Browse entries in the PDBbind-CN Database
HEADER 1SIV_COMPLEX COMPND 1SIV_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 99 PRO GLN PHE SER LEU TRP ARG ARG PRO VAL VAL THR ALA SEQRES 2 A 99 HIS ILE GLU GLY GLN PRO VAL GLU VAL LEU LEU ASP THR SEQRES 3 A 99 GLY ALA ASP ASP SER ILE VAL THR GLY ILE GLU LEU GLY SEQRES 4 A 99 PRO HIS TYR THR PRO LYS ILE VAL GLY GLY ILE GLY GLY SEQRES 5 A 99 PHE ILE ASN THR LYS GLU TYR LYS ASN VAL LYS ILE GLU SEQRES 6 A 99 VAL LEU GLY LYS ARG ILE LYS GLY THR ILE MET THR GLY SEQRES 7 A 99 ASP THR PRO ILE ASN ILE PHE GLY ARG ASN LEU LEU THR SEQRES 8 A 99 ALA LEU GLY MET SER LEU ASN LEU SEQRES 1 B 99 PRO GLN PHE SER LEU TRP ARG ARG PRO VAL VAL THR ALA SEQRES 2 B 99 HIS ILE GLU GLY GLN PRO VAL GLU VAL LEU LEU ASP THR SEQRES 3 B 99 GLY ALA ASP ASP SER ILE VAL THR GLY ILE GLU LEU GLY SEQRES 4 B 99 PRO HIS TYR THR PRO LYS ILE VAL GLY GLY ILE GLY GLY SEQRES 5 B 99 PHE ILE ASN THR LYS GLU TYR LYS ASN VAL LYS ILE GLU SEQRES 6 B 99 VAL LEU GLY LYS ARG ILE LYS GLY THR ILE MET THR GLY SEQRES 7 B 99 ASP THR PRO ILE ASN ILE PHE GLY ARG ASN LEU LEU THR SEQRES 8 B 99 ALA LEU GLY MET SER LEU ASN LEU HET PSI A 233 89 ATOM 1 N PRO A 1 10.896 30.936 52.275 1.00 20.03 N ATOM 2 CA PRO A 1 10.957 30.112 51.068 1.00 19.06 C ATOM 3 C PRO A 1 9.617 30.169 50.368 1.00 18.14 C ATOM 4 O PRO A 1 8.610 29.854 51.006 1.00 19.05 O ATOM 5 CB PRO A 1 11.285 28.686 51.502 1.00 19.34 C ATOM 6 CG PRO A 1 12.217 28.961 52.690 1.00 19.88 C ATOM 7 CD PRO A 1 11.499 30.136 53.341 1.00 18.45 C ATOM 8 HA PRO A 1 11.720 30.469 50.376 1.00 0.00 H ATOM 9 HD3 PRO A 1 10.724 29.771 54.015 1.00 0.00 H ATOM 10 HD2 PRO A 1 12.211 30.741 53.902 1.00 0.00 H ATOM 11 HG3 PRO A 1 13.219 29.234 52.360 1.00 0.00 H ATOM 12 HG2 PRO A 1 12.277 28.104 53.361 1.00 0.00 H ATOM 13 HB2 PRO A 1 10.391 28.143 51.809 1.00 0.00 H ATOM 14 HB3 PRO A 1 11.792 28.132 50.712 1.00 0.00 H ATOM 15 N GLN A 2 9.571 30.595 49.100 1.00 18.15 N ATOM 16 CA GLN A 2 8.345 30.688 48.307 1.00 16.80 C ATOM 17 C GLN A 2 8.747 30.150 46.939 1.00 14.03 C ATOM 18 O GLN A 2 9.801 30.504 46.413 1.00 13.69 O ATOM 19 CB GLN A 2 7.872 32.145 48.191 1.00 17.43 C ATOM 20 CG GLN A 2 7.017 32.334 46.928 1.00 21.45 C ATOM 21 CD GLN A 2 6.001 33.476 46.922 1.00 23.04 C ATOM 22 OE1 GLN A 2 5.509 33.932 47.959 1.00 23.45 O ATOM 23 NE2 GLN A 2 5.567 33.919 45.746 1.00 24.06 N ATOM 24 HA GLN A 2 7.520 30.135 48.755 1.00 0.00 H ATOM 25 HB2 GLN A 2 7.278 32.401 49.068 1.00 0.00 H ATOM 26 HB3 GLN A 2 8.741 32.801 48.138 1.00 0.00 H ATOM 27 HG2 GLN A 2 7.699 32.501 46.095 1.00 0.00 H ATOM 28 HG3 GLN A 2 6.467 31.407 46.766 1.00 0.00 H ATOM 29 HE22 GLN A 2 5.974 33.542 44.866 1.00 0.00 H ATOM 30 HE21 GLN A 2 4.821 34.642 45.706 1.00 0.00 H ATOM 31 H GLN A 2 10.464 30.878 48.649 1.00 0.00 H ATOM 32 N PHE A 3 7.977 29.247 46.383 1.00 13.33 N ATOM 33 CA PHE A 3 8.241 28.663 45.096 1.00 12.13 C ATOM 34 C PHE A 3 7.056 29.174 44.282 1.00 13.32 C ATOM 35 O PHE A 3 5.883 28.968 44.619 1.00 14.56 O ATOM 36 CB PHE A 3 8.277 27.159 45.264 1.00 11.45 C ATOM 37 CG PHE A 3 9.408 26.804 46.217 1.00 12.62 C ATOM 38 CD1 PHE A 3 10.716 26.814 45.767 1.00 12.26 C ATOM 39 CD2 PHE A 3 9.155 26.597 47.560 1.00 10.93 C ATOM 40 CE1 PHE A 3 11.766 26.639 46.658 1.00 12.17 C ATOM 41 CE2 PHE A 3 10.219 26.423 48.437 1.00 10.79 C ATOM 42 CZ PHE A 3 11.531 26.444 48.003 1.00 10.48 C ATOM 43 HA PHE A 3 9.187 28.918 44.619 1.00 0.00 H ATOM 44 HB2 PHE A 3 7.328 26.812 45.674 1.00 0.00 H ATOM 45 HB3 PHE A 3 8.449 26.685 44.297 1.00 0.00 H ATOM 46 HD2 PHE A 3 8.129 26.570 47.928 1.00 0.00 H ATOM 47 HE2 PHE A 3 10.013 26.266 49.496 1.00 0.00 H ATOM 48 HZ PHE A 3 12.356 26.310 48.703 1.00 0.00 H ATOM 49 HE1 PHE A 3 12.792 26.656 46.289 1.00 0.00 H ATOM 50 HD1 PHE A 3 10.923 26.960 44.707 1.00 0.00 H ATOM 51 H PHE A 3 7.130 28.936 46.900 1.00 0.00 H ATOM 52 N SER A 4 7.410 29.982 43.277 1.00 11.92 N ATOM 53 CA SER A 4 6.481 30.618 42.352 1.00 11.94 C ATOM 54 C SER A 4 5.878 29.685 41.293 1.00 12.05 C ATOM 55 O SER A 4 4.996 30.006 40.476 1.00 12.27 O ATOM 56 CB SER A 4 7.257 31.743 41.723 1.00 12.46 C ATOM 57 OG SER A 4 8.474 31.181 41.193 1.00 18.01 O ATOM 58 HA SER A 4 5.602 30.961 42.899 1.00 0.00 H ATOM 59 HB2 SER A 4 7.491 32.500 42.472 1.00 0.00 H ATOM 60 HB3 SER A 4 6.674 32.195 40.921 1.00 0.00 H ATOM 61 HG SER A 4 8.993 30.769 41.928 1.00 0.00 H ATOM 62 H SER A 4 8.424 30.171 43.146 1.00 0.00 H ATOM 63 N LEU A 5 6.617 28.565 41.249 1.00 9.85 N ATOM 64 CA LEU A 5 6.374 27.436 40.397 1.00 8.28 C ATOM 65 C LEU A 5 6.627 27.651 38.922 1.00 8.44 C ATOM 66 O LEU A 5 6.174 26.844 38.138 1.00 7.42 O ATOM 67 CB LEU A 5 4.952 26.956 40.687 1.00 7.33 C ATOM 68 CG LEU A 5 4.729 26.550 42.149 1.00 8.42 C ATOM 69 CD1 LEU A 5 3.234 26.435 42.370 1.00 8.59 C ATOM 70 CD2 LEU A 5 5.523 25.300 42.484 1.00 5.61 C ATOM 71 HA LEU A 5 7.113 26.671 40.636 1.00 0.00 H ATOM 72 HB2 LEU A 5 4.259 27.761 40.443 1.00 0.00 H ATOM 73 HB3 LEU A 5 4.743 26.094 40.054 1.00 0.00 H ATOM 74 HG LEU A 5 5.105 27.301 42.844 1.00 0.00 H ATOM 75 HD21 LEU A 5 5.202 24.483 41.837 1.00 0.00 H ATOM 76 HD22 LEU A 5 6.584 25.493 42.329 1.00 0.00 H ATOM 77 HD23 LEU A 5 5.350 25.030 43.526 1.00 0.00 H ATOM 78 HD11 LEU A 5 2.763 27.397 42.166 1.00 0.00 H ATOM 79 HD12 LEU A 5 2.826 25.679 41.699 1.00 0.00 H ATOM 80 HD13 LEU A 5 3.042 26.147 43.403 1.00 0.00 H ATOM 81 H LEU A 5 7.436 28.511 41.887 1.00 0.00 H ATOM 82 N TRP A 6 7.333 28.703 38.476 1.00 8.79 N ATOM 83 CA TRP A 6 7.618 28.905 37.053 1.00 9.16 C ATOM 84 C TRP A 6 8.693 27.889 36.696 1.00 9.84 C ATOM 85 O TRP A 6 9.011 27.615 35.558 1.00 12.00 O ATOM 86 CB TRP A 6 8.133 30.326 36.770 1.00 9.24 C ATOM 87 CG TRP A 6 6.988 31.339 36.812 1.00 10.30 C ATOM 88 CD1 TRP A 6 6.797 32.125 37.920 1.00 9.18 C ATOM 89 CD2 TRP A 6 6.023 31.553 35.831 1.00 9.52 C ATOM 90 NE1 TRP A 6 5.718 32.818 37.650 1.00 9.59 N ATOM 91 CE2 TRP A 6 5.228 32.524 36.437 1.00 8.22 C ATOM 92 CE3 TRP A 6 5.717 31.085 34.554 1.00 9.14 C ATOM 93 CZ2 TRP A 6 4.123 33.042 35.807 1.00 7.58 C ATOM 94 CZ3 TRP A 6 4.610 31.607 33.914 1.00 9.11 C ATOM 95 CH2 TRP A 6 3.830 32.569 34.537 1.00 9.91 C ATOM 96 HA TRP A 6 6.711 28.778 36.461 1.00 0.00 H ATOM 97 HB2 TRP A 6 8.875 30.594 37.522 1.00 0.00 H ATOM 98 HB3 TRP A 6 8.594 30.349 35.783 1.00 0.00 H ATOM 99 HE1 TRP A 6 5.293 33.512 38.298 1.00 0.00 H ATOM 100 HD1 TRP A 6 7.406 32.164 38.823 1.00 0.00 H ATOM 101 HZ2 TRP A 6 3.500 33.796 36.287 1.00 0.00 H ATOM 102 HH2 TRP A 6 2.960 32.965 34.013 1.00 0.00 H ATOM 103 HZ3 TRP A 6 4.348 31.261 32.914 1.00 0.00 H ATOM 104 HE3 TRP A 6 6.335 30.327 34.073 1.00 0.00 H ATOM 105 H TRP A 6 7.689 29.397 39.164 1.00 0.00 H ATOM 106 N ARG A 7 9.359 27.307 37.655 1.00 9.01 N ATOM 107 CA ARG A 7 10.367 26.317 37.439 1.00 9.76 C ATOM 108 C ARG A 7 9.979 25.232 38.472 1.00 11.89 C ATOM 109 O ARG A 7 9.223 25.507 39.444 1.00 12.43 O ATOM 110 CB ARG A 7 11.708 26.898 37.766 1.00 9.31 C ATOM 111 CG ARG A 7 12.207 27.807 36.695 1.00 11.42 C ATOM 112 CD ARG A 7 13.415 28.561 37.194 1.00 10.62 C ATOM 113 NE ARG A 7 14.522 27.722 37.561 1.00 11.32 N ATOM 114 CZ ARG A 7 15.184 27.957 38.688 1.00 11.78 C ATOM 115 NH1 ARG A 7 14.856 28.959 39.500 1.00 10.38 N ATOM 116 NH2 ARG A 7 16.194 27.155 39.009 1.00 12.18 N ATOM 117 HA ARG A 7 10.427 25.943 36.417 1.00 0.00 H ATOM 118 HB2 ARG A 7 11.629 27.461 38.696 1.00 0.00 H ATOM 119 HB3 ARG A 7 12.421 26.084 37.896 1.00 0.00 H ATOM 120 HG2 ARG A 7 12.482 27.220 35.819 1.00 0.00 H ATOM 121 HG3 ARG A 7 11.423 28.515 36.425 1.00 0.00 H ATOM 122 HD2 ARG A 7 13.120 29.140 38.069 1.00 0.00 H ATOM 123 HD3 ARG A 7 13.745 29.238 36.406 1.00 0.00 H ATOM 124 HE ARG A 7 14.804 26.933 36.946 1.00 0.00 H ATOM 125 HH12 ARG A 7 15.395 29.116 40.376 1.00 0.00 H ATOM 126 HH11 ARG A 7 14.061 29.585 39.259 1.00 0.00 H ATOM 127 HH22 ARG A 7 16.729 27.318 39.886 1.00 0.00 H ATOM 128 HH21 ARG A 7 16.450 26.365 38.383 1.00 0.00 H ATOM 129 H ARG A 7 9.144 27.580 38.635 1.00 0.00 H ATOM 130 N ARG A 8 10.441 23.986 38.263 1.00 11.51 N ATOM 131 CA ARG A 8 10.159 22.884 39.191 1.00 10.68 C ATOM 132 C ARG A 8 10.672 23.281 40.555 1.00 9.59 C ATOM 133 O ARG A 8 11.800 23.749 40.606 1.00 11.22 O ATOM 134 CB ARG A 8 10.892 21.603 38.845 1.00 7.92 C ATOM 135 CG ARG A 8 10.190 20.871 37.748 1.00 9.47 C ATOM 136 CD ARG A 8 11.062 19.731 37.347 1.00 7.95 C ATOM 137 NE ARG A 8 10.340 18.904 36.407 1.00 10.26 N ATOM 138 CZ ARG A 8 10.918 17.886 35.791 1.00 8.87 C ATOM 139 NH1 ARG A 8 12.182 17.573 36.008 1.00 8.90 N ATOM 140 NH2 ARG A 8 10.205 17.149 34.966 1.00 9.34 N ATOM 141 HA ARG A 8 9.085 22.706 39.146 1.00 0.00 H ATOM 142 HB2 ARG A 8 11.904 21.846 38.522 1.00 0.00 H ATOM 143 HB3 ARG A 8 10.937 20.966 39.729 1.00 0.00 H ATOM 144 HG2 ARG A 8 9.229 20.499 38.103 1.00 0.00 H ATOM 145 HG3 ARG A 8 10.030 21.535 36.899 1.00 0.00 H ATOM 146 HD2 ARG A 8 11.325 19.143 38.226 1.00 0.00 H ATOM 147 HD3 ARG A 8 11.971 20.110 36.880 1.00 0.00 H ATOM 148 HE ARG A 8 9.341 19.115 36.210 1.00 0.00 H ATOM 149 HH12 ARG A 8 12.611 16.767 35.510 1.00 0.00 H ATOM 150 HH11 ARG A 8 12.749 18.132 36.677 1.00 0.00 H ATOM 151 HH22 ARG A 8 10.645 16.345 34.474 1.00 0.00 H ATOM 152 HH21 ARG A 8 9.202 17.370 34.806 1.00 0.00 H ATOM 153 H ARG A 8 11.016 23.797 37.417 1.00 0.00 H ATOM 154 N PRO A 9 9.940 23.133 41.652 1.00 9.24 N ATOM 155 CA PRO A 9 10.421 23.392 42.997 1.00 8.00 C ATOM 156 C PRO A 9 11.410 22.345 43.461 1.00 8.28 C ATOM 157 O PRO A 9 11.014 21.421 44.162 1.00 10.29 O ATOM 158 CB PRO A 9 9.145 23.445 43.765 1.00 9.68 C ATOM 159 CG PRO A 9 8.234 22.487 43.073 1.00 7.79 C ATOM 160 CD PRO A 9 8.507 22.823 41.635 1.00 9.38 C ATOM 161 HA PRO A 9 11.005 24.305 43.111 1.00 0.00 H ATOM 162 HD3 PRO A 9 8.294 21.975 40.984 1.00 0.00 H ATOM 163 HD2 PRO A 9 7.921 23.683 41.312 1.00 0.00 H ATOM 164 HG3 PRO A 9 7.191 22.665 43.335 1.00 0.00 H ATOM 165 HG2 PRO A 9 8.493 21.453 43.299 1.00 0.00 H ATOM 166 HB2 PRO A 9 9.307 23.140 44.799 1.00 0.00 H ATOM 167 HB3 PRO A 9 8.728 24.452 43.746 1.00 0.00 H ATOM 168 N VAL A 10 12.663 22.387 43.051 1.00 8.48 N ATOM 169 CA VAL A 10 13.622 21.383 43.474 1.00 8.66 C ATOM 170 C VAL A 10 14.475 21.978 44.563 1.00 9.68 C ATOM 171 O VAL A 10 14.784 23.152 44.512 1.00 11.57 O ATOM 172 CB VAL A 10 14.452 20.932 42.220 1.00 9.05 C ATOM 173 CG1 VAL A 10 15.756 20.221 42.608 1.00 8.32 C ATOM 174 CG2 VAL A 10 13.611 19.925 41.437 1.00 4.74 C ATOM 175 HA VAL A 10 13.139 20.495 43.882 1.00 0.00 H ATOM 176 HB VAL A 10 14.697 21.824 41.644 1.00 0.00 H ATOM 177 HG11 VAL A 10 16.375 20.897 43.198 1.00 0.00 H ATOM 178 HG12 VAL A 10 15.523 19.333 43.196 1.00 0.00 H ATOM 179 HG13 VAL A 10 16.292 19.930 41.705 1.00 0.00 H ATOM 180 HG21 VAL A 10 13.389 19.067 42.072 1.00 0.00 H ATOM 181 HG22 VAL A 10 12.680 20.397 41.124 1.00 0.00 H ATOM 182 HG23 VAL A 10 14.166 19.595 40.559 1.00 0.00 H ATOM 183 H VAL A 10 12.968 23.151 42.415 1.00 0.00 H ATOM 184 N VAL A 11 14.941 21.252 45.557 1.00 11.73 N ATOM 185 CA VAL A 11 15.761 21.820 46.646 1.00 9.84 C ATOM 186 C VAL A 11 16.762 20.737 47.063 1.00 9.65 C ATOM 187 O VAL A 11 16.672 19.615 46.551 1.00 10.06 O ATOM 188 CB VAL A 11 14.636 22.240 47.673 1.00 10.94 C ATOM 189 CG1 VAL A 11 14.282 21.074 48.616 1.00 10.82 C ATOM 190 CG2 VAL A 11 15.046 23.490 48.340 1.00 11.84 C ATOM 191 HA VAL A 11 16.401 22.681 46.453 1.00 0.00 H ATOM 192 HB VAL A 11 13.698 22.456 47.162 1.00 0.00 H ATOM 193 HG11 VAL A 11 13.921 20.230 48.028 1.00 0.00 H ATOM 194 HG12 VAL A 11 15.170 20.777 49.173 1.00 0.00 H ATOM 195 HG13 VAL A 11 13.505 21.393 49.311 1.00 0.00 H ATOM 196 HG21 VAL A 11 15.986 23.328 48.867 1.00 0.00 H ATOM 197 HG22 VAL A 11 15.177 24.273 47.593 1.00 0.00 H ATOM 198 HG23 VAL A 11 14.277 23.790 49.052 1.00 0.00 H ATOM 199 H VAL A 11 14.723 20.235 45.576 1.00 0.00 H ATOM 200 N THR A 12 17.790 21.014 47.867 1.00 11.69 N ATOM 201 CA THR A 12 18.765 20.011 48.320 1.00 10.95 C ATOM 202 C THR A 12 18.433 19.595 49.736 1.00 11.47 C ATOM 203 O THR A 12 18.329 20.386 50.686 1.00 11.19 O ATOM 204 CB THR A 12 20.194 20.524 48.376 1.00 11.97 C ATOM 205 OG1 THR A 12 20.481 20.857 47.035 1.00 16.69 O ATOM 206 CG2 THR A 12 21.241 19.533 48.870 1.00 13.39 C ATOM 207 HA THR A 12 18.702 19.199 47.595 1.00 0.00 H ATOM 208 HB THR A 12 20.248 21.341 49.096 1.00 0.00 H ATOM 209 HG1 THR A 12 20.393 20.049 46.470 1.00 0.00 H ATOM 210 HG23 THR A 12 21.029 19.269 49.906 1.00 0.00 H ATOM 211 HG21 THR A 12 21.211 18.636 48.251 1.00 0.00 H ATOM 212 HG22 THR A 12 22.229 19.988 48.805 1.00 0.00 H ATOM 213 H THR A 12 17.908 21.995 48.192 1.00 0.00 H ATOM 214 N ALA A 13 18.275 18.309 49.861 1.00 11.19 N ATOM 215 CA ALA A 13 17.971 17.754 51.140 1.00 10.83 C ATOM 216 C ALA A 13 19.151 16.857 51.496 1.00 11.49 C ATOM 217 O ALA A 13 19.900 16.449 50.607 1.00 9.92 O ATOM 218 CB ALA A 13 16.698 16.948 51.012 1.00 8.56 C ATOM 219 HA ALA A 13 17.821 18.510 51.911 1.00 0.00 H ATOM 220 HB1 ALA A 13 15.889 17.599 50.683 1.00 0.00 H ATOM 221 HB2 ALA A 13 16.845 16.152 50.282 1.00 0.00 H ATOM 222 HB3 ALA A 13 16.446 16.514 51.979 1.00 0.00 H ATOM 223 H ALA A 13 18.370 17.688 49.032 1.00 0.00 H ATOM 224 N HIS A 14 19.410 16.654 52.788 1.00 12.40 N ATOM 225 CA HIS A 14 20.468 15.783 53.278 1.00 13.45 C ATOM 226 C HIS A 14 19.621 14.695 53.903 1.00 14.26 C ATOM 227 O HIS A 14 18.847 15.001 54.822 1.00 15.75 O ATOM 228 CB HIS A 14 21.277 16.374 54.379 1.00 17.06 C ATOM 229 CG HIS A 14 22.425 17.148 53.801 1.00 18.57 C ATOM 230 ND1 HIS A 14 22.406 18.397 53.355 1.00 16.67 N ATOM 231 CD2 HIS A 14 23.669 16.574 53.566 1.00 19.87 C ATOM 232 CE1 HIS A 14 23.603 18.599 52.841 1.00 19.94 C ATOM 233 NE2 HIS A 14 24.364 17.506 52.966 1.00 21.47 N ATOM 234 HA HIS A 14 21.180 15.518 52.496 1.00 0.00 H ATOM 235 HB2 HIS A 14 20.651 17.041 54.972 1.00 0.00 H ATOM 236 HB3 HIS A 14 21.661 15.577 55.016 1.00 0.00 H ATOM 237 HD2 HIS A 14 23.995 15.567 53.825 1.00 0.00 H ATOM 238 HE1 HIS A 14 23.928 19.530 52.377 1.00 0.00 H ATOM 239 H HIS A 14 18.820 17.148 53.488 1.00 0.00 H ATOM 240 N ILE A 15 19.657 13.464 53.396 1.00 15.16 N ATOM 241 CA ILE A 15 18.880 12.329 53.907 1.00 14.41 C ATOM 242 C ILE A 15 19.968 11.455 54.481 1.00 14.95 C ATOM 243 O ILE A 15 20.831 10.901 53.767 1.00 15.51 O ATOM 244 CB ILE A 15 18.147 11.566 52.757 1.00 13.54 C ATOM 245 CG1 ILE A 15 17.070 12.477 52.130 1.00 14.37 C ATOM 246 CG2 ILE A 15 17.541 10.265 53.297 1.00 15.26 C ATOM 247 CD1 ILE A 15 16.306 11.930 50.922 1.00 10.24 C ATOM 248 HA ILE A 15 18.100 12.622 54.610 1.00 0.00 H ATOM 249 HB ILE A 15 18.861 11.303 51.977 1.00 0.00 H ATOM 250 HG12 ILE A 15 16.339 12.702 52.906 1.00 0.00 H ATOM 251 HG13 ILE A 15 17.561 13.398 51.817 1.00 0.00 H ATOM 252 HD11 ILE A 15 17.008 11.713 50.117 1.00 0.00 H ATOM 253 HD12 ILE A 15 15.785 11.016 51.207 1.00 0.00 H ATOM 254 HD13 ILE A 15 15.583 12.672 50.585 1.00 0.00 H ATOM 255 HG21 ILE A 15 18.335 9.635 53.698 1.00 0.00 H ATOM 256 HG22 ILE A 15 16.827 10.499 54.087 1.00 0.00 H ATOM 257 HG23 ILE A 15 17.032 9.740 52.489 1.00 0.00 H ATOM 258 H ILE A 15 20.280 13.295 52.580 1.00 0.00 H ATOM 259 N GLU A 16 19.989 11.437 55.807 1.00 14.69 N ATOM 260 CA GLU A 16 20.955 10.658 56.585 1.00 13.79 C ATOM 261 C GLU A 16 22.389 10.978 56.188 1.00 14.23 C ATOM 262 O GLU A 16 23.266 10.119 56.009 1.00 14.21 O ATOM 263 CB GLU A 16 20.713 9.165 56.382 1.00 14.59 C ATOM 264 CG GLU A 16 19.346 8.636 56.724 1.00 17.32 C ATOM 265 CD GLU A 16 19.049 8.250 58.167 1.00 17.55 C ATOM 266 OE1 GLU A 16 19.880 8.370 59.042 1.00 20.39 O ATOM 267 OE2 GLU A 16 17.940 7.847 58.448 1.00 18.42 O ATOM 268 HA GLU A 16 20.815 10.925 57.632 1.00 0.00 H ATOM 269 HB2 GLU A 16 20.897 8.943 55.331 1.00 0.00 H ATOM 270 HB3 GLU A 16 21.436 8.629 56.997 1.00 0.00 H ATOM 271 HG2 GLU A 16 18.625 9.404 56.443 1.00 0.00 H ATOM 272 HG3 GLU A 16 19.184 7.747 56.114 1.00 0.00 H ATOM 273 H GLU A 16 19.284 12.004 56.320 1.00 0.00 H ATOM 274 N GLY A 17 22.595 12.272 55.938 1.00 14.74 N ATOM 275 CA GLY A 17 23.927 12.745 55.587 1.00 15.94 C ATOM 276 C GLY A 17 24.224 12.851 54.114 1.00 16.26 C ATOM 277 O GLY A 17 25.137 13.585 53.736 1.00 18.36 O ATOM 278 HA3 GLY A 17 24.651 12.058 56.025 1.00 0.00 H ATOM 279 HA2 GLY A 17 24.056 13.735 56.025 1.00 0.00 H ATOM 280 H GLY A 17 21.803 12.944 55.994 1.00 0.00 H ATOM 281 N GLN A 18 23.460 12.212 53.235 1.00 16.37 N ATOM 282 CA GLN A 18 23.718 12.279 51.816 1.00 16.25 C ATOM 283 C GLN A 18 23.003 13.495 51.275 1.00 14.74 C ATOM 284 O GLN A 18 21.814 13.607 51.575 1.00 14.28 O ATOM 285 CB GLN A 18 23.193 11.029 51.171 1.00 17.38 C ATOM 286 CG GLN A 18 24.175 9.879 51.412 1.00 23.90 C ATOM 287 CD GLN A 18 23.465 8.507 51.437 1.00 28.59 C ATOM 288 OE1 GLN A 18 23.748 7.590 50.607 1.00 30.29 O ATOM 289 NE2 GLN A 18 22.475 8.359 52.360 1.00 28.73 N ATOM 290 HA GLN A 18 24.785 12.358 51.608 1.00 0.00 H ATOM 291 HB2 GLN A 18 22.224 10.776 51.602 1.00 0.00 H ATOM 292 HB3 GLN A 18 23.080 11.193 50.099 1.00 0.00 H ATOM 293 HG2 GLN A 18 24.917 9.877 50.614 1.00 0.00 H ATOM 294 HG3 GLN A 18 24.673 10.036 52.369 1.00 0.00 H ATOM 295 HE22 GLN A 18 22.267 9.129 53.027 1.00 0.00 H ATOM 296 HE21 GLN A 18 21.927 7.476 52.398 1.00 0.00 H ATOM 297 H GLN A 18 22.655 11.649 53.578 1.00 0.00 H ATOM 298 N PRO A 19 23.609 14.428 50.527 1.00 13.98 N ATOM 299 CA PRO A 19 22.877 15.419 49.756 1.00 12.40 C ATOM 300 C PRO A 19 22.107 14.755 48.630 1.00 12.31 C ATOM 301 O PRO A 19 22.610 13.826 47.987 1.00 13.12 O ATOM 302 CB PRO A 19 23.950 16.347 49.293 1.00 12.39 C ATOM 303 CG PRO A 19 25.112 15.417 49.007 1.00 10.96 C ATOM 304 CD PRO A 19 25.027 14.431 50.156 1.00 13.73 C ATOM 305 HA PRO A 19 22.110 15.953 50.316 1.00 0.00 H ATOM 306 HD3 PRO A 19 25.345 13.438 49.838 1.00 0.00 H ATOM 307 HD2 PRO A 19 25.645 14.758 50.992 1.00 0.00 H ATOM 308 HG3 PRO A 19 26.060 15.955 49.017 1.00 0.00 H ATOM 309 HG2 PRO A 19 24.990 14.916 48.047 1.00 0.00 H ATOM 310 HB2 PRO A 19 23.645 16.880 48.393 1.00 0.00 H ATOM 311 HB3 PRO A 19 24.207 17.067 50.070 1.00 0.00 H ATOM 312 N VAL A 20 20.873 15.173 48.395 1.00 12.29 N ATOM 313 CA VAL A 20 20.038 14.635 47.344 1.00 13.60 C ATOM 314 C VAL A 20 19.211 15.798 46.811 1.00 14.33 C ATOM 315 O VAL A 20 18.889 16.691 47.603 1.00 15.96 O ATOM 316 CB VAL A 20 19.158 13.493 47.914 1.00 12.97 C ATOM 317 CG1 VAL A 20 17.671 13.680 47.866 1.00 12.82 C ATOM 318 CG2 VAL A 20 19.416 12.363 46.979 1.00 14.92 C ATOM 319 HA VAL A 20 20.620 14.200 46.531 1.00 0.00 H ATOM 320 HB VAL A 20 19.415 13.388 48.968 1.00 0.00 H ATOM 321 HG11 VAL A 20 17.399 14.568 48.436 1.00 0.00 H ATOM 322 HG12 VAL A 20 17.355 13.801 46.830 1.00 0.00 H ATOM 323 HG13 VAL A 20 17.182 12.806 48.297 1.00 0.00 H ATOM 324 HG21 VAL A 20 19.121 12.653 45.970 1.00 0.00 H ATOM 325 HG22 VAL A 20 20.478 12.117 46.992 1.00 0.00 H ATOM 326 HG23 VAL A 20 18.837 11.494 47.292 1.00 0.00 H ATOM 327 H VAL A 20 20.484 15.927 48.997 1.00 0.00 H ATOM 328 N GLU A 21 18.960 15.888 45.485 1.00 14.28 N ATOM 329 CA GLU A 21 18.148 16.968 44.909 1.00 13.16 C ATOM 330 C GLU A 21 16.722 16.493 45.050 1.00 10.10 C ATOM 331 O GLU A 21 16.456 15.329 44.740 1.00 11.13 O ATOM 332 CB GLU A 21 18.493 17.148 43.472 1.00 14.98 C ATOM 333 CG GLU A 21 19.858 17.788 43.333 1.00 22.91 C ATOM 334 CD GLU A 21 19.846 19.307 43.599 1.00 28.75 C ATOM 335 OE1 GLU A 21 19.571 19.675 44.762 1.00 29.15 O ATOM 336 OE2 GLU A 21 20.120 20.102 42.646 1.00 31.72 O ATOM 337 HA GLU A 21 18.313 17.925 45.403 1.00 0.00 H ATOM 338 HB2 GLU A 21 18.500 16.176 42.980 1.00 0.00 H ATOM 339 HB3 GLU A 21 17.747 17.787 43.000 1.00 0.00 H ATOM 340 HG2 GLU A 21 20.536 17.317 44.044 1.00 0.00 H ATOM 341 HG3 GLU A 21 20.220 17.616 42.319 1.00 0.00 H ATOM 342 H GLU A 21 19.356 15.166 44.850 1.00 0.00 H ATOM 343 N VAL A 22 15.745 17.257 45.431 1.00 8.04 N ATOM 344 CA VAL A 22 14.408 16.709 45.594 1.00 6.92 C ATOM 345 C VAL A 22 13.256 17.552 45.070 1.00 6.89 C ATOM 346 O VAL A 22 13.322 18.764 45.250 1.00 7.68 O ATOM 347 CB VAL A 22 14.431 16.408 47.125 1.00 4.91 C ATOM 348 CG1 VAL A 22 13.528 17.294 47.924 1.00 4.88 C ATOM 349 CG2 VAL A 22 14.176 14.952 47.261 1.00 7.29 C ATOM 350 HA VAL A 22 14.199 15.837 44.974 1.00 0.00 H ATOM 351 HB VAL A 22 15.401 16.648 47.561 1.00 0.00 H ATOM 352 HG11 VAL A 22 13.830 18.333 47.792 1.00 0.00 H ATOM 353 HG12 VAL A 22 12.501 17.167 47.582 1.00 0.00 H ATOM 354 HG13 VAL A 22 13.597 17.026 48.978 1.00 0.00 H ATOM 355 HG21 VAL A 22 13.205 14.712 46.827 1.00 0.00 H ATOM 356 HG22 VAL A 22 14.956 14.398 46.739 1.00 0.00 H ATOM 357 HG23 VAL A 22 14.180 14.681 48.317 1.00 0.00 H ATOM 358 H VAL A 22 15.919 18.265 45.620 1.00 0.00 H ATOM 359 N LEU A 23 12.239 17.032 44.408 1.00 5.53 N ATOM 360 CA LEU A 23 11.164 17.863 43.953 1.00 5.97 C ATOM 361 C LEU A 23 10.096 17.937 45.039 1.00 8.32 C ATOM 362 O LEU A 23 9.728 16.903 45.610 1.00 7.44 O ATOM 363 CB LEU A 23 10.514 17.300 42.673 1.00 5.81 C ATOM 364 CG LEU A 23 9.310 18.030 42.016 1.00 5.25 C ATOM 365 CD1 LEU A 23 9.704 19.393 41.577 1.00 3.80 C ATOM 366 CD2 LEU A 23 8.874 17.314 40.758 1.00 6.58 C ATOM 367 HA LEU A 23 11.573 18.849 43.733 1.00 0.00 H ATOM 368 HB2 LEU A 23 11.299 17.250 41.919 1.00 0.00 H ATOM 369 HB3 LEU A 23 10.176 16.291 42.911 1.00 0.00 H ATOM 370 HG LEU A 23 8.515 18.057 42.761 1.00 0.00 H ATOM 371 HD21 LEU A 23 9.702 17.290 40.050 1.00 0.00 H ATOM 372 HD22 LEU A 23 8.577 16.295 41.006 1.00 0.00 H ATOM 373 HD23 LEU A 23 8.030 17.842 40.315 1.00 0.00 H ATOM 374 HD11 LEU A 23 10.040 19.968 42.440 1.00 0.00 H ATOM 375 HD12 LEU A 23 10.513 19.320 40.851 1.00 0.00 H ATOM 376 HD13 LEU A 23 8.847 19.888 41.120 1.00 0.00 H ATOM 377 H LEU A 23 12.218 16.010 44.215 1.00 0.00 H ATOM 378 N LEU A 24 9.589 19.132 45.347 1.00 8.27 N ATOM 379 CA LEU A 24 8.550 19.295 46.347 1.00 7.98 C ATOM 380 C LEU A 24 7.268 19.041 45.573 1.00 8.33 C ATOM 381 O LEU A 24 6.772 19.845 44.771 1.00 8.75 O ATOM 382 CB LEU A 24 8.581 20.704 46.934 1.00 8.85 C ATOM 383 CG LEU A 24 9.510 21.080 48.097 1.00 10.97 C ATOM 384 CD1 LEU A 24 10.408 19.940 48.496 1.00 7.09 C ATOM 385 CD2 LEU A 24 10.310 22.323 47.679 1.00 11.66 C ATOM 386 HA LEU A 24 8.663 18.623 47.198 1.00 0.00 H ATOM 387 HB2 LEU A 24 8.836 21.372 46.111 1.00 0.00 H ATOM 388 HB3 LEU A 24 7.567 20.916 47.272 1.00 0.00 H ATOM 389 HG LEU A 24 8.916 21.304 48.983 1.00 0.00 H ATOM 390 HD21 LEU A 24 10.894 22.095 46.787 1.00 0.00 H ATOM 391 HD22 LEU A 24 9.622 23.141 47.465 1.00 0.00 H ATOM 392 HD23 LEU A 24 10.979 22.612 48.489 1.00 0.00 H ATOM 393 HD11 LEU A 24 9.799 19.091 48.808 1.00 0.00 H ATOM 394 HD12 LEU A 24 11.027 19.652 47.646 1.00 0.00 H ATOM 395 HD13 LEU A 24 11.046 20.254 49.322 1.00 0.00 H ATOM 396 H LEU A 24 9.950 19.974 44.855 1.00 0.00 H ATOM 397 N ASP A 25 6.675 17.906 45.844 1.00 7.57 N ATOM 398 CA ASP A 25 5.482 17.538 45.152 1.00 6.56 C ATOM 399 C ASP A 25 4.170 17.467 