Browse entries in the PDBbind-CN Database
HEADER 1AKW_COMPLEX COMPND 1AKW_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 147 PRO LYS ALA LEU ILE VAL TYR GLY SER THR THR GLY ASN SEQRES 2 A 147 THR GLU TYR THR ALA GLU THR ILE ALA ARG GLU LEU ALA SEQRES 3 A 147 ASP ALA GLY TYR GLU VAL ASP SER ARG ASP ALA ALA SER SEQRES 4 A 147 VAL GLU ALA GLY GLY LEU PHE GLU GLY PHE ASP LEU VAL SEQRES 5 A 147 LEU LEU GLY CYS SER THR TRP LEU ASP ASP SER ILE GLU SEQRES 6 A 147 LEU GLN ASP ASP PHE ILE PRO LEU PHE ASP SER LEU GLU SEQRES 7 A 147 GLU THR GLY ALA GLN GLY ARG LYS VAL ALA CYS PHE GLY SEQRES 8 A 147 CYS GLY ASP SER SER TYR GLU TYR PHE CYS GLY ALA VAL SEQRES 9 A 147 ASP ALA ILE GLU GLU LYS LEU LYS ASN LEU GLY ALA GLU SEQRES 10 A 147 ILE VAL GLN ASP GLY LEU ARG ILE ASP GLY ASP PRO ARG SEQRES 11 A 147 ALA ALA ARG ASP ASP ILE VAL GLY TRP ALA HIS ASP VAL SEQRES 12 A 147 ARG GLY ALA ILE HET FMN A 247 50 ATOM 1 N PRO A 2 22.357 26.276 0.037 1.00 30.08 N ATOM 2 CA PRO A 2 22.133 26.281 1.524 1.00 28.18 C ATOM 3 C PRO A 2 20.891 25.477 1.884 1.00 29.37 C ATOM 4 O PRO A 2 20.033 25.344 0.990 1.00 32.30 O ATOM 5 CB PRO A 2 22.137 27.735 1.980 1.00 31.99 C ATOM 6 CG PRO A 2 22.293 28.536 0.711 1.00 30.89 C ATOM 7 CD PRO A 2 22.124 27.633 -0.472 1.00 28.91 C ATOM 8 HA PRO A 2 22.930 25.774 2.068 1.00 0.00 H ATOM 9 HD3 PRO A 2 21.116 27.721 -0.878 1.00 0.00 H ATOM 10 HD2 PRO A 2 22.849 27.880 -1.247 1.00 0.00 H ATOM 11 HG3 PRO A 2 23.285 28.988 0.685 1.00 0.00 H ATOM 12 HG2 PRO A 2 21.537 29.321 0.681 1.00 0.00 H ATOM 13 HB2 PRO A 2 21.200 27.984 2.479 1.00 0.00 H ATOM 14 HB3 PRO A 2 22.970 27.923 2.658 1.00 0.00 H ATOM 15 N LYS A 3 20.775 24.894 3.082 1.00 23.72 N ATOM 16 CA LYS A 3 19.618 24.103 3.467 1.00 21.65 C ATOM 17 C LYS A 3 18.836 24.845 4.563 1.00 20.04 C ATOM 18 O LYS A 3 19.469 25.295 5.508 1.00 18.61 O ATOM 19 CB LYS A 3 19.946 22.789 4.118 1.00 22.34 C ATOM 20 CG LYS A 3 20.825 21.818 3.411 1.00 32.80 C ATOM 21 CD LYS A 3 21.111 20.613 4.307 1.00 45.84 C ATOM 22 CE LYS A 3 19.900 19.840 4.792 1.00 50.49 C ATOM 23 NZ LYS A 3 20.228 18.867 5.882 1.00 53.31 N ATOM 24 HA LYS A 3 19.082 23.941 2.532 1.00 0.00 H ATOM 25 HB2 LYS A 3 20.427 23.018 5.069 1.00 0.00 H ATOM 26 HB3 LYS A 3 18.999 22.282 4.304 1.00 0.00 H ATOM 27 HG2 LYS A 3 20.330 21.480 2.501 1.00 0.00 H ATOM 28 HG3 LYS A 3 21.765 22.305 3.152 1.00 0.00 H ATOM 29 HD2 LYS A 3 21.744 19.924 3.747 1.00 0.00 H ATOM 30 HD3 LYS A 3 21.651 20.970 5.184 1.00 0.00 H ATOM 31 HE2 LYS A 3 19.478 19.291 3.951 1.00 0.00 H ATOM 32 HE3 LYS A 3 19.162 20.549 5.168 1.00 0.00 H ATOM 33 HZ1 LYS A 3 20.925 18.179 5.532 1.00 0.00 H ATOM 34 HZ2 LYS A 3 20.624 19.380 6.695 1.00 0.00 H ATOM 35 HZ3 LYS A 3 19.362 18.369 6.172 1.00 0.00 H ATOM 36 H LYS A 3 21.547 25.012 3.769 1.00 0.00 H ATOM 37 N ALA A 4 17.532 24.926 4.413 1.00 18.49 N ATOM 38 CA ALA A 4 16.705 25.620 5.384 1.00 16.21 C ATOM 39 C ALA A 4 15.680 24.659 5.971 1.00 16.37 C ATOM 40 O ALA A 4 15.175 23.787 5.252 1.00 17.33 O ATOM 41 CB ALA A 4 15.989 26.811 4.732 1.00 15.14 C ATOM 42 HA ALA A 4 17.347 25.995 6.181 1.00 0.00 H ATOM 43 HB1 ALA A 4 16.729 27.507 4.337 1.00 0.00 H ATOM 44 HB2 ALA A 4 15.356 26.453 3.920 1.00 0.00 H ATOM 45 HB3 ALA A 4 15.375 27.317 5.477 1.00 0.00 H ATOM 46 H ALA A 4 17.085 24.485 3.584 1.00 0.00 H ATOM 47 N LEU A 5 15.416 24.803 7.280 1.00 13.86 N ATOM 48 CA LEU A 5 14.409 23.972 7.955 1.00 9.21 C ATOM 49 C LEU A 5 13.276 24.929 8.361 1.00 12.33 C ATOM 50 O LEU A 5 13.622 25.986 8.914 1.00 13.73 O ATOM 51 CB LEU A 5 14.921 23.284 9.225 1.00 12.85 C ATOM 52 CG LEU A 5 13.901 22.546 10.100 1.00 14.08 C ATOM 53 CD1 LEU A 5 13.293 21.312 9.438 1.00 15.64 C ATOM 54 CD2 LEU A 5 14.543 22.157 11.423 1.00 15.57 C ATOM 55 HA LEU A 5 14.105 23.177 7.274 1.00 0.00 H ATOM 56 HB2 LEU A 5 15.674 22.557 8.920 1.00 0.00 H ATOM 57 HB3 LEU A 5 15.387 24.050 9.845 1.00 0.00 H ATOM 58 HG LEU A 5 13.078 23.242 10.261 1.00 0.00 H ATOM 59 HD21 LEU A 5 15.395 21.505 11.234 1.00 0.00 H ATOM 60 HD22 LEU A 5 14.879 23.056 11.940 1.00 0.00 H ATOM 61 HD23 LEU A 5 13.813 21.633 12.040 1.00 0.00 H ATOM 62 HD11 LEU A 5 12.779 21.608 8.523 1.00 0.00 H ATOM 63 HD12 LEU A 5 14.085 20.603 9.198 1.00 0.00 H ATOM 64 HD13 LEU A 5 12.582 20.847 10.122 1.00 0.00 H ATOM 65 H LEU A 5 15.935 25.518 7.828 1.00 0.00 H ATOM 66 N ILE A 6 12.009 24.630 8.084 1.00 11.71 N ATOM 67 CA ILE A 6 10.850 25.448 8.483 1.00 11.93 C ATOM 68 C ILE A 6 9.960 24.565 9.375 1.00 11.48 C ATOM 69 O ILE A 6 9.526 23.492 8.942 1.00 14.59 O ATOM 70 CB ILE A 6 9.974 26.022 7.341 1.00 15.24 C ATOM 71 CG1 ILE A 6 10.837 26.874 6.397 1.00 15.86 C ATOM 72 CG2 ILE A 6 8.808 26.866 7.900 1.00 11.96 C ATOM 73 CD1 ILE A 6 10.175 27.292 5.099 1.00 19.89 C ATOM 74 HA ILE A 6 11.264 26.326 8.979 1.00 0.00 H ATOM 75 HB ILE A 6 9.548 25.186 6.786 1.00 0.00 H ATOM 76 HG12 ILE A 6 11.126 27.778 6.932 1.00 0.00 H ATOM 77 HG13 ILE A 6 11.729 26.299 6.148 1.00 0.00 H ATOM 78 HD11 ILE A 6 9.890 26.404 4.535 1.00 0.00 H ATOM 79 HD12 ILE A 6 9.287 27.884 5.320 1.00 0.00 H ATOM 80 HD13 ILE A 6 10.874 27.888 4.512 1.00 0.00 H ATOM 81 HG21 ILE A 6 8.182 26.242 8.538 1.00 0.00 H ATOM 82 HG22 ILE A 6 9.208 27.696 8.482 1.00 0.00 H ATOM 83 HG23 ILE A 6 8.213 27.254 7.073 1.00 0.00 H ATOM 84 H ILE A 6 11.824 23.758 7.548 1.00 0.00 H ATOM 85 N VAL A 7 9.684 24.923 10.627 1.00 11.43 N ATOM 86 CA VAL A 7 8.832 24.172 11.552 1.00 13.87 C ATOM 87 C VAL A 7 7.677 25.110 11.951 1.00 13.77 C ATOM 88 O VAL A 7 7.923 26.251 12.366 1.00 11.99 O ATOM 89 CB VAL A 7 9.505 23.591 12.824 1.00 14.60 C ATOM 90 CG1 VAL A 7 8.597 22.706 13.670 1.00 11.96 C ATOM 91 CG2 VAL A 7 10.717 22.729 12.451 1.00 20.21 C ATOM 92 HA VAL A 7 8.514 23.277 11.017 1.00 0.00 H ATOM 93 HB VAL A 7 9.779 24.471 13.406 1.00 0.00 H ATOM 94 HG11 VAL A 7 7.735 23.284 14.002 1.00 0.00 H ATOM 95 HG12 VAL A 7 8.259 21.859 13.073 1.00 0.00 H ATOM 96 HG13 VAL A 7 9.150 22.344 14.537 1.00 0.00 H ATOM 97 HG21 VAL A 7 10.393 21.905 11.816 1.00 0.00 H ATOM 98 HG22 VAL A 7 11.444 23.339 11.915 1.00 0.00 H ATOM 99 HG23 VAL A 7 11.172 22.333 13.359 1.00 0.00 H ATOM 100 H VAL A 7 10.107 25.806 10.976 1.00 0.00 H ATOM 101 N TYR A 8 6.419 24.688 11.820 1.00 11.56 N ATOM 102 CA TYR A 8 5.292 25.536 12.183 1.00 10.87 C ATOM 103 C TYR A 8 4.263 24.783 13.030 1.00 12.57 C ATOM 104 O TYR A 8 4.073 23.570 12.990 1.00 13.52 O ATOM 105 CB TYR A 8 4.657 26.098 10.880 1.00 12.47 C ATOM 106 CG TYR A 8 4.179 24.973 9.977 1.00 16.23 C ATOM 107 CD1 TYR A 8 2.910 24.434 10.184 1.00 18.24 C ATOM 108 CD2 TYR A 8 4.976 24.437 8.968 1.00 16.14 C ATOM 109 CE1 TYR A 8 2.409 23.382 9.439 1.00 18.53 C ATOM 110 CE2 TYR A 8 4.477 23.388 8.212 1.00 19.52 C ATOM 111 CZ TYR A 8 3.223 22.869 8.449 1.00 19.54 C ATOM 112 OH TYR A 8 2.751 21.818 7.701 1.00 23.16 O ATOM 113 HA TYR A 8 5.647 26.361 12.801 1.00 0.00 H ATOM 114 HB3 TYR A 8 5.401 26.691 10.348 1.00 0.00 H ATOM 115 HB2 TYR A 8 3.809 26.731 11.141 1.00 0.00 H ATOM 116 HD2 TYR A 8 5.973 24.835 8.777 1.00 0.00 H ATOM 117 HE2 TYR A 8 5.088 22.966 7.415 1.00 0.00 H ATOM 118 HE1 TYR A 8 1.415 22.976 9.625 1.00 0.00 H ATOM 119 HD1 TYR A 8 2.285 24.861 10.968 1.00 0.00 H ATOM 120 HH TYR A 8 1.841 21.579 8.008 1.00 0.00 H ATOM 121 H TYR A 8 6.239 23.733 11.451 1.00 0.00 H ATOM 122 N GLY A 9 3.551 25.529 13.860 1.00 12.11 N ATOM 123 CA GLY A 9 2.449 25.029 14.692 1.00 10.92 C ATOM 124 C GLY A 9 1.227 25.810 14.154 1.00 11.21 C ATOM 125 O GLY A 9 1.280 27.055 14.220 1.00 12.30 O ATOM 126 HA3 GLY A 9 2.622 25.248 15.746 1.00 0.00 H ATOM 127 HA2 GLY A 9 2.316 23.955 14.563 1.00 0.00 H ATOM 128 H GLY A 9 3.789 26.539 13.928 1.00 0.00 H ATOM 129 N SER A 10 0.188 25.168 13.631 1.00 10.39 N ATOM 130 CA SER A 10 -0.982 25.875 13.084 1.00 11.58 C ATOM 131 C SER A 10 -2.270 25.114 13.423 1.00 12.05 C ATOM 132 O SER A 10 -2.304 23.888 13.307 1.00 11.61 O ATOM 133 CB SER A 10 -0.794 25.990 11.567 1.00 12.10 C ATOM 134 OG SER A 10 -1.770 26.824 10.968 1.00 12.08 O ATOM 135 HA SER A 10 -1.068 26.869 13.522 1.00 0.00 H ATOM 136 HB2 SER A 10 -0.865 24.995 11.128 1.00 0.00 H ATOM 137 HB3 SER A 10 0.194 26.405 11.366 1.00 0.00 H ATOM 138 HG SER A 10 -1.709 27.733 11.356 1.00 0.00 H ATOM 139 H SER A 10 0.202 24.128 13.607 1.00 0.00 H ATOM 140 N THR A 11 -3.324 25.786 13.870 1.00 13.93 N ATOM 141 CA THR A 11 -4.598 25.157 14.244 1.00 15.37 C ATOM 142 C THR A 11 -5.665 25.353 13.166 1.00 15.82 C ATOM 143 O THR A 11 -6.409 24.410 12.897 1.00 17.41 O ATOM 144 CB THR A 11 -5.173 25.736 15.555 1.00 16.21 C ATOM 145 OG1 THR A 11 -4.251 25.397 16.591 1.00 18.36 O ATOM 146 CG2 THR A 11 -6.547 25.182 15.936 1.00 13.87 C ATOM 147 HA THR A 11 -4.367 24.099 14.369 1.00 0.00 H ATOM 148 HB THR A 11 -5.305 26.809 15.417 1.00 0.00 H ATOM 149 HG1 THR A 11 -3.367 25.794 16.387 1.00 0.00 H ATOM 150 HG23 THR A 11 -7.267 25.431 15.156 1.00 0.00 H ATOM 151 HG21 THR A 11 -6.484 24.099 16.042 1.00 0.00 H ATOM 152 HG22 THR A 11 -6.866 25.623 16.880 1.00 0.00 H ATOM 153 H THR A 11 -3.243 26.819 13.961 1.00 0.00 H ATOM 154 N THR A 12 -5.747 26.555 12.607 1.00 13.47 N ATOM 155 CA THR A 12 -6.755 26.782 11.562 1.00 17.14 C ATOM 156 C THR A 12 -6.163 26.879 10.151 1.00 20.73 C ATOM 157 O THR A 12 -6.842 27.134 9.140 1.00 22.97 O ATOM 158 CB THR A 12 -7.696 27.951 11.902 1.00 16.91 C ATOM 159 OG1 THR A 12 -7.075 29.200 11.553 1.00 17.06 O ATOM 160 CG2 THR A 12 -8.104 27.967 13.371 1.00 13.09 C ATOM 161 HA THR A 12 -7.373 25.884 11.546 1.00 0.00 H ATOM 162 HB THR A 12 -8.605 27.811 11.317 1.00 0.00 H ATOM 163 HG1 THR A 12 -6.232 29.301 12.062 1.00 0.00 H ATOM 164 HG23 THR A 12 -8.574 27.017 13.627 1.00 0.00 H ATOM 165 HG21 THR A 12 -7.220 28.115 13.991 1.00 0.00 H ATOM 166 HG22 THR A 12 -8.809 28.780 13.542 1.00 0.00 H ATOM 167 H THR A 12 -5.110 27.321 12.903 1.00 0.00 H ATOM 168 N GLY A 13 -4.851 26.678 9.988 1.00 14.36 N ATOM 169 CA GLY A 13 -4.147 26.719 8.726 1.00 12.89 C ATOM 170 C GLY A 13 -3.487 28.026 8.326 1.00 13.53 C ATOM 171 O GLY A 13 -2.869 28.041 7.249 1.00 14.37 O ATOM 172 HA3 GLY A 13 -4.864 26.464 7.945 1.00 0.00 H ATOM 173 HA2 GLY A 13 -3.367 25.959 8.764 1.00 0.00 H ATOM 174 H GLY A 13 -4.290 26.475 10.840 1.00 0.00 H ATOM 175 N ASN A 14 -3.549 29.111 9.083 1.00 10.79 N ATOM 176 CA ASN A 14 -2.971 30.376 8.690 1.00 9.58 C ATOM 177 C ASN A 14 -1.450 30.398 8.725 1.00 12.51 C ATOM 178 O ASN A 14 -0.843 30.838 7.727 1.00 12.79 O ATOM 179 CB ASN A 14 -3.554 31.537 9.505 1.00 11.25 C ATOM 180 CG ASN A 14 -5.008 31.768 9.097 1.00 17.43 C ATOM 181 OD1 ASN A 14 -5.416 31.404 7.989 1.00 18.03 O ATOM 182 ND2 ASN A 14 -5.795 32.401 9.951 1.00 15.27 N ATOM 183 HA ASN A 14 -3.249 30.507 7.644 1.00 0.00 H ATOM 184 HB2 ASN A 14 -3.509 31.294 10.567 1.00 0.00 H ATOM 185 HB3 ASN A 14 -2.975 32.441 9.315 1.00 0.00 H ATOM 186 HD22 ASN A 14 -5.426 32.696 10.877 1.00 0.00 H ATOM 187 HD21 ASN A 14 -6.783 32.603 9.696 1.00 0.00 H ATOM 188 H ASN A 14 -4.035 29.050 10.000 1.00 0.00 H ATOM 189 N THR A 15 -0.891 29.909 9.834 1.00 10.71 N ATOM 190 CA THR A 15 0.580 29.857 9.948 1.00 12.42 C ATOM 191 C THR A 15 1.134 28.805 8.984 1.00 10.77 C ATOM 192 O THR A 15 2.236 28.931 8.452 1.00 10.04 O ATOM 193 CB THR A 15 1.042 29.630 11.402 1.00 11.27 C ATOM 194 OG1 THR A 15 0.426 30.642 12.200 1.00 9.30 O ATOM 195 CG2 THR A 15 2.554 29.785 11.534 1.00 10.87 C ATOM 196 HA THR A 15 0.987 30.827 9.662 1.00 0.00 H ATOM 197 HB THR A 15 0.768 28.623 11.715 1.00 0.00 H ATOM 198 HG1 THR A 15 -0.558 30.563 12.129 1.00 0.00 H ATOM 199 HG23 THR A 15 3.050 29.023 10.933 1.00 0.00 H ATOM 200 HG21 THR A 15 2.849 30.774 11.184 1.00 0.00 H ATOM 201 HG22 THR A 15 2.840 29.668 12.579 1.00 0.00 H ATOM 202 H THR A 15 -1.488 29.567 10.613 1.00 0.00 H ATOM 203 N GLU A 16 0.352 27.758 8.724 1.00 11.15 N ATOM 204 CA GLU A 16 0.771 26.736 7.761 1.00 12.27 C ATOM 205 C GLU A 16 0.828 27.347 6.365 1.00 13.40 C ATOM 206 O GLU A 16 1.795 27.162 5.621 1.00 14.37 O ATOM 207 CB GLU A 16 -0.198 25.573 7.855 1.00 15.91 C ATOM 208 CG GLU A 16 0.114 24.496 6.819 1.00 24.92 C ATOM 209 CD GLU A 16 -0.907 23.374 6.818 1.00 32.93 C ATOM 210 OE1 GLU A 16 -2.117 23.608 6.676 1.00 38.82 O ATOM 211 OE2 GLU A 16 -0.519 22.202 6.962 1.00 42.14 O ATOM 212 HA GLU A 16 1.771 26.363 7.982 1.00 0.00 H ATOM 213 HB2 GLU A 16 -0.131 25.136 8.851 1.00 0.00 H ATOM 214 HB3 GLU A 16 -1.210 25.941 7.689 1.00 0.00 H ATOM 215 HG2 GLU A 16 0.129 24.956 5.831 1.00 0.00 H ATOM 216 HG3 GLU A 16 1.095 24.075 7.037 1.00 0.00 H ATOM 217 H GLU A 16 -0.564 27.665 9.209 1.00 0.00 H ATOM 218 N TYR A 17 -0.165 28.147 5.944 1.00 13.88 N ATOM 219 CA TYR A 17 -0.159 28.835 4.653 1.00 14.77 C ATOM 220 C TYR A 17 1.063 29.767 4.626 1.00 13.67 C ATOM 221 O TYR A 17 1.779 29.890 3.616 1.00 13.23 O ATOM 222 CB TYR A 17 -1.447 29.668 4.418 1.00 15.80 C ATOM 223 CG TYR A 17 -1.361 30.613 3.230 1.00 15.22 C ATOM 224 CD1 TYR A 17 -1.692 30.207 1.938 1.00 19.53 C ATOM 225 CD2 TYR A 17 -0.901 31.919 3.400 1.00 18.38 C ATOM 226 CE1 TYR A 17 -1.571 31.085 0.862 1.00 20.88 C ATOM 227 CE2 TYR A 17 -0.762 32.797 2.339 1.00 20.11 C ATOM 228 CZ TYR A 17 -1.119 32.370 1.063 1.00 21.99 C ATOM 229 OH TYR A 17 -0.967 33.252 0.008 1.00 22.64 O ATOM 230 HA TYR A 17 -0.116 28.088 3.861 1.00 0.00 H ATOM 231 HB3 TYR A 17 -1.642 30.258 5.313 1.00 0.00 H ATOM 232 HB2 TYR A 17 -2.275 28.980 4.250 1.00 0.00 H ATOM 233 HD2 TYR A 17 -0.642 32.260 4.403 1.00 0.00 H ATOM 234 HE2 TYR A 17 -0.380 33.805 2.500 1.00 0.00 H ATOM 235 HE1 TYR A 17 -1.835 30.753 -0.142 1.00 0.00 H ATOM 236 HD1 TYR A 17 -2.049 29.192 1.767 1.00 0.00 H ATOM 237 HH TYR A 17 -1.258 32.815 -0.831 1.00 0.00 H ATOM 238 H TYR A 17 -0.984 28.285 6.570 1.00 0.00 H ATOM 239 N THR A 18 1.307 30.474 5.728 1.00 11.54 N ATOM 240 CA THR A 18 2.469 31.374 5.799 1.00 13.87 C ATOM 241 C THR A 18 3.769 30.593 5.600 1.00 13.53 C ATOM 242 O THR A 18 4.618 31.039 4.813 1.00 13.21 O ATOM 243 CB THR A 18 2.445 32.146 7.129 1.00 12.21 C ATOM 244 OG1 THR A 18 1.208 32.880 7.198 1.00 13.89 O ATOM 245 CG2 THR A 18 3.589 33.126 7.253 1.00 12.35 C ATOM 246 HA THR A 18 2.416 32.104 4.991 1.00 0.00 H ATOM 247 HB THR A 18 2.540 31.423 7.939 1.00 0.00 H ATOM 248 HG1 THR A 18 0.448 32.247 7.156 1.00 0.00 H ATOM 249 HG23 THR A 18 4.535 32.587 7.203 1.00 0.00 H ATOM 250 HG21 THR A 18 3.537 33.848 6.438 1.00 0.00 H ATOM 251 HG22 THR A 18 3.517 33.648 8.207 1.00 0.00 H ATOM 252 H THR A 18 0.670 30.389 6.546 1.00 0.00 H ATOM 253 N ALA A 19 3.979 29.465 6.269 1.00 11.84 N ATOM 254 CA ALA A 19 5.154 28.611 6.160 1.00 12.68 C ATOM 255 C ALA A 19 5.357 28.143 4.713 1.00 18.00 C ATOM 256 O ALA A 19 6.475 28.243 4.179 1.00 15.12 O ATOM 257 CB ALA A 19 5.033 27.426 7.108 1.00 10.55 C ATOM 258 HA ALA A 19 6.032 29.190 6.446 1.00 0.00 H ATOM 259 HB1 ALA A 19 4.949 27.789 8.132 1.00 0.00 H ATOM 260 HB2 ALA A 19 4.146 26.847 6.852 1.00 0.00 H ATOM 261 HB3 ALA A 19 5.918 26.797 7.016 1.00 0.00 H ATOM 262 H ALA A 19 3.236 29.164 6.932 1.00 0.00 H ATOM 263 N GLU A 20 4.298 27.669 4.030 1.00 17.93 N ATOM 264 CA GLU A 20 4.393 27.237 2.640 1.00 18.28 C ATOM 265 C GLU A 20 4.759 28.357 1.678 1.00 16.96 C ATOM 266 O GLU A 20 5.496 28.135 0.704 1.00 18.13 O ATOM 267 CB GLU A 20 3.081 26.582 2.205 1.00 21.82 C ATOM 268 CG GLU A 20 2.941 25.280 2.994 1.00 41.06 C ATOM 269 CD GLU A 20 1.607 24.582 2.767 1.00 54.51 C ATOM 270 OE1 GLU A 20 0.657 25.230 2.247 1.00 55.84 O ATOM 271 OE2 GLU A 20 1.543 23.372 3.137 1.00 58.41 O ATOM 272 HA GLU A 20 5.208 26.515 2.597 1.00 0.00 H ATOM 273 HB2 GLU A 20 2.243 27.243 2.424 1.00 0.00 H ATOM 274 HB3 GLU A 20 3.106 26.370 1.136 1.00 0.00 H ATOM 275 HG2 GLU A 20 3.742 24.604 2.693 1.00 0.00 H ATOM 276 HG3 GLU A 20 3.038 25.506 4.056 1.00 0.00 H ATOM 277 H GLU A 20 3.378 27.609 4.511 1.00 0.00 H ATOM 278 N THR A 21 4.316 29.574 1.922 1.00 13.93 N ATOM 279 CA THR A 21 4.642 30.724 1.092 1.00 15.04 C ATOM 280 C THR A 21 6.121 31.058 1.243 1.00 19.85 C ATOM 281 O THR A 21 6.816 31.364 0.262 1.00 19.34 O ATOM 282 CB THR A 21 3.733 31.906 1.462 1.00 12.94 C ATOM 283 OG1 THR A 21 2.384 31.506 1.174 1.00 16.82 O ATOM 284 CG2 THR A 21 4.060 33.160 0.686 1.00 14.38 C ATOM 285 HA THR A 21 4.463 30.495 0.041 1.00 0.00 H ATOM 286 HB THR A 21 3.878 32.146 2.515 1.00 0.00 H ATOM 287 HG1 THR A 21 2.156 30.707 1.712 1.00 0.00 H ATOM 288 HG23 THR A 21 5.084 33.464 0.904 1.00 0.00 H ATOM 289 HG21 THR A 21 3.958 32.962 -0.381 1.00 0.00 H ATOM 290 HG22 THR A 21 3.374 33.955 0.977 1.00 0.00 H ATOM 291 