Browse entries in the PDBbind-CN Database
HEADER 3QX8_COMPLEX COMPND 3QX8_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 133 LYS GLN PHE HIS THR GLY ILE GLU ILE LYS VAL TRP ALA SEQRES 2 A 133 ILE ALA CYS PHE ALA PRO GLN ARG GLN CYS THR GLU VAL SEQRES 3 A 133 HIS LEU LYS SER PHE THR GLU GLN LEU ARG LYS ILE SER SEQRES 4 A 133 ARG ASP ALA GLY MET PRO ILE GLN GLY GLN PRO CYS PHE SEQRES 5 A 133 CYS LYS TYR ALA GLN GLY ALA ASP SER VAL GLU PRO MET SEQRES 6 A 133 PHE ARG HIS LEU LYS ASN THR TYR ALA GLY LEU GLN LEU SEQRES 7 A 133 VAL VAL VAL ILE LEU PRO GLY LYS THR PRO VAL TYR ALA SEQRES 8 A 133 GLU VAL LYS ARG VAL GLY ASP THR VAL LEU GLY MET ALA SEQRES 9 A 133 THR GLN CYS VAL GLN MET LYS ASN VAL GLN ARG THR THR SEQRES 10 A 133 PRO GLN THR LEU SER ASN LEU CYS LEU LYS ILE ASN VAL SEQRES 11 A 133 LYS LEU GLY HET GTG A 171 81 ATOM 1 N LYS A 440 10.839 8.790 -33.303 1.00 68.44 N ATOM 2 CA LYS A 440 10.757 7.681 -34.300 1.00 69.29 C ATOM 3 C LYS A 440 9.378 7.023 -34.178 1.00 68.83 C ATOM 4 O LYS A 440 8.709 7.165 -33.153 1.00 68.91 O ATOM 5 CB LYS A 440 11.869 6.652 -34.027 1.00 69.54 C ATOM 6 CG LYS A 440 12.329 5.845 -35.249 1.00 69.85 C ATOM 7 CD LYS A 440 11.221 4.964 -35.815 1.00 69.99 C ATOM 8 CE LYS A 440 11.619 4.331 -37.141 1.00 69.70 C ATOM 9 NZ LYS A 440 10.470 3.629 -37.785 1.00 68.68 N ATOM 10 HA LYS A 440 10.891 8.069 -35.310 1.00 0.00 H ATOM 11 HB2 LYS A 440 12.733 7.186 -33.631 1.00 0.00 H ATOM 12 HB3 LYS A 440 11.502 5.950 -33.278 1.00 0.00 H ATOM 13 HG2 LYS A 440 12.655 6.538 -36.024 1.00 0.00 H ATOM 14 HG3 LYS A 440 13.165 5.211 -34.955 1.00 0.00 H ATOM 15 HD2 LYS A 440 11.000 4.173 -35.099 1.00 0.00 H ATOM 16 HD3 LYS A 440 10.330 5.573 -35.968 1.00 0.00 H ATOM 17 HE2 LYS A 440 12.418 3.611 -36.963 1.00 0.00 H ATOM 18 HE3 LYS A 440 11.977 5.112 -37.812 1.00 0.00 H ATOM 19 HZ1 LYS A 440 10.126 2.878 -37.153 1.00 0.00 H ATOM 20 HZ2 LYS A 440 9.705 4.311 -37.964 1.00 0.00 H ATOM 21 HZ3 LYS A 440 10.781 3.211 -38.685 1.00 0.00 H ATOM 22 HN3 LYS A 440 10.711 8.404 -32.346 1.00 0.00 H ATOM 23 HN2 LYS A 440 10.093 9.487 -33.499 1.00 0.00 H ATOM 24 HN1 LYS A 440 11.770 9.248 -33.372 1.00 0.00 H ATOM 25 N GLN A 441 8.953 6.316 -35.223 1.00 67.56 N ATOM 26 CA GLN A 441 7.657 5.648 -35.217 1.00 66.36 C ATOM 27 C GLN A 441 7.583 4.456 -34.259 1.00 64.74 C ATOM 28 O GLN A 441 8.550 3.715 -34.081 1.00 64.78 O ATOM 29 CB GLN A 441 7.285 5.188 -36.629 1.00 67.51 C ATOM 30 CG GLN A 441 7.057 6.326 -37.613 1.00 69.84 C ATOM 31 CD GLN A 441 6.073 5.957 -38.714 1.00 70.92 C ATOM 32 OE1 GLN A 441 4.890 5.722 -38.450 1.00 71.29 O ATOM 33 NE2 GLN A 441 6.556 5.900 -39.952 1.00 71.26 N ATOM 34 HA GLN A 441 6.943 6.390 -34.858 1.00 0.00 H ATOM 35 HB2 GLN A 441 8.093 4.563 -37.010 1.00 0.00 H ATOM 36 HB3 GLN A 441 6.370 4.600 -36.568 1.00 0.00 H ATOM 37 HG2 GLN A 441 6.667 7.186 -37.069 1.00 0.00 H ATOM 38 HG3 GLN A 441 8.011 6.589 -38.070 1.00 0.00 H ATOM 39 HE22 GLN A 441 7.560 6.106 -40.128 1.00 0.00 H ATOM 40 HE21 GLN A 441 5.930 5.650 -40.744 1.00 0.00 H ATOM 41 H GLN A 441 9.560 6.238 -36.064 1.00 0.00 H ATOM 42 N PHE A 442 6.413 4.289 -33.648 1.00 62.25 N ATOM 43 CA PHE A 442 6.139 3.209 -32.704 1.00 59.23 C ATOM 44 C PHE A 442 5.975 1.892 -33.473 1.00 58.13 C ATOM 45 O PHE A 442 5.347 1.862 -34.533 1.00 58.13 O ATOM 46 CB PHE A 442 4.847 3.530 -31.943 1.00 57.87 C ATOM 47 CG PHE A 442 4.445 2.486 -30.948 1.00 55.77 C ATOM 48 CD1 PHE A 442 5.016 2.460 -29.679 1.00 54.61 C ATOM 49 CD2 PHE A 442 3.486 1.531 -31.276 1.00 54.46 C ATOM 50 CE1 PHE A 442 4.632 1.498 -28.748 1.00 54.24 C ATOM 51 CE2 PHE A 442 3.097 0.564 -30.353 1.00 54.42 C ATOM 52 CZ PHE A 442 3.670 0.549 -29.085 1.00 53.38 C ATOM 53 HA PHE A 442 6.964 3.111 -31.998 1.00 0.00 H ATOM 54 HB2 PHE A 442 4.987 4.472 -31.413 1.00 0.00 H ATOM 55 HB3 PHE A 442 4.041 3.640 -32.668 1.00 0.00 H ATOM 56 HD2 PHE A 442 3.034 1.541 -32.268 1.00 0.00 H ATOM 57 HE2 PHE A 442 2.346 -0.179 -30.623 1.00 0.00 H ATOM 58 HZ PHE A 442 3.367 -0.204 -28.357 1.00 0.00 H ATOM 59 HE1 PHE A 442 5.084 1.488 -27.756 1.00 0.00 H ATOM 60 HD1 PHE A 442 5.771 3.199 -29.411 1.00 0.00 H ATOM 61 H PHE A 442 5.651 4.966 -33.854 1.00 0.00 H ATOM 62 N HIS A 443 6.530 0.809 -32.936 1.00 56.20 N ATOM 63 CA HIS A 443 6.447 -0.499 -33.583 1.00 54.46 C ATOM 64 C HIS A 443 5.517 -1.465 -32.859 1.00 54.21 C ATOM 65 O HIS A 443 5.616 -1.642 -31.641 1.00 54.41 O ATOM 66 CB HIS A 443 7.833 -1.130 -33.662 1.00 53.64 C ATOM 67 CG HIS A 443 8.831 -0.293 -34.392 1.00 54.08 C ATOM 68 ND1 HIS A 443 8.728 -0.020 -35.740 1.00 53.79 N ATOM 69 CD2 HIS A 443 9.937 0.356 -33.958 1.00 53.72 C ATOM 70 CE1 HIS A 443 9.728 0.762 -36.105 1.00 53.85 C ATOM 71 NE2 HIS A 443 10.476 1.005 -35.043 1.00 54.54 N ATOM 72 HA HIS A 443 6.039 -0.323 -34.578 1.00 0.00 H ATOM 73 HB2 HIS A 443 8.196 -1.293 -32.647 1.00 0.00 H ATOM 74 HB3 HIS A 443 7.747 -2.089 -34.174 1.00 0.00 H ATOM 75 HD2 HIS A 443 10.327 0.363 -32.940 1.00 0.00 H ATOM 76 HE1 HIS A 443 9.906 1.142 -37.111 1.00 0.00 H ATOM 77 H HIS A 443 7.036 0.895 -32.032 1.00 0.00 H ATOM 78 N THR A 444 4.611 -2.089 -33.605 1.00 52.82 N ATOM 79 CA THR A 444 3.702 -3.056 -33.004 1.00 52.18 C ATOM 80 C THR A 444 4.244 -4.434 -33.340 1.00 50.04 C ATOM 81 O THR A 444 5.220 -4.552 -34.084 1.00 49.67 O ATOM 82 CB THR A 444 2.272 -2.931 -33.552 1.00 53.13 C ATOM 83 OG1 THR A 444 2.293 -3.102 -34.975 1.00 55.49 O ATOM 84 CG2 THR A 444 1.678 -1.573 -33.198 1.00 53.86 C ATOM 85 HA THR A 444 3.648 -2.880 -31.930 1.00 0.00 H ATOM 86 HB THR A 444 1.650 -3.704 -33.100 1.00 0.00 H ATOM 87 HG1 THR A 444 1.372 -3.022 -35.329 1.00 0.00 H ATOM 88 HG23 THR A 444 1.667 -1.454 -32.115 1.00 0.00 H ATOM 89 HG21 THR A 444 2.284 -0.785 -33.645 1.00 0.00 H ATOM 90 HG22 THR A 444 0.660 -1.512 -33.582 1.00 0.00 H ATOM 91 H THR A 444 4.551 -1.886 -34.623 1.00 0.00 H ATOM 92 N GLY A 445 3.623 -5.472 -32.788 1.00 48.60 N ATOM 93 CA GLY A 445 4.085 -6.823 -33.047 1.00 45.72 C ATOM 94 C GLY A 445 5.167 -7.221 -32.067 1.00 43.58 C ATOM 95 O GLY A 445 5.749 -8.302 -32.174 1.00 44.79 O ATOM 96 HA3 GLY A 445 4.484 -6.876 -34.060 1.00 0.00 H ATOM 97 HA2 GLY A 445 3.246 -7.512 -32.952 1.00 0.00 H ATOM 98 H GLY A 445 2.803 -5.315 -32.168 1.00 0.00 H ATOM 99 N ILE A 446 5.442 -6.338 -31.112 1.00 40.88 N ATOM 100 CA ILE A 446 6.454 -6.599 -30.098 1.00 37.89 C ATOM 101 C ILE A 446 5.793 -7.263 -28.897 1.00 36.62 C ATOM 102 O ILE A 446 4.767 -6.797 -28.412 1.00 36.36 O ATOM 103 CB ILE A 446 7.117 -5.290 -29.587 1.00 37.48 C ATOM 104 CG1 ILE A 446 7.698 -4.483 -30.753 1.00 37.36 C ATOM 105 CG2 ILE A 446 8.182 -5.623 -28.557 1.00 33.66 C ATOM 106 CD1 ILE A 446 8.926 -5.077 -31.382 1.00 38.62 C ATOM 107 HA ILE A 446 7.214 -7.233 -30.554 1.00 0.00 H ATOM 108 HB ILE A 446 6.359 -4.669 -29.110 1.00 0.00 H ATOM 109 HG12 ILE A 446 6.930 -4.398 -31.522 1.00 0.00 H ATOM 110 HG13 ILE A 446 7.953 -3.489 -30.384 1.00 0.00 H ATOM 111 HD11 ILE A 446 9.713 -5.158 -30.633 1.00 0.00 H ATOM 112 HD12 ILE A 446 8.690 -6.067 -31.772 1.00 0.00 H ATOM 113 HD13 ILE A 446 9.262 -4.435 -32.196 1.00 0.00 H ATOM 114 HG21 ILE A 446 7.723 -6.147 -27.719 1.00 0.00 H ATOM 115 HG22 ILE A 446 8.941 -6.259 -29.013 1.00 0.00 H ATOM 116 HG23 ILE A 446 8.643 -4.701 -28.202 1.00 0.00 H ATOM 117 H ILE A 446 4.921 -5.438 -31.089 1.00 0.00 H ATOM 118 N GLU A 447 6.389 -8.353 -28.429 1.00 35.96 N ATOM 119 CA GLU A 447 5.901 -9.077 -27.258 1.00 34.16 C ATOM 120 C GLU A 447 7.097 -9.512 -26.425 1.00 31.69 C ATOM 121 O GLU A 447 7.931 -10.281 -26.883 1.00 31.11 O ATOM 122 CB GLU A 447 5.090 -10.308 -27.670 1.00 36.36 C ATOM 123 CG GLU A 447 3.689 -9.982 -28.145 1.00 41.16 C ATOM 124 CD GLU A 447 2.904 -11.219 -28.517 1.00 43.95 C ATOM 125 OE1 GLU A 447 3.164 -11.779 -29.609 1.00 46.07 O ATOM 126 OE2 GLU A 447 2.035 -11.634 -27.713 1.00 45.22 O ATOM 127 HA GLU A 447 5.249 -8.421 -26.681 1.00 0.00 H ATOM 128 HB2 GLU A 447 5.619 -10.814 -28.478 1.00 0.00 H ATOM 129 HB3 GLU A 447 5.016 -10.975 -26.811 1.00 0.00 H ATOM 130 HG2 GLU A 447 3.161 -9.459 -27.347 1.00 0.00 H ATOM 131 HG3 GLU A 447 3.757 -9.334 -29.019 1.00 0.00 H ATOM 132 H GLU A 447 7.238 -8.706 -28.916 1.00 0.00 H ATOM 133 N ILE A 448 7.182 -9.017 -25.199 1.00 29.50 N ATOM 134 CA ILE A 448 8.289 -9.377 -24.337 1.00 28.94 C ATOM 135 C ILE A 448 7.881 -10.456 -23.340 1.00 29.03 C ATOM 136 O ILE A 448 7.126 -10.201 -22.405 1.00 30.61 O ATOM 137 CB ILE A 448 8.818 -8.137 -23.598 1.00 28.49 C ATOM 138 CG1 ILE A 448 9.170 -7.060 -24.625 1.00 28.85 C ATOM 139 CG2 ILE A 448 10.049 -8.496 -22.778 1.00 27.18 C ATOM 140 CD1 ILE A 448 9.732 -5.800 -24.030 1.00 32.15 C ATOM 141 HA ILE A 448 9.086 -9.780 -24.962 1.00 0.00 H ATOM 142 HB ILE A 448 8.050 -7.763 -22.920 1.00 0.00 H ATOM 143 HG12 ILE A 448 9.908 -7.472 -25.313 1.00 0.00 H ATOM 144 HG13 ILE A 448 8.265 -6.804 -25.176 1.00 0.00 H ATOM 145 HD11 ILE A 448 9.002 -5.365 -23.348 1.00 0.00 H ATOM 146 HD12 ILE A 448 10.647 -6.034 -23.485 1.00 0.00 H ATOM 147 HD13 ILE A 448 9.954 -5.091 -24.827 1.00 0.00 H ATOM 148 HG21 ILE A 448 9.787 -9.261 -22.048 1.00 0.00 H ATOM 149 HG22 ILE A 448 10.827 -8.875 -23.440 1.00 0.00 H ATOM 150 HG23 ILE A 448 10.411 -7.607 -22.261 1.00 0.00 H ATOM 151 H ILE A 448 6.449 -8.365 -24.853 1.00 0.00 H ATOM 152 N LYS A 449 8.392 -11.665 -23.549 1.00 28.76 N ATOM 153 CA LYS A 449 8.081 -12.797 -22.687 1.00 28.44 C ATOM 154 C LYS A 449 9.210 -13.189 -21.748 1.00 27.12 C ATOM 155 O LYS A 449 8.968 -13.497 -20.584 1.00 28.46 O ATOM 156 CB LYS A 449 7.674 -13.991 -23.544 1.00 30.91 C ATOM 157 CG LYS A 449 6.436 -13.693 -24.349 1.00 34.73 C ATOM 158 CD LYS A 449 5.829 -14.924 -24.984 1.00 39.57 C ATOM 159 CE LYS A 449 4.391 -14.617 -25.412 1.00 42.15 C ATOM 160 NZ LYS A 449 4.037 -15.262 -26.712 1.00 46.26 N ATOM 161 HA LYS A 449 7.257 -12.482 -22.047 1.00 0.00 H ATOM 162 HB2 LYS A 449 8.490 -14.234 -24.225 1.00 0.00 H ATOM 163 HB3 LYS A 449 7.478 -14.844 -22.894 1.00 0.00 H ATOM 164 HG2 LYS A 449 5.694 -13.241 -23.690 1.00 0.00 H ATOM 165 HG3 LYS A 449 6.697 -12.988 -25.138 1.00 0.00 H ATOM 166 HD2 LYS A 449 6.416 -15.210 -25.857 1.00 0.00 H ATOM 167 HD3 LYS A 449 5.828 -15.742 -24.264 1.00 0.00 H ATOM 168 HE2 LYS A 449 4.278 -13.538 -25.514 1.00 0.00 H ATOM 169 HE3 LYS A 449 3.710 -14.982 -24.643 1.00 0.00 H ATOM 170 HZ1 LYS A 449 4.676 -14.915 -27.455 1.00 0.00 H ATOM 171 HZ2 LYS A 449 4.134 -16.294 -26.624 1.00 0.00 H ATOM 172 HZ3 LYS A 449 3.055 -15.025 -26.959 1.00 0.00 H ATOM 173 H LYS A 449 9.035 -11.807 -24.354 1.00 0.00 H ATOM 174 N VAL A 450 10.442 -13.181 -22.239 1.00 24.71 N ATOM 175 CA VAL A 450 11.568 -13.538 -21.387 1.00 23.37 C ATOM 176 C VAL A 450 12.392 -12.306 -21.052 1.00 23.00 C ATOM 177 O VAL A 450 13.159 -11.827 -21.879 1.00 23.05 O ATOM 178 CB VAL A 450 12.497 -14.567 -22.065 1.00 23.49 C ATOM 179 CG1 VAL A 450 13.535 -15.057 -21.072 1.00 20.45 C ATOM 180 CG2 VAL A 450 11.681 -15.731 -22.608 1.00 23.37 C ATOM 181 HA VAL A 450 11.150 -13.977 -20.481 1.00 0.00 H ATOM 182 HB VAL A 450 13.011 -14.090 -22.899 1.00 0.00 H ATOM 183 HG11 VAL A 450 14.128 -14.212 -20.721 1.00 0.00 H ATOM 184 HG12 VAL A 450 13.033 -15.527 -20.226 1.00 0.00 H ATOM 185 HG13 VAL A 450 14.187 -15.783 -21.558 1.00 0.00 H ATOM 186 HG21 VAL A 450 11.149 -16.214 -21.788 1.00 0.00 H ATOM 187 HG22 VAL A 450 10.963 -15.360 -23.340 1.00 0.00 H ATOM 188 HG23 VAL A 450 12.348 -16.450 -23.084 1.00 0.00 H ATOM 189 H VAL A 450 10.604 -12.920 -23.233 1.00 0.00 H ATOM 190 N TRP A 451 12.227 -11.777 -19.848 1.00 21.07 N ATOM 191 CA TRP A 451 13.003 -10.616 -19.459 1.00 21.09 C ATOM 192 C TRP A 451 13.416 -10.709 -18.000 1.00 23.03 C ATOM 193 O TRP A 451 12.773 -11.381 -17.187 1.00 23.60 O ATOM 194 CB TRP A 451 12.235 -9.320 -19.725 1.00 20.95 C ATOM 195 CG TRP A 451 10.980 -9.168 -18.946 1.00 21.34 C ATOM 196 CD1 TRP A 451 9.800 -9.813 -19.159 1.00 21.76 C ATOM 197 CD2 TRP A 451 10.778 -8.319 -17.811 1.00 22.84 C ATOM 198 NE1 TRP A 451 8.870 -9.421 -18.226 1.00 23.53 N ATOM 199 CE2 TRP A 451 9.444 -8.505 -17.384 1.00 23.16 C ATOM 200 CE3 TRP A 451 11.596 -7.419 -17.113 1.00 23.12 C ATOM 201 CZ2 TRP A 451 8.902 -7.823 -16.284 1.00 23.93 C ATOM 202 CZ3 TRP A 451 11.059 -6.738 -16.015 1.00 24.72 C ATOM 203 CH2 TRP A 451 9.721 -6.947 -15.614 1.00 24.44 C ATOM 204 HA TRP A 451 13.906 -10.598 -20.070 1.00 0.00 H ATOM 205 HB2 TRP A 451 12.889 -8.482 -19.482 1.00 0.00 H ATOM 206 HB3 TRP A 451 11.983 -9.287 -20.785 1.00 0.00 H ATOM 207 HE1 TRP A 451 7.890 -9.764 -18.168 1.00 0.00 H ATOM 208 HD1 TRP A 451 9.619 -10.536 -19.955 1.00 0.00 H ATOM 209 HZ2 TRP A 451 7.870 -7.982 -15.973 1.00 0.00 H ATOM 210 HH2 TRP A 451 9.330 -6.402 -14.755 1.00 0.00 H ATOM 211 HZ3 TRP A 451 11.682 -6.036 -15.461 1.00 0.00 H ATOM 212 HE3 TRP A 451 12.629 -7.253 -17.419 1.00 0.00 H ATOM 213 H TRP A 451 11.543 -12.194 -19.184 1.00 0.00 H ATOM 214 N ALA A 452 14.506 -10.034 -17.672 1.00 22.36 N ATOM 215 CA ALA A 452 15.018 -10.072 -16.326 1.00 21.53 C ATOM 216 C ALA A 452 15.151 -8.698 -15.712 1.00 20.86 C ATOM 217 O ALA A 452 15.207 -7.688 -16.410 1.00 20.81 O ATOM 218 CB ALA A 452 16.367 -10.776 -16.319 1.00 22.42 C ATOM 219 HA ALA A 452 14.299 -10.621 -15.718 1.00 0.00 H ATOM 220 HB1 ALA A 452 16.247 -11.793 -16.692 1.00 0.00 H ATOM 221 HB2 ALA A 452 17.062 -10.233 -16.959 1.00 0.00 H ATOM 222 HB3 ALA A 452 16.755 -10.805 -15.301 1.00 0.00 H ATOM 223 H ALA A 452 14.998 -9.470 -18.394 1.00 0.00 H ATOM 224 N ILE A 453 15.184 -8.672 -14.389 1.00 21.37 N ATOM 225 CA ILE A 453 15.356 -7.431 -13.655 1.00 22.36 C ATOM 226 C ILE A 453 16.648 -7.541 -12.869 1.00 21.06 C ATOM 227 O ILE A 453 16.861 -8.518 -12.158 1.00 21.33 O ATOM 228 CB ILE A 453 14.224 -7.177 -12.645 1.00 22.48 C ATOM 229 CG1 ILE A 453 12.927 -6.846 -13.379 1.00 22.87 C ATOM 230 CG2 ILE A 453 14.620 -6.039 -11.709 1.00 22.44 C ATOM 231 CD1 ILE A 453 11.792 -6.435 -12.460 1.00 21.90 C ATOM 232 HA ILE A 453 15.358 -6.612 -14.374 1.00 0.00 H ATOM 233 HB ILE A 453 14.059 -8.078 -12.053 1.00 0.00 H ATOM 234 HG12 ILE A 453 13.123 -6.027 -14.071 1.00 0.00 H ATOM 235 HG13 ILE A 453 12.614 -7.727 -13.939 1.00 0.00 H ATOM 236 HD11 ILE A 453 11.574 -7.248 -11.767 1.00 0.00 H ATOM 237 HD12 ILE A 453 12.083 -5.547 -11.900 1.00 0.00 H ATOM 238 HD13 ILE A 453 10.905 -6.216 -13.055 1.00 0.00 H ATOM 239 HG21 ILE A 453 15.530 -6.310 -11.174 1.00 0.00 H ATOM 240 HG22 ILE A 453 14.796 -5.135 -12.292 1.00 0.00 H ATOM 241 HG23 ILE A 453 13.816 -5.861 -10.995 1.00 0.00 H ATOM 242 H ILE A 453 15.084 -9.563 -13.862 1.00 0.00 H ATOM 243 N ALA A 454 17.509 -6.542 -13.003 1.00 20.69 N ATOM 244 CA ALA A 454 18.775 -6.523 -12.272 1.00 19.51 C ATOM 245 C ALA A 454 18.721 -5.254 -11.454 1.00 18.76 C ATOM 246 O ALA A 454 18.817 -4.164 -12.005 1.00 20.39 O ATOM 247 CB ALA A 454 19.958 -6.468 -13.245 1.00 19.33 C ATOM 248 HA ALA A 454 18.909 -7.414 -11.659 1.00 0.00 H ATOM 249 HB1 ALA A 454 19.936 -7.345 -13.892 1.00 0.00 H ATOM 250 HB2 ALA A 454 19.886 -5.565 -13.852 1.00 0.00 H ATOM 251 HB3 ALA A 454 20.891 -6.455 -12.681 1.00 0.00 H ATOM 252 H ALA A 454 17.279 -5.755 -13.642 1.00 0.00 H ATOM 253 N CYS A 455 18.566 -5.381 -10.144 1.00 18.62 N ATOM 254 CA CYS A 455 18.474 -4.190 -9.318 1.00 19.63 C ATOM 255 C CYS A 455 19.773 -3.837 -8.632 1.00 19.50 C ATOM 256 O CYS A 455 20.173 -4.491 -7.678 1.00 19.49 O ATOM 257 CB CYS A 455 17.371 -4.344 -8.266 1.00 17.99 C ATOM 258 SG CYS A 455 16.997 -2.778 -7.438 1.00 19.72 S ATOM 259 HA CYS A 455 18.232 -3.373 -9.998 1.00 0.00 H ATOM 260 HB2 CYS A 455 17.696 -5.068 -7.519 1.00 0.00 H ATOM 261 HB3 CYS A 455 16.467 -4.708 -8.754 1.00 0.00 H ATOM 262 HG CYS A 455 18.132 -2.311 -6.807 1.00 0.00 H ATOM 263 H CYS A 455 18.511 -6.325 -9.711 1.00 0.00 H ATOM 264 N PHE A 456 20.425 -2.789 -9.115 1.00 21.43 N ATOM 265 CA PHE A 456 21.694 -2.364 -8.522 1.00 23.71 C ATOM 266 C PHE A 456 21.469 -1.335 -7.438 1.00 23.94 C ATOM 267 O PHE A 456 22.405 -0.751 -6.908 1.00 25.07 O ATOM 268 CB PHE A 456 22.632 -1.829 -9.606 1.00 22.07 C ATOM 269 CG PHE A 456 23.209 -2.915 -10.473 1.00 22.08 C ATOM 270 CD1 PHE A 456 24.352 -3.600 -10.078 1.00 20.12 C ATOM 271 CD2 PHE A 456 22.560 -3.309 -11.643 1.00 22.98 C ATOM 272 CE1 PHE A 456 24.839 -4.658 -10.823 1.00 21.30 C ATOM 273 CE2 PHE A 456 23.040 -4.373 -12.401 1.00 21.88 C ATOM 274 CZ PHE A 456 24.187 -5.051 -11.987 1.00 20.91 C ATOM 275 HA PHE A 456 22.165 -3.230 -8.058 1.00 0.00 H ATOM 276 HB2 PHE A 456 22.074 -1.139 -10.239 1.00 0.00 H ATOM 277 HB3 PHE A 456 23.452 -1.296 -9.124 1.00 0.00 H ATOM 278 HD2 PHE A 456 21.666 -2.777 -11.968 1.00 0.00 H ATOM 279 HE2 