Browse entries in the PDBbind-CN Database
HEADER 1LFO_COMPLEX COMPND 1LFO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 69 ACE MET ASN PHE SER GLY LYS TYR GLN VAL GLN SER GLN SEQRES 2 A 69 GLU ASN PHE GLU PRO PHE MET LYS ALA MET GLY LEU PRO SEQRES 3 A 69 GLU ASP LEU ILE GLN LYS GLY LYS ASP ILE LYS GLY VAL SEQRES 4 A 69 SER GLU ILE VAL HIS GLU GLY LYS LYS VAL LYS LEU THR SEQRES 5 A 69 ILE THR TYR GLY SER LYS VAL ILE HIS ASN GLU PHE THR SEQRES 6 A 69 LEU GLY GLU GLU SEQRES 1 A 58 GLU LEU GLU THR MET THR GLY GLU LYS VAL LYS ALA VAL SEQRES 2 A 58 VAL LYS MET GLU GLY ASP ASN LYS MET VAL THR THR PHE SEQRES 3 A 58 LYS GLY ILE LYS SER VAL THR GLU PHE ASN GLY ASP THR SEQRES 4 A 58 ILE THR ASN THR MET THR LEU GLY ASP ILE VAL TYR LYS SEQRES 5 A 58 ARG VAL SER LYS ARG ILE HET ACE A 0 6 HET OLA A 189 53 HETATM 1 CA ACE A 0 31.072 5.721 34.975 1.00 89.65 C HETATM 2 C ACE A 0 30.449 6.858 35.831 1.00 85.66 C HETATM 3 O ACE A 0 29.425 7.432 35.402 1.00 88.15 O HETATM 4 H3 ACE A 0 31.952 5.326 35.483 1.00 0.00 H HETATM 5 H2 ACE A 0 31.360 6.117 34.001 1.00 0.00 H HETATM 6 H1 ACE A 0 30.339 4.925 34.842 1.00 0.00 H ATOM 7 N MET A 1 31.096 7.272 36.917 1.00 80.86 N ATOM 8 CA MET A 1 32.400 7.919 36.828 1.00 74.00 C ATOM 9 C MET A 1 32.689 8.746 38.082 1.00 69.78 C ATOM 10 O MET A 1 33.843 8.856 38.503 1.00 76.27 O ATOM 11 CB MET A 1 32.453 8.823 35.588 1.00 76.30 C ATOM 12 CG MET A 1 33.843 9.107 35.057 1.00 75.05 C ATOM 13 SD MET A 1 33.797 10.167 33.602 1.00 71.24 S ATOM 14 CE MET A 1 34.934 11.469 34.108 1.00 74.76 C ATOM 15 HA MET A 1 33.160 7.142 36.745 1.00 0.00 H ATOM 16 HB2 MET A 1 31.880 8.342 34.795 1.00 0.00 H ATOM 17 HB3 MET A 1 31.988 9.775 35.844 1.00 0.00 H ATOM 18 HG2 MET A 1 34.320 8.163 34.792 1.00 0.00 H ATOM 19 HG3 MET A 1 34.425 9.600 35.836 1.00 0.00 H ATOM 20 HE1 MET A 1 34.557 11.947 35.012 1.00 0.00 H ATOM 21 HE2 MET A 1 35.915 11.037 34.306 1.00 0.00 H ATOM 22 HE3 MET A 1 35.015 12.208 33.311 1.00 0.00 H ATOM 23 H MET A 1 30.662 7.131 37.851 1.00 0.00 H ATOM 24 N ASN A 2 31.628 9.263 38.702 1.00 58.80 N ATOM 25 CA ASN A 2 31.711 10.114 39.898 1.00 56.76 C ATOM 26 C ASN A 2 32.373 11.444 39.560 1.00 54.09 C ATOM 27 O ASN A 2 33.570 11.513 39.300 1.00 55.81 O ATOM 28 CB ASN A 2 32.454 9.451 41.059 1.00 52.85 C ATOM 29 CG ASN A 2 32.472 10.327 42.309 1.00 58.56 C ATOM 30 OD1 ASN A 2 31.724 11.307 42.411 1.00 57.12 O ATOM 31 ND2 ASN A 2 33.326 9.981 43.263 1.00 68.08 N ATOM 32 HA ASN A 2 30.685 10.280 40.226 1.00 0.00 H ATOM 33 HB2 ASN A 2 31.962 8.508 41.298 1.00 0.00 H ATOM 34 HB3 ASN A 2 33.482 9.256 40.752 1.00 0.00 H ATOM 35 HD22 ASN A 2 33.937 9.149 43.137 1.00 0.00 H ATOM 36 HD21 ASN A 2 33.384 10.542 44.137 1.00 0.00 H ATOM 37 H ASN A 2 30.685 9.052 38.317 1.00 0.00 H ATOM 38 N PHE A 3 31.595 12.512 39.662 1.00 47.94 N ATOM 39 CA PHE A 3 32.071 13.833 39.309 1.00 34.88 C ATOM 40 C PHE A 3 32.325 14.735 40.503 1.00 32.60 C ATOM 41 O PHE A 3 32.403 15.949 40.354 1.00 32.94 O ATOM 42 CB PHE A 3 31.049 14.474 38.385 1.00 32.40 C ATOM 43 CG PHE A 3 30.626 13.592 37.244 1.00 28.01 C ATOM 44 CD1 PHE A 3 31.571 12.987 36.423 1.00 38.01 C ATOM 45 CD2 PHE A 3 29.285 13.410 36.958 1.00 30.55 C ATOM 46 CE1 PHE A 3 31.181 12.217 35.322 1.00 36.13 C ATOM 47 CE2 PHE A 3 28.884 12.646 35.864 1.00 38.21 C ATOM 48 CZ PHE A 3 29.835 12.050 35.045 1.00 37.25 C ATOM 49 HA PHE A 3 33.037 13.713 38.819 1.00 0.00 H ATOM 50 HB2 PHE A 3 30.165 14.726 38.971 1.00 0.00 H ATOM 51 HB3 PHE A 3 31.482 15.386 37.973 1.00 0.00 H ATOM 52 HD2 PHE A 3 28.532 13.871 37.597 1.00 0.00 H ATOM 53 HE2 PHE A 3 27.823 12.516 35.650 1.00 0.00 H ATOM 54 HZ PHE A 3 29.523 11.453 34.188 1.00 0.00 H ATOM 55 HE1 PHE A 3 31.933 11.751 34.686 1.00 0.00 H ATOM 56 HD1 PHE A 3 32.631 13.115 36.640 1.00 0.00 H ATOM 57 H PHE A 3 30.619 12.399 40.004 1.00 0.00 H ATOM 58 N SER A 4 32.438 14.151 41.688 1.00 24.60 N ATOM 59 CA SER A 4 32.673 14.955 42.879 1.00 30.16 C ATOM 60 C SER A 4 33.981 15.745 42.796 1.00 31.11 C ATOM 61 O SER A 4 34.928 15.316 42.126 1.00 32.14 O ATOM 62 CB SER A 4 32.641 14.075 44.131 1.00 19.19 C ATOM 63 OG SER A 4 31.344 13.526 44.316 1.00 27.27 O ATOM 64 HA SER A 4 31.868 15.687 42.944 1.00 0.00 H ATOM 65 HB2 SER A 4 32.904 14.677 45.001 1.00 0.00 H ATOM 66 HB3 SER A 4 33.362 13.265 44.020 1.00 0.00 H ATOM 67 HG SER A 4 31.104 12.976 43.528 1.00 0.00 H ATOM 68 H SER A 4 32.359 13.117 41.767 1.00 0.00 H ATOM 69 N GLY A 5 34.015 16.912 43.440 1.00 26.25 N ATOM 70 CA GLY A 5 35.215 17.724 43.426 1.00 20.94 C ATOM 71 C GLY A 5 34.962 19.214 43.362 1.00 22.82 C ATOM 72 O GLY A 5 33.829 19.657 43.181 1.00 25.64 O ATOM 73 HA3 GLY A 5 35.808 17.441 42.556 1.00 0.00 H ATOM 74 HA2 GLY A 5 35.780 17.513 44.334 1.00 0.00 H ATOM 75 H GLY A 5 33.174 17.242 43.956 1.00 0.00 H ATOM 76 N LYS A 6 36.023 19.990 43.551 1.00 22.37 N ATOM 77 CA LYS A 6 35.952 21.445 43.491 1.00 19.17 C ATOM 78 C LYS A 6 36.774 21.852 42.267 1.00 17.26 C ATOM 79 O LYS A 6 37.846 21.320 42.041 1.00 17.14 O ATOM 80 CB LYS A 6 36.514 22.053 44.773 1.00 16.01 C ATOM 81 CG LYS A 6 36.188 23.519 44.955 1.00 36.62 C ATOM 82 CD LYS A 6 36.320 23.963 46.415 1.00 53.91 C ATOM 83 CE LYS A 6 37.756 23.870 46.937 1.00 56.15 C ATOM 84 NZ LYS A 6 37.905 24.386 48.338 1.00 58.60 N ATOM 85 HA LYS A 6 34.926 21.803 43.404 1.00 0.00 H ATOM 86 HB2 LYS A 6 36.105 21.503 45.621 1.00 0.00 H ATOM 87 HB3 LYS A 6 37.598 21.942 44.758 1.00 0.00 H ATOM 88 HG2 LYS A 6 36.871 24.109 44.345 1.00 0.00 H ATOM 89 HG3 LYS A 6 35.164 23.695 44.625 1.00 0.00 H ATOM 90 HD2 LYS A 6 35.986 24.997 46.496 1.00 0.00 H ATOM 91 HD3 LYS A 6 35.684 23.328 47.031 1.00 0.00 H ATOM 92 HE2 LYS A 6 38.403 24.453 46.281 1.00 0.00 H ATOM 93 HE3 LYS A 6 38.066 22.825 46.916 1.00 0.00 H ATOM 94 HZ1 LYS A 6 37.621 25.386 48.370 1.00 0.00 H ATOM 95 HZ2 LYS A 6 37.300 23.832 48.977 1.00 0.00 H ATOM 96 HZ3 LYS A 6 38.898 24.297 48.635 1.00 0.00 H ATOM 97 H LYS A 6 36.940 19.542 43.750 1.00 0.00 H ATOM 98 N TYR A 7 36.220 22.725 41.434 1.00 16.51 N ATOM 99 CA TYR A 7 36.869 23.161 40.208 1.00 15.07 C ATOM 100 C TYR A 7 36.801 24.672 40.103 1.00 17.61 C ATOM 101 O TYR A 7 35.943 25.298 40.703 1.00 12.88 O ATOM 102 CB TYR A 7 36.127 22.584 38.989 1.00 19.62 C ATOM 103 CG TYR A 7 35.817 21.107 39.077 1.00 28.13 C ATOM 104 CD1 TYR A 7 34.729 20.648 39.821 1.00 31.57 C ATOM 105 CD2 TYR A 7 36.612 20.166 38.421 1.00 29.75 C ATOM 106 CE1 TYR A 7 34.439 19.283 39.912 1.00 40.16 C ATOM 107 CE2 TYR A 7 36.330 18.801 38.502 1.00 37.71 C ATOM 108 CZ TYR A 7 35.245 18.368 39.250 1.00 37.89 C ATOM 109 OH TYR A 7 34.965 17.024 39.345 1.00 47.32 O ATOM 110 HA TYR A 7 37.904 22.819 40.227 1.00 0.00 H ATOM 111 HB3 TYR A 7 36.745 22.749 38.106 1.00 0.00 H ATOM 112 HB2 TYR A 7 35.186 23.122 38.878 1.00 0.00 H ATOM 113 HD2 TYR A 7 37.468 20.502 37.835 1.00 0.00 H ATOM 114 HE2 TYR A 7 36.959 18.080 37.980 1.00 0.00 H ATOM 115 HE1 TYR A 7 33.586 18.941 40.498 1.00 0.00 H ATOM 116 HD1 TYR A 7 34.094 21.366 40.340 1.00 0.00 H ATOM 117 HH TYR A 7 34.164 16.894 39.912 1.00 0.00 H ATOM 118 H TYR A 7 35.284 23.113 41.668 1.00 0.00 H ATOM 119 N GLN A 8 37.691 25.257 39.318 1.00 13.25 N ATOM 120 CA GLN A 8 37.670 26.689 39.124 1.00 16.35 C ATOM 121 C GLN A 8 37.785 26.995 37.649 1.00 16.59 C ATOM 122 O GLN A 8 38.506 26.315 36.935 1.00 20.38 O ATOM 123 CB GLN A 8 38.803 27.365 39.873 1.00 14.36 C ATOM 124 CG GLN A 8 38.798 28.858 39.681 1.00 26.52 C ATOM 125 CD GLN A 8 39.690 29.546 40.663 1.00 34.26 C ATOM 126 OE1 GLN A 8 40.908 29.384 40.629 1.00 42.21 O ATOM 127 NE2 GLN A 8 39.094 30.313 41.559 1.00 31.75 N ATOM 128 HA GLN A 8 36.729 27.074 39.516 1.00 0.00 H ATOM 129 HB2 GLN A 8 38.701 27.147 40.936 1.00 0.00 H ATOM 130 HB3 GLN A 8 39.751 26.967 39.511 1.00 0.00 H ATOM 131 HG2 GLN A 8 39.142 29.086 38.672 1.00 0.00 H ATOM 132 HG3 GLN A 8 37.780 29.227 39.809 1.00 0.00 H ATOM 133 HE22 GLN A 8 38.059 30.419 41.547 1.00 0.00 H ATOM 134 HE21 GLN A 8 39.659 30.811 42.276 1.00 0.00 H ATOM 135 H GLN A 8 38.411 24.682 38.837 1.00 0.00 H ATOM 136 N VAL A 9 37.040 27.993 37.192 1.00 18.62 N ATOM 137 CA VAL A 9 37.071 28.401 35.803 1.00 16.00 C ATOM 138 C VAL A 9 38.471 28.869 35.470 1.00 18.59 C ATOM 139 O VAL A 9 39.090 29.572 36.261 1.00 16.91 O ATOM 140 CB VAL A 9 36.098 29.558 35.538 1.00 20.50 C ATOM 141 CG1 VAL A 9 36.145 29.964 34.072 1.00 13.63 C ATOM 142 CG2 VAL A 9 34.707 29.145 35.925 1.00 15.43 C ATOM 143 HA VAL A 9 36.778 27.551 35.187 1.00 0.00 H ATOM 144 HB VAL A 9 36.393 30.418 36.139 1.00 0.00 H ATOM 145 HG11 VAL A 9 37.156 30.283 33.817 1.00 0.00 H ATOM 146 HG12 VAL A 9 35.864 29.113 33.451 1.00 0.00 H ATOM 147 HG13 VAL A 9 35.449 30.785 33.901 1.00 0.00 H ATOM 148 HG21 VAL A 9 34.409 28.278 35.335 1.00 0.00 H ATOM 149 HG22 VAL A 9 34.687 28.889 36.984 1.00 0.00 H ATOM 150 HG23 VAL A 9 34.019 29.969 35.736 1.00 0.00 H ATOM 151 H VAL A 9 36.414 28.498 37.852 1.00 0.00 H ATOM 152 N GLN A 10 38.958 28.451 34.307 1.00 19.82 N ATOM 153 CA GLN A 10 40.284 28.804 33.829 1.00 24.06 C ATOM 154 C GLN A 10 40.138 29.763 32.659 1.00 25.80 C ATOM 155 O GLN A 10 40.909 30.710 32.547 1.00 29.31 O ATOM 156 CB GLN A 10 41.063 27.549 33.385 1.00 16.87 C ATOM 157 CG GLN A 10 41.247 26.473 34.473 1.00 22.88 C ATOM 158 CD GLN A 10 41.984 26.978 35.727 1.00 35.68 C ATOM 159 OE1 GLN A 10 43.090 27.514 35.643 1.00 40.02 O ATOM 160 NE2 GLN A 10 41.375 26.785 36.894 1.00 30.19 N ATOM 161 HA GLN A 10 40.843 29.276 34.637 1.00 0.00 H ATOM 162 HB2 GLN A 10 40.527 27.097 32.550 1.00 0.00 H ATOM 163 HB3 GLN A 10 42.052 27.865 33.052 1.00 0.00 H ATOM 164 HG2 GLN A 10 40.262 26.115 34.773 1.00 0.00 H ATOM 165 HG3 GLN A 10 41.818 25.648 34.048 1.00 0.00 H ATOM 166 HE22 GLN A 10 40.441 26.329 36.924 1.00 0.00 H ATOM 167 HE21 GLN A 10 41.833 27.091 37.776 1.00 0.00 H ATOM 168 H GLN A 10 38.362 27.842 33.710 1.00 0.00 H ATOM 169 N SER A 11 39.138 29.519 31.807 1.00 30.72 N ATOM 170 CA SER A 11 38.867 30.353 30.632 1.00 24.02 C ATOM 171 C SER A 11 37.430 30.189 30.134 1.00 24.41 C ATOM 172 O SER A 11 36.776 29.180 30.402 1.00 26.52 O ATOM 173 CB SER A 11 39.828 30.008 29.493 1.00 23.63 C ATOM 174 OG SER A 11 39.511 28.747 28.918 1.00 20.96 O ATOM 175 HA SER A 11 39.012 31.388 30.941 1.00 0.00 H ATOM 176 HB2 SER A 11 40.845 29.976 29.883 1.00 0.00 H ATOM 177 HB3 SER A 11 39.759 30.777 28.724 1.00 0.00 H ATOM 178 HG SER A 11 39.576 28.044 29.612 1.00 0.00 H ATOM 179 H SER A 11 38.523 28.699 31.986 1.00 0.00 H ATOM 180 N GLN A 12 36.952 31.187 29.400 1.00 28.53 N ATOM 181 CA GLN A 12 35.602 31.161 28.856 1.00 37.61 C ATOM 182 C GLN A 12 35.447 32.060 27.628 1.00 40.02 C ATOM 183 O GLN A 12 36.180 33.035 27.463 1.00 49.01 O ATOM 184 CB GLN A 12 34.555 31.509 29.936 1.00 32.03 C ATOM 185 CG GLN A 12 34.749 32.842 30.666 1.00 34.25 C ATOM 186 CD GLN A 12 33.905 32.938 31.938 1.00 39.65 C ATOM 187 OE1 GLN A 12 32.921 32.221 32.092 1.00 34.82 O ATOM 188 NE2 GLN A 12 34.303 33.807 32.860 1.00 46.08 N ATOM 189 HA GLN A 12 35.420 30.139 28.523 1.00 0.00 H ATOM 190 HB2 GLN A 12 33.577 31.533 29.455 1.00 0.00 H ATOM 191 HB3 GLN A 12 34.572 30.716 30.683 1.00 0.00 H ATOM 192 HG2 GLN A 12 35.800 32.945 30.935 1.00 0.00 H ATOM 193 HG3 GLN A 12 34.466 33.653 29.995 1.00 0.00 H ATOM 194 HE22 GLN A 12 35.143 34.397 32.691 1.00 0.00 H ATOM 195 HE21 GLN A 12 33.775 33.898 33.751 1.00 0.00 H ATOM 196 H GLN A 12 37.559 32.010 29.209 1.00 0.00 H ATOM 197 N GLU A 13 34.532 31.684 26.741 1.00 39.00 N ATOM 198 CA GLU A 13 34.260 32.440 25.530 1.00 38.33 C ATOM 199 C GLU A 13 32.786 32.785 25.476 1.00 39.17 C ATOM 200 O GLU A 13 31.938 31.962 25.840 1.00 36.11 O ATOM 201 CB GLU A 13 34.547 31.601 24.299 1.00 51.94 C ATOM 202 CG GLU A 13 35.947 31.104 24.138 1.00 66.19 C ATOM 203 CD GLU A 13 36.053 30.212 22.919 1.00 77.77 C ATOM 204 OE1 GLU A 13 35.761 30.702 21.803 1.00 80.79 O ATOM 205 OE2 GLU A 13 36.394 29.018 23.082 1.00 84.17 O ATOM 206 HA GLU A 13 34.888 33.330 25.545 1.00 0.00 H ATOM 207 HB2 GLU A 13 33.889 30.732 24.330 1.00 0.00 H ATOM 208 HB3 GLU A 13 34.308 32.205 23.424 1.00 0.00 H ATOM 209 HG2 GLU A 13 36.619 31.954 24.021 1.00 0.00 H ATOM 210 HG3 GLU A 13 36.231 30.537 25.024 1.00 0.00 H ATOM 211 H GLU A 13 33.989 30.815 26.920 1.00 0.00 H ATOM 212 N ASN A 14 32.490 33.973 24.958 1.00 35.56 N ATOM 213 CA ASN A 14 31.121 34.466 24.788 1.00 32.06 C ATOM 214 C ASN A 14 30.283 34.593 26.052 1.00 30.37 C ATOM 215 O ASN A 14 29.073 34.373 26.030 1.00 31.73 O ATOM 216 CB ASN A 14 30.375 33.640 23.738 1.00 34.35 C ATOM 217 CG ASN A 14 31.083 33.635 22.409 1.00 36.12 C ATOM 218 OD1 ASN A 14 31.608 34.655 21.979 1.00 34.39 O ATOM 219 ND2 ASN A 14 31.148 32.475 21.773 1.00 44.41 N ATOM 220 HA ASN A 14 31.255 35.494 24.451 1.00 0.00 H ATOM 221 HB2 ASN A 14 30.290 32.613 24.094 1.00 0.00 H ATOM 222 HB3 ASN A 14 29.378 34.061 23.603 1.00 0.00 H ATOM 223 HD22 ASN A 14 30.687 31.634 22.176 1.00 0.00 H ATOM 224 HD21 ASN A 14 31.660 32.405 20.871 1.00 0.00 H ATOM 225 H ASN A 14 33.274 34.586 24.657 1.00 0.00 H ATOM 226 N PHE A 15 30.927 34.975 27.143 1.00 26.89 N ATOM 227 CA PHE A 15 30.241 35.165 28.405 1.00 29.66 C ATOM 228 C PHE A 15 29.273 36.357 28.304 1.00 34.62 C ATOM 229 O PHE A 15 28.085 36.234 28.636 1.00 36.58 O ATOM 230 CB PHE A 15 31.272 35.395 29.520 1.00 17.84 C ATOM 231 CG PHE A 15 30.673 35.860 30.817 1.00 24.13 C ATOM 232 CD1 PHE A 15 30.157 34.939 31.732 1.00 22.36 C ATOM 233 CD2 PHE A 15 30.618 37.225 31.127 1.00 21.19 C ATOM 234 CE1 PHE A 15 29.589 35.369 32.949 1.00 23.02 C ATOM 235 CE2 PHE A 15 30.051 37.666 32.333 1.00 24.03 C ATOM 236 CZ PHE A 15 29.536 36.731 33.247 1.00 21.78 C ATOM 237 HA PHE A 15 29.661 34.273 28.642 1.00 0.00 H ATOM 238 HB2 PHE A 15 31.797 34.457 29.701 1.00 0.00 H ATOM 239 HB3 PHE A 15 31.983 36.148 29.180 1.00 0.00 H ATOM 240 HD2 PHE A 15 31.020 37.954 30.423 1.00 0.00 H ATOM 241 HE2 PHE A 15 30.010 38.731 32.560 1.00 0.00 H ATOM 242 HZ PHE A 15 29.097 37.069 34.186 1.00 0.00 H ATOM 243 HE1 PHE A 15 29.192 34.639 33.655 1.00 0.00 H ATOM 244 HD1 PHE A 15 30.194 33.874 31.502 1.00 0.00 H ATOM 245 H PHE A 15 31.952 35.143 27.093 1.00 0.00 H ATOM 246 N GLU A 16 29.764 37.485 27.790 1.00 38.48 N ATOM 247 CA GLU A 16 28.950 38.698 27.674 1.00 39.62 C ATOM 248 C GLU A 16 27.723 38.612 26.772 1.00 35.92 C ATOM 249 O GLU A 16 26.624 38.940 27.208 1.00 34.27 O ATOM 250 CB GLU A 16 29.809 39.900 27.301 1.00 48.78 C ATOM 251 CG GLU A 16 29.206 41.213 27.744 1.00 64.51 C ATOM 252 CD GLU A 16 30.217 42.340 27.762 1.00 73.68 C ATOM 253 OE1 GLU A 16 31.201 42.253 28.538 1.00 76.13 O ATOM 254 OE2 GLU A 16 30.023 43.313 27.002 1.00 79.56 O ATOM 255 HA GLU A 16 28.534 38.824 28.674 1.00 0.00 H ATOM 256 HB2 GLU A 16 30.786 39.789 27.771 1.00 0.00 H ATOM 257 HB3 GLU A 16 29.929 39.920 26.218 1.00 0.00 H ATOM 258 HG2 GLU A 16 28.401 41.477 27.059 1.00 0.00 H ATOM 259 HG3 GLU A 16 28.801 41.091 28.749 1.00 0.00 H ATOM 260 H GLU A 16 30.751 37.505 27.463 1.00 0.00 H ATOM 261 N PRO A 17 27.888 38.164 25.508 1.00 34.19 N ATOM 262 CA PRO A 17 26.751 38.048 24.583 1.00 30.68 C ATOM 263 C PRO A 17 25.693 37.086 25.118 1.00 37.19 C ATOM 264 O PRO A 17 24.507 37.410 25.142 1.00 42.53 O ATOM 265 CB PRO A 17 27.392 37.474 23.317 1.00 30.27 C ATOM 266 CG PRO A 17 28.802 37.934 23.390 1.00 33.03 C ATOM 267 CD PRO A 17 29.140 37.760 24.847 1.00 30.85 C ATOM 268 HA PRO A 17 