Browse entries in the PDBbind-CN Database
HEADER 1AKV_COMPLEX COMPND 1AKV_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 GLY 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 ALA 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 273 52 ATOM 1 N PRO A 2 49.912 25.908 -7.816 1.00 14.41 N ATOM 2 CA PRO A 2 48.805 25.916 -6.797 1.00 13.47 C ATOM 3 C PRO A 2 49.251 26.752 -5.607 1.00 12.03 C ATOM 4 O PRO A 2 50.444 27.000 -5.442 1.00 13.31 O ATOM 5 CB PRO A 2 48.518 24.474 -6.370 1.00 11.66 C ATOM 6 CG PRO A 2 49.248 23.718 -7.459 1.00 11.30 C ATOM 7 CD PRO A 2 50.431 24.531 -7.914 1.00 11.09 C ATOM 8 HA PRO A 2 47.894 26.346 -7.213 1.00 0.00 H ATOM 9 HD3 PRO A 2 51.289 24.383 -7.259 1.00 0.00 H ATOM 10 HD2 PRO A 2 50.711 24.285 -8.938 1.00 0.00 H ATOM 11 HG3 PRO A 2 48.576 23.549 -8.300 1.00 0.00 H ATOM 12 HG2 PRO A 2 49.591 22.759 -7.071 1.00 0.00 H ATOM 13 HB2 PRO A 2 48.928 24.256 -5.384 1.00 0.00 H ATOM 14 HB3 PRO A 2 47.450 24.257 -6.375 1.00 0.00 H ATOM 15 N LYS A 3 48.295 27.181 -4.816 1.00 13.21 N ATOM 16 CA LYS A 3 48.588 28.001 -3.637 1.00 12.38 C ATOM 17 C LYS A 3 48.259 27.108 -2.421 1.00 12.68 C ATOM 18 O LYS A 3 47.099 26.720 -2.336 1.00 13.51 O ATOM 19 CB LYS A 3 47.627 29.134 -3.411 1.00 17.85 C ATOM 20 CG LYS A 3 47.755 30.513 -3.950 1.00 38.78 C ATOM 21 CD LYS A 3 46.836 31.483 -3.194 1.00 46.46 C ATOM 22 CE LYS A 3 47.466 32.060 -1.932 1.00 47.42 C ATOM 23 NZ LYS A 3 46.597 33.134 -1.330 1.00 52.42 N ATOM 24 HA LYS A 3 49.605 28.372 -3.766 1.00 0.00 H ATOM 25 HB2 LYS A 3 46.667 28.772 -3.779 1.00 0.00 H ATOM 26 HB3 LYS A 3 47.577 29.254 -2.329 1.00 0.00 H ATOM 27 HG2 LYS A 3 48.788 30.844 -3.844 1.00 0.00 H ATOM 28 HG3 LYS A 3 47.482 30.511 -5.005 1.00 0.00 H ATOM 29 HD2 LYS A 3 46.581 32.307 -3.860 1.00 0.00 H ATOM 30 HD3 LYS A 3 45.928 30.950 -2.914 1.00 0.00 H ATOM 31 HE2 LYS A 3 48.437 32.487 -2.183 1.00 0.00 H ATOM 32 HE3 LYS A 3 47.599 31.260 -1.203 1.00 0.00 H ATOM 33 HZ1 LYS A 3 46.470 33.903 -2.019 1.00 0.00 H ATOM 34 HZ2 LYS A 3 45.670 32.731 -1.084 1.00 0.00 H ATOM 35 HZ3 LYS A 3 47.053 33.507 -0.473 1.00 0.00 H ATOM 36 H LYS A 3 47.308 26.934 -5.031 1.00 0.00 H ATOM 37 N ALA A 4 49.255 26.880 -1.585 1.00 12.52 N ATOM 38 CA ALA A 4 48.958 26.026 -0.435 1.00 10.46 C ATOM 39 C ALA A 4 49.111 26.832 0.846 1.00 12.51 C ATOM 40 O ALA A 4 50.011 27.669 0.923 1.00 14.74 O ATOM 41 CB ALA A 4 49.965 24.874 -0.442 1.00 7.44 C ATOM 42 HA ALA A 4 47.939 25.644 -0.489 1.00 0.00 H ATOM 43 HB1 ALA A 4 49.865 24.311 -1.370 1.00 0.00 H ATOM 44 HB2 ALA A 4 50.975 25.276 -0.367 1.00 0.00 H ATOM 45 HB3 ALA A 4 49.770 24.217 0.406 1.00 0.00 H ATOM 46 H ALA A 4 50.201 27.286 -1.736 1.00 0.00 H ATOM 47 N LEU A 5 48.202 26.565 1.781 1.00 12.84 N ATOM 48 CA LEU A 5 48.272 27.200 3.106 1.00 11.35 C ATOM 49 C LEU A 5 48.696 26.101 4.103 1.00 9.11 C ATOM 50 O LEU A 5 48.096 25.023 4.086 1.00 8.62 O ATOM 51 CB LEU A 5 46.905 27.597 3.625 1.00 14.22 C ATOM 52 CG LEU A 5 46.683 28.677 4.668 1.00 16.70 C ATOM 53 CD1 LEU A 5 45.539 28.271 5.581 1.00 10.94 C ATOM 54 CD2 LEU A 5 47.935 29.131 5.339 1.00 14.70 C ATOM 55 HA LEU A 5 48.933 28.063 3.020 1.00 0.00 H ATOM 56 HB2 LEU A 5 46.333 27.906 2.750 1.00 0.00 H ATOM 57 HB3 LEU A 5 46.469 26.688 4.040 1.00 0.00 H ATOM 58 HG LEU A 5 46.366 29.595 4.173 1.00 0.00 H ATOM 59 HD21 LEU A 5 48.403 28.285 5.842 1.00 0.00 H ATOM 60 HD22 LEU A 5 48.619 29.536 4.593 1.00 0.00 H ATOM 61 HD23 LEU A 5 47.695 29.903 6.070 1.00 0.00 H