Browse entries in the PDBbind-CN Database
HEADER 3GPO_COMPLEX COMPND 3GPO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 162 HIS HIS ALA PRO SER TYR ARG VAL LYS ARG MSE ASP ILE SEQRES 2 A 162 ALA LYS ASN ASP GLU GLU CYS VAL VAL ASN ALA ALA ASN SEQRES 3 A 162 PRO ARG GLY LEU PRO GLY ASP GLY VAL CYS LYS ALA VAL SEQRES 4 A 162 TYR LYS LYS TRP PRO GLU SER PHE LYS ASN SER ALA THR SEQRES 5 A 162 PRO VAL GLY THR ALA LYS THR VAL MSE CYS GLY THR TYR SEQRES 6 A 162 PRO VAL ILE HIS ALA VAL GLY PRO ASN PHE SER ASN TYR SEQRES 7 A 162 SER GLU SER GLU GLY ASP ARG GLU LEU ALA ALA ALA TYR SEQRES 8 A 162 ARG GLU VAL ALA LYS GLU VAL THR ARG LEU GLY VAL ASN SEQRES 9 A 162 SER VAL ALA ILE PRO LEU LEU SER THR GLY VAL TYR SER SEQRES 10 A 162 GLY GLY LYS ASP ARG LEU THR GLN SER LEU ASN HIS LEU SEQRES 11 A 162 PHE THR ALA MSE ASP SER THR ASP ALA ASP VAL VAL ILE SEQRES 12 A 162 TYR CYS ARG ASP LYS GLU TRP GLU LYS LYS ILE SER GLU SEQRES 13 A 162 ALA ILE GLN MSE ARG THR HET MSE A 9 17 HET MSE A 59 17 HET MSE A 132 17 HET MSE A 158 17 HET APR A 12 57 ATOM 1 N HIS A -1 10.234 46.000 20.881 1.00 31.56 N ATOM 2 CA HIS A -1 11.281 44.966 20.615 1.00 31.37 C ATOM 3 C HIS A -1 11.990 45.147 19.254 1.00 30.49 C ATOM 4 O HIS A -1 12.617 46.181 19.026 1.00 30.68 O ATOM 5 CB HIS A -1 10.731 43.542 20.829 1.00 31.80 C ATOM 6 CG HIS A -1 9.510 43.228 20.022 1.00 32.98 C ATOM 7 ND1 HIS A -1 9.556 42.471 18.869 1.00 35.56 N ATOM 8 CD2 HIS A -1 8.210 43.562 20.202 1.00 33.97 C ATOM 9 CE1 HIS A -1 8.337 42.360 18.368 1.00 35.72 C ATOM 10 NE2 HIS A -1 7.502 43.010 19.161 1.00 35.91 N ATOM 11 HA HIS A -1 12.066 45.117 21.356 1.00 0.00 H ATOM 12 HB2 HIS A -1 11.511 42.830 20.560 1.00 0.00 H ATOM 13 HB3 HIS A -1 10.483 43.426 21.884 1.00 0.00 H ATOM 14 HD2 HIS A -1 7.802 44.157 21.019 1.00 0.00 H ATOM 15 HE1 HIS A -1 8.067 41.825 17.458 1.00 0.00 H ATOM 16 HN3 HIS A -1 9.506 45.953 20.140 1.00 0.00 H ATOM 17 HN2 HIS A -1 10.672 46.943 20.879 1.00 0.00 H ATOM 18 HN1 HIS A -1 9.799 45.820 21.808 1.00 0.00 H ATOM 19 N HIS A 0 11.889 44.153 18.373 1.00 29.68 N ATOM 20 CA HIS A 0 12.653 44.085 17.118 1.00 28.67 C ATOM 21 C HIS A 0 12.524 45.328 16.228 1.00 27.56 C ATOM 22 O HIS A 0 11.417 45.751 15.910 1.00 27.39 O ATOM 23 CB HIS A 0 12.260 42.815 16.346 1.00 29.18 C ATOM 24 CG HIS A 0 12.508 42.891 14.870 1.00 30.83 C ATOM 25 ND1 HIS A 0 11.542 43.301 13.974 1.00 33.75 N ATOM 26 CD2 HIS A 0 13.607 42.601 14.131 1.00 32.60 C ATOM 27 CE1 HIS A 0 12.034 43.264 12.747 1.00 32.75 C ATOM 28 NE2 HIS A 0 13.286 42.842 12.814 1.00 33.34 N ATOM 29 HA HIS A 0 13.706 44.048 17.399 1.00 0.00 H ATOM 30 HB2 HIS A 0 12.834 41.980 16.747 1.00 0.00 H ATOM 31 HB3 HIS A 0 11.197 42.633 16.505 1.00 0.00 H ATOM 32 HD2 HIS A 0 14.565 42.244 14.509 1.00 0.00 H ATOM 33 HE1 HIS A 0 11.499 43.535 11.836 1.00 0.00 H ATOM 34 H HIS A 0 11.229 43.377 18.586 1.00 0.00 H ATOM 35 N ALA A 1 13.664 45.888 15.824 1.00 26.07 N ATOM 36 CA ALA A 1 13.702 47.080 14.967 1.00 24.68 C ATOM 37 C ALA A 1 13.409 46.750 13.494 1.00 23.46 C ATOM 38 O ALA A 1 14.215 46.076 12.843 1.00 23.39 O ATOM 39 CB ALA A 1 15.061 47.799 15.106 1.00 24.61 C ATOM 40 HA ALA A 1 12.910 47.748 15.306 1.00 0.00 H ATOM 41 HB1 ALA A 1 15.206 48.102 16.143 1.00 0.00 H ATOM 42 HB2 ALA A 1 15.861 47.121 14.809 1.00 0.00 H ATOM 43 HB3 ALA A 1 15.072 48.680 14.464 1.00 0.00 H ATOM 44 H ALA A 1 14.563 45.463 16.128 1.00 0.00 H ATOM 45 N PRO A 2 12.253 47.223 12.963 1.00 22.05 N ATOM 46 CA PRO A 2 11.944 47.066 11.538 1.00 21.19 C ATOM 47 C PRO A 2 13.018 47.752 10.708 1.00 20.57 C ATOM 48 O PRO A 2 13.483 48.829 11.083 1.00 20.58 O ATOM 49 CB PRO A 2 10.600 47.796 11.372 1.00 21.11 C ATOM 50 CG PRO A 2 10.023 47.841 12.752 1.00 21.45 C ATOM 51 CD PRO A 2 11.204 47.979 13.668 1.00 22.14 C ATOM 52 HA PRO A 2 11.900 46.025 11.217 1.00 0.00 H ATOM 53 HD3 PRO A 2 11.487 49.025 13.789 1.00 0.00 H ATOM 54 HD2 PRO A 2 10.996 47.544 14.646 1.00 0.00 H ATOM 55 HG3 PRO A 2 9.476 46.923 12.968 1.00 0.00 H ATOM 56 HG2 PRO A 2 9.354 48.695 12.859 1.00 0.00 H ATOM 57 HB2 PRO A 2 10.754 48.804 10.986 1.00 0.00 H ATOM 58 HB3 PRO A 2 9.944 47.246 10.698 1.00 0.00 H ATOM 59 N SER A 3 13.425 47.124 9.606 1.00 19.10 N ATOM 60 CA SER A 3 14.575 47.611 8.845 1.00 18.80 C ATOM 61 C SER A 3 14.285 47.645 7.337 1.00 18.61 C ATOM 62 O SER A 3 13.297 47.053 6.881 1.00 18.80 O ATOM 63 CB SER A 3 15.800 46.744 9.122 1.00 18.28 C ATOM 64 OG SER A 3 15.569 45.403 8.701 1.00 17.40 O ATOM 65 HA SER A 3 14.775 48.632 9.170 1.00 0.00 H ATOM 66 HB2 SER A 3 16.012 46.753 10.191 1.00 0.00 H ATOM 67 HB3 SER A 3 16.655 47.148 8.580 1.00 0.00 H ATOM 68 HG SER A 3 14.794 45.032 9.194 1.00 0.00 H ATOM 69 H SER A 3 12.918 46.276 9.282 1.00 0.00 H ATOM 70 N TYR A 4 15.134 48.357 6.596 1.00 18.18 N ATOM 71 CA TYR A 4 15.170 48.309 5.136 1.00 18.85 C ATOM 72 C TYR A 4 16.530 47.782 4.727 1.00 19.44 C ATOM 73 O TYR A 4 17.553 48.215 5.259 1.00 19.55 O ATOM 74 CB TYR A 4 15.037 49.712 4.519 1.00 18.86 C ATOM 75 CG TYR A 4 13.642 50.261 4.401 1.00 17.45 C ATOM 76 CD1 TYR A 4 13.230 51.310 5.204 1.00 16.85 C ATOM 77 CD2 TYR A 4 12.742 49.752 3.450 1.00 16.88 C ATOM 78 CE1 TYR A 4 11.950 51.843 5.098 1.00 16.09 C ATOM 79 CE2 TYR A 4 11.462 50.266 3.341 1.00 17.23 C ATOM 80 CZ TYR A 4 11.072 51.314 4.169 1.00 17.17 C ATOM 81 OH TYR A 4 9.811 51.849 4.058 1.00 18.45 O ATOM 82 HA TYR A 4 14.346 47.684 4.792 1.00 0.00 H ATOM 83 HB3 TYR A 4 15.465 49.676 3.517 1.00 0.00 H ATOM 84 HB2 TYR A 4 15.614 50.402 5.135 1.00 0.00 H ATOM 85 HD2 TYR A 4 13.056 48.943 2.790 1.00 0.00 H ATOM 86 HE2 TYR A 4 10.765 49.853 2.612 1.00 0.00 H ATOM 87 HE1 TYR A 4 11.642 52.668 5.740 1.00 0.00 H ATOM 88 HD1 TYR A 4 13.923 51.727 5.935 1.00 0.00 H ATOM 89 HH TYR A 4 9.704 52.579 4.718 1.00 0.00 H ATOM 90 H TYR A 4 15.808 48.981 7.084 1.00 0.00 H ATOM 91 N ARG A 5 16.537 46.849 3.786 1.00 20.02 N ATOM 92 CA ARG A 5 17.779 46.317 3.221 1.00 21.45 C ATOM 93 C ARG A 5 17.633 46.266 1.715 1.00 21.50 C ATOM 94 O ARG A 5 16.516 46.202 1.216 1.00 21.50 O ATOM 95 CB ARG A 5 18.041 44.901 3.737 1.00 21.44 C ATOM 96 CG ARG A 5 18.692 44.831 5.108 1.00 25.91 C ATOM 97 CD ARG A 5 17.684 45.065 6.232 1.00 32.13 C ATOM 98 NE ARG A 5 16.865 43.883 6.512 1.00 37.06 N ATOM 99 CZ ARG A 5 15.551 43.796 6.305 1.00 37.46 C ATOM 100 NH1 ARG A 5 14.861 44.815 5.827 1.00 36.94 N ATOM 101 NH2 ARG A 5 14.929 42.668 6.604 1.00 41.17 N ATOM 102 HA ARG A 5 18.611 46.958 3.513 1.00 0.00 H ATOM 103 HB2 ARG A 5 17.087 44.377 3.788 1.00 0.00 H ATOM 104 HB3 ARG A 5 18.694 44.396 3.025 1.00 0.00 H ATOM 105 HG2 ARG A 5 19.140 43.845 5.236 1.00 0.00 H ATOM 106 HG3 ARG A 5 19.470 45.592 5.168 1.00 0.00 H ATOM 107 HD2 ARG A 5 17.026 45.886 5.946 1.00 0.00 H ATOM 108 HD3 ARG A 5 18.227 45.336 7.137 1.00 0.00 H ATOM 109 HE ARG A 5 17.346 43.047 6.902 1.00 0.00 H ATOM 110 HH12 ARG A 5 13.836 44.723 5.674 1.00 0.00 H ATOM 111 HH11 ARG A 5 15.342 45.710 5.604 1.00 0.00 H ATOM 112 HH22 ARG A 5 13.904 42.582 6.449 1.00 0.00 H ATOM 113 HH21 ARG A 5 15.465 41.866 6.994 1.00 0.00 H ATOM 114 H ARG A 5 15.629 46.482 3.437 1.00 0.00 H ATOM 115 N VAL A 6 18.754 46.307 0.999 1.00 21.80 N ATOM 116 CA VAL A 6 18.759 46.030 -0.437 1.00 22.03 C ATOM 117 C VAL A 6 19.672 44.837 -0.741 1.00 22.40 C ATOM 118 O VAL A 6 20.726 44.686 -0.128 1.00 22.17 O ATOM 119 CB VAL A 6 19.165 47.285 -1.279 1.00 21.99 C ATOM 120 CG1 VAL A 6 20.536 47.801 -0.883 1.00 20.81 C ATOM 121 CG2 VAL A 6 19.082 46.997 -2.782 1.00 21.55 C ATOM 122 HA VAL A 6 17.741 45.775 -0.731 1.00 0.00 H ATOM 123 HB VAL A 6 18.448 48.075 -1.058 1.00 0.00 H ATOM 124 HG11 VAL A 6 20.527 48.080 0.171 1.00 0.00 H ATOM 125 HG12 VAL A 6 21.278 47.020 -1.047 1.00 0.00 H ATOM 126 HG13 VAL A 6 20.784 48.673 -1.489 1.00 0.00 H ATOM 127 HG21 VAL A 6 19.757 46.178 -3.031 1.00 0.00 H ATOM 128 HG22 VAL A 6 18.060 46.720 -3.042 1.00 0.00 H ATOM 129 HG23 VAL A 6 19.370 47.889 -3.338 1.00 0.00 H ATOM 130 H VAL A 6 19.649 46.542 1.473 1.00 0.00 H ATOM 131 N LYS A 7 19.249 43.980 -1.665 1.00 22.74 N ATOM 132 CA LYS A 7 20.092 42.866 -2.120 1.00 23.23 C ATOM 133 C LYS A 7 20.090 42.828 -3.635 1.00 23.30 C ATOM 134 O LYS A 7 19.040 42.990 -4.263 1.00 22.99 O ATOM 135 CB LYS A 7 19.632 41.524 -1.536 1.00 23.01 C ATOM 136 CG LYS A 7 19.624 41.494 -0.006 1.00 24.57 C ATOM 137 CD LYS A 7 19.744 40.087 0.558 1.00 27.71 C ATOM 138 CE LYS A 7 18.549 39.230 0.210 1.00 28.77 C ATOM 139 NZ LYS A 7 18.478 38.013 1.082 1.00 27.54 N ATOM 140 HA LYS A 7 21.108 43.030 -1.761 1.00 0.00 H ATOM 141 HB2 LYS A 7 18.621 41.322 -1.891 1.00 0.00 H ATOM 142 HB3 LYS A 7 20.304 40.744 -1.893 1.00 0.00 H ATOM 143 HG2 LYS A 7 20.462 42.088 0.358 1.00 0.00 H ATOM 144 HG3 LYS A 7 18.690 41.932 0.346 1.00 0.00 H ATOM 145 HD2 LYS A 7 20.641 39.621 0.151 1.00 0.00 H ATOM 146 HD3 LYS A 7 19.828 40.149 1.643 1.00 0.00 H ATOM 147 HE2 LYS A 7 18.628 38.917 -0.831 1.00 0.00 H ATOM 148 HE3 LYS A 7 17.640 39.817 0.344 1.00 0.00 H ATOM 149 HZ1 LYS A 7 19.340 37.446 0.955 1.00 0.00 H ATOM 150 HZ2 LYS A 7 18.398 38.305 2.077 1.00 0.00 H ATOM 151 HZ3 LYS A 7 17.647 37.446 0.817 1.00 0.00 H ATOM 152 H LYS A 7 18.301 44.101 -2.075 1.00 0.00 H ATOM 153 N ARG A 8 21.255 42.675 -4.215 1.00 23.79 N ATOM 154 CA ARG A 8 21.374 42.483 -5.630 1.00 24.61 C ATOM 155 C ARG A 8 21.369 40.993 -5.941 1.00 25.10 C ATOM 156 O ARG A 8 22.366 40.335 -5.971 1.00 24.49 O ATOM 157 CB ARG A 8 22.614 43.143 -6.192 1.00 24.70 C ATOM 158 CG ARG A 8 22.772 42.897 -7.654 1.00 25.61 C ATOM 159 CD ARG A 8 23.642 43.877 -8.321 1.00 26.63 C ATOM 160 NE ARG A 8 24.868 44.046 -7.586 1.00 85.45 N ATOM 161 CZ ARG A 8 25.694 43.052 -7.270 1.00107.07 C ATOM 162 NH1 ARG A 8 25.421 41.808 -7.648 1.00 92.37 N ATOM 163 NH2 ARG A 8 26.787 43.301 -6.576 1.00 99.57 N ATOM 164 HA ARG A 8 20.519 42.959 -6.110 1.00 0.00 H ATOM 165 HB2 ARG A 8 22.547 44.218 -6.022 1.00 0.00 H ATOM 166 HB3 ARG A 8 23.488 42.748 -5.673 1.00 0.00 H ATOM 167 HG2 ARG A 8 23.199 41.904 -7.793 1.00 0.00 H ATOM 168 HG3 ARG A 8 21.787 42.936 -8.120 1.00 0.00 H ATOM 169 HD2 ARG A 8 23.124 44.834 -8.381 1.00 0.00 H ATOM 170 HD3 ARG A 8 23.872 43.526 -9.327 1.00 0.00 H ATOM 171 HE ARG A 8 25.125 45.007 -7.282 1.00 0.00 H ATOM 172 HH12 ARG A 8 26.070 41.034 -7.399 1.00 0.00 H ATOM 173 HH11 ARG A 8 24.558 41.608 -8.193 1.00 0.00 H ATOM 174 HH22 ARG A 8 27.434 42.525 -6.328 1.00 0.00 H ATOM 175 HH21 ARG A 8 27.003 44.273 -6.276 1.00 0.00 H ATOM 176 H ARG A 8 22.116 42.693 -3.633 1.00 0.00 H HETATM 177 N MSE A 9 20.191 40.483 -6.130 1.00 25.76 N HETATM 178 CA MSE A 9 20.016 39.091 -6.490 1.00 26.91 C HETATM 179 C MSE A 9 18.608 38.865 -6.984 1.00 25.94 C HETATM 180 O MSE A 9 17.748 39.748 -6.898 1.00 25.63 O HETATM 181 CB MSE A 9 20.353 38.136 -5.326 1.00 28.01 C HETATM 182 CG MSE A 9 19.589 38.372 -4.011 1.00 31.47 C HETATM 183 SE MSE A 9 19.831 36.886 -2.716 1.00 37.62 S HETATM 184 CE MSE A 9 18.963 35.479 -3.710 1.00 35.37 C HETATM 185 HE3 MSE A 9 18.999 34.554 -3.135 1.00 0.00 H HETATM 186 HE2 MSE A 9 19.477 35.338 -4.661 1.00 0.00 H HETATM 187 HE1 MSE A 9 17.924 35.753 -3.894 1.00 0.00 H HETATM 188 HG2 MSE A 9 19.950 39.295 -3.557 1.00 0.00 H HETATM 189 HG1 MSE A 9 18.527 38.471 -4.236 1.00 0.00 H HETATM 190 HB2 MSE A 9 21.418 38.232 -5.114 1.00 0.00 H HETATM 191 HB1 MSE A 9 20.140 37.120 -5.657 1.00 0.00 H HETATM 192 HA MSE A 9 20.720 38.863 -7.291 1.00 0.00 H HETATM 193 H MSE A 9 19.352 41.088 -6.020 1.00 0.00 H ATOM 194 N ASP A 10 18.401 37.673 -7.514 1.00 24.88 N ATOM 195 CA ASP A 10 17.137 37.277 -8.077 1.00 24.71 C ATOM 196 C ASP A 10 16.120 37.141 -6.947 1.00 24.08 C ATOM 197 O ASP A 10 16.242 36.285 -6.065 1.00 24.63 O ATOM 198 CB ASP A 10 17.316 35.973 -8.855 1.00 25.16 C ATOM 199 CG ASP A 10 16.009 35.410 -9.382 1.00 26.68 C ATOM 200 OD1 ASP A 10 14.953 36.069 -9.210 1.00 24.74 O ATOM 201 OD2 ASP A 10 16.054 34.295 -9.965 1.00 26.77 O ATOM 202 HA ASP A 10 16.767 38.026 -8.777 1.00 0.00 H ATOM 203 HB2 ASP A 10 17.979 36.161 -9.700 1.00 0.00 H ATOM 204 HB3 ASP A 10 17.771 35.235 -8.195 1.00 0.00 H ATOM 205 H ASP A 10 19.186 36.991 -7.525 1.00 0.00 H ATOM 206 N ILE A 11 15.123 38.012 -6.988 1.00 23.22 N ATOM 207 CA ILE A 11 14.076 38.063 -5.976 1.00 22.15 C ATOM 208 C ILE A 11 13.392 36.710 -5.722 1.00 21.68 C ATOM 209 O ILE A 11 12.893 36.461 -4.616 1.00 20.79 O ATOM 210 CB ILE A 11 13.035 39.191 -6.318 1.00 22.05 C ATOM 211 CG1 ILE A 11 12.144 39.505 -5.110 1.00 21.44 C ATOM 212 CG2 ILE A 11 12.216 38.841 -7.588 1.00 20.00 C ATOM 213 CD1 ILE A 11 11.298 40.801 -5.292 1.00 22.28 C ATOM 214 HA ILE A 11 14.566 38.312 -5.035 1.00 0.00 H ATOM 215 HB ILE A 11 13.587 40.102 -6.548 1.00 0.00 H ATOM 216 HG12 ILE A 11 11.465 38.667 -4.953 1.00 0.00 H ATOM 217 HG13 ILE A 11 12.779 39.626 -4.233 1.00 0.00 H ATOM 218 HD11 ILE A 11 11.965 41.651 -5.440 1.00 0.00 H ATOM 219 HD12 ILE A 11 10.649 40.691 -6.161 1.00 0.00 H ATOM 220 HD13 ILE A 11 10.691 40.965 -4.402 1.00 0.00 H ATOM 221 HG21 ILE A 11 12.893 38.726 -8.435 1.00 0.00 H ATOM 222 HG22 ILE A 11 11.675 37.909 -7.425 1.00 0.00 H ATOM 223 HG23 ILE A 11 11.507 39.643 -7.794 1.00 0.00 H ATOM 224 H ILE A 11 15.086 38.689 -7.777 1.00 0.00 H ATOM 225 N ALA A 12 13.392 35.830 -6.729 1.00 21.18 N ATOM 226 CA ALA A 12 12.787 34.510 -6.578 1.00 21.29 C ATOM 227 C ALA A 12 13.531 33.687 -5.533 1.00 21.91 C ATOM 228 O ALA A 12 12.957 32.772 -4.941 1.00 21.80 O ATOM 229 CB ALA A 12 12.749 33.773 -7.912 1.00 21.50 C ATOM 230 HA ALA A 12 11.762 34.649 -6.236 1.00 0.00 H ATOM 231 HB1 ALA A 12 12.161 34.349 -8.627 1.00 0.00 H ATOM 232 HB2 ALA A 12 13.765 33.652 -8.288 1.00 0.00 H ATOM 233 HB3 ALA A 12 12.294 32.793 -7.771 1.00 0.00 H ATOM 234 H ALA A 12 13.831 36.091 -7.635 1.00 0.00 H ATOM 235 N LYS A 13 14.792 34.042 -5.285 1.00 22.00 N ATOM 236 CA LYS A 13 15.594 33.352 -4.291 1.00 23.11 C ATOM 237 C LYS A 13 15.565 34.036 -2.909 1.00 23.18 C ATOM 238 O LYS A 13 16.420 33.761 -2.071 1.00 23.25 O ATOM 239 CB LYS A 13 17.041 33.180 -4.801 1.00 23.60 C ATOM 240 CG LYS A 13 17.187 32.545 -6.193 1.00 25.06 C ATOM 241 CD LYS A 13 16.864 31.043 -6.182 1.00 30.36 C ATOM 242 CE LYS A 13 16.751 30.449 -7.597 1.00 32.37 C ATOM 243 NZ LYS A 13 18.067 30.296 -8.285 1.00 32.65 N ATOM 244 HA LYS A 13 15.148 32.368 -4.146 1.00 0.00 H ATOM 245 HB2 LYS A 13 17.505 34.166 -4.832 1.00 0.00 H ATOM 246 HB3 LYS A 13 17.575 32.551 -4.088 1.00 0.00 H ATOM 247 HG2 LYS A 13 16.506 33.046 -6.881 1.00 0.00 H ATOM 248 HG3 LYS A 13 18.213 32.681 -6.536 1.00 0.00 H ATOM 249 HD2 LYS A 13 17.656 30.520 -5.646 1.00 0.00 H ATOM 250 HD3 LYS A 13 15.917 30.894 -5.664 1.00 0.00 H ATOM 251 HE2 LYS A 13 16.121 31.105 -8.198 1.00 0.00 H ATOM 252 HE3 LYS A 13 16.284 29.467 -7.523 1.00 0.00 H ATOM 253 HZ1 LYS A 13 18.521 31.227 -8.373 1.00 0.00 H ATOM 254 HZ2 LYS A 13 18.676 29.663 -7.728 1.00 0.00 H ATOM 255 HZ3 LYS A 13 17.917 29.891 -9.231 1.00 0.00 H ATOM 256 H LYS A 13 15.211 34.832 -5.816 1.00 0.00 H ATOM 257 N ASN A 14 14.576 34.908 -2.673 1.00 23.13 N ATOM 258 CA ASN A 14 14.456 35.669 -1.400 1.00 22.79 C ATOM 259 C ASN A 14 14.314 34.813 -0.131 1.00 23.14 C ATOM 260 O ASN A 14 13.918 33.644 -0.202 1.00 23.36 O ATOM 261 CB ASN A 14 13.298 36.664 -1.461 1.00 21.29 C ATOM 262 CG ASN A 14 11.930 35.995 -1.313 1.00 21.04 C ATOM 263 OD1 ASN A 14 11.499 35.626 -0.213 1.00 16.76 O ATOM 264 ND2 ASN A 14 11.242 35.848 -2.424 1.00 18.55 N ATOM 265 HA ASN A 14 15.411 36.187 -1.313 1.00 0.00 H ATOM 266 HB2 ASN A 14 13.420 37.389 -0.657 1.00 0.00 H ATOM 267 HB3 ASN A 14 13.332 37.179 -2.421 1.00 0.00 H ATOM 268 HD22 ASN A 14 11.640 36.172 -3.329 1.00 0.00 H ATOM 269 HD21 ASN A 14 10.300 35.408 -2.398 1.00 0.00 H ATOM 270 H ASN A 14 13.860 35.060 -3.412 1.00 0.00 H ATOM 271 N ASP A 15 14.591 35.426 1.022 1.00 23.49 N ATOM 272 CA ASP A 15 14.614 34.717 2.313 1.00 23.91 C ATOM 273 C ASP A 15 13.509 35.223 3.246 1.00 23.25 C ATOM 274 O ASP A 15 13.526 34.948 4.450 1.00 22.83 O ATOM 275 CB ASP A 15 15.990 34.867 2.998 1.00 24.29 C ATOM 276 CG ASP A 15 17.161 34.628 2.041 1.00 26.92 C ATOM 277 OD1 ASP A 15 17.872 33.581 2.190 1.00 28.48 O ATOM 278 OD2 ASP A 15 17.346 35.482 1.128 1.00 29.41 O ATOM 279 HA ASP A 15 14.435 33.661 2.108 1.00 0.00 H ATOM 280 HB2 ASP A 15 16.070 35.877 3.401 1.00 0.00 H ATOM 281 HB3 ASP A 15 16.054 34.146 3.813 1.00 0.00 H ATOM 282 H ASP A 15 14.799 36.445 1.008 1.00 0.00 H ATOM 283 N GLU A 16 12.550 35.949 2.679 1.00 21.85 N ATOM 284 CA GLU A 16 11.534 36.641 3.461 1.00 21.70 C ATOM 285 C GLU A 16 10.228 35.854 3.512 1.00 21.91 C ATOM 286 O GLU A 16 10.018 34.921 2.747 1.00 22.08 O ATOM 287 CB GLU A 16 11.264 38.031 2.860 1.00 21.02 C ATOM 288 CG GLU A 16 12.361 39.048 3.101 1.00 20.19 C ATOM 289 CD GLU A 16 13.659 38.672 2.449 1.00 21.36 C ATOM 290 OE1 GLU A 16 13.774 38.777 1.214 1.00 19.74 O ATOM 291 OE2 GLU A 16 14.574 38.262 3.175 1.00 22.96 O ATOM 292 HA GLU A 16 11.914 36.740 4.478 1.00 0.00 H ATOM 293 HB2 GLU A 16 11.137 37.917 1.783 1.00 0.00 H ATOM 294 HB3 GLU A 16 10.342 38.416 3.295 1.00 0.00 H ATOM 295 HG2 GLU A 16 12.037 40.010 2.703 1.00 0.00 H ATOM 296 HG3 GLU A 16 12.524 39.137 4.175 1.00 0.00 H ATOM 297 H GLU A 16 12.524 36.025 1.642 1.00 0.00 H ATOM 298 N GLU A 17 9.329 36.269 4.388 1.00 22.16 N ATOM 299 CA GLU A 17 8.073 35.550 4.572 1.00 22.36 C ATOM 300 C GLU A 17 7.108 35.671 3.390 1.00 21.88 C ATOM 301 O GLU A 17 6.105 34.953 3.336 1.00 21.58 O ATOM 302 CB GLU A 17 7.417 35.973 5.885 1.00 22.51 C ATOM 303 CG GLU A 17 8.250 35.551 7.101 1.00 24.44 C ATOM 304 CD GLU A 17 7.535 35.720 8.414 1.00 25.73 C ATOM 305 OE1 GLU A 17 6.460 36.352 8.451 1.00 26.08 O ATOM 306 OE2 GLU A 17 8.051 35.213 9.426 1.00 28.41 O ATOM 307 HA GLU A 17 8.322 34.490 4.620 1.00 0.00 H ATOM 308 HB2 GLU A 17 7.307 37.057 5.891 1.00 0.00 H ATOM 309 HB3 GLU A 17 6.433 35.509 5.953 1.00 0.00 H ATOM 310 HG2 GLU A 17 8.517 34.500 6.987 1.00 0.00 H ATOM 311 HG3 GLU A 17 9.157 36.155 7.123 1.00 0.00 H ATOM 312 H GLU A 17 9.520 37.120 4.954 1.00 0.00 H ATOM 313 N CYS A 18 7.416 36.562 2.437 1.00 20.88 N ATOM 314 CA CYS A 18 6.598 36.710 1.263 1.00 20.62 C ATOM 315 C CYS A 18 7.321 37.487 0.141 1.00 20.00 C ATOM 316 O CYS A 18 8.389 38.082 0.347 1.00 19.30 O ATOM 317 CB CYS A 18 5.250 37.360 1.633 1.00 20.91 C ATOM 318 SG CYS A 18 5.331 39.127 2.082 1.00 23.03 S ATOM 319 HA CYS A 18 6.401 35.715 0.864 1.00 0.00 H ATOM 320 HB2 CYS A 18 4.835 36.816 2.481 1.00 0.00 H ATOM 321 HB3 CYS A 18 4.582 37.260 0.777 1.00 0.00 H ATOM 322 HG CYS A 18 6.155 39.284 3.177 1.00 0.00 H ATOM 323 H CYS A 18 8.262 37.157 2.548 1.00 0.00 H ATOM 324 N VAL A 19 6.736 37.449 -1.051 1.00 19.18 N ATOM 325 CA VAL A 19 7.331 38.101 -2.203 1.00 17.59 C ATOM 326 C VAL A 19 6.304 38.985 -2.887 1.00 16.62 C ATOM 327 O VAL A 19 5.101 38.669 -2.920 1.00 16.94 O ATOM 328 CB VAL A 19 7.920 37.050 -3.203 1.00 18.26 C ATOM 329 CG1 VAL A 19 6.810 36.289 -3.937 1.00 17.53 C ATOM 330 CG2 VAL A 19 8.888 37.710 -4.175 1.00 17.07 C ATOM 331 HA VAL A 19 8.156 38.726 -1.860 1.00 0.00 H ATOM 332 HB VAL A 19 8.481 36.315 -2.625 1.00 0.00 H ATOM 333 HG11 VAL A 19 6.189 35.765 -3.211 1.00 0.00 H ATOM 334 HG12 VAL A 19 6.197 36.995 -4.498 1.00 0.00 H ATOM 335 HG13 VAL A 19 7.257 