26.239 38.998 24.427 1.00 0.00 H ATOM 269 HD3 PRO A 17 29.390 36.724 25.074 1.00 0.00 H ATOM 270 HD2 PRO A 17 29.968 38.405 25.141 1.00 0.00 H ATOM 271 HG3 PRO A 17 28.890 38.978 23.089 1.00 0.00 H ATOM 272 HG2 PRO A 17 29.448 37.320 22.762 1.00 0.00 H ATOM 273 HB2 PRO A 17 27.339 36.385 23.314 1.00 0.00 H ATOM 274 HB3 PRO A 17 26.903 37.863 22.424 1.00 0.00 H ATOM 275 N PHE A 18 26.132 35.910 25.565 1.00 37.90 N ATOM 276 CA PHE A 18 25.231 34.891 26.098 1.00 33.78 C ATOM 277 C PHE A 18 24.488 35.406 27.318 1.00 33.43 C ATOM 278 O PHE A 18 23.263 35.281 27.406 1.00 34.42 O ATOM 279 CB PHE A 18 26.004 33.617 26.469 1.00 26.84 C ATOM 280 CG PHE A 18 25.120 32.467 26.890 1.00 25.18 C ATOM 281 CD1 PHE A 18 24.622 31.570 25.939 1.00 14.69 C ATOM 282 CD2 PHE A 18 24.771 32.287 28.235 1.00 28.37 C ATOM 283 CE1 PHE A 18 23.789 30.514 26.310 1.00 19.44 C ATOM 284 CE2 PHE A 18 23.932 31.228 28.627 1.00 24.72 C ATOM 285 CZ PHE A 18 23.441 30.342 27.663 1.00 25.40 C ATOM 286 HA PHE A 18 24.508 34.654 25.318 1.00 0.00 H ATOM 287 HB2 PHE A 18 26.586 33.304 25.602 1.00 0.00 H ATOM 288 HB3 PHE A 18 26.678 33.852 27.293 1.00 0.00 H ATOM 289 HD2 PHE A 18 25.154 32.976 28.987 1.00 0.00 H ATOM 290 HE2 PHE A 18 23.666 31.099 29.676 1.00 0.00 H ATOM 291 HZ PHE A 18 22.790 29.519 27.959 1.00 0.00 H ATOM 292 HE1 PHE A 18 23.409 29.825 25.555 1.00 0.00 H ATOM 293 HD1 PHE A 18 24.889 31.698 24.890 1.00 0.00 H ATOM 294 H PHE A 18 27.152 35.710 25.533 1.00 0.00 H ATOM 295 N MET A 19 25.228 35.991 28.253 1.00 34.27 N ATOM 296 CA MET A 19 24.634 36.505 29.474 1.00 31.62 C ATOM 297 C MET A 19 23.644 37.621 29.167 1.00 32.27 C ATOM 298 O MET A 19 22.561 37.683 29.761 1.00 25.89 O ATOM 299 CB MET A 19 25.725 36.958 30.436 1.00 29.65 C ATOM 300 CG MET A 19 25.769 36.144 31.725 1.00 39.01 C ATOM 301 SD MET A 19 25.737 34.347 31.512 1.00 42.70 S ATOM 302 CE MET A 19 24.152 33.975 32.068 1.00 40.33 C ATOM 303 HA MET A 19 24.073 35.707 29.959 1.00 0.00 H ATOM 304 HB2 MET A 19 26.689 36.866 29.935 1.00 0.00 H ATOM 305 HB3 MET A 19 25.549 38.003 30.692 1.00 0.00 H ATOM 306 HG2 MET A 19 24.908 36.426 32.331 1.00 0.00 H ATOM 307 HG3 MET A 19 26.685 36.403 32.255 1.00 0.00 H ATOM 308 HE1 MET A 19 24.049 34.291 33.106 1.00 0.00 H ATOM 309 HE2 MET A 19 23.420 34.499 31.453 1.00 0.00 H ATOM 310 HE3 MET A 19 23.986 32.900 31.996 1.00 0.00 H ATOM 311 H MET A 19 26.254 36.083 28.108 1.00 0.00 H ATOM 312 N LYS A 20 23.985 38.435 28.173 1.00 36.24 N ATOM 313 CA LYS A 20 23.121 39.528 27.731 1.00 41.75 C ATOM 314 C LYS A 20 21.769 38.967 27.282 1.00 43.21 C ATOM 315 O LYS A 20 20.719 39.371 27.795 1.00 51.46 O ATOM 316 CB LYS A 20 23.772 40.288 26.573 1.00 35.11 C ATOM 317 CG LYS A 20 24.071 41.752 26.864 1.00 43.06 C ATOM 318 CD LYS A 20 24.903 42.397 25.751 1.00 50.28 C ATOM 319 CE LYS A 20 26.319 41.828 25.702 1.00 59.98 C ATOM 320 NZ LYS A 20 27.185 42.459 24.657 1.00 65.53 N ATOM 321 HA LYS A 20 22.972 40.216 28.563 1.00 0.00 H ATOM 322 HB2 LYS A 20 24.710 39.792 26.325 1.00 0.00 H ATOM 323 HB3 LYS A 20 23.101 40.242 25.716 1.00 0.00 H ATOM 324 HG2 LYS A 20 23.129 42.292 26.959 1.00 0.00 H ATOM 325 HG3 LYS A 20 24.623 41.820 27.801 1.00 0.00 H ATOM 326 HD2 LYS A 20 24.415 42.214 24.794 1.00 0.00 H ATOM 327 HD3 LYS A 20 24.960 43.471 25.929 1.00 0.00 H ATOM 328 HE2 LYS A 20 26.254 40.760 25.496 1.00 0.00 H ATOM 329 HE3 LYS A 20 26.786 41.982 26.675 1.00 0.00 H ATOM 330 HZ1 LYS A 20 26.759 42.312 23.720 1.00 0.00 H ATOM 331 HZ2 LYS A 20 27.267 43.479 24.845 1.00 0.00 H ATOM 332 HZ3 LYS A 20 28.129 42.024 24.682 1.00 0.00 H ATOM 333 H LYS A 20 24.897 38.289 27.694 1.00 0.00 H ATOM 334 N ALA A 21 21.799 38.005 26.360 1.00 41.03 N ATOM 335 CA ALA A 21 20.574 37.380 25.847 1.00 34.36 C ATOM 336 C ALA A 21 19.801 36.604 26.912 1.00 31.72 C ATOM 337 O ALA A 21 18.664 36.202 26.681 1.00 29.30 O ATOM 338 CB ALA A 21 20.890 36.474 24.668 1.00 36.15 C ATOM 339 HA ALA A 21 19.929 38.196 25.521 1.00 0.00 H ATOM 340 HB1 ALA A 21 21.348 37.062 23.872 1.00 0.00 H ATOM 341 HB2 ALA A 21 21.580 35.692 24.987 1.00 0.00 H ATOM 342 HB3 ALA A 21 19.969 36.021 24.303 1.00 0.00 H ATOM 343 H ALA A 21 22.719 37.687 25.993 1.00 0.00 H ATOM 344 N MET A 22 20.427 36.359 28.059 1.00 31.29 N ATOM 345 CA MET A 22 19.758 35.651 29.138 1.00 31.07 C ATOM 346 C MET A 22 19.028 36.603 30.058 1.00 31.15 C ATOM 347 O MET A 22 18.224 36.177 30.882 1.00 31.98 O ATOM 348 CB MET A 22 20.732 34.786 29.931 1.00 31.67 C ATOM 349 CG MET A 22 20.991 33.461 29.267 1.00 34.98 C ATOM 350 SD MET A 22 19.454 32.797 28.561 1.00 52.52 S ATOM 351 CE MET A 22 18.608 32.173 30.054 1.00 36.36 C ATOM 352 HA MET A 22 19.021 34.994 28.676 1.00 0.00 H ATOM 353 HB2 MET A 22 21.677 35.320 30.028 1.00 0.00 H ATOM 354 HB3 MET A 22 20.315 34.606 30.922 1.00 0.00 H ATOM 355 HG2 MET A 22 21.381 32.759 30.004 1.00 0.00 H ATOM 356 HG3 MET A 22 21.724 33.595 28.471 1.00 0.00 H ATOM 357 HE1 MET A 22 19.228 31.413 30.530 1.00 0.00 H ATOM 358 HE2 MET A 22 18.443 32.997 30.748 1.00 0.00 H ATOM 359 HE3 MET A 22 17.650 31.737 29.772 1.00 0.00 H ATOM 360 H MET A 22 21.409 36.678 28.186 1.00 0.00 H ATOM 361 N GLY A 23 19.289 37.895 29.893 1.00 37.52 N ATOM 362 CA GLY A 23 18.634 38.897 30.715 1.00 43.97 C ATOM 363 C GLY A 23 19.310 39.127 32.053 1.00 48.99 C ATOM 364 O GLY A 23 18.690 39.612 32.999 1.00 53.39 O ATOM 365 HA3 GLY A 23 17.609 38.575 30.898 1.00 0.00 H ATOM 366 HA2 GLY A 23 18.625 39.839 30.167 1.00 0.00 H ATOM 367 H GLY A 23 19.971 38.193 29.166 1.00 0.00 H ATOM 368 N LEU A 24 20.577 38.744 32.151 1.00 46.98 N ATOM 369 CA LEU A 24 21.323 38.940 33.380 1.00 40.48 C ATOM 370 C LEU A 24 21.604 40.441 33.348 1.00 36.67 C ATOM 371 O LEU A 24 22.028 40.968 32.324 1.00 39.26 O ATOM 372 CB LEU A 24 22.613 38.107 33.321 1.00 40.65 C ATOM 373 CG LEU A 24 23.462 37.717 34.542 1.00 35.32 C ATOM 374 CD1 LEU A 24 24.511 38.741 34.806 1.00 35.97 C ATOM 375 CD2 LEU A 24 22.622 37.462 35.773 1.00 37.57 C ATOM 376 HA LEU A 24 20.811 38.633 34.292 1.00 0.00 H ATOM 377 HB2 LEU A 24 22.331 37.166 32.849 1.00 0.00 H ATOM 378 HB3 LEU A 24 23.285 38.656 32.662 1.00 0.00 H ATOM 379 HG LEU A 24 23.954 36.775 34.301 1.00 0.00 H ATOM 380 HD21 LEU A 24 22.065 38.365 36.025 1.00 0.00 H ATOM 381 HD22 LEU A 24 21.925 36.648 35.574 1.00 0.00 H ATOM 382 HD23 LEU A 24 23.272 37.190 36.605 1.00 0.00 H ATOM 383 HD11 LEU A 24 25.163 38.824 33.936 1.00 0.00 H ATOM 384 HD12 LEU A 24 24.037 39.703 35.000 1.00 0.00 H ATOM 385 HD13 LEU A 24 25.098 38.442 35.674 1.00 0.00 H ATOM 386 H LEU A 24 21.042 38.297 31.335 1.00 0.00 H ATOM 387 N PRO A 25 21.264 41.161 34.426 1.00 36.88 N ATOM 388 CA PRO A 25 21.487 42.609 34.496 1.00 37.96 C ATOM 389 C PRO A 25 22.926 43.067 34.311 1.00 40.97 C ATOM 390 O PRO A 25 23.848 42.593 34.966 1.00 45.78 O ATOM 391 CB PRO A 25 20.926 42.981 35.870 1.00 35.41 C ATOM 392 CG PRO A 25 21.018 41.705 36.648 1.00 42.56 C ATOM 393 CD PRO A 25 20.600 40.675 35.644 1.00 39.89 C ATOM 394 HA PRO A 25 20.999 43.115 33.663 1.00 0.00 H ATOM 395 HD3 PRO A 25 20.955 39.682 35.921 1.00 0.00 H ATOM 396 HD2 PRO A 25 19.517 40.652 35.525 1.00 0.00 H ATOM 397 HG3 PRO A 25 20.343 41.717 37.504 1.00 0.00 H ATOM 398 HG2 PRO A 25 22.037 41.527 36.993 1.00 0.00 H ATOM 399 HB2 PRO A 25 21.524 43.764 36.335 1.00 0.00 H ATOM 400 HB3 PRO A 25 19.891 43.314 35.791 1.00 0.00 H ATOM 401 N GLU A 26 23.078 44.013 33.397 1.00 49.17 N ATOM 402 CA GLU A 26 24.341 44.632 33.004 1.00 54.86 C ATOM 403 C GLU A 26 25.482 44.616 34.020 1.00 56.87 C ATOM 404 O GLU A 26 26.564 44.100 33.744 1.00 57.02 O ATOM 405 CB GLU A 26 24.085 46.085 32.579 1.00 67.33 C ATOM 406 CG GLU A 26 22.701 46.373 31.950 1.00 80.44 C ATOM 407 CD GLU A 26 21.549 46.501 32.970 1.00 84.03 C ATOM 408 OE1 GLU A 26 21.787 46.468 34.205 1.00 83.22 O ATOM 409 OE2 GLU A 26 20.390 46.638 32.520 1.00 82.94 O ATOM 410 HA GLU A 26 24.694 43.998 32.190 1.00 0.00 H ATOM 411 HB2 GLU A 26 24.188 46.714 33.463 1.00 0.00 H ATOM 412 HB3 GLU A 26 24.847 46.359 31.849 1.00 0.00 H ATOM 413 HG2 GLU A 26 22.768 47.307 31.392 1.00 0.00 H ATOM 414 HG3 GLU A 26 22.462 45.559 31.266 1.00 0.00 H ATOM 415 H GLU A 26 22.219 44.346 32.915 1.00 0.00 H ATOM 416 N ASP A 27 25.252 45.222 35.179 1.00 60.55 N ATOM 417 CA ASP A 27 26.276 45.295 36.212 1.00 63.20 C ATOM 418 C ASP A 27 26.829 43.934 36.612 1.00 59.61 C ATOM 419 O ASP A 27 28.042 43.787 36.769 1.00 62.47 O ATOM 420 CB ASP A 27 25.783 46.090 37.433 1.00 74.87 C ATOM 421 CG ASP A 27 24.420 45.627 37.937 1.00 89.38 C ATOM 422 OD1 ASP A 27 23.395 45.897 37.260 1.00 92.51 O ATOM 423 OD2 ASP A 27 24.377 45.010 39.028 1.00 95.16 O ATOM 424 HA ASP A 27 27.113 45.837 35.772 1.00 0.00 H ATOM 425 HB2 ASP A 27 26.508 45.975 38.238 1.00 0.00 H ATOM 426 HB3 ASP A 27 25.712 47.142 37.157 1.00 0.00 H ATOM 427 H ASP A 27 24.322 45.653 35.353 1.00 0.00 H ATOM 428 N LEU A 28 25.958 42.937 36.747 1.00 53.39 N ATOM 429 CA LEU A 28 26.412 41.597 37.098 1.00 46.89 C ATOM 430 C LEU A 28 27.281 41.074 35.972 1.00 42.12 C ATOM 431 O LEU A 28 28.314 40.470 36.224 1.00 45.72 O ATOM 432 CB LEU A 28 25.248 40.627 37.311 1.00 42.91 C ATOM 433 CG LEU A 28 24.359 40.762 38.538 1.00 47.45 C ATOM 434 CD1 LEU A 28 23.493 39.517 38.651 1.00 36.65 C ATOM 435 CD2 LEU A 28 25.222 40.918 39.774 1.00 52.16 C ATOM 436 HA LEU A 28 26.965 41.663 38.035 1.00 0.00 H ATOM 437 HB2 LEU A 28 24.599 40.718 36.440 1.00 0.00 H ATOM 438 HB3 LEU A 28 25.675 39.625 37.340 1.00 0.00 H ATOM 439 HG LEU A 28 23.721 41.641 38.447 1.00 0.00 H ATOM 440 HD21 LEU A 28 25.861 40.041 39.883 1.00 0.00 H ATOM 441 HD22 LEU A 28 25.841 41.810 39.673 1.00 0.00 H ATOM 442 HD23 LEU A 28 24.583 41.015 40.652 1.00 0.00 H ATOM 443 HD11 LEU A 28 22.878 39.421 37.756 1.00 0.00 H ATOM 444 HD12 LEU A 28 24.132 38.639 38.750 1.00 0.00 H ATOM 445 HD13 LEU A 28 22.850 39.601 39.527 1.00 0.00 H ATOM 446 H LEU A 28 24.944 43.116 36.601 1.00 0.00 H ATOM 447 N ILE A 29 26.870 41.306 34.730 1.00 34.69 N ATOM 448 CA ILE A 29 27.657 40.852 33.597 1.00 34.20 C ATOM 449 C ILE A 29 29.046 41.446 33.747 1.00 36.00 C ATOM 450 O ILE A 29 30.040 40.737 33.636 1.00 38.89 O ATOM 451 CB ILE A 29 27.068 41.318 32.258 1.00 37.48 C ATOM 452 CG1 ILE A 29 25.687 40.705 32.046 1.00 42.84 C ATOM 453 CG2 ILE A 29 28.001 40.948 31.097 1.00 36.21 C ATOM 454 CD1 ILE A 29 25.008 41.164 30.755 1.00 49.91 C ATOM 455 HA ILE A 29 27.668 39.762 33.590 1.00 0.00 H ATOM 456 HB ILE A 29 26.969 42.403 32.285 1.00 0.00 H ATOM 457 HG12 ILE A 29 25.792 39.620 32.014 1.00 0.00 H ATOM 458 HG13 ILE A 29 25.053 40.983 32.888 1.00 0.00 H ATOM 459 HD11 ILE A 29 24.886 42.247 30.776 1.00 0.00 H ATOM 460 HD12 ILE A 29 25.625 40.883 29.902 1.00 0.00 H ATOM 461 HD13 ILE A 29 24.031 40.688 30.671 1.00 0.00 H ATOM 462 HG21 ILE A 29 28.969 41.428 31.243 1.00 0.00 H ATOM 463 HG22 ILE A 29 28.131 39.866 31.068 1.00 0.00 H ATOM 464 HG23 ILE A 29 27.563 41.288 30.158 1.00 0.00 H ATOM 465 H ILE A 29 25.978 41.816 34.568 1.00 0.00 H ATOM 466 N GLN A 30 29.101 42.738 34.050 1.00 39.34 N ATOM 467 CA GLN A 30 30.373 43.429 34.209 1.00 49.84 C ATOM 468 C GLN A 30 31.213 42.829 35.322 1.00 46.80 C ATOM 469 O GLN A 30 32.416 42.634 35.162 1.00 45.41 O ATOM 470 CB GLN A 30 30.148 44.922 34.470 1.00 58.58 C ATOM 471 CG GLN A 30 29.630 45.690 33.260 1.00 78.68 C ATOM 472 CD GLN A 30 30.580 45.637 32.062 1.00 86.47 C ATOM 473 OE1 GLN A 30 31.618 46.304 32.040 1.00 89.65 O ATOM 474 NE2 GLN A 30 30.215 44.848 31.054 1.00 91.93 N ATOM 475 HA GLN A 30 30.922 43.306 33.275 1.00 0.00 H ATOM 476 HB2 GLN A 30 29.423 45.024 35.277 1.00 0.00 H ATOM 477 HB3 GLN A 30 31.096 45.364 34.777 1.00 0.00 H ATOM 478 HG2 GLN A 30 28.672 45.263 32.962 1.00 0.00 H ATOM 479 HG3 GLN A 30 29.489 46.733 33.545 1.00 0.00 H ATOM 480 HE22 GLN A 30 29.331 44.303 31.114 1.00 0.00 H ATOM 481 HE21 GLN A 30 30.813 44.777 30.206 1.00 0.00 H ATOM 482 H GLN A 30 28.215 43.268 34.177 1.00 0.00 H ATOM 483 N LYS A 31 30.556 42.508 36.431 1.00 45.79 N ATOM 484 CA LYS A 31 31.220 41.926 37.590 1.00 46.24 C ATOM 485 C LYS A 31 31.676 40.489 37.364 1.00 44.93 C ATOM 486 O LYS A 31 32.862 40.180 37.509 1.00 53.75 O ATOM 487 CB LYS A 31 30.304 42.014 38.817 1.00 50.44 C ATOM 488 CG LYS A 31 30.120 43.441 39.348 1.00 57.41 C ATOM 489 CD LYS A 31 28.758 43.667 40.010 1.00 60.05 C ATOM 490 CE LYS A 31 28.540 42.798 41.239 1.00 65.14 C ATOM 491 NZ LYS A 31 29.496 43.098 42.341 1.00 70.14 N ATOM 492 HA LYS A 31 32.125 42.509 37.762 1.00 0.00 H ATOM 493 HB2 LYS A 31 29.325 41.619 38.545 1.00 0.00 H ATOM 494 HB3 LYS A 31 30.733 41.404 39.612 1.00 0.00 H ATOM 495 HG2 LYS A 31 30.900 43.641 40.083 1.00 0.00 H ATOM 496 HG3 LYS A 31 30.220 44.137 38.515 1.00 0.00 H ATOM 497 HD2 LYS A 31 28.686 44.713 40.307 1.00 0.00 H ATOM 498 HD3 LYS A 31 27.977 43.443 39.283 1.00 0.00 H ATOM 499 HE2 LYS A 31 28.658 41.753 40.951 1.00 0.00 H ATOM 500 HE3 LYS A 31 27.526 42.961 41.604 1.00 0.00 H ATOM 501 HZ1 LYS A 31 30.468 42.937 42.008 1.00 0.00 H ATOM 502 HZ2 LYS A 31 29.387 44.091 42.632 1.00 0.00 H ATOM 503 HZ3 LYS A 31 29.298 42.475 43.150 1.00 0.00 H ATOM 504 H LYS A 31 29.531 42.678 36.473 1.00 0.00 H ATOM 505 N GLY A 32 30.745 39.617 36.990 1.00 39.23 N ATOM 506 CA GLY A 32 31.054 38.213 36.763 1.00 31.19 C ATOM 507 C GLY A 32 31.912 37.983 35.547 1.00 31.72 C ATOM 508 O GLY A 32 32.419 36.884 35.318 1.00 30.70 O ATOM 509 HA3 GLY A 32 30.118 37.668 36.635 1.00 0.00 H ATOM 510 HA2 GLY A 32 31.580 37.828 37.636 1.00 0.00 H ATOM 511 H GLY A 32 29.768 39.947 36.856 1.00 0.00 H ATOM 512 N LYS A 33 32.027 39.018 34.733 1.00 35.10 N ATOM 513 CA LYS A 33 32.833 38.976 33.532 1.00 38.37 C ATOM 514 C LYS A 33 34.277 38.644 33.884 1.00 36.77 C ATOM 515 O LYS A 33 34.944 37.905 33.168 1.00 41.63 O ATOM 516 CB LYS A 33 32.752 40.339 32.840 1.00 44.62 C ATOM 517 CG LYS A 33 33.746 40.594 31.720 1.00 59.20 C ATOM 518 CD LYS A 33 33.516 41.972 31.068 1.00 63.77 C ATOM 519 CE LYS A 33 33.358 43.103 32.102 1.00 67.62 C ATOM 520 NZ LYS A 33 34.514 43.308 33.030 1.00 64.30 N ATOM 521 HA LYS A 33 32.460 38.203 32.860 1.00 0.00 H ATOM 522 HB2 LYS A 33 31.750 40.439 32.422 1.00 0.00 H ATOM 523 HB3 LYS A 33 32.906 41.105 33.600 1.00 0.00 H ATOM 524 HG2 LYS A 33 34.757 40.558 32.127 1.00 0.00 H ATOM 525 HG3 LYS A 33 33.633 39.819 30.962 1.00 0.00 H ATOM 526 HD2 LYS A 33 34.368 42.201 30.428 1.00 0.00 H ATOM 527 HD3 LYS A 33 32.611 41.924 30.463 1.00 0.00 H ATOM 528 HE2 LYS A 33 32.479 42.882 32.707 1.00 0.00 H ATOM 529 HE3 LYS A 33 33.198 44.033 31.557 1.00 0.00 H ATOM 530 HZ1 LYS A 33 34.678 42.438 33.575 1.00 0.00 H ATOM 531 HZ2 LYS A 33 35.364 43.537 32.477 1.00 0.00 H ATOM 532 HZ3 LYS A 33 34.300 44.091 33.680 1.00 0.00 H ATOM 533 H LYS A 33 31.519 39.896 34.964 1.00 0.00 H ATOM 534 N ASP A 34 34.753 39.123 35.072 1.00 37.39 N ATOM 535 CA ASP A 34 36.172 38.973 35.399 1.00 36.56 C ATOM 536 C ASP A 34 36.264 38.090 36.637 1.00 38.41 C ATOM 537 O ASP A 34 37.435 38.023 37.207 1.00 45.36 O ATOM 538 CB ASP A 34 36.782 40.351 35.676 1.00 36.86 C ATOM 539 CG ASP A 34 35.815 41.314 36.369 1.00 31.49 C ATOM 540 OD1 ASP A 34 35.266 40.981 37.488 1.00 39.23 O ATOM 541 OD2 ASP A 34 35.550 42.457 35.835 1.00 31.14 O ATOM 542 HA ASP A 34 36.720 38.520 34.573 1.00 0.00 H ATOM 543 HB2 ASP A 34 37.657 40.221 36.313 1.00 0.00 H ATOM 544 HB3 ASP A 34 37.088 40.791 34.727 1.00 0.00 H ATOM 545 H ASP A 34 