Browse entries in the PDBbind-CN Database
HEADER 5C13_COMPLEX COMPND 5C13_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 59 MET TYR VAL ILE ARG ASP GLU TRP GLY ASN GLN ILE TRP SEQRES 2 A 59 ILE CYS PRO GLY CYS ASN LYS PRO ASP ASP GLY SER PRO SEQRES 3 A 59 MET ILE GLY CYS ASP ASP CYS ASP ASP TRP TYR HIS TRP SEQRES 4 A 59 PRO CYS VAL GLY ILE MET THR ALA PRO PRO GLU GLU MET SEQRES 5 A 59 GLN TRP PHE CYS PRO LYS CYS SEQRES 1 E 59 MET TYR VAL ILE ARG ASP GLU TRP GLY ASN GLN ILE TRP SEQRES 2 E 59 ILE CYS PRO GLY CYS ASN LYS PRO ASP ASP GLY SER PRO SEQRES 3 E 59 MET ILE GLY CYS ASP ASP CYS ASP ASP TRP TYR HIS TRP SEQRES 4 E 59 PRO CYS VAL GLY ILE MET THR ALA PRO PRO GLU GLU MET SEQRES 5 E 59 GLN TRP PHE CYS PRO LYS CYS HET ZN A 1 1 HET ZN A 2 1 HET ZN A 3 1 HET ZN A 4 1 HET ALA A 159 113 ATOM 1 N MET A 856 0.005 6.688 46.019 1.00 20.37 N ATOM 2 CA MET A 856 0.218 5.525 46.897 1.00 20.85 C ATOM 3 C MET A 856 -0.228 5.643 48.395 1.00 27.91 C ATOM 4 O MET A 856 0.165 6.550 49.141 1.00 22.21 O ATOM 5 CB MET A 856 1.700 5.142 46.904 1.00 28.37 C ATOM 6 CG MET A 856 2.220 4.505 45.619 1.00 23.85 C ATOM 7 SD MET A 856 3.966 4.110 45.748 1.00 22.08 S ATOM 8 CE MET A 856 3.837 2.346 46.097 1.00 18.66 C ATOM 9 HN3 MET A 856 0.529 7.505 46.394 1.00 0.00 H ATOM 10 HN2 MET A 856 -1.010 6.912 45.983 1.00 0.00 H ATOM 11 HN1 MET A 856 0.346 6.466 45.062 1.00 0.00 H ATOM 12 N TYR A 857 -0.947 4.639 48.862 1.00 25.06 N ATOM 13 CA TYR A 857 -1.178 4.525 50.305 1.00 29.40 C ATOM 14 C TYR A 857 0.120 4.105 50.981 1.00 27.96 C ATOM 15 O TYR A 857 0.829 3.258 50.433 1.00 21.93 O ATOM 16 CB TYR A 857 -2.291 3.506 50.607 1.00 26.44 C ATOM 17 CG TYR A 857 -3.717 4.076 50.613 1.00 23.89 C ATOM 18 CD1 TYR A 857 -4.173 4.837 51.693 1.00 32.67 C ATOM 19 CD2 TYR A 857 -4.611 3.809 49.583 1.00 30.89 C ATOM 20 CE1 TYR A 857 -5.471 5.339 51.729 1.00 30.93 C ATOM 21 CE2 TYR A 857 -5.917 4.315 49.612 1.00 31.07 C ATOM 22 CZ TYR A 857 -6.323 5.082 50.695 1.00 31.29 C ATOM 23 OH TYR A 857 -7.596 5.591 50.767 1.00 47.33 O ATOM 24 HH TYR A 857 -7.697 6.107 51.606 1.00 0.00 H ATOM 25 H TYR A 857 -1.347 3.934 48.210 1.00 0.00 H ATOM 26 N VAL A 858 0.414 4.680 52.160 1.00 26.12 N ATOM 27 CA VAL A 858 1.521 4.233 53.029 1.00 24.86 C ATOM 28 C VAL A 858 1.048 3.704 54.392 1.00 27.51 C ATOM 29 O VAL A 858 0.416 4.413 55.169 1.00 22.71 O ATOM 30 CB VAL A 858 2.534 5.375 53.269 1.00 30.38 C ATOM 31 CG1 VAL A 858 3.179 5.742 51.972 1.00 36.70 C ATOM 32 CG2 VAL A 858 1.843 6.611 53.811 1.00 28.50 C ATOM 33 H VAL A 858 -0.168 5.481 52.477 1.00 0.00 H ATOM 34 N ILE A 859 1.350 2.449 54.684 1.00 23.65 N ATOM 35 CA ILE A 859 1.021 1.898 55.985 1.00 17.55 C ATOM 36 C ILE A 859 2.144 2.129 56.965 1.00 26.30 C ATOM 37 O ILE A 859 3.301 1.829 56.681 1.00 25.02 O ATOM 38 CB ILE A 859 0.775 0.400 55.937 1.00 20.88 C ATOM 39 CG1 ILE A 859 -0.464 0.118 55.115 1.00 25.24 C ATOM 40 CG2 ILE A 859 0.653 -0.134 57.356 1.00 25.95 C ATOM 41 CD1 ILE A 859 -0.900 -1.341 55.082 1.00 31.27 C ATOM 42 H ILE A 859 1.826 1.854 53.976 1.00 0.00 H ATOM 43 N ARG A 860 1.784 2.608 58.142 1.00 31.42 N ATOM 44 CA ARG A 860 2.701 2.674 59.264 1.00 27.17 C ATOM 45 C ARG A 860 2.372 1.516 60.207 1.00 31.42 C ATOM 46 O ARG A 860 1.362 1.571 60.921 1.00 28.69 O ATOM 47 CB ARG A 860 2.591 4.030 59.961 1.00 30.52 C ATOM 48 CG ARG A 860 3.628 4.191 61.076 1.00 44.25 C ATOM 49 CD ARG A 860 4.120 5.614 61.193 1.00 53.00 C ATOM 50 NE ARG A 860 4.703 5.843 62.509 1.00 55.44 N ATOM 51 CZ ARG A 860 4.477 6.920 63.257 1.00 60.20 C ATOM 52 NH1 ARG A 860 3.693 7.907 62.820 1.00 62.12 N ATOM 53 NH2 ARG A 860 5.048 7.019 64.447 1.00 64.29 N ATOM 54 HE ARG A 860 5.340 5.114 62.890 1.00 0.00 H ATOM 55 HH12 ARG A 860 3.527 8.742 63.417 1.00 0.00 H ATOM 56 HH11 ARG A 860 3.248 7.841 61.882 1.00 0.00 H ATOM 57 HH22 ARG A 860 4.877 7.857 65.038 1.00 0.00 H ATOM 58 HH21 ARG A 860 5.668 6.258 64.791 1.00 0.00 H ATOM 59 H ARG A 860 0.810 2.949 58.269 1.00 0.00 H ATOM 60 N ASP A 861 3.204 0.468 60.198 1.00 31.12 N ATOM 61 CA ASP A 861 2.904 -0.770 60.926 1.00 36.52 C ATOM 62 C ASP A 861 3.269 -0.708 62.412 1.00 39.26 C ATOM 63 O ASP A 861 3.604 0.358 62.928 1.00 38.28 O ATOM 64 CB ASP A 861 3.616 -1.951 60.267 1.00 40.09 C ATOM 65 CG ASP A 861 5.139 -1.807 60.251 1.00 42.14 C ATOM 66 OD1 ASP A 861 5.728 -1.138 61.132 1.00 33.15 O ATOM 67 OD2 ASP A 861 5.756 -2.387 59.330 1.00 44.35 O ATOM 68 H ASP A 861 4.091 0.533 59.658 1.00 0.00 H ATOM 69 N GLU A 862 3.195 -1.859 63.081 1.00 45.65 N ATOM 70 CA GLU A 862 3.576 -2.005 64.509 1.00 56.84 C ATOM 71 C GLU A 862 4.884 -1.346 64.909 1.00 50.50 C ATOM 72 O GLU A 862 5.000 -0.757 65.994 1.00 47.49 O ATOM 73 CB GLU A 862 3.738 -3.476 64.909 1.00 62.02 C ATOM 74 CG GLU A 862 3.060 -4.499 64.037 1.00 64.71 C ATOM 75 CD GLU A 862 1.598 -4.245 63.900 1.00 68.37 C ATOM 76 OE1 GLU A 862 0.852 -4.297 64.919 1.00 63.20 O ATOM 77 OE2 GLU A 862 1.218 -3.978 62.748 1.00 64.10 O ATOM 78 H GLU A 862 2.852 -2.700 62.575 1.00 0.00 H ATOM 79 N TRP A 863 5.880 -1.509 64.047 1.00 41.58 N ATOM 80 CA TRP A 863 7.251 -1.121 64.339 1.00 41.14 C ATOM 81 C TRP A 863 7.526 0.332 64.042 1.00 36.29 C ATOM 82 O TRP A 863 8.640 0.795 64.221 1.00 31.21 O ATOM 83 CB TRP A 863 8.196 -1.992 63.531 1.00 45.38 C ATOM 84 CG TRP A 863 8.051 -3.422 63.875 1.00 51.44 C ATOM 85 CD1 TRP A 863 7.341 -4.371 63.198 1.00 52.83 C ATOM 86 CD2 TRP A 863 8.629 -4.077 65.001 1.00 50.98 C ATOM 87 NE1 TRP A 863 7.448 -5.586 63.837 1.00 55.48 N ATOM 88 CE2 TRP A 863 8.237 -5.432 64.946 1.00 54.26 C ATOM 89 CE3 TRP A 863 9.442 -3.651 66.048 1.00 53.22 C ATOM 90 CZ2 TRP A 863 8.632 -6.362 65.905 1.00 57.04 C ATOM 91 CZ3 TRP A 863 9.837 -4.573 66.995 1.00 61.76 C ATOM 92 CH2 TRP A 863 9.432 -5.915 66.919 1.00 61.70 C ATOM 93 HE1 TRP A 863 7.003 -6.474 63.529 1.00 0.00 H ATOM 94 H TRP A 863 5.671 -1.933 63.121 1.00 0.00 H ATOM 95 N GLY A 864 6.513 1.045 63.563 1.00 36.82 N ATOM 96 CA GLY A 864 6.702 2.406 63.104 1.00 38.03 C ATOM 97 C GLY A 864 7.373 2.449 61.740 1.00 29.89 C ATOM 98 O GLY A 864 7.805 3.501 61.311 1.00 35.07 O ATOM 99 H GLY A 864 5.566 0.618 63.517 1.00 0.00 H ATOM 100 N ASN A 865 7.472 1.312 61.064 1.00 33.56 N ATOM 101 CA ASN A 865 7.916 1.301 59.655 1.00 29.50 C ATOM 102 C ASN A 865 6.826 1.628 58.651 1.00 32.34 C ATOM 103 O ASN A 865 5.649 1.312 58.857 1.00 27.59 O ATOM 104 CB ASN A 865 8.492 -0.051 59.276 1.00 26.24 C ATOM 105 CG ASN A 865 9.714 -0.398 60.083 1.00 32.98 C ATOM 106 OD1 ASN A 865 10.495 0.468 60.470 1.00 28.05 O ATOM 107 ND2 ASN A 865 9.854 -1.662 60.386 1.00 37.82 N ATOM 108 HD22 ASN A 865 9.167 -2.360 60.035 1.00 0.00 H ATOM 109 HD21 ASN A 865 10.652 -1.970 60.978 1.00 0.00 H ATOM 110 H ASN A 865 7.233 0.415 61.533 1.00 0.00 H ATOM 111 N GLN A 866 7.264 2.188 57.526 1.00 31.18 N ATOM 112 CA GLN A 866 6.384 2.578 56.438 1.00 27.62 C ATOM 113 C GLN A 866 6.408 1.617 55.285 1.00 27.53 C ATOM 114 O GLN A 866 7.446 1.388 54.669 1.00 26.40 O ATOM 115 CB GLN A 866 6.769 3.951 55.933 1.00 27.70 C ATOM 116 CG GLN A 866 6.191 5.022 56.772 1.00 34.10 C ATOM 117 CD GLN A 866 6.694 6.355 56.365 1.00 30.99 C ATOM 118 OE1 GLN A 866 7.371 6.491 55.340 1.00 40.96 O ATOM 119 NE2 GLN A 866 6.395 7.359 57.168 1.00 42.46 N ATOM 120 HE22 GLN A 866 5.821 7.191 58.019 1.00 0.00 H ATOM 121 HE21 GLN A 866 6.733 8.318 56.950 1.00 0.00 H ATOM 122 H GLN A 866 8.285 2.354 57.421 1.00 0.00 H ATOM 123 N ILE A 867 5.238 1.092 54.962 1.00 25.73 N ATOM 124 CA ILE A 867 5.051 0.209 53.823 1.00 23.00 C ATOM 125 C ILE A 867 4.286 0.926 52.707 1.00 28.78 C ATOM 126 O ILE A 867 3.144 1.374 52.925 1.00 20.72 O ATOM 127 CB ILE A 867 4.277 -1.033 54.264 1.00 24.10 C ATOM 128 CG1 ILE A 867 5.048 -1.761 55.371 1.00 39.51 C ATOM 129 CG2 ILE A 867 4.026 -1.941 53.100 1.00 35.16 C ATOM 130 CD1 ILE A 867 4.164 -2.694 56.187 1.00 38.39 C ATOM 131 H ILE A 867 4.412 1.322 55.551 1.00 0.00 H ATOM 132 N TRP A 868 4.885 1.018 51.511 1.00 26.50 N ATOM 133 CA TRP A 868 4.215 1.631 50.381 1.00 22.95 C ATOM 134 C TRP A 868 3.431 0.608 49.601 1.00 27.49 C ATOM 135 O TRP A 868 3.954 -0.455 49.279 1.00 26.21 O ATOM 136 CB TRP A 868 5.206 2.318 49.491 1.00 29.79 C ATOM 137 CG TRP A 868 5.940 3.325 50.247 1.00 25.79 C ATOM 138 CD1 TRP A 868 6.942 3.102 51.143 1.00 29.22 C ATOM 139 CD2 TRP A 868 5.768 4.738 50.176 1.00 26.99 C ATOM 140 NE1 TRP A 868 7.394 4.295 51.649 1.00 31.03 N ATOM 141 CE2 TRP A 868 6.684 5.315 51.073 1.00 29.75 C ATOM 142 CE3 TRP A 868 4.931 5.572 49.439 1.00 25.73 C ATOM 143 CZ2 TRP A 868 6.782 6.681 51.255 1.00 35.16 C ATOM 144 CZ3 TRP A 868 5.017 6.928 49.633 1.00 29.90 C ATOM 145 CH2 TRP A 868 5.934 7.472 50.531 1.00 40.35 C ATOM 146 HE1 TRP A 868 8.151 4.406 52.354 1.00 0.00 H ATOM 147 H TRP A 868 5.848 0.643 51.392 1.00 0.00 H ATOM 148 N ILE A 869 2.173 0.946 49.307 1.00 23.83 N ATOM 149 CA ILE A 869 1.213 0.009 48.735 1.00 26.64 C ATOM 150 C ILE A 869 1.026 0.210 47.230 1.00 21.92 C ATOM 151 O ILE A 869 0.743 1.316 46.777 1.00 17.57 O ATOM 152 CB ILE A 869 -0.191 0.147 49.423 1.00 20.41 C ATOM 153 CG1 ILE A 869 -0.056 0.168 50.965 1.00 25.82 C ATOM 154 CG2 ILE A 869 -1.108 -0.922 48.949 1.00 19.49 C ATOM 155 CD1 ILE A 869 0.440 -1.091 51.526 1.00 27.54 C ATOM 156 H ILE A 869 1.864 1.921 49.494 1.00 0.00 H ATOM 157 N CYS A 870 1.169 -0.876 46.468 1.00 20.05 N ATOM 158 CA CYS A 870 0.730 -0.920 45.072 1.00 17.73 C ATOM 159 C CYS A 870 -0.682 -0.359 44.890 1.00 20.01 C ATOM 160 O CYS A 870 -1.616 -0.869 45.494 1.00 18.74 O ATOM 161 CB CYS A 870 0.784 -2.364 44.578 1.00 17.72 C ATOM 162 SG CYS A 870 0.104 -2.696 43.002 1.00 20.14 S ATOM 163 H CYS A 870 1.609 -1.723 46.881 1.00 0.00 H ATOM 164 N PRO A 871 -0.847 0.705 44.075 1.00 17.02 N ATOM 165 CA PRO A 871 -2.219 1.195 43.856 1.00 21.45 C ATOM 166 C PRO A 871 -3.088 0.240 42.990 1.00 24.18 C ATOM 167 O PRO A 871 -4.294 0.396 42.882 1.00 26.21 O ATOM 168 CB PRO A 871 -2.011 2.531 43.126 1.00 18.79 C ATOM 169 CG PRO A 871 -0.568 2.856 43.237 1.00 20.06 C ATOM 170 CD PRO A 871 0.155 1.555 43.408 1.00 18.52 C ATOM 171 N GLY A 872 -2.472 -0.757 42.384 1.00 20.52 N ATOM 172 CA GLY A 872 -3.217 -1.673 41.545 1.00 25.52 C ATOM 173 C GLY A 872 -4.067 -2.625 42.340 1.00 26.26 C ATOM 174 O GLY A 872 -5.237 -2.849 