PHE A 456 22.523 -4.675 -13.312 1.00 0.00 H ATOM 280 HZ PHE A 456 24.571 -5.886 -12.574 1.00 0.00 H ATOM 281 HE1 PHE A 456 25.736 -5.185 -10.497 1.00 0.00 H ATOM 282 HD1 PHE A 456 24.872 -3.299 -9.168 1.00 0.00 H ATOM 283 H PHE A 456 20.032 -2.264 -9.922 1.00 0.00 H ATOM 284 N ALA A 457 20.205 -1.126 -7.107 1.00 24.55 N ATOM 285 CA ALA A 457 19.851 -0.194 -6.061 1.00 24.50 C ATOM 286 C ALA A 457 19.744 -1.045 -4.817 1.00 25.08 C ATOM 287 O ALA A 457 19.360 -2.214 -4.898 1.00 27.08 O ATOM 288 CB ALA A 457 18.516 0.461 -6.367 1.00 24.09 C ATOM 289 HA ALA A 457 20.580 0.609 -5.955 1.00 0.00 H ATOM 290 HB1 ALA A 457 18.584 0.997 -7.314 1.00 0.00 H ATOM 291 HB2 ALA A 457 17.744 -0.306 -6.437 1.00 0.00 H ATOM 292 HB3 ALA A 457 18.264 1.160 -5.569 1.00 0.00 H ATOM 293 H ALA A 457 19.453 -1.641 -7.608 1.00 0.00 H ATOM 294 N PRO A 458 20.097 -0.486 -3.651 1.00 25.04 N ATOM 295 CA PRO A 458 20.014 -1.249 -2.406 1.00 25.64 C ATOM 296 C PRO A 458 18.569 -1.667 -2.126 1.00 26.70 C ATOM 297 O PRO A 458 17.636 -0.888 -2.323 1.00 26.84 O ATOM 298 CB PRO A 458 20.536 -0.261 -1.364 1.00 25.45 C ATOM 299 CG PRO A 458 21.479 0.594 -2.157 1.00 24.17 C ATOM 300 CD PRO A 458 20.682 0.841 -3.407 1.00 24.68 C ATOM 301 HA PRO A 458 20.582 -2.179 -2.420 1.00 0.00 H ATOM 302 HD3 PRO A 458 19.910 1.593 -3.245 1.00 0.00 H ATOM 303 HD2 PRO A 458 21.322 1.152 -4.233 1.00 0.00 H ATOM 304 HG3 PRO A 458 22.408 0.067 -2.374 1.00 0.00 H ATOM 305 HG2 PRO A 458 21.705 1.525 -1.638 1.00 0.00 H ATOM 306 HB2 PRO A 458 19.724 0.334 -0.946 1.00 0.00 H ATOM 307 HB3 PRO A 458 21.058 -0.779 -0.559 1.00 0.00 H ATOM 308 N GLN A 459 18.384 -2.898 -1.670 1.00 28.30 N ATOM 309 CA GLN A 459 17.052 -3.393 -1.363 1.00 28.81 C ATOM 310 C GLN A 459 16.324 -2.509 -0.356 1.00 28.83 C ATOM 311 O GLN A 459 15.122 -2.256 -0.497 1.00 29.73 O ATOM 312 CB GLN A 459 17.136 -4.822 -0.825 1.00 30.07 C ATOM 313 CG GLN A 459 15.795 -5.416 -0.415 1.00 29.30 C ATOM 314 CD GLN A 459 15.856 -6.921 -0.249 1.00 30.02 C ATOM 315 OE1 GLN A 459 16.943 -7.508 -0.199 1.00 28.70 O ATOM 316 NE2 GLN A 459 14.687 -7.559 -0.160 1.00 30.28 N ATOM 317 HA GLN A 459 16.480 -3.376 -2.291 1.00 0.00 H ATOM 318 HB2 GLN A 459 17.567 -5.455 -1.601 1.00 0.00 H ATOM 319 HB3 GLN A 459 17.790 -4.821 0.047 1.00 0.00 H ATOM 320 HG2 GLN A 459 15.490 -4.971 0.532 1.00 0.00 H ATOM 321 HG3 GLN A 459 15.057 -5.178 -1.181 1.00 0.00 H ATOM 322 HE22 GLN A 459 13.797 -7.023 -0.207 1.00 0.00 H ATOM 323 HE21 GLN A 459 14.666 -8.592 -0.043 1.00 0.00 H ATOM 324 H GLN A 459 19.206 -3.520 -1.530 1.00 0.00 H ATOM 325 N ARG A 460 17.053 -2.037 0.650 1.00 29.06 N ATOM 326 CA ARG A 460 16.480 -1.198 1.701 1.00 29.31 C ATOM 327 C ARG A 460 15.904 0.109 1.172 1.00 29.37 C ATOM 328 O ARG A 460 15.165 0.791 1.872 1.00 30.77 O ATOM 329 CB ARG A 460 17.528 -0.888 2.776 1.00 30.11 C ATOM 330 CG ARG A 460 18.721 -0.103 2.279 1.00 33.56 C ATOM 331 CD ARG A 460 19.516 0.486 3.445 1.00 38.70 C ATOM 332 NE ARG A 460 20.634 1.311 2.984 1.00 40.98 N ATOM 333 CZ ARG A 460 21.673 0.839 2.303 1.00 43.07 C ATOM 334 NH1 ARG A 460 21.741 -0.453 2.009 1.00 43.37 N ATOM 335 NH2 ARG A 460 22.639 1.658 1.902 1.00 44.34 N ATOM 336 HA ARG A 460 15.658 -1.771 2.131 1.00 0.00 H ATOM 337 HB2 ARG A 460 17.046 -0.312 3.566 1.00 0.00 H ATOM 338 HB3 ARG A 460 17.887 -1.833 3.184 1.00 0.00 H ATOM 339 HG2 ARG A 460 19.369 -0.765 1.704 1.00 0.00 H ATOM 340 HG3 ARG A 460 18.373 0.708 1.639 1.00 0.00 H ATOM 341 HD2 ARG A 460 19.907 -0.330 4.053 1.00 0.00 H ATOM 342 HD3 ARG A 460 18.850 1.101 4.050 1.00 0.00 H ATOM 343 HE ARG A 460 20.614 2.328 3.203 1.00 0.00 H ATOM 344 HH12 ARG A 460 22.554 -0.823 1.476 1.00 0.00 H ATOM 345 HH11 ARG A 460 20.981 -1.096 2.311 1.00 0.00 H ATOM 346 HH22 ARG A 460 23.450 1.284 1.369 1.00 0.00 H ATOM 347 HH21 ARG A 460 22.584 2.673 2.121 1.00 0.00 H ATOM 348 H ARG A 460 18.065 -2.272 0.691 1.00 0.00 H ATOM 349 N GLN A 461 16.247 0.468 -0.059 1.00 30.04 N ATOM 350 CA GLN A 461 15.728 1.700 -0.642 1.00 30.06 C ATOM 351 C GLN A 461 14.688 1.364 -1.696 1.00 29.48 C ATOM 352 O GLN A 461 13.679 2.050 -1.823 1.00 30.23 O ATOM 353 CB GLN A 461 16.863 2.523 -1.261 1.00 30.32 C ATOM 354 CG GLN A 461 17.984 2.804 -0.284 1.00 33.31 C ATOM 355 CD GLN A 461 19.028 3.746 -0.836 1.00 36.59 C ATOM 356 OE1 GLN A 461 19.413 3.658 -2.002 1.00 38.83 O ATOM 357 NE2 GLN A 461 19.509 4.646 0.009 1.00 38.82 N ATOM 358 HA GLN A 461 15.265 2.296 0.144 1.00 0.00 H ATOM 359 HB2 GLN A 461 17.270 1.973 -2.109 1.00 0.00 H ATOM 360 HB3 GLN A 461 16.456 3.473 -1.607 1.00 0.00 H ATOM 361 HG2 GLN A 461 17.557 3.247 0.616 1.00 0.00 H ATOM 362 HG3 GLN A 461 18.467 1.861 -0.029 1.00 0.00 H ATOM 363 HE22 GLN A 461 19.154 4.684 0.986 1.00 0.00 H ATOM 364 HE21 GLN A 461 20.242 5.314 -0.305 1.00 0.00 H ATOM 365 H GLN A 461 16.891 -0.134 -0.612 1.00 0.00 H ATOM 366 N CYS A 462 14.942 0.288 -2.431 1.00 29.09 N ATOM 367 CA CYS A 462 14.063 -0.180 -3.495 1.00 27.49 C ATOM 368 C CYS A 462 13.700 -1.623 -3.164 1.00 28.11 C ATOM 369 O CYS A 462 14.306 -2.562 -3.691 1.00 29.83 O ATOM 370 CB CYS A 462 14.818 -0.117 -4.822 1.00 27.13 C ATOM 371 SG CYS A 462 13.816 -0.330 -6.287 1.00 24.35 S ATOM 372 HA CYS A 462 13.164 0.431 -3.577 1.00 0.00 H ATOM 373 HB2 CYS A 462 15.575 -0.901 -4.816 1.00 0.00 H ATOM 374 HB3 CYS A 462 15.305 0.856 -4.886 1.00 0.00 H ATOM 375 HG CYS A 462 14.619 -0.251 -7.407 1.00 0.00 H ATOM 376 H CYS A 462 15.812 -0.248 -2.238 1.00 0.00 H ATOM 377 N THR A 463 12.713 -1.783 -2.283 1.00 26.90 N ATOM 378 CA THR A 463 12.247 -3.086 -1.805 1.00 23.96 C ATOM 379 C THR A 463 11.543 -3.944 -2.849 1.00 24.15 C ATOM 380 O THR A 463 11.332 -3.532 -3.985 1.00 23.56 O ATOM 381 CB THR A 463 11.284 -2.916 -0.609 1.00 24.13 C ATOM 382 OG1 THR A 463 10.011 -2.463 -1.084 1.00 24.63 O ATOM 383 CG2 THR A 463 11.831 -1.884 0.376 1.00 20.83 C ATOM 384 HA THR A 463 13.162 -3.607 -1.522 1.00 0.00 H ATOM 385 HB THR A 463 11.183 -3.878 -0.106 1.00 0.00 H ATOM 386 HG1 THR A 463 10.122 -1.594 -1.546 1.00 0.00 H ATOM 387 HG23 THR A 463 12.801 -2.216 0.746 1.00 0.00 H ATOM 388 HG21 THR A 463 11.942 -0.925 -0.129 1.00 0.00 H ATOM 389 HG22 THR A 463 11.139 -1.778 1.211 1.00 0.00 H ATOM 390 H THR A 463 12.246 -0.931 -1.913 1.00 0.00 H ATOM 391 N GLU A 464 11.164 -5.146 -2.437 1.00 25.38 N ATOM 392 CA GLU A 464 10.503 -6.097 -3.320 1.00 25.91 C ATOM 393 C GLU A 464 9.127 -5.620 -3.769 1.00 24.78 C ATOM 394 O GLU A 464 8.732 -5.862 -4.905 1.00 25.66 O ATOM 395 CB GLU A 464 10.415 -7.474 -2.633 1.00 27.63 C ATOM 396 CG GLU A 464 11.794 -8.028 -2.233 1.00 35.05 C ATOM 397 CD GLU A 464 11.768 -9.456 -1.663 1.00 39.98 C ATOM 398 OE1 GLU A 464 11.013 -9.721 -0.693 1.00 42.62 O ATOM 399 OE2 GLU A 464 12.521 -10.315 -2.184 1.00 40.02 O ATOM 400 HA GLU A 464 11.107 -6.184 -4.223 1.00 0.00 H ATOM 401 HB2 GLU A 464 9.804 -7.378 -1.736 1.00 0.00 H ATOM 402 HB3 GLU A 464 9.942 -8.177 -3.319 1.00 0.00 H ATOM 403 HG2 GLU A 464 12.431 -8.026 -3.117 1.00 0.00 H ATOM 404 HG3 GLU A 464 12.220 -7.368 -1.478 1.00 0.00 H ATOM 405 H GLU A 464 11.345 -5.419 -1.450 1.00 0.00 H ATOM 406 N VAL A 465 8.400 -4.926 -2.894 1.00 23.05 N ATOM 407 CA VAL A 465 7.078 -4.442 -3.269 1.00 21.04 C ATOM 408 C VAL A 465 7.219 -3.334 -4.304 1.00 20.48 C ATOM 409 O VAL A 465 6.370 -3.176 -5.184 1.00 19.37 O ATOM 410 CB VAL A 465 6.271 -3.948 -2.039 1.00 21.25 C ATOM 411 CG1 VAL A 465 6.820 -2.631 -1.521 1.00 19.24 C ATOM 412 CG2 VAL A 465 4.806 -3.821 -2.411 1.00 22.47 C ATOM 413 HA VAL A 465 6.519 -5.273 -3.700 1.00 0.00 H ATOM 414 HB VAL A 465 6.368 -4.678 -1.236 1.00 0.00 H ATOM 415 HG11 VAL A 465 7.861 -2.764 -1.226 1.00 0.00 H ATOM 416 HG12 VAL A 465 6.756 -1.878 -2.307 1.00 0.00 H ATOM 417 HG13 VAL A 465 6.235 -2.309 -0.659 1.00 0.00 H ATOM 418 HG21 VAL A 465 4.700 -3.105 -3.226 1.00 0.00 H ATOM 419 HG22 VAL A 465 4.427 -4.793 -2.728 1.00 0.00 H ATOM 420 HG23 VAL A 465 4.241 -3.474 -1.546 1.00 0.00 H ATOM 421 H VAL A 465 8.776 -4.730 -1.944 1.00 0.00 H ATOM 422 N HIS A 466 8.302 -2.568 -4.201 1.00 19.97 N ATOM 423 CA HIS A 466 8.568 -1.504 -5.164 1.00 18.65 C ATOM 424 C HIS A 466 8.779 -2.142 -6.537 1.00 18.03 C ATOM 425 O HIS A 466 8.295 -1.636 -7.543 1.00 18.55 O ATOM 426 CB HIS A 466 9.832 -0.717 -4.792 1.00 17.11 C ATOM 427 CG HIS A 466 9.647 0.235 -3.650 1.00 18.74 C ATOM 428 ND1 HIS A 466 10.352 0.123 -2.469 1.00 18.87 N ATOM 429 CD2 HIS A 466 8.868 1.336 -3.522 1.00 19.50 C ATOM 430 CE1 HIS A 466 10.016 1.118 -1.665 1.00 20.13 C ATOM 431 NE2 HIS A 466 9.119 1.868 -2.280 1.00 20.87 N ATOM 432 HA HIS A 466 7.722 -0.816 -5.168 1.00 0.00 H ATOM 433 HB2 HIS A 466 10.612 -1.429 -4.521 1.00 0.00 H ATOM 434 HB3 HIS A 466 10.150 -0.147 -5.665 1.00 0.00 H ATOM 435 HD2 HIS A 466 8.173 1.727 -4.265 1.00 0.00 H ATOM 436 HE1 HIS A 466 10.412 1.290 -0.664 1.00 0.00 H ATOM 437 H HIS A 466 8.970 -2.730 -3.421 1.00 0.00 H ATOM 438 N LEU A 467 9.521 -3.244 -6.563 1.00 18.46 N ATOM 439 CA LEU A 467 9.805 -3.954 -7.801 1.00 21.25 C ATOM 440 C LEU A 467 8.559 -4.574 -8.443 1.00 22.92 C ATOM 441 O LEU A 467 8.359 -4.441 -9.650 1.00 23.97 O ATOM 442 CB LEU A 467 10.840 -5.057 -7.555 1.00 19.89 C ATOM 443 CG LEU A 467 12.267 -4.637 -7.195 1.00 23.90 C ATOM 444 CD1 LEU A 467 13.115 -5.884 -6.901 1.00 20.98 C ATOM 445 CD2 LEU A 467 12.873 -3.819 -8.350 1.00 22.20 C ATOM 446 HA LEU A 467 10.195 -3.209 -8.495 1.00 0.00 H ATOM 447 HB2 LEU A 467 10.468 -5.674 -6.738 1.00 0.00 H ATOM 448 HB3 LEU A 467 10.898 -5.656 -8.464 1.00 0.00 H ATOM 449 HG LEU A 467 12.252 -4.013 -6.302 1.00 0.00 H ATOM 450 HD21 LEU A 467 12.892 -4.428 -9.254 1.00 0.00 H ATOM 451 HD22 LEU A 467 12.266 -2.930 -8.522 1.00 0.00 H ATOM 452 HD23 LEU A 467 13.889 -3.522 -8.089 1.00 0.00 H ATOM 453 HD11 LEU A 467 12.677 -6.431 -6.066 1.00 0.00 H ATOM 454 HD12 LEU A 467 13.137 -6.523 -7.784 1.00 0.00 H ATOM 455 HD13 LEU A 467 14.130 -5.580 -6.645 1.00 0.00 H ATOM 456 H LEU A 467 9.911 -3.610 -5.671 1.00 0.00 H ATOM 457 N LYS A 468 7.736 -5.253 -7.645 1.00 24.81 N ATOM 458 CA LYS A 468 6.537 -5.892 -8.172 1.00 28.35 C ATOM 459 C LYS A 468 5.473 -4.877 -8.543 1.00 28.08 C ATOM 460 O LYS A 468 4.674 -5.108 -9.441 1.00 28.73 O ATOM 461 CB LYS A 468 5.979 -6.918 -7.175 1.00 30.26 C ATOM 462 CG LYS A 468 6.879 -8.146 -7.009 1.00 33.04 C ATOM 463 CD LYS A 468 6.078 -9.417 -6.724 1.00 38.14 C ATOM 464 CE LYS A 468 5.305 -9.890 -7.972 1.00 41.53 C ATOM 465 NZ LYS A 468 4.476 -11.113 -7.734 1.00 42.50 N ATOM 466 HA LYS A 468 6.825 -6.415 -9.084 1.00 0.00 H ATOM 467 HB2 LYS A 468 5.869 -6.434 -6.204 1.00 0.00 H ATOM 468 HB3 LYS A 468 5.002 -7.249 -7.528 1.00 0.00 H ATOM 469 HG2 LYS A 468 7.450 -8.289 -7.926 1.00 0.00 H ATOM 470 HG3 LYS A 468 7.564 -7.970 -6.180 1.00 0.00 H ATOM 471 HD2 LYS A 468 6.763 -10.205 -6.412 1.00 0.00 H ATOM 472 HD3 LYS A 468 5.368 -9.216 -5.922 1.00 0.00 H ATOM 473 HE2 LYS A 468 6.024 -10.109 -8.761 1.00 0.00 H ATOM 474 HE3 LYS A 468 4.646 -9.084 -8.296 1.00 0.00 H ATOM 475 HZ1 LYS A 468 5.092 -11.895 -7.434 1.00 0.00 H ATOM 476 HZ2 LYS A 468 3.776 -10.917 -6.990 1.00 0.00 H ATOM 477 HZ3 LYS A 468 3.985 -11.374 -8.613 1.00 0.00 H ATOM 478 H LYS A 468 7.953 -5.328 -6.631 1.00 0.00 H ATOM 479 N SER A 469 5.475 -3.742 -7.859 1.00 28.74 N ATOM 480 CA SER A 469 4.514 -2.680 -8.158 1.00 28.71 C ATOM 481 C SER A 469 4.909 -2.011 -9.469 1.00 27.52 C ATOM 482 O SER A 469 4.072 -1.758 -10.338 1.00 27.22 O ATOM 483 CB SER A 469 4.512 -1.635 -7.038 1.00 29.83 C ATOM 484 OG SER A 469 4.089 -0.369 -7.515 1.00 31.31 O ATOM 485 HA SER A 469 3.516 -3.111 -8.240 1.00 0.00 H ATOM 486 HB2 SER A 469 5.521 -1.544 -6.635 1.00 0.00 H ATOM 487 HB3 SER A 469 3.835 -1.962 -6.249 1.00 0.00 H ATOM 488 HG SER A 469 4.098 0.283 -6.770 1.00 0.00 H ATOM 489 H SER A 469 6.170 -3.604 -7.098 1.00 0.00 H ATOM 490 N PHE A 470 6.197 -1.713 -9.584 1.00 26.09 N ATOM 491 CA PHE A 470 6.755 -1.079 -10.768 1.00 25.10 C ATOM 492 C PHE A 470 6.519 -1.987 -11.984 1.00 24.72 C ATOM 493 O PHE A 470 6.172 -1.530 -13.071 1.00 22.57 O ATOM 494 CB PHE A 470 8.260 -0.841 -10.558 1.00 23.09 C ATOM 495 CG PHE A 470 9.003 -0.589 -11.828 1.00 23.33 C ATOM 496 CD1 PHE A 470 8.915 0.638 -12.468 1.00 23.49 C ATOM 497 CD2 PHE A 470 9.723 -1.614 -12.434 1.00 22.60 C ATOM 498 CE1 PHE A 470 9.534 0.836 -13.705 1.00 24.61 C ATOM 499 CE2 PHE A 470 10.341 -1.426 -13.661 1.00 23.25 C ATOM 500 CZ PHE A 470 10.246 -0.202 -14.298 1.00 22.99 C ATOM 501 HA PHE A 470 6.270 -0.119 -10.943 1.00 0.00 H ATOM 502 HB2 PHE A 470 8.386 0.024 -9.906 1.00 0.00 H ATOM 503 HB3 PHE A 470 8.686 -1.722 -10.077 1.00 0.00 H ATOM 504 HD2 PHE A 470 9.802 -2.580 -11.936 1.00 0.00 H ATOM 505 HE2 PHE A 470 10.900 -2.240 -14.122 1.00 0.00 H ATOM 506 HZ PHE A 470 10.728 -0.051 -15.264 1.00 0.00 H ATOM 507 HE1 PHE A 470 9.459 1.802 -14.205 1.00 0.00 H ATOM 508 HD1 PHE A 470 8.360 1.453 -12.003 1.00 0.00 H ATOM 509 H PHE A 470 6.834 -1.942 -8.795 1.00 0.00 H ATOM 510 N THR A 471 6.711 -3.282 -11.774 1.00 26.14 N ATOM 511 CA THR A 471 6.527 -4.278 -12.813 1.00 27.98 C ATOM 512 C THR A 471 5.059 -4.428 -13.220 1.00 27.91 C ATOM 513 O THR A 471 4.757 -4.541 -14.404 1.00 29.81 O ATOM 514 CB THR A 471 7.063 -5.628 -12.341 1.00 28.95 C ATOM 515 OG1 THR A 471 8.470 -5.507 -12.102 1.00 31.08 O ATOM 516 CG2 THR A 471 6.800 -6.706 -13.378 1.00 28.80 C ATOM 517 HA THR A 471 7.081 -3.938 -13.688 1.00 0.00 H ATOM 518 HB THR A 471 6.553 -5.916 -11.422 1.00 0.00 H ATOM 519 HG1 THR A 471 8.628 -4.821 -11.406 1.00 0.00 H ATOM 520 HG23 THR A 471 5.727 -6.788 -13.551 1.00 0.00 H ATOM 521 HG21 THR A 471 7.300 -6.442 -14.310 1.00 0.00 H ATOM 522 HG22 THR A 471 7.185 -7.659 -13.015 1.00 0.00 H ATOM 523 H THR A 471 7.005 -3.596 -10.827 1.00 0.00 H ATOM 524 N GLU A 472 4.155 -4.442 -12.241 1.00 27.24 N ATOM 525 CA GLU A 472 2.723 -4.554 -12.509 1.00 25.20 C ATOM 526 C GLU A 472 2.226 -3.353 -13.324 1.00 26.26 C ATOM 527 O GLU A 472 1.432 -3.518 -14.250 1.00 27.12 O ATOM 528 CB GLU A 472 1.956 -4.659 -11.190 1.00 24.38 C ATOM 529 CG GLU A 472 0.440 -4.514 -11.297 1.00 24.97 C ATOM 530 CD GLU A 472 -0.202 -5.494 -12.273 1.00 24.10 C ATOM 531 OE1 GLU A 472 0.387 -6.552 -12.570 1.00 23.70 O ATOM 532 OE2 GLU A 472 -1.320 -5.204 -12.732 1.00 26.18 O ATOM 533 HA GLU A 472 2.547 -5.456 -13.096 1.00 0.00 H ATOM 534 HB2 GLU A 472 2.170 -5.635 -10.754 1.00 0.00 H ATOM 535 HB3 GLU A 472 2.322 -3.877 -10.525 1.00 0.00 H ATOM 536 HG2 GLU A 472 0.008 -4.678 -10.310 1.00 0.00 H ATOM 537 HG3 GLU A 472 0.213 -3.500 -11.628 1.00 0.00 H ATOM 538 H GLU A 472 4.479 -4.371 -11.255 1.00 0.00 H ATOM 539 N GLN A 473 2.697 -2.153 -12.980 1.00 27.20 N ATOM 540 CA GLN A 473 2.323 -0.925 -13.699 1.00 27.52 C ATOM 541 C GLN A 473 2.873 -0.979 -15.135 1.00 26.90 C ATOM 542 O GLN A 473 2.171 -0.663 -16.095 1.00 27.74 O ATOM 543 CB GLN A 473 2.883 0.313 -12.981 1.00 29.39 C ATOM 544 CG GLN A 473 2.297 0.574 -11.591 1.00 32.25 C ATOM 545 CD GLN A 473 1.014 1.387 -11.626 1.00 33.86 C ATOM 546 OE1 GLN A 473 0.138 1.165 -12.464 1.00 34.77 O ATOM 547 NE2 GLN A 473 0.895 2.329 -10.704 1.00 35.08 N ATOM 548 HA GLN A 473 1.236 -0.854 -13.724 1.00 0.00 H ATOM 549 HB2 GLN A 473 3.960 0.185 -12.876 1.00 0.00 H ATOM 550 HB3 GLN A 473 2.681 1.185 -13.603 1.00 0.00 H ATOM 551 HG2 GLN A 473 2.087 -0.385 -11.117 1.00 0.00 H ATOM 552 HG3 GLN A 473 3.035 1.116 -11.000 1.00 0.00 H ATOM 553 HE22 GLN A 473 1.659 2.482 -10.016 1.00 0.00 H ATOM 554 HE21 GLN A 473 0.037 2.916 -10.668 1.00 0.00 H ATOM 555 H GLN A 473 3.352 -2.083 -12.175 1.00 0.00 H ATOM 556 N LEU A 474 4.133 -1.391 -15.268 1.00 26.17 N ATOM 557 CA LEU A 474 4.784 -1.511 -16.567 1.00 25.14 C ATOM 558 C LEU A 474 4.053 -2.526 -17.464 1.00 25.76 C ATOM 559 O LEU A 474 3.940 -2.331 -18.678 1.00 25.71 O ATOM 560 CB LEU A 474 6.244 -1.939 -16.373 1.00 22.66 C ATOM 561 CG LEU A 474 7.074 -2.093 -17.651 1.00 21.62 C ATOM 562 CD1 LEU A 474 7.005 -0.838 -18.490 1.00 19.84 C ATOM 563 CD2 LEU A 474 8.494 -2.396 -17.284 1.00 21.25 C ATOM 564 HA LEU A 474 4.749 -0.540 -17.060 1.00 0.00 H ATOM 565 HB2 LEU A 474 6.731 -1.191 -15.747 1.00 0.00 H ATOM 566 HB3 LEU A 474 6.245 -2.899 -15.857 1.00 0.00 H ATOM 567 HG LEU A 474 6.668 -2.914 -18.242 1.00 0.00 H ATOM 568 HD21 LEU A 474 8.895 -1.579 -16.683 1.00 0.00 H ATOM 569 HD22 LEU A 474 8.530 -3.322 -16.710 1.00 0.00 H ATOM 570 HD23 LEU A 474 9.087 -2.506 -18.192 1.00 0.00 H ATOM 571 HD11 LEU A 474 5.968 -0.643 -18.765 1.00 0.00 H ATOM 572 HD12 LEU A 474 7.395 0.003 -17.916 1.00 0.00 H ATOM 573 HD13 LEU A 474 7.602 -0.972 -19.392 1.00 0.00 H ATOM 574 H LEU A 474 4.672 -1.636 -14.413 1.00 0.00 H ATOM 575 N ARG A 