Browse entries in the PDBbind-CN Database
HEADER 2W9H_COMPLEX COMPND 2W9H_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 158 THR LEU SER ILE LEU VAL ALA HIS ASP LEU GLN ARG VAL SEQRES 2 A 158 ILE GLY PHE GLU ASN GLN LEU PRO TRP HIS LEU PRO ASN SEQRES 3 A 158 ASP LEU LYS HIS VAL LYS LYS LEU SER THR GLY HIS THR SEQRES 4 A 158 LEU VAL MET GLY ARG LYS THR PHE GLU SER ILE GLY LYS SEQRES 5 A 158 PRO LEU PRO ASN ARG ARG ASN VAL VAL LEU THR SER ASP SEQRES 6 A 158 THR SER PHE ASN VAL GLU GLY VAL ASP VAL ILE HIS SER SEQRES 7 A 158 ILE GLU ASP ILE TYR GLN LEU PRO GLY HIS VAL PHE ILE SEQRES 8 A 158 PHE GLY GLY GLN THR LEU PHE GLU GLU MET ILE ASP LYS SEQRES 9 A 158 VAL ASP ASP MET TYR ILE THR VAL ILE GLU GLY LYS PHE SEQRES 10 A 158 ARG GLY ASP THR PHE PHE PRO PRO TYR THR PHE GLU ASP SEQRES 11 A 158 TRP GLU VAL ALA SER SER VAL GLU GLY LYS LEU ASP GLU SEQRES 12 A 158 LYS ASN THR ILE PRO HIS THR PHE LEU HIS LEU ILE ARG SEQRES 13 A 158 LYS LYS HET TOP A 251 39 ATOM 1 N THR A 1 14.064 4.225 -1.888 1.00 20.92 N ATOM 2 CA THR A 1 13.074 4.836 -0.963 1.00 19.67 C ATOM 3 C THR A 1 13.456 4.456 0.462 1.00 17.65 C ATOM 4 O THR A 1 13.825 3.316 0.722 1.00 18.98 O ATOM 5 CB THR A 1 11.643 4.347 -1.274 1.00 21.10 C ATOM 6 OG1 THR A 1 11.282 4.752 -2.601 1.00 23.97 O ATOM 7 CG2 THR A 1 10.642 4.922 -0.280 1.00 21.23 C ATOM 8 HA THR A 1 13.085 5.919 -1.087 1.00 0.00 H ATOM 9 HB THR A 1 11.623 3.260 -1.194 1.00 0.00 H ATOM 10 HG1 THR A 1 10.365 4.439 -2.802 1.00 0.00 H ATOM 11 HG23 THR A 1 10.916 4.614 0.729 1.00 0.00 H ATOM 12 HG21 THR A 1 10.652 6.010 -0.345 1.00 0.00 H ATOM 13 HG22 THR A 1 9.644 4.552 -0.516 1.00 0.00 H ATOM 14 HN3 THR A 1 14.048 3.191 -1.777 1.00 0.00 H ATOM 15 HN2 THR A 1 15.014 4.585 -1.664 1.00 0.00 H ATOM 16 HN1 THR A 1 13.820 4.473 -2.868 1.00 0.00 H ATOM 17 N LEU A 2 13.386 5.428 1.368 1.00 15.10 N ATOM 18 CA LEU A 2 13.692 5.197 2.771 1.00 14.12 C ATOM 19 C LEU A 2 12.433 5.430 3.593 1.00 11.58 C ATOM 20 O LEU A 2 11.849 6.515 3.556 1.00 12.06 O ATOM 21 CB LEU A 2 14.792 6.155 3.232 1.00 14.66 C ATOM 22 CG LEU A 2 15.379 5.960 4.624 1.00 17.50 C ATOM 23 CD1 LEU A 2 16.055 4.602 4.751 1.00 17.99 C ATOM 24 CD2 LEU A 2 16.374 7.084 4.905 1.00 17.73 C ATOM 25 HA LEU A 2 14.040 4.173 2.905 1.00 0.00 H ATOM 26 HB2 LEU A 2 15.613 6.071 2.520 1.00 0.00 H ATOM 27 HB3 LEU A 2 14.380 7.163 3.193 1.00 0.00 H ATOM 28 HG LEU A 2 14.573 5.992 5.357 1.00 0.00 H ATOM 29 HD21 LEU A 2 17.171 7.056 4.162 1.00 0.00 H ATOM 30 HD22 LEU A 2 15.860 8.044 4.853 1.00 0.00 H ATOM 31 HD23 LEU A 2 16.799 6.951 5.900 1.00 0.00 H ATOM 32 HD11 LEU A 2 15.324 3.815 4.568 1.00 0.00 H ATOM 33 HD12 LEU A 2 16.860 4.529 4.020 1.00 0.00 H ATOM 34 HD13 LEU A 2 16.464 4.494 5.756 1.00 0.00 H ATOM 35 H LEU A 2 13.104 6.382 1.064 1.00 0.00 H ATOM 36 N SER A 3 12.014 4.405 4.330 1.00 8.98 N ATOM 37 CA SER A 3 10.744 4.448 5.052 1.00 8.43 C ATOM 38 C SER A 3 10.968 4.078 6.508 1.00 9.10 C ATOM 39 O SER A 3 11.798 3.225 6.795 1.00 10.97 O ATOM 40 CB SER A 3 9.770 3.421 4.463 1.00 9.45 C ATOM 41 OG SER A 3 9.581 3.611 3.076 1.00 11.31 O ATOM 42 HA SER A 3 10.337 5.455 4.966 1.00 0.00 H ATOM 43 HB2 SER A 3 8.808 3.517 4.967 1.00 0.00 H ATOM 44 HB3 SER A 3 10.168 2.420 4.631 1.00 0.00 H ATOM 45 HG SER A 3 9.213 4.516 2.915 1.00 0.00 H ATOM 46 H SER A 3 12.605 3.552 4.394 1.00 0.00 H ATOM 47 N ILE A 4 10.213 4.690 7.415 1.00 8.18 N ATOM 48 CA ILE A 4 10.061 4.142 8.758 1.00 7.53 C ATOM 49 C ILE A 4 8.979 3.055 8.769 1.00 7.51 C ATOM 50 O ILE A 4 7.961 3.168 8.081 1.00 8.26 O ATOM 51 CB ILE A 4 9.767 5.256 9.801 1.00 7.41 C ATOM 52 CG1 ILE A 4 11.098 5.804 10.333 1.00 9.39 C ATOM 53 CG2 ILE A 4 8.889 4.747 10.956 1.00 9.39 C ATOM 54 CD1 ILE A 4 10.989 7.051 11.173 1.00 9.68 C ATOM 55 HA ILE A 4 11.006 3.683 9.048 1.00 0.00 H ATOM 56 HB ILE A 4 9.208 6.052 9.309 1.00 0.00 H ATOM 57 HG12 ILE A 4 11.564 5.028 10.940 1.00 0.00 H ATOM 58 HG13 ILE A 4 11.737 6.028 9.478 1.00 0.00 H ATOM 59 HD11 ILE A 4 10.539 7.848 10.581 1.00 0.00 H ATOM 60 HD12 ILE A 4 10.366 6.847 12.044 1.00 0.00 H ATOM 61 HD13 ILE A 4 11.983 7.356 11.499 1.00 0.00 H ATOM 62 HG21 ILE A 4 7.938 4.392 10.559 1.00 0.00 H ATOM 63 HG22 ILE A 4 9.399 3.929 11.465 1.00 0.00 H ATOM 64 HG23 ILE A 4 8.710 5.560 11.660 1.00 0.00 H ATOM 65 H ILE A 4 9.724 5.572 7.163 1.00 0.00 H ATOM 66 N LEU A 5 9.225 2.008 9.547 1.00 7.22 N ATOM 67 CA LEU A 5 8.238 0.965 9.797 1.00 6.93 C ATOM 68 C LEU A 5 8.167 0.806 11.311 1.00 6.96 C ATOM 69 O LEU A 5 9.180 0.498 11.939 1.00 8.01 O ATOM 70 CB LEU A 5 8.718 -0.337 9.145 1.00 8.16 C ATOM 71 CG LEU A 5 7.867 -1.599 9.255 1.00 7.66 C ATOM 72 CD1 LEU A 5 6.442 -1.324 8.812 1.00 9.97 C ATOM 73 CD2 LEU A 5 8.508 -2.678 8.379 1.00 10.13 C ATOM 74 HA LEU A 5 7.259 1.212 9.386 1.00 0.00 H ATOM 75 HB2 LEU A 5 8.842 -0.131 8.082 1.00 0.00 H ATOM 76 HB3 LEU A 5 9.688 -0.571 9.584 1.00 0.00 H ATOM 77 HG LEU A 5 7.826 -1.935 10.291 1.00 0.00 H ATOM 78 HD21 LEU A 5 8.540 -2.333 7.345 1.00 0.00 H ATOM 79 HD22 LEU A 5 9.521 -2.874 8.730 1.00 0.00 H ATOM 80 HD23 LEU A 5 7.917 -3.592 8.440 1.00 0.00 H ATOM 81 HD11 LEU A 5 6.009 -0.550 9.445 1.00 0.00 H ATOM 82 HD12 LEU A 5 6.444 -0.988 7.775 1.00 0.00 H ATOM 83 HD13 LEU A 5 5.853 -2.237 8.899 1.00 0.00 H ATOM 84 H LEU A 5 10.160 1.929 9.996 1.00 0.00 H ATOM 85 N VAL A 6 6.999 1.063 11.901 1.00 6.70 N ATOM 86 CA VAL A 6 6.869 1.079 13.361 1.00 6.45 C ATOM 87 C VAL A 6 5.448 0.720 13.786 1.00 6.44 C ATOM 88 O VAL A 6 4.482 1.041 13.080 1.00 6.16 O ATOM 89 CB VAL A 6 7.262 2.469 13.953 1.00 6.31 C ATOM 90 CG1 VAL A 6 6.324 3.566 13.461 1.00 7.42 C ATOM 91 CG2 VAL A 6 7.287 2.428 15.474 1.00 8.47 C ATOM 92 HA VAL A 6 7.556 0.330 13.754 1.00 0.00 H ATOM 93 HB VAL A 6 8.267 2.703 13.601 1.00 0.00 H ATOM 94 HG11 VAL A 6 6.374 3.625 12.374 1.00 0.00 H ATOM 95 HG12 VAL A 6 5.304 3.334 13.767 1.00 0.00 H ATOM 96 HG13 VAL A 6 6.626 4.521 13.892 1.00 0.00 H ATOM 97 HG21 VAL A 6 6.299 2.157 15.845 1.00 0.00 H ATOM 98 HG22 VAL A 6 8.016 1.688 15.804 1.00 0.00 H ATOM 99 HG23 VAL A 6 7.564 3.410 15.858 1.00 0.00 H ATOM 100 H VAL A 6 6.163 1.256 11.313 1.00 0.00 H ATOM 101 N ALA A 7 5.337 0.073 14.943 1.00 6.61 N ATOM 102 CA ALA A 7 4.058 -0.062 15.648 1.00 6.28 C ATOM 103 C ALA A 7 4.179 0.694 16.961 1.00 6.04 C ATOM 104 O ALA A 7 5.093 0.415 17.739 1.00 6.67 O ATOM 105 CB ALA A 7 3.772 -1.531 15.931 1.00 7.70 C ATOM 106 HA ALA A 7 3.245 0.337 15.042 1.00 0.00 H ATOM 107 HB1 ALA A 7 3.723 -2.078 14.990 1.00 0.00 H ATOM 108 HB2 ALA A 7 4.569 -1.942 16.551 1.00 0.00 H ATOM 109 HB3 ALA A 7 2.820 -1.620 16.455 1.00 0.00 H ATOM 110 H ALA A 7 6.188 -0.353 15.363 1.00 0.00 H ATOM 111 N HIS A 8 3.288 1.659 17.194 1.00 6.07 N ATOM 112 CA HIS A 8 3.299 2.402 18.459 1.00 6.71 C ATOM 113 C HIS A 8 1.884 2.583 18.987 1.00 6.21 C ATOM 114 O HIS A 8 0.921 2.554 18.211 1.00 7.55 O ATOM 115 CB HIS A 8 4.035 3.755 18.332 1.00 6.99 C ATOM 116 CG HIS A 8 3.290 4.821 17.575 1.00 6.67 C ATOM 117 ND1 HIS A 8 2.129 5.405 18.041 1.00 7.35 N ATOM 118 CD2 HIS A 8 3.599 5.474 16.426 1.00 7.99 C ATOM 119 CE1 HIS A 8 1.730 6.335 17.189 1.00 8.42 C ATOM 120 NE2 HIS A 8 2.609 6.403 16.204 1.00 9.07 N ATOM 121 HA HIS A 8 3.859 1.810 19.183 1.00 0.00 H ATOM 122 HB2 HIS A 8 4.230 4.129 19.337 1.00 0.00 H ATOM 123 HB3 HIS A 8 4.982 3.578 17.822 1.00 0.00 H ATOM 124 HD2 HIS A 8 4.470 5.295 15.796 1.00 0.00 H ATOM 125 HE1 HIS A 8 0.830 6.942 17.283 1.00 0.00 H ATOM 126 H HIS A 8 2.577 1.887 16.470 1.00 0.00 H ATOM 127 N ASP A 9 1.748 2.753 20.301 1.00 6.66 N ATOM 128 CA ASP A 9 0.417 2.918 20.879 1.00 6.47 C ATOM 129 C ASP A 9 -0.020 4.372 20.971 1.00 6.98 C ATOM 130 O ASP A 9 0.617 5.264 20.389 1.00 7.86 O ATOM 131 CB ASP A 9 0.248 2.151 22.193 1.00 7.42 C ATOM 132 CG ASP A 9 0.813 2.883 23.398 1.00 8.19 C ATOM 133 OD1 ASP A 9 1.350 4.004 23.255 1.00 8.21 O ATOM 134 OD2 ASP A 9 0.706 2.313 24.507 1.00 9.65 O ATOM 135 HA ASP A 9 -0.275 2.457 20.174 1.00 0.00 H ATOM 136 HB2 ASP A 9 -0.816 1.981 22.359 1.00 0.00 H ATOM 137 HB3 ASP A 9 0.758 1.192 22.101 1.00 0.00 H ATOM 138 H ASP A 9 2.588 2.768 20.914 1.00 0.00 H ATOM 139 N LEU A 10 -1.130 4.619 21.659 1.00 7.44 N ATOM 140 CA LEU A 10 -1.672 5.970 21.696 1.00 8.87 C ATOM 141 C LEU A 10 -0.771 6.983 22.392 1.00 9.19 C ATOM 142 O LEU A 10 -0.944 8.195 22.196 1.00 12.00 O ATOM 143 CB LEU A 10 -3.078 5.985 22.285 1.00 9.24 C ATOM 144 CG LEU A 10 -4.144 5.314 21.413 1.00 10.25 C ATOM 145 CD1 LEU A 10 -5.439 5.163 22.190 1.00 12.75 C ATOM 146 CD2 LEU A 10 -4.392 6.085 20.124 1.00 13.22 C ATOM 147 HA LEU A 10 -1.724 6.292 20.656 1.00 0.00 H ATOM 148 HB2 LEU A 10 -3.050 5.469 23.245 1.00 0.00 H ATOM 149 HB3 LEU A 10 -3.370 7.023 22.440 1.00 0.00 H ATOM 150 HG LEU A 10 -3.770 4.327 21.139 1.00 0.00 H ATOM 151 HD21 LEU A 10 -4.732 7.092 20.364 1.00 0.00 H ATOM 152 HD22 LEU A 10 -3.466 6.139 19.551 1.00 0.00 H ATOM 153 HD23 LEU A 10 -5.155 5.573 19.537 1.00 0.00 H ATOM 154 HD11 LEU A 10 -5.262 4.549 23.073 1.00 0.00 H ATOM 155 HD12 LEU A 10 -5.795 6.147 22.495 1.00 0.00 H ATOM 156 HD13 LEU A 10 -6.187 4.685 21.558 1.00 0.00 H ATOM 157 H LEU A 10 -1.610 3.850 22.169 1.00 0.00 H ATOM 158 N GLN A 11 0.165 6.502 23.209 1.00 8.26 N ATOM 159 CA GLN A 11 1.149 7.390 23.842 1.00 9.09 C ATOM 160 C GLN A 11 2.548 7.118 23.283 1.00 8.01 C ATOM 161 O GLN A 11 3.566 7.367 23.944 1.00 7.71 O ATOM 162 CB GLN A 11 1.130 7.257 25.374 1.00 10.20 C ATOM 163 CG GLN A 11 -0.175 7.717 26.041 1.00 12.04 C ATOM 164 CD GLN A 11 -0.306 9.237 26.145 1.00 16.14 C ATOM 165 OE1 GLN A 11 0.034 9.974 25.218 1.00 17.78 O ATOM 166 NE2 GLN A 11 -0.820 9.707 27.281 1.00 18.15 N ATOM 167 HA GLN A 11 0.875 8.418 23.605 1.00 0.00 H ATOM 168 HB2 GLN A 11 1.290 6.209 25.626 1.00 0.00 H ATOM 169 HB3 GLN A 11 1.947 7.855 25.777 1.00 0.00 H ATOM 170 HG2 GLN A 11 -1.013 7.338 25.457 1.00 0.00 H ATOM 171 HG3 GLN A 11 -0.215 7.298 27.046 1.00 0.00 H ATOM 172 HE22 GLN A 11 -1.094 9.050 28.039 1.00 0.00 H ATOM 173 HE21 GLN A 11 -0.947 10.731 27.410 1.00 0.00 H ATOM 174 H GLN A 11 0.200 5.481 23.402 1.00 0.00 H ATOM 175 N ARG A 12 2.578 6.605 22.055 1.00 7.23 N ATOM 176 CA ARG A 12 3.823 6.394 21.311 1.00 6.94 C ATOM 177 C ARG A 12 4.749 5.337 21.923 1.00 6.39 C ATOM 178 O ARG A 12 5.932 5.248 21.581 1.00 7.10 O ATOM 179 CB ARG A 12 4.558 7.712 21.038 1.00 7.45 C ATOM 180 CG ARG A 12 3.880 8.573 19.959 1.00 7.70 C ATOM 181 CD ARG A 12 4.528 9.960 19.860 1.00 9.18 C ATOM 182 NE ARG A 12 4.314 10.723 21.086 1.00 9.95 N ATOM 183 CZ ARG A 12 5.214 10.885 22.059 1.00 9.59 C ATOM 184 NH1 ARG A 12 6.446 10.387 21.955 1.00 9.36 N ATOM 185 NH2 ARG A 12 4.889 11.579 23.143 1.00 11.94 N ATOM 186 HA ARG A 12 3.515 5.981 20.351 1.00 0.00 H ATOM 187 HB2 ARG A 12 4.597 8.285 21.964 1.00 0.00 H ATOM 188 HB3 ARG A 12 5.572 7.482 20.711 1.00 0.00 H ATOM 189 HG2 ARG A 12 3.969 8.070 18.996 1.00 0.00 H ATOM 190 HG3 ARG A 12 2.826 8.691 20.210 1.00 0.00 H ATOM 191 HD2 ARG A 12 4.089 10.501 19.022 1.00 0.00 H ATOM 192 HD3 ARG A 12 5.599 9.843 19.694 1.00 0.00 H ATOM 193 HE ARG A 12 3.387 11.177 21.212 1.00 0.00 H ATOM 194 HH12 ARG A 12 7.130 10.526 22.726 1.00 0.00 H ATOM 195 HH11 ARG A 12 6.723 9.859 21.103 1.00 0.00 H ATOM 196 HH22 ARG A 12 5.585 11.709 23.905 1.00 0.00 H ATOM 197 HH21 ARG A 12 3.939 11.992 23.230 1.00 0.00 H ATOM 198 H ARG A 12 1.679 6.342 21.604 1.00 0.00 H ATOM 199 N VAL A 13 4.203 4.498 22.798 1.00 6.70 N ATOM 200 CA VAL A 13 4.970 3.366 23.326 1.00 7.01 C ATOM 201 C VAL A 13 5.346 2.423 22.184 1.00 6.76 C ATOM 202 O VAL A 13 4.494 2.072 21.358 1.00 6.97 O ATOM 203 CB VAL A 13 4.156 2.594 24.380 1.00 7.77 C ATOM 204 CG1 VAL A 13 4.849 1.292 24.753 1.00 9.86 C ATOM 205 CG2 VAL A 13 3.957 3.462 25.612 1.00 9.87 C ATOM 206 HA VAL A 13 5.872 3.754 23.799 1.00 0.00 H ATOM 207 HB VAL A 13 3.182 2.347 23.957 1.00 0.00 H ATOM 208 HG11 VAL A 13 4.953 0.670 23.864 1.00 0.00 H ATOM 209 HG12 VAL A 13 5.835 1.511 25.162 1.00 0.00 H ATOM 210 HG13 VAL A 13 4.254 0.766 25.499 1.00 0.00 H ATOM 211 HG21 VAL A 13 4.929 3.727 26.029 1.00 0.00 H ATOM 212 HG22 VAL A 13 3.420 4.369 25.333 1.00 0.00 H ATOM 213 HG23 VAL A 13 3.380 2.910 26.354 1.00 0.00 H ATOM 214 H VAL A 13 3.222 4.646 23.111 1.00 0.00 H ATOM 215 N ILE A 14 6.611 2.005 22.158 1.00 7.58 N ATOM 216 CA ILE A 14 7.079 1.013 21.198 1.00 7.92 C ATOM 217 C ILE A 14 7.760 -0.182 21.858 1.00 8.84 C ATOM 218 O ILE A 14 8.313 -1.045 21.181 1.00 13.77 O ATOM 219 CB ILE A 14 8.031 1.616 20.133 1.00 7.78 C ATOM 220 CG1 ILE A 14 9.280 2.222 20.781 1.00 8.64 C ATOM 221 CG2 ILE A 14 7.286 2.618 19.257 1.00 8.91 C ATOM 222 CD1 ILE A 14 10.287 2.749 19.763 1.00 10.27 C ATOM 223 HA ILE A 14 6.173 0.663 20.703 1.00 0.00 H ATOM 224 HB ILE A 14 8.379 0.812 19.484 1.00 0.00 H ATOM 225 HG12 ILE A 14 8.972 3.047 21.424 1.00 0.00 H ATOM 226 HG13 ILE A 14 9.765 1.455 21.384 1.00 0.00 H ATOM 227 HD11 ILE A 14 10.612 1.932 19.119 1.00 0.00 H ATOM 228 HD12 ILE A 14 9.818 3.526 19.159 1.00 0.00 H ATOM 229 HD13 ILE A 14 11.148 3.165 20.287 1.00 0.00 H ATOM 230 HG21 ILE A 14 6.462 2.115 18.752 1.00 0.00 H ATOM 231 HG22 ILE A 14 6.895 3.423 19.880 1.00 0.00 H ATOM 232 HG23 ILE A 14 7.971 3.030 18.516 1.00 0.00 H ATOM 233 H ILE A 14 7.286 2.399 22.844 1.00 0.00 H ATOM 234 N GLY A 15 7.725 -0.241 23.178 1.00 7.85 N ATOM 235 CA GLY A 15 8.262 -1.393 23.866 1.00 8.76 C ATOM 236 C GLY A 15 8.145 -1.254 25.358 1.00 8.28 C ATOM 237 O GLY A 15 7.979 -0.148 25.882 1.00 8.01 O ATOM 238 HA3 GLY A 15 9.314 -1.503 23.603 1.00 0.00 H ATOM 239 HA2 GLY A 15 7.714 -2.281 23.550 1.00 0.00 H ATOM 240 H GLY A 15 7.311 0.542 23.722 1.00 0.00 H ATOM 241 N PHE A 16 8.225 -2.395 26.036 1.00 9.09 N ATOM 242 CA PHE A 16 8.304 -2.443 27.481 1.00 10.64 C ATOM 243 C PHE A 16 9.171 -3.635 27.831 1.00 10.45 C ATOM 244 O PHE A 16 8.923 -4.737 27.350 1.00 11.39 O ATOM 245 CB PHE A 16 6.914 -2.616 28.087 1.00 10.29 C ATOM 246 CG PHE A 16 6.903 -2.581 29.584 1.00 11.77 C ATOM 247 CD1 PHE A 16 7.366 -1.463 30.271 1.00 12.54 C ATOM 248 CD2 PHE A 16 6.446 -3.672 30.310 1.00 14.24 C ATOM 249 CE1 PHE A 16 7.366 -1.428 31.658 1.00 14.98 C ATOM 250 CE2 PHE A 16 6.433 -3.641 31.698 1.00 16.69 C ATOM 251 CZ PHE A 16 6.901 -2.522 32.371 1.00 15.99 C ATOM 252 HA PHE A 16 8.723 -1.518 27.876 1.00 0.00 H ATOM 253 HB2 PHE A 16 6.275 -1.813 27.719 1.00 0.00 H ATOM 254 HB3 PHE A 16 6.513 -3.576 27.762 1.00 0.00 H ATOM 255 HD2 PHE A 16 6.094 -4.561 29.786 1.00 0.00 H ATOM 256 HE2 PHE A 16 6.055 -4.496 32.259 1.00 0.00 H ATOM 257 HZ PHE A 16 6.903 -2.503 33.461 1.00 0.00 H ATOM 258 HE1 PHE A 16 7.730 -0.545 32.184 1.00 0.00 H ATOM 259 HD1 PHE A 16 7.734 -0.603 29.712 1.00 0.00 H ATOM 260 H PHE A 16 8.231 -3.290 25.506 1.00 0.00 H ATOM 261 N GLU A 17 10.208 -3.412 28.630 1.00 11.80 N ATOM 262 CA GLU A 17 11.083 -4.507 29.039 1.00 12.96 C ATOM 263 C GLU A 17 11.567 -5.309 27.826 1.00 13.01 C ATOM 264 O GLU A 17 11.602 -6.549 27.829 1.00 13.38 O ATOM 265 CB GLU A 17 10.396 -5.379 30.104 1.00 13.76 C ATOM 266 CG GLU A 17 10.165 -4.601 31.398 1.00 15.77 C ATOM 267 CD GLU A 17 9.384 -5.352 32.460 1.00 16.79 C ATOM 268 OE1 GLU A 17 8.701 -6.336 32.133 1.00 20.72 O ATOM 269 OE2 GLU A 17 9.431 -4.909 33.629 1.00 23.02 O ATOM 270 HA GLU A 17 11.977 -4.090 29.503 1.00 0.00 H ATOM 271 HB2 GLU A 17 9.435 -5.719 29.718 1.00 0.00 H ATOM 272 HB3 GLU A 17 11.027 -6.242 30.317 1.00 0.00 H ATOM 273 HG2 GLU A 17 11.137 -4.338 31.814 1.00 0.00 H ATOM 274 HG3 GLU A 17 9.617 -3.691 31.154 1.00 0.00 H ATOM 275 H GLU A 17 10.399 -2.447 28.968 1.00 0.00 H ATOM 276 N ASN A 18 11.941 -4.556 26.791 1.00 12.34 N ATOM 277 CA ASN A 18 12.538 -5.073 25.572 1.00 13.55 C ATOM 278 C ASN A 18 11.642 -5.914 24.676 1.00 12.43 C ATOM 279 O ASN A 18 12.122 -6.633 23.796 1.00 14.95 O ATOM 280 CB ASN A 18 13.868 -5.770 25.830 1.00 14.78 C ATOM 281 CG ASN A 18 14.779 -5.711 24.627 1.00 16.13 C ATOM 282 OD1 ASN A 18 14.677 -4.798 23.803 1.00 20.36 O ATOM 283 ND2 ASN A 18 15.665 -6.683 24.507 1.00 17.24 N ATOM 284 HA ASN A 18 12.714 -4.167 24.992 1.00 0.00 H ATOM 285 HB2 ASN A 18 14.363 -5.285 26.671 1.00 0.00 H ATOM 286 HB3 ASN A 18 13.677 -6.814 26.076 1.00 0.00 H ATOM 287 HD22 ASN A 18 15.715 -7.432 25.226 1.00 0.00 H ATOM 288 HD21 ASN A 18 16.312 -6.699 23.693 1.00 0.00 H ATOM 289 H ASN A 18 11.795 -3.529 26.861 1.00 0.00 H ATOM 290 N GLN A 19 10.339 -5.797 24.888 1.00 11.66 N ATOM 291 CA GLN A 19 9.359 -6.527 24.091 1.00 11.63 C ATOM 292 C GLN A 19 8.215 -5.607 23.690 1.00 11.57 C ATOM 293 O GLN A 19 7.998 -4.571 24.305 1.00 12.92 O ATOM 294 CB GLN A 19 8.787 -7.680 24.905 1.00 13.95 C ATOM 295 CG GLN A 19 9.842 -8.540 25.578 1.00 19.01 C ATOM 296 CD GLN A 19 9.319 -9.228 26.828 1.00 23.27 C ATOM 297 OE1 GLN A 19 9.768 -8.946 27.949 1.00 26.18 O ATOM 298 NE2 GLN A 19 8.370 -10.142 26.644 1.00 20.88 N ATOM 299 HA GLN A 19 9.856 -6.907 23.199 1.00 0.00 H ATOM 300 HB2 GLN A 19 8.137 -7.267 25.676 1.00 0.00 H ATOM 301 HB3 GLN A 19 8.201 -8.313 24.239 1.00 0.00 H ATOM 302 HG2 GLN A 19 10.175 -9.301 24.873 1.00 0.00 H ATOM 303 HG3 GLN A 19 10.686 -7.907 25.854 1.00 0.00 H ATOM 304 HE22 GLN A 19 8.023 -10.346 25.685 1.00 0.00 H ATOM 305 HE21 GLN A 19 7.975 -10.653 27.459 1.00 0.00 H ATOM 306 H GLN A 19 10.005 -5.166 25.645 1.00 0.00 H ATOM 307 N LEU A 20 7.474 -6.000 22.667 1.00 12.10 N ATOM 308 CA LEU A 20 6.201 -5.351 22.382 1.00 12.13 C ATOM 309 C LEU A 20 5.188 -5.691 23.479 1.00 12.79 C ATOM 310 O LEU A 20 4.995 -6.863 23.792 1.00 13.65 O ATOM 311 CB LEU A 20 5.679 -5.819 21.022 1.00 13.54 C ATOM 312 CG LEU A 20 6.594 -5.522 19.835 1.00 16.28 C ATOM 313 CD1 LEU A 20 6.043 -6.172 18.572 1.00 17.53 C ATOM 314 CD2 LEU A 20 6.728 -4.015 19.667 1.00 19.56 C ATOM 315 HA LEU A 20 6.344 -4.271 22.356 1.00 0.00 H ATOM 316 HB2 LEU A 20 5.530 -6.898 21.071 1.00 0.00 H ATOM 317 HB3 LEU A 20 4.722 -5.329 20.841 1.00 0.00 H ATOM 318 HG LEU A 20 7.583 -5.940 20.019 1.00 0.00 H ATOM 319 HD21 LEU A 20 5.744 -3.582 19.487 1.00 0.00 H ATOM 320 HD22 LEU A 20 7.155 -3.586 20.574 1.00 0.00 H ATOM 321 HD23 LEU A 20 7.381 -3.802 18.820 1.00 0.00 H ATOM 322 HD11 LEU A 20 5.983 -7.251 18.717 1.00 0.00 H ATOM 323 HD12 LEU A 20 5.049 -5.776 18.365 1.00 0.00 H ATOM 324 HD13 LEU A 20 6.704 -5.953 17.734 1.00 0.00 H ATOM 325 H LEU A 20 7.803 -6.779 22.061 1.00 0.00 H ATOM 326 N PRO A 21 4.542 -4.673 24.082 1.00 12.23 N ATOM 327 CA PRO A 21 3.596 -4.986 25.167 1.00 13.09 C ATOM 328 C PRO A 21 2.286 -5.624 24.703 1.00 12.27 C ATOM 329 O PRO A 21 1.551 -6.206 25.518 1.00 14.55 O ATOM 330 CB PRO A 21 3.336 -3.630 25.851 1.00 15.33 C ATOM 331 CG PRO A 21 3.943 -2.605 25.009 1.00 14.02 C ATOM 332 CD PRO A 21 4.706 -3.225 23.863 1.00 12.30 C ATOM 333 HA PRO A 21 4.023 -5.738 25.831 1.00 0.00 H ATOM 334 HD3 PRO A 21 4.282 -2.925 22.905 1.00 0.00 H ATOM 335 HD2 PRO A 21 5.758 -2.942 23.897 1.00 0.00 H ATOM 336 HG3 PRO A 21 4.628 -2.008 25.612 1.00 0.00 