Browse entries in the PDBbind-CN Database
HEADER 2NXD_COMPLEX COMPND 2NXD_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 99 PRO GLN ILE THR LEU TRP LYS ARG PRO LEU VAL THR ILE SEQRES 2 A 99 ARG ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASN THR SEQRES 3 A 99 GLY ALA ASP ASP THR VAL LEU GLU GLU MET ASN LEU PRO SEQRES 4 A 99 GLY LYS TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY SEQRES 5 A 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE PRO ILE GLU SEQRES 6 A 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY SEQRES 7 A 99 PRO THR PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 A 99 GLN ILE GLY CYS THR LEU ASN PHE SEQRES 1 B 99 PRO GLN ILE THR LEU TRP LYS ARG PRO LEU VAL THR ILE SEQRES 2 B 99 ARG ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASN THR SEQRES 3 B 99 GLY ALA ASP ASP THR VAL LEU GLU GLU MET ASN LEU PRO SEQRES 4 B 99 GLY LYS TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY SEQRES 5 B 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE PRO ILE GLU SEQRES 6 B 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY SEQRES 7 B 99 PRO THR PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 B 99 GLN ILE GLY CYS THR LEU ASN PHE HET ALA A 273 120 ATOM 1 N PRO A 1 28.548 7.044 -3.048 1.00 56.16 N ATOM 2 CA PRO A 1 27.525 6.295 -3.764 1.00 55.80 C ATOM 3 C PRO A 1 26.135 6.486 -3.180 1.00 55.34 C ATOM 4 O PRO A 1 25.956 7.201 -2.196 1.00 55.43 O ATOM 5 CB PRO A 1 27.957 4.843 -3.546 1.00 56.07 C ATOM 6 CG PRO A 1 28.590 4.851 -2.181 1.00 56.37 C ATOM 7 CD PRO A 1 29.093 6.265 -1.921 1.00 56.57 C ATOM 8 HA PRO A 1 27.453 6.610 -4.805 1.00 0.00 H ATOM 9 HD3 PRO A 1 28.718 6.642 -0.970 1.00 0.00 H ATOM 10 HD2 PRO A 1 30.183 6.296 -1.918 1.00 0.00 H ATOM 11 HG3 PRO A 1 29.422 4.148 -2.152 1.00 0.00 H ATOM 12 HG2 PRO A 1 27.854 4.572 -1.427 1.00 0.00 H ATOM 13 HB2 PRO A 1 27.096 4.175 -3.570 1.00 0.00 H ATOM 14 HB3 PRO A 1 28.676 4.535 -4.305 1.00 0.00 H ATOM 15 N GLN A 2 25.164 5.824 -3.796 1.00 55.07 N ATOM 16 CA GLN A 2 23.827 5.689 -3.232 1.00 54.66 C ATOM 17 C GLN A 2 23.591 4.209 -2.958 1.00 54.03 C ATOM 18 O GLN A 2 23.787 3.348 -3.835 1.00 53.34 O ATOM 19 CB GLN A 2 22.772 6.216 -4.209 1.00 55.29 C ATOM 20 CG GLN A 2 21.333 5.866 -3.829 1.00 55.36 C ATOM 21 CD GLN A 2 20.332 6.562 -4.726 1.00 55.82 C ATOM 22 OE1 GLN A 2 20.004 7.733 -4.509 1.00 53.91 O ATOM 23 NE2 GLN A 2 19.869 5.860 -5.765 1.00 54.22 N ATOM 24 HA GLN A 2 23.747 6.270 -2.313 1.00 0.00 H ATOM 25 HB2 GLN A 2 22.859 7.302 -4.254 1.00 0.00 H ATOM 26 HB3 GLN A 2 22.977 5.796 -5.193 1.00 0.00 H ATOM 27 HG2 GLN A 2 21.196 4.788 -3.916 1.00 0.00 H ATOM 28 HG3 GLN A 2 21.156 6.171 -2.798 1.00 0.00 H ATOM 29 HE22 GLN A 2 20.175 4.876 -5.906 1.00 0.00 H ATOM 30 HE21 GLN A 2 19.203 6.298 -6.433 1.00 0.00 H ATOM 31 H GLN A 2 25.365 5.384 -4.717 1.00 0.00 H ATOM 32 N ILE A 3 23.146 3.939 -1.739 1.00 53.05 N ATOM 33 CA ILE A 3 22.948 2.588 -1.264 1.00 52.67 C ATOM 34 C ILE A 3 21.466 2.446 -0.948 1.00 52.15 C ATOM 35 O ILE A 3 20.909 3.230 -0.181 1.00 51.45 O ATOM 36 CB ILE A 3 23.832 2.331 -0.030 1.00 52.83 C ATOM 37 CG1 ILE A 3 25.301 2.301 -0.457 1.00 54.28 C ATOM 38 CG2 ILE A 3 23.458 1.022 0.668 1.00 52.81 C ATOM 39 CD1 ILE A 3 26.220 2.945 0.534 1.00 55.75 C ATOM 40 HA ILE A 3 23.236 1.848 -2.011 1.00 0.00 H ATOM 41 HB ILE A 3 23.671 3.140 0.683 1.00 0.00 H ATOM 42 HG12 ILE A 3 25.603 1.262 -0.585 1.00 0.00 H ATOM 43 HG13 ILE A 3 25.396 2.825 -1.408 1.00 0.00 H ATOM 44 HD11 ILE A 3 25.937 3.990 0.665 1.00 0.00 H ATOM 45 HD12 ILE A 3 26.145 2.425 1.489 1.00 0.00 H ATOM 46 HD13 ILE A 3 27.245 2.888 0.168 1.00 0.00 H ATOM 47 HG21 ILE A 3 22.418 1.069 0.992 1.00 0.00 H ATOM 48 HG22 ILE A 3 23.586 0.192 -0.027 1.00 0.00 H ATOM 49 HG23 ILE A 3 24.104 0.876 1.534 1.00 0.00 H ATOM 50 H ILE A 3 22.931 4.730 -1.099 1.00 0.00 H ATOM 51 N THR A 4 20.830 1.468 -1.588 1.00 51.19 N ATOM 52 CA THR A 4 19.422 1.174 -1.365 1.00 50.89 C ATOM 53 C THR A 4 19.337 0.168 -0.241 1.00 50.74 C ATOM 54 O THR A 4 20.347 -0.399 0.177 1.00 51.10 O ATOM 55 CB THR A 4 18.756 0.549 -2.619 1.00 51.38 C ATOM 56 OG1 THR A 4 19.491 -0.610 -3.021 1.00 50.12 O ATOM 57 CG2 THR A 4 18.711 1.552 -3.756 1.00 50.54 C ATOM 58 HA THR A 4 18.905 2.105 -1.131 1.00 0.00 H ATOM 59 HB THR A 4 17.733 0.265 -2.370 1.00 0.00 H ATOM 60 HG1 THR A 4 19.493 -1.271 -2.284 1.00 0.00 H ATOM 61 HG23 THR A 4 18.149 2.431 -3.441 1.00 0.00 H ATOM 62 HG21 THR A 4 19.727 1.844 -4.022 1.00 0.00 H ATOM 63 HG22 THR A 4 18.224 1.099 -4.620 1.00 0.00 H ATOM 64 H THR A 4 21.359 0.892 -2.273 1.00 0.00 H ATOM 65 N LEU A 5 18.125 -0.111 0.214 1.00 50.41 N ATOM 66 CA LEU A 5 17.973 -0.868 1.447 1.00 49.82 C ATOM 67 C LEU A 5 17.209 -2.190 1.341 1.00 49.39 C ATOM 68 O LEU A 5 16.832 -2.765 2.362 1.00 48.50 O ATOM 69 CB LEU A 5 17.362 0.058 2.497 1.00 50.71 C ATOM 70 CG LEU A 5 18.253 1.257 2.818 1.00 48.56 C ATOM 71 CD1 LEU A 5 17.465 2.323 3.567 1.00 48.81 C ATOM 72 CD2 LEU A 5 19.468 0.786 3.637 1.00 50.00 C ATOM 73 HA LEU A 5 18.971 -1.198 1.735 1.00 0.00 H ATOM 74 HB2 LEU A 5 16.405 0.424 2.125 1.00 0.00 H ATOM 75 HB3 LEU A 5 17.200 -0.511 3.412 1.00 0.00 H ATOM 76 HG LEU A 5 18.608 1.703 1.889 1.00 0.00 H ATOM 77 HD21 LEU A 5 19.124 0.329 4.565 1.00 0.00 H ATOM 78 HD22 LEU A 5 20.034 0.056 3.058 1.00 0.00 H ATOM 79 HD23 LEU A 5 20.104 1.641 3.866 1.00 0.00 H ATOM 80 HD11 LEU A 5 16.631 2.657 2.950 1.00 0.00 H ATOM 81 HD12 LEU A 5 17.085 1.904 4.499 1.00 0.00 H ATOM 82 HD13 LEU A 5 18.117 3.168 3.786 1.00 0.00 H ATOM 83 H LEU A 5 17.285 0.210 -0.308 1.00 0.00 H ATOM 84 N TRP A 6 17.054 -2.696 0.117 1.00 49.16 N ATOM 85 CA TRP A 6 16.541 -4.042 -0.124 1.00 49.19 C ATOM 86 C TRP A 6 17.415 -5.099 0.541 1.00 49.07 C ATOM 87 O TRP A 6 16.919 -6.129 0.985 1.00 48.76 O ATOM 88 CB TRP A 6 16.418 -4.316 -1.629 1.00 49.40 C ATOM 89 CG TRP A 6 15.499 -3.335 -2.273 1.00 49.28 C ATOM 90 CD1 TRP A 6 15.849 -2.226 -2.979 1.00 49.49 C ATOM 91 CD2 TRP A 6 14.080 -3.308 -2.160 1.00 50.21 C ATOM 92 NE1 TRP A 6 14.733 -1.529 -3.353 1.00 50.90 N ATOM 93 CE2 TRP A 6 13.628 -2.174 -2.864 1.00 49.99 C ATOM 94 CE3 TRP A 6 13.139 -4.153 -1.559 1.00 50.85 C ATOM 95 CZ2 TRP A 6 12.280 -1.857 -2.977 1.00 50.77 C ATOM 96 CZ3 TRP A 6 11.795 -3.842 -1.682 1.00 50.25 C ATOM 97 CH2 TRP A 6 11.377 -2.706 -2.390 1.00 50.50 C ATOM 98 HA TRP A 6 15.548 -4.100 0.322 1.00 0.00 H ATOM 99 HB2 TRP A 6 17.403 -4.238 -2.088 1.00 0.00 H ATOM 100 HB3 TRP A 6 16.028 -5.323 -1.778 1.00 0.00 H ATOM 101 HE1 TRP A 6 14.725 -0.654 -3.915 1.00 0.00 H ATOM 102 HD1 TRP A 6 16.873 -1.934 -3.213 1.00 0.00 H ATOM 103 HZ2 TRP A 6 11.952 -0.966 -3.513 1.00 0.00 H ATOM 104 HH2 TRP A 6 10.311 -2.493 -2.476 1.00 0.00 H ATOM 105 HZ3 TRP A 6 11.050 -4.491 -1.221 1.00 0.00 H ATOM 106 HE3 TRP A 6 13.457 -5.037 -1.006 1.00 0.00 H ATOM 107 H TRP A 6 17.309 -2.107 -0.701 1.00 0.00 H ATOM 108 N LYS A 7 18.711 -4.825 0.626 1.00 49.07 N ATOM 109 CA LYS A 7 19.630 -5.651 1.391 1.00 49.12 C ATOM 110 C LYS A 7 20.294 -4.828 2.494 1.00 49.48 C ATOM 111 O LYS A 7 20.229 -3.597 2.487 1.00 50.13 O ATOM 112 CB LYS A 7 20.687 -6.240 0.460 1.00 50.51 C ATOM 113 HA LYS A 7 19.073 -6.463 1.858 1.00 0.00 H ATOM 114 HB2 LYS A 7 20.200 -6.849 -0.301 1.00 0.00 H ATOM 115 HB3 LYS A 7 21.239 -5.431 -0.019 1.00 0.00 H ATOM 116 H LYS A 7 19.082 -3.991 0.128 1.00 0.00 H ATOM 117 N ARG A 8 20.930 -5.510 3.449 1.00 48.11 N ATOM 118 CA ARG A 8 21.689 -4.820 4.481 1.00 46.97 C ATOM 119 C ARG A 8 22.760 -3.933 3.830 1.00 46.39 C ATOM 120 O ARG A 8 23.479 -4.388 2.931 1.00 45.20 O ATOM 121 CB ARG A 8 22.366 -5.814 5.431 1.00 46.12 C ATOM 122 CG ARG A 8 21.434 -6.588 6.341 1.00 46.82 C ATOM 123 CD ARG A 8 22.172 -7.153 7.558 1.00 47.03 C ATOM 124 NE ARG A 8 21.317 -7.997 8.391 1.00 47.09 N ATOM 125 CZ ARG A 8 21.636 -8.438 9.607 1.00 48.44 C ATOM 126 NH1 ARG A 8 22.800 -8.111 10.166 1.00 48.84 N ATOM 127 NH2 ARG A 8 20.785 -9.209 10.277 1.00 47.56 N ATOM 128 HA ARG A 8 20.995 -4.208 5.057 1.00 0.00 H ATOM 129 HB2 ARG A 8 22.919 -6.533 4.826 1.00 0.00 H ATOM 130 HB3 ARG A 8 23.062 -5.258 6.058 1.00 0.00 H ATOM 131 HG2 ARG A 8 20.642 -5.923 6.685 1.00 0.00 H ATOM 132 HG3 ARG A 8 20.995 -7.413 5.779 1.00 0.00 H ATOM 133 HD2 ARG A 8 22.538 -6.322 8.162 1.00 0.00 H ATOM 134 HD3 ARG A 8 23.017 -7.747 7.210 1.00 0.00 H ATOM 135 HE ARG A 8 20.391 -8.274 8.006 1.00 0.00 H ATOM 136 HH12 ARG A 8 23.037 -8.462 11.116 1.00 0.00 H ATOM 137 HH11 ARG A 8 23.471 -7.505 9.653 1.00 0.00 H ATOM 138 HH22 ARG A 8 21.033 -9.554 11.226 1.00 0.00 H ATOM 139 HH21 ARG A 8 19.872 -9.467 9.852 1.00 0.00 H ATOM 140 H ARG A 8 20.882 -6.549 3.456 1.00 0.00 H ATOM 141 N PRO A 9 22.900 -2.679 4.302 1.00 45.83 N ATOM 142 CA PRO A 9 23.947 -1.766 3.849 1.00 45.86 C ATOM 143 C PRO A 9 25.328 -2.071 4.445 1.00 45.51 C ATOM 144 O PRO A 9 25.884 -1.312 5.260 1.00 46.27 O ATOM 145 CB PRO A 9 23.410 -0.403 4.275 1.00 45.13 C ATOM 146 CG PRO A 9 22.673 -0.698 5.518 1.00 46.31 C ATOM 147 CD PRO A 9 22.022 -2.026 5.287 1.00 45.57 C ATOM 148 HA PRO A 9 24.132 -1.843 2.778 1.00 0.00 H ATOM 149 HD3 PRO A 9 21.977 -2.603 6.211 1.00 0.00 H ATOM 150 HD2 PRO A 9 21.015 -1.902 4.888 1.00 0.00 H ATOM 151 HG3 PRO A 9 21.921 0.068 5.707 1.00 0.00 H ATOM 152 HG2 PRO A 9 23.358 -0.750 6.365 1.00 0.00 H ATOM 153 HB2 PRO A 9 24.225 0.297 4.461 1.00 0.00 H ATOM 154 HB3 PRO A 9 22.745 0.009 3.516 1.00 0.00 H ATOM 155 N LEU A 10 25.864 -3.206 4.014 1.00 45.26 N ATOM 156 CA LEU A 10 27.163 -3.675 4.445 1.00 44.21 C ATOM 157 C LEU A 10 28.174 -3.136 3.456 1.00 43.24 C ATOM 158 O LEU A 10 27.974 -3.244 2.249 1.00 44.32 O ATOM 159 CB LEU A 10 27.205 -5.205 4.470 1.00 45.27 C ATOM 160 CG LEU A 10 26.420 -5.881 5.603 1.00 46.70 C ATOM 161 CD1 LEU A 10 26.146 -7.335 5.254 1.00 47.87 C ATOM 162 CD2 LEU A 10 27.191 -5.785 6.909 1.00 46.59 C ATOM 163 HA LEU A 10 27.382 -3.330 5.456 1.00 0.00 H ATOM 164 HB2 LEU A 10 26.802 -5.566 3.523 1.00 0.00 H ATOM 165 HB3 LEU A 10 28.248 -5.509 4.559 1.00 0.00 H ATOM 166 HG LEU A 10 25.467 -5.366 5.726 1.00 0.00 H ATOM 167 HD21 LEU A 10 28.155 -6.281 6.798 1.00 0.00 H ATOM 168 HD22 LEU A 10 27.348 -4.736 7.161 1.00 0.00 H ATOM 169 HD23 LEU A 10 26.621 -6.269 7.702 1.00 0.00 H ATOM 170 HD11 LEU A 10 25.562 -7.383 4.335 1.00 0.00 H ATOM 171 HD12 LEU A 10 27.092 -7.858 5.112 1.00 0.00 H ATOM 172 HD13 LEU A 10 25.589 -7.803 6.065 1.00 0.00 H ATOM 173 H LEU A 10 25.327 -3.784 3.337 1.00 0.00 H ATOM 174 N VAL A 11 29.234 -2.530 3.977 1.00 41.59 N ATOM 175 CA VAL A 11 30.303 -1.967 3.161 1.00 40.45 C ATOM 176 C VAL A 11 31.647 -2.400 3.716 1.00 39.18 C ATOM 177 O VAL A 11 31.762 -2.799 4.869 1.00 37.73 O ATOM 178 CB VAL A 11 30.298 -0.430 3.171 1.00 40.26 C ATOM 179 CG1 VAL A 11 29.042 0.117 2.504 1.00 40.19 C ATOM 180 CG2 VAL A 11 30.470 0.091 4.588 1.00 40.65 C ATOM 181 HA VAL A 11 30.140 -2.325 2.145 1.00 0.00 H ATOM 182 HB VAL A 11 31.146 -0.073 2.586 1.00 0.00 H ATOM 183 HG11 VAL A 11 29.002 -0.226 1.470 1.00 0.00 H ATOM 184 HG12 VAL A 11 28.163 -0.239 3.041 1.00 0.00 H ATOM 185 HG13 VAL A 11 29.066 1.207 2.526 1.00 0.00 H ATOM 186 HG21 VAL A 11 29.651 -0.271 5.209 1.00 0.00 H ATOM 187 HG22 VAL A 11 31.418 -0.264 4.992 1.00 0.00 H ATOM 188 HG23 VAL A 11 30.464 1.181 4.576 1.00 0.00 H ATOM 189 H VAL A 11 29.305 -2.454 5.012 1.00 0.00 H ATOM 190 N THR A 12 32.677 -2.281 2.894 1.00 38.60 N ATOM 191 CA THR A 12 34.016 -2.602 3.333 1.00 38.22 C ATOM 192 C THR A 12 34.652 -1.367 3.966 1.00 37.97 C ATOM 193 O THR A 12 34.588 -0.270 3.419 1.00 36.15 O ATOM 194 CB THR A 12 34.843 -3.117 2.142 1.00 38.89 C ATOM 195 OG1 THR A 12 34.135 -4.218 1.564 1.00 38.55 O ATOM 196 CG2 THR A 12 36.248 -3.554 2.575 1.00 38.98 C ATOM 197 HA THR A 12 33.985 -3.391 4.084 1.00 0.00 H ATOM 198 HB THR A 12 34.972 -2.315 1.415 1.00 0.00 H ATOM 199 HG1 THR A 12 34.026 -4.931 2.242 1.00 0.00 H ATOM 200 HG23 THR A 12 36.773 -2.705 3.012 1.00 0.00 H ATOM 201 HG21 THR A 12 36.168 -4.352 3.313 1.00 0.00 H ATOM 202 HG22 THR A 12 36.799 -3.915 1.706 1.00 0.00 H ATOM 203 H THR A 12 32.521 -1.952 1.920 1.00 0.00 H ATOM 204 N ILE A 13 35.219 -1.556 5.156 1.00 37.39 N ATOM 205 CA ILE A 13 35.966 -0.508 5.813 1.00 37.59 C ATOM 206 C ILE A 13 37.410 -0.948 5.968 1.00 37.38 C ATOM 207 O ILE A 13 37.717 -2.155 5.963 1.00 36.19 O ATOM 208 CB ILE A 13 35.374 -0.156 7.174 1.00 37.67 C ATOM 209 CG1 ILE A 13 35.551 -1.319 8.147 1.00 37.65 C ATOM 210 CG2 ILE A 13 33.902 0.237 6.999 1.00 36.91 C ATOM 211 CD1 ILE A 13 35.535 -0.910 9.609 1.00 39.22 C ATOM 212 HA ILE A 13 35.913 0.389 5.196 1.00 0.00 H ATOM 213 HB ILE A 13 35.902 0.697 7.601 1.00 0.00 H ATOM 214 HG12 ILE A 13 34.742 -2.031 7.981 1.00 0.00 H ATOM 215 HG13 ILE A 13 36.506 -1.800 7.936 1.00 0.00 H ATOM 216 HD11 ILE A 13 36.346 -0.207 9.797 1.00 0.00 H ATOM 217 HD12 ILE A 13 34.581 -0.437 9.842 1.00 0.00 H ATOM 218 HD13 ILE A 13 35.667 -1.794 10.234 1.00 0.00 H ATOM 219 HG21 ILE A 13 33.834 1.100 6.336 1.00 0.00 H ATOM 220 HG22 ILE A 13 33.353 -0.599 6.566 1.00 0.00 H ATOM 221 HG23 ILE A 13 33.477 0.489 7.970 1.00 0.00 H ATOM 222 H ILE A 13 35.122 -2.480 5.624 1.00 0.00 H ATOM 223 N ARG A 14 38.286 0.045 6.086 1.00 37.88 N ATOM 224 CA ARG A 14 39.690 -0.217 6.356 1.00 38.51 C ATOM 225 C ARG A 14 40.071 0.448 7.658 1.00 38.42 C ATOM 226 O ARG A 14 39.900 1.655 7.822 1.00 38.78 O ATOM 227 CB ARG A 14 40.576 0.284 5.217 1.00 37.79 C ATOM 228 CG ARG A 14 42.013 -0.193 5.325 1.00 38.63 C ATOM 229 CD ARG A 14 42.739 -0.073 3.986 1.00 38.85 C ATOM 230 NE ARG A 14 43.930 -0.921 3.935 1.00 39.06 N ATOM 231 CZ ARG A 14 44.379 -1.548 2.848 1.00 40.73 C ATOM 232 NH1 ARG A 14 43.735 -1.456 1.689 1.00 41.44 N ATOM 233 NH2 ARG A 14 45.486 -2.281 2.919 1.00 42.06 N ATOM 234 HA ARG A 14 39.842 -1.293 6.435 1.00 0.00 H ATOM 235 HB2 ARG A 14 40.162 -0.072 4.273 1.00 0.00 H ATOM 236 HB3 ARG A 14 40.571 1.374 5.227 1.00 0.00 H ATOM 237 HG2 ARG A 14 42.534 0.412 6.067 1.00 0.00 H ATOM 238 HG3 ARG A 14 42.019 -1.236 5.640 1.00 0.00 H ATOM 239 HD2 ARG A 14 43.038 0.965 3.838 1.00 0.00 H ATOM 240 HD3 ARG A 14 42.059 -0.371 3.188 1.00 0.00 H ATOM 241 HE ARG A 14 44.469 -1.044 4.816 1.00 0.00 H ATOM 242 HH12 ARG A 14 44.100 -1.952 0.851 1.00 0.00 H ATOM 243 HH11 ARG A 14 42.866 -0.888 1.620 1.00 0.00 H ATOM 244 HH22 ARG A 14 45.840 -2.772 2.073 1.00 0.00 H ATOM 245 HH21 ARG A 14 45.998 -2.363 3.820 1.00 0.00 H ATOM 246 H ARG A 14 37.961 1.027 5.983 1.00 0.00 H ATOM 247 N ILE A 15 40.587 -0.351 8.580 1.00 39.57 N ATOM 248 CA ILE A 15 41.045 0.163 9.860 1.00 40.23 C ATOM 249 C ILE A 15 42.301 -0.594 10.272 1.00 40.52 C ATOM 250 O ILE A 15 42.323 -1.827 10.223 1.00 42.00 O ATOM 251 CB ILE A 15 39.923 0.053 10.929 1.00 40.66 C ATOM 252 CG1 ILE A 15 40.368 0.634 12.265 1.00 40.79 C ATOM 253 CG2 ILE A 15 39.460 -1.381 11.113 1.00 42.44 C ATOM 254 CD1 ILE A 15 39.233 0.841 13.262 1.00 40.17 C ATOM 255 HA ILE A 15 41.289 1.221 9.771 1.00 0.00 H ATOM 256 HB ILE A 15 39.080 0.638 10.561 1.00 0.00 H ATOM 257 HG12 ILE A 15 41.095 -0.046 12.709 1.00 0.00 H ATOM 258 HG13 ILE A 15 40.841 1.598 12.079 1.00 0.00 H ATOM 259 HD11 ILE A 15 38.501 1.529 12.840 1.00 0.00 H ATOM 260 HD12 ILE A 15 38.755 -0.116 13.471 1.00 0.00 H ATOM 261 HD13 ILE A 15 39.634 1.257 14.186 1.00 0.00 H ATOM 262 HG21 ILE A 15 39.072 -1.760 10.168 1.00 0.00 H ATOM 263 HG22 ILE A 15 40.302 -1.995 11.434 1.00 0.00 H ATOM 264 HG23 ILE A 15 38.675 -1.414 11.869 1.00 0.00 H ATOM 265 H ILE A 15 40.666 -1.369 8.383 1.00 0.00 H ATOM 266 N GLY A 16 43.343 0.139 10.663 1.00 40.87 N ATOM 267 CA GLY A 16 44.627 -0.466 11.013 1.00 40.82 C ATOM 268 C GLY A 16 45.172 -1.389 9.934 1.00 41.24 C ATOM 269 O GLY A 16 45.803 -2.417 10.230 1.00 41.16 O ATOM 270 HA3 GLY A 16 44.500 -1.042 11.929 1.00 0.00 H ATOM 271 HA2 GLY A 16 45.350 0.331 11.184 1.00 0.00 H ATOM 272 H GLY A 16 43.240 1.172 10.721 1.00 0.00 H ATOM 273 N GLY A 17 44.928 -1.026 8.676 1.00 40.70 N ATOM 274 CA GLY A 17 45.356 -1.845 7.551 1.00 41.19 C ATOM 275 C GLY A 17 44.557 -3.126 7.395 1.00 41.09 C ATOM 276 O GLY A 17 44.860 -3.932 6.521 1.00 40.33 O ATOM 277 HA3 GLY A 17 46.404 -2.107 7.694 1.00 0.00 H ATOM 278 HA2 GLY A 17 45.251 -1.259 6.638 1.00 0.00 H ATOM 279 H GLY A 17 44.420 -0.137 8.493 1.00 0.00 H ATOM 280 N GLN A 18 43.532 -3.305 8.230 1.00 41.76 N ATOM 281 CA GLN A 18 42.657 -4.477 8.155 1.00 42.27 C ATOM 282 C GLN A 18 41.374 -4.125 7.415 1.00 41.48 C ATOM 283 O GLN A 18 40.787 -3.083 7.672 1.00 40.35 O ATOM 284 CB GLN A 18 42.277 -4.963 9.558 1.00 43.62 C ATOM 285 CG GLN A 18 43.430 -5.083 10.541 1.00 46.50 C ATOM 286 CD GLN A 18 44.549 -5.956 10.012 1.00 50.13 C ATOM 287 OE1 GLN A 18 44.320 -7.104 9.631 1.00 52.73 O ATOM 288 NE2 GLN A 18 45.772 -5.422 10.004 1.00 52.48 N ATOM 289 HA GLN A 18 43.199 -5.262 7.627 1.00 0.00 H ATOM 290 HB2 GLN A 18 41.553 -4.262 9.973 1.00 0.00 H ATOM 291 HB3 GLN A 18 41.815 -5.945 9.460 1.00 0.00 H ATOM 292 HG2 GLN A 18 43.826 -4.087 10.740 1.00 0.00 H ATOM 293 HG3 GLN A 18 43.056 -5.516 11.469 1.00 0.00 H ATOM 294 HE22 GLN A 18 45.916 -4.447 10.336 1.00 0.00 H ATOM 295 HE21 GLN A 18 46.581 -5.981 9.666 1.00 0.00 H ATOM 296 H GLN A 18 43.348 -2.587 8.960 1.00 0.00 H ATOM 297 N LEU A 19 40.930 -5.013 6.532 1.00 41.55 N ATOM 298 CA LEU A 19 39.652 -4.862 5.856 1.00 41.79 C ATOM 299 C LEU A 19 38.575 -5.615 6.613 1.00 41.97 C ATOM 300 O LEU A 19 38.791 -6.756 7.048 1.00 41.53 O ATOM 301 CB LEU A 19 39.726 -5.387 4.430 1.00 42.18 C ATOM 302 CG LEU A 19 40.654 -4.652 3.464 1.00 42.47 C ATOM 303 CD1 LEU A 19 40.618 -5.354 2.113 1.00 42.29 C ATOM 304 CD2 LEU A 19 40.241 -3.193 3.339 1.00 41.23 C ATOM 305 HA LEU A 19 39.408 -3.800 5.826 1.00 0.00 H ATOM 306 HB2 LEU A 19 40.057 -6.424 4.479 1.00 0.00 H ATOM 307 HB3 LEU A 19 38.720 -5.348 4.013 1.00 0.00 H ATOM 308 HG LEU A 19 41.675 -4.671 3.845 1.00 0.00 H ATOM 309 HD21 LEU A 19 39.219 -3.137 2.963 1.00 0.00 H ATOM 310 HD22 LEU A 19 40.296 -2.716 4.318 1.00 0.00 H ATOM 311 HD23 LEU A 19 40.913 -2.685 2.647 1.00 0.00 H ATOM 312 HD11 LEU A 19 40.951 -6.385 2.232 1.00 0.00 H ATOM 313 HD12 LEU A 19 39.599 -5.342 1.726 1.00 0.00 H ATOM 314 HD13 LEU A 19 41.278 -4.835 1.418 1.00 0.00 H ATOM 315 H LEU A 19 41.517 -5.844 6.317 1.00 0.00 H ATOM 316 N LYS A 20 37.420 -4.971 6.771 1.00 41.61 N ATOM 317 CA LYS A 20 36.282 -5.564 7.472 1.00 41.88 C ATOM 318 C LYS A 20 34.997 -5.155 6.777 1.00 41.44 C ATOM 319 O LYS A 20 34.974 -4.165 6.060 1.00 39.79 O ATOM 320 CB LYS A 20 36.241 -5.095 8.930 1.00 41.88 C ATOM 321 CG LYS A 20 37.444 -5.508 9.755 1.00 43.58 C ATOM 322 CD LYS A 20 37.434 -4.856 11.130 1.00 43.49 C ATOM 323 CE LYS A 20 38.686 -5.167 11.931 1.00 45.28 C ATOM 324 NZ LYS A 20 38.528 -6.399 12.743 1.00 46.66 N ATOM 325 HA LYS A 20 36.388 -6.649 7.456 1.00 0.00 H ATOM 326 HB2 LYS A 20 36.180 -4.007 8.937 1.00 0.00 H ATOM 327 HB3 LYS A 20 35.348 -5.511 9.397 1.00 0.00 H ATOM 328 HG2 LYS A 20 37.434 -6.591 9.877 1.00 0.00 H ATOM 329 HG3 LYS A 20 38.352 -5.211 9.230 1.00 0.00 H ATOM 330 HD2 LYS A 20 37.359 -3.776 11.004 1.00 0.00 H ATOM 331 HD3 LYS A 20 36.567 -5.218 11.682 1.00 0.00 H ATOM 332 HE2 LYS A 20 38.897 -4.330 12.597 1.00 0.00 H ATOM 333 HE3 LYS A 20 39.521 -5.302 11.243 1.00 0.00 H ATOM 334 HZ1 LYS A 20 37.737 -6.276 13.407 1.00 0.00 H ATOM 335 HZ2 LYS A 20 38.333 -7.204 12.114 1.00 0.00 H ATOM 336 HZ3 LYS A 20 39.404 -6.577 13.275 1.00 0.00 H ATOM 337 H LYS A 20 37.324 -4.011 6.382 1.00 0.00 H ATOM 338 N GLU A 21 33.939 -5.937 6.971 1.00 42.37 N ATOM 339 CA GLU A 21 32.613 -5.557 6.513 1.00 43.28 C ATOM 340 C GLU A 21 31.857 -4.938 7.683 1.00 43.28 C ATOM 341 O GLU A 21 31.863 -5.487 8.787 1.00 42.69 O ATOM 342 CB GLU A 21 31.849 -6.778 5.972 1.00 44.31 C ATOM 343 CG GLU A 21 32.542 -7.458 4.815 1.00 47.17 C ATOM 344 CD GLU A 21 32.648 -6.586 3.569 1.00 49.01 C ATOM 345 OE1 GLU A 21 33.784 -6.235 3.206 1.00 50.16 O ATOM 346 OE2 GLU A 21 31.611 -6.297 2.926 1.00 50.71 O ATOM 347 HA GLU A 21 32.702 -4.836 5.701 1.00 0.00 H ATOM 348 HB2 GLU A 21 31.736 -7.501 6.780 1.00 0.00 H ATOM 349 HB3 GLU A 21 30.864 -6.450 5.640 1.00 0.00 H ATOM 350 HG2 GLU A 21 33.549 -7.734 5.130 1.00 0.00 H ATOM 351 HG3 GLU A 21 31.983 -8.358 4.559 1.00 0.00 H ATOM 352 H GLU A 21 34.064 -6.844 7.463 1.00 0.00 H ATOM 353 N ALA A 22 31.227 -3.794 7.441 1.00 42.61 N ATOM 354 CA ALA A 22 30.456 -3.124 8.480 1.00 43.76 C ATOM 355 C ALA A 22 29.132 -2.617 7.946 1.00 43.29 C ATOM 356 O ALA A 22 28.983 -2.311 6.755 1.00 43.29 O ATOM 357 CB ALA A 22 31.256 -1.966 9.101 1.00 44.18 C ATOM 358 HA ALA A 22 30.250 -3.860 9.257 1.00 0.00 H ATOM 359 HB1 ALA A 22 32.173 -2.355 9.542 1.00 0.00 H ATOM 360 HB2 ALA A 22 31.504 -1.240 8.326 1.00 0.00 H ATOM 361 HB3 ALA A 22 30.656 -1.484 9.873 1.00 0.00 H ATOM 362 H ALA A 22 31.285 -3.369 6.494 1.00 0.00 H ATOM 363 N LEU A 23 28.183 -2.518 8.864 1.00 43.54 N ATOM 364 CA LEU A 23 26.827 -2.080 8.561 1.00 44.05 C ATOM 365 C LEU A 23 26.681 -0.577 8.764 1.00 44.08 C ATOM 366 O LEU A 23 26.902 -0.059 9.870 1.00 45.59 O ATOM 367 CB LEU A 23 25.857 -2.799 9.485 1.00 43.97 C ATOM 368 CG LEU A 23 24.357 -2.673 9.242 1.00 43.60 C ATOM 369 CD1 LEU A 23 23.948 -3.490 8.020 1.00 42.39 C ATOM 370 CD2 LEU A 23 23.651 -3.170 10.522 1.00 45.26 C ATOM 371 HA LEU A 23 26.611 -2.314 7.519 1.00 0.00 H ATOM 372 HB2 LEU A 23 26.099 -3.861 9.435 1.00 0.00 H ATOM 373 HB3 LEU A 23 26.047 -2.431 10.493 1.00 0.00 H ATOM 374 HG LEU A 23 24.073 -1.641 9.036 1.00 0.00 H ATOM 375 HD21 LEU A 23 23.927 -4.208 10.708 1.00 0.00 H ATOM 376 HD22 LEU A 23 23.959 -2.554 11.367 1.00 0.00 H ATOM 377 HD23 LEU A 23 22.571 -3.097 10.392 1.00 0.00 H ATOM 378 HD11 LEU A 23 24.483 -3.124 7.144 1.00 0.00 H ATOM 379 HD12 LEU A 23 24.195 -4.538 8.186 1.00 0.00 H ATOM 380 HD13 LEU A 23 22.874 -3.390 7.860 1.00 0.00 H ATOM 381 H LEU A 23 28.416 -2.764 9.847 1.00 0.00 H ATOM 382 N LEU A 24 26.281 0.118 7.707 1.00 43.81 N ATOM 383 CA LEU A 24 25.909 1.535 7.827 1.00 44.10 C ATOM 384 C LEU A 24 24.565 1.678 8.549 1.00 44.50 C ATOM 385 O LEU A 24 23.517 1.309 8.023 1.00 45.15 O ATOM 386 CB LEU A 24 25.872 2.204 6.462 1.00 43.22 C ATOM 387 CG LEU A 24 27.141 2.106 5.617 1.00 43.73 C ATOM 388 CD1 LEU A 24 26.905 2.789 4.302 1.00 45.68 C ATOM 389 CD2 LEU A 24 28.363 2.685 6.326 1.00 47.97 C ATOM 390 HA LEU A 24 26.669 2.040 8.423 1.00 0.00 H ATOM 391 HB2 LEU A 24 25.060 1.751 5.893 1.00 0.00 H ATOM 392 HB3 LEU A 24 25.659 3.262 6.618 1.00 0.00 H ATOM 393 HG LEU A 24 27.361 1.051 5.451 1.00 0.00 H ATOM 394 HD21 LEU A 24 28.188 3.738 6.548 1.00 0.00 H ATOM 395 HD22 LEU A 24 28.535 2.140 7.254 1.00 0.00 H ATOM 396 HD23 LEU A 24 29.236 2.589 5.680 1.00 0.00 H ATOM 397 HD11 LEU A 24 26.079 2.302 3.784 1.00 0.00 H ATOM 398 HD12 LEU A 24 26.659 3.836 4.477 1.00 0.00 H ATOM 399 HD13 LEU A 24 27.807 2.723 3.693 1.00 0.00 H ATOM 400 H LEU A 24 26.230 -0.347 6.778 1.00 0.00 H ATOM 401 N ASN A 25 24.617 2.195 9.774 1.00 44.00 N ATOM 402 CA ASN A 25 23.515 2.087 10.722 1.00 44.34 C ATOM 403 C ASN A 25 23.082 3.450 11.272 1.00 43.82 C ATOM 404 O ASN A 25 23.624 3.951 12.265 1.00 43.10 O ATOM 405 CB ASN A 25 23.949 1.164 11.870 1.00 44.99 C ATOM 406 CG ASN A 25 22.850 0.906 12.873 1.00 45.29 C ATOM 407 OD1 ASN A 25 23.039 0.157 13.831 1.00 52.87 O ATOM 408 ND2 ASN A 25 21.698 1.472 12.644 1.00 42.94 N ATOM 409 HA ASN A 25 22.652 1.673 10.201 1.00 0.00 H ATOM 410 HB2 ASN A 25 24.264 0.210 11.448 1.00 0.00 H ATOM 411 HB3 ASN A 25 24.790 1.626 12.388 1.00 0.00 H ATOM 412 HD22 ASN A 25 21.581 2.099 11.822 1.00 0.00 H ATOM 413 HD21 ASN A 25 20.896 1.297 13.283 1.00 0.00 H ATOM 414 H ASN A 25 25.479 2.697 10.067 1.00 0.00 H ATOM 415 N THR A 26 22.032 4.001 10.671 1.00 43.21 N ATOM 416 CA THR A 26 21.465 5.276 11.118 1.00 42.53 C ATOM 417 C THR A 26 20.775 5.204 12.494 1.00 42.83 C ATOM 418 O THR A 26 20.493 6.238 13.116 1.00 40.78 O ATOM 419 CB THR A 26 20.486 5.818 10.090 1.00 42.35 C ATOM 420 OG1 THR A 26 19.383 4.913 9.924 1.00 38.93 O ATOM 421 CG2 THR A 26 21.213 6.026 8.757 1.00 43.32 C ATOM 422 HA THR A 26 22.314 5.951 11.225 1.00 0.00 H ATOM 423 HB THR A 26 20.092 6.773 10.437 1.00 0.00 H ATOM 424 HG1 THR A 26 18.915 4.803 10.789 1.00 0.00 H ATOM 425 HG23 THR A 26 22.046 6.714 8.902 1.00 0.00 H ATOM 426 HG21 THR A 26 21.590 5.069 8.397 1.00 0.00 H ATOM 427 HG22 THR A 26 20.519 6.442 8.027 1.00 0.00 H ATOM 428 H THR A 26 21.601 3.513 9.860 1.00 0.00 H ATOM 429 N GLY A 27 20.572 3.985 12.988 1.00 42.29 N ATOM 