Browse entries in the PDBbind-CN Database
HEADER 4E34_COMPLEX COMPND 4E34_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 87 GLY PRO ILE ARG LYS VAL LEU LEU LEU LYS GLU ASP HIS SEQRES 2 A 87 GLU GLY LEU GLY ILE SER ILE THR GLY GLY LYS GLU HIS SEQRES 3 A 87 GLY VAL PRO ILE LEU ILE SER GLU ILE HIS PRO GLY GLN SEQRES 4 A 87 PRO ALA ASP ARG CYS GLY GLY LEU HIS VAL GLY ASP ALA SEQRES 5 A 87 ILE LEU ALA VAL ASN GLY VAL ASN LEU ARG ASP THR LYS SEQRES 6 A 87 HIS LYS GLU ALA VAL THR ILE LEU SER GLN GLN ARG GLY SEQRES 7 A 87 GLU ILE GLU PHE GLU VAL VAL TYR VAL HET ALA A 207 163 ATOM 1 N GLY A 284 7.515 18.994 -1.804 1.00 8.70 N ATOM 2 CA GLY A 284 6.577 17.937 -2.116 1.00 7.79 C ATOM 3 C GLY A 284 5.151 18.435 -2.024 1.00 6.43 C ATOM 4 O GLY A 284 4.921 19.637 -1.848 1.00 6.04 O ATOM 5 HA3 GLY A 284 6.715 17.117 -1.411 1.00 0.00 H ATOM 6 HA2 GLY A 284 6.766 17.579 -3.128 1.00 0.00 H ATOM 7 HN3 GLY A 284 7.342 19.336 -0.837 1.00 0.00 H ATOM 8 HN2 GLY A 284 7.390 19.777 -2.477 1.00 0.00 H ATOM 9 HN1 GLY A 284 8.485 18.627 -1.874 1.00 0.00 H ATOM 10 N PRO A 285 4.182 17.523 -2.134 1.00 6.26 N ATOM 11 CA PRO A 285 2.775 17.912 -2.060 1.00 6.11 C ATOM 12 C PRO A 285 2.396 18.274 -0.636 1.00 6.75 C ATOM 13 O PRO A 285 2.908 17.670 0.302 1.00 7.10 O ATOM 14 CB PRO A 285 2.046 16.630 -2.480 1.00 8.34 C ATOM 15 CG PRO A 285 2.973 15.530 -2.090 1.00 12.10 C ATOM 16 CD PRO A 285 4.352 16.069 -2.324 1.00 9.95 C ATOM 17 HA PRO A 285 2.537 18.779 -2.676 1.00 0.00 H ATOM 18 HD3 PRO A 285 5.060 15.660 -1.603 1.00 0.00 H ATOM 19 HD2 PRO A 285 4.694 15.844 -3.334 1.00 0.00 H ATOM 20 HG3 PRO A 285 2.799 14.648 -2.706 1.00 0.00 H ATOM 21 HG2 PRO A 285 2.838 15.271 -1.040 1.00 0.00 H ATOM 22 HB2 PRO A 285 1.095 16.537 -1.955 1.00 0.00 H ATOM 23 HB3 PRO A 285 1.868 16.622 -3.555 1.00 0.00 H ATOM 24 N ILE A 286 1.519 19.249 -0.469 1.00 5.15 N ATOM 25 CA ILE A 286 0.967 19.509 0.850 1.00 6.29 C ATOM 26 C ILE A 286 0.071 18.325 1.238 1.00 7.14 C ATOM 27 O ILE A 286 -0.718 17.827 0.414 1.00 9.66 O ATOM 28 CB ILE A 286 0.203 20.853 0.886 1.00 6.11 C ATOM 29 CG1 ILE A 286 1.165 22.016 0.582 1.00 10.15 C ATOM 30 CG2 ILE A 286 -0.502 21.027 2.239 1.00 8.57 C ATOM 31 CD1 ILE A 286 0.503 23.377 0.490 1.00 11.88 C ATOM 32 HA ILE A 286 1.772 19.603 1.579 1.00 0.00 H ATOM 33 HB ILE A 286 -0.567 20.853 0.115 1.00 0.00 H ATOM 34 HG12 ILE A 286 1.913 22.055 1.374 1.00 0.00 H ATOM 35 HG13 ILE A 286 1.656 21.812 -0.370 1.00 0.00 H ATOM 36 HD11 ILE A 286 -0.240 23.365 -0.307 1.00 0.00 H ATOM 37 HD12 ILE A 286 0.017 23.608 1.438 1.00 0.00 H ATOM 38 HD13 ILE A 286 1.258 24.133 0.273 1.00 0.00 H ATOM 39 HG21 ILE A 286 -1.209 20.210 2.387 1.00 0.00 H ATOM 40 HG22 ILE A 286 0.240 21.016 3.038 1.00 0.00 H ATOM 41 HG23 ILE A 286 -1.036 21.977 2.250 1.00 0.00 H ATOM 42 H ILE A 286 1.225 19.829 -1.280 1.00 0.00 H ATOM 43 N ARG A 287 0.221 17.850 2.473 1.00 5.71 N ATOM 44 CA ARG A 287 -0.561 16.719 2.981 1.00 6.96 C ATOM 45 C ARG A 287 -1.361 17.105 4.209 1.00 6.59 C ATOM 46 O ARG A 287 -0.932 17.948 4.997 1.00 6.94 O ATOM 47 CB ARG A 287 0.353 15.553 3.387 1.00 7.00 C ATOM 48 CG ARG A 287 1.120 14.912 2.251 1.00 13.45 C ATOM 49 CD ARG A 287 2.606 14.888 2.541 1.00 9.89 C ATOM 50 NE ARG A 287 2.932 14.263 3.828 1.00 7.39 N ATOM 51 CZ ARG A 287 4.032 14.546 4.517 1.00 5.39 C ATOM 52 NH1 ARG A 287 4.882 15.445 4.052 1.00 6.90 N ATOM 53 NH2 ARG A 287 4.275 13.951 5.677 1.00 4.52 N ATOM 54 HA ARG A 287 -1.228 16.422 2.172 1.00 0.00 H ATOM 55 HB2 ARG A 287 1.075 15.927 4.113 1.00 0.00 H ATOM 56 HB3 ARG A 287 -0.265 14.785 3.853 1.00 0.00 H ATOM 57 HG2 ARG A 287 0.767 13.890 2.115 1.00 0.00 H ATOM 58 HG3 ARG A 287 0.944 15.480 1.337 1.00 0.00 H ATOM 59 HD2 ARG A 287 2.974 15.914 2.550 1.00 0.00 H ATOM 60 HD3 ARG A 287 3.105 14.331 1.748 1.00 0.00 H ATOM 61 HE ARG A 287 2.269 13.564 4.220 1.00 0.00 H ATOM 62 HH12 ARG A 287 5.745 15.671 4.587 1.00 0.00 H ATOM 63 HH11 ARG A 287 4.688 15.927 3.151 1.00 0.00 H ATOM 64 HH22 ARG A 287 5.139 14.180 6.208 1.00 0.00 H ATOM 65 HH21 ARG A 287 3.601 13.255 6.056 1.00 0.00 H ATOM 66 H ARG A 287 0.919 18.298 3.100 1.00 0.00 H ATOM 67 N LYS A 288 -2.521 16.480 4.378 1.00 7.17 N ATOM 68 CA LYS A 288 -3.267 16.572 5.622 1.00 5.70 C ATOM 69 C LYS A 288 -3.116 15.239 6.339 1.00 5.96 C ATOM 70 O LYS A 288 -3.309 14.179 5.736 1.00 9.17 O ATOM 71 CB LYS A 288 -4.739 16.880 5.361 1.00 12.34 C ATOM 72 CG LYS A 288 -4.955 18.256 4.756 1.00 21.25 C ATOM 73 CD LYS A 288 -6.362 18.769 4.993 1.00 28.63 C ATOM 74 CE LYS A 288 -6.451 20.238 4.629 1.00 37.62 C ATOM 75 NZ LYS A 288 -5.344 21.010 5.266 1.00 41.59 N ATOM 76 HA LYS A 288 -2.879 17.386 6.235 1.00 0.00 H ATOM 77 HB2 LYS A 288 -5.135 16.132 4.675 1.00 0.00 H ATOM 78 HB3 LYS A 288 -5.279 16.826 6.306 1.00 0.00 H ATOM 79 HG2 LYS A 288 -4.246 18.953 5.204 1.00 0.00 H ATOM 80 HG3 LYS A 288 -4.777 18.200 3.682 1.00 0.00 H ATOM 81 HD2 LYS A 288 -7.061 18.202 4.378 1.00 0.00 H ATOM 82 HD3 LYS A 288 -6.620 18.642 6.044 1.00 0.00 H ATOM 83 HE2 LYS A 288 -7.407 20.634 4.972 1.00 0.00 H ATOM 84 HE3 LYS A 288 -6.383 20.343 3.546 1.00 0.00 H ATOM 85 HZ1 LYS A 288 -5.407 20.916 6.300 1.00 0.00 H ATOM 86 HZ2 LYS A 288 -4.430 20.638 4.938 1.00 0.00 H ATOM 87 HZ3 LYS A 288 -5.426 22.013 5.002 1.00 0.00 H ATOM 88 H LYS A 288 -2.906 15.909 3.599 1.00 0.00 H ATOM 89 N VAL A 289 -2.751 15.293 7.616 1.00 4.42 N ATOM 90 CA VAL A 289 -2.423 14.103 8.394 1.00 3.59 C ATOM 91 C VAL A 289 -3.155 14.163 9.721 1.00 3.32 C ATOM 92 O VAL A 289 -3.135 15.190 10.403 1.00 5.32 O ATOM 93 CB VAL A 289 -0.903 14.043 8.662 1.00 4.68 C ATOM 94 CG1 VAL A 289 -0.559 12.905 9.607 1.00 6.55 C ATOM 95 CG2 VAL A 289 -0.144 13.886 7.349 1.00 6.96 C ATOM 96 HA VAL A 289 -2.723 13.217 7.835 1.00 0.00 H ATOM 97 HB VAL A 289 -0.604 14.978 9.136 1.00 0.00 H ATOM 98 HG11 VAL A 289 -1.075 13.053 10.555 1.00 0.00 H ATOM 99 HG12 VAL A 289 -0.873 11.960 9.165 1.00 0.00 H ATOM 100 HG13 VAL A 289 0.518 12.888 9.777 1.00 0.00 H ATOM 101 HG21 VAL A 289 -0.457 12.965 6.858 1.00 0.00 H ATOM 102 HG22 VAL A 289 -0.360 14.736 6.702 1.00 0.00 H ATOM 103 HG23 VAL A 289 0.926 13.845 7.552 1.00 0.00 H ATOM 104 H VAL A 289 -2.697 16.222 8.080 1.00 0.00 H ATOM 105 N LEU A 290 -3.784 13.060 10.111 1.00 2.38 N ATOM 106 CA LEU A 290 -4.461 12.962 11.401 1.00 2.89 C ATOM 107 C LEU A 290 -3.580 12.283 12.448 1.00 3.74 C ATOM 108 O LEU A 290 -2.976 11.252 12.171 1.00 3.52 O ATOM 109 CB LEU A 290 -5.749 12.148 11.242 1.00 3.81 C ATOM 110 CG LEU A 290 -6.610 11.991 12.490 1.00 4.02 C ATOM 111 CD1 LEU A 290 -7.118 13.351 12.965 1.00 9.09 C ATOM 112 CD2 LEU A 290 -7.771 11.068 12.199 1.00 6.31 C ATOM 113 HA LEU A 290 -4.683 13.975 11.737 1.00 0.00 H ATOM 114 HB2 LEU A 290 -6.357 12.634 10.479 1.00 0.00 H ATOM 115 HB3 LEU A 290 -5.471 11.150 10.903 1.00 0.00 H ATOM 116 HG LEU A 290 -6.002 11.557 13.284 1.00 0.00 H ATOM 117 HD21 LEU A 290 -8.375 11.488 11.395 1.00 0.00 H ATOM 118 HD22 LEU A 290 -7.391 10.092 11.898 1.00 0.00 H ATOM 119 HD23 LEU A 290 -8.382 10.961 13.095 1.00 0.00 H ATOM 120 HD11 LEU A 290 -6.269 13.993 13.199 1.00 0.00 H ATOM 121 HD12 LEU A 290 -7.716 13.809 12.177 1.00 0.00 H ATOM 122 HD13 LEU A 290 -7.730 13.217 13.857 1.00 0.00 H ATOM 123 H LEU A 290 -3.795 12.237 9.475 1.00 0.00 H ATOM 124 N LEU A 291 -3.525 12.854 13.648 1.00 2.76 N ATOM 125 CA LEU A 291 -2.788 12.279 14.772 1.00 2.49 C ATOM 126 C LEU A 291 -3.743 12.122 15.950 1.00 2.86 C ATOM 127 O LEU A 291 -4.544 13.019 16.227 1.00 3.86 O ATOM 128 CB LEU A 291 -1.618 13.205 15.135 1.00 3.45 C ATOM 129 CG LEU A 291 -0.745 12.850 16.340 1.00 2.81 C ATOM 130 CD1 LEU A 291 0.672 13.388 16.116 1.00 3.75 C ATOM 131 CD2 LEU A 291 -1.335 13.376 17.639 1.00 3.60 C ATOM 132 HA LEU A 291 -2.385 11.301 14.509 1.00 0.00 H ATOM 133 HB2 LEU A 291 -0.962 13.249 14.266 1.00 0.00 H ATOM 134 HB3 LEU A 291 -2.037 14.193 15.323 1.00 0.00 H ATOM 135 HG LEU A 291 -0.705 11.765 16.433 1.00 0.00 H ATOM 136 HD21 LEU A 291 -1.420 14.461 17.585 1.00 0.00 H ATOM 137 HD22 LEU A 291 -2.323 12.940 17.791 1.00 0.00 H ATOM 138 HD23 LEU A 291 -0.684 13.102 18.469 1.00 0.00 H ATOM 139 HD11 LEU A 291 1.092 12.939 15.216 1.00 0.00 H ATOM 140 HD12 LEU A 291 0.634 14.471 15.999 1.00 0.00 H ATOM 141 HD13 LEU A 291 1.295 13.136 16.974 1.00 0.00 H ATOM 142 H LEU A 291 -4.030 13.751 13.793 1.00 0.00 H ATOM 143 N LEU A 292 -3.688 10.969 16.608 1.00 2.70 N ATOM 144 CA LEU A 292 -4.484 10.706 17.804 1.00 3.21 C ATOM 145 C LEU A 292 -3.565 10.667 19.015 1.00 5.60 C ATOM 146 O LEU A 292 -2.624 9.870 19.068 1.00 4.53 O ATOM 147 CB LEU A 292 -5.237 9.378 17.677 1.00 4.24 C ATOM 148 CG LEU A 292 -6.671 9.447 17.143 1.00 5.05 C ATOM 149 CD1 LEU A 292 -6.780 10.221 15.837 1.00 5.90 C ATOM 150 CD2 LEU A 292 -7.242 8.039 16.975 1.00 5.25 C ATOM 151 HA LEU A 292 -5.219 11.502 17.922 1.00 0.00 H ATOM 152 HB2 LEU A 292 -4.665 8.737 17.006 1.00 0.00 H ATOM 153 HB3 LEU A 292 -5.275 8.924 18.667 1.00 0.00 H ATOM 154 HG LEU A 292 -7.257 9.993 17.882 1.00 0.00 H ATOM 155 HD21 LEU A 292 -6.626 7.480 16.271 1.00 0.00 H ATOM 156 HD22 LEU A 292 -7.245 7.532 17.940 1.00 0.00 H ATOM 157 HD23 LEU A 292 -8.261 8.105 16.595 1.00 0.00 H ATOM 158 HD11 LEU A 292 -6.433 11.243 15.992 1.00 0.00 H ATOM 159 HD12 LEU A 292 -6.165 9.738 15.078 1.00 0.00 H ATOM 160 HD13 LEU A 292 -7.820 10.235 15.510 1.00 0.00 H ATOM 161 H LEU A 292 -3.053 10.224 16.257 1.00 0.00 H ATOM 162 N LYS A 293 -3.852 11.534 19.983 1.00 7.81 N ATOM 163 CA LYS A 293 -3.016 11.729 21.169 1.00 12.85 C ATOM 164 C LYS A 293 -3.883 11.499 22.396 1.00 11.04 C ATOM 165 O LYS A 293 -5.019 11.978 22.461 1.00 9.42 O ATOM 166 CB LYS A 293 -2.462 13.172 21.218 1.00 14.54 C ATOM 167 CG LYS A 293 -1.298 13.380 22.197 1.00 17.73 C ATOM 168 CD LYS A 293 -0.819 14.824 22.253 1.00 12.03 C ATOM 169 CE LYS A 293 -1.717 15.705 23.110 1.00 12.32 C ATOM 170 NZ LYS A 293 -1.872 15.153 24.481 1.00 10.63 N ATOM 171 HA LYS A 293 -2.177 11.034 21.138 1.00 0.00 H ATOM 172 HB2 LYS A 293 -2.117 13.438 20.219 1.00 0.00 H ATOM 173 HB3 LYS A 293 -3.274 13.838 21.509 1.00 0.00 H ATOM 174 HG2 LYS A 293 -1.625 13.083 23.194 1.00 0.00 H ATOM 175 HG3 LYS A 293 -0.465 12.749 21.886 1.00 0.00 H ATOM 176 HD2 LYS A 293 0.188 14.842 22.669 1.00 0.00 H ATOM 177 HD3 LYS A 293 -0.800 15.225 21.240 1.00 0.00 H ATOM 178 HE2 LYS A 293 -2.699 15.772 22.642 1.00 0.00 H ATOM 179 HE3 LYS A 293 -1.278 16.701 23.176 1.00 0.00 H ATOM 180 HZ1 LYS A 293 -2.296 14.205 24.426 1.00 0.00 H ATOM 181 HZ2 LYS A 293 -0.939 15.091 24.936 1.00 0.00 H ATOM 182 HZ3 LYS A 293 -2.490 15.778 25.037 1.00 0.00 H ATOM 183 H LYS A 293 -4.717 12.104 19.892 1.00 0.00 H ATOM 184 N GLU A 294 -3.353 10.771 23.372 1.00 7.86 N ATOM 185 CA GLU A 294 -4.014 10.679 24.657 1.00 9.83 C ATOM 186 C GLU A 294 -3.516 11.820 25.568 1.00 7.90 C ATOM 187 O GLU A 294 -2.472 12.426 25.307 1.00 5.02 O ATOM 188 CB GLU A 294 -3.764 9.311 25.298 1.00 14.85 C ATOM 189 CG GLU A 294 -4.004 8.112 24.365 1.00 15.85 C ATOM 190 CD GLU A 294 -5.426 8.021 23.837 1.00 13.41 C ATOM 191 OE1 GLU A 294 -6.328 8.698 24.384 1.00 14.67 O ATOM 192 OE2 GLU A 294 -5.641 7.263 22.861 1.00 15.96 O ATOM 193 HA GLU A 294 -5.090 10.782 24.518 1.00 0.00 H ATOM 194 HB2 GLU A 294 -2.728 9.278 25.635 1.00 0.00 H ATOM 195 HB3 GLU A 294 -4.428 9.212 26.157 1.00 0.00 H ATOM 196 HG2 GLU A 294 -3.326 8.196 23.515 1.00 0.00 H ATOM 197 HG3 GLU A 294 -3.782 7.198 24.916 1.00 0.00 H ATOM 198 H GLU A 294 -2.459 10.264 23.213 1.00 0.00 H ATOM 199 N ASP A 295 -4.256 12.126 26.625 1.00 8.14 N ATOM 200 CA ASP A 295 -3.971 13.319 27.407 1.00 8.25 C ATOM 201 C ASP A 295 -2.690 13.244 28.252 1.00 7.62 C ATOM 202 O ASP A 295 -2.157 14.268 28.674 1.00 9.86 O ATOM 203 CB ASP A 295 -5.183 13.675 28.276 1.00 15.87 C ATOM 204 CG ASP A 295 -6.389 14.090 27.449 1.00 20.43 C ATOM 205 OD1 ASP A 295 -6.206 14.503 26.282 1.00 15.39 O ATOM 206 OD2 ASP A 295 -7.523 14.006 27.965 1.00 17.43 O ATOM 207 HA ASP A 295 -3.781 14.113 26.685 1.00 0.00 H ATOM 208 HB2 ASP A 295 -5.452 12.805 28.875 1.00 0.00 H ATOM 209 HB3 ASP A 295 -4.911 14.499 28.936 1.00 0.00 H ATOM 210 H ASP A 295 -5.047 11.508 26.897 1.00 0.00 H ATOM 211 N HIS A 296 -2.199 12.033 28.482 1.00 4.17 N ATOM 212 CA HIS A 296 -0.976 11.816 29.268 1.00 3.82 C ATOM 213 C HIS A 296 0.299 11.887 28.422 1.00 3.39 C ATOM 214 O HIS A 296 1.398 11.732 28.949 1.00 4.38 O ATOM 215 CB HIS A 296 -1.030 10.450 29.962 1.00 4.63 C ATOM 216 CG HIS A 296 -0.864 9.302 29.021 1.00 3.79 C ATOM 217 ND1 HIS A 296 -1.766 9.048 28.005 1.00 5.18 N ATOM 218 CD2 HIS A 296 0.111 8.370 28.902 1.00 5.58 C ATOM 219 CE1 HIS A 296 -1.360 7.994 27.319 1.00 6.26 C ATOM 220 NE2 HIS A 296 -0.219 7.569 27.836 1.00 6.67 N ATOM 221 HA HIS A 296 -0.936 12.622 30.001 1.00 0.00 H ATOM 222 HB2 HIS A 296 -0.233 10.407 30.704 1.00 0.00 H ATOM 223 HB3 HIS A 