35.569 -4.622 1.00 0.00 H ATOM 336 HG21 VAL A 19 8.364 38.479 -4.742 1.00 0.00 H ATOM 337 HG22 VAL A 19 9.708 38.163 -3.618 1.00 0.00 H ATOM 338 HG23 VAL A 19 9.283 36.959 -4.859 1.00 0.00 H ATOM 339 H VAL A 19 5.834 36.942 -1.161 1.00 0.00 H ATOM 340 N VAL A 20 6.785 40.113 -3.406 1.00 16.07 N ATOM 341 CA VAL A 20 5.977 40.988 -4.246 1.00 15.09 C ATOM 342 C VAL A 20 6.407 40.790 -5.696 1.00 15.53 C ATOM 343 O VAL A 20 7.588 40.910 -6.025 1.00 15.54 O ATOM 344 CB VAL A 20 6.144 42.492 -3.860 1.00 15.56 C ATOM 345 CG1 VAL A 20 5.237 43.369 -4.704 1.00 11.13 C ATOM 346 CG2 VAL A 20 5.878 42.707 -2.366 1.00 13.68 C ATOM 347 HA VAL A 20 4.928 40.729 -4.105 1.00 0.00 H ATOM 348 HB VAL A 20 7.176 42.780 -4.062 1.00 0.00 H ATOM 349 HG11 VAL A 20 5.491 43.245 -5.757 1.00 0.00 H ATOM 350 HG12 VAL A 20 4.199 43.077 -4.543 1.00 0.00 H ATOM 351 HG13 VAL A 20 5.372 44.412 -4.416 1.00 0.00 H ATOM 352 HG21 VAL A 20 4.860 42.396 -2.131 1.00 0.00 H ATOM 353 HG22 VAL A 20 6.584 42.115 -1.784 1.00 0.00 H ATOM 354 HG23 VAL A 20 6.001 43.763 -2.125 1.00 0.00 H ATOM 355 H VAL A 20 7.770 40.379 -3.205 1.00 0.00 H ATOM 356 N ASN A 21 5.458 40.453 -6.554 1.00 15.73 N ATOM 357 CA ASN A 21 5.753 40.292 -7.975 1.00 15.48 C ATOM 358 C ASN A 21 5.482 41.646 -8.617 1.00 15.56 C ATOM 359 O ASN A 21 4.499 42.294 -8.273 1.00 16.25 O ATOM 360 CB ASN A 21 4.830 39.224 -8.582 1.00 15.26 C ATOM 361 CG ASN A 21 5.074 38.989 -10.071 1.00 16.24 C ATOM 362 OD1 ASN A 21 6.178 39.190 -10.580 1.00 18.63 O ATOM 363 ND2 ASN A 21 4.036 38.546 -10.769 1.00 16.48 N ATOM 364 HA ASN A 21 6.782 39.973 -8.139 1.00 0.00 H ATOM 365 HB2 ASN A 21 4.992 38.285 -8.052 1.00 0.00 H ATOM 366 HB3 ASN A 21 3.796 39.542 -8.447 1.00 0.00 H ATOM 367 HD22 ASN A 21 3.122 38.390 -10.299 1.00 0.00 H ATOM 368 HD21 ASN A 21 4.137 38.355 -11.786 1.00 0.00 H ATOM 369 H ASN A 21 4.488 40.301 -6.211 1.00 0.00 H ATOM 370 N ALA A 22 6.347 42.085 -9.525 1.00 15.77 N ATOM 371 CA ALA A 22 6.013 43.258 -10.333 1.00 15.90 C ATOM 372 C ALA A 22 5.121 42.749 -11.459 1.00 16.08 C ATOM 373 O ALA A 22 5.590 42.344 -12.523 1.00 16.64 O ATOM 374 CB ALA A 22 7.268 43.932 -10.859 1.00 16.27 C ATOM 375 HA ALA A 22 5.497 44.019 -9.747 1.00 0.00 H ATOM 376 HB1 ALA A 22 7.887 44.250 -10.020 1.00 0.00 H ATOM 377 HB2 ALA A 22 7.825 43.228 -11.477 1.00 0.00 H ATOM 378 HB3 ALA A 22 6.990 44.800 -11.456 1.00 0.00 H ATOM 379 H ALA A 22 7.256 41.598 -9.660 1.00 0.00 H ATOM 380 N ALA A 23 3.819 42.770 -11.224 1.00 16.30 N ATOM 381 CA ALA A 23 2.916 41.991 -12.057 1.00 15.98 C ATOM 382 C ALA A 23 2.347 42.766 -13.221 1.00 16.17 C ATOM 383 O ALA A 23 2.449 44.011 -13.297 1.00 15.53 O ATOM 384 CB ALA A 23 1.770 41.414 -11.216 1.00 16.51 C ATOM 385 HA ALA A 23 3.519 41.185 -12.476 1.00 0.00 H ATOM 386 HB1 ALA A 23 2.180 40.769 -10.439 1.00 0.00 H ATOM 387 HB2 ALA A 23 1.212 42.230 -10.756 1.00 0.00 H ATOM 388 HB3 ALA A 23 1.106 40.835 -11.858 1.00 0.00 H ATOM 389 H ALA A 23 3.441 43.344 -10.443 1.00 0.00 H ATOM 390 N ASN A 24 1.672 42.039 -14.099 1.00 15.72 N ATOM 391 CA ASN A 24 0.796 42.702 -15.052 1.00 17.19 C ATOM 392 C ASN A 24 -0.655 42.496 -14.641 1.00 17.36 C ATOM 393 O ASN A 24 -0.954 41.582 -13.868 1.00 18.67 O ATOM 394 CB ASN A 24 1.056 42.209 -16.487 1.00 17.30 C ATOM 395 CG ASN A 24 0.794 40.744 -16.644 1.00 18.49 C ATOM 396 OD1 ASN A 24 -0.362 40.308 -16.738 1.00 19.62 O ATOM 397 ND2 ASN A 24 1.867 39.963 -16.672 1.00 19.46 N ATOM 398 HA ASN A 24 1.010 43.771 -15.044 1.00 0.00 H ATOM 399 HB2 ASN A 24 0.405 42.756 -17.169 1.00 0.00 H ATOM 400 HB3 ASN A 24 2.097 42.408 -16.742 1.00 0.00 H ATOM 401 HD22 ASN A 24 2.816 40.380 -16.589 1.00 0.00 H ATOM 402 HD21 ASN A 24 1.759 38.934 -16.777 1.00 0.00 H ATOM 403 H ASN A 24 1.768 41.003 -14.107 1.00 0.00 H ATOM 404 N PRO A 25 -1.568 43.326 -15.158 1.00 17.93 N ATOM 405 CA PRO A 25 -2.944 43.272 -14.664 1.00 18.18 C ATOM 406 C PRO A 25 -3.751 42.030 -15.048 1.00 19.20 C ATOM 407 O PRO A 25 -4.811 41.828 -14.480 1.00 19.45 O ATOM 408 CB PRO A 25 -3.598 44.523 -15.247 1.00 17.87 C ATOM 409 CG PRO A 25 -2.760 44.936 -16.357 1.00 18.53 C ATOM 410 CD PRO A 25 -1.377 44.363 -16.186 1.00 17.69 C ATOM 411 HA PRO A 25 -2.927 43.222 -13.575 1.00 0.00 H ATOM 412 HD3 PRO A 25 -1.016 43.928 -17.118 1.00 0.00 H ATOM 413 HD2 PRO A 25 -0.676 45.126 -15.847 1.00 0.00 H ATOM 414 HG3 PRO A 25 -2.702 46.024 -16.383 1.00 0.00 H ATOM 415 HG2 PRO A 25 -3.190 44.574 -17.291 1.00 0.00 H ATOM 416 HB2 PRO A 25 -4.605 44.296 -15.597 1.00 0.00 H ATOM 417 HB3 PRO A 25 -3.645 45.311 -14.495 1.00 0.00 H ATOM 418 N ARG A 26 -3.232 41.189 -15.955 1.00 19.65 N ATOM 419 CA ARG A 26 -3.966 40.022 -16.437 1.00 19.73 C ATOM 420 C ARG A 26 -3.477 38.717 -15.811 1.00 20.37 C ATOM 421 O ARG A 26 -3.976 37.642 -16.133 1.00 19.69 O ATOM 422 CB ARG A 26 -3.908 39.992 -17.976 1.00 20.13 C ATOM 423 CG ARG A 26 -4.353 41.363 -18.535 1.00 21.10 C ATOM 424 CD ARG A 26 -4.434 41.426 -20.027 1.00 23.31 C ATOM 425 NE ARG A 26 -4.937 42.739 -20.401 1.00 26.43 N ATOM 426 CZ ARG A 26 -6.228 43.036 -20.595 1.00 28.17 C ATOM 427 NH1 ARG A 26 -6.573 44.279 -20.922 1.00 28.24 N ATOM 428 NH2 ARG A 26 -7.168 42.098 -20.478 1.00 26.08 N ATOM 429 HA ARG A 26 -5.006 40.112 -16.124 1.00 0.00 H ATOM 430 HB2 ARG A 26 -2.888 39.782 -18.297 1.00 0.00 H ATOM 431 HB3 ARG A 26 -4.573 39.214 -18.350 1.00 0.00 H ATOM 432 HG2 ARG A 26 -5.338 41.593 -18.130 1.00 0.00 H ATOM 433 HG3 ARG A 26 -3.639 42.116 -18.200 1.00 0.00 H ATOM 434 HD2 ARG A 26 -5.111 40.654 -20.393 1.00 0.00 H ATOM 435 HD3 ARG A 26 -3.444 41.274 -20.457 1.00 0.00 H ATOM 436 HE ARG A 26 -4.243 43.503 -20.527 1.00 0.00 H ATOM 437 HH12 ARG A 26 -7.574 44.518 -21.074 1.00 0.00 H ATOM 438 HH11 ARG A 26 -5.842 45.012 -21.025 1.00 0.00 H ATOM 439 HH22 ARG A 26 -8.167 42.341 -20.631 1.00 0.00 H ATOM 440 HH21 ARG A 26 -6.902 41.123 -20.234 1.00 0.00 H ATOM 441 H ARG A 26 -2.278 41.374 -16.326 1.00 0.00 H ATOM 442 N GLY A 27 -2.516 38.812 -14.899 1.00 19.95 N ATOM 443 CA GLY A 27 -1.924 37.622 -14.299 1.00 21.19 C ATOM 444 C GLY A 27 -1.154 36.736 -15.264 1.00 22.09 C ATOM 445 O GLY A 27 -1.165 35.515 -15.142 1.00 21.69 O ATOM 446 HA3 GLY A 27 -2.726 37.029 -13.860 1.00 0.00 H ATOM 447 HA2 GLY A 27 -1.240 37.943 -13.514 1.00 0.00 H ATOM 448 H GLY A 27 -2.180 39.752 -14.608 1.00 0.00 H ATOM 449 N LEU A 28 -0.484 37.349 -16.232 1.00 22.32 N ATOM 450 CA LEU A 28 0.247 36.598 -17.243 1.00 22.92 C ATOM 451 C LEU A 28 1.713 36.492 -16.854 1.00 23.38 C ATOM 452 O LEU A 28 2.242 37.400 -16.203 1.00 22.14 O ATOM 453 CB LEU A 28 0.126 37.292 -18.603 1.00 22.89 C ATOM 454 CG LEU A 28 -1.273 37.432 -19.212 1.00 24.60 C ATOM 455 CD1 LEU A 28 -1.303 38.569 -20.232 1.00 25.21 C ATOM 456 CD2 LEU A 28 -1.714 36.127 -19.846 1.00 26.73 C ATOM 457 HA LEU A 28 -0.179 35.597 -17.312 1.00 0.00 H ATOM 458 HB2 LEU A 28 0.535 38.296 -18.493 1.00 0.00 H ATOM 459 HB3 LEU A 28 0.734 36.729 -19.311 1.00 0.00 H ATOM 460 HG LEU A 28 -1.973 37.673 -18.412 1.00 0.00 H ATOM 461 HD21 LEU A 28 -1.012 35.852 -20.633 1.00 0.00 H ATOM 462 HD22 LEU A 28 -1.736 35.345 -19.087 1.00 0.00 H ATOM 463 HD23 LEU A 28 -2.710 36.250 -20.272 1.00 0.00 H ATOM 464 HD11 LEU A 28 -1.036 39.504 -19.740 1.00 0.00 H ATOM 465 HD12 LEU A 28 -0.589 38.360 -21.029 1.00 0.00 H ATOM 466 HD13 LEU A 28 -2.305 38.652 -20.653 1.00 0.00 H ATOM 467 H LEU A 28 -0.481 38.388 -16.269 1.00 0.00 H ATOM 468 N PRO A 29 2.379 35.378 -17.235 1.00 24.80 N ATOM 469 CA PRO A 29 3.837 35.332 -17.058 1.00 25.38 C ATOM 470 C PRO A 29 4.474 36.415 -17.918 1.00 25.91 C ATOM 471 O PRO A 29 3.851 36.893 -18.869 1.00 26.64 O ATOM 472 CB PRO A 29 4.228 33.920 -17.536 1.00 25.90 C ATOM 473 CG PRO A 29 3.037 33.398 -18.286 1.00 26.42 C ATOM 474 CD PRO A 29 1.833 34.114 -17.767 1.00 25.45 C ATOM 475 HA PRO A 29 4.166 35.511 -16.034 1.00 0.00 H ATOM 476 HD3 PRO A 29 1.119 34.305 -18.568 1.00 0.00 H ATOM 477 HD2 PRO A 29 1.348 33.538 -16.979 1.00 0.00 H ATOM 478 HG3 PRO A 29 2.933 32.326 -18.121 1.00 0.00 H ATOM 479 HG2 PRO A 29 3.154 33.590 -19.352 1.00 0.00 H ATOM 480 HB2 PRO A 29 5.098 33.968 -18.191 1.00 0.00 H ATOM 481 HB3 PRO A 29 4.451 33.279 -16.683 1.00 0.00 H ATOM 482 N GLY A 30 5.674 36.852 -17.578 1.00 25.86 N ATOM 483 CA GLY A 30 6.293 37.912 -18.370 1.00 25.95 C ATOM 484 C GLY A 30 7.790 37.837 -18.276 1.00 25.81 C ATOM 485 O GLY A 30 8.328 36.775 -17.994 1.00 25.57 O ATOM 486 HA3 GLY A 30 5.958 38.880 -17.997 1.00 0.00 H ATOM 487 HA2 GLY A 30 5.993 37.802 -19.412 1.00 0.00 H ATOM 488 H GLY A 30 6.170 36.447 -16.759 1.00 0.00 H ATOM 489 N ASP A 31 8.449 38.966 -18.521 1.00 25.52 N ATOM 490 CA ASP A 31 9.898 39.072 -18.434 1.00 26.37 C ATOM 491 C ASP A 31 10.257 39.594 -17.052 1.00 25.96 C ATOM 492 O ASP A 31 9.379 39.754 -16.202 1.00 26.31 O ATOM 493 CB ASP A 31 10.425 40.052 -19.490 1.00 26.99 C ATOM 494 CG ASP A 31 10.301 39.525 -20.907 1.00 29.48 C ATOM 495 OD1 ASP A 31 9.884 40.311 -21.780 1.00 33.97 O ATOM 496 OD2 ASP A 31 10.627 38.345 -21.171 1.00 31.90 O ATOM 497 HA ASP A 31 10.346 38.093 -18.607 1.00 0.00 H ATOM 498 HB2 ASP A 31 9.859 40.981 -19.414 1.00 0.00 H ATOM 499 HB3 ASP A 31 11.477 40.251 -19.285 1.00 0.00 H ATOM 500 H ASP A 31 7.904 39.811 -18.787 1.00 0.00 H ATOM 501 N GLY A 32 11.538 39.867 -16.813 1.00 25.38 N ATOM 502 CA GLY A 32 11.934 40.564 -15.580 1.00 24.14 C ATOM 503 C GLY A 32 11.515 39.814 -14.329 1.00 23.38 C ATOM 504 O GLY A 32 11.596 38.588 -14.277 1.00 23.06 O ATOM 505 HA3 GLY A 32 11.468 41.549 -15.570 1.00 0.00 H ATOM 506 HA2 GLY A 32 13.018 40.676 -15.574 1.00 0.00 H ATOM 507 H GLY A 32 12.264 39.585 -17.503 1.00 0.00 H ATOM 508 N VAL A 33 11.045 40.547 -13.328 1.00 21.89 N ATOM 509 CA VAL A 33 10.685 39.949 -12.037 1.00 20.97 C ATOM 510 C VAL A 33 9.656 38.832 -12.190 1.00 20.47 C ATOM 511 O VAL A 33 9.792 37.763 -11.608 1.00 19.78 O ATOM 512 CB VAL A 33 10.183 41.032 -11.038 1.00 20.12 C ATOM 513 CG1 VAL A 33 9.474 40.398 -9.810 1.00 20.72 C ATOM 514 CG2 VAL A 33 11.350 41.878 -10.593 1.00 20.02 C ATOM 515 HA VAL A 33 11.591 39.501 -11.629 1.00 0.00 H ATOM 516 HB VAL A 33 9.449 41.656 -11.548 1.00 0.00 H ATOM 517 HG11 VAL A 33 8.615 39.818 -10.147 1.00 0.00 H ATOM 518 HG12 VAL A 33 10.172 39.745 -9.286 1.00 0.00 H ATOM 519 HG13 VAL A 33 9.139 41.188 -9.138 1.00 0.00 H ATOM 520 HG21 VAL A 33 12.091 41.245 -10.104 1.00 0.00 H ATOM 521 HG22 VAL A 33 11.799 42.361 -11.461 1.00 0.00 H ATOM 522 HG23 VAL A 33 11.001 42.637 -9.893 1.00 0.00 H ATOM 523 H VAL A 33 10.929 41.572 -13.462 1.00 0.00 H ATOM 524 N CYS A 34 8.629 39.098 -12.980 1.00 20.08 N ATOM 525 CA CYS A 34 7.558 38.152 -13.184 1.00 20.68 C ATOM 526 C CYS A 34 8.059 36.822 -13.798 1.00 20.89 C ATOM 527 O CYS A 34 7.521 35.752 -13.503 1.00 19.87 O ATOM 528 CB CYS A 34 6.470 38.806 -14.029 1.00 20.66 C ATOM 529 SG CYS A 34 5.108 37.725 -14.347 1.00 23.13 S ATOM 530 HA CYS A 34 7.137 37.883 -12.216 1.00 0.00 H ATOM 531 HB2 CYS A 34 6.904 39.110 -14.982 1.00 0.00 H ATOM 532 HB3 CYS A 34 6.101 39.686 -13.502 1.00 0.00 H ATOM 533 HG CYS A 34 4.169 38.384 -15.113 1.00 0.00 H ATOM 534 H CYS A 34 8.592 40.015 -13.468 1.00 0.00 H ATOM 535 N LYS A 35 9.105 36.908 -14.621 1.00 21.31 N ATOM 536 CA LYS A 35 9.753 35.737 -15.207 1.00 22.27 C ATOM 537 C LYS A 35 10.244 34.829 -14.084 1.00 22.62 C ATOM 538 O LYS A 35 9.952 33.635 -14.077 1.00 21.86 O ATOM 539 CB LYS A 35 10.925 36.140 -16.125 1.00 21.76 C ATOM 540 CG LYS A 35 11.535 34.993 -16.947 1.00 25.15 C ATOM 541 CD LYS A 35 12.747 35.459 -17.749 1.00 28.51 C ATOM 542 CE LYS A 35 13.214 34.378 -18.713 1.00 32.02 C ATOM 543 NZ LYS A 35 14.531 34.720 -19.323 1.00 34.93 N ATOM 544 HA LYS A 35 9.028 35.206 -15.823 1.00 0.00 H ATOM 545 HB2 LYS A 35 10.565 36.899 -16.820 1.00 0.00 H ATOM 546 HB3 LYS A 35 11.712 36.564 -15.502 1.00 0.00 H ATOM 547 HG2 LYS A 35 11.844 34.197 -16.269 1.00 0.00 H ATOM 548 HG3 LYS A 35 10.781 34.611 -17.635 1.00 0.00 H ATOM 549 HD2 LYS A 35 12.478 36.350 -18.316 1.00 0.00 H ATOM 550 HD3 LYS A 35 13.558 35.698 -17.062 1.00 0.00 H ATOM 551 HE2 LYS A 35 12.474 34.267 -19.506 1.00 0.00 H ATOM 552 HE3 LYS A 35 13.308 33.437 -18.171 1.00 0.00 H ATOM 553 HZ1 LYS A 35 14.447 35.615 -19.847 1.00 0.00 H ATOM 554 HZ2 LYS A 35 15.243 34.822 -18.572 1.00 0.00 H ATOM 555 HZ3 LYS A 35 14.818 33.961 -19.974 1.00 0.00 H ATOM 556 H LYS A 35 9.476 37.851 -14.856 1.00 0.00 H ATOM 557 N ALA A 36 10.972 35.415 -13.132 1.00 22.84 N ATOM 558 CA ALA A 36 11.558 34.649 -12.038 1.00 23.23 C ATOM 559 C ALA A 36 10.483 34.125 -11.097 1.00 23.21 C ATOM 560 O ALA A 36 10.570 32.992 -10.639 1.00 23.80 O ATOM 561 CB ALA A 36 12.573 35.493 -11.290 1.00 23.35 C ATOM 562 HA ALA A 36 12.072 33.786 -12.461 1.00 0.00 H ATOM 563 HB1 ALA A 36 13.364 35.800 -11.975 1.00 0.00 H ATOM 564 HB2 ALA A 36 12.080 36.376 -10.883 1.00 0.00 H ATOM 565 HB3 ALA A 36 13.002 34.908 -10.477 1.00 0.00 H ATOM 566 H ALA A 36 11.125 36.443 -13.171 1.00 0.00 H ATOM 567 N VAL A 37 9.460 34.939 -10.832 1.00 22.62 N ATOM 568 CA VAL A 37 8.353 34.557 -9.952 1.00 22.10 C ATOM 569 C VAL A 37 7.510 33.427 -10.551 1.00 22.12 C ATOM 570 O VAL A 37 7.092 32.498 -9.845 1.00 21.69 O ATOM 571 CB VAL A 37 7.450 35.785 -9.608 1.00 22.41 C ATOM 572 CG1 VAL A 37 6.198 35.359 -8.831 1.00 21.78 C ATOM 573 CG2 VAL A 37 8.245 36.831 -8.811 1.00 22.17 C ATOM 574 HA VAL A 37 8.799 34.187 -9.029 1.00 0.00 H ATOM 575 HB VAL A 37 7.124 36.232 -10.547 1.00 0.00 H ATOM 576 HG11 VAL A 37 5.618 34.660 -9.434 1.00 0.00 H ATOM 577 HG12 VAL A 37 6.496 34.877 -7.900 1.00 0.00 H ATOM 578 HG13 VAL A 37 5.593 36.238 -8.609 1.00 0.00 H ATOM 579 HG21 VAL A 37 8.604 36.384 -7.884 1.00 0.00 H ATOM 580 HG22 VAL A 37 9.094 37.170 -9.405 1.00 0.00 H ATOM 581 HG23 VAL A 37 7.599 37.678 -8.581 1.00 0.00 H ATOM 582 H VAL A 37 9.448 35.883 -11.268 1.00 0.00 H ATOM 583 N TYR A 38 7.275 33.494 -11.859 1.00 21.84 N ATOM 584 CA TYR A 38 6.565 32.421 -12.545 1.00 22.04 C ATOM 585 C TYR A 38 7.375 31.130 -12.562 1.00 22.12 C ATOM 586 O TYR A 38 6.816 30.028 -12.513 1.00 21.45 O ATOM 587 CB TYR A 38 6.222 32.805 -13.982 1.00 22.02 C ATOM 588 CG TYR A 38 5.292 31.808 -14.617 1.00 22.78 C ATOM 589 CD1 TYR A 38 3.920 31.851 -14.363 1.00 23.89 C ATOM 590 CD2 TYR A 38 5.779 30.810 -15.458 1.00 23.56 C ATOM 591 CE1 TYR A 38 3.053 30.916 -14.931 1.00 26.25 C ATOM 592 CE2 TYR A 38 4.926 29.873 -16.021 1.00 27.11 C ATOM 593 CZ TYR A 38 3.566 29.939 -15.763 1.00 27.46 C ATOM 594 OH TYR A 38 2.717 29.012 -16.335 1.00 31.14 O ATOM 595 HA TYR A 38 5.644 32.258 -11.986 1.00 0.00 H ATOM 596 HB3 TYR A 38 7.142 32.851 -14.565 1.00 0.00 H ATOM 597 HB2 TYR A 38 5.744 33.784 -13.982 1.00 0.00 H ATOM 598 HD2 TYR A 38 6.846 30.765 -15.677 1.00 0.00 H ATOM 599 HE2 TYR A 38 5.324 29.088 -16.664 1.00 0.00 H ATOM 600 HE1 TYR A 38 1.984 30.956 -14.721 1.00 0.00 H ATOM 601 HD1 TYR A 38 3.519 32.627 -13.711 1.00 0.00 H ATOM 602 HH TYR A 38 1.787 29.199 -16.051 1.00 0.00 H ATOM 603 H TYR A 38 7.601 34.321 -12.398 1.00 0.00 H ATOM 604 N LYS A 39 8.691 31.270 -12.668 1.00 22.17 N ATOM 605 CA LYS A 39 9.559 30.101 -12.710 1.00 22.98 C ATOM 606 C LYS A 39 9.462 29.301 -11.400 1.00 23.42 C ATOM 607 O LYS A 39 9.504 28.067 -11.411 1.00 22.92 O ATOM 608 CB LYS A 39 11.007 30.509 -13.005 1.00 23.00 C ATOM 609 CG LYS A 39 11.924 29.318 -13.322 1.00 25.36 C ATOM 610 CD LYS A 39 13.376 29.733 -13.543 1.00 27.10 C ATOM 611 CE LYS A 39 14.212 28.526 -13.956 1.00 30.83 C ATOM 612 NZ LYS A 39 15.666 28.821 -13.894 1.00 33.05 N ATOM 613 HA LYS A 39 9.223 29.455 -13.521 1.00 0.00 H ATOM 614 HB2 LYS A 39 11.009 31.184 -13.861 1.00 0.00 H ATOM 615 HB3 LYS A 39 11.404 31.029 -12.133 1.00 0.00 H ATOM 616 HG2 LYS A 39 11.885 28.616 -12.489 1.00 0.00 H ATOM 617 HG3 LYS A 39 11.560 28.828 -14.225 1.00 0.00 H ATOM 618 HD2 LYS A 39 13.420 30.487 -14.329 1.00 0.00 H ATOM 619 HD3 LYS A 39 13.776 30.149 -12.619 1.00 0.00 H ATOM 620 HE2 LYS A 39 13.951 28.247 -14.977 1.00 0.00 H ATOM 621 HE3 LYS A 39 13.990 27.696 -13.286 1.00 0.00 H ATOM 622 HZ1 LYS A 39 15.886 29.609 -14.536 1.00 0.00 H ATOM 623 HZ2 LYS A 39 15.924 29.083 -12.921 1.00 0.00 H ATOM 624 HZ3 LYS A 39 16.202 27.978 -14.181 1.00 0.00 H ATOM 625 H LYS A 39 9.106 32.222 -12.721 1.00 0.00 H ATOM 626 N LYS A 40 9.301 30.009 -10.283 1.00 23.55 N ATOM 627 CA LYS A 40 9.249 29.377 -8.962 1.00 23.98 C ATOM 628 C LYS A 40 7.825 29.057 -8.479 1.00 23.74 C ATOM 629 O LYS A 40 7.553 27.953 -7.977 1.00 23.18 O ATOM 630 CB LYS A 40 9.943 30.260 -7.938 1.00 24.56 C ATOM 631 CG LYS A 40 10.146 29.587 -6.588 1.00 26.64 C ATOM 632 CD LYS A 40 11.293 30.253 -5.799 1.00 30.89 C ATOM 633 CE LYS A 40 12.690 29.851 -6.331 1.00 31.42 C ATOM 634 NZ LYS A 40 13.653 29.417 -5.249 1.00 33.34 N ATOM 635 HA LYS A 40 9.765 28.422 -9.065 1.00 0.00 H ATOM 636 HB2 LYS A 40 10.919 30.543 -8.332 1.00 0.00 H ATOM 637 HB3 LYS A 40 9.339 31.155 -7.789 1.00 0.00 H ATOM 638 HG2 LYS A 40 9.225 29.664 -6.010 1.00 0.00 H ATOM 639 HG3 LYS A 40 10.387 28.536 -6.747 1.00 0.00 H ATOM 640 HD2 LYS A 40 11.188 31.335 -5.875 1.00 0.00 H ATOM 641 HD3 LYS A 40 11.218 29.955 -4.753 1.00 0.00 H ATOM 642 HE2 LYS A 40 13.120 30.707 -6.851 1.00 0.00 H ATOM 643 HE3 LYS A 40 12.567 29.026 -7.033 1.00 0.00 H ATOM 644 HZ1 LYS A 40 13.791 30.198 -4.576 1.00 0.00 H ATOM 645 HZ2 LYS A 40 13.263 28.592 -4.750 1.00 0.00 H ATOM 646 HZ3 LYS A 40 14.565 29.164 -5.680 1.00 0.00 H ATOM 647 H LYS A 40 9.209 31.043 -10.351 1.00 0.00 H ATOM 648 N TRP A 41 6.926 30.023 -8.621 1.00 22.23 N ATOM 649 CA TRP A 41 5.591 29.895 -8.082 1.00 21.73 C ATOM 650 C TRP A 41 4.494 30.017 -9.150 1.00 21.16 C ATOM 651 O TRP A 41 3.670 30.930 -9.071 1.00 21.19 O ATOM 652 CB TRP A 41 5.368 30.966 -7.011 1.00 21.59 C ATOM 653 CG TRP A 41 6.358 30.985 -5.859 1.00 22.47 C ATOM 654 CD1 TRP A 41 6.366 30.150 -4.764 1.00 25.03 C ATOM 655 CD2 TRP A 41 7.441 31.911 -5.659 1.00 22.27 C ATOM 656 NE1 TRP A 41 7.398 30.489 -3.916 1.00 25.44 N ATOM 657 CE2 TRP A 41 8.062 31.574 -4.432 1.00 24.95 C ATOM 658 CE3 TRP A 41 7.947 32.990 -6.395 1.00 24.29 C ATOM 659 CZ2 TRP A 41 9.176 32.274 -3.931 1.00 24.72 C ATOM 660 CZ3 TRP A 41 9.053 33.693 -5.891 1.00 23.40 C ATOM 661 CH2 TRP A 41 9.649 33.333 -4.677 1.00 23.73 C ATOM 662 HA TRP A 41 5.517 28.894 -7.657 1.00 0.00 H ATOM 663 HB2 TRP A 41 5.410 31.939 -7.501 1.00 0.00 H ATOM 664 HB3 TRP A 41 4.373 30.814 -6.592 1.00 0.00 H ATOM 665 HE1 TRP A 41 7.635 30.002 -3.028 1.00 0.00 H ATOM 666 HD1 TRP A 41 5.659 29.339 -4.593 1.00 0.00 H ATOM 667 HZ2 TRP A 41 9.647 31.990 -2.990 1.00 0.00 H ATOM 668 HH2 TRP A 41 10.505 33.902 -4.314 1.00 0.00 H ATOM 669 HZ3 TRP A 41 9.455 34.534 -6.456 1.00 0.00 H ATOM 670 HE3 TRP A 41 7.490 33.279 -7.342 1.00 0.00 H ATOM 671 H TRP A 41 7.188 30.891 -9.131 1.00 0.00 H ATOM 672 N PRO A 42 4.462 29.105 -10.147 1.00 20.16 N ATOM 673 CA PRO A 42 3.424 29.325 -11.176 1.00 20.14 C ATOM 674 C PRO A 42 1.957 29.219 -10.701 1.00 20.34 C ATOM 675 O PRO A 42 1.086 29.846 -11.315 1.00 20.30 O ATOM 676 CB PRO A 42 3.751 28.270 -12.249 1.00 20.11 C ATOM 677 CG PRO A 42 4.542 27.212 -11.516 1.00 19.47 C ATOM 678 CD PRO A 42 5.335 27.960 -10.474 1.00 20.47 C ATOM 679 HA PRO A 42 3.463 30.356 -11.526 1.00 0.00 H ATOM 680 HD3 PRO A 42 5.512 