H ATOM 337 HG2 PRO A 21 3.159 -1.962 24.609 1.00 0.00 H ATOM 338 HB2 PRO A 21 2.264 -3.455 25.941 1.00 0.00 H ATOM 339 HB3 PRO A 21 3.789 -3.617 26.842 1.00 0.00 H ATOM 340 N TRP A 22 1.992 -5.514 23.410 1.00 11.24 N ATOM 341 CA TRP A 22 0.819 -6.146 22.802 1.00 11.14 C ATOM 342 C TRP A 22 1.269 -7.331 21.958 1.00 12.33 C ATOM 343 O TRP A 22 2.427 -7.406 21.541 1.00 13.40 O ATOM 344 CB TRP A 22 0.071 -5.141 21.909 1.00 11.11 C ATOM 345 CG TRP A 22 0.997 -4.465 20.960 1.00 8.83 C ATOM 346 CD1 TRP A 22 1.440 -4.946 19.767 1.00 10.77 C ATOM 347 CD2 TRP A 22 1.672 -3.222 21.173 1.00 8.15 C ATOM 348 NE1 TRP A 22 2.331 -4.062 19.202 1.00 9.47 N ATOM 349 CE2 TRP A 22 2.490 -2.994 20.047 1.00 7.59 C ATOM 350 CE3 TRP A 22 1.641 -2.264 22.197 1.00 9.09 C ATOM 351 CZ2 TRP A 22 3.279 -1.837 19.913 1.00 9.30 C ATOM 352 CZ3 TRP A 22 2.419 -1.117 22.066 1.00 9.25 C ATOM 353 CH2 TRP A 22 3.236 -0.916 20.934 1.00 11.06 C ATOM 354 HA TRP A 22 0.149 -6.483 23.593 1.00 0.00 H ATOM 355 HB2 TRP A 22 -0.694 -5.671 21.342 1.00 0.00 H ATOM 356 HB3 TRP A 22 -0.402 -4.389 22.540 1.00 0.00 H ATOM 357 HE1 TRP A 22 2.806 -4.184 18.285 1.00 0.00 H ATOM 358 HD1 TRP A 22 1.134 -5.893 19.323 1.00 0.00 H ATOM 359 HZ2 TRP A 22 3.901 -1.676 19.033 1.00 0.00 H ATOM 360 HH2 TRP A 22 3.845 -0.014 20.867 1.00 0.00 H ATOM 361 HZ3 TRP A 22 2.396 -0.362 22.851 1.00 0.00 H ATOM 362 HE3 TRP A 22 1.019 -2.415 23.079 1.00 0.00 H ATOM 363 H TRP A 22 2.624 -4.954 22.803 1.00 0.00 H ATOM 364 N HIS A 23 0.345 -8.250 21.701 1.00 13.33 N ATOM 365 CA HIS A 23 0.626 -9.380 20.826 1.00 14.68 C ATOM 366 C HIS A 23 -0.294 -9.306 19.624 1.00 13.66 C ATOM 367 O HIS A 23 -1.487 -9.582 19.727 1.00 15.13 O ATOM 368 CB HIS A 23 0.439 -10.699 21.580 1.00 16.39 C ATOM 369 CG HIS A 23 1.280 -10.801 22.814 1.00 21.11 C ATOM 370 ND1 HIS A 23 0.789 -10.527 24.073 1.00 25.54 N ATOM 371 CD2 HIS A 23 2.585 -11.119 22.980 1.00 24.42 C ATOM 372 CE1 HIS A 23 1.752 -10.688 24.963 1.00 26.33 C ATOM 373 NE2 HIS A 23 2.852 -11.048 24.326 1.00 25.97 N ATOM 374 HA HIS A 23 1.662 -9.338 20.489 1.00 0.00 H ATOM 375 HB2 HIS A 23 -0.609 -10.788 21.867 1.00 0.00 H ATOM 376 HB3 HIS A 23 0.703 -11.520 20.913 1.00 0.00 H ATOM 377 HD2 HIS A 23 3.292 -11.382 22.193 1.00 0.00 H ATOM 378 HE1 HIS A 23 1.655 -10.548 26.040 1.00 0.00 H ATOM 379 H HIS A 23 -0.597 -8.161 22.133 1.00 0.00 H ATOM 380 N LEU A 24 0.269 -8.910 18.488 1.00 11.70 N ATOM 381 CA LEU A 24 -0.516 -8.711 17.274 1.00 10.97 C ATOM 382 C LEU A 24 0.140 -9.377 16.080 1.00 11.13 C ATOM 383 O LEU A 24 0.857 -8.735 15.315 1.00 9.63 O ATOM 384 CB LEU A 24 -0.708 -7.228 16.971 1.00 12.80 C ATOM 385 CG LEU A 24 -1.758 -6.442 17.743 1.00 14.13 C ATOM 386 CD1 LEU A 24 -1.734 -5.009 17.237 1.00 14.41 C ATOM 387 CD2 LEU A 24 -3.165 -7.059 17.596 1.00 14.75 C ATOM 388 HA LEU A 24 -1.490 -9.168 17.452 1.00 0.00 H ATOM 389 HB2 LEU A 24 0.250 -6.740 17.149 1.00 0.00 H ATOM 390 HB3 LEU A 24 -0.964 -7.149 15.914 1.00 0.00 H ATOM 391 HG LEU A 24 -1.524 -6.472 18.807 1.00 0.00 H ATOM 392 HD21 LEU A 24 -3.449 -7.066 16.544 1.00 0.00 H ATOM 393 HD22 LEU A 24 -3.154 -8.080 17.977 1.00 0.00 H ATOM 394 HD23 LEU A 24 -3.882 -6.465 18.163 1.00 0.00 H ATOM 395 HD11 LEU A 24 -0.745 -4.583 17.403 1.00 0.00 H ATOM 396 HD12 LEU A 24 -1.961 -4.998 16.171 1.00 0.00 H ATOM 397 HD13 LEU A 24 -2.479 -4.423 17.775 1.00 0.00 H ATOM 398 H LEU A 24 1.294 -8.738 18.463 1.00 0.00 H ATOM 399 N PRO A 25 -0.107 -10.680 15.914 1.00 10.83 N ATOM 400 CA PRO A 25 0.377 -11.351 14.704 1.00 11.02 C ATOM 401 C PRO A 25 -0.038 -10.627 13.417 1.00 10.65 C ATOM 402 O PRO A 25 0.688 -10.664 12.426 1.00 11.69 O ATOM 403 CB PRO A 25 -0.275 -12.730 14.786 1.00 13.02 C ATOM 404 CG PRO A 25 -0.486 -12.952 16.256 1.00 12.63 C ATOM 405 CD PRO A 25 -0.784 -11.601 16.846 1.00 11.11 C ATOM 406 HA PRO A 25 1.466 -11.380 14.661 1.00 0.00 H ATOM 407 HD3 PRO A 25 -1.857 -11.413 16.874 1.00 0.00 H ATOM 408 HD2 PRO A 25 -0.374 -11.513 17.852 1.00 0.00 H ATOM 409 HG3 PRO A 25 0.413 -13.372 16.708 1.00 0.00 H ATOM 410 HG2 PRO A 25 -1.324 -13.629 16.420 1.00 0.00 H ATOM 411 HB2 PRO A 25 -1.226 -12.741 14.253 1.00 0.00 H ATOM 412 HB3 PRO A 25 0.382 -13.494 14.370 1.00 0.00 H ATOM 413 N ASN A 26 -1.177 -9.944 13.428 1.00 9.80 N ATOM 414 CA ASN A 26 -1.600 -9.207 12.239 1.00 10.54 C ATOM 415 C ASN A 26 -0.618 -8.082 11.886 1.00 9.97 C ATOM 416 O ASN A 26 -0.385 -7.787 10.710 1.00 10.35 O ATOM 417 CB ASN A 26 -3.006 -8.633 12.420 1.00 10.88 C ATOM 418 CG ASN A 26 -3.626 -8.208 11.117 1.00 11.19 C ATOM 419 OD1 ASN A 26 -3.594 -8.954 10.131 1.00 15.29 O ATOM 420 ND2 ASN A 26 -4.214 -7.014 11.100 1.00 12.16 N ATOM 421 HA ASN A 26 -1.612 -9.918 11.413 1.00 0.00 H ATOM 422 HB2 ASN A 26 -3.639 -9.394 12.877 1.00 0.00 H ATOM 423 HB3 ASN A 26 -2.948 -7.767 13.079 1.00 0.00 H ATOM 424 HD22 ASN A 26 -4.215 -6.422 11.955 1.00 0.00 H ATOM 425 HD21 ASN A 26 -4.673 -6.673 10.231 1.00 0.00 H ATOM 426 H ASN A 26 -1.768 -9.934 14.283 1.00 0.00 H ATOM 427 N ASP A 27 -0.038 -7.458 12.908 1.00 9.32 N ATOM 428 CA ASP A 27 0.990 -6.455 12.664 1.00 9.17 C ATOM 429 C ASP A 27 2.253 -7.111 12.120 1.00 9.60 C ATOM 430 O ASP A 27 2.888 -6.585 11.205 1.00 9.82 O ATOM 431 CB ASP A 27 1.312 -5.655 13.931 1.00 9.81 C ATOM 432 CG ASP A 27 2.530 -4.765 13.748 1.00 9.67 C ATOM 433 OD1 ASP A 27 2.459 -3.808 12.942 1.00 10.73 O ATOM 434 OD2 ASP A 27 3.570 -5.048 14.377 1.00 10.98 O ATOM 435 HA ASP A 27 0.601 -5.759 11.921 1.00 0.00 H ATOM 436 HB2 ASP A 27 0.454 -5.031 14.181 1.00 0.00 H ATOM 437 HB3 ASP A 27 1.504 -6.351 14.748 1.00 0.00 H ATOM 438 H ASP A 27 -0.319 -7.687 13.883 1.00 0.00 H ATOM 439 N LEU A 28 2.620 -8.266 12.671 1.00 10.34 N ATOM 440 CA LEU A 28 3.793 -8.960 12.159 1.00 11.75 C ATOM 441 C LEU A 28 3.608 -9.395 10.696 1.00 10.78 C ATOM 442 O LEU A 28 4.558 -9.385 9.913 1.00 11.48 O ATOM 443 CB LEU A 28 4.179 -10.133 13.073 1.00 13.46 C ATOM 444 CG LEU A 28 4.286 -9.742 14.558 1.00 19.31 C ATOM 445 CD1 LEU A 28 4.817 -10.894 15.410 1.00 20.70 C ATOM 446 CD2 LEU A 28 5.145 -8.489 14.739 1.00 20.40 C ATOM 447 HA LEU A 28 4.626 -8.257 12.165 1.00 0.00 H ATOM 448 HB2 LEU A 28 3.423 -10.912 12.974 1.00 0.00 H ATOM 449 HB3 LEU A 28 5.144 -10.522 12.748 1.00 0.00 H ATOM 450 HG LEU A 28 3.278 -9.515 14.905 1.00 0.00 H ATOM 451 HD21 LEU A 28 6.147 -8.679 14.355 1.00 0.00 H ATOM 452 HD22 LEU A 28 4.696 -7.660 14.192 1.00 0.00 H ATOM 453 HD23 LEU A 28 5.201 -8.239 15.798 1.00 0.00 H ATOM 454 HD11 LEU A 28 4.143 -11.746 15.327 1.00 0.00 H ATOM 455 HD12 LEU A 28 5.809 -11.178 15.057 1.00 0.00 H ATOM 456 HD13 LEU A 28 4.877 -10.577 16.451 1.00 0.00 H ATOM 457 H LEU A 28 2.074 -8.669 13.459 1.00 0.00 H ATOM 458 N LYS A 29 2.380 -9.752 10.325 1.00 10.36 N ATOM 459 CA LYS A 29 2.051 -10.089 8.933 1.00 11.49 C ATOM 460 C LYS A 29 2.155 -8.857 8.022 1.00 10.84 C ATOM 461 O LYS A 29 2.634 -8.939 6.893 1.00 10.98 O ATOM 462 CB LYS A 29 0.645 -10.692 8.867 1.00 12.47 C ATOM 463 CG LYS A 29 0.182 -11.099 7.471 1.00 12.68 C ATOM 464 CD LYS A 29 -1.217 -11.703 7.538 1.00 15.83 C ATOM 465 CE LYS A 29 -1.903 -11.729 6.183 1.00 24.57 C ATOM 466 NZ LYS A 29 -3.343 -12.076 6.334 1.00 29.28 N ATOM 467 HA LYS A 29 2.773 -10.823 8.575 1.00 0.00 H ATOM 468 HB2 LYS A 29 0.627 -11.578 9.501 1.00 0.00 H ATOM 469 HB3 LYS A 29 -0.058 -9.955 9.255 1.00 0.00 H ATOM 470 HG2 LYS A 29 0.165 -10.220 6.826 1.00 0.00 H ATOM 471 HG3 LYS A 29 0.874 -11.835 7.062 1.00 0.00 H ATOM 472 HD2 LYS A 29 -1.140 -12.724 7.911 1.00 0.00 H ATOM 473 HD3 LYS A 29 -1.821 -11.111 8.225 1.00 0.00 H ATOM 474 HE2 LYS A 29 -1.419 -12.473 5.550 1.00 0.00 H ATOM 475 HE3 LYS A 29 -1.817 -10.747 5.718 1.00 0.00 H ATOM 476 HZ1 LYS A 29 -3.428 -13.014 6.774 1.00 0.00 H ATOM 477 HZ2 LYS A 29 -3.808 -11.366 6.935 1.00 0.00 H ATOM 478 HZ3 LYS A 29 -3.795 -12.089 5.398 1.00 0.00 H ATOM 479 H LYS A 29 1.629 -9.794 11.044 1.00 0.00 H ATOM 480 N HIS A 30 1.727 -7.712 8.540 1.00 9.54 N ATOM 481 CA HIS A 30 1.886 -6.432 7.859 1.00 9.75 C ATOM 482 C HIS A 30 3.371 -6.166 7.577 1.00 10.13 C ATOM 483 O HIS A 30 3.760 -5.827 6.455 1.00 10.56 O ATOM 484 CB HIS A 30 1.279 -5.343 8.761 1.00 10.42 C ATOM 485 CG HIS A 30 1.325 -3.958 8.200 1.00 12.61 C ATOM 486 ND1 HIS A 30 0.590 -3.575 7.101 1.00 15.17 N ATOM 487 CD2 HIS A 30 1.969 -2.845 8.630 1.00 15.49 C ATOM 488 CE1 HIS A 30 0.798 -2.291 6.861 1.00 17.01 C ATOM 489 NE2 HIS A 30 1.631 -1.825 7.774 1.00 16.33 N ATOM 490 HA HIS A 30 1.373 -6.436 6.897 1.00 0.00 H ATOM 491 HB2 HIS A 30 0.236 -5.599 8.945 1.00 0.00 H ATOM 492 HB3 HIS A 30 1.824 -5.344 9.705 1.00 0.00 H ATOM 493 HD2 HIS A 30 2.631 -2.773 9.493 1.00 0.00 H ATOM 494 HE1 HIS A 30 0.357 -1.715 6.048 1.00 0.00 H ATOM 495 H HIS A 30 1.259 -7.728 9.469 1.00 0.00 H ATOM 496 N VAL A 31 4.199 -6.331 8.601 1.00 10.06 N ATOM 497 CA VAL A 31 5.641 -6.197 8.444 1.00 10.63 C ATOM 498 C VAL A 31 6.176 -7.138 7.355 1.00 10.85 C ATOM 499 O VAL A 31 6.970 -6.721 6.515 1.00 11.84 O ATOM 500 CB VAL A 31 6.377 -6.456 9.779 1.00 10.40 C ATOM 501 CG1 VAL A 31 7.883 -6.608 9.535 1.00 11.76 C ATOM 502 CG2 VAL A 31 6.106 -5.320 10.772 1.00 10.88 C ATOM 503 HA VAL A 31 5.836 -5.170 8.136 1.00 0.00 H ATOM 504 HB VAL A 31 5.999 -7.384 10.209 1.00 0.00 H ATOM 505 HG11 VAL A 31 8.058 -7.448 8.863 1.00 0.00 H ATOM 506 HG12 VAL A 31 8.271 -5.694 9.085 1.00 0.00 H ATOM 507 HG13 VAL A 31 8.387 -6.790 10.484 1.00 0.00 H ATOM 508 HG21 VAL A 31 6.458 -4.379 10.350 1.00 0.00 H ATOM 509 HG22 VAL A 31 5.035 -5.255 10.965 1.00 0.00 H ATOM 510 HG23 VAL A 31 6.633 -5.521 11.705 1.00 0.00 H ATOM 511 H VAL A 31 3.809 -6.561 9.537 1.00 0.00 H ATOM 512 N LYS A 32 5.738 -8.398 7.374 1.00 10.59 N ATOM 513 CA LYS A 32 6.170 -9.385 6.380 1.00 12.74 C ATOM 514 C LYS A 32 5.792 -8.917 4.971 1.00 11.83 C ATOM 515 O LYS A 32 6.614 -8.967 4.052 1.00 12.68 O ATOM 516 CB LYS A 32 5.537 -10.743 6.696 1.00 13.31 C ATOM 517 CG LYS A 32 5.789 -11.836 5.666 1.00 14.26 C ATOM 518 CD LYS A 32 5.086 -13.125 6.093 1.00 17.10 C ATOM 519 CE LYS A 32 5.229 -14.237 5.060 1.00 15.37 C ATOM 520 NZ LYS A 32 4.404 -15.435 5.420 1.00 18.93 N ATOM 521 HA LYS A 32 7.254 -9.489 6.420 1.00 0.00 H ATOM 522 HB2 LYS A 32 5.932 -11.084 7.653 1.00 0.00 H ATOM 523 HB3 LYS A 32 4.460 -10.601 6.779 1.00 0.00 H ATOM 524 HG2 LYS A 32 5.403 -11.517 4.698 1.00 0.00 H ATOM 525 HG3 LYS A 32 6.861 -12.018 5.586 1.00 0.00 H ATOM 526 HD2 LYS A 32 5.518 -13.464 7.034 1.00 0.00 H ATOM 527 HD3 LYS A 32 4.026 -12.915 6.236 1.00 0.00 H ATOM 528 HE2 LYS A 32 6.276 -14.533 5.002 1.00 0.00 H ATOM 529 HE3 LYS A 32 4.904 -13.862 4.089 1.00 0.00 H ATOM 530 HZ1 LYS A 32 4.712 -15.802 6.343 1.00 0.00 H ATOM 531 HZ2 LYS A 32 3.402 -15.161 5.472 1.00 0.00 H ATOM 532 HZ3 LYS A 32 4.527 -16.170 4.694 1.00 0.00 H ATOM 533 H LYS A 32 5.070 -8.689 8.116 1.00 0.00 H ATOM 534 N LYS A 33 4.556 -8.451 4.808 1.00 11.51 N ATOM 535 CA LYS A 33 4.062 -8.051 3.492 1.00 12.87 C ATOM 536 C LYS A 33 4.858 -6.866 2.949 1.00 12.40 C ATOM 537 O LYS A 33 5.231 -6.847 1.775 1.00 14.36 O ATOM 538 CB LYS A 33 2.561 -7.724 3.535 1.00 15.00 C ATOM 539 CG LYS A 33 1.673 -8.949 3.683 1.00 18.38 C ATOM 540 CD LYS A 33 0.241 -8.657 3.253 1.00 24.90 C ATOM 541 CE LYS A 33 -0.709 -8.615 4.432 1.00 29.57 C ATOM 542 NZ LYS A 33 -2.110 -8.861 3.978 1.00 29.97 N ATOM 543 HA LYS A 33 4.201 -8.895 2.816 1.00 0.00 H ATOM 544 HB2 LYS A 33 2.377 -7.061 4.380 1.00 0.00 H ATOM 545 HB3 LYS A 33 2.293 -7.214 2.610 1.00 0.00 H ATOM 546 HG2 LYS A 33 2.072 -9.753 3.064 1.00 0.00 H ATOM 547 HG3 LYS A 33 1.673 -9.262 4.727 1.00 0.00 H ATOM 548 HD2 LYS A 33 0.215 -7.693 2.746 1.00 0.00 H ATOM 549 HD3 LYS A 33 -0.086 -9.437 2.565 1.00 0.00 H ATOM 550 HE2 LYS A 33 -0.651 -7.635 4.906 1.00 0.00 H ATOM 551 HE3 LYS A 33 -0.424 -9.383 5.151 1.00 0.00 H ATOM 552 HZ1 LYS A 33 -2.385 -8.128 3.293 1.00 0.00 H ATOM 553 HZ2 LYS A 33 -2.168 -9.797 3.528 1.00 0.00 H ATOM 554 HZ3 LYS A 33 -2.749 -8.829 4.798 1.00 0.00 H ATOM 555 H LYS A 33 3.929 -8.370 5.634 1.00 0.00 H ATOM 556 N LEU A 34 5.141 -5.887 3.811 1.00 11.43 N ATOM 557 CA LEU A 34 5.819 -4.678 3.363 1.00 11.61 C ATOM 558 C LEU A 34 7.294 -4.914 3.069 1.00 11.34 C ATOM 559 O LEU A 34 7.836 -4.331 2.127 1.00 13.11 O ATOM 560 CB LEU A 34 5.699 -3.563 4.397 1.00 11.99 C ATOM 561 CG LEU A 34 4.348 -2.856 4.465 1.00 12.27 C ATOM 562 CD1 LEU A 34 4.284 -1.972 5.701 1.00 13.39 C ATOM 563 CD2 LEU A 34 4.064 -2.031 3.226 1.00 16.85 C ATOM 564 HA LEU A 34 5.323 -4.382 2.439 1.00 0.00 H ATOM 565 HB2 LEU A 34 5.900 -3.994 5.378 1.00 0.00 H ATOM 566 HB3 LEU A 34 6.457 -2.813 4.169 1.00 0.00 H ATOM 567 HG LEU A 34 3.582 -3.630 4.523 1.00 0.00 H ATOM 568 HD21 LEU A 34 4.837 -1.271 3.112 1.00 0.00 H ATOM 569 HD22 LEU A 34 4.060 -2.681 2.351 1.00 0.00 H ATOM 570 HD23 LEU A 34 3.091 -1.550 3.327 1.00 0.00 H ATOM 571 HD11 LEU A 34 4.413 -2.586 6.592 1.00 0.00 H ATOM 572 HD12 LEU A 34 5.077 -1.226 5.654 1.00 0.00 H ATOM 573 HD13 LEU A 34 3.316 -1.473 5.739 1.00 0.00 H ATOM 574 H LEU A 34 4.875 -5.988 4.811 1.00 0.00 H ATOM 575 N SER A 35 7.955 -5.730 3.890 1.00 11.60 N ATOM 576 CA SER A 35 9.422 -5.762 3.893 1.00 12.18 C ATOM 577 C SER A 35 10.063 -6.983 3.242 1.00 13.08 C ATOM 578 O SER A 35 11.261 -6.970 2.973 1.00 13.43 O ATOM 579 CB SER A 35 9.991 -5.574 5.304 1.00 11.97 C ATOM 580 OG SER A 35 9.661 -6.655 6.158 1.00 12.17 O ATOM 581 HA SER A 35 9.690 -4.916 3.260 1.00 0.00 H ATOM 582 HB2 SER A 35 9.586 -4.655 5.727 1.00 0.00 H ATOM 583 HB3 SER A 35 11.076 -5.496 5.239 1.00 0.00 H ATOM 584 HG SER A 35 8.676 -6.730 6.229 1.00 0.00 H ATOM 585 H SER A 35 7.425 -6.350 4.535 1.00 0.00 H ATOM 586 N THR A 36 9.289 -8.039 3.002 1.00 13.64 N ATOM 587 CA THR A 36 9.828 -9.206 2.314 1.00 15.35 C ATOM 588 C THR A 36 10.417 -8.790 0.964 1.00 15.32 C ATOM 589 O THR A 36 9.793 -8.034 0.210 1.00 16.27 O ATOM 590 CB THR A 36 8.759 -10.294 2.132 1.00 15.74 C ATOM 591 OG1 THR A 36 8.497 -10.916 3.400 1.00 18.06 O ATOM 592 CG2 THR A 36 9.239 -11.359 1.138 1.00 17.63 C ATOM 593 HA THR A 36 10.621 -9.630 2.930 1.00 0.00 H ATOM 594 HB THR A 36 7.851 -9.833 1.744 1.00 0.00 H ATOM 595 HG1 THR A 36 8.172 -10.234 4.040 1.00 0.00 H ATOM 596 HG23 THR A 36 9.439 -10.891 0.174 1.00 0.00 H ATOM 597 HG21 THR A 36 10.151 -11.821 1.515 1.00 0.00 H ATOM 598 HG22 THR A 36 8.467 -12.119 1.021 1.00 0.00 H ATOM 599 H THR A 36 8.295 -8.032 3.307 1.00 0.00 H ATOM 600 N GLY A 37 11.632 -9.264 0.682 1.00 14.97 N ATOM 601 CA GLY A 37 12.351 -8.905 -0.543 1.00 16.04 C ATOM 602 C GLY A 37 13.035 -7.546 -0.508 1.00 15.66 C ATOM 603 O GLY A 37 13.659 -7.131 -1.486 1.00 17.85 O ATOM 604 HA3 GLY A 37 11.638 -8.905 -1.367 1.00 0.00 H ATOM 605 HA2 GLY A 37 13.113 -9.663 -0.724 1.00 0.00 H ATOM 606 H GLY A 37 12.085 -9.912 1.357 1.00 0.00 H ATOM 607 N HIS A 38 12.927 -6.850 0.622 1.00 14.54 N ATOM 608 CA HIS A 38 13.550 -5.539 0.764 1.00 13.77 C ATOM 609 C HIS A 38 14.581 -5.577 1.883 1.00 12.16 C ATOM 610 O HIS A 38 15.161 -6.631 2.129 1.00 14.22 O ATOM 611 CB HIS A 38 12.484 -4.455 0.961 1.00 13.98 C ATOM 612 CG HIS A 38 11.549 -4.347 -0.202 1.00 15.95 C ATOM 613 ND1 HIS A 38 10.193 -4.575 -0.105 1.00 20.00 N ATOM 614 CD2 HIS A 38 11.794 -4.085 -1.508 1.00 16.96 C ATOM 615 CE1 HIS A 38 9.639 -4.433 -1.297 1.00 18.14 C ATOM 616 NE2 HIS A 38 10.588 -4.129 -2.163 1.00 20.69 N ATOM 617 HA HIS A 38 14.082 -5.280 -0.152 1.00 0.00 H ATOM 618 HB2 HIS A 38 11.905 -4.693 1.853 1.00 0.00 H ATOM 619 HB3 HIS A 38 12.983 -3.496 1.098 1.00 0.00 H ATOM 620 HD2 HIS A 38 12.766 -3.878 -1.955 1.00 0.00 H ATOM 621 HE1 HIS A 38 8.579 -4.547 -1.526 1.00 0.00 H ATOM 622 H HIS A 38 12.389 -7.248 1.418 1.00 0.00 H ATOM 623 N THR A 39 14.823 -4.443 2.548 1.00 11.61 N ATOM 624 CA THR A 39 15.874 -4.346 3.553 1.00 11.29 C ATOM 625 C THR A 39 15.300 -3.750 4.829 1.00 10.34 C ATOM 626 O THR A 39 14.604 -2.726 4.767 1.00 11.33 O ATOM 627 CB THR A 39 17.038 -3.463 3.044 1.00 12.31 C ATOM 628 OG1 THR A 39 17.622 -4.091 1.899 1.00 13.73 O ATOM 629 CG2 THR A 39 18.117 -3.291 4.107 1.00 11.97 C ATOM 630 HA THR A 39 16.260 -5.345 3.753 1.00 0.00 H ATOM 631 HB THR A 39 16.639 -2.479 2.796 1.00 0.00 H ATOM 632 HG1 THR A 39 16.937 -4.186 1.191 1.00 0.00 H ATOM 633 HG23 THR A 39 17.686 -2.813 4.987 1.00 0.00 H ATOM 634 HG21 THR A 39 18.514 -4.268 4.381 1.00 0.00 H ATOM 635 HG22 THR A 39 18.920 -2.669 3.711 1.00 0.00 H ATOM 636 H THR A 39 14.244 -3.604 2.342 1.00 0.00 H ATOM 637 N LEU A 40 15.594 -4.388 5.967 1.00 9.82 N ATOM 638 CA LEU A 40 15.340 -3.813 7.298 1.00 9.18 C ATOM 639 C LEU A 40 16.637 -3.325 7.903 1.00 9.04 C ATOM 640 O LEU A 40 17.624 -4.064 7.924 1.00 11.48 O ATOM 641 CB LEU A 40 14.750 -4.867 8.248 1.00 10.18 C ATOM 642 CG LEU A 40 13.407 -5.488 7.865 1.00 10.61 C ATOM 643 CD1 LEU A 40 12.992 -6.504 8.914 1.00 11.02 C ATOM 644 CD2 LEU A 40 12.353 -4.408 7.726 1.00 11.43 C ATOM 645 HA LEU A 40 14.635 -2.991 7.174 1.00 0.00 H ATOM 646 HB2 LEU A 40 15.474 -5.678 8.327 1.00 0.00 H ATOM 647 HB3 LEU A 40 14.626 -4.396 9.223 1.00 0.00 H ATOM 648 HG LEU A 40 13.509 -5.996 6.906 1.00 0.00 H ATOM 649 HD21 LEU A 40 12.246 -3.882 8.675 1.00 0.00 H ATOM 650 HD22 LEU A 40 12.656 -3.704 6.951 1.00 0.00 H ATOM 651 HD23 LEU A 40 11.401 -4.864 7.453 1.00 0.00 H ATOM 652 HD11 LEU A 40 13.747 -7.288 8.978 1.00 0.00 H ATOM 653 HD12 LEU A 40 12.898 -6.009 9.880 1.00 0.00 H ATOM 654 HD13 LEU A 40 12.034 -6.942 8.634 1.00 0.00 H ATOM 655 H LEU A 40 16.022 -5.334 5.909 1.00 0.00 H ATOM 656 N VAL A 41 16.638 -2.093 8.411 1.00 9.05 N ATOM 657 CA VAL A 41 17.763 -1.599 9.212 1.00 8.71 C ATOM 658 C VAL A 41 17.283 -1.402 10.632 1.00 8.05 C ATOM 659 O VAL A 41 16.257 -0.751 10.860 1.00 7.99 O ATOM 660 CB VAL A 41 18.299 -0.251 8.692 1.00 9.13 C ATOM 661 CG1 VAL A 41 19.384 0.289 9.636 1.00 11.47 C ATOM 662 CG2 VAL A 41 18.837 -0.407 7.273 1.00 10.83 C ATOM 663 HA VAL A 41 18.569 -2.330 9.151 1.00 0.00 H ATOM 664 HB VAL A 41 17.481 0.469 8.667 1.00 0.00 H ATOM 665 HG11 VAL A 41 18.960 0.433 10.630 1.00 0.00 H ATOM 666 HG12 VAL A 41 20.206 -0.425 9.690 1.00 0.00 H ATOM 667 HG13 VAL A 41 19.753 1.242 9.256 1.00 0.00 H ATOM 668 HG21 VAL A 41 19.646 -1.137 7.271 1.00 0.00 H ATOM 669 HG22 VAL A 41 18.036 -0.749 6.618 1.00 0.00 H ATOM 670 HG23 VAL A 41 19.212 0.554 6.920 1.00 0.00 H ATOM 671 H VAL A 41 15.825 -1.469 8.236 1.00 0.00 H ATOM 672 N MET A 42 18.016 -1.968 11.585 1.00 7.58 N ATOM 673 CA MET A 42 17.585 -1.905 12.976 1.00 8.06 C ATOM 674 C MET A 42 18.783 -1.744 13.901 1.00 7.81 C ATOM 675 O MET A 42 19.898 -2.146 13.567 1.00 9.03 O ATOM 676 CB MET A 42 16.808 -3.173 13.367 1.00 8.51 C ATOM 677 CG MET A 42 17.673 -4.431 13.439 1.00 9.46 C ATOM 678 SD MET A 42 16.697 -5.956 13.425 1.00 11.21 S ATOM 679 CE MET A 42 16.373 -6.130 11.664 1.00 12.79 C ATOM 680 HA MET A 42 16.930 -1.040 13.081 1.00 0.00 H ATOM 681 HB2 MET A 42 16.355 -3.011 14.345 1.00 0.00 H ATOM 682 HB3 MET A 42 