Browse entries in the PDBbind-CN Database
HEADER 2FGV_COMPLEX COMPND 2FGV_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 99 PRO GLN ILE THR LEU TRP LYS ARG PRO LEU VAL THR ILE SEQRES 2 A 99 ARG ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 A 99 GLY ALA ASP ASP THR VAL LEU GLU GLU MET ASN LEU PRO SEQRES 4 A 99 GLY LYS TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY SEQRES 5 A 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE PRO VAL GLU SEQRES 6 A 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY SEQRES 7 A 99 PRO ASN PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 A 99 GLN ILE GLY CYS THR LEU ASN PHE SEQRES 1 B 99 PRO GLN ILE THR LEU TRP LYS ARG PRO LEU VAL THR ILE SEQRES 2 B 99 ARG ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 B 99 GLY ALA ASP ASP THR VAL LEU GLU GLU MET ASN LEU PRO SEQRES 4 B 99 GLY LYS TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY SEQRES 5 B 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE PRO VAL GLU SEQRES 6 B 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY SEQRES 7 B 99 PRO ASN PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 B 99 GLN ILE GLY CYS THR LEU ASN PHE HET QNC A 392 100 ATOM 1 N PRO A 1 12.652 14.037 0.302 1.00 18.47 N ATOM 2 CA PRO A 1 13.559 14.991 0.925 1.00 18.34 C ATOM 3 C PRO A 1 14.932 14.389 1.184 1.00 17.54 C ATOM 4 O PRO A 1 15.140 13.197 0.956 1.00 16.85 O ATOM 5 CB PRO A 1 12.872 15.279 2.258 1.00 19.12 C ATOM 6 CG PRO A 1 12.254 13.979 2.616 1.00 18.90 C ATOM 7 CD PRO A 1 11.847 13.325 1.312 1.00 19.99 C ATOM 8 HA PRO A 1 13.732 15.867 0.300 1.00 0.00 H ATOM 9 HD3 PRO A 1 12.083 12.261 1.319 1.00 0.00 H ATOM 10 HD2 PRO A 1 10.781 13.458 1.125 1.00 0.00 H ATOM 11 HG3 PRO A 1 11.380 14.138 3.247 1.00 0.00 H ATOM 12 HG2 PRO A 1 12.973 13.352 3.144 1.00 0.00 H ATOM 13 HB2 PRO A 1 13.597 15.587 3.012 1.00 0.00 H ATOM 14 HB3 PRO A 1 12.114 16.054 2.147 1.00 0.00 H ATOM 15 N GLN A 2 15.853 15.231 1.643 1.00 17.32 N ATOM 16 CA GLN A 2 17.152 14.792 2.136 1.00 18.11 C ATOM 17 C GLN A 2 17.133 14.937 3.652 1.00 17.95 C ATOM 18 O GLN A 2 16.799 16.002 4.172 1.00 17.75 O ATOM 19 CB GLN A 2 18.274 15.649 1.547 1.00 18.03 C ATOM 20 CG GLN A 2 19.651 15.347 2.120 1.00 18.71 C ATOM 21 CD GLN A 2 20.763 15.974 1.307 1.00 19.80 C ATOM 22 OE1 GLN A 2 21.325 16.998 1.699 1.00 24.69 O ATOM 23 NE2 GLN A 2 21.072 15.379 0.161 1.00 20.17 N ATOM 24 HA GLN A 2 17.336 13.759 1.842 1.00 0.00 H ATOM 25 HB2 GLN A 2 18.306 15.480 0.471 1.00 0.00 H ATOM 26 HB3 GLN A 2 18.044 16.696 1.742 1.00 0.00 H ATOM 27 HG2 GLN A 2 19.700 15.734 3.138 1.00 0.00 H ATOM 28 HG3 GLN A 2 19.795 14.267 2.136 1.00 0.00 H ATOM 29 HE22 GLN A 2 20.570 14.516 -0.129 1.00 0.00 H ATOM 30 HE21 GLN A 2 21.816 15.776 -0.447 1.00 0.00 H ATOM 31 H GLN A 2 15.637 16.248 1.650 1.00 0.00 H ATOM 32 N ILE A 3 17.493 13.865 4.349 1.00 18.54 N ATOM 33 CA ILE A 3 17.523 13.862 5.809 1.00 18.70 C ATOM 34 C ILE A 3 18.984 13.740 6.230 1.00 18.26 C ATOM 35 O ILE A 3 19.637 12.750 5.905 1.00 17.66 O ATOM 36 CB ILE A 3 16.703 12.686 6.386 1.00 19.30 C ATOM 37 CG1 ILE A 3 15.263 12.692 5.848 1.00 22.19 C ATOM 38 CG2 ILE A 3 16.703 12.729 7.907 1.00 19.81 C ATOM 39 CD1 ILE A 3 14.386 13.772 6.414 1.00 25.02 C ATOM 40 HA ILE A 3 17.078 14.780 6.193 1.00 0.00 H ATOM 41 HB ILE A 3 17.178 11.759 6.063 1.00 0.00 H ATOM 42 HG12 ILE A 3 15.305 12.820 4.766 1.00 0.00 H ATOM 43 HG13 ILE A 3 14.809 11.729 6.081 1.00 0.00 H ATOM 44 HD11 ILE A 3 14.318 13.654 7.495 1.00 0.00 H ATOM 45 HD12 ILE A 3 14.815 14.746 6.180 1.00 0.00 H ATOM 46 HD13 ILE A 3 13.391 13.697 5.976 1.00 0.00 H ATOM 47 HG21 ILE A 3 17.728 12.658 8.271 1.00 0.00 H ATOM 48 HG22 ILE A 3 16.261 13.667 8.243 1.00 0.00 H ATOM 49 HG23 ILE A 3 16.120 11.893 8.293 1.00 0.00 H ATOM 50 H ILE A 3 17.762 13.000 3.838 1.00 0.00 H ATOM 51 N THR A 4 19.518 14.748 6.919 1.00 18.46 N ATOM 52 CA THR A 4 20.898 14.672 7.385 1.00 17.85 C ATOM 53 C THR A 4 20.918 13.880 8.687 1.00 17.40 C ATOM 54 O THR A 4 19.870 13.508 9.223 1.00 17.65 O ATOM 55 CB THR A 4 21.544 16.047 7.624 1.00 18.34 C ATOM 56 OG1 THR A 4 20.804 16.741 8.631 1.00 17.81 O ATOM 57 CG2 THR A 4 21.558 16.862 6.342 1.00 18.33 C ATOM 58 HA THR A 4 21.480 14.188 6.601 1.00 0.00 H ATOM 59 HB THR A 4 22.574 15.905 7.951 1.00 0.00 H ATOM 60 HG1 THR A 4 19.869 16.859 8.329 1.00 0.00 H ATOM 61 HG23 THR A 4 22.124 16.327 5.579 1.00 0.00 H ATOM 62 HG21 THR A 4 20.535 17.014 5.998 1.00 0.00 H ATOM 63 HG22 THR A 4 22.026 17.828 6.532 1.00 0.00 H ATOM 64 H THR A 4 18.948 15.593 7.125 1.00 0.00 H ATOM 65 N LEU A 5 22.120 13.616 9.183 1.00 16.40 N ATOM 66 CA LEU A 5 22.297 12.722 10.319 1.00 16.15 C ATOM 67 C LEU A 5 22.934 13.420 11.521 1.00 16.01 C ATOM 68 O LEU A 5 23.425 12.754 12.428 1.00 15.68 O ATOM 69 CB LEU A 5 23.120 11.501 9.876 1.00 15.65 C ATOM 70 CG LEU A 5 22.476 10.686 8.750 1.00 15.97 C ATOM 71 CD1 LEU A 5 23.435 9.637 8.205 1.00 16.51 C ATOM 72 CD2 LEU A 5 21.165 10.033 9.198 1.00 16.35 C ATOM 73 HA LEU A 5 21.313 12.394 10.653 1.00 0.00 H ATOM 74 HB2 LEU A 5 24.093 11.851 9.532 1.00 0.00 H ATOM 75 HB3 LEU A 5 23.254 10.848 10.738 1.00 0.00 H ATOM 76 HG LEU A 5 22.243 11.386 7.947 1.00 0.00 H ATOM 77 HD21 LEU A 5 21.362 9.364 10.036 1.00 0.00 H ATOM 78 HD22 LEU A 5 20.462 10.807 9.506 1.00 0.00 H ATOM 79 HD23 LEU A 5 20.742 9.465 8.370 1.00 0.00 H ATOM 80 HD11 LEU A 5 24.324 10.129 7.811 1.00 0.00 H ATOM 81 HD12 LEU A 5 23.720 8.956 9.007 1.00 0.00 H ATOM 82 HD13 LEU A 5 22.945 9.078 7.408 1.00 0.00 H ATOM 83 H LEU A 5 22.956 14.058 8.750 1.00 0.00 H ATOM 84 N TRP A 6 22.907 14.753 11.535 1.00 16.12 N ATOM 85 CA TRP A 6 23.355 15.538 12.688 1.00 16.30 C ATOM 86 C TRP A 6 22.572 15.224 13.951 1.00 16.77 C ATOM 87 O TRP A 6 23.125 15.236 15.047 1.00 17.74 O ATOM 88 CB TRP A 6 23.220 17.038 12.403 1.00 17.05 C ATOM 89 CG TRP A 6 24.027 17.452 11.239 1.00 17.86 C ATOM 90 CD1 TRP A 6 23.568 17.853 10.021 1.00 18.89 C ATOM 91 CD2 TRP A 6 25.452 17.474 11.163 1.00 16.77 C ATOM 92 NE1 TRP A 6 24.625 18.138 9.191 1.00 20.22 N ATOM 93 CE2 TRP A 6 25.793 17.911 9.868 1.00 19.83 C ATOM 94 CE3 TRP A 6 26.473 17.178 12.068 1.00 17.92 C ATOM 95 CZ2 TRP A 6 27.116 18.052 9.452 1.00 20.30 C ATOM 96 CZ3 TRP A 6 27.784 17.320 11.653 1.00 18.91 C ATOM 97 CH2 TRP A 6 28.095 17.755 10.361 1.00 19.76 C ATOM 98 HA TRP A 6 24.398 15.267 12.850 1.00 0.00 H ATOM 99 HB2 TRP A 6 22.173 17.267 12.205 1.00 0.00 H ATOM 100 HB3 TRP A 6 23.553 17.595 13.279 1.00 0.00 H ATOM 101 HE1 TRP A 6 24.550 18.472 8.209 1.00 0.00 H ATOM 102 HD1 TRP A 6 22.517 17.936 9.745 1.00 0.00 H ATOM 103 HZ2 TRP A 6 27.361 18.385 8.444 1.00 0.00 H ATOM 104 HH2 TRP A 6 29.141 17.860 10.071 1.00 0.00 H ATOM 105 HZ3 TRP A 6 28.592 17.088 12.347 1.00 0.00 H ATOM 106 HE3 TRP A 6 26.242 16.843 13.079 1.00 0.00 H ATOM 107 H TRP A 6 22.554 15.255 10.695 1.00 0.00 H ATOM 108 N LYS A 7 21.276 14.984 13.775 1.00 16.47 N ATOM 109 CA LYS A 7 20.422 14.479 14.840 1.00 16.04 C ATOM 110 C LYS A 7 19.821 13.154 14.379 1.00 15.48 C ATOM 111 O LYS A 7 19.916 12.791 13.209 1.00 15.51 O ATOM 112 CB LYS A 7 19.309 15.474 15.136 1.00 17.17 C ATOM 113 HA LYS A 7 21.005 14.335 15.749 1.00 0.00 H ATOM 114 HB2 LYS A 7 19.745 16.423 15.447 1.00 0.00 H ATOM 115 HB3 LYS A 7 18.710 15.625 14.238 1.00 0.00 H ATOM 116 H LYS A 7 20.856 15.164 12.841 1.00 0.00 H ATOM 117 N ARG A 8 19.173 12.449 15.297 1.00 15.38 N ATOM 118 CA ARG A 8 18.500 11.209 14.936 1.00 15.43 C ATOM 119 C ARG A 8 17.483 11.523 13.843 1.00 15.39 C ATOM 120 O ARG A 8 16.725 12.487 13.972 1.00 15.51 O ATOM 121 CB ARG A 8 17.803 10.604 16.152 1.00 15.44 C ATOM 122 CG ARG A 8 18.764 10.213 17.262 1.00 15.99 C ATOM 123 CD ARG A 8 18.047 9.582 18.434 1.00 16.84 C ATOM 124 NE ARG A 8 18.949 9.325 19.551 1.00 18.26 N ATOM 125 CZ ARG A 8 18.561 8.858 20.735 1.00 19.70 C ATOM 126 NH1 ARG A 8 17.282 8.584 20.966 1.00 21.89 N ATOM 127 NH2 ARG A 8 19.455 8.656 21.694 1.00 19.09 N ATOM 128 HA ARG A 8 19.227 10.482 14.575 1.00 0.00 H ATOM 129 HB2 ARG A 8 17.097 11.335 16.546 1.00 0.00 H ATOM 130 HB3 ARG A 8 17.261 9.714 15.833 1.00 0.00 H ATOM 131 HG2 ARG A 8 19.488 9.501 16.867 1.00 0.00 H ATOM 132 HG3 ARG A 8 19.286 11.106 17.607 1.00 0.00 H ATOM 133 HD2 ARG A 8 17.608 8.638 18.112 1.00 0.00 H ATOM 134 HD3 ARG A 8 17.256 10.254 18.767 1.00 0.00 H ATOM 135 HE ARG A 8 19.961 9.519 19.413 1.00 0.00 H ATOM 136 HH12 ARG A 8 16.988 8.219 21.894 1.00 0.00 H ATOM 137 HH11 ARG A 8 16.575 8.734 20.218 1.00 0.00 H ATOM 138 HH22 ARG A 8 19.152 8.291 22.619 1.00 0.00 H ATOM 139 HH21 ARG A 8 20.459 8.863 21.521 1.00 0.00 H ATOM 140 H ARG A 8 19.145 12.784 16.281 1.00 0.00 H ATOM 141 N PRO A 9 17.477 10.731 12.758 1.00 15.31 N ATOM 142 CA PRO A 9 16.538 10.942 11.652 1.00 15.22 C ATOM 143 C PRO A 9 15.117 10.503 11.986 1.00 15.42 C ATOM 144 O PRO A 9 14.616 9.493 11.488 1.00 15.25 O ATOM 145 CB PRO A 9 17.148 10.112 10.518 1.00 15.27 C ATOM 146 CG PRO A 9 17.819 8.986 11.230 1.00 15.89 C ATOM 147 CD PRO A 9 18.374 9.590 12.495 1.00 15.06 C ATOM 148 HA PRO A 9 16.423 11.996 11.399 1.00 0.00 H ATOM 149 HD3 PRO A 9 18.343 8.873 13.315 1.00 0.00 H ATOM 150 HD2 PRO A 9 19.400 9.927 12.348 1.00 0.00 H ATOM 151 HG3 PRO A 9 18.622 8.572 10.620 1.00 0.00 H ATOM 152 HG2 PRO A 9 17.101 8.200 11.465 1.00 0.00 H ATOM 153 HB2 PRO A 9 16.374 9.742 9.846 1.00 0.00 H ATOM 154 HB3 PRO A 9 17.870 10.699 9.950 1.00 0.00 H ATOM 155 N LEU A 10 14.486 11.299 12.841 1.00 15.08 N ATOM 156 CA LEU A 10 13.120 11.072 13.287 1.00 15.94 C ATOM 157 C LEU A 10 12.168 11.797 12.349 1.00 16.73 C ATOM 158 O LEU A 10 12.325 12.999 12.102 1.00 17.21 O ATOM 159 CB LEU A 10 12.946 11.607 14.710 1.00 16.76 C ATOM 160 CG LEU A 10 13.718 10.828 15.773 1.00 17.35 C ATOM 161 CD1 LEU A 10 13.753 11.600 17.080 1.00 19.74 C ATOM 162 CD2 LEU A 10 13.124 9.448 15.987 1.00 18.11 C ATOM 163 HA LEU A 10 12.903 10.004 13.280 1.00 0.00 H ATOM 164 HB2 LEU A 10 13.287 12.642 14.730 1.00 0.00 H ATOM 165 HB3 LEU A 10 11.886 11.570 14.962 1.00 0.00 H ATOM 166 HG LEU A 10 14.740 10.700 15.415 1.00 0.00 H ATOM 167 HD21 LEU A 10 12.088 9.546 16.313 1.00 0.00 H ATOM 168 HD22 LEU A 10 13.161 8.889 15.052 1.00 0.00 H ATOM 169 HD23 LEU A 10 13.698 8.921 16.750 1.00 0.00 H ATOM 170 HD11 LEU A 10 14.242 12.561 16.920 1.00 0.00 H ATOM 171 HD12 LEU A 10 12.734 11.764 17.431 1.00 0.00 H ATOM 172 HD13 LEU A 10 14.308 11.028 17.824 1.00 0.00 H ATOM 173 H LEU A 10 14.994 12.127 13.211 1.00 0.00 H ATOM 174 N VAL A 11 11.174 11.068 11.850 1.00 16.64 N ATOM 175 CA VAL A 11 10.186 11.628 10.941 1.00 17.38 C ATOM 176 C VAL A 11 8.797 11.176 11.375 1.00 17.77 C ATOM 177 O VAL A 11 8.655 10.310 12.239 1.00 18.98 O ATOM 178 CB VAL A 11 10.430 11.184 9.481 1.00 17.35 C ATOM 179 CG1 VAL A 11 11.829 11.554 9.021 1.00 17.70 C ATOM 180 CG2 VAL A 11 10.190 9.694 9.300 1.00 17.61 C ATOM 181 HA VAL A 11 10.269 12.714 10.980 1.00 0.00 H ATOM 182 HB VAL A 11 9.711 11.718 8.860 1.00 0.00 H ATOM 183 HG11 VAL A 11 11.956 12.635 9.082 1.00 0.00 H ATOM 184 HG12 VAL A 11 12.562 11.064 9.661 1.00 0.00 H ATOM 185 HG13 VAL A 11 11.969 11.228 7.990 1.00 0.00 H ATOM 186 HG21 VAL A 11 10.868 9.137 9.947 1.00 0.00 H ATOM 187 HG22 VAL A 11 9.159 9.459 9.563 1.00 0.00 H ATOM 188 HG23 VAL A 11 10.372 9.422 8.260 1.00 0.00 H ATOM 189 H VAL A 11 11.101 10.066 12.118 1.00 0.00 H ATOM 190 N THR A 12 7.774 11.764 10.765 1.00 18.62 N ATOM 191 CA THR A 12 6.397 11.424 11.075 1.00 18.62 C ATOM 192 C THR A 12 5.951 10.284 10.173 1.00 18.43 C ATOM 193 O THR A 12 6.221 10.293 8.974 1.00 19.06 O ATOM 194 CB THR A 12 5.475 12.632 10.885 1.00 19.26 C ATOM 195 OG1 THR A 12 5.956 13.708 11.700 1.00 20.46 O ATOM 196 CG2 THR A 12 4.057 12.287 11.285 1.00 19.95 C ATOM 197 HA THR A 12 6.337 11.117 12.119 1.00 0.00 H ATOM 198 HB THR A 12 5.474 12.924 9.835 1.00 0.00 H ATOM 199 HG1 THR A 12 5.954 13.428 12.650 1.00 0.00 H ATOM 200 HG23 THR A 12 3.694 11.468 10.663 1.00 0.00 H ATOM 201 HG21 THR A 12 4.040 11.985 12.332 1.00 0.00 H ATOM 202 HG22 THR A 12 3.419 13.160 11.147 1.00 0.00 H ATOM 203 H THR A 12 7.965 12.489 10.044 1.00 0.00 H ATOM 204 N ILE A 13 5.281 9.300 10.766 1.00 18.31 N ATOM 205 CA ILE A 13 4.673 8.214 10.016 1.00 18.64 C ATOM 206 C ILE A 13 3.189 8.188 10.326 1.00 18.54 C ATOM 207 O ILE A 13 2.757 8.745 11.335 1.00 19.12 O ATOM 208 CB ILE A 13 5.287 6.841 10.357 1.00 18.03 C ATOM 209 CG1 ILE A 13 4.985 6.442 11.803 1.00 19.85 C ATOM 210 CG2 ILE A 13 6.788 6.877 10.110 1.00 19.21 C ATOM 211 CD1 ILE A 13 5.325 5.017 12.120 1.00 19.31 C ATOM 212 HA ILE A 13 4.855 8.394 8.957 1.00 0.00 H ATOM 213 HB ILE A 13 4.837 6.088 9.710 1.00 0.00 H ATOM 214 HG12 ILE A 13 5.560 7.089 12.466 1.00 0.00 H ATOM 215 HG13 ILE A 13 3.921 6.591 11.986 1.00 0.00 H ATOM 216 HD11 ILE A 13 4.749 4.355 11.474 1.00 0.00 H ATOM 217 HD12 ILE A 13 6.390 4.853 11.954 1.00 0.00 H ATOM 218 HD13 ILE A 13 5.083 4.810 13.162 1.00 0.00 H ATOM 219 HG21 ILE A 13 6.977 7.109 9.062 1.00 0.00 H ATOM 220 HG22 ILE A 13 7.240 7.643 10.740 1.00 0.00 H ATOM 221 HG23 ILE A 13 7.218 5.905 10.352 1.00 0.00 H ATOM 222 H ILE A 13 5.189 9.308 11.802 1.00 0.00 H ATOM 223 N ARG A 14 2.425 7.550 9.447 1.00 18.85 N ATOM 224 CA ARG A 14 1.017 7.294 9.697 1.00 19.22 C ATOM 225 C ARG A 14 0.760 5.791 9.684 1.00 18.77 C ATOM 226 O ARG A 14 1.097 5.099 8.720 1.00 17.77 O ATOM 227 CB ARG A 14 0.155 7.994 8.648 1.00 19.18 C ATOM 228 CG ARG A 14 -1.313 8.053 9.019 1.00 20.09 C ATOM 229 CD ARG A 14 -2.150 8.659 7.914 1.00 20.88 C ATOM 230 NE ARG A 14 -2.421 7.666 6.881 1.00 20.31 N ATOM 231 CZ ARG A 14 -2.977 7.938 5.706 1.00 22.17 C ATOM 232 NH1 ARG A 14 -3.329 9.179 5.392 1.00 22.69 N ATOM 233 NH2 ARG A 14 -3.180 6.955 4.839 1.00 23.70 N ATOM 234 HA ARG A 14 0.750 7.691 10.677 1.00 0.00 H ATOM 235 HB2 ARG A 14 0.522 9.013 8.523 1.00 0.00 H ATOM 236 HB3 ARG A 14 0.252 7.456 7.705 1.00 0.00 H ATOM 237 HG2 ARG A 14 -1.668 7.041 9.216 1.00 0.00 H ATOM 238 HG3 ARG A 14 -1.425 8.658 9.919 1.00 0.00 H ATOM 239 HD2 ARG A 14 -1.612 9.498 7.474 1.00 0.00 H ATOM 240 HD3 ARG A 14 -3.094 9.012 8.330 1.00 0.00 H ATOM 241 HE ARG A 14 -2.161 6.678 7.078 1.00 0.00 H ATOM 242 HH12 ARG A 14 -3.764 9.378 4.468 1.00 0.00 H ATOM 243 HH11 ARG A 14 -3.170 9.952 6.070 1.00 0.00 H ATOM 244 HH22 ARG A 14 -3.615 7.157 3.916 1.00 0.00 H ATOM 245 HH21 ARG A 14 -2.904 5.982 5.082 1.00 0.00 H ATOM 246 H ARG A 14 2.847 7.224 8.554 1.00 0.00 H ATOM 247 N ILE A 15 0.172 5.302 10.772 1.00 18.46 N ATOM 248 CA ILE A 15 -0.188 3.898 10.900 1.00 19.09 C ATOM 249 C ILE A 15 -1.538 3.849 11.608 1.00 19.43 C ATOM 250 O ILE A 15 -1.749 4.540 12.603 1.00 20.30 O ATOM 251 CB ILE A 15 0.890 3.088 11.647 1.00 19.38 C ATOM 252 CG1 ILE A 15 0.422 1.643 11.841 1.00 19.96 C ATOM 253 CG2 ILE A 15 1.261 3.736 12.981 1.00 19.90 C ATOM 254 CD1 ILE A 15 1.535 0.681 12.190 1.00 20.69 C ATOM 255 HA ILE A 15 -0.258 3.433 9.917 1.00 0.00 H ATOM 256 HB ILE A 15 1.793 3.081 11.037 1.00 0.00 H ATOM 257 HG12 ILE A 15 -0.313 1.625 12.646 1.00 0.00 H ATOM 258 HG13 ILE A 15 -0.046 1.306 10.916 1.00 0.00 H ATOM 259 HD11 ILE A 15 2.274 0.677 11.389 1.00 0.00 H ATOM 260 HD12 ILE A 15 2.007 0.996 13.121 1.00 0.00 H ATOM 261 HD13 ILE A 15 1.123 -0.321 12.311 1.00 0.00 H ATOM 262 HG21 ILE A 15 1.648 4.739 12.801 1.00 0.00 H ATOM 263 HG22 ILE A 15 0.375 3.795 13.614 1.00 0.00 H ATOM 264 HG23 ILE A 15 2.023 3.135 13.476 1.00 0.00 H ATOM 265 H ILE A 15 -0.038 5.947 11.560 1.00 0.00 H ATOM 266 N GLY A 16 -2.460 3.062 11.070 1.00 19.57 N ATOM 267 CA GLY A 16 -3.843 3.093 11.545 1.00 19.50 C ATOM 268 C GLY A 16 -4.511 4.458 11.464 1.00 19.74 C ATOM 269 O GLY A 16 -5.434 4.749 12.229 1.00 19.90 O ATOM 270 HA3 GLY A 16 -3.852 2.771 12.586 1.00 0.00 H ATOM 271 HA2 GLY A 16 -4.425 2.394 10.945 1.00 0.00 H ATOM 272 H GLY A 16 -2.196 2.414 10.300 1.00 0.00 H ATOM 273 N GLY A 17 -4.056 5.295 10.534 1.00 19.81 N ATOM 274 CA GLY A 17 -4.586 6.647 10.377 1.00 19.65 C ATOM 275 C GLY A 17 -4.063 7.663 11.377 1.00 19.75 C ATOM 276 O GLY A 17 -4.417 8.841 11.306 1.00 19.46 O ATOM 277 HA3 GLY A 17 -5.670 6.599 10.479 1.00 0.00 H ATOM 278 HA2 GLY A 17 -4.332 6.996 9.376 1.00 0.00 H ATOM 279 H GLY A 17 -3.298 4.975 9.898 1.00 0.00 H ATOM 280 N GLN A 18 -3.221 7.218 12.306 1.00 20.04 N ATOM 281 CA GLN A 18 -2.702 8.081 13.363 1.00 20.12 C ATOM 282 C GLN A 18 -1.232 8.384 13.129 1.00 19.87 C ATOM 283 O GLN A 18 -0.511 7.585 12.533 1.00 19.71 O ATOM 284 CB GLN A 18 -2.839 7.396 14.720 1.00 20.54 C ATOM 285 CG GLN A 18 -4.271 7.113 15.124 1.00 21.26 C ATOM 286 CD GLN A 18 -4.388 6.635 16.557 1.00 22.43 C ATOM 287 OE1 GLN A 18 -5.461 6.689 17.153 1.00 26.93 O ATOM 288 NE2 GLN A 18 -3.277 6.165 17.117 1.00 26.86 N ATOM 289 HA GLN A 18 -3.277 9.007 13.351 1.00 0.00 H ATOM 290 HB2 GLN A 18 -2.299 6.450 14.683 1.00 0.00 H ATOM 291 HB3 GLN A 18 -2.390 8.040 15.476 1.00 0.00 H ATOM 292 HG2 GLN A 18 -4.853 8.028 15.012 1.00 0.00 H ATOM 293 HG3 GLN A 18 -4.675 6.344 14.465 1.00 0.00 H ATOM 294 HE22 GLN A 18 -2.391 6.139 16.573 1.00 0.00 H ATOM 295 HE21 GLN A 18 -3.294 5.824 18.099 1.00 0.00 H ATOM 296 H GLN A 18 -2.923 6.222 12.278 1.00 0.00 H ATOM 297 N LEU A 19 -0.799 9.538 13.624 1.00 19.39 N ATOM 298 CA LEU A 19 0.573 9.975 13.421 1.00 18.93 C ATOM 299 C LEU A 19 1.481 9.605 14.589 1.00 18.82 C ATOM 300 O LEU A 19 1.113 9.736 15.755 1.00 19.53 O ATOM 301 CB LEU A 19 0.613 11.484 13.177 1.00 18.99 C ATOM 302 CG LEU A 19 -0.152 11.962 11.941 1.00 18.56 C ATOM 303 CD1 LEU A 19 0.051 13.458 11.766 1.00 19.21 C ATOM 304 CD2 LEU A 19 0.251 11.244 10.662 1.00 20.12 C ATOM 305 HA LEU A 19 0.952 9.453 12.543 1.00 0.00 H ATOM 306 HB2 LEU A 19 0.188 11.979 14.050 1.00 0.00 H ATOM 307 HB3 LEU A 19 1.656 11.781 13.065 1.00 0.00 H ATOM 308 HG LEU A 19 -1.202 11.728 12.114 1.00 0.00 H ATOM 309 HD21 LEU A 19 1.312 11.408 10.473 1.00 0.00 H ATOM 310 HD22 LEU A 19 0.061 10.176 10.771 1.00 0.00 H ATOM 311 HD23 LEU A 19 -0.332 11.635 9.828 1.00 0.00 H ATOM 312 HD11 LEU A 19 -0.321 13.979 12.648 1.00 0.00 H ATOM 313 HD12 LEU A 19 1.113 13.667 11.640 1.00 0.00 H ATOM 314 HD13 LEU A 19 -0.495 13.797 10.885 1.00 0.00 H ATOM 315 H LEU A 19 -1.452 10.139 14.166 1.00 0.00 H ATOM 316 N LYS A 20 2.677 9.136 14.242 1.00 18.26 N ATOM 317 CA LYS A 20 3.702 8.774 15.214 1.00 18.40 C ATOM 318 C LYS A 20 5.046 9.279 14.726 1.00 18.31 C ATOM 319 O LYS A 20 5.210 9.576 13.548 1.00 19.97 O ATOM 320 CB LYS A 20 3.798 7.255 15.344 1.00 18.73 C ATOM 321 CG LYS A 20 2.538 6.601 15.848 1.00 19.43 C ATOM 322 CD LYS A 20 2.717 5.095 15.905 1.00 20.48 C ATOM 323 CE LYS A 20 1.601 4.445 16.685 1.00 21.89 C ATOM 324 NZ LYS A 20 1.906 4.462 18.141 1.00 24.08 N ATOM 325 HA LYS A 20 3.440 9.214 16.176 1.00 0.00 H ATOM 326 HB2 LYS A 20 4.030 6.841 14.363 1.00 0.00 H ATOM 327 HB3 LYS A 20 4.606 7.021 16.036 1.00 0.00 H ATOM 328 HG2 LYS A 20 2.312 6.975 16.846 1.00 0.00 H ATOM 329 HG3 LYS A 20 1.714 6.841 15.176 1.00 0.00 H ATOM 330 HD2 LYS A 20 2.721 4.698 14.890 1.00 0.00 H ATOM 331 HD3 LYS A 20 3.668 4.867 16.386 1.00 0.00 H ATOM 332 HE2 LYS A 20 1.485 3.413 16.354 1.00 0.00 H ATOM 333 HE3 LYS A 20 0.673 4.989 16.506 1.00 0.00 H ATOM 334 HZ1 LYS A 20 2.789 3.941 18.315 1.00 0.00 H ATOM 335 HZ2 LYS A 20 2.014 5.446 18.460 1.00 0.00 H ATOM 336 HZ3 LYS A 20 1.127 4.011 18.662 1.00 0.00 H ATOM 337 H LYS A 20 2.891 9.022 13.231 1.00 0.00 H ATOM 338 N GLU A 21 6.004 9.364 15.641 1.00 16.24 N ATOM 339 CA GLU A 21 7.381 9.701 15.296 1.00 16.43 C ATOM 340 C GLU A 21 8.191 8.417 15.181 1.00 15.40 C ATOM 341 O GLU A 21 8.068 7.540 16.030 1.00 16.28 O ATOM 342 CB GLU A 21 7.969 10.558 16.410 1.00 16.47 C ATOM 343 CG GLU A 21 9.392 10.997 16.195 1.00 17.70 C ATOM 344 CD GLU A 21 9.859 11.950 17.278 1.00 18.81 C ATOM 345 OE1 GLU A 21 10.092 11.488 18.417 1.00 23.49 O ATOM 346 OE2 GLU A 21 10.004 13.158 16.985 1.00 23.26 O ATOM 347 HA GLU A 21 7.408 10.243 14.351 1.00 0.00 H ATOM 348 HB2 GLU A 21 7.352 11.451 16.511 1.00 0.00 H ATOM 349 HB3 GLU A 21 7.929 9.983 17.335 1.00 0.00 H ATOM 350 HG2 GLU A 21 10.036 10.118 16.197 1.00 0.00 H ATOM 351 HG3 GLU A 21 9.465 11.497 15.229 1.00 0.00 H ATOM 352 H GLU A 21 5.765 9.184 16.637 1.00 0.00 H ATOM 353 N ALA A 22 9.025 8.302 14.151 1.00 13.98 N ATOM 354 CA ALA A 22 9.800 7.085 13.947 1.00 14.04 C ATOM 355 C ALA A 22 11.175 7.361 13.363 1.00 13.69 C ATOM 356 O ALA A 22 11.384 8.339 12.640 1.00 13.72 O ATOM 357 CB ALA A 22 9.042 6.120 13.047 1.00 13.78 C ATOM 358 HA ALA A 22 9.947 6.635 14.929 1.00 0.00 H ATOM 359 HB1 ALA A 22 8.090 5.863 13.512 1.00 0.00 H ATOM 360 HB2 ALA A 22 8.860 6.592 12.082 1.00 0.00 H ATOM 361 HB3 ALA A 22 9.635 5.216 12.905 1.00 0.00 H ATOM 362 H ALA A 22 9.125 9.092 13.482 1.00 0.00 H ATOM 363 N LEU A 23 12.095 6.452 13.663 1.00 13.53 N ATOM 364 CA LEU A 23 13.503 6.602 13.314 1.00 13.39 C ATOM 365 C LEU A 23 13.757 5.903 11.982 1.00 13.44 C ATOM 366 O LEU A 23 13.517 4.708 11.866 1.00 13.59 O ATOM 367 CB LEU A 23 14.337 5.928 14.409 1.00 14.18 C ATOM 368 CG LEU A 23 15.860 6.002 14.340 1.00 13.91 C ATOM 369 CD1 LEU A 23 16.332 7.429 14.534 1.00 14.36 C ATOM 370 CD2 LEU A 23 16.452 5.100 15.403 1.00 13.73 C ATOM 371 HA LEU A 23 13.771 7.655 13.229 1.00 0.00 H ATOM 372 HB2 LEU A 23 14.039 6.376 15.357 1.00 0.00 H ATOM 373 HB3 LEU A 23 14.069 4.871 14.408 1.00 0.00 H ATOM 374 HG LEU A 23 16.192 5.668 13.357 1.00 0.00 H ATOM 375 HD21 LEU A 23 16.114 5.428 16.386 1.00 0.00 H ATOM 376 HD22 LEU A 23 16.127 4.074 15.229 1.00 0.00 H ATOM 377 HD23 LEU A 23 17.540 5.151 15.356 1.00 0.00 H ATOM 378 HD11 LEU A 23 15.911 8.059 13.751 1.00 0.00 H ATOM 379 HD12 LEU A 23 16.003 7.790 15.509 1.00 0.00 H ATOM 380 HD13 LEU A 23 17.420 7.461 14.481 1.00 0.00 H ATOM 381 H LEU A 23 11.798 5.594 14.170 1.00 0.00 H ATOM 382 N LEU A 24 14.256 6.618 10.979 1.00 13.29 N ATOM 383 CA LEU A 24 14.639 5.970 9.728 1.00 13.10 C ATOM 384 C LEU A 24 15.950 5.236 9.972 1.00 12.98 C ATOM 385 O LEU A 24 16.964 5.882 10.281 1.00 13.03 O ATOM 386 CB LEU A 24 14.800 6.989 8.602 1.00 13.52 C ATOM 387 CG LEU A 24 13.552 7.819 8.312 1.00 13.28 C ATOM 388 CD1 LEU A 24 13.822 8.788 7.174 1.00 15.05 C ATOM 389 CD2 LEU A 24 12.335 6.949 8.007 1.00 15.30 C ATOM 390 HA LEU A 24 13.859 5.274 9.418 1.00 0.00 H ATOM 391 HB2 LEU A 24 15.606 7.671 8.873 1.00 0.00 H ATOM 392 HB3 LEU A 24 15.070 6.452 7.693 1.00 0.00 H ATOM 393 HG LEU A 24 13.317 8.384 9.214 1.00 0.00 H ATOM 394 HD21 LEU A 24 12.541 6.332 7.133 1.00 0.00 H ATOM 395 HD22 LEU A 24 12.124 6.309 8.864 1.00 0.00 H ATOM 396 HD23 LEU A 24 11.474 7.587 7.808 1.00 0.00 H ATOM 397 HD11 LEU A 24 14.639 9.454 7.452 1.00 0.00 H ATOM 398 HD12 LEU A 24 14.096 8.229 6.279 1.00 0.00 H ATOM 399 HD13 LEU A 24 12.924 9.374 6.977 1.00 0.00 H ATOM 400 H LEU A 24 14.374 7.646 11.086 1.00 0.00 H ATOM 401 N ASP A 25 15.933 3.909 9.833 1.00 13.10 N ATOM 402 CA ASP A 25 16.963 3.061 10.433 1.00 12.78 C ATOM 403 C ASP A 25 17.536 2.080 9.410 1.00 12.47 C ATOM 404 O ASP A 25 17.024 0.982 9.239 1.00 13.13 O ATOM 405 CB ASP A 25 16.326 2.339 11.623 1.00 13.61 C ATOM 406 CG ASP A 25 17.326 1.628 12.492 1.00 15.32 C ATOM 407 OD1 ASP A 25 18.486 1.495 12.061 1.00 14.47 O ATOM 408 OD2 ASP A 25 16.940 1.224 13.612 1.00 16.59 O ATOM 409 HA ASP A 25 17.805 3.664 10.774 1.00 0.00 H ATOM 410 HB2 ASP A 25 15.799 3.073 12.232 1.00 0.00 H ATOM 411 HB3 ASP A 25 15.615 1.606 11.243 1.00 0.00 H ATOM 412 H ASP A 25 15.168 3.467 9.284 1.00 0.00 H ATOM 413 N THR A 26 18.605 2.468 8.724 1.00 12.01 N ATOM 414 CA THR A 26 19.174 1.615 7.687 1.00 12.33 C ATOM 415 C THR A 26 19.832 0.354 8.240 1.00 12.60 C ATOM 416 O THR A 26 20.046 -0.615 7.504 1.00 12.93 O ATOM 417 CB THR A 26 20.187 2.376 6.822 1.00 12.24 C ATOM 418 OG1 THR A 26 21.230 2.908 7.648 1.00 11.37 O ATOM 419 CG2 THR A 26 19.510 3.498 6.078 1.00 12.56 C ATOM 420 HA THR A 26 18.328 1.308 7.072 1.00 0.00 H ATOM 421 HB THR A 26 20.614 1.682 6.098 1.00 0.00 H ATOM 422 HG1 THR A 26 21.690 2.166 8.115 1.00 0.00 H ATOM 423 HG23 THR A 26 18.717 3.090 5.451 1.00 0.00 H ATOM 424 HG21 THR A 26 19.083 4.201 6.793 1.00 0.00 H ATOM 425 HG22 THR A 26 20.241 4.011 5.454 1.00 0.00 H ATOM 426 H THR A 26 19.041 3.390 8.928 1.00 0.00 H ATOM 427 N GLY A 27 20.153 0.352 9.530 1.00 12.67 N ATOM 428 CA GLY A 27 20.717 -0.827 10.183 1.00 12.71 C ATOM 429 C GLY A 27 19.692 -1.805 10.727 1.00 13.00 C ATOM 430 O GLY A 27 20.068 -2.814 11.332 1.00 13.68 O ATOM 431 HA3 GLY A 27 21.339 -0.491 11.013 1.00 0.00 H ATOM 432 HA2 GLY A 27 21.336 -1.353 9.457 1.00 0.00 H ATOM 433 H GLY A 27 19.998 1.214 10.090 1.00 0.00 H ATOM 434 N ALA A 28 18.408 -1.539 10.503 1.00 12.69 N ATOM 435 CA ALA A 28 17.357 -2.458 10.924 1.00 12.47 C ATOM 436 C ALA A 28 16.793 -3.226 9.744 1.00 12.55 C ATOM 437 O ALA A 28 16.314 -2.624 8.789 1.00 12.90 O ATOM 438 CB ALA A 28 16.234 -1.715 11.617 1.00 13.00 C ATOM 439 HA ALA A 28 17.807 -3.163 11.623 1.00 0.00 H ATOM 440 HB1 ALA A 28 16.626 -1.204 12.496 1.00 0.00 H ATOM 441 HB2 ALA A 28 15.806 -0.984 10.931 1.00 0.00 H ATOM 442 HB3 ALA A 28 15.464 -2.424 11.920 1.00 0.00 H ATOM 443 H ALA A 28 18.148 -0.657 10.017 1.00 0.00 H ATOM 444 N ASP A 29 16.832 -4.555 9.823 1.00 12.11 N ATOM 445 CA ASP A 29 16.196 -5.386 8.810 1.00 12.92 C ATOM 446 C ASP A 29 14.689 -5.189 8.806 1.00 13.48 C ATOM 447 O ASP A 29 14.056 -5.219 7.747 1.00 14.13 O ATOM 448 CB ASP A 29 16.424 -6.865 9.108 1.00 12.69 C ATOM 449 CG ASP A 29 17.847 -7.315 8.895 1.00 14.30 C ATOM 450 OD1 ASP A 29 18.675 -6.535 8.392 1.00 14.13 O ATOM 451 OD2 ASP A 29 18.102 -8.489 9.238 1.00 14.61 O ATOM 452 HA