430 CA GLY A 27 19.986 3.767 14.303 1.00 42.89 C ATOM 431 C GLY A 27 20.989 3.708 15.439 1.00 43.10 C ATOM 432 O GLY A 27 20.613 3.479 16.576 1.00 43.57 O ATOM 433 HA3 GLY A 27 19.441 2.823 14.281 1.00 0.00 H ATOM 434 HA2 GLY A 27 19.291 4.582 14.505 1.00 0.00 H ATOM 435 H GLY A 27 20.841 3.160 12.415 1.00 0.00 H ATOM 436 N ALA A 28 22.259 3.928 15.135 1.00 43.06 N ATOM 437 CA ALA A 28 23.320 3.846 16.115 1.00 43.69 C ATOM 438 C ALA A 28 23.951 5.234 16.258 1.00 42.99 C ATOM 439 O ALA A 28 24.249 5.884 15.268 1.00 43.28 O ATOM 440 CB ALA A 28 24.369 2.819 15.659 1.00 43.53 C ATOM 441 HA ALA A 28 22.925 3.523 17.078 1.00 0.00 H ATOM 442 HB1 ALA A 28 23.897 1.842 15.554 1.00 0.00 H ATOM 443 HB2 ALA A 28 24.785 3.128 14.700 1.00 0.00 H ATOM 444 HB3 ALA A 28 25.166 2.761 16.401 1.00 0.00 H ATOM 445 H ALA A 28 22.503 4.169 14.153 1.00 0.00 H ATOM 446 N ASP A 29 24.139 5.683 17.489 1.00 43.14 N ATOM 447 CA ASP A 29 24.720 6.994 17.732 1.00 43.70 C ATOM 448 C ASP A 29 26.223 6.849 17.512 1.00 43.80 C ATOM 449 O ASP A 29 26.882 7.769 17.020 1.00 44.04 O ATOM 450 CB ASP A 29 24.481 7.471 19.170 1.00 43.88 C ATOM 451 CG ASP A 29 22.999 7.549 19.578 1.00 44.98 C ATOM 452 OD1 ASP A 29 22.080 7.770 18.759 1.00 46.66 O ATOM 453 OD2 ASP A 29 22.764 7.446 20.798 1.00 42.95 O ATOM 454 HA ASP A 29 24.262 7.724 17.065 1.00 0.00 H ATOM 455 HB2 ASP A 29 24.985 6.780 19.846 1.00 0.00 H ATOM 456 HB3 ASP A 29 24.917 8.465 19.276 1.00 0.00 H ATOM 457 H ASP A 29 23.866 5.088 18.297 1.00 0.00 H ATOM 458 N ASP A 30 26.746 5.683 17.891 1.00 43.98 N ATOM 459 CA ASP A 30 28.181 5.421 17.931 1.00 44.31 C ATOM 460 C ASP A 30 28.528 4.264 17.031 1.00 44.61 C ATOM 461 O ASP A 30 27.646 3.540 16.563 1.00 45.07 O ATOM 462 CB ASP A 30 28.607 5.075 19.353 1.00 45.26 C ATOM 463 CG ASP A 30 28.199 6.134 20.337 1.00 45.67 C ATOM 464 OD1 ASP A 30 28.359 7.318 19.999 1.00 46.80 O ATOM 465 OD2 ASP A 30 27.698 5.785 21.421 1.00 49.12 O ATOM 466 HA ASP A 30 28.701 6.317 17.593 1.00 0.00 H ATOM 467 HB2 ASP A 30 28.144 4.131 19.639 1.00 0.00 H ATOM 468 HB3 ASP A 30 29.691 4.969 19.380 1.00 0.00 H ATOM 469 H ASP A 30 26.098 4.920 18.173 1.00 0.00 H ATOM 470 N THR A 31 29.827 4.119 16.797 1.00 44.64 N ATOM 471 CA THR A 31 30.399 3.098 15.924 1.00 44.13 C ATOM 472 C THR A 31 30.964 1.990 16.811 1.00 44.67 C ATOM 473 O THR A 31 31.715 2.278 17.749 1.00 43.77 O ATOM 474 CB THR A 31 31.486 3.748 15.045 1.00 44.52 C ATOM 475 OG1 THR A 31 30.846 4.609 14.088 1.00 43.71 O ATOM 476 CG2 THR A 31 32.365 2.723 14.342 1.00 45.18 C ATOM 477 HA THR A 31 29.652 2.665 15.259 1.00 0.00 H ATOM 478 HB THR A 31 32.150 4.323 15.691 1.00 0.00 H ATOM 479 HG1 THR A 31 30.334 5.309 14.566 1.00 0.00 H ATOM 480 HG23 THR A 31 32.839 2.082 15.085 1.00 0.00 H ATOM 481 HG21 THR A 31 31.752 2.116 13.676 1.00 0.00 H ATOM 482 HG22 THR A 31 33.131 3.239 13.763 1.00 0.00 H ATOM 483 H THR A 31 30.481 4.777 17.267 1.00 0.00 H ATOM 484 N VAL A 32 30.529 0.754 16.557 1.00 44.44 N ATOM 485 CA VAL A 32 30.897 -0.412 17.364 1.00 45.97 C ATOM 486 C VAL A 32 31.407 -1.553 16.477 1.00 46.01 C ATOM 487 O VAL A 32 30.681 -2.051 15.601 1.00 46.10 O ATOM 488 CB VAL A 32 29.708 -0.941 18.203 1.00 45.87 C ATOM 489 CG1 VAL A 32 30.202 -1.856 19.292 1.00 48.39 C ATOM 490 CG2 VAL A 32 28.949 0.213 18.828 1.00 48.53 C ATOM 491 HA VAL A 32 31.685 -0.079 18.039 1.00 0.00 H ATOM 492 HB VAL A 32 29.043 -1.494 17.540 1.00 0.00 H ATOM 493 HG11 VAL A 32 30.726 -2.701 18.845 1.00 0.00 H ATOM 494 HG12 VAL A 32 30.882 -1.308 19.944 1.00 0.00 H ATOM 495 HG13 VAL A 32 29.354 -2.219 19.872 1.00 0.00 H ATOM 496 HG21 VAL A 32 29.619 0.778 19.476 1.00 0.00 H ATOM 497 HG22 VAL A 32 28.568 0.864 18.041 1.00 0.00 H ATOM 498 HG23 VAL A 32 28.117 -0.176 19.414 1.00 0.00 H ATOM 499 H VAL A 32 29.896 0.611 15.744 1.00 0.00 H ATOM 500 N LEU A 33 32.655 -1.955 16.713 1.00 45.77 N ATOM 501 CA LEU A 33 33.264 -3.073 15.996 1.00 45.51 C ATOM 502 C LEU A 33 33.416 -4.292 16.883 1.00 44.98 C ATOM 503 O LEU A 33 33.617 -4.175 18.098 1.00 45.29 O ATOM 504 CB LEU A 33 34.646 -2.674 15.479 1.00 45.77 C ATOM 505 CG LEU A 33 34.679 -1.390 14.650 1.00 46.97 C ATOM 506 CD1 LEU A 33 36.089 -1.108 14.199 1.00 48.96 C ATOM 507 CD2 LEU A 33 33.784 -1.510 13.455 1.00 47.37 C ATOM 508 HA LEU A 33 32.603 -3.322 15.166 1.00 0.00 H ATOM 509 HB2 LEU A 33 35.303 -2.539 16.338 1.00 0.00 H ATOM 510 HB3 LEU A 33 35.023 -3.487 14.859 1.00 0.00 H ATOM 511 HG LEU A 33 34.324 -0.568 15.272 1.00 0.00 H ATOM 512 HD21 LEU A 33 34.119 -2.341 12.834 1.00 0.00 H ATOM 513 HD22 LEU A 33 32.761 -1.691 13.785 1.00 0.00 H ATOM 514 HD23 LEU A 33 33.823 -0.585 12.879 1.00 0.00 H ATOM 515 HD11 LEU A 33 36.732 -0.990 15.072 1.00 0.00 H ATOM 516 HD12 LEU A 33 36.448 -1.939 13.591 1.00 0.00 H ATOM 517 HD13 LEU A 33 36.104 -0.192 13.609 1.00 0.00 H ATOM 518 H LEU A 33 33.215 -1.456 17.433 1.00 0.00 H ATOM 519 N GLU A 34 33.373 -5.462 16.258 1.00 43.97 N ATOM 520 CA GLU A 34 33.668 -6.700 16.950 1.00 44.70 C ATOM 521 C GLU A 34 35.086 -6.685 17.512 1.00 44.43 C ATOM 522 O GLU A 34 35.968 -5.948 17.042 1.00 42.18 O ATOM 523 CB GLU A 34 33.536 -7.904 16.024 1.00 44.02 C ATOM 524 CG GLU A 34 32.199 -8.049 15.309 1.00 45.44 C ATOM 525 CD GLU A 34 32.360 -8.683 13.940 1.00 47.27 C ATOM 526 OE1 GLU A 34 31.374 -8.691 13.168 1.00 52.60 O ATOM 527 OE2 GLU A 34 33.485 -9.143 13.627 1.00 49.86 O ATOM 528 HA GLU A 34 32.945 -6.785 17.761 1.00 0.00 H ATOM 529 HB2 GLU A 34 34.315 -7.829 15.265 1.00 0.00 H ATOM 530 HB3 GLU A 34 33.696 -8.803 16.619 1.00 0.00 H ATOM 531 HG2 GLU A 34 31.541 -8.674 15.913 1.00 0.00 H ATOM 532 HG3 GLU A 34 31.752 -7.062 15.191 1.00 0.00 H ATOM 533 H GLU A 34 33.122 -5.491 15.249 1.00 0.00 H ATOM 534 N GLU A 35 35.287 -7.560 18.495 1.00 45.15 N ATOM 535 CA GLU A 35 36.514 -7.628 19.270 1.00 46.89 C ATOM 536 C GLU A 35 37.698 -7.595 18.326 1.00 47.58 C ATOM 537 O GLU A 35 37.783 -8.399 17.410 1.00 46.12 O ATOM 538 CB GLU A 35 36.569 -8.925 20.094 1.00 47.90 C ATOM 539 CG GLU A 35 37.072 -8.714 21.503 1.00 50.96 C ATOM 540 CD GLU A 35 36.182 -7.755 22.270 1.00 54.18 C ATOM 541 OE1 GLU A 35 34.963 -8.019 22.383 1.00 57.79 O ATOM 542 OE2 GLU A 35 36.707 -6.729 22.744 1.00 57.66 O ATOM 543 HA GLU A 35 36.544 -6.778 19.951 1.00 0.00 H ATOM 544 HB2 GLU A 35 35.565 -9.347 20.144 1.00 0.00 H ATOM 545 HB3 GLU A 35 37.233 -9.628 19.590 1.00 0.00 H ATOM 546 HG2 GLU A 35 37.090 -9.673 22.021 1.00 0.00 H ATOM 547 HG3 GLU A 35 38.082 -8.306 21.462 1.00 0.00 H ATOM 548 H GLU A 35 34.525 -8.231 18.720 1.00 0.00 H ATOM 549 N MET A 36 38.603 -6.659 18.567 1.00 48.95 N ATOM 550 CA MET A 36 39.835 -6.550 17.802 1.00 49.96 C ATOM 551 C MET A 36 40.830 -5.753 18.628 1.00 50.17 C ATOM 552 O MET A 36 40.449 -5.084 19.585 1.00 49.78 O ATOM 553 CB MET A 36 39.558 -5.803 16.505 1.00 49.77 C ATOM 554 CG MET A 36 39.095 -4.381 16.762 1.00 50.61 C ATOM 555 SD MET A 36 38.953 -3.429 15.266 1.00 51.64 S ATOM 556 CE MET A 36 40.673 -3.367 14.735 1.00 53.43 C ATOM 557 HA MET A 36 40.229 -7.540 17.573 1.00 0.00 H ATOM 558 HB2 MET A 36 40.472 -5.775 15.911 1.00 0.00 H ATOM 559 HB3 MET A 36 38.783 -6.332 15.951 1.00 0.00 H ATOM 560 HG2 MET A 36 39.814 -3.893 17.420 1.00 0.00 H ATOM 561 HG3 MET A 36 38.121 -4.413 17.250 1.00 0.00 H ATOM 562 HE1 MET A 36 41.272 -2.882 15.505 1.00 0.00 H ATOM 563 HE2 MET A 36 41.039 -4.381 14.573 1.00 0.00 H ATOM 564 HE3 MET A 36 40.745 -2.801 13.806 1.00 0.00 H ATOM 565 H MET A 36 38.426 -5.977 19.332 1.00 0.00 H ATOM 566 N ASN A 37 42.094 -5.788 18.226 1.00 50.83 N ATOM 567 CA ASN A 37 43.123 -4.974 18.862 1.00 51.57 C ATOM 568 C ASN A 37 43.356 -3.653 18.148 1.00 51.92 C ATOM 569 O ASN A 37 43.612 -3.627 16.942 1.00 52.48 O ATOM 570 CB ASN A 37 44.433 -5.755 18.920 1.00 51.51 C ATOM 571 CG ASN A 37 44.334 -6.944 19.826 1.00 52.39 C ATOM 572 OD1 ASN A 37 44.503 -8.086 19.398 1.00 54.75 O ATOM 573 ND2 ASN A 37 43.999 -6.689 21.082 1.00 53.22 N ATOM 574 HA ASN A 37 42.769 -4.742 19.866 1.00 0.00 H ATOM 575 HB2 ASN A 37 44.685 -6.096 17.916 1.00 0.00 H ATOM 576 HB3 ASN A 37 45.220 -5.097 19.287 1.00 0.00 H ATOM 577 HD22 ASN A 37 43.868 -5.706 21.396 1.00 0.00 H ATOM 578 HD21 ASN A 37 43.867 -7.472 21.754 1.00 0.00 H ATOM 579 H ASN A 37 42.358 -6.412 17.437 1.00 0.00 H ATOM 580 N LEU A 38 43.267 -2.563 18.904 1.00 52.45 N ATOM 581 CA LEU A 38 43.547 -1.237 18.384 1.00 52.76 C ATOM 582 C LEU A 38 44.555 -0.600 19.320 1.00 53.31 C ATOM 583 O LEU A 38 44.537 -0.884 20.516 1.00 53.21 O ATOM 584 CB LEU A 38 42.271 -0.392 18.325 1.00 53.11 C ATOM 585 CG LEU A 38 41.263 -0.703 17.216 1.00 53.02 C ATOM 586 CD1 LEU A 38 39.989 0.129 17.413 1.00 54.50 C ATOM 587 CD2 LEU A 38 41.855 -0.456 15.843 1.00 52.92 C ATOM 588 HA LEU A 38 43.938 -1.300 17.369 1.00 0.00 H ATOM 589 HB2 LEU A 38 41.755 -0.513 19.278 1.00 0.00 H ATOM 590 HB3 LEU A 38 42.574 0.648 18.207 1.00 0.00 H ATOM 591 HG LEU A 38 41.008 -1.761 17.278 1.00 0.00 H ATOM 592 HD21 LEU A 38 42.150 0.590 15.759 1.00 0.00 H ATOM 593 HD22 LEU A 38 42.728 -1.093 15.705 1.00 0.00 H ATOM 594 HD23 LEU A 38 41.111 -0.687 15.081 1.00 0.00 H ATOM 595 HD11 LEU A 38 39.545 -0.112 18.379 1.00 0.00 H ATOM 596 HD12 LEU A 38 40.240 1.189 17.382 1.00 0.00 H ATOM 597 HD13 LEU A 38 39.280 -0.101 16.618 1.00 0.00 H ATOM 598 H LEU A 38 42.988 -2.664 19.901 1.00 0.00 H ATOM 599 N PRO A 39 45.456 0.243 18.781 1.00 53.98 N ATOM 600 CA PRO A 39 46.472 0.823 19.643 1.00 54.04 C ATOM 601 C PRO A 39 45.968 2.044 20.412 1.00 54.22 C ATOM 602 O PRO A 39 44.799 2.417 20.315 1.00 53.75 O ATOM 603 CB PRO A 39 47.594 1.211 18.662 1.00 54.34 C ATOM 604 CG PRO A 39 47.084 0.867 17.274 1.00 54.46 C ATOM 605 CD PRO A 39 45.610 0.710 17.394 1.00 53.85 C ATOM 606 HA PRO A 39 46.792 0.128 20.419 1.00 0.00 H ATOM 607 HD3 PRO A 39 45.098 1.659 17.238 1.00 0.00 H ATOM 608 HD2 PRO A 39 45.232 -0.027 16.685 1.00 0.00 H ATOM 609 HG3 PRO A 39 47.535 -0.062 16.926 1.00 0.00 H ATOM 610 HG2 PRO A 39 47.322 1.669 16.575 1.00 0.00 H ATOM 611 HB2 PRO A 39 47.806 2.278 18.733 1.00 0.00 H ATOM 612 HB3 PRO A 39 48.500 0.647 18.882 1.00 0.00 H ATOM 613 N GLY A 40 46.863 2.648 21.183 1.00 54.84 N ATOM 614 CA GLY A 40 46.515 3.783 22.023 1.00 54.95 C ATOM 615 C GLY A 40 45.770 3.339 23.264 1.00 55.20 C ATOM 616 O GLY A 40 45.460 2.156 23.441 1.00 54.88 O ATOM 617 HA3 GLY A 40 45.884 4.466 21.454 1.00 0.00 H ATOM 618 HA2 GLY A 40 47.428 4.298 22.322 1.00 0.00 H ATOM 619 H GLY A 40 47.843 2.299 21.187 1.00 0.00 H ATOM 620 N LYS A 41 45.494 4.302 24.136 1.00 55.61 N ATOM 621 CA LYS A 41 44.718 4.041 25.338 1.00 55.35 C ATOM 622 C LYS A 41 43.259 3.810 24.951 1.00 55.79 C ATOM 623 O LYS A 41 42.841 4.090 23.817 1.00 56.38 O ATOM 624 CB LYS A 41 44.840 5.215 26.302 1.00 55.83 C ATOM 625 HA LYS A 41 45.099 3.150 25.837 1.00 0.00 H ATOM 626 HB2 LYS A 41 45.887 5.354 26.573 1.00 0.00 H ATOM 627 HB3 LYS A 41 44.465 6.119 25.821 1.00 0.00 H ATOM 628 H LYS A 41 45.841 5.266 23.955 1.00 0.00 H ATOM 629 N TRP A 42 42.490 3.273 25.888 1.00 54.79 N ATOM 630 CA TRP A 42 41.057 3.201 25.709 1.00 54.40 C ATOM 631 C TRP A 42 40.400 3.391 27.071 1.00 54.12 C ATOM 632 O TRP A 42 41.055 3.265 28.110 1.00 53.66 O ATOM 633 CB TRP A 42 40.667 1.882 25.035 1.00 54.42 C ATOM 634 CG TRP A 42 41.278 0.671 25.668 1.00 54.27 C ATOM 635 CD1 TRP A 42 42.462 0.069 25.340 1.00 53.86 C ATOM 636 CD2 TRP A 42 40.749 -0.061 26.774 1.00 54.30 C ATOM 637 NE1 TRP A 42 42.690 -1.005 26.166 1.00 53.51 N ATOM 638 CE2 TRP A 42 41.654 -1.105 27.057 1.00 52.96 C ATOM 639 CE3 TRP A 42 39.595 0.066 27.556 1.00 53.89 C ATOM 640 CZ2 TRP A 42 41.437 -2.022 28.080 1.00 53.53 C ATOM 641 CZ3 TRP A 42 39.383 -0.840 28.572 1.00 53.65 C ATOM 642 CH2 TRP A 42 40.301 -1.872 28.827 1.00 53.95 C ATOM 643 HA TRP A 42 40.706 3.991 25.045 1.00 0.00 H ATOM 644 HB2 TRP A 42 39.583 1.782 25.079 1.00 0.00 H ATOM 645 HB3 TRP A 42 40.985 1.922 23.993 1.00 0.00 H ATOM 646 HE1 TRP A 42 43.514 -1.638 26.122 1.00 0.00 H ATOM 647 HD1 TRP A 42 43.127 0.394 24.540 1.00 0.00 H ATOM 648 HZ2 TRP A 42 42.144 -2.828 28.278 1.00 0.00 H ATOM 649 HH2 TRP A 42 40.103 -2.570 29.640 1.00 0.00 H ATOM 650 HZ3 TRP A 42 38.488 -0.755 29.188 1.00 0.00 H ATOM 651 HE3 TRP A 42 38.879 0.865 27.365 1.00 0.00 H ATOM 652 H TRP A 42 42.921 2.901 26.758 1.00 0.00 H ATOM 653 N LYS A 43 39.132 3.780 27.056 1.00 53.92 N ATOM 654 CA LYS A 43 38.376 3.971 28.282 1.00 53.61 C ATOM 655 C LYS A 43 37.236 2.958 28.314 1.00 53.68 C ATOM 656 O LYS A 43 36.474 2.857 27.350 1.00 53.56 O ATOM 657 CB LYS A 43 37.821 5.376 28.337 1.00 53.73 C ATOM 658 HA LYS A 43 39.027 3.824 29.144 1.00 0.00 H ATOM 659 HB2 LYS A 43 38.643 6.091 28.308 1.00 0.00 H ATOM 660 HB3 LYS A 43 37.165 5.540 27.482 1.00 0.00 H ATOM 661 H LYS A 43 38.666 3.953 26.142 1.00 0.00 H ATOM 662 N PRO A 44 37.092 2.234 29.431 1.00 53.17 N ATOM 663 CA PRO A 44 35.949 1.342 29.548 1.00 53.22 C ATOM 664 C PRO A 44 34.665 2.147 29.409 1.00 53.23 C ATOM 665 O PRO A 44 34.604 3.286 29.883 1.00 53.48 O ATOM 666 CB PRO A 44 36.074 0.790 30.968 1.00 52.99 C ATOM 667 CG PRO A 44 37.475 1.007 31.356 1.00 53.43 C ATOM 668 CD PRO A 44 37.926 2.233 30.645 1.00 53.40 C ATOM 669 HA PRO A 44 35.925 0.560 28.790 1.00 0.00 H ATOM 670 HD3 PRO A 44 37.746 3.124 31.246 1.00 0.00 H ATOM 671 HD2 PRO A 44 38.985 2.174 30.394 1.00 0.00 H ATOM 672 HG3 PRO A 44 38.085 0.154 31.059 1.00 0.00 H ATOM 673 HG2 PRO A 44 37.550 1.148 32.434 1.00 0.00 H ATOM 674 HB2 PRO A 44 35.405 1.323 31.644 1.00 0.00 H ATOM 675 HB3 PRO A 44 35.835 -0.273 30.985 1.00 0.00 H ATOM 676 N LYS A 45 33.663 1.557 28.766 1.00 53.01 N ATOM 677 CA LYS A 45 32.406 2.239 28.476 1.00 52.72 C ATOM 678 C LYS A 45 31.273 1.227 28.479 1.00 52.51 C ATOM 679 O LYS A 45 31.501 0.046 28.219 1.00 52.64 O ATOM 680 CB LYS A 45 32.484 2.909 27.105 1.00 53.10 C ATOM 681 HA LYS A 45 32.224 2.998 29.237 1.00 0.00 H ATOM 682 HB2 LYS A 45 33.297 3.635 27.102 1.00 0.00 H ATOM 683 HB3 LYS A 45 32.668 2.152 26.342 1.00 0.00 H ATOM 684 H LYS A 45 33.779 0.571 28.457 1.00 0.00 H ATOM 685 N MET A 46 30.062 1.704 28.754 1.00 52.14 N ATOM 686 CA MET A 46 28.854 0.896 28.637 1.00 51.71 C ATOM 687 C MET A 46 27.934 1.513 27.605 1.00 51.10 C ATOM 688 O MET A 46 27.739 2.725 27.596 1.00 49.53 O ATOM 689 CB MET A 46 28.110 0.817 29.973 1.00 52.45 C ATOM 690 CG MET A 46 28.918 0.228 31.114 1.00 54.51 C ATOM 691 SD MET A 46 29.673 -1.344 30.667 1.00 60.30 S ATOM 692 CE MET A 46 29.433 -2.313 32.151 1.00 57.68 C ATOM 693 HA MET A 46 29.147 -0.110 28.337 1.00 0.00 H ATOM 694 HB2 MET A 46 27.809 1.826 30.255 1.00 0.00 H ATOM 695 HB3 MET A 46 27.222 0.201 29.832 1.00 0.00 H ATOM 696 HG2 MET A 46 28.259 0.072 31.968 1.00 0.00 H ATOM 697 HG3 MET A 46 29.705 0.931 31.388 1.00 0.00 H ATOM 698 HE1 MET A 46 29.931 -1.823 32.988 1.00 0.00 H ATOM 699 HE2 MET A 46 28.367 -2.397 32.360 1.00 0.00 H ATOM 700 HE3 MET A 46 29.855 -3.307 32.006 1.00 0.00 H ATOM 701 H MET A 46 29.973 2.693 29.065 1.00 0.00 H ATOM 702 N ILE A 47 27.381 0.679 26.727 1.00 50.57 N ATOM 703 CA ILE A 47 26.350 1.126 25.792 1.00 50.51 C ATOM 704 C ILE A 47 25.140 0.199 25.819 1.00 50.48 C ATOM 705 O ILE A 47 25.220 -0.930 26.311 1.00 49.73 O ATOM 706 CB ILE A 47 26.882 1.208 24.350 1.00 50.63 C ATOM 707 CG1 ILE A 47 27.400 -0.162 23.886 1.00 50.38 C ATOM 708 CG2 ILE A 47 27.955 2.276 24.260 1.00 50.28 C ATOM 709 CD1 ILE A 47 28.006 -0.156 22.506 1.00 50.72 C ATOM 710 HA ILE A 47 26.052 2.123 26.116 1.00 0.00 H ATOM 711 HB ILE A 47 26.069 1.488 23.680 1.00 0.00 H ATOM 712 HG12 ILE A 47 28.159 -0.498 24.592 1.00 0.00 H ATOM 713 HG13 ILE A 47 26.566 -0.863 23.891 1.00 0.00 H ATOM 714 HD11 ILE A 47 27.257 0.166 21.783 1.00 0.00 H ATOM 715 HD12 ILE A 47 28.852 0.531 22.485 1.00 0.00 H ATOM 716 HD13 ILE A 47 28.346 -1.161 22.256 1.00 0.00 H ATOM 717 HG21 ILE A 47 27.532 3.239 24.545 1.00 0.00 H ATOM 718 HG22 ILE A 47 28.774 2.024 24.934 1.00 0.00 H ATOM 719 HG23 ILE A 47 28.328 2.329 23.237 1.00 0.00 H ATOM 720 H ILE A 47 27.690 -0.314 26.706 1.00 0.00 H ATOM 721 N GLY A 48 24.029 0.683 25.272 1.00 50.14 N ATOM 722 CA GLY A 48 22.803 -0.105 25.202 1.00 50.39 C ATOM 723 C GLY A 48 22.168 -0.191 23.824 1.00 50.37 C ATOM 724 O GLY A 48 22.379 0.667 22.962 1.00 50.02 O ATOM 725 HA3 GLY A 48 22.076 0.340 25.882 1.00 0.00 H ATOM 726 HA2 GLY A 48 23.034 -1.118 25.531 1.00 0.00 H ATOM 727 H GLY A 48 24.034 1.648 24.884 1.00 0.00 H ATOM 728 N GLY A 49 21.368 -1.237 23.631 1.00 50.25 N ATOM 729 CA GLY A 49 20.565 -1.398 22.419 1.00 50.19 C ATOM 730 C GLY A 49 19.265 -2.123 22.713 1.00 50.06 C ATOM 731 O GLY A 49 18.789 -2.113 23.852 1.00 50.34 O ATOM 732 HA3 GLY A 49 21.135 -1.972 21.688 1.00 0.00 H ATOM 733 HA2 GLY A 49 20.338 -0.414 22.009 1.00 0.00 H ATOM 734 H GLY A 49 21.312 -1.967 24.369 1.00 0.00 H ATOM 735 N ILE A 50 18.697 -2.787 21.711 1.00 50.01 N ATOM 736 CA ILE A 50 17.351 -3.349 21.840 1.00 49.87 C ATOM 737 C ILE A 50 17.234 -4.362 22.983 1.00 49.72 C ATOM 738 O ILE A 50 16.176 -4.468 23.606 1.00 49.29 O ATOM 739 CB ILE A 50 16.849 -3.966 20.502 1.00 50.01 C ATOM 740 CG1 ILE A 50 15.394 -3.570 20.239 1.00 49.74 C ATOM 741 CG2 ILE A 50 16.999 -5.488 20.486 1.00 49.70 C ATOM 742 CD1 ILE A 50 14.929 -3.859 18.828 1.00 49.86 C ATOM 743 HA ILE A 50 16.703 -2.509 22.091 1.00 0.00 H ATOM 744 HB ILE A 50 17.474 -3.565 19.704 1.00 0.00 H ATOM 745 HG12 ILE A 50 14.757 -4.121 20.931 1.00 0.00 H ATOM 746 HG13 ILE A 50 15.290 -2.501 20.424 1.00 0.00 H ATOM 747 HD11 ILE A 50 15.549 -3.306 18.122 1.00 0.00 H ATOM 748 HD12 ILE A 50 15.016 -4.927 18.630 1.00 0.00 H ATOM 749 HD13 ILE A 50 13.889 -3.551 18.719 1.00 0.00 H ATOM 750 HG21 ILE A 50 18.050 -5.750 20.611 1.00 0.00 H ATOM 751 HG22 ILE A 50 16.417 -5.918 21.301 1.00 0.00 H ATOM 752 HG23 ILE A 50 16.637 -5.878 19.535 1.00 0.00 H ATOM 753 H ILE A 50 19.218 -2.909 20.819 1.00 0.00 H ATOM 754 N GLY A 51 18.315 -5.090 23.263 1.00 49.55 N ATOM 755 CA GLY A 51 18.308 -6.128 24.301 1.00 49.84 C ATOM 756 C GLY A 51 19.164 -5.815 25.521 1.00 50.01 C ATOM 757 O GLY A 51 19.595 -6.716 26.239 1.00 50.08 O ATOM 758 HA3 GLY A 51 18.674 -7.054 23.858 1.00 0.00 H ATOM 759 HA2 GLY A 51 17.280 -6.268 24.634 1.00 0.00 H ATOM 760 H GLY A 51 19.191 -4.917 22.729 1.00 0.00 H ATOM 761 N GLY A 52 19.413 -4.528 25.737 1.00 50.13 N ATOM 762 CA GLY A 52 20.088 -4.000 26.925 1.00 50.32 C ATOM 763 C GLY A 52 21.472 -3.407 26.731 1.00 50.57 C ATOM 764 O GLY A 52 21.778 -2.877 25.663 1.00 50.33 O ATOM 765 HA3 GLY A 52 20.178 -4.817 27.641 1.00 0.00 H ATOM 766 HA2 GLY A 52 19.452 -3.220 27.344 1.00 0.00 H ATOM 767 H GLY A 52 19.107 -3.848 25.012 1.00 0.00 H ATOM 768 N PHE A 53 22.300 -3.532 27.774 1.00 50.51 N ATOM 769 CA PHE A 53 23.590 -2.849 27.884 1.00 50.49 C ATOM 770 C PHE A 53 24.769 -3.811 27.742 1.00 50.72 C ATOM 771 O PHE A 53 24.707 -4.935 28.241 1.00 49.75 O ATOM 772 CB PHE A 53 23.682 -2.129 29.235 1.00 50.60 C ATOM 773 HA PHE A 53 23.647 -2.130 27.066 1.00 0.00 H ATOM 774 HB2 PHE A 53 22.878 -1.397 29.311 1.00 0.00 H ATOM 775 HB3 PHE A 53 23.589 -2.857 30.041 1.00 0.00 H ATOM 776 H PHE A 53 22.009 -4.153 28.556 1.00 0.00 H ATOM 777 N ILE A 54 25.845 -3.358 27.093 1.00 50.87 N ATOM 778 CA ILE A 54 27.091 -4.124 27.021 1.00 50.64 C ATOM 779 C ILE A 54 28.330 -3.311 27.417 1.00 49.62 C ATOM 780 O ILE A 54 28.332 -2.087 27.351 1.00 49.81 O ATOM 781 CB ILE A 54 27.310 -4.727 25.612 1.00 50.71 C ATOM 782 CG1 ILE A 54 27.386 -3.621 24.563 1.00 51.77 C ATOM 783 CG2 ILE A 54 26.182 -5.719 25.273 1.00 51.83 C ATOM 784 CD1 ILE A 54 27.996 -4.063 23.238 1.00 52.53 C ATOM 785 HA ILE A 54 26.972 -4.926 27.750 1.00 0.00 H ATOM 786 HB ILE A 54 28.257 -5.267 25.609 1.00 0.00 H ATOM 787 HG12 ILE A 54 26.376 -3.260 24.372 1.00 0.00 H ATOM 788 HG13 ILE A 54 27.991 -2.808 24.965 1.00 0.00 H ATOM 789 HD11 ILE A 54 29.013 -4.416 23.408 1.00 0.00 H ATOM 790 HD12 ILE A 54 27.396 -4.868 22.814 1.00 0.00 H ATOM 791 HD13 ILE A 54 28.013 -3.219 22.548 1.00 0.00 H ATOM 792 HG21 ILE A 54 26.175 -6.524 26.008 1.00 0.00 H ATOM 793 HG22 ILE A 54 25.224 -5.199 25.293 1.00 0.00 H ATOM 794 HG23 ILE A 54 26.351 -6.134 24.279 1.00 0.00 H ATOM 795 H ILE A 54 25.796 -2.431 26.624 1.00 0.00 H ATOM 796 N LYS A 55 29.395 -4.010 27.792 1.00 48.83 N ATOM 797 CA LYS A 55 30.688 -3.377 28.050 1.00 49.33 C ATOM 798 C LYS A 55 31.531 -3.287 26.776 1.00 48.52 C ATOM 799 O LYS A 55 31.634 -4.238 26.020 1.00 49.12 O ATOM 800 CB LYS A 55 31.440 -4.135 29.121 1.00 49.25 C ATOM 801 HA LYS A 55 30.498 -2.362 28.399 1.00 0.00 H ATOM 802 HB2 LYS A 55 30.855 -4.138 30.041 1.00 0.00 H ATOM 803 HB3 LYS A 55 31.605 -5.160 28.791 1.00 0.00 H ATOM 804 H LYS A 55 29.307 -5.040 27.906 1.00 0.00 H ATOM 805 N VAL A 56 32.147 -2.139 26.542 1.00 49.06 N ATOM 806 CA VAL A 56 32.965 -1.949 25.355 1.00 48.84 C ATOM 807 C VAL A 56 34.228 -1.184 25.733 1.00 48.76 C ATOM 808 O VAL A 56 34.350 -0.712 26.863 1.00 47.75 O ATOM 809 CB VAL A 56 32.185 -1.213 24.246 1.00 48.85 C ATOM 810 CG1 VAL A 56 31.026 -2.071 23.736 1.00 49.36 C ATOM 811 CG2 VAL A 56 31.692 0.163 24.722 1.00 51.22 C ATOM 812 HA VAL A 56 33.241 -2.926 24.957 1.00 0.00 H ATOM 813 HB VAL A 56 32.870 -1.042 23.415 1.00 0.00 H ATOM 814 HG11 VAL A 56 31.417 -3.004 23.331 1.00 0.00 H ATOM 815 HG12 VAL A 56 30.346 -2.288 24.560 1.00 0.00 H ATOM 816 HG13 VAL A 56 30.492 -1.530 22.955 1.00 0.00 H ATOM 817 HG21 VAL A 56 31.033 0.034 25.581 1.00 0.00 H ATOM 818 HG22 VAL A 56 32.547 0.775 25.007 1.00 0.00 H ATOM 819 HG23 VAL A 56 31.147 0.652 23.914 1.00 0.00 H ATOM 820 H VAL A 56 32.044 -1.358 27.220 1.00 0.00 H ATOM 821 N ARG A 57 35.173 -1.100 24.800 1.00 48.76 N ATOM 822 CA ARG A 57 36.379 -0.299 24.991 1.00 49.48 C ATOM 823 C ARG A 57 36.330 0.848 24.003 1.00 49.35 C ATOM 824 O ARG A 57 36.088 0.643 22.810 1.00 50.14 O ATOM 825 CB ARG A 57 37.654 -1.124 24.796 1.00 49.42 C ATOM 826 CG ARG A 57 37.613 -2.462 25.496 1.00 49.84 C ATOM 827 CD ARG A 57 38.975 -3.111 25.559 1.00 49.77 C ATOM 828 NE ARG A 57 39.570 -3.240 24.234 1.00 50.64 N ATOM 829 CZ ARG A 57 39.485 -4.318 23.455 1.00 51.55 C ATOM 830 NH1 ARG A 57 38.799 -5.391 23.831 1.00 51.24 N ATOM 831 NH2 ARG A 57 40.090 -4.326 22.273 1.00 51.89 N ATOM 832 HA ARG A 57 36.408 0.072 26.015 1.00 0.00 H ATOM 833 HB2 ARG A 57 37.796 -1.296 23.729 1.00 0.00 H ATOM 834 HB3 ARG A 57 38.498 -0.555 25.186 1.00 0.00 H ATOM 835 HG2 ARG A 57 37.245 -2.317 26.512 1.00 0.00 H ATOM 836 HG3 ARG A 57 36.934 -3.121 24.956 1.00 0.00 H ATOM 837 HD2 ARG A 57 38.875 -4.103 26.000 1.00 0.00 H ATOM 838 HD3 ARG A 57 39.629 -2.502 26.183 1.00 0.00 H ATOM 839 HE ARG A 57 40.103 -2.426 23.868 1.00 0.00 H ATOM 840 HH12 ARG A 57 38.747 -6.220 23.206 1.00 0.00 H ATOM 841 HH11 ARG A 57 38.314 -5.402 24.751 1.00 0.00 H ATOM 842 HH22 ARG A 57 40.026 -5.165 21.662 1.00 0.00 H ATOM 843 HH21 ARG A 57 40.628 -3.493 21.958 1.00 0.00 H ATOM 844 H ARG A 57 35.049 -1.620 23.908 1.00 0.00 H ATOM 845 N GLN A 58 36.484 2.057 24.523 1.00 48.82 N ATOM 846 CA GLN A 58 36.376 3.261 23.719 1.00 49.71 C ATOM 847 C GLN A 58 37.750 3.743 23.304 1.00 49.65 C ATOM 848 O GLN A 58 38.563 4.088 24.157 1.00 50.67 O ATOM 849 CB GLN A 58 35.666 4.369 24.498 1.00 49.37 C ATOM 850 CG GLN A 58 35.555 5.677 23.719 1.00 49.20 C ATOM 851 CD GLN A 58 34.858 6.771 24.498 1.00 49.39 C ATOM 852 OE1 GLN A 58 34.081 6.501 25.413 1.00 49.72 O ATOM 853 NE2 GLN A 58 35.139 8.018 24.141 1.00 47.98 N ATOM 854 HA GLN A 58 35.793 3.020 22.830 1.00 0.00 H ATOM 855 HB2 GLN A 58 34.661 4.028 24.748 1.00 0.00 H ATOM 856 HB3 GLN A 58 36.222 4.559 25.416 1.00 0.00 H ATOM 857 HG2 GLN A 58 36.559 6.017 23.465 1.00 0.00 H ATOM 858 HG3 GLN A 58 34.993 5.490 22.804 1.00 0.00 H ATOM 859 HE22 GLN A 58 35.803 8.199 23.361 1.00 0.00 H ATOM 860 HE21 GLN A 58 34.696 8.815 24.641 1.00 0.00 H ATOM 861 H GLN A 58 36.689 2.146 25.539 1.00 0.00 H ATOM 862 N TYR A 59 37.978 3.780 21.994 1.00 50.57 N ATOM 863 CA TYR A 59 39.156 4.403 21.393 1.00 50.90 C ATOM 864 C TYR A 59 38.773 5.701 20.686 1.00 51.12 C ATOM 865 O TYR A 59 37.811 5.768 19.910 1.00 52.52 O ATOM 866 CB TYR A 59 39.821 3.458 20.386 1.00 51.37 C ATOM 867 CG TYR A 59 40.287 2.160 20.985 1.00 51.44 C ATOM 868 CD1 TYR A 59 39.387 1.124 21.241 1.00 51.62 C ATOM 869 CD2 TYR A 59 41.628 1.960 21.298 1.00 51.72 C ATOM 870 CE1 TYR A 59 39.808 -0.075 21.809 1.00 50.93 C ATOM 871 CE2 TYR A 59 42.057 0.767 21.859 1.00 51.90 C ATOM 872 CZ TYR A 59 41.146 -0.246 22.116 1.00 51.91 C ATOM 873 OH TYR A 59 41.593 -1.425 22.681 1.00 51.10 O ATOM 874 HA TYR A 59 39.861 4.621 22.195 1.00 0.00 H ATOM 875 HB3 TYR A 59 40.683 3.967 19.955 1.00 0.00 H ATOM 876 HB2 TYR A 59 39.102 3.234 19.598 1.00 0.00 H ATOM 877 HD2 TYR A 59 42.351 2.752 21.100 1.00 0.00 H ATOM 878 HE2 TYR A 59 43.111 0.625 22.098 1.00 0.00 H ATOM 879 HE1 TYR A 59 39.091 -0.871 22.010 1.00 0.00 H ATOM 880 HD1 TYR A 59 38.334 1.257 20.991 1.00 0.00 H ATOM 881 HH TYR A 59 40.829 -2.043 22.801 1.00 0.00 H ATOM 882 H TYR A 59 37.279 3.341 21.362 1.00 0.00 H ATOM 883 N ASP A 60 39.527 6.748 20.979 1.00 51.39 N ATOM 884 CA ASP A 60 39.274 8.065 20.412 1.00 51.22 C ATOM 885 C ASP A 60 40.202 8.347 19.237 1.00 50.75 C ATOM 886 O ASP A 60 41.340 7.866 19.218 1.00 50.03 O ATOM 887 CB ASP A 60 39.470 9.130 21.486 1.00 51.35 C ATOM 888 CG ASP A 60 38.397 9.069 22.554 1.00 53.00 C ATOM 889 OD1 ASP A 60 37.214 8.875 22.188 1.00 53.82 O ATOM 890 OD2 ASP A 60 38.738 9.223 23.748 1.00 54.35 O ATOM 891 HA ASP A 60 38.247 8.089 20.049 1.00 0.00 H ATOM 892 HB2 ASP A 60 40.442 8.981 21.956 1.00 0.00 H ATOM 893 HB3 ASP A 60 39.442 10.113 21.016 1.00 0.00 H ATOM 894 H ASP A 60 40.325 6.627 21.635 1.00 0.00 H ATOM 895 N GLN A 61 39.714 9.160 18.300 1.00 50.04 N ATOM 896 CA GLN A 61 40.525 9.721 17.221 1.00 50.61 C ATOM 897 C GLN A 61 41.205 8.596 16.436 1.00 50.31 C ATOM 898 O GLN A 61 42.426 8.598 16.234 1.00 49.98 O ATOM 899 CB GLN A 61 41.535 10.766 17.756 1.00 50.22 C ATOM 900 CG GLN A 61 41.180 12.213 17.379 1.00 51.28 C ATOM 901 CD GLN A 61 42.233 13.244 17.770 1.00 52.03 C ATOM 902 OE1 GLN A 61 42.321 13.641 18.932 1.00 54.03 O ATOM 903 NE2 GLN A 61 43.005 13.719 16.787 1.00 51.85 N ATOM 904 HA GLN A 61 39.872 10.256 16.532 1.00 0.00 H ATOM 905 HB2 GLN A 61 41.566 10.690 18.843 1.00 0.00 H ATOM 906 HB3 GLN A 61 42.519 10.535 17.348 1.00 0.00 H ATOM 907 HG2 GLN A 61 41.042 12.260 16.299 1.00 0.00 H ATOM 908 HG3 GLN A 61 40.246 12.475 17.875 1.00 0.00 H ATOM 909 HE22 GLN A 61 42.897 13.355 15.819 1.00 0.00 H ATOM 910 HE21 GLN A 61 43.714 14.453 16.991 1.00 0.00 H ATOM 911 H GLN A 61 38.705 9.408 18.339 1.00 0.00 H ATOM 912 N ILE A 62 40.397 7.619 16.027 1.00 49.88 N ATOM 913 CA ILE A 62 40.884 6.497 15.231 1.00 50.28 C ATOM 914 C ILE A 62 40.514 6.712 13.760 1.00 50.34 C ATOM 915 O ILE A 62 39.348 6.959 13.423 1.00 49.07 O ATOM 916 CB ILE A 62 40.302 5.152 15.722 1.00 50.20 C ATOM 917 CG1 ILE A 62 40.729 4.871 17.172 1.00 50.83 C ATOM 918 CG2 ILE A 62 40.736 4.014 14.802 1.00 50.85 C ATOM 919 CD1 ILE A 62 42.210 4.499 17.372 1.00 51.94 C ATOM 920 HA ILE A 62 41.967 6.453 15.341 1.00 0.00 H ATOM 921 HB ILE A 62 39.214 5.219 15.696 1.00 0.00 H ATOM 922 HG12 ILE A 62 40.526 5.766 17.761 1.00 0.00 H ATOM 923 HG13 ILE A 62 40.123 4.046 17.546 1.00 0.00 H ATOM 924 HD11 ILE A 62 42.436 3.595 16.806 1.00 0.00 H ATOM 925 HD12 ILE A 62 42.839 5.317 17.020 1.00 0.00 H ATOM 926 HD13 ILE A 62 42.399 4.323 18.431 1.00 0.00 H ATOM 927 HG21 ILE A 62 40.377 4.208 13.791 1.00 0.00 H ATOM 928 HG22 ILE A 62 41.824 3.948 14.796 1.00 0.00 H ATOM 929 HG23 ILE A 62 40.316 3.076 15.164 1.00 0.00 H ATOM 930 H ILE A 62 39.390 7.657 16.282 1.00 0.00 H ATOM 931 N PRO A 63 41.510 6.603 12.868 1.00 51.03 N ATOM 932 CA PRO A 63 41.232 6.722 11.440 1.00 51.44 C ATOM 933 C PRO A 63 40.582 5.460 10.873 1.00 52.02 C ATOM 934 O PRO A 63 41.015 4.337 11.173 1.00 51.53 O ATOM 935 CB PRO A 63 42.621 6.966 10.820 1.00 51.22 C ATOM 936 CG PRO A 63 43.561 7.122 11.944 1.00 51.29 C ATOM 937 CD PRO A 63 42.951 6.418 13.116 1.00 51.12 C ATOM 938 HA PRO A 63 40.522 7.519 11.222 1.00 0.00 H ATOM 939 HD3 PRO A 63 43.219 5.362 13.127 1.00 0.00 H ATOM 940 HD2 PRO A 63 43.254 6.878 14.057 1.00 0.00 H ATOM 941 HG3 PRO A 63 43.702 8.178 12.172 1.00 0.00 H ATOM 942 HG2 PRO A 63 44.523 6.673 11.695 1.00 0.00 H ATOM 943 HB2 PRO A 63 42.912 6.117 10.201 1.00 0.00 H ATOM 944 HB3 PRO A 63 42.608 7.870 10.211 1.00 0.00 H ATOM 945 N ILE A 64 39.495 5.650 10.127 1.00 53.11 N ATOM 946 CA ILE A 64 38.807 4.560 9.419 1.00 54.29 C ATOM 947 C ILE A 64 38.400 5.070 8.034 1.00 54.85 C ATOM 948 O ILE A 64 37.915 6.206 7.899 1.00 55.09 O ATOM 949 CB ILE A 64 37.493 4.132 10.110 1.00 54.80 C ATOM 950 CG1 ILE A 64 37.724 3.536 11.494 1.00 56.07 C ATOM 951 CG2 ILE A 64 36.782 3.066 9.295 1.00 54.59 C ATOM 952 CD1 ILE A 64 36.449 2.921 12.091 1.00 55.94 C ATOM 953 HA ILE A 64 39.495 3.715 9.394 1.00 0.00 H ATOM 954 HB ILE A 64 36.898 5.041 10.195 1.00 0.00 H ATOM 955 HG12 ILE A 64 38.484 2.759 11.418 1.00 0.00 H ATOM 956 HG13 ILE A 64 38.077 4.324 12.160 1.00 0.00 H ATOM 957 HD11 ILE A 64 35.683 3.691 12.181 1.00 0.00 H ATOM 958 HD12 ILE A 64 36.091 2.125 11.438 1.00 0.00 H ATOM 959 HD13 ILE A 64 36.672 2.512 13.076 1.00 0.00 H ATOM 960 HG21 ILE A 64 36.549 3.462 8.306 1.00 0.00 H ATOM 961 HG22 ILE A 64 37.429 2.195 9.196 1.00 0.00 H ATOM 962 HG23 ILE A 64 35.860 2.779 9.800 1.00 0.00 H ATOM 963 H ILE A 64 39.115 6.614 10.041 1.00 0.00 H ATOM 964 N GLU A 65 38.610 4.241 7.015 1.00 54.96 N ATOM 965 CA GLU A 65 38.127 4.520 5.667 1.00 55.51 C ATOM 966 C GLU A 65 36.893 3.682 5.385 1.00 54.94 C ATOM 967 O GLU A 65 36.899 2.461 5.519 1.00 54.05 O ATOM 968 CB GLU A 65 39.187 4.220 4.599 1.00 55.24 C ATOM 969 CG GLU A 65 40.476 4.952 4.835 1.00 57.59 C ATOM 970 CD GLU A 65 41.312 5.114 3.583 1.00 57.66 C ATOM 971 OE1 GLU A 65 41.190 4.275 2.654 1.00 59.15 O ATOM 972 OE2 GLU A 65 42.091 6.100 3.550 1.00 59.00 O ATOM 973 HA GLU A 65 37.890 5.583 5.619 1.00 0.00 H ATOM 974 HB2 GLU A 65 39.389 3.149 4.600 1.00 0.00 H ATOM 975 HB3 GLU A 65 38.793 4.513 3.626 1.00 0.00 H ATOM 976 HG2 GLU A 65 40.245 5.942 5.227 1.00 0.00 H ATOM 977 HG3 GLU A 65 41.059 4.398 5.571 1.00 0.00 H ATOM 978 H GLU A 65 39.138 3.361 7.186 1.00 0.00 H ATOM 979 N ILE A 66 35.837 4.369 4.972 1.00 55.00 N ATOM 980 CA ILE A 66 34.554 3.741 4.736 1.00 54.62 C ATOM 981 C ILE A 66 34.226 3.954 3.263 1.00 54.46 C ATOM 982 O ILE A 66 34.048 5.090 2.830 1.00 53.53 O ATOM 983 CB ILE A 66 33.483 4.404 5.613 1.00 54.02 C ATOM 984 CG1 ILE A 66 33.879 4.307 7.093 1.00 54.99 C ATOM 985 CG2 ILE A 66 32.119 3.796 5.309 1.00 54.14 C ATOM 986 CD1 ILE A 66 33.222 5.322 8.003 1.00 54.61 C ATOM 987 HA ILE A 66 34.582 2.679 4.981 1.00 0.00 H ATOM 988 HB ILE A 66 33.411 5.467 5.383 1.00 0.00 H ATOM 989 HG12 ILE A 66 33.613 3.312 7.449 1.00 0.00 H ATOM 990 HG13 ILE A 66 34.959 4.440 7.163 1.00 0.00 H ATOM 991 HD11 ILE A 66 33.487 6.327 7.675 1.00 0.00 H ATOM 992 HD12 ILE A 66 32.140 5.198 7.962 1.00 0.00 H ATOM 993 HD13 ILE A 66 33.568 5.169 9.025 1.00 0.00 H ATOM 994 HG21 ILE A 66 31.877 3.957 4.259 1.00 0.00 H ATOM 995 HG22 ILE A 66 32.145 2.726 5.517 1.00 0.00 H ATOM 996 HG23 ILE A 66 31.363 4.271 5.935 1.00 0.00 H ATOM 997 H ILE A 66 35.933 5.392 4.812 1.00 0.00 H ATOM 998 N CYS A 67 34.151 2.871 2.496 1.00 54.99 N ATOM 999 CA CYS A 67 33.968 2.978 1.043 1.00 55.23 C ATOM 1000 C CYS A 67 34.907 4.017 0.451 1.00 54.44 C ATOM 1001 O CYS A 67 34.514 4.769 -0.434 1.00 54.74 O ATOM 1002 CB CYS A 67 32.537 3.388 0.683 1.00 55.33 C ATOM 1003 SG CYS A 67 31.297 2.128 0.933 1.00 61.25 S ATOM 1004 HA CYS A 67 34.184 1.991 0.633 1.00 0.00 H ATOM 1005 HB2 CYS A 67 32.522 3.671 -0.369 1.00 0.00 H ATOM 1006 HB3 CYS A 67 32.270 4.250 1.294 1.00 0.00 H ATOM 1007 HG CYS A 67 30.061 2.624 0.573 1.00 0.00 H ATOM 1008 H CYS A 67 34.223 1.930 2.933 1.00 0.00 H ATOM 1009 N GLY A 68 36.146 4.053 0.927 1.00 53.89 N ATOM 1010 CA GLY A 68 37.126 5.013 0.436 1.00 54.10 C ATOM 1011 C GLY A 68 37.090 6.384 1.097 1.00 53.84 C ATOM 1012 O GLY A 68 38.012 7.172 0.912 1.00 54.52 O ATOM 1013 HA3 GLY A 68 36.956 5.150 -0.632 1.00 0.00 H ATOM 1014 HA2 GLY A 68 38.118 4.590 0.593 1.00 0.00 H ATOM 1015 H GLY A 68 36.424 3.379 1.669 1.00 0.00 H ATOM 1016 N HIS A 69 36.029 6.686 1.840 1.00 53.18 N ATOM 1017 CA HIS A 69 35.878 7.998 2.470 1.00 53.17 C ATOM 1018 C HIS A 69 36.539 7.959 3.853 1.00 52.70 C ATOM 1019 O HIS A 69 36.339 7.017 4.621 1.00 51.27 O ATOM 1020 CB HIS A 69 34.400 8.395 2.589 1.00 52.83 C ATOM 1021 CG HIS A 69 33.790 8.881 1.308 1.00 53.90 C ATOM 1022 ND1 HIS A 69 33.759 8.121 0.158 1.00 55.02 N ATOM 1023 CD2 HIS A 69 33.171 10.047 1.005 1.00 53.40 C ATOM 1024 CE1 HIS A 69 33.169 8.808 -0.804 1.00 54.90 C ATOM 1025 NE2 HIS A 69 32.793 9.976 -0.314 1.00 55.07 N ATOM 1026 HA HIS A 69 36.364 8.750 1.848 1.00 0.00 H ATOM 1027 HB2 HIS A 69 33.838 7.525 2.927 1.00 0.00 H ATOM 1028 HB3 HIS A 69 34.318 9.190 3.331 1.00 0.00 H ATOM 1029 HD2 HIS A 69 33.004 10.885 1.681 1.00 0.00 H ATOM 1030 HE1 HIS A 69 33.018 8.469 -1.829 1.00 0.00 H ATOM 1031 H HIS A 69 35.287 5.970 1.977 1.00 0.00 H ATOM 1032 N LYS A 70 37.338 8.980 4.154 1.00 52.81 N ATOM 1033 CA LYS A 70 38.194 8.969 5.332 1.00 52.95 C ATOM 1034 C LYS A 70 37.456 9.563 6.522 1.00 52.53 C ATOM 1035 O LYS A 70 36.864 10.633 6.426 1.00 53.25 O ATOM 1036 CB LYS A 70 39.461 9.785 5.071 1.00 53.83 C ATOM 1037 CG LYS A 70 40.440 9.196 4.055 1.00 54.79 C ATOM 1038 CD LYS A 70 41.661 10.111 3.896 1.00 54.81 C ATOM 1039 CE LYS A 70 42.968 9.340 3.714 1.00 57.60 C ATOM 1040 NZ LYS A 70 44.087 9.897 4.545 1.00 59.31 N ATOM 1041 HA LYS A 70 38.465 7.936 5.551 1.00 0.00 H ATOM 1042 HB2 LYS A 70 39.157 10.768 4.711 1.00 0.00 H ATOM 1043 HB3 LYS A 70 39.989 9.894 6.018 1.00 0.00 H ATOM 1044 HG2 LYS A 70 40.768 8.215 4.399 1.00 0.00 H ATOM 1045 HG3 LYS A 70 39.940 9.093 3.092 1.00 0.00 H ATOM 1046 HD2 LYS A 70 41.508 10.746 3.023 1.00 0.00 H ATOM 1047 HD3 LYS A 70 41.746 10.734 4.786 1.00 0.00 H ATOM 1048 HE2 LYS A 70 43.257 9.385 2.664 1.00 0.00 H ATOM 1049 HE3 LYS A 70 42.804 8.301 4.000 1.00 0.00 H ATOM 1050 HZ1 LYS A 70 44.259 10.886 4.274 1.00 0.00 H ATOM 1051 HZ2 LYS A 70 43.826 9.852 5.551 1.00 0.00 H ATOM 1052 HZ3 LYS A 70 44.949 9.338 4.384 1.00 0.00 H ATOM 1053 H LYS A 70 37.351 9.811 3.529 1.00 0.00 H ATOM 1054 N ALA A 71 37.465 8.864 7.648 1.00 51.64 N ATOM 1055 CA ALA A 71 37.004 9.454 8.894 1.00 51.18 C ATOM 1056 C ALA A 71 38.047 9.230 9.978 1.00 50.78 C ATOM 1057 O ALA A 71 38.896 8.347 9.873 1.00 50.55 O ATOM 1058 CB ALA A 71 35.657 8.873 9.306 1.00 50.85 C ATOM 1059 HA ALA A 71 36.868 10.526 8.750 1.00 0.00 H ATOM 1060 HB1 ALA A 71 34.921 9.077 8.528 1.00 0.00 H ATOM 1061 HB2 ALA A 71 35.754 7.796 9.443 1.00 0.00 H ATOM 1062 HB3 ALA A 71 35.336 9.332 10.241 1.00 0.00 H ATOM 1063 H ALA A 71 37.806 7.882 7.640 1.00 0.00 H ATOM 1064 N ILE A 72 37.978 10.071 11.001 1.00 50.65 N ATOM 1065 CA ILE A 72 38.795 9.956 12.195 1.00 50.21 C ATOM 1066 C ILE A 72 37.887 10.303 13.366 1.00 50.24 C ATOM 1067 O ILE A 72 37.449 11.448 13.532 1.00 50.35 O ATOM 1068 CB ILE A 72 40.027 10.892 12.213 1.00 50.01 C ATOM 1069 CG1 ILE A 72 40.719 10.949 10.849 1.00 48.91 C ATOM 1070 CG2 ILE A 72 41.028 10.441 13.280 1.00 49.27 C ATOM 1071 CD1 ILE A 72 41.988 11.764 10.866 1.00 50.78 C ATOM 1072 HA ILE A 72 39.198 8.944 12.241 1.00 0.00 H ATOM 1073 HB ILE A 72 39.667 11.893 12.452 1.00 0.00 H ATOM 1074 HG12 ILE A 72 40.963 9.933 10.540 1.00 0.00 H ATOM 1075 HG13 ILE A 72 40.031 11.391 10.128 1.00 0.00 H ATOM 1076 HD11 ILE A 72 41.757 12.787 11.164 1.00 0.00 H ATOM 1077 HD12 ILE A 72 42.690 11.327 11.576 1.00 0.00 H ATOM 1078 HD13 ILE A 72 42.431 11.766 9.870 1.00 0.00 H ATOM 1079 HG21 ILE A 72 40.549 10.466 14.259 1.00 0.00 H ATOM 1080 HG22 ILE A 72 41.358 9.425 13.061 1.00 0.00 H ATOM 1081 HG23 ILE A 72 41.887 11.112 13.277 1.00 0.00 H ATOM 1082 H ILE A 72 37.300 10.858 10.944 1.00 0.00 H ATOM 1083 N GLY A 73 37.613 9.304 14.194 1.00 50.73 N ATOM 1084 CA GLY A 73 36.766 9.545 15.354 1.00 51.03 C ATOM 1085 C GLY A 73 36.724 8.395 16.325 1.00 50.70 C ATOM 1086 O GLY A 73 37.631 7.562 16.392 1.00 50.60 O ATOM 1087 HA3 GLY A 73 35.752 9.738 15.005 1.00 0.00 H ATOM 1088 HA2 GLY A 73 37.142 10.424 15.878 1.00 0.00 H ATOM 1089 H GLY A 73 38.000 8.355 14.016 1.00 0.00 H ATOM 1090 N THR A 74 35.647 8.357 17.091 1.00 51.38 N ATOM 1091 CA THR A 74 35.554 7.408 18.190 1.00 51.74 C ATOM 1092 C THR A 74 35.039 6.074 17.696 1.00 51.39 C ATOM 1093 O THR A 74 34.042 5.985 16.964 1.00 52.48 O ATOM 1094 CB THR A 74 34.667 7.928 19.331 1.00 51.39 C ATOM 1095 OG1 THR A 74 35.257 9.117 19.858 1.00 51.79 O ATOM 1096 CG2 THR A 74 34.540 6.899 20.437 1.00 52.71 C ATOM 1097 HA THR A 74 36.560 7.280 18.589 1.00 0.00 H ATOM 1098 HB THR A 74 33.670 8.131 18.940 1.00 0.00 H ATOM 1099 HG1 THR A 74 36.163 8.911 20.201 1.00 0.00 H ATOM 1100 HG23 THR A 74 34.090 5.991 20.037 1.00 0.00 H ATOM 1101 HG21 THR A 74 35.529 6.671 20.835 1.00 0.00 H ATOM 1102 HG22 THR A 74 33.910 7.298 21.232 1.00 0.00 H ATOM 1103 H THR A 74 34.860 9.011 16.906 1.00 0.00 H ATOM 1104 N VAL A 75 35.731 5.032 18.132 1.00 51.44 N ATOM 1105 CA VAL A 75 35.397 3.673 17.765 1.00 50.75 C ATOM 1106 C VAL A 75 35.317 2.829 19.039 1.00 49.90 C ATOM 1107 O VAL A 75 36.219 2.856 19.886 1.00 49.72 O ATOM 1108 CB VAL A 75 36.431 3.130 16.778 1.00 51.96 C ATOM 1109 CG1 VAL A 75 36.187 1.674 16.484 1.00 53.27 C ATOM 1110 CG2 VAL A 75 36.427 3.957 15.494 1.00 53.18 C ATOM 1111 HA VAL A 75 34.429 3.636 17.266 1.00 0.00 H ATOM 1112 HB VAL A 75 37.417 3.213 17.236 1.00 0.00 H ATOM 1113 HG11 VAL A 75 36.253 1.102 17.409 1.00 0.00 H ATOM 1114 HG12 VAL A 75 35.194 1.554 16.051 1.00 0.00 H ATOM 1115 HG13 VAL A 75 36.938 1.316 15.779 1.00 0.00 H ATOM 1116 HG21 VAL A 75 35.439 3.910 15.036 1.00 0.00 H ATOM 1117 HG22 VAL A 75 36.670 4.993 15.730 1.00 0.00 H ATOM 1118 HG23 VAL A 75 37.169 3.556 14.803 1.00 0.00 H ATOM 1119 H VAL A 75 36.543 5.197 18.760 1.00 0.00 H ATOM 1120 N LEU A 76 34.198 2.134 19.206 1.00 47.89 N ATOM 1121 CA LEU A 76 33.995 1.313 20.388 1.00 47.92 C ATOM 1122 C LEU A 76 34.210 -0.110 19.922 1.00 47.06 C ATOM 1123 O LEU A 76 33.839 -0.452 18.795 1.00 46.55 O ATOM 1124 CB LEU A 76 32.585 1.470 20.977 1.00 47.67 C ATOM 1125 CG LEU A 76 32.073 2.900 21.118 1.00 47.94 C ATOM 1126 CD1 LEU A 76 30.602 2.890 21.547 1.00 47.72 C ATOM 1127 CD2 LEU A 76 32.957 3.656 22.112 1.00 47.37 C ATOM 1128 HA LEU A 76 34.680 1.608 21.183 1.00 0.00 H ATOM 1129 HB2 LEU A 76 31.892 0.930 20.332 1.00 0.00 H ATOM 1130 HB3 LEU A 76 32.585 1.017 21.968 1.00 0.00 H ATOM 1131 HG LEU A 76 32.126 3.415 20.159 1.00 0.00 H ATOM 1132 HD21 LEU A 76 32.921 3.157 23.080 1.00 0.00 H ATOM 1133 HD22 LEU A 76 33.984 3.669 21.746 1.00 0.00 H ATOM 1134 HD23 LEU A 76 32.594 4.678 22.215 1.00 0.00 H ATOM 1135 HD11 LEU A 76 30.009 2.369 20.795 1.00 0.00 H ATOM 1136 HD12 LEU A 76 30.508 2.379 22.505 1.00 0.00 H ATOM 1137 HD13 LEU A 76 30.246 3.916 21.645 1.00 0.00 H ATOM 1138 H LEU A 76 33.455 2.178 18.480 1.00 0.00 H ATOM 1139 N VAL A 77 34.820 -0.916 20.782 1.00 45.51 N ATOM 1140 CA VAL A 77 35.086 -2.305 20.458 1.00 45.80 C ATOM 1141 C VAL A 77 34.515 -3.155 21.576 1.00 45.77 C ATOM 1142 O VAL A 77 34.773 -2.906 22.749 1.00 44.87 O ATOM 1143 CB VAL A 77 36.599 -2.572 20.329 1.00 45.74 C ATOM 1144 CG1 VAL A 77 36.917 -4.069 20.316 1.00 46.95 C ATOM 1145 CG2 VAL A 77 37.169 -1.871 19.105 1.00 44.70 C ATOM 1146 HA VAL A 77 34.626 -2.549 19.500 1.00 0.00 H ATOM 1147 HB VAL A 77 37.082 -2.155 21.213 1.00 0.00 H ATOM 1148 HG11 VAL A 77 36.569 -4.521 21.245 1.00 0.00 H ATOM 1149 HG12 VAL A 77 36.414 -4.539 19.471 1.00 0.00 H ATOM 1150 HG13 VAL A 77 37.994 -4.210 20.224 1.00 0.00 H ATOM 1151 HG21 VAL A 77 36.669 -2.241 18.210 1.00 0.00 H ATOM 1152 HG22 VAL A 77 37.008 -0.797 19.195 1.00 0.00 H ATOM 1153 HG23 VAL A 77 38.238 -2.075 19.036 1.00 0.00 H ATOM 1154 H VAL A 77 35.114 -0.544 21.708 1.00 0.00 H ATOM 1155 N GLY A 78 33.699 -4.125 21.194 1.00 46.12 N ATOM 1156 CA GLY A 78 33.161 -5.099 22.130 1.00 45.86 C ATOM 1157 C GLY A 78 32.237 -6.060 21.408 1.00 46.07 C ATOM 1158 O GLY A 78 32.271 -6.131 20.166 1.00 46.08 O ATOM 1159 HA3 GLY A 78 32.604 -4.580 22.910 1.00 0.00 H ATOM 1160 HA2 GLY A 78 33.981 -5.657 22.581 1.00 0.00 H ATOM 1161 H GLY A 78 33.434 -4.193 20.191 1.00 0.00 H ATOM 1162 N PRO A 79 31.377 -6.761 22.171 1.00 45.04 N ATOM 1163 CA PRO A 79 30.546 -7.861 21.684 1.00 45.29 C ATOM 1164 C PRO A 79 29.307 -7.433 20.897 1.00 45.51 C ATOM 1165 O PRO A 79 28.192 -7.797 21.230 1.00 45.22 O ATOM 1166 CB PRO A 79 30.154 -8.600 22.968 1.00 45.28 C ATOM 1167 CG PRO A 79 30.218 -7.587 24.062 1.00 43.83 C ATOM 1168 CD PRO A 79 31.149 -6.487 23.602 1.00 46.23 C ATOM 1169 HA PRO A 79 31.094 -8.466 20.962 1.00 0.00 H ATOM 1170 HD3 PRO A 79 30.686 -5.510 23.737 1.00 0.00 H ATOM 1171 HD2 PRO A 79 32.088 -6.522 24.154 1.00 0.00 H ATOM 1172 HG3 PRO A 79 30.603 -8.045 24.973 1.00 0.00 H ATOM 1173 HG2 PRO A 79 29.225 -7.180 24.253 1.00 0.00 H ATOM 1174 HB2 PRO A 79 29.144 -9.001 22.881 1.00 0.00 H ATOM 1175 HB3 PRO A 79 30.851 -9.414 23.164 1.00 0.00 H ATOM 1176 N THR A 80 29.504 -6.624 19.867 1.00 46.38 N ATOM 1177 CA THR A 80 28.427 -6.302 18.944 1.00 46.58 C ATOM 1178 C THR A 80 28.153 -7.492 18.018 1.00 47.08 C ATOM 1179 O THR A 80 29.083 -8.205 17.639 1.00 48.21 O ATOM 1180 CB THR A 80 28.780 -5.054 18.136 1.00 46.47 C ATOM 1181 OG1 THR A 80 27.728 -4.783 17.207 1.00 46.87 O ATOM 1182 CG2 THR A 80 30.122 -5.227 17.419 1.00 46.99 C ATOM 1183 HA THR A 80 27.521 -6.095 19.514 1.00 0.00 H ATOM 1184 HB THR A 80 28.884 -4.205 18.812 1.00 0.00 H ATOM 1185 HG1 THR A 80 27.621 -5.555 16.597 1.00 0.00 H ATOM 1186 HG23 THR A 80 30.901 -5.432 18.153 1.00 0.00 H ATOM 1187 HG21 THR A 80 30.053 -6.059 16.718 1.00 0.00 H ATOM 1188 HG22 THR A 80 30.363 -4.313 16.877 1.00 0.00 H ATOM 1189 H THR A 80 30.446 -6.211 19.715 1.00 0.00 H ATOM 1190 N PRO A 81 26.876 -7.741 17.678 1.00 47.35 N ATOM 1191 CA PRO A 81 26.532 -8.818 16.758 1.00 47.06 C ATOM 1192 C PRO A 81 27.146 -8.675 15.369 1.00 47.30 C ATOM 1193 O PRO A 81 27.367 -9.675 14.691 1.00 46.63 O ATOM 1194 CB PRO A 81 25.010 -8.699 16.638 1.00 47.32 C ATOM 1195 CG PRO A 81 24.587 -8.008 17.886 1.00 47.87 C ATOM 1196 CD PRO A 81 25.671 -7.026 18.130 1.00 47.30 C ATOM 1197 HA PRO A 81 26.904 -9.771 17.133 1.00 0.00 H ATOM 1198 HD3 PRO A 81 25.514 -6.117 17.550 1.00 0.00 H ATOM 1199 HD2 PRO A 81 25.739 -6.773 19.188 1.00 0.00 H ATOM 1200 HG3 PRO A 81 24.508 -8.713 18.713 1.00 0.00 H ATOM 1201 HG2 PRO A 81 23.630 -7.505 17.747 1.00 0.00 H ATOM 1202 HB2 PRO A 81 24.738 -8.111 15.761 1.00 0.00 H ATOM 1203 HB3 PRO A 81 24.551 -9.685 16.570 1.00 0.00 H ATOM 1204 N VAL A 82 27.373 -7.436 14.947 1.00 46.99 N ATOM 1205 CA VAL A 82 27.966 -7.162 13.648 1.00 47.27 C ATOM 1206 C VAL A 82 28.752 -5.851 13.759 1.00 47.04 C ATOM 1207 O VAL A 82 28.497 -5.047 14.669 1.00 46.63 O ATOM 1208 CB VAL A 82 26.856 -7.152 12.557 1.00 47.73 C ATOM 1209 CG1 VAL A 82 26.017 -5.895 12.618 1.00 48.52 C ATOM 1210 CG2 VAL A 82 27.444 -7.342 11.174 1.00 48.62 C ATOM 1211 HA VAL A 82 28.667 -7.939 13.343 1.00 0.00 H ATOM 1212 HB VAL A 82 26.197 -7.995 12.764 1.00 0.00 H ATOM 1213 HG11 VAL A 82 25.538 -5.827 13.594 1.00 0.00 H ATOM 1214 HG12 VAL A 82 26.656 -5.025 12.464 1.00 0.00 H ATOM 1215 HG13 VAL A 82 25.255 -5.930 11.839 1.00 0.00 H ATOM 1216 HG21 VAL A 82 28.145 -6.534 10.965 1.00 0.00 H ATOM 1217 HG22 VAL A 82 27.966 -8.298 11.131 1.00 0.00 H ATOM 1218 HG23 VAL A 82 26.643 -7.330 10.435 1.00 0.00 H ATOM 1219 H VAL A 82 27.119 -6.638 15.564 1.00 0.00 H ATOM 1220 N ASN A 83 29.749 -5.650 12.901 1.00 46.89 N ATOM 1221 CA ASN A 83 30.414 -4.354 12.861 1.00 47.39 C ATOM 1222 C ASN A 83 29.407 -3.300 12.412 1.00 47.62 C ATOM 1223 O ASN A 83 28.710 -3.469 11.401 1.00 46.38 O ATOM 1224 CB ASN A 83 31.626 -4.324 11.919 1.00 47.58 C ATOM 1225 CG ASN A 83 32.750 -5.223 12.369 1.00 48.08 C ATOM 1226 OD1 ASN A 83 33.104 -5.265 13.551 1.00 48.32 O ATOM 1227 ND2 ASN A 83 33.339 -5.938 11.420 1.00 43.56 N ATOM 1228 HA ASN A 83 30.787 -4.150 13.865 1.00 0.00 H ATOM 1229 HB2 ASN A 83 31.303 -4.642 10.928 1.00 0.00 H ATOM 1230 HB3 ASN A 83 32.000 -3.301 11.867 1.00 0.00 H ATOM 1231 HD22 ASN A 83 33.007 -5.871 10.437 1.00 0.00 H ATOM 1232 HD21 ASN A 83 34.133 -6.566 11.659 1.00 0.00 H ATOM 1233 H ASN A 83 30.052 -6.413 12.263 1.00 0.00 H ATOM 1234 N ILE A 84 29.374 -2.199 13.159 1.00 47.46 N ATOM 1235 CA ILE A 84 28.396 -1.145 12.971 1.00 47.72 C ATOM 1236 C ILE A 84 29.072 0.211 12.814 1.00 46.87 C ATOM 1237 O ILE A 84 29.797 0.655 13.708 1.00 48.77 O ATOM 1238 CB ILE A 84 27.468 -1.100 14.192 1.00 48.34 C ATOM 1239 CG1 ILE A 84 26.456 -2.246 14.118 1.00 48.87 C ATOM 1240 CG2 ILE A 84 26.746 0.225 14.269 1.00 50.33 C ATOM 1241 CD1 ILE A 84 25.868 -2.633 15.470 1.00 50.15 C ATOM 1242 HA ILE A 84 27.830 -1.357 12.064 1.00 0.00 H ATOM 1243 HB ILE A 84 28.074 -1.212 15.091 1.00 0.00 H ATOM 1244 HG12 ILE A 84 25.640 -1.943 13.462 1.00 0.00 H ATOM 1245 HG13 ILE A 84 26.955 -3.119 13.697 1.00 0.00 H ATOM 1246 HD11 ILE A 84 26.670 -2.950 16.136 1.00 0.00 H ATOM 1247 HD12 ILE A 84 25.355 -1.773 15.901 1.00 0.00 H ATOM 1248 HD13 ILE A 84 25.160 -3.451 15.336 1.00 0.00 H ATOM 1249 HG21 ILE A 84 27.476 1.031 14.352 1.00 0.00 H ATOM 1250 HG22 ILE A 84 26.149 0.365 13.368 1.00 0.00 H ATOM 1251 HG23 ILE A 84 26.094 0.232 15.143 1.00 0.00 H ATOM 1252 H ILE A 84 30.082 -2.090 13.912 1.00 0.00 H ATOM 1253 N ILE A 85 28.821 0.868 11.688 1.00 45.62 N ATOM 1254 CA ILE A 85 29.183 2.262 11.523 1.00 45.40 C ATOM 1255 C ILE A 85 28.007 3.166 11.907 1.00 44.87 C ATOM 1256 O ILE A 85 26.962 3.193 11.238 1.00 43.53 O ATOM 1257 CB ILE A 85 29.610 2.598 10.089 1.00 44.88 C ATOM 1258 CG1 ILE A 85 30.732 1.672 9.615 1.00 45.76 C ATOM 1259 CG2 ILE A 85 30.040 4.069 10.002 1.00 45.51 C ATOM 1260 CD1 ILE A 85 31.994 1.710 10.473 1.00 45.43 C ATOM 1261 HA ILE A 85 30.034 2.438 12.181 1.00 0.00 H ATOM 1262 HB ILE A 85 28.757 2.442 9.429 1.00 0.00 H ATOM 1263 HG12 ILE A 85 30.352 0.650 9.614 1.00 0.00 H ATOM 1264 HG13 ILE A 85 31.003 1.959 8.599 1.00 0.00 H ATOM 1265 HD11 ILE A 85 32.399 2.722 10.476 1.00 0.00 H ATOM 1266 HD12 ILE A 85 31.748 1.413 11.492 1.00 0.00 H ATOM 1267 HD13 ILE A 85 32.733 1.023 10.061 1.00 0.00 H ATOM 1268 HG21 ILE A 85 29.204 4.708 10.288 1.00 0.00 H ATOM 1269 HG22 ILE A 85 30.878 4.242 10.677 1.00 0.00 H ATOM 1270 HG23 ILE A 85 30.341 4.298 8.980 1.00 0.00 H ATOM 1271 H ILE A 85 28.353 0.370 10.904 1.00 0.00 H ATOM 1272 N GLY A 86 28.210 3.941 12.966 1.00 44.85 N ATOM 1273 CA GLY A 86 27.183 4.832 13.486 1.00 44.69 C ATOM 1274 C GLY A 86 27.284 6.290 13.062 1.00 45.16 C ATOM 1275 O GLY A 86 28.178 6.691 12.314 1.00 46.10 O ATOM 1276 HA3 GLY A 86 27.232 4.797 14.574 1.00 0.00 H ATOM 1277 HA2 GLY A 86 26.216 4.455 13.155 1.00 0.00 H ATOM 1278 H GLY A 86 29.135 3.910 13.440 1.00 0.00 H ATOM 1279 N ARG A 87 26.343 7.092 13.559 1.00 45.28 N ATOM 1280 CA ARG A 87 26.155 8.454 13.086 1.00 45.26 C ATOM 1281 C ARG A 87 27.392 9.335 13.293 1.00 46.11 C ATOM 1282 O ARG A 87 27.599 10.292 12.546 1.00 46.06 O ATOM 1283 CB ARG A 87 24.928 9.092 13.734 1.00 45.12 C ATOM 1284 CG ARG A 87 23.583 8.493 13.306 1.00 45.19 C ATOM 1285 CD ARG A 87 22.398 9.267 13.863 1.00 44.16 C ATOM 1286 NE ARG A 87 22.413 9.309 15.327 1.00 43.55 N ATOM 1287 CZ ARG A 87 22.847 10.326 16.074 1.00 43.66 C ATOM 1288 NH1 ARG A 87 23.322 11.446 15.539 1.00 42.41 N ATOM 1289 NH2 ARG A 87 22.828 10.207 17.390 1.00 42.93 N ATOM 1290 HA ARG A 87 25.993 8.386 12.010 1.00 0.00 H ATOM 1291 HB2 ARG A 87 25.020 8.980 14.814 1.00 0.00 H ATOM 1292 HB3 ARG A 87 24.923 10.152 13.479 1.00 0.00 H ATOM 1293 HG2 ARG A 87 23.526 8.502 12.218 1.00 0.00 H ATOM 1294 HG3 ARG A 87 23.528 7.465 13.663 1.00 0.00 H ATOM 1295 HD2 ARG A 87 21.477 8.787 13.533 1.00 0.00 H ATOM 1296 HD3 ARG A 87 22.432 10.287 13.480 1.00 0.00 H ATOM 1297 HE ARG A 87 22.054 8.472 15.829 1.00 0.00 H ATOM 1298 HH12 ARG A 87 23.651 12.217 16.154 1.00 0.00 H ATOM 1299 HH11 ARG A 87 23.364 11.551 14.505 1.00 0.00 H ATOM 1300 HH22 ARG A 87 23.162 10.990 17.988 1.00 0.00 H ATOM 1301 HH21 ARG A 87 22.479 9.331 17.828 1.00 0.00 H ATOM 1302 H ARG A 87 25.722 6.731 14.311 1.00 0.00 H ATOM 1303 N ASN A 88 28.215 9.016 14.290 1.00 47.02 N ATOM 1304 CA ASN A 88 29.398 9.818 14.569 1.00 47.09 C ATOM 1305 C ASN A 88 30.344 9.823 13.366 1.00 47.70 C ATOM 1306 O ASN A 88 30.970 10.840 13.097 1.00 49.16 O ATOM 1307 CB ASN A 88 30.119 9.342 15.839 1.00 47.77 C ATOM 1308 CG ASN A 88 30.808 7.969 15.681 1.00 47.86 C ATOM 1309 OD1 ASN A 88 30.198 6.991 15.243 1.00 47.31 O ATOM 1310 ND2 ASN A 88 32.081 7.900 16.081 1.00 48.07 N ATOM 1311 HA ASN A 88 29.070 10.842 14.749 1.00 0.00 H ATOM 1312 HB2 ASN A 88 30.877 10.080 16.102 1.00 0.00 H ATOM 1313 HB3 ASN A 88 29.388 9.270 16.644 