42.040 1.00 22.37 O ATOM 175 H GLY A 872 -1.448 -0.886 42.509 1.00 0.00 H ATOM 176 N CYS A 873 -3.473 -3.195 43.362 1.00 24.08 N ATOM 177 CA CYS A 873 -4.186 -4.135 44.185 1.00 25.08 C ATOM 178 C CYS A 873 -4.508 -3.551 45.577 1.00 23.93 C ATOM 179 O CYS A 873 -5.470 -3.965 46.230 1.00 22.26 O ATOM 180 CB CYS A 873 -3.347 -5.406 44.282 1.00 24.75 C ATOM 181 SG CYS A 873 -1.790 -5.190 45.156 1.00 23.04 S ATOM 182 H CYS A 873 -2.482 -2.966 43.578 1.00 0.00 H ATOM 183 N ASN A 874 -3.701 -2.581 46.014 1.00 24.90 N ATOM 184 CA ASN A 874 -3.810 -1.995 47.356 1.00 25.12 C ATOM 185 C ASN A 874 -3.759 -3.081 48.422 1.00 26.20 C ATOM 186 O ASN A 874 -4.430 -2.998 49.444 1.00 25.80 O ATOM 187 CB ASN A 874 -5.073 -1.144 47.493 1.00 22.52 C ATOM 188 CG ASN A 874 -4.843 0.297 47.104 1.00 26.37 C ATOM 189 OD1 ASN A 874 -3.972 0.946 47.649 1.00 27.65 O ATOM 190 ND2 ASN A 874 -5.616 0.806 46.148 1.00 26.90 N ATOM 191 HD22 ASN A 874 -6.351 0.218 45.706 1.00 0.00 H ATOM 192 HD21 ASN A 874 -5.485 1.792 45.843 1.00 0.00 H ATOM 193 H ASN A 874 -2.962 -2.224 45.375 1.00 0.00 H ATOM 194 N LYS A 875 -2.961 -4.109 48.156 1.00 22.87 N ATOM 195 CA LYS A 875 -2.658 -5.120 49.144 1.00 30.83 C ATOM 196 C LYS A 875 -1.209 -4.893 49.586 1.00 40.73 C ATOM 197 O LYS A 875 -0.296 -4.740 48.761 1.00 35.23 O ATOM 198 CB LYS A 875 -2.868 -6.536 48.599 1.00 32.89 C ATOM 199 CG LYS A 875 -4.342 -6.911 48.369 1.00 34.49 C ATOM 200 CD LYS A 875 -4.945 -7.756 49.492 1.00 48.30 C ATOM 201 CE LYS A 875 -5.644 -9.004 48.956 1.00 49.63 C ATOM 202 NZ LYS A 875 -6.322 -9.737 50.072 1.00 53.52 N ATOM 203 HZ1 LYS A 875 -5.614 -10.020 50.780 1.00 0.00 H ATOM 204 HZ2 LYS A 875 -7.028 -9.115 50.515 1.00 0.00 H ATOM 205 HZ3 LYS A 875 -6.793 -10.583 49.693 1.00 0.00 H ATOM 206 H LYS A 875 -2.541 -4.189 47.208 1.00 0.00 H ATOM 207 N PRO A 876 -0.995 -4.805 50.897 1.00 33.55 N ATOM 208 CA PRO A 876 0.377 -4.690 51.383 1.00 39.03 C ATOM 209 C PRO A 876 1.219 -5.947 51.240 1.00 51.32 C ATOM 210 O PRO A 876 2.436 -5.841 51.167 1.00 54.74 O ATOM 211 CB PRO A 876 0.186 -4.359 52.863 1.00 38.48 C ATOM 212 CG PRO A 876 -1.189 -4.797 53.181 1.00 37.13 C ATOM 213 CD PRO A 876 -1.975 -4.567 51.964 1.00 35.24 C ATOM 214 N ASP A 877 0.614 -7.121 51.219 1.00 57.62 N ATOM 215 CA ASP A 877 1.433 -8.322 51.261 1.00 68.96 C ATOM 216 C ASP A 877 1.922 -8.705 49.881 1.00 67.31 C ATOM 217 O ASP A 877 1.224 -9.353 49.103 1.00 75.27 O ATOM 218 CB ASP A 877 0.664 -9.460 51.912 1.00 80.85 C ATOM 219 CG ASP A 877 0.593 -9.305 53.413 1.00 83.20 C ATOM 220 OD1 ASP A 877 1.497 -8.654 53.982 1.00 76.56 O ATOM 221 OD2 ASP A 877 -0.365 -9.819 54.022 1.00 92.93 O ATOM 222 H ASP A 877 -0.423 -7.185 51.174 1.00 0.00 H ATOM 223 N ASP A 878 3.144 -8.276 49.592 1.00 64.04 N ATOM 224 CA ASP A 878 3.746 -8.496 48.292 1.00 56.22 C ATOM 225 C ASP A 878 4.467 -9.814 48.239 1.00 56.32 C ATOM 226 O ASP A 878 3.859 -10.866 48.049 1.00 55.55 O ATOM 227 CB ASP A 878 4.739 -7.378 47.952 1.00 55.54 C ATOM 228 CG ASP A 878 4.211 -6.020 48.286 1.00 56.13 C ATOM 229 OD1 ASP A 878 2.980 -5.850 48.198 1.00 65.00 O ATOM 230 OD2 ASP A 878 5.009 -5.115 48.610 1.00 57.57 O ATOM 231 H ASP A 878 3.686 -7.767 50.320 1.00 0.00 H ATOM 232 N GLY A 879 5.772 -9.736 48.473 1.00 57.41 N ATOM 233 CA GLY A 879 6.713 -10.652 47.895 1.00 51.50 C ATOM 234 C GLY A 879 6.964 -10.041 46.544 1.00 51.21 C ATOM 235 O GLY A 879 7.984 -9.397 46.330 1.00 52.92 O ATOM 236 H GLY A 879 6.125 -8.983 49.098 1.00 0.00 H ATOM 237 N SER A 880 5.971 -10.184 45.670 1.00 47.77 N ATOM 238 CA SER A 880 6.055 -9.811 44.268 1.00 44.73 C ATOM 239 C SER A 880 6.851 -8.521 43.945 1.00 40.33 C ATOM 240 O SER A 880 6.658 -7.480 44.575 1.00 38.76 O ATOM 241 CB SER A 880 4.639 -9.670 43.727 1.00 46.15 C ATOM 242 OG SER A 880 4.692 -9.037 42.470 1.00 44.17 O ATOM 243 HG SER A 880 5.104 -8.142 42.570 1.00 0.00 H ATOM 244 H SER A 880 5.076 -10.589 46.013 1.00 0.00 H ATOM 245 N PRO A 881 7.723 -8.586 42.931 1.00 36.73 N ATOM 246 CA PRO A 881 8.546 -7.435 42.572 1.00 26.95 C ATOM 247 C PRO A 881 7.715 -6.264 42.139 1.00 24.79 C ATOM 248 O PRO A 881 6.569 -6.468 41.712 1.00 22.22 O ATOM 249 CB PRO A 881 9.386 -7.955 41.409 1.00 27.64 C ATOM 250 CG PRO A 881 8.570 -9.037 40.834 1.00 34.33 C ATOM 251 CD PRO A 881 7.901 -9.694 41.979 1.00 29.27 C ATOM 252 N MET A 882 8.277 -5.063 42.274 1.00 21.75 N ATOM 253 CA MET A 882 7.613 -3.833 41.844 1.00 21.19 C ATOM 254 C MET A 882 8.369 -3.020 40.807 1.00 21.47 C ATOM 255 O MET A 882 9.577 -3.173 40.637 1.00 19.96 O ATOM 256 CB MET A 882 7.349 -2.956 43.053 1.00 21.52 C ATOM 257 CG MET A 882 6.514 -3.693 44.114 1.00 24.04 C ATOM 258 SD MET A 882 6.229 -2.728 45.601 1.00 29.36 S ATOM 259 CE MET A 882 4.717 -1.873 45.255 1.00 28.70 C ATOM 260 H MET A 882 9.223 -4.998 42.701 1.00 0.00 H ATOM 261 N ILE A 883 7.642 -2.131 40.128 1.00 18.36 N ATOM 262 CA ILE A 883 8.225 -1.289 39.092 1.00 16.12 C ATOM 263 C ILE A 883 7.747 0.123 39.342 1.00 16.46 C ATOM 264 O ILE A 883 6.630 0.315 39.744 1.00 20.31 O ATOM 265 CB ILE A 883 7.855 -1.762 37.680 1.00 22.35 C ATOM 266 CG1 ILE A 883 8.585 -0.918 36.640 1.00 18.89 C ATOM 267 CG2 ILE A 883 6.365 -1.640 37.414 1.00 14.79 C ATOM 268 CD1 ILE A 883 8.573 -1.565 35.324 1.00 24.09 C ATOM 269 H ILE A 883 6.629 -2.036 40.345 1.00 0.00 H ATOM 270 N GLY A 884 8.619 1.110 39.162 1.00 15.63 N ATOM 271 CA GLY A 884 8.278 2.482 39.463 1.00 19.62 C ATOM 272 C GLY A 884 7.968 3.299 38.224 1.00 23.86 C ATOM 273 O GLY A 884 8.668 3.198 37.223 1.00 18.60 O ATOM 274 H GLY A 884 9.568 0.890 38.797 1.00 0.00 H ATOM 275 N CYS A 885 6.911 4.102 38.299 1.00 21.58 N ATOM 276 CA CYS A 885 6.554 5.035 37.232 1.00 22.68 C ATOM 277 C CYS A 885 7.583 6.167 37.089 1.00 23.62 C ATOM 278 O CYS A 885 7.938 6.824 38.061 1.00 22.23 O ATOM 279 CB CYS A 885 5.181 5.650 37.484 1.00 23.21 C ATOM 280 SG CYS A 885 4.646 6.752 36.114 1.00 20.61 S ATOM 281 H CYS A 885 6.315 4.065 39.150 1.00 0.00 H ATOM 282 N ASP A 886 8.041 6.412 35.867 1.00 26.97 N ATOM 283 CA ASP A 886 9.074 7.427 35.638 1.00 33.14 C ATOM 284 C ASP A 886 8.489 8.817 35.464 1.00 33.52 C ATOM 285 O ASP A 886 9.217 9.768 35.232 1.00 35.19 O ATOM 286 CB ASP A 886 9.915 7.043 34.427 1.00 29.17 C ATOM 287 CG ASP A 886 10.805 5.848 34.715 1.00 36.66 C ATOM 288 OD1 ASP A 886 11.471 5.842 35.767 1.00 29.65 O ATOM 289 OD2 ASP A 886 10.798 4.889 33.930 1.00 36.85 O ATOM 290 H ASP A 886 7.661 5.876 35.061 1.00 0.00 H ATOM 291 N ASP A 887 7.171 8.920 35.587 1.00 28.08 N ATOM 292 CA ASP A 887 6.488 10.219 35.652 1.00 34.81 C ATOM 293 C ASP A 887 6.081 10.579 37.098 1.00 29.61 C ATOM 294 O ASP A 887 6.594 11.536 37.669 1.00 35.77 O ATOM 295 CB ASP A 887 5.255 10.205 34.732 1.00 35.19 C ATOM 296 CG ASP A 887 4.574 11.570 34.621 1.00 43.13 C ATOM 297 OD1 ASP A 887 4.948 12.512 35.356 1.00 49.37 O ATOM 298 OD2 ASP A 887 3.641 11.693 33.800 1.00 43.20 O ATOM 299 H ASP A 887 6.602 8.051 35.639 1.00 0.00 H ATOM 300 N CYS A 888 5.172 9.814 37.691 1.00 29.45 N ATOM 301 CA CYS A 888 4.615 10.145 39.016 1.00 25.29 C ATOM 302 C CYS A 888 5.307 9.392 40.162 1.00 31.00 C ATOM 303 O CYS A 888 5.126 9.711 41.335 1.00 28.34 O ATOM 304 CB CYS A 888 3.117 9.844 39.041 1.00 27.65 C ATOM 305 SG CYS A 888 2.751 8.081 39.027 1.00 25.48 S ATOM 306 H CYS A 888 4.843 8.955 37.206 1.00 0.00 H ATOM 307 N ASP A 889 6.083 8.377 39.816 1.00 26.97 N ATOM 308 CA ASP A 889 6.854 7.622 40.781 1.00 27.52 C ATOM 309 C ASP A 889 6.019 6.822 41.772 1.00 30.05 C ATOM 310 O ASP A 889 6.521 6.463 42.850 1.00 31.23 O ATOM 311 CB ASP A 889 7.787 8.559 41.549 1.00 31.65 C ATOM 312 CG ASP A 889 8.989 7.844 42.099 1.00 36.60 C ATOM 313 OD1 ASP A 889 9.295 6.716 41.631 1.00 36.42 O ATOM 314 OD2 ASP A 889 9.642 8.426 42.990 1.00 38.51 O ATOM 315 H ASP A 889 6.141 8.112 38.812 1.00 0.00 H ATOM 316 N ASP A 890 4.765 6.553 41.421 1.00 24.91 N ATOM 317 CA ASP A 890 4.001 5.467 42.043 1.00 21.09 C ATOM 318 C ASP A 890 4.611 4.142 41.620 1.00 19.68 C ATOM 319 O ASP A 890 5.009 3.996 40.466 1.00 25.99 O ATOM 320 CB ASP A 890 2.541 5.487 41.610 1.00 18.75 C ATOM 321 CG ASP A 890 1.720 6.539 42.320 1.00 25.73 C ATOM 322 OD1 ASP A 890 2.237 7.198 43.257 1.00 23.18 O ATOM 323 OD2 ASP A 890 0.531 6.669 41.966 1.00 24.73 O ATOM 324 H ASP A 890 4.313 7.130 40.683 1.00 0.00 H ATOM 325 N TRP A 891 4.686 3.194 42.543 1.00 18.94 N ATOM 326 CA TRP A 891 5.212 1.865 42.290 1.00 17.40 C ATOM 327 C TRP A 891 4.106 0.803 42.301 1.00 20.94 C ATOM 328 O TRP A 891 3.187 0.877 43.118 1.00 16.57 O ATOM 329 CB TRP A 891 6.274 1.515 43.334 1.00 21.06 C ATOM 330 CG TRP A 891 7.536 2.351 43.192 1.00 20.20 C ATOM 331 CD1 TRP A 891 7.649 3.686 43.397 1.00 25.36 C ATOM 332 CD2 TRP A 891 8.848 1.893 42.803 1.00 19.43 C ATOM 333 NE1 TRP A 891 8.966 4.093 43.173 1.00 24.56 N ATOM 334 CE2 TRP A 891 9.703 3.004 42.810 1.00 19.37 C ATOM 335 CE3 TRP A 891 9.379 0.645 42.466 1.00 21.07 C ATOM 336 CZ2 TRP A 891 11.055 2.908 42.479 1.00 24.91 C ATOM 337 CZ3 TRP A 891 10.708 0.562 42.143 1.00 17.47 C ATOM 338 CH2 TRP A 891 11.529 1.687 42.152 1.00 16.49 C ATOM 339 HE1 TRP A 891 9.325 5.064 43.267 1.00 0.00 H ATOM 340 H TRP A 891 4.349 3.415 43.502 1.00 0.00 H ATOM 341 N TYR A 892 4.214 -0.184 41.404 1.00 14.38 N ATOM 342 CA TYR A 892 3.200 -1.236 41.259 1.00 18.78 C ATOM 343 C TYR A 892 3.883 -2.561 41.264 1.00 18.48 C ATOM 344 O TYR A 892 5.015 -2.656 40.818 1.00 23.18 O ATOM 345 CB TYR A 892 2.421 -1.119 39.933 1.00 15.65 C ATOM 346 CG TYR A 892 1.497 0.043 39.796 1.00 17.48 C ATOM 347 CD1 TYR A 892 1.966 1.341 39.680 1.00 21.64 C ATOM 348 CD2 TYR A 892 0.129 -0.167 39.744 1.00 20.45 C ATOM 349 CE1 TYR A 892 1.075 2.423 39.554 1.00 22.00 C ATOM 350 CE2 TYR A 892 -0.753 0.879 39.585 1.00 20.89 C ATOM 351 CZ TYR A 892 -0.291 2.168 39.518 1.00 21.77 C ATOM 352 OH TYR A 892 -1.227 3.177 39.379 1.00 25.50 O ATOM 353 HH TYR A 892 -0.765 4.052 39.343 1.00 0.00 H ATOM 354 H TYR A 892 5.049 -0.207 40.785 1.00 0.00 H ATOM 355 N HIS A 893 3.197 -3.595 41.697 1.00 17.90 N ATOM 356 CA HIS A 893 3.626 -4.957 41.391 1.00 22.15 C ATOM 357 C HIS A 893 3.584 -5.231 39.901 1.00 23.53 C ATOM 358 O HIS A 893 2.613 -4.852 39.225 1.00 17.74 O ATOM 359 CB HIS A 893 2.727 -6.002 42.058 1.00 29.88 C ATOM 360 CG HIS A 