Browse entries in the PDBbind-CN Database
HEADER 1BL4_COMPLEX COMPND 1BL4_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 107 GLY VAL GLN VAL GLU THR ILE SER PRO GLY ASP GLY ARG SEQRES 2 A 107 THR PHE PRO LYS ARG GLY GLN THR CYS VAL VAL HIS TYR SEQRES 3 A 107 THR GLY MET LEU GLU ASP GLY LYS LYS VAL ASP SER SER SEQRES 4 A 107 ARG ASP ARG ASN LYS PRO PHE LYS PHE MET LEU GLY LYS SEQRES 5 A 107 GLN GLU VAL ILE ARG GLY TRP GLU GLU GLY VAL ALA GLN SEQRES 6 A 107 MET SER VAL GLY GLN ARG ALA LYS LEU THR ILE SER PRO SEQRES 7 A 107 ASP TYR ALA TYR GLY ALA THR GLY HIS PRO GLY ILE ILE SEQRES 8 A 107 PRO PRO HIS ALA THR LEU VAL PHE ASP VAL GLU LEU LEU SEQRES 9 A 107 LYS LEU GLU SEQRES 1 B 107 GLY VAL GLN VAL GLU THR ILE SER PRO GLY ASP GLY ARG SEQRES 2 B 107 THR PHE PRO LYS ARG GLY GLN THR CYS VAL VAL HIS TYR SEQRES 3 B 107 THR GLY MET LEU GLU ASP GLY LYS LYS VAL ASP SER SER SEQRES 4 B 107 ARG ASP ARG ASN LYS PRO PHE LYS PHE MET LEU GLY LYS SEQRES 5 B 107 GLN GLU VAL ILE ARG GLY TRP GLU GLU GLY VAL ALA GLN SEQRES 6 B 107 MET SER VAL GLY GLN ARG ALA LYS LEU THR ILE SER PRO SEQRES 7 B 107 ASP TYR ALA TYR GLY ALA THR GLY HIS PRO GLY ILE ILE SEQRES 8 B 107 PRO PRO HIS ALA THR LEU VAL PHE ASP VAL GLU LEU LEU SEQRES 9 B 107 LYS LEU GLU HET AP A 1 96 ATOM 1 N GLY A 1 2.234 11.816 7.695 1.00 14.81 N ATOM 2 CA GLY A 1 2.202 10.391 8.057 1.00 14.05 C ATOM 3 C GLY A 1 1.305 9.646 7.097 1.00 12.69 C ATOM 4 O GLY A 1 1.203 10.022 5.928 1.00 13.57 O ATOM 5 HA3 GLY A 1 1.818 10.282 9.071 1.00 0.00 H ATOM 6 HA2 GLY A 1 3.210 9.980 8.005 1.00 0.00 H ATOM 7 HN3 GLY A 1 1.272 12.207 7.745 1.00 0.00 H ATOM 8 HN2 GLY A 1 2.601 11.918 6.727 1.00 0.00 H ATOM 9 HN1 GLY A 1 2.852 12.327 8.357 1.00 0.00 H ATOM 10 N VAL A 2 0.678 8.582 7.581 1.00 12.38 N ATOM 11 CA VAL A 2 -0.222 7.779 6.767 1.00 11.17 C ATOM 12 C VAL A 2 -1.590 7.716 7.438 1.00 11.75 C ATOM 13 O VAL A 2 -1.705 7.425 8.640 1.00 9.96 O ATOM 14 CB VAL A 2 0.348 6.330 6.495 1.00 11.71 C ATOM 15 CG1 VAL A 2 0.807 5.685 7.775 1.00 17.81 C ATOM 16 CG2 VAL A 2 -0.694 5.442 5.821 1.00 10.24 C ATOM 17 HA VAL A 2 -0.319 8.257 5.792 1.00 0.00 H ATOM 18 HB VAL A 2 1.200 6.438 5.824 1.00 0.00 H ATOM 19 HG11 VAL A 2 1.592 6.292 8.225 1.00 0.00 H ATOM 20 HG12 VAL A 2 -0.034 5.608 8.464 1.00 0.00 H ATOM 21 HG13 VAL A 2 1.195 4.689 7.560 1.00 0.00 H ATOM 22 HG21 VAL A 2 -1.568 5.356 6.466 1.00 0.00 H ATOM 23 HG22 VAL A 2 -0.986 5.885 4.869 1.00 0.00 H ATOM 24 HG23 VAL A 2 -0.270 4.453 5.648 1.00 0.00 H ATOM 25 H VAL A 2 0.835 8.313 8.573 1.00 0.00 H ATOM 26 N GLN A 3 -2.619 8.052 6.669 1.00 10.53 N ATOM 27 CA GLN A 3 -3.980 8.017 7.161 1.00 10.00 C ATOM 28 C GLN A 3 -4.641 6.814 6.536 1.00 11.17 C ATOM 29 O GLN A 3 -4.373 6.486 5.376 1.00 10.98 O ATOM 30 CB GLN A 3 -4.689 9.299 6.779 1.00 9.00 C ATOM 31 CG GLN A 3 -4.062 10.500 7.456 1.00 13.31 C ATOM 32 CD GLN A 3 -4.647 11.803 7.001 1.00 18.34 C ATOM 33 OE1 GLN A 3 -4.317 12.298 5.924 1.00 19.54 O ATOM 34 NE2 GLN A 3 -5.520 12.379 7.821 1.00 21.33 N ATOM 35 HA GLN A 3 -4.016 7.938 8.248 1.00 0.00 H ATOM 36 HB2 GLN A 3 -4.629 9.429 5.698 1.00 0.00 H ATOM 37 HB3 GLN A 3 -5.735 9.229 7.078 1.00 0.00 H ATOM 38 HG2 GLN A 3 -4.211 10.409 8.532 1.00 0.00 H ATOM 39 HG3 GLN A 3 -2.994 10.504 7.237 1.00 0.00 H ATOM 40 HE22 GLN A 3 -5.768 11.922 8.722 1.00 0.00 H ATOM 41 HE21 GLN A 3 -5.956 13.287 7.562 1.00 0.00 H ATOM 42 H GLN A 3 -2.443 8.348 5.688 1.00 0.00 H ATOM 43 N VAL A 4 -5.456 6.124 7.319 1.00 9.74 N ATOM 44 CA VAL A 4 -6.145 4.924 6.853 1.00 11.36 C ATOM 45 C VAL A 4 -7.663 5.068 6.918 1.00 10.89 C ATOM 46 O VAL A 4 -8.220 5.430 7.953 1.00 10.69 O ATOM 47 CB VAL A 4 -5.725 3.682 7.701 1.00 11.38 C ATOM 48 CG1 VAL A 4 -6.472 2.413 7.255 1.00 10.40 C ATOM 49 CG2 VAL A 4 -4.217 3.483 7.615 1.00 12.50 C ATOM 50 HA VAL A 4 -5.853 4.785 5.812 1.00 0.00 H ATOM 51 HB VAL A 4 -6.000 3.869 8.739 1.00 0.00 H ATOM 52 HG11 VAL A 4 -7.545 2.564 7.373 1.00 0.00 H ATOM 53 HG12 VAL A 4 -6.246 2.209 6.209 1.00 0.00 H ATOM 54 HG13 VAL A 4 -6.153 1.570 7.869 1.00 0.00 H ATOM 55 HG21 VAL A 4 -3.932 3.323 6.575 1.00 0.00 H ATOM 56 HG22 VAL A 4 -3.712 4.369 7.999 1.00 0.00 H ATOM 57 HG23 VAL A 4 -3.932 2.615 8.209 1.00 0.00 H ATOM 58 H VAL A 4 -5.610 6.447 8.296 1.00 0.00 H ATOM 59 N GLU A 5 -8.321 4.845 5.793 1.00 9.88 N ATOM 60 CA GLU A 5 -9.776 4.895 5.755 1.00 9.76 C ATOM 61 C GLU A 5 -10.197 3.508 5.310 1.00 7.66 C ATOM 62 O GLU A 5 -9.736 3.025 4.282 1.00 10.01 O ATOM 63 CB GLU A 5 -10.263 5.968 4.766 1.00 11.77 C ATOM 64 CG GLU A 5 -11.792 5.988 4.633 1.00 16.28 C ATOM 65 CD GLU A 5 -12.345 7.161 3.831 1.00 21.64 C ATOM 66 OE1 GLU A 5 -11.556 7.958 3.284 1.00 23.84 O ATOM 67 OE2 GLU A 5 -13.591 7.278 3.756 1.00 27.05 O ATOM 68 HA GLU A 5 -10.205 5.162 6.721 1.00 0.00 H ATOM 69 HB2 GLU A 5 -9.929 6.945 5.116 1.00 0.00 H ATOM 70 HB3 GLU A 5 -9.828 5.766 3.787 1.00 0.00 H ATOM 71 HG2 GLU A 5 -12.103 5.065 4.144 1.00 0.00 H ATOM 72 HG3 GLU A 5 -12.220 6.029 5.635 1.00 0.00 H ATOM 73 H GLU A 5 -7.792 4.631 4.923 1.00 0.00 H ATOM 74 N THR A 6 -10.976 2.809 6.116 1.00 7.74 N ATOM 75 CA THR A 6 -11.424 1.464 5.733 1.00 10.63 C ATOM 76 C THR A 6 -12.590 1.502 4.741 1.00 11.73 C ATOM 77 O THR A 6 -13.528 2.281 4.897 1.00 13.47 O ATOM 78 CB THR A 6 -11.794 0.639 6.958 1.00 11.24 C ATOM 79 OG1 THR A 6 -10.623 0.465 7.763 1.00 16.05 O ATOM 80 CG2 THR A 6 -12.339 -0.727 6.555 1.00 13.34 C ATOM 81 HA THR A 6 -10.584 0.985 5.231 1.00 0.00 H ATOM 82 HB THR A 6 -12.570 1.163 7.516 1.00 0.00 H ATOM 83 HG1 THR A 6 -10.851 -0.071 8.564 1.00 0.00 H ATOM 84 HG23 THR A 6 -13.231 -0.595 5.942 1.00 0.00 H ATOM 85 HG21 THR A 6 -11.582 -1.265 5.985 1.00 0.00 H ATOM 86 HG22 THR A 6 -12.593 -1.294 7.451 1.00 0.00 H ATOM 87 H THR A 6 -11.274 3.213 7.027 1.00 0.00 H ATOM 88 N ILE A 7 -12.509 0.670 3.712 1.00 12.28 N ATOM 89 CA ILE A 7 -13.519 0.592 2.657 1.00 12.36 C ATOM 90 C ILE A 7 -14.343 -0.673 2.830 1.00 14.10 C ATOM 91 O ILE A 7 -15.553 -0.673 2.600 1.00 14.81 O ATOM 92 CB ILE A 7 -12.851 0.573 1.268 1.00 12.99 C ATOM 93 CG1 ILE A 7 -12.033 1.848 1.068 1.00 16.63 C ATOM 94 CG2 ILE A 7 -13.892 0.396 0.166 1.00 12.14 C ATOM 95 CD1 ILE A 7 -11.137 1.789 -0.162 1.00 22.72 C ATOM 96 HA ILE A 7 -14.163 1.468 2.730 1.00 0.00 H ATOM 97 HB ILE A 7 -12.174 -0.280 1.212 1.00 0.00 H ATOM 98 HG12 ILE A 7 -12.719 2.688 0.959 1.00 0.00 H ATOM 99 HG13 ILE A 7 -11.408 2.002 1.947 1.00 0.00 H ATOM 100 HD11 ILE A 7 -10.439 0.958 -0.062 1.00 0.00 H ATOM 101 HD12 ILE A 7 -11.751 1.644 -1.051 1.00 0.00 H ATOM 102 HD13 ILE A 7 -10.582 2.723 -0.251 1.00 0.00 H ATOM 103 HG21 ILE A 7 -14.420 -0.546 0.315 1.00 0.00 H ATOM 104 HG22 ILE A 7 -14.602 1.222 0.203 1.00 0.00 H ATOM 105 HG23 ILE A 7 -13.395 0.386 -0.804 1.00 0.00 H ATOM 106 H ILE A 7 -11.684 0.040 3.652 1.00 0.00 H ATOM 107 N SER A 8 -13.679 -1.758 3.205 1.00 10.54 N ATOM 108 CA SER A 8 -14.351 -3.027 3.436 1.00 12.13 C ATOM 109 C SER A 8 -13.595 -3.686 4.572 1.00 12.12 C ATOM 110 O SER A 8 -12.367 -3.694 4.582 1.00 12.35 O ATOM 111 CB SER A 8 -14.322 -3.902 2.188 1.00 14.94 C ATOM 112 OG SER A 8 -14.943 -5.149 2.441 1.00 19.57 O ATOM 113 HA SER A 8 -15.403 -2.881 3.681 1.00 0.00 H ATOM 114 HB2 SER A 8 -13.287 -4.070 1.892 1.00 0.00 H ATOM 115 HB3 SER A 8 -14.851 -3.395 1.382 1.00 0.00 H ATOM 116 HG SER A 8 -14.915 -5.703 1.621 1.00 0.00 H ATOM 117 H SER A 8 -12.649 -1.700 3.338 1.00 0.00 H ATOM 118 N PRO A 9 -14.312 -4.251 5.549 1.00 13.99 N ATOM 119 CA PRO A 9 -13.654 -4.894 6.689 1.00 14.13 C ATOM 120 C PRO A 9 -12.912 -6.217 6.479 1.00 14.02 C ATOM 121 O PRO A 9 -13.300 -7.064 5.663 1.00 14.57 O ATOM 122 CB PRO A 9 -14.800 -5.063 7.677 1.00 12.92 C ATOM 123 CG PRO A 9 -15.963 -5.374 6.775 1.00 15.12 C ATOM 124 CD PRO A 9 -15.783 -4.350 5.663 1.00 13.92 C ATOM 125 HA PRO A 9 -12.817 -4.269 7.000 1.00 0.00 H ATOM 126 HD3 PRO A 9 -16.227 -4.699 4.731 1.00 0.00 H ATOM 127 HD2 PRO A 9 -16.222 -3.391 5.937 1.00 0.00 H ATOM 128 HG3 PRO A 9 -16.913 -5.236 7.291 1.00 0.00 H ATOM 129 HG2 PRO A 9 -15.905 -6.392 6.390 1.00 0.00 H ATOM 130 HB2 PRO A 9 -14.607 -5.883 8.369 1.00 0.00 H ATOM 131 HB3 PRO A 9 -14.973 -4.147 8.241 1.00 0.00 H ATOM 132 N GLY A 10 -11.837 -6.373 7.241 1.00 12.01 N ATOM 133 CA GLY A 10 -11.067 -7.594 7.209 1.00 13.20 C ATOM 134 C GLY A 10 -11.658 -8.466 8.294 1.00 15.21 C ATOM 135 O GLY A 10 -12.800 -8.249 8.712 1.00 17.64 O ATOM 136 HA3 GLY A 10 -10.016 -7.389 7.414 1.00 0.00 H ATOM 137 HA2 GLY A 10 -11.159 -8.078 6.237 1.00 0.00 H ATOM 138 H GLY A 10 -11.543 -5.601 7.873 1.00 0.00 H ATOM 139 N ASP A 11 -10.911 -9.457 8.762 1.00 16.56 N ATOM 140 CA ASP A 11 -11.436 -10.308 9.819 1.00 17.18 C ATOM 141 C ASP A 11 -11.253 -9.683 11.203 1.00 18.28 C ATOM 142 O ASP A 11 -11.728 -10.221 12.206 1.00 20.97 O ATOM 143 CB ASP A 11 -10.869 -11.735 9.742 1.00 15.65 C ATOM 144 CG ASP A 11 -9.359 -11.817 10.000 1.00 14.46 C ATOM 145 OD1 ASP A 11 -8.711 -10.815 10.359 1.00 13.48 O ATOM 146 OD2 ASP A 11 -8.816 -12.921 9.855 1.00 17.38 O ATOM 147 HA ASP A 11 -12.511 -10.391 9.657 1.00 0.00 H ATOM 148 HB2 ASP A 11 -11.379 -12.348 10.485 1.00 0.00 H ATOM 149 HB3 ASP A 11 -11.070 -12.131 8.747 1.00 0.00 H ATOM 150 H ASP A 11 -9.959 -9.624 8.377 1.00 0.00 H ATOM 151 N GLY A 12 -10.535 -8.562 11.251 1.00 16.72 N ATOM 152 CA GLY A 12 -10.312 -7.866 12.504 1.00 14.97 C ATOM 153 C GLY A 12 -9.379 -8.520 13.503 1.00 16.85 C ATOM 154 O GLY A 12 -9.315 -8.081 14.648 1.00 15.51 O ATOM 155 HA3 GLY A 12 -11.280 -7.746 12.989 1.00 0.00 H ATOM 156 HA2 GLY A 12 -9.902 -6.885 12.266 1.00 0.00 H ATOM 157 H GLY A 12 -10.127 -8.179 10.374 1.00 0.00 H ATOM 158 N ARG A 13 -8.652 -9.557 13.101 1.00 16.97 N ATOM 159 CA ARG A 13 -7.733 -10.201 14.041 1.00 20.24 C ATOM 160 C ARG A 13 -6.436 -10.737 13.461 1.00 18.23 C ATOM 161 O ARG A 13 -5.467 -10.917 14.186 1.00 16.82 O ATOM 162 CB ARG A 13 -8.432 -11.287 14.870 1.00 22.31 C ATOM 163 CG ARG A 13 -9.106 -12.384 14.087 1.00 28.09 C ATOM 164 CD ARG A 13 -9.750 -13.397 15.030 1.00 32.84 C ATOM 165 NE ARG A 13 -8.766 -14.277 15.662 1.00 37.34 N ATOM 166 CZ ARG A 13 -8.540 -14.340 16.971 1.00 38.10 C ATOM 167 NH1 ARG A 13 -9.221 -13.565 17.811 1.00 38.07 N ATOM 168 NH2 ARG A 13 -7.624 -15.174 17.442 1.00 37.69 N ATOM 169 HA ARG A 13 -7.428 -9.376 14.684 1.00 0.00 H ATOM 170 HB2 ARG A 13 -7.684 -11.748 15.515 1.00 0.00 H ATOM 171 HB3 ARG A 13 -9.190 -10.802 15.485 1.00 0.00 H ATOM 172 HG2 ARG A 13 -9.875 -11.949 13.449 1.00 0.00 H ATOM 173 HG3 ARG A 13 -8.365 -12.890 13.468 1.00 0.00 H ATOM 174 HD2 ARG A 13 -10.452 -14.008 14.462 1.00 0.00 H ATOM 175 HD3 ARG A 13 -10.288 -12.857 15.809 1.00 0.00 H ATOM 176 HE ARG A 13 -8.204 -14.897 15.044 1.00 0.00 H ATOM 177 HH12 ARG A 13 -9.039 -13.620 18.833 1.00 0.00 H ATOM 178 HH11 ARG A 13 -9.936 -12.904 17.445 1.00 0.00 H ATOM 179 HH22 ARG A 13 -7.445 -15.226 18.465 1.00 0.00 H ATOM 180 HH21 ARG A 13 -7.084 -15.777 16.788 1.00 0.00 H ATOM 181 H ARG A 13 -8.735 -9.909 12.126 1.00 0.00 H ATOM 182 N THR A 14 -6.408 -10.985 12.160 1.00 16.90 N ATOM 183 CA THR A 14 -5.200 -11.494 11.515 1.00 15.91 C ATOM 184 C THR A 14 -4.411 -10.348 10.891 1.00 15.17 C ATOM 185 O THR A 14 -4.736 -9.886 9.801 1.00 15.02 O ATOM 186 CB THR A 14 -5.558 -12.512 10.439 1.00 17.26 C ATOM 187 OG1 THR A 14 -6.422 -13.507 11.004 1.00 15.97 O ATOM 188 CG2 THR A 14 -4.304 -13.175 9.878 1.00 17.67 C ATOM 189 HA THR A 14 -4.587 -11.980 12.274 1.00 0.00 H ATOM 190 HB THR A 14 -6.065 -11.998 9.622 1.00 0.00 H ATOM 191 HG1 THR A 14 -7.246 -13.074 11.341 1.00 0.00 H ATOM 192 HG23 THR A 14 -3.652 -12.413 9.450 1.00 0.00 H ATOM 193 HG21 THR A 14 -3.780 -13.695 10.680 1.00 0.00 H ATOM 194 HG22 THR A 14 -4.587 -13.889 9.104 1.00 0.00 H ATOM 195 H THR A 14 -7.260 -10.815 11.588 1.00 0.00 H ATOM 196 N PHE A 15 -3.408 -9.864 11.607 1.00 13.68 N ATOM 197 CA PHE A 15 -2.579 -8.772 11.126 1.00 14.40 C ATOM 198 C PHE A 15 -1.199 -9.290 10.738 1.00 15.74 C ATOM 199 O PHE A 15 -0.719 -10.279 11.295 1.00 17.47 O ATOM 200 CB PHE A 15 -2.476 -7.687 12.195 1.00 13.28 C ATOM 201 CG PHE A 15 -3.792 -7.058 12.534 1.00 15.22 C ATOM 202 CD1 PHE A 15 -4.614 -7.620 13.505 1.00 15.20 C ATOM 203 CD2 PHE A 15 -4.225 -5.912 11.864 1.00 15.10 C ATOM 204 CE1 PHE A 15 -5.846 -7.052 13.801 1.00 14.62 C ATOM 205 CE2 PHE A 15 -5.457 -5.336 12.154 1.00 15.79 C ATOM 206 CZ PHE A 15 -6.267 -5.907 13.122 1.00 15.69 C ATOM 207 HA PHE A 15 -3.039 -8.337 10.239 1.00 0.00 H ATOM 208 HB2 PHE A 15 -2.062 -8.132 13.100 1.00 0.00 H ATOM 209 HB3 PHE A 15 -1.804 -6.909 11.834 1.00 0.00 H ATOM 210 HD2 PHE A 15 -3.588 -5.462 11.102 1.00 0.00 H ATOM 211 HE2 PHE A 15 -5.783 -4.441 11.623 1.00 0.00 H ATOM 212 HZ PHE A 15 -7.234 -5.462 13.354 1.00 0.00 H ATOM 213 HE1 PHE A 15 -6.484 -7.500 14.563 1.00 0.00 H ATOM 214 HD1 PHE A 15 -4.289 -8.513 14.038 1.00 0.00 H ATOM 215 H PHE A 15 -3.208 -10.277 12.540 1.00 0.00 H ATOM 216 N PRO A 16 -0.559 -8.644 9.757 1.00 15.71 N ATOM 217 CA PRO A 16 0.770 -9.036 9.282 1.00 16.49 C ATOM 218 C PRO A 16 1.849 -8.839 10.349 1.00 17.06 C ATOM 219 O PRO A 16 1.860 -7.824 11.051 1.00 16.56 O ATOM 220 CB PRO A 16 1.018 -8.075 8.106 1.00 16.29 C ATOM 221 CG PRO A 16 -0.335 -7.597 7.708 1.00 16.38 C ATOM 222 CD PRO A 16 -1.034 -7.452 9.034 1.00 15.54 C ATOM 223 HA PRO A 16 0.812 -10.092 9.016 1.00 0.00 H ATOM 224 HD3 PRO A 16 -0.736 -6.535 9.542 1.00 0.00 H ATOM 225 HD2 PRO A 16 -2.117 -7.465 8.915 1.00 0.00 H ATOM 226 HG3 PRO A 16 -0.840 -8.326 7.074 1.00 0.00 H ATOM 227 HG2 PRO A 16 -0.278 -6.642 7.186 1.00 0.00 H ATOM 228 HB2 PRO A 16 1.643 -7.239 8.419 1.00 0.00 H ATOM 229 HB3 PRO A 16 1.499 -8.597 7.279 1.00 0.00 H ATOM 230 N LYS A 17 2.756 -9.802 10.455 1.00 17.94 N ATOM 231 CA LYS A 17 3.865 -9.725 11.397 1.00 17.75 C ATOM 232 C LYS A 17 5.142 -9.608 10.551 1.00 16.86 C ATOM 233 O LYS A 17 5.185 -10.092 9.417 1.00 16.24 O ATOM 234 CB LYS A 17 3.891 -10.983 12.268 1.00 21.08 C ATOM 235 CG LYS A 17 2.554 -11.288 12.934 1.00 27.08 C ATOM 236 CD LYS A 17 2.285 -12.797 12.967 1.00 34.53 C ATOM 237 CE LYS A 17 0.785 -13.132 12.880 1.00 37.69 C ATOM 238 NZ LYS A 17 0.183 -12.858 11.524 1.00 33.89 N ATOM 239 HA LYS A 17 3.772 -8.871 12.068 1.00 0.00 H ATOM 240 HB2 LYS A 17 4.166 -11.831 11.641 1.00 0.00 H ATOM 241 HB3 LYS A 17 4.642 -10.849 13.046 1.00 0.00 H ATOM 242 HG2 LYS A 17 2.569 -10.906 13.955 1.00 0.00 H ATOM 243 HG3 LYS A 17 1.757 -10.796 12.376 1.00 0.00 H ATOM 244 HD2 LYS A 17 2.796 -13.262 12.124 1.00 0.00 H ATOM 245 HD3 LYS A 17 2.680 -13.202 13.898 1.00 0.00 H ATOM 246 HE2 LYS A 17 0.254 -12.533 13.620 1.00 0.00 H ATOM 247 HE3 LYS A 17 0.654 -14.190 13.108 1.00 0.00 H ATOM 248 HZ1 LYS A 17 0.290 -11.849 11.296 1.00 0.00 H ATOM 249 HZ2 LYS A 17 0.672 -13.431 10.807 1.00 0.00 H ATOM 250 HZ3 LYS A 17 -0.827 -13.106 11.538 1.00 0.00 H ATOM 251 H LYS A 17 2.672 -10.640 9.845 1.00 0.00 H ATOM 252 N ARG A 18 6.165 -8.936 11.068 1.00 16.95 N ATOM 253 CA ARG A 18 7.412 -8.786 10.319 1.00 19.98 C ATOM 254 C ARG A 18 7.911 -10.168 9.900 1.00 19.01 C ATOM 255 O ARG A 18 7.837 -11.131 10.670 1.00 17.32 O ATOM 256 CB ARG A 18 8.464 -8.055 11.156 1.00 24.76 C ATOM 257 CG ARG A 18 8.129 -6.596 11.428 1.00 33.59 C ATOM 258 CD ARG A 18 8.982 -6.016 12.554 1.00 40.80 C ATOM 259 NE ARG A 18 8.520 -4.690 12.975 1.00 49.70 N ATOM 260 CZ ARG A 18 7.564 -4.468 13.880 1.00 52.39 C ATOM 261 NH1 ARG A 18 6.949 -5.484 14.474 1.00 54.30 N ATOM 262 NH2 ARG A 18 7.241 -3.224 14.218 1.00 52.72 N ATOM 263 HA ARG A 18 7.229 -8.185 9.428 1.00 0.00 H ATOM 264 HB2 ARG A 18 8.561 -8.569 12.112 1.00 0.00 H ATOM 265 HB3 ARG A 18 9.415 -8.096 10.625 1.00 0.00 H ATOM 266 HG2 ARG A 18 8.304 -6.019 10.520 1.00 0.00 H ATOM 267 HG3 ARG A 18 7.078 -6.522 11.708 1.00 0.00 H ATOM 268 HD2 ARG A 18 10.012 -5.935 12.208 1.00 0.00 H ATOM 269 HD3 ARG A 18 8.940 -6.690 13.409 1.00 0.00 H ATOM 270 HE ARG A 18 8.970 -3.861 12.536 1.00 0.00 H ATOM 271 HH12 ARG A 18 6.205 -5.302 15.178 1.00 0.00 H ATOM 272 HH11 ARG A 18 7.211 -6.462 14.235 1.00 0.00 H ATOM 273 HH22 ARG A 18 6.496 -3.054 14.923 1.00 0.00 H ATOM 274 HH21 ARG A 18 7.733 -2.421 13.777 1.00 0.00 H ATOM 275 H ARG A 18 6.078 -8.513 12.014 1.00 0.00 H ATOM 276 N GLY A 19 8.371 -10.283 8.662 1.00 18.21 N ATOM 277 CA GLY A 19 8.838 -11.571 8.195 1.00 16.68 C ATOM 278 C GLY A 19 7.803 -12.290 7.364 1.00 16.42 C ATOM 279 O GLY A 19 8.127 -13.237 6.652 1.00 18.44 O ATOM 280 HA3 GLY A 19 9.085 -12.189 9.059 1.00 0.00 H ATOM 281 HA2 GLY A 19 9.732 -11.421 7.589 1.00 0.00 H ATOM 282 H GLY A 19 8.396 -9.456 8.032 1.00 0.00 H ATOM 283 N GLN A 20 6.546 -11.875 7.470 1.00 15.18 N ATOM 284 CA GLN A 20 5.487 -12.487 6.677 1.00 13.90 C ATOM 285 C GLN A 20 5.369 -11.756 5.342 1.00 14.03 C ATOM 286 O GLN A 20 5.637 -10.550 5.256 1.00 13.79 O ATOM 287 CB GLN A 20 4.146 -12.424 7.407 1.00 13.07 C ATOM 288 CG GLN A 20 4.016 -13.421 8.535 1.00 16.11 C ATOM 289 CD GLN A 20 2.613 -13.497 9.089 1.00 17.08 C ATOM 290 OE1 GLN A 20 2.082 -12.513 9.592 1.00 18.63 O ATOM 291 NE2 GLN A 20 2.005 -14.668 9.003 1.00 17.20 N ATOM 292 HA GLN A 20 5.741 -13.534 6.513 1.00 0.00 H ATOM 293 HB2 GLN A 20 4.026 -11.422 7.819 1.00 0.00 H ATOM 294 HB3 GLN A 20 3.352 -12.617 6.685 1.00 0.00 H ATOM 295 HG2 GLN A 20 4.298 -14.406 8.164 1.00 0.00 H ATOM 296 HG3 GLN A 20 4.693 -13.129 9.338 1.00 0.00 H ATOM 297 HE22 GLN A 20 2.493 -15.477 8.568 1.00 0.00 H ATOM 298 HE21 GLN A 20 1.038 -14.780 9.370 1.00 0.00 H ATOM 299 H GLN A 20 6.314 -11.103 8.127 1.00 0.00 H ATOM 300 N THR A 21 4.983 -12.492 4.305 1.00 14.51 N ATOM 301 CA THR A 21 4.800 -11.929 2.972 1.00 14.44 C ATOM 302 C THR A 21 3.352 -11.497 2.835 1.00 12.09 C ATOM 303 O THR A 21 2.437 -12.291 3.074 1.00 13.78 O ATOM 304 CB THR A 21 5.121 -12.969 1.848 1.00 16.49 C ATOM 305 OG1 THR A 21 6.537 -13.192 1.783 1.00 17.97 O ATOM 306 CG2 THR A 21 4.631 -12.463 0.482 1.00 16.73 C ATOM 307 HA THR A 21 5.484 -11.089 2.857 1.00 0.00 H ATOM 308 HB THR A 21 4.607 -13.900 2.087 1.00 0.00 H ATOM 309 HG1 THR A 21 6.734 -13.851 1.070 1.00 0.00 H ATOM 310 HG23 THR A 21 3.555 -12.291 0.524 1.00 0.00 H ATOM 311 HG21 THR A 21 5.140 -11.531 0.238 1.00 0.00 H ATOM 312 HG22 THR A 21 4.852 -13.210 -0.281 1.00 0.00 H ATOM 313 H THR A 21 4.805 -13.506 4.449 1.00 0.00 H ATOM 314 N CYS A 22 3.153 -10.219 2.543 1.00 12.30 N ATOM 315 CA CYS A 22 1.816 -9.661 2.339 1.00 11.95 C ATOM 316 C CYS A 22 1.434 -9.731 0.868 1.00 10.19 C ATOM 317 O CYS A 22 2.173 -9.243 0.012 1.00 10.61 O ATOM 318 CB CYS A 22 1.785 -8.197 2.759 1.00 12.41 C ATOM 319 SG CYS A 22 2.119 -7.984 4.463 1.00 17.03 S ATOM 320 HA CYS A 22 1.116 -10.242 2.940 1.00 0.00 H ATOM 321 HB2 CYS A 22 0.797 -7.791 2.542 1.00 0.00 H ATOM 322 HB3 CYS A 22 2.534 -7.652 2.184 1.00 0.00 H ATOM 323 HG CYS A 22 2.075 -6.640 4.774 1.00 0.00 H ATOM 324 H CYS A 22 3.977 -9.591 2.456 1.00 0.00 H ATOM 325 N VAL A 23 0.282 -10.323 0.574 1.00 10.99 N ATOM 326 CA VAL A 23 -0.193 -10.424 -0.800 1.00 10.96 C ATOM 327 C VAL A 23 -1.331 -9.414 -0.919 1.00 10.47 C ATOM 328 O VAL A 23 -2.332 -9.519 -0.211 1.00 10.80 O ATOM 329 CB VAL A 23 -0.671 -11.851 -1.119 1.00 11.32 C ATOM 330 CG1 VAL A 23 -1.017 -11.978 -2.592 1.00 9.65 C ATOM 331 CG2 VAL A 23 0.420 -12.862 -0.755 1.00 10.85 C ATOM 332 HA VAL A 23 0.601 -10.210 -1.515 1.00 0.00 H ATOM 333 HB VAL A 23 -1.564 -12.057 -0.529 1.00 0.00 H ATOM 334 HG11 VAL A 23 -1.811 -11.274 -2.839 1.00 0.00 H ATOM 335 HG12 VAL A 23 -0.134 -11.757 -3.192 1.00 0.00 H ATOM 336 HG13 VAL A 23 -1.353 -12.994 -2.799 1.00 0.00 H ATOM 337 HG21 VAL A 23 1.320 -12.647 -1.332 1.00 0.00 H ATOM 338 HG22 VAL A 23 0.642 -12.787 0.309 1.00 0.00 H ATOM 339 HG23 VAL A 23 0.072 -13.869 -0.985 1.00 0.00 H ATOM 340 H VAL A 23 -0.294 -10.724 1.342 1.00 0.00 H ATOM 341 N VAL A 24 -1.169 -8.434 -1.803 1.00 10.23 N ATOM 342 CA VAL A 24 -2.152 -7.373 -1.958 1.00 10.84 C ATOM 343 C VAL A 24 -2.434 -6.956 -3.393 1.00 10.56 C ATOM 344 O VAL A 24 -1.639 -7.195 -4.297 1.00 12.12 O ATOM 345 CB VAL A 24 -1.670 -6.051 -1.264 1.00 12.97 C ATOM 346 CG1 VAL A 24 -1.209 -6.295 0.173 1.00 15.74 C ATOM 347 CG2 VAL A 24 -0.563 -5.396 -2.067 1.00 14.06 C ATOM 348 HA VAL A 24 -3.048 -7.808 -1.515 1.00 0.00 H ATOM 349 HB VAL A 24 -2.526 -5.377 -1.226 1.00 0.00 H ATOM 350 HG11 VAL A 24 -2.036 -6.704 0.754 1.00 0.00 H ATOM 351 HG12 VAL A 24 -0.379 -7.002 0.172 1.00 0.00 H ATOM 352 HG13 VAL A 24 -0.884 -5.353 0.614 1.00 0.00 H ATOM 353 HG21 VAL A 24 0.281 -6.081 -2.146 1.00 0.00 H ATOM 354 HG22 VAL A 24 -0.932 -5.156 -3.064 1.00 0.00 H ATOM 355 HG23 VAL A 24 -0.245 -4.481 -1.566 1.00 0.00 H ATOM 356 H VAL A 24 -0.317 -8.426 -2.399 1.00 0.00 H ATOM 357 N HIS A 25 -3.579 -6.315 -3.596 1.00 8.64 N ATOM 358 CA HIS A 25 -3.898 -5.739 -4.895 1.00 6.75 C ATOM 359 C HIS A 25 -4.058 -4.262 -4.544 1.00 7.77 C ATOM 360 O HIS A 25 -4.618 -3.929 -3.497 1.00 10.32 O ATOM 361 CB HIS A 25 -5.158 -6.352 -5.519 1.00 8.26 C ATOM 362 CG HIS A 25 -4.867 -7.296 -6.647 1.00 8.77 C ATOM 363 ND1 HIS A 25 -3.992 -6.989 -7.666 1.00 9.85 N ATOM 364 CD2 HIS A 25 -5.317 -8.547 -6.905 1.00 11.39 C ATOM 365 CE1 HIS A 25 -3.913 -8.009 -8.504 1.00 11.69 C ATOM 366 NE2 HIS A 25 -4.708 -8.967 -8.065 1.00 12.04 N ATOM 367 HA HIS A 25 -3.143 -5.923 -5.659 1.00 0.00 H ATOM 368 HB2 HIS A 25 -5.698 -6.896 -4.744 1.00 0.00 H ATOM 369 HB3 HIS A 25 -5.784 -5.544 -5.897 1.00 0.00 H ATOM 370 HD2 HIS A 25 -6.029 -9.115 -6.306 1.00 0.00 H ATOM 371 HE1 HIS A 25 -3.297 -8.051 -9.403 1.00 0.00 H ATOM 372 H HIS A 25 -4.259 -6.223 -2.815 1.00 0.00 H ATOM 373 N TYR A 26 -3.488 -3.384 -5.360 1.00 7.36 N ATOM 374 CA TYR A 26 -3.535 -1.957 -5.089 1.00 9.07 C ATOM 375 C TYR A 26 -3.691 -1.129 -6.344 1.00 8.95 C ATOM 376 O TYR A 26 -3.401 -1.585 -7.459 1.00 9.96 O ATOM 377 CB TYR A 26 -2.217 -1.501 -4.407 1.00 7.69 C ATOM 378 CG TYR A 26 -1.008 -1.465 -5.352 1.00 8.36 C ATOM 379 CD1 TYR A 26 -0.748 -0.347 -6.158 1.00 8.45 C ATOM 380 CD2 TYR A 26 -0.196 -2.580 -5.514 1.00 9.87 C ATOM 381 CE1 TYR A 26 0.276 -0.361 -7.113 1.00 6.83 C ATOM 382 CE2 TYR A 26 0.829 -2.601 -6.458 1.00 8.17 C ATOM 383 CZ TYR A 26 1.056 -1.494 -7.255 1.00 10.47 C ATOM 384 OH TYR A 26 2.049 -1.534 -8.200 1.00 9.10 O ATOM 385 HA TYR A 26 -4.401 -1.801 -4.446 1.00 0.00 H ATOM 386 HB3 TYR A 26 -1.996 -2.190 -3.592 1.00 0.00 H ATOM 387 HB2 TYR A 26 -2.368 -0.500 -4.004 1.00 0.00 H ATOM 388 HD2 TYR A 26 -0.364 -3.457 -4.889 1.00 0.00 H ATOM 389 HE2 TYR A 26 1.451 -3.489 -6.568 1.00 0.00 H ATOM 390 HE1 TYR A 26 0.457 0.513 -7.739 1.00 0.00 H ATOM 391 HD1 TYR A 26 -1.355 0.550 -6.039 1.00 0.00 H ATOM 392 HH TYR A 26 2.080 -0.669 -8.681 1.00 0.00 H ATOM 393 H TYR A 26 -2.997 -3.724 -6.211 1.00 0.00 H ATOM 394 N THR A 27 -4.137 0.103 -6.135 1.00 8.11 N ATOM 395 CA THR A 27 -4.215 1.104 -7.178 1.00 8.43 C ATOM 396 C THR A 27 -3.593 2.345 -6.517 1.00 6.41 C ATOM 397 O THR A 27 -4.028 2.783 -5.455 1.00 8.20 O ATOM 398 CB THR A 27 -5.653 1.394 -7.650 1.00 10.61 C ATOM 399 OG1 THR A 27 -6.169 0.245 -8.322 1.00 9.13 O ATOM 400 CG2 THR A 27 -5.663 2.573 -8.617 1.00 10.75 C ATOM 401 HA THR A 27 -3.705 0.778 -8.084 1.00 0.00 H ATOM 402 HB THR A 27 -6.267 1.633 -6.782 1.00 0.00 H ATOM 403 HG1 THR A 27 -5.598 0.037 -9.104 1.00 0.00 H ATOM 404 HG23 THR A 27 -5.271 3.457 -8.114 1.00 0.00 H ATOM 405 HG21 THR A 27 -5.041 2.338 -9.481 1.00 0.00 H ATOM 406 HG22 THR A 27 -6.685 2.764 -8.945 1.00 0.00 H ATOM 407 H THR A 27 -4.445 0.362 -5.176 1.00 0.00 H ATOM 408 N GLY A 28 -2.519 2.851 -7.097 1.00 5.81 N ATOM 409 CA GLY A 28 -1.878 4.023 -6.559 1.00 7.88 C ATOM 410 C GLY A 28 -2.242 5.230 -7.387 1.00 11.75 C ATOM 411 O GLY A 28 -2.204 5.199 -8.624 1.00 10.75 O ATOM 412 HA3 GLY A 28 -0.797 3.885 -6.576 1.00 0.00 H ATOM 413 HA2 GLY A 28 -2.207 4.176 -5.531 1.00 0.00 H ATOM 414 H GLY A 28 -2.133 2.399 -7.950 1.00 0.00 H ATOM 415 N MET A 29 -2.613 6.306 -6.713 1.00 12.61 N ATOM 416 CA MET A 29 -2.974 7.516 -7.421 1.00 16.14 C ATOM 417 C MET A 29 -2.450 8.769 -6.746 1.00 17.29 C ATOM 418 O MET A 29 -1.979 8.733 -5.602 1.00 13.36 O ATOM 419 CB MET A 29 -4.495 7.581 -7.655 1.00 20.42 C ATOM 420 CG MET A 29 -5.370 7.452 -6.419 1.00 23.17 C ATOM 421 SD MET A 29 -6.948 6.583 -6.747 1.00 24.14 S ATOM 422 CE MET A 29 -6.756 5.127 -5.670 1.00 17.68 C ATOM 423 HA MET A 29 -2.485 7.476 -8.394 1.00 0.00 H ATOM 424 HB2 MET A 29 -4.719 8.540 -8.123 1.00 0.00 H ATOM 425 HB3 MET A 29 -4.762 6.774 -8.337 1.00 0.00 H ATOM 426 HG2 MET A 29 -5.594 8.451 -6.046 1.00 0.00 H ATOM 427 HG3 MET A 29 -4.819 6.897 -5.659 1.00 0.00 H ATOM 428 HE1 MET A 29 -5.873 4.565 -5.975 1.00 0.00 H ATOM 429 HE2 MET A 29 -6.641 5.454 -4.637 1.00 0.00 H ATOM 430 HE3 MET A 29 -7.639 4.494 -5.756 1.00 0.00 H ATOM 431 H MET A 29 -2.645 6.283 -5.674 1.00 0.00 H ATOM 432 N LEU A 30 -2.364 9.834 -7.537 1.00 17.87 N ATOM 433 CA LEU A 30 -1.927 11.130 -7.039 1.00 21.21 C ATOM 434 C LEU A 30 -3.118 11.731 -6.276 