475 3.554 -3.599 -16.852 1.00 26.27 N ATOM 576 CA ARG A 475 2.834 -4.648 -17.573 1.00 26.90 C ATOM 577 C ARG A 475 1.549 -4.117 -18.192 1.00 26.12 C ATOM 578 O ARG A 475 1.249 -4.378 -19.348 1.00 25.12 O ATOM 579 CB ARG A 475 2.483 -5.809 -16.628 1.00 27.15 C ATOM 580 CG ARG A 475 1.711 -6.947 -17.308 1.00 27.96 C ATOM 581 CD ARG A 475 1.221 -8.014 -16.311 1.00 28.07 C ATOM 582 NE ARG A 475 0.140 -7.537 -15.443 1.00 29.08 N ATOM 583 CZ ARG A 475 -1.124 -7.370 -15.831 1.00 29.60 C ATOM 584 NH1 ARG A 475 -1.478 -7.649 -17.082 1.00 30.08 N ATOM 585 NH2 ARG A 475 -2.034 -6.918 -14.972 1.00 26.54 N ATOM 586 HA ARG A 475 3.492 -5.001 -18.367 1.00 0.00 H ATOM 587 HB2 ARG A 475 3.410 -6.216 -16.223 1.00 0.00 H ATOM 588 HB3 ARG A 475 1.873 -5.418 -15.814 1.00 0.00 H ATOM 589 HG2 ARG A 475 0.846 -6.525 -17.820 1.00 0.00 H ATOM 590 HG3 ARG A 475 2.365 -7.425 -18.037 1.00 0.00 H ATOM 591 HD2 ARG A 475 2.061 -8.316 -15.685 1.00 0.00 H ATOM 592 HD3 ARG A 475 0.860 -8.875 -16.874 1.00 0.00 H ATOM 593 HE ARG A 475 0.376 -7.313 -14.455 1.00 0.00 H ATOM 594 HH12 ARG A 475 -2.464 -7.519 -17.385 1.00 0.00 H ATOM 595 HH11 ARG A 475 -0.768 -7.998 -17.758 1.00 0.00 H ATOM 596 HH22 ARG A 475 -3.019 -6.789 -15.278 1.00 0.00 H ATOM 597 HH21 ARG A 475 -1.760 -6.694 -13.994 1.00 0.00 H ATOM 598 H ARG A 475 3.681 -3.694 -15.824 1.00 0.00 H ATOM 599 N LYS A 476 0.793 -3.365 -17.404 1.00 27.14 N ATOM 600 CA LYS A 476 -0.469 -2.818 -17.864 1.00 26.07 C ATOM 601 C LYS A 476 -0.346 -1.785 -18.976 1.00 26.29 C ATOM 602 O LYS A 476 -1.059 -1.872 -19.977 1.00 27.77 O ATOM 603 CB LYS A 476 -1.242 -2.237 -16.678 1.00 24.16 C ATOM 604 CG LYS A 476 -1.684 -3.306 -15.695 1.00 22.77 C ATOM 605 CD LYS A 476 -2.693 -2.789 -14.690 1.00 25.18 C ATOM 606 CE LYS A 476 -2.103 -1.718 -13.773 1.00 25.91 C ATOM 607 NZ LYS A 476 -3.039 -1.363 -12.663 1.00 28.26 N ATOM 608 HA LYS A 476 -1.015 -3.651 -18.307 1.00 0.00 H ATOM 609 HB2 LYS A 476 -0.601 -1.526 -16.157 1.00 0.00 H ATOM 610 HB3 LYS A 476 -2.125 -1.721 -17.055 1.00 0.00 H ATOM 611 HG2 LYS A 476 -2.134 -4.128 -16.251 1.00 0.00 H ATOM 612 HG3 LYS A 476 -0.809 -3.670 -15.157 1.00 0.00 H ATOM 613 HD2 LYS A 476 -3.538 -2.362 -15.230 1.00 0.00 H ATOM 614 HD3 LYS A 476 -3.038 -3.623 -14.079 1.00 0.00 H ATOM 615 HE2 LYS A 476 -1.897 -0.824 -14.361 1.00 0.00 H ATOM 616 HE3 LYS A 476 -1.173 -2.092 -13.345 1.00 0.00 H ATOM 617 HZ1 LYS A 476 -3.927 -0.999 -13.063 1.00 0.00 H ATOM 618 HZ2 LYS A 476 -3.236 -2.210 -12.093 1.00 0.00 H ATOM 619 HZ3 LYS A 476 -2.603 -0.634 -12.063 1.00 0.00 H ATOM 620 H LYS A 476 1.112 -3.163 -16.435 1.00 0.00 H ATOM 621 N ILE A 477 0.564 -0.825 -18.823 1.00 25.75 N ATOM 622 CA ILE A 477 0.715 0.221 -19.829 1.00 25.55 C ATOM 623 C ILE A 477 1.381 -0.264 -21.117 1.00 24.99 C ATOM 624 O ILE A 477 1.056 0.217 -22.205 1.00 24.68 O ATOM 625 CB ILE A 477 1.490 1.436 -19.264 1.00 26.45 C ATOM 626 CG1 ILE A 477 1.415 2.596 -20.260 1.00 28.51 C ATOM 627 CG2 ILE A 477 2.930 1.056 -18.977 1.00 24.28 C ATOM 628 CD1 ILE A 477 2.152 3.865 -19.825 1.00 30.85 C ATOM 629 HA ILE A 477 -0.300 0.525 -20.087 1.00 0.00 H ATOM 630 HB ILE A 477 1.036 1.752 -18.325 1.00 0.00 H ATOM 631 HG12 ILE A 477 1.845 2.261 -21.204 1.00 0.00 H ATOM 632 HG13 ILE A 477 0.365 2.848 -20.409 1.00 0.00 H ATOM 633 HD11 ILE A 477 1.728 4.227 -18.888 1.00 0.00 H ATOM 634 HD12 ILE A 477 3.209 3.639 -19.684 1.00 0.00 H ATOM 635 HD13 ILE A 477 2.042 4.629 -20.594 1.00 0.00 H ATOM 636 HG21 ILE A 477 2.952 0.248 -18.246 1.00 0.00 H ATOM 637 HG22 ILE A 477 3.408 0.726 -19.899 1.00 0.00 H ATOM 638 HG23 ILE A 477 3.461 1.922 -18.580 1.00 0.00 H ATOM 639 H ILE A 477 1.172 -0.821 -17.979 1.00 0.00 H ATOM 640 N SER A 478 2.315 -1.203 -21.002 1.00 23.79 N ATOM 641 CA SER A 478 2.959 -1.732 -22.193 1.00 23.44 C ATOM 642 C SER A 478 1.935 -2.622 -22.902 1.00 24.28 C ATOM 643 O SER A 478 1.990 -2.790 -24.113 1.00 25.05 O ATOM 644 CB SER A 478 4.205 -2.544 -21.836 1.00 23.55 C ATOM 645 OG SER A 478 3.886 -3.660 -21.017 1.00 22.38 O ATOM 646 HA SER A 478 3.284 -0.915 -22.837 1.00 0.00 H ATOM 647 HB2 SER A 478 4.905 -1.902 -21.302 1.00 0.00 H ATOM 648 HB3 SER A 478 4.670 -2.901 -22.755 1.00 0.00 H ATOM 649 HG SER A 478 3.468 -3.343 -20.177 1.00 0.00 H ATOM 650 H SER A 478 2.584 -1.558 -20.062 1.00 0.00 H ATOM 651 N ARG A 479 1.001 -3.186 -22.140 1.00 24.73 N ATOM 652 CA ARG A 479 -0.051 -4.029 -22.708 1.00 26.23 C ATOM 653 C ARG A 479 -0.991 -3.127 -23.495 1.00 27.31 C ATOM 654 O ARG A 479 -1.299 -3.382 -24.661 1.00 27.68 O ATOM 655 CB ARG A 479 -0.852 -4.719 -21.602 1.00 27.27 C ATOM 656 CG ARG A 479 -2.181 -5.317 -22.079 1.00 28.53 C ATOM 657 CD ARG A 479 -3.102 -5.645 -20.910 1.00 27.91 C ATOM 658 NE ARG A 479 -3.539 -4.440 -20.201 1.00 30.08 N ATOM 659 CZ ARG A 479 -3.998 -4.432 -18.952 1.00 28.17 C ATOM 660 NH1 ARG A 479 -4.083 -5.565 -18.273 1.00 27.70 N ATOM 661 NH2 ARG A 479 -4.350 -3.297 -18.374 1.00 25.76 N ATOM 662 HA ARG A 479 0.399 -4.794 -23.341 1.00 0.00 H ATOM 663 HB2 ARG A 479 -0.243 -5.522 -21.187 1.00 0.00 H ATOM 664 HB3 ARG A 479 -1.065 -3.986 -20.824 1.00 0.00 H ATOM 665 HG2 ARG A 479 -2.679 -4.599 -22.731 1.00 0.00 H ATOM 666 HG3 ARG A 479 -1.978 -6.231 -22.637 1.00 0.00 H ATOM 667 HD2 ARG A 479 -2.569 -6.291 -20.212 1.00 0.00 H ATOM 668 HD3 ARG A 479 -3.980 -6.168 -21.289 1.00 0.00 H ATOM 669 HE ARG A 479 -3.487 -3.532 -20.706 1.00 0.00 H ATOM 670 HH12 ARG A 479 -4.442 -5.561 -17.297 1.00 0.00 H ATOM 671 HH11 ARG A 479 -3.791 -6.460 -18.716 1.00 0.00 H ATOM 672 HH22 ARG A 479 -4.708 -3.300 -17.397 1.00 0.00 H ATOM 673 HH21 ARG A 479 -4.269 -2.401 -18.896 1.00 0.00 H ATOM 674 H ARG A 479 1.020 -3.023 -21.113 1.00 0.00 H ATOM 675 N ASP A 480 -1.438 -2.064 -22.834 1.00 27.89 N ATOM 676 CA ASP A 480 -2.351 -1.100 -23.434 1.00 28.46 C ATOM 677 C ASP A 480 -1.762 -0.410 -24.653 1.00 28.91 C ATOM 678 O ASP A 480 -2.496 0.101 -25.491 1.00 29.68 O ATOM 679 CB ASP A 480 -2.759 -0.049 -22.399 1.00 27.80 C ATOM 680 CG ASP A 480 -3.463 -0.656 -21.191 1.00 27.56 C ATOM 681 OD1 ASP A 480 -3.615 -1.896 -21.135 1.00 26.93 O ATOM 682 OD2 ASP A 480 -3.863 0.110 -20.290 1.00 28.12 O ATOM 683 HA ASP A 480 -3.225 -1.660 -23.768 1.00 0.00 H ATOM 684 HB2 ASP A 480 -1.864 0.470 -22.057 1.00 0.00 H ATOM 685 HB3 ASP A 480 -3.432 0.665 -22.873 1.00 0.00 H ATOM 686 H ASP A 480 -1.125 -1.915 -21.854 1.00 0.00 H ATOM 687 N ALA A 481 -0.438 -0.394 -24.760 1.00 30.72 N ATOM 688 CA ALA A 481 0.215 0.251 -25.904 1.00 30.96 C ATOM 689 C ALA A 481 0.458 -0.709 -27.065 1.00 30.42 C ATOM 690 O ALA A 481 0.985 -0.311 -28.098 1.00 31.25 O ATOM 691 CB ALA A 481 1.539 0.879 -25.472 1.00 30.91 C ATOM 692 HA ALA A 481 -0.467 1.024 -26.259 1.00 0.00 H ATOM 693 HB1 ALA A 481 1.351 1.626 -24.701 1.00 0.00 H ATOM 694 HB2 ALA A 481 2.195 0.104 -25.077 1.00 0.00 H ATOM 695 HB3 ALA A 481 2.012 1.354 -26.332 1.00 0.00 H ATOM 696 H ALA A 481 0.142 -0.844 -24.024 1.00 0.00 H ATOM 697 N GLY A 482 0.087 -1.972 -26.893 1.00 30.34 N ATOM 698 CA GLY A 482 0.294 -2.941 -27.955 1.00 30.43 C ATOM 699 C GLY A 482 1.684 -3.553 -27.989 1.00 30.72 C ATOM 700 O GLY A 482 2.064 -4.193 -28.970 1.00 31.21 O ATOM 701 HA3 GLY A 482 0.117 -2.444 -28.909 1.00 0.00 H ATOM 702 HA2 GLY A 482 -0.430 -3.746 -27.827 1.00 0.00 H ATOM 703 H GLY A 482 -0.352 -2.268 -25.998 1.00 0.00 H ATOM 704 N MET A 483 2.451 -3.347 -26.924 1.00 30.31 N ATOM 705 CA MET A 483 3.795 -3.902 -26.817 1.00 30.31 C ATOM 706 C MET A 483 3.892 -4.592 -25.448 1.00 29.73 C ATOM 707 O MET A 483 4.761 -4.288 -24.638 1.00 29.78 O ATOM 708 CB MET A 483 4.836 -2.789 -26.939 1.00 29.73 C ATOM 709 CG MET A 483 4.619 -1.623 -25.982 1.00 31.91 C ATOM 710 SD MET A 483 6.082 -0.559 -25.809 1.00 33.22 S ATOM 711 CE MET A 483 7.198 -1.707 -24.918 1.00 28.40 C ATOM 712 HA MET A 483 3.988 -4.617 -27.617 1.00 0.00 H ATOM 713 HB2 MET A 483 5.819 -3.216 -26.740 1.00 0.00 H ATOM 714 HB3 MET A 483 4.808 -2.405 -27.959 1.00 0.00 H ATOM 715 HG2 MET A 483 4.363 -2.023 -25.001 1.00 0.00 H ATOM 716 HG3 MET A 483 3.792 -1.018 -26.354 1.00 0.00 H ATOM 717 HE1 MET A 483 6.741 -1.993 -23.971 1.00 0.00 H ATOM 718 HE2 MET A 483 7.364 -2.596 -25.526 1.00 0.00 H ATOM 719 HE3 MET A 483 8.151 -1.212 -24.729 1.00 0.00 H ATOM 720 H MET A 483 2.081 -2.771 -26.141 1.00 0.00 H ATOM 721 N PRO A 484 2.996 -5.552 -25.189 1.00 29.25 N ATOM 722 CA PRO A 484 2.938 -6.300 -23.932 1.00 29.93 C ATOM 723 C PRO A 484 4.234 -6.885 -23.370 1.00 30.13 C ATOM 724 O PRO A 484 4.983 -7.562 -24.075 1.00 31.18 O ATOM 725 CB PRO A 484 1.899 -7.386 -24.234 1.00 29.38 C ATOM 726 CG PRO A 484 2.082 -7.616 -25.700 1.00 28.53 C ATOM 727 CD PRO A 484 2.146 -6.200 -26.204 1.00 28.70 C ATOM 728 HA PRO A 484 2.691 -5.616 -23.120 1.00 0.00 H ATOM 729 HD3 PRO A 484 2.602 -6.151 -27.193 1.00 0.00 H ATOM 730 HD2 PRO A 484 1.155 -5.747 -26.240 1.00 0.00 H ATOM 731 HG3 PRO A 484 1.239 -8.157 -26.129 1.00 0.00 H ATOM 732 HG2 PRO A 484 3.004 -8.158 -25.909 1.00 0.00 H ATOM 733 HB2 PRO A 484 2.101 -8.293 -23.665 1.00 0.00 H ATOM 734 HB3 PRO A 484 0.890 -7.038 -24.013 1.00 0.00 H ATOM 735 N ILE A 485 4.480 -6.605 -22.093 1.00 29.66 N ATOM 736 CA ILE A 485 5.637 -7.120 -21.359 1.00 31.12 C ATOM 737 C ILE A 485 5.008 -8.035 -20.314 1.00 31.96 C ATOM 738 O ILE A 485 4.211 -7.575 -19.494 1.00 32.75 O ATOM 739 CB ILE A 485 6.408 -5.999 -20.602 1.00 30.27 C ATOM 740 CG1 ILE A 485 7.141 -5.095 -21.590 1.00 29.08 C ATOM 741 CG2 ILE A 485 7.376 -6.619 -19.600 1.00 28.41 C ATOM 742 CD1 ILE A 485 7.867 -3.934 -20.927 1.00 28.76 C ATOM 743 HA ILE A 485 6.349 -7.595 -22.034 1.00 0.00 H ATOM 744 HB ILE A 485 5.695 -5.384 -20.054 1.00 0.00 H ATOM 745 HG12 ILE A 485 7.872 -5.696 -22.131 1.00 0.00 H ATOM 746 HG13 ILE A 485 6.413 -4.691 -22.293 1.00 0.00 H ATOM 747 HD11 ILE A 485 7.147 -3.316 -20.390 1.00 0.00 H ATOM 748 HD12 ILE A 485 8.607 -4.322 -20.228 1.00 0.00 H ATOM 749 HD13 ILE A 485 8.365 -3.335 -21.690 1.00 0.00 H ATOM 750 HG21 ILE A 485 6.818 -7.220 -18.882 1.00 0.00 H ATOM 751 HG22 ILE A 485 8.089 -7.252 -20.129 1.00 0.00 H ATOM 752 HG23 ILE A 485 7.911 -5.827 -19.075 1.00 0.00 H ATOM 753 H ILE A 485 3.814 -5.986 -21.588 1.00 0.00 H ATOM 754 N GLN A 486 5.343 -9.319 -20.323 1.00 33.56 N ATOM 755 CA GLN A 486 4.714 -10.195 -19.351 1.00 36.39 C ATOM 756 C GLN A 486 5.146 -9.859 -17.930 1.00 36.02 C ATOM 757 O GLN A 486 6.337 -9.799 -17.614 1.00 37.01 O ATOM 758 CB GLN A 486 4.974 -11.666 -19.675 1.00 38.21 C ATOM 759 CG GLN A 486 6.282 -12.210 -19.200 1.00 41.25 C ATOM 760 CD GLN A 486 6.259 -13.721 -19.178 1.00 43.52 C ATOM 761 OE1 GLN A 486 6.057 -14.362 -20.213 1.00 44.85 O ATOM 762 NE2 GLN A 486 6.452 -14.304 -17.992 1.00 44.72 N ATOM 763 HA GLN A 486 3.639 -10.027 -19.414 1.00 0.00 H ATOM 764 HB2 GLN A 486 4.179 -12.256 -19.218 1.00 0.00 H ATOM 765 HB3 GLN A 486 4.935 -11.783 -20.758 1.00 0.00 H ATOM 766 HG2 GLN A 486 7.073 -11.874 -19.870 1.00 0.00 H ATOM 767 HG3 GLN A 486 6.479 -11.841 -18.194 1.00 0.00 H ATOM 768 HE22 GLN A 486 6.619 -13.721 -17.147 1.00 0.00 H ATOM 769 HE21 GLN A 486 6.436 -15.341 -17.913 1.00 0.00 H ATOM 770 H GLN A 486 6.036 -9.687 -21.006 1.00 0.00 H ATOM 771 N GLY A 487 4.140 -9.624 -17.093 1.00 35.80 N ATOM 772 CA GLY A 487 4.342 -9.253 -15.707 1.00 34.44 C ATOM 773 C GLY A 487 5.216 -10.129 -14.844 1.00 33.05 C ATOM 774 O GLY A 487 5.471 -9.779 -13.699 1.00 34.19 O ATOM 775 HA3 GLY A 487 3.359 -9.217 -15.237 1.00 0.00 H ATOM 776 HA2 GLY A 487 4.782 -8.256 -15.702 1.00 0.00 H ATOM 777 H GLY A 487 3.166 -9.710 -17.448 1.00 0.00 H ATOM 778 N GLN A 488 5.679 -11.257 -15.364 1.00 32.59 N ATOM 779 CA GLN A 488 6.529 -12.135 -14.570 1.00 32.31 C ATOM 780 C GLN A 488 7.925 -12.277 -15.173 1.00 30.28 C ATOM 781 O GLN A 488 8.116 -12.996 -16.152 1.00 29.05 O ATOM 782 CB GLN A 488 5.876 -13.513 -14.438 1.00 35.07 C ATOM 783 CG GLN A 488 6.656 -14.504 -13.585 1.00 38.57 C ATOM 784 CD GLN A 488 6.982 -13.961 -12.205 1.00 40.32 C ATOM 785 OE1 GLN A 488 6.170 -13.266 -11.581 1.00 40.94 O ATOM 786 NE2 GLN A 488 8.173 -14.284 -11.715 1.00 42.81 N ATOM 787 HA GLN A 488 6.640 -11.684 -13.584 1.00 0.00 H ATOM 788 HB2 GLN A 488 4.890 -13.381 -13.991 1.00 0.00 H ATOM 789 HB3 GLN A 488 5.767 -13.935 -15.437 1.00 0.00 H ATOM 790 HG2 GLN A 488 6.061 -15.410 -13.472 1.00 0.00 H ATOM 791 HG3 GLN A 488 7.589 -14.744 -14.095 1.00 0.00 H ATOM 792 HE22 GLN A 488 8.824 -14.871 -12.275 1.00 0.00 H ATOM 793 HE21 GLN A 488 8.455 -13.950 -10.771 1.00 0.00 H ATOM 794 H GLN A 488 5.435 -11.516 -16.341 1.00 0.00 H ATOM 795 N PRO A 489 8.919 -11.581 -14.599 1.00 28.86 N ATOM 796 CA PRO A 489 10.276 -11.687 -15.140 1.00 27.93 C ATOM 797 C PRO A 489 10.838 -13.051 -14.771 1.00 27.11 C ATOM 798 O PRO A 489 10.494 -13.605 -13.730 1.00 27.57 O ATOM 799 CB PRO A 489 11.010 -10.542 -14.449 1.00 27.08 C ATOM 800 CG PRO A 489 10.368 -10.523 -13.097 1.00 26.76 C ATOM 801 CD PRO A 489 8.890 -10.668 -13.442 1.00 29.03 C ATOM 802 HA PRO A 489 10.353 -11.612 -16.225 1.00 0.00 H ATOM 803 HD3 PRO A 489 8.332 -11.102 -12.612 1.00 0.00 H ATOM 804 HD2 PRO A 489 8.452 -9.707 -13.710 1.00 0.00 H ATOM 805 HG3 PRO A 489 10.563 -9.584 -12.579 1.00 0.00 H ATOM 806 HG2 PRO A 489 10.714 -11.354 -12.483 1.00 0.00 H ATOM 807 HB2 PRO A 489 12.079 -10.744 -14.376 1.00 0.00 H ATOM 808 HB3 PRO A 489 10.855 -9.599 -14.974 1.00 0.00 H ATOM 809 N CYS A 490 11.696 -13.588 -15.627 1.00 26.26 N ATOM 810 CA CYS A 490 12.294 -14.895 -15.396 1.00 25.08 C ATOM 811 C CYS A 490 13.389 -14.820 -14.346 1.00 23.54 C ATOM 812 O CYS A 490 13.935 -15.841 -13.932 1.00 24.17 O ATOM 813 CB CYS A 490 12.907 -15.410 -16.699 1.00 27.79 C ATOM 814 SG CYS A 490 14.373 -14.449 -17.259 1.00 31.30 S ATOM 815 HA CYS A 490 11.511 -15.567 -15.044 1.00 0.00 H ATOM 816 HB2 CYS A 490 12.147 -15.364 -17.479 1.00 0.00 H ATOM 817 HB3 CYS A 490 13.211 -16.446 -16.550 1.00 0.00 H ATOM 818 HG CYS A 490 14.007 -13.135 -17.468 1.00 0.00 H ATOM 819 H CYS A 490 11.949 -13.061 -16.487 1.00 0.00 H ATOM 820 N PHE A 491 13.712 -13.611 -13.913 1.00 22.05 N ATOM 821 CA PHE A 491 14.797 -13.435 -12.962 1.00 22.15 C ATOM 822 C PHE A 491 14.713 -12.050 -12.354 1.00 22.98 C ATOM 823 O PHE A 491 14.468 -11.068 -13.050 1.00 24.68 O ATOM 824 CB PHE A 491 16.127 -13.603 -13.713 1.00 21.66 C ATOM 825 CG PHE A 491 17.358 -13.303 -12.894 1.00 23.12 C ATOM 826 CD1 PHE A 491 18.127 -14.340 -12.357 1.00 22.52 C ATOM 827 CD2 PHE A 491 17.778 -11.982 -12.691 1.00 21.90 C ATOM 828 CE1 PHE A 491 19.296 -14.069 -11.636 1.00 22.73 C ATOM 829 CE2 PHE A 491 18.946 -11.699 -11.966 1.00 21.74 C ATOM 830 CZ PHE A 491 19.705 -12.745 -11.441 1.00 21.66 C ATOM 831 HA PHE A 491 14.728 -14.172 -12.162 1.00 0.00 H ATOM 832 HB2 PHE A 491 16.193 -14.634 -14.060 1.00 0.00 H ATOM 833 HB3 PHE A 491 16.119 -12.932 -14.572 1.00 0.00 H ATOM 834 HD2 PHE A 491 17.189 -11.162 -13.102 1.00 0.00 H ATOM 835 HE2 PHE A 491 19.259 -10.666 -11.814 1.00 0.00 H ATOM 836 HZ PHE A 491 20.615 -12.531 -10.880 1.00 0.00 H ATOM 837 HE1 PHE A 491 19.887 -14.888 -11.227 1.00 0.00 H ATOM 838 HD1 PHE A 491 17.812 -15.373 -12.502 1.00 0.00 H ATOM 839 H PHE A 491 13.186 -12.782 -14.256 1.00 0.00 H ATOM 840 N CYS A 492 14.907 -11.972 -11.051 1.00 23.80 N ATOM 841 CA CYS A 492 14.888 -10.692 -10.376 1.00 26.98 C ATOM 842 C CYS A 492 15.778 -10.785 -9.156 1.00 26.38 C ATOM 843 O CYS A 492 15.457 -11.500 -8.212 1.00 27.70 O ATOM 844 CB CYS A 492 13.469 -10.311 -9.958 1.00 27.79 C ATOM 845 SG CYS A 492 13.366 -8.672 -9.188 1.00 32.60 S ATOM 846 HA CYS A 492 15.251 -9.921 -11.055 1.00 0.00 H ATOM 847 HB2 CYS A 492 13.107 -11.052 -9.245 1.00 0.00 H ATOM 848 HB3 CYS A 492 12.833 -10.319 -10.843 1.00 0.00 H ATOM 849 HG CYS A 492 12.056 -8.409 -8.843 1.00 0.00 H ATOM 850 H CYS A 492 15.075 -12.840 -10.503 1.00 0.00 H ATOM 851 N LYS A 493 16.901 -10.070 -9.181 1.00 26.64 N ATOM 852 CA LYS A 493 17.836 -10.091 -8.057 1.00 26.47 C ATOM 853 C LYS A 493 18.573 -8.771 -7.816 1.00 24.37 C ATOM 854 O LYS A 493 18.704 -7.939 -8.709 1.00 24.08 O ATOM 855 CB LYS A 493 18.853 -11.222 -8.250 1.00 28.20 C ATOM 856 CG LYS A 493 18.246 -12.625 -8.146 1.00 33.34 C ATOM 857 CD LYS A 493 19.298 -13.728 -8.309 1.00 34.25 C ATOM 858 CE LYS A 493 18.671 -15.125 -8.267 1.00 36.31 C ATOM 859 NZ LYS A 493 19.643 -16.224 -8.606 1.00 38.34 N ATOM 860 HA LYS A 493 17.227 -10.258 -7.169 1.00 0.00 H ATOM 861 HB2 LYS A 493 19.303 -11.115 -9.237 1.00 0.00 H ATOM 862 HB3 LYS A 493 19.625 -11.124 -7.487 1.00 0.00 H ATOM 863 HG2 LYS A 493 17.774 -12.732 -7.169 1.00 0.00 H ATOM 864 HG3 LYS A 493 17.493 -12.740 -8.926 1.00 0.00 H ATOM 865 HD2 LYS A 493 19.802 -13.596 -9.266 