34.110 39.592 35.741 1.00 0.00 H ATOM 546 N ILE A 35 35.287 37.377 37.115 1.00 33.64 N ATOM 547 CA ILE A 35 35.414 36.501 38.281 1.00 26.75 C ATOM 548 C ILE A 35 35.636 35.048 37.844 1.00 25.71 C ATOM 549 O ILE A 35 34.936 34.529 36.977 1.00 30.31 O ATOM 550 CB ILE A 35 34.183 36.606 39.231 1.00 20.28 C ATOM 551 CG1 ILE A 35 34.119 38.008 39.858 1.00 21.45 C ATOM 552 CG2 ILE A 35 34.277 35.557 40.339 1.00 9.31 C ATOM 553 CD1 ILE A 35 32.905 38.251 40.755 1.00 15.23 C ATOM 554 HA ILE A 35 36.286 36.837 38.843 1.00 0.00 H ATOM 555 HB ILE A 35 33.280 36.429 38.647 1.00 0.00 H ATOM 556 HG12 ILE A 35 35.018 38.154 40.456 1.00 0.00 H ATOM 557 HG13 ILE A 35 34.098 38.741 39.051 1.00 0.00 H ATOM 558 HD11 ILE A 35 31.993 38.124 40.172 1.00 0.00 H ATOM 559 HD12 ILE A 35 32.914 37.537 41.578 1.00 0.00 H ATOM 560 HD13 ILE A 35 32.945 39.265 41.152 1.00 0.00 H ATOM 561 HG21 ILE A 35 34.300 34.562 39.895 1.00 0.00 H ATOM 562 HG22 ILE A 35 35.187 35.720 40.916 1.00 0.00 H ATOM 563 HG23 ILE A 35 33.410 35.643 40.994 1.00 0.00 H ATOM 564 H ILE A 35 34.363 37.432 36.642 1.00 0.00 H ATOM 565 N LYS A 36 36.679 34.429 38.379 1.00 25.16 N ATOM 566 CA LYS A 36 36.985 33.042 38.061 1.00 21.62 C ATOM 567 C LYS A 36 36.272 32.222 39.110 1.00 16.00 C ATOM 568 O LYS A 36 36.837 31.890 40.140 1.00 18.39 O ATOM 569 CB LYS A 36 38.497 32.803 38.099 1.00 23.63 C ATOM 570 CG LYS A 36 39.138 32.642 36.719 1.00 26.43 C ATOM 571 CD LYS A 36 38.906 33.858 35.851 1.00 37.60 C ATOM 572 CE LYS A 36 39.323 33.620 34.399 1.00 50.01 C ATOM 573 NZ LYS A 36 40.784 33.332 34.245 1.00 51.84 N ATOM 574 HA LYS A 36 36.658 32.770 37.057 1.00 0.00 H ATOM 575 HB2 LYS A 36 38.966 33.651 38.598 1.00 0.00 H ATOM 576 HB3 LYS A 36 38.686 31.896 38.673 1.00 0.00 H ATOM 577 HG2 LYS A 36 40.211 32.495 36.842 1.00 0.00 H ATOM 578 HG3 LYS A 36 38.707 31.769 36.228 1.00 0.00 H ATOM 579 HD2 LYS A 36 37.846 34.110 35.875 1.00 0.00 H ATOM 580 HD3 LYS A 36 39.485 34.691 36.251 1.00 0.00 H ATOM 581 HE2 LYS A 36 39.082 34.511 33.819 1.00 0.00 H ATOM 582 HE3 LYS A 36 38.759 32.771 34.011 1.00 0.00 H ATOM 583 HZ1 LYS A 36 41.335 34.139 34.603 1.00 0.00 H ATOM 584 HZ2 LYS A 36 41.027 32.478 34.786 1.00 0.00 H ATOM 585 HZ3 LYS A 36 41.002 33.180 33.240 1.00 0.00 H ATOM 586 H LYS A 36 37.292 34.946 39.041 1.00 0.00 H ATOM 587 N GLY A 37 34.996 31.975 38.860 1.00 19.24 N ATOM 588 CA GLY A 37 34.164 31.229 39.787 1.00 21.61 C ATOM 589 C GLY A 37 34.564 29.806 40.115 1.00 19.50 C ATOM 590 O GLY A 37 35.228 29.130 39.333 1.00 23.51 O ATOM 591 HA3 GLY A 37 33.159 31.195 39.366 1.00 0.00 H ATOM 592 HA2 GLY A 37 34.144 31.785 40.725 1.00 0.00 H ATOM 593 H GLY A 37 34.578 32.325 37.975 1.00 0.00 H ATOM 594 N VAL A 38 34.126 29.355 41.282 1.00 17.43 N ATOM 595 CA VAL A 38 34.418 28.020 41.773 1.00 17.09 C ATOM 596 C VAL A 38 33.117 27.230 41.786 1.00 16.79 C ATOM 597 O VAL A 38 32.078 27.772 42.143 1.00 22.20 O ATOM 598 CB VAL A 38 35.012 28.098 43.202 1.00 13.57 C ATOM 599 CG1 VAL A 38 35.082 26.726 43.839 1.00 15.29 C ATOM 600 CG2 VAL A 38 36.394 28.727 43.151 1.00 20.22 C ATOM 601 HA VAL A 38 35.149 27.530 41.129 1.00 0.00 H ATOM 602 HB VAL A 38 34.357 28.718 43.814 1.00 0.00 H ATOM 603 HG11 VAL A 38 34.079 26.304 43.900 1.00 0.00 H ATOM 604 HG12 VAL A 38 35.714 26.077 43.233 1.00 0.00 H ATOM 605 HG13 VAL A 38 35.503 26.813 44.841 1.00 0.00 H ATOM 606 HG21 VAL A 38 37.045 28.120 42.522 1.00 0.00 H ATOM 607 HG22 VAL A 38 36.319 29.732 42.736 1.00 0.00 H ATOM 608 HG23 VAL A 38 36.806 28.779 44.159 1.00 0.00 H ATOM 609 H VAL A 38 33.547 29.986 41.873 1.00 0.00 H ATOM 610 N SER A 39 33.167 25.981 41.336 1.00 18.33 N ATOM 611 CA SER A 39 31.995 25.101 41.305 1.00 18.81 C ATOM 612 C SER A 39 32.290 23.841 42.101 1.00 17.35 C ATOM 613 O SER A 39 33.339 23.227 41.932 1.00 23.15 O ATOM 614 CB SER A 39 31.643 24.727 39.865 1.00 13.54 C ATOM 615 OG SER A 39 31.234 25.874 39.127 1.00 27.39 O ATOM 616 HA SER A 39 31.148 25.627 41.745 1.00 0.00 H ATOM 617 HB2 SER A 39 30.831 24.000 39.873 1.00 0.00 H ATOM 618 HB3 SER A 39 32.518 24.288 39.386 1.00 0.00 H ATOM 619 HG SER A 39 31.970 26.536 39.113 1.00 0.00 H ATOM 620 H SER A 39 34.076 25.612 40.991 1.00 0.00 H ATOM 621 N GLU A 40 31.389 23.479 43.002 1.00 17.44 N ATOM 622 CA GLU A 40 31.582 22.292 43.809 1.00 25.74 C ATOM 623 C GLU A 40 30.500 21.270 43.522 1.00 26.31 C ATOM 624 O GLU A 40 29.310 21.595 43.553 1.00 22.74 O ATOM 625 CB GLU A 40 31.593 22.649 45.285 1.00 32.02 C ATOM 626 CG GLU A 40 31.869 21.460 46.187 1.00 55.27 C ATOM 627 CD GLU A 40 32.294 21.853 47.596 1.00 68.61 C ATOM 628 OE1 GLU A 40 32.058 23.015 48.004 1.00 73.41 O ATOM 629 OE2 GLU A 40 32.869 20.984 48.296 1.00 78.05 O ATOM 630 HA GLU A 40 32.546 21.855 43.550 1.00 0.00 H ATOM 631 HB2 GLU A 40 32.366 23.399 45.454 1.00 0.00 H ATOM 632 HB3 GLU A 40 30.621 23.065 45.548 1.00 0.00 H ATOM 633 HG2 GLU A 40 30.962 20.860 46.255 1.00 0.00 H ATOM 634 HG3 GLU A 40 32.665 20.864 45.740 1.00 0.00 H ATOM 635 H GLU A 40 30.532 24.054 43.131 1.00 0.00 H ATOM 636 N ILE A 41 30.923 20.046 43.217 1.00 21.96 N ATOM 637 CA ILE A 41 30.011 18.954 42.909 1.00 23.10 C ATOM 638 C ILE A 41 30.087 17.815 43.929 1.00 29.24 C ATOM 639 O ILE A 41 31.165 17.443 44.394 1.00 34.37 O ATOM 640 CB ILE A 41 30.311 18.371 41.510 1.00 17.79 C ATOM 641 CG1 ILE A 41 30.140 19.460 40.445 1.00 27.88 C ATOM 642 CG2 ILE A 41 29.396 17.187 41.213 1.00 16.56 C ATOM 643 CD1 ILE A 41 30.562 19.040 39.055 1.00 30.52 C ATOM 644 HA ILE A 41 29.009 19.381 42.941 1.00 0.00 H ATOM 645 HB ILE A 41 31.342 18.016 41.492 1.00 0.00 H ATOM 646 HG12 ILE A 41 29.088 19.744 40.412 1.00 0.00 H ATOM 647 HG13 ILE A 41 30.739 20.322 40.738 1.00 0.00 H ATOM 648 HD11 ILE A 41 31.616 18.764 39.065 1.00 0.00 H ATOM 649 HD12 ILE A 41 29.964 18.185 38.738 1.00 0.00 H ATOM 650 HD13 ILE A 41 30.408 19.869 38.364 1.00 0.00 H ATOM 651 HG21 ILE A 41 29.555 16.410 41.961 1.00 0.00 H ATOM 652 HG22 ILE A 41 28.357 17.516 41.243 1.00 0.00 H ATOM 653 HG23 ILE A 41 29.625 16.792 40.223 1.00 0.00 H ATOM 654 H ILE A 41 31.946 19.862 43.198 1.00 0.00 H ATOM 655 N VAL A 42 28.926 17.297 44.304 1.00 33.32 N ATOM 656 CA VAL A 42 28.835 16.173 45.217 1.00 31.85 C ATOM 657 C VAL A 42 27.916 15.224 44.473 1.00 33.61 C ATOM 658 O VAL A 42 26.725 15.493 44.319 1.00 33.54 O ATOM 659 CB VAL A 42 28.239 16.572 46.564 1.00 37.68 C ATOM 660 CG1 VAL A 42 28.103 15.346 47.436 1.00 39.97 C ATOM 661 CG2 VAL A 42 29.138 17.597 47.249 1.00 31.41 C ATOM 662 HA VAL A 42 29.807 15.746 45.464 1.00 0.00 H ATOM 663 HB VAL A 42 27.256 17.015 46.405 1.00 0.00 H ATOM 664 HG11 VAL A 42 27.448 14.625 46.947 1.00 0.00 H ATOM 665 HG12 VAL A 42 29.086 14.900 47.590 1.00 0.00 H ATOM 666 HG13 VAL A 42 27.677 15.631 48.398 1.00 0.00 H ATOM 667 HG21 VAL A 42 30.126 17.164 47.407 1.00 0.00 H ATOM 668 HG22 VAL A 42 29.225 18.482 46.618 1.00 0.00 H ATOM 669 HG23 VAL A 42 28.704 17.875 48.209 1.00 0.00 H ATOM 670 H VAL A 42 28.048 17.711 43.930 1.00 0.00 H ATOM 671 N HIS A 43 28.506 14.159 43.939 1.00 35.56 N ATOM 672 CA HIS A 43 27.802 13.170 43.129 1.00 39.35 C ATOM 673 C HIS A 43 27.600 11.857 43.862 1.00 42.93 C ATOM 674 O HIS A 43 28.568 11.193 44.224 1.00 43.59 O ATOM 675 CB HIS A 43 28.624 12.910 41.867 1.00 39.08 C ATOM 676 CG HIS A 43 27.937 12.061 40.847 1.00 45.56 C ATOM 677 ND1 HIS A 43 28.586 11.564 39.734 1.00 43.54 N ATOM 678 CD2 HIS A 43 26.647 11.662 40.739 1.00 49.85 C ATOM 679 CE1 HIS A 43 27.725 10.900 38.985 1.00 52.48 C ATOM 680 NE2 HIS A 43 26.543 10.944 39.570 1.00 52.18 N ATOM 681 HA HIS A 43 26.815 13.568 42.893 1.00 0.00 H ATOM 682 HB2 HIS A 43 28.859 13.871 41.409 1.00 0.00 H ATOM 683 HB3 HIS A 43 29.549 12.412 42.159 1.00 0.00 H ATOM 684 HD2 HIS A 43 25.843 11.870 41.445 1.00 0.00 H ATOM 685 HE1 HIS A 43 27.952 10.400 38.043 1.00 0.00 H ATOM 686 H HIS A 43 29.523 14.023 44.107 1.00 0.00 H ATOM 687 N GLU A 44 26.345 11.468 44.047 1.00 45.65 N ATOM 688 CA GLU A 44 26.026 10.214 44.717 1.00 51.56 C ATOM 689 C GLU A 44 24.923 9.490 43.943 1.00 52.96 C ATOM 690 O GLU A 44 23.740 9.774 44.117 1.00 47.24 O ATOM 691 CB GLU A 44 25.589 10.476 46.157 1.00 58.34 C ATOM 692 CG GLU A 44 26.597 11.272 46.973 1.00 69.30 C ATOM 693 CD GLU A 44 26.667 10.828 48.427 1.00 79.59 C ATOM 694 OE1 GLU A 44 26.833 9.608 48.671 1.00 84.06 O ATOM 695 OE2 GLU A 44 26.573 11.699 49.323 1.00 83.60 O ATOM 696 HA GLU A 44 26.915 9.584 44.743 1.00 0.00 H ATOM 697 HB2 GLU A 44 24.651 11.030 46.136 1.00 0.00 H ATOM 698 HB3 GLU A 44 25.431 9.516 46.648 1.00 0.00 H ATOM 699 HG2 GLU A 44 27.583 11.149 46.524 1.00 0.00 H ATOM 700 HG3 GLU A 44 26.315 12.324 46.944 1.00 0.00 H ATOM 701 H GLU A 44 25.571 12.073 43.706 1.00 0.00 H ATOM 702 N GLY A 45 25.315 8.562 43.075 1.00 53.99 N ATOM 703 CA GLY A 45 24.339 7.838 42.281 1.00 56.30 C ATOM 704 C GLY A 45 23.726 8.763 41.249 1.00 56.84 C ATOM 705 O GLY A 45 24.447 9.332 40.428 1.00 59.46 O ATOM 706 HA3 GLY A 45 23.555 7.454 42.934 1.00 0.00 H ATOM 707 HA2 GLY A 45 24.829 7.006 41.775 1.00 0.00 H ATOM 708 H GLY A 45 26.328 8.353 42.964 1.00 0.00 H ATOM 709 N LYS A 46 22.403 8.903 41.268 1.00 58.71 N ATOM 710 CA LYS A 46 21.711 9.800 40.337 1.00 57.33 C ATOM 711 C LYS A 46 21.497 11.173 40.989 1.00 51.45 C ATOM 712 O LYS A 46 20.832 12.040 40.429 1.00 45.49 O ATOM 713 CB LYS A 46 20.358 9.218 39.917 1.00 64.01 C ATOM 714 CG LYS A 46 20.421 8.089 38.901 1.00 72.67 C ATOM 715 CD LYS A 46 19.013 7.728 38.421 1.00 81.99 C ATOM 716 CE LYS A 46 19.022 6.768 37.229 1.00 88.07 C ATOM 717 NZ LYS A 46 19.462 5.377 37.565 1.00 91.04 N ATOM 718 HA LYS A 46 22.334 9.910 39.449 1.00 0.00 H ATOM 719 HB2 LYS A 46 19.862 8.839 40.811 1.00 0.00 H ATOM 720 HB3 LYS A 46 19.763 10.024 39.488 1.00 0.00 H ATOM 721 HG2 LYS A 46 21.022 8.405 38.048 1.00 0.00 H ATOM 722 HG3 LYS A 46 20.879 7.214 39.363 1.00 0.00 H ATOM 723 HD2 LYS A 46 18.474 7.258 39.243 1.00 0.00 H ATOM 724 HD3 LYS A 46 18.499 8.643 38.128 1.00 0.00 H ATOM 725 HE2 LYS A 46 19.698 7.167 36.473 1.00 0.00 H ATOM 726 HE3 LYS A 46 18.012 6.719 36.822 1.00 0.00 H ATOM 727 HZ1 LYS A 46 20.430 5.403 37.944 1.00 0.00 H ATOM 728 HZ2 LYS A 46 18.820 4.974 38.277 1.00 0.00 H ATOM 729 HZ3 LYS A 46 19.440 4.791 36.706 1.00 0.00 H ATOM 730 H LYS A 46 21.846 8.363 41.960 1.00 0.00 H ATOM 731 N LYS A 47 22.055 11.349 42.182 1.00 47.06 N ATOM 732 CA LYS A 47 21.935 12.585 42.937 1.00 44.70 C ATOM 733 C LYS A 47 23.144 13.475 42.722 1.00 45.89 C ATOM 734 O LYS A 47 24.279 13.095 43.029 1.00 46.82 O ATOM 735 CB LYS A 47 21.774 12.274 44.430 1.00 48.76 C ATOM 736 CG LYS A 47 21.883 13.476 45.376 1.00 57.38 C ATOM 737 CD LYS A 47 20.522 13.973 45.865 1.00 67.59 C ATOM 738 CE LYS A 47 19.677 14.569 44.749 1.00 75.24 C ATOM 739 NZ LYS A 47 20.360 15.717 44.079 1.00 78.81 N ATOM 740 HA LYS A 47 21.052 13.116 42.581 1.00 0.00 H ATOM 741 HB2 LYS A 47 20.793 11.822 44.574 1.00 0.00 H ATOM 742 HB3 LYS A 47 22.547 11.558 44.708 1.00 0.00 H ATOM 743 HG2 LYS A 47 22.479 13.185 46.241 1.00 0.00 H ATOM 744 HG3 LYS A 47 22.382 14.289 44.849 1.00 0.00 H ATOM 745 HD2 LYS A 47 19.981 13.134 46.302 1.00 0.00 H ATOM 746 HD3 LYS A 47 20.683 14.736 46.626 1.00 0.00 H ATOM 747 HE2 LYS A 47 18.734 14.918 45.170 1.00 0.00 H ATOM 748 HE3 LYS A 47 19.479 13.796 44.007 1.00 0.00 H ATOM 749 HZ1 LYS A 47 20.547 16.464 44.778 1.00 0.00 H ATOM 750 HZ2 LYS A 47 21.258 15.392 43.668 1.00 0.00 H ATOM 751 HZ3 LYS A 47 19.748 16.091 43.326 1.00 0.00 H ATOM 752 H LYS A 47 22.602 10.567 42.594 1.00 0.00 H ATOM 753 N VAL A 48 22.894 14.660 42.183 1.00 46.68 N ATOM 754 CA VAL A 48 23.951 15.622 41.940 1.00 45.75 C ATOM 755 C VAL A 48 23.645 16.876 42.740 1.00 42.94 C ATOM 756 O VAL A 48 22.590 17.489 42.571 1.00 41.37 O ATOM 757 CB VAL A 48 24.056 15.990 40.444 1.00 46.54 C ATOM 758 CG1 VAL A 48 25.228 16.932 40.222 1.00 41.03 C ATOM 759 CG2 VAL A 48 24.205 14.732 39.596 1.00 44.01 C ATOM 760 HA VAL A 48 24.901 15.181 42.242 1.00 0.00 H ATOM 761 HB VAL A 48 23.141 16.497 40.139 1.00 0.00 H ATOM 762 HG11 VAL A 48 25.078 17.840 40.806 1.00 0.00 H ATOM 763 HG12 VAL A 48 26.150 16.444 40.538 1.00 0.00 H ATOM 764 HG13 VAL A 48 25.293 17.185 39.164 1.00 0.00 H ATOM 765 HG21 VAL A 48 25.107 14.199 39.895 1.00 0.00 H ATOM 766 HG22 VAL A 48 23.336 14.091 39.744 1.00 0.00 H ATOM 767 HG23 VAL A 48 24.278 15.011 38.545 1.00 0.00 H ATOM 768 H VAL A 48 21.916 14.905 41.928 1.00 0.00 H ATOM 769 N LYS A 49 24.551 17.211 43.648 1.00 41.68 N ATOM 770 CA LYS A 49 24.430 18.392 44.491 1.00 43.36 C ATOM 771 C LYS A 49 25.441 19.392 43.918 1.00 38.21 C ATOM 772 O LYS A 49 26.642 19.154 43.988 1.00 39.97 O ATOM 773 CB LYS A 49 24.805 18.014 45.919 1.00 51.92 C ATOM 774 CG LYS A 49 24.167 18.861 46.991 1.00 66.72 C ATOM 775 CD LYS A 49 24.545 18.347 48.376 1.00 77.82 C ATOM 776 CE LYS A 49 24.131 16.889 48.580 1.00 82.04 C ATOM 777 NZ LYS A 49 24.638 16.336 49.876 1.00 84.07 N ATOM 778 HA LYS A 49 23.422 18.807 44.507 1.00 0.00 H ATOM 779 HB2 LYS A 49 24.508 16.978 46.084 1.00 0.00 H ATOM 780 HB3 LYS A 49 25.887 18.100 46.019 1.00 0.00 H ATOM 781 HG2 LYS A 49 24.508 19.891 46.885 1.00 0.00 H ATOM 782 HG3 LYS A 49 23.083 18.825 46.879 1.00 0.00 H ATOM 783 HD2 LYS A 49 25.625 18.427 48.498 1.00 0.00 H ATOM 784 HD3 LYS A 49 24.049 18.962 49.127 1.00 0.00 H ATOM 785 HE2 LYS A 49 24.532 16.291 47.761 1.00 0.00 H ATOM 786 HE3 LYS A 49 23.043 16.828 48.573 1.00 0.00 H ATOM 787 HZ1 LYS A 49 25.677 16.383 49.889 1.00 0.00 H ATOM 788 HZ2 LYS A 49 24.254 16.896 50.664 1.00 0.00 H ATOM 789 HZ3 LYS A 49 24.334 15.346 49.972 1.00 0.00 H ATOM 790 H LYS A 49 25.386 16.602 43.763 1.00 0.00 H ATOM 791 N LEU A 50 24.953 20.487 43.337 1.00 33.97 N ATOM 792 CA LEU A 50 25.803 21.505 42.707 1.00 30.42 C ATOM 793 C LEU A 50 25.816 22.903 43.356 1.00 29.14 C ATOM 794 O LEU A 50 24.773 23.536 43.520 1.00 35.37 O ATOM 795 CB LEU A 50 25.395 21.636 41.233 1.00 34.26 C ATOM 796 CG LEU A 50 26.027 22.753 40.399 1.00 32.31 C ATOM 797 CD1 LEU A 50 27.534 22.560 40.335 1.00 35.22 C ATOM 798 CD2 LEU A 50 25.425 22.747 39.002 1.00 38.19 C ATOM 799 HA LEU A 50 26.822 21.141 42.841 1.00 0.00 H ATOM 800 HB2 LEU A 50 25.639 20.692 40.746 1.00 0.00 H ATOM 801 HB3 LEU A 50 24.316 21.787 41.209 1.00 0.00 H ATOM 802 HG LEU A 50 25.823 23.717 40.865 1.00 0.00 H ATOM 803 HD21 LEU A 50 25.620 21.785 38.528 1.00 0.00 H ATOM 804 HD22 LEU A 50 24.349 22.909 39.071 1.00 0.00 H ATOM 805 HD23 LEU A 50 25.876 23.543 38.410 1.00 0.00 H ATOM 806 HD11 LEU A 50 27.946 22.586 41.344 1.00 0.00 H ATOM 807 HD12 LEU A 50 27.756 21.597 39.876 1.00 0.00 H ATOM 808 HD13 LEU A 50 27.976 23.359 39.740 1.00 0.00 H ATOM 809 H LEU A 50 23.923 20.627 43.329 1.00 0.00 H ATOM 810 N THR A 51 27.003 23.414 43.655 1.00 29.24 N ATOM 811 CA THR A 51 27.137 24.737 44.252 1.00 24.66 C ATOM 812 C THR A 51 28.121 25.604 43.453 1.00 27.18 C ATOM 813 O THR A 51 29.257 25.204 43.223 1.00 29.57 O ATOM 814 CB THR A 51 27.595 24.628 45.720 1.00 27.98 C ATOM 815 OG1 THR A 51 26.595 23.933 46.472 1.00 37.46 O ATOM 816 CG2 THR A 51 27.826 25.999 46.333 1.00 22.54 C ATOM 817 HA THR A 51 26.158 25.216 44.226 1.00 0.00 H ATOM 818 HB THR A 51 28.539 24.083 45.746 1.00 0.00 H ATOM 819 HG1 THR A 51 26.469 23.027 46.093 1.00 0.00 H ATOM 820 HG23 THR A 51 28.588 26.528 45.760 1.00 0.00 H ATOM 821 HG21 THR A 51 26.895 26.566 46.313 1.00 0.00 H ATOM 822 HG22 THR A 51 28.160 25.883 