27.339 -9.596 1.00 0.00 H ATOM 681 HD2 PRO A 42 6.290 28.298 -10.877 1.00 0.00 H ATOM 682 HG3 PRO A 42 5.209 26.690 -12.202 1.00 0.00 H ATOM 683 HG2 PRO A 42 3.873 26.493 -11.044 1.00 0.00 H ATOM 684 HB2 PRO A 42 2.836 27.848 -12.665 1.00 0.00 H ATOM 685 HB3 PRO A 42 4.345 28.708 -13.051 1.00 0.00 H ATOM 686 N GLU A 43 1.680 28.440 -9.646 1.00 20.43 N ATOM 687 CA GLU A 43 0.307 28.312 -9.102 1.00 21.20 C ATOM 688 C GLU A 43 -0.138 29.629 -8.511 1.00 21.04 C ATOM 689 O GLU A 43 -1.334 29.856 -8.363 1.00 21.59 O ATOM 690 CB GLU A 43 0.141 27.287 -7.958 1.00 21.03 C ATOM 691 CG GLU A 43 1.263 26.336 -7.661 1.00 23.31 C ATOM 692 CD GLU A 43 2.495 27.015 -7.116 1.00 21.24 C ATOM 693 OE1 GLU A 43 3.188 27.690 -7.906 1.00 19.45 O ATOM 694 OE2 GLU A 43 2.797 26.813 -5.925 1.00 23.29 O ATOM 695 HA GLU A 43 -0.280 27.982 -9.959 1.00 0.00 H ATOM 696 HB2 GLU A 43 -0.046 27.854 -7.046 1.00 0.00 H ATOM 697 HB3 GLU A 43 -0.735 26.683 -8.195 1.00 0.00 H ATOM 698 HG2 GLU A 43 0.915 25.609 -6.927 1.00 0.00 H ATOM 699 HG3 GLU A 43 1.532 25.820 -8.582 1.00 0.00 H ATOM 700 H GLU A 43 2.452 27.909 -9.195 1.00 0.00 H ATOM 701 N SER A 44 0.818 30.480 -8.144 1.00 21.67 N ATOM 702 CA SER A 44 0.481 31.814 -7.644 1.00 21.32 C ATOM 703 C SER A 44 -0.240 32.660 -8.678 1.00 21.72 C ATOM 704 O SER A 44 -0.841 33.677 -8.324 1.00 20.97 O ATOM 705 CB SER A 44 1.707 32.553 -7.096 1.00 21.45 C ATOM 706 OG SER A 44 2.452 33.177 -8.121 1.00 21.39 O ATOM 707 HA SER A 44 -0.210 31.655 -6.816 1.00 0.00 H ATOM 708 HB2 SER A 44 2.348 31.838 -6.581 1.00 0.00 H ATOM 709 HB3 SER A 44 1.373 33.314 -6.390 1.00 0.00 H ATOM 710 HG SER A 44 2.765 32.492 -8.763 1.00 0.00 H ATOM 711 H SER A 44 1.815 30.194 -8.213 1.00 0.00 H ATOM 712 N PHE A 45 -0.188 32.237 -9.943 1.00 21.48 N ATOM 713 CA PHE A 45 -0.834 32.990 -11.019 1.00 22.31 C ATOM 714 C PHE A 45 -2.308 32.642 -11.216 1.00 22.72 C ATOM 715 O PHE A 45 -2.986 33.261 -12.040 1.00 23.58 O ATOM 716 CB PHE A 45 0.000 32.919 -12.326 1.00 22.03 C ATOM 717 CG PHE A 45 1.313 33.688 -12.237 1.00 22.16 C ATOM 718 CD1 PHE A 45 1.446 34.959 -12.821 1.00 21.32 C ATOM 719 CD2 PHE A 45 2.393 33.162 -11.535 1.00 20.55 C ATOM 720 CE1 PHE A 45 2.652 35.677 -12.725 1.00 19.26 C ATOM 721 CE2 PHE A 45 3.592 33.876 -11.416 1.00 21.04 C ATOM 722 CZ PHE A 45 3.716 35.142 -12.020 1.00 20.91 C ATOM 723 HA PHE A 45 -0.852 34.034 -10.706 1.00 0.00 H ATOM 724 HB2 PHE A 45 0.223 31.874 -12.540 1.00 0.00 H ATOM 725 HB3 PHE A 45 -0.593 33.336 -13.140 1.00 0.00 H ATOM 726 HD2 PHE A 45 2.305 32.180 -11.071 1.00 0.00 H ATOM 727 HE2 PHE A 45 4.427 33.453 -10.857 1.00 0.00 H ATOM 728 HZ PHE A 45 4.648 35.700 -11.932 1.00 0.00 H ATOM 729 HE1 PHE A 45 2.748 36.651 -13.204 1.00 0.00 H ATOM 730 HD1 PHE A 45 0.602 35.395 -13.356 1.00 0.00 H ATOM 731 H PHE A 45 0.320 31.358 -10.168 1.00 0.00 H ATOM 732 N LYS A 46 -2.808 31.676 -10.434 1.00 23.01 N ATOM 733 CA LYS A 46 -4.216 31.287 -10.487 1.00 23.24 C ATOM 734 C LYS A 46 -5.097 32.450 -10.000 1.00 23.00 C ATOM 735 O LYS A 46 -5.052 32.822 -8.839 1.00 22.98 O ATOM 736 CB LYS A 46 -4.465 30.016 -9.644 1.00 23.67 C ATOM 737 CG LYS A 46 -5.839 29.384 -9.852 1.00 24.12 C ATOM 738 CD LYS A 46 -6.058 28.179 -8.951 1.00 24.16 C ATOM 739 CE LYS A 46 -7.426 27.539 -9.227 1.00 24.66 C ATOM 740 NZ LYS A 46 -7.679 26.358 -8.330 1.00 24.81 N ATOM 741 HA LYS A 46 -4.480 31.057 -11.519 1.00 0.00 H ATOM 742 HB2 LYS A 46 -3.706 29.278 -9.906 1.00 0.00 H ATOM 743 HB3 LYS A 46 -4.366 30.279 -8.591 1.00 0.00 H ATOM 744 HG2 LYS A 46 -6.605 30.129 -9.635 1.00 0.00 H ATOM 745 HG3 LYS A 46 -5.926 29.066 -10.891 1.00 0.00 H ATOM 746 HD2 LYS A 46 -5.274 27.445 -9.138 1.00 0.00 H ATOM 747 HD3 LYS A 46 -6.015 28.498 -7.909 1.00 0.00 H ATOM 748 HE2 LYS A 46 -7.458 27.208 -10.265 1.00 0.00 H ATOM 749 HE3 LYS A 46 -8.205 28.283 -9.060 1.00 0.00 H ATOM 750 HZ1 LYS A 46 -6.943 25.640 -8.488 1.00 0.00 H ATOM 751 HZ2 LYS A 46 -7.656 26.667 -7.337 1.00 0.00 H ATOM 752 HZ3 LYS A 46 -8.612 25.953 -8.547 1.00 0.00 H ATOM 753 H LYS A 46 -2.175 31.188 -9.769 1.00 0.00 H ATOM 754 N ASN A 47 -5.893 33.021 -10.900 1.00 22.67 N ATOM 755 CA ASN A 47 -6.766 34.152 -10.555 1.00 23.26 C ATOM 756 C ASN A 47 -6.005 35.335 -9.919 1.00 22.77 C ATOM 757 O ASN A 47 -6.465 35.941 -8.955 1.00 22.54 O ATOM 758 CB ASN A 47 -7.923 33.679 -9.648 1.00 23.64 C ATOM 759 CG ASN A 47 -8.838 32.655 -10.336 1.00 24.78 C ATOM 760 OD1 ASN A 47 -9.197 32.806 -11.504 1.00 26.48 O ATOM 761 ND2 ASN A 47 -9.222 31.611 -9.599 1.00 26.61 N ATOM 762 HA ASN A 47 -7.179 34.530 -11.490 1.00 0.00 H ATOM 763 HB2 ASN A 47 -7.500 33.223 -8.753 1.00 0.00 H ATOM 764 HB3 ASN A 47 -8.521 34.546 -9.365 1.00 0.00 H ATOM 765 HD22 ASN A 47 -8.896 31.521 -8.616 1.00 0.00 H ATOM 766 HD21 ASN A 47 -9.847 30.888 -10.008 1.00 0.00 H ATOM 767 H ASN A 47 -5.898 32.657 -11.874 1.00 0.00 H ATOM 768 N SER A 48 -4.822 35.638 -10.449 1.00 22.46 N ATOM 769 CA SER A 48 -4.019 36.762 -9.940 1.00 22.02 C ATOM 770 C SER A 48 -4.277 38.072 -10.691 1.00 21.26 C ATOM 771 O SER A 48 -3.787 39.112 -10.275 1.00 21.52 O ATOM 772 CB SER A 48 -2.525 36.419 -9.934 1.00 22.01 C ATOM 773 OG SER A 48 -2.044 36.249 -11.258 1.00 22.86 O ATOM 774 HA SER A 48 -4.341 36.925 -8.912 1.00 0.00 H ATOM 775 HB2 SER A 48 -2.372 35.495 -9.376 1.00 0.00 H ATOM 776 HB3 SER A 48 -1.974 37.228 -9.454 1.00 0.00 H ATOM 777 HG SER A 48 -2.540 35.513 -11.696 1.00 0.00 H ATOM 778 H SER A 48 -4.457 35.069 -11.239 1.00 0.00 H ATOM 779 N ALA A 49 -5.029 38.015 -11.794 1.00 20.31 N ATOM 780 CA ALA A 49 -5.472 39.211 -12.504 1.00 19.82 C ATOM 781 C ALA A 49 -6.087 40.261 -11.567 1.00 19.31 C ATOM 782 O ALA A 49 -6.950 39.942 -10.749 1.00 18.62 O ATOM 783 CB ALA A 49 -6.462 38.851 -13.611 1.00 19.80 C ATOM 784 HA ALA A 49 -4.581 39.655 -12.949 1.00 0.00 H ATOM 785 HB1 ALA A 49 -5.982 38.178 -14.321 1.00 0.00 H ATOM 786 HB2 ALA A 49 -7.331 38.360 -13.174 1.00 0.00 H ATOM 787 HB3 ALA A 49 -6.777 39.759 -14.125 1.00 0.00 H ATOM 788 H ALA A 49 -5.309 37.083 -12.161 1.00 0.00 H ATOM 789 N THR A 50 -5.620 41.506 -11.686 1.00 19.67 N ATOM 790 CA THR A 50 -6.081 42.605 -10.810 1.00 19.60 C ATOM 791 C THR A 50 -5.785 43.963 -11.463 1.00 19.52 C ATOM 792 O THR A 50 -4.901 44.051 -12.318 1.00 20.30 O ATOM 793 CB THR A 50 -5.442 42.514 -9.406 1.00 19.82 C ATOM 794 OG1 THR A 50 -6.140 43.371 -8.488 1.00 21.83 O ATOM 795 CG2 THR A 50 -3.952 42.873 -9.433 1.00 19.68 C ATOM 796 HA THR A 50 -7.159 42.508 -10.682 1.00 0.00 H ATOM 797 HB THR A 50 -5.527 41.480 -9.072 1.00 0.00 H ATOM 798 HG1 THR A 50 -6.089 44.306 -8.808 1.00 0.00 H ATOM 799 HG23 THR A 50 -3.434 42.217 -10.132 1.00 0.00 H ATOM 800 HG21 THR A 50 -3.835 43.909 -9.751 1.00 0.00 H ATOM 801 HG22 THR A 50 -3.531 42.748 -8.435 1.00 0.00 H ATOM 802 H THR A 50 -4.910 41.710 -12.418 1.00 0.00 H ATOM 803 N PRO A 51 -6.470 45.010 -11.080 1.00 18.94 N ATOM 804 CA PRO A 51 -6.273 46.246 -11.799 1.00 18.14 C ATOM 805 C PRO A 51 -4.933 46.894 -11.532 1.00 17.57 C ATOM 806 O PRO A 51 -4.278 46.591 -10.602 1.00 17.18 O ATOM 807 CB PRO A 51 -7.434 47.090 -11.336 1.00 18.89 C ATOM 808 CG PRO A 51 -8.376 46.187 -10.840 1.00 19.68 C ATOM 809 CD PRO A 51 -7.713 45.040 -10.320 1.00 17.92 C ATOM 810 HA PRO A 51 -6.251 46.101 -12.879 1.00 0.00 H ATOM 811 HD3 PRO A 51 -7.518 45.149 -9.253 1.00 0.00 H ATOM 812 HD2 PRO A 51 -8.299 44.137 -10.490 1.00 0.00 H ATOM 813 HG3 PRO A 51 -9.047 45.885 -11.644 1.00 0.00 H ATOM 814 HG2 PRO A 51 -8.953 46.663 -10.047 1.00 0.00 H ATOM 815 HB2 PRO A 51 -7.117 47.779 -10.553 1.00 0.00 H ATOM 816 HB3 PRO A 51 -7.850 47.656 -12.169 1.00 0.00 H ATOM 817 N VAL A 52 -4.545 47.780 -12.418 1.00 17.06 N ATOM 818 CA VAL A 52 -3.384 48.605 -12.232 1.00 16.60 C ATOM 819 C VAL A 52 -3.566 49.377 -10.930 1.00 15.85 C ATOM 820 O VAL A 52 -4.622 49.768 -10.634 1.00 14.73 O ATOM 821 CB VAL A 52 -3.196 49.576 -13.434 1.00 20.00 C ATOM 822 CG1 VAL A 52 -2.074 50.468 -13.225 1.00 20.00 C ATOM 823 CG2 VAL A 52 -3.023 48.804 -14.693 1.00 20.00 C ATOM 824 HA VAL A 52 -2.487 47.987 -12.179 1.00 0.00 H ATOM 825 HB VAL A 52 -4.093 50.190 -13.515 1.00 0.00 H ATOM 826 HG11 VAL A 52 -2.245 51.060 -12.326 1.00 0.00 H ATOM 827 HG12 VAL A 52 -1.162 49.882 -13.108 1.00 0.00 H ATOM 828 HG13 VAL A 52 -1.974 51.131 -14.084 1.00 0.00 H ATOM 829 HG21 VAL A 52 -2.144 48.165 -14.608 1.00 0.00 H ATOM 830 HG22 VAL A 52 -3.906 48.189 -14.865 1.00 0.00 H ATOM 831 HG23 VAL A 52 -2.892 49.495 -15.526 1.00 0.00 H ATOM 832 H VAL A 52 -5.100 47.890 -13.290 1.00 0.00 H ATOM 833 N GLY A 53 -2.492 49.577 -10.204 1.00 15.56 N ATOM 834 CA GLY A 53 -2.493 50.275 -8.953 1.00 16.32 C ATOM 835 C GLY A 53 -3.066 49.516 -7.782 1.00 16.69 C ATOM 836 O GLY A 53 -3.312 50.103 -6.794 1.00 17.43 O ATOM 837 HA3 GLY A 53 -3.076 51.188 -9.079 1.00 0.00 H ATOM 838 HA2 GLY A 53 -1.462 50.534 -8.713 1.00 0.00 H ATOM 839 H GLY A 53 -1.587 49.207 -10.557 1.00 0.00 H ATOM 840 N THR A 54 -3.248 48.213 -7.927 1.00 17.20 N ATOM 841 CA THR A 54 -3.755 47.376 -6.854 1.00 17.71 C ATOM 842 C THR A 54 -2.795 46.234 -6.673 1.00 18.50 C ATOM 843 O THR A 54 -1.854 46.058 -7.453 1.00 18.32 O ATOM 844 CB THR A 54 -5.164 46.752 -7.136 1.00 17.95 C ATOM 845 OG1 THR A 54 -5.059 45.775 -8.171 1.00 18.56 O ATOM 846 CG2 THR A 54 -6.212 47.805 -7.512 1.00 17.76 C ATOM 847 HA THR A 54 -3.852 48.015 -5.977 1.00 0.00 H ATOM 848 HB THR A 54 -5.502 46.283 -6.212 1.00 0.00 H ATOM 849 HG1 THR A 54 -4.719 46.205 -8.995 1.00 0.00 H ATOM 850 HG23 THR A 54 -6.284 48.545 -6.715 1.00 0.00 H ATOM 851 HG21 THR A 54 -5.916 48.295 -8.439 1.00 0.00 H ATOM 852 HG22 THR A 54 -7.179 47.321 -7.648 1.00 0.00 H ATOM 853 H THR A 54 -3.020 47.773 -8.841 1.00 0.00 H ATOM 854 N ALA A 55 -3.032 45.454 -5.626 1.00 19.02 N ATOM 855 CA ALA A 55 -2.251 44.272 -5.410 1.00 19.49 C ATOM 856 C ALA A 55 -3.238 43.165 -5.033 1.00 20.01 C ATOM 857 O ALA A 55 -4.319 43.418 -4.485 1.00 19.36 O ATOM 858 CB ALA A 55 -1.199 44.503 -4.316 1.00 19.42 C ATOM 859 HA ALA A 55 -1.693 43.993 -6.304 1.00 0.00 H ATOM 860 HB1 ALA A 55 -0.534 45.313 -4.618 1.00 0.00 H ATOM 861 HB2 ALA A 55 -1.698 44.769 -3.384 1.00 0.00 H ATOM 862 HB3 ALA A 55 -0.620 43.591 -4.172 1.00 0.00 H ATOM 863 H ALA A 55 -3.789 45.702 -4.958 1.00 0.00 H ATOM 864 N LYS A 56 -2.862 41.948 -5.334 1.00 20.01 N ATOM 865 CA LYS A 56 -3.697 40.808 -5.091 1.00 20.55 C ATOM 866 C LYS A 56 -2.811 39.686 -4.694 1.00 20.59 C ATOM 867 O LYS A 56 -1.891 39.379 -5.373 1.00 21.06 O ATOM 868 CB LYS A 56 -4.525 40.424 -6.307 1.00 19.88 C ATOM 869 CG LYS A 56 -5.308 39.157 -6.084 1.00 22.64 C ATOM 870 CD LYS A 56 -6.620 39.160 -6.707 1.00 27.65 C ATOM 871 CE LYS A 56 -6.936 37.740 -7.057 1.00 30.00 C ATOM 872 NZ LYS A 56 -8.265 37.220 -6.638 1.00 33.89 N ATOM 873 HA LYS A 56 -4.410 41.048 -4.303 1.00 0.00 H ATOM 874 HB2 LYS A 56 -5.221 41.233 -6.528 1.00 0.00 H ATOM 875 HB3 LYS A 56 -3.857 40.279 -7.156 1.00 0.00 H ATOM 876 HG2 LYS A 56 -4.736 38.323 -6.491 1.00 0.00 H ATOM 877 HG3 LYS A 56 -5.437 39.017 -5.011 1.00 0.00 H ATOM 878 HD2 LYS A 56 -7.364 39.550 -6.013 1.00 0.00 H ATOM 879 HD3 LYS A 56 -6.607 39.775 -7.607 1.00 0.00 H ATOM 880 HE2 LYS A 56 -6.176 37.110 -6.595 1.00 0.00 H ATOM 881 HE3 LYS A 56 -6.873 37.647 -8.141 1.00 0.00 H ATOM 882 HZ1 LYS A 56 -8.348 37.278 -5.603 1.00 0.00 H ATOM 883 HZ2 LYS A 56 -9.014 37.790 -7.080 1.00 0.00 H ATOM 884 HZ3 LYS A 56 -8.359 36.229 -6.939 1.00 0.00 H ATOM 885 H LYS A 56 -1.926 41.803 -5.764 1.00 0.00 H ATOM 886 N THR A 57 -3.114 39.090 -3.563 1.00 20.79 N ATOM 887 CA THR A 57 -2.286 38.051 -2.962 1.00 20.76 C ATOM 888 C THR A 57 -2.836 36.665 -3.274 1.00 21.18 C ATOM 889 O THR A 57 -4.043 36.409 -3.163 1.00 21.04 O ATOM 890 CB THR A 57 -2.183 38.255 -1.429 1.00 21.13 C ATOM 891 OG1 THR A 57 -1.618 39.547 -1.166 1.00 21.05 O ATOM 892 CG2 THR A 57 -1.313 37.178 -0.771 1.00 19.78 C ATOM 893 HA THR A 57 -1.288 38.127 -3.393 1.00 0.00 H ATOM 894 HB THR A 57 -3.185 38.181 -1.007 1.00 0.00 H ATOM 895 HG1 THR A 57 -2.199 40.246 -1.558 1.00 0.00 H ATOM 896 HG23 THR A 57 -1.741 36.195 -0.970 1.00 0.00 H ATOM 897 HG21 THR A 57 -0.305 37.226 -1.182 1.00 0.00 H ATOM 898 HG22 THR A 57 -1.277 37.349 0.305 1.00 0.00 H ATOM 899 H THR A 57 -3.986 39.373 -3.073 1.00 0.00 H ATOM 900 N VAL A 58 -1.946 35.774 -3.693 1.00 21.43 N ATOM 901 CA VAL A 58 -2.318 34.374 -3.882 1.00 21.35 C ATOM 902 C VAL A 58 -1.378 33.530 -3.029 1.00 22.26 C ATOM 903 O VAL A 58 -0.155 33.604 -3.180 1.00 21.23 O ATOM 904 CB VAL A 58 -2.289 33.930 -5.362 1.00 21.11 C ATOM 905 CG1 VAL A 58 -2.507 32.414 -5.463 1.00 19.98 C ATOM 906 CG2 VAL A 58 -3.378 34.630 -6.155 1.00 21.04 C ATOM 907 HA VAL A 58 -3.353 34.238 -3.569 1.00 0.00 H ATOM 908 HB VAL A 58 -1.315 34.196 -5.772 1.00 0.00 H ATOM 909 HG11 VAL A 58 -1.716 31.897 -4.919 1.00 0.00 H ATOM 910 HG12 VAL A 58 -3.474 32.158 -5.031 1.00 0.00 H ATOM 911 HG13 VAL A 58 -2.484 32.114 -6.511 1.00 0.00 H ATOM 912 HG21 VAL A 58 -4.351 34.381 -5.731 1.00 0.00 H ATOM 913 HG22 VAL A 58 -3.224 35.708 -6.107 1.00 0.00 H ATOM 914 HG23 VAL A 58 -3.338 34.301 -7.194 1.00 0.00 H ATOM 915 H VAL A 58 -0.971 36.077 -3.889 1.00 0.00 H HETATM 916 N MSE A 59 -1.978 32.748 -2.130 1.00 23.46 N HETATM 917 CA MSE A 59 -1.261 31.906 -1.194 1.00 24.93 C HETATM 918 C MSE A 59 -0.755 30.657 -1.889 1.00 25.40 C HETATM 919 O MSE A 59 -1.534 29.926 -2.519 1.00 25.67 O HETATM 920 CB MSE A 59 -2.184 31.472 -0.047 1.00 25.56 C HETATM 921 CG MSE A 59 -2.811 32.594 0.733 1.00 28.28 C HETATM 922 SE MSE A 59 -1.420 33.656 1.645 1.00 36.69 S HETATM 923 CE MSE A 59 -0.693 32.305 2.838 1.00 31.27 C HETATM 924 HE3 MSE A 59 0.111 32.741 3.432 1.00 0.00 H HETATM 925 HE2 MSE A 59 -0.303 31.475 2.250 1.00 0.00 H HETATM 926 HE1 MSE A 59 -1.481 31.944 3.500 1.00 0.00 H HETATM 927 HG2 MSE A 59 -3.367 33.239 0.052 1.00 0.00 H HETATM 928 HG1 MSE A 59 -3.492 32.179 1.476 1.00 0.00 H HETATM 929 HB2 MSE A 59 -1.599 30.866 0.645 1.00 0.00 H HETATM 930 HB1 MSE A 59 -2.986 30.867 -0.470 1.00 0.00 H HETATM 931 HA MSE A 59 -0.424 32.483 -0.802 1.00 0.00 H HETATM 932 H MSE A 59 -3.018 32.742 -2.099 1.00 0.00 H ATOM 933 N CYS A 60 0.545 30.409 -1.758 1.00 25.34 N ATOM 934 CA CYS A 60 1.142 29.158 -2.199 1.00 25.43 C ATOM 935 C CYS A 60 1.510 28.353 -0.952 1.00 25.64 C ATOM 936 O CYS A 60 2.647 28.424 -0.470 1.00 25.92 O ATOM 937 CB CYS A 60 2.369 29.441 -3.050 1.00 25.19 C ATOM 938 SG CYS A 60 1.960 30.302 -4.577 1.00 25.61 S ATOM 939 HA CYS A 60 0.443 28.588 -2.811 1.00 0.00 H ATOM 940 HB2 CYS A 60 2.849 28.494 -3.299 1.00 0.00 H ATOM 941 HB3 CYS A 60 3.060 30.057 -2.475 1.00 0.00 H ATOM 942 HG CYS A 60 3.114 30.527 -5.300 1.00 0.00 H ATOM 943 H CYS A 60 1.154 31.133 -1.326 1.00 0.00 H ATOM 944 N GLY A 61 0.531 27.607 -0.434 1.00 25.72 N ATOM 945 CA GLY A 61 0.626 26.968 0.875 1.00 24.91 C ATOM 946 C GLY A 61 0.527 28.042 1.939 1.00 24.96 C ATOM 947 O GLY A 61 -0.514 28.691 2.080 1.00 25.22 O ATOM 948 HA3 GLY A 61 1.580 26.449 0.963 1.00 0.00 H ATOM 949 HA2 GLY A 61 -0.188 26.253 0.996 1.00 0.00 H ATOM 950 H GLY A 61 -0.339 27.475 -0.989 1.00 0.00 H ATOM 951 N THR A 62 1.623 28.246 2.666 1.00 24.10 N ATOM 952 CA THR A 62 1.690 29.268 3.708 1.00 23.69 C ATOM 953 C THR A 62 2.346 30.540 3.166 1.00 23.07 C ATOM 954 O THR A 62 2.395 31.565 3.848 1.00 22.98 O ATOM 955 CB THR A 62 2.471 28.771 4.962 1.00 23.74 C ATOM 956 OG1 THR A 62 3.823 28.448 4.600 1.00 24.02 O ATOM 957 CG2 THR A 62 1.801 27.531 5.568 1.00 24.76 C ATOM 958 HA THR A 62 0.666 29.485 4.012 1.00 0.00 H ATOM 959 HB THR A 62 2.467 29.571 5.703 1.00 0.00 H ATOM 960 HG1 THR A 62 4.268 29.254 4.236 1.00 0.00 H ATOM 961 HG23 THR A 62 0.775 27.773 5.844 1.00 0.00 H ATOM 962 HG21 THR A 62 1.801 26.725 4.835 1.00 0.00 H ATOM 963 HG22 THR A 62 2.353 27.218 6.454 1.00 0.00 H ATOM 964 H THR A 62 2.461 27.657 2.486 1.00 0.00 H ATOM 965 N TYR A 63 2.825 30.463 1.925 1.00 21.95 N ATOM 966 CA TYR A 63 3.643 31.513 1.342 1.00 21.16 C ATOM 967 C TYR A 63 2.858 32.448 0.411 1.00 20.31 C ATOM 968 O TYR A 63 2.389 32.027 -0.670 1.00 19.10 O ATOM 969 CB TYR A 63 4.835 30.889 0.607 1.00 21.70 C ATOM 970 CG TYR A 63 5.913 31.891 0.247 1.00 22.14 C ATOM 971 CD1 TYR A 63 6.934 32.205 1.156 1.00 23.67 C ATOM 972 CD2 TYR A 63 5.930 32.504 -1.000 1.00 21.27 C ATOM 973 CE1 TYR A 63 7.939 33.138 0.824 1.00 22.05 C ATOM 974 CE2 TYR A 63 6.931 33.436 -1.344 1.00 22.80 C ATOM 975 CZ TYR A 63 7.932 33.742 -0.426 1.00 22.80 C ATOM 976 OH TYR A 63 8.921 34.651 -0.754 1.00 19.07 O ATOM 977 HA TYR A 63 3.998 32.137 2.162 1.00 0.00 H ATOM 978 HB3 TYR A 63 4.472 30.427 -0.311 1.00 0.00 H ATOM 979 HB2 TYR A 63 5.274 30.124 1.248 1.00 0.00 H ATOM 980 HD2 TYR A 63 5.155 32.260 -1.726 1.00 0.00 H ATOM 981 HE2 TYR A 63 6.921 33.914 -2.323 1.00 0.00 H ATOM 982 HE1 TYR A 63 8.718 33.384 1.546 1.00 0.00 H ATOM 983 HD1 TYR A 63 6.951 31.721 2.133 1.00 0.00 H ATOM 984 HH TYR A 63 9.545 34.748 0.009 1.00 0.00 H ATOM 985 H TYR A 63 2.606 29.622 1.354 1.00 0.00 H ATOM 986 N PRO A 64 2.728 33.725 0.819 1.00 19.09 N ATOM 987 CA PRO A 64 2.025 34.697 0.003 1.00 18.07 C ATOM 988 C PRO A 64 2.880 35.236 -1.138 1.00 18.05 C ATOM 989 O PRO A 64 4.053 35.596 -0.950 1.00 17.73 O ATOM 990 CB PRO A 64 1.712 35.839 0.988 1.00 17.91 C ATOM 991 CG PRO A 64 2.153 35.352 2.360 1.00 18.61 C ATOM 992 CD PRO A 64 3.199 34.324 2.080 1.00 19.26 C ATOM 993 HA PRO A 64 1.148 34.254 -0.469 1.00 0.00 H ATOM 994 HD3 PRO A 64 4.180 34.783 1.956 1.00 0.00 H ATOM 995 HD2 PRO A 64 3.245 33.581 2.876 1.00 0.00 H ATOM 996 HG3 PRO A 64 1.315 34.911 2.899 1.00 0.00 H ATOM 997 HG2 PRO A 64 2.568 36.173 2.945 1.00 0.00 H ATOM 998 HB2 PRO A 64 2.263 36.738 0.711 1.00 0.00 H ATOM 999 HB3 PRO A 64 0.644 36.055 0.989 1.00 0.00 H ATOM 1000 N VAL A 65 2.273 35.279 -2.320 1.00 17.23 N ATOM 1001 CA VAL A 65 2.835 35.996 -3.445 1.00 16.61 C ATOM 1002 C VAL A 65 1.901 37.161 -3.639 1.00 16.13 C ATOM 1003 O VAL A 65 0.714 36.977 -3.936 1.00 16.27 O ATOM 1004 CB VAL A 65 2.928 35.077 -4.705 1.00 16.66 C ATOM 1005 CG1 VAL A 65 3.393 35.861 -5.966 1.00 16.53 C ATOM 1006 CG2 VAL A 65 3.875 33.922 -4.429 1.00 17.38 C ATOM 1007 HA VAL A 65 3.858 36.330 -3.274 1.00 0.00 H ATOM 1008 HB VAL A 65 1.929 34.693 -4.911 1.00 0.00 H ATOM 1009 HG11 VAL A 65 2.682 36.660 -6.178 1.00 0.00 H ATOM 1010 HG12 VAL A 65 4.379 36.289 -5.783 1.00 0.00 H ATOM 1011 HG13 VAL A 65 3.443 35.181 -6.817 1.00 0.00 H ATOM 1012 HG21 VAL A 65 4.865 34.314 -4.193 1.00 0.00 H ATOM 1013 HG22 VAL A 65 3.502 33.342 -3.585 1.00 0.00 H ATOM 1014 HG23 VAL A 65 3.936 33.285 -5.311 1.00 0.00 H ATOM 1015 H VAL A 65 1.367 34.783 -2.440 1.00 0.00 H ATOM 1016 N ILE A 66 2.419 38.363 -3.411 1.00 16.03 N ATOM 1017 CA ILE A 66 1.643 39.576 -3.592 1.00 15.30 C ATOM 1018 C ILE A 66 1.883 40.084 -5.025 1.00 15.16 C ATOM 1019 O ILE A 66 2.961 40.571 -5.357 1.00 15.76 O ATOM 1020 CB ILE A 66 1.989 40.627 -2.518 1.00 15.40 C ATOM 1021 CG1 ILE A 66 1.876 40.012 -1.106 1.00 15.54 C ATOM 1022 CG2 ILE A 66 1.068 41.871 -2.624 1.00 16.84 C ATOM 1023 CD1 ILE A 66 2.583 40.847 -0.009 1.00 16.41 C ATOM 1024 HA ILE A 66 0.580 39.372 -3.464 1.00 0.00 H ATOM 1025 HB ILE A 66 3.016 40.948 -2.690 1.00 0.00 H ATOM 1026 HG12 ILE A 66 0.820 39.929 -0.849 1.00 0.00 H ATOM 1027 HG13 