H THR A 21 3.703 29.720 2.749 1.00 0.00 H ATOM 292 N ILE A 22 6.653 31.019 2.464 1.00 15.28 N ATOM 293 CA ILE A 22 8.070 31.307 2.734 1.00 16.78 C ATOM 294 C ILE A 22 8.912 30.211 2.094 1.00 15.82 C ATOM 295 O ILE A 22 9.929 30.501 1.446 1.00 15.57 O ATOM 296 CB ILE A 22 8.311 31.404 4.260 1.00 15.95 C ATOM 297 CG1 ILE A 22 7.640 32.647 4.866 1.00 12.03 C ATOM 298 CG2 ILE A 22 9.819 31.414 4.564 1.00 15.45 C ATOM 299 CD1 ILE A 22 7.581 32.618 6.380 1.00 13.93 C ATOM 300 HA ILE A 22 8.357 32.267 2.304 1.00 0.00 H ATOM 301 HB ILE A 22 7.858 30.526 4.720 1.00 0.00 H ATOM 302 HG12 ILE A 22 8.202 33.529 4.558 1.00 0.00 H ATOM 303 HG13 ILE A 22 6.622 32.714 4.481 1.00 0.00 H ATOM 304 HD11 ILE A 22 7.012 31.746 6.704 1.00 0.00 H ATOM 305 HD12 ILE A 22 8.593 32.562 6.781 1.00 0.00 H ATOM 306 HD13 ILE A 22 7.095 33.525 6.741 1.00 0.00 H ATOM 307 HG21 ILE A 22 10.270 30.495 4.190 1.00 0.00 H ATOM 308 HG22 ILE A 22 10.281 32.272 4.075 1.00 0.00 H ATOM 309 HG23 ILE A 22 9.971 31.483 5.641 1.00 0.00 H ATOM 310 H ILE A 22 6.037 30.773 3.265 1.00 0.00 H ATOM 311 N ALA A 23 8.534 28.935 2.233 1.00 13.38 N ATOM 312 CA ALA A 23 9.221 27.793 1.660 1.00 14.85 C ATOM 313 C ALA A 23 9.355 27.981 0.142 1.00 20.96 C ATOM 314 O ALA A 23 10.447 27.715 -0.372 1.00 21.30 O ATOM 315 CB ALA A 23 8.535 26.457 1.918 1.00 13.12 C ATOM 316 HA ALA A 23 10.192 27.755 2.153 1.00 0.00 H ATOM 317 HB1 ALA A 23 8.469 26.285 2.992 1.00 0.00 H ATOM 318 HB2 ALA A 23 7.533 26.476 1.490 1.00 0.00 H ATOM 319 HB3 ALA A 23 9.114 25.657 1.456 1.00 0.00 H ATOM 320 H ALA A 23 7.680 28.747 2.796 1.00 0.00 H ATOM 321 N ARG A 24 8.327 28.408 -0.586 1.00 19.79 N ATOM 322 CA ARG A 24 8.440 28.654 -2.013 1.00 25.04 C ATOM 323 C ARG A 24 9.435 29.765 -2.343 1.00 20.80 C ATOM 324 O ARG A 24 10.223 29.572 -3.259 1.00 24.25 O ATOM 325 CB ARG A 24 7.156 29.171 -2.712 1.00 33.94 C ATOM 326 CG ARG A 24 6.547 28.092 -3.547 1.00 52.03 C ATOM 327 CD ARG A 24 5.706 28.431 -4.770 1.00 57.59 C ATOM 328 NE ARG A 24 5.118 27.110 -5.135 1.00 63.43 N ATOM 329 CZ ARG A 24 5.711 26.227 -5.940 1.00 62.77 C ATOM 330 NH1 ARG A 24 6.872 26.539 -6.511 1.00 63.55 N ATOM 331 NH2 ARG A 24 5.113 25.064 -6.189 1.00 62.68 N ATOM 332 HA ARG A 24 8.723 27.662 -2.364 1.00 0.00 H ATOM 333 HB2 ARG A 24 6.438 29.489 -1.956 1.00 0.00 H ATOM 334 HB3 ARG A 24 7.410 30.018 -3.349 1.00 0.00 H ATOM 335 HG2 ARG A 24 7.370 27.469 -3.899 1.00 0.00 H ATOM 336 HG3 ARG A 24 5.909 27.508 -2.883 1.00 0.00 H ATOM 337 HD2 ARG A 24 6.325 28.824 -5.577 1.00 0.00 H ATOM 338 HD3 ARG A 24 4.928 29.154 -4.525 1.00 0.00 H ATOM 339 HE ARG A 24 4.189 26.862 -4.738 1.00 0.00 H ATOM 340 HH12 ARG A 24 7.342 25.857 -7.140 1.00 0.00 H ATOM 341 HH11 ARG A 24 7.309 27.465 -6.328 1.00 0.00 H ATOM 342 HH22 ARG A 24 5.567 24.369 -6.815 1.00 0.00 H ATOM 343 HH21 ARG A 24 4.191 24.850 -5.757 1.00 0.00 H ATOM 344 H ARG A 24 7.413 28.571 -0.118 1.00 0.00 H ATOM 345 N GLU A 25 9.386 30.893 -1.660 1.00 18.81 N ATOM 346 CA GLU A 25 10.317 31.984 -1.925 1.00 23.22 C ATOM 347 C GLU A 25 11.750 31.504 -1.725 1.00 23.57 C ATOM 348 O GLU A 25 12.604 31.845 -2.548 1.00 23.30 O ATOM 349 CB GLU A 25 9.980 33.230 -1.124 1.00 27.87 C ATOM 350 CG GLU A 25 10.285 34.530 -1.857 1.00 48.67 C ATOM 351 CD GLU A 25 11.624 35.183 -1.583 1.00 57.11 C ATOM 352 OE1 GLU A 25 12.523 34.593 -0.933 1.00 60.06 O ATOM 353 OE2 GLU A 25 11.810 36.351 -2.017 1.00 56.50 O ATOM 354 HA GLU A 25 10.218 32.285 -2.968 1.00 0.00 H ATOM 355 HB2 GLU A 25 8.916 33.210 -0.887 1.00 0.00 H ATOM 356 HB3 GLU A 25 10.558 33.212 -0.200 1.00 0.00 H ATOM 357 HG2 GLU A 25 10.233 34.324 -2.926 1.00 0.00 H ATOM 358 HG3 GLU A 25 9.509 35.247 -1.589 1.00 0.00 H ATOM 359 H GLU A 25 8.668 31.007 -0.916 1.00 0.00 H ATOM 360 N LEU A 26 12.070 30.712 -0.709 1.00 19.45 N ATOM 361 CA LEU A 26 13.414 30.200 -0.480 1.00 21.70 C ATOM 362 C LEU A 26 13.846 29.229 -1.573 1.00 21.33 C ATOM 363 O LEU A 26 14.971 29.330 -2.087 1.00 21.16 O ATOM 364 CB LEU A 26 13.552 29.579 0.932 1.00 21.47 C ATOM 365 CG LEU A 26 13.421 30.556 2.120 1.00 25.22 C ATOM 366 CD1 LEU A 26 13.782 29.921 3.460 1.00 21.96 C ATOM 367 CD2 LEU A 26 14.249 31.824 1.948 1.00 22.55 C ATOM 368 HA LEU A 26 14.095 31.050 -0.526 1.00 0.00 H ATOM 369 HB2 LEU A 26 12.778 28.819 1.039 1.00 0.00 H ATOM 370 HB3 LEU A 26 14.533 29.108 0.994 1.00 0.00 H ATOM 371 HG LEU A 26 12.364 30.821 2.125 1.00 0.00 H ATOM 372 HD21 LEU A 26 15.302 31.559 1.853 1.00 0.00 H ATOM 373 HD22 LEU A 26 13.923 32.350 1.051 1.00 0.00 H ATOM 374 HD23 LEU A 26 14.112 32.467 2.817 1.00 0.00 H ATOM 375 HD11 LEU A 26 13.119 29.077 3.651 1.00 0.00 H ATOM 376 HD12 LEU A 26 14.815 29.574 3.430 1.00 0.00 H ATOM 377 HD13 LEU A 26 13.669 30.660 4.253 1.00 0.00 H ATOM 378 H LEU A 26 11.320 30.443 -0.040 1.00 0.00 H ATOM 379 N ALA A 27 12.998 28.305 -1.979 1.00 19.74 N ATOM 380 CA ALA A 27 13.244 27.320 -3.024 1.00 25.75 C ATOM 381 C ALA A 27 13.500 27.908 -4.410 1.00 26.39 C ATOM 382 O ALA A 27 14.329 27.407 -5.185 1.00 32.76 O ATOM 383 CB ALA A 27 12.053 26.345 -3.149 1.00 24.25 C ATOM 384 HA ALA A 27 14.155 26.813 -2.704 1.00 0.00 H ATOM 385 HB1 ALA A 27 11.910 25.825 -2.202 1.00 0.00 H ATOM 386 HB2 ALA A 27 11.151 26.905 -3.398 1.00 0.00 H ATOM 387 HB3 ALA A 27 12.260 25.619 -3.935 1.00 0.00 H ATOM 388 H ALA A 27 12.070 28.277 -1.511 1.00 0.00 H ATOM 389 N ASP A 28 12.828 28.988 -4.761 1.00 23.44 N ATOM 390 CA ASP A 28 12.915 29.712 -6.017 1.00 23.08 C ATOM 391 C ASP A 28 14.179 30.561 -6.091 1.00 26.12 C ATOM 392 O ASP A 28 14.613 31.082 -7.122 1.00 28.00 O ATOM 393 CB ASP A 28 11.632 30.522 -6.271 1.00 25.16 C ATOM 394 CG ASP A 28 10.387 29.678 -6.540 1.00 31.67 C ATOM 395 OD1 ASP A 28 10.391 28.414 -6.664 1.00 26.38 O ATOM 396 OD2 ASP A 28 9.299 30.326 -6.628 1.00 37.67 O ATOM 397 HA ASP A 28 12.995 28.986 -6.826 1.00 0.00 H ATOM 398 HB2 ASP A 28 11.441 31.140 -5.394 1.00 0.00 H ATOM 399 HB3 ASP A 28 11.801 31.164 -7.136 1.00 0.00 H ATOM 400 H ASP A 28 12.160 29.364 -4.058 1.00 0.00 H ATOM 401 N ALA A 29 14.867 30.711 -4.960 1.00 24.33 N ATOM 402 CA ALA A 29 16.105 31.444 -4.819 1.00 25.58 C ATOM 403 C ALA A 29 17.280 30.469 -4.704 1.00 29.65 C ATOM 404 O ALA A 29 18.438 30.849 -4.512 1.00 36.60 O ATOM 405 CB ALA A 29 16.085 32.327 -3.592 1.00 30.87 C ATOM 406 HA ALA A 29 16.220 32.071 -5.703 1.00 0.00 H ATOM 407 HB1 ALA A 29 15.266 33.042 -3.673 1.00 0.00 H ATOM 408 HB2 ALA A 29 15.944 31.710 -2.704 1.00 0.00 H ATOM 409 HB3 ALA A 29 17.031 32.864 -3.517 1.00 0.00 H ATOM 410 H ALA A 29 14.480 30.262 -4.105 1.00 0.00 H ATOM 411 N GLY A 30 16.988 29.181 -4.821 1.00 27.76 N ATOM 412 CA GLY A 30 17.959 28.126 -4.762 1.00 30.07 C ATOM 413 C GLY A 30 18.255 27.320 -3.528 1.00 34.73 C ATOM 414 O GLY A 30 19.205 26.509 -3.563 1.00 32.88 O ATOM 415 HA3 GLY A 30 18.906 28.580 -5.052 1.00 0.00 H ATOM 416 HA2 GLY A 30 17.657 27.404 -5.521 1.00 0.00 H ATOM 417 H GLY A 30 15.992 28.919 -4.965 1.00 0.00 H ATOM 418 N TYR A 31 17.514 27.477 -2.422 1.00 31.37 N ATOM 419 CA TYR A 31 17.773 26.719 -1.213 1.00 22.07 C ATOM 420 C TYR A 31 17.075 25.366 -1.220 1.00 21.37 C ATOM 421 O TYR A 31 16.042 25.267 -1.878 1.00 24.58 O ATOM 422 CB TYR A 31 17.097 27.351 0.020 1.00 23.00 C ATOM 423 CG TYR A 31 17.780 28.534 0.633 1.00 28.21 C ATOM 424 CD1 TYR A 31 17.990 29.679 -0.131 1.00 30.17 C ATOM 425 CD2 TYR A 31 18.225 28.513 1.950 1.00 28.48 C ATOM 426 CE1 TYR A 31 18.624 30.785 0.401 1.00 33.27 C ATOM 427 CE2 TYR A 31 18.858 29.626 2.482 1.00 31.77 C ATOM 428 CZ TYR A 31 19.049 30.749 1.713 1.00 34.20 C ATOM 429 OH TYR A 31 19.675 31.872 2.208 1.00 38.26 O ATOM 430 HA TYR A 31 18.861 26.675 -1.174 1.00 0.00 H ATOM 431 HB3 TYR A 31 17.022 26.580 0.787 1.00 0.00 H ATOM 432 HB2 TYR A 31 16.096 27.665 -0.277 1.00 0.00 H ATOM 433 HD2 TYR A 31 18.077 27.624 2.563 1.00 0.00 H ATOM 434 HE2 TYR A 31 19.206 29.610 3.515 1.00 0.00 H ATOM 435 HE1 TYR A 31 18.786 31.674 -0.208 1.00 0.00 H ATOM 436 HD1 TYR A 31 17.649 29.703 -1.166 1.00 0.00 H ATOM 437 HH TYR A 31 19.713 32.565 1.502 1.00 0.00 H ATOM 438 H TYR A 31 16.731 28.162 -2.431 1.00 0.00 H ATOM 439 N GLU A 32 17.653 24.434 -0.473 1.00 21.73 N ATOM 440 CA GLU A 32 16.964 23.146 -0.326 1.00 28.39 C ATOM 441 C GLU A 32 16.214 23.439 1.010 1.00 27.66 C ATOM 442 O GLU A 32 16.789 23.924 1.979 1.00 24.23 O ATOM 443 CB GLU A 32 17.682 21.861 -0.365 1.00 40.49 C ATOM 444 CG GLU A 32 19.164 21.662 -0.469 1.00 62.16 C ATOM 445 CD GLU A 32 19.574 20.215 -0.186 1.00 73.68 C ATOM 446 OE1 GLU A 32 18.736 19.442 0.359 1.00 77.54 O ATOM 447 OE2 GLU A 32 20.742 19.861 -0.503 1.00 81.35 O ATOM 448 HA GLU A 32 16.382 22.911 -1.217 1.00 0.00 H ATOM 449 HB2 GLU A 32 17.393 21.349 0.552 1.00 0.00 H ATOM 450 HB3 GLU A 32 17.266 21.332 -1.222 1.00 0.00 H ATOM 451 HG2 GLU A 32 19.484 21.927 -1.477 1.00 0.00 H ATOM 452 HG3 GLU A 32 19.658 22.314 0.251 1.00 0.00 H ATOM 453 H GLU A 32 18.566 24.610 -0.006 1.00 0.00 H ATOM 454 N VAL A 33 14.911 23.248 0.963 1.00 26.33 N ATOM 455 CA VAL A 33 13.997 23.524 2.057 1.00 24.31 C ATOM 456 C VAL A 33 13.264 22.288 2.557 1.00 25.53 C ATOM 457 O VAL A 33 12.716 21.510 1.767 1.00 25.32 O ATOM 458 CB VAL A 33 12.893 24.516 1.577 1.00 24.52 C ATOM 459 CG1 VAL A 33 11.986 24.900 2.743 1.00 24.79 C ATOM 460 CG2 VAL A 33 13.459 25.769 0.929 1.00 24.17 C ATOM 461 HA VAL A 33 14.612 23.927 2.862 1.00 0.00 H ATOM 462 HB VAL A 33 12.317 23.995 0.812 1.00 0.00 H ATOM 463 HG11 VAL A 33 11.512 24.004 3.143 1.00 0.00 H ATOM 464 HG12 VAL A 33 12.580 25.377 3.522 1.00 0.00 H ATOM 465 HG13 VAL A 33 11.220 25.593 2.393 1.00 0.00 H ATOM 466 HG21 VAL A 33 14.088 26.296 1.647 1.00 0.00 H ATOM 467 HG22 VAL A 33 14.054 25.490 0.059 1.00 0.00 H ATOM 468 HG23 VAL A 33 12.640 26.417 0.617 1.00 0.00 H ATOM 469 H VAL A 33 14.509 22.873 0.080 1.00 0.00 H ATOM 470 N ASP A 34 13.237 22.137 3.875 1.00 18.97 N ATOM 471 CA ASP A 34 12.525 21.014 4.523 1.00 21.39 C ATOM 472 C ASP A 34 11.462 21.682 5.400 1.00 22.78 C ATOM 473 O ASP A 34 11.779 22.434 6.339 1.00 22.53 O ATOM 474 CB ASP A 34 13.612 20.201 5.173 1.00 30.01 C ATOM 475 CG ASP A 34 13.243 18.907 5.832 1.00 40.69 C ATOM 476 OD1 ASP A 34 12.032 18.678 6.073 1.00 47.87 O ATOM 477 OD2 ASP A 34 14.202 18.143 6.104 1.00 44.13 O ATOM 478 HA ASP A 34 11.972 20.303 3.909 1.00 0.00 H ATOM 479 HB2 ASP A 34 14.347 19.971 4.401 1.00 0.00 H ATOM 480 HB3 ASP A 34 14.072 20.830 5.935 1.00 0.00 H ATOM 481 H ASP A 34 13.732 22.830 4.471 1.00 0.00 H ATOM 482 N SER A 35 10.179 21.489 5.104 1.00 17.80 N ATOM 483 CA SER A 35 9.095 22.147 5.853 1.00 19.93 C ATOM 484 C SER A 35 8.336 21.152 6.692 1.00 23.87 C ATOM 485 O SER A 35 7.871 20.130 6.172 1.00 25.07 O ATOM 486 CB SER A 35 8.242 22.880 4.815 1.00 24.62 C ATOM 487 OG SER A 35 7.238 23.660 5.430 1.00 35.40 O ATOM 488 HA SER A 35 9.469 22.870 6.578 1.00 0.00 H ATOM 489 HB2 SER A 35 7.771 22.146 4.161 1.00 0.00 H ATOM 490 HB3 SER A 35 8.885 23.532 4.224 1.00 0.00 H ATOM 491 HG SER A 35 6.706 24.120 4.733 1.00 0.00 H ATOM 492 H SER A 35 9.934 20.853 4.318 1.00 0.00 H ATOM 493 N ARG A 36 8.233 21.318 8.022 1.00 19.05 N ATOM 494 CA ARG A 36 7.565 20.335 8.851 1.00 14.59 C ATOM 495 C ARG A 36 6.606 20.892 9.894 1.00 13.49 C ATOM 496 O ARG A 36 6.893 21.913 10.487 1.00 13.93 O ATOM 497 CB ARG A 36 8.585 19.536 9.720 1.00 14.22 C ATOM 498 CG ARG A 36 9.638 18.894 8.857 1.00 25.17 C ATOM 499 CD ARG A 36 10.388 17.792 9.571 1.00 41.85 C ATOM 500 NE ARG A 36 11.798 17.896 9.171 1.00 49.87 N ATOM 501 CZ ARG A 36 12.792 17.209 9.740 1.00 53.78 C ATOM 502 NH1 ARG A 36 12.504 16.365 10.732 1.00 55.32 N ATOM 503 NH2 ARG A 36 14.042 17.385 9.313 1.00 47.44 N ATOM 504 HA ARG A 36 7.028 19.745 8.108 1.00 0.00 H ATOM 505 HB2 ARG A 36 9.065 20.216 10.423 1.00 0.00 H ATOM 506 HB3 ARG A 36 8.054 18.761 10.272 1.00 0.00 H ATOM 507 HG2 ARG A 36 9.156 18.473 7.974 1.00 0.00 H ATOM 508 HG3 ARG A 36 10.351 19.659 8.550 1.00 0.00 H ATOM 509 HD2 ARG A 36 9.988 16.820 9.282 1.00 0.00 H ATOM 510 HD3 ARG A 36 10.296 17.915 10.650 1.00 0.00 H ATOM 511 HE ARG A 36 12.037 18.546 8.395 1.00 0.00 H ATOM 512 HH12 ARG A 36 13.263 15.821 11.188 1.00 0.00 H ATOM 513 HH11 ARG A 36 11.520 16.251 11.049 1.00 0.00 H ATOM 514 HH22 ARG A 36 14.821 16.853 9.751 1.00 0.00 H ATOM 515 HH21 ARG A 36 14.239 18.054 8.541 1.00 0.00 H ATOM 516 H ARG A 36 8.640 22.167 8.464 1.00 0.00 H ATOM 517 N ASP A 37 5.510 20.171 10.076 1.00 14.13 N ATOM 518 CA ASP A 37 4.531 20.523 11.099 1.00 15.37 C ATOM 519 C ASP A 37 5.196 20.183 12.442 1.00 16.22 C ATOM 520 O ASP A 37 5.777 19.088 12.597 1.00 15.78 O ATOM 521 CB ASP A 37 3.276 19.675 10.893 1.00 15.08 C ATOM 522 CG ASP A 37 2.153 20.007 11.849 1.00 22.59 C ATOM 523 OD1 ASP A 37 2.321 20.342 13.040 1.00 19.10 O ATOM 524 OD2 ASP A 37 1.005 19.934 11.350 1.00 26.30 O ATOM 525 HA ASP A 37 4.239 21.573 11.060 1.00 0.00 H ATOM 526 HB2 ASP A 37 2.919 19.831 9.875 1.00 0.00 H ATOM 527 HB3 ASP A 37 3.543 18.627 11.027 1.00 0.00 H ATOM 528 H ASP A 37 5.344 19.337 9.477 1.00 0.00 H ATOM 529 N ALA A 38 5.111 21.073 13.436 1.00 14.64 N ATOM 530 CA ALA A 38 5.700 20.795 14.748 1.00 13.87 C ATOM 531 C ALA A 38 5.111 19.535 15.378 1.00 19.21 C ATOM 532 O ALA A 38 5.767 18.873 16.197 1.00 17.12 O ATOM 533 CB ALA A 38 5.485 21.975 15.689 1.00 12.28 C ATOM 534 HA ALA A 38 6.767 20.636 14.594 1.00 0.00 H ATOM 535 HB1 ALA A 38 5.956 22.864 15.269 1.00 0.00 H ATOM 536 HB2 ALA A 38 4.416 22.152 15.810 1.00 0.00 H ATOM 537 HB3 ALA A 38 5.929 21.750 16.659 1.00 0.00 H ATOM 538 H ALA A 38 4.620 21.975 13.275 1.00 0.00 H ATOM 539 N ALA A 39 3.878 19.113 15.093 1.00 17.98 N ATOM 540 CA ALA A 39 3.263 17.919 15.663 1.00 19.81 C ATOM 541 C ALA A 39 4.002 16.630 15.304 1.00 22.96 C ATOM 542 O ALA A 39 3.840 15.616 15.985 1.00 29.63 O ATOM 543 CB ALA A 39 1.812 17.791 15.193 1.00 16.96 C ATOM 544 HA ALA A 39 3.313 18.045 16.745 1.00 0.00 H ATOM 545 HB1 ALA A 39 1.249 18.668 15.512 1.00 0.00 H ATOM 546 HB2 ALA A 39 1.789 17.719 14.106 1.00 0.00 H ATOM 547 HB3 ALA A 39 1.368 16.895 15.627 1.00 0.00 H ATOM 548 H ALA A 39 3.317 19.673 14.419 1.00 0.00 H ATOM 549 N SER A 40 4.832 16.603 14.271 1.00 19.36 N ATOM 550 CA SER A 40 5.548 15.425 13.841 1.00 23.03 C ATOM 551 C SER A 40 7.056 15.419 14.048 1.00 27.35 C ATOM 552 O SER A 40 7.731 14.491 13.549 1.00 31.33 O ATOM 553 CB SER A 40 5.239 15.270 12.337 1.00 29.09 C ATOM 554 OG SER A 40 6.028 16.162 11.549 1.00 37.47 O ATOM 555 HA SER A 40 5.207 14.601 14.467 1.00 0.00 H ATOM 556 HB2 SER A 40 4.184 15.485 12.167 1.00 0.00 H ATOM 557 HB3 SER A 40 5.453 14.245 12.034 1.00 0.00 H ATOM 558 HG SER A 40 5.834 17.095 11.816 1.00 0.00 H ATOM 559 H SER A 40 4.976 17.484 13.738 1.00 0.00 H ATOM 560 N VAL A 41 7.622 16.406 14.745 1.00 21.39 N ATOM 561 CA VAL A 41 9.078 16.424 14.926 1.00 21.87 C ATOM 562 C VAL A 41 9.453 16.093 16.368 1.00 25.96 C ATOM 563 O VAL A 41 8.665 16.204 17.313 1.00 26.59 O ATOM 564 CB VAL A 41 9.726 17.773 14.533 1.00 21.20 C ATOM 565 CG1 VAL A 41 9.320 18.210 13.133 1.00 22.09 C ATOM 566 CG2 VAL A 41 9.371 18.861 15.549 1.00 21.08 C ATOM 567 HA VAL A 41 9.467 15.661 14.252 1.00 0.00 H ATOM 568 HB VAL A 41 10.806 17.624 14.535 1.00 0.00 H ATOM 569 HG11 VAL A 41 9.636 17.456 12.412 1.00 0.00 H ATOM 570 HG12 VAL A 41 8.237 18.325 13.089 1.00 0.00 H ATOM 571 HG13 VAL A 41 9.797 19.161 12.898 1.00 0.00 H ATOM 572 HG21 VAL A 41 8.289 18.986 15.582 1.00 0.00 H ATOM 573 HG22 VAL A 41 9.735 18.569 16.534 1.00 0.00 H ATOM 574 HG23 VAL A 41 9.838 19.800 15.252 1.00 0.00 H ATOM 575 H VAL A 41 7.034 17.158 15.158 1.00 0.00 H ATOM 576 N GLU A 42 10.703 15.692 16.501 1.00 28.36 N ATOM 577 CA GLU A 42 11.398 15.355 17.731 1.00 33.22 C ATOM 578 C GLU A 42 12.449 16.452 17.982 1.00 25.02 C ATOM 579 O GLU A 42 13.222 16.708 17.049 1.00 24.70 O ATOM 580 CB GLU A 42 12.124 14.011 17.550 1.00 47.74 C ATOM 581 CG GLU A 42 12.246 13.224 18.856 1.00 67.99 C ATOM 582 CD GLU A 42 10.851 12.758 19.273 1.00 77.94 C ATOM 583 OE1 GLU A 42 10.443 11.737 18.671 1.00 85.93 O ATOM 584 OE2 GLU A 42 10.202 13.403 20.128 1.00 83.28 O ATOM 585 HA GLU A 42 10.697 15.282 18.562 1.00 0.00 H ATOM 586 HB2 GLU A 42 11.569 13.409 16.831 1.00 0.00 H ATOM 587 HB3 GLU A 42 13.125 14.204 17.165 1.00 0.00 H ATOM 588 HG2 GLU A 42 12.893 12.360 18.706 1.00 0.00 H ATOM 589 HG3 GLU A 42 12.668 13.862 19.632 1.00 0.00 H ATOM 590 H GLU A 42 11.255 15.607 15.623 1.00 0.00 H ATOM 591 N ALA A 43 12.512 17.071 19.151 1.00 19.41 N ATOM 592 CA ALA A 43 13.444 