47.364 1.00 0.00 H ATOM 823 H THR A 51 27.859 22.857 43.459 1.00 0.00 H ATOM 824 N ILE A 52 27.658 26.770 43.001 1.00 25.92 N ATOM 825 CA ILE A 52 28.478 27.707 42.235 1.00 22.14 C ATOM 826 C ILE A 52 28.660 29.003 43.027 1.00 23.49 C ATOM 827 O ILE A 52 27.687 29.613 43.495 1.00 18.97 O ATOM 828 CB ILE A 52 27.858 28.002 40.846 1.00 20.41 C ATOM 829 CG1 ILE A 52 27.769 26.698 40.041 1.00 24.41 C ATOM 830 CG2 ILE A 52 28.708 29.019 40.086 1.00 24.90 C ATOM 831 CD1 ILE A 52 27.033 26.803 38.720 1.00 32.66 C ATOM 832 HA ILE A 52 29.452 27.248 42.067 1.00 0.00 H ATOM 833 HB ILE A 52 26.860 28.418 40.985 1.00 0.00 H ATOM 834 HG12 ILE A 52 28.784 26.358 39.835 1.00 0.00 H ATOM 835 HG13 ILE A 52 27.257 25.957 40.655 1.00 0.00 H ATOM 836 HD11 ILE A 52 26.008 27.127 38.901 1.00 0.00 H ATOM 837 HD12 ILE A 52 27.537 27.529 38.081 1.00 0.00 H ATOM 838 HD13 ILE A 52 27.027 25.829 38.231 1.00 0.00 H ATOM 839 HG21 ILE A 52 28.759 29.947 40.656 1.00 0.00 H ATOM 840 HG22 ILE A 52 29.713 28.620 39.948 1.00 0.00 H ATOM 841 HG23 ILE A 52 28.257 29.213 39.113 1.00 0.00 H ATOM 842 H ILE A 52 26.670 27.024 43.202 1.00 0.00 H ATOM 843 N THR A 53 29.919 29.377 43.229 1.00 22.28 N ATOM 844 CA THR A 53 30.265 30.574 43.978 1.00 21.47 C ATOM 845 C THR A 53 31.008 31.579 43.117 1.00 24.89 C ATOM 846 O THR A 53 32.052 31.269 42.541 1.00 26.00 O ATOM 847 CB THR A 53 31.132 30.220 45.184 1.00 18.00 C ATOM 848 OG1 THR A 53 30.463 29.229 45.971 1.00 20.98 O ATOM 849 CG2 THR A 53 31.372 31.444 46.037 1.00 21.09 C ATOM 850 HA THR A 53 29.330 31.023 44.312 1.00 0.00 H ATOM 851 HB THR A 53 32.089 29.838 44.830 1.00 0.00 H ATOM 852 HG1 THR A 53 30.312 28.420 45.421 1.00 0.00 H ATOM 853 HG23 THR A 53 31.881 32.204 45.445 1.00 0.00 H ATOM 854 HG21 THR A 53 30.416 31.834 46.387 1.00 0.00 H ATOM 855 HG22 THR A 53 31.991 31.173 46.893 1.00 0.00 H ATOM 856 H THR A 53 30.685 28.792 42.837 1.00 0.00 H ATOM 857 N TYR A 54 30.443 32.772 43.003 1.00 25.60 N ATOM 858 CA TYR A 54 31.044 33.842 42.233 1.00 24.35 C ATOM 859 C TYR A 54 31.230 35.008 43.179 1.00 26.40 C ATOM 860 O TYR A 54 30.328 35.821 43.371 1.00 27.00 O ATOM 861 CB TYR A 54 30.156 34.232 41.052 1.00 20.35 C ATOM 862 CG TYR A 54 30.616 33.633 39.749 1.00 18.07 C ATOM 863 CD1 TYR A 54 30.361 32.291 39.438 1.00 22.97 C ATOM 864 CD2 TYR A 54 31.325 34.402 38.826 1.00 25.00 C ATOM 865 CE1 TYR A 54 30.803 31.732 38.233 1.00 16.93 C ATOM 866 CE2 TYR A 54 31.769 33.856 37.626 1.00 26.18 C ATOM 867 CZ TYR A 54 31.503 32.523 37.335 1.00 27.59 C ATOM 868 OH TYR A 54 31.921 32.008 36.137 1.00 34.19 O ATOM 869 HA TYR A 54 31.999 33.528 41.813 1.00 0.00 H ATOM 870 HB3 TYR A 54 30.161 35.318 40.957 1.00 0.00 H ATOM 871 HB2 TYR A 54 29.140 33.891 41.253 1.00 0.00 H ATOM 872 HD2 TYR A 54 31.535 35.448 39.049 1.00 0.00 H ATOM 873 HE2 TYR A 54 32.323 34.471 36.917 1.00 0.00 H ATOM 874 HE1 TYR A 54 30.599 30.686 38.003 1.00 0.00 H ATOM 875 HD1 TYR A 54 29.810 31.672 40.146 1.00 0.00 H ATOM 876 HH TYR A 54 31.659 31.055 36.079 1.00 0.00 H ATOM 877 H TYR A 54 29.537 32.946 43.483 1.00 0.00 H ATOM 878 N GLY A 55 32.402 35.054 43.798 1.00 23.99 N ATOM 879 CA GLY A 55 32.694 36.104 44.741 1.00 29.47 C ATOM 880 C GLY A 55 31.765 35.945 45.917 1.00 34.33 C ATOM 881 O GLY A 55 31.835 34.953 46.643 1.00 37.94 O ATOM 882 HA3 GLY A 55 32.536 37.076 44.273 1.00 0.00 H ATOM 883 HA2 GLY A 55 33.729 36.026 45.074 1.00 0.00 H ATOM 884 H GLY A 55 33.117 34.325 43.601 1.00 0.00 H ATOM 885 N SER A 56 30.846 36.886 46.066 1.00 39.59 N ATOM 886 CA SER A 56 29.902 36.840 47.169 1.00 45.01 C ATOM 887 C SER A 56 28.555 36.230 46.793 1.00 43.97 C ATOM 888 O SER A 56 27.713 36.018 47.670 1.00 45.72 O ATOM 889 CB SER A 56 29.734 38.235 47.783 1.00 46.49 C ATOM 890 OG SER A 56 29.589 39.233 46.787 1.00 55.94 O ATOM 891 HA SER A 56 30.326 36.170 47.918 1.00 0.00 H ATOM 892 HB2 SER A 56 30.612 38.463 48.387 1.00 0.00 H ATOM 893 HB3 SER A 56 28.848 38.237 48.417 1.00 0.00 H ATOM 894 HG SER A 56 30.393 39.241 46.210 1.00 0.00 H ATOM 895 H SER A 56 30.799 37.669 45.384 1.00 0.00 H ATOM 896 N LYS A 57 28.348 35.955 45.504 1.00 39.04 N ATOM 897 CA LYS A 57 27.104 35.346 45.043 1.00 39.67 C ATOM 898 C LYS A 57 27.230 33.825 44.969 1.00 39.71 C ATOM 899 O LYS A 57 28.155 33.301 44.346 1.00 35.54 O ATOM 900 CB LYS A 57 26.677 35.908 43.687 1.00 45.98 C ATOM 901 CG LYS A 57 25.342 35.350 43.202 1.00 54.94 C ATOM 902 CD LYS A 57 24.730 36.204 42.099 1.00 70.40 C ATOM 903 CE LYS A 57 23.354 35.677 41.698 1.00 79.11 C ATOM 904 NZ LYS A 57 22.640 36.564 40.725 1.00 86.24 N ATOM 905 HA LYS A 57 26.333 35.594 45.772 1.00 0.00 H ATOM 906 HB2 LYS A 57 26.591 36.991 43.772 1.00 0.00 H ATOM 907 HB3 LYS A 57 27.444 35.662 42.952 1.00 0.00 H ATOM 908 HG2 LYS A 57 25.501 34.342 42.819 1.00 0.00 H ATOM 909 HG3 LYS A 57 24.650 35.313 44.043 1.00 0.00 H ATOM 910 HD2 LYS A 57 24.629 37.229 42.456 1.00 0.00 H ATOM 911 HD3 LYS A 57 25.386 36.186 41.229 1.00 0.00 H ATOM 912 HE2 LYS A 57 22.743 35.586 42.596 1.00 0.00 H ATOM 913 HE3 LYS A 57 23.479 34.694 41.243 1.00 0.00 H ATOM 914 HZ1 LYS A 57 22.505 37.504 41.149 1.00 0.00 H ATOM 915 HZ2 LYS A 57 23.207 36.652 39.858 1.00 0.00 H ATOM 916 HZ3 LYS A 57 21.714 36.150 40.495 1.00 0.00 H ATOM 917 H LYS A 57 29.090 36.180 44.811 1.00 0.00 H ATOM 918 N VAL A 58 26.280 33.130 45.592 1.00 36.55 N ATOM 919 CA VAL A 58 26.252 31.672 45.650 1.00 33.56 C ATOM 920 C VAL A 58 24.902 31.141 45.184 1.00 31.70 C ATOM 921 O VAL A 58 23.865 31.702 45.514 1.00 36.11 O ATOM 922 CB VAL A 58 26.454 31.190 47.102 1.00 32.72 C ATOM 923 CG1 VAL A 58 26.451 29.669 47.183 1.00 28.64 C ATOM 924 CG2 VAL A 58 27.735 31.753 47.660 1.00 42.03 C ATOM 925 HA VAL A 58 27.050 31.305 45.004 1.00 0.00 H ATOM 926 HB VAL A 58 25.620 31.553 47.703 1.00 0.00 H ATOM 927 HG11 VAL A 58 25.496 29.289 46.819 1.00 0.00 H ATOM 928 HG12 VAL A 58 27.259 29.272 46.569 1.00 0.00 H ATOM 929 HG13 VAL A 58 26.595 29.361 48.219 1.00 0.00 H ATOM 930 HG21 VAL A 58 28.574 31.417 47.051 1.00 0.00 H ATOM 931 HG22 VAL A 58 27.688 32.842 47.647 1.00 0.00 H ATOM 932 HG23 VAL A 58 27.867 31.406 48.685 1.00 0.00 H ATOM 933 H VAL A 58 25.516 33.655 46.063 1.00 0.00 H ATOM 934 N ILE A 59 24.919 30.041 44.443 1.00 31.61 N ATOM 935 CA ILE A 59 23.700 29.413 43.953 1.00 27.82 C ATOM 936 C ILE A 59 23.760 27.928 44.279 1.00 24.11 C ATOM 937 O ILE A 59 24.749 27.261 43.994 1.00 23.58 O ATOM 938 CB ILE A 59 23.554 29.578 42.426 1.00 32.44 C ATOM 939 CG1 ILE A 59 23.525 31.063 42.055 1.00 39.62 C ATOM 940 CG2 ILE A 59 22.280 28.907 41.938 1.00 34.05 C ATOM 941 CD1 ILE A 59 23.559 31.329 40.555 1.00 40.04 C ATOM 942 HA ILE A 59 22.846 29.891 44.433 1.00 0.00 H ATOM 943 HB ILE A 59 24.411 29.104 41.947 1.00 0.00 H ATOM 944 HG12 ILE A 59 22.612 31.500 42.460 1.00 0.00 H ATOM 945 HG13 ILE A 59 24.390 31.547 42.509 1.00 0.00 H ATOM 946 HD11 ILE A 59 24.473 30.910 40.134 1.00 0.00 H ATOM 947 HD12 ILE A 59 22.693 30.863 40.085 1.00 0.00 H ATOM 948 HD13 ILE A 59 23.536 32.404 40.377 1.00 0.00 H ATOM 949 HG21 ILE A 59 22.315 27.844 42.178 1.00 0.00 H ATOM 950 HG22 ILE A 59 21.420 29.363 42.428 1.00 0.00 H ATOM 951 HG23 ILE A 59 22.194 29.034 40.859 1.00 0.00 H ATOM 952 H ILE A 59 25.836 29.612 44.203 1.00 0.00 H ATOM 953 N HIS A 60 22.711 27.414 44.902 1.00 33.42 N ATOM 954 CA HIS A 60 22.654 26.005 45.258 1.00 33.04 C ATOM 955 C HIS A 60 21.644 25.303 44.367 1.00 32.95 C ATOM 956 O HIS A 60 20.545 25.807 44.166 1.00 37.26 O ATOM 957 CB HIS A 60 22.231 25.835 46.715 1.00 37.08 C ATOM 958 CG HIS A 60 23.183 26.436 47.697 1.00 46.81 C ATOM 959 ND1 HIS A 60 24.256 25.740 48.213 1.00 51.60 N ATOM 960 CD2 HIS A 60 23.233 27.672 48.250 1.00 52.05 C ATOM 961 CE1 HIS A 60 24.930 26.525 49.041 1.00 52.85 C ATOM 962 NE2 HIS A 60 24.328 27.700 49.078 1.00 55.65 N ATOM 963 HA HIS A 60 23.645 25.571 45.123 1.00 0.00 H ATOM 964 HB2 HIS A 60 21.258 26.307 46.847 1.00 0.00 H ATOM 965 HB3 HIS A 60 22.148 24.769 46.926 1.00 0.00 H ATOM 966 HD2 HIS A 60 22.535 28.490 48.071 1.00 0.00 H ATOM 967 HE1 HIS A 60 25.827 26.249 49.596 1.00 0.00 H ATOM 968 H HIS A 60 21.910 28.032 45.142 1.00 0.00 H ATOM 969 N ASN A 61 22.024 24.153 43.824 1.00 29.25 N ATOM 970 CA ASN A 61 21.139 23.378 42.968 1.00 30.09 C ATOM 971 C ASN A 61 21.344 21.919 43.299 1.00 33.81 C ATOM 972 O ASN A 61 22.431 21.519 43.698 1.00 35.90 O ATOM 973 CB ASN A 61 21.410 23.636 41.491 1.00 30.45 C ATOM 974 CG ASN A 61 20.618 24.819 40.947 1.00 39.33 C ATOM 975 OD1 ASN A 61 19.388 24.809 40.950 1.00 38.05 O ATOM 976 ND2 ASN A 61 21.322 25.832 40.453 1.00 35.78 N ATOM 977 HA ASN A 61 20.106 23.674 43.149 1.00 0.00 H ATOM 978 HB2 ASN A 61 22.473 23.838 41.361 1.00 0.00 H ATOM 979 HB3 ASN A 61 21.139 22.745 40.925 1.00 0.00 H ATOM 980 HD22 ASN A 61 22.361 25.800 40.470 1.00 0.00 H ATOM 981 HD21 ASN A 61 20.834 26.657 40.049 1.00 0.00 H ATOM 982 H ASN A 61 22.982 23.796 44.016 1.00 0.00 H ATOM 983 N GLU A 62 20.282 21.134 43.177 1.00 38.19 N ATOM 984 CA GLU A 62 20.327 19.718 43.497 1.00 45.17 C ATOM 985 C GLU A 62 19.314 19.057 42.589 1.00 47.09 C ATOM 986 O GLU A 62 18.204 19.561 42.436 1.00 53.86 O ATOM 987 CB GLU A 62 19.913 19.512 44.953 1.00 50.06 C ATOM 988 CG GLU A 62 20.708 18.461 45.697 1.00 72.27 C ATOM 989 CD GLU A 62 20.363 18.405 47.180 1.00 80.94 C ATOM 990 OE1 GLU A 62 20.943 19.196 47.962 1.00 83.59 O ATOM 991 OE2 GLU A 62 19.514 17.570 47.562 1.00 86.44 O ATOM 992 HA GLU A 62 21.326 19.304 43.361 1.00 0.00 H ATOM 993 HB2 GLU A 62 20.031 20.461 45.477 1.00 0.00 H ATOM 994 HB3 GLU A 62 18.864 19.218 44.969 1.00 0.00 H ATOM 995 HG2 GLU A 62 20.501 17.487 45.253 1.00 0.00 H ATOM 996 HG3 GLU A 62 21.769 18.688 45.594 1.00 0.00 H ATOM 997 H GLU A 62 19.388 21.546 42.841 1.00 0.00 H ATOM 998 N PHE A 63 19.700 17.956 41.957 1.00 43.74 N ATOM 999 CA PHE A 63 18.793 17.250 41.058 1.00 40.53 C ATOM 1000 C PHE A 63 19.166 15.784 40.884 1.00 40.10 C ATOM 1001 O PHE A 63 20.278 15.358 41.232 1.00 36.08 O ATOM 1002 CB PHE A 63 18.722 17.945 39.690 1.00 43.03 C ATOM 1003 CG PHE A 63 20.065 18.204 39.068 1.00 46.24 C ATOM 1004 CD1 PHE A 63 20.704 17.216 38.317 1.00 44.54 C ATOM 1005 CD2 PHE A 63 20.694 19.437 39.234 1.00 43.70 C ATOM 1006 CE1 PHE A 63 21.946 17.448 37.741 1.00 46.90 C ATOM 1007 CE2 PHE A 63 21.942 19.683 38.661 1.00 48.39 C ATOM 1008 CZ PHE A 63 22.571 18.685 37.912 1.00 49.46 C ATOM 1009 HA PHE A 63 17.808 17.282 41.525 1.00 0.00 H ATOM 1010 HB2 PHE A 63 18.146 17.314 39.013 1.00 0.00 H ATOM 1011 HB3 PHE A 63 18.212 18.900 39.816 1.00 0.00 H ATOM 1012 HD2 PHE A 63 20.206 20.217 39.818 1.00 0.00 H ATOM 1013 HE2 PHE A 63 22.425 20.651 38.797 1.00 0.00 H ATOM 1014 HZ PHE A 63 23.546 18.871 37.463 1.00 0.00 H ATOM 1015 HE1 PHE A 63 22.432 16.666 37.157 1.00 0.00 H ATOM 1016 HD1 PHE A 63 20.221 16.248 38.181 1.00 0.00 H ATOM 1017 H PHE A 63 20.663 17.591 42.104 1.00 0.00 H ATOM 1018 N THR A 64 18.203 15.011 40.396 1.00 40.36 N ATOM 1019 CA THR A 64 18.396 13.592 40.163 1.00 38.11 C ATOM 1020 C THR A 64 18.414 13.336 38.664 1.00 34.45 C ATOM 1021 O THR A 64 17.520 13.763 37.933 1.00 28.55 O ATOM 1022 CB THR A 64 17.304 12.774 40.856 1.00 38.31 C ATOM 1023 OG1 THR A 64 17.367 13.025 42.266 1.00 43.26 O ATOM 1024 CG2 THR A 64 17.503 11.293 40.609 1.00 40.85 C ATOM 1025 HA THR A 64 19.349 13.278 40.588 1.00 0.00 H ATOM 1026 HB THR A 64 16.334 13.067 40.455 1.00 0.00 H ATOM 1027 HG1 THR A 64 16.664 12.500 42.725 1.00 0.00 H ATOM 1028 HG23 THR A 64 17.456 11.095 39.538 1.00 0.00 H ATOM 1029 HG21 THR A 64 18.477 10.989 40.994 1.00 0.00 H ATOM 1030 HG22 THR A 64 16.719 10.732 41.118 1.00 0.00 H ATOM 1031 H THR A 64 17.280 15.436 40.174 1.00 0.00 H ATOM 1032 N LEU A 65 19.489 12.707 38.211 1.00 37.47 N ATOM 1033 CA LEU A 65 19.674 12.396 36.802 1.00 41.76 C ATOM 1034 C LEU A 65 18.453 11.663 36.256 1.00 43.06 C ATOM 1035 O LEU A 65 17.991 10.686 36.849 1.00 42.64 O ATOM 1036 CB LEU A 65 20.947 11.560 36.622 1.00 40.81 C ATOM 1037 CG LEU A 65 22.245 12.234 37.089 1.00 42.18 C ATOM 1038 CD1 LEU A 65 23.377 11.230 37.165 1.00 42.74 C ATOM 1039 CD2 LEU A 65 22.603 13.372 36.143 1.00 38.25 C ATOM 1040 HA LEU A 65 19.785 13.323 36.239 1.00 0.00 H ATOM 1041 HB2 LEU A 65 20.826 10.635 37.186 1.00 0.00 H ATOM 1042 HB3 LEU A 65 21.050 11.327 35.562 1.00 0.00 H ATOM 1043 HG LEU A 65 22.089 12.639 38.089 1.00 0.00 H ATOM 1044 HD21 LEU A 65 22.743 12.976 35.137 1.00 0.00 H ATOM 1045 HD22 LEU A 65 21.797 14.105 36.137 1.00 0.00 H ATOM 1046 HD23 LEU A 65 23.525 13.846 36.480 1.00 0.00 H ATOM 1047 HD11 LEU A 65 23.116 10.443 37.872 1.00 0.00 H ATOM 1048 HD12 LEU A 65 23.542 10.795 36.179 1.00 0.00 H ATOM 1049 HD13 LEU A 65 24.285 11.733 37.498 1.00 0.00 H ATOM 1050 H LEU A 65 20.227 12.426 38.887 1.00 0.00 H ATOM 1051 N GLY A 66 17.898 12.184 35.167 1.00 45.49 N ATOM 1052 CA GLY A 66 16.735 11.568 34.553 1.00 53.77 C ATOM 1053 C GLY A 66 15.405 12.136 35.016 1.00 57.71 C ATOM 1054 O GLY A 66 14.418 12.086 34.278 1.00 59.15 O ATOM 1055 HA3 GLY A 66 16.750 10.503 34.785 1.00 0.00 H ATOM 1056 HA2 GLY A 66 16.807 11.704 33.474 1.00 0.00 H ATOM 1057 H GLY A 66 18.302 13.046 34.748 1.00 0.00 H ATOM 1058 N GLU A 67 15.381 12.683 36.229 1.00 62.31 N ATOM 1059 CA GLU A 67 14.176 13.270 36.808 1.00 65.64 C ATOM 1060 C GLU A 67 13.992 14.737 36.432 1.00 65.34 C ATOM 1061 O GLU A 67 14.966 15.477 36.260 1.00 64.40 O ATOM 1062 CB GLU A 67 14.235 13.181 38.330 1.00 73.06 C ATOM 1063 CG GLU A 67 13.349 12.138 38.962 1.00 86.29 C ATOM 1064 CD GLU A 67 13.270 12.320 40.468 1.00 94.82 C ATOM 1065 OE1 GLU A 67 12.529 13.222 40.922 1.00 96.46 O ATOM 1066 OE2 GLU A 67 13.965 11.582 41.197 1.00100.99 O ATOM 1067 HA GLU A 67 13.336 12.703 36.407 1.00 0.00 H ATOM 1068 HB2 GLU A 67 15.265 12.961 38.613 1.00 0.00 H ATOM 1069 HB3 GLU A 67 13.948 14.152 38.733 1.00 0.00 H ATOM 1070 HG2 GLU A 67 12.347 12.221 38.541 1.00 0.00 H ATOM 1071 HG3 GLU A 67 13.753 11.149 38.744 1.00 0.00 H ATOM 1072 H GLU A 67 16.258 12.693 36.788 1.00 0.00 H ATOM 1073 N GLU A 68 12.740 15.159 36.303 1.00 65.15 N ATOM 1074 CA GLU A 68 12.464 16.551 35.989 1.00 64.31 C ATOM 1075 C GLU A 68 12.555 17.276 37.306 1.00 62.45 C ATOM 1076 O GLU A 68 11.886 16.900 38.265 1.00 68.97 O ATOM 1077 CB GLU A 68 11.065 16.736 35.399 1.00 66.45 C ATOM 1078 CG GLU A 68 10.734 18.196 35.118 1.00 71.96 C ATOM 1079 CD GLU A 68 9.538 18.369 34.207 1.00 77.69 C ATOM 1080 OE1 GLU A 68 9.682 18.137 32.986 1.00 78.95 O ATOM 1081 OE2 GLU A 68 8.457 18.749 34.709 1.00 79.55 O ATOM 1082 HA GLU A 68 13.166 16.927 35.244 1.00 0.00 H ATOM 1083 HB2 GLU A 68 11.004 16.178 34.465 1.00 0.00 H ATOM 1084 HB3 GLU A 68 10.334 16.342 36.105 1.00 0.00 H ATOM 1085 HG2 GLU A 68 10.524 18.693 36.065 1.00 0.00 H ATOM 1086 HG3 GLU A 68 11.599 18.664 34.648 1.00 0.00 H ATOM 1087 H GLU A 68 11.953 14.491 36.427 1.00 0.00 H TER 1088 GLU A 68 ATOM 1089 N GLU A 70 13.571 21.332 39.364 1.00 58.37 N ATOM 1090 CA GLU A 70 13.518 22.773 39.220 1.00 59.72 C ATOM 1091 C GLU A 70 14.940 23.293 39.387 1.00 53.98 C ATOM 1092 O GLU A 70 15.586 23.048 40.406 1.00 51.77 O ATOM 1093 CB GLU A 70 12.568 23.384 40.258 1.00 69.87 C ATOM 1094 CG GLU A 70 12.165 24.830 39.952 1.00 87.05 C ATOM 1095 CD GLU A 70 10.663 25.097 40.114 1.00 93.01 C ATOM 1096 OE1 GLU A 70 10.175 25.113 41.268 1.00 97.35 O ATOM 1097 OE2 GLU A 70 9.974 25.311 39.086 1.00 91.82 O ATOM 1098 HA GLU A 