1.00 0.00 H ATOM 866 HD3 LYS A 493 20.026 -13.643 -7.502 1.00 0.00 H ATOM 867 HE2 LYS A 493 17.849 -15.157 -8.982 1.00 0.00 H ATOM 868 HE3 LYS A 493 18.285 -15.301 -7.263 1.00 0.00 H ATOM 869 HZ1 LYS A 493 20.012 -16.074 -9.567 1.00 0.00 H ATOM 870 HZ2 LYS A 493 20.429 -16.212 -7.925 1.00 0.00 H ATOM 871 HZ3 LYS A 493 19.156 -17.142 -8.559 1.00 0.00 H ATOM 872 H LYS A 493 17.117 -9.487 -10.014 1.00 0.00 H ATOM 873 N TYR A 494 19.035 -8.582 -6.587 1.00 23.23 N ATOM 874 CA TYR A 494 19.783 -7.386 -6.217 1.00 23.75 C ATOM 875 C TYR A 494 21.264 -7.666 -6.412 1.00 24.72 C ATOM 876 O TYR A 494 21.700 -8.810 -6.309 1.00 25.53 O ATOM 877 CB TYR A 494 19.534 -7.040 -4.754 1.00 22.99 C ATOM 878 CG TYR A 494 18.138 -6.551 -4.472 1.00 23.03 C ATOM 879 CD1 TYR A 494 17.761 -5.247 -4.789 1.00 22.38 C ATOM 880 CD2 TYR A 494 17.191 -7.393 -3.888 1.00 24.10 C ATOM 881 CE1 TYR A 494 16.483 -4.788 -4.527 1.00 24.03 C ATOM 882 CE2 TYR A 494 15.905 -6.946 -3.621 1.00 25.30 C ATOM 883 CZ TYR A 494 15.560 -5.641 -3.939 1.00 24.94 C ATOM 884 OH TYR A 494 14.307 -5.173 -3.635 1.00 27.87 O ATOM 885 HA TYR A 494 19.462 -6.550 -6.839 1.00 0.00 H ATOM 886 HB3 TYR A 494 20.237 -6.260 -4.461 1.00 0.00 H ATOM 887 HB2 TYR A 494 19.713 -7.933 -4.155 1.00 0.00 H ATOM 888 HD2 TYR A 494 17.466 -8.418 -3.638 1.00 0.00 H ATOM 889 HE2 TYR A 494 15.173 -7.614 -3.166 1.00 0.00 H ATOM 890 HE1 TYR A 494 16.203 -3.765 -4.780 1.00 0.00 H ATOM 891 HD1 TYR A 494 18.486 -4.577 -5.251 1.00 0.00 H ATOM 892 HH TYR A 494 14.228 -4.231 -3.928 1.00 0.00 H ATOM 893 H TYR A 494 18.858 -9.309 -5.865 1.00 0.00 H ATOM 894 N ALA A 495 22.037 -6.626 -6.696 1.00 25.38 N ATOM 895 CA ALA A 495 23.475 -6.781 -6.888 1.00 26.38 C ATOM 896 C ALA A 495 24.140 -5.459 -6.541 1.00 28.38 C ATOM 897 O ALA A 495 23.467 -4.434 -6.444 1.00 28.50 O ATOM 898 CB ALA A 495 23.774 -7.161 -8.329 1.00 25.12 C ATOM 899 HA ALA A 495 23.859 -7.574 -6.246 1.00 0.00 H ATOM 900 HB1 ALA A 495 23.278 -8.102 -8.565 1.00 0.00 H ATOM 901 HB2 ALA A 495 23.407 -6.379 -8.993 1.00 0.00 H ATOM 902 HB3 ALA A 495 24.851 -7.273 -8.458 1.00 0.00 H ATOM 903 H ALA A 495 21.610 -5.682 -6.783 1.00 0.00 H ATOM 904 N GLN A 496 25.452 -5.472 -6.348 1.00 30.24 N ATOM 905 CA GLN A 496 26.151 -4.237 -6.009 1.00 32.51 C ATOM 906 C GLN A 496 27.464 -4.083 -6.740 1.00 31.11 C ATOM 907 O GLN A 496 28.220 -5.040 -6.884 1.00 31.58 O ATOM 908 CB GLN A 496 26.457 -4.172 -4.524 1.00 35.01 C ATOM 909 CG GLN A 496 25.418 -4.780 -3.621 1.00 40.65 C ATOM 910 CD GLN A 496 25.864 -4.708 -2.180 1.00 43.75 C ATOM 911 OE1 GLN A 496 25.949 -3.621 -1.604 1.00 45.69 O ATOM 912 NE2 GLN A 496 26.180 -5.863 -1.595 1.00 45.29 N ATOM 913 HA GLN A 496 25.475 -3.436 -6.308 1.00 0.00 H ATOM 914 HB2 GLN A 496 27.399 -4.693 -4.352 1.00 0.00 H ATOM 915 HB3 GLN A 496 26.569 -3.123 -4.249 1.00 0.00 H ATOM 916 HG2 GLN A 496 24.480 -4.236 -3.735 1.00 0.00 H ATOM 917 HG3 GLN A 496 25.267 -5.823 -3.899 1.00 0.00 H ATOM 918 HE22 GLN A 496 26.091 -6.755 -2.123 1.00 0.00 H ATOM 919 HE21 GLN A 496 26.515 -5.873 -0.611 1.00 0.00 H ATOM 920 H GLN A 496 25.982 -6.362 -6.438 1.00 0.00 H ATOM 921 N GLY A 497 27.728 -2.865 -7.187 1.00 30.77 N ATOM 922 CA GLY A 497 28.969 -2.574 -7.870 1.00 30.94 C ATOM 923 C GLY A 497 29.054 -3.010 -9.310 1.00 30.08 C ATOM 924 O GLY A 497 28.520 -4.048 -9.701 1.00 31.82 O ATOM 925 HA3 GLY A 497 29.773 -3.068 -7.325 1.00 0.00 H ATOM 926 HA2 GLY A 497 29.121 -1.495 -7.839 1.00 0.00 H ATOM 927 H GLY A 497 27.032 -2.106 -7.045 1.00 0.00 H ATOM 928 N ALA A 498 29.755 -2.195 -10.090 1.00 30.38 N ATOM 929 CA ALA A 498 29.980 -2.428 -11.506 1.00 29.48 C ATOM 930 C ALA A 498 30.557 -3.820 -11.738 1.00 29.75 C ATOM 931 O ALA A 498 30.225 -4.485 -12.720 1.00 29.59 O ATOM 932 CB ALA A 498 30.933 -1.376 -12.046 1.00 27.95 C ATOM 933 HA ALA A 498 29.026 -2.361 -12.029 1.00 0.00 H ATOM 934 HB1 ALA A 498 30.498 -0.387 -11.904 1.00 0.00 H ATOM 935 HB2 ALA A 498 31.881 -1.438 -11.511 1.00 0.00 H ATOM 936 HB3 ALA A 498 31.101 -1.551 -13.109 1.00 0.00 H ATOM 937 H ALA A 498 30.166 -1.341 -9.662 1.00 0.00 H ATOM 938 N ASP A 499 31.420 -4.257 -10.829 1.00 29.97 N ATOM 939 CA ASP A 499 32.053 -5.564 -10.951 1.00 31.47 C ATOM 940 C ASP A 499 31.082 -6.734 -10.953 1.00 31.11 C ATOM 941 O ASP A 499 31.426 -7.830 -11.399 1.00 30.11 O ATOM 942 CB ASP A 499 33.095 -5.740 -9.844 1.00 32.42 C ATOM 943 CG ASP A 499 34.439 -5.149 -10.224 1.00 35.22 C ATOM 944 OD1 ASP A 499 34.453 -4.214 -11.052 1.00 37.13 O ATOM 945 OD2 ASP A 499 35.477 -5.606 -9.703 1.00 35.42 O ATOM 946 HA ASP A 499 32.530 -5.579 -11.931 1.00 0.00 H ATOM 947 HB2 ASP A 499 32.736 -5.245 -8.942 1.00 0.00 H ATOM 948 HB3 ASP A 499 33.222 -6.804 -9.647 1.00 0.00 H ATOM 949 H ASP A 499 31.649 -3.654 -10.013 1.00 0.00 H ATOM 950 N SER A 500 29.869 -6.501 -10.458 1.00 31.06 N ATOM 951 CA SER A 500 28.854 -7.543 -10.412 1.00 31.40 C ATOM 952 C SER A 500 28.183 -7.757 -11.759 1.00 30.23 C ATOM 953 O SER A 500 27.660 -8.830 -12.035 1.00 30.65 O ATOM 954 CB SER A 500 27.782 -7.184 -9.388 1.00 32.74 C ATOM 955 OG SER A 500 28.063 -7.792 -8.146 1.00 38.69 O ATOM 956 HA SER A 500 29.363 -8.465 -10.132 1.00 0.00 H ATOM 957 HB2 SER A 500 26.813 -7.530 -9.746 1.00 0.00 H ATOM 958 HB3 SER A 500 27.755 -6.102 -9.260 1.00 0.00 H ATOM 959 HG SER A 500 27.359 -7.549 -7.494 1.00 0.00 H ATOM 960 H SER A 500 29.641 -5.553 -10.096 1.00 0.00 H ATOM 961 N VAL A 501 28.214 -6.720 -12.587 1.00 29.10 N ATOM 962 CA VAL A 501 27.577 -6.728 -13.889 1.00 27.96 C ATOM 963 C VAL A 501 27.922 -7.880 -14.817 1.00 28.23 C ATOM 964 O VAL A 501 27.044 -8.661 -15.189 1.00 28.07 O ATOM 965 CB VAL A 501 27.835 -5.389 -14.624 1.00 27.25 C ATOM 966 CG1 VAL A 501 27.157 -5.386 -15.985 1.00 26.53 C ATOM 967 CG2 VAL A 501 27.310 -4.240 -13.788 1.00 28.08 C ATOM 968 HA VAL A 501 26.522 -6.869 -13.652 1.00 0.00 H ATOM 969 HB VAL A 501 28.909 -5.273 -14.771 1.00 0.00 H ATOM 970 HG11 VAL A 501 27.553 -6.203 -16.589 1.00 0.00 H ATOM 971 HG12 VAL A 501 26.083 -5.517 -15.855 1.00 0.00 H ATOM 972 HG13 VAL A 501 27.351 -4.437 -16.484 1.00 0.00 H ATOM 973 HG21 VAL A 501 26.239 -4.367 -13.631 1.00 0.00 H ATOM 974 HG22 VAL A 501 27.821 -4.229 -12.825 1.00 0.00 H ATOM 975 HG23 VAL A 501 27.493 -3.300 -14.309 1.00 0.00 H ATOM 976 H VAL A 501 28.719 -5.862 -12.288 1.00 0.00 H ATOM 977 N GLU A 502 29.187 -7.996 -15.202 1.00 27.97 N ATOM 978 CA GLU A 502 29.572 -9.053 -16.133 1.00 26.42 C ATOM 979 C GLU A 502 29.187 -10.445 -15.640 1.00 25.92 C ATOM 980 O GLU A 502 28.558 -11.213 -16.368 1.00 24.80 O ATOM 981 CB GLU A 502 31.072 -8.981 -16.449 1.00 25.41 C ATOM 982 CG GLU A 502 31.547 -10.046 -17.457 1.00 28.99 C ATOM 983 CD GLU A 502 32.806 -9.649 -18.231 1.00 28.74 C ATOM 984 OE1 GLU A 502 33.577 -8.797 -17.735 1.00 30.10 O ATOM 985 OE2 GLU A 502 33.030 -10.204 -19.331 1.00 27.99 O ATOM 986 HA GLU A 502 29.010 -8.881 -17.051 1.00 0.00 H ATOM 987 HB2 GLU A 502 31.290 -7.996 -16.861 1.00 0.00 H ATOM 988 HB3 GLU A 502 31.626 -9.115 -15.520 1.00 0.00 H ATOM 989 HG2 GLU A 502 31.755 -10.967 -16.912 1.00 0.00 H ATOM 990 HG3 GLU A 502 30.745 -10.223 -18.173 1.00 0.00 H ATOM 991 H GLU A 502 29.904 -7.334 -14.841 1.00 0.00 H ATOM 992 N PRO A 503 29.543 -10.785 -14.391 1.00 25.37 N ATOM 993 CA PRO A 503 29.181 -12.115 -13.898 1.00 26.22 C ATOM 994 C PRO A 503 27.676 -12.363 -13.993 1.00 26.33 C ATOM 995 O PRO A 503 27.248 -13.416 -14.464 1.00 26.87 O ATOM 996 CB PRO A 503 29.671 -12.094 -12.451 1.00 25.32 C ATOM 997 CG PRO A 503 30.835 -11.167 -12.512 1.00 25.51 C ATOM 998 CD PRO A 503 30.305 -10.045 -13.374 1.00 25.41 C ATOM 999 HA PRO A 503 29.624 -12.923 -14.481 1.00 0.00 H ATOM 1000 HD3 PRO A 503 29.661 -9.375 -12.804 1.00 0.00 H ATOM 1001 HD2 PRO A 503 31.116 -9.472 -13.824 1.00 0.00 H ATOM 1002 HG3 PRO A 503 31.698 -11.646 -12.973 1.00 0.00 H ATOM 1003 HG2 PRO A 503 31.107 -10.808 -11.519 1.00 0.00 H ATOM 1004 HB2 PRO A 503 28.900 -11.714 -11.780 1.00 0.00 H ATOM 1005 HB3 PRO A 503 29.977 -13.088 -12.125 1.00 0.00 H ATOM 1006 N MET A 504 26.875 -11.392 -13.559 1.00 25.76 N ATOM 1007 CA MET A 504 25.424 -11.556 -13.597 1.00 26.22 C ATOM 1008 C MET A 504 24.870 -11.706 -15.017 1.00 25.37 C ATOM 1009 O MET A 504 24.029 -12.571 -15.286 1.00 24.57 O ATOM 1010 CB MET A 504 24.734 -10.387 -12.903 1.00 25.51 C ATOM 1011 CG MET A 504 23.240 -10.582 -12.811 1.00 26.83 C ATOM 1012 SD MET A 504 22.382 -9.238 -12.007 1.00 29.65 S ATOM 1013 CE MET A 504 22.324 -9.856 -10.330 1.00 31.12 C ATOM 1014 HA MET A 504 25.211 -12.484 -13.067 1.00 0.00 H ATOM 1015 HB2 MET A 504 25.138 -10.288 -11.896 1.00 0.00 H ATOM 1016 HB3 MET A 504 24.936 -9.475 -13.466 1.00 0.00 H ATOM 1017 HG2 MET A 504 23.047 -11.497 -12.250 1.00 0.00 H ATOM 1018 HG3 MET A 504 22.845 -10.686 -13.821 1.00 0.00 H ATOM 1019 HE1 MET A 504 21.781 -10.801 -10.311 1.00 0.00 H ATOM 1020 HE2 MET A 504 23.340 -10.012 -9.966 1.00 0.00 H ATOM 1021 HE3 MET A 504 21.816 -9.131 -9.694 1.00 0.00 H ATOM 1022 H MET A 504 27.285 -10.510 -13.190 1.00 0.00 H ATOM 1023 N PHE A 505 25.341 -10.863 -15.925 1.00 25.48 N ATOM 1024 CA PHE A 505 24.888 -10.919 -17.307 1.00 25.91 C ATOM 1025 C PHE A 505 25.312 -12.237 -17.949 1.00 25.74 C ATOM 1026 O PHE A 505 24.535 -12.879 -18.661 1.00 24.12 O ATOM 1027 CB PHE A 505 25.440 -9.722 -18.087 1.00 26.23 C ATOM 1028 CG PHE A 505 24.713 -8.437 -17.804 1.00 27.02 C ATOM 1029 CD1 PHE A 505 23.976 -8.280 -16.626 1.00 27.60 C ATOM 1030 CD2 PHE A 505 24.762 -7.380 -18.706 1.00 26.90 C ATOM 1031 CE1 PHE A 505 23.299 -7.093 -16.355 1.00 25.39 C ATOM 1032 CE2 PHE A 505 24.091 -6.192 -18.441 1.00 27.40 C ATOM 1033 CZ PHE A 505 23.358 -6.051 -17.263 1.00 26.43 C ATOM 1034 HA PHE A 505 23.799 -10.869 -17.329 1.00 0.00 H ATOM 1035 HB2 PHE A 505 26.489 -9.591 -17.822 1.00 0.00 H ATOM 1036 HB3 PHE A 505 25.360 -9.937 -19.153 1.00 0.00 H ATOM 1037 HD2 PHE A 505 25.332 -7.484 -19.629 1.00 0.00 H ATOM 1038 HE2 PHE A 505 24.138 -5.370 -19.155 1.00 0.00 H ATOM 1039 HZ PHE A 505 22.831 -5.119 -17.058 1.00 0.00 H ATOM 1040 HE1 PHE A 505 22.727 -6.986 -15.434 1.00 0.00 H ATOM 1041 HD1 PHE A 505 23.931 -9.099 -15.909 1.00 0.00 H ATOM 1042 H PHE A 505 26.045 -10.151 -15.646 1.00 0.00 H ATOM 1043 N ARG A 506 26.544 -12.650 -17.695 1.00 25.52 N ATOM 1044 CA ARG A 506 26.986 -13.908 -18.250 1.00 26.01 C ATOM 1045 C ARG A 506 26.065 -15.000 -17.728 1.00 26.24 C ATOM 1046 O ARG A 506 25.642 -15.869 -18.491 1.00 27.89 O ATOM 1047 CB ARG A 506 28.436 -14.182 -17.866 1.00 26.04 C ATOM 1048 CG ARG A 506 29.412 -13.397 -18.731 1.00 29.31 C ATOM 1049 CD ARG A 506 30.870 -13.605 -18.345 1.00 28.59 C ATOM 1050 NE ARG A 506 31.725 -12.784 -19.189 1.00 28.89 N ATOM 1051 CZ ARG A 506 31.912 -12.990 -20.487 1.00 31.14 C ATOM 1052 NH1 ARG A 506 32.700 -12.179 -21.170 1.00 32.38 N ATOM 1053 NH2 ARG A 506 31.330 -14.018 -21.100 1.00 31.19 N ATOM 1054 HA ARG A 506 26.942 -13.878 -19.339 1.00 0.00 H ATOM 1055 HB2 ARG A 506 28.584 -13.900 -16.823 1.00 0.00 H ATOM 1056 HB3 ARG A 506 28.637 -15.247 -17.985 1.00 0.00 H ATOM 1057 HG2 ARG A 506 29.282 -13.708 -19.768 1.00 0.00 H ATOM 1058 HG3 ARG A 506 29.179 -12.336 -18.639 1.00 0.00 H ATOM 1059 HD2 ARG A 506 31.133 -14.655 -18.475 1.00 0.00 H ATOM 1060 HD3 ARG A 506 31.012 -13.323 -17.302 1.00 0.00 H ATOM 1061 HE ARG A 506 32.222 -11.984 -18.747 1.00 0.00 H ATOM 1062 HH12 ARG A 506 32.851 -12.335 -22.187 1.00 0.00 H ATOM 1063 HH11 ARG A 506 33.170 -11.385 -20.691 1.00 0.00 H ATOM 1064 HH22 ARG A 506 31.483 -14.171 -22.117 1.00 0.00 H ATOM 1065 HH21 ARG A 506 30.723 -14.668 -20.562 1.00 0.00 H ATOM 1066 H ARG A 506 27.183 -12.078 -17.106 1.00 0.00 H ATOM 1067 N HIS A 507 25.740 -14.945 -16.434 1.00 25.27 N ATOM 1068 CA HIS A 507 24.843 -15.935 -15.822 1.00 25.59 C ATOM 1069 C HIS A 507 23.496 -15.983 -16.530 1.00 24.51 C ATOM 1070 O HIS A 507 22.998 -17.056 -16.859 1.00 25.61 O ATOM 1071 CB HIS A 507 24.582 -15.618 -14.352 1.00 25.87 C ATOM 1072 CG HIS A 507 23.424 -16.374 -13.776 1.00 26.30 C ATOM 1073 ND1 HIS A 507 23.489 -17.716 -13.466 1.00 27.17 N ATOM 1074 CD2 HIS A 507 22.158 -15.985 -13.490 1.00 27.08 C ATOM 1075 CE1 HIS A 507 22.316 -18.120 -13.013 1.00 25.81 C ATOM 1076 NE2 HIS A 507 21.490 -17.090 -13.018 1.00 27.39 N ATOM 1077 HA HIS A 507 25.347 -16.897 -15.914 1.00 0.00 H ATOM 1078 HB2 HIS A 507 25.476 -15.867 -13.781 1.00 0.00 H ATOM 1079 HB3 HIS A 507 24.379 -14.551 -14.259 1.00 0.00 H ATOM 1080 HD2 HIS A 507 21.746 -14.983 -13.611 1.00 0.00 H ATOM 1081 HE1 HIS A 507 22.071 -19.132 -12.690 1.00 0.00 H ATOM 1082 H HIS A 507 26.131 -14.183 -15.845 1.00 0.00 H ATOM 1083 N LEU A 508 22.910 -14.810 -16.739 1.00 22.87 N ATOM 1084 CA LEU A 508 21.623 -14.700 -17.402 1.00 23.56 C ATOM 1085 C LEU A 508 21.640 -15.300 -18.805 1.00 25.12 C ATOM 1086 O LEU A 508 20.748 -16.074 -19.181 1.00 24.07 O ATOM 1087 CB LEU A 508 21.218 -13.230 -17.480 1.00 21.51 C ATOM 1088 CG LEU A 508 20.906 -12.664 -16.099 1.00 23.50 C ATOM 1089 CD1 LEU A 508 20.756 -11.152 -16.162 1.00 21.99 C ATOM 1090 CD2 LEU A 508 19.641 -13.339 -15.567 1.00 21.32 C ATOM 1091 HA LEU A 508 20.900 -15.265 -16.814 1.00 0.00 H ATOM 1092 HB2 LEU A 508 22.036 -12.660 -17.921 1.00 0.00 H ATOM 1093 HB3 LEU A 508 20.333 -13.139 -18.109 1.00 0.00 H ATOM 1094 HG LEU A 508 21.729 -12.871 -15.415 1.00 0.00 H ATOM 1095 HD21 LEU A 508 18.812 -13.140 -16.246 1.00 0.00 H ATOM 1096 HD22 LEU A 508 19.806 -14.414 -15.499 1.00 0.00 H ATOM 1097 HD23 LEU A 508 19.407 -12.942 -14.579 1.00 0.00 H ATOM 1098 HD11 LEU A 508 21.685 -10.711 -16.524 1.00 0.00 H ATOM 1099 HD12 LEU A 508 19.942 -10.897 -16.841 1.00 0.00 H ATOM 1100 HD13 LEU A 508 20.534 -10.768 -15.166 1.00 0.00 H ATOM 1101 H LEU A 508 23.387 -13.944 -16.418 1.00 0.00 H ATOM 1102 N LYS A 509 22.660 -14.919 -19.571 1.00 24.75 N ATOM 1103 CA LYS A 509 22.833 -15.375 -20.939 1.00 24.52 C ATOM 1104 C LYS A 509 22.948 -16.893 -21.029 1.00 24.69 C ATOM 1105 O LYS A 509 22.505 -17.499 -22.005 1.00 22.69 O ATOM 1106 CB LYS A 509 24.078 -14.722 -21.548 1.00 22.33 C ATOM 1107 CG LYS A 509 24.543 -15.369 -22.843 1.00 23.03 C ATOM 1108 CD LYS A 509 24.436 -14.419 -24.027 1.00 23.15 C ATOM 1109 CE LYS A 509 24.948 -15.063 -25.307 1.00 22.22 C ATOM 1110 NZ LYS A 509 24.983 -14.093 -26.442 1.00 24.55 N ATOM 1111 HA LYS A 509 21.946 -15.080 -21.499 1.00 0.00 H ATOM 1112 HB2 LYS A 509 23.853 -13.675 -21.749 1.00 0.00 H ATOM 1113 HB3 LYS A 509 24.889 -14.785 -20.822 1.00 0.00 H ATOM 1114 HG2 LYS A 509 25.583 -15.675 -22.730 1.00 0.00 H ATOM 1115 HG3 LYS A 509 23.927 -16.247 -23.039 1.00 0.00 H ATOM 1116 HD2 LYS A 509 23.391 -14.140 -24.164 1.00 0.00 H ATOM 1117 HD3 LYS A 509 25.025 -13.526 -23.819 1.00 0.00 H ATOM 1118 HE2 LYS A 509 24.292 -15.892 -25.572 1.00 0.00 H ATOM 1119 HE3 LYS A 509 25.956 -15.440 -25.134 1.00 0.00 H ATOM 1120 HZ1 LYS A 509 24.023 -13.733 -26.619 1.00 0.00 H ATOM 1121 HZ2 LYS A 509 25.612 -13.301 -26.200 1.00 0.00 H ATOM 1122 HZ3 LYS A 509 25.338 -14.572 -27.295 1.00 0.00 H ATOM 1123 H LYS A 509 23.364 -14.266 -19.172 1.00 0.00 H ATOM 1124 N ASN A 510 23.536 -17.499 -20.003 1.00 25.46 N ATOM 1125 CA ASN A 510 23.718 -18.943 -19.979 1.00 26.07 C ATOM 1126 C ASN A 510 22.567 -19.685 -19.309 1.00 26.73 C ATOM 1127 O ASN A 510 22.546 -20.913 -19.301 1.00 26.61 O ATOM 1128 CB ASN A 510 25.022 -19.306 -19.258 1.00 24.13 C ATOM 1129 CG ASN A 510 26.246 -18.699 -19.917 1.00 23.94 C ATOM 1130 OD1 ASN A 510 26.306 -18.554 -21.133 1.00 23.03 O ATOM 1131 ND2 ASN A 510 27.238 -18.357 -19.111 1.00 26.21 N ATOM 1132 HA ASN A 510 23.753 -19.257 -21.022 1.00 0.00 H ATOM 1133 HB2 ASN A 510 24.964 -18.946 -18.231 1.00 0.00 H ATOM 1134 HB3 ASN A 510 25.129 -20.391 -19.256 1.00 0.00 H ATOM 1135 HD22 ASN A 510 27.146 -18.497 -18.085 1.00 0.00 H ATOM 1136 HD21 ASN A 510 28.110 -17.948 -19.504 1.00 0.00 H ATOM 1137 H ASN A 510 23.873 -16.930 -19.201 1.00 0.00 H ATOM 1138 N THR A 511 21.600 -18.954 -18.765 1.00 26.47 N ATOM 1139 CA THR A 511 20.501 -19.611 -18.070 1.00 26.11 C ATOM 1140 C THR A 511 19.136 -19.547 -18.744 1.00 26.52 C ATOM 1141 O THR A 511 18.432 -20.554 -18.822 1.00 27.36 O ATOM 1142 CB THR A 511 20.369 -19.058 -16.638 1.00 25.95 C ATOM 1143 OG1 THR A 511 21.658 -19.067 -16.004 1.00 25.02 O ATOM 1144 CG2 THR A 511 19.399 -19.907 -15.825 1.00 23.81 C ATOM 1145 HA THR A 511 20.782 -20.664 -18.082 1.00 0.00 H ATOM 1146 HB THR A 511 19.986 -18.039 -16.688 1.00 0.00 H ATOM 1147 HG1 THR A 511 22.283 -18.501 -16.522 1.00 0.00 H ATOM 1148 HG23 THR A 511 18.421 -19.900 -16.306 1.00 0.00 H ATOM 1149 HG21 THR A 511 19.771 -20.930 -15.770 1.00 0.00 H ATOM 