893 2.547 -5.816 43.525 1.00 23.66 C ATOM 361 ND1 HIS A 893 1.316 -5.575 44.100 1.00 22.30 N ATOM 362 CD2 HIS A 893 3.435 -5.896 44.545 1.00 29.76 C ATOM 363 CE1 HIS A 893 1.464 -5.488 45.412 1.00 27.05 C ATOM 364 NE2 HIS A 893 2.739 -5.675 45.703 1.00 29.78 N ATOM 365 H HIS A 893 2.339 -3.442 42.264 1.00 0.00 H ATOM 366 N TRP A 894 4.607 -5.933 39.425 1.00 17.44 N ATOM 367 CA TRP A 894 4.693 -6.406 38.060 1.00 23.40 C ATOM 368 C TRP A 894 3.388 -7.002 37.548 1.00 29.04 C ATOM 369 O TRP A 894 2.919 -6.589 36.510 1.00 22.33 O ATOM 370 CB TRP A 894 5.818 -7.426 37.937 1.00 25.76 C ATOM 371 CG TRP A 894 7.173 -6.794 38.070 1.00 28.19 C ATOM 372 CD1 TRP A 894 7.451 -5.569 38.579 1.00 21.40 C ATOM 373 CD2 TRP A 894 8.431 -7.360 37.672 1.00 29.35 C ATOM 374 NE1 TRP A 894 8.810 -5.325 38.518 1.00 24.58 N ATOM 375 CE2 TRP A 894 9.430 -6.416 37.977 1.00 23.58 C ATOM 376 CE3 TRP A 894 8.806 -8.575 37.094 1.00 32.06 C ATOM 377 CZ2 TRP A 894 10.781 -6.645 37.720 1.00 29.03 C ATOM 378 CZ3 TRP A 894 10.153 -8.803 36.849 1.00 34.51 C ATOM 379 CH2 TRP A 894 11.116 -7.840 37.151 1.00 31.16 C ATOM 380 HE1 TRP A 894 9.283 -4.454 38.832 1.00 0.00 H ATOM 381 H TRP A 894 5.391 -6.155 40.071 1.00 0.00 H ATOM 382 N PRO A 895 2.799 -7.968 38.273 1.00 24.32 N ATOM 383 CA PRO A 895 1.597 -8.586 37.712 1.00 28.37 C ATOM 384 C PRO A 895 0.401 -7.653 37.733 1.00 31.75 C ATOM 385 O PRO A 895 -0.509 -7.810 36.927 1.00 35.82 O ATOM 386 CB PRO A 895 1.370 -9.798 38.615 1.00 22.02 C ATOM 387 CG PRO A 895 2.147 -9.539 39.826 1.00 34.98 C ATOM 388 CD PRO A 895 3.326 -8.750 39.392 1.00 26.92 C ATOM 389 N CYS A 896 0.406 -6.674 38.624 1.00 27.23 N ATOM 390 CA CYS A 896 -0.695 -5.731 38.664 1.00 33.49 C ATOM 391 C CYS A 896 -0.663 -4.824 37.462 1.00 29.41 C ATOM 392 O CYS A 896 -1.660 -4.193 37.167 1.00 20.86 O ATOM 393 CB CYS A 896 -0.685 -4.915 39.968 1.00 24.89 C ATOM 394 SG CYS A 896 -0.945 -5.978 41.392 1.00 25.76 S ATOM 395 H CYS A 896 1.197 -6.581 39.293 1.00 0.00 H ATOM 396 N VAL A 897 0.456 -4.762 36.745 1.00 25.47 N ATOM 397 CA VAL A 897 0.489 -3.928 35.545 1.00 26.80 C ATOM 398 C VAL A 897 0.842 -4.733 34.288 1.00 27.76 C ATOM 399 O VAL A 897 1.146 -4.145 33.264 1.00 30.44 O ATOM 400 CB VAL A 897 1.481 -2.726 35.697 1.00 27.97 C ATOM 401 CG1 VAL A 897 0.930 -1.691 36.644 1.00 25.65 C ATOM 402 CG2 VAL A 897 2.874 -3.186 36.147 1.00 21.18 C ATOM 403 H VAL A 897 1.297 -5.300 37.035 1.00 0.00 H ATOM 404 N GLY A 898 0.782 -6.059 34.352 1.00 26.96 N ATOM 405 CA GLY A 898 0.991 -6.874 33.162 1.00 29.82 C ATOM 406 C GLY A 898 2.451 -7.089 32.780 1.00 35.06 C ATOM 407 O GLY A 898 2.767 -7.441 31.636 1.00 31.65 O ATOM 408 H GLY A 898 0.583 -6.521 35.262 1.00 0.00 H ATOM 409 N ILE A 899 3.353 -6.861 33.730 1.00 29.10 N ATOM 410 CA ILE A 899 4.776 -7.078 33.489 1.00 31.00 C ATOM 411 C ILE A 899 5.148 -8.441 34.007 1.00 32.09 C ATOM 412 O ILE A 899 4.853 -8.783 35.145 1.00 31.86 O ATOM 413 CB ILE A 899 5.626 -5.963 34.118 1.00 22.62 C ATOM 414 CG1 ILE A 899 5.563 -4.787 33.154 1.00 35.38 C ATOM 415 CG2 ILE A 899 7.066 -6.373 34.292 1.00 22.06 C ATOM 416 CD1 ILE A 899 5.950 -3.487 33.731 1.00 35.53 C ATOM 417 H ILE A 899 3.039 -6.522 34.662 1.00 0.00 H ATOM 418 N MET A 900 5.781 -9.203 33.123 1.00 31.93 N ATOM 419 CA MET A 900 6.173 -10.592 33.353 1.00 42.09 C ATOM 420 C MET A 900 7.690 -10.745 33.484 1.00 41.13 C ATOM 421 O MET A 900 8.161 -11.604 34.213 1.00 45.36 O ATOM 422 CB MET A 900 5.692 -11.475 32.191 1.00 46.89 C ATOM 423 CG MET A 900 4.189 -11.466 31.931 1.00 48.91 C ATOM 424 SD MET A 900 3.188 -12.397 33.125 1.00 74.68 S ATOM 425 CE MET A 900 2.213 -11.100 33.898 1.00 51.38 C ATOM 426 H MET A 900 6.014 -8.781 32.201 1.00 0.00 H ATOM 427 N THR A 901 8.453 -9.931 32.758 1.00 37.70 N ATOM 428 CA THR A 901 9.930 -9.987 32.828 1.00 40.94 C ATOM 429 C THR A 901 10.579 -8.628 33.126 1.00 36.63 C ATOM 430 O THR A 901 10.055 -7.572 32.748 1.00 35.74 O ATOM 431 CB THR A 901 10.537 -10.543 31.508 1.00 43.53 C ATOM 432 OG1 THR A 901 10.454 -9.562 30.460 1.00 47.67 O ATOM 433 CG2 THR A 901 9.799 -11.782 31.070 1.00 42.05 C ATOM 434 HG1 THR A 901 10.955 -8.752 30.728 1.00 0.00 H ATOM 435 H THR A 901 8.000 -9.239 32.127 1.00 0.00 H ATOM 436 N ALA A 902 11.732 -8.667 33.791 1.00 37.62 N ATOM 437 CA ALA A 902 12.469 -7.458 34.093 1.00 33.70 C ATOM 438 C ALA A 902 12.645 -6.687 32.801 1.00 36.94 C ATOM 439 O ALA A 902 13.030 -7.263 31.792 1.00 36.59 O ATOM 440 CB ALA A 902 13.821 -7.777 34.728 1.00 43.30 C ATOM 441 H ALA A 902 12.111 -9.585 34.100 1.00 0.00 H ATOM 442 N PRO A 903 12.301 -5.396 32.802 1.00 33.72 N ATOM 443 CA PRO A 903 12.478 -4.675 31.542 1.00 32.65 C ATOM 444 C PRO A 903 13.945 -4.305 31.376 1.00 34.63 C ATOM 445 O PRO A 903 14.657 -4.268 32.375 1.00 33.39 O ATOM 446 CB PRO A 903 11.599 -3.432 31.711 1.00 36.12 C ATOM 447 CG PRO A 903 10.862 -3.611 33.022 1.00 31.04 C ATOM 448 CD PRO A 903 11.671 -4.555 33.829 1.00 29.72 C ATOM 449 N PRO A 904 14.407 -4.088 30.142 1.00 31.96 N ATOM 450 CA PRO A 904 15.746 -3.514 29.961 1.00 35.57 C ATOM 451 C PRO A 904 15.903 -2.173 30.704 1.00 38.08 C ATOM 452 O PRO A 904 14.945 -1.415 30.839 1.00 29.39 O ATOM 453 CB PRO A 904 15.841 -3.340 28.446 1.00 38.72 C ATOM 454 CG PRO A 904 14.907 -4.408 27.897 1.00 35.85 C ATOM 455 CD PRO A 904 13.782 -4.484 28.864 1.00 36.61 C ATOM 456 N GLU A 905 17.108 -1.901 31.192 1.00 34.75 N ATOM 457 CA GLU A 905 17.333 -0.786 32.095 1.00 38.68 C ATOM 458 C GLU A 905 17.227 0.556 31.361 1.00 37.93 C ATOM 459 O GLU A 905 16.854 1.561 31.962 1.00 41.43 O ATOM 460 CB GLU A 905 18.714 -0.913 32.787 1.00 46.95 C ATOM 461 CG GLU A 905 19.097 -2.339 33.244 1.00 44.44 C ATOM 462 CD GLU A 905 19.762 -3.162 32.150 1.00 54.76 C ATOM 463 OE1 GLU A 905 20.965 -2.937 31.895 1.00 63.32 O ATOM 464 OE2 GLU A 905 19.089 -4.031 31.539 1.00 52.78 O ATOM 465 H GLU A 905 17.912 -2.502 30.920 1.00 0.00 H ATOM 466 N GLU A 906 17.562 0.579 30.072 1.00 39.54 N ATOM 467 CA GLU A 906 17.424 1.784 29.236 1.00 36.69 C ATOM 468 C GLU A 906 15.963 2.166 29.094 1.00 38.22 C ATOM 469 O GLU A 906 15.629 3.290 28.713 1.00 36.23 O ATOM 470 CB GLU A 906 18.025 1.592 27.822 1.00 40.81 C ATOM 471 CG GLU A 906 17.919 0.182 27.251 1.00 41.09 C ATOM 472 CD GLU A 906 18.943 -0.755 27.859 1.00 44.61 C ATOM 473 OE1 GLU A 906 20.128 -0.365 27.960 1.00 58.01 O ATOM 474 OE2 GLU A 906 18.558 -1.865 28.282 1.00 46.21 O ATOM 475 H GLU A 906 17.936 -0.289 29.638 1.00 0.00 H ATOM 476 N MET A 907 15.080 1.220 29.370 1.00 35.80 N ATOM 477 CA MET A 907 13.670 1.470 29.159 1.00 36.21 C ATOM 478 C MET A 907 13.094 2.247 30.323 1.00 34.27 C ATOM 479 O MET A 907 13.626 2.220 31.411 1.00 41.58 O ATOM 480 CB MET A 907 12.917 0.170 28.958 1.00 31.71 C ATOM 481 CG MET A 907 12.717 -0.126 27.506 1.00 45.02 C ATOM 482 SD MET A 907 11.824 -1.635 27.272 1.00 52.19 S ATOM 483 CE MET A 907 12.768 -2.281 25.920 1.00 39.63 C ATOM 484 H MET A 907 15.398 0.300 29.737 1.00 0.00 H ATOM 485 N GLN A 908 12.030 2.976 30.051 1.00 38.31 N ATOM 486 CA GLN A 908 11.315 3.718 31.062 1.00 41.70 C ATOM 487 C GLN A 908 9.900 3.185 31.084 1.00 39.76 C ATOM 488 O GLN A 908 9.338 2.954 30.031 1.00 36.76 O ATOM 489 CB GLN A 908 11.327 5.194 30.740 1.00 39.67 C ATOM 490 CG GLN A 908 12.631 5.885 31.034 1.00 46.14 C ATOM 491 CD GLN A 908 12.492 7.372 30.862 1.00 51.11 C ATOM 492 OE1 GLN A 908 11.693 7.838 30.050 1.00 52.16 O ATOM 493 NE2 GLN A 908 13.251 8.130 31.635 1.00 59.64 N ATOM 494 HE22 GLN A 908 13.912 7.690 32.307 1.00 0.00 H ATOM 495 HE21 GLN A 908 13.187 9.166 31.571 1.00 0.00 H ATOM 496 H GLN A 908 11.692 3.018 29.068 1.00 0.00 H ATOM 497 N TRP A 909 9.339 2.961 32.267 1.00 38.85 N ATOM 498 CA TRP A 909 7.959 2.502 32.392 1.00 32.08 C ATOM 499 C TRP A 909 7.046 3.586 32.970 1.00 32.43 C ATOM 500 O TRP A 909 7.527 4.445 33.711 1.00 30.89 O ATOM 501 CB TRP A 909 7.917 1.271 33.258 1.00 31.17 C ATOM 502 CG TRP A 909 6.530 0.770 33.443 1.00 33.03 C ATOM 503 CD1 TRP A 909 5.787 0.029 32.561 1.00 26.86 C ATOM 504 CD2 TRP A 909 5.712 0.983 34.586 1.00 27.95 C ATOM 505 NE1 TRP A 909 4.549 -0.237 33.101 1.00 31.93 N ATOM 506 CE2 TRP A 909 4.485 0.332 34.348 1.00 29.34 C ATOM 507 CE3 TRP A 909 5.911 1.644 35.813 1.00 29.43 C ATOM 508 CZ2 TRP A 909 3.457 0.334 35.276 1.00 30.89 C ATOM 509 CZ3 TRP A 909 4.893 1.648 36.730 1.00 25.39 C ATOM 510 CH2 TRP A 909 3.683 0.988 36.465 1.00 24.96 C ATOM 511 HE1 TRP A 909 3.790 -0.778 32.641 1.00 0.00 H ATOM 512 H TRP A 909 9.899 3.117 33.129 1.00 0.00 H ATOM 513 N PHE A 910 5.742 3.543 32.656 1.00 38.08 N ATOM 514 CA PHE A 910 4.853 4.686 32.965 1.00 39.55 C ATOM 515 C PHE A 910 3.500 4.532 33.711 1.00 38.14 C ATOM 516 O PHE A 910 2.958 5.538 34.159 1.00 48.98 O ATOM 517 CB PHE A 910 4.595 5.432 31.657 1.00 39.15 C ATOM 518 CG PHE A 910 5.701 6.373 31.324 1.00 39.26 C ATOM 519 CD1 PHE A 910 5.817 7.570 32.003 1.00 42.62 C ATOM 520 CD2 PHE A 910 6.670 6.033 30.409 1.00 45.16 C ATOM 521 CE1 PHE A 910 6.863 8.436 31.752 1.00 47.48 C ATOM 522 CE2 PHE A 910 7.721 6.888 30.152 1.00 50.20 C ATOM 523 CZ PHE A 910 7.818 8.093 30.825 1.00 50.34 C ATOM 524 H PHE A 910 5.352 2.698 32.191 1.00 0.00 H ATOM 525 N CYS A 911 2.954 3.351 33.923 1.00 40.51 N ATOM 526 CA CYS A 911 1.732 3.255 34.754 1.00 31.99 C ATOM 527 C CYS A 911 0.497 3.811 34.012 1.00 29.14 C ATOM 528 O CYS A 911 0.586 4.796 33.285 1.00 31.52 O ATOM 529 CB CYS A 911 1.900 3.975 36.120 1.00 33.17 C ATOM 530 SG CYS A 911 0.952 5.532 36.488 1.00 29.33 S ATOM 531 H CYS A 911 3.377 2.495 33.511 1.00 0.00 H ATOM 532 N PRO A 912 -0.659 3.165 34.183 1.00 27.84 N ATOM 533 CA PRO A 912 -1.873 3.535 33.441 1.00 34.74 C ATOM 534 C PRO A 912 -2.165 5.031 33.418 1.00 34.89 C ATOM 535 O PRO A 912 -2.399 5.595 32.350 1.00 36.23 O ATOM 536 CB PRO A 912 -2.969 2.780 34.189 1.00 35.66 C ATOM 537 CG PRO A 912 -2.287 1.554 34.644 1.00 36.18 C ATOM 538 CD PRO A 912 -0.904 2.013 35.061 1.00 34.56 C ATOM 539 N LYS A 913 -2.103 5.674 34.572 1.00 33.52 N ATOM 540 CA LYS A 913 -2.417 7.097 34.661 1.00 37.54 C ATOM 541 C LYS A 913 -1.493 7.990 33.813 1.00 40.56 C ATOM 542 O LYS A 913 -1.988 8.919 33.183 1.00 44.32 O ATOM 543 CB LYS A 913 -2.410 7.539 36.133 1.00 40.96 C ATOM 544 CG LYS A 913 -3.438 6.756 36.957 1.00 50.05 