70 13.130 23.055 38.241 1.00 0.00 H ATOM 1099 HB2 GLU A 70 11.664 22.776 40.297 1.00 0.00 H ATOM 1100 HB3 GLU A 70 13.061 23.363 41.230 1.00 0.00 H ATOM 1101 HG2 GLU A 70 12.707 25.490 40.629 1.00 0.00 H ATOM 1102 HG3 GLU A 70 12.446 25.056 38.924 1.00 0.00 H ATOM 1103 HN3 GLU A 70 13.941 21.092 40.306 1.00 0.00 H ATOM 1104 HN2 GLU A 70 14.195 20.935 38.633 1.00 0.00 H ATOM 1105 HN1 GLU A 70 12.614 20.939 39.256 1.00 0.00 H ATOM 1106 N LEU A 71 15.465 23.893 38.326 1.00 49.99 N ATOM 1107 CA LEU A 71 16.809 24.446 38.337 1.00 46.51 C ATOM 1108 C LEU A 71 16.740 25.944 38.544 1.00 45.62 C ATOM 1109 O LEU A 71 15.868 26.620 37.990 1.00 45.62 O ATOM 1110 CB LEU A 71 17.530 24.150 37.015 1.00 45.85 C ATOM 1111 CG LEU A 71 17.852 22.679 36.729 1.00 48.61 C ATOM 1112 CD1 LEU A 71 18.249 22.491 35.273 1.00 48.98 C ATOM 1113 CD2 LEU A 71 18.940 22.187 37.672 1.00 35.31 C ATOM 1114 HA LEU A 71 17.366 23.983 39.152 1.00 0.00 H ATOM 1115 HB2 LEU A 71 16.900 24.516 36.204 1.00 0.00 H ATOM 1116 HB3 LEU A 71 18.471 24.701 37.019 1.00 0.00 H ATOM 1117 HG LEU A 71 16.958 22.081 36.905 1.00 0.00 H ATOM 1118 HD21 LEU A 71 19.840 22.785 37.529 1.00 0.00 H ATOM 1119 HD22 LEU A 71 18.597 22.284 38.702 1.00 0.00 H ATOM 1120 HD23 LEU A 71 19.159 21.141 37.458 1.00 0.00 H ATOM 1121 HD11 LEU A 71 17.427 22.804 34.630 1.00 0.00 H ATOM 1122 HD12 LEU A 71 19.131 23.094 35.057 1.00 0.00 H ATOM 1123 HD13 LEU A 71 18.473 21.440 35.092 1.00 0.00 H ATOM 1124 H LEU A 71 14.896 23.970 37.459 1.00 0.00 H ATOM 1125 N GLU A 72 17.651 26.456 39.359 1.00 40.49 N ATOM 1126 CA GLU A 72 17.721 27.876 39.620 1.00 33.88 C ATOM 1127 C GLU A 72 18.777 28.472 38.684 1.00 37.30 C ATOM 1128 O GLU A 72 19.936 28.044 38.681 1.00 40.54 O ATOM 1129 CB GLU A 72 18.100 28.110 41.079 1.00 26.30 C ATOM 1130 CG GLU A 72 17.784 29.497 41.569 1.00 23.21 C ATOM 1131 CD GLU A 72 18.256 29.737 42.982 1.00 30.35 C ATOM 1132 OE1 GLU A 72 18.579 28.765 43.694 1.00 24.96 O ATOM 1133 OE2 GLU A 72 18.306 30.914 43.380 1.00 37.39 O ATOM 1134 HA GLU A 72 16.757 28.353 39.441 1.00 0.00 H ATOM 1135 HB2 GLU A 72 17.556 27.394 41.696 1.00 0.00 H ATOM 1136 HB3 GLU A 72 19.171 27.941 41.188 1.00 0.00 H ATOM 1137 HG2 GLU A 72 18.269 30.218 40.912 1.00 0.00 H ATOM 1138 HG3 GLU A 72 16.704 29.643 41.532 1.00 0.00 H ATOM 1139 H GLU A 72 18.332 25.821 39.822 1.00 0.00 H ATOM 1140 N THR A 73 18.358 29.400 37.832 1.00 40.41 N ATOM 1141 CA THR A 73 19.278 30.032 36.896 1.00 33.59 C ATOM 1142 C THR A 73 20.040 31.113 37.650 1.00 33.34 C ATOM 1143 O THR A 73 19.756 31.354 38.819 1.00 33.72 O ATOM 1144 CB THR A 73 18.525 30.649 35.712 1.00 33.18 C ATOM 1145 OG1 THR A 73 17.750 31.763 36.169 1.00 38.67 O ATOM 1146 CG2 THR A 73 17.602 29.620 35.087 1.00 33.47 C ATOM 1147 HA THR A 73 19.963 29.285 36.494 1.00 0.00 H ATOM 1148 HB THR A 73 19.247 30.981 34.966 1.00 0.00 H ATOM 1149 HG1 THR A 73 17.101 31.455 36.850 1.00 0.00 H ATOM 1150 HG23 THR A 73 18.190 28.771 34.738 1.00 0.00 H ATOM 1151 HG21 THR A 73 16.880 29.283 35.830 1.00 0.00 H ATOM 1152 HG22 THR A 73 17.076 30.070 34.245 1.00 0.00 H ATOM 1153 H THR A 73 17.356 29.680 37.833 1.00 0.00 H ATOM 1154 N MET A 74 20.978 31.777 36.982 1.00 38.60 N ATOM 1155 CA MET A 74 21.775 32.826 37.613 1.00 46.99 C ATOM 1156 C MET A 74 21.019 34.126 37.847 1.00 51.80 C ATOM 1157 O MET A 74 21.487 34.990 38.589 1.00 56.15 O ATOM 1158 CB MET A 74 23.041 33.118 36.810 1.00 54.21 C ATOM 1159 CG MET A 74 22.796 33.657 35.408 1.00 66.07 C ATOM 1160 SD MET A 74 22.347 32.375 34.216 1.00 76.60 S ATOM 1161 CE MET A 74 20.893 33.095 33.440 1.00 76.17 C ATOM 1162 HA MET A 74 22.035 32.427 38.593 1.00 0.00 H ATOM 1163 HB2 MET A 74 23.629 33.854 37.359 1.00 0.00 H ATOM 1164 HB3 MET A 74 23.609 32.192 36.723 1.00 0.00 H ATOM 1165 HG2 MET A 74 23.706 34.148 35.062 1.00 0.00 H ATOM 1166 HG3 MET A 74 21.987 34.386 35.454 1.00 0.00 H ATOM 1167 HE1 MET A 74 20.127 33.267 34.196 1.00 0.00 H ATOM 1168 HE2 MET A 74 21.163 34.042 32.973 1.00 0.00 H ATOM 1169 HE3 MET A 74 20.510 32.411 32.683 1.00 0.00 H ATOM 1170 H MET A 74 21.149 31.543 35.983 1.00 0.00 H ATOM 1171 N THR A 75 19.870 34.280 37.196 1.00 53.32 N ATOM 1172 CA THR A 75 19.060 35.487 37.356 1.00 54.46 C ATOM 1173 C THR A 75 18.198 35.388 38.613 1.00 58.34 C ATOM 1174 O THR A 75 17.794 36.402 39.192 1.00 58.44 O ATOM 1175 CB THR A 75 18.118 35.692 36.164 1.00 55.17 C ATOM 1176 OG1 THR A 75 17.216 34.579 36.072 1.00 59.44 O ATOM 1177 CG2 THR A 75 18.911 35.809 34.869 1.00 53.67 C ATOM 1178 HA THR A 75 19.753 36.326 37.427 1.00 0.00 H ATOM 1179 HB THR A 75 17.557 36.614 36.316 1.00 0.00 H ATOM 1180 HG1 THR A 75 17.734 33.745 35.945 1.00 0.00 H ATOM 1181 HG23 THR A 75 19.596 36.654 34.939 1.00 0.00 H ATOM 1182 HG21 THR A 75 19.478 34.892 34.708 1.00 0.00 H ATOM 1183 HG22 THR A 75 18.224 35.964 34.037 1.00 0.00 H ATOM 1184 H THR A 75 19.540 33.526 36.560 1.00 0.00 H ATOM 1185 N GLY A 76 17.906 34.151 39.010 1.00 61.04 N ATOM 1186 CA GLY A 76 17.080 33.895 40.179 1.00 56.87 C ATOM 1187 C GLY A 76 15.836 33.122 39.777 1.00 55.35 C ATOM 1188 O GLY A 76 15.150 32.518 40.614 1.00 49.48 O ATOM 1189 HA3 GLY A 76 16.786 34.844 40.629 1.00 0.00 H ATOM 1190 HA2 GLY A 76 17.649 33.312 40.903 1.00 0.00 H ATOM 1191 H GLY A 76 18.279 33.345 38.469 1.00 0.00 H ATOM 1192 N GLU A 77 15.539 33.165 38.480 1.00 51.77 N ATOM 1193 CA GLU A 77 14.390 32.485 37.901 1.00 48.58 C ATOM 1194 C GLU A 77 14.546 30.994 38.115 1.00 47.98 C ATOM 1195 O GLU A 77 15.669 30.486 38.201 1.00 49.66 O ATOM 1196 CB GLU A 77 14.328 32.793 36.401 1.00 53.37 C ATOM 1197 CG GLU A 77 13.206 32.108 35.627 1.00 65.20 C ATOM 1198 CD GLU A 77 13.144 32.534 34.157 1.00 72.20 C ATOM 1199 OE1 GLU A 77 13.751 33.568 33.794 1.00 73.35 O ATOM 1200 OE2 GLU A 77 12.473 31.837 33.361 1.00 75.80 O ATOM 1201 HA GLU A 77 13.470 32.827 38.376 1.00 0.00 H ATOM 1202 HB2 GLU A 77 14.205 33.870 36.285 1.00 0.00 H ATOM 1203 HB3 GLU A 77 15.275 32.487 35.957 1.00 0.00 H ATOM 1204 HG2 GLU A 77 13.362 31.030 35.670 1.00 0.00 H ATOM 1205 HG3 GLU A 77 12.256 32.355 36.101 1.00 0.00 H ATOM 1206 H GLU A 77 16.159 33.712 37.849 1.00 0.00 H ATOM 1207 N LYS A 78 13.426 30.297 38.237 1.00 44.39 N ATOM 1208 CA LYS A 78 13.467 28.854 38.415 1.00 48.31 C ATOM 1209 C LYS A 78 12.766 28.192 37.237 1.00 51.98 C ATOM 1210 O LYS A 78 11.748 28.694 36.746 1.00 52.56 O ATOM 1211 CB LYS A 78 12.858 28.441 39.758 1.00 40.49 C ATOM 1212 CG LYS A 78 13.772 28.747 40.930 1.00 29.99 C ATOM 1213 CD LYS A 78 13.200 28.321 42.262 1.00 30.46 C ATOM 1214 CE LYS A 78 14.150 28.723 43.383 1.00 32.92 C ATOM 1215 NZ LYS A 78 13.615 28.440 44.754 1.00 27.00 N ATOM 1216 HA LYS A 78 14.504 28.518 38.437 1.00 0.00 H ATOM 1217 HB2 LYS A 78 11.920 28.978 39.897 1.00 0.00 H ATOM 1218 HB3 LYS A 78 12.662 27.369 39.738 1.00 0.00 H ATOM 1219 HG2 LYS A 78 14.717 28.226 40.777 1.00 0.00 H ATOM 1220 HG3 LYS A 78 13.951 29.822 40.958 1.00 0.00 H ATOM 1221 HD2 LYS A 78 12.235 28.805 42.414 1.00 0.00 H ATOM 1222 HD3 LYS A 78 13.067 27.239 42.270 1.00 0.00 H ATOM 1223 HE2 LYS A 78 14.345 29.792 43.303 1.00 0.00 H ATOM 1224 HE3 LYS A 78 15.083 28.174 43.257 1.00 0.00 H ATOM 1225 HZ1 LYS A 78 12.729 28.966 44.894 1.00 0.00 H ATOM 1226 HZ2 LYS A 78 13.434 27.420 44.851 1.00 0.00 H ATOM 1227 HZ3 LYS A 78 14.313 28.738 45.465 1.00 0.00 H ATOM 1228 H LYS A 78 12.509 30.786 38.205 1.00 0.00 H ATOM 1229 N VAL A 79 13.362 27.109 36.743 1.00 52.36 N ATOM 1230 CA VAL A 79 12.836 26.371 35.597 1.00 50.70 C ATOM 1231 C VAL A 79 12.801 24.886 35.897 1.00 51.65 C ATOM 1232 O VAL A 79 13.426 24.425 36.848 1.00 50.24 O ATOM 1233 CB VAL A 79 13.713 26.581 34.338 1.00 46.46 C ATOM 1234 CG1 VAL A 79 13.700 28.042 33.919 1.00 47.25 C ATOM 1235 CG2 VAL A 79 15.144 26.111 34.600 1.00 47.75 C ATOM 1236 HA VAL A 79 11.831 26.748 35.409 1.00 0.00 H ATOM 1237 HB VAL A 79 13.298 25.986 33.524 1.00 0.00 H ATOM 1238 HG11 VAL A 79 12.677 28.345 33.694 1.00 0.00 H ATOM 1239 HG12 VAL A 79 14.092 28.655 34.731 1.00 0.00 H ATOM 1240 HG13 VAL A 79 14.322 28.170 33.033 1.00 0.00 H ATOM 1241 HG21 VAL A 79 15.567 26.682 35.427 1.00 0.00 H ATOM 1242 HG22 VAL A 79 15.136 25.051 34.855 1.00 0.00 H ATOM 1243 HG23 VAL A 79 15.746 26.266 33.704 1.00 0.00 H ATOM 1244 H VAL A 79 14.239 26.774 37.192 1.00 0.00 H ATOM 1245 N LYS A 80 12.061 24.141 35.091 1.00 54.09 N ATOM 1246 CA LYS A 80 11.968 22.698 35.267 1.00 56.74 C ATOM 1247 C LYS A 80 12.742 22.077 34.113 1.00 52.31 C ATOM 1248 O LYS A 80 12.747 22.619 33.007 1.00 52.84 O ATOM 1249 CB LYS A 80 10.505 22.244 35.256 1.00 59.34 C ATOM 1250 CG LYS A 80 9.641 22.964 36.294 1.00 68.49 C ATOM 1251 CD LYS A 80 8.215 22.425 36.345 1.00 75.30 C ATOM 1252 CE LYS A 80 8.141 21.067 37.035 1.00 83.00 C ATOM 1253 NZ LYS A 80 8.587 21.121 38.461 1.00 85.67 N ATOM 1254 HA LYS A 80 12.382 22.388 36.226 1.00 0.00 H ATOM 1255 HB2 LYS A 80 10.090 22.436 34.267 1.00 0.00 H ATOM 1256 HB3 LYS A 80 10.473 21.174 35.461 1.00 0.00 H ATOM 1257 HG2 LYS A 80 10.097 22.839 37.276 1.00 0.00 H ATOM 1258 HG3 LYS A 80 9.605 24.024 36.044 1.00 0.00 H ATOM 1259 HD2 LYS A 80 7.591 23.132 36.891 1.00 0.00 H ATOM 1260 HD3 LYS A 80 7.840 22.323 35.326 1.00 0.00 H ATOM 1261 HE2 LYS A 80 8.778 20.366 36.496 1.00 0.00 H ATOM 1262 HE3 LYS A 80 7.110 20.716 37.005 1.00 0.00 H ATOM 1263 HZ1 LYS A 80 9.574 21.447 38.502 1.00 0.00 H ATOM 1264 HZ2 LYS A 80 7.980 21.781 38.988 1.00 0.00 H ATOM 1265 HZ3 LYS A 80 8.516 20.172 38.881 1.00 0.00 H ATOM 1266 H LYS A 80 11.536 24.595 34.317 1.00 0.00 H ATOM 1267 N ALA A 81 13.424 20.969 34.373 1.00 46.39 N ATOM 1268 CA ALA A 81 14.209 20.318 33.333 1.00 38.22 C ATOM 1269 C ALA A 81 14.752 18.980 33.793 1.00 34.94 C ATOM 1270 O ALA A 81 14.829 18.704 34.985 1.00 31.83 O ATOM 1271 CB ALA A 81 15.364 21.222 32.911 1.00 39.35 C ATOM 1272 HA ALA A 81 13.549 20.139 32.484 1.00 0.00 H ATOM 1273 HB1 ALA A 81 14.967 22.162 32.527 1.00 0.00 H ATOM 1274 HB2 ALA A 81 16.002 21.421 33.772 1.00 0.00 H ATOM 1275 HB3 ALA A 81 15.945 20.727 32.133 1.00 0.00 H ATOM 1276 H ALA A 81 13.398 20.561 35.329 1.00 0.00 H ATOM 1277 N VAL A 82 15.114 18.141 32.837 1.00 37.61 N ATOM 1278 CA VAL A 82 15.682 16.846 33.163 1.00 44.42 C ATOM 1279 C VAL A 82 17.132 16.858 32.712 1.00 44.19 C ATOM 1280 O VAL A 82 17.431 17.213 31.566 1.00 44.92 O ATOM 1281 CB VAL A 82 14.953 15.693 32.445 1.00 46.71 C ATOM 1282 CG1 VAL A 82 15.747 14.400 32.572 1.00 45.57 C ATOM 1283 CG2 VAL A 82 13.578 15.503 33.037 1.00 50.88 C ATOM 1284 HA VAL A 82 15.584 16.680 34.236 1.00 0.00 H ATOM 1285 HB VAL A 82 14.860 15.948 31.389 1.00 0.00 H ATOM 1286 HG11 VAL A 82 16.731 14.533 32.121 1.00 0.00 H ATOM 1287 HG12 VAL A 82 15.860 14.147 33.626 1.00 0.00 H ATOM 1288 HG13 VAL A 82 15.217 13.598 32.059 1.00 0.00 H ATOM 1289 HG21 VAL A 82 13.670 15.265 34.097 1.00 0.00 H ATOM 1290 HG22 VAL A 82 13.003 16.421 32.918 1.00 0.00 H ATOM 1291 HG23 VAL A 82 13.072 14.686 32.522 1.00 0.00 H ATOM 1292 H VAL A 82 14.990 18.412 31.841 1.00 0.00 H ATOM 1293 N VAL A 83 18.027 16.532 33.636 1.00 43.09 N ATOM 1294 CA VAL A 83 19.444 16.468 33.329 1.00 40.60 C ATOM 1295 C VAL A 83 19.719 14.988 33.084 1.00 39.80 C ATOM 1296 O VAL A 83 19.409 14.139 33.923 1.00 37.98 O ATOM 1297 CB VAL A 83 20.312 17.004 34.492 1.00 38.57 C ATOM 1298 CG1 VAL A 83 21.772 17.050 34.076 1.00 32.44 C ATOM 1299 CG2 VAL A 83 19.839 18.390 34.903 1.00 25.44 C ATOM 1300 HA VAL A 83 19.696 17.089 32.469 1.00 0.00 H ATOM 1301 HB VAL A 83 20.211 16.332 35.345 1.00 0.00 H ATOM 1302 HG11 VAL A 83 22.105 16.046 33.813 1.00 0.00 H ATOM 1303 HG12 VAL A 83 21.882 17.708 33.214 1.00 0.00 H ATOM 1304 HG13 VAL A 83 22.372 17.429 34.903 1.00 0.00 H ATOM 1305 HG21 VAL A 83 19.921 19.067 34.053 1.00 0.00 H ATOM 1306 HG22 VAL A 83 18.800 18.337 35.227 1.00 0.00 H ATOM 1307 HG23 VAL A 83 20.458 18.756 35.722 1.00 0.00 H ATOM 1308 H VAL A 83 17.706 16.318 34.602 1.00 0.00 H ATOM 1309 N LYS A 84 20.226 14.681 31.899 1.00 42.31 N ATOM 1310 CA LYS A 84 20.510 13.307 31.519 1.00 46.61 C ATOM 1311 C LYS A 84 21.993 12.989 31.442 1.00 43.65 C ATOM 1312 O LYS A 84 22.820 13.848 31.156 1.00 47.10 O ATOM 1313 CB LYS A 84 19.876 12.996 30.165 1.00 48.23 C ATOM 1314 CG LYS A 84 18.381 13.189 30.092 1.00 49.83 C ATOM 1315 CD LYS A 84 17.962 13.140 28.641 1.00 68.13 C ATOM 1316 CE LYS A 84 16.477 13.386 28.440 1.00 77.17 C ATOM 1317 NZ LYS A 84 16.135 13.346 26.978 1.00 83.94 N ATOM 1318 HA LYS A 84 20.083 12.687 32.307 1.00 0.00 H ATOM 1319 HB2 LYS A 84 20.336 13.646 29.420 1.00 0.00 H ATOM 1320 HB3 LYS A 84 20.094 11.956 29.922 1.00 0.00 H ATOM 1321 HG2 LYS A 84 17.880 12.396 30.647 1.00 0.00 H ATOM 1322 HG3 LYS A 84 18.113 14.155 30.520 1.00 0.00 H ATOM 1323 HD2 LYS A 84 18.517 13.902 28.094 1.00 0.00 H ATOM 1324 HD3 LYS A 84 18.208 12.156 28.242 1.00 0.00 H ATOM 1325 HE2 LYS A 84 16.216 14.364 28.844 1.00 0.00 H ATOM 1326 HE3 LYS A 84 15.911 12.616 28.963 1.00 0.00 H ATOM 1327 HZ1 LYS A 84 16.672 14.082 26.477 1.00 0.00 H ATOM 1328 HZ2 LYS A 84 16.380 12.412 26.591 1.00 0.00 H ATOM 1329 HZ3 LYS A 84 15.116 13.516 26.857 1.00 0.00 H ATOM 1330 H LYS A 84 20.426 15.444 31.222 1.00 0.00 H ATOM 1331 N MET A 85 22.296 11.715 31.640 1.00 49.88 N ATOM 1332 CA MET A 85 23.652 11.191 31.592 1.00 52.91 C ATOM 1333 C MET A 85 23.850 10.667 30.167 1.00 54.02 C ATOM 1334 O MET A 85 23.349 9.599 29.815 1.00 62.57 O ATOM 1335 CB MET A 85 23.771 10.041 32.600 1.00 54.29 C ATOM 1336 CG MET A 85 25.168 9.538 32.868 1.00 57.23 C ATOM 1337 SD MET A 85 26.100 10.655 33.916 1.00 64.07 S ATOM 1338 CE MET A 85 27.361 11.191 32.759 1.00 64.88 C ATOM 1339 HA MET A 85 24.399 11.945 31.840 1.00 0.00 H ATOM 1340 HB2 MET A 85 23.352 10.382 33.547 1.00 0.00 H ATOM 1341 HB3 MET A 85 23.182 9.205 32.223 1.00 0.00 H ATOM 1342 HG2 MET A 85 25.691 9.429 31.918 1.00 0.00 H ATOM 1343 HG3 MET A 85 25.104 8.567 33.359 1.00 0.00 H ATOM 1344 HE1 MET A 85 27.930 10.326 32.417 1.00 0.00 H ATOM 1345 HE2 MET A 85 26.887 11.676 31.906 1.00 0.00 H ATOM 1346 HE3 MET A 85 28.030 11.895 33.253 1.00 0.00 H ATOM 1347 H MET A 85 21.521 11.052 31.841 1.00 0.00 H ATOM 1348 N GLU A 86 24.498 11.455 29.322 1.00 56.64 N ATOM 1349 CA GLU A 86 24.743 11.051 27.945 1.00 58.11 C ATOM 1350 C GLU A 86 26.126 10.433 27.867 1.00 56.93 C ATOM 1351 O GLU A 86 27.140 11.115 28.034 1.00 59.86 O ATOM 1352 CB GLU A 86 24.641 12.251 27.009 1.00 68.12 C ATOM 1353 CG GLU A 86 24.735 11.912 25.535 1.00 78.18 C ATOM 1354 CD GLU A 86 24.461 13.116 24.655 1.00 86.63 C ATOM 1355 OE1 GLU A 86 23.269 13.432 24.430 1.00 87.93 O ATOM 1356 OE2 GLU A 86 25.438 13.749 24.198 1.00 92.86 O ATOM 1357 HA GLU A 86 23.993 10.323 27.634 1.00 0.00 H ATOM 1358 HB2 GLU A 86 23.683 12.739 27.185 1.00 0.00 H ATOM 1359 HB3 GLU A 86 25.449 12.941 27.251 1.00 0.00 H ATOM 1360 HG2 GLU A 86 25.738 11.542 25.322 1.00 0.00 H ATOM 1361 HG3 GLU A 86 24.006 11.135 25.305 1.00 0.00 H ATOM 1362 H GLU A 86 24.839 12.382 29.649 1.00 0.00 H ATOM 1363 N GLY A 87 26.165 9.136 27.604 1.00 51.55 N ATOM 1364 CA GLY A 87 27.431 8.445 27.544 1.00 44.38 C ATOM 1365 C GLY A 87 27.893 8.152 28.956 1.00 41.09 C ATOM 1366 O GLY A 87 27.082 7.991 29.864 1.00 43.23 O ATOM 1367 HA3 GLY A 87 28.167 9.071 27.040 1.00 0.00 H ATOM 1368 HA2 GLY A 87 27.313 7.511 26.995 1.00 0.00 H ATOM 1369 H GLY A 87 25.281 8.613 27.440 1.00 0.00 H ATOM 1370 N ASP A 88 29.203 8.150 29.145 1.00 