ASP A 29 16.632 -5.096 7.854 1.00 0.00 H ATOM 453 HB2 ASP A 29 16.156 -7.052 10.148 1.00 0.00 H ATOM 454 HB3 ASP A 29 15.776 -7.451 8.456 1.00 0.00 H ATOM 455 H ASP A 29 17.324 -5.006 10.620 1.00 0.00 H ATOM 456 N ASP A 30 14.139 -5.012 10.005 1.00 13.31 N ATOM 457 CA ASP A 30 12.702 -5.026 10.251 1.00 12.91 C ATOM 458 C ASP A 30 12.220 -3.671 10.752 1.00 13.07 C ATOM 459 O ASP A 30 13.008 -2.824 11.167 1.00 13.52 O ATOM 460 CB ASP A 30 12.367 -6.078 11.312 1.00 12.82 C ATOM 461 CG ASP A 30 12.848 -7.466 10.935 1.00 15.21 C ATOM 462 OD1 ASP A 30 12.517 -7.946 9.829 1.00 17.24 O ATOM 463 OD2 ASP A 30 13.569 -8.086 11.742 1.00 19.10 O ATOM 464 HA ASP A 30 12.205 -5.260 9.310 1.00 0.00 H ATOM 465 HB2 ASP A 30 12.839 -5.789 12.251 1.00 0.00 H ATOM 466 HB3 ASP A 30 11.285 -6.108 11.444 1.00 0.00 H ATOM 467 H ASP A 30 14.772 -4.854 10.815 1.00 0.00 H ATOM 468 N THR A 31 10.906 -3.482 10.713 1.00 12.91 N ATOM 469 CA THR A 31 10.282 -2.296 11.264 1.00 13.14 C ATOM 470 C THR A 31 9.691 -2.685 12.612 1.00 13.83 C ATOM 471 O THR A 31 8.899 -3.621 12.688 1.00 14.06 O ATOM 472 CB THR A 31 9.208 -1.768 10.303 1.00 13.42 C ATOM 473 OG1 THR A 31 9.855 -1.258 9.136 1.00 12.98 O ATOM 474 CG2 THR A 31 8.377 -0.667 10.937 1.00 13.91 C ATOM 475 HA THR A 31 11.006 -1.492 11.397 1.00 0.00 H ATOM 476 HB THR A 31 8.536 -2.588 10.051 1.00 0.00 H ATOM 477 HG1 THR A 31 10.370 -1.984 8.702 1.00 0.00 H ATOM 478 HG23 THR A 31 7.882 -1.054 11.828 1.00 0.00 H ATOM 479 HG21 THR A 31 9.027 0.164 11.213 1.00 0.00 H ATOM 480 HG22 THR A 31 7.628 -0.323 10.224 1.00 0.00 H ATOM 481 H THR A 31 10.306 -4.208 10.273 1.00 0.00 H ATOM 482 N VAL A 32 10.111 -1.989 13.666 1.00 13.97 N ATOM 483 CA VAL A 32 9.754 -2.356 15.034 1.00 14.68 C ATOM 484 C VAL A 32 9.140 -1.147 15.731 1.00 15.60 C ATOM 485 O VAL A 32 9.778 -0.099 15.874 1.00 15.20 O ATOM 486 CB VAL A 32 10.960 -2.861 15.849 1.00 14.59 C ATOM 487 CG1 VAL A 32 10.479 -3.501 17.140 1.00 16.09 C ATOM 488 CG2 VAL A 32 11.775 -3.858 15.035 1.00 13.18 C ATOM 489 HA VAL A 32 9.039 -3.177 14.977 1.00 0.00 H ATOM 490 HB VAL A 32 11.600 -2.013 16.091 1.00 0.00 H ATOM 491 HG11 VAL A 32 9.930 -2.764 17.727 1.00 0.00 H ATOM 492 HG12 VAL A 32 9.825 -4.341 16.906 1.00 0.00 H ATOM 493 HG13 VAL A 32 11.338 -3.855 17.710 1.00 0.00 H ATOM 494 HG21 VAL A 32 11.146 -4.708 14.769 1.00 0.00 H ATOM 495 HG22 VAL A 32 12.138 -3.374 14.128 1.00 0.00 H ATOM 496 HG23 VAL A 32 12.622 -4.203 15.628 1.00 0.00 H ATOM 497 H VAL A 32 10.714 -1.156 13.510 1.00 0.00 H ATOM 498 N LEU A 33 7.896 -1.308 16.164 1.00 17.07 N ATOM 499 CA LEU A 33 7.132 -0.213 16.745 1.00 17.25 C ATOM 500 C LEU A 33 7.023 -0.367 18.251 1.00 17.81 C ATOM 501 O LEU A 33 7.070 -1.476 18.775 1.00 18.39 O ATOM 502 CB LEU A 33 5.722 -0.185 16.154 1.00 18.08 C ATOM 503 CG LEU A 33 5.667 -0.106 14.629 1.00 19.76 C ATOM 504 CD1 LEU A 33 4.216 -0.130 14.168 1.00 22.18 C ATOM 505 CD2 LEU A 33 6.389 1.125 14.128 1.00 20.04 C ATOM 506 HA LEU A 33 7.654 0.716 16.515 1.00 0.00 H ATOM 507 HB2 LEU A 33 5.206 -1.093 16.465 1.00 0.00 H ATOM 508 HB3 LEU A 33 5.202 0.684 16.558 1.00 0.00 H ATOM 509 HG LEU A 33 6.177 -0.972 14.207 1.00 0.00 H ATOM 510 HD21 LEU A 33 5.918 2.016 14.544 1.00 0.00 H ATOM 511 HD22 LEU A 33 7.432 1.085 14.441 1.00 0.00 H ATOM 512 HD23 LEU A 33 6.336 1.158 13.040 1.00 0.00 H ATOM 513 HD11 LEU A 33 3.746 -1.055 14.500 1.00 0.00 H ATOM 514 HD12 LEU A 33 3.686 0.722 14.595 1.00 0.00 H ATOM 515 HD13 LEU A 33 4.181 -0.074 13.080 1.00 0.00 H ATOM 516 H LEU A 33 7.453 -2.246 16.086 1.00 0.00 H ATOM 517 N GLU A 34 6.873 0.769 18.922 1.00 17.69 N ATOM 518 CA GLU A 34 6.492 0.799 20.331 1.00 18.52 C ATOM 519 C GLU A 34 5.157 0.094 20.529 1.00 18.82 C ATOM 520 O GLU A 34 4.362 -0.026 19.599 1.00 19.40 O ATOM 521 CB GLU A 34 6.373 2.249 20.806 1.00 18.56 C ATOM 522 CG GLU A 34 7.680 3.025 20.786 1.00 20.26 C ATOM 523 CD GLU A 34 7.482 4.513 20.998 1.00 20.94 C ATOM 524 OE1 GLU A 34 6.721 4.888 21.914 1.00 24.09 O ATOM 525 OE2 GLU A 34 8.092 5.303 20.241 1.00 25.19 O ATOM 526 HA GLU A 34 7.259 0.286 20.911 1.00 0.00 H ATOM 527 HB2 GLU A 34 5.661 2.763 20.160 1.00 0.00 H ATOM 528 HB3 GLU A 34 5.995 2.243 21.828 1.00 0.00 H ATOM 529 HG2 GLU A 34 8.325 2.643 21.577 1.00 0.00 H ATOM 530 HG3 GLU A 34 8.162 2.871 19.821 1.00 0.00 H ATOM 531 H GLU A 34 7.033 1.669 18.426 1.00 0.00 H ATOM 532 N GLU A 35 4.906 -0.360 21.751 1.00 19.86 N ATOM 533 CA GLU A 35 3.677 -1.077 22.061 1.00 20.11 C ATOM 534 C GLU A 35 2.456 -0.334 21.533 1.00 20.35 C ATOM 535 O GLU A 35 2.276 0.850 21.819 1.00 20.93 O ATOM 536 CB GLU A 35 3.553 -1.269 23.575 1.00 20.16 C ATOM 537 CG GLU A 35 2.230 -1.861 24.050 1.00 21.10 C ATOM 538 CD GLU A 35 1.893 -3.184 23.387 1.00 22.87 C ATOM 539 OE1 GLU A 35 0.710 -3.405 23.038 1.00 24.97 O ATOM 540 OE2 GLU A 35 2.820 -4.003 23.241 1.00 23.70 O ATOM 541 HA GLU A 35 3.721 -2.050 21.572 1.00 0.00 H ATOM 542 HB2 GLU A 35 4.355 -1.933 23.897 1.00 0.00 H ATOM 543 HB3 GLU A 35 3.677 -0.296 24.050 1.00 0.00 H ATOM 544 HG2 GLU A 35 2.288 -2.018 25.127 1.00 0.00 H ATOM 545 HG3 GLU A 35 1.433 -1.150 23.830 1.00 0.00 H ATOM 546 H GLU A 35 5.604 -0.200 22.505 1.00 0.00 H ATOM 547 N MET A 36 1.643 -1.045 20.757 1.00 20.52 N ATOM 548 CA MET A 36 0.350 -0.552 20.287 1.00 21.79 C ATOM 549 C MET A 36 -0.538 -1.748 19.950 1.00 21.55 C ATOM 550 O MET A 36 -0.064 -2.746 19.414 1.00 21.13 O ATOM 551 CB MET A 36 0.532 0.340 19.063 1.00 22.54 C ATOM 552 CG MET A 36 1.107 -0.369 17.864 1.00 23.80 C ATOM 553 SD MET A 36 1.418 0.779 16.515 1.00 26.18 S ATOM 554 CE MET A 36 -0.253 1.249 16.087 1.00 26.72 C ATOM 555 HA MET A 36 -0.121 0.045 21.068 1.00 0.00 H ATOM 556 HB2 MET A 36 -0.441 0.745 18.787 1.00 0.00 H ATOM 557 HB3 MET A 36 1.202 1.157 19.331 1.00 0.00 H ATOM 558 HG2 MET A 36 0.402 -1.129 17.528 1.00 0.00 H ATOM 559 HG3 MET A 36 2.045 -0.846 18.149 1.00 0.00 H ATOM 560 HE1 MET A 36 -0.813 0.363 15.788 1.00 0.00 H ATOM 561 HE2 MET A 36 -0.732 1.709 16.951 1.00 0.00 H ATOM 562 HE3 MET A 36 -0.229 1.961 15.262 1.00 0.00 H ATOM 563 H MET A 36 1.942 -1.999 20.470 1.00 0.00 H ATOM 564 N ASN A 37 -1.827 -1.654 20.260 1.00 21.71 N ATOM 565 CA ASN A 37 -2.712 -2.814 20.174 1.00 21.85 C ATOM 566 C ASN A 37 -3.451 -2.860 18.837 1.00 21.57 C ATOM 567 O ASN A 37 -4.666 -2.665 18.777 1.00 21.46 O ATOM 568 CB ASN A 37 -3.691 -2.839 21.358 1.00 22.16 C ATOM 569 CG ASN A 37 -4.153 -4.246 21.713 1.00 23.23 C ATOM 570 OD1 ASN A 37 -3.987 -5.193 20.941 1.00 26.77 O ATOM 571 ND2 ASN A 37 -4.742 -4.388 22.896 1.00 28.50 N ATOM 572 HA ASN A 37 -2.094 -3.710 20.228 1.00 0.00 H ATOM 573 HB2 ASN A 37 -3.198 -2.405 22.227 1.00 0.00 H ATOM 574 HB3 ASN A 37 -4.565 -2.240 21.101 1.00 0.00 H ATOM 575 HD22 ASN A 37 -4.863 -3.564 23.519 1.00 0.00 H ATOM 576 HD21 ASN A 37 -5.082 -5.323 23.199 1.00 0.00 H ATOM 577 H ASN A 37 -2.213 -0.739 20.569 1.00 0.00 H ATOM 578 N LEU A 38 -2.705 -3.132 17.769 1.00 20.96 N ATOM 579 CA LEU A 38 -3.293 -3.237 16.437 1.00 21.03 C ATOM 580 C LEU A 38 -4.269 -4.407 16.385 1.00 20.42 C ATOM 581 O LEU A 38 -4.018 -5.449 16.995 1.00 19.86 O ATOM 582 CB LEU A 38 -2.219 -3.453 15.371 1.00 21.34 C ATOM 583 CG LEU A 38 -1.270 -2.287 15.101 1.00 22.58 C ATOM 584 CD1 LEU A 38 -0.069 -2.767 14.302 1.00 22.36 C ATOM 585 CD2 LEU A 38 -1.999 -1.166 14.383 1.00 25.07 C ATOM 586 HA LEU A 38 -3.813 -2.301 16.235 1.00 0.00 H ATOM 587 HB2 LEU A 38 -1.614 -4.306 15.680 1.00 0.00 H ATOM 588 HB3 LEU A 38 -2.726 -3.689 14.435 1.00 0.00 H ATOM 589 HG LEU A 38 -0.910 -1.893 16.051 1.00 0.00 H ATOM 590 HD21 LEU A 38 -2.387 -1.536 13.434 1.00 0.00 H ATOM 591 HD22 LEU A 38 -2.825 -0.816 15.002 1.00 0.00 H ATOM 592 HD23 LEU A 38 -1.307 -0.344 14.199 1.00 0.00 H ATOM 593 HD11 LEU A 38 0.458 -3.535 14.867 1.00 0.00 H ATOM 594 HD12 LEU A 38 -0.408 -3.181 13.352 1.00 0.00 H ATOM 595 HD13 LEU A 38 0.601 -1.927 14.115 1.00 0.00 H ATOM 596 H LEU A 38 -1.681 -3.273 17.886 1.00 0.00 H ATOM 597 N PRO A 39 -5.391 -4.240 15.667 1.00 20.13 N ATOM 598 CA PRO A 39 -6.322 -5.348 15.492 1.00 20.41 C ATOM 599 C PRO A 39 -5.767 -6.475 14.628 1.00 20.59 C ATOM 600 O PRO A 39 -4.853 -6.266 13.832 1.00 20.72 O ATOM 601 CB PRO A 39 -7.509 -4.707 14.773 1.00 20.39 C ATOM 602 CG PRO A 39 -6.965 -3.487 14.124 1.00 20.30 C ATOM 603 CD PRO A 39 -5.854 -3.011 14.997 1.00 20.17 C ATOM 604 HA PRO A 39 -6.559 -5.808 16.451 1.00 0.00 H ATOM 605 HD3 PRO A 39 -5.055 -2.566 14.404 1.00 0.00 H ATOM 606 HD2 PRO A 39 -6.214 -2.283 15.724 1.00 0.00 H ATOM 607 HG3 PRO A 39 -7.739 -2.723 14.046 1.00 0.00 H ATOM 608 HG2 PRO A 39 -6.589 -3.724 13.129 1.00 0.00 H ATOM 609 HB2 PRO A 39 -7.915 -5.388 14.025 1.00 0.00 H ATOM 610 HB3 PRO A 39 -8.290 -4.444 15.486 1.00 0.00 H ATOM 611 N GLY A 40 -6.338 -7.662 14.794 1.00 20.69 N ATOM 612 CA GLY A 40 -6.107 -8.756 13.861 1.00 20.43 C ATOM 613 C GLY A 40 -5.100 -9.757 14.381 1.00 20.67 C ATOM 614 O GLY A 40 -4.616 -9.657 15.511 1.00 21.19 O ATOM 615 HA3 GLY A 40 -5.737 -8.343 12.922 1.00 0.00 H ATOM 616 HA2 GLY A 40 -7.052 -9.270 13.684 1.00 0.00 H ATOM 617 H GLY A 40 -6.965 -7.814 15.610 1.00 0.00 H ATOM 618 N LYS A 41 -4.786 -10.729 13.537 1.00 20.11 N ATOM 619 CA LYS A 41 -3.898 -11.806 13.929 1.00 19.60 C ATOM 620 C LYS A 41 -2.458 -11.318 13.919 1.00 18.62 C ATOM 621 O LYS A 41 -2.095 -10.404 13.177 1.00 18.18 O ATOM 622 CB LYS A 41 -4.072 -13.012 13.007 1.00 19.75 C ATOM 623 CG LYS A 41 -5.489 -13.553 13.011 1.00 21.72 C ATOM 624 CD LYS A 41 -5.577 -14.941 12.408 1.00 22.05 C ATOM 625 CE LYS A 41 -5.323 -14.926 10.912 1.00 23.87 C ATOM 626 NZ LYS A 41 -5.906 -16.136 10.279 1.00 24.94 N ATOM 627 HA LYS A 41 -4.152 -12.122 14.941 1.00 0.00 H ATOM 628 HB2 LYS A 41 -3.815 -12.714 11.990 1.00 0.00 H ATOM 629 HB3 LYS A 41 -3.396 -13.802 13.334 1.00 0.00 H ATOM 630 HG2 LYS A 41 -5.846 -13.594 14.040 1.00 0.00 H ATOM 631 HG3 LYS A 41 -6.123 -12.879 12.435 1.00 0.00 H ATOM 632 HD2 LYS A 41 -4.834 -15.580 12.885 1.00 0.00 H ATOM 633 HD3 LYS A 41 -6.573 -15.343 12.592 1.00 0.00 H ATOM 634 HE2 LYS A 41 -4.249 -14.906 10.729 1.00 0.00 H ATOM 635 HE3 LYS A 41 -5.780 -14.037 10.478 1.00 0.00 H ATOM 636 HZ1 LYS A 41 -5.469 -16.986 10.690 1.00 0.00 H ATOM 637 HZ2 LYS A 41 -6.932 -16.155 10.450 1.00 0.00 H ATOM 638 HZ3 LYS A 41 -5.724 -16.112 9.255 1.00 0.00 H ATOM 639 H LYS A 41 -5.184 -10.719 12.576 1.00 0.00 H ATOM 640 N TRP A 42 -1.657 -11.939 14.775 1.00 17.84 N ATOM 641 CA TRP A 42 -0.225 -11.690 14.824 1.00 17.85 C ATOM 642 C TRP A 42 0.457 -12.998 15.184 1.00 17.49 C ATOM 643 O TRP A 42 -0.193 -13.930 15.661 1.00 16.33 O ATOM 644 CB TRP A 42 0.105 -10.614 15.861 1.00 18.82 C ATOM 645 CG TRP A 42 -0.409 -10.907 17.240 1.00 19.01 C ATOM 646 CD1 TRP A 42 -1.648 -10.610 17.731 1.00 19.96 C ATOM 647 CD2 TRP A 42 0.301 -11.549 18.306 1.00 19.29 C ATOM 648 NE1 TRP A 42 -1.754 -11.029 19.035 1.00 20.45 N ATOM 649 CE2 TRP A 42 -0.574 -11.612 19.412 1.00 20.31 C ATOM 650 CE3 TRP A 42 1.587 -12.082 18.435 1.00 19.69 C ATOM 651 CZ2 TRP A 42 -0.201 -12.180 20.629 1.00 20.40 C ATOM 652 CZ3 TRP A 42 1.956 -12.645 19.642 1.00 20.08 C ATOM 653 CH2 TRP A 42 1.065 -12.690 20.724 1.00 19.80 C ATOM 654 HA TRP A 42 0.126 -11.328 13.857 1.00 0.00 H ATOM 655 HB2 TRP A 42 1.189 -10.512 15.915 1.00 0.00 H ATOM 656 HB3 TRP A 42 -0.331 -9.672 15.527 1.00 0.00 H ATOM 657 HE1 TRP A 42 -2.594 -10.921 19.638 1.00 0.00 H ATOM 658 HD1 TRP A 42 -2.439 -10.112 17.169 1.00 0.00 H ATOM 659 HZ2 TRP A 42 -0.891 -12.216 21.472 1.00 0.00 H ATOM 660 HH2 TRP A 42 1.388 -13.142 21.662 1.00 0.00 H ATOM 661 HZ3 TRP A 42 2.957 -13.061 19.755 1.00 0.00 H ATOM 662 HE3 TRP A 42 2.286 -12.054 17.599 1.00 0.00 H ATOM 663 H TRP A 42 -2.068 -12.629 15.435 1.00 0.00 H ATOM 664 N LYS A 43 1.765 -13.057 14.952 1.00 16.47 N ATOM 665 CA LYS A 43 2.576 -14.216 15.320 1.00 17.04 C ATOM 666 C LYS A 43 3.719 -13.779 16.224 1.00 16.96 C ATOM 667 O LYS A 43 4.280 -12.700 16.022 1.00 16.63 O ATOM 668 CB LYS A 43 3.148 -14.868 14.079 1.00 17.88 C ATOM 669 HA LYS A 43 1.944 -14.931 15.846 1.00 0.00 H ATOM 670 HB2 LYS A 43 2.333 -15.193 13.432 1.00 0.00 H ATOM 671 HB3 LYS A 43 3.772 -14.149 13.547 1.00 0.00 H ATOM 672 H LYS A 43 2.228 -12.248 14.491 1.00 0.00 H ATOM 673 N PRO A 44 4.072 -14.608 17.221 1.00 16.09 N ATOM 674 CA PRO A 44 5.294 -14.321 17.963 1.00 15.89 C ATOM 675 C PRO A 44 6.545 -14.428 17.106 1.00 15.68 C ATOM 676 O PRO A 44 6.642 -15.283 16.224 1.00 15.54 O ATOM 677 CB PRO A 44 5.333 -15.401 19.051 1.00 16.49 C ATOM 678 CG PRO A 44 3.997 -16.013 19.081 1.00 17.39 C ATOM 679 CD PRO A 44 3.383 -15.806 17.734 1.00 17.12 C ATOM 680 HA PRO A 44 5.283 -13.300 18.345 1.00 0.00 H ATOM 681 HD3 PRO A 44 3.562 -16.665 17.088 1.00 0.00 H ATOM 682 HD2 PRO A 44 2.310 -15.633 17.817 1.00 0.00 H ATOM 683 HG3 PRO A 44 3.385 -15.537 19.847 1.00 0.00 H ATOM 684 HG2 PRO A 44 4.079 -17.079 19.294 1.00 0.00 H ATOM 685 HB2 PRO A 44 6.086 -16.152 18.810 1.00 0.00 H ATOM 686 HB3 PRO A 44 5.564 -14.954 20.018 1.00 0.00 H ATOM 687 N LYS A 45 7.501 -13.552 17.386 1.00 14.89 N ATOM 688 CA LYS A 45 8.787 -13.570 16.709 1.00 14.81 C ATOM 689 C LYS A 45 9.823 -13.113 17.725 1.00 14.53 C ATOM 690 O LYS A 45 9.501 -12.369 18.649 1.00 15.54 O ATOM 691 CB LYS A 45 8.759 -12.606 15.524 1.00 15.23 C ATOM 692 CG LYS A 45 9.974 -12.650 14.611 1.00 15.29 C ATOM 693 CD LYS A 45 9.830 -11.631 13.488 1.00 16.12 C ATOM 694 CE LYS A 45 11.065 -11.595 12.618 1.00 17.41 C ATOM 695 NZ LYS A 45 10.988 -12.621 11.552 1.00 20.10 N ATOM 696 HA LYS A 45 9.021 -14.565 16.331 1.00 0.00 H ATOM 697 HB2 LYS A 45 7.880 -12.838 14.923 1.00 0.00 H ATOM 698 HB3 LYS A 45 8.672 -11.593 15.917 1.00 0.00 H ATOM 699 HG2 LYS A 45 10.868 -12.422 15.191 1.00 0.00 H ATOM 700 HG3 LYS A 45 10.065 -13.648 14.182 1.00 0.00 H ATOM 701 HD2 LYS A 45 8.970 -11.898 12.874 1.00 0.00 H ATOM 702 HD3 LYS A 45 9.672 -10.644 13.922 1.00 0.00 H ATOM 703 HE2 LYS A 45 11.943 -11.786 13.235 1.00 0.00 H ATOM 704 HE3 LYS A 45 11.151 -10.610 12.160 1.00 0.00 H ATOM 705 HZ1 LYS A 45 10.909 -13.563 11.985 1.00 0.00 H ATOM 706 HZ2 LYS A 45 10.154 -12.440 10.958 1.00 0.00 H ATOM 707 HZ3 LYS A 45 11.847 -12.577 10.968 1.00 0.00 H ATOM 708 H LYS A 45 7.325 -12.829 18.113 1.00 0.00 H ATOM 709 N MET A 46 11.054 -13.587 17.552 1.00 14.44 N ATOM 710 CA MET A 46 12.213 -13.090 18.288 1.00 14.46 C ATOM 711 C MET A 46 13.086 -12.267 17.349 1.00 14.23 C ATOM 712 O MET A 46 13.385 -12.702 16.236 1.00 14.32 O ATOM 713 CB MET A 46 13.049 -14.256 18.822 1.00 14.52 C ATOM 714 CG MET A 46 12.346 -15.122 19.843 1.00 15.55 C ATOM 715 SD MET A 46 11.920 -14.217 21.335 1.00 18.20 S ATOM 716 CE MET A 46 13.504 -14.076 22.153 1.00 19.51 C ATOM 717 HA MET A 46 11.861 -12.483 19.122 1.00 0.00 H ATOM 718 HB2 MET A 46 13.331 -14.886 17.979 1.00 0.00 H ATOM 719 HB3 MET A 46 13.947 -13.846 19.284 1.00 0.00 H ATOM 720 HG2 MET A 46 13.002 -15.950 20.111 1.00 0.00 H ATOM 721 HG3 MET A 46 11.431 -15.515 19.399 1.00 0.00 H ATOM 722 HE1 MET A 46 13.897 -15.072 22.356 1.00 0.00 H ATOM 723 HE2 MET A 46 14.197 -13.535 21.509 1.00 0.00 H ATOM 724 HE3 MET A 46 13.380 -13.535 23.091 1.00 0.00 H ATOM 725 H MET A 46 11.198 -14.349 16.859 1.00 0.00 H ATOM 726 N ILE A 47 13.484 -11.078 17.793 1.00 13.97 N ATOM 727 CA ILE A 47 14.428 -10.268 17.028 1.00 14.71 C ATOM 728 C ILE A 47 15.531 -9.791 17.957 1.00 14.42 C ATOM 729 O ILE A 47 15.344 -9.654 19.162 1.00 14.76 O ATOM 730 CB ILE A 47 13.764 -9.059 16.346 1.00 15.34 C ATOM 731 CG1 ILE A 47 13.076 -8.160 17.376 1.00 16.61 C ATOM 732 CG2 ILE A 47 12.803 -9.535 15.280 1.00 16.95 C ATOM 733 CD1 ILE A 47 12.678 -6.805 16.845 1.00 16.69 C ATOM 734 HA ILE A 47 14.832 -10.894 16.233 1.00 0.00 H ATOM 735 HB ILE A 47 14.532 -8.456 15.863 1.00 0.00 H ATOM 736 HG12 ILE A 47 12.178 -8.667 17.727 1.00 0.00 H ATOM 737 HG13 ILE A 47 13.759 -8.013 18.212 1.00 0.00 H ATOM 738 HD11 ILE A 47 13.566 -6.276 16.500 1.00 0.00 H ATOM 739 HD12 ILE A 47 11.983 -6.931 16.015 1.00 0.00 H ATOM 740 HD13 ILE A 47 12.198 -6.232 17.638 1.00 0.00 H ATOM 741 HG21 ILE A 47 13.347 -10.115 14.535 1.00 0.00 H ATOM 742 HG22 ILE A 47 12.034 -10.158 15.737 1.00 0.00 H ATOM 743 HG23 ILE A 47 12.337 -8.673 14.802 1.00 0.00 H ATOM 744 H ILE A 47 13.118 -10.720 18.698 1.00 0.00 H ATOM 745 N GLY A 48 16.697 -9.545 17.383 1.00 14.75 N ATOM 746 CA GLY A 48 17.844 -9.196 18.189 1.00 15.01 C ATOM 747 C GLY A 48 18.570 -7.985 17.662 1.00 15.53 C ATOM 748 O GLY A 48 18.368 -7.542 16.530 1.00 16.34 O ATOM 749 HA3 GLY A 48 18.534 -10.040 18.201 1.00 0.00 H ATOM 750 HA2 GLY A 48 17.508 -8.988 19.205 1.00 0.00 H ATOM 751 H GLY A 48 16.788 -9.603 16.349 1.00 0.00 H ATOM 752 N GLY A 49 19.416 -7.460 18.533 1.00 15.94 N ATOM 753 CA GLY A 49 20.325 -6.393 18.160 1.00 15.49 C ATOM 754 C GLY A 49 21.311 -6.310 19.299 1.00 15.29 C ATOM 755 O GLY A 49 21.573 -7.310 19.962 1.00 14.96 O ATOM 756 HA3 GLY A 49 19.787 -5.452 18.048 1.00 0.00 H ATOM 757 HA2 GLY A 49 20.835 -6.632 17.227 1.00 0.00 H ATOM 758 H GLY A 49 19.430 -7.821 19.508 1.00 0.00 H ATOM 759 N ILE A 50 21.858 -5.129 19.550 1.00 15.20 N ATOM 760 CA ILE A 50 22.817 -5.038 20.640 1.00 15.20 C ATOM 761 C ILE A 50 22.006 -5.254 21.914 1.00 15.19 C ATOM 762 O ILE A 50 20.866 -4.798 22.026 1.00 15.24 O ATOM 763 CB ILE A 50 23.654 -3.736 20.657 1.00 15.68 C ATOM 764 CG1 ILE A 50 23.062 -2.684 21.592 1.00 16.53 C ATOM 765 CG2 ILE A 50 23.895 -3.193 19.252 1.00 16.18 C ATOM 766 CD1 ILE A 50 23.859 -2.487 22.846 1.00 16.67 C ATOM 767 HA ILE A 50 23.591 -5.797 20.525 1.00 0.00 H ATOM 768 HB ILE A 50 24.632 -3.995 21.063 1.00 0.00 H ATOM 769 HG12 ILE A 50 23.015 -1.734 21.059 1.00 0.00 H ATOM 770 HG13 ILE A 50 22.054 -2.994 21.868 1.00 0.00 H ATOM 771 HD11 ILE A 50 23.906 -3.427 23.397 1.00 0.00 H ATOM 772 HD12 ILE A 50 24.868 -2.166 22.587 1.00 0.00 H ATOM 773 HD13 ILE A 50 23.381 -1.726 23.463 1.00 0.00 H ATOM 774 HG21 ILE A 50 24.433 -3.936 18.664 1.00 0.00 H ATOM 775 HG22 ILE A 50 22.937 -2.977 18.778 1.00 0.00 H ATOM 776 HG23 ILE A 50 24.486 -2.279 19.313 1.00 0.00 H ATOM 777 H ILE A 50 21.609 -4.292 18.985 1.00 0.00 H ATOM 778 N GLY A 51 22.584 -5.999 22.844 1.00 14.85 N ATOM 779 CA GLY A 51 21.930 -6.309 24.109 1.00 14.19 C ATOM 780 C GLY A 51 21.140 -7.599 24.144 1.00 13.86 C ATOM 781 O GLY A 51 20.759 -8.040 25.223 1.00 14.19 O ATOM 782 HA3 GLY A 51 21.247 -5.492 24.342 1.00 0.00 H ATOM 783 HA2 GLY A 51 22.700 -6.367 24.878 1.00 0.00 H ATOM 784 H GLY A 51 23.537 -6.376 22.666 1.00 0.00 H ATOM 785 N GLY A 52 20.889 -8.207 22.988 1.00 12.89 N ATOM 786 CA GLY A 52 20.235 -9.512 22.935 1.00 13.40 C ATOM 787 C GLY A 52 18.936 -9.537 22.153 1.00 13.65 C ATOM 788 O GLY A 52 18.685 -8.668 21.319 1.00 13.33 O ATOM 789 HA3 GLY A 52 20.023 -9.828 23.956 1.00 0.00 H ATOM 790 HA2 GLY A 52 20.924 -10.219 22.473 1.00 0.00 H ATOM 791 H GLY A 52 21.165 -7.742 22.100 1.00 0.00 H ATOM 792 N PHE A 53 18.121 -10.551 22.429 1.00 13.35 N ATOM 793 CA PHE A 53 16.869 -10.768 21.728 1.00 13.91 C ATOM 794 C PHE A 53 15.681 -10.352 22.580 1.00 14.30 C ATOM 795 O PHE A 53 15.720 -10.442 23.809 1.00 15.35 O ATOM 796 CB PHE A 53 16.733 -12.240 21.330 1.00 13.69 C ATOM 797 CG PHE A 53 17.473 -12.593 20.070 1.00 12.10 C ATOM 798 CD1 PHE A 53 18.840 -12.784 20.083 1.00 12.73 C ATOM 799 CD2 PHE A 53 16.803 -12.700 18.865 1.00 12.62 C ATOM 800 CE1 PHE A 53 19.522 -13.094 18.929 1.00 12.55 C ATOM 801 CE2 PHE A 53 17.484 -13.014 17.704 1.00 12.40 C ATOM 802 CZ PHE A 53 18.844 -13.203 17.736 1.00 13.90 C ATOM 803 HA PHE A 53 16.878 -10.151 20.830 1.00 0.00 H ATOM 804 HB2 PHE A 53 17.122 -12.854 22.142 1.00 0.00 H ATOM 805 HB3 PHE A 53 15.676 -12.461 21.183 1.00 0.00 H ATOM 806 HD2 PHE A 53 15.726 -12.535 18.830 1.00 0.00 H ATOM 807 HE2 PHE A 53 16.942 -13.112 16.763 1.00 0.00 H ATOM 808 HZ PHE A 53 19.385 -13.439 16.819 1.00 0.00 H ATOM 809 HE1 PHE A 53 20.600 -13.253 18.959 1.00 0.00 H ATOM 810 HD1 PHE A 53 19.387 -12.688 21.021 1.00 0.00 H ATOM 811 H PHE A 53 18.393 -11.217 23.180 1.00 0.00 H ATOM 812 N ILE A 54 14.635 -9.894 21.898 1.00 14.52 N ATOM 813 CA ILE A 54 13.367 -9.560 22.519 1.00 14.36 C ATOM 814 C ILE A 54 12.234 -10.251 21.771 1.00 13.87 C ATOM 815 O ILE A 54 12.347 -10.579 20.588 1.00 14.86 O ATOM 816 CB ILE A 54 13.113 -8.041 22.547 1.00 14.60 C ATOM 817 CG1 ILE A 54 13.180 -7.419 21.149 1.00 15.12 C ATOM 818 CG2 ILE A 54 14.122 -7.377 23.455 1.00 13.98 C ATOM 819 CD1 ILE A 54 12.481 -6.075 21.046 1.00 16.08 C ATOM 820 HA ILE A 54 13.407 -9.907 23.552 1.00 0.00 H ATOM 821 HB ILE A 54 12.104 -7.879 22.927 1.00 0.00 H ATOM 822 HG12 ILE A 54 14.228 -7.284 20.882 1.00 0.00 H ATOM 823 HG13 ILE A 54 12.712 -8.106 20.443 1.00 0.00 H ATOM 824 HD11 ILE A 54 11.428 -6.194 21.299 1.00 0.00 H ATOM 825 HD12 ILE A 54 12.945 -5.372 21.738 1.00 0.00 H ATOM 826 HD13 ILE A 54 12.571 -5.697 20.027 1.00 0.00 H ATOM 827 HG21 ILE A 54 14.023 -7.781 24.463 1.00 0.00 H ATOM 828 HG22 ILE A 54 15.128 -7.571 23.082 1.00 0.00 H ATOM 829 HG23 ILE A 54 13.941 -6.302 23.473 1.00 0.00 H ATOM 830 H ILE A 54 14.731 -9.769 20.870 1.00 0.00 H ATOM 831 N LYS A 55 11.140 -10.465 22.491 1.00 13.37 N ATOM 832 CA LYS A 55 9.924 -11.029 21.925 1.00 14.34 C ATOM 833 C LYS A 55 9.045 -9.912 21.395 1.00 13.96 C ATOM 834 O LYS A 55 8.789 -8.931 22.097 1.00 14.76 O ATOM 835 CB LYS A 55 9.139 -11.768 23.009 1.00 14.57 C ATOM 836 CG LYS A 55 9.860 -12.918 23.656 1.00 17.17 C ATOM 837 CD LYS A 55 9.025 -13.526 24.768 1.00 17.54 C ATOM 838 CE LYS A 55 9.727 -14.691 25.442 1.00 19.73 C ATOM 839 NZ LYS A 55 11.100 -14.342 25.902 1.00 20.18 N ATOM 840 HA LYS A 55 10.199 -11.715 21.124 1.00 0.00 H ATOM 841 HB2 LYS A 55 8.883 -11.050 23.788 1.00 0.00 H ATOM 842 HB3 LYS A 55 8.225 -12.154 22.558 1.00 0.00 H ATOM 843 HG2 LYS A 55 10.063 -13.681 22.904 1.00 0.00 H ATOM 844 HG3 LYS A 55 10.802 -12.560 24.072 1.00 0.00 H ATOM 845 HD2 LYS A 55 8.822 -12.758 25.515 1.00 0.00 H ATOM 846 HD3 LYS A 55 8.084 -13.879 24.347 1.00 0.00 H ATOM 847 HE2 LYS A 55 9.795 -15.516 24.733 1.00 0.00 H ATOM 848 HE3 LYS A 55 9.138 -15.003 26.305 1.00 0.00 H ATOM 849 HZ1 LYS A 55 11.674 -14.051 25.085 1.00 0.00 H ATOM 850 HZ2 LYS A 55 11.047 -13.561 26.586 1.00 0.00 H ATOM 851 HZ3 LYS A 55 11.534 -15.172 26.354 1.00 0.00 H ATOM 852 H LYS A 55 11.152 -10.219 23.502 1.00 0.00 H ATOM 853 N VAL A 56 8.559 -10.090 20.172 1.00 13.40 N ATOM 854 CA VAL A 56 7.720 -9.097 19.529 1.00 13.97 C ATOM 855 C VAL A 56 6.530 -9.766 18.863 1.00 14.01 C ATOM 856 O VAL A 56 6.528 -10.974 18.637 1.00 15.17 O ATOM 857 CB VAL A 56 8.493 -8.298 18.462 1.00 13.62 C ATOM 858 CG1 VAL A 56 9.650 -7.556 19.111 1.00 13.98 C ATOM 859 CG2 VAL A 56 9.012 -9.206 17.358 1.00 14.53 C ATOM 860 HA VAL A 56 7.384 -8.411 20.307 1.00 0.00 H ATOM 861 HB VAL A 56 7.806 -7.581 18.012 1.00 0.00 H ATOM 862 HG11 VAL A 56 9.263 -6.870 19.865 1.00 0.00 H ATOM 863 HG12 VAL A 56 10.322 -8.274 19.581 1.00 0.00 H ATOM 864 HG13 VAL A 56 10.192 -6.994 18.350 1.00 0.00 H ATOM 865 HG21 VAL A 56 9.682 -9.951 17.787 1.00 0.00 H ATOM 866 HG22 VAL A 56 8.172 -9.706 16.876 1.00 0.00 H ATOM 867 HG23 VAL A 56 9.552 -8.610 16.623 1.00 0.00 H ATOM 868 H VAL A 56 8.787 -10.967 19.661 1.00 0.00 H ATOM 869 N ARG A 57 5.521 -8.962 18.554 1.00 15.27 N ATOM 870 CA ARG A 57 4.333 -9.443 17.874 1.00 15.70 C ATOM 871 C ARG A 57 4.414 -9.010 16.417 1.00 16.50 C ATOM 872 O ARG A 57 4.593 -7.822 16.144 1.00 17.16 O ATOM 873 CB ARG A 57 3.088 -8.859 18.534 1.00 16.44 C ATOM 874 CG ARG A 57 3.024 -9.103 20.026 1.00 16.35 C ATOM 875 CD ARG A 57 1.624 -8.951 20.577 1.00 17.21 C ATOM 876 NE ARG A 57 1.035 -7.655 20.263 1.00 17.96 N ATOM 877 CZ ARG A 57 1.250 -6.542 20.959 1.00 19.70 C ATOM 878 NH1 ARG A 57 2.042 -6.554 22.027 1.00 20.33 N ATOM 879 NH2 ARG A 57 0.654 -5.413 20.589 1.00 19.58 N ATOM 880 HA ARG A 57 4.272 -10.530 17.935 1.00 0.00 H ATOM 881 HB2 ARG A 57 3.077 -7.783 18.359 1.00 0.00 H ATOM 882 HB3 ARG A 57 2.209 -9.309 18.073 1.00 0.00 H ATOM 883 HG2 ARG A 57 3.373 -10.115 20.230 1.00 0.00 H ATOM 884 HG3 ARG A 57 3.677 -8.387 20.526 1.00 0.00 H ATOM 885 HD2 ARG A 57 1.661 -9.065 21.660 1.00 0.00 H ATOM 886 HD3 ARG A 57 0.995 -9.733 20.152 1.00 0.00 H ATOM 887 HE ARG A 57 0.404 -7.597 19.439 1.00 0.00 H ATOM 888 HH12 ARG A 57 2.204 -5.678 22.564 1.00 0.00 H ATOM 889 HH11 ARG A 57 2.500 -7.439 22.325 1.00 0.00 H ATOM 890 HH22 ARG A 57 0.817 -4.538 21.128 1.00 0.00 H ATOM 891 HH21 ARG A 57 0.025 -5.404 19.761 1.00 0.00 H ATOM 892 H ARG A 57 5.584 -7.955 18.807 1.00 0.00 H ATOM 893 N GLN A 58 4.277 -9.969 15.506 1.00 16.32 N ATOM 894 CA GLN A 58 4.407 -9.709 14.072 1.00 16.56 C ATOM 895 C GLN A 58 3.040 -9.546 13.426 1.00 16.61 C ATOM 896 O GLN A 58 2.234 -10.477 13.469 1.00 16.13 O ATOM 897 CB GLN A 58 5.160 -10.847 13.377 1.00 16.58 C ATOM 898 CG GLN A 58 5.260 -10.679 11.868 1.00 17.01 C ATOM 899 CD GLN A 58 6.006 -11.804 11.178 1.00 16.95 C ATOM 900 OE1 GLN A 58 6.853 -12.467 11.771 1.00 19.84 O ATOM 901 NE2 GLN A 58 5.695 -12.027 9.907 1.00 18.24 N ATOM 902 HA GLN A 58 4.971 -8.784 13.957 1.00 0.00 H ATOM 903 HB2 GLN A 58 6.169 -10.893 13.786 1.00 0.00 H ATOM 904 HB3 GLN A 58 4.641 -11.782 13.586 1.00 0.00 H ATOM 905 HG2 GLN A 58 4.251 -10.633 11.459 1.00 0.00 H ATOM 906 HG3 GLN A 58 5.778 -9.743 11.659 1.00 0.00 H ATOM 907 HE22 GLN A 58 4.972 -11.444 9.439 1.00 0.00 H ATOM 908 HE21 GLN A 58 6.174 -12.784 9.380 1.00 0.00 H ATOM 909 H GLN A 58 4.070 -10.937 15.824 1.00 0.00 H ATOM 910 N TYR A 59 2.807 -8.380 12.821 1.00 16.68 N ATOM 911 CA TYR A 59 1.584 -8.082 12.077 1.00 17.03 C ATOM 912 C TYR A 59 1.977 -7.890 10.620 