16.024 -3.337 12.628 1.00 0.00 H ATOM 683 HG2 MET A 42 18.258 -4.400 14.358 1.00 0.00 H ATOM 684 HG3 MET A 42 18.346 -4.440 12.582 1.00 0.00 H ATOM 685 HE1 MET A 42 15.826 -5.257 11.309 1.00 0.00 H ATOM 686 HE2 MET A 42 17.319 -6.211 11.128 1.00 0.00 H ATOM 687 HE3 MET A 42 15.779 -7.028 11.492 1.00 0.00 H ATOM 688 H MET A 42 18.900 -2.457 11.338 1.00 0.00 H ATOM 689 N GLY A 43 18.540 -1.141 15.059 1.00 8.89 N ATOM 690 CA GLY A 43 19.519 -1.111 16.132 1.00 9.54 C ATOM 691 C GLY A 43 19.789 -2.484 16.724 1.00 9.64 C ATOM 692 O GLY A 43 19.014 -3.433 16.533 1.00 10.52 O ATOM 693 HA3 GLY A 43 19.149 -0.458 16.922 1.00 0.00 H ATOM 694 HA2 GLY A 43 20.454 -0.711 15.739 1.00 0.00 H ATOM 695 H GLY A 43 17.621 -0.676 15.202 1.00 0.00 H ATOM 696 N ARG A 44 20.901 -2.594 17.444 1.00 10.63 N ATOM 697 CA ARG A 44 21.293 -3.852 18.060 1.00 11.00 C ATOM 698 C ARG A 44 20.264 -4.374 19.066 1.00 10.82 C ATOM 699 O ARG A 44 20.005 -5.588 19.134 1.00 11.08 O ATOM 700 CB ARG A 44 22.654 -3.686 18.725 1.00 11.29 C ATOM 701 CG ARG A 44 23.189 -4.944 19.340 1.00 13.24 C ATOM 702 CD ARG A 44 24.573 -4.703 19.898 1.00 13.89 C ATOM 703 NE ARG A 44 25.105 -5.926 20.476 1.00 14.51 N ATOM 704 CZ ARG A 44 26.372 -6.087 20.829 1.00 16.18 C ATOM 705 NH1 ARG A 44 27.234 -5.090 20.667 1.00 19.07 N ATOM 706 NH2 ARG A 44 26.774 -7.245 21.337 1.00 16.31 N ATOM 707 HA ARG A 44 21.350 -4.599 17.269 1.00 0.00 H ATOM 708 HB2 ARG A 44 23.364 -3.343 17.972 1.00 0.00 H ATOM 709 HB3 ARG A 44 22.564 -2.933 19.508 1.00 0.00 H ATOM 710 HG2 ARG A 44 22.526 -5.262 20.145 1.00 0.00 H ATOM 711 HG3 ARG A 44 23.237 -5.724 18.581 1.00 0.00 H ATOM 712 HD2 ARG A 44 24.521 -3.934 20.669 1.00 0.00 H ATOM 713 HD3 ARG A 44 25.231 -4.368 19.096 1.00 0.00 H ATOM 714 HE ARG A 44 24.452 -6.722 20.621 1.00 0.00 H ATOM 715 HH12 ARG A 44 28.229 -5.213 20.943 1.00 0.00 H ATOM 716 HH11 ARG A 44 26.914 -4.186 20.264 1.00 0.00 H ATOM 717 HH22 ARG A 44 27.768 -7.374 21.615 1.00 0.00 H ATOM 718 HH21 ARG A 44 26.095 -8.024 21.457 1.00 0.00 H ATOM 719 H ARG A 44 21.507 -1.758 17.570 1.00 0.00 H ATOM 720 N LYS A 45 19.672 -3.471 19.846 1.00 11.57 N ATOM 721 CA LYS A 45 18.692 -3.913 20.846 1.00 11.14 C ATOM 722 C LYS A 45 17.465 -4.541 20.207 1.00 10.47 C ATOM 723 O LYS A 45 16.963 -5.559 20.677 1.00 11.75 O ATOM 724 CB LYS A 45 18.260 -2.780 21.780 1.00 12.70 C ATOM 725 CG LYS A 45 17.511 -3.281 23.005 1.00 18.34 C ATOM 726 CD LYS A 45 17.315 -2.184 24.041 1.00 21.71 C ATOM 727 CE LYS A 45 18.615 -1.832 24.751 1.00 23.91 C ATOM 728 NZ LYS A 45 18.905 -2.742 25.896 1.00 25.24 N ATOM 729 HA LYS A 45 19.202 -4.672 21.440 1.00 0.00 H ATOM 730 HB2 LYS A 45 19.149 -2.242 22.110 1.00 0.00 H ATOM 731 HB3 LYS A 45 17.610 -2.101 21.228 1.00 0.00 H ATOM 732 HG2 LYS A 45 16.534 -3.650 22.694 1.00 0.00 H ATOM 733 HG3 LYS A 45 18.079 -4.095 23.457 1.00 0.00 H ATOM 734 HD2 LYS A 45 16.933 -1.293 23.543 1.00 0.00 H ATOM 735 HD3 LYS A 45 16.590 -2.524 24.781 1.00 0.00 H ATOM 736 HE2 LYS A 45 18.544 -0.811 25.125 1.00 0.00 H ATOM 737 HE3 LYS A 45 19.434 -1.899 24.035 1.00 0.00 H ATOM 738 HZ1 LYS A 45 18.133 -2.680 26.590 1.00 0.00 H ATOM 739 HZ2 LYS A 45 18.983 -3.719 25.549 1.00 0.00 H ATOM 740 HZ3 LYS A 45 19.800 -2.459 26.344 1.00 0.00 H ATOM 741 H LYS A 45 19.902 -2.462 19.748 1.00 0.00 H ATOM 742 N THR A 46 16.981 -3.929 19.134 1.00 9.80 N ATOM 743 CA THR A 46 15.863 -4.481 18.400 1.00 8.76 C ATOM 744 C THR A 46 16.236 -5.826 17.787 1.00 8.82 C ATOM 745 O THR A 46 15.446 -6.781 17.835 1.00 9.95 O ATOM 746 CB THR A 46 15.366 -3.493 17.333 1.00 8.83 C ATOM 747 OG1 THR A 46 14.816 -2.348 17.994 1.00 13.50 O ATOM 748 CG2 THR A 46 14.288 -4.124 16.453 1.00 10.75 C ATOM 749 HA THR A 46 15.042 -4.649 19.097 1.00 0.00 H ATOM 750 HB THR A 46 16.206 -3.212 16.697 1.00 0.00 H ATOM 751 HG1 THR A 46 15.515 -1.922 18.550 1.00 0.00 H ATOM 752 HG23 THR A 46 14.699 -4.997 15.946 1.00 0.00 H ATOM 753 HG21 THR A 46 13.445 -4.427 17.074 1.00 0.00 H ATOM 754 HG22 THR A 46 13.953 -3.397 15.713 1.00 0.00 H ATOM 755 H THR A 46 17.412 -3.038 18.815 1.00 0.00 H ATOM 756 N PHE A 47 17.443 -5.921 17.228 1.00 9.04 N ATOM 757 CA PHE A 47 17.886 -7.206 16.714 1.00 8.99 C ATOM 758 C PHE A 47 17.892 -8.281 17.804 1.00 9.62 C ATOM 759 O PHE A 47 17.425 -9.393 17.584 1.00 9.71 O ATOM 760 CB PHE A 47 19.260 -7.154 16.034 1.00 10.39 C ATOM 761 CG PHE A 47 19.736 -8.515 15.629 1.00 10.93 C ATOM 762 CD1 PHE A 47 19.182 -9.136 14.528 1.00 13.04 C ATOM 763 CD2 PHE A 47 20.640 -9.221 16.411 1.00 14.11 C ATOM 764 CE1 PHE A 47 19.556 -10.422 14.169 1.00 14.29 C ATOM 765 CE2 PHE A 47 21.024 -10.513 16.056 1.00 14.87 C ATOM 766 CZ PHE A 47 20.484 -11.106 14.934 1.00 14.89 C ATOM 767 HA PHE A 47 17.156 -7.471 15.950 1.00 0.00 H ATOM 768 HB2 PHE A 47 19.190 -6.526 15.146 1.00 0.00 H ATOM 769 HB3 PHE A 47 19.980 -6.721 16.728 1.00 0.00 H ATOM 770 HD2 PHE A 47 21.053 -8.762 17.309 1.00 0.00 H ATOM 771 HE2 PHE A 47 21.750 -11.054 16.664 1.00 0.00 H ATOM 772 HZ PHE A 47 20.788 -12.113 14.650 1.00 0.00 H ATOM 773 HE1 PHE A 47 19.121 -10.892 13.287 1.00 0.00 H ATOM 774 HD1 PHE A 47 18.439 -8.607 13.931 1.00 0.00 H ATOM 775 H PHE A 47 18.059 -5.086 17.161 1.00 0.00 H ATOM 776 N GLU A 48 18.426 -7.949 18.975 1.00 9.67 N ATOM 777 CA GLU A 48 18.503 -8.938 20.052 1.00 10.49 C ATOM 778 C GLU A 48 17.098 -9.328 20.540 1.00 11.47 C ATOM 779 O GLU A 48 16.880 -10.464 20.970 1.00 11.92 O ATOM 780 CB GLU A 48 19.387 -8.434 21.198 1.00 9.95 C ATOM 781 CG GLU A 48 20.855 -8.317 20.790 1.00 11.73 C ATOM 782 CD GLU A 48 21.742 -7.812 21.913 1.00 12.36 C ATOM 783 OE1 GLU A 48 21.222 -7.548 23.020 1.00 15.59 O ATOM 784 OE2 GLU A 48 22.966 -7.690 21.690 1.00 13.20 O ATOM 785 HA GLU A 48 18.971 -9.839 19.656 1.00 0.00 H ATOM 786 HB2 GLU A 48 19.030 -7.453 21.510 1.00 0.00 H ATOM 787 HB3 GLU A 48 19.309 -9.130 22.033 1.00 0.00 H ATOM 788 HG2 GLU A 48 21.210 -9.300 20.482 1.00 0.00 H ATOM 789 HG3 GLU A 48 20.929 -7.626 19.951 1.00 0.00 H ATOM 790 H GLU A 48 18.789 -6.986 19.126 1.00 0.00 H ATOM 791 N SER A 49 16.130 -8.428 20.373 1.00 12.31 N ATOM 792 CA SER A 49 14.720 -8.758 20.636 1.00 13.23 C ATOM 793 C SER A 49 14.114 -9.769 19.650 1.00 13.21 C ATOM 794 O SER A 49 13.427 -10.706 20.062 1.00 13.97 O ATOM 795 CB SER A 49 13.862 -7.489 20.705 1.00 13.37 C ATOM 796 OG SER A 49 12.678 -7.721 21.448 1.00 17.18 O ATOM 797 HA SER A 49 14.715 -9.252 21.608 1.00 0.00 H ATOM 798 HB2 SER A 49 13.595 -7.182 19.694 1.00 0.00 H ATOM 799 HB3 SER A 49 14.435 -6.695 21.184 1.00 0.00 H ATOM 800 HG SER A 49 12.916 -7.996 22.369 1.00 0.00 H ATOM 801 H SER A 49 16.376 -7.471 20.050 1.00 0.00 H ATOM 802 N ILE A 50 14.360 -9.592 18.355 1.00 12.14 N ATOM 803 CA ILE A 50 13.854 -10.547 17.368 1.00 12.69 C ATOM 804 C ILE A 50 14.675 -11.836 17.351 1.00 12.88 C ATOM 805 O ILE A 50 14.199 -12.879 16.892 1.00 13.21 O ATOM 806 CB ILE A 50 13.717 -9.938 15.950 1.00 12.78 C ATOM 807 CG1 ILE A 50 15.083 -9.556 15.380 1.00 12.09 C ATOM 808 CG2 ILE A 50 12.785 -8.733 15.972 1.00 13.44 C ATOM 809 CD1 ILE A 50 15.068 -9.240 13.887 1.00 13.34 C ATOM 810 HA ILE A 50 12.844 -10.804 17.688 1.00 0.00 H ATOM 811 HB ILE A 50 13.283 -10.696 15.298 1.00 0.00 H ATOM 812 HG12 ILE A 50 15.443 -8.676 15.913 1.00 0.00 H ATOM 813 HG13 ILE A 50 15.769 -10.386 15.548 1.00 0.00 H ATOM 814 HD11 ILE A 50 14.722 -10.114 13.335 1.00 0.00 H ATOM 815 HD12 ILE A 50 14.396 -8.402 13.701 1.00 0.00 H ATOM 816 HD13 ILE A 50 16.075 -8.979 13.562 1.00 0.00 H ATOM 817 HG21 ILE A 50 11.800 -9.043 16.320 1.00 0.00 H ATOM 818 HG22 ILE A 50 13.188 -7.976 16.645 1.00 0.00 H ATOM 819 HG23 ILE A 50 12.703 -8.320 14.966 1.00 0.00 H ATOM 820 H ILE A 50 14.915 -8.770 18.042 1.00 0.00 H ATOM 821 N GLY A 51 15.902 -11.762 17.865 1.00 12.62 N ATOM 822 CA GLY A 51 16.711 -12.965 18.075 1.00 13.42 C ATOM 823 C GLY A 51 17.415 -13.438 16.820 1.00 14.89 C ATOM 824 O GLY A 51 18.609 -13.690 16.844 1.00 15.58 O ATOM 825 HA3 GLY A 51 16.059 -13.764 18.429 1.00 0.00 H ATOM 826 HA2 GLY A 51 17.463 -12.749 18.834 1.00 0.00 H ATOM 827 H GLY A 51 16.293 -10.833 18.122 1.00 0.00 H ATOM 828 N LYS A 52 16.676 -13.574 15.721 1.00 17.92 N ATOM 829 CA LYS A 52 17.261 -14.008 14.450 1.00 19.22 C ATOM 830 C LYS A 52 16.762 -13.124 13.312 1.00 17.55 C ATOM 831 O LYS A 52 15.704 -12.500 13.433 1.00 18.21 O ATOM 832 CB LYS A 52 16.929 -15.474 14.167 1.00 21.73 C ATOM 833 CG LYS A 52 15.465 -15.838 14.347 1.00 23.90 C ATOM 834 CD LYS A 52 15.280 -17.355 14.338 1.00 29.51 C ATOM 835 CE LYS A 52 14.071 -17.764 15.163 1.00 32.72 C ATOM 836 NZ LYS A 52 13.581 -19.127 14.802 1.00 35.71 N ATOM 837 HA LYS A 52 18.344 -13.913 14.523 1.00 0.00 H ATOM 838 HB2 LYS A 52 17.210 -15.694 13.137 1.00 0.00 H ATOM 839 HB3 LYS A 52 17.519 -16.093 14.843 1.00 0.00 H ATOM 840 HG2 LYS A 52 15.111 -15.440 15.298 1.00 0.00 H ATOM 841 HG3 LYS A 52 14.885 -15.402 13.534 1.00 0.00 H ATOM 842 HD2 LYS A 52 15.140 -17.691 13.310 1.00 0.00 H ATOM 843 HD3 LYS A 52 16.171 -17.825 14.754 1.00 0.00 H ATOM 844 HE2 LYS A 52 13.269 -17.045 14.993 1.00 0.00 H ATOM 845 HE3 LYS A 52 14.346 -17.757 16.218 1.00 0.00 H ATOM 846 HZ1 LYS A 52 13.309 -19.142 13.798 1.00 0.00 H ATOM 847 HZ2 LYS A 52 14.337 -19.821 14.968 1.00 0.00 H ATOM 848 HZ3 LYS A 52 12.756 -19.364 15.389 1.00 0.00 H ATOM 849 H LYS A 52 15.658 -13.367 15.766 1.00 0.00 H ATOM 850 N PRO A 53 17.521 -13.055 12.207 1.00 17.68 N ATOM 851 CA PRO A 53 17.044 -12.233 11.103 1.00 17.34 C ATOM 852 C PRO A 53 15.680 -12.707 10.612 1.00 16.26 C ATOM 853 O PRO A 53 15.374 -13.906 10.647 1.00 16.39 O ATOM 854 CB PRO A 53 18.107 -12.434 10.014 1.00 18.44 C ATOM 855 CG PRO A 53 18.872 -13.651 10.423 1.00 19.86 C ATOM 856 CD PRO A 53 18.821 -13.686 11.913 1.00 18.33 C ATOM 857 HA PRO A 53 16.914 -11.189 11.387 1.00 0.00 H ATOM 858 HD3 PRO A 53 18.854 -14.710 12.284 1.00 0.00 H ATOM 859 HD2 PRO A 53 19.642 -13.117 12.348 1.00 0.00 H ATOM 860 HG3 PRO A 53 19.905 -13.583 10.080 1.00 0.00 H ATOM 861 HG2 PRO A 53 18.411 -14.547 10.007 1.00 0.00 H ATOM 862 HB2 PRO A 53 17.635 -12.589 9.044 1.00 0.00 H ATOM 863 HB3 PRO A 53 18.767 -11.568 9.961 1.00 0.00 H ATOM 864 N LEU A 54 14.864 -11.763 10.164 1.00 15.14 N ATOM 865 CA LEU A 54 13.592 -12.106 9.554 1.00 15.95 C ATOM 866 C LEU A 54 13.855 -12.679 8.173 1.00 15.99 C ATOM 867 O LEU A 54 14.653 -12.131 7.412 1.00 16.10 O ATOM 868 CB LEU A 54 12.687 -10.877 9.483 1.00 15.60 C ATOM 869 CG LEU A 54 12.176 -10.416 10.853 1.00 17.97 C ATOM 870 CD1 LEU A 54 11.385 -9.117 10.747 1.00 20.86 C ATOM 871 CD2 LEU A 54 11.343 -11.497 11.539 1.00 22.56 C ATOM 872 HA LEU A 54 13.077 -12.853 10.158 1.00 0.00 H ATOM 873 HB2 LEU A 54 13.249 -10.060 9.031 1.00 0.00 H ATOM 874 HB3 LEU A 54 11.828 -11.116 8.856 1.00 0.00 H ATOM 875 HG LEU A 54 13.054 -10.228 11.471 1.00 0.00 H ATOM 876 HD21 LEU A 54 10.483 -11.741 10.916 1.00 0.00 H ATOM 877 HD22 LEU A 54 11.954 -12.388 11.682 1.00 0.00 H ATOM 878 HD23 LEU A 54 11.000 -11.130 12.507 1.00 0.00 H ATOM 879 HD11 LEU A 54 12.025 -8.336 10.336 1.00 0.00 H ATOM 880 HD12 LEU A 54 10.527 -9.268 10.091 1.00 0.00 H ATOM 881 HD13 LEU A 54 11.039 -8.822 11.738 1.00 0.00 H ATOM 882 H LEU A 54 15.139 -10.764 10.251 1.00 0.00 H ATOM 883 N PRO A 55 13.208 -13.805 7.850 1.00 16.50 N ATOM 884 CA PRO A 55 13.552 -14.476 6.603 1.00 16.19 C ATOM 885 C PRO A 55 13.156 -13.709 5.334 1.00 15.78 C ATOM 886 O PRO A 55 12.240 -12.880 5.352 1.00 15.11 O ATOM 887 CB PRO A 55 12.804 -15.817 6.700 1.00 16.67 C ATOM 888 CG PRO A 55 11.680 -15.569 7.660 1.00 19.09 C ATOM 889 CD PRO A 55 12.157 -14.510 8.611 1.00 17.29 C ATOM 890 HA PRO A 55 14.633 -14.574 6.502 1.00 0.00 H ATOM 891 HD3 PRO A 55 11.346 -13.831 8.876 1.00 0.00 H ATOM 892 HD2 PRO A 55 12.566 -14.956 9.517 1.00 0.00 H ATOM 893 HG3 PRO A 55 11.440 -16.483 8.203 1.00 0.00 H ATOM 894 HG2 PRO A 55 10.796 -15.224 7.124 1.00 0.00 H ATOM 895 HB2 PRO A 55 12.417 -16.111 5.724 1.00 0.00 H ATOM 896 HB3 PRO A 55 13.465 -16.598 7.077 1.00 0.00 H ATOM 897 N ASN A 56 13.844 -14.007 4.234 1.00 16.84 N ATOM 898 CA ASN A 56 13.448 -13.534 2.908 1.00 17.10 C ATOM 899 C ASN A 56 13.608 -12.029 2.715 1.00 16.44 C ATOM 900 O ASN A 56 12.952 -11.428 1.863 1.00 17.32 O ATOM 901 CB ASN A 56 12.002 -13.942 2.580 1.00 17.94 C ATOM 902 CG ASN A 56 11.735 -15.408 2.826 1.00 22.07 C ATOM 903 OD1 ASN A 56 10.766 -15.774 3.497 1.00 26.75 O ATOM 904 ND2 ASN A 56 12.588 -16.257 2.275 1.00 24.04 N ATOM 905 HA ASN A 56 14.137 -14.019 2.216 1.00 0.00 H ATOM 906 HB2 ASN A 56 11.325 -13.356 3.202 1.00 0.00 H ATOM 907 HB3 ASN A 56 11.809 -13.724 1.530 1.00 0.00 H ATOM 908 HD22 ASN A 56 13.390 -15.900 1.718 1.00 0.00 H ATOM 909 HD21 ASN A 56 12.456 -17.281 2.399 1.00 0.00 H ATOM 910 H ASN A 56 14.695 -14.598 4.321 1.00 0.00 H ATOM 911 N ARG A 57 14.481 -11.418 3.510 1.00 15.21 N ATOM 912 CA ARG A 57 14.840 -10.020 3.296 1.00 14.97 C ATOM 913 C ARG A 57 16.216 -9.751 3.866 1.00 14.70 C ATOM 914 O ARG A 57 16.739 -10.545 4.645 1.00 15.22 O ATOM 915 CB ARG A 57 13.807 -9.086 3.938 1.00 14.81 C ATOM 916 CG ARG A 57 13.796 -9.104 5.455 1.00 12.65 C ATOM 917 CD ARG A 57 12.379 -8.904 5.961 1.00 14.06 C ATOM 918 NE ARG A 57 11.695 -10.183 6.052 1.00 15.01 N ATOM 919 CZ ARG A 57 10.565 -10.390 6.717 1.00 15.55 C ATOM 920 NH1 ARG A 57 9.948 -9.382 7.322 1.00 16.35 N ATOM 921 NH2 ARG A 57 10.053 -11.612 6.770 1.00 16.17 N ATOM 922 HA ARG A 57 14.852 -9.825 2.224 1.00 0.00 H ATOM 923 HB2 ARG A 57 14.019 -8.068 3.611 1.00 0.00 H ATOM 924 HB3 ARG A 57 12.818 -9.380 3.587 1.00 0.00 H ATOM 925 HG2 ARG A 57 14.175 -10.063 5.809 1.00 0.00 H ATOM 926 HG3 ARG A 57 14.432 -8.302 5.831 1.00 0.00 H ATOM 927 HD2 ARG A 57 11.839 -8.254 5.273 1.00 0.00 H ATOM 928 HD3 ARG A 57 12.410 -8.441 6.947 1.00 0.00 H ATOM 929 HE ARG A 57 12.122 -10.994 5.561 1.00 0.00 H ATOM 930 HH12 ARG A 57 9.063 -9.551 7.841 1.00 0.00 H ATOM 931 HH11 ARG A 57 10.350 -8.424 7.276 1.00 0.00 H ATOM 932 HH22 ARG A 57 9.168 -11.783 7.289 1.00 0.00 H ATOM 933 HH21 ARG A 57 10.536 -12.399 6.293 1.00 0.00 H ATOM 934 H ARG A 57 14.914 -11.944 4.296 1.00 0.00 H ATOM 935 N ARG A 58 16.801 -8.623 3.483 1.00 14.36 N ATOM 936 CA ARG A 58 18.107 -8.259 4.012 1.00 13.91 C ATOM 937 C ARG A 58 17.934 -7.658 5.401 1.00 13.04 C ATOM 938 O ARG A 58 17.136 -6.736 5.591 1.00 14.79 O ATOM 939 CB ARG A 58 18.810 -7.275 3.082 1.00 14.91 C ATOM 940 CG ARG A 58 20.250 -7.003 3.471 1.00 15.42 C ATOM 941 CD ARG A 58 20.868 -5.946 2.582 1.00 17.53 C ATOM 942 NE ARG A 58 22.310 -5.860 2.777 1.00 19.99 N ATOM 943 CZ ARG A 58 23.114 -5.069 2.072 1.00 22.63 C ATOM 944 NH1 ARG A 58 22.618 -4.288 1.122 1.00 23.45 N ATOM 945 NH2 ARG A 58 24.417 -5.057 2.322 1.00 25.87 N ATOM 946 HA ARG A 58 18.729 -9.151 4.081 1.00 0.00 H ATOM 947 HB2 ARG A 58 18.796 -7.684 2.072 1.00 0.00 H ATOM 948 HB3 ARG A 58 18.263 -6.332 3.099 1.00 0.00 H ATOM 949 HG2 ARG A 58 20.280 -6.660 4.505 1.00 0.00 H ATOM 950 HG3 ARG A 58 20.824 -7.925 3.379 1.00 0.00 H ATOM 951 HD2 ARG A 58 20.420 -4.980 2.816 1.00 0.00 H ATOM 952 HD3 ARG A 58 20.665 -6.196 1.541 1.00 0.00 H ATOM 953 HE ARG A 58 22.738 -6.455 3.515 1.00 0.00 H ATOM 954 HH12 ARG A 58 23.250 -3.671 0.573 1.00 0.00 H ATOM 955 HH11 ARG A 58 21.597 -4.292 0.926 1.00 0.00 H ATOM 956 HH22 ARG A 58 25.046 -4.439 1.771 1.00 0.00 H ATOM 957 HH21 ARG A 58 24.809 -5.666 3.069 1.00 0.00 H ATOM 958 H ARG A 58 16.325 -7.997 2.803 1.00 0.00 H ATOM 959 N ASN A 59 18.668 -8.194 6.368 1.00 13.61 N ATOM 960 CA ASN A 59 18.667 -7.669 7.724 1.00 12.71 C ATOM 961 C ASN A 59 19.980 -6.968 8.007 1.00 13.13 C ATOM 962 O ASN A 59 21.043 -7.583 7.916 1.00 14.74 O ATOM 963 CB ASN A 59 18.474 -8.796 8.736 1.00 13.95 C ATOM 964 CG ASN A 59 17.079 -9.393 8.695 1.00 14.62 C ATOM 965 OD1 ASN A 59 16.314 -9.251 9.646 1.00 14.93 O ATOM 966 ND2 ASN A 59 16.743 -10.073 7.596 1.00 17.22 N ATOM 967 HA ASN A 59 17.843 -6.961 7.816 1.00 0.00 H ATOM 968 HB2 ASN A 59 19.196 -9.584 8.522 1.00 0.00 H ATOM 969 HB3 ASN A 59 18.655 -8.401 9.736 1.00 0.00 H ATOM 970 HD22 ASN A 59 17.423 -10.168 6.815 1.00 0.00 H ATOM 971 HD21 ASN A 59 15.801 -10.508 7.521 1.00 0.00 H ATOM 972 H ASN A 59 19.264 -9.017 6.149 1.00 0.00 H ATOM 973 N VAL A 60 19.891 -5.687 8.348 1.00 11.66 N ATOM 974 CA VAL A 60 21.051 -4.850 8.614 1.00 12.15 C ATOM 975 C VAL A 60 20.962 -4.319 10.044 1.00 10.47 C ATOM 976 O VAL A 60 19.944 -3.729 10.436 1.00 10.11 O ATOM 977 CB VAL A 60 21.117 -3.657 7.634 1.00 13.22 C ATOM 978 CG1 VAL A 60 22.312 -2.759 7.957 1.00 13.27 C ATOM 979 CG2 VAL A 60 21.180 -4.149 6.180 1.00 14.31 C ATOM 980 HA VAL A 60 21.950 -5.452 8.483 1.00 0.00 H ATOM 981 HB VAL A 60 20.208 -3.068 7.752 1.00 0.00 H ATOM 982 HG11 VAL A 60 22.213 -2.377 8.973 1.00 0.00 H ATOM 983 HG12 VAL A 60 23.232 -3.337 7.873 1.00 0.00 H ATOM 984 HG13 VAL A 60 22.339 -1.926 7.255 1.00 0.00 H ATOM 985 HG21 VAL A 60 22.069 -4.766 6.045 1.00 0.00 H ATOM 986 HG22 VAL A 60 20.290 -4.738 5.958 1.00 0.00 H ATOM 987 HG23 VAL A 60 21.226 -3.291 5.509 1.00 0.00 H ATOM 988 H VAL A 60 18.945 -5.262 8.429 1.00 0.00 H ATOM 989 N VAL A 61 22.017 -4.553 10.824 1.00 10.61 N ATOM 990 CA VAL A 61 22.106 -4.060 12.191 1.00 10.84 C ATOM 991 C VAL A 61 23.078 -2.906 12.294 1.00 11.73 C ATOM 992 O VAL A 61 24.219 -3.010 11.841 1.00 13.59 O ATOM 993 CB VAL A 61 22.527 -5.166 13.166 1.00 11.61 C ATOM 994 CG1 VAL A 61 22.736 -4.582 14.562 1.00 14.51 C ATOM 995 CG2 VAL A 61 21.464 -6.249 13.197 1.00 14.55 C ATOM 996 HA VAL A 61 21.109 -3.714 12.465 1.00 0.00 H ATOM 997 HB VAL A 61 23.467 -5.604 12.831 1.00 0.00 H ATOM 998 HG11 VAL A 61 23.516 -3.822 14.523 1.00 0.00 H ATOM 999 HG12 VAL A 61 21.806 -4.132 14.909 1.00 0.00 H ATOM 1000 HG13 VAL A 61 23.035 -5.377 15.246 1.00 0.00 H ATOM 1001 HG21 VAL A 61 20.518 -5.818 13.524 1.00 0.00 H ATOM 1002 HG22 VAL A 61 21.347 -6.670 12.199 1.00 0.00 H ATOM 1003 HG23 VAL A 61 21.766 -7.033 13.891 1.00 0.00 H ATOM 1004 H VAL A 61 22.808 -5.110 10.441 1.00 0.00 H ATOM 1005 N LEU A 62 22.611 -1.813 12.885 1.00 12.43 N ATOM 1006 CA LEU A 62 23.439 -0.632 13.120 1.00 13.95 C ATOM 1007 C LEU A 62 23.883 -0.602 14.572 1.00 14.88 C ATOM 1008 O LEU A 62 23.052 -0.553 15.483 1.00 16.22 O ATOM 1009 CB LEU A 62 22.657 0.645 12.784 1.00 14.47 C ATOM 1010 CG LEU A 62 23.319 1.958 13.206 1.00 14.92 C ATOM 1011 CD1 LEU A 62 24.587 2.191 12.377 1.00 17.02 C ATOM 1012 CD2 LEU A 62 22.347 3.107 13.033 1.00 20.17 C ATOM 1013 HA LEU A 62 24.316 -0.681 12.475 1.00 0.00 H ATOM 1014 HB2 LEU A 62 22.512 0.675 11.704 1.00 0.00 H ATOM 1015 HB3 LEU A 62 21.687 0.584 13.278 1.00 0.00 H ATOM 1016 HG LEU A 62 23.598 1.899 14.258 1.00 0.00 H ATOM 1017 HD21 LEU A 62 22.049 3.175 11.987 1.00 0.00 H ATOM 1018 HD22 LEU A 62 21.467 2.933 13.652 1.00 0.00 H ATOM 1019 HD23 LEU A 62 22.828 4.037 13.336 1.00 0.00 H ATOM 1020 HD11 LEU A 62 25.282 1.368 12.540 1.00 0.00 H ATOM 1021 HD12 LEU A 62 24.324 