1.00 22.57 C ATOM 435 O LEU A 30 -4.236 11.189 -6.314 1.00 18.70 O ATOM 436 CB LEU A 30 -1.516 12.021 -8.215 1.00 21.24 C ATOM 437 CG LEU A 30 -0.028 12.152 -8.578 1.00 24.27 C ATOM 438 CD1 LEU A 30 0.806 10.938 -8.209 1.00 22.72 C ATOM 439 CD2 LEU A 30 0.108 12.455 -10.051 1.00 23.76 C ATOM 440 HA LEU A 30 -1.062 11.042 -6.381 1.00 0.00 H ATOM 441 HB2 LEU A 30 -2.026 11.637 -9.098 1.00 0.00 H ATOM 442 HB3 LEU A 30 -1.879 13.025 -7.995 1.00 0.00 H ATOM 443 HG LEU A 30 0.367 12.974 -7.981 1.00 0.00 H ATOM 444 HD21 LEU A 30 -0.337 11.646 -10.630 1.00 0.00 H ATOM 445 HD22 LEU A 30 -0.405 13.390 -10.277 1.00 0.00 H ATOM 446 HD23 LEU A 30 1.164 12.547 -10.306 1.00 0.00 H ATOM 447 HD11 LEU A 30 0.750 10.773 -7.133 1.00 0.00 H ATOM 448 HD12 LEU A 30 0.422 10.062 -8.732 1.00 0.00 H ATOM 449 HD13 LEU A 30 1.843 11.110 -8.498 1.00 0.00 H ATOM 450 H LEU A 30 -2.616 9.738 -8.541 1.00 0.00 H ATOM 451 N GLU A 31 -2.893 12.843 -5.589 1.00 23.29 N ATOM 452 CA GLU A 31 -3.965 13.477 -4.834 1.00 27.68 C ATOM 453 C GLU A 31 -5.177 13.864 -5.702 1.00 30.39 C ATOM 454 O GLU A 31 -6.323 13.784 -5.251 1.00 30.18 O ATOM 455 CB GLU A 31 -3.423 14.688 -4.089 1.00 28.77 C ATOM 456 CG GLU A 31 -4.347 15.186 -3.007 1.00 31.02 C ATOM 457 CD GLU A 31 -3.617 15.947 -1.937 1.00 33.05 C ATOM 458 OE1 GLU A 31 -2.676 16.706 -2.277 1.00 32.13 O ATOM 459 OE2 GLU A 31 -3.984 15.767 -0.755 1.00 34.36 O ATOM 460 HA GLU A 31 -4.333 12.740 -4.120 1.00 0.00 H ATOM 461 HB2 GLU A 31 -2.471 14.416 -3.633 1.00 0.00 H ATOM 462 HB3 GLU A 31 -3.264 15.493 -4.806 1.00 0.00 H ATOM 463 HG2 GLU A 31 -5.092 15.842 -3.457 1.00 0.00 H ATOM 464 HG3 GLU A 31 -4.845 14.331 -2.551 1.00 0.00 H ATOM 465 H GLU A 31 -1.943 13.266 -5.589 1.00 0.00 H ATOM 466 N ASP A 32 -4.925 14.235 -6.957 1.00 30.87 N ATOM 467 CA ASP A 32 -5.997 14.618 -7.880 1.00 32.67 C ATOM 468 C ASP A 32 -6.713 13.427 -8.525 1.00 32.27 C ATOM 469 O ASP A 32 -7.341 13.567 -9.577 1.00 33.71 O ATOM 470 CB ASP A 32 -5.471 15.576 -8.958 1.00 35.01 C ATOM 471 CG ASP A 32 -4.366 14.966 -9.814 1.00 41.43 C ATOM 472 OD1 ASP A 32 -3.671 14.040 -9.342 1.00 45.23 O ATOM 473 OD2 ASP A 32 -4.180 15.421 -10.968 1.00 44.27 O ATOM 474 HA ASP A 32 -6.744 15.129 -7.272 1.00 0.00 H ATOM 475 HB2 ASP A 32 -6.300 15.855 -9.609 1.00 0.00 H ATOM 476 HB3 ASP A 32 -5.079 16.467 -8.469 1.00 0.00 H ATOM 477 H ASP A 32 -3.940 14.253 -7.291 1.00 0.00 H ATOM 478 N GLY A 33 -6.580 12.250 -7.917 1.00 30.04 N ATOM 479 CA GLY A 33 -7.234 11.055 -8.422 1.00 25.25 C ATOM 480 C GLY A 33 -6.638 10.365 -9.636 1.00 24.48 C ATOM 481 O GLY A 33 -7.080 9.276 -9.975 1.00 24.72 O ATOM 482 HA3 GLY A 33 -8.257 11.331 -8.677 1.00 0.00 H ATOM 483 HA2 GLY A 33 -7.247 10.327 -7.611 1.00 0.00 H ATOM 484 H GLY A 33 -5.994 12.184 -7.060 1.00 0.00 H ATOM 485 N LYS A 34 -5.633 10.950 -10.283 1.00 23.68 N ATOM 486 CA LYS A 34 -5.051 10.308 -11.464 1.00 23.99 C ATOM 487 C LYS A 34 -4.233 9.049 -11.138 1.00 20.64 C ATOM 488 O LYS A 34 -3.347 9.067 -10.272 1.00 16.70 O ATOM 489 CB LYS A 34 -4.226 11.300 -12.297 1.00 28.59 C ATOM 490 CG LYS A 34 -2.777 11.477 -11.863 1.00 35.81 C ATOM 491 CD LYS A 34 -1.973 12.278 -12.888 1.00 38.38 C ATOM 492 CE LYS A 34 -1.801 11.509 -14.194 1.00 41.09 C ATOM 493 NZ LYS A 34 -0.903 10.319 -14.066 1.00 43.92 N ATOM 494 HA LYS A 34 -5.898 9.974 -12.064 1.00 0.00 H ATOM 495 HB2 LYS A 34 -4.227 10.953 -13.330 1.00 0.00 H ATOM 496 HB3 LYS A 34 -4.714 12.273 -12.241 1.00 0.00 H ATOM 497 HG2 LYS A 34 -2.756 12.002 -10.908 1.00 0.00 H ATOM 498 HG3 LYS A 34 -2.321 10.494 -11.746 1.00 0.00 H ATOM 499 HD2 LYS A 34 -2.494 13.213 -13.094 1.00 0.00 H ATOM 500 HD3 LYS A 34 -0.989 12.496 -12.473 1.00 0.00 H ATOM 501 HE2 LYS A 34 -1.379 12.183 -14.940 1.00 0.00 H ATOM 502 HE3 LYS A 34 -2.781 11.169 -14.527 1.00 0.00 H ATOM 503 HZ1 LYS A 34 0.041 10.630 -13.758 1.00 0.00 H ATOM 504 HZ2 LYS A 34 -1.299 9.661 -13.364 1.00 0.00 H ATOM 505 HZ3 LYS A 34 -0.829 9.842 -14.987 1.00 0.00 H ATOM 506 H LYS A 34 -5.261 11.862 -9.950 1.00 0.00 H ATOM 507 N LYS A 35 -4.551 7.961 -11.834 1.00 18.59 N ATOM 508 CA LYS A 35 -3.894 6.678 -11.637 1.00 19.54 C ATOM 509 C LYS A 35 -2.448 6.642 -12.127 1.00 21.78 C ATOM 510 O LYS A 35 -2.173 6.974 -13.287 1.00 20.30 O ATOM 511 CB LYS A 35 -4.698 5.573 -12.322 1.00 19.78 C ATOM 512 CG LYS A 35 -4.133 4.167 -12.080 1.00 24.67 C ATOM 513 CD LYS A 35 -4.924 3.086 -12.790 1.00 26.05 C ATOM 514 CE LYS A 35 -4.692 3.126 -14.284 1.00 28.16 C ATOM 515 NZ LYS A 35 -5.416 2.012 -14.963 1.00 30.52 N ATOM 516 HA LYS A 35 -3.857 6.517 -10.560 1.00 0.00 H ATOM 517 HB2 LYS A 35 -5.720 5.604 -11.944 1.00 0.00 H ATOM 518 HB3 LYS A 35 -4.703 5.764 -13.395 1.00 0.00 H ATOM 519 HG2 LYS A 35 -3.104 4.138 -12.438 1.00 0.00 H ATOM 520 HG3 LYS A 35 -4.149 3.964 -11.009 1.00 0.00 H ATOM 521 HD2 LYS A 35 -4.616 2.112 -12.409 1.00 0.00 H ATOM 522 HD3 LYS A 35 -5.985 3.234 -12.591 1.00 0.00 H ATOM 523 HE2 LYS A 35 -3.624 3.032 -14.483 1.00 0.00 H ATOM 524 HE3 LYS A 35 -5.051 4.077 -14.676 1.00 0.00 H ATOM 525 HZ1 LYS A 35 -5.073 1.102 -14.594 1.00 0.00 H ATOM 526 HZ2 LYS A 35 -6.436 2.100 -14.779 1.00 0.00 H ATOM 527 HZ3 LYS A 35 -5.242 2.060 -15.987 1.00 0.00 H ATOM 528 H LYS A 35 -5.302 8.031 -12.550 1.00 0.00 H ATOM 529 N VAL A 36 -1.525 6.253 -11.239 1.00 21.63 N ATOM 530 CA VAL A 36 -0.101 6.158 -11.599 1.00 18.56 C ATOM 531 C VAL A 36 0.256 4.705 -11.910 1.00 16.35 C ATOM 532 O VAL A 36 0.992 4.431 -12.859 1.00 15.12 O ATOM 533 CB VAL A 36 0.867 6.720 -10.490 1.00 18.10 C ATOM 534 CG1 VAL A 36 0.279 7.923 -9.786 1.00 16.95 C ATOM 535 CG2 VAL A 36 1.224 5.680 -9.509 1.00 19.88 C ATOM 536 HA VAL A 36 0.040 6.784 -12.480 1.00 0.00 H ATOM 537 HB VAL A 36 1.776 7.039 -11.000 1.00 0.00 H ATOM 538 HG11 VAL A 36 0.096 8.714 -10.513 1.00 0.00 H ATOM 539 HG12 VAL A 36 -0.660 7.641 -9.310 1.00 0.00 H ATOM 540 HG13 VAL A 36 0.979 8.278 -9.030 1.00 0.00 H ATOM 541 HG21 VAL A 36 0.319 5.313 -9.025 1.00 0.00 H ATOM 542 HG22 VAL A 36 1.724 4.857 -10.020 1.00 0.00 H ATOM 543 HG23 VAL A 36 1.892 6.104 -8.759 1.00 0.00 H ATOM 544 H VAL A 36 -1.821 6.012 -10.272 1.00 0.00 H ATOM 545 N ASP A 37 -0.266 3.782 -11.099 1.00 13.92 N ATOM 546 CA ASP A 37 -0.022 2.358 -11.277 1.00 12.58 C ATOM 547 C ASP A 37 -1.015 1.487 -10.515 1.00 11.69 C ATOM 548 O ASP A 37 -1.517 1.870 -9.461 1.00 11.75 O ATOM 549 CB ASP A 37 1.402 1.978 -10.857 1.00 14.69 C ATOM 550 CG ASP A 37 1.744 0.554 -11.241 1.00 17.94 C ATOM 551 OD1 ASP A 37 1.623 0.243 -12.445 1.00 17.69 O ATOM 552 OD2 ASP A 37 2.087 -0.261 -10.354 1.00 14.47 O ATOM 553 HA ASP A 37 -0.153 2.169 -12.342 1.00 0.00 H ATOM 554 HB2 ASP A 37 2.105 2.653 -11.344 1.00 0.00 H ATOM 555 HB3 ASP A 37 1.490 2.082 -9.776 1.00 0.00 H ATOM 556 H ASP A 37 -0.869 4.092 -10.311 1.00 0.00 H ATOM 557 N SER A 38 -1.294 0.307 -11.052 1.00 9.70 N ATOM 558 CA SER A 38 -2.221 -0.609 -10.416 1.00 10.92 C ATOM 559 C SER A 38 -1.880 -2.050 -10.729 1.00 10.60 C ATOM 560 O SER A 38 -1.645 -2.420 -11.882 1.00 11.59 O ATOM 561 CB SER A 38 -3.660 -0.309 -10.860 1.00 10.31 C ATOM 562 OG SER A 38 -4.569 -1.242 -10.295 1.00 11.17 O ATOM 563 HA SER A 38 -2.137 -0.465 -9.339 1.00 0.00 H ATOM 564 HB2 SER A 38 -3.718 -0.367 -11.947 1.00 0.00 H ATOM 565 HB3 SER A 38 -3.932 0.696 -10.536 1.00 0.00 H ATOM 566 HG SER A 38 -4.522 -1.190 -9.307 1.00 0.00 H ATOM 567 H SER A 38 -0.839 0.033 -11.946 1.00 0.00 H ATOM 568 N SER A 39 -1.857 -2.869 -9.689 1.00 11.64 N ATOM 569 CA SER A 39 -1.566 -4.284 -9.838 1.00 12.02 C ATOM 570 C SER A 39 -2.756 -4.982 -10.459 1.00 15.43 C ATOM 571 O SER A 39 -2.602 -6.034 -11.079 1.00 13.97 O ATOM 572 CB SER A 39 -1.248 -4.920 -8.480 1.00 11.05 C ATOM 573 OG SER A 39 -2.318 -4.760 -7.565 1.00 10.34 O ATOM 574 HA SER A 39 -0.695 -4.394 -10.484 1.00 0.00 H ATOM 575 HB2 SER A 39 -0.356 -4.447 -8.068 1.00 0.00 H ATOM 576 HB3 SER A 39 -1.061 -5.984 -8.623 1.00 0.00 H ATOM 577 HG SER A 39 -3.130 -5.192 -7.930 1.00 0.00 H ATOM 578 H SER A 39 -2.052 -2.489 -8.741 1.00 0.00 H ATOM 579 N ARG A 40 -3.941 -4.389 -10.312 1.00 14.38 N ATOM 580 CA ARG A 40 -5.148 -4.989 -10.866 1.00 17.76 C ATOM 581 C ARG A 40 -5.062 -4.984 -12.380 1.00 17.34 C ATOM 582 O ARG A 40 -5.703 -5.788 -13.044 1.00 18.64 O ATOM 583 CB ARG A 40 -6.407 -4.283 -10.347 1.00 18.73 C ATOM 584 CG ARG A 40 -6.685 -4.569 -8.874 1.00 23.17 C ATOM 585 CD ARG A 40 -7.754 -3.637 -8.271 1.00 29.44 C ATOM 586 NE ARG A 40 -7.981 -3.881 -6.836 1.00 34.32 N ATOM 587 CZ ARG A 40 -7.729 -2.995 -5.867 1.00 37.88 C ATOM 588 NH1 ARG A 40 -7.244 -1.791 -6.161 1.00 37.22 N ATOM 589 NH2 ARG A 40 -7.962 -3.307 -4.594 1.00 37.07 N ATOM 590 HA ARG A 40 -5.224 -6.025 -10.535 1.00 0.00 H ATOM 591 HB2 ARG A 40 -6.281 -3.208 -10.475 1.00 0.00 H ATOM 592 HB3 ARG A 40 -7.262 -4.619 -10.934 1.00 0.00 H ATOM 593 HG2 ARG A 40 -7.028 -5.599 -8.779 1.00 0.00 H ATOM 594 HG3 ARG A 40 -5.758 -4.443 -8.314 1.00 0.00 H ATOM 595 HD2 ARG A 40 -8.692 -3.792 -8.804 1.00 0.00 H ATOM 596 HD3 ARG A 40 -7.430 -2.605 -8.402 1.00 0.00 H ATOM 597 HE ARG A 40 -8.364 -4.807 -6.557 1.00 0.00 H ATOM 598 HH12 ARG A 40 -7.051 -1.108 -5.401 1.00 0.00 H ATOM 599 HH11 ARG A 40 -7.058 -1.533 -7.151 1.00 0.00 H ATOM 600 HH22 ARG A 40 -7.764 -2.614 -3.844 1.00 0.00 H ATOM 601 HH21 ARG A 40 -8.342 -4.244 -4.349 1.00 0.00 H ATOM 602 H ARG A 40 -4.005 -3.488 -9.796 1.00 0.00 H ATOM 603 N ASP A 41 -4.222 -4.112 -12.916 1.00 16.80 N ATOM 604 CA ASP A 41 -4.008 -4.044 -14.358 1.00 18.38 C ATOM 605 C ASP A 41 -2.990 -5.084 -14.829 1.00 21.22 C ATOM 606 O ASP A 41 -2.774 -5.191 -16.036 1.00 22.36 O ATOM 607 CB ASP A 41 -3.431 -2.681 -14.757 1.00 16.44 C ATOM 608 CG ASP A 41 -4.447 -1.565 -14.707 1.00 16.41 C ATOM 609 OD1 ASP A 41 -5.640 -1.829 -14.918 1.00 19.82 O ATOM 610 OD2 ASP A 41 -4.044 -0.411 -14.484 1.00 15.25 O ATOM 611 HA ASP A 41 -4.982 -4.221 -14.815 1.00 0.00 H ATOM 612 HB2 ASP A 41 -2.615 -2.438 -14.076 1.00 0.00 H ATOM 613 HB3 ASP A 41 -3.045 -2.753 -15.774 1.00 0.00 H ATOM 614 H ASP A 41 -3.702 -3.460 -12.294 1.00 0.00 H ATOM 615 N ARG A 42 -2.423 -5.881 -13.909 1.00 21.13 N ATOM 616 CA ARG A 42 -1.342 -6.816 -14.255 1.00 20.95 C ATOM 617 C ARG A 42 -1.376 -8.333 -14.232 1.00 24.25 C ATOM 618 O ARG A 42 -0.340 -8.931 -14.503 1.00 30.62 O ATOM 619 CB ARG A 42 -0.077 -6.440 -13.480 1.00 18.24 C ATOM 620 CG ARG A 42 0.658 -5.247 -13.988 1.00 14.17 C ATOM 621 CD ARG A 42 2.046 -5.194 -13.358 1.00 16.00 C ATOM 622 NE ARG A 42 2.050 -5.092 -11.896 1.00 10.24 N ATOM 623 CZ ARG A 42 2.104 -3.938 -11.232 1.00 10.73 C ATOM 624 NH1 ARG A 42 2.098 -2.790 -11.890 1.00 11.61 N ATOM 625 NH2 ARG A 42 2.124 -3.924 -9.910 1.00 10.91 N ATOM 626 HA ARG A 42 -1.440 -6.649 -15.328 1.00 0.00 H ATOM 627 HB2 ARG A 42 -0.362 -6.244 -12.446 1.00 0.00 H ATOM 628 HB3 ARG A 42 0.602 -7.292 -13.512 1.00 0.00 H ATOM 629 HG2 ARG A 42 0.754 -5.314 -15.072 1.00 0.00 H ATOM 630 HG3 ARG A 42 0.107 -4.343 -13.728 1.00 0.00 H ATOM 631 HD2 ARG A 42 2.569 -4.327 -13.761 1.00 0.00 H ATOM 632 HD3 ARG A 42 2.581 -6.102 -13.637 1.00 0.00 H ATOM 633 HE ARG A 42 2.008 -5.972 -11.344 1.00 0.00 H ATOM 634 HH12 ARG A 42 2.140 -1.891 -11.368 1.00 0.00 H ATOM 635 HH11 ARG A 42 2.051 -2.786 -12.929 1.00 0.00 H ATOM 636 HH22 ARG A 42 2.166 -3.019 -9.400 1.00 0.00 H ATOM 637 HH21 ARG A 42 2.098 -4.818 -9.380 1.00 0.00 H ATOM 638 H ARG A 42 -2.757 -5.836 -12.925 1.00 0.00 H ATOM 639 N ASN A 43 -2.459 -8.974 -13.836 1.00 24.86 N ATOM 640 CA ASN A 43 -2.494 -10.455 -13.820 1.00 25.32 C ATOM 641 C ASN A 43 -2.040 -11.146 -12.552 1.00 25.28 C ATOM 642 O ASN A 43 -2.192 -12.359 -12.430 1.00 25.95 O ATOM 643 CB ASN A 43 -1.784 -11.106 -15.019 1.00 25.60 C ATOM 644 CG ASN A 43 -2.546 -10.934 -16.306 1.00 27.39 C ATOM 645 OD1 ASN A 43 -3.723 -10.578 -16.293 1.00 24.82 O ATOM 646 ND2 ASN A 43 -1.884 -11.171 -17.427 1.00 24.26 N ATOM 647 HA ASN A 43 -3.570 -10.619 -13.885 1.00 0.00 H ATOM 648 HB2 ASN A 43 -0.800 -10.651 -15.132 1.00 0.00 H ATOM 649 HB3 ASN A 43 -1.669 -12.172 -14.821 1.00 0.00 H ATOM 650 HD22 ASN A 43 -0.889 -11.470 -17.390 1.00 0.00 H ATOM 651 HD21 ASN A 43 -2.359 -11.058 -18.345 1.00 0.00 H ATOM 652 H ASN A 43 -3.295 -8.435 -13.533 1.00 0.00 H ATOM 653 N LYS A 44 -1.392 -10.430 -11.648 1.00 22.77 N ATOM 654 CA LYS A 44 -1.048 -11.056 -10.388 1.00 20.28 C ATOM 655 C LYS A 44 -0.905 -10.036 -9.272 1.00 15.96 C ATOM 656 O LYS A 44 -0.652 -8.864 -9.525 1.00 13.01 O ATOM 657 CB LYS A 44 0.134 -12.029 -10.507 1.00 24.81 C ATOM 658 CG LYS A 44 1.534 -11.473 -10.522 1.00 27.60 C ATOM 659 CD LYS A 44 2.487 -12.671 -10.542 1.00 34.55 C ATOM 660 CE LYS A 44 3.931 -12.299 -10.277 1.00 37.22 C ATOM 661 NZ LYS A 44 4.811 -13.503 -10.274 1.00 37.69 N ATOM 662 HA LYS A 44 -1.889 -11.688 -10.103 1.00 0.00 H ATOM 663 HB2 LYS A 44 0.071 -12.715 -9.662 1.00 0.00 H ATOM 664 HB3 LYS A 44 -0.000 -12.584 -11.435 1.00 0.00 H ATOM 665 HG2 LYS A 44 1.684 -10.859 -11.410 1.00 0.00 H ATOM 666 HG3 LYS A 44 1.708 -10.870 -9.631 1.00 0.00 H ATOM 667 HD2 LYS A 44 2.167 -13.379 -9.778 1.00 0.00 H ATOM 668 HD3 LYS A 44 2.427 -13.144 -11.522 1.00 0.00 H ATOM 669 HE2 LYS A 44 3.999 -11.807 -9.306 1.00 0.00 H ATOM 670 HE3 LYS A 44 4.269 -11.614 -11.054 1.00 0.00 H ATOM 671 HZ1 LYS A 44 4.497 -14.159 -9.531 1.00 0.00 H ATOM 672 HZ2 LYS A 44 4.755 -13.974 -11.200 1.00 0.00 H ATOM 673 HZ3 LYS A 44 5.793 -13.213 -10.090 1.00 0.00 H ATOM 674 H LYS A 44 -1.135 -9.440 -11.838 1.00 0.00 H ATOM 675 N PRO A 45 -1.246 -10.431 -8.047 1.00 13.40 N ATOM 676 CA PRO A 45 -1.141 -9.512 -6.918 1.00 13.24 C ATOM 677 C PRO A 45 0.294 -9.110 -6.630 1.00 12.16 C ATOM 678 O PRO A 45 1.230 -9.752 -7.102 1.00 13.82 O ATOM 679 CB PRO A 45 -1.759 -10.314 -5.777 1.00 11.52 C ATOM 680 CG PRO A 45 -1.551 -11.738 -6.188 1.00 14.46 C ATOM 681 CD PRO A 45 -1.857 -11.704 -7.638 1.00 13.81 C ATOM 682 HA PRO A 45 -1.642 -8.560 -7.094 1.00 0.00 H ATOM 683 HD3 PRO A 45 -1.404 -12.547 -8.159 1.00 0.00 H ATOM 684 HD2 PRO A 45 -2.932 -11.704 -7.817 1.00 0.00 H ATOM 685 HG3 PRO A 45 -2.231 -12.404 -5.657 1.00 0.00 H ATOM 686 HG2 PRO A 45 -0.523 -12.053 -6.010 1.00 0.00 H ATOM 687 HB2 PRO A 45 -1.253 -10.103 -4.835 1.00 0.00 H ATOM 688 HB3 PRO A 45 -2.821 -10.090 -5.675 1.00 0.00 H ATOM 689 N PHE A 46 0.458 -8.009 -5.912 1.00 9.18 N ATOM 690 CA PHE A 46 1.768 -7.521 -5.534 1.00 10.12 C ATOM 691 C PHE A 46 2.134 -8.216 -4.215 1.00 10.09 C ATOM 692 O PHE A 46 1.263 -8.517 -3.400 1.00 8.93 O ATOM 693 CB PHE A 46 1.699 -6.002 -5.356 1.00 9.87 C ATOM 694 CG PHE A 46 2.984 -5.372 -4.896 1.00 11.62 C ATOM 695 CD1 PHE A 46 3.961 -5.014 -5.809 1.00 11.74 C ATOM 696 CD2 PHE A 46 3.194 -5.091 -3.542 1.00 10.99 C ATOM 697 CE1 PHE A 46 5.136 -4.376 -5.379 1.00 16.02 C ATOM 698 CE2 PHE A 46 4.355 -4.457 -3.104 1.00 9.05 C ATOM 699 CZ PHE A 46 5.325 -4.098 -4.015 1.00 12.24 C ATOM 700 HA PHE A 46 2.522 -7.736 -6.291 1.00 0.00 H ATOM 701 HB2 PHE A 46 1.425 -5.558 -6.313 1.00 0.00 H ATOM 702 HB3 PHE A 46 0.927 -5.779 -4.619 1.00 0.00 H ATOM 703 HD2 PHE A 46 2.434 -5.374 -2.814 1.00 0.00 H ATOM 704 HE2 PHE A 46 4.496 -4.246 -2.044 1.00 0.00 H ATOM 705 HZ PHE A 46 6.235 -3.601 -3.679 1.00 0.00 H ATOM 706 HE1 PHE A 46 5.901 -4.097 -6.103 1.00 0.00 H ATOM 707 HD1 PHE A 46 3.818 -5.229 -6.868 1.00 0.00 H ATOM 708 H PHE A 46 -0.383 -7.477 -5.609 1.00 0.00 H ATOM 709 N LYS A 47 3.412 -8.516 -4.027 1.00 12.37 N ATOM 710 CA LYS A 47 3.864 -9.176 -2.806 1.00 11.77 C ATOM 711 C LYS A 47 5.096 -8.501 -2.255 1.00 10.00 C ATOM 712 O LYS A 47 5.955 -8.061 -3.007 1.00 11.58 O ATOM 713 CB LYS A 47 4.210 -10.645 -3.064 1.00 9.07 C ATOM 714 CG LYS A 47 3.060 -11.502 -3.481 1.00 10.24 C ATOM 715 CD LYS A 47 3.513 -12.933 -3.544 1.00 12.97 C ATOM 716 CE LYS A 47 2.415 -13.840 -4.022 1.00 16.35 C ATOM 717 NZ LYS A 47 2.914 -15.235 -4.096 1.00 22.61 N ATOM 718 HA LYS A 47 3.045 -9.109 -2.090 1.00 0.00 H ATOM 719 HB2 LYS A 47 4.962 -10.682 -3.852 1.00 0.00 H ATOM 720 HB3 LYS A 47 4.626 -11.061 -2.146 1.00 0.00 H ATOM 721 HG2 LYS A 47 2.251 -11.406 -2.757 1.00 0.00 H ATOM 722 HG3 LYS A 47 2.706 -11.187 -4.463 1.00 0.00 H ATOM 723 HD2 LYS A 47 4.357 -13.007 -4.230 1.00 0.00 H ATOM 724 HD3 LYS A 47 3.826 -13.250 -2.549 1.00 0.00 H ATOM 725 HE2 LYS A 47 2.085 -13.520 -5.010 1.00 0.00 H ATOM 726 HE3 LYS A 47 1.577 -13.791 -3.327 1.00 0.00 H ATOM 727 HZ1 LYS A 47 3.713 -15.281 -4.760 1.00 0.00 H ATOM 728 HZ2 LYS A 47 3.227 -15.540 -3.153 1.00 0.00 H ATOM 729 HZ3 LYS A 47 2.150 -15.858 -4.427 1.00 0.00 H ATOM 730 H LYS A 47 4.106 -8.276 -4.764 1.00 0.00 H ATOM 731 N PHE A 48 5.169 -8.410 -0.940 1.00 9.11 N ATOM 732 CA PHE A 48 6.331 -7.825 -0.281 1.00 10.97 C ATOM 733 C PHE A 48 6.401 -8.395 1.127 1.00 12.51 C ATOM 734 O PHE A 48 5.405 -8.887 1.667 1.00 12.44 O ATOM 735 CB PHE A 48 6.272 -6.284 -0.249 1.00 11.50 C ATOM 736 CG PHE A 48 5.278 -5.717 0.748 1.00 13.69 C ATOM 737 CD1 PHE A 48 3.905 -5.718 0.476 1.00 13.24 C ATOM 738 CD2 PHE A 48 5.721 -5.174 1.954 1.00 13.31 C ATOM 739 CE1 PHE A 48 2.994 -5.185 1.401 1.00 14.38 C ATOM 740 CE2 PHE A 48 4.822 -4.642 2.882 1.00 14.50 C ATOM 741 CZ PHE A 48 3.455 -4.646 2.607 1.00 14.42 C ATOM 742 HA PHE A 48 7.229 -8.079 -0.844 1.00 0.00 H ATOM 743 HB2 PHE A 48 7.263 -5.909 0.006 1.00 0.00 H ATOM 744 HB3 PHE A 48 5.997 -5.932 -1.243 1.00 0.00 H ATOM 745 HD2 PHE A 48 6.788 -5.164 2.177 1.00 0.00 H ATOM 746 HE2 PHE A 48 5.189 -4.224 3.820 1.00 0.00 H ATOM 747 HZ PHE A 48 2.750 -4.232 3.327 1.00 0.00 H ATOM 748 HE1 PHE A 48 1.927 -5.191 1.180 1.00 0.00 H ATOM 749 HD1 PHE A 48 3.540 -6.136 -0.462 1.00 0.00 H ATOM 750 H PHE A 48 4.380 -8.763 -0.361 1.00 0.00 H ATOM 751 N MET A 49 7.579 -8.343 1.721 1.00 14.01 N ATOM 752 CA MET A 49 7.753 -8.859 3.059 1.00 14.60 C ATOM 753 C MET A 49 7.888 -7.704 4.033 1.00 12.05 C ATOM 754 O MET A 49 8.694 -6.797 3.844 1.00 13.80 O ATOM 755 CB MET A 49 8.974 -9.761 3.102 1.00 17.28 C ATOM 756 CG MET A 49 9.091 -10.544 4.377 1.00 22.70 C ATOM 757 SD MET A 49 10.513 -11.591 4.262 1.00 24.59 S ATOM 758 CE MET A 49 11.315 -11.140 5.741 1.00 33.29 C ATOM 759 HA MET A 49 6.883 -9.450 3.347 1.00 0.00 H ATOM 760 HB2 MET A 49 8.916 -10.462 2.270 1.00 0.00 H ATOM 761 HB3 MET A 49 9.865 -9.143 2.993 1.00 0.00 H ATOM 762 HG2 MET A 49 8.197 -11.151 4.520 1.00 0.00 H ATOM 763 HG3 MET A 49 9.203 -9.861 5.219 1.00 0.00 H ATOM 764 HE1 MET A 49 11.540 -10.074 5.720 1.00 0.00 H ATOM 765 HE2 MET A 49 10.664 -11.359 6.587 1.00 0.00 H ATOM 766 HE3 MET A 49 12.241 -11.706 5.838 1.00 0.00 H ATOM 767 H MET A 49 8.390 -7.926 1.221 1.00 0.00 H ATOM 768 N LEU A 50 7.028 -7.705 5.039 1.00 14.61 N ATOM 769 CA LEU A 50 7.016 -6.666 6.058 1.00 16.81 C ATOM 770 C LEU A 50 8.317 -6.630 6.882 1.00 19.12 C ATOM 771 O LEU A 50 8.794 -7.670 7.353 1.00 17.87 O ATOM 772 CB LEU A 50 5.819 -6.888 6.992 1.00 15.75 C ATOM 773 CG LEU A 50 5.330 -5.685 7.805 1.00 16.60 C ATOM 774 CD1 LEU A 50 4.780 -4.630 6.846 1.00 17.36 C ATOM 775 CD2 LEU A 50 4.243 -6.108 8.782 1.00 14.05 C ATOM 776 HA LEU A 50 6.932 -5.706 5.548 1.00 0.00 H ATOM 777 HB2 LEU A 50 4.985 -7.231 6.380 1.00 0.00 H ATOM 778 HB3 LEU A 50 6.095 -7.671 7.699 1.00 0.00 H ATOM 779 HG LEU A 50 6.163 -5.274 8.375 1.00 0.00 H ATOM 780 HD21 LEU A 50 3.403 -6.528 8.229 1.00 0.00 H ATOM 781 HD22 LEU A 50 4.642 -6.859 9.464 1.00 0.00 H ATOM 782 HD23 LEU A 50 3.909 -5.240 9.350 1.00 0.00 H ATOM 783 HD11 LEU A 50 5.568 -4.317 6.161 1.00 0.00 H ATOM 784 HD12 LEU A 50 3.951 -5.053 6.279 1.00 0.00 H ATOM 785 HD13 LEU A 50 4.430 -3.770 7.416 1.00 0.00 H ATOM 786 H LEU A 50 6.335 -8.477 5.104 1.00 0.00 H ATOM 787 N GLY A 51 8.888 -5.434 7.028 1.00 18.59 N ATOM 788 CA GLY A 51 10.106 -5.269 7.811 1.00 21.14 C ATOM 789 C GLY A 51 11.444 -5.427 7.099 1.00 22.22 C ATOM 790 O GLY A 51 12.503 -5.409 7.732 1.00 23.07 O ATOM 791 HA3 GLY A 51 10.077 -6.006 8.614 1.00 0.00 H ATOM 792 HA2 GLY A 51 10.083 -4.267 8.239 1.00 0.00 H ATOM 793 H GLY A 51 8.456 -4.604 6.575 1.00 0.00 H ATOM 794 N LYS A 52 11.421 -5.584 5.788 1.00 20.17 N ATOM 795 CA LYS A 52 12.661 -5.732 5.055 1.00 21.15 C ATOM 796 C LYS A 52 12.989 -4.488 4.247 1.00 20.90 C ATOM 797 O LYS A 52 13.905 -4.499 3.425 1.00 20.79 O ATOM 798 CB LYS A 52 12.587 -6.953 4.138 1.00 26.26 C ATOM 799 CG LYS A 52 12.626 -8.282 4.870 1.00 32.72 C ATOM 800 CD LYS A 52 13.911 -9.049 4.555 1.00 40.46 C ATOM 801 CE LYS A 52 15.143 -8.246 4.976 1.00 46.41 C ATOM 802 NZ LYS A 52 16.450 -8.835 4.553 1.00 50.41 N ATOM 803 HA LYS A 52 13.461 -5.874 5.781 1.00 0.00 H ATOM 804 HB2 LYS A 52 11.657 -6.901 3.573 1.00 0.00 H ATOM 805 HB3 LYS A 52 13.432 -6.916 3.450 1.00 0.00 H ATOM 806 HG2 LYS A 52 12.575 -8.099 5.943 1.00 0.00 H ATOM 807 HG3 LYS A 52 11.769 -8.882 4.564 1.00 0.00 H ATOM 808 HD2 LYS A 52 13.902 -9.997 5.092 1.00 0.00 H ATOM 809 HD3 LYS A 52 13.959 -9.241 3.483 1.00 0.00 H ATOM 810 HE2 LYS A 52 15.142 -8.168 6.063 1.00 0.00 H ATOM 811 HE3 LYS A 52 15.063 -7.250 4.541 1.00 0.00 H ATOM 812 HZ1 LYS A 52 16.553 -9.783 4.969 1.00 0.00 H ATOM 813 HZ2 LYS A 52 16.478 -8.906 3.516 1.00 0.00 H ATOM 814 HZ3 LYS A 52 17.226 -8.225 4.881 1.00 0.00 H ATOM 815 H LYS A 52 10.513 -5.601 5.282 1.00 0.00 H ATOM 816 N GLN A 53 12.256 -3.404 4.503 1.00 18.68 N ATOM 817 CA GLN A 53 12.445 -2.148 3.780 1.00 17.83 C ATOM 818 C GLN A 53 12.279 -2.345 2.275 1.00 15.33 C ATOM 819 O GLN A 53 13.007 -1.768 1.462 1.00 15.78 O ATOM 820 CB GLN A 53 13.805 -1.519 4.080 1.00 20.72 C ATOM 821 CG GLN A 53 13.898 -0.845 5.409 1.00 26.74 C ATOM 822 CD GLN A 53 15.091 0.079 5.490 1.00 35.45 C ATOM 823 OE1 GLN A 53 15.944 -0.071 6.365 1.00 40.51 O ATOM 824 NE2 GLN A 53 15.160 1.049 4.578 1.00 36.48 N ATOM 825 HA GLN A 53 11.672 -1.464 4.129 1.00 0.00 H ATOM 826 HB2 GLN A 53 14.559 -2.305 4.044 1.00 0.00 H ATOM 827 HB3 GLN A 53 14.016 -0.779 3.308 1.00 0.00 H ATOM 828 HG2 GLN A 53 12.990 -0.264 5.574 1.00 0.00 H ATOM 829 HG3 GLN A 53 13.988 -1.606 6.185 1.00 0.00 H ATOM 830 HE22 GLN A 53 14.416 1.138 3.857 1.00 0.00 H ATOM 831 HE21 GLN A 53 15.958 1.716 4.588 1.00 0.00 H ATOM 832 H GLN A 53 11.526 -3.454 5.242 1.00 0.00 H ATOM 833 N GLU A 54 11.310 -3.161 1.901 1.00 13.63 N ATOM 834 CA GLU A 54 11.070 -3.410 0.494 1.00 12.50 C ATOM 835 C GLU A 54 10.188 -2.359 -0.159 1.00 13.19 C ATOM 836 O GLU A 54 10.212 -2.207 -1.385 1.00 15.38 O ATOM 837 CB GLU A 54 10.454 -4.783 0.306 1.00 12.30 C ATOM 838 CG GLU A 54 11.341 -5.903 0.839 1.00 19.79 C ATOM 839 CD GLU A 54 10.841 -7.286 0.486 1.00 19.30 C ATOM 840 OE1 GLU A 54 9.682 -7.409 0.053 1.00 17.02 O ATOM 841 OE2 GLU A 54 11.610 -8.254 0.643 1.00 23.95 O ATOM 842 HA GLU A 54 12.041 -3.361 0.001 1.00 0.00 H ATOM 843 HB2 GLU A 54 9.500 -4.813 0.832 1.00 0.00 H ATOM 844 HB3 GLU A 54 10.286 -4.947 -0.758 1.00 0.00 H ATOM 845 HG2 GLU A 54 12.341 -5.780 0.422 1.00 0.00 H ATOM 846 HG3 GLU A 54 11.388 -5.819 1.925 1.00 0.00 H ATOM 847 H GLU A 54 10.718 -3.626 2.618 1.00 0.00 H ATOM 848 N VAL A 55 9.456 -1.597 0.652 1.00 10.25 N ATOM 849 CA VAL A 55 8.524 -0.597 0.126 1.00 9.77 C ATOM 850 C VAL A 55 8.645 0.714 0.875 1.00 9.97 C ATOM 851 O VAL A 55 9.265 0.761 1.933 1.00 11.80 O ATOM 852 CB VAL A 55 7.044 -1.086 0.256 1.00 8.92 C ATOM 853 CG1 VAL A 55 6.786 -2.297 -0.636 1.00 8.78 C ATOM 854 CG2 VAL A 55 6.731 -1.458 1.696 1.00 6.48 C ATOM 855 HA VAL A 55 8.782 -0.452 -0.923 1.00 0.00 H ATOM 856 HB VAL A 55 6.399 -0.266 -0.060 1.00 0.00 H ATOM 857 HG11 VAL A 55 6.975 -2.028 -1.675 1.00 0.00 H ATOM 858 HG12 VAL A 55 7.450 -3.110 -0.343 1.00 0.00 H ATOM 859 HG13 VAL A 55 5.749 -2.614 -0.525 1.00 0.00 H ATOM 860 HG21 VAL A 55 7.398 -2.258 2.017 1.00 0.00 H ATOM 861 HG22 VAL A 55 6.874 -0.586 2.334 1.00 0.00 H ATOM 862 HG23 VAL A 55 5.697 -1.796 1.766 1.00 0.00 H ATOM 863 H VAL A 55 9.548 -1.715 1.681 1.00 0.00 H ATOM 864 N ILE A 56 8.058 1.777 0.328 1.00 10.72 N ATOM 865 CA ILE A 56 8.069 3.093 0.974 1.00 11.84 C ATOM 866 C ILE A 56 7.516 2.964 2.396 1.00 12.35 C ATOM 867 O ILE A 56 6.707 2.076 2.682 1.00 10.27 O ATOM 868 CB ILE A 56 7.207 4.122 0.193 1.00 14.22 C ATOM 869 CG1 ILE A 56 5.805 3.553 -0.082 1.00 13.21 C ATOM 870 CG2 ILE A 56 7.852 4.466 -1.137 1.00 12.85 C ATOM 871 CD1 ILE A 56 4.871 4.557 -0.721 1.00 14.28 C ATOM 872 HA ILE A 56 9.099 3.449 0.991 1.00 0.00 H ATOM 873 HB ILE A 56 7.131 5.019 0.808 1.00 0.00 H ATOM 874 HG12 ILE A 56 5.903 2.696 -0.749 1.00 0.00 H ATOM 875 HG13 ILE A 56 5.371 3.228 0.863 1.00 0.00 H ATOM 876 HD11 ILE A 56 4.755 5.416 -0.060 1.00 0.00 H ATOM 877 HD12 ILE A 56 5.288 4.884 -1.674 1.00 0.00 H ATOM 878 HD13 ILE A 56 3.899 4.092 -0.888 1.00 0.00 H ATOM 879 HG21 ILE A 56 8.839 4.895 -0.961 1.00 0.00 H ATOM 880 HG22 ILE A 56 7.950 3.561 -1.737 1.00 0.00 H ATOM 881 HG23 ILE A 56 7.230 5.188 -1.665 1.00 0.00 H ATOM 882 H ILE A 56 7.576 1.670 -0.587 1.00 0.00 H ATOM 883 N ARG A 57 7.954 3.847 3.282 1.00 14.58 N ATOM 884 CA ARG A 57 7.538 3.837 4.693 1.00 16.54 C ATOM 885 C ARG A 57 