Browse entries in the PDBbind-CN Database
HEADER 1JIZ_COMPLEX COMPND 1JIZ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 166 GLY PHE ARG GLU MET PRO GLY GLY PRO VAL TRP ARG LYS SEQRES 2 A 166 HIS TYR ILE THR TYR ARG ILE ASN ASN TYR THR PRO ASP SEQRES 3 A 166 MET ASN ARG GLU ASP VAL ASP TYR ALA ILE ARG LYS ALA SEQRES 4 A 166 PHE GLN VAL TRP SER ASN VAL THR PRO LEU LYS PHE SER SEQRES 5 A 166 LYS ILE ASN THR GLY MET ALA ASP ILE LEU VAL VAL PHE SEQRES 6 A 166 ALA ARG GLY ALA HIS GLY ASP PHE HIS ALA PHE ASP GLY SEQRES 7 A 166 LYS GLY GLY ILE LEU ALA HIS ALA PHE GLY PRO GLY SER SEQRES 8 A 166 GLY ILE GLY GLY ASP ALA HIS PHE ASP GLU ASP GLU PHE SEQRES 9 A 166 TRP THR THR HIS SER GLY GLY THR ASN LEU PHE LEU THR SEQRES 10 A 166 ALA VAL HIS GLU ILE GLY HIS SER LEU GLY LEU GLY HIS SEQRES 11 A 166 SER SER ASP PRO LYS ALA VAL MET PHE PRO THR TYR LYS SEQRES 12 A 166 TYR VAL ASP ILE ASN THR PHE ARG LEU SER ALA ASP ASP SEQRES 13 A 166 ILE ARG GLY ILE GLN SER LEU TYR GLY ASP HET ZN A 1 1 HET ZN A 2 1 HET CA A 3 1 HET CA A 4 1 HET CA A 5 1 HET CGS A 335 48 ATOM 1 N GLY A -1 17.330 3.466 75.872 1.00 32.83 N ATOM 2 CA GLY A -1 17.904 3.151 74.542 1.00 32.11 C ATOM 3 C GLY A -1 17.015 3.625 73.408 1.00 32.08 C ATOM 4 O GLY A -1 16.013 2.979 73.083 1.00 31.98 O ATOM 5 HA3 GLY A -1 18.031 2.072 74.461 1.00 0.00 H ATOM 6 HA2 GLY A -1 18.875 3.638 74.454 1.00 0.00 H ATOM 7 HN3 GLY A -1 16.406 2.999 75.969 1.00 0.00 H ATOM 8 HN2 GLY A -1 17.211 4.495 75.962 1.00 0.00 H ATOM 9 HN1 GLY A -1 17.972 3.123 76.615 1.00 0.00 H ATOM 10 N PHE A 1 17.377 4.759 72.810 1.00 31.49 N ATOM 11 CA PHE A 1 16.611 5.313 71.698 1.00 30.99 C ATOM 12 C PHE A 1 16.848 4.446 70.469 1.00 31.09 C ATOM 13 O PHE A 1 17.919 3.863 70.304 1.00 30.57 O ATOM 14 CB PHE A 1 17.050 6.752 71.397 1.00 30.19 C ATOM 15 CG PHE A 1 18.362 6.848 70.666 1.00 29.79 C ATOM 16 CD1 PHE A 1 18.434 6.603 69.299 1.00 29.47 C ATOM 17 CD2 PHE A 1 19.537 7.144 71.352 1.00 29.42 C ATOM 18 CE1 PHE A 1 19.654 6.647 68.629 1.00 29.48 C ATOM 19 CE2 PHE A 1 20.760 7.190 70.688 1.00 28.99 C ATOM 20 CZ PHE A 1 20.818 6.940 69.327 1.00 28.91 C ATOM 21 HA PHE A 1 15.554 5.325 71.962 1.00 0.00 H ATOM 22 HB2 PHE A 1 16.281 7.225 70.787 1.00 0.00 H ATOM 23 HB3 PHE A 1 17.143 7.288 72.342 1.00 0.00 H ATOM 24 HD2 PHE A 1 19.499 7.342 72.423 1.00 0.00 H ATOM 25 HE2 PHE A 1 21.671 7.423 71.239 1.00 0.00 H ATOM 26 HZ PHE A 1 21.775 6.973 68.805 1.00 0.00 H ATOM 27 HE1 PHE A 1 19.695 6.452 67.557 1.00 0.00 H ATOM 28 HD1 PHE A 1 17.524 6.374 68.745 1.00 0.00 H ATOM 29 H PHE A 1 18.225 5.261 73.143 1.00 0.00 H ATOM 30 N ARG A 2 15.843 4.365 69.608 1.00 31.68 N ATOM 31 CA ARG A 2 15.955 3.577 68.392 1.00 31.93 C ATOM 32 C ARG A 2 15.624 4.452 67.199 1.00 32.11 C ATOM 33 O ARG A 2 14.890 5.430 67.321 1.00 32.29 O ATOM 34 CB ARG A 2 15.008 2.369 68.445 1.00 31.80 C ATOM 35 CG ARG A 2 15.545 1.189 69.264 1.00 32.32 C ATOM 36 CD ARG A 2 14.658 -0.046 69.139 1.00 32.40 C ATOM 37 NE ARG A 2 13.705 -0.157 70.239 1.00 33.28 N ATOM 38 CZ ARG A 2 13.919 -0.859 71.348 1.00 33.56 C ATOM 39 NH1 ARG A 2 13.001 -0.901 72.301 1.00 34.43 N ATOM 40 NH2 ARG A 2 15.045 -1.536 71.499 1.00 33.80 N ATOM 41 HA ARG A 2 16.975 3.205 68.298 1.00 0.00 H ATOM 42 HB2 ARG A 2 14.065 2.692 68.886 1.00 0.00 H ATOM 43 HB3 ARG A 2 14.832 2.027 67.425 1.00 0.00 H ATOM 44 HG2 ARG A 2 16.546 0.941 68.910 1.00 0.00 H ATOM 45 HG3 ARG A 2 15.595 1.482 70.313 1.00 0.00 H ATOM 46 HD2 ARG A 2 15.291 -0.933 69.132 1.00 0.00 H ATOM 47 HD3 ARG A 2 14.106 0.012 68.201 1.00 0.00 H ATOM 48 HE ARG A 2 12.799 0.346 70.150 1.00 0.00 H ATOM 49 HH12 ARG A 2 13.174 -1.452 73.166 1.00 0.00 H ATOM 50 HH11 ARG A 2 12.107 -0.383 72.185 1.00 0.00 H ATOM 51 HH22 ARG A 2 15.210 -2.084 72.367 1.00 0.00 H ATOM 52 HH21 ARG A 2 15.766 -1.520 70.749 1.00 0.00 H ATOM 53 H ARG A 2 14.958 4.875 69.806 1.00 0.00 H ATOM 54 N GLU A 3 16.196 4.125 66.051 1.00 32.66 N ATOM 55 CA GLU A 3 15.910 4.883 64.846 1.00 33.66 C ATOM 56 C GLU A 3 15.024 3.966 64.023 1.00 33.69 C ATOM 57 O GLU A 3 15.138 2.743 64.126 1.00 33.75 O ATOM 58 CB GLU A 3 17.195 5.201 64.083 1.00 34.41 C ATOM 59 CG GLU A 3 17.833 4.001 63.422 1.00 36.80 C ATOM 60 CD GLU A 3 19.012 4.380 62.553 1.00 37.62 C ATOM 61 OE1 GLU A 3 19.488 3.515 61.784 1.00 38.04 O ATOM 62 OE2 GLU A 3 19.462 5.542 62.641 1.00 38.26 O ATOM 63 HA GLU A 3 15.437 5.840 65.067 1.00 0.00 H ATOM 64 HB2 GLU A 3 16.962 5.934 63.311 1.00 0.00 H ATOM 65 HB3 GLU A 3 17.913 5.628 64.783 1.00 0.00 H ATOM 66 HG2 GLU A 3 18.175 3.315 64.197 1.00 0.00 H ATOM 67 HG3 GLU A 3 17.086 3.504 62.802 1.00 0.00 H ATOM 68 H GLU A 3 16.854 3.321 66.012 1.00 0.00 H ATOM 69 N MET A 4 14.131 4.535 63.225 1.00 33.89 N ATOM 70 CA MET A 4 13.252 3.708 62.413 1.00 34.10 C ATOM 71 C MET A 4 14.098 2.869 61.463 1.00 33.97 C ATOM 72 O MET A 4 15.177 3.297 61.038 1.00 34.21 O ATOM 73 CB MET A 4 12.271 4.586 61.644 1.00 34.61 C ATOM 74 CG MET A 4 11.467 5.461 62.572 1.00 36.09 C ATOM 75 SD MET A 4 10.201 6.409 61.763 1.00 38.32 S ATOM 76 CE MET A 4 8.723 5.658 62.437 1.00 38.18 C ATOM 77 HA MET A 4 12.673 3.042 63.052 1.00 0.00 H ATOM 78 HB2 MET A 4 12.828 5.219 60.954 1.00 0.00 H ATOM 79 HB3 MET A 4 11.590 3.948 61.081 1.00 0.00 H ATOM 80 HG2 MET A 4 12.149 6.153 63.067 1.00 0.00 H ATOM 81 HG3 MET A 4 10.993 4.824 63.318 1.00 0.00 H ATOM 82 HE1 MET A 4 8.705 4.599 62.179 1.00 0.00 H ATOM 83 HE2 MET A 4 8.723 5.769 63.521 1.00 0.00 H ATOM 84 HE3 MET A 4 7.844 6.150 62.020 1.00 0.00 H ATOM 85 H MET A 4 14.059 5.572 63.180 1.00 0.00 H ATOM 86 N PRO A 5 13.631 1.652 61.135 1.00 33.51 N ATOM 87 CA PRO A 5 14.366 0.760 60.232 1.00 32.84 C ATOM 88 C PRO A 5 14.702 1.425 58.908 1.00 32.36 C ATOM 89 O PRO A 5 13.845 2.046 58.278 1.00 32.39 O ATOM 90 CB PRO A 5 13.426 -0.437 60.080 1.00 33.04 C ATOM 91 CG PRO A 5 12.069 0.147 60.341 1.00 33.80 C ATOM 92 CD PRO A 5 12.327 1.072 61.498 1.00 33.60 C ATOM 93 HA PRO A 5 15.343 0.472 60.620 1.00 0.00 H ATOM 94 HD3 PRO A 5 11.557 1.840 61.572 1.00 0.00 H ATOM 95 HD2 PRO A 5 12.384 0.525 62.439 1.00 0.00 H ATOM 96 HG3 PRO A 5 11.351 -0.628 60.609 1.00 0.00 H ATOM 97 HG2 PRO A 5 11.702 0.695 59.473 1.00 0.00 H ATOM 98 HB2 PRO A 5 13.484 -0.853 59.074 1.00 0.00 H ATOM 99 HB3 PRO A 5 13.663 -1.213 60.808 1.00 0.00 H ATOM 100 N GLY A 6 15.959 1.296 58.498 1.00 31.86 N ATOM 101 CA GLY A 6 16.393 1.907 57.260 1.00 32.04 C ATOM 102 C GLY A 6 17.092 3.221 57.538 1.00 32.28 C ATOM 103 O GLY A 6 17.897 3.689 56.732 1.00 33.41 O ATOM 104 HA3 GLY A 6 15.526 2.088 56.625 1.00 0.00 H ATOM 105 HA2 GLY A 6 17.082 1.234 56.749 1.00 0.00 H ATOM 106 H GLY A 6 16.636 0.752 59.071 1.00 0.00 H ATOM 107 N GLY A 7 16.780 3.821 58.684 1.00 31.72 N ATOM 108 CA GLY A 7 17.401 5.077 59.060 1.00 30.94 C ATOM 109 C GLY A 7 16.982 6.249 58.199 1.00 30.21 C ATOM 110 O GLY A 7 17.826 7.046 57.783 1.00 30.68 O ATOM 111 HA3 GLY A 7 18.482 4.963 58.982 1.00 0.00 H ATOM 112 HA2 GLY A 7 17.133 5.297 60.094 1.00 0.00 H ATOM 113 H GLY A 7 16.082 3.384 59.319 1.00 0.00 H ATOM 114 N PRO A 8 15.681 6.380 57.909 1.00 29.51 N ATOM 115 CA PRO A 8 15.178 7.484 57.087 1.00 29.36 C ATOM 116 C PRO A 8 15.291 8.840 57.800 1.00 29.01 C ATOM 117 O PRO A 8 14.963 8.960 58.984 1.00 29.19 O ATOM 118 CB PRO A 8 13.726 7.080 56.837 1.00 29.31 C ATOM 119 CG PRO A 8 13.360 6.383 58.115 1.00 28.66 C ATOM 120 CD PRO A 8 14.576 5.507 58.343 1.00 29.27 C ATOM 121 HA PRO A 8 15.747 7.628 56.169 1.00 0.00 H ATOM 122 HD3 PRO A 8 14.676 5.237 59.394 1.00 0.00 H ATOM 123 HD2 PRO A 8 14.528 4.601 57.739 1.00 0.00 H ATOM 124 HG3 PRO A 8 12.456 5.786 57.998 1.00 0.00 H ATOM 125 HG2 PRO A 8 13.222 7.093 58.930 1.00 0.00 H ATOM 126 HB2 PRO A 8 13.096 7.954 56.670 1.00 0.00 H ATOM 127 HB3 PRO A 8 13.645 6.407 55.983 1.00 0.00 H ATOM 128 N VAL A 9 15.753 9.857 57.080 1.00 28.25 N ATOM 129 CA VAL A 9 15.893 11.191 57.653 1.00 27.77 C ATOM 130 C VAL A 9 15.543 12.246 56.616 1.00 27.99 C ATOM 131 O VAL A 9 15.605 11.990 55.409 1.00 27.53 O ATOM 132 CB VAL A 9 17.346 11.460 58.121 1.00 27.74 C ATOM 133 CG1 VAL A 9 17.720 10.522 59.255 1.00 27.70 C ATOM 134 CG2 VAL A 9 18.307 11.285 56.949 1.00 27.22 C ATOM 135 HA VAL A 9 15.218 11.243 58.507 1.00 0.00 H ATOM 136 HB VAL A 9 17.415 12.485 58.487 1.00 0.00 H ATOM 137 HG11 VAL A 9 17.042 10.679 60.094 1.00 0.00 H ATOM 138 HG12 VAL A 9 17.642 9.490 58.912 1.00 0.00 H ATOM 139 HG13 VAL A 9 18.743 10.725 59.571 1.00 0.00 H ATOM 140 HG21 VAL A 9 18.233 10.266 56.569 1.00 0.00 H ATOM 141 HG22 VAL A 9 18.046 11.989 56.159 1.00 0.00 H ATOM 142 HG23 VAL A 9 19.326 11.476 57.285 1.00 0.00 H ATOM 143 H VAL A 9 16.020 9.698 56.088 1.00 0.00 H ATOM 144 N TRP A 10 15.164 13.430 57.085 1.00 28.29 N ATOM 145 CA TRP A 10 14.861 14.512 56.168 1.00 28.72 C ATOM 146 C TRP A 10 16.211 15.019 55.715 1.00 29.58 C ATOM 147 O TRP A 10 17.110 15.195 56.530 1.00 29.68 O ATOM 148 CB TRP A 10 14.085 15.626 56.866 1.00 27.97 C ATOM 149 CG TRP A 10 12.698 15.223 57.208 1.00 27.66 C ATOM 150 CD1 TRP A 10 12.251 14.767 58.411 1.00 27.27 C ATOM 151 CD2 TRP A 10 11.573 15.185 56.318 1.00 28.10 C ATOM 152 NE1 TRP A 10 10.916 14.445 58.330 1.00 27.72 N ATOM 153 CE2 TRP A 10 10.476 14.691 57.055 1.00 28.13 C ATOM 154 CE3 TRP A 10 11.388 15.516 54.968 1.00 27.94 C ATOM 155 CZ2 TRP A 10 9.207 14.519 56.487 1.00 28.46 C ATOM 156 CZ3 TRP A 10 10.128 15.344 54.404 1.00 28.07 C ATOM 157 CH2 TRP A 10 9.055 14.850 55.164 1.00 28.15 C ATOM 158 HA TRP A 10 14.238 14.177 55.339 1.00 0.00 H ATOM 159 HB2 TRP A 10 14.608 15.895 57.784 1.00 0.00 H ATOM 160 HB3 TRP A 10 14.045 16.492 56.205 1.00 0.00 H ATOM 161 HE1 TRP A 10 10.335 14.075 59.109 1.00 0.00 H ATOM 162 HD1 TRP A 10 12.863 14.671 59.308 1.00 0.00 H ATOM 163 HZ2 TRP A 10 8.372 14.137 57.074 1.00 0.00 H ATOM 164 HH2 TRP A 10 8.080 14.727 54.692 1.00 0.00 H ATOM 165 HZ3 TRP A 10 9.971 15.597 53.355 1.00 0.00 H ATOM 166 HE3 TRP A 10 12.216 15.901 54.372 1.00 0.00 H ATOM 167 H TRP A 10 15.085 13.581 58.111 1.00 0.00 H ATOM 168 N ARG A 11 16.373 15.234 54.417 1.00 30.95 N ATOM 169 CA ARG A 11 17.650 15.709 53.924 1.00 32.34 C ATOM 170 C ARG A 11 17.714 17.220 53.862 1.00 32.06 C ATOM 171 O ARG A 11 18.708 17.789 53.405 1.00 32.55 O ATOM 172 CB ARG A 11 17.954 15.084 52.564 1.00 34.25 C ATOM 173 CG ARG A 11 18.409 13.638 52.708 1.00 37.67 C ATOM 174 CD ARG A 11 18.748 12.992 51.384 1.00 40.90 C ATOM 175 NE ARG A 11 17.578 12.865 50.522 1.00 44.44 N ATOM 176 CZ ARG A 11 17.567 12.191 49.377 1.00 46.28 C ATOM 177 NH1 ARG A 11 18.668 11.578 48.952 1.00 47.04 N ATOM 178 NH2 ARG A 11 16.456 12.128 48.654 1.00 47.21 N ATOM 179 HA ARG A 11 18.417 15.396 54.632 1.00 0.00 H ATOM 180 HB2 ARG A 11 17.054 15.114 51.950 1.00 0.00 H ATOM 181 HB3 ARG A 11 18.743 15.658 52.078 1.00 0.00 H ATOM 182 HG2 ARG A 11 19.294 13.613 53.344 1.00 0.00 H ATOM 183 HG3 ARG A 11 17.609 13.067 53.179 1.00 0.00 H ATOM 184 HD2 ARG A 11 19.157 11.999 51.571 1.00 0.00 H ATOM 185 HD3 ARG A 11 19.495 13.602 50.876 1.00 0.00 H ATOM 186 HE ARG A 11 16.698 13.331 50.822 1.00 0.00 H ATOM 187 HH12 ARG A 11 18.657 11.051 48.055 1.00 0.00 H ATOM 188 HH11 ARG A 11 19.540 11.625 49.516 1.00 0.00 H ATOM 189 HH22 ARG A 11 16.448 11.600 47.758 1.00 0.00 H ATOM 190 HH21 ARG A 11 15.593 12.606 48.984 1.00 0.00 H ATOM 191 H ARG A 11 15.588 15.063 53.756 1.00 0.00 H ATOM 192 N LYS A 12 16.660 17.862 54.357 1.00 31.07 N ATOM 193 CA LYS A 12 16.580 19.314 54.381 1.00 30.34 C ATOM 194 C LYS A 12 16.296 19.791 55.801 1.00 30.18 C ATOM 195 O LYS A 12 15.847 19.011 56.636 1.00 30.19 O ATOM 196 CB LYS A 12 15.473 19.781 53.446 1.00 29.90 C ATOM 197 CG LYS A 12 14.120 19.175 53.746 1.00 29.55 C ATOM 198 CD LYS A 12 13.111 19.677 52.746 1.00 29.26 C ATOM 199 CE LYS A 12 11.813 18.918 52.808 1.00 28.38 C ATOM 200 NZ LYS A 12 10.920 19.386 51.713 1.00 28.67 N ATOM 201 HA LYS A 12 17.530 19.733 54.048 1.00 0.00 H ATOM 202 HB2 LYS A 12 15.389 20.865 53.527 1.00 0.00 H ATOM 203 HB3 LYS A 12 15.750 19.515 52.426 1.00 0.00 H ATOM 204 HG2 LYS A 12 14.186 18.089 53.682 1.00 0.00 H ATOM 205 HG3 LYS A 12 13.809 19.460 54.751 1.00 0.00 H ATOM 206 HD2 LYS A 12 12.911 20.729 52.948 1.00 0.00 H ATOM 207 HD3 LYS A 12 13.529 19.574 51.745 1.00 0.00 H ATOM 208 HE2 LYS A 12 11.333 19.094 53.771 1.00 0.00 H ATOM 209 HE3 LYS A 12 12.008 17.852 52.690 1.00 0.00 H ATOM 210 HZ1 LYS A 12 10.736 20.403 51.828 1.00 0.00 H ATOM 211 HZ2 LYS A 12 11.380 19.217 50.796 1.00 0.00 H ATOM 212 HZ3 LYS A 12 10.022 18.863 51.753 1.00 0.00 H ATOM 213 H LYS A 12 15.867 17.308 54.739 1.00 0.00 H ATOM 214 N HIS A 13 16.561 21.067 56.073 1.00 30.21 N ATOM 215 CA HIS A 13 16.325 21.634 57.397 1.00 29.84 C ATOM 216 C HIS A 13 15.037 22.445 57.435 1.00 29.51 C ATOM 217 O HIS A 13 14.393 22.541 58.472 1.00 29.89 O ATOM 218 CB HIS A 13 17.495 22.525 57.837 1.00 30.41 C ATOM 219 CG HIS A 13 18.786 21.789 58.023 1.00 31.66 C ATOM 220 ND1 HIS A 13 18.841 20.451 58.349 1.00 32.21 N ATOM 221 CD2 HIS A 13 20.071 22.210 57.952 1.00 32.32 C ATOM 222 CE1 HIS A 13 20.103 20.079 58.468 1.00 32.90 C ATOM 223 NE2 HIS A 13 20.870 21.128 58.232 1.00 33.06 N ATOM 224 HA HIS A 13 16.235 20.795 58.087 1.00 0.00 H ATOM 225 HB2 HIS A 13 17.645 23.294 57.079 1.00 0.00 H ATOM 226 HB3 HIS A 13 17.230 22.997 58.783 1.00 0.00 H ATOM 227 HD2 HIS A 13 20.409 23.219 57.717 1.00 0.00 H ATOM 228 HE1 HIS A 13 20.452 19.077 58.718 1.00 0.00 H ATOM 229 H HIS A 13 16.946 21.675 55.323 1.00 0.00 H ATOM 230 N TYR A 14 14.666 23.038 56.306 1.00 29.30 N ATOM 231 CA TYR A 14 13.445 23.831 56.238 1.00 28.61 C ATOM 232 C TYR A 14 12.287 22.897 55.919 1.00 26.77 C ATOM 233 O TYR A 14 12.065 22.523 54.768 1.00 25.81 O ATOM 234 CB TYR A 14 13.562 24.921 55.164 1.00 31.00 C ATOM 235 CG TYR A 14 14.599 25.983 55.473 1.00 33.58 C ATOM 236 CD1 TYR A 14 15.637 26.249 54.579 1.00 34.57 C ATOM 237 CD2 TYR A 14 14.546 26.719 56.660 1.00 35.05 C ATOM 238 CE1 TYR A 14 16.600 27.224 54.856 1.00 36.01 C ATOM 239 CE2 TYR A 14 15.504 27.697 56.950 1.00 36.35 C ATOM 240 CZ TYR A 14 16.532 27.943 56.039 1.00 36.80 C ATOM 241 OH TYR A 14 17.492 28.898 56.305 1.00 36.63 O ATOM 242 HA TYR A 14 13.276 24.327 57.194 1.00 0.00 H ATOM 243 HB3 TYR A 14 12.592 25.408 55.062 1.00 0.00 H ATOM 244 HB2 TYR A 14 13.829 24.445 54.220 1.00 0.00 H ATOM 245 HD2 TYR A 14 13.744 26.528 57.373 1.00 0.00 H ATOM 246 HE2 TYR A 14 15.448 28.262 57.880 1.00 0.00 H ATOM 247 HE1 TYR A 14 17.402 27.418 54.144 1.00 0.00 H ATOM 248 HD1 TYR A 14 15.698 25.686 53.648 1.00 0.00 H ATOM 249 HH TYR A 14 17.969 28.661 57.139 1.00 0.00 H ATOM 250 H TYR A 14 15.257 22.935 55.456 1.00 0.00 H ATOM 251 N ILE A 15 11.552 22.529 56.960 1.00 24.95 N ATOM 252 CA ILE A 15 10.430 21.618 56.825 1.00 23.11 C ATOM 253 C ILE A 15 9.113 22.316 57.098 1.00 21.97 C ATOM 254 O ILE A 15 8.997 23.114 58.024 1.00 21.78 O ATOM 255 CB ILE A 15 10.593 20.430 57.793 1.00 22.91 C ATOM 256 CG1 ILE A 15 11.949 19.752 57.535 1.00 22.17 C ATOM 257 CG2 ILE A 15 9.435 19.447 57.621 1.00 21.59 C ATOM 258 CD1 ILE A 15 12.370 18.766 58.603 1.00 22.14 C ATOM 259 HA ILE A 15 10.419 21.256 55.797 1.00 0.00 H ATOM 260 HB ILE A 15 10.572 20.785 58.823 1.00 0.00 H ATOM 261 HG12 ILE A 15 11.889 19.221 56.585 1.00 0.00 H ATOM 262 HG13 ILE A 15 12.711 20.528 57.468 1.00 0.00 H ATOM 263 HD11 ILE A 15 12.449 19.281 59.560 1.00 0.00 H ATOM 264 HD12 ILE A 15 11.627 17.972 58.676 1.00 0.00 H ATOM 265 HD13 ILE A 15 13.337 18.337 58.339 1.00 0.00 H ATOM 266 HG21 ILE A 15 8.494 19.955 57.833 1.00 0.00 H ATOM 267 HG22 ILE A 15 9.425 19.075 56.597 1.00 0.00 H ATOM 268 HG23 ILE A 15 9.563 18.613 58.311 1.00 0.00 H ATOM 269 H ILE A 15 11.787 22.904 57.901 1.00 0.00 H ATOM 270 N THR A 16 8.117 22.015 56.279 1.00 20.89 N ATOM 271 CA THR A 16 6.810 22.622 56.447 1.00 20.33 C ATOM 272 C THR A 16 5.781 21.604 56.911 1.00 19.89 C ATOM 273 O THR A 16 5.876 20.415 56.598 1.00 19.59 O ATOM 274 CB THR A 16 6.305 23.226 55.130 1.00 20.19 C ATOM 275 OG1 THR A 16 6.217 22.190 54.147 1.00 20.25 O ATOM 276 CG2 THR A 16 7.247 24.322 54.640 1.00 19.51 C ATOM 277 HA THR A 16 6.928 23.402 57.199 1.00 0.00 H ATOM 278 HB THR A 16 5.323 23.669 55.296 1.00 0.00 H ATOM 279 HG1 THR A 16 5.892 22.573 53.294 1.00 0.00 H ATOM 280 HG23 THR A 16 7.310 25.108 55.392 1.00 0.00 H ATOM 281 HG21 THR A 16 8.237 23.899 54.470 1.00 0.00 H ATOM 282 HG22 THR A 16 6.864 24.739 53.708 1.00 0.00 H ATOM 283 H THR A 16 8.273 21.336 55.507 1.00 0.00 H ATOM 284 N TYR A 17 4.809 22.076 57.681 1.00 19.56 N ATOM 285 CA TYR A 17 3.733 21.215 58.145 1.00 19.58 C ATOM 286 C TYR A 17 2.428 21.962 57.952 1.00 19.70 C ATOM 287 O TYR A 17 2.389 23.192 57.897 1.00 18.07 O ATOM 288 CB TYR A 17 3.895 20.812 59.620 1.00 19.70 C ATOM 289 CG TYR A 17 3.654 21.919 60.629 1.00 19.59 C ATOM 290 CD1 TYR A 17 4.700 22.736 61.067 1.00 19.72 C ATOM 291 CD2 TYR A 17 2.382 22.137 61.160 1.00 18.94 C ATOM 292 CE1 TYR A 17 4.483 23.738 62.018 1.00 20.48 C ATOM 293 CE2 TYR A 17 2.152 23.136 62.105 1.00 19.41 C ATOM 294 CZ TYR A 17 3.205 23.929 62.533 1.00 20.28 C ATOM 295 OH TYR A 17 2.985 24.892 63.491 1.00 20.88 O ATOM 296 HA TYR A 17 3.750 20.290 57.568 1.00 0.00 H ATOM 297 HB3 TYR A 17 4.912 20.446 59.759 1.00 0.00 H ATOM 298 HB2 TYR A 17 3.189 20.008 59.828 1.00 0.00 H ATOM 299 HD2 TYR A 17 1.551 21.514 60.829 1.00 0.00 H ATOM 300 HE2 TYR A 17 1.150 23.292 62.505 1.00 0.00 H ATOM 301 HE1 TYR A 17 5.309 24.365 62.353 1.00 0.00 H ATOM 302 HD1 TYR A 17 5.701 22.590 60.661 1.00 0.00 H ATOM 303 HH TYR A 17 2.313 25.538 63.159 1.00 0.00 H ATOM 304 H TYR A 17 4.817 23.079 57.957 1.00 0.00 H ATOM 305 N ARG A 18 1.354 21.201 57.854 1.00 21.07 N ATOM 306 CA ARG A 18 0.045 21.772 57.644 1.00 22.20 C ATOM 307 C ARG A 18 -0.978 20.948 58.398 1.00 22.09 C ATOM 308 O ARG A 18 -0.913 19.715 58.411 1.00 22.10 O ATOM 309 CB ARG A 18 -0.246 21.758 56.153 1.00 24.39 C ATOM 310 CG ARG A 18 -1.575 22.317 55.730 1.00 27.13 C ATOM 311 CD ARG A 18 -1.550 22.389 54.226 1.00 30.66 C ATOM 312 NE ARG A 18 -2.762 22.951 53.650 1.00 33.59 N ATOM 313 CZ ARG A 18 -3.925 22.319 53.603 1.00 34.54 C ATOM 314 NH1 ARG A 18 -4.037 21.091 54.107 1.00 34.68 N ATOM 315 NH2 ARG A 18 -4.965 22.916 53.033 1.00 34.66 N ATOM 316 HA ARG A 18 0.002 22.798 58.010 1.00 0.00 H ATOM 317 HB2 ARG A 18 0.532 22.338 55.657 1.00 0.00 H ATOM 318 HB3 ARG A 18 -0.197 20.723 55.814 1.00 0.00 H ATOM 319 HG2 ARG A 18 -2.382 21.664 56.063 1.00 0.00 H ATOM 320 HG3 ARG A 18 -1.717 23.312 56.153 1.00 0.00 H ATOM 321 HD2 ARG A 18 -1.418 21.380 53.834 1.00 0.00 H ATOM 322 HD3 ARG A 18 -0.705 23.008 53.924 1.00 0.00 H ATOM 323 HE ARG A 18 -2.712 23.910 53.250 1.00 0.00 H ATOM 324 HH12 ARG A 18 -4.950 20.595 54.070 1.00 0.00 H ATOM 325 HH11 ARG A 18 -3.211 20.628 54.538 1.00 0.00 H ATOM 326 HH22 ARG A 18 -5.884 22.431 52.990 1.00 0.00 H ATOM 327 HH21 ARG A 18 -4.861 23.869 52.630 1.00 0.00 H ATOM 328 H ARG A 18 1.453 20.168 57.930 1.00 0.00 H ATOM 329 N ILE A 19 -1.907 21.634 59.049 1.00 21.53 N ATOM 330 CA ILE A 19 -2.946 20.953 59.796 1.00 21.38 C ATOM 331 C ILE A 19 -4.099 20.748 58.833 1.00 21.35 C ATOM 332 O ILE A 19 -4.779 21.696 58.443 1.00 21.30 O ATOM 333 CB ILE A 19 -3.384 21.781 61.029 1.00 21.28 C ATOM 334 CG1 ILE A 19 -2.212 21.856 62.018 1.00 20.93 C ATOM 335 CG2 ILE A 19 -4.614 21.148 61.688 1.00 20.05 C ATOM 336 CD1 ILE A 19 -2.393 22.859 63.137 1.00 21.29 C ATOM 337 HA ILE A 19 -2.588 20.000 60.184 1.00 0.00 H ATOM 338 HB ILE A 19 -3.657 22.789 60.717 1.00 0.00 H ATOM 339 HG12 ILE A 19 -2.079 20.870 62.463 1.00 0.00 H ATOM 340 HG13 ILE A 19 -1.314 22.126 61.462 1.00 0.00 H ATOM 341 HD11 ILE A 19 -2.513 23.856 62.713 1.00 0.00 H ATOM 342 HD12 ILE A 19 -3.279 22.599 63.716 1.00 0.00 H ATOM 343 HD13 ILE A 19 -1.516 22.841 63.784 1.00 0.00 H ATOM 344 HG21 ILE A 19 -5.434 21.118 60.970 1.00 0.00 H ATOM 345 HG22 ILE A 19 -4.372 20.135 62.008 1.00 0.00 H ATOM 346 HG23 ILE A 19 -4.908 21.743 62.553 1.00 0.00 H ATOM 347 H ILE A 19 -1.890 22.674 59.023 1.00 0.00 H ATOM 348 N ASN A 20 -4.286 19.493 58.441 1.00 21.23 N ATOM 349 CA ASN A 20 -5.326 19.109 57.504 1.00 21.24 C ATOM 350 C ASN A 20 -6.736 19.420 57.979 1.00 21.14 C ATOM 351 O ASN A 20 -7.579 19.850 57.198 1.00 21.43 O ATOM 352 CB ASN A 20 -5.223 17.621 57.204 1.00 21.69 C ATOM 353 CG ASN A 20 -6.264 17.168 56.223 1.00 21.62 C ATOM 354 OD1 ASN A 20 -6.226 17.541 55.054 1.00 22.33 O ATOM 355 ND2 ASN A 20 -7.215 16.368 56.693 1.00 22.03 N ATOM 356 HA ASN A 20 -5.157 19.708 56.609 1.00 0.00 H ATOM 357 HB2 ASN A 20 -4.236 17.413 56.790 1.00 0.00 H ATOM 358 HB3 ASN A 20 -5.350 17.065 58.133 1.00 0.00 H ATOM 359 HD22 ASN A 20 -7.205 16.079 57.692 1.00 0.00 H ATOM 360 HD21 ASN A 20 -7.970 16.031 56.062 1.00 0.00 H ATOM 361 H ASN A 20 -3.661 18.754 58.821 1.00 0.00 H ATOM 362 N ASN A 21 -6.998 19.171 59.255 1.00 21.02 N ATOM 363 CA ASN A 21 -8.311 19.435 59.828 1.00 21.16 C ATOM 364 C ASN A 21 -8.162 19.539 61.334 1.00 21.54 C ATOM 365 O ASN A 21 -7.114 19.191 61.883 1.00 21.67 O ATOM 366 CB ASN A 21 -9.317 18.327 59.457 1.00 20.69 C ATOM 367 CG ASN A 21 -8.904 16.949 59.962 1.00 20.32 C ATOM 368 OD1 ASN A 21 -7.852 16.432 59.596 1.00 20.25 O ATOM 369 ND2 ASN A 21 -9.740 16.349 60.804 1.00 19.84 N ATOM 370 HA ASN A 21 -8.701 20.369 59.425 1.00 0.00 H ATOM 371 HB2 ASN A 21 -10.286 18.579 59.889 1.00 0.00 H ATOM 372 HB3 ASN A 21 -9.404 18.287 58.371 1.00 0.00 H ATOM 373 HD22 ASN A 21 -10.621 16.823 61.088 1.00 0.00 H ATOM 374 HD21 ASN A 21 -9.513 15.406 61.178 1.00 0.00 H ATOM 375 H ASN A 21 -6.249 18.778 59.860 1.00 0.00 H ATOM 376 N TYR A 22 -9.206 20.027 61.997 1.00 21.96 N ATOM 377 CA TYR A 22 -9.177 20.195 63.445 1.00 22.18 C ATOM 378 C TYR A 22 -10.172 19.325 64.188 1.00 22.21 C ATOM 379 O TYR A 22 -11.312 19.152 63.757 1.00 22.28 O ATOM 380 CB TYR A 22 -9.440 21.659 63.819 1.00 21.78 C ATOM 381 CG TYR A 22 -8.339 22.599 63.413 1.00 22.31 C ATOM 382 CD1 TYR A 22 -8.183 22.981 62.085 1.00 22.22 C ATOM 383 CD2 TYR A 22 -7.416 23.067 64.353 1.00 22.04 C ATOM 384 CE1 TYR A 22 -7.131 23.804 61.697 1.00 23.08 C ATOM 385 CE2 TYR A 22 -6.362 23.886 63.978 1.00 22.61 C ATOM 386 CZ TYR A 22 -6.222 24.251 62.646 1.00 23.30 C ATOM 387 OH TYR A 22 -5.164 25.042 62.256 1.00 24.08 O ATOM 388 HA TYR A 22 -8.179 19.882 63.750 1.00 0.00 H ATOM 389 HB3 TYR A 22 -9.563 21.721 64.900 1.00 0.00 H ATOM 390 HB2 TYR A 22 -10.361 21.978 63.331 1.00 0.00 H ATOM 391 HD2 TYR A 22 -7.527 22.783 65.399 1.00 0.00 H ATOM 392 HE2 TYR A 22 -5.649 24.240 64.723 1.00 0.00 H ATOM 393 HE1 TYR A 22 -7.021 24.097 60.653 1.00 0.00 H ATOM 394 HD1 TYR A 22 -8.895 22.631 61.338 1.00 0.00 H ATOM 395 HH TYR A 22 -5.204 25.906 62.738 1.00 0.00 H ATOM 396 H TYR A 22 -10.062 20.295 61.471 1.00 0.00 H ATOM 397 N THR A 23 -9.730 18.784 65.317 1.00 22.54 N ATOM 398 CA THR A 23 -10.591 17.968 66.152 1.00 22.60 C ATOM 399 C THR A 23 -11.576 18.925 66.824 1.00 23.47 C ATOM 400 O THR A 23 -11.206 20.029 67.232 1.00 22.99 O ATOM 401 CB THR A 23 -9.790 17.255 67.246 1.00 22.21 C ATOM 402 OG1 THR A 23 -10.691 16.572 68.122 1.00 22.22 O ATOM 403 CG2 THR A 23 -8.974 18.260 68.052 1.00 21.11 C ATOM 404 HA THR A 23 -11.086 17.210 65.546 1.00 0.00 H ATOM 405 HB THR A 23 -9.111 16.544 66.777 1.00 0.00 H ATOM 406 HG1 THR A 23 -11.212 15.907 67.605 1.00 0.00 H ATOM 407 HG23 THR A 23 -8.286 18.783 67.388 1.00 0.00 H ATOM 408 HG21 THR A 23 -9.646 18.979 68.521 1.00 0.00 H ATOM 409 HG22 THR A 23 -8.409 17.734 68.821 1.00 0.00 H ATOM 410 H THR A 23 -8.746 18.949 65.609 1.00 0.00 H ATOM 411 N PRO A 24 -12.849 18.525 66.933 1.00 23.96 N ATOM 412 CA PRO A 24 -13.837 19.397 67.569 1.00 24.34 C ATOM 413 C PRO A 24 -13.702 19.433 69.091 1.00 24.97 C ATOM 414 O PRO A 24 -14.327 20.256 69.753 1.00 25.48 O ATOM 415 CB PRO A 24 -15.163 18.793 67.117 1.00 23.85 C ATOM 416 CG PRO A 24 -14.846 17.334 67.050 1.00 24.15 C ATOM 417 CD PRO A 24 -13.491 17.321 66.373 1.00 24.30 C ATOM 418 HA PRO A 24 -13.723 20.443 67.283 1.00 0.00 H ATOM 419 HD3 PRO A 24 -12.931 16.421 66.626 1.00 0.00 H ATOM 420 HD2 PRO A 24 -13.590 17.393 65.290 1.00 0.00 H ATOM 421 HG3 PRO A 24 -15.587 16.797 66.458 1.00 0.00 H ATOM 422 HG2 PRO A 24 -14.792 16.896 68.047 1.00 0.00 H ATOM 423 HB2 PRO A 24 -15.954 18.992 67.840 1.00 0.00 H ATOM 424 HB3 PRO A 24 -15.459 19.178 66.141 1.00 0.00 H ATOM 425 N ASP A 25 -12.878 18.546 69.642 1.00 25.72 N ATOM 426 CA ASP A 25 -12.692 18.477 71.086 1.00 26.82 C ATOM 427 C ASP A 25 -12.001 19.694 71.665 1.00 27.40 C ATOM 428 O ASP A 25 -12.265 20.090 72.800 1.00 26.76 O ATOM 429 CB ASP A 25 -11.875 17.246 71.466 1.00 27.58 C ATOM 430 CG ASP A 25 -12.455 15.977 70.917 1.00 28.50 C ATOM 431 OD1 ASP A 25 -13.688 15.923 70.713 1.00 28.57 O ATOM 432 OD2 ASP A 25 -11.671 15.028 70.702 1.00 30.04 O ATOM 433 HA ASP A 25 -13.697 18.426 71.504 1.00 0.00 H ATOM 434 HB2 ASP A 25 -10.863 17.364 71.078 1.00 0.00 H ATOM 435 HB3 ASP A 25 -11.839 17.172 72.553 1.00 0.00 H ATOM 436 H ASP A 25 -12.355 17.888 69.029 1.00 0.00 H ATOM 437 N MET A 26 -11.095 20.270 70.890 1.00 28.60 N ATOM 438 CA MET A 26 -10.356 21.431 71.342 1.00 29.52 C ATOM 439 C MET A 26 -10.673 22.652 70.511 1.00 30.46 C ATOM 440 O MET A 26 -11.263 22.565 69.437 1.00 30.14 O ATOM 441 CB MET A 26 -8.856 21.157 71.280 1.00 29.26 C ATOM 442 CG MET A 26 -8.369 20.130 72.275 1.00 29.08 C ATOM 443 SD MET A 26 -6.689 19.595 71.895 1.00 29.02 S ATOM 444 CE MET A 26 -5.743 21.086 72.281 1.00 28.68 C ATOM 445 HA MET A 26 -10.656 21.628 72.371 1.00 0.00 H ATOM 446 HB2 MET A 26 -8.615 20.803 70.278 1.00 0.00 H ATOM 447 HB3 MET A 26 -8.330 22.093 71.470 1.00 0.00 H ATOM 448 HG2 MET A 26 -9.032 19.265 72.247 1.00 0.00 H ATOM 449 HG3 MET A 26 -8.386 20.567 73.274 1.00 0.00 H ATOM 450 HE1 MET A 26 -6.088 21.907 71.652 1.00 0.00 H ATOM 451 HE2 MET A 26 -5.887 21.345 73.330 1.00 0.00 H ATOM 452 HE3 MET A 26 -4.685 20.902 72.093 1.00 0.00 H ATOM 453 H MET A 26 -10.911 19.883 69.942 1.00 0.00 H ATOM 454 N ASN A 27 -10.273 23.797 71.033 1.00 32.19 N ATOM 455 CA ASN A 27 -10.477 25.060 70.359 1.00 34.27 C ATOM 456 C ASN A 27 -9.405 25.157 69.270 1.00 34.79 C ATOM 457 O ASN A 27 -8.245 24.804 69.495 1.00 35.36 O ATOM 458 CB ASN A 27 -10.349 26.184 71.385 1.00 36.07 C ATOM 459 CG ASN A 27 -10.331 27.544 70.754 1.00 38.99 C ATOM 460 OD1 ASN A 27 -11.269 27.945 70.055 1.00 40.93 O ATOM 461 ND2 ASN A 27 -9.256 28.275 70.996 1.00 40.05 N ATOM 462 HA ASN A 27 -11.464 25.139 69.904 1.00 0.00 H ATOM 463 HB2 ASN A 27 -11.194 26.129 72.071 1.00 0.00 H ATOM 464 HB3 ASN A 27 -9.422 26.045 71.941 1.00 0.00 H ATOM 465 HD22 ASN A 27 -8.492 27.895 71.590 1.00 0.00 H ATOM 466 HD21 ASN A 27 -9.175 29.230 70.592 1.00 0.00 H ATOM 467 H ASN A 27 -9.797 23.790 71.957 1.00 0.00 H ATOM 468 N ARG A 28 -9.797 25.620 68.091 1.00 35.06 N ATOM 469 CA ARG A 28 -8.874 25.726 66.968 1.00 36.27 C ATOM 470 C ARG A 28 -7.480 26.271 67.314 1.00 36.08 C ATOM 471 O ARG A 28 -6.469 25.711 66.880 1.00 36.29 O ATOM 472 CB ARG A 28 -9.494 26.584 65.860 1.00 37.89 C ATOM 473 CG ARG A 28 -8.790 26.472 64.513 1.00 39.99 C ATOM 474 CD ARG A 28 -9.222 27.582 63.560 1.00 42.13 C ATOM 475 NE ARG A 28 -8.876 27.280 62.172 1.00 44.04 N ATOM 476 CZ ARG A 28 -9.476 26.341 61.443 1.00 44.92 C ATOM 477 NH1 ARG A 28 -10.458 25.612 61.969 1.00 44.87 N ATOM 478 NH2 ARG A 28 -9.093 26.124 60.190 1.00 45.04 N ATOM 479 HA ARG A 28 -8.715 24.700 66.636 1.00 0.00 H ATOM 480 HB2 ARG A 28 -10.532 26.277 65.730 1.00 0.00 H ATOM 481 HB3 ARG A 28 -9.462 27.626 66.177 1.00 0.00 H ATOM 482 HG2 ARG A 28 -7.713 26.539 64.670 1.00 0.00 H ATOM 483 HG3 ARG A 28 -9.032 25.508 64.066 1.00 0.00 H ATOM 484 HD2 ARG A 28 -8.728 28.509 63.852 1.00 0.00 H ATOM 485 HD3 ARG A 28 -10.302 27.709 63.634 1.00 0.00 H ATOM 486 HE ARG A 28 -8.115 27.832 61.727 1.00 0.00 H ATOM 487 HH12 ARG A 28 -10.925 24.879 61.398 1.00 0.00 H ATOM 488 HH11 ARG A 28 -10.758 25.775 62.951 1.00 0.00 H ATOM 489 HH22 ARG A 28 -9.563 25.390 59.622 1.00 0.00 H ATOM 490 HH21 ARG A 28 -8.323 26.688 59.776 1.00 0.00 H ATOM 491 H ARG A 28 -10.786 25.914 67.965 1.00 0.00 H ATOM 492 N GLU A 29 -7.412 27.349 68.091 1.00 35.50 N ATOM 493 CA GLU A 29 -6.113 27.918 68.428 1.00 35.34 C ATOM 494 C GLU A 29 -5.307 27.102 69.424 1.00 34.15 C ATOM 495 O GLU A 29 -4.077 27.153 69.420 1.00 33.96 O ATOM 496 CB GLU A 29 -6.240 29.374 68.910 1.00 37.47 C ATOM 497 CG GLU A 29 -7.497 29.732 69.680 1.00 41.25 C ATOM 498 CD GLU A 29 -8.748 29.835 68.797 1.00 43.67 C ATOM 499 OE1 GLU A 29 -9.838 30.149 69.333 1.00 44.15 O ATOM 500 OE2 GLU A 29 -8.645 29.605 67.569 1.00 45.49 O ATOM 501 HA GLU A 29 -5.552 27.894 67.494 1.00 0.00 H ATOM 502 HB2 GLU A 29 -5.387 29.584 69.555 1.00 0.00 H ATOM 503 HB3 GLU A 29 -6.197 30.018 68.031 1.00 0.00 H ATOM 504 HG2 GLU A 29 -7.670 28.965 70.435 1.00 0.00 H ATOM 505 HG3 GLU A 29 -7.340 30.693 70.170 1.00 0.00 H ATOM 506 H GLU A 29 -8.283 27.784 68.457 1.00 0.00 H ATOM 507 N ASP A 30 -5.984 26.343 70.276 1.00 33.09 N ATOM 508 CA ASP A 30 -5.274 25.506 71.237 1.00 31.69 C ATOM 509 C ASP A 30 -4.572 24.399 70.466 1.00 30.54 C ATOM 510 O ASP A 30 -3.477 23.963 70.829 1.00 30.19 O ATOM 511 CB ASP A 30 -6.253 24.911 72.245 1.00 32.38 C ATOM 512 CG ASP A 30 -6.709 25.925 73.277 1.00 32.79 C ATOM 513 OD1 ASP A 30 -7.747 25.692 73.927 1.00 32.60 O ATOM 514 OD2 ASP A 30 -6.022 26.956 73.446 1.00 33.79 O ATOM 515 HA ASP A 30 -4.546 26.100 71.789 1.00 0.00 H ATOM 516 HB2 ASP A 30 -7.126 24.541 71.708 1.00 0.00 H ATOM 517 HB3 ASP A 30 -5.766 24.083 72.759 1.00 0.00 H ATOM 518 H ASP A 30 -7.024 26.345 70.259 1.00 0.00 H ATOM 519 N VAL A 31 -5.212 23.954 69.390 1.00 29.32 N ATOM 520 CA VAL A 31 -4.649 22.912 68.549 1.00 28.56 C ATOM 521 C VAL A 31 -3.378 23.437 67.891 1.00 28.51 C ATOM 522 O VAL A 31 -2.342 22.767 67.897 1.00 28.33 O ATOM 523 CB VAL A 31 -5.655 22.475 67.469 1.00 27.85 C ATOM 524 CG1 VAL A 31 -5.012 21.477 66.519 1.00 26.99 C ATOM 525 CG2 VAL A 31 -6.878 21.863 68.134 1.00 27.11 C ATOM 526 HA VAL A 31 -4.418 22.045 69.167 1.00 0.00 H ATOM 527 HB VAL A 31 -5.961 23.347 66.891 1.00 0.00 H ATOM 528 HG11 VAL A 31 -4.151 21.939 66.037 1.00 0.00 H ATOM 529 HG12 VAL A 31 -4.689 20.600 67.080 1.00 0.00 H ATOM 530 HG13 VAL A 31 -5.737 21.179 65.762 1.00 0.00 H ATOM 531 HG21 VAL A 31 -6.575 20.996 68.721 1.00 0.00 H ATOM 532 HG22 VAL A 31 -7.343 22.602 68.787 1.00 0.00 H ATOM 533 HG23 VAL A 31 -7.590 21.554 67.369 1.00 0.00 H ATOM 534 H VAL A 31 -6.137 24.361 69.144 1.00 0.00 H ATOM 535 N ASP A 32 -3.459 24.642 67.333 1.00 28.14 N ATOM 536 CA ASP A 32 -2.308 25.251 66.691 1.00 28.46 C ATOM 537 C ASP A 32 -1.167 25.390 67.692 1.00 28.67 C ATOM 538 O ASP A 32 -0.006 25.113 67.383 1.00 28.31 O ATOM 539 CB ASP A 32 -2.674 26.628 66.134 1.00 29.29 C ATOM 540 CG ASP A 32 -3.567 26.547 64.913 1.00 30.71 C ATOM 541 OD1 ASP A 32 -3.437 25.571 64.140 1.00 31.17 O ATOM 542 OD2 ASP A 32 -4.386 27.469 64.712 1.00 31.73 O ATOM 543 HA ASP A 32 -1.991 24.611 65.868 1.00 0.00 H ATOM 544 HB2 ASP A 32 -3.193 27.191 66.909 1.00 0.00 H ATOM 545 HB3 ASP A 32 -1.756 27.149 65.861 1.00 0.00 H ATOM 546 H ASP A 32 -4.362 25.157 67.357 1.00 0.00 H ATOM 547 N TYR A 33 -1.511 25.823 68.899 1.00 29.04 N ATOM 548 CA TYR A 33 -0.530 26.003 69.957 1.00 29.27 C ATOM 549 C TYR A 33 0.160 24.668 70.260 1.00 29.01 C ATOM 550 O TYR A 33 1.389 24.557 70.208 1.00 28.67 O ATOM 551 CB TYR A 33 -1.225 26.560 71.208 1.00 29.49 C ATOM 552 CG TYR A 33 -0.267 26.986 72.293 1.00 30.27 C ATOM 553 CD1 TYR A 33 0.188 26.079 73.245 1.00 30.91 C ATOM 554 CD2 TYR A 33 0.230 28.282 72.334 1.00 30.75 C ATOM 555 CE1 TYR A 33 1.116 26.451 74.209 1.00 31.55 C ATOM 556 CE2 TYR A 33 1.159 28.665 73.292 1.00 31.72 C ATOM 557 CZ TYR A 33 1.601 27.744 74.227 1.00 31.82 C ATOM 558 OH TYR A 33 2.537 28.106 75.176 1.00 32.51 O ATOM 559 HA TYR A 33 0.232 26.714 69.637 1.00 0.00 H ATOM 560 HB3 TYR A 33 -1.881 25.788 71.611 1.00 0.00 H ATOM 561 HB2 TYR A 33 -1.821 27.425 70.915 1.00 0.00 H ATOM 562 HD2 TYR A 33 -0.115 29.011 71.601 1.00 0.00 H ATOM 563 HE2 TYR A 33 1.539 29.687 73.308 1.00 0.00 H ATOM 564 HE1 TYR A 33 1.460 25.726 74.947 1.00 0.00 H ATOM 565 HD1 TYR A 33 -0.191 25.057 73.234 1.00 0.00 H ATOM 566 HH TYR A 33 2.734 27.329 75.757 1.00 0.00 H ATOM 567 H TYR A 33 -2.510 26.039 69.093 1.00 0.00 H ATOM 568 N ALA A 34 -0.646 23.655 70.555 1.00 28.76 N ATOM 569 CA ALA A 34 -0.134 22.326 70.859 1.00 28.72 C ATOM 570 C ALA A 34 0.890 21.849 69.828 1.00 28.60 C ATOM 571 O ALA A 34 2.021 21.512 70.178 1.00 28.38 O ATOM 572 CB ALA A 34 -1.294 21.335 70.939 1.00 28.35 C ATOM 573 HA ALA A 34 0.377 22.382 71.820 1.00 0.00 H ATOM 574 HB1 ALA A 34 -1.983 21.647 71.724 1.00 0.00 H ATOM 575 HB2 ALA A 34 -1.817 21.312 69.983 1.00 0.00 H ATOM 576 HB3 ALA A 34 -0.907 20.342 71.167 1.00 0.00 H ATOM 577 H ALA A 34 -1.673 23.815 70.569 1.00 0.00 H ATOM 578 N ILE A 35 0.493 21.824 68.559 1.00 28.52 N ATOM 579 CA ILE A 35 1.381 21.371 67.495 1.00 28.84 C ATOM 580 C ILE A 35 2.620 22.252 67.326 1.00 28.89 C ATOM 581 O ILE A 35 3.728 21.741 67.155 1.00 27.84 O ATOM 582 CB ILE A 35 0.627 21.272 66.132 1.00 28.99 C ATOM 583 CG1 ILE A 35 -0.116 19.935 66.027 1.00 29.09 C ATOM 584 CG2 ILE A 35 1.613 21.355 64.976 1.00 28.77 C ATOM 585 CD1 ILE A 35 -1.153 19.706 67.081 1.00 29.75 C ATOM 586 HA ILE A 35 1.720 20.381 67.800 1.00 0.00 H ATOM 587 HB ILE A 35 -0.082 22.099 66.083 1.00 0.00 H ATOM 588 HG12 ILE A 35 -0.607 19.896 65.055 1.00 0.00 H ATOM 589 HG13 ILE A 35 0.619 19.133 66.095 1.00 0.00 H ATOM 590 HD11 ILE A 35 -0.681 19.727 68.063 1.00 0.00 H ATOM 591 HD12 ILE A 35 -1.908 20.490 67.022 1.00 0.00 H ATOM 592 HD13 ILE A 35 -1.622 18.735 66.922 1.00 0.00 H ATOM 593 HG21 ILE A 35 2.145 22.305 65.021 1.00 0.00 H ATOM 594 HG22 ILE A 35 2.327 20.534 65.049 1.00 0.00 H ATOM 595 HG23 ILE A 35 1.072 21.284 64.033 1.00 0.00 H ATOM 596 H ILE A 35 -0.471 22.134 68.321 1.00 0.00 H ATOM 597 N ARG A 36 2.430 23.567 67.372 1.00 29.31 N ATOM 598 CA ARG A 36 3.537 24.506 67.219 1.00 30.30 C ATOM 599 C ARG A 36 4.594 24.234 68.278 1.00 30.17 C ATOM 600 O ARG A 36 5.788 24.142 67.979 1.00 29.84 O ATOM 601 CB ARG A 36 3.039 25.941 67.374 1.00 31.88 C ATOM 602 CG ARG A 36 4.097 27.020 67.142 1.00 34.16 C ATOM 603 CD ARG A 36 3.631 28.324 67.764 1.00 36.31 C ATOM 604 NE ARG A 36 2.194 28.509 67.559 1.00 39.92 N ATOM 605 CZ ARG A 36 1.396 29.201 68.370 1.00 41.34 C ATOM 606 NH1 ARG A 36 1.899 29.784 69.455 1.00 41.97 N ATOM 607 NH2 ARG A 36 0.093 29.301 68.102 1.00 40.65 N ATOM 608 HA ARG A 36 3.966 24.376 66.225 1.00 0.00 H ATOM 609 HB2 ARG A 36 2.232 26.099 66.658 1.00 0.00 H ATOM 610 HB3 ARG A 36 2.653 26.058 68.387 1.00 0.00 H ATOM 611 HG2 ARG A 36 5.037 26.713 67.601 1.00 0.00 H ATOM 612 HG3 ARG A 36 4.246 27.160 66.071 1.00 0.00 H ATOM 613 HD2 ARG A 36 4.168 29.153 67.303 1.00 0.00 H ATOM 614 HD3 ARG A 36 3.841 28.306 68.833 1.00 0.00 H ATOM 615 HE ARG A 36 1.765 28.069 66.720 1.00 0.00 H ATOM 616 HH12 ARG A 36 1.278 30.325 70.090 1.00 0.00 H ATOM 617 HH11 ARG A 36 2.913 29.699 69.668 1.00 0.00 H ATOM 618 HH22 ARG A 36 -0.528 29.842 68.737 1.00 0.00 H ATOM 619 HH21 ARG A 36 -0.301 28.838 67.258 1.00 0.00 H ATOM 620 H ARG A 36 1.469 23.936 67.521 1.00 0.00 H ATOM 621 N LYS A 37 4.136 24.112 69.520 1.00 29.62 N ATOM 622 CA LYS A 37 5.016 23.847 70.647 1.00 29.26 C ATOM 623 C LYS A 37 5.662 22.474 70.562 1.00 28.66 C ATOM 624 O LYS A 37 6.789 22.285 71.014 1.00 28.36 O ATOM 625 CB LYS A 37 4.234 23.970 71.955 1.00 29.90 C ATOM 626 CG LYS A 37 3.949 25.398 72.357 1.00 30.65 C ATOM 627 CD LYS A 37 5.257 26.134 72.548 1.00 33.02 C ATOM 628 CE LYS A 37 5.055 27.558 72.995 1.00 34.87 C ATOM 629 NZ LYS A 37 6.381 28.203 73.207 1.00 35.72 N ATOM 630 HA LYS A 37 5.815 24.588 70.619 1.00 0.00 H ATOM 631 HB2 LYS A 37 3.284 23.448 71.839 1.00 0.00 H ATOM 632 HB3 LYS A 37 4.813 23.497 72.749 1.00 0.00 H ATOM 633 HG2 LYS A 37 3.366 25.887 71.576 1.00 0.00 H ATOM 634 HG3 LYS A 37 3.385 25.408 73.290 1.00 0.00 H ATOM 635 HD2 LYS A 37 5.847 25.611 73.301 1.00 0.00 H ATOM 636 HD3 LYS A 37 5.798 26.137 71.602 1.00 0.00 H ATOM 637 HE2 LYS A 37 4.491 27.570 73.928 1.00 0.00 H ATOM 638 HE3 LYS A 37 4.502 28.104 72.231 1.00 0.00 H ATOM 639 HZ1 LYS A 37 6.907 27.681 73.937 1.00 0.00 H ATOM 640 HZ2 LYS A 37 6.917 28.191 72.316 1.00 0.00 H ATOM 641 HZ3 LYS A 37 6.241 29.186 73.516 1.00 0.00 H ATOM 642 H LYS A 37 3.115 24.209 69.691 1.00 0.00 H ATOM 643 N ALA A 38 4.943 21.516 69.986 1.00 28.13 N ATOM 644 CA ALA A 38 5.462 20.165 69.843 1.00 27.78 C ATOM 645 C ALA A 38 6.626 20.165 68.855 1.00 27.75 C ATOM 646 O ALA A 38 7.642 19.503 69.085 1.00 27.98 O ATOM 647 CB ALA A 38 4.360 19.224 69.374 1.00 27.75 C ATOM 648 HA ALA A 38 5.821 19.814 70.810 1.00 0.00 H ATOM 649 HB1 ALA A 38 3.552 19.220 70.105 1.00 0.00 H ATOM 650 HB2 ALA A 38 3.979 19.564 68.411 1.00 0.00 H ATOM 651 HB3 ALA A 38 4.763 18.217 69.272 1.00 0.00 H ATOM 652 H ALA A 38 3.991 21.737 69.631 1.00 0.00 H ATOM 653 N PHE A 39 6.482 20.906 67.758 1.00 27.23 N ATOM 654 CA PHE A 39 7.552 20.981 66.770 1.00 27.32 C ATOM 655 C PHE A 39 8.753 21.692 67.375 1.00 27.97 C ATOM 656 O PHE A 39 9.899 21.279 67.180 1.00 28.55 O ATOM 657 CB PHE A 39 7.096 21.728 65.508 1.00 26.08 C ATOM 658 CG PHE A 39 6.384 20.854 64.507 1.00 24.96 C ATOM 659 CD1 PHE A 39 5.017 21.003 64.276 1.00 23.86 C ATOM 660 CD2 PHE A 39 7.076 19.855 63.822 1.00 23.97 C ATOM 661 CE1 PHE A 39 4.351 20.167 63.382 1.00 23.08 C ATOM 662 CE2 PHE A 39 6.416 19.018 62.929 1.00 23.28 C ATOM 663 CZ PHE A 39 5.051 19.174 62.709 1.00 22.93 C ATOM 664 HA PHE A 39 7.824 19.965 66.485 1.00 0.00 H ATOM 665 HB2 PHE A 39 6.420 22.529 65.808 1.00 0.00 H ATOM 666 HB3 PHE A 39 7.974 22.157 65.026 1.00 0.00 H ATOM 667 HD2 PHE A 39 8.146 19.729 63.989 1.00 0.00 H ATOM 668 HE2 PHE A 39 6.968 18.240 62.402 1.00 0.00 H ATOM 669 HZ PHE A 39 4.532 18.518 62.010 1.00 0.00 H ATOM 670 HE1 PHE A 39 3.282 20.292 63.211 1.00 0.00 H ATOM 671 HD1 PHE A 39 4.463 21.782 64.800 1.00 0.00 H ATOM 672 H PHE A 39 5.600 21.435 67.605 1.00 0.00 H ATOM 673 N GLN A 40 8.483 22.759 68.118 1.00 28.41 N ATOM 674 CA GLN A 40 9.542 23.529 68.754 1.00 28.76 C ATOM 675 C GLN A 40 10.422 22.653 69.641 1.00 27.94 C ATOM 676 O GLN A 40 11.634 22.850 69.707 1.00 27.29 O ATOM 677 CB GLN A 40 8.946 24.663 69.583 1.00 30.12 C ATOM 678 CG GLN A 40 9.997 25.510 70.265 1.00 33.13 C ATOM 679 CD GLN A 40 9.409 26.586 71.162 1.00 35.19 C ATOM 680 OE1 GLN A 40 10.149 27.300 71.839 1.00 37.33 O ATOM 681 NE2 GLN A 40 8.078 26.709 71.172 1.00 35.00 N ATOM 682 HA GLN A 40 10.166 23.944 67.962 1.00 0.00 H ATOM 683 HB2 GLN A 40 8.357 25.302 68.925 1.00 0.00 H ATOM 684 HB3 GLN A 40 8.297 24.233 70.346 1.00 0.00 H ATOM 685 HG2 GLN A 40 10.627 24.859 70.871 1.00 0.00 H ATOM 686 HG3 GLN A 40 10.605 25.991 69.499 1.00 0.00 H ATOM 687 HE22 GLN A 40 7.493 26.082 70.583 1.00 0.00 H ATOM 688 HE21 GLN A 40 7.627 27.431 71.769 1.00 0.00 H ATOM 689 H GLN A 40 7.493 23.051 68.248 1.00 0.00 H ATOM 690 N VAL A 41 9.809 21.688 70.323 1.00 27.62 N ATOM 691 CA VAL A 41 10.552 20.782 71.193 1.00 27.42 C ATOM 692 C VAL A 41 11.695 20.136 70.427 1.00 27.24 C ATOM 693 O VAL A 41 12.760 19.878 70.987 1.00 27.84 O ATOM 694 CB VAL A 41 9.647 19.661 71.760 1.00 27.44 C ATOM 695 CG1 VAL A 41 10.487 18.617 72.459 1.00 27.26 C ATOM 696 CG2 VAL A 41 8.651 20.245 72.742 1.00 27.86 C ATOM 697 HA VAL A 41 10.937 21.378 72.021 1.00 0.00 H ATOM 698 HB VAL A 41 9.110 19.196 70.933 1.00 0.00 H ATOM 699 HG11 VAL A 41 11.191 18.184 71.749 1.00 0.00 H ATOM 700 HG12 VAL A 41 11.036 19.082 73.278 1.00 0.00 H ATOM 701 HG13 VAL A 41 9.838 17.835 72.853 1.00 0.00 H ATOM 702 HG21 VAL A 41 9.188 20.722 73.562 1.00 0.00 H ATOM 703 HG22 VAL A 41 8.032 20.984 72.233 1.00 0.00 H ATOM 704 HG23 VAL A 41 8.020 19.448 73.135 1.00 0.00 H ATOM 705 H VAL A 41 8.779 21.577 70.234 1.00 0.00 H ATOM 706 N TRP A 42 11.477 19.885 69.142 1.00 26.81 N ATOM 707 CA TRP A 42 12.506 19.262 68.324 1.00 26.84 C ATOM 708 C TRP A 42 13.435 20.262 67.628 1.00 27.18 C ATOM 709 O TRP A 42 14.590 19.937 67.346 1.00 26.76 O ATOM 710 CB TRP A 42 11.860 18.323 67.304 1.00 26.11 C