2.243 11.320 1.00 0.00 H ATOM 1022 HD13 LEU A 62 25.053 3.128 12.683 1.00 0.00 H ATOM 1023 H LEU A 62 21.618 -1.797 13.193 1.00 0.00 H ATOM 1024 N THR A 63 25.194 -0.633 14.791 1.00 14.93 N ATOM 1025 CA THR A 63 25.747 -0.644 16.138 1.00 16.11 C ATOM 1026 C THR A 63 27.129 -0.011 16.116 1.00 16.61 C ATOM 1027 O THR A 63 27.852 -0.116 15.126 1.00 15.98 O ATOM 1028 CB THR A 63 25.857 -2.088 16.714 1.00 16.00 C ATOM 1029 OG1 THR A 63 26.521 -2.049 17.984 1.00 17.75 O ATOM 1030 CG2 THR A 63 26.649 -3.006 15.780 1.00 15.63 C ATOM 1031 HA THR A 63 25.072 -0.078 16.780 1.00 0.00 H ATOM 1032 HB THR A 63 24.846 -2.481 16.818 1.00 0.00 H ATOM 1033 HG1 THR A 63 26.002 -1.483 18.609 1.00 0.00 H ATOM 1034 HG23 THR A 63 26.156 -3.046 14.809 1.00 0.00 H ATOM 1035 HG21 THR A 63 27.660 -2.616 15.660 1.00 0.00 H ATOM 1036 HG22 THR A 63 26.693 -4.007 16.208 1.00 0.00 H ATOM 1037 H THR A 63 25.842 -0.650 13.978 1.00 0.00 H ATOM 1038 N SER A 64 27.496 0.630 17.218 1.00 18.39 N ATOM 1039 CA SER A 64 28.833 1.194 17.338 1.00 19.30 C ATOM 1040 C SER A 64 29.906 0.154 17.655 1.00 19.29 C ATOM 1041 O SER A 64 31.099 0.431 17.516 1.00 19.79 O ATOM 1042 CB SER A 64 28.855 2.316 18.381 1.00 20.23 C ATOM 1043 OG SER A 64 28.449 1.839 19.652 1.00 25.84 O ATOM 1044 HA SER A 64 29.078 1.603 16.358 1.00 0.00 H ATOM 1045 HB2 SER A 64 28.178 3.109 18.065 1.00 0.00 H ATOM 1046 HB3 SER A 64 29.867 2.713 18.456 1.00 0.00 H ATOM 1047 HG SER A 64 28.472 2.583 20.305 1.00 0.00 H ATOM 1048 H SER A 64 26.822 0.731 18.004 1.00 0.00 H ATOM 1049 N ASP A 65 29.482 -1.033 18.091 1.00 18.73 N ATOM 1050 CA ASP A 65 30.400 -2.109 18.468 1.00 19.49 C ATOM 1051 C ASP A 65 30.998 -2.767 17.222 1.00 19.92 C ATOM 1052 O ASP A 65 30.312 -3.491 16.502 1.00 19.33 O ATOM 1053 CB ASP A 65 29.646 -3.152 19.313 1.00 19.47 C ATOM 1054 CG ASP A 65 30.540 -4.289 19.793 1.00 22.18 C ATOM 1055 OD1 ASP A 65 31.757 -4.260 19.526 1.00 24.11 O ATOM 1056 OD2 ASP A 65 30.022 -5.228 20.443 1.00 22.70 O ATOM 1057 HA ASP A 65 31.217 -1.690 19.056 1.00 0.00 H ATOM 1058 HB2 ASP A 65 29.221 -2.653 20.184 1.00 0.00 H ATOM 1059 HB3 ASP A 65 28.842 -3.573 18.709 1.00 0.00 H ATOM 1060 H ASP A 65 28.458 -1.201 18.166 1.00 0.00 H ATOM 1061 N THR A 66 32.282 -2.512 16.967 1.00 22.11 N ATOM 1062 CA THR A 66 32.942 -3.061 15.783 1.00 24.20 C ATOM 1063 C THR A 66 33.231 -4.556 15.923 1.00 25.96 C ATOM 1064 O THR A 66 33.654 -5.206 14.965 1.00 27.82 O ATOM 1065 CB THR A 66 34.250 -2.302 15.436 1.00 24.29 C ATOM 1066 OG1 THR A 66 35.141 -2.333 16.558 1.00 25.66 O ATOM 1067 CG2 THR A 66 33.948 -0.861 15.067 1.00 24.50 C ATOM 1068 HA THR A 66 32.238 -2.924 14.962 1.00 0.00 H ATOM 1069 HB THR A 66 34.720 -2.792 14.583 1.00 0.00 H ATOM 1070 HG1 THR A 66 35.973 -1.847 16.331 1.00 0.00 H ATOM 1071 HG23 THR A 66 33.270 -0.840 14.214 1.00 0.00 H ATOM 1072 HG21 THR A 66 33.481 -0.360 15.915 1.00 0.00 H ATOM 1073 HG22 THR A 66 34.876 -0.351 14.808 1.00 0.00 H ATOM 1074 H THR A 66 32.823 -1.912 17.622 1.00 0.00 H ATOM 1075 N SER A 67 32.979 -5.094 17.114 1.00 25.79 N ATOM 1076 CA SER A 67 33.211 -6.513 17.394 1.00 26.66 C ATOM 1077 C SER A 67 31.948 -7.353 17.202 1.00 26.47 C ATOM 1078 O SER A 67 31.943 -8.549 17.493 1.00 26.51 O ATOM 1079 CB SER A 67 33.773 -6.704 18.809 1.00 27.39 C ATOM 1080 OG SER A 67 32.758 -6.621 19.801 1.00 27.95 O ATOM 1081 HA SER A 67 33.948 -6.865 16.672 1.00 0.00 H ATOM 1082 HB2 SER A 67 34.516 -5.930 19.000 1.00 0.00 H ATOM 1083 HB3 SER A 67 34.246 -7.684 18.871 1.00 0.00 H ATOM 1084 HG SER A 67 32.327 -5.731 19.757 1.00 0.00 H ATOM 1085 H SER A 67 32.605 -4.487 17.871 1.00 0.00 H ATOM 1086 N PHE A 68 30.886 -6.727 16.701 1.00 25.61 N ATOM 1087 CA PHE A 68 29.589 -7.389 16.579 1.00 24.29 C ATOM 1088 C PHE A 68 29.423 -8.035 15.205 1.00 24.65 C ATOM 1089 O PHE A 68 29.572 -7.372 14.185 1.00 24.64 O ATOM 1090 CB PHE A 68 28.457 -6.385 16.833 1.00 23.69 C ATOM 1091 CG PHE A 68 27.086 -6.995 16.774 1.00 23.22 C ATOM 1092 CD1 PHE A 68 26.558 -7.645 17.879 1.00 24.32 C ATOM 1093 CD2 PHE A 68 26.330 -6.924 15.616 1.00 20.25 C ATOM 1094 CE1 PHE A 68 25.295 -8.220 17.828 1.00 23.23 C ATOM 1095 CE2 PHE A 68 25.062 -7.499 15.559 1.00 22.03 C ATOM 1096 CZ PHE A 68 24.549 -8.139 16.669 1.00 21.57 C ATOM 1097 HA PHE A 68 29.542 -8.178 17.329 1.00 0.00 H ATOM 1098 HB2 PHE A 68 28.598 -5.949 17.822 1.00 0.00 H ATOM 1099 HB3 PHE A 68 28.517 -5.600 16.080 1.00 0.00 H ATOM 1100 HD2 PHE A 68 26.731 -6.413 14.740 1.00 0.00 H ATOM 1101 HE2 PHE A 68 24.477 -7.444 14.641 1.00 0.00 H ATOM 1102 HZ PHE A 68 23.553 -8.581 16.631 1.00 0.00 H ATOM 1103 HE1 PHE A 68 24.893 -8.734 18.701 1.00 0.00 H ATOM 1104 HD1 PHE A 68 27.141 -7.705 18.798 1.00 0.00 H ATOM 1105 H PHE A 68 30.982 -5.740 16.388 1.00 0.00 H ATOM 1106 N ASN A 69 29.121 -9.333 15.180 1.00 24.03 N ATOM 1107 CA ASN A 69 28.869 -10.030 13.922 1.00 25.24 C ATOM 1108 C ASN A 69 27.903 -11.196 14.099 1.00 24.68 C ATOM 1109 O ASN A 69 27.959 -11.897 15.105 1.00 26.61 O ATOM 1110 CB ASN A 69 30.187 -10.500 13.291 1.00 27.03 C ATOM 1111 CG ASN A 69 30.054 -11.824 12.562 1.00 30.91 C ATOM 1112 OD1 ASN A 69 30.118 -12.892 13.174 1.00 35.17 O ATOM 1113 ND2 ASN A 69 29.883 -11.762 11.244 1.00 34.40 N ATOM 1114 HA ASN A 69 28.394 -9.320 13.245 1.00 0.00 H ATOM 1115 HB2 ASN A 69 30.522 -9.744 12.581 1.00 0.00 H ATOM 1116 HB3 ASN A 69 30.931 -10.610 14.080 1.00 0.00 H ATOM 1117 HD22 ASN A 69 29.835 -10.838 10.769 1.00 0.00 H ATOM 1118 HD21 ASN A 69 29.798 -12.637 10.689 1.00 0.00 H ATOM 1119 H ASN A 69 29.064 -9.860 16.075 1.00 0.00 H ATOM 1120 N VAL A 70 27.020 -11.390 13.121 1.00 23.58 N ATOM 1121 CA VAL A 70 26.008 -12.451 13.178 1.00 23.61 C ATOM 1122 C VAL A 70 25.770 -13.006 11.780 1.00 24.06 C ATOM 1123 O VAL A 70 25.510 -12.253 10.840 1.00 24.05 O ATOM 1124 CB VAL A 70 24.659 -11.924 13.745 1.00 24.07 C ATOM 1125 CG1 VAL A 70 23.582 -13.002 13.667 1.00 24.55 C ATOM 1126 CG2 VAL A 70 24.832 -11.441 15.177 1.00 24.82 C ATOM 1127 HA VAL A 70 26.382 -13.231 13.841 1.00 0.00 H ATOM 1128 HB VAL A 70 24.340 -11.079 13.135 1.00 0.00 H ATOM 1129 HG11 VAL A 70 23.437 -13.294 12.627 1.00 0.00 H ATOM 1130 HG12 VAL A 70 23.895 -13.869 14.249 1.00 0.00 H ATOM 1131 HG13 VAL A 70 22.648 -12.610 14.069 1.00 0.00 H ATOM 1132 HG21 VAL A 70 25.178 -12.267 15.798 1.00 0.00 H ATOM 1133 HG22 VAL A 70 25.565 -10.635 15.201 1.00 0.00 H ATOM 1134 HG23 VAL A 70 23.876 -11.077 15.554 1.00 0.00 H ATOM 1135 H VAL A 70 27.049 -10.768 12.288 1.00 0.00 H ATOM 1136 N GLU A 71 25.862 -14.326 11.639 1.00 25.34 N ATOM 1137 CA GLU A 71 25.599 -14.957 10.356 1.00 26.76 C ATOM 1138 C GLU A 71 24.205 -14.586 9.856 1.00 26.30 C ATOM 1139 O GLU A 71 23.228 -14.658 10.605 1.00 27.35 O ATOM 1140 CB GLU A 71 25.763 -16.479 10.455 1.00 27.79 C ATOM 1141 CG GLU A 71 25.311 -17.241 9.215 1.00 31.01 C ATOM 1142 CD GLU A 71 26.347 -17.228 8.106 1.00 34.63 C ATOM 1143 OE1 GLU A 71 27.479 -16.752 8.346 1.00 36.74 O ATOM 1144 OE2 GLU A 71 26.030 -17.696 6.992 1.00 38.07 O ATOM 1145 HA GLU A 71 26.328 -14.590 9.634 1.00 0.00 H ATOM 1146 HB2 GLU A 71 26.817 -16.699 10.626 1.00 0.00 H ATOM 1147 HB3 GLU A 71 25.178 -16.831 11.304 1.00 0.00 H ATOM 1148 HG2 GLU A 71 25.113 -18.276 9.495 1.00 0.00 H ATOM 1149 HG3 GLU A 71 24.394 -16.785 8.841 1.00 0.00 H ATOM 1150 H GLU A 71 26.125 -14.913 12.456 1.00 0.00 H ATOM 1151 N GLY A 72 24.122 -14.179 8.592 1.00 25.91 N ATOM 1152 CA GLY A 72 22.845 -13.831 7.974 1.00 25.03 C ATOM 1153 C GLY A 72 22.431 -12.390 8.206 1.00 24.13 C ATOM 1154 O GLY A 72 21.346 -11.976 7.799 1.00 24.50 O ATOM 1155 HA3 GLY A 72 22.074 -14.482 8.386 1.00 0.00 H ATOM 1156 HA2 GLY A 72 22.925 -13.998 6.900 1.00 0.00 H ATOM 1157 H GLY A 72 24.992 -14.106 8.027 1.00 0.00 H ATOM 1158 N VAL A 73 23.297 -11.625 8.865 1.00 22.50 N ATOM 1159 CA VAL A 73 23.040 -10.210 9.118 1.00 21.55 C ATOM 1160 C VAL A 73 24.205 -9.374 8.591 1.00 20.87 C ATOM 1161 O VAL A 73 25.365 -9.740 8.768 1.00 20.82 O ATOM 1162 CB VAL A 73 22.870 -9.928 10.622 1.00 22.18 C ATOM 1163 CG1 VAL A 73 22.740 -8.436 10.867 1.00 23.86 C ATOM 1164 CG2 VAL A 73 21.662 -10.672 11.183 1.00 23.77 C ATOM 1165 HA VAL A 73 22.115 -9.944 8.606 1.00 0.00 H ATOM 1166 HB VAL A 73 23.758 -10.290 11.140 1.00 0.00 H ATOM 1167 HG11 VAL A 73 23.637 -7.931 10.509 1.00 0.00 H ATOM 1168 HG12 VAL A 73 21.869 -8.056 10.333 1.00 0.00 H ATOM 1169 HG13 VAL A 73 22.621 -8.254 11.935 1.00 0.00 H ATOM 1170 HG21 VAL A 73 20.762 -10.347 10.661 1.00 0.00 H ATOM 1171 HG22 VAL A 73 21.799 -11.744 11.040 1.00 0.00 H ATOM 1172 HG23 VAL A 73 21.565 -10.455 12.247 1.00 0.00 H ATOM 1173 H VAL A 73 24.183 -12.047 9.210 1.00 0.00 H ATOM 1174 N ASP A 74 23.894 -8.265 7.932 1.00 19.62 N ATOM 1175 CA ASP A 74 24.911 -7.277 7.593 1.00 19.54 C ATOM 1176 C ASP A 74 25.003 -6.238 8.702 1.00 18.41 C ATOM 1177 O ASP A 74 23.985 -5.764 9.194 1.00 19.62 O ATOM 1178 CB ASP A 74 24.589 -6.607 6.258 1.00 21.38 C ATOM 1179 CG ASP A 74 24.686 -7.568 5.086 1.00 23.82 C ATOM 1180 OD1 ASP A 74 25.548 -8.472 5.124 1.00 26.46 O ATOM 1181 OD2 ASP A 74 23.908 -7.418 4.122 1.00 25.97 O ATOM 1182 HA ASP A 74 25.873 -7.780 7.494 1.00 0.00 H ATOM 1183 HB2 ASP A 74 23.575 -6.210 6.302 1.00 0.00 H ATOM 1184 HB3 ASP A 74 25.292 -5.789 6.099 1.00 0.00 H ATOM 1185 H ASP A 74 22.906 -8.098 7.652 1.00 0.00 H ATOM 1186 N VAL A 75 26.220 -5.889 9.100 1.00 17.23 N ATOM 1187 CA VAL A 75 26.418 -4.932 10.174 1.00 17.55 C ATOM 1188 C VAL A 75 26.977 -3.628 9.626 1.00 16.99 C ATOM 1189 O VAL A 75 27.923 -3.628 8.824 1.00 17.92 O ATOM 1190 CB VAL A 75 27.347 -5.491 11.286 1.00 17.31 C ATOM 1191 CG1 VAL A 75 27.525 -4.464 12.409 1.00 21.49 C ATOM 1192 CG2 VAL A 75 26.783 -6.792 11.845 1.00 19.97 C ATOM 1193 HA VAL A 75 25.444 -4.742 10.625 1.00 0.00 H ATOM 1194 HB VAL A 75 28.324 -5.693 10.846 1.00 0.00 H ATOM 1195 HG11 VAL A 75 27.969 -3.555 12.002 1.00 0.00 H ATOM 1196 HG12 VAL A 75 26.553 -4.232 12.844 1.00 0.00 H ATOM 1197 HG13 VAL A 75 28.179 -4.877 13.177 1.00 0.00 H ATOM 1198 HG21 VAL A 75 25.795 -6.607 12.267 1.00 0.00 H ATOM 1199 HG22 VAL A 75 26.705 -7.527 11.044 1.00 0.00 H ATOM 1200 HG23 VAL A 75 27.447 -7.170 12.623 1.00 0.00 H ATOM 1201 H VAL A 75 27.049 -6.309 8.633 1.00 0.00 H ATOM 1202 N ILE A 76 26.395 -2.515 10.057 1.00 15.53 N ATOM 1203 CA ILE A 76 26.965 -1.198 9.774 1.00 15.43 C ATOM 1204 C ILE A 76 27.205 -0.429 11.069 1.00 15.88 C ATOM 1205 O ILE A 76 26.643 -0.755 12.120 1.00 14.31 O ATOM 1206 CB ILE A 76 26.053 -0.374 8.841 1.00 14.65 C ATOM 1207 CG1 ILE A 76 24.647 -0.246 9.442 1.00 14.93 C ATOM 1208 CG2 ILE A 76 25.993 -1.006 7.462 1.00 16.80 C ATOM 1209 CD1 ILE A 76 23.741 0.713 8.699 1.00 16.39 C ATOM 1210 HA ILE A 76 27.917 -1.357 9.268 1.00 0.00 H ATOM 1211 HB ILE A 76 26.474 0.626 8.740 1.00 0.00 H ATOM 1212 HG12 ILE A 76 24.181 -1.231 9.436 1.00 0.00 H ATOM 1213 HG13 ILE A 76 24.745 0.102 10.470 1.00 0.00 H ATOM 1214 HD11 ILE A 76 24.185 1.709 8.705 1.00 0.00 H ATOM 1215 HD12 ILE A 76 23.621 0.374 7.670 1.00 0.00 H ATOM 1216 HD13 ILE A 76 22.768 0.745 9.189 1.00 0.00 H ATOM 1217 HG21 ILE A 76 26.996 -1.042 7.036 1.00 0.00 H ATOM 1218 HG22 ILE A 76 25.595 -2.017 7.544 1.00 0.00 H ATOM 1219 HG23 ILE A 76 25.345 -0.411 6.819 1.00 0.00 H ATOM 1220 H ILE A 76 25.515 -2.581 10.608 1.00 0.00 H ATOM 1221 N HIS A 77 28.043 0.599 10.994 1.00 16.92 N ATOM 1222 CA HIS A 77 28.452 1.317 12.193 1.00 17.67 C ATOM 1223 C HIS A 77 28.091 2.799 12.200 1.00 19.31 C ATOM 1224 O HIS A 77 28.249 3.470 13.217 1.00 21.17 O ATOM 1225 CB HIS A 77 29.943 1.109 12.448 1.00 17.80 C ATOM 1226 CG HIS A 77 30.336 -0.333 12.458 1.00 18.87 C ATOM 1227 ND1 HIS A 77 29.970 -1.195 13.471 1.00 21.78 N ATOM 1228 CD2 HIS A 77 31.027 -1.076 11.562 1.00 22.92 C ATOM 1229 CE1 HIS A 77 30.442 -2.400 13.209 1.00 21.28 C ATOM 1230 NE2 HIS A 77 31.087 -2.356 12.058 1.00 22.91 N ATOM 1231 HA HIS A 77 27.875 0.887 13.012 1.00 0.00 H ATOM 1232 HB2 HIS A 77 30.504 1.617 11.664 1.00 0.00 H ATOM 1233 HB3 HIS A 77 30.195 1.545 13.415 1.00 0.00 H ATOM 1234 HD2 HIS A 77 31.455 -0.725 10.623 1.00 0.00 H ATOM 1235 HE1 HIS A 77 30.320 -3.282 13.837 1.00 0.00 H ATOM 1236 H HIS A 77 28.412 0.895 10.068 1.00 0.00 H ATOM 1237 N SER A 78 27.590 3.299 11.074 1.00 19.68 N ATOM 1238 CA SER A 78 27.192 4.695 10.978 1.00 20.06 C ATOM 1239 C SER A 78 25.859 4.875 10.275 1.00 19.41 C ATOM 1240 O SER A 78 25.511 4.110 9.376 1.00 18.13 O ATOM 1241 CB SER A 78 28.261 5.516 10.259 1.00 21.01 C ATOM 1242 OG SER A 78 27.774 6.815 9.971 1.00 26.03 O ATOM 1243 HA SER A 78 27.080 5.053 12.001 1.00 0.00 H ATOM 1244 HB2 SER A 78 28.531 5.018 9.328 1.00 0.00 H ATOM 1245 HB3 SER A 78 29.142 5.595 10.896 1.00 0.00 H ATOM 1246 HG SER A 78 28.477 7.334 9.506 1.00 0.00 H ATOM 1247 H SER A 78 27.481 2.680 10.246 1.00 0.00 H ATOM 1248 N ILE A 79 25.127 5.906 10.686 1.00 19.80 N ATOM 1249 CA ILE A 79 23.917 6.325 9.990 1.00 20.38 C ATOM 1250 C ILE A 79 24.175 6.561 8.505 1.00 20.00 C ATOM 1251 O ILE A 79 23.360 6.213 7.660 1.00 19.76 O ATOM 1252 CB ILE A 79 23.324 7.607 10.623 1.00 21.89 C ATOM 1253 CG1 ILE A 79 22.746 7.300 12.006 1.00 25.24 C ATOM 1254 CG2 ILE A 79 22.248 8.201 9.723 1.00 23.63 C ATOM 1255 CD1 ILE A 79 21.360 6.695 11.973 1.00 27.69 C ATOM 1256 HA ILE A 79 23.197 5.513 10.091 1.00 0.00 H ATOM 1257 HB ILE A 79 24.125 8.338 10.733 1.00 0.00 H ATOM 1258 HG12 ILE A 79 23.414 6.601 12.509 1.00 0.00 H ATOM 1259 HG13 ILE A 79 22.701 8.230 12.573 1.00 0.00 H ATOM 1260 HD11 ILE A 79 20.675 7.387 11.483 1.00 0.00 H ATOM 1261 HD12 ILE A 79 21.388 5.756 11.420 1.00 0.00 H ATOM 1262 HD13 ILE A 79 21.022 6.507 12.992 1.00 0.00 H ATOM 1263 HG21 ILE A 79 22.683 8.453 8.756 1.00 0.00 H ATOM 1264 HG22 ILE A 79 21.449 7.473 9.585 1.00 0.00 H ATOM 1265 HG23 ILE A 79 21.845 9.101 10.187 1.00 0.00 H ATOM 1266 H ILE A 79 25.428 6.431 11.532 1.00 0.00 H ATOM 1267 N GLU A 80 25.318 7.155 8.183 1.00 19.36 N ATOM 1268 CA GLU A 80 25.661 7.424 6.794 1.00 19.47 C ATOM 1269 C GLU A 80 25.670 6.174 5.919 1.00 18.78 C ATOM 1270 O GLU A 80 25.375 6.246 4.725 1.00 20.31 O ATOM 1271 CB GLU A 80 27.013 8.135 6.706 1.00 19.45 C ATOM 1272 CG GLU A 80 26.992 9.561 7.230 1.00 22.30 C ATOM 1273 CD GLU A 80 28.245 9.922 8.007 1.00 25.92 C ATOM 1274 OE1 GLU A 80 29.331 9.401 7.672 1.00 26.70 O ATOM 1275 OE2 GLU A 80 28.140 10.728 8.957 1.00 26.98 O ATOM 1276 HA GLU A 80 24.875 8.072 6.406 1.00 0.00 H ATOM 1277 HB2 GLU A 80 27.739 7.566 7.287 1.00 0.00 H ATOM 1278 HB3 GLU A 80 27.322 8.157 5.661 1.00 0.00 H ATOM 1279 HG2 GLU A 80 26.899 10.242 6.384 1.00 0.00 H ATOM 1280 HG3 GLU A 80 26.129 9.678 7.886 1.00 0.00 H ATOM 1281 H GLU A 80 25.979 7.433 8.936 1.00 0.00 H ATOM 1282 N ASP A 81 26.006 5.031 6.512 1.00 18.16 N ATOM 1283 CA ASP A 81 26.008 3.761 5.790 1.00 17.60 C ATOM 1284 C ASP A 81 24.615 3.407 5.253 1.00 17.29 C ATOM 1285 O ASP A 81 24.490 2.712 4.251 1.00 17.72 O ATOM 1286 CB ASP A 81 26.516 2.625 6.687 1.00 18.11 C ATOM 1287 CG ASP A 81 27.969 2.787 7.088 1.00 21.29 C ATOM 1288 OD1 ASP A 81 28.763 3.339 6.290 1.00 25.15 O ATOM 1289 OD2 ASP A 81 28.321 2.334 8.197 1.00 23.24 O ATOM 1290 HA ASP A 81 26.681 3.880 4.941 1.00 0.00 H ATOM 1291 HB2 ASP A 81 25.907 2.598 7.591 1.00 0.00 H ATOM 1292 HB3 ASP A 81 26.407 1.683 6.149 1.00 0.00 H ATOM 1293 H ASP A 81 26.274 5.042 7.517 1.00 0.00 H ATOM 1294 N ILE A 82 23.567 3.881 5.922 1.00 15.82 N ATOM 1295 CA ILE A 82 22.200 3.569 5.496 1.00 15.31 C ATOM 1296 C ILE A 82 21.915 4.062 4.083 1.00 16.91 C ATOM 1297 O ILE A 82 21.248 3.387 3.297 1.00 17.73 O ATOM 1298 CB ILE A 82 21.157 4.152 6.466 1.00 14.06 C ATOM 1299 CG1 ILE A 82 21.281 3.475 7.830 1.00 15.06 C ATOM 1300 CG2 ILE A 82 19.730 3.964 5.915 1.00 14.26 C ATOM 1301 CD1 ILE A 82 20.443 4.116 8.916 1.00 14.25 C ATOM 1302 HA ILE A 82 22.119 2.482 5.504 1.00 0.00 H ATOM 1303 HB ILE A 82 21.346 5.220 6.573 1.00 0.00 H ATOM 1304 HG12 ILE A 82 20.970 2.435 7.726 1.00 0.00 H ATOM 1305 HG13 ILE A 82 22.326 3.512 8.137 1.00 0.00 H ATOM 1306 HD11 ILE A 82 20.748 5.155 9.043 1.00 0.00 H ATOM 1307 HD12 ILE A 82 19.391 4.077 8.632 1.00 0.00 H ATOM 1308 HD13 ILE A 82 20.588 3.576 9.852 1.00 0.00 H ATOM 1309 HG21 ILE A 82 19.642 4.474 4.956 1.00 0.00 H ATOM 1310 HG22 ILE A 82 19.530 2.901 5.782 1.00 0.00 H ATOM 1311 HG23 ILE A 82 19.012 4.384 6.619 1.00 0.00 H ATOM 1312 H ILE A 82 23.720 4.481 6.758 1.00 0.00 H ATOM 1313 N TYR A 83 22.429 5.243 3.760 1.00 18.83 N ATOM 1314 CA TYR A 83 22.066 5.895 2.512 1.00 20.39 C ATOM 1315 C TYR A 83 22.658 5.184 1.303 1.00 21.84 C ATOM 1316 O TYR A 83 22.214 5.404 0.173 1.00 23.03 O ATOM 1317 CB TYR A 83 22.485 7.366 2.534 1.00 22.11 C ATOM 1318 CG TYR A 83 21.792 8.153 3.617 1.00 23.18 C ATOM 1319 CD1 TYR A 83 20.418 8.381 3.568 1.00 24.52 C ATOM 1320 CD2 TYR A 83 22.501 8.650 4.702 1.00 26.31 C ATOM 1321 CE1 TYR A 83 19.779 9.089 4.566 1.00 25.28 C ATOM 1322 CE2 TYR A 83 21.869 9.361 5.705 1.00 26.53 C ATOM 1323 CZ TYR A 83 20.509 9.574 5.630 1.00 26.13 C ATOM 1324 OH TYR A 83 19.877 10.277 6.622 1.00 27.66 O ATOM 1325 HA TYR A 83 20.981 5.840 2.419 1.00 0.00 H ATOM 1326 HB3 TYR A 83 22.243 7.812 1.569 1.00 0.00 H ATOM 1327 HB2 TYR A 83 23.561 7.420 2.698 1.00 0.00 H ATOM 1328 HD2 TYR A 83 23.575 8.477 4.764 1.00 0.00 H ATOM 1329 HE2 TYR A 83 22.441 9.750 6.548 1.00 0.00 H ATOM 1330 HE1 TYR A 83 18.704 9.263 4.513 1.00 0.00 H ATOM 1331 HD1 TYR A 83 19.839 7.994 2.729 1.00 0.00 H ATOM 1332 HH TYR A 83 18.911 10.339 6.417 1.00 0.00 H ATOM 1333 H TYR A 83 23.099 5.707 4.407 1.00 0.00 H ATOM 1334 N GLN A 84 23.651 4.333 1.547 1.00 22.22 N ATOM 1335 CA GLN A 84 24.287 3.559 0.483 1.00 23.78 C ATOM 1336 C GLN A 84 23.669 2.181 0.235 1.00 23.33 C ATOM 1337 O GLN A 84 24.057 1.486 -0.704 1.00 24.27 O ATOM 1338 CB GLN A 84 25.788 3.416 0.742 1.00 24.57 C ATOM 1339 CG GLN A 84 26.506 4.732 1.026 1.00 27.64 C ATOM 1340 CD GLN A 84 26.288 5.777 -0.056 1.00 31.74 C ATOM 1341 OE1 GLN A 84 26.084 5.448 -1.224 1.00 33.76 O ATOM 1342 NE2 GLN A 84 26.335 7.048 0.332 1.00 33.81 N ATOM 1343 HA GLN A 84 24.111 4.133 -0.427 1.00 0.00 H ATOM 1344 HB2 GLN A 84 25.925 2.760 1.602 1.00 0.00 H ATOM 1345 HB3 GLN A 84 26.244 2.961 -0.137 1.00 0.00 H ATOM 1346 HG2 GLN A 84 26.139 5.130 1.972 1.00 0.00 H ATOM 1347 HG3 GLN A 84 27.575 4.534 1.107 1.00 0.00 H ATOM 1348 HE22 GLN A 84 26.510 7.281 1.330 1.00 0.00 H ATOM 1349 HE21 GLN A 84 26.197 7.809 -0.363 1.00 0.00 H ATOM 1350 H GLN A 84 23.985 4.215 2.525 1.00 0.00 H ATOM 1351 N LEU A 85 22.715 1.777 1.073 1.00 21.22 N ATOM 1352 CA LEU A 85 22.026 0.506 0.855 1.00 20.02 C ATOM 1353 C LEU A 85 21.073 0.584 -0.340 1.00 20.46 C ATOM 1354 O LEU A 85 20.271 1.511 -0.440 1.00 21.74 O ATOM 1355 CB LEU A 85 21.247 0.090 2.108 1.00 19.01 C ATOM 1356 CG LEU A 85 22.043 -0.090 3.403 1.00 17.25 C ATOM 1357 CD1 LEU A 85 21.107 -0.154 4.604 1.00 14.86 C ATOM 1358 CD2 LEU A 85 22.925 -1.334 