1.00 17.58 C ATOM 913 O TYR A 59 2.921 -7.147 10.335 1.00 18.41 O ATOM 914 CB TYR A 59 0.966 -6.772 12.576 1.00 17.06 C ATOM 915 CG TYR A 59 0.469 -6.817 14.002 1.00 17.44 C ATOM 916 CD1 TYR A 59 1.321 -6.561 15.064 1.00 17.37 C ATOM 917 CD2 TYR A 59 -0.854 -7.118 14.291 1.00 16.86 C ATOM 918 CE1 TYR A 59 0.870 -6.599 16.369 1.00 18.44 C ATOM 919 CE2 TYR A 59 -1.315 -7.160 15.598 1.00 17.04 C ATOM 920 CZ TYR A 59 -0.446 -6.901 16.636 1.00 17.89 C ATOM 921 OH TYR A 59 -0.899 -6.946 17.942 1.00 19.96 O ATOM 922 HA TYR A 59 0.865 -8.891 12.205 1.00 0.00 H ATOM 923 HB3 TYR A 59 0.124 -6.524 11.929 1.00 0.00 H ATOM 924 HB2 TYR A 59 1.721 -5.989 12.503 1.00 0.00 H ATOM 925 HD2 TYR A 59 -1.545 -7.326 13.474 1.00 0.00 H ATOM 926 HE2 TYR A 59 -2.359 -7.397 15.803 1.00 0.00 H ATOM 927 HE1 TYR A 59 1.557 -6.390 17.189 1.00 0.00 H ATOM 928 HD1 TYR A 59 2.367 -6.325 14.866 1.00 0.00 H ATOM 929 HH TYR A 59 -0.152 -6.737 18.557 1.00 0.00 H ATOM 930 H TYR A 59 3.536 -7.641 12.882 1.00 0.00 H ATOM 931 N ASP A 60 1.248 -8.536 9.718 1.00 18.02 N ATOM 932 CA ASP A 60 1.557 -8.475 8.292 1.00 17.93 C ATOM 933 C ASP A 60 0.673 -7.502 7.507 1.00 17.97 C ATOM 934 O ASP A 60 -0.464 -7.217 7.882 1.00 18.35 O ATOM 935 CB ASP A 60 1.485 -9.880 7.689 1.00 18.44 C ATOM 936 CG ASP A 60 2.553 -10.811 8.244 1.00 20.14 C ATOM 937 OD1 ASP A 60 3.668 -10.337 8.557 1.00 20.66 O ATOM 938 OD2 ASP A 60 2.279 -12.025 8.362 1.00 22.79 O ATOM 939 HA ASP A 60 2.570 -8.082 8.207 1.00 0.00 H ATOM 940 HB2 ASP A 60 0.505 -10.304 7.907 1.00 0.00 H ATOM 941 HB3 ASP A 60 1.615 -9.804 6.609 1.00 0.00 H ATOM 942 H ASP A 60 0.435 -9.101 10.036 1.00 0.00 H ATOM 943 N GLN A 61 1.221 -6.998 6.404 1.00 17.73 N ATOM 944 CA GLN A 61 0.489 -6.156 5.459 1.00 17.62 C ATOM 945 C GLN A 61 -0.241 -4.994 6.130 1.00 16.88 C ATOM 946 O GLN A 61 -1.431 -4.749 5.917 1.00 17.77 O ATOM 947 CB GLN A 61 -0.444 -7.000 4.587 1.00 18.29 C ATOM 948 CG GLN A 61 0.302 -7.936 3.646 1.00 20.47 C ATOM 949 CD GLN A 61 1.188 -7.193 2.660 1.00 25.10 C ATOM 950 OE1 GLN A 61 2.400 -7.082 2.856 1.00 28.28 O ATOM 951 NE2 GLN A 61 0.585 -6.665 1.604 1.00 27.63 N ATOM 952 HA GLN A 61 1.230 -5.693 4.807 1.00 0.00 H ATOM 953 HB2 GLN A 61 -1.081 -7.598 5.238 1.00 0.00 H ATOM 954 HB3 GLN A 61 -1.063 -6.329 3.991 1.00 0.00 H ATOM 955 HG2 GLN A 61 0.925 -8.604 4.240 1.00 0.00 H ATOM 956 HG3 GLN A 61 -0.427 -8.522 3.087 1.00 0.00 H ATOM 957 HE22 GLN A 61 -0.441 -6.783 1.478 1.00 0.00 H ATOM 958 HE21 GLN A 61 1.137 -6.133 0.902 1.00 0.00 H ATOM 959 H GLN A 61 2.219 -7.214 6.204 1.00 0.00 H ATOM 960 N ILE A 62 0.522 -4.266 6.937 1.00 16.61 N ATOM 961 CA ILE A 62 0.043 -3.061 7.601 1.00 16.64 C ATOM 962 C ILE A 62 0.492 -1.832 6.808 1.00 16.24 C ATOM 963 O ILE A 62 1.690 -1.658 6.573 1.00 16.46 O ATOM 964 CB ILE A 62 0.647 -2.966 9.008 1.00 16.79 C ATOM 965 CG1 ILE A 62 0.271 -4.185 9.855 1.00 16.90 C ATOM 966 CG2 ILE A 62 0.230 -1.674 9.702 1.00 16.70 C ATOM 967 CD1 ILE A 62 -1.219 -4.391 10.070 1.00 19.15 C ATOM 968 HA ILE A 62 -1.045 -3.102 7.662 1.00 0.00 H ATOM 969 HB ILE A 62 1.732 -2.953 8.900 1.00 0.00 H ATOM 970 HG12 ILE A 62 0.666 -5.073 9.362 1.00 0.00 H ATOM 971 HG13 ILE A 62 0.741 -4.074 10.832 1.00 0.00 H ATOM 972 HD11 ILE A 62 -1.635 -3.521 10.577 1.00 0.00 H ATOM 973 HD12 ILE A 62 -1.710 -4.520 9.105 1.00 0.00 H ATOM 974 HD13 ILE A 62 -1.377 -5.279 10.681 1.00 0.00 H ATOM 975 HG21 ILE A 62 0.575 -0.821 9.117 1.00 0.00 H ATOM 976 HG22 ILE A 62 -0.856 -1.643 9.787 1.00 0.00 H ATOM 977 HG23 ILE A 62 0.675 -1.637 10.697 1.00 0.00 H ATOM 978 H ILE A 62 1.503 -4.569 7.102 1.00 0.00 H ATOM 979 N PRO A 63 -0.454 -0.985 6.370 1.00 15.58 N ATOM 980 CA PRO A 63 -0.041 0.274 5.749 1.00 15.59 C ATOM 981 C PRO A 63 0.719 1.194 6.695 1.00 15.62 C ATOM 982 O PRO A 63 0.272 1.431 7.819 1.00 16.49 O ATOM 983 CB PRO A 63 -1.368 0.921 5.345 1.00 15.44 C ATOM 984 CG PRO A 63 -2.337 -0.203 5.261 1.00 15.27 C ATOM 985 CD PRO A 63 -1.918 -1.145 6.356 1.00 15.45 C ATOM 986 HA PRO A 63 0.647 0.098 4.922 1.00 0.00 H ATOM 987 HD3 PRO A 63 -2.355 -0.858 7.312 1.00 0.00 H ATOM 988 HD2 PRO A 63 -2.200 -2.172 6.123 1.00 0.00 H ATOM 989 HG3 PRO A 63 -2.277 -0.692 4.288 1.00 0.00 H ATOM 990 HG2 PRO A 63 -3.354 0.152 5.426 1.00 0.00 H ATOM 991 HB2 PRO A 63 -1.685 1.645 6.096 1.00 0.00 H ATOM 992 HB3 PRO A 63 -1.273 1.418 4.380 1.00 0.00 H ATOM 993 N VAL A 64 1.871 1.682 6.238 1.00 16.04 N ATOM 994 CA VAL A 64 2.643 2.680 6.961 1.00 16.29 C ATOM 995 C VAL A 64 3.075 3.772 5.990 1.00 16.31 C ATOM 996 O VAL A 64 3.756 3.491 5.008 1.00 17.79 O ATOM 997 CB VAL A 64 3.906 2.072 7.599 1.00 15.97 C ATOM 998 CG1 VAL A 64 4.656 3.138 8.414 1.00 16.33 C ATOM 999 CG2 VAL A 64 3.542 0.871 8.464 1.00 16.76 C ATOM 1000 HA VAL A 64 2.012 3.081 7.754 1.00 0.00 H ATOM 1001 HB VAL A 64 4.568 1.724 6.806 1.00 0.00 H ATOM 1002 HG11 VAL A 64 4.947 3.958 7.757 1.00 0.00 H ATOM 1003 HG12 VAL A 64 4.005 3.516 9.202 1.00 0.00 H ATOM 1004 HG13 VAL A 64 5.546 2.694 8.859 1.00 0.00 H ATOM 1005 HG21 VAL A 64 2.862 1.187 9.255 1.00 0.00 H ATOM 1006 HG22 VAL A 64 3.057 0.114 7.847 1.00 0.00 H ATOM 1007 HG23 VAL A 64 4.448 0.455 8.906 1.00 0.00 H ATOM 1008 H VAL A 64 2.233 1.335 5.327 1.00 0.00 H ATOM 1009 N GLU A 65 2.662 5.007 6.259 1.00 16.46 N ATOM 1010 CA GLU A 65 3.038 6.131 5.409 1.00 16.51 C ATOM 1011 C GLU A 65 4.176 6.873 6.088 1.00 16.73 C ATOM 1012 O GLU A 65 4.082 7.188 7.268 1.00 16.69 O ATOM 1013 CB GLU A 65 1.852 7.066 5.204 1.00 16.35 C ATOM 1014 CG GLU A 65 2.021 8.033 4.053 1.00 17.20 C ATOM 1015 CD GLU A 65 0.865 8.995 3.985 1.00 18.19 C ATOM 1016 OE1 GLU A 65 0.867 9.937 4.800 1.00 19.19 O ATOM 1017 OE2 GLU A 65 -0.031 8.804 3.132 1.00 20.06 O ATOM 1018 HA GLU A 65 3.351 5.769 4.430 1.00 0.00 H ATOM 1019 HB2 GLU A 65 0.966 6.460 5.015 1.00 0.00 H ATOM 1020 HB3 GLU A 65 1.708 7.643 6.118 1.00 0.00 H ATOM 1021 HG2 GLU A 65 2.945 8.594 4.191 1.00 0.00 H ATOM 1022 HG3 GLU A 65 2.074 7.472 3.120 1.00 0.00 H ATOM 1023 H GLU A 65 2.060 5.174 7.090 1.00 0.00 H ATOM 1024 N ILE A 66 5.250 7.115 5.344 1.00 15.99 N ATOM 1025 CA ILE A 66 6.476 7.672 5.909 1.00 16.65 C ATOM 1026 C ILE A 66 6.721 8.999 5.213 1.00 16.43 C ATOM 1027 O ILE A 66 7.026 9.034 4.020 1.00 15.69 O ATOM 1028 CB ILE A 66 7.670 6.736 5.672 1.00 15.98 C ATOM 1029 CG1 ILE A 66 7.426 5.380 6.343 1.00 17.62 C ATOM 1030 CG2 ILE A 66 8.969 7.358 6.193 1.00 15.84 C ATOM 1031 CD1 ILE A 66 7.985 4.216 5.571 1.00 18.35 C ATOM 1032 HA ILE A 66 6.369 7.798 6.986 1.00 0.00 H ATOM 1033 HB ILE A 66 7.772 6.585 4.597 1.00 0.00 H ATOM 1034 HG12 ILE A 66 7.890 5.395 7.329 1.00 0.00 H ATOM 1035 HG13 ILE A 66 6.351 5.237 6.451 1.00 0.00 H ATOM 1036 HD11 ILE A 66 7.522 4.180 4.585 1.00 0.00 H ATOM 1037 HD12 ILE A 66 9.063 4.337 5.463 1.00 0.00 H ATOM 1038 HD13 ILE A 66 7.774 3.291 6.107 1.00 0.00 H ATOM 1039 HG21 ILE A 66 9.154 8.299 5.674 1.00 0.00 H ATOM 1040 HG22 ILE A 66 8.878 7.544 7.263 1.00 0.00 H ATOM 1041 HG23 ILE A 66 9.797 6.673 6.011 1.00 0.00 H ATOM 1042 H ILE A 66 5.216 6.901 4.327 1.00 0.00 H ATOM 1043 N CYS A 67 6.577 10.094 5.950 1.00 17.12 N ATOM 1044 CA CYS A 67 6.673 11.421 5.350 1.00 17.94 C ATOM 1045 C CYS A 67 5.859 11.547 4.076 1.00 17.89 C ATOM 1046 O CYS A 67 6.338 12.105 3.089 1.00 18.48 O ATOM 1047 CB CYS A 67 8.123 11.739 5.002 1.00 18.25 C ATOM 1048 SG CYS A 67 9.117 11.922 6.447 1.00 21.47 S ATOM 1049 HA CYS A 67 6.280 12.117 6.091 1.00 0.00 H ATOM 1050 HB2 CYS A 67 8.154 12.667 4.432 1.00 0.00 H ATOM 1051 HB3 CYS A 67 8.527 10.928 4.396 1.00 0.00 H ATOM 1052 HG CYS A 67 10.415 12.208 6.077 1.00 0.00 H ATOM 1053 H CYS A 67 6.393 10.005 6.970 1.00 0.00 H ATOM 1054 N GLY A 68 4.637 11.030 4.090 1.00 17.75 N ATOM 1055 CA GLY A 68 3.759 11.147 2.933 1.00 18.13 C ATOM 1056 C GLY A 68 4.033 10.141 1.829 1.00 18.42 C ATOM 1057 O GLY A 68 3.355 10.154 0.806 1.00 19.09 O ATOM 1058 HA3 GLY A 68 3.874 12.148 2.518 1.00 0.00 H ATOM 1059 HA2 GLY A 68 2.731 11.011 3.270 1.00 0.00 H ATOM 1060 H GLY A 68 4.301 10.534 4.940 1.00 0.00 H ATOM 1061 N HIS A 69 5.011 9.261 2.029 1.00 18.55 N ATOM 1062 CA HIS A 69 5.318 8.212 1.064 1.00 18.22 C ATOM 1063 C HIS A 69 4.737 6.893 1.567 1.00 18.02 C ATOM 1064 O HIS A 69 5.100 6.434 2.651 1.00 17.97 O ATOM 1065 CB HIS A 69 6.833 8.085 0.883 1.00 18.09 C ATOM 1066 CG HIS A 69 7.453 9.248 0.174 1.00 19.13 C ATOM 1067 ND1 HIS A 69 7.897 9.170 -1.128 1.00 20.12 N ATOM 1068 CD2 HIS A 69 7.703 10.515 0.581 1.00 20.69 C ATOM 1069 CE1 HIS A 69 8.394 10.339 -1.493 1.00 21.46 C ATOM 1070 NE2 HIS A 69 8.282 11.175 -0.477 1.00 21.11 N ATOM 1071 HA HIS A 69 4.878 8.463 0.099 1.00 0.00 H ATOM 1072 HB2 HIS A 69 7.292 7.998 1.868 1.00 0.00 H ATOM 1073 HB3 HIS A 69 7.037 7.182 0.307 1.00 0.00 H ATOM 1074 HD2 HIS A 69 7.486 10.933 1.564 1.00 0.00 H ATOM 1075 HE1 HIS A 69 8.823 10.573 -2.467 1.00 0.00 H ATOM 1076 H HIS A 69 5.574 9.323 2.901 1.00 0.00 H ATOM 1077 N LYS A 70 3.841 6.286 0.792 1.00 18.43 N ATOM 1078 CA LYS A 70 3.091 5.129 1.271 1.00 18.21 C ATOM 1079 C LYS A 70 3.871 3.836 1.128 1.00 18.12 C ATOM 1080 O LYS A 70 4.485 3.585 0.097 1.00 20.16 O ATOM 1081 CB LYS A 70 1.765 4.980 0.527 1.00 18.68 C ATOM 1082 CG LYS A 70 0.802 6.115 0.799 1.00 17.84 C ATOM 1083 CD LYS A 70 -0.504 5.931 0.035 1.00 18.88 C ATOM 1084 CE LYS A 70 -1.504 7.030 0.336 1.00 19.56 C ATOM 1085 NZ LYS A 70 -1.801 7.073 1.793 1.00 21.20 N ATOM 1086 HA LYS A 70 2.905 5.312 2.329 1.00 0.00 H ATOM 1087 HB2 LYS A 70 1.969 4.946 -0.543 1.00 0.00 H ATOM 1088 HB3 LYS A 70 1.297 4.045 0.836 1.00 0.00 H ATOM 1089 HG2 LYS A 70 0.587 6.150 1.867 1.00 0.00 H ATOM 1090 HG3 LYS A 70 1.264 7.054 0.492 1.00 0.00 H ATOM 1091 HD2 LYS A 70 -0.289 5.935 -1.034 1.00 0.00 H ATOM 1092 HD3 LYS A 70 -0.942 4.972 0.313 1.00 0.00 H ATOM 1093 HE2 LYS A 70 -2.426 6.838 -0.214 1.00 0.00 H ATOM 1094 HE3 LYS A 70 -1.089 7.989 0.025 1.00 0.00 H ATOM 1095 HZ1 LYS A 70 -2.199 6.160 2.091 1.00 0.00 H ATOM 1096 HZ2 LYS A 70 -0.923 7.258 2.319 1.00 0.00 H ATOM 1097 HZ3 LYS A 70 -2.487 7.831 1.983 1.00 0.00 H ATOM 1098 H LYS A 70 3.673 6.642 -0.171 1.00 0.00 H ATOM 1099 N ALA A 71 3.808 3.021 2.175 1.00 18.24 N ATOM 1100 CA ALA A 71 4.380 1.689 2.176 1.00 17.83 C ATOM 1101 C ALA A 71 3.371 0.743 2.808 1.00 17.43 C ATOM 1102 O ALA A 71 2.376 1.170 3.396 1.00 18.00 O ATOM 1103 CB ALA A 71 5.677 1.664 2.972 1.00 17.70 C ATOM 1104 HA ALA A 71 4.604 1.384 1.154 1.00 0.00 H ATOM 1105 HB1 ALA A 71 6.391 2.355 2.523 1.00 0.00 H ATOM 1106 HB2 ALA A 71 5.476 1.964 4.001 1.00 0.00 H ATOM 1107 HB3 ALA A 71 6.090 0.655 2.960 1.00 0.00 H ATOM 1108 H ALA A 71 3.326 3.354 3.034 1.00 0.00 H ATOM 1109 N ILE A 72 3.627 -0.550 2.680 1.00 17.33 N ATOM 1110 CA ILE A 72 2.765 -1.540 3.305 1.00 16.47 C ATOM 1111 C ILE A 72 3.604 -2.781 3.531 1.00 15.85 C ATOM 1112 O ILE A 72 4.278 -3.252 2.621 1.00 16.13 O ATOM 1113 CB ILE A 72 1.507 -1.867 2.464 1.00 16.69 C ATOM 1114 CG1 ILE A 72 0.715 -3.004 3.114 1.00 16.21 C ATOM 1115 CG2 ILE A 72 1.871 -2.241 1.045 1.00 17.31 C ATOM 1116 CD1 ILE A 72 -0.653 -3.227 2.504 1.00 16.38 C ATOM 1117 HA ILE A 72 2.384 -1.141 4.245 1.00 0.00 H ATOM 1118 HB ILE A 72 0.890 -0.969 2.430 1.00 0.00 H ATOM 1119 HG12 ILE A 72 1.290 -3.924 3.013 1.00 0.00 H ATOM 1120 HG13 ILE A 72 0.586 -2.772 4.171 1.00 0.00 H ATOM 1121 HD11 ILE A 72 -1.248 -2.319 2.607 1.00 0.00 H ATOM 1122 HD12 ILE A 72 -0.543 -3.473 1.448 1.00 0.00 H ATOM 1123 HD13 ILE A 72 -1.150 -4.049 3.020 1.00 0.00 H ATOM 1124 HG21 ILE A 72 2.395 -1.409 0.574 1.00 0.00 H ATOM 1125 HG22 ILE A 72 2.517 -3.119 1.056 1.00 0.00 H ATOM 1126 HG23 ILE A 72 0.963 -2.464 0.485 1.00 0.00 H ATOM 1127 H ILE A 72 4.452 -0.860 2.128 1.00 0.00 H ATOM 1128 N GLY A 73 3.576 -3.308 4.752 1.00 16.04 N ATOM 1129 CA GLY A 73 4.365 -4.490 5.033 1.00 15.60 C ATOM 1130 C GLY A 73 4.278 -4.939 6.467 1.00 15.50 C ATOM 1131 O GLY A 73 3.369 -4.558 7.203 1.00 16.44 O ATOM 1132 HA3 GLY A 73 5.408 -4.273 4.801 1.00 0.00 H ATOM 1133 HA2 GLY A 73 4.013 -5.301 4.395 1.00 0.00 H ATOM 1134 H GLY A 73 2.994 -2.876 5.497 1.00 0.00 H ATOM 1135 N THR A 74 5.245 -5.762 6.848 1.00 15.90 N ATOM 1136 CA THR A 74 5.266 -6.337 8.180 1.00 15.97 C ATOM 1137 C THR A 74 5.760 -5.325 9.210 1.00 15.76 C ATOM 1138 O THR A 74 6.761 -4.629 8.987 1.00 16.49 O ATOM 1139 CB THR A 74 6.145 -7.598 8.189 1.00 16.55 C ATOM 1140 OG1 THR A 74 5.569 -8.563 7.294 1.00 17.04 O ATOM 1141 CG2 THR A 74 6.236 -8.190 9.574 1.00 17.30 C ATOM 1142 HA THR A 74 4.248 -6.613 8.454 1.00 0.00 H ATOM 1143 HB THR A 74 7.152 -7.329 7.870 1.00 0.00 H ATOM 1144 HG1 THR A 74 6.126 -9.381 7.290 1.00 0.00 H ATOM 1145 HG23 THR A 74 6.673 -7.458 10.253 1.00 0.00 H ATOM 1146 HG21 THR A 74 5.237 -8.457 9.920 1.00 0.00 H ATOM 1147 HG22 THR A 74 6.863 -9.081 9.546 1.00 0.00 H ATOM 1148 H THR A 74 6.004 -6.000 6.178 1.00 0.00 H ATOM 1149 N VAL A 75 5.042 -5.245 10.329 1.00 16.01 N ATOM 1150 CA VAL A 75 5.487 -4.426 11.448 1.00 16.14 C ATOM 1151 C VAL A 75 5.533 -5.310 12.682 1.00 15.09 C ATOM 1152 O VAL A 75 4.673 -6.167 12.870 1.00 15.80 O ATOM 1153 CB VAL A 75 4.612 -3.175 11.680 1.00 16.90 C ATOM 1154 CG1 VAL A 75 4.589 -2.313 10.423 1.00 17.29 C ATOM 1155 CG2 VAL A 75 3.206 -3.536 12.120 1.00 18.34 C ATOM 1156 HA VAL A 75 6.477 -4.033 11.219 1.00 0.00 H ATOM 1157 HB VAL A 75 5.058 -2.602 12.493 1.00 0.00 H ATOM 1158 HG11 VAL A 75 5.604 -2.000 10.180 1.00 0.00 H ATOM 1159 HG12 VAL A 75 4.177 -2.891 9.595 1.00 0.00 H ATOM 1160 HG13 VAL A 75 3.969 -1.434 10.598 1.00 0.00 H ATOM 1161 HG21 VAL A 75 2.731 -4.145 11.351 1.00 0.00 H ATOM 1162 HG22 VAL A 75 3.252 -4.097 13.053 1.00 0.00 H ATOM 1163 HG23 VAL A 75 2.628 -2.624 12.271 1.00 0.00 H ATOM 1164 H VAL A 75 4.151 -5.775 10.405 1.00 0.00 H ATOM 1165 N LEU A 76 6.560 -5.101 13.500 1.00 14.99 N ATOM 1166 CA LEU A 76 6.756 -5.860 14.723 1.00 15.12 C ATOM 1167 C LEU A 76 6.505 -4.909 15.883 1.00 15.67 C ATOM 1168 O LEU A 76 6.966 -3.768 15.847 1.00 17.44 O ATOM 1169 CB LEU A 76 8.190 -6.391 14.771 1.00 15.00 C ATOM 1170 CG LEU A 76 8.620 -7.159 13.523 1.00 15.36 C ATOM 1171 CD1 LEU A 76 10.060 -7.622 13.647 1.00 14.39 C ATOM 1172 CD2 LEU A 76 7.693 -8.324 13.230 1.00 15.00 C ATOM 1173 HA LEU A 76 6.078 -6.712 14.774 1.00 0.00 H ATOM 1174 HB2 LEU A 76 8.864 -5.544 14.899 1.00 0.00 H ATOM 1175 HB3 LEU A 76 8.279 -7.057 15.629 1.00 0.00 H ATOM 1176 HG LEU A 76 8.552 -6.476 12.677 1.00 0.00 H ATOM 1177 HD21 LEU A 76 7.699 -9.013 14.075 1.00 0.00 H ATOM 1178 HD22 LEU A 76 6.681 -7.951 13.071 1.00 0.00 H ATOM 1179 HD23 LEU A 76 8.035 -8.843 12.335 1.00 0.00 H ATOM 1180 HD11 LEU A 76 10.710 -6.755 13.769 1.00 0.00 H ATOM 1181 HD12 LEU A 76 10.157 -8.275 14.514 1.00 0.00 H ATOM 1182 HD13 LEU A 76 10.344 -8.167 12.747 1.00 0.00 H ATOM 1183 H LEU A 76 7.251 -4.364 13.254 1.00 0.00 H ATOM 1184 N VAL A 77 5.769 -5.360 16.891 1.00 13.02 N ATOM 1185 CA VAL A 77 5.438 -4.508 18.026 1.00 14.00 C ATOM 1186 C VAL A 77 6.151 -5.035 19.265 1.00 13.88 C ATOM 1187 O VAL A 77 6.052 -6.215 19.593 1.00 13.47 O ATOM 1188 CB VAL A 77 3.909 -4.468 18.242 1.00 14.13 C ATOM 1189 CG1 VAL A 77 3.561 -3.677 19.486 1.00 14.59 C ATOM 1190 CG2 VAL A 77 3.237 -3.871 17.008 1.00 14.83 C ATOM 1191 HA VAL A 77 5.770 -3.489 17.830 1.00 0.00 H ATOM 1192 HB VAL A 77 3.543 -5.484 18.387 1.00 0.00 H ATOM 1193 HG11 VAL A 77 4.027 -4.144 20.354 1.00 0.00 H ATOM 1194 HG12 VAL A 77 3.928 -2.656 19.380 1.00 0.00 H ATOM 1195 HG13 VAL A 77 2.479 -3.664 19.616 1.00 0.00 H ATOM 1196 HG21 VAL A 77 3.609 -2.859 16.847 1.00 0.00 H ATOM 1197 HG22 VAL A 77 3.466 -4.486 16.138 1.00 0.00 H ATOM 1198 HG23 VAL A 77 2.158 -3.843 17.161 1.00 0.00 H ATOM 1199 H VAL A 77 5.422 -6.340 16.871 1.00 0.00 H ATOM 1200 N GLY A 78 6.873 -4.153 19.951 1.00 14.13 N ATOM 1201 CA GLY A 78 7.765 -4.563 21.026 1.00 14.61 C ATOM 1202 C GLY A 78 7.821 -3.537 22.137 1.00 14.15 C ATOM 1203 O GLY A 78 7.082 -2.558 22.110 1.00 12.87 O ATOM 1204 HA3 GLY A 78 8.768 -4.698 20.620 1.00 0.00 H ATOM 1205 HA2 GLY A 78 7.411 -5.508 21.437 1.00 0.00 H ATOM 1206 H GLY A 78 6.798 -3.143 19.713 1.00 0.00 H ATOM 1207 N PRO A 79 8.725 -3.748 23.107 1.00 14.44 N ATOM 1208 CA PRO A 79 8.847 -2.906 24.289 1.00 14.28 C ATOM 1209 C PRO A 79 9.872 -1.782 24.130 1.00 13.92 C ATOM 1210 O PRO A 79 10.266 -1.163 25.121 1.00 13.44 O ATOM 1211 CB PRO A 79 9.336 -3.902 25.337 1.00 14.11 C ATOM 1212 CG PRO A 79 10.248 -4.802 24.549 1.00 15.37 C ATOM 1213 CD PRO A 79 9.714 -4.840 23.133 1.00 15.26 C ATOM 1214 HA PRO A 79 7.913 -2.395 24.525 1.00 0.00 H ATOM 1215 HD3 PRO A 79 10.511 -4.661 22.411 1.00 0.00 H ATOM 1216 HD2 PRO A 79 9.241 -5.799 22.920 1.00 0.00 H ATOM 1217 HG3 PRO A 79 10.247 -5.804 24.977 1.00 0.00 H ATOM 1218 HG2 PRO A 79 11.264 -4.406 24.556 1.00 0.00 H ATOM 1219 HB2 PRO A 79 9.879 -3.396 26.136 1.00 0.00 H ATOM 1220 HB3 PRO A 79 8.504 -4.463 25.763 1.00 0.00 H ATOM 1221 N ASN A 80 10.282 -1.519 22.892 1.00 14.78 N ATOM 1222 CA ASN A 80 11.325 -0.543 22.600 1.00 15.27 C ATOM 1223 C ASN A 80 10.854 0.895 22.821 1.00 14.96 C ATOM 1224 O ASN A 80 9.663 1.185 22.722 1.00 14.19 O ATOM 1225 CB ASN A 80 11.846 -0.723 21.164 1.00 16.37 C ATOM 1226 CG ASN A 80 10.744 -1.070 20.162 1.00 18.91 C ATOM 1227 OD1 ASN A 80 9.968 -2.011 20.369 1.00 20.79 O ATOM 1228 ND2 ASN A 80 10.679 -0.318 19.057 1.00 20.84 N ATOM 1229 HA ASN A 80 12.140 -0.726 23.301 1.00 0.00 H ATOM 1230 HB2 ASN A 80 12.321 0.206 20.849 1.00 0.00 H ATOM 1231 HB3 ASN A 80 12.583 -1.526 21.161 1.00 0.00 H ATOM 1232 HD22 ASN A 80 11.350 0.465 18.920 1.00 0.00 H ATOM 1233 HD21 ASN A 80 9.957 -0.516 18.335 1.00 0.00 H ATOM 1234 H ASN A 80 9.841 -2.030 22.101 1.00 0.00 H ATOM 1235 N PRO A 81 11.788 1.806 23.134 1.00 15.03 N ATOM 1236 CA PRO A 81 11.437 3.194 23.427 1.00 14.85 C ATOM 1237 C PRO A 81 11.121 4.056 22.214 1.00 14.77 C ATOM 1238 O PRO A 81 10.530 5.125 22.367 1.00 15.39 O ATOM 1239 CB PRO A 81 12.691 3.739 24.112 1.00 15.00 C ATOM 1240 CG PRO A 81 13.800 2.890 23.617 1.00 15.09 C ATOM 1241 CD PRO A 81 13.235 1.554 23.261 1.00 15.63 C ATOM 1242 HA PRO A 81 10.521 3.223 24.018 1.00 0.00 H ATOM 1243 HD3 PRO A 81 13.651 1.195 22.320 1.00 0.00 H ATOM 1244 HD2 PRO A 81 13.435 0.826 24.047 1.00 0.00 H ATOM 1245 HG3 PRO A 81 14.555 2.777 24.395 1.00 0.00 H ATOM 1246 HG2 PRO A 81 14.252 3.347 22.737 1.00 0.00 H ATOM 1247 HB2 PRO A 81 12.855 4.781 23.838 1.00 0.00 H ATOM 1248 HB3 PRO A 81 12.601 3.659 25.195 1.00 0.00 H ATOM 1249 N VAL A 82 11.526 3.599 21.032 1.00 14.11 N ATOM 1250 CA VAL A 82 11.381 4.375 19.805 1.00 13.56 C ATOM 1251 C VAL A 82 10.865 3.455 18.705 1.00 12.98 C ATOM 1252 O VAL A 82 11.196 2.271 18.667 1.00 14.08 O ATOM 1253 CB VAL A 82 12.724 5.025 19.392 1.00 14.27 C ATOM 1254 CG1 VAL A 82 13.766 3.977 19.060 1.00 14.04 C ATOM 1255 CG2 VAL A 82 12.560 5.997 18.221 1.00 14.76 C ATOM 1256 HA VAL A 82 10.670 5.184 19.972 1.00 0.00 H ATOM 1257 HB VAL A 82 13.068 5.597 20.253 1.00 0.00 H ATOM 1258 HG11 VAL A 82 13.939 3.349 19.934 1.00 0.00 H ATOM 1259 HG12 VAL A 82 13.410 3.362 18.234 1.00 0.00 H ATOM 1260 HG13 VAL A 82 14.696 4.469 18.774 1.00 0.00 H ATOM 1261 HG21 VAL A 82 12.163 5.461 17.359 1.00 0.00 H ATOM 1262 HG22 VAL A 82 11.871 6.793 18.505 1.00 0.00 H ATOM 1263 HG23 VAL A 82 13.529 6.427 17.969 1.00 0.00 H ATOM 1264 H VAL A 82 11.961 2.656 20.981 1.00 0.00 H ATOM 1265 N ASN A 83 10.035 4.003 17.824 1.00 11.90 N ATOM 1266 CA ASN A 83 9.625 3.301 16.625 1.00 11.67 C ATOM 1267 C ASN A 83 10.773 3.363 15.627 1.00 10.99 C ATOM 1268 O ASN A 83 11.341 4.438 15.434 1.00 11.02 O ATOM 1269 CB ASN A 83 8.424 4.000 15.991 1.00 11.22 C ATOM 1270 CG ASN A 83 7.208 4.037 16.892 1.00 11.89 C ATOM 1271 OD1 ASN A 83 6.757 3.007 17.387 1.00 11.63 O ATOM 1272 ND2 ASN A 83 6.665 5.234 17.097 1.00 11.78 N ATOM 1273 HA ASN A 83 9.363 2.274 16.879 1.00 0.00 H ATOM 1274 HB2 ASN A 83 8.707 5.024 15.750 1.00 0.00 H ATOM 1275 HB3 ASN A 83 8.160 3.472 15.075 1.00 0.00 H ATOM 1276 HD22 ASN A 83 7.084 6.077 16.656 1.00 0.00 H ATOM 1277 HD21 ASN A 83 5.822 5.326 17.699 1.00 0.00 H ATOM 1278 H ASN A 83 9.670 4.961 18.000 1.00 0.00 H ATOM 1279 N ILE A 84 11.094 2.240 14.989 1.00 10.77 N ATOM 1280 CA ILE A 84 12.143 2.218 13.972 1.00 10.84 C ATOM 1281 C ILE A 84 11.589 1.712 12.651 1.00 10.39 C ATOM 1282 O ILE A 84 10.878 0.703 12.629 1.00 11.37 O ATOM 1283 CB ILE A 84 13.385 1.423 14.421 1.00 11.53 C ATOM 1284 CG1 ILE A 84 13.118 -0.078 14.495 1.00 11.91 C ATOM 1285 CG2 ILE A 84 13.881 1.934 15.765 1.00 10.77 C ATOM 1286 CD1 ILE A 84 14.312 -0.877 14.993 1.00 12.35 C ATOM 1287 HA ILE A 84 12.483 3.243 13.827 1.00 0.00 H ATOM 1288 HB ILE A 84 14.156 1.578 13.666 1.00 0.00 H ATOM 1289 HG12 ILE A 84 12.281 -0.248 15.172 1.00 0.00 H ATOM 1290 HG13 ILE A 84 12.855 -0.433 13.498 1.00 0.00 H ATOM 1291 HD11 ILE A 84 15.155 -0.726 14.319 1.00 0.00 H ATOM 1292 HD12 ILE A 84 14.580 -0.541 15.994 1.00 0.00 H ATOM 1293 HD13 ILE A 84 14.053 -1.935 15.021 1.00 0.00 H ATOM 1294 HG21 ILE A 84 14.145 2.988 15.677 1.00 0.00 H ATOM 1295 HG22 ILE A 84 13.094 1.816 16.510 1.00 0.00 H ATOM 1296 HG23 ILE A 84 14.758 1.363 16.068 1.00 0.00 H ATOM 1297 H ILE A 84 10.588 1.361 15.219 1.00 0.00 H ATOM 1298 N ILE A 85 11.900 2.438 11.575 1.00 9.44 N ATOM 1299 CA ILE A 85 11.516 2.046 10.227 1.00 10.17 C ATOM 1300 C ILE A 85 12.738 1.404 9.598 1.00 10.58 C ATOM 1301 O ILE A 85 13.756 2.064 9.386 1.00 9.98 O ATOM 1302 CB ILE A 85 11.098 3.251 9.360 1.00 9.84 C ATOM 1303 CG1 ILE A 85 9.972 4.053 10.019 1.00 10.19 C ATOM 1304 CG2 ILE A 85 10.683 2.804 7.955 1.00 9.69 C ATOM 1305 CD1 ILE A 85 8.772 3.219 10.430 1.00 11.25 C ATOM 1306 HA ILE A 85 10.660 1.373 10.281 1.00 0.00 H ATOM 1307 HB ILE A 85 11.968 3.901 9.271 1.00 0.00 H ATOM 1308 HG12 ILE A 85 10.373 4.538 10.909 1.00 0.00 H ATOM 1309 HG13 ILE A 85 9.635 4.813 9.314 1.00 0.00 H ATOM 1310 HD11 ILE A 85 8.348 2.736 9.550 1.00 0.00 H ATOM 1311 HD12 ILE A 85 9.087 2.460 11.146 1.00 0.00 H ATOM 1312 HD13 ILE A 85 8.022 3.864 10.888 1.00 0.00 H ATOM 1313 HG21 ILE A 85 11.521 2.301 7.473 1.00 0.00 H ATOM 1314 HG22 ILE A 85 9.839 2.118 8.028 1.00 0.00 H ATOM 1315 HG23 ILE A 85 10.394 3.676 7.368 1.00 0.00 H ATOM 1316 H ILE A 85 12.438 3.319 11.705 1.00 0.00 H ATOM 1317 N GLY A 86 12.616 0.112 9.315 1.00 12.11 N ATOM 1318 CA GLY A 86 13.725 -0.681 8.803 1.00 12.66 C ATOM 1319 C GLY A 86 13.644 -0.879 7.305 1.00 12.88 C ATOM 1320 O GLY A 86 12.785 -0.300 6.640 1.00 14.49 O ATOM 1321 HA3 GLY A 86 13.712 -1.657 9.287 1.00 0.00 H ATOM 1322 HA2 GLY A 86 14.659 -0.172 9.040 1.00 0.00 H ATOM 1323 H GLY A 86 11.696 -0.350 9.464 1.00 0.00 H ATOM 1324 N ARG A 87 14.551 -1.688 6.766 1.00 13.53 N ATOM 1325 CA ARG A 87 14.726 -1.743 5.327 1.00 13.59 C ATOM 1326 C ARG A 87 13.506 -2.285 4.592 1.00 14.11 C ATOM 1327 O ARG A 87 13.297 -1.960 3.422 1.00 14.97 O ATOM 1328 CB ARG A 87 15.965 -2.561 4.960 1.00 14.07 C ATOM 1329 CG ARG A 87 17.261 -1.916 5.424 1.00 13.98 C ATOM 1330 CD ARG A 87 18.513 -2.644 4.936 1.00 14.14 C ATOM 1331 NE ARG A 87 18.589 -3.998 5.477 1.00 13.54 N ATOM 1332 CZ ARG A 87 18.229 -5.112 4.839 1.00 14.85 C ATOM 1333 NH1 ARG A 87 17.747 -5.089 3.605 1.00 16.13 N ATOM 1334 NH2 ARG A 87 18.338 -6.282 5.454 1.00 15.79 N ATOM 1335 HA ARG A 87 14.860 -0.712 5.001 1.00 0.00 H ATOM 1336 HB2 ARG A 87 15.881 -3.545 5.422 1.00 0.00 H ATOM 1337 HB3 ARG A 87 16.000 -2.672 3.876 1.00 0.00 H ATOM 1338 HG2 ARG A 87 17.290 -0.892 5.052 1.00 0.00 H ATOM 1339 HG3 ARG A 87 17.271 -1.905 6.514 1.00 0.00 H ATOM 1340 HD2 ARG A 87 19.394 -2.086 5.253 1.00 0.00 H ATOM 1341 HD3 ARG A 87 18.490 -2.698 3.848 1.00 0.00 H ATOM 1342 HE ARG A 87 18.956 -4.103 6.444 1.00 0.00 H ATOM 1343 HH12 ARG A 87 17.476 -5.977 3.136 1.00 0.00 H ATOM 1344 HH11 ARG A 87 17.640 -4.183 3.105 1.00 0.00 H ATOM 1345 HH22 ARG A 87 18.059 -7.155 4.963 1.00 0.00 H ATOM 1346 HH21 ARG A 87 18.702 -6.326 6.427 1.00 0.00 H ATOM 1347 H ARG A 87 15.139 -2.286 7.381 1.00 0.00 H ATOM 1348 N ASN A 88 12.700 -3.104 5.255 1.00 14.29 N ATOM 1349 CA ASN A 88 11.522 -3.644 4.590 1.00 14.33 C ATOM 1350 C ASN A 88 10.591 -2.555 4.068 1.00 14.75 C ATOM 1351 O ASN A 88 9.946 -2.749 3.030 1.00 16.35 O ATOM 1352 CB ASN A 88 10.766 -4.633 5.482 1.00 14.68 C ATOM 1353 CG ASN A 88 10.079 -3.970 6.653 1.00 14.08 C ATOM 1354 OD1 ASN A 88 10.683 -3.162 7.350 1.00 14.84 O ATOM 1355 ND2 ASN A 88 8.801 -4.304 6.864 1.00 15.13 N ATOM 1356 HA ASN A 88 11.890 -4.191 3.722 1.00 0.00 H ATOM 1357 HB2 ASN A 88 10.012 -5.139 4.878 1.00 0.00 H ATOM 1358 HB3 ASN A 88 11.475 -5.367 5.865 1.00 0.00 H ATOM 1359 HD22 ASN A 88 8.335 -4.996 6.243 1.00 0.00 H ATOM 1360 HD21 ASN A 88 8.273 -3.872 7.649 1.00 0.00 H ATOM 1361 H ASN A 88 12.908 -3.358 6.242 1.00 0.00 H ATOM 1362 N LEU A 89 10.509 -1.433 4.782 1.00 14.84 N ATOM 1363 CA LEU A 89 9.716 -0.288 4.332 1.00 14.62 C ATOM 1364 C LEU A 89 10.543 0.810 3.680 1.00 14.46 C ATOM 1365 O LEU A 89 10.050 1.495 2.782 1.00 15.18 O ATOM 1366 CB LEU A 89 8.911 0.310 5.493 1.00 14.28 C ATOM 1367 CG LEU A 89 7.997 -0.662 6.243 1.00 15.53 C ATOM 1368 CD1 LEU A 89 7.173 0.047 7.314 1.00 14.32 C ATOM 1369 CD2 LEU A 89 7.075 -1.393 5.278 1.00 16.97 C ATOM 1370 HA LEU A 89 9.044 -0.683 3.570 1.00 0.00 H ATOM 1371 HB2 LEU A 89 9.618 0.726 6.211 1.00 0.00 H ATOM 1372 HB3 LEU A 89 8.290 1.111 5.092 1.00 0.00 H ATOM 1373 HG LEU A 89 8.641 -1.389 6.739 1.00 0.00 H ATOM 1374 HD21 LEU A 89 6.457 -0.668 4.748 1.00 0.00 H ATOM 1375 HD22 LEU A 89 7.673 -1.955 4.561 1.00 0.00 H ATOM 1376 HD23 LEU A 89 6.436 -2.077 5.836 1.00 0.00 H ATOM 1377 HD11 LEU A 89 7.843 0.514 8.036 1.00 0.00 H ATOM 1378 HD12 LEU