18.145 19.428 1.00 17.09 C ATOM 593 C ALA A 43 14.915 17.782 19.388 1.00 16.99 C ATOM 594 O ALA A 43 15.724 18.596 18.923 1.00 16.19 O ATOM 595 CB ALA A 43 13.124 18.790 20.794 1.00 16.81 C ATOM 596 HA ALA A 43 13.296 18.842 18.603 1.00 0.00 H ATOM 597 HB1 ALA A 43 12.111 19.192 20.776 1.00 0.00 H ATOM 598 HB2 ALA A 43 13.204 18.037 21.578 1.00 0.00 H ATOM 599 HB3 ALA A 43 13.832 19.595 20.989 1.00 0.00 H ATOM 600 H ALA A 43 11.862 16.772 19.906 1.00 0.00 H ATOM 601 N GLY A 44 15.305 16.617 19.877 1.00 18.64 N ATOM 602 CA GLY A 44 16.706 16.217 19.913 1.00 17.69 C ATOM 603 C GLY A 44 17.508 16.315 18.643 1.00 17.50 C ATOM 604 O GLY A 44 17.283 15.535 17.708 1.00 20.11 O ATOM 605 HA3 GLY A 44 16.737 15.176 20.235 1.00 0.00 H ATOM 606 HA2 GLY A 44 17.201 16.841 20.657 1.00 0.00 H ATOM 607 H GLY A 44 14.587 15.963 20.249 1.00 0.00 H ATOM 608 N GLY A 45 18.462 17.260 18.538 1.00 17.35 N ATOM 609 CA GLY A 45 19.284 17.464 17.355 1.00 16.42 C ATOM 610 C GLY A 45 18.487 17.872 16.115 1.00 15.74 C ATOM 611 O GLY A 45 18.938 17.726 14.973 1.00 17.05 O ATOM 612 HA3 GLY A 45 19.809 16.534 17.136 1.00 0.00 H ATOM 613 HA2 GLY A 45 20.010 18.248 17.571 1.00 0.00 H ATOM 614 H GLY A 45 18.621 17.884 19.355 1.00 0.00 H ATOM 615 N LEU A 46 17.292 18.446 16.273 1.00 14.77 N ATOM 616 CA LEU A 46 16.422 18.839 15.169 1.00 16.42 C ATOM 617 C LEU A 46 17.075 19.761 14.160 1.00 14.29 C ATOM 618 O LEU A 46 16.880 19.615 12.943 1.00 16.39 O ATOM 619 CB LEU A 46 15.127 19.443 15.746 1.00 15.06 C ATOM 620 CG LEU A 46 14.011 19.837 14.769 1.00 19.34 C ATOM 621 CD1 LEU A 46 13.536 18.715 13.877 1.00 16.34 C ATOM 622 CD2 LEU A 46 12.857 20.430 15.586 1.00 20.26 C ATOM 623 HA LEU A 46 16.192 17.940 14.598 1.00 0.00 H ATOM 624 HB2 LEU A 46 14.708 18.711 16.436 1.00 0.00 H ATOM 625 HB3 LEU A 46 15.407 20.341 16.297 1.00 0.00 H ATOM 626 HG LEU A 46 14.419 20.572 14.075 1.00 0.00 H ATOM 627 HD21 LEU A 46 12.494 19.685 16.294 1.00 0.00 H ATOM 628 HD22 LEU A 46 13.211 21.306 16.129 1.00 0.00 H ATOM 629 HD23 LEU A 46 12.049 20.719 14.914 1.00 0.00 H ATOM 630 HD11 LEU A 46 14.370 18.352 13.277 1.00 0.00 H ATOM 631 HD12 LEU A 46 13.148 17.903 14.492 1.00 0.00 H ATOM 632 HD13 LEU A 46 12.748 19.083 13.220 1.00 0.00 H ATOM 633 H LEU A 46 16.961 18.624 17.243 1.00 0.00 H ATOM 634 N PHE A 47 17.855 20.722 14.639 1.00 11.44 N ATOM 635 CA PHE A 47 18.516 21.691 13.784 1.00 15.28 C ATOM 636 C PHE A 47 19.877 21.252 13.251 1.00 17.39 C ATOM 637 O PHE A 47 20.437 22.017 12.456 1.00 14.82 O ATOM 638 CB PHE A 47 18.676 23.052 14.469 1.00 13.72 C ATOM 639 CG PHE A 47 17.450 23.652 15.107 1.00 16.56 C ATOM 640 CD1 PHE A 47 16.162 23.219 14.846 1.00 16.18 C ATOM 641 CD2 PHE A 47 17.611 24.720 15.987 1.00 16.72 C ATOM 642 CE1 PHE A 47 15.048 23.796 15.444 1.00 16.46 C ATOM 643 CE2 PHE A 47 16.508 25.313 16.593 1.00 19.98 C ATOM 644 CZ PHE A 47 15.228 24.850 16.323 1.00 13.03 C ATOM 645 HA PHE A 47 17.844 21.774 12.930 1.00 0.00 H ATOM 646 HB2 PHE A 47 19.430 22.940 15.248 1.00 0.00 H ATOM 647 HB3 PHE A 47 19.033 23.757 13.718 1.00 0.00 H ATOM 648 HD2 PHE A 47 18.611 25.095 16.203 1.00 0.00 H ATOM 649 HE2 PHE A 47 16.650 26.145 17.283 1.00 0.00 H ATOM 650 HZ PHE A 47 14.366 25.315 16.802 1.00 0.00 H ATOM 651 HE1 PHE A 47 14.047 23.424 15.224 1.00 0.00 H ATOM 652 HD1 PHE A 47 16.016 22.396 14.146 1.00 0.00 H ATOM 653 H PHE A 47 17.998 20.783 15.667 1.00 0.00 H ATOM 654 N GLU A 48 20.394 20.092 13.647 1.00 16.64 N ATOM 655 CA GLU A 48 21.700 19.683 13.137 1.00 17.04 C ATOM 656 C GLU A 48 21.770 19.650 11.609 1.00 18.08 C ATOM 657 O GLU A 48 20.910 19.061 10.947 1.00 18.92 O ATOM 658 CB GLU A 48 22.080 18.290 13.702 1.00 13.11 C ATOM 659 CG GLU A 48 22.509 18.254 15.152 1.00 15.08 C ATOM 660 CD GLU A 48 23.877 18.887 15.388 1.00 18.16 C ATOM 661 OE1 GLU A 48 24.834 18.602 14.614 1.00 17.71 O ATOM 662 OE2 GLU A 48 24.029 19.692 16.320 1.00 20.59 O ATOM 663 HA GLU A 48 22.411 20.437 13.473 1.00 0.00 H ATOM 664 HB2 GLU A 48 21.212 17.639 13.595 1.00 0.00 H ATOM 665 HB3 GLU A 48 22.902 17.900 13.102 1.00 0.00 H ATOM 666 HG2 GLU A 48 21.770 18.792 15.746 1.00 0.00 H ATOM 667 HG3 GLU A 48 22.547 17.214 15.477 1.00 0.00 H ATOM 668 H GLU A 48 19.875 19.484 14.312 1.00 0.00 H ATOM 669 N GLY A 49 22.792 20.258 11.006 1.00 16.05 N ATOM 670 CA GLY A 49 22.981 20.241 9.573 1.00 17.24 C ATOM 671 C GLY A 49 22.257 21.285 8.768 1.00 19.97 C ATOM 672 O GLY A 49 22.426 21.279 7.541 1.00 23.44 O ATOM 673 HA3 GLY A 49 22.656 19.265 9.211 1.00 0.00 H ATOM 674 HA2 GLY A 49 24.047 20.361 9.382 1.00 0.00 H ATOM 675 H GLY A 49 23.484 20.767 11.593 1.00 0.00 H ATOM 676 N PHE A 50 21.490 22.177 9.377 1.00 14.39 N ATOM 677 CA PHE A 50 20.770 23.208 8.647 1.00 14.31 C ATOM 678 C PHE A 50 21.463 24.554 8.705 1.00 15.51 C ATOM 679 O PHE A 50 21.942 24.980 9.760 1.00 17.23 O ATOM 680 CB PHE A 50 19.327 23.389 9.195 1.00 12.35 C ATOM 681 CG PHE A 50 18.477 22.238 8.725 1.00 12.58 C ATOM 682 CD1 PHE A 50 18.035 22.226 7.408 1.00 13.45 C ATOM 683 CD2 PHE A 50 18.144 21.203 9.583 1.00 14.77 C ATOM 684 CE1 PHE A 50 17.253 21.179 6.948 1.00 14.41 C ATOM 685 CE2 PHE A 50 17.369 20.139 9.131 1.00 18.97 C ATOM 686 CZ PHE A 50 16.928 20.144 7.805 1.00 16.79 C ATOM 687 HA PHE A 50 20.742 22.865 7.613 1.00 0.00 H ATOM 688 HB2 PHE A 50 19.349 23.407 10.285 1.00 0.00 H ATOM 689 HB3 PHE A 50 18.910 24.326 8.826 1.00 0.00 H ATOM 690 HD2 PHE A 50 18.490 21.222 10.616 1.00 0.00 H ATOM 691 HE2 PHE A 50 17.111 19.317 9.799 1.00 0.00 H ATOM 692 HZ PHE A 50 16.317 19.318 7.440 1.00 0.00 H ATOM 693 HE1 PHE A 50 16.897 21.171 5.918 1.00 0.00 H ATOM 694 HD1 PHE A 50 18.304 23.041 6.736 1.00 0.00 H ATOM 695 H PHE A 50 21.400 22.139 10.412 1.00 0.00 H ATOM 696 N ASP A 51 21.524 25.270 7.583 1.00 15.08 N ATOM 697 CA ASP A 51 22.151 26.586 7.558 1.00 17.82 C ATOM 698 C ASP A 51 21.265 27.702 8.087 1.00 19.21 C ATOM 699 O ASP A 51 21.743 28.710 8.607 1.00 20.05 O ATOM 700 CB ASP A 51 22.569 26.926 6.106 1.00 23.03 C ATOM 701 CG ASP A 51 23.518 25.847 5.596 1.00 25.15 C ATOM 702 OD1 ASP A 51 24.614 25.675 6.185 1.00 31.88 O ATOM 703 OD2 ASP A 51 23.168 25.110 4.654 1.00 25.33 O ATOM 704 HA ASP A 51 23.013 26.527 8.222 1.00 0.00 H ATOM 705 HB2 ASP A 51 21.684 26.965 5.470 1.00 0.00 H ATOM 706 HB3 ASP A 51 23.071 27.893 6.087 1.00 0.00 H ATOM 707 H ASP A 51 21.116 24.883 6.708 1.00 0.00 H ATOM 708 N LEU A 52 19.952 27.521 7.933 1.00 18.95 N ATOM 709 CA LEU A 52 18.956 28.493 8.366 1.00 16.43 C ATOM 710 C LEU A 52 17.735 27.747 8.916 1.00 13.29 C ATOM 711 O LEU A 52 17.284 26.751 8.346 1.00 15.24 O ATOM 712 CB LEU A 52 18.541 29.293 7.138 1.00 16.34 C ATOM 713 CG LEU A 52 17.464 30.357 7.318 1.00 20.94 C ATOM 714 CD1 LEU A 52 17.901 31.406 8.347 1.00 19.08 C ATOM 715 CD2 LEU A 52 17.139 31.057 6.011 1.00 18.98 C ATOM 716 HA LEU A 52 19.357 29.147 9.141 1.00 0.00 H ATOM 717 HB2 LEU A 52 19.432 29.792 6.757 1.00 0.00 H ATOM 718 HB3 LEU A 52 18.178 28.584 6.394 1.00 0.00 H ATOM 719 HG LEU A 52 16.571 29.843 7.672 1.00 0.00 H ATOM 720 HD21 LEU A 52 18.037 31.540 5.626 1.00 0.00 H ATOM 721 HD22 LEU A 52 16.780 30.325 5.288 1.00 0.00 H ATOM 722 HD23 LEU A 52 16.367 31.807 6.184 1.00 0.00 H ATOM 723 HD11 LEU A 52 18.079 30.920 9.306 1.00 0.00 H ATOM 724 HD12 LEU A 52 18.818 31.887 8.006 1.00 0.00 H ATOM 725 HD13 LEU A 52 17.116 32.154 8.457 1.00 0.00 H ATOM 726 H LEU A 52 19.623 26.643 7.482 1.00 0.00 H ATOM 727 N VAL A 53 17.228 28.222 10.053 1.00 13.06 N ATOM 728 CA VAL A 53 16.030 27.632 10.679 1.00 11.38 C ATOM 729 C VAL A 53 14.985 28.734 10.872 1.00 11.23 C ATOM 730 O VAL A 53 15.244 29.809 11.415 1.00 13.23 O ATOM 731 CB VAL A 53 16.286 26.976 12.041 1.00 14.63 C ATOM 732 CG1 VAL A 53 15.008 26.349 12.621 1.00 13.14 C ATOM 733 CG2 VAL A 53 17.369 25.893 11.938 1.00 17.66 C ATOM 734 HA VAL A 53 15.692 26.843 10.007 1.00 0.00 H ATOM 735 HB VAL A 53 16.624 27.768 12.709 1.00 0.00 H ATOM 736 HG11 VAL A 53 14.251 27.123 12.750 1.00 0.00 H ATOM 737 HG12 VAL A 53 14.636 25.586 11.937 1.00 0.00 H ATOM 738 HG13 VAL A 53 15.233 25.895 13.586 1.00 0.00 H ATOM 739 HG21 VAL A 53 17.047 25.125 11.235 1.00 0.00 H ATOM 740 HG22 VAL A 53 18.298 26.342 11.587 1.00 0.00 H ATOM 741 HG23 VAL A 53 17.529 25.446 12.919 1.00 0.00 H ATOM 742 H VAL A 53 17.691 29.032 10.512 1.00 0.00 H ATOM 743 N LEU A 54 13.772 28.504 10.416 1.00 10.67 N ATOM 744 CA LEU A 54 12.671 29.477 10.539 1.00 11.17 C ATOM 745 C LEU A 54 11.591 28.842 11.408 1.00 11.92 C ATOM 746 O LEU A 54 11.158 27.726 11.091 1.00 10.82 O ATOM 747 CB LEU A 54 12.151 29.840 9.139 1.00 12.50 C ATOM 748 CG LEU A 54 13.200 30.510 8.229 1.00 18.76 C ATOM 749 CD1 LEU A 54 12.609 30.956 6.904 1.00 23.63 C ATOM 750 CD2 LEU A 54 13.799 31.753 8.884 1.00 20.67 C ATOM 751 HA LEU A 54 13.002 30.404 11.007 1.00 0.00 H ATOM 752 HB2 LEU A 54 11.810 28.926 8.653 1.00 0.00 H ATOM 753 HB3 LEU A 54 11.310 30.524 9.253 1.00 0.00 H ATOM 754 HG LEU A 54 13.964 29.751 8.064 1.00 0.00 H ATOM 755 HD21 LEU A 54 13.006 32.474 9.086 1.00 0.00 H ATOM 756 HD22 LEU A 54 14.283 31.472 9.819 1.00 0.00 H ATOM 757 HD23 LEU A 54 14.534 32.198 8.213 1.00 0.00 H ATOM 758 HD11 LEU A 54 12.207 30.091 6.377 1.00 0.00 H ATOM 759 HD12 LEU A 54 11.811 31.675 7.087 1.00 0.00 H ATOM 760 HD13 LEU A 54 13.387 31.422 6.299 1.00 0.00 H ATOM 761 H LEU A 54 13.582 27.595 9.948 1.00 0.00 H ATOM 762 N LEU A 55 11.168 29.477 12.495 1.00 11.61 N ATOM 763 CA LEU A 55 10.172 28.893 13.389 1.00 12.53 C ATOM 764 C LEU A 55 8.899 29.743 13.441 1.00 9.85 C ATOM 765 O LEU A 55 8.989 30.951 13.653 1.00 10.24 O ATOM 766 CB LEU A 55 10.732 28.793 14.814 1.00 12.41 C ATOM 767 CG LEU A 55 11.935 27.882 15.062 1.00 14.22 C ATOM 768 CD1 LEU A 55 12.329 27.893 16.539 1.00 14.20 C ATOM 769 CD2 LEU A 55 11.661 26.450 14.599 1.00 16.12 C ATOM 770 HA LEU A 55 9.932 27.904 12.999 1.00 0.00 H ATOM 771 HB2 LEU A 55 11.022 29.799 15.118 1.00 0.00 H ATOM 772 HB3 LEU A 55 9.923 28.440 15.454 1.00 0.00 H ATOM 773 HG LEU A 55 12.765 28.273 14.474 1.00 0.00 H ATOM 774 HD21 LEU A 55 10.807 26.050 15.145 1.00 0.00 H ATOM 775 HD22 LEU A 55 11.443 26.450 13.531 1.00 0.00 H ATOM 776 HD23 LEU A 55 12.539 25.833 14.792 1.00 0.00 H ATOM 777 HD11 LEU A 55 12.589 28.909 16.837 1.00 0.00 H ATOM 778 HD12 LEU A 55 11.491 27.540 17.140 1.00 0.00 H ATOM 779 HD13 LEU A 55 13.187 27.238 16.690 1.00 0.00 H ATOM 780 H LEU A 55 11.557 30.416 12.716 1.00 0.00 H ATOM 781 N GLY A 56 7.751 29.071 13.280 1.00 13.38 N ATOM 782 CA GLY A 56 6.494 29.804 13.279 1.00 15.01 C ATOM 783 C GLY A 56 5.358 29.194 14.083 1.00 11.02 C ATOM 784 O GLY A 56 5.160 27.980 14.147 1.00 11.01 O ATOM 785 HA3 GLY A 56 6.160 29.890 12.245 1.00 0.00 H ATOM 786 HA2 GLY A 56 6.689 30.798 13.681 1.00 0.00 H ATOM 787 H GLY A 56 7.758 28.038 13.157 1.00 0.00 H ATOM 788 N CYS A 57 4.525 30.091 14.627 1.00 10.63 N ATOM 789 CA CYS A 57 3.403 29.635 15.451 1.00 12.75 C ATOM 790 C CYS A 57 2.340 30.693 15.719 1.00 9.77 C ATOM 791 O CYS A 57 2.717 31.872 15.805 1.00 12.09 O ATOM 792 CB CYS A 57 4.293 29.502 16.720 1.00 23.26 C ATOM 793 SG CYS A 57 3.558 28.938 18.193 1.00 16.05 S ATOM 794 HA CYS A 57 2.822 28.799 15.061 1.00 0.00 H ATOM 795 HB2 CYS A 57 4.711 30.488 16.925 1.00 0.00 H ATOM 796 HB3 CYS A 57 5.100 28.810 16.477 1.00 0.00 H ATOM 797 HG CYS A 57 2.546 29.801 18.560 1.00 0.00 H ATOM 798 H CYS A 57 4.674 31.107 14.465 1.00 0.00 H ATOM 799 N SER A 58 1.082 30.250 15.909 1.00 11.49 N ATOM 800 CA SER A 58 0.001 31.199 16.219 1.00 9.51 C ATOM 801 C SER A 58 -0.114 31.443 17.729 1.00 11.19 C ATOM 802 O SER A 58 0.470 30.681 18.532 1.00 10.32 O ATOM 803 CB SER A 58 -1.347 30.749 15.640 1.00 7.37 C ATOM 804 OG SER A 58 -1.582 29.384 15.884 1.00 10.67 O ATOM 805 HA SER A 58 0.266 32.141 15.739 1.00 0.00 H ATOM 806 HB2 SER A 58 -1.346 30.922 14.564 1.00 0.00 H ATOM 807 HB3 SER A 58 -2.144 31.334 16.100 1.00 0.00 H ATOM 808 HG SER A 58 -2.457 29.127 15.499 1.00 0.00 H ATOM 809 H SER A 58 0.874 29.234 15.836 1.00 0.00 H ATOM 810 N THR A 59 -0.841 32.508 18.114 1.00 13.04 N ATOM 811 CA THR A 59 -0.980 32.861 19.546 1.00 12.92 C ATOM 812 C THR A 59 -2.399 32.644 20.020 1.00 15.03 C ATOM 813 O THR A 59 -3.334 32.961 19.272 1.00 12.54 O ATOM 814 CB THR A 59 -0.600 34.345 19.748 1.00 13.24 C ATOM 815 OG1 THR A 59 0.720 34.486 19.211 1.00 13.44 O ATOM 816 CG2 THR A 59 -0.590 34.752 21.206 1.00 11.24 C ATOM 817 HA THR A 59 -0.316 32.219 20.125 1.00 0.00 H ATOM 818 HB THR A 59 -1.334 34.983 19.256 1.00 0.00 H ATOM 819 HG1 THR A 59 0.712 34.244 18.251 1.00 0.00 H ATOM 820 HG23 THR A 59 -1.593 34.646 21.618 1.00 0.00 H ATOM 821 HG21 THR A 59 0.100 34.112 21.756 1.00 0.00 H ATOM 822 HG22 THR A 59 -0.269 35.790 21.290 1.00 0.00 H ATOM 823 H THR A 59 -1.313 33.093 17.395 1.00 0.00 H ATOM 824 N TRP A 60 -2.603 32.033 21.179 1.00 14.56 N ATOM 825 CA TRP A 60 -3.920 31.722 21.740 1.00 16.40 C ATOM 826 C TRP A 60 -3.963 32.191 23.186 1.00 25.24 C ATOM 827 O TRP A 60 -3.212 31.599 23.975 1.00 28.31 O ATOM 828 CB TRP A 60 -4.187 30.189 21.722 1.00 14.80 C ATOM 829 CG TRP A 60 -4.142 29.747 20.276 1.00 16.32 C ATOM 830 CD1 TRP A 60 -3.015 29.381 19.578 1.00 17.50 C ATOM 831 CD2 TRP A 60 -5.233 29.753 19.349 1.00 16.05 C ATOM 832 NE1 TRP A 60 -3.348 29.153 18.266 1.00 14.67 N ATOM 833 CE2 TRP A 60 -4.707 29.367 18.100 1.00 16.57 C ATOM 834 CE3 TRP A 60 -6.600 30.004 19.461 1.00 14.76 C ATOM 835 CZ2 TRP A 60 -5.507 29.217 16.971 1.00 14.95 C ATOM 836 CZ3 TRP A 60 -7.389 29.869 18.336 1.00 15.56 C ATOM 837 CH2 TRP A 60 -6.843 29.480 17.101 1.00 18.67 C ATOM 838 HA TRP A 60 -4.677 32.225 21.138 1.00 0.00 H ATOM 839 HB2 TRP A 60 -3.420 29.669 22.296 1.00 0.00 H ATOM 840 HB3 TRP A 60 -5.167 29.975 22.149 1.00 0.00 H ATOM 841 HE1 TRP A 60 -2.686 28.866 17.517 1.00 0.00 H ATOM 842 HD1 TRP A 60 -2.015 29.287 20.000 1.00 0.00 H ATOM 843 HZ2 TRP A 60 -5.084 28.901 16.017 1.00 0.00 H ATOM 844 HH2 TRP A 60 -7.495 29.386 16.232 1.00 0.00 H ATOM 845 HZ3 TRP A 60 -8.458 30.068 18.407 1.00 0.00 H ATOM 846 HE3 TRP A 60 -7.036 30.300 20.415 1.00 0.00 H ATOM 847 H TRP A 60 -1.766 31.754 21.730 1.00 0.00 H ATOM 848 N LEU A 61 -4.776 33.172 23.561 1.00 29.70 N ATOM 849 CA LEU A 61 -4.760 33.605 24.964 1.00 36.16 C ATOM 850 C LEU A 61 -5.048 32.482 25.964 1.00 36.86 C ATOM 851 O LEU A 61 -5.920 31.631 25.828 1.00 29.98 O ATOM 852 CB LEU A 61 -5.649 34.800 25.246 1.00 37.88 C ATOM 853 CG LEU A 61 -6.995 34.831 24.544 1.00 42.79 C ATOM 854 CD1 LEU A 61 -7.815 33.559 24.741 1.00 45.09 C ATOM 855 CD2 LEU A 61 -7.735 36.073 25.038 1.00 52.90 C ATOM 856 HA LEU A 61 -3.728 33.920 25.117 1.00 0.00 H ATOM 857 HB2 LEU A 61 -5.836 34.827 26.320 1.00 0.00 H ATOM 858 HB3 LEU A 61 -5.102 35.696 24.951 1.00 0.00 H ATOM 859 HG LEU A 61 -6.836 34.879 23.467 1.00 0.00 H ATOM 860 HD21 LEU A 61 -7.867 36.010 26.118 1.00 0.00 H ATOM 861 HD22 LEU A 61 -7.154 36.962 24.793 1.00 0.00 H ATOM 862 HD23 LEU A 61 -8.710 36.130 24.554 1.00 0.00 H ATOM 863 HD11 LEU A 61 -7.261 32.707 24.348 1.00 0.00 H ATOM 864 HD12 LEU A 61 -8.005 33.411 25.804 1.00 0.00 H ATOM 865 HD13 LEU A 61 -8.763 33.654 24.211 1.00 0.00 H ATOM 866 H LEU A 61 -5.412 33.625 22.874 1.00 0.00 H ATOM 867 N ASP A 62 -4.232 32.520 27.018 1.00 43.28 N ATOM 868 CA ASP A 62 -4.217 31.571 28.134 1.00 46.84 C ATOM 869 C ASP A 62 -3.540 32.206 29.354 1.00 45.31 C ATOM 870 O ASP A 62 -2.865 33.243 29.226 1.00 34.81 O ATOM 871 CB ASP A 62 -3.424 30.363 27.611 1.00 49.04 C ATOM 872 CG ASP A 62 -3.764 29.034 28.219 1.00 51.42 C ATOM 873 OD1 ASP A 62 -4.722 28.391 27.744 1.00 57.98 O ATOM 874 OD2 ASP A 62 -3.055 28.635 29.164 1.00 55.17 O ATOM 875 HA ASP A 62 -5.216 31.280 28.457 1.00 0.00 H ATOM 876 HB2 ASP A 62 -3.596 30.292 26.537 1.00 0.00 H ATOM 877 HB3 ASP A 62 -2.367 30.553 27.796 1.00 0.00 H ATOM 878 H ASP A 62 -3.541 33.297 27.051 1.00 0.00 H ATOM 879 N ASP A 63 -3.684 31.638 30.552 1.00 53.43 N ATOM 880 CA ASP A 63 -3.095 32.136 31.786 1.00 53.90 C ATOM 881 C ASP A 63 -1.664 31.633 32.040 1.00 47.23 C ATOM 882 O ASP A 63 -0.962 32.247 32.844 1.00 40.89 O ATOM 883 CB ASP A 63 -3.789 31.657 33.070 1.00 57.32 C ATOM 884 CG ASP A 63 -5.207 32.113 33.291 1.00 65.30 C ATOM 885 OD1 ASP A 63 -5.450 33.338 33.174 1.00 63.96 O ATOM 886 OD2 ASP A 63 -6.022 31.198 33.586 1.00 69.60 O ATOM 887 HA ASP A 63 -3.176 33.210 31.618 1.00 0.00 H ATOM 888 HB2 ASP A 63 -3.792 30.567 33.056 1.00 0.00 H ATOM 889 HB3 ASP A 63 -3.195 32.006 33.915 1.00 0.00 H ATOM 890 H ASP A 63 -4.261 30.774 30.609 