C ATOM 545 CD LYS A 913 -3.303 6.994 38.445 1.00 53.65 C ATOM 546 CE LYS A 913 -4.293 6.148 39.253 1.00 50.33 C ATOM 547 NZ LYS A 913 -3.620 5.511 40.450 1.00 55.96 N ATOM 548 HZ1 LYS A 913 -2.846 4.897 40.125 1.00 0.00 H ATOM 549 HZ2 LYS A 913 -3.237 6.255 41.068 1.00 0.00 H ATOM 550 HZ3 LYS A 913 -4.316 4.945 40.977 1.00 0.00 H ATOM 551 H LYS A 913 -1.826 5.157 35.431 1.00 0.00 H ATOM 552 N CYS A 914 -0.190 7.712 33.728 1.00 36.77 N ATOM 553 CA CYS A 914 0.718 8.679 33.086 1.00 32.86 C ATOM 554 C CYS A 914 1.025 8.417 31.595 1.00 36.61 C ATOM 555 O CYS A 914 1.053 7.276 31.118 1.00 43.57 O ATOM 556 CB CYS A 914 2.040 8.760 33.881 1.00 42.92 C ATOM 557 SG CYS A 914 1.831 9.295 35.612 1.00 32.59 S ATOM 558 H CYS A 914 0.181 6.820 34.112 1.00 0.00 H TER 559 CYS A 914 ATOM 560 N MET E 856 -15.121 -6.010 53.777 1.00 21.96 N ATOM 561 CA MET E 856 -14.881 -4.853 52.908 1.00 26.87 C ATOM 562 C MET E 856 -15.296 -5.030 51.427 1.00 28.90 C ATOM 563 O MET E 856 -14.925 -5.996 50.752 1.00 25.12 O ATOM 564 CB MET E 856 -13.406 -4.487 52.928 1.00 25.76 C ATOM 565 CG MET E 856 -12.938 -3.782 54.184 1.00 22.55 C ATOM 566 SD MET E 856 -11.196 -3.359 54.094 1.00 24.37 S ATOM 567 CE MET E 856 -11.245 -1.599 53.810 1.00 18.77 C ATOM 568 HN3 MET E 856 -14.587 -6.828 53.419 1.00 0.00 H ATOM 569 HN2 MET E 856 -16.137 -6.233 53.782 1.00 0.00 H ATOM 570 HN1 MET E 856 -14.809 -5.787 54.744 1.00 0.00 H ATOM 571 N TYR E 857 -15.979 -4.017 50.920 1.00 23.39 N ATOM 572 CA TYR E 857 -16.252 -3.902 49.502 1.00 23.64 C ATOM 573 C TYR E 857 -14.966 -3.500 48.824 1.00 26.07 C ATOM 574 O TYR E 857 -14.224 -2.722 49.396 1.00 22.83 O ATOM 575 CB TYR E 857 -17.337 -2.856 49.234 1.00 24.80 C ATOM 576 CG TYR E 857 -18.788 -3.362 49.200 1.00 23.27 C ATOM 577 CD1 TYR E 857 -19.295 -3.969 48.070 1.00 27.10 C ATOM 578 CD2 TYR E 857 -19.645 -3.191 50.295 1.00 29.07 C ATOM 579 CE1 TYR E 857 -20.625 -4.424 48.022 1.00 30.62 C ATOM 580 CE2 TYR E 857 -20.971 -3.644 50.265 1.00 26.19 C ATOM 581 CZ TYR E 857 -21.449 -4.251 49.113 1.00 34.62 C ATOM 582 OH TYR E 857 -22.740 -4.708 49.030 1.00 38.93 O ATOM 583 HH TYR E 857 -22.891 -5.107 48.136 1.00 0.00 H ATOM 584 H TYR E 857 -16.332 -3.278 51.561 1.00 0.00 H ATOM 585 N VAL E 858 -14.711 -4.036 47.624 1.00 23.32 N ATOM 586 CA VAL E 858 -13.620 -3.599 46.771 1.00 21.44 C ATOM 587 C VAL E 858 -14.148 -3.034 45.455 1.00 20.93 C ATOM 588 O VAL E 858 -14.876 -3.700 44.757 1.00 18.62 O ATOM 589 CB VAL E 858 -12.648 -4.763 46.432 1.00 29.18 C ATOM 590 CG1 VAL E 858 -11.916 -5.221 47.652 1.00 39.91 C ATOM 591 CG2 VAL E 858 -13.411 -5.957 45.821 1.00 31.83 C ATOM 592 H VAL E 858 -15.325 -4.804 47.286 1.00 0.00 H ATOM 593 N ILE E 859 -13.789 -1.805 45.132 1.00 20.23 N ATOM 594 CA ILE E 859 -14.153 -1.205 43.858 1.00 19.69 C ATOM 595 C ILE E 859 -13.046 -1.434 42.827 1.00 26.15 C ATOM 596 O ILE E 859 -11.849 -1.282 43.112 1.00 19.86 O ATOM 597 CB ILE E 859 -14.385 0.307 43.954 1.00 19.79 C ATOM 598 CG1 ILE E 859 -15.660 0.594 44.703 1.00 27.62 C ATOM 599 CG2 ILE E 859 -14.518 0.888 42.579 1.00 24.71 C ATOM 600 CD1 ILE E 859 -15.977 2.061 44.863 1.00 25.40 C ATOM 601 H ILE E 859 -13.229 -1.249 45.809 1.00 0.00 H ATOM 602 N ARG E 860 -13.472 -1.767 41.616 1.00 23.79 N ATOM 603 CA ARG E 860 -12.586 -1.843 40.481 1.00 25.83 C ATOM 604 C ARG E 860 -12.882 -0.641 39.616 1.00 28.18 C ATOM 605 O ARG E 860 -13.971 -0.538 39.042 1.00 26.61 O ATOM 606 CB ARG E 860 -12.785 -3.161 39.739 1.00 34.99 C ATOM 607 CG ARG E 860 -11.782 -3.407 38.632 1.00 37.26 C ATOM 608 CD ARG E 860 -11.828 -4.848 38.180 1.00 45.96 C ATOM 609 NE ARG E 860 -10.927 -5.073 37.059 1.00 54.70 N ATOM 610 CZ ARG E 860 -9.612 -5.215 37.187 1.00 59.10 C ATOM 611 NH1 ARG E 860 -9.047 -5.141 38.394 1.00 51.67 N ATOM 612 NH2 ARG E 860 -8.863 -5.416 36.106 1.00 61.98 N ATOM 613 HE ARG E 860 -11.336 -5.126 36.104 1.00 0.00 H ATOM 614 HH12 ARG E 860 -8.018 -5.252 38.494 1.00 0.00 H ATOM 615 HH11 ARG E 860 -9.636 -4.972 39.234 1.00 0.00 H ATOM 616 HH22 ARG E 860 -7.833 -5.528 36.200 1.00 0.00 H ATOM 617 HH21 ARG E 860 -9.307 -5.461 35.167 1.00 0.00 H ATOM 618 H ARG E 860 -14.481 -1.981 41.480 1.00 0.00 H ATOM 619 N ASP E 861 -11.933 0.292 39.541 1.00 24.23 N ATOM 620 CA ASP E 861 -12.192 1.544 38.838 1.00 30.25 C ATOM 621 C ASP E 861 -11.841 1.464 37.358 1.00 28.53 C ATOM 622 O ASP E 861 -11.550 0.409 36.830 1.00 28.59 O ATOM 623 CB ASP E 861 -11.469 2.716 39.530 1.00 35.31 C ATOM 624 CG ASP E 861 -9.936 2.647 39.471 1.00 35.67 C ATOM 625 OD1 ASP E 861 -9.343 1.786 38.787 1.00 33.31 O ATOM 626 OD2 ASP E 861 -9.326 3.519 40.131 1.00 33.79 O ATOM 627 H ASP E 861 -11.007 0.127 39.984 1.00 0.00 H ATOM 628 N GLU E 862 -11.903 2.604 36.697 1.00 35.70 N ATOM 629 CA GLU E 862 -11.726 2.704 35.252 1.00 41.51 C ATOM 630 C GLU E 862 -10.326 2.292 34.781 1.00 40.94 C ATOM 631 O GLU E 862 -10.155 1.919 33.626 1.00 37.74 O ATOM 632 CB GLU E 862 -11.988 4.139 34.776 1.00 42.71 C ATOM 633 CG GLU E 862 -13.105 4.877 35.512 1.00 49.22 C ATOM 634 CD GLU E 862 -12.633 5.530 36.805 1.00 46.55 C ATOM 635 OE1 GLU E 862 -11.935 6.564 36.751 1.00 58.83 O ATOM 636 OE2 GLU E 862 -12.960 4.997 37.874 1.00 40.92 O ATOM 637 H GLU E 862 -12.087 3.476 37.233 1.00 0.00 H ATOM 638 N TRP E 863 -9.346 2.362 35.675 1.00 37.43 N ATOM 639 CA TRP E 863 -7.967 2.018 35.337 1.00 37.53 C ATOM 640 C TRP E 863 -7.641 0.576 35.618 1.00 33.39 C ATOM 641 O TRP E 863 -6.511 0.162 35.414 1.00 36.69 O ATOM 642 CB TRP E 863 -7.005 2.901 36.111 1.00 34.56 C ATOM 643 CG TRP E 863 -7.191 4.312 35.778 1.00 43.26 C ATOM 644 CD1 TRP E 863 -7.226 4.856 34.526 1.00 54.53 C ATOM 645 CD2 TRP E 863 -7.373 5.387 36.689 1.00 50.94 C ATOM 646 NE1 TRP E 863 -7.426 6.213 34.603 1.00 55.97 N ATOM 647 CE2 TRP E 863 -7.523 6.565 35.922 1.00 55.87 C ATOM 648 CE3 TRP E 863 -7.424 5.476 38.081 1.00 54.36 C ATOM 649 CZ2 TRP E 863 -7.718 7.816 36.502 1.00 60.31 C ATOM 650 CZ3 TRP E 863 -7.622 6.726 38.659 1.00 63.20 C ATOM 651 CH2 TRP E 863 -7.766 7.879 37.866 1.00 61.58 C ATOM 652 HE1 TRP E 863 -7.493 6.864 33.794 1.00 0.00 H ATOM 653 H TRP E 863 -9.567 2.671 36.643 1.00 0.00 H ATOM 654 N GLY E 864 -8.623 -0.183 36.100 1.00 31.75 N ATOM 655 CA GLY E 864 -8.394 -1.555 36.504 1.00 30.42 C ATOM 656 C GLY E 864 -7.746 -1.662 37.878 1.00 32.32 C ATOM 657 O GLY E 864 -7.283 -2.727 38.245 1.00 35.50 O ATOM 658 H GLY E 864 -9.578 0.219 36.189 1.00 0.00 H ATOM 659 N ASN E 865 -7.705 -0.567 38.631 1.00 29.67 N ATOM 660 CA ASN E 865 -7.221 -0.596 40.007 1.00 28.85 C ATOM 661 C ASN E 865 -8.306 -0.892 41.044 1.00 32.61 C ATOM 662 O ASN E 865 -9.469 -0.522 40.880 1.00 28.89 O ATOM 663 CB ASN E 865 -6.586 0.726 40.385 1.00 25.95 C ATOM 664 CG ASN E 865 -5.301 0.974 39.658 1.00 31.94 C ATOM 665 OD1 ASN E 865 -4.664 0.046 39.152 1.00 29.67 O ATOM 666 ND2 ASN E 865 -4.905 2.233 39.595 1.00 29.84 N ATOM 667 HD22 ASN E 865 -5.477 2.981 40.037 1.00 0.00 H ATOM 668 HD21 ASN E 865 -4.022 2.476 39.103 1.00 0.00 H ATOM 669 H ASN E 865 -8.027 0.336 38.228 1.00 0.00 H ATOM 670 N GLN E 866 -7.882 -1.503 42.144 1.00 28.21 N ATOM 671 CA GLN E 866 -8.778 -1.925 43.209 1.00 30.05 C ATOM 672 C GLN E 866 -8.758 -1.007 44.396 1.00 30.59 C ATOM 673 O GLN E 866 -7.710 -0.789 44.998 1.00 25.83 O ATOM 674 CB GLN E 866 -8.398 -3.297 43.680 1.00 33.33 C ATOM 675 CG GLN E 866 -8.847 -4.385 42.792 1.00 33.94 C ATOM 676 CD GLN E 866 -8.424 -5.688 43.367 1.00 34.85 C ATOM 677 OE1 GLN E 866 -7.783 -5.726 44.425 1.00 36.73 O ATOM 678 NE2 GLN E 866 -8.765 -6.770 42.696 1.00 40.80 N ATOM 679 HE22 GLN E 866 -9.304 -6.685 41.811 1.00 0.00 H ATOM 680 HE21 GLN E 866 -8.495 -7.709 43.052 1.00 0.00 H ATOM 681 H GLN E 866 -6.864 -1.688 42.249 1.00 0.00 H ATOM 682 N ILE E 867 -9.923 -0.507 44.755 1.00 24.04 N ATOM 683 CA ILE E 867 -10.055 0.387 45.903 1.00 28.22 C ATOM 684 C ILE E 867 -10.781 -0.343 47.037 1.00 30.52 C ATOM 685 O ILE E 867 -11.860 -0.895 46.817 1.00 20.69 O ATOM 686 CB ILE E 867 -10.816 1.675 45.482 1.00 29.81 C ATOM 687 CG1 ILE E 867 -10.062 2.358 44.333 1.00 38.09 C ATOM 688 CG2 ILE E 867 -11.025 2.625 46.666 1.00 33.21 C ATOM 689 CD1 ILE E 867 -10.882 3.447 43.603 1.00 45.74 C ATOM 690 H ILE E 867 -10.771 -0.755 44.207 1.00 0.00 H ATOM 691 N TRP E 868 -10.181 -0.376 48.236 1.00 29.11 N ATOM 692 CA TRP E 868 -10.808 -1.041 49.371 1.00 26.73 C ATOM 693 C TRP E 868 -11.573 -0.047 50.169 1.00 26.61 C ATOM 694 O TRP E 868 -11.012 0.938 50.641 1.00 29.77 O ATOM 695 CB TRP E 868 -9.770 -1.721 50.264 1.00 30.27 C ATOM 696 CG TRP E 868 -9.043 -2.769 49.528 1.00 31.99 C ATOM 697 CD1 TRP E 868 -8.067 -2.580 48.594 1.00 33.30 C ATOM 698 CD2 TRP E 868 -9.235 -4.173 49.632 1.00 28.84 C ATOM 699 NE1 TRP E 868 -7.643 -3.784 48.108 1.00 35.59 N ATOM 700 CE2 TRP E 868 -8.349 -4.781 48.724 1.00 37.58 C ATOM 701 CE3 TRP E 868 -10.085 -4.981 50.389 1.00 32.53 C ATOM 702 CZ2 TRP E 868 -8.281 -6.154 48.565 1.00 35.58 C ATOM 703 CZ3 TRP E 868 -10.012 -6.324 50.240 1.00 34.87 C ATOM 704 CH2 TRP E 868 -9.119 -6.909 49.327 1.00 45.45 C ATOM 705 HE1 TRP E 868 -6.905 -3.920 47.388 1.00 0.00 H ATOM 706 H TRP E 868 -9.254 0.080 48.358 1.00 0.00 H ATOM 707 N ILE E 869 -12.845 -0.340 50.394 1.00 25.37 N ATOM 708 CA ILE E 869 -13.746 0.634 50.994 1.00 26.47 C ATOM 709 C ILE E 869 -14.024 0.442 52.475 1.00 15.84 C ATOM 710 O ILE E 869 -14.428 -0.644 52.903 1.00 22.44 O ATOM 711 CB ILE E 869 -15.139 0.618 50.276 1.00 24.27 C ATOM 712 CG1 ILE E 869 -14.959 0.764 48.771 1.00 27.91 C ATOM 713 CG2 ILE E 869 -16.030 1.691 50.833 1.00 21.50 C ATOM 714 CD1 ILE E 869 -14.409 2.096 48.345 1.00 35.46 C ATOM 715 H ILE E 869 -13.206 -1.281 50.138 1.00 0.00 H ATOM 716 N CYS E 870 -13.937 1.536 53.227 1.00 18.07 N ATOM 717 CA CYS E 870 -14.401 1.595 54.618 1.00 19.67 C ATOM 718 C CYS E 870 -15.817 1.000 54.847 1.00 21.18 C ATOM 719 O CYS E 870 -16.808 1.422 54.245 1.00 18.20 O ATOM 720 CB CYS E 870 -14.350 3.053 55.099 1.00 19.65 C ATOM 721 SG CYS E 870 -14.968 3.426 56.760 1.00 18.48 S ATOM 722 H CYS E 870 -13.520 2.392 52.808 1.00 0.00 H ATOM 723 N PRO E 871 -15.919 0.002 55.731 1.00 20.38 N ATOM 724 CA PRO E 871 -17.252 -0.532 56.020 1.00 23.06 C ATOM 725 C PRO E 871 -18.122 0.413 56.858 1.00 25.70 C ATOM 726 O PRO E 871 -19.347 0.270 56.894 