296 -1.995 10.353 30.460 1.00 0.00 H ATOM 224 HD2 HIS A 296 0.994 8.273 29.534 1.00 0.00 H ATOM 225 HE1 HIS A 296 -1.878 7.549 26.470 1.00 0.00 H ATOM 226 H HIS A 296 -2.697 11.208 28.092 1.00 0.00 H ATOM 227 N GLU A 297 0.134 12.110 27.123 1.00 4.38 N ATOM 228 CA GLU A 297 1.245 12.080 26.170 1.00 4.88 C ATOM 229 C GLU A 297 1.523 13.444 25.572 1.00 3.55 C ATOM 230 O GLU A 297 0.645 14.317 25.551 1.00 3.96 O ATOM 231 CB GLU A 297 0.889 11.164 24.992 1.00 9.10 C ATOM 232 CG GLU A 297 0.466 9.762 25.343 1.00 8.27 C ATOM 233 CD GLU A 297 0.163 8.945 24.101 1.00 3.72 C ATOM 234 OE1 GLU A 297 -0.904 9.167 23.482 1.00 8.39 O ATOM 235 OE2 GLU A 297 1.028 8.123 23.774 1.00 11.02 O ATOM 236 HA GLU A 297 2.117 11.730 26.723 1.00 0.00 H ATOM 237 HB2 GLU A 297 0.071 11.631 24.443 1.00 0.00 H ATOM 238 HB3 GLU A 297 1.765 11.096 24.347 1.00 0.00 H ATOM 239 HG2 GLU A 297 1.269 9.278 25.898 1.00 0.00 H ATOM 240 HG3 GLU A 297 -0.428 9.807 25.965 1.00 0.00 H ATOM 241 H GLU A 297 -0.822 12.314 26.769 1.00 0.00 H ATOM 242 N GLY A 298 2.743 13.620 25.067 1.00 3.20 N ATOM 243 CA GLY A 298 3.031 14.697 24.138 1.00 4.24 C ATOM 244 C GLY A 298 2.792 14.258 22.701 1.00 2.25 C ATOM 245 O GLY A 298 2.243 13.177 22.450 1.00 3.75 O ATOM 246 HA3 GLY A 298 4.073 14.996 24.251 1.00 0.00 H ATOM 247 HA2 GLY A 298 2.385 15.545 24.364 1.00 0.00 H ATOM 248 H GLY A 298 3.506 12.971 25.345 1.00 0.00 H ATOM 249 N LEU A 299 3.201 15.098 21.756 1.00 2.72 N ATOM 250 CA LEU A 299 3.034 14.757 20.350 1.00 2.94 C ATOM 251 C LEU A 299 4.033 13.704 19.889 1.00 2.36 C ATOM 252 O LEU A 299 3.749 12.935 18.973 1.00 4.19 O ATOM 253 CB LEU A 299 3.185 16.007 19.494 1.00 2.59 C ATOM 254 CG LEU A 299 2.025 16.997 19.624 1.00 2.79 C ATOM 255 CD1 LEU A 299 2.392 18.334 19.002 1.00 6.79 C ATOM 256 CD2 LEU A 299 0.772 16.467 18.986 1.00 4.87 C ATOM 257 HA LEU A 299 2.034 14.339 20.234 1.00 0.00 H ATOM 258 HB2 LEU A 299 4.103 16.515 19.788 1.00 0.00 H ATOM 259 HB3 LEU A 299 3.259 15.701 18.450 1.00 0.00 H ATOM 260 HG LEU A 299 1.833 17.136 20.688 1.00 0.00 H ATOM 261 HD21 LEU A 299 0.954 16.286 17.927 1.00 0.00 H ATOM 262 HD22 LEU A 299 0.485 15.534 19.471 1.00 0.00 H ATOM 263 HD23 LEU A 299 -0.029 17.198 19.099 1.00 0.00 H ATOM 264 HD11 LEU A 299 3.265 18.743 19.511 1.00 0.00 H ATOM 265 HD12 LEU A 299 2.619 18.192 17.946 1.00 0.00 H ATOM 266 HD13 LEU A 299 1.554 19.023 19.105 1.00 0.00 H ATOM 267 H LEU A 299 3.642 16.002 22.021 1.00 0.00 H ATOM 268 N GLY A 300 5.214 13.686 20.504 1.00 3.02 N ATOM 269 CA GLY A 300 6.250 12.750 20.102 1.00 3.60 C ATOM 270 C GLY A 300 7.088 13.259 18.943 1.00 4.16 C ATOM 271 O GLY A 300 7.540 12.487 18.091 1.00 3.59 O ATOM 272 HA3 GLY A 300 5.777 11.814 19.805 1.00 0.00 H ATOM 273 HA2 GLY A 300 6.906 12.570 20.954 1.00 0.00 H ATOM 274 H GLY A 300 5.397 14.351 21.282 1.00 0.00 H ATOM 275 N ILE A 301 7.308 14.569 18.900 1.00 3.33 N ATOM 276 CA ILE A 301 8.191 15.130 17.887 1.00 4.89 C ATOM 277 C ILE A 301 9.118 16.137 18.510 1.00 4.15 C ATOM 278 O ILE A 301 8.844 16.677 19.587 1.00 4.79 O ATOM 279 CB ILE A 301 7.423 15.814 16.742 1.00 6.82 C ATOM 280 CG1 ILE A 301 6.648 17.017 17.248 1.00 7.17 C ATOM 281 CG2 ILE A 301 6.471 14.824 16.086 1.00 7.80 C ATOM 282 CD1 ILE A 301 5.894 17.755 16.153 1.00 10.02 C ATOM 283 HA ILE A 301 8.751 14.295 17.467 1.00 0.00 H ATOM 284 HB ILE A 301 8.149 16.158 16.005 1.00 0.00 H ATOM 285 HG12 ILE A 301 5.929 16.677 17.993 1.00 0.00 H ATOM 286 HG13 ILE A 301 7.350 17.710 17.712 1.00 0.00 H ATOM 287 HD11 ILE A 301 6.601 18.112 15.404 1.00 0.00 H ATOM 288 HD12 ILE A 301 5.179 17.078 15.686 1.00 0.00 H ATOM 289 HD13 ILE A 301 5.363 18.603 16.587 1.00 0.00 H ATOM 290 HG21 ILE A 301 7.040 13.986 15.685 1.00 0.00 H ATOM 291 HG22 ILE A 301 5.760 14.460 16.827 1.00 0.00 H ATOM 292 HG23 ILE A 301 5.934 15.320 15.278 1.00 0.00 H ATOM 293 H ILE A 301 6.848 15.195 19.592 1.00 0.00 H ATOM 294 N SER A 302 10.226 16.388 17.823 1.00 3.15 N ATOM 295 CA SER A 302 11.012 17.569 18.118 1.00 3.08 C ATOM 296 C SER A 302 10.851 18.501 16.946 1.00 4.52 C ATOM 297 O SER A 302 10.828 18.062 15.780 1.00 4.40 O ATOM 298 CB SER A 302 12.484 17.228 18.295 1.00 7.03 C ATOM 299 OG SER A 302 12.656 16.425 19.444 1.00 7.09 O ATOM 300 HA SER A 302 10.670 18.021 19.049 1.00 0.00 H ATOM 301 HB2 SER A 302 13.058 18.148 18.407 1.00 0.00 H ATOM 302 HB3 SER A 302 12.838 16.686 17.418 1.00 0.00 H ATOM 303 HG SER A 302 13.616 16.207 19.552 1.00 0.00 H ATOM 304 H SER A 302 10.530 15.736 17.072 1.00 0.00 H ATOM 305 N ILE A 303 10.728 19.791 17.245 1.00 3.35 N ATOM 306 CA ILE A 303 10.670 20.808 16.207 1.00 3.74 C ATOM 307 C ILE A 303 11.838 21.776 16.303 1.00 2.98 C ATOM 308 O ILE A 303 12.367 22.048 17.398 1.00 3.81 O ATOM 309 CB ILE A 303 9.333 21.606 16.240 1.00 3.40 C ATOM 310 CG1 ILE A 303 9.101 22.271 17.599 1.00 4.61 C ATOM 311 CG2 ILE A 303 8.155 20.712 15.854 1.00 4.56 C ATOM 312 CD1 ILE A 303 8.018 23.366 17.549 1.00 6.05 C ATOM 313 HA ILE A 303 10.730 20.273 15.259 1.00 0.00 H ATOM 314 HB ILE A 303 9.410 22.404 15.501 1.00 0.00 H ATOM 315 HG12 ILE A 303 8.792 21.507 18.313 1.00 0.00 H ATOM 316 HG13 ILE A 303 10.037 22.721 17.932 1.00 0.00 H ATOM 317 HD11 ILE A 303 8.319 24.141 16.845 1.00 0.00 H ATOM 318 HD12 ILE A 303 7.074 22.927 17.226 1.00 0.00 H ATOM 319 HD13 ILE A 303 7.897 23.801 18.541 1.00 0.00 H ATOM 320 HG21 ILE A 303 8.309 20.326 14.846 1.00 0.00 H ATOM 321 HG22 ILE A 303 8.086 19.881 16.556 1.00 0.00 H ATOM 322 HG23 ILE A 303 7.234 21.294 15.885 1.00 0.00 H ATOM 323 H ILE A 303 10.672 20.079 18.243 1.00 0.00 H ATOM 324 N THR A 304 12.230 22.300 15.150 1.00 4.90 N ATOM 325 CA THR A 304 13.239 23.334 15.089 1.00 4.47 C ATOM 326 C THR A 304 12.727 24.408 14.135 1.00 4.79 C ATOM 327 O THR A 304 11.640 24.300 13.566 1.00 6.78 O ATOM 328 CB THR A 304 14.610 22.746 14.672 1.00 6.45 C ATOM 329 OG1 THR A 304 15.642 23.722 14.862 1.00 8.71 O ATOM 330 CG2 THR A 304 14.591 22.260 13.226 1.00 7.98 C ATOM 331 HA THR A 304 13.409 23.782 16.068 1.00 0.00 H ATOM 332 HB THR A 304 14.816 21.884 15.306 1.00 0.00 H ATOM 333 HG1 THR A 304 15.676 23.983 15.816 1.00 0.00 H ATOM 334 HG23 THR A 304 13.800 21.520 13.103 1.00 0.00 H ATOM 335 HG21 THR A 304 14.406 23.105 12.563 1.00 0.00 H ATOM 336 HG22 THR A 304 15.553 21.810 12.983 1.00 0.00 H ATOM 337 H THR A 304 11.801 21.959 14.266 1.00 0.00 H ATOM 338 N GLY A 305 13.487 25.481 14.000 1.00 4.13 N ATOM 339 CA GLY A 305 13.095 26.553 13.107 1.00 6.08 C ATOM 340 C GLY A 305 12.131 27.542 13.723 1.00 4.24 C ATOM 341 O GLY A 305 11.984 27.627 14.946 1.00 5.93 O ATOM 342 HA3 GLY A 305 12.622 26.113 12.229 1.00 0.00 H ATOM 343 HA2 GLY A 305 13.992 27.092 12.803 1.00 0.00 H ATOM 344 H GLY A 305 14.373 25.557 14.539 1.00 0.00 H ATOM 345 N GLY A 306 11.461 28.298 12.861 1.00 4.57 N ATOM 346 CA GLY A 306 10.577 29.363 13.291 1.00 5.50 C ATOM 347 C GLY A 306 10.875 30.681 12.594 1.00 5.13 C ATOM 348 O GLY A 306 11.987 30.913 12.099 1.00 5.10 O ATOM 349 HA3 GLY A 306 10.692 29.501 14.366 1.00 0.00 H ATOM 350 HA2 GLY A 306 9.549 29.075 13.071 1.00 0.00 H ATOM 351 H GLY A 306 11.574 28.120 11.843 1.00 0.00 H ATOM 352 N LYS A 307 9.883 31.558 12.568 1.00 5.31 N ATOM 353 CA LYS A 307 9.970 32.796 11.806 1.00 6.77 C ATOM 354 C LYS A 307 11.219 33.613 12.115 1.00 8.55 C ATOM 355 O LYS A 307 11.819 34.211 11.220 1.00 8.85 O ATOM 356 CB LYS A 307 8.719 33.634 12.045 1.00 10.70 C ATOM 357 CG LYS A 307 8.730 34.976 11.332 1.00 14.24 C ATOM 358 CD LYS A 307 7.741 35.921 11.984 1.00 24.70 C ATOM 359 CE LYS A 307 8.340 37.311 12.164 1.00 29.46 C ATOM 360 NZ LYS A 307 8.056 37.847 13.527 1.00 24.44 N ATOM 361 HA LYS A 307 10.042 32.516 10.755 1.00 0.00 H ATOM 362 HB2 LYS A 307 7.855 33.068 11.697 1.00 0.00 H ATOM 363 HB3 LYS A 307 8.626 33.815 13.116 1.00 0.00 H ATOM 364 HG2 LYS A 307 9.730 35.406 11.388 1.00 0.00 H ATOM 365 HG3 LYS A 307 8.456 34.832 10.287 1.00 0.00 H ATOM 366 HD2 LYS A 307 6.853 35.995 11.356 1.00 0.00 H ATOM 367 HD3 LYS A 307 7.462 35.525 12.960 1.00 0.00 H ATOM 368 HE2 LYS A 307 7.911 37.983 11.421 1.00 0.00 H ATOM 369 HE3 LYS A 307 9.419 37.255 12.021 1.00 0.00 H ATOM 370 HZ1 LYS A 307 7.027 37.907 13.667 1.00 0.00 H ATOM 371 HZ2 LYS A 307 8.468 37.212 14.241 1.00 0.00 H ATOM 372 HZ3 LYS A 307 8.476 38.794 13.620 1.00 0.00 H ATOM 373 H LYS A 307 9.017 31.357 13.107 1.00 0.00 H ATOM 374 N GLU A 308 11.624 33.640 13.375 1.00 6.37 N ATOM 375 CA GLU A 308 12.751 34.492 13.752 1.00 8.31 C ATOM 376 C GLU A 308 14.065 33.968 13.170 1.00 8.76 C ATOM 377 O GLU A 308 15.068 34.688 13.153 1.00 13.21 O ATOM 378 CB GLU A 308 12.836 34.665 15.278 1.00 9.62 C ATOM 379 CG GLU A 308 13.287 33.424 16.042 1.00 8.26 C ATOM 380 CD GLU A 308 12.151 32.517 16.495 1.00 9.23 C ATOM 381 OE1 GLU A 308 11.267 32.186 15.692 1.00 5.86 O ATOM 382 OE2 GLU A 308 12.169 32.112 17.677 1.00 15.81 O ATOM 383 HA GLU A 308 12.577 35.479 13.323 1.00 0.00 H ATOM 384 HB2 GLU A 308 13.542 35.468 15.489 1.00 0.00 H ATOM 385 HB3 GLU A 308 11.848 34.947 15.642 1.00 0.00 H ATOM 386 HG2 GLU A 308 13.948 32.846 15.395 1.00 0.00 H ATOM 387 HG3 GLU A 308 13.838 33.748 16.925 1.00 0.00 H ATOM 388 H GLU A 308 11.144 33.059 14.092 1.00 0.00 H ATOM 389 N HIS A 309 14.043 32.732 12.676 1.00 6.85 N ATOM 390 CA HIS A 309 15.200 32.100 12.047 1.00 6.03 C ATOM 391 C HIS A 309 15.078 32.039 10.529 1.00 6.49 C ATOM 392 O HIS A 309 15.940 31.469 9.861 1.00 10.76 O ATOM 393 CB HIS A 309 15.387 30.694 12.616 1.00 8.10 C ATOM 394 CG HIS A 309 15.477 30.689 14.104 1.00 8.40 C ATOM 395 ND1 HIS A 309 16.506 31.311 14.776 1.00 8.67 N ATOM 396 CD2 HIS A 309 14.643 30.202 15.051 1.00 8.69 C ATOM 397 CE1 HIS A 309 16.308 31.196 16.078 1.00 7.58 C ATOM 398 NE2 HIS A 309 15.182 30.531 16.270 1.00 10.16 N ATOM 399 HA HIS A 309 16.072 32.714 12.272 1.00 0.00 H ATOM 400 HB2 HIS A 309 14.539 30.079 12.314 1.00 0.00 H ATOM 401 HB3 HIS A 309 16.305 30.271 12.208 1.00 0.00 H ATOM 402 HD2 HIS A 309 13.718 29.652 14.879 1.00 0.00 H ATOM 403 HE1 HIS A 309 16.962 31.583 16.860 1.00 0.00 H ATOM 404 H HIS A 309 13.158 32.189 12.741 1.00 0.00 H ATOM 405 N GLY A 310 13.991 32.586 10.002 1.00 7.22 N ATOM 406 CA GLY A 310 13.762 32.596 8.567 1.00 7.75 C ATOM 407 C GLY A 310 13.401 31.256 7.958 1.00 9.26 C ATOM 408 O GLY A 310 13.521 31.067 6.746 1.00 12.76 O ATOM 409 HA3 GLY A 310 14.672 32.952 8.083 1.00 0.00 H ATOM 410 HA2 GLY A 310 12.947 33.290 8.361 1.00 0.00 H ATOM 411 H GLY A 310 13.285 33.019 10.631 1.00 0.00 H ATOM 412 N VAL A 311 12.942 30.325 8.785 1.00 8.41 N ATOM 413 CA VAL A 311 12.575 29.010 8.282 1.00 11.00 C ATOM 414 C VAL A 311 11.290 28.537 8.943 1.00 8.56 C ATOM 415 O VAL A 311 10.913 29.039 9.994 1.00 8.29 O ATOM 416 CB VAL A 311 13.695 27.987 8.508 1.00 15.65 C ATOM 417 CG1 VAL A 311 14.933 28.372 7.703 1.00 18.71 C ATOM 418 CG2 VAL A 311 14.028 27.897 9.982 1.00 12.26 C ATOM 419 HA VAL A 311 12.416 29.096 7.207 1.00 0.00 H ATOM 420 HB VAL A 311 13.353 27.009 8.168 1.00 0.00 H ATOM 421 HG11 VAL A 311 14.682 28.398 6.643 1.00 0.00 H ATOM 422 HG12 VAL A 311 15.279 29.356 8.020 1.00 0.00 H ATOM 423 HG13 VAL A 311 15.719 27.636 7.874 1.00 0.00 H ATOM 424 HG21 VAL A 311 14.357 28.873 10.339 1.00 0.00 H ATOM 425 HG22 VAL A 311 13.142 27.586 10.535 1.00 0.00 H ATOM 426 HG23 VAL A 311 14.824 27.168 10.129 1.00 0.00 H ATOM 427 H VAL A 311 12.844 30.537 9.799 1.00 0.00 H ATOM 428 N PRO A 312 10.605 27.575 8.309 1.00 7.32 N ATOM 429 CA PRO A 312 9.346 27.068 8.870 1.00 6.19 C ATOM 430 C PRO A 312 9.585 26.310 10.167 1.00 5.46 C ATOM 431 O PRO A 312 10.724 26.039 10.553 1.00 6.33 O ATOM 432 CB PRO A 312 8.864 26.068 7.814 1.00 8.76 C ATOM 433 CG PRO A 312 9.678 26.346 6.582 1.00 15.44 C ATOM 434 CD PRO A 312 10.968 26.916 7.044 1.00 9.57 C ATOM 435 HA PRO A 312 8.646 27.874 9.089 1.00 0.00 H ATOM 436 HD3 PRO A 312 11.707 26.132 7.208 1.00 0.00 H ATOM 437 HD2 PRO A 312 11.358 27.636 6.325 1.00 0.00 H ATOM 438 HG3 PRO A 312 9.159 27.059 5.942 1.00 0.00 H ATOM 439 HG2 PRO A 312 9.851 25.423 6.029 1.00 0.00 H ATOM 440 HB2 PRO A 312 9.029 25.046 8.156 1.00 0.00 H ATOM 441 HB3 PRO A 312 7.803 26.214 7.609 1.00 0.00 H ATOM 442 N ILE A 313 8.493 25.981 10.835 1.00 6.46 N ATOM 443 CA ILE A 313 8.542 25.015 11.915 1.00 3.52 C ATOM 444 C ILE A 313 8.784 23.653 11.274 1.00 5.20 C ATOM 445 O ILE A 313 7.961 23.175 10.480 1.00 5.91 O ATOM 446 CB ILE A 313 7.230 25.008 12.695 1.00 4.86 C ATOM 447 CG1 ILE A 313 6.954 26.407 13.280 1.00 4.50 C ATOM 448 CG2 ILE A 313 7.242 23.932 13.780 1.00 5.46 C ATOM 449 CD1 ILE A 313 8.020 26.904 14.235 1.00 5.87 C ATOM 450 HA ILE A 313 9.334 25.265 12.621 1.00 0.00 H ATOM 451 HB ILE A 313 6.417 24.762 12.012 1.00 0.00 H ATOM 452 HG12 ILE A 313 6.879 27.114 12.454 1.00 0.00 H ATOM 453 HG13 ILE A 313 6.005 26.373 13.815 1.00 0.00 H ATOM 454 HD11 ILE A 313 8.102 26.216 