45.911 1.00 7.81 C ATOM 400 O ASP A 25 3.949 16.512 46.654 1.00 10.14 O ATOM 401 CB ASP A 25 5.906 16.219 44.469 1.00 5.55 C ATOM 402 CG ASP A 25 5.011 15.576 43.428 1.00 5.75 C ATOM 403 OD1 ASP A 25 3.939 16.061 43.120 1.00 7.53 O ATOM 404 OD2 ASP A 25 5.378 14.548 42.909 1.00 7.92 O ATOM 405 HA ASP A 25 5.177 18.337 44.477 1.00 0.00 H ATOM 406 HB2 ASP A 25 6.864 16.410 43.985 1.00 0.00 H ATOM 407 HB3 ASP A 25 6.042 15.484 45.263 1.00 0.00 H ATOM 408 H ASP A 25 7.074 17.271 46.565 1.00 0.00 H ATOM 409 N THR A 26 3.223 18.380 45.694 1.00 5.85 N ATOM 410 CA THR A 26 1.935 18.367 46.362 1.00 4.50 C ATOM 411 C THR A 26 1.016 17.271 45.845 1.00 3.80 C ATOM 412 O THR A 26 -0.005 16.954 46.438 1.00 3.85 O ATOM 413 CB THR A 26 1.217 19.717 46.194 1.00 4.72 C ATOM 414 OG1 THR A 26 1.137 20.016 44.812 1.00 7.57 O ATOM 415 CG2 THR A 26 1.930 20.795 46.947 1.00 4.56 C ATOM 416 HA THR A 26 2.147 18.175 47.414 1.00 0.00 H ATOM 417 HB THR A 26 0.210 19.655 46.606 1.00 0.00 H ATOM 418 HG1 THR A 26 0.629 19.303 44.350 1.00 0.00 H ATOM 419 HG23 THR A 26 1.972 20.531 48.004 1.00 0.00 H ATOM 420 HG21 THR A 26 2.942 20.900 46.557 1.00 0.00 H ATOM 421 HG22 THR A 26 1.393 21.736 46.827 1.00 0.00 H ATOM 422 H THR A 26 3.417 19.140 45.011 1.00 0.00 H ATOM 423 N GLY A 27 1.360 16.710 44.692 1.00 3.64 N ATOM 424 CA GLY A 27 0.589 15.661 44.084 1.00 3.13 C ATOM 425 C GLY A 27 1.089 14.319 44.553 1.00 4.63 C ATOM 426 O GLY A 27 0.569 13.318 44.094 1.00 6.35 O ATOM 427 HA3 GLY A 27 0.684 15.724 43.000 1.00 0.00 H ATOM 428 HA2 GLY A 27 -0.459 15.774 44.363 1.00 0.00 H ATOM 429 H GLY A 27 2.220 17.042 44.211 1.00 0.00 H ATOM 430 N ALA A 28 2.093 14.218 45.420 1.00 4.51 N ATOM 431 CA ALA A 28 2.600 12.956 45.874 1.00 3.28 C ATOM 432 C ALA A 28 2.183 12.629 47.293 1.00 5.28 C ATOM 433 O ALA A 28 2.375 13.450 48.198 1.00 7.26 O ATOM 434 CB ALA A 28 4.099 12.961 45.841 1.00 4.21 C ATOM 435 HA ALA A 28 2.183 12.206 45.202 1.00 0.00 H ATOM 436 HB1 ALA A 28 4.438 13.137 44.820 1.00 0.00 H ATOM 437 HB2 ALA A 28 4.473 13.752 46.491 1.00 0.00 H ATOM 438 HB3 ALA A 28 4.472 11.997 46.188 1.00 0.00 H ATOM 439 H ALA A 28 2.528 15.090 45.783 1.00 0.00 H ATOM 440 N ASP A 29 1.585 11.472 47.548 1.00 4.41 N ATOM 441 CA ASP A 29 1.206 11.123 48.912 1.00 5.26 C ATOM 442 C ASP A 29 2.422 10.705 49.689 1.00 6.59 C ATOM 443 O ASP A 29 2.531 10.976 50.879 1.00 6.47 O ATOM 444 CB ASP A 29 0.294 9.934 49.074 1.00 2.03 C ATOM 445 CG ASP A 29 -1.097 10.097 48.550 1.00 4.87 C ATOM 446 OD1 ASP A 29 -1.561 11.192 48.311 1.00 6.34 O ATOM 447 OD2 ASP A 29 -1.738 9.090 48.355 1.00 8.69 O ATOM 448 HA ASP A 29 0.699 12.026 49.251 1.00 0.00 H ATOM 449 HB2 ASP A 29 0.750 9.091 48.554 1.00 0.00 H ATOM 450 HB3 ASP A 29 0.225 9.709 50.138 1.00 0.00 H ATOM 451 H ASP A 29 1.386 10.811 46.771 1.00 0.00 H ATOM 452 N ASP A 30 3.391 10.083 49.024 1.00 8.58 N ATOM 453 CA ASP A 30 4.581 9.631 49.719 1.00 9.78 C ATOM 454 C ASP A 30 5.833 10.283 49.158 1.00 9.80 C ATOM 455 O ASP A 30 5.738 11.045 48.202 1.00 10.40 O ATOM 456 CB ASP A 30 4.623 8.108 49.582 1.00 11.82 C ATOM 457 CG ASP A 30 3.285 7.450 49.878 1.00 12.60 C ATOM 458 OD1 ASP A 30 2.878 7.476 51.023 1.00 15.02 O ATOM 459 OD2 ASP A 30 2.606 6.963 48.975 1.00 16.93 O ATOM 460 HA ASP A 30 4.546 9.916 50.770 1.00 0.00 H ATOM 461 HB2 ASP A 30 4.916 7.858 48.562 1.00 0.00 H ATOM 462 HB3 ASP A 30 5.365 7.716 50.278 1.00 0.00 H ATOM 463 H ASP A 30 3.295 9.920 48.001 1.00 0.00 H ATOM 464 N SER A 31 6.990 9.991 49.734 1.00 9.81 N ATOM 465 CA SER A 31 8.259 10.543 49.302 1.00 10.58 C ATOM 466 C SER A 31 9.068 9.377 48.780 1.00 10.57 C ATOM 467 O SER A 31 9.312 8.455 49.545 1.00 9.60 O ATOM 468 CB SER A 31 8.961 11.199 50.492 1.00 10.83 C ATOM 469 OG SER A 31 8.156 12.200 51.106 1.00 7.74 O ATOM 470 HA SER A 31 8.134 11.305 48.532 1.00 0.00 H ATOM 471 HB2 SER A 31 9.887 11.657 50.145 1.00 0.00 H ATOM 472 HB3 SER A 31 9.191 10.431 51.231 1.00 0.00 H ATOM 473 HG SER A 31 8.648 12.596 51.868 1.00 0.00 H ATOM 474 H SER A 31 6.988 9.331 50.538 1.00 0.00 H ATOM 475 N ILE A 32 9.476 9.345 47.517 1.00 11.83 N ATOM 476 CA ILE A 32 10.244 8.235 46.945 1.00 12.48 C ATOM 477 C ILE A 32 11.579 8.825 46.526 1.00 11.51 C ATOM 478 O ILE A 32 11.625 9.882 45.901 1.00 11.00 O ATOM 479 CB ILE A 32 9.575 7.608 45.678 1.00 12.81 C ATOM 480 CG1 ILE A 32 8.133 7.217 45.877 1.00 10.73 C ATOM 481 CG2 ILE A 32 10.332 6.307 45.376 1.00 12.56 C ATOM 482 CD1 ILE A 32 7.143 8.372 45.912 1.00 16.02 C ATOM 483 HA ILE A 32 10.321 7.441 47.687 1.00 0.00 H ATOM 484 HB ILE A 32 9.613 8.357 44.887 1.00 0.00 H ATOM 485 HG12 ILE A 32 7.848 6.554 45.060 1.00 0.00 H ATOM 486 HG13 ILE A 32 8.057 6.680 46.822 1.00 0.00 H ATOM 487 HD11 ILE A 32 7.398 9.042 46.733 1.00 0.00 H ATOM 488 HD12 ILE A 32 7.188 8.917 44.969 1.00 0.00 H ATOM 489 HD13 ILE A 32 6.136 7.981 46.059 1.00 0.00 H ATOM 490 HG21 ILE A 32 11.381 6.534 45.188 1.00 0.00 H ATOM 491 HG22 ILE A 32 10.251 5.635 46.230 1.00 0.00 H ATOM 492 HG23 ILE A 32 9.899 5.832 44.496 1.00 0.00 H ATOM 493 H ILE A 32 9.238 10.149 46.902 1.00 0.00 H ATOM 494 N VAL A 33 12.646 8.098 46.772 1.00 11.52 N ATOM 495 CA VAL A 33 13.994 8.503 46.481 1.00 12.05 C ATOM 496 C VAL A 33 14.769 7.343 45.832 1.00 14.52 C ATOM 497 O VAL A 33 14.446 6.150 46.037 1.00 14.57 O ATOM 498 CB VAL A 33 14.473 8.985 47.915 1.00 11.30 C ATOM 499 CG1 VAL A 33 15.629 8.145 48.400 1.00 10.83 C ATOM 500 CG2 VAL A 33 14.778 10.475 47.890 1.00 11.22 C ATOM 501 HA VAL A 33 14.137 9.292 45.743 1.00 0.00 H ATOM 502 HB VAL A 33 13.670 8.841 48.638 1.00 0.00 H ATOM 503 HG11 VAL A 33 15.317 7.102 48.463 1.00 0.00 H ATOM 504 HG12 VAL A 33 16.460 8.235 47.701 1.00 0.00 H ATOM 505 HG13 VAL A 33 15.941 8.493 49.385 1.00 0.00 H ATOM 506 HG21 VAL A 33 15.567 10.671 47.164 1.00 0.00 H ATOM 507 HG22 VAL A 33 13.879 11.024 47.609 1.00 0.00 H ATOM 508 HG23 VAL A 33 15.106 10.794 48.879 1.00 0.00 H ATOM 509 H VAL A 33 12.505 7.164 47.208 1.00 0.00 H ATOM 510 N THR A 34 15.768 7.643 44.993 1.00 15.71 N ATOM 511 CA THR A 34 16.552 6.582 44.393 1.00 15.62 C ATOM 512 C THR A 34 17.961 6.995 44.676 1.00 13.37 C ATOM 513 O THR A 34 18.272 8.151 44.865 1.00 10.84 O ATOM 514 CB THR A 34 16.543 6.425 42.855 1.00 18.11 C ATOM 515 OG1 THR A 34 15.276 6.672 42.270 1.00 23.25 O ATOM 516 CG2 THR A 34 16.893 4.949 42.573 1.00 19.24 C ATOM 517 HA THR A 34 16.147 5.653 44.794 1.00 0.00 H ATOM 518 HB THR A 34 17.243 7.146 42.432 1.00 0.00 H ATOM 519 HG1 THR A 34 14.614 6.034 42.638 1.00 0.00 H ATOM 520 HG23 THR A 34 17.865 4.718 43.009 1.00 0.00 H ATOM 521 HG21 THR A 34 16.133 4.306 43.016 1.00 0.00 H ATOM 522 HG22 THR A 34 16.928 4.785 41.496 1.00 0.00 H ATOM 523 H THR A 34 15.981 8.637 44.772 1.00 0.00 H ATOM 524 N GLY A 35 18.826 6.018 44.715 1.00 14.43 N ATOM 525 CA GLY A 35 20.232 6.319 44.723 1.00 16.01 C ATOM 526 C GLY A 35 20.828 6.345 46.096 1.00 17.27 C ATOM 527 O GLY A 35 22.038 6.530 46.180 1.00 20.07 O ATOM 528 HA3 GLY A 35 20.379 7.297 44.264 1.00 0.00 H ATOM 529 HA2 GLY A 35 20.751 5.562 44.135 1.00 0.00 H ATOM 530 H GLY A 35 18.501 5.030 44.740 1.00 0.00 H ATOM 531 N ILE A 36 20.092 6.131 47.172 1.00 17.30 N ATOM 532 CA ILE A 36 20.653 6.208 48.520 1.00 18.44 C ATOM 533 C ILE A 36 20.275 4.877 49.138 1.00 18.79 C ATOM 534 O ILE A 36 19.148 4.432 48.872 1.00 19.00 O ATOM 535 CB ILE A 36 19.992 7.440 49.144 1.00 19.83 C ATOM 536 CG1 ILE A 36 20.851 8.608 48.716 1.00 20.00 C ATOM 537 CG2 ILE A 36 19.868 7.389 50.654 1.00 21.13 C ATOM 538 CD1 ILE A 36 20.136 9.930 49.064 1.00 22.21 C ATOM 539 HA ILE A 36 21.730 6.336 48.628 1.00 0.00 H ATOM 540 HB ILE A 36 18.960 7.514 48.801 1.00 0.00 H ATOM 541 HG12 ILE A 36 21.808 8.565 49.236 1.00 0.00 H ATOM 542 HG13 ILE A 36 21.021 8.559 47.640 1.00 0.00 H ATOM 543 HD11 ILE A 36 19.180 9.972 48.543 1.00 0.00 H ATOM 544 HD12 ILE A 36 19.967 9.978 50.140 1.00 0.00 H ATOM 545 HD13 ILE A 36 20.758 10.770 48.754 1.00 0.00 H ATOM 546 HG21 ILE A 36 19.266 6.526 50.939 1.00 0.00 H ATOM 547 HG22 ILE A 36 20.861 7.303 51.096 1.00 0.00 H ATOM 548 HG23 ILE A 36 19.389 8.301 51.009 1.00 0.00 H ATOM 549 H ILE A 36 19.084 5.901 47.057 1.00 0.00 H ATOM 550 N GLU A 37 21.098 4.144 49.895 1.00 19.91 N ATOM 551 CA GLU A 37 20.580 2.891 50.402 1.00 19.91 C ATOM 552 C GLU A 37 20.401 3.172 51.877 1.00 18.11 C ATOM 553 O GLU A 37 21.247 3.761 52.555 1.00 16.83 O ATOM 554 CB GLU A 37 21.551 1.740 50.106 1.00 23.39 C ATOM 555 CG GLU A 37 20.688 0.428 49.782 1.00 29.62 C ATOM 556 CD GLU A 37 20.020 -0.339 50.995 1.00 32.79 C ATOM 557 OE1 GLU A 37 20.730 -0.464 52.018 1.00 35.22 O ATOM 558 OE2 GLU A 37 18.842 -0.818 50.956 1.00 33.36 O ATOM 559 HA GLU A 37 19.647 2.569 49.940 1.00 0.00 H ATOM 560 HB2 GLU A 37 22.174 1.994 49.248 1.00 0.00 H ATOM 561 HB3 GLU A 37 22.186 1.560 50.974 1.00 0.00 H ATOM 562 HG2 GLU A 37 19.887 0.725 49.105 1.00 0.00 H ATOM 563 HG3 GLU A 37 21.347 -0.277 49.275 1.00 0.00 H ATOM 564 H GLU A 37 22.065 4.459 50.110 1.00 0.00 H ATOM 565 N LEU A 38 19.161 2.935 52.289 1.00 15.44 N ATOM 566 CA LEU A 38 18.843 3.168 53.664 1.00 12.54 C ATOM 567 C LEU A 38 18.971 1.973 54.578 1.00 11.58 C ATOM 568 O LEU A 38 18.817 2.154 55.786 1.00 10.08 O ATOM 569 CB LEU A 38 17.443 3.775 53.738 1.00 8.88 C ATOM 570 CG LEU A 38 17.246 5.275 53.781 1.00 8.02 C ATOM 571 CD1 LEU A 38 18.538 6.057 53.769 1.00 7.37 C ATOM 572 CD2 LEU A 38 16.437 5.627 52.582 1.00 10.02 C ATOM 573 HA LEU A 38 19.597 3.857 54.044 1.00 0.00 H ATOM 574 HB2 LEU A 38 16.902 3.416 52.862 1.00 0.00 H ATOM 575 HB3 LEU A 38 16.979 3.375 54.639 1.00 0.00 H ATOM 576 HG LEU A 38 16.754 5.538 54.717 1.00 0.00 H ATOM 577 HD21 LEU A 38 16.975 5.329 51.682 1.00 0.00 H ATOM 578 HD22 LEU A 38 15.481 5.106 52.625 1.00 0.00 H ATOM 579 HD23 LEU A 38 16.265 6.703 52.564 1.00 0.00 H ATOM 580 HD11 LEU A 38 19.136 5.782 54.638 1.00 0.00 H ATOM 581 HD12 LEU A 38 19.092 5.828 52.859 1.00 0.00 H ATOM 582 HD13 LEU A 38 18.316 7.124 53.802 1.00 0.00 H ATOM 583 H LEU A 38 18.438 2.588 51.627 1.00 0.00 H ATOM 584 N GLY A 39 19.226 0.772 54.075 1.00 10.66 N ATOM 585 CA GLY A 39 19.554 -0.334 54.970 1.00 10.81 C ATOM 586 C GLY A 39 18.568 -1.486 54.858 1.00 11.20 C ATOM 587 O GLY A 39 17.710 -1.446 53.979 1.00 10.23 O ATOM 588 HA3 GLY A 39 19.548 0.033 55.996 1.00 0.00 H ATOM 589 HA2 GLY A 39 20.550 -0.701 54.722 1.00 0.00 H ATOM 590 H GLY A 39 19.192 0.619 53.047 1.00 0.00 H ATOM 591 N PRO A 40 18.645 -2.530 55.696 1.00 11.64 N ATOM 592 CA PRO A 40 17.795 -3.740 55.661 1.00 11.66 C ATOM 593 C PRO A 40 16.390 -3.737 56.287 1.00 10.49 C ATOM 594 O PRO A 40 15.589 -4.616 56.051 1.00 12.64 O ATOM 595 CB PRO A 40 18.670 -4.788 56.308 1.00 11.12 C ATOM 596 CG PRO A 40 19.316 -3.985 57.441 1.00 12.96 C ATOM 597 CD PRO A 40 19.690 -2.691 56.707 1.00 11.80 C ATOM 598 HA PRO A 40 17.504 -3.893 54.622 1.00 0.00 H ATOM 599 HD3 PRO A 40 19.695 -1.845 57.394 1.00 0.00 H ATOM 600 HD2 PRO A 40 20.670 -2.783 56.238 1.00 0.00 H ATOM 601 HG3 PRO A 40 20.197 -4.489 57.838 1.00 0.00 H ATOM 602 HG2 PRO A 40 18.611 -3.797 58.251 1.00 0.00 H ATOM 603 HB2 PRO A 40 18.079 -5.618 56.694 1.00 0.00 H ATOM 604 HB3 PRO A 40 19.418 -5.169 55.612 1.00 0.00 H ATOM 605 N HIS A 41 15.977 -2.798 57.102 1.00 10.62 N ATOM 606 CA HIS A 41 14.655 -2.865 57.690 1.00 10.66 C ATOM 607 C HIS A 41 13.708 -1.890 57.023 1.00 11.04 C ATOM 608 O HIS A 41 13.786 -0.662 57.116 1.00 12.12 O ATOM 609 CB HIS A 41 14.850 -2.622 59.185 1.00 8.75 C ATOM 610 CG HIS A 41 15.867 -3.592 59.758 1.00 7.83 C ATOM 611 ND1 HIS A 41 16.041 -4.883 59.501 1.00 9.81 N ATOM 612 CD2 HIS A 41 16.857 -3.214 60.615 1.00 6.44 C ATOM 613 CE1 HIS A 41 17.083 -5.256 60.158 1.00 5.79 C ATOM 614 NE2 HIS A 41 17.573 -4.263 60.819 1.00 7.21 N ATOM 615 HA HIS A 41 14.181 -3.835 57.539 1.00 0.00 H ATOM 616 HB2 HIS A 41 15.202 -1.602 59.339 1.00 0.00 H ATOM 617 HB3 HIS A 41 13.897 -2.758 59.697 1.00 0.00 H ATOM 618 HD2 HIS A 41 17.011 -2.223 61.041 1.00 0.00 H ATOM 619 HE1 HIS A 41 17.492 -6.266 60.156 1.00 0.00 H ATOM 620 H HIS A 41 16.603 -1.999 57.328 1.00 0.00 H ATOM 621 N TYR A 42 12.814 -2.511 56.307 1.00 10.11 N ATOM 622 CA TYR A 42 11.837 -1.762 55.566 1.00 11.30 C ATOM 623 C TYR A 42 10.624 -2.661 55.304 1.00 11.31 C ATOM 624 O TYR A 42 10.619 -3.865 55.578 1.00 11.48 O ATOM 625 CB TYR A 42 12.475 -1.289 54.188 1.00 10.63 C ATOM 626 CG TYR A 42 12.893 -2.476 53.316 1.00 11.42 C ATOM 627 CD1 TYR A 42 11.959 -3.158 52.548 1.00 12.72 C ATOM 628 CD2 TYR A 42 14.192 -2.939 53.377 1.00 12.13 C ATOM 629 CE1 TYR A 42 12.317 -4.301 51.873 1.00 12.00 C ATOM 630 CE2 TYR A 42 14.562 -4.079 52.710 1.00 10.77 C ATOM 631 CZ TYR A 42 13.613 -4.739 51.972 1.00 12.10 C ATOM 632 OH TYR A 42 13.962 -5.870 51.302 1.00 14.40 O ATOM 633 HA TYR A 42 11.523 -0.884 56.131 1.00 0.00 H ATOM 634 HB3 TYR A 42 13.353 -0.678 54.397 1.00 0.00 H ATOM 635 HB2 TYR A 42 11.741 -0.694 53.645 1.00 0.00 H ATOM 636 HD2 TYR A 42 14.932 -2.393 53.962 1.00 0.00 H ATOM 637 HE2 TYR A 42 15.585 -4.451 52.765 1.00 0.00 H ATOM 638 HE1 TYR A 42 11.588 -4.846 51.273 1.00 0.00 H ATOM 639 HD1 TYR A 42 10.937 -2.785 52.480 1.00 0.00 H ATOM 640 HH TYR A 42 13.172 -6.224 50.821 1.00 0.00 H ATOM 641 H TYR A 42 12.808 -3.550 56.272 1.00 0.00 H ATOM 642 N THR A 43 9.638 -2.065 54.680 1.00 9.73 N ATOM 643 CA THR A 43 8.449 -2.762 54.328 1.00 12.53 C ATOM 644 C THR A 43 8.415 -2.566 52.809 1.00 12.57 C ATOM 645 O THR A 43 8.562 -1.454 52.324 1.00 11.77 O ATOM 646 CB THR A 43 7.245 -2.120 55.000 1.00 13.36 C ATOM 647 OG1 THR A 43 7.549 -2.189 56.396 1.00 13.58 O ATOM 648 CG2 THR A 43 5.899 -2.772 54.617 1.00 11.77 C ATOM 649 HA THR A 43 8.427 -3.808 54.632 1.00 0.00 H ATOM 650 HB THR A 43 7.093 -1.092 54.671 1.00 0.00 H ATOM 651 HG1 THR A 43 8.386 -1.691 56.575 1.00 0.00 H ATOM 652 HG23 THR A 43 5.744 -2.677 53.542 1.00 0.00 H ATOM 653 HG21 THR A 43 5.917 -3.827 54.891 1.00 0.00 H ATOM 654 HG22 THR A 43 5.090 -2.271 55.148 1.00 0.00 H ATOM 655 H THR A 43 9.727 -1.058 54.436 1.00 0.00 H ATOM 656 N PRO A 44 8.342 -3.633 52.024 1.00 12.83 N ATOM 657 CA PRO A 44 7.925 -3.576 50.645 1.00 11.98 C ATOM 658 C PRO A 44 6.566 -2.907 50.607 1.00 10.97 C ATOM 659 O PRO A 44 5.658 -3.175 51.393 1.00 11.43 O ATOM 660 CB PRO A 44 7.941 -5.058 50.198 1.00 13.58 C ATOM 661 CG PRO A 44 7.843 -5.879 51.453 1.00 12.91 C ATOM 662 CD PRO A 44 8.630 -5.021 52.450 1.00 12.96 C ATOM 663 HA PRO A 44 8.552 -2.993 49.970 1.00 0.00 H ATOM 664 HD3 PRO A 44 8.285 -5.194 53.469 1.00 0.00 H ATOM 665 HD2 PRO A 44 9.697 -5.233 52.388 1.00 0.00 H ATOM 666 HG3 PRO A 44 8.302 -6.859 51.323 1.00 0.00 H ATOM 667 HG2 PRO A 44 6.807 -6.003 51.767 1.00 0.00 H ATOM 668 HB2 PRO A 44 7.093 -5.264 49.545 1.00 0.00 H ATOM 669 HB3 PRO A 44 8.868 -5.283 49.671 1.00 0.00 H ATOM 670 N LYS A 45 6.405 -2.037 49.654 1.00 11.13 N ATOM 671 CA LYS A 45 5.180 -1.296 49.489 1.00 9.76 C ATOM 672 C LYS A 45 5.091 -1.112 47.991 1.00 8.86 C ATOM 673 O LYS A 45 6.029 -1.394 47.246 1.00 8.45 O ATOM 674 CB LYS A 45 5.380 0.013 50.247 1.00 9.95 C ATOM 675 CG LYS A 45 4.399 0.500 51.275 1.00 9.30 C ATOM 676 CD LYS A 45 4.319 -0.353 52.501 1.00 11.41 C ATOM 677 CE LYS A 45 3.222 0.180 53.453 1.00 14.98 C ATOM 678 NZ LYS A 45 3.420 1.568 53.867 1.00 16.48 N ATOM 679 HA LYS A 45 4.267 -1.757 49.865 1.00 0.00 H ATOM 680 HB2 LYS A 45 6.339 -0.075 50.758 1.00 0.00 H ATOM 681 HB3 LYS A 45 5.443 0.796 49.491 1.00 0.00 H ATOM 682 HG2 LYS A 45 4.691 1.506 51.577 1.00 0.00 H ATOM 683 HG3 LYS A 45 3.411 0.532 50.816 1.00 0.00 H ATOM 684 HD2 LYS A 45 4.080 -1.377 52.213 1.00 0.00 H ATOM 685 HD3 LYS A 45 5.280 -0.337 53.014 1.00 0.00 H ATOM 686 HE2 LYS A 45 3.208 -0.446 54.345 1.00 0.00 H ATOM 687 HE3 LYS A 45 2.261 0.107 52.944 1.00 0.00 H ATOM 688 HZ1 LYS A 45 4.329 1.654 54.365 1.00 0.00 H ATOM 689 HZ2 LYS A 45 3.424 2.182 53.027 1.00 0.00 H ATOM 690 HZ3 LYS A 45 2.647 1.853 54.502 1.00 0.00 H ATOM 691 H LYS A 45 7.187 -1.870 48.988 1.00 0.00 H ATOM 692 N ILE A 46 3.981 -0.601 47.517 1.00 11.03 N ATOM 693 CA ILE A 46 3.770 -0.367 46.089 1.00 9.93 C ATOM 694 C ILE A 46 3.212 1.036 45.952 1.00 11.06 C ATOM 695 O ILE A 46 2.481 1.428 46.862 1.00 11.57 O ATOM 696 CB ILE A 46 2.768 -1.478 45.561 1.00 9.62 C ATOM 697 CG1 ILE A 46 3.401 -1.861 44.334 1.00 10.78 C ATOM 698 CG2 ILE A 46 1.375 -1.165 45.090 1.00 5.25 C ATOM 699 CD1 ILE A 46 4.314 -3.039 44.555 1.00 16.78 C ATOM 700 HA ILE A 46 4.683 -0.437 45.498 1.00 0.00 H ATOM 701 HB ILE A 46 2.618 -2.135 46.418 1.00 0.00 H ATOM 702 HG12 ILE A 46 2.637 -2.131 43.605 1.00 0.00 H ATOM 703 HG13 ILE A 46 3.984 -1.022 43.954 1.00 0.00 H ATOM 704 HD11 ILE A 46 5.082 -2.771 45.281 1.00 0.00 H ATOM 705 HD12 ILE A 46 3.734 -3.881 44.932 1.00 0.00 H ATOM 706 HD13 ILE A 46 4.785 -3.314 43.611 1.00 0.00 H ATOM 707 HG21 ILE A 46 0.812 -0.709 45.904 1.00 0.00 H ATOM 708 HG22 ILE A 46 1.424 -0.474 44.248 1.00 0.00 H ATOM 709 HG23 ILE A 46 0.883 -2.086 44.778 1.00 0.00 H ATOM 710 H ILE A 46 3.221 -0.352 48.182 1.00 0.00 H ATOM 711 N VAL A 47 3.596 1.879 45.001 1.00 12.33 N ATOM 712 CA VAL A 47 2.983 3.213 44.859 1.00 12.08 C ATOM 713 C VAL A 47 2.709 3.326 43.368 1.00 12.01 C ATOM 714 O VAL A 47 3.441 2.781 42.521 1.00 12.97 O ATOM 715 CB VAL A 47 3.843 4.459 45.219 1.00 13.41 C ATOM 716 CG1 VAL A 47 3.742 4.726 46.716 1.00 14.66 C ATOM 717 CG2 VAL A 47 5.280 4.285 44.779 1.00 15.61 C ATOM 718 HA VAL A 47 2.144 3.244 45.554 1.00 0.00 H ATOM 719 HB VAL A 47 3.456 5.325 44.681 1.00 0.00 H ATOM 720 HG11 VAL A 47 2.701 4.912 46.981 1.00 0.00 H ATOM 721 HG12 VAL A 47 4.109 3.858 47.264 1.00 0.00 H ATOM 722 HG13 VAL A 47 4.344 5.599 46.970 1.00 0.00 H ATOM 723 HG21 VAL A 47 5.708 3.414 45.276 1.00 0.00 H ATOM 724 HG22 VAL A 47 5.313 4.142 43.699 1.00 0.00 H ATOM 725 HG23 VAL A 47 5.851 5.174 45.047 1.00 0.00 H ATOM 726 H VAL A 47 4.347 1.592 44.341 1.00 0.00 H ATOM 727 N GLY A 48 1.666 4.017 42.973 1.00 12.60 N ATOM 728 CA GLY A 48 1.328 4.087 41.569 1.00 13.42 C ATOM 729 C GLY A 48 1.123 5.509 41.096 1.00 14.03 C ATOM 730 O GLY A 48 1.103 6.430 41.904 1.00 14.84 O ATOM 731 HA3 GLY A 48 0.409 3.526 41.401 1.00 0.00 H ATOM 732 HA2 GLY A 48 2.136 3.639 40.991 1.00 0.00 H ATOM 733 H GLY A 48 1.080 4.516 43.672 1.00 0.00 H ATOM 734 N GLY A 49 0.957 5.718 39.800 1.00 14.54 N ATOM 735 CA GLY A 49 0.743 7.027 39.222 1.00 13.34 C ATOM 736 C GLY A 49 0.534 6.882 37.727 1.00 12.97 C ATOM 737 O GLY A 49 -0.015 5.887 37.255 1.00 13.62 O ATOM 738 HA3 GLY A 49 1.613 7.656 39.410 1.00 0.00 H ATOM 739 HA2 GLY A 49 -0.138 7.485 39.671 1.00 0.00 H ATOM 740 H GLY A 49 0.982 4.897 39.162 1.00 0.00 H ATOM 741 N ILE A 50 0.920 7.896 36.962 1.00 13.72 N ATOM 742 CA ILE A 50 0.855 7.935 35.494 1.00 13.74 C ATOM 743 C ILE A 50 1.813 6.844 35.104 1.00 14.17 C ATOM 744 O ILE A 50 2.924 6.871 35.644 1.00 14.99 O ATOM 745 CB ILE A 50 1.382 9.345 34.961 1.00 15.78 C ATOM 746 CG1 ILE A 50 0.247 10.343 35.117 1.00 15.35 C ATOM 747 CG2 ILE A 50 1.958 9.267 33.519 1.00 13.83 C ATOM 748 CD1 ILE A 50 -0.721 10.232 33.942 1.00 18.44 C ATOM 749 HA ILE A 50 -0.150 7.805 35.091 1.00 0.00 H ATOM 750 HB ILE A 50 2.234 9.678 35.553 1.00 0.00 H ATOM 751 HG12 ILE A 50 -0.288 10.138 36.044 1.00 0.00 H ATOM 752 HG13 ILE A 50 0.657 11.352 35.151 1.00 0.00 H ATOM 753 HD11 ILE A 50 -0.189 10.440 33.014 1.00 0.00 H ATOM 754 HD12 ILE A 50 -1.135 9.224 33.908 1.00 0.00 H ATOM 755 HD13 ILE A 50 -1.528 10.953 34.069 1.00 0.00 H ATOM 756 HG21 ILE A 50 2.795 8.569 33.501 1.00 0.00 H ATOM 757 HG22 ILE A 50 1.181 8.922 32.837 1.00 0.00 H ATOM 758 HG23 ILE A 50 2.300 10.255 33.212 1.00 0.00 H ATOM 759 H ILE A 50 1.301 8.736 37.443 1.00 0.00 H ATOM 760 N GLY A 51 1.484 5.915 34.228 1.00 13.20 N ATOM 761 CA GLY A 51 2.531 4.983 33.853 1.00 12.64 C ATOM 762 C GLY A 51 2.346 3.675 34.572 1.00 13.71 C ATOM 763 O GLY A 51 2.440 2.640 33.921 1.00 15.74 O ATOM 764 HA3 GLY A 51 3.501 5.405 34.117 1.00 0.00 H ATOM 765 HA2 GLY A 51 2.492 4.811 32.777 1.00 0.00 H ATOM 766 H GLY A 51 0.526 5.854 33.828 1.00 0.00 H ATOM 767 N GLY A 52 2.059 3.631 35.866 1.00 14.20 N ATOM 768 CA GLY A 52 1.721 2.366 36.498 1.00 12.41 C ATOM 769 C GLY A 52 2.117 2.417 37.940 1.00 12.37 C ATOM 770 O GLY A 52 1.989 3.466 38.571 1.00 13.19 O ATOM 771 HA3 GLY A 52 2.254 1.556 36.001 1.00 0.00 H ATOM 772 HA2 GLY A 52 0.647 2.194 36.420 1.00 0.00 H ATOM 773 H GLY A 52 2.076 4.504 36.431 1.00 0.00 H ATOM 774 N PHE A 53 2.583 1.304 38.465 1.00 9.60 N ATOM 775 CA PHE A 53 2.975 1.268 39.855 1.00 9.21 C ATOM 776 C PHE A 53 4.415 0.780 39.934 1.00 9.74 C ATOM 777 O PHE A 53 4.910 0.207 38.954 1.00 10.22 O ATOM 778 CB PHE A 53 2.062 0.311 40.661 1.00 7.11 C ATOM 779 CG PHE A 53 2.236 -1.179 40.441 1.00 5.09 C ATOM 780 CD1 PHE A 53 3.151 -1.880 41.203 1.00 4.31 C ATOM 781 CD2 PHE A 53 1.476 -1.835 39.489 1.00 6.22 C ATOM 782 CE1 PHE A 53 3.309 -3.249 41.030 1.00 8.31 C ATOM 783 CE2 PHE A 53 1.626 -3.204 39.301 1.00 7.18 C ATOM 784 CZ PHE A 53 2.541 -3.927 40.069 1.00 8.85 C ATOM 785 HA PHE A 53 2.882 2.267 40.281 1.00 0.00 H ATOM 786 HB2 PHE A 53 2.237 0.507 41.719 1.00 0.00 H ATOM 787 HB3 PHE A 53 1.030 0.559 40.413 1.00 0.00 H ATOM 788 HD2 PHE A 53 0.759 -1.278 38.886 1.00 0.00 H ATOM 789 HE2 PHE A 53 1.026 -3.716 38.549 1.00 0.00 H ATOM 790 HZ PHE A 53 2.658 -5.001 39.925 1.00 0.00 H ATOM 791 HE1 PHE A 53 4.028 -3.797 41.639 1.00 0.00 H ATOM 792 HD1 PHE A 53 3.753 -1.355 41.945 1.00 0.00 H ATOM 793 H PHE A 53 2.669 0.449 37.879 1.00 0.00 H ATOM 794 N ILE A 54 5.130 1.015 41.029 1.00 9.90 N ATOM 795 CA ILE A 54 6.503 0.533 41.168 1.00 9.49 C ATOM 796 C ILE A 54 6.538 -0.043 42.557 1.00 10.21 C ATOM 797 O ILE A 54 5.652 0.243 43.386 1.00 13.79 O ATOM 798 CB ILE A 54 7.628 1.614 41.077 1.00 7.07 C ATOM 799 CG1 ILE A 54 7.373 2.852 41.869 1.00 5.05 C ATOM 800 CG2 ILE A 54 7.765 1.928 39.602 1.00 8.94 C ATOM 801 CD1 ILE A 54 8.670 3.641 42.062 1.00 2.60 C ATOM 802 HA ILE A 54 6.713 -0.150 40.345 1.00 0.00 H ATOM 803 HB ILE A 54 8.543 1.219 41.517 1.00 0.00 H ATOM 804 HG12 ILE A 54 6.650 3.473 41.341 1.00 0.00 H ATOM 805 HG13 ILE A 54 6.971 2.578 42.844 1.00 0.00 H ATOM 806 HD11 ILE A 54 9.394 3.023 42.593 1.00 0.00 H ATOM 807 HD12 ILE A 54 9.073 3.919 41.088 1.00 0.00 H ATOM 808 HD13 ILE A 54 8.464 4.541 42.642 1.00 0.00 H ATOM 809 HG21 ILE A 54 8.038 1.021 39.063 1.00 0.00 H ATOM 810 HG22 ILE A 54 6.816 2.306 39.223 1.00 0.00 H ATOM 811 HG23 ILE A 54 8.540 2.682 39.463 1.00 0.00 H ATOM 812 H ILE A 54 4.702 1.556 41.807 1.00 0.00 H ATOM 813 N ASN A 55 7.548 -0.851 42.824 1.00 10.74 N ATOM 814 CA ASN A 55 7.724 -1.484 44.129 1.00 9.96 C ATOM 815 C ASN A 55 8.635 -0.592 44.914 1.00 8.40 C ATOM 816 O ASN A 55 9.587 -0.073 44.354 1.00 8.67 O ATOM 817 CB ASN A 55 8.392 -2.824 44.032 1.00 13.40 C ATOM 818 CG ASN A 55 7.644 -3.738 43.093 1.00 16.22 C ATOM 819 OD1 ASN A 55 7.942 -3.750 41.899 1.00 22.48 O ATOM 820 ND2 ASN A 55 6.661 -4.509 43.518 1.00 15.32 N ATOM 821 HA ASN A 55 6.744 -1.627 44.584 1.00 0.00 H ATOM 822 HB2 ASN A 55 9.409 -2.689 43.663 1.00 0.00 H ATOM 823 HB3 ASN A 55 8.423 -3.279 45.022 1.00 0.00 H ATOM 824 HD22 ASN A 55 6.398 -4.509 44.524 1.00 0.00 H ATOM 825 HD21 ASN A 55 6.149 -5.116 42.847 1.00 0.00 H ATOM 826 H ASN A 55 8.245 -1.044 42.077 1.00 0.00 H ATOM 827 N THR A 56 8.400 -0.363 46.179 1.00 8.13 N ATOM 828 CA THR A 56 9.258 0.502 46.943 1.00 8.17 C ATOM 829 C THR A 56 9.623 -0.161 48.253 1.00 7.32 C ATOM 830 O THR A 56 8.993 -1.123 48.705 1.00 6.96 O ATOM 831 CB THR A 56 8.526 1.860 47.225 1.00 9.43 C ATOM 832 OG1 THR A 56 7.383 1.610 48.062 1.00 6.17 O ATOM 833 CG2 THR A 56 8.120 2.564 45.899 1.00 9.58 C ATOM 834 HA THR A 56 10.168 0.694 46.374 1.00 0.00 H ATOM 835 HB THR A 56 9.205 2.537 47.744 1.00 0.00 H ATOM 836 HG1 THR A 56 6.767 0.987 47.600 1.00 0.00 H ATOM 837 HG23 THR A 56 9.010 2.736 45.293 1.00 0.00 H ATOM 838 HG21 THR A 56 7.423 1.930 45.351 1.00 0.00 H ATOM 839 HG22 THR A 56 7.644 3.518 46.127 1.00 0.00 H ATOM 840 H THR A 56 7.582 -0.812 46.639 1.00 0.00 H ATOM 841 N LYS A 57 10.666 0.373 48.840 1.00 6.33 N ATOM 842 CA LYS A 57 11.156 -0.082 50.112 1.00 5.69 C ATOM 843 C LYS A 57 10.906 1.139 51.007 1.00 6.07 C ATOM 844 O LYS A 57 11.361 2.257 50.736 1.00 4.33 O ATOM 845 CB LYS A 57 12.625 -0.449 49.946 1.00 7.52 C ATOM 846 CG LYS A 57 12.889 -1.790 49.214 1.00 7.71 C ATOM 847 CD LYS A 57 14.378 -1.831 48.998 1.00 10.71 C ATOM 848 CE LYS A 57 15.138 -3.148 49.142 1.00 15.62 C ATOM 849 NZ LYS A 57 15.129 -4.036 47.971 1.00 18.60 N ATOM 850 HA LYS A 57 10.686 -0.972 50.531 1.00 0.00 H ATOM 851 HB2 LYS A 57 13.110 0.346 49.380 1.00 0.00 H ATOM 852 HB3 LYS A 57 13.072 -0.512 50.938 1.00 0.00 H ATOM 853 HG2 LYS A 57 12.568 -2.631 49.828 1.00 0.00 H ATOM 854 HG3 LYS A 57 12.363 -1.816 48.260 1.00 0.00 H ATOM 855 HD2 LYS A 57 14.558 -1.473 47.984 1.00 0.00 H ATOM 856 HD3 LYS A 57 14.818 -1.134 49.711 1.00 0.00 H ATOM 857 HE2 LYS A 57 14.700 -3.695 49.977 1.00 0.00 H ATOM 858 HE3 LYS A 57 16.177 -2.909 49.370 1.00 0.00 H ATOM 859 HZ1 LYS A 57 14.148 -4.295 47.741 1.00 0.00 H ATOM 860 HZ2 LYS A 57 15.558 -3.544 47.161 1.00 0.00 H ATOM 861 HZ3 LYS A 57 15.674 -4.895 48.185 1.00 0.00 H ATOM 862 H LYS A 57 11.159 1.157 48.367 1.00 0.00 H ATOM 863 N GLU A 58 10.021 0.960 51.986 1.00 6.23 N ATOM 864 CA GLU A 58 9.625 1.967 52.960 1.00 6.93 C ATOM 865 C GLU A 58 10.419 1.940 54.275 1.00 7.49 C ATOM 866 O GLU A 58 10.496 0.969 55.039 1.00 6.76 O ATOM 867 CB GLU A 58 8.140 1.820 53.316 1.00 8.39 C ATOM 868 CG GLU A 58 7.670 2.995 54.181 1.00 7.94 C ATOM 869 CD GLU A 58 6.245 2.860 54.684 1.00 12.01 C ATOM 870 OE1 GLU A 58 6.009 2.015 55.557 1.00 13.02 O ATOM 871 OE2 GLU A 58 5.377 3.610 54.220 1.00 12.13 O ATOM 872 HA GLU A 58 9.836 2.916 52.466 1.00 0.00 H ATOM 873 HB2 GLU A 58 7.553 1.794 52.398 1.00 0.00 H ATOM 874 HB3 GLU A 58 7.994 0.890 53.866 1.00 0.00 H ATOM 875 HG2 GLU A 58 8.332 3.073 55.043 1.00 0.00 H ATOM 876 HG3 GLU A 58 7.739 3.907 53.588 1.00 0.00 H ATOM 877 H GLU A 58 9.576 0.023 52.061 1.00 0.00 H ATOM 878 N TYR A 59 10.938 3.099 54.586 1.00 8.10 N ATOM 879 CA TYR A 59 11.728 3.319 55.771 1.00 8.92 C ATOM 880 C TYR A 59 11.100 4.365 56.673 1.00 8.94 C ATOM 881 O TYR A 59 10.446 5.329 56.266 1.00 9.59 O ATOM 882 CB TYR A 59 13.115 3.777 55.408 1.00 8.13 C ATOM 883 CG TYR A 59 13.884 2.750 54.633 1.00 8.01 C ATOM 884 CD1 TYR A 59 13.786 2.720 53.257 1.00 7.20 C ATOM 885 CD2 TYR A 59 14.739 1.932 55.322 1.00 8.02 C ATOM 886 CE1 TYR A 59 14.568 1.879 52.532 1.00 5.19 C ATOM 887 CE2 TYR A 59 15.534 1.081 54.598 1.00 9.79 C ATOM 888 CZ TYR A 59 15.444 1.077 53.215 1.00 9.83 C ATOM 889 OH TYR A 59 16.338 0.304 52.508 1.00 11.25 O ATOM 890 HA TYR A 59 11.774 2.368 56.301 1.00 0.00 H ATOM 891 HB3 TYR A 59 13.659 4.000 56.326 1.00 0.00 H ATOM 892 HB2 TYR A 59 13.036 4.681 54.805 1.00 0.00 H ATOM 893 HD2 TYR A 59 14.786 1.956 56.411 1.00 0.00 H ATOM 894 HE2 TYR A 59 16.230 0.414 55.106 1.00 0.00 H ATOM 895 HE1 TYR A 59 14.501 1.843 51.445 1.00 0.00 H ATOM 896 HD1 TYR A 59 13.077 3.375 52.749 1.00 0.00 H ATOM 897 HH TYR A 59 16.236 -0.644 52.774 1.00 0.00 H ATOM 898 H TYR A 59 10.772 3.902 53.946 1.00 0.00 H ATOM 899 N LYS A 60 11.300 4.094 57.950 1.00 8.36 N ATOM 900 CA LYS A 60 10.782 4.958 58.965 1.00 7.65 C ATOM 901 C LYS A 60 11.919 5.542 59.757 1.00 7.25 C ATOM 902 O LYS A 60 13.025 4.998 59.831 1.00 6.55 O ATOM 903 CB LYS A 60 9.906 4.176 59.941 1.00 9.14 C ATOM 904 CG LYS A 60 8.800 3.305 59.460 1.00 6.93 C ATOM 905 CD LYS A 60 7.928 4.089 58.573 1.00 8.03 C ATOM 906 CE LYS A 60 6.546 3.709 58.998 1.00 9.70 C ATOM 907 NZ LYS A 60 6.210 4.398 60.219 1.00 13.48 N ATOM 908 HA LYS A 60 10.198 5.738 58.476 1.00 0.00 H ATOM 909 HB2 LYS A 60 10.577 3.535 60.513 1.00 0.00 H ATOM 910 HB3 LYS A 60 9.453 4.911 60.606 1.00 0.00 H ATOM 911 HG2 LYS A 60 9.213 2.458 58.912 1.00 0.00 H ATOM 912 HG3 LYS A 60 8.224 2.941 60.311 1.00 0.00 H ATOM 913 HD2 LYS A 60 8.096 5.157 58.709 1.00 0.00 H ATOM 914 HD3 LYS A 60 8.099 3.826 57.529 1.00 0.00 H ATOM 915 HE2 LYS A 60 6.500 2.633 59.164 1.00 0.00 H ATOM 916 HE3 LYS A 60 5.837 3.986 58.218 1.00 0.00 H ATOM 917 HZ1 LYS A 60 6.887 4.133 60.963 1.00 0.00 H ATOM 918 HZ2 LYS A 60 6.253 5.425 60.059 1.00 0.00 H ATOM 919 HZ3 LYS A 60 5.248 4.132 60.512 1.00 0.00 H ATOM 920 H LYS A 60 11.838 3.246 58.219 1.00 0.00 H ATOM 921 N ASN A 61 11.583 6.649 60.387 1.00 6.57 N ATOM 922 CA ASN A 61 12.515 7.341 61.247 1.00 8.44 C ATOM 923 C ASN A 61 13.760 7.796 60.551 1.00 8.20 C ATOM 924 O ASN A 61 14.877 7.657 61.041 1.00 8.50 O ATOM 925 CB ASN A 61 12.860 6.393 62.358 1.00 10.73 C ATOM 926 CG ASN A 61 12.677 7.100 63.628 1.00 15.07 C ATOM 927 OD1 ASN A 61 13.520 7.815 64.161 1.00 18.61 O ATOM 928 ND2 ASN A 61 11.472 6.908 64.117 1.00 18.72 N ATOM 929 HA ASN A 61 12.044 8.255 61.609 1.00 0.00 H ATOM 930 HB2 ASN A 61 12.204 5.523 62.320 1.00 0.00 H ATOM 931 HB3 ASN A 61 13.896 6.069 62.260 1.00 0.00 H ATOM 932 HD22 ASN A 61 10.801 6.289 63.618 1.00 0.00 H ATOM 933 HD21 ASN A 61 11.190 7.375 65.003 1.00 0.00 H ATOM 934 H ASN A 61 10.625 7.034 60.262 1.00 0.00 H ATOM 935 N VAL A 62 13.573 8.238 59.311 1.00 9.63 N ATOM 936 CA VAL A 62 14.674 8.702 58.491 1.00 7.44 C ATOM 937 C VAL A 62 14.944 10.148 58.774 1.00 7.72 C ATOM 938 O VAL A 62 14.058 10.982 58.825 1.00 8.74 O ATOM 939 CB VAL A 62 14.339 8.476 57.021 1.00 6.73 C ATOM 940 CG1 VAL A 62 15.527 8.936 56.202 1.00 6.00 C ATOM 941 CG2 VAL A 62 14.036 6.982 56.735 1.00 6.85 C ATOM 942 HA VAL A 62 15.578 8.140 58.728 1.00 0.00 H ATOM 943 HB VAL A 62 13.445 9.041 56.757 1.00 0.00 H ATOM 944 HG11 VAL A 62 15.710 9.994 56.391 1.00 0.00 H ATOM 945 HG12 VAL A 62 16.407 8.358 56.484 1.00 0.00 H ATOM 946 HG13 VAL A 62 15.316 8.786 55.143 1.00 0.00 H ATOM 947 HG21 VAL A 62 14.909 6.381 56.989 1.00 0.00 H ATOM 948 HG22 VAL A 62 13.186 6.663 57.338 1.00 0.00 H ATOM 949 HG23 VAL A 62 13.801 6.856 55.678 1.00 0.00 H ATOM 950 H VAL A 62 12.610 8.251 58.919 1.00 0.00 H ATOM 951 N LYS A 63 16.195 10.357 59.091 1.00 8.05 N ATOM 952 CA LYS A 63 16.717 11.655 59.394 1.00 9.63 C ATOM 953 C LYS A 63 16.936 12.519 58.174 1.00 8.91 C ATOM 954 O LYS A 63 17.785 12.192 57.354 1.00 8.06 O ATOM 955 CB LYS A 63 18.040 11.522 60.074 1.00 10.73 C ATOM 956 CG LYS A 63 17.856 11.249 61.525 1.00 14.47 C ATOM 957 CD LYS A 63 19.238 11.166 62.103 1.00 17.76 C ATOM 958 CE LYS A 63 19.866 9.783 61.895 1.00 21.67 C ATOM 959 NZ LYS A 63 19.255 8.851 62.848 1.00 22.23 N ATOM 960 HA LYS A 63 15.969 12.131 60.027 1.00 0.00 H ATOM 961 HB2 LYS A 63 18.595 10.700 59.622 1.00 0.00 H ATOM 962 HB3 LYS A 63 18.601 12.448 59.951 1.00 0.00 H ATOM 963 HG2 LYS A 63 17.295 12.057 61.996 1.00 0.00 H ATOM 964 HG3 LYS A 63 17.326 10.308 61.670 1.00 0.00 H ATOM 965 HD2 LYS A 63 19.867 11.914 61.621 1.00 0.00 H ATOM 966 HD3 LYS A 63 19.185 11.372 63.172 1.00 0.00 H ATOM 967 HE2 LYS A 63 20.941 9.836 62.069 1.00 0.00 H ATOM 968 HE3 LYS A 63 19.680 9.443 60.876 1.00 0.00 H ATOM 969 HZ1 LYS A 63 19.434 9.182 63.818 1.00 0.00 H ATOM 970 HZ2 LYS A 63 18.230 8.807 62.679 1.00 0.00 H ATOM 971 HZ3 LYS A 63 19.670 7.906 62.721 1.00 0.00 H ATOM 972 H LYS A 63 16.841 9.543 59.125 1.00 0.00 H ATOM 973 N ILE A 64 16.239 13.625 58.033 1.00 9.38 N ATOM 974 CA ILE A 64 16.411 14.508 56.894 1.00 9.88 C ATOM 975 C ILE A 64 16.526 15.972 57.301 1.00 9.11 C ATOM 976 O ILE A 64 15.869 16.425 58.220 1.00 10.08 O ATOM 977 CB ILE A 64 15.210 14.226 55.803 1.00 11.11 C ATOM 978 CG1 ILE A 64 14.769 15.552 55.235 1.00 9.55 C ATOM 979 CG2 ILE A 64 14.037 13.388 56.336 1.00 9.82 C ATOM 980 CD1 ILE A 64 15.794 15.811 54.118 1.00 13.31 C ATOM 981 HA ILE A 64 17.364 14.285 56.414 1.00 0.00 H ATOM 982 HB ILE A 64 15.617 13.595 55.013 1.00 0.00 H ATOM 983 HG12 ILE A 64 13.758 15.489 54.832 1.00 0.00 H ATOM 984 HG13 ILE A 64 14.809 16.335 55.992 1.00 0.00 H ATOM 985 HD11 ILE A 64 16.795 15.852 54.547 1.00 0.00 H ATOM 986 HD12 ILE A 64 15.744 15.005 53.386 1.00 0.00 H ATOM 987 HD13 ILE A 64 15.567 16.760 53.631 1.00 0.00 H ATOM 988 HG21 ILE A 64 14.405 12.414 56.657 1.00 0.00 H ATOM 989 HG22 ILE A 64 13.579 13.902 57.181 1.00 0.00 H ATOM 990 HG23 ILE A 64 13.298 13.256 55.546 1.00 0.00 H ATOM 991 H ILE A 64 15.541 13.875 58.762 1.00 0.00 H ATOM 992 N GLU A 65 17.402 16.717 56.647 1.00 10.34 N ATOM 993 CA GLU A 65 17.616 18.154 56.901 1.00 11.92 C ATOM 994 C GLU A 65 17.258 18.760 55.539 1.00 12.57 C ATOM 995 O GLU A 65 17.881 18.383 54.525 1.00 14.53 O ATOM 996 CB GLU A 65 19.088 18.517 57.204 1.00 14.31 C ATOM 997 CG GLU A 65 19.829 17.667 58.217 1.00 15.90 C ATOM 998 CD GLU A 65 21.333 17.845 58.225 1.00 16.20 C ATOM 999 OE1 GLU A 65 22.050 17.488 57.288 1.00 17.39 O ATOM 1000 OE2 GLU A 65 21.802 18.304 59.241 1.00 17.85 O ATOM 1001 HA GLU A 65 17.044 18.497 57.763 1.00 0.00 H ATOM 1002 HB2 GLU A 65 19.638 18.458 56.265 1.00 0.00 H ATOM 1003 HB3 GLU A 65 19.102 19.544 57.568 1.00 0.00 H ATOM 1004 HG2 GLU A 65 19.453 17.918 59.209 1.00 0.00 H ATOM 1005 HG3 GLU A 65 19.613 16.620 58.003 1.00 0.00 H ATOM 1006 H GLU A 65 17.975 16.261 55.908 1.00 0.00 H ATOM 1007 N VAL A 66 16.272 19.642 55.429 1.00 12.05 N ATOM 1008 CA VAL A 66 15.821 20.272 54.186 1.00 11.81 C ATOM 1009 C VAL A 66 15.523 21.714 54.609 1.00 14.17 C ATOM 1010 O VAL A 66 15.149 21.910 55.777 1.00 13.01 O ATOM 1011 CB VAL A 66 14.384 19.958 53.602 1.00 12.29 C ATOM 1012 CG1 VAL A 66 14.507 19.786 52.115 1.00 9.66 C ATOM 1013 CG2 VAL A 66 13.681 18.853 54.385 1.00 10.15 C ATOM 1014 HA VAL A 66 16.581 19.973 53.464 1.00 0.00 H ATOM 1015 HB VAL A 66 13.695 20.791 53.742 1.00 0.00 H ATOM 1016 HG11 VAL A 66 14.898 20.704 51.675 1.00 0.00 H ATOM 1017 HG12 VAL A 66 15.187 18.961 51.901 1.00 0.00 H ATOM 1018 HG13 VAL A 66 13.526 19.569 51.693 1.00 0.00 H ATOM 1019 HG21 VAL A 66 14.276 17.941 54.338 1.00 0.00 H ATOM 1020 HG22 VAL A 66 13.568 19.161 55.424 1.00 0.00 H ATOM 1021 HG23 VAL A 66 12.698 18.670 53.950 1.00 0.00 H ATOM 1022 H VAL A 66 15.776 19.909 56.303 1.00 0.00 H ATOM 1023 N LEU A 67 15.581 22.701 53.682 1.00 13.28 N ATOM 1024 CA LEU A 67 15.254 24.088 53.989 1.00 14.85 C ATOM 1025 C LEU A 67 15.620 24.616 55.388 1.00 15.15 C ATOM 1026 O LEU A 67 14.791 25.225 56.067 1.00 15.58 O ATOM 1027 CB LEU A 67 13.705 24.299 53.799 1.00 15.22 C ATOM 1028 CG LEU A 67 12.841 24.416 52.518 1.00 15.85 C ATOM 1029 CD1 LEU A 67 13.632 25.204 51.484 1.00 15.35 C ATOM 1030 CD2 LEU A 67 12.435 23.052 51.993 1.00 14.27 C ATOM 1031 HA LEU A 67 15.878 24.655 53.298 1.00 0.00 H ATOM 1032 HB2 LEU A 67 13.260 23.462 54.337 1.00 0.00 H ATOM 1033 HB3 LEU A 67 13.501 25.225 54.336 1.00 0.00 H ATOM 1034 HG LEU A 67 11.913 24.940 52.746 1.00 0.00 H ATOM 1035 HD21 LEU A 67 13.329 22.475 51.755 1.00 0.00 H ATOM 1036 HD22 LEU A 67 11.855 22.529 52.754 1.00 0.00 H ATOM 1037 HD23 LEU A 67 11.830 23.175 51.094 1.00 0.00 H ATOM 1038 HD11 LEU A 67 13.856 26.195 51.878 1.00 0.00 H ATOM 1039 HD12 LEU A 67 14.562 24.680 51.264 1.00 0.00 H ATOM 1040 HD13 LEU A 67 13.042 25.299 50.572 1.00 0.00 H ATOM 1041 H LEU A 67 15.870 22.459 52.713 1.00 0.00 H ATOM 1042 N GLY A 68 16.801 24.340 55.929 1.00 16.10 N ATOM 1043 CA GLY A 68 17.130 24.814 57.263 1.00 17.11 C ATOM 1044 C GLY A 68 16.437 24.066 58.399 1.00 18.06 C ATOM 1045 O GLY A 68 16.661 24.448 59.556 1.00 20.43 O ATOM 1046 HA3 GLY A 68 16.849 25.865 57.328 1.00 0.00 H ATOM 1047 HA2 GLY A 68 18.207 24.718 57.401 1.00 0.00 H ATOM 1048 H GLY A 68 17.496 23.781 55.394 1.00 0.00 H ATOM 1049 N LYS A 69 15.601 23.052 58.163 1.00 17.33 N ATOM 1050 CA LYS A 69 14.964 22.271 59.209 1.00 16.09 C ATOM 1051 C LYS A 69 15.431 20.815 59.281 1.00 15.38 C ATOM 1052 O LYS A 69 15.861 20.217 58.292 1.00 15.06 O ATOM 1053 CB LYS A 69 13.457 22.253 58.996 1.00 15.20 C ATOM 1054 CG LYS A 69 12.824 23.637 58.940 1.00 17.88 C ATOM 1055 CD LYS A 69 11.307 23.620 59.232 1.00 18.63 C ATOM 1056 CE LYS A 69 10.712 25.031 59.311 1.00 19.38 C ATOM 1057 NZ LYS A 69 9.237 24.987 59.290 1.00 19.78 N ATOM 1058 HA LYS A 69 15.247 22.759 60.142 1.00 0.00 H ATOM 1059 HB2 LYS A 69 13.249 21.742 58.056 1.00 0.00 H ATOM 1060 HB3 LYS A 69 13.001 21.700 59.817 1.00 0.00 H ATOM 1061 HG2 LYS A 69 13.313 24.273 59.678 1.00 0.00 H ATOM 1062 HG3 LYS A 69 12.982 24.051 57.944 1.00 0.00 H ATOM 1063 HD2 LYS A 69 10.803 23.071 58.436 1.00 0.00 H ATOM 1064 HD3 LYS A 69 11.139 23.115 60.183 1.00 0.00 H ATOM 1065 HE2 LYS A 69 11.063 25.614 58.460 1.00 0.00 H ATOM 1066 HE3 LYS A 69 11.041 25.505 60.235 1.00 0.00 H ATOM 1067 HZ1 LYS A 69 8.917 24.539 58.407 1.00 0.00 H ATOM 1068 HZ2 LYS A 69 8.896 24.435 60.103 1.00 0.00 H ATOM 1069 HZ3 LYS A 69 8.862 25.955 59.345 1.00 0.00 H ATOM 1070 H LYS A 69 15.394 22.807 57.174 1.00 0.00 H ATOM 1071 N ARG A 70 15.379 20.190 60.456 1.00 16.26 N ATOM 1072 CA ARG A 70 15.772 18.785 60.621 1.00 15.00 C ATOM 1073 C ARG A 70 14.473 18.103 61.011 1.00 14.13 C ATOM 1074 O ARG A 70 13.842 18.567 61.968 1.00 14.39 O ATOM 1075 CB ARG A 70 16.664 18.477 61.765 1.00 15.22 C ATOM 1076 CG ARG A 70 18.050 18.970 61.659 1.00 16.35 C ATOM 1077 CD ARG A 70 18.772 18.401 62.878 1.00 17.20 C ATOM 1078 NE ARG A 70 19.949 19.229 62.960 1.00 20.71 N ATOM 1079 CZ ARG A 70 21.161 18.770 62.633 1.00 22.69 C ATOM 1080 NH1 ARG A 70 21.337 17.472 62.246 1.00 21.94 N ATOM 1081 NH2 ARG A 70 22.165 19.685 62.525 1.00 22.17 N ATOM 1082 HA ARG A 70 16.291 18.487 59.710 1.00 0.00 H ATOM 1083 HB2 ARG A 70 16.222 18.915 62.660 1.00 0.00 H ATOM 1084 HB3 ARG A 70 16.703 17.393 61.874 1.00 0.00 H ATOM 1085 HG2 ARG A 70 18.513 18.614 60.739 1.00 0.00 H ATOM 1086 HG3 ARG A 70 18.071 20.060 61.676 1.00 0.00 H ATOM 1087 HD2 ARG A 70 19.036 17.354 62.726 1.00 0.00 H ATOM 1088 HD3 ARG A 70 18.162 18.494 63.776 1.00 0.00 H ATOM 1089 HE ARG A 70 19.852 20.213 63.283 1.00 0.00 H ATOM 1090 HH12 ARG A 70 22.286 17.128 61.994 1.00 0.00 H ATOM 1091 HH11 ARG A 70 20.522 16.827 62.203 1.00 0.00 H ATOM 1092 HH22 ARG A 70 23.125 19.376 62.273 1.00 0.00 H ATOM 1093 HH21 ARG A 70 21.971 20.693 62.695 1.00 0.00 H ATOM 1094 H ARG A 70 15.047 20.717 61.289 1.00 0.00 H ATOM 1095 N ILE A 71 14.010 17.086 60.298 1.00 13.03 N ATOM 1096 CA ILE A 71 12.780 16.381 60.623 1.00 11.74 C ATOM 1097 C ILE A 71 13.081 14.896 60.515 1.00 10.99 C ATOM 1098 O ILE A 71 14.071 14.539 59.896 1.00 12.84 O ATOM 1099 CB ILE A 71 11.621 16.691 59.659 1.00 11.98 C ATOM 1100 CG1 ILE A 71 12.049 16.539 58.200 1.00 12.71 C ATOM 1101 CG2 ILE A 71 11.113 18.110 59.967 1.00 10.29 C ATOM 1102 CD1 ILE A 71 10.798 16.295 57.326 1.00 14.07 C ATOM 1103 HA ILE A 71 12.466 16.696 61.618 1.00 0.00 H ATOM 1104 HB ILE A 71 10.812 15.976 59.807 1.00 0.00 H ATOM 1105 HG12 ILE A 71 12.552 17.448 57.871 1.00 0.00 H ATOM 1106 HG13 ILE A 71 12.730 15.693 58.106 1.00 0.00 H ATOM 1107 HD11 ILE A 71 10.297 15.386 57.657 1.00 0.00 H ATOM 1108 HD12 ILE A 71 10.118 17.142 57.422 1.00 0.00 H ATOM 1109 HD13 ILE A 71 11.100 16.186 56.284 1.00 0.00 H ATOM 1110 HG21 ILE A 71 10.767 18.154 61.000 1.00 0.00 H ATOM 1111 HG22 ILE A 71 11.924 18.824 59.823 1.00 0.00 H ATOM 1112 HG23 ILE A 71 10.290 18.354 59.295 1.00 0.00 H ATOM 1113 H ILE A 71 14.552 16.777 59.466 1.00 0.00 H ATOM 1114 N LYS A 72 12.325 13.990 61.099 1.00 10.98 N ATOM 1115 CA LYS A 72 12.566 12.557 61.007 1.00 11.65 C ATOM 1116 C LYS A 72 11.340 12.178 60.191 1.00 11.12 C ATOM 1117 O LYS A 72 10.294 12.818 60.339 1.00 11.10 O ATOM 1118 CB LYS A 72 12.495 11.835 62.340 1.00 13.20 C ATOM 1119 CG LYS A 72 13.359 12.311 63.528 1.00 16.75 C ATOM 1120 CD LYS A 72 13.169 13.825 64.009 1.00 20.77 C ATOM 1121 CE LYS A 72 11.754 14.449 64.403 1.00 22.69 C ATOM 1122 NZ LYS A 72 11.102 15.332 63.417 1.00 17.50 N ATOM 1123 HA LYS A 72 13.552 12.306 60.615 1.00 0.00 H ATOM 1124 HB2 LYS A 72 11.457 11.883 62.668 1.00 0.00 H ATOM 1125 HB3 LYS A 72 12.767 10.797 62.150 1.00 0.00 H ATOM 1126 HG2 LYS A 72 13.133 11.666 64.377 1.00 0.00 H ATOM 1127 HG3 LYS A 72 14.404 12.185 63.245 1.00 0.00 H ATOM 1128 HD2 LYS A 72 13.802 13.941 64.889 1.00 0.00 H ATOM 1129 HD3 LYS A 72 13.555 14.446 63.201 1.00 0.00 H ATOM 1130 HE2 LYS A 72 11.894 15.026 65.317 1.00 0.00 H ATOM 1131 HE3 LYS A 72 11.074 13.620 64.599 1.00 0.00 H ATOM 1132 HZ1 LYS A 72 11.718 16.147 63.222 1.00 0.00 H ATOM 1133 HZ2 LYS A 72 10.935 14.803 62.537 1.00 0.00 H ATOM 1134 HZ3 LYS A 72 10.194 15.666 63.799 1.00 0.00 H ATOM 1135 H LYS A 72 11.510 14.316 61.657 1.00 0.00 H ATOM 1136 N GLY A 73 11.344 11.219 59.273 1.00 11.72 N ATOM 1137 CA GLY A 73 10.123 10.968 58.521 1.00 9.62 C ATOM 1138 C GLY A 73 10.186 9.701 57.730 1.00 7.64 C ATOM 1139 O GLY A 73 11.150 8.956 57.860 1.00 8.70 O ATOM 1140 HA3 GLY A 73 9.957 11.800 57.836 1.00 0.00 H ATOM 1141 HA2 GLY A 73 9.289 10.903 59.220 1.00 0.00 H ATOM 1142 H GLY A 73 12.202 10.659 59.095 1.00 0.00 H ATOM 1143 N THR A 74 9.191 9.466 56.923 1.00 6.55 N ATOM 1144 CA THR A 74 9.156 8.248 56.184 1.00 9.06 C ATOM 1145 C THR A 74 9.607 8.516 54.763 1.00 10.18 C ATOM 1146 O THR A 74 9.209 9.496 54.144 1.00 10.49 O ATOM 1147 CB THR A 74 7.726 7.727 56.277 1.00 8.30 C ATOM 1148 OG1 THR A 74 7.491 7.705 57.685 1.00 7.26 O ATOM 1149 CG2 THR A 74 7.474 6.372 55.652 1.00 4.35 C ATOM 1150 HA THR A 74 9.833 7.490 56.578 1.00 0.00 H ATOM 1151 HB THR A 74 7.049 8.362 55.705 1.00 0.00 H ATOM 1152 HG1 THR A 74 6.574 7.376 57.860 1.00 0.00 H ATOM 1153 HG23 THR A 74 7.663 6.427 54.580 1.00 0.00 H ATOM 1154 HG21 THR A 74 8.140 5.636 56.102 1.00 0.00 H ATOM 1155 HG22 THR A 74 6.438 6.080 55.825 1.00 0.00 H ATOM 1156 H THR A 74 8.426 10.163 56.819 1.00 0.00 H ATOM 1157 N ILE A 75 10.512 7.688 54.262 1.00 10.49 N ATOM 1158 CA ILE A 75 11.012 7.841 52.922 1.00 11.42 C ATOM 1159 C ILE A 75 10.931 6.447 52.343 1.00 10.90 C ATOM 1160 O ILE A 75 10.954 5.457 53.063 1.00 10.24 O ATOM 1161 CB ILE A 75 12.501 8.436 52.910 1.00 12.33 C ATOM 1162 CG1 ILE A 75 12.375 9.901 52.554 1.00 12.95 C ATOM 1163 CG2 ILE A 75 13.427 7.944 51.819 1.00 11.51 C ATOM 1164 CD1 ILE A 75 13.052 10.750 53.649 1.00 15.34 C ATOM 1165 HA ILE A 75 10.438 8.557 52.333 1.00 0.00 H ATOM 1166 HB ILE A 75 12.910 8.157 53.881 1.00 0.00 H ATOM 1167 HG12 ILE A 75 12.861 10.087 51.596 1.00 0.00 H ATOM 1168 HG13 ILE A 75 11.321 10.170 52.484 1.00 0.00 H ATOM 1169 HD11 ILE A 75 12.564 10.563 54.606 1.00 0.00 H ATOM 1170 HD12 ILE A 75 14.106 10.479 53.717 1.00 0.00 H ATOM 1171 HD13 ILE A 75 12.963 11.806 53.395 1.00 0.00 H ATOM 1172 HG21 ILE A 75 13.543 6.863 51.902 1.00 0.00 H ATOM 1173 HG22 ILE A 75 13.003 8.191 50.846 1.00 0.00 H ATOM 1174 HG23 ILE A 75 14.400 8.424 51.926 1.00 0.00 H ATOM 1175 H ILE A 75 10.869 6.909 54.851 1.00 0.00 H ATOM 1176 N MET A 76 10.680 6.457 51.037 1.00 9.39 N ATOM 1177 CA MET A 76 10.580 5.283 50.248 1.00 8.89 C ATOM 1178 C MET A 76 11.727 5.373 49.268 1.00 9.52 C ATOM 1179 O MET A 76 12.194 6.425 48.857 1.00 9.82 O ATOM 1180 CB MET A 76 9.273 5.262 49.553 1.00 9.81 C ATOM 1181 CG MET A 76 8.253 4.842 50.602 1.00 11.85 C ATOM 1182 SD MET A 76 6.714 4.604 49.722 1.00 14.35 S ATOM 1183 CE MET A 76 5.521 4.227 50.974 1.00 13.84 C ATOM 1184 HA MET A 76 10.636 4.367 50.837 1.00 0.00 H ATOM 1185 HB2 MET A 76 9.033 6.252 49.165 1.00 0.00 H ATOM 1186 HB3 MET A 76 9.291 4.545 48.732 1.00 0.00 H ATOM 1187 HG2 MET A 76 8.142 5.621 51.357 1.00 0.00 H ATOM 1188 HG3 MET A 76 8.563 3.914 51.082 1.00 0.00 H ATOM 1189 HE1 MET A 76 5.825 3.324 51.504 1.00 0.00 H ATOM 1190 HE2 MET A 76 5.458 5.058 51.676 1.00 0.00 H ATOM 1191 HE3 MET A 76 4.548 4.067 50.510 1.00 0.00 H ATOM 1192 H MET A 76 10.550 7.376 50.569 1.00 0.00 H ATOM 1193 N THR A 77 12.260 4.228 48.972 1.00 8.54 N ATOM 1194 CA THR A 77 13.350 4.032 48.073 1.00 9.46 C ATOM 1195 C THR A 77 12.755 3.264 46.907 1.00 10.57 C ATOM 1196 O THR A 77 11.866 2.420 47.135 1.00 10.71 O ATOM 1197 CB THR A 77 14.365 3.269 48.904 1.00 10.17 C ATOM 1198 OG1 THR A 77 15.137 4.362 49.430 1.00 13.06 O ATOM 1199 CG2 THR A 77 15.085 2.119 48.226 1.00 6.36 C ATOM 1200 HA THR A 77 13.842 4.912 47.659 1.00 0.00 H ATOM 1201 HB THR A 77 13.939 2.641 49.686 1.00 0.00 H ATOM 1202 HG1 THR A 77 15.858 4.007 50.008 1.00 0.00 H ATOM 1203 HG23 THR A 77 14.355 1.383 47.889 1.00 0.00 H ATOM 1204 HG21 THR A 77 15.644 2.496 47.370 1.00 0.00 H ATOM 1205 HG22 THR A 77 15.771 1.654 48.934 1.00 0.00 H ATOM 1206 H THR A 77 11.860 3.383 49.428 1.00 0.00 H ATOM 1207 N GLY A 78 13.135 3.539 45.661 1.00 10.26 N ATOM 1208 CA GLY A 78 12.623 2.720 44.592 1.00 11.25 C ATOM 1209 C GLY A 78 12.969 3.364 43.297 1.00 12.49 C ATOM 1210 O GLY A 78 13.475 4.467 43.229 1.00 13.69 O ATOM 1211 HA3 GLY A 78 11.540 2.632 44.682 1.00 0.00 H ATOM 1212 HA2 GLY A 78 13.072 1.728 44.641 1.00 0.00 H ATOM 1213 H GLY A 78 13.786 4.326 45.464 1.00 0.00 H ATOM 1214 N ASP A 79 12.806 2.532 42.302 1.00 14.95 N ATOM 1215 CA ASP A 79 12.942 2.785 40.869 1.00 16.97 C ATOM 1216 C ASP A 79 12.261 4.130 40.481 1.00 16.58 C ATOM 1217 O ASP A 79 11.246 4.053 39.777 1.00 17.73 O ATOM 1218 CB ASP A 79 12.304 1.495 40.146 1.00 22.02 C ATOM 1219 CG ASP A 79 11.174 0.554 40.821 1.00 26.55 C ATOM 1220 OD1 ASP A 79 10.891 0.625 42.052 1.00 24.30 O ATOM 1221 OD2 ASP A 79 10.564 -0.293 40.098 1.00 24.95 O ATOM 1222 HA ASP A 79 13.978 2.908 40.553 1.00 0.00 H ATOM 1223 HB2 ASP A 79 11.869 1.861 39.216 1.00 0.00 H ATOM 1224 HB3 ASP A 79 13.142 0.836 39.920 1.00 0.00 H ATOM 1225 H ASP A 79 12.545 1.560 42.565 1.00 0.00 H ATOM 1226 N THR A 80 12.694 5.354 40.878 1.00 14.02 N ATOM 1227 CA THR A 80 12.008 6.575 40.512 1.00 11.51 C ATOM 1228 C THR A 80 12.902 7.446 39.643 1.00 11.83 C ATOM 1229 O THR A 80 14.071 7.675 39.989 1.00 11.93 O ATOM 1230 CB THR A 80 11.537 7.349 41.832 1.00 12.38 C ATOM 1231 OG1 THR A 80 10.747 8.434 41.363 1.00 11.90 O ATOM 1232 CG2 THR A 80 12.616 7.939 42.719 1.00 11.31 C ATOM 1233 HA THR A 80 11.121 6.329 