1.00 25.96 O ATOM 727 CB PRO E 871 -16.970 -1.817 56.797 1.00 22.58 C ATOM 728 CG PRO E 871 -15.536 -2.099 56.601 1.00 22.06 C ATOM 729 CD PRO E 871 -14.865 -0.790 56.377 1.00 18.66 C ATOM 730 N GLY E 872 -17.511 1.408 57.478 1.00 19.76 N ATOM 731 CA GLY E 872 -18.262 2.374 58.248 1.00 19.54 C ATOM 732 C GLY E 872 -19.108 3.315 57.439 1.00 24.22 C ATOM 733 O GLY E 872 -20.269 3.570 57.769 1.00 21.76 O ATOM 734 H GLY E 872 -16.477 1.497 57.411 1.00 0.00 H ATOM 735 N CYS E 873 -18.530 3.868 56.386 1.00 19.97 N ATOM 736 CA CYS E 873 -19.290 4.774 55.546 1.00 23.14 C ATOM 737 C CYS E 873 -19.585 4.143 54.191 1.00 24.70 C ATOM 738 O CYS E 873 -20.573 4.483 53.554 1.00 24.89 O ATOM 739 CB CYS E 873 -18.540 6.091 55.400 1.00 23.75 C ATOM 740 SG CYS E 873 -16.950 5.957 54.567 1.00 24.31 S ATOM 741 H CYS E 873 -17.537 3.655 56.162 1.00 0.00 H ATOM 742 N ASN E 874 -18.768 3.173 53.780 1.00 25.48 N ATOM 743 CA ASN E 874 -18.915 2.522 52.462 1.00 26.01 C ATOM 744 C ASN E 874 -18.873 3.535 51.323 1.00 27.81 C ATOM 745 O ASN E 874 -19.592 3.422 50.340 1.00 25.13 O ATOM 746 CB ASN E 874 -20.195 1.698 52.420 1.00 22.28 C ATOM 747 CG ASN E 874 -19.947 0.239 52.699 1.00 22.59 C ATOM 748 OD1 ASN E 874 -19.098 -0.383 52.078 1.00 23.08 O ATOM 749 ND2 ASN E 874 -20.684 -0.312 53.635 1.00 27.20 N ATOM 750 HD22 ASN E 874 -21.395 0.256 54.138 1.00 0.00 H ATOM 751 HD21 ASN E 874 -20.557 -1.316 53.873 1.00 0.00 H ATOM 752 H ASN E 874 -18.000 2.864 54.409 1.00 0.00 H ATOM 753 N LYS E 875 -18.007 4.532 51.464 1.00 26.06 N ATOM 754 CA LYS E 875 -17.780 5.495 50.407 1.00 36.62 C ATOM 755 C LYS E 875 -16.294 5.555 49.990 1.00 44.17 C ATOM 756 O LYS E 875 -15.393 5.599 50.840 1.00 38.92 O ATOM 757 CB LYS E 875 -18.282 6.869 50.842 1.00 42.06 C ATOM 758 CG LYS E 875 -19.094 7.600 49.763 1.00 56.95 C ATOM 759 CD LYS E 875 -20.205 6.729 49.124 1.00 47.45 C ATOM 760 CE LYS E 875 -20.963 7.459 48.017 1.00 52.11 C ATOM 761 NZ LYS E 875 -21.563 6.440 47.067 1.00 49.26 N ATOM 762 HZ1 LYS E 875 -20.802 5.867 46.650 1.00 0.00 H ATOM 763 HZ2 LYS E 875 -22.217 5.823 47.590 1.00 0.00 H ATOM 764 HZ3 LYS E 875 -22.080 6.934 46.312 1.00 0.00 H ATOM 765 H LYS E 875 -17.479 4.623 52.355 1.00 0.00 H ATOM 766 N PRO E 876 -16.035 5.528 48.674 1.00 41.74 N ATOM 767 CA PRO E 876 -14.674 5.523 48.141 1.00 46.96 C ATOM 768 C PRO E 876 -13.938 6.842 48.225 1.00 57.10 C ATOM 769 O PRO E 876 -12.716 6.829 48.302 1.00 65.64 O ATOM 770 CB PRO E 876 -14.885 5.157 46.675 1.00 39.64 C ATOM 771 CG PRO E 876 -16.230 5.584 46.392 1.00 40.25 C ATOM 772 CD PRO E 876 -17.010 5.289 47.602 1.00 39.10 C ATOM 773 N ASP E 877 -14.638 7.962 48.164 1.00 63.09 N ATOM 774 CA ASP E 877 -13.941 9.247 48.152 1.00 76.38 C ATOM 775 C ASP E 877 -13.250 9.496 49.513 1.00 80.98 C ATOM 776 O ASP E 877 -13.650 10.366 50.292 1.00 90.26 O ATOM 777 CB ASP E 877 -14.908 10.387 47.783 1.00 82.07 C ATOM 778 CG ASP E 877 -16.166 10.422 48.656 1.00 87.40 C ATOM 779 OD1 ASP E 877 -16.346 9.527 49.510 1.00 85.60 O ATOM 780 OD2 ASP E 877 -16.988 11.346 48.469 1.00 85.76 O ATOM 781 H ASP E 877 -15.677 7.929 48.125 1.00 0.00 H ATOM 782 N ASP E 878 -12.198 8.725 49.782 1.00 82.29 N ATOM 783 CA ASP E 878 -11.534 8.758 51.086 1.00 81.72 C ATOM 784 C ASP E 878 -10.542 9.892 51.219 1.00 83.99 C ATOM 785 O ASP E 878 -10.874 10.981 51.698 1.00 82.11 O ATOM 786 CB ASP E 878 -10.774 7.451 51.369 1.00 76.21 C ATOM 787 CG ASP E 878 -11.551 6.221 50.991 1.00 80.08 C ATOM 788 OD1 ASP E 878 -12.790 6.315 50.873 1.00 86.52 O ATOM 789 OD2 ASP E 878 -10.916 5.148 50.847 1.00 77.25 O ATOM 790 H ASP E 878 -11.839 8.083 49.047 1.00 0.00 H ATOM 791 N GLY E 879 -9.310 9.612 50.799 1.00 96.83 N ATOM 792 CA GLY E 879 -8.154 10.334 51.283 1.00 87.27 C ATOM 793 C GLY E 879 -7.935 9.991 52.740 1.00 75.88 C ATOM 794 O GLY E 879 -6.880 9.455 53.111 1.00 70.89 O ATOM 795 H GLY E 879 -9.175 8.852 50.102 1.00 0.00 H ATOM 796 N SER E 880 -8.962 10.304 53.534 1.00 54.94 N ATOM 797 CA SER E 880 -9.003 10.097 54.972 1.00 51.97 C ATOM 798 C SER E 880 -8.111 8.950 55.435 1.00 47.55 C ATOM 799 O SER E 880 -8.153 7.854 54.868 1.00 46.90 O ATOM 800 CB SER E 880 -10.445 9.841 55.425 1.00 48.94 C ATOM 801 OG SER E 880 -10.474 9.534 56.809 1.00 43.68 O ATOM 802 HG SER E 880 -9.931 8.723 56.977 1.00 0.00 H ATOM 803 H SER E 880 -9.799 10.730 53.088 1.00 0.00 H ATOM 804 N PRO E 881 -7.277 9.206 56.450 1.00 44.49 N ATOM 805 CA PRO E 881 -6.531 8.090 57.019 1.00 30.75 C ATOM 806 C PRO E 881 -7.419 6.943 57.518 1.00 26.54 C ATOM 807 O PRO E 881 -8.560 7.121 57.968 1.00 24.61 O ATOM 808 CB PRO E 881 -5.766 8.752 58.169 1.00 31.99 C ATOM 809 CG PRO E 881 -6.530 9.947 58.489 1.00 36.78 C ATOM 810 CD PRO E 881 -7.011 10.452 57.187 1.00 41.39 C ATOM 811 N MET E 882 -6.868 5.745 57.414 1.00 23.93 N ATOM 812 CA MET E 882 -7.550 4.530 57.826 1.00 21.41 C ATOM 813 C MET E 882 -6.767 3.806 58.915 1.00 22.25 C ATOM 814 O MET E 882 -5.552 4.025 59.086 1.00 16.73 O ATOM 815 CB MET E 882 -7.755 3.620 56.612 1.00 21.01 C ATOM 816 CG MET E 882 -8.512 4.319 55.467 1.00 23.95 C ATOM 817 SD MET E 882 -8.905 3.254 54.060 1.00 27.69 S ATOM 818 CE MET E 882 -10.480 2.543 54.483 1.00 24.07 C ATOM 819 H MET E 882 -5.908 5.670 57.021 1.00 0.00 H ATOM 820 N ILE E 883 -7.472 2.925 59.627 1.00 17.93 N ATOM 821 CA ILE E 883 -6.900 2.145 60.716 1.00 14.16 C ATOM 822 C ILE E 883 -7.309 0.697 60.516 1.00 14.42 C ATOM 823 O ILE E 883 -8.436 0.393 60.153 1.00 19.16 O ATOM 824 CB ILE E 883 -7.358 2.682 62.092 1.00 19.60 C ATOM 825 CG1 ILE E 883 -6.643 1.957 63.218 1.00 21.33 C ATOM 826 CG2 ILE E 883 -8.857 2.540 62.285 1.00 17.20 C ATOM 827 CD1 ILE E 883 -6.722 2.708 64.535 1.00 30.16 C ATOM 828 H ILE E 883 -8.476 2.789 59.394 1.00 0.00 H ATOM 829 N GLY E 884 -6.383 -0.213 60.694 1.00 17.27 N ATOM 830 CA GLY E 884 -6.673 -1.615 60.456 1.00 15.83 C ATOM 831 C GLY E 884 -7.075 -2.328 61.721 1.00 21.52 C ATOM 832 O GLY E 884 -6.467 -2.096 62.764 1.00 19.32 O ATOM 833 H GLY E 884 -5.433 0.072 61.008 1.00 0.00 H ATOM 834 N CYS E 885 -8.099 -3.180 61.639 1.00 19.00 N ATOM 835 CA CYS E 885 -8.492 -4.012 62.768 1.00 21.81 C ATOM 836 C CYS E 885 -7.491 -5.113 62.992 1.00 28.43 C ATOM 837 O CYS E 885 -7.195 -5.877 62.084 1.00 24.96 O ATOM 838 CB CYS E 885 -9.861 -4.648 62.545 1.00 26.00 C ATOM 839 SG CYS E 885 -10.378 -5.679 63.916 1.00 23.63 S ATOM 840 H CYS E 885 -8.629 -3.252 60.747 1.00 0.00 H ATOM 841 N ASP E 886 -7.020 -5.249 64.225 1.00 24.74 N ATOM 842 CA ASP E 886 -6.009 -6.244 64.513 1.00 28.39 C ATOM 843 C ASP E 886 -6.569 -7.634 64.707 1.00 33.35 C ATOM 844 O ASP E 886 -5.813 -8.544 64.990 1.00 33.78 O ATOM 845 CB ASP E 886 -5.210 -5.802 65.728 1.00 30.42 C ATOM 846 CG ASP E 886 -4.323 -4.641 65.401 1.00 31.53 C ATOM 847 OD1 ASP E 886 -3.504 -4.790 64.484 1.00 29.71 O ATOM 848 OD2 ASP E 886 -4.490 -3.562 65.989 1.00 38.28 O ATOM 849 H ASP E 886 -7.378 -4.639 64.987 1.00 0.00 H ATOM 850 N ASP E 887 -7.880 -7.807 64.527 1.00 30.67 N ATOM 851 CA ASP E 887 -8.470 -9.148 64.465 1.00 31.98 C ATOM 852 C ASP E 887 -8.817 -9.540 63.014 1.00 33.62 C ATOM 853 O ASP E 887 -8.188 -10.417 62.413 1.00 35.30 O ATOM 854 CB ASP E 887 -9.713 -9.216 65.355 1.00 37.90 C ATOM 855 CG ASP E 887 -10.162 -10.646 65.652 1.00 42.27 C ATOM 856 OD1 ASP E 887 -9.863 -11.568 64.856 1.00 47.18 O ATOM 857 OD2 ASP E 887 -10.844 -10.839 66.682 1.00 51.30 O ATOM 858 H ASP E 887 -8.495 -6.974 64.429 1.00 0.00 H ATOM 859 N CYS E 888 -9.785 -8.850 62.437 1.00 27.90 N ATOM 860 CA CYS E 888 -10.321 -9.208 61.113 1.00 31.39 C ATOM 861 C CYS E 888 -9.615 -8.521 59.928 1.00 33.46 C ATOM 862 O CYS E 888 -9.804 -8.898 58.754 1.00 24.54 O ATOM 863 CB CYS E 888 -11.805 -8.874 61.079 1.00 30.27 C ATOM 864 SG CYS E 888 -12.165 -7.116 61.023 1.00 25.82 S ATOM 865 H CYS E 888 -10.181 -8.027 62.934 1.00 0.00 H ATOM 866 N ASP E 889 -8.780 -7.531 60.232 1.00 25.43 N ATOM 867 CA ASP E 889 -8.096 -6.747 59.203 1.00 28.94 C ATOM 868 C ASP E 889 -8.979 -5.994 58.177 1.00 29.50 C ATOM 869 O ASP E 889 -8.507 -5.618 57.104 1.00 25.15 O ATOM 870 CB ASP E 889 -7.153 -7.649 58.429 1.00 23.35 C ATOM 871 CG ASP E 889 -5.947 -6.905 57.904 1.00 41.47 C ATOM 872 OD1 ASP E 889 -5.531 -5.885 58.519 1.00 41.71 O ATOM 873 OD2 ASP E 889 -5.406 -7.343 56.869 1.00 43.30 O ATOM 874 H ASP E 889 -8.608 -7.307 61.233 1.00 0.00 H ATOM 875 N ASP E 890 -10.240 -5.761 58.481 1.00 26.68 N ATOM 876 CA ASP E 890 -10.958 -4.701 57.788 1.00 21.20 C ATOM 877 C ASP E 890 -10.268 -3.365 58.133 1.00 23.30 C ATOM 878 O ASP E 890 -9.690 -3.240 59.211 1.00 25.10 O ATOM 879 CB ASP E 890 -12.410 -4.650 58.232 1.00 25.56 C ATOM 880 CG ASP E 890 -13.244 -5.781 57.687 1.00 27.37 C ATOM 881 OD1 ASP E 890 -12.824 -6.441 56.727 1.00 27.54 O ATOM 882 OD2 ASP E 890 -14.356 -5.986 58.221 1.00 27.22 O ATOM 883 H ASP E 890 -10.718 -6.329 59.209 1.00 0.00 H ATOM 884 N TRP E 891 -10.362 -2.369 57.257 1.00 17.44 N ATOM 885 CA TRP E 891 -9.782 -1.040 57.494 1.00 14.71 C ATOM 886 C TRP E 891 -10.875 -0.015 57.475 1.00 17.35 C ATOM 887 O TRP E 891 -11.764 -0.089 56.619 1.00 14.90 O ATOM 888 CB TRP E 891 -8.714 -0.697 56.437 1.00 21.29 C ATOM 889 CG TRP E 891 -7.436 -1.474 56.659 1.00 19.52 C ATOM 890 CD1 TRP E 891 -7.285 -2.802 56.493 1.00 25.93 C ATOM 891 CD2 TRP E 891 -6.158 -0.981 57.121 1.00 18.09 C ATOM 892 NE1 TRP E 891 -6.009 -3.187 56.816 1.00 20.56 N ATOM 893 CE2 TRP E 891 -5.292 -2.087 57.199 1.00 22.38 C ATOM 894 CE3 TRP E 891 -5.663 0.278 57.465 1.00 21.16 C ATOM 895 CZ2 TRP E 891 -3.945 -1.970 57.585 1.00 22.18 C ATOM 896 CZ3 TRP E 891 -4.319 0.386 57.845 1.00 20.17 C ATOM 897 CH2 TRP E 891 -3.491 -0.727 57.904 1.00 16.46 C ATOM 898 HE1 TRP E 891 -5.645 -4.160 56.776 1.00 0.00 H ATOM 899 H TRP E 891 -10.869 -2.538 56.365 1.00 0.00 H ATOM 900 N TYR E 892 -10.851 0.922 58.431 1.00 16.31 N ATOM 901 CA TYR E 892 -11.885 1.976 58.529 1.00 14.26 C ATOM 902 C TYR E 892 -11.259 3.343 58.503 1.00 21.19 C ATOM 903 O TYR E 892 -10.132 3.509 58.981 1.00 16.47 O ATOM 904 CB TYR E 892 -12.703 1.873 59.835 1.00 17.28 C ATOM 905 CG TYR E 892 -13.641 0.725 59.978 1.00 17.63 C ATOM 906 CD1 TYR E 892 -13.174 -0.572 60.086 1.00 17.16 C ATOM 907 CD2 TYR E 892 -15.008 0.945 60.048 1.00 15.19 C ATOM 908 CE1 TYR E 892 -14.030 -1.618 60.237 