1.00 0.00 H ATOM 1314 HD22 ASN A 88 32.559 8.749 16.444 1.00 0.00 H ATOM 1315 HD21 ASN A 88 32.594 6.997 16.029 1.00 0.00 H ATOM 1316 H ASN A 88 28.010 8.183 14.877 1.00 0.00 H ATOM 1317 N LEU A 89 30.429 8.709 12.641 1.00 46.73 N ATOM 1318 CA LEU A 89 31.285 8.614 11.457 1.00 46.60 C ATOM 1319 C LEU A 89 30.497 8.809 10.159 1.00 46.68 C ATOM 1320 O LEU A 89 31.039 9.256 9.154 1.00 47.16 O ATOM 1321 CB LEU A 89 32.016 7.266 11.435 1.00 47.28 C ATOM 1322 CG LEU A 89 32.882 6.973 12.673 1.00 47.44 C ATOM 1323 CD1 LEU A 89 33.751 5.740 12.484 1.00 49.10 C ATOM 1324 CD2 LEU A 89 33.776 8.155 13.061 1.00 47.47 C ATOM 1325 HA LEU A 89 32.016 9.420 11.520 1.00 0.00 H ATOM 1326 HB2 LEU A 89 31.268 6.477 11.351 1.00 0.00 H ATOM 1327 HB3 LEU A 89 32.663 7.246 10.558 1.00 0.00 H ATOM 1328 HG LEU A 89 32.173 6.792 13.481 1.00 0.00 H ATOM 1329 HD21 LEU A 89 34.444 8.391 12.233 1.00 0.00 H ATOM 1330 HD22 LEU A 89 33.154 9.021 13.285 1.00 0.00 H ATOM 1331 HD23 LEU A 89 34.364 7.891 13.940 1.00 0.00 H ATOM 1332 HD11 LEU A 89 33.115 4.874 12.301 1.00 0.00 H ATOM 1333 HD12 LEU A 89 34.415 5.892 11.633 1.00 0.00 H ATOM 1334 HD13 LEU A 89 34.344 5.574 13.383 1.00 0.00 H ATOM 1335 H LEU A 89 29.869 7.880 12.925 1.00 0.00 H ATOM 1336 N LEU A 90 29.218 8.460 10.156 1.00 46.28 N ATOM 1337 CA LEU A 90 28.402 8.700 8.978 1.00 46.25 C ATOM 1338 C LEU A 90 28.379 10.178 8.616 1.00 46.54 C ATOM 1339 O LEU A 90 28.406 10.542 7.446 1.00 46.29 O ATOM 1340 CB LEU A 90 26.984 8.168 9.190 1.00 45.66 C ATOM 1341 CG LEU A 90 26.859 6.648 9.299 1.00 44.59 C ATOM 1342 CD1 LEU A 90 25.410 6.271 9.524 1.00 44.40 C ATOM 1343 CD2 LEU A 90 27.425 6.000 8.057 1.00 43.60 C ATOM 1344 HA LEU A 90 28.849 8.162 8.142 1.00 0.00 H ATOM 1345 HB2 LEU A 90 26.596 8.604 10.111 1.00 0.00 H ATOM 1346 HB3 LEU A 90 26.373 8.496 8.349 1.00 0.00 H ATOM 1347 HG LEU A 90 27.433 6.286 10.152 1.00 0.00 H ATOM 1348 HD21 LEU A 90 26.872 6.347 7.184 1.00 0.00 H ATOM 1349 HD22 LEU A 90 28.476 6.270 7.954 1.00 0.00 H ATOM 1350 HD23 LEU A 90 27.333 4.917 8.140 1.00 0.00 H ATOM 1351 HD11 LEU A 90 25.055 6.731 10.446 1.00 0.00 H ATOM 1352 HD12 LEU A 90 24.810 6.625 8.686 1.00 0.00 H ATOM 1353 HD13 LEU A 90 25.326 5.187 9.601 1.00 0.00 H ATOM 1354 H LEU A 90 28.799 8.014 10.997 1.00 0.00 H ATOM 1355 N THR A 91 28.303 11.029 9.635 1.00 47.45 N ATOM 1356 CA THR A 91 28.281 12.453 9.425 1.00 47.29 C ATOM 1357 C THR A 91 29.629 12.892 8.867 1.00 47.66 C ATOM 1358 O THR A 91 29.691 13.749 7.992 1.00 47.28 O ATOM 1359 CB THR A 91 27.967 13.230 10.722 1.00 48.52 C ATOM 1360 OG1 THR A 91 28.936 12.915 11.735 1.00 47.53 O ATOM 1361 CG2 THR A 91 26.547 12.902 11.232 1.00 46.83 C ATOM 1362 HA THR A 91 27.484 12.679 8.716 1.00 0.00 H ATOM 1363 HB THR A 91 28.015 14.296 10.499 1.00 0.00 H ATOM 1364 HG1 THR A 91 28.724 13.419 12.561 1.00 0.00 H ATOM 1365 HG23 THR A 91 25.819 13.144 10.457 1.00 0.00 H ATOM 1366 HG21 THR A 91 26.485 11.841 11.472 1.00 0.00 H ATOM 1367 HG22 THR A 91 26.338 13.491 12.125 1.00 0.00 H ATOM 1368 H THR A 91 28.258 10.657 10.605 1.00 0.00 H ATOM 1369 N GLN A 92 30.711 12.312 9.365 1.00 46.97 N ATOM 1370 CA GLN A 92 32.014 12.689 8.841 1.00 46.87 C ATOM 1371 C GLN A 92 32.157 12.414 7.343 1.00 47.16 C ATOM 1372 O GLN A 92 32.774 13.224 6.659 1.00 46.25 O ATOM 1373 CB GLN A 92 33.161 12.026 9.591 1.00 45.76 C ATOM 1374 CG GLN A 92 33.334 12.520 11.004 1.00 45.58 C ATOM 1375 CD GLN A 92 34.656 12.072 11.585 1.00 45.70 C ATOM 1376 OE1 GLN A 92 35.579 11.744 10.840 1.00 44.36 O ATOM 1377 NE2 GLN A 92 34.748 12.022 12.912 1.00 40.93 N ATOM 1378 HA GLN A 92 32.075 13.766 8.997 1.00 0.00 H ATOM 1379 HB2 GLN A 92 32.975 10.952 9.623 1.00 0.00 H ATOM 1380 HB3 GLN A 92 34.085 12.218 9.045 1.00 0.00 H ATOM 1381 HG2 GLN A 92 33.296 13.609 11.007 1.00 0.00 H ATOM 1382 HG3 GLN A 92 32.524 12.128 11.619 1.00 0.00 H ATOM 1383 HE22 GLN A 92 33.940 12.310 13.500 1.00 0.00 H ATOM 1384 HE21 GLN A 92 35.628 11.695 13.360 1.00 0.00 H ATOM 1385 H GLN A 92 30.630 11.599 10.118 1.00 0.00 H ATOM 1386 N ILE A 93 31.642 11.286 6.844 1.00 47.53 N ATOM 1387 CA ILE A 93 31.754 10.995 5.401 1.00 47.71 C ATOM 1388 C ILE A 93 30.640 11.615 4.544 1.00 48.24 C ATOM 1389 O ILE A 93 30.549 11.320 3.356 1.00 46.84 O ATOM 1390 CB ILE A 93 31.837 9.484 5.095 1.00 48.43 C ATOM 1391 CG1 ILE A 93 30.562 8.746 5.511 1.00 48.05 C ATOM 1392 CG2 ILE A 93 33.058 8.859 5.780 1.00 47.99 C ATOM 1393 CD1 ILE A 93 30.603 7.264 5.175 1.00 48.42 C ATOM 1394 HA ILE A 93 32.694 11.471 5.122 1.00 0.00 H ATOM 1395 HB ILE A 93 31.943 9.379 4.015 1.00 0.00 H ATOM 1396 HG12 ILE A 93 30.431 8.856 6.588 1.00 0.00 H ATOM 1397 HG13 ILE A 93 29.714 9.197 4.995 1.00 0.00 H ATOM 1398 HD11 ILE A 93 30.724 7.140 4.099 1.00 0.00 H ATOM 1399 HD12 ILE A 93 31.442 6.799 5.692 1.00 0.00 H ATOM 1400 HD13 ILE A 93 29.672 6.795 5.494 1.00 0.00 H ATOM 1401 HG21 ILE A 93 33.964 9.343 5.416 1.00 0.00 H ATOM 1402 HG22 ILE A 93 32.978 8.997 6.858 1.00 0.00 H ATOM 1403 HG23 ILE A 93 33.096 7.794 5.551 1.00 0.00 H ATOM 1404 H ILE A 93 31.161 10.612 7.474 1.00 0.00 H ATOM 1405 N GLY A 94 29.763 12.402 5.165 1.00 48.34 N ATOM 1406 CA GLY A 94 28.755 13.162 4.444 1.00 49.32 C ATOM 1407 C GLY A 94 27.513 12.364 4.112 1.00 49.25 C ATOM 1408 O GLY A 94 26.800 12.690 3.166 1.00 48.16 O ATOM 1409 HA3 GLY A 94 29.194 13.519 3.512 1.00 0.00 H ATOM 1410 HA2 GLY A 94 28.463 14.015 5.057 1.00 0.00 H ATOM 1411 H GLY A 94 29.801 12.475 6.202 1.00 0.00 H ATOM 1412 N CYS A 95 27.246 11.334 4.906 1.00 50.41 N ATOM 1413 CA CYS A 95 26.160 10.413 4.617 1.00 50.92 C ATOM 1414 C CYS A 95 24.832 10.988 5.110 1.00 51.68 C ATOM 1415 O CYS A 95 24.726 11.464 6.251 1.00 52.14 O ATOM 1416 CB CYS A 95 26.440 9.034 5.230 1.00 51.53 C ATOM 1417 SG CYS A 95 25.184 7.796 4.822 1.00 53.87 S ATOM 1418 HA CYS A 95 26.088 10.282 3.537 1.00 0.00 H ATOM 1419 HB2 CYS A 95 26.482 9.140 6.314 1.00 0.00 H ATOM 1420 HB3 CYS A 95 27.404 8.682 4.863 1.00 0.00 H ATOM 1421 HG CYS A 95 25.516 6.594 5.413 1.00 0.00 H ATOM 1422 H CYS A 95 27.828 11.183 5.755 1.00 0.00 H ATOM 1423 N THR A 96 23.825 10.968 4.238 1.00 51.59 N ATOM 1424 CA THR A 96 22.463 11.332 4.628 1.00 51.58 C ATOM 1425 C THR A 96 21.438 10.276 4.228 1.00 52.45 C ATOM 1426 O THR A 96 21.709 9.393 3.402 1.00 52.79 O ATOM 1427 CB THR A 96 22.038 12.649 3.977 1.00 52.54 C ATOM 1428 OG1 THR A 96 22.118 12.521 2.552 1.00 50.00 O ATOM 1429 CG2 THR A 96 22.924 13.804 4.450 1.00 53.31 C ATOM 1430 HA THR A 96 22.484 11.423 5.714 1.00 0.00 H ATOM 1431 HB THR A 96 21.011 12.869 4.269 1.00 0.00 H ATOM 1432 HG1 THR A 96 23.049 12.308 2.293 1.00 0.00 H ATOM 1433 HG23 THR A 96 22.856 13.892 5.534 1.00 0.00 H ATOM 1434 HG21 THR A 96 23.958 13.608 4.165 1.00 0.00 H ATOM 1435 HG22 THR A 96 22.588 14.732 3.987 1.00 0.00 H ATOM 1436 H THR A 96 24.012 10.686 3.255 1.00 0.00 H ATOM 1437 N LEU A 97 20.249 10.383 4.814 1.00 52.95 N ATOM 1438 CA LEU A 97 19.099 9.591 4.383 1.00 51.69 C ATOM 1439 C LEU A 97 18.248 10.431 3.446 1.00 51.55 C ATOM 1440 O LEU A 97 17.999 11.604 3.714 1.00 50.34 O ATOM 1441 CB LEU A 97 18.226 9.180 5.568 1.00 52.28 C ATOM 1442 CG LEU A 97 18.652 8.010 6.447 1.00 51.73 C ATOM 1443 CD1 LEU A 97 17.802 8.015 7.694 1.00 53.00 C ATOM 1444 CD2 LEU A 97 18.492 6.699 5.713 1.00 52.87 C ATOM 1445 HA LEU A 97 19.473 8.694 3.890 1.00 0.00 H ATOM 1446 HB2 LEU A 97 18.144 10.051 6.218 1.00 0.00 H ATOM 1447 HB3 LEU A 97 17.243 8.933 5.167 1.00 0.00 H ATOM 1448 HG LEU A 97 19.705 8.117 6.709 1.00 0.00 H ATOM 1449 HD21 LEU A 97 17.447 6.566 5.433 1.00 0.00 H ATOM 1450 HD22 LEU A 97 19.111 6.708 4.816 1.00 0.00 H ATOM 1451 HD23 LEU A 97 18.803 5.880 6.362 1.00 0.00 H ATOM 1452 HD11 LEU A 97 17.947 8.954 8.227 1.00 0.00 H ATOM 1453 HD12 LEU A 97 16.753 7.911 7.417 1.00 0.00 H ATOM 1454 HD13 LEU A 97 18.094 7.183 8.335 1.00 0.00 H ATOM 1455 H LEU A 97 20.134 11.051 5.603 1.00 0.00 H ATOM 1456 N ASN A 98 17.775 9.821 2.367 1.00 51.09 N ATOM 1457 CA ASN A 98 17.050 10.554 1.340 1.00 51.01 C ATOM 1458 C ASN A 98 15.863 9.757 0.839 1.00 50.88 C ATOM 1459 O ASN A 98 15.974 8.561 0.558 1.00 50.66 O ATOM 1460 CB ASN A 98 17.958 10.895 0.153 1.00 51.03 C ATOM 1461 CG ASN A 98 19.090 11.828 0.526 1.00 51.56 C ATOM 1462 OD1 ASN A 98 18.981 13.043 0.382 1.00 52.46 O ATOM 1463 ND2 ASN A 98 20.182 11.265 0.999 1.00 51.43 N ATOM 1464 HA ASN A 98 16.698 11.479 1.797 1.00 0.00 H ATOM 1465 HB2 ASN A 98 18.383 9.970 -0.237 1.00 0.00 H ATOM 1466 HB3 ASN A 98 17.355 11.371 -0.621 1.00 0.00 H ATOM 1467 HD22 ASN A 98 20.230 10.231 1.104 1.00 0.00 H ATOM 1468 HD21 ASN A 98 20.996 11.854 1.267 1.00 0.00 H ATOM 1469 H ASN A 98 17.925 8.798 2.253 1.00 0.00 H ATOM 1470 N PHE A 99 14.725 10.429 0.716 1.00 50.88 N ATOM 1471 CA PHE A 99 13.568 9.818 0.084 1.00 51.26 C ATOM 1472 C PHE A 99 12.646 10.892 -0.453 1.00 50.55 C ATOM 1473 O PHE A 99 13.042 12.053 -0.493 1.00 50.65 O ATOM 1474 CB PHE A 99 12.828 8.888 1.054 1.00 51.95 C ATOM 1475 CG PHE A 99 12.228 9.579 2.247 1.00 51.22 C ATOM 1476 CD1 PHE A 99 13.030 9.977 3.308 1.00 53.20 C ATOM 1477 CD2 PHE A 99 10.859 9.728 2.359 1.00 51.82 C ATOM 1478 CE1 PHE A 99 12.483 10.568 4.431 1.00 53.26 C ATOM 1479 CE2 PHE A 99 10.295 10.310 3.482 1.00 52.78 C ATOM 1480 CZ PHE A 99 11.111 10.739 4.521 1.00 53.23 C ATOM 1481 HA PHE A 99 13.913 9.206 -0.749 1.00 0.00 H ATOM 1482 OXT PHE A 99 11.519 10.602 -0.843 1.00 49.93 O ATOM 1483 HB2 PHE A 99 12.025 8.395 0.507 1.00 0.00 H ATOM 1484 HB3 PHE A 99 13.534 8.140 1.414 1.00 0.00 H ATOM 1485 HD2 PHE A 99 10.213 9.382 1.552 1.00 0.00 H ATOM 1486 HE2 PHE A 99 9.214 10.431 3.550 1.00 0.00 H ATOM 1487 HZ PHE A 99 10.674 11.208 5.403 1.00 0.00 H ATOM 1488 HE1 PHE A 99 13.129 10.899 5.244 1.00 0.00 H ATOM 1489 HD1 PHE A 99 14.107 9.821 3.254 1.00 0.00 H ATOM 1490 H PHE A 99 14.661 11.403 1.076 1.00 0.00 H TER 1491 PHE A 99 ATOM 1492 N PRO B 1 12.567 14.130 1.304 1.00 54.06 N ATOM 1493 CA PRO B 1 13.438 14.931 2.145 1.00 53.94 C ATOM 1494 C PRO B 1 14.890 14.466 2.083 1.00 53.34 C ATOM 1495 O PRO B 1 15.171 13.393 1.549 1.00 52.69 O ATOM 1496 CB PRO B 1 12.875 14.685 3.546 1.00 53.88 C ATOM 1497 CG PRO B 1 11.427 14.293 3.332 1.00 54.45 C ATOM 1498 CD PRO B 1 11.206 14.075 1.858 1.00 54.63 C ATOM 1499 HA PRO B 1 13.455 15.978 1.841 1.00 0.00 H ATOM 1500 HD3 PRO B 1 10.746 13.105 1.670 1.00 0.00 H ATOM 1501 HD2 PRO B 1 10.579 14.861 1.436 1.00 0.00 H ATOM 1502 HG3 PRO B 1 10.773 15.089 3.689 1.00 0.00 H ATOM 1503 HG2 PRO B 1 11.210 13.374 3.877 1.00 0.00 H ATOM 1504 HB2 PRO B 1 13.419 13.881 4.041 1.00 0.00 H ATOM 1505 HB3 PRO B 1 12.941 15.591 4.149 1.00 0.00 H ATOM 1506 N GLN B 2 15.794 15.297 2.588 1.00 53.32 N ATOM 1507 CA GLN B 2 17.125 14.852 2.969 1.00 53.35 C ATOM 1508 C GLN B 2 17.275 15.014 4.483 1.00 53.32 C ATOM 1509 O GLN B 2 17.097 16.110 5.020 1.00 52.53 O ATOM 1510 CB GLN B 2 18.198 15.673 2.267 1.00 53.53 C ATOM 1511 CG GLN B 2 19.612 15.303 2.709 1.00 53.07 C ATOM 1512 CD GLN B 2 20.667 15.984 1.866 1.00 54.35 C ATOM 1513 OE1 GLN B 2 21.323 16.930 2.308 1.00 57.39 O ATOM 1514 NE2 GLN B 2 20.809 15.531 0.630 1.00 54.68 N ATOM 1515 HA GLN B 2 17.248 13.809 2.677 1.00 0.00 H ATOM 1516 HB2 GLN B 2 18.115 15.509 1.193 1.00 0.00 H ATOM 1517 HB3 GLN B 2 18.029 16.727 2.486 1.00 0.00 H ATOM 1518 HG2 GLN B 2 19.745 15.602 3.749 1.00 0.00 H ATOM 1519 HG3 GLN B 2 19.736 14.223 2.624 1.00 0.00 H ATOM 1520 HE22 GLN B 2 20.234 14.730 0.300 1.00 0.00 H ATOM 1521 HE21 GLN B 2 21.496 15.976 -0.011 1.00 0.00 H ATOM 1522 H GLN B 2 15.542 16.298 2.715 1.00 0.00 H ATOM 1523 N ILE B 3 17.607 13.922 5.159 1.00 52.29 N ATOM 1524 CA ILE B 3 17.760 13.930 6.607 1.00 52.16 C ATOM 1525 C ILE B 3 19.235 13.742 6.940 1.00 51.24 C ATOM 1526 O ILE B 3 19.837 12.753 6.559 1.00 49.99 O ATOM 1527 CB ILE B 3 16.933 12.804 7.239 1.00 52.53 C ATOM 1528 CG1 ILE B 3 15.493 12.895 6.737 1.00 54.01 C ATOM 1529 CG2 ILE B 3 16.993 12.870 8.762 1.00 52.95 C ATOM 1530 CD1 ILE B 3 14.537 12.084 7.532 1.00 54.06 C ATOM 1531 HA ILE B 3 17.404 14.879 7.007 1.00 0.00 H ATOM 1532 HB ILE B 3 17.351 11.842 6.943 1.00 0.00 H ATOM 1533 HG12 ILE B 3 15.178 13.938 6.777 1.00 0.00 H ATOM 1534 HG13 ILE B 3 15.465 12.548 5.704 1.00 0.00 H ATOM 1535 HD11 ILE B 3 14.832 11.035 7.493 1.00 0.00 H ATOM 1536 HD12 ILE B 3 14.545 12.426 8.567 1.00 0.00 H ATOM 1537 HD13 ILE B 3 13.535 12.197 7.118 1.00 0.00 H ATOM 1538 HG21 ILE B 3 18.028 12.770 9.088 1.00 0.00 H ATOM 1539 HG22 ILE B 3 16.596 13.828 9.099 1.00 0.00 H ATOM 1540 HG23 ILE B 3 16.398 12.060 9.183 1.00 0.00 H ATOM 1541 H ILE B 3 17.763 13.034 4.640 1.00 0.00 H ATOM 1542 N THR B 4 19.825 14.718 7.620 1.00 50.74 N ATOM 1543 CA THR B 4 21.195 14.593 8.076 1.00 50.42 C ATOM 1544 C THR B 4 21.237 13.764 9.358 1.00 50.25 C ATOM 1545 O THR B 4 20.202 13.441 9.970 1.00 49.90 O ATOM 1546 CB THR B 4 21.851 15.958 8.318 1.00 50.95 C ATOM 1547 OG1 THR B 4 21.064 16.713 9.248 1.00 50.48 O ATOM 1548 CG2 THR B 4 22.014 16.710 7.012 1.00 51.29 C ATOM 1549 HA THR B 4 21.760 14.093 7.289 1.00 0.00 H ATOM 1550 HB THR B 4 22.844 15.806 8.741 1.00 0.00 H ATOM 1551 HG1 THR B 4 20.155 16.846 8.878 1.00 0.00 H ATOM 1552 HG23 THR B 4 22.615 16.115 6.324 1.00 0.00 H ATOM 1553 HG21 THR B 4 21.033 16.892 6.574 1.00 0.00 H ATOM 1554 HG22 THR B 4 22.511 17.661 7.202 1.00 0.00 H ATOM 1555 H THR B 4 19.295 15.588 7.829 1.00 0.00 H ATOM 1556 N LEU B 5 22.447 13.397 9.743 1.00 49.32 N ATOM 1557 CA LEU B 5 22.644 12.423 10.814 1.00 49.35 C ATOM 1558 C LEU B 5 23.369 13.005 12.036 1.00 48.73 C ATOM 1559 O LEU B 5 23.836 12.268 12.897 1.00 47.48 O ATOM 1560 CB LEU B 5 23.356 11.196 10.242 1.00 49.51 C ATOM 1561 CG LEU B 5 22.549 10.503 9.145 1.00 50.17 C ATOM 1562 CD1 LEU B 5 23.376 9.426 8.459 1.00 50.02 C ATOM 1563 CD2 LEU B 5 21.248 9.898 9.719 1.00 50.90 C ATOM 1564 HA LEU B 5 21.666 12.126 11.193 1.00 0.00 H ATOM 1565 HB2 LEU B 5 24.313 11.511 9.825 1.00 0.00 H ATOM 1566 HB3 LEU B 5 23.529 10.485 11.050 1.00 0.00 H ATOM 1567 HG LEU B 5 22.282 11.255 8.402 1.00 0.00 H ATOM 1568 HD21 LEU B 5 21.497 9.167 10.488 1.00 0.00 H ATOM 1569 HD22 LEU B 5 20.641 10.692 10.154 1.00 0.00 H ATOM 1570 HD23 LEU B 5 20.691 9.410 8.919 1.00 0.00 H ATOM 1571 HD11 LEU B 5 24.260 9.879 8.011 1.00 0.00 H ATOM 1572 HD12 LEU B 5 23.681 8.681 9.194 1.00 0.00 H ATOM 1573 HD13 LEU B 5 22.777 8.949 7.683 1.00 0.00 H ATOM 1574 H LEU B 5 23.277 13.811 9.273 1.00 0.00 H ATOM 1575 N TRP B 6 23.388 14.334 12.146 1.00 48.60 N ATOM 1576 CA TRP B 6 23.942 15.001 13.331 1.00 48.34 C ATOM 1577 C TRP B 6 23.172 14.633 14.596 1.00 48.44 C ATOM 1578 O TRP B 6 23.731 14.563 15.699 1.00 48.05 O ATOM 1579 CB TRP B 6 23.846 16.508 13.154 1.00 47.46 C ATOM 1580 CG TRP B 6 24.607 17.048 11.995 1.00 46.32 C ATOM 1581 CD1 TRP B 6 24.087 17.585 10.855 1.00 45.64 C ATOM 1582 CD2 TRP B 6 26.027 17.149 11.881 1.00 44.66 C ATOM 1583 NE1 TRP B 6 25.099 18.011 10.032 1.00 45.57 N ATOM 1584 CE2 TRP B 6 26.301 17.765 10.641 1.00 46.85 C ATOM 1585 CE3 TRP B 6 27.097 16.767 12.698 1.00 45.76 C ATOM 1586 CZ2 TRP B 6 27.597 17.982 10.187 1.00 46.66 C ATOM 1587 CZ3 TRP B 6 28.385 17.008 12.259 1.00 46.35 C ATOM 1588 CH2 TRP B 6 28.622 17.624 11.015 1.00 46.78 C ATOM 1589 HA TRP B 6 24.978 14.677 13.435 1.00 0.00 H ATOM 1590 HB2 TRP B 6 22.796 16.768 13.022 1.00 0.00 H ATOM 1591 HB3 TRP B 6 24.225 16.981 14.060 1.00 0.00 H ATOM 1592 HE1 TRP B 6 24.974 18.450 9.097 1.00 0.00 H ATOM 1593 HD1 TRP B 6 23.023 17.664 10.630 1.00 0.00 H ATOM 1594 HZ2 TRP B 6 27.788 18.421 9.208 1.00 0.00 H ATOM 1595 HH2 TRP B 6 29.649 17.820 10.706 1.00 0.00 H ATOM 1596 HZ3 TRP B 6 29.229 16.717 12.884 1.00 0.00 H ATOM 1597 HE3 TRP B 6 26.918 16.289 13.661 1.00 0.00 H ATOM 1598 H TRP B 6 23.001 14.912 11.373 1.00 0.00 H ATOM 1599 N LYS B 7 21.864 14.472 14.435 1.00 48.76 N ATOM 1600 CA LYS B 7 21.000 13.980 15.508 1.00 49.03 C ATOM 1601 C LYS B 7 20.318 12.693 15.062 1.00 47.96 C ATOM 1602 O LYS B 7 20.417 12.285 13.900 1.00 47.81 O ATOM 1603 CB LYS B 7 19.981 15.048 15.935 1.00 49.86 C ATOM 1604 CG LYS B 7 18.840 15.311 14.970 1.00 50.81 C ATOM 1605 CD LYS B 7 17.929 16.421 15.465 1.00 52.22 C ATOM 1606 CE LYS B 7 16.812 16.709 14.465 1.00 54.23 C ATOM 1607 NZ LYS B 7 15.955 17.865 14.851 1.00 56.83 N ATOM 1608 HA LYS B 7 21.609 13.762 16.385 1.00 0.00 H ATOM 1609 HB2 LYS B 7 19.548 14.734 16.884 1.00 0.00 H ATOM 1610 HB3 LYS B 7 20.520 15.985 16.076 1.00 0.00 H ATOM 1611 HG2 LYS B 7 19.254 15.598 14.003 1.00 0.00 H ATOM 1612 HG3 LYS B 7 18.255 14.398 14.857 1.00 0.00 H ATOM 1613 HD2 LYS B 7 17.487 16.121 16.415 1.00 0.00 H ATOM 1614 HD3 LYS B 7 18.518 17.326 15.610 1.00 0.00 H ATOM 1615 HE2 LYS B 7 16.182 15.823 14.386 1.00 0.00 H ATOM 1616 HE3 LYS B 7 17.262 16.921 13.495 1.00 0.00 H ATOM 1617 HZ1 LYS B 7 15.509 17.673 15.771 1.00 0.00 H ATOM 1618 HZ2 LYS B 7 16.541 18.721 14.921 1.00 0.00 H ATOM 1619 HZ3 LYS B 7 15.219 18.005 14.130 1.00 0.00 H ATOM 1620 H LYS B 7 21.439 14.704 13.514 1.00 0.00 H ATOM 1621 N ARG B 8 19.680 12.016 16.005 1.00 46.74 N ATOM 1622 CA ARG B 8 18.918 10.807 15.691 1.00 47.31 C ATOM 1623 C ARG B 8 17.855 11.128 14.660 1.00 46.74 C ATOM 1624 O ARG B 8 17.117 12.095 14.837 1.00 46.65 O ATOM 1625 CB ARG B 8 18.231 10.271 16.945 1.00 46.34 C ATOM 1626 CG ARG B 8 19.198 9.856 18.008 1.00 46.84 C ATOM 1627 CD ARG B 8 18.533 9.020 19.062 1.00 48.40 C ATOM 1628 NE ARG B 8 19.428 8.814 20.194 1.00 51.34 N ATOM 1629 CZ ARG B 8 19.270 7.873 21.123 1.00 51.94 C ATOM 1630 NH1 ARG B 8 18.253 7.017 21.069 1.00 51.80 N ATOM 1631 NH2 ARG B 8 20.151 7.784 22.109 1.00 51.69 N ATOM 1632 HA ARG B 8 19.607 10.057 15.303 1.00 0.00 H ATOM 1633 HB2 ARG B 8 17.585 11.051 17.348 1.00 0.00 H ATOM 1634 HB3 ARG B 8 17.627 9.407 16.668 1.00 0.00 H ATOM 1635 HG2 ARG B 8 20.000 9.277 17.551 1.00 0.00 H ATOM 1636 HG3 ARG B 8 19.616 10.748 18.475 1.00 0.00 H ATOM 1637 HD2 ARG B 8 18.265 8.053 18.636 1.00 0.00 H ATOM 1638 HD3 ARG B 8 17.631 9.527 19.406 1.00 0.00 H ATOM 1639 HE ARG B 8 20.248 9.447 20.282 1.00 0.00 H ATOM 1640 HH12 ARG B 8 18.147 6.289 21.804 1.00 0.00 H ATOM 1641 HH11 ARG B 8 17.564 7.076 20.292 1.00 0.00 H ATOM 1642 HH22 ARG B 8 20.040 7.054 22.841 1.00 0.00 H ATOM 1643 HH21 ARG B 8 20.953 8.444 22.150 1.00 0.00 H ATOM 1644 H ARG B 8 19.722 12.351 16.989 1.00 0.00 H ATOM 1645 N PRO B 9 17.794 10.357 13.563 1.00 47.07 N ATOM 1646 CA PRO B 9 16.782 10.647 12.539 1.00 47.80 C ATOM 1647 C PRO B 9 15.380 10.218 12.960 1.00 47.16 C ATOM 1648 O PRO B 9 14.875 9.181 12.531 1.00 46.29 O ATOM 1649 CB PRO B 9 17.283 9.849 11.337 1.00 47.09 C ATOM 1650 CG PRO B 9 17.974 8.680 11.960 1.00 47.05 C ATOM 1651 CD PRO B 9 18.673 9.247 13.146 1.00 47.39 C ATOM 1652 HA PRO B 9 16.678 11.714 12.341 1.00 0.00 H ATOM 1653 HD3 PRO B 9 18.765 8.503 13.938 1.00 0.00 H ATOM 1654 HD2 PRO B 9 19.664 9.614 12.877 1.00 0.00 H ATOM 1655 HG3 PRO B 9 18.689 8.240 11.265 1.00 0.00 H ATOM 1656 HG2 PRO B 9 17.252 7.923 12.264 1.00 0.00 H ATOM 1657 HB2 PRO B 9 16.452 9.523 10.711 1.00 0.00 H ATOM 1658 HB3 PRO B 9 17.977 10.439 10.739 1.00 0.00 H ATOM 1659 N LEU B 10 14.779 11.029 13.818 1.00 47.71 N ATOM 1660 CA LEU B 10 13.433 10.790 14.316 1.00 48.47 C ATOM 1661 C LEU B 10 12.385 11.431 13.409 1.00 48.66 C ATOM 1662 O LEU B 10 12.514 12.590 12.998 1.00 47.11 O ATOM 1663 CB LEU B 10 13.287 11.331 15.742 1.00 48.73 C ATOM 1664 CG LEU B 10 14.090 10.560 16.795 1.00 49.81 C ATOM 1665 CD1 LEU B 10 14.118 11.319 18.128 1.00 50.86 C ATOM 1666 CD2 LEU B 10 13.523 9.156 16.984 1.00 49.83 C ATOM 1667 HA LEU B 10 13.268 9.713 14.322 1.00 0.00 H ATOM 1668 HB2 LEU B 10 13.621 12.368 15.750 1.00 0.00 H ATOM 1669 HB3 LEU B 10 12.233 11.288 16.017 1.00 0.00 H ATOM 1670 HG LEU B 10 15.116 10.469 16.438 1.00 0.00 H ATOM 1671 HD21 LEU B 10 12.486 9.226 17.312 1.00 0.00 H ATOM 1672 HD22 LEU B 10 13.571 8.616 16.038 1.00 0.00 H ATOM 1673 HD23 LEU B 10 14.109 8.627 17.736 1.00 0.00 H ATOM 1674 HD11 LEU B 10 14.581 12.295 17.979 1.00 0.00 H ATOM 1675 HD12 LEU B 10 13.099 11.450 18.491 1.00 0.00 H ATOM 1676 HD13 LEU B 10 14.694 10.749 18.857 1.00 0.00 H ATOM 1677 H LEU B 10 15.291 11.872 14.149 1.00 0.00 H ATOM 1678 N VAL B 11 11.337 10.671 13.110 1.00 48.89 N ATOM 1679 CA VAL B 11 10.237 11.191 12.312 1.00 49.83 C ATOM 1680 C VAL B 11 8.890 10.799 12.897 1.00 50.64 C ATOM 1681 O VAL B 11 8.797 9.926 13.762 1.00 51.55 O ATOM 1682 CB VAL B 11 10.321 10.745 10.852 1.00 49.71 C ATOM 1683 CG1 VAL B 11 11.645 11.178 10.259 1.00 50.89 C ATOM 1684 CG2 VAL B 11 10.125 9.240 10.720 1.00 50.52 C ATOM 1685 HA VAL B 11 10.327 12.277 12.338 1.00 0.00 H ATOM 1686 HB VAL B 11 9.515 11.224 10.296 1.00 0.00 H ATOM 1687 HG11 VAL B 11 11.727 12.264 10.310 1.00 0.00 H ATOM 1688 HG12 VAL B 11 12.460 10.724 10.823 1.00 0.00 H ATOM 1689 HG13 VAL B 11 11.698 10.857 9.219 1.00 0.00 H ATOM 1690 HG21 VAL B 11 10.900 8.723 11.286 1.00 0.00 H ATOM 1691 HG22 VAL B 11 9.145 8.967 11.110 1.00 0.00 H ATOM 1692 HG23 VAL B 11 10.191 8.957 9.669 1.00 0.00 H ATOM 1693 H VAL B 11 11.302 9.689 13.452 1.00 0.00 H ATOM 1694 N THR B 12 7.852 11.490 12.445 1.00 51.26 N ATOM 1695 CA THR B 12 6.505 11.264 12.943 1.00 51.29 C ATOM 1696 C THR B 12 5.893 10.179 12.083 1.00 51.29 C ATOM 1697 O THR B 12 5.970 10.236 10.851 1.00 51.63 O ATOM 1698 CB THR B 12 5.673 12.554 12.874 1.00 51.64 C ATOM 1699 HA THR B 12 6.526 10.959 13.989 1.00 0.00 H ATOM 1700 HB THR B 12 6.148 13.324 13.482 1.00 0.00 H ATOM 1701 H THR B 12 8.006 12.214 11.714 1.00 0.00 H ATOM 1702 N ILE B 13 5.352 9.157 12.737 1.00 51.66 N ATOM 1703 CA ILE B 13 4.636 8.098 12.034 1.00 51.76 C ATOM 1704 C ILE B 13 3.204 8.019 12.552 1.00 51.97 C ATOM 1705 O ILE B 13 2.939 8.357 13.710 1.00 51.79 O ATOM 1706 CB ILE B 13 5.316 6.721 12.190 1.00 51.28 C ATOM 1707 CG1 ILE B 13 5.515 6.384 13.670 1.00 51.83 C ATOM 1708 CG2 ILE B 13 6.647 6.702 11.443 1.00 52.14 C ATOM 1709 CD1 ILE B 13 5.515 4.907 13.961 1.00 51.56 C ATOM 1710 HA ILE B 13 4.645 8.349 10.973 1.00 0.00 H ATOM 1711 HB ILE B 13 4.668 5.960 11.756 1.00 0.00 H ATOM 1712 HG12 ILE B 13 6.470 6.798 13.992 1.00 0.00 H ATOM 1713 HG13 ILE B 13 4.709 6.847 14.240 1.00 0.00 H ATOM 1714 HD11 ILE B 13 4.561 4.478 13.656 1.00 0.00 H ATOM 1715 HD12 ILE B 13 6.323 4.429 13.408 1.00 0.00 H ATOM 1716 HD13 ILE B 13 5.661 4.748 15.029 1.00 0.00 H ATOM 1717 HG21 ILE B 13 6.471 6.896 10.385 1.00 0.00 H ATOM 1718 HG22 ILE B 13 7.302 7.472 11.851 1.00 0.00 H ATOM 1719 HG23 ILE B 13 7.115 5.725 11.562 1.00 0.00 H ATOM 1720 H ILE B 13 5.441 9.111 13.772 1.00 0.00 H ATOM 1721 N ARG B 14 2.302 7.608 11.668 1.00 52.08 N ATOM 1722 CA ARG B 14 0.909 7.354 12.017 1.00 52.73 C ATOM 1723 C ARG B 14 0.596 5.875 11.816 1.00 52.44 C ATOM 1724 O ARG B 14 0.862 5.303 10.758 1.00 51.25 O ATOM 1725 CB ARG B 14 -0.037 8.218 11.177 1.00 52.84 C ATOM 1726 HA ARG B 14 0.758 7.618 13.064 1.00 0.00 H ATOM 1727 HB2 ARG B 14 0.181 9.271 11.355 1.00 0.00 H ATOM 1728 HB3 ARG B 14 0.106 7.989 10.121 1.00 0.00 H ATOM 1729 H ARG B 14 2.602 7.461 10.683 1.00 0.00 H ATOM 1730 N ILE B 15 0.063 5.264 12.866 1.00 52.88 N ATOM 1731 CA ILE B 15 -0.503 3.935 12.779 1.00 53.34 C ATOM 1732 C ILE B 15 -1.918 4.039 13.322 1.00 53.97 C ATOM 1733 O ILE B 15 -2.122 4.328 14.507 1.00 54.50 O ATOM 1734 CB ILE B 15 0.331 2.944 13.575 1.00 53.65 C ATOM 1735 HA ILE B 15 -0.512 3.570 11.752 1.00 0.00 H ATOM 1736 HB ILE B 15 1.346 2.923 13.177 1.00 0.00 H ATOM 1737 H ILE B 15 0.052 5.756 13.782 1.00 0.00 H ATOM 1738 N GLY B 16 -2.879 3.910 12.410 1.00 54.22 N ATOM 1739 CA GLY B 16 -4.300 3.892 12.733 1.00 54.69 C ATOM 1740 C GLY B 16 -4.776 5.009 13.639 1.00 54.83 C ATOM 1741 O GLY B 16 -5.529 4.766 14.579 1.00 55.59 O ATOM 1742 HA3 GLY B 16 -4.522 2.944 13.223 1.00 0.00 H ATOM 1743 HA2 GLY B 16 -4.858 3.956 11.799 1.00 0.00 H ATOM 1744 H GLY B 16 -2.601 3.817 11.412 1.00 0.00 H ATOM 1745 N GLY B 17 -4.349 6.234 13.364 1.00 54.84 N ATOM 1746 CA GLY B 17 -4.746 7.368 14.193 1.00 55.42 C ATOM 1747 C GLY B 17 -4.016 7.476 15.522 1.00 55.87 C ATOM 1748 O GLY B 17 -4.348 8.334 16.337 1.00 56.33 O ATOM 1749 HA3 GLY B 17 -5.813 7.280 14.399 1.00 0.00 H ATOM 1750 HA2 GLY B 17 -4.560 8.282 13.629 1.00 0.00 H ATOM 1751 H GLY B 17 -3.724 6.389 12.548 1.00 0.00 H ATOM 1752 N GLN B 18 -3.039 6.602 15.754 1.00 55.88 N ATOM 1753 CA GLN B 18 -2.114 6.756 16.862 1.00 56.07 C ATOM 1754 C GLN B 18 -0.815 7.229 16.233 1.00 56.42 C ATOM 1755 O GLN B 18 -0.254 6.546 15.372 1.00 57.75 O ATOM 1756 CB GLN B 18 -1.912 5.439 17.593 1.00 56.19 C ATOM 1757 HA GLN B 18 -2.488 7.461 17.604 1.00 0.00 H ATOM 1758 HB2 GLN B 18 -2.869 5.091 17.982 1.00 0.00 H ATOM 1759 HB3 GLN B 18 -1.509 4.699 16.901 1.00 0.00 H ATOM 1760 H GLN B 18 -2.935 5.783 15.121 1.00 0.00 H ATOM 1761 N LEU B 19 -0.342 8.398 16.648 1.00 56.42 N ATOM 1762 CA LEU B 19 0.808 9.012 15.999 1.00 56.22 C ATOM 1763 C LEU B 19 1.972 9.115 16.971 1.00 55.87 C ATOM 1764 O LEU B 19 1.851 9.734 18.031 1.00 56.09 O ATOM 1765 CB LEU B 19 0.448 10.382 15.432 1.00 56.88 C ATOM 1766 CG LEU B 19 -0.331 10.298 14.118 1.00 58.33 C ATOM 1767 CD1 LEU B 19 -1.831 10.217 14.391 1.00 61.18 C ATOM 1768 CD2 LEU B 19 -0.020 11.472 13.198 1.00 58.08 C ATOM 1769 HA LEU B 19 1.111 8.377 15.166 1.00 0.00 H ATOM 1770 HB2 LEU B 19 -0.161 10.912 16.164 1.00 0.00 H ATOM 1771 HB3 LEU B 19 1.369 10.938 15.256 1.00 0.00 H ATOM 1772 HG LEU B 19 -0.014 9.389 13.607 1.00 0.00 H ATOM 1773 HD21 LEU B 19 -0.289 12.403 13.696 1.00 0.00 H ATOM 1774 HD22 LEU B 19 1.045 11.477 12.965 1.00 0.00 H ATOM 1775 HD23 LEU B 19 -0.594 11.372 12.277 1.00 0.00 H ATOM 1776 HD11 LEU B 19 -2.043 9.329 14.987 1.00 0.00 H ATOM 1777 HD12 LEU B 19 -2.148 11.106 14.936 1.00 0.00 H ATOM 1778 HD13 LEU B 19 -2.369 10.158 13.445 1.00 0.00 H ATOM 1779 H LEU B 19 -0.799 8.882 17.447 1.00 0.00 H ATOM 1780 N LYS B 20 3.089 8.501 16.575 1.00 54.60 N ATOM 1781 CA LYS B 20 4.262 8.330 17.414 1.00 53.13 C ATOM 1782 C LYS B 20 5.506 8.746 16.644 1.00 51.83 C ATOM 1783 O LYS B 20 5.455 9.037 15.451 1.00 51.48 O ATOM 1784 CB LYS B 20 4.383 6.884 17.861 1.00 53.23 C ATOM 1785 HA LYS B 20 4.161 8.959 18.299 1.00 0.00 H ATOM 1786 HB2 LYS B 20 3.495 6.605 18.428 1.00 0.00 H ATOM 1787 HB3 LYS B 20 4.474 6.241 16.986 1.00 0.00 H ATOM 1788 H LYS B 20 3.121 8.122 15.607 1.00 0.00 H ATOM 1789 N GLU B 21 6.623 8.795 17.353 1.00 50.77 N ATOM 1790 CA GLU B 21 7.877 9.216 16.752 1.00 49.98 C ATOM 1791 C GLU B 21 8.782 7.992 16.697 1.00 48.71 C ATOM 1792 O GLU B 21 8.850 7.210 17.652 1.00 47.97 O ATOM 1793 CB GLU B 21 8.509 10.369 17.537 1.00 50.34 C ATOM 1794 CG GLU B 21 7.619 11.616 17.633 1.00 52.61 C ATOM 1795 CD GLU B 21 7.724 12.570 16.440 1.00 55.49 C ATOM 1796 OE1 GLU B 21 6.661 12.979 15.904 1.00 53.31 O ATOM 1797 OE2 GLU B 21 8.864 12.947 16.068 1.00 58.13 O ATOM 1798 HA GLU B 21 7.714 9.601 15.745 1.00 0.00 H ATOM 1799 HB2 GLU B 21 8.723 10.020 18.547 1.00 0.00 H ATOM 1800 HB3 GLU B 21 9.441 10.649 17.046 1.00 0.00 H ATOM 1801 HG2 GLU B 21 6.583 11.288 17.716 1.00 0.00 H ATOM 1802 HG3 GLU B 21 7.898 12.165 18.532 1.00 0.00 H ATOM 1803 H GLU B 21 6.602 8.527 18.358 1.00 0.00 H ATOM 1804 N ALA B 22 9.435 7.818 15.552 1.00 46.85 N ATOM 1805 CA ALA B 22 10.203 6.612 15.274 1.00 45.91 C ATOM 1806 C ALA B 22 11.538 6.975 14.632 1.00 44.55 C ATOM 1807 O ALA B 22 11.660 7.993 13.950 1.00 43.44 O ATOM 1808 CB ALA B 22 9.425 5.689 14.374 1.00 44.57 C ATOM 1809 HA ALA B 22 10.395 6.097 16.215 1.00 0.00 H ATOM 1810 HB1 ALA B 22 8.491 5.411 14.861 1.00 0.00 H ATOM 1811 HB2 ALA B 22 9.209 6.197 13.434 1.00 0.00 H ATOM 1812 HB3 ALA B 22 10.014 4.793 14.177 1.00 0.00 H ATOM 1813 H ALA B 22 9.396 8.567 14.832 1.00 0.00 H ATOM 1814 N LEU B 23 12.522 6.113 14.864 1.00 44.12 N ATOM 1815 CA LEU B 23 13.871 6.286 14.351 1.00 43.89 C ATOM 1816 C LEU B 23 14.004 5.620 12.982 1.00 42.43 C ATOM 1817 O LEU B 23 13.659 4.469 12.836 1.00 41.30 O ATOM 1818 CB LEU B 23 14.822 5.643 15.359 1.00 44.30 C ATOM 1819 CG LEU B 23 16.329 5.763 15.205 1.00 44.59 C ATOM 1820 CD1 LEU B 23 16.792 7.199 15.257 1.00 47.15 C ATOM 1821 CD2 LEU B 23 16.991 4.949 16.313 1.00 44.85 C ATOM 1822 HA LEU B 23 14.108 7.342 14.224 1.00 0.00 H ATOM 1823 HB2 LEU B 23 14.576 6.068 16.332 1.00 0.00 H ATOM 1824 HB3 LEU B 23 14.595 4.577 15.362 1.00 0.00 H ATOM 1825 HG LEU B 23 16.614 5.378 14.226 1.00 0.00 H ATOM 1826 HD21 LEU B 23 16.682 5.339 17.283 1.00 0.00 H ATOM 1827 HD22 LEU B 23 16.688 3.906 16.226 1.00 0.00 H ATOM 1828 HD23 LEU B 23 18.074 5.023 16.219 1.00 0.00 H ATOM 1829 HD11 LEU B 23 16.322 7.761 14.450 1.00 0.00 H ATOM 1830 HD12 LEU B 23 16.512 7.635 16.216 1.00 0.00 H ATOM 1831 HD13 LEU B 23 17.875 7.234 15.143 1.00 0.00 H ATOM 1832 H LEU B 23 12.317 5.273 15.441 1.00 0.00 H ATOM 1833 N LEU B 24 14.459 6.354 11.972 1.00 42.18 N ATOM 1834 CA LEU B 24 14.709 5.781 10.658 1.00 42.65 C ATOM 1835 C LEU B 24 16.038 5.036 10.723 1.00 42.53 C ATOM 1836 O LEU B 24 17.093 5.657 10.873 1.00 42.29 O ATOM 1837 CB LEU B 24 14.746 6.872 9.581 1.00 43.52 C ATOM 1838 CG LEU B 24 13.444 7.645 9.386 1.00 44.70 C ATOM 1839 CD1 LEU B 24 13.630 8.779 8.404 1.00 46.12 C ATOM 1840 CD2 LEU B 24 12.304 6.732 8.934 1.00 46.41 C ATOM 1841 HA LEU B 24 13.905 5.096 10.388 1.00 0.00 H ATOM 1842 HB2 LEU B 24 15.524 7.586 9.852 1.00 0.00 H ATOM 1843 HB3 LEU B 24 15.002 6.400 8.633 1.00 0.00 H ATOM 1844 HG LEU B 24 13.171 8.064 10.355 1.00 0.00 H ATOM 1845 HD21 LEU B 24 12.570 6.263 7.987 1.00 0.00 H ATOM 1846 HD22 LEU B 24 12.136 5.962 9.687 1.00 0.00 H ATOM 1847 HD23 LEU B 24 11.396 7.322 8.807 1.00 0.00 H ATOM 1848 HD11 LEU B 24 14.391 9.463 8.781 1.00 0.00 H ATOM 1849 HD12 LEU B 24 13.946 8.376 7.442 1.00 0.00 H ATOM 1850 HD13 LEU B 24 12.687 9.312 8.284 1.00 0.00 H ATOM 1851 H LEU B 24 14.642 7.366 12.125 1.00 0.00 H ATOM 1852 N ASN B 25 15.971 3.706 10.668 1.00 41.97 N ATOM 1853 CA ASN B 25 17.056 2.844 11.117 1.00 42.24 C ATOM 1854 C ASN B 25 17.480 1.821 10.051 1.00 41.70 C ATOM 1855 O ASN B 25 16.914 0.739 9.929 1.00 42.33 O ATOM 1856 CB ASN B 25 16.659 2.143 12.425 1.00 42.07 C ATOM 1857 CG ASN B 25 17.785 1.312 13.025 1.00 43.12 C ATOM 1858 OD1 ASN B 25 18.897 1.243 12.490 1.00 42.20 O ATOM 1859 ND2 ASN B 25 17.511 0.718 14.193 1.00 43.55 N ATOM 1860 HA ASN B 25 17.925 3.477 11.297 1.00 0.00 H ATOM 1861 HB2 ASN B 25 16.364 2.902 13.150 1.00 0.00 H ATOM 1862 HB3 ASN B 25 15.813 1.486 12.224 1.00 0.00 H ATOM 1863 HD22 ASN B 25 16.561 0.801 14.609 1.00 0.00 H ATOM 1864 HD21 ASN B 25 18.248 0.173 14.685 1.00 0.00 H ATOM 1865 H ASN B 25 15.109 3.265 10.289 1.00 0.00 H ATOM 1866 N THR B 26 18.536 2.171 9.325 1.00 42.11 N ATOM 1867 CA THR B 26 19.081 1.353 8.257 1.00 41.27 C ATOM 1868 C THR B 26 19.788 0.116 8.805 1.00 41.19 C ATOM 1869 O THR B 26 20.075 -0.824 8.054 1.00 39.24 O ATOM 1870 CB THR B 26 20.068 2.171 7.394 1.00 42.00 C ATOM 1871 OG1 THR B 26 21.151 2.640 8.205 1.00 40.35 O ATOM 1872 CG2 THR B 26 19.352 3.376 6.749 1.00 40.56 C ATOM 1873 HA THR B 26 18.244 1.027 7.639 1.00 0.00 H ATOM 1874 HB THR B 26 20.454 1.525 6.606 1.00 0.00 H ATOM 1875 HG1 THR B 26 21.625 1.866 8.600 1.00 0.00 H ATOM 1876 HG23 THR B 26 18.528 3.019 6.132 1.00 0.00 H ATOM 1877 HG21 THR B 26 18.965 4.029 7.532 1.00 0.00 H ATOM 1878 HG22 THR B 26 20.059 3.928 6.130 1.00 0.00 H ATOM 1879 H THR B 26 18.997 3.080 9.533 1.00 0.00 H ATOM 1880 N GLY B 27 20.080 0.130 10.105 1.00 40.73 N ATOM 1881 CA GLY B 27 20.650 -1.027 10.773 1.00 41.98 C ATOM 1882 C GLY B 27 19.647 -2.076 11.224 1.00 42.70 C ATOM 1883 O GLY B 27 20.039 -3.096 11.798 1.00 43.63 O ATOM 1884 HA3 GLY B 27 21.190 -0.676 11.653 1.00 0.00 H ATOM 1885 HA2 GLY B 27 21.349 -1.503 10.085 1.00 0.00 H ATOM 1886 H GLY B 27 19.895 0.992 10.656 1.00 0.00 H ATOM 1887 N ALA B 28 18.359 -1.830 10.999 1.00 43.19 N ATOM 1888 CA ALA B 28 17.312 -2.756 11.439 1.00 43.45 C ATOM 1889 C ALA B 28 16.678 -3.490 10.262 1.00 43.42 C ATOM 1890 O ALA B 28 16.187 -2.849 9.332 1.00 42.55 O ATOM 1891 CB ALA B 28 16.250 -2.001 12.197 1.00 43.83 C ATOM 1892 HA ALA B 28 17.775 -3.499 12.088 1.00 0.00 H ATOM 1893 HB1 ALA B 28 16.698 -1.522 13.068 1.00 0.00 H ATOM 1894 HB2 ALA B 28 15.812 -1.242 11.548 1.00 0.00 H ATOM 1895 HB3 ALA B 28 15.474 -2.695 12.521 1.00 0.00 H ATOM 1896 H ALA B 28 18.089 -0.959 10.499 1.00 0.00 H ATOM 1897 N ASP B 29 16.660 -4.822 10.300 1.00 42.98 N ATOM 1898 CA ASP B 29 15.936 -5.568 9.270 1.00 44.15 C ATOM 1899 C ASP B 29 14.431 -5.249 9.309 1.00 44.54 C ATOM 1900 O ASP B 29 13.783 -5.067 8.279 1.00 44.22 O ATOM 1901 CB ASP B 29 16.126 -7.083 9.419 1.00 43.38 C ATOM 1902 CG ASP B 29 17.575 -7.503 9.412 1.00 42.53 C ATOM 1903 OD1 ASP B 29 18.442 -6.736 8.926 1.00 39.31 O ATOM 1904 OD2 ASP B 29 17.832 -8.622 9.903 1.00 40.45 O ATOM 1905 HA ASP B 29 16.352 -5.255 8.313 1.00 0.00 H ATOM 1906 HB2 ASP B 29 15.678 -7.398 10.362 1.00 0.00 H ATOM 1907 HB3 ASP B 29 15.617 -7.579 8.593 1.00 0.00 H ATOM 1908 H ASP B 29 17.159 -5.329 11.059 1.00 0.00 H ATOM 1909 N ASP B 30 13.898 -5.173 10.525 1.00 45.38 N ATOM 1910 CA ASP B 30 12.465 -5.159 10.768 1.00 45.12 C ATOM 1911 C ASP B 30 12.059 -3.829 11.383 1.00 45.03 C ATOM 1912 O ASP B 30 12.896 -3.053 11.840 1.00 44.28 O ATOM 1913 CB ASP B 30 12.110 -6.284 11.748 1.00 45.73 C ATOM 1914 CG ASP B 30 12.503 -7.653 11.243 1.00 46.56 C ATOM 1915 OD1 ASP B 30 12.396 -7.919 10.030 1.00 48.35 O ATOM 1916 OD2 ASP B 30 12.895 -8.495 12.072 1.00 51.80 O ATOM 1917 HA ASP B 30 11.940 -5.301 9.824 1.00 0.00 H ATOM 1918 HB2 ASP B 30 12.626 -6.100 12.690 1.00 0.00 H ATOM 1919 HB3 ASP B 30 11.033 -6.271 11.916 1.00 0.00 H ATOM 1920 H ASP B 30 14.538 -5.121 11.343 1.00 0.00 H ATOM 1921 N THR B 31 10.754 -3.603 11.449 1.00 44.65 N ATOM 1922 CA THR B 31 10.210 -2.422 12.104 1.00 44.95 C ATOM 1923 C THR B 31 9.619 -2.846 13.444 1.00 44.74 C ATOM 1924 O THR B 31 8.832 -3.790 13.506 1.00 43.62 O ATOM 1925 CB THR B 31 9.148 -1.758 11.202 1.00 44.67 C ATOM 1926 OG1 THR B 31 9.807 -1.078 10.135 1.00 43.90 O ATOM 1927 CG2 THR B 31 8.271 -0.776 11.964 1.00 44.73 C ATOM 1928 HA THR B 31 10.995 -1.685 12.278 1.00 0.00 H ATOM 1929 HB THR B 31 8.497 -2.544 10.819 1.00 0.00 H ATOM 1930 HG1 THR B 31 10.336 -1.728 9.608 1.00 0.00 H ATOM 1931 HG23 THR B 31 7.768 -1.297 12.779 1.00 0.00 H ATOM 1932 HG21 THR B 31 8.891 0.024 12.370 1.00 0.00 H ATOM 1933 HG22 THR B 31 7.528 -0.354 11.287 1.00 0.00 H ATOM 1934 H THR B 31 10.100 -4.289 11.021 1.00 0.00 H ATOM 1935 N VAL B 32 10.028 -2.156 14.508 1.00 45.31 N ATOM 1936 CA VAL B 32 9.614 -2.494 15.862 1.00 46.57 C ATOM 1937 C VAL B 32 9.097 -1.273 16.604 1.00 46.44 C ATOM 1938 O VAL B 32 9.798 -0.260 16.746 1.00 44.94 O ATOM 1939 CB VAL B 32 10.762 -3.087 16.696 1.00 46.49 C ATOM 1940 CG1 VAL B 32 10.198 -3.845 17.873 1.00 48.29 C ATOM 1941 CG2 VAL B 32 11.602 -4.006 15.853 1.00 50.34 C ATOM 1942 HA VAL B 32 8.825 -3.237 15.747 1.00 0.00 H ATOM 1943 HB VAL B 32 11.390 -2.273 17.057 1.00 0.00 H ATOM 1944 HG11 VAL B 32 9.613 -3.167 18.494 1.00 0.00 H ATOM 1945 HG12 VAL B 32 9.559 -4.651 17.512 1.00 0.00 H ATOM 1946 HG13 VAL B 32 11.016 -4.263 18.460 1.00 0.00 H ATOM 1947 HG21 VAL B 32 10.981 -4.818 15.474 1.00 0.00 H ATOM 1948 HG22 VAL B 32 12.022 -3.447 15.017 1.00 0.00 H ATOM 1949 HG23 VAL B 32 12.409 -4.417 16.459 1.00 0.00 H ATOM 1950 H VAL B 32 10.666 -1.347 14.366 1.00 0.00 H ATOM 1951 N LEU B 33 7.878 -1.417 17.105 1.00 47.96 N ATOM 1952 CA LEU B 33 7.212 -0.391 17.869 1.00 49.13 C ATOM 1953 C LEU B 33 6.943 -0.865 19.289 1.00 50.29 C ATOM 1954 O LEU B 33 6.669 -2.048 19.519 1.00 49.41 O ATOM 1955 CB LEU B 33 5.881 -0.051 17.211 1.00 49.87 C ATOM 1956 CG LEU B 33 5.911 0.353 15.743 1.00 50.77 C ATOM 1957 CD1 LEU B 33 4.494 0.701 15.314 1.00 52.31 C ATOM 1958 CD2 LEU B 33 6.840 1.521 15.538 1.00 52.69 C ATOM 1959 HA LEU B 33 7.858 0.486 17.900 1.00 0.00 H ATOM 1960 HB2 LEU B 33 5.240 -0.928 17.297 1.00 0.00 H ATOM 1961 HB3 LEU B 33 5.441 0.775 17.769 1.00 0.00 H ATOM 1962 HG LEU B 33 6.284 -0.471 15.134 1.00 0.00 H ATOM 1963 HD21 LEU B 33 6.495 2.367 16.132 1.00 0.00 H ATOM 1964 HD22 LEU B 33 7.846 1.242 15.851 1.00 0.00 H ATOM 1965 HD23 LEU B 33 6.849 1.796 14.483 1.00 0.00 H ATOM 1966 HD11 LEU B 33 3.851 -0.168 15.450 1.00 0.00 H ATOM 1967 HD12 LEU B 33 4.124 1.527 15.922 1.00 0.00 H ATOM 1968 HD13 LEU B 33 4.495 0.993 14.264 1.00 0.00 H ATOM 1969 H LEU B 33 7.378 -2.313 16.939 1.00 0.00 H ATOM 1970 N GLU B 34 6.985 0.081 20.224 1.00 51.32 N ATOM 1971 CA GLU B 34 6.578 -0.173 21.596 1.00 53.28 C ATOM 1972 C GLU B 34 5.060 -0.300 21.711 1.00 53.93 C ATOM 1973 O GLU B 34 4.341 -0.050 20.743 1.00 54.60 O ATOM 1974 CB GLU B 34 7.058 0.970 22.480 1.00 53.59 C ATOM 1975 CG GLU B 34 7.285 0.570 23.908 1.00 55.07 C ATOM 1976 CD GLU B 34 7.053 1.705 24.882 1.00 55.24 C ATOM 1977 OE1 GLU B 34 6.399 2.723 24.540 1.00 60.79 O ATOM 1978 OE2 GLU B 34 7.502 1.554 26.025 1.00 56.59 O ATOM 1979 HA GLU B 34 7.023 -1.114 21.918 1.00 0.00 H ATOM 1980 HB2 GLU B 34 7.996 1.349 22.075 1.00 0.00 H ATOM 1981 HB3 GLU B 34 6.308 1.761 22.458 1.00 0.00 H ATOM 1982 HG2 GLU B 34 6.603 -0.244 24.154 1.00 0.00 H ATOM 1983 HG3 GLU B 34 8.314 0.226 24.014 1.00 0.00 H ATOM 1984 H GLU B 34 7.319 1.031 19.965 1.00 0.00 H ATOM 1985 N GLU B 35 4.600 -0.764 22.869 1.00 54.78 N ATOM 1986 CA GLU B 35 3.208 -0.629 23.327 1.00 55.92 C ATOM 1987 C GLU B 35 2.203 -0.217 22.259 1.00 56.34 C ATOM 1988 O GLU B 35 1.936 0.975 22.092 1.00 56.37 O ATOM 1989 CB GLU B 35 3.109 0.400 24.469 1.00 55.84 C ATOM 1990 CG GLU B 35 3.326 -0.151 25.882 1.00 56.99 C ATOM 1991 CD GLU B 35 3.069 0.886 26.969 1.00 56.46 C ATOM 1992 OE1 GLU B 35 2.827 2.068 26.639 1.00 59.54 O ATOM 1993 OE2 GLU B 35 3.119 0.528 28.162 1.00 55.94 O ATOM 1994 HA GLU B 35 2.944 -1.636 23.649 1.00 0.00 H ATOM 1995 HB2 GLU B 35 3.859 1.171 24.291 1.00 0.00 H ATOM 1996 HB3 GLU B 35 2.115 0.846 24.432 1.00 0.00 H ATOM 1997 HG2 GLU B 35 2.649 -0.991 26.036 1.00 0.00 H ATOM 1998 HG3 GLU B 35 4.357 -0.496 25.967 1.00 0.00 H ATOM 1999 H GLU B 35 5.270 -1.256 23.494 1.00 0.00 H ATOM 2000 N MET B 36 1.634 -1.189 21.553 1.00 57.17 N ATOM 2001 CA MET B 36 0.342 -0.968 20.914 1.00 58.30 C ATOM 2002 C MET B 36 -0.405 -2.233 20.502 1.00 58.40 C ATOM 2003 O MET B 36 0.162 -3.184 19.963 1.00 58.90 O ATOM 2004 CB MET B 36 0.441 0.008 19.740 1.00 58.54 C ATOM 2005 CG MET B 36 1.416 -0.357 18.657 1.00 58.95 C ATOM 2006 SD MET B 36 1.428 0.911 17.371 1.00 61.81 S ATOM 2007 CE MET B 36 -0.221 1.624 17.431 1.00 61.12 C ATOM 2008 HA MET B 36 -0.263 -0.518 21.701 1.00 0.00 H ATOM 2009 HB2 MET B 36 -0.547 0.085 19.287 1.00 0.00 H ATOM 2010 HB3 MET B 36 0.734 0.980 20.138 1.00 0.00 H ATOM 2011 HG2 MET B 36 1.126 -1.312 18.218 1.00 0.00 H ATOM 2012 HG3 MET B 36 2.414 -0.444 19.086 1.00 0.00 H ATOM 2013 HE1 MET B 36 -0.959 0.847 17.231 1.00 0.00 H ATOM 2014 HE2 MET B 36 -0.397 2.048 18.420 1.00 0.00 H ATOM 2015 HE3 MET B 36 -0.304 2.408 16.678 1.00 0.00 H ATOM 2016 H MET B 36 2.111 -2.108 21.456 1.00 0.00 H ATOM 2017 N ASN B 37 -1.706 -2.204 20.760 1.00 58.80 N ATOM 2018 CA ASN B 37 -2.571 -3.356 20.594 1.00 58.83 C ATOM 2019 C ASN B 37 -3.243 -3.236 19.240 1.00 58.78 C ATOM 2020 O ASN B 37 -4.384 -2.788 19.149 1.00 59.09 O ATOM 2021 CB ASN B 37 -3.620 -3.394 21.711 1.00 59.06 C ATOM 2022 HA ASN B 37 -1.994 -4.279 20.648 1.00 0.00 H ATOM 2023 HB2 ASN B 37 -3.119 -3.459 22.677 1.00 0.00 H ATOM 2024 HB3 ASN B 37 -4.222 -2.486 21.673 1.00 0.00 H ATOM 2025 H ASN B 37 -2.125 -1.314 21.097 1.00 0.00 H ATOM 2026 N LEU B 38 -2.542 -3.652 18.192 1.00 58.48 N ATOM 2027 CA LEU B 38 -3.077 -3.524 16.846 1.00 58.74 C ATOM 2028 C LEU B 38 -3.825 -4.790 16.396 1.00 58.06 C ATOM 2029 O LEU B 38 -3.751 -5.825 17.056 1.00 57.02 O ATOM 2030 CB LEU B 38 -1.966 -3.066 15.897 1.00 59.67 C ATOM 2031 CG LEU B 38 -0.870 -4.021 15.440 1.00 60.87 C ATOM 2032 CD1 LEU B 38 -1.340 -4.691 14.165 1.00 63.76 C ATOM 2033 CD2 LEU B 38 0.446 -3.287 15.189 1.00 59.32 C ATOM 2034 HA LEU B 38 -3.844 -2.750 16.829 1.00 0.00 H ATOM 2035 HB2 LEU B 38 -2.460 -2.708 14.994 1.00 0.00 H ATOM 2036 HB3 LEU B 38 -1.464 -2.233 16.389 1.00 0.00 H ATOM 2037 HG LEU B 38 -0.684 -4.757 16.222 1.00 0.00 H ATOM 2038 HD21 LEU B 38 0.299 -2.535 14.414 1.00 0.00 H ATOM 2039 HD22 LEU B 38 0.772 -2.803 16.110 1.00 0.00 H ATOM 2040 HD23 LEU B 38 1.203 -4.001 14.865 1.00 0.00 H ATOM 2041 HD11 LEU B 38 -2.261 -5.239 14.362 1.00 0.00 H ATOM 2042 HD12 LEU B 38 -1.523 -3.933 13.404 1.00 0.00 H ATOM 2043 HD13 LEU B 38 -0.573 -5.382 13.815 1.00 0.00 H ATOM 2044 H LEU B 38 -1.602 -4.073 18.335 1.00 0.00 H ATOM 2045 N PRO B 39 -4.630 -4.687 15.324 1.00 57.90 N ATOM 2046 CA PRO B 39 -5.576 -5.755 15.008 1.00 57.80 C ATOM 2047 C PRO B 39 -4.948 -6.942 14.288 1.00 57.88 C ATOM 2048 O PRO B 39 -3.861 -6.825 13.727 1.00 58.48 O ATOM 2049 CB PRO B 39 -6.585 -5.060 14.096 1.00 57.97 C ATOM 2050 CG PRO B 39 -5.790 -4.003 13.401 1.00 58.19 C ATOM 2051 CD PRO B 39 -4.712 -3.575 14.355 1.00 57.84 C ATOM 2052 HA PRO B 39 -6.000 -6.187 15.915 1.00 0.00 H ATOM 2053 HD3 PRO B 39 -3.763 -3.443 13.834 1.00 0.00 H ATOM 2054 HD2 PRO B 39 -4.983 -2.645 14.854 1.00 0.00 H ATOM 2055 HG3 PRO B 39 -6.429 -3.156 13.151 1.00 0.00 H ATOM 2056 HG2 PRO B 39 -5.347 -4.404 12.489 1.00 0.00 H ATOM 2057 HB2 PRO B 39 -7.004 -5.764 13.377 1.00 0.00 H ATOM 2058 HB3 PRO B 39 -7.391 -4.616 14.680 1.00 0.00 H ATOM 2059 N GLY B 40 -5.615 -8.089 14.342 1.00 57.72 N ATOM 2060 CA GLY B 40 -5.276 -9.216 13.479 1.00 57.35 C ATOM 2061 C GLY B 40 -4.425 -10.275 14.143 1.00 57.22 C ATOM 2062 O GLY B 40 -4.051 -10.156 15.313 1.00 57.37 O ATOM 2063 HA3 GLY B 40 -4.733 -8.833 12.615 1.00 0.00 H ATOM 2064 HA2 GLY B 40 -6.203 -9.682 13.146 1.00 0.00 H ATOM 2065 H GLY B 40 -6.400 -8.187 15.017 1.00 0.00 H ATOM 2066 N LYS B 41 -4.116 -11.317 13.380 1.00 56.67 N ATOM 2067 CA LYS B 41 -3.331 -12.430 13.894 1.00 56.76 C ATOM 2068 C LYS B 41 -1.906 -11.952 14.157 1.00 56.29 C ATOM 2069 O LYS B 41 -1.395 -11.086 13.444 1.00 56.25 O ATOM 2070 CB LYS B 41 -3.339 -13.584 12.900 1.00 56.64 C ATOM 2071 HA LYS B 41 -3.767 -12.788 14.827 1.00 0.00 H ATOM 2072 HB2 LYS B 41 -4.365 -13.915 12.738 1.00 0.00 H ATOM 2073 HB3 LYS B 41 -2.910 -13.251 11.955 1.00 0.00 H ATOM 2074 H LYS B 41 -4.442 -11.338 12.393 1.00 0.00 H ATOM 2075 N TRP B 42 -1.287 -12.474 15.211 1.00 56.41 N ATOM 2076 CA TRP B 42 0.129 -12.204 15.465 1.00 56.26 C ATOM 2077 C TRP B 42 0.880 -13.459 15.905 1.00 56.09 C ATOM 2078 O TRP B 42 0.311 -14.348 16.542 1.00 55.32 O ATOM 2079 CB TRP B 42 0.312 -11.096 16.506 1.00 57.08 C ATOM 2080 CG TRP B 42 -0.245 -11.427 17.855 1.00 58.20 C ATOM 2081 CD1 TRP B 42 -1.459 -11.043 18.355 1.00 58.70 C ATOM 2082 CD2 TRP B 42 0.388 -12.201 18.885 1.00 58.28 C ATOM 2083 NE1 TRP B 42 -1.619 -11.538 19.628 1.00 59.14 N ATOM 2084 CE2 TRP B 42 -0.504 -12.253 19.975 1.00 58.63 C ATOM 2085 CE3 TRP B 42 1.621 -12.853 18.992 1.00 57.77 C ATOM 2086 CZ2 TRP B 42 -0.201 -12.929 21.159 1.00 58.70 C ATOM 2087 CZ3 TRP B 42 1.921 -13.524 20.164 1.00 58.38 C ATOM 2088 CH2 TRP B 42 1.017 -13.553 21.235 1.00 58.43 C ATOM 2089 HA TRP B 42 0.553 -11.867 14.519 1.00 0.00 H ATOM 2090 HB2 TRP B 42 1.379 -10.901 16.614 1.00 0.00 H ATOM 2091 HB3 TRP B 42 -0.185 -10.197 16.141 1.00 0.00 H ATOM 2092 HE1 TRP B 42 -2.454 -11.392 20.231 1.00 0.00 H ATOM 2093 HD1 TRP B 42 -2.191 -10.435 17.823 1.00 0.00 H ATOM 2094 HZ2 TRP B 42 -0.906 -12.959 21.990 1.00 0.00 H ATOM 2095 HH2 TRP B 42 1.289 -14.083 22.148 1.00 0.00 H ATOM 2096 HZ3 TRP B 42 2.877 -14.039 20.256 1.00 0.00 H ATOM 2097 HE3 TRP B 42 2.333 -12.833 18.167 1.00 0.00 H ATOM 2098 H TRP B 42 -1.817 -13.084 15.866 1.00 0.00 H ATOM 2099 N LYS B 43 2.162 -13.501 15.548 1.00 55.11 N ATOM 2100 CA LYS B 43 3.036 -14.651 15.777 1.00 54.47 C ATOM 2101 C LYS B 43 4.203 -14.196 16.650 1.00 53.81 C ATOM 2102 O LYS B 43 4.805 -13.161 16.377 1.00 52.65 O ATOM 2103 CB LYS B 43 3.559 -15.182 14.448 1.00 54.03 C ATOM 2104 HA LYS B 43 2.483 -15.449 16.273 1.00 0.00 H ATOM 2105 HB2 LYS B 43 2.719 -15.488 13.825 1.00 0.00 H ATOM 2106 HB3 LYS B 43 4.122 -14.398 13.941 1.00 0.00 H ATOM 2107 H LYS B 43 2.566 -12.666 15.078 1.00 0.00 H ATOM 2108 N PRO B 44 4.523 -14.962 17.704 1.00 52.98 N ATOM 2109 CA PRO B 44 5.715 -14.644 18.484 1.00 52.47 C ATOM 2110 C PRO B 44 6.992 -14.660 17.638 1.00 51.66 C ATOM 2111 O PRO B 44 7.098 -15.400 16.665 1.00 51.89 O ATOM 2112 CB PRO B 44 5.748 -15.741 19.554 1.00 52.55 C ATOM 2113 CG PRO B 44 4.346 -16.304 19.602 1.00 52.70 C ATOM 2114 CD PRO B 44 3.803 -16.141 18.225 1.00 53.24 C ATOM 2115 HA PRO B 44 5.674 -13.637 18.899 1.00 0.00 H ATOM 2116 HD3 PRO B 44 4.009 -17.023 17.618 1.00 0.00 H ATOM 2117 HD2 PRO B 44 2.728 -15.962 18.249 1.00 0.00 H ATOM 2118 HG3 PRO B 44 3.738 -15.752 20.319 1.00 0.00 H ATOM 2119 HG2 PRO B 44 4.368 -17.358 19.881 1.00 0.00 H ATOM 2120 HB2 PRO B 44 6.461 -16.518 19.281 1.00 0.00 H ATOM 2121 HB3 PRO B 44 6.023 -15.321 20.522 1.00 0.00 H ATOM 2122 N LYS B 45 7.958 -13.836 18.010 1.00 51.11 N ATOM 2123 CA LYS B 45 9.233 -13.780 17.307 1.00 50.62 C ATOM 2124 C LYS B 45 10.284 -13.282 18.291 1.00 49.88 C ATOM 2125 O LYS B 45 9.962 -12.605 19.270 1.00 49.15 O ATOM 2126 CB LYS B 45 9.105 -12.805 16.126 1.00 50.93 C ATOM 2127 CG LYS B 45 10.312 -12.727 15.197 1.00 50.87 C ATOM 2128 CD LYS B 45 10.003 -11.806 14.029 1.00 50.65 C ATOM 2129 CE LYS B 45 11.240 -11.437 13.229 1.00 49.32 C ATOM 2130 NZ LYS B 45 11.597 -12.437 12.212 1.00 47.64 N ATOM 2131 HA LYS B 45 9.518 -14.760 16.925 1.00 0.00 H ATOM 2132 HB2 LYS B 45 8.244 -13.110 15.531 1.00 0.00 H ATOM 2133 HB3 LYS B 45 8.930 -11.809 16.532 1.00 0.00 H ATOM 2134 HG2 LYS B 45 11.169 -12.339 15.748 1.00 0.00 H ATOM 2135 HG3 LYS B 45 10.545 -13.723 14.821 1.00 0.00 H ATOM 2136 HD2 LYS B 45 9.296 -12.307 13.367 1.00 0.00 H ATOM 2137 HD3 LYS B 45 9.552 -10.892 14.415 1.00 0.00 H ATOM 2138 HE2 LYS B 45 12.078 -11.330 13.918 1.00 0.00 H ATOM 2139 HE3 LYS B 45 11.058 -10.485 12.729 1.00 0.00 H ATOM 2140 HZ1 LYS B 45 11.784 -13.349 12.675 1.00 0.00 H ATOM 2141 HZ2 LYS B 45 10.810 -12.543 11.540 1.00 0.00 H ATOM 2142 HZ3 LYS B 45 12.448 -12.124 11.703 1.00 0.00 H ATOM 2143 H LYS B 45 7.803 -13.211 18.827 1.00 0.00 H ATOM 2144 N MET B 46 11.540 -13.627 18.032 1.00 50.01 N ATOM 2145 CA MET B 46 12.672 -13.149 18.819 1.00 49.60 C ATOM 2146 C MET B 46 13.580 -12.312 17.919 1.00 48.06 C ATOM 2147 O MET B 46 13.980 -12.754 16.851 1.00 47.65 O ATOM 2148 CB MET B 46 13.447 -14.335 19.388 1.00 50.13 C ATOM 2149 CG MET B 46 12.650 -15.178 20.359 1.00 54.32 C ATOM 2150 SD MET B 46 12.611 -14.385 21.969 1.00 61.93 S ATOM 2151 CE MET B 46 14.252 -14.782 22.593 1.00 61.73 C ATOM 2152 HA MET B 46 12.314 -12.538 19.648 1.00 0.00 H ATOM 2153 HB2 MET B 46 13.761 -14.970 18.559 1.00 0.00 H ATOM 2154 HB3 MET B 46 14.327 -13.954 19.906 1.00 0.00 H ATOM 2155 HG2 MET B 46 13.114 -16.160 20.451 1.00 0.00 H ATOM 2156 HG3 MET B 46 11.632 -15.292 19.987 1.00 0.00 H ATOM 2157 HE1 MET B 46 14.367 -15.865 22.645 1.00 0.00 H ATOM 2158 HE2 MET B 46 15.005 -14.367 21.923 1.00 0.00 H ATOM 2159 HE3 MET B 46 14.374 -14.354 23.588 1.00 0.00 H ATOM 2160 H MET B 46 11.725 -14.266 17.233 1.00 0.00 H ATOM 2161 N ILE B 47 13.890 -11.092 18.326 1.00 47.73 N ATOM 2162 CA ILE B 47 14.740 -10.240 17.520 1.00 47.73 C ATOM 2163 C ILE B 47 15.934 -9.826 18.357 1.00 47.34 C ATOM 2164 O ILE B 47 15.830 -9.651 19.579 1.00 45.77 O ATOM 2165 CB ILE B 47 13.980 -9.001 16.969 1.00 48.80 C ATOM 2166 CG1 ILE B 47 13.377 -8.160 18.092 1.00 48.00 C ATOM 2167 CG2 ILE B 47 12.849 -9.430 16.030 1.00 48.44 C ATOM 2168 CD1 ILE B 47 12.836 -6.857 17.585 1.00 48.39 C ATOM 2169 HA ILE B 47 15.074 -10.799 16.646 1.00 0.00 H ATOM 2170 HB ILE B 47 14.713 -8.403 16.427 1.00 0.00 H ATOM 2171 HG12 ILE B 47 12.567 -8.721 18.557 1.00 0.00 H ATOM 2172 HG13 ILE B 47 14.149 -7.957 18.834 1.00 0.00 H ATOM 2173 HD11 ILE B 47 13.642 -6.285 17.124 1.00 0.00 H ATOM 2174 HD12 ILE B 47 12.058 -7.051 16.847 1.00 0.00 H ATOM 2175 HD13 ILE B 47 12.417 -6.291 18.417 1.00 0.00 H ATOM 2176 HG21 ILE B 47 13.266 -9.988 15.192 1.00 0.00 H ATOM 2177 HG22 ILE B 47 12.146 -10.061 16.574 1.00 0.00 H ATOM 2178 HG23 ILE B 47 12.332 -8.545 15.658 1.00 0.00 H ATOM 2179 H ILE B 47 13.520 -10.742 19.233 1.00 0.00 H ATOM 2180 N GLY B 48 17.080 -9.734 17.697 1.00 46.85 N ATOM 2181 CA GLY B 48 18.342 -9.531 18.388 1.00 47.23 C ATOM 2182 C GLY B 48 18.951 -8.171 18.103 1.00 47.53 C ATOM 2183 O GLY B 48 18.915 -7.686 16.977 1.00 45.70 O ATOM 2184 HA3 GLY B 48 19.043 -10.302 18.068 1.00 0.00 H ATOM 2185 HA2 GLY B 48 18.171 -9.619 19.461 1.00 0.00 H ATOM 2186 H GLY B 48 17.076 -9.809 16.660 1.00 0.00 H ATOM 2187 N GLY B 49 19.524 -7.567 19.139 1.00 47.13 N ATOM 2188 CA GLY B 49 20.373 -6.393 18.977 1.00 47.55 C ATOM 2189 C GLY B 49 21.641 -6.518 19.803 1.00 47.06 C ATOM 2190 O GLY B 49 21.967 -7.591 20.302 1.00 45.72 O ATOM 2191 HA3 GLY B 49 19.823 -5.509 19.299 1.00 0.00 H ATOM 2192 HA2 GLY B 49 20.641 -6.289 17.926 