ATOM 62 HD11 LEU A 5 44.632 28.143 4.990 1.00 0.00 H ATOM 63 HD12 LEU A 5 45.787 27.332 6.076 1.00 0.00 H ATOM 64 HD13 LEU A 5 45.380 29.047 6.330 1.00 0.00 H ATOM 65 H LEU A 5 47.432 25.898 1.572 1.00 0.00 H ATOM 66 N ILE A 6 49.705 26.306 4.921 1.00 11.47 N ATOM 67 CA ILE A 6 50.103 25.288 5.939 1.00 13.01 C ATOM 68 C ILE A 6 49.856 25.969 7.319 1.00 10.01 C ATOM 69 O ILE A 6 50.362 27.083 7.495 1.00 12.34 O ATOM 70 CB ILE A 6 51.548 24.789 5.808 1.00 12.48 C ATOM 71 CG1 ILE A 6 51.728 24.059 4.448 1.00 7.08 C ATOM 72 CG2 ILE A 6 51.970 23.849 6.947 1.00 7.79 C ATOM 73 CD1 ILE A 6 53.216 23.973 4.142 1.00 6.46 C ATOM 74 HA ILE A 6 49.513 24.382 5.804 1.00 0.00 H ATOM 75 HB ILE A 6 52.189 25.669 5.864 1.00 0.00 H ATOM 76 HG12 ILE A 6 51.306 23.056 4.510 1.00 0.00 H ATOM 77 HG13 ILE A 6 51.222 24.617 3.660 1.00 0.00 H ATOM 78 HD11 ILE A 6 53.632 24.979 4.084 1.00 0.00 H ATOM 79 HD12 ILE A 6 53.717 23.416 4.934 1.00 0.00 H ATOM 80 HD13 ILE A 6 53.361 23.463 3.190 1.00 0.00 H ATOM 81 HG21 ILE A 6 51.888 24.374 7.899 1.00 0.00 H ATOM 82 HG22 ILE A 6 51.319 22.975 6.955 1.00 0.00 H ATOM 83 HG23 ILE A 6 53.002 23.534 6.793 1.00 0.00 H ATOM 84 H ILE A 6 50.238 27.197 4.858 1.00 0.00 H ATOM 85 N VAL A 7 49.095 25.365 8.220 1.00 7.76 N ATOM 86 CA VAL A 7 48.867 26.039 9.526 1.00 12.36 C ATOM 87 C VAL A 7 49.304 25.011 10.577 1.00 11.34 C ATOM 88 O VAL A 7 48.797 23.870 10.485 1.00 11.89 O ATOM 89 CB VAL A 7 47.406 26.402 9.781 1.00 12.71 C ATOM 90 CG1 VAL A 7 47.233 26.959 11.200 1.00 13.91 C ATOM 91 CG2 VAL A 7 46.854 27.383 8.762 1.00 13.21 C ATOM 92 HA VAL A 7 49.418 26.979 9.553 1.00 0.00 H ATOM 93 HB VAL A 7 46.832 25.481 9.677 1.00 0.00 H ATOM 94 HG11 VAL A 7 47.544 26.207 11.925 1.00 0.00 H ATOM 95 HG12 VAL A 7 47.847 27.852 11.316 1.00 0.00 H ATOM 96 HG13 VAL A 7 46.186 27.212 11.364 1.00 0.00 H ATOM 97 HG21 VAL A 7 47.436 28.304 8.794 1.00 0.00 H ATOM 98 HG22 VAL A 7 46.919 26.945 7.766 1.00 0.00 H ATOM 99 HG23 VAL A 7 45.812 27.601 8.997 1.00 0.00 H ATOM 100 H VAL A 7 48.666 24.439 8.018 1.00 0.00 H ATOM 101 N TYR A 8 50.224 25.357 11.472 1.00 10.73 N ATOM 102 CA TYR A 8 50.635 24.306 12.410 1.00 7.28 C ATOM 103 C TYR A 8 50.523 24.809 13.864 1.00 8.27 C ATOM 104 O TYR A 8 50.536 25.990 14.125 1.00 6.36 O ATOM 105 CB TYR A 8 52.067 23.836 12.090 1.00 5.01 C ATOM 106 CG TYR A 8 53.008 25.006 12.250 1.00 11.06 C ATOM 107 CD1 TYR A 8 53.593 25.318 13.480 1.00 10.01 C ATOM 108 CD2 TYR A 8 53.238 25.835 11.155 1.00 13.04 C ATOM 109 CE1 TYR A 8 54.415 26.403 13.612 1.00 6.92 C ATOM 110 CE2 TYR A 8 54.073 26.936 11.261 1.00 12.05 C ATOM 111 CZ TYR A 8 54.642 27.204 12.508 1.00 19.01 C ATOM 112 OH TYR A 8 55.469 28.320 12.601 1.00 18.95 O ATOM 113 HA TYR A 8 49.967 23.452 12.299 1.00 0.00 H ATOM 114 HB3 TYR A 8 52.112 23.466 11.066 1.00 0.00 H ATOM 115 HB2 TYR A 8 52.353 23.038 12.775 1.00 0.00 H ATOM 116 HD2 TYR A 8 52.755 25.615 10.203 1.00 0.00 H ATOM 117 HE2 TYR A 8 54.279 27.572 10.400 1.00 0.00 H ATOM 118 HE1 TYR A 8 54.882 26.632 14.570 1.00 0.00 H ATOM 119 HD1 TYR A 8 53.391 24.688 14.346 1.00 0.00 H ATOM 120 HH TYR A 8 55.808 28.402 13.528 1.00 0.00 H ATOM 121 H TYR A 8 50.628 26.315 11.505 1.00 0.00 H ATOM 122 N GLY A 9 50.348 23.819 14.722 1.00 10.79 N ATOM 123 CA GLY A 9 50.268 24.013 16.156 1.00 11.31 C ATOM 124 C GLY A 9 51.446 23.150 16.651 1.00 5.33 C ATOM 125 O GLY A 9 51.453 21.937 16.462 1.00 6.68 O ATOM 126 HA3 GLY A 9 49.318 23.656 16.554 1.00 0.00 H ATOM 127 