15.076 1.00 0.00 H ATOM 455 HD12 ILE A 313 8.976 26.958 13.714 1.00 0.00 H ATOM 456 HD13 ILE A 313 7.747 27.894 14.599 1.00 0.00 H ATOM 457 HG21 ILE A 313 7.380 22.954 13.319 1.00 0.00 H ATOM 458 HG22 ILE A 313 8.060 24.126 14.474 1.00 0.00 H ATOM 459 HG23 ILE A 313 6.295 23.951 14.319 1.00 0.00 H ATOM 460 H ILE A 313 7.585 26.421 10.582 1.00 0.00 H ATOM 461 N LEU A 314 9.934 23.059 11.564 1.00 3.48 N ATOM 462 CA LEU A 314 10.347 21.811 10.934 1.00 3.75 C ATOM 463 C LEU A 314 10.428 20.680 11.947 1.00 3.65 C ATOM 464 O LEU A 314 10.948 20.850 13.057 1.00 5.55 O ATOM 465 CB LEU A 314 11.731 21.974 10.327 1.00 5.88 C ATOM 466 CG LEU A 314 11.798 22.962 9.177 1.00 7.96 C ATOM 467 CD1 LEU A 314 13.220 23.482 8.999 1.00 15.51 C ATOM 468 CD2 LEU A 314 11.299 22.268 7.918 1.00 8.81 C ATOM 469 HA LEU A 314 9.605 21.572 10.172 1.00 0.00 H ATOM 470 HB2 LEU A 314 12.409 22.315 11.110 1.00 0.00 H ATOM 471 HB3 LEU A 314 12.060 21.001 9.961 1.00 0.00 H ATOM 472 HG LEU A 314 11.166 23.825 9.387 1.00 0.00 H ATOM 473 HD21 LEU A 314 11.930 21.405 7.706 1.00 0.00 H ATOM 474 HD22 LEU A 314 10.271 21.940 8.069 1.00 0.00 H ATOM 475 HD23 LEU A 314 11.340 22.964 7.080 1.00 0.00 H ATOM 476 HD11 LEU A 314 13.540 23.981 9.914 1.00 0.00 H ATOM 477 HD12 LEU A 314 13.887 22.646 8.787 1.00 0.00 H ATOM 478 HD13 LEU A 314 13.246 24.189 8.170 1.00 0.00 H ATOM 479 H LEU A 314 10.563 23.499 12.266 1.00 0.00 H ATOM 480 N ILE A 315 9.952 19.507 11.555 1.00 4.49 N ATOM 481 CA ILE A 315 10.105 18.340 12.399 1.00 5.32 C ATOM 482 C ILE A 315 11.528 17.826 12.263 1.00 4.47 C ATOM 483 O ILE A 315 11.963 17.484 11.156 1.00 5.83 O ATOM 484 CB ILE A 315 9.118 17.236 12.002 1.00 3.74 C ATOM 485 CG1 ILE A 315 7.683 17.737 12.186 1.00 4.45 C ATOM 486 CG2 ILE A 315 9.384 15.982 12.813 1.00 5.70 C ATOM 487 CD1 ILE A 315 6.613 16.712 11.816 1.00 4.60 C ATOM 488 HA ILE A 315 9.897 18.620 13.432 1.00 0.00 H ATOM 489 HB ILE A 315 9.254 16.982 10.951 1.00 0.00 H ATOM 490 HG12 ILE A 315 7.547 18.012 13.232 1.00 0.00 H ATOM 491 HG13 ILE A 315 7.545 18.618 11.559 1.00 0.00 H ATOM 492 HD11 ILE A 315 6.725 16.434 10.768 1.00 0.00 H ATOM 493 HD12 ILE A 315 6.727 15.827 12.442 1.00 0.00 H ATOM 494 HD13 ILE A 315 5.626 17.146 11.975 1.00 0.00 H ATOM 495 HG21 ILE A 315 10.401 15.638 12.625 1.00 0.00 H ATOM 496 HG22 ILE A 315 9.265 16.205 13.873 1.00 0.00 H ATOM 497 HG23 ILE A 315 8.677 15.206 12.522 1.00 0.00 H ATOM 498 H ILE A 315 9.467 19.424 10.639 1.00 0.00 H ATOM 499 N SER A 316 12.240 17.752 13.382 1.00 4.51 N ATOM 500 CA SER A 316 13.609 17.254 13.365 1.00 5.45 C ATOM 501 C SER A 316 13.738 15.857 13.965 1.00 5.08 C ATOM 502 O SER A 316 14.745 15.186 13.744 1.00 7.36 O ATOM 503 CB SER A 316 14.551 18.225 14.077 1.00 6.90 C ATOM 504 OG SER A 316 14.151 18.405 15.414 1.00 7.49 O ATOM 505 HA SER A 316 13.897 17.180 12.316 1.00 0.00 H ATOM 506 HB2 SER A 316 14.532 19.186 13.563 1.00 0.00 H ATOM 507 HB3 SER A 316 15.564 17.824 14.056 1.00 0.00 H ATOM 508 HG SER A 316 14.770 19.035 15.860 1.00 0.00 H ATOM 509 H SER A 316 11.815 18.053 14.282 1.00 0.00 H ATOM 510 N GLU A 317 12.739 15.436 14.741 1.00 3.79 N ATOM 511 CA GLU A 317 12.701 14.081 15.288 1.00 4.22 C ATOM 512 C GLU A 317 11.269 13.569 15.301 1.00 3.84 C ATOM 513 O GLU A 317 10.322 14.330 15.517 1.00 4.48 O ATOM 514 CB GLU A 317 13.247 14.029 16.722 1.00 4.97 C ATOM 515 CG GLU A 317 14.582 14.727 16.947 1.00 8.71 C ATOM 516 CD GLU A 317 15.749 14.008 16.300 1.00 13.18 C ATOM 517 OE1 GLU A 317 15.589 12.829 15.923 1.00 11.84 O ATOM 518 OE2 GLU A 317 16.828 14.628 16.170 1.00 12.17 O ATOM 519 HA GLU A 317 13.328 13.457 14.651 1.00 0.00 H ATOM 520 HB2 GLU A 317 12.511 14.494 17.378 1.00 0.00 H ATOM 521 HB3 GLU A 317 13.366 12.981 16.997 1.00 0.00 H ATOM 522 HG2 GLU A 317 14.521 15.733 16.532 1.00 0.00 H ATOM 523 HG3 GLU A 317 14.765 14.788 18.020 1.00 0.00 H ATOM 524 H GLU A 317 11.963 16.092 14.964 1.00 0.00 H ATOM 525 N ILE A 318 11.126 12.270 15.063 1.00 5.30 N ATOM 526 CA ILE A 318 9.877 11.552 15.322 1.00 5.59 C ATOM 527 C ILE A 318 10.237 10.509 16.382 1.00 5.89 C ATOM 528 O ILE A 318 10.996 9.582 16.101 1.00 6.81 O ATOM 529 CB ILE A 318 9.336 10.866 14.048 1.00 4.79 C ATOM 530 CG1 ILE A 318 8.937 11.910 12.991 1.00 5.91 C ATOM 531 CG2 ILE A 318 8.165 9.934 14.382 1.00 8.38 C ATOM 532 CD1 ILE A 318 7.691 12.743 13.342 1.00 7.16 C ATOM 533 HA ILE A 318 9.089 12.230 15.651 1.00 0.00 H ATOM 534 HB ILE A 318 10.134 10.255 13.626 1.00 0.00 H ATOM 535 HG12 ILE A 318 9.775 12.594 12.857 1.00 0.00 H ATOM 536 HG13 ILE A 318 8.743 11.387 12.055 1.00 0.00 H ATOM 537 HD11 ILE A 318 6.835 12.079 13.467 1.00 0.00 H ATOM 538 HD12 ILE A 318 7.869 13.287 14.270 1.00 0.00 H ATOM 539 HD13 ILE A 318 7.490 13.450 12.537 1.00 0.00 H ATOM 540 HG21 ILE A 318 8.501 9.166 15.078 1.00 0.00 H ATOM 541 HG22 ILE A 318 7.361 10.512 14.837 1.00 0.00 H ATOM 542 HG23 ILE A 318 7.804 9.464 13.467 1.00 0.00 H ATOM 543 H ILE A 318 11.934 11.742 14.677 1.00 0.00 H ATOM 544 N HIS A 319 9.741 10.660 17.600 1.00 4.06 N ATOM 545 CA HIS A 319 10.158 9.768 18.669 1.00 3.76 C ATOM 546 C HIS A 319 9.440 8.430 18.621 1.00 4.17 C ATOM 547 O HIS A 319 8.229 8.379 18.475 1.00 4.85 O ATOM 548 CB HIS A 319 10.014 10.490 20.001 1.00 5.21 C ATOM 549 CG HIS A 319 10.863 11.720 20.062 1.00 7.92 C ATOM 550 ND1 HIS A 319 10.336 12.993 20.143 1.00 14.30 N ATOM 551 CD2 HIS A 319 12.206 11.877 19.963 1.00 8.87 C ATOM 552 CE1 HIS A 319 11.317 13.876 20.129 1.00 10.93 C ATOM 553 NE2 HIS A 319 12.463 13.224 20.026 1.00 15.69 N ATOM 554 HA HIS A 319 11.209 9.513 18.536 1.00 0.00 H ATOM 555 HB2 HIS A 319 8.971 10.774 20.137 1.00 0.00 H ATOM 556 HB3 HIS A 319 10.313 9.815 20.803 1.00 0.00 H ATOM 557 HD2 HIS A 319 12.944 11.082 19.854 1.00 0.00 H ATOM 558 HE1 HIS A 319 11.202 14.958 20.192 1.00 0.00 H ATOM 559 H HIS A 319 9.053 11.416 17.792 1.00 0.00 H ATOM 560 N PRO A 320 10.200 7.331 18.703 1.00 3.16 N ATOM 561 CA PRO A 320 9.596 6.021 18.442 1.00 3.45 C ATOM 562 C PRO A 320 8.500 5.672 19.420 1.00 3.68 C ATOM 563 O PRO A 320 8.651 5.842 20.626 1.00 4.81 O ATOM 564 CB PRO A 320 10.773 5.047 18.589 1.00 6.07 C ATOM 565 CG PRO A 320 11.790 5.785 19.407 1.00 7.30 C ATOM 566 CD PRO A 320 11.636 7.228 19.008 1.00 5.92 C ATOM 567 HA PRO A 320 9.115 5.991 17.464 1.00 0.00 H ATOM 568 HD3 PRO A 320 11.913 7.893 19.826 1.00 0.00 H ATOM 569 HD2 PRO A 320 12.241 7.460 18.132 1.00 0.00 H ATOM 570 HG3 PRO A 320 12.795 5.430 19.181 1.00 0.00 H ATOM 571 HG2 PRO A 320 11.592 5.658 20.471 1.00 0.00 H ATOM 572 HB2 PRO A 320 10.456 4.138 19.100 1.00 0.00 H ATOM 573 HB3 PRO A 320 11.181 4.789 17.612 1.00 0.00 H ATOM 574 N GLY A 321 7.387 5.189 18.881 1.00 3.46 N ATOM 575 CA GLY A 321 6.281 4.719 19.697 1.00 4.26 C ATOM 576 C GLY A 321 5.338 5.776 20.254 1.00 3.85 C ATOM 577 O GLY A 321 4.318 5.434 20.856 1.00 5.61 O ATOM 578 HA3 GLY A 321 6.703 4.175 20.542 1.00 0.00 H ATOM 579 HA2 GLY A 321 5.688 4.037 19.087 1.00 0.00 H ATOM 580 H GLY A 321 7.305 5.146 17.845 1.00 0.00 H ATOM 581 N GLN A 322 5.658 7.047 20.041 1.00 2.62 N ATOM 582 CA GLN A 322 4.812 8.133 20.527 1.00 3.67 C ATOM 583 C GLN A 322 3.827 8.562 19.429 1.00 2.56 C ATOM 584 O GLN A 322 3.893 8.050 18.317 1.00 4.62 O ATOM 585 CB GLN A 322 5.675 9.272 21.077 1.00 3.60 C ATOM 586 CG GLN A 322 6.496 8.831 22.289 1.00 3.26 C ATOM 587 CD GLN A 322 5.635 8.240 23.395 1.00 4.39 C ATOM 588 OE1 GLN A 322 4.660 8.849 23.838 1.00 6.48 O ATOM 589 NE2 GLN A 322 5.995 7.041 23.847 1.00 9.17 N ATOM 590 HA GLN A 322 4.202 7.794 21.364 1.00 0.00 H ATOM 591 HB2 GLN A 322 6.355 9.609 20.294 1.00 0.00 H ATOM 592 HB3 GLN A 322 5.025 10.096 21.372 1.00 0.00 H ATOM 593 HG2 GLN A 322 7.217 8.079 21.968 1.00 0.00 H ATOM 594 HG3 GLN A 322 7.027 9.696 22.685 1.00 0.00 H ATOM 595 HE22 GLN A 322 6.826 6.562 23.445 1.00 0.00 H ATOM 596 HE21 GLN A 322 5.446 6.584 24.602 1.00 0.00 H ATOM 597 H GLN A 322 6.528 7.273 19.518 1.00 0.00 H ATOM 598 N PRO A 323 2.880 9.466 19.745 1.00 1.84 N ATOM 599 CA PRO A 323 1.753 9.653 18.816 1.00 1.64 C ATOM 600 C PRO A 323 2.099 9.983 17.367 1.00 2.75 C ATOM 601 O PRO A 323 1.443 9.451 16.468 1.00 3.52 O ATOM 602 CB PRO A 323 0.917 10.746 19.493 1.00 2.01 C ATOM 603 CG PRO A 323 1.163 10.488 20.960 1.00 4.11 C ATOM 604 CD PRO A 323 2.638 10.150 21.031 1.00 2.86 C ATOM 605 HA PRO A 323 1.227 8.709 18.672 1.00 0.00 H ATOM 606 HD3 PRO A 323 3.244 11.052 21.116 1.00 0.00 H ATOM 607 HD2 PRO A 323 2.850 9.491 21.873 1.00 0.00 H ATOM 608 HG3 PRO A 323 0.557 9.654 21.314 1.00 0.00 H ATOM 609 HG2 PRO A 323 0.940 11.375 21.552 1.00 0.00 H ATOM 610 HB2 PRO A 323 1.260 11.740 19.205 1.00 0.00 H ATOM 611 HB3 PRO A 323 -0.140 10.643 19.247 1.00 0.00 H ATOM 612 N ALA A 324 3.100 10.810 17.115 1.00 2.39 N ATOM 613 CA ALA A 324 3.432 11.137 15.729 1.00 2.77 C ATOM 614 C ALA A 324 3.936 9.907 14.979 1.00 2.73 C ATOM 615 O ALA A 324 3.559 9.690 13.819 1.00 4.09 O ATOM 616 CB ALA A 324 4.441 12.287 15.647 1.00 4.06 C ATOM 617 HA ALA A 324 2.515 11.473 15.244 1.00 0.00 H ATOM 618 HB1 ALA A 324 4.018 13.174 16.119 1.00 0.00 H ATOM 619 HB2 ALA A 324 5.358 12.002 16.163 1.00 0.00 H ATOM 620 HB3 ALA A 324 4.662 12.501 14.601 1.00 0.00 H ATOM 621 H ALA A 324 3.647 11.224 17.897 1.00 0.00 H ATOM 622 N ASP A 325 4.753 9.083 15.634 1.00 2.84 N ATOM 623 CA ASP A 325 5.237 7.859 15.019 1.00 2.54 C ATOM 624 C ASP A 325 4.053 6.947 14.724 1.00 2.53 C ATOM 625 O ASP A 325 3.923 6.398 13.619 1.00 3.88 O ATOM 626 CB ASP A 325 6.232 7.172 15.957 1.00 3.01 C ATOM 627 CG ASP A 325 6.918 5.977 15.320 1.00 4.28 C ATOM 628 OD1 ASP A 325 7.116 5.983 14.091 1.00 5.28 O ATOM 629 OD2 ASP A 325 7.239 5.034 16.077 1.00 6.19 O ATOM 630 HA ASP A 325 5.748 8.087 14.083 1.00 0.00 H ATOM 631 HB2 ASP A 325 6.993 7.896 16.247 1.00 0.00 H ATOM 632 HB3 ASP A 325 5.697 6.834 16.844 1.00 0.00 H ATOM 633 H ASP A 325 5.049 9.320 16.602 1.00 0.00 H ATOM 634 N ARG A 326 3.173 6.800 15.709 1.00 2.69 N ATOM 635 CA ARG A 326 2.033 5.907 15.551 1.00 2.22 C ATOM 636 C ARG A 326 1.054 6.338 14.456 1.00 2.90 C ATOM 637 O ARG A 326 0.433 5.485 13.802 1.00 3.86 O ATOM 638 CB ARG A 326 1.290 5.733 16.876 1.00 3.82 C ATOM 639 CG ARG A 326 2.177 5.287 18.025 1.00 3.04 C ATOM 640 CD ARG A 326 1.366 4.769 19.214 1.00 4.38 C ATOM 641 NE ARG A 326 0.401 5.718 19.771 1.00 5.57 N ATOM 642 CZ ARG A 326 0.574 6.416 20.896 1.00 3.91 C ATOM 643 NH1 ARG A 326 1.709 6.335 21.571 1.00 5.81 N ATOM 644 NH2 ARG A 326 -0.408 7.198 21.328 1.00 6.60 N ATOM 645 HA ARG A 326 2.452 4.952 15.233 1.00 0.00 H ATOM 646 HB2 ARG A 326 0.836 6.687 17.143 1.00 0.00 H ATOM 647 HB3 ARG A 326 0.508 4.987 16.736 1.00 0.00 H ATOM 648 HG2 ARG A 326 2.833 4.491 17.674 1.00 0.00 H ATOM 649 HG3 ARG A 326 2.779 6.134 18.353 1.00 0.00 H ATOM 650 HD2 ARG A 326 2.064 4.494 20.005 1.00 0.00 H ATOM 651 HD3 ARG A 326 0.820 3.883 18.890 1.00 0.00 H ATOM 652 HE ARG A 326 -0.488 5.860 19.250 1.00 0.00 H ATOM 653 HH12 ARG A 326 1.834 6.883 22.446 1.00 0.00 H ATOM 654 HH11 ARG A 326 2.476 5.724 21.226 1.00 0.00 H ATOM 655 HH22 ARG A 326 -0.288 7.748 22.203 1.00 0.00 H ATOM 656 HH21 ARG A 326 -1.297 7.261 20.792 1.00 0.00 H ATOM 657 H ARG A 326 3.299 7.325 16.598 1.00 0.00 H ATOM 658 N CYS A 327 0.906 7.646 14.237 1.00 3.57 N ATOM 659 CA CYS A 327 -0.069 8.105 13.250 1.00 3.95 C ATOM 660 C CYS A 327 0.362 7.733 11.839 1.00 4.76 C ATOM 661 O CYS A 327 -0.475 7.624 10.950 1.00 4.79 O ATOM 662 CB CYS A 327 -0.378 9.613 13.367 1.00 5.61 C ATOM 663 SG CYS A 327 0.711 10.773 12.486 1.00 5.14 S ATOM 664 HA CYS A 327 -1.002 7.585 13.469 1.00 0.00 H ATOM 665 HB2 CYS A 327 -0.341 9.872 14.425 1.00 0.00 H ATOM 666 HB3 CYS A 327 -1.390 9.768 12.992 1.00 0.00 H ATOM 667 HG CYS A 327 2.003 10.631 12.950 1.00 0.00 H ATOM 668 H CYS A 327 1.480 8.334 14.765 1.00 0.00 H ATOM 669 N GLY A 328 1.667 7.582 11.634 1.00 3.40 N ATOM 670 CA GLY A 328 2.189 7.087 10.366 1.00 3.85 C ATOM 671 C GLY A 328 2.494 8.108 9.275 1.00 5.64 C ATOM 672 O GLY A 328 3.223 7.803 8.341 1.00 6.43 O ATOM 673 HA3 GLY A 328 1.455 6.389 9.962 1.00 0.00 H ATOM 674 HA2 GLY A 328 3.115 6.554 10.581 1.00 0.00 H ATOM 675 H GLY A 328 2.332 7.823 12.397 1.00 0.00 H ATOM 676 N GLY A 329 1.948 9.315 9.386 1.00 5.08 N ATOM 677 CA GLY A 329 2.040 10.277 8.296 1.00 4.50 C ATOM 678 C GLY A 329 2.929 11.480 8.504 1.00 5.25 C ATOM 679 O GLY A 329 2.955 12.362 7.649 1.00 6.42 O ATOM 680 HA3 GLY A 329 1.033 10.645 8.098 1.00 0.00 H ATOM 681 HA2 GLY A 329 2.410 9.744 7.420 1.00 0.00 H ATOM 682 H GLY A 329 1.450 9.575 10.261 1.00 0.00 H ATOM 683 N LEU A 330 3.642 11.543 9.625 1.00 3.23 N ATOM 684 CA LEU A 330 4.529 12.668 9.936 1.00 4.99 C ATOM 685 C LEU A 330 5.968 12.194 9.944 1.00 5.27 C ATOM 686 O LEU A 330 6.280 11.166 10.553 1.00 6.59 O ATOM 687 CB LEU A 330 4.212 13.259 11.308 1.00 4.78 C ATOM 688 CG LEU A 330 2.832 