39.928 1.00 0.00 H ATOM 1234 HB THR A 80 11.040 6.610 42.461 1.00 0.00 H ATOM 1235 HG1 THR A 80 11.297 9.012 40.777 1.00 0.00 H ATOM 1236 HG23 THR A 80 13.248 7.138 43.102 1.00 0.00 H ATOM 1237 HG21 THR A 80 13.221 8.635 42.138 1.00 0.00 H ATOM 1238 HG22 THR A 80 12.151 8.467 43.552 1.00 0.00 H ATOM 1239 H THR A 80 13.549 5.417 41.466 1.00 0.00 H ATOM 1240 N PRO A 81 12.368 7.980 38.518 1.00 10.78 N ATOM 1241 CA PRO A 81 13.055 8.923 37.622 1.00 9.59 C ATOM 1242 C PRO A 81 13.501 10.238 38.243 1.00 11.32 C ATOM 1243 O PRO A 81 14.437 10.854 37.739 1.00 10.56 O ATOM 1244 CB PRO A 81 12.100 9.151 36.505 1.00 8.54 C ATOM 1245 CG PRO A 81 10.743 8.911 37.140 1.00 9.61 C ATOM 1246 CD PRO A 81 10.998 7.738 38.070 1.00 9.67 C ATOM 1247 HA PRO A 81 14.004 8.485 37.312 1.00 0.00 H ATOM 1248 HD3 PRO A 81 10.302 7.742 38.909 1.00 0.00 H ATOM 1249 HD2 PRO A 81 10.919 6.790 37.539 1.00 0.00 H ATOM 1250 HG3 PRO A 81 9.998 8.658 36.386 1.00 0.00 H ATOM 1251 HG2 PRO A 81 10.411 9.787 37.697 1.00 0.00 H ATOM 1252 HB2 PRO A 81 12.178 10.171 36.128 1.00 0.00 H ATOM 1253 HB3 PRO A 81 12.278 8.449 35.691 1.00 0.00 H ATOM 1254 N ILE A 82 12.858 10.659 39.355 1.00 12.80 N ATOM 1255 CA ILE A 82 13.162 11.888 40.062 1.00 13.14 C ATOM 1256 C ILE A 82 12.932 11.695 41.563 1.00 13.73 C ATOM 1257 O ILE A 82 12.054 10.892 41.892 1.00 14.98 O ATOM 1258 CB ILE A 82 12.262 12.908 39.435 1.00 15.39 C ATOM 1259 CG1 ILE A 82 12.637 14.265 39.918 1.00 15.42 C ATOM 1260 CG2 ILE A 82 10.819 12.562 39.768 1.00 15.79 C ATOM 1261 CD1 ILE A 82 11.808 15.277 39.097 1.00 21.65 C ATOM 1262 HA ILE A 82 14.202 12.205 39.981 1.00 0.00 H ATOM 1263 HB ILE A 82 12.370 12.904 38.350 1.00 0.00 H ATOM 1264 HG12 ILE A 82 12.406 14.363 40.979 1.00 0.00 H ATOM 1265 HG13 ILE A 82 13.702 14.438 39.762 1.00 0.00 H ATOM 1266 HD11 ILE A 82 12.043 15.164 38.039 1.00 0.00 H ATOM 1267 HD12 ILE A 82 10.746 15.089 39.256 1.00 0.00 H ATOM 1268 HD13 ILE A 82 12.051 16.290 39.419 1.00 0.00 H ATOM 1269 HG21 ILE A 82 10.584 11.572 39.377 1.00 0.00 H ATOM 1270 HG22 ILE A 82 10.686 12.567 40.850 1.00 0.00 H ATOM 1271 HG23 ILE A 82 10.156 13.300 39.315 1.00 0.00 H ATOM 1272 H ILE A 82 12.094 10.061 39.729 1.00 0.00 H ATOM 1273 N ASN A 83 13.635 12.355 42.509 1.00 12.75 N ATOM 1274 CA ASN A 83 13.394 12.131 43.945 1.00 10.53 C ATOM 1275 C ASN A 83 12.270 13.064 44.320 1.00 11.03 C ATOM 1276 O ASN A 83 12.292 14.255 43.987 1.00 10.67 O ATOM 1277 CB ASN A 83 14.580 12.460 44.791 1.00 11.07 C ATOM 1278 CG ASN A 83 15.804 11.639 44.410 1.00 14.34 C ATOM 1279 OD1 ASN A 83 15.738 10.458 44.043 1.00 15.11 O ATOM 1280 ND2 ASN A 83 16.979 12.248 44.429 1.00 14.27 N ATOM 1281 HA ASN A 83 13.168 11.078 44.115 1.00 0.00 H ATOM 1282 HB2 ASN A 83 14.815 13.518 44.671 1.00 0.00 H ATOM 1283 HB3 ASN A 83 14.334 12.260 45.834 1.00 0.00 H ATOM 1284 HD22 ASN A 83 17.046 13.240 44.735 1.00 0.00 H ATOM 1285 HD21 ASN A 83 17.835 11.735 44.138 1.00 0.00 H ATOM 1286 H ASN A 83 14.363 13.037 42.217 1.00 0.00 H ATOM 1287 N ILE A 84 11.285 12.525 45.022 1.00 8.58 N ATOM 1288 CA ILE A 84 10.108 13.249 45.434 1.00 6.08 C ATOM 1289 C ILE A 84 9.899 13.365 46.918 1.00 4.86 C ATOM 1290 O ILE A 84 10.054 12.395 47.639 1.00 6.82 O ATOM 1291 CB ILE A 84 8.924 12.511 44.760 1.00 7.10 C ATOM 1292 CG1 ILE A 84 8.995 12.669 43.264 1.00 3.58 C ATOM 1293 CG2 ILE A 84 7.600 12.987 45.360 1.00 10.10 C ATOM 1294 CD1 ILE A 84 8.065 11.675 42.631 1.00 4.95 C ATOM 1295 HA ILE A 84 10.208 14.290 45.126 1.00 0.00 H ATOM 1296 HB ILE A 84 8.989 11.441 44.959 1.00 0.00 H ATOM 1297 HG12 ILE A 84 8.696 13.680 42.987 1.00 0.00 H ATOM 1298 HG13 ILE A 84 10.014 12.487 42.923 1.00 0.00 H ATOM 1299 HD11 ILE A 84 8.367 10.666 42.912 1.00 0.00 H ATOM 1300 HD12 ILE A 84 7.048 11.860 42.976 1.00 0.00 H ATOM 1301 HD13 ILE A 84 8.107 11.779 41.547 1.00 0.00 H ATOM 1302 HG21 ILE A 84 7.591 12.778 46.430 1.00 0.00 H ATOM 1303 HG22 ILE A 84 7.494 14.060 45.197 1.00 0.00 H ATOM 1304 HG23 ILE A 84 6.775 12.462 44.879 1.00 0.00 H ATOM 1305 H ILE A 84 11.365 11.524 45.291 1.00 0.00 H ATOM 1306 N PHE A 85 9.514 14.530 47.374 1.00 5.14 N ATOM 1307 CA PHE A 85 9.235 14.795 48.755 1.00 3.28 C ATOM 1308 C PHE A 85 7.759 15.138 48.619 1.00 4.13 C ATOM 1309 O PHE A 85 7.374 16.163 48.043 1.00 4.01 O ATOM 1310 CB PHE A 85 10.037 15.969 49.302 1.00 4.06 C ATOM 1311 CG PHE A 85 11.314 15.580 50.070 1.00 5.91 C ATOM 1312 CD1 PHE A 85 12.000 14.400 49.802 1.00 5.17 C ATOM 1313 CD2 PHE A 85 11.806 16.419 51.055 1.00 5.31 C ATOM 1314 CE1 PHE A 85 13.148 14.077 50.500 1.00 7.71 C ATOM 1315 CE2 PHE A 85 12.964 16.078 51.750 1.00 7.56 C ATOM 1316 CZ PHE A 85 13.644 14.911 51.486 1.00 6.56 C ATOM 1317 HA PHE A 85 9.483 13.988 49.445 1.00 0.00 H ATOM 1318 HB2 PHE A 85 10.326 16.602 48.463 1.00 0.00 H ATOM 1319 HB3 PHE A 85 9.394 16.533 49.977 1.00 0.00 H ATOM 1320 HD2 PHE A 85 11.286 17.348 51.287 1.00 0.00 H ATOM 1321 HE2 PHE A 85 13.340 16.751 52.521 1.00 0.00 H ATOM 1322 HZ PHE A 85 14.547 14.651 52.038 1.00 0.00 H ATOM 1323 HE1 PHE A 85 13.672 13.149 50.270 1.00 0.00 H ATOM 1324 HD1 PHE A 85 11.628 13.723 49.033 1.00 0.00 H ATOM 1325 H PHE A 85 9.404 15.309 46.694 1.00 0.00 H ATOM 1326 N GLY A 86 6.962 14.166 49.071 1.00 2.39 N ATOM 1327 CA GLY A 86 5.525 14.209 49.041 1.00 2.01 C ATOM 1328 C GLY A 86 4.922 14.911 50.235 1.00 2.05 C ATOM 1329 O GLY A 86 5.604 15.395 51.121 1.00 2.42 O ATOM 1330 HA3 GLY A 86 5.149 13.186 49.014 1.00 0.00 H ATOM 1331 HA2 GLY A 86 5.213 14.733 48.138 1.00 0.00 H ATOM 1332 H GLY A 86 7.412 13.319 49.473 1.00 0.00 H ATOM 1333 N ARG A 87 3.604 14.878 50.309 1.00 3.93 N ATOM 1334 CA ARG A 87 2.802 15.577 51.282 1.00 5.24 C ATOM 1335 C ARG A 87 3.102 15.233 52.729 1.00 7.78 C ATOM 1336 O ARG A 87 3.026 16.081 53.633 1.00 6.39 O ATOM 1337 CB ARG A 87 1.357 15.324 50.969 1.00 5.17 C ATOM 1338 CG ARG A 87 0.850 16.250 49.872 1.00 6.66 C ATOM 1339 CD ARG A 87 -0.664 16.246 49.740 1.00 6.74 C ATOM 1340 NE ARG A 87 -1.111 14.873 49.588 1.00 8.31 N ATOM 1341 CZ ARG A 87 -1.832 14.283 50.543 1.00 10.98 C ATOM 1342 NH1 ARG A 87 -2.158 14.962 51.648 1.00 11.05 N ATOM 1343 NH2 ARG A 87 -2.226 13.021 50.407 1.00 6.12 N ATOM 1344 HA ARG A 87 3.053 16.634 51.198 1.00 0.00 H ATOM 1345 HB2 ARG A 87 1.241 14.291 50.641 1.00 0.00 H ATOM 1346 HB3 ARG A 87 0.766 15.486 51.870 1.00 0.00 H ATOM 1347 HG2 ARG A 87 1.176 17.265 50.097 1.00 0.00 H ATOM 1348 HG3 ARG A 87 1.282 15.933 48.923 1.00 0.00 H ATOM 1349 HD2 ARG A 87 -0.958 16.827 48.866 1.00 0.00 H ATOM 1350 HD3 ARG A 87 -1.112 16.682 50.633 1.00 0.00 H ATOM 1351 HE ARG A 87 -0.867 14.344 48.726 1.00 0.00 H ATOM 1352 HH12 ARG A 87 -2.720 14.503 52.393 1.00 0.00 H ATOM 1353 HH11 ARG A 87 -1.850 15.949 51.762 1.00 0.00 H ATOM 1354 HH22 ARG A 87 -2.788 12.568 51.156 1.00 0.00 H ATOM 1355 HH21 ARG A 87 -1.973 12.486 49.552 1.00 0.00 H ATOM 1356 H ARG A 87 3.102 14.299 49.606 1.00 0.00 H ATOM 1357 N ASN A 88 3.518 13.983 52.956 1.00 7.98 N ATOM 1358 CA ASN A 88 3.857 13.590 54.321 1.00 9.18 C ATOM 1359 C ASN A 88 5.051 14.419 54.866 1.00 8.90 C ATOM 1360 O ASN A 88 5.064 14.796 56.029 1.00 11.78 O ATOM 1361 CB ASN A 88 4.202 12.099 54.385 1.00 7.90 C ATOM 1362 CG ASN A 88 5.539 11.744 53.784 1.00 11.08 C ATOM 1363 OD1 ASN A 88 6.453 11.296 54.481 1.00 13.97 O ATOM 1364 ND2 ASN A 88 5.678 11.927 52.476 1.00 8.57 N ATOM 1365 HA ASN A 88 2.983 13.785 54.942 1.00 0.00 H ATOM 1366 HB2 ASN A 88 4.206 11.794 55.431 1.00 0.00 H ATOM 1367 HB3 ASN A 88 3.430 11.546 53.850 1.00 0.00 H ATOM 1368 HD22 ASN A 88 4.887 12.307 51.917 1.00 0.00 H ATOM 1369 HD21 ASN A 88 6.577 11.691 52.011 1.00 0.00 H ATOM 1370 H ASN A 88 3.599 13.302 52.174 1.00 0.00 H ATOM 1371 N LEU A 89 6.045 14.782 54.063 1.00 8.11 N ATOM 1372 CA LEU A 89 7.162 15.556 54.556 1.00 8.35 C ATOM 1373 C LEU A 89 6.824 17.020 54.412 1.00 10.16 C ATOM 1374 O LEU A 89 7.258 17.784 55.274 1.00 13.49 O ATOM 1375 CB LEU A 89 8.467 15.266 53.782 1.00 5.61 C ATOM 1376 CG LEU A 89 8.952 13.801 53.860 1.00 6.60 C ATOM 1377 CD1 LEU A 89 10.180 13.693 53.002 1.00 3.35 C ATOM 1378 CD2 LEU A 89 9.171 13.346 55.323 1.00 4.64 C ATOM 1379 HA LEU A 89 7.331 15.282 55.597 1.00 0.00 H ATOM 1380 HB2 LEU A 89 8.302 15.514 52.733 1.00 0.00 H ATOM 1381 HB3 LEU A 89 9.251 15.906 54.187 1.00 0.00 H ATOM 1382 HG LEU A 89 8.194 13.117 53.480 1.00 0.00 H ATOM 1383 HD21 LEU A 89 9.923 13.982 55.791 1.00 0.00 H ATOM 1384 HD22 LEU A 89 8.233 13.426 55.872 1.00 0.00 H ATOM 1385 HD23 LEU A 89 9.512 12.311 55.333 1.00 0.00 H ATOM 1386 HD11 LEU A 89 9.929 13.960 51.975 1.00 0.00 H ATOM 1387 HD12 LEU A 89 10.946 14.371 53.379 1.00 0.00 H ATOM 1388 HD13 LEU A 89 10.553 12.669 53.031 1.00 0.00 H ATOM 1389 H LEU A 89 6.019 14.504 53.061 1.00 0.00 H ATOM 1390 N LEU A 90 6.038 17.457 53.416 1.00 9.01 N ATOM 1391 CA LEU A 90 5.712 18.870 53.260 1.00 8.29 C ATOM 1392 C LEU A 90 4.835 19.280 54.441 1.00 9.77 C ATOM 1393 O LEU A 90 4.912 20.443 54.854 1.00 9.71 O ATOM 1394 CB LEU A 90 4.987 19.141 51.896 1.00 5.52 C ATOM 1395 CG LEU A 90 5.672 18.627 50.619 1.00 5.16 C ATOM 1396 CD1 LEU A 90 4.780 18.820 49.433 1.00 5.74 C ATOM 1397 CD2 LEU A 90 6.977 19.328 50.419 1.00 6.10 C ATOM 1398 HA LEU A 90 6.626 19.463 53.248 1.00 0.00 H ATOM 1399 HB2 LEU A 90 4.003 18.676 51.950 1.00 0.00 H ATOM 1400 HB3 LEU A 90 4.872 20.220 51.795 1.00 0.00 H ATOM 1401 HG LEU A 90 5.865 17.560 50.729 1.00 0.00 H ATOM 1402 HD21 LEU A 90 6.802 20.400 50.325 1.00 0.00 H ATOM 1403 HD22 LEU A 90 7.625 19.138 51.275 1.00 0.00 H ATOM 1404 HD23 LEU A 90 7.453 18.956 49.512 1.00 0.00 H ATOM 1405 HD11 LEU A 90 3.852 18.269 49.585 1.00 0.00 H ATOM 1406 HD12 LEU A 90 4.559 19.881 49.315 1.00 0.00 H ATOM 1407 HD13 LEU A 90 5.282 18.450 48.539 1.00 0.00 H ATOM 1408 H LEU A 90 5.651 16.770 52.738 1.00 0.00 H ATOM 1409 N THR A 91 4.005 18.390 55.021 1.00 10.26 N ATOM 1410 CA THR A 91 3.216 18.814 56.170 1.00 11.20 C ATOM 1411 C THR A 91 4.193 18.933 57.362 1.00 10.79 C ATOM 1412 O THR A 91 4.207 19.955 58.046 1.00 9.26 O ATOM 1413 CB THR A 91 2.058 17.813 56.445 1.00 8.62 C ATOM 1414 OG1 THR A 91 2.392 16.458 56.282 1.00 10.77 O ATOM 1415 CG2 THR A 91 1.005 18.128 55.443 1.00 10.27 C ATOM 1416 HA THR A 91 2.735 19.776 55.991 1.00 0.00 H ATOM 1417 HB THR A 91 1.762 17.930 57.487 1.00 0.00 H ATOM 1418 HG1 THR A 91 2.687 16.302 55.350 1.00 0.00 H ATOM 1419 HG23 THR A 91 0.717 19.175 55.537 1.00 0.00 H ATOM 1420 HG21 THR A 91 1.393 17.945 54.441 1.00 0.00 H ATOM 1421 HG22 THR A 91 0.136 17.494 55.619 1.00 0.00 H ATOM 1422 H THR A 91 3.929 17.419 54.655 1.00 0.00 H ATOM 1423 N ALA A 92 5.116 17.987 57.530 1.00 10.64 N ATOM 1424 CA ALA A 92 6.095 18.015 58.594 1.00 12.63 C ATOM 1425 C ALA A 92 6.885 19.331 58.520 1.00 13.88 C ATOM 1426 O ALA A 92 7.285 19.852 59.554 1.00 16.08 O ATOM 1427 CB ALA A 92 7.035 16.838 58.440 1.00 13.19 C ATOM 1428 HA ALA A 92 5.595 17.950 59.560 1.00 0.00 H ATOM 1429 HB1 ALA A 92 6.465 15.910 58.492 1.00 0.00 H ATOM 1430 HB2 ALA A 92 7.540 16.902 57.476 1.00 0.00 H ATOM 1431 HB3 ALA A 92 7.774 16.857 59.241 1.00 0.00 H ATOM 1432 H ALA A 92 5.133 17.189 56.863 1.00 0.00 H ATOM 1433 N LEU A 93 7.152 19.928 57.353 1.00 14.83 N ATOM 1434 CA LEU A 93 7.876 21.211 57.241 1.00 14.52 C ATOM 1435 C LEU A 93 6.926 22.428 57.397 1.00 13.98 C ATOM 1436 O LEU A 93 7.338 23.575 57.432 1.00 13.40 O ATOM 1437 CB LEU A 93 8.522 21.379 55.889 1.00 14.28 C ATOM 1438 CG LEU A 93 9.889 20.896 55.457 1.00 15.87 C ATOM 1439 CD1 LEU A 93 10.652 20.281 56.604 1.00 14.24 C ATOM 1440 CD2 LEU A 93 9.659 20.001 54.244 1.00 17.46 C ATOM 1441 HA LEU A 93 8.620 21.181 58.037 1.00 0.00 H ATOM 1442 HB2 LEU A 93 7.828 20.915 55.189 1.00 0.00 H ATOM 1443 HB3 LEU A 93 8.540 22.456 55.720 1.00 0.00 H ATOM 1444 HG LEU A 93 10.550 21.709 55.156 1.00 0.00 H ATOM 1445 HD21 LEU A 93 9.018 19.166 54.527 1.00 0.00 H ATOM 1446 HD22 LEU A 93 9.178 20.578 53.454 1.00 0.00 H ATOM 1447 HD23 LEU A 93 10.617 19.622 53.887 1.00 0.00 H ATOM 1448 HD11 LEU A 93 10.783 21.023 57.391 1.00 0.00 H ATOM 1449 HD12 LEU A 93 10.094 19.430 56.995 1.00 0.00 H ATOM 1450 HD13 LEU A 93 11.628 19.947 56.252 1.00 0.00 H ATOM 1451 H LEU A 93 6.833 19.464 56.478 1.00 0.00 H ATOM 1452 N GLY A 94 5.621 22.243 57.471 1.00 12.79 N ATOM 1453 CA GLY A 94 4.658 23.319 57.544 1.00 12.76 C ATOM 1454 C GLY A 94 4.598 24.062 56.220 1.00 14.00 C ATOM 1455 O GLY A 94 4.532 25.291 56.205 1.00 15.21 O ATOM 1456 HA3 GLY A 94 4.951 24.012 58.333 1.00 0.00 H ATOM 1457 HA2 GLY A 94 3.675 22.907 57.771 1.00 0.00 H ATOM 1458 H GLY A 94 5.265 21.266 57.477 1.00 0.00 H ATOM 1459 N MET A 95 4.630 23.372 55.080 1.00 12.85 N ATOM 1460 CA MET A 95 4.641 24.035 53.803 1.00 10.62 C ATOM 1461 C MET A 95 3.195 24.081 53.365 1.00 10.64 C ATOM 1462 O MET A 95 2.412 23.231 53.789 1.00 12.29 O ATOM 1463 CB MET A 95 5.531 23.189 52.959 1.00 11.16 C ATOM 1464 CG MET A 95 5.863 23.558 51.536 1.00 12.13 C ATOM 1465 SD MET A 95 7.664 23.368 51.330 1.00 16.34 S ATOM 1466 CE MET A 95 7.976 24.957 50.622 1.00 11.24 C ATOM 1467 HA MET A 95 5.017 25.058 53.771 1.00 0.00 H ATOM 1468 HB2 MET A 95 6.482 23.122 53.488 1.00 0.00 H ATOM 1469 HB3 MET A 95 5.069 22.203 52.920 1.00 0.00 H ATOM 1470 HG2 MET A 95 5.572 24.590 51.341 1.00 0.00 H ATOM 1471 HG3 MET A 95 5.337 22.897 50.847 1.00 0.00 H ATOM 1472 HE1 MET A 95 7.411 25.058 49.696 1.00 0.00 H ATOM 1473 HE2 MET A 95 7.668 25.733 51.323 1.00 0.00 H ATOM 1474 HE3 MET A 95 9.041 25.057 50.412 1.00 0.00 H ATOM 1475 H MET A 95 4.647 22.333 55.114 1.00 0.00 H ATOM 1476 N SER A 96 2.738 25.042 52.591 1.00 9.44 N ATOM 1477 CA SER A 96 1.360 25.086 52.149 1.00 10.51 C ATOM 1478 C SER A 96 1.300 25.626 50.711 1.00 11.12 C ATOM 1479 O SER A 96 2.244 26.218 50.184 1.00 9.96 O ATOM 1480 CB SER A 96 0.529 25.984 53.050 1.00 10.89 C ATOM 1481 OG SER A 96 1.046 27.301 53.129 1.00 14.36 O ATOM 1482 HA SER A 96 0.954 24.075 52.190 1.00 0.00 H ATOM 1483 HB2 SER A 96 0.511 25.554 54.052 1.00 0.00 H ATOM 1484 HB3 SER A 96 -0.487 26.030 52.657 1.00 0.00 H ATOM 1485 HG SER A 96 0.472 27.844 53.725 1.00 0.00 H ATOM 1486 H SER A 96 3.388 25.795 52.287 1.00 0.00 H ATOM 1487 N LEU A 97 0.219 25.328 50.017 1.00 11.67 N ATOM 1488 CA LEU A 97 0.042 25.779 48.676 1.00 13.23 C ATOM 1489 C LEU A 97 -0.855 26.967 48.948 1.00 14.87 C ATOM 1490 O LEU A 97 -1.715 26.930 49.822 1.00 16.77 O ATOM 1491 CB LEU A 97 -0.622 24.666 47.869 1.00 13.57 C ATOM 1492 CG LEU A 97 -0.629 24.692 46.325 1.00 12.43 C ATOM 1493 CD1 LEU A 97 0.727 25.113 45.744 1.00 10.49 C ATOM 1494 CD2 LEU A 97 -1.057 23.314 45.873 1.00 10.11 C ATOM 1495 HA LEU A 97 0.929 26.034 48.095 1.00 0.00 H ATOM 1496 HB2 LEU A 97 -0.131 23.738 48.160 1.00 0.00 H ATOM 1497 HB3 LEU A 97 -1.666 24.637 48.182 1.00 0.00 H ATOM 1498 HG LEU A 97 -1.325 25.444 45.954 1.00 0.00 H ATOM 1499 HD21 LEU A 97 -0.349 22.574 46.247 1.00 0.00 H ATOM 1500 HD22 LEU A 97 -2.051 23.097 46.264 1.00 0.00 H ATOM 1501 HD23 LEU A 97 -1.078 23.280 44.784 1.00 0.00 H ATOM 1502 HD11 LEU A 97 0.978 26.113 46.098 1.00 0.00 H ATOM 1503 HD12 LEU A 97 1.494 24.409 46.067 1.00 0.00 H ATOM 1504 HD13 LEU A 97 0.669 25.115 44.656 1.00 0.00 H ATOM 1505 H LEU A 97 -0.523 24.749 50.459 1.00 0.00 H ATOM 1506 N ASN A 98 -0.668 28.068 48.267 1.00 16.21 N ATOM 1507 CA ASN A 98 -1.472 29.241 48.483 1.00 18.59 C ATOM 1508 C ASN A 98 -1.785 29.893 47.141 1.00 19.93 C ATOM 1509 O ASN A 98 -1.028 29.766 46.159 1.00 19.23 O ATOM 1510 CB ASN A 98 -0.701 30.243 49.357 1.00 22.12 C ATOM 1511 CG ASN A 98 -0.270 29.653 50.701 1.00 23.56 C ATOM 1512 OD1 ASN A 98 -1.122 29.469 51.559 1.00 24.97 O ATOM 1513 ND2 ASN A 98 0.983 29.255 50.955 1.00 24.01 N ATOM 1514 HA ASN A 98 -2.398 28.955 48.983 1.00 0.00 H ATOM 1515 HB2 ASN A 98 0.189 30.564 48.816 1.00 0.00 H ATOM 1516 HB3 ASN A 98 -1.341 31.105 49.545 1.00 0.00 H ATOM 1517 HD22 ASN A 98 1.728 29.398 50.244 1.00 0.00 H ATOM 1518 HD21 ASN A 98 1.211 28.802 51.863 1.00 0.00 H ATOM 1519 H ASN A 98 0.084 28.096 47.549 1.00 0.00 H ATOM 1520 N LEU A 99 -2.937 30.577 47.162 1.00 20.32 N ATOM 1521 CA LEU A 99 -3.525 31.331 46.067 1.00 19.33 C ATOM 1522 C LEU A 99 -3.959 32.659 46.691 1.00 20.85 C ATOM 1523 O LEU A 99 -3.372 33.674 46.319 1.00 22.41 O ATOM 1524 CB LEU A 99 -4.753 30.636 45.480 1.00 18.53 C ATOM 1525 CG LEU A 99 -5.474 31.391 44.358 1.00 19.35 C ATOM 1526 CD1 LEU A 99 -4.519 31.889 43.266 1.00 21.24 C ATOM 1527 CD2 LEU A 99 -6.375 30.439 43.639 1.00 19.56 C ATOM 1528 HA LEU A 99 -2.809 31.442 45.252 1.00 0.00 H ATOM 1529 OXT LEU A 99 -4.850 32.695 47.557 1.00 21.85 O ATOM 1530 HB2 LEU A 99 -4.434 29.672 45.084 1.00 0.00 H ATOM 1531 HB3 LEU A 99 -5.466 30.477 46.289 1.00 0.00 H ATOM 1532 HG LEU A 99 -5.984 32.227 44.837 1.00 0.00 H ATOM 1533 HD21 LEU A 99 -5.782 29.628 43.217 1.00 0.00 H ATOM 1534 HD22 LEU A 99 -7.104 30.032 44.339 1.00 0.00 H ATOM 1535 HD23 LEU A 99 -6.893 30.966 42.838 1.00 0.00 H ATOM 1536 HD11 LEU A 99 -3.787 32.566 43.706 1.00 0.00 H ATOM 1537 HD12 LEU A 99 -4.005 31.038 42.818 1.00 0.00 H ATOM 1538 HD13 LEU A 99 -5.088 32.416 42.500 1.00 0.00 H ATOM 1539 H LEU A 99 -3.467 30.567 48.057 1.00 0.00 H TER 1540 LEU A 99 ATOM 1541 N PRO B 1 -7.128 31.130 48.502 1.00 23.69 N ATOM 1542 CA PRO B 1 -7.132 30.007 49.448 1.00 22.24 C ATOM 1543 C PRO B 1 -5.745 29.444 49.729 1.00 21.81 C ATOM 1544 O PRO B 1 -4.818 29.598 48.936 1.00 21.49 O ATOM 1545 CB PRO B 1 -8.036 28.912 48.891 1.00 23.06 C ATOM 1546 CG PRO B 1 -8.253 29.301 47.424 1.00 25.64 C ATOM 1547 CD PRO B 1 -8.171 30.846 47.506 1.00 24.16 C ATOM 1548 HA PRO B 1 -7.503 30.380 50.402 1.00 0.00 H ATOM 1549 HD3 PRO B 1 -7.898 31.266 46.538 1.00 0.00 H ATOM 1550 HD2 PRO B 1 -9.127 31.262 47.825 1.00 0.00 H ATOM 1551 HG3 PRO B 1 -9.227 28.971 47.063 1.00 0.00 H ATOM 1552 HG2 PRO B 1 -7.472 28.893 46.783 1.00 0.00 H ATOM 1553 HB2 PRO B 1 -7.552 27.938 48.964 1.00 0.00 H ATOM 1554 HB3 PRO B 1 -8.985 28.886 49.427 1.00 0.00 H ATOM 1555 N GLN B 2 -5.646 28.740 50.862 1.00 21.67 N ATOM 1556 CA GLN B 2 -4.430 28.109 51.358 1.00 20.60 C ATOM 1557 C GLN B 2 -4.817 26.659 51.437 1.00 18.60 C ATOM 1558 O GLN B 2 -5.928 26.397 51.910 1.00 18.85 O ATOM 1559 CB GLN B 2 -4.107 28.602 52.750 1.00 21.56 C ATOM 1560 CG GLN B 2 -2.940 27.845 53.325 1.00 25.37 C ATOM 1561 CD GLN B 2 -2.642 28.240 54.767 1.00 27.74 C ATOM 1562 OE1 GLN B 2 -1.860 29.172 55.050 1.00 26.42 O ATOM 1563 NE2 GLN B 2 -3.274 27.488 55.699 1.00 26.55 N ATOM 1564 HA GLN B 2 -3.561 28.312 50.732 1.00 0.00 H ATOM 1565 HB2 GLN B 2 -3.859 29.663 52.706 1.00 0.00 H ATOM 1566 HB3 GLN B 2 -4.977 28.460 53.391 1.00 0.00 H ATOM 1567 HG2 GLN B 2 -3.165 26.779 53.293 1.00 0.00 H ATOM 1568 HG3 GLN B 2 -2.058 28.047 52.717 1.00 0.00 H ATOM 1569 HE22 GLN B 2 -3.915 26.724 55.404 1.00 0.00 H ATOM 1570 HE21 GLN B 2 -3.119 27.674 56.710 1.00 0.00 H ATOM 1571 H GLN B 2 -6.507 28.634 51.436 1.00 0.00 H ATOM 1572 N PHE B 3 -3.961 25.747 51.020 1.00 16.66 N ATOM 1573 CA PHE B 3 -4.214 24.310 51.046 1.00 15.30 C ATOM 1574 C PHE B 3 -3.069 23.869 51.912 1.00 14.75 C ATOM 1575 O PHE B 3 -1.898 24.089 51.567 1.00 13.77 O ATOM 1576 CB PHE B 3 -4.066 23.599 49.638 1.00 15.02 C ATOM 1577 CG PHE B 3 -5.205 23.915 48.654 1.00 13.83 C ATOM 1578 CD1 PHE B 3 -5.332 25.179 48.093 1.00 15.65 C ATOM 1579 CD2 PHE B 3 -6.203 22.992 48.439 1.00 13.43 C ATOM 1580 CE1 PHE B 3 -6.453 25.506 47.354 1.00 14.46 C ATOM 1581 CE2 PHE B 3 -7.315 23.311 47.704 1.00 13.10 C ATOM 1582 CZ PHE B 3 -7.445 24.572 47.166 1.00 14.49 C ATOM 1583 HA PHE B 3 -5.227 24.072 51.371 1.00 0.00 H ATOM 1584 HB2 PHE B 3 -3.126 23.920 49.189 1.00 0.00 H ATOM 1585 HB3 PHE B 3 -4.041 22.521 49.799 1.00 0.00 H ATOM 1586 HD2 PHE B 3 -6.108 21.991 48.860 1.00 0.00 H ATOM 1587 HE2 PHE B 3 -8.096 22.567 47.545 1.00 0.00 H ATOM 1588 HZ PHE B 3 -8.334 24.830 46.591 1.00 0.00 H ATOM 1589 HE1 PHE B 3 -6.551 26.502 46.921 1.00 0.00 H ATOM 1590 HD1 PHE B 3 -4.543 25.917 48.236 1.00 0.00 H ATOM 1591 H PHE B 3 -3.046 26.073 50.648 1.00 0.00 H ATOM 1592 N SER B 4 -3.331 23.461 53.152 1.00 16.07 N ATOM 1593 CA SER B 4 -2.224 22.980 53.984 1.00 17.15 C ATOM 1594 C SER B 4 -2.078 21.554 53.378 1.00 17.29 C ATOM 1595 O SER B 4 -2.937 21.179 52.529 1.00 19.48 O ATOM 1596 CB SER B 4 -2.630 22.901 55.422 1.00 16.45 C ATOM 1597 OG SER B 4 -3.793 22.086 55.485 1.00 20.40 O ATOM 1598 HA SER B 4 -1.326 23.597 53.980 1.00 0.00 H ATOM 1599 HB2 SER B 4 -2.851 23.898 55.804 1.00 0.00 H ATOM 1600 HB3 SER B 4 -1.829 22.456 56.013 1.00 0.00 H ATOM 1601 HG SER B 4 -4.091 22.011 56.426 1.00 0.00 H ATOM 1602 H SER B 4 -4.302 23.483 53.523 1.00 0.00 H ATOM 1603 N LEU B 5 -1.210 20.598 53.690 1.00 14.63 N ATOM 1604 CA LEU B 5 -1.379 19.417 52.847 1.00 11.28 C ATOM 1605 C LEU B 5 -1.704 18.153 53.578 1.00 10.76 C ATOM 1606 O LEU B 5 -1.196 17.085 53.271 1.00 11.55 O ATOM 1607 CB LEU B 5 -0.110 19.419 52.019 1.00 9.73 C ATOM 1608 CG LEU B 5 0.133 20.628 51.070 1.00 9.86 C ATOM 1609 CD1 LEU B 5 1.659 20.718 50.883 1.00 10.48 C ATOM 1610 CD2 LEU B 5 -0.696 20.535 49.774 1.00 4.55 C ATOM 1611 HA LEU B 5 -2.269 19.460 52.219 1.00 0.00 H ATOM 1612 HB2 LEU B 5 0.731 19.374 52.711 1.00 0.00 H ATOM 1613 HB3 LEU B 5 -0.121 18.519 51.404 1.00 0.00 H ATOM 1614 HG LEU B 5 -0.225 21.566 51.494 1.00 0.00 H ATOM 1615 HD21 LEU B 5 -0.427 19.626 49.237 1.00 0.00 H ATOM 1616 HD22 LEU B 5 -1.757 20.511 50.024 1.00 0.00 H ATOM 1617 HD23 LEU B 5 -0.488 21.403 49.148 1.00 0.00 H ATOM 1618 HD11 LEU B 5 2.134 20.874 51.852 1.00 0.00 H ATOM 1619 HD12 LEU B 5 2.025 19.790 50.443 1.00 0.00 H ATOM 1620 HD13 LEU B 5 1.894 21.553 50.223 1.00 0.00 H ATOM 1621 H LEU B 5 -0.497 20.680 54.443 1.00 0.00 H ATOM 1622 N TRP B 6 -2.581 18.286 54.572 1.00 10.60 N ATOM 1623 CA TRP B 6 -2.958 17.135 55.361 1.00 11.07 C ATOM 1624 C TRP B 6 -3.833 16.210 54.531 1.00 10.10 C ATOM 1625 O TRP B 6 -3.949 15.030 54.811 1.00 9.87 O ATOM 1626 CB TRP B 6 -3.634 17.614 56.703 1.00 13.71 C ATOM 1627 CG TRP B 6 -5.026 18.187 56.598 1.00 18.40 C ATOM 1628 CD1 TRP B 6 -5.279 19.540 56.382 1.00 19.31 C ATOM 1629 CD2 TRP B 6 -6.177 17.416 56.634 1.00 21.62 C ATOM 1630 NE1 TRP B 6 -6.603 19.621 56.261 1.00 21.15 N ATOM 1631 CE2 TRP B 6 -7.169 18.386 56.398 1.00 21.49 C ATOM 1632 CE3 TRP B 6 -6.486 16.072 56.827 1.00 23.00 C ATOM 1633 CZ2 TRP B 6 -8.489 17.987 56.359 1.00 22.76 C ATOM 1634 CZ3 TRP B 6 -7.823 15.687 56.783 1.00 22.30 C ATOM 1635 CH2 TRP B 6 -8.802 16.634 56.557 1.00 21.93 C ATOM 1636 HA TRP B 6 -2.080 16.555 55.646 1.00 0.00 H ATOM 1637 HB2 TRP B 6 -3.680 16.756 57.374 1.00 0.00 H ATOM 1638 HB3 TRP B 6 -2.994 18.381 57.140 1.00 0.00 H ATOM 1639 HE1 TRP B 6 -7.131 20.500 56.087 1.00 0.00 H ATOM 1640 HD1 TRP B 6 -4.554 20.352 56.325 1.00 0.00 H ATOM 1641 HZ2 TRP B 6 -9.280 18.715 56.176 1.00 0.00 H ATOM 1642 HH2 TRP B 6 -9.846 16.322 56.532 1.00 0.00 H ATOM 1643 HZ3 TRP B 6 -8.096 14.642 56.926 1.00 0.00 H ATOM 