HA2 GLY A 9 50.402 25.061 16.424 1.00 0.00 H ATOM 128 H GLY A 9 50.263 22.852 14.349 1.00 0.00 H ATOM 129 N SER A 10 52.347 23.801 17.346 1.00 7.87 N ATOM 130 CA SER A 10 53.537 23.146 17.838 1.00 7.35 C ATOM 131 C SER A 10 54.025 23.766 19.146 1.00 9.41 C ATOM 132 O SER A 10 54.288 24.957 19.253 1.00 10.72 O ATOM 133 CB SER A 10 54.671 23.329 16.797 1.00 5.25 C ATOM 134 OG SER A 10 55.801 22.496 17.033 1.00 6.71 O ATOM 135 HA SER A 10 53.293 22.097 18.005 1.00 0.00 H ATOM 136 HB2 SER A 10 54.998 24.369 16.822 1.00 0.00 H ATOM 137 HB3 SER A 10 54.273 23.098 15.809 1.00 0.00 H ATOM 138 HG SER A 10 55.522 21.547 17.003 1.00 0.00 H ATOM 139 H SER A 10 52.202 24.811 17.548 1.00 0.00 H ATOM 140 N THR A 11 54.128 22.852 20.118 1.00 9.36 N ATOM 141 CA THR A 11 54.577 23.258 21.454 1.00 10.60 C ATOM 142 C THR A 11 56.071 23.221 21.572 1.00 8.00 C ATOM 143 O THR A 11 56.676 24.182 22.085 1.00 12.60 O ATOM 144 CB THR A 11 53.869 22.387 22.534 1.00 9.08 C ATOM 145 OG1 THR A 11 52.480 22.788 22.648 1.00 10.79 O ATOM 146 CG2 THR A 11 54.548 22.566 23.896 1.00 10.61 C ATOM 147 HA THR A 11 54.292 24.297 21.622 1.00 0.00 H ATOM 148 HB THR A 11 53.935 21.341 22.233 1.00 0.00 H ATOM 149 HG1 THR A 11 52.033 22.233 23.335 1.00 0.00 H ATOM 150 HG23 THR A 11 55.594 22.267 23.821 1.00 0.00 H ATOM 151 HG21 THR A 11 54.488 23.612 24.196 1.00 0.00 H ATOM 152 HG22 THR A 11 54.043 21.945 24.636 1.00 0.00 H ATOM 153 H THR A 11 53.891 21.858 19.927 1.00 0.00 H ATOM 154 N THR A 12 56.722 22.117 21.167 1.00 11.66 N ATOM 155 CA THR A 12 58.194 22.068 21.283 1.00 13.57 C ATOM 156 C THR A 12 58.914 22.241 19.925 1.00 18.56 C ATOM 157 O THR A 12 60.140 22.102 19.852 1.00 16.95 O ATOM 158 CB THR A 12 58.661 20.831 22.057 1.00 11.81 C ATOM 159 OG1 THR A 12 58.485 19.713 21.189 1.00 16.32 O ATOM 160 CG2 THR A 12 57.816 20.546 23.312 1.00 11.42 C ATOM 161 HA THR A 12 58.490 22.935 21.874 1.00 0.00 H ATOM 162 HB THR A 12 59.691 21.001 22.372 1.00 0.00 H ATOM 163 HG1 THR A 12 57.529 19.635 20.943 1.00 0.00 H ATOM 164 HG23 THR A 12 57.916 21.375 24.012 1.00 0.00 H ATOM 165 HG21 THR A 12 56.770 20.434 23.027 1.00 0.00 H ATOM 166 HG22 THR A 12 58.166 19.627 23.783 1.00 0.00 H ATOM 167 H THR A 12 56.197 21.308 20.777 1.00 0.00 H ATOM 168 N GLY A 13 58.207 22.561 18.818 1.00 12.58 N ATOM 169 CA GLY A 13 58.859 22.761 17.541 1.00 11.30 C ATOM 170 C GLY A 13 58.925 21.573 16.620 1.00 10.62 C ATOM 171 O GLY A 13 59.432 21.725 15.489 1.00 8.18 O ATOM 172 HA3 GLY A 13 59.882 23.082 17.739 1.00 0.00 H ATOM 173 HA2 GLY A 13 58.325 23.555 17.018 1.00 0.00 H ATOM 174 H GLY A 13 57.174 22.666 18.885 1.00 0.00 H ATOM 175 N ASN A 14 58.426 20.403 17.011 1.00 7.75 N ATOM 176 CA ASN A 14 58.524 19.262 16.072 1.00 4.38 C ATOM 177 C ASN A 14 57.576 19.361 14.881 1.00 9.83 C ATOM 178 O ASN A 14 57.921 19.082 13.715 1.00 5.56 O ATOM 179 CB ASN A 14 58.241 18.040 16.893 1.00 1.72 C ATOM 180 CG ASN A 14 59.465 17.709 17.718 1.00 7.72 C ATOM 181 OD1 ASN A 14 60.593 18.152 17.449 1.00 9.66 O ATOM 182 ND2 ASN A 14 59.354 16.867 18.732 1.00 7.99 N ATOM 183 HA ASN A 14 59.515 19.239 15.619 1.00 0.00 H ATOM 184 HB2 ASN A 14 57.395 18.230 17.553 1.00 0.00 H ATOM 185 HB3 ASN A 14 58.006 17.203 16.235 1.00 0.00 H ATOM 186 HD22 ASN A 14 58.424 16.477 18.984 1.00 0.00 H ATOM 187 HD21 ASN A 14 60.197 16.595 19.277 1.00 0.00 H ATOM 188 H ASN A 14 57.982 20.294 17.945 1.00 0.00 H ATOM 189 N THR A 15 56.315 19.726 15.174 1.00 9.62 N ATOM 190 CA THR A 15 