13.898 11.445 1.00 4.77 C ATOM 689 CD1 LEU A 330 2.633 14.382 12.872 1.00 7.26 C ATOM 690 CD2 LEU A 330 2.679 15.048 10.473 1.00 6.37 C ATOM 691 HA LEU A 330 4.378 13.432 9.174 1.00 0.00 H ATOM 692 HB2 LEU A 330 4.286 12.459 12.044 1.00 0.00 H ATOM 693 HB3 LEU A 330 4.959 14.022 11.526 1.00 0.00 H ATOM 694 HG LEU A 330 2.072 13.152 11.211 1.00 0.00 H ATOM 695 HD21 LEU A 330 3.440 15.801 10.680 1.00 0.00 H ATOM 696 HD22 LEU A 330 2.799 14.679 9.454 1.00 0.00 H ATOM 697 HD23 LEU A 330 1.689 15.489 10.587 1.00 0.00 H ATOM 698 HD11 LEU A 330 2.710 13.536 13.555 1.00 0.00 H ATOM 699 HD12 LEU A 330 3.399 15.118 13.115 1.00 0.00 H ATOM 700 HD13 LEU A 330 1.647 14.837 12.966 1.00 0.00 H ATOM 701 H LEU A 330 3.567 10.763 10.308 1.00 0.00 H ATOM 702 N HIS A 331 6.854 12.960 9.313 1.00 4.76 N ATOM 703 CA HIS A 331 8.230 12.510 9.149 1.00 5.04 C ATOM 704 C HIS A 331 9.239 13.616 9.342 1.00 3.74 C ATOM 705 O HIS A 331 8.935 14.798 9.160 1.00 4.40 O ATOM 706 CB HIS A 331 8.410 11.883 7.772 1.00 7.40 C ATOM 707 CG HIS A 331 7.335 10.903 7.435 1.00 5.47 C ATOM 708 ND1 HIS A 331 7.242 9.675 8.051 1.00 9.04 N ATOM 709 CD2 HIS A 331 6.285 10.983 6.584 1.00 8.65 C ATOM 710 CE1 HIS A 331 6.184 9.033 7.586 1.00 9.41 C ATOM 711 NE2 HIS A 331 5.592 9.799 6.688 1.00 9.41 N ATOM 712 HA HIS A 331 8.415 11.770 9.928 1.00 0.00 H ATOM 713 HB2 HIS A 331 8.404 12.677 7.025 1.00 0.00 H ATOM 714 HB3 HIS A 331 9.371 11.368 7.747 1.00 0.00 H ATOM 715 HD2 HIS A 331 6.036 11.826 5.939 1.00 0.00 H ATOM 716 HE1 HIS A 331 5.856 8.040 7.892 1.00 0.00 H ATOM 717 H HIS A 331 6.563 13.884 8.935 1.00 0.00 H ATOM 718 N VAL A 332 10.456 13.222 9.708 1.00 4.80 N ATOM 719 CA VAL A 332 11.545 14.176 9.824 1.00 4.52 C ATOM 720 C VAL A 332 11.725 14.934 8.509 1.00 5.72 C ATOM 721 O VAL A 332 11.723 14.339 7.423 1.00 7.15 O ATOM 722 CB VAL A 332 12.863 13.487 10.242 1.00 5.44 C ATOM 723 CG1 VAL A 332 14.047 14.453 10.115 1.00 8.25 C ATOM 724 CG2 VAL A 332 12.747 12.928 11.657 1.00 7.97 C ATOM 725 HA VAL A 332 11.286 14.887 10.608 1.00 0.00 H ATOM 726 HB VAL A 332 13.048 12.652 9.566 1.00 0.00 H ATOM 727 HG11 VAL A 332 14.135 14.783 9.080 1.00 0.00 H ATOM 728 HG12 VAL A 332 13.881 15.316 10.760 1.00 0.00 H ATOM 729 HG13 VAL A 332 14.963 13.944 10.415 1.00 0.00 H ATOM 730 HG21 VAL A 332 12.536 13.741 12.351 1.00 0.00 H ATOM 731 HG22 VAL A 332 11.938 12.198 11.693 1.00 0.00 H ATOM 732 HG23 VAL A 332 13.685 12.446 11.934 1.00 0.00 H ATOM 733 H VAL A 332 10.630 12.217 9.914 1.00 0.00 H ATOM 734 N GLY A 333 11.857 16.253 8.606 1.00 3.71 N ATOM 735 CA GLY A 333 11.976 17.083 7.428 1.00 5.58 C ATOM 736 C GLY A 333 10.673 17.727 7.014 1.00 5.23 C ATOM 737 O GLY A 333 10.684 18.681 6.229 1.00 8.71 O ATOM 738 HA3 GLY A 333 12.334 16.465 6.604 1.00 0.00 H ATOM 739 HA2 GLY A 333 12.702 17.870 7.632 1.00 0.00 H ATOM 740 H GLY A 333 11.875 16.696 9.547 1.00 0.00 H ATOM 741 N ASP A 334 9.545 17.228 7.519 1.00 4.34 N ATOM 742 CA ASP A 334 8.266 17.889 7.265 1.00 5.49 C ATOM 743 C ASP A 334 8.230 19.274 7.893 1.00 4.93 C ATOM 744 O ASP A 334 8.640 19.456 9.050 1.00 5.91 O ATOM 745 CB ASP A 334 7.090 17.089 7.837 1.00 5.66 C ATOM 746 CG ASP A 334 6.721 15.888 6.990 1.00 5.89 C ATOM 747 OD1 ASP A 334 7.101 15.824 5.794 1.00 5.96 O ATOM 748 OD2 ASP A 334 6.031 15.002 7.535 1.00 4.93 O ATOM 749 HA ASP A 334 8.171 17.961 6.182 1.00 0.00 H ATOM 750 HB2 ASP A 334 7.359 16.741 8.834 1.00 0.00 H ATOM 751 HB3 ASP A 334 6.223 17.746 7.904 1.00 0.00 H ATOM 752 H ASP A 334 9.575 16.364 8.097 1.00 0.00 H ATOM 753 N ALA A 335 7.749 20.246 7.125 1.00 3.98 N ATOM 754 CA ALA A 335 7.402 21.547 7.677 1.00 3.89 C ATOM 755 C ALA A 335 5.950 21.501 8.116 1.00 4.84 C ATOM 756 O ALA A 335 5.090 20.978 7.390 1.00 5.67 O ATOM 757 CB ALA A 335 7.606 22.650 6.648 1.00 4.83 C ATOM 758 HA ALA A 335 8.049 21.768 8.526 1.00 0.00 H ATOM 759 HB1 ALA A 335 8.651 22.669 6.340 1.00 0.00 H ATOM 760 HB2 ALA A 335 6.974 22.458 5.781 1.00 0.00 H ATOM 761 HB3 ALA A 335 7.339 23.610 7.089 1.00 0.00 H ATOM 762 H ALA A 335 7.618 20.073 6.108 1.00 0.00 H ATOM 763 N ILE A 336 5.676 22.016 9.312 1.00 4.03 N ATOM 764 CA ILE A 336 4.307 22.066 9.804 1.00 4.58 C ATOM 765 C ILE A 336 3.686 23.395 9.404 1.00 4.66 C ATOM 766 O ILE A 336 4.031 24.462 9.935 1.00 5.18 O ATOM 767 CB ILE A 336 4.195 21.865 11.337 1.00 3.33 C ATOM 768 CG1 ILE A 336 4.939 20.608 11.783 1.00 4.15 C ATOM 769 CG2 ILE A 336 2.728 21.762 11.727 1.00 5.57 C ATOM 770 CD1 ILE A 336 4.955 20.397 13.297 1.00 5.51 C ATOM 771 HA ILE A 336 3.768 21.234 9.350 1.00 0.00 H ATOM 772 HB ILE A 336 4.651 22.722 11.833 1.00 0.00 H ATOM 773 HG12 ILE A 336 4.460 19.744 11.322 1.00 0.00 H ATOM 774 HG13 ILE A 336 5.970 20.679 11.436 1.00 0.00 H ATOM 775 HD11 ILE A 336 5.443 21.246 13.776 1.00 0.00 H ATOM 776 HD12 ILE A 336 3.931 20.311 13.661 1.00 0.00 H ATOM 777 HD13 ILE A 336 5.503 19.484 13.530 1.00 0.00 H ATOM 778 HG21 ILE A 336 2.212 22.678 11.441 1.00 0.00 H ATOM 779 HG22 ILE A 336 2.276 20.913 11.214 1.00 0.00 H ATOM 780 HG23 ILE A 336 2.649 21.621 12.805 1.00 0.00 H ATOM 781 H ILE A 336 6.448 22.387 9.902 1.00 0.00 H ATOM 782 N LEU A 337 2.762 23.322 8.461 1.00 5.50 N ATOM 783 CA LEU A 337 2.118 24.513 7.929 1.00 4.70 C ATOM 784 C LEU A 337 0.958 24.974 8.795 1.00 3.54 C ATOM 785 O LEU A 337 0.702 26.171 8.906 1.00 6.17 O ATOM 786 CB LEU A 337 1.645 24.269 6.486 1.00 4.05 C ATOM 787 CG LEU A 337 2.717 23.766 5.517 1.00 5.12 C ATOM 788 CD1 LEU A 337 2.109 23.474 4.149 1.00 11.74 C ATOM 789 CD2 LEU A 337 3.872 24.747 5.400 1.00 10.03 C ATOM 790 HA LEU A 337 2.861 25.310 7.932 1.00 0.00 H ATOM 791 HB2 LEU A 337 0.845 23.529 6.515 1.00 0.00 H ATOM 792 HB3 LEU A 337 1.255 25.209 6.097 1.00 0.00 H ATOM 793 HG LEU A 337 3.120 22.837 5.921 1.00 0.00 H ATOM 794 HD21 LEU A 337 3.499 25.704 5.034 1.00 0.00 H ATOM 795 HD22 LEU A 337 4.331 24.885 6.379 1.00 0.00 H ATOM 796 HD23 LEU A 337 4.612 24.354 4.703 1.00 0.00 H ATOM 797 HD11 LEU A 337 1.338 22.710 4.251 1.00 0.00 H ATOM 798 HD12 LEU A 337 1.668 24.386 3.747 1.00 0.00 H ATOM 799 HD13 LEU A 337 2.888 23.118 3.475 1.00 0.00 H ATOM 800 H LEU A 337 2.489 22.390 8.090 1.00 0.00 H ATOM 801 N ALA A 338 0.252 24.033 9.408 1.00 4.38 N ATOM 802 CA ALA A 338 -0.900 24.349 10.240 1.00 4.18 C ATOM 803 C ALA A 338 -1.238 23.168 11.135 1.00 5.11 C ATOM 804 O ALA A 338 -0.927 22.018 10.803 1.00 5.04 O ATOM 805 CB ALA A 338 -2.111 24.708 9.365 1.00 6.19 C ATOM 806 HA ALA A 338 -0.652 25.208 10.864 1.00 0.00 H ATOM 807 HB1 ALA A 338 -1.869 25.574 8.749 1.00 0.00 H ATOM 808 HB2 ALA A 338 -2.357 23.862 8.723 1.00 0.00 H ATOM 809 HB3 ALA A 338 -2.963 24.941 10.004 1.00 0.00 H ATOM 810 H ALA A 338 0.530 23.038 9.290 1.00 0.00 H ATOM 811 N VAL A 339 -1.873 23.456 12.265 1.00 4.93 N ATOM 812 CA VAL A 339 -2.390 22.418 13.143 1.00 4.56 C ATOM 813 C VAL A 339 -3.807 22.798 13.583 1.00 5.88 C ATOM 814 O VAL A 339 -4.042 23.914 14.068 1.00 6.14 O ATOM 815 CB VAL A 339 -1.442 22.160 14.347 1.00 3.78 C ATOM 816 CG1 VAL A 339 -1.368 23.390 15.248 1.00 5.15 C ATOM 817 CG2 VAL A 339 -1.879 20.917 15.120 1.00 6.58 C ATOM 818 HA VAL A 339 -2.438 21.474 12.599 1.00 0.00 H ATOM 819 HB VAL A 339 -0.438 21.973 13.966 1.00 0.00 H ATOM 820 HG11 VAL A 339 -0.989 24.236 14.675 1.00 0.00 H ATOM 821 HG12 VAL A 339 -2.364 23.622 15.626 1.00 0.00 H ATOM 822 HG13 VAL A 339 -0.699 23.187 16.084 1.00 0.00 H ATOM 823 HG21 VAL A 339 -2.893 21.061 15.493 1.00 0.00 H ATOM 824 HG22 VAL A 339 -1.853 20.051 14.458 1.00 0.00 H ATOM 825 HG23 VAL A 339 -1.201 20.755 15.958 1.00 0.00 H ATOM 826 H VAL A 339 -2.005 24.453 12.530 1.00 0.00 H ATOM 827 N ASN A 340 -4.752 21.879 13.402 1.00 6.11 N ATOM 828 CA ASN A 340 -6.162 22.161 13.668 1.00 5.90 C ATOM 829 C ASN A 340 -6.597 23.506 13.088 1.00 6.02 C ATOM 830 O ASN A 340 -7.316 24.268 13.742 1.00 9.43 O ATOM 831 CB ASN A 340 -6.478 22.068 15.171 1.00 7.28 C ATOM 832 CG ASN A 340 -6.539 20.632 15.665 1.00 6.62 C ATOM 833 OD1 ASN A 340 -6.840 19.713 14.900 1.00 6.79 O ATOM 834 ND2 ASN A 340 -6.289 20.437 16.947 1.00 6.38 N ATOM 835 HA ASN A 340 -6.743 21.392 13.159 1.00 0.00 H ATOM 836 HB2 ASN A 340 -5.702 22.596 15.725 1.00 0.00 H ATOM 837 HB3 ASN A 340 -7.442 22.543 15.356 1.00 0.00 H ATOM 838 HD22 ASN A 340 -6.039 21.242 17.556 1.00 0.00 H ATOM 839 HD21 ASN A 340 -6.343 19.479 17.347 1.00 0.00 H ATOM 840 H ASN A 340 -4.480 20.934 13.062 1.00 0.00 H ATOM 841 N GLY A 341 -6.134 23.804 11.875 1.00 7.21 N ATOM 842 CA GLY A 341 -6.511 25.027 11.183 1.00 11.10 C ATOM 843 C GLY A 341 -5.748 26.278 11.583 1.00 11.44 C ATOM 844 O GLY A 341 -5.976 27.347 11.015 1.00 14.47 O ATOM 845 HA3 GLY A 341 -7.569 25.206 11.373 1.00 0.00 H ATOM 846 HA2 GLY A 341 -6.357 24.868 10.116 1.00 0.00 H ATOM 847 H GLY A 341 -5.482 23.141 11.408 1.00 0.00 H ATOM 848 N VAL A 342 -4.846 26.165 12.555 1.00 9.27 N ATOM 849 CA VAL A 342 -4.027 27.304 12.970 1.00 9.76 C ATOM 850 C VAL A 342 -2.754 27.374 12.129 1.00 11.60 C ATOM 851 O VAL A 342 -1.912 26.479 12.200 1.00 8.61 O ATOM 852 CB VAL A 342 -3.640 27.210 14.449 1.00 9.12 C ATOM 853 CG1 VAL A 342 -2.853 28.441 14.880 1.00 10.71 C ATOM 854 CG2 VAL A 342 -4.885 27.059 15.320 1.00 9.10 C ATOM 855 HA VAL A 342 -4.624 28.204 12.821 1.00 0.00 H ATOM 856 HB VAL A 342 -3.010 26.330 14.577 1.00 0.00 H ATOM 857 HG11 VAL A 342 -1.945 28.518 14.282 1.00 0.00 H ATOM 858 HG12 VAL A 342 -3.464 29.332 14.731 1.00 0.00 H ATOM 859 HG13 VAL A 342 -2.589 28.351 15.934 1.00 0.00 H ATOM 860 HG21 VAL A 342 -5.533 27.923 15.178 1.00 0.00 H ATOM 861 HG22 VAL A 342 -5.418 26.152 15.035 1.00 0.00 H ATOM 862 HG23 VAL A 342 -4.589 26.994 16.367 1.00 0.00 H ATOM 863 H VAL A 342 -4.721 25.248 13.029 1.00 0.00 H ATOM 864 N ASN A 343 -2.609 28.439 11.341 1.00 7.65 N ATOM 865 CA ASN A 343 -1.457 28.623 10.472 1.00 6.91 C ATOM 866 C ASN A 343 -0.198 28.791 11.306 1.00 11.41 C ATOM 867 O ASN A 343 -0.162 29.600 12.227 1.00 13.70 O ATOM 868 CB ASN A 343 -1.655 29.856 9.574 1.00 10.46 C ATOM 869 CG ASN A 343 -0.643 29.940 8.449 1.00 14.86 C ATOM 870 OD1 ASN A 343 0.482 29.470 8.564 1.00 24.77 O ATOM 871 ND2 ASN A 343 -1.052 30.540 7.338 1.00 26.73 N ATOM 872 HA ASN A 343 -1.354 27.741 9.840 1.00 0.00 H ATOM 873 HB2 ASN A 343 -2.654 29.813 9.140 1.00 0.00 H ATOM 874 HB3 ASN A 343 -1.566 30.752 10.189 1.00 0.00 H ATOM 875 HD22 ASN A 343 -2.016 30.926 7.280 1.00 0.00 H ATOM 876 HD21 ASN A 343 -0.409 30.624 6.525 1.00 0.00 H ATOM 877 H ASN A 343 -3.350 29.169 11.348 1.00 0.00 H ATOM 878 N LEU A 344 0.826 28.013 10.988 1.00 7.95 N ATOM 879 CA LEU A 344 2.102 28.099 11.676 1.00 7.37 C ATOM 880 C LEU A 344 3.217 28.572 10.766 1.00 8.99 C ATOM 881 O LEU A 344 4.380 28.506 11.135 1.00 10.44 O ATOM 882 CB LEU A 344 2.480 26.735 12.243 1.00 7.19 C ATOM 883 CG LEU A 344 1.549 26.157 13.303 1.00 5.48 C ATOM 884 CD1 LEU A 344 2.037 24.770 13.702 1.00 9.34 C ATOM 885 CD2 LEU A 344 1.489 27.070 14.512 1.00 11.40 C ATOM 886 HA LEU A 344 1.982 28.830 12.476 1.00 0.00 H ATOM 887 HB2 LEU A 344 2.516 26.029 11.413 1.00 0.00 H ATOM 888 HB3 LEU A 344 3.472 26.824 12.686 1.00 0.00 H ATOM 889 HG LEU A 344 0.543 26.077 12.892 1.00 0.00 H ATOM 890 HD21 LEU A 344 2.488 27.175 14.936 1.00 0.00 H ATOM 891 HD22 LEU A 344 1.117 28.049 14.209 1.00 0.00 H ATOM 892 HD23 LEU A 344 0.820 26.640 15.257 1.00 0.00 H ATOM 893 HD11 LEU A 344 2.040 24.121 12.826 1.00 0.00 H ATOM 894 HD12 LEU A 344 3.047 24.844 14.105 1.00 0.00 H ATOM 895 HD13 LEU A 344 1.372 24.356 14.460 1.00 0.00 H ATOM 896 H LEU A 344 0.713 27.319 10.222 1.00 0.00 H ATOM 897 N ARG A 345 2.877 29.059 9.575 1.00 9.06 N ATOM 898 CA ARG A 345 3.907 29.420 8.604 1.00 12.97 C ATOM 899 C ARG A 345 4.706 30.671 8.975 1.00 9.49 C ATOM 900 O ARG A 345 5.841 30.833 8.523 1.00 15.98 O ATOM 901 CB ARG A 345 3.315 29.549 7.196 1.00 12.65 C ATOM 902 CG ARG A 345 2.809 28.225 6.636 1.00 11.55 C ATOM 903 CD ARG A 345 2.265 28.383 5.230 1.00 19.28 C ATOM 904 NE ARG A 345 3.324 28.714 4.282 1.00 21.41 N ATOM 905 CZ ARG A 345 3.106 29.075 3.021 1.00 34.83 C ATOM 906 NH1 ARG A 345 1.864 29.156 2.560 1.00 32.60 N ATOM 907 NH2 ARG A 345 4.127 29.361 2.223 1.00 39.87 N ATOM 908 HA ARG A 345 4.622 28.597 8.618 1.00 0.00 H ATOM 909 HB2 ARG A 345 2.482 30.251 7.233 1.00 0.00 H ATOM 910 HB3 ARG A 345 4.086 29.936 6.529 1.00 0.00 H ATOM 911 HG2 ARG A 345 3.632 27.511 6.619 1.00 0.00 H ATOM 912 HG3 ARG A 345 2.016 27.848 7.282 1.00 0.00 H ATOM 913 HD2 ARG A 345 1.522 29.181 5.225 1.00 0.00 H ATOM 914 HD3 ARG A 345 1.795 27.448 4.924 1.00 0.00 H ATOM 915 HE ARG A 345 4.309 28.665 4.613 1.00 0.00 H ATOM 916 HH12 ARG A 345 1.693 29.438 1.574 1.00 0.00 H ATOM 917 HH11 ARG A 345 1.062 28.937 3.185 1.00 0.00 H ATOM 918 HH22 ARG A 345 3.953 29.643 1.237 1.00 0.00 H ATOM 919 HH21 ARG A 345 5.101 29.303 2.583 1.00 0.00 H ATOM 920 H ARG A 345 1.873 29.183 9.334 1.00 0.00 H