6.032 3.787 4.964 1.00 13.87 C ATOM 886 O ARG A 57 5.564 2.976 5.784 1.00 11.35 O ATOM 887 CB ARG A 57 8.138 5.051 5.423 1.00 23.74 C ATOM 888 CG ARG A 57 9.382 4.780 6.275 1.00 35.39 C ATOM 889 CD ARG A 57 10.617 4.372 5.456 1.00 43.14 C ATOM 890 NE ARG A 57 10.430 3.080 4.791 1.00 50.00 N ATOM 891 CZ ARG A 57 10.557 1.894 5.386 1.00 52.15 C ATOM 892 NH1 ARG A 57 10.893 1.809 6.671 1.00 52.31 N ATOM 893 NH2 ARG A 57 10.289 0.787 4.702 1.00 51.95 N ATOM 894 HA ARG A 57 7.923 2.891 5.074 1.00 0.00 H ATOM 895 HB2 ARG A 57 8.405 5.793 4.671 1.00 0.00 H ATOM 896 HB3 ARG A 57 7.368 5.460 6.078 1.00 0.00 H ATOM 897 HG2 ARG A 57 9.622 5.686 6.831 1.00 0.00 H ATOM 898 HG3 ARG A 57 9.152 3.976 6.974 1.00 0.00 H ATOM 899 HD2 ARG A 57 11.476 4.304 6.124 1.00 0.00 H ATOM 900 HD3 ARG A 57 10.806 5.134 4.700 1.00 0.00 H ATOM 901 HE ARG A 57 10.180 3.089 3.782 1.00 0.00 H ATOM 902 HH12 ARG A 57 10.989 0.877 7.123 1.00 0.00 H ATOM 903 HH11 ARG A 57 11.060 2.674 7.223 1.00 0.00 H ATOM 904 HH22 ARG A 57 10.385 -0.142 5.158 1.00 0.00 H ATOM 905 HH21 ARG A 57 9.983 0.850 3.710 1.00 0.00 H ATOM 906 H ARG A 57 8.621 4.579 2.966 1.00 0.00 H ATOM 907 N GLY A 58 5.287 4.669 4.294 1.00 11.95 N ATOM 908 CA GLY A 58 3.843 4.746 4.457 1.00 9.16 C ATOM 909 C GLY A 58 3.150 3.416 4.292 1.00 11.50 C ATOM 910 O GLY A 58 2.173 3.138 4.975 1.00 12.11 O ATOM 911 HA3 GLY A 58 3.447 5.437 3.713 1.00 0.00 H ATOM 912 HA2 GLY A 58 3.627 5.127 5.455 1.00 0.00 H ATOM 913 H GLY A 58 5.754 5.323 3.634 1.00 0.00 H ATOM 914 N TRP A 59 3.667 2.577 3.399 1.00 14.62 N ATOM 915 CA TRP A 59 3.112 1.244 3.163 1.00 14.67 C ATOM 916 C TRP A 59 3.432 0.265 4.289 1.00 14.86 C ATOM 917 O TRP A 59 2.571 -0.522 4.691 1.00 15.01 O ATOM 918 CB TRP A 59 3.627 0.680 1.846 1.00 15.83 C ATOM 919 CG TRP A 59 2.633 0.776 0.756 1.00 14.59 C ATOM 920 CD1 TRP A 59 2.056 1.913 0.272 1.00 15.67 C ATOM 921 CD2 TRP A 59 2.054 -0.316 0.029 1.00 11.68 C ATOM 922 NE1 TRP A 59 1.149 1.596 -0.708 1.00 11.93 N ATOM 923 CE2 TRP A 59 1.125 0.235 -0.877 1.00 10.79 C ATOM 924 CE3 TRP A 59 2.230 -1.710 0.060 1.00 9.32 C ATOM 925 CZ2 TRP A 59 0.370 -0.551 -1.745 1.00 10.83 C ATOM 926 CZ3 TRP A 59 1.480 -2.496 -0.802 1.00 8.14 C ATOM 927 CH2 TRP A 59 0.560 -1.915 -1.693 1.00 12.56 C ATOM 928 HA TRP A 59 2.029 1.362 3.123 1.00 0.00 H ATOM 929 HB2 TRP A 59 4.519 1.234 1.554 1.00 0.00 H ATOM 930 HB3 TRP A 59 3.884 -0.369 1.992 1.00 0.00 H ATOM 931 HE1 TRP A 59 0.572 2.279 -1.238 1.00 0.00 H ATOM 932 HD1 TRP A 59 2.282 2.923 0.613 1.00 0.00 H ATOM 933 HZ2 TRP A 59 -0.343 -0.105 -2.438 1.00 0.00 H ATOM 934 HH2 TRP A 59 -0.016 -2.558 -2.358 1.00 0.00 H ATOM 935 HZ3 TRP A 59 1.605 -3.579 -0.789 1.00 0.00 H ATOM 936 HE3 TRP A 59 2.942 -2.165 0.748 1.00 0.00 H ATOM 937 H TRP A 59 4.496 2.879 2.848 1.00 0.00 H ATOM 938 N GLU A 60 4.669 0.294 4.781 1.00 15.43 N ATOM 939 CA GLU A 60 5.082 -0.585 5.879 1.00 19.09 C ATOM 940 C GLU A 60 4.149 -0.330 7.063 1.00 19.67 C ATOM 941 O GLU A 60 3.556 -1.252 7.619 1.00 20.97 O ATOM 942 CB GLU A 60 6.514 -0.265 6.334 1.00 24.38 C ATOM 943 CG GLU A 60 7.630 -0.747 5.420 1.00 31.68 C ATOM 944 CD GLU A 60 8.080 -2.174 5.699 1.00 29.52 C ATOM 945 OE1 GLU A 60 7.278 -3.002 6.170 1.00 32.68 O ATOM 946 OE2 GLU A 60 9.258 -2.473 5.434 1.00 38.21 O ATOM 947 HA GLU A 60 5.039 -1.619 5.538 1.00 0.00 H ATOM 948 HB2 GLU A 60 6.601 0.818 6.424 1.00 0.00 H ATOM 949 HB3 GLU A 60 6.663 -0.723 7.312 1.00 0.00 H ATOM 950 HG2 GLU A 60 7.278 -0.693 4.390 1.00 0.00 H ATOM 951 HG3 GLU A 60 8.487 -0.085 5.545 1.00 0.00 H ATOM 952 H GLU A 60 5.360 0.957 4.376 1.00 0.00 H ATOM 953 N GLU A 61 4.001 0.940 7.417 1.00 18.82 N ATOM 954 CA GLU A 61 3.156 1.326 8.533 1.00 17.31 C ATOM 955 C GLU A 61 1.665 1.170 8.289 1.00 14.28 C ATOM 956 O GLU A 61 0.935 0.746 9.186 1.00 13.67 O ATOM 957 CB GLU A 61 3.486 2.749 8.959 1.00 21.61 C ATOM 958 CG GLU A 61 4.869 2.845 9.581 1.00 31.75 C ATOM 959 CD GLU A 61 5.227 4.244 10.030 1.00 37.38 C ATOM 960 OE1 GLU A 61 4.331 4.968 10.536 1.00 40.19 O ATOM 961 OE2 GLU A 61 6.415 4.611 9.884 1.00 42.36 O ATOM 962 HA GLU A 61 3.382 0.625 9.336 1.00 0.00 H ATOM 963 HB2 GLU A 61 3.446 3.398 8.084 1.00 0.00 H ATOM 964 HB3 GLU A 61 2.747 3.080 9.689 1.00 0.00 H ATOM 965 HG2 GLU A 61 4.906 2.183 10.446 1.00 0.00 H ATOM 966 HG3 GLU A 61 5.603 2.519 8.844 1.00 0.00 H ATOM 967 H GLU A 61 4.503 1.677 6.882 1.00 0.00 H ATOM 968 N GLY A 62 1.206 1.499 7.085 1.00 11.27 N ATOM 969 CA GLY A 62 -0.211 1.378 6.783 1.00 11.06 C ATOM 970 C GLY A 62 -0.726 -0.043 6.656 1.00 11.70 C ATOM 971 O GLY A 62 -1.742 -0.384 7.269 1.00 10.88 O ATOM 972 HA3 GLY A 62 -0.400 1.891 5.840 1.00 0.00 H ATOM 973 HA2 GLY A 62 -0.769 1.869 7.580 1.00 0.00 H ATOM 974 H GLY A 62 1.863 1.844 6.357 1.00 0.00 H ATOM 975 N VAL A 63 -0.024 -0.887 5.899 1.00 10.27 N ATOM 976 CA VAL A 63 -0.466 -2.266 5.695 1.00 10.08 C ATOM 977 C VAL A 63 -0.389 -3.079 6.980 1.00 10.22 C ATOM 978 O VAL A 63 -1.196 -3.988 7.193 1.00 10.60 O ATOM 979 CB VAL A 63 0.309 -2.967 4.528 1.00 9.47 C ATOM 980 CG1 VAL A 63 -0.171 -4.393 4.337 1.00 9.29 C ATOM 981 CG2 VAL A 63 0.100 -2.207 3.229 1.00 9.76 C ATOM 982 HA VAL A 63 -1.514 -2.218 5.400 1.00 0.00 H ATOM 983 HB VAL A 63 1.367 -2.975 4.791 1.00 0.00 H ATOM 984 HG11 VAL A 63 -0.006 -4.957 5.255 1.00 0.00 H ATOM 985 HG12 VAL A 63 -1.234 -4.388 4.098 1.00 0.00 H ATOM 986 HG13 VAL A 63 0.384 -4.856 3.521 1.00 0.00 H ATOM 987 HG21 VAL A 63 -0.963 -2.185 2.990 1.00 0.00 H ATOM 988 HG22 VAL A 63 0.470 -1.188 3.342 1.00 0.00 H ATOM 989 HG23 VAL A 63 0.644 -2.705 2.427 1.00 0.00 H ATOM 990 H VAL A 63 0.853 -0.559 5.446 1.00 0.00 H ATOM 991 N ALA A 64 0.561 -2.744 7.848 1.00 9.56 N ATOM 992 CA ALA A 64 0.706 -3.437 9.123 1.00 11.60 C ATOM 993 C ALA A 64 -0.553 -3.231 9.985 1.00 13.60 C ATOM 994 O ALA A 64 -0.833 -4.012 10.904 1.00 13.64 O ATOM 995 CB ALA A 64 1.948 -2.927 9.862 1.00 11.38 C ATOM 996 HA ALA A 64 0.827 -4.503 8.933 1.00 0.00 H ATOM 997 HB1 ALA A 64 2.833 -3.110 9.252 1.00 0.00 H ATOM 998 HB2 ALA A 64 1.846 -1.857 10.045 1.00 0.00 H ATOM 999 HB3 ALA A 64 2.045 -3.452 10.812 1.00 0.00 H ATOM 1000 H ALA A 64 1.215 -1.971 7.612 1.00 0.00 H ATOM 1001 N GLN A 65 -1.322 -2.189 9.675 1.00 12.09 N ATOM 1002 CA GLN A 65 -2.543 -1.900 10.416 1.00 11.43 C ATOM 1003 C GLN A 65 -3.795 -2.548 9.833 1.00 12.24 C ATOM 1004 O GLN A 65 -4.899 -2.387 10.368 1.00 11.35 O ATOM 1005 CB GLN A 65 -2.760 -0.396 10.473 1.00 16.09 C ATOM 1006 CG GLN A 65 -1.727 0.335 11.280 1.00 20.35 C ATOM 1007 CD GLN A 65 -2.006 1.806 11.296 1.00 25.98 C ATOM 1008 OE1 GLN A 65 -2.829 2.285 12.075 1.00 31.19 O ATOM 1009 NE2 GLN A 65 -1.357 2.536 10.404 1.00 29.36 N ATOM 1010 HA GLN A 65 -2.397 -2.326 11.409 1.00 0.00 H ATOM 1011 HB2 GLN A 65 -2.740 -0.007 9.455 1.00 0.00 H ATOM 1012 HB3 GLN A 65 -3.739 -0.206 10.914 1.00 0.00 H ATOM 1013 HG2 GLN A 65 -1.740 -0.042 12.303 1.00 0.00 H ATOM 1014 HG3 GLN A 65 -0.744 0.162 10.842 1.00 0.00 H ATOM 1015 HE22 GLN A 65 -0.670 2.087 9.766 1.00 0.00 H ATOM 1016 HE21 GLN A 65 -1.534 3.559 10.341 1.00 0.00 H ATOM 1017 H GLN A 65 -1.045 -1.568 8.888 1.00 0.00 H ATOM 1018 N MET A 66 -3.640 -3.294 8.753 1.00 8.53 N ATOM 1019 CA MET A 66 -4.785 -3.929 8.119 1.00 8.59 C ATOM 1020 C MET A 66 -4.887 -5.407 8.457 1.00 9.54 C ATOM 1021 O MET A 66 -3.890 -6.025 8.793 1.00 12.54 O ATOM 1022 CB MET A 66 -4.671 -3.756 6.612 1.00 7.96 C ATOM 1023 CG MET A 66 -4.745 -2.305 6.170 1.00 6.93 C ATOM 1024 SD MET A 66 -4.427 -2.110 4.407 1.00 13.02 S ATOM 1025 CE MET A 66 -5.750 -3.076 3.705 1.00 8.34 C ATOM 1026 HA MET A 66 -5.688 -3.449 8.497 1.00 0.00 H ATOM 1027 HB2 MET A 66 -3.716 -4.170 6.287 1.00 0.00 H ATOM 1028 HB3 MET A 66 -5.484 -4.305 6.137 1.00 0.00 H ATOM 1029 HG2 MET A 66 -4.004 -1.731 6.726 1.00 0.00 H ATOM 1030 HG3 MET A 66 -5.741 -1.921 6.391 1.00 0.00 H ATOM 1031 HE1 MET A 66 -5.667 -4.107 4.049 1.00 0.00 H ATOM 1032 HE2 MET A 66 -6.708 -2.662 4.021 1.00 0.00 H ATOM 1033 HE3 MET A 66 -5.681 -3.048 2.618 1.00 0.00 H ATOM 1034 H MET A 66 -2.690 -3.428 8.352 1.00 0.00 H ATOM 1035 N SER A 67 -6.097 -5.953 8.466 1.00 9.61 N ATOM 1036 CA SER A 67 -6.264 -7.373 8.709 1.00 9.33 C ATOM 1037 C SER A 67 -6.603 -8.036 7.365 1.00 10.97 C ATOM 1038 O SER A 67 -6.985 -7.358 6.413 1.00 10.78 O ATOM 1039 CB SER A 67 -7.328 -7.644 9.773 1.00 12.66 C ATOM 1040 OG SER A 67 -8.585 -7.076 9.465 1.00 11.22 O ATOM 1041 HA SER A 67 -5.343 -7.799 9.107 1.00 0.00 H ATOM 1042 HB2 SER A 67 -6.984 -7.229 10.720 1.00 0.00 H ATOM 1043 HB3 SER A 67 -7.451 -8.722 9.873 1.00 0.00 H ATOM 1044 HG SER A 67 -8.490 -6.094 9.381 1.00 0.00 H ATOM 1045 H SER A 67 -6.933 -5.357 8.297 1.00 0.00 H ATOM 1046 N VAL A 68 -6.396 -9.341 7.266 1.00 10.41 N ATOM 1047 CA VAL A 68 -6.661 -10.084 6.039 1.00 11.88 C ATOM 1048 C VAL A 68 -8.109 -9.931 5.568 1.00 12.28 C ATOM 1049 O VAL A 68 -9.051 -10.135 6.338 1.00 9.50 O ATOM 1050 CB VAL A 68 -6.312 -11.592 6.217 1.00 14.37 C ATOM 1051 CG1 VAL A 68 -6.652 -12.384 4.960 1.00 11.44 C ATOM 1052 CG2 VAL A 68 -4.825 -11.746 6.558 1.00 11.03 C ATOM 1053 HA VAL A 68 -6.018 -9.658 5.269 1.00 0.00 H ATOM 1054 HB VAL A 68 -6.910 -11.990 7.037 1.00 0.00 H ATOM 1055 HG11 VAL A 68 -7.718 -12.294 4.753 1.00 0.00 H ATOM 1056 HG12 VAL A 68 -6.082 -11.990 4.119 1.00 0.00 H ATOM 1057 HG13 VAL A 68 -6.398 -13.433 5.113 1.00 0.00 H ATOM 1058 HG21 VAL A 68 -4.223 -11.330 5.750 1.00 0.00 H ATOM 1059 HG22 VAL A 68 -4.609 -11.214 7.485 1.00 0.00 H ATOM 1060 HG23 VAL A 68 -4.589 -12.803 6.681 1.00 0.00 H ATOM 1061 H VAL A 68 -6.031 -9.854 8.094 1.00 0.00 H ATOM 1062 N GLY A 69 -8.269 -9.518 4.312 1.00 12.70 N ATOM 1063 CA GLY A 69 -9.586 -9.338 3.734 1.00 10.78 C ATOM 1064 C GLY A 69 -9.971 -7.875 3.669 1.00 11.97 C ATOM 1065 O GLY A 69 -10.853 -7.495 2.902 1.00 13.89 O ATOM 1066 HA3 GLY A 69 -10.316 -9.869 4.344 1.00 0.00 H ATOM 1067 HA2 GLY A 69 -9.589 -9.750 2.725 1.00 0.00 H ATOM 1068 H GLY A 69 -7.429 -9.320 3.732 1.00 0.00 H ATOM 1069 N GLN A 70 -9.290 -7.039 4.445 1.00 9.22 N ATOM 1070 CA GLN A 70 -9.592 -5.615 4.479 1.00 8.65 C ATOM 1071 C GLN A 70 -9.170 -4.857 3.226 1.00 8.76 C ATOM 1072 O GLN A 70 -8.175 -5.182 2.579 1.00 10.61 O ATOM 1073 CB GLN A 70 -8.922 -4.975 5.705 1.00 10.10 C ATOM 1074 CG GLN A 70 -9.218 -3.497 5.932 1.00 9.65 C ATOM 1075 CD GLN A 70 -8.643 -2.998 7.238 1.00 12.28 C ATOM 1076 OE1 GLN A 70 -8.030 -3.759 7.982 1.00 11.82 O ATOM 1077 NE2 GLN A 70 -8.854 -1.726 7.538 1.00 12.15 N ATOM 1078 HA GLN A 70 -10.678 -5.539 4.535 1.00 0.00 H ATOM 1079 HB2 GLN A 70 -9.252 -5.521 6.589 1.00 0.00 H ATOM 1080 HB3 GLN A 70 -7.844 -5.086 5.592 1.00 0.00 H ATOM 1081 HG2 GLN A 70 -8.785 -2.921 5.114 1.00 0.00 H ATOM 1082 HG3 GLN A 70 -10.298 -3.352 5.945 1.00 0.00 H ATOM 1083 HE22 GLN A 70 -9.378 -1.116 6.879 1.00 0.00 H ATOM 1084 HE21 GLN A 70 -8.495 -1.336 8.433 1.00 0.00 H ATOM 1085 H GLN A 70 -8.524 -7.410 5.042 1.00 0.00 H ATOM 1086 N ARG A 71 -9.960 -3.851 2.886 1.00 8.65 N ATOM 1087 CA ARG A 71 -9.668 -2.970 1.762 1.00 7.86 C ATOM 1088 C ARG A 71 -9.674 -1.597 2.400 1.00 7.93 C ATOM 1089 O ARG A 71 -10.585 -1.273 3.171 1.00 8.27 O ATOM 1090 CB ARG A 71 -10.751 -3.045 0.689 1.00 8.29 C ATOM 1091 CG ARG A 71 -10.395 -2.285 -0.563 1.00 5.20 C ATOM 1092 CD ARG A 71 -11.385 -2.582 -1.662 1.00 8.15 C ATOM 1093 NE ARG A 71 -11.049 -1.869 -2.885 1.00 10.33 N ATOM 1094 CZ ARG A 71 -11.746 -1.958 -4.011 1.00 10.72 C ATOM 1095 NH1 ARG A 71 -12.813 -2.732 -4.069 1.00 11.25 N ATOM 1096 NH2 ARG A 71 -11.384 -1.262 -5.070 1.00 9.01 N ATOM 1097 HA ARG A 71 -8.735 -3.229 1.262 1.00 0.00 H ATOM 1098 HB2 ARG A 71 -10.909 -4.091 0.427 1.00 0.00 H ATOM 1099 HB3 ARG A 71 -11.673 -2.631 1.097 1.00 0.00 H ATOM 1100 HG2 ARG A 71 -10.406 -1.216 -0.349 1.00 0.00 H ATOM 1101 HG3 ARG A 71 -9.397 -2.579 -0.890 1.00 0.00 H ATOM 1102 HD2 ARG A 71 -12.380 -2.278 -1.336 1.00 0.00 H ATOM 1103 HD3 ARG A 71 -11.382 -3.653 -1.863 1.00 0.00 H ATOM 1104 HE ARG A 71 -10.212 -1.252 -2.876 1.00 0.00 H ATOM 1105 HH12 ARG A 71 -13.358 -2.801 -4.952 1.00 0.00 H ATOM 1106 HH11 ARG A 71 -13.109 -3.273 -3.232 1.00 0.00 H ATOM 1107 HH22 ARG A 71 -11.932 -1.333 -5.951 1.00 0.00 H ATOM 1108 HH21 ARG A 71 -10.551 -0.641 -5.024 1.00 0.00 H ATOM 1109 H ARG A 71 -10.822 -3.683 3.442 1.00 0.00 H ATOM 1110 N ALA A 72 -8.664 -0.792 2.108 1.00 8.55 N ATOM 1111 CA ALA A 72 -8.575 0.526 2.692 1.00 7.47 C ATOM 1112 C ALA A 72 -7.881 1.506 1.781 1.00 7.81 C ATOM 1113 O ALA A 72 -7.183 1.130 0.842 1.00 7.15 O ATOM 1114 CB ALA A 72 -7.838 0.455 4.030 1.00 9.94 C ATOM 1115 HA ALA A 72 -9.593 0.883 2.847 1.00 0.00 H ATOM 1116 HB1 ALA A 72 -8.381 -0.203 4.708 1.00 0.00 H ATOM 1117 HB2 ALA A 72 -6.833 0.064 3.870 1.00 0.00 H ATOM 1118 HB3 ALA A 72 -7.776 1.454 4.463 1.00 0.00 H ATOM 1119 H ALA A 72 -7.925 -1.113 1.450 1.00 0.00 H ATOM 1120 N LYS A 73 -8.127 2.776 2.050 1.00 6.79 N ATOM 1121 CA LYS A 73 -7.536 3.868 1.321 1.00 9.34 C ATOM 1122 C LYS A 73 -6.444 4.411 2.240 1.00 9.63 C ATOM 1123 O LYS A 73 -6.725 4.802 3.376 1.00 5.43 O ATOM 1124 CB LYS A 73 -8.600 4.934 1.099 1.00 12.21 C ATOM 1125 CG LYS A 73 -8.214 6.004 0.124 1.00 27.44 C ATOM 1126 CD LYS A 73 -8.341 5.511 -1.313 1.00 35.28 C ATOM 1127 CE LYS A 73 -9.781 5.561 -1.817 1.00 39.65 C ATOM 1128 NZ LYS A 73 -9.835 5.261 -3.280 1.00 41.60 N ATOM 1129 HA LYS A 73 -7.139 3.568 0.351 1.00 0.00 H ATOM 1130 HB2 LYS A 73 -9.501 4.444 0.729 1.00 0.00 H ATOM 1131 HB3 LYS A 73 -8.813 5.407 2.057 1.00 0.00 H ATOM 1132 HG2 LYS A 73 -8.867 6.865 0.264 1.00 0.00 H ATOM 1133 HG3 LYS A 73 -7.181 6.299 0.309 1.00 0.00 H ATOM 1134 HD2 LYS A 73 -7.723 6.138 -1.955 1.00 0.00 H ATOM 1135 HD3 LYS A 73 -7.987 4.481 -1.363 1.00 0.00 H ATOM 1136 HE2 LYS A 73 -10.189 6.556 -1.639 1.00 0.00 H ATOM 1137 HE3 LYS A 73 -10.376 4.824 -1.277 1.00 0.00 H ATOM 1138 HZ1 LYS A 73 -9.271 5.965 -3.798 1.00 0.00 H ATOM 1139 HZ2 LYS A 73 -9.449 4.311 -3.452 1.00 0.00 H ATOM 1140 HZ3 LYS A 73 -10.822 5.300 -3.604 1.00 0.00 H ATOM 1141 H LYS A 73 -8.781 2.998 2.828 1.00 0.00 H ATOM 1142 N LEU A 74 -5.197 4.392 1.777 1.00 10.31 N ATOM 1143 CA LEU A 74 -4.082 4.912 2.570 1.00 10.21 C ATOM 1144 C LEU A 74 -3.642 6.212 1.921 1.00 10.11 C ATOM 1145 O LEU A 74 -3.380 6.248 0.714 1.00 10.94 O ATOM 1146 CB LEU A 74 -2.895 3.944 2.570 1.00 10.39 C ATOM 1147 CG LEU A 74 -3.100 2.449 2.777 1.00 9.63 C ATOM 1148 CD1 LEU A 74 -1.731 1.819 2.949 1.00 16.58 C ATOM 1149 CD2 LEU A 74 -3.946 2.170 3.977 1.00 10.42 C ATOM 1150 HA LEU A 74 -4.405 5.051 3.602 1.00 0.00 H ATOM 1151 HB2 LEU A 74 -2.402 4.058 1.605 1.00 0.00 H ATOM 1152 HB3 LEU A 74 -2.223 4.277 3.361 1.00 0.00 H ATOM 1153 HG LEU A 74 -3.620 2.030 1.915 1.00 0.00 H ATOM 1154 HD21 LEU A 74 -3.461 2.577 4.864 1.00 0.00 H ATOM 1155 HD22 LEU A 74 -4.922 2.637 3.848 1.00 0.00 H ATOM 1156 HD23 LEU A 74 -4.069 1.093 4.091 1.00 0.00 H ATOM 1157 HD11 LEU A 74 -1.134 2.001 2.056 1.00 0.00 H ATOM 1158 HD12 LEU A 74 -1.236 2.259 3.815 1.00 0.00 H ATOM 1159 HD13 LEU A 74 -1.843 0.745 3.100 1.00 0.00 H ATOM 1160 H LEU A 74 -5.011 4.000 0.832 1.00 0.00 H ATOM 1161 N THR A 75 -3.613 7.286 2.695 1.00 8.35 N ATOM 1162 CA THR A 75 -3.193 8.586 2.185 1.00 8.14 C ATOM 1163 C THR A 75 -1.833 8.808 2.812 1.00 9.56 C ATOM 1164 O THR A 75 -1.688 8.840 4.038 1.00 8.18 O ATOM 1165 CB THR A 75 -4.220 9.689 2.544 1.00 11.47 C ATOM 1166 OG1 THR A 75 -5.490 9.361 1.944 1.00 9.85 O ATOM 1167 CG2 THR A 75 -3.761 11.048 2.016 1.00 8.81 C ATOM 1168 HA THR A 75 -3.136 8.622 1.097 1.00 0.00 H ATOM 1169 HB THR A 75 -4.310 9.744 3.629 1.00 0.00 H ATOM 1170 HG1 THR A 75 -5.802 8.488 2.291 1.00 0.00 H ATOM 1171 HG23 THR A 75 -2.801 11.305 2.464 1.00 0.00 H ATOM 1172 HG21 THR A 75 -3.656 10.999 0.932 1.00 0.00 H ATOM 1173 HG22 THR A 75 -4.500 11.806 2.277 1.00 0.00 H ATOM 1174 H THR A 75 -3.897 7.200 3.692 1.00 0.00 H ATOM 1175 N ILE A 76 -0.829 8.938 1.960 1.00 9.52 N ATOM 1176 CA ILE A 76 0.544 9.042 2.409 1.00 9.74 C ATOM 1177 C ILE A 76 1.187 10.357 2.044 1.00 11.17 C ATOM 1178 O ILE A 76 1.206 10.745 0.875 1.00 13.49 O ATOM 1179 CB ILE A 76 1.362 7.892 1.788 1.00 8.69 C ATOM 1180 CG1 ILE A 76 0.667 6.555 2.050 1.00 9.86 C ATOM 1181 CG2 ILE A 76 2.761 7.890 2.342 1.00 9.76 C ATOM 1182 CD1 ILE A 76 1.242 5.377 1.297 1.00 11.97 C ATOM 1183 HA ILE A 76 0.534 8.980 3.497 1.00 0.00 H ATOM 1184 HB ILE A 76 1.425 8.040 0.710 1.00 0.00 H ATOM 1185 HG12 ILE A 76 0.736 6.341 3.117 1.00 0.00 H ATOM 1186 HG13 ILE A 76 -0.381 6.658 1.768 1.00 0.00 H ATOM 1187 HD11 ILE A 76 1.170 5.562 0.225 1.00 0.00 H ATOM 1188 HD12 ILE A 76 2.288 5.245 1.575 1.00 0.00 H ATOM 1189 HD13 ILE A 76 0.682 4.477 1.550 1.00 0.00 H ATOM 1190 HG21 ILE A 76 3.244 8.839 2.108 1.00 0.00 H ATOM 1191 HG22 ILE A 76 2.722 7.757 3.423 1.00 0.00 H ATOM 1192 HG23 ILE A 76 3.327 7.073 1.894 1.00 0.00 H ATOM 1193 H ILE A 76 -1.031 8.966 0.940 1.00 0.00 H ATOM 1194 N SER A 77 1.712 11.050 3.049 1.00 11.98 N ATOM 1195 CA SER A 77 2.372 12.330 2.815 1.00 10.29 C ATOM 1196 C SER A 77 3.737 12.048 2.167 1.00 9.73 C ATOM 1197 O SER A 77 4.280 10.954 2.308 1.00 10.35 O ATOM 1198 CB SER A 77 2.477 13.137 4.115 1.00 8.23 C ATOM 1199 OG SER A 77 3.133 12.408 5.130 1.00 11.92 O ATOM 1200 HA SER A 77 1.787 12.950 2.135 1.00 0.00 H ATOM 1201 HB2 SER A 77 1.473 13.392 4.455 1.00 0.00 H ATOM 1202 HB3 SER A 77 3.036 14.052 3.919 1.00 0.00 H ATOM 1203 HG SER A 77 4.048 12.178 4.831 1.00 0.00 H ATOM 1204 H SER A 77 1.652 10.674 4.017 1.00 0.00 H ATOM 1205 N PRO A 78 4.306 13.034 1.462 1.00 10.95 N ATOM 1206 CA PRO A 78 5.599 12.888 0.778 1.00 12.36 C ATOM 1207 C PRO A 78 6.726 12.337 1.651 1.00 12.94 C ATOM 1208 O PRO A 78 7.459 11.443 1.231 1.00 12.34 O ATOM 1209 CB PRO A 78 5.897 14.313 0.304 1.00 12.11 C ATOM 1210 CG PRO A 78 4.549 14.927 0.175 1.00 13.85 C ATOM 1211 CD PRO A 78 3.838 14.428 1.389 1.00 12.21 C ATOM 1212 HA PRO A 78 5.541 12.151 -0.023 1.00 0.00 H ATOM 1213 HD3 PRO A 78 4.126 14.991 2.277 1.00 0.00 H ATOM 1214 HD2 PRO A 78 2.756 14.478 1.264 1.00 0.00 H ATOM 1215 HG3 PRO A 78 4.052 14.594 -0.736 1.00 0.00 H ATOM 1216 HG2 PRO A 78 4.612 16.015 0.176 1.00 0.00 H ATOM 1217 HB2 PRO A 78 6.501 14.849 1.036 1.00 0.00 H ATOM 1218 HB3 PRO A 78 6.415 14.304 -0.655 1.00 0.00 H ATOM 1219 N ASP A 79 6.868 12.864 2.858 1.00 11.72 N ATOM 1220 CA ASP A 79 7.916 12.403 3.762 1.00 14.97 C ATOM 1221 C ASP A 79 7.852 10.907 4.046 1.00 13.26 C ATOM 1222 O ASP A 79 8.837 10.320 4.470 1.00 10.75 O ATOM 1223 CB ASP A 79 7.929 13.217 5.066 1.00 19.11 C ATOM 1224 CG ASP A 79 6.574 13.279 5.745 1.00 25.41 C ATOM 1225 OD1 ASP A 79 5.574 13.567 5.055 1.00 26.54 O ATOM 1226 OD2 ASP A 79 6.513 13.082 6.981 1.00 25.93 O ATOM 1227 HA ASP A 79 8.859 12.574 3.242 1.00 0.00 H ATOM 1228 HB2 ASP A 79 8.641 12.760 5.753 1.00 0.00 H ATOM 1229 HB3 ASP A 79 8.249 14.234 4.837 1.00 0.00 H ATOM 1230 H ASP A 79 6.222 13.619 3.166 1.00 0.00 H ATOM 1231 N TYR A 80 6.689 10.297 3.819 1.00 13.25 N ATOM 1232 CA TYR A 80 6.515 8.856 4.024 1.00 13.59 C ATOM 1233 C TYR A 80 6.487 8.085 2.704 1.00 12.80 C ATOM 1234 O TYR A 80 6.223 6.868 2.672 1.00 13.00 O ATOM 1235 CB TYR A 80 5.235 8.581 4.811 1.00 16.69 C ATOM 1236 CG TYR A 80 5.437 8.696 6.287 1.00 16.47 C ATOM 1237 CD1 TYR A 80 5.700 9.930 6.875 1.00 21.65 C ATOM 1238 CD2 TYR A 80 5.426 7.564 7.099 1.00 21.57 C ATOM 1239 CE1 TYR A 80 5.959 10.039 8.239 1.00 23.48 C ATOM 1240 CE2 TYR A 80 5.679 7.659 8.465 1.00 25.60 C ATOM 1241 CZ TYR A 80 5.946 8.898 9.025 1.00 26.12 C ATOM 1242 OH TYR A 80 6.199 8.991 10.374 1.00 32.33 O ATOM 1243 HA TYR A 80 7.376 8.507 4.594 1.00 0.00 H ATOM 1244 HB3 TYR A 80 4.893 7.572 4.582 1.00 0.00 H ATOM 1245 HB2 TYR A 80 4.474 9.299 4.505 1.00 0.00 H ATOM 1246 HD2 TYR A 80 5.216 6.589 6.658 1.00 0.00 H ATOM 1247 HE2 TYR A 80 5.667 6.765 9.089 1.00 0.00 H ATOM 1248 HE1 TYR A 80 6.170 11.012 8.684 1.00 0.00 H ATOM 1249 HD1 TYR A 80 5.703 10.827 6.256 1.00 0.00 H ATOM 1250 HH TYR A 80 6.369 9.937 10.612 1.00 0.00 H ATOM 1251 H TYR A 80 5.881 10.860 3.486 1.00 0.00 H ATOM 1252 N ALA A 81 6.775 8.785 1.611 1.00 10.52 N ATOM 1253 CA ALA A 81 6.770 8.158 0.310 1.00 9.89 C ATOM 1254 C ALA A 81 8.053 8.485 -0.465 1.00 11.35 C ATOM 1255 O ALA A 81 9.127 8.026 -0.077 1.00 12.58 O ATOM 1256 CB ALA A 81 5.523 8.568 -0.459 1.00 6.48 C ATOM 1257 HA ALA A 81 6.746 7.076 0.440 1.00 0.00 H ATOM 1258 HB1 ALA A 81 4.637 8.256 0.094 1.00 0.00 H ATOM 1259 HB2 ALA A 81 5.513 9.651 -0.582 1.00 0.00 H ATOM 1260 HB3 ALA A 81 5.528 8.090 -1.439 1.00 0.00 H ATOM 1261 H ALA A 81 7.007 9.796 1.694 1.00 0.00 H ATOM 1262 N TYR A 82 7.955 9.299 -1.515 1.00 13.06 N ATOM 1263 CA TYR A 82 9.117 9.655 -2.336 1.00 14.49 C ATOM 1264 C TYR A 82 9.724 11.025 -2.038 1.00 13.76 C ATOM 1265 O TYR A 82 10.640 11.466 -2.723 1.00 17.74 O ATOM 1266 CB TYR A 82 8.768 9.526 -3.822 1.00 13.15 C ATOM 1267 CG TYR A 82 8.343 8.127 -4.192 1.00 10.68 C ATOM 1268 CD1 TYR A 82 7.028 7.705 -4.011 1.00 10.97 C ATOM 1269 CD2 TYR A 82 9.266 7.207 -4.666 1.00 12.80 C ATOM 1270 CE1 TYR A 82 6.647 6.393 -4.293 1.00 11.01 C ATOM 1271 CE2 TYR A 82 8.893 5.900 -4.952 1.00 12.56 C ATOM 1272 CZ TYR A 82 7.588 5.503 -4.763 1.00 11.12 C ATOM 1273 OH TYR A 82 7.241 4.209 -5.051 1.00 10.09 O ATOM 1274 HA TYR A 82 9.896 8.942 -2.067 1.00 0.00 H ATOM 1275 HB3 TYR A 82 9.644 9.794 -4.412 1.00 0.00 H ATOM 1276 HB2 TYR A 82 7.953 10.212 -4.052 1.00 0.00 H ATOM 1277 HD2 TYR A 82 10.301 7.514 -4.817 1.00 0.00 H ATOM 1278 HE2 TYR A 82 9.631 5.190 -5.325 1.00 0.00 H ATOM 1279 HE1 TYR A 82 5.615 6.075 -4.143 1.00 0.00 H ATOM 1280 HD1 TYR A 82 6.284 8.412 -3.643 1.00 0.00 H ATOM 1281 HH TYR A 82 6.277 4.078 -4.865 1.00 0.00 H ATOM 1282 H TYR A 82 7.025 9.695 -1.760 1.00 0.00 H ATOM 1283 N GLY A 83 9.204 11.700 -1.023 1.00 14.82 N ATOM 1284 CA GLY A 83 9.740 12.988 -0.620 1.00 15.95 C ATOM 1285 C GLY A 83 9.929 14.066 -1.665 1.00 16.75 C ATOM 1286 O GLY A 83 9.133 14.221 -2.587 1.00 16.07 O ATOM 1287 HA3 GLY A 83 10.717 12.802 -0.173 1.00 0.00 H ATOM 1288 HA2 GLY A 83 9.067 13.391 0.137 1.00 0.00 H ATOM 1289 H GLY A 83 8.396 11.299 -0.505 1.00 0.00 H ATOM 1290 N ALA A 84 11.012 14.813 -1.513 1.00 19.59 N ATOM 1291 CA ALA A 84 11.336 15.919 -2.401 1.00 23.09 C ATOM 1292 C ALA A 84 11.657 15.521 -3.826 1.00 24.79 C ATOM 1293 O ALA A 84 11.231 16.184 -4.758 1.00 26.11 O ATOM 1294 CB ALA A 84 12.488 16.718 -1.823 1.00 23.74 C ATOM 1295 HA ALA A 84 10.429 16.520 -2.462 1.00 0.00 H ATOM 1296 HB1 ALA A 84 12.203 17.109 -0.846 1.00 0.00 H ATOM 1297 HB2 ALA A 84 13.359 16.072 -1.717 1.00 0.00 H ATOM 1298 HB3 ALA A 84 12.727 17.545 -2.492 1.00 0.00 H ATOM 1299 H ALA A 84 11.658 14.600 -0.726 1.00 0.00 H ATOM 1300 N THR A 85 12.402 14.439 -3.992 1.00 26.88 N ATOM 1301 CA THR A 85 12.801 13.999 -5.318 1.00 31.37 C ATOM 1302 C THR A 85 11.767 13.253 -6.139 1.00 31.11 C ATOM 1303 O THR A 85 11.753 13.373 -7.363 1.00 33.83 O ATOM 1304 CB THR A 85 14.056 13.150 -5.250 1.00 34.58 C ATOM 1305 OG1 THR A 85 13.995 12.315 -4.086 1.00 38.16 O ATOM 1306 CG2 THR A 85 15.288 14.054 -5.184 1.00 37.36 C ATOM 1307 HA THR A 85 12.963 14.941 -5.841 1.00 0.00 H ATOM 1308 HB THR A 85 14.127 12.525 -6.140 1.00 0.00 H ATOM 1309 HG1 THR A 85 14.812 11.759 -4.037 1.00 0.00 H ATOM 1310 HG23 THR A 85 15.323 14.683 -6.073 1.00 0.00 H ATOM 1311 HG21 THR A 85 15.229 14.682 -4.295 1.00 0.00 H ATOM 1312 HG22 THR A 85 16.186 13.439 -5.137 1.00 0.00 H ATOM 1313 H THR A 85 12.707 13.895 -3.160 1.00 0.00 H ATOM 1314 N GLY A 86 10.907 12.486 -5.483 1.00 27.87 N ATOM 1315 CA GLY A 86 9.920 11.734 -6.226 1.00 26.18 C ATOM 1316 C GLY A 86 10.649 10.682 -7.035 1.00 25.71 C ATOM 1317 O GLY A 86 11.669 10.160 -6.590 1.00 25.66 O ATOM 1318 HA3 GLY A 86 9.371 12.400 -6.892 1.00 0.00 H ATOM 1319 HA2 GLY A 86 9.223 11.255 -5.538 1.00 0.00 H ATOM 1320 H GLY A 86 10.942 12.426 -4.445 1.00 0.00 H ATOM 1321 N HIS A 87 10.117 10.350 -8.208 1.00 26.34 N ATOM 1322 CA HIS A 87 10.730 9.354 -9.085 1.00 27.41 C ATOM 1323 C HIS A 87 10.355 9.718 -10.524 1.00 28.80 C ATOM 1324 O HIS A 87 9.203 9.582 -10.923 1.00 26.46 O ATOM 1325 CB HIS A 87 10.234 7.941 -8.733 1.00 24.47 C ATOM 1326 CG HIS A 87 10.997 6.838 -9.412 1.00 23.82 C ATOM 1327 ND1 HIS A 87 11.800 5.953 -8.725 1.00 22.66 N ATOM 1328 CD2 HIS A 87 11.048 6.457 -10.712 1.00 23.71 C ATOM 1329 CE1 HIS A 87 12.306 5.072 -9.569 1.00 23.84 C ATOM 1330 NE2 HIS A 87 11.865 5.356 -10.782 1.00 22.76 N ATOM 1331 HA HIS A 87 11.813 9.353 -8.963 1.00 0.00 H ATOM 1332 HB2 HIS A 87 10.322 7.805 -7.655 1.00 0.00 H ATOM 1333 HB3 HIS A 87 9.186 7.863 -9.024 1.00 0.00 H ATOM 1334 HD2 HIS A 87 10.536 6.936 -11.546 1.00 0.00 H ATOM 1335 HE1 HIS A 87 12.974 4.251 -9.309 1.00 0.00 H ATOM 1336 H HIS A 87 9.237 10.814 -8.511 1.00 0.00 H ATOM 1337 N PRO A 88 11.344 10.124 -11.334 1.00 32.33 N ATOM 1338 CA PRO A 88 11.181 10.520 -12.739 1.00 33.84 C ATOM 1339 C PRO A 88 10.194 9.709 -13.580 