ILE A 66 2.323 39.018 -1.126 1.00 0.00 H ATOM 1028 HD11 ILE A 66 3.644 40.931 -0.245 1.00 0.00 H ATOM 1029 HD12 ILE A 66 2.139 41.842 0.031 1.00 0.00 H ATOM 1030 HD13 ILE A 66 2.462 40.354 0.956 1.00 0.00 H ATOM 1031 HG21 ILE A 66 1.188 42.328 -3.606 1.00 0.00 H ATOM 1032 HG22 ILE A 66 0.030 41.566 -2.488 1.00 0.00 H ATOM 1033 HG23 ILE A 66 1.341 42.590 -1.852 1.00 0.00 H ATOM 1034 H ILE A 66 3.407 38.437 -3.094 1.00 0.00 H ATOM 1035 N HIS A 67 0.874 39.953 -5.870 1.00 14.95 N ATOM 1036 CA HIS A 67 0.986 40.472 -7.218 1.00 14.90 C ATOM 1037 C HIS A 67 0.650 41.960 -7.168 1.00 14.33 C ATOM 1038 O HIS A 67 -0.487 42.332 -6.919 1.00 15.59 O ATOM 1039 CB HIS A 67 0.068 39.721 -8.181 1.00 14.60 C ATOM 1040 CG HIS A 67 0.387 38.260 -8.281 1.00 15.92 C ATOM 1041 ND1 HIS A 67 1.338 37.764 -9.146 1.00 16.38 N ATOM 1042 CD2 HIS A 67 -0.085 37.196 -7.587 1.00 17.73 C ATOM 1043 CE1 HIS A 67 1.437 36.454 -8.982 1.00 17.43 C ATOM 1044 NE2 HIS A 67 0.576 36.082 -8.051 1.00 15.48 N ATOM 1045 HA HIS A 67 1.999 40.331 -7.594 1.00 0.00 H ATOM 1046 HB2 HIS A 67 -0.960 39.829 -7.835 1.00 0.00 H ATOM 1047 HB3 HIS A 67 0.165 40.166 -9.171 1.00 0.00 H ATOM 1048 HD2 HIS A 67 -0.846 37.218 -6.807 1.00 0.00 H ATOM 1049 HE1 HIS A 67 2.114 35.794 -9.524 1.00 0.00 H ATOM 1050 H HIS A 67 0.000 39.477 -5.567 1.00 0.00 H ATOM 1051 N ALA A 68 1.646 42.798 -7.389 1.00 14.27 N ATOM 1052 CA ALA A 68 1.430 44.245 -7.407 1.00 14.30 C ATOM 1053 C ALA A 68 1.569 44.770 -8.826 1.00 14.37 C ATOM 1054 O ALA A 68 2.584 44.509 -9.490 1.00 15.79 O ATOM 1055 CB ALA A 68 2.415 44.950 -6.500 1.00 13.45 C ATOM 1056 HA ALA A 68 0.423 44.446 -7.042 1.00 0.00 H ATOM 1057 HB1 ALA A 68 2.289 44.589 -5.479 1.00 0.00 H ATOM 1058 HB2 ALA A 68 3.430 44.743 -6.838 1.00 0.00 H ATOM 1059 HB3 ALA A 68 2.232 46.024 -6.532 1.00 0.00 H ATOM 1060 H ALA A 68 2.602 42.423 -7.553 1.00 0.00 H ATOM 1061 N VAL A 69 0.567 45.515 -9.281 1.00 14.90 N ATOM 1062 CA VAL A 69 0.525 45.960 -10.678 1.00 14.43 C ATOM 1063 C VAL A 69 0.826 47.448 -10.750 1.00 15.21 C ATOM 1064 O VAL A 69 -0.047 48.297 -10.507 1.00 15.63 O ATOM 1065 CB VAL A 69 -0.836 45.656 -11.356 1.00 14.64 C ATOM 1066 CG1 VAL A 69 -0.781 46.025 -12.848 1.00 13.70 C ATOM 1067 CG2 VAL A 69 -1.201 44.178 -11.203 1.00 15.43 C ATOM 1068 HA VAL A 69 1.285 45.400 -11.224 1.00 0.00 H ATOM 1069 HB VAL A 69 -1.601 46.257 -10.865 1.00 0.00 H ATOM 1070 HG11 VAL A 69 -0.560 47.088 -12.950 1.00 0.00 H ATOM 1071 HG12 VAL A 69 -0.000 45.442 -13.337 1.00 0.00 H ATOM 1072 HG13 VAL A 69 -1.743 45.806 -13.311 1.00 0.00 H ATOM 1073 HG21 VAL A 69 -0.430 43.565 -11.670 1.00 0.00 H ATOM 1074 HG22 VAL A 69 -1.272 43.930 -10.144 1.00 0.00 H ATOM 1075 HG23 VAL A 69 -2.159 43.990 -11.687 1.00 0.00 H ATOM 1076 H VAL A 69 -0.201 45.787 -8.635 1.00 0.00 H ATOM 1077 N GLY A 70 2.073 47.766 -11.056 1.00 15.16 N ATOM 1078 CA GLY A 70 2.426 49.164 -11.334 1.00 14.80 C ATOM 1079 C GLY A 70 1.923 49.567 -12.703 1.00 14.81 C ATOM 1080 O GLY A 70 1.573 48.706 -13.537 1.00 13.86 O ATOM 1081 HA3 GLY A 70 3.510 49.276 -11.301 1.00 0.00 H ATOM 1082 HA2 GLY A 70 1.973 49.807 -10.580 1.00 0.00 H ATOM 1083 H GLY A 70 2.803 47.026 -11.100 1.00 0.00 H ATOM 1084 N PRO A 71 1.860 50.886 -12.953 1.00 14.11 N ATOM 1085 CA PRO A 71 1.414 51.331 -14.253 1.00 13.63 C ATOM 1086 C PRO A 71 2.505 51.172 -15.319 1.00 14.07 C ATOM 1087 O PRO A 71 3.704 51.304 -15.022 1.00 13.73 O ATOM 1088 CB PRO A 71 1.164 52.825 -14.039 1.00 13.36 C ATOM 1089 CG PRO A 71 2.151 53.231 -12.972 1.00 14.28 C ATOM 1090 CD PRO A 71 2.140 52.009 -12.038 1.00 12.96 C ATOM 1091 HA PRO A 71 0.551 50.762 -14.600 1.00 0.00 H ATOM 1092 HD3 PRO A 71 3.105 51.883 -11.548 1.00 0.00 H ATOM 1093 HD2 PRO A 71 1.360 52.101 -11.282 1.00 0.00 H ATOM 1094 HG3 PRO A 71 1.823 54.130 -12.451 1.00 0.00 H ATOM 1095 HG2 PRO A 71 3.142 53.398 -13.393 1.00 0.00 H ATOM 1096 HB2 PRO A 71 1.343 53.380 -14.960 1.00 0.00 H ATOM 1097 HB3 PRO A 71 0.142 53.000 -13.704 1.00 0.00 H ATOM 1098 N ASN A 72 2.083 50.902 -16.551 1.00 13.26 N ATOM 1099 CA ASN A 72 3.007 50.965 -17.676 1.00 13.36 C ATOM 1100 C ASN A 72 3.099 52.417 -18.155 1.00 13.89 C ATOM 1101 O ASN A 72 2.118 52.947 -18.663 1.00 14.38 O ATOM 1102 CB ASN A 72 2.555 50.016 -18.800 1.00 13.08 C ATOM 1103 CG ASN A 72 3.534 49.986 -19.957 1.00 13.27 C ATOM 1104 OD1 ASN A 72 4.530 50.707 -19.948 1.00 13.81 O ATOM 1105 ND2 ASN A 72 3.249 49.165 -20.966 1.00 12.53 N ATOM 1106 HA ASN A 72 3.999 50.636 -17.366 1.00 0.00 H ATOM 1107 HB2 ASN A 72 2.462 49.009 -18.393 1.00 0.00 H ATOM 1108 HB3 ASN A 72 1.585 50.348 -19.170 1.00 0.00 H ATOM 1109 HD22 ASN A 72 2.394 48.573 -20.930 1.00 0.00 H ATOM 1110 HD21 ASN A 72 3.881 49.115 -21.790 1.00 0.00 H ATOM 1111 H ASN A 72 1.088 50.645 -16.712 1.00 0.00 H ATOM 1112 N PHE A 73 4.247 53.071 -17.966 1.00 13.97 N ATOM 1113 CA PHE A 73 4.382 54.500 -18.359 1.00 14.74 C ATOM 1114 C PHE A 73 4.409 54.747 -19.858 1.00 15.37 C ATOM 1115 O PHE A 73 4.440 55.901 -20.284 1.00 15.19 O ATOM 1116 CB PHE A 73 5.599 55.158 -17.709 1.00 14.99 C ATOM 1117 CG PHE A 73 5.380 55.506 -16.273 1.00 15.48 C ATOM 1118 CD1 PHE A 73 4.756 56.706 -15.925 1.00 15.29 C ATOM 1119 CD2 PHE A 73 5.731 54.607 -15.268 1.00 16.14 C ATOM 1120 CE1 PHE A 73 4.541 57.028 -14.588 1.00 15.69 C ATOM 1121 CE2 PHE A 73 5.526 54.933 -13.928 1.00 13.93 C ATOM 1122 CZ PHE A 73 4.912 56.143 -13.596 1.00 15.56 C ATOM 1123 HA PHE A 73 3.469 54.963 -17.984 1.00 0.00 H ATOM 1124 HB2 PHE A 73 6.442 54.470 -17.775 1.00 0.00 H ATOM 1125 HB3 PHE A 73 5.833 56.071 -18.256 1.00 0.00 H ATOM 1126 HD2 PHE A 73 6.168 53.644 -15.531 1.00 0.00 H ATOM 1127 HE2 PHE A 73 5.843 54.247 -13.143 1.00 0.00 H ATOM 1128 HZ PHE A 73 4.725 56.389 -12.551 1.00 0.00 H ATOM 1129 HE1 PHE A 73 4.079 57.980 -14.324 1.00 0.00 H ATOM 1130 HD1 PHE A 73 4.435 57.395 -16.706 1.00 0.00 H ATOM 1131 H PHE A 73 5.056 52.576 -17.539 1.00 0.00 H ATOM 1132 N SER A 74 4.403 53.669 -20.647 1.00 15.37 N ATOM 1133 CA SER A 74 4.165 53.785 -22.071 1.00 16.99 C ATOM 1134 C SER A 74 2.687 54.109 -22.326 1.00 17.47 C ATOM 1135 O SER A 74 2.373 54.738 -23.334 1.00 17.49 O ATOM 1136 CB SER A 74 4.557 52.502 -22.826 1.00 16.66 C ATOM 1137 OG SER A 74 5.945 52.241 -22.735 1.00 18.22 O ATOM 1138 HA SER A 74 4.792 54.594 -22.447 1.00 0.00 H ATOM 1139 HB2 SER A 74 4.287 52.614 -23.876 1.00 0.00 H ATOM 1140 HB3 SER A 74 4.011 51.661 -22.399 1.00 0.00 H ATOM 1141 HG SER A 74 6.448 52.998 -23.126 1.00 0.00 H ATOM 1142 H SER A 74 4.572 52.731 -20.232 1.00 0.00 H ATOM 1143 N ASN A 75 1.793 53.669 -21.432 1.00 17.21 N ATOM 1144 CA ASN A 75 0.337 53.891 -21.582 1.00 17.80 C ATOM 1145 C ASN A 75 -0.220 55.014 -20.705 1.00 17.83 C ATOM 1146 O ASN A 75 -1.113 55.736 -21.127 1.00 18.14 O ATOM 1147 CB ASN A 75 -0.479 52.625 -21.292 1.00 17.55 C ATOM 1148 CG ASN A 75 -0.048 51.429 -22.128 1.00 19.34 C ATOM 1149 OD1 ASN A 75 0.361 51.569 -23.275 1.00 23.62 O ATOM 1150 ND2 ASN A 75 -0.139 50.252 -21.549 1.00 19.32 N ATOM 1151 HA ASN A 75 0.231 54.183 -22.627 1.00 0.00 H ATOM 1152 HB2 ASN A 75 -0.363 52.371 -20.238 1.00 0.00 H ATOM 1153 HB3 ASN A 75 -1.528 52.834 -21.500 1.00 0.00 H ATOM 1154 HD22 ASN A 75 -0.492 50.178 -20.573 1.00 0.00 H ATOM 1155 HD21 ASN A 75 0.142 49.395 -22.067 1.00 0.00 H ATOM 1156 H ASN A 75 2.135 53.150 -20.598 1.00 0.00 H ATOM 1157 N TYR A 76 0.307 55.144 -19.493 1.00 16.59 N ATOM 1158 CA TYR A 76 -0.104 56.199 -18.557 1.00 16.77 C ATOM 1159 C TYR A 76 0.672 57.498 -18.742 1.00 16.68 C ATOM 1160 O TYR A 76 1.865 57.476 -19.042 1.00 16.52 O ATOM 1161 CB TYR A 76 0.093 55.720 -17.107 1.00 15.91 C ATOM 1162 CG TYR A 76 -1.000 54.774 -16.666 1.00 16.29 C ATOM 1163 CD1 TYR A 76 -2.138 55.255 -16.021 1.00 15.77 C ATOM 1164 CD2 TYR A 76 -0.918 53.403 -16.940 1.00 16.86 C ATOM 1165 CE1 TYR A 76 -3.159 54.386 -15.640 1.00 17.04 C ATOM 1166 CE2 TYR A 76 -1.927 52.528 -16.551 1.00 15.51 C ATOM 1167 CZ TYR A 76 -3.045 53.036 -15.917 1.00 16.06 C ATOM 1168 OH TYR A 76 -4.065 52.201 -15.570 1.00 16.43 O ATOM 1169 HA TYR A 76 -1.154 56.402 -18.767 1.00 0.00 H ATOM 1170 HB3 TYR A 76 0.094 56.588 -16.447 1.00 0.00 H ATOM 1171 HB2 TYR A 76 1.052 55.208 -17.033 1.00 0.00 H ATOM 1172 HD2 TYR A 76 -0.047 53.014 -17.468 1.00 0.00 H ATOM 1173 HE2 TYR A 76 -1.837 51.459 -16.743 1.00 0.00 H ATOM 1174 HE1 TYR A 76 -4.042 54.768 -15.127 1.00 0.00 H ATOM 1175 HD1 TYR A 76 -2.230 56.321 -15.813 1.00 0.00 H ATOM 1176 HH TYR A 76 -4.781 52.723 -15.129 1.00 0.00 H ATOM 1177 H TYR A 76 1.041 54.471 -19.194 1.00 0.00 H ATOM 1178 N SER A 77 0.013 58.630 -18.483 1.00 16.69 N ATOM 1179 CA SER A 77 0.720 59.921 -18.476 1.00 16.03 C ATOM 1180 C SER A 77 1.581 59.931 -17.229 1.00 15.83 C ATOM 1181 O SER A 77 1.374 59.102 -16.348 1.00 14.92 O ATOM 1182 CB SER A 77 -0.274 61.086 -18.442 1.00 15.75 C ATOM 1183 OG SER A 77 -1.013 61.063 -17.247 1.00 15.79 O ATOM 1184 HA SER A 77 1.322 60.039 -19.377 1.00 0.00 H ATOM 1185 HB2 SER A 77 -0.956 61.002 -19.288 1.00 0.00 H ATOM 1186 HB3 SER A 77 0.272 62.027 -18.509 1.00 0.00 H ATOM 1187 HG SER A 77 -1.650 61.821 -17.240 1.00 0.00 H ATOM 1188 H SER A 77 -1.007 58.599 -18.285 1.00 0.00 H ATOM 1189 N GLU A 78 2.542 60.848 -17.147 1.00 15.39 N ATOM 1190 CA GLU A 78 3.361 60.985 -15.947 1.00 14.80 C ATOM 1191 C GLU A 78 2.502 61.215 -14.705 1.00 14.15 C ATOM 1192 O GLU A 78 2.748 60.618 -13.651 1.00 12.67 O ATOM 1193 CB GLU A 78 4.380 62.134 -16.082 1.00 15.30 C ATOM 1194 CG GLU A 78 5.527 61.896 -17.092 1.00 16.65 C ATOM 1195 CD GLU A 78 6.368 60.644 -16.778 1.00 19.37 C ATOM 1196 OE1 GLU A 78 6.653 60.351 -15.585 1.00 19.39 O ATOM 1197 OE2 GLU A 78 6.734 59.949 -17.740 1.00 18.35 O ATOM 1198 HA GLU A 78 3.903 60.046 -15.834 1.00 0.00 H ATOM 1199 HB2 GLU A 78 3.839 63.027 -16.393 1.00 0.00 H ATOM 1200 HB3 GLU A 78 4.826 62.304 -15.102 1.00 0.00 H ATOM 1201 HG2 GLU A 78 5.095 61.782 -18.086 1.00 0.00 H ATOM 1202 HG3 GLU A 78 6.184 62.766 -17.081 1.00 0.00 H ATOM 1203 H GLU A 78 2.713 61.480 -17.955 1.00 0.00 H ATOM 1204 N SER A 79 1.502 62.079 -14.830 1.00 13.35 N ATOM 1205 CA SER A 79 0.609 62.415 -13.699 1.00 13.57 C ATOM 1206 C SER A 79 -0.192 61.183 -13.232 1.00 13.97 C ATOM 1207 O SER A 79 -0.203 60.829 -12.045 1.00 12.84 O ATOM 1208 CB SER A 79 -0.354 63.522 -14.122 1.00 12.56 C ATOM 1209 OG SER A 79 -1.280 63.802 -13.105 1.00 13.79 O ATOM 1210 HA SER A 79 1.225 62.754 -12.866 1.00 0.00 H ATOM 1211 HB2 SER A 79 -0.891 63.205 -15.016 1.00 0.00 H ATOM 1212 HB3 SER A 79 0.216 64.424 -14.344 1.00 0.00 H ATOM 1213 HG SER A 79 -0.797 64.095 -12.292 1.00 0.00 H ATOM 1214 H SER A 79 1.341 62.534 -15.751 1.00 0.00 H ATOM 1215 N GLU A 80 -0.880 60.543 -14.169 1.00 14.97 N ATOM 1216 CA GLU A 80 -1.759 59.429 -13.799 1.00 15.78 C ATOM 1217 C GLU A 80 -0.941 58.215 -13.351 1.00 15.76 C ATOM 1218 O GLU A 80 -1.331 57.523 -12.409 1.00 15.81 O ATOM 1219 CB GLU A 80 -2.723 59.076 -14.934 1.00 16.63 C ATOM 1220 CG GLU A 80 -3.719 60.198 -15.329 1.00 17.54 C ATOM 1221 CD GLU A 80 -4.696 60.594 -14.221 1.00 20.47 C ATOM 1222 OE1 GLU A 80 -5.020 59.776 -13.344 1.00 22.39 O ATOM 1223 OE2 GLU A 80 -5.163 61.748 -14.228 1.00 22.28 O ATOM 1224 HA GLU A 80 -2.367 59.748 -12.952 1.00 0.00 H ATOM 1225 HB2 GLU A 80 -2.131 58.826 -15.814 1.00 0.00 H ATOM 1226 HB3 GLU A 80 -3.301 58.205 -14.627 1.00 0.00 H ATOM 1227 HG2 GLU A 80 -3.145 61.081 -15.609 1.00 0.00 H ATOM 1228 HG3 GLU A 80 -4.297 59.855 -16.187 1.00 0.00 H ATOM 1229 H GLU A 80 -0.796 60.831 -15.165 1.00 0.00 H ATOM 1230 N GLY A 81 0.202 57.999 -14.003 1.00 15.56 N ATOM 1231 CA GLY A 81 1.126 56.922 -13.640 1.00 15.80 C ATOM 1232 C GLY A 81 1.697 57.102 -12.236 1.00 15.91 C ATOM 1233 O GLY A 81 1.854 56.144 -11.501 1.00 14.39 O ATOM 1234 HA3 GLY A 81 1.949 56.909 -14.355 1.00 0.00 H ATOM 1235 HA2 GLY A 81 0.593 55.972 -13.684 1.00 0.00 H ATOM 1236 H GLY A 81 0.447 58.620 -14.801 1.00 0.00 H ATOM 1237 N ASP A 82 1.989 58.345 -11.846 1.00 15.44 N ATOM 1238 CA ASP A 82 2.554 58.578 -10.529 1.00 15.73 C ATOM 1239 C ASP A 82 1.551 58.165 -9.439 1.00 15.97 C ATOM 1240 O ASP A 82 1.926 57.589 -8.406 1.00 15.57 O ATOM 1241 CB ASP A 82 2.942 60.056 -10.358 1.00 15.12 C ATOM 1242 CG ASP A 82 3.886 60.278 -9.203 1.00 15.11 C ATOM 1243 OD1 ASP A 82 4.981 59.656 -9.206 1.00 13.59 O ATOM 1244 OD2 ASP A 82 3.549 61.076 -8.283 1.00 12.99 O ATOM 1245 HA ASP A 82 3.454 57.971 -10.430 1.00 0.00 H ATOM 1246 HB2 ASP A 82 3.424 60.399 -11.274 1.00 0.00 H ATOM 1247 HB3 ASP A 82 2.036 60.637 -10.186 1.00 0.00 H ATOM 1248 H ASP A 82 1.812 59.146 -12.485 1.00 0.00 H ATOM 1249 N ARG A 83 0.282 58.471 -9.679 1.00 16.34 N ATOM 1250 CA ARG A 83 -0.802 58.123 -8.764 1.00 17.24 C ATOM 1251 C ARG A 83 -0.956 56.596 -8.672 1.00 16.41 C ATOM 1252 O ARG A 83 -1.099 56.061 -7.578 1.00 16.60 O ATOM 1253 CB ARG A 83 -2.114 58.736 -9.279 1.00 17.98 C ATOM 1254 CG ARG A 83 -3.127 59.200 -8.250 1.00 21.67 C ATOM 1255 CD ARG A 83 -2.502 60.166 -7.249 1.00 22.77 C ATOM 1256 NE ARG A 83 -3.160 61.468 -7.190 1.00 22.25 N ATOM 1257 CZ ARG A 83 -3.215 62.200 -6.087 1.00 22.56 C ATOM 1258 NH1 ARG A 83 -2.701 61.720 -4.955 1.00 21.09 N ATOM 1259 NH2 ARG A 83 -3.811 63.387 -6.098 1.00 21.94 N ATOM 1260 HA ARG A 83 -0.570 58.514 -7.774 1.00 0.00 H ATOM 1261 HB2 ARG A 83 -1.852 59.599 -9.891 1.00 0.00 H ATOM 1262 HB3 ARG A 83 -2.602 57.986 -9.901 1.00 0.00 H ATOM 1263 HG2 ARG A 83 -3.948 59.702 -8.762 1.00 0.00 H ATOM 1264 HG3 ARG A 83 -3.511 58.332 -7.714 1.00 0.00 H ATOM 1265 HD2 ARG A 83 -1.459 60.321 -7.527 1.00 0.00 H ATOM 1266 HD3 ARG A 83 -2.549 59.712 -6.259 1.00 0.00 H ATOM 1267 HE ARG A 83 -3.606 61.838 -8.054 1.00 0.00 H ATOM 1268 HH12 ARG A 83 -2.740 62.288 -4.084 1.00 0.00 H ATOM 1269 HH11 ARG A 83 -2.261 60.778 -4.942 1.00 0.00 H ATOM 1270 HH22 ARG A 83 -3.851 63.957 -5.229 1.00 0.00 H ATOM 1271 HH21 ARG A 83 -4.238 63.746 -6.976 1.00 0.00 H ATOM 1272 H ARG A 83 0.050 58.980 -10.556 1.00 0.00 H ATOM 1273 N GLU A 84 -0.993 55.914 -9.813 1.00 15.57 N ATOM 1274 CA GLU A 84 -1.145 54.440 -9.825 1.00 16.35 C ATOM 1275 C GLU A 84 0.027 53.723 -9.169 1.00 14.47 C ATOM 1276 O GLU A 84 -0.161 52.697 -8.532 1.00 14.46 O ATOM 1277 CB GLU A 84 -1.330 53.887 -11.245 1.00 16.49 C ATOM 1278 CG GLU A 84 -2.540 54.456 -11.967 1.00 21.03 C ATOM 1279 CD GLU A 84 -3.857 54.112 -11.290 1.00 27.07 C ATOM 1280 OE1 GLU A 84 -3.875 53.287 -10.346 1.00 27.66 O ATOM 1281 OE2 GLU A 84 -4.889 54.675 -11.718 1.00 31.07 O ATOM 1282 HA GLU A 84 -2.045 54.244 -9.243 1.00 0.00 H ATOM 1283 HB2 GLU A 84 -0.439 54.124 -11.826 1.00 0.00 H ATOM 1284 HB3 GLU A 84 -1.444 52.805 -11.182 1.00 0.00 H ATOM 1285 HG2 GLU A 84 -2.443 55.541 -12.005 1.00 0.00 H ATOM 1286 HG3 GLU A 84 -2.557 54.058 -12.982 1.00 0.00 H ATOM 1287 H GLU A 84 -0.914 56.425 -10.715 1.00 0.00 H ATOM 1288 N LEU A 85 1.226 54.272 -9.332 1.00 13.86 N ATOM 1289 CA LEU A 85 2.442 53.678 -8.773 1.00 13.54 C ATOM 1290 C LEU A 85 2.420 53.819 -7.264 1.00 14.06 C ATOM 1291 O LEU A 85 2.697 52.866 -6.532 1.00 14.60 O ATOM 1292 CB LEU A 85 3.715 54.314 -9.372 1.00 13.01 C ATOM 1293 CG LEU A 85 5.080 53.764 -8.917 1.00 12.93 C ATOM 1294 CD1 LEU A 85 5.184 52.215 -9.144 1.00 10.59 C ATOM 1295 CD2 LEU A 85 6.238 54.496 -9.639 1.00 17.77 C ATOM 1296 HA LEU A 85 2.466 52.620 -9.035 1.00 0.00 H ATOM 1297 HB2 LEU A 85 3.660 54.192 -10.454 1.00 0.00 H ATOM 1298 HB3 LEU A 85 3.694 55.376 -9.125 1.00 0.00 H ATOM 1299 HG LEU A 85 5.165 53.950 -7.846 1.00 0.00 H ATOM 1300 HD21 LEU A 85 6.142 54.352 -10.715 1.00 0.00 H ATOM 1301 HD22 LEU A 85 6.193 55.560 -9.408 1.00 0.00 H ATOM 1302 HD23 LEU A 85 7.191 54.089 -9.300 1.00 0.00 H ATOM 1303 HD11 LEU A 85 4.403 51.712 -8.574 1.00 0.00 H ATOM 1304 HD12 LEU A 85 5.060 51.995 -10.204 1.00 0.00 H ATOM 1305 HD13 LEU A 85 6.161 51.865 -8.811 1.00 0.00 H ATOM 1306 H LEU A 85 1.304 55.155 -9.876 1.00 0.00 H ATOM 1307 N ALA A 86 2.055 55.010 -6.800 1.00 13.93 N ATOM 1308 CA ALA A 86 1.847 55.232 -5.379 1.00 13.58 C ATOM 1309 C ALA A 86 0.814 54.232 -4.840 1.00 13.39 C ATOM 1310 O ALA A 86 1.038 53.627 -3.802 1.00 12.72 O ATOM 1311 CB ALA A 86 1.407 56.688 -5.116 1.00 13.31 C ATOM 1312 HA ALA A 86 2.788 55.071 -4.852 1.00 0.00 H ATOM 1313 HB1 ALA A 86 2.180 57.370 -5.471 1.00 0.00 H ATOM 1314 HB2 ALA A 86 0.475 56.886 -5.645 1.00 0.00 H ATOM 1315 HB3 ALA A 86 1.257 56.833 -4.046 1.00 0.00 H ATOM 1316 H ALA A 86 1.916 55.797 -7.466 1.00 0.00 H ATOM 1317 N ALA A 87 -0.288 54.058 -5.567 1.00 13.19 N ATOM 1318 CA ALA A 87 -1.414 53.224 -5.122 1.00 13.99 C ATOM 1319 C ALA A 87 -1.015 51.755 -5.022 1.00 13.98 C ATOM 1320 O ALA A 87 -1.365 51.083 -4.045 1.00 13.36 O ATOM 1321 CB ALA A 87 -2.616 53.387 -6.110 1.00 15.00 C ATOM 1322 HA ALA A 87 -1.711 53.558 -4.128 1.00 0.00 H ATOM 1323 HB1 ALA A 87 -2.927 54.431 -6.133 1.00 0.00 H ATOM 1324 HB2 ALA A 87 -2.309 53.076 -7.109 1.00 0.00 H ATOM 1325 HB3 ALA A 87 -3.447 52.766 -5.775 1.00 0.00 H ATOM 1326 H ALA A 87 -0.355 54.533 -6.490 1.00 0.00 H ATOM 1327 N ALA A 88 -0.289 51.251 -6.033 1.00 13.53 N ATOM 1328 CA ALA A 88 0.197 49.859 -6.012 1.00 14.39 C ATOM 1329 C ALA A 88 1.002 49.573 -4.744 1.00 14.80 C ATOM 1330 O ALA A 88 0.782 48.544 -4.095 1.00 14.28 O ATOM 1331 CB ALA A 88 1.040 49.517 -7.272 1.00 13.86 C ATOM 1332 HA ALA A 88 -0.685 49.219 -6.017 1.00 0.00 H ATOM 1333 HB1 ALA A 88 0.428 49.651 -8.164 1.00 0.00 H ATOM 1334 HB2 ALA A 88 1.905 50.179 -7.320 1.00 0.00 H ATOM 1335 HB3 ALA A 88 1.376 48.482 -7.213 1.00 0.00 H ATOM 1336 H ALA A 88 -0.065 51.856 -6.849 1.00 0.00 H ATOM 1337 N TYR A 89 1.929 50.474 -4.396 1.00 14.27 N ATOM 1338 CA TYR A 89 2.761 50.267 -3.216 1.00 14.52 C ATOM 1339 C TYR A 89 1.919 50.371 -1.925 1.00 15.68 C ATOM 1340 O TYR A 89 2.153 49.601 -0.982 1.00 15.15 O ATOM 1341 CB TYR A 89 3.940 51.253 -3.162 1.00 14.42 C ATOM 1342 CG TYR A 89 5.179 50.902 -3.974 1.00 14.82 C ATOM 1343 CD1 TYR A 89 5.594 51.731 -5.022 1.00 11.39 C ATOM 1344 CD2 TYR A 89 5.962 49.771 -3.672 1.00 12.79 C ATOM 1345 CE1 TYR A 89 6.741 51.454 -5.767 1.00 13.18 C ATOM 1346 CE2 TYR A 89 7.127 49.477 -4.424 1.00 14.68 C ATOM 1347 CZ TYR A 89 7.497 50.336 -5.470 1.00 11.86 C ATOM 1348 OH TYR A 89 8.630 50.112 -6.189 1.00 13.86 O ATOM 1349 HA TYR A 89 3.174 49.261 -3.289 1.00 0.00 H ATOM 1350 HB3 TYR A 89 4.245 51.342 -2.119 1.00 0.00 H ATOM 1351 HB2 TYR A 89 3.577 52.218 -3.517 1.00 0.00 H ATOM 1352 HD2 TYR A 89 5.669 49.115 -2.852 1.00 0.00 H ATOM 1353 HE2 TYR A 89 7.727 48.597 -4.193 1.00 0.00 H ATOM 1354 HE1 TYR A 89 7.039 52.117 -6.580 1.00 0.00 H ATOM 1355 HD1 TYR A 89 5.006 52.617 -5.263 1.00 0.00 H ATOM 1356 HH TYR A 89 8.726 50.816 -6.879 1.00 0.00 H ATOM 1357 H TYR A 89 2.057 51.330 -4.973 1.00 0.00 H ATOM 1358 N ARG A 90 0.950 51.298 -1.879 1.00 15.36 N ATOM 1359 CA ARG A 90 0.008 51.348 -0.750 1.00 16.52 C ATOM 1360 C ARG A 90 -0.806 50.047 -0.564 1.00 16.90 C ATOM 1361 O ARG A 90 -1.032 49.602 0.556 1.00 15.70 O ATOM 1362 CB ARG A 90 -0.938 52.532 -0.868 1.00 17.61 C ATOM 1363 CG ARG A 90 -0.316 53.865 -0.446 1.00 20.13 C ATOM 1364 CD ARG A 90 -1.384 54.897 -0.191 1.00 25.83 C ATOM 1365 NE ARG A 90 -2.415 54.913 -1.234 1.00 30.01 N ATOM 1366 CZ ARG A 90 -2.342 55.632 -2.354 1.00 31.54 C ATOM 1367 NH1 ARG A 90 -1.286 56.400 -2.589 