1150 HG22 THR A 511 19.313 -19.496 -14.819 1.00 0.00 H ATOM 1151 H THR A 511 21.628 -17.917 -18.835 1.00 0.00 H ATOM 1152 N TYR A 512 18.773 -18.371 -19.244 1.00 26.63 N ATOM 1153 CA TYR A 512 17.478 -18.168 -19.877 1.00 25.67 C ATOM 1154 C TYR A 512 17.565 -18.002 -21.376 1.00 28.30 C ATOM 1155 O TYR A 512 17.966 -16.944 -21.868 1.00 31.92 O ATOM 1156 CB TYR A 512 16.814 -16.934 -19.275 1.00 22.90 C ATOM 1157 CG TYR A 512 16.784 -16.977 -17.773 1.00 19.78 C ATOM 1158 CD1 TYR A 512 15.785 -17.670 -17.099 1.00 18.64 C ATOM 1159 CD2 TYR A 512 17.809 -16.396 -17.023 1.00 20.05 C ATOM 1160 CE1 TYR A 512 15.810 -17.792 -15.703 1.00 20.39 C ATOM 1161 CE2 TYR A 512 17.847 -16.509 -15.637 1.00 19.84 C ATOM 1162 CZ TYR A 512 16.850 -17.208 -14.984 1.00 20.94 C ATOM 1163 OH TYR A 512 16.902 -17.338 -13.616 1.00 24.09 O ATOM 1164 HA TYR A 512 16.889 -19.066 -19.690 1.00 0.00 H ATOM 1165 HB3 TYR A 512 15.790 -16.871 -19.645 1.00 0.00 H ATOM 1166 HB2 TYR A 512 17.368 -16.049 -19.590 1.00 0.00 H ATOM 1167 HD2 TYR A 512 18.596 -15.842 -17.535 1.00 0.00 H ATOM 1168 HE2 TYR A 512 18.657 -16.050 -15.071 1.00 0.00 H ATOM 1169 HE1 TYR A 512 15.023 -18.339 -15.185 1.00 0.00 H ATOM 1170 HD1 TYR A 512 14.971 -18.125 -17.664 1.00 0.00 H ATOM 1171 HH TYR A 512 16.121 -17.862 -13.306 1.00 0.00 H ATOM 1172 H TYR A 512 19.434 -17.571 -19.181 1.00 0.00 H ATOM 1173 N ALA A 513 17.184 -19.042 -22.110 1.00 28.46 N ATOM 1174 CA ALA A 513 17.208 -18.971 -23.563 1.00 28.78 C ATOM 1175 C ALA A 513 16.079 -18.048 -24.019 1.00 28.38 C ATOM 1176 O ALA A 513 15.005 -18.029 -23.418 1.00 28.56 O ATOM 1177 CB ALA A 513 17.022 -20.370 -24.164 1.00 30.48 C ATOM 1178 HA ALA A 513 18.168 -18.580 -23.901 1.00 0.00 H ATOM 1179 HB1 ALA A 513 17.828 -21.020 -23.824 1.00 0.00 H ATOM 1180 HB2 ALA A 513 16.064 -20.778 -23.842 1.00 0.00 H ATOM 1181 HB3 ALA A 513 17.042 -20.302 -25.252 1.00 0.00 H ATOM 1182 H ALA A 513 16.866 -19.914 -21.642 1.00 0.00 H ATOM 1183 N GLY A 514 16.325 -17.279 -25.074 1.00 28.12 N ATOM 1184 CA GLY A 514 15.302 -16.380 -25.579 1.00 27.08 C ATOM 1185 C GLY A 514 15.200 -15.078 -24.816 1.00 25.92 C ATOM 1186 O GLY A 514 14.363 -14.237 -25.125 1.00 25.86 O ATOM 1187 HA3 GLY A 514 14.339 -16.888 -25.522 1.00 0.00 H ATOM 1188 HA2 GLY A 514 15.529 -16.151 -26.620 1.00 0.00 H ATOM 1189 H GLY A 514 17.254 -17.321 -25.540 1.00 0.00 H ATOM 1190 N LEU A 515 16.051 -14.914 -23.810 1.00 26.64 N ATOM 1191 CA LEU A 515 16.057 -13.700 -23.011 1.00 24.65 C ATOM 1192 C LEU A 515 16.047 -12.520 -23.972 1.00 24.94 C ATOM 1193 O LEU A 515 16.943 -12.378 -24.809 1.00 27.48 O ATOM 1194 CB LEU A 515 17.303 -13.660 -22.129 1.00 24.03 C ATOM 1195 CG LEU A 515 17.398 -12.490 -21.149 1.00 24.45 C ATOM 1196 CD1 LEU A 515 16.166 -12.477 -20.247 1.00 24.57 C ATOM 1197 CD2 LEU A 515 18.673 -12.609 -20.324 1.00 23.74 C ATOM 1198 HA LEU A 515 15.185 -13.663 -22.358 1.00 0.00 H ATOM 1199 HB2 LEU A 515 17.331 -14.583 -21.550 1.00 0.00 H ATOM 1200 HB3 LEU A 515 18.173 -13.617 -22.784 1.00 0.00 H ATOM 1201 HG LEU A 515 17.434 -11.551 -21.702 1.00 0.00 H ATOM 1202 HD21 LEU A 515 18.658 -13.546 -19.767 1.00 0.00 H ATOM 1203 HD22 LEU A 515 19.537 -12.594 -20.988 1.00 0.00 H ATOM 1204 HD23 LEU A 515 18.734 -11.772 -19.628 1.00 0.00 H ATOM 1205 HD11 LEU A 515 15.271 -12.367 -20.859 1.00 0.00 H ATOM 1206 HD12 LEU A 515 16.114 -13.413 -19.691 1.00 0.00 H ATOM 1207 HD13 LEU A 515 16.237 -11.642 -19.550 1.00 0.00 H ATOM 1208 H LEU A 515 16.729 -15.671 -23.589 1.00 0.00 H ATOM 1209 N GLN A 516 15.021 -11.684 -23.859 1.00 23.84 N ATOM 1210 CA GLN A 516 14.872 -10.522 -24.730 1.00 24.31 C ATOM 1211 C GLN A 516 15.331 -9.216 -24.129 1.00 24.88 C ATOM 1212 O GLN A 516 15.729 -8.311 -24.852 1.00 24.87 O ATOM 1213 CB GLN A 516 13.413 -10.341 -25.118 1.00 22.17 C ATOM 1214 CG GLN A 516 12.852 -11.419 -25.984 1.00 22.85 C ATOM 1215 CD GLN A 516 11.347 -11.365 -26.009 1.00 23.92 C ATOM 1216 OE1 GLN A 516 10.682 -11.916 -25.129 1.00 25.42 O ATOM 1217 NE2 GLN A 516 10.797 -10.681 -27.001 1.00 22.38 N ATOM 1218 HA GLN A 516 15.512 -10.740 -25.585 1.00 0.00 H ATOM 1219 HB2 GLN A 516 12.822 -10.300 -24.203 1.00 0.00 H ATOM 1220 HB3 GLN A 516 13.320 -9.395 -25.652 1.00 0.00 H ATOM 1221 HG2 GLN A 516 13.230 -11.294 -26.999 1.00 0.00 H ATOM 1222 HG3 GLN A 516 13.168 -12.388 -25.597 1.00 0.00 H ATOM 1223 HE22 GLN A 516 11.400 -10.233 -27.721 1.00 0.00 H ATOM 1224 HE21 GLN A 516 9.763 -10.592 -27.060 1.00 0.00 H ATOM 1225 H GLN A 516 14.303 -11.863 -23.128 1.00 0.00 H ATOM 1226 N LEU A 517 15.277 -9.107 -22.808 1.00 25.24 N ATOM 1227 CA LEU A 517 15.638 -7.843 -22.194 1.00 26.51 C ATOM 1228 C LEU A 517 16.006 -7.903 -20.723 1.00 26.13 C ATOM 1229 O LEU A 517 15.497 -8.730 -19.960 1.00 27.50 O ATOM 1230 CB LEU A 517 14.474 -6.860 -22.375 1.00 26.11 C ATOM 1231 CG LEU A 517 14.594 -5.483 -21.716 1.00 26.62 C ATOM 1232 CD1 LEU A 517 15.668 -4.651 -22.432 1.00 26.90 C ATOM 1233 CD2 LEU A 517 13.243 -4.779 -21.773 1.00 24.59 C ATOM 1234 HA LEU A 517 16.547 -7.522 -22.703 1.00 0.00 H ATOM 1235 HB2 LEU A 517 14.348 -6.699 -23.446 1.00 0.00 H ATOM 1236 HB3 LEU A 517 13.580 -7.337 -21.973 1.00 0.00 H ATOM 1237 HG LEU A 517 14.890 -5.599 -20.673 1.00 0.00 H ATOM 1238 HD21 LEU A 517 12.940 -4.662 -22.813 1.00 0.00 H ATOM 1239 HD22 LEU A 517 12.501 -5.375 -21.242 1.00 0.00 H ATOM 1240 HD23 LEU A 517 13.326 -3.798 -21.304 1.00 0.00 H ATOM 1241 HD11 LEU A 517 16.627 -5.165 -22.368 1.00 0.00 H ATOM 1242 HD12 LEU A 517 15.391 -4.526 -23.479 1.00 0.00 H ATOM 1243 HD13 LEU A 517 15.746 -3.674 -21.956 1.00 0.00 H ATOM 1244 H LEU A 517 14.981 -9.914 -22.222 1.00 0.00 H ATOM 1245 N VAL A 518 16.907 -7.010 -20.334 1.00 25.51 N ATOM 1246 CA VAL A 518 17.320 -6.907 -18.948 1.00 24.15 C ATOM 1247 C VAL A 518 16.999 -5.487 -18.504 1.00 24.10 C ATOM 1248 O VAL A 518 17.545 -4.516 -19.038 1.00 24.62 O ATOM 1249 CB VAL A 518 18.840 -7.143 -18.744 1.00 22.93 C ATOM 1250 CG1 VAL A 518 19.169 -7.023 -17.266 1.00 17.83 C ATOM 1251 CG2 VAL A 518 19.245 -8.520 -19.250 1.00 21.49 C ATOM 1252 HA VAL A 518 16.798 -7.672 -18.374 1.00 0.00 H ATOM 1253 HB VAL A 518 19.393 -6.394 -19.310 1.00 0.00 H ATOM 1254 HG11 VAL A 518 18.902 -6.026 -16.916 1.00 0.00 H ATOM 1255 HG12 VAL A 518 18.604 -7.769 -16.708 1.00 0.00 H ATOM 1256 HG13 VAL A 518 20.236 -7.188 -17.118 1.00 0.00 H ATOM 1257 HG21 VAL A 518 18.693 -9.284 -18.702 1.00 0.00 H ATOM 1258 HG22 VAL A 518 19.016 -8.597 -20.313 1.00 0.00 H ATOM 1259 HG23 VAL A 518 20.315 -8.662 -19.096 1.00 0.00 H ATOM 1260 H VAL A 518 17.326 -6.370 -21.039 1.00 0.00 H ATOM 1261 N VAL A 519 16.082 -5.363 -17.553 1.00 24.60 N ATOM 1262 CA VAL A 519 15.732 -4.055 -17.031 1.00 23.56 C ATOM 1263 C VAL A 519 16.664 -3.846 -15.861 1.00 22.10 C ATOM 1264 O VAL A 519 16.666 -4.616 -14.911 1.00 22.13 O ATOM 1265 CB VAL A 519 14.278 -4.008 -16.587 1.00 24.01 C ATOM 1266 CG1 VAL A 519 13.979 -2.670 -15.925 1.00 25.14 C ATOM 1267 CG2 VAL A 519 13.390 -4.193 -17.796 1.00 23.39 C ATOM 1268 HA VAL A 519 15.836 -3.274 -17.785 1.00 0.00 H ATOM 1269 HB VAL A 519 14.089 -4.804 -15.866 1.00 0.00 H ATOM 1270 HG11 VAL A 519 14.624 -2.544 -15.056 1.00 0.00 H ATOM 1271 HG12 VAL A 519 14.164 -1.865 -16.636 1.00 0.00 H ATOM 1272 HG13 VAL A 519 12.936 -2.647 -15.611 1.00 0.00 H ATOM 1273 HG21 VAL A 519 13.583 -3.395 -18.512 1.00 0.00 H ATOM 1274 HG22 VAL A 519 13.604 -5.157 -18.258 1.00 0.00 H ATOM 1275 HG23 VAL A 519 12.345 -4.161 -17.486 1.00 0.00 H ATOM 1276 H VAL A 519 15.610 -6.211 -17.178 1.00 0.00 H ATOM 1277 N VAL A 520 17.477 -2.806 -15.957 1.00 23.27 N ATOM 1278 CA VAL A 520 18.476 -2.507 -14.946 1.00 22.03 C ATOM 1279 C VAL A 520 18.157 -1.285 -14.108 1.00 22.28 C ATOM 1280 O VAL A 520 18.118 -0.177 -14.623 1.00 24.42 O ATOM 1281 CB VAL A 520 19.819 -2.297 -15.626 1.00 21.77 C ATOM 1282 CG1 VAL A 520 20.922 -2.201 -14.590 1.00 21.97 C ATOM 1283 CG2 VAL A 520 20.065 -3.432 -16.605 1.00 19.76 C ATOM 1284 HA VAL A 520 18.493 -3.358 -14.265 1.00 0.00 H ATOM 1285 HB VAL A 520 19.812 -1.359 -16.181 1.00 0.00 H ATOM 1286 HG11 VAL A 520 20.723 -1.360 -13.926 1.00 0.00 H ATOM 1287 HG12 VAL A 520 20.956 -3.123 -14.010 1.00 0.00 H ATOM 1288 HG13 VAL A 520 21.878 -2.051 -15.092 1.00 0.00 H ATOM 1289 HG21 VAL A 520 20.071 -4.380 -16.067 1.00 0.00 H ATOM 1290 HG22 VAL A 520 19.273 -3.443 -17.353 1.00 0.00 H ATOM 1291 HG23 VAL A 520 21.027 -3.285 -17.095 1.00 0.00 H ATOM 1292 H VAL A 520 17.398 -2.181 -16.785 1.00 0.00 H ATOM 1293 N ILE A 521 17.929 -1.483 -12.816 1.00 22.73 N ATOM 1294 CA ILE A 521 17.623 -0.365 -11.933 1.00 23.53 C ATOM 1295 C ILE A 521 18.924 0.182 -11.339 1.00 24.33 C ATOM 1296 O ILE A 521 19.697 -0.560 -10.735 1.00 22.78 O ATOM 1297 CB ILE A 521 16.674 -0.797 -10.790 1.00 24.04 C ATOM 1298 CG1 ILE A 521 15.323 -1.215 -11.367 1.00 24.99 C ATOM 1299 CG2 ILE A 521 16.467 0.352 -9.811 1.00 23.83 C ATOM 1300 CD1 ILE A 521 15.027 -2.682 -11.205 1.00 26.99 C ATOM 1301 HA ILE A 521 17.123 0.408 -12.517 1.00 0.00 H ATOM 1302 HB ILE A 521 17.125 -1.639 -10.265 1.00 0.00 H ATOM 1303 HG12 ILE A 521 14.542 -0.648 -10.862 1.00 0.00 H ATOM 1304 HG13 ILE A 521 15.313 -0.977 -12.431 1.00 0.00 H ATOM 1305 HD11 ILE A 521 15.794 -3.265 -11.715 1.00 0.00 H ATOM 1306 HD12 ILE A 521 15.022 -2.935 -10.145 1.00 0.00 H ATOM 1307 HD13 ILE A 521 14.052 -2.905 -11.638 1.00 0.00 H ATOM 1308 HG21 ILE A 521 17.428 0.643 -9.386 1.00 0.00 H ATOM 1309 HG22 ILE A 521 16.029 1.201 -10.336 1.00 0.00 H ATOM 1310 HG23 ILE A 521 15.797 0.032 -9.013 1.00 0.00 H ATOM 1311 H ILE A 521 17.969 -2.447 -12.429 1.00 0.00 H ATOM 1312 N LEU A 522 19.157 1.476 -11.524 1.00 25.67 N ATOM 1313 CA LEU A 522 20.364 2.126 -11.024 1.00 27.45 C ATOM 1314 C LEU A 522 20.040 3.092 -9.889 1.00 29.57 C ATOM 1315 O LEU A 522 18.979 3.713 -9.877 1.00 29.23 O ATOM 1316 CB LEU A 522 21.043 2.894 -12.157 1.00 26.12 C ATOM 1317 CG LEU A 522 21.417 2.066 -13.387 1.00 26.97 C ATOM 1318 CD1 LEU A 522 21.800 2.971 -14.535 1.00 25.57 C ATOM 1319 CD2 LEU A 522 22.554 1.140 -13.041 1.00 26.25 C ATOM 1320 HA LEU A 522 21.031 1.352 -10.643 1.00 0.00 H ATOM 1321 HB2 LEU A 522 20.366 3.685 -12.479 1.00 0.00 H ATOM 1322 HB3 LEU A 522 21.956 3.338 -11.761 1.00 0.00 H ATOM 1323 HG LEU A 522 20.556 1.473 -13.696 1.00 0.00 H ATOM 1324 HD21 LEU A 522 23.415 1.727 -12.722 1.00 0.00 H ATOM 1325 HD22 LEU A 522 22.247 0.475 -12.234 1.00 0.00 H ATOM 1326 HD23 LEU A 522 22.820 0.550 -13.918 1.00 0.00 H ATOM 1327 HD11 LEU A 522 20.958 3.617 -14.784 1.00 0.00 H ATOM 1328 HD12 LEU A 522 22.655 3.582 -14.245 1.00 0.00 H ATOM 1329 HD13 LEU A 522 22.063 2.365 -15.402 1.00 0.00 H ATOM 1330 H LEU A 522 18.457 2.045 -12.042 1.00 0.00 H ATOM 1331 N PRO A 523 20.952 3.221 -8.912 1.00 32.48 N ATOM 1332 CA PRO A 523 20.773 4.121 -7.763 1.00 35.08 C ATOM 1333 C PRO A 523 21.399 5.485 -8.050 1.00 37.54 C ATOM 1334 O PRO A 523 22.433 5.820 -7.478 1.00 40.10 O ATOM 1335 CB PRO A 523 21.509 3.388 -6.650 1.00 33.25 C ATOM 1336 CG PRO A 523 22.688 2.823 -7.387 1.00 32.60 C ATOM 1337 CD PRO A 523 22.050 2.267 -8.655 1.00 33.27 C ATOM 1338 HA PRO A 523 19.731 4.327 -7.518 1.00 0.00 H ATOM 1339 HD3 PRO A 523 22.762 2.255 -9.481 1.00 0.00 H ATOM 1340 HD2 PRO A 523 21.666 1.260 -8.493 1.00 0.00 H ATOM 1341 HG3 PRO A 523 23.172 2.034 -6.811 1.00 0.00 H ATOM 1342 HG2 PRO A 523 23.416 3.600 -7.620 1.00 0.00 H ATOM 1343 HB2 PRO A 523 21.823 4.073 -5.862 1.00 0.00 H ATOM 1344 HB3 PRO A 523 20.894 2.598 -6.219 1.00 0.00 H ATOM 1345 N GLY A 524 20.775 6.270 -8.925 1.00 39.11 N ATOM 1346 CA GLY A 524 21.341 7.564 -9.278 1.00 40.97 C ATOM 1347 C GLY A 524 22.556 7.345 -10.173 1.00 42.09 C ATOM 1348 O GLY A 524 22.746 6.234 -10.669 1.00 41.37 O ATOM 1349 HA3 GLY A 524 21.643 8.091 -8.373 1.00 0.00 H ATOM 1350 HA2 GLY A 524 20.597 8.156 -9.810 1.00 0.00 H ATOM 1351 H GLY A 524 19.882 5.959 -9.357 1.00 0.00 H ATOM 1352 N LYS A 525 23.378 8.377 -10.380 1.00 43.49 N ATOM 1353 CA LYS A 525 24.573 8.240 -11.223 1.00 43.82 C ATOM 1354 C LYS A 525 25.594 7.287 -10.622 1.00 42.10 C ATOM 1355 O LYS A 525 25.985 7.426 -9.462 1.00 43.52 O ATOM 1356 CB LYS A 525 25.222 9.597 -11.500 1.00 45.88 C ATOM 1357 CG LYS A 525 25.457 10.459 -10.287 1.00 49.65 C ATOM 1358 CD LYS A 525 25.668 11.902 -10.730 1.00 53.21 C ATOM 1359 CE LYS A 525 24.469 12.405 -11.546 1.00 54.64 C ATOM 1360 NZ LYS A 525 24.702 13.752 -12.140 1.00 56.62 N ATOM 1361 HA LYS A 525 24.234 7.816 -12.168 1.00 0.00 H ATOM 1362 HB2 LYS A 525 26.185 9.418 -11.978 1.00 0.00 H ATOM 1363 HB3 LYS A 525 24.575 10.147 -12.184 1.00 0.00 H ATOM 1364 HG2 LYS A 525 24.592 10.403 -9.627 1.00 0.00 H ATOM 1365 HG3 LYS A 525 26.341 10.108 -9.756 1.00 0.00 H ATOM 1366 HD2 LYS A 525 25.790 12.532 -9.849 1.00 0.00 H ATOM 1367 HD3 LYS A 525 26.567 11.960 -11.344 1.00 0.00 H ATOM 1368 HE2 LYS A 525 23.599 12.458 -10.892 1.00 0.00 H ATOM 1369 HE3 LYS A 525 24.274 11.697 -12.352 1.00 0.00 H ATOM 1370 HZ1 LYS A 525 24.881 14.439 -11.380 1.00 0.00 H ATOM 1371 HZ2 LYS A 525 25.525 13.712 -12.774 1.00 0.00 H ATOM 1372 HZ3 LYS A 525 23.861 14.042 -12.679 1.00 0.00 H ATOM 1373 H LYS A 525 23.168 9.294 -9.936 1.00 0.00 H ATOM 1374 N THR A 526 26.014 6.320 -11.435 1.00 40.14 N ATOM 1375 CA THR A 526 26.951 5.281 -11.030 1.00 36.41 C ATOM 1376 C THR A 526 27.688 4.696 -12.235 1.00 34.77 C ATOM 1377 O THR A 526 27.187 4.716 -13.358 1.00 35.96 O ATOM 1378 CB THR A 526 26.192 4.140 -10.323 1.00 36.64 C ATOM 1379 OG1 THR A 526 27.048 3.001 -10.191 1.00 37.45 O ATOM 1380 CG2 THR A 526 24.939 3.749 -11.131 1.00 35.00 C ATOM 1381 HA THR A 526 27.677 5.735 -10.355 1.00 0.00 H ATOM 1382 HB THR A 526 25.884 4.484 -9.335 1.00 0.00 H ATOM 1383 HG1 THR A 526 26.557 2.271 -9.737 1.00 0.00 H ATOM 1384 HG23 THR A 526 24.287 4.617 -11.231 1.00 0.00 H ATOM 1385 HG21 THR A 526 25.239 3.403 -12.120 1.00 0.00 H ATOM 1386 HG22 THR A 526 24.407 2.952 -10.611 1.00 0.00 H ATOM 1387 H THR A 526 25.654 6.306 -12.411 1.00 0.00 H ATOM 1388 N PRO A 527 28.900 4.171 -12.019 1.00 33.18 N ATOM 1389 CA PRO A 527 29.648 3.592 -13.137 1.00 31.40 C ATOM 1390 C PRO A 527 28.994 2.291 -13.584 1.00 29.58 C ATOM 1391 O PRO A 527 29.402 1.694 -14.578 1.00 29.11 O ATOM 1392 CB PRO A 527 31.035 3.362 -12.541 1.00 31.37 C ATOM 1393 CG PRO A 527 31.119 4.385 -11.462 1.00 31.07 C ATOM 1394 CD PRO A 527 29.762 4.302 -10.835 1.00 32.36 C ATOM 1395 HA PRO A 527 29.681 4.222 -14.026 1.00 0.00 H ATOM 1396 HD3 PRO A 527 29.677 3.433 -10.182 1.00 0.00 H ATOM 1397 HD2 PRO A 527 29.528 5.204 -10.270 1.00 0.00 H ATOM 1398 HG3 PRO A 527 31.304 5.378 -11.873 1.00 0.00 H ATOM 1399 HG2 PRO A 527 31.901 4.138 -10.744 1.00 0.00 H ATOM 1400 HB2 PRO A 527 31.123 2.355 -12.133 1.00 0.00 H ATOM 1401 HB3 PRO A 527 31.812 3.518 -13.289 1.00 0.00 H ATOM 1402 N VAL A 528 27.997 1.846 -12.820 1.00 27.84 N ATOM 1403 CA VAL A 528 27.264 0.624 -13.141 1.00 25.77 C ATOM 1404 C VAL A 528 26.674 0.724 -14.543 1.00 25.22 C ATOM 1405 O VAL A 528 26.667 -0.250 -15.299 1.00 22.74 O ATOM 1406 CB VAL A 528 26.109 0.374 -12.153 1.00 25.37 C ATOM 1407 CG1 VAL A 528 25.178 -0.712 -12.702 1.00 23.21 C ATOM 1408 CG2 VAL A 528 26.663 -0.054 -10.815 1.00 21.35 C ATOM 1409 HA VAL A 528 27.973 -0.202 -13.076 1.00 0.00 H ATOM 1410 HB VAL A 528 25.543 1.297 -12.027 1.00 0.00 H ATOM 1411 HG11 VAL A 528 24.769 -0.388 -13.659 1.00 0.00 H ATOM 1412 HG12 VAL A 528 25.740 -1.636 -12.839 1.00 0.00 H ATOM 1413 HG13 VAL A 528 24.364 -0.882 -11.997 1.00 0.00 H ATOM 1414 HG21 VAL A 528 27.238 -0.972 -10.938 1.00 0.00 H ATOM 1415 HG22 VAL A 528 27.310 0.731 -10.423 1.00 0.00 H ATOM 1416 HG23 VAL A 528 25.840 -0.229 -10.122 1.00 0.00 H ATOM 1417 H VAL A 528 27.733 2.385 -11.970 1.00 0.00 H ATOM 1418 N TYR A 529 26.176 1.916 -14.866 1.00 26.00 N ATOM 1419 CA TYR A 529 25.588 2.198 -16.166 1.00 27.26 C ATOM 1420 C TYR A 529 26.568 1.918 -17.312 1.00 28.37 C ATOM 1421 O TYR A 529 26.258 1.165 -18.241 1.00 28.50 O ATOM 1422 CB TYR A 529 25.143 3.658 -16.226 1.00 27.09 C ATOM 1423 CG TYR A 529 24.643 4.065 -17.589 1.00 28.51 C ATOM 1424 CD1 TYR A 529 23.322 3.828 -17.973 1.00 29.73 C ATOM 1425 CD2 TYR A 529 25.504 4.658 -18.511 1.00 28.73 C ATOM 1426 CE1 TYR A 529 22.875 4.178 -19.249 1.00 30.10 C ATOM 1427 CE2 TYR A 529 25.075 5.003 -19.771 1.00 30.38 C ATOM 1428 CZ TYR A 529 23.768 4.767 -20.136 1.00 31.57 C ATOM 1429 OH TYR A 529 23.393 5.159 -21.391 1.00 34.12 O ATOM 1430 HA TYR A 529 24.730 1.537 -16.288 1.00 0.00 H ATOM 1431 HB3 TYR A 529 25.991 4.291 -15.963 1.00 0.00 H ATOM 1432 HB2 TYR A 529 24.341 3.807 -15.503 1.00 0.00 H ATOM 1433 HD2 TYR A 529 26.538 4.852 -18.227 1.00 0.00 H