1644 HE3 TRP B 6 -5.700 15.339 57.008 1.00 0.00 H ATOM 1645 H TRP B 6 -2.994 19.217 54.780 1.00 0.00 H ATOM 1646 N ARG B 7 -4.469 16.704 53.491 1.00 8.55 N ATOM 1647 CA ARG B 7 -5.289 15.869 52.640 1.00 9.92 C ATOM 1648 C ARG B 7 -4.882 16.295 51.198 1.00 9.46 C ATOM 1649 O ARG B 7 -4.178 17.278 51.017 1.00 5.44 O ATOM 1650 CB ARG B 7 -6.757 16.131 52.954 1.00 11.63 C ATOM 1651 CG ARG B 7 -7.081 17.577 52.702 1.00 18.17 C ATOM 1652 CD ARG B 7 -8.516 17.686 52.309 1.00 22.93 C ATOM 1653 NE ARG B 7 -9.349 17.549 53.495 1.00 29.20 N ATOM 1654 CZ ARG B 7 -10.486 18.247 53.664 1.00 30.91 C ATOM 1655 NH1 ARG B 7 -10.928 19.120 52.712 1.00 30.96 N ATOM 1656 NH2 ARG B 7 -11.153 18.085 54.841 1.00 32.36 N ATOM 1657 HA ARG B 7 -5.147 14.797 52.778 1.00 0.00 H ATOM 1658 HB2 ARG B 7 -7.381 15.504 52.318 1.00 0.00 H ATOM 1659 HB3 ARG B 7 -6.952 15.893 54.000 1.00 0.00 H ATOM 1660 HG2 ARG B 7 -6.904 18.156 53.608 1.00 0.00 H ATOM 1661 HG3 ARG B 7 -6.451 17.960 51.899 1.00 0.00 H ATOM 1662 HD2 ARG B 7 -8.761 16.897 51.598 1.00 0.00 H ATOM 1663 HD3 ARG B 7 -8.695 18.657 51.847 1.00 0.00 H ATOM 1664 HE ARG B 7 -9.054 16.886 54.240 1.00 0.00 H ATOM 1665 HH12 ARG B 7 -11.810 19.650 52.862 1.00 0.00 H ATOM 1666 HH11 ARG B 7 -10.383 19.255 51.837 1.00 0.00 H ATOM 1667 HH22 ARG B 7 -12.037 18.605 55.014 1.00 0.00 H ATOM 1668 HH21 ARG B 7 -10.778 17.441 55.567 1.00 0.00 H ATOM 1669 H ARG B 7 -4.381 17.718 53.275 1.00 0.00 H ATOM 1670 N ARG B 8 -5.180 15.544 50.148 1.00 9.76 N ATOM 1671 CA ARG B 8 -4.840 15.881 48.780 1.00 9.75 C ATOM 1672 C ARG B 8 -5.443 17.207 48.321 1.00 11.24 C ATOM 1673 O ARG B 8 -6.636 17.434 48.525 1.00 12.10 O ATOM 1674 CB ARG B 8 -5.334 14.825 47.861 1.00 10.18 C ATOM 1675 CG ARG B 8 -4.537 13.578 47.989 1.00 11.68 C ATOM 1676 CD ARG B 8 -5.276 12.604 47.141 1.00 9.73 C ATOM 1677 NE ARG B 8 -4.609 11.350 47.369 1.00 12.27 N ATOM 1678 CZ ARG B 8 -5.133 10.169 47.051 1.00 10.52 C ATOM 1679 NH1 ARG B 8 -6.333 10.067 46.485 1.00 9.39 N ATOM 1680 NH2 ARG B 8 -4.419 9.088 47.311 1.00 6.27 N ATOM 1681 HA ARG B 8 -3.754 15.966 48.753 1.00 0.00 H ATOM 1682 HB2 ARG B 8 -6.375 14.607 48.098 1.00 0.00 H ATOM 1683 HB3 ARG B 8 -5.265 15.187 46.835 1.00 0.00 H ATOM 1684 HG2 ARG B 8 -3.522 13.725 47.620 1.00 0.00 H ATOM 1685 HG3 ARG B 8 -4.501 13.243 49.026 1.00 0.00 H ATOM 1686 HD2 ARG B 8 -5.218 12.886 46.090 1.00 0.00 H ATOM 1687 HD3 ARG B 8 -6.322 12.545 47.443 1.00 0.00 H ATOM 1688 HE ARG B 8 -3.666 11.367 47.806 1.00 0.00 H ATOM 1689 HH12 ARG B 8 -6.718 9.131 46.247 1.00 0.00 H ATOM 1690 HH11 ARG B 8 -6.886 10.924 46.281 1.00 0.00 H ATOM 1691 HH22 ARG B 8 -4.796 8.147 47.077 1.00 0.00 H ATOM 1692 HH21 ARG B 8 -3.481 9.178 47.750 1.00 0.00 H ATOM 1693 H ARG B 8 -5.691 14.654 50.316 1.00 0.00 H ATOM 1694 N PRO B 9 -4.728 18.134 47.692 1.00 10.96 N ATOM 1695 CA PRO B 9 -5.312 19.403 47.301 1.00 10.02 C ATOM 1696 C PRO B 9 -6.080 19.174 46.001 1.00 10.11 C ATOM 1697 O PRO B 9 -5.531 19.295 44.912 1.00 10.77 O ATOM 1698 CB PRO B 9 -4.090 20.293 47.244 1.00 10.72 C ATOM 1699 CG PRO B 9 -2.994 19.361 46.751 1.00 12.06 C ATOM 1700 CD PRO B 9 -3.295 18.028 47.417 1.00 9.87 C ATOM 1701 HA PRO B 9 -6.056 19.862 47.952 1.00 0.00 H ATOM 1702 HD3 PRO B 9 -3.082 17.195 46.748 1.00 0.00 H ATOM 1703 HD2 PRO B 9 -2.724 17.908 48.338 1.00 0.00 H ATOM 1704 HG3 PRO B 9 -2.013 19.728 47.051 1.00 0.00 H ATOM 1705 HG2 PRO B 9 -3.029 19.266 45.666 1.00 0.00 H ATOM 1706 HB2 PRO B 9 -4.241 21.119 46.549 1.00 0.00 H ATOM 1707 HB3 PRO B 9 -3.850 20.689 48.231 1.00 0.00 H ATOM 1708 N VAL B 10 -7.286 18.630 46.150 1.00 9.91 N ATOM 1709 CA VAL B 10 -8.174 18.345 45.060 1.00 10.33 C ATOM 1710 C VAL B 10 -9.172 19.485 45.044 1.00 12.37 C ATOM 1711 O VAL B 10 -9.674 19.953 46.061 1.00 14.42 O ATOM 1712 CB VAL B 10 -8.868 17.036 45.258 1.00 8.52 C ATOM 1713 CG1 VAL B 10 -9.988 16.753 44.277 1.00 6.29 C ATOM 1714 CG2 VAL B 10 -7.802 16.024 44.977 1.00 7.14 C ATOM 1715 HA VAL B 10 -7.635 18.264 44.116 1.00 0.00 H ATOM 1716 HB VAL B 10 -9.317 17.023 46.251 1.00 0.00 H ATOM 1717 HG11 VAL B 10 -10.749 17.528 44.363 1.00 0.00 H ATOM 1718 HG12 VAL B 10 -9.588 16.746 43.263 1.00 0.00 H ATOM 1719 HG13 VAL B 10 -10.429 15.782 44.502 1.00 0.00 H ATOM 1720 HG21 VAL B 10 -7.442 16.151 43.956 1.00 0.00 H ATOM 1721 HG22 VAL B 10 -6.976 16.164 45.675 1.00 0.00 H ATOM 1722 HG23 VAL B 10 -8.214 15.022 45.096 1.00 0.00 H ATOM 1723 H VAL B 10 -7.603 18.398 47.113 1.00 0.00 H ATOM 1724 N VAL B 11 -9.492 19.931 43.845 1.00 13.61 N ATOM 1725 CA VAL B 11 -10.389 21.032 43.607 1.00 13.63 C ATOM 1726 C VAL B 11 -11.194 20.671 42.383 1.00 15.25 C ATOM 1727 O VAL B 11 -10.825 19.761 41.640 1.00 13.73 O ATOM 1728 CB VAL B 11 -9.414 22.236 43.469 1.00 12.33 C ATOM 1729 CG1 VAL B 11 -9.345 22.853 42.085 1.00 10.61 C ATOM 1730 CG2 VAL B 11 -9.803 23.139 44.593 1.00 14.26 C ATOM 1731 HA VAL B 11 -11.132 21.270 44.369 1.00 0.00 H ATOM 1732 HB VAL B 11 -8.368 21.941 43.557 1.00 0.00 H ATOM 1733 HG11 VAL B 11 -9.014 22.100 41.369 1.00 0.00 H ATOM 1734 HG12 VAL B 11 -10.332 23.217 41.801 1.00 0.00 H ATOM 1735 HG13 VAL B 11 -8.639 23.683 42.093 1.00 0.00 H ATOM 1736 HG21 VAL B 11 -10.845 23.436 44.475 1.00 0.00 H ATOM 1737 HG22 VAL B 11 -9.679 22.613 45.540 1.00 0.00 H ATOM 1738 HG23 VAL B 11 -9.168 24.025 44.582 1.00 0.00 H ATOM 1739 H VAL B 11 -9.070 19.458 43.020 1.00 0.00 H ATOM 1740 N THR B 12 -12.277 21.421 42.216 1.00 16.39 N ATOM 1741 CA THR B 12 -13.210 21.276 41.113 1.00 16.11 C ATOM 1742 C THR B 12 -12.898 22.290 40.008 1.00 15.42 C ATOM 1743 O THR B 12 -12.695 23.482 40.251 1.00 13.55 O ATOM 1744 CB THR B 12 -14.626 21.478 41.665 1.00 17.88 C ATOM 1745 OG1 THR B 12 -14.530 21.755 43.095 1.00 21.81 O ATOM 1746 CG2 THR B 12 -15.494 20.258 41.333 1.00 18.60 C ATOM 1747 HA THR B 12 -13.124 20.284 40.671 1.00 0.00 H ATOM 1748 HB THR B 12 -15.116 22.332 41.198 1.00 0.00 H ATOM 1749 HG1 THR B 12 -15.438 21.888 43.466 1.00 0.00 H ATOM 1750 HG23 THR B 12 -15.519 20.114 40.253 1.00 0.00 H ATOM 1751 HG21 THR B 12 -15.072 19.373 41.809 1.00 0.00 H ATOM 1752 HG22 THR B 12 -16.506 20.423 41.702 1.00 0.00 H ATOM 1753 H THR B 12 -12.469 22.161 42.921 1.00 0.00 H ATOM 1754 N ALA B 13 -12.845 21.840 38.761 1.00 15.14 N ATOM 1755 CA ALA B 13 -12.548 22.724 37.648 1.00 14.16 C ATOM 1756 C ALA B 13 -13.532 22.513 36.524 1.00 13.58 C ATOM 1757 O ALA B 13 -14.207 21.481 36.471 1.00 12.30 O ATOM 1758 CB ALA B 13 -11.171 22.410 37.108 1.00 13.65 C ATOM 1759 HA ALA B 13 -12.606 23.751 38.008 1.00 0.00 H ATOM 1760 HB1 ALA B 13 -10.431 22.555 37.895 1.00 0.00 H ATOM 1761 HB2 ALA B 13 -11.143 21.375 36.768 1.00 0.00 H ATOM 1762 HB3 ALA B 13 -10.950 23.074 36.273 1.00 0.00 H ATOM 1763 H ALA B 13 -13.020 20.832 38.577 1.00 0.00 H ATOM 1764 N HIS B 14 -13.698 23.503 35.665 1.00 14.44 N ATOM 1765 CA HIS B 14 -14.608 23.373 34.523 1.00 14.09 C ATOM 1766 C HIS B 14 -13.654 23.631 33.383 1.00 12.84 C ATOM 1767 O HIS B 14 -13.016 24.682 33.389 1.00 11.95 O ATOM 1768 CB HIS B 14 -15.714 24.424 34.494 1.00 14.62 C ATOM 1769 CG HIS B 14 -16.721 24.121 35.587 1.00 16.23 C ATOM 1770 ND1 HIS B 14 -16.483 24.042 36.896 1.00 15.43 N ATOM 1771 CD2 HIS B 14 -18.046 23.826 35.364 1.00 17.66 C ATOM 1772 CE1 HIS B 14 -17.598 23.704 37.470 1.00 14.97 C ATOM 1773 NE2 HIS B 14 -18.525 23.581 36.546 1.00 15.61 N ATOM 1774 HA HIS B 14 -15.138 22.421 34.519 1.00 0.00 H ATOM 1775 HB2 HIS B 14 -15.283 25.411 34.659 1.00 0.00 H ATOM 1776 HB3 HIS B 14 -16.211 24.403 33.524 1.00 0.00 H ATOM 1777 HD2 HIS B 14 -18.574 23.803 34.411 1.00 0.00 H ATOM 1778 HE1 HIS B 14 -17.741 23.548 38.539 1.00 0.00 H ATOM 1779 H HIS B 14 -13.174 24.391 35.801 1.00 0.00 H ATOM 1780 N ILE B 15 -13.499 22.629 32.508 1.00 11.66 N ATOM 1781 CA ILE B 15 -12.624 22.655 31.330 1.00 10.88 C ATOM 1782 C ILE B 15 -13.616 22.696 30.188 1.00 10.96 C ATOM 1783 O ILE B 15 -14.270 21.685 29.893 1.00 10.67 O ATOM 1784 CB ILE B 15 -11.704 21.342 31.217 1.00 9.25 C ATOM 1785 CG1 ILE B 15 -10.845 21.172 32.491 1.00 5.98 C ATOM 1786 CG2 ILE B 15 -10.867 21.417 29.923 1.00 4.75 C ATOM 1787 CD1 ILE B 15 -9.846 20.010 32.460 1.00 5.60 C ATOM 1788 HA ILE B 15 -11.922 23.489 31.353 1.00 0.00 H ATOM 1789 HB ILE B 15 -12.325 20.449 31.151 1.00 0.00 H ATOM 1790 HG12 ILE B 15 -10.284 22.094 32.644 1.00 0.00 H ATOM 1791 HG13 ILE B 15 -11.519 21.014 33.333 1.00 0.00 H ATOM 1792 HD11 ILE B 15 -10.385 19.073 32.323 1.00 0.00 H ATOM 1793 HD12 ILE B 15 -9.149 20.154 31.634 1.00 0.00 H ATOM 1794 HD13 ILE B 15 -9.296 19.980 33.400 1.00 0.00 H ATOM 1795 HG21 ILE B 15 -11.534 21.471 29.063 1.00 0.00 H ATOM 1796 HG22 ILE B 15 -10.235 22.305 29.951 1.00 0.00 H ATOM 1797 HG23 ILE B 15 -10.242 20.527 29.844 1.00 0.00 H ATOM 1798 H ILE B 15 -14.044 21.760 32.677 1.00 0.00 H ATOM 1799 N GLU B 16 -13.760 23.883 29.582 1.00 10.98 N ATOM 1800 CA GLU B 16 -14.676 24.111 28.475 1.00 11.27 C ATOM 1801 C GLU B 16 -16.091 23.671 28.846 1.00 11.97 C ATOM 1802 O GLU B 16 -16.773 22.860 28.205 1.00 12.23 O ATOM 1803 CB GLU B 16 -14.190 23.358 27.235 1.00 11.43 C ATOM 1804 CG GLU B 16 -12.828 23.830 26.782 1.00 12.75 C ATOM 1805 CD GLU B 16 -12.791 25.205 26.139 1.00 15.70 C ATOM 1806 OE1 GLU B 16 -13.797 25.921 26.139 1.00 16.67 O ATOM 1807 OE2 GLU B 16 -11.741 25.575 25.614 1.00 17.54 O ATOM 1808 HA GLU B 16 -14.700 25.178 28.255 1.00 0.00 H ATOM 1809 HB2 GLU B 16 -14.134 22.295 27.468 1.00 0.00 H ATOM 1810 HB3 GLU B 16 -14.904 23.514 26.426 1.00 0.00 H ATOM 1811 HG2 GLU B 16 -12.172 23.849 27.653 1.00 0.00 H ATOM 1812 HG3 GLU B 16 -12.447 23.110 26.057 1.00 0.00 H ATOM 1813 H GLU B 16 -13.187 24.682 29.921 1.00 0.00 H ATOM 1814 N GLY B 17 -16.446 24.143 30.046 1.00 11.79 N ATOM 1815 CA GLY B 17 -17.760 23.895 30.592 1.00 12.33 C ATOM 1816 C GLY B 17 -17.862 22.633 31.407 1.00 13.18 C ATOM 1817 O GLY B 17 -18.607 22.613 32.403 1.00 15.43 O ATOM 1818 HA3 GLY B 17 -18.467 23.826 29.765 1.00 0.00 H ATOM 1819 HA2 GLY B 17 -18.030 24.737 31.230 1.00 0.00 H ATOM 1820 H GLY B 17 -15.762 24.700 30.597 1.00 0.00 H ATOM 1821 N GLN B 18 -17.061 21.626 31.051 1.00 12.65 N ATOM 1822 CA GLN B 18 -17.061 20.283 31.646 1.00 10.43 C ATOM 1823 C GLN B 18 -16.469 20.186 33.042 1.00 10.02 C ATOM 1824 O GLN B 18 -15.336 20.628 33.203 1.00 11.20 O ATOM 1825 CB GLN B 18 -16.313 19.389 30.695 1.00 10.08 C ATOM 1826 CG GLN B 18 -16.882 19.479 29.290 1.00 11.23 C ATOM 1827 CD GLN B 18 -16.119 18.729 28.215 1.00 14.28 C ATOM 1828 OE1 GLN B 18 -16.288 17.516 28.054 1.00 16.92 O ATOM 1829 NE2 GLN B 18 -15.262 19.405 27.452 1.00 14.62 N ATOM 1830 HA GLN B 18 -18.100 19.983 31.785 1.00 0.00 H ATOM 1831 HB2 GLN B 18 -15.265 19.690 30.674 1.00 0.00 H ATOM 1832 HB3 GLN B 18 -16.387 18.359 31.043 1.00 0.00 H ATOM 1833 HG2 GLN B 18 -17.898 19.085 29.315 1.00 0.00 H ATOM 1834 HG3 GLN B 18 -16.909 20.531 29.008 1.00 0.00 H ATOM 1835 HE22 GLN B 18 -15.129 20.426 27.598 1.00 0.00 H ATOM 1836 HE21 GLN B 18 -14.726 18.912 26.710 1.00 0.00 H ATOM 1837 H GLN B 18 -16.379 21.808 30.287 1.00 0.00 H ATOM 1838 N PRO B 19 -17.129 19.723 34.104 1.00 11.19 N ATOM 1839 CA PRO B 19 -16.547 19.620 35.437 1.00 11.10 C ATOM 1840 C PRO B 19 -15.729 18.359 35.613 1.00 14.06 C ATOM 1841 O PRO B 19 -16.009 17.288 35.028 1.00 15.70 O ATOM 1842 CB PRO B 19 -17.694 19.692 36.360 1.00 10.47 C ATOM 1843 CG PRO B 19 -18.715 18.904 35.601 1.00 10.60 C ATOM 1844 CD PRO B 19 -18.552 19.448 34.167 1.00 12.97 C ATOM 1845 HA PRO B 19 -15.833 20.421 35.630 1.00 0.00 H ATOM 1846 HD3 PRO B 19 -18.844 18.704 33.426 1.00 0.00 H ATOM 1847 HD2 PRO B 19 -19.137 20.356 34.019 1.00 0.00 H ATOM 1848 HG3 PRO B 19 -19.719 19.089 35.982 1.00 0.00 H ATOM 1849 HG2 PRO B 19 -18.502 17.836 35.645 1.00 0.00 H ATOM 1850 HB2 PRO B 19 -17.465 19.232 37.321 1.00 0.00 H ATOM 1851 HB3 PRO B 19 -18.018 20.721 36.519 1.00 0.00 H ATOM 1852 N VAL B 20 -14.659 18.529 36.404 1.00 14.71 N ATOM 1853 CA VAL B 20 -13.716 17.462 36.717 1.00 12.94 C ATOM 1854 C VAL B 20 -12.968 17.778 38.022 1.00 13.46 C ATOM 1855 O VAL B 20 -12.698 18.937 38.370 1.00 14.69 O ATOM 1856 CB VAL B 20 -12.821 17.331 35.415 1.00 11.66 C ATOM 1857 CG1 VAL B 20 -12.269 18.663 34.976 1.00 14.05 C ATOM 1858 CG2 VAL B 20 -11.584 16.533 35.669 1.00 15.36 C ATOM 1859 HA VAL B 20 -14.173 16.495 36.928 1.00 0.00 H ATOM 1860 HB VAL B 20 -13.484 16.876 34.679 1.00 0.00 H ATOM 1861 HG11 VAL B 20 -13.093 19.342 34.758 1.00 0.00 H ATOM 1862 HG12 VAL B 20 -11.654 19.081 35.773 1.00 0.00 H ATOM 1863 HG13 VAL B 20 -11.662 18.526 34.081 1.00 0.00 H ATOM 1864 HG21 VAL B 20 -10.992 17.020 36.444 1.00 0.00 H ATOM 1865 HG22 VAL B 20 -11.861 15.531 35.997 1.00 0.00 H ATOM 1866 HG23 VAL B 20 -11.000 16.468 34.751 1.00 0.00 H ATOM 1867 H VAL B 20 -14.494 19.470 36.815 1.00 0.00 H ATOM 1868 N GLU B 21 -12.770 16.723 38.807 1.00 13.81 N ATOM 1869 CA GLU B 21 -12.065 16.731 40.104 1.00 13.99 C ATOM 1870 C GLU B 21 -10.587 16.833 39.682 1.00 12.56 C ATOM 1871 O GLU B 21 -10.089 15.985 38.915 1.00 12.93 O ATOM 1872 CB GLU B 21 -12.265 15.399 40.857 1.00 17.46 C ATOM 1873 CG GLU B 21 -13.670 14.767 40.994 1.00 22.40 C ATOM 1874 CD GLU B 21 -13.913 13.278 40.533 1.00 27.49 C ATOM 1875 OE1 GLU B 21 -12.986 12.504 40.160 1.00 27.47 O ATOM 1876 OE2 GLU B 21 -15.106 12.887 40.525 1.00 29.88 O ATOM 1877 HA GLU B 21 -12.414 17.526 40.763 1.00 0.00 H ATOM 1878 HB2 GLU B 21 -11.640 14.661 40.354 1.00 0.00 H ATOM 1879 HB3 GLU B 21 -11.895 15.556 41.870 1.00 0.00 H ATOM 1880 HG2 GLU B 21 -13.937 14.817 42.050 1.00 0.00 H ATOM 1881 HG3 GLU B 21 -14.354 15.391 40.418 1.00 0.00 H ATOM 1882 H GLU B 21 -13.145 15.811 38.478 1.00 0.00 H ATOM 1883 N VAL B 22 -9.787 17.748 40.196 1.00 11.69 N ATOM 1884 CA VAL B 22 -8.406 17.891 39.782 1.00 9.16 C ATOM 1885 C VAL B 22 -7.462 18.073 40.963 1.00 9.03 C ATOM 1886 O VAL B 22 -7.829 18.699 41.951 1.00 7.98 O ATOM 1887 CB VAL B 22 -8.574 19.063 38.754 1.00 9.89 C ATOM 1888 CG1 VAL B 22 -7.916 20.355 39.216 1.00 10.98 C ATOM 1889 CG2 VAL B 22 -8.171 18.496 37.417 1.00 8.12 C ATOM 1890 HA VAL B 22 -7.913 17.031 39.328 1.00 0.00 H ATOM 1891 HB VAL B 22 -9.602 19.413 38.662 1.00 0.00 H ATOM 1892 HG11 VAL B 22 -8.363 20.672 40.158 1.00 0.00 H ATOM 1893 HG12 VAL B 22 -6.848 20.187 39.357 1.00 0.00 H ATOM 1894 HG13 VAL B 22 -8.067 21.128 38.462 1.00 0.00 H ATOM 1895 HG21 VAL B 22 -7.136 18.156 37.465 1.00 0.00 H ATOM 1896 HG22 VAL B 22 -8.820 17.656 37.170 1.00 0.00 H ATOM 1897 HG23 VAL B 22 -8.266 19.268 36.653 1.00 0.00 H ATOM 1898 H VAL B 22 -10.161 18.389 40.924 1.00 0.00 H ATOM 1899 N LEU B 23 -6.271 17.502 40.875 1.00 7.21 N ATOM 1900 CA LEU B 23 -5.269 17.579 41.898 1.00 6.33 C ATOM 1901 C LEU B 23 -4.285 18.690 41.562 1.00 8.17 C ATOM 1902 O LEU B 23 -3.708 18.653 40.467 1.00 9.05 O ATOM 1903 CB LEU B 23 -4.547 16.262 41.938 1.00 5.30 C ATOM 1904 CG LEU B 23 -3.948 15.574 43.137 1.00 3.94 C ATOM 1905 CD1 LEU B 23 -2.817 14.742 42.644 1.00 2.96 C ATOM 1906 CD2 LEU B 23 -3.401 16.523 44.137 1.00 5.12 C ATOM 1907 HA LEU B 23 -5.725 17.792 42.865 1.00 0.00 H ATOM 1908 HB2 LEU B 23 -5.259 15.543 41.533 1.00 0.00 H ATOM 1909 HB3 LEU B 23 -3.716 16.380 41.242 1.00 0.00 H ATOM 1910 HG LEU B 23 -4.734 14.996 43.624 1.00 0.00 H ATOM 1911 HD21 LEU B 23 -2.619 17.125 43.675 1.00 0.00 H ATOM 1912 HD22 LEU B 23 -4.199 17.174 44.493 1.00 0.00 H ATOM 1913 HD23 LEU B 23 -2.984 15.965 44.976 1.00 0.00 H ATOM 1914 HD11 LEU B 23 -3.191 14.011 41.927 1.00 0.00 H ATOM 1915 HD12 LEU B 23 -2.080 15.383 42.160 1.00 0.00 H ATOM 1916 HD13 LEU B 23 -2.354 14.225 43.485 1.00 0.00 H ATOM 1917 H LEU B 23 -6.049 16.965 40.012 1.00 0.00 H ATOM 1918 N LEU B 24 -4.049 19.688 42.425 1.00 9.21 N ATOM 1919 CA LEU B 24 -3.099 20.755 42.130 1.00 9.37 C ATOM 1920 C LEU B 24 -1.760 20.107 42.478 1.00 9.62 C ATOM 1921 O LEU B 24 -1.405 19.795 43.635 1.00 7.03 O ATOM 1922 CB LEU B 24 -3.375 22.019 42.994 1.00 10.06 C ATOM 1923 CG LEU B 24 -4.586 23.034 42.746 1.00 10.37 C ATOM 1924 CD1 LEU B 24 -5.452 22.672 41.574 1.00 9.25 C ATOM 1925 CD2 LEU B 24 -5.445 23.053 43.979 1.00 8.82 C ATOM 1926 HA LEU B 24 -3.149 21.113 41.102 1.00 0.00 H ATOM 1927 HB2 LEU B 24 -3.499 21.656 44.014 1.00 0.00 H ATOM 1928 HB3 LEU B 24 -2.469 22.621 42.932 1.00 0.00 H ATOM 1929 HG LEU B 24 -4.145 24.006 42.526 1.00 0.00 H ATOM 1930 HD21 LEU B 24 -5.829 22.051 44.168 1.00 0.00 H ATOM 1931 HD22 LEU B 24 -4.849 23.382 44.830 1.00 0.00 H ATOM 1932 HD23 LEU B 24 -6.278 23.740 43.830 1.00 0.00 H ATOM 1933 HD11 LEU B 24 -4.848 22.661 40.667 1.00 0.00 H ATOM 1934 HD12 LEU B 24 -5.885 21.685 41.735 1.00 0.00 H ATOM 1935 HD13 LEU B 24 -6.250 23.408 41.472 1.00 0.00 H ATOM 1936 H LEU B 24 -4.558 19.702 43.332 1.00 0.00 H ATOM 1937 N ASP B 25 -1.001 19.956 41.395 1.00 8.96 N ATOM 1938 CA ASP B 25 0.286 19.325 41.455 1.00 9.03 C ATOM 1939 C ASP B 25 1.610 20.023 41.111 1.00 9.89 C ATOM 1940 O ASP B 25 2.027 20.081 39.947 1.00 9.79 O ATOM 1941 CB ASP B 25 0.033 18.051 40.632 1.00 7.42 C ATOM 1942 CG ASP B 25 1.012 16.903 40.758 1.00 9.67 C ATOM 1943 OD1 ASP B 25 2.127 17.084 41.213 1.00 11.72 O ATOM 1944 OD2 ASP B 25 0.652 15.796 40.386 1.00 10.94 O ATOM 1945 HA ASP B 25 0.549 19.238 42.509 1.00 0.00 H ATOM 1946 HB2 ASP B 25 -0.947 17.671 40.920 1.00 0.00 H ATOM 1947 HB3 ASP B 25 0.014 18.344 39.582 1.00 0.00 H ATOM 1948 H ASP B 25 -1.351 20.305 40.480 1.00 0.00 H ATOM 1949 N THR B 26 2.378 20.381 42.157 1.00 8.85 N ATOM 1950 CA THR B 26 3.654 21.044 41.957 1.00 8.87 C ATOM 1951 C THR B 26 4.705 20.114 41.383 1.00 7.21 C ATOM 1952 O THR B 26 5.684 20.601 40.851 1.00 7.60 O ATOM 1953 CB THR B 26 4.156 21.679 43.301 1.00 11.26 C ATOM 1954 OG1 THR B 26 4.265 20.700 44.325 1.00 9.79 O ATOM 1955 CG2 THR B 26 3.174 22.766 43.734 1.00 10.70 C ATOM 1956 HA THR B 26 3.494 21.835 41.225 1.00 0.00 H ATOM 1957 HB THR B 26 5.145 22.106 43.136 1.00 0.00 H ATOM 1958 HG1 THR B 26 4.909 20.002 44.046 1.00 0.00 H ATOM 1959 HG23 THR B 26 3.093 23.515 42.946 1.00 0.00 H ATOM 1960 HG21 THR B 26 2.196 22.319 43.915 1.00 0.00 H ATOM 1961 HG22 THR B 26 3.535 23.236 44.649 1.00 0.00 H ATOM 1962 H THR B 26 2.052 20.179 43.124 1.00 0.00 H ATOM 1963 N GLY B 27 4.539 18.794 41.443 1.00 5.25 N ATOM 1964 CA GLY B 27 5.465 17.886 40.810 1.00 5.06 C ATOM 1965 C GLY B 27 5.089 17.542 39.356 1.00 5.14 C ATOM 1966 O GLY B 27 5.574 16.572 38.759 1.00 2.02 O ATOM 1967 HA3 GLY B 27 5.493 16.962 41.388 1.00 0.00 H ATOM 1968 HA2 GLY B 27 6.454 18.344 40.812 1.00 0.00 H ATOM 1969 H GLY B 27 3.722 18.408 41.958 1.00 0.00 H ATOM 1970 N ALA B 28 4.170 18.287 38.773 1.00 4.88 N ATOM 1971 CA ALA B 28 3.776 18.041 37.420 1.00 5.86 C ATOM 1972 C ALA B 28 4.025 19.308 36.646 1.00 6.64 C ATOM 1973 O ALA B 28 3.647 20.406 37.044 1.00 7.93 O ATOM 1974 CB ALA B 28 2.306 17.704 37.311 1.00 5.88 C ATOM 1975 HA ALA B 28 4.345 17.195 37.035 1.00 0.00 H ATOM 1976 HB1 ALA B 28 2.095 16.809 37.896 1.00 0.00 H ATOM 1977 HB2 ALA B 28 1.714 18.536 37.693 1.00 0.00 H ATOM 1978 HB3 ALA B 28 2.052 17.525 36.266 1.00 0.00 H ATOM 1979 H ALA B 28 3.726 19.063 39.304 1.00 0.00 H ATOM 1980 N ASP B 29 4.753 19.135 35.557 1.00 7.58 N ATOM 1981 CA ASP B 29 5.078 20.219 34.682 1.00 8.42 C ATOM 1982 C ASP B 29 3.915 20.437 33.759 1.00 8.23 C ATOM 1983 O ASP B 29 3.707 21.567 33.391 1.00 11.46 O ATOM 1984 CB ASP B 29 6.200 19.959 33.744 1.00 9.94 C ATOM 1985 CG ASP B 29 7.426 19.322 34.334 1.00 9.83 C ATOM 1986 OD1 ASP B 29 8.172 19.984 35.038 1.00 8.99 O ATOM 1987 OD2 ASP B 29 7.643 18.161 34.047 1.00 10.24 O ATOM 1988 HA ASP B 29 5.336 21.043 35.347 1.00 0.00 H ATOM 1989 HB2 ASP B 29 5.830 19.302 32.957 1.00 0.00 H ATOM 1990 HB3 ASP B 29 6.498 20.913 33.309 1.00 0.00 H ATOM 1991 H ASP B 29 5.100 18.182 35.329 1.00 0.00 H ATOM 1992 N ASP B 30 3.144 19.408 33.431 1.00 9.88 N ATOM 1993 CA ASP B 30 1.994 19.383 32.528 1.00 10.00 C ATOM 1994 C ASP B 30 0.701 19.062 33.244 1.00 11.50 C ATOM 1995 O ASP B 30 0.755 18.520 34.352 1.00 13.93 O ATOM 1996 CB ASP B 30 2.228 18.297 31.456 1.00 9.57 C ATOM 1997 CG ASP B 30 3.618 18.343 30.823 1.00 12.21 C ATOM 1998 OD1 ASP B 30 4.081 19.436 30.518 1.00 15.07 O ATOM 1999 OD2 ASP B 30 4.278 17.320 30.652 1.00 14.43 O ATOM 2000 HA ASP B 30 1.902 20.377 32.090 1.00 0.00 H ATOM 2001 HB2 ASP B 30 2.094 17.320 31.921 1.00 0.00 H ATOM 2002 HB3 ASP B 30 1.487 18.427 30.667 1.00 0.00 H ATOM 2003 H ASP B 30 3.390 18.500 33.874 1.00 0.00 H ATOM 2004 N SER B 31 -0.440 19.346 32.609 1.00 10.12 N ATOM 2005 CA SER B 31 -1.762 19.080 33.156 1.00 10.13 C ATOM 2006 C SER B 31 -2.377 17.923 32.384 1.00 10.38 C ATOM 2007 O SER B 31 -2.479 18.054 31.173 1.00 10.64 O ATOM 2008 CB SER B 31 -2.608 20.313 33.032 1.00 8.92 C ATOM 2009 OG SER B 31 -1.885 21.270 33.769 1.00 7.47 O ATOM 2010 HA SER B 31 -1.697 18.814 34.211 1.00 0.00 H ATOM 2011 HB2 SER B 31 -3.598 20.154 33.461 1.00 0.00 H ATOM 2012 HB3 SER B 31 -2.709 20.616 31.990 1.00 0.00 H ATOM 2013 HG SER B 31 -0.987 21.383 33.369 1.00 0.00 H ATOM 2014 H SER B 31 -0.380 19.783 31.667 1.00 0.00 H ATOM 2015 N ILE B 32 -2.834 16.819 32.972 1.00 10.50 N ATOM 2016 CA ILE B 32 -3.389 15.694 32.215 1.00 11.92 C ATOM 2017 C ILE B 32 -4.663 15.389 32.909 1.00 11.15 C ATOM 2018 O ILE B 32 -4.717 15.157 34.118 1.00 11.58 O ATOM 2019 CB ILE B 32 -2.547 14.337 32.231 1.00 12.93 C ATOM 2020 CG1 ILE B 32 -1.101 14.643 32.140 1.00 15.23 C ATOM 2021 CG2 ILE B 32 -2.828 13.438 31.032 1.00 12.31 C ATOM 2022 CD1 ILE B 32 -0.639 14.895 33.586 1.00 20.31 C ATOM 2023 HA ILE B 32 -3.438 15.996 31.169 1.00 0.00 H ATOM 2024 HB ILE B 32 -2.832 13.834 33.155 1.00 0.00 H ATOM 2025 HG12 ILE B 32 -0.560 13.801 31.709 1.00 0.00 H ATOM 2026 HG13 ILE B 32 -0.937 15.530 31.528 1.00 0.00 H ATOM 2027 HD11 ILE B 32 -1.197 15.733 34.004 1.00 0.00 H ATOM 2028 HD12 ILE B 32 -0.820 14.002 34.185 1.00 0.00 H ATOM 2029 HD13 ILE B 32 0.426 15.128 33.590 1.00 0.00 H ATOM 2030 HG21 ILE B 32 -3.884 13.169 31.021 1.00 0.00 H ATOM 2031 HG22 ILE B 32 -2.577 13.970 30.114 1.00 0.00 H ATOM 2032 HG23 ILE B 32 -2.223 12.535 31.107 1.00 0.00 H ATOM 2033 H ILE B 32 -2.795 16.753 34.009 1.00 0.00 H ATOM 2034 N VAL B 33 -5.639 15.204 32.076 1.00 10.55 N ATOM 2035 CA VAL B 33 -6.939 14.935 32.587 1.00 12.56 C ATOM 2036 C VAL B 33 -7.591 13.835 31.774 1.00 12.13 C ATOM 2037 O VAL B 33 -7.011 13.426 30.763 1.00 11.23 O ATOM 2038 CB VAL B 33 -7.567 16.385 32.514 1.00 14.58 C ATOM 2039 CG1 VAL B 33 -8.383 16.574 31.226 1.00 14.25 C ATOM 2040 CG2 VAL B 33 -8.335 16.634 33.785 1.00 16.15 C ATOM 2041 HA VAL B 33 -7.032 14.529 33.594 1.00 0.00 H ATOM 2042 HB VAL B 33 -6.788 17.145 32.451 1.00 0.00 H ATOM 2043 HG11 VAL B 33 -7.734 16.432 30.362 1.00 0.00 H ATOM 2044 HG12 VAL B 33 -9.191 15.843 31.199 1.00 0.00 H ATOM 2045 HG13 VAL B 33 -8.801 17.580 31.207 1.00 0.00 H ATOM 2046 HG21 VAL B 33 -9.125 15.889 33.883 1.00 0.00 H ATOM 2047 HG22 VAL B 33 -7.659 16.562 34.637 1.00 0.00 H ATOM 2048 HG23 VAL B 33 -8.776 17.630 33.752 1.00 0.00 H ATOM 2049 H VAL B 33 -5.474 15.252 31.050 1.00 0.00 H ATOM 2050 N THR B 34 -8.754 13.331 32.192 1.00 12.02 N ATOM 2051 CA THR B 34 -9.426 12.309 31.433 1.00 13.00 C ATOM 2052 C THR B 34 -10.914 12.440 31.698 1.00 13.54 C ATOM 2053 O THR B 34 -11.368 13.063 32.649 1.00 12.51 O ATOM 2054 CB THR B 34 -8.888 10.841 31.775 1.00 14.46 C ATOM 2055 OG1 THR B 34 -9.407 10.176 30.636 1.00 17.37 O ATOM 2056 CG2 THR B 34 -9.395 9.986 32.912 1.00 9.55 C ATOM 2057 HA THR B 34 -9.220 12.449 30.372 1.00 0.00 H ATOM 2058 HB THR B 34 -7.838 10.960 32.042 1.00 0.00 H ATOM 2059 HG1 THR B 34 -9.164 9.217 30.676 1.00 0.00 H ATOM 2060 HG23 THR B 34 -9.054 10.404 33.859 1.00 0.00 H ATOM 2061 HG21 THR B 34 -10.485 9.967 32.893 1.00 0.00 H ATOM 2062 HG22 THR B 34 -9.011 8.972 32.802 1.00 0.00 H ATOM 2063 H THR B 34 -9.179 13.680 33.075 1.00 0.00 H ATOM 2064 N GLY B 35 -11.662 11.904 30.731 1.00 15.36 N ATOM 2065 CA GLY B 35 -13.117 11.939 30.718 1.00 15.79 C ATOM 2066 C GLY B 35 -13.729 13.289 30.326 1.00 17.07 C ATOM 2067 O GLY B 35 -14.845 13.582 30.767 1.00 18.87 O ATOM 2068 HA3 GLY B 35 -13.471 11.684 31.717 1.00 0.00 H ATOM 2069 HA2 GLY B 35 -13.467 11.190 30.008 1.00 0.00 H ATOM 2070 H GLY B 35 -11.177 11.434 29.940 1.00 0.00 H ATOM 2071 N ILE B 36 -13.092 14.102 29.473 1.00 17.25 N ATOM 2072 CA ILE B 36 -13.559 15.448 29.099 1.00 17.78 C ATOM 2073 C ILE B 36 -13.497 15.456 27.565 1.00 18.14 C ATOM 2074 O ILE B 36 -12.554 14.829 27.059 1.00 18.86 O ATOM 2075 CB ILE B 36 -12.571 16.431 29.843 1.00 17.51 C ATOM 2076 CG1 ILE B 36 -13.380 17.275 30.803 1.00 17.37 C ATOM 2077 CG2 ILE B 36 -11.847 17.385 28.945 1.00 18.16 C ATOM 2078 CD1 ILE B 36 -13.718 16.622 32.143 1.00 17.44 C ATOM 2079 HA ILE B 36 -14.570 15.743 29.381 1.00 0.00 H ATOM 2080 HB ILE B 36 -11.825 15.799 30.324 1.00 0.00 H ATOM 2081 HG12 ILE B 36 -12.814 18.184 31.007 1.00 0.00 H ATOM 2082 HG13 ILE B 36 -14.318 17.535 30.312 1.00 0.00 H ATOM 2083 HD11 ILE B 36 -14.300 15.717 31.968 1.00 0.00 H ATOM 2084 HD12 ILE B 36 -12.795 16.367 32.665 1.00 0.00 H ATOM 2085 HD13 ILE B 36 -14.299 17.318 32.749 1.00 0.00 H ATOM 2086 HG21 ILE B 36 -11.252 16.824 28.225 1.00 0.00 H ATOM 2087 HG22 ILE B 36 -12.571 18.005 28.416 1.00 0.00 H ATOM 2088 HG23 ILE B 36 -11.192 18.019 29.543 1.00 0.00 H ATOM 2089 H ILE B 36 -12.208 13.760 29.046 1.00 0.00 H ATOM 2090 N GLU B 37 -14.408 15.998 26.744 1.00 18.75 N ATOM 2091 CA GLU B 37 -14.255 15.954 25.288 1.00 19.28 C ATOM 2092 C GLU B 37 -13.580 17.223 24.811 1.00 18.70 C ATOM 2093 O GLU B 37 -13.889 18.312 25.313 1.00 17.49 O ATOM 2094 CB GLU B 37 -15.594 15.861 24.552 1.00 23.94 C ATOM 2095 CG GLU B 37 -16.438 14.568 24.727 1.00 28.86 C ATOM 2096 CD GLU B 37 -17.799 14.757 25.466 1.00 32.82 C ATOM 2097 OE1 GLU B 37 -17.831 15.497 26.496 1.00 32.77 O ATOM 2098 OE2 GLU B 37 -18.823 14.160 24.997 1.00 32.96 O ATOM 2099 HA GLU B 37 -13.666 15.063 25.069 1.00 0.00 H ATOM 2100 HB2 GLU B 37 -16.208 16.696 24.889 1.00 0.00 H ATOM 2101 HB3 GLU B 37 -15.387 15.971 23.488 1.00 0.00 H ATOM 2102 HG2 GLU B 37 -16.645 14.164 23.736 1.00 0.00 H ATOM 2103 HG3 GLU B 37 -15.843 13.851 25.293 1.00 0.00 H ATOM 2104 H GLU B 37 -15.245 16.462 27.152 1.00 0.00 H ATOM 2105 N LEU B 38 -12.668 17.143 23.836 1.00 16.86 N ATOM 2106 CA LEU B 38 -12.014 18.343 23.359 1.00 15.47 C ATOM 2107 C LEU B 38 -11.885 18.492 21.811 1.00 16.62 C ATOM 2108 O LEU B 38 -12.324 17.686 20.950 1.00 14.66 O ATOM 2109 CB LEU B 38 -10.703 18.360 24.148 1.00 14.20 C ATOM 2110 CG LEU B 38 -10.300 19.573 25.020 1.00 16.02 C ATOM 2111 CD1 LEU B 38 -11.478 20.304 25.611 1.00 12.10 C ATOM 2112 CD2 LEU B 38 -9.448 19.061 26.145 1.00 13.56 C ATOM 2113 HA LEU B 38 -12.615 19.234 23.540 1.00 0.00 H ATOM 2114 HB2 LEU B 38 -10.734 17.498 24.815 1.00 0.00 H ATOM 2115 HB3 LEU B 38 -9.904 18.226 23.419 1.00 0.00 H ATOM 2116 HG LEU B 38 -9.774 20.282 24.380 1.00 0.00 H ATOM 2117 HD21 LEU B 38 -10.019 18.343 26.733 1.00 0.00 H ATOM 2118 HD22 LEU B 38 -8.562 18.575 25.736 1.00 0.00 H ATOM 2119 HD23 LEU B 38 -9.147 19.895 26.779 1.00 0.00 H ATOM 2120 HD11 LEU B 38 -12.114 20.675 24.807 1.00 0.00 H ATOM 2121 HD12 LEU B 38 -12.048 19.622 26.242 1.00 0.00 H ATOM 2122 HD13 LEU B 38 -11.121 21.142 26.210 1.00 0.00 H ATOM 2123 H LEU B 38 -12.429 16.220 23.421 1.00 0.00 H ATOM 2124 N GLY B 39 -11.273 19.584 21.376 1.00 16.80 N ATOM 2125 CA GLY B 39 -11.481 19.915 19.988 1.00 19.85 C ATOM 2126 C GLY B 39 -10.580 19.202 19.009 1.00 22.38 C ATOM 2127 O GLY B 39 -9.679 20.029 18.777 1.00 21.76 O ATOM 2128 HA3 GLY B 39 -11.324 20.987 19.871 1.00 0.00 H ATOM 2129 HA2 GLY B 39 -12.513 19.671 19.735 1.00 0.00 H ATOM 2130 H GLY B 39 -10.678 20.167 21.998 1.00 0.00 H ATOM 2131 N PRO B 40 -10.779 17.943 18.351 1.00 22.04 N ATOM 2132 CA PRO B 40 -9.847 16.977 17.675 1.00 18.12 C ATOM 2133 C PRO B 40 -8.663 17.486 16.881 1.00 16.91 C ATOM 2134 O PRO B 40 -8.072 16.845 16.011 1.00 16.59 O ATOM 2135 CB PRO B 40 -10.658 16.149 16.714 1.00 18.93 C ATOM 2136 CG PRO B 40 -11.757 17.103 16.315 1.00 19.27 C ATOM 2137 CD PRO B 40 -12.088 17.609 17.743 1.00 21.48 C ATOM 2138 HA PRO B 40 -9.398 16.465 18.526 1.00 0.00 H ATOM 2139 HD3 PRO B 40 -12.725 18.492 17.698 1.00 0.00 H ATOM 2140 HD2 PRO B 40 -12.589 16.830 18.318 1.00 0.00 H ATOM 2141 HG3 PRO B 40 -12.600 16.597 15.845 1.00 0.00 H ATOM 2142 HG2 PRO B 40 -11.402 17.899 15.661 1.00 0.00 H ATOM 2143 HB2 PRO B 40 -10.063 15.849 15.851 1.00 0.00 H ATOM 2144 HB3 PRO B 40 -11.063 15.262 17.201 1.00 0.00 H ATOM 2145 N HIS B 41 -8.303 18.666 17.240 1.00 14.49 N ATOM 2146 CA HIS B 41 -7.264 19.419 16.684 1.00 14.97 C ATOM 2147 C HIS B 41 -6.367 19.394 17.937 1.00 15.19 C ATOM 2148 O HIS B 41 -6.309 20.272 18.798 1.00 14.62 O ATOM 2149 CB HIS B 41 -7.911 20.757 16.298 1.00 15.15 C ATOM 2150 CG HIS B 41 -8.967 20.631 15.191 1.00 17.84 C ATOM 2151 ND1 HIS B 41 -8.912 19.961 14.023 1.00 18.56 N ATOM 2152 CD2 HIS B 41 -10.224 21.220 15.240 1.00 19.02 C ATOM 2153 CE1 HIS B 41 -10.062 20.117 13.390 1.00 19.09 C ATOM 2154 NE2 HIS B 41 -10.847 20.878 14.130 1.00 20.35 N ATOM 2155 HA HIS B 41 -6.720 19.123 15.787 1.00 0.00 H ATOM 2156 HB2 HIS B 41 -8.388 21.178 17.183 1.00 0.00 H ATOM 2157 HB3 HIS B 41 -7.128 21.432 15.953 1.00 0.00 H ATOM 2158 HD2 HIS B 41 -10.619 21.844 16.041 1.00 0.00 H ATOM 2159 HE1 HIS B 41 -10.319 19.690 12.421 1.00 0.00 H ATOM 2160 H HIS B 41 -8.836 19.103 18.019 1.00 0.00 H ATOM 2161 N TYR B 42 -5.679 18.262 18.036 1.00 16.07 N ATOM 2162 CA TYR B 42 -4.765 17.984 19.131 1.00 15.75 C ATOM 2163 C TYR B 42 -3.444 17.496 18.546 1.00 16.49 C ATOM 2164 O TYR B 42 -3.436 17.006 17.415 1.00 17.24 O ATOM 2165 CB TYR B 42 -5.324 16.882 19.981 1.00 15.11 C ATOM 2166 CG TYR B 42 -5.422 15.526 19.309 1.00 12.79 C ATOM 2167 CD1 TYR B 42 -4.308 14.703 19.176 1.00 14.68 C ATOM 2168 CD2 TYR B 42 -6.657 15.083 18.905 1.00 13.63 C ATOM 2169 CE1 TYR B 42 -4.419 13.437 18.646 1.00 14.86 C ATOM 2170 CE2 TYR B 42 -6.793 13.810 18.385 1.00 12.88 C ATOM 2171 CZ TYR B 42 -5.674 13.001 18.264 1.00 15.64 C ATOM 2172 OH TYR B 42 -5.824 11.674 17.850 1.00 19.94 O ATOM 2173 HA TYR B 42 -4.624 18.886 19.727 1.00 0.00 H ATOM 2174 HB3 TYR B 42 -6.326 17.175 20.295 1.00 0.00 H ATOM 2175 HB2 TYR B 42 -4.686 16.777 20.858 1.00 0.00 H ATOM 2176 HD2 TYR B 42 -7.527 15.733 18.994 1.00 0.00 H ATOM 2177 HE2 TYR B 42 -7.772 13.445 18.073 1.00 0.00 H ATOM 2178 HE1 TYR B 42 -3.544 12.798 18.531 1.00 0.00 H ATOM 2179 HD1 TYR B 42 -3.332 15.066 19.497 1.00 0.00 H ATOM 2180 HH TYR B 42 -4.936 11.238 17.816 1.00 0.00 H ATOM 2181 H TYR B 42 -5.800 17.542 17.296 1.00 0.00 H ATOM 2182 N THR B 43 -2.341 17.484 19.265 1.00 16.75 N ATOM 2183 CA THR B 43 -1.130 16.994 18.688 1.00 16.12 C ATOM 2184 C THR B 43 -0.721 15.953 19.701 1.00 17.18 C ATOM 2185 O THR B 43 -0.809 16.145 20.923 1.00 18.11 O ATOM 2186 CB THR B 43 -0.083 18.163 18.488 1.00 18.37 C ATOM 2187 OG1 THR B 43 1.166 17.507 18.697 1.00 20.83 O ATOM 2188 CG2 THR B 43 -0.243 19.425 19.332 1.00 18.26 C ATOM 2189 HA THR B 43 -1.220 16.579 17.684 1.00 0.00 H ATOM 2190 HB THR B 43 -0.213 18.608 17.501 1.00 0.00 H ATOM 2191 HG1 THR B 43 1.188 17.125 19.610 1.00 0.00 H ATOM 2192 HG23 THR B 43 -1.213 19.877 19.127 1.00 0.00 H ATOM 2193 HG21 THR B 43 -0.178 19.165 20.388 1.00 0.00 H ATOM 2194 HG22 THR B 43 0.548 20.131 19.081 1.00 0.00 H ATOM 2195 H THR B 43 -2.352 17.829 20.246 1.00 0.00 H ATOM 2196 N PRO B 44 -0.354 14.780 19.201 1.00 18.45 N ATOM 2197 CA PRO B 44 0.080 13.610 19.991 1.00 17.32 C ATOM 2198 C PRO B 44 1.338 13.978 20.750 1.00 17.88 C ATOM 2199 O PRO B 44 2.299 14.479 20.159 1.00 18.06 O ATOM 2200 CB PRO B 44 0.348 12.548 18.973 1.00 17.39 C ATOM 2201 CG PRO B 44 -0.423 13.020 17.734 1.00 17.62 C ATOM 2202 CD PRO B 44 -0.179 14.528 17.775 1.00 16.98 C ATOM 2203 HA PRO B 44 -0.655 13.277 20.724 1.00 0.00 H ATOM 2204 HD3 PRO B 44 0.826 14.784 17.440 1.00 0.00 H ATOM 2205 HD2 PRO B 44 -0.910 15.072 17.176 1.00 0.00 H ATOM 2206 HG3 PRO B 44 -1.485 12.786 17.813 1.00 0.00 H ATOM 2207 HG2 PRO B 44 -0.022 12.577 16.823 1.00 0.00 H ATOM 2208 HB2 PRO B 44 1.415 12.474 18.761 1.00 0.00 H ATOM 2209 HB3 PRO B 44 -0.021 11.581 19.315 1.00 0.00 H ATOM 2210 N LYS B 45 1.394 13.728 22.046 1.00 20.22 N ATOM 2211 CA LYS B 45 2.572 14.060 22.836 1.00 19.53 C ATOM 2212 C LYS B 45 2.758 12.868 23.743 1.00 18.93 C ATOM 2213 O LYS B 45 1.842 12.045 23.857 1.00 19.57 O ATOM 2214 CB LYS B 45 2.281 15.293 23.631 1.00 21.58 C ATOM 2215 CG LYS B 45 3.423 16.292 23.802 1.00 24.50 C ATOM 2216 CD LYS B 45 3.467 17.180 22.583 1.00 25.35 C ATOM 2217 CE LYS B 45 4.526 18.234 22.857 1.00 26.88 C ATOM 2218 NZ LYS B 45 4.659 19.029 21.640 1.00 28.34 N ATOM 2219 HA LYS B 45 3.463 14.256 22.239 1.00 0.00 H ATOM 2220 HB2 LYS B 45 1.458 15.814 23.141 1.00 0.00 H ATOM 2221 HB3 LYS B 45 1.968 14.977 24.626 1.00 0.00 H ATOM 2222 HG2 LYS B 45 3.253 16.897 24.692 1.00 0.00 H ATOM 2223 HG3 LYS B 45 4.368 15.758 23.903 1.00 0.00 H ATOM 2224 HD2 LYS B 45 3.734 16.597 21.701 1.00 0.00 H ATOM 2225 HD3 LYS B 45 2.497 17.652 22.425 1.00 0.00 H ATOM 2226 HE2 LYS B 45 5.476 17.757 23.099 1.00 0.00 H ATOM 2227 HE3 LYS B 45 4.217 18.869 23.688 1.00 0.00 H ATOM 2228 HZ1 LYS B 45 4.948 18.412 20.854 1.00 0.00 H ATOM 2229 HZ2 LYS B 45 3.746 19.473 21.416 1.00 0.00 H ATOM 2230 HZ3 LYS B 45 5.378 19.766 21.786 1.00 0.00 H ATOM 2231 H LYS B 45 0.578 13.284 22.513 1.00 0.00 H ATOM 2232 N ILE B 46 3.880 12.719 24.426 1.00 18.04 N ATOM 2233 CA ILE B 46 4.058 11.560 25.292 1.00 17.90 C ATOM 2234 C ILE B 46 4.239 12.122 26.695 1.00 17.77 C ATOM 2235 O ILE B 46 4.875 13.178 26.794 1.00 18.57 O ATOM 2236 CB ILE B 46 5.274 10.803 24.701 1.00 18.23 C ATOM 2237 CG1 ILE B 46 4.832 9.367 24.546 1.00 20.65 C ATOM 2238 CG2 ILE B 46 6.546 10.879 25.530 1.00 19.19 C ATOM 2239 CD1 ILE B 46 4.696 8.481 25.836 1.00 23.68 C ATOM 2240 HA ILE B 46 3.235 10.848 25.349 1.00 0.00 H ATOM 2241 HB ILE B 46 5.549 11.275 23.758 1.00 0.00 H ATOM 2242 HG12 ILE B 46 3.856 9.381 24.061 1.00 0.00 H ATOM 2243 HG13 ILE B 46 5.554 8.877 23.893 1.00 0.00 H ATOM 2244 HD11 ILE B 46 5.661 8.423 26.339 1.00 0.00 H ATOM 2245 HD12 ILE B 46 3.962 8.928 26.506 1.00 0.00 H ATOM 2246 HD13 ILE B 46 4.371 7.479 25.555 1.00 0.00 H ATOM 2247 HG21 ILE B 46 6.848 11.921 25.635 1.00 0.00 H ATOM 2248 HG22 ILE B 46 6.362 10.452 26.516 1.00 0.00 H ATOM 2249 HG23 ILE B 46 7.337 10.318 25.032 1.00 0.00 H ATOM 2250 H ILE B 46 4.636 13.429 24.345 1.00 0.00 H ATOM 2251 N VAL B 47 3.677 11.596 27.785 1.00 16.26 N ATOM 2252 CA VAL B 47 3.927 12.206 29.092 1.00 15.39 C ATOM 2253 C VAL B 47 4.469 11.151 30.059 1.00 13.36 C ATOM 2254 O VAL B 47 3.896 10.079 30.249 1.00 11.20 O ATOM 2255 CB VAL B 47 2.606 12.861 29.654 1.00 15.65 C ATOM 2256 CG1 VAL B 47 2.871 13.650 30.954 1.00 15.29 C ATOM 2257 CG2 VAL B 47 2.098 13.894 28.670 1.00 18.03 C ATOM 2258 HA VAL B 47 4.672 12.994 28.983 1.00 0.00 H ATOM 2259 HB VAL B 47 1.902 12.047 29.825 1.00 0.00 H ATOM 2260 HG11 VAL B 47 3.271 12.976 31.712 1.00 0.00 H ATOM 2261 HG12 VAL B 47 3.591 14.443 30.755 1.00 0.00 H ATOM 2262 HG13 VAL B 47 1.937 14.086 31.310 1.00 0.00 H ATOM 2263 HG21 VAL B 47 2.856 14.665 28.530 1.00 0.00 H ATOM 2264 HG22 VAL B 47 1.888 13.412 27.715 1.00 0.00 H ATOM 2265 HG23 VAL B 47 1.186 14.346 29.059 1.00 0.00 H ATOM 2266 H VAL B 47 3.066 10.758 27.706 1.00 0.00 H ATOM 2267 N GLY B 48 5.625 11.454 30.628 1.00 14.04 N ATOM 2268 CA GLY B 48 6.273 10.620 31.645 1.00 14.10 C ATOM 2269 C GLY B 48 5.796 10.894 33.069 1.00 14.40 C ATOM 2270 O GLY B 48 5.590 12.063 33.465 1.00 14.76 O ATOM 2271 HA3 GLY B 48 7.347 10.800 31.603 1.00 0.00 H ATOM 2272 HA2 GLY B 48 6.071 9.575 31.411 1.00 0.00 H ATOM 2273 H GLY B 48 6.100 12.332 30.338 1.00 0.00 H ATOM 2274 N GLY B 49 5.657 9.811 33.832 1.00 14.07 N ATOM 2275 CA GLY B 49 5.193 9.826 35.213 1.00 14.03 C ATOM 2276 C GLY B 49 5.975 8.817 36.061 1.00 13.70 C ATOM 2277 O GLY B 49 7.063 8.343 35.689 1.00 12.25 O ATOM 2278 HA3 GLY B 49 4.134 9.569 35.237 1.00 0.00 H ATOM 2279 HA2 GLY B 49 5.333 10.825 35.626 1.00 0.00 H ATOM 2280 H GLY B 49 5.897 8.890 33.412 1.00 0.00 H ATOM 2281 N ILE B 50 5.456 8.528 37.265 1.00 14.76 N ATOM 2282 CA ILE B 50 6.072 7.552 38.157 1.00 15.51 C ATOM 2283 C ILE B 50 5.871 6.201 37.480 1.00 17.02 C ATOM 2284 O ILE B 50 4.794 5.723 37.065 1.00 17.46 O ATOM 2285 CB ILE B 50 5.414 7.602 39.603 1.00 14.75 C ATOM 2286 CG1 ILE B 50 6.530 7.339 40.596 1.00 13.47 C ATOM 2287 CG2 ILE B 50 4.375 6.545 39.886 1.00 14.70 C ATOM 2288 CD1 ILE B 50 7.495 8.522 40.709 1.00 14.24 C ATOM 2289 HA ILE B 50 7.131 7.755 38.317 1.00 0.00 H ATOM 2290 HB ILE B 50 4.920 8.571 39.675 1.00 0.00 H ATOM 2291 HG12 ILE B 50 6.091 7.149 41.575 1.00 0.00 H ATOM 2292 HG13 ILE B 50 7.088 6.460 40.273 1.00 0.00 H ATOM 2293 HD11 ILE B 50 7.946 8.716 39.736 1.00 0.00 H ATOM 2294 HD12 ILE B 50 6.948 9.405 41.040 1.00 0.00 H ATOM 2295 HD13 ILE B 50 8.276 8.285 41.432 1.00 0.00 H ATOM 2296 HG21 ILE B 50 3.556 6.642 39.173 1.00 0.00 H ATOM 2297 HG22 ILE B 50 4.827 5.558 39.789 1.00 0.00 H ATOM 2298 HG23 ILE B 50 3.994 6.674 40.899 1.00 0.00 H ATOM 2299 H ILE B 50 4.589 9.014 37.571 1.00 0.00 H ATOM 2300 N GLY B 51 7.049 5.650 37.274 1.00 17.50 N ATOM 2301 CA GLY B 51 7.038 4.388 36.580 1.00 18.66 C ATOM 2302 C GLY B 51 6.386 4.373 35.182 1.00 15.80 C ATOM 2303 O GLY B 51 5.619 3.447 34.961 1.00 16.59 O ATOM 2304 HA3 GLY B 51 6.501 3.673 37.203 1.00 0.00 H ATOM 2305 HA2 GLY B 51 8.073 4.064 36.466 1.00 0.00 H ATOM 2306 H GLY B 51 7.932 6.098 37.592 1.00 0.00 H ATOM 2307 N GLY B 52 6.598 5.317 34.247 1.00 14.85 N ATOM 2308 CA GLY B 52 6.172 5.068 32.887 1.00 15.02 C ATOM 2309 C GLY B 52 5.756 6.295 32.119 1.00 16.43 C ATOM 2310 O GLY B 52 5.738 7.416 32.606 1.00 16.27 O ATOM 2311 HA3 GLY B 52 5.324 4.383 32.917 1.00 0.00 H ATOM 2312 HA2 GLY B 52 6.998 4.598 32.354 1.00 0.00 H ATOM 2313 H GLY B 52 7.062 6.213 34.498 1.00 0.00 H ATOM 2314 N PHE B 53 5.338 6.062 30.896 1.00 16.68 N ATOM 2315 CA PHE B 53 5.029 7.105 29.946 1.00 15.85 C ATOM 2316 C PHE B 53 3.687 6.760 29.397 1.00 15.55 C ATOM 2317 O PHE B 53 3.415 5.566 29.327 1.00 17.82 O ATOM 2318 CB PHE B 53 6.007 7.112 28.782 1.00 15.83 C ATOM 2319 CG PHE B 53 7.357 7.680 29.184 1.00 19.31 C ATOM 2320 CD1 PHE B 53 7.577 9.054 29.071 1.00 18.80 C ATOM 2321 CD2 PHE B 53 8.346 6.849 29.692 1.00 18.67 C ATOM 2322 CE1 PHE B 53 8.799 9.566 29.481 1.00 18.77 C ATOM 2323 CE2 PHE B 53 9.561 7.386 30.096 1.00 18.20 C ATOM 2324 CZ PHE B 53 9.784 8.740 29.991 1.00 17.12 C ATOM 2325 HA PHE B 53 5.073 8.078 30.434 1.00 0.00 H ATOM 2326 HB2 PHE B 53 6.145 6.090 28.430 1.00 0.00 H ATOM 2327 HB3 PHE B 53 5.594 7.720 27.977 1.00 0.00 H ATOM 2328 HD2 PHE B 53 8.169 5.777 29.774 1.00 0.00 H ATOM 2329 HE2 PHE B 53 10.338 6.735 30.496 1.00 0.00 H ATOM 2330 HZ PHE B 53 10.737 9.161 30.310 1.00 0.00 H ATOM 2331 HE1 PHE B 53 8.986 10.637 29.400 1.00 0.00 H ATOM 2332 HD1 PHE B 53 6.805 9.710 28.669 1.00 0.00 H ATOM 2333 H PHE B 53 5.223 5.073 30.595 1.00 0.00 H ATOM 2334 N ILE B 54 2.815 7.706 29.058 1.00 15.64 N ATOM 2335 CA ILE B 54 1.516 7.415 28.498 1.00 13.94 C ATOM 2336 C ILE B 54 1.345 8.283 27.245 1.00 16.01 C ATOM 2337 O ILE B 54 1.987 9.348 27.011 1.00 15.74 O ATOM 2338 CB ILE B 54 0.371 7.724 29.500 1.00 12.89 C ATOM 2339 CG1 ILE B 54 0.369 9.197 29.935 1.00 11.85 C ATOM 2340 CG2 ILE B 54 0.527 6.813 30.706 1.00 11.56 C ATOM 2341 CD1 ILE B 54 -1.082 9.579 30.332 1.00 9.02 C ATOM 2342 HA ILE B 54 1.460 6.353 28.260 1.00 0.00 H ATOM 2343 HB ILE B 54 -0.585 7.541 29.008 1.00 0.00 H ATOM 2344 HG12 ILE B 54 1.034 9.332 30.788 1.00 0.00 H ATOM 2345 HG13 ILE B 54 0.705 9.827 29.111 1.00 0.00 H ATOM 2346 HD11 ILE B 54 -1.741 9.438 29.475 1.00 0.00 H ATOM 2347 HD12 ILE B 54 -1.412 8.943 31.154 1.00 0.00 H ATOM 2348 HD13 ILE B 54 -1.109 10.623 30.645 1.00 0.00 H ATOM 2349 HG21 ILE B 54 0.470 5.773 30.384 1.00 0.00 H ATOM 2350 HG22 ILE B 54 1.493 6.997 31.176 1.00 0.00 H ATOM 2351 HG23 ILE B 54 -0.271 7.018 31.420 1.00 0.00 H ATOM 2352 H ILE B 54 3.081 8.701 29.203 1.00 0.00 H ATOM 2353 N ASN B 55 0.446 7.811 26.388 1.00 16.35 N ATOM 2354 CA ASN B 55 0.160 8.542 25.146 1.00 16.24 C ATOM 2355 C ASN B 55 -0.848 9.605 25.491 1.00 15.36 C ATOM 2356 O ASN B 55 -1.850 9.350 26.177 1.00 17.64 O ATOM 2357 CB ASN B 55 -0.365 7.572 24.108 1.00 16.72 C ATOM 2358 CG ASN B 55 0.871 6.801 23.706 1.00 18.20 C ATOM 2359 OD1 ASN B 55 1.104 5.679 24.146 1.00 21.73 O ATOM 2360 ND2 ASN B 55 1.799 7.396 22.981 1.00 18.76 N ATOM 2361 HA ASN B 55 1.050 9.009 24.724 1.00 0.00 H ATOM 2362 HB2 ASN B 55 -1.118 6.910 24.536 1.00 0.00 H ATOM 2363 HB3 ASN B 55 -0.791 8.102 23.256 1.00 0.00 H ATOM 2364 HD22 ASN B 55 1.628 8.347 22.596 1.00 0.00 H ATOM 2365 HD21 ASN B 55 2.702 6.914 22.795 1.00 0.00 H ATOM 2366 H ASN B 55 -0.055 6.924 26.596 1.00 0.00 H ATOM 2367 N THR B 56 -0.570 10.791 25.012 1.00 14.09 N ATOM 2368 CA THR B 56 -1.394 11.943 25.275 1.00 11.70 C ATOM 2369 C THR B 56 -1.822 12.697 24.038 1.00 12.32 C ATOM 2370 O THR B 56 -1.127 12.647 23.022 1.00 14.29 O ATOM 2371 CB THR B 56 -0.458 12.659 26.233 1.00 8.68 C ATOM 2372 OG1 THR B 56 -1.050 12.553 27.500 1.00 10.97 O ATOM 2373 CG2 THR B 56 -0.132 14.027 25.838 1.00 7.37 C ATOM 2374 HA THR B 56 -2.388 11.755 25.682 1.00 0.00 H ATOM 2375 HB THR B 56 0.526 12.189 26.230 1.00 0.00 H ATOM 2376 HG1 THR B 56 -1.942 12.981 27.483 1.00 0.00 H ATOM 2377 HG23 THR B 56 0.322 14.019 24.847 1.00 0.00 H ATOM 2378 HG21 THR B 56 -1.043 14.625 25.817 1.00 0.00 H ATOM 2379 HG22 THR B 56 0.568 14.454 26.556 1.00 0.00 H ATOM 2380 H THR B 56 0.277 10.906 24.420 1.00 0.00 H ATOM 2381 N LYS B 57 -2.916 13.430 24.128 1.00 11.79 N ATOM 2382 CA LYS B 57 -3.446 14.232 23.049 1.00 11.46 C ATOM 2383 C LYS B 57 -3.294 15.619 23.672 1.00 11.56 C ATOM 2384 O LYS B 57 -3.835 15.863 24.749 1.00 13.68 O ATOM 2385 CB LYS B 57 -4.909 13.907 22.802 1.00 11.69 C ATOM 2386 CG LYS B 57 -5.208 12.545 22.197 1.00 10.28 C ATOM 2387 CD LYS B 57 -6.685 12.641 21.930 1.00 10.63 C ATOM 2388 CE LYS B 57 -7.347 11.413 21.323 1.00 12.96 C ATOM 2389 NZ LYS B 57 -8.776 11.693 21.139 1.00 14.34 N ATOM 2390 HA LYS B 57 -2.961 14.097 22.082 1.00 0.00 H ATOM 2391 HB2 LYS B 57 -5.428 13.966 23.759 1.00 0.00 H ATOM 2392 HB3 LYS B 57 -5.307 14.664 22.127 1.00 0.00 H ATOM 2393 HG2 LYS B 57 -4.648 12.389 21.275 1.00 0.00 H ATOM 2394 HG3 LYS B 57 -4.983 11.741 22.898 1.00 0.00 H ATOM 2395 HD2 LYS B 57 -7.180 12.850 22.878 1.00 0.00 H ATOM 2396 HD3 LYS B 57 -6.845 13.475 21.247 1.00 0.00 H ATOM 2397 HE2 LYS B 57 -7.223 10.561 21.991 1.00 0.00 H ATOM 2398 HE3 LYS B 57 -6.890 11.188 20.360 1.00 0.00 H ATOM 2399 HZ1 LYS B 57 -9.207 11.909 22.060 1.00 0.00 H ATOM 2400 HZ2 LYS B 57 -8.889 12.508 20.502 1.00 0.00 H ATOM 2401 HZ3 LYS B 57 -9.241 10.860 20.724 1.00 0.00 H ATOM 2402 H LYS B 57 -3.429 13.430 25.033 1.00 0.00 H ATOM 2403 N GLU B 58 -2.519 16.530 23.101 1.00 12.09 N ATOM 2404 CA GLU B 58 -2.286 17.876 23.602 1.00 12.04 C ATOM 2405 C GLU B 58 -3.177 18.919 22.941 1.00 12.69 C ATOM 2406 O GLU B 58 -3.208 18.990 21.704 1.00 12.63 O ATOM 2407 CB GLU B 58 -0.862 18.208 23.341 1.00 12.02 C ATOM 2408 CG GLU B 58 -0.509 19.527 23.957 1.00 14.79 C ATOM 2409 CD GLU B 58 0.812 20.012 23.431 1.00 16.19 C ATOM 2410 OE1 GLU B 58 0.814 20.512 22.317 1.00 22.04 O ATOM 2411 OE2 GLU B 58 1.834 19.908 24.100 1.00 21.18 O ATOM 2412 HA GLU B 58 -2.524 17.895 24.666 1.00 0.00 H ATOM 2413 HB2 GLU B 58 -0.228 17.431 23.768 1.00 0.00 H ATOM 2414 HB3 GLU B 58 -0.697 18.259 22.265 1.00 0.00 H ATOM 2415 HG2 GLU B 58 -1.282 20.256 23.714 1.00 0.00 H ATOM 2416 HG3 GLU B 58 -0.445 19.413 25.039 1.00 0.00 H ATOM 2417 H GLU B 58 -2.037 16.260 22.220 1.00 0.00 H ATOM 2418 N TYR B 59 -3.899 19.723 23.717 1.00 12.04 N ATOM 2419 CA TYR B 59 -4.790 20.760 23.219 1.00 11.26 C ATOM 2420 C TYR B 59 -4.210 22.047 23.762 1.00 12.11 C ATOM 2421 O TYR B 59 -3.825 22.166 24.930 1.00 13.17 O ATOM 2422 CB TYR B 59 -6.199 20.578 23.741 1.00 11.11 C ATOM 2423 CG TYR B 59 -6.895 19.361 23.181 1.00 11.69 C ATOM 2424 CD1 TYR B 59 -6.715 18.138 23.814 1.00 11.97 C ATOM 2425 CD2 TYR B 59 -7.640 19.479 22.025 1.00 11.23 C ATOM 2426 CE1 TYR B 59 -7.282 17.014 23.260 1.00 12.12 C ATOM 2427 CE2 TYR B 59 -8.203 18.360 21.469 1.00 11.37 C ATOM 2428 CZ TYR B 59 -8.011 17.132 22.091 1.00 12.47 C ATOM 2429 OH TYR B 59 -8.542 15.992 21.519 1.00 12.44 O ATOM 2430 HA TYR B 59 -4.857 20.741 22.131 1.00 0.00 H ATOM 2431 HB3 TYR B 59 -6.782 21.461 23.478 1.00 0.00 H ATOM 2432 HB2 TYR B 59 -6.156 20.483 24.826 1.00 0.00 H ATOM 2433 HD2 TYR B 59 -7.779 20.454 21.558 1.00 0.00 H ATOM 2434 HE2 TYR B 59 -8.791 18.432 20.554 1.00 0.00 H ATOM 2435 HE1 TYR B 59 -7.158 16.042 23.737 1.00 0.00 H ATOM 2436 HD1 TYR B 59 -6.134 18.070 24.734 1.00 0.00 H ATOM 2437 HH TYR B 59 -8.318 15.208 22.080 1.00 0.00 H ATOM 2438 H TYR B 59 -3.822 19.602 24.747 1.00 0.00 H ATOM 2439 N LYS B 60 -4.095 23.032 22.891 1.00 11.66 N ATOM 2440 CA LYS B 60 -3.523 24.296 23.291 1.00 12.46 C ATOM 2441 C LYS B 60 -4.647 25.273 23.633 1.00 12.72 C ATOM 2442 O LYS B 60 -5.779 25.078 23.193 1.00 13.28 O ATOM 2443 CB LYS B 60 -2.701 24.727 22.103 1.00 13.76 C ATOM 2444 CG LYS B 60 -1.350 25.335 22.283 1.00 16.44 C ATOM 2445 CD LYS B 60 -0.295 24.246 22.174 1.00 17.25 C ATOM 2446 CE LYS B 60 1.095 24.906 22.266 1.00 19.79 C ATOM 2447 NZ LYS B 60 1.288 25.641 23.527 1.00 22.32 N ATOM 2448 HA LYS B 60 -2.900 24.243 24.184 1.00 0.00 H ATOM 2449 HB2 LYS B 60 -2.562 23.841 21.484 1.00 0.00 H ATOM 2450 HB3 LYS B 60 -3.300 25.458 21.560 1.00 0.00 H ATOM 2451 HG2 LYS B 60 -1.181 26.085 21.511 1.00 0.00 H ATOM 2452 HG3 LYS B 60 -1.289 25.806 23.264 1.00 0.00 H ATOM 2453 HD2 LYS B 60 -0.418 23.531 22.987 1.00 0.00 H ATOM 2454 HD3 LYS B 60 -0.395 23.730 21.219 1.00 0.00 H ATOM 2455 HE2 LYS B 60 1.208 