1.00 29.55 N ATOM 1368 NH2 ARG A 90 -3.336 55.586 -3.236 1.00 32.80 N ATOM 1369 HA ARG A 90 0.630 51.466 0.137 1.00 0.00 H ATOM 1370 HB2 ARG A 90 -1.257 52.615 -1.907 1.00 0.00 H ATOM 1371 HB3 ARG A 90 -1.806 52.343 -0.237 1.00 0.00 H ATOM 1372 HG2 ARG A 90 0.263 53.717 0.465 1.00 0.00 H ATOM 1373 HG3 ARG A 90 0.342 54.220 -1.239 1.00 0.00 H ATOM 1374 HD2 ARG A 90 -0.916 55.880 -0.148 1.00 0.00 H ATOM 1375 HD3 ARG A 90 -1.859 54.679 0.766 1.00 0.00 H ATOM 1376 HE ARG A 90 -3.260 54.324 -1.090 1.00 0.00 H ATOM 1377 HH12 ARG A 90 -1.234 56.959 -3.464 1.00 0.00 H ATOM 1378 HH11 ARG A 90 -0.510 56.443 -1.898 1.00 0.00 H ATOM 1379 HH22 ARG A 90 -3.281 56.146 -4.111 1.00 0.00 H ATOM 1380 HH21 ARG A 90 -4.168 54.990 -3.051 1.00 0.00 H ATOM 1381 H ARG A 90 0.864 51.990 -2.651 1.00 0.00 H ATOM 1382 N GLU A 91 -1.230 49.442 -1.663 1.00 16.96 N ATOM 1383 CA GLU A 91 -1.923 48.163 -1.564 1.00 17.40 C ATOM 1384 C GLU A 91 -0.972 47.063 -1.139 1.00 16.95 C ATOM 1385 O GLU A 91 -1.375 46.143 -0.434 1.00 16.90 O ATOM 1386 CB GLU A 91 -2.659 47.809 -2.849 1.00 17.00 C ATOM 1387 CG GLU A 91 -3.889 48.690 -3.076 1.00 19.65 C ATOM 1388 CD GLU A 91 -5.099 47.943 -3.658 1.00 25.30 C ATOM 1389 OE1 GLU A 91 -5.034 46.703 -3.855 1.00 23.68 O ATOM 1390 OE2 GLU A 91 -6.127 48.615 -3.920 1.00 28.41 O ATOM 1391 HA GLU A 91 -2.683 48.263 -0.789 1.00 0.00 H ATOM 1392 HB2 GLU A 91 -1.977 47.935 -3.690 1.00 0.00 H ATOM 1393 HB3 GLU A 91 -2.978 46.768 -2.795 1.00 0.00 H ATOM 1394 HG2 GLU A 91 -4.182 49.122 -2.119 1.00 0.00 H ATOM 1395 HG3 GLU A 91 -3.616 49.488 -3.766 1.00 0.00 H ATOM 1396 H GLU A 91 -1.069 49.878 -2.594 1.00 0.00 H ATOM 1397 N VAL A 92 0.295 47.175 -1.523 1.00 16.38 N ATOM 1398 CA VAL A 92 1.287 46.226 -1.036 1.00 16.12 C ATOM 1399 C VAL A 92 1.368 46.317 0.498 1.00 17.02 C ATOM 1400 O VAL A 92 1.299 45.293 1.207 1.00 16.85 O ATOM 1401 CB VAL A 92 2.673 46.417 -1.713 1.00 15.74 C ATOM 1402 CG1 VAL A 92 3.744 45.650 -0.962 1.00 15.29 C ATOM 1403 CG2 VAL A 92 2.647 45.948 -3.186 1.00 15.55 C ATOM 1404 HA VAL A 92 0.969 45.220 -1.310 1.00 0.00 H ATOM 1405 HB VAL A 92 2.904 47.482 -1.688 1.00 0.00 H ATOM 1406 HG11 VAL A 92 3.798 46.014 0.064 1.00 0.00 H ATOM 1407 HG12 VAL A 92 3.495 44.589 -0.959 1.00 0.00 H ATOM 1408 HG13 VAL A 92 4.706 45.797 -1.453 1.00 0.00 H ATOM 1409 HG21 VAL A 92 2.384 44.891 -3.225 1.00 0.00 H ATOM 1410 HG22 VAL A 92 1.908 46.528 -3.738 1.00 0.00 H ATOM 1411 HG23 VAL A 92 3.631 46.095 -3.630 1.00 0.00 H ATOM 1412 H VAL A 92 0.578 47.939 -2.170 1.00 0.00 H ATOM 1413 N ALA A 93 1.511 47.540 1.014 1.00 16.83 N ATOM 1414 CA ALA A 93 1.602 47.760 2.464 1.00 17.05 C ATOM 1415 C ALA A 93 0.385 47.212 3.213 1.00 16.81 C ATOM 1416 O ALA A 93 0.524 46.624 4.292 1.00 17.72 O ATOM 1417 CB ALA A 93 1.793 49.267 2.751 1.00 16.70 C ATOM 1418 HA ALA A 93 2.468 47.209 2.832 1.00 0.00 H ATOM 1419 HB1 ALA A 93 2.710 49.613 2.274 1.00 0.00 H ATOM 1420 HB2 ALA A 93 0.943 49.822 2.353 1.00 0.00 H ATOM 1421 HB3 ALA A 93 1.860 49.425 3.827 1.00 0.00 H ATOM 1422 H ALA A 93 1.559 48.358 0.373 1.00 0.00 H ATOM 1423 N LYS A 94 -0.807 47.395 2.642 1.00 17.10 N ATOM 1424 CA LYS A 94 -2.054 46.908 3.258 1.00 17.45 C ATOM 1425 C LYS A 94 -2.083 45.393 3.342 1.00 17.19 C ATOM 1426 O LYS A 94 -2.468 44.838 4.379 1.00 17.45 O ATOM 1427 CB LYS A 94 -3.307 47.493 2.562 1.00 17.84 C ATOM 1428 CG LYS A 94 -4.688 46.937 3.045 1.00 22.25 C ATOM 1429 CD LYS A 94 -5.789 48.014 2.903 1.00 26.80 C ATOM 1430 CE LYS A 94 -7.208 47.455 2.903 1.00 30.48 C ATOM 1431 NZ LYS A 94 -7.831 47.382 4.260 1.00 31.10 N ATOM 1432 HA LYS A 94 -2.076 47.274 4.284 1.00 0.00 H ATOM 1433 HB2 LYS A 94 -3.306 48.571 2.726 1.00 0.00 H ATOM 1434 HB3 LYS A 94 -3.221 47.289 1.495 1.00 0.00 H ATOM 1435 HG2 LYS A 94 -4.956 46.069 2.442 1.00 0.00 H ATOM 1436 HG3 LYS A 94 -4.609 46.641 4.091 1.00 0.00 H ATOM 1437 HD2 LYS A 94 -5.695 48.712 3.735 1.00 0.00 H ATOM 1438 HD3 LYS A 94 -5.630 48.546 1.965 1.00 0.00 H ATOM 1439 HE2 LYS A 94 -7.181 46.450 2.483 1.00 0.00 H ATOM 1440 HE3 LYS A 94 -7.829 48.093 2.274 1.00 0.00 H ATOM 1441 HZ1 LYS A 94 -7.257 46.766 4.871 1.00 0.00 H ATOM 1442 HZ2 LYS A 94 -7.876 48.336 4.671 1.00 0.00 H ATOM 1443 HZ3 LYS A 94 -8.792 46.993 4.178 1.00 0.00 H ATOM 1444 H LYS A 94 -0.858 47.898 1.733 1.00 0.00 H ATOM 1445 N GLU A 95 -1.638 44.734 2.275 1.00 17.54 N ATOM 1446 CA GLU A 95 -1.591 43.267 2.195 1.00 17.99 C ATOM 1447 C GLU A 95 -0.567 42.722 3.168 1.00 17.80 C ATOM 1448 O GLU A 95 -0.861 41.800 3.956 1.00 17.67 O ATOM 1449 CB GLU A 95 -1.260 42.809 0.746 1.00 17.37 C ATOM 1450 CG GLU A 95 -2.453 42.933 -0.192 1.00 20.21 C ATOM 1451 CD GLU A 95 -3.581 42.025 0.225 1.00 23.30 C ATOM 1452 OE1 GLU A 95 -3.522 40.830 -0.107 1.00 24.99 O ATOM 1453 OE2 GLU A 95 -4.509 42.490 0.910 1.00 24.50 O ATOM 1454 HA GLU A 95 -2.572 42.874 2.463 1.00 0.00 H ATOM 1455 HB2 GLU A 95 -0.447 43.425 0.361 1.00 0.00 H ATOM 1456 HB3 GLU A 95 -0.943 41.767 0.773 1.00 0.00 H ATOM 1457 HG2 GLU A 95 -2.806 43.964 -0.182 1.00 0.00 H ATOM 1458 HG3 GLU A 95 -2.139 42.668 -1.202 1.00 0.00 H ATOM 1459 H GLU A 95 -1.307 45.284 1.457 1.00 0.00 H ATOM 1460 N VAL A 96 0.625 43.314 3.147 1.00 17.24 N ATOM 1461 CA VAL A 96 1.677 42.916 4.093 1.00 17.14 C ATOM 1462 C VAL A 96 1.180 43.002 5.555 1.00 17.10 C ATOM 1463 O VAL A 96 1.333 42.054 6.338 1.00 16.50 O ATOM 1464 CB VAL A 96 2.956 43.760 3.898 1.00 17.13 C ATOM 1465 CG1 VAL A 96 3.856 43.681 5.122 1.00 18.27 C ATOM 1466 CG2 VAL A 96 3.699 43.359 2.612 1.00 16.82 C ATOM 1467 HA VAL A 96 1.926 41.876 3.884 1.00 0.00 H ATOM 1468 HB VAL A 96 2.657 44.802 3.783 1.00 0.00 H ATOM 1469 HG11 VAL A 96 3.318 44.058 5.992 1.00 0.00 H ATOM 1470 HG12 VAL A 96 4.145 42.644 5.293 1.00 0.00 H ATOM 1471 HG13 VAL A 96 4.748 44.285 4.955 1.00 0.00 H ATOM 1472 HG21 VAL A 96 3.982 42.308 2.670 1.00 0.00 H ATOM 1473 HG22 VAL A 96 3.046 43.514 1.753 1.00 0.00 H ATOM 1474 HG23 VAL A 96 4.594 43.972 2.505 1.00 0.00 H ATOM 1475 H VAL A 96 0.814 44.066 2.454 1.00 0.00 H ATOM 1476 N THR A 97 0.571 44.128 5.910 1.00 16.82 N ATOM 1477 CA THR A 97 -0.014 44.274 7.242 1.00 16.80 C ATOM 1478 C THR A 97 -1.084 43.195 7.517 1.00 17.37 C ATOM 1479 O THR A 97 -1.023 42.497 8.532 1.00 17.25 O ATOM 1480 CB THR A 97 -0.564 45.705 7.467 1.00 16.80 C ATOM 1481 OG1 THR A 97 0.474 46.660 7.184 1.00 14.87 O ATOM 1482 CG2 THR A 97 -1.014 45.877 8.903 1.00 14.68 C ATOM 1483 HA THR A 97 0.785 44.120 7.967 1.00 0.00 H ATOM 1484 HB THR A 97 -1.415 45.865 6.805 1.00 0.00 H ATOM 1485 HG1 THR A 97 0.766 46.559 6.243 1.00 0.00 H ATOM 1486 HG23 THR A 97 -1.801 45.156 9.125 1.00 0.00 H ATOM 1487 HG21 THR A 97 -0.168 45.710 9.570 1.00 0.00 H ATOM 1488 HG22 THR A 97 -1.396 46.888 9.044 1.00 0.00 H ATOM 1489 H THR A 97 0.510 44.915 5.233 1.00 0.00 H ATOM 1490 N ARG A 98 -2.048 43.064 6.606 1.00 18.09 N ATOM 1491 CA ARG A 98 -3.110 42.061 6.707 1.00 18.39 C ATOM 1492 C ARG A 98 -2.568 40.643 6.891 1.00 18.30 C ATOM 1493 O ARG A 98 -3.080 39.854 7.713 1.00 18.11 O ATOM 1494 CB ARG A 98 -3.996 42.122 5.447 1.00 18.70 C ATOM 1495 CG ARG A 98 -5.133 41.089 5.434 1.00 20.51 C ATOM 1496 CD ARG A 98 -5.936 41.125 4.132 1.00 22.88 C ATOM 1497 NE ARG A 98 -5.212 40.514 3.015 1.00 23.71 N ATOM 1498 CZ ARG A 98 -5.085 39.205 2.807 1.00 22.87 C ATOM 1499 NH1 ARG A 98 -5.619 38.325 3.648 1.00 23.24 N ATOM 1500 NH2 ARG A 98 -4.392 38.780 1.756 1.00 24.10 N ATOM 1501 HA ARG A 98 -3.696 42.296 7.596 1.00 0.00 H ATOM 1502 HB2 ARG A 98 -4.436 43.117 5.384 1.00 0.00 H ATOM 1503 HB3 ARG A 98 -3.365 41.949 4.575 1.00 0.00 H ATOM 1504 HG2 ARG A 98 -4.704 40.094 5.554 1.00 0.00 H ATOM 1505 HG3 ARG A 98 -5.805 41.297 6.267 1.00 0.00 H ATOM 1506 HD2 ARG A 98 -6.154 42.164 3.883 1.00 0.00 H ATOM 1507 HD3 ARG A 98 -6.871 40.585 4.281 1.00 0.00 H ATOM 1508 HE ARG A 98 -4.761 41.153 2.330 1.00 0.00 H ATOM 1509 HH12 ARG A 98 -5.511 37.306 3.472 1.00 0.00 H ATOM 1510 HH11 ARG A 98 -6.145 38.656 4.482 1.00 0.00 H ATOM 1511 HH22 ARG A 98 -4.285 37.760 1.582 1.00 0.00 H ATOM 1512 HH21 ARG A 98 -3.957 39.467 1.108 1.00 0.00 H ATOM 1513 H ARG A 98 -2.046 43.703 5.786 1.00 0.00 H ATOM 1514 N LEU A 99 -1.536 40.316 6.127 1.00 18.47 N ATOM 1515 CA LEU A 99 -0.952 38.973 6.132 1.00 19.20 C ATOM 1516 C LEU A 99 -0.215 38.674 7.440 1.00 19.45 C ATOM 1517 O LEU A 99 0.083 37.524 7.746 1.00 19.55 O ATOM 1518 CB LEU A 99 -0.003 38.816 4.936 1.00 19.20 C ATOM 1519 CG LEU A 99 -0.688 38.571 3.594 1.00 18.67 C ATOM 1520 CD1 LEU A 99 0.305 38.777 2.438 1.00 20.46 C ATOM 1521 CD2 LEU A 99 -1.318 37.176 3.543 1.00 19.73 C ATOM 1522 HA LEU A 99 -1.766 38.253 6.049 1.00 0.00 H ATOM 1523 HB2 LEU A 99 0.589 39.728 4.852 1.00 0.00 H ATOM 1524 HB3 LEU A 99 0.658 37.973 5.137 1.00 0.00 H ATOM 1525 HG LEU A 99 -1.493 39.297 3.483 1.00 0.00 H ATOM 1526 HD21 LEU A 99 -0.542 36.423 3.682 1.00 0.00 H ATOM 1527 HD22 LEU A 99 -2.060 37.085 4.336 1.00 0.00 H ATOM 1528 HD23 LEU A 99 -1.798 37.031 2.575 1.00 0.00 H ATOM 1529 HD11 LEU A 99 0.682 39.799 2.463 1.00 0.00 H ATOM 1530 HD12 LEU A 99 1.135 38.079 2.545 1.00 0.00 H ATOM 1531 HD13 LEU A 99 -0.201 38.598 1.489 1.00 0.00 H ATOM 1532 H LEU A 99 -1.126 41.039 5.502 1.00 0.00 H ATOM 1533 N GLY A 100 0.087 39.716 8.200 1.00 19.74 N ATOM 1534 CA GLY A 100 0.804 39.569 9.478 1.00 20.24 C ATOM 1535 C GLY A 100 2.261 39.137 9.336 1.00 20.52 C ATOM 1536 O GLY A 100 2.887 38.738 10.316 1.00 19.69 O ATOM 1537 HA3 GLY A 100 0.283 38.822 10.078 1.00 0.00 H ATOM 1538 HA2 GLY A 100 0.781 40.528 9.995 1.00 0.00 H ATOM 1539 H GLY A 100 -0.191 40.667 7.884 1.00 0.00 H ATOM 1540 N VAL A 101 2.801 39.225 8.118 1.00 19.84 N ATOM 1541 CA VAL A 101 4.149 38.722 7.822 1.00 20.46 C ATOM 1542 C VAL A 101 5.242 39.501 8.552 1.00 20.91 C ATOM 1543 O VAL A 101 5.031 40.660 8.936 1.00 22.29 O ATOM 1544 CB VAL A 101 4.420 38.658 6.288 1.00 20.61 C ATOM 1545 CG1 VAL A 101 3.512 37.608 5.630 1.00 20.43 C ATOM 1546 CG2 VAL A 101 4.230 40.049 5.639 1.00 19.58 C ATOM 1547 HA VAL A 101 4.185 37.702 8.205 1.00 0.00 H ATOM 1548 HB VAL A 101 5.456 38.358 6.129 1.00 0.00 H ATOM 1549 HG11 VAL A 101 3.712 36.630 6.069 1.00 0.00 H ATOM 1550 HG12 VAL A 101 2.469 37.876 5.797 1.00 0.00 H ATOM 1551 HG13 VAL A 101 3.713 37.575 4.559 1.00 0.00 H ATOM 1552 HG21 VAL A 101 3.207 40.388 5.802 1.00 0.00 H ATOM 1553 HG22 VAL A 101 4.925 40.757 6.090 1.00 0.00 H ATOM 1554 HG23 VAL A 101 4.425 39.979 4.569 1.00 0.00 H ATOM 1555 H VAL A 101 2.249 39.664 7.354 1.00 0.00 H ATOM 1556 N ASN A 102 6.403 38.887 8.767 1.00 20.92 N ATOM 1557 CA ASN A 102 7.482 39.586 9.501 1.00 21.48 C ATOM 1558 C ASN A 102 8.481 40.240 8.572 1.00 20.79 C ATOM 1559 O ASN A 102 9.260 41.099 8.980 1.00 20.24 O ATOM 1560 CB ASN A 102 8.209 38.647 10.478 1.00 21.96 C ATOM 1561 CG ASN A 102 7.328 38.206 11.641 1.00 24.66 C ATOM 1562 OD1 ASN A 102 6.907 39.021 12.472 1.00 27.24 O ATOM 1563 ND2 ASN A 102 7.066 36.905 11.719 1.00 25.92 N ATOM 1564 HA ASN A 102 6.993 40.373 10.075 1.00 0.00 H ATOM 1565 HB2 ASN A 102 8.535 37.761 9.933 1.00 0.00 H ATOM 1566 HB3 ASN A 102 9.080 39.167 10.878 1.00 0.00 H ATOM 1567 HD22 ASN A 102 7.440 36.255 10.998 1.00 0.00 H ATOM 1568 HD21 ASN A 102 6.487 36.537 12.501 1.00 0.00 H ATOM 1569 H ASN A 102 6.552 37.918 8.420 1.00 0.00 H ATOM 1570 N SER A 103 8.454 39.824 7.310 1.00 20.50 N ATOM 1571 CA SER A 103 9.343 40.376 6.306 1.00 20.19 C ATOM 1572 C SER A 103 8.703 40.229 4.932 1.00 19.90 C ATOM 1573 O SER A 103 7.748 39.452 4.752 1.00 19.50 O ATOM 1574 CB SER A 103 10.684 39.657 6.330 1.00 19.89 C ATOM 1575 OG SER A 103 10.473 38.268 6.093 1.00 20.65 O ATOM 1576 HA SER A 103 9.512 41.431 6.522 1.00 0.00 H ATOM 1577 HB2 SER A 103 11.155 39.794 7.304 1.00 0.00 H ATOM 1578 HB3 SER A 103 11.331 40.066 5.554 1.00 0.00 H ATOM 1579 HG SER A 103 11.343 37.796 6.108 1.00 0.00 H ATOM 1580 H SER A 103 7.778 39.083 7.035 1.00 0.00 H ATOM 1581 N VAL A 104 9.237 40.991 3.986 1.00 19.80 N ATOM 1582 CA VAL A 104 8.767 40.998 2.607 1.00 19.11 C ATOM 1583 C VAL A 104 9.911 41.317 1.634 1.00 19.12 C ATOM 1584 O VAL A 104 10.737 42.195 1.896 1.00 19.15 O ATOM 1585 CB VAL A 104 7.542 41.953 2.419 1.00 19.44 C ATOM 1586 CG1 VAL A 104 7.840 43.390 2.910 1.00 18.72 C ATOM 1587 CG2 VAL A 104 7.071 41.945 0.968 1.00 18.83 C ATOM 1588 HA VAL A 104 8.415 39.994 2.369 1.00 0.00 H ATOM 1589 HB VAL A 104 6.733 41.573 3.043 1.00 0.00 H ATOM 1590 HG11 VAL A 104 8.091 43.365 3.970 1.00 0.00 H ATOM 1591 HG12 VAL A 104 8.678 43.799 2.346 1.00 0.00 H ATOM 1592 HG13 VAL A 104 6.959 44.014 2.758 1.00 0.00 H ATOM 1593 HG21 VAL A 104 7.883 42.280 0.322 1.00 0.00 H ATOM 1594 HG22 VAL A 104 6.776 40.933 0.689 1.00 0.00 H ATOM 1595 HG23 VAL A 104 6.219 42.616 0.860 1.00 0.00 H ATOM 1596 H VAL A 104 10.030 41.614 4.241 1.00 0.00 H ATOM 1597 N ALA A 105 9.946 40.582 0.523 1.00 19.08 N ATOM 1598 CA ALA A 105 10.864 40.820 -0.584 1.00 18.42 C ATOM 1599 C ALA A 105 10.133 41.625 -1.650 1.00 17.77 C ATOM 1600 O ALA A 105 9.039 41.223 -2.103 1.00 18.09 O ATOM 1601 CB ALA A 105 11.332 39.494 -1.166 1.00 18.66 C ATOM 1602 HA ALA A 105 11.737 41.370 -0.233 1.00 0.00 H ATOM 1603 HB1 ALA A 105 11.842 38.919 -0.393 1.00 0.00 H ATOM 1604 HB2 ALA A 105 10.470 38.933 -1.528 1.00 0.00 H ATOM 1605 HB3 ALA A 105 12.017 39.683 -1.992 1.00 0.00 H ATOM 1606 H ALA A 105 9.277 39.790 0.441 1.00 0.00 H ATOM 1607 N ILE A 106 10.745 42.741 -2.049 1.00 17.28 N ATOM 1608 CA ILE A 106 10.102 43.692 -2.949 1.00 16.15 C ATOM 1609 C ILE A 106 11.064 44.236 -4.018 1.00 16.22 C ATOM 1610 O ILE A 106 12.218 44.574 -3.727 1.00 17.13 O ATOM 1611 CB ILE A 106 9.430 44.848 -2.136 1.00 16.44 C ATOM 1612 CG1 ILE A 106 8.440 45.658 -2.997 1.00 15.42 C ATOM 1613 CG2 ILE A 106 10.476 45.719 -1.485 1.00 13.77 C ATOM 1614 CD1 ILE A 106 7.513 46.573 -2.169 1.00 12.96 C ATOM 1615 HA ILE A 106 9.323 43.153 -3.489 1.00 0.00 H ATOM 1616 HB ILE A 106 8.837 44.399 -1.339 1.00 0.00 H ATOM 1617 HG12 ILE A 106 9.010 46.278 -3.688 1.00 0.00 H ATOM 1618 HG13 ILE A 106 7.822 44.960 -3.562 1.00 0.00 H ATOM 1619 HD11 ILE A 106 6.927 45.966 -1.479 1.00 0.00 H ATOM 1620 HD12 ILE A 106 8.116 47.285 -1.606 1.00 0.00 H ATOM 1621 HD13 ILE A 106 6.844 47.112 -2.839 1.00 0.00 H ATOM 1622 HG21 ILE A 106 11.079 45.115 -0.807 1.00 0.00 H ATOM 1623 HG22 ILE A 106 11.115 46.153 -2.254 1.00 0.00 H ATOM 1624 HG23 ILE A 106 9.986 46.516 -0.925 1.00 0.00 H ATOM 1625 H ILE A 106 11.708 42.939 -1.709 1.00 0.00 H ATOM 1626 N PRO A 107 10.579 44.327 -5.273 1.00 15.61 N ATOM 1627 CA PRO A 107 11.336 44.972 -6.330 1.00 14.89 C ATOM 1628 C PRO A 107 10.875 46.435 -6.526 1.00 15.65 C ATOM 1629 O PRO A 107 9.847 46.843 -5.967 1.00 15.42 O ATOM 1630 CB PRO A 107 10.913 44.177 -7.554 1.00 15.13 C ATOM 1631 CG PRO A 107 9.506 43.893 -7.322 1.00 15.56 C ATOM 1632 CD PRO A 107 9.344 43.724 -5.811 1.00 14.96 C ATOM 1633 HA PRO A 107 12.407 44.993 -6.131 1.00 0.00 H ATOM 1634 HD3 PRO A 107 8.461 44.252 -5.450 1.00 0.00 H ATOM 1635 HD2 PRO A 107 9.272 42.671 -5.540 1.00 0.00 H ATOM 1636 HG3 PRO A 107 9.216 42.978 -7.837 1.00 0.00 H ATOM 1637 HG2 PRO A 107 8.891 44.719 -7.678 1.00 0.00 H ATOM 1638 HB2 PRO A 107 11.045 44.765 -8.462 1.00 0.00 H ATOM 1639 HB3 PRO A 107 11.487 43.254 -7.634 1.00 0.00 H ATOM 1640 N LEU A 108 11.611 47.205 -7.326 1.00 15.52 N ATOM 1641 CA LEU A 108 11.127 48.548 -7.733 1.00 15.25 C ATOM 1642 C LEU A 108 10.108 48.463 -8.885 1.00 15.02 C ATOM 1643 O LEU A 108 10.472 48.297 -10.054 1.00 14.33 O ATOM 1644 CB LEU A 108 12.294 49.466 -8.078 1.00 15.93 C ATOM 1645 CG LEU A 108 13.246 49.731 -6.909 1.00 16.50 C ATOM 1646 CD1 LEU A 108 14.328 50.682 -7.356 1.00 16.16 C ATOM 1647 CD2 LEU A 108 12.473 50.309 -5.736 1.00 19.46 C ATOM 1648 HA LEU A 108 10.604 48.983 -6.881 1.00 0.00 H ATOM 1649 HB2 LEU A 108 12.863 49.008 -8.887 1.00 0.00 H ATOM 1650 HB3 LEU A 108 11.891 50.421 -8.415 1.00 0.00 H ATOM 1651 HG LEU A 108 13.707 48.797 -6.588 1.00 0.00 H ATOM 1652 HD21 LEU A 108 12.003 51.245 -6.038 1.00 0.00 H ATOM 1653 HD22 LEU A 108 11.706 49.600 -5.423 1.00 0.00 H ATOM 1654 HD23 LEU A 108 13.157 50.495 -4.908 1.00 0.00 H ATOM 1655 HD11 LEU A 108 14.880 50.239 -8.185 1.00 0.00 H ATOM 1656 HD12 LEU A 108 13.875 51.619 -7.679 1.00 0.00 H ATOM 1657 HD13 LEU A 108 15.008 50.873 -6.526 1.00 0.00 H ATOM 1658 H LEU A 108 12.532 46.863 -7.668 1.00 0.00 H ATOM 1659 N LEU A 109 8.829 48.575 -8.525 1.00 14.27 N ATOM 1660 CA LEU A 109 7.726 48.576 -9.485 1.00 14.45 C ATOM 1661 C LEU A 109 7.902 49.618 -10.609 1.00 14.00 C ATOM 1662 O LEU A 109 8.353 50.743 -10.363 1.00 14.43 O ATOM 1663 CB LEU A 109 6.405 48.813 -8.728 1.00 14.38 C ATOM 1664 CG LEU A 109 6.067 47.788 -7.624 1.00 14.59 C ATOM 1665 CD1 LEU A 109 4.744 48.146 -6.995 1.00 14.35 C ATOM 1666 CD2 LEU A 109 6.016 46.362 -8.207 1.00 12.94 C ATOM 1667 HA LEU A 109 7.713 47.603 -9.977 1.00 0.00 H ATOM 1668 HB2 LEU A 109 6.457 49.798 -8.265 1.00 0.00 H ATOM 1669 HB3 LEU A 109 5.595 48.798 -9.457 1.00 0.00 H ATOM 1670 HG LEU A 109 6.846 47.815 -6.862 1.00 0.00 H ATOM 1671 HD21 LEU A 109 5.250 46.314 -8.981 1.00 0.00 H ATOM 1672 HD22 LEU A 109 6.986 46.112 -8.638 1.00 0.00 H ATOM 1673 HD23 LEU A 109 5.776 45.655 -7.413 1.00 0.00 H ATOM 1674 HD11 LEU A 109 4.808 49.143 -6.559 1.00 0.00 H ATOM 1675 HD12 LEU A 109 3.965 48.131 -7.757 1.00 0.00 H ATOM 1676 HD13 LEU A 109 4.506 47.422 -6.216 1.00 0.00 H ATOM 1677 H LEU A 109 8.605 48.666 -7.513 1.00 0.00 H ATOM 1678 N SER A 110 7.585 49.215 -11.840 1.00 14.84 N ATOM 1679 CA SER A 110 7.522 50.128 -12.980 1.00 14.87 C ATOM 1680 C SER A 110 8.872 50.710 -13.354 1.00 14.94 C ATOM 1681 O SER A 110 8.916 51.735 -14.001 1.00 14.77 O ATOM 1682 CB SER A 110 6.514 51.279 -12.743 1.00 15.56 C ATOM 1683 OG SER A 110 5.181 50.807 -12.668 1.00 14.95 O ATOM 1684 HA SER A 110 7.179 49.517 -13.815 1.00 0.00 H ATOM 1685 HB2 SER A 110 6.591 51.990 -13.566 1.00 0.00 H ATOM 1686 HB3 SER A 110 6.764 51.780 -11.808 1.00 0.00 H ATOM 1687 HG SER A 110 4.944 50.356 -13.517 1.00 0.00 H ATOM 1688 H SER A 110 7.374 48.209 -11.996 1.00 0.00 H ATOM 1689 N THR A 111 9.970 50.059 -12.960 1.00 14.70 N ATOM 1690 CA THR A 111 11.322 50.523 -13.351 1.00 14.53 C ATOM 1691 C THR A 111 11.990 49.704 -14.452 1.00 14.90 C ATOM 1692 O THR A 111 13.131 49.996 -14.848 1.00 15.20 O ATOM 1693 CB THR A 111 12.296 50.586 -12.141 1.00 14.39 C ATOM 1694 OG1 THR A 111 12.532 49.257 -11.646 1.00 14.71 O ATOM 1695 CG2 THR A 111 11.716 51.434 -11.038 1.00 13.32 C ATOM 1696 HA THR A 111 11.135 51.521 -13.747 1.00 0.00 H ATOM 1697 HB THR A 111 13.234 51.032 -12.471 1.00 0.00 H ATOM 1698 HG1 THR A 111 11.674 48.856 -11.359 1.00 0.00 H ATOM 1699 HG23 THR A 111 11.537 52.442 -11.412 1.00 0.00 H ATOM 1700 HG21 THR A 111 10.776 50.997 -10.702 1.00 0.00 H ATOM 1701 HG22 THR A 111 12.418 51.474 -10.205 1.00 0.00 H ATOM 1702 H THR A 111 9.874 49.210 -12.367 1.00 0.00 H ATOM 1703 N GLY A 112 11.280 48.702 -14.960 1.00 15.39 N ATOM 1704 CA GLY A 112 11.808 47.831 -16.019 1.00 15.74 C ATOM 1705 C GLY A 112 10.966 47.922 -17.277 1.00 15.65 C ATOM 1706 O GLY A 112 10.983 48.955 -17.951 1.00 15.44 O ATOM 1707 HA3 GLY A 112 11.808 46.800 -15.665 1.00 0.00 H ATOM 1708 HA2 GLY A 112 12.829 48.133 -16.252 1.00 0.00 H ATOM 1709 H GLY A 112 