ATOM 1434 HE2 TYR A 529 25.766 5.461 -20.478 1.00 0.00 H ATOM 1435 HE1 TYR A 529 21.842 3.992 -19.544 1.00 0.00 H ATOM 1436 HD1 TYR A 529 22.631 3.364 -17.269 1.00 0.00 H ATOM 1437 HH TYR A 529 22.439 4.937 -21.533 1.00 0.00 H ATOM 1438 H TYR A 529 26.209 2.678 -14.159 1.00 0.00 H ATOM 1439 N ALA A 530 27.745 2.540 -17.250 1.00 27.75 N ATOM 1440 CA ALA A 530 28.761 2.353 -18.279 1.00 26.55 C ATOM 1441 C ALA A 530 29.033 0.869 -18.444 1.00 24.86 C ATOM 1442 O ALA A 530 29.062 0.354 -19.547 1.00 25.65 O ATOM 1443 CB ALA A 530 30.039 3.071 -17.879 1.00 27.73 C ATOM 1444 HA ALA A 530 28.406 2.767 -19.223 1.00 0.00 H ATOM 1445 HB1 ALA A 530 29.835 4.135 -17.763 1.00 0.00 H ATOM 1446 HB2 ALA A 530 30.403 2.664 -16.935 1.00 0.00 H ATOM 1447 HB3 ALA A 530 30.793 2.926 -18.653 1.00 0.00 H ATOM 1448 H ALA A 530 27.943 3.173 -16.449 1.00 0.00 H ATOM 1449 N GLU A 531 29.229 0.193 -17.322 1.00 24.19 N ATOM 1450 CA GLU A 531 29.506 -1.231 -17.308 1.00 24.56 C ATOM 1451 C GLU A 531 28.336 -2.047 -17.876 1.00 24.47 C ATOM 1452 O GLU A 531 28.541 -2.980 -18.654 1.00 24.19 O ATOM 1453 CB GLU A 531 29.821 -1.669 -15.874 1.00 24.20 C ATOM 1454 CG GLU A 531 30.225 -3.129 -15.728 1.00 25.15 C ATOM 1455 CD GLU A 531 31.512 -3.462 -16.459 1.00 27.37 C ATOM 1456 OE1 GLU A 531 31.956 -2.646 -17.301 1.00 25.77 O ATOM 1457 OE2 GLU A 531 32.073 -4.553 -16.199 1.00 28.12 O ATOM 1458 HA GLU A 531 30.367 -1.420 -17.949 1.00 0.00 H ATOM 1459 HB2 GLU A 531 30.639 -1.052 -15.502 1.00 0.00 H ATOM 1460 HB3 GLU A 531 28.933 -1.500 -15.264 1.00 0.00 H ATOM 1461 HG2 GLU A 531 30.360 -3.349 -14.669 1.00 0.00 H ATOM 1462 HG3 GLU A 531 29.426 -3.753 -16.128 1.00 0.00 H ATOM 1463 H GLU A 531 29.183 0.702 -16.417 1.00 0.00 H ATOM 1464 N VAL A 532 27.112 -1.700 -17.484 1.00 25.20 N ATOM 1465 CA VAL A 532 25.930 -2.402 -17.981 1.00 23.28 C ATOM 1466 C VAL A 532 25.922 -2.299 -19.502 1.00 24.53 C ATOM 1467 O VAL A 532 25.635 -3.277 -20.199 1.00 24.83 O ATOM 1468 CB VAL A 532 24.614 -1.777 -17.437 1.00 23.03 C ATOM 1469 CG1 VAL A 532 23.420 -2.332 -18.204 1.00 23.74 C ATOM 1470 CG2 VAL A 532 24.453 -2.075 -15.961 1.00 19.58 C ATOM 1471 HA VAL A 532 25.977 -3.438 -17.645 1.00 0.00 H ATOM 1472 HB VAL A 532 24.663 -0.697 -17.573 1.00 0.00 H ATOM 1473 HG11 VAL A 532 23.524 -2.088 -19.261 1.00 0.00 H ATOM 1474 HG12 VAL A 532 23.382 -3.414 -18.081 1.00 0.00 H ATOM 1475 HG13 VAL A 532 22.503 -1.889 -17.816 1.00 0.00 H ATOM 1476 HG21 VAL A 532 24.421 -3.154 -15.811 1.00 0.00 H ATOM 1477 HG22 VAL A 532 25.297 -1.656 -15.413 1.00 0.00 H ATOM 1478 HG23 VAL A 532 23.526 -1.629 -15.601 1.00 0.00 H ATOM 1479 H VAL A 532 26.995 -0.915 -16.812 1.00 0.00 H ATOM 1480 N LYS A 533 26.238 -1.111 -20.015 1.00 24.58 N ATOM 1481 CA LYS A 533 26.263 -0.899 -21.458 1.00 25.75 C ATOM 1482 C LYS A 533 27.456 -1.574 -22.109 1.00 27.24 C ATOM 1483 O LYS A 533 27.319 -2.174 -23.180 1.00 28.14 O ATOM 1484 CB LYS A 533 26.251 0.597 -21.793 1.00 23.32 C ATOM 1485 CG LYS A 533 24.949 1.255 -21.393 1.00 23.24 C ATOM 1486 CD LYS A 533 23.774 0.494 -22.003 1.00 23.59 C ATOM 1487 CE LYS A 533 22.504 0.602 -21.155 1.00 26.03 C ATOM 1488 NZ LYS A 533 21.265 0.235 -21.941 1.00 25.22 N ATOM 1489 HA LYS A 533 25.360 -1.356 -21.863 1.00 0.00 H ATOM 1490 HB2 LYS A 533 27.069 1.084 -21.263 1.00 0.00 H ATOM 1491 HB3 LYS A 533 26.392 0.719 -22.867 1.00 0.00 H ATOM 1492 HG2 LYS A 533 24.859 1.249 -20.307 1.00 0.00 H ATOM 1493 HG3 LYS A 533 24.939 2.284 -21.751 1.00 0.00 H ATOM 1494 HD2 LYS A 533 23.569 0.901 -22.993 1.00 0.00 H ATOM 1495 HD3 LYS A 533 24.047 -0.558 -22.093 1.00 0.00 H ATOM 1496 HE2 LYS A 533 22.404 1.627 -20.799 1.00 0.00 H ATOM 1497 HE3 LYS A 533 22.592 -0.071 -20.302 1.00 0.00 H ATOM 1498 HZ1 LYS A 533 21.169 0.877 -22.754 1.00 0.00 H ATOM 1499 HZ2 LYS A 533 21.348 -0.745 -22.279 1.00 0.00 H ATOM 1500 HZ3 LYS A 533 20.429 0.322 -21.329 1.00 0.00 H ATOM 1501 H LYS A 533 26.470 -0.323 -19.377 1.00 0.00 H ATOM 1502 N ARG A 534 28.622 -1.491 -21.470 1.00 27.36 N ATOM 1503 CA ARG A 534 29.807 -2.127 -22.030 1.00 28.07 C ATOM 1504 C ARG A 534 29.533 -3.617 -22.225 1.00 29.43 C ATOM 1505 O ARG A 534 29.854 -4.192 -23.268 1.00 30.40 O ATOM 1506 CB ARG A 534 31.028 -1.977 -21.100 1.00 25.98 C ATOM 1507 CG ARG A 534 32.276 -2.734 -21.624 1.00 24.87 C ATOM 1508 CD ARG A 534 33.490 -2.689 -20.682 1.00 24.88 C ATOM 1509 NE ARG A 534 33.393 -3.657 -19.593 1.00 23.74 N ATOM 1510 CZ ARG A 534 33.575 -4.967 -19.728 1.00 22.81 C ATOM 1511 NH1 ARG A 534 33.452 -5.766 -18.673 1.00 22.99 N ATOM 1512 NH2 ARG A 534 33.899 -5.478 -20.911 1.00 24.68 N ATOM 1513 HA ARG A 534 30.029 -1.639 -22.979 1.00 0.00 H ATOM 1514 HB2 ARG A 534 31.273 -0.918 -21.013 1.00 0.00 H ATOM 1515 HB3 ARG A 534 30.768 -2.370 -20.117 1.00 0.00 H ATOM 1516 HG2 ARG A 534 32.002 -3.778 -21.777 1.00 0.00 H ATOM 1517 HG3 ARG A 534 32.567 -2.292 -22.577 1.00 0.00 H ATOM 1518 HD2 ARG A 534 33.564 -1.689 -20.255 1.00 0.00 H ATOM 1519 HD3 ARG A 534 34.389 -2.903 -21.260 1.00 0.00 H ATOM 1520 HE ARG A 534 33.165 -3.296 -18.645 1.00 0.00 H ATOM 1521 HH12 ARG A 534 33.594 -6.791 -18.778 1.00 0.00 H ATOM 1522 HH11 ARG A 534 33.214 -5.366 -17.743 1.00 0.00 H ATOM 1523 HH22 ARG A 534 34.041 -6.503 -21.013 1.00 0.00 H ATOM 1524 HH21 ARG A 534 34.011 -4.853 -21.735 1.00 0.00 H ATOM 1525 H ARG A 534 28.686 -0.972 -20.571 1.00 0.00 H ATOM 1526 N VAL A 535 28.934 -4.239 -21.217 1.00 29.31 N ATOM 1527 CA VAL A 535 28.676 -5.670 -21.274 1.00 30.65 C ATOM 1528 C VAL A 535 27.518 -6.102 -22.175 1.00 31.53 C ATOM 1529 O VAL A 535 27.636 -7.080 -22.907 1.00 32.55 O ATOM 1530 CB VAL A 535 28.457 -6.236 -19.853 1.00 29.95 C ATOM 1531 CG1 VAL A 535 28.240 -7.736 -19.924 1.00 29.08 C ATOM 1532 CG2 VAL A 535 29.668 -5.896 -18.954 1.00 29.33 C ATOM 1533 HA VAL A 535 29.573 -6.086 -21.733 1.00 0.00 H ATOM 1534 HB VAL A 535 27.569 -5.779 -19.416 1.00 0.00 H ATOM 1535 HG11 VAL A 535 27.362 -7.946 -20.535 1.00 0.00 H ATOM 1536 HG12 VAL A 535 29.116 -8.208 -20.369 1.00 0.00 H ATOM 1537 HG13 VAL A 535 28.086 -8.128 -18.918 1.00 0.00 H ATOM 1538 HG21 VAL A 535 30.570 -6.336 -19.380 1.00 0.00 H ATOM 1539 HG22 VAL A 535 29.783 -4.814 -18.895 1.00 0.00 H ATOM 1540 HG23 VAL A 535 29.502 -6.300 -17.955 1.00 0.00 H ATOM 1541 H VAL A 535 28.646 -3.698 -20.377 1.00 0.00 H ATOM 1542 N GLY A 536 26.405 -5.376 -22.125 1.00 32.63 N ATOM 1543 CA GLY A 536 25.258 -5.733 -22.940 1.00 32.04 C ATOM 1544 C GLY A 536 25.450 -5.400 -24.404 1.00 33.39 C ATOM 1545 O GLY A 536 25.142 -6.203 -25.284 1.00 32.40 O ATOM 1546 HA3 GLY A 536 24.387 -5.192 -22.571 1.00 0.00 H ATOM 1547 HA2 GLY A 536 25.085 -6.805 -22.847 1.00 0.00 H ATOM 1548 H GLY A 536 26.356 -4.548 -21.498 1.00 0.00 H ATOM 1549 N ASP A 537 25.980 -4.214 -24.669 1.00 34.16 N ATOM 1550 CA ASP A 537 26.187 -3.779 -26.037 1.00 35.49 C ATOM 1551 C ASP A 537 27.418 -4.332 -26.762 1.00 36.20 C ATOM 1552 O ASP A 537 27.278 -4.978 -27.805 1.00 37.52 O ATOM 1553 CB ASP A 537 26.197 -2.245 -26.102 1.00 35.76 C ATOM 1554 CG ASP A 537 24.831 -1.647 -25.839 1.00 36.71 C ATOM 1555 OD1 ASP A 537 23.835 -2.384 -25.983 1.00 37.96 O ATOM 1556 OD2 ASP A 537 24.745 -0.443 -25.503 1.00 37.83 O ATOM 1557 HA ASP A 537 25.343 -4.207 -26.578 1.00 0.00 H ATOM 1558 HB2 ASP A 537 26.895 -1.867 -25.355 1.00 0.00 H ATOM 1559 HB3 ASP A 537 26.528 -1.939 -27.094 1.00 0.00 H ATOM 1560 H ASP A 537 26.251 -3.587 -23.885 1.00 0.00 H ATOM 1561 N THR A 538 28.614 -4.106 -26.223 1.00 35.43 N ATOM 1562 CA THR A 538 29.827 -4.561 -26.904 1.00 34.97 C ATOM 1563 C THR A 538 30.415 -5.926 -26.538 1.00 34.45 C ATOM 1564 O THR A 538 31.345 -6.381 -27.201 1.00 36.08 O ATOM 1565 CB THR A 538 30.955 -3.528 -26.759 1.00 34.33 C ATOM 1566 OG1 THR A 538 31.499 -3.598 -25.436 1.00 37.66 O ATOM 1567 CG2 THR A 538 30.426 -2.132 -26.992 1.00 35.39 C ATOM 1568 HA THR A 538 29.458 -4.678 -27.923 1.00 0.00 H ATOM 1569 HB THR A 538 31.725 -3.750 -27.497 1.00 0.00 H ATOM 1570 HG1 THR A 538 30.786 -3.404 -24.777 1.00 0.00 H ATOM 1571 HG23 THR A 538 30.009 -2.066 -27.997 1.00 0.00 H ATOM 1572 HG21 THR A 538 29.649 -1.912 -26.260 1.00 0.00 H ATOM 1573 HG22 THR A 538 31.240 -1.414 -26.887 1.00 0.00 H ATOM 1574 H THR A 538 28.687 -3.604 -25.315 1.00 0.00 H ATOM 1575 N VAL A 539 29.896 -6.585 -25.506 1.00 32.87 N ATOM 1576 CA VAL A 539 30.440 -7.884 -25.108 1.00 30.05 C ATOM 1577 C VAL A 539 29.546 -9.112 -25.340 1.00 29.82 C ATOM 1578 O VAL A 539 29.959 -10.061 -25.995 1.00 29.28 O ATOM 1579 CB VAL A 539 30.862 -7.879 -23.611 1.00 29.79 C ATOM 1580 CG1 VAL A 539 31.339 -9.255 -23.201 1.00 29.25 C ATOM 1581 CG2 VAL A 539 31.962 -6.863 -23.374 1.00 28.22 C ATOM 1582 HA VAL A 539 31.290 -7.998 -25.780 1.00 0.00 H ATOM 1583 HB VAL A 539 29.996 -7.606 -23.009 1.00 0.00 H ATOM 1584 HG11 VAL A 539 30.533 -9.975 -23.344 1.00 0.00 H ATOM 1585 HG12 VAL A 539 32.195 -9.539 -23.814 1.00 0.00 H ATOM 1586 HG13 VAL A 539 31.632 -9.239 -22.151 1.00 0.00 H ATOM 1587 HG21 VAL A 539 32.827 -7.117 -23.986 1.00 0.00 H ATOM 1588 HG22 VAL A 539 31.602 -5.870 -23.645 1.00 0.00 H ATOM 1589 HG23 VAL A 539 32.244 -6.874 -22.321 1.00 0.00 H ATOM 1590 H VAL A 539 29.099 -6.175 -24.979 1.00 0.00 H ATOM 1591 N LEU A 540 28.327 -9.098 -24.810 1.00 29.61 N ATOM 1592 CA LEU A 540 27.434 -10.249 -24.933 1.00 28.62 C ATOM 1593 C LEU A 540 26.250 -10.124 -25.889 1.00 28.50 C ATOM 1594 O LEU A 540 25.537 -11.106 -26.117 1.00 27.73 O ATOM 1595 CB LEU A 540 26.889 -10.620 -23.552 1.00 27.79 C ATOM 1596 CG LEU A 540 27.893 -10.880 -22.438 1.00 28.14 C ATOM 1597 CD1 LEU A 540 27.141 -11.097 -21.123 1.00 27.76 C ATOM 1598 CD2 LEU A 540 28.745 -12.092 -22.797 1.00 28.07 C ATOM 1599 HA LEU A 540 28.071 -11.016 -25.374 1.00 0.00 H ATOM 1600 HB2 LEU A 540 26.246 -9.803 -23.226 1.00 0.00 H ATOM 1601 HB3 LEU A 540 26.293 -11.525 -23.670 1.00 0.00 H ATOM 1602 HG LEU A 540 28.555 -10.023 -22.317 1.00 0.00 H ATOM 1603 HD21 LEU A 540 28.102 -12.963 -22.919 1.00 0.00 H ATOM 1604 HD22 LEU A 540 29.276 -11.898 -23.729 1.00 0.00 H ATOM 1605 HD23 LEU A 540 29.464 -12.278 -21.999 1.00 0.00 H ATOM 1606 HD11 LEU A 540 26.557 -10.207 -20.889 1.00 0.00 H ATOM 1607 HD12 LEU A 540 26.475 -11.954 -21.224 1.00 0.00 H ATOM 1608 HD13 LEU A 540 27.857 -11.284 -20.323 1.00 0.00 H ATOM 1609 H LEU A 540 28.003 -8.253 -24.298 1.00 0.00 H ATOM 1610 N GLY A 541 26.028 -8.932 -26.433 1.00 28.75 N ATOM 1611 CA GLY A 541 24.903 -8.746 -27.331 1.00 28.65 C ATOM 1612 C GLY A 541 23.597 -8.964 -26.584 1.00 29.79 C ATOM 1613 O GLY A 541 22.764 -9.801 -26.957 1.00 30.98 O ATOM 1614 HA3 GLY A 541 24.974 -9.461 -28.151 1.00 0.00 H ATOM 1615 HA2 GLY A 541 24.925 -7.733 -27.732 1.00 0.00 H ATOM 1616 H GLY A 541 26.659 -8.134 -26.216 1.00 0.00 H ATOM 1617 N MET A 542 23.420 -8.212 -25.507 1.00 27.85 N ATOM 1618 CA MET A 542 22.218 -8.319 -24.706 1.00 27.32 C ATOM 1619 C MET A 542 21.528 -6.975 -24.580 1.00 25.77 C ATOM 1620 O MET A 542 22.141 -5.982 -24.185 1.00 25.48 O ATOM 1621 CB MET A 542 22.553 -8.859 -23.319 1.00 27.72 C ATOM 1622 CG MET A 542 23.169 -10.232 -23.353 1.00 28.44 C ATOM 1623 SD MET A 542 23.637 -10.781 -21.728 1.00 30.01 S ATOM 1624 CE MET A 542 21.995 -11.177 -21.053 1.00 31.57 C ATOM 1625 HA MET A 542 21.540 -9.010 -25.207 1.00 0.00 H ATOM 1626 HB2 MET A 542 23.254 -8.176 -22.840 1.00 0.00 H ATOM 1627 HB3 MET A 542 21.635 -8.905 -22.733 1.00 0.00 H ATOM 1628 HG2 MET A 542 24.055 -10.207 -23.987 1.00 0.00 H ATOM 1629 HG3 MET A 542 22.446 -10.934 -23.769 1.00 0.00 H ATOM 1630 HE1 MET A 542 21.375 -10.280 -21.059 1.00 0.00 H ATOM 1631 HE2 MET A 542 21.528 -11.947 -21.666 1.00 0.00 H ATOM 1632 HE3 MET A 542 22.102 -11.540 -20.031 1.00 0.00 H ATOM 1633 H MET A 542 24.158 -7.533 -25.232 1.00 0.00 H ATOM 1634 N ALA A 543 20.246 -6.957 -24.928 1.00 24.11 N ATOM 1635 CA ALA A 543 19.445 -5.745 -24.853 1.00 23.32 C ATOM 1636 C ALA A 543 19.242 -5.356 -23.395 1.00 22.67 C ATOM 1637 O ALA A 543 18.836 -6.168 -22.569 1.00 22.59 O ATOM 1638 CB ALA A 543 18.095 -5.965 -25.531 1.00 21.97 C ATOM 1639 HA ALA A 543 19.967 -4.939 -25.369 1.00 0.00 H ATOM 1640 HB1 ALA A 543 18.254 -6.225 -26.578 1.00 0.00 H ATOM 1641 HB2 ALA A 543 17.566 -6.776 -25.030 1.00 0.00 H ATOM 1642 HB3 ALA A 543 17.505 -5.051 -25.468 1.00 0.00 H ATOM 1643 H ALA A 543 19.802 -7.835 -25.264 1.00 0.00 H ATOM 1644 N THR A 544 19.534 -4.108 -23.078 1.00 22.42 N ATOM 1645 CA THR A 544 19.361 -3.649 -21.718 1.00 23.23 C ATOM 1646 C THR A 544 18.632 -2.321 -21.702 1.00 23.15 C ATOM 1647 O THR A 544 18.764 -1.511 -22.624 1.00 21.58 O ATOM 1648 CB THR A 544 20.716 -3.457 -20.997 1.00 24.04 C ATOM 1649 OG1 THR A 544 21.467 -2.430 -21.664 1.00 25.50 O ATOM 1650 CG2 THR A 544 21.501 -4.763 -20.981 1.00 21.97 C ATOM 1651 HA THR A 544 18.785 -4.414 -21.198 1.00 0.00 H ATOM 1652 HB THR A 544 20.534 -3.158 -19.965 1.00 0.00 H ATOM 1653 HG1 THR A 544 20.956 -1.582 -21.642 1.00 0.00 H ATOM 1654 HG23 THR A 544 20.917 -5.530 -20.472 1.00 0.00 H ATOM 1655 HG21 THR A 544 21.702 -5.077 -22.005 1.00 0.00 H ATOM 1656 HG22 THR A 544 22.443 -4.613 -20.454 1.00 0.00 H ATOM 1657 H THR A 544 19.888 -3.455 -23.806 1.00 0.00 H ATOM 1658 N GLN A 545 17.852 -2.116 -20.647 1.00 23.84 N ATOM 1659 CA GLN A 545 17.117 -0.881 -20.463 1.00 25.10 C ATOM 1660 C GLN A 545 17.308 -0.454 -19.022 1.00 26.45 C ATOM 1661 O GLN A 545 16.939 -1.171 -18.087 1.00 26.12 O ATOM 1662 CB GLN A 545 15.636 -1.079 -20.743 1.00 26.00 C ATOM 1663 CG GLN A 545 14.802 0.169 -20.518 1.00 28.34 C ATOM 1664 CD GLN A 545 15.285 1.349 -21.337 1.00 27.41 C ATOM 1665 OE1 GLN A 545 15.412 1.264 -22.559 1.00 27.60 O ATOM 1666 NE2 GLN A 545 15.552 2.461 -20.665 1.00 29.62 N ATOM 1667 HA GLN A 545 17.485 -0.124 -21.155 1.00 0.00 H ATOM 1668 HB2 GLN A 545 15.520 -1.389 -21.782 1.00 0.00 H ATOM 1669 HB3 GLN A 545 15.263 -1.866 -20.087 1.00 0.00 H ATOM 1670 HG2 GLN A 545 13.769 -0.047 -20.792 1.00 0.00 H ATOM 1671 HG3 GLN A 545 14.849 0.434 -19.462 1.00 0.00 H ATOM 1672 HE22 GLN A 545 15.430 2.487 -19.632 1.00 0.00 H ATOM 1673 HE21 GLN A 545 15.883 3.307 -21.171 1.00 0.00 H ATOM 1674 H GLN A 545 17.766 -2.865 -19.931 1.00 0.00 H ATOM 1675 N CYS A 546 17.907 0.712 -18.844 1.00 26.39 N ATOM 1676 CA CYS A 546 18.141 1.221 -17.512 1.00 26.13 C ATOM 1677 C CYS A 546 17.013 2.143 -17.105 1.00 26.59 C ATOM 1678 O CYS A 546 16.336 2.737 -17.946 1.00 27.12 O ATOM 1679 CB CYS A 546 19.468 1.969 -17.468 1.00 25.69 C ATOM 1680 SG CYS A 546 20.841 0.920 -17.839 1.00 27.64 S ATOM 1681 HA CYS A 546 18.182 0.384 -16.814 1.00 0.00 H ATOM 1682 HB2 CYS A 546 19.604 2.385 -16.470 1.00 0.00 H ATOM 1683 HB3 CYS A 546 19.438 2.779 -18.197 1.00 0.00 H ATOM 1684 HG CYS A 546 22.008 1.655 -17.783 1.00 0.00 H ATOM 1685 H CYS A 546 18.212 1.267 -19.669 1.00 0.00 H ATOM 1686 N VAL A 547 16.812 2.241 -15.801 1.00 27.55 N ATOM 1687 CA VAL A 547 15.785 3.096 -15.240 1.00 27.96 C ATOM 1688 C VAL A 547 16.251 3.521 -13.859 1.00 27.32 C ATOM 1689 O VAL A 547 16.882 2.745 -13.142 1.00 28.23 O ATOM 1690 CB VAL A 547 14.430 2.354 -15.116 1.00 27.68 C ATOM 1691 CG1 VAL A 547 14.593 1.095 -14.285 1.00 27.16 C ATOM 1692 CG2 VAL A 547 13.400 3.266 -14.480 1.00 26.41 C ATOM 1693 HA VAL A 547 15.631 3.954 -15.895 1.00 0.00 H ATOM 1694 HB VAL A 547 14.091 2.072 -16.113 1.00 0.00 H ATOM 1695 HG11 VAL A 547 15.317 0.436 -14.764 1.00 0.00 H ATOM 1696 HG12 VAL A 547 14.946 1.362 -13.289 1.00 0.00 H ATOM 1697 HG13 VAL A 547 13.633 0.586 -14.207 1.00 0.00 H ATOM 1698 HG21 VAL A 547 13.741 3.561 -13.488 1.00 0.00 H ATOM 1699 HG22 VAL A 547 13.270 4.153 -15.100 1.00 0.00 H ATOM 1700 HG23 VAL A 547 12.451 2.737 -14.396 1.00 0.00 H ATOM 1701 H VAL A 547 17.411 1.686 -15.157 1.00 0.00 H ATOM 1702 N GLN A 548 15.948 4.759 -13.499 1.00 27.38 N ATOM 1703 CA GLN A 548 16.317 5.287 -12.201 1.00 27.43 C ATOM 1704 C GLN A 548 15.493 4.665 -11.086 1.00 27.75 C ATOM 1705 O GLN A 548 14.309 4.374 -11.257 1.00 28.60 O ATOM 1706 CB GLN A 548 16.129 6.804 -12.185 1.00 31.28 C ATOM 1707 CG GLN A 548 17.342 7.570 -12.650 1.00 34.80 C ATOM 1708 CD GLN A 548 18.574 7.160 -11.873 1.00 38.81 C ATOM 1709 OE1 GLN A 548 18.591 7.221 -10.639 1.00 38.31 O ATOM 1710 NE2 GLN A 548 19.611 6.721 -12.590 1.00 40.75 N ATOM 1711 HA GLN A 548 17.364 5.038 -12.029 1.00 0.00 H ATOM 1712 HB2 GLN A 548 15.293 7.054 -12.838 1.00 0.00 H ATOM 1713 HB3 GLN A 548 15.897 7.112 -11.165 1.00 0.00 H ATOM 1714 HG2 GLN A 548 17.505 7.370 -13.709 1.00 0.00 H ATOM 1715 HG3 GLN A 548 17.168 8.636 -12.505 1.00 0.00 H ATOM 1716 HE22 GLN A 548 19.549 6.688 -13.628 1.00 0.00 H ATOM 1717 HE21 GLN A 548 20.481 6.412 -12.111 1.00 0.00 H ATOM 1718 H