ATOM 711 CG TRP A 42 11.067 17.213 67.938 1.00 24.73 C ATOM 712 CD1 TRP A 42 9.701 17.115 68.021 1.00 24.70 C ATOM 713 CD2 TRP A 42 11.591 16.042 68.576 1.00 24.28 C ATOM 714 NE1 TRP A 42 9.345 15.953 68.667 1.00 23.69 N ATOM 715 CE2 TRP A 42 10.482 15.274 69.018 1.00 23.99 C ATOM 716 CE3 TRP A 42 12.888 15.564 68.818 1.00 23.38 C ATOM 717 CZ2 TRP A 42 10.633 14.051 69.687 1.00 23.46 C ATOM 718 CZ3 TRP A 42 13.038 14.345 69.486 1.00 23.66 C ATOM 719 CH2 TRP A 42 11.913 13.603 69.912 1.00 23.31 C ATOM 720 HA TRP A 42 13.142 18.694 69.003 1.00 0.00 H ATOM 721 HB2 TRP A 42 11.193 18.907 66.669 1.00 0.00 H ATOM 722 HB3 TRP A 42 12.647 17.881 66.693 1.00 0.00 H ATOM 723 HE1 TRP A 42 8.371 15.641 68.858 1.00 0.00 H ATOM 724 HD1 TRP A 42 8.999 17.852 67.631 1.00 0.00 H ATOM 725 HZ2 TRP A 42 9.767 13.477 70.017 1.00 0.00 H ATOM 726 HH2 TRP A 42 12.063 12.656 70.430 1.00 0.00 H ATOM 727 HZ3 TRP A 42 14.039 13.961 69.681 1.00 0.00 H ATOM 728 HE3 TRP A 42 13.760 16.131 68.492 1.00 0.00 H ATOM 729 H TRP A 42 10.562 20.136 68.716 1.00 0.00 H ATOM 730 N SER A 43 12.936 21.471 67.364 1.00 28.00 N ATOM 731 CA SER A 43 13.728 22.529 66.718 1.00 28.86 C ATOM 732 C SER A 43 14.844 22.969 67.654 1.00 29.66 C ATOM 733 O SER A 43 15.973 23.236 67.227 1.00 29.45 O ATOM 734 CB SER A 43 12.877 23.768 66.435 1.00 28.77 C ATOM 735 OG SER A 43 11.712 23.470 65.700 1.00 31.28 O ATOM 736 HA SER A 43 14.116 22.121 65.785 1.00 0.00 H ATOM 737 HB2 SER A 43 13.475 24.480 65.867 1.00 0.00 H ATOM 738 HB3 SER A 43 12.586 24.216 67.385 1.00 0.00 H ATOM 739 HG SER A 43 11.156 22.829 66.210 1.00 0.00 H ATOM 740 H SER A 43 11.950 21.673 67.625 1.00 0.00 H ATOM 741 N ASN A 44 14.494 23.059 68.935 1.00 29.88 N ATOM 742 CA ASN A 44 15.408 23.486 69.983 1.00 30.62 C ATOM 743 C ASN A 44 16.693 22.672 70.099 1.00 30.86 C ATOM 744 O ASN A 44 17.711 23.190 70.558 1.00 31.39 O ATOM 745 CB ASN A 44 14.689 23.465 71.333 1.00 31.64 C ATOM 746 CG ASN A 44 13.554 24.472 71.416 1.00 33.08 C ATOM 747 OD1 ASN A 44 12.694 24.372 72.294 1.00 33.93 O ATOM 748 ND2 ASN A 44 13.550 25.454 70.513 1.00 33.62 N ATOM 749 HA ASN A 44 15.714 24.492 69.698 1.00 0.00 H ATOM 750 HB2 ASN A 44 14.281 22.467 71.494 1.00 0.00 H ATOM 751 HB3 ASN A 44 15.413 23.691 72.116 1.00 0.00 H ATOM 752 HD22 ASN A 44 14.296 25.499 69.790 1.00 0.00 H ATOM 753 HD21 ASN A 44 12.801 26.175 70.532 1.00 0.00 H ATOM 754 H ASN A 44 13.519 22.812 69.200 1.00 0.00 H ATOM 755 N VAL A 45 16.659 21.408 69.690 1.00 30.43 N ATOM 756 CA VAL A 45 17.843 20.567 69.807 1.00 30.22 C ATOM 757 C VAL A 45 18.436 20.084 68.487 1.00 30.09 C ATOM 758 O VAL A 45 19.269 19.177 68.469 1.00 30.19 O ATOM 759 CB VAL A 45 17.547 19.343 70.700 1.00 30.51 C ATOM 760 CG1 VAL A 45 17.218 19.805 72.112 1.00 30.05 C ATOM 761 CG2 VAL A 45 16.382 18.545 70.124 1.00 30.74 C ATOM 762 HA VAL A 45 18.595 21.217 70.255 1.00 0.00 H ATOM 763 HB VAL A 45 18.428 18.702 70.732 1.00 0.00 H ATOM 764 HG11 VAL A 45 18.067 20.354 72.520 1.00 0.00 H ATOM 765 HG12 VAL A 45 16.343 20.454 72.086 1.00 0.00 H ATOM 766 HG13 VAL A 45 17.010 18.937 72.738 1.00 0.00 H ATOM 767 HG21 VAL A 45 15.496 19.179 70.079 1.00 0.00 H ATOM 768 HG22 VAL A 45 16.638 18.204 69.121 1.00 0.00 H ATOM 769 HG23 VAL A 45 16.182 17.684 70.762 1.00 0.00 H ATOM 770 H VAL A 45 15.784 21.018 69.285 1.00 0.00 H ATOM 771 N THR A 46 18.021 20.689 67.381 1.00 29.54 N ATOM 772 CA THR A 46 18.536 20.287 66.076 1.00 28.86 C ATOM 773 C THR A 46 18.582 21.470 65.123 1.00 29.05 C ATOM 774 O THR A 46 18.103 22.561 65.443 1.00 28.35 O ATOM 775 CB THR A 46 17.645 19.214 65.420 1.00 28.74 C ATOM 776 OG1 THR A 46 16.321 19.737 65.256 1.00 27.91 O ATOM 777 CG2 THR A 46 17.602 17.946 66.266 1.00 28.58 C ATOM 778 HA THR A 46 19.536 19.890 66.252 1.00 0.00 H ATOM 779 HB THR A 46 18.065 18.956 64.448 1.00 0.00 H ATOM 780 HG1 THR A 46 15.952 19.980 66.142 1.00 0.00 H ATOM 781 HG23 THR A 46 18.613 17.556 66.385 1.00 0.00 H ATOM 782 HG21 THR A 46 17.183 18.178 67.245 1.00 0.00 H ATOM 783 HG22 THR A 46 16.980 17.201 65.770 1.00 0.00 H ATOM 784 H THR A 46 17.322 21.457 67.445 1.00 0.00 H ATOM 785 N PRO A 47 19.183 21.272 63.939 1.00 29.40 N ATOM 786 CA PRO A 47 19.260 22.357 62.958 1.00 29.49 C ATOM 787 C PRO A 47 17.968 22.444 62.137 1.00 29.40 C ATOM 788 O PRO A 47 17.893 23.179 61.157 1.00 29.84 O ATOM 789 CB PRO A 47 20.476 21.970 62.113 1.00 29.18 C ATOM 790 CG PRO A 47 20.424 20.481 62.126 1.00 29.12 C ATOM 791 CD PRO A 47 20.096 20.171 63.573 1.00 29.31 C ATOM 792 HA PRO A 47 19.367 23.348 63.400 1.00 0.00 H ATOM 793 HD3 PRO A 47 19.603 19.203 63.667 1.00 0.00 H ATOM 794 HD2 PRO A 47 20.994 20.182 64.191 1.00 0.00 H ATOM 795 HG3 PRO A 47 21.384 20.051 61.840 1.00 0.00 H ATOM 796 HG2 PRO A 47 19.647 20.109 61.458 1.00 0.00 H ATOM 797 HB2 PRO A 47 20.389 22.358 61.098 1.00 0.00 H ATOM 798 HB3 PRO A 47 21.399 22.335 62.562 1.00 0.00 H ATOM 799 N LEU A 48 16.949 21.696 62.553 1.00 29.49 N ATOM 800 CA LEU A 48 15.663 21.688 61.860 1.00 29.31 C ATOM 801 C LEU A 48 14.778 22.883 62.214 1.00 29.66 C ATOM 802 O LEU A 48 14.731 23.338 63.360 1.00 30.07 O ATOM 803 CB LEU A 48 14.902 20.394 62.157 1.00 28.63 C ATOM 804 CG LEU A 48 15.582 19.079 61.761 1.00 29.20 C ATOM 805 CD1 LEU A 48 14.655 17.909 62.083 1.00 28.93 C ATOM 806 CD2 LEU A 48 15.929 19.087 60.285 1.00 28.69 C ATOM 807 HA LEU A 48 15.894 21.757 60.797 1.00 0.00 H ATOM 808 HB2 LEU A 48 14.719 20.359 63.231 1.00 0.00 H ATOM 809 HB3 LEU A 48 13.950 20.444 61.629 1.00 0.00 H ATOM 810 HG LEU A 48 16.506 18.970 62.328 1.00 0.00 H ATOM 811 HD21 LEU A 48 15.017 19.206 59.699 1.00 0.00 H ATOM 812 HD22 LEU A 48 16.607 19.915 60.077 1.00 0.00 H ATOM 813 HD23 LEU A 48 16.411 18.146 60.021 1.00 0.00 H ATOM 814 HD11 LEU A 48 14.441 17.900 63.152 1.00 0.00 H ATOM 815 HD12 LEU A 48 13.725 18.020 61.526 1.00 0.00 H ATOM 816 HD13 LEU A 48 15.140 16.975 61.801 1.00 0.00 H ATOM 817 H LEU A 48 17.072 21.100 63.396 1.00 0.00 H ATOM 818 N LYS A 49 14.073 23.382 61.208 1.00 29.51 N ATOM 819 CA LYS A 49 13.182 24.518 61.369 1.00 29.38 C ATOM 820 C LYS A 49 11.845 24.139 60.761 1.00 28.71 C ATOM 821 O LYS A 49 11.765 23.738 59.606 1.00 28.97 O ATOM 822 CB LYS A 49 13.776 25.743 60.674 1.00 30.23 C ATOM 823 CG LYS A 49 15.077 26.223 61.323 1.00 31.67 C ATOM 824 CD LYS A 49 15.682 27.412 60.589 1.00 32.87 C ATOM 825 CE LYS A 49 16.583 28.241 61.504 1.00 33.41 C ATOM 826 NZ LYS A 49 17.721 27.469 62.071 1.00 33.45 N ATOM 827 HA LYS A 49 13.051 24.769 62.422 1.00 0.00 H ATOM 828 HB2 LYS A 49 13.979 25.489 59.634 1.00 0.00 H ATOM 829 HB3 LYS A 49 13.048 26.553 60.713 1.00 0.00 H ATOM 830 HG2 LYS A 49 14.869 26.514 62.353 1.00 0.00 H ATOM 831 HG3 LYS A 49 15.796 25.404 61.317 1.00 0.00 H ATOM 832 HD2 LYS A 49 16.272 27.046 59.749 1.00 0.00 H ATOM 833 HD3 LYS A 49 14.877 28.045 60.217 1.00 0.00 H ATOM 834 HE2 LYS A 49 15.981 28.624 62.328 1.00 0.00 H ATOM 835 HE3 LYS A 49 16.984 29.076 60.930 1.00 0.00 H ATOM 836 HZ1 LYS A 49 17.354 26.673 62.631 1.00 0.00 H ATOM 837 HZ2 LYS A 49 18.312 27.105 61.296 1.00 0.00 H ATOM 838 HZ3 LYS A 49 18.290 28.090 62.681 1.00 0.00 H ATOM 839 H LYS A 49 14.161 22.944 60.269 1.00 0.00 H ATOM 840 N PHE A 50 10.793 24.253 61.550 1.00 28.36 N ATOM 841 CA PHE A 50 9.469 23.881 61.084 1.00 28.15 C ATOM 842 C PHE A 50 8.598 25.100 60.872 1.00 27.87 C ATOM 843 O PHE A 50 8.515 25.975 61.729 1.00 28.42 O ATOM 844 CB PHE A 50 8.822 22.935 62.095 1.00 28.17 C ATOM 845 CG PHE A 50 9.634 21.700 62.368 1.00 27.70 C ATOM 846 CD1 PHE A 50 9.715 20.682 61.419 1.00 27.80 C ATOM 847 CD2 PHE A 50 10.324 21.556 63.569 1.00 26.93 C ATOM 848 CE1 PHE A 50 10.471 19.530 61.662 1.00 27.40 C ATOM 849 CE2 PHE A 50 11.082 20.414 63.822 1.00 27.54 C ATOM 850 CZ PHE A 50 11.155 19.396 62.864 1.00 27.31 C ATOM 851 HA PHE A 50 9.568 23.376 60.123 1.00 0.00 H ATOM 852 HB2 PHE A 50 8.686 23.473 63.033 1.00 0.00 H ATOM 853 HB3 PHE A 50 7.849 22.630 61.709 1.00 0.00 H ATOM 854 HD2 PHE A 50 10.271 22.345 64.319 1.00 0.00 H ATOM 855 HE2 PHE A 50 11.618 20.314 64.766 1.00 0.00 H ATOM 856 HZ PHE A 50 11.746 18.502 63.060 1.00 0.00 H ATOM 857 HE1 PHE A 50 10.523 18.741 60.912 1.00 0.00 H ATOM 858 HD1 PHE A 50 9.182 20.785 60.474 1.00 0.00 H ATOM 859 H PHE A 50 10.914 24.614 62.518 1.00 0.00 H ATOM 860 N SER A 51 7.936 25.139 59.725 1.00 27.68 N ATOM 861 CA SER A 51 7.078 26.259 59.375 1.00 27.20 C ATOM 862 C SER A 51 5.675 25.818 58.971 1.00 26.53 C ATOM 863 O SER A 51 5.506 24.984 58.087 1.00 26.08 O ATOM 864 CB SER A 51 7.729 27.044 58.236 1.00 27.79 C ATOM 865 OG SER A 51 6.874 28.065 57.767 1.00 30.01 O ATOM 866 HA SER A 51 6.967 26.887 60.259 1.00 0.00 H ATOM 867 HB2 SER A 51 7.952 26.362 57.416 1.00 0.00 H ATOM 868 HB3 SER A 51 8.655 27.492 58.596 1.00 0.00 H ATOM 869 HG SER A 51 7.320 28.556 57.032 1.00 0.00 H ATOM 870 H SER A 51 8.033 24.347 59.057 1.00 0.00 H ATOM 871 N LYS A 52 4.672 26.388 59.626 1.00 26.11 N ATOM 872 CA LYS A 52 3.281 26.067 59.340 1.00 26.49 C ATOM 873 C LYS A 52 2.781 26.773 58.079 1.00 27.03 C ATOM 874 O LYS A 52 3.058 27.950 57.864 1.00 27.30 O ATOM 875 CB LYS A 52 2.408 26.466 60.534 1.00 25.88 C ATOM 876 CG LYS A 52 0.911 26.285 60.334 1.00 25.84 C ATOM 877 CD LYS A 52 0.162 26.527 61.648 1.00 26.74 C ATOM 878 CE LYS A 52 -1.348 26.306 61.523 1.00 26.68 C ATOM 879 NZ LYS A 52 -2.033 27.325 60.667 1.00 27.07 N ATOM 880 HA LYS A 52 3.214 24.993 59.168 1.00 0.00 H ATOM 881 HB2 LYS A 52 2.709 25.861 61.389 1.00 0.00 H ATOM 882 HB3 LYS A 52 2.594 27.518 60.751 1.00 0.00 H ATOM 883 HG2 LYS A 52 0.560 26.995 59.585 1.00 0.00 H ATOM 884 HG3 LYS A 52 0.715 25.269 59.990 1.00 0.00 H ATOM 885 HD2 LYS A 52 0.552 25.844 62.402 1.00 0.00 H ATOM 886 HD3 LYS A 52 0.338 27.555 61.965 1.00 0.00 H ATOM 887 HE2 LYS A 52 -1.786 26.343 62.521 1.00 0.00 H ATOM 888 HE3 LYS A 52 -1.518 25.321 61.089 1.00 0.00 H ATOM 889 HZ1 LYS A 52 -1.889 28.271 61.074 1.00 0.00 H ATOM 890 HZ2 LYS A 52 -1.633 27.295 59.707 1.00 0.00 H ATOM 891 HZ3 LYS A 52 -3.051 27.114 60.627 1.00 0.00 H ATOM 892 H LYS A 52 4.886 27.086 60.367 1.00 0.00 H ATOM 893 N ILE A 53 2.061 26.045 57.235 1.00 27.46 N ATOM 894 CA ILE A 53 1.503 26.623 56.021 1.00 28.13 C ATOM 895 C ILE A 53 0.025 26.241 55.982 1.00 29.23 C ATOM 896 O ILE A 53 -0.376 25.218 56.543 1.00 28.91 O ATOM 897 CB ILE A 53 2.227 26.115 54.741 1.00 27.70 C ATOM 898 CG1 ILE A 53 1.934 24.635 54.503 1.00 28.16 C ATOM 899 CG2 ILE A 53 3.722 26.317 54.878 1.00 26.70 C ATOM 900 CD1 ILE A 53 2.552 24.099 53.231 1.00 27.86 C ATOM 901 HA ILE A 53 1.635 27.705 56.037 1.00 0.00 H ATOM 902 HB ILE A 53 1.857 26.687 53.890 1.00 0.00 H ATOM 903 HG12 ILE A 53 2.326 24.065 55.345 1.00 0.00 H ATOM 904 HG13 ILE A 53 0.854 24.501 54.446 1.00 0.00 H ATOM 905 HD11 ILE A 53 2.161 24.653 52.377 1.00 0.00 H ATOM 906 HD12 ILE A 53 3.635 24.216 53.277 1.00 0.00 H ATOM 907 HD13 ILE A 53 2.304 23.043 53.125 1.00 0.00 H ATOM 908 HG21 ILE A 53 3.933 27.378 55.014 1.00 0.00 H ATOM 909 HG22 ILE A 53 4.085 25.760 55.742 1.00 0.00 H ATOM 910 HG23 ILE A 53 4.220 25.958 53.977 1.00 0.00 H ATOM 911 H ILE A 53 1.892 25.041 57.445 1.00 0.00 H ATOM 912 N ASN A 54 -0.786 27.063 55.328 1.00 30.34 N ATOM 913 CA ASN A 54 -2.220 26.810 55.267 1.00 31.59 C ATOM 914 C ASN A 54 -2.695 26.341 53.904 1.00 32.27 C ATOM 915 O ASN A 54 -3.807 25.827 53.776 1.00 32.76 O ATOM 916 CB ASN A 54 -2.972 28.073 55.674 1.00 32.48 C ATOM 917 CG ASN A 54 -2.557 28.576 57.040 1.00 33.15 C ATOM 918 OD1 ASN A 54 -2.826 29.720 57.401 1.00 34.40 O ATOM 919 ND2 ASN A 54 -1.901 27.718 57.811 1.00 33.25 N ATOM 920 HA ASN A 54 -2.429 25.995 55.960 1.00 0.00 H ATOM 921 HB2 ASN A 54 -2.773 28.852 54.938 1.00 0.00 H ATOM 922 HB3 ASN A 54 -4.040 27.855 55.690 1.00 0.00 H ATOM 923 HD22 ASN A 54 -1.695 26.759 57.464 1.00 0.00 H ATOM 924 HD21 ASN A 54 -1.593 28.004 58.762 1.00 0.00 H ATOM 925 H ASN A 54 -0.393 27.900 54.852 1.00 0.00 H ATOM 926 N THR A 55 -1.856 26.529 52.889 1.00 32.73 N ATOM 927 CA THR A 55 -2.181 26.107 51.527 1.00 33.43 C ATOM 928 C THR A 55 -0.936 25.514 50.897 1.00 33.60 C ATOM 929 O THR A 55 0.186 25.871 51.259 1.00 33.99 O ATOM 930 CB THR A 55 -2.661 27.285 50.631 1.00 33.43 C ATOM 931 OG1 THR A 55 -1.634 28.279 50.552 1.00 33.83 O ATOM 932 CG2 THR A 55 -3.926 27.917 51.196 1.00 33.97 C ATOM 933 HA THR A 55 -2.993 25.383 51.593 1.00 0.00 H ATOM 934 HB THR A 55 -2.879 26.893 49.638 1.00 0.00 H ATOM 935 HG1 THR A 55 -0.818 27.878 50.160 1.00 0.00 H ATOM 936 HG23 THR A 55 -4.711 27.163 51.258 1.00 0.00 H ATOM 937 HG21 THR A 55 -3.720 28.312 52.191 1.00 0.00 H ATOM 938 HG22 THR A 55 -4.249 28.727 50.542 1.00 0.00 H ATOM 939 H THR A 55 -0.941 26.990 53.069 1.00 0.00 H ATOM 940 N GLY A 56 -1.135 24.610 49.948 1.00 33.91 N ATOM 941 CA GLY A 56 -0.004 23.981 49.294 1.00 33.61 C ATOM 942 C GLY A 56 0.302 22.646 49.930 1.00 33.19 C ATOM 943 O GLY A 56 -0.383 22.227 50.864 1.00 33.18 O ATOM 944 HA3 GLY A 56 0.868 24.629 49.383 1.00 0.00 H ATOM 945 HA2 GLY A 56 -0.237 23.831 48.240 1.00 0.00 H ATOM 946 H GLY A 56 -2.104 24.352 49.672 1.00 0.00 H ATOM 947 N MET A 57 1.332 21.975 49.429 1.00 33.04 N ATOM 948 CA MET A 57 1.713 20.675 49.958 1.00 32.42 C ATOM 949 C MET A 57 2.810 20.829 51.005 1.00 31.10 C ATOM 950 O MET A 57 3.904 21.317 50.711 1.00 31.02 O ATOM 951 CB MET A 57 2.202 19.770 48.824 1.00 34.92 C ATOM 952 CG MET A 57 1.231 19.642 47.648 1.00 37.96 C ATOM 953 SD MET A 57 -0.275 18.679 48.000 1.00 42.53 S ATOM 954 CE MET A 57 -1.425 20.003 48.568 1.00 41.13 C ATOM 955 HA MET A 57 0.840 20.221 50.427 1.00 0.00 H ATOM 956 HB2 MET A 57 3.142 20.174 48.447 1.00 0.00 H ATOM 957 HB3 MET A 57 2.374 18.774 49.233 1.00 0.00 H ATOM 958 HG2 MET A 57 1.757 19.159 46.825 1.00 0.00 H ATOM 959 HG3 MET A 57 0.929 20.645 47.347 1.00 0.00 H ATOM 960 HE1 MET A 57 -1.008 20.492 49.448 1.00 0.00 H ATOM 961 HE2 MET A 57 -1.555 20.736 47.771 1.00 0.00 H ATOM 962 HE3 MET A 57 -2.390 19.562 48.819 1.00 0.00 H ATOM 963 H MET A 57 1.876 22.386 48.644 1.00 0.00 H ATOM 964 N ALA A 58 2.507 20.416 52.231 1.00 29.06 N ATOM 965 CA ALA A 58 3.470 20.490 53.319 1.00 27.16 C ATOM 966 C ALA A 58 4.239 19.174 53.406 1.00 26.19 C ATOM 967 O ALA A 58 3.782 18.143 52.904 1.00 25.84 O ATOM 968 CB ALA A 58 2.750 20.759 54.621 1.00 27.32 C ATOM 969 HA ALA A 58 4.172 21.303 53.131 1.00 0.00 H ATOM 970 HB1 ALA A 58 2.213 21.705 54.549 1.00 0.00 H ATOM 971 HB2 ALA A 58 2.044 19.952 54.818 1.00 0.00 H ATOM 972 HB3 ALA A 58 3.476 20.813 55.432 1.00 0.00 H ATOM 973 H ALA A 58 1.559 20.031 52.417 1.00 0.00 H ATOM 974 N ASP A 59 5.409 19.208 54.036 1.00 24.86 N ATOM 975 CA ASP A 59 6.218 18.002 54.183 1.00 23.86 C ATOM 976 C ASP A 59 5.533 17.064 55.165 1.00 22.76 C ATOM 977 O ASP A 59 5.519 15.847 54.988 1.00 22.87 O ATOM 978 CB ASP A 59 7.607 18.352 54.717 1.00 24.40 C ATOM 979 CG ASP A 59 8.383 19.226 53.772 1.00 24.89 C ATOM 980 OD1 ASP A 59 8.546 18.803 52.609 1.00 26.78 O ATOM 981 OD2 ASP A 59 8.825 20.322 54.182 1.00 23.67 O ATOM 982 HA ASP A 59 6.323 17.524 53.209 1.00 0.00 H ATOM 983 HB2 ASP A 59 7.495 18.876 55.666 1.00 0.00 H ATOM 984 HB3 ASP A 59 8.164 17.428 54.876 1.00 0.00 H ATOM 985 H ASP A 59 5.753 20.107 54.430 1.00 0.00 H ATOM 986 N ILE A 60 4.962 17.660 56.204 1.00 21.31 N ATOM 987 CA ILE A 60 4.282 16.930 57.258 1.00 19.41 C ATOM 988 C ILE A 60 2.825 17.350 57.358 1.00 19.42 C ATOM 989 O ILE A 60 2.519 18.519 57.608 1.00 19.65 O ATOM 990 CB ILE A 60 4.971 17.202 58.612 1.00 18.91 C ATOM 991 CG1 ILE A 60 6.394 16.628 58.579 1.00 18.93 C ATOM 992 CG2 ILE A 60 4.136 16.645 59.755 1.00 17.47 C ATOM 993 CD1 ILE A 60 7.246 16.966 59.780 1.00 17.54 C ATOM 994 HA ILE A 60 4.331 15.868 57.017 1.00 0.00 H ATOM 995 HB ILE A 60 5.051 18.275 58.785 1.00 0.00 H ATOM 996 HG12 ILE A 60 6.320 15.543 58.511 1.00 0.00 H ATOM 997 HG13 ILE A 60 6.894 17.013 57.690 1.00 0.00 H ATOM 998 HD11 ILE A 60 7.347 18.048 59.859 1.00 0.00 H ATOM 999 HD12 ILE A 60 6.772 16.577 60.681 1.00 0.00 H ATOM 1000 HD13 ILE A 60 8.232 16.516 59.663 1.00 0.00 H ATOM 1001 HG21 ILE A 60 3.156 17.122 59.753 1.00 0.00 H ATOM 1002 HG22 ILE A 60 4.018 15.569 59.626 1.00 0.00 H ATOM 1003 HG23 ILE A 60 4.638 16.846 60.701 1.00 0.00 H ATOM 1004 H ILE A 60 5.004 18.697 56.266 1.00 0.00 H ATOM 1005 N LEU A 61 1.922 16.402 57.157 1.00 18.98 N ATOM 1006 CA LEU A 61 0.508 16.711 57.265 1.00 18.89 C ATOM 1007 C LEU A 61 -0.013 16.171 58.593 1.00 18.96 C ATOM 1008 O LEU A 61 0.250 15.022 58.955 1.00 19.25 O ATOM 1009 CB LEU A 61 -0.278 16.093 56.111 1.00 18.53 C ATOM 1010 CG LEU A 61 -1.726 16.584 55.977 1.00 19.00 C ATOM 1011 CD1 LEU A 61 -1.758 18.069 55.646 1.00 17.14 C ATOM 1012 CD2 LEU A 61 -2.426 15.801 54.892 1.00 19.45 C ATOM 1013 HA LEU A 61 0.377 17.792 57.220 1.00 0.00 H ATOM 1014 HB2 LEU A 61 0.245 16.324 55.183 1.00 0.00 H ATOM 1015 HB3 LEU A 61 -0.299 15.013 56.256 1.00 0.00 H ATOM 1016 HG LEU A 61 -2.239 16.430 56.926 1.00 0.00 H ATOM 1017 HD21 LEU A 61 -1.904 15.946 53.946 1.00 0.00 H ATOM 1018 HD22 LEU A 61 -2.424 14.742 55.151 1.00 0.00 H ATOM 1019 HD23 LEU A 61 -3.454 16.151 54.799 1.00 0.00 H ATOM 1020 HD11 LEU A 61 -1.267 18.628 56.442 1.00 0.00 H ATOM 1021 HD12 LEU A 61 -1.237 18.241 54.704 1.00 0.00 H ATOM 1022 HD13 LEU A 61 -2.793 18.397 55.555 1.00 0.00 H ATOM 1023 H LEU A 61 2.226 15.436 56.922 1.00 0.00 H ATOM 1024 N VAL A 62 -0.725 17.023 59.324 1.00 18.95 N ATOM 1025 CA VAL A 62 -1.308 16.661 60.610 1.00 18.79 C ATOM 1026 C VAL A 62 -2.801 16.441 60.393 1.00 19.22 C ATOM 1027 O VAL A 62 -3.504 17.321 59.889 1.00 19.03 O ATOM 1028 CB VAL A 62 -1.111 17.788 61.647 1.00 19.16 C ATOM 1029 CG1 VAL A 62 -2.059 17.589 62.823 1.00 19.08 C ATOM 1030 CG2 VAL A 62 0.338 17.802 62.127 1.00 18.51 C ATOM 1031 HA VAL A 62 -0.821 15.763 60.990 1.00 0.00 H ATOM 1032 HB VAL A 62 -1.336 18.747 61.180 1.00 0.00 H ATOM 1033 HG11 VAL A 62 -3.088 17.607 62.465 1.00 0.00 H ATOM 1034 HG12 VAL A 62 -1.854 16.628 63.295 1.00 0.00 H ATOM 1035 HG13 VAL A 62 -1.911 18.390 63.547 1.00 0.00 H ATOM 1036 HG21 VAL A 62 0.576 16.843 62.587 1.00 0.00 H ATOM 1037 HG22 VAL A 62 0.999 17.974 61.278 1.00 0.00 H ATOM 1038 HG23 VAL A 62 0.469 18.600 62.858 1.00 0.00 H ATOM 1039 H VAL A 62 -0.872 17.987 58.964 1.00 0.00 H ATOM 1040 N VAL A 63 -3.291 15.265 60.764 1.00 19.56 N ATOM 1041 CA VAL A 63 -4.703 14.972 60.568 1.00 19.66 C ATOM 1042 C VAL A 63 -5.342 14.172 61.695 1.00 20.02 C ATOM 1043 O VAL A 63 -4.695 13.337 62.340 1.00 20.20 O ATOM 1044 CB VAL A 63 -4.935 14.226 59.213 1.00 19.33 C ATOM 1045 CG1 VAL A 63 -3.600 13.960 58.522 1.00 18.41 C ATOM 1046 CG2 VAL A 63 -5.688 12.924 59.443 1.00 17.62 C ATOM 1047 HA VAL A 63 -5.192 15.946 60.558 1.00 0.00 H ATOM 1048 HB VAL A 63 -5.540 14.860 58.565 1.00 0.00 H ATOM 1049 HG11 VAL A 63 -3.098 14.908 58.327 1.00 0.00 H ATOM 1050 HG12 VAL A 63 -2.975 13.343 59.167 1.00 0.00 H ATOM 1051 HG13 VAL A 63 -3.777 13.440 57.580 1.00 0.00 H ATOM 1052 HG21 VAL A 63 -5.108 12.282 60.106 1.00 0.00 H ATOM 1053 HG22 VAL A 63 -6.654 13.140 59.899 1.00 0.00 H ATOM 1054 HG23 VAL A 63 -5.840 12.420 58.489 1.00 0.00 H ATOM 1055 H VAL A 63 -2.667 14.553 61.194 1.00 0.00 H ATOM 1056 N PHE A 64 -6.622 14.452 61.918 1.00 20.18 N ATOM 1057 CA PHE A 64 -7.418 13.774 62.931 1.00 20.95 C ATOM 1058 C PHE A 64 -8.383 12.869 62.183 1.00 21.24 C ATOM 1059 O PHE A 64 -9.233 13.350 61.433 1.00 21.71 O ATOM 1060 CB PHE A 64 -8.206 14.786 63.773 1.00 21.23 C ATOM 1061 CG PHE A 64 -7.340 15.661 64.633 1.00 21.19 C ATOM 1062 CD1 PHE A 64 -6.842 16.864 64.148 1.00 20.89 C ATOM 1063 CD2 PHE A 64 -6.998 15.262 65.924 1.00 20.85 C ATOM 1064 CE1 PHE A 64 -6.014 17.660 64.938 1.00 21.13 C ATOM 1065 CE2 PHE A 64 -6.174 16.046 66.721 1.00 20.61 C ATOM 1066 CZ PHE A 64 -5.678 17.248 66.230 1.00 21.02 C ATOM 1067 HA PHE A 64 -6.778 13.211 63.610 1.00 0.00 H ATOM 1068 HB2 PHE A 64 -8.778 15.424 63.099 1.00 0.00 H ATOM 1069 HB3 PHE A 64 -8.890 14.237 64.420 1.00 0.00 H ATOM 1070 HD2 PHE A 64 -7.383 14.320 66.314 1.00 0.00 H ATOM 1071 HE2 PHE A 64 -5.917 15.720 67.729 1.00 0.00 H ATOM 1072 