10.321 48.529 -14.597 1.00 0.00 H ATOM 1710 N VAL A 113 10.223 46.868 -17.615 1.00 16.23 N ATOM 1711 CA VAL A 113 9.466 46.934 -18.871 1.00 17.32 C ATOM 1712 C VAL A 113 8.314 47.951 -18.820 1.00 16.62 C ATOM 1713 O VAL A 113 7.817 48.355 -19.856 1.00 16.63 O ATOM 1714 CB VAL A 113 9.038 45.533 -19.494 1.00 19.51 C ATOM 1715 CG1 VAL A 113 9.934 44.339 -18.965 1.00 20.19 C ATOM 1716 CG2 VAL A 113 7.533 45.271 -19.399 1.00 17.88 C ATOM 1717 HA VAL A 113 10.192 47.315 -19.590 1.00 0.00 H ATOM 1718 HB VAL A 113 9.240 45.594 -20.563 1.00 0.00 H ATOM 1719 HG11 VAL A 113 10.975 44.522 -19.230 1.00 0.00 H ATOM 1720 HG12 VAL A 113 9.841 44.269 -17.881 1.00 0.00 H ATOM 1721 HG13 VAL A 113 9.600 43.407 -19.421 1.00 0.00 H ATOM 1722 HG21 VAL A 113 7.230 45.275 -18.352 1.00 0.00 H ATOM 1723 HG22 VAL A 113 6.995 46.052 -19.937 1.00 0.00 H ATOM 1724 HG23 VAL A 113 7.306 44.301 -19.841 1.00 0.00 H ATOM 1725 H VAL A 113 10.181 46.025 -17.008 1.00 0.00 H ATOM 1726 N TYR A 114 7.922 48.377 -17.617 1.00 15.66 N ATOM 1727 CA TYR A 114 6.885 49.407 -17.478 1.00 15.24 C ATOM 1728 C TYR A 114 7.431 50.828 -17.301 1.00 15.99 C ATOM 1729 O TYR A 114 6.659 51.771 -17.020 1.00 15.09 O ATOM 1730 CB TYR A 114 5.959 49.065 -16.317 1.00 15.07 C ATOM 1731 CG TYR A 114 4.871 48.060 -16.610 1.00 14.08 C ATOM 1732 CD1 TYR A 114 4.788 47.399 -17.838 1.00 14.38 C ATOM 1733 CD2 TYR A 114 3.932 47.731 -15.612 1.00 15.64 C ATOM 1734 CE1 TYR A 114 3.779 46.455 -18.087 1.00 14.34 C ATOM 1735 CE2 TYR A 114 2.924 46.793 -15.843 1.00 14.60 C ATOM 1736 CZ TYR A 114 2.845 46.164 -17.075 1.00 16.38 C ATOM 1737 OH TYR A 114 1.843 45.236 -17.274 1.00 15.13 O ATOM 1738 HA TYR A 114 6.337 49.405 -18.420 1.00 0.00 H ATOM 1739 HB3 TYR A 114 5.481 49.988 -15.989 1.00 0.00 H ATOM 1740 HB2 TYR A 114 6.572 48.667 -15.508 1.00 0.00 H ATOM 1741 HD2 TYR A 114 3.994 48.219 -14.639 1.00 0.00 H ATOM 1742 HE2 TYR A 114 2.204 46.557 -15.059 1.00 0.00 H ATOM 1743 HE1 TYR A 114 3.720 45.953 -19.053 1.00 0.00 H ATOM 1744 HD1 TYR A 114 5.519 47.620 -18.616 1.00 0.00 H ATOM 1745 HH TYR A 114 1.910 44.872 -18.192 1.00 0.00 H ATOM 1746 H TYR A 114 8.358 47.972 -16.764 1.00 0.00 H ATOM 1747 N SER A 115 8.743 51.002 -17.468 1.00 15.56 N ATOM 1748 CA SER A 115 9.364 52.312 -17.219 1.00 16.48 C ATOM 1749 C SER A 115 9.113 53.383 -18.309 1.00 17.25 C ATOM 1750 O SER A 115 9.418 54.564 -18.108 1.00 17.41 O ATOM 1751 CB SER A 115 10.873 52.150 -17.023 1.00 15.74 C ATOM 1752 OG SER A 115 11.481 51.811 -18.260 1.00 15.33 O ATOM 1753 HA SER A 115 8.877 52.681 -16.316 1.00 0.00 H ATOM 1754 HB2 SER A 115 11.062 51.359 -16.297 1.00 0.00 H ATOM 1755 HB3 SER A 115 11.294 53.086 -16.656 1.00 0.00 H ATOM 1756 HG SER A 115 11.099 50.960 -18.592 1.00 0.00 H ATOM 1757 H SER A 115 9.333 50.203 -17.777 1.00 0.00 H ATOM 1758 N GLY A 116 8.589 52.972 -19.459 1.00 18.31 N ATOM 1759 CA GLY A 116 8.463 53.869 -20.610 1.00 19.36 C ATOM 1760 C GLY A 116 9.802 54.419 -21.069 1.00 20.25 C ATOM 1761 O GLY A 116 9.886 55.558 -21.545 1.00 20.81 O ATOM 1762 HA3 GLY A 116 7.818 54.703 -20.334 1.00 0.00 H ATOM 1763 HA2 GLY A 116 8.010 53.318 -21.434 1.00 0.00 H ATOM 1764 H GLY A 116 8.260 51.989 -19.544 1.00 0.00 H ATOM 1765 N GLY A 117 10.861 53.637 -20.892 1.00 20.59 N ATOM 1766 CA GLY A 117 12.204 54.080 -21.284 1.00 20.89 C ATOM 1767 C GLY A 117 12.921 55.041 -20.336 1.00 20.99 C ATOM 1768 O GLY A 117 14.058 55.438 -20.607 1.00 20.44 O ATOM 1769 HA3 GLY A 117 12.118 54.575 -22.251 1.00 0.00 H ATOM 1770 HA2 GLY A 117 12.827 53.192 -21.386 1.00 0.00 H ATOM 1771 H GLY A 117 10.736 52.695 -20.469 1.00 0.00 H ATOM 1772 N LYS A 118 12.283 55.404 -19.221 1.00 19.79 N ATOM 1773 CA LYS A 118 12.853 56.384 -18.294 1.00 20.10 C ATOM 1774 C LYS A 118 13.520 55.700 -17.097 1.00 19.29 C ATOM 1775 O LYS A 118 13.122 54.606 -16.704 1.00 18.49 O ATOM 1776 CB LYS A 118 11.750 57.333 -17.804 1.00 20.15 C ATOM 1777 CG LYS A 118 12.229 58.666 -17.194 1.00 22.96 C ATOM 1778 CD LYS A 118 11.038 59.616 -17.009 1.00 25.90 C ATOM 1779 CE LYS A 118 11.419 60.940 -16.375 1.00 27.09 C ATOM 1780 NZ LYS A 118 11.485 60.835 -14.906 1.00 29.93 N ATOM 1781 HA LYS A 118 13.618 56.950 -18.826 1.00 0.00 H ATOM 1782 HB2 LYS A 118 11.108 57.566 -18.654 1.00 0.00 H ATOM 1783 HB3 LYS A 118 11.170 56.808 -17.045 1.00 0.00 H ATOM 1784 HG2 LYS A 118 12.692 58.475 -16.226 1.00 0.00 H ATOM 1785 HG3 LYS A 118 12.959 59.127 -17.860 1.00 0.00 H ATOM 1786 HD2 LYS A 118 10.598 59.814 -17.986 1.00 0.00 H ATOM 1787 HD3 LYS A 118 10.301 59.127 -16.373 1.00 0.00 H ATOM 1788 HE2 LYS A 118 10.675 61.689 -16.644 1.00 0.00 H ATOM 1789 HE3 LYS A 118 12.394 61.247 -16.753 1.00 0.00 H ATOM 1790 HZ1 LYS A 118 10.556 60.548 -14.538 1.00 0.00 H ATOM 1791 HZ2 LYS A 118 12.198 60.125 -14.642 1.00 0.00 H ATOM 1792 HZ3 LYS A 118 11.748 61.758 -14.505 1.00 0.00 H ATOM 1793 H LYS A 118 11.358 54.980 -19.005 1.00 0.00 H ATOM 1794 N ASP A 119 14.539 56.343 -16.536 1.00 19.25 N ATOM 1795 CA ASP A 119 15.123 55.911 -15.257 1.00 19.24 C ATOM 1796 C ASP A 119 14.186 56.362 -14.133 1.00 18.12 C ATOM 1797 O ASP A 119 14.039 57.556 -13.888 1.00 18.35 O ATOM 1798 CB ASP A 119 16.532 56.510 -15.078 1.00 19.55 C ATOM 1799 CG ASP A 119 17.178 56.162 -13.724 1.00 22.04 C ATOM 1800 OD1 ASP A 119 16.470 55.771 -12.764 1.00 21.37 O ATOM 1801 OD2 ASP A 119 18.420 56.295 -13.624 1.00 24.01 O ATOM 1802 HA ASP A 119 15.228 54.826 -15.235 1.00 0.00 H ATOM 1803 HB2 ASP A 119 17.173 56.131 -15.874 1.00 0.00 H ATOM 1804 HB3 ASP A 119 16.459 57.595 -15.158 1.00 0.00 H ATOM 1805 H ASP A 119 14.935 57.176 -17.016 1.00 0.00 H ATOM 1806 N ARG A 120 13.567 55.403 -13.447 1.00 16.82 N ATOM 1807 CA ARG A 120 12.547 55.702 -12.445 1.00 16.09 C ATOM 1808 C ARG A 120 12.917 55.132 -11.073 1.00 15.88 C ATOM 1809 O ARG A 120 12.047 54.949 -10.211 1.00 15.10 O ATOM 1810 CB ARG A 120 11.176 55.181 -12.906 1.00 15.70 C ATOM 1811 CG ARG A 120 10.639 55.867 -14.163 1.00 15.32 C ATOM 1812 CD ARG A 120 9.238 55.395 -14.514 1.00 12.81 C ATOM 1813 NE ARG A 120 8.810 55.940 -15.814 1.00 14.34 N ATOM 1814 CZ ARG A 120 8.247 57.134 -15.993 1.00 16.20 C ATOM 1815 NH1 ARG A 120 8.002 57.940 -14.953 1.00 16.20 N ATOM 1816 NH2 ARG A 120 7.905 57.526 -17.217 1.00 17.33 N ATOM 1817 HA ARG A 120 12.490 56.785 -12.339 1.00 0.00 H ATOM 1818 HB2 ARG A 120 11.266 54.114 -13.110 1.00 0.00 H ATOM 1819 HB3 ARG A 120 10.461 55.337 -12.098 1.00 0.00 H ATOM 1820 HG2 ARG A 120 10.616 56.944 -13.994 1.00 0.00 H ATOM 1821 HG3 ARG A 120 11.305 55.645 -14.997 1.00 0.00 H ATOM 1822 HD2 ARG A 120 8.545 55.728 -13.741 1.00 0.00 H ATOM 1823 HD3 ARG A 120 9.230 54.306 -14.563 1.00 0.00 H ATOM 1824 HE ARG A 120 8.959 55.348 -16.656 1.00 0.00 H ATOM 1825 HH12 ARG A 120 7.562 58.869 -15.108 1.00 0.00 H ATOM 1826 HH11 ARG A 120 8.252 57.637 -13.990 1.00 0.00 H ATOM 1827 HH22 ARG A 120 7.465 58.457 -17.361 1.00 0.00 H ATOM 1828 HH21 ARG A 120 8.077 56.901 -18.030 1.00 0.00 H ATOM 1829 H ARG A 120 13.818 54.410 -13.630 1.00 0.00 H ATOM 1830 N LEU A 121 14.210 54.868 -10.878 1.00 15.86 N ATOM 1831 CA LEU A 121 14.719 54.387 -9.588 1.00 16.87 C ATOM 1832 C LEU A 121 14.223 55.266 -8.448 1.00 16.84 C ATOM 1833 O LEU A 121 13.608 54.769 -7.518 1.00 17.56 O ATOM 1834 CB LEU A 121 16.256 54.330 -9.568 1.00 16.74 C ATOM 1835 CG LEU A 121 16.979 53.712 -8.350 1.00 18.62 C ATOM 1836 CD1 LEU A 121 18.432 53.483 -8.675 1.00 18.14 C ATOM 1837 CD2 LEU A 121 16.894 54.582 -7.078 1.00 18.98 C ATOM 1838 HA LEU A 121 14.338 53.375 -9.451 1.00 0.00 H ATOM 1839 HB2 LEU A 121 16.564 53.758 -10.443 1.00 0.00 H ATOM 1840 HB3 LEU A 121 16.613 55.356 -9.662 1.00 0.00 H ATOM 1841 HG LEU A 121 16.468 52.772 -8.142 1.00 0.00 H ATOM 1842 HD21 LEU A 121 17.351 55.552 -7.272 1.00 0.00 H ATOM 1843 HD22 LEU A 121 15.848 54.720 -6.803 1.00 0.00 H ATOM 1844 HD23 LEU A 121 17.423 54.086 -6.264 1.00 0.00 H ATOM 1845 HD11 LEU A 121 18.510 52.802 -9.523 1.00 0.00 H ATOM 1846 HD12 LEU A 121 18.901 54.434 -8.927 1.00 0.00 H ATOM 1847 HD13 LEU A 121 18.932 53.047 -7.810 1.00 0.00 H ATOM 1848 H LEU A 121 14.877 55.007 -11.663 1.00 0.00 H ATOM 1849 N THR A 122 14.508 56.569 -8.507 1.00 16.56 N ATOM 1850 CA THR A 122 14.190 57.448 -7.380 1.00 16.49 C ATOM 1851 C THR A 122 12.668 57.596 -7.180 1.00 16.14 C ATOM 1852 O THR A 122 12.164 57.564 -6.037 1.00 16.20 O ATOM 1853 CB THR A 122 14.909 58.807 -7.530 1.00 16.96 C ATOM 1854 OG1 THR A 122 16.325 58.579 -7.427 1.00 17.92 O ATOM 1855 CG2 THR A 122 14.489 59.786 -6.449 1.00 16.76 C ATOM 1856 HA THR A 122 14.566 56.984 -6.468 1.00 0.00 H ATOM 1857 HB THR A 122 14.643 59.238 -8.495 1.00 0.00 H ATOM 1858 HG1 THR A 122 16.531 58.180 -6.545 1.00 0.00 H ATOM 1859 HG23 THR A 122 13.416 59.965 -6.520 1.00 0.00 H ATOM 1860 HG21 THR A 122 14.725 59.368 -5.470 1.00 0.00 H ATOM 1861 HG22 THR A 122 15.025 60.726 -6.583 1.00 0.00 H ATOM 1862 H THR A 122 14.958 56.962 -9.358 1.00 0.00 H ATOM 1863 N GLN A 123 11.940 57.705 -8.280 1.00 14.46 N ATOM 1864 CA GLN A 123 10.475 57.756 -8.215 1.00 14.44 C ATOM 1865 C GLN A 123 9.842 56.523 -7.565 1.00 13.88 C ATOM 1866 O GLN A 123 8.979 56.651 -6.687 1.00 13.75 O ATOM 1867 CB GLN A 123 9.891 57.964 -9.618 1.00 13.61 C ATOM 1868 CG GLN A 123 8.363 57.925 -9.666 1.00 13.75 C ATOM 1869 CD GLN A 123 7.831 58.082 -11.075 1.00 12.28 C ATOM 1870 OE1 GLN A 123 8.527 57.783 -12.037 1.00 13.12 O ATOM 1871 NE2 GLN A 123 6.583 58.543 -11.202 1.00 11.57 N ATOM 1872 HA GLN A 123 10.230 58.602 -7.573 1.00 0.00 H ATOM 1873 HB2 GLN A 123 10.221 58.935 -9.987 1.00 0.00 H ATOM 1874 HB3 GLN A 123 10.275 57.179 -10.270 1.00 0.00 H ATOM 1875 HG2 GLN A 123 8.023 56.969 -9.267 1.00 0.00 H ATOM 1876 HG3 GLN A 123 7.971 58.735 -9.050 1.00 0.00 H ATOM 1877 HE22 GLN A 123 6.029 58.784 -10.355 1.00 0.00 H ATOM 1878 HE21 GLN A 123 6.166 58.660 -12.147 1.00 0.00 H ATOM 1879 H GLN A 123 12.414 57.755 -9.205 1.00 0.00 H ATOM 1880 N SER A 124 10.251 55.334 -8.016 1.00 13.81 N ATOM 1881 CA SER A 124 9.687 54.074 -7.518 1.00 15.53 C ATOM 1882 C SER A 124 10.052 53.839 -6.059 1.00 16.32 C ATOM 1883 O SER A 124 9.203 53.451 -5.256 1.00 17.02 O ATOM 1884 CB SER A 124 10.127 52.887 -8.371 1.00 15.23 C ATOM 1885 OG SER A 124 9.431 51.696 -8.008 1.00 15.42 O ATOM 1886 HA SER A 124 8.603 54.161 -7.590 1.00 0.00 H ATOM 1887 HB2 SER A 124 11.197 52.729 -8.233 1.00 0.00 H ATOM 1888 HB3 SER A 124 9.926 53.110 -9.419 1.00 0.00 H ATOM 1889 HG SER A 124 9.614 51.485 -7.058 1.00 0.00 H ATOM 1890 H SER A 124 10.993 55.300 -8.744 1.00 0.00 H ATOM 1891 N LEU A 125 11.315 54.100 -5.724 1.00 17.11 N ATOM 1892 CA LEU A 125 11.785 53.980 -4.362 1.00 17.45 C ATOM 1893 C LEU A 125 11.074 54.944 -3.429 1.00 17.44 C ATOM 1894 O LEU A 125 10.702 54.554 -2.311 1.00 17.13 O ATOM 1895 CB LEU A 125 13.294 54.191 -4.285 1.00 17.88 C ATOM 1896 CG LEU A 125 13.959 53.887 -2.926 1.00 19.59 C ATOM 1897 CD1 LEU A 125 13.709 52.432 -2.469 1.00 19.24 C ATOM 1898 CD2 LEU A 125 15.431 54.178 -3.037 1.00 21.34 C ATOM 1899 HA LEU A 125 11.553 52.967 -4.034 1.00 0.00 H ATOM 1900 HB2 LEU A 125 13.758 53.548 -5.033 1.00 0.00 H ATOM 1901 HB3 LEU A 125 13.496 55.234 -4.528 1.00 0.00 H ATOM 1902 HG LEU A 125 13.512 54.525 -2.163 1.00 0.00 H ATOM 1903 HD21 LEU A 125 15.867 53.549 -3.813 1.00 0.00 H ATOM 1904 HD22 LEU A 125 15.574 55.227 -3.295 1.00 0.00 H ATOM 1905 HD23 LEU A 125 15.915 53.968 -2.083 1.00 0.00 H ATOM 1906 HD11 LEU A 125 12.637 52.263 -2.368 1.00 0.00 H ATOM 1907 HD12 LEU A 125 14.118 51.745 -3.209 1.00 0.00 H ATOM 1908 HD13 LEU A 125 14.196 52.266 -1.508 1.00 0.00 H ATOM 1909 H LEU A 125 11.982 54.399 -6.464 1.00 0.00 H ATOM 1910 N ASN A 126 10.881 56.186 -3.882 1.00 17.57 N ATOM 1911 CA ASN A 126 10.161 57.165 -3.064 1.00 17.47 C ATOM 1912 C ASN A 126 8.757 56.674 -2.720 1.00 17.09 C ATOM 1913 O ASN A 126 8.350 56.788 -1.572 1.00 16.79 O ATOM 1914 CB ASN A 126 10.154 58.568 -3.695 1.00 17.54 C ATOM 1915 CG ASN A 126 11.453 59.327 -3.439 1.00 18.89 C ATOM 1916 OD1 ASN A 126 12.257 58.925 -2.598 1.00 22.00 O ATOM 1917 ND2 ASN A 126 11.662 60.427 -4.163 1.00 18.69 N ATOM 1918 HA ASN A 126 10.707 57.263 -2.126 1.00 0.00 H ATOM 1919 HB2 ASN A 126 10.013 58.468 -4.771 1.00 0.00 H ATOM 1920 HB3 ASN A 126 9.326 59.138 -3.273 1.00 0.00 H ATOM 1921 HD22 ASN A 126 10.956 60.731 -4.863 1.00 0.00 H ATOM 1922 HD21 ASN A 126 12.531 60.981 -4.028 1.00 0.00 H ATOM 1923 H ASN A 126 11.243 56.459 -4.818 1.00 0.00 H ATOM 1924 N HIS A 127 8.038 56.103 -3.694 1.00 16.59 N ATOM 1925 CA HIS A 127 6.694 55.571 -3.438 1.00 16.38 C ATOM 1926 C HIS A 127 6.752 54.319 -2.560 1.00 16.43 C ATOM 1927 O HIS A 127 5.860 54.098 -1.748 1.00 16.68 O ATOM 1928 CB HIS A 127 5.956 55.243 -4.751 1.00 16.32 C ATOM 1929 CG HIS A 127 5.534 56.457 -5.527 1.00 16.74 C ATOM 1930 ND1 HIS A 127 4.792 57.473 -4.970 1.00 17.75 N ATOM 1931 CD2 HIS A 127 5.771 56.825 -6.811 1.00 15.84 C ATOM 1932 CE1 HIS A 127 4.571 58.411 -5.879 1.00 17.56 C ATOM 1933 NE2 HIS A 127 5.162 58.047 -7.006 1.00 17.33 N ATOM 1934 HA HIS A 127 6.141 56.349 -2.911 1.00 0.00 H ATOM 1935 HB2 HIS A 127 6.618 54.647 -5.378 1.00 0.00 H ATOM 1936 HB3 HIS A 127 5.066 54.662 -4.510 1.00 0.00 H ATOM 1937 HD2 HIS A 127 6.338 56.260 -7.551 1.00 0.00 H ATOM 1938 HE1 HIS A 127 4.000 59.327 -5.725 1.00 0.00 H ATOM 1939 H HIS A 127 8.439 56.035 -4.651 1.00 0.00 H ATOM 1940 N LEU A 128 7.799 53.512 -2.745 1.00 16.48 N ATOM 1941 CA LEU A 128 8.032 52.342 -1.897 1.00 17.23 C ATOM 1942 C LEU A 128 8.129 52.769 -0.427 1.00 18.46 C ATOM 1943 O LEU A 128 7.324 52.324 0.403 1.00 19.21 O ATOM 1944 CB LEU A 128 9.269 51.567 -2.354 1.00 16.31 C ATOM 1945 CG LEU A 128 9.573 50.199 -1.689 1.00 17.20 C ATOM 1946 CD1 LEU A 128 10.445 49.370 -2.648 1.00 15.34 C ATOM 1947 CD2 LEU A 128 10.262 50.396 -0.313 1.00 15.08 C ATOM 1948 HA LEU A 128 7.185 51.663 -1.992 1.00 0.00 H ATOM 1949 HB2 LEU A 128 9.160 51.388 -3.424 1.00 0.00 H ATOM 1950 HB3 LEU A 128 10.133 52.208 -2.181 1.00 0.00 H ATOM 1951 HG LEU A 128 8.643 49.663 -1.501 1.00 0.00 H ATOM 1952 HD21 LEU A 128 11.199 50.936 -0.451 1.00 0.00 H ATOM 1953 HD22 LEU A 128 9.605 50.968 0.342 1.00 0.00 H ATOM 1954 HD23 LEU A 128 10.465 49.422 0.133 1.00 0.00 H ATOM 1955 HD11 LEU A 128 9.909 49.217 -3.584 1.00 0.00 H ATOM 1956 HD12 LEU A 128 11.375 49.903 -2.844 1.00 0.00 H ATOM 1957 HD13 LEU A 128 10.667 48.405 -2.193 1.00 0.00 H ATOM 1958 H LEU A 128 8.468 53.720 -3.513 1.00 0.00 H ATOM 1959 N PHE A 129 9.074 53.660 -0.122 1.00 19.25 N ATOM 1960 CA PHE A 129 9.194 54.255 1.218 1.00 20.03 C ATOM 1961 C PHE A 129 7.891 54.843 1.732 1.00 20.28 C ATOM 1962 O PHE A 129 7.468 54.536 2.835 1.00 21.28 O ATOM 1963 CB PHE A 129 10.273 55.344 1.246 1.00 20.13 C ATOM 1964 CG PHE A 129 11.680 54.823 1.144 1.00 20.77 C ATOM 1965 CD1 PHE A 129 12.010 53.524 1.565 1.00 20.70 C ATOM 1966 CD2 PHE A 129 12.685 55.635 0.614 1.00 18.48 C ATOM 1967 CE1 PHE A 129 13.330 53.062 1.477 1.00 20.46 C ATOM 1968 CE2 PHE A 129 14.000 55.179 0.497 1.00 20.76 C ATOM 1969 CZ PHE A 129 14.329 53.892 0.935 1.00 20.27 C ATOM 1970 HA PHE A 129 9.474 53.432 1.876 1.00 0.00 H ATOM 1971 HB2 PHE A 129 10.098 56.021 0.410 1.00 0.00 H ATOM 1972 HB3 PHE A 129 10.179 55.894 2.182 1.00 0.00 H ATOM 1973 HD2 PHE A 129 12.438 56.645 0.285 1.00 0.00 H ATOM 1974 HE2 PHE A 129 14.766 55.823 0.066 1.00 0.00 H ATOM 1975 HZ PHE A 129 15.355 53.533 0.857 1.00 0.00 H ATOM 1976 HE1 PHE A 129 13.583 52.061 1.828 1.00 0.00 H ATOM 1977 HD1 PHE A 129 11.234 52.871 1.963 1.00 0.00 H ATOM 1978 H PHE A 129 9.751 53.944 -0.859 1.00 0.00 H ATOM 1979 N THR A 130 7.256 55.712 0.951 1.00 19.87 N ATOM 1980 CA THR A 130 6.016 56.343 1.384 1.00 19.22 C ATOM 1981 C THR A 130 4.954 55.332 1.873 1.00 20.15 C ATOM 1982 O THR A 130 4.265 55.592 2.872 1.00 18.79 O ATOM 1983 CB THR A 130 5.453 57.250 0.288 1.00 19.81 C ATOM 1984 OG1 THR A 130 6.404 58.294 0.035 1.00 18.13 O ATOM 1985 CG2 THR A 130 4.139 57.894 0.725 1.00 20.83 C ATOM 1986 HA THR A 130 6.269 56.956 2.249 1.00 0.00 H ATOM 1987 HB THR A 130 5.269 56.650 -0.603 1.00 0.00 H ATOM 1988 HG1 THR A 130 6.056 58.892 -0.673 1.00 0.00 H ATOM 1989 HG23 THR A 130 3.402 57.115 0.922 1.00 0.00 H ATOM 1990 HG21 THR A 130 4.305 58.477 1.631 1.00 0.00 H ATOM 1991 HG22 THR A 130 3.775 58.548 -0.068 1.00 0.00 H ATOM 1992 H THR A 130 7.650 55.945 0.017 1.00 0.00 H ATOM 1993 N ALA A 131 4.833 54.198 1.171 1.00 19.19 N ATOM 1994 CA ALA A 131 3.914 53.134 1.591 1.00 20.03 C ATOM 1995 C ALA A 131 4.414 52.262 2.746 1.00 19.89 C ATOM 1996 O ALA A 131 3.658 52.005 3.688 1.00 19.99 O ATOM 1997 CB ALA A 131 3.551 52.240 0.420 1.00 19.29 C ATOM 1998 HA ALA A 131 3.039 53.666 1.964 1.00 0.00 H ATOM 1999 HB1 ALA A 131 3.068 52.836 -0.354 1.00 0.00 H ATOM 2000 HB2 ALA A 131 4.456 51.784 0.018 1.00 0.00 H ATOM 2001 HB3 ALA A 131 2.869 51.460 0.758 1.00 0.00 H ATOM 2002 H ALA A 131 5.402 54.069 0.310 1.00 0.00 H HETATM 2003 N MSE A 132 5.667 51.813 2.644 1.00 20.45 N HETATM 2004 CA MSE A 132 6.256 50.813 3.536 1.00 21.28 C HETATM 2005 C MSE A 132 6.571 51.351 4.915 1.00 20.85 C HETATM 2006 O MSE A 132 6.566 50.596 5.890 1.00 20.40 O HETATM 2007 CB MSE A 132 7.578 50.282 2.975 1.00 21.89 C HETATM 2008 CG MSE A 132 7.504 49.419 1.740 1.00 26.71 C HETATM 2009 SE MSE A 132 6.274 47.967 1.911 1.00 38.76 S HETATM 2010 CE MSE A 132 4.848 48.718 0.819 1.00 34.84 C HETATM 2011 HE3 MSE A 132 4.013 48.019 0.783 1.00 0.00 H HETATM 2012 HE2 MSE A 132 5.220 48.894 -0.190 1.00 0.00 H HETATM 2013 HE1 MSE A 132 4.516 49.660 1.255 1.00 0.00 H HETATM 2014 HG2 MSE A 132 7.193 50.041 0.901 1.00 0.00 H HETATM 2015 HG1 MSE A 132 8.495 49.012 1.541 1.00 0.00 H HETATM 2016 HB2 MSE A 132 8.055 49.694 3.759 1.00 0.00 H HETATM 2017 HB1 MSE A 132 8.203 51.143 2.737 1.00 0.00 H HETATM 2018 HA MSE A 132 5.500 50.031 3.609 1.00 0.00 H HETATM 2019 H MSE A 132 6.262 52.198 1.883 1.00 0.00 H ATOM 2020 N ASP A 133 6.890 52.643 4.982 1.00 19.86 N ATOM 2021 CA ASP A 133 7.430 53.253 6.206 1.00 19.92 C ATOM 2022 C ASP A 133 6.574 53.006 7.443 1.00 20.05 C ATOM 2023 O ASP A 133 7.099 52.942 8.552 1.00 20.20 O ATOM 2024 CB ASP A 133 7.637 54.755 6.028 1.00 20.15 C ATOM 2025 CG ASP A 133 8.950 55.091 5.334 1.00 20.73 C ATOM 2026 OD1 ASP A 133 9.801 54.200 5.096 1.00 22.98 O ATOM 2027 OD2 ASP A 133 9.137 56.268 5.035 1.00 23.85 O ATOM 2028 HA ASP A 133 8.388 52.761 6.372 1.00 0.00 H ATOM 2029 HB2 ASP A 133 6.816 55.152 5.431 1.00 0.00 H ATOM 2030 HB3 ASP A 133 7.631 55.227 7.011 1.00 0.00 H ATOM 2031 H ASP A 133 6.753 53.239 4.141 1.00 0.00 H ATOM 2032 N SER A 134 5.266 52.895 7.247 1.00 20.44 N ATOM 2033 CA SER A 134 4.323 52.726 8.349 1.00 20.99 C ATOM 2034 C SER A 134 4.062 51.271 8.700 1.00 21.34 C ATOM 2035 O SER A 134 3.363 50.991 9.669 1.00 21.96 O ATOM 2036 CB SER A 134 3.009 53.474 8.084 1.00 20.89 C ATOM 2037 OG SER A 134 2.367 53.027 6.902 1.00 20.41 O ATOM 2038 HA SER A 134 4.802 53.170 9.222 1.00 0.00 H ATOM 2039 HB2 SER A 134 3.224 54.538 7.986 1.00 0.00 H ATOM 2040 HB3 SER A 134 2.339 53.316 8.929 1.00 0.00 H ATOM 2041 HG SER A 134 2.966 53.173 6.127 1.00 0.00 H ATOM 2042 H SER A 134 4.900 52.930 6.274 1.00 0.00 H ATOM 2043 N THR A 135 4.622 50.344 7.928 1.00 21.62 N ATOM 2044 CA THR A 135 4.547 48.926 8.260 1.00 