1.00 0.00 H ATOM 891 N SER A 64 -1.332 30.519 31.404 1.00 44.88 N ATOM 892 CA SER A 64 -0.019 29.905 31.550 1.00 46.95 C ATOM 893 C SER A 64 0.831 30.011 30.287 1.00 49.43 C ATOM 894 O SER A 64 1.878 30.680 30.275 1.00 51.78 O ATOM 895 CB SER A 64 -0.211 28.445 31.999 1.00 48.41 C ATOM 896 OG SER A 64 -1.077 28.423 33.138 1.00 53.46 O ATOM 897 HA SER A 64 0.541 30.451 32.309 1.00 0.00 H ATOM 898 HB2 SER A 64 0.754 28.013 32.264 1.00 0.00 H ATOM 899 HB3 SER A 64 -0.656 27.868 31.189 1.00 0.00 H ATOM 900 HG SER A 64 -1.207 27.487 33.434 1.00 0.00 H ATOM 901 H SER A 64 -2.032 30.068 30.780 1.00 0.00 H ATOM 902 N ILE A 65 0.389 29.395 29.193 1.00 49.52 N ATOM 903 CA ILE A 65 1.141 29.408 27.920 1.00 46.29 C ATOM 904 C ILE A 65 0.273 29.693 26.707 1.00 36.70 C ATOM 905 O ILE A 65 -0.694 28.986 26.401 1.00 34.48 O ATOM 906 CB ILE A 65 1.942 28.079 27.915 1.00 45.80 C ATOM 907 CG1 ILE A 65 3.083 28.082 26.903 1.00 44.03 C ATOM 908 CG2 ILE A 65 1.038 26.854 27.816 1.00 43.00 C ATOM 909 CD1 ILE A 65 2.713 27.656 25.513 1.00 52.15 C ATOM 910 HA ILE A 65 1.837 30.244 27.847 1.00 0.00 H ATOM 911 HB ILE A 65 2.426 28.004 28.889 1.00 0.00 H ATOM 912 HG12 ILE A 65 3.482 29.095 26.849 1.00 0.00 H ATOM 913 HG13 ILE A 65 3.857 27.406 27.267 1.00 0.00 H ATOM 914 HD11 ILE A 65 2.325 26.638 25.538 1.00 0.00 H ATOM 915 HD12 ILE A 65 1.950 28.328 25.120 1.00 0.00 H ATOM 916 HD13 ILE A 65 3.596 27.694 24.875 1.00 0.00 H ATOM 917 HG21 ILE A 65 0.359 26.835 28.669 1.00 0.00 H ATOM 918 HG22 ILE A 65 0.461 26.903 26.892 1.00 0.00 H ATOM 919 HG23 ILE A 65 1.650 25.952 27.816 1.00 0.00 H ATOM 920 H ILE A 65 -0.517 28.887 29.235 1.00 0.00 H ATOM 921 N GLU A 66 0.580 30.778 25.984 1.00 29.08 N ATOM 922 CA GLU A 66 -0.150 31.220 24.812 1.00 30.19 C ATOM 923 C GLU A 66 0.241 30.622 23.463 1.00 21.74 C ATOM 924 O GLU A 66 -0.336 31.031 22.456 1.00 22.53 O ATOM 925 CB GLU A 66 0.015 32.749 24.611 1.00 40.93 C ATOM 926 CG GLU A 66 -0.954 33.581 25.439 1.00 54.76 C ATOM 927 CD GLU A 66 -0.287 34.173 26.664 1.00 63.83 C ATOM 928 OE1 GLU A 66 0.744 33.610 27.105 1.00 70.83 O ATOM 929 OE2 GLU A 66 -0.789 35.201 27.170 1.00 66.72 O ATOM 930 HA GLU A 66 -1.159 30.883 25.051 1.00 0.00 H ATOM 931 HB2 GLU A 66 1.032 33.026 24.889 1.00 0.00 H ATOM 932 HB3 GLU A 66 -0.147 32.978 23.558 1.00 0.00 H ATOM 933 HG2 GLU A 66 -1.340 34.392 24.821 1.00 0.00 H ATOM 934 HG3 GLU A 66 -1.780 32.946 25.759 1.00 0.00 H ATOM 935 H GLU A 66 1.400 31.343 26.285 1.00 0.00 H ATOM 936 N LEU A 67 1.212 29.734 23.405 1.00 15.48 N ATOM 937 CA LEU A 67 1.651 29.107 22.179 1.00 13.25 C ATOM 938 C LEU A 67 0.611 28.080 21.694 1.00 13.77 C ATOM 939 O LEU A 67 -0.093 27.481 22.493 1.00 16.19 O ATOM 940 CB LEU A 67 2.972 28.315 22.379 1.00 11.36 C ATOM 941 CG LEU A 67 4.319 29.019 22.251 1.00 22.69 C ATOM 942 CD1 LEU A 67 4.418 30.328 23.004 1.00 24.09 C ATOM 943 CD2 LEU A 67 5.452 28.129 22.754 1.00 21.54 C ATOM 944 HA LEU A 67 1.791 29.914 21.460 1.00 0.00 H ATOM 945 HB2 LEU A 67 2.934 27.891 23.382 1.00 0.00 H ATOM 946 HB3 LEU A 67 2.969 27.509 21.645 1.00 0.00 H ATOM 947 HG LEU A 67 4.407 29.229 21.185 1.00 0.00 H ATOM 948 HD21 LEU A 67 5.283 27.885 23.803 1.00 0.00 H ATOM 949 HD22 LEU A 67 5.480 27.211 22.167 1.00 0.00 H ATOM 950 HD23 LEU A 67 6.400 28.657 22.651 1.00 0.00 H ATOM 951 HD11 LEU A 67 3.662 31.019 22.630 1.00 0.00 H ATOM 952 HD12 LEU A 67 4.254 30.148 24.066 1.00 0.00 H ATOM 953 HD13 LEU A 67 5.409 30.757 22.856 1.00 0.00 H ATOM 954 H LEU A 67 1.689 29.469 24.290 1.00 0.00 H ATOM 955 N GLN A 68 0.566 27.869 20.395 1.00 12.74 N ATOM 956 CA GLN A 68 -0.299 26.872 19.758 1.00 12.92 C ATOM 957 C GLN A 68 0.155 25.524 20.316 1.00 13.63 C ATOM 958 O GLN A 68 1.365 25.250 20.456 1.00 12.37 O ATOM 959 CB GLN A 68 -0.114 27.040 18.248 1.00 12.16 C ATOM 960 CG GLN A 68 -1.028 26.253 17.342 1.00 8.60 C ATOM 961 CD GLN A 68 -0.655 24.827 17.116 1.00 10.87 C ATOM 962 OE1 GLN A 68 -1.484 24.025 16.654 1.00 15.58 O ATOM 963 NE2 GLN A 68 0.567 24.403 17.361 1.00 8.45 N ATOM 964 HA GLN A 68 -1.366 26.970 19.956 1.00 0.00 H ATOM 965 HB2 GLN A 68 -0.255 28.096 18.017 1.00 0.00 H ATOM 966 HB3 GLN A 68 0.910 26.751 18.010 1.00 0.00 H ATOM 967 HG2 GLN A 68 -2.027 26.272 17.778 1.00 0.00 H ATOM 968 HG3 GLN A 68 -1.047 26.751 16.373 1.00 0.00 H ATOM 969 HE22 GLN A 68 1.277 25.057 17.748 1.00 0.00 H ATOM 970 HE21 GLN A 68 0.823 23.414 17.168 1.00 0.00 H ATOM 971 H GLN A 68 1.181 28.444 19.785 1.00 0.00 H ATOM 972 N ASP A 69 -0.770 24.643 20.678 1.00 14.12 N ATOM 973 CA ASP A 69 -0.543 23.360 21.301 1.00 12.89 C ATOM 974 C ASP A 69 0.467 22.417 20.693 1.00 14.18 C ATOM 975 O ASP A 69 1.216 21.808 21.473 1.00 14.09 O ATOM 976 CB ASP A 69 -1.829 22.542 21.501 1.00 11.37 C ATOM 977 CG ASP A 69 -2.660 23.063 22.654 1.00 16.64 C ATOM 978 OD1 ASP A 69 -2.176 23.840 23.488 1.00 13.07 O ATOM 979 OD2 ASP A 69 -3.864 22.701 22.666 1.00 14.52 O ATOM 980 HA ASP A 69 -0.112 23.717 22.236 1.00 0.00 H ATOM 981 HB2 ASP A 69 -2.423 22.591 20.588 1.00 0.00 H ATOM 982 HB3 ASP A 69 -1.559 21.505 21.702 1.00 0.00 H ATOM 983 H ASP A 69 -1.760 24.904 20.494 1.00 0.00 H ATOM 984 N ASP A 70 0.524 22.264 19.377 1.00 13.65 N ATOM 985 CA ASP A 70 1.490 21.375 18.736 1.00 14.20 C ATOM 986 C ASP A 70 2.925 21.903 18.895 1.00 13.50 C ATOM 987 O ASP A 70 3.874 21.105 18.873 1.00 15.40 O ATOM 988 CB ASP A 70 1.196 21.211 17.235 1.00 13.23 C ATOM 989 CG ASP A 70 -0.161 20.621 16.902 1.00 15.67 C ATOM 990 OD1 ASP A 70 -0.539 19.667 17.619 1.00 21.54 O ATOM 991 OD2 ASP A 70 -0.864 21.061 15.962 1.00 15.82 O ATOM 992 HA ASP A 70 1.397 20.409 19.232 1.00 0.00 H ATOM 993 HB2 ASP A 70 1.260 22.195 16.769 1.00 0.00 H ATOM 994 HB3 ASP A 70 1.960 20.560 16.811 1.00 0.00 H ATOM 995 H ASP A 70 -0.142 22.795 18.781 1.00 0.00 H ATOM 996 N PHE A 71 3.120 23.196 19.081 1.00 10.66 N ATOM 997 CA PHE A 71 4.464 23.752 19.226 1.00 11.41 C ATOM 998 C PHE A 71 4.994 23.708 20.643 1.00 15.47 C ATOM 999 O PHE A 71 6.214 23.758 20.834 1.00 13.97 O ATOM 1000 CB PHE A 71 4.399 25.208 18.759 1.00 11.50 C ATOM 1001 CG PHE A 71 5.713 25.751 18.266 1.00 13.32 C ATOM 1002 CD1 PHE A 71 6.045 25.634 16.921 1.00 13.83 C ATOM 1003 CD2 PHE A 71 6.576 26.396 19.141 1.00 17.79 C ATOM 1004 CE1 PHE A 71 7.260 26.134 16.463 1.00 15.34 C ATOM 1005 CE2 PHE A 71 7.793 26.892 18.674 1.00 19.94 C ATOM 1006 CZ PHE A 71 8.124 26.758 17.337 1.00 15.23 C ATOM 1007 HA PHE A 71 5.148 23.146 18.631 1.00 0.00 H ATOM 1008 HB2 PHE A 71 3.674 25.276 17.948 1.00 0.00 H ATOM 1009 HB3 PHE A 71 4.066 25.822 19.596 1.00 0.00 H ATOM 1010 HD2 PHE A 71 6.304 26.515 20.190 1.00 0.00 H ATOM 1011 HE2 PHE A 71 8.482 27.384 19.361 1.00 0.00 H ATOM 1012 HZ PHE A 71 9.074 27.148 16.973 1.00 0.00 H ATOM 1013 HE1 PHE A 71 7.529 26.032 15.412 1.00 0.00 H ATOM 1014 HD1 PHE A 71 5.356 25.152 16.228 1.00 0.00 H ATOM 1015 H PHE A 71 2.299 23.833 19.125 1.00 0.00 H ATOM 1016 N ILE A 72 4.170 23.572 21.674 1.00 16.28 N ATOM 1017 CA ILE A 72 4.580 23.546 23.072 1.00 16.05 C ATOM 1018 C ILE A 72 5.689 22.571 23.408 1.00 13.09 C ATOM 1019 O ILE A 72 6.683 22.989 24.023 1.00 14.91 O ATOM 1020 CB ILE A 72 3.368 23.462 24.043 1.00 19.34 C ATOM 1021 CG1 ILE A 72 2.558 24.772 23.977 1.00 13.64 C ATOM 1022 CG2 ILE A 72 3.778 23.242 25.503 1.00 18.52 C ATOM 1023 CD1 ILE A 72 1.217 24.642 24.663 1.00 17.97 C ATOM 1024 HA ILE A 72 5.049 24.517 23.234 1.00 0.00 H ATOM 1025 HB ILE A 72 2.779 22.603 23.720 1.00 0.00 H ATOM 1026 HG12 ILE A 72 3.128 25.564 24.464 1.00 0.00 H ATOM 1027 HG13 ILE A 72 2.395 25.034 22.931 1.00 0.00 H ATOM 1028 HD11 ILE A 72 0.637 23.857 24.178 1.00 0.00 H ATOM 1029 HD12 ILE A 72 1.370 24.387 25.712 1.00 0.00 H ATOM 1030 HD13 ILE A 72 0.681 25.588 24.592 1.00 0.00 H ATOM 1031 HG21 ILE A 72 4.333 22.307 25.586 1.00 0.00 H ATOM 1032 HG22 ILE A 72 4.407 24.070 25.831 1.00 0.00 H ATOM 1033 HG23 ILE A 72 2.885 23.193 26.126 1.00 0.00 H ATOM 1034 H ILE A 72 3.155 23.477 21.469 1.00 0.00 H ATOM 1035 N PRO A 73 5.618 21.306 23.056 1.00 17.16 N ATOM 1036 CA PRO A 73 6.642 20.291 23.339 1.00 16.14 C ATOM 1037 C PRO A 73 7.996 20.666 22.755 1.00 19.94 C ATOM 1038 O PRO A 73 9.038 20.439 23.401 1.00 19.47 O ATOM 1039 CB PRO A 73 6.117 18.947 22.834 1.00 15.65 C ATOM 1040 CG PRO A 73 4.646 19.247 22.730 1.00 18.27 C ATOM 1041 CD PRO A 73 4.466 20.708 22.372 1.00 14.83 C ATOM 1042 HA PRO A 73 6.820 20.222 24.412 1.00 0.00 H ATOM 1043 HD3 PRO A 73 4.513 20.866 21.294 1.00 0.00 H ATOM 1044 HD2 PRO A 73 3.524 21.101 22.754 1.00 0.00 H ATOM 1045 HG3 PRO A 73 4.162 19.042 23.685 1.00 0.00 H ATOM 1046 HG2 PRO A 73 4.199 18.623 21.956 1.00 0.00 H ATOM 1047 HB2 PRO A 73 6.544 18.686 21.866 1.00 0.00 H ATOM 1048 HB3 PRO A 73 6.315 18.145 23.545 1.00 0.00 H ATOM 1049 N LEU A 74 8.037 21.273 21.564 1.00 15.64 N ATOM 1050 CA LEU A 74 9.277 21.719 20.928 1.00 14.91 C ATOM 1051 C LEU A 74 9.869 22.883 21.701 1.00 11.83 C ATOM 1052 O LEU A 74 11.055 22.915 22.061 1.00 14.34 O ATOM 1053 CB LEU A 74 9.016 22.104 19.452 1.00 11.18 C ATOM 1054 CG LEU A 74 10.203 22.642 18.649 1.00 18.30 C ATOM 1055 CD1 LEU A 74 11.368 21.653 18.615 1.00 20.04 C ATOM 1056 CD2 LEU A 74 9.795 22.993 17.217 1.00 19.51 C ATOM 1057 HA LEU A 74 9.997 20.901 20.939 1.00 0.00 H ATOM 1058 HB2 LEU A 74 8.650 21.214 18.940 1.00 0.00 H ATOM 1059 HB3 LEU A 74 8.241 22.870 19.445 1.00 0.00 H ATOM 1060 HG LEU A 74 10.532 23.547 19.159 1.00 0.00 H ATOM 1061 HD21 LEU A 74 9.416 22.100 16.719 1.00 0.00 H ATOM 1062 HD22 LEU A 74 9.017 23.756 17.239 1.00 0.00 H ATOM 1063 HD23 LEU A 74 10.662 23.372 16.676 1.00 0.00 H ATOM 1064 HD11 LEU A 74 11.706 21.457 19.632 1.00 0.00 H ATOM 1065 HD12 LEU A 74 11.039 20.722 18.154 1.00 0.00 H ATOM 1066 HD13 LEU A 74 12.187 22.078 18.034 1.00 0.00 H ATOM 1067 H LEU A 74 7.140 21.437 21.063 1.00 0.00 H ATOM 1068 N PHE A 75 9.037 23.886 22.007 1.00 11.94 N ATOM 1069 CA PHE A 75 9.399 25.069 22.757 1.00 12.45 C ATOM 1070 C PHE A 75 9.994 24.676 24.110 1.00 14.35 C ATOM 1071 O PHE A 75 11.016 25.195 24.567 1.00 14.51 O ATOM 1072 CB PHE A 75 8.210 26.017 23.007 1.00 12.18 C ATOM 1073 CG PHE A 75 8.526 27.280 23.765 1.00 14.22 C ATOM 1074 CD1 PHE A 75 9.121 28.370 23.152 1.00 15.87 C ATOM 1075 CD2 PHE A 75 8.233 27.377 25.125 1.00 17.64 C ATOM 1076 CE1 PHE A 75 9.419 29.528 23.855 1.00 14.53 C ATOM 1077 CE2 PHE A 75 8.541 28.525 25.843 1.00 19.15 C ATOM 1078 CZ PHE A 75 9.119 29.612 25.209 1.00 16.83 C ATOM 1079 HA PHE A 75 10.130 25.600 22.147 1.00 0.00 H ATOM 1080 HB2 PHE A 75 7.800 26.302 22.038 1.00 0.00 H ATOM 1081 HB3 PHE A 75 7.457 25.467 23.572 1.00 0.00 H ATOM 1082 HD2 PHE A 75 7.755 26.539 25.632 1.00 0.00 H ATOM 1083 HE2 PHE A 75 8.327 28.571 26.911 1.00 0.00 H ATOM 1084 HZ PHE A 75 9.336 30.523 25.766 1.00 0.00 H ATOM 1085 HE1 PHE A 75 9.888 30.370 23.346 1.00 0.00 H ATOM 1086 HD1 PHE A 75 9.361 28.317 22.090 1.00 0.00 H ATOM 1087 H PHE A 75 8.053 23.809 21.680 1.00 0.00 H ATOM 1088 N ASP A 76 9.351 23.728 24.786 1.00 13.61 N ATOM 1089 CA ASP A 76 9.827 23.270 26.088 1.00 18.14 C ATOM 1090 C ASP A 76 11.161 22.545 25.991 1.00 20.35 C ATOM 1091 O ASP A 76 11.802 22.429 27.034 1.00 24.32 O ATOM 1092 CB ASP A 76 8.799 22.343 26.742 1.00 19.89 C ATOM 1093 CG ASP A 76 7.666 23.130 27.369 1.00 29.13 C ATOM 1094 OD1 ASP A 76 7.683 24.379 27.418 1.00 31.21 O ATOM 1095 OD2 ASP A 76 6.703 22.493 27.844 1.00 36.25 O ATOM 1096 HA ASP A 76 9.967 24.161 26.701 1.00 0.00 H ATOM 1097 HB2 ASP A 76 8.390 21.675 25.984 1.00 0.00 H ATOM 1098 HB3 ASP A 76 9.293 21.754 27.515 1.00 0.00 H ATOM 1099 H ASP A 76 8.493 23.305 24.379 1.00 0.00 H ATOM 1100 N SER A 77 11.595 22.059 24.855 1.00 17.90 N ATOM 1101 CA SER A 77 12.864 21.366 24.708 1.00 18.07 C ATOM 1102 C SER A 77 13.779 22.073 23.729 1.00 16.93 C ATOM 1103 O SER A 77 14.650 21.425 23.139 1.00 17.73 O ATOM 1104 CB SER A 77 12.603 20.006 24.045 1.00 21.86 C ATOM 1105 OG SER A 77 12.048 19.160 25.018 1.00 34.54 O ATOM 1106 HA SER A 77 13.310 21.307 25.701 1.00 0.00 H ATOM 1107 HB2 SER A 77 13.539 19.586 23.677 1.00 0.00 H ATOM 1108 HB3 SER A 77 11.907 20.124 23.214 1.00 0.00 H ATOM 1109 HG SER A 77 11.201 19.551 25.350 1.00 0.00 H ATOM 1110 H SER A 77 10.998 22.175 24.011 1.00 0.00 H ATOM 1111 N LEU A 78 13.593 23.368 23.568 1.00 13.00 N ATOM 1112 CA LEU A 78 14.380 24.128 22.610 1.00 14.76 C ATOM 1113 C LEU A 78 15.866 24.022 22.916 1.00 19.75 C ATOM 1114 O LEU A 78 16.702 24.148 21.996 1.00 16.73 O ATOM 1115 CB LEU A 78 13.860 25.547 22.604 1.00 16.67 C ATOM 1116 CG LEU A 78 13.763 26.354 21.320 1.00 21.49 C ATOM 1117 CD1 LEU A 78 13.204 25.561 20.153 1.00 19.04 C ATOM 1118 CD2 LEU A 78 12.916 27.610 21.562 1.00 19.22 C ATOM 1119 HA LEU A 78 14.272 23.721 21.605 1.00 0.00 H ATOM 1120 HB2 LEU A 78 12.853 25.507 23.019 1.00 0.00 H ATOM 1121 HB3 LEU A 78 14.505 26.114 23.275 1.00 0.00 H ATOM 1122 HG LEU A 78 14.780 26.633 21.043 1.00 0.00 H ATOM 1123 HD21 LEU A 78 11.916 27.316 21.882 1.00 0.00 H ATOM 1124 HD22 LEU A 78 13.383 28.218 22.337 1.00 0.00 H ATOM 1125 HD23 LEU A 78 12.849 28.185 20.639 1.00 0.00 H ATOM 1126 HD11 LEU A 78 13.849 24.705 19.955 1.00 0.00 H ATOM 1127 HD12 LEU A 78 12.201 25.213 20.399 1.00 0.00 H ATOM 1128 HD13 LEU A 78 13.162 26.198 19.269 1.00 0.00 H ATOM 1129 H LEU A 78 12.871 23.855 24.136 1.00 0.00 H ATOM 1130 N GLU A 79 16.243 23.777 24.169 1.00 16.90 N ATOM 1131 CA GLU A 79 17.666 23.649 24.492 1.00 19.97 C ATOM 1132 C GLU A 79 18.349 22.401 23.945 1.00 18.82 C ATOM 1133 O GLU A 79 19.590 22.323 24.014 1.00 21.74 O ATOM 1134 CB GLU A 79 17.841 23.752 26.004 1.00 23.93 C ATOM 1135 CG GLU A 79 17.352 22.591 26.835 1.00 30.66 C ATOM 1136 CD GLU A 79 15.847 22.474 27.016 1.00 39.82 C ATOM 1137 OE1 GLU A 79 15.048 23.370 26.628 1.00 34.75 O ATOM 1138 OE2 GLU A 79 15.533 21.389 27.585 1.00 41.71 O ATOM 1139 HA GLU A 79 18.171 24.470 23.983 1.00 0.00 H ATOM 1140 HB2 GLU A 79 18.906 23.873 26.204 1.00 0.00 H ATOM 1141 HB3 GLU A 79 17.307 24.642 26.337 1.00 0.00 H ATOM 1142 HG2 GLU A 79 17.701 21.674 26.361 1.00 0.00 H ATOM 1143 HG3 GLU A 79 17.799 22.680 27.825 1.00 0.00 H ATOM 1144 H GLU A 79 15.528 23.677 24.918 1.00 0.00 H ATOM 1145 N GLU A 80 17.671 21.405 23.398 1.00 14.74 N ATOM 1146 CA GLU A 80 18.249 20.212 22.841 1.00 16.29 C ATOM 1147 C GLU A 80 18.273 20.176 21.299 1.00 13.89 C ATOM 1148 O GLU A 80 18.657 19.140 20.740 1.00 14.87 O ATOM 1149 CB GLU A 80 17.354 19.032 23.189 1.00 21.32 C ATOM 1150 CG GLU A 80 17.459 18.536 24.606 1.00 38.47 C ATOM 1151 CD GLU A 80 16.513 17.344 24.752 1.00 47.13 C ATOM 1152 OE1 GLU A 80 16.116 16.730 23.737 1.00 51.19 O ATOM 1153 OE2 GLU A 80 16.172 17.058 25.918 1.00 59.54 O ATOM 1154 HA GLU A 80 19.263 20.180 23.240 1.00 0.00 H ATOM 1155 HB2 GLU A 80 16.321 19.330 23.013 1.00 0.00 H ATOM 1156 HB3 GLU A 80 17.611 18.207 22.524 1.00 0.00 H ATOM 1157 HG2 GLU A 80 18.483 18.226 24.816 1.00 0.00 H ATOM 1158 HG3 GLU A 80 17.170 19.326 25.299 1.00 0.00 H ATOM 1159 H GLU A 80 16.635 21.492 23.369 1.00 0.00 H ATOM 1160 N THR A 81 17.841 21.271 20.680 1.00 11.99 N ATOM 1161 CA THR A 81 17.762 21.312 19.225 1.00 12.68 C ATOM 1162 C THR A 81 19.048 21.662 18.491 1.00 13.45 C ATOM 1163 O THR A 81 19.138 21.309 17.305 1.00 14.87 O ATOM 1164 CB THR A 81 16.658 22.312 18.792 1.00 12.83 C ATOM 1165 OG1 THR A 81 17.028 23.613 19.267 1.00 13.57 O ATOM 1166 CG2 THR A 81 15.269 21.931 19.299 1.00 11.92 C ATOM 1167 HA THR A 81 17.534 20.285 18.938 1.00 0.00 H ATOM 1168 HB THR A 81 16.589 22.297 17.704 1.00 0.00 H ATOM 1169 HG1 THR A 81 17.104 23.593 20.254 1.00 0.00 H ATOM 1170 HG23 THR A 81 15.007 20.940 18.927 1.00 0.00 H ATOM 1171 HG21 THR A 81 15.271 21.923 20.389 1.00 0.00 H ATOM 1172 HG22 THR A 81 14.541 22.659 18.941 1.00 0.00 H ATOM 1173 H THR A 81 17.558 22.102 21.237 1.00 0.00 H ATOM 1174 N GLY A 82 20.028 22.311 19.115 1.00 13.43 N ATOM 1175 CA GLY A 82 21.266 22.684 18.424 1.00 13.53 C ATOM 1176 C GLY A 82 21.177 24.137 17.976 1.00 14.39 C ATOM 1177 O GLY A 82 21.660 24.534 16.905 1.00 17.45 O ATOM 1178 HA3 GLY A 82 21.405 22.043 17.554 1.00 0.00 H ATOM 1179 HA2 GLY A 82 22.111 22.563 19.101 1.00 0.00 H ATOM 1180 H GLY A 82 19.913 22.560 20.118 1.00 0.00 H ATOM 1181 N ALA A 83 20.539 24.961 18.813 1.00 15.26 N ATOM 1182 CA ALA A 83 20.355 26.379 18.517 1.00 17.39 C ATOM 1183 C ALA A 83 21.556 27.293 18.760 1.00 19.59 C ATOM 1184 O ALA A 83 21.582 28.399 18.209 1.00 17.73 O ATOM 1185 CB ALA A 83 19.148 26.946 19.283 1.00 16.82 C ATOM 1186 HA ALA A 83 20.196 26.385 