A 89 6.551 0.810 6.846 1.00 0.00 H ATOM 1379 HD13 LEU A 89 6.538 -0.679 7.822 1.00 0.00 H ATOM 1380 H LEU A 89 11.023 -1.369 5.684 1.00 0.00 H ATOM 1381 N LEU A 90 11.793 0.983 4.103 1.00 13.89 N ATOM 1382 CA LEU A 90 12.628 2.011 3.481 1.00 13.61 C ATOM 1383 C LEU A 90 12.786 1.779 1.977 1.00 13.98 C ATOM 1384 O LEU A 90 12.807 2.728 1.184 1.00 15.16 O ATOM 1385 CB LEU A 90 14.006 2.101 4.135 1.00 13.40 C ATOM 1386 CG LEU A 90 14.017 2.558 5.593 1.00 14.61 C ATOM 1387 CD1 LEU A 90 15.423 2.438 6.145 1.00 15.83 C ATOM 1388 CD2 LEU A 90 13.504 3.981 5.737 1.00 14.29 C ATOM 1389 HA LEU A 90 12.111 2.958 3.636 1.00 0.00 H ATOM 1390 HB2 LEU A 90 14.464 1.113 4.090 1.00 0.00 H ATOM 1391 HB3 LEU A 90 14.606 2.805 3.558 1.00 0.00 H ATOM 1392 HG LEU A 90 13.346 1.915 6.163 1.00 0.00 H ATOM 1393 HD21 LEU A 90 14.138 4.654 5.160 1.00 0.00 H ATOM 1394 HD22 LEU A 90 12.480 4.036 5.366 1.00 0.00 H ATOM 1395 HD23 LEU A 90 13.527 4.270 6.788 1.00 0.00 H ATOM 1396 HD11 LEU A 90 15.748 1.399 6.085 1.00 0.00 H ATOM 1397 HD12 LEU A 90 16.096 3.065 5.560 1.00 0.00 H ATOM 1398 HD13 LEU A 90 15.433 2.764 7.185 1.00 0.00 H ATOM 1399 H LEU A 90 12.173 0.392 4.870 1.00 0.00 H ATOM 1400 N THR A 91 12.892 0.516 1.578 1.00 14.17 N ATOM 1401 CA THR A 91 13.013 0.183 0.156 1.00 14.04 C ATOM 1402 C THR A 91 11.774 0.589 -0.635 1.00 14.33 C ATOM 1403 O THR A 91 11.875 1.003 -1.796 1.00 14.69 O ATOM 1404 CB THR A 91 13.252 -1.324 -0.050 1.00 14.34 C ATOM 1405 OG1 THR A 91 12.270 -2.069 0.677 1.00 16.24 O ATOM 1406 CG2 THR A 91 14.645 -1.710 0.418 1.00 14.27 C ATOM 1407 HA THR A 91 13.871 0.746 -0.213 1.00 0.00 H ATOM 1408 HB THR A 91 13.168 -1.552 -1.112 1.00 0.00 H ATOM 1409 HG1 THR A 91 12.340 -1.853 1.641 1.00 0.00 H ATOM 1410 HG23 THR A 91 15.386 -1.138 -0.141 1.00 0.00 H ATOM 1411 HG21 THR A 91 14.743 -1.493 1.482 1.00 0.00 H ATOM 1412 HG22 THR A 91 14.802 -2.775 0.248 1.00 0.00 H ATOM 1413 H THR A 91 12.889 -0.247 2.285 1.00 0.00 H ATOM 1414 N GLN A 92 10.611 0.466 -0.005 1.00 14.27 N ATOM 1415 CA GLN A 92 9.347 0.767 -0.675 1.00 14.52 C ATOM 1416 C GLN A 92 9.170 2.248 -0.992 1.00 15.05 C ATOM 1417 O GLN A 92 8.443 2.604 -1.925 1.00 15.28 O ATOM 1418 CB GLN A 92 8.174 0.285 0.180 1.00 14.05 C ATOM 1419 CG GLN A 92 8.166 -1.216 0.415 1.00 14.56 C ATOM 1420 CD GLN A 92 6.904 -1.692 1.096 1.00 15.72 C ATOM 1421 OE1 GLN A 92 5.848 -1.084 0.959 1.00 17.50 O ATOM 1422 NE2 GLN A 92 7.007 -2.794 1.838 1.00 19.12 N ATOM 1423 HA GLN A 92 9.369 0.237 -1.627 1.00 0.00 H ATOM 1424 HB2 GLN A 92 8.225 0.785 1.147 1.00 0.00 H ATOM 1425 HB3 GLN A 92 7.246 0.560 -0.322 1.00 0.00 H ATOM 1426 HG2 GLN A 92 8.255 -1.721 -0.547 1.00 0.00 H ATOM 1427 HG3 GLN A 92 9.020 -1.476 1.041 1.00 0.00 H ATOM 1428 HE22 GLN A 92 7.923 -3.278 1.926 1.00 0.00 H ATOM 1429 HE21 GLN A 92 6.171 -3.170 2.329 1.00 0.00 H ATOM 1430 H GLN A 92 10.599 0.149 0.985 1.00 0.00 H ATOM 1431 N ILE A 93 9.820 3.107 -0.212 1.00 14.96 N ATOM 1432 CA ILE A 93 9.740 4.550 -0.417 1.00 15.05 C ATOM 1433 C ILE A 93 10.960 5.085 -1.168 1.00 15.58 C ATOM 1434 O ILE A 93 11.111 6.295 -1.307 1.00 14.70 O ATOM 1435 CB ILE A 93 9.522 5.339 0.902 1.00 15.42 C ATOM 1436 CG1 ILE A 93 10.743 5.256 1.827 1.00 16.11 C ATOM 1437 CG2 ILE A 93 8.233 4.876 1.592 1.00 15.35 C ATOM 1438 CD1 ILE A 93 10.596 6.048 3.100 1.00 16.45 C ATOM 1439 HA ILE A 93 8.857 4.712 -1.036 1.00 0.00 H ATOM 1440 HB ILE A 93 9.405 6.394 0.654 1.00 0.00 H ATOM 1441 HG12 ILE A 93 10.906 4.211 2.089 1.00 0.00 H ATOM 1442 HG13 ILE A 93 11.611 5.633 1.286 1.00 0.00 H ATOM 1443 HD11 ILE A 93 10.444 7.100 2.857 1.00 0.00 H ATOM 1444 HD12 ILE A 93 9.738 5.676 3.661 1.00 0.00 H ATOM 1445 HD13 ILE A 93 11.499 5.939 3.700 1.00 0.00 H ATOM 1446 HG21 ILE A 93 7.385 5.049 0.929 1.00 0.00 H ATOM 1447 HG22 ILE A 93 8.306 3.813 1.821 1.00 0.00 H ATOM 1448 HG23 ILE A 93 8.094 5.439 2.515 1.00 0.00 H ATOM 1449 H ILE A 93 10.403 2.740 0.567 1.00 0.00 H ATOM 1450 N GLY A 94 11.821 4.197 -1.660 1.00 15.32 N ATOM 1451 CA GLY A 94 12.909 4.608 -2.545 1.00 15.48 C ATOM 1452 C GLY A 94 14.050 5.294 -1.826 1.00 15.38 C ATOM 1453 O GLY A 94 14.747 6.120 -2.415 1.00 15.16 O ATOM 1454 HA3 GLY A 94 12.507 5.296 -3.289 1.00 0.00 H ATOM 1455 HA2 GLY A 94 13.300 3.722 -3.045 1.00 0.00 H ATOM 1456 H GLY A 94 11.718 3.193 -1.410 1.00 0.00 H ATOM 1457 N CYS A 95 14.250 4.932 -0.562 1.00 16.31 N ATOM 1458 CA CYS A 95 15.256 5.558 0.282 1.00 16.48 C ATOM 1459 C CYS A 95 16.650 4.997 0.003 1.00 16.67 C ATOM 1460 O CYS A 95 16.838 3.784 -0.063 1.00 17.19 O ATOM 1461 CB CYS A 95 14.884 5.353 1.756 1.00 17.65 C ATOM 1462 SG CYS A 95 15.845 6.336 2.939 1.00 20.22 S ATOM 1463 HA CYS A 95 15.281 6.624 0.055 1.00 0.00 H ATOM 1464 HB2 CYS A 95 15.028 4.300 1.997 1.00 0.00 H ATOM 1465 HB3 CYS A 95 13.832 5.612 1.878 1.00 0.00 H ATOM 1466 HG CYS A 95 15.414 6.060 4.221 1.00 0.00 H ATOM 1467 H CYS A 95 13.664 4.172 -0.161 1.00 0.00 H ATOM 1468 N THR A 96 17.618 5.894 -0.162 1.00 16.16 N ATOM 1469 CA THR A 96 19.010 5.529 -0.361 1.00 16.21 C ATOM 1470 C THR A 96 19.896 6.274 0.627 1.00 16.38 C ATOM 1471 O THR A 96 19.500 7.299 1.177 1.00 16.68 O ATOM 1472 CB THR A 96 19.507 5.865 -1.778 1.00 16.27 C ATOM 1473 OG1 THR A 96 19.303 7.256 -2.055 1.00 16.29 O ATOM 1474 CG2 THR A 96 18.789 5.029 -2.807 1.00 16.27 C ATOM 1475 HA THR A 96 19.070 4.451 -0.210 1.00 0.00 H ATOM 1476 HB THR A 96 20.573 5.641 -1.829 1.00 0.00 H ATOM 1477 HG1 THR A 96 19.805 7.799 -1.397 1.00 0.00 H ATOM 1478 HG23 THR A 96 18.948 3.973 -2.590 1.00 0.00 H ATOM 1479 HG21 THR A 96 17.722 5.251 -2.774 1.00 0.00 H ATOM 1480 HG22 THR A 96 19.179 5.261 -3.798 1.00 0.00 H ATOM 1481 H THR A 96 17.367 6.903 -0.148 1.00 0.00 H ATOM 1482 N LEU A 97 21.087 5.724 0.844 1.00 15.89 N ATOM 1483 CA LEU A 97 22.168 6.409 1.537 1.00 16.75 C ATOM 1484 C LEU A 97 23.060 7.039 0.491 1.00 16.13 C ATOM 1485 O LEU A 97 23.362 6.412 -0.524 1.00 17.06 O ATOM 1486 CB LEU A 97 23.005 5.414 2.325 1.00 16.81 C ATOM 1487 CG LEU A 97 22.300 4.871 3.560 1.00 19.12 C ATOM 1488 CD1 LEU A 97 22.973 3.581 4.000 1.00 20.74 C ATOM 1489 CD2 LEU A 97 22.292 5.922 4.663 1.00 21.17 C ATOM 1490 HA LEU A 97 21.751 7.151 2.218 1.00 0.00 H ATOM 1491 HB2 LEU A 97 23.252 4.577 1.672 1.00 0.00 H ATOM 1492 HB3 LEU A 97 23.923 5.909 2.641 1.00 0.00 H ATOM 1493 HG LEU A 97 21.260 4.642 3.327 1.00 0.00 H ATOM 1494 HD21 LEU A 97 23.318 6.183 4.922 1.00 0.00 H ATOM 1495 HD22 LEU A 97 21.767 6.811 4.313 1.00 0.00 H ATOM 1496 HD23 LEU A 97 21.785 5.522 5.541 1.00 0.00 H ATOM 1497 HD11 LEU A 97 22.913 2.849 3.195 1.00 0.00 H ATOM 1498 HD12 LEU A 97 24.019 3.780 4.235 1.00 0.00 H ATOM 1499 HD13 LEU A 97 22.468 3.192 4.884 1.00 0.00 H ATOM 1500 H LEU A 97 21.254 4.756 0.502 1.00 0.00 H ATOM 1501 N ASN A 98 23.487 8.272 0.734 1.00 16.01 N ATOM 1502 CA ASN A 98 24.299 8.984 -0.238 1.00 16.74 C ATOM 1503 C ASN A 98 25.453 9.699 0.430 1.00 16.31 C ATOM 1504 O ASN A 98 25.247 10.408 1.412 1.00 16.45 O ATOM 1505 CB ASN A 98 23.440 9.992 -0.997 1.00 16.55 C ATOM 1506 CG ASN A 98 22.323 9.325 -1.764 1.00 18.35 C ATOM 1507 OD1 ASN A 98 21.293 8.962 -1.193 1.00 19.39 O ATOM 1508 ND2 ASN A 98 22.527 9.141 -3.063 1.00 20.67 N ATOM 1509 HA ASN A 98 24.707 8.253 -0.936 1.00 0.00 H ATOM 1510 HB2 ASN A 98 23.007 10.693 -0.283 1.00 0.00 H ATOM 1511 HB3 ASN A 98 24.073 10.535 -1.699 1.00 0.00 H ATOM 1512 HD22 ASN A 98 23.413 9.465 -3.501 1.00 0.00 H ATOM 1513 HD21 ASN A 98 21.801 8.673 -3.642 1.00 0.00 H ATOM 1514 H ASN A 98 23.237 8.734 1.631 1.00 0.00 H ATOM 1515 N PHE A 99 26.656 9.514 -0.107 1.00 16.50 N ATOM 1516 CA PHE A 99 27.803 10.302 0.314 1.00 17.01 C ATOM 1517 C PHE A 99 28.838 10.348 -0.799 1.00 17.50 C ATOM 1518 O PHE A 99 29.894 10.961 -0.640 1.00 18.91 O ATOM 1519 CB PHE A 99 28.402 9.789 1.627 1.00 17.44 C ATOM 1520 CG PHE A 99 28.934 8.380 1.575 1.00 17.84 C ATOM 1521 CD1 PHE A 99 28.084 7.291 1.679 1.00 19.03 C ATOM 1522 CD2 PHE A 99 30.296 8.149 1.478 1.00 18.35 C ATOM 1523 CE1 PHE A 99 28.581 6.001 1.653 1.00 19.25 C ATOM 1524 CE2 PHE A 99 30.795 6.856 1.449 1.00 19.09 C ATOM 1525 CZ PHE A 99 29.939 5.783 1.538 1.00 19.83 C ATOM 1526 HA PHE A 99 27.463 11.319 0.511 1.00 0.00 H ATOM 1527 OXT PHE A 99 28.597 9.787 -1.869 1.00 17.99 O ATOM 1528 HB2 PHE A 99 29.222 10.451 1.907 1.00 0.00 H ATOM 1529 HB3 PHE A 99 27.627 9.830 2.392 1.00 0.00 H ATOM 1530 HD2 PHE A 99 30.983 8.993 1.424 1.00 0.00 H ATOM 1531 HE2 PHE A 99 31.868 6.689 1.355 1.00 0.00 H ATOM 1532 HZ PHE A 99 30.331 4.766 1.518 1.00 0.00 H ATOM 1533 HE1 PHE A 99 27.899 5.154 1.724 1.00 0.00 H ATOM 1534 HD1 PHE A 99 27.011 7.453 1.783 1.00 0.00 H ATOM 1535 H PHE A 99 26.779 8.790 -0.844 1.00 0.00 H TER 1536 PHE A 99 ATOM 1537 N PRO B 1 29.028 7.366 -3.058 1.00 22.24 N ATOM 1538 CA PRO B 1 28.092 6.483 -3.747 1.00 21.82 C ATOM 1539 C PRO B 1 26.647 6.711 -3.333 1.00 21.10 C ATOM 1540 O PRO B 1 26.379 7.445 -2.384 1.00 20.58 O ATOM 1541 CB PRO B 1 28.537 5.091 -3.302 1.00 22.39 C ATOM 1542 CG PRO B 1 29.110 5.303 -1.960 1.00 23.72 C ATOM 1543 CD PRO B 1 29.788 6.644 -2.022 1.00 23.06 C ATOM 1544 HA PRO B 1 28.111 6.646 -4.825 1.00 0.00 H ATOM 1545 HD3 PRO B 1 29.725 7.158 -1.063 1.00 0.00 H ATOM 1546 HD2 PRO B 1 30.835 6.539 -2.308 1.00 0.00 H ATOM 1547 HG3 PRO B 1 29.832 4.521 -1.725 1.00 0.00 H ATOM 1548 HG2 PRO B 1 28.323 5.308 -1.206 1.00 0.00 H ATOM 1549 HB2 PRO B 1 27.687 4.410 -3.256 1.00 0.00 H ATOM 1550 HB3 PRO B 1 29.287 4.689 -3.983 1.00 0.00 H ATOM 1551 N GLN B 2 25.734 6.084 -4.067 1.00 20.31 N ATOM 1552 CA GLN B 2 24.345 5.962 -3.663 1.00 19.84 C ATOM 1553 C GLN B 2 24.115 4.486 -3.385 1.00 18.68 C ATOM 1554 O GLN B 2 24.405 3.641 -4.232 1.00 18.28 O ATOM 1555 CB GLN B 2 23.393 6.437 -4.760 1.00 19.76 C ATOM 1556 CG GLN B 2 21.941 6.152 -4.438 1.00 21.07 C ATOM 1557 CD GLN B 2 20.976 6.992 -5.246 1.00 21.75 C ATOM 1558 OE1 GLN B 2 20.784 8.177 -4.968 1.00 23.97 O ATOM 1559 NE2 GLN B 2 20.358 6.380 -6.250 1.00 25.47 N ATOM 1560 HA GLN B 2 24.149 6.582 -2.788 1.00 0.00 H ATOM 1561 HB2 GLN B 2 23.517 7.512 -4.888 1.00 0.00 H ATOM 1562 HB3 GLN B 2 23.650 5.929 -5.689 1.00 0.00 H ATOM 1563 HG2 GLN B 2 21.740 5.100 -4.642 1.00 0.00 H ATOM 1564 HG3 GLN B 2 21.774 6.354 -3.380 1.00 0.00 H ATOM 1565 HE22 GLN B 2 20.553 5.377 -6.447 1.00 0.00 H ATOM 1566 HE21 GLN B 2 19.680 6.903 -6.839 1.00 0.00 H ATOM 1567 H GLN B 2 26.027 5.662 -4.971 1.00 0.00 H ATOM 1568 N ILE B 3 23.610 4.191 -2.193 1.00 17.79 N ATOM 1569 CA ILE B 3 23.449 2.814 -1.752 1.00 17.93 C ATOM 1570 C ILE B 3 21.978 2.548 -1.469 1.00 16.89 C ATOM 1571 O ILE B 3 21.346 3.271 -0.703 1.00 16.88 O ATOM 1572 CB ILE B 3 24.294 2.537 -0.493 1.00 18.08 C ATOM 1573 CG1 ILE B 3 25.770 2.766 -0.810 1.00 19.15 C ATOM 1574 CG2 ILE B 3 24.061 1.113 0.000 1.00 19.01 C ATOM 1575 CD1 ILE B 3 26.680 2.716 0.392 1.00 19.89 C ATOM 1576 HA ILE B 3 23.796 2.147 -2.541 1.00 0.00 H ATOM 1577 HB ILE B 3 23.993 3.221 0.301 1.00 0.00 H ATOM 1578 HG12 ILE B 3 26.091 1.998 -1.513 1.00 0.00 H ATOM 1579 HG13 ILE B 3 25.871 3.747 -1.274 1.00 0.00 H ATOM 1580 HD11 ILE B 3 26.383 3.487 1.103 1.00 0.00 H ATOM 1581 HD12 ILE B 3 26.603 1.736 0.864 1.00 0.00 H ATOM 1582 HD13 ILE B 3 27.708 2.889 0.075 1.00 0.00 H ATOM 1583 HG21 ILE B 3 23.007 0.982 0.243 1.00 0.00 H ATOM 1584 HG22 ILE B 3 24.345 0.408 -0.781 1.00 0.00 H ATOM 1585 HG23 ILE B 3 24.665 0.934 0.889 1.00 0.00 H ATOM 1586 H ILE B 3 23.322 4.963 -1.559 1.00 0.00 H ATOM 1587 N THR B 4 21.435 1.523 -2.116 1.00 16.26 N ATOM 1588 CA THR B 4 20.057 1.119 -1.869 1.00 16.36 C ATOM 1589 C THR B 4 20.005 0.157 -0.690 1.00 16.23 C ATOM 1590 O THR B 4 21.036 -0.201 -0.121 1.00 16.70 O ATOM 1591 CB THR B 4 19.419 0.487 -3.110 1.00 16.84 C ATOM 1592 OG1 THR B 4 20.201 -0.638 -3.518 1.00 17.75 O ATOM 1593 CG2 THR B 4 19.359 1.496 -4.234 1.00 16.61 C ATOM 1594 HA THR B 4 19.480 2.013 -1.630 1.00 0.00 H ATOM 1595 HB THR B 4 18.406 0.165 -2.870 1.00 0.00 H ATOM 1596 HG1 THR B 4 19.792 -1.049 -4.320 1.00 0.00 H ATOM 1597 HG23 THR B 4 18.762 2.352 -3.920 1.00 0.00 H ATOM 1598 HG21 THR B 4 20.369 1.825 -4.479 1.00 0.00 H ATOM 1599 HG22 THR B 4 18.903 1.035 -5.110 1.00 0.00 H ATOM 1600 H THR B 4 22.004 0.999 -2.812 1.00 0.00 H ATOM 1601 N LEU B 5 18.792 -0.239 -0.319 1.00 15.49 N ATOM 1602 CA LEU B 5 18.570 -0.926 0.946 1.00 15.68 C ATOM 1603 C LEU B 5 17.873 -2.268 0.753 1.00 16.16 C ATOM 1604 O LEU B 5 17.340 -2.828 1.704 1.00 16.15 O ATOM 1605 CB LEU B 5 17.779 -0.003 1.888 1.00 16.11 C ATOM 1606 CG LEU B 5 18.552 1.262 2.264 1.00 16.78 C ATOM 1607 CD1 LEU B 5 17.635 2.247 2.969 1.00 19.08 C ATOM 1608 CD2 LEU B 5 19.762 0.934 3.133 1.00 17.66 C ATOM 1609 HA LEU B 5 19.536 -1.152 1.397 1.00 0.00 H ATOM 1610 HB2 LEU B 5 16.852 0.289 1.393 1.00 0.00 H ATOM 1611 HB3 LEU B 5 17.545 -0.553 2.800 1.00 0.00 H ATOM 1612 HG LEU B 5 18.920 1.721 1.346 1.00 0.00 H ATOM 1613 HD21 LEU B 5 19.428 0.446 4.049 1.00 0.00 H ATOM 1614 HD22 LEU B 5 20.430 0.268 2.587 1.00 0.00 H ATOM 1615 HD23 LEU B 5 20.289 1.855 3.382 1.00 0.00 H ATOM 1616 HD11 LEU B 5 16.813 2.515 2.306 1.00 0.00 H ATOM 1617 HD12 LEU B 5 17.238 1.788 3.875 1.00 0.00 H ATOM 1618 HD13 LEU B 5 18.198 3.143 3.231 1.00 0.00 H ATOM 1619 H LEU B 5 17.983 -0.054 -0.946 1.00 0.00 H ATOM 1620 N TRP B 6 17.895 -2.792 -0.472 1.00 15.96 N ATOM 1621 CA TRP B 6 17.366 -4.125 -0.746 1.00 16.31 C ATOM 1622 C TRP B 6 18.190 -5.186 -0.017 1.00 16.79 C ATOM 1623 O TRP B 6 17.675 -6.240 0.358 1.00 17.41 O ATOM 1624 CB TRP B 6 17.329 -4.375 -2.261 1.00 16.82 C ATOM 1625 CG TRP B 6 16.528 -3.311 -2.962 1.00 17.29 C ATOM 1626 CD1 TRP B 6 17.007 -2.236 -3.653 1.00 18.16 C ATOM 1627 CD2 TRP B 6 15.101 -3.202 -2.994 1.00 16.60 C ATOM 1628 NE1 TRP B 6 15.970 -1.474 -4.127 1.00 17.87 N ATOM 1629 CE2 TRP B 6 14.788 -2.044 -3.733 1.00 17.17 C ATOM 1630 CE3 TRP B 6 14.058 -3.977 -2.476 1.00 16.64 C ATOM 1631 CZ2 TRP B 6 13.479 -1.637 -3.962 1.00 17.17 C ATOM 1632 CZ3 TRP B 6 12.759 -3.574 -2.709 1.00 18.26 C ATOM 1633 CH2 TRP B 6 12.481 -2.413 -3.445 1.00 18.01 C ATOM 1634 HA TRP B 6 16.344 -4.190 -0.371 1.00 0.00 H ATOM 1635 HB2 TRP B 6 18.348 -4.369 -2.649 1.00 0.00 H ATOM 1636 HB3 TRP B 6 16.875 -5.347 -2.451 1.00 0.00 H ATOM 1637 HE1 TRP B 6 16.065 -0.606 -4.692 1.00 0.00 H ATOM 1638 HD1 TRP B 6 18.063 -2.015 -3.806 1.00 0.00 H ATOM 1639 HZ2 TRP B 6 13.258 -0.734 -4.532 1.00 0.00 H ATOM 1640 HH2 TRP B 6 11.443 -2.123 -3.608 1.00 0.00 H ATOM 1641 HZ3 TRP B 6 11.935 -4.168 -2.314 1.00 0.00 H ATOM 1642 HE3 TRP B 6 14.267 -4.879 -1.901 1.00 0.00 H ATOM 1643 H TRP B 6 18.299 -2.237 -1.253 1.00 0.00 H ATOM 1644 N LYS B 7 19.475 -4.899 0.171 1.00 16.65 N ATOM 1645 CA LYS B 7 20.375 -5.701 0.996 1.00 16.53 C ATOM 1646 C LYS B 7 20.907 -4.818 2.121 1.00 16.34 C ATOM 1647 O LYS B 7 20.825 -3.593 2.043 1.00 16.55 O ATOM 1648 CB LYS B 7 21.543 -6.209 0.162 1.00 17.45 C ATOM 1649 HA LYS B 7 19.836 -6.558 1.401 1.00 0.00 H ATOM 1650 HB2 LYS B 7 21.164 -6.824 -0.655 1.00 0.00 H ATOM 1651 HB3 LYS B 7 22.093 -5.361 -0.245 1.00 0.00 H ATOM 1652 H LYS B 7 19.862 -4.054 -0.297 1.00 0.00 H ATOM 1653 N ARG B 8 21.476 -5.434 3.151 1.00 15.63 N ATOM 1654 CA ARG B 8 22.098 -4.661 4.223 1.00 15.95 C ATOM 1655 C ARG B 8 23.183 -3.774 3.636 1.00 16.26 C ATOM 1656 O ARG B 8 23.987 -4.247 2.825 1.00 16.64 O ATOM 1657 CB ARG B 8 22.720 -5.579 5.275 1.00 16.11 C ATOM 1658 CG ARG B 8 21.700 -6.357 6.081 1.00 16.16 C ATOM 1659 CD ARG B 8 22.342 -7.140 7.201 1.00 16.72 C ATOM 1660 NE ARG B 8 21.333 -7.963 7.863 1.00 17.26 N ATOM 1661 CZ ARG B 8 21.540 -9.182 8.351 1.00 17.74 C ATOM 1662 NH1 ARG B 8 22.728 -9.769 8.266 1.00 19.43 N ATOM 1663 NH2 ARG B 8 20.539 -9.832 8.925 1.00 17.33 N ATOM 1664 HA ARG B 8 21.328 -4.056 4.702 1.00 0.00 H ATOM 1665 HB2 ARG B 8 23.374 -6.289 4.769 1.00 0.00 H ATOM 1666 HB3 ARG B 8 23.308 -4.969 5.960 1.00 0.00 H ATOM 1667 HG2 ARG B 8 20.981 -5.658 6.507 1.00 0.00 H ATOM 1668 HG3 ARG B 8 21.182 -7.050 5.418 1.00 0.00 H ATOM 1669 HD2 ARG B 8 22.779 -6.450 7.923 1.00 0.00 H ATOM 1670 HD3 ARG B 8 23.124 -7.781 6.794 1.00 0.00 H ATOM 1671 HE ARG B 8 20.378 -7.564 7.960 1.00 0.00 H ATOM 1672 HH12 ARG B 8 22.865 -10.724 8.655 1.00 0.00 H ATOM 1673 HH11 ARG B 8 23.521 -9.274 7.810 1.00 0.00 H ATOM 1674 HH22 ARG B 8 20.691 -10.786 9.310 1.00 0.00 H ATOM 1675 HH21 ARG B 8 19.601 -9.388 8.991 1.00 0.00 H ATOM 1676 H ARG B 8 21.479 -6.473 3.195 1.00 0.00 H ATOM 1677 N PRO B 9 23.218 -2.493 4.039 1.00 16.10 N ATOM 1678 CA PRO B 9 24.250 -1.599 3.520 1.00 15.87 C ATOM 1679 C PRO B 9 25.617 -1.838 4.161 1.00 16.22 C ATOM 1680 O PRO B 9 26.112 -1.018 4.938 1.00 15.99 O ATOM 1681 CB PRO B 9 23.686 -0.212 3.831 1.00 16.09 C ATOM 1682 CG PRO B 9 22.900 -0.415 5.065 1.00 15.64 C ATOM 1683 CD PRO B 9 22.297 -1.788 4.950 1.00 16.43 C ATOM 1684 HA PRO B 9 24.447 -1.749 2.458 1.00 0.00 H ATOM 1685 HD3 PRO B 9 22.258 -2.279 5.922 1.00 0.00 H ATOM 1686 HD2 PRO B 9 21.293 -1.739 4.528 1.00 0.00 H ATOM 1687 HG3 PRO B 9 22.116 0.338 5.143 1.00 0.00 H ATOM 1688 HG2 PRO B 9 23.547 -0.357 5.940 1.00 0.00 H ATOM 1689 HB2 PRO B 9 24.490 0.505 3.997 1.00 0.00 H ATOM 1690 HB3 PRO B 9 23.049 0.139 3.019 1.00 0.00 H ATOM 1691 N LEU B 10 26.219 -2.970 3.810 1.00 15.60 N ATOM 1692 CA LEU B 10 27.532 -3.338 4.309 1.00 16.31 C ATOM 1693 C LEU B 10 28.588 -2.809 3.353 1.00 17.03 C ATOM 1694 O LEU B 10 28.452 -2.941 2.136 1.00 18.33 O ATOM 1695 CB LEU B 10 27.657 -4.854 4.430 1.00 16.36 C ATOM 1696 CG LEU B 10 26.747 -5.487 5.480 1.00 16.87 C ATOM 1697 CD1 LEU B 10 26.596 -6.979 5.223 1.00 18.59 C ATOM 1698 CD2 LEU B 10 27.271 -5.252 6.890 1.00 18.50 C ATOM 1699 HA LEU B 10 27.673 -2.904 5.299 1.00 0.00 H ATOM 1700 HB2 LEU B 10 27.416 -5.293 3.462 1.00 0.00 H ATOM 1701 HB3 LEU B 10 28.689 -5.090 4.688 1.00 0.00 H ATOM 1702 HG LEU B 10 25.771 -5.009 5.399 1.00 0.00 H ATOM 1703 HD21 LEU B 10 28.264 -5.691 6.985 1.00 0.00 H ATOM 1704 HD22 LEU B 10 27.326 -4.180 7.082 1.00 0.00 H ATOM 1705 HD23 LEU B 10 26.597 -5.717 7.609 1.00 0.00 H ATOM 1706 HD11 LEU B 10 26.161 -7.134 4.236 1.00 0.00 H ATOM 1707 HD12 LEU B 10 27.575 -7.455 5.268 1.00 0.00 H ATOM 1708 HD13 LEU B 10 25.944 -7.413 5.981 1.00 0.00 H ATOM 1709 H LEU B 10 25.732 -3.615 3.155 1.00 0.00 H ATOM 1710 N VAL B 11 29.635 -2.216 3.916 1.00 16.72 N ATOM 1711 CA VAL B 11 30.746 -1.683 3.137 1.00 16.61 C ATOM 1712 C VAL B 11 32.052 -2.069 3.803 1.00 16.87 C ATOM 1713 O VAL B 11 32.058 -2.470 4.956 1.00 17.33 O ATOM 1714 CB VAL B 11 30.688 -0.151 3.018 1.00 16.82 C ATOM 1715 CG1 VAL B 11 29.394 0.273 2.354 1.00 16.95 C ATOM 1716 CG2 VAL B 11 30.850 0.529 4.372 1.00 16.78 C ATOM 1717 HA VAL B 11 30.677 -2.104 2.134 1.00 0.00 H ATOM 1718 HB VAL B 11 31.525 0.167 2.396 1.00 0.00 H ATOM 1719 HG11 VAL B 11 29.338 -0.165 1.358 1.00 0.00 H ATOM 1720 HG12 VAL B 11 28.550 -0.071 2.952 1.00 0.00 H ATOM 1721 HG13 VAL B 11 29.366 1.360 2.276 1.00 0.00 H ATOM 1722 HG21 VAL B 11 30.049 0.206 5.037 1.00 0.00 H ATOM 1723 HG22 VAL B 11 31.813 0.255 4.802 1.00 0.00 H ATOM 1724 HG23 VAL B 11 30.803 1.610 4.242 1.00 0.00 H ATOM 1725 H VAL B 11 29.663 -2.129 4.952 1.00 0.00 H ATOM 1726 N THR B 12 33.152 -1.946 3.073 1.00 17.38 N ATOM 1727 CA THR B 12 34.464 -2.209 3.646 1.00 17.68 C ATOM 1728 C THR B 12 35.017 -0.937 4.292 1.00 18.25 C ATOM 1729 O THR B 12 34.949 0.152 3.714 1.00 18.14 O ATOM 1730 CB THR B 12 35.432 -2.755 2.583 1.00 18.15 C ATOM 1731 OG1 THR B 12 34.864 -3.933 1.996 1.00 18.10 O ATOM 1732 CG2 THR B 12 36.783 -3.111 3.197 1.00 17.86 C ATOM 1733 HA THR B 12 34.360 -2.973 4.417 1.00 0.00 H ATOM 1734 HB THR B 12 35.587 -1.983 1.829 1.00 0.00 H ATOM 1735 HG1 THR B 12 34.721 -4.615 2.700 1.00 0.00 H ATOM 1736 HG23 THR B 12 37.223 -2.220 3.646 1.00 0.00 H ATOM 1737 HG21 THR B 12 36.643 -3.874 3.963 1.00 0.00 H ATOM 1738 HG22 THR B 12 37.445 -3.492 2.419 1.00 0.00 H ATOM 1739 H THR B 12 33.076 -1.657 2.077 1.00 0.00 H ATOM 1740 N ILE B 13 35.553 -1.100 5.499 1.00 18.02 N ATOM 1741 CA ILE B 13 36.249 -0.038 6.207 1.00 17.99 C ATOM 1742 C ILE B 13 37.691 -0.452 6.478 1.00 17.79 C ATOM 1743 O ILE B 13 38.007 -1.643 6.442 1.00 17.89 O ATOM 1744 CB ILE B 13 35.534 0.320 7.540 1.00 18.09 C ATOM 1745 CG1 ILE B 13 35.625 -0.809 8.572 1.00 19.53 C ATOM 1746 CG2 ILE B 13 34.075 0.645 7.275 1.00 17.09 C ATOM 1747 CD1 ILE B 13 35.247 -0.393 9.982 1.00 18.57 C ATOM 1748 HA ILE B 13 36.241 0.851 5.576 1.00 0.00 H ATOM 1749 HB ILE B 13 36.044 1.190 7.954 1.00 0.00 H ATOM 1750 HG12 ILE B 13 34.957 -1.612 8.261 1.00 0.00 H ATOM 1751 HG13 ILE B 13 36.651 -1.177 8.587 1.00 0.00 H ATOM 1752 HD11 ILE B 13 35.914 0.402 10.316 1.00 0.00 H ATOM 1753 HD12 ILE B 13 34.218 -0.033 9.990 1.00 0.00 H ATOM 1754 HD13 ILE B 13 35.338 -1.250 10.649 1.00 0.00 H ATOM 1755 HG21 ILE B 13 34.011 1.493 6.594 1.00 0.00 H ATOM 1756 HG22 ILE B 13 33.587 -0.220 6.827 1.00 0.00 H ATOM 1757 HG23 ILE B 13 33.583 0.894 8.215 1.00 0.00 H ATOM 1758 H ILE B 13 35.470 -2.030 5.957 1.00 0.00 H ATOM 1759 N ARG B 14 38.544 0.532 6.748 1.00 17.70 N ATOM 1760 CA ARG B 14 39.892 0.290 7.256 1.00 18.05 C ATOM 1761 C ARG B 14 40.047 0.923 8.632 1.00 17.97 C ATOM 1762 O ARG B 14 39.702 2.088 8.817 1.00 18.19 O ATOM 1763 CB ARG B 14 40.936 0.899 6.323 1.00 18.22 C ATOM 1764 CG ARG B 14 40.691 0.601 4.858 1.00 18.43 C ATOM 1765 CD ARG B 14 41.995 0.584 4.084 1.00 19.39 C ATOM 1766 NE ARG B 14 42.623 1.900 4.129 1.00 20.63 N ATOM 1767 CZ ARG B 14 43.682 2.244 4.857 1.00 20.81 C ATOM 1768 NH1 ARG B 14 44.314 1.377 5.642 1.00 20.94 N ATOM 1769 NH2 ARG B 14 44.120 3.494 4.786 1.00 22.13 N ATOM 1770 HA ARG B 14 40.043 -0.788 7.317 1.00 0.00 H ATOM 1771 HB2 ARG B 14 40.931 1.980 6.460 1.00 0.00 H ATOM 1772 HB3 ARG B 14 41.914 0.504 6.596 1.00 0.00 H ATOM 1773 HG2 ARG B 14 40.209 -0.372 4.767 1.00 0.00 H ATOM 1774 HG3 ARG B 14 40.038 1.368 4.442 1.00 0.00 H ATOM 1775 HD2 ARG B 14 41.795 0.315 3.047 1.00 0.00 H ATOM 1776 HD3 ARG B 14 42.667 -0.152 4.526 1.00 0.00 H ATOM 1777 HE ARG B 14 42.202 2.642 3.534 1.00 0.00 H ATOM 1778 HH12 ARG B 14 45.139 1.683 6.197 1.00 0.00 H ATOM 1779 HH11 ARG B 14 43.984 0.393 5.702 1.00 0.00 H ATOM 1780 HH22 ARG B 14 44.946 3.788 5.345 1.00 0.00 H ATOM 1781 HH21 ARG B 14 43.637 4.180 4.171 1.00 0.00 H ATOM 1782 H ARG B 14 38.239 1.514 6.591 1.00 0.00 H ATOM 1783 N ILE B 15 40.569 0.165 9.591 1.00 17.79 N ATOM 1784 CA ILE B 15 40.752 0.684 10.942 1.00 17.64 C ATOM 1785 C ILE B 15 41.930 -0.043 11.568 1.00 17.98 C ATOM 1786 O ILE B 15 42.037 -1.259 11.461 1.00 18.57 O ATOM 1787 CB ILE B 15 39.469 0.522 11.776 1.00 17.95 C ATOM 1788 CG1 ILE B 15 39.637 1.142 13.165 1.00 17.60 C ATOM 1789 CG2 ILE B 15 39.066 -0.942 11.876 1.00 17.99 C ATOM 1790 CD1 ILE B 15 38.360 1.122 13.993 1.00 17.54 C ATOM 1791 HA ILE B 15 40.961 1.753 10.910 1.00 0.00 H ATOM 1792 HB ILE B 15 38.667 1.056 11.266 1.00 0.00 H ATOM 1793 HG12 ILE B 15 40.406 0.586 13.701 1.00 0.00 H ATOM 1794 HG13 ILE B 15 39.956 2.177 13.046 1.00 0.00 H ATOM 1795 HD11 ILE B 15 37.583 1.684 13.474 1.00 0.00 H ATOM 1796 HD12 ILE B 15 38.034 0.091 14.131 1.00 0.00 H ATOM 1797 HD13 ILE B 15 38.552 1.577 14.965 1.00 0.00 H ATOM 1798 HG21 ILE B 15 38.886 -1.337 10.876 1.00 0.00 H ATOM 1799 HG22 ILE B 15 39.867 -1.506 12.353 1.00 0.00 H ATOM 1800 HG23 ILE B 15 38.156 -1.027 12.471 1.00 0.00 H ATOM 1801 H ILE B 15 40.851 -0.812 9.375 1.00 0.00 H ATOM 1802 N GLY B 16 42.832 0.703 12.197 1.00 17.83 N ATOM 1803 CA GLY B 16 44.051 0.109 12.745 1.00 17.79 C ATOM 1804 C GLY B 16 44.887 -0.688 11.753 1.00 17.94 C ATOM 1805 O GLY B 16 45.591 -1.622 12.140 1.00 18.45 O ATOM 1806 HA3 GLY B 16 43.765 -0.558 13.558 1.00 0.00 H ATOM 1807 HA2 GLY B 16 44.671 0.914 13.139 1.00 0.00 H ATOM 1808 H GLY B 16 42.669 1.725 12.301 1.00 0.00 H ATOM 1809 N GLY B 17 44.809 -0.332 10.473 1.00 17.49 N ATOM 1810 CA GLY B 17 45.521 -1.052 9.421 1.00 18.14 C ATOM 1811 C GLY B 17 44.786 -2.243 8.833 1.00 18.65 C ATOM 1812 O GLY B 17 45.264 -2.843 7.875 1.00 18.61 O ATOM 1813 HA3 GLY B 17 46.463 -1.410 9.837 1.00 0.00 H ATOM 1814 HA2 GLY B 17 45.725 -0.350 8.612 1.00 0.00 H ATOM 1815 H GLY B 17 44.222 0.486 10.213 1.00 0.00 H ATOM 1816 N GLN B 18 43.628 -2.586 9.389 1.00 18.70 N ATOM 1817 CA GLN B 18 42.903 -3.804 9.019 1.00 19.07 C ATOM 1818 C GLN B 18 41.602 -3.492 8.289 1.00 18.99 C ATOM 1819 O GLN B 18 40.925 -2.524 8.635 1.00 19.73 O ATOM 1820 CB GLN B 18 42.556 -4.591 10.286 1.00 19.19 C ATOM 1821 CG GLN B 18 41.924 -5.954 10.037 1.00 20.18 C ATOM 1822 CD GLN B 18 41.549 -6.668 11.322 1.00 21.34 C ATOM 1823 OE1 GLN B 18 40.919 -6.090 12.206 1.00 25.28 O ATOM 1824 NE2 GLN B 18 41.928 -7.933 11.427 1.00 20.72 N ATOM 1825 HA GLN B 18 43.549 -4.380 8.356 1.00 0.00 H ATOM 1826 HB2 GLN B 18 43.474 -4.741 10.855 1.00 0.00 H ATOM 1827 HB3 GLN B 18 41.858 -3.996 10.875 1.00 0.00 H ATOM 1828 HG2 GLN B 18 41.024 -5.817 9.438 1.00 0.00 H ATOM 1829 HG3 GLN B 18 42.634 -6.573 9.488 1.00 0.00 H ATOM 1830 HE22 GLN B 18 42.460 -8.382 10.654 1.00 0.00 H ATOM 1831 HE21 GLN B 18 41.694 -8.477 12.282 1.00 0.00 H ATOM 1832 H GLN B 18 43.220 -1.964 10.116 1.00 0.00 H ATOM 1833 N LEU B 19 41.257 -4.322 7.307 1.00 18.59 N ATOM 1834 CA LEU B 19 39.964 -4.251 6.630 1.00 18.80 C ATOM 1835 C LEU B 19 38.888 -5.023 7.381 1.00 18.75 C ATOM 1836 O LEU B 19 39.127 -6.128 7.864 1.00 19.34 O ATOM 1837 CB LEU B 19 40.049 -4.828 5.218 1.00 18.67 C ATOM 1838 CG LEU B 19 40.995 -4.154 4.230 1.00 20.16 C ATOM 1839 CD1 LEU B 19 40.903 -4.829 2.868 1.00 19.39 C ATOM 1840 CD2 LEU B 19 40.670 -2.684 4.133 1.00 21.46 C ATOM 1841 HA LEU B 19 39.699 -3.194 6.593 1.00 0.00 H ATOM 1842 HB2 LEU