1.00 33.36 C ATOM 1340 O PRO A 88 10.273 8.485 -13.648 1.00 33.52 O ATOM 1341 CB PRO A 88 12.610 10.419 -13.298 1.00 34.87 C ATOM 1342 CG PRO A 88 13.317 9.488 -12.344 1.00 36.82 C ATOM 1343 CD PRO A 88 12.773 9.962 -11.018 1.00 35.87 C ATOM 1344 HA PRO A 88 10.729 11.511 -12.788 1.00 0.00 H ATOM 1345 HD3 PRO A 88 12.927 9.220 -10.235 1.00 0.00 H ATOM 1346 HD2 PRO A 88 13.225 10.907 -10.716 1.00 0.00 H ATOM 1347 HG3 PRO A 88 14.399 9.606 -12.398 1.00 0.00 H ATOM 1348 HG2 PRO A 88 13.057 8.447 -12.534 1.00 0.00 H ATOM 1349 HB2 PRO A 88 12.602 10.006 -14.307 1.00 0.00 H ATOM 1350 HB3 PRO A 88 13.090 11.397 -13.311 1.00 0.00 H ATOM 1351 N GLY A 89 9.239 10.413 -14.180 1.00 33.20 N ATOM 1352 CA GLY A 89 8.252 9.778 -15.036 1.00 34.39 C ATOM 1353 C GLY A 89 7.119 9.026 -14.365 1.00 34.08 C ATOM 1354 O GLY A 89 6.183 8.618 -15.047 1.00 35.39 O ATOM 1355 HA3 GLY A 89 8.781 9.070 -15.674 1.00 0.00 H ATOM 1356 HA2 GLY A 89 7.806 10.558 -15.653 1.00 0.00 H ATOM 1357 H GLY A 89 9.198 11.442 -14.033 1.00 0.00 H ATOM 1358 N ILE A 90 7.189 8.840 -13.047 1.00 31.03 N ATOM 1359 CA ILE A 90 6.150 8.119 -12.319 1.00 27.63 C ATOM 1360 C ILE A 90 5.537 8.956 -11.194 1.00 24.69 C ATOM 1361 O ILE A 90 4.327 9.173 -11.156 1.00 23.52 O ATOM 1362 CB ILE A 90 6.700 6.791 -11.717 1.00 28.01 C ATOM 1363 CG1 ILE A 90 7.285 5.897 -12.822 1.00 30.79 C ATOM 1364 CG2 ILE A 90 5.586 6.035 -11.006 1.00 29.99 C ATOM 1365 CD1 ILE A 90 7.806 4.540 -12.330 1.00 28.06 C ATOM 1366 HA ILE A 90 5.371 7.898 -13.049 1.00 0.00 H ATOM 1367 HB ILE A 90 7.486 7.043 -11.005 1.00 0.00 H ATOM 1368 HG12 ILE A 90 6.506 5.715 -13.562 1.00 0.00 H ATOM 1369 HG13 ILE A 90 8.112 6.431 -13.290 1.00 0.00 H ATOM 1370 HD11 ILE A 90 8.597 4.700 -11.597 1.00 0.00 H ATOM 1371 HD12 ILE A 90 6.989 3.984 -11.869 1.00 0.00 H ATOM 1372 HD13 ILE A 90 8.200 3.976 -13.175 1.00 0.00 H ATOM 1373 HG21 ILE A 90 5.185 6.653 -10.202 1.00 0.00 H ATOM 1374 HG22 ILE A 90 4.794 5.804 -11.718 1.00 0.00 H ATOM 1375 HG23 ILE A 90 5.985 5.109 -10.590 1.00 0.00 H ATOM 1376 H ILE A 90 8.005 9.218 -12.524 1.00 0.00 H ATOM 1377 N ILE A 91 6.387 9.422 -10.284 1.00 21.79 N ATOM 1378 CA ILE A 91 5.956 10.208 -9.128 1.00 20.21 C ATOM 1379 C ILE A 91 6.593 11.595 -9.138 1.00 20.49 C ATOM 1380 O ILE A 91 7.817 11.722 -9.158 1.00 22.10 O ATOM 1381 CB ILE A 91 6.391 9.532 -7.784 1.00 17.13 C ATOM 1382 CG1 ILE A 91 5.913 8.075 -7.699 1.00 13.65 C ATOM 1383 CG2 ILE A 91 5.924 10.362 -6.592 1.00 12.98 C ATOM 1384 CD1 ILE A 91 4.410 7.884 -7.724 1.00 14.82 C ATOM 1385 HA ILE A 91 4.870 10.274 -9.195 1.00 0.00 H ATOM 1386 HB ILE A 91 7.480 9.499 -7.758 1.00 0.00 H ATOM 1387 HG12 ILE A 91 6.336 7.532 -8.544 1.00 0.00 H ATOM 1388 HG13 ILE A 91 6.291 7.650 -6.769 1.00 0.00 H ATOM 1389 HD11 ILE A 91 3.965 8.406 -6.877 1.00 0.00 H ATOM 1390 HD12 ILE A 91 4.009 8.288 -8.654 1.00 0.00 H ATOM 1391 HD13 ILE A 91 4.179 6.821 -7.659 1.00 0.00 H ATOM 1392 HG21 ILE A 91 6.366 11.357 -6.648 1.00 0.00 H ATOM 1393 HG22 ILE A 91 4.837 10.445 -6.612 1.00 0.00 H ATOM 1394 HG23 ILE A 91 6.236 9.876 -5.668 1.00 0.00 H ATOM 1395 H ILE A 91 7.401 9.219 -10.399 1.00 0.00 H ATOM 1396 N PRO A 92 5.775 12.651 -9.176 1.00 22.89 N ATOM 1397 CA PRO A 92 6.324 14.011 -9.169 1.00 23.84 C ATOM 1398 C PRO A 92 6.885 14.348 -7.777 1.00 23.15 C ATOM 1399 O PRO A 92 6.696 13.590 -6.818 1.00 21.14 O ATOM 1400 CB PRO A 92 5.099 14.869 -9.514 1.00 23.24 C ATOM 1401 CG PRO A 92 3.967 14.075 -8.992 1.00 24.81 C ATOM 1402 CD PRO A 92 4.325 12.673 -9.413 1.00 22.46 C ATOM 1403 HA PRO A 92 7.152 14.164 -9.861 1.00 0.00 H ATOM 1404 HD3 PRO A 92 3.811 11.931 -8.802 1.00 0.00 H ATOM 1405 HD2 PRO A 92 4.091 12.502 -10.464 1.00 0.00 H ATOM 1406 HG3 PRO A 92 3.025 14.392 -9.439 1.00 0.00 H ATOM 1407 HG2 PRO A 92 3.898 14.155 -7.907 1.00 0.00 H ATOM 1408 HB2 PRO A 92 5.153 15.841 -9.024 1.00 0.00 H ATOM 1409 HB3 PRO A 92 5.013 15.011 -10.591 1.00 0.00 H ATOM 1410 N PRO A 93 7.638 15.453 -7.663 1.00 23.12 N ATOM 1411 CA PRO A 93 8.211 15.856 -6.375 1.00 22.79 C ATOM 1412 C PRO A 93 7.149 16.329 -5.377 1.00 19.35 C ATOM 1413 O PRO A 93 6.108 16.839 -5.777 1.00 18.51 O ATOM 1414 CB PRO A 93 9.163 16.993 -6.773 1.00 24.14 C ATOM 1415 CG PRO A 93 8.515 17.571 -7.977 1.00 24.83 C ATOM 1416 CD PRO A 93 8.111 16.336 -8.741 1.00 24.91 C ATOM 1417 HA PRO A 93 8.704 15.033 -5.858 1.00 0.00 H ATOM 1418 HD3 PRO A 93 7.316 16.553 -9.454 1.00 0.00 H ATOM 1419 HD2 PRO A 93 8.960 15.900 -9.267 1.00 0.00 H ATOM 1420 HG3 PRO A 93 9.215 18.180 -8.550 1.00 0.00 H ATOM 1421 HG2 PRO A 93 7.647 18.173 -7.709 1.00 0.00 H ATOM 1422 HB2 PRO A 93 9.242 17.734 -5.977 1.00 0.00 H ATOM 1423 HB3 PRO A 93 10.155 16.608 -7.009 1.00 0.00 H ATOM 1424 N HIS A 94 7.402 16.094 -4.090 1.00 18.19 N ATOM 1425 CA HIS A 94 6.505 16.494 -2.994 1.00 20.11 C ATOM 1426 C HIS A 94 5.072 15.983 -3.149 1.00 18.99 C ATOM 1427 O HIS A 94 4.125 16.640 -2.717 1.00 17.32 O ATOM 1428 CB HIS A 94 6.466 18.022 -2.859 1.00 21.83 C ATOM 1429 CG HIS A 94 7.814 18.658 -2.732 1.00 27.16 C ATOM 1430 ND1 HIS A 94 8.587 18.550 -1.594 1.00 31.68 N ATOM 1431 CD2 HIS A 94 8.518 19.435 -3.589 1.00 30.15 C ATOM 1432 CE1 HIS A 94 9.707 19.233 -1.755 1.00 30.97 C ATOM 1433 NE2 HIS A 94 9.689 19.777 -2.959 1.00 31.66 N ATOM 1434 HA HIS A 94 6.922 16.033 -2.098 1.00 0.00 H ATOM 1435 HB2 HIS A 94 5.976 18.432 -3.742 1.00 0.00 H ATOM 1436 HB3 HIS A 94 5.884 18.273 -1.972 1.00 0.00 H ATOM 1437 HD2 HIS A 94 8.212 19.733 -4.592 1.00 0.00 H ATOM 1438 HE1 HIS A 94 10.507 19.331 -1.021 1.00 0.00 H ATOM 1439 H HIS A 94 8.284 15.600 -3.846 1.00 0.00 H ATOM 1440 N ALA A 95 4.914 14.787 -3.703 1.00 18.23 N ATOM 1441 CA ALA A 95 3.583 14.255 -3.940 1.00 15.75 C ATOM 1442 C ALA A 95 2.960 13.450 -2.822 1.00 15.59 C ATOM 1443 O ALA A 95 3.593 12.558 -2.253 1.00 12.13 O ATOM 1444 CB ALA A 95 3.575 13.427 -5.230 1.00 14.26 C ATOM 1445 HA ALA A 95 2.956 15.143 -4.017 1.00 0.00 H ATOM 1446 HB1 ALA A 95 3.865 14.060 -6.069 1.00 0.00 H ATOM 1447 HB2 ALA A 95 4.281 12.602 -5.135 1.00 0.00 H ATOM 1448 HB3 ALA A 95 2.574 13.032 -5.400 1.00 0.00 H ATOM 1449 H ALA A 95 5.749 14.227 -3.969 1.00 0.00 H ATOM 1450 N THR A 96 1.708 13.770 -2.506 1.00 15.28 N ATOM 1451 CA THR A 96 0.961 13.008 -1.524 1.00 15.09 C ATOM 1452 C THR A 96 0.339 11.910 -2.385 1.00 14.12 C ATOM 1453 O THR A 96 -0.173 12.204 -3.470 1.00 14.27 O ATOM 1454 CB THR A 96 -0.149 13.848 -0.887 1.00 14.60 C ATOM 1455 OG1 THR A 96 0.446 14.803 -0.012 1.00 19.84 O ATOM 1456 CG2 THR A 96 -1.105 12.981 -0.086 1.00 12.61 C ATOM 1457 HA THR A 96 1.578 12.652 -0.699 1.00 0.00 H ATOM 1458 HB THR A 96 -0.711 14.340 -1.681 1.00 0.00 H ATOM 1459 HG1 THR A 96 1.056 15.387 -0.529 1.00 0.00 H ATOM 1460 HG23 THR A 96 -1.566 12.246 -0.746 1.00 0.00 H ATOM 1461 HG21 THR A 96 -0.554 12.468 0.703 1.00 0.00 H ATOM 1462 HG22 THR A 96 -1.878 13.609 0.358 1.00 0.00 H ATOM 1463 H THR A 96 1.256 14.582 -2.972 1.00 0.00 H ATOM 1464 N LEU A 97 0.442 10.654 -1.957 1.00 11.36 N ATOM 1465 CA LEU A 97 -0.132 9.562 -2.729 1.00 10.39 C ATOM 1466 C LEU A 97 -1.289 8.899 -1.992 1.00 10.48 C ATOM 1467 O LEU A 97 -1.327 8.849 -0.747 1.00 11.04 O ATOM 1468 CB LEU A 97 0.920 8.497 -3.057 1.00 10.84 C ATOM 1469 CG LEU A 97 2.279 8.947 -3.597 1.00 12.28 C ATOM 1470 CD1 LEU A 97 3.213 7.739 -3.655 1.00 13.96 C ATOM 1471 CD2 LEU A 97 2.142 9.601 -4.967 1.00 12.32 C ATOM 1472 HA LEU A 97 -0.504 10.001 -3.655 1.00 0.00 H ATOM 1473 HB2 LEU A 97 1.108 7.939 -2.140 1.00 0.00 H ATOM 1474 HB3 LEU A 97 0.483 7.833 -3.802 1.00 0.00 H ATOM 1475 HG LEU A 97 2.699 9.698 -2.928 1.00 0.00 H ATOM 1476 HD21 LEU A 97 1.709 8.887 -5.667 1.00 0.00 H ATOM 1477 HD22 LEU A 97 1.493 10.473 -4.888 1.00 0.00 H ATOM 1478 HD23 LEU A 97 3.126 9.909 -5.321 1.00 0.00 H ATOM 1479 HD11 LEU A 97 3.332 7.325 -2.654 1.00 0.00 H ATOM 1480 HD12 LEU A 97 2.786 6.983 -4.314 1.00 0.00 H ATOM 1481 HD13 LEU A 97 4.184 8.051 -4.039 1.00 0.00 H ATOM 1482 H LEU A 97 0.936 10.451 -1.065 1.00 0.00 H ATOM 1483 N VAL A 98 -2.237 8.388 -2.765 1.00 7.57 N ATOM 1484 CA VAL A 98 -3.389 7.705 -2.212 1.00 7.17 C ATOM 1485 C VAL A 98 -3.438 6.319 -2.831 1.00 8.48 C ATOM 1486 O VAL A 98 -3.336 6.166 -4.055 1.00 11.77 O ATOM 1487 CB VAL A 98 -4.707 8.475 -2.507 1.00 9.08 C ATOM 1488 CG1 VAL A 98 -5.872 7.724 -1.945 1.00 9.44 C ATOM 1489 CG2 VAL A 98 -4.657 9.877 -1.914 1.00 8.26 C ATOM 1490 HA VAL A 98 -3.295 7.645 -1.128 1.00 0.00 H ATOM 1491 HB VAL A 98 -4.822 8.562 -3.587 1.00 0.00 H ATOM 1492 HG11 VAL A 98 -5.921 6.736 -2.404 1.00 0.00 H ATOM 1493 HG12 VAL A 98 -5.749 7.620 -0.867 1.00 0.00 H ATOM 1494 HG13 VAL A 98 -6.791 8.271 -2.156 1.00 0.00 H ATOM 1495 HG21 VAL A 98 -4.523 9.809 -0.834 1.00 0.00 H ATOM 1496 HG22 VAL A 98 -3.823 10.426 -2.351 1.00 0.00 H ATOM 1497 HG23 VAL A 98 -5.590 10.396 -2.133 1.00 0.00 H ATOM 1498 H VAL A 98 -2.151 8.480 -3.797 1.00 0.00 H ATOM 1499 N PHE A 99 -3.519 5.298 -1.990 1.00 6.33 N ATOM 1500 CA PHE A 99 -3.566 3.931 -2.473 1.00 7.25 C ATOM 1501 C PHE A 99 -4.835 3.253 -2.020 1.00 8.71 C ATOM 1502 O PHE A 99 -5.261 3.411 -0.873 1.00 10.57 O ATOM 1503 CB PHE A 99 -2.397 3.105 -1.916 1.00 7.76 C ATOM 1504 CG PHE A 99 -1.051 3.439 -2.507 1.00 8.14 C ATOM 1505 CD1 PHE A 99 -0.284 4.487 -1.989 1.00 6.53 C ATOM 1506 CD2 PHE A 99 -0.514 2.644 -3.528 1.00 8.84 C ATOM 1507 CE1 PHE A 99 0.998 4.737 -2.472 1.00 9.67 C ATOM 1508 CE2 PHE A 99 0.778 2.880 -4.026 1.00 7.19 C ATOM 1509 CZ PHE A 99 1.540 3.937 -3.491 1.00 6.70 C ATOM 1510 HA PHE A 99 -3.514 3.980 -3.561 1.00 0.00 H ATOM 1511 HB2 PHE A 99 -2.346 3.271 -0.840 1.00 0.00 H ATOM 1512 HB3 PHE A 99 -2.602 2.052 -2.111 1.00 0.00 H ATOM 1513 HD2 PHE A 99 -1.108 1.830 -3.942 1.00 0.00 H ATOM 1514 HE2 PHE A 99 1.186 2.252 -4.818 1.00 0.00 H ATOM 1515 HZ PHE A 99 2.545 4.133 -3.866 1.00 0.00 H ATOM 1516 HE1 PHE A 99 1.584 5.557 -2.057 1.00 0.00 H ATOM 1517 HD1 PHE A 99 -0.694 5.115 -1.198 1.00 0.00 H ATOM 1518 H PHE A 99 -3.549 5.480 -0.966 1.00 0.00 H ATOM 1519 N ASP A 100 -5.450 2.523 -2.940 1.00 6.70 N ATOM 1520 CA ASP A 100 -6.624 1.738 -2.648 1.00 8.51 C ATOM 1521 C ASP A 100 -5.928 0.382 -2.497 1.00 7.81 C ATOM 1522 O ASP A 100 -5.375 -0.151 -3.471 1.00 7.60 O ATOM 1523 CB ASP A 100 -7.560 1.761 -3.858 1.00 10.04 C ATOM 1524 CG ASP A 100 -8.754 0.827 -3.718 1.00 14.10 C ATOM 1525 OD1 ASP A 100 -8.745 -0.138 -2.925 1.00 13.17 O ATOM 1526 OD2 ASP A 100 -9.712 1.044 -4.463 1.00 19.47 O ATOM 1527 HA ASP A 100 -7.243 2.045 -1.805 1.00 0.00 H ATOM 1528 HB2 ASP A 100 -7.930 2.778 -3.989 1.00 0.00 H ATOM 1529 HB3 ASP A 100 -6.992 1.466 -4.740 1.00 0.00 H ATOM 1530 H ASP A 100 -5.072 2.516 -3.909 1.00 0.00 H ATOM 1531 N VAL A 101 -5.930 -0.157 -1.282 1.00 8.45 N ATOM 1532 CA VAL A 101 -5.240 -1.410 -0.995 1.00 10.00 C ATOM 1533 C VAL A 101 -6.146 -2.496 -0.444 1.00 8.41 C ATOM 1534 O VAL A 101 -6.966 -2.244 0.439 1.00 9.47 O ATOM 1535 CB VAL A 101 -4.097 -1.199 0.073 1.00 10.27 C ATOM 1536 CG1 VAL A 101 -3.360 -2.506 0.335 1.00 11.41 C ATOM 1537 CG2 VAL A 101 -3.117 -0.112 -0.359 1.00 9.10 C ATOM 1538 HA VAL A 101 -4.844 -1.727 -1.960 1.00 0.00 H ATOM 1539 HB VAL A 101 -4.569 -0.871 0.999 1.00 0.00 H ATOM 1540 HG11 VAL A 101 -4.063 -3.249 0.712 1.00 0.00 H ATOM 1541 HG12 VAL A 101 -2.915 -2.863 -0.594 1.00 0.00 H ATOM 1542 HG13 VAL A 101 -2.577 -2.338 1.074 1.00 0.00 H ATOM 1543 HG21 VAL A 101 -2.656 -0.395 -1.305 1.00 0.00 H ATOM 1544 HG22 VAL A 101 -3.652 0.830 -0.482 1.00 0.00 H ATOM 1545 HG23 VAL A 101 -2.345 0.003 0.402 1.00 0.00 H ATOM 1546 H VAL A 101 -6.438 0.328 -0.515 1.00 0.00 H ATOM 1547 N GLU A 102 -5.970 -3.711 -0.947 1.00 6.43 N ATOM 1548 CA GLU A 102 -6.724 -4.855 -0.463 1.00 9.19 C ATOM 1549 C GLU A 102 -5.749 -5.956 -0.031 1.00 9.51 C ATOM 1550 O GLU A 102 -4.955 -6.443 -0.844 1.00 9.24 O ATOM 1551 CB GLU A 102 -7.695 -5.386 -1.528 1.00 12.15 C ATOM 1552 CG GLU A 102 -8.570 -6.502 -0.974 1.00 17.17 C ATOM 1553 CD GLU A 102 -9.611 -7.031 -1.943 1.00 21.88 C ATOM 1554 OE1 GLU A 102 -9.685 -6.574 -3.109 1.00 24.04 O ATOM 1555 OE2 GLU A 102 -10.362 -7.926 -1.513 1.00 22.63 O ATOM 1556 HA GLU A 102 -7.323 -4.538 0.390 1.00 0.00 H ATOM 1557 HB2 GLU A 102 -8.333 -4.569 -1.866 1.00 0.00 H ATOM 1558 HB3 GLU A 102 -7.121 -5.770 -2.372 1.00 0.00 H ATOM 1559 HG2 GLU A 102 -7.923 -7.330 -0.685 1.00 0.00 H ATOM 1560 HG3 GLU A 102 -9.087 -6.123 -0.093 1.00 0.00 H ATOM 1561 H GLU A 102 -5.274 -3.848 -1.708 1.00 0.00 H ATOM 1562 N LEU A 103 -5.745 -6.286 1.260 1.00 9.28 N ATOM 1563 CA LEU A 103 -4.854 -7.339 1.777 1.00 8.75 C ATOM 1564 C LEU A 103 -5.531 -8.692 1.575 1.00 8.42 C ATOM 1565 O LEU A 103 -6.444 -9.048 2.306 1.00 7.75 O ATOM 1566 CB LEU A 103 -4.551 -7.111 3.260 1.00 10.38 C ATOM 1567 CG LEU A 103 -3.632 -8.110 3.991 1.00 11.93 C ATOM 1568 CD1 LEU A 103 -2.280 -8.264 3.264 1.00 11.60 C ATOM 1569 CD2 LEU A 103 -3.410 -7.640 5.419 1.00 10.62 C ATOM 1570 HA LEU A 103 -3.908 -7.314 1.237 1.00 0.00 H ATOM 1571 HB2 LEU A 103 -4.089 -6.128 3.346 1.00 0.00 H ATOM 1572 HB3 LEU A 103 -5.506 -7.109 3.786 1.00 0.00 H ATOM 1573 HG LEU A 103 -4.117 -9.086 3.997 1.00 0.00 H ATOM 1574 HD21 LEU A 103 -2.942 -6.655 5.408 1.00 0.00 H ATOM 1575 HD22 LEU A 103 -4.369 -7.582 5.934 1.00 0.00 H ATOM 1576 HD23 LEU A 103 -2.760 -8.346 5.936 1.00 0.00 H ATOM 1577 HD11 LEU A 103 -2.453 -8.628 2.251 1.00 0.00 H ATOM 1578 HD12 LEU A 103 -1.779 -7.297 3.223 1.00 0.00 H ATOM 1579 HD13 LEU A 103 -1.657 -8.975 3.806 1.00 0.00 H ATOM 1580 H LEU A 103 -6.383 -5.791 1.915 1.00 0.00 H ATOM 1581 N LEU A 104 -5.042 -9.462 0.611 1.00 8.79 N ATOM 1582 CA LEU A 104 -5.639 -10.753 0.262 1.00 11.98 C ATOM 1583 C LEU A 104 -5.288 -11.939 1.153 1.00 13.60 C ATOM 1584 O LEU A 104 -6.162 -12.721 1.524 1.00 12.37 O ATOM 1585 CB LEU A 104 -5.295 -11.085 -1.186 1.00 16.67 C ATOM 1586 CG LEU A 104 -5.551 -9.940 -2.172 1.00 18.37 C ATOM 1587 CD1 LEU A 104 -4.904 -10.240 -3.514 1.00 20.38 C ATOM 1588 CD2 LEU A 104 -7.051 -9.720 -2.326 1.00 20.04 C ATOM 1589 HA LEU A 104 -6.708 -10.612 0.419 1.00 0.00 H ATOM 1590 HB2 LEU A 104 -4.238 -11.348 -1.235 1.00 0.00 H ATOM 1591 HB3 LEU A 104 -5.896 -11.941 -1.493 1.00 0.00 H ATOM 1592 HG LEU A 104 -5.103 -9.026 -1.783 1.00 0.00 H ATOM 1593 HD21 LEU A 104 -7.514 -10.632 -2.703 1.00 0.00 H ATOM 1594 HD22 LEU A 104 -7.481 -9.466 -1.357 1.00 0.00 H ATOM 1595 HD23 LEU A 104 -7.227 -8.905 -3.028 1.00 0.00 H ATOM 1596 HD11 LEU A 104 -3.829 -10.359 -3.379 1.00 0.00 H ATOM 1597 HD12 LEU A 104 -5.324 -11.160 -3.921 1.00 0.00 H ATOM 1598 HD13 LEU A 104 -5.096 -9.416 -4.201 1.00 0.00 H ATOM 1599 H LEU A 104 -4.206 -9.137 0.085 1.00 0.00 H ATOM 1600 N LYS A 105 -4.007 -12.100 1.457 1.00 14.67 N ATOM 1601 CA LYS A 105 -3.549 -13.203 2.303 1.00 16.66 C ATOM 1602 C LYS A 105 -2.131 -12.944 2.783 1.00 14.58 C ATOM 1603 O LYS A 105 -1.479 -12.002 2.332 1.00 11.25 O ATOM 1604 CB LYS A 105 -3.582 -14.531 1.534 1.00 19.14 C ATOM 1605 CG LYS A 105 -2.691 -14.547 0.321 1.00 22.26 C ATOM 1606 CD LYS A 105 -2.698 -15.900 -0.376 1.00 29.41 C ATOM 1607 CE LYS A 105 -2.108 -16.991 0.511 1.00 35.11 C ATOM 1608 NZ LYS A 105 -1.998 -18.304 -0.199 1.00 37.14 N ATOM 1609 HA LYS A 105 -4.221 -13.269 3.159 1.00 0.00 H ATOM 1610 HB2 LYS A 105 -3.263 -15.327 2.207 1.00 0.00 H ATOM 1611 HB3 LYS A 105 -4.606 -14.718 1.212 1.00 0.00 H ATOM 1612 HG2 LYS A 105 -3.038 -13.788 -0.380 1.00 0.00 H ATOM 1613 HG3 LYS A 105 -1.672 -14.316 0.630 1.00 0.00 H ATOM 1614 HD2 LYS A 105 -3.725 -16.164 -0.626 1.00 0.00 H ATOM 1615 HD3 LYS A 105 -2.109 -15.830 -1.291 1.00 0.00 H ATOM 1616 HE2 LYS A 105 -2.748 -17.117 1.384 1.00 0.00 H ATOM 1617 HE3 LYS A 105 -1.113 -16.682 0.833 1.00 0.00 H ATOM 1618 HZ1 LYS A 105 -2.943 -18.612 -0.504 1.00 0.00 H ATOM 1619 HZ2 LYS A 105 -1.383 -18.197 -1.030 1.00 0.00 H ATOM 1620 HZ3 LYS A 105 -1.592 -19.012 0.445 1.00 0.00 H ATOM 1621 H LYS A 105 -3.310 -11.425 1.084 1.00 0.00 H ATOM 1622 N LEU A 106 -1.694 -13.762 3.735 1.00 15.88 N ATOM 1623 CA LEU A 106 -0.354 -13.693 4.304 1.00 16.40 C ATOM 1624 C LEU A 106 0.311 -15.030 4.007 1.00 20.31 C ATOM 1625 O LEU A 106 -0.359 -16.076 4.011 1.00 20.56 O ATOM 1626 CB LEU A 106 -0.426 -13.485 5.819 1.00 13.53 C ATOM 1627 CG LEU A 106 -0.953 -12.122 6.257 1.00 11.75 C ATOM 1628 CD1 LEU A 106 -1.101 -12.055 7.772 1.00 15.61 C ATOM 1629 CD2 LEU A 106 -0.001 -11.058 5.761 1.00 11.63 C ATOM 1630 HA LEU A 106 0.205 -12.860 3.878 1.00 0.00 H ATOM 1631 HB2 LEU A 106 -1.080 -14.251 6.235 1.00 0.00 H ATOM 1632 HB3 LEU A 106 0.578 -13.607 6.226 1.00 0.00 H ATOM 1633 HG LEU A 106 -1.942 -11.958 5.830 1.00 0.00 H ATOM 1634 HD21 LEU A 106 0.988 -11.230 6.187 1.00 0.00 H ATOM 1635 HD22 LEU A 106 0.058 -11.103 4.674 1.00 0.00 H ATOM 1636 HD23 LEU A 106 -0.364 -10.077 6.066 1.00 0.00 H ATOM 1637 HD11 LEU A 106 -1.800 -12.823 8.102 1.00 0.00 H ATOM 1638 HD12 LEU A 106 -0.130 -12.221 8.238 1.00 0.00 H ATOM 1639 HD13 LEU A 106 -1.478 -11.073 8.056 1.00 0.00 H ATOM 1640 H LEU A 106 -2.344 -14.491 4.093 1.00 0.00 H ATOM 1641 N GLU A 107 1.599 -15.003 3.682 1.00 20.45 N ATOM 1642 CA GLU A 107 2.297 -16.246 3.416 1.00 23.73 C ATOM 1643 C GLU A 107 3.778 -16.219 3.782 1.00 22.19 C ATOM 1644 O GLU A 107 4.192 -15.336 4.557 1.00 21.30 O ATOM 1645 CB GLU A 107 2.061 -16.713 1.971 1.00 23.09 C ATOM 1646 CG GLU A 107 2.442 -15.733 0.882 1.00 26.25 C ATOM 1647 CD GLU A 107 2.054 -16.215 -0.528 1.00 25.05 C ATOM 1648 OE1 GLU A 107 1.009 -16.868 -0.704 1.00 24.58 O ATOM 1649 OE2 GLU A 107 2.803 -15.922 -1.474 1.00 27.18 O ATOM 1650 HA GLU A 107 1.861 -16.987 4.087 1.00 0.00 H ATOM 1651 OXT GLU A 107 4.503 -17.135 3.361 1.00 25.88 O ATOM 1652 HB2 GLU A 107 2.640 -17.624 1.817 1.00 0.00 H ATOM 1653 HB3 GLU A 107 1.000 -16.936 1.862 1.00 0.00 H ATOM 1654 HG2 GLU A 107 1.939 -14.786 1.076 1.00 0.00 H ATOM 1655 HG3 GLU A 107 3.521 -15.582 0.913 1.00 0.00 H ATOM 1656 H GLU A 107 2.104 -14.096 3.619 1.00 0.00 H TER 1657 GLU A 107 ATOM 1658 N GLY B 1 17.266 11.001 5.115 1.00 12.78 N ATOM 1659 CA GLY B 1 17.319 9.727 5.889 1.00 13.71 C ATOM 1660 C GLY B 1 18.213 9.958 7.088 1.00 13.13 C ATOM 1661 O GLY B 1 18.436 11.107 7.459 1.00 13.99 O ATOM 1662 HA3 GLY B 1 17.728 8.931 5.267 1.00 0.00 H ATOM 1663 HA2 GLY B 1 16.318 9.450 6.219 1.00 0.00 H ATOM 1664 HN3 GLY B 1 18.226 11.259 4.808 1.00 0.00 H ATOM 1665 HN2 GLY B 1 16.879 11.755 5.717 1.00 0.00 H ATOM 1666 HN1 GLY B 1 16.657 10.874 4.282 1.00 0.00 H ATOM 1667 N VAL B 2 18.717 8.888 7.688 1.00 13.35 N ATOM 1668 CA VAL B 2 19.601 9.004 8.847 1.00 13.16 C ATOM 1669 C VAL B 2 20.961 8.375 8.543 1.00 12.05 C ATOM 1670 O VAL B 2 21.046 7.216 8.115 1.00 11.57 O ATOM 1671 CB VAL B 2 18.972 8.380 10.135 1.00 12.77 C ATOM 1672 CG1 VAL B 2 18.622 6.933 9.922 1.00 16.06 C ATOM 1673 CG2 VAL B 2 19.931 8.525 11.331 1.00 15.37 C ATOM 1674 HA VAL B 2 19.741 10.066 9.047 1.00 0.00 H ATOM 1675 HB VAL B 2 18.053 8.924 10.354 1.00 0.00 H ATOM 1676 HG11 VAL B 2 17.902 6.851 9.107 1.00 0.00 H ATOM 1677 HG12 VAL B 2 19.524 6.376 9.669 1.00 0.00 H ATOM 1678 HG13 VAL B 2 18.187 6.528 10.835 1.00 0.00 H ATOM 1679 HG21 VAL B 2 20.866 8.011 11.109 1.00 0.00 H ATOM 1680 HG22 VAL B 2 20.129 9.582 11.510 1.00 0.00 H ATOM 1681 HG23 VAL B 2 19.474 8.084 12.217 1.00 0.00 H ATOM 1682 H VAL B 2 18.478 7.943 7.325 1.00 0.00 H ATOM 1683 N GLN B 3 22.007 9.183 8.682 1.00 9.01 N ATOM 1684 CA GLN B 3 23.369 8.746 8.442 1.00 11.57 C ATOM 1685 C GLN B 3 24.060 8.596 9.793 1.00 13.08 C ATOM 1686 O GLN B 3 23.928 9.452 10.675 1.00 11.28 O ATOM 1687 CB GLN B 3 24.096 9.762 7.579 1.00 12.66 C ATOM 1688 CG GLN B 3 23.506 9.881 6.176 1.00 16.76 C ATOM 1689 CD GLN B 3 24.094 11.039 5.419 1.00 23.01 C ATOM 1690 OE1 GLN B 3 23.828 12.204 5.734 1.00 25.15 O ATOM 1691 NE2 GLN B 3 24.918 10.736 4.425 1.00 22.09 N ATOM 1692 HA GLN B 3 23.377 7.793 7.914 1.00 0.00 H ATOM 1693 HB2 GLN B 3 24.038 10.736 8.065 1.00 0.00 H ATOM 1694 HB3 GLN B 3 25.140 9.462 7.493 1.00 0.00 H ATOM 1695 HG2 GLN B 3 23.710 8.961 5.628 1.00 0.00 H ATOM 1696 HG3 GLN B 3 22.428 10.023 6.257 1.00 0.00 H ATOM 1697 HE22 GLN B 3 25.112 9.740 4.196 1.00 0.00 H ATOM 1698 HE21 GLN B 3 25.370 11.494 3.875 1.00 0.00 H ATOM 1699 H GLN B 3 21.842 10.167 8.974 1.00 0.00 H ATOM 1700 N VAL B 4 24.770 7.487 9.955 1.00 12.35 N ATOM 1701 CA VAL B 4 25.457 7.166 11.199 1.00 10.53 C ATOM 1702 C VAL B 4 26.971 7.193 11.030 1.00 11.20 C ATOM 1703 O VAL B 4 27.503 6.547 10.135 1.00 9.39 O ATOM 1704 CB VAL B 4 25.059 5.762 11.647 1.00 10.51 C ATOM 1705 CG1 VAL B 4 25.686 5.425 12.987 1.00 11.95 C ATOM 1706 CG2 VAL B 4 23.551 5.650 11.671 1.00 10.78 C ATOM 1707 HA VAL B 4 25.170 7.915 11.937 1.00 0.00 H ATOM 1708 HB VAL B 4 25.439 5.029 10.935 1.00 0.00 H ATOM 1709 HG11 VAL B 4 26.772 5.472 12.901 1.00 0.00 H ATOM 1710 HG12 VAL B 4 25.348 6.142 13.735 1.00 0.00 H ATOM 1711 HG13 VAL B 4 25.387 4.420 13.284 1.00 0.00 H ATOM 1712 HG21 VAL B 4 23.145 6.384 12.367 1.00 0.00 H ATOM 1713 HG22 VAL B 4 23.158 5.839 10.672 1.00 0.00 H ATOM 1714 HG23 VAL B 4 23.267 4.647 11.991 1.00 0.00 H ATOM 1715 H VAL B 4 24.839 6.819 9.161 1.00 0.00 H ATOM 1716 N GLU B 5 27.651 8.003 11.829 1.00 9.59 N ATOM 1717 CA GLU B 5 29.101 8.045 11.775 1.00 10.45 C ATOM 1718 C GLU B 5 29.572 7.615 13.157 1.00 12.34 C ATOM 1719 O GLU B 5 29.210 8.230 14.159 1.00 11.61 O ATOM 1720 CB GLU B 5 29.615 9.450 11.463 1.00 10.43 C ATOM 1721 CG GLU B 5 31.131 9.543 11.516 1.00 15.02 C ATOM 1722 CD GLU B 5 31.680 10.902 11.108 1.00 21.39 C ATOM 1723 OE1 GLU B 5 30.907 11.745 10.625 1.00 27.99 O ATOM 1724 OE2 GLU B 5 32.903 11.129 11.261 1.00 26.85 O ATOM 1725 HA GLU B 5 29.478 7.396 10.984 1.00 0.00 H ATOM 1726 HB2 GLU B 5 29.283 9.730 10.463 1.00 0.00 H ATOM 1727 HB3 GLU B 5 29.197 10.145 12.191 1.00 0.00 H ATOM 1728 HG2 GLU B 5 31.452 9.335 12.537 1.00 0.00 H ATOM 1729 HG3 GLU B 5 31.545 8.790 10.845 1.00 0.00 H ATOM 1730 H GLU B 5 27.142 8.613 12.500 1.00 0.00 H ATOM 1731 N THR B 6 30.335 6.536 13.236 1.00 10.37 N ATOM 1732 CA THR B 6 30.829 6.088 14.541 1.00 12.27 C ATOM 1733 C THR B 6 32.018 6.911 15.071 1.00 11.21 C ATOM 1734 O THR B 6 32.977 7.187 14.346 1.00 12.83 O ATOM 1735 CB THR B 6 31.173 4.617 14.500 1.00 12.38 C ATOM 1736 OG1 THR B 6 29.976 3.876 14.207 1.00 13.72 O ATOM 1737 CG2 THR B 6 31.734 4.173 15.840 1.00 13.50 C ATOM 1738 HA THR B 6 30.014 6.252 15.246 1.00 0.00 H ATOM 1739 HB THR B 6 31.925 4.437 13.732 1.00 0.00 H ATOM 1740 HG1 THR B 6 30.187 2.909 14.177 1.00 0.00 H ATOM 1741 HG23 THR B 6 32.641 4.737 16.058 1.00 0.00 H ATOM 1742 HG21 THR B 6 30.995 4.355 16.620 1.00 0.00 H ATOM 1743 HG22 THR B 6 31.967 3.109 15.800 1.00 0.00 H ATOM 1744 H THR B 6 30.583 6.008 12.375 1.00 0.00 H ATOM 1745 N ILE B 7 31.924 7.315 16.333 1.00 11.37 N ATOM 1746 CA ILE B 7 32.948 8.115 16.999 1.00 13.88 C ATOM 1747 C ILE B 7 33.769 7.239 17.959 1.00 13.39 C ATOM 1748 O ILE B 7 34.944 7.503 18.198 1.00 15.62 O ATOM 1749 CB ILE B 7 32.291 9.229 17.841 1.00 16.65 C ATOM 1750 CG1 ILE B 7 31.545 10.207 16.948 1.00 21.03 C ATOM 1751 CG2 ILE B 7 33.333 9.958 18.663 1.00 19.55 C ATOM 1752 CD1 ILE B 7 30.654 11.135 17.741 1.00 28.29 C ATOM 1753 HA ILE B 7 33.589 8.543 16.228 1.00 0.00 H ATOM 1754 HB ILE B 7 31.575 8.766 18.520 1.00 0.00 H ATOM 1755 HG12 ILE B 7 32.271 10.803 16.396 1.00 0.00 H ATOM 1756 HG13 ILE B 7 30.930 9.644 16.246 1.00 0.00 H ATOM 1757 HD11 ILE B 7 29.919 10.548 18.292 1.00 0.00 H ATOM 1758 HD12 ILE B 7 31.261 11.709 18.441 1.00 0.00 H ATOM 1759 HD13 ILE B 7 30.142 11.815 17.060 1.00 0.00 H ATOM 1760 HG21 ILE B 7 33.826 9.252 19.332 1.00 0.00 H ATOM 1761 HG22 ILE B 7 34.071 10.405 17.997 1.00 0.00 H ATOM 1762 HG23 ILE B 7 32.850 10.739 19.250 1.00 0.00 H ATOM 1763 H ILE B 7 31.077 7.048 16.875 1.00 0.00 H ATOM 1764 N SER B 8 33.103 6.283 18.587 1.00 10.17 N ATOM 1765 CA SER B 8 33.730 5.367 19.512 1.00 13.11 C ATOM 1766 C SER B 8 32.977 4.057 19.359 1.00 12.71 C ATOM 1767 O SER B 8 31.754 4.055 19.292 1.00 11.81 O ATOM 1768 CB SER B 8 33.593 5.887 20.936 1.00 15.32 C ATOM 1769 OG SER B 8 34.137 4.955 21.850 1.00 22.91 O ATOM 1770 HA SER B 8 34.794 5.249 19.309 1.00 0.00 H ATOM 1771 HB2 SER B 8 32.538 6.041 21.163 1.00 0.00 H ATOM 1772 HB3 SER B 8 34.125 6.834 21.027 1.00 0.00 H ATOM 1773 HG SER B 8 33.653 4.095 21.770 1.00 0.00 H ATOM 1774 H SER B 8 32.083 6.187 18.407 1.00 0.00 H ATOM 1775 N PRO B 9 33.691 2.921 19.292 1.00 15.21 N ATOM 1776 CA PRO B 9 33.009 1.635 19.135 1.00 14.65 C ATOM 1777 C PRO B 9 32.267 1.084 20.348 1.00 13.44 C ATOM 1778 O PRO B 9 32.612 1.358 21.499 1.00 13.61 O ATOM 1779 CB PRO B 9 34.140 0.709 18.695 1.00 12.19 C ATOM 1780 CG PRO B 9 35.289 1.238 19.460 1.00 13.83 C ATOM 1781 CD PRO B 9 35.154 2.736 19.304 1.00 14.91 C ATOM 1782 HA PRO B 9 32.183 1.738 18.431 1.00 0.00 H ATOM 1783 HD3 PRO B 9 35.612 3.263 20.141 1.00 0.00 H ATOM 1784 HD2 PRO B 9 35.603 3.078 18.372 1.00 0.00 H ATOM 1785 HG3 PRO B 9 36.232 