1.00 0.00 H ATOM 2193 H GLY B 49 19.362 -7.944 20.095 1.00 0.00 H ATOM 2194 N ILE B 50 22.389 -5.426 19.881 1.00 47.35 N ATOM 2195 CA ILE B 50 23.406 -5.286 20.910 1.00 47.35 C ATOM 2196 C ILE B 50 22.707 -5.588 22.229 1.00 47.53 C ATOM 2197 O ILE B 50 21.613 -5.080 22.489 1.00 47.18 O ATOM 2198 CB ILE B 50 24.029 -3.875 20.900 1.00 47.67 C ATOM 2199 CG1 ILE B 50 25.165 -3.823 19.874 1.00 47.60 C ATOM 2200 CG2 ILE B 50 24.544 -3.480 22.287 1.00 47.57 C ATOM 2201 CD1 ILE B 50 25.918 -2.509 19.837 1.00 47.94 C ATOM 2202 HA ILE B 50 24.238 -5.970 20.743 1.00 0.00 H ATOM 2203 HB ILE B 50 23.255 -3.160 20.622 1.00 0.00 H ATOM 2204 HG12 ILE B 50 25.875 -4.616 20.111 1.00 0.00 H ATOM 2205 HG13 ILE B 50 24.740 -4.000 18.886 1.00 0.00 H ATOM 2206 HD11 ILE B 50 25.228 -1.703 19.588 1.00 0.00 H ATOM 2207 HD12 ILE B 50 26.363 -2.319 20.814 1.00 0.00 H ATOM 2208 HD13 ILE B 50 26.703 -2.563 19.083 1.00 0.00 H ATOM 2209 HG21 ILE B 50 23.716 -3.488 22.996 1.00 0.00 H ATOM 2210 HG22 ILE B 50 25.305 -4.192 22.607 1.00 0.00 H ATOM 2211 HG23 ILE B 50 24.976 -2.480 22.242 1.00 0.00 H ATOM 2212 H ILE B 50 22.246 -4.657 19.195 1.00 0.00 H ATOM 2213 N GLY B 51 23.300 -6.479 23.018 1.00 47.44 N ATOM 2214 CA GLY B 51 22.761 -6.803 24.332 1.00 47.35 C ATOM 2215 C GLY B 51 21.994 -8.111 24.408 1.00 47.18 C ATOM 2216 O GLY B 51 21.916 -8.720 25.478 1.00 47.18 O ATOM 2217 HA3 GLY B 51 22.088 -5.999 24.629 1.00 0.00 H ATOM 2218 HA2 GLY B 51 23.593 -6.857 25.035 1.00 0.00 H ATOM 2219 H GLY B 51 24.165 -6.954 22.691 1.00 0.00 H ATOM 2220 N GLY B 52 21.411 -8.545 23.296 1.00 47.37 N ATOM 2221 CA GLY B 52 20.732 -9.834 23.267 1.00 46.91 C ATOM 2222 C GLY B 52 19.399 -9.715 22.564 1.00 47.19 C ATOM 2223 O GLY B 52 19.233 -8.855 21.705 1.00 47.90 O ATOM 2224 HA3 GLY B 52 20.570 -10.177 24.289 1.00 0.00 H ATOM 2225 HA2 GLY B 52 21.354 -10.556 22.737 1.00 0.00 H ATOM 2226 H GLY B 52 21.439 -7.959 22.437 1.00 0.00 H ATOM 2227 N PHE B 53 18.455 -10.588 22.913 1.00 46.55 N ATOM 2228 CA PHE B 53 17.201 -10.685 22.176 1.00 47.13 C ATOM 2229 C PHE B 53 16.009 -10.226 22.995 1.00 46.93 C ATOM 2230 O PHE B 53 16.014 -10.331 24.220 1.00 47.35 O ATOM 2231 CB PHE B 53 16.943 -12.122 21.712 1.00 46.42 C ATOM 2232 CG PHE B 53 17.748 -12.521 20.525 1.00 46.96 C ATOM 2233 CD1 PHE B 53 19.108 -12.770 20.660 1.00 45.92 C ATOM 2234 CD2 PHE B 53 17.145 -12.711 19.286 1.00 43.42 C ATOM 2235 CE1 PHE B 53 19.855 -13.153 19.571 1.00 46.00 C ATOM 2236 CE2 PHE B 53 17.901 -13.069 18.201 1.00 45.60 C ATOM 2237 CZ PHE B 53 19.254 -13.282 18.339 1.00 46.39 C ATOM 2238 HA PHE B 53 17.310 -10.025 21.315 1.00 0.00 H ATOM 2239 HB2 PHE B 53 17.182 -12.797 22.533 1.00 0.00 H ATOM 2240 HB3 PHE B 53 15.887 -12.218 21.460 1.00 0.00 H ATOM 2241 HD2 PHE B 53 16.069 -12.575 19.178 1.00 0.00 H ATOM 2242 HE2 PHE B 53 17.430 -13.186 17.225 1.00 0.00 H ATOM 2243 HZ PHE B 53 19.852 -13.554 17.469 1.00 0.00 H ATOM 2244 HE1 PHE B 53 20.920 -13.354 19.683 1.00 0.00 H ATOM 2245 HD1 PHE B 53 19.585 -12.661 21.634 1.00 0.00 H ATOM 2246 H PHE B 53 18.616 -11.213 23.728 1.00 0.00 H ATOM 2247 N ILE B 54 14.986 -9.741 22.301 1.00 47.77 N ATOM 2248 CA ILE B 54 13.679 -9.489 22.900 1.00 47.92 C ATOM 2249 C ILE B 54 12.585 -10.251 22.154 1.00 48.15 C ATOM 2250 O ILE B 54 12.746 -10.599 20.987 1.00 49.15 O ATOM 2251 CB ILE B 54 13.351 -7.977 22.964 1.00 47.57 C ATOM 2252 CG1 ILE B 54 13.323 -7.345 21.574 1.00 48.43 C ATOM 2253 CG2 ILE B 54 14.354 -7.256 23.861 1.00 47.62 C ATOM 2254 CD1 ILE B 54 12.603 -6.002 21.535 1.00 48.57 C ATOM 2255 HA ILE B 54 13.718 -9.854 23.926 1.00 0.00 H ATOM 2256 HB ILE B 54 12.354 -7.871 23.391 1.00 0.00 H ATOM 2257 HG12 ILE B 54 14.350 -7.197 21.241 1.00 0.00 H ATOM 2258 HG13 ILE B 54 12.816 -8.029 20.893 1.00 0.00 H ATOM 2259 HD11 ILE B 54 11.570 -6.136 21.856 1.00 0.00 H ATOM 2260 HD12 ILE B 54 13.105 -5.303 22.204 1.00 0.00 H ATOM 2261 HD13 ILE B 54 12.621 -5.611 20.518 1.00 0.00 H ATOM 2262 HG21 ILE B 54 14.307 -7.674 24.866 1.00 0.00 H ATOM 2263 HG22 ILE B 54 15.359 -7.387 23.459 1.00 0.00 H ATOM 2264 HG23 ILE B 54 14.110 -6.194 23.896 1.00 0.00 H ATOM 2265 H ILE B 54 15.121 -9.533 21.291 1.00 0.00 H ATOM 2266 N LYS B 55 11.504 -10.559 22.860 1.00 48.55 N ATOM 2267 CA LYS B 55 10.358 -11.263 22.296 1.00 48.67 C ATOM 2268 C LYS B 55 9.349 -10.218 21.865 1.00 48.38 C ATOM 2269 O LYS B 55 9.025 -9.299 22.618 1.00 47.28 O ATOM 2270 CB LYS B 55 9.731 -12.210 23.322 1.00 48.93 C ATOM 2271 CG LYS B 55 8.481 -12.983 22.836 1.00 49.80 C ATOM 2272 CD LYS B 55 7.983 -13.902 23.955 1.00 49.90 C ATOM 2273 CE LYS B 55 6.903 -14.858 23.488 1.00 50.54 C ATOM 2274 NZ LYS B 55 6.337 -15.629 24.629 1.00 50.56 N ATOM 2275 HA LYS B 55 10.676 -11.870 21.449 1.00 0.00 H ATOM 2276 HB2 LYS B 55 10.487 -12.940 23.612 1.00 0.00 H ATOM 2277 HB3 LYS B 55 9.445 -11.621 24.193 1.00 0.00 H ATOM 2278 HG2 LYS B 55 7.696 -12.275 22.570 1.00 0.00 H ATOM 2279 HG3 LYS B 55 8.740 -13.581 21.962 1.00 0.00 H ATOM 2280 HD2 LYS B 55 8.825 -14.483 24.331 1.00 0.00 H ATOM 2281 HD3 LYS B 55 7.580 -13.286 24.759 1.00 0.00 H ATOM 2282 HE2 LYS B 55 7.331 -15.553 22.766 1.00 0.00 H ATOM 2283 HE3 LYS B 55 6.105 -14.288 23.012 1.00 0.00 H ATOM 2284 HZ1 LYS B 55 7.094 -16.179 25.084 1.00 0.00 H ATOM 2285 HZ2 LYS B 55 5.923 -14.971 25.319 1.00 0.00 H ATOM 2286 HZ3 LYS B 55 5.601 -16.274 24.278 1.00 0.00 H ATOM 2287 H LYS B 55 11.473 -10.285 23.863 1.00 0.00 H ATOM 2288 N VAL B 56 8.879 -10.353 20.634 1.00 48.58 N ATOM 2289 CA VAL B 56 7.935 -9.405 20.077 1.00 49.52 C ATOM 2290 C VAL B 56 6.774 -10.156 19.438 1.00 49.63 C ATOM 2291 O VAL B 56 6.833 -11.372 19.256 1.00 49.40 O ATOM 2292 CB VAL B 56 8.621 -8.473 19.057 1.00 49.30 C ATOM 2293 CG1 VAL B 56 9.802 -7.771 19.712 1.00 49.25 C ATOM 2294 CG2 VAL B 56 9.069 -9.236 17.825 1.00 48.67 C ATOM 2295 HA VAL B 56 7.549 -8.778 20.881 1.00 0.00 H ATOM 2296 HB VAL B 56 7.896 -7.726 18.734 1.00 0.00 H ATOM 2297 HG11 VAL B 56 9.449 -7.182 20.558 1.00 0.00 H ATOM 2298 HG12 VAL B 56 10.518 -8.515 20.059 1.00 0.00 H ATOM 2299 HG13 VAL B 56 10.281 -7.115 18.986 1.00 0.00 H ATOM 2300 HG21 VAL B 56 9.777 -10.012 18.117 1.00 0.00 H ATOM 2301 HG22 VAL B 56 8.203 -9.694 17.348 1.00 0.00 H ATOM 2302 HG23 VAL B 56 9.548 -8.549 17.128 1.00 0.00 H ATOM 2303 H VAL B 56 9.194 -11.157 20.055 1.00 0.00 H ATOM 2304 N ARG B 57 5.723 -9.416 19.112 1.00 50.40 N ATOM 2305 CA ARG B 57 4.608 -9.949 18.349 1.00 51.02 C ATOM 2306 C ARG B 57 4.735 -9.430 16.924 1.00 51.73 C ATOM 2307 O ARG B 57 4.926 -8.230 16.703 1.00 52.35 O ATOM 2308 CB ARG B 57 3.282 -9.534 18.987 1.00 50.54 C ATOM 2309 CG ARG B 57 3.162 -10.023 20.426 1.00 51.29 C ATOM 2310 CD ARG B 57 1.815 -9.733 21.086 1.00 51.42 C ATOM 2311 NE ARG B 57 1.248 -8.435 20.726 1.00 51.51 N ATOM 2312 CZ ARG B 57 1.541 -7.268 21.304 1.00 52.14 C ATOM 2313 NH1 ARG B 57 2.449 -7.186 22.270 1.00 52.65 N ATOM 2314 NH2 ARG B 57 0.925 -6.158 20.903 1.00 50.45 N ATOM 2315 HA ARG B 57 4.626 -11.039 18.342 1.00 0.00 H ATOM 2316 HB2 ARG B 57 3.212 -8.446 18.978 1.00 0.00 H ATOM 2317 HB3 ARG B 57 2.463 -9.954 18.403 1.00 0.00 H ATOM 2318 HG2 ARG B 57 3.319 -11.102 20.433 1.00 0.00 H ATOM 2319 HG3 ARG B 57 3.941 -9.540 21.016 1.00 0.00 H ATOM 2320 HD2 ARG B 57 1.949 -9.762 22.167 1.00 0.00 H ATOM 2321 HD3 ARG B 57 1.111 -10.510 20.787 1.00 0.00 H ATOM 2322 HE ARG B 57 0.555 -8.419 19.951 1.00 0.00 H ATOM 2323 HH12 ARG B 57 2.662 -6.267 22.707 1.00 0.00 H ATOM 2324 HH11 ARG B 57 2.947 -8.041 22.590 1.00 0.00 H ATOM 2325 HH22 ARG B 57 1.151 -5.247 21.351 1.00 0.00 H ATOM 2326 HH21 ARG B 57 0.218 -6.202 20.142 1.00 0.00 H ATOM 2327 H ARG B 57 5.696 -8.421 19.413 1.00 0.00 H ATOM 2328 N GLN B 58 4.685 -10.345 15.965 1.00 51.58 N ATOM 2329 CA GLN B 58 4.775 -9.985 14.559 1.00 52.07 C ATOM 2330 C GLN B 58 3.380 -9.869 13.950 1.00 52.62 C ATOM 2331 O GLN B 58 2.612 -10.833 13.952 1.00 52.95 O ATOM 2332 CB GLN B 58 5.597 -11.020 13.799 1.00 52.31 C ATOM 2333 CG GLN B 58 5.581 -10.829 12.294 1.00 52.35 C ATOM 2334 CD GLN B 58 6.275 -11.944 11.550 1.00 52.69 C ATOM 2335 OE1 GLN B 58 7.250 -12.529 12.031 1.00 53.81 O ATOM 2336 NE2 GLN B 58 5.786 -12.237 10.355 1.00 52.78 N ATOM 2337 HA GLN B 58 5.271 -9.018 14.480 1.00 0.00 H ATOM 2338 HB2 GLN B 58 6.630 -10.959 14.143 1.00 0.00 H ATOM 2339 HB3 GLN B 58 5.198 -12.009 14.025 1.00 0.00 H ATOM 2340 HG2 GLN B 58 4.544 -10.781 11.961 1.00 0.00 H ATOM 2341 HG3 GLN B 58 6.081 -9.890 12.058 1.00 0.00 H ATOM 2342 HE22 GLN B 58 4.962 -11.718 9.989 1.00 0.00 H ATOM 2343 HE21 GLN B 58 6.225 -12.986 9.783 1.00 0.00 H ATOM 2344 H GLN B 58 4.579 -11.346 16.226 1.00 0.00 H ATOM 2345 N TYR B 59 3.079 -8.680 13.429 1.00 52.60 N ATOM 2346 CA TYR B 59 1.837 -8.392 12.709 1.00 53.10 C ATOM 2347 C TYR B 59 2.176 -8.095 11.254 1.00 52.85 C ATOM 2348 O TYR B 59 3.082 -7.312 10.985 1.00 52.13 O ATOM 2349 CB TYR B 59 1.161 -7.146 13.290 1.00 52.82 C ATOM 2350 CG TYR B 59 0.676 -7.311 14.706 1.00 53.55 C ATOM 2351 CD1 TYR B 59 1.552 -7.221 15.789 1.00 53.16 C ATOM 2352 CD2 TYR B 59 -0.668 -7.542 14.966 1.00 53.98 C ATOM 2353 CE1 TYR B 59 1.097 -7.384 17.090 1.00 52.77 C ATOM 2354 CE2 TYR B 59 -1.134 -7.681 16.253 1.00 54.67 C ATOM 2355 CZ TYR B 59 -0.251 -7.609 17.312 1.00 54.85 C ATOM 2356 OH TYR B 59 -0.756 -7.743 18.586 1.00 54.68 O ATOM 2357 HA TYR B 59 1.171 -9.250 12.798 1.00 0.00 H ATOM 2358 HB3 TYR B 59 0.306 -6.897 12.662 1.00 0.00 H ATOM 2359 HB2 TYR B 59 1.878 -6.326 13.267 1.00 0.00 H ATOM 2360 HD2 TYR B 59 -1.368 -7.615 14.134 1.00 0.00 H ATOM 2361 HE2 TYR B 59 -2.196 -7.847 16.436 1.00 0.00 H ATOM 2362 HE1 TYR B 59 1.793 -7.335 17.927 1.00 0.00 H ATOM 2363 HD1 TYR B 59 2.608 -7.020 15.610 1.00 0.00 H ATOM 2364 HH TYR B 59 -0.018 -7.671 19.242 1.00 0.00 H ATOM 2365 H TYR B 59 3.768 -7.909 13.541 1.00 0.00 H ATOM 2366 N ASP B 60 1.448 -8.707 10.329 1.00 52.39 N ATOM 2367 CA ASP B 60 1.712 -8.520 8.905 1.00 52.75 C ATOM 2368 C ASP B 60 0.677 -7.600 8.264 1.00 52.47 C ATOM 2369 O ASP B 60 -0.459 -7.507 8.740 1.00 51.61 O ATOM 2370 CB ASP B 60 1.706 -9.876 8.194 1.00 53.13 C ATOM 2371 CG ASP B 60 2.791 -10.812 8.703 1.00 54.55 C ATOM 2372 OD1 ASP B 60 3.938 -10.366 8.946 1.00 54.29 O ATOM 2373 OD2 ASP B 60 2.488 -12.012 8.854 1.00 58.30 O ATOM 2374 HA ASP B 60 2.692 -8.054 8.802 1.00 0.00 H ATOM 2375 HB2 ASP B 60 0.736 -10.348 8.351 1.00 0.00 H ATOM 2376 HB3 ASP B 60 1.860 -9.711 7.128 1.00 0.00 H ATOM 2377 H ASP B 60 0.672 -9.334 10.625 1.00 0.00 H ATOM 2378 N GLN B 61 1.089 -6.950 7.174 1.00 51.94 N ATOM 2379 CA GLN B 61 0.219 -6.133 6.325 1.00 51.72 C ATOM 2380 C GLN B 61 -0.437 -4.973 7.077 1.00 51.31 C ATOM 2381 O GLN B 61 -1.624 -4.697 6.918 1.00 50.24 O ATOM 2382 CB GLN B 61 -0.828 -7.002 5.635 1.00 51.85 C ATOM 2383 HA GLN B 61 0.858 -5.680 5.566 1.00 0.00 H ATOM 2384 HB2 GLN B 61 -0.329 -7.748 5.016 1.00 0.00 H ATOM 2385 HB3 GLN B 61 -1.437 -7.502 6.388 1.00 0.00 H ATOM 2386 H GLN B 61 2.092 -7.029 6.910 1.00 0.00 H ATOM 2387 N ILE B 62 0.371 -4.289 7.880 1.00 51.19 N ATOM 2388 CA ILE B 62 -0.087 -3.195 8.728 1.00 50.90 C ATOM 2389 C ILE B 62 0.252 -1.865 8.066 1.00 50.58 C ATOM 2390 O ILE B 62 1.410 -1.633 7.725 1.00 51.25 O ATOM 2391 CB ILE B 62 0.610 -3.280 10.106 1.00 50.95 C ATOM 2392 CG1 ILE B 62 0.192 -4.563 10.831 1.00 50.31 C ATOM 2393 CG2 ILE B 62 0.361 -2.024 10.951 1.00 51.12 C ATOM 2394 CD1 ILE B 62 -1.333 -4.776 10.942 1.00 49.42 C ATOM 2395 HA ILE B 62 -1.166 -3.269 8.865 1.00 0.00 H ATOM 2396 HB ILE B 62 1.687 -3.324 9.944 1.00 0.00 H ATOM 2397 HG12 ILE B 62 0.615 -5.411 10.292 1.00 0.00 H ATOM 2398 HG13 ILE B 62 0.605 -4.533 11.839 1.00 0.00 H ATOM 2399 HD11 ILE B 62 -1.776 -3.945 11.492 1.00 0.00 H ATOM 2400 HD12 ILE B 62 -1.766 -4.824 9.943 1.00 0.00 H ATOM 2401 HD13 ILE B 62 -1.531 -5.709 11.470 1.00 0.00 H ATOM 2402 HG21 ILE B 62 0.748 -1.151 10.425 1.00 0.00 H ATOM 2403 HG22 ILE B 62 -0.710 -1.905 11.116 1.00 0.00 H ATOM 2404 HG23 ILE B 62 0.869 -2.126 11.910 1.00 0.00 H ATOM 2405 H ILE B 62 1.378 -4.546 7.905 1.00 0.00 H ATOM 2406 N PRO B 63 -0.754 -0.993 7.871 1.00 50.28 N ATOM 2407 CA PRO B 63 -0.508 0.334 7.300 1.00 50.44 C ATOM 2408 C PRO B 63 0.210 1.281 8.260 1.00 50.39 C ATOM 2409 O PRO B 63 -0.096 1.326 9.447 1.00 49.87 O ATOM 2410 CB PRO B 63 -1.912 0.850 6.982 1.00 50.39 C ATOM 2411 CG PRO B 63 -2.818 0.104 7.907 1.00 49.95 C ATOM 2412 CD PRO B 63 -2.179 -1.217 8.173 1.00 50.01 C ATOM 2413 HA PRO B 63 0.151 0.279 6.433 1.00 0.00 H ATOM 2414 HD3 PRO B 63 -2.313 -1.510 9.214 1.00 0.00 H ATOM 2415 HD2 PRO B 63 -2.596 -1.987 7.524 1.00 0.00 H ATOM 2416 HG3 PRO B 63 -3.793 -0.039 7.442 1.00 0.00 H ATOM 2417 HG2 PRO B 63 -2.939 0.656 8.839 1.00 0.00 H ATOM 2418 HB2 PRO B 63 -1.977 1.923 7.165 1.00 0.00 H ATOM 2419 HB3 PRO B 63 -2.170 0.643 5.943 1.00 0.00 H ATOM 2420 N ILE B 64 1.175 2.031 7.747 1.00 50.85 N ATOM 2421 CA ILE B 64 1.882 3.011 8.563 1.00 51.62 C ATOM 2422 C ILE B 64 2.235 4.206 7.687 1.00 51.88 C ATOM 2423 O ILE B 64 2.864 4.044 6.645 1.00 52.96 O ATOM 2424 CB ILE B 64 3.151 2.398 9.196 1.00 52.59 C ATOM 2425 CG1 ILE B 64 3.972 3.450 9.963 1.00 52.57 C ATOM 2426 CG2 ILE B 64 4.018 1.739 8.130 1.00 53.79 C ATOM 2427 CD1 ILE B 64 4.826 2.847 11.054 1.00 53.09 C ATOM 2428 HA ILE B 64 1.239 3.332 9.383 1.00 0.00 H ATOM 2429 HB ILE B 64 2.823 1.642 9.909 1.00 0.00 H ATOM 2430 HG12 ILE B 64 4.622 3.967 9.257 1.00 0.00 H ATOM 2431 HG13 ILE B 64 3.285 4.166 10.414 1.00 0.00 H ATOM 2432 HD11 ILE B 64 4.187 2.335 11.773 1.00 0.00 H ATOM 2433 HD12 ILE B 64 5.525 2.135 10.615 1.00 0.00 H ATOM 2434 HD13 ILE B 64 5.381 3.638 11.558 1.00 0.00 H ATOM 2435 HG21 ILE B 64 3.450 0.948 7.639 1.00 0.00 H ATOM 2436 HG22 ILE B 64 4.316 2.485 7.393 1.00 0.00 H ATOM 2437 HG23 ILE B 64 4.906 1.314 8.598 1.00 0.00 H ATOM 2438 H ILE B 64 1.432 1.919 6.746 1.00 0.00 H ATOM 2439 N GLU B 65 1.807 5.400 8.073 1.00 50.82 N ATOM 2440 CA GLU B 65 2.174 6.570 7.288 1.00 50.79 C ATOM 2441 C GLU B 65 3.447 7.241 7.831 1.00 49.57 C ATOM 2442 O GLU B 65 3.518 7.611 9.002 1.00 49.02 O ATOM 2443 CB GLU B 65 1.009 7.557 7.197 1.00 50.57 C ATOM 2444 CG GLU B 65 1.026 8.363 5.909 1.00 52.22 C ATOM 2445 CD GLU B 65 0.808 9.836 6.148 1.00 53.73 C ATOM 2446 OE1 GLU B 65 1.690 10.461 6.780 1.00 58.95 O ATOM 2447 OE2 GLU B 65 -0.221 10.371 5.684 1.00 56.72 O ATOM 2448 HA GLU B 65 2.400 6.232 6.277 1.00 0.00 H ATOM 2449 HB2 GLU B 65 0.074 6.999 7.248 1.00 0.00 H ATOM 2450 HB3 GLU B 65 1.067 8.245 8.041 1.00 0.00 H ATOM 2451 HG2 GLU B 65 1.992 8.226 5.423 1.00 0.00 H ATOM 2452 HG3 GLU B 65 0.236 7.994 5.255 1.00 0.00 H ATOM 2453 H GLU B 65 1.218 5.499 8.924 1.00 0.00 H ATOM 2454 N ILE B 66 4.459 7.362 6.974 1.00 49.08 N ATOM 2455 CA ILE B 66 5.751 7.937 7.353 1.00 49.27 C ATOM 2456 C ILE B 66 6.036 9.197 6.525 1.00 48.39 C ATOM 2457 O ILE B 66 6.265 9.128 5.319 1.00 46.93 O ATOM 2458 CB ILE B 66 6.897 6.917 7.161 1.00 48.98 C ATOM 2459 CG1 ILE B 66 6.554 5.588 7.839 1.00 49.75 C ATOM 2460 CG2 ILE B 66 8.217 7.480 7.691 1.00 48.70 C ATOM 2461 CD1 ILE B 66 7.287 4.396 7.259 1.00 49.40 C ATOM 2462 HA ILE B 66 5.700 8.202 8.409 1.00 0.00 H ATOM 2463 HB ILE B 66 7.017 6.731 6.094 1.00 0.00 H ATOM 2464 HG12 ILE B 66 6.808 5.666 8.896 1.00 0.00 H ATOM 2465 HG13 ILE B 66 5.483 5.416 7.736 1.00 0.00 H ATOM 2466 HD11 ILE B 66 7.035 4.295 6.203 1.00 0.00 H ATOM 2467 HD12 ILE B 66 8.362 4.545 7.365 1.00 0.00 H ATOM 2468 HD13 ILE B 66 6.990 3.493 7.793 1.00 0.00 H ATOM 2469 HG21 ILE B 66 8.464 8.394 7.151 1.00 0.00 H ATOM 2470 HG22 ILE B 66 8.116 7.701 8.754 1.00 0.00 H ATOM 2471 HG23 ILE B 66 9.009 6.745 7.545 1.00 0.00 H ATOM 2472 H ILE B 66 4.326 7.035 5.996 1.00 0.00 H ATOM 2473 N CYS B 67 5.985 10.356 7.172 1.00 48.80 N ATOM 2474 CA CYS B 67 6.187 11.630 6.485 1.00 49.46 C ATOM 2475 C CYS B 67 5.391 11.719 5.182 1.00 49.54 C ATOM 2476 O CYS B 67 5.946 12.033 4.125 1.00 49.03 O ATOM 2477 CB CYS B 67 7.675 11.840 6.190 1.00 49.01 C ATOM 2478 SG CYS B 67 8.673 12.173 7.640 1.00 51.37 S ATOM 2479 HA CYS B 67 5.824 12.414 7.150 1.00 0.00 H ATOM 2480 HB2 CYS B 67 7.772 12.684 5.507 1.00 0.00 H ATOM 2481 HB3 CYS B 67 8.059 10.940 5.710 1.00 0.00 H ATOM 2482 HG CYS B 67 9.989 12.345 7.261 1.00 0.00 H ATOM 2483 H CYS B 67 5.796 10.357 8.195 1.00 0.00 H ATOM 2484 N GLY B 68 4.095 11.428 5.253 1.00 50.32 N ATOM 2485 CA GLY B 68 3.223 11.528 4.082 1.00 50.86 C ATOM 2486 C GLY B 68 3.343 10.383 3.090 1.00 51.45 C ATOM 2487 O GLY B 68 2.642 10.365 2.079 1.00 51.72 O ATOM 2488 HA3 GLY B 68 3.463 12.454 3.560 1.00 0.00 H ATOM 2489 HA2 GLY B 68 2.191 11.566 4.431 1.00 0.00 H ATOM 2490 H GLY B 68 3.692 11.122 6.162 1.00 0.00 H ATOM 2491 N HIS B 69 4.214 9.417 3.379 1.00 51.97 N ATOM 2492 CA HIS B 69 4.415 8.258 2.510 1.00 52.31 C ATOM 2493 C HIS B 69 3.678 7.058 3.078 1.00 52.86 C ATOM 2494 O HIS B 69 3.759 6.771 4.271 1.00 52.57 O ATOM 2495 CB HIS B 69 5.902 7.923 2.351 1.00 52.40 C ATOM 2496 CG HIS B 69 6.639 8.878 1.467 1.00 52.05 C ATOM 2497 ND1 HIS B 69 6.939 10.166 1.852 1.00 52.00 N ATOM 2498 CD2 HIS B 69 7.091 8.750 0.197 1.00 52.25 C ATOM 2499 CE1 HIS B 69 7.555 10.788 0.862 1.00 52.06 C ATOM 2500 NE2 HIS B 69 7.650 9.954 -0.158 1.00 52.57 N ATOM 2501 HA HIS B 69 4.019 8.505 1.525 1.00 0.00 H ATOM 2502 HB2 HIS B 69 6.366 7.937 3.337 1.00 0.00 H ATOM 2503 HB3 HIS B 69 5.987 6.923 1.925 1.00 0.00 H ATOM 2504 HD2 HIS B 69 7.024 7.859 -0.427 1.00 0.00 H ATOM 2505 HE1 HIS B 69 7.922 11.814 0.883 1.00 0.00 H ATOM 2506 H HIS B 69 4.771 9.490 4.254 1.00 0.00 H ATOM 2507 N LYS B 70 2.977 6.356 2.197 1.00 53.42 N ATOM 2508 CA LYS B 70 2.162 5.215 2.576 1.00 53.98 C ATOM 2509 C LYS B 70 3.017 3.957 2.615 1.00 54.31 C ATOM 2510 O LYS B 70 3.615 3.575 1.605 1.00 55.27 O ATOM 2511 CB LYS B 70 1.002 5.051 1.592 1.00 53.92 C ATOM 2512 CG LYS B 70 -0.205 5.903 1.948 1.00 55.19 C ATOM 2513 CD LYS B 70 -1.284 5.876 0.863 1.00 54.75 C ATOM 2514 CE LYS B 70 -2.432 6.805 1.223 1.00 55.03 C ATOM 2515 NZ LYS B 70 -3.173 7.310 0.034 1.00 56.56 N ATOM 2516 HA LYS B 70 1.749 5.383 3.571 1.00 0.00 H ATOM 2517 HB2 LYS B 70 1.347 5.335 0.598 1.00 0.00 H ATOM 2518 HB3 LYS B 70 0.698 4.004 1.584 1.00 0.00 H ATOM 2519 HG2 LYS B 70 -0.635 5.530 2.878 1.00 0.00 H ATOM 2520 HG3 LYS B 70 0.123 6.933 2.089 1.00 0.00 H ATOM 2521 HD2 LYS B 70 -0.848 6.196 -0.083 1.00 0.00 H ATOM 2522 HD3 LYS B 70 -1.664 4.860 0.761 1.00 0.00 H ATOM 2523 HE2 LYS B 70 -2.029 7.658 1.769 1.00 0.00 H ATOM 2524 HE3 LYS B 70 -3.129 6.263 1.862 1.00 0.00 H ATOM 2525 HZ1 LYS B 70 -2.521 7.839 -0.580 1.00 0.00 H ATOM 2526 HZ2 LYS B 70 -3.572 6.506 -0.492 1.00 0.00 H ATOM 2527 HZ3 LYS B 70 -3.942 7.937 0.347 1.00 0.00 H ATOM 2528 H LYS B 70 3.012 6.634 1.195 1.00 0.00 H ATOM 2529 N ALA B 71 3.125 3.364 3.800 1.00 54.15 N ATOM 2530 CA ALA B 71 3.812 2.090 3.972 1.00 54.02 C ATOM 2531 C ALA B 71 2.820 1.047 4.488 1.00 54.03 C ATOM 2532 O ALA B 71 1.943 1.351 5.303 1.00 54.40 O ATOM 2533 CB ALA B 71 4.993 2.222 4.925 1.00 53.93 C ATOM 2534 HA ALA B 71 4.206 1.772 3.007 1.00 0.00 H ATOM 2535 HB1 ALA B 71 5.702 2.947 4.525 1.00 0.00 H ATOM 2536 HB2 ALA B 71 4.637 2.559 5.899 1.00 0.00 H ATOM 2537 HB3 ALA B 71 5.483 1.254 5.031 1.00 0.00 H ATOM 2538 H ALA B 71 2.705 3.825 4.632 1.00 0.00 H ATOM 2539 N ILE B 72 2.949 -0.175 3.984 1.00 53.18 N ATOM 2540 CA ILE B 72 2.188 -1.302 4.514 1.00 52.83 C ATOM 2541 C ILE B 72 3.105 -2.518 4.566 1.00 52.02 C ATOM 2542 O ILE B 72 3.759 -2.852 3.583 1.00 51.47 O ATOM 2543 CB ILE B 72 0.918 -1.589 3.680 1.00 52.62 C ATOM 2544 CG1 ILE B 72 0.125 -2.760 4.264 1.00 51.41 C ATOM 2545 CG2 ILE B 72 1.271 -1.863 2.219 1.00 53.97 C ATOM 2546 CD1 ILE B 72 -1.164 -3.057 3.488 1.00 52.84 C ATOM 2547 HA ILE B 72 1.839 -1.058 5.517 1.00 0.00 H ATOM 2548 HB ILE B 72 0.291 -0.698 3.721 1.00 0.00 H ATOM 2549 HG12 ILE B 72 0.755 -3.650 4.246 1.00 0.00 H ATOM 2550 HG13 ILE B 72 -0.137 -2.523 5.295 1.00 0.00 H ATOM 2551 HD11 ILE B 72 -1.808 -2.178 3.506 1.00 0.00 H ATOM 2552 HD12 ILE B 72 -0.916 -3.306 2.456 1.00 0.00 H ATOM 2553 HD13 ILE B 72 -1.680 -3.897 3.952 1.00 0.00 H ATOM 2554 HG21 ILE B 72 1.776 -0.993 1.799 1.00 0.00 H ATOM 2555 HG22 ILE B 72 1.930 -2.729 2.162 1.00 0.00 H ATOM 2556 HG23 ILE B 72 0.358 -2.061 1.657 1.00 0.00 H ATOM 2557 H ILE B 72 3.607 -0.332 3.194 1.00 0.00 H ATOM 2558 N GLY B 73 3.180 -3.157 5.725 1.00 51.79 N ATOM 2559 CA GLY B 73 4.062 -4.308 5.874 1.00 51.60 C ATOM 2560 C GLY B 73 4.083 -4.875 7.274 1.00 50.99 C ATOM 2561 O GLY B 73 3.190 -4.613 8.070 1.00 50.10 O ATOM 2562 HA3 GLY B 73 5.075 -4.003 5.610 1.00 0.00 H ATOM 2563 HA2 GLY B 73 3.729 -5.089 5.190 1.00 0.00 H ATOM 2564 H GLY B 73 2.607 -2.836 6.531 1.00 0.00 H ATOM 2565 N THR B 74 5.142 -5.611 7.587 1.00 50.61 N ATOM 2566 CA THR B 74 5.232 -6.312 8.860 1.00 50.48 C ATOM 2567 C THR B 74 5.690 -5.371 9.968 1.00 50.24 C ATOM 2568 O THR B 74 6.646 -4.621 9.807 1.00 50.67 O ATOM 2569 CB THR B 74 6.174 -7.522 8.745 1.00 50.93 C ATOM 2570 OG1 THR B 74 5.677 -8.394 7.720 1.00 50.24 O ATOM 2571 CG2 THR B 74 6.272 -8.282 10.085 1.00 50.95 C ATOM 2572 HA THR B 74 4.238 -6.676 9.119 1.00 0.00 H ATOM 2573 HB THR B 74 7.174 -7.172 8.490 1.00 0.00 H ATOM 2574 HG1 THR B 74 4.766 -8.698 7.960 1.00 0.00 H ATOM 2575 HG23 THR B 74 6.650 -7.610 10.855 1.00 0.00 H ATOM 2576 HG21 THR B 74 5.284 -8.643 10.369 1.00 0.00 H ATOM 2577 HG22 THR B 74 6.951 -9.127 9.973 1.00 0.00 H ATOM 2578 H THR B 74 5.925 -5.689 6.908 1.00 0.00 H ATOM 2579 N VAL B 75 4.949 -5.356 11.066 1.00 50.43 N ATOM 2580 CA VAL B 75 5.274 -4.499 12.203 1.00 50.04 C ATOM 2581 C VAL B 75 5.416 -5.391 13.433 1.00 49.34 C ATOM 2582 O VAL B 75 4.534 -6.187 13.751 1.00 48.22 O ATOM 2583 CB VAL B 75 4.189 -3.410 12.433 1.00 50.11 C ATOM 2584 CG1 VAL B 75 4.417 -2.662 13.746 1.00 50.99 C ATOM 2585 CG2 VAL B 75 4.149 -2.420 11.266 1.00 50.53 C ATOM 2586 HA VAL B 75 6.206 -3.969 12.005 1.00 0.00 H ATOM 2587 HB VAL B 75 3.228 -3.920 12.493 1.00 0.00 H ATOM 2588 HG11 VAL B 75 4.380 -3.368 14.576 1.00 0.00 H ATOM 2589 HG12 VAL B 75 5.393 -2.178 13.722 1.00 0.00 H ATOM 2590 HG13 VAL B 75 3.640 -1.909 13.873 1.00 0.00 H ATOM 2591 HG21 VAL B 75 5.119 -1.933 11.171 1.00 0.00 H ATOM 2592 HG22 VAL B 75 3.918 -2.955 10.345 1.00 0.00 H ATOM 2593 HG23 VAL B 75 3.381 -1.670 11.454 1.00 0.00 H ATOM 2594 H VAL B 75 4.113 -5.972 11.120 1.00 0.00 H ATOM 2595 N LEU B 76 6.529 -5.242 14.132 1.00 48.71 N ATOM 2596 CA LEU B 76 6.764 -6.017 15.331 1.00 48.88 C ATOM 2597 C LEU B 76 6.445 -5.143 16.538 1.00 48.82 C ATOM 2598 O LEU B 76 6.742 -3.942 16.548 1.00 47.81 O ATOM 2599 CB LEU B 76 8.214 -6.517 15.384 1.00 49.23 C ATOM 2600 CG LEU B 76 8.787 -7.144 14.106 1.00 50.05 C ATOM 2601 CD1 LEU B 76 10.199 -7.630 14.343 1.00 51.72 C ATOM 2602 CD2 LEU B 76 7.914 -8.281 13.578 1.00 51.24 C ATOM 2603 HA LEU B 76 6.120 -6.897 15.333 1.00 0.00 H ATOM 2604 HB2 LEU B 76 8.845 -5.667 15.644 1.00 0.00 H ATOM 2605 HB3 LEU B 76 8.274 -7.267 16.173 1.00 0.00 H ATOM 2606 HG LEU B 76 8.800 -6.366 13.343 1.00 0.00 H ATOM 2607 HD21 LEU B 76 7.840 -9.062 14.335 1.00 0.00 H ATOM 2608 HD22 LEU B 76 6.919 -7.898 13.351 1.00 0.00 H ATOM 2609 HD23 LEU B 76 8.362 -8.691 12.673 1.00 0.00 H ATOM 2610 HD11 LEU B 76 10.827 -6.789 14.638 1.00 0.00 H ATOM 2611 HD12 LEU B 76 10.196 -8.379 15.135 1.00 0.00 H ATOM 2612 HD13 LEU B 76 10.589 -8.071 13.426 1.00 0.00 H ATOM 2613 H LEU B 76 7.245 -4.558 13.815 1.00 0.00 H ATOM 2614 N VAL B 77 5.839 -5.757 17.548 1.00 48.52 N ATOM 2615 CA VAL B 77 5.473 -5.046 18.768 1.00 49.11 C ATOM 2616 C VAL B 77 6.117 -5.701 19.991 1.00 49.00 C ATOM 2617 O VAL B 77 5.959 -6.902 20.247 1.00 48.92 O ATOM 2618 CB VAL B 77 3.944 -4.967 18.920 1.00 49.48 C ATOM 2619 CG1 VAL B 77 3.553 -4.219 20.197 1.00 50.62 C ATOM 2620 CG2 VAL B 77 3.348 -4.292 17.698 1.00 49.57 C ATOM 2621 HA VAL B 77 5.853 -4.027 18.695 1.00 0.00 H ATOM 2622 HB VAL B 77 3.547 -5.979 19.000 1.00 0.00 H ATOM 2623 HG11 VAL B 77 3.963 -4.741 21.062 1.00 0.00 H ATOM 2624 HG12 VAL B 77 3.952 -3.205 20.160 1.00 0.00 H ATOM 2625 HG13 VAL B 77 2.467 -4.180 20.276 1.00 0.00 H ATOM 2626 HG21 VAL B 77 3.757 -3.286 17.605 1.00 0.00 H ATOM 2627 HG22 VAL B 77 3.596 -4.870 16.808 1.00 0.00 H ATOM 2628 HG23 VAL B 77 2.265 -4.237 17.807 1.00 0.00 H ATOM 2629 H VAL B 77 5.620 -6.770 17.467 1.00 0.00 H ATOM 2630 N GLY B 78 6.863 -4.900 20.743 1.00 49.42 N ATOM 2631 CA GLY B 78 7.501 -5.400 21.950 1.00 49.35 C ATOM 2632 C GLY B 78 8.255 -4.321 22.703 1.00 48.83 C ATOM 2633 O GLY B 78 8.161 -3.143 22.360 1.00 48.75 O ATOM 2634 HA3 GLY B 78 8.202 -6.188 21.674 1.00 0.00 H ATOM 2635 HA2 GLY B 78 6.734 -5.812 22.605 1.00 0.00 H ATOM 2636 H GLY B 78 6.992 -3.906 20.466 1.00 0.00 H ATOM 2637 N PRO B 79 9.027 -4.730 23.718 1.00 48.88 N ATOM 2638 CA PRO B 79 9.708 -3.837 24.644 1.00 48.70 C ATOM 2639 C PRO B 79 11.007 -3.316 24.056 1.00 48.42 C ATOM 2640 O PRO B 79 12.076 -3.510 24.640 1.00 48.21 O ATOM 2641 CB PRO B 79 9.973 -4.734 25.855 1.00 49.06 C ATOM 2642 CG PRO B 79 10.186 -6.100 25.242 1.00 49.90 C ATOM 2643 CD PRO B 79 9.260 -6.152 24.051 1.00 49.70 C ATOM 2644 HA PRO B 79 9.126 -2.948 24.885 1.00 0.00 H ATOM 2645 HD3 PRO B 79 9.729 -6.674 23.217 1.00 0.00 H ATOM 2646 HD2 PRO B 79 8.324 -6.649 24.308 1.00 0.00 H ATOM 2647 HG3 PRO B 79 9.933 -6.883 25.957 1.00 0.00 H ATOM 2648 HG2 PRO B 79 11.222 -6.219 24.926 1.00 0.00 H ATOM 2649 HB2 PRO B 79 10.861 -4.407 26.396 1.00 0.00 H ATOM 2650 HB3 PRO B 79 9.118 -4.739 26.531 1.00 0.00 H ATOM 2651 N THR B 80 10.901 -2.707 22.878 1.00 47.64 N ATOM 2652 CA THR B 80 11.968 -1.890 22.321 1.00 47.84 C ATOM 2653 C THR B 80 12.070 -0.571 23.085 1.00 47.78 C ATOM 2654 O THR B 80 11.060 0.060 23.385 1.00 47.85 O ATOM 2655 CB THR B 80 11.765 -1.619 20.799 1.00 47.40 C ATOM 2656 OG1 THR B 80 12.875 -0.863 20.293 1.00 47.94 O ATOM 2657 CG2 THR B 80 10.466 -0.864 20.509 1.00 46.16 C ATOM 2658 HA THR B 80 12.899 -2.446 22.430 1.00 0.00 H ATOM 2659 HB THR B 80 11.702 -2.587 20.302 1.00 0.00 H ATOM 2660 HG1 THR B 80 12.934 -0.001 20.776 1.00 0.00 H ATOM 2661 HG23 THR B 80 9.621 -1.436 20.892 1.00 0.00 H ATOM 2662 HG21 THR B 80 10.497 0.111 20.996 1.00 0.00 H ATOM 2663 HG22 THR B 80 10.357 -0.730 19.433 1.00 0.00 H ATOM 2664 H THR B 80 10.022 -2.819 22.334 1.00 0.00 H ATOM 2665 N PRO B 81 13.298 -0.148 23.416 1.00 48.73 N ATOM 2666 CA PRO B 81 13.487 1.144 24.089 1.00 48.30 C ATOM 2667 C PRO B 81 13.116 2.371 23.254 1.00 48.10 C ATOM 2668 O PRO B 81 12.756 3.404 23.817 1.00 47.42 O ATOM 2669 CB PRO B 81 14.978 1.153 24.423 1.00 48.57 C ATOM 2670 CG PRO B 81 15.588 0.170 23.505 1.00 49.35 C ATOM 2671 CD PRO B 81 14.568 -0.871 23.234 1.00 48.80 C ATOM 2672 HA PRO B 81 12.824 1.223 24.950 1.00 0.00 H ATOM 2673 HD3 PRO B 81 14.659 -1.253 22.217 1.00 0.00 H ATOM 2674 HD2 PRO B 81 14.654 -1.697 23.940 1.00 0.00 H ATOM 2675 HG3 PRO B 81 16.466 -0.279 23.969 1.00 0.00 H ATOM 2676 HG2 PRO B 81 15.880 0.658 22.575 1.00 0.00 H ATOM 2677 HB2 PRO B 81 15.401 2.144 24.258 1.00 0.00 H ATOM 2678 HB3 PRO B 81 15.139 0.859 25.460 1.00 0.00 H ATOM 2679 N VAL B 82 13.239 2.265 21.931 1.00 48.38 N ATOM 2680 CA VAL B 82 12.810 3.309 20.993 1.00 48.89 C ATOM 2681 C VAL B 82 12.047 2.654 19.830 1.00 49.26 C ATOM 2682 O VAL B 82 12.387 1.543 19.407 1.00 50.41 O ATOM 2683 CB VAL B 82 14.028 4.084 20.425 1.00 48.87 C ATOM 2684 CG1 VAL B 82 13.584 5.194 19.475 1.00 49.37 C ATOM 2685 CG2 VAL B 82 14.881 4.669 21.549 1.00 50.11 C ATOM 2686 HA VAL B 82 12.170 4.012 21.526 1.00 0.00 H ATOM 2687 HB VAL B 82 14.633 3.371 19.864 1.00 0.00 H ATOM 2688 HG11 VAL B 82 13.030 4.759 18.643 1.00 0.00 H ATOM 2689 HG12 VAL B 82 12.945 5.895 20.011 1.00 0.00 H ATOM 2690 HG13 VAL B 82 14.461 5.717 19.095 1.00 0.00 H ATOM 2691 HG21 VAL B 82 14.277 5.355 22.143 1.00 0.00 H ATOM 2692 HG22 VAL B 82 15.246 3.862 22.184 1.00 0.00 H ATOM 2693 HG23 VAL B 82 15.727 5.206 21.120 1.00 0.00 H ATOM 2694 H VAL B 82 13.661 1.397 21.543 1.00 0.00 H ATOM 2695 N ASN B 83 11.023 3.332 19.314 1.00 49.04 N ATOM 2696 CA ASN B 83 10.370 2.924 18.062 1.00 48.68 C ATOM 2697 C ASN B 83 11.317 3.027 16.864 1.00 48.59 C ATOM 2698 O ASN B 83 12.012 4.035 16.690 1.00 47.16 O ATOM 2699 CB ASN B 83 9.151 3.796 17.760 1.00 48.76 C ATOM 2700 CG ASN B 83 8.161 3.861 18.905 1.00 50.01 C ATOM 2701 OD1 ASN B 83 8.019 2.925 19.693 1.00 54.22 O ATOM 2702 ND2 ASN B 83 7.455 4.978 18.992 1.00 50.33 N ATOM 2703 HA ASN B 83 10.069 1.887 18.208 1.00 0.00 H ATOM 2704 HB2 ASN B 83 9.494 4.807 17.542 1.00 0.00 H ATOM 2705 HB3 ASN B 83 8.643 3.389 16.886 1.00 0.00 H ATOM 2706 HD22 ASN B 83 7.607 5.744 18.305 1.00 0.00 H ATOM 2707 HD21 ASN B 83 6.749 5.089 19.747 1.00 0.00 H ATOM 2708 H ASN B 83 10.675 4.176 19.812 1.00 0.00 H ATOM 2709 N ILE B 84 11.289 2.003 16.013 1.00 48.80 N ATOM 2710 CA ILE B 84 12.243 1.831 14.934 1.00 49.47 C ATOM 2711 C ILE B 84 11.566 1.492 13.609 1.00 49.48 C ATOM 2712 O ILE B 84 10.855 0.497 13.507 1.00 50.32 O ATOM 2713 CB ILE B 84 13.200 0.681 15.279 1.00 49.77 C ATOM 2714 CG1 ILE B 84 14.173 1.115 16.369 1.00 51.26 C ATOM 2715 CG2 ILE B 84 13.951 0.202 14.049 1.00 48.83 C ATOM 2716 CD1 ILE B 84 14.647 -0.067 17.195 1.00 52.26 C ATOM 2717 HA ILE B 84 12.773 2.777 14.823 1.00 0.00 H ATOM 2718 HB ILE B 84 12.607 -0.155 15.651 1.00 0.00 H ATOM 2719 HG12 ILE B 84 15.036 1.592 15.904 1.00 0.00 H ATOM 2720 HG13 ILE B 84 13.675 1.829 17.025 1.00 0.00 H ATOM 2721 HD11 ILE B 84 13.789 -0.545 17.668 1.00 0.00 H ATOM 2722 HD12 ILE B 84 15.152 -0.783 16.546 1.00 0.00 H ATOM 2723 HD13 ILE B 84 15.339 0.281 17.962 1.00 0.00 H ATOM 2724 HG21 ILE B 84 13.238 -0.151 13.304 1.00 0.00 H ATOM 2725 HG22 ILE B 84 14.532 1.026 13.636 1.00 0.00 H ATOM 2726 HG23 ILE B 84 14.620 -0.612 14.327 1.00 0.00 H ATOM 2727 H ILE B 84 10.543 1.288 16.128 1.00 0.00 H ATOM 2728 N ILE B 85 11.829 2.305 12.589 1.00 49.18 N ATOM 2729 CA ILE B 85 11.413 2.010 11.221 1.00 48.69 C ATOM 2730 C ILE B 85 12.576 1.296 10.557 1.00 49.08 C ATOM 2731 O ILE B 85 13.660 1.868 10.404 1.00 48.63 O ATOM 2732 CB ILE B 85 11.070 3.289 10.409 1.00 48.97 C ATOM 2733 CG1 ILE B 85 10.002 4.121 11.130 1.00 47.91 C ATOM 2734 CG2 ILE B 85 10.595 2.932 8.984 1.00 48.51 C ATOM 2735 CD1 ILE B 85 8.809 3.332 11.603 1.00 47.55 C ATOM 2736 HA ILE B 85 10.507 1.405 11.246 1.00 0.00 H ATOM 2737 HB ILE B 85 11.980 3.884 10.328 1.00 0.00 H ATOM 2738 HG12 ILE B 85 10.465 4.592 11.997 1.00 0.00 H ATOM 2739 HG13 ILE B 85 9.650 4.892 10.444 1.00 0.00 H ATOM 2740 HD11 ILE B 85 8.322 2.863 10.747 1.00 0.00 H ATOM 2741 HD12 ILE B 85 9.138 2.563 12.302 1.00 0.00 H ATOM 2742 HD13 ILE B 85 8.107 4.001 12.101 1.00 0.00 H ATOM 2743 HG21 ILE B 85 11.385 2.390 8.464 1.00 0.00 H ATOM 2744 HG22 ILE B 85 9.704 2.308 9.045 1.00 0.00 H ATOM 2745 HG23 ILE B 85 10.362 3.847 8.440 1.00 0.00 H ATOM 2746 H ILE B 85 12.351 3.185 12.774 1.00 0.00 H ATOM 2747 N GLY B 86 12.337 0.045 10.171 1.00 48.69 N ATOM 2748 CA GLY B 86 13.367 -0.780 9.580 1.00 49.19 C ATOM 2749 C GLY B 86 13.367 -0.804 8.069 1.00 49.44 C ATOM 2750 O GLY B 86 12.514 -0.187 7.429 1.00 50.17 O ATOM 2751 HA3 GLY B 86 13.231 -1.801 9.936 1.00 0.00 H ATOM 2752 HA2 GLY B 86 14.335 -0.406 9.914 1.00 0.00 H ATOM 2753 H GLY B 86 11.383 -0.350 10.298 1.00 0.00 H ATOM 2754 N ARG B 87 14.307 -1.566 7.509 1.00 49.52 N ATOM 2755 CA ARG B 87 14.509 -1.618 6.057 1.00 49.56 C ATOM 2756 C ARG B 87 13.285 -2.143 5.307 1.00 49.36 C ATOM 2757 O ARG B 87 13.049 -1.755 4.166 1.00 49.53 O ATOM 2758 CB ARG B 87 15.728 -2.467 5.713 1.00 49.26 C ATOM 2759 CG ARG B 87 17.054 -1.834 6.077 1.00 50.14 C ATOM 2760 CD ARG B 87 18.215 -2.634 5.492 1.00 49.99 C ATOM 2761 NE ARG B 87 18.266 -4.002 6.003 1.00 49.23 N ATOM 2762 CZ ARG B 87 17.872 -5.097 5.350 1.00 50.26 C ATOM 2763 NH1 ARG B 87 17.351 -5.041 4.130 1.00 48.32 N ATOM 2764 NH2 ARG B 87 17.992 -6.276 5.947 1.00 51.12 N ATOM 2765 HA ARG B 87 14.674 -0.591 5.732 1.00 0.00 H ATOM 2766 HB2 ARG B 87 15.645 -3.415 6.245 1.00 0.00 H ATOM 2767 HB3 ARG B 87 15.722 -2.653 4.639 1.00 0.00 H ATOM 2768 HG2 ARG B 87 17.085 -0.818 5.683 1.00 0.00 H ATOM 2769 HG3 ARG B 87 17.151 -1.805 7.162 1.00 0.00 H ATOM 2770 HD2 ARG B 87 19.149 -2.131 5.745 1.00 0.00 H ATOM 2771 HD3 ARG B 87 18.104 -2.669 4.408 1.00 0.00 H ATOM 2772 HE ARG B 87 18.644 -4.134 6.963 1.00 0.00 H ATOM 2773 HH12 ARG B 87 17.055 -5.915 3.651 1.00 0.00 H ATOM 2774 HH11 ARG B 87 17.239 -4.123 3.654 1.00 0.00 H ATOM 2775 HH22 ARG B 87 17.691 -7.141 5.455 1.00 0.00 H ATOM 2776 HH21 ARG B 87 18.387 -6.335 6.907 1.00 0.00 H ATOM 2777 H ARG B 87 14.918 -2.143 8.122 1.00 0.00 H ATOM 2778 N ASN B 88 12.503 -2.997 5.958 1.00 49.17 N ATOM 2779 CA ASN B 88 11.284 -3.519 5.361 1.00 49.56 C ATOM 2780 C ASN B 88 10.386 -2.368 4.917 1.00 49.90 C ATOM 2781 O ASN B 88 9.870 -2.410 3.805 1.00 50.41 O ATOM 2782 CB ASN B 88 10.564 -4.533 6.279 1.00 49.44 C ATOM 2783 CG ASN B 88 9.832 -3.884 7.457 1.00 50.60 C ATOM 2784 OD1 ASN B 88 10.408 -3.094 8.216 1.00 46.65 O ATOM 2785 ND2 ASN B 88 8.546 -4.230 7.616 1.00 47.66 N ATOM 2786 HA ASN B 88 11.553 -4.089 4.472 1.00 0.00 H ATOM 2787 HB2 ASN B 88 9.836 -5.082 5.682 1.00 0.00 H ATOM 2788 HB3 ASN B 88 11.306 -5.227 6.674 1.00 0.00 H ATOM 2789 HD22 ASN B 88 8.102 -4.898 6.954 1.00 0.00 H ATOM 2790 HD21 ASN B 88 7.993 -3.830 8.401 1.00 0.00 H ATOM 2791 H ASN B 88 12.769 -3.299 6.917 1.00 0.00 H ATOM 2792 N LEU B 89 10.296 -1.301 5.711 1.00 49.71 N ATOM 2793 CA LEU B 89 9.442 -0.167 5.355 1.00 50.26 C ATOM 2794 C LEU B 89 10.209 0.994 4.728 1.00 50.09 C ATOM 2795 O LEU B 89 9.665 1.705 3.882 1.00 49.82 O ATOM 2796 CB LEU B 89 8.639 0.326 6.562 1.00 50.01 C ATOM 2797 CG LEU B 89 7.663 -0.683 7.165 1.00 49.96 C ATOM 2798 CD1 LEU B 89 6.880 -0.012 8.293 1.00 48.50 C ATOM 2799 CD2 LEU B 89 6.725 -1.269 6.104 1.00 51.49 C ATOM 2800 HA LEU B 89 8.756 -0.543 4.596 1.00 0.00 H ATOM 2801 HB2 LEU B 89 9.346 0.615 7.340 1.00 0.00 H ATOM 2802 HB3 LEU B 89 8.067 1.200 6.250 1.00 0.00 H ATOM 2803 HG LEU B 89 8.230 -1.520 7.572 1.00 0.00 H ATOM 2804 HD21 LEU B 89 6.149 -0.465 5.646 1.00 0.00 H ATOM 2805 HD22 LEU B 89 7.314 -1.776 5.340 1.00 0.00 H ATOM 2806 HD23 LEU B 89 6.047 -1.982 6.574 1.00 0.00 H ATOM 2807 HD11 LEU B 89 7.573 0.331 9.061 1.00 0.00 H ATOM 2808 HD12 LEU B 89 6.328 0.839 7.894 1.00 0.00 H ATOM 2809 HD13 LEU B 89 6.182 -0.729 8.726 1.00 0.00 H ATOM 2810 H LEU B 89 10.841 -1.274 6.597 1.00 0.00 H ATOM 2811 N LEU B 90 11.477 1.154 5.092 1.00 50.46 N ATOM 2812 CA LEU B 90 12.292 2.207 4.497 1.00 50.54 C ATOM 2813 C LEU B 90 12.378 2.022 2.981 1.00 50.44 C ATOM 2814 O LEU B 90 12.406 2.997 2.240 1.00 50.01 O ATOM 2815 CB LEU B 90 13.695 2.242 5.102 1.00 50.02 C ATOM 2816 CG LEU B 90 13.825 2.593 6.587 1.00 49.71 C ATOM 2817 CD1 LEU B 90 15.250 2.344 7.041 1.00 46.45 C ATOM 2818 CD2 LEU B 90 13.382 4.001 6.898 1.00 48.91 C ATOM 2819 HA LEU B 90 11.809 3.160 4.715 1.00 0.00 H ATOM 2820 HB2 LEU B 90 14.134 1.254 4.962 1.00 0.00 H ATOM 2821 HB3 LEU B 90 14.272 2.978 4.542 1.00 0.00 H ATOM 2822 HG LEU B 90 13.150 1.944 7.145 1.00 0.00 H ATOM 2823 HD21 LEU B 90 13.994 4.706 6.335 1.00 0.00 H ATOM 2824 HD22 LEU B 90 12.336 4.121 6.618 1.00 0.00 H ATOM 2825 HD23 LEU B 90 13.498 4.190 7.965 1.00 0.00 H ATOM 2826 HD11 LEU B 90 15.499 1.293 6.892 1.00 0.00 H ATOM 2827 HD12 LEU B 90 15.929 2.966 6.459 1.00 0.00 H ATOM 2828 HD13 LEU B 90 15.342 2.594 8.098 1.00 0.00 H ATOM 2829 H LEU B 90 11.892 0.523 5.807 1.00 0.00 H ATOM 2830 N THR B 91 12.411 0.773 2.524 1.00 51.16 N ATOM 2831 CA THR B 91 12.437 0.478 1.090 1.00 51.46 C ATOM 2832 C THR B 91 11.143 0.936 0.411 1.00 51.93 C ATOM 2833 O THR B 91 11.165 1.506 -0.686 1.00 52.07 O ATOM 2834 CB THR B 91 12.622 -1.033 0.814 1.00 52.13 C ATOM 2835 OG1 THR B 91 11.698 -1.796 1.607 1.00 51.29 O ATOM 2836 CG2 THR B 91 14.049 -1.461 1.131 1.00 51.84 C ATOM 2837 HA THR B 91 13.288 1.023 0.681 1.00 0.00 H ATOM 2838 HB THR B 91 12.426 -1.218 -0.242 1.00 0.00 H ATOM 2839 HG1 THR B 91 11.863 -1.618 2.567 1.00 0.00 H ATOM 2840 HG23 THR B 91 14.744 -0.879 0.526 1.00 0.00 H ATOM 2841 HG21 THR B 91 14.252 -1.289 2.188 1.00 0.00 H ATOM 2842 HG22 THR B 91 14.168 -2.521 0.905 1.00 0.00 H ATOM 2843 H THR B 91 12.419 -0.015 3.203 1.00 0.00 H ATOM 2844 N GLN B 92 10.013 0.677 1.060 1.00 52.14 N ATOM 2845 CA GLN B 92 8.709 1.030 0.491 1.00 52.26 C ATOM 2846 C GLN B 92 8.552 2.522 0.201 1.00 52.20 C ATOM 2847 O GLN B 92 7.863 2.909 -0.750 1.00 52.06 O ATOM 2848 CB GLN B 92 7.589 0.571 1.416 1.00 51.90 C ATOM 2849 CG GLN B 92 7.427 -0.931 1.447 1.00 52.92 C ATOM 2850 CD GLN B 92 6.250 -1.367 2.286 1.00 52.54 C ATOM 2851 OE1 GLN B 92 5.256 -0.653 2.402 1.00 52.72 O ATOM 2852 NE2 GLN B 92 6.362 -2.543 2.893 1.00 54.14 N ATOM 2853 HA GLN B 92 8.648 0.514 -0.467 1.00 0.00 H ATOM 2854 HB2 GLN B 92 7.808 0.918 2.426 1.00 0.00 H ATOM 2855 HB3 GLN B 92 6.653 1.015 1.076 1.00 0.00 H ATOM 2856 HG2 GLN B 92 7.282 -1.289 0.428 1.00 0.00 H ATOM 2857 HG3 GLN B 92 8.334 -1.373 1.860 1.00 0.00 H ATOM 2858 HE22 GLN B 92 7.222 -3.114 2.766 1.00 0.00 H ATOM 2859 HE21 GLN B 92 5.590 -2.893 3.495 1.00 0.00 H ATOM 2860 H GLN B 92 10.054 0.214 1.991 1.00 0.00 H ATOM 2861 N ILE B 93 9.193 3.358 1.016 1.00 52.40 N ATOM 2862 CA ILE B 93 9.087 4.810 0.867 1.00 52.30 C ATOM 2863 C ILE B 93 10.244 5.440 0.084 1.00 52.26 C ATOM 2864 O ILE B 93 10.316 6.655 -0.039 1.00 51.39 O ATOM 2865 CB ILE B 93 8.938 5.508 2.234 1.00 52.73 C ATOM 2866 CG1 ILE B 93 10.238 5.396 3.048 1.00 51.70 C ATOM 2867 CG2 ILE B 93 7.754 4.909 2.996 1.00 52.40 C ATOM 2868 CD1 ILE B 93 10.232 6.184 4.332 1.00 52.97 C ATOM 2869 HA ILE B 93 8.184 4.969 0.277 1.00 0.00 H ATOM 2870 HB ILE B 93 8.744 6.568 2.071 1.00 0.00 H ATOM 2871 HG12 ILE B 93 10.400 4.346 3.292 1.00 0.00 H ATOM 2872 HG13 ILE B 93 11.061 5.755 2.430 1.00 0.00 H ATOM 2873 HD11 ILE B 93 10.084 7.240 4.108 1.00 0.00 H ATOM 2874 HD12 ILE B 93 9.423 5.830 4.970 1.00 0.00 H ATOM 2875 HD13 ILE B 93 11.185 6.050 4.844 1.00 0.00 H ATOM 2876 HG21 ILE B 93 6.842 5.051 2.417 1.00 0.00 H ATOM 2877 HG22 ILE B 93 7.925 3.844 3.151 1.00 0.00 H ATOM 2878 HG23 ILE B 93 7.655 5.407 3.961 1.00 0.00 H ATOM 2879 H ILE B 93 9.784 2.969 1.778 1.00 0.00 H ATOM 2880 N GLY B 94 11.138 4.614 -0.451 1.00 52.69 N ATOM 2881 CA GLY B 94 12.167 5.084 -1.377 1.00 52.84 C ATOM 2882 C GLY B 94 13.376 5.688 -0.689 1.00 53.64 C ATOM 2883 O GLY B 94 14.102 6.474 -1.285 1.00 53.34 O ATOM 2884 HA3 GLY B 94 11.726 5.841 -2.026 1.00 0.00 H ATOM 2885 HA2 GLY B 94 12.500 4.239 -1.980 1.00 0.00 H ATOM 2886 H GLY B 94 11.104 3.604 -0.204 1.00 0.00 H ATOM 2887 N CYS B 95 13.602 5.289 0.559 1.00 54.20 N ATOM 2888 CA CYS B 95 14.704 5.819 1.356 1.00 53.67 C ATOM 2889 C CYS B 95 16.048 5.185 0.990 1.00 53.52 C ATOM 2890 O CYS B 95 16.198 3.955 0.964 1.00 53.15 O ATOM 2891 CB CYS B 95 14.401 5.618 2.837 1.00 53.78 C ATOM 2892 SG CYS B 95 15.543 6.464 3.930 1.00 57.30 S ATOM 2893 HA CYS B 95 14.792 6.883 1.138 1.00 0.00 H ATOM 2894 HB2 CYS B 95 14.443 4.551 3.055 1.00 0.00 H ATOM 2895 HB3 CYS B 95 13.396 5.989 3.036 1.00 0.00 H ATOM 2896 HG CYS B 95 15.187 6.222 5.241 1.00 0.00 H ATOM 2897 H CYS B 95 12.973 4.576 0.981 1.00 0.00 H ATOM 2898 N THR B 96 17.034 6.040 0.744 1.00 53.21 N ATOM 2899 CA THR B 96 18.402 5.603 0.465 1.00 52.68 C ATOM 2900 C THR B 96 19.433 6.299 1.356 1.00 52.20 C ATOM 2901 O THR B 96 19.175 7.366 1.919 1.00 50.78 O ATOM 2902 CB THR B 96 18.780 5.845 -1.030 1.00 53.12 C ATOM 2903 OG1 THR B 96 18.724 7.245 -1.343 1.00 51.90 O ATOM 2904 CG2 THR B 96 17.837 5.079 -1.952 1.00 53.75 C ATOM 2905 HA THR B 96 18.424 4.535 0.682 1.00 0.00 H ATOM 2906 HB THR B 96 19.798 5.485 -1.183 1.00 0.00 H ATOM 2907 HG1 THR B 96 19.361 7.737 -0.766 1.00 0.00 H ATOM 2908 HG23 THR B 96 17.881 4.016 -1.713 1.00 0.00 H ATOM 2909 HG21 THR B 96 16.819 5.443 -1.812 1.00 0.00 H ATOM 2910 HG22 THR B 96 18.140 5.232 -2.988 1.00 0.00 H ATOM 2911 H THR B 96 16.826 7.059 0.750 1.00 0.00 H ATOM 2912 N LEU B 97 20.594 5.661 1.499 1.00 51.81 N ATOM 2913 CA LEU B 97 21.776 6.314 2.051 1.00 51.99 C ATOM 2914 C LEU B 97 22.622 6.863 0.912 1.00 51.51 C ATOM 2915 O LEU B 97 22.801 6.212 -0.113 1.00 51.32 O ATOM 2916 CB LEU B 97 22.613 5.324 2.857 1.00 51.93 C ATOM 2917 CG LEU B 97 21.970 4.909 4.173 1.00 53.66 C ATOM 2918 CD1 LEU B 97 22.575 3.599 4.653 1.00 54.80 C ATOM 2919 CD2 LEU B 97 22.142 5.998 5.188 1.00 54.45 C ATOM 2920 HA LEU B 97 21.453 7.121 2.709 1.00 0.00 H ATOM 2921 HB2 LEU B 97 22.767 4.431 2.252 1.00 0.00 H ATOM 2922 HB3 LEU B 97 23.577 5.785 3.075 1.00 0.00 H ATOM 2923 HG LEU B 97 20.901 4.751 4.026 1.00 0.00 H ATOM 2924 HD21 LEU B 97 23.205 6.180 5.347 1.00 0.00 H ATOM 2925 HD22 LEU B 97 21.666 6.909 4.825 1.00 0.00 H ATOM 2926 HD23 LEU B 97 21.679 5.694 6.127 1.00 0.00 H ATOM 2927 HD11 LEU B 97 22.400 2.824 3.906 1.00 0.00 H ATOM 2928 HD12 LEU B 97 23.647 3.728 4.801 1.00 0.00 H ATOM 2929 HD13 LEU B 97 22.110 3.309 5.595 1.00 0.00 H ATOM 2930 H LEU B 97 20.660 4.665 1.208 1.00 0.00 H ATOM 2931 N ASN B 98 23.138 8.064 1.104 1.00 51.38 N ATOM 2932 CA ASN B 98 23.781 8.813 0.037 1.00 51.38 C ATOM 2933 C ASN B 98 25.003 9.529 0.586 1.00 51.18 C ATOM 2934 O ASN B 98 24.909 10.251 1.589 1.00 50.59 O ATOM 2935 CB ASN B 98 22.800 9.834 -0.541 1.00 50.81 C ATOM 2936 CG ASN B 98 21.646 9.175 -1.255 1.00 53.03 C ATOM 2937 OD1 ASN B 98 20.575 8.996 -0.679 1.00 53.41 O ATOM 2938 ND2 ASN B 98 21.882 8.735 -2.486 1.00 50.34 N ATOM 2939 HA ASN B 98 24.088 8.127 -0.752 1.00 0.00 H ATOM 2940 HB2 ASN B 98 22.408 10.444 0.273 1.00 0.00 H ATOM 2941 HB3 ASN B 98 23.332 10.472 -1.247 1.00 0.00 H ATOM 2942 HD22 ASN B 98 22.804 8.910 -2.933 1.00 0.00 H ATOM 2943 HD21 ASN B 98 21.144 8.215 -3.003 1.00 0.00 H ATOM 2944 H ASN B 98 23.082 8.488 2.052 1.00 0.00 H ATOM 2945 N PHE B 99 26.153 9.286 -0.033 1.00 51.50 N ATOM 2946 CA PHE B 99 27.353 10.029 0.308 1.00 52.28 C ATOM 2947 C PHE B 99 28.351 9.984 -0.842 1.00 52.67 C ATOM 2948 O PHE B 99 29.423 10.579 -0.766 1.00 51.58 O ATOM 2949 CB PHE B 99 27.978 9.525 1.617 1.00 53.73 C ATOM 2950 CG PHE B 99 28.512 8.127 1.544 1.00 53.35 C ATOM 2951 CD1 PHE B 99 27.699 7.050 1.839 1.00 56.33 C ATOM 2952 CD2 PHE B 99 29.830 7.892 1.192 1.00 55.62 C ATOM 2953 CE1 PHE B 99 28.175 5.755 1.759 1.00 56.31 C ATOM 2954 CE2 PHE B 99 30.320 6.602 1.107 1.00 56.26 C ATOM 2955 CZ PHE B 99 29.487 5.529 1.392 1.00 56.99 C ATOM 2956 HA PHE B 99 27.071 11.069 0.472 1.00 0.00 H ATOM 2957 OXT PHE B 99 28.081 9.372 -1.880 1.00 53.19 O ATOM 2958 HB2 PHE B 99 28.799 10.191 1.883 1.00 0.00 H ATOM 2959 HB3 PHE B 99 27.216 9.560 2.396 1.00 0.00 H ATOM 2960 HD2 PHE B 99 30.489 8.734 0.979 1.00 0.00 H ATOM 2961 HE2 PHE B 99 31.356 6.428 0.817 1.00 0.00 H ATOM 2962 HZ PHE B 99 29.868 4.510 1.326 1.00 0.00 H ATOM 2963 HE1 PHE B 99 27.518 4.915 1.985 1.00 0.00 H ATOM 2964 HD1 PHE B 99 26.666 7.224 2.140 1.00 0.00 H ATOM 2965 H PHE B 99 26.194 8.554 -0.771 1.00 0.00 H TER 2966 PHE B 99 HETATM 2967 O HOH 1 31.641 5.530 18.309 1.00 32.28 O HETATM 2968 O HOH 2 20.296 5.892 17.979 1.00 39.51 O HETATM 2969 O HOH 3 24.600 13.672 7.908 1.00 34.97 O HETATM 2970 O HOH 4 33.635 10.531 16.750 1.00 37.74 O HETATM 2971 O HOH 5 20.561 7.400 15.687 1.00 33.78 O HETATM 2972 O HOH 6 29.189 -6.751 28.186 1.00 46.73 O HETATM 2973 O HOH 7 30.796 -10.191 18.040 1.00 41.31 O HETATM 2974 O HOH 8 37.646 1.773 2.213 1.00 51.22 O HETATM 2975 O HOH 9 33.360 -9.620 19.090 1.00 40.81 O HETATM 2976 O HOH 10 19.678 -3.197 -1.490 1.00 44.31 O HETATM 2977 O HOH 11 27.094 15.864 7.198 1.00 60.80 O HETATM 2978 O HOH 12 20.992 -8.438 3.410 1.00 52.17 O HETATM 2979 O HOH 13 32.404 12.419 14.611 1.00 41.80 O HETATM 2980 O HOH 14 41.865 6.503 22.985 1.00 46.07 O HETATM 2981 O HOH 15 36.137 -6.031 14.325 1.00 45.22 O HETATM 2982 O HOH 16 36.078 -7.042 4.135 1.00 54.45 O HETATM 2983 O HOH 17 17.102 14.369 -1.140 1.00 48.13 O HETATM 2984 O HOH 18 44.334 1.579 7.546 1.00 41.67 O HETATM 2985 O HOH 19 37.885 11.665 1.542 1.00 55.06 O HETATM 2986 O HOH 20 42.282 3.168 7.896 1.00 55.10 O HETATM 2987 O HOH 21 15.955 1.517 -0.536 1.00 38.70 O HETATM 2988 O HOH 22 34.226 -8.703 8.677 1.00 52.66 O HETATM 2989 O HOH 23 14.887 1.836 -2.873 1.00 51.91 O HETATM 2990 O HOH 24 37.281 10.872 18.317 1.00 49.68 O HETATM 2991 O HOH 25 20.166 -4.333 29.910 1.00 48.59 O HETATM 2992 O HOH 26 28.886 13.883 13.994 1.00 42.12 O HETATM 2993 O HOH 27 20.545 3.610 -6.360 1.00 48.18 O HETATM 2994 O HOH 28 20.545 7.903 -8.191 1.00 48.89 O HETATM 2995 O HOH 29 22.192 -2.372 1.152 1.00 48.46 O HETATM 2996 O HOH 30 29.916 -8.087 3.291 1.00 51.97 O HETATM 2997 O HOH 31 42.832 -7.941 15.825 1.00 55.65 O HETATM 2998 O HOH 32 42.313 1.257 29.330 1.00 68.35 O HETATM 2999 O HOH 33 24.634 13.185 1.299 1.00 39.50 O HETATM 3000 O HOH 34 45.942 2.412 9.367 1.00 56.10 O HETATM 3001 O HOH 35 26.436 10.611 17.057 1.00 46.70 O HETATM 3002 O HOH 36 40.894 8.322 7.809 1.00 45.68 O HETATM 3003 O HOH 37 19.637 -4.558 -3.796 1.00 47.11 O HETATM 3004 O HOH 38 45.080 -4.230 0.819 1.00 62.74 O HETATM 3005 O HOH 39 43.318 3.105 11.458 1.00 38.50 O HETATM 3006 O HOH 40 26.075 12.385 14.885 1.00 48.05 O HETATM 3007 O HOH 41 25.213 -8.882 8.254 1.00 49.99 O HETATM 3008 O HOH 42 28.626 -8.532 8.625 1.00 56.00 O HETATM 3009 O HOH 43 30.267 -7.614 11.225 1.00 49.85 O HETATM 3010 O HOH 44 20.476 16.121 11.886 1.00 38.95 O HETATM 3011 O HOH 45 12.130 -15.532 15.879 1.00 34.44 O HETATM 3012 O HOH 46 19.964 -3.542 7.991 1.00 33.33 O HETATM 3013 O HOH 47 12.959 7.523 -3.652 1.00 39.66 O HETATM 3014 O HOH 48 10.814 11.618 19.605 1.00 65.03 O HETATM 3015 O HOH 49 8.995 -5.691 10.623 1.00 37.46 O HETATM 3016 O HOH 50 18.828 13.378 11.941 1.00 47.52 O HETATM 3017 O HOH 51 11.734 -9.760 25.950 1.00 41.11 O HETATM 3018 O HOH 52 16.465 14.583 11.885 1.00 49.91 O HETATM 3019 O HOH 53 23.800 9.603 -4.323 1.00 44.39 O HETATM 3020 O HOH 54 9.351 -10.342 27.304 1.00 45.38 O HETATM 3021 O HOH 55 16.300 7.813 -2.256 1.00 42.97 O HETATM 3022 O HOH 56 18.792 17.255 8.162 1.00 49.94 O HETATM 3023 O HOH 57 18.206 18.174 5.834 1.00 46.86 O HETATM 3024 O HOH 58 5.451 4.264 22.017 1.00 50.68 O HETATM 3025 O HOH 59 20.241 18.696 4.127 1.00 50.31 O HETATM 3026 O HOH 60 6.669 -18.462 15.342 1.00 68.77 O HETATM 3027 O HOH 61 18.338 13.397 19.326 1.00 57.15 O HETATM 3028 O HOH 62 20.450 12.971 18.810 1.00 47.54 O HETATM 3029 O HOH 63 7.205 -6.015 5.689 1.00 41.12 O HETATM 3030 O HOH 64 15.624 8.106 20.505 1.00 53.91 O HETATM 3031 O HOH 65 6.058 8.074 22.001 1.00 45.54 O HETATM 3032 O HOH 66 26.193 -8.446 22.572 1.00 42.22 O HETATM 3033 O HOH 67 3.605 -7.928 6.066 1.00 43.53 O HETATM 3034 O HOH 68 15.036 -14.065 14.386 1.00 66.37 O HETATM 3035 O HOH 69 1.966 -3.935 23.358 1.00 54.02 O HETATM 3036 O HOH 70 -2.068 -8.631 11.981 1.00 55.91 O HETATM 3037 O HOH 71 9.615 -10.295 10.229 1.00 51.33 O HETATM 3038 O HOH 72 14.277 -6.294 5.894 1.00 53.76 O HETATM 3039 O HOH 73 10.171 -7.292 9.033 1.00 51.90 O HETATM 3040 O HOH 74 20.226 -2.745 19.387 1.00 48.18 O HETATM 3041 N ALA A 75 24.943 7.065 23.373 1.00 0.24 N HETATM 3042 CA ALA A 75 25.362 5.666 23.708 1.00 0.06 C HETATM 3043 CB ALA A 75 25.764 5.579 25.183 1.00 -0.00 C HETATM 3044 H5 ALA A 75 26.070 4.549 25.419 1.00 0.03 H HETATM 3045 H6 ALA A 75 24.908 5.861 25.814 1.00 0.03 H HETATM 3046 H7 ALA A 75 26.603 6.264 25.375 1.00 0.03 H HETATM 3047 C ALA A 75 24.266 4.641 23.394 1.00 0.23 C HETATM 3048 O ALA A 75 24.161 3.607 24.067 1.00 -0.39 O HETATM 3049 N ALA A 75 23.452 4.922 22.376 1.00 -0.26 N HETATM 3050 CA ALA A 75 22.334 4.048 22.029 1.00 0.13 C HETATM 3051 CB ALA A 75 21.022 4.757 22.257 1.00 -0.02 C HETATM 3052 H10 ALA A 75 20.192 4.086 21.991 1.00 0.03 H HETATM 3053 H11 ALA A 75 20.979 5.660 21.630 1.00 0.03 H HETATM 3054 H12 ALA A 75 20.939 5.042 23.316 1.00 0.03 H HETATM 3055 C ALA A 75 22.440 3.547 20.589 1.00 0.20 C HETATM 3056 O ALA A 75 22.491 4.330 19.644 1.00 -0.39 O HETATM 3057 N ALA A 75 22.482 2.226 20.450 1.00 -0.26 N HETATM 3058 CA ALA A 75 22.753 1.559 19.183 1.00 0.13 C HETATM 3059 CB ALA A 75 24.135 0.861 19.222 1.00 -0.00 C HETATM 3060 CG2 ALA A 75 24.272 -0.171 18.092 1.00 -0.06 C HETATM 3061 H18 ALA A 75 23.466 -0.915 18.175 1.00 0.02 H HETATM 3062 H19 ALA A 75 25.246 -0.676 18.172 1.00 0.02 H HETATM 3063 H20 ALA A 75 24.202 0.339 17.120 1.00 0.02 H HETATM 3064 CG1 ALA A 75 25.263 1.899 19.103 1.00 -0.05 C HETATM 3065 CD1 ALA A 75 25.505 2.725 20.347 1.00 -0.06 C HETATM 3066 H21 ALA A 75 26.326 3.434 20.163 1.00 0.02 H HETATM 3067 H22 ALA A 75 25.775 2.061 21.181 1.00 0.02 H HETATM 3068 H23 ALA A 75 24.591 3.281 20.602 1.00 0.02 H HETATM 3069 H16 ALA A 75 25.010 2.585 18.282 1.00 0.03 H HETATM 3070 H17 ALA A 75 26.194 1.365 18.861 1.00 0.03 H HETATM 3071 H15 ALA A 75 24.233 0.340 20.186 1.00 0.03 H HETATM 3072 C ALA A 75 21.639 0.551 18.867 1.00 0.20 C HETATM 3073 O ALA A 75 21.617 -0.558 19.406 1.00 -0.39 O HETATM 3074 N ALA A 75 20.721 0.942 17.986 1.00 -0.26 N HETATM 3075 CA ALA A 75 