B 19 40.362 -5.868 5.310 1.00 0.00 H ATOM 1843 HB3 LEU B 19 39.048 -4.787 4.789 1.00 0.00 H ATOM 1844 HG LEU B 19 42.020 -4.256 4.586 1.00 0.00 H ATOM 1845 HD21 LEU B 19 39.643 -2.562 3.790 1.00 0.00 H ATOM 1846 HD22 LEU B 19 40.784 -2.223 5.114 1.00 0.00 H ATOM 1847 HD23 LEU B 19 41.350 -2.209 3.426 1.00 0.00 H ATOM 1848 HD11 LEU B 19 41.177 -5.879 2.965 1.00 0.00 H ATOM 1849 HD12 LEU B 19 39.882 -4.752 2.494 1.00 0.00 H ATOM 1850 HD13 LEU B 19 41.584 -4.337 2.173 1.00 0.00 H ATOM 1851 H LEU B 19 41.936 -5.051 7.009 1.00 0.00 H ATOM 1852 N LYS B 20 37.704 -4.423 7.459 1.00 18.51 N ATOM 1853 CA LYS B 20 36.536 -5.050 8.059 1.00 18.59 C ATOM 1854 C LYS B 20 35.299 -4.697 7.249 1.00 18.27 C ATOM 1855 O LYS B 20 35.281 -3.697 6.538 1.00 18.15 O ATOM 1856 CB LYS B 20 36.324 -4.531 9.479 1.00 19.44 C ATOM 1857 CG LYS B 20 37.449 -4.830 10.439 1.00 19.82 C ATOM 1858 CD LYS B 20 37.130 -4.221 11.788 1.00 20.82 C ATOM 1859 CE LYS B 20 38.014 -4.778 12.881 1.00 23.75 C ATOM 1860 NZ LYS B 20 37.850 -6.243 13.051 1.00 23.51 N ATOM 1861 HA LYS B 20 36.697 -6.128 8.075 1.00 0.00 H ATOM 1862 HB2 LYS B 20 36.199 -3.449 9.429 1.00 0.00 H ATOM 1863 HB3 LYS B 20 35.413 -4.983 9.873 1.00 0.00 H ATOM 1864 HG2 LYS B 20 37.562 -5.909 10.544 1.00 0.00 H ATOM 1865 HG3 LYS B 20 38.377 -4.404 10.057 1.00 0.00 H ATOM 1866 HD2 LYS B 20 37.276 -3.142 11.732 1.00 0.00 H ATOM 1867 HD3 LYS B 20 36.089 -4.433 12.034 1.00 0.00 H ATOM 1868 HE2 LYS B 20 37.762 -4.286 13.820 1.00 0.00 H ATOM 1869 HE3 LYS B 20 39.054 -4.569 12.631 1.00 0.00 H ATOM 1870 HZ1 LYS B 20 36.862 -6.454 13.298 1.00 0.00 H ATOM 1871 HZ2 LYS B 20 38.096 -6.724 12.162 1.00 0.00 H ATOM 1872 HZ3 LYS B 20 38.477 -6.575 13.811 1.00 0.00 H ATOM 1873 H LYS B 20 37.608 -3.462 7.074 1.00 0.00 H ATOM 1874 N GLU B 21 34.261 -5.514 7.381 1.00 16.60 N ATOM 1875 CA GLU B 21 32.957 -5.190 6.815 1.00 17.05 C ATOM 1876 C GLU B 21 32.104 -4.536 7.891 1.00 16.45 C ATOM 1877 O GLU B 21 32.049 -5.029 9.014 1.00 16.81 O ATOM 1878 CB GLU B 21 32.250 -6.457 6.329 1.00 17.09 C ATOM 1879 CG GLU B 21 32.970 -7.147 5.184 1.00 18.73 C ATOM 1880 CD GLU B 21 33.123 -6.237 3.982 1.00 19.79 C ATOM 1881 OE1 GLU B 21 34.278 -5.911 3.630 1.00 20.96 O ATOM 1882 OE2 GLU B 21 32.083 -5.842 3.410 1.00 23.36 O ATOM 1883 HA GLU B 21 33.097 -4.516 5.970 1.00 0.00 H ATOM 1884 HB2 GLU B 21 32.178 -7.155 7.163 1.00 0.00 H ATOM 1885 HB3 GLU B 21 31.248 -6.188 5.995 1.00 0.00 H ATOM 1886 HG2 GLU B 21 33.960 -7.453 5.523 1.00 0.00 H ATOM 1887 HG3 GLU B 21 32.400 -8.028 4.889 1.00 0.00 H ATOM 1888 H GLU B 21 34.381 -6.407 7.901 1.00 0.00 H ATOM 1889 N ALA B 22 31.430 -3.441 7.556 1.00 15.91 N ATOM 1890 CA ALA B 22 30.614 -2.737 8.536 1.00 16.00 C ATOM 1891 C ALA B 22 29.324 -2.217 7.925 1.00 15.79 C ATOM 1892 O ALA B 22 29.250 -1.936 6.727 1.00 15.91 O ATOM 1893 CB ALA B 22 31.402 -1.585 9.153 1.00 16.35 C ATOM 1894 HA ALA B 22 30.350 -3.451 9.316 1.00 0.00 H ATOM 1895 HB1 ALA B 22 32.291 -1.978 9.646 1.00 0.00 H ATOM 1896 HB2 ALA B 22 31.698 -0.888 8.369 1.00 0.00 H ATOM 1897 HB3 ALA B 22 30.778 -1.069 9.883 1.00 0.00 H ATOM 1898 H ALA B 22 31.486 -3.082 6.582 1.00 0.00 H ATOM 1899 N LEU B 23 28.320 -2.076 8.779 1.00 15.60 N ATOM 1900 CA LEU B 23 26.975 -1.666 8.377 1.00 15.73 C ATOM 1901 C LEU B 23 26.796 -0.159 8.542 1.00 15.19 C ATOM 1902 O LEU B 23 27.026 0.364 9.629 1.00 15.85 O ATOM 1903 CB LEU B 23 25.985 -2.398 9.287 1.00 17.08 C ATOM 1904 CG LEU B 23 24.476 -2.311 9.052 1.00 17.13 C ATOM 1905 CD1 LEU B 23 24.109 -3.015 7.766 1.00 19.36 C ATOM 1906 CD2 LEU B 23 23.735 -2.952 10.222 1.00 17.73 C ATOM 1907 HA LEU B 23 26.808 -1.911 7.328 1.00 0.00 H ATOM 1908 HB2 LEU B 23 26.245 -3.456 9.238 1.00 0.00 H ATOM 1909 HB3 LEU B 23 26.162 -2.028 10.297 1.00 0.00 H ATOM 1910 HG LEU B 23 24.189 -1.262 8.975 1.00 0.00 H ATOM 1911 HD21 LEU B 23 24.028 -3.998 10.307 1.00 0.00 H ATOM 1912 HD22 LEU B 23 23.989 -2.427 11.143 1.00 0.00 H ATOM 1913 HD23 LEU B 23 22.661 -2.887 10.049 1.00 0.00 H ATOM 1914 HD11 LEU B 23 24.629 -2.542 6.933 1.00 0.00 H ATOM 1915 HD12 LEU B 23 24.402 -4.063 7.831 1.00 0.00 H ATOM 1916 HD13 LEU B 23 23.032 -2.946 7.610 1.00 0.00 H ATOM 1917 H LEU B 23 28.498 -2.267 9.786 1.00 0.00 H ATOM 1918 N LEU B 24 26.371 0.535 7.490 1.00 14.61 N ATOM 1919 CA LEU B 24 26.101 1.968 7.588 1.00 14.73 C ATOM 1920 C LEU B 24 24.723 2.138 8.200 1.00 15.04 C ATOM 1921 O LEU B 24 23.719 1.821 7.555 1.00 15.77 O ATOM 1922 CB LEU B 24 26.161 2.657 6.222 1.00 14.91 C ATOM 1923 CG LEU B 24 27.473 2.470 5.469 1.00 15.91 C ATOM 1924 CD1 LEU B 24 27.396 3.159 4.112 1.00 18.37 C ATOM 1925 CD2 LEU B 24 28.662 2.972 6.275 1.00 17.20 C ATOM 1926 HA LEU B 24 26.865 2.435 8.209 1.00 0.00 H ATOM 1927 HB2 LEU B 24 25.356 2.258 5.605 1.00 0.00 H ATOM 1928 HB3 LEU B 24 26.006 3.725 6.374 1.00 0.00 H ATOM 1929 HG LEU B 24 27.626 1.402 5.312 1.00 0.00 H ATOM 1930 HD21 LEU B 24 28.535 4.034 6.485 1.00 0.00 H ATOM 1931 HD22 LEU B 24 28.723 2.420 7.213 1.00 0.00 H ATOM 1932 HD23 LEU B 24 29.577 2.820 5.703 1.00 0.00 H ATOM 1933 HD11 LEU B 24 26.583 2.724 3.531 1.00 0.00 H ATOM 1934 HD12 LEU B 24 27.213 4.224 4.256 1.00 0.00 H ATOM 1935 HD13 LEU B 24 28.338 3.020 3.581 1.00 0.00 H ATOM 1936 H LEU B 24 26.228 0.049 6.582 1.00 0.00 H ATOM 1937 N ASP B 25 24.681 2.622 9.439 1.00 14.90 N ATOM 1938 CA ASP B 25 23.460 2.550 10.233 1.00 14.63 C ATOM 1939 C ASP B 25 22.968 3.910 10.713 1.00 14.33 C ATOM 1940 O ASP B 25 23.446 4.424 11.725 1.00 14.31 O ATOM 1941 CB ASP B 25 23.676 1.658 11.454 1.00 14.50 C ATOM 1942 CG ASP B 25 22.388 1.416 12.229 1.00 15.43 C ATOM 1943 OD1 ASP B 25 21.323 1.946 11.833 1.00 16.16 O ATOM 1944 OD2 ASP B 25 22.462 0.682 13.228 1.00 18.74 O ATOM 1945 HA ASP B 25 22.699 2.135 9.572 1.00 0.00 H ATOM 1946 HB2 ASP B 25 24.071 0.698 11.121 1.00 0.00 H ATOM 1947 HB3 ASP B 25 24.398 2.137 12.115 1.00 0.00 H ATOM 1948 H ASP B 25 25.532 3.058 9.847 1.00 0.00 H ATOM 1949 N THR B 26 21.985 4.466 10.014 1.00 14.30 N ATOM 1950 CA THR B 26 21.426 5.755 10.410 1.00 14.47 C ATOM 1951 C THR B 26 20.678 5.714 11.743 1.00 14.77 C ATOM 1952 O THR B 26 20.449 6.757 12.358 1.00 15.00 O ATOM 1953 CB THR B 26 20.476 6.280 9.329 1.00 14.64 C ATOM 1954 OG1 THR B 26 19.395 5.356 9.152 1.00 13.40 O ATOM 1955 CG2 THR B 26 21.212 6.416 8.004 1.00 14.43 C ATOM 1956 HA THR B 26 22.280 6.421 10.534 1.00 0.00 H ATOM 1957 HB THR B 26 20.097 7.253 9.642 1.00 0.00 H ATOM 1958 HG1 THR B 26 18.903 5.259 10.005 1.00 0.00 H ATOM 1959 HG23 THR B 26 22.039 7.116 8.120 1.00 0.00 H ATOM 1960 HG21 THR B 26 21.598 5.442 7.703 1.00 0.00 H ATOM 1961 HG22 THR B 26 20.524 6.787 7.244 1.00 0.00 H ATOM 1962 H THR B 26 21.610 3.978 9.176 1.00 0.00 H ATOM 1963 N GLY B 27 20.269 4.529 12.192 1.00 14.46 N ATOM 1964 CA GLY B 27 19.604 4.400 13.482 1.00 14.70 C ATOM 1965 C GLY B 27 20.544 4.396 14.669 1.00 14.77 C ATOM 1966 O GLY B 27 20.093 4.522 15.811 1.00 16.09 O ATOM 1967 HA3 GLY B 27 19.044 3.465 13.486 1.00 0.00 H ATOM 1968 HA2 GLY B 27 18.913 5.236 13.596 1.00 0.00 H ATOM 1969 H GLY B 27 20.427 3.681 11.612 1.00 0.00 H ATOM 1970 N ALA B 28 21.843 4.244 14.418 1.00 14.10 N ATOM 1971 CA ALA B 28 22.806 4.124 15.508 1.00 14.02 C ATOM 1972 C ALA B 28 23.437 5.474 15.815 1.00 14.18 C ATOM 1973 O ALA B 28 23.995 6.115 14.921 1.00 14.45 O ATOM 1974 CB ALA B 28 23.878 3.114 15.140 1.00 14.15 C ATOM 1975 HA ALA B 28 22.284 3.779 16.400 1.00 0.00 H ATOM 1976 HB1 ALA B 28 23.415 2.144 14.960 1.00 0.00 H ATOM 1977 HB2 ALA B 28 24.393 3.445 14.238 1.00 0.00 H ATOM 1978 HB3 ALA B 28 24.593 3.030 15.959 1.00 0.00 H ATOM 1979 H ALA B 28 22.175 4.210 13.433 1.00 0.00 H ATOM 1980 N ASP B 29 23.371 5.898 17.074 1.00 14.18 N ATOM 1981 CA ASP B 29 23.998 7.161 17.453 1.00 14.61 C ATOM 1982 C ASP B 29 25.510 7.025 17.397 1.00 15.08 C ATOM 1983 O ASP B 29 26.217 7.990 17.081 1.00 15.45 O ATOM 1984 CB ASP B 29 23.632 7.555 18.883 1.00 14.52 C ATOM 1985 CG ASP B 29 22.155 7.821 19.079 1.00 16.38 C ATOM 1986 OD1 ASP B 29 21.401 7.975 18.098 1.00 15.80 O ATOM 1987 OD2 ASP B 29 21.756 7.874 20.262 1.00 17.74 O ATOM 1988 HA ASP B 29 23.642 7.920 16.756 1.00 0.00 H ATOM 1989 HB2 ASP B 29 23.928 6.746 19.550 1.00 0.00 H ATOM 1990 HB3 ASP B 29 24.183 8.459 19.143 1.00 0.00 H ATOM 1991 H ASP B 29 22.873 5.330 17.789 1.00 0.00 H ATOM 1992 N ASP B 30 25.982 5.835 17.761 1.00 14.49 N ATOM 1993 CA ASP B 30 27.396 5.542 17.947 1.00 14.99 C ATOM 1994 C ASP B 30 27.893 4.452 17.017 1.00 15.08 C ATOM 1995 O ASP B 30 27.117 3.713 16.420 1.00 15.86 O ATOM 1996 CB ASP B 30 27.643 5.057 19.378 1.00 15.46 C ATOM 1997 CG ASP B 30 27.138 6.023 20.418 1.00 17.37 C ATOM 1998 OD1 ASP B 30 27.461 7.220 20.321 1.00 19.27 O ATOM 1999 OD2 ASP B 30 26.419 5.575 21.337 1.00 24.21 O ATOM 2000 HA ASP B 30 27.931 6.467 17.732 1.00 0.00 H ATOM 2001 HB2 ASP B 30 27.136 4.102 19.514 1.00 0.00 H ATOM 2002 HB3 ASP B 30 28.715 4.921 19.520 1.00 0.00 H ATOM 2003 H ASP B 30 25.299 5.067 17.922 1.00 0.00 H ATOM 2004 N THR B 31 29.216 4.356 16.926 1.00 14.81 N ATOM 2005 CA THR B 31 29.869 3.332 16.128 1.00 14.96 C ATOM 2006 C THR B 31 30.316 2.210 17.061 1.00 15.46 C ATOM 2007 O THR B 31 31.034 2.452 18.027 1.00 15.12 O ATOM 2008 CB THR B 31 31.047 3.955 15.376 1.00 15.21 C ATOM 2009 OG1 THR B 31 30.528 4.874 14.409 1.00 14.73 O ATOM 2010 CG2 THR B 31 31.911 2.908 14.678 1.00 15.52 C ATOM 2011 HA THR B 31 29.189 2.914 15.386 1.00 0.00 H ATOM 2012 HB THR B 31 31.685 4.463 16.099 1.00 0.00 H ATOM 2013 HG1 THR B 31 30.009 5.579 14.871 1.00 0.00 H ATOM 2014 HG23 THR B 31 32.304 2.211 15.418 1.00 0.00 H ATOM 2015 HG21 THR B 31 31.306 2.366 13.951 1.00 0.00 H ATOM 2016 HG22 THR B 31 32.738 3.402 14.168 1.00 0.00 H ATOM 2017 H THR B 31 29.805 5.038 17.445 1.00 0.00 H ATOM 2018 N VAL B 32 29.859 0.996 16.766 1.00 15.67 N ATOM 2019 CA VAL B 32 30.136 -0.153 17.620 1.00 15.85 C ATOM 2020 C VAL B 32 30.704 -1.284 16.783 1.00 16.53 C ATOM 2021 O VAL B 32 30.026 -1.823 15.903 1.00 17.16 O ATOM 2022 CB VAL B 32 28.876 -0.662 18.345 1.00 15.65 C ATOM 2023 CG1 VAL B 32 29.249 -1.743 19.363 1.00 16.65 C ATOM 2024 CG2 VAL B 32 28.184 0.489 19.053 1.00 15.66 C ATOM 2025 HA VAL B 32 30.853 0.173 18.374 1.00 0.00 H ATOM 2026 HB VAL B 32 28.198 -1.090 17.606 1.00 0.00 H ATOM 2027 HG11 VAL B 32 29.725 -2.577 18.847 1.00 0.00 H ATOM 2028 HG12 VAL B 32 29.939 -1.327 20.097 1.00 0.00 H ATOM 2029 HG13 VAL B 32 28.348 -2.092 19.867 1.00 0.00 H ATOM 2030 HG21 VAL B 32 28.865 0.928 19.782 1.00 0.00 H ATOM 2031 HG22 VAL B 32 27.897 1.244 18.321 1.00 0.00 H ATOM 2032 HG23 VAL B 32 27.294 0.118 19.562 1.00 0.00 H ATOM 2033 H VAL B 32 29.290 0.863 15.905 1.00 0.00 H ATOM 2034 N LEU B 33 31.951 -1.641 17.073 1.00 17.76 N ATOM 2035 CA LEU B 33 32.623 -2.723 16.371 1.00 18.18 C ATOM 2036 C LEU B 33 32.695 -3.971 17.238 1.00 19.00 C ATOM 2037 O LEU B 33 32.666 -3.904 18.467 1.00 20.16 O ATOM 2038 CB LEU B 33 34.033 -2.308 15.947 1.00 18.78 C ATOM 2039 CG LEU B 33 34.130 -1.015 15.139 1.00 21.17 C ATOM 2040 CD1 LEU B 33 35.538 -0.875 14.588 1.00 23.07 C ATOM 2041 CD2 LEU B 33 33.126 -0.965 14.008 1.00 21.73 C ATOM 2042 HA LEU B 33 32.039 -2.947 15.478 1.00 0.00 H ATOM 2043 HB2 LEU B 33 34.631 -2.184 16.850 1.00 0.00 H ATOM 2044 HB3 LEU B 33 34.451 -3.113 15.343 1.00 0.00 H ATOM 2045 HG LEU B 33 33.900 -0.186 15.808 1.00 0.00 H ATOM 2046 HD21 LEU B 33 33.302 -1.800 13.330 1.00 0.00 H ATOM 2047 HD22 LEU B 33 32.117 -1.033 14.416 1.00 0.00 H ATOM 2048 HD23 LEU B 33 33.238 -0.026 13.466 1.00 0.00 H ATOM 2049 HD11 LEU B 33 36.249 -0.845 15.414 1.00 0.00 H ATOM 2050 HD12 LEU B 33 35.762 -1.726 13.945 1.00 0.00 H ATOM 2051 HD13 LEU B 33 35.611 0.047 14.011 1.00 0.00 H ATOM 2052 H LEU B 33 32.461 -1.132 17.823 1.00 0.00 H ATOM 2053 N GLU B 34 32.800 -5.109 16.565 1.00 19.29 N ATOM 2054 CA GLU B 34 32.994 -6.383 17.233 1.00 20.21 C ATOM 2055 C GLU B 34 34.304 -6.345 18.009 1.00 20.59 C ATOM 2056 O GLU B 34 35.186 -5.524 17.737 1.00 20.18 O ATOM 2057 CB GLU B 34 33.018 -7.507 16.198 1.00 20.24 C ATOM 2058 CG GLU B 34 31.723 -7.649 15.399 1.00 21.24 C ATOM 2059 CD GLU B 34 31.913 -8.302 14.046 1.00 21.82 C ATOM 2060 OE1 GLU B 34 32.996 -8.870 13.790 1.00 22.58 O ATOM 2061 OE2 GLU B 34 30.967 -8.247 13.233 1.00 24.88 O ATOM 2062 HA GLU B 34 32.174 -6.568 17.927 1.00 0.00 H ATOM 2063 HB2 GLU B 34 33.832 -7.312 15.499 1.00 0.00 H ATOM 2064 HB3 GLU B 34 33.205 -8.447 16.718 1.00 0.00 H ATOM 2065 HG2 GLU B 34 31.025 -8.253 15.978 1.00 0.00 H ATOM 2066 HG3 GLU B 34 31.302 -6.655 15.246 1.00 0.00 H ATOM 2067 H GLU B 34 32.742 -5.088 15.527 1.00 0.00 H ATOM 2068 N GLU B 35 34.419 -7.229 18.992 1.00 21.42 N ATOM 2069 CA GLU B 35 35.600 -7.259 19.838 1.00 22.90 C ATOM 2070 C GLU B 35 36.863 -7.353 18.987 1.00 23.10 C ATOM 2071 O GLU B 35 36.947 -8.159 18.058 1.00 23.12 O ATOM 2072 CB GLU B 35 35.511 -8.421 20.830 1.00 23.12 C ATOM 2073 CG GLU B 35 34.479 -8.189 21.932 1.00 24.83 C ATOM 2074 CD GLU B 35 34.232 -9.410 22.797 1.00 25.93 C ATOM 2075 OE1 GLU B 35 34.407 -10.546 22.307 1.00 30.27 O ATOM 2076 OE2 GLU B 35 33.850 -9.239 23.976 1.00 29.25 O ATOM 2077 HA GLU B 35 35.650 -6.331 20.408 1.00 0.00 H ATOM 2078 HB2 GLU B 35 35.239 -9.324 20.284 1.00 0.00 H ATOM 2079 HB3 GLU B 35 36.488 -8.558 21.293 1.00 0.00 H ATOM 2080 HG2 GLU B 35 34.832 -7.379 22.571 1.00 0.00 H ATOM 2081 HG3 GLU B 35 33.537 -7.899 21.467 1.00 0.00 H ATOM 2082 H GLU B 35 33.652 -7.911 19.159 1.00 0.00 H ATOM 2083 N MET B 36 37.828 -6.501 19.312 1.00 23.62 N ATOM 2084 CA MET B 36 39.061 -6.369 18.552 1.00 24.28 C ATOM 2085 C MET B 36 40.036 -5.557 19.387 1.00 24.52 C ATOM 2086 O MET B 36 39.646 -4.902 20.353 1.00 25.84 O ATOM 2087 CB MET B 36 38.812 -5.615 17.246 1.00 24.50 C ATOM 2088 CG MET B 36 38.423 -4.158 17.463 1.00 25.35 C ATOM 2089 SD MET B 36 38.186 -3.218 15.940 1.00 26.18 S ATOM 2090 CE MET B 36 39.843 -3.246 15.261 1.00 28.18 C ATOM 2091 HA MET B 36 39.451 -7.360 18.322 1.00 0.00 H ATOM 2092 HB2 MET B 36 39.723 -5.646 16.648 1.00 0.00 H ATOM 2093 HB3 MET B 36 38.007 -6.113 16.706 1.00 0.00 H ATOM 2094 HG2 MET B 36 39.211 -3.677 18.043 1.00 0.00 H ATOM 2095 HG3 MET B 36 37.491 -4.134 18.028 1.00 0.00 H ATOM 2096 HE1 MET B 36 40.530 -2.773 15.963 1.00 0.00 H ATOM 2097 HE2 MET B 36 40.148 -4.279 15.093 1.00 0.00 H ATOM 2098 HE3 MET B 36 39.856 -2.703 14.316 1.00 0.00 H ATOM 2099 H MET B 36 37.696 -5.899 20.150 1.00 0.00 H ATOM 2100 N ASN B 37 41.302 -5.595 18.995 1.00 24.89 N ATOM 2101 CA ASN B 37 42.312 -4.733 19.582 1.00 24.27 C ATOM 2102 C ASN B 37 42.418 -3.440 18.788 1.00 24.09 C ATOM 2103 O ASN B 37 42.388 -3.461 17.562 1.00 24.40 O ATOM 2104 CB ASN B 37 43.654 -5.458 19.596 1.00 24.57 C ATOM 2105 CG ASN B 37 43.637 -6.676 20.496 1.00 25.70 C ATOM 2106 OD1 ASN B 37 43.160 -6.612 21.629 1.00 27.21 O ATOM 2107 ND2 ASN B 37 44.151 -7.793 19.997 1.00 25.84 N ATOM 2108 HA ASN B 37 42.029 -4.489 20.606 1.00 0.00 H ATOM 2109 HB2 ASN B 37 43.893 -5.775 18.581 1.00 0.00 H ATOM 2110 HB3 ASN B 37 44.421 -4.770 19.951 1.00 0.00 H ATOM 2111 HD22 ASN B 37 44.543 -7.800 19.034 1.00 0.00 H ATOM 2112 HD21 ASN B 37 44.162 -8.661 20.569 1.00 0.00 H ATOM 2113 H ASN B 37 41.579 -6.261 18.246 1.00 0.00 H ATOM 2114 N LEU B 38 42.524 -2.318 19.491 1.00 23.53 N ATOM 2115 CA LEU B 38 42.792 -1.037 18.858 1.00 23.75 C ATOM 2116 C LEU B 38 43.859 -0.351 19.693 1.00 23.25 C ATOM 2117 O LEU B 38 43.918 -0.551 20.904 1.00 23.23 O ATOM 2118 CB LEU B 38 41.535 -0.167 18.797 1.00 23.85 C ATOM 2119 CG LEU B 38 40.505 -0.495 17.715 1.00 25.26 C ATOM 2120 CD1 LEU B 38 39.216 0.290 17.923 1.00 25.35 C ATOM 2121 CD2 LEU B 38 41.079 -0.221 16.330 1.00 25.84 C ATOM 2122 HA LEU B 38 43.122 -1.188 17.830 1.00 0.00 H ATOM 2123 HB2 LEU B 38 41.034 -0.248 19.762 1.00 0.00 H ATOM 2124 HB3 LEU B 38 41.857 0.863 18.641 1.00 0.00 H ATOM 2125 HG LEU B 38 40.267 -1.556 17.791 1.00 0.00 H ATOM 2126 HD21 LEU B 38 41.351 0.832 16.253 1.00 0.00 H ATOM 2127 HD22 LEU B 38 41.964 -0.839 16.176 1.00 0.00 H ATOM 2128 HD23 LEU B 38 40.331 -0.461 15.574 1.00 0.00 H ATOM 2129 HD11 LEU B 38 38.792 0.038 18.895 1.00 0.00 H ATOM 2130 HD12 LEU B 38 39.432 1.358 17.885 1.00 0.00 H ATOM 2131 HD13 LEU B 38 38.505 0.034 17.137 1.00 0.00 H ATOM 2132 H LEU B 38 42.412 -2.357 20.524 1.00 0.00 H ATOM 2133 N PRO B 39 44.708 0.460 19.052 1.00 23.78 N ATOM 2134 CA PRO B 39 45.770 1.064 19.846 1.00 23.94 C ATOM 2135 C PRO B 39 45.258 2.168 20.767 1.00 23.96 C ATOM 2136 O PRO B 39 44.261 2.829 20.464 1.00 24.54 O ATOM 2137 CB PRO B 39 46.735 1.616 18.796 1.00 23.86 C ATOM 2138 CG PRO B 39 45.939 1.770 17.553 1.00 24.41 C ATOM 2139 CD PRO B 39 44.759 0.850 17.632 1.00 23.82 C ATOM 2140 HA PRO B 39 46.235 0.345 20.520 1.00 0.00 H ATOM 2141 HD3 PRO B 39 43.845 1.365 17.338 1.00 0.00 H ATOM 2142 HD2 PRO B 39 44.904 -0.022 16.995 1.00 0.00 H ATOM 2143 HG3 PRO B 39 46.551 1.511 16.689 1.00 0.00 H ATOM 2144 HG2 PRO B 39 45.597 2.801 17.459 1.00 0.00 H ATOM 2145 HB2 PRO B 39 47.132 2.580 19.115 1.00 0.00 H ATOM 2146 HB3 PRO B 39 47.559 0.921 18.635 1.00 0.00 H ATOM 2147 N GLY B 40 45.943 2.335 21.893 1.00 23.95 N ATOM 2148 CA GLY B 40 45.698 3.444 22.806 1.00 23.57 C ATOM 2149 C GLY B 40 44.822 3.076 23.985 1.00 23.43 C ATOM 2150 O GLY B 40 44.396 1.929 24.142 1.00 23.64 O ATOM 2151 HA3 GLY B 40 45.211 4.246 22.252 1.00 0.00 H ATOM 2152 HA2 GLY B 40 46.657 3.797 23.186 1.00 0.00 H ATOM 2153 H GLY B 40 46.684 1.646 22.133 1.00 0.00 H ATOM 2154 N LYS B 41 44.550 4.073 24.819 1.00 22.51 N ATOM 2155 CA LYS B 41 43.764 3.876 26.027 1.00 22.07 C ATOM 2156 C LYS B 41 42.301 3.693 25.654 1.00 21.42 C ATOM 2157 O LYS B 41 41.844 4.227 24.644 1.00 22.75 O ATOM 2158 CB LYS B 41 43.926 5.070 26.947 1.00 22.16 C ATOM 2159 HA LYS B 41 44.114 2.985 26.548 1.00 0.00 H ATOM 2160 HB2 LYS B 41 44.977 5.181 27.215 1.00 0.00 H ATOM 2161 HB3 LYS B 41 43.583 5.970 26.436 1.00 0.00 H ATOM 2162 H LYS B 41 44.910 5.024 24.602 1.00 0.00 H ATOM 2163 N TRP B 42 41.576 2.918 26.453 1.00 20.48 N ATOM 2164 CA TRP B 42 40.127 2.883 26.348 1.00 19.86 C ATOM 2165 C TRP B 42 39.491 3.011 27.720 1.00 19.74 C ATOM 2166 O TRP B 42 40.136 2.754 28.737 1.00 19.12 O ATOM 2167 CB TRP B 42 39.640 1.613 25.649 1.00 19.30 C ATOM 2168 CG TRP B 42 40.074 0.315 26.270 1.00 18.92 C ATOM 2169 CD1 TRP B 42 41.183 -0.408 25.954 1.00 19.60 C ATOM 2170 CD2 TRP B 42 39.395 -0.421 27.300 1.00 18.24 C ATOM 2171 NE1 TRP B 42 41.242 -1.544 26.724 1.00 19.93 N ATOM 2172 CE2 TRP B 42 40.157 -1.577 27.559 1.00 19.15 C ATOM 2173 CE3 TRP B 42 38.221 -0.213 28.027 1.00 18.60 C ATOM 2174 CZ2 TRP B 42 39.783 -2.519 28.515 1.00 19.01 C ATOM 2175 CZ3 TRP B 42 37.849 -1.150 28.980 1.00 18.56 C ATOM 2176 CH2 TRP B 42 38.628 -2.290 29.212 1.00 18.82 C ATOM 2177 HA TRP B 42 39.822 3.733 25.737 1.00 0.00 H ATOM 2178 HB2 TRP B 42 38.550 1.632 25.642 1.00 0.00 H ATOM 2179 HB3 TRP B 42 40.009 1.633 24.624 1.00 0.00 H ATOM 2180 HE1 TRP B 42 41.991 -2.264 26.680 1.00 0.00 H ATOM 2181 HD1 TRP B 42 41.918 -0.126 25.200 1.00 0.00 H ATOM 2182 HZ2 TRP B 42 40.388 -3.406 28.701 1.00 0.00 H ATOM 2183 HH2 TRP B 42 38.307 -3.011 29.964 1.00 0.00 H ATOM 2184 HZ3 TRP B 42 36.937 -0.996 29.557 1.00 0.00 H ATOM 2185 HE3 TRP B 42 37.608 0.670 27.849 1.00 0.00 H ATOM 2186 H TRP B 42 42.052 2.328 27.164 1.00 0.00 H ATOM 2187 N LYS B 43 38.223 3.413 27.717 1.00 19.16 N ATOM 2188 CA LYS B 43 37.453 3.630 28.936 1.00 19.17 C ATOM 2189 C LYS B 43 36.266 2.674 28.914 1.00 18.57 C ATOM 2190 O LYS B 43 35.618 2.524 27.877 1.00 18.10 O ATOM 2191 CB LYS B 43 36.969 5.066 28.991 1.00 20.15 C ATOM 2192 HA LYS B 43 38.069 3.445 29.816 1.00 0.00 H ATOM 2193 HB2 LYS B 43 37.827 5.738 28.982 1.00 0.00 H ATOM 2194 HB3 LYS B 43 36.338 5.269 28.125 1.00 0.00 H ATOM 2195 H LYS B 43 37.759 3.580 26.802 1.00 0.00 H ATOM 2196 N PRO B 44 35.971 2.022 30.046 1.00 17.94 N ATOM 2197 CA PRO B 44 34.772 1.201 30.090 1.00 18.24 C ATOM 2198 C PRO B 44 33.522 2.071 30.002 1.00 18.22 C ATOM 2199 O PRO B 44 33.441 3.097 30.678 1.00 18.69 O ATOM 2200 CB PRO B 44 34.837 0.525 31.465 1.00 18.85 C ATOM 2201 CG PRO B 44 36.186 0.762 31.984 1.00 18.40 C ATOM 2202 CD PRO B 44 36.702 1.997 31.324 1.00 17.67 C ATOM 2203 HA PRO B 44 34.723 0.492 29.264 1.00 0.00 H ATOM 2204 HD3 PRO B 44 36.479 2.882 31.920 1.00 0.00 H ATOM 2205 HD2 PRO B 44 37.778 1.933 31.159 1.00 0.00 H ATOM 2206 HG3 PRO B 44 36.831 -0.085 31.749 1.00 0.00 H ATOM 2207 HG2 PRO B 44 36.152 0.902 33.064 1.00 0.00 H ATOM 2208 HB2 PRO B 44 34.094 0.960 32.134 1.00 0.00 H ATOM 2209 HB3 PRO B 44 34.654 -0.545 31.368 1.00 0.00 H ATOM 2210 N LYS B 45 32.562 1.653 29.185 1.00 18.05 N ATOM 2211 CA LYS B 45 31.294 2.362 29.048 1.00 18.03 C ATOM 2212 C LYS B 45 30.184 1.353 28.806 1.00 17.85 C ATOM 2213 O LYS B 45 30.440 0.175 28.560 1.00 19.15 O ATOM 2214 CB LYS B 45 31.352 3.334 27.896 1.00 18.93 C ATOM 2215 HA LYS B 45 31.099 2.920 29.964 1.00 0.00 H ATOM 2216 HB2 LYS B 45 32.146 4.059 28.074 1.00 0.00 H ATOM 2217 HB3 LYS B 45 31.555 2.790 26.973 1.00 0.00 H ATOM 2218 H LYS B 45 32.719 0.791 28.624 1.00 0.00 H ATOM 2219 N MET B 46 28.947 1.823 28.879 1.00 16.47 N ATOM 2220 CA MET B 46 27.817 0.978 28.522 1.00 16.72 C ATOM 2221 C MET B 46 26.964 1.683 27.485 1.00 16.80 C ATOM 2222 O MET B 46 26.836 2.904 27.519 1.00 17.34 O ATOM 2223 CB MET B 46 26.991 0.659 29.765 1.00 16.92 C ATOM 2224 CG MET B 46 27.722 -0.255 30.737 1.00 16.96 C ATOM 2225 SD MET B 46 26.774 -0.587 32.230 1.00 16.87 S ATOM 2226 CE MET B 46 25.425 -1.548 31.552 1.00 17.70 C ATOM 2227 HA MET B 46 28.183 0.042 28.101 1.00 0.00 H ATOM 2228 HB2 MET B 46 26.753 1.592 30.275 1.00 0.00 H ATOM 2229 HB3 MET B 46 26.067 0.171 29.454 1.00 0.00 H ATOM 2230 HG2 MET B 46 28.663 0.218 31.019 1.00 0.00 H ATOM 2231 HG3 MET B 46 27.928 -1.202 30.237 1.00 0.00 H ATOM 2232 HE1 MET B 46 24.889 -0.950 30.815 1.00 0.00 H ATOM 2233 HE2 MET B 46 25.823 -2.444 31.075 1.00 0.00 H ATOM 2234 HE3 MET B 46 24.745 -1.833 32.354 1.00 0.00 H ATOM 2235 H MET B 46 28.783 2.801 29.193 1.00 0.00 H ATOM 2236 N ILE B 47 26.393 0.905 26.572 1.00 16.74 N ATOM 2237 CA ILE B 47 25.451 1.432 25.591 1.00 16.95 C ATOM 2238 C ILE B 47 24.280 0.484 25.412 1.00 16.48 C ATOM 2239 O ILE B 47 24.416 -0.718 25.629 1.00 17.06 O ATOM 2240 CB ILE B 47 26.102 1.647 24.217 1.00 17.45 C ATOM 2241 CG1 ILE B 47 26.736 0.351 23.706 1.00 18.40 C ATOM 2242 CG2 ILE B 47 27.115 2.759 24.280 1.00 18.96 C ATOM 2243 CD1 ILE B 47 27.156 0.423 22.270 1.00 18.90 C ATOM 2244 HA ILE B 47 25.112 2.393 25.978 1.00 0.00 H ATOM 2245 HB ILE B 47 25.325 1.938 23.510 1.00 0.00 H ATOM 2246 HG12 ILE B 47 27.614 0.132 24.313 1.00 0.00 H ATOM 2247 HG13 ILE B 47 26.011 -0.456 23.815 1.00 0.00 H ATOM 2248 HD11 ILE B 47 26.285 0.631 21.648 1.00 0.00 H ATOM 2249 HD12 ILE B 47 27.890 1.219 22.147 1.00 0.00 H ATOM 2250 HD13 ILE B 47 27.597 -0.529 21.974 1.00 0.00 H ATOM 2251 HG21 ILE B 47 26.622 3.681 24.586 1.00 0.00 H ATOM 2252 HG22 ILE B 47 27.890 2.503 25.003 1.00 0.00 H ATOM 2253 HG23 ILE B 47 27.565 2.895 23.296 1.00 0.00 H ATOM 2254 H ILE B 47 26.624 -0.109 26.556 1.00 0.00 H ATOM 2255 N GLY B 48 23.142 1.035 24.998 1.00 16.78 N ATOM 2256 CA GLY B 48 21.898 0.283 24.904 1.00 16.87 C ATOM 2257 C GLY B 48 21.406 0.181 23.476 1.00 16.93 C ATOM 2258 O GLY B 48 21.529 1.129 22.706 1.00 16.68 O ATOM 2259 HA3 GLY B 48 21.138 0.783 25.504 1.00 0.00 H ATOM 2260 HA2 GLY B 48 22.063 -0.722 25.293 1.00 0.00 H ATOM 2261 H GLY B 48 23.141 2.040 24.732 1.00 0.00 H ATOM 2262 N GLY B 49 20.850 -0.974 23.125 1.00 16.73 N ATOM 2263 CA GLY B 49 20.155 -1.128 21.853 1.00 17.42 C ATOM 2264 C GLY B 49 18.853 -1.877 22.028 1.00 17.19 C ATOM 2265 O GLY B 49 18.243 -1.833 23.090 1.00 17.17 O ATOM 2266 HA3 GLY B 49 20.793 -1.680 21.163 1.00 0.00 H ATOM 2267 HA2 GLY B 49 19.945 -0.141 21.441 1.00 0.00 H ATOM 2268 H GLY B 49 20.912 -1.786 23.772 1.00 0.00 H ATOM 2269 N ILE B 50 18.424 -2.563 20.976 1.00 17.40 N ATOM 2270 CA ILE B 50 17.075 -3.105 20.949 1.00 17.79 C ATOM 2271 C ILE B 50 16.897 -4.202 21.981 1.00 17.74 C ATOM 2272 O ILE B 50 15.778 -4.413 22.453 1.00 18.07 O ATOM 2273 CB ILE B 50 16.685 -3.624 19.555 1.00 17.48 C ATOM 2274 CG1 ILE B 50 15.163 -3.725 19.425 1.00 18.24 C ATOM 2275 CG2 ILE B 50 17.366 -4.955 19.253 1.00 17.73 C ATOM 2276 CD1 ILE B 50 14.706 -3.840 18.001 1.00 18.57 C ATOM 2277 HA ILE B 50 16.407 -2.280 21.198 1.00 0.00 H ATOM 2278 HB ILE B 50 17.035 -2.908 18.812 1.00 0.00 H ATOM 2279 HG12 ILE B 50 14.824 -4.605 19.972 1.00 0.00 H ATOM 2280 HG13 ILE B 50 14.716 -2.833 19.863 1.00 0.00 H ATOM 2281 HD11 ILE B 50 15.030 -2.961 17.445 1.00 0.00 H ATOM 2282 HD12 ILE B 50 15.139 -4.735 17.553 1.00 0.00 H ATOM 2283 HD13 ILE B 50 13.618 -3.908 17.974 1.00 0.00 H ATOM 2284 HG21 ILE B 50 18.448 -4.824 19.286 1.00 0.00 H ATOM 2285 HG22 ILE B 50 17.065 -5.693 19.997 1.00 0.00 H ATOM 2286 HG23 ILE B 50 17.071 -5.296 18.261 1.00 0.00 H ATOM 2287 H ILE B 50 19.057 -2.714 20.165 1.00 0.00 H ATOM 2288 N GLY B 51 17.982 -4.891 22.332 1.00 17.76 N ATOM 2289 CA GLY B 51 17.908 -5.996 23.286 1.00 18.27 C ATOM 2290 C GLY B 51 18.243 -5.656 24.729 1.00 18.52 C ATOM 2291 O GLY B 51 18.043 -6.489 25.608 1.00 20.44 O ATOM 2292 HA3 GLY B 51 18.602 -6.769 22.956 1.00 0.00 H ATOM 2293 HA2 GLY B 51 16.891 -6.389 23.263 1.00 0.00 H ATOM 2294 H GLY B 51 18.902 -4.637 21.918 1.00 0.00 H ATOM 2295 N GLY B 52 18.739 -4.446 24.979 1.00 18.24 N ATOM 2296 CA GLY B 52 19.209 -4.040 26.303 1.00 17.85 C ATOM 2297 C GLY B 52 20.596 -3.417 26.217 1.00 17.52 C ATOM 2298 O GLY B 52 21.005 -2.971 25.155 1.00 17.95 O ATOM 2299 HA3 