55.294 19.893 14.160 1.00 8.79 C ATOM 191 C THR A 15 55.635 21.124 13.282 1.00 14.87 C ATOM 192 O THR A 15 55.282 21.172 12.118 1.00 12.58 O ATOM 193 CB THR A 15 53.860 20.037 14.645 1.00 6.46 C ATOM 194 OG1 THR A 15 53.694 18.891 15.461 1.00 10.59 O ATOM 195 CG2 THR A 15 52.878 19.967 13.471 1.00 7.16 C ATOM 196 HA THR A 15 55.316 18.952 13.610 1.00 0.00 H ATOM 197 HB THR A 15 53.676 20.984 15.153 1.00 0.00 H ATOM 198 HG1 THR A 15 54.353 18.915 16.199 1.00 0.00 H ATOM 199 HG23 THR A 15 53.003 20.848 12.841 1.00 0.00 H ATOM 200 HG21 THR A 15 53.077 19.069 12.886 1.00 0.00 H ATOM 201 HG22 THR A 15 51.858 19.935 13.854 1.00 0.00 H ATOM 202 H THR A 15 56.063 19.895 16.169 1.00 0.00 H ATOM 203 N GLU A 16 56.296 22.102 13.888 1.00 11.14 N ATOM 204 CA GLU A 16 56.763 23.263 13.220 1.00 13.09 C ATOM 205 C GLU A 16 57.893 22.848 12.236 1.00 15.24 C ATOM 206 O GLU A 16 57.887 23.295 11.079 1.00 9.57 O ATOM 207 CB GLU A 16 57.367 24.297 14.194 1.00 13.00 C ATOM 208 CG GLU A 16 57.748 25.478 13.263 1.00 12.17 C ATOM 209 CD GLU A 16 58.275 26.647 14.034 1.00 28.15 C ATOM 210 OE1 GLU A 16 58.436 26.453 15.257 1.00 29.47 O ATOM 211 OE2 GLU A 16 58.519 27.695 13.404 1.00 29.12 O ATOM 212 HA GLU A 16 55.909 23.713 12.713 1.00 0.00 H ATOM 213 HB2 GLU A 16 56.635 24.607 14.940 1.00 0.00 H ATOM 214 HB3 GLU A 16 58.247 23.895 14.696 1.00 0.00 H ATOM 215 HG2 GLU A 16 58.513 25.143 12.563 1.00 0.00 H ATOM 216 HG3 GLU A 16 56.863 25.791 12.709 1.00 0.00 H ATOM 217 H GLU A 16 56.482 22.013 14.907 1.00 0.00 H ATOM 218 N TYR A 17 58.863 22.034 12.634 1.00 13.55 N ATOM 219 CA TYR A 17 59.936 21.554 11.769 1.00 12.60 C ATOM 220 C TYR A 17 59.286 20.802 10.583 1.00 17.20 C ATOM 221 O TYR A 17 59.635 20.903 9.383 1.00 11.79 O ATOM 222 CB TYR A 17 60.864 20.616 12.560 1.00 9.60 C ATOM 223 CG TYR A 17 61.646 19.762 11.564 1.00 7.99 C ATOM 224 CD1 TYR A 17 62.764 20.245 10.914 1.00 10.96 C ATOM 225 CD2 TYR A 17 61.210 18.490 11.249 1.00 7.95 C ATOM 226 CE1 TYR A 17 63.458 19.462 9.996 1.00 11.37 C ATOM 227 CE2 TYR A 17 61.880 17.671 10.324 1.00 7.05 C ATOM 228 CZ TYR A 17 63.009 18.186 9.703 1.00 10.55 C ATOM 229 OH TYR A 17 63.692 17.387 8.824 1.00 11.44 O ATOM 230 HA TYR A 17 60.535 22.386 11.400 1.00 0.00 H ATOM 231 HB3 TYR A 17 60.271 19.973 13.211 1.00 0.00 H ATOM 232 HB2 TYR A 17 61.555 21.204 13.164 1.00 0.00 H ATOM 233 HD2 TYR A 17 60.313 18.107 11.736 1.00 0.00 H ATOM 234 HE2 TYR A 17 61.525 16.665 10.102 1.00 0.00 H ATOM 235 HE1 TYR A 17 64.352 19.852 9.510 1.00 0.00 H ATOM 236 HD1 TYR A 17 63.109 21.257 11.123 1.00 0.00 H ATOM 237 HH TYR A 17 64.468 17.884 8.462 1.00 0.00 H ATOM 238 H TYR A 17 58.858 21.718 13.625 1.00 0.00 H ATOM 239 N THR A 18 58.285 19.967 10.917 1.00 11.89 N ATOM 240 CA THR A 18 57.511 19.177 9.992 1.00 14.22 C ATOM 241 C THR A 18 56.886 20.099 8.945 1.00 14.94 C ATOM 242 O THR A 18 57.040 19.861 7.748 1.00 14.61 O ATOM 243 CB THR A 18 56.456 18.295 10.690 1.00 14.37 C ATOM 244 OG1 THR A 18 57.199 17.448 11.606 1.00 9.44 O ATOM 245 CG2 THR A 18 55.693 17.378 9.730 1.00 4.06 C ATOM 246 HA THR A 18 58.184 18.477 9.497 1.00 0.00 H ATOM 247 HB THR A 18 55.718 18.941 11.165 1.00 0.00 H ATOM 248 HG1 THR A 18 57.684 18.014 12.257 1.00 0.00 H ATOM 249 HG23 THR A 18 55.123 17.985 9.026 1.00 0.00 H ATOM 250 HG21 THR A 18 56.402 16.756 9.184 1.00 0.00 H ATOM 251 HG22 THR A 18 55.013 16.743 10.299 1.00 0.00 H ATOM 252 H THR A 18 58.050 19.885 11.927 1.00 0.00 H ATOM 253 N ALA A 19 56.190 