HZ PHE A 64 -5.030 17.867 66.850 1.00 0.00 H ATOM 1073 HE1 PHE A 64 -5.629 18.602 64.548 1.00 0.00 H ATOM 1074 HD1 PHE A 64 -7.101 17.188 63.140 1.00 0.00 H ATOM 1075 H PHE A 64 -7.076 15.190 61.342 1.00 0.00 H ATOM 1076 N ALA A 65 -8.247 11.560 62.383 1.00 21.65 N ATOM 1077 CA ALA A 65 -9.099 10.597 61.696 1.00 21.39 C ATOM 1078 C ALA A 65 -9.659 9.490 62.595 1.00 21.08 C ATOM 1079 O ALA A 65 -9.112 9.169 63.651 1.00 20.33 O ATOM 1080 CB ALA A 65 -8.343 9.991 60.514 1.00 20.83 C ATOM 1081 HA ALA A 65 -9.968 11.156 61.349 1.00 0.00 H ATOM 1082 HB1 ALA A 65 -8.060 10.783 59.821 1.00 0.00 H ATOM 1083 HB2 ALA A 65 -7.447 9.487 60.877 1.00 0.00 H ATOM 1084 HB3 ALA A 65 -8.984 9.272 60.004 1.00 0.00 H ATOM 1085 H ALA A 65 -7.519 11.218 63.042 1.00 0.00 H ATOM 1086 N ARG A 66 -10.758 8.908 62.127 1.00 21.32 N ATOM 1087 CA ARG A 66 -11.487 7.860 62.826 1.00 21.03 C ATOM 1088 C ARG A 66 -11.442 6.566 62.003 1.00 20.35 C ATOM 1089 O ARG A 66 -11.554 6.597 60.778 1.00 20.26 O ATOM 1090 CB ARG A 66 -12.937 8.321 62.988 1.00 21.36 C ATOM 1091 CG ARG A 66 -13.636 7.840 64.236 1.00 23.95 C ATOM 1092 CD ARG A 66 -15.097 8.292 64.235 1.00 23.91 C ATOM 1093 NE ARG A 66 -15.229 9.732 64.013 1.00 25.00 N ATOM 1094 CZ ARG A 66 -15.122 10.658 64.962 1.00 24.82 C ATOM 1095 NH1 ARG A 66 -14.884 10.314 66.219 1.00 25.36 N ATOM 1096 NH2 ARG A 66 -15.246 11.936 64.649 1.00 25.12 N ATOM 1097 HA ARG A 66 -11.040 7.669 63.802 1.00 0.00 H ATOM 1098 HB2 ARG A 66 -12.944 9.411 62.998 1.00 0.00 H ATOM 1099 HB3 ARG A 66 -13.502 7.963 62.127 1.00 0.00 H ATOM 1100 HG2 ARG A 66 -13.596 6.751 64.274 1.00 0.00 H ATOM 1101 HG3 ARG A 66 -13.133 8.251 65.111 1.00 0.00 H ATOM 1102 HD2 ARG A 66 -15.543 8.042 65.198 1.00 0.00 H ATOM 1103 HD3 ARG A 66 -15.628 7.764 63.443 1.00 0.00 H ATOM 1104 HE ARG A 66 -15.420 10.055 63.043 1.00 0.00 H ATOM 1105 HH12 ARG A 66 -14.802 11.047 66.952 1.00 0.00 H ATOM 1106 HH11 ARG A 66 -14.779 9.311 66.473 1.00 0.00 H ATOM 1107 HH22 ARG A 66 -15.163 12.663 65.388 1.00 0.00 H ATOM 1108 HH21 ARG A 66 -15.427 12.215 63.663 1.00 0.00 H ATOM 1109 H ARG A 66 -11.120 9.221 61.204 1.00 0.00 H ATOM 1110 N GLY A 67 -11.276 5.434 62.680 1.00 19.80 N ATOM 1111 CA GLY A 67 -11.235 4.148 61.999 1.00 19.09 C ATOM 1112 C GLY A 67 -10.391 4.113 60.739 1.00 18.69 C ATOM 1113 O GLY A 67 -9.275 4.630 60.720 1.00 17.94 O ATOM 1114 HA3 GLY A 67 -12.255 3.876 61.730 1.00 0.00 H ATOM 1115 HA2 GLY A 67 -10.835 3.410 62.694 1.00 0.00 H ATOM 1116 H GLY A 67 -11.174 5.468 63.714 1.00 0.00 H ATOM 1117 N ALA A 68 -10.923 3.491 59.689 1.00 18.72 N ATOM 1118 CA ALA A 68 -10.224 3.394 58.403 1.00 19.07 C ATOM 1119 C ALA A 68 -10.210 4.771 57.753 1.00 19.32 C ATOM 1120 O ALA A 68 -11.265 5.339 57.479 1.00 19.55 O ATOM 1121 CB ALA A 68 -10.931 2.397 57.491 1.00 17.86 C ATOM 1122 HA ALA A 68 -9.204 3.047 58.565 1.00 0.00 H ATOM 1123 HB1 ALA A 68 -10.942 1.416 57.966 1.00 0.00 H ATOM 1124 HB2 ALA A 68 -11.955 2.729 57.317 1.00 0.00 H ATOM 1125 HB3 ALA A 68 -10.400 2.336 56.541 1.00 0.00 H ATOM 1126 H ALA A 68 -11.865 3.060 59.784 1.00 0.00 H ATOM 1127 N HIS A 69 -9.020 5.304 57.498 1.00 19.26 N ATOM 1128 CA HIS A 69 -8.912 6.630 56.914 1.00 19.04 C ATOM 1129 C HIS A 69 -7.964 6.761 55.723 1.00 19.57 C ATOM 1130 O HIS A 69 -7.288 7.775 55.570 1.00 19.69 O ATOM 1131 CB HIS A 69 -8.532 7.648 57.999 1.00 18.76 C ATOM 1132 CG HIS A 69 -7.310 7.274 58.785 1.00 17.84 C ATOM 1133 ND1 HIS A 69 -7.343 6.377 59.830 1.00 16.85 N ATOM 1134 CD2 HIS A 69 -6.016 7.651 58.654 1.00 17.30 C ATOM 1135 CE1 HIS A 69 -6.122 6.216 60.308 1.00 16.79 C ATOM 1136 NE2 HIS A 69 -5.298 6.978 59.613 1.00 17.26 N ATOM 1137 HA HIS A 69 -9.901 6.834 56.504 1.00 0.00 H ATOM 1138 HB2 HIS A 69 -8.350 8.609 57.519 1.00 0.00 H ATOM 1139 HB3 HIS A 69 -9.369 7.741 58.690 1.00 0.00 H ATOM 1140 HD2 HIS A 69 -5.618 8.356 57.924 1.00 0.00 H ATOM 1141 HE1 HIS A 69 -5.842 5.564 61.136 1.00 0.00 H ATOM 1142 H HIS A 69 -8.157 4.767 57.719 1.00 0.00 H ATOM 1143 N GLY A 70 -7.897 5.725 54.896 1.00 20.06 N ATOM 1144 CA GLY A 70 -7.088 5.797 53.691 1.00 19.70 C ATOM 1145 C GLY A 70 -5.594 5.568 53.676 1.00 19.54 C ATOM 1146 O GLY A 70 -4.926 6.043 52.758 1.00 19.90 O ATOM 1147 HA3 GLY A 70 -7.240 6.798 53.289 1.00 0.00 H ATOM 1148 HA2 GLY A 70 -7.509 5.063 53.004 1.00 0.00 H ATOM 1149 H GLY A 70 -8.427 4.856 55.112 1.00 0.00 H ATOM 1150 N ASP A 71 -5.058 4.841 54.650 1.00 19.89 N ATOM 1151 CA ASP A 71 -3.621 4.572 54.672 1.00 19.46 C ATOM 1152 C ASP A 71 -3.292 3.132 55.087 1.00 18.86 C ATOM 1153 O ASP A 71 -2.134 2.811 55.349 1.00 18.77 O ATOM 1154 CB ASP A 71 -2.910 5.564 55.608 1.00 20.29 C ATOM 1155 CG ASP A 71 -3.373 5.448 57.058 1.00 21.10 C ATOM 1156 OD1 ASP A 71 -2.796 6.140 57.924 1.00 20.68 O ATOM 1157 OD2 ASP A 71 -4.314 4.667 57.334 1.00 21.65 O ATOM 1158 HA ASP A 71 -3.260 4.701 53.652 1.00 0.00 H ATOM 1159 HB2 ASP A 71 -1.838 5.373 55.569 1.00 0.00 H ATOM 1160 HB3 ASP A 71 -3.110 6.577 55.259 1.00 0.00 H ATOM 1161 H ASP A 71 -5.666 4.460 55.403 1.00 0.00 H ATOM 1162 N PHE A 72 -4.313 2.277 55.140 1.00 18.15 N ATOM 1163 CA PHE A 72 -4.162 0.869 55.523 1.00 17.42 C ATOM 1164 C PHE A 72 -3.726 0.681 56.974 1.00 17.43 C ATOM 1165 O PHE A 72 -3.270 -0.397 57.367 1.00 17.71 O ATOM 1166 CB PHE A 72 -3.183 0.147 54.584 1.00 16.95 C ATOM 1167 CG PHE A 72 -3.553 0.256 53.134 1.00 16.53 C ATOM 1168 CD1 PHE A 72 -2.833 1.084 52.277 1.00 16.28 C ATOM 1169 CD2 PHE A 72 -4.656 -0.427 52.631 1.00 16.14 C ATOM 1170 CE1 PHE A 72 -3.209 1.231 50.945 1.00 15.91 C ATOM 1171 CE2 PHE A 72 -5.045 -0.287 51.295 1.00 15.26 C ATOM 1172 CZ PHE A 72 -4.321 0.543 50.454 1.00 16.00 C ATOM 1173 HA PHE A 72 -5.153 0.425 55.428 1.00 0.00 H ATOM 1174 HB2 PHE A 72 -2.192 0.579 54.721 1.00 0.00 H ATOM 1175 HB3 PHE A 72 -3.159 -0.908 54.856 1.00 0.00 H ATOM 1176 HD2 PHE A 72 -5.226 -1.082 53.289 1.00 0.00 H ATOM 1177 HE2 PHE A 72 -5.913 -0.828 50.917 1.00 0.00 H ATOM 1178 HZ PHE A 72 -4.619 0.659 49.412 1.00 0.00 H ATOM 1179 HE1 PHE A 72 -2.636 1.883 50.285 1.00 0.00 H ATOM 1180 HD1 PHE A 72 -1.964 1.624 52.654 1.00 0.00 H ATOM 1181 H PHE A 72 -5.263 2.625 54.898 1.00 0.00 H ATOM 1182 N HIS A 73 -3.853 1.744 57.759 1.00 17.81 N ATOM 1183 CA HIS A 73 -3.530 1.710 59.182 1.00 18.29 C ATOM 1184 C HIS A 73 -4.773 2.242 59.905 1.00 18.66 C ATOM 1185 O HIS A 73 -4.808 3.399 60.343 1.00 19.01 O ATOM 1186 CB HIS A 73 -2.329 2.606 59.491 1.00 18.16 C ATOM 1187 CG HIS A 73 -1.020 2.078 58.987 1.00 17.91 C ATOM 1188 ND1 HIS A 73 -0.745 1.913 57.646 1.00 17.44 N ATOM 1189 CD2 HIS A 73 0.115 1.745 59.646 1.00 17.71 C ATOM 1190 CE1 HIS A 73 0.505 1.509 57.501 1.00 17.26 C ATOM 1191 NE2 HIS A 73 1.050 1.400 58.699 1.00 17.50 N ATOM 1192 HA HIS A 73 -3.269 0.701 59.500 1.00 0.00 H ATOM 1193 HB2 HIS A 73 -2.503 3.580 59.034 1.00 0.00 H ATOM 1194 HB3 HIS A 73 -2.258 2.721 60.573 1.00 0.00 H ATOM 1195 HD2 HIS A 73 0.260 1.750 60.726 1.00 0.00 H ATOM 1196 HE1 HIS A 73 1.002 1.301 56.553 1.00 0.00 H ATOM 1197 H HIS A 73 -4.195 2.634 57.345 1.00 0.00 H ATOM 1198 N ALA A 74 -5.796 1.400 60.026 1.00 18.43 N ATOM 1199 CA ALA A 74 -7.038 1.826 60.665 1.00 18.44 C ATOM 1200 C ALA A 74 -6.964 2.036 62.181 1.00 18.62 C ATOM 1201 O ALA A 74 -6.290 1.295 62.901 1.00 18.73 O ATOM 1202 CB ALA A 74 -8.150 0.842 60.333 1.00 17.51 C ATOM 1203 HA ALA A 74 -7.245 2.814 60.254 1.00 0.00 H ATOM 1204 HB1 ALA A 74 -8.292 0.807 59.253 1.00 0.00 H ATOM 1205 HB2 ALA A 74 -7.877 -0.149 60.697 1.00 0.00 H ATOM 1206 HB3 ALA A 74 -9.074 1.165 60.812 1.00 0.00 H ATOM 1207 H ALA A 74 -5.710 0.430 59.662 1.00 0.00 H ATOM 1208 N PHE A 75 -7.658 3.066 62.657 1.00 18.52 N ATOM 1209 CA PHE A 75 -7.707 3.354 64.079 1.00 18.54 C ATOM 1210 C PHE A 75 -8.731 2.410 64.719 1.00 18.90 C ATOM 1211 O PHE A 75 -9.570 1.831 64.022 1.00 18.50 O ATOM 1212 CB PHE A 75 -8.051 4.824 64.300 1.00 18.06 C ATOM 1213 CG PHE A 75 -6.864 5.740 64.160 1.00 17.63 C ATOM 1214 CD1 PHE A 75 -6.982 6.979 63.527 1.00 17.72 C ATOM 1215 CD2 PHE A 75 -5.622 5.367 64.664 1.00 16.88 C ATOM 1216 CE1 PHE A 75 -5.870 7.833 63.397 1.00 16.96 C ATOM 1217 CE2 PHE A 75 -4.509 6.212 64.540 1.00 16.99 C ATOM 1218 CZ PHE A 75 -4.635 7.447 63.904 1.00 16.15 C ATOM 1219 HA PHE A 75 -6.738 3.186 64.549 1.00 0.00 H ATOM 1220 HB2 PHE A 75 -8.803 5.118 63.568 1.00 0.00 H ATOM 1221 HB3 PHE A 75 -8.459 4.937 65.304 1.00 0.00 H ATOM 1222 HD2 PHE A 75 -5.512 4.404 65.163 1.00 0.00 H ATOM 1223 HE2 PHE A 75 -3.544 5.903 64.941 1.00 0.00 H ATOM 1224 HZ PHE A 75 -3.771 8.104 63.805 1.00 0.00 H ATOM 1225 HE1 PHE A 75 -5.978 8.797 62.899 1.00 0.00 H ATOM 1226 HD1 PHE A 75 -7.948 7.289 63.128 1.00 0.00 H ATOM 1227 H PHE A 75 -8.177 3.679 61.996 1.00 0.00 H ATOM 1228 N ASP A 76 -8.663 2.262 66.038 1.00 18.92 N ATOM 1229 CA ASP A 76 -9.518 1.317 66.750 1.00 19.72 C ATOM 1230 C ASP A 76 -10.617 1.852 67.673 1.00 19.88 C ATOM 1231 O ASP A 76 -11.066 1.141 68.572 1.00 19.09 O ATOM 1232 CB ASP A 76 -8.608 0.389 67.557 1.00 20.44 C ATOM 1233 CG ASP A 76 -7.641 1.162 68.450 1.00 21.56 C ATOM 1234 OD1 ASP A 76 -6.885 0.524 69.210 1.00 22.17 O ATOM 1235 OD2 ASP A 76 -7.636 2.414 68.393 1.00 21.27 O ATOM 1236 HA ASP A 76 -10.090 0.835 65.957 1.00 0.00 H ATOM 1237 HB2 ASP A 76 -9.228 -0.253 68.183 1.00 0.00 H ATOM 1238 HB3 ASP A 76 -8.032 -0.226 66.866 1.00 0.00 H ATOM 1239 H ASP A 76 -7.983 2.835 66.577 1.00 0.00 H ATOM 1240 N GLY A 77 -11.068 3.079 67.456 1.00 20.47 N ATOM 1241 CA GLY A 77 -12.087 3.624 68.334 1.00 21.29 C ATOM 1242 C GLY A 77 -11.410 4.114 69.603 1.00 22.04 C ATOM 1243 O GLY A 77 -10.189 3.987 69.732 1.00 21.85 O ATOM 1244 HA3 GLY A 77 -12.815 2.851 68.579 1.00 0.00 H ATOM 1245 HA2 GLY A 77 -12.593 4.454 67.841 1.00 0.00 H ATOM 1246 H GLY A 77 -10.696 3.644 66.666 1.00 0.00 H ATOM 1247 N LYS A 78 -12.181 4.664 70.541 1.00 22.58 N ATOM 1248 CA LYS A 78 -11.607 5.178 71.779 1.00 22.63 C ATOM 1249 C LYS A 78 -10.799 4.114 72.517 1.00 22.36 C ATOM 1250 O LYS A 78 -11.249 2.982 72.700 1.00 22.02 O ATOM 1251 CB LYS A 78 -12.699 5.737 72.691 1.00 23.20 C ATOM 1252 CG LYS A 78 -12.127 6.546 73.837 1.00 25.60 C ATOM 1253 CD LYS A 78 -13.184 7.326 74.605 1.00 27.79 C ATOM 1254 CE LYS A 78 -12.525 8.175 75.691 1.00 28.90 C ATOM 1255 NZ LYS A 78 -13.498 9.002 76.463 1.00 31.23 N ATOM 1256 HA LYS A 78 -10.925 5.984 71.507 1.00 0.00 H ATOM 1257 HB2 LYS A 78 -13.355 6.377 72.102 1.00 0.00 H ATOM 1258 HB3 LYS A 78 -13.275 4.907 73.100 1.00 0.00 H ATOM 1259 HG2 LYS A 78 -11.628 5.865 74.527 1.00 0.00 H ATOM 1260 HG3 LYS A 78 -11.400 7.251 73.435 1.00 0.00 H ATOM 1261 HD2 LYS A 78 -13.724 7.976 73.917 1.00 0.00 H ATOM 1262 HD3 LYS A 78 -13.883 6.628 75.067 1.00 0.00 H ATOM 1263 HE2 LYS A 78 -11.802 8.841 75.220 1.00 0.00 H ATOM 1264 HE3 LYS A 78 -12.008 7.511 76.384 1.00 0.00 H ATOM 1265 HZ1 LYS A 78 -13.992 9.648 75.815 1.00 0.00 H ATOM 1266 HZ2 LYS A 78 -14.189 8.379 76.927 1.00 0.00 H ATOM 1267 HZ3 LYS A 78 -12.988 9.553 77.183 1.00 0.00 H ATOM 1268 H LYS A 78 -13.208 4.727 70.388 1.00 0.00 H ATOM 1269 N GLY A 79 -9.597 4.496 72.934 1.00 22.08 N ATOM 1270 CA GLY A 79 -8.714 3.579 73.626 1.00 21.83 C ATOM 1271 C GLY A 79 -7.701 2.993 72.662 1.00 21.87 C ATOM 1272 O GLY A 79 -7.661 3.361 71.489 1.00 22.58 O ATOM 1273 HA3 GLY A 79 -9.303 2.773 74.062 1.00 0.00 H ATOM 1274 HA2 GLY A 79 -8.189 4.114 74.418 1.00 0.00 H ATOM 1275 H GLY A 79 -9.284 5.472 72.760 1.00 0.00 H ATOM 1276 N GLY A 80 -6.875 2.078 73.151 1.00 22.00 N ATOM 1277 CA GLY A 80 -5.877 1.457 72.298 1.00 21.85 C ATOM 1278 C GLY A 80 -4.974 2.451 71.595 1.00 21.77 C ATOM 1279 O GLY A 80 -4.315 3.272 72.239 1.00 22.03 O ATOM 1280 HA3 GLY A 80 -6.391 0.864 71.542 1.00 0.00 H ATOM 1281 HA2 GLY A 80 -5.258 0.803 72.912 1.00 0.00 H ATOM 1282 H GLY A 80 -6.942 1.803 74.152 1.00 0.00 H ATOM 1283 N ILE A 81 -4.938 2.381 70.269 1.00 21.19 N ATOM 1284 CA ILE A 81 -4.098 3.282 69.491 1.00 21.39 C ATOM 1285 C ILE A 81 -4.553 4.733 69.624 1.00 21.56 C ATOM 1286 O ILE A 81 -5.734 5.049 69.439 1.00 21.84 O ATOM 1287 CB ILE A 81 -4.107 2.904 68.005 1.00 21.42 C ATOM 1288 CG1 ILE A 81 -3.737 1.429 67.847 1.00 21.37 C ATOM 1289 CG2 ILE A 81 -3.122 3.780 67.241 1.00 20.82 C ATOM 1290 CD1 ILE A 81 -3.872 0.918 66.436 1.00 20.63 C ATOM 1291 HA ILE A 81 -3.088 3.184 69.890 1.00 0.00 H ATOM 1292 HB ILE A 81 -5.106 3.064 67.598 1.00 0.00 H ATOM 1293 HG12 ILE A 81 -2.702 1.298 68.163 1.00 0.00 H ATOM 1294 HG13 ILE A 81 -4.390 0.839 68.491 1.00 0.00 H ATOM 1295 HD11 ILE A 81 -4.905 1.031 66.107 1.00 0.00 H ATOM 1296 HD12 ILE A 81 -3.216 1.490 65.780 1.00 0.00 H ATOM 1297 HD13 ILE A 81 -3.592 -0.135 66.404 1.00 0.00 H ATOM 1298 HG21 ILE A 81 -3.409 4.826 67.348 1.00 0.00 H ATOM 1299 HG22 ILE A 81 -2.120 3.634 67.644 1.00 0.00 H ATOM 1300 HG23 ILE A 81 -3.135 3.505 66.186 1.00 0.00 H ATOM 1301 H ILE A 81 -5.519 1.672 69.778 1.00 0.00 H ATOM 1302 N LEU A 82 -3.605 5.611 69.943 1.00 20.73 N ATOM 1303 CA LEU A 82 -3.894 7.027 70.106 1.00 20.36 C ATOM 1304 C LEU A 82 -3.591 7.792 68.822 1.00 20.63 C ATOM 1305 O LEU A 82 -4.374 8.636 68.376 1.00 20.41 O ATOM 1306 CB LEU A 82 -3.053 7.596 71.247 1.00 19.57 C ATOM 1307 CG LEU A 82 -3.248 6.902 72.594 1.00 19.69 C ATOM 1308 CD1 LEU A 82 -2.299 7.521 73.616 1.00 18.77 C ATOM 1309 CD2 LEU A 82 -4.716 7.014 73.029 1.00 17.82 C ATOM 1310 HA LEU A 82 -4.953 7.138 70.337 1.00 0.00 H ATOM 1311 HB2 LEU A 82 -2.002 7.510 70.970 1.00 0.00 H ATOM 1312 HB3 LEU A 82 -3.311 8.648 71.367 1.00 0.00 H ATOM 1313 HG LEU A 82 -3.013 5.841 72.513 1.00 0.00 H ATOM 1314 HD21 LEU A 82 -4.987 8.066 73.122 1.00 0.00 H ATOM 1315 HD22 LEU A 82 -5.352 6.538 72.282 1.00 0.00 H ATOM 1316 HD23 LEU A 82 -4.848 6.517 73.990 1.00 0.00 H ATOM 1317 HD11 LEU A 82 -1.270 7.390 73.281 1.00 0.00 H ATOM 1318 HD12 LEU A 82 -2.517 8.584 73.715 1.00 0.00 H ATOM 1319 HD13 LEU A 82 -2.434 7.029 74.579 1.00 0.00 H ATOM 1320 H LEU A 82 -2.630 5.275 70.080 1.00 0.00 H ATOM 1321 N ALA A 83 -2.438 7.491 68.237 1.00 20.58 N ATOM 1322 CA ALA A 83 -2.005 8.148 67.019 1.00 20.04 C ATOM 1323 C ALA A 83 -0.855 7.366 66.421 1.00 20.20 C ATOM 1324 O ALA A 83 -0.301 6.461 67.059 1.00 21.24 O ATOM 1325 CB ALA A 83 -1.554 9.570 67.328 1.00 19.65 C ATOM 1326 HA ALA A 83 -2.833 8.188 66.311 1.00 0.00 H ATOM 1327 HB1 ALA A 83 -2.385 10.127 67.762 1.00 0.00 H ATOM 1328 HB2 ALA A 83 -0.725 9.541 68.036 1.00 0.00 H ATOM 1329 HB3 ALA A 83 -1.231 10.055 66.407 1.00 0.00 H ATOM 1330 H ALA A 83 -1.829 6.764 68.664 1.00 0.00 H ATOM 1331 N HIS A 84 -0.505 7.713 65.190 1.00 19.27 N ATOM 1332 CA HIS A 84 0.599 7.072 64.501 1.00 19.06 C ATOM 1333 C HIS A 84 1.113 8.059 63.458 1.00 18.99 C ATOM 1334 O HIS A 84 0.374 8.938 63.003 1.00 18.74 O ATOM 1335 CB HIS A 84 0.153 5.733 63.875 1.00 18.61 C ATOM 1336 CG HIS A 84 -0.923 5.856 62.835 1.00 19.94 C ATOM 1337 ND1 HIS A 84 -1.834 4.848 62.594 1.00 20.45 N ATOM 1338 CD2 HIS A 84 -1.198 6.831 61.934 1.00 20.10 C ATOM 1339 CE1 HIS A 84 -2.621 5.195 61.591 1.00 20.24 C ATOM 1340 NE2 HIS A 84 -2.256 6.394 61.171 1.00 20.56 N ATOM 1341 HA HIS A 84 1.403 6.822 65.194 1.00 0.00 H ATOM 1342 HB2 HIS A 84 1.023 5.268 63.411 1.00 0.00 H ATOM 1343 HB3 HIS A 84 -0.218 5.091 64.674 1.00 0.00 H ATOM 1344 HD2 HIS A 84 -0.678 7.784 61.833 1.00 0.00 H ATOM 1345 HE1 HIS A 84 -3.433 4.595 61.180 1.00 0.00 H ATOM 1346 H HIS A 84 -1.036 8.465 64.706 1.00 0.00 H ATOM 1347 N ALA A 85 2.389 7.941 63.112 1.00 18.62 N ATOM 1348 CA ALA A 85 2.991 8.838 62.138 1.00 18.50 C ATOM 1349 C ALA A 85 3.921 8.027 61.267 1.00 18.33 C ATOM 1350 O ALA A 85 4.179 6.865 61.553 1.00 18.31 O ATOM 1351 CB ALA A 85 3.758 9.949 62.846 1.00 18.14 C ATOM 1352 HA ALA A 85 2.218 9.304 61.527 1.00 0.00 H ATOM 1353 HB1 ALA A 85 3.074 10.516 63.478 1.00 0.00 H ATOM 1354 HB2 ALA A 85 4.544 9.511 63.461 1.00 0.00 H ATOM 1355 HB3 ALA A 85 4.203 10.612 62.104 1.00 0.00 H ATOM 1356 H ALA A 85 2.969 7.194 63.545 1.00 0.00 H ATOM 1357 N PHE A 86 4.428 8.638 60.203 1.00 18.69 N ATOM 1358 CA PHE A 86 5.318 7.931 59.297 1.00 18.44 C ATOM 1359 C PHE A 86 6.683 8.592 59.189 1.00 18.39 C ATOM 1360 O PHE A 86 6.809 9.813 59.330 1.00 18.05 O ATOM 1361 CB PHE A 86 4.643 7.812 57.932 1.00 18.62 C ATOM 1362 CG PHE A 86 3.281 7.185 58.007 1.00 20.18 C ATOM 1363 CD1 PHE A 86 2.185 7.922 58.461 1.00 19.91 C ATOM 1364 CD2 PHE A 86 3.106 5.828 57.708 1.00 20.34 C ATOM 1365 CE1 PHE A 86 0.926 7.317 58.626 1.00 20.33 C ATOM 1366 CE2 PHE A 86 1.855 5.210 57.867 1.00 20.57 C ATOM 1367 CZ PHE A 86 0.762 5.957 58.329 1.00 20.91 C ATOM 1368 HA PHE A 86 5.503 6.935 59.700 1.00 0.00 H ATOM 1369 HB2 PHE A 86 4.544 8.810 57.504 1.00 0.00 H ATOM 1370 HB3 PHE A 86 5.272 7.201 57.284 1.00 0.00 H ATOM 1371 HD2 PHE A 86 3.952 5.244 57.347 1.00 0.00 H ATOM 1372 HE2 PHE A 86 1.734 4.153 57.632 1.00 0.00 H ATOM 1373 HZ PHE A 86 -0.211 5.482 58.457 1.00 0.00 H ATOM 1374 HE1 PHE A 86 0.080 7.904 58.984 1.00 0.00 H ATOM 1375 HD1 PHE A 86 2.307 8.981 58.691 1.00 0.00 H ATOM 1376 H PHE A 86 4.186 9.632 60.016 1.00 0.00 H ATOM 1377 N GLY A 87 7.704 7.768 58.962 1.00 18.10 N ATOM 1378 CA GLY A 87 9.062 8.267 58.847 1.00 18.00 C ATOM 1379 C GLY A 87 9.271 9.239 57.702 1.00 18.25 C ATOM 1380 O GLY A 87 8.463 9.302 56.776 1.00 17.59 O ATOM 1381 HA3 GLY A 87 9.728 7.417 58.700 1.00 0.00 H ATOM 1382 HA2 GLY A 87 9.321 8.773 59.777 1.00 0.00 H ATOM 1383 H GLY A 87 7.525 6.748 58.865 1.00 0.00 H ATOM 1384 N PRO A 88 10.367 10.009 57.734 1.00 19.23 N ATOM 1385 CA PRO A 88 10.672 10.986 56.682 1.00 19.57 C ATOM 1386 C PRO A 88 10.561 10.371 55.287 1.00 19.63 C ATOM 1387 O PRO A 88 10.948 9.221 55.066 1.00 20.01 O ATOM 1388 CB PRO A 88 12.104 11.410 57.009 1.00 19.76 C ATOM 1389 CG PRO A 88 12.180 11.248 58.506 1.00 19.19 C ATOM 1390 CD PRO A 88 11.465 9.934 58.718 1.00 19.80 C ATOM 1391 HA PRO A 88 9.976 11.825 56.663 1.00 0.00 H ATOM 1392 HD3 PRO A 88 12.122 9.089 58.512 1.00 0.00 H ATOM 1393 HD2 PRO A 88 11.079 9.854 59.734 1.00 0.00 H ATOM 1394 HG3 PRO A 88 11.670 12.064 59.019 1.00 0.00 H ATOM 1395 HG2 PRO A 88 13.214 11.196 58.847 1.00 0.00 H ATOM 1396 HB2 PRO A 88 12.826 10.765 56.509 1.00 0.00 H ATOM 1397 HB3 PRO A 88 12.281 12.446 56.718 1.00 0.00 H ATOM 1398 N GLY A 89 10.038 11.152 54.351 1.00 19.22 N ATOM 1399 CA GLY A 89 9.877 10.692 52.988 1.00 18.96 C ATOM 1400 C GLY A 89 8.787 11.528 52.366 1.00 19.77 C ATOM 1401 O GLY A 89 8.067 12.216 53.086 1.00 20.14 O ATOM 1402 HA3 GLY A 89 9.593 9.640 52.979 1.00 0.00 H ATOM 1403 HA2 GLY A 89 10.808 10.821 52.437 1.00 0.00 H ATOM 1404 H GLY A 89 9.737 12.115 54.602 1.00 0.00 H ATOM 1405 N SER A 90 8.650 11.491 51.046 1.00 20.40 N ATOM 1406 CA SER A 90 7.609 12.284 50.409 1.00 21.61 C ATOM 1407 C SER A 90 6.300 11.508 50.434 1.00 21.03 C ATOM 1408 O SER A 90 6.295 10.312 50.728 1.00 21.07 O ATOM 1409 CB SER A 90 8.010 12.644 48.975 1.00 23.02 C ATOM 1410 OG SER A 90 8.312 11.483 48.234 1.00 26.03 O ATOM 1411 HA SER A 90 7.476 13.217 50.957 1.00 0.00 H ATOM 1412 HB2 SER A 90 8.887 13.291 49.000 1.00 0.00 H ATOM 1413 HB3 SER A 90 7.186 13.171 48.494 1.00 0.00 H ATOM 1414 HG SER A 90 9.063 11.004 48.666 1.00 0.00 H ATOM 1415 H SER A 90 9.283 10.899 50.471 1.00 0.00 H ATOM 1416 N GLY A 91 5.193 12.183 50.134 1.00 20.47 N ATOM 1417 CA GLY A 91 3.900 11.521 50.169 1.00 19.85 C ATOM 1418 C GLY A 91 3.407 11.457 51.609 1.00 19.79 C ATOM 1419 O GLY A 91 3.416 12.466 52.319 1.00 19.09 O ATOM 1420 HA3 GLY A 91 3.997 10.511 49.772 1.00 0.00 H ATOM 1421 HA2 GLY A 91 3.187 12.081 49.564 1.00 0.00 H ATOM 1422 H GLY A 91 5.254 13.188 49.874 1.00 0.00 H ATOM 1423 N ILE A 92 2.991 10.277 52.062 1.00 19.49 N ATOM 1424 CA ILE A 92 2.510 10.152 53.432 1.00 18.74 C ATOM 1425 C ILE A 92 3.660 10.340 54.418 1.00 18.68 C ATOM 1426 O ILE A 92 3.435 10.614 55.595 1.00 18.84 O ATOM 1427 CB ILE A 92 1.856 8.772 53.688 1.00 18.04 C ATOM 1428 CG1 ILE A 92 0.964 8.847 54.929 1.00 17.75 C ATOM 1429 CG2 ILE A 92 2.926 7.712 53.899 1.00 16.93 C ATOM 1430 CD1 ILE A 92 0.126 7.610 55.168 1.00 17.94 C ATOM 1431 HA ILE A 92 1.758 10.928 53.578 1.00 0.00 H ATOM 1432 HB ILE A 92 