GLY B 52 19.249 -4.915 26.952 1.00 0.00 H ATOM 2300 HA2 GLY B 52 18.515 -3.311 26.721 1.00 0.00 H ATOM 2301 H GLY B 52 18.795 -3.760 24.199 1.00 0.00 H ATOM 2302 N PHE B 53 21.331 -3.391 27.323 1.00 16.21 N ATOM 2303 CA PHE B 53 22.649 -2.769 27.368 1.00 16.79 C ATOM 2304 C PHE B 53 23.791 -3.780 27.341 1.00 16.24 C ATOM 2305 O PHE B 53 23.638 -4.928 27.757 1.00 16.03 O ATOM 2306 CB PHE B 53 22.775 -1.881 28.608 1.00 17.78 C ATOM 2307 CG PHE B 53 21.989 -0.608 28.501 1.00 17.70 C ATOM 2308 CD1 PHE B 53 20.604 -0.632 28.523 1.00 19.31 C ATOM 2309 CD2 PHE B 53 22.641 0.603 28.342 1.00 18.74 C ATOM 2310 CE1 PHE B 53 19.874 0.541 28.406 1.00 18.98 C ATOM 2311 CE2 PHE B 53 21.923 1.779 28.230 1.00 19.07 C ATOM 2312 CZ PHE B 53 20.544 1.745 28.259 1.00 18.40 C ATOM 2313 HA PHE B 53 22.736 -2.165 26.465 1.00 0.00 H ATOM 2314 HB2 PHE B 53 22.416 -2.439 29.473 1.00 0.00 H ATOM 2315 HB3 PHE B 53 23.826 -1.629 28.750 1.00 0.00 H ATOM 2316 HD2 PHE B 53 23.730 0.629 28.305 1.00 0.00 H ATOM 2317 HE2 PHE B 53 22.444 2.730 28.119 1.00 0.00 H ATOM 2318 HZ PHE B 53 19.978 2.672 28.166 1.00 0.00 H ATOM 2319 HE1 PHE B 53 18.785 0.516 28.429 1.00 0.00 H ATOM 2320 HD1 PHE B 53 20.083 -1.583 28.633 1.00 0.00 H ATOM 2321 H PHE B 53 20.953 -3.830 28.187 1.00 0.00 H ATOM 2322 N ILE B 54 24.933 -3.329 26.835 1.00 16.51 N ATOM 2323 CA ILE B 54 26.159 -4.109 26.875 1.00 16.05 C ATOM 2324 C ILE B 54 27.292 -3.216 27.365 1.00 15.70 C ATOM 2325 O ILE B 54 27.209 -1.984 27.321 1.00 16.96 O ATOM 2326 CB ILE B 54 26.556 -4.694 25.499 1.00 16.44 C ATOM 2327 CG1 ILE B 54 26.795 -3.581 24.483 1.00 15.83 C ATOM 2328 CG2 ILE B 54 25.502 -5.657 24.991 1.00 16.41 C ATOM 2329 CD1 ILE B 54 27.491 -4.022 23.220 1.00 16.44 C ATOM 2330 HA ILE B 54 25.982 -4.949 27.547 1.00 0.00 H ATOM 2331 HB ILE B 54 27.487 -5.246 25.630 1.00 0.00 H ATOM 2332 HG12 ILE B 54 25.829 -3.157 24.209 1.00 0.00 H ATOM 2333 HG13 ILE B 54 27.406 -2.813 24.957 1.00 0.00 H ATOM 2334 HD11 ILE B 54 28.467 -4.437 23.471 1.00 0.00 H ATOM 2335 HD12 ILE B 54 26.889 -4.782 22.721 1.00 0.00 H ATOM 2336 HD13 ILE B 54 27.618 -3.165 22.558 1.00 0.00 H ATOM 2337 HG21 ILE B 54 25.389 -6.477 25.700 1.00 0.00 H ATOM 2338 HG22 ILE B 54 24.552 -5.132 24.887 1.00 0.00 H ATOM 2339 HG23 ILE B 54 25.809 -6.052 24.022 1.00 0.00 H ATOM 2340 H ILE B 54 24.951 -2.387 26.396 1.00 0.00 H ATOM 2341 N LYS B 55 28.348 -3.870 27.832 1.00 15.34 N ATOM 2342 CA LYS B 55 29.588 -3.193 28.167 1.00 15.80 C ATOM 2343 C LYS B 55 30.488 -3.110 26.948 1.00 15.85 C ATOM 2344 O LYS B 55 30.665 -4.093 26.233 1.00 16.76 O ATOM 2345 CB LYS B 55 30.309 -3.950 29.279 1.00 15.80 C ATOM 2346 CG LYS B 55 29.566 -3.914 30.611 1.00 16.40 C ATOM 2347 CD LYS B 55 30.079 -4.984 31.563 1.00 16.92 C ATOM 2348 CE LYS B 55 31.515 -4.717 31.972 1.00 18.23 C ATOM 2349 NZ LYS B 55 32.046 -5.805 32.835 1.00 19.47 N ATOM 2350 HA LYS B 55 29.353 -2.184 28.506 1.00 0.00 H ATOM 2351 HB2 LYS B 55 30.422 -4.990 28.973 1.00 0.00 H ATOM 2352 HB3 LYS B 55 31.294 -3.505 29.419 1.00 0.00 H ATOM 2353 HG2 LYS B 55 29.706 -2.935 31.069 1.00 0.00 H ATOM 2354 HG3 LYS B 55 28.504 -4.080 30.430 1.00 0.00 H ATOM 2355 HD2 LYS B 55 29.452 -4.996 32.455 1.00 0.00 H ATOM 2356 HD3 LYS B 55 30.025 -5.954 31.069 1.00 0.00 H ATOM 2357 HE2 LYS B 55 31.558 -3.776 32.520 1.00 0.00 H ATOM 2358 HE3 LYS B 55 32.131 -4.642 31.076 1.00 0.00 H ATOM 2359 HZ1 LYS B 55 31.466 -5.878 33.695 1.00 0.00 H ATOM 2360 HZ2 LYS B 55 32.013 -6.705 32.316 1.00 0.00 H ATOM 2361 HZ3 LYS B 55 33.030 -5.590 33.096 1.00 0.00 H ATOM 2362 H LYS B 55 28.285 -4.900 27.962 1.00 0.00 H ATOM 2363 N VAL B 56 31.058 -1.926 26.733 1.00 15.64 N ATOM 2364 CA VAL B 56 31.964 -1.715 25.611 1.00 16.48 C ATOM 2365 C VAL B 56 33.238 -1.049 26.094 1.00 17.00 C ATOM 2366 O VAL B 56 33.305 -0.540 27.210 1.00 16.57 O ATOM 2367 CB VAL B 56 31.325 -0.840 24.512 1.00 16.61 C ATOM 2368 CG1 VAL B 56 30.149 -1.560 23.880 1.00 16.58 C ATOM 2369 CG2 VAL B 56 30.914 0.520 25.070 1.00 18.51 C ATOM 2370 HA VAL B 56 32.186 -2.693 25.184 1.00 0.00 H ATOM 2371 HB VAL B 56 32.067 -0.663 23.734 1.00 0.00 H ATOM 2372 HG11 VAL B 56 30.493 -2.494 23.436 1.00 0.00 H ATOM 2373 HG12 VAL B 56 29.402 -1.773 24.644 1.00 0.00 H ATOM 2374 HG13 VAL B 56 29.711 -0.928 23.107 1.00 0.00 H ATOM 2375 HG21 VAL B 56 30.189 0.378 25.872 1.00 0.00 H ATOM 2376 HG22 VAL B 56 31.794 1.032 25.460 1.00 0.00 H ATOM 2377 HG23 VAL B 56 30.466 1.117 24.275 1.00 0.00 H ATOM 2378 H VAL B 56 30.853 -1.137 27.378 1.00 0.00 H ATOM 2379 N ARG B 57 34.244 -1.063 25.225 1.00 17.37 N ATOM 2380 CA ARG B 57 35.458 -0.287 25.422 1.00 18.17 C ATOM 2381 C ARG B 57 35.364 0.940 24.535 1.00 18.13 C ATOM 2382 O ARG B 57 35.113 0.804 23.340 1.00 19.42 O ATOM 2383 CB ARG B 57 36.682 -1.098 24.999 1.00 18.41 C ATOM 2384 CG ARG B 57 36.789 -2.431 25.716 1.00 19.27 C ATOM 2385 CD ARG B 57 38.015 -3.213 25.279 1.00 21.03 C ATOM 2386 NE ARG B 57 38.232 -4.357 26.157 1.00 23.42 N ATOM 2387 CZ ARG B 57 39.330 -5.107 26.171 1.00 25.02 C ATOM 2388 NH1 ARG B 57 40.337 -4.861 25.340 1.00 26.57 N ATOM 2389 NH2 ARG B 57 39.414 -6.119 27.023 1.00 25.80 N ATOM 2390 HA ARG B 57 35.559 -0.018 26.473 1.00 0.00 H ATOM 2391 HB2 ARG B 57 36.622 -1.284 23.927 1.00 0.00 H ATOM 2392 HB3 ARG B 57 37.577 -0.515 25.215 1.00 0.00 H ATOM 2393 HG2 ARG B 57 36.850 -2.250 26.789 1.00 0.00 H ATOM 2394 HG3 ARG B 57 35.899 -3.021 25.498 1.00 0.00 H ATOM 2395 HD2 ARG B 57 38.888 -2.562 25.316 1.00 0.00 H ATOM 2396 HD3 ARG B 57 37.870 -3.567 24.258 1.00 0.00 H ATOM 2397 HE ARG B 57 37.471 -4.605 26.822 1.00 0.00 H ATOM 2398 HH12 ARG B 57 41.189 -5.457 25.364 1.00 0.00 H ATOM 2399 HH11 ARG B 57 40.274 -4.072 24.665 1.00 0.00 H ATOM 2400 HH22 ARG B 57 40.268 -6.712 27.043 1.00 0.00 H ATOM 2401 HH21 ARG B 57 38.626 -6.320 27.671 1.00 0.00 H ATOM 2402 H ARG B 57 34.160 -1.651 24.372 1.00 0.00 H ATOM 2403 N GLN B 58 35.541 2.125 25.112 1.00 19.25 N ATOM 2404 CA GLN B 58 35.449 3.357 24.337 1.00 18.92 C ATOM 2405 C GLN B 58 36.845 3.820 23.961 1.00 18.79 C ATOM 2406 O GLN B 58 37.645 4.129 24.841 1.00 18.37 O ATOM 2407 CB GLN B 58 34.744 4.455 25.128 1.00 18.50 C ATOM 2408 CG GLN B 58 34.648 5.776 24.379 1.00 19.55 C ATOM 2409 CD GLN B 58 33.900 6.833 25.156 1.00 19.90 C ATOM 2410 OE1 GLN B 58 32.759 6.631 25.565 1.00 21.65 O ATOM 2411 NE2 GLN B 58 34.538 7.979 25.352 1.00 23.67 N ATOM 2412 HA GLN B 58 34.866 3.156 23.438 1.00 0.00 H ATOM 2413 HB2 GLN B 58 33.735 4.117 25.363 1.00 0.00 H ATOM 2414 HB3 GLN B 58 35.295 4.622 26.054 1.00 0.00 H ATOM 2415 HG2 GLN B 58 35.656 6.138 24.179 1.00 0.00 H ATOM 2416 HG3 GLN B 58 34.131 5.605 23.435 1.00 0.00 H ATOM 2417 HE22 GLN B 58 35.504 8.105 24.987 1.00 0.00 H ATOM 2418 HE21 GLN B 58 34.073 8.751 25.870 1.00 0.00 H ATOM 2419 H GLN B 58 35.748 2.174 26.130 1.00 0.00 H ATOM 2420 N TYR B 59 37.121 3.848 22.661 1.00 19.13 N ATOM 2421 CA TYR B 59 38.337 4.446 22.128 1.00 19.00 C ATOM 2422 C TYR B 59 38.009 5.781 21.469 1.00 19.03 C ATOM 2423 O TYR B 59 37.100 5.853 20.643 1.00 19.97 O ATOM 2424 CB TYR B 59 38.950 3.537 21.064 1.00 19.20 C ATOM 2425 CG TYR B 59 39.472 2.201 21.554 1.00 19.05 C ATOM 2426 CD1 TYR B 59 38.648 1.082 21.640 1.00 19.05 C ATOM 2427 CD2 TYR B 59 40.807 2.051 21.904 1.00 19.34 C ATOM 2428 CE1 TYR B 59 39.140 -0.140 22.072 1.00 18.67 C ATOM 2429 CE2 TYR B 59 41.304 0.839 22.336 1.00 19.75 C ATOM 2430 CZ TYR B 59 40.471 -0.254 22.422 1.00 19.18 C ATOM 2431 OH TYR B 59 40.997 -1.454 22.852 1.00 20.13 O ATOM 2432 HA TYR B 59 39.038 4.586 22.951 1.00 0.00 H ATOM 2433 HB3 TYR B 59 39.781 4.073 20.606 1.00 0.00 H ATOM 2434 HB2 TYR B 59 38.186 3.342 20.311 1.00 0.00 H ATOM 2435 HD2 TYR B 59 41.476 2.909 21.836 1.00 0.00 H ATOM 2436 HE2 TYR B 59 42.355 0.747 22.609 1.00 0.00 H ATOM 2437 HE1 TYR B 59 38.480 -1.005 22.135 1.00 0.00 H ATOM 2438 HD1 TYR B 59 37.597 1.168 21.363 1.00 0.00 H ATOM 2439 HH TYR B 59 40.284 -2.141 22.862 1.00 0.00 H ATOM 2440 H TYR B 59 36.441 3.426 21.997 1.00 0.00 H ATOM 2441 N ASP B 60 38.768 6.820 21.801 1.00 18.92 N ATOM 2442 CA ASP B 60 38.555 8.157 21.252 1.00 18.97 C ATOM 2443 C ASP B 60 39.514 8.463 20.098 1.00 18.49 C ATOM 2444 O ASP B 60 40.631 7.944 20.051 1.00 18.14 O ATOM 2445 CB ASP B 60 38.714 9.210 22.352 1.00 19.13 C ATOM 2446 CG ASP B 60 37.646 9.097 23.433 1.00 20.32 C ATOM 2447 OD1 ASP B 60 36.504 8.690 23.129 1.00 23.32 O ATOM 2448 OD2 ASP B 60 37.953 9.431 24.594 1.00 23.71 O ATOM 2449 HA ASP B 60 37.540 8.189 20.857 1.00 0.00 H ATOM 2450 HB2 ASP B 60 39.693 9.086 22.815 1.00 0.00 H ATOM 2451 HB3 ASP B 60 38.650 10.200 21.900 1.00 0.00 H ATOM 2452 H ASP B 60 39.544 6.676 22.478 1.00 0.00 H ATOM 2453 N GLN B 61 39.063 9.317 19.181 1.00 18.05 N ATOM 2454 CA GLN B 61 39.873 9.836 18.076 1.00 18.68 C ATOM 2455 C GLN B 61 40.597 8.749 17.273 1.00 17.81 C ATOM 2456 O GLN B 61 41.810 8.817 17.034 1.00 18.10 O ATOM 2457 CB GLN B 61 40.809 10.945 18.579 1.00 19.29 C ATOM 2458 CG GLN B 61 40.434 12.342 18.067 1.00 22.12 C ATOM 2459 CD GLN B 61 39.046 12.813 18.489 1.00 23.87 C ATOM 2460 OE1 GLN B 61 38.297 12.089 19.144 1.00 29.33 O ATOM 2461 NE2 GLN B 61 38.696 14.037 18.105 1.00 24.43 N ATOM 2462 HA GLN B 61 39.188 10.278 17.353 1.00 0.00 H ATOM 2463 HB2 GLN B 61 40.777 10.956 19.668 1.00 0.00 H ATOM 2464 HB3 GLN B 61 41.823 10.717 18.249 1.00 0.00 H ATOM 2465 HG2 GLN B 61 41.167 13.054 18.448 1.00 0.00 H ATOM 2466 HG3 GLN B 61 40.474 12.329 16.978 1.00 0.00 H ATOM 2467 HE22 GLN B 61 39.358 14.618 17.552 1.00 0.00 H ATOM 2468 HE21 GLN B 61 37.760 14.414 18.358 1.00 0.00 H ATOM 2469 H GLN B 61 38.075 9.635 19.254 1.00 0.00 H ATOM 2470 N ILE B 62 39.816 7.761 16.846 1.00 17.76 N ATOM 2471 CA ILE B 62 40.317 6.645 16.053 1.00 17.84 C ATOM 2472 C ILE B 62 40.030 6.935 14.580 1.00 17.35 C ATOM 2473 O ILE B 62 38.873 7.148 14.212 1.00 16.59 O ATOM 2474 CB ILE B 62 39.607 5.335 16.456 1.00 18.44 C ATOM 2475 CG1 ILE B 62 39.912 4.967 17.913 1.00 19.53 C ATOM 2476 CG2 ILE B 62 39.984 4.192 15.516 1.00 17.61 C ATOM 2477 CD1 ILE B 62 41.368 4.715 18.216 1.00 21.11 C ATOM 2478 HA ILE B 62 41.387 6.530 16.224 1.00 0.00 H ATOM 2479 HB ILE B 62 38.533 5.501 16.369 1.00 0.00 H ATOM 2480 HG12 ILE B 62 39.571 5.785 18.547 1.00 0.00 H ATOM 2481 HG13 ILE B 62 39.354 4.063 18.158 1.00 0.00 H ATOM 2482 HD11 ILE B 62 41.728 3.889 17.603 1.00 0.00 H ATOM 2483 HD12 ILE B 62 41.945 5.613 17.993 1.00 0.00 H ATOM 2484 HD13 ILE B 62 41.480 4.462 19.270 1.00 0.00 H ATOM 2485 HG21 ILE B 62 39.691 4.449 14.498 1.00 0.00 H ATOM 2486 HG22 ILE B 62 41.061 4.031 15.555 1.00 0.00 H ATOM 2487 HG23 ILE B 62 39.468 3.283 15.826 1.00 0.00 H ATOM 2488 H ILE B 62 38.805 7.786 17.088 1.00 0.00 H ATOM 2489 N PRO B 63 41.073 6.964 13.732 1.00 17.49 N ATOM 2490 CA PRO B 63 40.834 7.065 12.297 1.00 17.72 C ATOM 2491 C PRO B 63 40.148 5.839 11.694 1.00 18.17 C ATOM 2492 O PRO B 63 40.587 4.700 11.908 1.00 18.52 O ATOM 2493 CB PRO B 63 42.241 7.246 11.717 1.00 16.71 C ATOM 2494 CG PRO B 63 43.087 7.711 12.875 1.00 17.38 C ATOM 2495 CD PRO B 63 42.513 6.976 14.041 1.00 17.38 C ATOM 2496 HA PRO B 63 40.148 7.881 12.068 1.00 0.00 H ATOM 2497 HD3 PRO B 63 42.911 5.963 14.104 1.00 0.00 H ATOM 2498 HD2 PRO B 63 42.712 7.502 14.975 1.00 0.00 H ATOM 2499 HG3 PRO B 63 43.002 8.789 13.013 1.00 0.00 H ATOM 2500 HG2 PRO B 63 44.134 7.447 12.724 1.00 0.00 H ATOM 2501 HB2 PRO B 63 42.617 6.302 11.323 1.00 0.00 H ATOM 2502 HB3 PRO B 63 42.235 7.993 10.923 1.00 0.00 H ATOM 2503 N VAL B 64 39.082 6.089 10.938 1.00 18.58 N ATOM 2504 CA VAL B 64 38.351 5.039 10.242 1.00 18.54 C ATOM 2505 C VAL B 64 38.133 5.516 8.809 1.00 18.78 C ATOM 2506 O VAL B 64 37.634 6.622 8.594 1.00 19.44 O ATOM 2507 CB VAL B 64 36.988 4.765 10.897 1.00 18.98 C ATOM 2508 CG1 VAL B 64 36.319 3.581 10.210 1.00 19.56 C ATOM 2509 CG2 VAL B 64 37.156 4.496 12.382 1.00 19.05 C ATOM 2510 HA VAL B 64 38.923 4.112 10.280 1.00 0.00 H ATOM 2511 HB VAL B 64 36.355 5.645 10.783 1.00 0.00 H ATOM 2512 HG11 VAL B 64 36.175 3.809 9.154 1.00 0.00 H ATOM 2513 HG12 VAL B 64 36.953 2.700 10.309 1.00 0.00 H ATOM 2514 HG13 VAL B 64 35.353 3.390 10.677 1.00 0.00 H ATOM 2515 HG21 VAL B 64 37.798 3.626 12.522 1.00 0.00 H ATOM 2516 HG22 VAL B 64 37.610 5.365 12.858 1.00 0.00 H ATOM 2517 HG23 VAL B 64 36.180 4.304 12.828 1.00 0.00 H ATOM 2518 H VAL B 64 38.758 7.072 10.840 1.00 0.00 H ATOM 2519 N GLU B 65 38.507 4.687 7.840 1.00 18.57 N ATOM 2520 CA GLU B 65 38.299 5.017 6.438 1.00 18.71 C ATOM 2521 C GLU B 65 37.149 4.178 5.902 1.00 18.69 C ATOM 2522 O GLU B 65 37.192 2.952 5.967 1.00 18.80 O ATOM 2523 CB GLU B 65 39.571 4.761 5.631 1.00 18.63 C ATOM 2524 CG GLU B 65 39.539 5.422 4.261 1.00 18.95 C ATOM 2525 CD GLU B 65 40.860 5.341 3.521 1.00 19.36 C ATOM 2526 OE1 GLU B 65 40.832 5.371 2.274 1.00 19.35 O ATOM 2527 OE2 GLU B 65 41.922 5.250 4.173 1.00 20.87 O ATOM 2528 HA GLU B 65 38.054 6.075 6.345 1.00 0.00 H ATOM 2529 HB2 GLU B 65 40.422 5.152 6.188 1.00 0.00 H ATOM 2530 HB3 GLU B 65 39.689 3.686 5.497 1.00 0.00 H ATOM 2531 HG2 GLU B 65 38.775 4.931 3.658 1.00 0.00 H ATOM 2532 HG3 GLU B 65 39.279 6.473 4.390 1.00 0.00 H ATOM 2533 H GLU B 65 38.958 3.783 8.089 1.00 0.00 H ATOM 2534 N ILE B 66 36.131 4.852 5.373 1.00 18.58 N ATOM 2535 CA ILE B 66 34.866 4.221 4.999 1.00 18.84 C ATOM 2536 C ILE B 66 34.654 4.462 3.513 1.00 18.84 C ATOM 2537 O ILE B 66 34.383 5.587 3.105 1.00 18.88 O ATOM 2538 CB ILE B 66 33.692 4.856 5.777 1.00 17.95 C ATOM 2539 CG1 ILE B 66 33.882 4.682 7.286 1.00 19.02 C ATOM 2540 CG2 ILE B 66 32.365 4.250 5.337 1.00 18.16 C ATOM 2541 CD1 ILE B 66 33.141 5.705 8.109 1.00 19.43 C ATOM 2542 HA ILE B 66 34.902 3.157 5.231 1.00 0.00 H ATOM 2543 HB ILE B 66 33.677 5.923 5.553 1.00 0.00 H ATOM 2544 HG12 ILE B 66 33.527 3.690 7.566 1.00 0.00 H ATOM 2545 HG13 ILE B 66 34.945 4.763 7.511 1.00 0.00 H ATOM 2546 HD11 ILE B 66 33.493 6.703 7.849 1.00 0.00 H ATOM 2547 HD12 ILE B 66 32.073 5.630 7.904 1.00 0.00 H ATOM 2548 HD13 ILE B 66 33.323 5.519 9.167 1.00 0.00 H ATOM 2549 HG21 ILE B 66 32.221 4.429 4.272 1.00 0.00 H ATOM 2550 HG22 ILE B 66 32.376 3.177 5.528 1.00 0.00 H ATOM 2551 HG23 ILE B 66 31.552 4.712 5.898 1.00 0.00 H ATOM 2552 H ILE B 66 36.240 5.875 5.218 1.00 0.00 H ATOM 2553 N CYS B 67 34.785 3.415 2.701 1.00 19.99 N ATOM 2554 CA CYS B 67 34.752 3.560 1.245 1.00 20.73 C ATOM 2555 C CYS B 67 35.600 4.713 0.738 1.00 20.83 C ATOM 2556 O CYS B 67 35.169 5.477 -0.129 1.00 21.16 O ATOM 2557 CB CYS B 67 33.329 3.765 0.740 1.00 21.91 C ATOM 2558 SG CYS B 67 32.240 2.413 1.163 1.00 24.16 S ATOM 2559 HA CYS B 67 35.166 2.628 0.859 1.00 0.00 H ATOM 2560 HB2 CYS B 67 33.356 3.864 -0.345 1.00 0.00 H ATOM 2561 HB3 CYS B 67 32.933 4.681 1.178 1.00 0.00 H ATOM 2562 HG CYS B 67 30.976 2.672 0.673 1.00 0.00 H ATOM 2563 H CYS B 67 34.914 2.469 3.112 1.00 0.00 H ATOM 2564 N GLY B 68 36.798 4.846 1.293 1.00 20.45 N ATOM 2565 CA GLY B 68 37.738 5.857 0.839 1.00 20.71 C ATOM 2566 C GLY B 68 37.556 7.228 1.462 1.00 20.74 C ATOM 2567 O GLY B 68 38.385 8.107 1.244 1.00 21.69 O ATOM 2568 HA3 GLY B 68 37.630 5.959 -0.241 1.00 0.00 H ATOM 2569 HA2 GLY B 68 38.745 5.511 1.071 1.00 0.00 H ATOM 2570 H GLY B 68 37.071 4.212 2.071 1.00 0.00 H ATOM 2571 N HIS B 69 36.487 7.417 2.234 1.00 20.20 N ATOM 2572 CA HIS B 69 36.234 8.684 2.918 1.00 20.07 C ATOM 2573 C HIS B 69 36.778 8.598 4.341 1.00 19.85 C ATOM 2574 O HIS B 69 36.633 7.567 4.996 1.00 20.24 O ATOM 2575 CB HIS B 69 34.733 8.978 2.950 1.00 20.07 C ATOM 2576 CG HIS B 69 34.147 9.277 1.606 1.00 21.33 C ATOM 2577 ND1 HIS B 69 33.683 10.527 1.260 1.00 23.79 N ATOM 2578 CD2 HIS B 69 33.952 8.491 0.521 1.00 23.26 C ATOM 2579 CE1 HIS B 69 33.224 10.497 0.021 1.00 23.19 C ATOM 2580 NE2 HIS B 69 33.377 9.273 -0.450 1.00 22.82 N ATOM 2581 HA HIS B 69 36.733 9.491 2.382 1.00 0.00 H ATOM 2582 HB2 HIS B 69 34.221 8.109 3.363 1.00 0.00 H ATOM 2583 HB3 HIS B 69 34.565 9.838 3.598 1.00 0.00 H ATOM 2584 HD2 HIS B 69 34.204 7.434 0.434 1.00 0.00 H ATOM 2585 HE1 HIS B 69 32.793 11.339 -0.520 1.00 0.00 H ATOM 2586 H HIS B 69 35.810 6.637 2.354 1.00 0.00 H ATOM 2587 N LYS B 70 37.401 9.668 4.824 1.00 19.87 N ATOM 2588 CA LYS B 70 38.068 9.622 6.121 1.00 19.78 C ATOM 2589 C LYS B 70 37.239 10.212 7.254 1.00 18.97 C ATOM 2590 O LYS B 70 36.644 11.284 7.123 1.00 19.51 O ATOM 2591 CB LYS B 70 39.421 10.331 6.059 1.00 19.94 C ATOM 2592 CG LYS B 70 40.446 9.595 5.215 1.00 20.68 C ATOM 2593 CD LYS B 70 41.855 10.112 5.463 1.00 20.94 C ATOM 2594 CE LYS B 70 42.873 9.381 4.603 1.00 21.23 C ATOM 2595 NZ LYS B 70 44.170 9.182 5.307 1.00 21.96 N ATOM 2596 HA LYS B 70 38.208 8.564 6.343 1.00 0.00 H ATOM 2597 HB2 LYS B 70 39.272 11.324 5.635 1.00 0.00 H ATOM 2598 HB3 LYS B 70 39.810 10.424 7.073 1.00 0.00 H ATOM 2599 HG2 LYS B 70 40.410 8.534 5.461 1.00 0.00 H ATOM 2600 HG3 LYS B 70 40.200 9.731 4.162 1.00 0.00 H ATOM 2601 HD2 LYS B 70 41.890 11.176 5.227 1.00 0.00 H ATOM 2602 HD3 LYS B 70 42.107 9.966 6.513 1.00 0.00 H ATOM 2603 HE2 LYS B 70 43.051 9.963 3.699 1.00 0.00 H ATOM 2604 HE3 LYS B 70 42.468 8.406 4.332 1.00 0.00 H ATOM 2605 HZ1 LYS B 70 44.570 10.107 5.563 1.00 0.00 H ATOM 2606 HZ2 LYS B 70 44.013 8.620 6.168 1.00 0.00 H ATOM 2607 HZ3 LYS B 70 44.830 8.680 4.680 1.00 0.00 H ATOM 2608 H LYS B 70 37.413 10.549 4.271 1.00 0.00 H ATOM 2609 N ALA B 71 37.242 9.495 8.374 1.00 18.76 N ATOM 2610 CA ALA B 71 36.602 9.930 9.606 1.00 18.21 C ATOM 2611 C ALA B 71 37.619 9.708 10.718 1.00 18.00 C ATOM 2612 O ALA B 71 38.482 8.838 10.614 1.00 18.54 O ATOM 2613 CB ALA B 71 35.339 9.118 9.867 1.00 18.56 C ATOM 2614 HA ALA B 71 36.303 10.977 9.548 1.00 0.00 H ATOM 2615 HB1 ALA B 71 34.644 9.254 9.039 1.00 0.00 H ATOM 2616 HB2 ALA B 71 35.599 8.063 9.956 1.00 0.00 H ATOM 2617 HB3 ALA B 71 34.875 9.458 10.793 1.00 0.00 H ATOM 2618 H ALA B 71 37.727 8.575 8.369 1.00 0.00 H ATOM 2619 N ILE B 72 37.529 10.513 11.771 1.00 17.10 N ATOM 2620 CA ILE B 72 38.326 10.301 12.975 1.00 16.92 C ATOM 2621 C ILE B 72 37.401 10.571 14.149 1.00 16.79 C ATOM 2622 O ILE B 72 36.957 11.698 14.364 1.00 17.43 O ATOM 2623 CB ILE B 72 39.557 11.245 13.063 1.00 16.69 C ATOM 2624 CG1 ILE B 72 40.438 11.147 11.815 1.00 16.51 C ATOM 2625 CG2 ILE B 72 40.394 10.919 14.296 1.00 17.50 C ATOM 2626 CD1 ILE B 72 41.548 12.190 11.767 1.00 16.24 C ATOM 2627 HA ILE B 72 38.722 9.285 12.970 1.00 0.00 H ATOM 2628 HB ILE B 72 39.175 12.263 13.136 1.00 0.00 H ATOM 2629 HG12 ILE B 72 40.894 10.157 11.792 1.00 0.00 H ATOM 2630 HG13 ILE B 72 39.806 11.275 10.936 1.00 0.00 H ATOM 2631 HD11 ILE B 72 41.108 13.187 11.778 1.00 0.00 H ATOM 2632 HD12 ILE B 72 42.197 12.068 12.634 1.00 0.00 H ATOM 2633 HD13 ILE B 72 42.130 12.058 10.855 1.00 0.00 H ATOM 2634 HG21 ILE B 72 39.785 11.046 15.191 1.00 0.00 H ATOM 2635 HG22 ILE B 72 40.742 9.888 14.235 1.00 0.00 H ATOM 2636 HG23 ILE B 72 41.251 11.591 14.340 1.00 0.00 H ATOM 2637 H ILE B 72 36.871 11.318 11.736 1.00 0.00 H ATOM 2638 N GLY B 73 37.091 9.533 14.914 1.00 16.86 N ATOM 2639 CA GLY B 73 36.148 9.721 16.004 1.00 16.85 C ATOM 2640 C GLY B 73 36.092 8.575 16.984 1.00 17.03 C ATOM 2641 O GLY B 73 36.941 7.686 16.997 1.00 17.32 O ATOM 2642 HA3 GLY B 73 35.154 9.853 15.576 1.00 0.00 H ATOM 2643 HA2 GLY B 73 36.431 10.622 16.548 1.00 0.00 H ATOM 2644 H GLY B 73 37.515 8.600 14.737 1.00 0.00 H ATOM 2645 N THR B 74 35.062 8.611 17.817 1.00 17.19 N ATOM 2646 CA THR B 74 34.887 7.615 18.853 1.00 16.72 C ATOM 2647 C THR B 74 34.417 6.282 18.280 1.00 16.91 C ATOM 2648 O THR B 74 33.462 6.223 17.505 1.00 16.83 O ATOM 2649 CB THR B 74 33.882 8.137 19.889 1.00 17.02 C ATOM 2650 OG1 THR B 74 34.383 9.360 20.442 1.00 17.81 O ATOM 2651 CG2 THR B 74 33.679 7.132 20.996 1.00 17.55 C ATOM 2652 HA THR B 74 35.851 7.439 19.330 1.00 0.00 H ATOM 2653 HB THR B 74 32.923 8.305 19.399 1.00 0.00 H ATOM 2654 HG1 THR B 74 34.496 10.026 19.718 1.00 0.00 H ATOM 2655 HG23 THR B 74 33.298 6.202 20.575 1.00 0.00 H ATOM 2656 HG21 THR B 74 34.630 6.944 21.493 1.00 0.00 H ATOM 2657 HG22 THR B 74 32.963 7.527 21.716 1.00 0.00 H ATOM 2658 H THR B 74 34.362 9.374 17.724 1.00 0.00 H ATOM 2659 N VAL B 75 35.102 5.214 18.679 1.00 16.97 N ATOM 2660 CA VAL B 75 34.733 3.859 18.290 1.00 16.98 C ATOM 2661 C VAL B 75 34.538 3.073 19.578 1.00 16.88 C ATOM 2662 O VAL B 75 35.401 3.089 20.461 1.00 16.54 O ATOM 2663 CB VAL B 75 35.835 3.206 17.421 1.00 18.51 C ATOM 2664 CG1 VAL B 75 35.545 1.738 17.155 1.00 19.39 C ATOM 2665 CG2 VAL B 75 35.974 3.968 16.110 1.00 19.87 C ATOM 2666 HA VAL B 75 33.823 3.868 17.690 1.00 0.00 H ATOM 2667 HB VAL B 75 36.775 3.257 17.971 1.00 0.00 H ATOM 2668 HG11 VAL B 75 35.492 1.202 18.103 1.00 0.00 H ATOM 2669 HG12 VAL B 75 34.594 1.646 16.630 1.00 0.00 H ATOM 2670 HG13 VAL B 75 36.342 1.317 16.542 1.00 0.00 H ATOM 2671 HG21 VAL B 75 35.026 3.940 15.573 1.00 0.00 H ATOM 2672 HG22 VAL B 75 36.244 5.003 16.320 1.00 0.00 H ATOM 2673 HG23 VAL B 75 36.751 3.504 15.502 1.00 0.00 H ATOM 2674 H VAL B 75 35.932 5.351 19.291 1.00 0.00 H ATOM 2675 N LEU B 76 33.395 2.399 19.678 1.00 15.96 N ATOM 2676 CA LEU B 76 33.111 1.513 20.798 1.00 16.13 C ATOM 2677 C LEU B 76 33.321 0.080 20.347 1.00 16.06 C ATOM 2678 O LEU B 76 32.980 -0.266 19.217 1.00 16.64 O ATOM 2679 CB LEU B 76 31.666 1.696 21.265 1.00 15.52 C ATOM 2680 CG LEU B 76 31.266 3.151 21.523 1.00 16.18 C ATOM 2681 CD1 LEU B 76 29.813 3.227 21.957 1.00 15.94 C ATOM 2682 CD2 LEU B 76 32.169 3.795 22.554 1.00 18.09 C ATOM 2683 HA LEU B 76 33.777 1.749 21.628 1.00 0.00 H ATOM 2684 HB2 LEU B 76 31.005 1.291 20.498 1.00 0.00 H ATOM 2685 HB3 LEU B 76 31.533 1.136 22.191 1.00 0.00 H ATOM 2686 HG LEU B 76 31.382 3.705 20.592 1.00 0.00 H ATOM 2687 HD21 LEU B 76 32.099 3.244 23.492 1.00 0.00 H ATOM 2688 HD22 LEU B 76 33.198 3.776 22.196 1.00 0.00 H ATOM 2689 HD23 LEU B 76 31.858 4.827 22.714 1.00 0.00 H ATOM 2690 HD11 LEU B 76 29.179 2.816 21.172 1.00 0.00 H ATOM 2691 HD12 LEU B 76 29.678 2.652 22.873 1.00 0.00 H ATOM 2692 HD13 LEU B 76 29.543 4.268 22.137 1.00 0.00 H ATOM 2693 H LEU B 76 32.680 2.509 18.931 1.00 0.00 H ATOM 2694 N VAL B 77 33.884 -0.740 21.232 1.00 14.41 N ATOM 2695 CA VAL B 77 34.216 -2.126 20.922 1.00 15.17 C ATOM 2696 C VAL B 77 33.564 -3.041 21.959 1.00 14.64 C ATOM 2697 O VAL B 77 33.757 -2.862 23.159 1.00 14.89 O ATOM 2698 CB VAL B 77 35.743 -2.323 20.904 1.00 15.39 C ATOM 2699 CG1 VAL B 77 36.085 -3.776 20.741 1.00 16.38 C ATOM 2700 CG2 VAL B 77 36.366 -1.500 19.779 1.00 15.21 C ATOM 2701 HA VAL B 77 33.836 -2.378 19.932 1.00 0.00 H ATOM 2702 HB VAL B 77 36.149 -1.980 21.856 1.00 0.00 H ATOM 2703 HG11 VAL B 77 35.664 -4.342 21.572 1.00 0.00 H ATOM 2704 HG12 VAL B 77 35.669 -4.143 19.802 1.00 0.00 H ATOM 2705 HG13 VAL B 77 37.169 -3.894 20.731 1.00 0.00 H ATOM 2706 HG21 VAL B 77 35.952 -1.822 18.823 1.00 0.00 H ATOM 2707 HG22 VAL B 77 36.143 -0.445 19.936 1.00 0.00 H ATOM 2708 HG23 VAL B 77 37.446 -1.648 19.777 1.00 0.00 H ATOM 2709 H VAL B 77 34.096 -0.377 22.183 1.00 0.00 H ATOM 2710 N GLY B 78 32.793 -4.023 21.503 1.00 14.77 N ATOM 2711 CA GLY B 78 32.043 -4.878 22.420 1.00 15.63 C ATOM 2712 C GLY B 78 31.361 -6.020 21.693 1.00 16.08 C ATOM 2713 O GLY B 78 31.470 -6.134 20.475 1.00 16.98 O ATOM 2714 HA3 GLY B 78 31.286 -4.277 22.923 1.00 0.00 H ATOM 2715 HA2 GLY B 78 32.729 -5.290 23.160 1.00 0.00 H ATOM 2716 H GLY B 78 32.723 -4.185 20.478 1.00 0.00 H ATOM 2717 N PRO B 79 30.650 -6.878 22.439 1.00 16.32 N ATOM 2718 CA PRO B 79 29.996 -8.042 21.835 1.00 16.83 C ATOM 2719 C PRO B 79 28.842 -7.685 20.888 1.00 17.71 C ATOM 2720 O PRO B 79 27.878 -7.032 21.292 1.00 19.24 O ATOM 2721 CB PRO B 79 29.517 -8.852 23.042 1.00 17.11 C ATOM 2722 CG PRO B 79 29.509 -7.909 24.191 1.00 17.24 C ATOM 2723 CD PRO B 79 30.439 -6.786 23.895 1.00 16.91 C ATOM 2724 HA PRO B 79 30.680 -8.592 21.189 1.00 0.00 H ATOM 2725 HD3 PRO B 79 29.991 -5.829 24.163 1.00 0.00 H ATOM 2726 HD2 PRO B 79 31.379 -6.908 24.432 1.00 0.00 H ATOM 2727 HG3 PRO B 79 29.835 -8.427 25.093 1.00 0.00 H ATOM 2728 HG2 PRO B 79 28.501 -7.521 24.340 1.00 0.00 H ATOM 2729 HB2 PRO B 79 28.514 -9.241 22.864 1.00 0.00 H ATOM 2730 HB3 PRO B 79 30.198 -9.681 23.237 1.00 0.00 H ATOM 2731 N ASN B 80 28.948 -8.116 19.632 1.00 17.43 N ATOM 2732 CA ASN B 80 28.124 -7.591 18.545 1.00 16.74 C ATOM 2733 C ASN B 80 28.243 -8.558 17.363 1.00 15.97 C ATOM 2734 O ASN B 80 29.353 -9.006 17.083 1.00 16.15 O ATOM 2735 CB ASN B 80 28.679 -6.208 18.185 1.00 18.32 C ATOM 2736 CG ASN B 80 27.830 -5.443 17.193 1.00 20.32 C ATOM 2737 OD1 ASN B 80 26.985 -5.998 16.493 1.00 25.29 O ATOM 2738 ND2 ASN B 80 28.058 -4.132 17.132 1.00 25.48 N ATOM 2739 HA ASN B 80 27.073 -7.498 18.820 1.00 0.00 H ATOM 2740 HB2 ASN B 80 28.753 -5.619 19.099 1.00 0.00 H ATOM 2741 HB3 ASN B 80 29.673 -6.338 17.757 1.00 0.00 H ATOM 2742 HD22 ASN B 80 28.782 -3.701 17.742 1.00 0.00 H ATOM 2743 HD21 ASN B 80 27.512 -3.539 16.475 1.00 0.00 H ATOM 2744 H ASN B 80 29.646 -8.856 19.416 1.00 0.00 H ATOM 2745 N PRO B 81 27.127 -8.938 16.706 1.00 14.68 N ATOM 2746 CA PRO B 81 27.243 -9.784 15.511 1.00 14.65 C ATOM 2747 C PRO B 81 27.688 -9.099 14.222 1.00 14.76 C ATOM 2748 O PRO B 81 28.058 -9.775 13.253 1.00 14.77 O ATOM 2749 CB PRO B 81 25.817 -10.312 15.325 1.00 14.67 C ATOM 2750 CG PRO B 81 24.963 -9.231 15.863 1.00 14.29 C ATOM 2751 CD PRO B 81 25.711 -8.698 17.047 1.00 14.20 C ATOM 2752 HA PRO B 81 28.025 -10.525 15.677 1.00 0.00 H ATOM 2753 HD3 PRO B 81 25.519 -7.634 17.181 1.00 0.00 H ATOM 2754 HD2 PRO B 81 25.434 -9.233 17.955 1.00 0.00 H ATOM 2755 HG3 PRO B 81 23.993 -9.624 16.168 1.00 0.00 H ATOM 2756 HG2 