1.00 18.83 C ATOM 909 CE2 TYR E 892 -15.880 -0.086 60.195 1.00 21.43 C ATOM 910 CZ TYR E 892 -15.393 -1.373 60.296 1.00 26.14 C ATOM 911 OH TYR E 892 -16.262 -2.422 60.438 1.00 27.59 O ATOM 912 HH TYR E 892 -15.750 -3.268 60.495 1.00 0.00 H ATOM 913 H TYR E 892 -10.080 0.909 59.128 1.00 0.00 H ATOM 914 N HIS E 893 -11.984 4.345 58.010 1.00 20.04 N ATOM 915 CA HIS E 893 -11.516 5.711 58.242 1.00 26.53 C ATOM 916 C HIS E 893 -11.567 6.036 59.718 1.00 26.09 C ATOM 917 O HIS E 893 -12.531 5.676 60.402 1.00 21.49 O ATOM 918 CB HIS E 893 -12.343 6.758 57.535 1.00 23.14 C ATOM 919 CG HIS E 893 -12.526 6.513 56.093 1.00 28.18 C ATOM 920 ND1 HIS E 893 -13.768 6.319 55.534 1.00 33.86 N ATOM 921 CD2 HIS E 893 -11.631 6.447 55.084 1.00 29.63 C ATOM 922 CE1 HIS E 893 -13.627 6.136 54.234 1.00 27.98 C ATOM 923 NE2 HIS E 893 -12.342 6.206 53.943 1.00 28.45 N ATOM 924 H HIS E 893 -12.857 4.162 57.476 1.00 0.00 H ATOM 925 N TRP E 894 -10.556 6.759 60.181 1.00 20.63 N ATOM 926 CA TRP E 894 -10.496 7.210 61.559 1.00 28.94 C ATOM 927 C TRP E 894 -11.781 7.875 62.005 1.00 22.52 C ATOM 928 O TRP E 894 -12.318 7.478 63.017 1.00 23.91 O ATOM 929 CB TRP E 894 -9.358 8.205 61.792 1.00 31.44 C ATOM 930 CG TRP E 894 -7.989 7.693 61.605 1.00 33.33 C ATOM 931 CD1 TRP E 894 -7.613 6.500 61.086 1.00 26.45 C ATOM 932 CD2 TRP E 894 -6.783 8.387 61.949 1.00 32.77 C ATOM 933 NE1 TRP E 894 -6.239 6.394 61.109 1.00 27.24 N ATOM 934 CE2 TRP E 894 -5.714 7.553 61.614 1.00 30.32 C ATOM 935 CE3 TRP E 894 -6.515 9.638 62.511 1.00 34.90 C ATOM 936 CZ2 TRP E 894 -4.394 7.926 61.815 1.00 32.56 C ATOM 937 CZ3 TRP E 894 -5.212 10.007 62.700 1.00 36.23 C ATOM 938 CH2 TRP E 894 -4.167 9.156 62.354 1.00 36.36 C ATOM 939 HE1 TRP E 894 -5.691 5.568 60.794 1.00 0.00 H ATOM 940 H TRP E 894 -9.781 7.011 59.535 1.00 0.00 H ATOM 941 N PRO E 895 -12.252 8.906 61.277 1.00 23.14 N ATOM 942 CA PRO E 895 -13.496 9.557 61.730 1.00 24.24 C ATOM 943 C PRO E 895 -14.676 8.604 61.815 1.00 23.18 C ATOM 944 O PRO E 895 -15.496 8.736 62.714 1.00 30.42 O ATOM 945 CB PRO E 895 -13.748 10.621 60.676 1.00 26.88 C ATOM 946 CG PRO E 895 -12.979 10.169 59.479 1.00 34.47 C ATOM 947 CD PRO E 895 -11.746 9.526 60.044 1.00 29.03 C ATOM 948 N CYS E 896 -14.729 7.615 60.929 1.00 22.69 N ATOM 949 CA CYS E 896 -15.812 6.624 60.964 1.00 26.26 C ATOM 950 C CYS E 896 -15.809 5.707 62.180 1.00 25.14 C ATOM 951 O CYS E 896 -16.789 5.008 62.431 1.00 22.69 O ATOM 952 CB CYS E 896 -15.793 5.775 59.674 1.00 22.67 C ATOM 953 SG CYS E 896 -16.151 6.773 58.221 1.00 22.62 S ATOM 954 H CYS E 896 -13.992 7.542 60.199 1.00 0.00 H ATOM 955 N VAL E 897 -14.748 5.711 62.968 1.00 24.96 N ATOM 956 CA VAL E 897 -14.757 4.913 64.182 1.00 19.49 C ATOM 957 C VAL E 897 -14.355 5.761 65.382 1.00 25.18 C ATOM 958 O VAL E 897 -13.917 5.225 66.392 1.00 26.87 O ATOM 959 CB VAL E 897 -13.818 3.686 64.058 1.00 26.17 C ATOM 960 CG1 VAL E 897 -14.354 2.692 63.040 1.00 22.78 C ATOM 961 CG2 VAL E 897 -12.408 4.132 63.677 1.00 26.56 C ATOM 962 H VAL E 897 -13.914 6.281 62.721 1.00 0.00 H ATOM 963 N GLY E 898 -14.450 7.082 65.252 1.00 27.54 N ATOM 964 CA GLY E 898 -14.210 7.982 66.377 1.00 31.06 C ATOM 965 C GLY E 898 -12.771 8.242 66.779 1.00 36.46 C ATOM 966 O GLY E 898 -12.506 8.697 67.886 1.00 36.81 O ATOM 967 H GLY E 898 -14.701 7.484 64.326 1.00 0.00 H ATOM 968 N ILE E 899 -11.837 7.956 65.891 1.00 33.51 N ATOM 969 CA ILE E 899 -10.432 8.219 66.168 1.00 36.96 C ATOM 970 C ILE E 899 -10.051 9.550 65.566 1.00 40.43 C ATOM 971 O ILE E 899 -10.357 9.827 64.410 1.00 40.05 O ATOM 972 CB ILE E 899 -9.543 7.107 65.627 1.00 31.60 C ATOM 973 CG1 ILE E 899 -9.819 5.852 66.440 1.00 29.75 C ATOM 974 CG2 ILE E 899 -8.087 7.487 65.715 1.00 34.91 C ATOM 975 CD1 ILE E 899 -9.328 4.650 65.803 1.00 31.26 C ATOM 976 H ILE E 899 -12.109 7.536 64.979 1.00 0.00 H ATOM 977 N MET E 900 -9.394 10.367 66.381 1.00 48.85 N ATOM 978 CA MET E 900 -9.091 11.751 66.053 1.00 50.06 C ATOM 979 C MET E 900 -7.582 11.940 65.813 1.00 54.15 C ATOM 980 O MET E 900 -7.180 12.676 64.910 1.00 58.98 O ATOM 981 CB MET E 900 -9.579 12.677 67.179 1.00 43.91 C ATOM 982 CG MET E 900 -11.072 12.542 67.520 1.00 51.21 C ATOM 983 SD MET E 900 -12.195 12.943 66.160 1.00 61.86 S ATOM 984 CE MET E 900 -13.816 12.772 66.929 1.00 55.42 C ATOM 985 H MET E 900 -9.080 9.998 67.301 1.00 0.00 H ATOM 986 N THR E 901 -6.751 11.275 66.614 1.00 54.90 N ATOM 987 CA THR E 901 -5.295 11.357 66.437 1.00 54.40 C ATOM 988 C THR E 901 -4.704 9.990 66.147 1.00 50.06 C ATOM 989 O THR E 901 -5.290 8.963 66.486 1.00 52.17 O ATOM 990 CB THR E 901 -4.578 11.923 67.683 1.00 59.41 C ATOM 991 OG1 THR E 901 -4.369 10.878 68.642 1.00 69.21 O ATOM 992 CG2 THR E 901 -5.378 13.045 68.328 1.00 53.23 C ATOM 993 HG1 THR E 901 -3.811 10.167 68.238 1.00 0.00 H ATOM 994 H THR E 901 -7.140 10.687 67.379 1.00 0.00 H ATOM 995 N ALA E 902 -3.538 9.980 65.522 1.00 54.64 N ATOM 996 CA ALA E 902 -2.791 8.744 65.363 1.00 57.54 C ATOM 997 C ALA E 902 -2.688 8.071 66.727 1.00 53.29 C ATOM 998 O ALA E 902 -2.305 8.708 67.706 1.00 52.73 O ATOM 999 CB ALA E 902 -1.402 9.011 64.783 1.00 59.19 C ATOM 1000 H ALA E 902 -3.152 10.867 65.140 1.00 0.00 H ATOM 1001 N PRO E 903 -3.078 6.794 66.815 1.00 50.95 N ATOM 1002 CA PRO E 903 -2.915 6.161 68.118 1.00 46.03 C ATOM 1003 C PRO E 903 -1.503 5.618 68.292 1.00 44.97 C ATOM 1004 O PRO E 903 -0.834 5.335 67.299 1.00 44.32 O ATOM 1005 CB PRO E 903 -3.945 5.023 68.088 1.00 50.13 C ATOM 1006 CG PRO E 903 -4.625 5.093 66.776 1.00 46.98 C ATOM 1007 CD PRO E 903 -3.759 5.894 65.874 1.00 49.19 C ATOM 1008 N PRO E 904 -1.035 5.499 69.541 1.00 46.61 N ATOM 1009 CA PRO E 904 0.275 4.888 69.818 1.00 45.44 C ATOM 1010 C PRO E 904 0.511 3.547 69.088 1.00 46.34 C ATOM 1011 O PRO E 904 -0.406 2.743 68.940 1.00 36.19 O ATOM 1012 CB PRO E 904 0.238 4.698 71.332 1.00 45.33 C ATOM 1013 CG PRO E 904 -0.562 5.888 71.797 1.00 47.60 C ATOM 1014 CD PRO E 904 -1.615 6.130 70.740 1.00 44.18 C ATOM 1015 N GLU E 905 1.748 3.318 68.662 1.00 42.39 N ATOM 1016 CA GLU E 905 2.096 2.167 67.836 1.00 43.04 C ATOM 1017 C GLU E 905 1.993 0.837 68.559 1.00 48.71 C ATOM 1018 O GLU E 905 1.747 -0.202 67.958 1.00 46.93 O ATOM 1019 CB GLU E 905 3.512 2.317 67.320 1.00 49.01 C ATOM 1020 CG GLU E 905 3.900 3.752 67.075 1.00 53.59 C ATOM 1021 CD GLU E 905 5.010 3.872 66.077 1.00 59.40 C ATOM 1022 OE1 GLU E 905 5.617 2.829 65.753 1.00 58.03 O ATOM 1023 OE2 GLU E 905 5.271 5.004 65.620 1.00 60.40 O ATOM 1024 H GLU E 905 2.499 3.986 68.928 1.00 0.00 H ATOM 1025 N GLU E 906 2.224 0.889 69.861 1.00 52.60 N ATOM 1026 CA GLU E 906 2.164 -0.276 70.729 1.00 52.18 C ATOM 1027 C GLU E 906 0.755 -0.810 70.843 1.00 52.35 C ATOM 1028 O GLU E 906 0.553 -1.959 71.232 1.00 57.99 O ATOM 1029 CB GLU E 906 2.673 0.072 72.132 1.00 54.62 C ATOM 1030 CG GLU E 906 3.630 1.259 72.170 1.00 57.19 C ATOM 1031 CD GLU E 906 2.909 2.590 72.188 1.00 52.92 C ATOM 1032 OE1 GLU E 906 3.159 3.422 71.288 1.00 45.61 O ATOM 1033 OE2 GLU E 906 2.094 2.793 73.102 1.00 50.79 O ATOM 1034 H GLU E 906 2.460 1.809 70.285 1.00 0.00 H ATOM 1035 N MET E 907 -0.226 0.030 70.526 1.00 44.47 N ATOM 1036 CA MET E 907 -1.601 -0.301 70.838 1.00 44.54 C ATOM 1037 C MET E 907 -2.278 -1.078 69.736 1.00 39.46 C ATOM 1038 O MET E 907 -1.908 -0.967 68.585 1.00 45.35 O ATOM 1039 CB MET E 907 -2.382 0.970 71.160 1.00 41.49 C ATOM 1040 CG MET E 907 -2.252 1.323 72.640 1.00 41.87 C ATOM 1041 SD MET E 907 -3.477 2.414 73.287 1.00 48.35 S ATOM 1042 CE MET E 907 -2.653 3.912 72.847 1.00 42.26 C ATOM 1043 H MET E 907 -0.005 0.929 70.052 1.00 0.00 H ATOM 1044 N GLN E 908 -3.262 -1.881 70.119 1.00 45.00 N ATOM 1045 CA GLN E 908 -4.058 -2.638 69.167 1.00 44.92 C ATOM 1046 C GLN E 908 -5.502 -2.150 69.082 1.00 46.13 C ATOM 1047 O GLN E 908 -6.205 -2.070 70.097 1.00 43.98 O ATOM 1048 CB GLN E 908 -4.034 -4.103 69.537 1.00 40.93 C ATOM 1049 CG GLN E 908 -2.762 -4.754 69.145 1.00 50.56 C ATOM 1050 CD GLN E 908 -2.791 -6.220 69.432 1.00 53.40 C ATOM 1051 OE1 GLN E 908 -3.243 -6.645 70.492 1.00 52.71 O ATOM 1052 NE2 GLN E 908 -2.329 -7.013 68.481 1.00 51.65 N ATOM 1053 HE22 GLN E 908 -1.956 -6.606 67.600 1.00 0.00 H ATOM 1054 HE21 GLN E 908 -2.339 -8.044 68.614 1.00 0.00 H ATOM 1055 H GLN E 908 -3.471 -1.972 71.134 1.00 0.00 H ATOM 1056 N TRP E 909 -5.941 -1.824 67.866 1.00 36.48 N ATOM 1057 CA TRP E 909 -7.314 -1.361 67.653 1.00 38.14 C ATOM 1058 C TRP E 909 -8.141 -2.464 67.044 1.00 35.08 C ATOM 1059 O TRP E 909 -7.600 -3.307 66.313 1.00 33.45 O ATOM 1060 CB TRP E 909 -7.333 -0.125 66.762 1.00 34.64 C ATOM 1061 CG TRP E 909 -8.720 0.307 66.427 1.00 36.20 C ATOM 1062 CD1 TRP E 909 -9.572 1.035 67.213 1.00 33.57 C ATOM 1063 CD2 TRP E 909 -9.427 0.021 65.222 1.00 24.89 C ATOM 1064 NE1 TRP E 909 -10.764 1.225 66.561 1.00 38.66 N ATOM 1065 CE2 TRP E 909 -10.696 0.618 65.331 1.00 34.04 C ATOM 1066 CE3 TRP E 909 -9.102 -0.668 64.051 1.00 27.63 C ATOM 1067 CZ2 TRP E 909 -11.645 0.535 64.317 1.00 26.56 C ATOM 1068 CZ3 TRP E 909 -10.031 -0.733 63.053 1.00 24.81 C ATOM 1069 CH2 TRP E 909 -11.297 -0.141 63.193 1.00 25.10 C ATOM 1070 HE1 TRP E 909 -11.584 1.743 66.936 1.00 0.00 H ATOM 1071 H TRP E 909 -5.296 -1.900 67.053 1.00 0.00 H ATOM 1072 N PHE E 910 -9.450 -2.457 67.303 1.00 40.67 N ATOM 1073 CA PHE E 910 -10.238 -3.655 67.029 1.00 32.18 C ATOM 1074 C PHE E 910 -11.575 -3.585 66.296 1.00 40.14 C ATOM 1075 O PHE E 910 -12.126 -4.631 65.984 1.00 52.93 O ATOM 1076 CB PHE E 910 -10.424 -4.364 68.356 1.00 36.55 C ATOM 1077 CG PHE E 910 -9.240 -5.171 68.721 1.00 32.96 C ATOM 1078 CD1 PHE E 910 -9.029 -6.393 68.121 1.00 36.91 C ATOM 1079 CD2 PHE E 910 -8.279 -4.673 69.580 1.00 43.94 C ATOM 1080 CE1 PHE E 910 -7.906 -7.142 68.412 1.00 41.87 C ATOM 1081 CE2 PHE E 910 -7.134 -5.418 69.880 1.00 39.78 C ATOM 1082 CZ PHE E 910 -6.954 -6.648 69.306 1.00 40.61 C ATOM 1083 H PHE E 910 -9.904 -1.608 67.696 1.00 0.00 H ATOM 1084 N CYS E 911 -12.091 -2.422 65.954 1.00 39.49 N ATOM 1085 CA CYS E 911 -13.246 -2.368 65.047 1.00 36.11 C ATOM 1086 C CYS E 911 -14.505 -2.887 65.739 1.00 41.08 C ATOM 1087 O CYS E 911 -14.457 -3.859 66.494 1.00 35.19 O ATOM 1088 CB CYS E 911 -12.995 -3.166 63.739 1.00 36.42 C ATOM 1089 SG CYS E 911 -14.161 -4.534 63.315 1.00 