3.349 1.00 20.63 C ATOM 1359 HA LEU A 85 22.788 -0.243 0.641 1.00 0.00 H ATOM 1360 HB2 LEU A 85 20.491 0.853 2.292 1.00 0.00 H ATOM 1361 HB3 LEU A 85 20.758 -0.859 1.890 1.00 0.00 H ATOM 1362 HG LEU A 85 22.695 0.777 3.512 1.00 0.00 H ATOM 1363 HD21 LEU A 85 22.300 -2.215 3.202 1.00 0.00 H ATOM 1364 HD22 LEU A 85 23.628 -1.244 2.521 1.00 0.00 H ATOM 1365 HD23 LEU A 85 23.475 -1.429 4.285 1.00 0.00 H ATOM 1366 HD11 LEU A 85 20.535 0.771 4.667 1.00 0.00 H ATOM 1367 HD12 LEU A 85 20.426 -0.997 4.488 1.00 0.00 H ATOM 1368 HD13 LEU A 85 21.694 -0.282 5.514 1.00 0.00 H ATOM 1369 H LEU A 85 22.459 2.370 1.888 1.00 0.00 H ATOM 1370 N PRO A 86 21.157 -0.399 -1.253 1.00 21.36 N ATOM 1371 CA PRO A 86 20.301 -0.419 -2.437 1.00 21.79 C ATOM 1372 C PRO A 86 18.844 -0.768 -2.138 1.00 21.55 C ATOM 1373 O PRO A 86 18.563 -1.543 -1.219 1.00 22.00 O ATOM 1374 CB PRO A 86 20.936 -1.507 -3.306 1.00 22.14 C ATOM 1375 CG PRO A 86 21.608 -2.412 -2.344 1.00 23.31 C ATOM 1376 CD PRO A 86 22.083 -1.546 -1.213 1.00 21.82 C ATOM 1377 HA PRO A 86 20.251 0.565 -2.903 1.00 0.00 H ATOM 1378 HD3 PRO A 86 22.012 -2.072 -0.261 1.00 0.00 H ATOM 1379 HD2 PRO A 86 23.112 -1.224 -1.373 1.00 0.00 H ATOM 1380 HG3 PRO A 86 22.453 -2.909 -2.820 1.00 0.00 H ATOM 1381 HG2 PRO A 86 20.907 -3.162 -1.977 1.00 0.00 H ATOM 1382 HB2 PRO A 86 20.173 -2.043 -3.870 1.00 0.00 H ATOM 1383 HB3 PRO A 86 21.659 -1.074 -3.997 1.00 0.00 H ATOM 1384 N GLY A 87 17.933 -0.194 -2.920 1.00 20.36 N ATOM 1385 CA GLY A 87 16.535 -0.607 -2.916 1.00 19.34 C ATOM 1386 C GLY A 87 15.688 0.110 -1.883 1.00 18.53 C ATOM 1387 O GLY A 87 16.021 1.208 -1.435 1.00 19.59 O ATOM 1388 HA3 GLY A 87 16.493 -1.677 -2.712 1.00 0.00 H ATOM 1389 HA2 GLY A 87 16.115 -0.409 -3.902 1.00 0.00 H ATOM 1390 H GLY A 87 18.228 0.575 -3.555 1.00 0.00 H ATOM 1391 N HIS A 88 14.576 -0.517 -1.522 1.00 17.00 N ATOM 1392 CA HIS A 88 13.681 0.034 -0.519 1.00 15.41 C ATOM 1393 C HIS A 88 14.171 -0.377 0.859 1.00 13.26 C ATOM 1394 O HIS A 88 14.259 -1.568 1.166 1.00 14.73 O ATOM 1395 CB HIS A 88 12.258 -0.483 -0.734 1.00 15.50 C ATOM 1396 CG HIS A 88 11.207 0.316 -0.024 1.00 14.44 C ATOM 1397 ND1 HIS A 88 9.864 0.188 -0.305 1.00 16.26 N ATOM 1398 CD2 HIS A 88 11.300 1.255 0.949 1.00 14.40 C ATOM 1399 CE1 HIS A 88 9.173 1.013 0.464 1.00 14.59 C ATOM 1400 NE2 HIS A 88 10.021 1.671 1.237 1.00 14.30 N ATOM 1401 HA HIS A 88 13.672 1.121 -0.603 1.00 0.00 H ATOM 1402 HB2 HIS A 88 12.043 -0.461 -1.802 1.00 0.00 H ATOM 1403 HB3 HIS A 88 12.208 -1.511 -0.375 1.00 0.00 H ATOM 1404 HD2 HIS A 88 12.217 1.614 1.416 1.00 0.00 H ATOM 1405 HE1 HIS A 88 8.089 1.131 0.461 1.00 0.00 H ATOM 1406 H HIS A 88 14.339 -1.426 -1.968 1.00 0.00 H ATOM 1407 N VAL A 89 14.473 0.620 1.684 1.00 12.20 N ATOM 1408 CA VAL A 89 15.041 0.382 2.995 1.00 11.64 C ATOM 1409 C VAL A 89 14.039 0.843 4.046 1.00 10.06 C ATOM 1410 O VAL A 89 13.526 1.966 3.981 1.00 10.51 O ATOM 1411 CB VAL A 89 16.368 1.154 3.164 1.00 12.14 C ATOM 1412 CG1 VAL A 89 16.891 1.013 4.576 1.00 13.96 C ATOM 1413 CG2 VAL A 89 17.407 0.640 2.162 1.00 15.51 C ATOM 1414 HA VAL A 89 15.251 -0.681 3.111 1.00 0.00 H ATOM 1415 HB VAL A 89 16.181 2.210 2.970 1.00 0.00 H ATOM 1416 HG11 VAL A 89 16.157 1.414 5.276 1.00 0.00 H ATOM 1417 HG12 VAL A 89 17.065 -0.041 4.794 1.00 0.00 H ATOM 1418 HG13 VAL A 89 17.826 1.565 4.672 1.00 0.00 H ATOM 1419 HG21 VAL A 89 17.585 -0.421 2.337 1.00 0.00 H ATOM 1420 HG22 VAL A 89 17.035 0.785 1.148 1.00 0.00 H ATOM 1421 HG23 VAL A 89 18.338 1.192 2.291 1.00 0.00 H ATOM 1422 H VAL A 89 14.297 1.599 1.380 1.00 0.00 H ATOM 1423 N PHE A 90 13.758 -0.037 5.002 1.00 8.53 N ATOM 1424 CA PHE A 90 12.841 0.267 6.094 1.00 8.79 C ATOM 1425 C PHE A 90 13.626 0.386 7.388 1.00 8.24 C ATOM 1426 O PHE A 90 14.323 -0.553 7.780 1.00 9.96 O ATOM 1427 CB PHE A 90 11.819 -0.857 6.263 1.00 9.56 C ATOM 1428 CG PHE A 90 10.861 -0.995 5.111 1.00 10.02 C ATOM 1429 CD1 PHE A 90 9.662 -0.293 5.096 1.00 9.55 C ATOM 1430 CD2 PHE A 90 11.152 -1.839 4.054 1.00 11.43 C ATOM 1431 CE1 PHE A 90 8.767 -0.432 4.039 1.00 11.25 C ATOM 1432 CE2 PHE A 90 10.269 -1.980 2.988 1.00 12.57 C ATOM 1433 CZ PHE A 90 9.075 -1.273 2.978 1.00 11.51 C ATOM 1434 HA PHE A 90 12.326 1.200 5.863 1.00 0.00 H ATOM 1435 HB2 PHE A 90 12.359 -1.797 6.374 1.00 0.00 H ATOM 1436 HB3 PHE A 90 11.242 -0.662 7.167 1.00 0.00 H ATOM 1437 HD2 PHE A 90 12.086 -2.401 4.056 1.00 0.00 H ATOM 1438 HE2 PHE A 90 10.515 -2.646 2.161 1.00 0.00 H ATOM 1439 HZ PHE A 90 8.383 -1.377 2.142 1.00 0.00 H ATOM 1440 HE1 PHE A 90 7.826 0.118 4.044 1.00 0.00 H ATOM 1441 HD1 PHE A 90 9.419 0.375 5.922 1.00 0.00 H ATOM 1442 H PHE A 90 14.208 -0.974 4.970 1.00 0.00 H ATOM 1443 N ILE A 91 13.503 1.541 8.037 1.00 8.05 N ATOM 1444 CA ILE A 91 14.049 1.754 9.373 1.00 7.33 C ATOM 1445 C ILE A 91 13.105 1.088 10.376 1.00 7.27 C ATOM 1446 O ILE A 91 11.937 1.471 10.491 1.00 8.02 O ATOM 1447 CB ILE A 91 14.155 3.269 9.692 1.00 7.73 C ATOM 1448 CG1 ILE A 91 15.038 3.984 8.660 1.00 9.70 C ATOM 1449 CG2 ILE A 91 14.692 3.497 11.097 1.00 9.81 C ATOM 1450 CD1 ILE A 91 16.443 3.423 8.542 1.00 12.37 C ATOM 1451 HA ILE A 91 15.050 1.326 9.432 1.00 0.00 H ATOM 1452 HB ILE A 91 13.151 3.690 9.639 1.00 0.00 H ATOM 1453 HG12 ILE A 91 14.556 3.905 7.685 1.00 0.00 H ATOM 1454 HG13 ILE A 91 15.112 5.034 8.943 1.00 0.00 H ATOM 1455 HD11 ILE A 91 16.948 3.505 9.505 1.00 0.00 H ATOM 1456 HD12 ILE A 91 16.391 2.375 8.246 1.00 0.00 H ATOM 1457 HD13 ILE A 91 16.996 3.987 7.791 1.00 0.00 H ATOM 1458 HG21 ILE A 91 14.021 3.034 11.821 1.00 0.00 H ATOM 1459 HG22 ILE A 91 15.683 3.052 11.182 1.00 0.00 H ATOM 1460 HG23 ILE A 91 14.755 4.568 11.291 1.00 0.00 H ATOM 1461 H ILE A 91 12.998 2.323 7.574 1.00 0.00 H ATOM 1462 N PHE A 92 13.626 0.100 11.094 1.00 6.85 N ATOM 1463 CA PHE A 92 12.812 -0.861 11.851 1.00 7.21 C ATOM 1464 C PHE A 92 12.868 -0.609 13.361 1.00 8.45 C ATOM 1465 O PHE A 92 12.163 -1.254 14.122 1.00 9.59 O ATOM 1466 CB PHE A 92 13.322 -2.267 11.538 1.00 8.86 C ATOM 1467 CG PHE A 92 12.335 -3.381 11.792 1.00 8.32 C ATOM 1468 CD1 PHE A 92 11.057 -3.359 11.242 1.00 8.57 C ATOM 1469 CD2 PHE A 92 12.725 -4.493 12.527 1.00 9.94 C ATOM 1470 CE1 PHE A 92 10.177 -4.421 11.453 1.00 10.31 C ATOM 1471 CE2 PHE A 92 11.851 -5.552 12.740 1.00 11.25 C ATOM 1472 CZ PHE A 92 10.584 -5.519 12.193 1.00 11.10 C ATOM 1473 HA PHE A 92 11.770 -0.746 11.552 1.00 0.00 H ATOM 1474 HB2 PHE A 92 13.602 -2.298 10.485 1.00 0.00 H ATOM 1475 HB3 PHE A 92 14.203 -2.451 12.152 1.00 0.00 H ATOM 1476 HD2 PHE A 92 13.732 -4.536 12.943 1.00 0.00 H ATOM 1477 HE2 PHE A 92 12.165 -6.407 13.338 1.00 0.00 H ATOM 1478 HZ PHE A 92 9.904 -6.357 12.343 1.00 0.00 H ATOM 1479 HE1 PHE A 92 9.170 -4.387 11.036 1.00 0.00 H ATOM 1480 HD1 PHE A 92 10.741 -2.506 10.642 1.00 0.00 H ATOM 1481 H PHE A 92 14.661 0.001 11.122 1.00 0.00 H ATOM 1482 N GLY A 93 13.691 0.345 13.786 1.00 9.38 N ATOM 1483 CA GLY A 93 13.786 0.705 15.201 1.00 10.74 C ATOM 1484 C GLY A 93 15.145 0.345 15.742 1.00 10.56 C ATOM 1485 O GLY A 93 15.960 -0.183 15.003 1.00 13.63 O ATOM 1486 HA3 GLY A 93 13.021 0.167 15.761 1.00 0.00 H ATOM 1487 HA2 GLY A 93 13.628 1.778 15.311 1.00 0.00 H ATOM 1488 H GLY A 93 14.283 0.848 13.095 1.00 0.00 H ATOM 1489 N GLY A 94 15.404 0.626 17.021 1.00 10.72 N ATOM 1490 CA GLY A 94 14.396 1.066 17.976 1.00 9.39 C ATOM 1491 C GLY A 94 14.360 2.572 18.161 1.00 7.97 C ATOM 1492 O GLY A 94 14.596 3.325 17.222 1.00 8.64 O ATOM 1493 HA3 GLY A 94 14.608 0.604 18.940 1.00 0.00 H ATOM 1494 HA2 GLY A 94 13.418 0.737 17.624 1.00 0.00 H ATOM 1495 H GLY A 94 16.384 0.525 17.355 1.00 0.00 H ATOM 1496 N GLN A 95 14.060 2.999 19.387 1.00 8.44 N ATOM 1497 CA GLN A 95 13.862 4.409 19.692 1.00 8.10 C ATOM 1498 C GLN A 95 14.952 5.336 19.152 1.00 8.82 C ATOM 1499 O GLN A 95 14.653 6.319 18.471 1.00 8.93 O ATOM 1500 CB GLN A 95 13.671 4.608 21.196 1.00 9.28 C ATOM 1501 CG GLN A 95 13.607 6.064 21.601 1.00 9.35 C ATOM 1502 CD GLN A 95 13.211 6.252 23.051 1.00 9.01 C ATOM 1503 OE1 GLN A 95 12.724 5.335 23.706 1.00 9.61 O ATOM 1504 NE2 GLN A 95 13.402 7.463 23.555 1.00 11.05 N ATOM 1505 HA GLN A 95 12.954 4.700 19.164 1.00 0.00 H ATOM 1506 HB2 GLN A 95 12.741 4.124 21.494 1.00 0.00 H ATOM 1507 HB3 GLN A 95 14.506 4.140 21.717 1.00 0.00 H ATOM 1508 HG2 GLN A 95 14.588 6.512 21.447 1.00 0.00 H ATOM 1509 HG3 GLN A 95 12.875 6.569 20.971 1.00 0.00 H ATOM 1510 HE22 GLN A 95 13.818 8.212 22.965 1.00 0.00 H ATOM 1511 HE21 GLN A 95 13.136 7.664 24.540 1.00 0.00 H ATOM 1512 H GLN A 95 13.964 2.301 20.152 1.00 0.00 H ATOM 1513 N THR A 96 16.216 5.059 19.446 1.00 9.29 N ATOM 1514 CA THR A 96 17.249 6.016 19.035 1.00 9.61 C ATOM 1515 C THR A 96 17.413 6.079 17.509 1.00 9.99 C ATOM 1516 O THR A 96 17.680 7.146 16.959 1.00 10.54 O ATOM 1517 CB THR A 96 18.602 5.772 19.711 1.00 10.00 C ATOM 1518 OG1 THR A 96 19.044 4.448 19.401 1.00 11.44 O ATOM 1519 CG2 THR A 96 18.492 5.951 21.226 1.00 9.90 C ATOM 1520 HA THR A 96 16.889 6.986 19.377 1.00 0.00 H ATOM 1521 HB THR A 96 19.324 6.499 19.339 1.00 0.00 H ATOM 1522 HG1 THR A 96 18.380 3.793 19.734 1.00 0.00 H ATOM 1523 HG23 THR A 96 18.155 6.964 21.447 1.00 0.00 H ATOM 1524 HG21 THR A 96 17.776 5.233 21.624 1.00 0.00 H ATOM 1525 HG22 THR A 96 19.468 5.784 21.682 1.00 0.00 H ATOM 1526 H THR A 96 16.467 4.187 19.954 1.00 0.00 H ATOM 1527 N LEU A 97 17.231 4.957 16.815 1.00 10.28 N ATOM 1528 CA LEU A 97 17.310 5.003 15.357 1.00 9.92 C ATOM 1529 C LEU A 97 16.107 5.761 14.776 1.00 8.81 C ATOM 1530 O LEU A 97 16.254 6.544 13.834 1.00 9.72 O ATOM 1531 CB LEU A 97 17.426 3.600 14.773 1.00 12.06 C ATOM 1532 CG LEU A 97 17.631 3.532 13.265 1.00 14.14 C ATOM 1533 CD1 LEU A 97 18.832 4.363 12.802 1.00 14.94 C ATOM 1534 CD2 LEU A 97 17.754 2.077 12.856 1.00 16.76 C ATOM 1535 HA LEU A 97 18.212 5.547 15.077 1.00 0.00 H ATOM 1536 HB2 LEU A 97 18.273 3.106 15.250 1.00 0.00 H ATOM 1537 HB3 LEU A 97 16.510 3.060 15.012 1.00 0.00 H ATOM 1538 HG LEU A 97 16.766 3.973 12.770 1.00 0.00 H ATOM 1539 HD21 LEU A 97 18.606 1.628 13.367 1.00 0.00 H ATOM 1540 HD22 LEU A 97 16.843 1.545 13.131 1.00 0.00 H ATOM 1541 HD23 LEU A 97 17.901 2.015 11.778 1.00 0.00 H ATOM 1542 HD11 LEU A 97 18.677 5.407 13.075 1.00 0.00 H ATOM 1543 HD12 LEU A 97 19.737 3.991 13.283 1.00 0.00 H ATOM 1544 HD13 LEU A 97 18.934 4.280 11.720 1.00 0.00 H ATOM 1545 H LEU A 97 17.035 4.060 17.304 1.00 0.00 H ATOM 1546 N PHE A 98 14.918 5.552 15.347 1.00 8.62 N ATOM 1547 CA PHE A 98 13.764 6.349 14.940 1.00 8.17 C ATOM 1548 C PHE A 98 14.005 7.842 15.158 1.00 8.46 C ATOM 1549 O PHE A 98 13.661 8.657 14.305 1.00 9.58 O ATOM 1550 CB PHE A 98 12.494 5.932 15.680 1.00 8.35 C ATOM 1551 CG PHE A 98 11.948 4.585 15.282 1.00 7.56 C ATOM 1552 CD1 PHE A 98 11.910 4.176 13.953 1.00 7.05 C ATOM 1553 CD2 PHE A 98 11.432 3.740 16.253 1.00 8.15 C ATOM 1554 CE1 PHE A 98 11.378 2.931 13.600 1.00 8.30 C ATOM 1555 CE2 PHE A 98 10.901 2.498 15.915 1.00 6.67 C ATOM 1556 CZ PHE A 98 10.856 2.102 14.582 1.00 7.86 C ATOM 1557 HA PHE A 98 13.627 6.163 13.875 1.00 0.00 H ATOM 1558 HB2 PHE A 98 12.715 5.908 16.747 1.00 0.00 H ATOM 1559 HB3 PHE A 98 11.726 6.681 15.486 1.00 0.00 H ATOM 1560 HD2 PHE A 98 11.442 4.053 17.297 1.00 0.00 H ATOM 1561 HE2 PHE A 98 10.521 1.837 16.694 1.00 0.00 H ATOM 1562 HZ PHE A 98 10.412 1.144 14.310 1.00 0.00 H ATOM 1563 HE1 PHE A 98 11.374 2.614 12.557 1.00 0.00 H ATOM 1564 HD1 PHE A 98 12.300 4.834 13.176 1.00 0.00 H ATOM 1565 H PHE A 98 14.814 4.822 16.081 1.00 0.00 H ATOM 1566 N GLU A 99 14.562 8.201 16.313 1.00 8.37 N ATOM 1567 CA GLU A 99 14.838 9.605 16.615 1.00 9.80 C ATOM 1568 C GLU A 99 15.812 10.211 15.606 1.00 10.95 C ATOM 1569 O GLU A 99 15.674 11.373 15.215 1.00 12.90 O ATOM 1570 CB GLU A 99 15.375 9.751 18.046 1.00 10.28 C ATOM 1571 CG GLU A 99 14.279 9.582 19.088 1.00 11.79 C ATOM 1572 CD GLU A 99 14.772 9.267 20.497 1.00 14.05 C ATOM 1573 OE1 GLU A 99 15.946 8.875 20.677 1.00 14.98 O ATOM 1574 OE2 GLU A 99 13.950 9.392 21.433 1.00 16.11 O ATOM 1575 HA GLU A 99 13.900 10.155 16.539 1.00 0.00 H ATOM 1576 HB2 GLU A 99 16.140 8.993 18.214 1.00 0.00 H ATOM 1577 HB3 GLU A 99 15.816 10.741 18.157 1.00 0.00 H ATOM 1578 HG2 GLU A 99 13.706 10.508 19.129 1.00 0.00 H ATOM 1579 HG3 GLU A 99 13.629 8.768 18.767 1.00 0.00 H ATOM 1580 H GLU A 99 14.805 7.470 17.012 1.00 0.00 H ATOM 1581 N GLU A 100 16.791 9.416 15.184 1.00 9.64 N ATOM 1582 CA GLU A 100 17.811 9.871 14.235 1.00 12.26 C ATOM 1583 C GLU A 100 17.291 9.966 12.805 1.00 11.78 C ATOM 1584 O GLU A 100 17.818 10.735 11.994 1.00 13.98 O ATOM 1585 CB GLU A 100 19.031 8.944 14.296 1.00 13.09 C ATOM 1586 CG GLU A 100 19.823 9.075 15.599 1.00 14.65 C ATOM 1587 CD GLU A 100 20.702 7.873 15.934 1.00 17.35 C ATOM 1588 OE1 GLU A 100 20.619 6.823 15.261 1.00 22.85 O ATOM 1589 OE2 GLU A 100 21.491 7.981 16.898 1.00 26.47 O ATOM 1590 HA GLU A 100 18.097 10.880 14.532 1.00 0.00 H ATOM 1591 HB2 GLU A 100 18.689 7.914 14.200 1.00 0.00 H ATOM 1592 HB3 GLU A 100 19.692 9.185 13.463 1.00 0.00 H ATOM 1593 HG2 GLU A 100 20.464 9.953 15.521 1.00 0.00 H ATOM 1594 HG3 GLU A 100 19.114 9.216 16.415 1.00 0.00 H ATOM 1595 H GLU A 100 16.834 8.439 15.539 1.00 0.00 H ATOM 1596 N MET A 101 16.260 9.184 12.487 1.00 9.67 N ATOM 1597 CA MET A 101 15.834 9.036 11.095 1.00 10.38 C ATOM 1598 C MET A 101 14.515 9.721 10.739 1.00 10.40 C ATOM 1599 O MET A 101 14.216 9.909 9.552 1.00 10.69 O ATOM 1600 CB MET A 101 15.799 7.561 10.678 1.00 10.56 C ATOM 1601 CG MET A 101 17.167 6.882 10.719 1.00 11.98 C ATOM 1602 SD MET A 101 18.419 7.693 9.697 1.00 19.69 S ATOM 1603 CE MET A 101 17.709 7.418 8.084 1.00 19.33 C ATOM 1604 HA MET A 101 16.596 9.565 10.523 1.00 0.00 H ATOM 1605 HB2 MET A 101 15.129 7.028 11.352 1.00 0.00 H ATOM 1606 HB3 MET A 101 15.413 7.499 9.660 1.00 0.00 H ATOM 1607 HG2 MET A 101 17.052 5.856 10.371 1.00 0.00 H ATOM 1608 HG3 MET A 101 17.517 6.877 11.751 1.00 0.00 H ATOM 1609 HE1 MET A 101 17.614 6.346 7.908 1.00 0.00 H ATOM 1610 HE2 MET A 101 16.724 7.884 8.038 1.00 0.00 H ATOM 1611 HE3 MET A 101 18.356 7.857 7.324 1.00 0.00 H ATOM 1612 H MET A 101 15.752 8.673 13.237 1.00 0.00 H ATOM 1613 N ILE A 102 13.710 10.080 11.738 1.00 9.95 N ATOM 1614 CA ILE A 102 12.376 10.586 11.421 1.00 11.72 C ATOM 1615 C ILE A 102 12.386 11.830 10.528 1.00 11.68 C ATOM 1616 O ILE A 102 11.486 12.010 9.702 1.00 12.01 O ATOM 1617 CB ILE A 102 11.471 10.752 12.671 1.00 11.46 C ATOM 1618 CG1 ILE A 102 10.025 11.074 12.250 1.00 11.80 C ATOM 1619 CG2 ILE A 102 12.052 11.790 13.620 1.00 11.11 C ATOM 1620 CD1 ILE A 102 8.986 10.916 13.347 1.00 13.03 C ATOM 1621 HA ILE A 102 11.916 9.802 10.820 1.00 0.00 H ATOM 1622 HB ILE A 102 11.440 9.810 13.218 1.00 0.00 H ATOM 1623 HG12 ILE A 102 9.996 12.107 11.903 1.00 0.00 H ATOM 1624 HG13 ILE A 102 9.755 10.408 11.430 1.00 0.00 H ATOM 1625 HD11 ILE A 102 8.986 9.885 13.700 1.00 0.00 H ATOM 1626 HD12 ILE A 102 9.227 11.585 14.173 1.00 0.00 H ATOM 1627 HD13 ILE A 102 8.001 11.165 12.952 1.00 0.00 H ATOM 1628 HG21 ILE A 102 13.044 11.472 13.941 1.00 0.00 H ATOM 1629 HG22 ILE A 102 12.125 12.749 13.107 1.00 0.00 H ATOM 1630 HG23 ILE A 102 11.402 11.890 14.489 1.00 0.00 H ATOM 1631 H ILE A 102 14.025 10.002 12.726 1.00 0.00 H ATOM 1632 N ASP A 103 13.401 12.680 10.685 1.00 11.11 N ATOM 1633 CA ASP A 103 13.516 13.892 9.860 1.00 11.85 C ATOM 1634 C ASP A 103 14.092 13.603 8.471 1.00 12.62 C ATOM 1635 O ASP A 103 14.108 14.479 7.601 1.00 12.96 O ATOM 1636 CB ASP A 103 14.362 14.958 10.567 1.00 12.25 C ATOM 1637 CG ASP A 103 13.651 15.586 11.758 1.00 12.80 C ATOM 1638 OD1 ASP A 103 12.423 15.414 11.893 1.00 12.08 O ATOM 1639 OD2 ASP A 103 14.327 16.267 12.563 1.00 16.47 O ATOM 1640 HA ASP A 103 12.503 14.271 9.723 1.00 0.00 H ATOM 1641 HB2 ASP A 103 15.284 14.494 10.917 1.00 0.00 H ATOM 1642 HB3 ASP A 103 14.601 15.744 9.851 1.00 0.00 H ATOM 1643 H ASP A 103 14.125 12.482 11.405 1.00 0.00 H ATOM 1644 N LYS A 104 14.548 12.369 8.266 1.00 12.69 N ATOM 1645 CA LYS A 104 15.316 12.003 7.078 1.00 14.72 C ATOM 1646 C LYS A 104 14.564 11.099 6.112 1.00 13.92 C ATOM 1647 O LYS A 104 14.891 11.050 4.929 1.00 16.27 O ATOM 1648 CB LYS A 104 16.633 11.327 7.474 1.00 14.65 C ATOM 1649 CG LYS A 104 17.541 12.203 8.332 1.00 19.31 C ATOM 1650 CD LYS A 104 18.859 11.521 8.640 1.00 20.95 C ATOM 1651 CE LYS A 104 19.741 12.420 9.495 1.00 27.36 C ATOM 1652 NZ LYS A 104 18.969 13.100 10.576 1.00 29.19 N ATOM 1653 HA LYS A 104 15.508 12.941 6.556 1.00 0.00 H ATOM 1654 HB2 LYS A 104 16.400 10.421 8.034 1.00 0.00 H ATOM 1655 HB3 LYS A 104 17.171 11.062 6.564 1.00 0.00 H ATOM 1656 HG2 LYS A 104 17.741 13.132 7.798 1.00 0.00 H ATOM 1657 HG3 LYS A 104 17.032 12.426 9.270 1.00 0.00 H ATOM 1658 HD2 LYS A 104 18.665 10.593 9.178 1.00 0.00 H ATOM 1659 HD3 LYS A 104 19.374 11.298 7.706 1.00 0.00 H ATOM 1660 HE2 LYS A 104 20.194 13.178 8.856 1.00 0.00 H ATOM 1661 HE3 LYS A 104 20.524 11.814 9.950 1.00 0.00 H ATOM 1662 HZ1 LYS A 104 18.223 13.687 10.151 1.00 0.00 H ATOM 1663 HZ2 LYS A 104 18.538 12.384 11.195 1.00 0.00 H ATOM 1664 HZ3 LYS A 104 19.610 13.701 11.132 1.00 0.00 H ATOM 1665 H LYS A 104 14.350 11.638 8.979 1.00 0.00 H ATOM 1666 N VAL A 105 13.581 10.357 6.613 1.00 12.36 N ATOM 1667 CA VAL A 105 12.936 9.350 5.769 1.00 12.52 C ATOM 1668 C VAL A 105 11.933 10.005 4.827 1.00 13.55 C ATOM 1669 O VAL A 105 11.462 11.125 5.067 1.00 14.34 O ATOM 1670 CB VAL A 105 12.233 8.231 6.590 1.00 11.71 C ATOM 1671 CG1 VAL A 105 13.246 7.449 7.396 1.00 13.11 C ATOM 1672 CG2 VAL A 105 11.126 8.802 7.476 1.00 10.70 C ATOM 1673 HA VAL A 105 13.731 8.877 5.192 1.00 0.00 H ATOM 1674 HB VAL A 105 11.758 7.543 5.891 1.00 0.00 H ATOM 1675 HG11 VAL A 105 13.970 6.992 6.722 1.00 0.00 H ATOM 1676 HG12 VAL A 105 13.760 8.122 8.082 1.00 0.00 H ATOM 1677 HG13 VAL A 105 12.735 6.671 7.963 1.00 0.00 H ATOM 1678 HG21 VAL A 105 11.555 9.524 8.171 1.00 0.00 H ATOM 1679 HG22 VAL A 105 10.380 9.294 6.852 1.00 0.00 H ATOM 1680 HG23 VAL A 105 10.656 7.993 8.035 1.00 0.00 H ATOM 1681 H VAL A 105 13.273 10.491 7.597 1.00 0.00 H ATOM 1682 N ASP A 106 11.595 9.286 3.765 1.00 12.84 N ATOM 1683 CA ASP A 106 10.604 9.748 2.808 1.00 13.58 C ATOM 1684 C ASP A 106 9.177 9.590 3.337 1.00 13.49 C ATOM 1685 O ASP A 106 8.316 10.444 3.131 1.00 14.92 O ATOM 1686 CB ASP A 106 10.773 8.972 1.501 1.00 15.03 C ATOM 1687 CG ASP A 106 12.151 9.165 0.885 1.00 17.57 C ATOM 1688 OD1 ASP A 106 12.586 10.332 0.777 1.00 22.06 O ATOM 1689 OD2 ASP A 106 12.799 8.160 0.510 1.00 19.50 O ATOM 1690 HA ASP A 106 10.765 10.812 2.636 1.00 0.00 H ATOM 1691 HB2 ASP A 106 10.625 7.911 1.702 1.00 0.00 H ATOM 1692 HB3 ASP A 106 10.021 9.315 0.791 1.00 0.00 H ATOM 1693 H ASP A 106 12.053 8.365 3.613 1.00 0.00 H ATOM 1694 N ASP A 107 8.919 8.486 4.021 1.00 11.54 N ATOM 1695 CA ASP A 107 7.557 8.168 4.436 1.00 11.19 C ATOM 1696 C ASP A 107 7.572 7.231 5.637 1.00 9.27 C