40.33 N ATOM 1371 CA ASP A 88 29.824 7.854 30.426 1.00 39.24 C ATOM 1372 C ASP A 88 30.325 9.102 31.156 1.00 42.85 C ATOM 1373 O ASP A 88 30.470 9.098 32.387 1.00 37.27 O ATOM 1374 CB ASP A 88 30.974 6.863 30.145 1.00 49.46 C ATOM 1375 CG ASP A 88 32.102 6.917 31.173 1.00 58.91 C ATOM 1376 OD1 ASP A 88 32.903 7.885 31.136 1.00 56.85 O ATOM 1377 OD2 ASP A 88 32.234 5.961 31.972 1.00 59.87 O ATOM 1378 HA ASP A 88 29.083 7.421 31.098 1.00 0.00 H ATOM 1379 HB2 ASP A 88 30.563 5.853 30.138 1.00 0.00 H ATOM 1380 HB3 ASP A 88 31.392 7.091 29.164 1.00 0.00 H ATOM 1381 H ASP A 88 29.819 8.371 28.337 1.00 0.00 H ATOM 1382 N ASN A 89 30.541 10.179 30.401 1.00 41.49 N ATOM 1383 CA ASN A 89 31.098 11.412 30.962 1.00 38.57 C ATOM 1384 C ASN A 89 30.401 12.732 30.612 1.00 33.56 C ATOM 1385 O ASN A 89 30.956 13.797 30.884 1.00 31.40 O ATOM 1386 CB ASN A 89 32.575 11.515 30.547 1.00 31.71 C ATOM 1387 CG ASN A 89 32.739 11.676 29.045 1.00 31.40 C ATOM 1388 OD1 ASN A 89 31.851 11.314 28.273 1.00 35.74 O ATOM 1389 ND2 ASN A 89 33.843 12.265 28.626 1.00 21.45 N ATOM 1390 HA ASN A 89 30.945 11.307 32.036 1.00 0.00 H ATOM 1391 HB2 ASN A 89 33.020 12.377 31.044 1.00 0.00 H ATOM 1392 HB3 ASN A 89 33.092 10.609 30.862 1.00 0.00 H ATOM 1393 HD22 ASN A 89 34.569 12.556 29.311 1.00 0.00 H ATOM 1394 HD21 ASN A 89 33.987 12.438 27.611 1.00 0.00 H ATOM 1395 H ASN A 89 30.308 10.143 29.388 1.00 0.00 H ATOM 1396 N LYS A 90 29.217 12.677 30.007 1.00 30.40 N ATOM 1397 CA LYS A 90 28.498 13.893 29.639 1.00 28.08 C ATOM 1398 C LYS A 90 27.162 14.024 30.331 1.00 33.72 C ATOM 1399 O LYS A 90 26.430 13.046 30.474 1.00 35.26 O ATOM 1400 CB LYS A 90 28.250 13.954 28.132 1.00 31.29 C ATOM 1401 CG LYS A 90 29.374 14.571 27.326 1.00 43.06 C ATOM 1402 CD LYS A 90 29.123 14.429 25.834 1.00 45.25 C ATOM 1403 CE LYS A 90 30.127 13.477 25.172 1.00 55.71 C ATOM 1404 NZ LYS A 90 30.129 12.072 25.707 1.00 48.71 N ATOM 1405 HA LYS A 90 29.141 14.713 29.959 1.00 0.00 H ATOM 1406 HB2 LYS A 90 28.094 12.937 27.773 1.00 0.00 H ATOM 1407 HB3 LYS A 90 27.348 14.541 27.960 1.00 0.00 H ATOM 1408 HG2 LYS A 90 29.451 15.629 27.575 1.00 0.00 H ATOM 1409 HG3 LYS A 90 30.309 14.071 27.579 1.00 0.00 H ATOM 1410 HD2 LYS A 90 28.116 14.041 25.681 1.00 0.00 H ATOM 1411 HD3 LYS A 90 29.207 15.410 25.367 1.00 0.00 H ATOM 1412 HE2 LYS A 90 31.126 13.891 25.310 1.00 0.00 H ATOM 1413 HE3 LYS A 90 29.897 13.432 24.107 1.00 0.00 H ATOM 1414 HZ1 LYS A 90 30.361 12.089 26.721 1.00 0.00 H ATOM 1415 HZ2 LYS A 90 29.188 11.650 25.573 1.00 0.00 H ATOM 1416 HZ3 LYS A 90 30.839 11.509 25.197 1.00 0.00 H ATOM 1417 H LYS A 90 28.796 11.751 29.792 1.00 0.00 H ATOM 1418 N MET A 91 26.868 15.234 30.797 1.00 33.98 N ATOM 1419 CA MET A 91 25.594 15.549 31.438 1.00 29.46 C ATOM 1420 C MET A 91 24.947 16.539 30.479 1.00 27.89 C ATOM 1421 O MET A 91 25.547 17.565 30.136 1.00 24.80 O ATOM 1422 CB MET A 91 25.789 16.204 32.803 1.00 24.50 C ATOM 1423 CG MET A 91 26.050 15.244 33.963 1.00 23.96 C ATOM 1424 SD MET A 91 25.876 16.137 35.542 1.00 43.08 S ATOM 1425 CE MET A 91 26.517 14.995 36.711 1.00 30.13 C ATOM 1426 HA MET A 91 24.998 14.654 31.619 1.00 0.00 H ATOM 1427 HB2 MET A 91 26.638 16.883 32.731 1.00 0.00 H ATOM 1428 HB3 MET A 91 24.889 16.773 33.034 1.00 0.00 H ATOM 1429 HG2 MET A 91 27.060 14.842 33.882 1.00 0.00 H ATOM 1430 HG3 MET A 91 25.331 14.426 33.927 1.00 0.00 H ATOM 1431 HE1 MET A 91 25.930 14.077 36.680 1.00 0.00 H ATOM 1432 HE2 MET A 91 27.556 14.771 36.467 1.00 0.00 H ATOM 1433 HE3 MET A 91 26.462 15.430 37.709 1.00 0.00 H ATOM 1434 H MET A 91 27.576 15.989 30.701 1.00 0.00 H ATOM 1435 N VAL A 92 23.762 16.202 29.988 1.00 29.57 N ATOM 1436 CA VAL A 92 23.070 17.066 29.043 1.00 32.42 C ATOM 1437 C VAL A 92 21.677 17.464 29.509 1.00 33.95 C ATOM 1438 O VAL A 92 20.976 16.677 30.146 1.00 34.48 O ATOM 1439 CB VAL A 92 22.987 16.393 27.666 1.00 26.68 C ATOM 1440 CG1 VAL A 92 22.179 17.236 26.701 1.00 32.62 C ATOM 1441 CG2 VAL A 92 24.377 16.191 27.125 1.00 29.42 C ATOM 1442 HA VAL A 92 23.657 17.982 28.974 1.00 0.00 H ATOM 1443 HB VAL A 92 22.490 15.429 27.777 1.00 0.00 H ATOM 1444 HG11 VAL A 92 21.169 17.365 27.091 1.00 0.00 H ATOM 1445 HG12 VAL A 92 22.653 18.211 26.588 1.00 0.00 H ATOM 1446 HG13 VAL A 92 22.136 16.737 25.733 1.00 0.00 H ATOM 1447 HG21 VAL A 92 24.872 17.157 27.030 1.00 0.00 H ATOM 1448 HG22 VAL A 92 24.943 15.557 27.808 1.00 0.00 H ATOM 1449 HG23 VAL A 92 24.319 15.713 26.147 1.00 0.00 H ATOM 1450 H VAL A 92 23.321 15.307 30.282 1.00 0.00 H ATOM 1451 N THR A 93 21.305 18.707 29.220 1.00 33.58 N ATOM 1452 CA THR A 93 19.994 19.228 29.578 1.00 38.45 C ATOM 1453 C THR A 93 19.615 20.403 28.675 1.00 39.63 C ATOM 1454 O THR A 93 20.466 20.973 27.975 1.00 38.21 O ATOM 1455 CB THR A 93 19.942 19.667 31.048 1.00 43.77 C ATOM 1456 OG1 THR A 93 18.654 20.233 31.336 1.00 36.28 O ATOM 1457 CG2 THR A 93 21.036 20.691 31.337 1.00 43.03 C ATOM 1458 HA THR A 93 19.276 18.420 29.437 1.00 0.00 H ATOM 1459 HB THR A 93 20.105 18.796 31.683 1.00 0.00 H ATOM 1460 HG1 THR A 93 17.952 19.555 31.169 1.00 0.00 H ATOM 1461 HG23 THR A 93 22.009 20.253 31.116 1.00 0.00 H ATOM 1462 HG21 THR A 93 20.882 21.571 30.713 1.00 0.00 H ATOM 1463 HG22 THR A 93 20.995 20.977 32.388 1.00 0.00 H ATOM 1464 H THR A 93 21.973 19.328 28.721 1.00 0.00 H ATOM 1465 N THR A 94 18.337 20.761 28.689 1.00 39.30 N ATOM 1466 CA THR A 94 17.836 21.860 27.873 1.00 36.91 C ATOM 1467 C THR A 94 16.852 22.678 28.696 1.00 41.06 C ATOM 1468 O THR A 94 16.120 22.124 29.522 1.00 42.22 O ATOM 1469 CB THR A 94 17.118 21.327 26.624 1.00 30.56 C ATOM 1470 OG1 THR A 94 17.970 20.396 25.948 1.00 36.96 O ATOM 1471 CG2 THR A 94 16.778 22.456 25.677 1.00 28.91 C ATOM 1472 HA THR A 94 18.678 22.476 27.558 1.00 0.00 H ATOM 1473 HB THR A 94 16.195 20.839 26.938 1.00 0.00 H ATOM 1474 HG1 THR A 94 18.182 19.643 26.555 1.00 0.00 H ATOM 1475 HG23 THR A 94 16.129 23.170 26.184 1.00 0.00 H ATOM 1476 HG21 THR A 94 17.695 22.955 25.364 1.00 0.00 H ATOM 1477 HG22 THR A 94 16.266 22.054 24.803 1.00 0.00 H ATOM 1478 H THR A 94 17.674 20.242 29.300 1.00 0.00 H ATOM 1479 N PHE A 95 16.889 23.997 28.516 1.00 45.05 N ATOM 1480 CA PHE A 95 15.986 24.919 29.208 1.00 44.82 C ATOM 1481 C PHE A 95 16.017 26.296 28.549 1.00 44.99 C ATOM 1482 O PHE A 95 17.072 26.756 28.109 1.00 43.88 O ATOM 1483 CB PHE A 95 16.321 25.029 30.707 1.00 47.51 C ATOM 1484 CG PHE A 95 17.655 25.660 31.003 1.00 50.29 C ATOM 1485 CD1 PHE A 95 17.785 27.044 31.077 1.00 53.65 C ATOM 1486 CD2 PHE A 95 18.776 24.872 31.230 1.00 53.33 C ATOM 1487 CE1 PHE A 95 19.009 27.630 31.375 1.00 53.88 C ATOM 1488 CE2 PHE A 95 20.005 25.449 31.531 1.00 51.86 C ATOM 1489 CZ PHE A 95 20.121 26.830 31.602 1.00 51.67 C ATOM 1490 HA PHE A 95 14.978 24.513 29.126 1.00 0.00 H ATOM 1491 HB2 PHE A 95 15.547 25.628 31.186 1.00 0.00 H ATOM 1492 HB3 PHE A 95 16.317 24.025 31.132 1.00 0.00 H ATOM 1493 HD2 PHE A 95 18.691 23.787 31.171 1.00 0.00 H ATOM 1494 HE2 PHE A 95 20.875 24.818 31.711 1.00 0.00 H ATOM 1495 HZ PHE A 95 21.083 27.286 31.836 1.00 0.00 H ATOM 1496 HE1 PHE A 95 19.096 28.715 31.430 1.00 0.00 H ATOM 1497 HD1 PHE A 95 16.915 27.676 30.899 1.00 0.00 H ATOM 1498 H PHE A 95 17.590 24.389 27.855 1.00 0.00 H ATOM 1499 N LYS A 96 14.852 26.925 28.436 1.00 46.51 N ATOM 1500 CA LYS A 96 14.740 28.257 27.831 1.00 45.96 C ATOM 1501 C LYS A 96 15.427 28.404 26.469 1.00 45.11 C ATOM 1502 O LYS A 96 16.007 29.447 26.163 1.00 49.31 O ATOM 1503 CB LYS A 96 15.264 29.331 28.790 1.00 45.96 C ATOM 1504 CG LYS A 96 14.493 29.425 30.091 1.00 53.34 C ATOM 1505 CD LYS A 96 14.811 30.717 30.817 1.00 59.36 C ATOM 1506 CE LYS A 96 14.397 31.924 29.986 1.00 60.33 C ATOM 1507 NZ LYS A 96 14.680 33.212 30.679 1.00 66.44 N ATOM 1508 HA LYS A 96 13.674 28.393 27.647 1.00 0.00 H ATOM 1509 HB2 LYS A 96 16.304 29.104 29.023 1.00 0.00 H ATOM 1510 HB3 LYS A 96 15.208 30.297 28.287 1.00 0.00 H ATOM 1511 HG2 LYS A 96 13.425 29.390 29.876 1.00 0.00 H ATOM 1512 HG3 LYS A 96 14.763 28.582 30.727 1.00 0.00 H ATOM 1513 HD2 LYS A 96 14.274 30.735 31.765 1.00 0.00 H ATOM 1514 HD3 LYS A 96 15.883 30.765 31.007 1.00 0.00 H ATOM 1515 HE2 LYS A 96 13.327 31.861 29.785 1.00 0.00 H ATOM 1516 HE3 LYS A 96 14.944 31.905 29.043 1.00 0.00 H ATOM 1517 HZ1 LYS A 96 14.156 33.244 31.577 1.00 0.00 H ATOM 1518 HZ2 LYS A 96 15.700 33.285 30.869 1.00 0.00 H ATOM 1519 HZ3 LYS A 96 14.381 34.003 30.074 1.00 0.00 H ATOM 1520 H LYS A 96 13.992 26.458 28.788 1.00 0.00 H ATOM 1521 N GLY A 97 15.366 27.360 25.653 1.00 42.86 N ATOM 1522 CA GLY A 97 15.985 27.423 24.340 1.00 45.56 C ATOM 1523 C GLY A 97 17.482 27.163 24.331 1.00 44.95 C ATOM 1524 O GLY A 97 18.107 27.113 23.266 1.00 44.50 O ATOM 1525 HA3 GLY A 97 15.810 28.417 23.929 1.00 0.00 H ATOM 1526 HA2 GLY A 97 15.507 26.679 23.703 1.00 0.00 H ATOM 1527 H GLY A 97 14.874 26.494 25.954 1.00 0.00 H ATOM 1528 N ILE A 98 18.060 27.004 25.515 1.00 39.61 N ATOM 1529 CA ILE A 98 19.481 26.741 25.650 1.00 34.87 C ATOM 1530 C ILE A 98 19.725 25.235 25.684 1.00 35.49 C ATOM 1531 O ILE A 98 18.919 24.475 26.236 1.00 33.21 O ATOM 1532 CB ILE A 98 20.018 27.321 26.970 1.00 34.25 C ATOM 1533 CG1 ILE A 98 19.818 28.832 27.015 1.00 37.06 C ATOM 1534 CG2 ILE A 98 21.485 26.977 27.152 1.00 28.99 C ATOM 1535 CD1 ILE A 98 20.088 29.427 28.398 1.00 39.47 C ATOM 1536 HA ILE A 98 19.987 27.203 24.802 1.00 0.00 H ATOM 1537 HB ILE A 98 19.456 26.873 27.789 1.00 0.00 H ATOM 1538 HG12 ILE A 98 20.497 29.295 26.298 1.00 0.00 H ATOM 1539 HG13 ILE A 98 18.789 29.055 26.735 1.00 0.00 H ATOM 1540 HD11 ILE A 98 19.409 28.980 29.124 1.00 0.00 H ATOM 1541 HD12 ILE A 98 21.118 29.219 28.687 1.00 0.00 H ATOM 1542 HD13 ILE A 98 19.929 30.505 28.366 1.00 0.00 H ATOM 1543 HG21 ILE A 98 21.603 25.894 27.169 1.00 0.00 H ATOM 1544 HG22 ILE A 98 22.060 27.393 26.325 1.00 0.00 H ATOM 1545 HG23 ILE A 98 21.842 27.398 28.092 1.00 0.00 H ATOM 1546 H ILE A 98 17.476 27.070 26.373 1.00 0.00 H ATOM 1547 N LYS A 99 20.826 24.819 25.068 1.00 37.11 N ATOM 1548 CA LYS A 99 21.257 23.419 25.046 1.00 37.55 C ATOM 1549 C LYS A 99 22.541 23.389 25.867 1.00 31.01 C ATOM 1550 O LYS A 99 23.490 24.114 25.567 1.00 35.60 O ATOM 1551 CB LYS A 99 21.536 22.957 23.610 1.00 42.84 C ATOM 1552 CG LYS A 99 22.360 21.670 23.492 1.00 57.06 C ATOM 1553 CD LYS A 99 21.677 20.467 24.139 1.00 63.68 C ATOM 1554 CE LYS A 99 22.493 19.207 23.925 1.00 70.22 C ATOM 1555 NZ LYS A 99 22.705 18.906 22.477 1.00 73.55 N ATOM 1556 HA LYS A 99 20.492 22.754 25.447 1.00 0.00 H ATOM 1557 HB2 LYS A 99 20.579 22.792 23.115 1.00 0.00 H ATOM 1558 HB3 LYS A 99 22.076 23.753 23.097 1.00 0.00 H ATOM 1559 HG2 LYS A 99 22.519 21.454 22.436 1.00 0.00 H ATOM 1560 HG3 LYS A 99 23.323 21.827 23.978 1.00 0.00 H ATOM 1561 HD2 LYS A 99 21.572 20.648 25.209 1.00 0.00 H ATOM 1562 HD3 LYS A 99 20.690 20.334 23.695 1.00 0.00 H ATOM 1563 HE2 LYS A 99 21.970 18.368 24.384 1.00 0.00 H ATOM 1564 HE3 LYS A 99 23.465 19.333 24.403 1.00 0.00 H ATOM 1565 HZ1 LYS A 99 21.784 18.776 22.013 1.00 0.00 H ATOM 1566 HZ2 LYS A 99 23.211 19.697 22.030 1.00 0.00 H ATOM 1567 HZ3 LYS A 99 23.268 18.036 22.384 1.00 0.00 H ATOM 1568 H LYS A 99 21.412 25.523 24.576 1.00 0.00 H ATOM 1569 N SER A 100 22.587 22.564 26.898 1.00 25.90 N ATOM 1570 CA SER A 100 23.776 22.536 27.723 1.00 28.06 C ATOM 1571 C SER A 100 24.496 21.202 27.746 1.00 29.38 C ATOM 1572 O SER A 100 23.892 20.159 28.027 1.00 29.51 O ATOM 1573 CB SER A 100 23.424 22.953 29.146 1.00 30.05 C ATOM 1574 OG SER A 100 24.591 23.217 29.899 1.00 33.54 O ATOM 1575 HA SER A 100 24.470 23.242 27.267 1.00 0.00 H ATOM 1576 HB2 SER A 100 22.864 22.150 29.625 1.00 0.00 H ATOM 1577 HB3 SER A 100 22.810 23.853 29.113 1.00 0.00 H ATOM 1578 HG SER A 100 25.150 22.401 29.936 1.00 0.00 H ATOM 1579 H SER A 100 21.781 21.944 27.114 1.00 0.00 H ATOM 1580 N VAL A 101 25.798 21.246 27.475 1.00 26.00 N ATOM 1581 CA VAL A 101 26.623 20.049 27.501 1.00 27.95 C ATOM 1582 C VAL A 101 27.848 20.217 28.407 1.00 25.43 C ATOM 1583 O VAL A 101 28.684 21.096 28.183 1.00 21.62 O ATOM 1584 CB VAL A 101 27.068 19.630 26.087 1.00 27.23 C ATOM 1585 CG1 VAL A 101 28.020 18.432 26.169 1.00 27.77 C ATOM 1586 CG2 VAL A 101 25.845 19.273 25.249 1.00 22.73 C ATOM 1587 HA VAL A 101 25.999 19.257 27.914 1.00 0.00 H ATOM 1588 HB VAL A 101 27.593 20.461 25.616 1.00 0.00 H ATOM 1589 HG11 VAL A 101 28.897 18.706 26.755 1.00 0.00 H ATOM 1590 HG12 VAL A 101 27.509 17.596 26.647 1.00 0.00 H ATOM 1591 HG13 VAL A 101 28.328 18.145 25.164 1.00 0.00 H ATOM 1592 HG21 VAL A 101 25.312 18.448 25.720 1.00 0.00 H ATOM 1593 HG22 VAL A 101 25.188 20.140 25.180 1.00 0.00 H ATOM 1594 HG23 VAL A 101 26.165 18.977 24.250 1.00 0.00 H ATOM 1595 H VAL A 101 26.236 22.159 27.239 1.00 0.00 H ATOM 1596 N THR A 102 27.912 19.396 29.454 1.00 24.73 N ATOM 1597 CA THR A 102 29.016 19.391 30.414 1.00 20.19 C ATOM 1598 C THR A 102 29.787 18.082 30.188 1.00 20.67 C ATOM 1599 O THR A 102 29.206 17.006 30.297 1.00 20.05 O ATOM 1600 CB THR A 102 28.474 19.429 31.874 1.00 25.86 C ATOM 1601 OG1 THR A 102 27.594 20.551 32.030 1.00 32.08 O ATOM 1602 CG2 THR A 102 29.606 19.542 32.889 1.00 17.45 C ATOM 1603 HA THR A 102 29.652 20.265 30.272 1.00 0.00 H ATOM 1604 HB THR A 102 27.940 18.497 32.056 1.00 0.00 H ATOM 1605 HG1 THR A 102 26.836 20.465 31.399 1.00 0.00 H ATOM 1606 HG23 THR A 102 30.279 18.692 32.776 1.00 0.00 H ATOM 1607 HG21 THR A 102 30.155 20.468 32.717 1.00 0.00 H ATOM 1608 HG22 THR A 102 29.190 19.547 33.896 1.00 0.00 H ATOM 1609 H THR A 102 27.134 18.721 29.597 1.00 0.00 H ATOM 1610 N GLU A 103 31.063 18.177 29.820 1.00 14.29 N ATOM 1611 CA GLU A 103 31.893 17.000 29.567 1.00 15.98 C ATOM 1612 C GLU A 103 33.064 16.894 30.543 1.00 11.68 C ATOM 1613 O GLU A 103 33.841 17.837 30.713 1.00 8.65 O ATOM 1614 CB GLU A 103 32.392 16.995 28.113 1.00 11.00 C ATOM 1615 CG GLU A 103 33.410 15.909 27.820 1.00 18.32 C ATOM 1616 CD GLU A 103 33.727 15.747 26.348 1.00 16.55 C ATOM 1617 OE1 GLU A 103 33.285 16.570 25.523 1.00 27.92 O ATOM 1618 OE2 GLU A 103 34.416 14.771 26.005 1.00 28.74 O ATOM 1619 HA GLU A 103 31.266 16.123 29.728 1.00 0.00 H ATOM 1620 HB2 GLU A 103 31.535 16.850 27.455 1.00 0.00 H ATOM 1621 HB3 GLU A 103 32.850 17.962 27.903 1.00 0.00 H ATOM 1622 HG2 GLU A 103 34.333 16.153 28.346 1.00 0.00 H ATOM 1623 HG3 GLU A 103 33.020 14.962 28.194 1.00 0.00 H ATOM 1624 H GLU A 103 31.484 19.121 29.709 1.00 0.00 H ATOM 1625 N PHE A 104 33.164 15.742 31.194 1.00 17.51 N ATOM 1626 CA PHE A 104 34.206 15.474 32.187 1.00 21.31 C ATOM 1627 C PHE A 104 35.334 14.589 31.645 1.00 23.89 C ATOM 1628 O PHE A 104 35.102 13.528 31.051 1.00 21.71 O ATOM 1629 CB PHE A 104 33.597 14.794 33.420 1.00 24.99 C ATOM 1630 CG PHE A 104 32.578 15.633 34.153 1.00 26.42 C ATOM 1631 CD1 PHE A 104 31.244 15.653 33.750 1.00 32.42 C ATOM 1632 CD2 PHE A 104 32.942 16.370 35.278 1.00 36.95 C ATOM 1633 CE1 PHE A 104 30.281 16.395 34.458 1.00 31.86 C ATOM 1634 CE2 PHE A 104 31.986 17.115 35.992 1.00 35.19 C ATOM 1635 CZ PHE A 104 30.655 17.123 35.578 1.00 33.33 C ATOM 1636 HA PHE A 104 34.636 16.440 32.450 1.00 0.00 H ATOM 1637 HB2 PHE A 104 33.112 13.873 33.097 1.00 0.00 H ATOM 1638 HB3 PHE A 104 34.404 14.555 34.112 1.00 0.00 H ATOM 1639 HD2 PHE A 104 33.981 16.369 35.609 1.00 0.00 H ATOM 1640 HE2 PHE A 104 32.286 17.687 36.870 1.00 0.00 H ATOM 1641 HZ PHE A 104 29.912 17.698 