ATOM 921 N ASP A 346 4.118 31.551 9.779 1.00 11.33 N ATOM 922 CA ASP A 346 4.796 32.788 10.165 1.00 14.20 C ATOM 923 C ASP A 346 4.970 32.882 11.670 1.00 12.91 C ATOM 924 O ASP A 346 5.073 33.970 12.238 1.00 14.87 O ATOM 925 CB ASP A 346 4.016 34.003 9.666 1.00 19.75 C ATOM 926 CG ASP A 346 3.936 34.058 8.161 1.00 31.80 C ATOM 927 OD1 ASP A 346 4.962 33.776 7.504 1.00 35.30 O ATOM 928 OD2 ASP A 346 2.845 34.373 7.638 1.00 36.11 O ATOM 929 HA ASP A 346 5.784 32.775 9.704 1.00 0.00 H ATOM 930 HB2 ASP A 346 3.004 33.959 10.069 1.00 0.00 H ATOM 931 HB3 ASP A 346 4.509 34.907 10.024 1.00 0.00 H ATOM 932 H ASP A 346 3.162 31.357 10.139 1.00 0.00 H ATOM 933 N THR A 347 4.996 31.732 12.320 1.00 9.20 N ATOM 934 CA THR A 347 5.058 31.700 13.764 1.00 8.37 C ATOM 935 C THR A 347 6.498 31.557 14.234 1.00 5.34 C ATOM 936 O THR A 347 7.308 30.845 13.621 1.00 5.83 O ATOM 937 CB THR A 347 4.170 30.569 14.319 1.00 12.59 C ATOM 938 OG1 THR A 347 4.702 29.291 13.946 1.00 15.10 O ATOM 939 CG2 THR A 347 2.769 30.700 13.735 1.00 14.22 C ATOM 940 HA THR A 347 4.674 32.644 14.151 1.00 0.00 H ATOM 941 HB THR A 347 4.140 30.647 15.406 1.00 0.00 H ATOM 942 HG1 THR A 347 4.734 29.223 12.959 1.00 0.00 H ATOM 943 HG23 THR A 347 2.351 31.668 14.011 1.00 0.00 H ATOM 944 HG21 THR A 347 2.821 30.621 12.649 1.00 0.00 H ATOM 945 HG22 THR A 347 2.137 29.904 14.129 1.00 0.00 H ATOM 946 H THR A 347 4.972 30.839 11.787 1.00 0.00 H ATOM 947 N LYS A 348 6.818 32.267 15.304 1.00 4.40 N ATOM 948 CA LYS A 348 8.097 32.088 15.980 1.00 4.92 C ATOM 949 C LYS A 348 8.149 30.755 16.711 1.00 4.20 C ATOM 950 O LYS A 348 7.114 30.137 17.020 1.00 4.46 O ATOM 951 CB LYS A 348 8.359 33.233 16.949 1.00 6.02 C ATOM 952 CG LYS A 348 8.489 34.568 16.233 1.00 7.68 C ATOM 953 CD LYS A 348 9.068 35.620 17.149 1.00 20.40 C ATOM 954 CE LYS A 348 8.052 36.676 17.472 1.00 24.87 C ATOM 955 NZ LYS A 348 8.696 37.798 18.208 1.00 25.90 N ATOM 956 HA LYS A 348 8.878 32.090 15.220 1.00 0.00 H ATOM 957 HB2 LYS A 348 7.532 33.292 17.656 1.00 0.00 H ATOM 958 HB3 LYS A 348 9.284 33.032 17.490 1.00 0.00 H ATOM 959 HG2 LYS A 348 9.143 34.447 15.370 1.00 0.00 H ATOM 960 HG3 LYS A 348 7.503 34.890 15.898 1.00 0.00 H ATOM 961 HD2 LYS A 348 9.395 35.146 18.074 1.00 0.00 H ATOM 962 HD3 LYS A 348 9.923 36.086 16.660 1.00 0.00 H ATOM 963 HE2 LYS A 348 7.266 36.243 18.090 1.00 0.00 H ATOM 964 HE3 LYS A 348 7.618 37.054 16.546 1.00 0.00 H ATOM 965 HZ1 LYS A 348 9.109 37.439 19.092 1.00 0.00 H ATOM 966 HZ2 LYS A 348 9.445 38.213 17.618 1.00 0.00 H ATOM 967 HZ3 LYS A 348 7.983 38.523 18.426 1.00 0.00 H ATOM 968 H LYS A 348 6.142 32.968 15.670 1.00 0.00 H ATOM 969 N HIS A 349 9.365 30.304 16.979 1.00 4.10 N ATOM 970 CA HIS A 349 9.558 28.991 17.564 1.00 3.49 C ATOM 971 C HIS A 349 8.678 28.760 18.798 1.00 3.28 C ATOM 972 O HIS A 349 7.950 27.766 18.859 1.00 3.24 O ATOM 973 CB HIS A 349 11.031 28.782 17.932 1.00 3.29 C ATOM 974 CG HIS A 349 11.326 27.401 18.419 1.00 3.63 C ATOM 975 ND1 HIS A 349 11.649 26.365 17.562 1.00 3.74 N ATOM 976 CD2 HIS A 349 11.304 26.862 19.659 1.00 3.05 C ATOM 977 CE1 HIS A 349 11.835 25.259 18.256 1.00 5.16 C ATOM 978 NE2 HIS A 349 11.621 25.530 19.534 1.00 5.29 N ATOM 979 HA HIS A 349 9.259 28.264 16.809 1.00 0.00 H ATOM 980 HB2 HIS A 349 11.640 28.976 17.049 1.00 0.00 H ATOM 981 HB3 HIS A 349 11.296 29.490 18.717 1.00 0.00 H ATOM 982 HD2 HIS A 349 11.077 27.387 20.587 1.00 0.00 H ATOM 983 HE1 HIS A 349 12.117 24.288 17.847 1.00 0.00 H ATOM 984 H HIS A 349 10.192 30.899 16.767 1.00 0.00 H ATOM 985 N LYS A 350 8.756 29.651 19.788 1.00 4.07 N ATOM 986 CA LYS A 350 8.036 29.431 21.041 1.00 3.98 C ATOM 987 C LYS A 350 6.538 29.615 20.874 1.00 3.20 C ATOM 988 O LYS A 350 5.750 28.995 21.595 1.00 3.56 O ATOM 989 CB LYS A 350 8.585 30.312 22.160 1.00 4.58 C ATOM 990 CG LYS A 350 9.985 29.907 22.602 1.00 4.28 C ATOM 991 CD LYS A 350 10.497 30.741 23.796 1.00 5.50 C ATOM 992 CE LYS A 350 9.882 30.267 25.102 1.00 7.77 C ATOM 993 NZ LYS A 350 10.231 31.142 26.267 1.00 11.03 N ATOM 994 HA LYS A 350 8.200 28.392 21.327 1.00 0.00 H ATOM 995 HB2 LYS A 350 8.616 31.343 21.808 1.00 0.00 H ATOM 996 HB3 LYS A 350 7.916 30.243 23.018 1.00 0.00 H ATOM 997 HG2 LYS A 350 9.969 28.856 22.891 1.00 0.00 H ATOM 998 HG3 LYS A 350 10.668 30.042 21.764 1.00 0.00 H ATOM 999 HD2 LYS A 350 11.581 30.645 23.858 1.00 0.00 H ATOM 1000 HD3 LYS A 350 10.234 31.787 23.638 1.00 0.00 H ATOM 1001 HE2 LYS A 350 10.238 29.257 25.307 1.00 0.00 H ATOM 1002 HE3 LYS A 350 8.798 30.253 24.990 1.00 0.00 H ATOM 1003 HZ1 LYS A 350 11.263 31.157 26.391 1.00 0.00 H ATOM 1004 HZ2 LYS A 350 9.888 32.108 26.089 1.00 0.00 H ATOM 1005 HZ3 LYS A 350 9.783 30.767 27.127 1.00 0.00 H ATOM 1006 H LYS A 350 9.333 30.508 19.667 1.00 0.00 H ATOM 1007 N GLU A 351 6.126 30.447 19.920 1.00 4.10 N ATOM 1008 CA GLU A 351 4.708 30.552 19.617 1.00 4.18 C ATOM 1009 C GLU A 351 4.173 29.194 19.154 1.00 3.29 C ATOM 1010 O GLU A 351 3.105 28.740 19.591 1.00 4.76 O ATOM 1011 CB GLU A 351 4.470 31.624 18.550 1.00 3.36 C ATOM 1012 CG GLU A 351 4.833 33.029 19.012 1.00 4.71 C ATOM 1013 CD GLU A 351 4.774 34.044 17.903 1.00 7.14 C ATOM 1014 OE1 GLU A 351 4.724 33.665 16.718 1.00 7.77 O ATOM 1015 OE2 GLU A 351 4.765 35.245 18.217 1.00 9.01 O ATOM 1016 HA GLU A 351 4.171 30.847 20.519 1.00 0.00 H ATOM 1017 HB2 GLU A 351 5.073 31.381 17.675 1.00 0.00 H ATOM 1018 HB3 GLU A 351 3.415 31.612 18.277 1.00 0.00 H ATOM 1019 HG2 GLU A 351 4.137 33.329 19.795 1.00 0.00 H ATOM 1020 HG3 GLU A 351 5.846 33.012 19.415 1.00 0.00 H ATOM 1021 H GLU A 351 6.816 31.020 19.393 1.00 0.00 H ATOM 1022 N ALA A 352 4.925 28.549 18.269 1.00 4.51 N ATOM 1023 CA ALA A 352 4.557 27.240 17.736 1.00 4.16 C ATOM 1024 C ALA A 352 4.503 26.181 18.834 1.00 3.24 C ATOM 1025 O ALA A 352 3.594 25.351 18.850 1.00 3.76 O ATOM 1026 CB ALA A 352 5.527 26.818 16.630 1.00 5.94 C ATOM 1027 HA ALA A 352 3.557 27.326 17.311 1.00 0.00 H ATOM 1028 HB1 ALA A 352 5.497 27.550 15.823 1.00 0.00 H ATOM 1029 HB2 ALA A 352 6.537 26.764 17.036 1.00 0.00 H ATOM 1030 HB3 ALA A 352 5.235 25.840 16.246 1.00 0.00 H ATOM 1031 H ALA A 352 5.808 28.992 17.944 1.00 0.00 H ATOM 1032 N VAL A 353 5.457 26.211 19.761 1.00 3.48 N ATOM 1033 CA VAL A 353 5.424 25.264 20.877 1.00 3.46 C ATOM 1034 C VAL A 353 4.128 25.409 21.663 1.00 3.34 C ATOM 1035 O VAL A 353 3.466 24.435 21.962 1.00 3.22 O ATOM 1036 CB VAL A 353 6.623 25.444 21.835 1.00 2.57 C ATOM 1037 CG1 VAL A 353 6.438 24.603 23.098 1.00 4.62 C ATOM 1038 CG2 VAL A 353 7.923 25.079 21.131 1.00 4.82 C ATOM 1039 HA VAL A 353 5.485 24.266 20.442 1.00 0.00 H ATOM 1040 HB VAL A 353 6.673 26.492 22.131 1.00 0.00 H ATOM 1041 HG11 VAL A 353 5.528 24.914 23.610 1.00 0.00 H ATOM 1042 HG12 VAL A 353 6.360 23.551 22.824 1.00 0.00 H ATOM 1043 HG13 VAL A 353 7.294 24.746 23.757 1.00 0.00 H ATOM 1044 HG21 VAL A 353 7.880 24.039 20.807 1.00 0.00 H ATOM 1045 HG22 VAL A 353 8.059 25.726 20.264 1.00 0.00 H ATOM 1046 HG23 VAL A 353 8.757 25.211 21.820 1.00 0.00 H ATOM 1047 H VAL A 353 6.226 26.907 19.693 1.00 0.00 H ATOM 1048 N THR A 354 3.759 26.633 21.996 1.00 3.81 N ATOM 1049 CA THR A 354 2.530 26.856 22.761 1.00 2.64 C ATOM 1050 C THR A 354 1.301 26.363 21.997 1.00 3.04 C ATOM 1051 O THR A 354 0.471 25.610 22.528 1.00 3.30 O ATOM 1052 CB THR A 354 2.392 28.336 23.132 1.00 4.52 C ATOM 1053 OG1 THR A 354 3.363 28.641 24.136 1.00 6.94 O ATOM 1054 CG2 THR A 354 1.008 28.644 23.682 1.00 6.27 C ATOM 1055 HA THR A 354 2.595 26.276 23.682 1.00 0.00 H ATOM 1056 HB THR A 354 2.546 28.936 22.235 1.00 0.00 H ATOM 1057 HG1 THR A 354 3.202 28.075 24.932 1.00 0.00 H ATOM 1058 HG23 THR A 354 0.258 28.415 22.925 1.00 0.00 H ATOM 1059 HG21 THR A 354 0.827 28.037 24.569 1.00 0.00 H ATOM 1060 HG22 THR A 354 0.950 29.700 23.945 1.00 0.00 H ATOM 1061 H THR A 354 4.345 27.444 21.713 1.00 0.00 H ATOM 1062 N ILE A 355 1.204 26.738 20.728 1.00 3.27 N ATOM 1063 CA ILE A 355 0.078 26.300 19.927 1.00 2.92 C ATOM 1064 C ILE A 355 0.028 24.776 19.787 1.00 4.20 C ATOM 1065 O ILE A 355 -1.018 24.159 20.017 1.00 4.51 O ATOM 1066 CB ILE A 355 0.114 26.963 18.548 1.00 3.56 C ATOM 1067 CG1 ILE A 355 -0.031 28.482 18.677 1.00 4.49 C ATOM 1068 CG2 ILE A 355 -0.972 26.398 17.651 1.00 5.14 C ATOM 1069 CD1 ILE A 355 0.320 29.216 17.387 1.00 6.33 C ATOM 1070 HA ILE A 355 -0.829 26.607 20.447 1.00 0.00 H ATOM 1071 HB ILE A 355 1.080 26.747 18.091 1.00 0.00 H ATOM 1072 HG12 ILE A 355 -1.063 28.713 18.941 1.00 0.00 H ATOM 1073 HG13 ILE A 355 0.632 28.830 19.469 1.00 0.00 H ATOM 1074 HD11 ILE A 355 1.354 28.999 17.117 1.00 0.00 H ATOM 1075 HD12 ILE A 355 -0.343 28.882 16.589 1.00 0.00 H ATOM 1076 HD13 ILE A 355 0.199 30.289 17.537 1.00 0.00 H ATOM 1077 HG21 ILE A 355 -0.820 25.325 17.530 1.00 0.00 H ATOM 1078 HG22 ILE A 355 -1.947 26.580 18.104 1.00 0.00 H ATOM 1079 HG23 ILE A 355 -0.926 26.885 16.677 1.00 0.00 H ATOM 1080 H ILE A 355 1.936 27.346 20.308 1.00 0.00 H ATOM 1081 N LEU A 356 1.150 24.163 19.419 1.00 3.38 N ATOM 1082 CA LEU A 356 1.180 22.718 19.237 1.00 3.60 C ATOM 1083 C LEU A 356 0.860 21.946 20.519 1.00 3.81 C ATOM 1084 O LEU A 356 0.070 20.999 20.489 1.00 3.03 O ATOM 1085 CB LEU A 356 2.523 22.283 18.663 1.00 3.57 C ATOM 1086 CG LEU A 356 2.685 22.628 17.178 1.00 2.70 C ATOM 1087 CD1 LEU A 356 4.147 22.712 16.791 1.00 3.40 C ATOM 1088 CD2 LEU A 356 1.957 21.622 16.297 1.00 4.06 C ATOM 1089 HA LEU A 356 0.390 22.473 18.527 1.00 0.00 H ATOM 1090 HB2 LEU A 356 3.316 22.779 19.223 1.00 0.00 H ATOM 1091 HB3 LEU A 356 2.617 21.203 18.780 1.00 0.00 H ATOM 1092 HG LEU A 356 2.235 23.608 17.019 1.00 0.00 H ATOM 1093 HD21 LEU A 356 2.366 20.627 16.470 1.00 0.00 H ATOM 1094 HD22 LEU A 356 0.895 21.628 16.542 1.00 0.00 H ATOM 1095 HD23 LEU A 356 2.091 21.894 15.250 1.00 0.00 H ATOM 1096 HD11 LEU A 356 4.634 23.486 17.383 1.00 0.00 H ATOM 1097 HD12 LEU A 356 4.627 21.752 16.980 1.00 0.00 H ATOM 1098 HD13 LEU A 356 4.228 22.958 15.732 1.00 0.00 H ATOM 1099 H LEU A 356 2.013 24.720 19.260 1.00 0.00 H ATOM 1100 N SER A 357 1.447 22.352 21.644 1.00 2.15 N ATOM 1101 CA SER A 357 1.232 21.647 22.909 1.00 3.70 C ATOM 1102 C SER A 357 -0.178 21.809 23.478 1.00 3.84 C ATOM 1103 O SER A 357 -0.575 21.029 24.345 1.00 5.68 O ATOM 1104 CB SER A 357 2.269 22.069 23.959 1.00 4.25 C ATOM 1105 OG SER A 357 3.581 21.688 23.578 1.00 4.30 O ATOM 1106 HA SER A 357 1.354 20.590 22.673 1.00 0.00 H ATOM 1107 HB2 SER A 357 2.024 21.595 24.909 1.00 0.00 H ATOM 1108 HB3 SER A 357 2.234 23.152 24.076 1.00 0.00 H ATOM 1109 HG SER A 357 3.812 22.120 22.718 1.00 0.00 H ATOM 1110 H SER A 357 2.069 23.185 21.623 1.00 0.00 H ATOM 1111 N GLN A 358 -0.925 22.802 23.001 1.00 3.77 N ATOM 1112 CA GLN A 358 -2.306 23.028 23.446 1.00 4.93 C ATOM 1113 C GLN A 358 -3.276 22.035 22.816 1.00 4.87 C ATOM 1114 O GLN A 358 -4.378 21.833 23.326 1.00 5.04 O ATOM 1115 CB GLN A 358 -2.773 24.452 23.078 1.00 4.96 C ATOM 1116 CG GLN A 358 -2.327 25.509 24.052 1.00 9.18 C ATOM 1117 CD GLN A 358 -2.781 26.886 23.645 1.00 12.04 C ATOM 1118 OE1 GLN A 358 -3.442 27.056 22.622 1.00 22.83 O ATOM 1119 NE2 GLN A 358 -2.435 27.885 24.450 1.00 11.39 N ATOM 1120 HA GLN A 358 -2.308 22.895 24.528 1.00 0.00 H ATOM 1121 HB2 GLN A 358 -2.375 24.701 22.094 1.00 0.00 H ATOM 1122 HB3 GLN A 358 -3.862 24.457 23.040 1.00 0.00 H ATOM 1123 HG2 GLN A 358 -2.740 25.279 25.034 1.00 0.00 H ATOM 1124 HG3 GLN A 358 -1.238 25.500 24.106 1.00 0.00 H ATOM 1125 HE22 GLN A 358 -1.875 27.694 25.305 1.00 0.00 H ATOM 1126 HE21 GLN A 358 -2.724 28.858 24.225 1.00 0.00 H ATOM 1127 H GLN A 358 -0.516 23.440 22.288 1.00 0.00 H ATOM 1128 N GLN A 359 -2.889 21.428 21.699 1.00 3.24 N ATOM 1129 CA GLN A 359 -3.853 20.593 20.976 1.00 4.00 C ATOM 1130 C GLN A 359 -4.057 19.252 21.670 1.00 3.28 C ATOM 1131 O GLN A 359 -3.107 18.674 22.207 1.00 4.95 O ATOM 1132 CB GLN A 359 -3.426 20.403 19.513 1.00 3.45 C ATOM 1133 CG GLN A 359 -3.041 21.696 18.805 1.00 4.73 C ATOM 1134 CD GLN A 359 -4.127 22.756 18.877 1.00 4.26 C ATOM 1135 OE1 GLN A 359 -5.298 22.470 18.624 1.00 6.21 O ATOM 1136 NE2 GLN A 359 -3.751 23.982 19.230 1.00 6.27 N ATOM 1137 HA GLN A 359 -4.811 21.112 20.981 1.00 0.00 H ATOM 1138 HB2 GLN A 359 -2.568 19.732 19.491 1.00 0.00 H ATOM 1139 HB3 GLN A 359 -4.255 19.949 18.970 1.00 0.00 H ATOM 1140 HG2 GLN A 359 -2.138 22.091 19.269 1.00 0.00 H ATOM 1141 HG3 GLN A 359 -2.842 21.473 17.757 1.00 0.00 H ATOM 1142 HE22 GLN A 359 -2.751 24.180 19.435 1.00 0.00 H ATOM 1143 HE21 GLN A 359 -4.457 24.742 19.301 1.00 0.00 H ATOM 1144 H GLN A 359 -1.918 21.543 21.344 1.00 0.00 H ATOM 1145 N ARG A 360 -5.295 18.771 21.676 1.00 3.38 N ATOM 1146 CA ARG A 360 -5.636 17.518 22.347 1.00 4.08 C ATOM 1147 C ARG A 360 -6.420 16.589 21.453 1.00 2.95 C ATOM 1148 O ARG A 360 -7.157 17.040 20.569 1.00 5.50 O ATOM 1149 CB ARG A 360 -6.492 17.793 23.580 