1.255 8.503 52.820 1.00 0.00 H ATOM 1433 HG12 ILE A 92 1.602 9.001 55.799 1.00 0.00 H ATOM 1434 HG13 ILE A 92 0.293 9.698 54.816 1.00 0.00 H ATOM 1435 HD11 ILE A 92 -0.529 7.446 54.313 1.00 0.00 H ATOM 1436 HD12 ILE A 92 0.781 6.748 55.296 1.00 0.00 H ATOM 1437 HD13 ILE A 92 -0.475 7.748 56.067 1.00 0.00 H ATOM 1438 HG21 ILE A 92 3.554 7.650 53.010 1.00 0.00 H ATOM 1439 HG22 ILE A 92 3.538 7.982 54.760 1.00 0.00 H ATOM 1440 HG23 ILE A 92 2.450 6.748 54.078 1.00 0.00 H ATOM 1441 H ILE A 92 3.009 9.445 51.439 1.00 0.00 H ATOM 1442 N GLY A 93 4.889 10.190 53.929 1.00 18.79 N ATOM 1443 CA GLY A 93 6.055 10.340 54.783 1.00 19.05 C ATOM 1444 C GLY A 93 6.043 11.585 55.654 1.00 19.43 C ATOM 1445 O GLY A 93 5.817 12.693 55.162 1.00 20.13 O ATOM 1446 HA3 GLY A 93 6.940 10.377 54.148 1.00 0.00 H ATOM 1447 HA2 GLY A 93 6.114 9.469 55.435 1.00 0.00 H ATOM 1448 H GLY A 93 5.016 9.962 52.922 1.00 0.00 H ATOM 1449 N GLY A 94 6.286 11.406 56.950 1.00 19.35 N ATOM 1450 CA GLY A 94 6.307 12.529 57.871 1.00 19.52 C ATOM 1451 C GLY A 94 4.945 12.911 58.431 1.00 20.05 C ATOM 1452 O GLY A 94 4.859 13.689 59.381 1.00 19.71 O ATOM 1453 HA3 GLY A 94 6.714 13.393 57.346 1.00 0.00 H ATOM 1454 HA2 GLY A 94 6.959 12.273 58.706 1.00 0.00 H ATOM 1455 H GLY A 94 6.464 10.446 57.309 1.00 0.00 H ATOM 1456 N ASP A 95 3.877 12.363 57.857 1.00 20.00 N ATOM 1457 CA ASP A 95 2.524 12.680 58.311 1.00 20.01 C ATOM 1458 C ASP A 95 2.202 12.087 59.682 1.00 20.07 C ATOM 1459 O ASP A 95 2.680 11.002 60.040 1.00 19.55 O ATOM 1460 CB ASP A 95 1.493 12.205 57.277 1.00 20.03 C ATOM 1461 CG ASP A 95 1.547 13.009 55.993 1.00 20.13 C ATOM 1462 OD1 ASP A 95 2.435 13.879 55.882 1.00 20.49 O ATOM 1463 OD2 ASP A 95 0.708 12.776 55.096 1.00 20.57 O ATOM 1464 HA ASP A 95 2.473 13.764 58.414 1.00 0.00 H ATOM 1465 HB2 ASP A 95 1.688 11.158 57.043 1.00 0.00 H ATOM 1466 HB3 ASP A 95 0.496 12.300 57.708 1.00 0.00 H ATOM 1467 H ASP A 95 4.007 11.696 57.070 1.00 0.00 H ATOM 1468 N ALA A 96 1.389 12.816 60.446 1.00 19.66 N ATOM 1469 CA ALA A 96 0.989 12.387 61.782 1.00 19.09 C ATOM 1470 C ALA A 96 -0.529 12.344 61.900 1.00 19.05 C ATOM 1471 O ALA A 96 -1.216 13.352 61.701 1.00 18.61 O ATOM 1472 CB ALA A 96 1.563 13.329 62.820 1.00 19.29 C ATOM 1473 HA ALA A 96 1.377 11.383 61.955 1.00 0.00 H ATOM 1474 HB1 ALA A 96 2.651 13.324 62.751 1.00 0.00 H ATOM 1475 HB2 ALA A 96 1.191 14.337 62.639 1.00 0.00 H ATOM 1476 HB3 ALA A 96 1.259 13.001 63.814 1.00 0.00 H ATOM 1477 H ALA A 96 1.028 13.719 60.078 1.00 0.00 H ATOM 1478 N HIS A 97 -1.046 11.167 62.232 1.00 18.91 N ATOM 1479 CA HIS A 97 -2.482 10.981 62.368 1.00 18.72 C ATOM 1480 C HIS A 97 -2.872 10.757 63.821 1.00 18.80 C ATOM 1481 O HIS A 97 -2.198 10.034 64.556 1.00 18.43 O ATOM 1482 CB HIS A 97 -2.931 9.793 61.518 1.00 18.75 C ATOM 1483 CG HIS A 97 -2.591 9.930 60.065 1.00 18.75 C ATOM 1484 ND1 HIS A 97 -2.769 8.907 59.158 1.00 18.14 N ATOM 1485 CD2 HIS A 97 -2.081 10.971 59.363 1.00 18.15 C ATOM 1486 CE1 HIS A 97 -2.381 9.312 57.962 1.00 18.50 C ATOM 1487 NE2 HIS A 97 -1.960 10.560 58.059 1.00 18.20 N ATOM 1488 HA HIS A 97 -2.979 11.887 62.021 1.00 0.00 H ATOM 1489 HB2 HIS A 97 -2.449 8.893 61.901 1.00 0.00 H ATOM 1490 HB3 HIS A 97 -4.012 9.692 61.611 1.00 0.00 H ATOM 1491 HD2 HIS A 97 -1.816 11.951 59.760 1.00 0.00 H ATOM 1492 HE1 HIS A 97 -2.404 8.717 57.049 1.00 0.00 H ATOM 1493 H HIS A 97 -0.410 10.361 62.398 1.00 0.00 H ATOM 1494 N PHE A 98 -3.961 11.394 64.231 1.00 18.83 N ATOM 1495 CA PHE A 98 -4.442 11.262 65.592 1.00 18.71 C ATOM 1496 C PHE A 98 -5.848 10.697 65.551 1.00 19.07 C ATOM 1497 O PHE A 98 -6.713 11.197 64.838 1.00 19.12 O ATOM 1498 CB PHE A 98 -4.428 12.624 66.293 1.00 18.99 C ATOM 1499 CG PHE A 98 -3.069 13.272 66.325 1.00 19.52 C ATOM 1500 CD1 PHE A 98 -2.579 13.954 65.209 1.00 19.22 C ATOM 1501 CD2 PHE A 98 -2.249 13.152 67.453 1.00 19.61 C ATOM 1502 CE1 PHE A 98 -1.291 14.504 65.212 1.00 18.72 C ATOM 1503 CE2 PHE A 98 -0.959 13.698 67.465 1.00 18.96 C ATOM 1504 CZ PHE A 98 -0.482 14.373 66.341 1.00 18.67 C ATOM 1505 HA PHE A 98 -3.793 10.590 66.154 1.00 0.00 H ATOM 1506 HB2 PHE A 98 -5.115 13.289 65.769 1.00 0.00 H ATOM 1507 HB3 PHE A 98 -4.769 12.487 67.319 1.00 0.00 H ATOM 1508 HD2 PHE A 98 -2.619 12.627 68.334 1.00 0.00 H ATOM 1509 HE2 PHE A 98 -0.330 13.596 68.349 1.00 0.00 H ATOM 1510 HZ PHE A 98 0.522 14.798 66.345 1.00 0.00 H ATOM 1511 HE1 PHE A 98 -0.921 15.033 64.334 1.00 0.00 H ATOM 1512 HD1 PHE A 98 -3.207 14.060 64.324 1.00 0.00 H ATOM 1513 H PHE A 98 -4.480 12.000 63.563 1.00 0.00 H ATOM 1514 N ASP A 99 -6.063 9.632 66.306 1.00 19.92 N ATOM 1515 CA ASP A 99 -7.365 8.985 66.373 1.00 20.58 C ATOM 1516 C ASP A 99 -8.403 9.966 66.933 1.00 20.99 C ATOM 1517 O ASP A 99 -8.324 10.382 68.093 1.00 19.83 O ATOM 1518 CB ASP A 99 -7.272 7.753 67.276 1.00 20.94 C ATOM 1519 CG ASP A 99 -8.493 6.866 67.186 1.00 21.09 C ATOM 1520 OD1 ASP A 99 -9.579 7.366 66.814 1.00 19.68 O ATOM 1521 OD2 ASP A 99 -8.360 5.664 67.505 1.00 22.05 O ATOM 1522 HA ASP A 99 -7.672 8.678 65.373 1.00 0.00 H ATOM 1523 HB2 ASP A 99 -6.397 7.172 66.984 1.00 0.00 H ATOM 1524 HB3 ASP A 99 -7.158 8.085 68.308 1.00 0.00 H ATOM 1525 H ASP A 99 -5.278 9.246 66.868 1.00 0.00 H ATOM 1526 N GLU A 100 -9.374 10.323 66.098 1.00 21.71 N ATOM 1527 CA GLU A 100 -10.429 11.248 66.488 1.00 22.00 C ATOM 1528 C GLU A 100 -11.414 10.623 67.484 1.00 21.71 C ATOM 1529 O GLU A 100 -12.265 11.316 68.038 1.00 21.50 O ATOM 1530 CB GLU A 100 -11.171 11.745 65.238 1.00 23.17 C ATOM 1531 CG GLU A 100 -12.192 12.864 65.489 1.00 23.56 C ATOM 1532 CD GLU A 100 -11.574 14.109 66.106 1.00 24.18 C ATOM 1533 OE1 GLU A 100 -11.247 14.081 67.311 1.00 24.35 O ATOM 1534 OE2 GLU A 100 -11.409 15.117 65.383 1.00 25.26 O ATOM 1535 HA GLU A 100 -9.959 12.091 66.995 1.00 0.00 H ATOM 1536 HB2 GLU A 100 -10.430 12.116 64.530 1.00 0.00 H ATOM 1537 HB3 GLU A 100 -11.699 10.898 64.799 1.00 0.00 H ATOM 1538 HG2 GLU A 100 -12.648 13.138 64.537 1.00 0.00 H ATOM 1539 HG3 GLU A 100 -12.961 12.487 66.164 1.00 0.00 H ATOM 1540 H GLU A 100 -9.380 9.929 65.136 1.00 0.00 H ATOM 1541 N ASP A 101 -11.310 9.318 67.713 1.00 21.41 N ATOM 1542 CA ASP A 101 -12.193 8.678 68.677 1.00 21.20 C ATOM 1543 C ASP A 101 -11.653 8.859 70.089 1.00 21.78 C ATOM 1544 O ASP A 101 -12.287 8.450 71.056 1.00 22.44 O ATOM 1545 CB ASP A 101 -12.382 7.188 68.377 1.00 21.05 C ATOM 1546 CG ASP A 101 -13.428 6.938 67.301 1.00 20.39 C ATOM 1547 OD1 ASP A 101 -14.414 7.701 67.244 1.00 20.11 O ATOM 1548 OD2 ASP A 101 -13.274 5.972 66.521 1.00 20.37 O ATOM 1549 HA ASP A 101 -13.167 9.160 68.596 1.00 0.00 H ATOM 1550 HB2 ASP A 101 -11.430 6.775 68.042 1.00 0.00 H ATOM 1551 HB3 ASP A 101 -12.694 6.684 69.292 1.00 0.00 H ATOM 1552 H ASP A 101 -10.599 8.755 67.204 1.00 0.00 H ATOM 1553 N GLU A 102 -10.469 9.454 70.210 1.00 22.04 N ATOM 1554 CA GLU A 102 -9.905 9.737 71.530 1.00 21.93 C ATOM 1555 C GLU A 102 -10.412 11.137 71.833 1.00 21.86 C ATOM 1556 O GLU A 102 -10.848 11.848 70.923 1.00 21.66 O ATOM 1557 CB GLU A 102 -8.370 9.770 71.510 1.00 22.14 C ATOM 1558 CG GLU A 102 -7.682 8.485 71.046 1.00 23.12 C ATOM 1559 CD GLU A 102 -8.233 7.231 71.706 1.00 23.00 C ATOM 1560 OE1 GLU A 102 -8.452 7.238 72.935 1.00 22.98 O ATOM 1561 OE2 GLU A 102 -8.434 6.230 70.989 1.00 23.57 O ATOM 1562 HA GLU A 102 -10.190 8.976 72.257 1.00 0.00 H ATOM 1563 HB2 GLU A 102 -8.061 10.575 70.843 1.00 0.00 H ATOM 1564 HB3 GLU A 102 -8.027 9.987 72.522 1.00 0.00 H ATOM 1565 HG2 GLU A 102 -7.812 8.393 69.968 1.00 0.00 H ATOM 1566 HG3 GLU A 102 -6.619 8.559 71.278 1.00 0.00 H ATOM 1567 H GLU A 102 -9.938 9.721 69.356 1.00 0.00 H ATOM 1568 N PHE A 103 -10.380 11.544 73.096 1.00 22.21 N ATOM 1569 CA PHE A 103 -10.826 12.894 73.427 1.00 22.44 C ATOM 1570 C PHE A 103 -9.593 13.761 73.644 1.00 21.91 C ATOM 1571 O PHE A 103 -8.916 13.645 74.662 1.00 21.42 O ATOM 1572 CB PHE A 103 -11.692 12.907 74.683 1.00 23.27 C ATOM 1573 CG PHE A 103 -12.331 14.231 74.942 1.00 23.88 C ATOM 1574 CD1 PHE A 103 -13.294 14.727 74.071 1.00 23.85 C ATOM 1575 CD2 PHE A 103 -11.929 15.015 76.021 1.00 24.38 C ATOM 1576 CE1 PHE A 103 -13.847 15.992 74.267 1.00 24.56 C ATOM 1577 CE2 PHE A 103 -12.475 16.281 76.227 1.00 24.31 C ATOM 1578 CZ PHE A 103 -13.437 16.771 75.346 1.00 24.24 C ATOM 1579 HA PHE A 103 -11.433 13.279 72.608 1.00 0.00 H ATOM 1580 HB2 PHE A 103 -12.477 12.159 74.571 1.00 0.00 H ATOM 1581 HB3 PHE A 103 -11.067 12.650 75.538 1.00 0.00 H ATOM 1582 HD2 PHE A 103 -11.178 14.634 76.713 1.00 0.00 H ATOM 1583 HE2 PHE A 103 -12.151 16.885 77.074 1.00 0.00 H ATOM 1584 HZ PHE A 103 -13.867 17.761 75.501 1.00 0.00 H ATOM 1585 HE1 PHE A 103 -14.600 16.371 73.576 1.00 0.00 H ATOM 1586 HD1 PHE A 103 -13.620 14.121 73.226 1.00 0.00 H ATOM 1587 H PHE A 103 -10.040 10.906 73.844 1.00 0.00 H ATOM 1588 N TRP A 104 -9.308 14.626 72.676 1.00 21.87 N ATOM 1589 CA TRP A 104 -8.134 15.484 72.751 1.00 22.35 C ATOM 1590 C TRP A 104 -8.334 16.690 73.656 1.00 23.22 C ATOM 1591 O TRP A 104 -9.323 17.414 73.545 1.00 23.35 O ATOM 1592 CB TRP A 104 -7.711 15.905 71.337 1.00 20.28 C ATOM 1593 CG TRP A 104 -7.453 14.710 70.473 1.00 18.25 C ATOM 1594 CD1 TRP A 104 -8.307 14.158 69.561 1.00 17.71 C ATOM 1595 CD2 TRP A 104 -6.328 13.825 70.554 1.00 17.90 C ATOM 1596 NE1 TRP A 104 -7.791 12.980 69.076 1.00 16.86 N ATOM 1597 CE2 TRP A 104 -6.577 12.749 69.668 1.00 17.66 C ATOM 1598 CE3 TRP A 104 -5.136 13.831 71.295 1.00 17.62 C ATOM 1599 CZ2 TRP A 104 -5.675 11.682 69.503 1.00 17.63 C ATOM 1600 CZ3 TRP A 104 -4.237 12.768 71.130 1.00 17.88 C ATOM 1601 CH2 TRP A 104 -4.515 11.709 70.240 1.00 17.36 C ATOM 1602 HA TRP A 104 -7.332 14.905 73.209 1.00 0.00 H ATOM 1603 HB2 TRP A 104 -8.506 16.503 70.890 1.00 0.00 H ATOM 1604 HB3 TRP A 104 -6.801 16.502 71.400 1.00 0.00 H ATOM 1605 HE1 TRP A 104 -8.248 12.364 68.374 1.00 0.00 H ATOM 1606 HD1 TRP A 104 -9.262 14.590 69.261 1.00 0.00 H ATOM 1607 HZ2 TRP A 104 -5.888 10.863 68.816 1.00 0.00 H ATOM 1608 HH2 TRP A 104 -3.796 10.897 70.135 1.00 0.00 H ATOM 1609 HZ3 TRP A 104 -3.307 12.759 71.699 1.00 0.00 H ATOM 1610 HE3 TRP A 104 -4.914 14.645 71.985 1.00 0.00 H ATOM 1611 H TRP A 104 -9.936 14.691 71.849 1.00 0.00 H ATOM 1612 N THR A 105 -7.380 16.889 74.558 1.00 24.56 N ATOM 1613 CA THR A 105 -7.438 17.981 75.523 1.00 25.62 C ATOM 1614 C THR A 105 -6.145 18.774 75.578 1.00 26.12 C ATOM 1615 O THR A 105 -5.088 18.301 75.143 1.00 25.85 O ATOM 1616 CB THR A 105 -7.704 17.450 76.949 1.00 25.65 C ATOM 1617 OG1 THR A 105 -6.639 16.568 77.335 1.00 26.38 O ATOM 1618 CG2 THR A 105 -9.023 16.695 77.007 1.00 25.84 C ATOM 1619 HA THR A 105 -8.251 18.625 75.187 1.00 0.00 H ATOM 1620 HB THR A 105 -7.756 18.299 77.631 1.00 0.00 H ATOM 1621 HG1 THR A 105 -5.781 17.062 77.320 1.00 0.00 H ATOM 1622 HG23 THR A 105 -9.835 17.361 76.715 1.00 0.00 H ATOM 1623 HG21 THR A 105 -8.984 15.846 76.325 1.00 0.00 H ATOM 1624 HG22 THR A 105 -9.192 16.339 78.023 1.00 0.00 H ATOM 1625 H THR A 105 -6.564 16.244 74.577 1.00 0.00 H ATOM 1626 N THR A 106 -6.247 19.979 76.133 1.00 27.29 N ATOM 1627 CA THR A 106 -5.104 20.871 76.291 1.00 28.65 C ATOM 1628 C THR A 106 -4.337 20.453 77.542 1.00 29.39 C ATOM 1629 O THR A 106 -3.170 20.813 77.720 1.00 29.51 O ATOM 1630 CB THR A 106 -5.548 22.348 76.435 1.00 29.03 C ATOM 1631 OG1 THR A 106 -6.490 22.465 77.512 1.00 29.10 O ATOM 1632 CG2 THR A 106 -6.183 22.848 75.135 1.00 28.23 C ATOM 1633 HA THR A 106 -4.477 20.796 75.402 1.00 0.00 H ATOM 1634 HB THR A 106 -4.671 22.958 76.650 1.00 0.00 H ATOM 1635 HG1 THR A 106 -6.065 22.165 78.354 1.00 0.00 H ATOM 1636 HG23 THR A 106 -5.463 22.756 74.322 1.00 0.00 H ATOM 1637 HG21 THR A 106 -7.066 22.249 74.910 1.00 0.00 H ATOM 1638 HG22 THR A 106 -6.471 23.893 75.251 1.00 0.00 H ATOM 1639 H THR A 106 -7.179 20.297 76.467 1.00 0.00 H ATOM 1640 N HIS A 107 -5.001 19.691 78.410 1.00 30.34 N ATOM 1641 CA HIS A 107 -4.358 19.201 79.620 1.00 31.02 C ATOM 1642 C HIS A 107 -4.544 17.697 79.798 1.00 30.08 C ATOM 1643 O HIS A 107 -4.122 16.940 78.925 1.00 30.06 O ATOM 1644 CB HIS A 107 -4.839 19.995 80.832 1.00 33.61 C ATOM 1645 CG HIS A 107 -4.426 21.435 80.786 1.00 36.72 C ATOM 1646 ND1 HIS A 107 -5.224 22.425 80.249 1.00 37.70 N ATOM 1647 CD2 HIS A 107 -3.256 22.035 81.115 1.00 37.54 C ATOM 1648 CE1 HIS A 107 -4.563 23.569 80.247 1.00 38.01 C ATOM 1649 NE2 HIS A 107 -3.366 23.360 80.766 1.00 38.22 N ATOM 1650 HA HIS A 107 -3.284 19.359 79.523 1.00 0.00 H ATOM 1651 HB2 HIS A 107 -5.927 19.946 80.871 1.00 0.00 H ATOM 1652 HB3 HIS A 107 -4.424 19.542 81.732 1.00 0.00 H ATOM 1653 HD2 HIS A 107 -2.390 21.556 81.571 1.00 0.00 H ATOM 1654 HE1 HIS A 107 -4.941 24.523 79.880 1.00 0.00 H ATOM 1655 H HIS A 107 -5.993 19.443 78.220 1.00 0.00 H ATOM 1656 N SER A 108 -5.168 17.248 80.886 1.00 29.00 N ATOM 1657 CA SER A 108 -5.326 15.806 81.095 1.00 28.17 C ATOM 1658 C SER A 108 -6.750 15.256 81.147 1.00 28.14 C ATOM 1659 O SER A 108 -6.965 14.111 81.547 1.00 27.87 O ATOM 1660 CB SER A 108 -4.576 15.373 82.359 1.00 27.56 C ATOM 1661 OG SER A 108 -5.127 15.968 83.519 1.00 27.16 O ATOM 1662 HA SER A 108 -4.902 15.374 80.188 1.00 0.00 H ATOM 1663 HB2 SER A 108 -3.531 15.670 82.270 1.00 0.00 H ATOM 1664 HB3 SER A 108 -4.637 14.289 82.454 1.00 0.00 H ATOM 1665 HG SER A 108 -6.075 15.698 83.609 1.00 0.00 H ATOM 1666 H SER A 108 -5.542 17.920 81.586 1.00 0.00 H ATOM 1667 N GLY A 109 -7.723 16.056 80.734 1.00 28.32 N ATOM 1668 CA GLY A 109 -9.096 15.585 80.750 1.00 28.81 C ATOM 1669 C GLY A 109 -9.287 14.340 79.899 1.00 29.05 C ATOM 1670 O GLY A 109 -10.247 13.596 80.081 1.00 30.38 O ATOM 1671 HA3 GLY A 109 -9.743 16.375 80.367 1.00 0.00 H ATOM 1672 HA2 GLY A 109 -9.376 15.354 81.778 1.00 0.00 H ATOM 1673 H GLY A 109 -7.504 17.016 80.400 1.00 0.00 H ATOM 1674 N GLY A 110 -8.373 14.117 78.961 1.00 28.63 N ATOM 1675 CA GLY A 110 -8.452 12.959 78.089 1.00 27.52 C ATOM 1676 C GLY A 110 -7.059 12.657 77.582 1.00 27.31 C ATOM 1677 O GLY A 110 -6.144 12.438 78.375 1.00 28.03 O ATOM 1678 HA3 GLY A 110 -9.113 13.173 77.249 1.00 0.00 H ATOM 1679 HA2 GLY A 110 -8.837 12.104 78.644 1.00 0.00 H ATOM 1680 H GLY A 110 -7.585 14.786 78.849 1.00 0.00 H ATOM 1681 N THR A 111 -6.876 12.636 76.269 1.00 26.55 N ATOM 1682 CA THR A 111 -5.545 12.380 75.730 1.00 25.46 C ATOM 1683 C THR A 111 -4.923 13.716 75.325 1.00 24.75 C ATOM 1684 O THR A 111 -5.471 14.446 74.491 1.00 24.32 O ATOM 1685 CB THR A 111 -5.589 11.424 74.518 1.00 25.52 C ATOM 1686 OG1 THR A 111 -6.162 10.165 74.913 1.00 24.41 O ATOM 1687 CG2 THR A 111 -4.183 11.187 73.987 1.00 24.76 C ATOM 1688 HA THR A 111 -4.943 11.894 76.498 1.00 0.00 H ATOM 1689 HB THR A 111 -6.199 11.877 73.736 1.00 0.00 H ATOM 1690 HG1 THR A 111 -7.082 10.313 75.248 1.00 0.00 H ATOM 1691 HG23 THR A 111 -3.744 12.138 73.686 1.00 0.00 H ATOM 1692 HG21 THR A 111 -3.572 10.735 74.768 1.00 0.00 H ATOM 1693 HG22 THR A 111 -4.229 10.519 73.127 1.00 0.00 H ATOM 1694 H THR A 111 -7.677 12.801 75.627 1.00 0.00 H ATOM 1695 N ASN A 112 -3.786 14.034 75.938 1.00 23.78 N ATOM 1696 CA ASN A 112 -3.086 15.288 75.677 1.00 22.96 C ATOM 1697 C ASN A 112 -2.487 15.373 74.278 1.00 22.42 C ATOM 1698 O ASN A 112 -1.574 14.622 73.940 1.00 22.36 O ATOM 1699 CB ASN A 112 -1.980 15.490 76.714 1.00 22.94 C ATOM 1700 CG ASN A 112 -1.370 16.879 76.649 1.00 22.96 C ATOM 1701 OD1 ASN A 112 -0.270 17.078 76.107 1.00 22.08 O ATOM 1702 ND2 ASN A 112 -2.093 17.854 77.188 1.00 20.83 N ATOM 1703 HA ASN A 112 -3.834 16.077 75.749 1.00 0.00 H ATOM 1704 HB2 ASN A 112 -2.400 15.338 77.708 1.00 0.00 H ATOM 1705 HB3 ASN A 112 -1.195 14.754 76.537 1.00 0.00 H ATOM 1706 HD22 ASN A 112 -3.009 17.638 77.631 1.00 0.00 H ATOM 1707 HD21 ASN A 112 -1.743 18.833 77.167 1.00 0.00 H ATOM 1708 H ASN A 112 -3.382 13.367 76.626 1.00 0.00 H ATOM 1709 N LEU A 113 -2.994 16.309 73.478 1.00 21.93 N ATOM 1710 CA LEU A 113 -2.520 16.501 72.109 1.00 21.09 C ATOM 1711 C LEU A 113 -1.016 16.779 72.036 1.00 20.59 C ATOM 1712 O LEU A 113 -0.269 16.053 71.373 1.00 19.80 O ATOM 1713 CB LEU A 113 -3.294 17.646 71.449 1.00 20.69 C ATOM 1714 CG LEU A 113 -2.971 17.941 69.981 1.00 20.75 C ATOM 1715 CD1 LEU A 113 -3.106 16.661 69.142 1.00 20.17 C ATOM 1716 CD2 LEU A 113 -3.903 19.033 69.474 1.00 19.58 C ATOM 1717 HA LEU A 113 -2.698 15.569 71.573 1.00 0.00 H ATOM 1718 HB2 LEU A 113 -4.355 17.406 71.512 1.00 0.00 H ATOM 1719 HB3 LEU A 113 -3.093 18.553 72.020 1.00 0.00 H ATOM 1720 HG LEU A 113 -1.942 18.289 69.891 1.00 0.00 H ATOM 1721 HD21 LEU A 113 -4.936 18.697 69.562 1.00 0.00 H ATOM 1722 HD22 LEU A 113 -3.761 19.935 70.069 1.00 0.00 H ATOM 1723 HD23 LEU A 113 -3.676 19.246 68.429 1.00 0.00 H ATOM 1724 HD11 LEU A 113 -2.413 15.908 69.517 1.00 0.00 H ATOM 1725 HD12 LEU A 113 -4.127 16.286 69.216 1.00 0.00 H ATOM 1726 HD13 LEU A 113 -2.874 16.884 68.101 1.00 0.00 H ATOM 1727 H LEU A 113 -3.752 16.923 73.839 1.00 0.00 H ATOM 1728 N PHE A 114 -0.583 17.835 72.718 1.00 20.28 N ATOM 1729 CA PHE A 114 0.826 18.219 72.757 1.00 20.31 C ATOM 1730 C PHE A 114 1.766 17.023 72.978 1.00 20.68 C ATOM 1731 O PHE A 114 2.594 16.700 72.124 1.00 19.94 O ATOM 1732 CB PHE A 114 1.041 19.248 73.869 1.00 20.07 C ATOM 1733 CG PHE A 114 2.487 19.462 74.230 1.00 20.29 C ATOM 1734 CD1 PHE A 114 3.361 20.082 73.335 1.00 19.12 C ATOM 1735 CD2 PHE A 114 2.982 19.016 75.457 1.00 19.58 C ATOM 1736 CE1 PHE A 114 4.703 20.253 73.654 1.00 18.92 C ATOM 1737 CE2 PHE A 114 4.325 19.182 75.786 1.00 19.25 C ATOM 1738 CZ PHE A 114 5.188 19.801 74.881 1.00 19.60 C ATOM 1739 HA PHE A 114 1.071 18.644 71.784 1.00 0.00 H ATOM 1740 HB2 PHE A 114 0.624 20.200 73.541 1.00 0.00 H ATOM 1741 HB3 PHE A 114 0.511 18.908 74.759 1.00 0.00 H ATOM 1742 HD2 PHE A 114 2.310 18.532 76.166 1.00 0.00 H ATOM 1743 HE2 PHE A 114 4.701 18.830 76.747 1.00 0.00 H ATOM 1744 HZ PHE A 114 6.240 19.931 75.133 1.00 0.00 H ATOM 1745 HE1 PHE A 114 5.375 20.739 72.947 1.00 0.00 H ATOM 1746 HD1 PHE A 114 2.986 20.436 72.375 1.00 0.00 H ATOM 1747 H PHE A 114 -1.273 18.409 73.243 1.00 0.00 H ATOM 1748 N LEU A 115 1.643 16.378 74.133 1.00 21.02 N ATOM 1749 CA LEU A 115 2.486 15.228 74.450 1.00 21.96 C ATOM 1750 C LEU A 115 2.459 14.155 73.361 1.00 21.87 C ATOM 1751 O LEU A 115 3.503 13.671 72.917 1.00 21.85 O ATOM 1752 CB LEU A 115 2.060 14.619 75.788 1.00 22.18 C ATOM 1753 CG LEU A 115 2.522 15.394 77.024 1.00 21.78 C ATOM 1754 CD1 LEU A 115 1.866 14.807 78.265 1.00 21.82 C ATOM 1755 CD2 LEU A 115 4.047 15.340 77.121 1.00 20.04 C ATOM 1756 HA LEU A 115 3.511 15.595 74.515 1.00 0.00 H ATOM 1757 HB2 LEU A 115 0.971 14.569 75.806 1.00 0.00 H ATOM 1758 HB3 LEU A 115 2.470 13.611 75.847 1.00 0.00 H ATOM 1759 HG LEU A 115 2.224 16.439 76.944 1.00 0.00 H ATOM 1760 HD21 LEU A 115 4.368 14.302 77.202 1.00 0.00 H ATOM 1761 HD22 LEU A 115 4.483 15.788 76.228 1.00 0.00 H ATOM 1762 HD23 LEU A 115 4.374 15.893 78.002 1.00 0.00 H ATOM 1763 HD11 LEU A 115 0.783 14.882 78.172 1.00 0.00 H ATOM 1764 HD12 LEU A 115 2.151 13.760 78.364 1.00 0.00 H ATOM 1765 HD13 LEU A 115 2.196 15.360 79.145 1.00 0.00 H ATOM 1766 H LEU A 115 0.934 16.698 74.824 1.00 0.00 H ATOM 1767 N THR A 116 1.263 13.778 72.936 1.00 21.44 N ATOM 1768 CA THR A 116 1.136 12.774 71.900 1.00 21.44 C ATOM 1769 C THR A 116 1.886 13.259 70.660 1.00 21.47 C ATOM 1770 O THR A 116 2.659 12.511 70.047 1.00 21.06 O ATOM 1771 CB THR A 116 -0.341 12.549 71.537 1.00 21.72 C ATOM 1772 OG1 THR A 116 -1.093 12.283 72.729 1.00 21.03 O ATOM 1773 CG2 THR A 116 -0.477 11.370 70.588 1.00 21.92 C ATOM 1774 HA THR A 116 1.552 11.834 72.261 1.00 0.00 H ATOM 1775 HB THR A 116 -0.723 13.446 71.050 1.00 0.00 H ATOM 1776 HG1 THR A 116 -1.018 13.055 73.344 1.00 0.00 H ATOM 1777 HG23 THR A 116 0.093 11.568 69.680 1.00 0.00 H ATOM 1778 HG21 THR A 116 -0.094 10.471 71.070 1.00 0.00 H ATOM 1779 HG22 THR A 116 -1.528 11.228 70.335 1.00 0.00 H ATOM 1780 H THR A 116 0.409 14.206 73.349 1.00 0.00 H ATOM 1781 N ALA A 117 1.659 14.527 70.316 1.00 20.91 N ATOM 1782 CA ALA A 117 2.274 15.152 69.148 1.00 19.71 C ATOM 1783 C ALA A 117 3.797 15.153 69.197 