25.602 21.435 1.00 0.00 H ATOM 2456 HE3 LYS B 60 1.856 24.129 22.194 1.00 0.00 H ATOM 2457 HZ1 LYS B 60 0.571 26.391 23.603 1.00 0.00 H ATOM 2458 HZ2 LYS B 60 1.191 24.985 24.328 1.00 0.00 H ATOM 2459 HZ3 LYS B 60 2.238 26.065 23.538 1.00 0.00 H ATOM 2460 H LYS B 60 -4.418 22.897 21.912 1.00 0.00 H ATOM 2461 N ASN B 61 -4.364 26.296 24.429 1.00 12.48 N ATOM 2462 CA ASN B 61 -5.334 27.314 24.800 1.00 12.94 C ATOM 2463 C ASN B 61 -6.710 26.928 25.299 1.00 13.59 C ATOM 2464 O ASN B 61 -7.679 27.629 24.973 1.00 14.26 O ATOM 2465 CB ASN B 61 -5.553 28.244 23.632 1.00 14.25 C ATOM 2466 CG ASN B 61 -4.281 28.955 23.337 1.00 17.51 C ATOM 2467 OD1 ASN B 61 -3.682 29.551 24.226 1.00 20.43 O ATOM 2468 ND2 ASN B 61 -3.740 28.849 22.129 1.00 19.96 N ATOM 2469 HA ASN B 61 -4.848 27.739 25.678 1.00 0.00 H ATOM 2470 HB2 ASN B 61 -5.862 27.669 22.759 1.00 0.00 H ATOM 2471 HB3 ASN B 61 -6.328 28.969 23.881 1.00 0.00 H ATOM 2472 HD22 ASN B 61 -4.247 28.344 21.375 1.00 0.00 H ATOM 2473 HD21 ASN B 61 -2.809 29.271 21.937 1.00 0.00 H ATOM 2474 H ASN B 61 -3.398 26.374 24.807 1.00 0.00 H ATOM 2475 N VAL B 62 -6.857 25.828 26.047 1.00 11.93 N ATOM 2476 CA VAL B 62 -8.142 25.400 26.561 1.00 9.45 C ATOM 2477 C VAL B 62 -8.563 26.353 27.681 1.00 9.81 C ATOM 2478 O VAL B 62 -7.777 26.843 28.495 1.00 10.78 O ATOM 2479 CB VAL B 62 -7.958 23.972 26.996 1.00 9.04 C ATOM 2480 CG1 VAL B 62 -9.219 23.510 27.624 1.00 8.93 C ATOM 2481 CG2 VAL B 62 -7.650 23.090 25.816 1.00 8.20 C ATOM 2482 HA VAL B 62 -8.949 25.434 25.829 1.00 0.00 H ATOM 2483 HB VAL B 62 -7.127 23.916 27.699 1.00 0.00 H ATOM 2484 HG11 VAL B 62 -9.445 24.138 28.486 1.00 0.00 H ATOM 2485 HG12 VAL B 62 -10.031 23.579 26.900 1.00 0.00 H ATOM 2486 HG13 VAL B 62 -9.105 22.475 27.946 1.00 0.00 H ATOM 2487 HG21 VAL B 62 -8.473 23.138 25.103 1.00 0.00 H ATOM 2488 HG22 VAL B 62 -6.733 23.433 25.337 1.00 0.00 H ATOM 2489 HG23 VAL B 62 -7.521 22.062 26.156 1.00 0.00 H ATOM 2490 H VAL B 62 -6.016 25.258 26.268 1.00 0.00 H ATOM 2491 N LYS B 63 -9.816 26.727 27.652 1.00 9.63 N ATOM 2492 CA LYS B 63 -10.334 27.636 28.629 1.00 11.63 C ATOM 2493 C LYS B 63 -10.778 26.849 29.826 1.00 11.80 C ATOM 2494 O LYS B 63 -11.516 25.871 29.664 1.00 12.91 O ATOM 2495 CB LYS B 63 -11.469 28.393 27.969 1.00 15.45 C ATOM 2496 CG LYS B 63 -11.004 29.419 26.883 1.00 15.50 C ATOM 2497 CD LYS B 63 -12.255 30.048 26.255 1.00 15.89 C ATOM 2498 CE LYS B 63 -12.995 30.932 27.249 1.00 15.65 C ATOM 2499 NZ LYS B 63 -12.186 32.122 27.461 1.00 19.16 N ATOM 2500 HA LYS B 63 -9.591 28.354 28.977 1.00 0.00 H ATOM 2501 HB2 LYS B 63 -12.134 27.670 27.496 1.00 0.00 H ATOM 2502 HB3 LYS B 63 -12.015 28.935 28.741 1.00 0.00 H ATOM 2503 HG2 LYS B 63 -10.392 30.194 27.344 1.00 0.00 H ATOM 2504 HG3 LYS B 63 -10.422 28.908 26.116 1.00 0.00 H ATOM 2505 HD2 LYS B 63 -11.956 30.652 25.398 1.00 0.00 H ATOM 2506 HD3 LYS B 63 -12.922 29.253 25.923 1.00 0.00 H ATOM 2507 HE2 LYS B 63 -13.131 30.401 28.191 1.00 0.00 H ATOM 2508 HE3 LYS B 63 -13.969 31.210 26.847 1.00 0.00 H ATOM 2509 HZ1 LYS B 63 -11.258 31.846 27.840 1.00 0.00 H ATOM 2510 HZ2 LYS B 63 -12.059 32.619 26.556 1.00 0.00 H ATOM 2511 HZ3 LYS B 63 -12.665 32.749 28.138 1.00 0.00 H ATOM 2512 H LYS B 63 -10.444 26.359 26.909 1.00 0.00 H ATOM 2513 N ILE B 64 -10.261 27.260 30.986 1.00 11.06 N ATOM 2514 CA ILE B 64 -10.539 26.644 32.282 1.00 11.81 C ATOM 2515 C ILE B 64 -11.062 27.589 33.371 1.00 11.74 C ATOM 2516 O ILE B 64 -10.602 28.727 33.478 1.00 12.09 O ATOM 2517 CB ILE B 64 -9.229 25.966 32.816 1.00 11.88 C ATOM 2518 CG1 ILE B 64 -8.708 24.976 31.798 1.00 9.94 C ATOM 2519 CG2 ILE B 64 -9.504 25.225 34.150 1.00 10.24 C ATOM 2520 CD1 ILE B 64 -7.216 25.166 31.654 1.00 10.61 C ATOM 2521 HA ILE B 64 -11.343 25.933 32.090 1.00 0.00 H ATOM 2522 HB ILE B 64 -8.486 26.745 32.986 1.00 0.00 H ATOM 2523 HG12 ILE B 64 -8.918 23.960 32.134 1.00 0.00 H ATOM 2524 HG13 ILE B 64 -9.194 25.148 30.838 1.00 0.00 H ATOM 2525 HD11 ILE B 64 -7.011 26.183 31.320 1.00 0.00 H ATOM 2526 HD12 ILE B 64 -6.735 24.995 32.617 1.00 0.00 H ATOM 2527 HD13 ILE B 64 -6.830 24.457 30.922 1.00 0.00 H ATOM 2528 HG21 ILE B 64 -9.862 25.938 34.893 1.00 0.00 H ATOM 2529 HG22 ILE B 64 -10.260 24.456 33.988 1.00 0.00 H ATOM 2530 HG23 ILE B 64 -8.583 24.762 34.503 1.00 0.00 H ATOM 2531 H ILE B 64 -9.616 28.075 30.966 1.00 0.00 H ATOM 2532 N GLU B 65 -11.993 27.193 34.216 1.00 12.06 N ATOM 2533 CA GLU B 65 -12.487 28.060 35.282 1.00 14.82 C ATOM 2534 C GLU B 65 -12.216 27.198 36.518 1.00 14.72 C ATOM 2535 O GLU B 65 -12.721 26.065 36.686 1.00 14.14 O ATOM 2536 CB GLU B 65 -13.977 28.357 35.104 1.00 17.21 C ATOM 2537 CG GLU B 65 -14.548 29.208 36.224 1.00 22.84 C ATOM 2538 CD GLU B 65 -15.707 30.127 35.789 1.00 26.13 C ATOM 2539 OE1 GLU B 65 -16.691 29.663 35.140 1.00 26.81 O ATOM 2540 OE2 GLU B 65 -15.604 31.334 36.108 1.00 26.07 O ATOM 2541 HA GLU B 65 -12.018 29.043 35.322 1.00 0.00 H ATOM 2542 HB2 GLU B 65 -14.116 28.884 34.160 1.00 0.00 H ATOM 2543 HB3 GLU B 65 -14.519 27.412 35.074 1.00 0.00 H ATOM 2544 HG2 GLU B 65 -14.913 28.543 37.007 1.00 0.00 H ATOM 2545 HG3 GLU B 65 -13.748 29.831 36.623 1.00 0.00 H ATOM 2546 H GLU B 65 -12.387 26.235 34.121 1.00 0.00 H ATOM 2547 N VAL B 66 -11.298 27.670 37.351 1.00 14.62 N ATOM 2548 CA VAL B 66 -10.937 26.954 38.546 1.00 15.08 C ATOM 2549 C VAL B 66 -10.604 27.907 39.683 1.00 16.20 C ATOM 2550 O VAL B 66 -10.048 28.983 39.477 1.00 16.97 O ATOM 2551 CB VAL B 66 -9.754 26.014 38.159 1.00 15.62 C ATOM 2552 CG1 VAL B 66 -8.507 26.795 37.781 1.00 12.93 C ATOM 2553 CG2 VAL B 66 -9.509 25.060 39.336 1.00 13.37 C ATOM 2554 HA VAL B 66 -11.767 26.358 38.924 1.00 0.00 H ATOM 2555 HB VAL B 66 -10.012 25.439 37.270 1.00 0.00 H ATOM 2556 HG11 VAL B 66 -8.726 27.436 36.927 1.00 0.00 H ATOM 2557 HG12 VAL B 66 -8.193 27.408 38.626 1.00 0.00 H ATOM 2558 HG13 VAL B 66 -7.710 26.099 37.519 1.00 0.00 H ATOM 2559 HG21 VAL B 66 -9.258 25.639 40.225 1.00 0.00 H ATOM 2560 HG22 VAL B 66 -10.411 24.477 39.523 1.00 0.00 H ATOM 2561 HG23 VAL B 66 -8.685 24.389 39.093 1.00 0.00 H ATOM 2562 H VAL B 66 -10.831 28.574 37.137 1.00 0.00 H ATOM 2563 N LEU B 67 -10.999 27.568 40.914 1.00 18.25 N ATOM 2564 CA LEU B 67 -10.745 28.382 42.110 1.00 17.73 C ATOM 2565 C LEU B 67 -11.189 29.841 41.965 1.00 19.20 C ATOM 2566 O LEU B 67 -10.558 30.818 42.391 1.00 18.87 O ATOM 2567 CB LEU B 67 -9.233 28.232 42.433 1.00 18.23 C ATOM 2568 CG LEU B 67 -8.818 27.034 43.299 1.00 16.66 C ATOM 2569 CD1 LEU B 67 -7.327 26.893 43.487 1.00 14.58 C ATOM 2570 CD2 LEU B 67 -9.354 27.305 44.684 1.00 19.75 C ATOM 2571 HA LEU B 67 -11.351 28.024 42.942 1.00 0.00 H ATOM 2572 HB2 LEU B 67 -8.701 28.152 41.485 1.00 0.00 H ATOM 2573 HB3 LEU B 67 -8.916 29.137 42.951 1.00 0.00 H ATOM 2574 HG LEU B 67 -9.193 26.138 42.805 1.00 0.00 H ATOM 2575 HD21 LEU B 67 -8.923 28.231 45.064 1.00 0.00 H ATOM 2576 HD22 LEU B 67 -10.439 27.399 44.640 1.00 0.00 H ATOM 2577 HD23 LEU B 67 -9.086 26.480 45.344 1.00 0.00 H ATOM 2578 HD11 LEU B 67 -6.850 26.766 42.515 1.00 0.00 H ATOM 2579 HD12 LEU B 67 -6.937 27.788 43.971 1.00 0.00 H ATOM 2580 HD13 LEU B 67 -7.121 26.023 44.110 1.00 0.00 H ATOM 2581 H LEU B 67 -11.517 26.674 41.032 1.00 0.00 H ATOM 2582 N GLY B 68 -12.351 29.918 41.276 1.00 19.65 N ATOM 2583 CA GLY B 68 -13.003 31.196 40.961 1.00 20.28 C ATOM 2584 C GLY B 68 -12.324 32.087 39.897 1.00 20.16 C ATOM 2585 O GLY B 68 -12.811 33.194 39.648 1.00 19.98 O ATOM 2586 HA3 GLY B 68 -13.061 31.772 41.884 1.00 0.00 H ATOM 2587 HA2 GLY B 68 -14.010 30.973 40.609 1.00 0.00 H ATOM 2588 H GLY B 68 -12.801 29.036 40.956 1.00 0.00 H ATOM 2589 N LYS B 69 -11.239 31.637 39.242 1.00 20.05 N ATOM 2590 CA LYS B 69 -10.477 32.404 38.255 1.00 19.78 C ATOM 2591 C LYS B 69 -10.677 31.757 36.888 1.00 19.13 C ATOM 2592 O LYS B 69 -10.925 30.550 36.789 1.00 20.29 O ATOM 2593 CB LYS B 69 -8.978 32.391 38.580 1.00 18.70 C ATOM 2594 CG LYS B 69 -8.710 32.648 40.062 1.00 21.17 C ATOM 2595 CD LYS B 69 -7.931 33.909 40.422 1.00 20.80 C ATOM 2596 CE LYS B 69 -6.533 33.794 39.794 1.00 24.07 C ATOM 2597 NZ LYS B 69 -5.605 34.788 40.350 1.00 23.87 N ATOM 2598 HA LYS B 69 -10.828 33.436 38.266 1.00 0.00 H ATOM 2599 HB2 LYS B 69 -8.568 31.417 38.312 1.00 0.00 H ATOM 2600 HB3 LYS B 69 -8.484 33.166 37.993 1.00 0.00 H ATOM 2601 HG2 LYS B 69 -9.675 32.704 40.565 1.00 0.00 H ATOM 2602 HG3 LYS B 69 -8.150 31.796 40.447 1.00 0.00 H ATOM 2603 HD2 LYS B 69 -8.443 34.787 40.028 1.00 0.00 H ATOM 2604 HD3 LYS B 69 -7.845 33.995 41.505 1.00 0.00 H ATOM 2605 HE2 LYS B 69 -6.615 33.949 38.718 1.00 0.00 H ATOM 2606 HE3 LYS B 69 -6.140 32.796 39.987 1.00 0.00 H ATOM 2607 HZ1 LYS B 69 -5.971 35.744 40.164 1.00 0.00 H ATOM 2608 HZ2 LYS B 69 -5.517 34.642 41.376 1.00 0.00 H ATOM 2609 HZ3 LYS B 69 -4.673 34.679 39.902 1.00 0.00 H ATOM 2610 H LYS B 69 -10.917 30.671 39.453 1.00 0.00 H ATOM 2611 N ARG B 70 -10.684 32.541 35.808 1.00 18.35 N ATOM 2612 CA ARG B 70 -10.850 32.003 34.468 1.00 17.19 C ATOM 2613 C ARG B 70 -9.439 32.046 33.970 1.00 16.49 C ATOM 2614 O ARG B 70 -8.779 33.068 34.163 1.00 18.39 O ATOM 2615 CB ARG B 70 -11.691 32.873 33.650 1.00 16.70 C ATOM 2616 CG ARG B 70 -13.111 32.572 34.035 1.00 20.18 C ATOM 2617 CD ARG B 70 -13.786 32.682 32.691 1.00 22.78 C ATOM 2618 NE ARG B 70 -15.210 32.885 32.884 1.00 27.06 N ATOM 2619 CZ ARG B 70 -16.048 31.842 32.871 1.00 29.81 C ATOM 2620 NH1 ARG B 70 -15.535 30.597 32.686 1.00 31.12 N ATOM 2621 NH2 ARG B 70 -17.392 32.030 33.044 1.00 30.55 N ATOM 2622 HA ARG B 70 -11.324 31.022 34.439 1.00 0.00 H ATOM 2623 HB2 ARG B 70 -11.459 33.919 33.850 1.00 0.00 H ATOM 2624 HB3 ARG B 70 -11.534 32.663 32.592 1.00 0.00 H ATOM 2625 HG2 ARG B 70 -13.211 31.572 34.456 1.00 0.00 H ATOM 2626 HG3 ARG B 70 -13.501 33.303 34.743 1.00 0.00 H ATOM 2627 HD2 ARG B 70 -13.622 31.765 32.125 1.00 0.00 H ATOM 2628 HD3 ARG B 70 -13.369 33.526 32.142 1.00 0.00 H ATOM 2629 HE ARG B 70 -15.581 33.845 33.033 1.00 0.00 H ATOM 2630 HH12 ARG B 70 -16.167 29.771 32.672 1.00 0.00 H ATOM 2631 HH11 ARG B 70 -14.511 30.470 32.558 1.00 0.00 H ATOM 2632 HH22 ARG B 70 -18.037 31.214 33.033 1.00 0.00 H ATOM 2633 HH21 ARG B 70 -17.769 32.989 33.187 1.00 0.00 H ATOM 2634 H ARG B 70 -10.567 33.567 35.929 1.00 0.00 H ATOM 2635 N ILE B 71 -8.984 30.963 33.369 1.00 15.28 N ATOM 2636 CA ILE B 71 -7.633 30.790 32.854 1.00 13.71 C ATOM 2637 C ILE B 71 -7.595 30.077 31.464 1.00 13.29 C ATOM 2638 O ILE B 71 -8.613 29.571 30.971 1.00 13.27 O ATOM 2639 CB ILE B 71 -7.021 30.070 34.151 1.00 13.79 C ATOM 2640 CG1 ILE B 71 -5.707 30.637 34.300 1.00 16.79 C ATOM 2641 CG2 ILE B 71 -6.880 28.562 34.146 1.00 12.98 C ATOM 2642 CD1 ILE B 71 -5.966 31.964 35.049 1.00 20.22 C ATOM 2643 HA ILE B 71 -7.054 31.662 32.552 1.00 0.00 H ATOM 2644 HB ILE B 71 -7.733 30.244 34.958 1.00 0.00 H ATOM 2645 HG12 ILE B 71 -5.063 29.979 34.884 1.00 0.00 H ATOM 2646 HG13 ILE B 71 -5.250 30.821 33.328 1.00 0.00 H ATOM 2647 HD11 ILE B 71 -6.624 32.595 34.451 1.00 0.00 H ATOM 2648 HD12 ILE B 71 -6.437 31.752 36.009 1.00 0.00 H ATOM 2649 HD13 ILE B 71 -5.019 32.478 35.213 1.00 0.00 H ATOM 2650 HG21 ILE B 71 -7.862 28.107 34.013 1.00 0.00 H ATOM 2651 HG22 ILE B 71 -6.226 28.262 33.328 1.00 0.00 H ATOM 2652 HG23 ILE B 71 -6.452 28.235 35.094 1.00 0.00 H ATOM 2653 H ILE B 71 -9.644 30.168 33.254 1.00 0.00 H ATOM 2654 N LYS B 72 -6.474 29.993 30.754 1.00 12.54 N ATOM 2655 CA LYS B 72 -6.378 29.338 29.453 1.00 11.47 C ATOM 2656 C LYS B 72 -5.076 28.570 29.507 1.00 11.30 C ATOM 2657 O LYS B 72 -4.087 29.091 30.062 1.00 10.54 O ATOM 2658 CB LYS B 72 -6.193 30.271 28.311 1.00 13.26 C ATOM 2659 CG LYS B 72 -7.380 30.649 27.489 1.00 17.28 C ATOM 2660 CD LYS B 72 -6.800 31.600 26.385 1.00 20.02 C ATOM 2661 CE LYS B 72 -7.880 32.171 25.414 1.00 20.77 C ATOM 2662 NZ LYS B 72 -9.037 32.759 26.098 1.00 20.64 N ATOM 2663 HA LYS B 72 -7.295 28.771 29.295 1.00 0.00 H ATOM 2664 HB2 LYS B 72 -5.777 31.194 28.716 1.00 0.00 H ATOM 2665 HB3 LYS B 72 -5.470 29.812 27.637 1.00 0.00 H ATOM 2666 HG2 LYS B 72 -7.835 29.767 27.039 1.00 0.00 H ATOM 2667 HG3 LYS B 72 -8.121 31.169 28.096 1.00 0.00 H ATOM 2668 HD2 LYS B 72 -6.304 32.436 26.878 1.00 0.00 H ATOM 2669 HD3 LYS B 72 -6.071 31.041 25.798 1.00 0.00 H ATOM 2670 HE2 LYS B 72 -8.232 31.361 24.776 1.00 0.00 H ATOM 2671 HE3 LYS B 72 -7.416 32.941 24.798 1.00 0.00 H ATOM 2672 HZ1 LYS B 72 -9.498 32.033 26.683 1.00 0.00 H ATOM 2673 HZ2 LYS B 72 -8.719 33.543 26.703 1.00 0.00 H ATOM 2674 HZ3 LYS B 72 -9.711 33.117 25.391 1.00 0.00 H ATOM 2675 H LYS B 72 -5.612 30.420 31.150 1.00 0.00 H ATOM 2676 N GLY B 73 -5.013 27.384 28.911 1.00 9.14 N ATOM 2677 CA GLY B 73 -3.770 26.659 28.939 1.00 8.53 C ATOM 2678 C GLY B 73 -3.801 25.334 28.219 1.00 9.85 C ATOM 2679 O GLY B 73 -4.815 24.870 27.702 1.00 7.77 O ATOM 2680 HA3 GLY B 73 -3.507 26.474 29.981 1.00 0.00 H ATOM 2681 HA2 GLY B 73 -3.003 27.280 28.476 1.00 0.00 H ATOM 2682 H GLY B 73 -5.847 26.987 28.433 1.00 0.00 H ATOM 2683 N THR B 74 -2.591 24.795 28.106 1.00 10.94 N ATOM 2684 CA THR B 74 -2.441 23.499 27.504 1.00 11.53 C ATOM 2685 C THR B 74 -2.824 22.354 28.422 1.00 11.93 C ATOM 2686 O THR B 74 -2.295 22.290 29.537 1.00 11.65 O ATOM 2687 CB THR B 74 -0.978 23.324 27.032 1.00 11.67 C ATOM 2688 OG1 THR B 74 -0.651 24.417 26.173 1.00 11.70 O ATOM 2689 CG2 THR B 74 -0.786 22.025 26.286 1.00 9.33 C ATOM 2690 HA THR B 74 -3.131 23.459 26.661 1.00 0.00 H ATOM 2691 HB THR B 74 -0.326 23.304 27.906 1.00 0.00 H ATOM 2692 HG1 THR B 74 -0.749 25.267 26.671 1.00 0.00 H ATOM 2693 HG23 THR B 74 -1.036 21.191 26.942 1.00 0.00 H ATOM 2694 HG21 THR B 74 -1.437 22.010 25.412 1.00 0.00 H ATOM 2695 HG22 THR B 74 0.253 21.940 25.968 1.00 0.00 H ATOM 2696 H THR B 74 -1.756 25.310 28.452 1.00 0.00 H ATOM 2697 N ILE B 75 -3.830 21.556 28.087 1.00 13.52 N ATOM 2698 CA ILE B 75 -4.155 20.425 28.933 1.00 15.17 C ATOM 2699 C ILE B 75 -3.974 19.220 27.935 1.00 15.79 C ATOM 2700 O ILE B 75 -4.208 19.330 26.705 1.00 14.06 O ATOM 2701 CB ILE B 75 -5.622 20.374 29.594 1.00 14.01 C ATOM 2702 CG1 ILE B 75 -6.600 20.451 28.544 1.00 15.80 C ATOM 2703 CG2 ILE B 75 -5.866 21.412 30.652 1.00 12.93 C ATOM 2704 CD1 ILE B 75 -7.064 18.984 28.639 1.00 17.67 C ATOM 2705 HA ILE B 75 -3.525 20.443 29.822 1.00 0.00 H ATOM 2706 HB ILE B 75 -5.705 19.427 30.127 1.00 0.00 H ATOM 2707 HG12 ILE B 75 -7.398 21.160 28.764 1.00 0.00 H ATOM 2708 HG13 ILE B 75 -6.160 20.691 27.576 1.00 0.00 H ATOM 2709 HD11 ILE B 75 -6.218 18.324 28.448 1.00 0.00 H ATOM 2710 HD12 ILE B 75 -7.458 18.793 29.637 1.00 0.00 H ATOM 2711 HD13 ILE B 75 -7.843 18.802 27.899 1.00 0.00 H ATOM 2712 HG21 ILE B 75 -5.148 21.279 31.462 1.00 0.00 H ATOM 2713 HG22 ILE B 75 -5.748 22.405 30.219 1.00 0.00 H ATOM 2714 HG23 ILE B 75 -6.878 21.302 31.040 1.00 0.00 H ATOM 2715 H ILE B 75 -4.381 21.741 27.224 1.00 0.00 H ATOM 2716 N MET B 76 -3.493 18.087 28.498 1.00 14.52 N ATOM 2717 CA MET B 76 -3.223 16.822 27.802 1.00 13.13 C ATOM 2718 C MET B 76 -4.317 15.872 28.236 1.00 12.62 C ATOM 2719 O MET B 76 -4.742 15.872 29.395 1.00 12.24 O ATOM 2720 CB MET B 76 -1.961 16.129 28.226 1.00 12.37 C ATOM 2721 CG MET B 76 -0.674 16.928 28.231 1.00 12.55 C ATOM 2722 SD MET B 76 -0.039 17.105 26.545 1.00 16.03 S ATOM 2723 CE MET B 76 1.371 18.027 27.031 1.00 14.74 C ATOM 2724 HA MET B 76 -3.155 17.055 26.739 1.00 0.00 H ATOM 2725 HB2 MET B 76 -2.118 15.762 29.240 1.00 0.00 H ATOM 2726 HB3 MET B 76 -1.814 15.283 27.554 1.00 0.00 H ATOM 2727 HG2 MET B 76 0.067 16.413 28.843 1.00 0.00 H ATOM 2728 HG3 MET B 76 -0.865 17.916 28.649 1.00 0.00 H ATOM 2729 HE1 MET B 76 1.051 18.943 27.528 1.00 0.00 H ATOM 2730 HE2 MET B 76 1.974 17.432 27.717 1.00 0.00 H ATOM 2731 HE3 MET B 76 1.961 18.277 26.150 1.00 0.00 H ATOM 2732 H MET B 76 -3.296 18.115 29.519 1.00 0.00 H ATOM 2733 N THR B 77 -4.849 15.133 27.302 1.00 12.15 N ATOM 2734 CA THR B 77 -5.880 14.164 27.561 1.00 14.02 C ATOM 2735 C THR B 77 -5.122 12.849 27.525 1.00 13.19 C ATOM 2736 O THR B 77 -4.220 12.718 26.705 1.00 13.31 O ATOM 2737 CB THR B 77 -6.893 14.374 26.451 1.00 16.12 C ATOM 2738 OG1 THR B 77 -7.954 15.062 27.132 1.00 20.14 O ATOM 2739 CG2 THR B 77 -7.271 13.121 25.649 1.00 18.47 C ATOM 2740 HA THR B 77 -6.431 14.218 28.500 1.00 0.00 H ATOM 2741 HB THR B 77 -6.505 14.956 25.615 1.00 0.00 H ATOM 2742 HG1 THR B 77 -8.685 15.254 26.492 1.00 0.00 H ATOM 2743 HG23 THR B 77 -6.376 12.703 25.188 1.00 0.00 H ATOM 2744 HG21 THR B 77 -7.715 12.384 26.318 1.00 0.00 H ATOM 2745 HG22 THR B 77 -7.989 13.390 24.874 1.00 0.00 H ATOM 2746 H THR B 77 -4.512 15.250 26.325 1.00 0.00 H ATOM 2747 N GLY B 78 -5.429 11.907 28.409 1.00 13.65 N ATOM 2748 CA GLY B 78 -4.765 10.618 28.501 1.00 14.84 C ATOM 2749 C GLY B 78 -5.423 9.774 29.599 1.00 16.45 C ATOM 2750 O GLY B 78 -6.245 10.235 30.407 1.00 15.28 O ATOM 2751 HA3 GLY B 78 -3.713 10.769 28.741 1.00 0.00 H ATOM 2752 HA2 GLY B 78 -4.848 10.099 27.546 1.00 0.00 H ATOM 2753 H GLY B 78 -6.197 12.105 29.081 1.00 0.00 H ATOM 2754 N ASP B 79 -5.102 8.488 29.630 1.00 18.47 N ATOM 2755 CA ASP B 79 -5.657 7.580 30.648 1.00 21.54 C ATOM 2756 C ASP B 79 -4.748 7.699 31.868 1.00 19.73 C ATOM 2757 O ASP B 79 -3.733 7.011 32.018 1.00 21.40 O ATOM 2758 CB ASP B 79 -5.676 6.105 30.149 1.00 23.29 C ATOM 2759 CG ASP B 79 -6.230 5.992 28.707 1.00 28.46 C ATOM 2760 OD1 ASP B 79 -7.363 6.469 28.398 1.00 30.02 O ATOM 2761 OD2 ASP B 79 -5.489 5.433 27.874 1.00 31.07 O ATOM 2762 HA ASP B 79 -6.688 7.851 30.876 1.00 0.00 H ATOM 2763 HB2 ASP B 79 -4.659 5.713 30.168 1.00 0.00 H ATOM 2764 HB3 ASP B 79 -6.305 5.515 30.816 1.00 0.00 H ATOM 2765 H ASP B 79 -4.443 8.112 28.919 1.00 0.00 H ATOM 2766 N THR B 80 -5.026 8.766 32.587 1.00 17.64 N ATOM 2767 CA THR B 80 -4.287 9.061 33.789 1.00 17.14 C ATOM 2768 C THR B 80 -5.147 8.530 34.962 1.00 16.63 C ATOM 2769 O THR B 80 -6.386 8.673 34.941 1.00 15.93 O ATOM 2770 CB THR B 80 -4.075 10.575 33.843 1.00 16.33 C ATOM 2771 OG1 THR B 80 -3.453 10.822 35.107 1.00 12.49 O ATOM 2772 CG2 THR B 80 -5.376 11.382 33.618 1.00 16.51 C ATOM 2773 HA THR B 80 -3.303 8.593 33.832 1.00 0.00 H ATOM 2774 HB THR B 80 -3.442 10.919 33.025 1.00 0.00 H ATOM 2775 HG1 THR B 80 -4.050 10.512 35.833 1.00 0.00 H ATOM 2776 HG23 THR B 80 -5.787 11.140 32.638 1.00 0.00 H ATOM 2777 HG21 THR B 80 -6.100 11.125 34.391 1.00 0.00 H ATOM 2778 HG22 THR B 80 -5.154 12.448 33.667 1.00 0.00 H ATOM 2779 H THR B 80 -5.789 9.405 32.284 1.00 0.00 H ATOM 2780 N PRO B 81 -4.576 7.895 36.000 1.00 16.11 N ATOM 2781 CA PRO B 81 -5.314 7.491 37.199 1.00 15.84 C ATOM 2782 C PRO B 81 -5.752 8.664 38.042 1.00 15.32 C ATOM 2783 O PRO B 81 -6.633 8.464 38.868 1.00 17.40 O ATOM 2784 CB PRO B 81 -4.396 6.579 37.967 1.00 14.31 C ATOM 2785 CG PRO B 81 -3.026 7.134 37.592 1.00 16.53 C ATOM 2786 CD PRO B 81 -3.188 7.462 36.089 1.00 16.36 C ATOM 2787 HA PRO B 81 -6.240 6.989 36.918 1.00 0.00 H ATOM 2788 HD3 PRO B 81 -2.508 8.258 35.785 1.00 0.00 H ATOM 2789 HD2 PRO B 81 -3.011 6.580 35.473 1.00 0.00 H ATOM 2790 HG3 PRO B 81 -2.244 6.391 37.750 1.00 0.00 H ATOM 2791 HG2 PRO B 81 -2.795 8.031 38.167 1.00 0.00 H ATOM 2792 HB2 PRO B 81 -4.573 6.648 39.040 1.00 0.00 H ATOM 2793 HB3 PRO B 81 -4.506 5.543 37.648 1.00 0.00 H ATOM 2794 N ILE B 82 -5.163 9.858 37.915 1.00 14.67 N ATOM 2795 CA ILE B 82 -5.527 11.030 38.696 1.00 12.39 C ATOM 2796 C ILE B 82 -5.507 12.208 37.716 1.00 11.20 C ATOM 2797 O ILE B 82 -4.580 12.334 36.915 1.00 10.38 O ATOM 2798 CB ILE B 82 -4.507 11.422 39.828 1.00 13.14 C ATOM 2799 CG1 ILE B 82 -3.683 10.274 40.394 1.00 15.50 C ATOM 2800 CG2 ILE B 82 -5.365 12.044 40.953 1.00 13.88 C ATOM 2801 CD1 ILE B 82 -2.422 9.887 39.629 1.00 18.84 C ATOM 2802 HA ILE B 82 -6.481 10.808 39.174 1.00 0.00 H ATOM 2803 HB ILE B 82 -3.764 12.096 39.401 1.00 0.00 H ATOM 2804 HG12 ILE B 82 -3.383 10.550 41.405 1.00 0.00 H ATOM 2805 HG13 ILE B 82 -4.327 9.395 40.435 1.00 0.00 H ATOM 2806 HD11 ILE B 82 -2.691 9.585 38.617 1.00 0.00 H ATOM 2807 HD12 ILE B 82 -1.747 10.742 39.588 1.00 0.00 H ATOM 2808 HD13 ILE B 82 -1.930 9.058 40.138 1.00 0.00 H ATOM 2809 HG21 ILE B 82 -5.890 12.918 40.567 1.00 0.00 H ATOM 2810 HG22 ILE B 82 -6.090 11.309 41.304 1.00 0.00 H ATOM 2811 HG23 ILE B 82 -4.719 12.342 41.779 1.00 0.00 H ATOM 2812 H ILE B 82 -4.399 9.954 37.216 1.00 0.00 H ATOM 2813 N ASN B 83 -6.477 13.103 37.822 1.00 9.10 N ATOM 2814 CA ASN B 83 -6.560 14.248 36.965 1.00 9.73 C ATOM 2815 C ASN B 83 -5.640 15.230 37.611 1.00 8.72 C ATOM 2816 O ASN B 83 -5.787 15.557 38.774 1.00 7.93 O ATOM 2817 CB ASN B 83 -7.954 14.791 36.920 1.00 11.28 C ATOM 2818 CG ASN B 83 -8.863 13.900 36.101 1.00 12.08 C ATOM 2819 OD1 ASN B 83 -8.542 13.288 35.074 1.00 12.74 O ATOM 2820 ND2 ASN B 83 -10.058 13.791 36.619 1.00 13.59 N ATOM 2821 HA ASN B 83 -6.295 14.020 35.933 1.00 0.00 H ATOM 2822 HB2 ASN B 83 -8.343 14.858 37.936 1.00 0.00 H ATOM 2823 HB3 ASN B 83 -7.934 15.785 36.474 1.00 0.00 H ATOM 2824 HD22 ASN B 83 -10.300 14.317 37.483 1.00 0.00 H ATOM 2825 HD21 ASN B 83 -10.767 13.178 36.167 1.00 0.00 H ATOM 2826 H ASN B 83 -7.204 12.970 38.553 1.00 0.00 H ATOM 2827 N ILE B 84 -4.659 15.663 36.834 1.00 9.33 N ATOM 2828 CA ILE B 84 -3.639 16.580 37.271 1.00 8.90 C ATOM 2829 C ILE B 84 -3.561 17.960 36.666 1.00 10.09 C ATOM 2830 O ILE B 84 -3.579 18.078 35.445 1.00 10.19 O ATOM 2831 CB ILE B 84 -2.285 15.848 37.068 1.00 6.65 C ATOM 2832 CG1 ILE B 84 -2.255 14.626 37.974 1.00 8.48 C ATOM 2833 CG2 ILE B 84 -1.123 16.821 37.275 1.00 5.51 C ATOM 2834 CD1 ILE B 84 -1.118 13.602 37.809 1.00 8.53 C ATOM 2835 HA ILE B 84 -3.904 16.819 38.301 1.00 0.00 H ATOM 2836 HB ILE B 84 -2.175 15.487 36.046 1.00 0.00 H ATOM 2837 HG12 ILE B 84 -2.211 14.990 39.000 1.00 0.00 H ATOM 2838 HG13 ILE B 84 -3.192 14.091 37.820 1.00 0.00 H ATOM 2839 HD11 ILE B 84 -1.142 13.193 36.799 1.00 0.00 H ATOM 2840 HD12 ILE B 84 -0.160 14.094 37.980 1.00 0.00 H ATOM 2841 HD13 ILE B 84 -1.249 12.796 38.531 1.00 0.00 H ATOM 2842 HG21 ILE B 84 -1.200 17.636 36.555 1.00 0.00 H ATOM 2843 HG22 ILE B 84 -1.164 17.224 38.287 1.00 0.00 H ATOM 2844 HG23 ILE B 84 -0.180 16.295 37.130 1.00 0.00 H ATOM 2845 H ILE B 84 -4.623 15.321 35.852 1.00 0.00 H ATOM 2846 N PHE B 85 -3.440 18.996 37.497 1.00 10.60 N ATOM 2847 CA PHE B 85 -3.303 20.357 37.018 1.00 8.08 C ATOM 2848 C PHE B 85 -1.893 20.678 37.457 1.00 7.21 C ATOM 2849 O PHE B 85 -1.667 20.843 38.658 1.00 7.12 O ATOM 2850 CB PHE B 85 -4.221 21.305 37.702 1.00 9.60 C ATOM 2851 CG PHE B 85 -5.446 21.653 36.894 1.00 9.35 C ATOM 2852 CD1 PHE B 85 -5.947 20.769 35.970 1.00 7.60 C ATOM 2853 CD2 PHE B 85 -6.063 22.868 37.164 1.00 10.88 C ATOM 2854 CE1 PHE B 85 -7.101 21.116 35.316 1.00 7.87 C ATOM 2855 CE2 PHE B 85 -7.221 23.205 36.501 1.00 10.54 C ATOM 2856 CZ PHE B 85 -7.735 22.320 35.580 1.00 8.92 C ATOM 2857 HA PHE B 85 -3.520 20.444 35.954 1.00 0.00 H ATOM 2858 HB2 PHE B 85 -4.544 