29.87 S ATOM 1090 H CYS E 911 -11.681 -1.542 66.326 1.00 0.00 H ATOM 1091 N PRO E 912 -15.641 -2.229 65.481 1.00 41.13 N ATOM 1092 CA PRO E 912 -16.903 -2.555 66.153 1.00 46.98 C ATOM 1093 C PRO E 912 -17.214 -4.045 66.220 1.00 48.81 C ATOM 1094 O PRO E 912 -17.517 -4.508 67.313 1.00 46.58 O ATOM 1095 CB PRO E 912 -17.939 -1.817 65.304 1.00 52.48 C ATOM 1096 CG PRO E 912 -17.212 -0.608 64.869 1.00 49.38 C ATOM 1097 CD PRO E 912 -15.807 -1.093 64.556 1.00 39.37 C ATOM 1098 N LYS E 913 -17.105 -4.788 65.119 1.00 50.64 N ATOM 1099 CA LYS E 913 -17.521 -6.195 65.143 1.00 52.90 C ATOM 1100 C LYS E 913 -16.676 -7.038 66.084 1.00 50.35 C ATOM 1101 O LYS E 913 -17.205 -7.919 66.744 1.00 55.16 O ATOM 1102 CB LYS E 913 -17.469 -6.839 63.757 1.00 57.41 C ATOM 1103 CG LYS E 913 -18.539 -6.392 62.813 1.00 60.70 C ATOM 1104 CD LYS E 913 -18.047 -5.160 62.151 1.00 64.03 C ATOM 1105 CE LYS E 913 -18.962 -4.627 61.103 1.00 66.92 C ATOM 1106 NZ LYS E 913 -18.256 -3.401 60.641 1.00 65.68 N ATOM 1107 HZ1 LYS E 913 -18.138 -2.748 61.442 1.00 0.00 H ATOM 1108 HZ2 LYS E 913 -17.322 -3.661 60.264 1.00 0.00 H ATOM 1109 HZ3 LYS E 913 -18.816 -2.940 59.895 1.00 0.00 H ATOM 1110 H LYS E 913 -16.726 -4.372 64.245 1.00 0.00 H ATOM 1111 N CYS E 914 -15.371 -6.779 66.150 1.00 42.99 N ATOM 1112 CA CYS E 914 -14.470 -7.658 66.892 1.00 45.46 C ATOM 1113 C CYS E 914 -14.193 -7.150 68.330 1.00 43.34 C ATOM 1114 O CYS E 914 -14.478 -5.992 68.686 1.00 41.62 O ATOM 1115 CB CYS E 914 -13.152 -7.829 66.116 1.00 43.65 C ATOM 1116 SG CYS E 914 -13.328 -8.300 64.334 1.00 31.33 S ATOM 1117 H CYS E 914 -14.989 -5.941 65.667 1.00 0.00 H TER 1118 CYS E 914 HETATM 1119 ZN ZN A 1 2.491 7.381 36.931 1.00 28.55 ZN HETATM 1120 ZN ZN A 2 -0.396 -4.825 43.296 1.00 23.65 ZN HETATM 1121 ZN ZN A 3 -12.508 -6.376 63.048 1.00 28.99 ZN HETATM 1122 ZN ZN A 4 -15.530 5.570 56.320 1.00 23.12 ZN HETATM 1123 O HOH 5 9.450 -8.432 46.941 1.00 37.92 O HETATM 1124 O HOH 6 -1.229 -3.502 65.480 1.00 43.09 O HETATM 1125 O HOH 7 5.407 -4.618 58.718 1.00 57.75 O HETATM 1126 O HOH 8 -0.447 5.457 39.507 1.00 26.70 O HETATM 1127 O HOH 9 1.606 -3.399 47.985 1.00 26.70 O HETATM 1128 O HOH 10 9.620 -9.774 44.490 1.00 42.62 O HETATM 1129 O HOH 11 8.914 -6.505 30.766 1.00 32.78 O HETATM 1130 O HOH 12 6.088 -2.176 49.353 1.00 42.85 O HETATM 1131 O HOH 13 -1.706 2.670 47.032 1.00 19.45 O HETATM 1132 O HOH 14 -0.469 7.303 28.662 1.00 36.64 O HETATM 1133 O HOH 15 -3.237 3.139 37.227 1.00 50.61 O HETATM 1134 O HOH 16 7.373 -0.498 51.025 1.00 31.02 O HETATM 1135 O HOH 17 7.466 -12.885 36.835 1.00 50.01 O HETATM 1136 O HOH 18 13.955 4.599 34.381 1.00 37.52 O HETATM 1137 O HOH 19 6.584 -8.213 30.186 1.00 27.52 O HETATM 1138 O HOH 20 -3.561 4.137 45.576 1.00 28.50 O HETATM 1139 O HOH 21 -7.799 -6.634 52.684 1.00 41.21 O HETATM 1140 O HOH 22 10.404 -5.198 28.558 1.00 33.57 O HETATM 1141 O HOH 23 13.521 -7.365 40.338 1.00 38.57 O HETATM 1142 O HOH 24 14.151 -5.605 37.245 1.00 41.27 O HETATM 1143 O HOH 25 14.652 -8.569 39.110 1.00 47.94 O HETATM 1144 O HOH 26 -15.240 -7.564 55.226 1.00 33.45 O HETATM 1145 O HOH 27 -15.619 -4.697 60.465 1.00 35.53 O HETATM 1146 O HOH 28 -6.092 7.693 68.570 1.00 43.15 O HETATM 1147 O HOH 29 -3.499 -0.489 36.876 1.00 38.39 O HETATM 1148 O HOH 30 -15.845 -6.205 70.905 1.00 34.39 O HETATM 1149 O HOH 31 -16.746 -1.869 52.725 1.00 19.20 O HETATM 1150 O HOH 32 -20.707 -1.951 56.511 1.00 31.10 O HETATM 1151 O HOH 33 -13.461 3.809 51.843 1.00 28.84 O HETATM 1152 O HOH 34 -7.687 8.658 48.764 1.00 47.06 O HETATM 1153 O HOH 35 -7.904 1.138 48.727 1.00 29.25 O HETATM 1154 O HOH 36 -2.816 -7.936 65.182 1.00 47.04 O HETATM 1155 O HOH 37 -8.638 9.145 69.331 1.00 36.26 O HETATM 1156 O HOH 38 -18.478 -4.062 54.338 1.00 33.90 O HETATM 1157 O HOH 39 -6.615 -5.073 53.137 1.00 45.89 O HETATM 1158 O HOH 40 -0.764 -4.836 57.550 1.00 39.39 O HETATM 1159 N ALA A 41 13.722 -0.178 33.254 1.00 0.24 N HETATM 1160 CA ALA A 41 13.291 0.880 34.195 1.00 0.06 C HETATM 1161 C ALA A 41 13.790 0.598 35.606 1.00 0.23 C HETATM 1162 O ALA A 41 14.701 -0.213 35.817 1.00 -0.39 O HETATM 1163 N ALA A 41 13.227 1.301 36.569 1.00 -0.26 N HETATM 1164 CA ALA A 41 13.522 1.048 37.978 1.00 0.13 C HETATM 1165 C ALA A 41 12.570 0.011 38.552 1.00 0.20 C HETATM 1166 O ALA A 41 11.347 0.186 38.493 1.00 -0.39 O HETATM 1167 N ALA A 41 13.131 -1.072 39.092 1.00 -0.26 N HETATM 1168 CA ALA A 41 12.362 -2.143 39.717 1.00 0.16 C HETATM 1169 C ALA A 41 12.902 -2.488 41.115 1.00 0.21 C HETATM 1170 O ALA A 41 14.047 -2.140 41.484 1.00 -0.39 O HETATM 1171 N ALA A 41 12.090 -3.196 41.895 1.00 -0.26 N HETATM 1172 CA ALA A 41 12.562 -3.669 43.155 1.00 0.13 C HETATM 1173 CB ALA A 41 12.473 -2.550 44.184 1.00 -0.01 C HETATM 1174 CG ALA A 41 11.038 -2.103 44.533 1.00 -0.05 C HETATM 1175 CD ALA A 41 11.043 -1.013 45.659 1.00 -0.05 C HETATM 1176 CE ALA A 41 9.638 -0.510 45.987 1.00 -0.05 C HETATM 1177 CZ ALA A 41 9.482 0.609 47.056 1.00 -0.04 C HETATM 1178 CM3 ALA A 41 9.934 0.153 48.382 1.00 -0.06 C HETATM 1179 H38 ALA A 41 9.810 0.967 49.111 1.00 0.02 H HETATM 1180 H39 ALA A 41 10.995 -0.134 48.329 1.00 0.02 H HETATM 1181 H40 ALA A 41 9.335 -0.715 48.695 1.00 0.02 H HETATM 1182 CM2 ALA A 41 10.215 1.895 46.693 1.00 -0.06 C HETATM 1183 H41 ALA A 41 9.881 2.240 45.703 1.00 0.02 H HETATM 1184 H42 ALA A 41 11.298 1.705 46.669 1.00 0.02 H HETATM 1185 H43 ALA A 41 9.994 2.667 47.444 1.00 0.02 H HETATM 1186 CM1 ALA A 41 8.009 0.930 47.214 1.00 -0.06 C HETATM 1187 H44 ALA A 41 7.460 0.014 47.477 1.00 0.02 H HETATM 1188 H45 ALA A 41 7.618 1.333 46.268 1.00 0.02 H HETATM 1189 H46 ALA A 41 7.880 1.676 48.012 1.00 0.02 H HETATM 1190 H36 ALA A 41 9.056 -1.376 46.336 1.00 0.03 H HETATM 1191 H37 ALA A 41 9.203 -0.129 45.051 1.00 0.03 H HETATM 1192 H34 ALA A 41 11.654 -0.162 45.324 1.00 0.03 H HETATM 1193 H35 ALA A 41 11.485 -1.446 46.569 1.00 0.03 H HETATM 1194 H32 ALA A 41 10.465 -2.975 44.880 1.00 0.03 H HETATM 1195 H33 ALA A 41 10.563 -1.687 43.633 1.00 0.03 H HETATM 1196 H30 ALA A 41 13.016 -1.679 43.789 1.00 0.03 H HETATM 1197 H31 ALA A 41 12.958 -2.896 45.109 1.00 0.03 H HETATM 1198 C ALA A 41 11.862 -4.948 43.647 1.00 0.20 C HETATM 1199 O ALA A 41 10.869 -5.409 43.125 1.00 -0.39 O HETATM 1200 N ALA A 41 12.570 -5.595 44.585 1.00 -0.26 N HETATM 1201 CA ALA A 41 12.120 -6.822 45.281 1.00 0.13 C HETATM 1202 C ALA A 41 12.697 -6.824 46.698 1.00 0.20 C HETATM 1203 O ALA A 41 13.695 -6.170 46.943 1.00 -0.39 O HETATM 1204 N ALA A 41 12.114 -7.596 47.602 1.00 -0.27 N HETATM 1205 CA ALA A 41 12.742 -7.814 48.896 1.00 0.12 C HETATM 1206 C ALA A 41 13.925 -8.781 48.747 1.00 0.06 C HETATM 1207 O ALA A 41 15.005 -8.534 49.315 1.00 -0.57 O HETATM 1208 OXT ALA A 41 13.803 -9.811 48.058 1.00 -0.57 O HETATM 1209 CB ALA A 41 11.727 -8.344 49.925 1.00 0.09 C HETATM 1210 OG1 ALA A 41 10.929 -7.249 50.384 1.00 -0.39 O HETATM 1211 H58 ALA A 41 10.298 -7.564 51.020 1.00 0.21 H HETATM 1212 CG2 ALA A 41 12.410 -8.959 51.125 1.00 -0.04 C HETATM 1213 H59 ALA A 41 11.650 -9.323 51.832 1.00 0.03 H HETATM 1214 H60 ALA A 41 13.037 -8.202 51.618 1.00 0.03 H HETATM 1215 H61 ALA A 41 13.040 -9.800 50.798 1.00 0.03 H HETATM 1216 H57 ALA A 41 11.087 -9.099 49.445 1.00 0.06 H HETATM 1217 H56 ALA A 41 13.126 -6.850 49.260 1.00 0.08 H HETATM 1218 H55 ALA A 41 11.238 -8.031 47.394 1.00 0.19 H HETATM 1219 CB ALA A 41 12.600 -8.078 44.574 1.00 0.00 C HETATM 1220 CG ALA A 41 13.003 -7.877 43.156 1.00 0.04 C HETATM 1221 CD ALA A 41 13.501 -9.158 42.516 1.00 0.17 C HETATM 1222 OE1 ALA A 41 13.960 -10.078 43.210 1.00 -0.40 O HETATM 1223 NE2 ALA A 41 13.405 -9.230 41.179 1.00 -0.30 N HETATM 1224 H53 ALA A 41 13.717 -10.050 40.699 1.00 0.18 H HETATM 1225 H54 ALA A 41 13.021 -8.464 40.663 1.00 0.18 H HETATM 1226 H51 ALA A 41 13.806 -7.127 43.119 1.00 0.05 H HETATM 1227 H52 ALA A 41 12.134 -7.512 42.589 1.00 0.05 H HETATM 1228 H49 ALA A 41 11.786 -8.817 44.597 1.00 0.03 H HETATM 1229 H50 ALA A 41 13.467 -8.471 45.124 1.00 0.03 H HETATM 1230 H48 ALA A 41 11.021 -6.829 45.325 1.00 0.08 H HETATM 1231 H47 ALA A 41 13.465 -5.222 44.831 1.00 0.19 H HETATM 1232 H29 ALA A 41 13.626 -3.920 43.028 1.00 0.08 H HETATM 1233 H28 ALA A 41 11.155 -3.395 41.600 1.00 0.19 H HETATM 1234 CB ALA A 41 12.378 -3.423 38.851 1.00 0.09 C HETATM 1235 OG1 ALA A 41 13.726 -3.869 38.694 1.00 -0.39 O HETATM 1236 H24 ALA A 41 13.738 -4.656 38.162 1.00 0.21 H HETATM 1237 CG2 ALA A 41 11.753 -3.160 37.462 1.00 -0.03 C HETATM 1238 H25 ALA A 41 11.777 -4.085 36.868 1.00 0.03 H HETATM 1239 H26 ALA A 41 12.326 -2.377 36.944 1.00 0.03 H HETATM 1240 H27 ALA A 41 10.711 -2.831 37.585 1.00 0.03 H HETATM 1241 H23 ALA A 41 11.796 -4.205 39.360 1.00 0.06 H HETATM 1242 H22 ALA A 41 11.322 -1.801 39.819 1.00 0.08 H HETATM 1243 H21 ALA A 41 14.127 -1.154 39.067 1.00 0.19 H HETATM 1244 CB ALA A 41 13.453 2.353 38.763 1.00 -0.01 C HETATM 1245 CG ALA A 41 14.217 3.497 38.128 1.00 -0.02 C HETATM 1246 CD ALA A 41 13.894 4.811 38.819 1.00 0.06 C HETATM 1247 NE ALA A 41 12.545 5.216 38.476 1.00 -0.27 N HETATM 1248 CZ ALA A 41 11.611 5.599 39.346 1.00 0.29 C HETATM 1249 NH1 ALA A 41 11.863 5.670 40.645 1.00 -0.28 N HETATM 1250 H17 ALA A 41 11.124 5.969 41.297 1.00 0.26 H HETATM 1251 H18 ALA A 41 12.798 5.426 41.002 1.00 0.26 H HETATM 1252 NH2 ALA A 41 10.406 5.935 38.901 1.00 -0.28 N HETATM 1253 H19 ALA A 41 10.196 5.885 37.894 1.00 0.26 H HETATM 1254 H20 ALA A 41 9.681 6.246 39.563 1.00 0.26 H HETATM 1255 H16 ALA A 41 12.287 5.207 37.479 1.00 0.26 H HETATM 1256 H14 ALA A 41 14.604 5.583 38.489 1.00 0.07 H HETATM 1257 H15 ALA A 41 13.973 4.682 39.908 1.00 0.07 H HETATM 1258 H12 ALA A 41 13.940 3.570 37.066 1.00 0.03 H HETATM 1259 H13 ALA A 41 15.296 3.301 38.212 1.00 0.03 H HETATM 1260 H10 ALA A 41 13.868 2.175 39.766 1.00 0.03 H HETATM 1261 H11 ALA A 41 12.397 2.649 38.850 1.00 0.03 H HETATM 1262 H9 ALA A 41 14.546 0.652 38.053 1.00 0.08 H HETATM 1263 H8 ALA A 41 12.581 2.026 36.329 1.00 0.19 H HETATM 1264 CB ALA A 41 11.805 0.984 34.180 1.00 -0.00 C HETATM 1265 H5 ALA A 41 11.485 1.770 34.880 1.00 0.03 H HETATM 1266 H6 ALA A 41 11.367 0.022 34.485 1.00 0.03 H HETATM 1267 H7 ALA A 41 11.465 1.236 33.165 1.00 0.03 H HETATM 1268 H4 ALA A 41 13.715 1.839 33.862 1.00 0.11 H HETATM 