1.00 19.15 C ATOM 1784 O ALA A 117 4.454 14.948 68.178 1.00 19.17 O ATOM 1785 CB ALA A 117 1.753 16.574 68.988 1.00 18.91 C ATOM 1786 HA ALA A 117 1.993 14.550 68.284 1.00 0.00 H ATOM 1787 HB1 ALA A 117 0.671 16.551 68.857 1.00 0.00 H ATOM 1788 HB2 ALA A 117 2.000 17.152 69.878 1.00 0.00 H ATOM 1789 HB3 ALA A 117 2.216 17.033 68.115 1.00 0.00 H ATOM 1790 H ALA A 117 1.017 15.095 70.904 1.00 0.00 H ATOM 1791 N VAL A 118 4.365 15.397 70.372 1.00 18.76 N ATOM 1792 CA VAL A 118 5.818 15.400 70.497 1.00 18.67 C ATOM 1793 C VAL A 118 6.330 14.014 70.107 1.00 18.52 C ATOM 1794 O VAL A 118 7.254 13.879 69.305 1.00 17.86 O ATOM 1795 CB VAL A 118 6.254 15.732 71.943 1.00 18.51 C ATOM 1796 CG1 VAL A 118 7.769 15.592 72.087 1.00 17.49 C ATOM 1797 CG2 VAL A 118 5.817 17.140 72.291 1.00 18.15 C ATOM 1798 HA VAL A 118 6.236 16.165 69.842 1.00 0.00 H ATOM 1799 HB VAL A 118 5.781 15.031 72.630 1.00 0.00 H ATOM 1800 HG11 VAL A 118 8.062 14.568 71.853 1.00 0.00 H ATOM 1801 HG12 VAL A 118 8.263 16.279 71.400 1.00 0.00 H ATOM 1802 HG13 VAL A 118 8.059 15.829 73.111 1.00 0.00 H ATOM 1803 HG21 VAL A 118 6.281 17.844 71.600 1.00 0.00 H ATOM 1804 HG22 VAL A 118 4.732 17.212 72.212 1.00 0.00 H ATOM 1805 HG23 VAL A 118 6.125 17.373 73.310 1.00 0.00 H ATOM 1806 H VAL A 118 3.772 15.586 71.205 1.00 0.00 H ATOM 1807 N HIS A 119 5.704 12.991 70.677 1.00 18.55 N ATOM 1808 CA HIS A 119 6.058 11.608 70.404 1.00 18.95 C ATOM 1809 C HIS A 119 5.884 11.295 68.910 1.00 19.29 C ATOM 1810 O HIS A 119 6.749 10.667 68.287 1.00 19.14 O ATOM 1811 CB HIS A 119 5.162 10.684 71.236 1.00 19.77 C ATOM 1812 CG HIS A 119 5.378 9.226 70.972 1.00 19.99 C ATOM 1813 ND1 HIS A 119 6.319 8.478 71.646 1.00 19.91 N ATOM 1814 CD2 HIS A 119 4.782 8.382 70.096 1.00 19.72 C ATOM 1815 CE1 HIS A 119 6.293 7.235 71.199 1.00 19.68 C ATOM 1816 NE2 HIS A 119 5.369 7.151 70.258 1.00 20.33 N ATOM 1817 HA HIS A 119 7.102 11.447 70.672 1.00 0.00 H ATOM 1818 HB2 HIS A 119 5.359 10.874 72.291 1.00 0.00 H ATOM 1819 HB3 HIS A 119 4.122 10.923 71.013 1.00 0.00 H ATOM 1820 HD2 HIS A 119 3.986 8.633 69.395 1.00 0.00 H ATOM 1821 HE1 HIS A 119 6.926 6.418 71.547 1.00 0.00 H ATOM 1822 H HIS A 119 4.931 13.187 71.344 1.00 0.00 H ATOM 1823 N GLU A 120 4.763 11.733 68.340 1.00 19.08 N ATOM 1824 CA GLU A 120 4.483 11.488 66.927 1.00 18.58 C ATOM 1825 C GLU A 120 5.476 12.174 66.000 1.00 18.39 C ATOM 1826 O GLU A 120 5.982 11.558 65.061 1.00 17.84 O ATOM 1827 CB GLU A 120 3.060 11.927 66.581 1.00 18.99 C ATOM 1828 CG GLU A 120 1.997 11.036 67.203 1.00 20.07 C ATOM 1829 CD GLU A 120 2.323 9.562 67.030 1.00 20.36 C ATOM 1830 OE1 GLU A 120 2.504 9.130 65.875 1.00 20.55 O ATOM 1831 OE2 GLU A 120 2.408 8.837 68.046 1.00 20.66 O ATOM 1832 HA GLU A 120 4.586 10.414 66.771 1.00 0.00 H ATOM 1833 HB2 GLU A 120 2.913 12.946 66.940 1.00 0.00 H ATOM 1834 HB3 GLU A 120 2.943 11.904 65.498 1.00 0.00 H ATOM 1835 HG2 GLU A 120 1.928 11.260 68.268 1.00 0.00 H ATOM 1836 HG3 GLU A 120 1.039 11.244 66.726 1.00 0.00 H ATOM 1837 H GLU A 120 4.073 12.260 68.912 1.00 0.00 H ATOM 1838 N ILE A 121 5.759 13.446 66.264 1.00 18.20 N ATOM 1839 CA ILE A 121 6.703 14.178 65.439 1.00 18.11 C ATOM 1840 C ILE A 121 8.078 13.518 65.515 1.00 18.49 C ATOM 1841 O ILE A 121 8.895 13.641 64.601 1.00 18.61 O ATOM 1842 CB ILE A 121 6.789 15.641 65.875 1.00 18.40 C ATOM 1843 CG1 ILE A 121 5.421 16.305 65.684 1.00 17.71 C ATOM 1844 CG2 ILE A 121 7.866 16.367 65.060 1.00 17.78 C ATOM 1845 CD1 ILE A 121 5.348 17.734 66.180 1.00 17.16 C ATOM 1846 HA ILE A 121 6.353 14.155 64.407 1.00 0.00 H ATOM 1847 HB ILE A 121 7.065 15.697 66.928 1.00 0.00 H ATOM 1848 HG12 ILE A 121 5.184 16.300 64.620 1.00 0.00 H ATOM 1849 HG13 ILE A 121 4.678 15.718 66.223 1.00 0.00 H ATOM 1850 HD11 ILE A 121 5.569 17.759 67.247 1.00 0.00 H ATOM 1851 HD12 ILE A 121 6.076 18.341 65.643 1.00 0.00 H ATOM 1852 HD13 ILE A 121 4.346 18.127 66.006 1.00 0.00 H ATOM 1853 HG21 ILE A 121 8.830 15.885 65.224 1.00 0.00 H ATOM 1854 HG22 ILE A 121 7.611 16.321 64.001 1.00 0.00 H ATOM 1855 HG23 ILE A 121 7.920 17.408 65.378 1.00 0.00 H ATOM 1856 H ILE A 121 5.300 13.920 67.068 1.00 0.00 H ATOM 1857 N GLY A 122 8.325 12.808 66.609 1.00 19.19 N ATOM 1858 CA GLY A 122 9.587 12.109 66.759 1.00 19.28 C ATOM 1859 C GLY A 122 9.676 11.073 65.655 1.00 19.39 C ATOM 1860 O GLY A 122 10.747 10.828 65.097 1.00 19.25 O ATOM 1861 HA3 GLY A 122 9.627 11.619 67.732 1.00 0.00 H ATOM 1862 HA2 GLY A 122 10.414 12.814 66.674 1.00 0.00 H ATOM 1863 H GLY A 122 7.610 12.753 67.362 1.00 0.00 H ATOM 1864 N HIS A 123 8.540 10.460 65.336 1.00 19.57 N ATOM 1865 CA HIS A 123 8.494 9.465 64.273 1.00 19.87 C ATOM 1866 C HIS A 123 8.644 10.173 62.933 1.00 19.67 C ATOM 1867 O HIS A 123 9.405 9.728 62.073 1.00 19.71 O ATOM 1868 CB HIS A 123 7.173 8.688 64.304 1.00 20.38 C ATOM 1869 CG HIS A 123 7.067 7.716 65.439 1.00 20.63 C ATOM 1870 ND1 HIS A 123 8.069 6.819 65.747 1.00 20.69 N ATOM 1871 CD2 HIS A 123 6.061 7.470 66.311 1.00 20.66 C ATOM 1872 CE1 HIS A 123 7.684 6.062 66.758 1.00 20.70 C ATOM 1873 NE2 HIS A 123 6.469 6.435 67.119 1.00 20.69 N ATOM 1874 HA HIS A 123 9.307 8.753 64.417 1.00 0.00 H ATOM 1875 HB2 HIS A 123 6.355 9.404 64.387 1.00 0.00 H ATOM 1876 HB3 HIS A 123 7.077 8.136 63.369 1.00 0.00 H ATOM 1877 HD2 HIS A 123 5.107 7.994 66.363 1.00 0.00 H ATOM 1878 HE1 HIS A 123 8.269 5.265 67.217 1.00 0.00 H ATOM 1879 H HIS A 123 7.669 10.695 65.854 1.00 0.00 H ATOM 1880 N SER A 124 7.923 11.281 62.769 1.00 19.14 N ATOM 1881 CA SER A 124 7.984 12.065 61.537 1.00 19.24 C ATOM 1882 C SER A 124 9.429 12.385 61.178 1.00 19.72 C ATOM 1883 O SER A 124 9.779 12.464 59.997 1.00 19.83 O ATOM 1884 CB SER A 124 7.223 13.389 61.684 1.00 18.14 C ATOM 1885 OG SER A 124 5.851 13.183 61.953 1.00 17.85 O ATOM 1886 HA SER A 124 7.525 11.465 60.751 1.00 0.00 H ATOM 1887 HB2 SER A 124 7.319 13.956 60.758 1.00 0.00 H ATOM 1888 HB3 SER A 124 7.661 13.958 62.504 1.00 0.00 H ATOM 1889 HG SER A 124 5.443 12.672 61.210 1.00 0.00 H ATOM 1890 H SER A 124 7.299 11.597 63.539 1.00 0.00 H ATOM 1891 N LEU A 125 10.266 12.564 62.198 1.00 19.78 N ATOM 1892 CA LEU A 125 11.663 12.902 61.973 1.00 20.17 C ATOM 1893 C LEU A 125 12.618 11.710 61.840 1.00 21.17 C ATOM 1894 O LEU A 125 13.802 11.892 61.543 1.00 21.87 O ATOM 1895 CB LEU A 125 12.134 13.842 63.077 1.00 19.75 C ATOM 1896 CG LEU A 125 11.236 15.074 63.221 1.00 20.25 C ATOM 1897 CD1 LEU A 125 11.706 15.914 64.395 1.00 20.43 C ATOM 1898 CD2 LEU A 125 11.249 15.888 61.928 1.00 19.86 C ATOM 1899 HA LEU A 125 11.698 13.386 60.997 1.00 0.00 H ATOM 1900 HB2 LEU A 125 12.136 13.299 64.022 1.00 0.00 H ATOM 1901 HB3 LEU A 125 13.147 14.172 62.847 1.00 0.00 H ATOM 1902 HG LEU A 125 10.211 14.755 63.410 1.00 0.00 H ATOM 1903 HD21 LEU A 125 12.268 16.211 61.713 1.00 0.00 H ATOM 1904 HD22 LEU A 125 10.882 15.271 61.108 1.00 0.00 H ATOM 1905 HD23 LEU A 125 10.607 16.761 62.043 1.00 0.00 H ATOM 1906 HD11 LEU A 125 11.656 15.320 65.308 1.00 0.00 H ATOM 1907 HD12 LEU A 125 12.734 16.233 64.223 1.00 0.00 H ATOM 1908 HD13 LEU A 125 11.064 16.789 64.494 1.00 0.00 H ATOM 1909 H LEU A 125 9.915 12.460 63.172 1.00 0.00 H ATOM 1910 N GLY A 126 12.124 10.494 62.062 1.00 21.09 N ATOM 1911 CA GLY A 126 12.991 9.339 61.909 1.00 21.07 C ATOM 1912 C GLY A 126 13.340 8.553 63.156 1.00 21.36 C ATOM 1913 O GLY A 126 14.147 7.626 63.097 1.00 20.79 O ATOM 1914 HA3 GLY A 126 13.926 9.689 61.471 1.00 0.00 H ATOM 1915 HA2 GLY A 126 12.502 8.653 61.217 1.00 0.00 H ATOM 1916 H GLY A 126 11.130 10.373 62.342 1.00 0.00 H ATOM 1917 N LEU A 127 12.747 8.918 64.287 1.00 22.17 N ATOM 1918 CA LEU A 127 13.001 8.209 65.539 1.00 22.05 C ATOM 1919 C LEU A 127 12.028 7.065 65.745 1.00 21.69 C ATOM 1920 O LEU A 127 10.840 7.175 65.423 1.00 21.68 O ATOM 1921 CB LEU A 127 12.894 9.152 66.744 1.00 22.10 C ATOM 1922 CG LEU A 127 14.107 10.013 67.098 1.00 22.25 C ATOM 1923 CD1 LEU A 127 13.822 10.756 68.404 1.00 21.97 C ATOM 1924 CD2 LEU A 127 15.347 9.131 67.236 1.00 21.03 C ATOM 1925 HA LEU A 127 14.014 7.814 65.465 1.00 0.00 H ATOM 1926 HB2 LEU A 127 12.062 9.829 66.552 1.00 0.00 H ATOM 1927 HB3 LEU A 127 12.668 8.538 67.616 1.00 0.00 H ATOM 1928 HG LEU A 127 14.294 10.739 66.307 1.00 0.00 H ATOM 1929 HD21 LEU A 127 15.183 8.397 68.025 1.00 0.00 H ATOM 1930 HD22 LEU A 127 15.533 8.617 66.293 1.00 0.00 H ATOM 1931 HD23 LEU A 127 16.207 9.752 67.488 1.00 0.00 H ATOM 1932 HD11 LEU A 127 12.944 11.389 68.276 1.00 0.00 H ATOM 1933 HD12 LEU A 127 13.637 10.033 69.199 1.00 0.00 H ATOM 1934 HD13 LEU A 127 14.682 11.373 68.665 1.00 0.00 H ATOM 1935 H LEU A 127 12.089 9.724 64.281 1.00 0.00 H ATOM 1936 N GLY A 128 12.548 5.968 66.285 1.00 21.52 N ATOM 1937 CA GLY A 128 11.722 4.813 66.573 1.00 21.82 C ATOM 1938 C GLY A 128 11.379 4.830 68.054 1.00 22.15 C ATOM 1939 O GLY A 128 11.446 5.876 68.707 1.00 21.63 O ATOM 1940 HA3 GLY A 128 12.266 3.900 66.331 1.00 0.00 H ATOM 1941 HA2 GLY A 128 10.807 4.857 65.982 1.00 0.00 H ATOM 1942 H GLY A 128 13.564 5.938 66.504 1.00 0.00 H ATOM 1943 N HIS A 129 11.018 3.677 68.599 1.00 22.70 N ATOM 1944 CA HIS A 129 10.682 3.612 70.009 1.00 22.77 C ATOM 1945 C HIS A 129 11.903 3.363 70.883 1.00 23.82 C ATOM 1946 O HIS A 129 12.791 2.564 70.551 1.00 24.30 O ATOM 1947 CB HIS A 129 9.602 2.557 70.241 1.00 21.09 C ATOM 1948 CG HIS A 129 8.234 3.019 69.848 1.00 20.88 C ATOM 1949 ND1 HIS A 129 7.173 2.157 69.676 1.00 20.77 N ATOM 1950 CD2 HIS A 129 7.751 4.261 69.602 1.00 20.30 C ATOM 1951 CE1 HIS A 129 6.097 2.848 69.340 1.00 20.29 C ATOM 1952 NE2 HIS A 129 6.421 4.126 69.288 1.00 19.79 N ATOM 1953 HA HIS A 129 10.289 4.585 70.304 1.00 0.00 H ATOM 1954 HB2 HIS A 129 9.851 1.672 69.656 1.00 0.00 H ATOM 1955 HB3 HIS A 129 9.590 2.300 71.300 1.00 0.00 H ATOM 1956 HD2 HIS A 129 8.314 5.194 69.645 1.00 0.00 H ATOM 1957 HE1 HIS A 129 5.109 2.432 69.140 1.00 0.00 H ATOM 1958 H HIS A 129 10.976 2.817 68.015 1.00 0.00 H ATOM 1959 N SER A 130 11.947 4.082 71.998 1.00 24.27 N ATOM 1960 CA SER A 130 13.045 3.978 72.939 1.00 24.40 C ATOM 1961 C SER A 130 12.733 2.960 74.026 1.00 24.98 C ATOM 1962 O SER A 130 11.568 2.739 74.379 1.00 24.50 O ATOM 1963 CB SER A 130 13.309 5.348 73.570 1.00 23.28 C ATOM 1964 OG SER A 130 14.311 5.266 74.561 1.00 23.37 O ATOM 1965 HA SER A 130 13.933 3.644 72.402 1.00 0.00 H ATOM 1966 HB2 SER A 130 12.388 5.715 74.024 1.00 0.00 H ATOM 1967 HB3 SER A 130 13.632 6.042 72.794 1.00 0.00 H ATOM 1968 HG SER A 130 14.461 6.163 74.952 1.00 0.00 H ATOM 1969 H SER A 130 11.169 4.741 72.203 1.00 0.00 H ATOM 1970 N SER A 131 13.783 2.329 74.542 1.00 25.57 N ATOM 1971 CA SER A 131 13.634 1.357 75.621 1.00 26.09 C ATOM 1972 C SER A 131 13.734 2.113 76.951 1.00 26.10 C ATOM 1973 O SER A 131 13.379 1.587 78.003 1.00 25.73 O ATOM 1974 CB SER A 131 14.734 0.303 75.537 1.00 26.04 C ATOM 1975 OG SER A 131 16.013 0.911 75.600 1.00 26.65 O ATOM 1976 HA SER A 131 12.672 0.850 75.542 1.00 0.00 H ATOM 1977 HB2 SER A 131 14.640 -0.239 74.596 1.00 0.00 H ATOM 1978 HB3 SER A 131 14.627 -0.394 76.368 1.00 0.00 H ATOM 1979 HG SER A 131 16.115 1.542 74.844 1.00 0.00 H ATOM 1980 H SER A 131 14.732 2.532 74.169 1.00 0.00 H ATOM 1981 N ASP A 132 14.220 3.353 76.882 1.00 26.37 N ATOM 1982 CA ASP A 132 14.365 4.211 78.050 1.00 26.44 C ATOM 1983 C ASP A 132 12.968 4.677 78.444 1.00 27.05 C ATOM 1984 O ASP A 132 12.339 5.458 77.729 1.00 27.42 O ATOM 1985 CB ASP A 132 15.230 5.423 77.706 1.00 27.05 C ATOM 1986 CG ASP A 132 15.572 6.269 78.930 1.00 28.19 C ATOM 1987 OD1 ASP A 132 14.722 6.397 79.838 1.00 27.73 O ATOM 1988 OD2 ASP A 132 16.693 6.821 78.976 1.00 29.07 O ATOM 1989 HA ASP A 132 14.843 3.670 78.866 1.00 0.00 H ATOM 1990 HB2 ASP A 132 16.158 5.073 77.254 1.00 0.00 H ATOM 1991 HB3 ASP A 132 14.691 6.045 76.991 1.00 0.00 H ATOM 1992 H ASP A 132 14.508 3.723 75.954 1.00 0.00 H ATOM 1993 N PRO A 133 12.467 4.214 79.597 1.00 27.20 N ATOM 1994 CA PRO A 133 11.131 4.584 80.078 1.00 27.48 C ATOM 1995 C PRO A 133 10.866 6.063 80.340 1.00 27.97 C ATOM 1996 O PRO A 133 9.715 6.478 80.438 1.00 28.48 O ATOM 1997 CB PRO A 133 10.973 3.735 81.335 1.00 26.79 C ATOM 1998 CG PRO A 133 12.370 3.606 81.822 1.00 26.69 C ATOM 1999 CD PRO A 133 13.143 3.332 80.560 1.00 26.37 C ATOM 2000 HA PRO A 133 10.392 4.396 79.299 1.00 0.00 H ATOM 2001 HD3 PRO A 133 14.194 3.598 80.672 1.00 0.00 H ATOM 2002 HD2 PRO A 133 13.063 2.286 80.264 1.00 0.00 H ATOM 2003 HG3 PRO A 133 12.465 2.780 82.527 1.00 0.00 H ATOM 2004 HG2 PRO A 133 12.707 4.528 82.296 1.00 0.00 H ATOM 2005 HB2 PRO A 133 10.345 4.236 82.071 1.00 0.00 H ATOM 2006 HB3 PRO A 133 10.547 2.760 81.100 1.00 0.00 H ATOM 2007 N LYS A 134 11.914 6.866 80.459 1.00 28.83 N ATOM 2008 CA LYS A 134 11.705 8.283 80.711 1.00 29.31 C ATOM 2009 C LYS A 134 11.825 9.131 79.447 1.00 28.12 C ATOM 2010 O LYS A 134 11.714 10.354 79.495 1.00 27.68 O ATOM 2011 CB LYS A 134 12.659 8.774 81.810 1.00 31.32 C ATOM 2012 CG LYS A 134 14.109 8.389 81.623 1.00 34.18 C ATOM 2013 CD LYS A 134 14.927 8.721 82.865 1.00 36.42 C ATOM 2014 CE LYS A 134 16.380 8.313 82.678 1.00 38.45 C ATOM 2015 NZ LYS A 134 17.196 8.610 83.892 1.00 41.08 N ATOM 2016 HA LYS A 134 10.679 8.404 81.058 1.00 0.00 H ATOM 2017 HB2 LYS A 134 12.601 9.862 81.846 1.00 0.00 H ATOM 2018 HB3 LYS A 134 12.320 8.361 82.760 1.00 0.00 H ATOM 2019 HG2 LYS A 134 14.172 7.318 81.430 1.00 0.00 H ATOM 2020 HG3 LYS A 134 14.516 8.934 80.772 1.00 0.00 H ATOM 2021 HD2 LYS A 134 14.878 9.794 83.050 1.00 0.00 H ATOM 2022 HD3 LYS A 134 14.512 8.187 83.720 1.00 0.00 H ATOM 2023 HE2 LYS A 134 16.795 8.859 81.831 1.00 0.00 H ATOM 2024 HE3 LYS A 134 16.424 7.243 82.475 1.00 0.00 H ATOM 2025 HZ1 LYS A 134 17.164 9.631 84.088 1.00 0.00 H ATOM 2026 HZ2 LYS A 134 16.810 8.087 84.704 1.00 0.00 H ATOM 2027 HZ3 LYS A 134 18.180 8.318 83.726 1.00 0.00 H ATOM 2028 H LYS A 134 12.878 6.486 80.373 1.00 0.00 H ATOM 2029 N ALA A 135 12.036 8.471 78.312 1.00 26.97 N ATOM 2030 CA ALA A 135 12.133 9.165 77.033 1.00 26.00 C ATOM 2031 C ALA A 135 10.726 9.375 76.473 1.00 25.35 C ATOM 2032 O ALA A 135 9.842 8.541 76.671 1.00 25.53 O ATOM 2033 CB ALA A 135 12.962 8.346 76.053 1.00 25.58 C ATOM 2034 HA ALA A 135 12.620 10.129 77.179 1.00 0.00 H ATOM 2035 HB1 ALA A 135 13.963 8.201 76.458 1.00 0.00 H ATOM 2036 HB2 ALA A 135 12.488 7.377 75.899 1.00 0.00 H ATOM 2037 HB3 ALA A 135 13.026 8.876 75.102 1.00 0.00 H ATOM 2038 H ALA A 135 12.134 7.436 78.337 1.00 0.00 H ATOM 2039 N VAL A 136 10.516 10.486 75.774 1.00 24.72 N ATOM 2040 CA VAL A 136 9.204 10.769 75.197 1.00 23.60 C ATOM 2041 C VAL A 136 8.879 9.728 74.125 1.00 23.43 C ATOM 2042 O VAL A 136 7.709 9.450 73.852 1.00 22.72 O ATOM 2043 CB VAL A 136 9.137 12.204 74.573 1.00 22.48 C ATOM 2044 CG1 VAL A 136 9.964 12.276 73.297 1.00 21.09 C ATOM 2045 CG2 VAL A 136 7.688 12.591 74.311 1.00 21.14 C ATOM 2046 HA VAL A 136 8.470 10.721 76.001 1.00 0.00 H ATOM 2047 HB VAL A 136 9.560 12.916 75.282 1.00 0.00 H ATOM 2048 HG11 VAL A 136 11.003 12.039 73.525 1.00 0.00 H ATOM 2049 HG12 VAL A 136 9.577 11.559 72.574 1.00 0.00 H ATOM 2050 HG13 VAL A 136 9.902 13.282 72.882 1.00 0.00 H ATOM 2051 HG21 VAL A 136 7.242 11.877 73.618 1.00 0.00 H ATOM 2052 HG22 VAL A 136 7.135 12.582 75.250 1.00 0.00 H ATOM 2053 HG23 VAL A 136 7.653 13.590 73.877 1.00 0.00 H ATOM 2054 H VAL A 136 11.295 11.162 75.636 1.00 0.00 H ATOM 2055 N MET A 137 9.920 9.149 73.530 1.00 23.37 N ATOM 2056 CA MET A 137 9.736 8.141 72.495 1.00 23.95 C ATOM 2057 C MET A 137 9.468 6.753 73.069 1.00 24.38 C ATOM 2058 O MET A 137 9.464 5.768 72.339 1.00 24.54 O ATOM 2059 CB MET A 137 10.948 8.090 71.561 1.00 24.15 C ATOM 2060 CG MET A 137 11.102 9.320 70.669 1.00 24.54 C ATOM 2061 SD MET A 137 9.540 9.897 69.942 1.00 24.76 S ATOM 2062 CE MET A 137 9.120 8.522 68.829 1.00 24.43 C ATOM 2063 HA MET A 137 8.854 8.439 71.928 1.00 0.00 H ATOM 2064 HB2 MET A 137 11.846 7.995 72.171 1.00 0.00 H ATOM 2065 HB3 MET A 137 10.850 7.213 70.921 1.00 0.00 H ATOM 2066 HG2 MET A 137 11.789 9.074 69.859 1.00 0.00 H ATOM 2067 HG3 MET A 137 11.523 10.128 71.267 1.00 0.00 H ATOM 2068 HE1 MET A 137 9.915 8.395 68.094 1.00 0.00 H ATOM 2069 HE2 MET A 137 9.011 7.606 69.410 1.00 0.00 H ATOM 2070 HE3 MET A 137 8.183 8.743 68.318 1.00 0.00 H ATOM 2071 H MET A 137 10.884 9.422 73.810 1.00 0.00 H ATOM 2072 N PHE A 138 9.255 6.674 74.379 1.00 24.66 N ATOM 2073 CA PHE A 138 8.941 5.405 75.018 1.00 24.32 C ATOM 2074 C PHE A 138 7.511 5.094 74.555 1.00 24.29 C ATOM 2075 O PHE A 138 6.648 5.962 74.569 1.00 24.12 O ATOM 2076 CB PHE A 138 8.997 5.555 76.538 1.00 24.20 C ATOM 2077 CG PHE A 138 9.013 4.249 77.271 1.00 23.97 C ATOM 2078 CD1 PHE A 138 10.069 3.360 77.100 1.00 23.58 C ATOM 2079 CD2 PHE A 138 7.965 3.896 78.118 1.00 23.90 C ATOM 2080 CE1 PHE A 138 10.085 2.135 77.759 1.00 23.40 C ATOM 2081 CE2 PHE A 138 7.968 2.672 78.783 1.00 23.91 C ATOM 2082 CZ PHE A 138 9.031 1.789 78.602 1.00 23.66 C ATOM 2083 HA PHE A 138 9.642 4.613 74.756 1.00 0.00 H ATOM 2084 HB2 PHE A 138 9.901 6.106 76.797 1.00 0.00 H ATOM 2085 HB3 PHE A 138 8.123 6.121 76.861 1.00 0.00 H ATOM 2086 HD2 PHE A 138 7.133 4.585 78.262 1.00 0.00 H ATOM 2087 HE2 PHE A 138 7.142 2.406 79.443 1.00 0.00 H ATOM 2088 HZ PHE A 138 9.038 0.829 79.119 1.00 0.00 H ATOM 2089 HE1 PHE A 138 10.919 1.448 77.616 1.00 0.00 H ATOM 2090 HD1 PHE A 138 10.895 3.627 76.441 1.00 0.00 H ATOM 2091 H PHE A 138 9.314 7.536 74.958 1.00 0.00 H ATOM 2092 N PRO A 139 7.242 3.850 74.144 1.00 24.70 N ATOM 2093 CA PRO A 139 5.914 3.443 73.664 1.00 24.95 C ATOM 2094 C PRO A 139 4.710 3.646 74.584 1.00 25.00 C ATOM 2095 O PRO A 139 3.578 3.392 74.184 1.00 25.24 O ATOM 2096 CB PRO A 139 6.110 1.963 73.311 1.00 25.16 C ATOM 2097 CG PRO A 139 7.574 1.863 73.020 1.00 25.25 C ATOM 2098 CD PRO A 139 8.178 2.716 74.103 1.00 25.02 C ATOM 2099 HA PRO A 139 5.627 4.097 72.841 1.00 0.00 H ATOM 2100 HD3 PRO A 139 8.206 2.188 75.056 1.00 0.00 H ATOM 2101 HD2 PRO A 139 9.185 3.040 73.839 1.00 0.00 H ATOM 2102 HG3 PRO A 139 7.808 2.257 72.031 1.00 0.00 H ATOM 2103 HG2 PRO A 139 7.921 0.832 73.090 1.00 0.00 H ATOM 2104 HB2 PRO A 139 5.835 1.323 74.149 1.00 0.00 H ATOM 2105 HB3 PRO A 139 5.519 1.689 72.437 1.00 0.00 H ATOM 2106 N THR A 140 4.928 4.110 75.805 1.00 25.27 N ATOM 2107 CA THR A 140 3.803 4.282 76.716 1.00 25.22 C ATOM 2108 C THR A 140 3.364 5.721 76.948 1.00 25.18 C ATOM 2109 O THR A 140 4.176 6.591 77.264 1.00 25.45 O ATOM 2110 CB THR A 140 4.110 3.650 78.080 1.00 25.33 C ATOM 2111 OG1 THR A 140 4.520 2.291 77.890 1.00 25.58 O ATOM 2112 CG2 THR A 140 2.879 3.692 78.971 1.00 24.11 C ATOM 2113 HA THR A 140 2.977 3.780 76.213 1.00 0.00 H ATOM 2114 HB THR A 140 4.910 4.213 78.561 1.00 0.00 H ATOM 2115 HG1 THR A 140 4.719 1.881 78.769 1.00 0.00 H ATOM 2116 HG23 THR A 140 2.570 4.728 79.113 1.00 0.00 H ATOM 2117 HG21 THR A 140 2.071 3.132 78.499 1.00 0.00 H ATOM 2118 HG22 THR A 140 3.116 3.246 79.937 1.00 0.00 H ATOM 2119 H THR A 140 5.893 4.349 76.111 1.00 0.00 H ATOM 2120 N TYR A 141 2.068 5.961 76.788 1.00 24.76 N ATOM 2121 CA TYR A 141 1.511 7.287 77.005 1.00 24.61 C ATOM 2122 C TYR A 141 1.358 7.505 78.501 1.00 24.82 C ATOM 2123 O TYR A 141 0.860 6.637 79.220 1.00 25.02 O ATOM 2124 CB TYR A 141 0.134 7.421 76.355 1.00 24.73 C ATOM 2125 CG TYR A 141 -0.547 8.731 76.693 1.00 24.31 C ATOM 2126 CD1 TYR A 141 -0.286 9.885 75.958 1.00 24.13 C ATOM 2127 CD2 TYR A 141 -1.402 8.830 77.791 1.00 23.98 C ATOM 2128 CE1 TYR A 141 -0.858 11.112 76.312 1.00 24.23 C ATOM 2129 CE2 TYR A 141 -1.976 10.050 78.152 1.00 24.28 C ATOM 2130 CZ TYR A 141 -1.699 11.185 77.407 1.00 23.72 C ATOM 2131 OH TYR A 141 -2.269 12.387 77.752 1.00 23.34 O ATOM 2132 HA TYR A 141 2.181 8.024 76.561 1.00 0.00 H ATOM 2133 HB3 TYR A 141 -0.496 6.601 76.700 1.00 0.00 H ATOM 2134 HB2 TYR A 141 0.251 7.357 75.273 1.00 0.00 H ATOM 2135 HD2 TYR A 141 -1.626 7.939 78.377 1.00 0.00 H ATOM 2136 HE2 TYR A 141 -2.639 10.110 79.015 1.00 0.00 H ATOM 2137 HE1 TYR A 141 -0.642 12.006 75.727 1.00 0.00 H ATOM 2138 HD1 TYR A 141 0.375 9.831 75.093 1.00 0.00 H ATOM 