17.439 1.00 0.00 H ATOM 1187 HB1 ALA A 83 18.247 26.406 18.990 1.00 0.00 H ATOM 1188 HB2 ALA A 83 19.312 26.829 20.354 1.00 0.00 H ATOM 1189 HB3 ALA A 83 19.033 28.003 19.045 1.00 0.00 H ATOM 1190 H ALA A 83 20.161 24.580 19.704 1.00 0.00 H ATOM 1191 N GLN A 84 22.550 26.901 19.554 1.00 19.54 N ATOM 1192 CA GLN A 84 23.666 27.807 19.799 1.00 21.82 C ATOM 1193 C GLN A 84 24.375 28.089 18.487 1.00 21.17 C ATOM 1194 O GLN A 84 24.704 27.174 17.739 1.00 23.92 O ATOM 1195 CB GLN A 84 24.642 27.370 20.871 1.00 31.81 C ATOM 1196 CG GLN A 84 25.914 26.638 20.503 1.00 38.93 C ATOM 1197 CD GLN A 84 26.684 26.214 21.754 1.00 45.85 C ATOM 1198 OE1 GLN A 84 26.856 27.047 22.654 1.00 47.68 O ATOM 1199 NE2 GLN A 84 27.097 24.950 21.792 1.00 36.09 N ATOM 1200 HA GLN A 84 23.230 28.719 20.208 1.00 0.00 H ATOM 1201 HB2 GLN A 84 24.944 28.271 21.404 1.00 0.00 H ATOM 1202 HB3 GLN A 84 24.091 26.717 21.547 1.00 0.00 H ATOM 1203 HG2 GLN A 84 25.660 25.751 19.923 1.00 0.00 H ATOM 1204 HG3 GLN A 84 26.543 27.295 19.903 1.00 0.00 H ATOM 1205 HE22 GLN A 84 26.909 24.317 20.988 1.00 0.00 H ATOM 1206 HE21 GLN A 84 27.608 24.595 22.625 1.00 0.00 H ATOM 1207 H GLN A 84 22.531 25.959 19.995 1.00 0.00 H ATOM 1208 N GLY A 85 24.547 29.382 18.224 1.00 20.33 N ATOM 1209 CA GLY A 85 25.206 29.844 17.017 1.00 22.43 C ATOM 1210 C GLY A 85 24.462 29.563 15.713 1.00 24.96 C ATOM 1211 O GLY A 85 25.056 29.708 14.628 1.00 25.38 O ATOM 1212 HA3 GLY A 85 26.180 29.359 16.959 1.00 0.00 H ATOM 1213 HA2 GLY A 85 25.343 30.922 17.100 1.00 0.00 H ATOM 1214 H GLY A 85 24.197 30.085 18.906 1.00 0.00 H ATOM 1215 N ARG A 86 23.196 29.166 15.795 1.00 16.64 N ATOM 1216 CA ARG A 86 22.425 28.874 14.593 1.00 18.07 C ATOM 1217 C ARG A 86 21.757 30.141 14.070 1.00 15.31 C ATOM 1218 O ARG A 86 21.296 30.945 14.892 1.00 14.62 O ATOM 1219 CB ARG A 86 21.388 27.804 15.002 1.00 18.26 C ATOM 1220 CG ARG A 86 20.566 27.254 13.857 1.00 18.33 C ATOM 1221 CD ARG A 86 21.294 26.174 13.069 1.00 12.53 C ATOM 1222 NE ARG A 86 21.732 25.157 14.052 1.00 15.99 N ATOM 1223 CZ ARG A 86 22.530 24.148 13.683 1.00 17.62 C ATOM 1224 NH1 ARG A 86 22.910 24.089 12.402 1.00 14.38 N ATOM 1225 NH2 ARG A 86 22.972 23.243 14.544 1.00 15.88 N ATOM 1226 HA ARG A 86 23.055 28.506 13.783 1.00 0.00 H ATOM 1227 HB2 ARG A 86 21.920 26.975 15.468 1.00 0.00 H ATOM 1228 HB3 ARG A 86 20.707 28.250 15.727 1.00 0.00 H ATOM 1229 HG2 ARG A 86 19.647 26.830 14.261 1.00 0.00 H ATOM 1230 HG3 ARG A 86 20.320 28.073 13.180 1.00 0.00 H ATOM 1231 HD2 ARG A 86 22.157 26.599 12.557 1.00 0.00 H ATOM 1232 HD3 ARG A 86 20.623 25.725 12.337 1.00 0.00 H ATOM 1233 HE ARG A 86 21.416 25.228 15.040 1.00 0.00 H ATOM 1234 HH12 ARG A 86 23.530 23.319 12.078 1.00 0.00 H ATOM 1235 HH11 ARG A 86 22.586 24.813 11.729 1.00 0.00 H ATOM 1236 HH22 ARG A 86 23.591 22.474 14.218 1.00 0.00 H ATOM 1237 HH21 ARG A 86 22.700 23.302 15.546 1.00 0.00 H ATOM 1238 H ARG A 86 22.750 29.062 16.729 1.00 0.00 H ATOM 1239 N LYS A 87 21.684 30.340 12.756 1.00 15.06 N ATOM 1240 CA LYS A 87 21.001 31.502 12.172 1.00 18.86 C ATOM 1241 C LYS A 87 19.490 31.188 12.147 1.00 16.17 C ATOM 1242 O LYS A 87 19.144 30.175 11.531 1.00 13.35 O ATOM 1243 CB LYS A 87 21.435 31.713 10.724 1.00 16.54 C ATOM 1244 CG LYS A 87 22.818 32.328 10.702 1.00 27.44 C ATOM 1245 CD LYS A 87 23.319 32.372 9.270 1.00 42.67 C ATOM 1246 CE LYS A 87 24.838 32.518 9.293 1.00 54.94 C ATOM 1247 NZ LYS A 87 25.265 33.583 10.257 1.00 56.32 N ATOM 1248 HA LYS A 87 21.239 32.389 12.760 1.00 0.00 H ATOM 1249 HB2 LYS A 87 21.454 30.754 10.206 1.00 0.00 H ATOM 1250 HB3 LYS A 87 20.731 32.380 10.226 1.00 0.00 H ATOM 1251 HG2 LYS A 87 22.774 33.340 11.105 1.00 0.00 H ATOM 1252 HG3 LYS A 87 23.495 31.726 11.308 1.00 0.00 H ATOM 1253 HD2 LYS A 87 23.046 31.451 8.756 1.00 0.00 H ATOM 1254 HD3 LYS A 87 22.875 33.222 8.751 1.00 0.00 H ATOM 1255 HE2 LYS A 87 25.185 32.782 8.294 1.00 0.00 H ATOM 1256 HE3 LYS A 87 25.282 31.569 9.592 1.00 0.00 H ATOM 1257 HZ1 LYS A 87 24.848 34.493 9.974 1.00 0.00 H ATOM 1258 HZ2 LYS A 87 24.940 33.334 11.213 1.00 0.00 H ATOM 1259 HZ3 LYS A 87 26.302 33.659 10.251 1.00 0.00 H ATOM 1260 H LYS A 87 22.127 29.647 12.119 1.00 0.00 H ATOM 1261 N VAL A 88 18.668 31.978 12.825 1.00 14.20 N ATOM 1262 CA VAL A 88 17.235 31.712 12.915 1.00 13.65 C ATOM 1263 C VAL A 88 16.381 32.960 12.789 1.00 14.30 C ATOM 1264 O VAL A 88 16.850 34.080 12.985 1.00 15.38 O ATOM 1265 CB VAL A 88 16.880 31.104 14.315 1.00 16.29 C ATOM 1266 CG1 VAL A 88 17.661 29.853 14.718 1.00 15.54 C ATOM 1267 CG2 VAL A 88 17.083 32.124 15.445 1.00 16.80 C ATOM 1268 HA VAL A 88 17.023 31.032 12.090 1.00 0.00 H ATOM 1269 HB VAL A 88 15.835 30.823 14.188 1.00 0.00 H ATOM 1270 HG11 VAL A 88 17.481 29.063 13.989 1.00 0.00 H ATOM 1271 HG12 VAL A 88 18.726 30.085 14.748 1.00 0.00 H ATOM 1272 HG13 VAL A 88 17.332 29.522 15.703 1.00 0.00 H ATOM 1273 HG21 VAL A 88 18.125 32.442 15.463 1.00 0.00 H ATOM 1274 HG22 VAL A 88 16.441 32.988 15.273 1.00 0.00 H ATOM 1275 HG23 VAL A 88 16.826 31.663 16.399 1.00 0.00 H ATOM 1276 H VAL A 88 19.056 32.813 13.308 1.00 0.00 H ATOM 1277 N ALA A 89 15.087 32.835 12.457 1.00 14.98 N ATOM 1278 CA ALA A 89 14.145 33.948 12.366 1.00 17.73 C ATOM 1279 C ALA A 89 12.752 33.351 12.679 1.00 15.30 C ATOM 1280 O ALA A 89 12.567 32.171 12.378 1.00 13.95 O ATOM 1281 CB ALA A 89 14.159 34.730 11.077 1.00 15.47 C ATOM 1282 HA ALA A 89 14.444 34.712 13.083 1.00 0.00 H ATOM 1283 HB1 ALA A 89 15.149 35.160 10.925 1.00 0.00 H ATOM 1284 HB2 ALA A 89 13.920 34.065 10.247 1.00 0.00 H ATOM 1285 HB3 ALA A 89 13.418 35.528 11.130 1.00 0.00 H ATOM 1286 H ALA A 89 14.730 31.880 12.250 1.00 0.00 H ATOM 1287 N CYS A 90 11.848 34.138 13.247 1.00 14.05 N ATOM 1288 CA CYS A 90 10.531 33.648 13.635 1.00 10.99 C ATOM 1289 C CYS A 90 9.396 34.370 12.921 1.00 12.68 C ATOM 1290 O CYS A 90 9.610 35.496 12.466 1.00 11.63 O ATOM 1291 CB CYS A 90 10.358 33.895 15.158 1.00 10.73 C ATOM 1292 SG CYS A 90 11.708 33.133 16.098 1.00 18.84 S ATOM 1293 HA CYS A 90 10.480 32.593 13.367 1.00 0.00 H ATOM 1294 HB2 CYS A 90 9.410 33.466 15.483 1.00 0.00 H ATOM 1295 HB3 CYS A 90 10.353 34.968 15.347 1.00 0.00 H ATOM 1296 HG CYS A 90 11.521 33.372 17.444 1.00 0.00 H ATOM 1297 H CYS A 90 12.086 35.135 13.421 1.00 0.00 H ATOM 1298 N PHE A 91 8.238 33.707 12.864 1.00 10.98 N ATOM 1299 CA PHE A 91 7.069 34.310 12.205 1.00 10.77 C ATOM 1300 C PHE A 91 5.800 33.777 12.884 1.00 13.21 C ATOM 1301 O PHE A 91 5.845 32.794 13.636 1.00 10.39 O ATOM 1302 CB PHE A 91 7.031 33.949 10.717 1.00 10.70 C ATOM 1303 CG PHE A 91 6.966 32.500 10.339 1.00 12.98 C ATOM 1304 CD1 PHE A 91 8.121 31.731 10.279 1.00 11.04 C ATOM 1305 CD2 PHE A 91 5.745 31.886 10.017 1.00 14.19 C ATOM 1306 CE1 PHE A 91 8.055 30.392 9.920 1.00 12.07 C ATOM 1307 CE2 PHE A 91 5.670 30.547 9.650 1.00 11.39 C ATOM 1308 CZ PHE A 91 6.834 29.787 9.615 1.00 15.46 C ATOM 1309 HA PHE A 91 7.131 35.395 12.294 1.00 0.00 H ATOM 1310 HB2 PHE A 91 6.154 34.434 10.289 1.00 0.00 H ATOM 1311 HB3 PHE A 91 7.931 34.362 10.261 1.00 0.00 H ATOM 1312 HD2 PHE A 91 4.829 32.476 10.056 1.00 0.00 H ATOM 1313 HE2 PHE A 91 4.710 30.098 9.393 1.00 0.00 H ATOM 1314 HZ PHE A 91 6.794 28.730 9.352 1.00 0.00 H ATOM 1315 HE1 PHE A 91 8.971 29.803 9.875 1.00 0.00 H ATOM 1316 HD1 PHE A 91 9.085 32.182 10.515 1.00 0.00 H ATOM 1317 H PHE A 91 8.162 32.760 13.287 1.00 0.00 H ATOM 1318 N GLY A 92 4.631 34.374 12.669 1.00 11.51 N ATOM 1319 CA GLY A 92 3.442 33.811 13.338 1.00 10.37 C ATOM 1320 C GLY A 92 2.231 34.653 12.915 1.00 13.54 C ATOM 1321 O GLY A 92 2.397 35.782 12.447 1.00 13.01 O ATOM 1322 HA3 GLY A 92 3.567 33.856 14.420 1.00 0.00 H ATOM 1323 HA2 GLY A 92 3.299 32.774 13.033 1.00 0.00 H ATOM 1324 H GLY A 92 4.557 35.208 12.052 1.00 0.00 H ATOM 1325 N CYS A 93 1.055 34.076 13.057 1.00 9.67 N ATOM 1326 CA CYS A 93 -0.196 34.770 12.745 1.00 11.30 C ATOM 1327 C CYS A 93 -0.916 35.080 14.061 1.00 13.71 C ATOM 1328 O CYS A 93 -0.808 34.363 15.070 1.00 13.35 O ATOM 1329 CB CYS A 93 -1.091 33.887 11.861 1.00 10.19 C ATOM 1330 SG CYS A 93 -0.432 33.681 10.163 1.00 16.52 S ATOM 1331 HA CYS A 93 0.020 35.691 12.204 1.00 0.00 H ATOM 1332 HB2 CYS A 93 -2.079 34.344 11.798 1.00 0.00 H ATOM 1333 HB3 CYS A 93 -1.176 32.904 12.323 1.00 0.00 H ATOM 1334 HG CYS A 93 -1.287 32.880 9.434 1.00 0.00 H ATOM 1335 H CYS A 93 1.014 33.096 13.402 1.00 0.00 H ATOM 1336 N GLY A 94 -1.698 36.157 14.085 1.00 13.64 N ATOM 1337 CA GLY A 94 -2.456 36.550 15.267 1.00 10.96 C ATOM 1338 C GLY A 94 -3.530 37.568 14.895 1.00 12.14 C ATOM 1339 O GLY A 94 -3.949 37.721 13.744 1.00 14.87 O ATOM 1340 HA3 GLY A 94 -1.779 36.992 15.998 1.00 0.00 H ATOM 1341 HA2 GLY A 94 -2.930 35.669 15.700 1.00 0.00 H ATOM 1342 H GLY A 94 -1.771 36.741 13.227 1.00 0.00 H ATOM 1343 N ASP A 95 -3.973 38.315 15.882 1.00 14.52 N ATOM 1344 CA ASP A 95 -5.047 39.311 15.692 1.00 15.55 C ATOM 1345 C ASP A 95 -4.808 40.480 16.632 1.00 14.62 C ATOM 1346 O ASP A 95 -4.671 40.257 17.843 1.00 16.10 O ATOM 1347 CB ASP A 95 -6.331 38.557 16.053 1.00 15.71 C ATOM 1348 CG ASP A 95 -7.595 39.354 15.820 1.00 23.23 C ATOM 1349 OD1 ASP A 95 -7.580 40.586 15.890 1.00 21.55 O ATOM 1350 OD2 ASP A 95 -8.623 38.703 15.552 1.00 29.76 O ATOM 1351 HA ASP A 95 -5.095 39.719 14.682 1.00 0.00 H ATOM 1352 HB2 ASP A 95 -6.379 37.651 15.448 1.00 0.00 H ATOM 1353 HB3 ASP A 95 -6.285 38.286 17.108 1.00 0.00 H ATOM 1354 H ASP A 95 -3.554 38.201 16.827 1.00 0.00 H ATOM 1355 N SER A 96 -4.728 41.678 16.064 1.00 15.90 N ATOM 1356 CA SER A 96 -4.445 42.881 16.835 1.00 19.30 C ATOM 1357 C SER A 96 -5.560 43.330 17.750 1.00 26.74 C ATOM 1358 O SER A 96 -5.358 44.308 18.477 1.00 31.00 O ATOM 1359 CB SER A 96 -4.011 44.065 15.975 1.00 18.90 C ATOM 1360 OG SER A 96 -5.082 44.455 15.121 1.00 25.37 O ATOM 1361 HA SER A 96 -3.611 42.563 17.461 1.00 0.00 H ATOM 1362 HB2 SER A 96 -3.151 43.778 15.370 1.00 0.00 H ATOM 1363 HB3 SER A 96 -3.738 44.901 16.619 1.00 0.00 H ATOM 1364 HG SER A 96 -5.863 44.716 15.671 1.00 0.00 H ATOM 1365 H SER A 96 -4.872 41.760 15.037 1.00 0.00 H ATOM 1366 N SER A 97 -6.696 42.664 17.818 1.00 27.00 N ATOM 1367 CA SER A 97 -7.764 43.004 18.757 1.00 32.15 C ATOM 1368 C SER A 97 -7.440 42.402 20.134 1.00 31.11 C ATOM 1369 O SER A 97 -8.098 42.711 21.133 1.00 31.83 O ATOM 1370 CB SER A 97 -9.111 42.558 18.201 1.00 34.51 C ATOM 1371 OG SER A 97 -9.446 41.226 18.540 1.00 41.65 O ATOM 1372 HA SER A 97 -7.831 44.084 18.888 1.00 0.00 H ATOM 1373 HB2 SER A 97 -9.081 42.641 17.115 1.00 0.00 H ATOM 1374 HB3 SER A 97 -9.883 43.219 18.594 1.00 0.00 H ATOM 1375 HG SER A 97 -8.758 40.612 18.181 1.00 0.00 H ATOM 1376 H SER A 97 -6.839 41.860 17.174 1.00 0.00 H ATOM 1377 N TYR A 98 -6.424 41.533 20.248 1.00 25.13 N ATOM 1378 CA TYR A 98 -5.973 40.892 21.457 1.00 22.33 C ATOM 1379 C TYR A 98 -4.828 41.673 22.091 1.00 31.29 C ATOM 1380 O TYR A 98 -4.059 42.308 21.368 1.00 33.36 O ATOM 1381 CB TYR A 98 -5.409 39.454 21.280 1.00 20.59 C ATOM 1382 CG TYR A 98 -6.582 38.545 21.029 1.00 20.56 C ATOM 1383 CD1 TYR A 98 -7.271 37.956 22.076 1.00 20.74 C ATOM 1384 CD2 TYR A 98 -7.030 38.343 19.720 1.00 24.41 C ATOM 1385 CE1 TYR A 98 -8.377 37.150 21.858 1.00 19.94 C ATOM 1386 CE2 TYR A 98 -8.134 37.536 19.488 1.00 26.08 C ATOM 1387 CZ TYR A 98 -8.800 36.950 20.562 1.00 25.41 C ATOM 1388 OH TYR A 98 -9.893 36.143 20.304 1.00 25.29 O ATOM 1389 HA TYR A 98 -6.878 40.855 22.064 1.00 0.00 H ATOM 1390 HB3 TYR A 98 -4.883 39.145 22.183 1.00 0.00 H ATOM 1391 HB2 TYR A 98 -4.724 39.423 20.433 1.00 0.00 H ATOM 1392 HD2 TYR A 98 -6.514 38.818 18.885 1.00 0.00 H ATOM 1393 HE2 TYR A 98 -8.479 37.361 18.469 1.00 0.00 H ATOM 1394 HE1 TYR A 98 -8.901 36.685 22.693 1.00 0.00 H ATOM 1395 HD1 TYR A 98 -6.935 38.131 23.098 1.00 0.00 H ATOM 1396 HH TYR A 98 -10.587 36.670 19.834 1.00 0.00 H ATOM 1397 H TYR A 98 -5.910 41.298 19.375 1.00 0.00 H ATOM 1398 N GLU A 99 -4.725 41.573 23.411 1.00 41.59 N ATOM 1399 CA GLU A 99 -3.653 42.294 24.102 1.00 50.98 C ATOM 1400 C GLU A 99 -2.260 41.851 23.650 1.00 44.64 C ATOM 1401 O GLU A 99 -1.454 42.729 23.293 1.00 41.08 O ATOM 1402 CB GLU A 99 -3.833 42.197 25.626 1.00 60.26 C ATOM 1403 CG GLU A 99 -2.617 42.671 26.399 1.00 74.78 C ATOM 1404 CD GLU A 99 -2.773 42.960 27.871 1.00 81.26 C ATOM 1405 OE1 GLU A 99 -3.517 42.273 28.605 1.00 85.08 O ATOM 1406 OE2 GLU A 99 -2.093 43.925 28.312 1.00 85.11 O ATOM 1407 HA GLU A 99 -3.730 43.345 23.823 1.00 0.00 H ATOM 1408 HB2 GLU A 99 -4.688 42.808 25.914 1.00 0.00 H ATOM 1409 HB3 GLU A 99 -4.027 41.157 25.887 1.00 0.00 H ATOM 1410 HG2 GLU A 99 -1.851 41.901 26.300 1.00 0.00 H ATOM 1411 HG3 GLU A 99 -2.271 43.589 25.925 1.00 0.00 H ATOM 1412 H GLU A 99 -5.398 40.990 23.948 1.00 0.00 H ATOM 1413 N TYR A 100 -1.992 40.542 23.671 1.00 34.14 N ATOM 1414 CA TYR A 100 -0.678 40.060 23.247 1.00 35.97 C ATOM 1415 C TYR A 100 -0.739 39.732 21.755 1.00 25.19 C ATOM 1416 O TYR A 100 -0.932 38.550 21.438 1.00 25.10 O ATOM 1417 CB TYR A 100 -0.232 38.829 24.046 1.00 49.32 C ATOM 1418 CG TYR A 100 -0.327 39.092 25.529 1.00 62.02 C ATOM 1419 CD1 TYR A 100 0.458 40.068 26.137 1.00 67.78 C ATOM 1420 CD2 TYR A 100 -1.236 38.400 26.323 1.00 69.11 C ATOM 1421 CE1 TYR A 100 0.356 40.328 27.496 1.00 71.82 C ATOM 1422 CE2 TYR A 100 -1.341 38.655 27.684 1.00 72.99 C ATOM 1423 CZ TYR A 100 -0.544 39.621 28.270 1.00 74.29 C ATOM 1424 OH TYR A 100 -0.652 39.875 29.624 1.00 76.90 O ATOM 1425 HA TYR A 100 0.058 40.842 23.435 1.00 0.00 H ATOM 1426 HB3 TYR A 100 0.800 38.591 23.790 1.00 0.00 H ATOM 1427 HB2 TYR A 100 -0.872 37.985 23.790 1.00 0.00 H ATOM 1428 HD2 TYR A 100 -1.877 37.644 25.869 1.00 0.00 H ATOM 1429 HE2 TYR A 100 -2.052 38.094 28.290 1.00 0.00 H ATOM 1430 HE1 TYR A 100 0.986 41.091 27.953 1.00 0.00 H ATOM 1431 HD1 TYR A 100 1.165 40.638 25.535 1.00 0.00 H ATOM 1432 HH TYR A 100 -0.015 40.589 29.876 1.00 0.00 H ATOM 1433 H TYR A 100 -2.717 39.867 23.988 1.00 0.00 H ATOM 1434 N PHE A 101 -0.597 40.760 20.923 1.00 16.49 N ATOM 1435 CA PHE A 101 -0.655 40.542 19.474 1.00 16.86 C ATOM 1436 C PHE A 101 0.569 39.759 19.011 1.00 18.36 C ATOM 1437 O PHE A 101 1.705 40.213 19.159 1.00 17.95 O ATOM 1438 CB PHE A 101 -0.721 41.894 18.809 1.00 16.13 C ATOM 1439 CG PHE A 101 -0.490 41.830 17.330 1.00 16.75 C ATOM 1440 CD1 PHE A 101 -1.329 41.057 16.547 1.00 19.54 C ATOM 1441 CD2 PHE A 101 0.542 42.525 16.737 1.00 14.86 C ATOM 1442 CE1 PHE A 101 -1.156 40.987 15.180 1.00 17.25 C ATOM 1443 CE2 PHE A 101 0.721 42.450 15.371 1.00 20.12 C ATOM 1444 CZ PHE A 101 -0.125 41.693 14.580 1.00 15.50 C ATOM 1445 HA PHE A 101 -1.534 39.956 19.206 1.00 0.00 H ATOM 1446 HB2 PHE A 101 -1.707 42.322 18.989 1.00 0.00 H ATOM 1447 HB3 PHE A 101 0.039 42.537 19.252 1.00 0.00 H ATOM 1448 HD2 PHE A 101 1.214 43.131 17.345 1.00 0.00 H ATOM 1449 HE2 PHE A 101 1.542 42.996 14.907 1.00 0.00 H ATOM 1450 HZ PHE A 101 0.017 41.652 13.500 1.00 0.00 H ATOM 1451 HE1 PHE A 101 -1.828 40.379 14.574 1.00 0.00 H ATOM 1452 HD1 PHE A 101 -2.137 40.496 17.016 1.00 0.00 H ATOM 1453 H PHE A 101 -0.445 41.717 21.300 1.00 0.00 H ATOM 1454 N CYS A 102 0.378 38.549 18.492 1.00 14.96 N ATOM 1455 CA CYS A 102 1.441 37.664 18.039 1.00 14.75 C ATOM 1456 C CYS A 102 2.466 37.444 19.147 1.00 14.27 C ATOM 1457 O CYS A 102 3.675 37.364 18.919 1.00 15.52 O ATOM 1458 CB CYS A 102 2.137 38.161 16.758 1.00 13.55 C ATOM 1459 SG CYS A 102 1.143 37.895 15.275 1.00 15.38 S ATOM 1460 HA CYS A 102 0.966 36.715 17.790 1.00 0.00 H ATOM 1461 HB2 CYS A 102 3.081 37.628 16.645 1.00 0.00 H ATOM 1462 HB3 CYS A 102 2.333 39.228 16.859 1.00 0.00 H ATOM 1463 HG CYS A 102 1.829 38.363 14.173 1.00 0.00 H ATOM 1464 H CYS A 102 -0.602 38.211 18.404 1.00 0.00 H ATOM 1465 N GLY A 103 1.986 37.325 20.382 1.00 14.18 N ATOM 1466 CA GLY A 103 2.832 37.131 21.549 1.00 13.49 C ATOM 1467 C GLY A 103 3.685 35.879 21.457 1.00 16.64 C ATOM 1468 O GLY A 103 4.789 35.821 22.042 1.00 18.12 O ATOM 1469 HA3 GLY A 103 2.196 37.055 22.431 1.00 0.00 H ATOM 1470 HA2 GLY A 103 3.490 37.994 21.650 1.00 0.00 H ATOM 1471 H GLY A 103 0.956 37.373 20.520 1.00 0.00 H ATOM 1472 N ALA A 104 3.265 34.836 20.752 1.00 15.23 N ATOM 1473 CA ALA A 104 4.096 33.624 20.627 1.00 13.42 C ATOM 1474 C ALA A 104 5.413 33.950 19.912 1.00 13.80 C ATOM 1475 O ALA A 104 6.454 33.342 20.216 1.00 13.30 O ATOM 1476 CB ALA A 104 3.277 32.532 19.950 1.00 13.15 C ATOM 1477 HA ALA A 104 4.384 33.247 21.608 1.00 0.00 H ATOM 1478 HB1 ALA A 104 2.395 32.314 20.553 1.00 