ATOM 1697 O ASP A 107 8.635 6.788 6.062 1.00 9.24 O ATOM 1698 CB ASP A 107 6.726 7.599 3.275 1.00 11.03 C ATOM 1699 CG ASP A 107 7.295 6.311 2.700 1.00 11.73 C ATOM 1700 OD1 ASP A 107 8.381 5.884 3.138 1.00 13.06 O ATOM 1701 OD2 ASP A 107 6.642 5.717 1.810 1.00 14.01 O ATOM 1702 HA ASP A 107 7.070 9.095 4.740 1.00 0.00 H ATOM 1703 HB2 ASP A 107 5.717 7.400 3.637 1.00 0.00 H ATOM 1704 HB3 ASP A 107 6.686 8.344 2.481 1.00 0.00 H ATOM 1705 H ASP A 107 9.696 7.839 4.265 1.00 0.00 H ATOM 1706 N MET A 108 6.395 6.957 6.194 1.00 8.44 N ATOM 1707 CA MET A 108 6.278 6.118 7.387 1.00 8.52 C ATOM 1708 C MET A 108 5.102 5.182 7.243 1.00 8.10 C ATOM 1709 O MET A 108 4.004 5.589 6.853 1.00 9.37 O ATOM 1710 CB MET A 108 6.101 6.969 8.653 1.00 8.66 C ATOM 1711 CG MET A 108 7.174 8.061 8.830 1.00 9.44 C ATOM 1712 SD MET A 108 7.317 8.689 10.528 1.00 10.09 S ATOM 1713 CE MET A 108 5.838 9.676 10.689 1.00 10.15 C ATOM 1714 HA MET A 108 7.199 5.544 7.485 1.00 0.00 H ATOM 1715 HB2 MET A 108 5.125 7.452 8.608 1.00 0.00 H ATOM 1716 HB3 MET A 108 6.139 6.308 9.519 1.00 0.00 H ATOM 1717 HG2 MET A 108 6.925 8.896 8.175 1.00 0.00 H ATOM 1718 HG3 MET A 108 8.138 7.646 8.536 1.00 0.00 H ATOM 1719 HE1 MET A 108 5.847 10.467 9.939 1.00 0.00 H ATOM 1720 HE2 MET A 108 4.963 9.044 10.541 1.00 0.00 H ATOM 1721 HE3 MET A 108 5.804 10.118 11.685 1.00 0.00 H ATOM 1722 H MET A 108 5.532 7.351 5.768 1.00 0.00 H ATOM 1723 N TYR A 109 5.348 3.922 7.562 1.00 7.29 N ATOM 1724 CA TYR A 109 4.294 2.935 7.685 1.00 7.28 C ATOM 1725 C TYR A 109 4.113 2.658 9.160 1.00 7.53 C ATOM 1726 O TYR A 109 4.964 2.010 9.791 1.00 8.03 O ATOM 1727 CB TYR A 109 4.697 1.658 6.943 1.00 8.47 C ATOM 1728 CG TYR A 109 4.760 1.838 5.444 1.00 8.60 C ATOM 1729 CD1 TYR A 109 5.943 2.229 4.821 1.00 9.50 C ATOM 1730 CD2 TYR A 109 3.635 1.627 4.650 1.00 10.08 C ATOM 1731 CE1 TYR A 109 6.009 2.385 3.430 1.00 11.50 C ATOM 1732 CE2 TYR A 109 3.690 1.791 3.265 1.00 11.32 C ATOM 1733 CZ TYR A 109 4.875 2.167 2.664 1.00 11.42 C ATOM 1734 OH TYR A 109 4.933 2.324 1.293 1.00 14.52 O ATOM 1735 HA TYR A 109 3.362 3.295 7.250 1.00 0.00 H ATOM 1736 HB3 TYR A 109 3.967 0.880 7.169 1.00 0.00 H ATOM 1737 HB2 TYR A 109 5.680 1.346 7.297 1.00 0.00 H ATOM 1738 HD2 TYR A 109 2.697 1.329 5.118 1.00 0.00 H ATOM 1739 HE2 TYR A 109 2.800 1.623 2.659 1.00 0.00 H ATOM 1740 HE1 TYR A 109 6.945 2.676 2.954 1.00 0.00 H ATOM 1741 HD1 TYR A 109 6.831 2.416 5.425 1.00 0.00 H ATOM 1742 HH TYR A 109 5.849 2.594 1.031 1.00 0.00 H ATOM 1743 H TYR A 109 6.332 3.630 7.730 1.00 0.00 H ATOM 1744 N ILE A 110 3.022 3.181 9.710 1.00 7.41 N ATOM 1745 CA ILE A 110 2.795 3.124 11.142 1.00 8.05 C ATOM 1746 C ILE A 110 1.596 2.234 11.431 1.00 7.17 C ATOM 1747 O ILE A 110 0.531 2.399 10.842 1.00 9.04 O ATOM 1748 CB ILE A 110 2.549 4.540 11.717 1.00 7.80 C ATOM 1749 CG1 ILE A 110 3.766 5.443 11.427 1.00 10.14 C ATOM 1750 CG2 ILE A 110 2.197 4.456 13.209 1.00 8.93 C ATOM 1751 CD1 ILE A 110 3.799 6.761 12.199 1.00 13.47 C ATOM 1752 HA ILE A 110 3.683 2.710 11.620 1.00 0.00 H ATOM 1753 HB ILE A 110 1.691 4.999 11.225 1.00 0.00 H ATOM 1754 HG12 ILE A 110 4.668 4.884 11.676 1.00 0.00 H ATOM 1755 HG13 ILE A 110 3.767 5.676 10.362 1.00 0.00 H ATOM 1756 HD11 ILE A 110 2.913 7.346 11.954 1.00 0.00 H ATOM 1757 HD12 ILE A 110 3.814 6.554 13.269 1.00 0.00 H ATOM 1758 HD13 ILE A 110 4.693 7.320 11.923 1.00 0.00 H ATOM 1759 HG21 ILE A 110 1.294 3.859 13.335 1.00 0.00 H ATOM 1760 HG22 ILE A 110 3.021 3.990 13.750 1.00 0.00 H ATOM 1761 HG23 ILE A 110 2.027 5.460 13.598 1.00 0.00 H ATOM 1762 H ILE A 110 2.316 3.641 9.101 1.00 0.00 H ATOM 1763 N THR A 111 1.778 1.289 12.339 1.00 6.25 N ATOM 1764 CA THR A 111 0.642 0.611 12.943 1.00 6.58 C ATOM 1765 C THR A 111 0.346 1.316 14.254 1.00 7.33 C ATOM 1766 O THR A 111 1.152 1.245 15.187 1.00 7.04 O ATOM 1767 CB THR A 111 0.942 -0.869 13.213 1.00 7.10 C ATOM 1768 OG1 THR A 111 1.376 -1.491 12.001 1.00 8.15 O ATOM 1769 CG2 THR A 111 -0.298 -1.585 13.755 1.00 9.37 C ATOM 1770 HA THR A 111 -0.209 0.648 12.263 1.00 0.00 H ATOM 1771 HB THR A 111 1.729 -0.939 13.964 1.00 0.00 H ATOM 1772 HG1 THR A 111 1.570 -2.446 12.173 1.00 0.00 H ATOM 1773 HG23 THR A 111 -0.620 -1.103 14.678 1.00 0.00 H ATOM 1774 HG21 THR A 111 -1.099 -1.531 13.017 1.00 0.00 H ATOM 1775 HG22 THR A 111 -0.055 -2.629 13.954 1.00 0.00 H ATOM 1776 H THR A 111 2.744 1.028 12.624 1.00 0.00 H ATOM 1777 N VAL A 112 -0.779 2.030 14.307 1.00 7.69 N ATOM 1778 CA VAL A 112 -1.213 2.640 15.562 1.00 7.89 C ATOM 1779 C VAL A 112 -1.974 1.598 16.363 1.00 6.91 C ATOM 1780 O VAL A 112 -3.039 1.120 15.947 1.00 8.22 O ATOM 1781 CB VAL A 112 -2.085 3.891 15.335 1.00 7.90 C ATOM 1782 CG1 VAL A 112 -2.496 4.514 16.681 1.00 9.89 C ATOM 1783 CG2 VAL A 112 -1.321 4.907 14.493 1.00 10.54 C ATOM 1784 HA VAL A 112 -0.332 2.974 16.110 1.00 0.00 H ATOM 1785 HB VAL A 112 -2.990 3.597 14.803 1.00 0.00 H ATOM 1786 HG11 VAL A 112 -3.065 3.785 17.258 1.00 0.00 H ATOM 1787 HG12 VAL A 112 -1.602 4.801 17.235 1.00 0.00 H ATOM 1788 HG13 VAL A 112 -3.111 5.396 16.499 1.00 0.00 H ATOM 1789 HG21 VAL A 112 -0.407 5.194 15.013 1.00 0.00 H ATOM 1790 HG22 VAL A 112 -1.069 4.463 13.530 1.00 0.00 H ATOM 1791 HG23 VAL A 112 -1.943 5.788 14.336 1.00 0.00 H ATOM 1792 H VAL A 112 -1.352 2.154 13.448 1.00 0.00 H ATOM 1793 N ILE A 113 -1.409 1.227 17.504 1.00 6.75 N ATOM 1794 CA ILE A 113 -2.087 0.358 18.435 1.00 7.29 C ATOM 1795 C ILE A 113 -3.020 1.249 19.234 1.00 7.83 C ATOM 1796 O ILE A 113 -2.571 2.154 19.943 1.00 9.13 O ATOM 1797 CB ILE A 113 -1.076 -0.311 19.388 1.00 8.09 C ATOM 1798 CG1 ILE A 113 -0.019 -1.120 18.615 1.00 14.80 C ATOM 1799 CG2 ILE A 113 -1.798 -1.070 20.482 1.00 11.69 C ATOM 1800 CD1 ILE A 113 -0.544 -2.197 17.734 1.00 17.90 C ATOM 1801 HA ILE A 113 -2.622 -0.434 17.912 1.00 0.00 H ATOM 1802 HB ILE A 113 -0.499 0.457 19.903 1.00 0.00 H ATOM 1803 HG12 ILE A 113 0.546 -0.425 17.994 1.00 0.00 H ATOM 1804 HG13 ILE A 113 0.649 -1.580 19.343 1.00 0.00 H ATOM 1805 HD11 ILE A 113 -1.100 -2.917 18.334 1.00 0.00 H ATOM 1806 HD12 ILE A 113 -1.204 -1.761 16.983 1.00 0.00 H ATOM 1807 HD13 ILE A 113 0.288 -2.699 17.241 1.00 0.00 H ATOM 1808 HG21 ILE A 113 -2.419 -0.379 21.053 1.00 0.00 H ATOM 1809 HG22 ILE A 113 -2.426 -1.840 20.034 1.00 0.00 H ATOM 1810 HG23 ILE A 113 -1.067 -1.535 21.144 1.00 0.00 H ATOM 1811 H ILE A 113 -0.455 1.571 17.733 1.00 0.00 H ATOM 1812 N GLU A 114 -4.318 1.027 19.070 1.00 8.57 N ATOM 1813 CA GLU A 114 -5.321 1.942 19.603 1.00 9.86 C ATOM 1814 C GLU A 114 -5.630 1.604 21.054 1.00 10.68 C ATOM 1815 O GLU A 114 -6.773 1.275 21.422 1.00 11.80 O ATOM 1816 CB GLU A 114 -6.579 1.912 18.732 1.00 10.68 C ATOM 1817 CG GLU A 114 -6.308 2.170 17.252 1.00 13.51 C ATOM 1818 CD GLU A 114 -6.235 3.637 16.898 1.00 18.69 C ATOM 1819 OE1 GLU A 114 -6.367 4.473 17.813 1.00 20.32 O ATOM 1820 OE2 GLU A 114 -6.054 3.958 15.701 1.00 19.68 O ATOM 1821 HA GLU A 114 -4.927 2.958 19.581 1.00 0.00 H ATOM 1822 HB2 GLU A 114 -7.043 0.931 18.831 1.00 0.00 H ATOM 1823 HB3 GLU A 114 -7.267 2.676 19.094 1.00 0.00 H ATOM 1824 HG2 GLU A 114 -5.359 1.704 16.989 1.00 0.00 H ATOM 1825 HG3 GLU A 114 -7.109 1.714 16.670 1.00 0.00 H ATOM 1826 H GLU A 114 -4.627 0.181 18.550 1.00 0.00 H ATOM 1827 N GLY A 115 -4.593 1.698 21.877 1.00 11.07 N ATOM 1828 CA GLY A 115 -4.703 1.450 23.300 1.00 10.71 C ATOM 1829 C GLY A 115 -3.561 2.142 24.013 1.00 9.47 C ATOM 1830 O GLY A 115 -2.689 2.737 23.365 1.00 10.78 O ATOM 1831 HA3 GLY A 115 -4.655 0.378 23.489 1.00 0.00 H ATOM 1832 HA2 GLY A 115 -5.653 1.840 23.667 1.00 0.00 H ATOM 1833 H GLY A 115 -3.666 1.960 21.485 1.00 0.00 H ATOM 1834 N LYS A 116 -3.559 2.051 25.337 1.00 9.04 N ATOM 1835 CA LYS A 116 -2.498 2.645 26.151 1.00 9.13 C ATOM 1836 C LYS A 116 -1.893 1.556 27.022 1.00 10.43 C ATOM 1837 O LYS A 116 -2.518 1.115 27.994 1.00 13.00 O ATOM 1838 CB LYS A 116 -3.048 3.774 27.036 1.00 9.31 C ATOM 1839 CG LYS A 116 -3.657 4.940 26.241 1.00 10.14 C ATOM 1840 CD LYS A 116 -4.408 5.915 27.148 1.00 13.81 C ATOM 1841 CE LYS A 116 -3.473 6.874 27.842 1.00 19.60 C ATOM 1842 NZ LYS A 116 -4.268 7.983 28.440 1.00 22.01 N ATOM 1843 HA LYS A 116 -1.740 3.074 25.495 1.00 0.00 H ATOM 1844 HB2 LYS A 116 -3.820 3.359 27.684 1.00 0.00 H ATOM 1845 HB3 LYS A 116 -2.232 4.162 27.646 1.00 0.00 H ATOM 1846 HG2 LYS A 116 -2.856 5.477 25.732 1.00 0.00 H ATOM 1847 HG3 LYS A 116 -4.351 4.539 25.502 1.00 0.00 H ATOM 1848 HD2 LYS A 116 -5.114 6.486 26.544 1.00 0.00 H ATOM 1849 HD3 LYS A 116 -4.953 5.347 27.902 1.00 0.00 H ATOM 1850 HE2 LYS A 116 -2.765 7.280 27.120 1.00 0.00 H ATOM 1851 HE3 LYS A 116 -2.929 6.350 28.628 1.00 0.00 H ATOM 1852 HZ1 LYS A 116 -4.786 8.481 27.688 1.00 0.00 H ATOM 1853 HZ2 LYS A 116 -4.943 7.592 29.128 1.00 0.00 H ATOM 1854 HZ3 LYS A 116 -3.628 8.647 28.920 1.00 0.00 H ATOM 1855 H LYS A 116 -4.334 1.543 25.810 1.00 0.00 H ATOM 1856 N PHE A 117 -0.682 1.132 26.661 1.00 9.15 N ATOM 1857 CA PHE A 117 0.022 0.038 27.330 1.00 9.81 C ATOM 1858 C PHE A 117 1.134 0.571 28.224 1.00 10.59 C ATOM 1859 O PHE A 117 1.564 1.723 28.080 1.00 11.80 O ATOM 1860 CB PHE A 117 0.623 -0.913 26.285 1.00 10.09 C ATOM 1861 CG PHE A 117 -0.399 -1.744 25.577 1.00 8.83 C ATOM 1862 CD1 PHE A 117 -1.175 -1.201 24.559 1.00 10.56 C ATOM 1863 CD2 PHE A 117 -0.631 -3.056 25.967 1.00 10.85 C ATOM 1864 CE1 PHE A 117 -2.155 -1.963 23.930 1.00 10.45 C ATOM 1865 CE2 PHE A 117 -1.598 -3.833 25.331 1.00 9.81 C ATOM 1866 CZ PHE A 117 -2.352 -3.292 24.308 1.00 10.13 C ATOM 1867 HA PHE A 117 -0.697 -0.499 27.949 1.00 0.00 H ATOM 1868 HB2 PHE A 117 1.158 -0.319 25.544 1.00 0.00 H ATOM 1869 HB3 PHE A 117 1.323 -1.581 26.788 1.00 0.00 H ATOM 1870 HD2 PHE A 117 -0.049 -3.485 26.782 1.00 0.00 H ATOM 1871 HE2 PHE A 117 -1.759 -4.866 25.640 1.00 0.00 H ATOM 1872 HZ PHE A 117 -3.098 -3.901 23.798 1.00 0.00 H ATOM 1873 HE1 PHE A 117 -2.768 -1.523 23.143 1.00 0.00 H ATOM 1874 HD1 PHE A 117 -1.014 -0.168 24.251 1.00 0.00 H ATOM 1875 H PHE A 117 -0.213 1.604 25.862 1.00 0.00 H ATOM 1876 N ARG A 118 1.620 -0.284 29.121 1.00 12.09 N ATOM 1877 CA ARG A 118 2.896 -0.052 29.787 1.00 13.05 C ATOM 1878 C ARG A 118 4.003 0.147 28.758 1.00 11.31 C ATOM 1879 O ARG A 118 4.062 -0.569 27.762 1.00 13.13 O ATOM 1880 CB ARG A 118 3.259 -1.250 30.675 1.00 13.73 C ATOM 1881 CG ARG A 118 2.390 -1.383 31.918 1.00 18.00 C ATOM 1882 CD ARG A 118 3.181 -1.948 33.079 1.00 26.32 C ATOM 1883 NE ARG A 118 4.192 -1.002 33.548 1.00 30.50 N ATOM 1884 CZ ARG A 118 4.844 -1.116 34.700 1.00 32.70 C ATOM 1885 NH1 ARG A 118 4.595 -2.138 35.510 1.00 34.63 N ATOM 1886 NH2 ARG A 118 5.748 -0.212 35.042 1.00 34.12 N ATOM 1887 HA ARG A 118 2.799 0.844 30.400 1.00 0.00 H ATOM 1888 HB2 ARG A 118 3.154 -2.160 30.084 1.00 0.00 H ATOM 1889 HB3 ARG A 118 4.296 -1.141 30.991 1.00 0.00 H ATOM 1890 HG2 ARG A 118 2.008 -0.400 32.192 1.00 0.00 H ATOM 1891 HG3 ARG A 118 1.555 -2.048 31.699 1.00 0.00 H ATOM 1892 HD2 ARG A 118 3.675 -2.865 32.759 1.00 0.00 H ATOM 1893 HD3 ARG A 118 2.498 -2.172 33.898 1.00 0.00 H ATOM 1894 HE ARG A 118 4.415 -0.188 32.941 1.00 0.00 H ATOM 1895 HH12 ARG A 118 5.107 -2.224 36.411 1.00 0.00 H ATOM 1896 HH11 ARG A 118 3.888 -2.852 35.243 1.00 0.00 H ATOM 1897 HH22 ARG A 118 6.258 -0.302 35.944 1.00 0.00 H ATOM 1898 HH21 ARG A 118 5.948 0.588 34.409 1.00 0.00 H ATOM 1899 H ARG A 118 1.076 -1.139 29.353 1.00 0.00 H ATOM 1900 N GLY A 119 4.878 1.125 28.987 1.00 10.84 N ATOM 1901 CA GLY A 119 5.971 1.363 28.055 1.00 10.34 C ATOM 1902 C GLY A 119 7.183 1.984 28.708 1.00 9.18 C ATOM 1903 O GLY A 119 7.057 2.714 29.698 1.00 10.39 O ATOM 1904 HA3 GLY A 119 5.618 2.032 27.270 1.00 0.00 H ATOM 1905 HA2 GLY A 119 6.264 0.410 27.614 1.00 0.00 H ATOM 1906 H GLY A 119 4.780 1.720 29.834 1.00 0.00 H ATOM 1907 N ASP A 120 8.356 1.706 28.139 1.00 8.00 N ATOM 1908 CA ASP A 120 9.602 2.316 28.614 1.00 8.88 C ATOM 1909 C ASP A 120 10.502 2.724 27.457 1.00 8.33 C ATOM 1910 O ASP A 120 11.681 3.029 27.642 1.00 10.35 O ATOM 1911 CB ASP A 120 10.337 1.385 29.588 1.00 9.45 C ATOM 1912 CG ASP A 120 10.702 0.046 28.960 1.00 11.69 C ATOM 1913 OD1 ASP A 120 10.678 -0.051 27.709 1.00 12.32 O ATOM 1914 OD2 ASP A 120 11.029 -0.903 29.722 1.00 14.68 O ATOM 1915 HA ASP A 120 9.336 3.224 29.155 1.00 0.00 H ATOM 1916 HB2 ASP A 120 11.252 1.877 29.917 1.00 0.00 H ATOM 1917 HB3 ASP A 120 9.694 1.203 30.449 1.00 0.00 H ATOM 1918 H ASP A 120 8.388 1.041 27.340 1.00 0.00 H ATOM 1919 N THR A 121 9.924 2.751 26.262 1.00 7.65 N ATOM 1920 CA THR A 121 10.619 3.253 25.089 1.00 8.21 C ATOM 1921 C THR A 121 9.557 3.770 24.115 1.00 7.36 C ATOM 1922 O THR A 121 8.434 3.242 24.061 1.00 7.55 O ATOM 1923 CB THR A 121 11.554 2.188 24.466 1.00 10.09 C ATOM 1924 OG1 THR A 121 12.198 2.713 23.306 1.00 12.16 O ATOM 1925 CG2 THR A 121 10.806 0.938 24.093 1.00 9.19 C ATOM 1926 HA THR A 121 11.287 4.071 25.361 1.00 0.00 H ATOM 1927 HB THR A 121 12.298 1.931 25.220 1.00 0.00 H ATOM 1928 HG1 THR A 121 12.733 3.507 23.558 1.00 0.00 H ATOM 1929 HG23 THR A 121 10.313 0.534 24.977 1.00 0.00 H ATOM 1930 HG21 THR A 121 10.059 1.175 23.335 1.00 0.00 H ATOM 1931 HG22 THR A 121 11.506 0.202 23.697 1.00 0.00 H ATOM 1932 H THR A 121 8.949 2.404 26.163 1.00 0.00 H ATOM 1933 N PHE A 122 9.896 4.835 23.394 1.00 6.94 N ATOM 1934 CA PHE A 122 8.892 5.692 22.757 1.00 7.32 C ATOM 1935 C PHE A 122 9.317 6.122 21.364 1.00 8.17 C ATOM 1936 O PHE A 122 10.487 6.438 21.127 1.00 9.44 O ATOM 1937 CB PHE A 122 8.654 6.946 23.613 1.00 8.23 C ATOM 1938 CG PHE A 122 8.204 6.634 24.993 1.00 7.59 C ATOM 1939 CD1 PHE A 122 6.856 6.471 25.275 1.00 9.64 C ATOM 1940 CD2 PHE A 122 9.127 6.450 26.012 1.00 8.22 C ATOM 1941 CE1 PHE A 122 6.442 6.141 26.558 1.00 9.92 C ATOM 1942 CE2 PHE A 122 8.716 6.121 27.301 1.00 9.16 C ATOM 1943 CZ PHE A 122 7.371 5.967 27.570 1.00 10.20 C ATOM 1944 HA PHE A 122 7.975 5.109 22.673 1.00 0.00 H ATOM 1945 HB2 PHE A 122 9.586 7.509 23.671 1.00 0.00 H ATOM 1946 HB3 PHE A 122 7.892 7.557 23.129 1.00 0.00 H ATOM 1947 HD2 PHE A 122 10.190 6.565 25.800 1.00 0.00 H ATOM 1948 HE2 PHE A 122 9.452 5.986 28.093 1.00 0.00 H ATOM 1949 HZ PHE A 122 7.041 5.709 28.576 1.00 0.00 H ATOM 1950 HE1 PHE A 122 5.380 6.018 26.770 1.00 0.00 H ATOM 1951 HD1 PHE A 122 6.117 6.603 24.484 1.00 0.00 H ATOM 1952 H PHE A 122 10.903 5.067 23.279 1.00 0.00 H ATOM 1953 N PHE A 123 8.353 6.136 20.451 1.00 7.63 N ATOM 1954 CA PHE A 123 8.542 6.734 19.133 1.00 7.20 C ATOM 1955 C PHE A 123 8.530 8.263 19.292 1.00 8.43 C ATOM 1956 O PHE A 123 7.784 8.785 20.110 1.00 8.92 O ATOM 1957 CB PHE A 123 7.393 6.306 18.212 1.00 7.78 C ATOM 1958 CG PHE A 123 7.643 6.588 16.760 1.00 5.76 C ATOM 1959 CD1 PHE A 123 8.576 5.846 16.053 1.00 6.76 C ATOM 1960 CD2 PHE A 123 6.950 7.601 16.096 1.00 7.11 C ATOM 1961 CE1 PHE A 123 8.815 6.094 14.713 1.00 7.62 C ATOM 1962 CE2 PHE A 123 7.187 7.844 14.750 1.00 7.83 C ATOM 1963 CZ PHE A 123 8.119 7.093 14.063 1.00 8.62 C ATOM 1964 HA PHE A 123 9.488 6.408 18.700 1.00 0.00 H ATOM 1965 HB2 PHE A 123 7.237 5.234 18.332 1.00 0.00 H ATOM 1966 HB3 PHE A 123 6.492 6.839 18.516 1.00 0.00 H ATOM 1967 HD2 PHE A 123 6.220 8.204 16.636 1.00 0.00 H ATOM 1968 HE2 PHE A 123 6.635 8.630 14.234 1.00 0.00 H ATOM 1969 HZ PHE A 123 8.305 7.289 13.007 1.00 0.00 H ATOM 1970 HE1 PHE A 123 9.552 5.501 14.171 1.00 0.00 H ATOM 1971 HD1 PHE A 123 9.129 5.056 16.560 1.00 0.00 H ATOM 1972 H PHE A 123 7.434 5.707 20.682 1.00 0.00 H ATOM 1973 N PRO A 124 9.346 8.987 18.505 1.00 8.90 N ATOM 1974 CA PRO A 124 9.341 10.447 18.642 1.00 10.35 C ATOM 1975 C PRO A 124 7.995 11.074 18.270 1.00 10.50 C ATOM 1976 O PRO A 124 7.267 10.544 17.428 1.00 10.23 O ATOM 1977 CB PRO A 124 10.439 10.908 17.673 1.00 11.55 C ATOM 1978 CG PRO A 124 10.735 9.761 16.803 1.00 12.18 C ATOM 1979 CD PRO A 124 10.318 8.513 17.507 1.00 10.23 C ATOM 1980 HA PRO A 124 9.512 10.752 19.674 1.00 0.00 H ATOM 1981 HD3 PRO A 124 9.854 7.811 16.814 1.00 0.00 H ATOM 1982 HD2 PRO A 124 11.170 8.035 17.990 1.00 0.00 H ATOM 1983 HG3 PRO A 124 11.804 9.725 16.592 1.00 0.00 H ATOM 1984 HG2 PRO A 124 10.184 9.857 15.867 1.00 0.00 H ATOM 1985 HB2 PRO A 124 10.088 11.751 17.079 1.00 0.00 H ATOM 1986 HB3 PRO A 124 11.331 11.202 18.226 1.00 0.00 H ATOM 1987 N PRO A 125 7.650 12.199 18.912 1.00 11.03 N ATOM 1988 CA PRO A 125 6.420 12.877 18.546 1.00 11.96 C ATOM 1989 C PRO A 125 6.477 13.389 17.118 1.00 12.58 C ATOM 1990 O PRO A 125 7.546 13.738 16.612 1.00 13.57 O ATOM 1991 CB PRO A 125 6.324 14.032 19.545 1.00 13.90 C ATOM 1992 CG PRO A 125 7.632 14.136 20.175 1.00 15.97 C ATOM 1993 CD PRO A 125 8.380 12.872 19.995 1.00 13.27 C ATOM 1994 HA PRO A 125 5.553 12.218 18.584 1.00 0.00 H ATOM 1995 HD3 PRO A 125 9.413 13.067 19.708 1.00 0.00 H ATOM 1996 HD2 PRO A 125 8.364 12.275 20.907 1.00 0.00 H ATOM 1997 HG3 PRO A 125 7.506 14.333 21.240 1.00 0.00 H ATOM 1998 HG2 PRO A 125 8.189 14.954 19.719 1.00 0.00 H ATOM 1999 HB2 PRO A 125 6.079 14.960 19.028 1.00 0.00 H ATOM 2000 HB3 PRO A 125 5.560 13.822 20.293 1.00 0.00 H ATOM 2001 N TYR A 126 5.327 13.392 16.466 1.00 12.26 N ATOM 2002 CA TYR A 126 5.227 13.906 15.111 1.00 12.17 C ATOM 2003 C TYR A 126 3.871 14.547 14.948 1.00 13.63 C ATOM 2004 O TYR A 126 2.934 14.218 15.668 1.00 15.89 O ATOM 2005 CB TYR A 126 5.459 12.801 14.072 1.00 11.27 C ATOM 2006 CG TYR A 126 4.511 11.625 14.177 1.00 9.87 C ATOM 2007 CD1 TYR A 126 4.777 10.563 15.035 1.00 9.76 C ATOM 2008 CD2 TYR A 126 3.358 11.567 13.398 1.00 10.87 C ATOM 2009 CE1 TYR A 126 3.909 9.483 15.123 1.00 9.47 C ATOM 2010 CE2 TYR A 126 2.490 10.504 13.483 1.00 10.62 C ATOM 2011 CZ TYR A 126 2.764 9.462 14.339 1.00 8.40 C ATOM 2012 OH TYR A 126 1.878 8.409 14.401 1.00 10.29 O ATOM 2013 HA TYR A 126 6.005 14.650 14.942 1.00 0.00 H ATOM 2014 HB3 TYR A 126 6.476 12.429 14.193 1.00 0.00 H ATOM 2015 HB2 TYR A 126 5.349 13.239 13.080 1.00 0.00 H ATOM 2016 HD2 TYR A 126 3.139 12.381 12.707 1.00 0.00 H ATOM 2017 HE2 TYR A 126 1.587 10.487 12.873 1.00 0.00 H ATOM 2018 HE1 TYR A 126 4.125 8.658 15.802 1.00 0.00 H ATOM 2019 HD1 TYR A 126 5.679 10.579 15.647 1.00 0.00 H ATOM 2020 HH TYR A 126 2.206 7.741 15.055 1.00 0.00 H ATOM 2021 H TYR A 126 4.476 13.019 16.933 1.00 0.00 H ATOM 2022 N THR A 127 3.761 15.455 13.991 1.00 14.17 N ATOM 2023 CA THR A 127 2.525 16.196 13.829 1.00 14.91 C ATOM 2024 C THR A 127 1.986 16.063 12.411 1.00 14.47 C ATOM 2025 O THR A 127 2.750 15.954 11.453 1.00 13.84 O ATOM 2026 CB THR A 127 2.701 17.683 14.235 1.00 15.14 C ATOM 2027 OG1 THR A 127 1.567 18.439 13.808 1.00 16.24 O ATOM 2028 CG2 THR A 127 3.971 18.278 13.640 1.00 14.95 C ATOM 2029 HA THR A 127 1.786 15.761 14.502 1.00 0.00 H ATOM 2030 HB THR A 127 2.785 17.727 15.321 1.00 0.00 H ATOM 2031 HG1 THR A 127 0.751 18.077 14.235 1.00 0.00 H ATOM 2032 HG23 THR A 127 4.832 17.697 13.970 1.00 0.00 H ATOM 2033 HG21 THR A 127 3.908 18.252 12.552 1.00 0.00 H ATOM 2034 HG22 