PRO B 81 24.819 -8.449 15.117 1.00 0.00 H ATOM 2757 HB2 PRO B 81 25.603 -10.487 14.271 1.00 0.00 H ATOM 2758 HB3 PRO B 81 25.670 -11.237 15.883 1.00 0.00 H ATOM 2759 N VAL B 82 27.667 -7.767 14.222 1.00 14.63 N ATOM 2760 CA VAL B 82 27.906 -6.959 13.029 1.00 14.55 C ATOM 2761 C VAL B 82 28.612 -5.657 13.421 1.00 14.24 C ATOM 2762 O VAL B 82 28.253 -5.037 14.422 1.00 14.61 O ATOM 2763 CB VAL B 82 26.559 -6.609 12.351 1.00 14.83 C ATOM 2764 CG1 VAL B 82 26.751 -5.621 11.205 1.00 15.40 C ATOM 2765 CG2 VAL B 82 25.853 -7.876 11.872 1.00 15.31 C ATOM 2766 HA VAL B 82 28.529 -7.528 12.339 1.00 0.00 H ATOM 2767 HB VAL B 82 25.926 -6.125 13.095 1.00 0.00 H ATOM 2768 HG11 VAL B 82 27.194 -4.702 11.589 1.00 0.00 H ATOM 2769 HG12 VAL B 82 27.412 -6.059 10.457 1.00 0.00 H ATOM 2770 HG13 VAL B 82 25.784 -5.399 10.753 1.00 0.00 H ATOM 2771 HG21 VAL B 82 26.487 -8.394 11.152 1.00 0.00 H ATOM 2772 HG22 VAL B 82 25.661 -8.528 12.724 1.00 0.00 H ATOM 2773 HG23 VAL B 82 24.909 -7.607 11.399 1.00 0.00 H ATOM 2774 H VAL B 82 27.470 -7.277 15.118 1.00 0.00 H ATOM 2775 N ASN B 83 29.583 -5.219 12.625 1.00 13.58 N ATOM 2776 CA ASN B 83 30.237 -3.940 12.874 1.00 13.27 C ATOM 2777 C ASN B 83 29.266 -2.866 12.409 1.00 12.69 C ATOM 2778 O ASN B 83 28.706 -2.983 11.319 1.00 12.89 O ATOM 2779 CB ASN B 83 31.534 -3.849 12.076 1.00 13.15 C ATOM 2780 CG ASN B 83 32.571 -4.851 12.538 1.00 14.15 C ATOM 2781 OD1 ASN B 83 32.821 -4.993 13.734 1.00 15.46 O ATOM 2782 ND2 ASN B 83 33.169 -5.561 11.590 1.00 15.86 N ATOM 2783 HA ASN B 83 30.487 -3.823 13.928 1.00 0.00 H ATOM 2784 HB2 ASN B 83 31.312 -4.035 11.025 1.00 0.00 H ATOM 2785 HB3 ASN B 83 31.944 -2.845 12.188 1.00 0.00 H ATOM 2786 HD22 ASN B 83 32.924 -5.405 10.591 1.00 0.00 H ATOM 2787 HD21 ASN B 83 33.882 -6.273 11.846 1.00 0.00 H ATOM 2788 H ASN B 83 29.880 -5.797 11.813 1.00 0.00 H ATOM 2789 N ILE B 84 29.058 -1.837 13.225 1.00 12.30 N ATOM 2790 CA ILE B 84 28.071 -0.802 12.920 1.00 12.15 C ATOM 2791 C ILE B 84 28.720 0.578 12.903 1.00 11.68 C ATOM 2792 O ILE B 84 29.298 1.007 13.900 1.00 11.40 O ATOM 2793 CB ILE B 84 26.914 -0.804 13.946 1.00 12.18 C ATOM 2794 CG1 ILE B 84 26.171 -2.143 13.899 1.00 12.25 C ATOM 2795 CG2 ILE B 84 25.944 0.343 13.681 1.00 13.12 C ATOM 2796 CD1 ILE B 84 25.377 -2.442 15.146 1.00 12.86 C ATOM 2797 HA ILE B 84 27.667 -1.027 11.933 1.00 0.00 H ATOM 2798 HB ILE B 84 27.341 -0.666 14.939 1.00 0.00 H ATOM 2799 HG12 ILE B 84 25.487 -2.127 13.051 1.00 0.00 H ATOM 2800 HG13 ILE B 84 26.903 -2.938 13.758 1.00 0.00 H ATOM 2801 HD11 ILE B 84 26.049 -2.474 16.004 1.00 0.00 H ATOM 2802 HD12 ILE B 84 24.631 -1.662 15.296 1.00 0.00 H ATOM 2803 HD13 ILE B 84 24.880 -3.406 15.036 1.00 0.00 H ATOM 2804 HG21 ILE B 84 26.476 1.292 13.756 1.00 0.00 H ATOM 2805 HG22 ILE B 84 25.524 0.238 12.681 1.00 0.00 H ATOM 2806 HG23 ILE B 84 25.141 0.316 14.418 1.00 0.00 H ATOM 2807 H ILE B 84 29.611 -1.766 14.103 1.00 0.00 H ATOM 2808 N ILE B 85 28.598 1.269 11.772 1.00 11.10 N ATOM 2809 CA ILE B 85 29.063 2.648 11.644 1.00 11.42 C ATOM 2810 C ILE B 85 27.847 3.526 11.920 1.00 11.08 C ATOM 2811 O ILE B 85 26.871 3.480 11.173 1.00 10.36 O ATOM 2812 CB ILE B 85 29.577 2.958 10.222 1.00 11.47 C ATOM 2813 CG1 ILE B 85 30.689 1.990 9.806 1.00 12.00 C ATOM 2814 CG2 ILE B 85 30.069 4.396 10.133 1.00 11.39 C ATOM 2815 CD1 ILE B 85 31.929 2.049 10.675 1.00 13.54 C ATOM 2816 HA ILE B 85 29.889 2.825 12.333 1.00 0.00 H ATOM 2817 HB ILE B 85 28.743 2.828 9.533 1.00 0.00 H ATOM 2818 HG12 ILE B 85 30.292 0.976 9.847 1.00 0.00 H ATOM 2819 HG13 ILE B 85 30.979 2.224 8.782 1.00 0.00 H ATOM 2820 HD11 ILE B 85 32.351 3.053 10.637 1.00 0.00 H ATOM 2821 HD12 ILE B 85 31.662 1.805 11.703 1.00 0.00 H ATOM 2822 HD13 ILE B 85 32.663 1.331 10.308 1.00 0.00 H ATOM 2823 HG21 ILE B 85 29.249 5.074 10.369 1.00 0.00 H ATOM 2824 HG22 ILE B 85 30.882 4.545 10.844 1.00 0.00 H ATOM 2825 HG23 ILE B 85 30.427 4.594 9.123 1.00 0.00 H ATOM 2826 H ILE B 85 28.156 0.811 10.950 1.00 0.00 H ATOM 2827 N GLY B 86 27.903 4.299 13.003 1.00 12.43 N ATOM 2828 CA GLY B 86 26.779 5.122 13.432 1.00 12.65 C ATOM 2829 C GLY B 86 26.921 6.575 13.030 1.00 12.75 C ATOM 2830 O GLY B 86 27.872 6.958 12.342 1.00 13.43 O ATOM 2831 HA3 GLY B 86 26.703 5.068 14.518 1.00 0.00 H ATOM 2832 HA2 GLY B 86 25.867 4.725 12.985 1.00 0.00 H ATOM 2833 H GLY B 86 28.780 4.316 13.562 1.00 0.00 H ATOM 2834 N ARG B 87 25.971 7.398 13.464 1.00 12.99 N ATOM 2835 CA ARG B 87 25.911 8.781 13.001 1.00 13.21 C ATOM 2836 C ARG B 87 27.155 9.592 13.334 1.00 13.31 C ATOM 2837 O ARG B 87 27.497 10.521 12.605 1.00 14.92 O ATOM 2838 CB ARG B 87 24.671 9.494 13.540 1.00 13.52 C ATOM 2839 CG ARG B 87 23.382 8.951 12.947 1.00 13.77 C ATOM 2840 CD ARG B 87 22.122 9.705 13.368 1.00 13.74 C ATOM 2841 NE ARG B 87 21.958 9.734 14.819 1.00 13.87 N ATOM 2842 CZ ARG B 87 22.301 10.739 15.618 1.00 15.26 C ATOM 2843 NH1 ARG B 87 22.829 11.863 15.149 1.00 14.67 N ATOM 2844 NH2 ARG B 87 22.107 10.618 16.926 1.00 14.93 N ATOM 2845 HA ARG B 87 25.853 8.718 11.914 1.00 0.00 H ATOM 2846 HB2 ARG B 87 24.638 9.368 14.622 1.00 0.00 H ATOM 2847 HB3 ARG B 87 24.746 10.555 13.301 1.00 0.00 H ATOM 2848 HG2 ARG B 87 23.460 8.999 11.861 1.00 0.00 H ATOM 2849 HG3 ARG B 87 23.276 7.911 13.257 1.00 0.00 H ATOM 2850 HD2 ARG B 87 21.255 9.215 12.926 1.00 0.00 H ATOM 2851 HD3 ARG B 87 22.186 10.729 13.001 1.00 0.00 H ATOM 2852 HE ARG B 87 21.536 8.895 15.266 1.00 0.00 H ATOM 2853 HH12 ARG B 87 23.086 12.629 15.803 1.00 0.00 H ATOM 2854 HH11 ARG B 87 22.986 11.977 14.127 1.00 0.00 H ATOM 2855 HH22 ARG B 87 22.370 11.395 17.565 1.00 0.00 H ATOM 2856 HH21 ARG B 87 21.692 9.746 17.312 1.00 0.00 H ATOM 2857 H ARG B 87 25.262 7.052 14.142 1.00 0.00 H ATOM 2858 N ASN B 88 27.835 9.261 14.424 1.00 12.79 N ATOM 2859 CA ASN B 88 29.018 10.046 14.764 1.00 13.36 C ATOM 2860 C ASN B 88 30.066 10.046 13.650 1.00 13.92 C ATOM 2861 O ASN B 88 30.758 11.058 13.455 1.00 14.50 O ATOM 2862 CB ASN B 88 29.641 9.604 16.084 1.00 13.54 C ATOM 2863 CG ASN B 88 30.304 8.253 15.988 1.00 13.12 C ATOM 2864 OD1 ASN B 88 29.690 7.280 15.545 1.00 13.59 O ATOM 2865 ND2 ASN B 88 31.553 8.177 16.427 1.00 13.32 N ATOM 2866 HA ASN B 88 28.667 11.071 14.883 1.00 0.00 H ATOM 2867 HB2 ASN B 88 30.388 10.340 16.381 1.00 0.00 H ATOM 2868 HB3 ASN B 88 28.858 9.556 16.841 1.00 0.00 H ATOM 2869 HD22 ASN B 88 32.029 9.027 16.792 1.00 0.00 H ATOM 2870 HD21 ASN B 88 32.057 7.267 16.407 1.00 0.00 H ATOM 2871 H ASN B 88 27.533 8.464 15.020 1.00 0.00 H ATOM 2872 N LEU B 89 30.173 8.949 12.898 1.00 14.01 N ATOM 2873 CA LEU B 89 31.102 8.913 11.769 1.00 13.84 C ATOM 2874 C LEU B 89 30.392 9.135 10.433 1.00 14.14 C ATOM 2875 O LEU B 89 30.986 9.675 9.502 1.00 14.85 O ATOM 2876 CB LEU B 89 31.885 7.597 11.740 1.00 14.07 C ATOM 2877 CG LEU B 89 32.699 7.245 12.986 1.00 13.91 C ATOM 2878 CD1 LEU B 89 33.536 5.997 12.730 1.00 14.36 C ATOM 2879 CD2 LEU B 89 33.592 8.387 13.455 1.00 14.47 C ATOM 2880 HA LEU B 89 31.803 9.735 11.913 1.00 0.00 H ATOM 2881 HB2 LEU B 89 31.169 6.792 11.577 1.00 0.00 H ATOM 2882 HB3 LEU B 89 32.576 7.644 10.898 1.00 0.00 H ATOM 2883 HG LEU B 89 31.984 7.054 13.786 1.00 0.00 H ATOM 2884 HD21 LEU B 89 34.294 8.647 12.662 1.00 0.00 H ATOM 2885 HD22 LEU B 89 32.976 9.253 13.695 1.00 0.00 H ATOM 2886 HD23 LEU B 89 34.143 8.075 14.342 1.00 0.00 H ATOM 2887 HD11 LEU B 89 32.878 5.164 12.485 1.00 0.00 H ATOM 2888 HD12 LEU B 89 34.216 6.181 11.898 1.00 0.00 H ATOM 2889 HD13 LEU B 89 34.111 5.757 13.624 1.00 0.00 H ATOM 2890 H LEU B 89 29.592 8.114 13.116 1.00 0.00 H ATOM 2891 N LEU B 90 29.131 8.726 10.324 1.00 14.12 N ATOM 2892 CA LEU B 90 28.400 8.971 9.083 1.00 14.10 C ATOM 2893 C LEU B 90 28.334 10.466 8.774 1.00 14.26 C ATOM 2894 O LEU B 90 28.410 10.859 7.614 1.00 14.97 O ATOM 2895 CB LEU B 90 26.984 8.394 9.130 1.00 14.39 C ATOM 2896 CG LEU B 90 26.890 6.867 9.198 1.00 14.87 C ATOM 2897 CD1 LEU B 90 25.446 6.458 9.406 1.00 15.33 C ATOM 2898 CD2 LEU B 90 27.460 6.194 7.958 1.00 15.96 C ATOM 2899 HA LEU B 90 28.948 8.464 8.289 1.00 0.00 H ATOM 2900 HB2 LEU B 90 26.486 8.800 10.011 1.00 0.00 H ATOM 2901 HB3 LEU B 90 26.459 8.722 8.233 1.00 0.00 H ATOM 2902 HG LEU B 90 27.494 6.534 10.042 1.00 0.00 H ATOM 2903 HD21 LEU B 90 26.908 6.527 7.079 1.00 0.00 H ATOM 2904 HD22 LEU B 90 28.511 6.462 7.851 1.00 0.00 H ATOM 2905 HD23 LEU B 90 27.368 5.113 8.058 1.00 0.00 H ATOM 2906 HD11 LEU B 90 25.079 6.887 10.338 1.00 0.00 H ATOM 2907 HD12 LEU B 90 24.843 6.823 8.575 1.00 0.00 H ATOM 2908 HD13 LEU B 90 25.381 5.371 9.454 1.00 0.00 H ATOM 2909 H LEU B 90 28.669 8.236 11.116 1.00 0.00 H ATOM 2910 N THR B 91 28.159 11.295 9.798 1.00 14.52 N ATOM 2911 CA THR B 91 28.144 12.739 9.590 1.00 14.39 C ATOM 2912 C THR B 91 29.488 13.239 9.075 1.00 14.79 C ATOM 2913 O THR B 91 29.539 14.171 8.271 1.00 15.98 O ATOM 2914 CB THR B 91 27.771 13.507 10.867 1.00 15.32 C ATOM 2915 OG1 THR B 91 28.593 13.065 11.952 1.00 16.15 O ATOM 2916 CG2 THR B 91 26.303 13.307 11.210 1.00 15.94 C ATOM 2917 HA THR B 91 27.377 12.930 8.839 1.00 0.00 H ATOM 2918 HB THR B 91 27.939 14.570 10.695 1.00 0.00 H ATOM 2919 HG1 THR B 91 28.350 13.562 12.773 1.00 0.00 H ATOM 2920 HG23 THR B 91 25.687 13.647 10.377 1.00 0.00 H ATOM 2921 HG21 THR B 91 26.115 12.249 11.395 1.00 0.00 H ATOM 2922 HG22 THR B 91 26.058 13.882 12.103 1.00 0.00 H ATOM 2923 H THR B 91 28.032 10.911 10.756 1.00 0.00 H ATOM 2924 N GLN B 92 30.580 12.634 9.532 1.00 13.99 N ATOM 2925 CA GLN B 92 31.895 13.109 9.123 1.00 13.96 C ATOM 2926 C GLN B 92 32.158 12.876 7.643 1.00 14.30 C ATOM 2927 O GLN B 92 32.914 13.623 7.031 1.00 15.73 O ATOM 2928 CB GLN B 92 33.010 12.436 9.928 1.00 13.97 C ATOM 2929 CG GLN B 92 33.000 12.773 11.410 1.00 13.75 C ATOM 2930 CD GLN B 92 34.317 12.455 12.098 1.00 14.33 C ATOM 2931 OE1 GLN B 92 35.329 12.197 11.446 1.00 15.27 O ATOM 2932 NE2 GLN B 92 34.311 12.485 13.429 1.00 14.44 N ATOM 2933 HA GLN B 92 31.897 14.182 9.317 1.00 0.00 H ATOM 2934 HB2 GLN B 92 32.904 11.356 9.822 1.00 0.00 H ATOM 2935 HB3 GLN B 92 33.968 12.749 9.513 1.00 0.00 H ATOM 2936 HG2 GLN B 92 32.796 13.838 11.523 1.00 0.00 H ATOM 2937 HG3 GLN B 92 32.208 12.200 11.892 1.00 0.00 H ATOM 2938 HE22 GLN B 92 33.433 12.708 13.940 1.00 0.00 H ATOM 2939 HE21 GLN B 92 35.184 12.286 13.958 1.00 0.00 H ATOM 2940 H GLN B 92 30.496 11.824 10.179 1.00 0.00 H ATOM 2941 N ILE B 93 31.546 11.839 7.078 1.00 14.91 N ATOM 2942 CA ILE B 93 31.726 11.527 5.667 1.00 14.68 C ATOM 2943 C ILE B 93 30.620 12.111 4.786 1.00 15.32 C ATOM 2944 O ILE B 93 30.572 11.833 3.587 1.00 16.48 O ATOM 2945 CB ILE B 93 31.904 10.007 5.413 1.00 14.47 C ATOM 2946 CG1 ILE B 93 30.612 9.227 5.681 1.00 15.24 C ATOM 2947 CG2 ILE B 93 33.056 9.444 6.248 1.00 15.48 C ATOM 2948 CD1 ILE B 93 30.730 7.747 5.342 1.00 15.39 C ATOM 2949 HA ILE B 93 32.656 12.015 5.376 1.00 0.00 H ATOM 2950 HB ILE B 93 32.148 9.884 4.358 1.00 0.00 H ATOM 2951 HG12 ILE B 93 30.361 9.323 6.737 1.00 0.00 H ATOM 2952 HG13 ILE B 93 29.813 9.659 5.078 1.00 0.00 H ATOM 2953 HD11 ILE B 93 30.972 7.636 4.285 1.00 0.00 H ATOM 2954 HD12 ILE B 93 31.519 7.299 5.946 1.00 0.00 H ATOM 2955 HD13 ILE B 93 29.783 7.250 5.554 1.00 0.00 H ATOM 2956 HG21 ILE B 93 33.981 9.955 5.980 1.00 0.00 H ATOM 2957 HG22 ILE B 93 32.846 9.600 7.306 1.00 0.00 H ATOM 2958 HG23 ILE B 93 33.159 8.377 6.051 1.00 0.00 H ATOM 2959 H ILE B 93 30.925 11.238 7.657 1.00 0.00 H ATOM 2960 N GLY B 94 29.737 12.918 5.368 1.00 15.46 N ATOM 2961 CA GLY B 94 28.717 13.616 4.590 1.00 15.62 C ATOM 2962 C GLY B 94 27.568 12.734 4.135 1.00 15.92 C ATOM 2963 O GLY B 94 26.937 13.000 3.107 1.00 16.08 O ATOM 2964 HA3 GLY B 94 29.193 14.041 3.706 1.00 0.00 H ATOM 2965 HA2 GLY B 94 28.309 14.419 5.204 1.00 0.00 H ATOM 2966 H GLY B 94 29.774 13.055 6.398 1.00 0.00 H ATOM 2967 N CYS B 95 27.280 11.686 4.901 1.00 16.90 N ATOM 2968 CA CYS B 95 26.217 10.745 4.542 1.00 16.86 C ATOM 2969 C CYS B 95 24.841 11.308 4.885 1.00 16.85 C ATOM 2970 O CYS B 95 24.630 11.806 5.992 1.00 17.13 O ATOM 2971 CB CYS B 95 26.445 9.404 5.242 1.00 17.71 C ATOM 2972 SG CYS B 95 25.400 8.044 4.667 1.00 20.03 S ATOM 2973 HA CYS B 95 26.248 10.588 3.464 1.00 0.00 H ATOM 2974 HB2 CYS B 95 26.260 9.544 6.307 1.00 0.00 H ATOM 2975 HB3 CYS B 95 27.485 9.117 5.090 1.00 0.00 H ATOM 2976 HG CYS B 95 25.705 6.900 5.376 1.00 0.00 H ATOM 2977 H CYS B 95 27.822 11.531 5.775 1.00 0.00 H ATOM 2978 N THR B 96 23.916 11.216 3.931 1.00 16.81 N ATOM 2979 CA THR B 96 22.523 11.588 4.145 1.00 16.61 C ATOM 2980 C THR B 96 21.604 10.467 3.669 1.00 16.70 C ATOM 2981 O THR B 96 22.015 9.575 2.924 1.00 16.51 O ATOM 2982 CB THR B 96 22.137 12.857 3.371 1.00 17.08 C ATOM 2983 OG1 THR B 96 22.339 12.650 1.968 1.00 17.94 O ATOM 2984 CG2 THR B 96 22.960 14.046 3.844 1.00 16.95 C ATOM 2985 HA THR B 96 22.410 11.770 5.214 1.00 0.00 H ATOM 2986 HB THR B 96 21.084 13.071 3.557 1.00 0.00 H ATOM 2987 HG1 THR B 96 23.292 12.441 1.800 1.00 0.00 H ATOM 2988 HG23 THR B 96 22.800 14.195 4.912 1.00 0.00 H ATOM 2989 HG21 THR B 96 24.016 13.852 3.657 1.00 0.00 H ATOM 2990 HG22 THR B 96 22.651 14.939 3.301 1.00 0.00 H ATOM 2991 H THR B 96 24.200 10.864 2.994 1.00 0.00 H ATOM 2992 N LEU B 97 20.351 10.539 4.109 1.00 16.39 N ATOM 2993 CA LEU B 97 19.274 9.706 3.593 1.00 16.97 C ATOM 2994 C LEU B 97 18.459 10.498 2.593 1.00 16.73 C ATOM 2995 O LEU B 97 18.200 11.678 2.820 1.00 17.17 O ATOM 2996 CB LEU B 97 18.331 9.306 4.725 1.00 17.41 C ATOM 2997 CG LEU B 97 18.918 8.278 5.679 1.00 19.80 C ATOM 2998 CD1 LEU B 97 18.119 8.251 6.970 1.00 21.53 C ATOM 2999 CD2 LEU B 97 18.983 6.905 5.037 1.00 22.46 C ATOM 3000 HA LEU B 97 19.715 8.823 3.132 1.00 0.00 H ATOM 3001 HB2 LEU B 97 18.080 10.200 5.295 1.00 0.00 H ATOM 3002 HB3 LEU B 97 17.424 8.890 4.286 1.00 0.00 H ATOM 3003 HG LEU B 97 19.942 8.568 5.915 1.00 0.00 H ATOM 3004 HD21 LEU B 97 17.978 6.587 4.759 1.00 0.00 H ATOM 3005 HD22 LEU B 97 19.610 6.951 4.147 1.00 0.00 H ATOM 3006 HD23 LEU B 97 19.407 6.194 5.746 1.00 0.00 H ATOM 3007 HD11 LEU B 97 18.153 9.235 7.437 1.00 0.00 H ATOM 3008 HD12 LEU B 97 17.085 7.987 6.750 1.00 0.00 H ATOM 3009 HD13 LEU B 97 18.548 7.511 7.646 1.00 0.00 H ATOM 3010 H LEU B 97 20.129 11.224 4.859 1.00 0.00 H ATOM 3011 N ASN B 98 18.063 9.861 1.496 1.00 16.38 N ATOM 3012 CA ASN B 98 17.350 10.553 0.437 1.00 15.95 C ATOM 3013 C ASN B 98 16.209 9.706 -0.094 1.00 16.26 C ATOM 3014 O ASN B 98 16.401 8.527 -0.381 1.00 16.64 O ATOM 3015 CB ASN B 98 18.322 10.899 -0.691 1.00 15.78 C ATOM 3016 CG ASN B 98 19.416 11.840 -0.228 1.00 16.19 C ATOM 3017 OD1 ASN B 98 19.305 13.059 -0.379 1.00 20.04 O ATOM 3018 ND2 ASN B 98 20.465 11.284 0.356 1.00 16.51 N ATOM 3019 HA ASN B 98 16.925 11.470 0.844 1.00 0.00 H ATOM 3020 HB2 ASN B 98 18.779 9.980 -1.056 1.00 0.00 H ATOM 3021 HB3 ASN B 98 17.768 11.374 -1.500 1.00 0.00 H ATOM 3022 HD22 ASN B 98 20.515 10.251 0.461 1.00 0.00 H ATOM 3023 HD21 ASN B 98 21.240 11.880 0.710 1.00 0.00 H ATOM 3024 H ASN B 98 18.268 8.847 1.394 1.00 0.00 H ATOM 3025 N PHE B 99 15.025 10.302 -0.204 1.00 15.78 N ATOM 3026 CA PHE B 99 13.900 9.664 -0.876 1.00 15.96 C ATOM 3027 C PHE B 99 12.936 10.717 -1.407 1.00 15.93 C ATOM 3028 O PHE B 99 13.279 11.894 -1.418 1.00 15.83 O ATOM 3029 CB PHE B 99 13.180 8.674 0.039 1.00 17.16 C ATOM 3030 CG PHE B 99 12.602 9.279 1.286 1.00 16.97 C ATOM 3031 CD1 PHE B 99 13.393 9.500 2.400 1.00 19.21 C ATOM 3032 CD2 PHE B 99 11.255 9.599 1.351 1.00 18.66 C ATOM 3033 CE1 PHE B 99 12.855 10.041 3.550 1.00 19.08 C ATOM 3034 CE2 PHE B 99 10.709 10.138 2.496 1.00 19.10 C ATOM 3035 CZ PHE B 99 11.510 10.363 3.597 1.00 19.90 C ATOM 3036 HA PHE B 99 14.293 9.094 -1.718 1.00 0.00 H ATOM 3037 OXT PHE B 99 11.820 10.419 -1.835 1.00 16.04 O ATOM 3038 HB2 PHE B 99 12.367 8.218 -0.526 1.00 0.00 H ATOM 3039 HB3 PHE B 99 13.892 7.903 0.334 1.00 0.00 H ATOM 3040 HD2 PHE B 99 10.618 9.422 0.484 1.00 0.00 H ATOM 3041 HE2 PHE B 99 9.648 10.386 2.532 1.00 0.00 H ATOM 3042 HZ PHE B 99 11.084 10.794 4.503 1.00 0.00 H ATOM 3043 HE1 PHE B 99 13.489 10.214 4.420 1.00 0.00 H ATOM 3044 HD1 PHE B 99 14.452 9.244 2.369 1.00 0.00 H ATOM 3045 H PHE B 99 14.898 11.251 0.201 1.00 0.00 H TER 3046 PHE B 99 HETATM 3047 O HOH 1 9.371 -5.126 1.647 1.00 30.39 O HETATM 3048 O HOH 2 16.467 1.327 -1.172 1.00 13.54 O HETATM 3049 O HOH 3 3.658 -8.127 5.322 1.00 18.35 O HETATM 3050 O HOH 4 11.892 -15.402 15.437 1.00 17.61 O HETATM 3051 O HOH 5 13.373 7.556 -4.431 1.00 18.17 O HETATM 3052 O HOH 6 14.637 -6.285 5.321 1.00 23.38 O HETATM 3053 O HOH 7 9.159 -5.693 9.990 1.00 14.80 O HETATM 3054 O HOH 8 -2.935 3.460 14.922 1.00 32.33 O HETATM 3055 O HOH 9 11.188 -9.966 25.357 1.00 15.55 O HETATM 3056 O HOH 10 14.381 1.598 -2.926 1.00 14.93 O HETATM 3057 O HOH 11 -0.459 4.315 6.155 1.00 15.91 O HETATM 3058 O HOH 12 16.827 7.847 -3.318 1.00 14.88 O HETATM 3059 O HOH 13 20.423 -3.319 7.480 1.00 11.51 O HETATM 3060 O HOH 14 20.089 -2.879 18.562 1.00 17.46 O HETATM 3061 O HOH 15 9.716 7.007 18.116 1.00 25.79 O HETATM 3062 O HOH 16 19.594 -12.763 23.829 1.00 24.72 O HETATM 3063 O HOH 17 8.869 -10.437 26.714 1.00 17.74 O HETATM 3064 O HOH 18 -2.200 1.283 8.954 1.00 16.01 O HETATM 3065 O HOH 19 20.629 -5.007 9.663 1.00 14.41 O HETATM 3066 O HOH 20 8.155 -7.630 24.527 1.00 23.36 O HETATM 3067 O HOH 21 4.023 2.556 18.154 1.00 26.31 O HETATM 3068 O HOH 22 17.067 -9.440 14.653 1.00 22.03 O HETATM 3069 O HOH 23 0.711 3.633 3.659 1.00 15.94 O HETATM 3070 O HOH 24 8.761 13.963 -0.449 1.00 40.91 O HETATM 3071 O HOH 25 9.635 -8.267 6.045 1.00 33.42 O HETATM 3072 O HOH 26 10.106 -7.691 8.621 1.00 28.50 O HETATM 3073 O HOH 27 4.591 5.896 19.051 1.00 23.86 O HETATM 3074 O HOH 28 -0.862 -10.289 10.671 1.00 22.26 O HETATM 3075 O HOH 29 5.323 8.654 18.388 1.00 28.20 O HETATM 3076 O HOH 30 -2.777 10.695 15.357 1.00 23.40 O HETATM 3077 O HOH 31 4.754 -3.935 -0.247 1.00 28.17 O HETATM 3078 O HOH 32 18.245 13.911 11.328 1.00 22.72 O HETATM 3079 O HOH 33 13.731 -9.723 8.467 1.00 29.62 O HETATM 3080 O HOH 34 7.304 0.044 23.532 1.00 19.99 O HETATM 3081 O HOH 35 3.151 10.369 6.421 1.00 26.53 O HETATM 3082 O HOH 36 10.459 13.621 5.914 1.00 34.33 O HETATM 3083 O HOH 37 16.447 -9.124 26.104 1.00 23.17 O HETATM 3084 O HOH 38 -0.931 -7.988 23.155 1.00 34.23 O HETATM 3085 O HOH 39 25.862 14.800 15.349 1.00 20.27 O HETATM 3086 O HOH 40 -8.597 6.448 7.974 1.00 20.98 O HETATM 3087 O HOH 41 -5.701 -10.727 10.825 1.00 34.13 O HETATM 3088 O HOH 42 -3.603 -4.243 4.247 1.00 28.48 O HETATM 3089 O HOH 43 -1.814 4.251 2.654 1.00 24.76 O HETATM 3090 O HOH 44 -4.361 -7.975 17.579 1.00 41.42 O HETATM 3091 O HOH 45 5.560 -12.369 21.218 1.00 24.71 O HETATM 3092 O HOH 46 5.201 -4.111 24.085 1.00 37.43 O HETATM 3093 O HOH 47 5.645 -9.963 22.785 1.00 26.33 O HETATM 3094 O HOH 48 4.842 -6.056 1.491 1.00 32.61 O HETATM 3095 O HOH 49 6.733 -14.558 8.522 1.00 47.65 O HETATM 3096 O HOH 50 -9.749 -10.409 13.685 1.00 47.89 O HETATM 3097 O HOH 51 18.185 18.195 5.169 1.00 24.46 O HETATM 3098 O HOH 52 20.436 18.729 3.576 1.00 24.36 O HETATM 3099 O HOH 53 6.781 -4.559 -2.003 1.00 26.41 O HETATM 3100 O HOH 54 20.068 16.260 11.309 1.00 20.62 O HETATM 3101 O HOH 55 7.667 6.762 -2.345 1.00 25.14 O HETATM 3102 O HOH 56 31.398 11.246 -2.850 1.00 34.46 O HETATM 3103 O HOH 57 23.983 -8.308 19.651 1.00 28.27 O HETATM 3104 O HOH 58 24.942 10.091 -4.100 1.00 35.80 O HETATM 3105 O HOH 59 24.614 19.839 6.733 1.00 26.61 O HETATM 3106 O HOH 60 15.943 14.260 15.951 1.00 25.61 O HETATM 3107 O HOH 61 16.434 -10.261 10.148 1.00 26.97 O HETATM 3108 O HOH 62 6.887 4.110 24.559 1.00 29.80 O HETATM 3109 O HOH 63 8.918 5.646 24.797 1.00 41.37 O HETATM 3110 O HOH 64 -1.107 -1.615 23.669 1.00 32.31 O HETATM 3111 O HOH 65 -1.152 -5.232 24.039 1.00 27.87 O HETATM 3112 O HOH 66 -3.288 -8.120 12.031 1.00 24.90 O HETATM 3113 O HOH 67 -4.556 -5.868 9.855 1.00 26.98 O HETATM 3114 O HOH 68 -7.213 -6.344 6.514 1.00 29.57 O HETATM 3115 O HOH 69 1.669 -12.293 11.339 1.00 23.20 O HETATM 3116 O HOH 70 0.199 -13.025 7.514 1.00 30.48 O HETATM 3117 O HOH 71 3.119 -10.785 4.224 1.00 40.21 O HETATM 3118 O HOH 72 5.830 -7.406 22.216 1.00 31.44 O HETATM 3119 O HOH 73 18.393 17.267 7.596 1.00 25.96 O HETATM 3120 O HOH 74 17.133 6.282 19.490 1.00 27.39 O HETATM 3121 O HOH 75 19.962 -7.856 27.636 1.00 28.45 O HETATM 3122 O HOH 76 14.855 17.922 1.881 1.00 32.46 O HETATM 3123 O HOH 77 22.069 10.818 20.607 1.00 39.73 O HETATM 3124 O HOH 78 4.034 12.675 15.241 1.00 33.95 O HETATM 3125 O HOH 79 6.748 12.955 14.464 1.00 28.30 O HETATM 3126 O HOH 80 2.721 15.011 13.974 1.00 24.80 O HETATM 3127 O HOH 81 -6.188 7.373 7.350 1.00 30.25 O HETATM 3128 O HOH 82 -3.941 3.103 3.485 1.00 26.50 O HETATM 3129 O HOH 83 7.514 -15.294 13.534 1.00 26.59 O HETATM 3130 O HOH 84 10.459 -3.910 -0.263 1.00 27.19 O HETATM 3131 O HOH 85 10.007 -5.609 -4.436 1.00 37.78 O HETATM 3132 O HOH 86 8.039 -14.649 10.891 1.00 62.89 O HETATM 3133 O HOH 87 -1.134 11.282 5.736 1.00 42.11 O HETATM 3134 O HOH 88 3.546 12.945 6.898 1.00 46.34 O HETATM 3135 O HOH 89 18.265 -9.654 6.348 1.00 33.02 O HETATM 3136 O HOH 90 15.668 -8.705 5.747 1.00 36.61 O HETATM 3137 O HOH 91 -0.985 3.685 19.039 1.00 37.79 O HETATM 3138 O HOH 92 2.528 -16.046 22.336 1.00 42.29 O HETATM 3139 O HOH 93 4.320 -14.121 22.791 1.00 41.56 O HETATM 3140 O HOH 94 7.807 -14.008 20.781 1.00 30.71 O HETATM 3141 O HOH 95 3.827 -13.954 7.888 1.00 33.49 O HETATM 3142 O HOH 96 -4.635 0.890 2.532 1.00 37.73 O HETATM 3143 O HOH 97 7.408 -10.427 6.388 1.00 35.88 O HETATM 3144 O HOH 98 20.058 7.618 14.900 1.00 12.03 O HETATM 3145 O HOH 99 21.674 4.510 18.989 1.00 15.00 O HETATM 3146 O HOH 100 20.694 -2.978 -2.000 1.00 18.48 O HETATM 3147 O HOH 101 25.176 -7.449 22.004 1.00 19.60 O HETATM 3148 O HOH 102 19.453 6.030 17.835 1.00 20.49 O HETATM 3149 O HOH 103 22.638 -2.135 0.549 1.00 22.36 O HETATM 3150 O HOH 104 28.391 14.852 14.137 1.00 18.38 O HETATM 3151 O HOH 105 42.835 3.451 12.916 1.00 15.56 O HETATM 3152 O HOH 106 36.657 10.672 19.745 1.00 22.94 O HETATM 3153 O HOH 107 30.940 5.795 18.784 1.00 12.73 O HETATM 3154 O HOH 108 41.847 3.883 9.359 1.00 19.75 O HETATM 3155 O HOH 109 46.288 -4.339 11.996 1.00 24.26 O HETATM 3156 O HOH 110 21.265 -8.338 3.164 1.00 24.74 O HETATM 3157 O HOH 111 28.196 -6.763 27.956 1.00 17.05 O HETATM 3158 O HOH 112 44.166 2.212 9.265 1.00 19.94 O HETATM 3159 O HOH 113 23.590 -8.980 3.280 1.00 31.81 O HETATM 3160 O HOH 114 32.936 10.590 17.341 1.00 15.92 O HETATM 3161 O HOH 115 17.518 14.310 -1.852 1.00 24.90 O HETATM 3162 O HOH 116 25.889 10.723 17.543 1.00 26.82 O HETATM 3163 O HOH 117 23.418 -0.271 -3.497 1.00 22.63 O HETATM 3164 O HOH 118 41.938 -7.511 16.776 1.00 28.63 O HETATM 3165 O HOH 119 10.991 8.294 -3.212 1.00 19.23 O HETATM 3166 O HOH 120 19.495 -1.613 -5.932 1.00 23.47 O HETATM 3167 O HOH 121 37.953 2.468 2.663 1.00 27.36 O HETATM 3168 O HOH 122 27.728 9.161 -5.112 1.00 45.86 O HETATM 3169 O HOH 123 22.154 -7.037 28.858 1.00 23.79 O HETATM 3170 O HOH 124 34.511 -7.962 9.008 1.00 30.21 O HETATM 3171 O HOH 125 40.607 8.686 8.776 1.00 19.65 O HETATM 3172 O HOH 126 24.487 14.065 7.632 1.00 19.28 O HETATM 3173 O HOH 127 22.001 9.333 -7.224 1.00 42.09 O HETATM 3174 O HOH 128 30.257 14.494 16.182 1.00 23.18 O HETATM 3175 O HOH 129 23.111 4.031 24.915 1.00 25.28 O HETATM 3176 O HOH 130 24.885 13.391 1.148 1.00 22.01 O HETATM 3177 O HOH 131 40.929 6.509 23.803 1.00 28.36 O HETATM 3178 O HOH 132 32.037 12.578 15.305 1.00 20.60 O HETATM 3179 O HOH 133 43.585 0.807 27.907 1.00 55.70 O HETATM 3180 O HOH 134 28.513 4.277 30.223 1.00 23.51 O HETATM 3181 O HOH 135 25.796 1.318 -4.413 1.00 34.07 O HETATM 3182 O HOH 136 25.499 16.062 6.007 1.00 32.25 O HETATM 3183 O HOH 137 40.222 -7.336 14.524 1.00 30.10 O HETATM 3184 O HOH 138 44.707 -2.166 5.055 1.00 37.32 O HETATM 3185 O HOH 139 27.985 14.857 1.259 1.00 33.69 O HETATM 3186 O HOH 140 35.084 -7.696 11.904 1.00 31.59 O HETATM 3187 O HOH 141 33.951 12.498 3.122 1.00 28.84 O HETATM 3188 O HOH 142 24.910 -6.651 1.823 1.00 24.83 O HETATM 3189 O HOH 143 36.023 -4.983 28.463 1.00 38.43 O HETATM 3190 O HOH 144 31.489 11.447 19.900 1.00 58.92 O HETATM 3191 O HOH 145 15.622 12.634 -2.748 1.00 21.42 O HETATM 3192 O HOH 146 33.230 5.648 -2.155 1.00 34.82 O HETATM 3193 O HOH 147 25.733 -9.048 8.088 1.00 29.53 O HETATM 3194 O HOH 148 24.831 -10.046 5.589 1.00 32.76 O HETATM 3195 O HOH 149 30.109 -7.533 3.776 1.00 33.90 O HETATM 3196 O HOH 150 29.938 -6.522 10.003 1.00 21.90 O HETATM 3197 O HOH 151 29.791 -8.872 6.256 1.00 28.15 O HETATM 3198 O HOH 152 36.504 0.628 1.459 1.00 29.94 O HETATM 3199 O HOH 153 42.958 -8.129 3.584 1.00 65.36 O HETATM 3200 O HOH 154 30.014 8.202 19.906 1.00 32.14 O HETATM 3201 O HOH 155 23.440 7.690 22.493 1.00 31.25 O HETATM 3202 O HOH 156 25.955 8.942 21.531 1.00 32.24 O HETATM 3203 O HOH 157 23.800 5.150 21.945 1.00 35.25 O HETATM 3204 O HOH 158 35.524 -5.542 14.690 1.00 26.95 O HETATM 3205 O HOH 159 31.800 -9.246 18.911 1.00 31.21 O HETATM 3206 O HOH 160 49.612 2.956 21.571 1.00 44.04 O HETATM 3207 O HOH 161 48.275 0.434 22.349 1.00 36.03 O HETATM 3208 O HOH 162 42.821 4.889 22.129 1.00 48.27 O HETATM 3209 O HOH 163 38.390 6.416 25.979 1.00 32.40 O HETATM 3210 O HOH 164 19.177 -4.798 29.288 1.00 23.66 O HETATM 3211 O HOH 165 35.629 13.298 5.625 1.00 25.06 O HETATM 3212 O HOH 166 23.570 -2.014 -5.385 1.00 43.10 O HETATM 3213 O HOH 167 18.926 10.503 -5.212 1.00 27.14 O HETATM 3214 O HOH 168 21.806 -2.575 -7.343 1.00 28.56 O HETATM 3215 O HOH 169 36.479 -6.780 4.884 1.00 