GLN A 548 15.432 5.368 -14.165 1.00 0.00 H ATOM 1719 N MET A 549 16.136 4.472 -9.942 1.00 28.11 N ATOM 1720 CA MET A 549 15.517 3.899 -8.750 1.00 28.59 C ATOM 1721 C MET A 549 14.291 4.677 -8.290 1.00 27.82 C ATOM 1722 O MET A 549 13.291 4.087 -7.883 1.00 27.57 O ATOM 1723 CB MET A 549 16.554 3.856 -7.624 1.00 30.54 C ATOM 1724 CG MET A 549 16.014 3.600 -6.225 1.00 33.72 C ATOM 1725 SD MET A 549 17.359 3.626 -4.979 1.00 36.57 S ATOM 1726 CE MET A 549 17.774 5.355 -4.954 1.00 36.93 C ATOM 1727 HA MET A 549 15.177 2.895 -9.004 1.00 0.00 H ATOM 1728 HB2 MET A 549 17.266 3.064 -7.857 1.00 0.00 H ATOM 1729 HB3 MET A 549 17.072 4.815 -7.611 1.00 0.00 H ATOM 1730 HG2 MET A 549 15.529 2.624 -6.204 1.00 0.00 H ATOM 1731 HG3 MET A 549 15.285 4.372 -5.978 1.00 0.00 H ATOM 1732 HE1 MET A 549 18.097 5.664 -5.948 1.00 0.00 H ATOM 1733 HE2 MET A 549 16.898 5.933 -4.659 1.00 0.00 H ATOM 1734 HE3 MET A 549 18.580 5.524 -4.240 1.00 0.00 H ATOM 1735 H MET A 549 17.138 4.744 -9.891 1.00 0.00 H ATOM 1736 N LYS A 550 14.371 6.003 -8.358 1.00 28.33 N ATOM 1737 CA LYS A 550 13.269 6.859 -7.926 1.00 28.51 C ATOM 1738 C LYS A 550 12.015 6.641 -8.754 1.00 27.71 C ATOM 1739 O LYS A 550 10.902 6.837 -8.270 1.00 29.12 O ATOM 1740 CB LYS A 550 13.680 8.339 -7.977 1.00 30.30 C ATOM 1741 CG LYS A 550 14.058 8.869 -9.359 1.00 33.92 C ATOM 1742 CD LYS A 550 14.715 10.251 -9.254 1.00 35.12 C ATOM 1743 CE LYS A 550 15.322 10.719 -10.580 1.00 36.78 C ATOM 1744 NZ LYS A 550 14.402 11.570 -11.393 1.00 39.06 N ATOM 1745 HA LYS A 550 13.038 6.584 -6.897 1.00 0.00 H ATOM 1746 HB2 LYS A 550 12.845 8.933 -7.606 1.00 0.00 H ATOM 1747 HB3 LYS A 550 14.539 8.472 -7.319 1.00 0.00 H ATOM 1748 HG2 LYS A 550 14.756 8.176 -9.829 1.00 0.00 H ATOM 1749 HG3 LYS A 550 13.159 8.946 -9.970 1.00 0.00 H ATOM 1750 HD2 LYS A 550 13.961 10.973 -8.941 1.00 0.00 H ATOM 1751 HD3 LYS A 550 15.506 10.206 -8.505 1.00 0.00 H ATOM 1752 HE2 LYS A 550 15.587 9.840 -11.167 1.00 0.00 H ATOM 1753 HE3 LYS A 550 16.222 11.294 -10.363 1.00 0.00 H ATOM 1754 HZ1 LYS A 550 13.542 11.031 -11.618 1.00 0.00 H ATOM 1755 HZ2 LYS A 550 14.148 12.420 -10.850 1.00 0.00 H ATOM 1756 HZ3 LYS A 550 14.878 11.849 -12.274 1.00 0.00 H ATOM 1757 H LYS A 550 15.239 6.441 -8.728 1.00 0.00 H ATOM 1758 N ASN A 551 12.190 6.222 -10.000 1.00 27.05 N ATOM 1759 CA ASN A 551 11.052 5.981 -10.862 1.00 26.34 C ATOM 1760 C ASN A 551 10.455 4.610 -10.647 1.00 25.79 C ATOM 1761 O ASN A 551 9.375 4.315 -11.144 1.00 25.88 O ATOM 1762 CB ASN A 551 11.445 6.169 -12.316 1.00 27.05 C ATOM 1763 CG ASN A 551 11.719 7.611 -12.638 1.00 28.98 C ATOM 1764 OD1 ASN A 551 10.937 8.488 -12.277 1.00 30.73 O ATOM 1765 ND2 ASN A 551 12.827 7.874 -13.318 1.00 29.87 N ATOM 1766 HA ASN A 551 10.285 6.710 -10.602 1.00 0.00 H ATOM 1767 HB2 ASN A 551 12.343 5.585 -12.517 1.00 0.00 H ATOM 1768 HB3 ASN A 551 10.633 5.814 -12.950 1.00 0.00 H ATOM 1769 HD22 ASN A 551 13.459 7.099 -13.602 1.00 0.00 H ATOM 1770 HD21 ASN A 551 13.064 8.856 -13.567 1.00 0.00 H ATOM 1771 H ASN A 551 13.153 6.065 -10.361 1.00 0.00 H ATOM 1772 N VAL A 552 11.168 3.768 -9.913 1.00 25.59 N ATOM 1773 CA VAL A 552 10.668 2.439 -9.608 1.00 26.44 C ATOM 1774 C VAL A 552 9.999 2.499 -8.229 1.00 28.19 C ATOM 1775 O VAL A 552 9.034 1.777 -7.966 1.00 27.99 O ATOM 1776 CB VAL A 552 11.797 1.392 -9.603 1.00 25.23 C ATOM 1777 CG1 VAL A 552 11.269 0.075 -9.078 1.00 26.16 C ATOM 1778 CG2 VAL A 552 12.327 1.195 -11.016 1.00 25.73 C ATOM 1779 HA VAL A 552 9.957 2.135 -10.376 1.00 0.00 H ATOM 1780 HB VAL A 552 12.604 1.744 -8.960 1.00 0.00 H ATOM 1781 HG11 VAL A 552 10.899 0.213 -8.062 1.00 0.00 H ATOM 1782 HG12 VAL A 552 10.458 -0.271 -9.718 1.00 0.00 H ATOM 1783 HG13 VAL A 552 12.072 -0.662 -9.077 1.00 0.00 H ATOM 1784 HG21 VAL A 552 11.519 0.850 -11.661 1.00 0.00 H ATOM 1785 HG22 VAL A 552 12.715 2.141 -11.392 1.00 0.00 H ATOM 1786 HG23 VAL A 552 13.125 0.453 -11.003 1.00 0.00 H ATOM 1787 H VAL A 552 12.097 4.063 -9.551 1.00 0.00 H ATOM 1788 N GLN A 553 10.509 3.374 -7.361 1.00 27.67 N ATOM 1789 CA GLN A 553 9.947 3.547 -6.027 1.00 28.94 C ATOM 1790 C GLN A 553 8.610 4.243 -6.173 1.00 29.71 C ATOM 1791 O GLN A 553 7.644 3.932 -5.472 1.00 29.21 O ATOM 1792 CB GLN A 553 10.855 4.422 -5.168 1.00 29.33 C ATOM 1793 CG GLN A 553 12.269 3.915 -5.058 1.00 31.53 C ATOM 1794 CD GLN A 553 13.131 4.813 -4.202 1.00 32.12 C ATOM 1795 OE1 GLN A 553 13.151 6.029 -4.389 1.00 32.25 O ATOM 1796 NE2 GLN A 553 13.857 4.218 -3.259 1.00 32.93 N ATOM 1797 HA GLN A 553 9.843 2.573 -5.549 1.00 0.00 H ATOM 1798 HB2 GLN A 553 10.882 5.421 -5.604 1.00 0.00 H ATOM 1799 HB3 GLN A 553 10.431 4.476 -4.165 1.00 0.00 H ATOM 1800 HG2 GLN A 553 12.252 2.919 -4.616 1.00 0.00 H ATOM 1801 HG3 GLN A 553 12.702 3.861 -6.057 1.00 0.00 H ATOM 1802 HE22 GLN A 553 13.807 3.186 -3.138 1.00 0.00 H ATOM 1803 HE21 GLN A 553 14.474 4.785 -2.643 1.00 0.00 H ATOM 1804 H GLN A 553 11.329 3.948 -7.643 1.00 0.00 H ATOM 1805 N ARG A 554 8.577 5.204 -7.088 1.00 30.35 N ATOM 1806 CA ARG A 554 7.373 5.965 -7.366 1.00 32.56 C ATOM 1807 C ARG A 554 7.172 6.016 -8.865 1.00 31.89 C ATOM 1808 O ARG A 554 7.886 6.729 -9.567 1.00 33.99 O ATOM 1809 CB ARG A 554 7.498 7.390 -6.828 1.00 36.07 C ATOM 1810 CG ARG A 554 7.172 7.540 -5.363 1.00 41.31 C ATOM 1811 CD ARG A 554 5.672 7.375 -5.111 1.00 46.96 C ATOM 1812 NE ARG A 554 4.999 8.647 -4.843 1.00 50.45 N ATOM 1813 CZ ARG A 554 5.323 9.470 -3.845 1.00 52.70 C ATOM 1814 NH1 ARG A 554 6.314 9.159 -3.015 1.00 52.91 N ATOM 1815 NH2 ARG A 554 4.653 10.604 -3.673 1.00 53.12 N ATOM 1816 HA ARG A 554 6.525 5.484 -6.879 1.00 0.00 H ATOM 1817 HB2 ARG A 554 8.524 7.724 -6.984 1.00 0.00 H ATOM 1818 HB3 ARG A 554 6.820 8.028 -7.394 1.00 0.00 H ATOM 1819 HG2 ARG A 554 7.713 6.781 -4.798 1.00 0.00 H ATOM 1820 HG3 ARG A 554 7.482 8.530 -5.029 1.00 0.00 H ATOM 1821 HD2 ARG A 554 5.533 6.719 -4.252 1.00 0.00 H ATOM 1822 HD3 ARG A 554 5.219 6.919 -5.991 1.00 0.00 H ATOM 1823 HE ARG A 554 4.219 8.927 -5.471 1.00 0.00 H ATOM 1824 HH12 ARG A 554 6.563 9.804 -2.238 1.00 0.00 H ATOM 1825 HH11 ARG A 554 6.840 8.271 -3.143 1.00 0.00 H ATOM 1826 HH22 ARG A 554 4.907 11.245 -2.894 1.00 0.00 H ATOM 1827 HH21 ARG A 554 3.875 10.851 -4.317 1.00 0.00 H ATOM 1828 H ARG A 554 9.442 5.419 -7.623 1.00 0.00 H ATOM 1829 N THR A 555 6.204 5.263 -9.366 1.00 29.69 N ATOM 1830 CA THR A 555 5.960 5.282 -10.797 1.00 28.03 C ATOM 1831 C THR A 555 4.944 6.350 -11.149 1.00 27.58 C ATOM 1832 O THR A 555 4.115 6.737 -10.323 1.00 27.63 O ATOM 1833 CB THR A 555 5.426 3.930 -11.311 1.00 27.59 C ATOM 1834 OG1 THR A 555 4.131 3.679 -10.745 1.00 28.11 O ATOM 1835 CG2 THR A 555 6.388 2.801 -10.939 1.00 25.87 C ATOM 1836 HA THR A 555 6.919 5.491 -11.272 1.00 0.00 H ATOM 1837 HB THR A 555 5.344 3.971 -12.397 1.00 0.00 H ATOM 1838 HG1 THR A 555 3.510 4.402 -11.012 1.00 0.00 H ATOM 1839 HG23 THR A 555 7.367 3.002 -11.374 1.00 0.00 H ATOM 1840 HG21 THR A 555 6.476 2.743 -9.854 1.00 0.00 H ATOM 1841 HG22 THR A 555 6.004 1.857 -11.325 1.00 0.00 H ATOM 1842 H THR A 555 5.626 4.665 -8.742 1.00 0.00 H ATOM 1843 N THR A 556 5.040 6.835 -12.380 1.00 27.76 N ATOM 1844 CA THR A 556 4.123 7.825 -12.912 1.00 28.87 C ATOM 1845 C THR A 556 3.817 7.350 -14.326 1.00 29.64 C ATOM 1846 O THR A 556 4.630 6.659 -14.945 1.00 30.44 O ATOM 1847 CB THR A 556 4.757 9.212 -12.997 1.00 29.12 C ATOM 1848 OG1 THR A 556 5.743 9.223 -14.031 1.00 28.39 O ATOM 1849 CG2 THR A 556 5.415 9.569 -11.675 1.00 31.38 C ATOM 1850 HA THR A 556 3.245 7.915 -12.272 1.00 0.00 H ATOM 1851 HB THR A 556 3.979 9.943 -13.219 1.00 0.00 H ATOM 1852 HG1 THR A 556 6.442 8.552 -13.826 1.00 0.00 H ATOM 1853 HG23 THR A 556 4.665 9.562 -10.884 1.00 0.00 H ATOM 1854 HG21 THR A 556 6.192 8.839 -11.448 1.00 0.00 H ATOM 1855 HG22 THR A 556 5.858 10.562 -11.748 1.00 0.00 H ATOM 1856 H THR A 556 5.807 6.490 -12.991 1.00 0.00 H ATOM 1857 N PRO A 557 2.640 7.697 -14.853 1.00 29.52 N ATOM 1858 CA PRO A 557 2.314 7.258 -16.208 1.00 29.37 C ATOM 1859 C PRO A 557 3.310 7.757 -17.252 1.00 30.10 C ATOM 1860 O PRO A 557 3.588 7.065 -18.239 1.00 29.17 O ATOM 1861 CB PRO A 557 0.909 7.816 -16.412 1.00 29.10 C ATOM 1862 CG PRO A 557 0.322 7.698 -15.043 1.00 29.39 C ATOM 1863 CD PRO A 557 1.451 8.260 -14.191 1.00 29.70 C ATOM 1864 HA PRO A 557 2.364 6.176 -16.328 1.00 0.00 H ATOM 1865 HD3 PRO A 557 1.462 9.350 -14.215 1.00 0.00 H ATOM 1866 HD2 PRO A 557 1.375 7.922 -13.158 1.00 0.00 H ATOM 1867 HG3 PRO A 557 0.106 6.660 -14.788 1.00 0.00 H ATOM 1868 HG2 PRO A 557 -0.587 8.291 -14.945 1.00 0.00 H ATOM 1869 HB2 PRO A 557 0.940 8.855 -16.741 1.00 0.00 H ATOM 1870 HB3 PRO A 557 0.349 7.223 -17.135 1.00 0.00 H ATOM 1871 N GLN A 558 3.856 8.950 -17.024 1.00 30.88 N ATOM 1872 CA GLN A 558 4.806 9.530 -17.959 1.00 30.74 C ATOM 1873 C GLN A 558 6.150 8.828 -17.966 1.00 29.05 C ATOM 1874 O GLN A 558 6.745 8.632 -19.027 1.00 29.22 O ATOM 1875 CB GLN A 558 5.028 11.011 -17.678 1.00 33.13 C ATOM 1876 CG GLN A 558 5.420 11.747 -18.945 1.00 38.09 C ATOM 1877 CD GLN A 558 6.368 12.904 -18.706 1.00 41.12 C ATOM 1878 OE1 GLN A 558 6.081 13.807 -17.913 1.00 40.94 O ATOM 1879 NE2 GLN A 558 7.508 12.887 -19.403 1.00 41.44 N ATOM 1880 HA GLN A 558 4.354 9.399 -18.942 1.00 0.00 H ATOM 1881 HB2 GLN A 558 4.108 11.442 -17.284 1.00 0.00 H ATOM 1882 HB3 GLN A 558 5.823 11.120 -16.941 1.00 0.00 H ATOM 1883 HG2 GLN A 558 5.902 11.040 -19.619 1.00 0.00 H ATOM 1884 HG3 GLN A 558 4.515 12.134 -19.413 1.00 0.00 H ATOM 1885 HE22 GLN A 558 7.705 12.104 -20.059 1.00 0.00 H ATOM 1886 HE21 GLN A 558 8.198 13.656 -19.289 1.00 0.00 H ATOM 1887 H GLN A 558 3.599 9.475 -16.164 1.00 0.00 H ATOM 1888 N THR A 559 6.641 8.451 -16.793 1.00 28.22 N ATOM 1889 CA THR A 559 7.924 7.764 -16.739 1.00 27.05 C ATOM 1890 C THR A 559 7.794 6.355 -17.313 1.00 25.94 C ATOM 1891 O THR A 559 8.653 5.919 -18.087 1.00 25.61 O ATOM 1892 CB THR A 559 8.497 7.718 -15.296 1.00 26.95 C ATOM 1893 OG1 THR A 559 7.464 7.370 -14.370 1.00 27.26 O ATOM 1894 CG2 THR A 559 9.086 9.069 -14.919 1.00 26.56 C ATOM 1895 HA THR A 559 8.628 8.331 -17.348 1.00 0.00 H ATOM 1896 HB THR A 559 9.284 6.964 -15.258 1.00 0.00 H ATOM 1897 HG1 THR A 559 6.742 8.046 -14.413 1.00 0.00 H ATOM 1898 HG23 THR A 559 9.873 9.331 -15.626 1.00 0.00 H ATOM 1899 HG21 THR A 559 8.303 9.826 -14.948 1.00 0.00 H ATOM 1900 HG22 THR A 559 9.503 9.014 -13.914 1.00 0.00 H ATOM 1901 H THR A 559 6.113 8.645 -15.918 1.00 0.00 H ATOM 1902 N LEU A 560 6.722 5.649 -16.945 1.00 24.68 N ATOM 1903 CA LEU A 560 6.488 4.301 -17.471 1.00 23.71 C ATOM 1904 C LEU A 560 6.378 4.412 -18.993 1.00 23.77 C ATOM 1905 O LEU A 560 6.799 3.518 -19.726 1.00 24.93 O ATOM 1906 CB LEU A 560 5.191 3.708 -16.912 1.00 23.22 C ATOM 1907 CG LEU A 560 5.139 3.336 -15.431 1.00 22.73 C ATOM 1908 CD1 LEU A 560 3.701 3.124 -15.038 1.00 23.76 C ATOM 1909 CD2 LEU A 560 5.950 2.090 -15.153 1.00 21.15 C ATOM 1910 HA LEU A 560 7.309 3.647 -17.178 1.00 0.00 H ATOM 1911 HB2 LEU A 560 4.401 4.438 -17.089 1.00 0.00 H ATOM 1912 HB3 LEU A 560 4.980 2.801 -17.479 1.00 0.00 H ATOM 1913 HG LEU A 560 5.571 4.145 -14.842 1.00 0.00 H ATOM 1914 HD21 LEU A 560 5.550 1.260 -15.736 1.00 0.00 H ATOM 1915 HD22 LEU A 560 6.989 2.264 -15.433 1.00 0.00 H ATOM 1916 HD23 LEU A 560 5.894 1.851 -14.091 1.00 0.00 H ATOM 1917 HD11 LEU A 560 3.139 4.042 -15.210 1.00 0.00 H ATOM 1918 HD12 LEU A 560 3.277 2.319 -15.638 1.00 0.00 H ATOM 1919 HD13 LEU A 560 3.650 2.858 -13.982 1.00 0.00 H ATOM 1920 H LEU A 560 6.042 6.062 -16.275 1.00 0.00 H ATOM 1921 N SER A 561 5.799 5.517 -19.456 1.00 24.13 N ATOM 1922 CA SER A 561 5.652 5.761 -20.889 1.00 24.52 C ATOM 1923 C SER A 561 7.019 5.962 -21.539 1.00 25.01 C ATOM 1924 O SER A 561 7.319 5.342 -22.562 1.00 25.26 O ATOM 1925 CB SER A 561 4.789 6.998 -21.145 1.00 22.64 C ATOM 1926 OG SER A 561 4.777 7.305 -22.527 1.00 22.83 O ATOM 1927 HA SER A 561 5.165 4.889 -21.326 1.00 0.00 H ATOM 1928 HB2 SER A 561 5.197 7.844 -20.591 1.00 0.00 H ATOM 1929 HB3 SER A 561 3.770 6.803 -20.810 1.00 0.00 H ATOM 1930 HG SER A 561 4.216 8.106 -22.681 1.00 0.00 H ATOM 1931 H SER A 561 5.443 6.224 -18.782 1.00 0.00 H ATOM 1932 N ASN A 562 7.842 6.838 -20.958 1.00 25.04 N ATOM 1933 CA ASN A 562 9.182 7.076 -21.504 1.00 25.58 C ATOM 1934 C ASN A 562 9.901 5.734 -21.627 1.00 25.08 C ATOM 1935 O ASN A 562 10.564 5.455 -22.635 1.00 27.23 O ATOM 1936 CB ASN A 562 9.993 8.009 -20.594 1.00 25.24 C ATOM 1937 CG ASN A 562 9.304 9.341 -20.358 1.00 26.66 C ATOM 1938 OD1 ASN A 562 8.555 9.827 -21.210 1.00 27.86 O ATOM 1939 ND2 ASN A 562 9.569 9.950 -19.205 1.00 26.05 N ATOM 1940 HA ASN A 562 9.088 7.553 -22.479 1.00 0.00 H ATOM 1941 HB2 ASN A 562 10.141 7.517 -19.633 1.00 0.00 H ATOM 1942 HB3 ASN A 562 10.962 8.194 -21.058 1.00 0.00 H ATOM 1943 HD22 ASN A 562 10.207 9.503 -18.516 1.00 0.00 H ATOM 1944 HD21 ASN A 562 9.138 10.873 -18.993 1.00 0.00 H ATOM 1945 H ASN A 562 7.530 7.356 -20.112 1.00 0.00 H ATOM 1946 N LEU A 563 9.744 4.903 -20.599 1.00 24.05 N ATOM 1947 CA LEU A 563 10.352 3.584 -20.572 1.00 23.13 C ATOM 1948 C LEU A 563 9.842 2.700 -21.715 1.00 23.42 C ATOM 1949 O LEU A 563 10.644 2.112 -22.437 1.00 24.87 O ATOM 1950 CB LEU A 563 10.084 2.913 -19.227 1.00 22.80 C ATOM 1951 CG LEU A 563 10.926 1.677 -18.903 1.00 24.15 C ATOM 1952 CD1 LEU A 563 12.409 2.076 -18.793 1.00 25.54 C ATOM 1953 CD2 LEU A 563 10.441 1.065 -17.588 1.00 24.10 C ATOM 1954 HA LEU A 563 11.426 3.710 -20.707 1.00 0.00 H ATOM 1955 HB2 LEU A 563 10.264 3.652 -18.446 1.00 0.00 H ATOM 1956 HB3 LEU A 563 9.036 2.615 -19.208 1.00 0.00 H ATOM 1957 HG LEU A 563 10.820 0.940 -19.699 1.00 0.00 H ATOM 1958 HD21 LEU A 563 10.545 1.798 -16.788 1.00 0.00 H ATOM 1959 HD22 LEU A 563 9.394 0.778 -17.687 1.00 0.00 H ATOM 1960 HD23 LEU A 563 11.040 0.184 -17.356 1.00 0.00 H ATOM 1961 HD11 LEU A 563 12.740 2.503 -19.740 1.00 0.00 H ATOM 1962 HD12 LEU A 563 12.528 2.814 -17.999 1.00 0.00 H ATOM 1963 HD13 LEU A 563 13.005 1.193 -18.562 1.00 0.00 H ATOM 1964 H LEU A 563 9.167 5.208 -19.789 1.00 0.00 H ATOM 1965 N CYS A 564 8.523 2.600 -21.891 1.00 22.39 N ATOM 1966 CA CYS A 564 7.977 1.779 -22.980 1.00 23.94 C ATOM 1967 C CYS A 564 8.471 2.242 -24.347 1.00 25.27 C ATOM 1968 O CYS A 564 8.630 1.430 -25.270 1.00 26.22 O ATOM 1969 CB CYS A 564 6.449 1.813 -22.996 1.00 22.12 C ATOM 1970 SG CYS A 564 5.705 1.070 -21.572 1.00 25.59 S ATOM 1971 HA CYS A 564 8.326 0.764 -22.790 1.00 0.00 H ATOM 1972 HB2 CYS A 564 6.102 1.282 -23.882 1.00 0.00 H ATOM 1973 HB3 CYS A 564 6.128 2.853 -23.049 1.00 0.00 H ATOM 1974 HG CYS A 564 6.119 1.737 -20.437 1.00 0.00 H ATOM 1975 H CYS A 564 7.877 3.107 -21.253 1.00 0.00 H ATOM 1976 N LEU A 565 8.690 3.546 -24.488 1.00 23.52 N ATOM 1977 CA LEU A 565 9.172 4.081 -25.748 1.00 24.25 C ATOM 1978 C LEU A 565 10.636 3.698 -25.948 1.00 25.56 C ATOM 1979 O LEU A 565 11.024 3.258 -27.025 1.00 27.32 O ATOM 1980 CB LEU A 565 9.017 5.603 -25.783 1.00 24.55 C ATOM 1981 CG LEU A 565 7.617 6.199 -25.962 1.00 23.71 C ATOM 1982 CD1 LEU A 565 7.652 7.678 -25.616 1.00 22.77 C ATOM 1983 CD2 LEU A 565 7.130 5.984 -27.398 1.00 24.39 C ATOM 1984 HA LEU A 565 8.577 3.656 -26.557 1.00 0.00 H ATOM 1985 HB2 LEU A 565 9.411 5.987 -24.842 1.00 0.00 H ATOM 1986 HB3 LEU A 565 9.629 5.969 -26.608 1.00 0.00 H ATOM 1987 HG LEU A 565 6.918 5.698 -25.292 1.00 0.00 H ATOM 1988 HD21 LEU A 565 7.817 6.471 -28.090 1.00 0.00 H ATOM 1989 HD22 LEU A 565 7.094 4.916 -27.612 1.00 0.00 H ATOM 1990 HD23 LEU A 565 6.134 6.413 -27.511 1.00 0.00 H ATOM 1991 HD11 LEU A 565 7.971 7.800 -24.581 1.00 0.00 H ATOM 1992 HD12 LEU A 565 8.353 8.188 -26.277 1.00 0.00 H ATOM 1993 HD13 LEU A 565 6.656 8.103 -25.743 1.00 0.00 H ATOM 1994 H LEU A 565 8.514 4.188 -23.689 1.00 0.00 H ATOM 1995 N LYS A 566 11.458 3.867 -24.921 1.00 25.84 N ATOM 1996 CA LYS A 566 12.863 3.500 -25.067 1.00 26.60 C ATOM 1997 C LYS A 566 12.967 2.009 -25.357 1.00 27.02 C ATOM 1998 O LYS A 566 13.779 1.576 -26.174 1.00 27.63 O ATOM 1999 CB LYS A 566 13.647 3.833 -23.800 1.00 27.68 C ATOM 2000 CG LYS A 566 13.751 5.322 -23.497 1.00 28.63 C ATOM 2001 CD LYS A 566 14.343 5.529 -22.109 1.00 32.63 C ATOM 2002 CE LYS A 566 14.475 7.008 -21.739 1.00 34.61 C ATOM 2003 NZ LYS A 566 15.483 7.727 -22.563 1.00 36.97 N ATOM 2004 HA LYS A 566 13.289 4.070 -25.893 1.00 0.00 H ATOM 2005 HB2 LYS A 566 13.156 3.347 -22.957 1.00 0.00 H ATOM 2006 HB3 LYS A 566 14.656 3.436 -23.909 1.00 0.00 H ATOM 2007 HG2 LYS A 566 14.393 5.798 -24.239 1.00 0.00 H ATOM 2008 HG3 LYS A 566 12.758 5.769 -23.537 1.00 0.00 H ATOM 2009 HD2 LYS A 566 13.697 5.042 -21.378 1.00 0.00 H ATOM 2010 HD3 LYS A 566 15.332 