36.131 1.00 0.00 H ATOM 1642 HE1 PHE A 104 29.242 16.398 34.127 1.00 0.00 H ATOM 1643 HD1 PHE A 104 30.942 15.084 32.871 1.00 0.00 H ATOM 1644 H PHE A 104 32.470 14.995 30.989 1.00 0.00 H ATOM 1645 N ASN A 105 36.560 15.011 31.898 1.00 24.14 N ATOM 1646 CA ASN A 105 37.739 14.288 31.451 1.00 23.49 C ATOM 1647 C ASN A 105 38.785 14.445 32.544 1.00 27.02 C ATOM 1648 O ASN A 105 39.655 15.330 32.483 1.00 27.96 O ATOM 1649 CB ASN A 105 38.274 14.867 30.130 1.00 20.35 C ATOM 1650 CG ASN A 105 37.443 14.460 28.928 1.00 27.06 C ATOM 1651 OD1 ASN A 105 37.293 13.273 28.648 1.00 22.68 O ATOM 1652 ND2 ASN A 105 36.913 15.445 28.198 1.00 18.79 N ATOM 1653 HA ASN A 105 37.498 13.240 31.271 1.00 0.00 H ATOM 1654 HB2 ASN A 105 38.274 15.955 30.201 1.00 0.00 H ATOM 1655 HB3 ASN A 105 39.295 14.514 29.983 1.00 0.00 H ATOM 1656 HD22 ASN A 105 37.066 16.436 28.473 1.00 0.00 H ATOM 1657 HD21 ASN A 105 36.347 15.221 27.355 1.00 0.00 H ATOM 1658 H ASN A 105 36.686 15.892 32.436 1.00 0.00 H ATOM 1659 N GLY A 106 38.657 13.621 33.579 1.00 24.00 N ATOM 1660 CA GLY A 106 39.596 13.670 34.678 1.00 25.24 C ATOM 1661 C GLY A 106 39.523 14.984 35.421 1.00 27.82 C ATOM 1662 O GLY A 106 38.474 15.337 35.957 1.00 32.12 O ATOM 1663 HA3 GLY A 106 40.605 13.542 34.286 1.00 0.00 H ATOM 1664 HA2 GLY A 106 39.371 12.859 35.371 1.00 0.00 H ATOM 1665 H GLY A 106 37.875 12.935 33.599 1.00 0.00 H ATOM 1666 N ASP A 107 40.629 15.722 35.413 1.00 32.47 N ATOM 1667 CA ASP A 107 40.722 17.009 36.100 1.00 30.11 C ATOM 1668 C ASP A 107 40.108 18.161 35.333 1.00 28.28 C ATOM 1669 O ASP A 107 40.019 19.270 35.857 1.00 32.26 O ATOM 1670 CB ASP A 107 42.179 17.352 36.375 1.00 35.03 C ATOM 1671 CG ASP A 107 42.889 16.276 37.161 1.00 50.66 C ATOM 1672 OD1 ASP A 107 42.288 15.741 38.124 1.00 54.11 O ATOM 1673 OD2 ASP A 107 44.051 15.965 36.808 1.00 58.10 O ATOM 1674 HA ASP A 107 40.156 16.886 37.023 1.00 0.00 H ATOM 1675 HB2 ASP A 107 42.692 17.486 35.423 1.00 0.00 H ATOM 1676 HB3 ASP A 107 42.218 18.282 36.942 1.00 0.00 H ATOM 1677 H ASP A 107 41.461 15.370 34.898 1.00 0.00 H ATOM 1678 N THR A 108 39.680 17.899 34.107 1.00 21.52 N ATOM 1679 CA THR A 108 39.111 18.927 33.267 1.00 18.96 C ATOM 1680 C THR A 108 37.616 18.791 32.993 1.00 23.79 C ATOM 1681 O THR A 108 37.122 17.685 32.729 1.00 23.48 O ATOM 1682 CB THR A 108 39.891 18.980 31.935 1.00 19.50 C ATOM 1683 OG1 THR A 108 41.229 19.409 32.207 1.00 19.20 O ATOM 1684 CG2 THR A 108 39.240 19.931 30.914 1.00 15.10 C ATOM 1685 HA THR A 108 39.209 19.858 33.826 1.00 0.00 H ATOM 1686 HB THR A 108 39.883 17.983 31.495 1.00 0.00 H ATOM 1687 HG1 THR A 108 41.741 19.447 31.360 1.00 0.00 H ATOM 1688 HG23 THR A 108 38.222 19.601 30.710 1.00 0.00 H ATOM 1689 HG21 THR A 108 39.221 20.942 31.322 1.00 0.00 H ATOM 1690 HG22 THR A 108 39.819 19.921 29.990 1.00 0.00 H ATOM 1691 H THR A 108 39.756 16.929 33.740 1.00 0.00 H ATOM 1692 N ILE A 109 36.898 19.907 33.149 1.00 19.44 N ATOM 1693 CA ILE A 109 35.469 19.983 32.840 1.00 18.69 C ATOM 1694 C ILE A 109 35.364 20.996 31.710 1.00 16.67 C ATOM 1695 O ILE A 109 36.069 22.005 31.697 1.00 18.34 O ATOM 1696 CB ILE A 109 34.583 20.511 33.996 1.00 20.74 C ATOM 1697 CG1 ILE A 109 34.637 19.588 35.204 1.00 13.27 C ATOM 1698 CG2 ILE A 109 33.112 20.596 33.547 1.00 17.55 C ATOM 1699 CD1 ILE A 109 33.770 20.084 36.346 1.00 9.61 C ATOM 1700 HA ILE A 109 35.116 18.977 32.614 1.00 0.00 H ATOM 1701 HB ILE A 109 34.966 21.495 34.265 1.00 0.00 H ATOM 1702 HG12 ILE A 109 34.291 18.598 34.905 1.00 0.00 H ATOM 1703 HG13 ILE A 109 35.669 19.522 35.550 1.00 0.00 H ATOM 1704 HD11 ILE A 109 34.112 21.071 36.658 1.00 0.00 H ATOM 1705 HD12 ILE A 109 32.734 20.146 36.013 1.00 0.00 H ATOM 1706 HD13 ILE A 109 33.843 19.391 37.184 1.00 0.00 H ATOM 1707 HG21 ILE A 109 33.031 21.275 32.698 1.00 0.00 H ATOM 1708 HG22 ILE A 109 32.764 19.605 33.256 1.00 0.00 H ATOM 1709 HG23 ILE A 109 32.503 20.969 34.371 1.00 0.00 H ATOM 1710 H ILE A 109 37.375 20.759 33.506 1.00 0.00 H ATOM 1711 N THR A 110 34.547 20.678 30.720 1.00 23.06 N ATOM 1712 CA THR A 110 34.315 21.566 29.595 1.00 23.09 C ATOM 1713 C THR A 110 32.808 21.713 29.470 1.00 17.76 C ATOM 1714 O THR A 110 32.078 20.728 29.356 1.00 14.19 O ATOM 1715 CB THR A 110 34.918 21.001 28.299 1.00 25.94 C ATOM 1716 OG1 THR A 110 36.336 20.900 28.453 1.00 26.59 O ATOM 1717 CG2 THR A 110 34.616 21.918 27.124 1.00 32.07 C ATOM 1718 HA THR A 110 34.796 22.530 29.760 1.00 0.00 H ATOM 1719 HB THR A 110 34.482 20.021 28.105 1.00 0.00 H ATOM 1720 HG1 THR A 110 36.732 20.537 27.622 1.00 0.00 H ATOM 1721 HG23 THR A 110 33.537 22.002 26.998 1.00 0.00 H ATOM 1722 HG21 THR A 110 35.038 22.904 27.317 1.00 0.00 H ATOM 1723 HG22 THR A 110 35.058 21.503 26.218 1.00 0.00 H ATOM 1724 H THR A 110 34.055 19.762 30.748 1.00 0.00 H ATOM 1725 N ASN A 111 32.334 22.937 29.595 1.00 23.85 N ATOM 1726 CA ASN A 111 30.913 23.187 29.506 1.00 20.83 C ATOM 1727 C ASN A 111 30.614 24.026 28.284 1.00 20.04 C ATOM 1728 O ASN A 111 31.303 25.006 28.013 1.00 23.58 O ATOM 1729 CB ASN A 111 30.418 23.899 30.756 1.00 27.17 C ATOM 1730 CG ASN A 111 28.918 23.998 30.796 1.00 29.97 C ATOM 1731 OD1 ASN A 111 28.319 24.926 30.250 1.00 29.68 O ATOM 1732 ND2 ASN A 111 28.291 23.016 31.421 1.00 28.67 N ATOM 1733 HA ASN A 111 30.396 22.231 29.422 1.00 0.00 H ATOM 1734 HB2 ASN A 111 30.757 23.347 31.633 1.00 0.00 H ATOM 1735 HB3 ASN A 111 30.837 24.905 30.777 1.00 0.00 H ATOM 1736 HD22 ASN A 111 28.837 22.252 31.868 1.00 0.00 H ATOM 1737 HD21 ASN A 111 27.252 23.007 31.465 1.00 0.00 H ATOM 1738 H ASN A 111 32.988 23.729 29.759 1.00 0.00 H ATOM 1739 N THR A 112 29.586 23.628 27.549 1.00 25.68 N ATOM 1740 CA THR A 112 29.174 24.323 26.339 1.00 29.19 C ATOM 1741 C THR A 112 27.663 24.546 26.315 1.00 30.16 C ATOM 1742 O THR A 112 26.886 23.585 26.336 1.00 29.99 O ATOM 1743 CB THR A 112 29.555 23.510 25.098 1.00 30.70 C ATOM 1744 OG1 THR A 112 30.973 23.305 25.079 1.00 39.45 O ATOM 1745 CG2 THR A 112 29.122 24.224 23.842 1.00 31.02 C ATOM 1746 HA THR A 112 29.685 25.286 26.333 1.00 0.00 H ATOM 1747 HB THR A 112 29.047 22.546 25.138 1.00 0.00 H ATOM 1748 HG1 THR A 112 31.245 22.812 25.894 1.00 0.00 H ATOM 1749 HG23 THR A 112 28.043 24.375 23.865 1.00 0.00 H ATOM 1750 HG21 THR A 112 29.624 25.189 23.783 1.00 0.00 H ATOM 1751 HG22 THR A 112 29.387 23.621 22.973 1.00 0.00 H ATOM 1752 H THR A 112 29.053 22.787 27.848 1.00 0.00 H ATOM 1753 N MET A 113 27.257 25.814 26.298 1.00 25.29 N ATOM 1754 CA MET A 113 25.848 26.164 26.246 1.00 21.21 C ATOM 1755 C MET A 113 25.606 26.965 24.981 1.00 22.80 C ATOM 1756 O MET A 113 26.295 27.953 24.710 1.00 26.55 O ATOM 1757 CB MET A 113 25.428 26.972 27.470 1.00 15.97 C ATOM 1758 CG MET A 113 25.697 26.299 28.797 1.00 14.58 C ATOM 1759 SD MET A 113 25.179 27.382 30.122 1.00 26.46 S ATOM 1760 CE MET A 113 24.350 26.241 31.163 1.00 22.92 C ATOM 1761 HA MET A 113 25.251 25.252 26.241 1.00 0.00 H ATOM 1762 HB2 MET A 113 25.969 27.918 27.454 1.00 0.00 H ATOM 1763 HB3 MET A 113 24.358 27.165 27.398 1.00 0.00 H ATOM 1764 HG2 MET A 113 26.763 26.091 28.891 1.00 0.00 H ATOM 1765 HG3 MET A 113 25.140 25.364 28.851 1.00 0.00 H ATOM 1766 HE1 MET A 113 23.522 25.788 30.617 1.00 0.00 H ATOM 1767 HE2 MET A 113 25.048 25.465 31.478 1.00 0.00 H ATOM 1768 HE3 MET A 113 23.966 26.763 32.039 1.00 0.00 H ATOM 1769 H MET A 113 27.967 26.574 26.323 1.00 0.00 H ATOM 1770 N THR A 114 24.645 26.514 24.188 1.00 25.19 N ATOM 1771 CA THR A 114 24.327 27.175 22.937 1.00 22.66 C ATOM 1772 C THR A 114 22.937 27.805 22.941 1.00 20.18 C ATOM 1773 O THR A 114 21.946 27.166 23.309 1.00 25.79 O ATOM 1774 CB THR A 114 24.435 26.185 21.756 1.00 16.50 C ATOM 1775 OG1 THR A 114 23.611 25.048 22.017 1.00 16.43 O ATOM 1776 CG2 THR A 114 25.867 25.697 21.594 1.00 10.57 C ATOM 1777 HA THR A 114 25.056 27.977 22.819 1.00 0.00 H ATOM 1778 HB THR A 114 24.117 26.699 20.849 1.00 0.00 H ATOM 1779 HG1 THR A 114 23.914 24.606 22.849 1.00 0.00 H ATOM 1780 HG23 THR A 114 26.519 26.547 21.393 1.00 0.00 H ATOM 1781 HG21 THR A 114 26.186 25.201 22.511 1.00 0.00 H ATOM 1782 HG22 THR A 114 25.918 24.994 20.762 1.00 0.00 H ATOM 1783 H THR A 114 24.108 25.669 24.468 1.00 0.00 H ATOM 1784 N LEU A 115 22.882 29.082 22.591 1.00 27.88 N ATOM 1785 CA LEU A 115 21.622 29.813 22.499 1.00 33.33 C ATOM 1786 C LEU A 115 21.661 30.549 21.169 1.00 32.33 C ATOM 1787 O LEU A 115 22.410 31.518 21.009 1.00 35.17 O ATOM 1788 CB LEU A 115 21.465 30.822 23.636 1.00 33.04 C ATOM 1789 CG LEU A 115 20.156 31.617 23.563 1.00 41.57 C ATOM 1790 CD1 LEU A 115 18.969 30.685 23.766 1.00 42.85 C ATOM 1791 CD2 LEU A 115 20.147 32.718 24.609 1.00 50.61 C ATOM 1792 HA LEU A 115 20.780 29.124 22.571 1.00 0.00 H ATOM 1793 HB2 LEU A 115 21.491 30.283 24.583 1.00 0.00 H ATOM 1794 HB3 LEU A 115 22.299 31.523 23.595 1.00 0.00 H ATOM 1795 HG LEU A 115 20.079 32.077 22.578 1.00 0.00 H ATOM 1796 HD21 LEU A 115 20.240 32.276 25.601 1.00 0.00 H ATOM 1797 HD22 LEU A 115 20.984 33.393 24.431 1.00 0.00 H ATOM 1798 HD23 LEU A 115 19.211 33.272 24.543 1.00 0.00 H ATOM 1799 HD11 LEU A 115 18.970 29.922 22.987 1.00 0.00 H ATOM 1800 HD12 LEU A 115 19.046 30.208 24.743 1.00 0.00 H ATOM 1801 HD13 LEU A 115 18.044 31.260 23.712 1.00 0.00 H ATOM 1802 H LEU A 115 23.768 29.581 22.374 1.00 0.00 H ATOM 1803 N GLY A 116 20.886 30.069 20.207 1.00 31.37 N ATOM 1804 CA GLY A 116 20.865 30.699 18.905 1.00 34.45 C ATOM 1805 C GLY A 116 22.175 30.430 18.208 1.00 35.15 C ATOM 1806 O GLY A 116 22.525 29.282 17.963 1.00 36.05 O ATOM 1807 HA3 GLY A 116 20.726 31.774 19.021 1.00 0.00 H ATOM 1808 HA2 GLY A 116 20.046 30.290 18.314 1.00 0.00 H ATOM 1809 H GLY A 116 20.291 29.236 20.389 1.00 0.00 H ATOM 1810 N ASP A 117 22.914 31.484 17.899 1.00 42.51 N ATOM 1811 CA ASP A 117 24.199 31.318 17.242 1.00 46.15 C ATOM 1812 C ASP A 117 25.341 31.549 18.240 1.00 42.60 C ATOM 1813 O ASP A 117 26.517 31.544 17.870 1.00 48.94 O ATOM 1814 CB ASP A 117 24.316 32.276 16.055 1.00 49.27 C ATOM 1815 CG ASP A 117 25.402 31.862 15.077 1.00 59.14 C ATOM 1816 OD1 ASP A 117 25.245 30.798 14.437 1.00 67.12 O ATOM 1817 OD2 ASP A 117 26.413 32.590 14.959 1.00 59.34 O ATOM 1818 HA ASP A 117 24.272 30.297 16.867 1.00 0.00 H ATOM 1819 HB2 ASP A 117 23.362 32.299 15.529 1.00 0.00 H ATOM 1820 HB3 ASP A 117 24.546 33.273 16.431 1.00 0.00 H ATOM 1821 H ASP A 117 22.572 32.439 18.129 1.00 0.00 H ATOM 1822 N ILE A 118 24.988 31.752 19.504 1.00 36.06 N ATOM 1823 CA ILE A 118 25.978 31.984 20.548 1.00 32.28 C ATOM 1824 C ILE A 118 26.354 30.649 21.180 1.00 32.84 C ATOM 1825 O ILE A 118 25.501 29.778 21.360 1.00 32.37 O ATOM 1826 CB ILE A 118 25.418 32.889 21.674 1.00 27.10 C ATOM 1827 CG1 ILE A 118 24.616 34.055 21.091 1.00 30.67 C ATOM 1828 CG2 ILE A 118 26.553 33.423 22.534 1.00 16.67 C ATOM 1829 CD1 ILE A 118 24.031 34.992 22.158 1.00 27.95 C ATOM 1830 HA ILE A 118 26.837 32.472 20.088 1.00 0.00 H ATOM 1831 HB ILE A 118 24.753 32.286 22.292 1.00 0.00 H ATOM 1832 HG12 ILE A 118 25.273 34.636 20.444 1.00 0.00 H ATOM 1833 HG13 ILE A 118 23.795 33.648 20.501 1.00 0.00 H ATOM 1834 HD11 ILE A 118 23.362 34.428 22.808 1.00 0.00 H ATOM 1835 HD12 ILE A 118 24.841 35.417 22.750 1.00 0.00 H ATOM 1836 HD13 ILE A 118 23.476 35.794 21.671 1.00 0.00 H ATOM 1837 HG21 ILE A 118 27.092 32.588 22.982 1.00 0.00 H ATOM 1838 HG22 ILE A 118 27.234 34.005 21.914 1.00 0.00 H ATOM 1839 HG23 ILE A 118 26.144 34.057 23.321 1.00 0.00 H ATOM 1840 H ILE A 118 23.979 31.745 19.755 1.00 0.00 H ATOM 1841 N VAL A 119 27.638 30.471 21.467 1.00 33.81 N ATOM 1842 CA VAL A 119 28.119 29.261 22.123 1.00 31.62 C ATOM 1843 C VAL A 119 28.996 29.742 23.255 1.00 31.01 C ATOM 1844 O VAL A 119 30.115 30.207 23.025 1.00 31.85 O ATOM 1845 CB VAL A 119 28.997 28.366 21.213 1.00 35.33 C ATOM 1846 CG1 VAL A 119 29.576 27.208 22.032 1.00 33.66 C ATOM 1847 CG2 VAL A 119 28.202 27.836 20.028 1.00 30.36 C ATOM 1848 HA VAL A 119 27.260 28.662 22.425 1.00 0.00 H ATOM 1849 HB VAL A 119 29.814 28.971 20.818 1.00 0.00 H ATOM 1850 HG11 VAL A 119 30.185 27.607 22.843 1.00 0.00 H ATOM 1851 HG12 VAL A 119 28.761 26.614 22.446 1.00 0.00 H ATOM 1852 HG13 VAL A 119 30.193 26.582 21.388 1.00 0.00 H ATOM 1853 HG21 VAL A 119 27.362 27.244 20.391 1.00 0.00 H ATOM 1854 HG22 VAL A 119 27.830 28.674 19.438 1.00 0.00 H ATOM 1855 HG23 VAL A 119 28.847 27.212 19.409 1.00 0.00 H ATOM 1856 H VAL A 119 28.320 31.215 21.217 1.00 0.00 H ATOM 1857 N TYR A 120 28.449 29.716 24.463 1.00 28.87 N ATOM 1858 CA TYR A 120 29.185 30.128 25.646 1.00 23.14 C ATOM 1859 C TYR A 120 30.039 28.922 26.043 1.00 25.72 C ATOM 1860 O TYR A 120 29.513 27.825 26.258 1.00 19.74 O ATOM 1861 CB TYR A 120 28.200 30.525 26.747 1.00 16.14 C ATOM 1862 CG TYR A 120 28.807 30.769 28.107 1.00 18.21 C ATOM 1863 CD1 TYR A 120 30.025 31.432 28.249 1.00 27.63 C ATOM 1864 CD2 TYR A 120 28.170 30.313 29.254 1.00 25.97 C ATOM 1865 CE1 TYR A 120 30.588 31.625 29.490 1.00 20.05 C ATOM 1866 CE2 TYR A 120 28.725 30.499 30.501 1.00 16.75 C ATOM 1867 CZ TYR A 120 29.930 31.153 30.614 1.00 22.50 C ATOM 1868 OH TYR A 120 30.475 31.325 31.858 1.00 30.41 O ATOM 1869 HA TYR A 120 29.819 30.997 25.469 1.00 0.00 H ATOM 1870 HB3 TYR A 120 27.466 29.725 26.845 1.00 0.00 H ATOM 1871 HB2 TYR A 120 27.698 31.441 26.434 1.00 0.00 H ATOM 1872 HD2 TYR A 120 27.213 29.798 29.166 1.00 0.00 H ATOM 1873 HE2 TYR A 120 28.214 30.131 31.391 1.00 0.00 H ATOM 1874 HE1 TYR A 120 31.542 32.144 29.587 1.00 0.00 H ATOM 1875 HD1 TYR A 120 30.540 31.804 27.363 1.00 0.00 H ATOM 1876 HH TYR A 120 31.335 31.809 31.776 1.00 0.00 H ATOM 1877 H TYR A 120 27.466 29.392 24.566 1.00 0.00 H ATOM 1878 N LYS A 121 31.355 29.118 26.085 1.00 29.62 N ATOM 1879 CA LYS A 121 32.282 28.044 26.422 1.00 30.39 C ATOM 1880 C LYS A 121 33.026 28.302 27.727 1.00 26.33 C ATOM 1881 O LYS A 121 33.485 29.414 27.956 1.00 24.23 O ATOM 1882 CB LYS A 121 33.292 27.882 25.293 1.00 34.66 C ATOM 1883 CG LYS A 121 33.768 26.461 25.080 1.00 46.09 C ATOM 1884 CD LYS A 121 33.300 25.937 23.730 1.00 58.50 C ATOM 1885 CE LYS A 121 33.667 26.904 22.598 1.00 65.68 C ATOM 1886 NZ LYS A 121 33.537 26.274 21.252 1.00 73.92 N ATOM 1887 HA LYS A 121 31.696 27.135 26.554 1.00 0.00 H ATOM 1888 HB2 LYS A 121 32.830 28.229 24.369 1.00 0.00 H ATOM 1889 HB3 LYS A 121 34.159 28.502 25.519 1.00 0.00 H ATOM 1890 HG2 LYS A 121 34.857 26.438 25.116 1.00 0.00 H ATOM 1891 HG3 LYS A 121 33.367 25.826 25.870 1.00 0.00 H ATOM 1892 HD2 LYS A 121 33.772 24.973 23.540 1.00 0.00 H ATOM 1893 HD3 LYS A 121 32.217 25.812 23.753 1.00 0.00 H ATOM 1894 HE2 LYS A 121 34.698 27.230 22.735 1.00 0.00 H ATOM 1895 HE3 LYS A 121 33.005 27.768 22.646 1.00 0.00 H ATOM 1896 HZ1 LYS A 121 34.171 25.452 21.193 1.00 0.00 H ATOM 1897 HZ2 LYS A 121 32.554 25.966 21.108 1.00 0.00 H ATOM 1898 HZ3 LYS A 121 33.796 26.966 20.520 1.00 0.00 H ATOM 1899 H LYS A 121 31.732 30.063 25.872 1.00 0.00 H ATOM 1900 N ARG A 122 33.135 27.271 28.568 1.00 26.71 N ATOM 1901 CA ARG A 122 33.834 27.336 29.857 1.00 25.85 C ATOM 1902 C ARG A 122 34.751 26.139 29.999 1.00 21.57 C ATOM 1903 O ARG A 122 34.362 25.032 29.651 1.00 17.85 O ATOM 1904 CB ARG A 122 32.852 27.250 31.027 1.00 27.43 C ATOM 1905 CG ARG A 122 32.142 28.516 31.390 1.00 29.59 C ATOM 1906 CD ARG A 122 31.035 28.216 32.387 1.00 30.99 C ATOM 1907 NE ARG A 122 31.501 27.880 33.734 1.00 27.50 N ATOM 1908 CZ ARG A 122 31.382 28.691 