35.77 O HETATM 3216 O HOH 170 28.310 -8.297 8.550 1.00 28.88 O HETATM 3217 O HOH 171 19.584 5.302 20.551 1.00 32.29 O HETATM 3218 O HOH 172 21.786 3.650 21.730 1.00 27.79 O HETATM 3219 O HOH 173 35.709 -11.735 25.165 1.00 37.73 O HETATM 3220 O HOH 174 37.561 -6.259 22.774 1.00 33.61 O HETATM 3221 O HOH 175 18.110 2.870 24.306 1.00 39.52 O HETATM 3222 O HOH 176 18.367 0.036 24.936 1.00 35.85 O HETATM 3223 O HOH 177 13.986 -3.084 24.732 1.00 32.06 O HETATM 3224 O HOH 178 28.937 13.119 18.014 1.00 32.54 O HETATM 3225 O HOH 179 12.547 12.088 -4.979 1.00 32.55 O HETATM 3226 O HOH 180 10.589 12.447 -2.831 1.00 31.13 O HETATM 3227 O HOH 181 44.310 3.271 15.273 1.00 38.09 O HETATM 3228 O HOH 182 27.006 12.377 16.044 1.00 33.12 O HETATM 3229 O HOH 183 36.749 -5.389 0.535 1.00 44.13 O HETATM 3230 O HOH 184 43.332 -3.838 26.601 1.00 39.38 O HETATM 3231 O HOH 185 44.101 -0.760 23.874 1.00 38.48 O HETATM 3232 O HOH 186 32.183 -6.305 27.031 1.00 30.49 O HETATM 3233 O HOH 187 30.351 -8.184 28.684 1.00 31.12 O HETATM 3234 O HOH 188 37.841 12.673 21.788 1.00 46.46 O HETATM 3235 O HOH 189 44.859 11.420 14.701 1.00 31.88 O HETATM 3236 O HOH 190 42.394 10.514 9.036 1.00 31.56 O HETATM 3237 O HOH 191 44.877 9.532 9.048 1.00 29.51 O HETATM 3238 O HOH 192 44.378 10.399 11.883 1.00 34.72 O HETATM 3239 O HOH 193 25.845 -5.799 18.406 1.00 49.00 O HETATM 3240 O QNC A 194 18.870 -5.758 11.780 1.00 -0.38 O HETATM 3241 C QNC A 194 19.111 -6.271 12.863 1.00 0.23 C HETATM 3242 C2 QNC A 194 19.934 -7.515 12.970 1.00 0.12 C HETATM 3243 N1 QNC A 194 20.167 -8.098 14.168 1.00 -0.27 N HETATM 3244 C8A QNC A 194 20.914 -9.224 14.256 1.00 0.05 C HETATM 3245 C4A QNC A 194 21.446 -9.806 13.113 1.00 0.01 C HETATM 3246 C4 QNC A 194 21.208 -9.221 11.883 1.00 -0.03 C HETATM 3247 C3 QNC A 194 20.448 -8.064 11.805 1.00 -0.01 C HETATM 3248 H1 QNC A 194 20.258 -7.595 10.846 1.00 0.07 H HETATM 3249 H2 QNC A 194 21.615 -9.666 10.982 1.00 0.08 H HETATM 3250 C5 QNC A 194 22.211 -10.966 13.175 1.00 -0.04 C HETATM 3251 C6 QNC A 194 22.458 -11.570 14.398 1.00 -0.05 C HETATM 3252 C7 QNC A 194 21.933 -10.994 15.547 1.00 -0.05 C HETATM 3253 C8 QNC A 194 21.166 -9.834 15.480 1.00 -0.04 C HETATM 3254 H6 QNC A 194 20.762 -9.403 16.389 1.00 0.07 H HETATM 3255 H5 QNC A 194 22.123 -11.454 16.510 1.00 0.07 H HETATM 3256 H4 QNC A 194 23.050 -12.476 14.456 1.00 0.07 H HETATM 3257 H3 QNC A 194 22.614 -11.398 12.266 1.00 0.07 H HETATM 3258 N QNC A 194 18.541 -5.575 13.843 1.00 -0.26 N HETATM 3259 CA QNC A 194 17.770 -4.479 14.354 1.00 0.15 C HETATM 3260 C QNC A 194 18.610 -3.583 15.221 1.00 0.20 C HETATM 3261 O QNC A 194 18.582 -3.706 16.427 1.00 -0.39 O HETATM 3262 N QNC A 194 19.330 -2.665 14.561 1.00 -0.28 N HETATM 3263 CA QNC A 194 20.183 -1.679 15.203 1.00 0.08 C HETATM 3264 C QNC A 194 19.796 -0.262 14.882 1.00 0.12 C HETATM 3265 O QNC A 194 19.975 0.113 13.610 1.00 -0.38 O HETATM 3266 H14 QNC A 194 20.893 0.029 13.382 1.00 0.21 H HETATM 3267 CM QNC A 194 20.066 0.671 15.819 1.00 -0.00 C HETATM 3268 N1 QNC A 194 19.301 0.758 17.012 1.00 0.26 N HETATM 3269 C2 QNC A 194 20.068 1.442 18.062 1.00 0.07 C HETATM 3270 C QNC A 194 21.369 0.755 18.377 1.00 0.23 C HETATM 3271 O QNC A 194 21.412 -0.462 18.507 1.00 -0.39 O HETATM 3272 N QNC A 194 22.405 1.587 18.542 1.00 -0.28 N HETATM 3273 C QNC A 194 23.760 1.222 18.911 1.00 0.04 C HETATM 3274 C1 QNC A 194 24.614 2.491 19.012 1.00 -0.04 C HETATM 3275 H43 QNC A 194 25.643 2.219 19.292 1.00 0.03 H HETATM 3276 H44 QNC A 194 24.190 3.158 19.777 1.00 0.03 H HETATM 3277 H45 QNC A 194 24.622 3.006 18.040 1.00 0.03 H HETATM 3278 C2 QNC A 194 23.756 0.516 20.262 1.00 -0.04 C HETATM 3279 H46 QNC A 194 24.786 0.242 20.536 1.00 0.03 H HETATM 3280 H47 QNC A 194 23.139 -0.393 20.199 1.00 0.03 H HETATM 3281 H48 QNC A 194 23.340 1.189 21.026 1.00 0.03 H HETATM 3282 C3 QNC A 194 24.310 0.313 17.810 1.00 -0.04 C HETATM 3283 H49 QNC A 194 25.340 0.017 18.059 1.00 0.03 H HETATM 3284 H50 QNC A 194 24.306 0.854 16.852 1.00 0.03 H HETATM 3285 H51 QNC A 194 23.680 -0.585 17.727 1.00 0.03 H HETATM 3286 H42 QNC A 194 22.227 2.560 18.396 1.00 0.19 H HETATM 3287 C3 QNC A 194 19.285 1.531 19.371 1.00 0.01 C HETATM 3288 C3A QNC A 194 17.975 2.290 19.209 1.00 -0.03 C HETATM 3289 C4 QNC A 194 17.159 2.274 20.501 1.00 -0.05 C HETATM 3290 C5 QNC A 194 16.476 0.942 20.785 1.00 -0.05 C HETATM 3291 C6 QNC A 194 15.661 0.500 19.578 1.00 -0.05 C HETATM 3292 C7 QNC A 194 16.584 0.368 18.372 1.00 -0.05 C HETATM 3293 C7A QNC A 194 17.221 1.714 18.018 1.00 0.00 C HETATM 3294 C8 QNC A 194 18.079 1.541 16.769 1.00 -0.03 C HETATM 3295 H40 QNC A 194 17.481 1.028 16.002 1.00 0.08 H HETATM 3296 H41 QNC A 194 18.368 2.537 16.402 1.00 0.08 H HETATM 3297 H39 QNC A 194 16.415 2.421 17.772 1.00 0.04 H HETATM 3298 H37 QNC A 194 16.002 0.008 17.511 1.00 0.03 H HETATM 3299 H38 QNC A 194 17.379 -0.356 18.605 1.00 0.03 H HETATM 3300 H35 QNC A 194 14.883 1.248 19.366 1.00 0.03 H HETATM 3301 H36 QNC A 194 15.189 -0.471 19.788 1.00 0.03 H HETATM 3302 H33 QNC A 194 15.809 1.054 21.652 1.00 0.03 H HETATM 3303 H34 QNC A 194 17.240 0.182 21.005 1.00 0.03 H HETATM 3304 H31 QNC A 194 16.384 3.052 20.431 1.00 0.03 H HETATM 3305 H32 QNC A 194 17.834 2.503 21.339 1.00 0.03 H HETATM 3306 H30 QNC A 194 18.211 3.340 18.983 1.00 0.03 H HETATM 3307 H28 QNC A 194 19.904 2.048 20.119 1.00 0.03 H HETATM 3308 H29 QNC A 194 19.063 0.512 19.721 1.00 0.03 H HETATM 3309 H27 QNC A 194 20.285 2.461 17.708 1.00 0.11 H HETATM 3310 H24 QNC A 194 19.056 -0.170 17.319 1.00 0.21 H HETATM 3311 H25 QNC A 194 19.979 1.648 15.321 1.00 0.08 H HETATM 3312 H26 QNC A 194 21.109 0.509 16.129 1.00 0.08 H HETATM 3313 H13 QNC A 194 18.699 -0.317 14.943 1.00 0.07 H HETATM 3314 CB QNC A 194 21.641 -1.864 14.787 1.00 0.01 C HETATM 3315 CG QNC A 194 22.101 -3.300 14.871 1.00 -0.04 C HETATM 3316 CD1 QNC A 194 22.490 -3.838 16.092 1.00 -0.06 C HETATM 3317 CE1 QNC A 194 22.910 -5.164 16.166 1.00 -0.07 C HETATM 3318 CZ QNC A 194 22.949 -5.936 15.013 1.00 -0.07 C HETATM 3319 CE2 QNC A 194 22.568 -5.393 13.792 1.00 -0.07 C HETATM 3320 CD2 QNC A 194 22.145 -4.069 13.714 1.00 -0.06 C HETATM 3321 H20 QNC A 194 21.853 -3.642 12.761 1.00 0.06 H HETATM 3322 H22 QNC A 194 22.600 -6.003 12.896 1.00 0.06 H HETATM 3323 H23 QNC A 194 23.278 -6.968 15.065 1.00 0.06 H HETATM 3324 H21 QNC A 194 23.205 -5.590 17.118 1.00 0.06 H HETATM 3325 H19 QNC A 194 22.467 -3.226 16.986 1.00 0.06 H HETATM 3326 H17 QNC A 194 22.274 -1.254 15.448 1.00 0.04 H HETATM 3327 H18 QNC A 194 21.756 -1.519 13.749 1.00 0.04 H HETATM 3328 H15 QNC A 194 20.102 -1.823 16.291 1.00 0.06 H HETATM 3329 H16 QNC A 194 19.277 -2.658 13.562 1.00 0.19 H HETATM 3330 CB QNC A 194 16.434 -4.906 14.925 1.00 0.08 C HETATM 3331 CG QNC A 194 15.712 -5.566 13.776 1.00 0.18 C HETATM 3332 OD1 QNC A 194 15.351 -4.903 12.821 1.00 -0.40 O HETATM 3333 ND2 QNC A 194 15.522 -6.882 13.857 1.00 -0.30 N HETATM 3334 H11 QNC A 194 15.049 -7.365 13.120 1.00 0.18 H HETATM 3335 H12 QNC A 194 15.853 -7.387 14.654 1.00 0.18 H HETATM 3336 H9 QNC A 194 15.870 -4.033 15.285 1.00 0.06 H HETATM 3337 H10 QNC A 194 16.576 -5.617 15.752 1.00 0.06 H HETATM 3338 H8 QNC A 194 17.513 -3.865 13.478 1.00 0.08 H HETATM 3339 H7 QNC A 194 18.776 -6.095 14.664 1.00 0.19 H CONECT 3240 3241 CONECT 3241 3240 3242 3258 CONECT 3242 3241 3243 3247 CONECT 3243 3242 3244 CONECT 3244 3243 3245 3253 CONECT 3245 3244 3246 3250 CONECT 3246 3245 3247 3249 CONECT 3247 3242 3246 3248 CONECT 3248 3247 CONECT 3249 3246 CONECT 3250 3245 3251 3257 CONECT 3251 3250 3252 3256 CONECT 3252 3251 3253 3255 CONECT 3253 3244 3252 3254 CONECT 3254 3253 CONECT 3255 3252 CONECT 3256 3251 CONECT 3257 3250 CONECT 3258 3241 3259 3339 CONECT 3259 3258 3260 3330 3338 CONECT 3260 3259 3261 3262 CONECT 3261 3260 CONECT 3262 3260 3263 3329 CONECT 3263 3262 3264 3314 3328 CONECT 3264 3263 3265 3267 3313 CONECT 3265 3264 3266 CONECT 3266 3265 CONECT 3267 3264 3268 3311 3312 CONECT 3268 3267 3269 3294 3310 CONECT 3269 3268 3270 3287 3309 CONECT 3270 3269 3271 3272 CONECT 3271 3270 CONECT 3272 3270 3273 3286 CONECT 3273 3272 3274 3278 3282 CONECT 3274 3273 3275 3276 3277 CONECT 3275 3274 CONECT 3276 3274 CONECT 3277 3274 CONECT 3278 3273 3279 3280 3281 CONECT 3279 3278 CONECT 3280 3278 CONECT 3281 3278 CONECT 3282 3273 3283 3284 3285 CONECT 3283 3282 CONECT 3284 3282 CONECT 3285 3282 CONECT 3286 3272 CONECT 3287 3269 3288 3307 3308 CONECT 3288 3287 3289 3293 3306 CONECT 3289 3288 3290 3304 3305 CONECT 3290 3289 3291 3302 3303 CONECT 3291 3290 3292 3300 3301 CONECT 3292 3291 3293 3298 3299 CONECT 3293 3288 3292 3294 3297 CONECT 3294 3268 3293 3295 3296 CONECT 3295 3294 CONECT 3296 3294 CONECT 3297 3293 CONECT 3298 3292 CONECT 3299 3292 CONECT 3300 3291 CONECT 3301 3291 CONECT 3302 3290 CONECT 3303 3290 CONECT 3304 3289 CONECT 3305 3289 CONECT 3306 3288 CONECT 3307 3287 CONECT 3308 3287 CONECT 3309 3269 CONECT 3310 3268 CONECT 3311 3267 CONECT 3312 3267 CONECT 3313 3264 CONECT 3314 3263 3315 3326 3327 CONECT 3315 3314 3316 3320 CONECT 3316 3315 3317 3325 CONECT 3317 3316 3318 3324 CONECT 3318 3317 3319 3323 CONECT 3319 3318 3320 3322 CONECT 3320 3315 3319 3321 CONECT 3321 3320 CONECT 3322 3319 CONECT 3323 3318 CONECT 3324 3317 CONECT 3325 3316 CONECT 3326 3314 CONECT 3327 3314 CONECT 3328 3263 CONECT 3329 3262 CONECT 3330 3259 3331 3336 3337 CONECT 3331 3330 3332 3333 CONECT 3332 3331 CONECT 3333 3331 3334 3335 CONECT 3334 3333 CONECT 3335 3333 CONECT 3336 3330 CONECT 3337 3330 CONECT 3338 3259 CONECT 3339 3258 MASTER 0 0 0 0 0 0 0 0 3337 2 100 16 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 2fgv
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1a94
RCSB PDB
PDBbind
99aa, >1A94_1|Chains... at 90%
1aid
RCSB PDB
PDBbind
99aa, >1AID_1|Chains... at 91%
1b6j
RCSB PDB
PDBbind
99aa, >1B6J_1|Chains... at 93%
1b6k
RCSB PDB
PDBbind
99aa, >1B6K_1|Chains... at 95%
1b6l
RCSB PDB
PDBbind
99aa, >1B6L_1|Chains... at 95%
1b6m
RCSB PDB
PDBbind
99aa, >1B6M_1|Chains... at 95%
1b6p
RCSB PDB
PDBbind
99aa, >1B6P_1|Chains... at 95%
1cpi
RCSB PDB
PDBbind
99aa, >1CPI_1|Chains... at 93%
1d4k
RCSB PDB
PDBbind
99aa, >1D4K_1|Chains... at 95%
1d4l
RCSB PDB
PDBbind
99aa, >1D4L_1|Chains... at 95%
1kzk
RCSB PDB
PDBbind
99aa, >1KZK_1|Chains... at 92%
1mtr
RCSB PDB
PDBbind
99aa, >1MTR_1|Chains... at 95%
1sdt
RCSB PDB
PDBbind
99aa, >1SDT_1|Chains... at 91%
1sdu
RCSB PDB
PDBbind
99aa, >1SDU_1|Chains... at 90%
1sdv
RCSB PDB
PDBbind
99aa, >1SDV_1|Chains... at 90%
1z1h
RCSB PDB
PDBbind
99aa, >1Z1H_1|Chains... at 95%
1z1r
RCSB PDB
PDBbind
99aa, >1Z1R_1|Chains... at 95%
2aoc
RCSB PDB
PDBbind
99aa, >2AOC_1|Chains... at 90%
2aod
RCSB PDB
PDBbind
99aa, >2AOD_1|Chains... at 91%
2aoe
RCSB PDB
PDBbind
99aa, >2AOE_1|Chains... at 90%
2aog
RCSB PDB
PDBbind
99aa, >2AOG_1|Chains... at 90%
2aoh
RCSB PDB
PDBbind
99aa, >2AOH_1|Chains... at 90%
2avm
RCSB PDB
PDBbind
99aa, >2AVM_1|Chains... at 90%
2avo
RCSB PDB
PDBbind
99aa, >2AVO_1|Chains... at 90%
2avq
RCSB PDB
PDBbind
99aa, >2AVQ_1|Chains... at 90%
2avs
RCSB PDB
PDBbind
99aa, >2AVS_1|Chains... at 90%
2avv
RCSB PDB
PDBbind
99aa, >2AVV_1|Chains... at 90%
2f3k
RCSB PDB
PDBbind
99aa, >2F3K_1|Chains... at 91%
2f80
RCSB PDB
PDBbind
99aa, >2F80_1|Chains... at 90%
2f81
RCSB PDB
PDBbind
99aa, >2F81_1|Chains... at 90%
2f8g
RCSB PDB
PDBbind
99aa, >2F8G_1|Chains... at 90%
2fgu
RCSB PDB
PDBbind
99aa, >2FGU_1|Chains... at 91%
2hb3
RCSB PDB
PDBbind
99aa, >2HB3_1|Chains... at 91%
2hs1
RCSB PDB
PDBbind
99aa, >2HS1_1|Chains... at 90%
2hs2
RCSB PDB
PDBbind
99aa, >2HS2_1|Chains... at 92%
2i0a
RCSB PDB
PDBbind
99aa, >2I0A_1|Chains... at 91%
2i0d
RCSB PDB
PDBbind
99aa, >2I0D_1|Chains... at 91%
2idw
RCSB PDB
PDBbind
99aa, >2IDW_1|Chains... at 90%
2ien
RCSB PDB
PDBbind
99aa, >2IEN_1|Chains... at 91%
2ieo
RCSB PDB
PDBbind
99aa, >2IEO_1|Chains... at 90%
2nmy
RCSB PDB
PDBbind
99aa, >2NMY_1|Chains... at 90%
2nmz
RCSB PDB
PDBbind
99aa, >2NMZ_1|Chains... at 90%
2nnk
RCSB PDB
PDBbind
99aa, >2NNK_1|Chains... at 90%
2nnp
RCSB PDB
PDBbind
99aa, >2NNP_1|Chains... at 90%
2nxd
RCSB PDB
PDBbind
99aa, >2NXD_1|Chains... at 90%
2nxl
RCSB PDB
PDBbind
99aa, >2NXL_1|Chains... at 90%
2nxm
RCSB PDB
PDBbind
99aa, >2NXM_1|Chains... at 90%
2psu
RCSB PDB
PDBbind
99aa, >2PSU_1|Chains... at 91%
2psv
RCSB PDB
PDBbind
99aa, >2PSV_1|Chains... at 91%
2q54
RCSB PDB
PDBbind
99aa, >2Q54_1|Chains... at 91%
2q55
RCSB PDB
PDBbind
99aa, >2Q55_1|Chains... at 91%
2q5k
RCSB PDB
PDBbind
99aa, >2Q5K_1|Chains... at 91%
2qci
RCSB PDB
PDBbind
99aa, >2QCI_1|Chains... at 90%
2qd6
RCSB PDB
PDBbind
99aa, >2QD6_1|Chains... at 90%
2qd7
RCSB PDB
PDBbind
99aa, >2QD7_1|Chains... at 90%
2qd8
RCSB PDB
PDBbind
99aa, >2QD8_1|Chains... at 90%
2qhy
RCSB PDB
PDBbind
99aa, >2QHY_1|Chains... at 91%
2qhz
RCSB PDB
PDBbind
99aa, >2QHZ_1|Chains... at 91%
2qi0
RCSB PDB
PDBbind
99aa, >2QI0_1|Chains... at 91%
2qi1
RCSB PDB
PDBbind
99aa, >2QI1_1|Chains... at 91%
2qi3
RCSB PDB
PDBbind
99aa, >2QI3_1|Chains... at 91%
2qi4
RCSB PDB
PDBbind
99aa, >2QI4_1|Chains... at 91%
2qi5
RCSB PDB
PDBbind
99aa, >2QI5_1|Chains... at 91%
2qi6
RCSB PDB
PDBbind
99aa, >2QI6_1|Chains... at 91%
2qi7
RCSB PDB
PDBbind
99aa, >2QI7_1|Chains... at 91%
2z4o
RCSB PDB
PDBbind
99aa, >2Z4O_1|Chains... at 91%
3a2o
RCSB PDB
PDBbind
99aa, >3A2O_1|Chains... at 91%
3aid
RCSB PDB
PDBbind
99aa, >3AID_1|Chains... at 92%
3bva
RCSB PDB
PDBbind
99aa, >3BVA_1|Chains... at 90%
3bvb
RCSB PDB
PDBbind
99aa, >3BVB_1|Chains... at 90%
3bxs
RCSB PDB
PDBbind
99aa, >3BXS_1|Chains... at 95%
3cyw
RCSB PDB
PDBbind
99aa, >3CYW_1|Chains... at 90%
3cyx
RCSB PDB
PDBbind
99aa, >3CYX_1|Chains... at 90%
3d1x
RCSB PDB
PDBbind
99aa, >3D1X_1|Chains... at 90%
3d1y
RCSB PDB
PDBbind
99aa, >3D1Y_1|Chains... at 90%
3d1z
RCSB PDB
PDBbind
99aa, >3D1Z_1|Chains... at 90%
3d20
RCSB PDB
PDBbind
99aa, >3D20_1|Chains... at 90%
3dcr
RCSB PDB
PDBbind
99aa, >3DCR_1|Chains... at 98%
3djk
RCSB PDB
PDBbind
99aa, >3DJK_1|Chains... at 91%
3dk1
RCSB PDB
PDBbind
99aa, >3DK1_1|Chains... at 91%
3ekv
RCSB PDB
PDBbind
99aa, >3EKV_1|Chains... at 91%
3ekx
RCSB PDB
PDBbind
99aa, >3EKX_1|Chains... at 91%
3eky
RCSB PDB
PDBbind
99aa, >3EKY_1|Chains... at 91%
3el1
RCSB PDB
PDBbind
99aa, >3EL1_1|Chains... at 92%
3el9
RCSB PDB
PDBbind
99aa, >3EL9_1|Chains... at 90%
3fsm
RCSB PDB
PDBbind
203aa, >3FSM_1|Chain... *
3gi4
RCSB PDB
PDBbind
99aa, >3GI4_1|Chains... at 91%
3gi5
RCSB PDB
PDBbind
99aa, >3GI5_1|Chains... at 91%
3gi6
RCSB PDB
PDBbind
99aa, >3GI6_1|Chains... at 91%
3h5b
RCSB PDB
PDBbind
99aa, >3H5B_1|Chains... at 91%
3hau
RCSB PDB
PDBbind
99aa, >3HAU_1|Chains... at 98%
3haw
RCSB PDB
PDBbind
99aa, >3HAW_1|Chains... at 100%
3hbo
RCSB PDB
PDBbind
99aa, >3HBO_1|Chains... at 100%
3hdk
RCSB PDB
PDBbind
99aa, >3HDK_1|Chains... at 100%
3hlo
RCSB PDB
PDBbind
203aa, >3HLO_1|Chain... at 99%
3i6o
RCSB PDB
PDBbind
99aa, >3I6O_1|Chains... at 91%
3i7e
RCSB PDB
PDBbind
99aa, >3I7E_1|Chains... at 92%
3iaw
RCSB PDB
PDBbind
203aa, >3IAW_1|Chain... at 99%
3ka2
RCSB PDB
PDBbind
203aa, >3KA2_1|Chain... at 99%
3lzv
RCSB PDB
PDBbind
99aa, >3LZV_1|Chains... at 90%
3mxd
RCSB PDB
PDBbind
99aa, >3MXD_1|Chains... at 91%
3mxe
RCSB PDB
PDBbind
99aa, >3MXE_1|Chains... at 91%
3nu3
RCSB PDB
PDBbind
99aa, >3NU3_1|Chains... at 91%
3nu4
RCSB PDB
PDBbind
99aa, >3NU4_1|Chains... at 90%
3nu5
RCSB PDB
PDBbind
99aa, >3NU5_1|Chains... at 90%
3nu6
RCSB PDB
PDBbind
99aa, >3NU6_1|Chains... at 90%
3nu9
RCSB PDB
PDBbind
99aa, >3NU9_1|Chains... at 90%
3nuj
RCSB PDB
PDBbind
99aa, >3NUJ_1|Chains... at 90%
3nuo
RCSB PDB
PDBbind
99aa, >3NUO_1|Chains... at 90%
3o99
RCSB PDB
PDBbind
99aa, >3O99_1|Chains... at 91%
3o9a
RCSB PDB
PDBbind
99aa, >3O9A_1|Chains... at 91%
3o9b
RCSB PDB
PDBbind
99aa, >3O9B_1|Chains... at 91%
3o9c
RCSB PDB
PDBbind
99aa, >3O9C_1|Chains... at 91%
3o9d
RCSB PDB
PDBbind
99aa, >3O9D_1|Chains... at 91%
3o9e
RCSB PDB
PDBbind
99aa, >3O9E_1|Chains... at 91%
3o9f
RCSB PDB
PDBbind
99aa, >3O9F_1|Chains... at 91%
3o9g
RCSB PDB
PDBbind
99aa, >3O9G_1|Chains... at 91%
3o9h
RCSB PDB
PDBbind
99aa, >3O9H_1|Chains... at 91%
3o9i
RCSB PDB
PDBbind
99aa, >3O9I_1|Chains... at 91%
3ok9
RCSB PDB
PDBbind
99aa, >3OK9_1|Chains... at 91%
3oxc
RCSB PDB
PDBbind
99aa, >3OXC_1|Chains... at 91%
3pwm
RCSB PDB
PDBbind
99aa, >3PWM_1|Chains... at 90%
3qaa
RCSB PDB
PDBbind
99aa, >3QAA_1|Chains... at 91%
3st5
RCSB PDB
PDBbind
99aa, >3ST5_1|Chains... at 91%
3vf5
RCSB PDB
PDBbind
99aa, >3VF5_1|Chains... at 90%
3vf7
RCSB PDB
PDBbind
99aa, >3VF7_1|Chains... at 90%
3vfa
RCSB PDB
PDBbind
99aa, >3VFA_1|Chains... at 90%
3vfb
RCSB PDB
PDBbind
99aa, >3VFB_1|Chains... at 90%
4dfg
RCSB PDB
PDBbind
99aa, >4DFG_1|Chains... at 91%
4djo
RCSB PDB
PDBbind
99aa, >4DJO_1|Chains... at 91%
4djp
RCSB PDB
PDBbind
99aa, >4DJP_1|Chains... at 91%
4djq
RCSB PDB
PDBbind
99aa, >4DJQ_1|Chains... at 91%
4djr
RCSB PDB
PDBbind
99aa, >4DJR_1|Chains... at 91%
4ej8
RCSB PDB
PDBbind
99aa, >4EJ8_1|Chains... at 92%
4ejl
RCSB PDB
PDBbind
99aa, >4EJL_1|Chains... at 92%
4ep2
RCSB PDB
PDBbind
203aa, >4EP2_1|Chain... at 90%
4hdb
RCSB PDB
PDBbind
99aa, >4HDB_1|Chains... at 90%
4hdf
RCSB PDB
PDBbind
99aa, >4HDF_1|Chains... at 90%
4hdp
RCSB PDB
PDBbind
99aa, >4HDP_1|Chains... at 90%
4he9
RCSB PDB
PDBbind
99aa, >4HE9_1|Chains... at 90%
4heg
RCSB PDB
PDBbind
99aa, >4HEG_1|Chains... at 90%
4kb9
RCSB PDB
PDBbind
99aa, >4KB9_1|Chains... at 91%
4q1w
RCSB PDB
PDBbind
99aa, >4Q1W_1|Chains... at 90%
4q1x
RCSB PDB
PDBbind
99aa, >4Q1X_1|Chains... at 90%
4q1y
RCSB PDB
PDBbind
99aa, >4Q1Y_1|Chains... at 90%
4u8w
RCSB PDB
PDBbind
99aa, >4U8W_1|Chains... at 91%
4zip
RCSB PDB
PDBbind
99aa, >4ZIP_1|Chains... at 91%
4zls
RCSB PDB
PDBbind
99aa, >4ZLS_1|Chains... at 91%
5bry
RCSB PDB
PDBbind
99aa, >5BRY_1|Chains... at 91%
5bs4
RCSB PDB
PDBbind
99aa, >5BS4_1|Chains... at 91%
5dgu
RCSB PDB
PDBbind
99aa, >5DGU_1|Chains... at 91%
5dgw
RCSB PDB
PDBbind
99aa, >5DGW_1|Chains... at 91%
5jfp
RCSB PDB
PDBbind
99aa, >5JFP_1|Chains... at 91%
5jfu
RCSB PDB
PDBbind
99aa, >5JFU_1|Chains... at 91%
5jg1
RCSB PDB
PDBbind
99aa, >5JG1_1|Chains... at 91%
5ult
RCSB PDB
PDBbind
99aa, >5ULT_1|Chains... at 91%
5uov
RCSB PDB
PDBbind
99aa, >5UOV_1|Chains... at 91%
5upz
RCSB PDB
PDBbind
99aa, >5UPZ_1|Chains... at 91%
5wlo
RCSB PDB
PDBbind
99aa, >5WLO_1|Chains... at 91%
6b4n
RCSB PDB
PDBbind
99aa, >6B4N_1|Chains... at 91%
6c8x
RCSB PDB
PDBbind
99aa, >6C8X_1|Chains... at 91%
6cdj
RCSB PDB
PDBbind
99aa, >6CDJ_1|Chains... at 91%
6cdl
RCSB PDB
PDBbind
99aa, >6CDL_1|Chains... at 91%
6dif
RCSB PDB
PDBbind
99aa, >6DIF_1|Chains... at 91%
6dil
RCSB PDB
PDBbind
99aa, >6DIL_1|Chains... at 90%
6dj1
RCSB PDB
PDBbind
99aa, >6DJ1_1|Chains... at 91%
6dj2
RCSB PDB
PDBbind
99aa, >6DJ2_1|Chains... at 90%
6dj5
RCSB PDB
PDBbind
99aa, >6DJ5_1|Chains... at 90%
6dj7
RCSB PDB
PDBbind
99aa, >6DJ7_1|Chains... at 90%
6e7j
RCSB PDB
PDBbind
99aa, >6E7J_1|Chains... at 91%
6e9a
RCSB PDB
PDBbind
99aa, >6E9A_1|Chains... at 91%
7hvp
RCSB PDB
PDBbind
99aa, >7HVP_1|Chains... at 93%
8hvp
RCSB PDB
PDBbind
99aa, >8HVP_1|Chains... at 93%
6o48
RCSB PDB
PDBbind
99aa, >6O48_1|Chains... at 91%
6ixd
RCSB PDB
PDBbind
99aa, >6IXD_1|Chains... at 91%
6u7o
RCSB PDB
PDBbind
99aa, >6U7O_1|Chains... at 91%
6u7p
RCSB PDB
PDBbind
99aa, >6U7P_1|Chains... at 91%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1apv
RCSB PDB
PDBbind
5-mer
1apw
RCSB PDB
PDBbind
5-mer
1b6j
RCSB PDB
PDBbind
5-mer
1bhf
RCSB PDB
PDBbind
5-mer
1cpi
RCSB PDB
PDBbind
5-mer
1f1j
RCSB PDB
PDBbind
5-mer
1f9e
RCSB PDB
PDBbind
5-mer
1fch
RCSB PDB
PDBbind
5-mer
1fiv
RCSB PDB
PDBbind
5-mer
1fyr
RCSB PDB
PDBbind
5-mer
1gny
RCSB PDB
PDBbind
5-mer
1gu3
RCSB PDB
PDBbind
5-mer
1h5v
RCSB PDB
PDBbind
5-mer
1h9l
RCSB PDB
PDBbind
5-mer
1hef
RCSB PDB
PDBbind
5-mer
1iau
RCSB PDB
PDBbind
5-mer
1jq8
RCSB PDB
PDBbind
5-mer
1jq9
RCSB PDB
PDBbind
5-mer
1k9q
RCSB PDB
PDBbind
5-mer
1m7i
RCSB PDB
PDBbind
5-mer
1mf4
RCSB PDB
PDBbind
5-mer
1mhw
RCSB PDB
PDBbind
5-mer
1nh0
RCSB PDB
PDBbind
5-mer
1ny2
RCSB PDB
PDBbind
5-mer
1o9d
RCSB PDB
PDBbind
5-mer
1p02
RCSB PDB
PDBbind
5-mer
1p03
RCSB PDB
PDBbind
5-mer
1p04
RCSB PDB
PDBbind
5-mer
1p05
RCSB PDB
PDBbind
5-mer
1p06
RCSB PDB
PDBbind
5-mer
1p10
RCSB PDB
PDBbind
5-mer
1pau
RCSB PDB
PDBbind
5-mer
1qm5
RCSB PDB
PDBbind
5-mer
1qtn
RCSB PDB
PDBbind
5-mer
1shd
RCSB PDB
PDBbind
5-mer
1t37
RCSB PDB
PDBbind
5-mer
1tmb
RCSB PDB
PDBbind
5-mer
1w9u
RCSB PDB
PDBbind
5-mer
1w9v
RCSB PDB
PDBbind
5-mer
1waw
RCSB PDB
PDBbind
5-mer
1wb0
RCSB PDB
PDBbind
5-mer
1ym4
RCSB PDB
PDBbind
5-mer
1zm6
RCSB PDB
PDBbind
5-mer
2bcd
RCSB PDB
PDBbind
5-mer
2ce9
RCSB PDB
PDBbind
5-mer
2fgu
RCSB PDB
PDBbind
5-mer
2h5d
RCSB PDB
PDBbind
5-mer
2h5i
RCSB PDB
PDBbind
5-mer
2h5j
RCSB PDB
PDBbind
5-mer
2j9a
RCSB PDB
PDBbind
5-mer
2k1q
RCSB PDB
PDBbind
5-mer
2l6j
RCSB PDB
PDBbind
5-mer
2lpr
RCSB PDB
PDBbind
5-mer
2m0u
RCSB PDB
PDBbind
5-mer
2m0v
RCSB PDB
PDBbind
5-mer
2pcu
RCSB PDB
PDBbind
5-mer
2ql5
RCSB PDB
PDBbind
5-mer
2ql7
RCSB PDB
PDBbind
5-mer
2ql9
RCSB PDB
PDBbind
5-mer
2qlb
RCSB PDB
PDBbind
5-mer
2qlf
RCSB PDB
PDBbind
5-mer
2qlj
RCSB PDB
PDBbind
5-mer
3atw
RCSB PDB
PDBbind
5-mer
3ayc
RCSB PDB
PDBbind
5-mer
3c88
RCSB PDB
PDBbind
5-mer
3c89
RCSB PDB
PDBbind
5-mer
3c8a
RCSB PDB
PDBbind
5-mer
3c8b
RCSB PDB
PDBbind
5-mer
3chf
RCSB PDB
PDBbind
5-mer
3e7a
RCSB PDB
PDBbind
5-mer
3gjq
RCSB PDB
PDBbind
5-mer
3gjs
RCSB PDB
PDBbind
5-mer
3gjt
RCSB PDB
PDBbind
5-mer
3ibc
RCSB PDB
PDBbind
5-mer
3iqg
RCSB PDB
PDBbind
5-mer
3iqh
RCSB PDB
PDBbind
5-mer
3iqi
RCSB PDB
PDBbind
5-mer
3jzh
RCSB PDB
PDBbind
5-mer
3k05
RCSB PDB
PDBbind
5-mer
3k0h
RCSB PDB
PDBbind
5-mer
3k15
RCSB PDB
PDBbind
5-mer
3lpr
RCSB PDB
PDBbind
5-mer
3mp1
RCSB PDB
PDBbind
5-mer
3nin
RCSB PDB
PDBbind
5-mer
3nzw
RCSB PDB
PDBbind
5-mer
3nzx
RCSB PDB
PDBbind
5-mer
3ov1
RCSB PDB
PDBbind
5-mer
3ove
RCSB PDB
PDBbind
5-mer
3oyp
RCSB PDB
PDBbind
5-mer
3qw5
RCSB PDB
PDBbind
5-mer
3qw6
RCSB PDB
PDBbind
5-mer
3qw7
RCSB PDB
PDBbind
5-mer
3qw8
RCSB PDB
PDBbind
5-mer
3r7b
RCSB PDB
PDBbind
5-mer
3r7n
RCSB PDB
PDBbind
5-mer
3s8l
RCSB PDB
PDBbind
5-mer
3s8n
RCSB PDB
PDBbind
5-mer
3s8o
RCSB PDB
PDBbind
5-mer
3sxu
RCSB PDB
PDBbind
5-mer
3t6b
RCSB PDB
PDBbind
5-mer
3t6j
RCSB PDB
PDBbind
5-mer
3th0
RCSB PDB
PDBbind
5-mer
3u1i
RCSB PDB
PDBbind
5-mer
3u4w
RCSB PDB
PDBbind
5-mer
3vb4
RCSB PDB
PDBbind
5-mer
3vb5
RCSB PDB
PDBbind
5-mer
3vb7
RCSB PDB
PDBbind
5-mer
3wqv
RCSB PDB
PDBbind
5-mer
4czs
RCSB PDB
PDBbind
5-mer
4d8i
RCSB PDB
PDBbind
5-mer
4dkt
RCSB PDB
PDBbind
5-mer
4est
RCSB PDB
PDBbind
5-mer
4gm3
RCSB PDB
PDBbind
5-mer
4gm8
RCSB PDB
PDBbind
5-mer
4i9c
RCSB PDB
PDBbind
5-mer
4j78
RCSB PDB
PDBbind
5-mer
4j81
RCSB PDB
PDBbind
5-mer
4j82
RCSB PDB
PDBbind
5-mer
4j84
RCSB PDB
PDBbind
5-mer
4k3m
RCSB PDB
PDBbind
5-mer
4kvm
RCSB PDB
PDBbind
5-mer
4l6t
RCSB PDB
PDBbind
5-mer
4lte
RCSB PDB
PDBbind
5-mer
4omc
RCSB PDB
PDBbind
5-mer
4omd
RCSB PDB
PDBbind
5-mer
4pry
RCSB PDB
PDBbind
5-mer
4ps0
RCSB PDB
PDBbind
5-mer
4ps1
RCSB PDB
PDBbind
5-mer
4q6f
RCSB PDB
PDBbind
5-mer
4rcp
RCSB PDB
PDBbind
5-mer
4rsp
RCSB PDB
PDBbind
5-mer
4ryd
RCSB PDB
PDBbind
5-mer
4sga
RCSB PDB
PDBbind
5-mer
4whh
RCSB PDB
PDBbind
5-mer
4whl
RCSB PDB
PDBbind
5-mer
4wvs
RCSB PDB
PDBbind
5-mer
4wvu
RCSB PDB
PDBbind
5-mer
4x13
RCSB PDB
PDBbind
5-mer
4x9w
RCSB PDB
PDBbind
5-mer
4yec
RCSB PDB
PDBbind
5-mer
4yv8
RCSB PDB
PDBbind
5-mer
4z5w
RCSB PDB
PDBbind
5-mer
4z7q
RCSB PDB
PDBbind
5-mer
4zro
RCSB PDB
PDBbind
5-mer
5axi
RCSB PDB
PDBbind
5-mer
5bmm
RCSB PDB
PDBbind
5-mer
5btr
RCSB PDB
PDBbind
5-mer
5e3a
RCSB PDB
PDBbind
5-mer
5e8f
RCSB PDB
PDBbind
5-mer
5eld
RCSB PDB
PDBbind
5-mer
5ele
RCSB PDB
PDBbind
5-mer
5elf
RCSB PDB
PDBbind
5-mer
5f5b
RCSB PDB
PDBbind
5-mer
5h7h
RCSB PDB
PDBbind
5-mer
5icv
RCSB PDB
PDBbind
5-mer
5jr6
RCSB PDB
PDBbind
5-mer
5lpr
RCSB PDB
PDBbind
5-mer
5n99
RCSB PDB
PDBbind
5-mer
5nwi
RCSB PDB
PDBbind
5-mer
5nwk
RCSB PDB
PDBbind
5-mer
5ttw
RCSB PDB
PDBbind
5-mer
5x54
RCSB PDB
PDBbind
5-mer
5yc1
RCSB PDB
PDBbind
5-mer
5zob
RCSB PDB
PDBbind
5-mer
6ax4
RCSB PDB
PDBbind
5-mer
6b5q
RCSB PDB
PDBbind
5-mer
6eqv
RCSB PDB
PDBbind
5-mer
6eqw
RCSB PDB
PDBbind
5-mer
6lpr
RCSB PDB
PDBbind
5-mer
6mub
RCSB PDB
PDBbind
5-mer
7lpr
RCSB PDB
PDBbind
5-mer
8lpr
RCSB PDB
PDBbind
5-mer
9lpr
RCSB PDB
PDBbind
5-mer
6hzb
RCSB PDB
PDBbind
5-mer
6hza
RCSB PDB
PDBbind
5-mer
6hv2
RCSB PDB
PDBbind
5-mer
6dn6
RCSB PDB
PDBbind
5-mer
Entry Information
PDB ID
2fgv
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
HIV-1 protease T80N
Ligand Name
5-mer
EC.Number
E.C.3.4.23.16
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
Kd=760nM
Release Year
2006
Protein/NA Sequence
Check fasta file
Primary Reference
J.Virol. v80 pp. 6906-16, 2006
Ligand Properties
Formula
C
3
8
H
5
1
N
6
O
5
Molecular Weight
671.849
Exact Mass
671.392
No. of atoms
100
No. of bonds
104
Polar Surface Area
167.95
LOGP Value
4.24 (
Computed with XLOGP3
)
5.12 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 17
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 5
Canonical SMILES
NC(=O)C[C@@H](C(=O)N[C@H]([C@@H](C[N@@H+]1C[C@H]2CCCC[C@H]2C[C@H]1C(=O)NC(C)(C)C)O)Cc1ccccc1)NC(=O)c1ccc2c(n1)cccc2
InChI String
InChI=1S/C38H50N6O5/c1-38(2,3)43-37(49)32-20-26-14-7-8-15-27(26)22-44(32)23-33(45)30(19-24-11-5-4-6-12-24)41-36(48)31(21-34(39)46)42-35(47)29-18-17-25-13-9-10-16-28(25)40-29/h4-6,9-13,16-18,26-27,30-33,45H,7-8,14-15,19-23H2,1-3H3,(H2,39,46)(H,41,48)(H,42,47)(H,43,49)/p+1/t26-,27+,30-,31-,32-,33+/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):
P03369
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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