2139 HH TYR A 141 -3.255 12.307 77.712 1.00 0.00 H ATOM 2140 H TYR A 141 1.438 5.185 76.502 1.00 0.00 H ATOM 2141 N LYS A 142 1.771 8.674 78.964 1.00 24.50 N ATOM 2142 CA LYS A 142 1.675 9.006 80.375 1.00 24.37 C ATOM 2143 C LYS A 142 1.683 10.523 80.538 1.00 24.30 C ATOM 2144 O LYS A 142 2.676 11.187 80.227 1.00 24.82 O ATOM 2145 CB LYS A 142 2.851 8.388 81.114 1.00 24.70 C ATOM 2146 CG LYS A 142 3.001 8.825 82.543 1.00 26.79 C ATOM 2147 CD LYS A 142 4.299 8.276 83.087 1.00 29.62 C ATOM 2148 CE LYS A 142 4.611 8.816 84.461 1.00 31.68 C ATOM 2149 NZ LYS A 142 5.899 8.242 84.958 1.00 34.28 N ATOM 2150 HA LYS A 142 0.748 8.612 80.790 1.00 0.00 H ATOM 2151 HB2 LYS A 142 2.727 7.305 81.102 1.00 0.00 H ATOM 2152 HB3 LYS A 142 3.764 8.654 80.581 1.00 0.00 H ATOM 2153 HG2 LYS A 142 3.014 9.914 82.594 1.00 0.00 H ATOM 2154 HG3 LYS A 142 2.167 8.445 83.132 1.00 0.00 H ATOM 2155 HD2 LYS A 142 4.225 7.190 83.144 1.00 0.00 H ATOM 2156 HD3 LYS A 142 5.108 8.549 82.409 1.00 0.00 H ATOM 2157 HE2 LYS A 142 3.807 8.546 85.146 1.00 0.00 H ATOM 2158 HE3 LYS A 142 4.695 9.902 84.412 1.00 0.00 H ATOM 2159 HZ1 LYS A 142 5.819 7.206 85.008 1.00 0.00 H ATOM 2160 HZ2 LYS A 142 6.667 8.501 84.306 1.00 0.00 H ATOM 2161 HZ3 LYS A 142 6.104 8.621 85.905 1.00 0.00 H ATOM 2162 H LYS A 142 2.173 9.370 78.304 1.00 0.00 H ATOM 2163 N TYR A 143 0.574 11.079 81.008 1.00 23.60 N ATOM 2164 CA TYR A 143 0.507 12.517 81.190 1.00 23.46 C ATOM 2165 C TYR A 143 1.499 12.997 82.235 1.00 23.89 C ATOM 2166 O TYR A 143 1.653 12.391 83.298 1.00 24.23 O ATOM 2167 CB TYR A 143 -0.900 12.950 81.594 1.00 23.42 C ATOM 2168 CG TYR A 143 -1.032 14.447 81.750 1.00 24.03 C ATOM 2169 CD1 TYR A 143 -0.705 15.079 82.948 1.00 23.60 C ATOM 2170 CD2 TYR A 143 -1.435 15.241 80.675 1.00 24.33 C ATOM 2171 CE1 TYR A 143 -0.776 16.464 83.071 1.00 24.00 C ATOM 2172 CE2 TYR A 143 -1.507 16.627 80.788 1.00 24.33 C ATOM 2173 CZ TYR A 143 -1.178 17.232 81.985 1.00 24.42 C ATOM 2174 OH TYR A 143 -1.262 18.601 82.095 1.00 25.01 O ATOM 2175 HA TYR A 143 0.764 12.970 80.233 1.00 0.00 H ATOM 2176 HB3 TYR A 143 -1.150 12.478 82.544 1.00 0.00 H ATOM 2177 HB2 TYR A 143 -1.600 12.617 80.828 1.00 0.00 H ATOM 2178 HD2 TYR A 143 -1.698 14.767 79.729 1.00 0.00 H ATOM 2179 HE2 TYR A 143 -1.821 17.231 79.937 1.00 0.00 H ATOM 2180 HE1 TYR A 143 -0.517 16.944 84.015 1.00 0.00 H ATOM 2181 HD1 TYR A 143 -0.389 14.480 83.802 1.00 0.00 H ATOM 2182 HH TYR A 143 -0.995 18.875 83.008 1.00 0.00 H ATOM 2183 H TYR A 143 -0.246 10.485 81.246 1.00 0.00 H ATOM 2184 N VAL A 144 2.188 14.083 81.908 1.00 24.43 N ATOM 2185 CA VAL A 144 3.158 14.694 82.806 1.00 25.42 C ATOM 2186 C VAL A 144 2.900 16.192 82.715 1.00 26.58 C ATOM 2187 O VAL A 144 2.215 16.648 81.799 1.00 26.04 O ATOM 2188 CB VAL A 144 4.623 14.385 82.381 1.00 24.77 C ATOM 2189 CG1 VAL A 144 4.836 12.889 82.305 1.00 24.22 C ATOM 2190 CG2 VAL A 144 4.940 15.033 81.051 1.00 24.27 C ATOM 2191 HA VAL A 144 3.045 14.304 83.818 1.00 0.00 H ATOM 2192 HB VAL A 144 5.298 14.798 83.130 1.00 0.00 H ATOM 2193 HG11 VAL A 144 4.645 12.446 83.282 1.00 0.00 H ATOM 2194 HG12 VAL A 144 4.152 12.463 81.571 1.00 0.00 H ATOM 2195 HG13 VAL A 144 5.864 12.684 82.007 1.00 0.00 H ATOM 2196 HG21 VAL A 144 4.262 14.647 80.290 1.00 0.00 H ATOM 2197 HG22 VAL A 144 4.817 16.113 81.136 1.00 0.00 H ATOM 2198 HG23 VAL A 144 5.969 14.804 80.773 1.00 0.00 H ATOM 2199 H VAL A 144 2.029 14.514 80.975 1.00 0.00 H ATOM 2200 N ASP A 145 3.424 16.966 83.655 1.00 28.67 N ATOM 2201 CA ASP A 145 3.191 18.399 83.593 1.00 31.04 C ATOM 2202 C ASP A 145 3.673 18.965 82.264 1.00 31.92 C ATOM 2203 O ASP A 145 4.837 18.811 81.891 1.00 31.47 O ATOM 2204 CB ASP A 145 3.884 19.128 84.738 1.00 32.20 C ATOM 2205 CG ASP A 145 3.622 20.619 84.698 1.00 33.93 C ATOM 2206 OD1 ASP A 145 4.553 21.386 84.372 1.00 34.63 O ATOM 2207 OD2 ASP A 145 2.470 21.019 84.972 1.00 34.64 O ATOM 2208 HA ASP A 145 2.116 18.556 83.684 1.00 0.00 H ATOM 2209 HB2 ASP A 145 3.516 18.730 85.684 1.00 0.00 H ATOM 2210 HB3 ASP A 145 4.958 18.956 84.667 1.00 0.00 H ATOM 2211 H ASP A 145 3.992 16.555 84.423 1.00 0.00 H ATOM 2212 N ILE A 146 2.764 19.624 81.556 1.00 33.48 N ATOM 2213 CA ILE A 146 3.073 20.204 80.256 1.00 35.13 C ATOM 2214 C ILE A 146 3.886 21.487 80.342 1.00 35.64 C ATOM 2215 O ILE A 146 4.806 21.699 79.553 1.00 35.70 O ATOM 2216 CB ILE A 146 1.785 20.519 79.476 1.00 35.78 C ATOM 2217 CG1 ILE A 146 0.970 19.245 79.284 1.00 36.46 C ATOM 2218 CG2 ILE A 146 2.125 21.127 78.122 1.00 36.26 C ATOM 2219 CD1 ILE A 146 -0.378 19.508 78.676 1.00 37.73 C ATOM 2220 HA ILE A 146 3.670 19.450 79.743 1.00 0.00 H ATOM 2221 HB ILE A 146 1.196 21.238 80.045 1.00 0.00 H ATOM 2222 HG12 ILE A 146 1.523 18.572 78.629 1.00 0.00 H ATOM 2223 HG13 ILE A 146 0.829 18.771 80.255 1.00 0.00 H ATOM 2224 HD11 ILE A 146 -0.945 20.174 79.327 1.00 0.00 H ATOM 2225 HD12 ILE A 146 -0.250 19.975 77.699 1.00 0.00 H ATOM 2226 HD13 ILE A 146 -0.914 18.566 78.562 1.00 0.00 H ATOM 2227 HG21 ILE A 146 2.687 22.049 78.270 1.00 0.00 H ATOM 2228 HG22 ILE A 146 2.726 20.421 77.549 1.00 0.00 H ATOM 2229 HG23 ILE A 146 1.204 21.345 77.581 1.00 0.00 H ATOM 2230 H ILE A 146 1.803 19.729 81.941 1.00 0.00 H ATOM 2231 N ASN A 147 3.539 22.341 81.298 1.00 36.25 N ATOM 2232 CA ASN A 147 4.222 23.616 81.451 1.00 37.40 C ATOM 2233 C ASN A 147 5.700 23.472 81.761 1.00 37.09 C ATOM 2234 O ASN A 147 6.463 24.423 81.590 1.00 37.78 O ATOM 2235 CB ASN A 147 3.572 24.452 82.556 1.00 39.37 C ATOM 2236 CG ASN A 147 2.105 24.753 82.286 1.00 41.19 C ATOM 2237 OD1 ASN A 147 1.211 23.990 82.681 1.00 41.62 O ATOM 2238 ND2 ASN A 147 1.850 25.868 81.606 1.00 42.06 N ATOM 2239 HA ASN A 147 4.128 24.115 80.487 1.00 0.00 H ATOM 2240 HB2 ASN A 147 3.648 23.906 83.496 1.00 0.00 H ATOM 2241 HB3 ASN A 147 4.111 25.396 82.641 1.00 0.00 H ATOM 2242 HD22 ASN A 147 2.633 26.478 81.295 1.00 0.00 H ATOM 2243 HD21 ASN A 147 0.868 26.130 81.386 1.00 0.00 H ATOM 2244 H ASN A 147 2.766 22.094 81.948 1.00 0.00 H ATOM 2245 N THR A 148 6.109 22.289 82.207 1.00 35.82 N ATOM 2246 CA THR A 148 7.505 22.068 82.558 1.00 34.34 C ATOM 2247 C THR A 148 8.147 20.937 81.777 1.00 33.83 C ATOM 2248 O THR A 148 9.285 20.560 82.052 1.00 33.53 O ATOM 2249 CB THR A 148 7.654 21.769 84.070 1.00 34.44 C ATOM 2250 OG1 THR A 148 6.956 20.559 84.403 1.00 33.52 O ATOM 2251 CG2 THR A 148 7.084 22.921 84.892 1.00 33.96 C ATOM 2252 HA THR A 148 8.021 22.993 82.299 1.00 0.00 H ATOM 2253 HB THR A 148 8.713 21.652 84.298 1.00 0.00 H ATOM 2254 HG1 THR A 148 5.996 20.662 84.184 1.00 0.00 H ATOM 2255 HG23 THR A 148 7.612 23.841 84.641 1.00 0.00 H ATOM 2256 HG21 THR A 148 6.024 23.036 84.667 1.00 0.00 H ATOM 2257 HG22 THR A 148 7.210 22.706 85.953 1.00 0.00 H ATOM 2258 H THR A 148 5.425 21.512 82.307 1.00 0.00 H ATOM 2259 N PHE A 149 7.417 20.402 80.803 1.00 33.31 N ATOM 2260 CA PHE A 149 7.919 19.303 79.984 1.00 32.49 C ATOM 2261 C PHE A 149 9.304 19.568 79.403 1.00 32.78 C ATOM 2262 O PHE A 149 9.655 20.708 79.095 1.00 33.17 O ATOM 2263 CB PHE A 149 6.963 19.015 78.827 1.00 30.81 C ATOM 2264 CG PHE A 149 7.495 18.003 77.852 1.00 29.19 C ATOM 2265 CD1 PHE A 149 7.457 16.642 78.150 1.00 28.26 C ATOM 2266 CD2 PHE A 149 8.088 18.412 76.661 1.00 27.71 C ATOM 2267 CE1 PHE A 149 8.005 15.702 77.275 1.00 27.87 C ATOM 2268 CE2 PHE A 149 8.637 17.486 75.784 1.00 27.60 C ATOM 2269 CZ PHE A 149 8.597 16.125 76.091 1.00 27.69 C ATOM 2270 HA PHE A 149 7.990 18.446 80.654 1.00 0.00 H ATOM 2271 HB2 PHE A 149 6.026 18.640 79.238 1.00 0.00 H ATOM 2272 HB3 PHE A 149 6.777 19.946 78.292 1.00 0.00 H ATOM 2273 HD2 PHE A 149 8.122 19.473 76.414 1.00 0.00 H ATOM 2274 HE2 PHE A 149 9.099 17.822 74.856 1.00 0.00 H ATOM 2275 HZ PHE A 149 9.029 15.397 75.405 1.00 0.00 H ATOM 2276 HE1 PHE A 149 7.969 14.640 77.520 1.00 0.00 H ATOM 2277 HD1 PHE A 149 6.994 16.307 79.078 1.00 0.00 H ATOM 2278 H PHE A 149 6.464 20.776 80.620 1.00 0.00 H ATOM 2279 N ARG A 150 10.078 18.503 79.241 1.00 32.96 N ATOM 2280 CA ARG A 150 11.413 18.600 78.674 1.00 34.09 C ATOM 2281 C ARG A 150 11.837 17.265 78.076 1.00 33.66 C ATOM 2282 O ARG A 150 11.549 16.206 78.638 1.00 33.81 O ATOM 2283 CB ARG A 150 12.419 19.021 79.743 1.00 36.29 C ATOM 2284 CG ARG A 150 12.370 20.495 80.097 1.00 40.89 C ATOM 2285 CD ARG A 150 13.318 20.818 81.245 1.00 45.29 C ATOM 2286 NE ARG A 150 14.664 20.287 81.015 1.00 49.82 N ATOM 2287 CZ ARG A 150 15.474 20.672 80.028 1.00 51.71 C ATOM 2288 NH1 ARG A 150 15.082 21.605 79.161 1.00 52.57 N ATOM 2289 NH2 ARG A 150 16.677 20.119 79.903 1.00 52.19 N ATOM 2290 HA ARG A 150 11.392 19.354 77.887 1.00 0.00 H ATOM 2291 HB2 ARG A 150 12.219 18.445 80.647 1.00 0.00 H ATOM 2292 HB3 ARG A 150 13.420 18.789 79.380 1.00 0.00 H ATOM 2293 HG2 ARG A 150 12.657 21.080 79.223 1.00 0.00 H ATOM 2294 HG3 ARG A 150 11.353 20.757 80.391 1.00 0.00 H ATOM 2295 HD2 ARG A 150 12.921 20.383 82.162 1.00 0.00 H ATOM 2296 HD3 ARG A 150 13.381 21.901 81.355 1.00 0.00 H ATOM 2297 HE ARG A 150 15.013 19.557 81.669 1.00 0.00 H ATOM 2298 HH12 ARG A 150 15.718 21.901 78.393 1.00 0.00 H ATOM 2299 HH11 ARG A 150 14.140 22.037 79.252 1.00 0.00 H ATOM 2300 HH22 ARG A 150 17.310 20.418 79.134 1.00 0.00 H ATOM 2301 HH21 ARG A 150 16.985 19.387 80.575 1.00 0.00 H ATOM 2302 H ARG A 150 9.719 17.570 79.528 1.00 0.00 H ATOM 2303 N LEU A 151 12.503 17.318 76.924 1.00 32.81 N ATOM 2304 CA LEU A 151 12.994 16.110 76.270 1.00 31.44 C ATOM 2305 C LEU A 151 14.026 15.452 77.169 1.00 30.61 C ATOM 2306 O LEU A 151 14.831 16.139 77.799 1.00 31.01 O ATOM 2307 CB LEU A 151 13.660 16.448 74.939 1.00 31.21 C ATOM 2308 CG LEU A 151 12.766 16.544 73.711 1.00 31.23 C ATOM 2309 CD1 LEU A 151 13.603 16.881 72.487 1.00 30.91 C ATOM 2310 CD2 LEU A 151 12.050 15.222 73.522 1.00 30.95 C ATOM 2311 HA LEU A 151 12.151 15.443 76.088 1.00 0.00 H ATOM 2312 HB2 LEU A 151 14.157 17.411 75.057 1.00 0.00 H ATOM 2313 HB3 LEU A 151 14.405 15.677 74.741 1.00 0.00 H ATOM 2314 HG LEU A 151 12.029 17.335 73.847 1.00 0.00 H ATOM 2315 HD21 LEU A 151 12.785 14.429 73.383 1.00 0.00 H ATOM 2316 HD22 LEU A 151 11.445 15.008 74.403 1.00 0.00 H ATOM 2317 HD23 LEU A 151 11.407 15.281 72.644 1.00 0.00 H ATOM 2318 HD11 LEU A 151 14.104 17.836 72.643 1.00 0.00 H ATOM 2319 HD12 LEU A 151 14.347 16.100 72.331 1.00 0.00 H ATOM 2320 HD13 LEU A 151 12.955 16.948 71.613 1.00 0.00 H ATOM 2321 H LEU A 151 12.677 18.242 76.480 1.00 0.00 H ATOM 2322 N SER A 152 14.002 14.125 77.230 1.00 29.32 N ATOM 2323 CA SER A 152 14.958 13.393 78.045 1.00 27.93 C ATOM 2324 C SER A 152 16.298 13.381 77.310 1.00 27.30 C ATOM 2325 O SER A 152 16.356 13.633 76.106 1.00 26.98 O ATOM 2326 CB SER A 152 14.475 11.958 78.266 1.00 27.51 C ATOM 2327 OG SER A 152 14.569 11.201 77.071 1.00 27.14 O ATOM 2328 HA SER A 152 15.063 13.873 79.018 1.00 0.00 H ATOM 2329 HB2 SER A 152 13.436 11.978 78.595 1.00 0.00 H ATOM 2330 HB3 SER A 152 15.089 11.489 79.035 1.00 0.00 H ATOM 2331 HG SER A 152 14.009 11.621 76.371 1.00 0.00 H ATOM 2332 H SER A 152 13.287 13.601 76.686 1.00 0.00 H ATOM 2333 N ALA A 153 17.371 13.091 78.038 1.00 26.89 N ATOM 2334 CA ALA A 153 18.701 13.038 77.448 1.00 26.47 C ATOM 2335 C ALA A 153 18.723 12.044 76.295 1.00 26.55 C ATOM 2336 O ALA A 153 19.382 12.270 75.280 1.00 26.69 O ATOM 2337 CB ALA A 153 19.717 12.634 78.501 1.00 26.38 C ATOM 2338 HA ALA A 153 18.958 14.026 77.066 1.00 0.00 H ATOM 2339 HB1 ALA A 153 19.710 13.365 79.310 1.00 0.00 H ATOM 2340 HB2 ALA A 153 19.458 11.651 78.895 1.00 0.00 H ATOM 2341 HB3 ALA A 153 20.709 12.597 78.051 1.00 0.00 H ATOM 2342 H ALA A 153 17.258 12.897 79.054 1.00 0.00 H ATOM 2343 N ASP A 154 17.997 10.942 76.465 1.00 26.40 N ATOM 2344 CA ASP A 154 17.910 9.891 75.458 1.00 26.04 C ATOM 2345 C ASP A 154 17.312 10.405 74.145 1.00 25.51 C ATOM 2346 O ASP A 154 17.828 10.109 73.064 1.00 24.64 O ATOM 2347 CB ASP A 154 17.081 8.720 76.009 1.00 26.79 C ATOM 2348 CG ASP A 154 16.886 7.609 74.994 1.00 27.01 C ATOM 2349 OD1 ASP A 154 15.813 7.574 74.349 1.00 26.77 O ATOM 2350 OD2 ASP A 154 17.810 6.780 74.839 1.00 26.89 O ATOM 2351 HA ASP A 154 18.921 9.549 75.235 1.00 0.00 H ATOM 2352 HB2 ASP A 154 17.592 8.310 76.880 1.00 0.00 H ATOM 2353 HB3 ASP A 154 16.102 9.096 76.307 1.00 0.00 H ATOM 2354 H ASP A 154 17.469 10.825 77.354 1.00 0.00 H ATOM 2355 N ASP A 155 16.232 11.175 74.241 1.00 25.02 N ATOM 2356 CA ASP A 155 15.595 11.725 73.048 1.00 25.49 C ATOM 2357 C ASP A 155 16.556 12.659 72.313 1.00 26.10 C ATOM 2358 O ASP A 155 16.783 12.518 71.109 1.00 26.36 O ATOM 2359 CB ASP A 155 14.323 12.498 73.414 1.00 24.60 C ATOM 2360 CG ASP A 155 13.245 11.610 74.004 1.00 24.66 C ATOM 2361 OD1 ASP A 155 12.915 10.573 73.387 1.00 24.79 O ATOM 2362 OD2 ASP A 155 12.721 11.954 75.084 1.00 23.74 O ATOM 2363 HA ASP A 155 15.329 10.891 72.399 1.00 0.00 H ATOM 2364 HB2 ASP A 155 14.580 13.266 74.143 1.00 0.00 H ATOM 2365 HB3 ASP A 155 13.931 12.971 72.513 1.00 0.00 H ATOM 2366 H ASP A 155 15.836 11.388 75.179 1.00 0.00 H ATOM 2367 N ILE A 156 17.117 13.617 73.041 1.00 26.58 N ATOM 2368 CA ILE A 156 18.048 14.568 72.452 1.00 26.95 C ATOM 2369 C ILE A 156 19.219 13.826 71.818 1.00 27.85 C ATOM 2370 O ILE A 156 19.601 14.089 70.680 1.00 28.20 O ATOM 2371 CB ILE A 156 18.590 15.534 73.515 1.00 26.41 C ATOM 2372 CG1 ILE A 156 17.424 16.284 74.167 1.00 25.72 C ATOM 2373 CG2 ILE A 156 19.594 16.485 72.883 1.00 24.69 C ATOM 2374 CD1 ILE A 156 17.813 17.108 75.363 1.00 24.14 C ATOM 2375 HA ILE A 156 17.511 15.137 71.693 1.00 0.00 H ATOM 2376 HB ILE A 156 19.109 14.978 74.296 1.00 0.00 H ATOM 2377 HG12 ILE A 156 16.985 16.948 73.422 1.00 0.00 H ATOM 2378 HG13 ILE A 156 16.680 15.552 74.483 1.00 0.00 H ATOM 2379 HD11 ILE A 156 18.243 16.459 76.126 1.00 0.00 H ATOM 2380 HD12 ILE A 156 18.548 17.856 75.064 1.00 0.00 H ATOM 2381 HD13 ILE A 156 16.929 17.605 75.763 1.00 0.00 H ATOM 2382 HG21 ILE A 156 20.420 15.912 72.461 1.00 0.00 H ATOM 2383 HG22 ILE A 156 19.105 17.055 72.093 1.00 0.00 H ATOM 2384 HG23 ILE A 156 19.974 17.167 73.643 1.00 0.00 H ATOM 2385 H ILE A 156 16.887 13.689 74.053 1.00 0.00 H ATOM 2386 N ARG A 157 19.785 12.892 72.566 1.00 28.61 N ATOM 2387 CA ARG A 157 20.911 12.114 72.081 1.00 29.86 C ATOM 2388 C ARG A 157 20.520 11.353 70.816 1.00 29.96 C ATOM 2389 O ARG A 157 21.304 11.257 69.867 1.00 30.76 O ATOM 2390 CB ARG A 157 21.369 11.154 73.183 1.00 30.89 C ATOM 2391 CG ARG A 157 22.597 10.340 72.855 1.00 33.06 C ATOM 2392 CD ARG A 157 23.268 9.839 74.129 1.00 34.95 C ATOM 2393 NE ARG A 157 22.311 9.291 75.090 1.00 36.78 N ATOM 2394 CZ ARG A 157 22.001 9.865 76.253 1.00 37.93 C ATOM 2395 NH1 ARG A 157 22.575 11.011 76.610 1.00 38.07 N ATOM 2396 NH2 ARG A 157 21.111 9.297 77.064 1.00 37.27 N ATOM 2397 HA ARG A 157 21.737 12.778 71.827 1.00 0.00 H ATOM 2398 HB2 ARG A 157 21.582 11.742 74.076 1.00 0.00 H ATOM 2399 HB3 ARG A 157 20.552 10.463 73.391 1.00 0.00 H ATOM 2400 HG2 ARG A 157 22.307 9.486 72.243 1.00 0.00 H ATOM 2401 HG3 ARG A 157 23.300 10.961 72.300 1.00 0.00 H ATOM 2402 HD2 ARG A 157 23.795 10.670 74.596 1.00 0.00 H ATOM 2403 HD3 ARG A 157 23.983 9.060 73.864 1.00 0.00 H ATOM 2404 HE ARG A 157 21.841 8.395 74.850 1.00 0.00 H ATOM 2405 HH12 ARG A 157 22.330 11.455 77.518 1.00 0.00 H ATOM 2406 HH11 ARG A 157 23.269 11.463 75.981 1.00 0.00 H ATOM 2407 HH22 ARG A 157 20.872 9.747 77.970 1.00 0.00 H ATOM 2408 HH21 ARG A 157 20.655 8.403 76.791 1.00 0.00 H ATOM 2409 H ARG A 157 19.415 12.712 73.521 1.00 0.00 H ATOM 2410 N GLY A 158 19.299 10.831 70.796 1.00 29.48 N ATOM 2411 CA GLY A 158 18.840 10.092 69.638 1.00 28.81 C ATOM 2412 C GLY A 158 18.535 10.957 68.428 1.00 28.97 C ATOM 2413 O GLY A 158 18.917 10.614 67.311 1.00 29.32 O ATOM 2414 HA3 GLY A 158 17.932 9.555 69.913 1.00 0.00 H ATOM 2415 HA2 GLY A 158 19.614 9.376 69.360 1.00 0.00 H ATOM 2416 H GLY A 158 18.670 10.953 71.615 1.00 0.00 H ATOM 2417 N ILE A 159 17.849 12.078 68.636 1.00 28.55 N ATOM 2418 CA ILE A 159 17.493 12.961 67.530 1.00 28.45 C ATOM 2419 C ILE A 159 18.719 13.604 66.883 1.00 29.03 C ATOM 2420 O ILE A 159 18.756 13.809 65.665 1.00 28.68 O ATOM 2421 CB ILE A 159 16.525 14.079 67.991 1.00 27.94 C ATOM 2422 CG1 ILE A 159 15.933 14.792 66.773 1.00 27.82 C ATOM 2423 CG2 ILE A 159 17.253 15.080 68.871 1.00 27.34 C ATOM 2424 CD1 ILE A 159 15.048 13.902 65.913 1.00 27.89 C ATOM 2425 HA ILE A 159 16.999 12.331 66.790 1.00 0.00 H ATOM 2426 HB ILE A 159 15.719 13.626 68.568 1.00 0.00 H ATOM 2427 HG12 ILE A 159 15.337 15.635 67.123 1.00 0.00 H ATOM 2428 HG13 ILE A 159 16.753 15.160 66.157 1.00 0.00 H ATOM 2429 HD11 ILE A 159 15.632 13.059 65.544 1.00 0.00 H ATOM 2430 HD12 ILE A 159 14.214 13.534 66.511 1.00 0.00 H ATOM 2431 HD13 ILE A 159 14.666 14.478 65.070 1.00 0.00 H ATOM 2432 HG21 ILE A 159 17.650 14.569 69.748 1.00 0.00 H ATOM 2433 HG22 ILE A 159 18.072 15.528 68.308 1.00 0.00 H ATOM 2434 HG23 ILE A 159 16.558 15.858 69.186 1.00 0.00 H ATOM 2435 H ILE A 159 17.562 12.329 69.603 1.00 0.00 H ATOM 2436 N GLN A 160 19.723 13.916 67.697 1.00 29.89 N ATOM 2437 CA GLN A 160 20.939 14.537 67.187 1.00 30.24 C ATOM 2438 C GLN A 160 21.858 13.515 66.521 1.00 30.51 C ATOM 2439 O GLN A 160 22.773 13.880 65.785 1.00 30.69 O ATOM 2440 CB GLN A 160 21.671 15.277 68.311 1.00 30.28 C ATOM 2441 CG GLN A 160 20.818 16.351 68.978 1.00 30.63 C ATOM 2442 CD GLN A 160 21.582 17.159 70.011 1.00 31.17 C ATOM 2443 OE1 GLN A 160 22.427 16.629 70.725 1.00 32.42 O ATOM 2444 NE2 GLN A 160 21.272 18.447 70.109 1.00 31.49 N ATOM 2445 HA GLN A 160 20.650 15.259 66.423 1.00 0.00 H ATOM 2446 HB2 GLN A 160 21.969 14.551 69.068 1.00 0.00 H ATOM 2447 HB3 GLN A 160 22.560 15.750 67.893 1.00 0.00 H ATOM 2448 HG2 GLN A 160 20.450 17.030 68.209 1.00 0.00 H ATOM 2449 HG3 GLN A 160 19.973 15.868 69.470 1.00 0.00 H ATOM 2450 HE22 GLN A 160 20.549 18.857 69.484 1.00 0.00 H ATOM 2451 HE21 GLN A 160 21.752 19.045 70.811 1.00 0.00 H ATOM 2452 H GLN A 160 19.639 13.714 68.714 1.00 0.00 H ATOM 2453 N SER A 161 21.619 12.231 66.770 1.00 30.54 N ATOM 2454 CA SER A 161 22.436 11.212 66.129 1.00 30.93 C ATOM 2455 C SER A 161 21.982 11.120 64.670 1.00 31.44 C ATOM 2456 O SER A 161 22.608 10.442 63.851 1.00 31.85 O ATOM 2457 CB SER A 161 22.264 9.855 66.821 1.00 30.62 C ATOM 2458 OG SER A 161 20.995 9.294 66.553 1.00 31.55 O ATOM 2459 HA SER A 161 23.491 11.478 66.195 1.00 0.00 H ATOM 2460 HB2 SER A 161 22.372 9.990 67.897 1.00 0.00 H ATOM 2461 HB3 SER A 161 23.036 9.174 66.462 1.00 0.00 H ATOM 2462 HG SER A 161 20.289 9.906 66.881 1.00 0.00 H ATOM 2463 H SER A 161 20.853 11.957 67.418 1.00 0.00 H ATOM 2464 N LEU A 162 20.889 11.817 64.358 1.00 31.91 N ATOM 2465 CA LEU A 162 20.329 11.842 63.006 1.00 32.16 C ATOM 2466 C LEU A 162 20.537 13.190 62.307 1.00 32.39 C ATOM 2467 O LEU A 162 20.735 13.246 61.091 1.00 31.84 O ATOM 2468 CB LEU A 162 18.825 11.543 63.044 1.00 31.87 C ATOM 2469 CG LEU A 162 18.328 10.179 63.517 1.00 31.51 C ATOM 2470 CD1 LEU A 162 16.808 10.162 63.404 1.00 31.32 C ATOM 2471 CD2 LEU A 162 18.941 9.061 62.680 1.00 31.29 C ATOM 2472 HA LEU A 162 20.860 11.076 62.441 1.00 0.00 H ATOM 2473 HB2 LEU A 162 18.373 12.287 63.699 1.00 0.00 H ATOM 2474 HB3 LEU A 162 18.451 11.679 62.029 1.00 0.00 H ATOM 2475 HG LEU A 162 18.627 10.013 64.552 1.00 0.00 H ATOM 2476 HD21 LEU A 162 18.661 9.196 61.635 1.00 0.00 H ATOM 2477 HD22 LEU A 162 20.027 9.092 62.773 1.00 0.00 H ATOM 2478 HD23 LEU A 162 18.572 8.099 63.035 1.00 0.00 H ATOM 2479 HD11 LEU A 162 16.390 10.951 64.028 1.00 0.00 H ATOM 2480 HD12 LEU A 162 16.520 10.327 62.366 1.00 0.00 H ATOM 2481 HD13 LEU A 162 16.431 9.195 63.737 1.00 0.00 H ATOM 2482 H LEU A 162 20.416 12.365 65.105 1.00 0.00 H ATOM 2483 N TYR A 163 20.486 14.270 63.080 1.00 32.61 N ATOM 2484 CA TYR A 163 20.640 15.612 62.528 1.00 33.56 C ATOM 2485 C TYR A 163 21.709 16.423 63.265 1.00 34.93 C ATOM 2486 O TYR A 163 22.112 17.494 62.807 1.00 34.89 O ATOM 2487 CB TYR A 163 19.298 16.346 62.608 1.00 32.03 C ATOM 2488 CG TYR A 163 18.160 15.614 61.940 1.00 31.12 C ATOM 2489 CD1 TYR A 163 17.992 15.669 