0.885 19.042 1.00 0.00 H ATOM 1786 HG2 PRO B 9 35.227 0.948 20.509 1.00 0.00 H ATOM 1787 HB2 PRO B 9 33.930 -0.327 18.962 1.00 0.00 H ATOM 1788 HB3 PRO B 9 34.314 0.778 17.621 1.00 0.00 H ATOM 1789 N GLY B 10 31.210 0.339 20.061 1.00 11.18 N ATOM 1790 CA GLY B 10 30.426 -0.290 21.097 1.00 13.84 C ATOM 1791 C GLY B 10 30.947 -1.703 21.186 1.00 16.20 C ATOM 1792 O GLY B 10 32.037 -1.971 20.698 1.00 17.21 O ATOM 1793 HA3 GLY B 10 29.369 -0.288 20.831 1.00 0.00 H ATOM 1794 HA2 GLY B 10 30.561 0.228 22.047 1.00 0.00 H ATOM 1795 H GLY B 10 30.939 0.204 19.066 1.00 0.00 H ATOM 1796 N ASP B 11 30.173 -2.618 21.750 1.00 15.45 N ATOM 1797 CA ASP B 11 30.645 -3.985 21.854 1.00 19.23 C ATOM 1798 C ASP B 11 30.422 -4.785 20.577 1.00 18.60 C ATOM 1799 O ASP B 11 30.843 -5.930 20.480 1.00 21.43 O ATOM 1800 CB ASP B 11 30.070 -4.694 23.095 1.00 17.55 C ATOM 1801 CG ASP B 11 28.567 -4.954 23.017 1.00 18.95 C ATOM 1802 OD1 ASP B 11 27.932 -4.790 21.958 1.00 15.80 O ATOM 1803 OD2 ASP B 11 28.006 -5.346 24.057 1.00 22.00 O ATOM 1804 HA ASP B 11 31.725 -3.931 21.988 1.00 0.00 H ATOM 1805 HB2 ASP B 11 30.579 -5.651 23.211 1.00 0.00 H ATOM 1806 HB3 ASP B 11 30.266 -4.072 23.968 1.00 0.00 H ATOM 1807 H ASP B 11 29.235 -2.358 22.115 1.00 0.00 H ATOM 1808 N GLY B 12 29.763 -4.163 19.603 1.00 19.17 N ATOM 1809 CA GLY B 12 29.490 -4.806 18.329 1.00 18.06 C ATOM 1810 C GLY B 12 28.609 -6.043 18.387 1.00 21.00 C ATOM 1811 O GLY B 12 28.521 -6.772 17.405 1.00 21.48 O ATOM 1812 HA3 GLY B 12 30.444 -5.095 17.889 1.00 0.00 H ATOM 1813 HA2 GLY B 12 29.000 -4.076 17.684 1.00 0.00 H ATOM 1814 H GLY B 12 29.434 -3.189 19.758 1.00 0.00 H ATOM 1815 N ARG B 13 27.893 -6.252 19.485 1.00 19.51 N ATOM 1816 CA ARG B 13 27.058 -7.438 19.602 1.00 20.84 C ATOM 1817 C ARG B 13 25.702 -7.232 20.258 1.00 20.66 C ATOM 1818 O ARG B 13 24.722 -7.877 19.881 1.00 18.97 O ATOM 1819 CB ARG B 13 27.834 -8.553 20.310 1.00 26.35 C ATOM 1820 CG ARG B 13 28.447 -8.162 21.643 1.00 35.48 C ATOM 1821 CD ARG B 13 29.465 -9.191 22.118 1.00 43.51 C ATOM 1822 NE ARG B 13 28.886 -10.533 22.202 1.00 52.68 N ATOM 1823 CZ ARG B 13 29.107 -11.512 21.321 1.00 56.08 C ATOM 1824 NH1 ARG B 13 29.902 -11.315 20.270 1.00 56.76 N ATOM 1825 NH2 ARG B 13 28.527 -12.696 21.491 1.00 57.52 N ATOM 1826 HA ARG B 13 26.820 -7.719 18.576 1.00 0.00 H ATOM 1827 HB2 ARG B 13 27.150 -9.384 20.483 1.00 0.00 H ATOM 1828 HB3 ARG B 13 28.638 -8.877 19.650 1.00 0.00 H ATOM 1829 HG2 ARG B 13 28.943 -7.198 21.535 1.00 0.00 H ATOM 1830 HG3 ARG B 13 27.654 -8.080 22.386 1.00 0.00 H ATOM 1831 HD2 ARG B 13 29.826 -8.900 23.104 1.00 0.00 H ATOM 1832 HD3 ARG B 13 30.300 -9.210 21.418 1.00 0.00 H ATOM 1833 HE ARG B 13 28.258 -10.739 23.005 1.00 0.00 H ATOM 1834 HH12 ARG B 13 30.066 -12.085 19.591 1.00 0.00 H ATOM 1835 HH11 ARG B 13 30.358 -10.391 20.129 1.00 0.00 H ATOM 1836 HH22 ARG B 13 28.696 -13.461 20.807 1.00 0.00 H ATOM 1837 HH21 ARG B 13 27.904 -12.857 22.308 1.00 0.00 H ATOM 1838 H ARG B 13 27.929 -5.565 20.265 1.00 0.00 H ATOM 1839 N THR B 14 25.642 -6.359 21.256 1.00 18.93 N ATOM 1840 CA THR B 14 24.382 -6.079 21.932 1.00 18.06 C ATOM 1841 C THR B 14 23.668 -4.887 21.257 1.00 17.92 C ATOM 1842 O THR B 14 24.042 -3.727 21.457 1.00 15.96 O ATOM 1843 CB THR B 14 24.609 -5.791 23.415 1.00 17.12 C ATOM 1844 OG1 THR B 14 25.535 -6.743 23.955 1.00 18.85 O ATOM 1845 CG2 THR B 14 23.308 -5.901 24.174 1.00 18.82 C ATOM 1846 HA THR B 14 23.748 -6.962 21.852 1.00 0.00 H ATOM 1847 HB THR B 14 25.006 -4.781 23.515 1.00 0.00 H ATOM 1848 HG1 THR B 14 26.396 -6.675 23.471 1.00 0.00 H ATOM 1849 HG23 THR B 14 22.593 -5.182 23.774 1.00 0.00 H ATOM 1850 HG21 THR B 14 22.910 -6.910 24.066 1.00 0.00 H ATOM 1851 HG22 THR B 14 23.485 -5.690 25.229 1.00 0.00 H ATOM 1852 H THR B 14 26.507 -5.868 21.560 1.00 0.00 H ATOM 1853 N PHE B 15 22.672 -5.195 20.432 1.00 19.32 N ATOM 1854 CA PHE B 15 21.889 -4.198 19.709 1.00 19.33 C ATOM 1855 C PHE B 15 20.469 -4.169 20.278 1.00 20.71 C ATOM 1856 O PHE B 15 19.925 -5.215 20.647 1.00 21.10 O ATOM 1857 CB PHE B 15 21.859 -4.552 18.226 1.00 19.54 C ATOM 1858 CG PHE B 15 23.189 -4.425 17.549 1.00 20.04 C ATOM 1859 CD1 PHE B 15 23.606 -3.198 17.032 1.00 18.82 C ATOM 1860 CD2 PHE B 15 24.026 -5.529 17.415 1.00 20.19 C ATOM 1861 CE1 PHE B 15 24.836 -3.071 16.387 1.00 17.68 C ATOM 1862 CE2 PHE B 15 25.253 -5.409 16.773 1.00 18.22 C ATOM 1863 CZ PHE B 15 25.656 -4.174 16.259 1.00 17.06 C ATOM 1864 HA PHE B 15 22.341 -3.213 19.825 1.00 0.00 H ATOM 1865 HB2 PHE B 15 21.518 -5.582 18.125 1.00 0.00 H ATOM 1866 HB3 PHE B 15 21.154 -3.887 17.727 1.00 0.00 H ATOM 1867 HD2 PHE B 15 23.717 -6.494 17.816 1.00 0.00 H ATOM 1868 HE2 PHE B 15 25.901 -6.279 16.670 1.00 0.00 H ATOM 1869 HZ PHE B 15 26.619 -4.081 15.756 1.00 0.00 H ATOM 1870 HE1 PHE B 15 25.148 -2.106 15.986 1.00 0.00 H ATOM 1871 HD1 PHE B 15 22.961 -2.325 17.134 1.00 0.00 H ATOM 1872 H PHE B 15 22.439 -6.199 20.295 1.00 0.00 H ATOM 1873 N PRO B 16 19.852 -2.975 20.355 1.00 20.26 N ATOM 1874 CA PRO B 16 18.493 -2.758 20.885 1.00 20.97 C ATOM 1875 C PRO B 16 17.384 -3.533 20.157 1.00 22.94 C ATOM 1876 O PRO B 16 17.314 -3.514 18.921 1.00 23.15 O ATOM 1877 CB PRO B 16 18.285 -1.246 20.686 1.00 18.41 C ATOM 1878 CG PRO B 16 19.673 -0.690 20.585 1.00 16.70 C ATOM 1879 CD PRO B 16 20.389 -1.728 19.783 1.00 17.82 C ATOM 1880 HA PRO B 16 18.424 -3.112 21.914 1.00 0.00 H ATOM 1881 HD3 PRO B 16 20.152 -1.643 18.722 1.00 0.00 H ATOM 1882 HD2 PRO B 16 21.468 -1.661 19.920 1.00 0.00 H ATOM 1883 HG3 PRO B 16 20.123 -0.576 21.571 1.00 0.00 H ATOM 1884 HG2 PRO B 16 19.674 0.272 20.073 1.00 0.00 H ATOM 1885 HB2 PRO B 16 17.723 -1.050 19.773 1.00 0.00 H ATOM 1886 HB3 PRO B 16 17.757 -0.814 21.536 1.00 0.00 H ATOM 1887 N LYS B 17 16.531 -4.223 20.914 1.00 25.22 N ATOM 1888 CA LYS B 17 15.406 -4.957 20.318 1.00 26.97 C ATOM 1889 C LYS B 17 14.156 -4.107 20.545 1.00 26.68 C ATOM 1890 O LYS B 17 14.061 -3.394 21.558 1.00 23.57 O ATOM 1891 CB LYS B 17 15.201 -6.332 20.982 1.00 30.43 C ATOM 1892 CG LYS B 17 16.318 -7.366 20.785 1.00 36.92 C ATOM 1893 CD LYS B 17 17.505 -7.113 21.723 1.00 43.31 C ATOM 1894 CE LYS B 17 18.650 -8.116 21.546 1.00 46.20 C ATOM 1895 NZ LYS B 17 19.873 -7.670 22.303 1.00 46.68 N ATOM 1896 HA LYS B 17 15.605 -5.132 19.261 1.00 0.00 H ATOM 1897 HB2 LYS B 17 15.088 -6.168 22.054 1.00 0.00 H ATOM 1898 HB3 LYS B 17 14.281 -6.759 20.582 1.00 0.00 H ATOM 1899 HG2 LYS B 17 15.917 -8.360 20.984 1.00 0.00 H ATOM 1900 HG3 LYS B 17 16.667 -7.316 19.754 1.00 0.00 H ATOM 1901 HD2 LYS B 17 17.890 -6.112 21.530 1.00 0.00 H ATOM 1902 HD3 LYS B 17 17.150 -7.172 22.752 1.00 0.00 H ATOM 1903 HE2 LYS B 17 18.894 -8.197 20.487 1.00 0.00 H ATOM 1904 HE3 LYS B 17 18.333 -9.090 21.920 1.00 0.00 H ATOM 1905 HZ1 LYS B 17 20.181 -6.743 21.947 1.00 0.00 H ATOM 1906 HZ2 LYS B 17 19.645 -7.596 23.315 1.00 0.00 H ATOM 1907 HZ3 LYS B 17 20.635 -8.365 22.168 1.00 0.00 H ATOM 1908 H LYS B 17 16.664 -4.242 21.945 1.00 0.00 H ATOM 1909 N ARG B 18 13.215 -4.151 19.603 1.00 27.78 N ATOM 1910 CA ARG B 18 11.968 -3.396 19.740 1.00 28.02 C ATOM 1911 C ARG B 18 11.370 -3.896 21.029 1.00 26.31 C ATOM 1912 O ARG B 18 11.373 -5.102 21.291 1.00 24.41 O ATOM 1913 CB ARG B 18 11.011 -3.683 18.584 1.00 33.24 C ATOM 1914 CG ARG B 18 11.436 -3.086 17.251 1.00 40.73 C ATOM 1915 CD ARG B 18 10.362 -3.312 16.199 1.00 47.74 C ATOM 1916 NE ARG B 18 10.674 -2.675 14.916 1.00 54.78 N ATOM 1917 CZ ARG B 18 11.349 -3.260 13.926 1.00 57.75 C ATOM 1918 NH1 ARG B 18 11.803 -4.503 14.060 1.00 59.26 N ATOM 1919 NH2 ARG B 18 11.527 -2.618 12.776 1.00 58.40 N ATOM 1920 HA ARG B 18 12.146 -2.321 19.734 1.00 0.00 H ATOM 1921 HB2 ARG B 18 10.935 -4.764 18.465 1.00 0.00 H ATOM 1922 HB3 ARG B 18 10.033 -3.278 18.843 1.00 0.00 H ATOM 1923 HG2 ARG B 18 11.599 -2.015 17.373 1.00 0.00 H ATOM 1924 HG3 ARG B 18 12.363 -3.559 16.925 1.00 0.00 H ATOM 1925 HD2 ARG B 18 9.421 -2.905 16.570 1.00 0.00 H ATOM 1926 HD3 ARG B 18 10.254 -4.385 16.037 1.00 0.00 H ATOM 1927 HE ARG B 18 10.346 -1.699 14.768 1.00 0.00 H ATOM 1928 HH12 ARG B 18 12.329 -4.951 13.283 1.00 0.00 H ATOM 1929 HH11 ARG B 18 11.632 -5.027 14.942 1.00 0.00 H ATOM 1930 HH22 ARG B 18 12.053 -3.073 12.003 1.00 0.00 H ATOM 1931 HH21 ARG B 18 11.140 -1.661 12.649 1.00 0.00 H ATOM 1932 H ARG B 18 13.369 -4.732 18.755 1.00 0.00 H ATOM 1933 N GLY B 19 10.959 -2.963 21.876 1.00 26.81 N ATOM 1934 CA GLY B 19 10.389 -3.332 23.159 1.00 25.31 C ATOM 1935 C GLY B 19 11.354 -3.142 24.314 1.00 24.20 C ATOM 1936 O GLY B 19 10.956 -3.254 25.467 1.00 25.95 O ATOM 1937 HA3 GLY B 19 10.096 -4.381 23.120 1.00 0.00 H ATOM 1938 HA2 GLY B 19 9.508 -2.716 23.338 1.00 0.00 H ATOM 1939 H GLY B 19 11.046 -1.959 21.619 1.00 0.00 H ATOM 1940 N GLN B 20 12.619 -2.868 24.014 1.00 23.03 N ATOM 1941 CA GLN B 20 13.619 -2.656 25.056 1.00 23.21 C ATOM 1942 C GLN B 20 13.833 -1.169 25.249 1.00 21.13 C ATOM 1943 O GLN B 20 13.674 -0.378 24.310 1.00 19.20 O ATOM 1944 CB GLN B 20 14.969 -3.266 24.674 1.00 25.55 C ATOM 1945 CG GLN B 20 15.194 -4.695 25.092 1.00 28.85 C ATOM 1946 CD GLN B 20 16.607 -5.138 24.766 1.00 28.99 C ATOM 1947 OE1 GLN B 20 17.079 -4.942 23.648 1.00 28.98 O ATOM 1948 NE2 GLN B 20 17.306 -5.681 25.750 1.00 29.36 N ATOM 1949 HA GLN B 20 13.251 -3.132 25.965 1.00 0.00 H ATOM 1950 HB2 GLN B 20 15.061 -3.218 23.589 1.00 0.00 H ATOM 1951 HB3 GLN B 20 15.750 -2.658 25.131 1.00 0.00 H ATOM 1952 HG2 GLN B 20 15.031 -4.783 26.166 1.00 0.00 H ATOM 1953 HG3 GLN B 20 14.488 -5.337 24.565 1.00 0.00 H ATOM 1954 HE22 GLN B 20 16.866 -5.828 26.681 1.00 0.00 H ATOM 1955 HE21 GLN B 20 18.295 -5.960 25.593 1.00 0.00 H ATOM 1956 H GLN B 20 12.903 -2.803 23.016 1.00 0.00 H ATOM 1957 N THR B 21 14.239 -0.803 26.457 1.00 21.69 N ATOM 1958 CA THR B 21 14.506 0.588 26.797 1.00 21.22 C ATOM 1959 C THR B 21 15.969 0.882 26.543 1.00 18.33 C ATOM 1960 O THR B 21 16.844 0.135 26.976 1.00 19.19 O ATOM 1961 CB THR B 21 14.209 0.869 28.277 1.00 21.93 C ATOM 1962 OG1 THR B 21 12.833 0.579 28.540 1.00 25.46 O ATOM 1963 CG2 THR B 21 14.501 2.331 28.617 1.00 20.87 C ATOM 1964 HA THR B 21 13.863 1.218 26.183 1.00 0.00 H ATOM 1965 HB THR B 21 14.848 0.238 28.894 1.00 0.00 H ATOM 1966 HG1 THR B 21 12.636 0.758 29.493 1.00 0.00 H ATOM 1967 HG23 THR B 21 15.550 2.547 28.415 1.00 0.00 H ATOM 1968 HG21 THR B 21 13.871 2.978 28.006 1.00 0.00 H ATOM 1969 HG22 THR B 21 14.289 2.507 29.672 1.00 0.00 H ATOM 1970 H THR B 21 14.371 -1.533 27.186 1.00 0.00 H ATOM 1971 N CYS B 22 16.221 1.940 25.787 1.00 17.21 N ATOM 1972 CA CYS B 22 17.570 2.361 25.473 1.00 15.04 C ATOM 1973 C CYS B 22 17.916 3.512 26.398 1.00 15.12 C ATOM 1974 O CYS B 22 17.149 4.473 26.525 1.00 16.19 O ATOM 1975 CB CYS B 22 17.660 2.841 24.026 1.00 13.57 C ATOM 1976 SG CYS B 22 17.257 1.603 22.797 1.00 17.30 S ATOM 1977 HA CYS B 22 18.258 1.526 25.602 1.00 0.00 H ATOM 1978 HB2 CYS B 22 18.680 3.180 23.844 1.00 0.00 H ATOM 1979 HB3 CYS B 22 16.972 3.678 23.903 1.00 0.00 H ATOM 1980 HG CYS B 22 17.374 2.153 21.537 1.00 0.00 H ATOM 1981 H CYS B 22 15.423 2.487 25.406 1.00 0.00 H ATOM 1982 N VAL B 23 19.065 3.415 27.051 1.00 12.91 N ATOM 1983 CA VAL B 23 19.510 4.464 27.949 1.00 11.55 C ATOM 1984 C VAL B 23 20.664 5.155 27.248 1.00 11.56 C ATOM 1985 O VAL B 23 21.638 4.504 26.881 1.00 10.56 O ATOM 1986 CB VAL B 23 19.907 3.881 29.301 1.00 12.16 C ATOM 1987 CG1 VAL B 23 20.231 5.002 30.271 1.00 12.32 C ATOM 1988 CG2 VAL B 23 18.754 3.028 29.850 1.00 10.40 C ATOM 1989 HA VAL B 23 18.720 5.183 28.164 1.00 0.00 H ATOM 1990 HB VAL B 23 20.791 3.254 29.179 1.00 0.00 H ATOM 1991 HG11 VAL B 23 21.057 5.594 29.877 1.00 0.00 H ATOM 1992 HG12 VAL B 23 19.354 5.637 30.396 1.00 0.00 H ATOM 1993 HG13 VAL B 23 20.514 4.577 31.234 1.00 0.00 H ATOM 1994 HG21 VAL B 23 17.867 3.651 29.969 1.00 0.00 H ATOM 1995 HG22 VAL B 23 18.540 2.218 29.153 1.00 0.00 H ATOM 1996 HG23 VAL B 23 19.039 2.612 30.816 1.00 0.00 H ATOM 1997 H VAL B 23 19.659 2.572 26.917 1.00 0.00 H ATOM 1998 N VAL B 24 20.501 6.449 26.956 1.00 11.31 N ATOM 1999 CA VAL B 24 21.516 7.205 26.229 1.00 11.32 C ATOM 2000 C VAL B 24 21.768 8.626 26.718 1.00 11.46 C ATOM 2001 O VAL B 24 20.942 9.225 27.410 1.00 13.34 O ATOM 2002 CB VAL B 24 21.117 7.354 24.717 1.00 12.54 C ATOM 2003 CG1 VAL B 24 20.680 6.028 24.124 1.00 11.19 C ATOM 2004 CG2 VAL B 24 20.012 8.371 24.556 1.00 11.69 C ATOM 2005 HA VAL B 24 22.419 6.618 26.394 1.00 0.00 H ATOM 2006 HB VAL B 24 22.002 7.696 24.180 1.00 0.00 H ATOM 2007 HG11 VAL B 24 21.498 5.312 24.196 1.00 0.00 H ATOM 2008 HG12 VAL B 24 19.817 5.652 24.674 1.00 0.00 H ATOM 2009 HG13 VAL B 24 20.412 6.170 23.077 1.00 0.00 H ATOM 2010 HG21 VAL B 24 19.138 8.049 25.122 1.00 0.00 H ATOM 2011 HG22 VAL B 24 20.352 9.337 24.929 1.00 0.00 H ATOM 2012 HG23 VAL B 24 19.751 8.458 23.501 1.00 0.00 H ATOM 2013 H VAL B 24 19.628 6.930 27.255 1.00 0.00 H ATOM 2014 N HIS B 25 22.935 9.161 26.375 1.00 7.75 N ATOM 2015 CA HIS B 25 23.244 10.554 26.660 1.00 7.93 C ATOM 2016 C HIS B 25 23.390 11.119 25.261 1.00 8.53 C ATOM 2017 O HIS B 25 23.908 10.446 24.368 1.00 9.93 O ATOM 2018 CB HIS B 25 24.525 10.722 27.479 1.00 9.79 C ATOM 2019 CG HIS B 25 24.265 10.995 28.926 1.00 10.37 C ATOM 2020 ND1 HIS B 25 23.441 12.015 29.349 1.00 12.39 N ATOM 2021 CD2 HIS B 25 24.671 10.354 30.047 1.00 15.58 C ATOM 2022 CE1 HIS B 25 23.344 11.989 30.665 1.00 14.16 C ATOM 2023 NE2 HIS B 25 24.081 10.990 31.114 1.00 17.39 N ATOM 2024 HA HIS B 25 22.490 11.051 27.270 1.00 0.00 H ATOM 2025 HB2 HIS B 25 25.111 9.807 27.398 1.00 0.00 H ATOM 2026 HB3 HIS B 25 25.095 11.554 27.066 1.00 0.00 H ATOM 2027 HD2 HIS B 25 25.340 9.495 30.095 1.00 0.00 H ATOM 2028 HE1 HIS B 25 22.757 12.674 31.276 1.00 0.00 H ATOM 2029 H HIS B 25 23.643 8.571 25.892 1.00 0.00 H ATOM 2030 N TYR B 26 22.866 12.314 25.036 1.00 8.37 N ATOM 2031 CA TYR B 26 22.921 12.903 23.706 1.00 6.46 C ATOM 2032 C TYR B 26 23.064 14.389 23.778 1.00 6.32 C ATOM 2033 O TYR B 26 22.744 15.005 24.800 1.00 7.27 O ATOM 2034 CB TYR B 26 21.610 12.614 22.927 1.00 8.26 C ATOM 2035 CG TYR B 26 20.377 13.388 23.442 1.00 9.46 C ATOM 2036 CD1 TYR B 26 20.132 14.716 23.048 1.00 8.98 C ATOM 2037 CD2 TYR B 26 19.526 12.829 24.403 1.00 9.37 C ATOM 2038 CE1 TYR B 26 19.080 15.460 23.619 1.00 11.20 C ATOM 2039 CE2 TYR B 26 18.477 13.563 24.966 1.00 9.82 C ATOM 2040 CZ TYR B 26 18.264 14.869 24.575 1.00 10.58 C ATOM 2041 OH TYR B 26 17.229 15.580 25.138 1.00 11.32 O ATOM 2042 HA TYR B 26 23.781 12.462 23.203 1.00 0.00 H ATOM 2043 HB3 TYR B 26 21.398 11.547 23.000 1.00 0.00 H ATOM 2044 HB2 TYR B 26 21.768 12.881 21.882 1.00 0.00 H ATOM 2045 HD2 TYR B 26 19.685 11.798 24.720 1.00 0.00 H ATOM 2046 HE2 TYR B 26 17.829 13.104 25.712 1.00 0.00 H ATOM 2047 HE1 TYR B 26 18.908 16.492 23.313 1.00 0.00 H ATOM 2048 HD1 TYR B 26 20.765 15.177 22.290 1.00 0.00 H ATOM 2049 HH TYR B 26 17.210 16.493 24.755 1.00 0.00 H ATOM 2050 H TYR B 26 22.413 12.835 25.814 1.00 0.00 H ATOM 2051 N THR B 27 23.595 14.942 22.699 1.00 6.44 N ATOM 2052 CA THR B 27 23.661 16.371 22.495 1.00 8.07 C ATOM 2053 C THR B 27 23.064 16.571 21.089 1.00 9.23 C ATOM 2054 O THR B 27 23.482 15.928 20.118 1.00 7.52 O ATOM 2055 CB THR B 27 25.073 16.937 22.567 1.00 8.96 C ATOM 2056 OG1 THR B 27 25.565 16.773 23.903 1.00 10.26 O ATOM 2057 CG2 THR B 27 25.051 18.440 22.232 1.00 7.12 C ATOM 2058 HA THR B 27 23.124 16.901 23.282 1.00 0.00 H ATOM 2059 HB THR B 27 25.711 16.414 21.855 1.00 0.00 H ATOM 2060 HG1 THR B 27 24.975 17.258 24.533 1.00 0.00 H ATOM 2061 HG23 THR B 27 24.678 18.579 21.217 1.00 0.00 H ATOM 2062 HG21 THR B 27 24.398 18.958 22.935 1.00 0.00 H ATOM 2063 HG22 THR B 27 26.061 18.843 22.308 1.00 0.00 H ATOM 2064 H THR B 27 23.983 14.318 21.963 1.00 0.00 H ATOM 2065 N GLY B 28 22.027 17.389 20.993 1.00 9.16 N ATOM 2066 CA GLY B 28 21.416 17.624 19.702 1.00 10.75 C ATOM 2067 C GLY B 28 21.814 19.003 19.232 1.00 12.72 C ATOM 2068 O GLY B 28 21.904 19.941 20.030 1.00 10.66 O ATOM 2069 HA3 GLY B 28 20.331 17.564 19.791 1.00 0.00 H ATOM 2070 HA2 GLY B 28 21.763 16.877 18.988 1.00 0.00 H ATOM 2071 H GLY B 28 21.653 17.860 21.841 1.00 0.00 H ATOM 2072 N MET B 29 22.099 19.132 17.947 1.00 12.42 N ATOM 2073 CA MET B 29 22.478 20.421 17.416 1.00 13.93 C ATOM 2074 C MET B 29 22.033 20.622 15.976 1.00 15.60 C ATOM 2075 O MET B 29 21.633 19.673 15.285 1.00 11.93 O ATOM 2076 CB MET B 29 23.983 20.660 17.598 1.00 17.94 C ATOM 2077 CG MET B 29 24.901 19.623 17.003 1.00 23.07 C ATOM 2078 SD MET B 29 26.428 19.381 17.990 1.00 21.17 S ATOM 2079 CE MET B 29 26.494 17.606 18.030 1.00 15.06 C ATOM 2080 HA MET B 29 21.945 21.177 17.993 1.00 0.00 H ATOM 2081 HB2 MET B 29 24.225 21.619 17.141 1.00 0.00 H ATOM 2082 HB3 MET B 29 24.185 20.708 18.668 1.00 0.00 H ATOM 2083 HG2 MET B 29 25.181 19.940 15.998 1.00 0.00 H ATOM 2084 HG3 MET B 29 24.367 18.674 16.948 1.00 0.00 H ATOM 2085 HE1 MET B 29 25.593 17.221 18.507 1.00 0.00 H ATOM 2086 HE2 MET B 29 26.560 17.223 17.012 1.00 0.00 H ATOM 2087 HE3 MET B 29 27.370 17.289 18.596 1.00 0.00 H ATOM 2088 H MET B 29 22.050 18.305 17.318 1.00 0.00 H ATOM 2089 N LEU B 30 21.965 21.886 15.577 1.00 15.16 N ATOM 2090 CA LEU B 30 21.575 22.208 14.222 1.00 17.59 C ATOM 2091 C LEU B 30 22.766 21.915 13.325 1.00 16.70 C ATOM 2092 O LEU B 30 23.870 21.681 13.796 1.00 12.09 O ATOM 2093 CB LEU B 30 21.142 23.674 14.098 1.00 19.97 C ATOM 2094 CG LEU B 30 19.740 24.114 14.564 1.00 24.28 C ATOM 2095 CD1 LEU B 30 18.761 22.965 14.510 1.00 22.61 C ATOM 2096 CD2 LEU B 30 19.788 24.655 15.957 1.00 29.12 C ATOM 2097 HA LEU B 30 20.716 21.606 13.926 1.00 0.00 H ATOM 2098 HB2 LEU B 30 21.861 24.262 14.668 1.00 0.00 H ATOM 2099 HB3 LEU B 30 21.217 23.935 13.042 1.00 0.00 H ATOM 2100 HG LEU B 30 19.404 24.897 13.884 1.00 0.00 H ATOM 2101 HD21 LEU B 30 20.157 23.883 16.633 1.00 0.00 H ATOM 2102 HD22 LEU B 30 20.455 25.516 15.988 1.00 0.00 H ATOM 2103 HD23 LEU B 30 18.787 24.958 16.262 1.00 0.00 H ATOM 2104 HD11 LEU B 30 18.689 22.599 13.486 1.00 0.00 H ATOM 2105 HD12 LEU B 30 19.108 22.162 15.161 1.00 0.00 H ATOM 2106 HD13 LEU B 30 17.782 23.308 14.845 1.00 0.00 H ATOM 2107 H LEU B 30 22.194 22.651 16.244 1.00 0.00 H ATOM 2108 N GLU B 31 22.532 21.949 12.027 1.00 18.81 N ATOM 2109 CA GLU B 31 23.558 21.684 11.043 1.00 22.75 C ATOM 2110 C GLU B 31 24.744 22.633 11.161 1.00 24.86 C ATOM 2111 O GLU B 31 25.862 22.258 10.831 1.00 27.04 O ATOM 2112 CB GLU B 31 22.939 21.759 9.652 1.00 25.98 C ATOM 2113 CG GLU B 31 23.777 21.158 8.551 1.00 31.23 C ATOM 2114 CD GLU B 31 23.005 21.018 7.250 1.00 32.74 C ATOM 2115 OE1 GLU B 31 22.190 21.914 6.915 1.00 31.72 O ATOM 2116 OE2 GLU B 31 23.209 19.991 6.576 1.00 32.79 O ATOM 2117 HA GLU B 31 23.952 20.684 11.224 1.00 0.00 H ATOM 2118 HB2 GLU B 31 21.985 21.233 9.677 1.00 0.00 H ATOM 2119 HB3 GLU B 31 22.768 22.809 9.413 1.00 0.00 H ATOM 2120 HG2 GLU B 31 24.642 21.799 8.379 1.00 0.00 H ATOM 2121 HG3 GLU B 31 24.115 20.171 8.866 1.00 0.00 H ATOM 2122 H GLU B 31 21.572 22.175 11.698 1.00 0.00 H ATOM 2123 N ASP B 32 24.524 23.849 11.657 1.00 25.38 N ATOM 2124 CA ASP B 32 25.632 24.794 11.802 1.00 26.65 C ATOM 2125 C ASP B 32 26.382 24.646 13.122 1.00 27.83 C ATOM 2126 O ASP B 32 27.176 25.503 13.491 1.00 28.47 O ATOM 2127 CB ASP B 32 25.180 26.247 11.589 1.00 30.28 C ATOM 2128 CG ASP B 32 24.181 26.728 12.635 1.00 34.74 C ATOM 2129 OD1 ASP B 32 23.732 25.929 13.486 1.00 36.25 O ATOM 2130 OD2 ASP B 32 23.839 27.930 12.600 1.00 36.48 O ATOM 2131 HA ASP B 32 26.337 24.538 11.011 1.00 0.00 H ATOM 2132 HB2 ASP B 32 26.058 26.892 11.627 1.00 0.00 H ATOM 2133 HB3 ASP B 32 24.716 26.325 10.606 1.00 0.00 H ATOM 2134 H ASP B 32 23.563 24.128 11.942 1.00 0.00 H ATOM 2135 N GLY B 33 26.073 23.583 13.857 1.00 25.20 N ATOM 2136 CA GLY B 33 26.749 23.325 15.113 1.00 22.43 C ATOM 2137 C GLY B 33 26.173 23.911 16.383 1.00 22.01 C ATOM 2138 O GLY B 33 26.684 23.605 17.459 1.00 21.60 O ATOM 2139 HA3 GLY B 33 27.765 23.708 15.015 1.00 0.00 H ATOM 2140 HA2 GLY B 33 26.780 22.243 15.244 1.00 0.00 H ATOM 2141 H GLY B 33 25.336 22.927 13.527 1.00 0.00 H ATOM 2142 N LYS B 34 25.131 24.732 16.311 1.00 20.69 N ATOM 2143 CA LYS B 34 24.610 25.284 17.558 1.00 20.98 C ATOM 2144 C LYS B 34 23.817 24.255 18.339 1.00 16.75 C ATOM 2145 O LYS B 34 23.034 23.499 17.770 1.00 11.48 O ATOM 2146 CB LYS B 34 23.812 26.582 17.359 1.00 26.36 C ATOM 2147 CG LYS B 34 22.407 26.438 16.842 1.00 33.22 C ATOM 2148 CD LYS B 34 21.614 27.723 17.079 1.00 38.49 C ATOM 2149 CE LYS B 34 21.363 27.985 18.571 1.00 41.12 C ATOM 2150 NZ LYS B 34 20.183 27.243 19.120 1.00 42.45 N ATOM 2151 HA LYS B 34 25.482 25.554 18.154 1.00 0.00 H ATOM 2152 HB2 LYS B 34 23.759 27.089 18.323 1.00 0.00 H ATOM 2153 HB3 LYS B 34 24.362 27.203 16.653 1.00 0.00 H ATOM 2154 HG2 LYS B 34 22.438 26.227 15.773 1.00 0.00 H ATOM 2155 HG3 LYS B 34 21.917 25.613 17.360 1.00 0.00 H ATOM 2156 HD2 LYS B 34 22.173 28.562 16.664 1.00 0.00 H ATOM 2157 HD3 LYS B 34 20.653 27.641 16.570 1.00 0.00 H ATOM 2158 HE2 LYS B 34 21.194 29.053 18.710 1.00 0.00 H ATOM 2159 HE3 LYS B 34 22.250 27.683 19.128 1.00 0.00 H ATOM 2160 HZ1 LYS B 34 19.326 27.528 18.605 1.00 0.00 H ATOM 2161 HZ2 LYS B 34 20.334 26.220 19.005 1.00 0.00 H ATOM 2162 HZ3 LYS B 34 20.073 27.467 20.130 1.00 0.00 H ATOM 2163 H LYS B 34 24.700 24.974 15.396 1.00 0.00 H ATOM 2164 N LYS B 35 24.083 24.187 19.638 1.00 16.14 N ATOM 2165 CA LYS B 35 23.415 23.235 20.508 1.00 18.28 C ATOM 2166 C LYS B 35 21.975 23.621 20.803 1.00 17.97 C ATOM 2167 O LYS B 35 21.690 24.777 21.103 1.00 20.46 O ATOM 2168 CB LYS B 35 24.176 23.097 21.830 1.00 19.19 C ATOM 2169 CG LYS B 35 23.467 22.194 22.835 1.00 23.14 C ATOM 2170 CD LYS B 35 24.278 21.988 24.106 1.00 25.60 C ATOM 2171 CE LYS B 35 24.308 23.237 24.945 1.00 26.13 C ATOM 2172 NZ LYS B 35 25.150 23.023 26.141 1.00 30.03 N ATOM 2173 HA LYS B 35 23.404 22.284 19.976 1.00 0.00 H ATOM 2174 HB2 LYS B 35 25.161 22.679 21.622 1.00 0.00 H ATOM 2175 HB3 LYS B 35 24.288 24.087 22.271 1.00 0.00 H ATOM 2176 HG2 LYS B 35 22.511 22.647 23.099 1.00 0.00 H ATOM 2177 HG3 LYS B 35 23.292 21.224 22.371 1.00 0.00 H ATOM 2178 HD2 LYS B 35 23.830 21.181 24.686 1.00 0.00 H ATOM 2179 HD3 LYS B 35 25.299 21.717 23.836 1.00 0.00 H ATOM 2180 HE2 LYS B 35 23.294 23.487 25.257 1.00 0.00 H ATOM 2181 HE3 LYS B 35 24.718 24.058 24.357 1.00 0.00 H ATOM 2182 HZ1 LYS B 35 24.758 22.241 26.704 1.00 0.00 H ATOM 2183 HZ2 LYS B 35 26.118 22.786 25.844 1.00 0.00 H ATOM 2184 HZ3 LYS B 35 25.164 23.891 26.713 1.00 0.00 H ATOM 2185 H LYS B 35 24.789 24.833 20.044 1.00 0.00 H ATOM 2186 N VAL B 36 21.054 22.675 20.663 1.00 16.87 N ATOM 2187 CA VAL B 36 19.670 22.975 20.990 1.00 15.48 C ATOM 2188 C VAL B 36 19.319 22.346 22.338 1.00 15.69 C ATOM 2189 O VAL B 36 18.607 22.955 23.140 1.00 15.80 O ATOM 2190 CB VAL B 36 18.646 22.620 19.851 1.00 14.87 C ATOM 2191 CG1 VAL B 36 19.334 22.372 18.544 1.00 16.28 C ATOM 2192 CG2 VAL B 36 17.729 21.499 20.232 1.00 16.22 C ATOM 2193 HA VAL B 36 19.579 24.058 21.077 1.00 0.00 H ATOM 2194 HB VAL B 36 18.012 23.496 19.716 1.00 0.00 H ATOM 2195 HG11 VAL B 36 19.881 23.267 18.247 1.00 0.00 H ATOM 2196 HG12 VAL B 36 20.029 21.539 18.653 1.00 0.00 H ATOM 2197 HG13 VAL B 36 18.591 22.130 17.784 1.00 0.00 H ATOM 2198 HG21 VAL B 36 18.317 20.606 20.445 1.00 0.00 H ATOM 2199 HG22 VAL B 36 17.161 21.781 21.118 1.00 0.00 H ATOM 2200 HG23 VAL B 36 17.044 21.296 19.409 1.00 0.00 H ATOM 2201 H VAL B 36 21.320 21.729 20.323 1.00 0.00 H ATOM 2202 N ASP B 37 19.865 21.161 22.620 1.00 13.59 N ATOM 2203 CA ASP B 37 19.585 20.491 23.884 1.00 11.63 C ATOM 2204 C ASP B 37 20.530 19.323 24.135 1.00 13.28 C ATOM 2205 O ASP B 37 20.935 18.636 23.193 1.00 11.35 O ATOM 2206 CB ASP B 37 18.136 19.983 23.927 1.00 14.05 C ATOM 2207 CG ASP B 37 17.760 19.420 25.290 1.00 13.54 C ATOM 2208 OD1 ASP B 37 17.765 20.196 26.261 1.00 14.05 O ATOM 2209 OD2 ASP B 37 17.490 18.206 25.407 1.00 15.20 O ATOM 2210 HA ASP B 37 19.737 21.233 24.668 1.00 0.00 H ATOM 2211 HB2 ASP B 37 17.467 20.811 23.693 1.00 0.00 H ATOM 2212 HB3 ASP B 37 18.017 19.199 23.179 1.00 0.00 H ATOM 2213 H ASP B 37 20.498 20.710 21.929 1.00 0.00 H ATOM 2214 N SER B 38 20.840 19.073 25.404 1.00 9.98 N ATOM 2215 CA SER B 38 21.729 17.971 25.765 1.00 11.09 C ATOM 2216 C SER B 38 21.344 17.346 27.098 1.00 9.53 C ATOM 2217 O SER B 38 21.071 18.061 28.069 1.00 11.03 O ATOM 2218 CB SER B 38 23.183 18.467 25.832 1.00 10.33 C ATOM 2219 OG SER B 38 24.048 17.456 26.340 1.00 9.31 O ATOM 2220 HA SER B 38 21.632 17.207 24.994 1.00 0.00 H ATOM 2221 HB2 SER B 38 23.232 19.339 26.485 1.00 0.00 H ATOM 2222 HB3 SER B 38 23.511 18.746 24.830 1.00 0.00 H ATOM 2223 HG SER B 38 24.011 16.663 25.748 1.00 0.00 H ATOM 2224 H SER B 38 20.442 19.674 26.154 1.00 0.00 H ATOM 2225 N SER B 39 21.296 16.016 27.146 1.00 8.14 N ATOM 2226 CA SER B 39 20.987 