOM 827 CG1 VAL A 53 14.832 -17.916 -10.927 1.00 0.00 C ATOM 828 CG2 VAL A 53 12.589 -17.734 -12.122 1.00 0.00 C ATOM 829 H VAL A 53 14.168 -15.597 -12.728 1.00 0.00 H ATOM 830 HA VAL A 53 15.819 -17.844 -13.476 1.00 0.00 H ATOM 831 HB VAL A 53 14.080 -19.240 -12.432 1.00 0.00 H ATOM 832 HG11 VAL A 53 15.842 -18.299 -11.007 1.00 0.00 H ATOM 833 HG12 VAL A 53 14.334 -18.415 -10.101 1.00 0.00 H ATOM 834 HG13 VAL A 53 14.871 -16.853 -10.724 1.00 0.00 H ATOM 835 HG21 VAL A 53 12.129 -18.232 -11.277 1.00 0.00 H ATOM 836 HG22 VAL A 53 12.044 -17.992 -13.020 1.00 0.00 H ATOM 837 HG23 VAL A 53 12.535 -16.660 -11.975 1.00 0.00 H ATOM 838 N THR A 54 13.145 -17.077 -15.271 1.00 0.00 N ATOM 839 CA THR A 54 12.444 -17.271 -16.573 1.00 0.00 C ATOM 840 C THR A 54 13.078 -16.388 -17.672 1.00 0.00 C ATOM 841 O THR A 54 12.377 -15.888 -18.571 1.00 0.00 O ATOM 842 CB THR A 54 10.913 -16.970 -16.444 1.00 0.00 C ATOM 843 OG1 THR A 54 10.718 -15.630 -15.959 1.00 0.00 O ATOM 844 CG2 THR A 54 10.196 -17.967 -15.515 1.00 0.00 C ATOM 845 H THR A 54 12.855 -16.343 -14.692 1.00 0.00 H ATOM 846 HA THR A 54 12.560 -18.309 -16.869 1.00 0.00 H ATOM 847 HB THR A 54 10.460 -17.045 -17.429 1.00 0.00 H ATOM 848 HG1 THR A 54 10.392 -15.663 -15.052 1.00 0.00 H ATOM 849 HG21 THR A 54 9.142 -17.721 -15.456 1.00 0.00 H ATOM 850 HG22 THR A 54 10.624 -17.912 -14.522 1.00 0.00 H ATOM 851 HG23 THR A 54 10.307 -18.973 -15.895 1.00 0.00 H ATOM 852 N HIS A 55 14.419 -16.245 -17.618 1.00 0.00 N ATOM 853 CA HIS A 55 15.140 -15.173 -18.316 1.00 0.00 C ATOM 854 C HIS A 55 15.206 -15.469 -19.834 1.00 0.00 C ATOM 855 O HIS A 55 16.024 -16.309 -20.249 1.00 0.00 O ATOM 856 CB HIS A 55 16.567 -15.013 -17.716 1.00 0.00 C ATOM 857 CG HIS A 55 17.104 -13.625 -17.851 1.00 0.00 C ATOM 858 ND1 HIS A 55 17.641 -13.100 -19.001 1.00 0.00 N ATOM 859 CD2 HIS A 55 17.116 -12.628 -16.948 1.00 0.00 C ATOM 860 CE1 HIS A 55 17.952 -11.822 -18.759 1.00 0.00 C ATOM 861 NE2 HIS A 55 17.648 -11.482 -17.520 1.00 0.00 N ATOM 862 OXT HIS A 55 14.444 -14.863 -20.608 1.00 0.00 O ATOM 863 H HIS A 55 14.946 -16.950 -17.195 1.00 0.00 H ATOM 864 HA HIS A 55 14.583 -14.246 -18.155 1.00 0.00 H ATOM 865 HB2 HIS A 55 16.539 -15.256 -16.657 1.00 0.00 H ATOM 866 HB3 HIS A 55 17.257 -15.691 -18.206 1.00 0.00 H ATOM 867 HD1 HIS A 55 17.766 -13.577 -19.849 1.00 0.00 H ATOM 868 HD2 HIS A 55 16.756 -12.693 -15.924 1.00 0.00 H ATOM 869 HE1 HIS A 55 18.391 -11.155 -19.478 1.00 0.00 H