21.140 9.329 1.00 9.83 N ATOM 254 CA ALA A 19 55.558 22.122 8.492 1.00 6.91 C ATOM 255 C ALA A 19 56.595 22.830 7.637 1.00 10.57 C ATOM 256 O ALA A 19 56.284 23.081 6.468 1.00 7.44 O ATOM 257 CB ALA A 19 54.804 23.142 9.353 1.00 4.19 C ATOM 258 HA ALA A 19 54.848 21.617 7.837 1.00 0.00 H ATOM 259 HB1 ALA A 19 54.043 22.628 9.940 1.00 0.00 H ATOM 260 HB2 ALA A 19 55.506 23.640 10.022 1.00 0.00 H ATOM 261 HB3 ALA A 19 54.330 23.881 8.707 1.00 0.00 H ATOM 262 H ALA A 19 56.083 21.270 10.355 1.00 0.00 H ATOM 263 N GLU A 20 57.785 23.143 8.068 1.00 9.24 N ATOM 264 CA GLU A 20 58.805 23.796 7.263 1.00 11.94 C ATOM 265 C GLU A 20 59.367 22.827 6.219 1.00 14.59 C ATOM 266 O GLU A 20 59.702 23.321 5.138 1.00 10.83 O ATOM 267 CB GLU A 20 59.999 24.324 8.055 1.00 16.23 C ATOM 268 CG GLU A 20 59.640 25.434 9.032 1.00 14.33 C ATOM 269 CD GLU A 20 60.584 25.569 10.222 1.00 25.35 C ATOM 270 OE1 GLU A 20 61.407 24.648 10.456 1.00 28.04 O ATOM 271 OE2 GLU A 20 60.516 26.586 10.964 1.00 24.40 O ATOM 272 HA GLU A 20 58.289 24.644 6.813 1.00 0.00 H ATOM 273 HB2 GLU A 20 60.433 23.497 8.617 1.00 0.00 H ATOM 274 HB3 GLU A 20 60.736 24.710 7.351 1.00 0.00 H ATOM 275 HG2 GLU A 20 59.642 26.379 8.488 1.00 0.00 H ATOM 276 HG3 GLU A 20 58.638 25.239 9.414 1.00 0.00 H ATOM 277 H GLU A 20 58.021 22.910 9.054 1.00 0.00 H ATOM 278 N THR A 21 59.469 21.555 6.580 1.00 9.40 N ATOM 279 CA THR A 21 59.973 20.521 5.663 1.00 14.37 C ATOM 280 C THR A 21 59.034 20.359 4.467 1.00 11.22 C ATOM 281 O THR A 21 59.334 20.260 3.268 1.00 14.03 O ATOM 282 CB THR A 21 60.171 19.219 6.471 1.00 10.19 C ATOM 283 OG1 THR A 21 61.087 19.550 7.528 1.00 9.29 O ATOM 284 CG2 THR A 21 60.715 18.086 5.584 1.00 6.48 C ATOM 285 HA THR A 21 60.936 20.807 5.240 1.00 0.00 H ATOM 286 HB THR A 21 59.226 18.850 6.870 1.00 0.00 H ATOM 287 HG1 THR A 21 60.697 20.266 8.089 1.00 0.00 H ATOM 288 HG23 THR A 21 59.994 17.865 4.797 1.00 0.00 H ATOM 289 HG21 THR A 21 61.659 18.398 5.137 1.00 0.00 H ATOM 290 HG22 THR A 21 60.876 17.196 6.192 1.00 0.00 H ATOM 291 H THR A 21 59.184 21.280 7.542 1.00 0.00 H ATOM 292 N ILE A 22 57.755 20.293 4.803 1.00 6.40 N ATOM 293 CA ILE A 22 56.643 20.216 3.889 1.00 9.31 C ATOM 294 C ILE A 22 56.583 21.502 3.032 1.00 13.48 C ATOM 295 O ILE A 22 56.461 21.405 1.798 1.00 12.44 O ATOM 296 CB ILE A 22 55.289 20.006 4.619 1.00 10.38 C ATOM 297 CG1 ILE A 22 55.232 18.638 5.339 1.00 5.91 C ATOM 298 CG2 ILE A 22 54.131 20.077 3.609 1.00 10.25 C ATOM 299 CD1 ILE A 22 53.989 18.537 6.212 1.00 1.79 C ATOM 300 HA ILE A 22 56.805 19.347 3.251 1.00 0.00 H ATOM 301 HB ILE A 22 55.196 20.797 5.363 1.00 0.00 H ATOM 302 HG12 ILE A 22 55.211 17.843 4.594 1.00 0.00 H ATOM 303 HG13 ILE A 22 56.118 18.526 5.964 1.00 0.00 H ATOM 304 HD11 ILE A 22 54.008 19.328 6.961 1.00 0.00 H ATOM 305 HD12 ILE A 22 53.100 18.644 5.590 1.00 0.00 H ATOM 306 HD13 ILE A 22 53.972 17.566 6.707 1.00 0.00 H ATOM 307 HG21 ILE A 22 54.131 21.054 3.126 1.00 0.00 H ATOM 308 HG22 ILE A 22 54.258 19.298 2.857 1.00 0.00 H ATOM 309 HG23 ILE A 22 53.186 19.928 4.131 1.00 0.00 H ATOM 310 H ILE A 22 57.532 20.297 5.819 1.00 0.00 H ATOM 311 N ALA A 23 56.662 22.719 3.558 1.00 8.97 N ATOM 312 CA ALA A 23 56.612 24.000 2.893 1.00 8.02 C ATOM 313 C ALA A 23 57.706 24.068 1.826 1.00 12.38 C ATOM 314 O ALA A 23 57.485 24.475 0.688 1.00 10.69 O ATOM 315 CB ALA A 23 56.797 25.197 3.850 1.00 3.88 C ATOM 316 HA ALA A 23 55.617 24.077 2.455 1.00 0.00 H ATOM 317 HB1 ALA A 23 56.006 