1.00 6.66 C ATOM 1150 CG ARG A 360 -5.773 18.511 24.702 1.00 10.54 C ATOM 1151 CD ARG A 360 -6.764 18.985 25.764 1.00 14.16 C ATOM 1152 NE ARG A 360 -7.309 17.876 26.540 1.00 15.80 N ATOM 1153 CZ ARG A 360 -8.608 17.627 26.687 1.00 31.64 C ATOM 1154 NH1 ARG A 360 -9.510 18.404 26.100 1.00 37.80 N ATOM 1155 NH2 ARG A 360 -9.007 16.598 27.422 1.00 24.72 N ATOM 1156 HA ARG A 360 -4.691 17.048 22.619 1.00 0.00 H ATOM 1157 HB2 ARG A 360 -7.341 18.404 23.275 1.00 0.00 H ATOM 1158 HB3 ARG A 360 -6.852 16.838 23.963 1.00 0.00 H ATOM 1159 HG2 ARG A 360 -5.055 17.831 25.160 1.00 0.00 H ATOM 1160 HG3 ARG A 360 -5.245 19.373 24.295 1.00 0.00 H ATOM 1161 HD2 ARG A 360 -7.585 19.507 25.272 1.00 0.00 H ATOM 1162 HD3 ARG A 360 -6.254 19.670 26.441 1.00 0.00 H ATOM 1163 HE ARG A 360 -6.637 17.237 27.010 1.00 0.00 H ATOM 1164 HH12 ARG A 360 -10.524 18.205 26.218 1.00 0.00 H ATOM 1165 HH11 ARG A 360 -9.203 19.212 25.522 1.00 0.00 H ATOM 1166 HH22 ARG A 360 -10.022 16.404 27.537 1.00 0.00 H ATOM 1167 HH21 ARG A 360 -8.305 15.985 27.884 1.00 0.00 H ATOM 1168 H ARG A 360 -6.045 19.302 21.188 1.00 0.00 H ATOM 1169 N GLY A 361 -6.264 15.288 21.690 1.00 3.54 N ATOM 1170 CA GLY A 361 -7.156 14.302 21.110 1.00 4.45 C ATOM 1171 C GLY A 361 -6.881 13.997 19.653 1.00 5.28 C ATOM 1172 O GLY A 361 -5.813 13.491 19.293 1.00 5.08 O ATOM 1173 HA3 GLY A 361 -8.177 14.673 21.195 1.00 0.00 H ATOM 1174 HA2 GLY A 361 -7.058 13.377 21.678 1.00 0.00 H ATOM 1175 H GLY A 361 -5.486 14.972 22.304 1.00 0.00 H ATOM 1176 N GLU A 362 -7.864 14.294 18.814 1.00 4.59 N ATOM 1177 CA GLU A 362 -7.746 14.077 17.376 1.00 3.93 C ATOM 1178 C GLU A 362 -7.265 15.360 16.745 1.00 4.68 C ATOM 1179 O GLU A 362 -7.992 16.351 16.715 1.00 6.64 O ATOM 1180 CB GLU A 362 -9.094 13.664 16.777 1.00 4.53 C ATOM 1181 CG GLU A 362 -9.620 12.355 17.327 1.00 5.30 C ATOM 1182 CD GLU A 362 -10.972 11.969 16.771 1.00 10.94 C ATOM 1183 OE1 GLU A 362 -11.710 12.856 16.302 1.00 12.47 O ATOM 1184 OE2 GLU A 362 -11.293 10.770 16.806 1.00 8.98 O ATOM 1185 HA GLU A 362 -7.038 13.272 17.182 1.00 0.00 H ATOM 1186 HB2 GLU A 362 -9.822 14.447 16.991 1.00 0.00 H ATOM 1187 HB3 GLU A 362 -8.977 13.564 15.698 1.00 0.00 H ATOM 1188 HG2 GLU A 362 -8.908 11.567 17.083 1.00 0.00 H ATOM 1189 HG3 GLU A 362 -9.704 12.444 18.410 1.00 0.00 H ATOM 1190 H GLU A 362 -8.746 14.694 19.193 1.00 0.00 H ATOM 1191 N ILE A 363 -6.032 15.354 16.262 1.00 3.61 N ATOM 1192 CA ILE A 363 -5.362 16.579 15.850 1.00 3.47 C ATOM 1193 C ILE A 363 -4.998 16.512 14.372 1.00 4.67 C ATOM 1194 O ILE A 363 -4.327 15.570 13.936 1.00 4.81 O ATOM 1195 CB ILE A 363 -4.087 16.773 16.667 1.00 3.49 C ATOM 1196 CG1 ILE A 363 -4.428 16.818 18.160 1.00 4.05 C ATOM 1197 CG2 ILE A 363 -3.371 18.043 16.237 1.00 5.90 C ATOM 1198 CD1 ILE A 363 -3.227 16.735 19.072 1.00 5.12 C ATOM 1199 HA ILE A 363 -6.040 17.416 16.018 1.00 0.00 H ATOM 1200 HB ILE A 363 -3.418 15.931 16.489 1.00 0.00 H ATOM 1201 HG12 ILE A 363 -4.949 17.754 18.364 1.00 0.00 H ATOM 1202 HG13 ILE A 363 -5.088 15.980 18.386 1.00 0.00 H ATOM 1203 HD11 ILE A 363 -2.700 15.798 18.892 1.00 0.00 H ATOM 1204 HD12 ILE A 363 -2.560 17.573 18.870 1.00 0.00 H ATOM 1205 HD13 ILE A 363 -3.557 16.774 20.110 1.00 0.00 H ATOM 1206 HG21 ILE A 363 -3.110 17.972 15.181 1.00 0.00 H ATOM 1207 HG22 ILE A 363 -4.027 18.899 16.393 1.00 0.00 H ATOM 1208 HG23 ILE A 363 -2.464 18.166 16.830 1.00 0.00 H ATOM 1209 H ILE A 363 -5.528 14.448 16.175 1.00 0.00 H ATOM 1210 N GLU A 364 -5.410 17.514 13.599 1.00 3.43 N ATOM 1211 CA GLU A 364 -5.179 17.516 12.153 1.00 4.56 C ATOM 1212 C GLU A 364 -4.030 18.435 11.737 1.00 4.09 C ATOM 1213 O GLU A 364 -4.091 19.644 11.959 1.00 2.24 O ATOM 1214 CB GLU A 364 -6.448 17.939 11.411 1.00 9.38 C ATOM 1215 CG GLU A 364 -7.657 17.083 11.721 1.00 16.87 C ATOM 1216 CD GLU A 364 -8.864 17.452 10.886 1.00 30.75 C ATOM 1217 OE1 GLU A 364 -8.978 18.630 10.484 1.00 32.31 O ATOM 1218 OE2 GLU A 364 -9.697 16.558 10.628 1.00 37.21 O ATOM 1219 HA GLU A 364 -4.904 16.496 11.885 1.00 0.00 H ATOM 1220 HB2 GLU A 364 -6.678 18.969 11.684 1.00 0.00 H ATOM 1221 HB3 GLU A 364 -6.254 17.883 10.340 1.00 0.00 H ATOM 1222 HG2 GLU A 364 -7.405 16.040 11.528 1.00 0.00 H ATOM 1223 HG3 GLU A 364 -7.911 17.205 12.774 1.00 0.00 H ATOM 1224 H GLU A 364 -5.909 18.316 14.033 1.00 0.00 H ATOM 1225 N PHE A 365 -3.005 17.860 11.109 1.00 5.36 N ATOM 1226 CA PHE A 365 -1.821 18.585 10.682 1.00 5.55 C ATOM 1227 C PHE A 365 -1.872 18.832 9.187 1.00 6.40 C ATOM 1228 O PHE A 365 -2.342 17.991 8.414 1.00 7.74 O ATOM 1229 CB PHE A 365 -0.568 17.759 10.999 1.00 6.98 C ATOM 1230 CG PHE A 365 -0.190 17.757 12.453 1.00 5.23 C ATOM 1231 CD1 PHE A 365 -0.803 16.901 13.342 1.00 5.26 C ATOM 1232 CD2 PHE A 365 0.789 18.615 12.926 1.00 9.59 C ATOM 1233 CE1 PHE A 365 -0.463 16.906 14.690 1.00 4.49 C ATOM 1234 CE2 PHE A 365 1.143 18.625 14.263 1.00 7.10 C ATOM 1235 CZ PHE A 365 0.515 17.765 15.151 1.00 5.86 C ATOM 1236 HA PHE A 365 -1.786 19.538 11.211 1.00 0.00 H ATOM 1237 HB2 PHE A 365 -0.748 16.729 10.690 1.00 0.00 H ATOM 1238 HB3 PHE A 365 0.266 18.168 10.428 1.00 0.00 H ATOM 1239 HD2 PHE A 365 1.288 19.293 12.234 1.00 0.00 H ATOM 1240 HE2 PHE A 365 1.915 19.308 14.618 1.00 0.00 H ATOM 1241 HZ PHE A 365 0.791 17.767 16.205 1.00 0.00 H ATOM 1242 HE1 PHE A 365 -0.968 16.232 15.382 1.00 0.00 H ATOM 1243 HD1 PHE A 365 -1.566 16.210 12.983 1.00 0.00 H ATOM 1244 H PHE A 365 -3.055 16.840 10.915 1.00 0.00 H ATOM 1245 N GLU A 366 -1.373 19.985 8.777 1.00 5.47 N ATOM 1246 CA GLU A 366 -1.090 20.224 7.375 1.00 5.15 C ATOM 1247 C GLU A 366 0.420 20.351 7.268 1.00 4.29 C ATOM 1248 O GLU A 366 1.028 21.210 7.928 1.00 4.56 O ATOM 1249 CB GLU A 366 -1.792 21.500 6.918 1.00 7.58 C ATOM 1250 CG GLU A 366 -1.663 21.809 5.449 1.00 12.29 C ATOM 1251 CD GLU A 366 -2.539 22.981 5.026 1.00 26.19 C ATOM 1252 OE1 GLU A 366 -3.225 23.561 5.894 1.00 26.93 O ATOM 1253 OE2 GLU A 366 -2.541 23.325 3.826 1.00 23.38 O ATOM 1254 HA GLU A 366 -1.452 19.418 6.737 1.00 0.00 H ATOM 1255 HB2 GLU A 366 -2.852 21.405 7.152 1.00 0.00 H ATOM 1256 HB3 GLU A 366 -1.372 22.336 7.477 1.00 0.00 H ATOM 1257 HG2 GLU A 366 -0.623 22.052 5.232 1.00 0.00 H ATOM 1258 HG3 GLU A 366 -1.956 20.928 4.878 1.00 0.00 H ATOM 1259 H GLU A 366 -1.180 20.734 9.472 1.00 0.00 H ATOM 1260 N VAL A 367 1.033 19.475 6.475 1.00 4.10 N ATOM 1261 CA VAL A 367 2.491 19.405 6.408 1.00 3.25 C ATOM 1262 C VAL A 367 2.996 19.286 4.981 1.00 4.93 C ATOM 1263 O VAL A 367 2.257 18.911 4.064 1.00 5.98 O ATOM 1264 CB VAL A 367 3.043 18.204 7.234 1.00 4.28 C ATOM 1265 CG1 VAL A 367 2.722 18.372 8.709 1.00 5.58 C ATOM 1266 CG2 VAL A 367 2.480 16.882 6.720 1.00 7.17 C ATOM 1267 HA VAL A 367 2.854 20.341 6.833 1.00 0.00 H ATOM 1268 HB VAL A 367 4.126 18.187 7.113 1.00 0.00 H ATOM 1269 HG11 VAL A 367 3.178 19.291 9.076 1.00 0.00 H ATOM 1270 HG12 VAL A 367 1.641 18.423 8.841 1.00 0.00 H ATOM 1271 HG13 VAL A 367 3.117 17.522 9.265 1.00 0.00 H ATOM 1272 HG21 VAL A 367 1.393 16.894 6.803 1.00 0.00 H ATOM 1273 HG22 VAL A 367 2.764 16.749 5.676 1.00 0.00 H ATOM 1274 HG23 VAL A 367 2.882 16.062 7.315 1.00 0.00 H ATOM 1275 H VAL A 367 0.464 18.828 5.892 1.00 0.00 H ATOM 1276 N VAL A 368 4.272 19.591 4.792 1.00 4.75 N ATOM 1277 CA VAL A 368 4.893 19.399 3.494 1.00 5.95 C ATOM 1278 C VAL A 368 6.356 19.070 3.670 1.00 5.31 C ATOM 1279 O VAL A 368 7.047 19.685 4.484 1.00 6.15 O ATOM 1280 CB VAL A 368 4.727 20.641 2.595 1.00 4.05 C ATOM 1281 CG1 VAL A 368 5.444 21.852 3.179 1.00 6.00 C ATOM 1282 CG2 VAL A 368 5.210 20.351 1.169 1.00 7.11 C ATOM 1283 HA VAL A 368 4.392 18.567 2.999 1.00 0.00 H ATOM 1284 HB VAL A 368 3.664 20.879 2.552 1.00 0.00 H ATOM 1285 HG11 VAL A 368 5.030 22.079 4.162 1.00 0.00 H ATOM 1286 HG12 VAL A 368 6.508 21.633 3.273 1.00 0.00 H ATOM 1287 HG13 VAL A 368 5.305 22.708 2.519 1.00 0.00 H ATOM 1288 HG21 VAL A 368 6.264 20.073 1.193 1.00 0.00 H ATOM 1289 HG22 VAL A 368 4.626 19.532 0.749 1.00 0.00 H ATOM 1290 HG23 VAL A 368 5.082 21.243 0.555 1.00 0.00 H ATOM 1291 H VAL A 368 4.833 19.971 5.581 1.00 0.00 H ATOM 1292 N TYR A 369 6.820 18.088 2.909 1.00 4.63 N ATOM 1293 CA TYR A 369 8.234 17.765 2.882 1.00 6.33 C ATOM 1294 C TYR A 369 8.908 18.477 1.730 1.00 10.37 C ATOM 1295 O TYR A 369 8.519 18.285 0.580 1.00 11.71 O ATOM 1296 CB TYR A 369 8.429 16.266 2.714 1.00 7.75 C ATOM 1297 CG TYR A 369 9.879 15.855 2.794 1.00 8.34 C ATOM 1298 CD1 TYR A 369 10.687 15.843 1.659 1.00 13.29 C ATOM 1299 CD2 TYR A 369 10.444 15.477 4.002 1.00 9.32 C ATOM 1300 CE1 TYR A 369 12.019 15.467 1.734 1.00 12.67 C ATOM 1301 CE2 TYR A 369 11.764 15.105 4.085 1.00 9.84 C ATOM 1302 CZ TYR A 369 12.545 15.094 2.951 1.00 14.43 C ATOM 1303 OH TYR A 369 13.868 14.714 3.042 1.00 20.00 O ATOM 1304 HA TYR A 369 8.677 18.088 3.824 1.00 0.00 H ATOM 1305 HB3 TYR A 369 8.035 15.970 1.742 1.00 0.00 H ATOM 1306 HB2 TYR A 369 7.877 15.752 3.500 1.00 0.00 H ATOM 1307 HD2 TYR A 369 9.830 15.475 4.903 1.00 0.00 H ATOM 1308 HE2 TYR A 369 12.192 14.819 5.046 1.00 0.00 H ATOM 1309 HE1 TYR A 369 12.643 15.467 0.840 1.00 0.00 H ATOM 1310 HD1 TYR A 369 10.265 16.134 0.697 1.00 0.00 H ATOM 1311 HH TYR A 369 14.286 14.760 2.146 1.00 0.00 H ATOM 1312 H TYR A 369 6.159 17.540 2.322 1.00 0.00 H ATOM 1313 N VAL A 370 9.933 19.266 2.037 1.00 13.05 N ATOM 1314 CA VAL A 370 10.686 19.982 1.010 1.00 21.89 C ATOM 1315 C VAL A 370 12.127 19.483 0.934 1.00 21.97 C ATOM 1316 O VAL A 370 12.763 19.250 1.965 1.00 20.78 O ATOM 1317 CB VAL A 370 10.694 21.498 1.276 1.00 18.67 C ATOM 1318 CG1 VAL A 370 11.545 22.213 0.237 1.00 23.38 C ATOM 1319 CG2 VAL A 370 9.267 22.042 1.278 1.00 18.56 C ATOM 1320 HA VAL A 370 10.187 19.789 0.060 1.00 0.00 H ATOM 1321 HB VAL A 370 11.131 21.680 2.258 1.00 0.00 H ATOM 1322 HG11 VAL A 370 12.567 21.838 0.286 1.00 0.00 H ATOM 1323 HG12 VAL A 370 11.135 22.028 -0.756 1.00 0.00 H ATOM 1324 HG13 VAL A 370 11.540 23.284 0.440 1.00 0.00 H ATOM 1325 HG21 VAL A 370 8.806 21.852 0.309 1.00 0.00 H ATOM 1326 HG22 VAL A 370 8.691 21.546 2.059 1.00 0.00 H ATOM 1327 HG23 VAL A 370 9.289 23.115 1.467 1.00 0.00 H ATOM 1328 H VAL A 370 10.206 19.376 3.034 1.00 0.00 H TER 1329 VAL A 370 HETATM 1330 O HOH 1 4.676 9.207 11.357 1.00 4.53 O HETATM 1331 O HOH 2 6.224 10.089 17.843 1.00 3.64 O HETATM 1332 O HOH 3 -1.433 8.883 16.471 1.00 6.06 O HETATM 1333 O HOH 4 -0.323 18.520 21.738 1.00 3.16 O HETATM 1334 O HOH 5 -13.742 9.894 16.594 1.00 10.04 O HETATM 1335 O HOH 6 0.793 24.896 25.245 1.00 5.47 O HETATM 1336 O HOH 7 10.484 31.972 19.788 1.00 8.67 O HETATM 1337 O HOH 8 4.626 11.401 24.832 1.00 7.61 O HETATM 1338 O HOH 9 5.129 16.545 1.237 1.00 6.82 O HETATM 1339 O HOH 10 6.143 28.766 24.294 1.00 8.50 O HETATM 1340 O HOH 11 -10.467 8.957 18.630 1.00 7.49 O HETATM 1341 O HOH 12 5.856 26.594 9.723 1.00 8.70 O HETATM 1342 O HOH 13 13.638 10.947 14.335 1.00 10.95 O HETATM 1343 O HOH 14 4.955 5.689 8.747 1.00 7.81 O HETATM 1344 O HOH 15 8.864 7.135 12.294 1.00 10.13 O HETATM 1345 O HOH 16 5.747 6.646 11.305 1.00 9.04 O HETATM 1346 O HOH 17 10.945 10.318 10.047 1.00 9.39 O HETATM 1347 O HOH 18 -4.737 14.458 24.084 1.00 8.75 O HETATM 1348 O HOH 19 -7.517 20.571 20.972 1.00 13.32 O HETATM 1349 O HOH 20 -7.763 18.494 18.347 1.00 9.50 O HETATM 1350 O HOH 21 3.276 24.878 26.341 1.00 11.84 O HETATM 1351 O HOH 22 11.067 7.734 13.979 1.00 8.73 O HETATM 1352 O HOH 23 -2.443 7.018 19.294 1.00 13.85 O HETATM 1353 O HOH 24 -4.670 21.893 9.991 1.00 12.20 O HETATM 1354 O HOH 25 7.466 13.335 4.585 1.00 10.58 O HETATM 1355 O HOH 26 9.289 3.453 15.168 1.00 14.74 O HETATM 1356 O HOH 27 1.848 5.865 26.989 1.00 13.25 O HETATM 1357 O HOH 28 6.997 29.504 11.249 1.00 10.97 O HETATM 1358 O HOH 29 3.258 27.374 26.462 1.00 11.05 O HETATM 1359 O HOH 30 -4.146 5.956 20.995 1.00 12.95 O HETATM 1360 O HOH 31 -10.300 15.765 19.527 1.00 14.55 O HETATM 1361 O HOH 32 11.929 11.991 6.144 1.00 12.67 O HETATM 1362 O HOH 33 8.905 8.501 10.017 1.00 13.59 O HETATM 1363 O HOH 34 -3.395 14.786 2.187 1.00 18.03 O HETATM 1364 O HOH 35 9.759 11.715 4.343 1.00 15.74 O HETATM 1365 O HOH 36 3.568 9.006 5.100 1.00 16.08 O HETATM 1366 O HOH 37 9.661 20.652 4.591 1.00 13.35 O HETATM 1367 O HOH 38 -2.474 22.889 27.807 1.00 20.06 O HETATM 1368 O HOH 39 1.502 11.860 4.899 1.00 14.64 O HETATM 1369 O HOH 40 10.041 7.832 22.310 1.00 17.14 O HETATM 1370 O HOH 41 9.491 18.201 -3.262 1.00 19.66 O HETATM 1371 O HOH 42 -4.481 30.667 11.698 1.00 19.42 O HETATM 1372 O HOH 43 5.892 13.975 0.098 1.00 15.04 O HETATM 1373 O HOH 44 15.374 16.582 20.080 1.00 15.50 O HETATM 1374 O HOH 45 5.868 12.438 2.569 1.00 16.56 O HETATM 1375 O HOH 46 12.787 19.155 4.676 1.00 27.68 O HETATM 1376 O HOH 47 6.074 27.800 4.958 1.00 27.65 O HETATM 1377 O HOH 48 7.708 5.228 23.091 1.00 20.86 O HETATM 1378 O HOH 49 -0.080 22.855 26.916 1.00 20.31 O HETATM 1379 O