20.855 38.641 1.00 0.00 H ATOM 2859 HB3 PHE B 85 -3.674 22.224 37.911 1.00 0.00 H ATOM 2860 HD2 PHE B 85 -5.632 23.551 37.897 1.00 0.00 H ATOM 2861 HE2 PHE B 85 -7.721 24.153 36.701 1.00 0.00 H ATOM 2862 HZ PHE B 85 -8.654 22.570 35.050 1.00 0.00 H ATOM 2863 HE1 PHE B 85 -7.526 20.435 34.578 1.00 0.00 H ATOM 2864 HD1 PHE B 85 -5.444 19.824 35.764 1.00 0.00 H ATOM 2865 H PHE B 85 -3.444 18.822 38.522 1.00 0.00 H ATOM 2866 N GLY B 86 -0.974 20.694 36.492 1.00 5.44 N ATOM 2867 CA GLY B 86 0.416 20.954 36.738 1.00 5.37 C ATOM 2868 C GLY B 86 0.752 22.452 36.747 1.00 7.05 C ATOM 2869 O GLY B 86 -0.075 23.369 36.621 1.00 6.90 O ATOM 2870 HA3 GLY B 86 1.004 20.470 35.958 1.00 0.00 H ATOM 2871 HA2 GLY B 86 0.683 20.532 37.707 1.00 0.00 H ATOM 2872 H GLY B 86 -1.278 20.509 35.515 1.00 0.00 H ATOM 2873 N ARG B 87 2.057 22.709 36.848 1.00 8.20 N ATOM 2874 CA ARG B 87 2.619 24.038 36.967 1.00 8.89 C ATOM 2875 C ARG B 87 2.203 25.000 35.886 1.00 9.18 C ATOM 2876 O ARG B 87 2.022 26.168 36.186 1.00 9.02 O ATOM 2877 CB ARG B 87 4.125 23.967 36.990 1.00 7.20 C ATOM 2878 CG ARG B 87 4.639 23.438 38.336 1.00 6.83 C ATOM 2879 CD ARG B 87 6.133 23.553 38.395 1.00 5.19 C ATOM 2880 NE ARG B 87 6.790 22.888 37.265 1.00 8.09 N ATOM 2881 CZ ARG B 87 7.559 23.501 36.359 1.00 6.34 C ATOM 2882 NH1 ARG B 87 7.724 24.810 36.351 1.00 4.99 N ATOM 2883 NH2 ARG B 87 8.116 22.793 35.403 1.00 2.29 N ATOM 2884 HA ARG B 87 2.220 24.427 37.904 1.00 0.00 H ATOM 2885 HB2 ARG B 87 4.461 23.301 36.195 1.00 0.00 H ATOM 2886 HB3 ARG B 87 4.530 24.965 36.822 1.00 0.00 H ATOM 2887 HG2 ARG B 87 4.199 24.021 39.145 1.00 0.00 H ATOM 2888 HG3 ARG B 87 4.352 22.392 38.446 1.00 0.00 H ATOM 2889 HD2 ARG B 87 6.483 23.098 39.321 1.00 0.00 H ATOM 2890 HD3 ARG B 87 6.404 24.609 38.386 1.00 0.00 H ATOM 2891 HE ARG B 87 6.647 21.863 37.161 1.00 0.00 H ATOM 2892 HH12 ARG B 87 8.330 25.253 35.631 1.00 0.00 H ATOM 2893 HH11 ARG B 87 7.248 25.398 37.065 1.00 0.00 H ATOM 2894 HH22 ARG B 87 8.716 23.259 34.693 1.00 0.00 H ATOM 2895 HH21 ARG B 87 7.957 21.766 35.356 1.00 0.00 H ATOM 2896 H ARG B 87 2.713 21.902 36.841 1.00 0.00 H ATOM 2897 N ASN B 88 1.941 24.557 34.659 1.00 10.38 N ATOM 2898 CA ASN B 88 1.545 25.492 33.635 1.00 11.86 C ATOM 2899 C ASN B 88 0.246 26.170 34.046 1.00 12.66 C ATOM 2900 O ASN B 88 0.070 27.366 33.805 1.00 16.57 O ATOM 2901 CB ASN B 88 1.371 24.795 32.257 1.00 13.09 C ATOM 2902 CG ASN B 88 0.227 23.812 32.173 1.00 12.69 C ATOM 2903 OD1 ASN B 88 0.009 23.066 33.112 1.00 14.10 O ATOM 2904 ND2 ASN B 88 -0.550 23.724 31.127 1.00 11.67 N ATOM 2905 HA ASN B 88 2.334 26.236 33.528 1.00 0.00 H ATOM 2906 HB2 ASN B 88 1.208 25.568 31.506 1.00 0.00 H ATOM 2907 HB3 ASN B 88 2.293 24.260 32.031 1.00 0.00 H ATOM 2908 HD22 ASN B 88 -0.392 24.345 30.308 1.00 0.00 H ATOM 2909 HD21 ASN B 88 -1.327 23.032 31.113 1.00 0.00 H ATOM 2910 H ASN B 88 2.021 23.543 34.440 1.00 0.00 H ATOM 2911 N LEU B 89 -0.657 25.479 34.719 1.00 11.79 N ATOM 2912 CA LEU B 89 -1.876 26.122 35.109 1.00 10.55 C ATOM 2913 C LEU B 89 -1.740 26.720 36.495 1.00 9.97 C ATOM 2914 O LEU B 89 -2.372 27.728 36.813 1.00 13.40 O ATOM 2915 CB LEU B 89 -3.015 25.119 35.053 1.00 9.64 C ATOM 2916 CG LEU B 89 -3.159 24.336 33.783 1.00 8.98 C ATOM 2917 CD1 LEU B 89 -4.393 23.507 33.928 1.00 8.57 C ATOM 2918 CD2 LEU B 89 -3.266 25.242 32.551 1.00 11.50 C ATOM 2919 HA LEU B 89 -2.094 26.937 34.419 1.00 0.00 H ATOM 2920 HB2 LEU B 89 -2.869 24.407 35.866 1.00 0.00 H ATOM 2921 HB3 LEU B 89 -3.945 25.665 35.212 1.00 0.00 H ATOM 2922 HG LEU B 89 -2.274 23.718 33.627 1.00 0.00 H ATOM 2923 HD21 LEU B 89 -4.138 25.888 32.651 1.00 0.00 H ATOM 2924 HD22 LEU B 89 -2.367 25.853 32.472 1.00 0.00 H ATOM 2925 HD23 LEU B 89 -3.369 24.627 31.657 1.00 0.00 H ATOM 2926 HD11 LEU B 89 -4.284 22.842 34.784 1.00 0.00 H ATOM 2927 HD12 LEU B 89 -5.252 24.160 34.081 1.00 0.00 H ATOM 2928 HD13 LEU B 89 -4.541 22.916 33.024 1.00 0.00 H ATOM 2929 H LEU B 89 -0.485 24.483 34.962 1.00 0.00 H ATOM 2930 N LEU B 90 -0.931 26.165 37.372 1.00 9.86 N ATOM 2931 CA LEU B 90 -0.771 26.709 38.708 1.00 9.44 C ATOM 2932 C LEU B 90 -0.164 28.108 38.625 1.00 10.10 C ATOM 2933 O LEU B 90 -0.698 29.041 39.243 1.00 11.05 O ATOM 2934 CB LEU B 90 0.086 25.712 39.516 1.00 9.29 C ATOM 2935 CG LEU B 90 -0.632 24.663 40.465 1.00 9.25 C ATOM 2936 CD1 LEU B 90 -2.025 24.273 39.951 1.00 9.50 C ATOM 2937 CD2 LEU B 90 0.254 23.445 40.610 1.00 6.23 C ATOM 2938 HA LEU B 90 -1.726 26.828 39.220 1.00 0.00 H ATOM 2939 HB2 LEU B 90 0.673 25.141 38.797 1.00 0.00 H ATOM 2940 HB3 LEU B 90 0.755 26.302 40.142 1.00 0.00 H ATOM 2941 HG LEU B 90 -0.784 25.126 41.440 1.00 0.00 H ATOM 2942 HD21 LEU B 90 0.422 23.000 39.629 1.00 0.00 H ATOM 2943 HD22 LEU B 90 1.209 23.742 41.044 1.00 0.00 H ATOM 2944 HD23 LEU B 90 -0.233 22.719 41.261 1.00 0.00 H ATOM 2945 HD11 LEU B 90 -2.652 25.163 39.894 1.00 0.00 H ATOM 2946 HD12 LEU B 90 -1.934 23.827 38.961 1.00 0.00 H ATOM 2947 HD13 LEU B 90 -2.475 23.553 40.635 1.00 0.00 H ATOM 2948 H LEU B 90 -0.394 25.317 37.101 1.00 0.00 H ATOM 2949 N THR B 91 0.865 28.328 37.804 1.00 10.90 N ATOM 2950 CA THR B 91 1.502 29.644 37.647 1.00 10.03 C ATOM 2951 C THR B 91 0.451 30.644 37.123 1.00 10.03 C ATOM 2952 O THR B 91 0.331 31.761 37.625 1.00 12.00 O ATOM 2953 CB THR B 91 2.654 29.563 36.652 1.00 9.06 C ATOM 2954 OG1 THR B 91 2.121 28.926 35.492 1.00 11.12 O ATOM 2955 CG2 THR B 91 3.831 28.817 37.166 1.00 9.15 C ATOM 2956 HA THR B 91 1.893 29.970 38.611 1.00 0.00 H ATOM 2957 HB THR B 91 3.031 30.565 36.444 1.00 0.00 H ATOM 2958 HG1 THR B 91 1.791 28.025 35.734 1.00 0.00 H ATOM 2959 HG23 THR B 91 4.221 29.321 38.050 1.00 0.00 H ATOM 2960 HG21 THR B 91 3.531 27.802 37.427 1.00 0.00 H ATOM 2961 HG22 THR B 91 4.602 28.783 36.396 1.00 0.00 H ATOM 2962 H THR B 91 1.234 27.530 37.248 1.00 0.00 H ATOM 2963 N ALA B 92 -0.360 30.212 36.160 1.00 9.50 N ATOM 2964 CA ALA B 92 -1.406 31.012 35.571 1.00 10.28 C ATOM 2965 C ALA B 92 -2.429 31.427 36.640 1.00 11.14 C ATOM 2966 O ALA B 92 -3.102 32.447 36.540 1.00 12.32 O ATOM 2967 CB ALA B 92 -2.073 30.190 34.492 1.00 7.76 C ATOM 2968 HA ALA B 92 -0.986 31.922 35.142 1.00 0.00 H ATOM 2969 HB1 ALA B 92 -1.336 29.918 33.736 1.00 0.00 H ATOM 2970 HB2 ALA B 92 -2.493 29.286 34.933 1.00 0.00 H ATOM 2971 HB3 ALA B 92 -2.869 30.775 34.031 1.00 0.00 H ATOM 2972 H ALA B 92 -0.232 29.240 35.812 1.00 0.00 H ATOM 2973 N LEU B 93 -2.618 30.620 37.681 1.00 13.25 N ATOM 2974 CA LEU B 93 -3.542 30.930 38.755 1.00 11.70 C ATOM 2975 C LEU B 93 -2.860 31.869 39.713 1.00 11.84 C ATOM 2976 O LEU B 93 -3.511 32.586 40.447 1.00 13.14 O ATOM 2977 CB LEU B 93 -3.926 29.669 39.487 1.00 11.49 C ATOM 2978 CG LEU B 93 -4.986 28.799 38.851 1.00 11.23 C ATOM 2979 CD1 LEU B 93 -4.957 27.435 39.505 1.00 11.57 C ATOM 2980 CD2 LEU B 93 -6.353 29.423 39.031 1.00 11.61 C ATOM 2981 HA LEU B 93 -4.441 31.389 38.344 1.00 0.00 H ATOM 2982 HB2 LEU B 93 -3.026 29.064 39.594 1.00 0.00 H ATOM 2983 HB3 LEU B 93 -4.287 29.959 40.474 1.00 0.00 H ATOM 2984 HG LEU B 93 -4.785 28.704 37.784 1.00 0.00 H ATOM 2985 HD21 LEU B 93 -6.567 29.526 40.095 1.00 0.00 H ATOM 2986 HD22 LEU B 93 -6.367 30.406 38.559 1.00 0.00 H ATOM 2987 HD23 LEU B 93 -7.106 28.785 38.568 1.00 0.00 H ATOM 2988 HD11 LEU B 93 -3.975 26.985 39.361 1.00 0.00 H ATOM 2989 HD12 LEU B 93 -5.157 27.540 40.571 1.00 0.00 H ATOM 2990 HD13 LEU B 93 -5.719 26.800 39.052 1.00 0.00 H ATOM 2991 H LEU B 93 -2.081 29.730 37.726 1.00 0.00 H ATOM 2992 N GLY B 94 -1.548 31.932 39.767 1.00 12.78 N ATOM 2993 CA GLY B 94 -0.889 32.775 40.736 1.00 13.22 C ATOM 2994 C GLY B 94 -0.611 31.990 42.024 1.00 14.23 C ATOM 2995 O GLY B 94 -0.442 32.595 43.088 1.00 14.93 O ATOM 2996 HA3 GLY B 94 -1.528 33.627 40.965 1.00 0.00 H ATOM 2997 HA2 GLY B 94 0.054 33.131 40.321 1.00 0.00 H ATOM 2998 H GLY B 94 -0.978 31.368 39.104 1.00 0.00 H ATOM 2999 N MET B 95 -0.483 30.655 41.942 1.00 13.61 N ATOM 3000 CA MET B 95 -0.247 29.827 43.108 1.00 14.11 C ATOM 3001 C MET B 95 1.210 29.744 43.470 1.00 14.39 C ATOM 3002 O MET B 95 2.125 29.760 42.638 1.00 16.33 O ATOM 3003 CB MET B 95 -0.754 28.434 42.913 1.00 14.32 C ATOM 3004 CG MET B 95 -2.224 28.531 43.157 1.00 16.44 C ATOM 3005 SD MET B 95 -2.917 26.875 43.029 1.00 19.93 S ATOM 3006 CE MET B 95 -3.447 26.653 44.699 1.00 18.76 C ATOM 3007 HA MET B 95 -0.792 30.312 43.918 1.00 0.00 H ATOM 3008 HB2 MET B 95 -0.554 28.090 41.898 1.00 0.00 H ATOM 3009 HB3 MET B 95 -0.290 27.752 43.625 1.00 0.00 H ATOM 3010 HG2 MET B 95 -2.681 29.183 42.412 1.00 0.00 H ATOM 3011 HG3 MET B 95 -2.409 28.934 44.153 1.00 0.00 H ATOM 3012 HE1 MET B 95 -2.587 26.728 45.365 1.00 0.00 H ATOM 3013 HE2 MET B 95 -4.174 27.424 44.954 1.00 0.00 H ATOM 3014 HE3 MET B 95 -3.906 25.670 44.806 1.00 0.00 H ATOM 3015 H MET B 95 -0.556 30.200 41.010 1.00 0.00 H ATOM 3016 N SER B 96 1.429 29.521 44.742 1.00 12.86 N ATOM 3017 CA SER B 96 2.770 29.456 45.212 1.00 10.68 C ATOM 3018 C SER B 96 2.816 28.405 46.288 1.00 10.53 C ATOM 3019 O SER B 96 1.782 28.115 46.896 1.00 10.74 O ATOM 3020 CB SER B 96 3.010 30.887 45.640 1.00 9.00 C ATOM 3021 OG SER B 96 4.043 31.158 46.562 1.00 16.21 O ATOM 3022 HA SER B 96 3.553 29.151 44.518 1.00 0.00 H ATOM 3023 HB2 SER B 96 2.082 31.249 46.083 1.00 0.00 H ATOM 3024 HB3 SER B 96 3.228 31.459 44.738 1.00 0.00 H ATOM 3025 HG SER B 96 3.867 30.671 47.406 1.00 0.00 H ATOM 3026 H SER B 96 0.633 29.393 45.399 1.00 0.00 H ATOM 3027 N LEU B 97 3.999 27.817 46.448 1.00 10.14 N ATOM 3028 CA LEU B 97 4.280 26.789 47.428 1.00 11.08 C ATOM 3029 C LEU B 97 5.035 27.610 48.449 1.00 12.36 C ATOM 3030 O LEU B 97 6.077 28.220 48.148 1.00 13.22 O ATOM 3031 CB LEU B 97 5.198 25.729 46.900 1.00 9.90 C ATOM 3032 CG LEU B 97 4.774 24.286 46.975 1.00 10.43 C ATOM 3033 CD1 LEU B 97 6.030 23.483 46.666 1.00 10.31 C ATOM 3034 CD2 LEU B 97 4.152 23.913 48.325 1.00 9.69 C ATOM 3035 HA LEU B 97 3.391 26.260 47.771 1.00 0.00 H ATOM 3036 HB2 LEU B 97 5.374 25.955 45.848 1.00 0.00 H ATOM 3037 HB3 LEU B 97 6.135 25.815 47.451 1.00 0.00 H ATOM 3038 HG LEU B 97 3.978 24.073 46.261 1.00 0.00 H ATOM 3039 HD21 LEU B 97 4.879 24.087 49.119 1.00 0.00 H ATOM 3040 HD22 LEU B 97 3.269 24.527 48.499 1.00 0.00 H ATOM 3041 HD23 LEU B 97 3.868 22.861 48.314 1.00 0.00 H ATOM 3042 HD11 LEU B 97 6.391 23.744 45.671 1.00 0.00 H ATOM 3043 HD12 LEU B 97 6.798 23.714 47.404 1.00 0.00 H ATOM 3044 HD13 LEU B 97 5.797 22.419 46.702 1.00 0.00 H ATOM 3045 H LEU B 97 4.776 28.117 45.825 1.00 0.00 H ATOM 3046 N ASN B 98 4.567 27.643 49.679 1.00 12.41 N ATOM 3047 CA ASN B 98 5.227 28.439 50.661 1.00 13.22 C ATOM 3048 C ASN B 98 5.578 27.787 51.928 1.00 13.88 C ATOM 3049 O ASN B 98 4.879 26.897 52.361 1.00 14.84 O ATOM 3050 CB ASN B 98 4.390 29.653 51.051 1.00 13.82 C ATOM 3051 CG ASN B 98 4.135 30.595 49.893 1.00 15.78 C ATOM 3052 OD1 ASN B 98 3.094 30.462 49.241 1.00 16.64 O ATOM 3053 ND2 ASN B 98 5.046 31.505 49.536 1.00 15.25 N ATOM 3054 HA ASN B 98 6.154 28.687 50.144 1.00 0.00 H ATOM 3055 HB2 ASN B 98 3.430 29.305 51.433 1.00 0.00 H ATOM 3056 HB3 ASN B 98 4.915 30.200 51.834 1.00 0.00 H ATOM 3057 HD22 ASN B 98 5.920 31.611 50.090 1.00 0.00 H ATOM 3058 HD21 ASN B 98 4.881 32.107 48.704 1.00 0.00 H ATOM 3059 H ASN B 98 3.722 27.092 49.933 1.00 0.00 H ATOM 3060 N LEU B 99 6.718 28.214 52.441 1.00 15.34 N ATOM 3061 CA LEU B 99 7.247 27.771 53.704 1.00 16.08 C ATOM 3062 C LEU B 99 7.391 29.122 54.424 1.00 18.21 C ATOM 3063 O LEU B 99 8.221 29.965 54.058 1.00 19.96 O ATOM 3064 CB LEU B 99 8.611 27.105 53.589 1.00 16.54 C ATOM 3065 CG LEU B 99 9.139 26.392 54.851 1.00 16.74 C ATOM 3066 CD1 LEU B 99 9.757 27.318 55.866 1.00 18.74 C ATOM 3067 CD2 LEU B 99 7.977 25.792 55.572 1.00 18.03 C ATOM 3068 HA LEU B 99 6.624 27.020 54.190 1.00 0.00 H ATOM 3069 OXT LEU B 99 6.604 29.365 55.336 1.00 20.91 O ATOM 3070 HB2 LEU B 99 8.552 26.365 52.791 1.00 0.00 H ATOM 3071 HB3 LEU B 99 9.333 27.875 53.317 1.00 0.00 H ATOM 3072 HG LEU B 99 9.886 25.682 54.495 1.00 0.00 H ATOM 3073 HD21 LEU B 99 7.278 26.580 55.852 1.00 0.00 H ATOM 3074 HD22 LEU B 99 7.476 25.076 54.920 1.00 0.00 H ATOM 3075 HD23 LEU B 99 8.331 25.283 56.468 1.00 0.00 H ATOM 3076 HD11 LEU B 99 10.601 27.839 55.414 1.00 0.00 H ATOM 3077 HD12 LEU B 99 9.013 28.044 56.194 1.00 0.00 H ATOM 3078 HD13 LEU B 99 10.103 26.738 56.722 1.00 0.00 H ATOM 3079 H LEU B 99 7.266 28.912 51.900 1.00 0.00 H TER 3080 LEU B 99 HETATM 3081 O HOH 1 2.923 31.788 40.769 1.00 16.81 O HETATM 3082 O HOH 2 9.124 26.661 41.935 1.00 14.08 O HETATM 3083 O HOH 3 10.683 29.475 42.251 1.00 7.77 O HETATM 3084 O HOH 4 17.370 22.587 51.724 1.00 13.08 O HETATM 3085 O HOH 5 20.164 20.176 53.102 1.00 25.18 O HETATM 3086 O HOH 6 19.159 10.364 43.947 1.00 21.82 O HETATM 3087 O HOH 7 8.840 0.132 57.449 1.00 22.84 O HETATM 3088 O HOH 8 18.179 3.522 46.588 1.00 27.17 O HETATM 3089 O HOH 9 12.183 1.065 58.420 1.00 14.80 O HETATM 3090 O HOH 10 1.440 1.972 49.090 1.00 29.74 O HETATM 3091 O HOH 11 -1.730 4.674 34.412 1.00 28.04 O HETATM 3092 O HOH 12 17.696 7.517 61.192 1.00 33.69 O HETATM 3093 O HOH 13 6.534 10.961 57.314 1.00 11.74 O HETATM 3094 O HOH 14 6.646 8.115 52.446 1.00 6.49 O HETATM 3095 O HOH 15 20.603 14.573 56.997 1.00 32.61 O HETATM 3096 O HOH 16 26.420 15.750 54.312 1.00 38.08 O HETATM 3097 O HOH 17 -1.543 14.461 46.906 1.00 16.64 O HETATM 3098 O HOH 18 -1.950 11.990 45.434 1.00 11.63 O HETATM 3099 O HOH 19 0.592 11.463 53.040 1.00 18.50 O HETATM 3100 O HOH 20 5.351 -6.425 41.115 1.00 23.30 O HETATM 3101 O HOH 21 17.585 1.567 50.349 1.00 21.94 O HETATM 3102 O HOH 22 1.172 21.861 55.647 1.00 22.71 O HETATM 3103 O HOH 23 2.945 9.918 38.157 1.00 4.45 O HETATM 3104 O HOH 24 -4.534 20.052 50.744 1.00 10.17 O HETATM 3105 O HOH 25 -6.744 13.121 51.044 1.00 7.64 O HETATM 3106 O HOH 26 -12.922 25.251 41.951 1.00 18.02 O HETATM 3107 O HOH 27 -14.965 25.105 38.910 1.00 27.78 O HETATM 3108 O HOH 28 7.102 20.108 38.481 1.00 13.37 O HETATM 3109 O HOH 29 7.829 17.692 37.343 1.00 9.53 O HETATM 3110 O HOH 30 -1.949 26.999 25.917 1.00 14.88 O HETATM 3111 O HOH 31 -1.534 31.519 30.416 1.00 30.03 O HETATM 3112 O HOH 32 -0.408 26.102 29.569 1.00 10.60 O HETATM 3113 O HOH 33 0.877 30.225 32.657 1.00 25.37 O HETATM 3114 O HOH 34 6.956 18.722 30.221 1.00 30.77 O HETATM 3115 N PSI A 35 6.321 16.347 32.389 1.00 0.24 N HETATM 3116 CA1 PSI A 35 6.178 15.157 33.219 1.00 0.06 C HETATM 3117 C1 PSI A 35 5.100 15.411 34.260 1.00 0.23 C HETATM 3118 N2 PSI A 35 4.553 14.387 34.822 1.00 -0.26 N HETATM 3119 CA2 PSI A 35 3.522 14.546 35.801 1.00 0.13 C HETATM 3120 C2 PSI A 35 3.760 13.525 36.914 1.00 0.20 C HETATM 3121 N3 PSI A 35 4.215 13.948 38.082 1.00 -0.28 N HETATM 3122 CA3 PSI A 35 4.452 13.011 39.177 1.00 0.08 C HETATM 3123 C3 PSI A 35 3.343 13.125 40.233 1.00 0.08 C HETATM 3124 CX4 PSI A 35 1.969 12.755 39.784 1.00 -0.01 C HETATM 3125 CA4 PSI A 35 1.117 12.378 40.951 1.00 0.04 C HETATM 3126 C4 PSI A 35 1.527 11.000 41.451 1.00 0.18 C HETATM 3127 N5 PSI A 35 1.524 10.780 42.758 1.00 -0.27 N HETATM 3128 CA5 PSI A 35 1.882 9.476 43.227 1.00 0.13 C HETATM 3129 C5 PSI A 35 0.831 9.202 44.272 1.00 0.20 C HETATM 3130 N6 PSI A 35 0.187 8.063 44.137 1.00 -0.26 N HETATM 3131 CA6 PSI A 35 -0.835 7.623 45.077 1.00 0.14 C HETATM 3132 C6 PSI A 35 -0.358 6.263 45.627 1.00 0.26 C HETATM 3133 OM6 PSI A 35 -1.036 5.602 46.676 1.00 -0.28 O HETATM 3134 CM6 PSI A 35 -0.146 5.010 47.645 1.00 0.07 C HETATM 3135 H46 PSI A 35 -0.736 4.514 48.430 1.00 0.06 H HETATM 3136 H47 PSI A 35 0.479 5.795 48.096 1.00 0.06 H HETATM 3137 H48 PSI A 35 0.498 4.270 47.148 1.00 0.06 H HETATM 3138 O6 PSI A 35 0.661 5.687 45.229 1.00 -0.37 O HETATM 3139 CB6 PSI A 35 -2.213 7.472 44.394 1.00 -0.00 C HETATM 3140 CG62 PSI A 35 -2.156 6.412 43.315 1.00 -0.06 C HETATM 3141 H43 PSI A 35 -1.831 5.458 43.755 1.00 0.02 H HETATM 3142 H44 PSI A 35 -1.441 6.719 42.537 1.00 0.02 H HETATM 3143 H45 PSI A 35 -3.154 6.289 42.868 1.00 0.02 H HETATM 3144 CG61 PSI A 35 -2.652 8.832 43.888 1.00 -0.06 C HETATM 3145 H40 PSI A 35 -3.633 8.742 43.398 1.00 0.02 H HETATM 3146 H41 PSI A 35 -1.914 9.210 43.165 1.00 0.02 H HETATM 3147 H42 PSI A 35 -2.727 9.531 44.734 1.00 0.02 H HETATM 3148 H39 PSI A 35 -2.942 7.140 45.147 1.00 0.03 H HETATM 3149 H38 PSI A 35 -0.922 8.351 45.897 1.00 0.08 H HETATM 3150 H37 PSI A 35 0.408 7.476 43.358 1.00 0.19 H HETATM 3151 O5 PSI A 35 0.594 9.973 45.206 1.00 -0.39 O HETATM 3152 CB5 PSI A 35 3.272 9.343 43.919 1.00 -0.01 C HETATM 3153 CG52 PSI A 35 4.425 9.805 43.038 1.00 -0.06 C HETATM 3154 H34 PSI A 35 4.301 10.872 42.802 1.00 0.02 H HETATM 3155 H35 PSI A 35 4.431 9.221 42.106 1.00 0.02 H HETATM 3156 H36 PSI A 35 5.376 9.655 43.570 1.00 0.02 H HETATM 3157 CG51 PSI A 35 3.512 7.866 44.202 1.00 -0.06 C HETATM 3158 H31 PSI A 35 4.489 7.741 44.692 1.00 0.02 H HETATM 3159 H32 PSI A 35 3.502 7.305 43.256 1.00 0.02 H HETATM 3160 H33 PSI A 35 2.719 7.486 44.863 1.00 0.02 H HETATM 3161 H30 PSI A 35 3.269 9.921 44.855 1.00 0.03 H HETATM 3162 H29 PSI A 35 1.828 8.755 42.398 1.00 0.08 H HETATM 3163 H28 PSI A 35 1.278 11.506 43.400 1.00 0.19 H HETATM 3164 O4 PSI A 35 1.845 10.122 40.635 1.00 -0.40 O HETATM 3165 H26 PSI A 35 0.061 12.358 40.643 1.00 0.05 H HETATM 3166 H27 PSI A 35 1.250 13.115 41.756 1.00 0.05 H HETATM 3167 H24 PSI A 35 2.032 11.902 39.093 1.00 0.03 H HETATM 3168 H25 PSI A 35 1.514 13.613 39.267 1.00 0.03 H HETATM 3169 O3 PSI A 35 3.227 14.460 40.705 1.00 -0.39 O HETATM 3170 H23 PSI A 35 4.075 14.762 41.010 1.00 0.21 H HETATM 3171 H22 PSI A 35 3.622 12.466 41.069 1.00 0.06 H HETATM 3172 CB3 PSI A 35 5.822 13.315 39.752 1.00 0.01 C HETATM 3173 CG3 PSI A 35 6.911 13.067 38.732 1.00 -0.04 C HETATM 3174 CD32 PSI A 35 7.268 11.774 38.425 1.00 -0.06 C HETATM 3175 CE32 PSI A 35 8.269 11.582 37.501 1.00 -0.07 C HETATM 3176 CZ3 PSI A 35 8.899 12.661 36.898 1.00 -0.07 C HETATM 3177 CE31 PSI A 35 8.541 13.949 37.210 1.00 -0.07 C HETATM 3178 CD31 PSI A 35 7.542 14.143 38.131 1.00 -0.06 C HETATM 3179 H17 PSI A 35 7.243 15.152 38.391 1.00 0.06 H HETATM 3180 H19 PSI A 35 9.035 14.792 36.741 1.00 0.06 H HETATM 3181 H21 PSI A 35 9.684 12.485 36.171 1.00 0.06 H HETATM 3182 H20 PSI A 35 8.570 10.574 37.240 1.00 0.06 H HETATM 3183 H18 PSI A 35 6.775 10.932 38.897 1.00 0.06 H HETATM 3184 H15 PSI A 35 5.995 12.670 40.626 1.00 0.04 H HETATM 3185 H16 PSI A 35 5.855 14.370 40.062 1.00 0.04 H HETATM 3186 H14 PSI A 35 4.450 11.984 38.782 1.00 0.06 H HETATM 3187 H13 PSI A 35 4.399 14.922 38.217 1.00 0.19 H HETATM 3188 O2 PSI A 35 3.546 12.322 36.761 1.00 -0.39 O HETATM 3189 CB2 PSI A 35 2.205 14.311 35.105 1.00 -0.02 C HETATM 3190 H10 PSI A 35 1.383 14.425 35.827 1.00 0.03 H HETATM 3191 H11 PSI A 35 2.188 13.294 34.687 1.00 0.03 H HETATM 3192 H12 PSI A 35 2.083 15.043 34.293 1.00 0.03 H HETATM 3193 H9 PSI A 35 3.544 15.562 36.222 1.00 0.08 H HETATM 3194 H8 PSI A 35 4.854 13.467 34.569 1.00 0.19 H HETATM 3195 O1 PSI A 35 4.745 16.562 34.542 1.00 -0.39 O HETATM 3196 CB1 PSI A 35 7.468 14.826 33.945 1.00 -0.00 C HETATM 3197 H5 PSI A 35 7.322 13.925 34.559 1.00 0.03 H HETATM 3198 H6 PSI A 35 7.751 15.669 34.592 1.00 0.03 H HETATM 3199 H7 PSI A 35 8.266 14.643 33.210 1.00 0.03 H HETATM 3200 H4 PSI A 35 5.890 14.306 32.584 1.00 0.11 H HETATM 3201 H1 PSI A 35 7.034 16.189 31.695 1.00 0.20 H HETATM 3202 H2 PSI A 35 6.583 17.130 32.967 1.00 0.20 H HETATM 3203 H3 PSI A 35 5.445 16.545 31.931 1.00 0.20 H CONECT 3115 3116 3201 3202 3203 CONECT 3116 3115 3117 3196 3200 CONECT 3117 3116 3118 3195 CONECT 3118 3117 3119 3194 CONECT 3119 3118 3120 3189 3193 CONECT 3120 3119 3121 3188 CONECT 3121 3120 3122 3187 CONECT 3122 3121 3123 3172 3186 CONECT 3123 3122 3124 3169 3171 CONECT 3124 3123 3125 3167 3168 CONECT 3125 3124 3126 3165 3166 CONECT 3126 3125 3127 3164 CONECT 3127 3126 3128 3163 CONECT 3128 3127 3129 3152 3162 CONECT 3129 3128 3130 3151 CONECT 3130 3129 3131 3150 CONECT 3131 3130 3132 3139 3149 CONECT 3132 3131 3133 3138 CONECT 3133 3132 3134 CONECT 3134 3133 3135 3136 3137 CONECT 3135 3134 CONECT 3136 3134 CONECT 3137 3134 CONECT 3138 3132 CONECT 3139 3131 3140 3144 3148 CONECT 3140 3139 3141 3142 3143 CONECT 3141 3140 CONECT 3142 3140 CONECT 3143 3140 CONECT 3144 3139 3145 3146 3147 CONECT 3145 3144 CONECT 3146 3144 CONECT 3147 3144 CONECT 3148 3139 CONECT 3149 3131 CONECT 3150 3130 CONECT 3151 3129 CONECT 3152 3128 3153 3157 3161 CONECT 3153 3152 3154 3155 3156 CONECT 3154 3153 CONECT 3155 3153 CONECT 3156 3153 CONECT 3157 3152 3158 3159 3160 CONECT 3158 3157 CONECT 3159 3157 CONECT 3160 3157 CONECT 3161 3152 CONECT 3162 3128 CONECT 3163 3127 CONECT 3164 3126 CONECT 3165 3125 CONECT 3166 3125 CONECT 3167 3124 CONECT 3168 3124 CONECT 3169 3123 3170 CONECT 3170 3169 CONECT 3171 3123 CONECT 3172 3122 3173 3184 3185 CONECT 3173 3172 3174 3178 CONECT 3174 3173 3175 3183 CONECT 3175 3174 3176 3182 CONECT 3176 3175 3177 3181 CONECT 3177 3176 3178 3180 CONECT 3178 3173 3177 3179 CONECT 3179 3178 CONECT 3180 3177 CONECT 3181 3176 CONECT 3182 3175 CONECT 3183 3174 CONECT 3184 3172 CONECT 3185 3172 CONECT 3186 3122 CONECT 3187 3121 CONECT 3188 3120 CONECT 3189 3119 3190 3191 3192 CONECT 3190 3189 CONECT 3191 3189 CONECT 3192 3189 CONECT 3193 3119 CONECT 3194 3118 CONECT 3195 3117 CONECT 3196 3116 3197 3198 3199 CONECT 3197 3196 CONECT 3198 3196 CONECT 3199 3196 CONECT 3200 3116 CONECT 3201 3115 CONECT 3202 3115 CONECT 3203 3115 MASTER 0 0 0 0 0 0 0 0 3201 2 89 16 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 1siv
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1tcw
RCSB PDB
PDBbind
99aa, >1TCW_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1aaq
RCSB PDB
PDBbind
PSI
1heg
RCSB PDB
PDBbind
PSI
Entry Information
PDB ID
1siv
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
SIV protease
Ligand Name
PSI
EC.Number
E.C.3.4.23.16
Resolution
2.5(Å)
Affinity (Kd/Ki/IC50)
Ki=8.4nM
Release Year
1994
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistry v32 pp. 13054-60, 1993
Ligand Properties
Formula
C
2
9
H
4
8
N
5
O
7
Molecular Weight
578.721
Exact Mass
578.355
No. of atoms
89
No. of bonds
89
Polar Surface Area
190.57
LOGP Value
1.79 (
Computed with XLOGP3
)
1.01 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 22
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 1
Canonical SMILES
COC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)CC[C@@H]([C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)Cc1ccccc1)O
InChI String
InChI=1S/C29H47N5O7/c1-16(2)24(28(39)34-25(17(3)4)29(40)41-7)33-23(36)14-13-22(35)21(15-20-11-9-8-10-12-20)32-27(38)19(6)31-26(37)18(5)30/h8-12,16-19,21-22,24-25,35H,13-15,30H2,1-7H3,(H,31,37)(H,32,38)(H,33,36)(H,34,39)/p+1/t18-,19-,21-,22-,24-,25-/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):
P05896
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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