25.186 4.600 1.00 0.00 H ATOM 318 HB2 ALA A 23 57.767 25.121 4.342 1.00 0.00 H ATOM 319 HB3 ALA A 23 56.748 26.126 3.282 1.00 0.00 H ATOM 320 H ALA A 23 56.776 22.754 4.591 1.00 0.00 H ATOM 321 N ARG A 24 58.916 23.672 2.226 1.00 10.12 N ATOM 322 CA ARG A 24 60.059 23.663 1.332 1.00 9.06 C ATOM 323 C ARG A 24 59.880 22.701 0.163 1.00 11.84 C ATOM 324 O ARG A 24 60.250 22.978 -0.990 1.00 8.17 O ATOM 325 CB ARG A 24 61.304 23.234 2.113 1.00 15.52 C ATOM 326 CG ARG A 24 62.606 23.156 1.325 1.00 31.75 C ATOM 327 CD ARG A 24 62.838 24.448 0.570 1.00 58.95 C ATOM 328 NE ARG A 24 63.989 24.481 -0.303 1.00 81.47 N ATOM 329 CZ ARG A 24 65.276 24.763 -0.158 1.00 86.43 C ATOM 330 NH1 ARG A 24 65.764 25.111 1.031 1.00 91.36 N ATOM 331 NH2 ARG A 24 66.070 24.704 -1.235 1.00 87.62 N ATOM 332 HA ARG A 24 60.161 24.672 0.932 1.00 0.00 H ATOM 333 HB2 ARG A 24 61.449 23.948 2.924 1.00 0.00 H ATOM 334 HB3 ARG A 24 61.109 22.246 2.531 1.00 0.00 H ATOM 335 HG2 ARG A 24 63.434 22.987 2.013 1.00 0.00 H ATOM 336 HG3 ARG A 24 62.550 22.330 0.616 1.00 0.00 H ATOM 337 HD2 ARG A 24 62.954 25.246 1.304 1.00 0.00 H ATOM 338 HD3 ARG A 24 61.954 24.641 -0.038 1.00 0.00 H ATOM 339 HE ARG A 24 63.750 24.221 -1.281 1.00 0.00 H ATOM 340 HH12 ARG A 24 66.775 25.330 1.134 1.00 0.00 H ATOM 341 HH11 ARG A 24 65.134 25.164 1.857 1.00 0.00 H ATOM 342 HH22 ARG A 24 67.083 24.921 -1.147 1.00 0.00 H ATOM 343 HH21 ARG A 24 65.673 24.441 -2.160 1.00 0.00 H ATOM 344 H ARG A 24 59.044 23.360 3.210 1.00 0.00 H ATOM 345 N GLU A 25 59.316 21.532 0.428 1.00 11.94 N ATOM 346 CA GLU A 25 59.090 20.519 -0.584 1.00 12.81 C ATOM 347 C GLU A 25 58.101 21.058 -1.619 1.00 14.78 C ATOM 348 O GLU A 25 58.288 20.910 -2.824 1.00 15.27 O ATOM 349 CB GLU A 25 58.654 19.173 0.016 1.00 10.22 C ATOM 350 CG GLU A 25 59.057 18.012 -0.894 1.00 16.48 C ATOM 351 CD GLU A 25 58.066 17.657 -1.975 1.00 17.13 C ATOM 352 OE1 GLU A 25 56.992 18.257 -2.131 1.00 13.93 O ATOM 353 OE2 GLU A 25 58.296 16.701 -2.754 1.00 24.69 O ATOM 354 HA GLU A 25 60.034 20.305 -1.086 1.00 0.00 H ATOM 355 HB2 GLU A 25 59.129 19.045 0.989 1.00 0.00 H ATOM 356 HB3 GLU A 25 57.571 19.171 0.139 1.00 0.00 H ATOM 357 HG2 GLU A 25 59.999 18.274 -1.375 1.00 0.00 H ATOM 358 HG3 GLU A 25 59.202 17.131 -0.269 1.00 0.00 H ATOM 359 H GLU A 25 59.022 21.332 1.405 1.00 0.00 H ATOM 360 N LEU A 26 57.028 21.658 -1.200 1.00 11.82 N ATOM 361 CA LEU A 26 55.982 22.224 -2.038 1.00 16.19 C ATOM 362 C LEU A 26 56.522 23.469 -2.728 1.00 14.71 C ATOM 363 O LEU A 26 56.270 23.630 -3.929 1.00 11.70 O ATOM 364 CB LEU A 26 54.717 22.549 -1.236 1.00 14.06 C ATOM 365 CG LEU A 26 53.606 21.505 -1.128 1.00 16.82 C ATOM 366 CD1 LEU A 26 54.041 20.092 -1.150 1.00 11.78 C ATOM 367 CD2 LEU A 26 52.758 21.849 0.097 1.00 19.88 C ATOM 368 HA LEU A 26 55.695 21.483 -2.785 1.00 0.00 H ATOM 369 HB2 LEU A 26 55.036 22.779 -0.220 1.00 0.00 H ATOM 370 HB3 LEU A 26 54.275 23.438 -1.687 1.00 0.00 H ATOM 371 HG LEU A 26 53.012 21.566 -2.040 1.00 0.00 H ATOM 372 HD21 LEU A 26 53.385 21.828 0.989 1.00 0.00 H ATOM 373 HD22 LEU A 26 52.331 22.844 -0.026 1.00 0.00 H ATOM 374 HD23 LEU A 26 51.955 21.118 0.199 1.00 0.00 H ATOM 375 HD11 LEU A 26 54.560 19.887 -2.086 1.00 0.00 H ATOM 376 HD12 LEU A 26 54.714 19.907 -0.313 1.00 0.00 H ATOM 377 HD13 LEU A 26 53.169 19.443 -1.067 1.00 0.00 H ATOM 378 H LEU A 26 56.905 21.742 -0.171 1.00 0.00 H ATOM 379 N ALA A 27 57.269 24.349 -2.096 1.00 8.13 N ATOM 380 CA ALA A 27 57.814 25.516 -2.712 