HOH 50 10.422 23.365 4.395 1.00 24.39 O HETATM 1380 O HOH 51 -11.885 14.721 14.547 1.00 21.58 O HETATM 1381 O HOH 52 -2.484 19.570 25.263 1.00 18.66 O HETATM 1382 O HOH 53 13.826 10.026 16.912 1.00 23.23 O HETATM 1383 O HOH 54 8.521 16.065 -4.513 1.00 19.16 O HETATM 1384 O HOH 55 17.100 16.954 17.520 1.00 22.59 O HETATM 1385 O HOH 56 3.422 10.727 3.408 1.00 29.60 O HETATM 1386 O HOH 57 11.536 17.050 -1.606 1.00 23.57 O HETATM 1387 O HOH 58 -4.105 21.300 1.999 1.00 28.13 O HETATM 1388 O HOH 59 -8.246 14.155 24.552 1.00 26.77 O HETATM 1389 O HOH 60 7.780 14.330 -1.654 1.00 33.93 O HETATM 1390 O HOH 61 -1.133 15.174 -0.665 1.00 32.22 O HETATM 1391 O HOH 62 -5.299 29.247 22.495 1.00 22.50 O HETATM 1392 O HOH 63 -10.168 16.246 23.937 1.00 30.06 O HETATM 1393 O HOH 64 -8.138 27.801 8.931 1.00 37.72 O HETATM 1394 O HOH 65 -9.873 18.410 21.450 1.00 32.50 O HETATM 1395 O HOH 66 14.021 30.975 18.856 1.00 22.28 O HETATM 1396 O HOH 67 9.726 13.922 -4.991 1.00 26.31 O HETATM 1397 O HOH 68 -8.539 25.042 16.257 1.00 27.47 O HETATM 1398 O HOH 69 -0.968 27.048 6.252 1.00 30.01 O HETATM 1399 O HOH 70 3.815 12.316 -0.810 1.00 28.23 O HETATM 1400 O HOH 71 15.424 9.482 18.838 1.00 32.42 O HETATM 1401 O HOH 72 13.078 34.574 19.443 1.00 29.79 O HETATM 1402 O HOH 73 10.051 11.643 1.685 1.00 33.09 O HETATM 1403 O HOH 74 -5.169 24.111 7.675 1.00 35.03 O HETATM 1404 O HOH 75 0.486 13.140 -0.417 1.00 30.55 O HETATM 1405 O HOH 76 17.972 19.987 13.763 1.00 27.58 O HETATM 1406 O HOH 77 9.029 8.975 4.920 1.00 35.56 O HETATM 1407 O HOH 78 8.839 30.766 9.520 1.00 11.27 O HETATM 1408 O HOH 79 -7.480 6.831 20.942 1.00 12.78 O HETATM 1409 O HOH 80 18.161 22.687 14.041 1.00 21.28 O HETATM 1410 O HOH 81 16.957 15.754 12.397 1.00 21.34 O HETATM 1411 O HOH 82 12.276 9.807 7.705 1.00 26.96 O HETATM 1412 O HOH 83 -3.352 18.746 1.451 1.00 37.04 O HETATM 1413 O HOH 84 -8.423 21.146 11.117 1.00 37.73 O HETATM 1414 O HOH 85 5.434 32.046 3.132 1.00 35.00 O HETATM 1415 O HOH 86 -4.801 26.743 19.624 1.00 33.56 O HETATM 1416 O HOH 87 12.331 36.631 28.538 1.00 41.38 O HETATM 1417 O HOH 88 1.576 31.905 11.021 1.00 17.73 O HETATM 1418 O HOH 89 6.875 5.509 6.763 1.00 17.60 O HETATM 1419 O HOH 90 15.800 12.764 13.545 1.00 24.63 O HETATM 1420 O HOH 91 14.475 18.902 10.059 1.00 23.36 O HETATM 1421 O HOH 92 -14.712 16.698 14.613 1.00 43.10 O HETATM 1422 O HOH 93 -7.434 24.047 18.388 1.00 24.53 O HETATM 1423 O HOH 94 -14.184 12.623 15.693 1.00 43.65 O HETATM 1424 O HOH 95 -9.276 11.610 25.814 1.00 29.80 O HETATM 1425 O HOH 96 -5.585 17.010 29.086 1.00 30.72 O HETATM 1426 O HOH 97 -6.504 15.721 31.133 1.00 32.40 O HETATM 1427 O HOH 98 -7.004 23.449 21.831 1.00 36.35 O HETATM 1428 O HOH 99 -5.555 30.783 20.615 1.00 37.41 O HETATM 1429 O HOH 100 11.237 34.537 8.720 1.00 35.67 O HETATM 1430 O HOH 101 17.309 11.336 19.216 1.00 37.43 O HETATM 1431 O HOH 102 10.479 26.253 23.502 1.00 4.33 O HETATM 1432 O HOH 103 16.715 19.333 16.127 1.00 16.62 O HETATM 1433 O HOH 104 16.556 18.159 22.050 1.00 19.22 O HETATM 1434 O HOH 105 26.350 20.527 18.479 1.00 26.02 O HETATM 1435 O HOH 106 17.624 24.301 21.489 1.00 20.40 O HETATM 1436 O HOH 107 14.532 22.953 25.024 1.00 23.17 O HETATM 1437 O HOH 108 18.875 19.284 20.449 1.00 34.47 O HETATM 1438 O HOH 109 16.762 22.333 23.424 1.00 18.87 O HETATM 1439 O HOH 110 15.513 20.079 23.541 1.00 25.19 O HETATM 1440 O HOH 111 24.625 17.656 17.192 1.00 28.98 O HETATM 1441 O HOH 112 26.466 28.972 13.962 1.00 36.06 O HETATM 1442 O HOH 113 26.513 27.611 16.395 1.00 36.31 O HETATM 1443 O HOH 114 16.600 19.866 26.271 1.00 33.76 O HETATM 1444 O HOH 115 27.952 29.898 17.985 1.00 39.16 O HETATM 1445 O HOH 116 19.026 22.727 18.045 1.00 19.88 O HETATM 1446 O HOH 117 20.828 32.902 9.865 1.00 22.23 O HETATM 1447 O HOH 118 20.321 24.889 14.074 1.00 36.61 O HETATM 1448 O HOH 119 19.675 21.729 20.076 1.00 40.43 O HETATM 1449 N ALA A 120 26.342 18.250 15.064 1.00 0.24 N HETATM 1450 CA ALA A 120 25.881 19.195 14.051 1.00 0.06 C HETATM 1451 C ALA A 120 25.722 20.603 14.623 1.00 0.23 C HETATM 1452 O ALA A 120 25.888 20.820 15.827 1.00 -0.39 O HETATM 1453 N ALA A 120 25.402 21.556 13.752 1.00 -0.26 N HETATM 1454 CA ALA A 120 25.199 22.941 14.165 1.00 0.15 C HETATM 1455 C ALA A 120 23.962 23.092 15.047 1.00 0.21 C HETATM 1456 O ALA A 120 22.946 22.432 14.824 1.00 -0.39 O HETATM 1457 N ALA A 120 24.052 23.960 16.049 1.00 -0.26 N HETATM 1458 CA ALA A 120 22.951 24.156 16.986 1.00 0.15 C HETATM 1459 C ALA A 120 22.551 25.627 17.107 1.00 0.21 C HETATM 1460 O ALA A 120 22.316 26.124 18.207 1.00 -0.39 O HETATM 1461 N ALA A 120 22.463 26.317 15.974 1.00 -0.26 N HETATM 1462 CA ALA A 120 22.147 27.743 15.975 1.00 0.13 C HETATM 1463 C ALA A 120 20.647 28.018 16.106 1.00 0.20 C HETATM 1464 O ALA A 120 20.247 29.039 16.676 1.00 -0.39 O HETATM 1465 N ALA A 120 19.820 27.113 15.579 1.00 -0.26 N HETATM 1466 CA ALA A 120 18.376 27.183 15.804 1.00 0.14 C HETATM 1467 C ALA A 120 18.036 26.400 17.062 1.00 0.21 C HETATM 1468 O ALA A 120 18.730 25.445 17.408 1.00 -0.39 O HETATM 1469 N ALA A 120 16.963 26.798 17.749 1.00 -0.25 N HETATM 1470 CA ALA A 120 16.493 26.036 18.907 1.00 0.13 C HETATM 1471 C ALA A 120 15.756 24.765 18.488 1.00 0.20 C HETATM 1472 O ALA A 120 15.191 24.689 17.390 1.00 -0.39 O HETATM 1473 N ALA A 120 15.784 23.776 19.366 1.00 -0.26 N HETATM 1474 CA ALA A 120 14.998 22.567 19.179 1.00 0.16 C HETATM 1475 C ALA A 120 14.167 22.377 20.427 1.00 0.21 C HETATM 1476 O ALA A 120 14.683 22.527 21.541 1.00 -0.39 O HETATM 1477 N ALA A 120 12.881 22.070 20.255 1.00 -0.26 N HETATM 1478 CA ALA A 120 12.022 21.770 21.396 1.00 0.15 C HETATM 1479 C ALA A 120 11.414 20.394 21.210 1.00 0.21 C HETATM 1480 O ALA A 120 10.973 20.049 20.109 1.00 -0.39 O HETATM 1481 N ALA A 120 11.410 19.610 22.283 1.00 -0.26 N HETATM 1482 CA ALA A 120 10.746 18.314 22.332 1.00 0.13 C HETATM 1483 C ALA A 120 9.324 18.550 22.808 1.00 0.20 C HETATM 1484 O ALA A 120 9.119 19.170 23.866 1.00 -0.39 O HETATM 1485 N ALA A 120 8.343 18.078 22.039 1.00 -0.27 N HETATM 1486 CA ALA A 120 6.942 18.373 22.316 1.00 0.10 C HETATM 1487 C ALA A 120 6.041 17.171 22.069 1.00 0.06 C HETATM 1488 O ALA A 120 6.475 16.134 21.544 1.00 -0.57 O HETATM 1489 OXT ALA A 120 4.854 17.252 22.387 1.00 -0.57 O HETATM 1490 CB ALA A 120 6.423 19.558 21.460 1.00 -0.01 C HETATM 1491 CG1 ALA A 120 6.431 19.222 19.966 1.00 -0.05 C HETATM 1492 CD1 ALA A 120 5.775 20.296 19.086 1.00 -0.06 C HETATM 1493 H80 ALA A 120 5.820 19.984 18.032 1.00 0.02 H HETATM 1494 H81 ALA A 120 6.311 21.249 19.209 1.00 0.02 H HETATM 1495 H82 ALA A 120 4.725 20.425 19.386 1.00 0.02 H HETATM 1496 H75 ALA A 120 5.889 18.276 19.820 1.00 0.03 H HETATM 1497 H76 ALA A 120 7.476 19.100 19.643 1.00 0.03 H HETATM 1498 CG2 ALA A 120 7.235 20.823 21.712 1.00 -0.06 C HETATM 1499 H77 ALA A 120 7.224 21.058 22.787 1.00 0.02 H HETATM 1500 H78 ALA A 120 6.795 21.660 21.150 1.00 0.02 H HETATM 1501 H79 ALA A 120 8.272 20.665 21.381 1.00 0.02 H HETATM 1502 H74 ALA A 120 5.383 19.756 21.758 1.00 0.03 H HETATM 1503 H73 ALA A 120 6.864 18.651 23.377 1.00 0.07 H HETATM 1504 H72 ALA A 120 8.574 17.507 21.251 1.00 0.19 H HETATM 1505 CB ALA A 120 11.447 17.399 23.358 1.00 -0.00 C HETATM 1506 CG1 ALA A 120 12.932 17.231 23.026 1.00 -0.05 C HETATM 1507 CD1 ALA A 120 13.745 16.652 24.181 1.00 -0.06 C HETATM 1508 H69 ALA A 120 14.798 16.558 23.877 1.00 0.02 H HETATM 1509 H70 ALA A 120 13.350 15.660 24.447 1.00 0.02 H HETATM 1510 H71 ALA A 120 13.673 17.321 25.052 1.00 0.02 H HETATM 1511 H64 ALA A 120 13.346 18.217 22.767 1.00 0.03 H HETATM 1512 H65 ALA A 120 13.023 16.556 22.162 1.00 0.03 H HETATM 1513 CG2 ALA A 120 10.758 16.055 23.430 1.00 -0.06 C HETATM 1514 H66 ALA A 120 9.694 16.201 23.669 1.00 0.02 H HETATM 1515 H67 ALA A 120 11.229 15.443 24.213 1.00 0.02 H HETATM 1516 H68 ALA A 120 10.849 15.544 22.460 1.00 0.02 H HETATM 1517 H63 ALA A 120 11.371 17.875 24.347 1.00 0.03 H HETATM 1518 H62 ALA A 120 10.751 17.844 21.337 1.00 0.08 H HETATM 1519 H61 ALA A 120 11.889 19.927 23.102 1.00 0.19 H HETATM 1520 CB ALA A 120 10.901 22.798 21.518 1.00 0.08 C HETATM 1521 OG ALA A 120 11.405 24.094 21.792 1.00 -0.39 O HETATM 1522 H60 ALA A 120 11.983 24.363 21.088 1.00 0.21 H HETATM 1523 H58 ALA A 120 10.229 22.497 22.335 1.00 0.06 H HETATM 1524 H59 ALA A 120 10.339 22.827 20.573 1.00 0.06 H HETATM 1525 H57 ALA A 120 12.626 21.784 22.316 1.00 0.08 H HETATM 1526 H56 ALA A 120 12.500 22.045 19.331 1.00 0.19 H HETATM 1527 CB ALA A 120 15.902 21.355 18.998 1.00 0.09 C HETATM 1528 OG1 ALA A 120 16.627 21.505 17.777 1.00 -0.39 O HETATM 1529 H52 ALA A 120 17.151 22.297 17.816 1.00 0.21 H HETATM 1530 CG2 ALA A 120 15.079 20.077 18.936 1.00 -0.03 C HETATM 1531 H53 ALA A 120 15.750 19.215 18.805 1.00 0.03 H HETATM 1532 H54 ALA A 120 14.382 20.131 18.087 1.00 0.03 H HETATM 1533 H55 ALA A 120 14.511 19.961 19.871 1.00 0.03 H HETATM 1534 H51 ALA A 120 16.605 21.294 19.842 1.00 0.06 H HETATM 1535 H50 ALA A 120 14.347 22.676 18.299 1.00 0.08 H HETATM 1536 H49 ALA A 120 16.360 23.862 20.179 1.00 0.19 H HETATM 1537 CB ALA A 120 15.518 27.002 19.579 1.00 -0.01 C HETATM 1538 CG ALA A 120 14.992 27.820 18.462 1.00 -0.03 C HETATM 1539 CD ALA A 120 16.166 28.018 17.538 1.00 0.04 C HETATM 1540 H47 ALA A 120 15.836 28.099 16.492 1.00 0.05 H HETATM 1541 H48 ALA A 120 16.738 28.916 17.813 1.00 0.05 H HETATM 1542 H45 ALA A 120 14.623 28.788 18.832 1.00 0.03 H HETATM 1543 H46 ALA A 120 14.178 27.291 17.945 1.00 0.03 H HETATM 1544 H43 ALA A 120 16.038 27.634 20.314 1.00 0.03 H HETATM 1545 H44 ALA A 120 14.705 26.453 20.077 1.00 0.03 H HETATM 1546 H42 ALA A 120 17.328 25.777 19.575 1.00 0.08 H HETATM 1547 CB ALA A 120 17.580 26.566 14.654 1.00 0.00 C HETATM 1548 CG ALA A 120 17.809 27.142 13.298 1.00 -0.04 C HETATM 1549 CD1 ALA A 120 18.351 28.360 12.988 1.00 0.02 C HETATM 1550 NE1 ALA A 120 18.404 28.516 11.621 1.00 -0.29 N HETATM 1551 CE2 ALA A 120 17.901 27.389 11.025 1.00 0.06 C HETATM 1552 CD2 ALA A 120 17.514 26.505 12.052 1.00 -0.02 C HETATM 1553 CE3 ALA A 120 16.964 25.266 11.705 1.00 -0.07 C HETATM 1554 CZ3 ALA A 120 16.815 24.954 10.364 1.00 -0.08 C HETATM 1555 CH2 ALA A 120 17.205 25.857 9.367 1.00 -0.08 C HETATM 1556 CZ2 ALA A 120 17.748 27.076 9.675 1.00 -0.04 C HETATM 1557 H39 ALA A 120 18.047 27.771 8.899 1.00 0.05 H HETATM 1558 H41 ALA A 120 17.074 25.584 8.326 1.00 0.05 H HETATM 1559 H40 ALA A 120 16.390 23.997 10.082 1.00 0.05 H HETATM 1560 H38 ALA A 120 16.660 24.563 12.472 1.00 0.05 H HETATM 1561 H37 ALA A 120 18.763 29.345 11.127 1.00 0.22 H HETATM 1562 H36 ALA A 120 18.690 29.097 13.715 1.00 0.08 H HETATM 1563 H34 ALA A 120 16.512 26.680 14.889 1.00 0.04 H HETATM 1564 H35 ALA A 120 17.833 25.497 14.609 1.00 0.04 H HETATM 1565 H33 ALA A 120 18.083 28.236 15.925 1.00 0.08 H HETATM 1566 H32 ALA A 120 20.194 26.373 15.020 1.00 0.19 H HETATM 1567 CB ALA A 120 22.719 28.424 14.730 1.00 -0.01 C HETATM 1568 CG ALA A 120 22.662 29.940 14.770 1.00 -0.02 C HETATM 1569 CD ALA A 120 21.709 30.455 13.719 1.00 0.06 C HETATM 1570 NE ALA A 120 22.123 30.048 12.381 1.00 -0.27 N HETATM 1571 CZ ALA A 120 22.697 30.859 11.502 1.00 0.29 C HETATM 1572 NH1 ALA A 120 23.043 30.404 10.305 1.00 -0.28 N HETATM 1573 H28 ALA A 120 23.489 31.035 9.623 1.00 0.26 H HETATM 1574 H29 ALA A 120 22.866 29.420 10.057 1.00 0.26 H HETATM 1575 NH2 ALA A 120 22.916 32.128 11.817 1.00 -0.28 N HETATM 1576 H30 ALA A 120 22.648 32.482 12.746 1.00 0.26 H HETATM 1577 H31 ALA A 120 23.355 32.760 11.132 1.00 0.26 H HETATM 1578 H27 ALA A 120 21.960 29.070 12.101 1.00 0.26 H HETATM 1579 H25 ALA A 120 21.683 31.554 13.767 1.00 0.07 H HETATM 1580 H26 ALA A 120 20.704 30.055 13.920 1.00 0.07 H HETATM 1581 H23 ALA A 120 23.666 30.346 14.580 1.00 0.03 H HETATM 1582 H24 ALA A 120 22.317 30.264 15.763 1.00 0.03 H HETATM 1583 H21 ALA A 120 22.148 28.080 13.855 1.00 0.03 H HETATM 1584 H22 ALA A 120 23.771 28.121 14.623 1.00 0.03 H HETATM 1585 H20 ALA A 120 22.638 28.186 16.854 1.00 0.08 H HETATM 1586 H19 ALA A 120 22.616 25.850 15.103 1.00 0.19 H HETATM 1587 CB ALA A 120 23.322 23.597 18.363 1.00 0.08 C HETATM 1588 OG ALA A 120 24.463 24.253 18.893 1.00 -0.39 O HETATM 1589 H18 ALA A 120 24.281 25.181 18.981 1.00 0.21 H HETATM 1590 H16 ALA A 120 23.538 22.523 18.268 1.00 0.06 H HETATM 1591 H17 ALA A 120 22.474 23.741 19.049 1.00 0.06 H HETATM 1592 H15 ALA A 120 22.081 23.598 16.608 1.00 0.08 H HETATM 1593 H14 ALA A 120 24.892 24.490 16.163 1.00 0.19 H HETATM 1594 CB ALA A 120 25.095 23.856 12.940 1.00 0.08 C HETATM 1595 CG ALA A 120 25.021 25.327 13.313 1.00 0.18 C HETATM 1596 OD1 ALA A 120 23.937 25.873 13.520 1.00 -0.40 O HETATM 1597 ND2 ALA A 120 26.178 25.977 13.394 1.00 -0.30 N HETATM 1598 H12 ALA A 120 26.191 26.947 13.636 1.00 0.18 H HETATM 1599 H13 ALA A 120 27.036 25.496 13.213 