15.327 28.395 1.00 8.72 C ATOM 2227 C SER B 39 22.186 15.425 29.331 1.00 11.51 C ATOM 2228 O SER B 39 22.036 15.265 30.532 1.00 9.51 O ATOM 2229 CB SER B 39 20.659 13.853 28.156 1.00 9.67 C ATOM 2230 OG SER B 39 21.679 13.219 27.404 1.00 10.57 O ATOM 2231 HA SER B 39 20.113 15.804 28.839 1.00 0.00 H ATOM 2232 HB2 SER B 39 19.718 13.781 27.611 1.00 0.00 H ATOM 2233 HB3 SER B 39 20.560 13.350 29.118 1.00 0.00 H ATOM 2234 HG SER B 39 22.536 13.278 27.897 1.00 0.00 H ATOM 2235 H SER B 39 21.481 15.463 26.285 1.00 0.00 H ATOM 2236 N ARG B 40 23.371 15.698 28.777 1.00 11.10 N ATOM 2237 CA ARG B 40 24.583 15.820 29.590 1.00 16.49 C ATOM 2238 C ARG B 40 24.497 17.055 30.474 1.00 18.07 C ATOM 2239 O ARG B 40 25.256 17.211 31.426 1.00 18.91 O ATOM 2240 CB ARG B 40 25.846 15.827 28.720 1.00 14.68 C ATOM 2241 CG ARG B 40 26.179 14.449 28.145 1.00 20.37 C ATOM 2242 CD ARG B 40 27.284 14.489 27.075 1.00 27.29 C ATOM 2243 NE ARG B 40 27.328 13.258 26.270 1.00 32.24 N ATOM 2244 CZ ARG B 40 27.183 13.209 24.940 1.00 35.06 C ATOM 2245 NH1 ARG B 40 27.007 14.327 24.237 1.00 29.55 N ATOM 2246 NH2 ARG B 40 27.230 12.037 24.303 1.00 31.80 N ATOM 2247 HA ARG B 40 24.655 14.945 30.236 1.00 0.00 H ATOM 2248 HB2 ARG B 40 25.696 16.522 27.894 1.00 0.00 H ATOM 2249 HB3 ARG B 40 26.686 16.163 29.328 1.00 0.00 H ATOM 2250 HG2 ARG B 40 26.508 13.804 28.960 1.00 0.00 H ATOM 2251 HG3 ARG B 40 25.277 14.033 27.696 1.00 0.00 H ATOM 2252 HD2 ARG B 40 28.247 14.619 27.570 1.00 0.00 H ATOM 2253 HD3 ARG B 40 27.100 15.335 26.413 1.00 0.00 H ATOM 2254 HE ARG B 40 27.483 12.360 26.771 1.00 0.00 H ATOM 2255 HH12 ARG B 40 26.895 14.280 23.204 1.00 0.00 H ATOM 2256 HH11 ARG B 40 26.981 15.247 24.721 1.00 0.00 H ATOM 2257 HH22 ARG B 40 27.117 12.002 23.270 1.00 0.00 H ATOM 2258 HH21 ARG B 40 27.380 11.159 24.840 1.00 0.00 H ATOM 2259 H ARG B 40 23.434 15.827 27.747 1.00 0.00 H ATOM 2260 N ASP B 41 23.541 17.920 30.168 1.00 17.58 N ATOM 2261 CA ASP B 41 23.318 19.115 30.962 1.00 20.30 C ATOM 2262 C ASP B 41 22.250 18.865 32.034 1.00 21.30 C ATOM 2263 O ASP B 41 21.996 19.756 32.840 1.00 24.71 O ATOM 2264 CB ASP B 41 22.802 20.252 30.069 1.00 19.10 C ATOM 2265 CG ASP B 41 23.849 20.785 29.116 1.00 17.11 C ATOM 2266 OD1 ASP B 41 25.057 20.691 29.413 1.00 18.10 O ATOM 2267 OD2 ASP B 41 23.449 21.332 28.074 1.00 14.39 O ATOM 2268 HA ASP B 41 24.268 19.380 31.426 1.00 0.00 H ATOM 2269 HB2 ASP B 41 21.960 19.879 29.486 1.00 0.00 H ATOM 2270 HB3 ASP B 41 22.467 21.069 30.708 1.00 0.00 H ATOM 2271 H ASP B 41 22.937 17.739 29.341 1.00 0.00 H ATOM 2272 N ARG B 42 21.702 17.651 32.111 1.00 21.58 N ATOM 2273 CA ARG B 42 20.585 17.365 33.025 1.00 23.54 C ATOM 2274 C ARG B 42 20.574 16.405 34.216 1.00 26.89 C ATOM 2275 O ARG B 42 19.486 16.057 34.681 1.00 33.17 O ATOM 2276 CB ARG B 42 19.359 16.971 32.203 1.00 21.28 C ATOM 2277 CG ARG B 42 18.684 18.075 31.440 1.00 17.54 C ATOM 2278 CD ARG B 42 17.279 17.619 31.108 1.00 15.32 C ATOM 2279 NE ARG B 42 17.246 16.430 30.267 1.00 11.24 N ATOM 2280 CZ ARG B 42 17.317 16.464 28.937 1.00 13.68 C ATOM 2281 NH1 ARG B 42 17.431 17.626 28.310 1.00 13.08 N ATOM 2282 NH2 ARG B 42 17.278 15.341 28.228 1.00 9.90 N ATOM 2283 HA ARG B 42 20.655 18.318 33.550 1.00 0.00 H ATOM 2284 HB2 ARG B 42 19.671 16.213 31.484 1.00 0.00 H ATOM 2285 HB3 ARG B 42 18.625 16.542 32.886 1.00 0.00 H ATOM 2286 HG2 ARG B 42 18.646 18.978 32.050 1.00 0.00 H ATOM 2287 HG3 ARG B 42 19.234 18.281 30.522 1.00 0.00 H ATOM 2288 HD2 ARG B 42 16.766 18.427 30.586 1.00 0.00 H ATOM 2289 HD3 ARG B 42 16.756 17.400 32.039 1.00 0.00 H ATOM 2290 HE ARG B 42 17.162 15.503 30.731 1.00 0.00 H ATOM 2291 HH12 ARG B 42 17.486 17.653 27.272 1.00 0.00 H ATOM 2292 HH11 ARG B 42 17.465 18.510 28.856 1.00 0.00 H ATOM 2293 HH22 ARG B 42 17.334 15.379 27.190 1.00 0.00 H ATOM 2294 HH21 ARG B 42 17.191 14.424 28.711 1.00 0.00 H ATOM 2295 H ARG B 42 22.074 16.888 31.510 1.00 0.00 H ATOM 2296 N ASN B 43 21.700 15.902 34.684 1.00 28.43 N ATOM 2297 CA ASN B 43 21.661 14.991 35.851 1.00 27.67 C ATOM 2298 C ASN B 43 21.228 13.544 35.634 1.00 27.00 C ATOM 2299 O ASN B 43 21.299 12.745 36.563 1.00 28.27 O ATOM 2300 CB ASN B 43 20.871 15.584 37.036 1.00 26.12 C ATOM 2301 CG ASN B 43 21.665 16.616 37.805 1.00 27.16 C ATOM 2302 OD1 ASN B 43 22.842 16.830 37.531 1.00 27.35 O ATOM 2303 ND2 ASN B 43 21.031 17.263 38.767 1.00 25.87 N ATOM 2304 HA ASN B 43 22.725 14.920 36.075 1.00 0.00 H ATOM 2305 HB2 ASN B 43 19.966 16.054 36.652 1.00 0.00 H ATOM 2306 HB3 ASN B 43 20.599 14.775 37.714 1.00 0.00 H ATOM 2307 HD22 ASN B 43 20.033 17.050 38.966 1.00 0.00 H ATOM 2308 HD21 ASN B 43 21.530 17.985 39.325 1.00 0.00 H ATOM 2309 H ASN B 43 22.608 16.143 34.237 1.00 0.00 H ATOM 2310 N LYS B 44 20.712 13.204 34.459 1.00 25.68 N ATOM 2311 CA LYS B 44 20.371 11.811 34.202 1.00 21.76 C ATOM 2312 C LYS B 44 20.222 11.545 32.717 1.00 18.35 C ATOM 2313 O LYS B 44 19.970 12.458 31.943 1.00 14.56 O ATOM 2314 CB LYS B 44 19.161 11.338 35.024 1.00 25.06 C ATOM 2315 CG LYS B 44 17.810 11.427 34.380 1.00 27.53 C ATOM 2316 CD LYS B 44 16.792 10.750 35.294 1.00 33.31 C ATOM 2317 CE LYS B 44 15.360 10.896 34.781 1.00 36.33 C ATOM 2318 NZ LYS B 44 14.325 10.314 35.690 1.00 38.35 N ATOM 2319 HA LYS B 44 21.208 11.203 34.547 1.00 0.00 H ATOM 2320 HB2 LYS B 44 19.331 10.293 35.284 1.00 0.00 H ATOM 2321 HB3 LYS B 44 19.130 11.937 35.934 1.00 0.00 H ATOM 2322 HG2 LYS B 44 17.538 12.473 34.238 1.00 0.00 H ATOM 2323 HG3 LYS B 44 17.829 10.923 33.414 1.00 0.00 H ATOM 2324 HD2 LYS B 44 17.033 9.689 35.362 1.00 0.00 H ATOM 2325 HD3 LYS B 44 16.857 11.200 36.285 1.00 0.00 H ATOM 2326 HE2 LYS B 44 15.289 10.395 33.815 1.00 0.00 H ATOM 2327 HE3 LYS B 44 15.148 11.958 34.655 1.00 0.00 H ATOM 2328 HZ1 LYS B 44 14.505 9.297 35.812 1.00 0.00 H ATOM 2329 HZ2 LYS B 44 14.370 10.789 36.614 1.00 0.00 H ATOM 2330 HZ3 LYS B 44 13.382 10.452 35.273 1.00 0.00 H ATOM 2331 H LYS B 44 20.552 13.926 33.728 1.00 0.00 H ATOM 2332 N PRO B 45 20.525 10.312 32.287 1.00 17.68 N ATOM 2333 CA PRO B 45 20.427 9.929 30.877 1.00 15.28 C ATOM 2334 C PRO B 45 18.997 9.871 30.366 1.00 13.71 C ATOM 2335 O PRO B 45 18.044 9.715 31.133 1.00 14.19 O ATOM 2336 CB PRO B 45 21.090 8.558 30.858 1.00 14.02 C ATOM 2337 CG PRO B 45 20.772 8.016 32.216 1.00 16.45 C ATOM 2338 CD PRO B 45 21.033 9.190 33.098 1.00 15.73 C ATOM 2339 HA PRO B 45 20.899 10.657 30.217 1.00 0.00 H ATOM 2340 HD3 PRO B 45 20.490 9.105 34.039 1.00 0.00 H ATOM 2341 HD2 PRO B 45 22.098 9.301 33.303 1.00 0.00 H ATOM 2342 HG3 PRO B 45 21.423 7.179 32.469 1.00 0.00 H ATOM 2343 HG2 PRO B 45 19.732 7.698 32.280 1.00 0.00 H ATOM 2344 HB2 PRO B 45 20.668 7.928 30.075 1.00 0.00 H ATOM 2345 HB3 PRO B 45 22.167 8.644 30.712 1.00 0.00 H ATOM 2346 N PHE B 46 18.864 10.026 29.057 1.00 11.68 N ATOM 2347 CA PHE B 46 17.579 9.995 28.387 1.00 10.67 C ATOM 2348 C PHE B 46 17.207 8.521 28.169 1.00 11.17 C ATOM 2349 O PHE B 46 18.061 7.686 27.909 1.00 12.06 O ATOM 2350 CB PHE B 46 17.704 10.741 27.058 1.00 10.94 C ATOM 2351 CG PHE B 46 16.444 10.762 26.253 1.00 13.87 C ATOM 2352 CD1 PHE B 46 15.423 11.660 26.562 1.00 12.47 C ATOM 2353 CD2 PHE B 46 16.262 9.866 25.205 1.00 10.21 C ATOM 2354 CE1 PHE B 46 14.236 11.663 25.842 1.00 12.33 C ATOM 2355 CE2 PHE B 46 15.077 9.859 24.474 1.00 12.93 C ATOM 2356 CZ PHE B 46 14.058 10.760 24.797 1.00 14.30 C ATOM 2357 HA PHE B 46 16.800 10.479 28.976 1.00 0.00 H ATOM 2358 HB2 PHE B 46 17.994 11.770 27.268 1.00 0.00 H ATOM 2359 HB3 PHE B 46 18.482 10.259 26.466 1.00 0.00 H ATOM 2360 HD2 PHE B 46 17.055 9.162 24.953 1.00 0.00 H ATOM 2361 HE2 PHE B 46 14.944 9.154 23.653 1.00 0.00 H ATOM 2362 HZ PHE B 46 13.126 10.756 24.232 1.00 0.00 H ATOM 2363 HE1 PHE B 46 13.446 12.370 26.094 1.00 0.00 H ATOM 2364 HD1 PHE B 46 15.559 12.369 27.379 1.00 0.00 H ATOM 2365 H PHE B 46 19.719 10.177 28.485 1.00 0.00 H ATOM 2366 N LYS B 47 15.939 8.185 28.338 1.00 12.03 N ATOM 2367 CA LYS B 47 15.508 6.811 28.156 1.00 14.15 C ATOM 2368 C LYS B 47 14.273 6.778 27.288 1.00 14.82 C ATOM 2369 O LYS B 47 13.415 7.654 27.401 1.00 16.94 O ATOM 2370 CB LYS B 47 15.151 6.166 29.491 1.00 16.09 C ATOM 2371 CG LYS B 47 16.213 6.190 30.558 1.00 15.25 C ATOM 2372 CD LYS B 47 15.813 5.212 31.637 1.00 20.11 C ATOM 2373 CE LYS B 47 16.769 5.233 32.808 1.00 27.56 C ATOM 2374 NZ LYS B 47 16.407 4.199 33.833 1.00 31.31 N ATOM 2375 HA LYS B 47 16.330 6.265 27.693 1.00 0.00 H ATOM 2376 HB2 LYS B 47 14.275 6.682 29.884 1.00 0.00 H ATOM 2377 HB3 LYS B 47 14.900 5.123 29.298 1.00 0.00 H ATOM 2378 HG2 LYS B 47 17.173 5.899 30.132 1.00 0.00 H ATOM 2379 HG3 LYS B 47 16.293 7.193 30.978 1.00 0.00 H ATOM 2380 HD2 LYS B 47 14.815 5.470 31.993 1.00 0.00 H ATOM 2381 HD3 LYS B 47 15.798 4.208 31.213 1.00 0.00 H ATOM 2382 HE2 LYS B 47 16.738 6.218 33.273 1.00 0.00 H ATOM 2383 HE3 LYS B 47 17.778 5.035 32.446 1.00 0.00 H ATOM 2384 HZ1 LYS B 47 15.447 4.385 34.188 1.00 0.00 H ATOM 2385 HZ2 LYS B 47 16.440 3.255 33.398 1.00 0.00 H ATOM 2386 HZ3 LYS B 47 17.084 4.242 34.621 1.00 0.00 H ATOM 2387 H LYS B 47 15.244 8.912 28.604 1.00 0.00 H ATOM 2388 N PHE B 48 14.181 5.783 26.416 1.00 13.39 N ATOM 2389 CA PHE B 48 13.013 5.632 25.557 1.00 14.47 C ATOM 2390 C PHE B 48 12.927 4.178 25.135 1.00 17.66 C ATOM 2391 O PHE B 48 13.942 3.481 25.097 1.00 16.27 O ATOM 2392 CB PHE B 48 13.093 6.540 24.323 1.00 15.18 C ATOM 2393 CG PHE B 48 14.054 6.059 23.272 1.00 16.93 C ATOM 2394 CD1 PHE B 48 15.417 6.294 23.398 1.00 16.50 C ATOM 2395 CD2 PHE B 48 13.589 5.361 22.160 1.00 15.97 C ATOM 2396 CE1 PHE B 48 16.303 5.840 22.428 1.00 16.89 C ATOM 2397 CE2 PHE B 48 14.464 4.906 21.192 1.00 17.22 C ATOM 2398 CZ PHE B 48 15.825 5.146 21.325 1.00 16.63 C ATOM 2399 HA PHE B 48 12.121 5.927 26.109 1.00 0.00 H ATOM 2400 HB2 PHE B 48 12.100 6.602 23.878 1.00 0.00 H ATOM 2401 HB3 PHE B 48 13.407 7.532 24.647 1.00 0.00 H ATOM 2402 HD2 PHE B 48 12.521 5.171 22.052 1.00 0.00 H ATOM 2403 HE2 PHE B 48 14.087 4.361 20.327 1.00 0.00 H ATOM 2404 HZ PHE B 48 16.518 4.789 20.563 1.00 0.00 H ATOM 2405 HE1 PHE B 48 17.371 6.029 22.533 1.00 0.00 H ATOM 2406 HD1 PHE B 48 15.795 6.838 24.264 1.00 0.00 H ATOM 2407 H PHE B 48 14.958 5.096 26.344 1.00 0.00 H ATOM 2408 N MET B 49 11.719 3.722 24.818 1.00 17.43 N ATOM 2409 CA MET B 49 11.509 2.346 24.410 1.00 18.34 C ATOM 2410 C MET B 49 11.396 2.272 22.900 1.00 18.07 C ATOM 2411 O MET B 49 10.675 3.050 22.271 1.00 17.74 O ATOM 2412 CB MET B 49 10.268 1.785 25.094 1.00 20.56 C ATOM 2413 CG MET B 49 10.020 0.323 24.811 1.00 28.25 C ATOM 2414 SD MET B 49 8.805 -0.339 25.945 1.00 31.32 S ATOM 2415 CE MET B 49 7.325 0.032 25.052 1.00 35.72 C ATOM 2416 HA MET B 49 12.361 1.737 24.714 1.00 0.00 H ATOM 2417 HB2 MET B 49 10.383 1.912 26.171 1.00 0.00 H ATOM 2418 HB3 MET B 49 9.402 2.352 24.753 1.00 0.00 H ATOM 2419 HG2 MET B 49 10.954 -0.228 24.924 1.00 0.00 H ATOM 2420 HG3 MET B 49 9.656 0.212 23.790 1.00 0.00 H ATOM 2421 HE1 MET B 49 7.253 1.109 24.902 1.00 0.00 H ATOM 2422 HE2 MET B 49 7.350 -0.470 24.085 1.00 0.00 H ATOM 2423 HE3 MET B 49 6.462 -0.316 25.621 1.00 0.00 H ATOM 2424 H MET B 49 10.905 4.368 24.864 1.00 0.00 H ATOM 2425 N LEU B 50 12.184 1.378 22.321 1.00 19.74 N ATOM 2426 CA LEU B 50 12.230 1.182 20.885 1.00 21.95 C ATOM 2427 C LEU B 50 10.941 0.525 20.366 1.00 23.38 C ATOM 2428 O LEU B 50 10.413 -0.397 20.989 1.00 25.06 O ATOM 2429 CB LEU B 50 13.443 0.319 20.534 1.00 20.13 C ATOM 2430 CG LEU B 50 13.967 0.357 19.097 1.00 22.35 C ATOM 2431 CD1 LEU B 50 14.599 1.716 18.796 1.00 20.38 C ATOM 2432 CD2 LEU B 50 14.997 -0.732 18.913 1.00 22.55 C ATOM 2433 HA LEU B 50 12.318 2.156 20.404 1.00 0.00 H ATOM 2434 HB2 LEU B 50 14.260 0.630 21.184 1.00 0.00 H ATOM 2435 HB3 LEU B 50 13.179 -0.715 20.754 1.00 0.00 H ATOM 2436 HG LEU B 50 13.135 0.199 18.411 1.00 0.00 H ATOM 2437 HD21 LEU B 50 15.822 -0.571 19.607 1.00 0.00 H ATOM 2438 HD22 LEU B 50 14.538 -1.701 19.110 1.00 0.00 H ATOM 2439 HD23 LEU B 50 15.372 -0.707 17.890 1.00 0.00 H ATOM 2440 HD11 LEU B 50 13.851 2.499 18.923 1.00 0.00 H ATOM 2441 HD12 LEU B 50 15.428 1.889 19.482 1.00 0.00 H ATOM 2442 HD13 LEU B 50 14.966 1.725 17.770 1.00 0.00 H ATOM 2443 H LEU B 50 12.796 0.791 22.923 1.00 0.00 H ATOM 2444 N GLY B 51 10.420 1.048 19.257 1.00 24.40 N ATOM 2445 CA GLY B 51 9.214 0.503 18.643 1.00 26.32 C ATOM 2446 C GLY B 51 7.876 0.930 19.224 1.00 27.92 C ATOM 2447 O GLY B 51 6.852 0.315 18.943 1.00 30.32 O ATOM 2448 HA3 GLY B 51 9.271 -0.583 18.718 1.00 0.00 H ATOM 2449 HA2 GLY B 51 9.222 0.794 17.593 1.00 0.00 H ATOM 2450 H GLY B 51 10.886 1.867 18.817 1.00 0.00 H ATOM 2451 N LYS B 52 7.863 2.012 19.988 1.00 26.42 N ATOM 2452 CA LYS B 52 6.638 2.490 20.609 1.00 25.46 C ATOM 2453 C LYS B 52 6.338 3.934 20.185 1.00 24.64 C ATOM 2454 O LYS B 52 5.515 4.610 20.794 1.00 25.46 O ATOM 2455 CB LYS B 52 6.804 2.376 22.126 1.00 30.15 C ATOM 2456 CG LYS B 52 5.550 2.592 22.950 1.00 40.93 C ATOM 2457 CD LYS B 52 4.485 1.551 22.648 1.00 46.80 C ATOM 2458 CE LYS B 52 3.203 1.837 23.426 1.00 50.10 C ATOM 2459 NZ LYS B 52 2.027 1.078 22.899 1.00 51.69 N ATOM 2460 HA LYS B 52 5.790 1.886 20.286 1.00 0.00 H ATOM 2461 HB2 LYS B 52 7.180 1.377 22.346 1.00 0.00 H ATOM 2462 HB3 LYS B 52 7.540 3.117 22.438 1.00 0.00 H ATOM 2463 HG2 LYS B 52 5.809 2.535 24.007 1.00 0.00 H ATOM 2464 HG3 LYS B 52 5.149 3.581 22.729 1.00 0.00 H ATOM 2465 HD2 LYS B 52 4.265 1.565 21.581 1.00 0.00 H ATOM 2466 HD3 LYS B 52 4.860 0.566 22.927 1.00 0.00 H ATOM 2467 HE2 LYS B 52 2.987 2.903 23.363 1.00 0.00 H ATOM 2468 HE3 LYS B 52 3.358 1.560 24.469 1.00 0.00 H ATOM 2469 HZ1 LYS B 52 1.863 1.340 21.906 1.00 0.00 H ATOM 2470 HZ2 LYS B 52 2.218 0.058 22.962 1.00 0.00 H ATOM 2471 HZ3 LYS B 52 1.185 1.310 23.464 1.00 0.00 H ATOM 2472 H LYS B 52 8.750 2.532 20.147 1.00 0.00 H ATOM 2473 N GLN B 53 6.978 4.375 19.101 1.00 22.95 N ATOM 2474 CA GLN B 53 6.828 5.732 18.563 1.00 22.51 C ATOM 2475 C GLN B 53 7.053 6.856 19.579 1.00 21.96 C ATOM 2476 O GLN B 53 6.429 7.914 19.503 1.00 19.84 O ATOM 2477 CB GLN B 53 5.473 5.908 17.871 1.00 25.98 C ATOM 2478 CG GLN B 53 5.402 5.300 16.482 1.00 29.12 C ATOM 2479 CD GLN B 53 4.087 5.597 15.785 1.00 34.95 C ATOM 2480 OE1 GLN B 53 3.231 4.720 15.648 1.00 35.76 O ATOM 2481 NE2 GLN B 53 3.920 6.838 15.342 1.00 33.56 N ATOM 2482 HA GLN B 53 7.631 5.828 17.832 1.00 0.00 H ATOM 2483 HB2 GLN B 53 4.709 5.438 18.490 1.00 0.00 H ATOM 2484 HB3 GLN B 53 5.267 6.975 17.789 1.00 0.00 H ATOM 2485 HG2 GLN B 53 6.216 5.705 15.881 1.00 0.00 H ATOM 2486 HG3 GLN B 53 5.517 4.219 16.567 1.00 0.00 H ATOM 2487 HE22 GLN B 53 4.670 7.545 15.480 1.00 0.00 H ATOM 2488 HE21 GLN B 53 3.039 7.103 14.857 1.00 0.00 H ATOM 2489 H GLN B 53 7.619 3.720 18.609 1.00 0.00 H ATOM 2490 N GLU B 54 7.987 6.645 20.499 1.00 20.02 N ATOM 2491 CA GLU B 54 8.287 7.649 21.520 1.00 17.59 C ATOM 2492 C GLU B 54 9.197 8.769 21.058 1.00 15.27 C ATOM 2493 O GLU B 54 9.155 9.856 21.621 1.00 16.34 O ATOM 2494 CB GLU B 54 8.889 6.988 22.753 1.00 14.55 C ATOM 2495 CG GLU B 54 7.946 6.006 23.387 1.00 17.44 C ATOM 2496 CD GLU B 54 8.482 5.353 24.643 1.00 18.36 C ATOM 2497 OE1 GLU B 54 9.579 5.715 25.119 1.00 17.94 O ATOM 2498 OE2 GLU B 54 7.785 4.462 25.161 1.00 20.16 O ATOM 2499 HA GLU B 54 7.328 8.111 21.754 1.00 0.00 H ATOM 2500 HB2 GLU B 54 9.799 6.464 22.462 1.00 0.00 H ATOM 2501 HB3 GLU B 54 9.134 7.761 23.482 1.00 0.00 H ATOM 2502 HG2 GLU B 54 7.025 6.531 23.641 1.00 0.00 H ATOM 2503 HG3 GLU B 54 7.728 5.223 22.661 1.00 0.00 H ATOM 2504 H GLU B 54 8.515 5.749 20.494 1.00 0.00 H ATOM 2505 N VAL B 55 9.988 8.518 20.015 1.00 13.05 N ATOM 2506 CA VAL B 55 10.939 9.503 19.507 1.00 11.45 C ATOM 2507 C VAL B 55 10.811 9.708 18.000 1.00 11.17 C ATOM 2508 O VAL B 55 10.130 8.942 17.314 1.00 13.10 O ATOM 2509 CB VAL B 55 12.409 9.079 19.819 1.00 13.46 C ATOM 2510 CG1 VAL B 55 12.647 9.036 21.326 1.00 14.04 C ATOM 2511 CG2 VAL B 55 12.716 7.717 19.216 1.00 9.38 C ATOM 2512 HA VAL B 55 10.701 10.438 20.014 1.00 0.00 H ATOM 2513 HB VAL B 55 13.073 9.821 19.374 1.00 0.00 H ATOM 2514 HG11 VAL B 55 12.466 10.024 21.749 1.00 0.00 H ATOM 2515 HG12 VAL B 55 11.967 8.315 21.780 1.00 0.00 H ATOM 2516 HG13 VAL B 55 13.677 8.738 21.522 1.00 0.00 H ATOM 2517 HG21 VAL B 55 12.038 6.974 19.636 1.00 0.00 H ATOM 2518 HG22 VAL B 55 12.584 7.762 18.135 1.00 0.00 H ATOM 2519 HG23 VAL B 55 13.745 7.443 19.446 1.00 0.00 H ATOM 2520 H VAL B 55 9.926 7.591 19.548 1.00 0.00 H ATOM 2521 N ILE B 56 11.486 10.729 17.489 1.00 9.48 N ATOM 2522 CA ILE B 56 11.459 11.015 16.066 1.00 11.08 C ATOM 2523 C ILE B 56 11.982 9.816 15.275 1.00 13.63 C ATOM 2524 O ILE B 56 12.782 9.016 15.778 1.00 10.39 O ATOM 2525 CB ILE B 56 12.266 12.292 15.705 1.00 12.82 C ATOM 2526 CG1 ILE B 56 13.736 12.162 16.146 1.00 9.87 C ATOM 2527 CG2 ILE B 56 11.576 13.535 16.300 1.00 12.15 C ATOM 2528 CD1 ILE B 56 14.608 13.359 15.755 1.00 10.39 C ATOM 2529 HA ILE B 56 10.420 11.203 15.794 1.00 0.00 H ATOM 2530 HB ILE B 56 12.281 12.412 14.622 1.00 0.00 H ATOM 2531 HG12 ILE B 56 13.762 12.058 17.231 1.00 0.00 H ATOM 2532 HG13 ILE B 56 14.155 11.267 15.686 1.00 0.00 H ATOM 2533 HD11 ILE B 56 14.604 13.471 14.671 1.00 0.00 H ATOM 2534 HD12 ILE B 56 14.210 14.263 16.216 1.00 0.00 H ATOM 2535 HD13 ILE B 56 15.628 13.192 16.100 1.00 0.00 H ATOM 2536 HG21 ILE B 56 10.568 13.619 15.893 1.00 0.00 H ATOM 2537 HG22 ILE B 56 11.525 13.436 17.384 1.00 0.00 H ATOM 2538 HG23 ILE B 56 12.149 14.426 16.042 1.00 0.00 H ATOM 2539 H ILE B 56 12.046 11.337 18.120 1.00 0.00 H ATOM 2540 N ARG B 57 11.512 9.708 14.036 1.00 13.27 N ATOM 2541 CA ARG B 57 11.865 8.634 13.108 1.00 16.88 C ATOM 2542 C ARG B 57 13.359 8.301 13.015 1.00 14.19 C ATOM 2543 O ARG B 57 13.760 7.144 13.160 1.00 12.16 O ATOM 2544 CB ARG B 57 11.355 9.012 11.700 1.00 24.07 C ATOM 2545 CG ARG B 57 10.320 8.064 11.080 1.00 36.68 C ATOM 2546 CD ARG B 57 8.896 8.321 11.603 1.00 43.09 C ATOM 2547 NE ARG B 57 8.798 8.176 13.056 1.00 50.27 N ATOM 2548 CZ ARG B 57 8.589 7.023 13.690 1.00 53.88 C ATOM 2549 NH1 ARG B 57 8.436 5.894 13.002 1.00 53.05 N ATOM 2550 NH2 ARG B 57 8.595 6.987 15.021 1.00 55.08 N ATOM 2551 HA ARG B 57 11.391 7.737 13.506 1.00 0.00 H ATOM 2552 HB2 ARG B 57 10.904 10.002 11.764 1.00 0.00 H ATOM 2553 HB3 ARG B 57 12.216 9.048 11.032 1.00 0.00 H ATOM 2554 HG2 ARG B 57 10.325 8.200 9.999 1.00 0.00 H ATOM 2555 HG3 ARG B 57 10.600 7.038 11.317 1.00 0.00 H ATOM 2556 HD2 ARG B 57 8.217 7.609 11.134 1.00 0.00 H ATOM 2557 HD3 ARG B 57 8.601 9.335 11.332 1.00 0.00 H ATOM 2558 HE ARG B 57 8.899 9.034 13.635 1.00 0.00 H ATOM 2559 HH12 ARG B 57 8.273 4.998 13.503 1.00 0.00 H ATOM 2560 HH11 ARG B 57 8.479 5.908 11.963 1.00 0.00 H ATOM 2561 HH22 ARG B 57 8.432 6.088 15.518 1.00 0.00 H ATOM 2562 HH21 ARG B 57 8.763 7.858 15.564 1.00 0.00 H ATOM 2563 H ARG B 57 10.848 10.437 13.704 1.00 0.00 H ATOM 2564 N GLY B 58 14.159 9.316 12.699 1.00 11.48 N ATOM 2565 CA GLY B 58 15.594 9.151 12.555 1.00 11.90 C ATOM 2566 C GLY B 58 16.257 8.475 13.734 1.00 14.43 C ATOM 2567 O GLY B 58 17.242 7.764 13.558 1.00 12.83 O ATOM 2568 HA3 GLY B 58 16.042 10.137 12.429 1.00 0.00 H ATOM 2569 HA2 GLY B 58 15.783 8.551 11.665 1.00 0.00 H ATOM 2570 H GLY B 58 13.743 10.258 12.550 1.00 0.00 H ATOM 2571 N TRP B 59 15.744 8.719 14.938 1.00 13.81 N ATOM 2572 CA TRP B 59 16.277 8.087 16.147 1.00 15.44 C ATOM 2573 C TRP B 59 15.908 6.607 16.231 1.00 17.59 C ATOM 2574 O TRP B 59 16.763 5.785 16.551 1.00 19.41 O ATOM 2575 CB TRP B 59 15.785 8.802 17.410 1.00 13.84 C ATOM 2576 CG TRP B 59 16.802 9.719 17.994 1.00 12.46 C ATOM 2577 CD1 TRP B 59 17.388 10.790 17.382 1.00 11.91 C ATOM 2578 CD2 TRP B 59 17.334 9.665 19.318 1.00 7.76 C ATOM 2579 NE1 TRP B 59 18.243 11.412 18.249 1.00 9.14 N ATOM 2580 CE2 TRP B 59 18.233 10.744 19.448 1.00 10.05 C ATOM 2581 CE3 TRP B 59 17.139 8.806 20.410 1.00 7.82 C ATOM 2582 CZ2 TRP B 59 18.946 10.997 20.630 1.00 9.48 C ATOM 2583 CZ3 TRP B 59 17.845 9.050 21.586 1.00 8.34 C ATOM 2584 CH2 TRP B 59 18.741 10.141 21.687 1.00 10.56 C ATOM 2585 HA TRP B 59 17.362 8.170 16.084 1.00 0.00 H ATOM 2586 HB2 TRP B 59 14.898 9.383 17.157 1.00 0.00 H ATOM 2587 HB3 TRP B 59 15.526 8.051 18.156 1.00 0.00 H ATOM 2588 HE1 TRP B 59 18.810 12.257 18.034 1.00 0.00 H ATOM 2589 HD1 TRP B 59 17.202 11.103 16.355 1.00 0.00 H ATOM 2590 HZ2 TRP B 59 19.635 11.838 20.707 1.00 0.00 H ATOM 2591 HH2 TRP B 59 19.279 10.306 22.620 1.00 0.00 H ATOM 2592 HZ3 TRP B 59 17.705 8.390 22.442 1.00 0.00 H ATOM 2593 HE3 TRP B 59 16.449 7.965 20.340 1.00 0.00 H ATOM 2594 H TRP B 59 14.943 9.377 15.022 1.00 0.00 H ATOM 2595 N GLU B 60 14.653 6.263 15.952 1.00 17.68 N ATOM 2596 CA GLU B 60 14.219 4.865 15.997 1.00 21.52 C ATOM 2597 C GLU B 60 15.121 4.055 15.079 1.00 22.39 C ATOM 2598 O GLU B 60 15.586 2.972 15.437 1.00 25.72 O ATOM 2599 CB GLU B 60 12.772 4.700 15.497 1.00 25.48 C ATOM 2600 CG GLU B 60 11.660 5.172 16.441 1.00 31.44 C ATOM 2601 CD GLU B 60 11.252 4.143 17.485 1.00 30.46 C ATOM 2602 OE1 GLU B 60 11.396 2.930 17.239 1.00 34.06 O ATOM 2603 OE2 GLU B 60 10.750 4.550 18.555 1.00 39.05 O ATOM 2604 HA GLU B 60 14.273 4.526 17.031 1.00 0.00 H ATOM 2605 HB2 GLU B 60 12.677 5.261 14.568 1.00 0.00 H ATOM 2606 HB3 GLU B 60 12.610 3.641 15.298 1.00 0.00 H ATOM 2607 HG2 GLU B 60 12.007 6.066 16.959 1.00 0.00 H ATOM 2608 HG3 GLU B 60 10.783 5.418 15.842 1.00 0.00 H ATOM 2609 H GLU B 60 13.967 7.002 15.697 1.00 0.00 H ATOM 2610 N GLU B 61 15.382 4.595 13.899 1.00 20.63 N ATOM 2611 CA GLU B 61 16.211 3.898 12.932 1.00 21.43 C ATOM 2612 C GLU B 61 17.707 3.956 13.222 1.00 18.01 C ATOM 2613 O GLU B 61 18.402 2.961 13.061 1.00 18.44 O ATOM 2614 CB GLU B 61 15.916 4.404 11.520 1.00 24.49 C ATOM 2615 CG GLU B 61 14.495 4.103 11.057 1.00 30.69 C ATOM 2616 CD GLU B 61 14.274 4.368 9.574 1.00 37.51 C ATOM 2617 OE1 GLU B 61 15.242 4.756 8.879 1.00 40.37 O ATOM 2618 OE2 GLU B 61 13.127 4.177 9.099 1.00 40.60 O ATOM 2619 HA GLU B 61 15.942 2.845 13.016 1.00 0.00 H ATOM 2620 HB2 GLU B 61 16.065 5.484 11.501 1.00 0.00 H ATOM 2621 HB3 GLU B 61 16.613 3.930 10.829 1.00 0.00 H ATOM 2622 HG2 GLU B 61 14.281 3.053 11.256 1.00 0.00 H ATOM 2623 HG3 GLU B 61 13.806 4.727 11.626 1.00 0.00 H ATOM 2624 H GLU B 61 14.989 5.528 13.662 1.00 0.00 H ATOM 2625 N GLY B 62 18.199 5.103 13.678 1.00 16.16 N ATOM 2626 CA GLY B 62 19.621 5.230 13.956 1.00 15.98 C ATOM 2627 C GLY B 62 20.111 4.502 15.189 1.00 15.72 C ATOM 2628 O GLY B 62 21.112 3.780 15.147 1.00 13.75 O ATOM 2629 HA3 GLY B 62 19.846 6.289 14.079 1.00 0.00 H ATOM 2630 HA2 GLY B 62 20.168 4.841 13.097 1.00 0.00 H ATOM 2631 H GLY B 62 17.565 5.912 13.837 1.00 0.00 H ATOM 2632 N VAL B 63 19.402 4.675 16.298 1.00 14.10 N ATOM 2633 CA VAL B 63 19.807 4.027 17.535 1.00 13.57 C ATOM 2634 C VAL B 63 19.710 2.508 17.385 1.00 14.08 C ATOM 2635 O VAL B 63 20.522 1.791 17.948 1.00 14.30 O ATOM 2636 CB VAL B 63 19.009 4.551 18.768 1.00 9.79 C ATOM 2637 CG1 VAL B 63 19.416 3.803 20.025 1.00 12.59 C ATOM 2638 CG2 VAL B 63 19.282 6.025 18.985 1.00 10.95 C ATOM 2639 HA VAL B 63 20.848 4.285 17.728 1.00 0.00 H ATOM 2640 HB VAL B 63 17.949 4.392 18.569 1.00 0.00 H ATOM 2641 HG11 VAL B 63 19.211 2.740 19.896 1.00 0.00 H ATOM 2642 HG12 VAL B 63 20.481 3.949 20.205 1.00 0.00 H ATOM 2643 HG13 VAL B 63 18.847 4.184 20.873 1.00 0.00 H ATOM 2644 HG21 VAL B 63 20.347 6.174 19.161 1.00 0.00 H ATOM 2645 HG22 VAL B 63 18.977 6.584 18.100 1.00 0.00 H ATOM 2646 HG23 VAL B 63 18.717 6.374 19.849 1.00 0.00 H ATOM 2647 H VAL B 63 18.554 5.276 16.282 1.00 0.00 H ATOM 2648 N ALA B 64 18.778 2.023 16.563 1.00 14.93 N ATOM 2649 CA ALA B 64 18.608 0.581 16.345 1.00 13.40 C ATOM 2650 C ALA B 64 19.839 -0.032 15.680 1.00 14.06 C ATOM 2651 O ALA B 64 20.050 -1.246 15.724 1.00 15.96 O ATOM 2652 CB ALA B 64 17.363 0.305 15.502 1.00 13.60 C ATOM 2653 HA ALA B 64 18.483 0.114 17.322 1.00 0.00 H ATOM 2654 HB1 ALA B 64 16.484 0.690 16.018 1.00 0.00 H ATOM 2655 HB2 ALA B 64 17.464 0.799 14.535 1.00 0.00 H ATOM 2656 HB3 ALA B 64 17.257 -0.770 15.353 1.00 0.00 H ATOM 2657 H ALA B 64 18.153 2.686 16.062 1.00 0.00 H ATOM 2658 N GLN B 65 20.677 0.810 15.096 1.00 14.42 N ATOM 2659 CA GLN B 65 21.891 0.333 14.454 1.00 12.61 C ATOM 2660 C GLN B 65 23.130 0.424 15.364 1.00 13.27 C ATOM 2661 O GLN B 65 24.235 0.085 14.933 1.00 12.35 O ATOM 2662 CB GLN B 65 22.142 1.139 13.185 1.00 13.62 C ATOM 2663 CG GLN B 65 21.050 1.013 12.141 1.00 15.80 C ATOM 2664 CD GLN B 65 21.247 1.991 11.008 1.00 18.85 C ATOM 2665 OE1 GLN B 65 22.107 1.802 10.146 1.00 25.19 O ATOM 2666 NE2 GLN B 65 20.479 3.066 11.023 1.00 20.48 N ATOM 2667 HA GLN B 65 21.737 -0.721 14.224 1.00 0.00 H ATOM 2668 HB2 GLN B 65 22.233 2.190 13.460 1.00 0.00 H ATOM 2669 HB3 GLN B 65 23.078 0.798 12.743 1.00 0.00 H ATOM 2670 HG2 GLN B 65 21.060 -0.000 11.739 1.00 0.00 H ATOM 2671 HG3 GLN B 65 20.086 1.207 12.612 1.00 0.00 H ATOM 