5.072 -22.080 1.00 0.00 H ATOM 2011 HE2 LYS A 566 14.768 7.079 -20.692 1.00 0.00 H ATOM 2012 HE3 LYS A 566 13.506 7.488 -21.878 1.00 0.00 H ATOM 2013 HZ1 LYS A 566 16.415 7.284 -22.433 1.00 0.00 H ATOM 2014 HZ2 LYS A 566 15.210 7.675 -23.565 1.00 0.00 H ATOM 2015 HZ3 LYS A 566 15.526 8.723 -22.265 1.00 0.00 H ATOM 2016 H LYS A 566 11.106 4.256 -24.023 1.00 0.00 H ATOM 2017 N ILE A 567 12.138 1.222 -24.682 1.00 26.51 N ATOM 2018 CA ILE A 567 12.141 -0.218 -24.879 1.00 25.26 C ATOM 2019 C ILE A 567 11.654 -0.556 -26.286 1.00 26.62 C ATOM 2020 O ILE A 567 12.181 -1.464 -26.941 1.00 27.13 O ATOM 2021 CB ILE A 567 11.236 -0.919 -23.831 1.00 24.01 C ATOM 2022 CG1 ILE A 567 11.920 -0.880 -22.464 1.00 22.07 C ATOM 2023 CG2 ILE A 567 10.911 -2.353 -24.265 1.00 20.03 C ATOM 2024 CD1 ILE A 567 11.125 -1.552 -21.363 1.00 23.10 C ATOM 2025 HA ILE A 567 13.163 -0.577 -24.754 1.00 0.00 H ATOM 2026 HB ILE A 567 10.287 -0.388 -23.756 1.00 0.00 H ATOM 2027 HG12 ILE A 567 12.884 -1.382 -22.547 1.00 0.00 H ATOM 2028 HG13 ILE A 567 12.077 0.163 -22.188 1.00 0.00 H ATOM 2029 HD11 ILE A 567 10.161 -1.055 -21.257 1.00 0.00 H ATOM 2030 HD12 ILE A 567 10.969 -2.600 -21.617 1.00 0.00 H ATOM 2031 HD13 ILE A 567 11.676 -1.483 -20.425 1.00 0.00 H ATOM 2032 HG21 ILE A 567 10.390 -2.332 -25.222 1.00 0.00 H ATOM 2033 HG22 ILE A 567 11.837 -2.919 -24.366 1.00 0.00 H ATOM 2034 HG23 ILE A 567 10.276 -2.823 -23.514 1.00 0.00 H ATOM 2035 H ILE A 567 11.475 1.643 -24.000 1.00 0.00 H ATOM 2036 N ASN A 568 10.657 0.182 -26.761 1.00 26.92 N ATOM 2037 CA ASN A 568 10.130 -0.093 -28.084 1.00 28.68 C ATOM 2038 C ASN A 568 11.146 0.180 -29.184 1.00 30.49 C ATOM 2039 O ASN A 568 11.211 -0.549 -30.169 1.00 31.14 O ATOM 2040 CB ASN A 568 8.866 0.702 -28.346 1.00 25.21 C ATOM 2041 CG ASN A 568 8.115 0.180 -29.553 1.00 27.05 C ATOM 2042 OD1 ASN A 568 8.551 0.356 -30.692 1.00 25.00 O ATOM 2043 ND2 ASN A 568 6.991 -0.490 -29.308 1.00 25.14 N ATOM 2044 HA ASN A 568 9.895 -1.157 -28.104 1.00 0.00 H ATOM 2045 HB2 ASN A 568 8.219 0.635 -27.471 1.00 0.00 H ATOM 2046 HB3 ASN A 568 9.134 1.744 -28.520 1.00 0.00 H ATOM 2047 HD22 ASN A 568 6.662 -0.613 -28.329 1.00 0.00 H ATOM 2048 HD21 ASN A 568 6.442 -0.890 -30.095 1.00 0.00 H ATOM 2049 H ASN A 568 10.257 0.952 -26.188 1.00 0.00 H ATOM 2050 N VAL A 569 11.937 1.230 -29.022 1.00 31.42 N ATOM 2051 CA VAL A 569 12.950 1.545 -30.010 1.00 32.43 C ATOM 2052 C VAL A 569 14.003 0.440 -30.025 1.00 32.81 C ATOM 2053 O VAL A 569 14.423 -0.019 -31.092 1.00 32.50 O ATOM 2054 CB VAL A 569 13.629 2.899 -29.699 1.00 33.56 C ATOM 2055 CG1 VAL A 569 14.966 2.994 -30.415 1.00 34.04 C ATOM 2056 CG2 VAL A 569 12.727 4.043 -30.148 1.00 33.22 C ATOM 2057 HA VAL A 569 12.469 1.618 -30.986 1.00 0.00 H ATOM 2058 HB VAL A 569 13.797 2.969 -28.624 1.00 0.00 H ATOM 2059 HG11 VAL A 569 15.614 2.184 -30.080 1.00 0.00 H ATOM 2060 HG12 VAL A 569 14.807 2.913 -31.490 1.00 0.00 H ATOM 2061 HG13 VAL A 569 15.432 3.953 -30.186 1.00 0.00 H ATOM 2062 HG21 VAL A 569 12.550 3.965 -31.221 1.00 0.00 H ATOM 2063 HG22 VAL A 569 11.777 3.985 -29.617 1.00 0.00 H ATOM 2064 HG23 VAL A 569 13.211 4.994 -29.926 1.00 0.00 H ATOM 2065 H VAL A 569 11.831 1.832 -28.181 1.00 0.00 H ATOM 2066 N LYS A 570 14.404 0.003 -28.833 1.00 33.83 N ATOM 2067 CA LYS A 570 15.424 -1.034 -28.684 1.00 34.11 C ATOM 2068 C LYS A 570 15.109 -2.411 -29.266 1.00 35.06 C ATOM 2069 O LYS A 570 15.988 -3.054 -29.836 1.00 36.80 O ATOM 2070 CB LYS A 570 15.798 -1.195 -27.212 1.00 32.25 C ATOM 2071 CG LYS A 570 16.567 -0.025 -26.632 1.00 31.27 C ATOM 2072 CD LYS A 570 17.012 -0.343 -25.220 1.00 31.40 C ATOM 2073 CE LYS A 570 17.918 0.720 -24.639 1.00 29.44 C ATOM 2074 NZ LYS A 570 17.220 2.002 -24.369 1.00 30.62 N ATOM 2075 HA LYS A 570 16.251 -0.661 -29.288 1.00 0.00 H ATOM 2076 HB2 LYS A 570 14.880 -1.319 -26.638 1.00 0.00 H ATOM 2077 HB3 LYS A 570 16.411 -2.090 -27.111 1.00 0.00 H ATOM 2078 HG2 LYS A 570 17.443 0.173 -27.250 1.00 0.00 H ATOM 2079 HG3 LYS A 570 15.926 0.857 -26.618 1.00 0.00 H ATOM 2080 HD2 LYS A 570 16.129 -0.432 -24.588 1.00 0.00 H ATOM 2081 HD3 LYS A 570 17.548 -1.292 -25.229 1.00 0.00 H ATOM 2082 HE2 LYS A 570 18.728 0.908 -25.344 1.00 0.00 H ATOM 2083 HE3 LYS A 570 18.333 0.347 -23.702 1.00 0.00 H ATOM 2084 HZ1 LYS A 570 16.827 2.375 -25.257 1.00 0.00 H ATOM 2085 HZ2 LYS A 570 16.450 1.840 -23.689 1.00 0.00 H ATOM 2086 HZ3 LYS A 570 17.895 2.686 -23.973 1.00 0.00 H ATOM 2087 H LYS A 570 13.977 0.413 -27.978 1.00 0.00 H ATOM 2088 N LEU A 571 13.876 -2.880 -29.120 1.00 35.68 N ATOM 2089 CA LEU A 571 13.533 -4.195 -29.647 1.00 35.73 C ATOM 2090 C LEU A 571 12.679 -4.070 -30.896 1.00 36.71 C ATOM 2091 O LEU A 571 12.242 -5.075 -31.464 1.00 37.18 O ATOM 2092 CB LEU A 571 12.770 -5.003 -28.601 1.00 35.57 C ATOM 2093 CG LEU A 571 13.315 -5.072 -27.176 1.00 35.50 C ATOM 2094 CD1 LEU A 571 12.462 -6.055 -26.388 1.00 37.22 C ATOM 2095 CD2 LEU A 571 14.761 -5.521 -27.170 1.00 34.82 C ATOM 2096 HA LEU A 571 14.462 -4.706 -29.899 1.00 0.00 H ATOM 2097 HB2 LEU A 571 11.767 -4.580 -28.540 1.00 0.00 H ATOM 2098 HB3 LEU A 571 12.709 -6.027 -28.970 1.00 0.00 H ATOM 2099 HG LEU A 571 13.274 -4.082 -26.722 1.00 0.00 H ATOM 2100 HD21 LEU A 571 14.835 -6.510 -27.622 1.00 0.00 H ATOM 2101 HD22 LEU A 571 15.362 -4.814 -27.741 1.00 0.00 H ATOM 2102 HD23 LEU A 571 15.123 -5.561 -26.143 1.00 0.00 H ATOM 2103 HD11 LEU A 571 11.428 -5.710 -26.378 1.00 0.00 H ATOM 2104 HD12 LEU A 571 12.514 -7.037 -26.858 1.00 0.00 H ATOM 2105 HD13 LEU A 571 12.835 -6.119 -25.366 1.00 0.00 H ATOM 2106 H LEU A 571 13.156 -2.311 -28.631 1.00 0.00 H ATOM 2107 N GLY A 572 12.440 -2.832 -31.317 1.00 37.41 N ATOM 2108 CA GLY A 572 11.624 -2.590 -32.492 1.00 38.46 C ATOM 2109 C GLY A 572 12.319 -2.916 -33.799 1.00 39.54 C ATOM 2110 O GLY A 572 11.672 -2.971 -34.847 1.00 40.21 O ATOM 2111 HA3 GLY A 572 11.344 -1.537 -32.505 1.00 0.00 H ATOM 2112 HA2 GLY A 572 10.725 -3.203 -32.418 1.00 0.00 H ATOM 2113 H GLY A 572 12.843 -2.026 -30.797 1.00 0.00 H TER 2114 GLY A 572 HETATM 2115 O HOH 1 31.283 -6.468 -14.227 1.00 19.48 O HETATM 2116 O HOH 2 2.246 5.152 -12.091 1.00 39.40 O HETATM 2117 O HOH 3 -2.990 -3.811 -10.963 1.00 21.17 O HETATM 2118 O HOH 4 10.089 -13.568 -18.240 1.00 24.99 O HETATM 2119 O HOH 5 16.597 -8.478 -27.319 1.00 37.05 O HETATM 2120 O HOH 6 17.098 7.071 -8.527 1.00 34.25 O HETATM 2121 O HOH 7 21.528 -3.788 -4.650 1.00 34.30 O HETATM 2122 O HOH 8 32.561 -0.074 -17.409 1.00 15.70 O HETATM 2123 O HOH 9 18.804 -9.049 -26.318 1.00 23.74 O HETATM 2124 O HOH 10 6.082 -9.634 -11.070 1.00 36.21 O HETATM 2125 O HOH 11 12.834 -5.890 0.086 1.00 49.14 O HETATM 2126 O HOH 12 15.834 -21.511 -20.170 1.00 47.47 O HETATM 2127 O HOH 13 36.401 -8.353 -17.860 1.00 36.07 O HETATM 2128 O HOH 14 4.291 -3.856 -29.955 1.00 41.95 O HETATM 2129 O HOH 15 4.284 -7.525 -10.229 1.00 19.22 O HETATM 2130 O HOH 16 32.470 -14.918 -23.825 1.00 44.62 O HETATM 2131 O HOH 17 1.841 -6.613 -20.495 1.00 21.84 O HETATM 2132 O HOH 18 27.944 -7.793 -28.835 1.00 42.16 O HETATM 2133 O HOH 19 27.010 -10.977 -9.842 1.00 24.14 O HETATM 2134 O HOH 20 24.262 -21.870 -21.061 1.00 16.78 O HETATM 2135 O HOH 21 32.253 3.547 -15.795 1.00 42.79 O HETATM 2136 O HOH 22 13.555 -19.011 -20.939 1.00 26.25 O HETATM 2137 O HOH 23 2.276 -6.601 -30.303 1.00 45.95 O HETATM 2138 O HOH 24 -1.590 -6.208 -25.950 1.00 38.25 O HETATM 2139 O HOH 25 21.735 -12.862 -26.334 1.00 63.66 O HETATM 2140 O HOH 26 34.714 -2.839 -13.069 1.00 39.68 O HETATM 2141 O HOH 27 5.242 3.100 -41.519 1.00 48.44 O HETATM 2142 O HOH 28 25.439 -13.437 -10.426 1.00 24.26 O HETATM 2143 O HOH 29 13.705 -10.080 -28.733 1.00 41.54 O HETATM 2144 O HOH 30 8.637 -9.602 -30.330 1.00 50.15 O HETATM 2145 O HOH 31 19.208 -10.406 -1.858 1.00 34.82 O HETATM 2146 O HOH 32 23.544 -1.549 -3.434 1.00 38.94 O HETATM 2147 O HOH 33 29.266 -6.526 -2.942 1.00 47.65 O HETATM 2148 O HOH 34 3.007 5.249 -7.547 1.00 40.99 O HETATM 2149 O HOH 35 22.581 -5.287 -27.466 1.00 44.25 O HETATM 2150 O HOH 36 1.101 -11.549 -13.789 1.00 45.53 O HETATM 2151 O HOH 37 18.233 12.605 -25.729 1.00 54.92 O HETATM 2152 PA GTG A 38 18.907 3.218 -21.564 1.00 0.30 P HETATM 2153 O1A GTG A 38 18.793 2.066 -20.631 1.00 -0.61 O HETATM 2154 O2A GTG A 38 17.399 3.605 -22.012 1.00 -0.61 O HETATM 2155 O3A GTG A 38 19.845 2.575 -22.778 1.00 -0.13 O HETATM 2156 PB GTG A 38 20.784 3.672 -23.660 1.00 0.34 P HETATM 2157 O1B GTG A 38 22.165 3.944 -22.828 1.00 -0.61 O HETATM 2158 O2B GTG A 38 21.181 2.979 -24.878 1.00 -0.61 O HETATM 2159 O3B GTG A 38 20.038 5.152 -24.219 1.00 -0.13 O HETATM 2160 PG GTG A 38 19.999 5.306 -25.762 1.00 0.30 P HETATM 2161 O1G GTG A 38 21.484 4.876 -26.493 1.00 -0.61 O HETATM 2162 O2G GTG A 38 18.880 4.501 -26.394 1.00 -0.61 O HETATM 2163 O5E GTG A 38 20.073 6.905 -26.134 1.00 -0.25 O HETATM 2164 C5E GTG A 38 19.645 7.164 -27.493 1.00 0.11 C HETATM 2165 C4E GTG A 38 19.835 8.641 -27.648 1.00 0.12 C HETATM 2166 O4E GTG A 38 21.163 8.708 -28.403 1.00 -0.33 O HETATM 2167 C1E GTG A 38 21.246 9.736 -29.527 1.00 0.22 C HETATM 2168 C2E GTG A 38 19.761 9.773 -29.904 1.00 0.14 C HETATM 2169 C3E GTG A 38 18.991 9.292 -28.708 1.00 0.12 C HETATM 2170 O3E GTG A 38 18.529 10.433 -27.969 1.00 -0.39 O HETATM 2171 H21 GTG A 38 17.965 10.960 -28.523 1.00 0.21 H HETATM 2172 H20 GTG A 38 18.171 8.634 -29.033 1.00 0.06 H HETATM 2173 O2E GTG A 38 19.348 11.107 -30.249 1.00 -0.38 O HETATM 2174 H23 GTG A 38 19.513 11.688 -29.516 1.00 0.21 H HETATM 2175 H22 GTG A 38 19.579 9.107 -30.760 1.00 0.07 H HETATM 2176 N9B GTG A 38 21.688 9.403 -30.911 1.00 -0.10 N HETATM 2177 C8B GTG A 38 22.050 8.205 -31.452 1.00 0.19 C HETATM 2178 N7B GTG A 38 22.281 8.364 -32.746 1.00 -0.19 N HETATM 2179 C5B GTG A 38 22.078 9.686 -33.094 1.00 0.26 C HETATM 2180 C6B GTG A 38 22.136 10.466 -34.328 1.00 0.26 C HETATM 2181 O6B GTG A 38 22.408 9.943 -35.407 1.00 -0.36 O HETATM 2182 N1B GTG A 38 21.871 11.818 -34.272 1.00 -0.25 N HETATM 2183 C2B GTG A 38 21.553 12.415 -33.069 1.00 0.20 C HETATM 2184 N2B GTG A 38 21.312 13.770 -33.030 1.00 -0.33 N HETATM 2185 H27 GTG A 38 21.074 14.225 -32.137 1.00 0.18 H HETATM 2186 H28 GTG A 38 21.370 14.328 -33.894 1.00 0.18 H HETATM 2187 N3B GTG A 38 21.472 11.703 -31.938 1.00 -0.19 N HETATM 2188 C4B GTG A 38 21.727 10.362 -31.914 1.00 0.33 C HETATM 2189 H29 GTG A 38 21.210 12.180 -31.063 1.00 0.25 H HETATM 2190 H26 GTG A 38 21.909 12.368 -35.106 1.00 0.18 H HETATM 2191 H25 GTG A 38 22.136 7.266 -30.906 1.00 0.18 H HETATM 2192 H24 GTG A 38 21.701 10.671 -29.169 1.00 0.10 H HETATM 2193 H19 GTG A 38 19.799 9.168 -26.683 1.00 0.07 H HETATM 2194 H17 GTG A 38 18.589 6.887 -27.631 1.00 0.06 H HETATM 2195 H18 GTG A 38 20.267 6.611 -28.212 1.00 0.06 H HETATM 2196 O5D GTG A 38 19.604 4.358 -20.617 1.00 -0.25 O HETATM 2197 C5D GTG A 38 18.578 4.970 -19.776 1.00 0.11 C HETATM 2198 C4D GTG A 38 19.193 5.642 -18.535 1.00 0.12 C HETATM 2199 O4D GTG A 38 20.387 6.427 -18.545 1.00 -0.35 O HETATM 2200 C1D GTG A 38 20.494 6.332 -17.109 1.00 0.17 C HETATM 2201 N9A GTG A 38 21.757 6.564 -16.418 1.00 -0.16 N HETATM 2202 C8A GTG A 38 21.996 6.153 -15.143 1.00 0.23 C HETATM 2203 N7A GTG A 38 23.192 6.449 -14.777 1.00 -0.05 N HETATM 2204 C7X GTG A 38 23.754 6.129 -13.480 1.00 0.10 C HETATM 2205 H2 GTG A 38 22.995 5.622 -12.866 1.00 0.07 H HETATM 2206 H3 GTG A 38 24.071 7.056 -12.979 1.00 0.07 H HETATM 2207 H4 GTG A 38 24.622 5.467 -13.610 1.00 0.07 H HETATM 2208 C5A GTG A 38 23.829 7.075 -15.797 1.00 0.45 C HETATM 2209 C6A GTG A 38 25.146 7.626 -15.990 1.00 0.41 C HETATM 2210 O6A GTG A 38 25.988 7.570 -15.104 1.00 -0.28 O HETATM 2211 N1A GTG A 38 25.443 8.206 -17.204 1.00 -0.22 N HETATM 2212 C2A GTG A 38 24.494 8.266 -18.213 1.00 0.23 C HETATM 2213 N2A GTG A 38 24.817 8.852 -19.411 1.00 -0.33 N HETATM 2214 H6 GTG A 38 24.118 8.901 -20.166 1.00 0.18 H HETATM 2215 H7 GTG A 38 25.759 9.243 -19.556 1.00 0.18 H HETATM 2216 N3A GTG A 38 23.268 7.757 -18.045 1.00 -0.15 N HETATM 2217 C4A GTG A 38 22.898 7.168 -16.872 1.00 0.41 C HETATM 2218 H8 GTG A 38 22.589 7.811 -18.818 1.00 0.29 H HETATM 2219 H5 GTG A 38 26.354 8.588 -17.359 1.00 0.19 H HETATM 2220 H1 GTG A 38 21.269 5.640 -14.515 1.00 0.22 H HETATM 2221 C2D GTG A 38 19.233 7.071 -16.610 1.00 0.12 C HETATM 2222 C3D GTG A 38 18.228 6.500 -17.654 1.00 0.11 C HETATM 2223 O3D GTG A 38 17.141 5.765 -17.091 1.00 -0.39 O HETATM 2224 H13 GTG A 38 17.482 5.072 -16.538 1.00 0.21 H HETATM 2225 H12 GTG A 38 17.798 7.318 -18.250 1.00 0.06 H HETATM 2226 O2D GTG A 38 18.845 6.768 -15.262 1.00 -0.39 O HETATM 2227 H15 GTG A 38 18.805 5.825 -15.149 1.00 0.21 H HETATM 2228 H14 GTG A 38 19.346 8.161 -16.704 1.00 0.07 H HETATM 2229 H16 GTG A 38 20.311 5.270 -16.889 1.00 0.08 H HETATM 2230 H11 GTG A 38 19.456 4.768 -17.922 1.00 0.07 H HETATM 2231 H9 GTG A 38 17.873 4.192 -19.449 1.00 0.06 H HETATM 2232 H10 GTG A 38 18.040 5.729 -20.363 1.00 0.06 H CONECT 1 2 22 23 24 CONECT 22 1 CONECT 23 1 CONECT 24 1 CONECT 2152 2153 2154 2155 2196 CONECT 2153 2152 CONECT 2154 2152 CONECT 2155 2152 2156 CONECT 2156 2155 2157 2158 2159 CONECT 2157 2156 CONECT 2158 2156 CONECT 2159 2156 2160 CONECT 2160 2159 2161 2162 2163 CONECT 2161 2160 CONECT 2162 2160 CONECT 2163 2160 2164 CONECT 2164 2163 2165 2194 2195 CONECT 2165 2164 2166 2169 2193 CONECT 2166 2165 2167 CONECT 2167 2166 2168 2176 2192 CONECT 2168 2167 2169 2173 2175 CONECT 2169 2165 2168 2170 2172 CONECT 2170 2169 2171 CONECT 2171 2170 CONECT 2172 2169 CONECT 2173 2168 2174 CONECT 2174 2173 CONECT 2175 2168 CONECT 2176 2167 2177 2188 CONECT 2177 2176 2178 2191 CONECT 2178 2177 2179 CONECT 2179 2178 2180 2188 CONECT 2180 2179 2181 2182 CONECT 2181 2180 CONECT 2182 2180 2183 2190 CONECT 2183 2182 2184 2187 CONECT 2184 2183 2185 2186 CONECT 2185 2184 CONECT 2186 2184 CONECT 2187 2183 2188 2189 CONECT 2188 2176 2179 2187 CONECT 2189 2187 CONECT 2190 2182 CONECT 2191 2177 CONECT 2192 2167 CONECT 2193 2165 CONECT 2194 2164 CONECT 2195 2164 CONECT 2196 2152 2197 CONECT 2197 2196 2198 2231 2232 CONECT 2198 2197 2199 2222 2230 CONECT 2199 2198 2200 CONECT 2200 2199 2201 2221 2229 CONECT 2201 2200 2202 2217 CONECT 2202 2201 2203 2220 CONECT 2203 2202 2204 2208 CONECT 2204 2203 2205 2206 2207 CONECT 2205 2204 CONECT 2206 2204 CONECT 2207 2204 CONECT 2208 2203 2209 2217 CONECT 2209 2208 2210 2211 CONECT 2210 2209 CONECT 2211 2209 2212 2219 CONECT 2212 2211 2213 2216 CONECT 2213 2212 2214 2215 CONECT 2214 2213 CONECT 2215 2213 CONECT 2216 2212 2217 2218 CONECT 2217 2201 2208 2216 CONECT 2218 2216 CONECT 2219 2211 CONECT 2220 2202 CONECT 2221 2200 2222 2226 2228 CONECT 2222 2198 2221 2223 2225 CONECT 2223 2222 2224 CONECT 2224 2223 CONECT 2225 2222 CONECT 2226 2221 2227 CONECT 2227 2226 CONECT 2228 2221 CONECT 2229 2200 CONECT 2230 2198 CONECT 2231 2197 CONECT 2232 2197 MASTER 0 0 0 0 0 0 0 0 2231 1 85 11 END
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Structure:
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Related entries of code: 3qx8
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3qx9
RCSB PDB
PDBbind
138aa, >3QX9_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3hxi
RCSB PDB
PDBbind
GTG
5tef
RCSB PDB
PDBbind
GTG
Entry Information
PDB ID
3qx8
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
MID domain from Protein argonaute-2
Ligand Name
GTG
EC.Number
E.C.-.-.-.-
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
Kd=1.37mM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) Embo Rep. Vol. 12: pp. 415-420
Ligand Properties
Formula
C
2
1
H
3
5
N
1
0
O
1
8
P
3
Molecular Weight
808.480
Exact Mass
808.134
No. of atoms
87
No. of bonds
92
Polar Surface Area
472.17
LOGP Value
-6.40 (
Computed with XLOGP3
)
-5.07 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 13
No. of Rotatable Bonds: 16
No. of Nitrogen and Oxygen Atoms: 28
No. of Rings: 6
Canonical SMILES
Nc1[nH+]c(=O)c2c([nH]1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)COP(OP(OP(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cn(c2c1[nH]c(N)[nH+]c2=O)C)(O)O)(O)O)(O)O
InChI String
InChI=1S/C21H36N10O18P3/c1-29-5-31(15-9(29)17(37)28-21(23)26-15)19-13(35)11(33)7(47-19)3-45-51(40,41)49-52(42,43)48-50(38,39)44-2-6-10(32)12(34)18(46-6)30-4-24-8-14(30)25-20(22)27-16(8)36/h4-7,10-13,18-19,32-35,38-43,50-52H,2-3H2,1H3,(H3,22,25,27,36)(H3,23,26,28,37)/p+2/t6-,7-,10-,11-,12-,13-,18-,19-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9UKV8
Entrez Gene ID
NCBI Entrez Gene ID:
27161
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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