19.573 0.102 17.641 1.00 0.14 C HETATM 3076 CB ALA A 75 18.285 0.928 17.661 1.00 0.02 C HETATM 3077 CG ALA A 75 18.110 1.692 18.940 1.00 -0.04 C HETATM 3078 CD1 ALA A 75 18.182 3.074 18.956 1.00 -0.06 C HETATM 3079 CE1 ALA A 75 18.064 3.780 20.142 1.00 -0.07 C HETATM 3080 CZ ALA A 75 17.912 3.099 21.339 1.00 -0.07 C HETATM 3081 CE2 ALA A 75 17.864 1.712 21.336 1.00 -0.07 C HETATM 3082 CD2 ALA A 75 17.973 1.018 20.141 1.00 -0.06 C HETATM 3083 H29 ALA A 75 17.951 -0.066 20.147 1.00 0.06 H HETATM 3084 H31 ALA A 75 17.741 1.172 22.268 1.00 0.06 H HETATM 3085 H32 ALA A 75 17.831 3.646 22.271 1.00 0.06 H HETATM 3086 H30 ALA A 75 18.090 4.864 20.134 1.00 0.06 H HETATM 3087 H28 ALA A 75 18.333 3.612 18.027 1.00 0.06 H HETATM 3088 H26 ALA A 75 17.429 0.249 17.536 1.00 0.05 H HETATM 3089 H27 ALA A 75 18.311 1.642 16.825 1.00 0.05 H HETATM 3090 C ALA A 75 19.768 -0.649 16.326 1.00 0.21 C HETATM 3091 O ALA A 75 19.008 -0.503 15.374 1.00 -0.39 O HETATM 3092 N ALA A 75 20.824 -1.453 16.292 1.00 -0.26 N HETATM 3093 CA ALA A 75 20.888 -2.601 15.394 1.00 0.14 C HETATM 3094 CB ALA A 75 22.285 -3.240 15.477 1.00 0.02 C HETATM 3095 CG ALA A 75 22.388 -4.650 14.938 1.00 -0.05 C HETATM 3096 CD1 ALA A 75 22.493 -4.886 13.573 1.00 -0.07 C HETATM 3097 CE1 ALA A 75 22.579 -6.172 13.070 1.00 -0.04 C HETATM 3098 CZ ALA A 75 22.570 -7.247 13.935 1.00 0.08 C HETATM 3099 CE2 ALA A 75 22.469 -7.038 15.302 1.00 -0.04 C HETATM 3100 CD2 ALA A 75 22.392 -5.744 15.796 1.00 -0.07 C HETATM 3101 H38 ALA A 75 22.334 -5.583 16.866 1.00 0.05 H HETATM 3102 H40 ALA A 75 22.450 -7.882 15.982 1.00 0.05 H HETATM 3103 OH ALA A 75 22.665 -8.527 13.424 1.00 -0.34 O HETATM 3104 H41 ALA A 75 22.726 -8.485 12.477 1.00 0.25 H HETATM 3105 H39 ALA A 75 22.653 -6.334 12.001 1.00 0.05 H HETATM 3106 H37 ALA A 75 22.508 -4.046 12.888 1.00 0.05 H HETATM 3107 H35 ALA A 75 22.587 -3.258 16.535 1.00 0.05 H HETATM 3108 H36 ALA A 75 22.982 -2.607 14.907 1.00 0.05 H HETATM 3109 C ALA A 75 19.773 -3.584 15.792 1.00 0.21 C HETATM 3110 O ALA A 75 19.460 -3.752 16.979 1.00 -0.39 O HETATM 3111 N ALA A 75 19.143 -4.191 14.792 1.00 -0.26 N HETATM 3112 CA ALA A 75 18.144 -5.238 15.022 1.00 0.13 C HETATM 3113 CB ALA A 75 16.722 -4.660 15.039 1.00 -0.01 C HETATM 3114 CG ALA A 75 15.627 -5.274 14.152 1.00 -0.04 C HETATM 3115 CD1 ALA A 75 15.307 -6.727 14.496 1.00 -0.06 C HETATM 3116 H47 ALA A 75 14.519 -7.098 13.824 1.00 0.02 H HETATM 3117 H48 ALA A 75 14.960 -6.789 15.538 1.00 0.02 H HETATM 3118 H49 ALA A 75 16.212 -7.341 14.374 1.00 0.02 H HETATM 3119 CD2 ALA A 75 14.375 -4.425 14.281 1.00 -0.06 C HETATM 3120 H50 ALA A 75 14.613 -3.380 14.032 1.00 0.02 H HETATM 3121 H51 ALA A 75 14.000 -4.479 15.314 1.00 0.02 H HETATM 3122 H52 ALA A 75 13.605 -4.800 13.591 1.00 0.02 H HETATM 3123 H46 ALA A 75 15.973 -5.242 13.108 1.00 0.03 H HETATM 3124 H44 ALA A 75 16.807 -3.602 14.750 1.00 0.03 H HETATM 3125 H45 ALA A 75 16.364 -4.729 16.077 1.00 0.03 H HETATM 3126 C ALA A 75 18.278 -6.339 13.973 1.00 0.20 C HETATM 3127 O ALA A 75 18.179 -6.089 12.769 1.00 -0.39 O HETATM 3128 N ALA A 75 18.541 -7.549 14.455 1.00 -0.26 N HETATM 3129 CA ALA A 75 18.524 -8.753 13.632 1.00 0.13 C HETATM 3130 CB ALA A 75 19.679 -9.679 14.014 1.00 -0.02 C HETATM 3131 H55 ALA A 75 19.650 -10.580 13.384 1.00 0.03 H HETATM 3132 H56 ALA A 75 19.583 -9.967 15.071 1.00 0.03 H HETATM 3133 H57 ALA A 75 20.634 -9.156 13.862 1.00 0.03 H HETATM 3134 C ALA A 75 17.184 -9.465 13.814 1.00 0.20 C HETATM 3135 O ALA A 75 16.937 -10.107 14.840 1.00 -0.39 O HETATM 3136 N ALA A 75 16.311 -9.301 12.825 1.00 -0.27 N HETATM 3137 CA ALA A 75 15.068 -10.052 12.759 1.00 0.13 C HETATM 3138 C ALA A 75 15.261 -11.408 12.108 1.00 0.25 C HETATM 3139 O ALA A 75 16.156 -11.580 11.280 1.00 -0.37 O HETATM 3140 O1 ALA A 75 14.459 -12.418 12.433 1.00 -0.29 O HETATM 3141 H61 ALA A 75 14.976 -13.128 12.795 1.00 0.25 H HETATM 3142 H59 ALA A 75 14.336 -9.477 12.173 1.00 0.08 H HETATM 3143 H60 ALA A 75 14.686 -10.199 13.780 1.00 0.08 H HETATM 3144 H58 ALA A 75 16.516 -8.640 12.103 1.00 0.19 H HETATM 3145 H54 ALA A 75 18.636 -8.466 12.576 1.00 0.08 H HETATM 3146 H53 ALA A 75 18.761 -7.638 15.427 1.00 0.19 H HETATM 3147 H43 ALA A 75 18.339 -5.683 16.009 1.00 0.08 H HETATM 3148 H42 ALA A 75 19.358 -3.925 13.852 1.00 0.19 H HETATM 3149 H34 ALA A 75 20.715 -2.267 14.360 1.00 0.08 H HETATM 3150 H33 ALA A 75 21.597 -1.266 16.899 1.00 0.19 H HETATM 3151 H25 ALA A 75 19.481 -0.660 18.429 1.00 0.08 H HETATM 3152 H24 ALA A 75 20.818 1.835 17.547 1.00 0.19 H HETATM 3153 H14 ALA A 75 22.771 2.317 18.387 1.00 0.08 H HETATM 3154 H13 ALA A 75 22.319 1.660 21.258 1.00 0.19 H HETATM 3155 H9 ALA A 75 22.369 3.172 22.694 1.00 0.08 H HETATM 3156 H8 ALA A 75 23.610 5.750 21.838 1.00 0.19 H HETATM 3157 H4 ALA A 75 26.241 5.419 23.095 1.00 0.11 H HETATM 3158 H1 ALA A 75 25.692 7.702 23.595 1.00 0.20 H HETATM 3159 H2 ALA A 75 24.125 7.308 23.909 1.00 0.20 H HETATM 3160 H3 ALA A 75 24.731 7.126 22.390 1.00 0.20 H CONECT 3041 3042 3158 3159 3160 CONECT 3042 3041 3043 3047 3157 CONECT 3043 3042 3044 3045 3046 CONECT 3044 3043 CONECT 3045 3043 CONECT 3046 3043 CONECT 3047 3042 3048 3049 CONECT 3048 3047 CONECT 3049 3047 3050 3156 CONECT 3050 3049 3051 3055 3155 CONECT 3051 3050 3052 3053 3054 CONECT 3052 3051 CONECT 3053 3051 CONECT 3054 3051 CONECT 3055 3050 3056 3057 CONECT 3056 3055 CONECT 3057 3055 3058 3154 CONECT 3058 3057 3059 3072 3153 CONECT 3059 3058 3060 3064 3071 CONECT 3060 3059 3061 3062 3063 CONECT 3061 3060 CONECT 3062 3060 CONECT 3063 3060 CONECT 3064 3059 3065 3069 3070 CONECT 3065 3064 3066 3067 3068 CONECT 3066 3065 CONECT 3067 3065 CONECT 3068 3065 CONECT 3069 3064 CONECT 3070 3064 CONECT 3071 3059 CONECT 3072 3058 3073 3074 CONECT 3073 3072 CONECT 3074 3072 3075 3152 CONECT 3075 3074 3076 3090 3151 CONECT 3076 3075 3077 3088 3089 CONECT 3077 3076 3078 3082 CONECT 3078 3077 3079 3087 CONECT 3079 3078 3080 3086 CONECT 3080 3079 3081 3085 CONECT 3081 3080 3082 3084 CONECT 3082 3077 3081 3083 CONECT 3083 3082 CONECT 3084 3081 CONECT 3085 3080 CONECT 3086 3079 CONECT 3087 3078 CONECT 3088 3076 CONECT 3089 3076 CONECT 3090 3075 3091 3092 CONECT 3091 3090 CONECT 3092 3090 3093 3150 CONECT 3093 3092 3094 3109 3149 CONECT 3094 3093 3095 3107 3108 CONECT 3095 3094 3096 3100 CONECT 3096 3095 3097 3106 CONECT 3097 3096 3098 3105 CONECT 3098 3097 3099 3103 CONECT 3099 3098 3100 3102 CONECT 3100 3095 3099 3101 CONECT 3101 3100 CONECT 3102 3099 CONECT 3103 3098 3104 CONECT 3104 3103 CONECT 3105 3097 CONECT 3106 3096 CONECT 3107 3094 CONECT 3108 3094 CONECT 3109 3093 3110 3111 CONECT 3110 3109 CONECT 3111 3109 3112 3148 CONECT 3112 3111 3113 3126 3147 CONECT 3113 3112 3114 3124 3125 CONECT 3114 3113 3115 3119 3123 CONECT 3115 3114 3116 3117 3118 CONECT 3116 3115 CONECT 3117 3115 CONECT 3118 3115 CONECT 3119 3114 3120 3121 3122 CONECT 3120 3119 CONECT 3121 3119 CONECT 3122 3119 CONECT 3123 3114 CONECT 3124 3113 CONECT 3125 3113 CONECT 3126 3112 3127 3128 CONECT 3127 3126 CONECT 3128 3126 3129 3146 CONECT 3129 3128 3130 3134 3145 CONECT 3130 3129 3131 3132 3133 CONECT 3131 3130 CONECT 3132 3130 CONECT 3133 3130 CONECT 3134 3129 3135 3136 CONECT 3135 3134 CONECT 3136 3134 3137 3144 CONECT 3137 3136 3138 3142 3143 CONECT 3138 3137 3139 3140 CONECT 3139 3138 CONECT 3140 3138 3141 CONECT 3141 3140 CONECT 3142 3137 CONECT 3143 3137 CONECT 3144 3136 CONECT 3145 3129 CONECT 3146 3128 CONECT 3147 3112 CONECT 3148 3111 CONECT 3149 3093 CONECT 3150 3092 CONECT 3151 3075 CONECT 3152 3074 CONECT 3153 3058 CONECT 3154 3057 CONECT 3155 3050 CONECT 3156 3049 CONECT 3157 3042 CONECT 3158 3041 CONECT 3159 3041 CONECT 3160 3041 MASTER 0 0 0 0 0 0 0 0 3158 2 120 16 END
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Structure:
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Protein
Pocket-Ligand
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Related entries of code: 2nxd
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1a94
RCSB PDB
PDBbind
99aa, >1A94_1|Chains... at 90%
1aid
RCSB PDB
PDBbind
99aa, >1AID_1|Chains... at 91%
1b6j
RCSB PDB
PDBbind
99aa, >1B6J_1|Chains... at 93%
1b6k
RCSB PDB
PDBbind
99aa, >1B6K_1|Chains... at 95%
1b6l
RCSB PDB
PDBbind
99aa, >1B6L_1|Chains... at 95%
1b6m
RCSB PDB
PDBbind
99aa, >1B6M_1|Chains... at 95%
1b6p
RCSB PDB
PDBbind
99aa, >1B6P_1|Chains... at 95%
1cpi
RCSB PDB
PDBbind
99aa, >1CPI_1|Chains... at 93%
1d4k
RCSB PDB
PDBbind
99aa, >1D4K_1|Chains... at 95%
1d4l
RCSB PDB
PDBbind
99aa, >1D4L_1|Chains... at 95%
1kzk
RCSB PDB
PDBbind
99aa, >1KZK_1|Chains... at 92%
1mtr
RCSB PDB
PDBbind
99aa, >1MTR_1|Chains... at 95%
1sdt
RCSB PDB
PDBbind
99aa, >1SDT_1|Chains... at 91%
1sdu
RCSB PDB
PDBbind
99aa, >1SDU_1|Chains... at 90%
1sdv
RCSB PDB
PDBbind
99aa, >1SDV_1|Chains... at 90%
1z1h
RCSB PDB
PDBbind
99aa, >1Z1H_1|Chains... at 95%
1z1r
RCSB PDB
PDBbind
99aa, >1Z1R_1|Chains... at 95%
2aoc
RCSB PDB
PDBbind
99aa, >2AOC_1|Chains... at 90%
2aod
RCSB PDB
PDBbind
99aa, >2AOD_1|Chains... at 91%
2aoe
RCSB PDB
PDBbind
99aa, >2AOE_1|Chains... at 90%
2aog
RCSB PDB
PDBbind
99aa, >2AOG_1|Chains... at 90%
2aoh
RCSB PDB
PDBbind
99aa, >2AOH_1|Chains... at 90%
2avm
RCSB PDB
PDBbind
99aa, >2AVM_1|Chains... at 90%
2avo
RCSB PDB
PDBbind
99aa, >2AVO_1|Chains... at 90%
2avq
RCSB PDB
PDBbind
99aa, >2AVQ_1|Chains... at 90%
2avs
RCSB PDB
PDBbind
99aa, >2AVS_1|Chains... at 90%
2avv
RCSB PDB
PDBbind
99aa, >2AVV_1|Chains... at 90%
2f3k
RCSB PDB
PDBbind
99aa, >2F3K_1|Chains... at 91%
2f80
RCSB PDB
PDBbind
99aa, >2F80_1|Chains... at 90%
2f81
RCSB PDB
PDBbind
99aa, >2F81_1|Chains... at 90%
2f8g
RCSB PDB
PDBbind
99aa, >2F8G_1|Chains... at 90%
2fgu
RCSB PDB
PDBbind
99aa, >2FGU_1|Chains... at 91%
2fgv
RCSB PDB
PDBbind
99aa, >2FGV_1|Chains... at 91%
2hb3
RCSB PDB
PDBbind
99aa, >2HB3_1|Chains... at 91%
2hs1
RCSB PDB
PDBbind
99aa, >2HS1_1|Chains... at 90%
2hs2
RCSB PDB
PDBbind
99aa, >2HS2_1|Chains... at 92%
2i0a
RCSB PDB
PDBbind
99aa, >2I0A_1|Chains... at 91%
2i0d
RCSB PDB
PDBbind
99aa, >2I0D_1|Chains... at 91%
2idw
RCSB PDB
PDBbind
99aa, >2IDW_1|Chains... at 90%
2ien
RCSB PDB
PDBbind
99aa, >2IEN_1|Chains... at 91%
2ieo
RCSB PDB
PDBbind
99aa, >2IEO_1|Chains... at 90%
2nmy
RCSB PDB
PDBbind
99aa, >2NMY_1|Chains... at 90%
2nmz
RCSB PDB
PDBbind
99aa, >2NMZ_1|Chains... at 90%
2nnk
RCSB PDB
PDBbind
99aa, >2NNK_1|Chains... at 90%
2nnp
RCSB PDB
PDBbind
99aa, >2NNP_1|Chains... at 90%
2nxl
RCSB PDB
PDBbind
99aa, >2NXL_1|Chains... at 90%
2nxm
RCSB PDB
PDBbind
99aa, >2NXM_1|Chains... at 90%
2psu
RCSB PDB
PDBbind
99aa, >2PSU_1|Chains... at 91%
2psv
RCSB PDB
PDBbind
99aa, >2PSV_1|Chains... at 91%
2q54
RCSB PDB
PDBbind
99aa, >2Q54_1|Chains... at 91%
2q55
RCSB PDB
PDBbind
99aa, >2Q55_1|Chains... at 91%
2q5k
RCSB PDB
PDBbind
99aa, >2Q5K_1|Chains... at 91%
2qci
RCSB PDB
PDBbind
99aa, >2QCI_1|Chains... at 90%
2qd6
RCSB PDB
PDBbind
99aa, >2QD6_1|Chains... at 90%
2qd7
RCSB PDB
PDBbind
99aa, >2QD7_1|Chains... at 90%
2qd8
RCSB PDB
PDBbind
99aa, >2QD8_1|Chains... at 90%
2qhy
RCSB PDB
PDBbind
99aa, >2QHY_1|Chains... at 91%
2qhz
RCSB PDB
PDBbind
99aa, >2QHZ_1|Chains... at 91%
2qi0
RCSB PDB
PDBbind
99aa, >2QI0_1|Chains... at 91%
2qi1
RCSB PDB
PDBbind
99aa, >2QI1_1|Chains... at 91%
2qi3
RCSB PDB
PDBbind
99aa, >2QI3_1|Chains... at 91%
2qi4
RCSB PDB
PDBbind
99aa, >2QI4_1|Chains... at 91%
2qi5
RCSB PDB
PDBbind
99aa, >2QI5_1|Chains... at 91%
2qi6
RCSB PDB
PDBbind
99aa, >2QI6_1|Chains... at 91%
2qi7
RCSB PDB
PDBbind
99aa, >2QI7_1|Chains... at 91%
2z4o
RCSB PDB
PDBbind
99aa, >2Z4O_1|Chains... at 91%
3a2o
RCSB PDB
PDBbind
99aa, >3A2O_1|Chains... at 91%
3aid
RCSB PDB
PDBbind
99aa, >3AID_1|Chains... at 92%
3bva
RCSB PDB
PDBbind
99aa, >3BVA_1|Chains... at 90%
3bvb
RCSB PDB
PDBbind
99aa, >3BVB_1|Chains... at 90%
3bxs
RCSB PDB
PDBbind
99aa, >3BXS_1|Chains... at 95%
3cyw
RCSB PDB
PDBbind
99aa, >3CYW_1|Chains... at 90%
3cyx
RCSB PDB
PDBbind
99aa, >3CYX_1|Chains... at 90%
3d1x
RCSB PDB
PDBbind
99aa, >3D1X_1|Chains... at 90%
3d1y
RCSB PDB
PDBbind
99aa, >3D1Y_1|Chains... at 90%
3d1z
RCSB PDB
PDBbind
99aa, >3D1Z_1|Chains... at 90%
3d20
RCSB PDB
PDBbind
99aa, >3D20_1|Chains... at 90%
3dcr
RCSB PDB
PDBbind
99aa, >3DCR_1|Chains... at 98%
3djk
RCSB PDB
PDBbind
99aa, >3DJK_1|Chains... at 91%
3dk1
RCSB PDB
PDBbind
99aa, >3DK1_1|Chains... at 91%
3ekv
RCSB PDB
PDBbind
99aa, >3EKV_1|Chains... at 91%
3ekx
RCSB PDB
PDBbind
99aa, >3EKX_1|Chains... at 91%
3eky
RCSB PDB
PDBbind
99aa, >3EKY_1|Chains... at 91%
3el1
RCSB PDB
PDBbind
99aa, >3EL1_1|Chains... at 92%
3el9
RCSB PDB
PDBbind
99aa, >3EL9_1|Chains... at 90%
3fsm
RCSB PDB
PDBbind
203aa, >3FSM_1|Chain... *
3gi4
RCSB PDB
PDBbind
99aa, >3GI4_1|Chains... at 91%
3gi5
RCSB PDB
PDBbind
99aa, >3GI5_1|Chains... at 91%
3gi6
RCSB PDB
PDBbind
99aa, >3GI6_1|Chains... at 91%
3h5b
RCSB PDB
PDBbind
99aa, >3H5B_1|Chains... at 91%
3hau
RCSB PDB
PDBbind
99aa, >3HAU_1|Chains... at 98%
3haw
RCSB PDB
PDBbind
99aa, >3HAW_1|Chains... at 100%
3hbo
RCSB PDB
PDBbind
99aa, >3HBO_1|Chains... at 100%
3hdk
RCSB PDB
PDBbind
99aa, >3HDK_1|Chains... at 100%
3hlo
RCSB PDB
PDBbind
203aa, >3HLO_1|Chain... at 99%
3i6o
RCSB PDB
PDBbind
99aa, >3I6O_1|Chains... at 91%
3i7e
RCSB PDB
PDBbind
99aa, >3I7E_1|Chains... at 92%
3iaw
RCSB PDB
PDBbind
203aa, >3IAW_1|Chain... at 99%
3ka2
RCSB PDB
PDBbind
203aa, >3KA2_1|Chain... at 99%
3lzv
RCSB PDB
PDBbind
99aa, >3LZV_1|Chains... at 90%
3mxd
RCSB PDB
PDBbind
99aa, >3MXD_1|Chains... at 91%
3mxe
RCSB PDB
PDBbind
99aa, >3MXE_1|Chains... at 91%
3nu3
RCSB PDB
PDBbind
99aa, >3NU3_1|Chains... at 91%
3nu4
RCSB PDB
PDBbind
99aa, >3NU4_1|Chains... at 90%
3nu5
RCSB PDB
PDBbind
99aa, >3NU5_1|Chains... at 90%
3nu6
RCSB PDB
PDBbind
99aa, >3NU6_1|Chains... at 90%
3nu9
RCSB PDB
PDBbind
99aa, >3NU9_1|Chains... at 90%
3nuj
RCSB PDB
PDBbind
99aa, >3NUJ_1|Chains... at 90%
3nuo
RCSB PDB
PDBbind
99aa, >3NUO_1|Chains... at 90%
3o99
RCSB PDB
PDBbind
99aa, >3O99_1|Chains... at 91%
3o9a
RCSB PDB
PDBbind
99aa, >3O9A_1|Chains... at 91%
3o9b
RCSB PDB
PDBbind
99aa, >3O9B_1|Chains... at 91%
3o9c
RCSB PDB
PDBbind
99aa, >3O9C_1|Chains... at 91%
3o9d
RCSB PDB
PDBbind
99aa, >3O9D_1|Chains... at 91%
3o9e
RCSB PDB
PDBbind
99aa, >3O9E_1|Chains... at 91%
3o9f
RCSB PDB
PDBbind
99aa, >3O9F_1|Chains... at 91%
3o9g
RCSB PDB
PDBbind
99aa, >3O9G_1|Chains... at 91%
3o9h
RCSB PDB
PDBbind
99aa, >3O9H_1|Chains... at 91%
3o9i
RCSB PDB
PDBbind
99aa, >3O9I_1|Chains... at 91%
3ok9
RCSB PDB
PDBbind
99aa, >3OK9_1|Chains... at 91%
3oxc
RCSB PDB
PDBbind
99aa, >3OXC_1|Chains... at 91%
3pwm
RCSB PDB
PDBbind
99aa, >3PWM_1|Chains... at 90%
3qaa
RCSB PDB
PDBbind
99aa, >3QAA_1|Chains... at 91%
3st5
RCSB PDB
PDBbind
99aa, >3ST5_1|Chains... at 91%
3vf5
RCSB PDB
PDBbind
99aa, >3VF5_1|Chains... at 90%
3vf7
RCSB PDB
PDBbind
99aa, >3VF7_1|Chains... at 90%
3vfa
RCSB PDB
PDBbind
99aa, >3VFA_1|Chains... at 90%
3vfb
RCSB PDB
PDBbind
99aa, >3VFB_1|Chains... at 90%
4dfg
RCSB PDB
PDBbind
99aa, >4DFG_1|Chains... at 91%
4djo
RCSB PDB
PDBbind
99aa, >4DJO_1|Chains... at 91%
4djp
RCSB PDB
PDBbind
99aa, >4DJP_1|Chains... at 91%
4djq
RCSB PDB
PDBbind
99aa, >4DJQ_1|Chains... at 91%
4djr
RCSB PDB
PDBbind
99aa, >4DJR_1|Chains... at 91%
4ej8
RCSB PDB
PDBbind
99aa, >4EJ8_1|Chains... at 92%
4ejl
RCSB PDB
PDBbind
99aa, >4EJL_1|Chains... at 92%
4ep2
RCSB PDB
PDBbind
203aa, >4EP2_1|Chain... at 90%
4hdb
RCSB PDB
PDBbind
99aa, >4HDB_1|Chains... at 90%
4hdf
RCSB PDB
PDBbind
99aa, >4HDF_1|Chains... at 90%
4hdp
RCSB PDB
PDBbind
99aa, >4HDP_1|Chains... at 90%
4he9
RCSB PDB
PDBbind
99aa, >4HE9_1|Chains... at 90%
4heg
RCSB PDB
PDBbind
99aa, >4HEG_1|Chains... at 90%
4kb9
RCSB PDB
PDBbind
99aa, >4KB9_1|Chains... at 91%
4q1w
RCSB PDB
PDBbind
99aa, >4Q1W_1|Chains... at 90%
4q1x
RCSB PDB
PDBbind
99aa, >4Q1X_1|Chains... at 90%
4q1y
RCSB PDB
PDBbind
99aa, >4Q1Y_1|Chains... at 90%
4u8w
RCSB PDB
PDBbind
99aa, >4U8W_1|Chains... at 91%
4zip
RCSB PDB
PDBbind
99aa, >4ZIP_1|Chains... at 91%
4zls
RCSB PDB
PDBbind
99aa, >4ZLS_1|Chains... at 91%
5bry
RCSB PDB
PDBbind
99aa, >5BRY_1|Chains... at 91%
5bs4
RCSB PDB
PDBbind
99aa, >5BS4_1|Chains... at 91%
5dgu
RCSB PDB
PDBbind
99aa, >5DGU_1|Chains... at 91%
5dgw
RCSB PDB
PDBbind
99aa, >5DGW_1|Chains... at 91%
5jfp
RCSB PDB
PDBbind
99aa, >5JFP_1|Chains... at 91%
5jfu
RCSB PDB
PDBbind
99aa, >5JFU_1|Chains... at 91%
5jg1
RCSB PDB
PDBbind
99aa, >5JG1_1|Chains... at 91%
5ult
RCSB PDB
PDBbind
99aa, >5ULT_1|Chains... at 91%
5uov
RCSB PDB
PDBbind
99aa, >5UOV_1|Chains... at 91%
5upz
RCSB PDB
PDBbind
99aa, >5UPZ_1|Chains... at 91%
5wlo
RCSB PDB
PDBbind
99aa, >5WLO_1|Chains... at 91%
6b4n
RCSB PDB
PDBbind
99aa, >6B4N_1|Chains... at 91%
6c8x
RCSB PDB
PDBbind
99aa, >6C8X_1|Chains... at 91%
6cdj
RCSB PDB
PDBbind
99aa, >6CDJ_1|Chains... at 91%
6cdl
RCSB PDB
PDBbind
99aa, >6CDL_1|Chains... at 91%
6dif
RCSB PDB
PDBbind
99aa, >6DIF_1|Chains... at 91%
6dil
RCSB PDB
PDBbind
99aa, >6DIL_1|Chains... at 90%
6dj1
RCSB PDB
PDBbind
99aa, >6DJ1_1|Chains... at 91%
6dj2
RCSB PDB
PDBbind
99aa, >6DJ2_1|Chains... at 90%
6dj5
RCSB PDB
PDBbind
99aa, >6DJ5_1|Chains... at 90%
6dj7
RCSB PDB
PDBbind
99aa, >6DJ7_1|Chains... at 90%
6e7j
RCSB PDB
PDBbind
99aa, >6E7J_1|Chains... at 91%
6e9a
RCSB PDB
PDBbind
99aa, >6E9A_1|Chains... at 91%
7hvp
RCSB PDB
PDBbind
99aa, >7HVP_1|Chains... at 93%
8hvp
RCSB PDB
PDBbind
99aa, >8HVP_1|Chains... at 93%
6o48
RCSB PDB
PDBbind
99aa, >6O48_1|Chains... at 91%
6ixd
RCSB PDB
PDBbind
99aa, >6IXD_1|Chains... at 91%
6u7o
RCSB PDB
PDBbind
99aa, >6U7O_1|Chains... at 91%
6u7p
RCSB PDB
PDBbind
99aa, >6U7P_1|Chains... at 91%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1aqc
RCSB PDB
PDBbind
10-mer
1awi
RCSB PDB
PDBbind
10-mer
1aze
RCSB PDB
PDBbind
10-mer
1bjr
RCSB PDB
PDBbind
10-mer
1cka
RCSB PDB
PDBbind
10-mer
1ckb
RCSB PDB
PDBbind
10-mer
1eb1
RCSB PDB
PDBbind
10-mer
1gbq
RCSB PDB
PDBbind
10-mer
1gvu
RCSB PDB
PDBbind
10-mer
1him
RCSB PDB
PDBbind
10-mer
1jd5
RCSB PDB
PDBbind
10-mer
1jd6
RCSB PDB
PDBbind
10-mer
1jmq
RCSB PDB
PDBbind
10-mer
1pyw
RCSB PDB
PDBbind
10-mer
1vj6
RCSB PDB
PDBbind
10-mer
1vr1
RCSB PDB
PDBbind
10-mer
1y2a
RCSB PDB
PDBbind
10-mer
1ywi
RCSB PDB
PDBbind
10-mer
1yy6
RCSB PDB
PDBbind
10-mer
1zkk
RCSB PDB
PDBbind
10-mer
2a0t
RCSB PDB
PDBbind
10-mer
2aoh
RCSB PDB
PDBbind
10-mer
2aoj
RCSB PDB
PDBbind
10-mer
2axi
RCSB PDB
PDBbind
10-mer
2azm
RCSB PDB
PDBbind
10-mer
2b7f
RCSB PDB
PDBbind
10-mer
2c2l
RCSB PDB
PDBbind
10-mer
2gfa
RCSB PDB
PDBbind
10-mer
2h13
RCSB PDB
PDBbind
10-mer
2hrp
RCSB PDB
PDBbind
10-mer
2ig0
RCSB PDB
PDBbind
10-mer
2jmj
RCSB PDB
PDBbind
10-mer
2jqi
RCSB PDB
PDBbind
10-mer
2jql
RCSB PDB
PDBbind
10-mer
2k2r
RCSB PDB
PDBbind
10-mer
2ke1
RCSB PDB
PDBbind
10-mer
2mnz
RCSB PDB
PDBbind
10-mer
2nxl
RCSB PDB
PDBbind
10-mer
2nxm
RCSB PDB
PDBbind
10-mer
2o9v
RCSB PDB
PDBbind
10-mer
2peh
RCSB PDB
PDBbind
10-mer
2pr9
RCSB PDB
PDBbind
10-mer
2puy
RCSB PDB
PDBbind
10-mer
2qqs
RCSB PDB
PDBbind
10-mer
2r3y
RCSB PDB
PDBbind
10-mer
2r7g
RCSB PDB
PDBbind
10-mer
2rr4
RCSB PDB
PDBbind
10-mer
2v7d
RCSB PDB
PDBbind
10-mer
2vnf
RCSB PDB
PDBbind
10-mer
2w6t
RCSB PDB
PDBbind
10-mer
2w77
RCSB PDB
PDBbind
10-mer
2wa8
RCSB PDB
PDBbind
10-mer
2wp1
RCSB PDB
PDBbind
10-mer
2z5o
RCSB PDB
PDBbind
10-mer
3al3
RCSB PDB
PDBbind
10-mer
3bh8
RCSB PDB
PDBbind
10-mer
3bh9
RCSB PDB
PDBbind
10-mer
3bhb
RCSB PDB
PDBbind
10-mer
3c94
RCSB PDB
PDBbind
10-mer
3d1e
RCSB PDB
PDBbind
10-mer
3diw
RCSB PDB
PDBbind
10-mer
3dnj
RCSB PDB
PDBbind
10-mer
3dpc
RCSB PDB
PDBbind
10-mer
3dvp
RCSB PDB
PDBbind
10-mer
3ebb
RCSB PDB
PDBbind
10-mer
3er5
RCSB PDB
PDBbind
10-mer
3f9w
RCSB PDB
PDBbind
10-mer
3f9y
RCSB PDB
PDBbind
10-mer
3fe7
RCSB PDB
PDBbind
10-mer
3fea
RCSB PDB
PDBbind
10-mer
3gbq
RCSB PDB
PDBbind
10-mer
3gds
RCSB PDB
PDBbind
10-mer
3hg1
RCSB PDB
PDBbind
10-mer
3iqj
RCSB PDB
PDBbind
10-mer
3ivv
RCSB PDB
PDBbind
10-mer
3nkx
RCSB PDB
PDBbind
10-mer
3oq5
RCSB PDB
PDBbind
10-mer
3puj
RCSB PDB
PDBbind
10-mer
3puk
RCSB PDB
PDBbind
10-mer
3pxe
RCSB PDB
PDBbind
10-mer
3q8d
RCSB PDB
PDBbind
10-mer
3qzt
RCSB PDB
PDBbind
10-mer
3rwi
RCSB PDB
PDBbind
10-mer
3shv
RCSB PDB
PDBbind
10-mer
3szm
RCSB PDB
PDBbind
10-mer
3tkz
RCSB PDB
PDBbind
10-mer
3tl0
RCSB PDB
PDBbind
10-mer
3uii
RCSB PDB
PDBbind
10-mer
3uik
RCSB PDB
PDBbind
10-mer
3uvm
RCSB PDB
PDBbind
10-mer
3zmp
RCSB PDB
PDBbind
10-mer
3zmq
RCSB PDB
PDBbind
10-mer
4bg6
RCSB PDB
PDBbind
10-mer
4e34
RCSB PDB
PDBbind
10-mer
4e35
RCSB PDB
PDBbind
10-mer
4e3b
RCSB PDB
PDBbind
10-mer
4e81
RCSB PDB
PDBbind
10-mer
4e9d
RCSB PDB
PDBbind
10-mer
4er4
RCSB PDB
PDBbind
10-mer
4h39
RCSB PDB
PDBbind
10-mer
4h3b
RCSB PDB
PDBbind
10-mer
4hcz
RCSB PDB
PDBbind
10-mer
4i2w
RCSB PDB
PDBbind
10-mer
4i2z
RCSB PDB
PDBbind
10-mer
4jfd
RCSB PDB
PDBbind
10-mer
4jfe
RCSB PDB
PDBbind
10-mer
4jff
RCSB PDB
PDBbind
10-mer
4jjq
RCSB PDB
PDBbind
10-mer
4joe
RCSB PDB
PDBbind
10-mer
4jof
RCSB PDB
PDBbind
10-mer
4jog
RCSB PDB
PDBbind
10-mer
4joh
RCSB PDB
PDBbind
10-mer
4joj
RCSB PDB
PDBbind
10-mer
4jok
RCSB PDB
PDBbind
10-mer
4k6y
RCSB PDB
PDBbind
10-mer
4k72
RCSB PDB
PDBbind
10-mer
4k75
RCSB PDB
PDBbind
10-mer
4k76
RCSB PDB
PDBbind
10-mer
4k78
RCSB PDB
PDBbind
10-mer
4lnp
RCSB PDB
PDBbind
10-mer
4mdr
RCSB PDB
PDBbind
10-mer
4n84
RCSB PDB
PDBbind
10-mer
4nmo
RCSB PDB
PDBbind
10-mer
4nmp
RCSB PDB
PDBbind
10-mer
4nmq
RCSB PDB
PDBbind
10-mer
4nmr
RCSB PDB
PDBbind
10-mer
4nms
RCSB PDB
PDBbind
10-mer
4nmt
RCSB PDB
PDBbind
10-mer
4nmv
RCSB PDB
PDBbind
10-mer
4o2c
RCSB PDB
PDBbind
10-mer
4oz1
RCSB PDB
PDBbind
10-mer
4p0a
RCSB PDB
PDBbind
10-mer
4p0b
RCSB PDB
PDBbind
10-mer
4qok
RCSB PDB
PDBbind
10-mer
4rqz
RCSB PDB
PDBbind
10-mer
4u90
RCSB PDB
PDBbind
10-mer
4v11
RCSB PDB
PDBbind
10-mer
4wj5
RCSB PDB
PDBbind
10-mer
4x1n
RCSB PDB
PDBbind
10-mer
4x1p
RCSB PDB
PDBbind
10-mer
4x1q
RCSB PDB
PDBbind
10-mer
4x1r
RCSB PDB
PDBbind
10-mer
4x1s
RCSB PDB
PDBbind
10-mer
4x34
RCSB PDB
PDBbind
10-mer
4x3s
RCSB PDB
PDBbind
10-mer
4x8n
RCSB PDB
PDBbind
10-mer
4xhv
RCSB PDB
PDBbind
10-mer
4z0u
RCSB PDB
PDBbind
10-mer
4z7i
RCSB PDB
PDBbind
10-mer
4zhl
RCSB PDB
PDBbind
10-mer
4zhm
RCSB PDB
PDBbind
10-mer
5ab0
RCSB PDB
PDBbind
10-mer
5aei
RCSB PDB
PDBbind
10-mer
5azg
RCSB PDB
PDBbind
10-mer
5c0m
RCSB PDB
PDBbind
10-mer
5c11
RCSB PDB
PDBbind
10-mer
5c13
RCSB PDB
PDBbind
10-mer
5d6y
RCSB PDB
PDBbind
10-mer
5gp7
RCSB PDB
PDBbind
10-mer
5gs4
RCSB PDB
PDBbind
10-mer
5gtr
RCSB PDB
PDBbind
10-mer
5iaw
RCSB PDB
PDBbind
10-mer
5j31
RCSB PDB
PDBbind
10-mer
5jzi
RCSB PDB
PDBbind
10-mer
5myo
RCSB PDB
PDBbind
10-mer
5n1y
RCSB PDB
PDBbind
10-mer
5nx2
RCSB PDB
PDBbind
10-mer
5t6z
RCSB PDB
PDBbind
10-mer
5t70
RCSB PDB
PDBbind
10-mer
5t8r
RCSB PDB
PDBbind
10-mer
5vnb
RCSB PDB
PDBbind
10-mer
5w7i
RCSB PDB
PDBbind
10-mer
5w7j
RCSB PDB
PDBbind
10-mer
5wkf
RCSB PDB
PDBbind
10-mer
5wkh
RCSB PDB
PDBbind
10-mer
6ar2
RCSB PDB
PDBbind
10-mer
6buu
RCSB PDB
PDBbind
10-mer
6fkp
RCSB PDB
PDBbind
10-mer
6mim
RCSB PDB
PDBbind
10-mer
6qtx
RCSB PDB
PDBbind
10-mer
6pek
RCSB PDB
PDBbind
10-mer
6iiw
RCSB PDB
PDBbind
10-mer
6hzx
RCSB PDB
PDBbind
10-mer
6hoi
RCSB PDB
PDBbind
10-mer
6dkp
RCSB PDB
PDBbind
10-mer
6a8n
RCSB PDB
PDBbind
10-mer
5zys
RCSB PDB
PDBbind
10-mer
Entry Information
PDB ID
2nxd
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
HIV-1 protease
Ligand Name
10-mer
EC.Number
E.C.3.4.23.16
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=2.2uM
Release Year
2007
Protein/NA Sequence
Check fasta file
Primary Reference
(2007) Proteins Vol. 70: pp. 678-694
Ligand Properties
Formula
C
4
1
H
6
1
N
8
O
1
0
Molecular Weight
825.971
Exact Mass
825.451
No. of atoms
120
No. of bonds
121
Polar Surface Area
288.87
LOGP Value
0.29 (
Computed with XLOGP3
)
1.79 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 10
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 32
No. of Nitrogen and Oxygen Atoms: 18
No. of Rings: 2
Canonical SMILES
CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)C)CC(C)C)Cc1ccc(cc1)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)C
InChI String
InChI=1S/C41H60N8O10/c1-8-23(4)34(49-37(55)26(7)44-35(53)24(5)42)41(59)48-32(19-27-12-10-9-11-13-27)40(58)47-31(20-28-14-16-29(50)17-15-28)39(57)46-30(18-22(2)3)38(56)45-25(6)36(54)43-21-33(51)52/h9-17,22-26,30-32,34,50H,8,18-21,42H2,1-7H3,(H,43,54)(H,44,53)(H,45,56)(H,46,57)(H,47,58)(H,48,59)(H,49,55)(H,51,52)/p+1/t23-,24-,25-,26-,30-,31-,32-,34-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P03369
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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