THR A 127 4.078 19.310 13.974 1.00 0.00 H ATOM 2035 H THR A 127 4.563 15.637 13.354 1.00 0.00 H ATOM 2036 N PHE A 128 0.664 16.058 12.279 1.00 15.45 N ATOM 2037 CA PHE A 128 0.048 15.976 10.972 1.00 17.12 C ATOM 2038 C PHE A 128 0.131 17.300 10.217 1.00 17.31 C ATOM 2039 O PHE A 128 -0.388 17.434 9.117 1.00 19.38 O ATOM 2040 CB PHE A 128 -1.359 15.396 11.072 1.00 18.25 C ATOM 2041 CG PHE A 128 -1.371 13.952 11.498 1.00 19.73 C ATOM 2042 CD1 PHE A 128 -1.056 12.950 10.592 1.00 19.14 C ATOM 2043 CD2 PHE A 128 -1.659 13.597 12.807 1.00 21.95 C ATOM 2044 CE1 PHE A 128 -1.049 11.618 10.978 1.00 19.90 C ATOM 2045 CE2 PHE A 128 -1.657 12.265 13.199 1.00 24.20 C ATOM 2046 CZ PHE A 128 -1.353 11.276 12.282 1.00 21.88 C ATOM 2047 HA PHE A 128 0.618 15.276 10.361 1.00 0.00 H ATOM 2048 HB2 PHE A 128 -1.924 15.978 11.800 1.00 0.00 H ATOM 2049 HB3 PHE A 128 -1.838 15.474 10.096 1.00 0.00 H ATOM 2050 HD2 PHE A 128 -1.890 14.373 13.537 1.00 0.00 H ATOM 2051 HE2 PHE A 128 -1.895 11.999 14.229 1.00 0.00 H ATOM 2052 HZ PHE A 128 -1.353 10.229 12.587 1.00 0.00 H ATOM 2053 HE1 PHE A 128 -0.804 10.841 10.253 1.00 0.00 H ATOM 2054 HD1 PHE A 128 -0.811 13.213 9.563 1.00 0.00 H ATOM 2055 H PHE A 128 0.064 16.114 13.126 1.00 0.00 H ATOM 2056 N GLU A 129 0.808 18.282 10.807 1.00 16.58 N ATOM 2057 CA GLU A 129 1.289 19.424 10.037 1.00 17.31 C ATOM 2058 C GLU A 129 2.476 19.063 9.143 1.00 16.37 C ATOM 2059 O GLU A 129 2.695 19.691 8.106 1.00 17.59 O ATOM 2060 CB GLU A 129 1.643 20.598 10.954 1.00 18.47 C ATOM 2061 CG GLU A 129 0.574 20.926 11.991 1.00 22.77 C ATOM 2062 CD GLU A 129 -0.474 21.904 11.493 1.00 27.04 C ATOM 2063 OE1 GLU A 129 -0.268 22.535 10.431 1.00 27.56 O ATOM 2064 OE2 GLU A 129 -1.509 22.050 12.182 1.00 29.73 O ATOM 2065 HA GLU A 129 0.472 19.728 9.383 1.00 0.00 H ATOM 2066 HB2 GLU A 129 2.566 20.355 11.480 1.00 0.00 H ATOM 2067 HB3 GLU A 129 1.801 21.481 10.334 1.00 0.00 H ATOM 2068 HG2 GLU A 129 0.074 20.000 12.276 1.00 0.00 H ATOM 2069 HG3 GLU A 129 1.062 21.358 12.865 1.00 0.00 H ATOM 2070 H GLU A 129 0.996 18.235 11.829 1.00 0.00 H ATOM 2071 N ASP A 130 3.236 18.043 9.538 1.00 14.57 N ATOM 2072 CA ASP A 130 4.412 17.626 8.760 1.00 12.92 C ATOM 2073 C ASP A 130 4.137 16.399 7.895 1.00 12.76 C ATOM 2074 O ASP A 130 4.902 16.090 6.980 1.00 12.72 O ATOM 2075 CB ASP A 130 5.593 17.323 9.682 1.00 12.95 C ATOM 2076 CG ASP A 130 6.144 18.562 10.354 1.00 14.62 C ATOM 2077 OD1 ASP A 130 6.058 19.658 9.757 1.00 20.04 O ATOM 2078 OD2 ASP A 130 6.662 18.438 11.483 1.00 17.75 O ATOM 2079 HA ASP A 130 4.653 18.461 8.103 1.00 0.00 H ATOM 2080 HB2 ASP A 130 5.264 16.625 10.452 1.00 0.00 H ATOM 2081 HB3 ASP A 130 6.387 16.864 9.093 1.00 0.00 H ATOM 2082 H ASP A 130 2.994 17.533 10.411 1.00 0.00 H ATOM 2083 N TRP A 131 3.049 15.704 8.208 1.00 11.71 N ATOM 2084 CA TRP A 131 2.752 14.401 7.612 1.00 11.34 C ATOM 2085 C TRP A 131 1.317 14.345 7.110 1.00 12.30 C ATOM 2086 O TRP A 131 0.390 14.769 7.802 1.00 15.01 O ATOM 2087 CB TRP A 131 2.994 13.276 8.631 1.00 10.85 C ATOM 2088 CG TRP A 131 4.428 13.159 9.042 1.00 10.27 C ATOM 2089 CD1 TRP A 131 5.005 13.677 10.168 1.00 10.51 C ATOM 2090 CD2 TRP A 131 5.484 12.522 8.306 1.00 9.69 C ATOM 2091 NE1 TRP A 131 6.345 13.383 10.189 1.00 10.39 N ATOM 2092 CE2 TRP A 131 6.666 12.675 9.059 1.00 9.75 C ATOM 2093 CE3 TRP A 131 5.542 11.834 7.086 1.00 10.06 C ATOM 2094 CZ2 TRP A 131 7.899 12.157 8.638 1.00 10.58 C ATOM 2095 CZ3 TRP A 131 6.769 11.314 6.669 1.00 10.49 C ATOM 2096 CH2 TRP A 131 7.932 11.485 7.445 1.00 11.02 C ATOM 2097 HA TRP A 131 3.421 14.261 6.763 1.00 0.00 H ATOM 2098 HB2 TRP A 131 2.393 13.475 9.518 1.00 0.00 H ATOM 2099 HB3 TRP A 131 2.681 12.331 8.187 1.00 0.00 H ATOM 2100 HE1 TRP A 131 7.010 13.654 10.941 1.00 0.00 H ATOM 2101 HD1 TRP A 131 4.477 14.241 10.937 1.00 0.00 H ATOM 2102 HZ2 TRP A 131 8.799 12.285 9.239 1.00 0.00 H ATOM 2103 HH2 TRP A 131 8.877 11.074 7.089 1.00 0.00 H ATOM 2104 HZ3 TRP A 131 6.828 10.767 5.728 1.00 0.00 H ATOM 2105 HE3 TRP A 131 4.648 11.708 6.476 1.00 0.00 H ATOM 2106 H TRP A 131 2.384 16.101 8.902 1.00 0.00 H ATOM 2107 N GLU A 132 1.150 13.813 5.904 1.00 12.63 N ATOM 2108 CA GLU A 132 -0.163 13.612 5.289 1.00 12.87 C ATOM 2109 C GLU A 132 -0.519 12.128 5.338 1.00 12.26 C ATOM 2110 O GLU A 132 0.311 11.287 5.014 1.00 10.36 O ATOM 2111 CB GLU A 132 -0.129 14.070 3.823 1.00 15.00 C ATOM 2112 CG GLU A 132 -1.457 13.933 3.094 1.00 19.29 C ATOM 2113 CD GLU A 132 -2.366 15.133 3.306 1.00 22.41 C ATOM 2114 OE1 GLU A 132 -1.860 16.278 3.307 1.00 24.22 O ATOM 2115 OE2 GLU A 132 -3.587 14.930 3.469 1.00 26.35 O ATOM 2116 HA GLU A 132 -0.907 14.194 5.833 1.00 0.00 H ATOM 2117 HB2 GLU A 132 0.167 15.119 3.799 1.00 0.00 H ATOM 2118 HB3 GLU A 132 0.614 13.472 3.295 1.00 0.00 H ATOM 2119 HG2 GLU A 132 -1.261 13.827 2.027 1.00 0.00 H ATOM 2120 HG3 GLU A 132 -1.966 13.041 3.459 1.00 0.00 H ATOM 2121 H GLU A 132 1.995 13.525 5.370 1.00 0.00 H ATOM 2122 N VAL A 133 -1.753 11.818 5.727 1.00 12.47 N ATOM 2123 CA VAL A 133 -2.250 10.445 5.688 1.00 13.19 C ATOM 2124 C VAL A 133 -2.592 10.050 4.256 1.00 12.46 C ATOM 2125 O VAL A 133 -3.540 10.579 3.659 1.00 15.26 O ATOM 2126 CB VAL A 133 -3.504 10.291 6.561 1.00 14.07 C ATOM 2127 CG1 VAL A 133 -4.057 8.871 6.454 1.00 17.07 C ATOM 2128 CG2 VAL A 133 -3.190 10.648 7.994 1.00 18.28 C ATOM 2129 HA VAL A 133 -1.465 9.795 6.074 1.00 0.00 H ATOM 2130 HB VAL A 133 -4.271 10.977 6.201 1.00 0.00 H ATOM 2131 HG11 VAL A 133 -4.318 8.661 5.417 1.00 0.00 H ATOM 2132 HG12 VAL A 133 -3.301 8.162 6.790 1.00 0.00 H ATOM 2133 HG13 VAL A 133 -4.945 8.780 7.079 1.00 0.00 H ATOM 2134 HG21 VAL A 133 -2.410 9.986 8.370 1.00 0.00 H ATOM 2135 HG22 VAL A 133 -2.846 11.681 8.043 1.00 0.00 H ATOM 2136 HG23 VAL A 133 -4.088 10.534 8.601 1.00 0.00 H ATOM 2137 H VAL A 133 -2.381 12.574 6.068 1.00 0.00 H ATOM 2138 N ALA A 134 -1.801 9.142 3.695 1.00 10.11 N ATOM 2139 CA ALA A 134 -2.069 8.603 2.364 1.00 10.37 C ATOM 2140 C ALA A 134 -3.041 7.441 2.385 1.00 10.51 C ATOM 2141 O ALA A 134 -3.822 7.251 1.446 1.00 11.43 O ATOM 2142 CB ALA A 134 -0.775 8.199 1.669 1.00 11.53 C ATOM 2143 HA ALA A 134 -2.542 9.405 1.797 1.00 0.00 H ATOM 2144 HB1 ALA A 134 -0.129 9.072 1.570 1.00 0.00 H ATOM 2145 HB2 ALA A 134 -0.269 7.436 2.261 1.00 0.00 H ATOM 2146 HB3 ALA A 134 -1.004 7.801 0.680 1.00 0.00 H ATOM 2147 H ALA A 134 -0.968 8.805 4.218 1.00 0.00 H ATOM 2148 N SER A 135 -2.994 6.646 3.445 1.00 9.29 N ATOM 2149 CA SER A 135 -3.966 5.583 3.606 1.00 9.61 C ATOM 2150 C SER A 135 -4.105 5.224 5.069 1.00 9.33 C ATOM 2151 O SER A 135 -3.136 5.267 5.833 1.00 9.25 O ATOM 2152 CB SER A 135 -3.569 4.355 2.788 1.00 9.61 C ATOM 2153 OG SER A 135 -2.414 3.740 3.339 1.00 7.62 O ATOM 2154 HA SER A 135 -4.929 5.936 3.238 1.00 0.00 H ATOM 2155 HB2 SER A 135 -3.359 4.660 1.763 1.00 0.00 H ATOM 2156 HB3 SER A 135 -4.392 3.640 2.792 1.00 0.00 H ATOM 2157 HG SER A 135 -2.603 3.459 4.269 1.00 0.00 H ATOM 2158 H SER A 135 -2.256 6.786 4.164 1.00 0.00 H ATOM 2159 N SER A 136 -5.329 4.898 5.453 1.00 11.35 N ATOM 2160 CA SER A 136 -5.651 4.500 6.812 1.00 11.56 C ATOM 2161 C SER A 136 -6.622 3.329 6.720 1.00 13.00 C ATOM 2162 O SER A 136 -7.672 3.438 6.074 1.00 15.37 O ATOM 2163 CB SER A 136 -6.294 5.669 7.561 1.00 12.79 C ATOM 2164 OG SER A 136 -6.629 5.298 8.882 1.00 14.91 O ATOM 2165 HA SER A 136 -4.753 4.210 7.357 1.00 0.00 H ATOM 2166 HB2 SER A 136 -7.199 5.975 7.036 1.00 0.00 H ATOM 2167 HB3 SER A 136 -5.593 6.503 7.591 1.00 0.00 H ATOM 2168 HG SER A 136 -7.269 4.543 8.859 1.00 0.00 H ATOM 2169 H SER A 136 -6.095 4.928 4.750 1.00 0.00 H ATOM 2170 N VAL A 137 -6.255 2.205 7.333 1.00 11.52 N ATOM 2171 CA VAL A 137 -7.040 0.965 7.242 1.00 13.50 C ATOM 2172 C VAL A 137 -7.149 0.345 8.632 1.00 12.00 C ATOM 2173 O VAL A 137 -6.142 0.126 9.295 1.00 11.84 O ATOM 2174 CB VAL A 137 -6.360 -0.067 6.300 1.00 13.83 C ATOM 2175 CG1 VAL A 137 -7.136 -1.378 6.280 1.00 17.76 C ATOM 2176 CG2 VAL A 137 -6.217 0.497 4.888 1.00 16.75 C ATOM 2177 HA VAL A 137 -8.023 1.213 6.842 1.00 0.00 H ATOM 2178 HB VAL A 137 -5.362 -0.269 6.688 1.00 0.00 H ATOM 2179 HG11 VAL A 137 -7.172 -1.793 7.287 1.00 0.00 H ATOM 2180 HG12 VAL A 137 -8.150 -1.193 5.925 1.00 0.00 H ATOM 2181 HG13 VAL A 137 -6.639 -2.083 5.613 1.00 0.00 H ATOM 2182 HG21 VAL A 137 -7.204 0.737 4.492 1.00 0.00 H ATOM 2183 HG22 VAL A 137 -5.607 1.400 4.919 1.00 0.00 H ATOM 2184 HG23 VAL A 137 -5.738 -0.245 4.249 1.00 0.00 H ATOM 2185 H VAL A 137 -5.381 2.204 7.897 1.00 0.00 H ATOM 2186 N GLU A 138 -8.365 0.064 9.086 1.00 12.92 N ATOM 2187 CA GLU A 138 -8.524 -0.561 10.389 1.00 13.19 C ATOM 2188 C GLU A 138 -8.122 -2.026 10.333 1.00 12.50 C ATOM 2189 O GLU A 138 -8.529 -2.757 9.428 1.00 14.13 O ATOM 2190 CB GLU A 138 -9.948 -0.398 10.927 1.00 15.94 C ATOM 2191 CG GLU A 138 -10.071 -0.593 12.453 1.00 21.29 C ATOM 2192 CD GLU A 138 -9.271 0.421 13.284 1.00 22.34 C ATOM 2193 OE1 GLU A 138 -8.768 1.416 12.719 1.00 23.41 O ATOM 2194 OE2 GLU A 138 -9.145 0.223 14.517 1.00 20.15 O ATOM 2195 HA GLU A 138 -7.859 -0.050 11.085 1.00 0.00 H ATOM 2196 HB2 GLU A 138 -10.294 0.606 10.681 1.00 0.00 H ATOM 2197 HB3 GLU A 138 -10.586 -1.132 10.435 1.00 0.00 H ATOM 2198 HG2 GLU A 138 -11.123 -0.505 12.725 1.00 0.00 H ATOM 2199 HG3 GLU A 138 -9.716 -1.594 12.700 1.00 0.00 H ATOM 2200 H GLU A 138 -9.201 0.290 8.511 1.00 0.00 H ATOM 2201 N GLY A 139 -7.316 -2.455 11.299 1.00 12.26 N ATOM 2202 CA GLY A 139 -6.934 -3.861 11.391 1.00 12.42 C ATOM 2203 C GLY A 139 -8.076 -4.764 11.815 1.00 13.01 C ATOM 2204 O GLY A 139 -8.935 -4.374 12.615 1.00 12.95 O ATOM 2205 HA3 GLY A 139 -6.129 -3.955 12.120 1.00 0.00 H ATOM 2206 HA2 GLY A 139 -6.578 -4.188 10.414 1.00 0.00 H ATOM 2207 H GLY A 139 -6.952 -1.779 12.000 1.00 0.00 H ATOM 2208 N LYS A 140 -8.075 -5.980 11.277 1.00 13.65 N ATOM 2209 CA LYS A 140 -9.070 -6.980 11.641 1.00 14.49 C ATOM 2210 C LYS A 140 -8.711 -7.650 12.968 1.00 14.20 C ATOM 2211 O LYS A 140 -7.541 -7.902 13.255 1.00 15.37 O ATOM 2212 CB LYS A 140 -9.191 -8.026 10.528 1.00 16.25 C ATOM 2213 CG LYS A 140 -9.914 -7.508 9.296 1.00 21.64 C ATOM 2214 CD LYS A 140 -9.699 -8.393 8.084 1.00 28.05 C ATOM 2215 CE LYS A 140 -10.372 -7.792 6.858 1.00 31.02 C ATOM 2216 NZ LYS A 140 -10.062 -8.562 5.623 1.00 35.14 N ATOM 2217 HA LYS A 140 -10.032 -6.482 11.765 1.00 0.00 H ATOM 2218 HB2 LYS A 140 -8.189 -8.339 10.236 1.00 0.00 H ATOM 2219 HB3 LYS A 140 -9.739 -8.884 10.917 1.00 0.00 H ATOM 2220 HG2 LYS A 140 -10.982 -7.461 9.510 1.00 0.00 H ATOM 2221 HG3 LYS A 140 -9.546 -6.507 9.069 1.00 0.00 H ATOM 2222 HD2 LYS A 140 -8.630 -8.490 7.895 1.00 0.00 H ATOM 2223 HD3 LYS A 140 -10.123 -9.378 8.279 1.00 0.00 H ATOM 2224 HE2 LYS A 140 -10.024 -6.767 6.731 1.00 0.00 H ATOM 2225 HE3 LYS A 140 -11.451 -7.792 7.012 1.00 0.00 H ATOM 2226 HZ1 LYS A 140 -9.034 -8.562 5.465 1.00 0.00 H ATOM 2227 HZ2 LYS A 140 -10.397 -9.540 5.733 1.00 0.00 H ATOM 2228 HZ3 LYS A 140 -10.539 -8.120 4.811 1.00 0.00 H ATOM 2229 H LYS A 140 -7.345 -6.224 10.578 1.00 0.00 H ATOM 2230 N LEU A 141 -9.731 -7.931 13.769 1.00 13.34 N ATOM 2231 CA LEU A 141 -9.544 -8.534 15.075 1.00 14.13 C ATOM 2232 C LEU A 141 -10.015 -9.980 15.050 1.00 14.25 C ATOM 2233 O LEU A 141 -10.944 -10.332 14.325 1.00 16.03 O ATOM 2234 CB LEU A 141 -10.302 -7.739 16.137 1.00 14.89 C ATOM 2235 CG LEU A 141 -9.925 -6.253 16.196 1.00 15.03 C ATOM 2236 CD1 LEU A 141 -10.686 -5.537 17.301 1.00 18.03 C ATOM 2237 CD2 LEU A 141 -8.420 -6.089 16.391 1.00 14.48 C ATOM 2238 HA LEU A 141 -8.484 -8.517 15.327 1.00 0.00 H ATOM 2239 HB2 LEU A 141 -11.368 -7.814 15.924 1.00 0.00 H ATOM 2240 HB3 LEU A 141 -10.095 -8.184 17.110 1.00 0.00 H ATOM 2241 HG LEU A 141 -10.204 -5.798 15.246 1.00 0.00 H ATOM 2242 HD21 LEU A 141 -8.122 -6.567 17.324 1.00 0.00 H ATOM 2243 HD22 LEU A 141 -7.894 -6.555 15.558 1.00 0.00 H ATOM 2244 HD23 LEU A 141 -8.173 -5.028 16.430 1.00 0.00 H ATOM 2245 HD11 LEU A 141 -11.757 -5.618 17.114 1.00 0.00 H ATOM 2246 HD12 LEU A 141 -10.448 -5.996 18.261 1.00 0.00 H ATOM 2247 HD13 LEU A 141 -10.397 -4.486 17.317 1.00 0.00 H ATOM 2248 H LEU A 141 -10.696 -7.712 13.450 1.00 0.00 H ATOM 2249 N ASP A 142 -9.353 -10.816 15.835 1.00 14.91 N ATOM 2250 CA ASP A 142 -9.770 -12.200 16.017 1.00 16.44 C ATOM 2251 C ASP A 142 -9.211 -12.660 17.357 1.00 17.20 C ATOM 2252 O ASP A 142 -8.724 -11.835 18.128 1.00 16.10 O ATOM 2253 CB ASP A 142 -9.274 -13.071 14.857 1.00 17.10 C ATOM 2254 CG ASP A 142 -7.779 -12.936 14.611 1.00 18.78 C ATOM 2255 OD1 ASP A 142 -7.005 -12.867 15.592 1.00 17.39 O ATOM 2256 OD2 ASP A 142 -7.373 -12.890 13.430 1.00 25.29 O ATOM 2257 HA ASP A 142 -10.856 -12.289 16.019 1.00 0.00 H ATOM 2258 HB2 ASP A 142 -9.496 -14.113 15.085 1.00 0.00 H ATOM 2259 HB3 ASP A 142 -9.804 -12.778 13.951 1.00 0.00 H ATOM 2260 H ASP A 142 -8.509 -10.474 16.337 1.00 0.00 H ATOM 2261 N GLU A 143 -9.289 -13.952 17.661 1.00 18.88 N ATOM 2262 CA GLU A 143 -8.908 -14.374 19.012 1.00 20.00 C ATOM 2263 C GLU A 143 -7.432 -14.124 19.331 1.00 18.91 C ATOM 2264 O GLU A 143 -7.065 -13.920 20.494 1.00 19.25 O ATOM 2265 CB GLU A 143 -9.339 -15.812 19.321 1.00 21.52 C ATOM 2266 CG GLU A 143 -8.497 -16.900 18.688 1.00 23.29 C ATOM 2267 CD GLU A 143 -8.873 -18.283 19.201 1.00 23.62 C ATOM 2268 OE1 GLU A 143 -8.565 -19.279 18.514 1.00 25.85 O ATOM 2269 OE2 GLU A 143 -9.485 -18.367 20.283 1.00 27.31 O ATOM 2270 HA GLU A 143 -9.468 -13.729 19.689 1.00 0.00 H ATOM 2271 HB2 GLU A 143 -9.304 -15.947 20.402 1.00 0.00 H ATOM 2272 HB3 GLU A 143 -10.364 -15.937 18.973 1.00 0.00 H ATOM 2273 HG2 GLU A 143 -8.641 -16.874 17.608 1.00 0.00 H ATOM 2274 HG3 GLU A 143 -7.448 -16.712 18.918 1.00 0.00 H ATOM 2275 H GLU A 143 -9.612 -14.646 16.957 1.00 0.00 H ATOM 2276 N LYS A 144 -6.603 -14.100 18.290 1.00 17.73 N ATOM 2277 CA LYS A 144 -5.162 -13.886 18.444 1.00 16.42 C ATOM 2278 C LYS A 144 -4.753 -12.425 18.253 1.00 14.95 C ATOM 2279 O LYS A 144 -3.602 -12.060 18.492 1.00 15.80 O ATOM 2280 CB LYS A 144 -4.393 -14.772 17.470 1.00 18.34 C ATOM 2281 CG LYS A 144 -4.558 -16.261 17.761 1.00 22.63 C ATOM 2282 CD LYS A 144 -3.816 -17.126 16.758 1.00 29.21 C ATOM 2283 CE LYS A 144 -3.412 -18.454 17.387 1.00 33.46 C ATOM 2284 NZ LYS A 144 -3.761 -19.615 16.523 1.00 36.59 N ATOM 2285 HA LYS A 144 -4.912 -14.156 19.470 1.00 0.00 H ATOM 2286 HB2 LYS A 144 -4.753 -14.573 16.461 1.00 0.00 H ATOM 2287 HB3 LYS A 144 -3.334 -14.521 17.533 1.00 0.00 H ATOM 2288 HG2 LYS A 144 -4.171 -16.469 18.759 1.00 0.00 H ATOM 2289 HG3 LYS A 144 -5.618 -16.511 17.724 1.00 0.00 H ATOM 2290 HD2 LYS A 144 -4.463 -17.317 15.902 1.00 0.00 H ATOM 2291 HD3 LYS A 144 -2.921 -16.601 16.425 1.00 0.00 H ATOM 2292 HE2 LYS A 144 -3.925 -18.561 18.343 1.00 0.00 H ATOM 2293 HE3 LYS A 144 -2.335 -18.451 17.553 1.00 0.00 H ATOM 2294 HZ1 LYS A 144 -4.789 -19.631 16.365 1.00 0.00 H ATOM 2295 HZ2 LYS A 144 -3.270 -19.527 15.611 1.00 0.00 H ATOM 2296 HZ3 LYS A 144 -3.467 -20.495 16.992 1.00 0.00 H ATOM 2297 H LYS A 144 -6.991 -14.238 17.335 1.00 0.00 H ATOM 2298 N ASN A 145 -5.702 -11.594 17.837 1.00 12.85 N ATOM 2299 CA ASN A 145 -5.462 -10.167 17.612 1.00 12.29 C ATOM 2300 C ASN A 145 -6.594 -9.381 18.239 1.00 12.74 C ATOM 2301 O ASN A 145 -7.611 -9.133 17.591 1.00 13.51 O ATOM 2302 CB ASN A 145 -5.421 -9.861 16.116 1.00 11.74 C ATOM 2303 CG ASN A 145 -4.269 -10.532 15.429 1.00 12.34 C ATOM 2304 OD1 ASN A 145 -3.172 -9.982 15.372 1.00 12.41 O ATOM 2305 ND2 ASN A 145 -4.496 -11.747 14.934 1.00 14.06 N ATOM 2306 HA ASN A 145 -4.506 -9.891 18.057 1.00 0.00 H ATOM 2307 HB2 ASN A 145 -6.350 -10.206 15.662 1.00 0.00 H ATOM 2308 HB3 ASN A 145 -5.331 -8.783 15.981 1.00 0.00 H ATOM 2309 HD22 ASN A 145 -5.443 -12.170 15.007 1.00 0.00 H ATOM 2310 HD21 ASN A 145 -3.726 -12.273 14.474 1.00 0.00 H ATOM 2311 H ASN A 145 -6.655 -11.972 17.664 1.00 0.00 H ATOM 2312 N THR A 146 -6.426 -9.002 19.500 1.00 12.50 N ATOM 2313 CA THR A 146 -7.556 -8.511 20.281 1.00 14.16 C ATOM 2314 C THR A 146 -7.543 -7.008 20.531 1.00 13.43 C ATOM 2315 O THR A 146 -8.538 -6.448 20.984 1.00 15.45 O ATOM 2316 CB THR A 146 -7.676 -9.247 21.627 1.00 16.19 C ATOM 2317 OG1 THR A 146 -6.501 -9.002 22.405 1.00 20.66 O ATOM 2318 CG2 THR A 146 -7.860 -10.743 21.411 1.00 19.52 C ATOM 2319 HA THR A 146 -8.426 -8.723 19.660 1.00 0.00 H ATOM 2320 HB THR A 146 -8.551 -8.873 22.158 1.00 0.00 H ATOM 2321 HG1 THR A 146 -5.707 -9.333 21.915 1.00 0.00 H ATOM 2322 HG23 THR A 146 -8.758 -10.915 20.817 1.00 0.00 H ATOM 2323 HG21 THR A 146 -6.993 -11.142 20.885 1.00 0.00 H ATOM 2324 HG22 THR A 146 -7.961 -11.239 22.377 1.00 0.00 H ATOM 2325 H THR A 146 -5.482 -9.055 19.934 1.00 0.00 H ATOM 2326 N ILE A 147 -6.422 -6.345 20.249 1.00 12.35 N ATOM 2327 CA ILE A 147 -6.361 -4.897 20.441 1.00 13.58 C ATOM 2328 C ILE A 147 -6.622 -4.201 19.113 1.00 11.09 C ATOM 2329 O ILE A 147 -5.969 -4.512 18.119 1.00 9.85 O ATOM 2330 CB ILE A 147 -5.004 -4.403 21.017 1.00 16.44 C ATOM 2331 CG1 ILE A 147 -5.068 -2.905 21.336 1.00 18.26 C ATOM 2332 CG2 ILE A 147 -3.881 -4.657 20.054 1.00 20.04 C ATOM 2333 CD1 ILE A 147 -5.917 -2.565 22.523 1.00 22.34 C ATOM 2334 HA ILE A 147 -7.126 -4.647 21.176 1.00 0.00 H ATOM 2335 HB ILE A 147 -4.814 -4.962 21.933 1.00 0.00 H ATOM 2336 HG12 ILE A 147 -4.055 -2.553 21.528 1.00 0.00 H ATOM 2337 HG13 ILE A 147 -5.473 -2.387 20.466 1.00 0.00 H ATOM 2338 HD11 ILE A 147 -6.939 -2.898 22.344 1.00 0.00 H ATOM 2339 HD12 ILE A 147 -5.520 -3.064 23.407 1.00 0.00 H ATOM 2340 HD13 ILE A 147 -5.907 -1.486 22.678 1.00 0.00 H ATOM 2341 HG21 ILE A 147 -3.807 -5.727 19.858 1.00 0.00 H ATOM 2342 HG22 ILE A 147 -4.077 -4.128 19.121 1.00 0.00 H ATOM 2343 HG23 ILE A 147 -2.946 -4.300 20.486 1.00 0.00 H ATOM 2344 H ILE A 147 -5.590 -6.858 19.892 1.00 0.00 H ATOM 2345 N PRO A 148 -7.570 -3.250 19.095 1.00 10.92 N ATOM 2346 CA PRO A 148 -7.799 -2.453 17.897 1.00 10.54 C ATOM 2347 C PRO A 148 -6.507 -1.792 17.428 1.00 9.31 C ATOM 2348 O PRO A 148 -5.693 -1.336 18.246 1.00 9.15 O ATOM 2349 CB PRO A 148 -8.831 -1.414 18.354 1.00 11.09 C ATOM 2350 CG PRO A 148 -9.550 -2.074 19.461 1.00 13.63 C ATOM 2351 CD PRO A 148 -8.492 -2.870 20.183 1.00 11.97 C ATOM 2352 HA PRO A 148 -8.145 -3.042 17.048 1.00 0.00 H ATOM 2353 HD3 PRO A 148 -7.986 -2.262 20.933 1.00 0.00 H ATOM 2354 HD2 PRO A 148 -8.921 -3.751 20.661 1.00 0.00 H ATOM 2355 HG3 PRO A 148 -10.330 -2.731 19.076 1.00 0.00 H ATOM 2356 HG2 PRO A 148 -9.996 -1.334 20.126 1.00 0.00 H ATOM 2357 HB2 PRO A 148 -8.337 -0.506 18.701 1.00 0.00 H ATOM 2358 HB3 PRO A 148 -9.515 -1.166 17.542 1.00 0.00 H ATOM 2359 N HIS A 149 -6.311 -1.763 16.117 1.00 7.82 N ATOM 2360 CA HIS A 149 -5.102 -1.169 15.543 1.00 8.15 C ATOM 2361 C HIS A 149 -5.414 -0.649 14.149 1.00 8.06 C ATOM 2362 O HIS A 149 -6.343 -1.131 13.493 1.00 9.07 O ATOM 2363 CB HIS A 149 -3.944 -2.187 15.513 1.00 9.19 C ATOM 2364 CG HIS A 149 -4.277 -3.485 14.830 