2672 HE22 GLN B 65 19.765 3.185 11.770 1.00 0.00 H ATOM 2673 HE21 GLN B 65 20.588 3.793 10.288 1.00 0.00 H ATOM 2674 H GLN B 65 20.464 1.828 15.096 1.00 0.00 H ATOM 2675 N MET B 66 22.960 0.872 16.609 1.00 9.37 N ATOM 2676 CA MET B 66 24.085 1.012 17.539 1.00 9.36 C ATOM 2677 C MET B 66 24.155 -0.110 18.567 1.00 8.18 C ATOM 2678 O MET B 66 23.144 -0.710 18.904 1.00 10.38 O ATOM 2679 CB MET B 66 23.997 2.353 18.269 1.00 8.27 C ATOM 2680 CG MET B 66 24.138 3.571 17.360 1.00 10.12 C ATOM 2681 SD MET B 66 23.785 5.110 18.229 1.00 12.40 S ATOM 2682 CE MET B 66 25.240 5.269 19.237 1.00 16.15 C ATOM 2683 HA MET B 66 24.992 0.960 16.936 1.00 0.00 H ATOM 2684 HB2 MET B 66 23.029 2.408 18.767 1.00 0.00 H ATOM 2685 HB3 MET B 66 24.791 2.389 19.015 1.00 0.00 H ATOM 2686 HG2 MET B 66 23.443 3.470 16.526 1.00 0.00 H ATOM 2687 HG3 MET B 66 25.158 3.609 16.978 1.00 0.00 H ATOM 2688 HE1 MET B 66 25.320 4.405 19.896 1.00 0.00 H ATOM 2689 HE2 MET B 66 26.120 5.322 18.596 1.00 0.00 H ATOM 2690 HE3 MET B 66 25.169 6.178 19.835 1.00 0.00 H ATOM 2691 H MET B 66 22.004 1.129 16.928 1.00 0.00 H ATOM 2692 N SER B 67 25.363 -0.454 19.002 1.00 9.16 N ATOM 2693 CA SER B 67 25.512 -1.486 20.016 1.00 10.33 C ATOM 2694 C SER B 67 25.901 -0.808 21.319 1.00 10.51 C ATOM 2695 O SER B 67 26.351 0.341 21.316 1.00 10.88 O ATOM 2696 CB SER B 67 26.536 -2.550 19.597 1.00 9.58 C ATOM 2697 OG SER B 67 27.816 -1.994 19.333 1.00 12.62 O ATOM 2698 HA SER B 67 24.569 -2.017 20.145 1.00 0.00 H ATOM 2699 HB2 SER B 67 26.177 -3.046 18.696 1.00 0.00 H ATOM 2700 HB3 SER B 67 26.630 -3.281 20.400 1.00 0.00 H ATOM 2701 HG SER B 67 27.743 -1.333 18.599 1.00 0.00 H ATOM 2702 H SER B 67 26.206 0.017 18.615 1.00 0.00 H ATOM 2703 N VAL B 68 25.699 -1.496 22.435 1.00 11.68 N ATOM 2704 CA VAL B 68 26.012 -0.936 23.743 1.00 13.40 C ATOM 2705 C VAL B 68 27.460 -0.459 23.884 1.00 12.22 C ATOM 2706 O VAL B 68 28.416 -1.187 23.573 1.00 11.03 O ATOM 2707 CB VAL B 68 25.630 -1.917 24.873 1.00 14.32 C ATOM 2708 CG1 VAL B 68 25.986 -1.330 26.223 1.00 16.36 C ATOM 2709 CG2 VAL B 68 24.146 -2.219 24.809 1.00 14.25 C ATOM 2710 HA VAL B 68 25.400 -0.039 23.837 1.00 0.00 H ATOM 2711 HB VAL B 68 26.189 -2.844 24.741 1.00 0.00 H ATOM 2712 HG11 VAL B 68 27.059 -1.140 26.264 1.00 0.00 H ATOM 2713 HG12 VAL B 68 25.445 -0.395 26.365 1.00 0.00 H ATOM 2714 HG13 VAL B 68 25.710 -2.034 27.008 1.00 0.00 H ATOM 2715 HG21 VAL B 68 23.583 -1.293 24.928 1.00 0.00 H ATOM 2716 HG22 VAL B 68 23.909 -2.668 23.845 1.00 0.00 H ATOM 2717 HG23 VAL B 68 23.883 -2.911 25.609 1.00 0.00 H ATOM 2718 H VAL B 68 25.308 -2.458 22.375 1.00 0.00 H ATOM 2719 N GLY B 69 27.598 0.785 24.324 1.00 10.85 N ATOM 2720 CA GLY B 69 28.898 1.394 24.494 1.00 10.57 C ATOM 2721 C GLY B 69 29.294 2.291 23.336 1.00 11.09 C ATOM 2722 O GLY B 69 30.195 3.118 23.474 1.00 11.93 O ATOM 2723 HA3 GLY B 69 29.642 0.603 24.590 1.00 0.00 H ATOM 2724 HA2 GLY B 69 28.885 1.991 25.406 1.00 0.00 H ATOM 2725 H GLY B 69 26.747 1.337 24.553 1.00 0.00 H ATOM 2726 N GLN B 70 28.583 2.176 22.215 1.00 8.84 N ATOM 2727 CA GLN B 70 28.897 2.955 21.026 1.00 8.24 C ATOM 2728 C GLN B 70 28.517 4.410 21.125 1.00 8.71 C ATOM 2729 O GLN B 70 27.523 4.764 21.745 1.00 11.39 O ATOM 2730 CB GLN B 70 28.211 2.352 19.801 1.00 9.66 C ATOM 2731 CG GLN B 70 28.627 2.977 18.474 1.00 7.90 C ATOM 2732 CD GLN B 70 27.975 2.298 17.301 1.00 10.40 C ATOM 2733 OE1 GLN B 70 27.341 1.249 17.445 1.00 10.60 O ATOM 2734 NE2 GLN B 70 28.140 2.874 16.124 1.00 13.75 N ATOM 2735 HA GLN B 70 29.982 2.913 20.930 1.00 0.00 H ATOM 2736 HB2 GLN B 70 28.448 1.289 19.766 1.00 0.00 H ATOM 2737 HB3 GLN B 70 27.135 2.480 19.916 1.00 0.00 H ATOM 2738 HG2 GLN B 70 28.341 4.029 18.475 1.00 0.00 H ATOM 2739 HG3 GLN B 70 29.709 2.896 18.371 1.00 0.00 H ATOM 2740 HE22 GLN B 70 28.682 3.758 16.049 1.00 0.00 H ATOM 2741 HE21 GLN B 70 27.728 2.443 15.272 1.00 0.00 H ATOM 2742 H GLN B 70 27.783 1.512 22.189 1.00 0.00 H ATOM 2743 N ARG B 71 29.325 5.254 20.511 1.00 9.67 N ATOM 2744 CA ARG B 71 29.059 6.681 20.481 1.00 8.76 C ATOM 2745 C ARG B 71 29.042 6.996 19.003 1.00 8.83 C ATOM 2746 O ARG B 71 29.943 6.588 18.262 1.00 8.71 O ATOM 2747 CB ARG B 71 30.156 7.477 21.194 1.00 9.21 C ATOM 2748 CG ARG B 71 29.811 8.944 21.384 1.00 9.17 C ATOM 2749 CD ARG B 71 30.845 9.670 22.212 1.00 10.93 C ATOM 2750 NE ARG B 71 30.528 11.087 22.344 1.00 13.54 N ATOM 2751 CZ ARG B 71 31.212 11.949 23.096 1.00 14.52 C ATOM 2752 NH1 ARG B 71 32.255 11.539 23.797 1.00 13.65 N ATOM 2753 NH2 ARG B 71 30.867 13.231 23.122 1.00 12.01 N ATOM 2754 HA ARG B 71 28.134 6.946 20.993 1.00 0.00 H ATOM 2755 HB2 ARG B 71 30.324 7.032 22.175 1.00 0.00 H ATOM 2756 HB3 ARG B 71 31.070 7.410 20.604 1.00 0.00 H ATOM 2757 HG2 ARG B 71 29.747 9.420 20.405 1.00 0.00 H ATOM 2758 HG3 ARG B 71 28.846 9.016 21.885 1.00 0.00 H ATOM 2759 HD2 ARG B 71 31.818 9.568 21.732 1.00 0.00 H ATOM 2760 HD3 ARG B 71 30.882 9.221 23.205 1.00 0.00 H ATOM 2761 HE ARG B 71 29.710 11.451 21.814 1.00 0.00 H ATOM 2762 HH12 ARG B 71 32.786 12.215 24.383 1.00 0.00 H ATOM 2763 HH11 ARG B 71 32.544 10.541 23.763 1.00 0.00 H ATOM 2764 HH22 ARG B 71 31.402 13.902 23.710 1.00 0.00 H ATOM 2765 HH21 ARG B 71 30.062 13.564 22.555 1.00 0.00 H ATOM 2766 H ARG B 71 30.175 4.887 20.036 1.00 0.00 H ATOM 2767 N ALA B 72 27.999 7.674 18.555 1.00 7.46 N ATOM 2768 CA ALA B 72 27.877 7.978 17.154 1.00 8.77 C ATOM 2769 C ALA B 72 27.252 9.326 16.920 1.00 7.92 C ATOM 2770 O ALA B 72 26.594 9.880 17.792 1.00 9.07 O ATOM 2771 CB ALA B 72 27.039 6.903 16.472 1.00 8.79 C ATOM 2772 HA ALA B 72 28.881 8.001 16.731 1.00 0.00 H ATOM 2773 HB1 ALA B 72 27.524 5.934 16.593 1.00 0.00 H ATOM 2774 HB2 ALA B 72 26.048 6.874 16.926 1.00 0.00 H ATOM 2775 HB3 ALA B 72 26.947 7.134 15.411 1.00 0.00 H ATOM 2776 H ALA B 72 27.263 7.989 19.219 1.00 0.00 H ATOM 2777 N LYS B 73 27.483 9.848 15.727 1.00 8.34 N ATOM 2778 CA LYS B 73 26.905 11.107 15.308 1.00 9.89 C ATOM 2779 C LYS B 73 25.826 10.707 14.293 1.00 11.46 C ATOM 2780 O LYS B 73 26.114 9.977 13.338 1.00 4.69 O ATOM 2781 CB LYS B 73 27.962 11.949 14.627 1.00 9.85 C ATOM 2782 CG LYS B 73 27.492 13.313 14.248 1.00 21.31 C ATOM 2783 CD LYS B 73 28.102 14.333 15.181 1.00 31.05 C ATOM 2784 CE LYS B 73 29.625 14.346 15.075 1.00 33.46 C ATOM 2785 NZ LYS B 73 30.217 15.433 15.908 1.00 37.80 N ATOM 2786 HA LYS B 73 26.506 11.688 16.140 1.00 0.00 H ATOM 2787 HB2 LYS B 73 28.809 12.053 15.305 1.00 0.00 H ATOM 2788 HB3 LYS B 73 28.284 11.432 13.723 1.00 0.00 H ATOM 2789 HG2 LYS B 73 27.795 13.530 13.224 1.00 0.00 H ATOM 2790 HG3 LYS B 73 26.405 13.357 14.322 1.00 0.00 H ATOM 2791 HD2 LYS B 73 27.720 15.321 14.925 1.00 0.00 H ATOM 2792 HD3 LYS B 73 27.820 14.090 16.205 1.00 0.00 H ATOM 2793 HE2 LYS B 73 29.907 14.502 14.034 1.00 0.00 H ATOM 2794 HE3 LYS B 73 30.013 13.386 15.415 1.00 0.00 H ATOM 2795 HZ1 LYS B 73 29.854 16.353 15.585 1.00 0.00 H ATOM 2796 HZ2 LYS B 73 29.955 15.287 16.904 1.00 0.00 H ATOM 2797 HZ3 LYS B 73 31.253 15.415 15.814 1.00 0.00 H ATOM 2798 H LYS B 73 28.102 9.336 15.067 1.00 0.00 H ATOM 2799 N LEU B 74 24.578 11.103 14.555 1.00 10.93 N ATOM 2800 CA LEU B 74 23.453 10.809 13.660 1.00 10.25 C ATOM 2801 C LEU B 74 23.052 12.114 12.983 1.00 10.07 C ATOM 2802 O LEU B 74 22.836 13.119 13.655 1.00 11.45 O ATOM 2803 CB LEU B 74 22.242 10.277 14.434 1.00 10.60 C ATOM 2804 CG LEU B 74 22.427 9.146 15.445 1.00 11.03 C ATOM 2805 CD1 LEU B 74 21.057 8.757 15.984 1.00 14.96 C ATOM 2806 CD2 LEU B 74 23.126 7.954 14.826 1.00 14.46 C ATOM 2807 HA LEU B 74 23.760 10.049 12.942 1.00 0.00 H ATOM 2808 HB2 LEU B 74 21.818 11.121 14.978 1.00 0.00 H ATOM 2809 HB3 LEU B 74 21.523 9.925 13.694 1.00 0.00 H ATOM 2810 HG LEU B 74 23.063 9.490 16.260 1.00 0.00 H ATOM 2811 HD21 LEU B 74 22.532 7.578 13.993 1.00 0.00 H ATOM 2812 HD22 LEU B 74 24.109 8.258 14.465 1.00 0.00 H ATOM 2813 HD23 LEU B 74 23.239 7.171 15.576 1.00 0.00 H ATOM 2814 HD11 LEU B 74 20.600 9.620 16.468 1.00 0.00 H ATOM 2815 HD12 LEU B 74 20.425 8.423 15.161 1.00 0.00 H ATOM 2816 HD13 LEU B 74 21.169 7.950 16.708 1.00 0.00 H ATOM 2817 H LEU B 74 24.396 11.640 15.427 1.00 0.00 H ATOM 2818 N THR B 75 23.065 12.121 11.658 1.00 9.21 N ATOM 2819 CA THR B 75 22.671 13.280 10.873 1.00 9.23 C ATOM 2820 C THR B 75 21.295 12.901 10.319 1.00 10.75 C ATOM 2821 O THR B 75 21.159 11.930 9.564 1.00 8.43 O ATOM 2822 CB THR B 75 23.675 13.549 9.743 1.00 9.60 C ATOM 2823 OG1 THR B 75 24.956 13.818 10.322 1.00 10.24 O ATOM 2824 CG2 THR B 75 23.256 14.767 8.914 1.00 9.44 C ATOM 2825 HA THR B 75 22.643 14.197 11.462 1.00 0.00 H ATOM 2826 HB THR B 75 23.710 12.674 9.094 1.00 0.00 H ATOM 2827 HG1 THR B 75 25.612 13.993 9.602 1.00 0.00 H ATOM 2828 HG23 THR B 75 22.281 14.581 8.464 1.00 0.00 H ATOM 2829 HG21 THR B 75 23.198 15.643 9.561 1.00 0.00 H ATOM 2830 HG22 THR B 75 23.992 14.941 8.129 1.00 0.00 H ATOM 2831 H THR B 75 23.370 11.261 11.158 1.00 0.00 H ATOM 2832 N ILE B 76 20.274 13.636 10.750 1.00 10.75 N ATOM 2833 CA ILE B 76 18.889 13.359 10.379 1.00 10.64 C ATOM 2834 C ILE B 76 18.270 14.472 9.523 1.00 10.66 C ATOM 2835 O ILE B 76 18.334 15.641 9.886 1.00 11.94 O ATOM 2836 CB ILE B 76 18.068 13.165 11.690 1.00 9.01 C ATOM 2837 CG1 ILE B 76 18.709 12.060 12.526 1.00 11.09 C ATOM 2838 CG2 ILE B 76 16.632 12.817 11.386 1.00 8.38 C ATOM 2839 CD1 ILE B 76 18.203 11.963 13.926 1.00 9.14 C ATOM 2840 HA ILE B 76 18.868 12.458 9.767 1.00 0.00 H ATOM 2841 HB ILE B 76 18.074 14.101 12.248 1.00 0.00 H ATOM 2842 HG12 ILE B 76 18.522 11.107 12.030 1.00 0.00 H ATOM 2843 HG13 ILE B 76 19.783 12.243 12.565 1.00 0.00 H ATOM 2844 HD11 ILE B 76 18.393 12.902 14.446 1.00 0.00 H ATOM 2845 HD12 ILE B 76 17.131 11.765 13.911 1.00 0.00 H ATOM 2846 HD13 ILE B 76 18.716 11.151 14.441 1.00 0.00 H ATOM 2847 HG21 ILE B 76 16.179 13.622 10.807 1.00 0.00 H ATOM 2848 HG22 ILE B 76 16.598 11.891 10.812 1.00 0.00 H ATOM 2849 HG23 ILE B 76 16.085 12.688 12.320 1.00 0.00 H ATOM 2850 H ILE B 76 20.470 14.442 11.378 1.00 0.00 H ATOM 2851 N SER B 77 17.689 14.107 8.381 1.00 11.28 N ATOM 2852 CA SER B 77 17.055 15.085 7.496 1.00 9.31 C ATOM 2853 C SER B 77 15.694 15.464 8.091 1.00 9.99 C ATOM 2854 O SER B 77 15.100 14.683 8.839 1.00 9.07 O ATOM 2855 CB SER B 77 16.889 14.511 6.095 1.00 8.28 C ATOM 2856 OG SER B 77 16.131 13.319 6.140 1.00 13.93 O ATOM 2857 HA SER B 77 17.682 15.973 7.415 1.00 0.00 H ATOM 2858 HB2 SER B 77 17.872 14.297 5.675 1.00 0.00 H ATOM 2859 HB3 SER B 77 16.377 15.239 5.466 1.00 0.00 H ATOM 2860 HG SER B 77 15.237 13.512 6.519 1.00 0.00 H ATOM 2861 H SER B 77 17.686 13.102 8.112 1.00 0.00 H ATOM 2862 N PRO B 78 15.142 16.622 7.696 1.00 11.27 N ATOM 2863 CA PRO B 78 13.853 17.082 8.216 1.00 12.40 C ATOM 2864 C PRO B 78 12.723 16.072 8.163 1.00 12.20 C ATOM 2865 O PRO B 78 11.961 15.947 9.119 1.00 11.99 O ATOM 2866 CB PRO B 78 13.564 18.310 7.355 1.00 12.62 C ATOM 2867 CG PRO B 78 14.909 18.834 7.084 1.00 11.78 C ATOM 2868 CD PRO B 78 15.670 17.590 6.724 1.00 10.88 C ATOM 2869 HA PRO B 78 13.914 17.280 9.286 1.00 0.00 H ATOM 2870 HD3 PRO B 78 15.461 17.279 5.700 1.00 0.00 H ATOM 2871 HD2 PRO B 78 16.744 17.732 6.848 1.00 0.00 H ATOM 2872 HG3 PRO B 78 15.331 19.314 7.967 1.00 0.00 H ATOM 2873 HG2 PRO B 78 14.897 19.544 6.257 1.00 0.00 H ATOM 2874 HB2 PRO B 78 13.056 18.033 6.431 1.00 0.00 H ATOM 2875 HB3 PRO B 78 12.960 19.038 7.897 1.00 0.00 H ATOM 2876 N ASP B 79 12.629 15.328 7.068 1.00 12.81 N ATOM 2877 CA ASP B 79 11.559 14.357 6.915 1.00 15.18 C ATOM 2878 C ASP B 79 11.614 13.210 7.921 1.00 14.29 C ATOM 2879 O ASP B 79 10.623 12.526 8.172 1.00 12.15 O ATOM 2880 CB ASP B 79 11.439 13.886 5.450 1.00 21.44 C ATOM 2881 CG ASP B 79 12.740 13.347 4.878 1.00 27.84 C ATOM 2882 OD1 ASP B 79 13.777 14.052 4.944 1.00 32.21 O ATOM 2883 OD2 ASP B 79 12.719 12.220 4.324 1.00 31.29 O ATOM 2884 HA ASP B 79 10.632 14.875 7.162 1.00 0.00 H ATOM 2885 HB2 ASP B 79 10.688 13.098 5.401 1.00 0.00 H ATOM 2886 HB3 ASP B 79 11.118 14.731 4.841 1.00 0.00 H ATOM 2887 H ASP B 79 13.331 15.442 6.309 1.00 0.00 H ATOM 2888 N TYR B 80 12.759 13.074 8.576 1.00 14.67 N ATOM 2889 CA TYR B 80 12.945 12.052 9.587 1.00 13.52 C ATOM 2890 C TYR B 80 12.980 12.686 10.962 1.00 11.31 C ATOM 2891 O TYR B 80 13.258 12.018 11.949 1.00 12.89 O ATOM 2892 CB TYR B 80 14.237 11.284 9.322 1.00 16.64 C ATOM 2893 CG TYR B 80 14.087 10.223 8.264 1.00 17.82 C ATOM 2894 CD1 TYR B 80 13.925 10.561 6.921 1.00 19.70 C ATOM 2895 CD2 TYR B 80 14.073 8.877 8.613 1.00 22.92 C ATOM 2896 CE1 TYR B 80 13.746 9.576 5.952 1.00 22.96 C ATOM 2897 CE2 TYR B 80 13.896 7.887 7.655 1.00 26.99 C ATOM 2898 CZ TYR B 80 13.731 8.242 6.327 1.00 26.96 C ATOM 2899 OH TYR B 80 13.538 7.247 5.392 1.00 32.30 O ATOM 2900 HA TYR B 80 12.110 11.353 9.546 1.00 0.00 H ATOM 2901 HB3 TYR B 80 14.554 10.807 10.249 1.00 0.00 H ATOM 2902 HB2 TYR B 80 15.001 11.991 8.999 1.00 0.00 H ATOM 2903 HD2 TYR B 80 14.203 8.594 9.657 1.00 0.00 H ATOM 2904 HE2 TYR B 80 13.887 6.837 7.947 1.00 0.00 H ATOM 2905 HE1 TYR B 80 13.619 9.853 4.906 1.00 0.00 H ATOM 2906 HD1 TYR B 80 13.939 11.610 6.625 1.00 0.00 H ATOM 2907 HH TYR B 80 13.437 7.654 4.495 1.00 0.00 H ATOM 2908 H TYR B 80 13.546 13.719 8.358 1.00 0.00 H ATOM 2909 N ALA B 81 12.654 13.969 11.031 1.00 9.72 N ATOM 2910 CA ALA B 81 12.671 14.683 12.301 1.00 11.90 C ATOM 2911 C ALA B 81 11.423 15.532 12.515 1.00 10.99 C ATOM 2912 O ALA B 81 10.346 14.981 12.761 1.00 14.36 O ATOM 2913 CB ALA B 81 13.922 15.529 12.413 1.00 10.58 C ATOM 2914 HA ALA B 81 12.676 13.932 13.091 1.00 0.00 H ATOM 2915 HB1 ALA B 81 14.800 14.886 12.354 1.00 0.00 H ATOM 2916 HB2 ALA B 81 13.944 16.252 11.598 1.00 0.00 H ATOM 2917 HB3 ALA B 81 13.919 16.056 13.367 1.00 0.00 H ATOM 2918 H ALA B 81 12.381 14.475 10.164 1.00 0.00 H ATOM 2919 N TYR B 82 11.543 16.851 12.395 1.00 11.67 N ATOM 2920 CA TYR B 82 10.398 17.744 12.620 1.00 12.86 C ATOM 2921 C TYR B 82 9.760 18.366 11.383 1.00 14.30 C ATOM 2922 O TYR B 82 8.883 19.234 11.489 1.00 15.52 O ATOM 2923 CB TYR B 82 10.765 18.832 13.633 1.00 10.74 C ATOM 2924 CG TYR B 82 11.131 18.257 14.979 1.00 8.93 C ATOM 2925 CD1 TYR B 82 10.160 18.022 15.945 1.00 8.08 C ATOM 2926 CD2 TYR B 82 12.441 17.900 15.261 1.00 6.38 C ATOM 2927 CE1 TYR B 82 10.490 17.429 17.171 1.00 12.01 C ATOM 2928 CE2 TYR B 82 12.785 17.310 16.489 1.00 10.08 C ATOM 2929 CZ TYR B 82 11.807 17.078 17.428 1.00 8.30 C ATOM 2930 OH TYR B 82 12.143 16.477 18.613 1.00 8.98 O ATOM 2931 HA TYR B 82 9.623 17.085 13.011 1.00 0.00 H ATOM 2932 HB3 TYR B 82 9.912 19.500 13.756 1.00 0.00 H ATOM 2933 HB2 TYR B 82 11.615 19.397 13.249 1.00 0.00 H ATOM 2934 HD2 TYR B 82 13.217 18.080 14.517 1.00 0.00 H ATOM 2935 HE2 TYR B 82 13.820 17.038 16.696 1.00 0.00 H ATOM 2936 HE1 TYR B 82 9.717 17.245 17.917 1.00 0.00 H ATOM 2937 HD1 TYR B 82 9.126 18.303 15.746 1.00 0.00 H ATOM 2938 HH TYR B 82 11.333 16.382 19.175 1.00 0.00 H ATOM 2939 H TYR B 82 12.465 17.258 12.137 1.00 0.00 H ATOM 2940 N GLY B 83 10.202 17.930 10.214 1.00 14.58 N ATOM 2941 CA GLY B 83 9.631 18.424 8.978 1.00 14.92 C ATOM 2942 C GLY B 83 9.643 19.919 8.750 1.00 16.19 C ATOM 2943 O GLY B 83 10.457 20.665 9.299 1.00 17.21 O ATOM 2944 HA3 GLY B 83 8.592 18.097 8.945 1.00 0.00 H ATOM 2945 HA2 GLY B 83 10.182 17.964 8.157 1.00 0.00 H ATOM 2946 H GLY B 83 10.967 17.226 10.183 1.00 0.00 H ATOM 2947 N ALA B 84 8.697 20.368 7.936 1.00 17.18 N ATOM 2948 CA ALA B 84 8.576 21.766 7.570 1.00 18.68 C ATOM 2949 C ALA B 84 8.232 22.730 8.701 1.00 20.24 C ATOM 2950 O ALA B 84 8.680 23.876 8.691 1.00 24.56 O ATOM 2951 CB ALA B 84 7.572 21.905 6.429 1.00 18.80 C ATOM 2952 HA ALA B 84 9.577 22.068 7.262 1.00 0.00 H ATOM 2953 HB1 ALA B 84 7.919 21.331 5.570 1.00 0.00 H ATOM 2954 HB2 ALA B 84 6.602 21.527 6.752 1.00 0.00 H ATOM 2955 HB3 ALA B 84 7.480 22.956 6.153 1.00 0.00 H ATOM 2956 H ALA B 84 8.014 19.689 7.544 1.00 0.00 H ATOM 2957 N THR B 85 7.462 22.275 9.679 1.00 21.14 N ATOM 2958 CA THR B 85 7.043 23.135 10.784 1.00 24.00 C ATOM 2959 C THR B 85 8.036 23.286 11.935 1.00 24.01 C ATOM 2960 O THR B 85 8.139 24.360 12.549 1.00 23.74 O ATOM 2961 CB THR B 85 5.679 22.665 11.350 1.00 27.00 C ATOM 2962 OG1 THR B 85 5.764 21.286 11.748 1.00 29.75 O ATOM 2963 CG2 THR B 85 4.591 22.814 10.290 1.00 27.39 C ATOM 2964 HA THR B 85 6.972 24.124 10.332 1.00 0.00 H ATOM 2965 HB THR B 85 5.429 23.281 12.214 1.00 0.00 H ATOM 2966 HG1 THR B 85 6.001 20.731 10.963 1.00 0.00 H ATOM 2967 HG23 THR B 85 4.523 23.858 9.985 1.00 0.00 H ATOM 2968 HG21 THR B 85 4.840 22.198 9.426 1.00 0.00 H ATOM 2969 HG22 THR B 85 3.636 22.492 10.704 1.00 0.00 H ATOM 2970 H THR B 85 7.149 21.283 9.660 1.00 0.00 H ATOM 2971 N GLY B 86 8.783 22.224 12.212 1.00 21.61 N ATOM 2972 CA GLY B 86 9.726 22.265 13.312 1.00 22.26 C ATOM 2973 C GLY B 86 8.947 22.195 14.615 1.00 22.71 C ATOM 2974 O GLY B 86 7.879 21.583 14.670 1.00 23.04 O ATOM 2975 HA3 GLY B 86 10.297 23.193 13.273 1.00 0.00 H ATOM 2976 HA2 GLY B 86 10.408 21.417 13.244 1.00 0.00 H ATOM 2977 H GLY B 86 8.691 21.361 11.639 1.00 0.00 H ATOM 2978 N HIS B 87 9.493 22.776 15.673 1.00 23.29 N ATOM 2979 CA HIS B 87 8.823 22.795 16.974 1.00 24.76 C ATOM 2980 C HIS B 87 9.135 24.157 17.590 1.00 26.36 C ATOM 2981 O HIS B 87 10.266 24.427 17.973 1.00 22.95 O ATOM 2982 CB HIS B 87 9.315 21.651 17.876 1.00 21.73 C ATOM 2983 CG HIS B 87 8.620 21.583 19.202 1.00 18.71 C ATOM 2984 ND1 HIS B 87 7.641 20.657 19.479 1.00 18.95 N ATOM 2985 CD2 HIS B 87 8.779 22.313 20.332 1.00 19.96 C ATOM 2986 CE1 HIS B 87 7.226 20.816 20.724 1.00 19.52 C ATOM 2987 NE2 HIS B 87 7.902 21.814 21.262 1.00 19.46 N ATOM 2988 HA HIS B 87 7.749 22.647 16.863 1.00 0.00 H ATOM 2989 HB2 HIS B 87 9.153 20.708 17.354 1.00 0.00 H ATOM 2990 HB3 HIS B 87 10.382 21.788 18.054 1.00 0.00 H ATOM 2991 HD2 HIS B 87 9.473 23.141 20.476 1.00 0.00 H ATOM 2992 HE1 HIS B 87 6.457 20.224 21.221 1.00 0.00 H ATOM 2993 H HIS B 87 10.423 23.231 15.576 1.00 0.00 H ATOM 2994 N PRO B 88 8.112 25.012 17.731 1.00 30.47 N ATOM 2995 CA PRO B 88 8.217 26.364 18.288 1.00 31.28 C ATOM 2996 C PRO B 88 9.200 26.517 19.439 1.00 30.02 C ATOM 2997 O PRO B 88 9.103 25.813 20.445 1.00 31.52 O ATOM 2998 CB PRO B 88 6.778 26.668 18.725 1.00 33.58 C ATOM 2999 CG PRO B 88 6.156 25.292 18.910 1.00 34.60 C ATOM 3000 CD PRO B 88 6.703 24.582 17.706 1.00 32.88 C ATOM 3001 HA PRO B 88 8.622 27.058 17.552 1.00 0.00 H ATOM 3002 HD3 PRO B 88 6.614 23.500 17.806 1.00 0.00 H ATOM 3003 HD2 PRO B 88 6.204 24.904 16.792 1.00 0.00 H ATOM 3004 HG3 PRO B 88 5.067 25.336 18.892 1.00 0.00 H ATOM 3005 HG2 PRO B 88 6.484 24.823 19.838 1.00 0.00 H ATOM 3006 HB2 PRO B 88 6.766 27.229 19.660 1.00 0.00 H ATOM 3007 HB3 PRO B 88 6.250 27.233 17.957 1.00 0.00 H ATOM 3008 N GLY B 89 10.179 27.395 19.238 1.00 29.52 N ATOM 3009 CA GLY B 89 11.183 27.677 20.249 1.00 29.15 C ATOM 3010 C GLY B 89 12.355 26.721 20.387 1.00 28.48 C ATOM 3011 O GLY B 89 13.371 27.089 20.961 1.00 29.42 O ATOM 3012 HA3 GLY B 89 10.673 27.704 21.212 1.00 0.00 H ATOM 3013 HA2 GLY B 89 11.594 28.662 20.030 1.00 0.00 H ATOM 3014 H GLY B 89 10.227 27.896 18.328 1.00 0.00 H ATOM 3015 N ILE B 90 12.244 25.518 19.839 1.00 24.30 N ATOM 3016 CA ILE B 90 13.320 24.543 19.963 1.00 22.27 C ATOM 3017 C ILE B 90 13.967 24.139 18.639 1.00 18.65 C ATOM 3018 O ILE B 90 15.184 24.217 18.488 1.00 16.95 O ATOM 3019 CB ILE B 90 12.813 23.264 20.682 1.00 23.49 C ATOM 3020 CG1 ILE B 90 12.130 23.644 21.998 1.00 25.31 C ATOM 3021 CG2 ILE B 90 13.974 22.302 20.945 1.00 22.88 C ATOM 3022 CD1 ILE B 90 11.585 22.469 22.777 1.00 24.70 C ATOM 3023 HA ILE B 90 14.089 25.046 20.549 1.00 0.00 H ATOM 3024 HB ILE B 90 12.090 22.762 20.039 1.00 0.00 H ATOM 3025 HG12 ILE B 90 12.857 24.161 22.624 1.00 0.00 H ATOM 3026 HG13 ILE B 90 11.303 24.317 21.772 1.00 0.00 H ATOM 3027 HD11 ILE B 90 10.845 21.946 22.172 1.00 0.00 H ATOM 3028 HD12 ILE B 90 12.400 21.789 23.024 1.00 0.00 H ATOM 3029 HD13 ILE B 90 11.118 22.828 23.694 1.00 0.00 H ATOM 3030 HG21 ILE B 90 14.431 22.019 19.997 1.00 0.00 H ATOM 3031 HG22 ILE B 90 14.716 22.793 21.575 1.00 0.00 H ATOM 3032 HG23 ILE B 90 13.599 21.411 21.450 1.00 0.00 H ATOM 3033 H ILE B 90 11.381 25.268 19.316 1.00 0.00 H ATOM 3034 N ILE B 91 13.139 23.720 17.688 1.00 16.34 N ATOM 3035 CA ILE B 91 13.582 23.250 16.379 1.00 14.73 C ATOM 3036 C ILE B 91 13.016 24.138 15.271 1.00 15.33 C ATOM 3037 O ILE B 91 11.796 24.249 15.120 1.00 16.27 O ATOM 3038 CB ILE B 91 13.044 21.825 16.120 1.00 13.56 C ATOM 3039 CG1 ILE B 91 13.406 20.879 17.273 1.00 14.58 C ATOM 3040 CG2 ILE B 91 13.524 21.308 14.783 1.00 11.41 C ATOM 3041 CD1 ILE B 91 14.902 20.772 17.558 1.00 15.67 C ATOM 3042 HA ILE B 91 14.672 23.271 16.374 1.00 0.00 H ATOM 3043 HB ILE B 91 11.956 21.869 16.078 1.00 0.00 H ATOM 3044 HG12 ILE B 91 12.912 21.238 18.176 1.00 0.00 H ATOM 3045 HG13 ILE B 91 13.034 19.884 17.027 1.00 0.00 H ATOM 3046 HD11 ILE B 91 15.414 20.401 16.670 1.00 0.00 H ATOM 3047 HD12 ILE B 91 15.292 21.756 17.820 1.00 0.00 H ATOM 3048 HD13 ILE B 91 15.064 20.083 18.387 1.00 0.00 H ATOM 3049 HG21 ILE B 91 13.170 21.968 13.991 1.00 0.00 H ATOM 3050 HG22 ILE B 91 14.614 21.281 14.775 1.00 0.00 H ATOM 3051 HG23 ILE B 91 13.133 20.303 14.622 1.00 0.00 H ATOM 3052 H ILE B 91 12.118 23.727 17.887 1.00 0.00 H ATOM 3053 N PRO B 92 13.884 24.793 14.491 1.00 17.94 N ATOM 3054 CA PRO B 92 13.315 25.632 13.431 1.00 17.65 C ATOM 3055 C PRO B 92 12.763 24.803 12.276 1.00 17.67 C ATOM 3056 O PRO B 92 12.943 23.579 12.225 1.00 14.52 O ATOM 3057 CB PRO B 92 14.494 26.504 13.006 1.00 18.02 C ATOM 3058 CG PRO B 92 15.686 25.660 13.308 1.00 19.06 C ATOM 3059 CD PRO B 92 15.334 25.015 14.627 1.00 16.93 C ATOM 3060 HA PRO B 92 12.458 26.216 13.767 1.00 0.00 H ATOM 3061 HD3 PRO B 92 15.867 24.074 14.761 1.00 0.00 H ATOM 3062 HD2 PRO B 92 15.555 25.679 15.463 1.00 0.00 H ATOM 3063 HG3 PRO B 92 16.584 26.271 13.400 1.00 0.00 H ATOM 3064 HG2 PRO B 92 15.838 24.908 12.534 1.00 0.00 H ATOM 3065 HB2 PRO B 92 14.442 26.737 11.942 1.00 0.00 H ATOM 3066 HB3 PRO B 92 14.519 27.431 13.579 1.00 0.00 H ATOM 3067 N PRO B 93 11.979 25.441 11.393 1.00 18.03 N ATOM 3068 CA PRO B 93 11.398 24.758 10.235 1.00 17.27 C ATOM 3069 C PRO B 93 12.489 24.258 9.279 1.00 16.08 C ATOM 3070 O PRO B 93 13.532 24.898 9.118 1.00 13.68 O ATOM 3071 CB PRO B 93 10.541 25.860 9.586 1.00 19.91 C ATOM 3072 CG PRO B 93 11.166 27.150 10.080 1.00 20.81 C ATOM 3073 CD PRO B 93 11.467 26.819 11.504 1.00 17.47 C ATOM 3074 HA PRO B 93 10.826 23.869 10.499 1.00 0.00 H ATOM 3075 HD3 PRO B 93 12.220 27.490 11.917 1.00 0.00 H ATOM 3076 HD2 PRO B 93 10.568 26.860 12.120 1.00 0.00 H ATOM 3077 HG3 PRO B 93 10.468 27.984 10.005 1.00 0.00 H ATOM 3078 HG2 PRO B 93 12.075 27.388 9.527 1.00 0.00 H ATOM 3079 HB2 PRO B 93 10.588 25.798 8.499 1.00 0.00 H ATOM 3080 HB3 PRO B 93 9.503 25.784 9.908 1.00 0.00 H ATOM 3081 N HIS B 94 12.252 23.095 8.675 1.00 16.16 N ATOM 3082 CA HIS B 94 13.190 22.494 7.719 1.00 17.60 C ATOM 3083 C HIS B 94 14.589 22.255 8.300 1.00 17.11 C ATOM 3084 O HIS B 94 15.580 22.366 7.582 1.00 16.30 O ATOM 3085 CB HIS B 94 13.348 23.399 6.489 1.00 20.40 C ATOM 3086 CG HIS B 94 12.059 23.761 5.828 1.00 24.92 C ATOM 3087 ND1 HIS B 94 11.220 22.825 5.267 1.00 26.81 N ATOM 3088 CD2 HIS B 94 11.482 24.967 5.604 1.00 26.60 C ATOM 3089 CE1 HIS B 94 10.186 23.435 4.721 1.00 27.20 C ATOM 3090 NE2 HIS B 94 10.319 24.736 4.912 1.00 26.10 N ATOM 3091 HA HIS B 94 12.759 21.528 7.457 1.00 0.00 H ATOM 3092 HB2 HIS B 94 13.843 24.319 6.802 1.00 0.00 H ATOM 3093 HB3 HIS B 94 13.973 22.881 5.761 1.00 0.00 H ATOM 3094 HD2 HIS B 94 11.869 25.938 5.915 1.00 0.00 H ATOM 3095 HE1 HIS B 94 9.361 22.948 4.200 1.00 0.00 H ATOM 3096 H HIS B 94 11.367 22.592 8.889 1.00 0.00 H ATOM 3097 N ALA B 95 14.683 21.908 9.575 1.00 14.76 N ATOM 3098 CA ALA B 95 15.994 21.701 10.174 1.00 13.69 C ATOM 3099 C ALA B 95 16.575 20.293 10.095 1.00 13.16 C ATOM 3100 O ALA B 95 15.918 19.288 10.429 1.00 11.48 O ATOM 3101 CB ALA B 95 15.998 22.179 11.630 1.00 11.55 C ATOM 3102 HA ALA B 95 16.656 22.302 9.550 1.00 0.00 H ATOM 3103 HB1 ALA B 95 15.756 23.241 11.663 1.00 0.00 H ATOM 3104 HB2 ALA B 95 15.255 21.618 12.197 1.00 0.00 H ATOM 3105 HB3 ALA B 95 16.986 22.017 12.062 1.00 0.00 H ATOM 3106 H ALA B 95 13.823 21.784 10.146 1.00 0.00 H ATOM 3107 N THR B 96 17.793 20.218 9.570 1.00 14.62 N ATOM 3108 CA THR B 96 18.512 18.959 9.537 1.00 14.54 C ATOM 3109 C THR B 96 19.150 18.983 10.937 1.00 11.21 C ATOM 3110 O THR B 96 19.642 20.027 11.383 1.00 9.62 O ATOM 3111 CB THR B 96 19.597 18.942 8.424 1.00 15.48 C ATOM 3112 OG1 THR B 96 18.960 18.752 7.157 1.00 16.11 O ATOM 3113 CG2 THR B 96 20.598 17.811 8.653 1.00 13.24 C ATOM 3114 HA THR B 96 17.895 18.087 9.321 1.00 0.00 H ATOM 3115 HB THR B 96 20.134 19.890 8.446 1.00 0.00 H ATOM 3116 HG1 THR B 96 18.325 19.493 6.994 1.00 0.00 H