60.561 1.00 30.76 C ATOM 2490 CD2 TYR A 163 17.249 14.857 62.686 1.00 30.71 C ATOM 2491 CE1 TYR A 163 16.947 14.995 59.934 1.00 30.39 C ATOM 2492 CE2 TYR A 163 16.199 14.173 62.067 1.00 30.03 C ATOM 2493 CZ TYR A 163 16.056 14.252 60.689 1.00 29.96 C ATOM 2494 OH TYR A 163 15.021 13.610 60.055 1.00 29.50 O ATOM 2495 HA TYR A 163 20.962 15.511 61.492 1.00 0.00 H ATOM 2496 HB3 TYR A 163 19.409 17.319 62.129 1.00 0.00 H ATOM 2497 HB2 TYR A 163 19.046 16.487 63.659 1.00 0.00 H ATOM 2498 HD2 TYR A 163 17.360 14.800 63.769 1.00 0.00 H ATOM 2499 HE2 TYR A 163 15.500 13.584 62.660 1.00 0.00 H ATOM 2500 HE1 TYR A 163 16.831 15.052 58.852 1.00 0.00 H ATOM 2501 HD1 TYR A 163 18.691 16.250 59.960 1.00 0.00 H ATOM 2502 HH TYR A 163 15.082 12.637 60.229 1.00 0.00 H ATOM 2503 H TYR A 163 20.333 14.156 64.102 1.00 0.00 H ATOM 2504 N GLY A 164 22.156 15.909 64.410 1.00 36.65 N ATOM 2505 CA GLY A 164 23.158 16.600 65.207 1.00 38.57 C ATOM 2506 C GLY A 164 22.727 17.995 65.628 1.00 40.15 C ATOM 2507 O GLY A 164 21.531 18.271 65.775 1.00 40.71 O ATOM 2508 HA3 GLY A 164 24.073 16.682 64.620 1.00 0.00 H ATOM 2509 HA2 GLY A 164 23.354 16.012 66.104 1.00 0.00 H ATOM 2510 H GLY A 164 21.782 14.997 64.740 1.00 0.00 H ATOM 2511 N ASP A 165 23.720 18.857 65.842 1.00 41.28 N ATOM 2512 CA ASP A 165 23.541 20.264 66.218 1.00 42.23 C ATOM 2513 C ASP A 165 24.747 20.772 67.005 1.00 42.99 C ATOM 2514 O ASP A 165 24.566 21.113 68.196 1.00 43.32 O ATOM 2515 CB ASP A 165 22.286 20.503 67.060 1.00 41.44 C ATOM 2516 CG ASP A 165 21.920 21.976 67.125 1.00 41.81 C ATOM 2517 OD1 ASP A 165 21.161 22.383 68.029 1.00 41.77 O ATOM 2518 OD2 ASP A 165 22.395 22.732 66.250 1.00 41.76 O ATOM 2519 HA ASP A 165 23.435 20.809 65.280 1.00 0.00 H ATOM 2520 OXT ASP A 165 25.856 20.822 66.422 1.00 43.34 O ATOM 2521 HB2 ASP A 165 21.455 19.952 66.619 1.00 0.00 H ATOM 2522 HB3 ASP A 165 22.465 20.139 68.072 1.00 0.00 H ATOM 2523 H ASP A 165 24.693 18.507 65.735 1.00 0.00 H TER 2524 ASP A 165 HETATM 2525 ZN ZN A 1 5.095 5.681 68.629 1.00 20.54 ZN HETATM 2526 ZN ZN A 2 -3.363 7.033 59.455 1.00 19.91 ZN HETATM 2527 CA CA A 3 -7.987 4.485 69.486 1.00 24.43 CA HETATM 2528 CA CA A 4 4.189 14.025 54.059 1.00 54.61 CA HETATM 2529 CA CA A 5 -12.341 13.225 69.382 1.00 74.14 CA HETATM 2530 O HOH 6 -7.944 2.635 54.862 1.00 5.64 O HETATM 2531 O HOH 7 5.595 11.430 78.280 1.00 17.86 O HETATM 2532 O HOH 8 3.380 2.185 60.485 1.00 16.37 O HETATM 2533 O HOH 9 -4.995 9.025 55.407 1.00 22.66 O HETATM 2534 O HOH 10 13.924 6.430 69.976 1.00 11.16 O HETATM 2535 O HOH 11 15.975 7.157 61.203 1.00 9.66 O HETATM 2536 O HOH 12 -12.608 19.537 77.913 1.00 30.59 O HETATM 2537 O HOH 13 17.808 30.482 58.459 1.00 24.51 O HETATM 2538 O HOH 14 -12.464 14.867 62.957 1.00 22.38 O HETATM 2539 O HOH 15 -7.177 0.603 75.991 1.00 35.87 O HETATM 2540 O HOH 16 -2.047 2.466 63.529 1.00 25.74 O HETATM 2541 O HOH 17 14.833 19.750 76.634 1.00 38.02 O HETATM 2542 O HOH 18 -1.901 11.681 55.402 1.00 25.74 O HETATM 2543 O HOH 19 -0.942 19.553 52.402 1.00 23.92 O HETATM 2544 O HOH 20 10.519 -0.037 74.186 1.00 14.76 O HETATM 2545 O HOH 21 -6.679 3.756 57.802 1.00 11.67 O HETATM 2546 O HOH 22 13.285 15.789 81.267 1.00 30.42 O HETATM 2547 O HOH 23 13.541 22.728 52.548 1.00 18.89 O HETATM 2548 O HOH 24 18.468 2.794 78.133 1.00 33.33 O HETATM 2549 O HOH 25 -6.643 3.219 77.112 1.00 38.83 O HETATM 2550 O HOH 26 14.356 8.319 72.218 1.00 18.15 O HETATM 2551 O HOH 27 1.992 23.384 75.391 1.00 31.59 O HETATM 2552 O HOH 28 -12.485 26.325 67.791 1.00 22.37 O HETATM 2553 O HOH 29 0.773 3.589 75.551 1.00 39.98 O HETATM 2554 O HOH 30 20.423 7.148 75.082 1.00 34.87 O HETATM 2555 O HOH 31 5.339 27.023 63.618 1.00 44.52 O HETATM 2556 O HOH 32 -5.512 -1.763 59.425 1.00 21.67 O HETATM 2557 O HOH 33 -2.018 24.458 58.543 1.00 15.54 O HETATM 2558 O HOH 34 6.645 14.143 52.625 1.00 13.84 O HETATM 2559 O HOH 35 15.256 -4.749 70.029 1.00 25.89 O HETATM 2560 O HOH 36 16.696 1.667 79.639 1.00 26.08 O HETATM 2561 O HOH 37 11.192 1.333 67.320 1.00 18.95 O HETATM 2562 O HOH 38 -16.129 16.891 70.881 1.00 24.46 O HETATM 2563 O HOH 39 -5.298 8.209 76.831 1.00 17.86 O HETATM 2564 O HOH 40 7.082 20.459 50.468 1.00 29.48 O HETATM 2565 O HOH 41 0.279 13.173 51.929 1.00 24.94 O HETATM 2566 O HOH 42 -15.023 5.083 64.783 1.00 19.11 O HETATM 2567 O HOH 43 7.233 8.241 52.897 1.00 27.79 O HETATM 2568 O HOH 44 -8.960 9.831 75.179 1.00 34.49 O HETATM 2569 O HOH 45 -14.048 23.691 69.886 1.00 40.61 O HETATM 2570 O HOH 46 -10.877 5.430 65.301 1.00 32.81 O HETATM 2571 O HOH 47 7.277 17.693 82.571 1.00 22.56 O HETATM 2572 O HOH 48 -3.453 26.753 74.242 1.00 32.43 O HETATM 2573 O HOH 49 10.959 23.147 80.566 1.00 36.19 O HETATM 2574 O HOH 50 0.673 25.567 64.533 1.00 16.49 O HETATM 2575 O HOH 51 16.028 15.507 47.984 1.00 46.13 O HETATM 2576 O HOH 52 17.675 -0.083 72.722 1.00 36.07 O HETATM 2577 O HOH 53 -12.207 17.418 61.892 1.00 19.29 O HETATM 2578 O HOH 54 -7.565 18.781 80.556 1.00 37.28 O HETATM 2579 O HOH 55 0.290 28.232 65.044 1.00 14.30 O HETATM 2580 O HOH 56 -2.677 19.327 74.003 1.00 25.64 O HETATM 2581 O HOH 57 5.929 6.881 79.357 1.00 38.11 O HETATM 2582 O HOH 58 16.941 24.664 64.812 1.00 26.19 O HETATM 2583 O HOH 59 12.443 -0.759 78.596 1.00 35.60 O HETATM 2584 O HOH 60 3.486 5.903 64.888 1.00 13.71 O HETATM 2585 O HOH 61 21.440 6.954 64.986 1.00 30.94 O HETATM 2586 O HOH 62 -12.219 7.825 58.565 1.00 35.61 O HETATM 2587 O HOH 63 8.227 27.328 67.823 1.00 48.87 O HETATM 2588 O HOH 64 -3.141 24.044 73.907 1.00 37.88 O HETATM 2589 O HOH 65 -12.590 28.826 60.729 1.00 42.66 O HETATM 2590 O HOH 66 -4.321 25.954 59.463 1.00 39.81 O HETATM 2591 O HOH 67 -3.665 0.786 62.770 1.00 27.96 O HETATM 2592 O HOH 68 -9.866 0.883 71.445 1.00 26.04 O HETATM 2593 O HOH 69 -5.122 28.033 61.702 1.00 30.34 O HETATM 2594 O HOH 70 -7.446 15.340 84.812 1.00 23.38 O HETATM 2595 O HOH 71 -3.832 23.506 50.612 1.00 45.92 O HETATM 2596 O HOH 72 10.755 9.688 49.574 1.00 37.68 O HETATM 2597 O HOH 73 -15.240 11.302 61.155 1.00 32.67 O HETATM 2598 O HOH 74 13.334 0.707 65.068 1.00 34.25 O HETATM 2599 O HOH 75 17.125 9.999 79.106 1.00 34.94 O HETATM 2600 O HOH 76 14.603 27.052 64.445 1.00 41.17 O HETATM 2601 O HOH 77 -10.230 22.473 66.824 1.00 44.06 O HETATM 2602 O HOH 78 8.306 8.548 78.693 1.00 24.53 O HETATM 2603 O HOH 79 10.358 25.813 57.595 1.00 24.93 O HETATM 2604 O HOH 80 12.225 20.258 75.836 1.00 35.21 O HETATM 2605 O HOH 81 0.169 29.516 54.857 1.00 26.39 O HETATM 2606 O HOH 82 7.077 28.938 77.449 1.00 50.56 O HETATM 2607 O HOH 83 9.825 22.436 52.945 1.00 18.88 O HETATM 2608 O HOH 84 6.624 10.202 79.994 1.00 23.05 O HETATM 2609 O HOH 85 -5.329 12.115 54.500 1.00 19.19 O HETATM 2610 O HOH 86 -13.708 3.480 58.948 1.00 16.95 O HETATM 2611 O HOH 87 27.031 18.262 65.915 1.00 18.91 O HETATM 2612 O HOH 88 5.944 8.478 75.887 1.00 32.52 O HETATM 2613 O HOH 89 -6.781 -0.864 57.327 1.00 31.03 O HETATM 2614 O HOH 90 -14.069 2.357 64.914 1.00 22.03 O HETATM 2615 O HOH 91 7.791 16.294 51.614 1.00 33.57 O HETATM 2616 O HOH 92 -14.634 14.140 68.799 1.00 36.15 O HETATM 2617 O HOH 93 -12.022 10.160 59.650 1.00 16.94 O HETATM 2618 O HOH 94 4.234 24.432 76.529 1.00 36.73 O HETATM 2619 O HOH 95 -4.060 12.739 79.841 1.00 19.65 O HETATM 2620 O HOH 96 11.330 26.322 63.871 1.00 13.14 O HETATM 2621 O HOH 97 -10.593 19.030 75.083 1.00 20.80 O HETATM 2622 O HOH 98 6.083 22.711 51.178 1.00 28.83 O HETATM 2623 O HOH 99 14.102 14.861 52.727 1.00 21.82 O HETATM 2624 O HOH 100 28.369 20.904 65.513 1.00 35.24 O HETATM 2625 O HOH 101 -6.737 9.112 78.988 1.00 33.35 O HETATM 2626 O HOH 102 -7.962 21.835 80.586 1.00 36.76 O HETATM 2627 O HOH 103 13.667 2.527 55.079 1.00 26.11 O HETATM 2628 O HOH 104 24.052 20.915 59.431 1.00 34.12 O HETATM 2629 O HOH 105 -12.761 12.849 60.939 1.00 31.13 O HETATM 2630 O HOH 106 9.369 16.263 81.283 1.00 42.46 O HETATM 2631 O HOH 107 3.941 10.032 77.388 1.00 8.22 O HETATM 2632 O HOH 108 -1.443 9.433 82.134 1.00 21.35 O HETATM 2633 O HOH 109 -17.748 16.965 68.900 1.00 33.93 O HETATM 2634 O HOH 110 -3.196 3.844 74.933 1.00 25.99 O HETATM 2635 O HOH 111 -11.119 21.094 60.410 1.00 30.96 O HETATM 2636 O HOH 112 26.068 20.199 63.551 1.00 37.31 O HETATM 2637 O HOH 113 -4.896 24.119 56.385 1.00 23.46 O HETATM 2638 O HOH 114 -12.955 11.635 78.668 1.00 36.19 O HETATM 2639 O HOH 115 25.037 23.103 63.858 1.00 28.09 O HETATM 2640 O HOH 116 7.673 6.926 54.896 1.00 14.51 O HETATM 2641 O HOH 117 -8.208 29.282 74.269 1.00 34.49 O HETATM 2642 O HOH 118 15.677 21.797 75.015 1.00 36.47 O HETATM 2643 O HOH 119 -2.427 12.536 52.392 1.00 36.02 O HETATM 2644 O HOH 120 -9.632 23.621 73.535 1.00 29.07 O HETATM 2645 O HOH 121 20.763 24.409 65.722 1.00 50.76 O HETATM 2646 O HOH 122 12.713 13.404 81.167 1.00 23.41 O HETATM 2647 O HOH 123 2.705 29.103 63.603 1.00 20.46 O HETATM 2648 O HOH 124 18.130 1.138 61.656 1.00 32.43 O HETATM 2649 O HOH 125 16.772 17.048 80.079 1.00 52.24 O HETATM 2650 O HOH 126 24.317 11.822 69.560 1.00 30.46 O HETATM 2651 O HOH 127 -13.233 18.428 59.877 1.00 36.59 O HETATM 2652 O HOH 128 -9.893 1.370 76.470 1.00 29.73 O HETATM 2653 O HOH 129 -8.639 21.093 75.467 1.00 37.41 O HETATM 2654 O HOH 130 -9.889 23.918 58.471 1.00 31.15 O HETATM 2655 O HOH 131 7.062 25.785 65.409 1.00 59.09 O HETATM 2656 O HOH 132 10.063 -0.969 80.211 1.00 32.20 O HETATM 2657 O HOH 133 15.957 -3.171 68.376 1.00 55.31 O HETATM 2658 O HOH 134 -5.084 29.605 65.781 1.00 29.96 O HETATM 2659 O HOH 135 7.556 4.946 58.474 1.00 37.09 O HETATM 2660 O HOH 136 -10.944 10.598 77.447 1.00 35.61 O HETATM 2661 O HOH 137 4.494 29.391 70.136 1.00 42.92 O HETATM 2662 O HOH 138 -15.086 12.133 70.913 1.00 29.40 O HETATM 2663 O HOH 139 -3.671 19.085 52.582 1.00 44.54 O HETATM 2664 O HOH 140 3.015 15.422 52.383 1.00 32.23 O HETATM 2665 O HOH 141 13.253 12.641 51.766 1.00 31.37 O HETATM 2666 O HOH 142 -15.721 13.277 76.659 1.00 30.10 O HETATM 2667 O HOH 143 8.393 2.611 64.822 1.00 33.24 O HETATM 2668 O HOH 144 22.653 8.151 61.974 1.00 41.27 O HETATM 2669 O HOH 145 23.337 13.994 70.685 1.00 35.45 O HETATM 2670 O HOH 146 21.757 11.015 59.048 1.00 34.84 O HETATM 2671 O HOH 147 -13.399 21.451 61.982 1.00 34.29 O HETATM 2672 O HOH 148 -8.841 30.819 72.097 1.00 40.45 O HETATM 2673 O HOH 149 6.264 4.669 55.698 1.00 19.60 O HETATM 2674 O HOH 150 10.390 6.623 55.371 1.00 19.24 O HETATM 2675 O HOH 151 10.758 14.888 50.642 1.00 41.23 O HETATM 2676 O HOH 152 21.455 13.444 50.351 1.00 46.19 O HETATM 2677 O HOH 153 6.007 18.507 49.072 1.00 31.67 O HETATM 2678 O HOH 154 -15.132 14.395 66.315 1.00 49.74 O HETATM 2679 O HOH 155 6.829 27.815 51.843 1.00 43.53 O HETATM 2680 O HOH 156 16.106 0.196 63.170 1.00 41.56 O HETATM 2681 O HOH 157 12.337 4.432 54.031 1.00 35.92 O HETATM 2682 O HOH 158 -11.781 28.758 67.485 1.00 43.20 O HETATM 2683 O HOH 159 5.466 25.683 50.785 1.00 39.67 O HETATM 2684 O HOH 160 21.766 20.784 72.323 1.00 38.71 O HETATM 2685 O HOH 161 20.262 4.324 73.397 1.00 45.63 O HETATM 2686 O HOH 162 -7.780 19.883 78.275 1.00 58.94 O HETATM 2687 O HOH 163 18.507 2.268 65.929 1.00 38.47 O HETATM 2688 O HOH 164 20.754 3.509 70.940 1.00 47.55 O HETATM 2689 O HOH 165 8.228 23.712 73.099 1.00 40.21 O HETATM 2690 O HOH 166 12.948 -2.665 75.275 1.00 43.47 O HETATM 2691 O HOH 167 -4.777 5.699 76.817 1.00 42.89 O HETATM 2692 O HOH 168 -4.375 8.283 81.302 1.00 51.66 O HETATM 2693 N1 CGS A 169 1.139 3.575 70.524 1.00 -0.20 N HETATM 2694 CC CGS A 169 2.250 2.917 71.267 1.00 0.07 C HETATM 2695 C5 CGS A 169 2.011 1.502 71.782 1.00 0.00 C HETATM 2696 CD CGS A 169 1.921 1.194 73.162 1.00 -0.04 C HETATM 2697 CE CGS A 169 1.699 -0.139 73.545 1.00 -0.04 C HETATM 2698 CZ CGS A 169 1.573 -1.123 72.555 1.00 0.00 C HETATM 2699 N11 CGS A 169 1.653 -0.858 71.237 1.00 -0.30 N HETATM 2700 CY CGS A 169 1.866 0.420 70.880 1.00 0.01 C HETATM 2701 H7 CGS A 169 1.932 0.639 69.820 1.00 0.08 H HETATM 2702 H6 CGS A 169 1.403 -2.148 72.865 1.00 0.08 H HETATM 2703 H5 CGS A 169 1.626 -0.404 74.594 1.00 0.07 H HETATM 2704 H4 CGS A 169 2.022 1.973 73.909 1.00 0.07 H HETATM 2705 H1 CGS A 169 2.485 3.549 72.136 1.00 0.07 H HETATM 2706 H2 CGS A 169 3.120 2.880 70.595 1.00 0.07 H HETATM 2707 CA CGS A 169 1.206 3.625 69.014 1.00 0.15 C HETATM 2708 C34 CGS A 169 2.452 4.511 68.663 1.00 0.31 C HETATM 2709 N35 CGS A 169 2.143 5.757 68.080 1.00 0.04 N HETATM 2710 O48 CGS A 169 3.096 6.591 67.742 1.00 -0.17 O HETATM 2711 O47 CGS A 169 3.636 4.221 68.846 1.00 -0.33 O HETATM 2712 CB CGS A 169 1.208 2.355 68.101 1.00 -0.01 C HETATM 2713 CG2 CGS A 169 1.400 2.609 66.593 1.00 -0.06 C HETATM 2714 H16 CGS A 169 1.384 1.650 66.055 1.00 0.02 H HETATM 2715 H17 CGS A 169 2.366 3.108 66.425 1.00 0.02 H HETATM 2716 H18 CGS A 169 0.587 3.251 66.223 1.00 0.02 H HETATM 2717 CG1 CGS A 169 -0.087 1.530 68.295 1.00 -0.06 C HETATM 2718 H19 CGS A 169 -0.242 1.338 69.367 1.00 0.02 H HETATM 2719 H20 CGS A 169 0.004 0.573 67.760 1.00 0.02 H HETATM 2720 H21 CGS A 169 -0.944 2.093 67.896 1.00 0.02 H HETATM 2721 H15 CGS A 169 2.055 1.736 68.431 1.00 0.03 H HETATM 2722 H3 CGS A 169 0.304 4.176 68.710 1.00 0.08 H HETATM 2723 S4 CGS A 169 0.062 4.577 71.347 1.00 0.07 S HETATM 2724 C17 CGS A 169 0.862 6.069 71.757 1.00 0.10 C HETATM 2725 CE2 CGS A 169 1.632 6.172 72.965 1.00 -0.04 C HETATM 2726 CD2 CGS A 169 2.276 7.337 73.335 1.00 -0.03 C HETATM 2727 C20 CGS A 169 2.209 8.500 72.533 1.00 0.09 C HETATM 2728 CD1 CGS A 169 1.456 8.428 71.330 1.00 -0.03 C HETATM 2729 CE1 CGS A 169 0.805 7.268 70.947 1.00 -0.04 C HETATM 2730 H11 CGS A 169 0.241 7.257 70.022 1.00 0.06 H HETATM 2731 H10 CGS A 169 1.390 9.305 70.696 1.00 0.05 H HETATM 2732 O27 CGS A 169 2.854 9.646 72.922 1.00 -0.32 O HETATM 2733 COM CGS A 169 3.476 9.784 74.196 1.00 0.06 C HETATM 2734 H12 CGS A 169 3.925 10.785 74.278 1.00 0.06 H HETATM 2735 H13 CGS A 169 4.260 9.020 74.306 1.00 0.06 H HETATM 2736 H14 CGS A 169 2.723 9.654 74.988 1.00 0.06 H HETATM 2737 H9 CGS A 169 2.844 7.360 74.258 1.00 0.05 H HETATM 2738 H8 CGS A 169 1.711 5.304 73.610 1.00 0.06 H HETATM 2739 O32 CGS A 169 -1.032 4.881 70.451 1.00 -0.15 O HETATM 2740 O33 CGS A 169 -0.316 3.939 72.585 1.00 -0.15 O CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 432 430 2529 CONECT 977 976 2528 CONECT 1136 1134 1135 2526 CONECT 1156 1155 2526 CONECT 1235 1233 2527 CONECT 1243 1242 2527 CONECT 1272 1271 2527 CONECT 1286 1285 2527 CONECT 1340 1338 1339 2526 CONECT 1419 1418 2528 CONECT 1445 1444 2528 CONECT 1462 1461 2528 CONECT 1484 1483 1486 2526 CONECT 1529 1528 2529 CONECT 1533 1532 2529 CONECT 1556 1555 2529 CONECT 1816 1814 1815 2525 CONECT 1873 1871 1872 2525 CONECT 1952 1950 1951 2525 CONECT 2525 1816 1873 1952 CONECT 2526 1136 1156 1340 1484 CONECT 2527 1235 1243 1272 1286 CONECT 2528 977 1419 1445 1462 CONECT 2529 432 1529 1533 1556 CONECT 2693 2694 2707 2723 CONECT 2694 2693 2695 2705 2706 CONECT 2695 2694 2696 2700 CONECT 2696 2695 2697 2704 CONECT 2697 2696 2698 2703 CONECT 2698 2697 2699 2702 CONECT 2699 2698 2700 CONECT 2700 2695 2699 2701 CONECT 2701 2700 CONECT 2702 2698 CONECT 2703 2697 CONECT 2704 2696 CONECT 2705 2694 CONECT 2706 2694 CONECT 2707 2693 2708 2712 2722 CONECT 2708 2707 2709 2711 CONECT 2709 2708 2710 CONECT 2710 2709 CONECT 2711 2708 CONECT 2712 2707 2713 2717 2721 CONECT 2713 2712 2714 2715 2716 CONECT 2714 2713 CONECT 2715 2713 CONECT 2716 2713 CONECT 2717 2712 2718 2719 2720 CONECT 2718 2717 CONECT 2719 2717 CONECT 2720 2717 CONECT 2721 2712 CONECT 2722 2707 CONECT 2723 2693 2724 2739 2740 CONECT 2724 2723 2725 2729 CONECT 2725 2724 2726 2738 CONECT 2726 2725 2727 2737 CONECT 2727 2726 2728 2732 CONECT 2728 2727 2729 2731 CONECT 2729 2724 2728 2730 CONECT 2730 2729 CONECT 2731 2728 CONECT 2732 2727 2733 CONECT 2733 2732 2734 2735 2736 CONECT 2734 2733 CONECT 2735 2733 CONECT 2736 2733 CONECT 2737 2726 CONECT 2738 2725 CONECT 2739 2723 CONECT 2740 2723 MASTER 0 0 0 0 0 0 0 0 2739 1 76 13 END
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Related entries of code: 1jiz
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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RCSB PDB
PDBbind
159aa, >1RMZ_1|Chain... at 98%
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RCSB PDB
PDBbind
163aa, >1ROS_1|Chains... at 97%
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RCSB PDB
PDBbind
159aa, >1UTT_1|Chain... at 100%
1utz
RCSB PDB
PDBbind
159aa, >1UTZ_1|Chains... at 100%
1ycm
RCSB PDB
PDBbind
159aa, >1YCM_1|Chain... at 98%
1z3j
RCSB PDB
PDBbind
159aa, >1Z3J_1|Chain... at 98%
2hu6
RCSB PDB
PDBbind
159aa, >2HU6_1|Chain... at 98%
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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2wo8
RCSB PDB
PDBbind
164aa, >2WO8_1|Chains... at 96%
2wo9
RCSB PDB
PDBbind
164aa, >2WO9_1|Chains... at 96%
2woa
RCSB PDB
PDBbind
164aa, >2WOA_1|Chains... at 96%
3ehx
RCSB PDB
PDBbind
158aa, >3EHX_1|Chain... at 99%
3ehy
RCSB PDB
PDBbind
158aa, >3EHY_1|Chain... at 99%
3f15
RCSB PDB
PDBbind
158aa, >3F15_1|Chain... at 99%
3f16
RCSB PDB
PDBbind
158aa, >3F16_1|Chain... at 99%
3f17
RCSB PDB
PDBbind
158aa, >3F17_1|Chain... at 99%
3f18
RCSB PDB
PDBbind
158aa, >3F18_1|Chain... at 99%
3f19
RCSB PDB
PDBbind
158aa, >3F19_1|Chain... at 99%
3f1a
RCSB PDB
PDBbind
158aa, >3F1A_1|Chain... at 99%
3lik
RCSB PDB
PDBbind
159aa, >3LIK_1|Chain... at 98%
3lil
RCSB PDB
PDBbind
159aa, >3LIL_1|Chain... at 98%
3lir
RCSB PDB
PDBbind
159aa, >3LIR_1|Chain... at 98%
3ljg
RCSB PDB
PDBbind
159aa, >3LJG_1|Chain... at 98%
3lk8
RCSB PDB
PDBbind
158aa, >3LK8_1|Chain... at 99%
3lka
RCSB PDB
PDBbind
158aa, >3LKA_1|Chain... at 99%
3n2u
RCSB PDB
PDBbind
158aa, >3N2U_1|Chain... at 99%
3n2v
RCSB PDB
PDBbind
158aa, >3N2V_1|Chain... at 99%
3nx7
RCSB PDB
PDBbind
158aa, >3NX7_1|Chain... at 99%
3ts4
RCSB PDB
PDBbind
159aa, >3TS4_1|Chain... at 98%
3tsk
RCSB PDB
PDBbind
159aa, >3TSK_1|Chain... at 98%
4efs
RCSB PDB
PDBbind
159aa, >4EFS_1|Chain... at 98%
4gql
RCSB PDB
PDBbind
159aa, >4GQL_1|Chain... at 98%
4gr0
RCSB PDB
PDBbind
159aa, >4GR0_1|Chain... at 98%
4gr3
RCSB PDB
PDBbind
159aa, >4GR3_1|Chain... at 98%
4gr8
RCSB PDB
PDBbind
152aa, >4GR8_1|Chain... at 99%
5cxa
RCSB PDB
PDBbind
159aa, >5CXA_1|Chain... at 98%
5czm
RCSB PDB
PDBbind
159aa, >5CZM_1|Chain... at 98%
5d3c
RCSB PDB
PDBbind
159aa, >5D3C_1|Chain... at 98%
5i0l
RCSB PDB
PDBbind
159aa, >5I0L_1|Chains... at 98%
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RCSB PDB
PDBbind
159aa, >5I2Z_1|Chains... at 98%
5i3m
RCSB PDB
PDBbind
159aa, >5I3M_1|Chains... at 98%
5i43
RCSB PDB
PDBbind
159aa, >5I43_1|Chains... at 98%
5i4o
RCSB PDB
PDBbind
159aa, >5I4O_1|Chains... at 98%
5l7f
RCSB PDB
PDBbind
159aa, >5L7F_1|Chains... at 98%
6ekn
RCSB PDB
PDBbind
159aa, >6EKN_1|Chain... at 98%
6ela
RCSB PDB
PDBbind
159aa, >6ELA_1|Chains... at 98%
6enm
RCSB PDB
PDBbind
159aa, >6ENM_1|Chains... at 98%
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PDBbind
159aa, >6EOX_1|Chain... at 98%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
2w0d
RCSB PDB
PDBbind
CGS
Entry Information
PDB ID
1jiz
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
macrophage metalloelastase (mmp-12)
Ligand Name
CGS
EC.Number
E.C.3.4.24.65
Resolution
2.6(Å)
Affinity (Kd/Ki/IC50)
IC50=2.0nM
Release Year
2002
Protein/NA Sequence
Check fasta file
Primary Reference
J.Mol.Biol. v312 pp. 743-51, 2001
Ligand Properties
Formula
C
1
8
H
2
1
N
3
O
5
S
Molecular Weight
391.441
Exact Mass
391.120
No. of atoms
48
No. of bonds
49
Polar Surface Area
114.38
LOGP Value
2.15 (
Computed with XLOGP3
)
3.68 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 2
Canonical SMILES
O=NC(=O)[C@H](N(S(=O)(=O)c1ccc(cc1)OC)Cc1cccnc1)C(C)C
InChI String
InChI=1S/C18H21N3O5S/c1-13(2)17(18(22)20-23)21(12-14-5-4-10-19-11-14)27(24,25)16-8-6-15(26-3)7-9-16/h4-11,13,17H,12H2,1-3H3/t17-/m1/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):
P39900
Entrez Gene ID
NCBI Entrez Gene ID:
4321
ASD
Information of known allosteric effects of PDB entries
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