34.782 1.00 24.80 C ATOM 1909 NH1 ARG A 122 30.836 29.893 34.637 1.00 30.49 N ATOM 1910 NH2 ARG A 122 31.694 28.263 35.997 1.00 15.28 N ATOM 1911 HA ARG A 122 34.378 28.281 29.878 1.00 0.00 H ATOM 1912 HB2 ARG A 122 32.097 26.506 30.773 1.00 0.00 H ATOM 1913 HB3 ARG A 122 33.408 26.917 31.904 1.00 0.00 H ATOM 1914 HG2 ARG A 122 32.851 29.214 31.835 1.00 0.00 H ATOM 1915 HG3 ARG A 122 31.711 28.960 30.493 1.00 0.00 H ATOM 1916 HD2 ARG A 122 30.455 27.375 32.008 1.00 0.00 H ATOM 1917 HD3 ARG A 122 30.394 29.095 32.458 1.00 0.00 H ATOM 1918 HE ARG A 122 31.951 26.954 33.880 1.00 0.00 H ATOM 1919 HH12 ARG A 122 30.744 30.525 35.458 1.00 0.00 H ATOM 1920 HH11 ARG A 122 30.500 30.202 33.703 1.00 0.00 H ATOM 1921 HH22 ARG A 122 31.599 28.901 36.813 1.00 0.00 H ATOM 1922 HH21 ARG A 122 32.033 27.290 36.134 1.00 0.00 H ATOM 1923 H ARG A 122 32.699 26.368 28.293 1.00 0.00 H ATOM 1924 N VAL A 123 35.955 26.370 30.515 1.00 22.46 N ATOM 1925 CA VAL A 123 36.925 25.307 30.768 1.00 17.10 C ATOM 1926 C VAL A 123 37.358 25.465 32.230 1.00 15.17 C ATOM 1927 O VAL A 123 37.794 26.549 32.646 1.00 17.87 O ATOM 1928 CB VAL A 123 38.160 25.380 29.825 1.00 23.46 C ATOM 1929 CG1 VAL A 123 39.202 24.362 30.235 1.00 11.54 C ATOM 1930 CG2 VAL A 123 37.746 25.117 28.383 1.00 17.07 C ATOM 1931 HA VAL A 123 36.469 24.336 30.575 1.00 0.00 H ATOM 1932 HB VAL A 123 38.583 26.381 29.903 1.00 0.00 H ATOM 1933 HG11 VAL A 123 39.524 24.565 31.257 1.00 0.00 H ATOM 1934 HG12 VAL A 123 38.772 23.362 30.180 1.00 0.00 H ATOM 1935 HG13 VAL A 123 40.058 24.429 29.563 1.00 0.00 H ATOM 1936 HG21 VAL A 123 37.301 24.125 28.309 1.00 0.00 H ATOM 1937 HG22 VAL A 123 37.018 25.867 28.073 1.00 0.00 H ATOM 1938 HG23 VAL A 123 38.623 25.172 27.739 1.00 0.00 H ATOM 1939 H VAL A 123 36.217 27.349 30.748 1.00 0.00 H ATOM 1940 N SER A 124 37.151 24.418 33.025 1.00 10.00 N ATOM 1941 CA SER A 124 37.510 24.430 34.442 1.00 17.13 C ATOM 1942 C SER A 124 38.414 23.273 34.774 1.00 15.13 C ATOM 1943 O SER A 124 38.436 22.266 34.066 1.00 15.65 O ATOM 1944 CB SER A 124 36.264 24.323 35.317 1.00 12.26 C ATOM 1945 OG SER A 124 35.380 25.379 35.040 1.00 12.70 O ATOM 1946 HA SER A 124 38.023 25.372 34.637 1.00 0.00 H ATOM 1947 HB2 SER A 124 36.557 24.365 36.366 1.00 0.00 H ATOM 1948 HB3 SER A 124 35.765 23.375 35.118 1.00 0.00 H ATOM 1949 HG SER A 124 35.111 25.341 34.088 1.00 0.00 H ATOM 1950 H SER A 124 36.719 23.561 32.624 1.00 0.00 H ATOM 1951 N LYS A 125 39.171 23.406 35.850 1.00 17.12 N ATOM 1952 CA LYS A 125 40.037 22.312 36.248 1.00 19.10 C ATOM 1953 C LYS A 125 39.845 22.108 37.726 1.00 19.98 C ATOM 1954 O LYS A 125 39.456 23.040 38.427 1.00 20.12 O ATOM 1955 CB LYS A 125 41.505 22.600 35.920 1.00 20.63 C ATOM 1956 CG LYS A 125 42.158 23.670 36.756 1.00 28.75 C ATOM 1957 CD LYS A 125 43.646 23.713 36.469 1.00 39.13 C ATOM 1958 CE LYS A 125 44.373 24.685 37.379 1.00 42.06 C ATOM 1959 NZ LYS A 125 45.835 24.715 37.080 1.00 48.32 N ATOM 1960 HA LYS A 125 39.775 21.410 35.695 1.00 0.00 H ATOM 1961 HB2 LYS A 125 42.068 21.676 36.057 1.00 0.00 H ATOM 1962 HB3 LYS A 125 41.562 22.908 34.876 1.00 0.00 H ATOM 1963 HG2 LYS A 125 41.715 24.637 36.516 1.00 0.00 H ATOM 1964 HG3 LYS A 125 41.999 23.451 37.812 1.00 0.00 H ATOM 1965 HD2 LYS A 125 44.062 22.716 36.615 1.00 0.00 H ATOM 1966 HD3 LYS A 125 43.796 24.020 35.434 1.00 0.00 H ATOM 1967 HE2 LYS A 125 44.228 24.379 38.415 1.00 0.00 H ATOM 1968 HE3 LYS A 125 43.960 25.683 37.235 1.00 0.00 H ATOM 1969 HZ1 LYS A 125 46.236 23.766 37.220 1.00 0.00 H ATOM 1970 HZ2 LYS A 125 45.980 25.012 36.094 1.00 0.00 H ATOM 1971 HZ3 LYS A 125 46.304 25.389 37.718 1.00 0.00 H ATOM 1972 H LYS A 125 39.146 24.285 36.405 1.00 0.00 H ATOM 1973 N ARG A 126 40.060 20.882 38.191 1.00 23.92 N ATOM 1974 CA ARG A 126 39.917 20.576 39.606 1.00 22.07 C ATOM 1975 C ARG A 126 41.002 21.245 40.458 1.00 20.72 C ATOM 1976 O ARG A 126 42.183 21.236 40.092 1.00 22.79 O ATOM 1977 CB ARG A 126 39.921 19.060 39.818 1.00 22.70 C ATOM 1978 CG ARG A 126 39.722 18.669 41.251 1.00 32.02 C ATOM 1979 CD ARG A 126 39.790 17.185 41.443 1.00 40.98 C ATOM 1980 NE ARG A 126 38.555 16.525 41.048 1.00 42.52 N ATOM 1981 CZ ARG A 126 38.460 15.698 40.015 1.00 52.86 C ATOM 1982 NH1 ARG A 126 39.529 15.438 39.269 1.00 59.96 N ATOM 1983 NH2 ARG A 126 37.310 15.093 39.755 1.00 58.83 N ATOM 1984 HA ARG A 126 38.961 20.982 39.935 1.00 0.00 H ATOM 1985 HB2 ARG A 126 39.118 18.624 39.224 1.00 0.00 H ATOM 1986 HB3 ARG A 126 40.878 18.664 39.479 1.00 0.00 H ATOM 1987 HG2 ARG A 126 40.499 19.138 41.855 1.00 0.00 H ATOM 1988 HG3 ARG A 126 38.745 19.022 41.580 1.00 0.00 H ATOM 1989 HD2 ARG A 126 39.980 16.975 42.495 1.00 0.00 H ATOM 1990 HD3 ARG A 126 40.608 16.790 40.841 1.00 0.00 H ATOM 1991 HE ARG A 126 37.698 16.712 41.607 1.00 0.00 H ATOM 1992 HH12 ARG A 126 39.453 14.789 38.460 1.00 0.00 H ATOM 1993 HH11 ARG A 126 40.441 15.883 39.495 1.00 0.00 H ATOM 1994 HH22 ARG A 126 37.235 14.445 38.945 1.00 0.00 H ATOM 1995 HH21 ARG A 126 36.483 15.267 40.361 1.00 0.00 H ATOM 1996 H ARG A 126 40.336 20.127 37.531 1.00 0.00 H ATOM 1997 N ILE A 127 40.582 21.870 41.558 1.00 21.17 N ATOM 1998 CA ILE A 127 41.485 22.544 42.490 1.00 22.65 C ATOM 1999 C ILE A 127 41.396 21.905 43.867 1.00 27.39 C ATOM 2000 O ILE A 127 40.579 20.975 44.050 1.00 35.24 O ATOM 2001 CB ILE A 127 41.164 24.051 42.658 1.00 18.71 C ATOM 2002 CG1 ILE A 127 39.687 24.257 43.005 1.00 18.33 C ATOM 2003 CG2 ILE A 127 41.582 24.815 41.441 1.00 25.60 C ATOM 2004 CD1 ILE A 127 39.357 25.674 43.427 1.00 15.36 C ATOM 2005 HA ILE A 127 42.483 22.441 42.064 1.00 0.00 H ATOM 2006 OXT ILE A 127 42.151 22.350 44.750 1.00 32.83 O ATOM 2007 HB ILE A 127 41.740 24.445 43.495 1.00 0.00 H ATOM 2008 HG12 ILE A 127 39.089 24.010 42.128 1.00 0.00 H ATOM 2009 HG13 ILE A 127 39.427 23.584 43.822 1.00 0.00 H ATOM 2010 HD11 ILE A 127 39.940 25.934 44.311 1.00 0.00 H ATOM 2011 HD12 ILE A 127 39.601 26.360 42.615 1.00 0.00 H ATOM 2012 HD13 ILE A 127 38.294 25.745 43.657 1.00 0.00 H ATOM 2013 HG21 ILE A 127 42.655 24.696 41.289 1.00 0.00 H ATOM 2014 HG22 ILE A 127 41.046 24.433 40.572 1.00 0.00 H ATOM 2015 HG23 ILE A 127 41.348 25.871 41.578 1.00 0.00 H ATOM 2016 H ILE A 127 39.563 21.879 41.763 1.00 0.00 H TER 2017 ILE A 127 HETATM 2018 O HOH 1 16.341 9.659 25.408 1.00 53.80 O HETATM 2019 O HOH 2 18.593 17.404 26.340 1.00 51.92 O HETATM 2020 O HOH 3 12.749 22.050 27.643 1.00 70.18 O HETATM 2021 O HOH 4 14.144 24.537 26.239 1.00 42.82 O HETATM 2022 O HOH 5 11.427 27.313 26.792 1.00 65.35 O HETATM 2023 O HOH 6 14.032 30.768 23.711 1.00 60.01 O HETATM 2024 O HOH 7 16.437 33.380 33.498 1.00 37.38 O HETATM 2025 O HOH 8 19.024 45.269 36.781 1.00 67.58 O HETATM 2026 O HOH 9 22.242 38.947 43.243 1.00 34.22 O HETATM 2027 O HOH 10 24.825 40.670 43.802 1.00 76.23 O HETATM 2028 O HOH 11 24.079 34.392 46.895 1.00 58.25 O HETATM 2029 O HOH 12 20.641 29.236 45.535 1.00 30.09 O HETATM 2030 O HOH 13 24.239 25.352 41.633 1.00 39.07 O HETATM 2031 O HOH 14 23.936 23.002 46.341 1.00 66.03 O HETATM 2032 O HOH 15 27.467 21.174 47.040 1.00 58.14 O HETATM 2033 O HOH 16 28.389 26.676 50.098 1.00 54.54 O HETATM 2034 O HOH 17 30.795 29.557 48.754 1.00 55.06 O HETATM 2035 O HOH 18 30.947 26.741 45.345 1.00 36.59 O HETATM 2036 O HOH 19 33.260 25.416 46.776 1.00 47.53 O HETATM 2037 O HOH 20 37.908 20.067 48.929 1.00 72.19 O HETATM 2038 O HOH 21 38.764 18.700 44.058 1.00 36.03 O HETATM 2039 O HOH 22 38.492 15.260 44.310 1.00 89.13 O HETATM 2040 O HOH 23 36.177 11.732 40.203 1.00 76.49 O HETATM 2041 O HOH 24 35.684 6.763 40.236 1.00 46.45 O HETATM 2042 O HOH 25 42.227 12.299 37.428 1.00 63.83 O HETATM 2043 O HOH 26 43.759 14.271 34.780 1.00 27.17 O HETATM 2044 O HOH 27 42.567 15.919 32.574 1.00 38.19 O HETATM 2045 O HOH 28 33.592 19.284 25.381 1.00 17.15 O HETATM 2046 O HOH 29 31.437 20.599 26.273 1.00 24.64 O HETATM 2047 O HOH 30 31.918 16.332 23.277 1.00 38.06 O HETATM 2048 O HOH 31 26.334 16.570 22.621 1.00 72.40 O HETATM 2049 O HOH 32 27.349 11.946 22.842 1.00 66.78 O HETATM 2050 O HOH 33 24.012 7.255 26.856 1.00 53.02 O HETATM 2051 O HOH 34 28.747 4.177 33.977 1.00 58.85 O HETATM 2052 O HOH 35 19.073 1.918 36.952 1.00 66.14 O HETATM 2053 O HOH 36 17.333 16.302 36.384 1.00 39.17 O HETATM 2054 O HOH 37 16.517 19.899 37.147 1.00 42.09 O HETATM 2055 O HOH 38 17.988 22.634 42.143 1.00 63.59 O HETATM 2056 O HOH 39 13.688 25.842 45.997 1.00 62.05 O HETATM 2057 O HOH 40 10.824 27.189 44.431 1.00 32.98 O HETATM 2058 O HOH 41 20.138 16.930 50.409 1.00 64.18 O HETATM 2059 O HOH 42 22.320 13.162 49.481 1.00 69.81 O HETATM 2060 O HOH 43 30.215 12.069 46.899 1.00 86.87 O HETATM 2061 O HOH 44 33.185 17.457 46.966 1.00 51.05 O HETATM 2062 O HOH 45 40.900 24.173 48.016 1.00 43.47 O HETATM 2063 O HOH 46 39.254 31.919 44.141 1.00 21.58 O HETATM 2064 O HOH 47 42.993 28.076 39.760 1.00 39.26 O HETATM 2065 O HOH 48 34.123 25.652 37.728 1.00 54.85 O HETATM 2066 O HOH 49 31.835 28.647 38.698 1.00 21.99 O HETATM 2067 O HOH 50 33.642 24.225 33.198 1.00 38.63 O HETATM 2068 O HOH 51 29.547 26.935 29.331 1.00 29.88 O HETATM 2069 O HOH 52 25.394 23.550 23.601 1.00 27.23 O HETATM 2070 O HOH 53 25.249 21.499 21.811 1.00 86.97 O HETATM 2071 O HOH 54 24.560 20.734 30.899 1.00 41.79 O HETATM 2072 O HOH 55 29.244 32.353 19.015 1.00 52.70 O HETATM 2073 O HOH 56 24.247 39.047 22.076 1.00 38.37 O HETATM 2074 O HOH 57 39.384 33.881 29.905 1.00 66.03 O HETATM 2075 O HOH 58 41.750 27.482 29.450 1.00 47.17 O HETATM 2076 O HOH 59 33.042 42.273 41.817 1.00 45.89 O HETATM 2077 O HOH 60 29.514 46.674 38.330 1.00 54.16 O HETATM 2078 O HOH 61 25.193 29.109 51.177 1.00 47.30 O HETATM 2079 C1 OLA A 62 30.220 39.651 43.710 1.00 0.03 C HETATM 2080 O1 OLA A 62 30.506 40.746 43.256 1.00 -0.57 O HETATM 2081 O2 OLA A 62 31.096 38.936 44.164 1.00 -0.57 O HETATM 2082 C2 OLA A 62 28.763 39.177 43.732 1.00 0.00 C HETATM 2083 C3 OLA A 62 28.148 38.992 42.350 1.00 -0.04 C HETATM 2084 C4 OLA A 62 29.201 38.970 41.254 1.00 -0.05 C HETATM 2085 C5 OLA A 62 28.569 38.890 39.878 1.00 -0.05 C HETATM 2086 C6 OLA A 62 27.665 37.680 39.746 1.00 -0.05 C HETATM 2087 C7 OLA A 62 27.413 37.386 38.286 1.00 -0.05 C HETATM 2088 C8 OLA A 62 26.985 35.951 38.079 1.00 -0.04 C HETATM 2089 C9 OLA A 62 27.508 35.518 36.811 1.00 -0.10 C HETATM 2090 C10 OLA A 62 27.081 34.387 36.154 1.00 -0.10 C HETATM 2091 C11 OLA A 62 27.216 33.049 36.676 1.00 -0.04 C HETATM 2092 C12 OLA A 62 27.425 32.108 35.504 1.00 -0.05 C HETATM 2093 C13 OLA A 62 27.277 30.658 35.916 1.00 -0.05 C HETATM 2094 C14 OLA A 62 27.327 29.759 34.694 1.00 -0.05 C HETATM 2095 C15 OLA A 62 27.086 28.319 35.079 1.00 -0.05 C HETATM 2096 C16 OLA A 62 27.245 27.406 33.877 1.00 -0.05 C HETATM 2097 C17 OLA A 62 26.825 25.989 34.217 1.00 -0.06 C HETATM 2098 C18 OLA A 62 28.014 25.299 34.894 1.00 -0.07 C HETATM 2099 H31 OLA A 62 27.739 24.266 35.153 1.00 0.02 H HETATM 2100 H32 OLA A 62 28.284 25.847 35.809 1.00 0.02 H HETATM 2101 H33 OLA A 62 28.872 25.288 34.206 1.00 0.02 H HETATM 2102 H29 OLA A 62 26.552 25.449 33.298 1.00 0.03 H HETATM 2103 H30 OLA A 62 25.964 26.008 34.901 1.00 0.03 H HETATM 2104 H27 OLA A 62 28.299 27.404 33.563 1.00 0.03 H HETATM 2105 H28 OLA A 62 26.618 27.780 33.054 1.00 0.03 H HETATM 2106 H25 OLA A 62 26.065 28.218 35.476 1.00 0.03 H HETATM 2107 H26 OLA A 62 27.811 28.026 35.853 1.00 0.03 H HETATM 2108 H23 OLA A 62 28.317 29.846 34.223 1.00 0.03 H HETATM 2109 H24 OLA A 62 26.552 30.076 33.981 1.00 0.03 H HETATM 2110 H21 OLA A 62 26.313 30.522 36.428 1.00 0.03 H HETATM 2111 H22 OLA A 62 28.096 30.389 36.599 1.00 0.03 H HETATM 2112 H19 OLA A 62 28.436 32.262 35.099 1.00 0.03 H HETATM 2113 H20 OLA A 62 26.680 32.336 34.727 1.00 0.03 H HETATM 2114 H17 OLA A 62 26.304 32.768 37.223 1.00 0.04 H HETATM 2115 H18 OLA A 62 28.080 32.998 37.354 1.00 0.04 H HETATM 2116 H16 OLA A 62 26.612 34.510 35.179 1.00 0.04 H HETATM 2117 H15 OLA A 62 28.287 36.120 36.344 1.00 0.04 H HETATM 2118 H13 OLA A 62 25.887 35.884 38.074 1.00 0.04 H HETATM 2119 H14 OLA A 62 27.387 35.320 38.885 1.00 0.04 H HETATM 2120 H11 OLA A 62 28.338 37.569 37.719 1.00 0.03 H HETATM 2121 H12 OLA A 62 26.619 38.053 37.918 1.00 0.03 H HETATM 2122 H9 OLA A 62 26.708 37.883 40.248 1.00 0.03 H HETATM 2123 H10 OLA A 62 28.148 36.810 40.215 1.00 0.03 H HETATM 2124 H7 OLA A 62 29.366 38.824 39.123 1.00 0.03 H HETATM 2125 H8 OLA A 62 27.975 39.799 39.705 1.00 0.03 H HETATM 2126 H5 OLA A 62 29.851 38.095 41.400 1.00 0.03 H HETATM 2127 H6 OLA A 62 29.803 39.889 41.318 1.00 0.03 H HETATM 2128 H3 OLA A 62 27.453 39.822 42.157 1.00 0.03 H HETATM 2129 H4 OLA A 62 27.597 38.040 42.331 1.00 0.03 H HETATM 2130 H1 OLA A 62 28.166 39.921 44.279 1.00 0.04 H HETATM 2131 H2 OLA A 62 28.721 38.213 44.261 1.00 0.04 H CONECT 1 2 4 5 6 CONECT 2 1 3 7 CONECT 4 1 CONECT 5 1 CONECT 6 1 CONECT 7 2 8 23 CONECT 1089 1090 1103 1104 1105 CONECT 1103 1089 CONECT 1104 1089 CONECT 1105 1089 CONECT 2079 2080 2081 2082 CONECT 2080 2079 CONECT 2081 2079 CONECT 2082 2079 2083 2130 2131 CONECT 2083 2082 2084 2128 2129 CONECT 2084 2083 2085 2126 2127 CONECT 2085 2084 2086 2124 2125 CONECT 2086 2085 2087 2122 2123 CONECT 2087 2086 2088 2120 2121 CONECT 2088 2087 2089 2118 2119 CONECT 2089 2088 2090 2117 CONECT 2090 2089 2091 2116 CONECT 2091 2090 2092 2114 2115 CONECT 2092 2091 2093 2112 2113 CONECT 2093 2092 2094 2110 2111 CONECT 2094 2093 2095 2108 2109 CONECT 2095 2094 2096 2106 2107 CONECT 2096 2095 2097 2104 2105 CONECT 2097 2096 2098 2102 2103 CONECT 2098 2097 2099 2100 2101 CONECT 2099 2098 CONECT 2100 2098 CONECT 2101 2098 CONECT 2102 2097 CONECT 2103 2097 CONECT 2104 2096 CONECT 2105 2096 CONECT 2106 2095 CONECT 2107 2095 CONECT 2108 2094 CONECT 2109 2094 CONECT 2110 2093 CONECT 2111 2093 CONECT 2112 2092 CONECT 2113 2092 CONECT 2114 2091 CONECT 2115 2091 CONECT 2116 2090 CONECT 2117 2089 CONECT 2118 2088 CONECT 2119 2088 CONECT 2120 2087 CONECT 2121 2087 CONECT 2122 2086 CONECT 2123 2086 CONECT 2124 2085 CONECT 2125 2085 CONECT 2126 2084 CONECT 2127 2084 CONECT 2128 2083 CONECT 2129 2083 CONECT 2130 2082 CONECT 2131 2082 MASTER 0 0 0 0 0 0 0 0 2129 2 63 11 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
PDB Code
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Ligand Name
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PDBbind
OLA
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Entry Information
PDB ID
1lfo
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
fatty acid binding protein
Ligand Name
OLA
EC.Number
E.C.-.-.-.-
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
Kd~0.2uM
Release Year
1997
Protein/NA Sequence
Check fasta file
Primary Reference
J.Biol.Chem. v272 pp. 7140-50, 1997
Ligand Properties
Formula
C
1
8
H
3
4
O
2
Molecular Weight
282.461
Exact Mass
282.256
No. of atoms
54
No. of bonds
53
Polar Surface Area
37.3
LOGP Value
8.71 (
Computed with XLOGP3
)
6.11 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 14
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 0
Canonical SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)O
InChI String
InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)
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):
P02692
Entrez Gene ID
NCBI Entrez Gene ID:
24360
ASD
Information of known allosteric effects of PDB entries
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