1.00 7.79 C ATOM 2365 ND1 HIS A 149 -5.123 -4.429 15.377 1.00 8.90 N ATOM 2366 CD2 HIS A 149 -3.843 -4.006 13.657 1.00 9.44 C ATOM 2367 CE1 HIS A 149 -5.213 -5.465 14.560 1.00 9.48 C ATOM 2368 NE2 HIS A 149 -4.439 -5.239 13.512 1.00 9.62 N ATOM 2369 HA HIS A 149 -4.780 -0.337 16.169 1.00 0.00 H ATOM 2370 HB2 HIS A 149 -3.103 -1.732 14.990 1.00 0.00 H ATOM 2371 HB3 HIS A 149 -3.655 -2.406 16.541 1.00 0.00 H ATOM 2372 HD2 HIS A 149 -3.151 -3.537 12.958 1.00 0.00 H ATOM 2373 HE1 HIS A 149 -5.822 -6.354 14.723 1.00 0.00 H ATOM 2374 H HIS A 149 -7.029 -2.170 15.485 1.00 0.00 H ATOM 2375 N THR A 150 -4.647 0.341 13.710 1.00 7.95 N ATOM 2376 CA THR A 150 -4.894 1.016 12.445 1.00 9.14 C ATOM 2377 C THR A 150 -3.589 1.094 11.674 1.00 7.83 C ATOM 2378 O THR A 150 -2.571 1.495 12.224 1.00 8.60 O ATOM 2379 CB THR A 150 -5.396 2.433 12.703 1.00 10.22 C ATOM 2380 OG1 THR A 150 -6.481 2.392 13.639 1.00 13.67 O ATOM 2381 CG2 THR A 150 -5.846 3.103 11.415 1.00 11.05 C ATOM 2382 HA THR A 150 -5.643 0.464 11.878 1.00 0.00 H ATOM 2383 HB THR A 150 -4.575 3.019 13.115 1.00 0.00 H ATOM 2384 HG1 THR A 150 -7.216 1.843 13.267 1.00 0.00 H ATOM 2385 HG23 THR A 150 -5.014 3.129 10.711 1.00 0.00 H ATOM 2386 HG21 THR A 150 -6.672 2.539 10.983 1.00 0.00 H ATOM 2387 HG22 THR A 150 -6.173 4.120 11.631 1.00 0.00 H ATOM 2388 H THR A 150 -3.840 0.645 14.291 1.00 0.00 H ATOM 2389 N PHE A 151 -3.615 0.692 10.407 1.00 7.36 N ATOM 2390 CA PHE A 151 -2.439 0.805 9.559 1.00 7.59 C ATOM 2391 C PHE A 151 -2.462 2.122 8.800 1.00 7.82 C ATOM 2392 O PHE A 151 -3.388 2.376 8.018 1.00 9.21 O ATOM 2393 CB PHE A 151 -2.382 -0.358 8.560 1.00 7.51 C ATOM 2394 CG PHE A 151 -2.308 -1.722 9.215 1.00 7.37 C ATOM 2395 CD1 PHE A 151 -1.186 -2.103 9.938 1.00 7.96 C ATOM 2396 CD2 PHE A 151 -3.360 -2.618 9.105 1.00 10.13 C ATOM 2397 CE1 PHE A 151 -1.109 -3.365 10.533 1.00 8.83 C ATOM 2398 CE2 PHE A 151 -3.295 -3.876 9.695 1.00 10.10 C ATOM 2399 CZ PHE A 151 -2.169 -4.248 10.415 1.00 8.50 C ATOM 2400 HA PHE A 151 -1.555 0.771 10.196 1.00 0.00 H ATOM 2401 HB2 PHE A 151 -3.277 -0.322 7.939 1.00 0.00 H ATOM 2402 HB3 PHE A 151 -1.500 -0.229 7.932 1.00 0.00 H ATOM 2403 HD2 PHE A 151 -4.252 -2.332 8.548 1.00 0.00 H ATOM 2404 HE2 PHE A 151 -4.129 -4.570 9.592 1.00 0.00 H ATOM 2405 HZ PHE A 151 -2.119 -5.230 10.885 1.00 0.00 H ATOM 2406 HE1 PHE A 151 -0.217 -3.654 11.089 1.00 0.00 H ATOM 2407 HD1 PHE A 151 -0.353 -1.408 10.043 1.00 0.00 H ATOM 2408 H PHE A 151 -4.491 0.290 10.016 1.00 0.00 H ATOM 2409 N LEU A 152 -1.447 2.954 9.031 1.00 8.81 N ATOM 2410 CA LEU A 152 -1.298 4.243 8.335 1.00 9.46 C ATOM 2411 C LEU A 152 -0.106 4.232 7.399 1.00 9.71 C ATOM 2412 O LEU A 152 0.954 3.706 7.744 1.00 10.46 O ATOM 2413 CB LEU A 152 -1.070 5.378 9.336 1.00 11.21 C ATOM 2414 CG LEU A 152 -2.088 5.590 10.457 1.00 10.26 C ATOM 2415 CD1 LEU A 152 -1.639 6.776 11.314 1.00 12.88 C ATOM 2416 CD2 LEU A 152 -3.464 5.871 9.854 1.00 14.58 C ATOM 2417 HA LEU A 152 -2.219 4.399 7.773 1.00 0.00 H ATOM 2418 HB2 LEU A 152 -0.105 5.198 9.810 1.00 0.00 H ATOM 2419 HB3 LEU A 152 -1.026 6.305 8.764 1.00 0.00 H ATOM 2420 HG LEU A 152 -2.152 4.695 11.076 1.00 0.00 H ATOM 2421 HD21 LEU A 152 -3.412 6.768 9.237 1.00 0.00 H ATOM 2422 HD22 LEU A 152 -3.771 5.023 9.241 1.00 0.00 H ATOM 2423 HD23 LEU A 152 -4.187 6.022 10.656 1.00 0.00 H ATOM 2424 HD11 LEU A 152 -0.658 6.564 11.740 1.00 0.00 H ATOM 2425 HD12 LEU A 152 -1.581 7.670 10.693 1.00 0.00 H ATOM 2426 HD13 LEU A 152 -2.359 6.936 12.117 1.00 0.00 H ATOM 2427 H LEU A 152 -0.730 2.681 9.733 1.00 0.00 H ATOM 2428 N HIS A 153 -0.259 4.868 6.242 1.00 8.38 N ATOM 2429 CA HIS A 153 0.889 5.247 5.437 1.00 8.60 C ATOM 2430 C HIS A 153 0.915 6.751 5.394 1.00 8.78 C ATOM 2431 O HIS A 153 -0.049 7.369 4.953 1.00 9.41 O ATOM 2432 CB HIS A 153 0.792 4.663 4.021 1.00 8.06 C ATOM 2433 CG HIS A 153 1.943 5.029 3.141 1.00 9.79 C ATOM 2434 ND1 HIS A 153 1.795 5.332 1.802 1.00 12.42 N ATOM 2435 CD2 HIS A 153 3.261 5.176 3.420 1.00 10.49 C ATOM 2436 CE1 HIS A 153 2.980 5.619 1.288 1.00 11.54 C ATOM 2437 NE2 HIS A 153 3.887 5.523 2.247 1.00 10.99 N ATOM 2438 HA HIS A 153 1.807 4.854 5.873 1.00 0.00 H ATOM 2439 HB2 HIS A 153 0.749 3.577 4.099 1.00 0.00 H ATOM 2440 HB3 HIS A 153 -0.125 5.029 3.559 1.00 0.00 H ATOM 2441 HD2 HIS A 153 3.735 5.044 4.392 1.00 0.00 H ATOM 2442 HE1 HIS A 153 3.176 5.889 0.250 1.00 0.00 H ATOM 2443 H HIS A 153 -1.217 5.098 5.908 1.00 0.00 H ATOM 2444 N LEU A 154 2.002 7.325 5.908 1.00 8.49 N ATOM 2445 CA LEU A 154 2.164 8.778 6.001 1.00 8.71 C ATOM 2446 C LEU A 154 3.255 9.243 5.059 1.00 8.64 C ATOM 2447 O LEU A 154 4.324 8.635 4.985 1.00 9.23 O ATOM 2448 CB LEU A 154 2.539 9.185 7.432 1.00 9.91 C ATOM 2449 CG LEU A 154 1.572 8.777 8.547 1.00 10.36 C ATOM 2450 CD1 LEU A 154 1.947 9.516 9.831 1.00 15.93 C ATOM 2451 CD2 LEU A 154 0.134 9.067 8.166 1.00 14.89 C ATOM 2452 HA LEU A 154 1.217 9.243 5.727 1.00 0.00 H ATOM 2453 HB2 LEU A 154 3.508 8.740 7.658 1.00 0.00 H ATOM 2454 HB3 LEU A 154 2.626 10.271 7.453 1.00 0.00 H ATOM 2455 HG LEU A 154 1.654 7.702 8.706 1.00 0.00 H ATOM 2456 HD21 LEU A 154 0.017 10.135 7.980 1.00 0.00 H ATOM 2457 HD22 LEU A 154 -0.121 8.509 7.265 1.00 0.00 H ATOM 2458 HD23 LEU A 154 -0.524 8.765 8.980 1.00 0.00 H ATOM 2459 HD11 LEU A 154 2.966 9.254 10.115 1.00 0.00 H ATOM 2460 HD12 LEU A 154 1.880 10.591 9.663 1.00 0.00 H ATOM 2461 HD13 LEU A 154 1.261 9.228 10.628 1.00 0.00 H ATOM 2462 H LEU A 154 2.768 6.715 6.258 1.00 0.00 H ATOM 2463 N ILE A 155 2.989 10.330 4.347 1.00 9.19 N ATOM 2464 CA ILE A 155 3.988 10.931 3.475 1.00 10.54 C ATOM 2465 C ILE A 155 4.185 12.386 3.899 1.00 11.37 C ATOM 2466 O ILE A 155 3.345 12.942 4.592 1.00 11.35 O ATOM 2467 CB ILE A 155 3.582 10.831 1.979 1.00 10.73 C ATOM 2468 CG1 ILE A 155 2.331 11.667 1.695 1.00 10.90 C ATOM 2469 CG2 ILE A 155 3.367 9.354 1.586 1.00 10.99 C ATOM 2470 CD1 ILE A 155 1.909 11.645 0.232 1.00 13.31 C ATOM 2471 HA ILE A 155 4.927 10.386 3.574 1.00 0.00 H ATOM 2472 HB ILE A 155 4.391 11.235 1.370 1.00 0.00 H ATOM 2473 HG12 ILE A 155 1.510 11.277 2.298 1.00 0.00 H ATOM 2474 HG13 ILE A 155 2.532 12.699 1.981 1.00 0.00 H ATOM 2475 HD11 ILE A 155 2.716 12.042 -0.384 1.00 0.00 H ATOM 2476 HD12 ILE A 155 1.693 10.619 -0.067 1.00 0.00 H ATOM 2477 HD13 ILE A 155 1.017 12.258 0.103 1.00 0.00 H ATOM 2478 HG21 ILE A 155 4.292 8.799 1.744 1.00 0.00 H ATOM 2479 HG22 ILE A 155 2.575 8.927 2.202 1.00 0.00 H ATOM 2480 HG23 ILE A 155 3.083 9.297 0.535 1.00 0.00 H ATOM 2481 H ILE A 155 2.046 10.763 4.413 1.00 0.00 H ATOM 2482 N ARG A 156 5.301 13.002 3.516 1.00 14.12 N ATOM 2483 CA ARG A 156 5.564 14.381 3.955 1.00 16.40 C ATOM 2484 C ARG A 156 4.601 15.411 3.381 1.00 17.82 C ATOM 2485 O ARG A 156 4.243 15.365 2.198 1.00 18.39 O ATOM 2486 CB ARG A 156 6.995 14.793 3.653 1.00 16.77 C ATOM 2487 CG ARG A 156 7.985 13.972 4.403 1.00 16.30 C ATOM 2488 CD ARG A 156 9.328 14.667 4.531 1.00 16.25 C ATOM 2489 NE ARG A 156 10.226 13.785 5.265 1.00 14.63 N ATOM 2490 CZ ARG A 156 10.436 13.850 6.575 1.00 12.40 C ATOM 2491 NH1 ARG A 156 9.847 14.789 7.308 1.00 14.88 N ATOM 2492 NH2 ARG A 156 11.256 12.980 7.149 1.00 12.62 N ATOM 2493 HA ARG A 156 5.403 14.368 5.033 1.00 0.00 H ATOM 2494 HB2 ARG A 156 7.177 14.675 2.585 1.00 0.00 H ATOM 2495 HB3 ARG A 156 7.125 15.840 3.929 1.00 0.00 H ATOM 2496 HG2 ARG A 156 7.594 13.776 5.402 1.00 0.00 H ATOM 2497 HG3 ARG A 156 8.127 13.027 3.878 1.00 0.00 H ATOM 2498 HD2 ARG A 156 9.208 15.606 5.072 1.00 0.00 H ATOM 2499 HD3 ARG A 156 9.736 14.869 3.541 1.00 0.00 H ATOM 2500 HE ARG A 156 10.737 13.056 4.727 1.00 0.00 H ATOM 2501 HH12 ARG A 156 10.018 14.832 8.333 1.00 0.00 H ATOM 2502 HH11 ARG A 156 9.215 15.481 6.857 1.00 0.00 H ATOM 2503 HH22 ARG A 156 11.426 13.024 8.174 1.00 0.00 H ATOM 2504 HH21 ARG A 156 11.729 12.254 6.574 1.00 0.00 H ATOM 2505 H ARG A 156 5.986 12.509 2.908 1.00 0.00 H ATOM 2506 N LYS A 157 4.198 16.351 4.227 1.00 20.07 N ATOM 2507 CA LYS A 157 3.258 17.390 3.824 1.00 24.20 C ATOM 2508 C LYS A 157 3.981 18.560 3.182 1.00 26.01 C ATOM 2509 O LYS A 157 3.718 18.906 2.025 1.00 28.44 O ATOM 2510 CB LYS A 157 2.451 17.871 5.026 1.00 24.67 C ATOM 2511 CG LYS A 157 0.966 17.965 4.772 1.00 28.21 C ATOM 2512 CD LYS A 157 0.314 18.914 5.755 1.00 29.82 C ATOM 2513 CE LYS A 157 -0.994 18.354 6.271 1.00 32.83 C ATOM 2514 NZ LYS A 157 -1.608 19.267 7.269 1.00 35.23 N ATOM 2515 HA LYS A 157 2.578 16.961 3.088 1.00 0.00 H ATOM 2516 HB2 LYS A 157 2.615 17.176 5.849 1.00 0.00 H ATOM 2517 HB3 LYS A 157 2.814 18.859 5.309 1.00 0.00 H ATOM 2518 HG2 LYS A 157 0.798 18.329 3.758 1.00 0.00 H ATOM 2519 HG3 LYS A 157 0.521 16.976 4.880 1.00 0.00 H ATOM 2520 HD2 LYS A 157 0.989 19.074 6.596 1.00 0.00 H ATOM 2521 HD3 LYS A 157 0.123 19.865 5.258 1.00 0.00 H ATOM 2522 HE2 LYS A 157 -0.808 17.387 6.739 1.00 0.00 H ATOM 2523 HE3 LYS A 157 -1.681 18.225 5.435 1.00 0.00 H ATOM 2524 HZ1 LYS A 157 -0.958 19.389 8.071 1.00 0.00 H ATOM 2525 HZ2 LYS A 157 -1.792 20.190 6.826 1.00 0.00 H ATOM 2526 HZ3 LYS A 157 -2.503 18.859 7.606 1.00 0.00 H ATOM 2527 H LYS A 157 4.562 16.346 5.201 1.00 0.00 H ATOM 2528 N LYS A 158 4.843 19.181 3.807 1.00 27.15 N ATOM 2529 HN3 LYS A 158 4.559 20.178 3.889 1.00 0.00 H ATOM 2530 HN2 LYS A 158 5.749 19.118 3.301 1.00 0.00 H ATOM 2531 HN1 LYS A 158 4.945 18.769 4.757 1.00 0.00 H TER 2532 LYS A 158 HETATM 2533 O HOH 1 7.389 -0.990 16.690 1.00 14.65 O HETATM 2534 O HOH 2 0.703 4.006 26.745 1.00 11.76 O HETATM 2535 O HOH 3 4.266 8.993 26.040 1.00 14.41 O HETATM 2536 O HOH 4 7.223 -12.214 12.645 1.00 25.95 O HETATM 2537 O HOH 5 -0.003 1.048 5.381 1.00 21.85 O HETATM 2538 O HOH 6 11.462 -1.009 21.041 1.00 26.91 O HETATM 2539 O HOH 7 6.527 -6.328 27.666 1.00 26.94 O HETATM 2540 O HOH 8 16.133 0.340 21.265 1.00 33.88 O HETATM 2541 O HOH 9 20.387 -16.882 13.662 1.00 30.15 O HETATM 2542 O HOH 10 7.655 -11.133 24.445 1.00 28.95 O HETATM 2543 O HOH 11 8.108 -8.585 21.426 1.00 22.61 O HETATM 2544 O HOH 12 -2.311 -8.275 22.814 1.00 23.07 O HETATM 2545 O HOH 13 -3.931 -9.873 20.749 1.00 19.44 O HETATM 2546 O HOH 14 3.001 -7.984 18.619 1.00 15.91 O HETATM 2547 O HOH 15 1.939 -13.016 11.765 1.00 18.30 O HETATM 2548 O HOH 16 -6.207 -6.493 9.034 1.00 19.08 O HETATM 2549 O HOH 17 2.976 -5.606 16.959 1.00 13.26 O HETATM 2550 O HOH 18 7.013 -9.837 11.412 1.00 19.48 O HETATM 2551 O HOH 19 3.415 -13.099 9.441 1.00 24.24 O HETATM 2552 O HOH 20 1.275 0.861 7.850 1.00 14.31 O HETATM 2553 O HOH 21 6.580 -2.996 0.212 1.00 28.36 O HETATM 2554 O HOH 22 7.519 2.718 -2.103 1.00 27.62 O HETATM 2555 O HOH 23 -3.386 8.460 14.282 1.00 28.48 O HETATM 2556 O HOH 24 16.264 -3.236 -0.207 1.00 22.63 O HETATM 2557 O HOH 25 19.931 -3.126 0.678 1.00 21.25 O HETATM 2558 O HOH 26 -1.466 7.899 17.701 1.00 27.82 O HETATM 2559 O HOH 27 26.529 -2.195 21.560 1.00 29.94 O HETATM 2560 O HOH 28 7.037 17.234 15.522 1.00 30.44 O HETATM 2561 O HOH 29 19.884 -0.473 19.422 1.00 23.44 O HETATM 2562 O HOH 30 17.250 -0.940 18.794 1.00 13.87 O HETATM 2563 O HOH 31 -11.635 -2.467 15.601 1.00 24.27 O HETATM 2564 O HOH 32 18.970 -7.431 24.471 1.00 20.30 O HETATM 2565 O HOH 33 21.418 -4.794 23.294 1.00 32.69 O HETATM 2566 O HOH 34 20.729 -14.712 15.454 1.00 17.53 O HETATM 2567 O HOH 35 12.292 -15.220 12.156 1.00 30.00 O HETATM 2568 O HOH 36 17.131 -13.341 6.173 1.00 25.38 O HETATM 2569 O HOH 37 8.060 -10.559 8.991 1.00 20.27 O HETATM 2570 O HOH 38 22.532 -0.213 18.025 1.00 22.78 O HETATM 2571 O HOH 39 24.556 -0.846 19.815 1.00 25.64 O HETATM 2572 O HOH 40 31.889 2.505 15.942 1.00 20.71 O HETATM 2573 O HOH 41 20.169 -10.568 5.970 1.00 27.33 O HETATM 2574 O HOH 42 27.448 -9.927 10.423 1.00 27.47 O HETATM 2575 O HOH 43 29.846 3.985 15.301 1.00 24.15 O HETATM 2576 O HOH 44 26.492 7.915 2.911 1.00 30.11 O HETATM 2577 O HOH 45 26.162 0.754 3.477 1.00 31.98 O HETATM 2578 O HOH 46 30.063 0.283 8.829 1.00 29.62 O HETATM 2579 O HOH 47 9.026 -0.751 -2.712 1.00 25.10 O HETATM 2580 O HOH 48 14.239 -3.175 -2.493 1.00 21.10 O HETATM 2581 O HOH 49 12.229 -1.418 16.899 1.00 20.59 O HETATM 2582 O HOH 50 14.122 5.295 26.223 1.00 25.36 O HETATM 2583 O HOH 51 17.048 2.486 20.889 1.00 22.19 O HETATM 2584 O HOH 52 17.969 2.153 17.951 1.00 18.90 O HETATM 2585 O HOH 53 16.686 8.888 23.315 1.00 24.73 O HETATM 2586 O HOH 54 13.916 13.333 16.665 1.00 35.01 O HETATM 2587 O HOH 55 11.270 9.230 21.048 1.00 18.12 O HETATM 2588 O HOH 56 10.212 15.396 10.222 1.00 19.89 O HETATM 2589 O HOH 57 13.323 17.244 7.581 1.00 26.75 O HETATM 2590 O HOH 58 15.478 12.811 12.771 1.00 18.35 O HETATM 2591 O HOH 59 17.376 11.307 3.782 1.00 35.54 O HETATM 2592 O HOH 60 7.213 12.113 1.452 1.00 24.40 O HETATM 2593 O HOH 61 7.126 3.465 0.476 1.00 18.57 O HETATM 2594 O HOH 62 3.546 -0.604 10.398 1.00 11.58 O HETATM 2595 O HOH 63 -4.888 6.186 13.909 1.00 30.15 O HETATM 2596 O HOH 64 -6.332 7.151 17.369 1.00 31.49 O HETATM 2597 O HOH 65 -3.322 1.806 30.451 1.00 28.64 O HETATM 2598 O HOH 66 -1.759 0.520 30.573 1.00 29.80 O HETATM 2599 O HOH 67 0.292 -2.819 29.336 1.00 18.12 O HETATM 2600 O HOH 68 12.098 -1.766 26.309 1.00 18.00 O HETATM 2601 O HOH 69 10.703 -0.649 32.500 1.00 26.14 O HETATM 2602 O HOH 70 13.172 1.024 21.359 1.00 15.33 O HETATM 2603 O HOH 71 9.123 14.080 14.563 1.00 22.72 O HETATM 2604 O HOH 72 2.941 12.513 18.081 1.00 21.28 O HETATM 2605 O HOH 73 -0.766 8.859 15.128 1.00 22.04 O HETATM 2606 O HOH 74 4.751 20.734 12.759 1.00 31.45 O HETATM 2607 O HOH 75 -0.880 16.271 14.809 1.00 23.96 O HETATM 2608 O HOH 76 2.894 22.659 13.775 1.00 27.48 O HETATM 2609 O HOH 77 1.980 22.247 7.498 1.00 27.46 O HETATM 2610 O HOH 78 6.389 16.277 13.032 1.00 17.42 O HETATM 2611 O HOH 79 8.222 14.480 12.103 1.00 16.13 O HETATM 2612 O HOH 80 -3.717 13.877 6.445 1.00 21.27 O HETATM 2613 O HOH 81 -6.306 7.390 0.476 1.00 26.23 O HETATM 2614 O HOH 82 -2.671 1.889 5.339 1.00 13.62 O HETATM 2615 O HOH 83 -7.429 5.379 3.483 1.00 23.62 O HETATM 2616 O HOH 84 -9.075 4.029 9.279 1.00 25.71 O HETATM 2617 O HOH 85 -10.626 0.617 7.334 1.00 22.38 O HETATM 2618 O HOH 86 -8.909 -2.554 14.797 1.00 12.44 O HETATM 2619 O HOH 87 -9.509 3.345 11.619 1.00 28.53 O HETATM 2620 O HOH 88 -6.170 -10.128 12.371 1.00 26.34 O HETATM 2621 O HOH 89 -12.390 -6.873 13.086 1.00 23.57 O HETATM 2622 O HOH 90 -11.011 -7.655 20.790 1.00 25.29 O HETATM 2623 O HOH 91 -0.346 0.456 -2.674 1.00 28.70 O HETATM 2624 O HOH 92 9.883 -11.722 16.119 1.00 34.39 O HETATM 2625 C1 TOP A 93 7.080 -4.293 14.719 1.00 0.00 C HETATM 2626 N2 TOP A 93 6.001 -3.879 14.078 1.00 -0.28 N HETATM 2627 C3 TOP A 93 6.067 -2.876 13.241 1.00 0.16 C HETATM 2628 N4 TOP A 93 4.979 -2.524 12.584 1.00 -0.31 N HETATM 2629 H2 TOP A 93 4.101 -3.043 12.727 1.00 0.18 H HETATM 2630 H3 TOP A 93 5.008 -1.730 11.928 1.00 0.18 H HETATM 2631 N5 TOP A 93 7.192 -2.228 13.072 1.00 -0.25 N HETATM 2632 C6 TOP A 93 8.280 -2.507 13.714 1.00 0.12 C HETATM 2633 N7 TOP A 93 9.395 -1.817 13.562 1.00 -0.32 N HETATM 2634 H4 TOP A 93 10.238 -2.076 14.095 1.00 0.18 H HETATM 2635 H5 TOP A 93 9.422 -1.020 12.911 1.00 0.18 H HETATM 2636 C8 TOP A 93 8.259 -3.650 14.616 1.00 0.02 C HETATM 2637 C9 TOP A 93 9.535 -4.047 15.340 1.00 0.01 C HETATM 2638 C10 TOP A 93 9.549 -5.296 16.212 1.00 -0.06 C HETATM 2639 C11 TOP A 93 9.803 -5.198 17.571 1.00 -0.05 C HETATM 2640 C12 TOP A 93 9.828 -6.363 18.391 1.00 0.11 C HETATM 2641 O13 TOP A 93 10.077 -6.316 19.721 1.00 -0.33 O HETATM 2642 C14 TOP A 93 10.438 -5.192 20.375 1.00 0.06 C HETATM 2643 H9 TOP A 93 10.581 -5.418 21.442 1.00 0.06 H HETATM 2644 H10 TOP A 93 9.649 -4.433 20.263 1.00 0.06 H HETATM 2645 H11 TOP A 93 11.378 -4.808 19.953 1.00 0.06 H HETATM 2646 C15 TOP A 93 9.553 -7.516 17.815 1.00 0.14 C HETATM 2647 O16 TOP A 93 9.490 -8.678 18.509 1.00 -0.33 O HETATM 2648 C17 TOP A 93 8.400 -9.567 18.270 1.00 0.05 C HETATM 2649 H12 TOP A 93 8.503 -10.454 18.912 1.00 0.06 H HETATM 2650 H13 TOP A 93 8.403 -9.876 17.214 1.00 0.06 H HETATM 2651 H14 TOP A 93 7.453 -9.056 18.500 1.00 0.06 H HETATM 2652 C18 TOP A 93 9.298 -7.626 16.500 1.00 0.11 C HETATM 2653 O19 TOP A 93 9.055 -8.804 15.985 1.00 -0.33 O HETATM 2654 C20 TOP A 93 9.034 -9.090 14.643 1.00 0.06 C HETATM 2655 H15 TOP A 93 8.804 -10.156 14.499 1.00 0.06 H HETATM 2656 H16 TOP A 93 10.017 -8.864 14.205 1.00 0.06 H HETATM 2657 H17 TOP A 93 8.264 -8.479 14.150 1.00 0.06 H HETATM 2658 C21 TOP A 93 9.305 -6.500 15.668 1.00 -0.05 C HETATM 2659 H18 TOP A 93 9.117 -6.598 14.605 1.00 0.04 H HETATM 2660 H8 TOP A 93 9.984 -4.226 18.014 1.00 0.04 H HETATM 2661 H6 TOP A 93 9.810 -3.202 15.988 1.00 0.05 H HETATM 2662 H7 TOP A 93 10.309 -4.186 14.570 1.00 0.05 H HETATM 2663 H1 TOP A 93 7.014 -5.175 15.345 1.00 0.08 H CONECT 1 2 14 15 16 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 2528 2508 2529 2530 2531 CONECT 2529 2528 CONECT 2530 2528 CONECT 2531 2528 CONECT 2625 2626 2636 2663 CONECT 2626 2625 2627 CONECT 2627 2626 2628 2631 CONECT 2628 2627 2629 2630 CONECT 2629 2628 CONECT 2630 2628 CONECT 2631 2627 2632 CONECT 2632 2631 2633 2636 CONECT 2633 2632 2634 2635 CONECT 2634 2633 CONECT 2635 2633 CONECT 2636 2625 2632 2637 CONECT 2637 2636 2638 2661 2662 CONECT 2638 2637 2639 2658 CONECT 2639 2638 2640 2660 CONECT 2640 2639 2641 2646 CONECT 2641 2640 2642 CONECT 2642 2641 2643 2644 2645 CONECT 2643 2642 CONECT 2644 2642 CONECT 2645 2642 CONECT 2646 2640 2647 2652 CONECT 2647 2646 2648 CONECT 2648 2647 2649 2650 2651 CONECT 2649 2648 CONECT 2650 2648 CONECT 2651 2648 CONECT 2652 2646 2653 2658 CONECT 2653 2652 2654 CONECT 2654 2653 2655 2656 2657 CONECT 2655 2654 CONECT 2656 2654 CONECT 2657 2654 CONECT 2658 2638 2652 2659 CONECT 2659 2658 CONECT 2660 2639 CONECT 2661 2637 CONECT 2662 2637 CONECT 2663 2625 MASTER 0 0 0 0 0 0 0 0 2662 1 47 13 END
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Structure:
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Related entries of code: 2w9h
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3fl9
RCSB PDB
PDBbind
TOP
3n0h
RCSB PDB
PDBbind
TOP
3s3v
RCSB PDB
PDBbind
TOP
4km2
RCSB PDB
PDBbind
TOP
Entry Information
PDB ID
2w9h
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Dihydrofolate reductase (DHFR)
Ligand Name
TOP
EC.Number
E.C.1.5.1.3
Resolution
1.48(Å)
Affinity (Kd/Ki/IC50)
Kd=430nM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) Proteins
Ligand Properties
Formula
C
1
4
H
1
8
N
4
O
3
Molecular Weight
290.318
Exact Mass
290.138
No. of atoms
39
No. of bonds
40
Polar Surface Area
105.51
LOGP Value
1.34 (
Computed with XLOGP3
)
2.42 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 2
Canonical SMILES
COc1cc(Cc2cnc(nc2N)N)cc(c1OC)OC
InChI String
InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18)
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):
P0A017
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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