1.00 9.69 C ATOM 381 C ALA A 27 58.812 25.123 -3.837 1.00 12.34 C ATOM 382 O ALA A 27 58.896 25.770 -4.912 1.00 7.85 O ATOM 383 CB ALA A 27 58.564 26.403 -1.726 1.00 7.56 C ATOM 384 HA ALA A 27 56.964 26.068 -3.113 1.00 0.00 H ATOM 385 HB1 ALA A 27 57.883 26.726 -0.939 1.00 0.00 H ATOM 386 HB2 ALA A 27 59.388 25.840 -1.287 1.00 0.00 H ATOM 387 HB3 ALA A 27 58.957 27.275 -2.249 1.00 0.00 H ATOM 388 H ALA A 27 57.474 24.185 -1.090 1.00 0.00 H ATOM 389 N ASP A 28 59.585 24.067 -3.620 1.00 9.60 N ATOM 390 CA ASP A 28 60.572 23.606 -4.596 1.00 13.68 C ATOM 391 C ASP A 28 59.957 23.143 -5.928 1.00 11.95 C ATOM 392 O ASP A 28 60.636 23.225 -6.945 1.00 14.42 O ATOM 393 CB ASP A 28 61.362 22.418 -4.061 1.00 14.80 C ATOM 394 CG ASP A 28 62.561 22.811 -3.216 1.00 18.70 C ATOM 395 OD1 ASP A 28 62.872 24.014 -3.090 1.00 13.22 O ATOM 396 OD2 ASP A 28 63.152 21.824 -2.712 1.00 22.22 O ATOM 397 HA ASP A 28 61.204 24.477 -4.770 1.00 0.00 H ATOM 398 HB2 ASP A 28 60.696 21.808 -3.451 1.00 0.00 H ATOM 399 HB3 ASP A 28 61.716 21.830 -4.908 1.00 0.00 H ATOM 400 H ASP A 28 59.486 23.548 -2.724 1.00 0.00 H ATOM 401 N ALA A 29 58.740 22.617 -5.818 1.00 12.27 N ATOM 402 CA ALA A 29 57.901 22.125 -6.879 1.00 10.69 C ATOM 403 C ALA A 29 57.165 23.291 -7.584 1.00 13.51 C ATOM 404 O ALA A 29 56.432 23.027 -8.535 1.00 15.14 O ATOM 405 CB ALA A 29 56.821 21.163 -6.425 1.00 7.37 C ATOM 406 HA ALA A 29 58.590 21.601 -7.541 1.00 0.00 H ATOM 407 HB1 ALA A 29 57.283 20.295 -5.955 1.00 0.00 H ATOM 408 HB2 ALA A 29 56.169 21.662 -5.708 1.00 0.00 H ATOM 409 HB3 ALA A 29 56.236 20.842 -7.287 1.00 0.00 H ATOM 410 H ALA A 29 58.350 22.554 -4.856 1.00 0.00 H ATOM 411 N GLY A 30 57.291 24.531 -7.102 1.00 14.30 N ATOM 412 CA GLY A 30 56.667 25.694 -7.728 1.00 11.66 C ATOM 413 C GLY A 30 55.380 26.178 -7.122 1.00 11.17 C ATOM 414 O GLY A 30 54.736 27.093 -7.600 1.00 10.33 O ATOM 415 HA3 GLY A 30 56.467 25.441 -8.769 1.00 0.00 H ATOM 416 HA2 GLY A 30 57.382 26.516 -7.685 1.00 0.00 H ATOM 417 H GLY A 30 57.859 24.674 -6.243 1.00 0.00 H ATOM 418 N TYR A 31 54.931 25.542 -6.001 1.00 11.63 N ATOM 419 CA TYR A 31 53.691 26.012 -5.376 1.00 11.12 C ATOM 420 C TYR A 31 53.930 27.354 -4.688 1.00 9.23 C ATOM 421 O TYR A 31 55.068 27.589 -4.289 1.00 9.41 O ATOM 422 CB TYR A 31 53.273 25.194 -4.130 1.00 6.31 C ATOM 423 CG TYR A 31 52.516 23.958 -4.475 1.00 11.81 C ATOM 424 CD1 TYR A 31 52.933 23.034 -5.458 1.00 13.65 C ATOM 425 CD2 TYR A 31 51.328 23.761 -3.787 1.00 13.15 C ATOM 426 CE1 TYR A 31 52.154 21.919 -5.730 1.00 13.12 C ATOM 427 CE2 TYR A 31 50.584 22.597 -4.040 1.00 18.96 C ATOM 428 CZ TYR A 31 50.990 21.696 -5.018 1.00 16.19 C ATOM 429 OH TYR A 31 50.181 20.593 -5.220 1.00 13.64 O ATOM 430 HA TYR A 31 52.970 25.983 -6.193 1.00 0.00 H ATOM 431 HB3 TYR A 31 52.646 25.821 -3.496 1.00 0.00 H ATOM 432 HB2 TYR A 31 54.172 24.910 -3.582 1.00 0.00 H ATOM 433 HD2 TYR A 31 50.978 24.497 -3.063 1.00 0.00 H ATOM 434 HE2 TYR A 31 49.680 22.398 -3.464 1.00 0.00 H ATOM 435 HE1 TYR A 31 52.460 21.218 -6.506 1.00 0.00 H ATOM 436 HD1 TYR A 31 53.864 23.196 -6.001 1.00 0.00 H ATOM 437 HH TYR A 31 50.568 20.028 -5.935 1.00 0.00 H ATOM 438 H TYR A 31 55.458 24.741 -5.599 1.00 0.00 H ATOM 439 N GLU A 32 52.833 28.087 -4.526 1.00 10.80 N ATOM 440 CA GLU A 32 53.004 29.350 -3.709 1.00 12.84 C ATOM 441 C GLU A 32 52.607 28.815 -2.299 1.00 10.14 C ATOM 442 O GLU A 32 51.581 28.163 -2.204 1.00 9.54 O ATOM 443 CB GLU A 32 52.097 30.416 -4.188 1.00 