21.97 C ATOM 2045 C THR A 135 5.760 48.617 9.120 1.00 22.56 C ATOM 2046 O THR A 135 6.781 49.301 9.009 1.00 23.65 O ATOM 2047 CB THR A 135 4.537 47.996 6.996 1.00 22.71 C ATOM 2048 OG1 THR A 135 5.855 47.871 6.436 1.00 21.67 O ATOM 2049 CG2 THR A 135 3.568 48.527 5.925 1.00 22.37 C ATOM 2050 HA THR A 135 3.609 48.730 8.779 1.00 0.00 H ATOM 2051 HB THR A 135 4.198 47.012 7.320 1.00 0.00 H ATOM 2052 HG1 THR A 135 6.185 48.765 6.169 1.00 0.00 H ATOM 2053 HG23 THR A 135 2.570 48.620 6.354 1.00 0.00 H ATOM 2054 HG21 THR A 135 3.909 49.503 5.580 1.00 0.00 H ATOM 2055 HG22 THR A 135 3.541 47.833 5.085 1.00 0.00 H ATOM 2056 H THR A 135 5.126 50.638 7.067 1.00 0.00 H ATOM 2057 N ASP A 136 5.665 47.603 9.972 1.00 22.55 N ATOM 2058 CA ASP A 136 6.815 47.214 10.779 1.00 22.77 C ATOM 2059 C ASP A 136 7.493 45.944 10.273 1.00 23.38 C ATOM 2060 O ASP A 136 8.345 45.371 10.973 1.00 23.66 O ATOM 2061 CB ASP A 136 6.489 47.148 12.294 1.00 22.33 C ATOM 2062 CG ASP A 136 5.320 46.208 12.634 1.00 21.21 C ATOM 2063 OD1 ASP A 136 4.773 45.523 11.763 1.00 18.44 O ATOM 2064 OD2 ASP A 136 4.940 46.166 13.804 1.00 18.35 O ATOM 2065 HA ASP A 136 7.545 48.014 10.658 1.00 0.00 H ATOM 2066 HB2 ASP A 136 7.376 46.799 12.822 1.00 0.00 H ATOM 2067 HB3 ASP A 136 6.235 48.151 12.636 1.00 0.00 H ATOM 2068 H ASP A 136 4.768 47.085 10.064 1.00 0.00 H ATOM 2069 N ALA A 137 7.116 45.491 9.074 1.00 23.09 N ATOM 2070 CA ALA A 137 7.800 44.333 8.493 1.00 23.13 C ATOM 2071 C ALA A 137 9.231 44.724 8.081 1.00 22.99 C ATOM 2072 O ALA A 137 9.491 45.884 7.720 1.00 23.34 O ATOM 2073 CB ALA A 137 7.032 43.775 7.315 1.00 23.24 C ATOM 2074 HA ALA A 137 7.852 43.548 9.248 1.00 0.00 H ATOM 2075 HB1 ALA A 137 6.040 43.464 7.644 1.00 0.00 H ATOM 2076 HB2 ALA A 137 6.937 44.543 6.548 1.00 0.00 H ATOM 2077 HB3 ALA A 137 7.567 42.917 6.908 1.00 0.00 H ATOM 2078 H ALA A 137 6.343 45.957 8.557 1.00 0.00 H ATOM 2079 N ASP A 138 10.162 43.782 8.162 1.00 22.27 N ATOM 2080 CA ASP A 138 11.478 44.001 7.569 1.00 22.57 C ATOM 2081 C ASP A 138 11.287 43.958 6.050 1.00 22.20 C ATOM 2082 O ASP A 138 10.673 43.037 5.517 1.00 22.33 O ATOM 2083 CB ASP A 138 12.481 42.933 8.002 1.00 22.11 C ATOM 2084 CG ASP A 138 12.843 43.018 9.490 1.00 24.53 C ATOM 2085 OD1 ASP A 138 12.685 44.102 10.093 1.00 24.04 O ATOM 2086 OD2 ASP A 138 13.301 41.995 10.045 1.00 22.65 O ATOM 2087 HA ASP A 138 11.881 44.958 7.899 1.00 0.00 H ATOM 2088 HB2 ASP A 138 12.050 41.951 7.805 1.00 0.00 H ATOM 2089 HB3 ASP A 138 13.392 43.053 7.415 1.00 0.00 H ATOM 2090 H ASP A 138 9.954 42.887 8.648 1.00 0.00 H ATOM 2091 N VAL A 139 11.797 44.969 5.365 1.00 21.89 N ATOM 2092 CA VAL A 139 11.599 45.096 3.923 1.00 21.28 C ATOM 2093 C VAL A 139 12.944 44.872 3.235 1.00 20.92 C ATOM 2094 O VAL A 139 13.953 45.469 3.608 1.00 19.82 O ATOM 2095 CB VAL A 139 11.036 46.495 3.583 1.00 20.91 C ATOM 2096 CG1 VAL A 139 10.973 46.694 2.090 1.00 21.75 C ATOM 2097 CG2 VAL A 139 9.648 46.674 4.205 1.00 21.89 C ATOM 2098 HA VAL A 139 10.880 44.355 3.574 1.00 0.00 H ATOM 2099 HB VAL A 139 11.705 47.247 4.001 1.00 0.00 H ATOM 2100 HG11 VAL A 139 11.975 46.605 1.670 1.00 0.00 H ATOM 2101 HG12 VAL A 139 10.325 45.936 1.651 1.00 0.00 H ATOM 2102 HG13 VAL A 139 10.574 47.685 1.873 1.00 0.00 H ATOM 2103 HG21 VAL A 139 8.974 45.913 3.812 1.00 0.00 H ATOM 2104 HG22 VAL A 139 9.721 46.572 5.288 1.00 0.00 H ATOM 2105 HG23 VAL A 139 9.265 47.664 3.957 1.00 0.00 H ATOM 2106 H VAL A 139 12.353 45.691 5.866 1.00 0.00 H ATOM 2107 N VAL A 140 12.966 43.975 2.258 1.00 20.80 N ATOM 2108 CA VAL A 140 14.203 43.711 1.545 1.00 20.69 C ATOM 2109 C VAL A 140 13.944 43.978 0.069 1.00 21.07 C ATOM 2110 O VAL A 140 13.125 43.293 -0.564 1.00 19.77 O ATOM 2111 CB VAL A 140 14.710 42.249 1.740 1.00 20.68 C ATOM 2112 CG1 VAL A 140 15.993 42.037 0.951 1.00 20.16 C ATOM 2113 CG2 VAL A 140 14.930 41.927 3.224 1.00 20.58 C ATOM 2114 HA VAL A 140 14.984 44.361 1.941 1.00 0.00 H ATOM 2115 HB VAL A 140 13.945 41.569 1.366 1.00 0.00 H ATOM 2116 HG11 VAL A 140 15.801 42.214 -0.107 1.00 0.00 H ATOM 2117 HG12 VAL A 140 16.754 42.733 1.304 1.00 0.00 H ATOM 2118 HG13 VAL A 140 16.340 41.014 1.093 1.00 0.00 H ATOM 2119 HG21 VAL A 140 15.673 42.610 3.636 1.00 0.00 H ATOM 2120 HG22 VAL A 140 13.990 42.043 3.763 1.00 0.00 H ATOM 2121 HG23 VAL A 140 15.283 40.901 3.323 1.00 0.00 H ATOM 2122 H VAL A 140 12.098 43.461 2.003 1.00 0.00 H ATOM 2123 N ILE A 141 14.620 44.995 -0.454 1.00 21.12 N ATOM 2124 CA ILE A 141 14.430 45.422 -1.824 1.00 21.72 C ATOM 2125 C ILE A 141 15.440 44.689 -2.680 1.00 22.19 C ATOM 2126 O ILE A 141 16.628 44.725 -2.387 1.00 22.59 O ATOM 2127 CB ILE A 141 14.659 46.961 -1.959 1.00 21.58 C ATOM 2128 CG1 ILE A 141 13.677 47.732 -1.074 1.00 21.19 C ATOM 2129 CG2 ILE A 141 14.532 47.425 -3.394 1.00 20.50 C ATOM 2130 CD1 ILE A 141 14.147 49.137 -0.731 1.00 21.54 C ATOM 2131 HA ILE A 141 13.411 45.200 -2.141 1.00 0.00 H ATOM 2132 HB ILE A 141 15.677 47.165 -1.628 1.00 0.00 H ATOM 2133 HG12 ILE A 141 12.724 47.805 -1.597 1.00 0.00 H ATOM 2134 HG13 ILE A 141 13.539 47.177 -0.146 1.00 0.00 H ATOM 2135 HD11 ILE A 141 15.095 49.081 -0.197 1.00 0.00 H ATOM 2136 HD12 ILE A 141 14.279 49.709 -1.649 1.00 0.00 H ATOM 2137 HD13 ILE A 141 13.402 49.624 -0.102 1.00 0.00 H ATOM 2138 HG21 ILE A 141 15.274 46.913 -4.007 1.00 0.00 H ATOM 2139 HG22 ILE A 141 13.532 47.194 -3.762 1.00 0.00 H ATOM 2140 HG23 ILE A 141 14.699 48.501 -3.443 1.00 0.00 H ATOM 2141 H ILE A 141 15.308 45.501 0.140 1.00 0.00 H ATOM 2142 N TYR A 142 14.994 44.061 -3.745 1.00 22.98 N ATOM 2143 CA TYR A 142 15.897 43.374 -4.649 1.00 23.96 C ATOM 2144 C TYR A 142 16.033 44.077 -5.974 1.00 24.35 C ATOM 2145 O TYR A 142 15.093 44.576 -6.484 1.00 24.41 O ATOM 2146 CB TYR A 142 15.400 41.962 -4.886 1.00 20.00 C ATOM 2147 CG TYR A 142 15.491 41.060 -3.696 1.00 20.00 C ATOM 2148 CD1 TYR A 142 16.451 40.085 -3.626 1.00 20.00 C ATOM 2149 CD2 TYR A 142 14.618 41.186 -2.654 1.00 20.00 C ATOM 2150 CE1 TYR A 142 16.530 39.263 -2.567 1.00 20.00 C ATOM 2151 CE2 TYR A 142 14.677 40.372 -1.576 1.00 20.00 C ATOM 2152 CZ TYR A 142 15.651 39.402 -1.514 1.00 20.00 C ATOM 2153 OH TYR A 142 15.728 38.595 -0.422 1.00 20.00 O ATOM 2154 HA TYR A 142 16.880 43.364 -4.177 1.00 0.00 H ATOM 2155 HB3 TYR A 142 15.991 41.524 -5.690 1.00 0.00 H ATOM 2156 HB2 TYR A 142 14.355 42.016 -5.192 1.00 0.00 H ATOM 2157 HD2 TYR A 142 13.854 41.963 -2.692 1.00 0.00 H ATOM 2158 HE2 TYR A 142 13.959 40.483 -0.763 1.00 0.00 H ATOM 2159 HE1 TYR A 142 17.291 38.484 -2.540 1.00 0.00 H ATOM 2160 HD1 TYR A 142 17.163 39.975 -4.444 1.00 0.00 H ATOM 2161 HH TYR A 142 14.880 38.094 -0.323 1.00 0.00 H ATOM 2162 H TYR A 142 13.973 44.056 -3.944 1.00 0.00 H ATOM 2163 N CYS A 143 17.218 44.069 -6.528 1.00 24.97 N ATOM 2164 CA CYS A 143 17.535 44.689 -7.817 1.00 25.48 C ATOM 2165 C CYS A 143 18.586 43.825 -8.516 1.00 26.39 C ATOM 2166 O CYS A 143 19.023 42.822 -7.957 1.00 25.80 O ATOM 2167 CB CYS A 143 18.106 46.078 -7.584 1.00 25.68 C ATOM 2168 SG CYS A 143 19.564 46.024 -6.538 1.00 26.00 S ATOM 2169 HA CYS A 143 16.636 44.768 -8.429 1.00 0.00 H ATOM 2170 HB2 CYS A 143 17.348 46.697 -7.104 1.00 0.00 H ATOM 2171 HB3 CYS A 143 18.375 46.516 -8.545 1.00 0.00 H ATOM 2172 HG CYS A 143 20.045 47.305 -6.356 1.00 0.00 H ATOM 2173 H CYS A 143 17.988 43.590 -6.019 1.00 0.00 H ATOM 2174 N ARG A 144 18.995 44.200 -9.728 1.00 27.21 N ATOM 2175 CA ARG A 144 20.003 43.417 -10.443 1.00 28.58 C ATOM 2176 C ARG A 144 21.218 44.234 -10.889 1.00 28.45 C ATOM 2177 O ARG A 144 22.268 43.665 -11.186 1.00 28.45 O ATOM 2178 CB ARG A 144 19.379 42.648 -11.623 1.00 28.75 C ATOM 2179 CG ARG A 144 20.191 41.431 -12.095 1.00 32.14 C ATOM 2180 CD ARG A 144 20.281 40.306 -11.034 1.00 36.15 C ATOM 2181 NE ARG A 144 19.065 39.494 -11.028 1.00 38.89 N ATOM 2182 CZ ARG A 144 18.947 38.298 -11.597 1.00 39.29 C ATOM 2183 NH1 ARG A 144 19.983 37.736 -12.209 1.00 40.83 N ATOM 2184 NH2 ARG A 144 17.787 37.656 -11.546 1.00 39.83 N ATOM 2185 HA ARG A 144 20.384 42.694 -9.722 1.00 0.00 H ATOM 2186 HB2 ARG A 144 18.392 42.301 -11.319 1.00 0.00 H ATOM 2187 HB3 ARG A 144 19.278 43.336 -12.462 1.00 0.00 H ATOM 2188 HG2 ARG A 144 19.719 41.026 -12.990 1.00 0.00 H ATOM 2189 HG3 ARG A 144 21.201 41.761 -12.336 1.00 0.00 H ATOM 2190 HD2 ARG A 144 20.416 40.754 -10.049 1.00 0.00 H ATOM 2191 HD3 ARG A 144 21.135 39.668 -11.262 1.00 0.00 H ATOM 2192 HE ARG A 144 18.230 39.881 -10.543 1.00 0.00 H ATOM 2193 HH12 ARG A 144 19.881 36.800 -12.651 1.00 0.00 H ATOM 2194 HH11 ARG A 144 20.897 38.232 -12.246 1.00 0.00 H ATOM 2195 HH22 ARG A 144 17.691 36.720 -11.990 1.00 0.00 H ATOM 2196 HH21 ARG A 144 16.974 38.088 -11.062 1.00 0.00 H ATOM 2197 H ARG A 144 18.595 45.054 -10.168 1.00 0.00 H ATOM 2198 N ASP A 145 21.081 45.557 -10.932 1.00 28.27 N ATOM 2199 CA ASP A 145 22.171 46.425 -11.386 1.00 28.48 C ATOM 2200 C ASP A 145 23.039 46.879 -10.208 1.00 28.73 C ATOM 2201 O ASP A 145 22.514 47.323 -9.177 1.00 28.43 O ATOM 2202 CB ASP A 145 21.598 47.627 -12.140 1.00 28.86 C ATOM 2203 CG ASP A 145 22.666 48.502 -12.745 1.00 29.41 C ATOM 2204 OD1 ASP A 145 23.010 48.303 -13.927 1.00 31.12 O ATOM 2205 OD2 ASP A 145 23.164 49.397 -12.045 1.00 30.31 O ATOM 2206 HA ASP A 145 22.809 45.859 -12.064 1.00 0.00 H ATOM 2207 HB2 ASP A 145 20.953 47.262 -12.939 1.00 0.00 H ATOM 2208 HB3 ASP A 145 21.009 48.226 -11.445 1.00 0.00 H ATOM 2209 H ASP A 145 20.180 45.985 -10.637 1.00 0.00 H ATOM 2210 N LYS A 146 24.360 46.746 -10.358 1.00 28.56 N ATOM 2211 CA LYS A 146 25.323 47.184 -9.333 1.00 28.51 C ATOM 2212 C LYS A 146 25.184 48.670 -8.964 1.00 28.00 C ATOM 2213 O LYS A 146 25.221 49.016 -7.776 1.00 27.81 O ATOM 2214 CB LYS A 146 26.773 46.897 -9.765 1.00 28.58 C ATOM 2215 CG LYS A 146 27.261 45.482 -9.493 1.00 29.88 C ATOM 2216 CD LYS A 146 28.780 45.380 -9.694 1.00 32.16 C ATOM 2217 CE LYS A 146 29.283 43.957 -9.438 1.00 33.45 C ATOM 2218 NZ LYS A 146 30.767 43.823 -9.612 1.00 33.14 N ATOM 2219 HA LYS A 146 25.085 46.601 -8.444 1.00 0.00 H ATOM 2220 HB2 LYS A 146 26.848 47.080 -10.837 1.00 0.00 H ATOM 2221 HB3 LYS A 146 27.427 47.588 -9.233 1.00 0.00 H ATOM 2222 HG2 LYS A 146 27.017 45.211 -8.466 1.00 0.00 H ATOM 2223 HG3 LYS A 146 26.763 44.794 -10.177 1.00 0.00 H ATOM 2224 HD2 LYS A 146 29.022 45.663 -10.718 1.00 0.00 H ATOM 2225 HD3 LYS A 146 29.276 46.062 -9.003 1.00 0.00 H ATOM 2226 HE2 LYS A 146 28.788 43.282 -10.136 1.00 0.00 H ATOM 2227 HE3 LYS A 146 29.025 43.675 -8.417 1.00 0.00 H ATOM 2228 HZ1 LYS A 146 31.025 44.081 -10.586 1.00 0.00 H ATOM 2229 HZ2 LYS A 146 31.252 44.456 -8.944 1.00 0.00 H ATOM 2230 HZ3 LYS A 146 31.049 42.839 -9.426 1.00 0.00 H ATOM 2231 H LYS A 146 24.723 46.316 -11.233 1.00 0.00 H ATOM 2232 N GLU A 147 25.045 49.537 -9.962 1.00 27.26 N ATOM 2233 CA GLU A 147 24.891 50.949 -9.715 1.00 27.31 C ATOM 2234 C GLU A 147 23.585 51.247 -8.958 1.00 26.98 C ATOM 2235 O GLU A 147 23.566 52.041 -8.064 1.00 27.32 O ATOM 2236 CB GLU A 147 24.949 51.749 -11.005 1.00 27.11 C ATOM 2237 CG GLU A 147 26.340 52.063 -11.578 1.00 29.13 C ATOM 2238 CD GLU A 147 27.474 52.045 -10.568 1.00 30.19 C ATOM 2239 OE1 GLU A 147 27.790 53.100 -9.988 1.00 83.99 O ATOM 2240 OE2 GLU A 147 28.082 50.971 -10.373 1.00 94.56 O ATOM 2241 HA GLU A 147 25.727 51.257 -9.087 1.00 0.00 H ATOM 2242 HB2 GLU A 147 24.401 51.189 -11.763 1.00 0.00 H ATOM 2243 HB3 GLU A 147 24.447 52.699 -10.824 1.00 0.00 H ATOM 2244 HG2 GLU A 147 26.562 51.325 -12.348 1.00 0.00 H ATOM 2245 HG3 GLU A 147 26.304 53.055 -12.027 1.00 0.00 H ATOM 2246 H GLU A 147 25.047 49.189 -10.942 1.00 0.00 H ATOM 2247 N TRP A 148 22.514 50.582 -9.334 1.00 26.20 N ATOM 2248 CA TRP A 148 21.213 50.735 -8.677 1.00 25.61 C ATOM 2249 C TRP A 148 21.235 50.237 -7.236 1.00 25.38 C ATOM 2250 O TRP A 148 20.612 50.843 -6.360 1.00 25.23 O ATOM 2251 CB TRP A 148 20.127 49.999 -9.469 1.00 25.62 C ATOM 2252 CG TRP A 148 19.614 50.786 -10.642 1.00 24.55 C ATOM 2253 CD1 TRP A 148 20.353 51.492 -11.540 1.00 24.75 C ATOM 2254 CD2 TRP A 148 18.248 50.933 -11.041 1.00 23.45 C ATOM 2255 NE1 TRP A 148 19.532 52.084 -12.470 1.00 24.43 N ATOM 2256 CE2 TRP A 148 18.233 51.758 -12.184 1.00 23.22 C ATOM 2257 CE3 TRP A 148 17.031 50.463 -10.529 1.00 23.36 C ATOM 2258 CZ2 TRP A 148 17.048 52.111 -12.843 1.00 23.82 C ATOM 2259 CZ3 TRP A 148 15.851 50.819 -11.183 1.00 23.89 C ATOM 2260 CH2 TRP A 148 15.870 51.636 -12.328 1.00 21.99 C ATOM 2261 HA TRP A 148 20.987 51.801 -8.654 1.00 0.00 H ATOM 2262 HB2 TRP A 148 20.542 49.060 -9.836 1.00 0.00 H ATOM 2263 HB3 TRP A 148 19.292 49.789 -8.800 1.00 0.00 H ATOM 2264 HE1 TRP A 148 19.846 52.682 -13.261 1.00 0.00 H ATOM 2265 HD1 TRP A 148 21.440 51.576 -11.524 1.00 0.00 H ATOM 2266 HZ2 TRP A 148 17.062 52.740 -13.733 1.00 0.00 H ATOM 2267 HH2 TRP A 148 14.930 51.896 -12.815 1.00 0.00 H ATOM 2268 HZ3 TRP A 148 14.897 50.457 -10.800 1.00 0.00 H ATOM 2269 HE3 TRP A 148 17.007 49.833 -9.640 1.00 0.00 H ATOM 2270 H TRP A 148 22.594 49.919 -10.132 1.00 0.00 H ATOM 2271 N GLU A 149 21.954 49.142 -6.993 1.00 24.64 N ATOM 2272 CA GLU A 149 22.151 48.633 -5.634 1.00 24.53 C ATOM 2273 C GLU A 149 22.754 49.724 -4.735 1.00 24.50 C ATOM 2274 O GLU A 149 22.213 50.021 -3.654 1.00 23.77 O ATOM 2275 CB GLU A 149 23.049 47.387 -5.634 1.00 24.57 C ATOM 2276 CG GLU A 149 23.299 46.840 -4.236 1.00 24.97 C ATOM 2277 CD GLU A 149 24.282 45.679 -4.188 1.00 25.80 C ATOM 2278 OE1 GLU A 149 24.940 45.359 -5.205 1.00 24.01 O ATOM 2279 OE2 GLU A 149 24.392 45.082 -3.098 1.00 27.32 O ATOM 2280 HA GLU A 149 21.177 48.348 -5.237 1.00 0.00 H ATOM 2281 HB2 GLU A 149 22.569 46.612 -6.231 1.00 0.00 H ATOM 2282 HB3 GLU A 149 24.007 47.648 -6.083 1.00 0.00 H ATOM 2283 HG2 GLU A 149 23.692 47.647 -3.618 1.00 0.00 H ATOM 2284 HG3 GLU A 149 22.348 46.500 -3.826 1.00 0.00 H ATOM 2285 H GLU A 149 22.387 48.635 -7.791 1.00 0.00 H ATOM 2286 N LYS A 150 23.856 50.320 -5.199 1.00 24.10 N ATOM 2287 CA LYS A 150 24.519 51.415 -4.484 1.00 24.46 C ATOM 2288 C LYS A 150 23.574 52.574 -4.193 1.00 24.26 C ATOM 2289 O LYS A 150 23.513 53.041 -3.061 1.00 24.64 O ATOM 2290 CB LYS A 150 25.744 51.934 -5.246 1.00 24.16 C ATOM 2291 CG LYS A 150 26.914 50.950 -5.334 1.00 25.78 C ATOM 2292 CD LYS A 150 27.953 51.756 -6.054 1.00 74.38 C ATOM 2293 CE LYS A 150 28.685 50.784 -7.010 1.00 93.84 C ATOM 2294 NZ LYS A 150 30.004 51.285 -7.531 1.00105.39 N ATOM 2295 HA LYS A 150 24.846 50.993 -3.534 1.00 0.00 H ATOM 2296 HB2 LYS A 150 25.432 52.181 -6.261 1.00 0.00 H ATOM 2297 HB3 LYS A 150 26.097 52.836 -4.746 1.00 0.00 H ATOM 2298 HG2 LYS A 150 27.259 50.656 -4.343 1.00 0.00 H ATOM 2299 HG3 LYS A 150 26.641 50.060 -5.901 1.00 0.00 H ATOM 2300 HD2 LYS A 150 27.480 52.557 -6.622 1.00 0.00 H ATOM 2301 HD3 LYS A 150 28.658 52.184 -5.341 1.00 0.00 H ATOM 2302 HE2 LYS A 150 28.034 50.592 -7.863 1.00 0.00 H ATOM 2303 HE3 LYS A 150 28.864 49.852 -6.474 1.00 0.00 H ATOM 2304 HZ1 LYS A 150 29.854 52.169 -8.058 1.00 0.00 H ATOM 2305 HZ2 LYS A 150 30.646 51.461 -6.732 1.00 0.00 H ATOM 2306 HZ3 LYS A 150 30.420 50.570 -8.161 1.00 0.00 H ATOM 2307 H LYS A 150 24.259 49.995 -6.101 1.00 0.00 H ATOM 2308 N LYS A 151 22.838 53.029 -5.209 1.00 24.10 N ATOM 2309 CA LYS A 151 21.942 54.178 -5.060 1.00 24.11 C ATOM 2310 C LYS A 151 20.797 53.893 -4.099 1.00 23.62 C ATOM 2311 O LYS A 151 20.414 54.757 -3.306 1.00 23.08 O ATOM 2312 CB LYS A 151 21.365 54.602 -6.408 1.00 24.48 C ATOM 2313 CG LYS A 151 22.294 55.403 -7.289 1.00 24.45 C ATOM 2314 CD LYS A 151 21.567 55.721 -8.584 1.00 26.54 C ATOM 2315 CE LYS A 151 22.421 56.548 -9.523 1.00 27.88 C ATOM 2316 NZ LYS A 151 22.084 56.250 -10.953 1.00 28.86 N ATOM 2317 HA LYS A 151 22.546 54.986 -4.648 1.00 0.00 H ATOM 2318 HB2 LYS A 151 21.081 53.700 -6.951 1.00 0.00 H ATOM 2319 HB3 LYS A 151 20.477 55.206 -6.219 1.00 0.00 H ATOM 2320 HG2 LYS A 151 22.573 56.329 -6.786 1.00 0.00 H ATOM 2321 HG3 LYS A 151 23.191 54.823 -7.503 1.00 0.00 H ATOM 2322 HD2 LYS A 151 21.303 54.786 -9.079 1.00 0.00 H ATOM 2323 HD3 LYS A 151 20.659 56.277 -8.351 1.00 0.00 H ATOM 2324 HE2 LYS A 151 23.472 56.317 -9.348 1.00 0.00 H ATOM 2325 HE3 LYS A 151 22.246 57.606 -9.327 1.00 0.00 H ATOM 2326 HZ1 LYS A 151 22.254 55.242 -11.145 1.00 0.00 H ATOM 2327 HZ2 LYS A 151 21.083 56.473 -11.126 1.00 0.00 H ATOM 2328 HZ3 LYS A 151 22.682 56.829 -11.577 1.00 0.00 H ATOM 2329 H LYS A 151 22.902 52.555 -6.132 1.00 0.00 H ATOM 2330 N ILE A 152 20.241 52.689 -4.184 1.00 23.27 N ATOM 2331 CA ILE A 152 19.155 52.287 -3.287 1.00 23.11 C ATOM 2332 C ILE A 152 19.694 52.235 -1.857 1.00 23.39 C ATOM 2333 O ILE A 152 19.065 52.761 -0.929 1.00 23.07 O ATOM 2334 CB ILE A 152 18.537 50.936 -3.698 1.00 23.02 C ATOM 2335 CG1 ILE A 152 17.878 51.067 -5.072 1.00 23.33 C ATOM 2336 CG2 ILE A 152 17.528 50.464 -2.649 1.00 22.58 C ATOM 2337 CD1 ILE A 152 17.543 49.720 -5.761 1.00 22.07 C ATOM 2338 HA ILE A 152 18.353 53.023 -3.352 1.00 0.00 H ATOM 2339 HB ILE A 152 19.327 50.187 -3.760 1.00 0.00 H ATOM 2340 HG12 ILE A 152 16.951 51.627 -4.952 1.00 0.00 H ATOM 2341 HG13 ILE A 152 18.555 51.622 -5.722 1.00 0.00 H ATOM 2342 HD11 ILE A 152 18.460 49.149 -5.904 1.00 0.00 H ATOM 2343 HD12 ILE A 152 16.855 49.154 -5.134 1.00 0.00 H ATOM 2344 HD13 ILE A 152 17.079 49.914 -6.728 1.00 0.00 H ATOM 2345 HG21 ILE A 152 18.032 50.345 -1.690 1.00 0.00 H ATOM 2346 HG22 ILE A 152 16.732 51.203 -2.554 1.00 0.00 H ATOM 2347 HG23 ILE A 152 17.104 49.509 -2.959 1.00 0.00 H ATOM 2348 H ILE A 152 20.584 52.019 -4.902 1.00 0.00 H ATOM 2349 N SER A 153 20.890 51.661 -1.706 1.00 23.53 N ATOM 2350 CA SER A 153 21.530 51.544 -0.404 1.00 23.55 C ATOM 2351 C SER A 153 21.785 52.907 0.227 1.00 23.93 C ATOM 2352 O SER A 153 21.474 53.094 1.399 1.00 23.67 O ATOM 2353 CB SER A 153 22.836 50.754 -0.489 1.00 23.81 C ATOM 2354 OG SER A 153 23.346 50.547 0.817 1.00 23.04 O ATOM 2355 HA SER A 153 20.836 50.998 0.235 1.00 0.00 H ATOM 2356 HB2 SER A 153 23.562 51.313 -1.079 1.00 0.00 H ATOM 2357 HB3 SER A 153 22.649 49.791 -0.964 1.00 0.00 H ATOM 2358 HG SER A 153 22.685 50.039 1.351 1.00 0.00 H ATOM 2359 H SER A 153 21.379 51.286 -2.544 1.00 0.00 H ATOM 2360 N GLU A 154 22.335 53.844 -0.553 1.00 23.99 N ATOM 2361 CA GLU A 154 22.578 55.212 -0.094 1.00 24.88 C ATOM 2362 C GLU A 154 21.283 55.874 0.367 1.00 24.78 C ATOM 2363 O GLU A 154 21.254 56.554 1.401 1.00 24.93 O ATOM 2364 CB GLU A 154 23.164 56.066 -1.216 1.00 25.34 C ATOM 2365 CG GLU A 154 24.589 55.730 -1.620 1.00 28.99 C ATOM 2366 CD GLU A 154 24.964 56.345 -2.969 1.00 33.05 C ATOM 2367 OE1 GLU A 154 24.353 57.374 -3.351 1.00 34.39 O ATOM 2368 OE2 GLU A 154 25.865 55.797 -3.646 1.00 33.92 O ATOM 2369 HA GLU A 154 23.281 55.147 0.737 1.00 0.00 H ATOM 2370 HB2 GLU A 154 22.529 55.948 -2.094 1.00 0.00 H ATOM 2371 HB3 GLU A 154 23.143 57.106 -0.892 1.00 0.00 H ATOM 2372 HG2 GLU A 154 25.270 56.110 -0.858 1.00 0.00 H ATOM 2373 HG3 GLU A 154 24.690 54.647 -1.687 1.00 0.00 H ATOM 2374 H GLU A 154 22.601 53.590 -1.526 1.00 0.00 H ATOM 2375 N ALA A 155 20.221 55.672 -0.413 1.00 24.08 N ATOM 2376 CA ALA A 155 18.942 56.296 -0.156 1.00 23.79 C ATOM 2377 C ALA A 155 18.354 55.770 1.142 1.00 23.42 C ATOM 2378 O ALA A 155 17.708 56.528 1.874 1.00 23.50 O ATOM 