1269 H1 ALA A 41 13.379 0.034 32.330 1.00 0.20 H HETATM 1270 H2 ALA A 41 13.352 -1.066 33.554 1.00 0.20 H HETATM 1271 H3 ALA A 41 14.729 -0.222 33.236 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 162 161 1120 CONECT 181 180 1120 CONECT 280 279 1119 CONECT 305 304 1119 CONECT 361 360 363 1120 CONECT 394 393 1120 CONECT 530 529 1119 CONECT 557 556 1119 CONECT 560 561 568 569 570 CONECT 568 560 CONECT 569 560 CONECT 570 560 CONECT 721 720 1122 CONECT 740 739 1122 CONECT 839 838 1121 CONECT 864 863 1121 CONECT 920 919 922 1122 CONECT 953 952 1122 CONECT 1089 1088 1121 CONECT 1116 1115 1121 CONECT 1119 280 305 530 557 CONECT 1120 162 181 361 394 CONECT 1121 839 864 1089 1116 CONECT 1122 721 740 920 953 CONECT 1159 1160 1269 1270 1271 CONECT 1160 1159 1161 1264 1268 CONECT 1161 1160 1162 1163 CONECT 1162 1161 CONECT 1163 1161 1164 1263 CONECT 1164 1163 1165 1244 1262 CONECT 1165 1164 1166 1167 CONECT 1166 1165 CONECT 1167 1165 1168 1243 CONECT 1168 1167 1169 1234 1242 CONECT 1169 1168 1170 1171 CONECT 1170 1169 CONECT 1171 1169 1172 1233 CONECT 1172 1171 1173 1198 1232 CONECT 1173 1172 1174 1196 1197 CONECT 1174 1173 1175 1194 1195 CONECT 1175 1174 1176 1192 1193 CONECT 1176 1175 1177 1190 1191 CONECT 1177 1176 1178 1182 1186 CONECT 1178 1177 1179 1180 1181 CONECT 1179 1178 CONECT 1180 1178 CONECT 1181 1178 CONECT 1182 1177 1183 1184 1185 CONECT 1183 1182 CONECT 1184 1182 CONECT 1185 1182 CONECT 1186 1177 1187 1188 1189 CONECT 1187 1186 CONECT 1188 1186 CONECT 1189 1186 CONECT 1190 1176 CONECT 1191 1176 CONECT 1192 1175 CONECT 1193 1175 CONECT 1194 1174 CONECT 1195 1174 CONECT 1196 1173 CONECT 1197 1173 CONECT 1198 1172 1199 1200 CONECT 1199 1198 CONECT 1200 1198 1201 1231 CONECT 1201 1200 1202 1219 1230 CONECT 1202 1201 1203 1204 CONECT 1203 1202 CONECT 1204 1202 1205 1218 CONECT 1205 1204 1206 1209 1217 CONECT 1206 1205 1207 1208 CONECT 1207 1206 CONECT 1208 1206 CONECT 1209 1205 1210 1212 1216 CONECT 1210 1209 1211 CONECT 1211 1210 CONECT 1212 1209 1213 1214 1215 CONECT 1213 1212 CONECT 1214 1212 CONECT 1215 1212 CONECT 1216 1209 CONECT 1217 1205 CONECT 1218 1204 CONECT 1219 1201 1220 1228 1229 CONECT 1220 1219 1221 1226 1227 CONECT 1221 1220 1222 1223 CONECT 1222 1221 CONECT 1223 1221 1224 1225 CONECT 1224 1223 CONECT 1225 1223 CONECT 1226 1220 CONECT 1227 1220 CONECT 1228 1219 CONECT 1229 1219 CONECT 1230 1201 CONECT 1231 1200 CONECT 1232 1172 CONECT 1233 1171 CONECT 1234 1168 1235 1237 1241 CONECT 1235 1234 1236 CONECT 1236 1235 CONECT 1237 1234 1238 1239 1240 CONECT 1238 1237 CONECT 1239 1237 CONECT 1240 1237 CONECT 1241 1234 CONECT 1242 1168 CONECT 1243 1167 CONECT 1244 1164 1245 1260 1261 CONECT 1245 1244 1246 1258 1259 CONECT 1246 1245 1247 1256 1257 CONECT 1247 1246 1248 1255 CONECT 1248 1247 1249 1252 CONECT 1249 1248 1250 1251 CONECT 1250 1249 CONECT 1251 1249 CONECT 1252 1248 1253 1254 CONECT 1253 1252 CONECT 1254 1252 CONECT 1255 1247 CONECT 1256 1246 CONECT 1257 1246 CONECT 1258 1245 CONECT 1259 1245 CONECT 1260 1244 CONECT 1261 1244 CONECT 1262 1164 CONECT 1263 1163 CONECT 1264 1160 1265 1266 1267 CONECT 1265 1264 CONECT 1266 1264 CONECT 1267 1264 CONECT 1268 1160 CONECT 1269 1159 CONECT 1270 1159 CONECT 1271 1159 MASTER 0 0 0 0 0 0 0 0 1269 2 141 10 END
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Related entries of code: 5c13
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
5wxg
RCSB PDB
PDBbind
63aa, >5WXG_1|Chain... at 100%
5wxh
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PDBbind
63aa, >5WXH_1|Chains... at 100%
Complexes with the same small molecule ligand
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Ligand Name
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RCSB PDB
PDBbind
10-mer
1jmq
RCSB PDB
PDBbind
10-mer
1pyw
RCSB PDB
PDBbind
10-mer
1vj6
RCSB PDB
PDBbind
10-mer
1vr1
RCSB PDB
PDBbind
10-mer
1y2a
RCSB PDB
PDBbind
10-mer
1ywi
RCSB PDB
PDBbind
10-mer
1yy6
RCSB PDB
PDBbind
10-mer
1zkk
RCSB PDB
PDBbind
10-mer
2a0t
RCSB PDB
PDBbind
10-mer
2aoh
RCSB PDB
PDBbind
10-mer
2aoj
RCSB PDB
PDBbind
10-mer
2axi
RCSB PDB
PDBbind
10-mer
2azm
RCSB PDB
PDBbind
10-mer
2b7f
RCSB PDB
PDBbind
10-mer
2c2l
RCSB PDB
PDBbind
10-mer
2gfa
RCSB PDB
PDBbind
10-mer
2h13
RCSB PDB
PDBbind
10-mer
2hrp
RCSB PDB
PDBbind
10-mer
2ig0
RCSB PDB
PDBbind
10-mer
2jmj
RCSB PDB
PDBbind
10-mer
2jqi
RCSB PDB
PDBbind
10-mer
2jql
RCSB PDB
PDBbind
10-mer
2k2r
RCSB PDB
PDBbind
10-mer
2ke1
RCSB PDB
PDBbind
10-mer
2mnz
RCSB PDB
PDBbind
10-mer
2nxd
RCSB PDB
PDBbind
10-mer
2nxl
RCSB PDB
PDBbind
10-mer
2nxm
RCSB PDB
PDBbind
10-mer
2o9v
RCSB PDB
PDBbind
10-mer
2peh
RCSB PDB
PDBbind
10-mer
2pr9
RCSB PDB
PDBbind
10-mer
2puy
RCSB PDB
PDBbind
10-mer
2qqs
RCSB PDB
PDBbind
10-mer
2r3y
RCSB PDB
PDBbind
10-mer
2r7g
RCSB PDB
PDBbind
10-mer
2rr4
RCSB PDB
PDBbind
10-mer
2v7d
RCSB PDB
PDBbind
10-mer
2vnf
RCSB PDB
PDBbind
10-mer
2w6t
RCSB PDB
PDBbind
10-mer
2w77
RCSB PDB
PDBbind
10-mer
2wa8
RCSB PDB
PDBbind
10-mer
2wp1
RCSB PDB
PDBbind
10-mer
2z5o
RCSB PDB
PDBbind
10-mer
3al3
RCSB PDB
PDBbind
10-mer
3bh8
RCSB PDB
PDBbind
10-mer
3bh9
RCSB PDB
PDBbind
10-mer
3bhb
RCSB PDB
PDBbind
10-mer
3c94
RCSB PDB
PDBbind
10-mer
3d1e
RCSB PDB
PDBbind
10-mer
3diw
RCSB PDB
PDBbind
10-mer
3dnj
RCSB PDB
PDBbind
10-mer
3dpc
RCSB PDB
PDBbind
10-mer
3dvp
RCSB PDB
PDBbind
10-mer
3ebb
RCSB PDB
PDBbind
10-mer
3er5
RCSB PDB
PDBbind
10-mer
3f9w
RCSB PDB
PDBbind
10-mer
3f9y
RCSB PDB
PDBbind
10-mer
3fe7
RCSB PDB
PDBbind
10-mer
3fea
RCSB PDB
PDBbind
10-mer
3gbq
RCSB PDB
PDBbind
10-mer
3gds
RCSB PDB
PDBbind
10-mer
3hg1
RCSB PDB
PDBbind
10-mer
3iqj
RCSB PDB
PDBbind
10-mer
3ivv
RCSB PDB
PDBbind
10-mer
3nkx
RCSB PDB
PDBbind
10-mer
3oq5
RCSB PDB
PDBbind
10-mer
3puj
RCSB PDB
PDBbind
10-mer
3puk
RCSB PDB
PDBbind
10-mer
3pxe
RCSB PDB
PDBbind
10-mer
3q8d
RCSB PDB
PDBbind
10-mer
3qzt
RCSB PDB
PDBbind
10-mer
3rwi
RCSB PDB
PDBbind
10-mer
3shv
RCSB PDB
PDBbind
10-mer
3szm
RCSB PDB
PDBbind
10-mer
3tkz
RCSB PDB
PDBbind
10-mer
3tl0
RCSB PDB
PDBbind
10-mer
3uii
RCSB PDB
PDBbind
10-mer
3uik
RCSB PDB
PDBbind
10-mer
3uvm
RCSB PDB
PDBbind
10-mer
3zmp
RCSB PDB
PDBbind
10-mer
3zmq
RCSB PDB
PDBbind
10-mer
4bg6
RCSB PDB
PDBbind
10-mer
4e34
RCSB PDB
PDBbind
10-mer
4e35
RCSB PDB
PDBbind
10-mer
4e3b
RCSB PDB
PDBbind
10-mer
4e81
RCSB PDB
PDBbind
10-mer
4e9d
RCSB PDB
PDBbind
10-mer
4er4
RCSB PDB
PDBbind
10-mer
4h39
RCSB PDB
PDBbind
10-mer
4h3b
RCSB PDB
PDBbind
10-mer
4hcz
RCSB PDB
PDBbind
10-mer
4i2w
RCSB PDB
PDBbind
10-mer
4i2z
RCSB PDB
PDBbind
10-mer
4jfd
RCSB PDB
PDBbind
10-mer
4jfe
RCSB PDB
PDBbind
10-mer
4jff
RCSB PDB
PDBbind
10-mer
4jjq
RCSB PDB
PDBbind
10-mer
4joe
RCSB PDB
PDBbind
10-mer
4jof
RCSB PDB
PDBbind
10-mer
4jog
RCSB PDB
PDBbind
10-mer
4joh
RCSB PDB
PDBbind
10-mer
4joj
RCSB PDB
PDBbind
10-mer
4jok
RCSB PDB
PDBbind
10-mer
4k6y
RCSB PDB
PDBbind
10-mer
4k72
RCSB PDB
PDBbind
10-mer
4k75
RCSB PDB
PDBbind
10-mer
4k76
RCSB PDB
PDBbind
10-mer
4k78
RCSB PDB
PDBbind
10-mer
4lnp
RCSB PDB
PDBbind
10-mer
4mdr
RCSB PDB
PDBbind
10-mer
4n84
RCSB PDB
PDBbind
10-mer
4nmo
RCSB PDB
PDBbind
10-mer
4nmp
RCSB PDB
PDBbind
10-mer
4nmq
RCSB PDB
PDBbind
10-mer
4nmr
RCSB PDB
PDBbind
10-mer
4nms
RCSB PDB
PDBbind
10-mer
4nmt
RCSB PDB
PDBbind
10-mer
4nmv
RCSB PDB
PDBbind
10-mer
4o2c
RCSB PDB
PDBbind
10-mer
4oz1
RCSB PDB
PDBbind
10-mer
4p0a
RCSB PDB
PDBbind
10-mer
4p0b
RCSB PDB
PDBbind
10-mer
4qok
RCSB PDB
PDBbind
10-mer
4rqz
RCSB PDB
PDBbind
10-mer
4u90
RCSB PDB
PDBbind
10-mer
4v11
RCSB PDB
PDBbind
10-mer
4wj5
RCSB PDB
PDBbind
10-mer
4x1n
RCSB PDB
PDBbind
10-mer
4x1p
RCSB PDB
PDBbind
10-mer
4x1q
RCSB PDB
PDBbind
10-mer
4x1r
RCSB PDB
PDBbind
10-mer
4x1s
RCSB PDB
PDBbind
10-mer
4x34
RCSB PDB
PDBbind
10-mer
4x3s
RCSB PDB
PDBbind
10-mer
4x8n
RCSB PDB
PDBbind
10-mer
4xhv
RCSB PDB
PDBbind
10-mer
4z0u
RCSB PDB
PDBbind
10-mer
4z7i
RCSB PDB
PDBbind
10-mer
4zhl
RCSB PDB
PDBbind
10-mer
4zhm
RCSB PDB
PDBbind
10-mer
5ab0
RCSB PDB
PDBbind
10-mer
5aei
RCSB PDB
PDBbind
10-mer
5azg
RCSB PDB
PDBbind
10-mer
5c0m
RCSB PDB
PDBbind
10-mer
5c11
RCSB PDB
PDBbind
10-mer
5d6y
RCSB PDB
PDBbind
10-mer
5gp7
RCSB PDB
PDBbind
10-mer
5gs4
RCSB PDB
PDBbind
10-mer
5gtr
RCSB PDB
PDBbind
10-mer
5iaw
RCSB PDB
PDBbind
10-mer
5j31
RCSB PDB
PDBbind
10-mer
5jzi
RCSB PDB
PDBbind
10-mer
5myo
RCSB PDB
PDBbind
10-mer
5n1y
RCSB PDB
PDBbind
10-mer
5nx2
RCSB PDB
PDBbind
10-mer
5t6z
RCSB PDB
PDBbind
10-mer
5t70
RCSB PDB
PDBbind
10-mer
5t8r
RCSB PDB
PDBbind
10-mer
5vnb
RCSB PDB
PDBbind
10-mer
5w7i
RCSB PDB
PDBbind
10-mer
5w7j
RCSB PDB
PDBbind
10-mer
5wkf
RCSB PDB
PDBbind
10-mer
5wkh
RCSB PDB
PDBbind
10-mer
6ar2
RCSB PDB
PDBbind
10-mer
6buu
RCSB PDB
PDBbind
10-mer
6fkp
RCSB PDB
PDBbind
10-mer
6mim
RCSB PDB
PDBbind
10-mer
6qtx
RCSB PDB
PDBbind
10-mer
6pek
RCSB PDB
PDBbind
10-mer
6iiw
RCSB PDB
PDBbind
10-mer
6hzx
RCSB PDB
PDBbind
10-mer
6hoi
RCSB PDB
PDBbind
10-mer
6dkp
RCSB PDB
PDBbind
10-mer
6a8n
RCSB PDB
PDBbind
10-mer
5zys
RCSB PDB
PDBbind
10-mer
Entry Information
PDB ID
5c13
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
TAF3 PHD finger
Ligand Name
10-mer
EC.Number
E.C.-.-.-.-
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
Kd=0.79uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Nat Commun Vol. 6, pp: 8911
Ligand Properties
Formula
C
3
2
H
6
2
N
1
0
O
1
0
Molecular Weight
746.896
Exact Mass
746.465
No. of atoms
114
No. of bonds
113
Polar Surface Area
360
LOGP Value
-1.72 (
Computed with XLOGP3
)
-2.05 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 9
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 31
No. of Nitrogen and Oxygen Atoms: 20
No. of Rings: 0
Canonical SMILES
NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCCC(C)(C)C
InChI String
InChI=1S/C32H60N10O10/c1-16(33)25(46)38-20(11-9-15-37-31(35)36)27(48)41-23(17(2)43)29(50)40-19(10-7-8-14-32(4,5)6)26(47)39-21(12-13-22(34)45)28(49)42-24(18(3)44)30(51)52/h16-21,23-24,43-44H,7-15,33H2,1-6H3,(H2,34,45)(H,38,46)(H,39,47)(H,40,50)(H,41,48)(H,42,49)(H,51,52)(H4,35,36,37)/p+2/t16-,17+,18+,19-,20-,21-,23-,24-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q5VWG9
P68431
Entrez Gene ID
NCBI Entrez Gene ID:
83860
8350
8351
8352
8353
8354
8355
8356
8357
8358
8968
ASD
Information of known allosteric effects of PDB entries
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