0.00 H ATOM 1479 HB2 ALA A 104 2.968 32.871 18.961 1.00 0.00 H ATOM 1480 HB3 ALA A 104 3.884 31.632 19.853 1.00 0.00 H ATOM 1481 H ALA A 104 2.338 34.874 20.282 1.00 0.00 H ATOM 1482 N VAL A 105 5.451 34.895 18.973 1.00 14.13 N ATOM 1483 CA VAL A 105 6.649 35.272 18.232 1.00 15.87 C ATOM 1484 C VAL A 105 7.668 35.840 19.211 1.00 16.67 C ATOM 1485 O VAL A 105 8.843 35.475 19.180 1.00 16.92 O ATOM 1486 CB VAL A 105 6.391 36.244 17.059 1.00 18.58 C ATOM 1487 CG1 VAL A 105 7.686 36.614 16.352 1.00 18.55 C ATOM 1488 CG2 VAL A 105 5.375 35.611 16.105 1.00 14.98 C ATOM 1489 HA VAL A 105 7.036 34.371 17.757 1.00 0.00 H ATOM 1490 HB VAL A 105 5.977 37.177 17.443 1.00 0.00 H ATOM 1491 HG11 VAL A 105 8.360 37.096 17.060 1.00 0.00 H ATOM 1492 HG12 VAL A 105 8.154 35.712 15.959 1.00 0.00 H ATOM 1493 HG13 VAL A 105 7.468 37.299 15.532 1.00 0.00 H ATOM 1494 HG21 VAL A 105 5.773 34.670 15.724 1.00 0.00 H ATOM 1495 HG22 VAL A 105 4.444 35.423 16.640 1.00 0.00 H ATOM 1496 HG23 VAL A 105 5.187 36.290 15.274 1.00 0.00 H ATOM 1497 H VAL A 105 4.567 35.397 18.754 1.00 0.00 H ATOM 1498 N ASP A 106 7.232 36.720 20.109 1.00 16.21 N ATOM 1499 CA ASP A 106 8.119 37.304 21.120 1.00 19.28 C ATOM 1500 C ASP A 106 8.721 36.260 22.074 1.00 14.69 C ATOM 1501 O ASP A 106 9.914 36.324 22.404 1.00 14.93 O ATOM 1502 CB ASP A 106 7.337 38.312 21.976 1.00 21.28 C ATOM 1503 CG ASP A 106 6.877 39.550 21.238 1.00 28.63 C ATOM 1504 OD1 ASP A 106 7.665 40.208 20.527 1.00 41.53 O ATOM 1505 OD2 ASP A 106 5.694 39.907 21.381 1.00 35.71 O ATOM 1506 HA ASP A 106 8.932 37.778 20.570 1.00 0.00 H ATOM 1507 HB2 ASP A 106 6.457 37.808 22.374 1.00 0.00 H ATOM 1508 HB3 ASP A 106 7.978 38.627 22.800 1.00 0.00 H ATOM 1509 H ASP A 106 6.231 37.002 20.093 1.00 0.00 H ATOM 1510 N ALA A 107 7.907 35.298 22.509 1.00 12.95 N ATOM 1511 CA ALA A 107 8.322 34.244 23.430 1.00 15.80 C ATOM 1512 C ALA A 107 9.409 33.363 22.832 1.00 15.89 C ATOM 1513 O ALA A 107 10.392 33.003 23.478 1.00 15.00 O ATOM 1514 CB ALA A 107 7.123 33.389 23.851 1.00 12.18 C ATOM 1515 HA ALA A 107 8.737 34.733 24.311 1.00 0.00 H ATOM 1516 HB1 ALA A 107 6.385 34.020 24.346 1.00 0.00 H ATOM 1517 HB2 ALA A 107 6.677 32.931 22.968 1.00 0.00 H ATOM 1518 HB3 ALA A 107 7.457 32.610 24.537 1.00 0.00 H ATOM 1519 H ALA A 107 6.922 35.298 22.174 1.00 0.00 H ATOM 1520 N ILE A 108 9.225 32.999 21.566 1.00 12.21 N ATOM 1521 CA ILE A 108 10.177 32.158 20.838 1.00 12.35 C ATOM 1522 C ILE A 108 11.464 32.926 20.587 1.00 11.44 C ATOM 1523 O ILE A 108 12.553 32.382 20.811 1.00 15.01 O ATOM 1524 CB ILE A 108 9.547 31.636 19.527 1.00 12.40 C ATOM 1525 CG1 ILE A 108 8.318 30.765 19.823 1.00 12.76 C ATOM 1526 CG2 ILE A 108 10.577 30.825 18.746 1.00 11.35 C ATOM 1527 CD1 ILE A 108 7.443 30.555 18.573 1.00 13.76 C ATOM 1528 HA ILE A 108 10.425 31.287 21.444 1.00 0.00 H ATOM 1529 HB ILE A 108 9.230 32.492 18.932 1.00 0.00 H ATOM 1530 HG12 ILE A 108 8.654 29.793 20.185 1.00 0.00 H ATOM 1531 HG13 ILE A 108 7.720 31.251 20.594 1.00 0.00 H ATOM 1532 HD11 ILE A 108 7.095 31.521 18.208 1.00 0.00 H ATOM 1533 HD12 ILE A 108 8.031 30.062 17.798 1.00 0.00 H ATOM 1534 HD13 ILE A 108 6.586 29.933 18.831 1.00 0.00 H ATOM 1535 HG21 ILE A 108 11.432 31.458 18.509 1.00 0.00 H ATOM 1536 HG22 ILE A 108 10.906 29.980 19.350 1.00 0.00 H ATOM 1537 HG23 ILE A 108 10.126 30.460 17.823 1.00 0.00 H ATOM 1538 H ILE A 108 8.369 33.325 21.073 1.00 0.00 H ATOM 1539 N GLU A 109 11.421 34.184 20.167 1.00 13.60 N ATOM 1540 CA GLU A 109 12.639 34.965 19.924 1.00 16.11 C ATOM 1541 C GLU A 109 13.472 35.116 21.196 1.00 17.05 C ATOM 1542 O GLU A 109 14.687 34.940 21.190 1.00 17.95 O ATOM 1543 CB GLU A 109 12.280 36.353 19.386 1.00 16.08 C ATOM 1544 CG GLU A 109 12.001 36.323 17.886 1.00 18.41 C ATOM 1545 CD GLU A 109 11.750 37.706 17.333 1.00 25.19 C ATOM 1546 OE1 GLU A 109 11.695 38.696 18.092 1.00 29.44 O ATOM 1547 OE2 GLU A 109 11.580 37.805 16.104 1.00 22.74 O ATOM 1548 HA GLU A 109 13.232 34.425 19.186 1.00 0.00 H ATOM 1549 HB2 GLU A 109 11.391 36.714 19.904 1.00 0.00 H ATOM 1550 HB3 GLU A 109 13.111 37.032 19.577 1.00 0.00 H ATOM 1551 HG2 GLU A 109 12.861 35.890 17.376 1.00 0.00 H ATOM 1552 HG3 GLU A 109 11.122 35.705 17.703 1.00 0.00 H ATOM 1553 H GLU A 109 10.496 34.630 20.005 1.00 0.00 H ATOM 1554 N GLU A 110 12.778 35.426 22.284 1.00 15.54 N ATOM 1555 CA GLU A 110 13.439 35.593 23.570 1.00 21.94 C ATOM 1556 C GLU A 110 14.119 34.311 24.029 1.00 21.41 C ATOM 1557 O GLU A 110 15.276 34.413 24.467 1.00 21.34 O ATOM 1558 CB GLU A 110 12.411 36.086 24.590 1.00 31.75 C ATOM 1559 CG GLU A 110 13.003 36.816 25.781 1.00 55.17 C ATOM 1560 CD GLU A 110 12.503 36.293 27.116 1.00 67.31 C ATOM 1561 OE1 GLU A 110 12.127 35.103 27.255 1.00 77.72 O ATOM 1562 OE2 GLU A 110 12.498 37.070 28.097 1.00 74.47 O ATOM 1563 HA GLU A 110 14.232 36.334 23.471 1.00 0.00 H ATOM 1564 HB2 GLU A 110 11.725 36.764 24.082 1.00 0.00 H ATOM 1565 HB3 GLU A 110 11.858 35.223 24.960 1.00 0.00 H ATOM 1566 HG2 GLU A 110 14.087 36.706 25.750 1.00 0.00 H ATOM 1567 HG3 GLU A 110 12.744 37.872 25.704 1.00 0.00 H ATOM 1568 H GLU A 110 11.748 35.551 22.217 1.00 0.00 H ATOM 1569 N LYS A 111 13.489 33.140 23.975 1.00 15.88 N ATOM 1570 CA LYS A 111 14.148 31.904 24.392 1.00 15.07 C ATOM 1571 C LYS A 111 15.299 31.539 23.463 1.00 20.79 C ATOM 1572 O LYS A 111 16.370 31.130 23.967 1.00 18.43 O ATOM 1573 CB LYS A 111 13.122 30.791 24.602 1.00 13.58 C ATOM 1574 CG LYS A 111 13.715 29.472 25.071 1.00 13.78 C ATOM 1575 CD LYS A 111 12.658 28.537 25.647 1.00 15.60 C ATOM 1576 CE LYS A 111 13.281 27.312 26.301 1.00 17.48 C ATOM 1577 NZ LYS A 111 12.236 26.422 26.902 1.00 17.96 N ATOM 1578 HA LYS A 111 14.618 32.061 25.363 1.00 0.00 H ATOM 1579 HB2 LYS A 111 12.402 31.127 25.349 1.00 0.00 H ATOM 1580 HB3 LYS A 111 12.608 30.617 23.656 1.00 0.00 H ATOM 1581 HG2 LYS A 111 14.194 28.981 24.224 1.00 0.00 H ATOM 1582 HG3 LYS A 111 14.460 29.676 25.840 1.00 0.00 H ATOM 1583 HD2 LYS A 111 12.077 29.078 26.394 1.00 0.00 H ATOM 1584 HD3 LYS A 111 11.999 28.211 24.842 1.00 0.00 H ATOM 1585 HE2 LYS A 111 13.964 27.637 27.086 1.00 0.00 H ATOM 1586 HE3 LYS A 111 13.835 26.751 25.548 1.00 0.00 H ATOM 1587 HZ1 LYS A 111 11.707 26.950 27.625 1.00 0.00 H ATOM 1588 HZ2 LYS A 111 11.584 26.103 26.157 1.00 0.00 H ATOM 1589 HZ3 LYS A 111 12.695 25.597 27.339 1.00 0.00 H ATOM 1590 H LYS A 111 12.509 33.104 23.629 1.00 0.00 H ATOM 1591 N LEU A 112 15.197 31.688 22.142 1.00 14.54 N ATOM 1592 CA LEU A 112 16.284 31.400 21.210 1.00 17.06 C ATOM 1593 C LEU A 112 17.510 32.276 21.529 1.00 16.87 C ATOM 1594 O LEU A 112 18.668 31.840 21.470 1.00 15.51 O ATOM 1595 CB LEU A 112 15.794 31.697 19.799 1.00 20.17 C ATOM 1596 CG LEU A 112 15.406 30.661 18.762 1.00 22.77 C ATOM 1597 CD1 LEU A 112 15.545 29.218 19.167 1.00 20.22 C ATOM 1598 CD2 LEU A 112 14.081 30.987 18.134 1.00 17.94 C ATOM 1599 HA LEU A 112 16.578 30.354 21.298 1.00 0.00 H ATOM 1600 HB2 LEU A 112 14.910 32.321 19.927 1.00 0.00 H ATOM 1601 HB3 LEU A 112 16.588 32.284 19.336 1.00 0.00 H ATOM 1602 HG LEU A 112 16.174 30.745 17.993 1.00 0.00 H ATOM 1603 HD21 LEU A 112 13.311 31.012 18.905 1.00 0.00 H ATOM 1604 HD22 LEU A 112 14.141 31.960 17.647 1.00 0.00 H ATOM 1605 HD23 LEU A 112 13.833 30.225 17.396 1.00 0.00 H ATOM 1606 HD11 LEU A 112 16.585 29.011 19.420 1.00 0.00 H ATOM 1607 HD12 LEU A 112 14.914 29.023 20.034 1.00 0.00 H ATOM 1608 HD13 LEU A 112 15.237 28.579 18.340 1.00 0.00 H ATOM 1609 H LEU A 112 14.294 32.028 21.754 1.00 0.00 H ATOM 1610 N LYS A 113 17.256 33.550 21.857 1.00 17.44 N ATOM 1611 CA LYS A 113 18.271 34.519 22.252 1.00 20.39 C ATOM 1612 C LYS A 113 18.943 34.027 23.558 1.00 23.52 C ATOM 1613 O LYS A 113 20.183 34.071 23.581 1.00 23.44 O ATOM 1614 CB LYS A 113 17.796 35.916 22.575 1.00 19.97 C ATOM 1615 CG LYS A 113 17.650 36.931 21.470 1.00 39.53 C ATOM 1616 CD LYS A 113 16.770 38.086 21.951 1.00 50.88 C ATOM 1617 CE LYS A 113 15.903 38.693 20.857 1.00 54.82 C ATOM 1618 NZ LYS A 113 14.605 39.205 21.402 1.00 60.85 N ATOM 1619 HA LYS A 113 18.915 34.583 21.375 1.00 0.00 H ATOM 1620 HB2 LYS A 113 16.817 35.816 23.044 1.00 0.00 H ATOM 1621 HB3 LYS A 113 18.502 36.331 23.294 1.00 0.00 H ATOM 1622 HG2 LYS A 113 18.633 37.313 21.195 1.00 0.00 H ATOM 1623 HG3 LYS A 113 17.189 36.460 20.602 1.00 0.00 H ATOM 1624 HD2 LYS A 113 16.117 37.715 22.741 1.00 0.00 H ATOM 1625 HD3 LYS A 113 17.416 38.867 22.351 1.00 0.00 H ATOM 1626 HE2 LYS A 113 15.696 37.931 20.106 1.00 0.00 H ATOM 1627 HE3 LYS A 113 16.443 39.519 20.395 1.00 0.00 H ATOM 1628 HZ1 LYS A 113 14.081 38.421 21.840 1.00 0.00 H ATOM 1629 HZ2 LYS A 113 14.795 39.938 22.115 1.00 0.00 H ATOM 1630 HZ3 LYS A 113 14.041 39.611 20.628 1.00 0.00 H ATOM 1631 H LYS A 113 16.267 33.870 21.828 1.00 0.00 H ATOM 1632 N ASN A 114 18.208 33.556 24.565 1.00 21.64 N ATOM 1633 CA ASN A 114 18.762 33.035 25.808 1.00 24.52 C ATOM 1634 C ASN A 114 19.604 31.764 25.616 1.00 27.49 C ATOM 1635 O ASN A 114 20.464 31.442 26.440 1.00 27.67 O ATOM 1636 CB ASN A 114 17.711 32.708 26.888 1.00 24.06 C ATOM 1637 CG ASN A 114 17.046 33.918 27.520 1.00 30.99 C ATOM 1638 OD1 ASN A 114 17.574 35.036 27.562 1.00 34.51 O ATOM 1639 ND2 ASN A 114 15.825 33.763 28.033 1.00 30.89 N ATOM 1640 HA ASN A 114 19.386 33.863 26.145 1.00 0.00 H ATOM 1641 HB2 ASN A 114 16.935 32.095 26.431 1.00 0.00 H ATOM 1642 HB3 ASN A 114 18.202 32.140 27.678 1.00 0.00 H ATOM 1643 HD22 ASN A 114 15.365 32.831 28.007 1.00 0.00 H ATOM 1644 HD21 ASN A 114 15.333 34.574 28.459 1.00 0.00 H ATOM 1645 H ASN A 114 17.174 33.561 24.457 1.00 0.00 H ATOM 1646 N LEU A 115 19.409 31.001 24.551 1.00 23.00 N ATOM 1647 CA LEU A 115 20.106 29.786 24.204 1.00 19.28 C ATOM 1648 C LEU A 115 21.279 30.026 23.268 1.00 22.61 C ATOM 1649 O LEU A 115 21.954 29.075 22.849 1.00 26.66 O ATOM 1650 CB LEU A 115 19.127 28.774 23.556 1.00 19.22 C ATOM 1651 CG LEU A 115 18.009 28.339 24.512 1.00 20.83 C ATOM 1652 CD1 LEU A 115 17.105 27.305 23.892 1.00 22.58 C ATOM 1653 CD2 LEU A 115 18.540 27.782 25.820 1.00 25.23 C ATOM 1654 HA LEU A 115 20.507 29.380 25.133 1.00 0.00 H ATOM 1655 HB2 LEU A 115 18.676 29.237 22.679 1.00 0.00 H ATOM 1656 HB3 LEU A 115 19.689 27.891 23.251 1.00 0.00 H ATOM 1657 HG LEU A 115 17.443 29.248 24.716 1.00 0.00 H ATOM 1658 HD21 LEU A 115 19.163 26.911 25.616 1.00 0.00 H ATOM 1659 HD22 LEU A 115 19.133 28.545 26.324 1.00 0.00 H ATOM 1660 HD23 LEU A 115 17.704 27.491 26.456 1.00 0.00 H ATOM 1661 HD11 LEU A 115 16.644 27.718 22.995 1.00 0.00 H ATOM 1662 HD12 LEU A 115 17.690 26.424 23.629 1.00 0.00 H ATOM 1663 HD13 LEU A 115 16.329 27.028 24.606 1.00 0.00 H ATOM 1664 H LEU A 115 18.669 31.313 23.890 1.00 0.00 H ATOM 1665 N GLY A 116 21.552 31.274 22.893 1.00 21.19 N ATOM 1666 CA GLY A 116 22.661 31.600 22.021 1.00 21.72 C ATOM 1667 C GLY A 116 22.466 31.565 20.528 1.00 21.60 C ATOM 1668 O GLY A 116 23.449 31.507 19.794 1.00 20.21 O ATOM 1669 HA3 GLY A 116 23.463 30.899 22.253 1.00 0.00 H ATOM 1670 HA2 GLY A 116 22.978 32.611 22.276 1.00 0.00 H ATOM 1671 H GLY A 116 20.945 32.044 23.240 1.00 0.00 H ATOM 1672 N ALA A 117 21.242 31.593 20.010 1.00 19.33 N ATOM 1673 CA ALA A 117 20.988 31.580 18.576 1.00 16.18 C ATOM 1674 C ALA A 117 21.227 32.975 18.018 1.00 17.82 C ATOM 1675 O ALA A 117 21.216 33.970 18.751 1.00 19.61 O ATOM 1676 CB ALA A 117 19.526 31.187 18.273 1.00 14.29 C ATOM 1677 HA ALA A 117 21.656 30.851 18.118 1.00 0.00 H ATOM 1678 HB1 ALA A 117 19.329 30.192 18.671 1.00 0.00 H ATOM 1679 HB2 ALA A 117 18.853 31.907 18.740 1.00 0.00 H ATOM 1680 HB3 ALA A 117 19.367 31.186 17.195 1.00 0.00 H ATOM 1681 H ALA A 117 20.429 31.626 20.658 1.00 0.00 H ATOM 1682 N GLU A 118 21.419 33.086 16.721 1.00 16.87 N ATOM 1683 CA GLU A 118 21.602 34.369 16.075 1.00 17.42 C ATOM 1684 C GLU A 118 20.325 34.724 15.301 1.00 17.99 C ATOM 1685 O GLU A 118 20.099 34.127 14.248 1.00 17.87 O ATOM 1686 CB GLU A 118 22.773 34.271 15.093 1.00 23.19 C ATOM 1687 CG GLU A 118 23.155 35.676 14.641 1.00 37.37 C ATOM 1688 CD GLU A 118 24.176 35.626 13.523 1.00 47.22 C ATOM 1689 OE1 GLU A 118 24.894 34.603 13.445 1.00 51.14 O ATOM 1690 OE2 GLU A 118 24.231 36.598 12.738 1.00 52.44 O ATOM 1691 HA GLU A 118 21.809 35.136 16.821 1.00 0.00 H ATOM 1692 HB2 GLU A 118 23.624 33.800 15.584 1.00 0.00 H ATOM 1693 HB3 GLU A 118 22.478 33.676 14.229 1.00 0.00 H ATOM 1694 HG2 GLU A 118 22.263 36.192 14.287 1.00 0.00 H ATOM 1695 HG3 GLU A 118 23.577 36.221 15.486 1.00 0.00 H ATOM 1696 H GLU A 118 21.440 32.223 16.140 1.00 0.00 H ATOM 1697 N ILE A 119 19.555 35.665 15.839 1.00 18.44 N ATOM 1698 CA ILE A 119 18.304 36.126 15.218 1.00 18.37 C ATOM 1699 C ILE A 119 18.724 37.038 14.068 1.00 22.26 C ATOM 1700 O ILE A 119 19.262 38.143 14.211 1.00 29.14 O ATOM 1701 CB ILE A 119 17.404 36.831 16.242 1.00 22.58 C ATOM 1702 CG1 ILE A 119 17.137 35.980 17.489 1.00 24.61 C ATOM 1703 CG2 ILE A 119 16.081 37.313 15.665 1.00 20.50 C ATOM 1704 CD1 ILE A 119 16.357 34.716 17.270 1.00 34.97 C ATOM 1705 HA ILE A 119 17.703 35.298 14.843 1.00 0.00 H ATOM 1706 HB ILE A 119 17.979 37.709 16.535 1.00 0.00 H ATOM 1707 HG12 ILE A 119 18.101 35.707 17.919 1.00 0.00 H ATOM 1708 HG13 ILE A 119 16.584 36.594 18.200 1.00 0.00 H ATOM 1709 HD11 ILE A 119 15.379 34.961 16.856 1.00 0.00 H ATOM 1710 HD12 ILE A 119 16.897 34.073 16.575 1.00 0.00 H ATOM 1711 HD13 ILE A 119 16.231 34.199 18.221 1.00 0.00 H ATOM 1712 HG21 ILE A 119 16.274 38.022 14.860 1.00 0.00 H ATOM 1713 HG22 ILE A 119 15.524 36.461 15.275 1.00 0.00 H ATOM 1714 HG23 ILE A 119 15.501 37.800 16.448 1.00 0.00 H ATOM 1715 H ILE A 119 19.850 36.094 16.739 1.00 0.00 H ATOM 1716 N VAL A 120 18.523 36.590 12.850 1.00 18.78 N ATOM 1717 CA VAL A 120 18.899 37.268 11.607 1.00 23.83 C ATOM 1718 C VAL A 120 18.066 38.445 11.157 1.00 28.59 C ATOM 1719 O VAL A 120 18.504 39.369 10.448 1.00 26.60 O ATOM 1720 CB VAL A 120 18.892 36.058 10.628 1.00 25.04 C ATOM 1721 CG1 VAL A 120 18.285 36.321 9.287 1.00 32.19 C ATOM 1722 CG2 VAL A 120 20.321 35.535 10.578 1.00 27.12 C ATOM 1723 HA VAL A 120 19.844 37.804 11.698 1.00 0.00 H ATOM 1724 HB VAL A 120 18.216 35.291 11.006 1.00 0.00 H ATOM 1725 HG11 VAL A 120 17.245 36.622 9.413 1.00 0.00 H ATOM 1726 HG12 VAL A 120 18.838 37.118 8.789 1.00 0.00 H ATOM 1727 HG13 VAL A 120 18.331 35.414 8.684 1.00 0.00 H ATOM 1728 HG21 VAL A 120 20.983 36.323 10.219 1.00 0.00 H ATOM 1729 HG22 VAL A 120 20.629 35.227 11.577 1.00 0.00 H ATOM 1730 HG23 VAL A 120 20.371 34.682 9.902 1.00 0.00 H ATOM 1731 H VAL A 120 18.053 35.667 12.759 1.00 0.00 H ATOM 1732 N GLN A 121 16.799 38.473 11.568 1.00 22.98 N ATOM 1733 CA GLN A 121 15.822 39.480 11.196 1.00 22.72 C ATOM 1734 C GLN A 121 14.719 39.582 12.232 1.00 21.89 C ATOM 1735 O GLN A 121 14.439 38.556 12.856 1.00 20.16 O ATOM 1736 CB GLN A 121 15.212 38.869 9.907 1.00 29.25 C ATOM 1737 CG GLN A 121 14.433 39.678 8.918 1.00 37.26 C ATOM 1738 CD GLN A 121 15.165 40.897 8.383 1.00 43.44 C ATOM 1739 OE1 GLN A 121 16.284 40.867 7.871 1.00 48.86 O ATOM 1740 NE2 GLN A 121 14.509 42.049 8.519 1.00 43.72 N ATOM 1741 HA GLN A 121 16.258 40.474 11.090 1.00 0.00 H ATOM 1742 HB2 GLN A 121 16.046 38.437 9.354 1.00 0.00 H ATOM 1743 HB3 GLN A 121 14.545 38.072 10.237 1.00 0.00 H ATOM 1744 HG2 GLN A 121 14.181 39.035 8.075 1.00 0.00 H ATOM 1745 HG3 GLN A 121 13.516 40.016 9.401 1.00 0.00 H ATOM 1746 HE22 GLN A 121 13.564 42.061 8.953 1.00 0.00 H ATOM 1747 HE21 GLN A 121 14.942 42.936 8.191 1.00 0.00 H ATOM 1748 H GLN A 121 16.485 37.714 12.206 1.00 0.00 H ATOM 1749 N ASP A 122 14.072 40.714 12.441 1.00 22.26 N ATOM 1750 CA ASP A 122 12.961 40.810 13.379 1.00 26.30 C ATOM 1751 C ASP A 122 11.813 39.922 12.852 1.00 21.69 C ATOM 1752 O ASP A 122 11.628 39.827 11.630 1.00 21.04 O ATOM 1753 CB ASP A 122 12.415 42.226 13.507 1.00 38.83 C ATOM 1754 CG ASP A 122 13.106 43.101 14.535 1.00 52.61 C ATOM 1755 OD1 ASP A 122 13.989 42.634 15.297 1.00 56.58 O ATOM 1756 OD2 ASP A 122 12.742 44.307 14.583 1.00 61.67 O ATOM 1757 HA ASP A 122 13.329 40.497 14.356 1.00 0.00 H ATOM 1758 HB2 ASP A 122 12.508 42.711 12.535 1.00 0.00 H ATOM 1759 HB3 ASP A 122 11.361 42.157 13.778 1.00 0.00 H ATOM 1760 H ASP A 122 14.365 41.565 11.919 1.00 0.00 H ATOM 1761 N GLY A 123 11.060 39.323 13.773 1.00 16.24 N ATOM 1762 CA GLY A 123 9.980 38.437 13.426 1.00 13.56 C ATOM 1763 C GLY A 123 8.872 39.017 12.570 1.00 14.22 C ATOM 1764 O GLY A 123 8.577 40.220 12.623 1.00 19.75 O ATOM 1765 HA3 GLY A 123 9.530 38.084 14.354 1.00 0.00 H