1.00 0.18 H HETATM 1600 H10 ALA A 120 24.188 23.589 12.377 1.00 0.06 H HETATM 1601 H11 ALA A 120 25.980 23.698 12.306 1.00 0.06 H HETATM 1602 H9 ALA A 120 26.075 23.252 14.753 1.00 0.08 H HETATM 1603 H8 ALA A 120 25.297 21.317 12.787 1.00 0.19 H HETATM 1604 CB ALA A 120 24.568 18.717 13.444 1.00 -0.00 C HETATM 1605 H5 ALA A 120 24.232 19.437 12.683 1.00 0.03 H HETATM 1606 H6 ALA A 120 23.807 18.636 14.234 1.00 0.03 H HETATM 1607 H7 ALA A 120 24.717 17.733 12.976 1.00 0.03 H HETATM 1608 H4 ALA A 120 26.637 19.235 13.253 1.00 0.11 H HETATM 1609 H1 ALA A 120 26.435 17.335 14.652 1.00 0.20 H HETATM 1610 H2 ALA A 120 25.674 18.213 15.818 1.00 0.20 H HETATM 1611 H3 ALA A 120 27.235 18.550 15.422 1.00 0.20 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 1449 1450 1609 1610 1611 CONECT 1450 1449 1451 1604 1608 CONECT 1451 1450 1452 1453 CONECT 1452 1451 CONECT 1453 1451 1454 1603 CONECT 1454 1453 1455 1594 1602 CONECT 1455 1454 1456 1457 CONECT 1456 1455 CONECT 1457 1455 1458 1593 CONECT 1458 1457 1459 1587 1592 CONECT 1459 1458 1460 1461 CONECT 1460 1459 CONECT 1461 1459 1462 1586 CONECT 1462 1461 1463 1567 1585 CONECT 1463 1462 1464 1465 CONECT 1464 1463 CONECT 1465 1463 1466 1566 CONECT 1466 1465 1467 1547 1565 CONECT 1467 1466 1468 1469 CONECT 1468 1467 CONECT 1469 1467 1470 1539 CONECT 1470 1469 1471 1537 1546 CONECT 1471 1470 1472 1473 CONECT 1472 1471 CONECT 1473 1471 1474 1536 CONECT 1474 1473 1475 1527 1535 CONECT 1475 1474 1476 1477 CONECT 1476 1475 CONECT 1477 1475 1478 1526 CONECT 1478 1477 1479 1520 1525 CONECT 1479 1478 1480 1481 CONECT 1480 1479 CONECT 1481 1479 1482 1519 CONECT 1482 1481 1483 1505 1518 CONECT 1483 1482 1484 1485 CONECT 1484 1483 CONECT 1485 1483 1486 1504 CONECT 1486 1485 1487 1490 1503 CONECT 1487 1486 1488 1489 CONECT 1488 1487 CONECT 1489 1487 CONECT 1490 1486 1491 1498 1502 CONECT 1491 1490 1492 1496 1497 CONECT 1492 1491 1493 1494 1495 CONECT 1493 1492 CONECT 1494 1492 CONECT 1495 1492 CONECT 1496 1491 CONECT 1497 1491 CONECT 1498 1490 1499 1500 1501 CONECT 1499 1498 CONECT 1500 1498 CONECT 1501 1498 CONECT 1502 1490 CONECT 1503 1486 CONECT 1504 1485 CONECT 1505 1482 1506 1513 1517 CONECT 1506 1505 1507 1511 1512 CONECT 1507 1506 1508 1509 1510 CONECT 1508 1507 CONECT 1509 1507 CONECT 1510 1507 CONECT 1511 1506 CONECT 1512 1506 CONECT 1513 1505 1514 1515 1516 CONECT 1514 1513 CONECT 1515 1513 CONECT 1516 1513 CONECT 1517 1505 CONECT 1518 1482 CONECT 1519 1481 CONECT 1520 1478 1521 1523 1524 CONECT 1521 1520 1522 CONECT 1522 1521 CONECT 1523 1520 CONECT 1524 1520 CONECT 1525 1478 CONECT 1526 1477 CONECT 1527 1474 1528 1530 1534 CONECT 1528 1527 1529 CONECT 1529 1528 CONECT 1530 1527 1531 1532 1533 CONECT 1531 1530 CONECT 1532 1530 CONECT 1533 1530 CONECT 1534 1527 CONECT 1535 1474 CONECT 1536 1473 CONECT 1537 1470 1538 1544 1545 CONECT 1538 1537 1539 1542 1543 CONECT 1539 1469 1538 1540 1541 CONECT 1540 1539 CONECT 1541 1539 CONECT 1542 1538 CONECT 1543 1538 CONECT 1544 1537 CONECT 1545 1537 CONECT 1546 1470 CONECT 1547 1466 1548 1563 1564 CONECT 1548 1547 1549 1552 CONECT 1549 1548 1550 1562 CONECT 1550 1549 1551 1561 CONECT 1551 1550 1552 1556 CONECT 1552 1548 1551 1553 CONECT 1553 1552 1554 1560 CONECT 1554 1553 1555 1559 CONECT 1555 1554 1556 1558 CONECT 1556 1551 1555 1557 CONECT 1557 1556 CONECT 1558 1555 CONECT 1559 1554 CONECT 1560 1553 CONECT 1561 1550 CONECT 1562 1549 CONECT 1563 1547 CONECT 1564 1547 CONECT 1565 1466 CONECT 1566 1465 CONECT 1567 1462 1568 1583 1584 CONECT 1568 1567 1569 1581 1582 CONECT 1569 1568 1570 1579 1580 CONECT 1570 1569 1571 1578 CONECT 1571 1570 1572 1575 CONECT 1572 1571 1573 1574 CONECT 1573 1572 CONECT 1574 1572 CONECT 1575 1571 1576 1577 CONECT 1576 1575 CONECT 1577 1575 CONECT 1578 1570 CONECT 1579 1569 CONECT 1580 1569 CONECT 1581 1568 CONECT 1582 1568 CONECT 1583 1567 CONECT 1584 1567 CONECT 1585 1462 CONECT 1586 1461 CONECT 1587 1458 1588 1590 1591 CONECT 1588 1587 1589 CONECT 1589 1588 CONECT 1590 1587 CONECT 1591 1587 CONECT 1592 1458 CONECT 1593 1457 CONECT 1594 1454 1595 1600 1601 CONECT 1595 1594 1596 1597 CONECT 1596 1595 CONECT 1597 1595 1598 1599 CONECT 1598 1597 CONECT 1599 1597 CONECT 1600 1594 CONECT 1601 1594 CONECT 1602 1454 CONECT 1603 1453 CONECT 1604 1450 1605 1606 1607 CONECT 1605 1604 CONECT 1606 1604 CONECT 1607 1604 CONECT 1608 1450 CONECT 1609 1449 CONECT 1610 1449 CONECT 1611 1449 MASTER 0 0 0 0 0 0 0 0 1610 1 167 7 END
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Structure:
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Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 4e34
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4e35
RCSB PDB
PDBbind
87aa, >4E35_1|Chains... at 100%
4joe
RCSB PDB
PDBbind
87aa, >4JOE_1|Chains... at 100%
4jof
RCSB PDB
PDBbind
87aa, >4JOF_1|Chains... at 100%
4jog
RCSB PDB
PDBbind
87aa, >4JOG_1|Chains... at 100%
4joh
RCSB PDB
PDBbind
87aa, >4JOH_1|Chains... at 100%
4joj
RCSB PDB
PDBbind
87aa, >4JOJ_1|Chains... at 100%
4jok
RCSB PDB
PDBbind
87aa, >4JOK_1|Chains... at 100%
4k6y
RCSB PDB
PDBbind
87aa, >4K6Y_1|Chains... at 100%
4k72
RCSB PDB
PDBbind
87aa, >4K72_1|Chains... at 100%
4k75
RCSB PDB
PDBbind
87aa, >4K75_1|Chain... at 100%
4k76
RCSB PDB
PDBbind
87aa, >4K76_1|Chains... at 100%
4k78
RCSB PDB
PDBbind
87aa, >4K78_1|Chain... at 98%
4nmo
RCSB PDB
PDBbind
87aa, >4NMO_1|Chains... at 100%
4nmp
RCSB PDB
PDBbind
87aa, >4NMP_1|Chains... at 100%
4nmq
RCSB PDB
PDBbind
87aa, >4NMQ_1|Chains... at 100%
4nmr
RCSB PDB
PDBbind
87aa, >4NMR_1|Chains... at 100%
4nms
RCSB PDB
PDBbind
87aa, >4NMS_1|Chains... at 100%
4nmt
RCSB PDB
PDBbind
87aa, >4NMT_1|Chains... at 100%
4nmv
RCSB PDB
PDBbind
87aa, >4NMV_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1aqc
RCSB PDB
PDBbind
10-mer
1awi
RCSB PDB
PDBbind
10-mer
1aze
RCSB PDB
PDBbind
10-mer
1bjr
RCSB PDB
PDBbind
10-mer
1cka
RCSB PDB
PDBbind
10-mer
1ckb
RCSB PDB
PDBbind
10-mer
1eb1
RCSB PDB
PDBbind
10-mer
1gbq
RCSB PDB
PDBbind
10-mer
1gvu
RCSB PDB
PDBbind
10-mer
1him
RCSB PDB
PDBbind
10-mer
1jd5
RCSB PDB
PDBbind
10-mer
1jd6
RCSB PDB
PDBbind
10-mer
1jmq
RCSB PDB
PDBbind
10-mer
1pyw
RCSB PDB
PDBbind
10-mer
1vj6
RCSB PDB
PDBbind
10-mer
1vr1
RCSB PDB
PDBbind
10-mer
1y2a
RCSB PDB
PDBbind
10-mer
1ywi
RCSB PDB
PDBbind
10-mer
1yy6
RCSB PDB
PDBbind
10-mer
1zkk
RCSB PDB
PDBbind
10-mer
2a0t
RCSB PDB
PDBbind
10-mer
2aoh
RCSB PDB
PDBbind
10-mer
2aoj
RCSB PDB
PDBbind
10-mer
2axi
RCSB PDB
PDBbind
10-mer
2azm
RCSB PDB
PDBbind
10-mer
2b7f
RCSB PDB
PDBbind
10-mer
2c2l
RCSB PDB
PDBbind
10-mer
2gfa
RCSB PDB
PDBbind
10-mer
2h13
RCSB PDB
PDBbind
10-mer
2hrp
RCSB PDB
PDBbind
10-mer
2ig0
RCSB PDB
PDBbind
10-mer
2jmj
RCSB PDB
PDBbind
10-mer
2jqi
RCSB PDB
PDBbind
10-mer
2jql
RCSB PDB
PDBbind
10-mer
2k2r
RCSB PDB
PDBbind
10-mer
2ke1
RCSB PDB
PDBbind
10-mer
2mnz
RCSB PDB
PDBbind
10-mer
2nxd
RCSB PDB
PDBbind
10-mer
2nxl
RCSB PDB
PDBbind
10-mer
2nxm
RCSB PDB
PDBbind
10-mer
2o9v
RCSB PDB
PDBbind
10-mer
2peh
RCSB PDB
PDBbind
10-mer
2pr9
RCSB PDB
PDBbind
10-mer
2puy
RCSB PDB
PDBbind
10-mer
2qqs
RCSB PDB
PDBbind
10-mer
2r3y
RCSB PDB
PDBbind
10-mer
2r7g
RCSB PDB
PDBbind
10-mer
2rr4
RCSB PDB
PDBbind
10-mer
2v7d
RCSB PDB
PDBbind
10-mer
2vnf
RCSB PDB
PDBbind
10-mer
2w6t
RCSB PDB
PDBbind
10-mer
2w77
RCSB PDB
PDBbind
10-mer
2wa8
RCSB PDB
PDBbind
10-mer
2wp1
RCSB PDB
PDBbind
10-mer
2z5o
RCSB PDB
PDBbind
10-mer
3al3
RCSB PDB
PDBbind
10-mer
3bh8
RCSB PDB
PDBbind
10-mer
3bh9
RCSB PDB
PDBbind
10-mer
3bhb
RCSB PDB
PDBbind
10-mer
3c94
RCSB PDB
PDBbind
10-mer
3d1e
RCSB PDB
PDBbind
10-mer
3diw
RCSB PDB
PDBbind
10-mer
3dnj
RCSB PDB
PDBbind
10-mer
3dpc
RCSB PDB
PDBbind
10-mer
3dvp
RCSB PDB
PDBbind
10-mer
3ebb
RCSB PDB
PDBbind
10-mer
3er5
RCSB PDB
PDBbind
10-mer
3f9w
RCSB PDB
PDBbind
10-mer
3f9y
RCSB PDB
PDBbind
10-mer
3fe7
RCSB PDB
PDBbind
10-mer
3fea
RCSB PDB
PDBbind
10-mer
3gbq
RCSB PDB
PDBbind
10-mer
3gds
RCSB PDB
PDBbind
10-mer
3hg1
RCSB PDB
PDBbind
10-mer
3iqj
RCSB PDB
PDBbind
10-mer
3ivv
RCSB PDB
PDBbind
10-mer
3nkx
RCSB PDB
PDBbind
10-mer
3oq5
RCSB PDB
PDBbind
10-mer
3puj
RCSB PDB
PDBbind
10-mer
3puk
RCSB PDB
PDBbind
10-mer
3pxe
RCSB PDB
PDBbind
10-mer
3q8d
RCSB PDB
PDBbind
10-mer
3qzt
RCSB PDB
PDBbind
10-mer
3rwi
RCSB PDB
PDBbind
10-mer
3shv
RCSB PDB
PDBbind
10-mer
3szm
RCSB PDB
PDBbind
10-mer
3tkz
RCSB PDB
PDBbind
10-mer
3tl0
RCSB PDB
PDBbind
10-mer
3uii
RCSB PDB
PDBbind
10-mer
3uik
RCSB PDB
PDBbind
10-mer
3uvm
RCSB PDB
PDBbind
10-mer
3zmp
RCSB PDB
PDBbind
10-mer
3zmq
RCSB PDB
PDBbind
10-mer
4bg6
RCSB PDB
PDBbind
10-mer
4e35
RCSB PDB
PDBbind
10-mer
4e3b
RCSB PDB
PDBbind
10-mer
4e81
RCSB PDB
PDBbind
10-mer
4e9d
RCSB PDB
PDBbind
10-mer
4er4
RCSB PDB
PDBbind
10-mer
4h39
RCSB PDB
PDBbind
10-mer
4h3b
RCSB PDB
PDBbind
10-mer
4hcz
RCSB PDB
PDBbind
10-mer
4i2w
RCSB PDB
PDBbind
10-mer
4i2z
RCSB PDB
PDBbind
10-mer
4jfd
RCSB PDB
PDBbind
10-mer
4jfe
RCSB PDB
PDBbind
10-mer
4jff
RCSB PDB
PDBbind
10-mer
4jjq
RCSB PDB
PDBbind
10-mer
4joe
RCSB PDB
PDBbind
10-mer
4jof
RCSB PDB
PDBbind
10-mer
4jog
RCSB PDB
PDBbind
10-mer
4joh
RCSB PDB
PDBbind
10-mer
4joj
RCSB PDB
PDBbind
10-mer
4jok
RCSB PDB
PDBbind
10-mer
4k6y
RCSB PDB
PDBbind
10-mer
4k72
RCSB PDB
PDBbind
10-mer
4k75
RCSB PDB
PDBbind
10-mer
4k76
RCSB PDB
PDBbind
10-mer
4k78
RCSB PDB
PDBbind
10-mer
4lnp
RCSB PDB
PDBbind
10-mer
4mdr
RCSB PDB
PDBbind
10-mer
4n84
RCSB PDB
PDBbind
10-mer
4nmo
RCSB PDB
PDBbind
10-mer
4nmp
RCSB PDB
PDBbind
10-mer
4nmq
RCSB PDB
PDBbind
10-mer
4nmr
RCSB PDB
PDBbind
10-mer
4nms
RCSB PDB
PDBbind
10-mer
4nmt
RCSB PDB
PDBbind
10-mer
4nmv
RCSB PDB
PDBbind
10-mer
4o2c
RCSB PDB
PDBbind
10-mer
4oz1
RCSB PDB
PDBbind
10-mer
4p0a
RCSB PDB
PDBbind
10-mer
4p0b
RCSB PDB
PDBbind
10-mer
4qok
RCSB PDB
PDBbind
10-mer
4rqz
RCSB PDB
PDBbind
10-mer
4u90
RCSB PDB
PDBbind
10-mer
4v11
RCSB PDB
PDBbind
10-mer
4wj5
RCSB PDB
PDBbind
10-mer
4x1n
RCSB PDB
PDBbind
10-mer
4x1p
RCSB PDB
PDBbind
10-mer
4x1q
RCSB PDB
PDBbind
10-mer
4x1r
RCSB PDB
PDBbind
10-mer
4x1s
RCSB PDB
PDBbind
10-mer
4x34
RCSB PDB
PDBbind
10-mer
4x3s
RCSB PDB
PDBbind
10-mer
4x8n
RCSB PDB
PDBbind
10-mer
4xhv
RCSB PDB
PDBbind
10-mer
4z0u
RCSB PDB
PDBbind
10-mer
4z7i
RCSB PDB
PDBbind
10-mer
4zhl
RCSB PDB
PDBbind
10-mer
4zhm
RCSB PDB
PDBbind
10-mer
5ab0
RCSB PDB
PDBbind
10-mer
5aei
RCSB PDB
PDBbind
10-mer
5azg
RCSB PDB
PDBbind
10-mer
5c0m
RCSB PDB
PDBbind
10-mer
5c11
RCSB PDB
PDBbind
10-mer
5c13
RCSB PDB
PDBbind
10-mer
5d6y
RCSB PDB
PDBbind
10-mer
5gp7
RCSB PDB
PDBbind
10-mer
5gs4
RCSB PDB
PDBbind
10-mer
5gtr
RCSB PDB
PDBbind
10-mer
5iaw
RCSB PDB
PDBbind
10-mer
5j31
RCSB PDB
PDBbind
10-mer
5jzi
RCSB PDB
PDBbind
10-mer
5myo
RCSB PDB
PDBbind
10-mer
5n1y
RCSB PDB
PDBbind
10-mer
5nx2
RCSB PDB
PDBbind
10-mer
5t6z
RCSB PDB
PDBbind
10-mer
5t70
RCSB PDB
PDBbind
10-mer
5t8r
RCSB PDB
PDBbind
10-mer
5vnb
RCSB PDB
PDBbind
10-mer
5w7i
RCSB PDB
PDBbind
10-mer
5w7j
RCSB PDB
PDBbind
10-mer
5wkf
RCSB PDB
PDBbind
10-mer
5wkh
RCSB PDB
PDBbind
10-mer
6ar2
RCSB PDB
PDBbind
10-mer
6buu
RCSB PDB
PDBbind
10-mer
6fkp
RCSB PDB
PDBbind
10-mer
6mim
RCSB PDB
PDBbind
10-mer
6qtx
RCSB PDB
PDBbind
10-mer
6pek
RCSB PDB
PDBbind
10-mer
6iiw
RCSB PDB
PDBbind
10-mer
6hzx
RCSB PDB
PDBbind
10-mer
6hoi
RCSB PDB
PDBbind
10-mer
6dkp
RCSB PDB
PDBbind
10-mer
6a8n
RCSB PDB
PDBbind
10-mer
5zys
RCSB PDB
PDBbind
10-mer
Entry Information
PDB ID
4e34
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Golgi-associated PDZ and coiled-coil motif-containing protein
Ligand Name
10-mer
EC.Number
E.C.-.-.-.-
Resolution
1.4(Å)
Affinity (Kd/Ki/IC50)
Kd=0.97uM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) J.Biol.Chem. Vol. 288: pp. 5114-5126
Ligand Properties
Formula
C
5
1
H
8
3
N
1
5
O
1
5
Molecular Weight
1146.300
Exact Mass
1145.620
No. of atoms
164
No. of bonds
166
Polar Surface Area
503.63
LOGP Value
-3.06 (
Computed with XLOGP3
)
-3.07 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 14
No. of Hydrogen Bond Acceptors: 15
No. of Rotatable Bonds: 44
No. of Nitrogen and Oxygen Atoms: 30
No. of Rings: 3
Canonical SMILES
CC[C@@H]([C@@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CC(=O)N)CO)CCC[NH+]=C(N)N)CO)C
InChI String
InChI=1S/C51H81N15O15/c1-7-24(3)38(47(77)64-39(50(80)81)25(4)8-2)63-45(75)35(23-68)62-48(78)40(27(6)69)65-46(76)36-16-12-18-66(36)49(79)33(19-28-21-57-30-14-10-9-13-29(28)30)60-42(72)31(15-11-17-56-51(54)55)58-44(74)34(22-67)61-43(73)32(20-37(53)70)59-41(71)26(5)52/h9-10,13-14,21,24-27,31-36,38-40,57,67-69H,7-8,11-12,15-20,22-23,52H2,1-6H3,(H2,53,70)(H,58,74)(H,59,71)(H,60,72)(H,61,73)(H,62,78)(H,63,75)(H,64,77)(H,65,76)(H,80,81)(H4,54,55,56)/p+2/t24-,25-,26-,27+,31-,32-,33-,34-,35-,36-,38-,39-,40-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9HD26
Entrez Gene ID
NCBI Entrez Gene ID:
57120
ASD
Information of known allosteric effects of PDB entries
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