2379 CB ALA A 155 17.993 56.058 -1.300 1.00 24.29 C ATOM 2380 HA ALA A 155 19.095 57.371 -0.060 1.00 0.00 H ATOM 2381 HB1 ALA A 155 18.414 56.479 -2.213 1.00 0.00 H ATOM 2382 HB2 ALA A 155 17.843 54.986 -1.429 1.00 0.00 H ATOM 2383 HB3 ALA A 155 17.038 56.537 -1.084 1.00 0.00 H ATOM 2384 H ALA A 155 20.316 55.043 -1.236 1.00 0.00 H ATOM 2385 N ILE A 156 18.582 54.485 1.428 1.00 21.97 N ATOM 2386 CA ILE A 156 18.200 53.902 2.718 1.00 21.35 C ATOM 2387 C ILE A 156 19.037 54.519 3.852 1.00 21.78 C ATOM 2388 O ILE A 156 18.495 54.976 4.868 1.00 21.02 O ATOM 2389 CB ILE A 156 18.359 52.348 2.732 1.00 21.05 C ATOM 2390 CG1 ILE A 156 17.377 51.671 1.752 1.00 20.07 C ATOM 2391 CG2 ILE A 156 18.196 51.787 4.162 1.00 20.85 C ATOM 2392 CD1 ILE A 156 17.632 50.162 1.564 1.00 17.57 C ATOM 2393 HA ILE A 156 17.146 54.130 2.874 1.00 0.00 H ATOM 2394 HB ILE A 156 19.369 52.117 2.394 1.00 0.00 H ATOM 2395 HG12 ILE A 156 16.364 51.805 2.132 1.00 0.00 H ATOM 2396 HG13 ILE A 156 17.467 52.159 0.782 1.00 0.00 H ATOM 2397 HD11 ILE A 156 18.638 50.011 1.173 1.00 0.00 H ATOM 2398 HD12 ILE A 156 17.534 49.656 2.524 1.00 0.00 H ATOM 2399 HD13 ILE A 156 16.903 49.756 0.862 1.00 0.00 H ATOM 2400 HG21 ILE A 156 18.956 52.222 4.811 1.00 0.00 H ATOM 2401 HG22 ILE A 156 17.206 52.041 4.540 1.00 0.00 H ATOM 2402 HG23 ILE A 156 18.312 50.703 4.141 1.00 0.00 H ATOM 2403 H ILE A 156 19.043 53.882 0.717 1.00 0.00 H ATOM 2404 N GLN A 157 20.353 54.537 3.659 1.00 22.34 N ATOM 2405 CA GLN A 157 21.296 54.945 4.712 1.00 23.43 C ATOM 2406 C GLN A 157 21.157 56.403 5.139 1.00 23.85 C ATOM 2407 O GLN A 157 21.370 56.738 6.305 1.00 23.81 O ATOM 2408 CB GLN A 157 22.750 54.663 4.287 1.00 23.67 C ATOM 2409 CG GLN A 157 23.122 53.177 4.269 1.00 23.70 C ATOM 2410 CD GLN A 157 22.820 52.474 5.588 1.00 24.65 C ATOM 2411 OE1 GLN A 157 21.981 51.571 5.641 1.00 24.62 O ATOM 2412 NE2 GLN A 157 23.497 52.892 6.662 1.00 23.96 N ATOM 2413 HA GLN A 157 21.038 54.340 5.581 1.00 0.00 H ATOM 2414 HB2 GLN A 157 22.897 55.065 3.285 1.00 0.00 H ATOM 2415 HB3 GLN A 157 23.415 55.174 4.983 1.00 0.00 H ATOM 2416 HG2 GLN A 157 22.558 52.686 3.476 1.00 0.00 H ATOM 2417 HG3 GLN A 157 24.189 53.088 4.063 1.00 0.00 H ATOM 2418 HE22 GLN A 157 24.196 53.657 6.571 1.00 0.00 H ATOM 2419 HE21 GLN A 157 23.325 52.452 7.589 1.00 0.00 H ATOM 2420 H GLN A 157 20.728 54.253 2.732 1.00 0.00 H HETATM 2421 N MSE A 158 20.803 57.262 4.192 1.00 24.55 N HETATM 2422 CA MSE A 158 20.797 58.702 4.432 1.00 25.26 C HETATM 2423 C MSE A 158 19.522 59.202 5.112 1.00 24.64 C HETATM 2424 O MSE A 158 19.410 60.385 5.441 1.00 24.06 O HETATM 2425 CB MSE A 158 21.030 59.449 3.126 1.00 26.10 C HETATM 2426 CG MSE A 158 19.785 59.670 2.309 1.00 30.17 C HETATM 2427 SE MSE A 158 20.132 60.794 0.760 1.00 43.09 S HETATM 2428 CE MSE A 158 21.330 62.155 1.536 1.00 37.92 C HETATM 2429 HE3 MSE A 158 21.614 62.870 0.764 1.00 0.00 H HETATM 2430 HE2 MSE A 158 22.223 61.669 1.929 1.00 0.00 H HETATM 2431 HE1 MSE A 158 20.813 62.675 2.343 1.00 0.00 H HETATM 2432 HG2 MSE A 158 19.409 58.705 1.969 1.00 0.00 H HETATM 2433 HG1 MSE A 158 19.033 60.151 2.934 1.00 0.00 H HETATM 2434 HB2 MSE A 158 21.736 58.875 2.525 1.00 0.00 H HETATM 2435 HB1 MSE A 158 21.462 60.422 3.361 1.00 0.00 H HETATM 2436 HA MSE A 158 21.612 58.905 5.127 1.00 0.00 H HETATM 2437 H MSE A 158 20.523 56.901 3.257 1.00 0.00 H ATOM 2438 N ARG A 159 18.567 58.299 5.315 1.00 24.12 N ATOM 2439 CA ARG A 159 17.300 58.656 5.941 1.00 24.13 C ATOM 2440 C ARG A 159 17.419 58.690 7.464 1.00 24.75 C ATOM 2441 O ARG A 159 16.592 59.304 8.154 1.00 24.35 O ATOM 2442 CB ARG A 159 16.230 57.647 5.551 1.00 23.95 C ATOM 2443 CG ARG A 159 15.950 57.573 4.066 1.00 22.92 C ATOM 2444 CD ARG A 159 14.889 56.538 3.822 1.00 21.83 C ATOM 2445 NE ARG A 159 13.580 57.128 4.032 1.00 20.93 N ATOM 2446 CZ ARG A 159 12.480 56.447 4.319 1.00 18.53 C ATOM 2447 NH1 ARG A 159 12.518 55.125 4.464 1.00 17.83 N ATOM 2448 NH2 ARG A 159 11.344 57.101 4.476 1.00 16.17 N ATOM 2449 HA ARG A 159 17.026 59.651 5.592 1.00 0.00 H ATOM 2450 HB2 ARG A 159 16.552 56.661 5.887 1.00 0.00 H ATOM 2451 HB3 ARG A 159 15.305 57.918 6.059 1.00 0.00 H ATOM 2452 HG2 ARG A 159 15.604 58.543 3.710 1.00 0.00 H ATOM 2453 HG3 ARG A 159 16.861 57.296 3.535 1.00 0.00 H ATOM 2454 HD2 ARG A 159 15.028 55.706 4.512 1.00 0.00 H ATOM 2455 HD3 ARG A 159 14.964 56.175 2.797 1.00 0.00 H ATOM 2456 HE ARG A 159 13.499 58.162 3.951 1.00 0.00 H ATOM 2457 HH12 ARG A 159 11.648 54.601 4.689 1.00 0.00 H ATOM 2458 HH11 ARG A 159 13.418 54.615 4.352 1.00 0.00 H ATOM 2459 HH22 ARG A 159 10.472 56.581 4.701 1.00 0.00 H ATOM 2460 HH21 ARG A 159 11.321 58.136 4.374 1.00 0.00 H ATOM 2461 H ARG A 159 18.728 57.315 5.020 1.00 0.00 H ATOM 2462 N THR A 160 18.462 58.025 7.961 1.00 25.15 N ATOM 2463 CA THR A 160 18.623 57.701 9.369 1.00 25.95 C ATOM 2464 C THR A 160 19.890 58.366 9.909 1.00 25.57 C ATOM 2465 O THR A 160 20.780 58.728 9.138 1.00 24.90 O ATOM 2466 CB THR A 160 18.719 56.159 9.570 1.00 26.20 C ATOM 2467 OG1 THR A 160 19.989 55.688 9.098 1.00 28.61 O ATOM 2468 CG2 THR A 160 17.611 55.435 8.789 1.00 27.09 C ATOM 2469 HA THR A 160 17.753 58.072 9.912 1.00 0.00 H ATOM 2470 HB THR A 160 18.606 55.950 10.634 1.00 0.00 H ATOM 2471 HG1 THR A 160 20.081 55.900 8.135 1.00 0.00 H ATOM 2472 HG23 THR A 160 16.638 55.782 9.136 1.00 0.00 H ATOM 2473 HG21 THR A 160 17.717 55.651 7.726 1.00 0.00 H ATOM 2474 HG22 THR A 160 17.695 54.361 8.953 1.00 0.00 H ATOM 2475 H THR A 160 19.206 57.719 7.301 1.00 0.00 H TER 2476 THR A 160 HETATM 2477 N1 APR A 1 15.207 39.984 -9.425 1.00 -0.27 N HETATM 2478 C2 APR A 1 15.364 41.245 -8.987 1.00 0.05 C HETATM 2479 N3 APR A 1 15.158 42.321 -9.770 1.00 -0.27 N HETATM 2480 C4 APR A 1 14.793 42.180 -11.066 1.00 0.16 C HETATM 2481 C5 APR A 1 14.614 40.830 -11.625 1.00 0.10 C HETATM 2482 C6 APR A 1 14.849 39.698 -10.701 1.00 0.13 C HETATM 2483 N6 APR A 1 14.702 38.415 -11.111 1.00 -0.32 N HETATM 2484 H2 APR A 1 14.430 38.213 -12.084 1.00 0.18 H HETATM 2485 H3 APR A 1 14.863 37.642 -10.450 1.00 0.18 H HETATM 2486 N7 APR A 1 14.243 40.988 -12.910 1.00 -0.30 N HETATM 2487 C8 APR A 1 14.212 42.326 -13.160 1.00 0.11 C HETATM 2488 N9 APR A 1 14.549 43.033 -12.054 1.00 -0.19 N HETATM 2489 C1' APR A 1 14.588 44.509 -11.862 1.00 0.20 C HETATM 2490 C2' APR A 1 14.495 45.322 -13.146 1.00 0.14 C HETATM 2491 O2' APR A 1 15.782 45.685 -13.660 1.00 -0.38 O HETATM 2492 H7 APR A 1 16.243 46.208 -13.015 1.00 0.21 H HETATM 2493 C3' APR A 1 13.695 46.550 -12.731 1.00 0.11 C HETATM 2494 O3' APR A 1 14.582 47.541 -12.182 1.00 -0.39 O HETATM 2495 H9 APR A 1 14.080 48.305 -11.924 1.00 0.21 H HETATM 2496 C4' APR A 1 12.791 46.048 -11.616 1.00 0.12 C HETATM 2497 O4' APR A 1 13.368 44.800 -11.153 1.00 -0.34 O HETATM 2498 C5' APR A 1 11.345 45.851 -12.061 1.00 0.11 C HETATM 2499 O5' APR A 1 11.322 45.552 -13.461 1.00 -0.25 O HETATM 2500 PA APR A 1 10.189 44.634 -14.119 1.00 0.30 P HETATM 2501 O1A APR A 1 10.225 43.280 -13.452 1.00 -0.61 O HETATM 2502 O2A APR A 1 10.303 44.718 -15.614 1.00 -0.61 O HETATM 2503 O3A APR A 1 8.766 45.266 -13.657 1.00 -0.13 O HETATM 2504 PB APR A 1 7.937 46.511 -14.284 1.00 0.30 P HETATM 2505 O1B APR A 1 6.911 46.839 -13.192 1.00 -0.61 O HETATM 2506 O2B APR A 1 8.915 47.549 -14.753 1.00 -0.61 O HETATM 2507 O5D APR A 1 7.129 45.859 -15.490 1.00 -0.25 O HETATM 2508 C5D APR A 1 6.189 44.818 -15.236 1.00 0.11 C HETATM 2509 C4D APR A 1 5.977 44.088 -16.550 1.00 0.12 C HETATM 2510 O4D APR A 1 7.162 43.343 -16.841 1.00 -0.34 O HETATM 2511 C1D APR A 1 6.712 42.025 -17.199 1.00 0.19 C HETATM 2512 O1D APR A 1 7.782 41.123 -17.033 1.00 -0.36 O HETATM 2513 H15 APR A 1 8.065 41.133 -16.126 1.00 0.21 H HETATM 2514 C2D APR A 1 5.540 41.771 -16.270 1.00 0.13 C HETATM 2515 O2D APR A 1 4.636 40.715 -16.635 1.00 -0.38 O HETATM 2516 H17 APR A 1 4.254 40.906 -17.483 1.00 0.21 H HETATM 2517 C3D APR A 1 4.841 43.087 -16.510 1.00 0.11 C HETATM 2518 O3D APR A 1 4.234 43.003 -17.815 1.00 -0.39 O HETATM 2519 H19 APR A 1 3.781 43.816 -18.005 1.00 0.21 H HETATM 2520 H20 APR A 1 4.101 43.326 -15.732 1.00 0.06 H HETATM 2521 H18 APR A 1 5.869 41.630 -15.230 1.00 0.07 H HETATM 2522 H16 APR A 1 6.375 41.993 -18.245 1.00 0.09 H HETATM 2523 H21 APR A 1 5.784 44.826 -17.342 1.00 0.07 H HETATM 2524 H13 APR A 1 5.239 45.244 -14.882 1.00 0.06 H HETATM 2525 H14 APR A 1 6.586 44.126 -14.478 1.00 0.06 H HETATM 2526 H11 APR A 1 10.773 46.771 -11.871 1.00 0.06 H HETATM 2527 H12 APR A 1 10.897 45.018 -11.499 1.00 0.06 H HETATM 2528 H10 APR A 1 12.797 46.779 -10.795 1.00 0.07 H HETATM 2529 H8 APR A 1 13.119 46.963 -13.572 1.00 0.06 H HETATM 2530 H6 APR A 1 13.955 44.754 -13.918 1.00 0.07 H HETATM 2531 H5 APR A 1 15.484 44.798 -11.293 1.00 0.10 H HETATM 2532 H4 APR A 1 13.951 42.769 -14.120 1.00 0.13 H HETATM 2533 H1 APR A 1 15.670 41.403 -7.959 1.00 0.10 H HETATM 2534 O HOH 1 -1.144 29.304 -12.946 1.00 29.26 O HETATM 2535 O HOH 2 18.210 48.244 -13.575 1.00 35.38 O HETATM 2536 O HOH 3 15.832 58.537 -17.873 1.00 21.34 O HETATM 2537 O HOH 4 -7.349 42.325 0.317 1.00 29.36 O HETATM 2538 O HOH 5 -0.633 62.916 -9.992 1.00 10.97 O HETATM 2539 O HOH 6 -1.662 40.400 -11.531 1.00 20.94 O HETATM 2540 O HOH 7 -2.686 63.072 -17.299 1.00 10.19 O HETATM 2541 O HOH 8 -2.991 58.491 -18.541 1.00 18.57 O HETATM 2542 O HOH 9 2.184 43.670 -19.502 1.00 19.06 O HETATM 2543 O HOH 10 5.290 59.715 -2.101 1.00 36.25 O HETATM 2544 O HOH 11 12.829 31.524 -10.229 1.00 21.99 O HETATM 2545 O HOH 12 -6.394 52.003 -9.110 1.00 37.93 O HETATM 2546 O HOH 13 7.402 50.802 -20.680 1.00 13.55 O HETATM 2547 O HOH 14 3.564 54.759 5.168 1.00 15.50 O HETATM 2548 O HOH 15 2.786 42.403 8.723 1.00 20.20 O HETATM 2549 O HOH 16 15.874 50.108 11.552 1.00 22.04 O HETATM 2550 O HOH 17 11.262 59.057 -12.716 1.00 31.88 O HETATM 2551 O HOH 18 0.000 38.038 -11.681 1.00 16.28 O HETATM 2552 O HOH 19 20.583 58.856 -2.173 1.00 39.40 O HETATM 2553 O HOH 20 4.194 45.931 -12.209 1.00 16.96 O HETATM 2554 O HOH 21 -2.317 57.050 -5.285 1.00 24.20 O HETATM 2555 O HOH 22 15.841 57.722 -10.888 1.00 16.00 O HETATM 2556 O HOH 23 19.834 57.261 -4.219 1.00 27.05 O HETATM 2557 O HOH 24 5.332 60.225 -13.326 1.00 15.85 O HETATM 2558 O HOH 25 -4.079 61.368 -18.953 1.00 17.51 O HETATM 2559 O HOH 26 13.670 52.773 -14.806 1.00 16.91 O HETATM 2560 O HOH 27 -4.482 35.976 1.379 1.00 27.93 O HETATM 2561 O HOH 28 -3.929 52.008 -2.905 1.00 25.37 O HETATM 2562 O HOH 29 23.443 42.509 -2.239 1.00 24.56 O HETATM 2563 O HOH 30 1.493 26.036 -3.864 1.00 25.89 O HETATM 2564 O HOH 31 -5.769 35.522 -13.423 1.00 29.79 O HETATM 2565 O HOH 32 0.212 48.965 -16.378 1.00 27.01 O HETATM 2566 O HOH 33 13.932 61.863 -3.797 1.00 36.85 O HETATM 2567 O HOH 34 -6.719 50.651 -12.669 1.00 25.35 O HETATM 2568 O HOH 35 3.176 54.897 -2.076 1.00 19.17 O HETATM 2569 O HOH 36 0.855 52.660 3.644 1.00 22.50 O HETATM 2570 O HOH 37 -1.728 51.406 2.389 1.00 27.17 O HETATM 2571 O HOH 38 -6.035 31.510 -6.514 1.00 21.37 O HETATM 2572 O HOH 39 10.915 26.321 -9.637 1.00 26.01 O HETATM 2573 O HOH 40 -5.687 40.190 -1.974 1.00 25.24 O HETATM 2574 O HOH 41 17.993 46.506 -11.157 1.00 31.94 O HETATM 2575 O HOH 42 7.261 38.741 -22.682 1.00 46.16 O HETATM 2576 O HOH 43 11.553 36.774 7.783 1.00 23.52 O HETATM 2577 O HOH 44 16.676 58.729 0.897 1.00 29.50 O HETATM 2578 O HOH 45 -8.688 30.796 -7.137 1.00 30.14 O HETATM 2579 O HOH 46 16.980 38.616 3.149 1.00 29.36 O HETATM 2580 O HOH 47 12.731 44.056 -16.496 1.00 20.66 O HETATM 2581 O HOH 48 19.870 28.897 -6.932 1.00 29.82 O HETATM 2582 O HOH 49 -4.206 29.827 -2.915 1.00 24.89 O HETATM 2583 O HOH 50 -5.098 29.363 -5.428 1.00 21.52 O HETATM 2584 O HOH 51 -6.484 32.748 0.291 1.00 38.90 O HETATM 2585 O HOH 52 13.541 27.847 -9.768 1.00 35.81 O HETATM 2586 O HOH 53 -5.061 32.626 -1.983 1.00 17.88 O HETATM 2587 O HOH 54 15.966 60.863 2.340 1.00 14.29 O HETATM 2588 O HOH 55 13.931 45.718 -8.561 1.00 17.93 O HETATM 2589 O HOH 56 -3.294 63.003 -9.792 1.00 15.20 O HETATM 2590 O HOH 57 20.512 35.875 -7.754 1.00 29.00 O HETATM 2591 O HOH 58 4.898 49.200 -23.458 1.00 28.40 O HETATM 2592 O HOH 59 -2.424 58.053 -21.111 1.00 18.16 O HETATM 2593 O HOH 60 -8.347 37.597 -10.370 1.00 27.87 O HETATM 2594 O HOH 61 1.204 56.785 -1.172 1.00 28.02 O HETATM 2595 O HOH 62 13.275 58.604 -10.671 1.00 15.55 O HETATM 2596 O HOH 63 -3.485 34.427 -14.331 1.00 33.76 O HETATM 2597 O HOH 64 7.928 33.521 -17.916 1.00 39.01 O HETATM 2598 O HOH 65 15.602 52.683 7.749 1.00 22.69 O HETATM 2599 O HOH 66 16.852 58.006 -4.671 1.00 35.85 O HETATM 2600 O HOH 67 -4.622 51.407 1.839 1.00 29.42 O HETATM 2601 O HOH 68 16.846 49.861 8.127 1.00 22.40 O HETATM 2602 O HOH 69 4.192 40.043 -19.222 1.00 32.79 O HETATM 2603 O HOH 70 0.768 57.449 1.545 1.00 34.90 O HETATM 2604 O HOH 71 9.488 32.107 -16.164 1.00 24.01 O HETATM 2605 O HOH 72 8.867 46.399 23.176 1.00 27.14 O HETATM 2606 O HOH 73 2.951 36.464 -21.274 1.00 31.54 O HETATM 2607 O HOH 74 8.076 41.787 -13.908 1.00 16.50 O HETATM 2608 O HOH 75 1.605 39.074 -13.767 1.00 16.82 O HETATM 2609 O HOH 76 -1.188 59.088 -3.976 1.00 27.02 O HETATM 2610 O HOH 77 7.802 58.013 5.914 1.00 29.95 O HETATM 2611 O HOH 78 -5.531 51.093 -5.153 1.00 34.22 O HETATM 2612 O HOH 79 21.050 46.878 2.902 1.00 24.73 O HETATM 2613 O HOH 80 -7.179 38.476 6.173 1.00 18.39 O HETATM 2614 O HOH 81 -6.900 37.935 -1.070 1.00 31.03 O HETATM 2615 O HOH 82 16.206 59.123 -2.278 1.00 53.86 O HETATM 2616 O HOH 83 -6.331 31.687 -13.408 1.00 27.14 O HETATM 2617 O HOH 84 -5.718 62.606 -3.619 1.00 28.65 O HETATM 2618 O HOH 85 -6.793 27.210 -5.807 1.00 36.45 O HETATM 2619 O HOH 86 8.623 62.258 -14.744 1.00 25.49 O HETATM 2620 O HOH 87 13.273 50.519 8.670 1.00 29.86 O HETATM 2621 O HOH 88 9.509 50.927 -22.973 1.00 36.08 O HETATM 2622 O HOH 89 21.816 49.754 2.784 1.00 39.76 O HETATM 2623 O HOH 90 -2.786 28.521 -6.668 1.00 28.09 O HETATM 2624 O HOH 91 8.437 25.632 -7.497 1.00 17.30 O HETATM 2625 O HOH 92 8.195 57.346 -20.216 1.00 28.00 O HETATM 2626 O HOH 93 5.809 26.618 -6.506 1.00 22.33 O HETATM 2627 O HOH 94 15.920 47.347 -9.722 1.00 33.24 O HETATM 2628 O HOH 95 23.242 45.693 -0.443 1.00 28.27 O HETATM 2629 O HOH 96 6.182 47.136 -22.431 1.00 27.82 O HETATM 2630 O HOH 97 -1.431 27.532 -3.913 1.00 34.25 O HETATM 2631 O HOH 98 13.989 37.577 -13.863 1.00 29.10 O HETATM 2632 O HOH 99 5.888 29.471 3.205 1.00 36.52 O HETATM 2633 O HOH 100 13.632 32.283 4.543 1.00 28.76 O HETATM 2634 O HOH 101 7.426 54.116 -24.094 1.00 22.71 O HETATM 2635 O HOH 102 0.848 62.162 -7.999 1.00 19.66 O HETATM 2636 O HOH 103 -4.725 50.433 -0.378 1.00 30.80 O HETATM 2637 O HOH 104 14.468 32.643 -11.431 1.00 28.58 O HETATM 2638 O HOH 105 -5.994 52.972 -14.061 1.00 43.76 O HETATM 2639 O HOH 106 14.689 29.996 -2.842 1.00 21.85 O HETATM 2640 O HOH 107 4.421 58.738 -19.373 1.00 34.25 O HETATM 2641 O HOH 108 16.287 48.910 -15.011 1.00 35.18 O HETATM 2642 O HOH 109 -3.643 53.828 1.603 1.00 37.74 O CONECT 1 2 16 17 18 CONECT 16 1 CONECT 17 1 CONECT 18 1 CONECT 177 155 178 193 CONECT 178 177 179 181 192 CONECT 179 178 180 194 CONECT 180 179 CONECT 181 178 182 190 191 CONECT 182 181 183 188 189 CONECT 183 182 184 CONECT 184 183 185 186 187 CONECT 185 184 CONECT 186 184 CONECT 187 184 CONECT 188 182 CONECT 189 182 CONECT 190 181 CONECT 191 181 CONECT 192 178 CONECT 193 177 CONECT 916 902 917 932 CONECT 917 916 918 920 931 CONECT 918 917 919 933 CONECT 919 918 CONECT 920 917 921 929 930 CONECT 921 920 922 927 928 CONECT 922 921 923 CONECT 923 922 924 925 926 CONECT 924 923 CONECT 925 923 CONECT 926 923 CONECT 927 921 CONECT 928 921 CONECT 929 920 CONECT 930 920 CONECT 931 917 CONECT 932 916 CONECT 2003 1995 2004 2019 CONECT 2004 2003 2005 2007 2018 CONECT 2005 2004 2006 2020 CONECT 2006 2005 CONECT 2007 2004 2008 2016 2017 CONECT 2008 2007 2009 2014 2015 CONECT 2009 2008 2010 CONECT 2010 2009 2011 2012 2013 CONECT 2011 2010 CONECT 2012 2010 CONECT 2013 2010 CONECT 2014 2008 CONECT 2015 2008 CONECT 2016 2007 CONECT 2017 2007 CONECT 2018 2004 CONECT 2019 2003 CONECT 2421 2406 2422 2437 CONECT 2422 2421 2423 2425 2436 CONECT 2423 2422 2424 2438 CONECT 2424 2423 CONECT 2425 2422 2426 2434 2435 CONECT 2426 2425 2427 2432 2433 CONECT 2427 2426 2428 CONECT 2428 2427 2429 2430 2431 CONECT 2429 2428 CONECT 2430 2428 CONECT 2431 2428 CONECT 2432 2426 CONECT 2433 2426 CONECT 2434 2425 CONECT 2435 2425 CONECT 2436 2422 CONECT 2437 2421 CONECT 2477 2478 2482 CONECT 2478 2477 2479 2533 CONECT 2479 2478 2480 CONECT 2480 2479 2481 2488 CONECT 2481 2480 2482 2486 CONECT 2482 2477 2481 2483 CONECT 2483 2482 2484 2485 CONECT 2484 2483 CONECT 2485 2483 CONECT 2486 2481 2487 CONECT 2487 2486 2488 2532 CONECT 2488 2480 2487 2489 CONECT 2489 2488 2490 2497 2531 CONECT 2490 2489 2491 2493 2530 CONECT 2491 2490 2492 CONECT 2492 2491 CONECT 2493 2490 2494 2496 2529 CONECT 2494 2493 2495 CONECT 2495 2494 CONECT 2496 2493 2497 2498 2528 CONECT 2497 2489 2496 CONECT 2498 2496 2499 2526 2527 CONECT 2499 2498 2500 CONECT 2500 2499 2501 2502 2503 CONECT 2501 2500 CONECT 2502 2500 CONECT 2503 2500 2504 CONECT 2504 2503 2505 2506 2507 CONECT 2505 2504 CONECT 2506 2504 CONECT 2507 2504 2508 CONECT 2508 2507 2509 2524 2525 CONECT 2509 2508 2510 2517 2523 CONECT 2510 2509 2511 CONECT 2511 2510 2512 2514 2522 CONECT 2512 2511 2513 CONECT 2513 2512 CONECT 2514 2511 2515 2517 2521 CONECT 2515 2514 2516 CONECT 2516 2515 CONECT 2517 2509 2514 2518 2520 CONECT 2518 2517 2519 CONECT 2519 2518 CONECT 2520 2517 CONECT 2521 2514 CONECT 2522 2511 CONECT 2523 2509 CONECT 2524 2508 CONECT 2525 2508 CONECT 2526 2498 CONECT 2527 2498 CONECT 2528 2496 CONECT 2529 2493 CONECT 2530 2490 CONECT 2531 2489 CONECT 2532 2487 CONECT 2533 2478 MASTER 0 0 0 0 0 0 0 0 2641 1 129 13 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 3gpo
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1ihy
RCSB PDB
PDBbind
APR
1szd
RCSB PDB
PDBbind
APR
2l8r
RCSB PDB
PDBbind
APR
3gqo
RCSB PDB
PDBbind
APR
3q6z
RCSB PDB
PDBbind
APR
5dus
RCSB PDB
PDBbind
APR
5mqx
RCSB PDB
PDBbind
APR
Entry Information
PDB ID
3gpo
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
macro domain of Chikungunya virus
Ligand Name
APR
EC.Number
E.C.-.-.-.-
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
Kd=5uM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) J.Virol. Vol. 83: pp. 6534-6545
Ligand Properties
Formula
C
1
5
H
2
5
N
5
O
1
4
P
2
Molecular Weight
561.332
Exact Mass
561.087
No. of atoms
61
No. of bonds
64
Polar Surface Area
325.02
LOGP Value
-6.34 (
Computed with XLOGP3
)
-3.58 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 12
No. of Rotatable Bonds: 14
No. of Nitrogen and Oxygen Atoms: 19
No. of Rings: 4
Canonical SMILES
O[C@@H]1[C@@H](COP(OP(OC[C@H]2O[C@H]([C@@H]([C@@H]2O)O)O)(O)O)(O)O)O[C@H]([C@@H]1O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C15H27N5O14P2/c16-12-7-13(18-3-17-12)20(4-19-7)14-10(23)8(21)5(32-14)1-30-35(26,27)34-36(28,29)31-2-6-9(22)11(24)15(25)33-6/h3-6,8-11,14-15,21-29,35-36H,1-2H2,(H2,16,17,18)/t5-,6-,8-,9-,10-,11-,14-,15-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q8JUX6
Entrez Gene ID
NCBI Entrez Gene ID:
956309
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