ATOM 1766 HA2 GLY A 123 10.407 37.591 12.886 1.00 0.00 H ATOM 1767 H GLY A 123 11.259 39.502 14.778 1.00 0.00 H ATOM 1768 N LEU A 124 8.264 38.156 11.767 1.00 11.65 N ATOM 1769 CA LEU A 124 7.134 38.562 10.914 1.00 12.82 C ATOM 1770 C LEU A 124 5.865 38.313 11.728 1.00 15.94 C ATOM 1771 O LEU A 124 5.571 37.209 12.192 1.00 14.17 O ATOM 1772 CB LEU A 124 7.136 37.707 9.659 1.00 12.05 C ATOM 1773 CG LEU A 124 5.949 37.880 8.721 1.00 14.94 C ATOM 1774 CD1 LEU A 124 5.895 39.322 8.238 1.00 19.09 C ATOM 1775 CD2 LEU A 124 6.023 36.900 7.563 1.00 18.77 C ATOM 1776 HA LEU A 124 7.199 39.608 10.616 1.00 0.00 H ATOM 1777 HB2 LEU A 124 8.040 37.943 9.098 1.00 0.00 H ATOM 1778 HB3 LEU A 124 7.165 36.662 9.969 1.00 0.00 H ATOM 1779 HG LEU A 124 5.027 37.661 9.260 1.00 0.00 H ATOM 1780 HD21 LEU A 124 6.941 37.072 7.001 1.00 0.00 H ATOM 1781 HD22 LEU A 124 6.018 35.881 7.950 1.00 0.00 H ATOM 1782 HD23 LEU A 124 5.163 37.046 6.909 1.00 0.00 H ATOM 1783 HD11 LEU A 124 5.784 39.987 9.095 1.00 0.00 H ATOM 1784 HD12 LEU A 124 6.817 39.561 7.708 1.00 0.00 H ATOM 1785 HD13 LEU A 124 5.046 39.447 7.566 1.00 0.00 H ATOM 1786 H LEU A 124 8.593 37.170 11.738 1.00 0.00 H ATOM 1787 N ARG A 125 5.065 39.331 11.966 1.00 15.69 N ATOM 1788 CA ARG A 125 3.822 39.279 12.730 1.00 15.36 C ATOM 1789 C ARG A 125 2.661 39.617 11.789 1.00 18.12 C ATOM 1790 O ARG A 125 2.531 40.750 11.299 1.00 19.94 O ATOM 1791 CB ARG A 125 3.877 40.214 13.935 1.00 16.19 C ATOM 1792 CG ARG A 125 4.995 39.934 14.936 1.00 19.08 C ATOM 1793 CD ARG A 125 5.140 41.015 16.003 1.00 23.50 C ATOM 1794 NE ARG A 125 6.148 40.655 16.994 1.00 23.60 N ATOM 1795 CZ ARG A 125 7.464 40.630 16.853 1.00 36.23 C ATOM 1796 NH1 ARG A 125 8.052 40.969 15.709 1.00 38.30 N ATOM 1797 NH2 ARG A 125 8.277 40.250 17.840 1.00 32.39 N ATOM 1798 HA ARG A 125 3.672 38.277 13.131 1.00 0.00 H ATOM 1799 HB2 ARG A 125 4.005 41.231 13.565 1.00 0.00 H ATOM 1800 HB3 ARG A 125 2.927 40.137 14.463 1.00 0.00 H ATOM 1801 HG2 ARG A 125 4.786 38.986 15.431 1.00 0.00 H ATOM 1802 HG3 ARG A 125 5.936 39.858 14.391 1.00 0.00 H ATOM 1803 HD2 ARG A 125 4.182 41.149 16.505 1.00 0.00 H ATOM 1804 HD3 ARG A 125 5.432 41.950 15.524 1.00 0.00 H ATOM 1805 HE ARG A 125 5.787 40.383 17.931 1.00 0.00 H ATOM 1806 HH12 ARG A 125 9.088 40.939 15.628 1.00 0.00 H ATOM 1807 HH11 ARG A 125 7.475 41.264 14.895 1.00 0.00 H ATOM 1808 HH22 ARG A 125 9.306 40.243 17.692 1.00 0.00 H ATOM 1809 HH21 ARG A 125 7.881 39.961 18.757 1.00 0.00 H ATOM 1810 H ARG A 125 5.343 40.254 11.575 1.00 0.00 H ATOM 1811 N ILE A 126 1.811 38.645 11.491 1.00 14.06 N ATOM 1812 CA ILE A 126 0.690 38.839 10.581 1.00 14.91 C ATOM 1813 C ILE A 126 -0.644 39.053 11.288 1.00 16.06 C ATOM 1814 O ILE A 126 -0.992 38.290 12.174 1.00 15.27 O ATOM 1815 CB ILE A 126 0.580 37.634 9.615 1.00 17.94 C ATOM 1816 CG1 ILE A 126 1.847 37.554 8.758 1.00 20.18 C ATOM 1817 CG2 ILE A 126 -0.639 37.781 8.705 1.00 16.27 C ATOM 1818 CD1 ILE A 126 1.954 36.281 7.960 1.00 27.75 C ATOM 1819 HA ILE A 126 0.900 39.755 10.029 1.00 0.00 H ATOM 1820 HB ILE A 126 0.469 36.723 10.203 1.00 0.00 H ATOM 1821 HG12 ILE A 126 1.850 38.396 8.066 1.00 0.00 H ATOM 1822 HG13 ILE A 126 2.714 37.623 9.416 1.00 0.00 H ATOM 1823 HD11 ILE A 126 1.964 35.428 8.639 1.00 0.00 H ATOM 1824 HD12 ILE A 126 1.099 36.202 7.288 1.00 0.00 H ATOM 1825 HD13 ILE A 126 2.876 36.295 7.378 1.00 0.00 H ATOM 1826 HG21 ILE A 126 -1.542 37.829 9.314 1.00 0.00 H ATOM 1827 HG22 ILE A 126 -0.545 38.696 8.119 1.00 0.00 H ATOM 1828 HG23 ILE A 126 -0.696 36.923 8.035 1.00 0.00 H ATOM 1829 H ILE A 126 1.949 37.709 11.923 1.00 0.00 H ATOM 1830 N ASP A 127 -1.389 40.086 10.899 1.00 17.03 N ATOM 1831 CA ASP A 127 -2.697 40.403 11.456 1.00 17.87 C ATOM 1832 C ASP A 127 -3.791 39.972 10.471 1.00 18.25 C ATOM 1833 O ASP A 127 -3.772 40.408 9.324 1.00 18.36 O ATOM 1834 CB ASP A 127 -2.780 41.924 11.679 1.00 21.06 C ATOM 1835 CG ASP A 127 -3.922 42.420 12.539 1.00 19.44 C ATOM 1836 OD1 ASP A 127 -4.676 41.621 13.146 1.00 18.67 O ATOM 1837 OD2 ASP A 127 -4.050 43.671 12.637 1.00 21.82 O ATOM 1838 HA ASP A 127 -2.838 39.878 12.401 1.00 0.00 H ATOM 1839 HB2 ASP A 127 -1.849 42.241 12.149 1.00 0.00 H ATOM 1840 HB3 ASP A 127 -2.871 42.398 10.702 1.00 0.00 H ATOM 1841 H ASP A 127 -1.014 40.704 10.152 1.00 0.00 H ATOM 1842 N GLY A 128 -4.732 39.135 10.892 1.00 19.48 N ATOM 1843 CA GLY A 128 -5.792 38.684 9.998 1.00 17.13 C ATOM 1844 C GLY A 128 -5.329 37.548 9.089 1.00 22.37 C ATOM 1845 O GLY A 128 -4.408 36.765 9.360 1.00 19.53 O ATOM 1846 HA3 GLY A 128 -6.111 39.523 9.379 1.00 0.00 H ATOM 1847 HA2 GLY A 128 -6.633 38.335 10.597 1.00 0.00 H ATOM 1848 H GLY A 128 -4.713 38.796 11.875 1.00 0.00 H ATOM 1849 N ASP A 129 -5.992 37.453 7.932 1.00 19.99 N ATOM 1850 CA ASP A 129 -5.758 36.437 6.910 1.00 20.85 C ATOM 1851 C ASP A 129 -4.438 36.631 6.191 1.00 19.45 C ATOM 1852 O ASP A 129 -4.251 37.671 5.555 1.00 17.63 O ATOM 1853 CB ASP A 129 -6.893 36.552 5.865 1.00 27.79 C ATOM 1854 CG ASP A 129 -6.904 35.481 4.796 1.00 29.31 C ATOM 1855 OD1 ASP A 129 -6.060 34.565 4.797 1.00 23.75 O ATOM 1856 OD2 ASP A 129 -7.803 35.537 3.911 1.00 40.30 O ATOM 1857 HA ASP A 129 -5.733 35.463 7.398 1.00 0.00 H ATOM 1858 HB2 ASP A 129 -7.844 36.508 6.395 1.00 0.00 H ATOM 1859 HB3 ASP A 129 -6.799 37.519 5.371 1.00 0.00 H ATOM 1860 H ASP A 129 -6.733 38.159 7.745 1.00 0.00 H ATOM 1861 N PRO A 130 -3.534 35.670 6.242 1.00 15.98 N ATOM 1862 CA PRO A 130 -2.236 35.757 5.603 1.00 15.07 C ATOM 1863 C PRO A 130 -2.338 35.824 4.101 1.00 16.82 C ATOM 1864 O PRO A 130 -1.417 36.366 3.496 1.00 17.73 O ATOM 1865 CB PRO A 130 -1.440 34.511 6.044 1.00 17.03 C ATOM 1866 CG PRO A 130 -2.556 33.559 6.402 1.00 17.24 C ATOM 1867 CD PRO A 130 -3.702 34.403 6.950 1.00 17.25 C ATOM 1868 HA PRO A 130 -1.736 36.677 5.905 1.00 0.00 H ATOM 1869 HD3 PRO A 130 -4.667 33.951 6.723 1.00 0.00 H ATOM 1870 HD2 PRO A 130 -3.610 34.539 8.028 1.00 0.00 H ATOM 1871 HG3 PRO A 130 -2.217 32.851 7.158 1.00 0.00 H ATOM 1872 HG2 PRO A 130 -2.882 33.014 5.516 1.00 0.00 H ATOM 1873 HB2 PRO A 130 -0.827 34.120 5.232 1.00 0.00 H ATOM 1874 HB3 PRO A 130 -0.807 34.726 6.905 1.00 0.00 H ATOM 1875 N ARG A 131 -3.407 35.285 3.510 1.00 17.84 N ATOM 1876 CA ARG A 131 -3.584 35.329 2.045 1.00 21.13 C ATOM 1877 C ARG A 131 -3.650 36.757 1.532 1.00 24.83 C ATOM 1878 O ARG A 131 -3.220 37.055 0.415 1.00 30.39 O ATOM 1879 CB ARG A 131 -4.809 34.505 1.656 1.00 21.13 C ATOM 1880 CG ARG A 131 -4.563 33.036 1.943 1.00 25.46 C ATOM 1881 CD ARG A 131 -5.820 32.209 2.069 1.00 26.35 C ATOM 1882 NE ARG A 131 -5.513 30.898 2.660 1.00 34.36 N ATOM 1883 CZ ARG A 131 -5.395 30.648 3.966 1.00 42.90 C ATOM 1884 NH1 ARG A 131 -5.554 31.583 4.911 1.00 44.37 N ATOM 1885 NH2 ARG A 131 -5.121 29.402 4.353 1.00 42.73 N ATOM 1886 HA ARG A 131 -2.712 34.884 1.565 1.00 0.00 H ATOM 1887 HB2 ARG A 131 -5.670 34.846 2.231 1.00 0.00 H ATOM 1888 HB3 ARG A 131 -5.009 34.636 0.593 1.00 0.00 H ATOM 1889 HG2 ARG A 131 -3.963 32.625 1.131 1.00 0.00 H ATOM 1890 HG3 ARG A 131 -4.008 32.959 2.878 1.00 0.00 H ATOM 1891 HD2 ARG A 131 -6.256 32.065 1.081 1.00 0.00 H ATOM 1892 HD3 ARG A 131 -6.533 32.733 2.706 1.00 0.00 H ATOM 1893 HE ARG A 131 -5.377 30.100 2.007 1.00 0.00 H ATOM 1894 HH12 ARG A 131 -5.450 31.331 5.915 1.00 0.00 H ATOM 1895 HH11 ARG A 131 -5.781 32.561 4.641 1.00 0.00 H ATOM 1896 HH22 ARG A 131 -5.024 29.181 5.365 1.00 0.00 H ATOM 1897 HH21 ARG A 131 -5.004 28.651 3.643 1.00 0.00 H ATOM 1898 H ARG A 131 -4.132 34.823 4.095 1.00 0.00 H ATOM 1899 N ALA A 132 -4.129 37.700 2.339 1.00 21.09 N ATOM 1900 CA ALA A 132 -4.175 39.117 2.040 1.00 24.06 C ATOM 1901 C ALA A 132 -2.860 39.866 2.321 1.00 31.03 C ATOM 1902 O ALA A 132 -2.644 41.031 1.945 1.00 33.76 O ATOM 1903 CB ALA A 132 -5.259 39.787 2.879 1.00 23.54 C ATOM 1904 HA ALA A 132 -4.375 39.177 0.970 1.00 0.00 H ATOM 1905 HB1 ALA A 132 -6.225 39.338 2.648 1.00 0.00 H ATOM 1906 HB2 ALA A 132 -5.036 39.648 3.937 1.00 0.00 H ATOM 1907 HB3 ALA A 132 -5.288 40.852 2.649 1.00 0.00 H ATOM 1908 H ALA A 132 -4.501 37.395 3.261 1.00 0.00 H ATOM 1909 N ALA A 133 -1.913 39.228 3.004 1.00 30.64 N ATOM 1910 CA ALA A 133 -0.613 39.791 3.347 1.00 27.62 C ATOM 1911 C ALA A 133 0.484 39.060 2.581 1.00 27.81 C ATOM 1912 O ALA A 133 1.663 39.068 2.952 1.00 27.81 O ATOM 1913 CB ALA A 133 -0.378 39.666 4.848 1.00 25.92 C ATOM 1914 HA ALA A 133 -0.593 40.846 3.072 1.00 0.00 H ATOM 1915 HB1 ALA A 133 -1.159 40.207 5.383 1.00 0.00 H ATOM 1916 HB2 ALA A 133 -0.403 38.614 5.132 1.00 0.00 H ATOM 1917 HB3 ALA A 133 0.595 40.088 5.099 1.00 0.00 H ATOM 1918 H ALA A 133 -2.115 38.257 3.316 1.00 0.00 H ATOM 1919 N ARG A 134 0.134 38.417 1.468 1.00 26.29 N ATOM 1920 CA ARG A 134 1.125 37.681 0.702 1.00 32.63 C ATOM 1921 C ARG A 134 2.341 38.515 0.333 1.00 31.68 C ATOM 1922 O ARG A 134 3.473 37.985 0.354 1.00 29.08 O ATOM 1923 CB ARG A 134 0.476 36.973 -0.491 1.00 36.20 C ATOM 1924 CG ARG A 134 1.489 36.009 -1.065 1.00 46.89 C ATOM 1925 CD ARG A 134 0.952 35.042 -2.079 1.00 58.85 C ATOM 1926 NE ARG A 134 2.008 34.601 -2.997 1.00 73.88 N ATOM 1927 CZ ARG A 134 2.656 35.379 -3.862 1.00 81.03 C ATOM 1928 NH1 ARG A 134 2.388 36.679 -3.966 1.00 83.32 N ATOM 1929 NH2 ARG A 134 3.593 34.848 -4.645 1.00 83.70 N ATOM 1930 HA ARG A 134 1.526 36.903 1.351 1.00 0.00 H ATOM 1931 HB2 ARG A 134 -0.409 36.429 -0.162 1.00 0.00 H ATOM 1932 HB3 ARG A 134 0.191 37.705 -1.247 1.00 0.00 H ATOM 1933 HG2 ARG A 134 2.278 36.592 -1.540 1.00 0.00 H ATOM 1934 HG3 ARG A 134 1.911 35.434 -0.241 1.00 0.00 H ATOM 1935 HD2 ARG A 134 0.162 35.528 -2.651 1.00 0.00 H ATOM 1936 HD3 ARG A 134 0.543 34.174 -1.562 1.00 0.00 H ATOM 1937 HE ARG A 134 2.273 33.596 -2.970 1.00 0.00 H ATOM 1938 HH12 ARG A 134 2.909 37.264 -4.650 1.00 0.00 H ATOM 1939 HH11 ARG A 134 1.658 37.109 -3.363 1.00 0.00 H ATOM 1940 HH22 ARG A 134 4.105 35.447 -5.324 1.00 0.00 H ATOM 1941 HH21 ARG A 134 3.813 33.834 -4.578 1.00 0.00 H ATOM 1942 H ARG A 134 -0.854 38.442 1.146 1.00 0.00 H ATOM 1943 N ASP A 135 2.224 39.797 0.017 1.00 28.13 N ATOM 1944 CA ASP A 135 3.373 40.624 -0.327 1.00 34.24 C ATOM 1945 C ASP A 135 4.360 40.841 0.817 1.00 29.95 C ATOM 1946 O ASP A 135 5.583 40.866 0.637 1.00 29.20 O ATOM 1947 CB ASP A 135 2.923 41.987 -0.870 1.00 50.37 C ATOM 1948 CG ASP A 135 2.360 41.932 -2.280 1.00 58.81 C ATOM 1949 OD1 ASP A 135 2.702 41.059 -3.114 1.00 60.19 O ATOM 1950 OD2 ASP A 135 1.521 42.835 -2.525 1.00 67.73 O ATOM 1951 HA ASP A 135 3.903 40.061 -1.096 1.00 0.00 H ATOM 1952 HB2 ASP A 135 2.153 42.383 -0.208 1.00 0.00 H ATOM 1953 HB3 ASP A 135 3.782 42.658 -0.869 1.00 0.00 H ATOM 1954 H ASP A 135 1.278 40.228 0.015 1.00 0.00 H ATOM 1955 N ASP A 136 3.849 41.022 2.019 1.00 26.69 N ATOM 1956 CA ASP A 136 4.610 41.188 3.241 1.00 26.26 C ATOM 1957 C ASP A 136 5.376 39.875 3.502 1.00 23.86 C ATOM 1958 O ASP A 136 6.556 39.949 3.865 1.00 21.99 O ATOM 1959 CB ASP A 136 3.717 41.512 4.431 1.00 34.06 C ATOM 1960 CG ASP A 136 2.872 42.766 4.395 1.00 48.12 C ATOM 1961 OD1 ASP A 136 3.175 43.725 3.643 1.00 52.45 O ATOM 1962 OD2 ASP A 136 1.863 42.806 5.157 1.00 54.97 O ATOM 1963 HA ASP A 136 5.295 42.027 3.121 1.00 0.00 H ATOM 1964 HB2 ASP A 136 3.035 40.671 4.557 1.00 0.00 H ATOM 1965 HB3 ASP A 136 4.364 41.588 5.305 1.00 0.00 H ATOM 1966 H ASP A 136 2.812 41.048 2.097 1.00 0.00 H ATOM 1967 N ILE A 137 4.771 38.707 3.322 1.00 19.61 N ATOM 1968 CA ILE A 137 5.431 37.414 3.556 1.00 17.90 C ATOM 1969 C ILE A 137 6.622 37.244 2.612 1.00 22.89 C ATOM 1970 O ILE A 137 7.774 36.935 2.960 1.00 20.64 O ATOM 1971 CB ILE A 137 4.423 36.243 3.426 1.00 15.68 C ATOM 1972 CG1 ILE A 137 3.272 36.362 4.426 1.00 16.66 C ATOM 1973 CG2 ILE A 137 5.112 34.896 3.593 1.00 16.39 C ATOM 1974 CD1 ILE A 137 2.063 35.487 4.129 1.00 16.86 C ATOM 1975 HA ILE A 137 5.811 37.399 4.577 1.00 0.00 H ATOM 1976 HB ILE A 137 4.007 36.305 2.420 1.00 0.00 H ATOM 1977 HG12 ILE A 137 3.651 36.091 5.411 1.00 0.00 H ATOM 1978 HG13 ILE A 137 2.942 37.401 4.439 1.00 0.00 H ATOM 1979 HD11 ILE A 137 1.656 35.751 3.153 1.00 0.00 H ATOM 1980 HD12 ILE A 137 2.366 34.440 4.126 1.00 0.00 H ATOM 1981 HD13 ILE A 137 1.304 35.645 4.896 1.00 0.00 H ATOM 1982 HG21 ILE A 137 5.876 34.782 2.824 1.00 0.00 H ATOM 1983 HG22 ILE A 137 5.576 34.846 4.578 1.00 0.00 H ATOM 1984 HG23 ILE A 137 4.376 34.098 3.496 1.00 0.00 H ATOM 1985 H ILE A 137 3.782 38.707 3.000 1.00 0.00 H ATOM 1986 N VAL A 138 6.366 37.456 1.315 1.00 22.76 N ATOM 1987 CA VAL A 138 7.387 37.365 0.274 1.00 22.75 C ATOM 1988 C VAL A 138 8.541 38.329 0.515 1.00 21.42 C ATOM 1989 O VAL A 138 9.713 37.953 0.389 1.00 21.36 O ATOM 1990 CB VAL A 138 6.714 37.614 -1.096 1.00 25.06 C ATOM 1991 CG1 VAL A 138 7.739 37.925 -2.167 1.00 26.31 C ATOM 1992 CG2 VAL A 138 5.895 36.379 -1.444 1.00 23.21 C ATOM 1993 HA VAL A 138 7.825 36.367 0.292 1.00 0.00 H ATOM 1994 HB VAL A 138 6.062 38.486 -1.039 1.00 0.00 H ATOM 1995 HG11 VAL A 138 8.296 38.819 -1.887 1.00 0.00 H ATOM 1996 HG12 VAL A 138 8.426 37.084 -2.266 1.00 0.00 H ATOM 1997 HG13 VAL A 138 7.231 38.094 -3.116 1.00 0.00 H ATOM 1998 HG21 VAL A 138 6.553 35.512 -1.497 1.00 0.00 H ATOM 1999 HG22 VAL A 138 5.140 36.217 -0.675 1.00 0.00 H ATOM 2000 HG23 VAL A 138 5.408 36.527 -2.408 1.00 0.00 H ATOM 2001 H VAL A 138 5.394 37.697 1.035 1.00 0.00 H ATOM 2002 N GLY A 139 8.255 39.586 0.861 1.00 21.90 N ATOM 2003 CA GLY A 139 9.291 40.570 1.124 1.00 24.14 C ATOM 2004 C GLY A 139 10.140 40.169 2.331 1.00 28.77 C ATOM 2005 O GLY A 139 11.371 40.314 2.308 1.00 27.42 O ATOM 2006 HA3 GLY A 139 8.824 41.535 1.322 1.00 0.00 H ATOM 2007 HA2 GLY A 139 9.934 40.652 0.248 1.00 0.00 H ATOM 2008 H GLY A 139 7.258 39.870 0.945 1.00 0.00 H ATOM 2009 N TRP A 140 9.520 39.650 3.399 1.00 23.93 N ATOM 2010 CA TRP A 140 10.255 39.252 4.601 1.00 19.21 C ATOM 2011 C TRP A 140 11.182 38.093 4.290 1.00 14.35 C ATOM 2012 O TRP A 140 12.328 38.085 4.736 1.00 18.33 O ATOM 2013 CB TRP A 140 9.297 38.909 5.739 1.00 16.07 C ATOM 2014 CG TRP A 140 9.891 38.534 7.055 1.00 16.44 C ATOM 2015 CD1 TRP A 140 10.255 39.362 8.082 1.00 18.34 C ATOM 2016 CD2 TRP A 140 10.156 37.191 7.513 1.00 16.84 C ATOM 2017 NE1 TRP A 140 10.735 38.636 9.148 1.00 17.32 N ATOM 2018 CE2 TRP A 140 10.684 37.294 8.827 1.00 16.87 C ATOM 2019 CE3 TRP A 140 9.984 35.925 6.940 1.00 15.05 C ATOM 2020 CZ2 TRP A 140 11.056 36.170 9.572 1.00 13.38 C ATOM 2021 CZ3 TRP A 140 10.351 34.814 7.688 1.00 15.16 C ATOM 2022 CH2 TRP A 140 10.868 34.938 8.986 1.00 13.89 C ATOM 2023 HA TRP A 140 10.864 40.094 4.931 1.00 0.00 H ATOM 2024 HB2 TRP A 140 8.662 39.779 5.904 1.00 0.00 H ATOM 2025 HB3 TRP A 140 8.684 38.071 5.408 1.00 0.00 H ATOM 2026 HE1 TRP A 140 11.079 39.032 10.046 1.00 0.00 H ATOM 2027 HD1 TRP A 140 10.176 40.449 8.059 1.00 0.00 H ATOM 2028 HZ2 TRP A 140 11.477 36.265 10.573 1.00 0.00 H ATOM 2029 HH2 TRP A 140 11.127 34.038 9.544 1.00 0.00 H ATOM 2030 HZ3 TRP A 140 10.234 33.820 7.255 1.00 0.00 H ATOM 2031 HE3 TRP A 140 9.574 35.815 5.936 1.00 0.00 H ATOM 2032 H TRP A 140 8.488 39.526 3.374 1.00 0.00 H ATOM 2033 N ALA A 141 10.668 37.128 3.540 1.00 16.42 N ATOM 2034 CA ALA A 141 11.426 35.945 3.127 1.00 20.90 C ATOM 2035 C ALA A 141 12.664 36.396 2.337 1.00 26.82 C ATOM 2036 O ALA A 141 13.806 35.958 2.446 1.00 23.57 O ATOM 2037 CB ALA A 141 10.533 35.058 2.275 1.00 21.93 C ATOM 2038 HA ALA A 141 11.755 35.377 3.997 1.00 0.00 H ATOM 2039 HB1 ALA A 141 9.664 34.753 2.858 1.00 0.00 H ATOM 2040 HB2 ALA A 141 10.206 35.612 1.395 1.00 0.00 H ATOM 2041 HB3 ALA A 141 11.091 34.175 1.964 1.00 0.00 H ATOM 2042 H ALA A 141 9.679 37.215 3.230 1.00 0.00 H ATOM 2043 N HIS A 142 12.433 37.380 1.473 1.00 32.15 N ATOM 2044 CA HIS A 142 13.451 38.004 0.651 1.00 33.69 C ATOM 2045 C HIS A 142 14.469 38.688 1.550 1.00 29.25 C ATOM 2046 O HIS A 142 15.680 38.562 1.338 1.00 30.75 O ATOM 2047 CB HIS A 142 12.760 38.967 -0.325 1.00 44.11 C ATOM 2048 CG HIS A 142 13.817 39.626 -1.153 1.00 57.65 C ATOM 2049 ND1 HIS A 142 14.350 40.858 -0.809 1.00 63.98 N ATOM 2050 CD2 HIS A 142 14.457 39.197 -2.269 1.00 60.55 C ATOM 2051 CE1 HIS A 142 15.277 41.173 -1.705 1.00 64.15 C ATOM 2052 NE2 HIS A 142 15.361 40.185 -2.595 1.00 64.30 N ATOM 2053 HA HIS A 142 13.998 37.271 0.059 1.00 0.00 H ATOM 2054 HB2 HIS A 142 12.077 38.414 -0.969 1.00 0.00 H ATOM 2055 HB3 HIS A 142 12.203 39.721 0.231 1.00 0.00 H ATOM 2056 HD2 HIS A 142 14.290 38.260 -2.801 1.00 0.00 H ATOM 2057 HE1 HIS A 142 15.870 42.087 -1.712 1.00 