ATOM 3117 HG23 THR B 96 21.087 17.950 9.617 1.00 0.00 H ATOM 3118 HG21 THR B 96 20.073 16.856 8.645 1.00 0.00 H ATOM 3119 HG22 THR B 96 21.346 17.823 7.860 1.00 0.00 H ATOM 3120 H THR B 96 18.237 21.073 9.178 1.00 0.00 H ATOM 3121 N LEU B 97 19.050 17.871 11.654 1.00 9.03 N ATOM 3122 CA LEU B 97 19.588 17.765 13.005 1.00 6.72 C ATOM 3123 C LEU B 97 20.767 16.803 13.099 1.00 7.60 C ATOM 3124 O LEU B 97 20.769 15.750 12.482 1.00 7.58 O ATOM 3125 CB LEU B 97 18.500 17.271 13.961 1.00 6.93 C ATOM 3126 CG LEU B 97 17.241 18.121 14.088 1.00 9.34 C ATOM 3127 CD1 LEU B 97 16.220 17.371 14.876 1.00 11.67 C ATOM 3128 CD2 LEU B 97 17.578 19.430 14.761 1.00 10.92 C ATOM 3129 HA LEU B 97 19.935 18.762 13.277 1.00 0.00 H ATOM 3130 HB2 LEU B 97 18.194 16.280 13.625 1.00 0.00 H ATOM 3131 HB3 LEU B 97 18.945 17.195 14.953 1.00 0.00 H ATOM 3132 HG LEU B 97 16.836 18.336 13.099 1.00 0.00 H ATOM 3133 HD21 LEU B 97 17.984 19.233 15.753 1.00 0.00 H ATOM 3134 HD22 LEU B 97 18.317 19.964 14.164 1.00 0.00 H ATOM 3135 HD23 LEU B 97 16.675 20.034 14.850 1.00 0.00 H ATOM 3136 HD11 LEU B 97 15.982 16.438 14.365 1.00 0.00 H ATOM 3137 HD12 LEU B 97 16.616 17.153 15.868 1.00 0.00 H ATOM 3138 HD13 LEU B 97 15.318 17.976 14.969 1.00 0.00 H ATOM 3139 H LEU B 97 18.571 17.047 11.238 1.00 0.00 H ATOM 3140 N VAL B 98 21.745 17.159 13.914 1.00 8.47 N ATOM 3141 CA VAL B 98 22.919 16.324 14.132 1.00 7.83 C ATOM 3142 C VAL B 98 22.943 15.972 15.617 1.00 6.12 C ATOM 3143 O VAL B 98 22.861 16.851 16.462 1.00 7.81 O ATOM 3144 CB VAL B 98 24.207 17.091 13.756 1.00 8.73 C ATOM 3145 CG1 VAL B 98 25.412 16.255 14.064 1.00 9.87 C ATOM 3146 CG2 VAL B 98 24.183 17.453 12.272 1.00 10.44 C ATOM 3147 HA VAL B 98 22.873 15.428 13.513 1.00 0.00 H ATOM 3148 HB VAL B 98 24.258 18.008 14.343 1.00 0.00 H ATOM 3149 HG11 VAL B 98 25.430 16.024 15.129 1.00 0.00 H ATOM 3150 HG12 VAL B 98 25.366 15.329 13.491 1.00 0.00 H ATOM 3151 HG13 VAL B 98 26.313 16.806 13.795 1.00 0.00 H ATOM 3152 HG21 VAL B 98 24.121 16.541 11.678 1.00 0.00 H ATOM 3153 HG22 VAL B 98 23.317 18.082 12.067 1.00 0.00 H ATOM 3154 HG23 VAL B 98 25.095 17.993 12.016 1.00 0.00 H ATOM 3155 H VAL B 98 21.674 18.066 14.417 1.00 0.00 H ATOM 3156 N PHE B 99 22.962 14.686 15.937 1.00 6.36 N ATOM 3157 CA PHE B 99 22.988 14.253 17.325 1.00 7.56 C ATOM 3158 C PHE B 99 24.266 13.470 17.656 1.00 9.53 C ATOM 3159 O PHE B 99 24.693 12.605 16.891 1.00 10.81 O ATOM 3160 CB PHE B 99 21.806 13.330 17.634 1.00 6.01 C ATOM 3161 CG PHE B 99 20.486 14.021 17.744 1.00 10.29 C ATOM 3162 CD1 PHE B 99 19.708 14.253 16.613 1.00 9.89 C ATOM 3163 CD2 PHE B 99 19.964 14.346 18.997 1.00 10.98 C ATOM 3164 CE1 PHE B 99 18.419 14.794 16.729 1.00 11.42 C ATOM 3165 CE2 PHE B 99 18.671 14.886 19.126 1.00 11.82 C ATOM 3166 CZ PHE B 99 17.901 15.108 17.986 1.00 9.65 C ATOM 3167 HA PHE B 99 22.940 15.162 17.924 1.00 0.00 H ATOM 3168 HB2 PHE B 99 21.736 12.589 16.838 1.00 0.00 H ATOM 3169 HB3 PHE B 99 22.006 12.827 18.580 1.00 0.00 H ATOM 3170 HD2 PHE B 99 20.567 14.179 19.889 1.00 0.00 H ATOM 3171 HE2 PHE B 99 18.274 15.129 20.112 1.00 0.00 H ATOM 3172 HZ PHE B 99 16.898 15.525 18.076 1.00 0.00 H ATOM 3173 HE1 PHE B 99 17.821 14.970 15.835 1.00 0.00 H ATOM 3174 HD1 PHE B 99 20.105 14.012 15.627 1.00 0.00 H ATOM 3175 H PHE B 99 22.958 13.972 15.180 1.00 0.00 H ATOM 3176 N ASP B 100 24.858 13.782 18.804 1.00 8.56 N ATOM 3177 CA ASP B 100 26.016 13.077 19.310 1.00 8.88 C ATOM 3178 C ASP B 100 25.319 12.156 20.321 1.00 9.94 C ATOM 3179 O ASP B 100 24.777 12.620 21.327 1.00 9.95 O ATOM 3180 CB ASP B 100 26.944 14.078 19.998 1.00 8.48 C ATOM 3181 CG ASP B 100 28.199 13.441 20.573 1.00 13.49 C ATOM 3182 OD1 ASP B 100 28.274 12.204 20.719 1.00 14.23 O ATOM 3183 OD2 ASP B 100 29.114 14.202 20.910 1.00 15.77 O ATOM 3184 HA ASP B 100 26.637 12.557 18.581 1.00 0.00 H ATOM 3185 HB2 ASP B 100 27.242 14.831 19.269 1.00 0.00 H ATOM 3186 HB3 ASP B 100 26.396 14.556 20.810 1.00 0.00 H ATOM 3187 H ASP B 100 24.472 14.568 19.364 1.00 0.00 H ATOM 3188 N VAL B 101 25.300 10.856 20.049 1.00 10.39 N ATOM 3189 CA VAL B 101 24.599 9.930 20.929 1.00 9.88 C ATOM 3190 C VAL B 101 25.492 8.827 21.446 1.00 10.88 C ATOM 3191 O VAL B 101 26.296 8.258 20.703 1.00 8.81 O ATOM 3192 CB VAL B 101 23.385 9.244 20.199 1.00 10.84 C ATOM 3193 CG1 VAL B 101 22.581 8.385 21.169 1.00 8.31 C ATOM 3194 CG2 VAL B 101 22.477 10.286 19.561 1.00 9.24 C ATOM 3195 HA VAL B 101 24.253 10.540 21.763 1.00 0.00 H ATOM 3196 HB VAL B 101 23.790 8.603 19.416 1.00 0.00 H ATOM 3197 HG11 VAL B 101 23.224 7.609 21.584 1.00 0.00 H ATOM 3198 HG12 VAL B 101 22.198 9.011 21.975 1.00 0.00 H ATOM 3199 HG13 VAL B 101 21.748 7.923 20.639 1.00 0.00 H ATOM 3200 HG21 VAL B 101 22.092 10.952 20.333 1.00 0.00 H ATOM 3201 HG22 VAL B 101 23.045 10.863 18.832 1.00 0.00 H ATOM 3202 HG23 VAL B 101 21.646 9.786 19.063 1.00 0.00 H ATOM 3203 H VAL B 101 25.788 10.497 19.204 1.00 0.00 H ATOM 3204 N GLU B 102 25.338 8.516 22.721 1.00 9.18 N ATOM 3205 CA GLU B 102 26.092 7.436 23.309 1.00 11.61 C ATOM 3206 C GLU B 102 25.114 6.447 23.931 1.00 10.93 C ATOM 3207 O GLU B 102 24.304 6.820 24.793 1.00 8.99 O ATOM 3208 CB GLU B 102 27.084 7.956 24.356 1.00 15.01 C ATOM 3209 CG GLU B 102 27.766 6.801 25.074 1.00 23.09 C ATOM 3210 CD GLU B 102 28.940 7.205 25.948 1.00 29.04 C ATOM 3211 OE1 GLU B 102 29.138 8.428 26.176 1.00 31.61 O ATOM 3212 OE2 GLU B 102 29.663 6.277 26.396 1.00 24.71 O ATOM 3213 HA GLU B 102 26.678 6.939 22.535 1.00 0.00 H ATOM 3214 HB2 GLU B 102 27.840 8.566 23.861 1.00 0.00 H ATOM 3215 HB3 GLU B 102 26.549 8.564 25.085 1.00 0.00 H ATOM 3216 HG2 GLU B 102 27.026 6.308 25.705 1.00 0.00 H ATOM 3217 HG3 GLU B 102 28.127 6.099 24.323 1.00 0.00 H ATOM 3218 H GLU B 102 24.667 9.055 23.306 1.00 0.00 H ATOM 3219 N LEU B 103 25.137 5.200 23.463 1.00 8.64 N ATOM 3220 CA LEU B 103 24.242 4.176 24.016 1.00 11.02 C ATOM 3221 C LEU B 103 24.910 3.563 25.253 1.00 11.57 C ATOM 3222 O LEU B 103 25.838 2.765 25.142 1.00 13.02 O ATOM 3223 CB LEU B 103 23.925 3.086 22.983 1.00 10.17 C ATOM 3224 CG LEU B 103 22.981 1.940 23.397 1.00 10.91 C ATOM 3225 CD1 LEU B 103 21.634 2.448 23.921 1.00 12.36 C ATOM 3226 CD2 LEU B 103 22.771 1.015 22.219 1.00 12.61 C ATOM 3227 HA LEU B 103 23.295 4.641 24.290 1.00 0.00 H ATOM 3228 HB2 LEU B 103 23.476 3.579 22.121 1.00 0.00 H ATOM 3229 HB3 LEU B 103 24.872 2.634 22.689 1.00 0.00 H ATOM 3230 HG LEU B 103 23.453 1.401 24.218 1.00 0.00 H ATOM 3231 HD21 LEU B 103 22.328 1.574 21.394 1.00 0.00 H ATOM 3232 HD22 LEU B 103 23.731 0.603 21.906 1.00 0.00 H ATOM 3233 HD23 LEU B 103 22.104 0.204 22.510 1.00 0.00 H ATOM 3234 HD11 LEU B 103 21.800 3.079 24.795 1.00 0.00 H ATOM 3235 HD12 LEU B 103 21.138 3.027 23.142 1.00 0.00 H ATOM 3236 HD13 LEU B 103 21.010 1.599 24.198 1.00 0.00 H ATOM 3237 H LEU B 103 25.796 4.949 22.698 1.00 0.00 H ATOM 3238 N LEU B 104 24.376 3.893 26.416 1.00 12.65 N ATOM 3239 CA LEU B 104 24.935 3.452 27.689 1.00 15.99 C ATOM 3240 C LEU B 104 24.548 2.049 28.113 1.00 15.35 C ATOM 3241 O LEU B 104 25.393 1.306 28.605 1.00 16.58 O ATOM 3242 CB LEU B 104 24.571 4.459 28.792 1.00 19.16 C ATOM 3243 CG LEU B 104 24.759 5.955 28.465 1.00 22.08 C ATOM 3244 CD1 LEU B 104 24.088 6.800 29.536 1.00 22.52 C ATOM 3245 CD2 LEU B 104 26.237 6.339 28.339 1.00 24.48 C ATOM 3246 HA LEU B 104 26.013 3.413 27.536 1.00 0.00 H ATOM 3247 HB2 LEU B 104 23.521 4.307 29.043 1.00 0.00 H ATOM 3248 HB3 LEU B 104 25.188 4.232 29.661 1.00 0.00 H ATOM 3249 HG LEU B 104 24.294 6.144 27.498 1.00 0.00 H ATOM 3250 HD21 LEU B 104 26.747 6.131 29.280 1.00 0.00 H ATOM 3251 HD22 LEU B 104 26.695 5.757 27.540 1.00 0.00 H ATOM 3252 HD23 LEU B 104 26.317 7.401 28.108 1.00 0.00 H ATOM 3253 HD11 LEU B 104 23.024 6.567 29.567 1.00 0.00 H ATOM 3254 HD12 LEU B 104 24.538 6.581 30.504 1.00 0.00 H ATOM 3255 HD13 LEU B 104 24.223 7.856 29.301 1.00 0.00 H ATOM 3256 H LEU B 104 23.524 4.490 26.424 1.00 0.00 H ATOM 3257 N LYS B 105 23.276 1.697 27.953 1.00 14.89 N ATOM 3258 CA LYS B 105 22.793 0.372 28.332 1.00 17.90 C ATOM 3259 C LYS B 105 21.380 0.083 27.840 1.00 16.19 C ATOM 3260 O LYS B 105 20.720 0.956 27.291 1.00 15.81 O ATOM 3261 CB LYS B 105 22.863 0.190 29.853 1.00 19.88 C ATOM 3262 CG LYS B 105 22.178 1.273 30.650 1.00 23.17 C ATOM 3263 CD LYS B 105 22.231 0.978 32.131 1.00 27.62 C ATOM 3264 CE LYS B 105 21.422 -0.270 32.445 1.00 35.39 C ATOM 3265 NZ LYS B 105 21.530 -0.676 33.880 1.00 40.33 N ATOM 3266 HA LYS B 105 23.452 -0.345 27.842 1.00 0.00 H ATOM 3267 HB2 LYS B 105 22.396 -0.763 30.103 1.00 0.00 H ATOM 3268 HB3 LYS B 105 23.913 0.166 30.144 1.00 0.00 H ATOM 3269 HG2 LYS B 105 22.675 2.224 30.459 1.00 0.00 H ATOM 3270 HG3 LYS B 105 21.136 1.340 30.338 1.00 0.00 H ATOM 3271 HD2 LYS B 105 23.267 0.821 32.431 1.00 0.00 H ATOM 3272 HD3 LYS B 105 21.819 1.823 32.682 1.00 0.00 H ATOM 3273 HE2 LYS B 105 21.784 -1.088 31.822 1.00 0.00 H ATOM 3274 HE3 LYS B 105 20.375 -0.075 32.214 1.00 0.00 H ATOM 3275 HZ1 LYS B 105 22.525 -0.872 34.109 1.00 0.00 H ATOM 3276 HZ2 LYS B 105 21.179 0.094 34.484 1.00 0.00 H ATOM 3277 HZ3 LYS B 105 20.960 -1.531 34.041 1.00 0.00 H ATOM 3278 H LYS B 105 22.608 2.383 27.547 1.00 0.00 H ATOM 3279 N LEU B 106 20.946 -1.163 27.976 1.00 17.33 N ATOM 3280 CA LEU B 106 19.604 -1.553 27.571 1.00 20.52 C ATOM 3281 C LEU B 106 18.954 -2.163 28.805 1.00 23.30 C ATOM 3282 O LEU B 106 19.632 -2.811 29.599 1.00 25.08 O ATOM 3283 CB LEU B 106 19.636 -2.591 26.439 1.00 18.15 C ATOM 3284 CG LEU B 106 20.264 -2.221 25.094 1.00 19.48 C ATOM 3285 CD1 LEU B 106 20.304 -3.423 24.170 1.00 20.17 C ATOM 3286 CD2 LEU B 106 19.487 -1.101 24.466 1.00 16.38 C ATOM 3287 HA LEU B 106 19.053 -0.691 27.195 1.00 0.00 H ATOM 3288 HB2 LEU B 106 20.182 -3.456 26.817 1.00 0.00 H ATOM 3289 HB3 LEU B 106 18.603 -2.874 26.239 1.00 0.00 H ATOM 3290 HG LEU B 106 21.290 -1.893 25.263 1.00 0.00 H ATOM 3291 HD21 LEU B 106 18.456 -1.419 24.310 1.00 0.00 H ATOM 3292 HD22 LEU B 106 19.505 -0.233 25.126 1.00 0.00 H ATOM 3293 HD23 LEU B 106 19.937 -0.840 23.508 1.00 0.00 H ATOM 3294 HD11 LEU B 106 20.897 -4.214 24.630 1.00 0.00 H ATOM 3295 HD12 LEU B 106 19.289 -3.781 23.998 1.00 0.00 H ATOM 3296 HD13 LEU B 106 20.755 -3.135 23.220 1.00 0.00 H ATOM 3297 H LEU B 106 21.581 -1.879 28.382 1.00 0.00 H ATOM 3298 N GLU B 107 17.660 -1.936 28.976 1.00 26.08 N ATOM 3299 CA GLU B 107 16.921 -2.483 30.110 1.00 28.90 C ATOM 3300 C GLU B 107 15.443 -2.617 29.745 1.00 30.14 C ATOM 3301 O GLU B 107 15.124 -2.566 28.539 1.00 30.36 O ATOM 3302 CB GLU B 107 17.101 -1.600 31.350 1.00 28.50 C ATOM 3303 CG GLU B 107 16.688 -0.152 31.150 1.00 31.34 C ATOM 3304 CD GLU B 107 17.041 0.748 32.321 1.00 32.15 C ATOM 3305 OE1 GLU B 107 18.150 0.623 32.878 1.00 32.55 O ATOM 3306 OE2 GLU B 107 16.211 1.609 32.668 1.00 33.89 O ATOM 3307 HA GLU B 107 17.314 -3.472 30.347 1.00 0.00 H ATOM 3308 OXT GLU B 107 14.610 -2.785 30.655 1.00 35.85 O ATOM 3309 HB2 GLU B 107 16.500 -2.018 32.158 1.00 0.00 H ATOM 3310 HB3 GLU B 107 18.153 -1.619 31.634 1.00 0.00 H ATOM 3311 HG2 GLU B 107 17.187 0.229 30.259 1.00 0.00 H ATOM 3312 HG3 GLU B 107 15.609 -0.118 31.002 1.00 0.00 H ATOM 3313 H GLU B 107 17.155 -1.350 28.281 1.00 0.00 H TER 3314 GLU B 107 HETATM 3315 O HOH 1 -7.077 7.872 3.712 1.00 15.24 O HETATM 3316 O HOH 2 -6.384 11.403 10.501 1.00 20.95 O HETATM 3317 O HOH 3 -0.988 5.589 10.719 1.00 19.58 O HETATM 3318 O HOH 4 -8.780 -4.511 10.423 1.00 15.35 O HETATM 3319 O HOH 5 5.821 10.973 -2.552 1.00 20.81 O HETATM 3320 O HOH 6 -1.389 0.381 -13.879 1.00 19.55 O HETATM 3321 O HOH 7 7.218 12.775 -4.276 1.00 25.04 O HETATM 3322 O HOH 8 -11.359 -4.410 9.220 1.00 19.31 O HETATM 3323 O HOH 9 -1.528 11.530 5.293 1.00 22.57 O HETATM 3324 O HOH 10 12.042 3.143 -12.733 1.00 22.14 O HETATM 3325 O HOH 11 3.669 -10.514 -8.026 1.00 27.74 O HETATM 3326 O HOH 12 1.247 -7.751 -10.505 1.00 28.33 O HETATM 3327 O HOH 13 0.521 16.226 -3.740 1.00 27.09 O HETATM 3328 O HOH 14 5.264 -9.001 -6.480 1.00 32.96 O HETATM 3329 O HOH 15 0.926 -5.613 12.230 1.00 29.00 O HETATM 3330 O HOH 16 2.683 -6.396 -8.970 1.00 34.23 O HETATM 3331 O HOH 17 -5.271 -11.277 -9.415 1.00 40.40 O HETATM 3332 O HOH 18 -3.744 -15.268 4.900 1.00 28.89 O HETATM 3333 O HOH 19 -9.557 -14.915 7.752 1.00 38.76 O HETATM 3334 O HOH 20 -6.944 11.446 0.721 1.00 32.99 O HETATM 3335 O HOH 21 -6.819 1.600 11.338 1.00 21.59 O HETATM 3336 O HOH 22 -11.036 -11.747 5.823 1.00 34.21 O HETATM 3337 O HOH 23 12.566 14.576 0.828 1.00 27.35 O HETATM 3338 O HOH 24 9.569 6.126 1.958 1.00 24.67 O HETATM 3339 O HOH 25 -7.626 -0.817 10.173 1.00 33.75 O HETATM 3340 O HOH 26 -0.370 12.151 7.821 1.00 29.68 O HETATM 3341 O HOH 27 2.136 17.035 -0.868 1.00 31.44 O HETATM 3342 O HOH 28 -0.803 -15.334 10.164 1.00 41.55 O HETATM 3343 O HOH 29 -6.247 8.159 -14.586 1.00 27.33 O HETATM 3344 O HOH 30 3.395 -16.227 7.225 1.00 31.32 O HETATM 3345 O HOH 31 8.128 14.293 8.704 1.00 44.07 O HETATM 3346 O HOH 32 12.032 4.901 1.384 1.00 37.36 O HETATM 3347 O HOH 33 -4.698 -9.082 -11.903 1.00 37.60 O HETATM 3348 O HOH 34 15.236 -6.239 2.127 1.00 40.22 O HETATM 3349 O HOH 35 -8.091 -6.956 -7.289 1.00 40.28 O HETATM 3350 O HOH 36 7.544 -11.626 13.389 1.00 26.27 O HETATM 3351 O HOH 37 7.333 -3.348 9.504 1.00 37.71 O HETATM 3352 O HOH 38 13.709 18.650 11.756 1.00 17.41 O HETATM 3353 O HOH 39 12.275 21.144 11.304 1.00 15.92 O HETATM 3354 O HOH 40 20.846 21.439 26.963 1.00 23.46 O HETATM 3355 O HOH 41 26.933 0.646 14.362 1.00 30.30 O HETATM 3356 O HOH 42 28.222 -1.356 16.672 1.00 23.17 O HETATM 3357 O HOH 43 15.740 10.128 32.128 1.00 26.73 O HETATM 3358 O HOH 44 20.495 4.551 8.168 1.00 21.65 O HETATM 3359 O HOH 45 7.456 22.009 24.159 1.00 29.21 O HETATM 3360 O HOH 46 23.992 13.777 33.275 1.00 27.47 O HETATM 3361 O HOH 47 20.764 12.345 6.656 1.00 28.67 O HETATM 3362 O HOH 48 30.509 -1.798 25.544 1.00 33.32 O HETATM 3363 O HOH 49 17.736 21.040 6.101 1.00 30.89 O HETATM 3364 O HOH 50 5.149 4.772 24.970 1.00 26.37 O HETATM 3365 O HOH 51 30.613 -0.223 17.328 1.00 21.32 O HETATM 3366 O HOH 52 5.781 19.119 9.415 1.00 40.49 O HETATM 3367 O HOH 53 32.767 3.676 23.800 1.00 42.07 O HETATM 3368 O HOH 54 17.598 13.611 30.566 1.00 35.76 O HETATM 3369 O HOH 55 24.468 -2.242 12.698 1.00 38.36 O HETATM 3370 O HOH 56 18.949 22.846 8.360 1.00 34.30 O HETATM 3371 O HOH 57 20.056 22.711 10.827 1.00 36.10 O HETATM 3372 O HOH 58 15.165 13.074 30.010 1.00 48.20 O HETATM 3373 O HOH 59 32.672 8.472 25.283 1.00 32.70 O HETATM 3374 O HOH 60 25.937 26.401 20.582 1.00 27.69 O HETATM 3375 O HOH 61 10.004 12.097 13.098 1.00 33.92 O HETATM 3376 O HOH 62 17.752 6.492 6.355 1.00 24.61 O HETATM 3377 O HOH 63 17.065 25.963 19.269 1.00 38.53 O HETATM 3378 O HOH 64 16.927 20.531 28.859 1.00 46.08 O HETATM 3379 O HOH 65 27.976 11.661 28.521 1.00 37.15 O HETATM 3380 O HOH 66 26.464 14.150 32.483 1.00 39.75 O HETATM 3381 O HOH 67 26.554 16.083 9.747 1.00 31.22 O HETATM 3382 O HOH 68 18.559 -3.152 16.641 1.00 34.25 O HETATM 3383 O HOH 69 6.765 18.691 7.057 1.00 38.01 O HETATM 3384 C1 AP A 1 6.513 1.185 -3.420 1.00 0.26 C HETATM 3385 O44 AP A 1 7.090 1.230 -2.348 1.00 -0.37 O HETATM 3386 O43 AP A 1 7.084 0.851 -4.599 1.00 -0.26 O HETATM 3387 C26 AP A 1 8.495 0.496 -4.640 1.00 0.12 C HETATM 3388 C27 AP A 1 9.322 1.481 -5.512 1.00 -0.00 C HETATM 3389 C28 AP A 1 10.829 1.484 -5.166 1.00 -0.02 C HETATM 3390 C29 AP A 1 11.183 1.661 -3.681 1.00 -0.06 C HETATM 3391 C34 AP A 1 11.389 0.579 -2.811 1.00 -0.08 C HETATM 3392 C33 AP A 1 11.716 0.782 -1.467 1.00 -0.05 C HETATM 3393 C32 AP A 1 11.843 2.083 -0.964 1.00 0.11 C HETATM 3394 C31 AP A 1 11.638 3.175 -1.822 1.00 0.11 C HETATM 3395 C30 AP A 1 11.310 2.957 -3.173 1.00 -0.04 C HETATM 3396 H35 AP A 1 11.154 3.806 -3.829 1.00 0.04 H HETATM 3397 O49 AP A 1 11.773 4.468 -1.287 1.00 -0.33 O HETATM 3398 C42 AP A 1 11.123 5.595 -1.892 1.00 0.06 C HETATM 3399 H41 AP A 1 11.358 6.505 -1.320 1.00 0.06 H HETATM 3400 H42 AP A 1 10.035 5.434 -1.893 1.00 0.06 H HETATM 3401 H43 AP A 1 11.478 5.711 -2.927 1.00 0.06 H HETATM 3402 O50 AP A 1 12.173 2.351 0.376 1.00 -0.33 O HETATM 3403 C21 AP A 1 12.477 1.283 1.296 1.00 0.06 C HETATM 3404 H24 AP A 1 12.707 1.706 2.285 1.00 0.06 H HETATM 3405 H25 AP A 1 13.346 0.718 0.928 1.00 0.06 H HETATM 3406 H26 AP A 1 11.610 0.611 1.377 1.00 0.06 H HETATM 3407 H36 AP A 1 11.871 -0.069 -0.813 1.00 0.05 H HETATM 3408 H37 AP A 1 11.293 -0.433 -3.188 1.00 0.04 H HETATM 3409 H33 AP A 1 11.300 2.307 -5.724 1.00 0.04 H HETATM 3410 H34 AP A 1 11.252 0.525 -5.500 1.00 0.04 H HETATM 3411 H31 AP A 1 8.927 2.497 -5.362 1.00 0.03 H HETATM 3412 H32 AP A 1 9.207 1.195 -6.568 1.00 0.03 H HETATM 3413 C25 AP A 1 8.489 -0.942 -5.189 1.00 -0.02 C HETATM 3414 C41 AP A 1 8.677 -2.024 -4.310 1.00 -0.03 C HETATM 3415 C35 AP A 1 8.650 -3.363 -4.768 1.00 0.09 C HETATM 3416 C24 AP A 1 8.432 -3.613 -6.139 1.00 -0.04 C HETATM 3417 C23 AP A 1 8.248 -2.546 -7.022 1.00 -0.08 C HETATM 3418 C22 AP A 1 8.275 -1.225 -6.544 1.00 -0.07 C HETATM 3419 H27 AP A 1 8.127 -0.407 -7.239 1.00 0.05 H HETATM 3420 H28 AP A 1 8.084 -2.737 -8.076 1.00 0.06 H HETATM 3421 H29 AP A 1 8.407 -4.632 -6.507 1.00 0.05 H HETATM 3422 O36 AP A 1 8.819 -4.413 -3.828 1.00 -0.31 O HETATM 3423 C37 AP A 1 9.996 -5.251 -3.722 1.00 0.12 C HETATM 3424 C38 AP A 1 10.453 -5.672 -5.103 1.00 0.07 C HETATM 3425 O40 AP A 1 9.761 -6.539 -5.726 1.00 -0.57 O HETATM 3426 O39 AP A 1 11.500 -5.149 -5.578 1.00 -0.57 O HETATM 3427 H38 AP A 1 9.755 -6.146 -3.129 1.00 0.08 H HETATM 3428 H39 AP A 1 10.801 -4.689 -3.227 1.00 0.08 H HETATM 3429 H40 AP A 1 8.847 -1.828 -3.257 1.00 0.05 H HETATM 3430 H30 AP A 1 8.915 0.504 -3.623 1.00 0.08 H HETATM 3431 C2 AP A 1 5.016 1.505 -3.487 1.00 0.15 C HETATM 3432 N7 AP A 1 4.532 1.344 -4.900 1.00 -0.25 N HETATM 3433 C6 AP A 1 4.310 -0.050 -5.423 1.00 0.04 C HETATM 3434 C5 AP A 1 3.439 -0.885 -4.463 1.00 -0.03 C HETATM 3435 C4 AP A 1 4.006 -0.790 -3.025 1.00 -0.05 C HETATM 3436 C3 AP A 1 4.072 0.701 -2.558 1.00 -0.01 C HETATM 3437 H2 AP A 1 3.064 1.139 -2.595 1.00 0.03 H HETATM 3438 H3 AP A 1 4.452 0.743 -1.527 1.00 0.03 H HETATM 3439 H4 AP A 1 3.355 -1.355 -2.341 1.00 0.03 H HETATM 3440 H5 AP A 1 5.018 -1.220 -3.006 1.00 0.03 H HETATM 3441 H6 AP A 1 2.409 -0.500 -4.476 1.00 0.03 H HETATM 3442 H7 AP A 1 3.442 -1.936 -4.788 1.00 0.03 H HETATM 3443 H8 AP A 1 3.807 0.011 -6.399 1.00 0.05 H HETATM 3444 H9 AP A 1 5.285 -0.546 -5.543 1.00 0.05 H HETATM 3445 C8 AP A 1 4.486 2.400 -5.752 1.00 0.19 C HETATM 3446 O45 AP A 1 4.763 3.522 -5.386 1.00 -0.39 O HETATM 3447 C9 AP A 1 4.074 2.186 -7.208 1.00 0.07 C HETATM 3448 C46 AP A 1 3.447 3.482 -7.806 1.00 -0.03 C HETATM 3449 C16 AP A 1 2.059 3.782 -7.182 1.00 -0.06 C HETATM 3450 H12 AP A 1 1.648 4.700 -7.626 1.00 0.02 H HETATM 3451 H13 AP A 1 2.167 3.917 -6.096 1.00 0.02 H HETATM 3452 H14 AP A 1 1.378 2.942 -7.382 1.00 0.02 H HETATM 3453 H44 AP A 1 3.330 3.354 -8.892 1.00 0.03 H HETATM 3454 H45 AP A 1 4.119 4.329 -7.606 1.00 0.03 H HETATM 3455 C10 AP A 1 5.278 1.712 -8.025 1.00 -0.05 C HETATM 3456 C47 AP A 1 5.251 0.469 -8.663 1.00 -0.05 C HETATM 3457 C14 AP A 1 6.375 0.000 -9.355 1.00 0.11 C HETATM 3458 C13 AP A 1 7.542 0.797 -9.414 1.00 0.14 C HETATM 3459 C12 AP A 1 7.581 2.046 -8.794 1.00 0.11 C HETATM 3460 C11 AP A 1 6.436 2.506 -8.108 1.00 -0.05 C HETATM 3461 H11 AP A 1 6.449 3.483 -7.639 1.00 0.04 H HETATM 3462 O17 AP A 1 8.746 2.808 -8.868 1.00 -0.33 O HETATM 3463 C20 AP A 1 8.810 4.097 -8.231 1.00 0.06 C HETATM 3464 H21 AP A 1 9.802 4.540 -8.400 1.00 0.06 H HETATM 3465 H22 AP A 1 8.639 3.981 -7.151 1.00 0.06 H HETATM 3466 H23 AP A 1 8.037 4.755 -8.656 1.00 0.06 H HETATM 3467 O48 AP A 1 8.671 0.342 -10.096 1.00 -0.33 O HETATM 3468 C19 AP A 1 8.706 0.692 -11.494 1.00 0.05 C HETATM 3469 H18 AP A 1 9.626 0.295 -11.948 1.00 0.06 H HETATM 3470 H19 AP A 1 8.689 1.787 -11.598 1.00 0.06 H HETATM 3471 H20 AP A 1 7.830 0.261 -12.002 1.00 0.06 H HETATM 3472 O15 AP A 1 6.352 -1.240 -9.981 1.00 -0.33 O HETATM 3473 C18 AP A 1 5.322 -2.190 -9.656 1.00 0.06 C HETATM 3474 H15 AP A 1 5.468 -3.106 -10.248 1.00 0.06 H HETATM 3475 H16 AP A 1 4.338 -1.757 -9.887 1.00 0.06 H HETATM 3476 H17 AP A 1 5.373 -2.434 -8.585 1.00 0.06 H HETATM 3477 H46 AP A 1 4.353 -0.137 -8.622 1.00 0.04 H HETATM 3478 H10 AP A 1 3.309 1.396 -7.237 1.00 0.07 H HETATM 3479 H1 AP A 1 4.911 2.563 -3.205 1.00 0.08 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 1658 1659 1664 1665 1666 CONECT 1664 1658 CONECT 1665 1658 CONECT 1666 1658 CONECT 3384 3385 3386 3431 CONECT 3385 3384 CONECT 3386 3384 3387 CONECT 3387 3386 3388 3413 3430 CONECT 3388 3387 3389 3411 3412 CONECT 3389 3388 3390 3409 3410 CONECT 3390 3389 3391 3395 CONECT 3391 3390 3392 3408 CONECT 3392 3391 3393 3407 CONECT 3393 3392 3394 3402 CONECT 3394 3393 3395 3397 CONECT 3395 3390 3394 3396 CONECT 3396 3395 CONECT 3397 3394 3398 CONECT 3398 3397 3399 3400 3401 CONECT 3399 3398 CONECT 3400 3398 CONECT 3401 3398 CONECT 3402 3393 3403 CONECT 3403 3402 3404 3405 3406 CONECT 3404 3403 CONECT 3405 3403 CONECT 3406 3403 CONECT 3407 3392 CONECT 3408 3391 CONECT 3409 3389 CONECT 3410 3389 CONECT 3411 3388 CONECT 3412 3388 CONECT 3413 3387 3414 3418 CONECT 3414 3413 3415 3429 CONECT 3415 3414 3416 3422 CONECT 3416 3415 3417 3421 CONECT 3417 3416 3418 3420 CONECT 3418 3413 3417 3419 CONECT 3419 3418 CONECT 3420 3417 CONECT 3421 3416 CONECT 3422 3415 3423 CONECT 3423 3422 3424 3427 3428 CONECT 3424 3423 3425 3426 CONECT 3425 3424 CONECT 3426 3424 CONECT 3427 3423 CONECT 3428 3423 CONECT 3429 3414 CONECT 3430 3387 CONECT 3431 3384 3432 3436 3479 CONECT 3432 3431 3433 3445 CONECT 3433 3432 3434 3443 3444 CONECT 3434 3433 3435 3441 3442 CONECT 3435 3434 3436 3439 3440 CONECT 3436 3431 3435 3437 3438 CONECT 3437 3436 CONECT 3438 3436 CONECT 3439 3435 CONECT 3440 3435 CONECT 3441 3434 CONECT 3442 3434 CONECT 3443 3433 CONECT 3444 3433 CONECT 3445 3432 3446 3447 CONECT 3446 3445 CONECT 3447 3445 3448 3455 3478 CONECT 3448 3447 3449 3453 3454 CONECT 3449 3448 3450 3451 3452 CONECT 3450 3449 CONECT 3451 3449 CONECT 3452 3449 CONECT 3453 3448 CONECT 3454 3448 CONECT 3455 3447 3456 3460 CONECT 3456 3455 3457 3477 CONECT 3457 3456 3458 3472 CONECT 3458 3457 3459 3467 CONECT 3459 3458 3460 3462 CONECT 3460 3455 3459 3461 CONECT 3461 3460 CONECT 3462 3459 3463 CONECT 3463 3462 3464 3465 3466 CONECT 3464 3463 CONECT 3465 3463 CONECT 3466 3463 CONECT 3467 3458 3468 CONECT 3468 3467 3469 3470 3471 CONECT 3469 3468 CONECT 3470 3468 CONECT 3471 3468 CONECT 3472 3457 3473 CONECT 3473 3472 3474 3475 3476 CONECT 3474 3473 CONECT 3475 3473 CONECT 3476 3473 CONECT 3477 3456 CONECT 3478 3447 CONECT 3479 3431 MASTER 0 0 0 0 0 0 0 0 3477 2 104 18 END
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Related entries of code: 1bl4
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1a7x
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PDBbind
107aa, >1A7X_1|Chains... *
1b6c
RCSB PDB
PDBbind
107aa, >1B6C_1|Chains... at 100%
1d7i
RCSB PDB
PDBbind
107aa, >1D7I_1|Chains... at 100%
1d7j
RCSB PDB
PDBbind
107aa, >1D7J_1|Chains... at 100%
1f40
RCSB PDB
PDBbind
107aa, >1F40_1|Chain... at 100%
1fkb
RCSB PDB
PDBbind
107aa, >1FKB_1|Chain... at 100%
1fkf
RCSB PDB
PDBbind
107aa, >1FKF_1|Chain... at 100%
1fkg
RCSB PDB
PDBbind
107aa, >1FKG_1|Chain... at 100%
1fkh
RCSB PDB
PDBbind
107aa, >1FKH_1|Chain... at 100%
1fki
RCSB PDB
PDBbind
107aa, >1FKI_1|Chains... at 100%
1j4r
RCSB PDB
PDBbind
107aa, >1J4R_1|Chains... at 100%
1qpf
RCSB PDB
PDBbind
107aa, >1QPF_1|Chains... at 100%
1qpl
RCSB PDB
PDBbind
107aa, >1QPL_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
1bl4
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
fk506 binding protein (fkbp)
Ligand Name
AP1
EC.Number
E.C.5.2.1.8
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
IC50=1.8nM
Release Year
1998
Protein/NA Sequence
Check fasta file
Primary Reference
Proc.Natl.Acad.Sci.USA v95 pp. 10437-42, 1998
Ligand Properties
Formula
C
3
8
H
4
7
NO
1
1
Molecular Weight
693.780
Exact Mass
693.315
No. of atoms
97
No. of bonds
100
Polar Surface Area
139.29
LOGP Value
7.20 (
Computed with XLOGP3
)
5.92 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 18
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 4
Canonical SMILES
CC[C@H](C(=O)N1CCCC[C@H]1C(=O)O[C@@H](c1cccc(c1)OCC(=O)O)CCc1ccc(c(c1)OC)OC)c1cc(OC)c(c(c1)OC)OC
InChI String
InChI=1S/C38H47NO11/c1-7-28(26-21-33(46-4)36(48-6)34(22-26)47-5)37(42)39-18-9-8-13-29(39)38(43)50-30(25-11-10-12-27(20-25)49-23-35(40)41)16-14-24-15-17-31(44-2)32(19-24)45-3/h10-12,15,17,19-22,28-30H,7-9,13-14,16,18,23H2,1-6H3,(H,40,41)/t28-,29-,30+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P62942
Entrez Gene ID
NCBI Entrez Gene ID:
2280
ASD
Information of known allosteric effects of PDB entries
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