0.00 H ATOM 2058 H HIS A 142 11.456 37.725 1.381 1.00 0.00 H ATOM 2059 N ASP A 143 14.098 39.398 2.600 1.00 25.35 N ATOM 2060 CA ASP A 143 15.043 40.040 3.497 1.00 30.11 C ATOM 2061 C ASP A 143 15.779 39.007 4.371 1.00 31.17 C ATOM 2062 O ASP A 143 16.920 39.324 4.727 1.00 30.34 O ATOM 2063 CB ASP A 143 14.404 41.023 4.481 1.00 34.06 C ATOM 2064 CG ASP A 143 13.745 42.231 3.849 1.00 44.88 C ATOM 2065 OD1 ASP A 143 14.254 42.690 2.793 1.00 49.66 O ATOM 2066 OD2 ASP A 143 12.728 42.696 4.422 1.00 43.63 O ATOM 2067 HA ASP A 143 15.713 40.574 2.824 1.00 0.00 H ATOM 2068 HB2 ASP A 143 13.647 40.485 5.051 1.00 0.00 H ATOM 2069 HB3 ASP A 143 15.182 41.378 5.157 1.00 0.00 H ATOM 2070 H ASP A 143 13.082 39.502 2.794 1.00 0.00 H ATOM 2071 N VAL A 144 15.151 37.876 4.726 1.00 24.27 N ATOM 2072 CA VAL A 144 15.872 36.918 5.549 1.00 24.66 C ATOM 2073 C VAL A 144 16.965 36.304 4.684 1.00 25.88 C ATOM 2074 O VAL A 144 18.056 36.125 5.233 1.00 24.68 O ATOM 2075 CB VAL A 144 15.088 35.826 6.288 1.00 26.33 C ATOM 2076 CG1 VAL A 144 13.858 36.415 6.968 1.00 21.61 C ATOM 2077 CG2 VAL A 144 14.734 34.672 5.384 1.00 31.57 C ATOM 2078 HA VAL A 144 16.244 37.505 6.388 1.00 0.00 H ATOM 2079 HB VAL A 144 15.737 35.419 7.064 1.00 0.00 H ATOM 2080 HG11 VAL A 144 14.170 37.174 7.686 1.00 0.00 H ATOM 2081 HG12 VAL A 144 13.211 36.868 6.217 1.00 0.00 H ATOM 2082 HG13 VAL A 144 13.317 35.623 7.486 1.00 0.00 H ATOM 2083 HG21 VAL A 144 14.119 35.033 4.559 1.00 0.00 H ATOM 2084 HG22 VAL A 144 15.648 34.227 4.990 1.00 0.00 H ATOM 2085 HG23 VAL A 144 14.180 33.924 5.951 1.00 0.00 H ATOM 2086 H VAL A 144 14.174 37.689 4.421 1.00 0.00 H ATOM 2087 N ARG A 145 16.732 36.002 3.414 1.00 29.00 N ATOM 2088 CA ARG A 145 17.765 35.440 2.550 1.00 36.67 C ATOM 2089 C ARG A 145 19.024 36.315 2.481 1.00 43.20 C ATOM 2090 O ARG A 145 20.144 35.820 2.370 1.00 44.29 O ATOM 2091 CB ARG A 145 17.301 35.359 1.092 1.00 36.64 C ATOM 2092 CG ARG A 145 16.289 34.284 0.815 1.00 47.43 C ATOM 2093 CD ARG A 145 16.278 33.936 -0.651 1.00 48.87 C ATOM 2094 NE ARG A 145 15.543 34.800 -1.533 1.00 57.09 N ATOM 2095 CZ ARG A 145 15.935 35.673 -2.446 1.00 62.11 C ATOM 2096 NH1 ARG A 145 17.221 35.900 -2.696 1.00 64.16 N ATOM 2097 NH2 ARG A 145 15.002 36.316 -3.150 1.00 63.29 N ATOM 2098 HA ARG A 145 17.971 34.463 2.988 1.00 0.00 H ATOM 2099 HB2 ARG A 145 16.860 36.319 0.822 1.00 0.00 H ATOM 2100 HB3 ARG A 145 18.174 35.173 0.467 1.00 0.00 H ATOM 2101 HG2 ARG A 145 16.542 33.395 1.393 1.00 0.00 H ATOM 2102 HG3 ARG A 145 15.300 34.637 1.108 1.00 0.00 H ATOM 2103 HD2 ARG A 145 15.855 32.936 -0.746 1.00 0.00 H ATOM 2104 HD3 ARG A 145 17.313 33.925 -0.992 1.00 0.00 H ATOM 2105 HE ARG A 145 14.510 34.725 -1.435 1.00 0.00 H ATOM 2106 HH12 ARG A 145 17.495 36.593 -3.421 1.00 0.00 H ATOM 2107 HH11 ARG A 145 17.953 35.384 -2.167 1.00 0.00 H ATOM 2108 HH22 ARG A 145 15.282 37.008 -3.874 1.00 0.00 H ATOM 2109 HH21 ARG A 145 13.995 36.125 -2.975 1.00 0.00 H ATOM 2110 H ARG A 145 15.784 36.171 3.022 1.00 0.00 H ATOM 2111 N GLY A 146 18.869 37.635 2.516 1.00 49.52 N ATOM 2112 CA GLY A 146 19.905 38.629 2.473 1.00 59.67 C ATOM 2113 C GLY A 146 20.745 38.850 3.720 1.00 68.64 C ATOM 2114 O GLY A 146 21.744 39.588 3.672 1.00 76.09 O ATOM 2115 HA3 GLY A 146 19.430 39.580 2.231 1.00 0.00 H ATOM 2116 HA2 GLY A 146 20.587 38.350 1.670 1.00 0.00 H ATOM 2117 H GLY A 146 17.892 37.986 2.582 1.00 0.00 H ATOM 2118 N ALA A 147 20.398 38.253 4.852 1.00 67.25 N ATOM 2119 CA ALA A 147 21.116 38.347 6.114 1.00 64.35 C ATOM 2120 C ALA A 147 21.904 37.053 6.358 1.00 65.05 C ATOM 2121 O ALA A 147 22.679 36.923 7.302 1.00 67.80 O ATOM 2122 CB ALA A 147 20.172 38.664 7.263 1.00 64.88 C ATOM 2123 HA ALA A 147 21.825 39.173 6.058 1.00 0.00 H ATOM 2124 HB1 ALA A 147 19.677 39.616 7.073 1.00 0.00 H ATOM 2125 HB2 ALA A 147 19.425 37.875 7.346 1.00 0.00 H ATOM 2126 HB3 ALA A 147 20.740 38.727 8.191 1.00 0.00 H ATOM 2127 H ALA A 147 19.539 37.667 4.836 1.00 0.00 H ATOM 2128 N ILE A 148 21.723 36.063 5.499 1.00 66.92 N ATOM 2129 CA ILE A 148 22.370 34.755 5.502 1.00 72.35 C ATOM 2130 C ILE A 148 23.621 34.853 4.622 1.00 78.76 C ATOM 2131 O ILE A 148 23.795 35.911 3.956 1.00 81.00 O ATOM 2132 CB ILE A 148 21.390 33.668 5.011 1.00 70.92 C ATOM 2133 CG1 ILE A 148 20.510 33.119 6.139 1.00 68.28 C ATOM 2134 CG2 ILE A 148 22.030 32.463 4.322 1.00 69.06 C ATOM 2135 CD1 ILE A 148 19.683 34.117 6.897 1.00 68.91 C ATOM 2136 HA ILE A 148 22.665 34.466 6.511 1.00 0.00 H ATOM 2137 OXT ILE A 148 24.465 33.930 4.550 1.00 82.88 O ATOM 2138 HB ILE A 148 20.802 34.211 4.271 1.00 0.00 H ATOM 2139 HG12 ILE A 148 19.828 32.390 5.701 1.00 0.00 H ATOM 2140 HG13 ILE A 148 21.163 32.620 6.855 1.00 0.00 H ATOM 2141 HD11 ILE A 148 20.340 34.851 7.364 1.00 0.00 H ATOM 2142 HD12 ILE A 148 19.003 34.621 6.210 1.00 0.00 H ATOM 2143 HD13 ILE A 148 19.108 33.601 7.666 1.00 0.00 H ATOM 2144 HG21 ILE A 148 22.581 32.799 3.444 1.00 0.00 H ATOM 2145 HG22 ILE A 148 22.713 31.970 5.014 1.00 0.00 H ATOM 2146 HG23 ILE A 148 21.251 31.764 4.018 1.00 0.00 H ATOM 2147 H ILE A 148 21.041 36.237 4.733 1.00 0.00 H TER 2148 ILE A 148 HETATM 2149 O HOH 1 1.563 34.320 16.611 1.00 10.89 O HETATM 2150 O HOH 2 0.538 22.339 13.873 1.00 15.57 O HETATM 2151 O HOH 3 -0.275 42.044 8.900 1.00 19.88 O HETATM 2152 O HOH 4 -4.085 35.785 11.616 1.00 18.14 O HETATM 2153 O HOH 5 12.940 36.517 14.186 1.00 17.87 O HETATM 2154 O HOH 6 -2.663 26.576 23.338 1.00 23.72 O HETATM 2155 O HOH 7 24.437 22.107 17.091 1.00 16.68 O HETATM 2156 O HOH 8 25.383 24.743 16.499 1.00 23.56 O HETATM 2157 O HOH 9 -3.546 21.176 15.754 1.00 27.02 O HETATM 2158 O HOH 10 23.358 28.647 11.056 1.00 26.45 O HETATM 2159 O HOH 11 -0.031 44.467 10.575 1.00 50.34 O HETATM 2160 O HOH 12 -2.203 45.199 11.861 1.00 25.54 O HETATM 2161 O HOH 13 19.711 24.634 21.654 1.00 29.32 O HETATM 2162 O HOH 14 15.194 15.338 15.816 1.00 27.52 O HETATM 2163 O HOH 15 5.099 17.228 8.344 1.00 39.01 O HETATM 2164 O HOH 16 -6.918 21.808 13.614 1.00 26.47 O HETATM 2165 O HOH 17 10.442 33.078 26.295 1.00 32.95 O HETATM 2166 O HOH 18 -8.458 31.423 13.161 1.00 37.98 O HETATM 2167 O HOH 19 -0.854 22.092 11.203 1.00 34.25 O HETATM 2168 O HOH 20 -9.275 35.920 15.578 1.00 38.49 O HETATM 2169 O HOH 21 -3.960 38.385 24.159 1.00 32.34 O HETATM 2170 O HOH 22 -4.504 28.152 24.756 1.00 31.40 O HETATM 2171 O HOH 23 -4.021 40.436 6.602 1.00 30.05 O HETATM 2172 O HOH 24 11.177 39.960 20.740 1.00 50.91 O HETATM 2173 O HOH 25 6.500 19.957 18.830 1.00 44.59 O HETATM 2174 O HOH 26 6.029 42.119 10.781 1.00 41.98 O HETATM 2175 O HOH 27 23.062 23.991 21.013 1.00 32.05 O HETATM 2176 O HOH 28 13.924 24.793 28.394 1.00 40.49 O HETATM 2177 O HOH 29 -2.446 44.555 20.481 1.00 64.25 O HETATM 2178 O HOH 30 0.402 17.486 18.739 1.00 42.27 O HETATM 2179 O HOH 31 25.634 25.646 13.898 1.00 38.93 O HETATM 2180 O HOH 32 -3.474 23.304 10.339 1.00 45.47 O HETATM 2181 O HOH 33 -7.423 35.635 11.528 1.00 43.35 O HETATM 2182 O HOH 34 18.842 17.194 11.858 1.00 42.43 O HETATM 2183 O HOH 35 11.499 23.263 29.876 1.00 49.29 O HETATM 2184 O HOH 36 0.909 20.508 24.228 1.00 49.12 O HETATM 2185 O HOH 37 4.707 40.609 18.721 1.00 39.42 O HETATM 2186 O HOH 38 -8.596 39.676 7.946 1.00 39.46 O HETATM 2187 O HOH 39 16.332 17.355 11.496 1.00 52.28 O HETATM 2188 O HOH 40 13.733 14.506 21.619 1.00 44.01 O HETATM 2189 O HOH 41 -3.503 26.464 4.999 1.00 37.54 O HETATM 2190 O HOH 42 12.119 14.882 14.172 1.00 36.18 O HETATM 2191 O HOH 43 -10.532 45.579 18.114 1.00 48.71 O HETATM 2192 O HOH 44 15.341 43.393 11.149 1.00 45.65 O HETATM 2193 O HOH 45 19.394 15.204 13.365 1.00 47.65 O HETATM 2194 O HOH 46 -13.091 29.937 22.087 1.00 56.68 O HETATM 2195 O HOH 47 13.692 22.709 -2.028 1.00 47.42 O HETATM 2196 O HOH 48 18.214 41.953 4.450 1.00 50.03 O HETATM 2197 O HOH 49 5.771 32.210 -2.506 1.00 43.42 O HETATM 2198 O HOH 50 8.376 34.096 -3.408 1.00 36.04 O HETATM 2199 O HOH 51 2.923 41.169 21.856 1.00 45.46 O HETATM 2200 O HOH 52 10.985 41.179 16.659 1.00 39.26 O HETATM 2201 O HOH 53 3.607 17.886 19.111 1.00 42.73 O HETATM 2202 O HOH 54 -2.134 26.175 26.702 1.00 49.90 O HETATM 2203 O HOH 55 -7.241 29.929 23.438 1.00 46.42 O HETATM 2204 O HOH 56 8.904 18.350 25.411 1.00 42.80 O HETATM 2205 O HOH 57 8.251 17.500 20.160 1.00 52.52 O HETATM 2206 O HOH 58 -9.069 31.997 10.642 1.00 57.35 O HETATM 2207 O HOH 59 -1.995 39.482 -1.158 1.00 49.41 O HETATM 2208 O HOH 60 -7.957 44.431 14.998 1.00 49.06 O HETATM 2209 O HOH 61 25.079 23.578 9.470 1.00 49.91 O HETATM 2210 O HOH 62 2.073 45.984 6.623 1.00 53.12 O HETATM 2211 O HOH 63 21.847 25.741 23.016 1.00 48.49 O HETATM 2212 O HOH 64 -11.329 35.830 17.792 1.00 50.25 O HETATM 2213 O HOH 65 3.065 38.025 25.007 1.00 52.11 O HETATM 2214 O HOH 66 6.181 43.041 21.997 1.00 52.43 O HETATM 2215 O HOH 67 7.703 42.217 5.159 1.00 42.48 O HETATM 2216 O HOH 68 0.457 19.769 8.650 1.00 41.01 O HETATM 2217 O HOH 69 22.003 35.330 21.642 1.00 45.40 O HETATM 2218 O HOH 70 -2.888 35.847 26.831 1.00 39.35 O HETATM 2219 O HOH 71 27.481 27.928 13.549 1.00 61.86 O HETATM 2220 O HOH 72 20.051 17.505 8.195 1.00 45.84 O HETATM 2221 O HOH 73 20.685 37.313 18.366 1.00 52.58 O HETATM 2222 O HOH 74 -5.090 38.219 27.759 1.00 66.99 O HETATM 2223 O HOH 75 6.094 44.511 3.436 1.00 58.93 O HETATM 2224 O HOH 76 17.412 39.056 29.969 1.00 61.34 O HETATM 2225 O HOH 77 29.497 29.429 17.316 1.00 62.08 O HETATM 2226 O HOH 78 -5.177 25.674 29.139 1.00 57.37 O HETATM 2227 O HOH 79 9.594 19.184 2.676 1.00 56.72 O HETATM 2228 O HOH 80 6.405 31.708 27.872 1.00 56.20 O HETATM 2229 O HOH 81 5.581 20.009 26.923 1.00 53.77 O HETATM 2230 O HOH 82 -2.188 25.889 2.635 1.00 58.83 O HETATM 2231 O HOH 83 21.137 33.271 0.545 1.00 60.90 O HETATM 2232 O HOH 84 -9.689 37.957 9.424 1.00 54.91 O HETATM 2233 O HOH 85 -7.513 41.203 12.709 1.00 54.36 O HETATM 2234 O HOH 86 3.208 43.381 19.577 1.00 51.90 O HETATM 2235 O HOH 87 12.524 33.761 30.728 1.00 47.34 O HETATM 2236 O HOH 88 25.933 32.408 14.598 1.00 55.51 O HETATM 2237 O HOH 89 0.591 45.550 4.049 1.00 53.55 O HETATM 2238 O HOH 90 25.557 26.625 11.405 1.00 54.20 O HETATM 2239 O HOH 91 9.523 25.697 29.518 1.00 49.19 O HETATM 2240 O HOH 92 10.251 42.663 7.037 1.00 64.77 O HETATM 2241 O HOH 93 16.900 14.275 23.444 1.00 65.71 O HETATM 2242 O HOH 94 15.935 13.342 27.807 1.00 63.93 O HETATM 2243 O HOH 95 4.798 23.091 4.032 1.00 57.13 O HETATM 2244 O HOH 96 11.421 38.724 -3.133 1.00 57.02 O HETATM 2245 O HOH 97 18.433 43.715 9.529 1.00 60.95 O HETATM 2246 O HOH 98 -6.834 28.747 6.762 1.00 55.09 O HETATM 2247 O HOH 99 -4.444 27.618 -0.537 1.00 62.52 O HETATM 2248 N1 FMN A 100 -4.213 36.299 18.244 1.00 -0.25 N HETATM 2249 C2 FMN A 100 -3.251 36.996 18.959 1.00 0.24 C HETATM 2250 O2 FMN A 100 -2.389 37.800 18.292 1.00 -0.39 O HETATM 2251 N3 FMN A 100 -3.177 36.949 20.341 1.00 -0.19 N HETATM 2252 C4 FMN A 100 -4.050 36.150 21.058 1.00 0.27 C HETATM 2253 O4 FMN A 100 -3.883 36.122 22.423 1.00 -0.37 O HETATM 2254 C4A FMN A 100 -5.031 35.406 20.325 1.00 0.21 C HETATM 2255 N5 FMN A 100 -5.890 34.582 21.013 1.00 -0.24 N HETATM 2256 C5A FMN A 100 -6.913 33.952 20.307 1.00 0.09 C HETATM 2257 C6 FMN A 100 -7.855 33.242 21.104 1.00 -0.04 C HETATM 2258 C7 FMN A 100 -8.920 32.647 20.408 1.00 -0.04 C HETATM 2259 C7M FMN A 100 -9.911 31.923 21.163 1.00 -0.04 C HETATM 2260 H3 FMN A 100 -9.655 31.958 22.232 1.00 0.04 H HETATM 2261 H4 FMN A 100 -9.936 30.876 20.826 1.00 0.04 H HETATM 2262 H5 FMN A 100 -10.898 32.382 21.008 1.00 0.04 H HETATM 2263 C8 FMN A 100 -9.011 32.757 19.014 1.00 -0.04 C HETATM 2264 C8M FMN A 100 -10.081 32.140 18.282 1.00 -0.03 C HETATM 2265 H6 FMN A 100 -9.960 32.350 17.209 1.00 0.04 H HETATM 2266 H7 FMN A 100 -11.043 32.544 18.629 1.00 0.04 H HETATM 2267 H8 FMN A 100 -10.059 31.053 18.447 1.00 0.04 H HETATM 2268 C9 FMN A 100 -8.057 33.455 18.248 1.00 -0.03 C HETATM 2269 C9A FMN A 100 -6.969 34.075 18.915 1.00 0.10 C HETATM 2270 N10 FMN A 100 -6.034 34.781 18.162 1.00 -0.21 N HETATM 2271 C10 FMN A 100 -5.107 35.487 18.918 1.00 0.19 C HETATM 2272 C1 FMN A 100 -5.980 34.950 16.758 1.00 0.09 C HETATM 2273 C2 FMN A 100 -5.321 33.692 16.154 1.00 0.11 C HETATM 2274 O2 FMN A 100 -3.936 33.609 16.555 1.00 -0.39 O HETATM 2275 H13 FMN A 100 -3.884 33.562 17.502 1.00 0.21 H HETATM 2276 C3 FMN A 100 -5.401 33.800 14.610 1.00 0.11 C HETATM 2277 O3 FMN A 100 -6.747 33.453 14.275 1.00 -0.39 O HETATM 2278 H15 FMN A 100 -6.928 32.569 14.572 1.00 0.21 H HETATM 2279 C4 FMN A 100 -4.443 33.019 13.805 1.00 0.11 C HETATM 2280 O4 FMN A 100 -4.598 33.377 12.410 1.00 -0.39 O HETATM 2281 H17 FMN A 100 -4.427 34.305 12.302 1.00 0.21 H HETATM 2282 C5 FMN A 100 -4.506 31.591 13.990 1.00 0.11 C HETATM 2283 O5 FMN A 100 -3.433 31.006 13.241 1.00 -0.27 O HETATM 2284 P FMN A 100 -3.328 29.395 12.867 1.00 0.20 P HETATM 2285 O1P FMN A 100 -3.433 28.504 14.255 1.00 -0.55 O HETATM 2286 O2P FMN A 100 -1.871 29.122 12.091 1.00 -0.55 O HETATM 2287 O3P FMN A 100 -4.516 28.979 11.788 1.00 -0.55 O HETATM 2288 H18 FMN A 100 -5.470 31.208 13.624 1.00 0.06 H HETATM 2289 H19 FMN A 100 -4.395 31.346 15.057 1.00 0.06 H HETATM 2290 H16 FMN A 100 -3.435 33.329 14.119 1.00 0.06 H HETATM 2291 H14 FMN A 100 -5.233 34.855 14.348 1.00 0.06 H HETATM 2292 H12 FMN A 100 -5.856 32.793 16.495 1.00 0.06 H HETATM 2293 H10 FMN A 100 -5.382 35.840 16.511 1.00 0.06 H HETATM 2294 H11 FMN A 100 -6.997 35.069 16.356 1.00 0.06 H HETATM 2295 H9 FMN A 100 -8.152 33.517 17.170 1.00 0.05 H HETATM 2296 H2 FMN A 100 -7.756 33.165 22.181 1.00 0.06 H HETATM 2297 H1 FMN A 100 -2.491 37.494 20.822 1.00 0.22 H CONECT 2248 2249 2271 CONECT 2249 2248 2250 2251 CONECT 2250 2249 CONECT 2251 2249 2252 2297 CONECT 2252 2251 2253 2254 CONECT 2253 2252 CONECT 2254 2252 2255 2271 CONECT 2255 2254 2256 CONECT 2256 2255 2257 2269 CONECT 2257 2256 2258 2296 CONECT 2258 2257 2259 2263 CONECT 2259 2258 2260 2261 2262 CONECT 2260 2259 CONECT 2261 2259 CONECT 2262 2259 CONECT 2263 2258 2264 2268 CONECT 2264 2263 2265 2266 2267 CONECT 2265 2264 CONECT 2266 2264 CONECT 2267 2264 CONECT 2268 2263 2269 2295 CONECT 2269 2256 2268 2270 CONECT 2270 2269 2271 2272 CONECT 2271 2248 2254 2270 CONECT 2272 2270 2273 2293 2294 CONECT 2273 2272 2274 2276 2292 CONECT 2274 2273 2275 CONECT 2275 2274 CONECT 2276 2273 2277 2279 2291 CONECT 2277 2276 2278 CONECT 2278 2277 CONECT 2279 2276 2280 2282 2290 CONECT 2280 2279 2281 CONECT 2281 2280 CONECT 2282 2279 2283 2288 2289 CONECT 2283 2282 2284 CONECT 2284 2283 2285 2286 2287 CONECT 2285 2284 CONECT 2286 2284 CONECT 2287 2284 CONECT 2288 2282 CONECT 2289 2282 CONECT 2290 2279 CONECT 2291 2276 CONECT 2292 2273 CONECT 2293 2272 CONECT 2294 2272 CONECT 2295 2268 CONECT 2296 2257 CONECT 2297 2251 MASTER 0 0 0 0 0 0 0 0 2296 1 50 12 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 1akw
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1akq
RCSB PDB
PDBbind
147aa, >1AKQ_1|Chain... *
1akr
RCSB PDB
PDBbind
147aa, >1AKR_1|Chain... at 98%
1akt
RCSB PDB
PDBbind
147aa, >1AKT_1|Chain... at 98%
1aku
RCSB PDB
PDBbind
147aa, >1AKU_1|Chain... at 100%
1akv
RCSB PDB
PDBbind
147aa, >1AKV_1|Chain... at 100%
1azl
RCSB PDB
PDBbind
147aa, >1AZL_1|Chain... at 98%
1c7e
RCSB PDB
PDBbind
147aa, >1C7E_1|Chains... at 99%
1c7f
RCSB PDB
PDBbind
147aa, >1C7F_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1akq
RCSB PDB
PDBbind
FMN ox
1akr
RCSB PDB
PDBbind
FMN ox
1akt
RCSB PDB
PDBbind
FMN ox
1azl
RCSB PDB
PDBbind
FMN ox
1c7f
RCSB PDB
PDBbind
FMN ox
1czk
RCSB PDB
PDBbind
FMN ox
1czr
RCSB PDB
PDBbind
FMN ox
Entry Information
PDB ID
1akw
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
flavodoxin
Ligand Name
FMN ox
EC.Number
E.C.-.-.-.-
Resolution
1.75(Å)
Affinity (Kd/Ki/IC50)
Kd=2.6nM
Release Year
1998
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistry v37 pp. 8405-16, 1998
Ligand Properties
Formula
C
1
7
H
2
2
N
4
O
9
P
Molecular Weight
457.352
Exact Mass
457.112
No. of atoms
53
No. of bonds
55
Polar Surface Area
224.84
LOGP Value
-2.56 (
Computed with XLOGP3
)
-2.00 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 13
No. of Rings: 3
Canonical SMILES
O=c1[nH]c(=O)c2c(n1)n(C[C@@H]([C@@H]([C@@H](COP(O)(O)O)O)O)O)c1c(n2)cc(c(c1)C)C
InChI String
InChI=1S/C17H23N4O9P/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29/h3-4,11-12,14,22-24,27-29,31H,5-6H2,1-2H3,(H,20,25,26)/t11-,12+,14-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00323
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com