18.46 C ATOM 444 CG GLU A 32 52.092 31.736 -3.476 1.00 32.70 C ATOM 445 CD GLU A 32 50.879 32.569 -3.899 1.00 41.47 C ATOM 446 OE1 GLU A 32 50.143 32.069 -4.790 1.00 44.87 O ATOM 447 OE2 GLU A 32 50.733 33.671 -3.313 1.00 45.40 O ATOM 448 HA GLU A 32 53.991 29.810 -3.750 1.00 0.00 H ATOM 449 HB2 GLU A 32 52.356 30.614 -5.228 1.00 0.00 H ATOM 450 HB3 GLU A 32 51.083 30.021 -4.137 1.00 0.00 H ATOM 451 HG2 GLU A 32 52.052 31.564 -2.400 1.00 0.00 H ATOM 452 HG3 GLU A 32 53.004 32.280 -3.722 1.00 0.00 H ATOM 453 H GLU A 32 51.917 27.811 -4.934 1.00 0.00 H ATOM 454 N VAL A 33 53.407 28.965 -1.253 1.00 13.07 N ATOM 455 CA VAL A 33 53.092 28.343 0.036 1.00 11.48 C ATOM 456 C VAL A 33 53.008 29.408 1.105 1.00 15.40 C ATOM 457 O VAL A 33 53.950 30.203 1.136 1.00 17.25 O ATOM 458 CB VAL A 33 54.224 27.376 0.452 1.00 12.03 C ATOM 459 CG1 VAL A 33 53.874 26.650 1.757 1.00 12.36 C ATOM 460 CG2 VAL A 33 54.529 26.336 -0.632 1.00 8.91 C ATOM 461 HA VAL A 33 52.147 27.809 -0.067 1.00 0.00 H ATOM 462 HB VAL A 33 55.113 27.990 0.598 1.00 0.00 H ATOM 463 HG11 VAL A 33 53.729 27.382 2.551 1.00 0.00 H ATOM 464 HG12 VAL A 33 52.957 26.077 1.618 1.00 0.00 H ATOM 465 HG13 VAL A 33 54.688 25.976 2.026 1.00 0.00 H ATOM 466 HG21 VAL A 33 53.635 25.745 -0.828 1.00 0.00 H ATOM 467 HG22 VAL A 33 54.838 26.845 -1.545 1.00 0.00 H ATOM 468 HG23 VAL A 33 55.331 25.682 -0.290 1.00 0.00 H ATOM 469 H VAL A 33 54.273 29.534 -1.349 1.00 0.00 H ATOM 470 N ASP A 34 51.932 29.346 1.873 1.00 14.15 N ATOM 471 CA ASP A 34 51.747 30.253 3.023 1.00 16.30 C ATOM 472 C ASP A 34 51.798 29.347 4.261 1.00 13.20 C ATOM 473 O ASP A 34 50.887 28.566 4.470 1.00 12.15 O ATOM 474 CB ASP A 34 50.343 30.823 2.857 1.00 32.19 C ATOM 475 CG ASP A 34 50.347 32.055 1.988 1.00 46.40 C ATOM 476 OD1 ASP A 34 51.266 32.231 1.163 1.00 54.83 O ATOM 477 OD2 ASP A 34 49.415 32.868 2.173 1.00 61.13 O ATOM 478 HA ASP A 34 52.482 31.054 3.101 1.00 0.00 H ATOM 479 HB2 ASP A 34 49.705 30.067 2.398 1.00 0.00 H ATOM 480 HB3 ASP A 34 49.947 31.083 3.839 1.00 0.00 H ATOM 481 H ASP A 34 51.198 28.640 1.661 1.00 0.00 H ATOM 482 N SER A 35 52.848 29.354 5.062 1.00 16.12 N ATOM 483 CA SER A 35 52.982 28.483 6.239 1.00 16.15 C ATOM 484 C SER A 35 52.781 29.360 7.479 1.00 21.70 C ATOM 485 O SER A 35 53.576 30.279 7.662 1.00 21.69 O ATOM 486 CB SER A 35 54.339 27.787 6.249 1.00 15.45 C ATOM 487 OG SER A 35 54.321 26.767 7.289 1.00 25.24 O ATOM 488 HA SER A 35 52.235 27.690 6.222 1.00 0.00 H ATOM 489 HB2 SER A 35 55.125 28.513 6.458 1.00 0.00 H ATOM 490 HB3 SER A 35 54.523 27.323 5.280 1.00 0.00 H ATOM 491 HG SER A 35 55.196 26.304 7.310 1.00 0.00 H ATOM 492 H SER A 35 53.624 30.013 4.848 1.00 0.00 H ATOM 493 N ARG A 36 51.746 29.173 8.282 1.00 14.06 N ATOM 494 CA ARG A 36 51.454 29.995 9.427 1.00 12.55 C ATOM 495 C ARG A 36 51.271 29.154 10.694 1.00 13.70 C ATOM 496 O ARG A 36 50.800 28.020 10.681 1.00 12.61 O ATOM 497 CB ARG A 36 50.089 30.664 9.163 1.00 14.04 C ATOM 498 CG ARG A 36 50.017 31.498 7.915 1.00 24.89 C ATOM 499 CD ARG A 36 48.755 32.336 7.776 1.00 45.73 C ATOM 500 NE ARG A 36 48.523 32.744 6.381 1.00 57.29 N ATOM 501 CZ ARG A 36 47.411 33.187 5.804 1.00 57.72 C ATOM 502 NH1 ARG A 36 46.261 33.338 6.453 1.00 64.77 N ATOM 503 NH2 ARG A 36 47.424 33.496 4.511 1.00 57.86 N ATOM 504 HA ARG A 36 52.275 30.698 9.570 1.00 0.00 H ATOM 505 HB2 ARG A 36 49.337 29.879 9.088 1.00 0.00 H ATOM 506 HB3 ARG A 36 49.858 31.307 10.012 1.00 0.00 H ATOM 507 HG2 ARG A 36 50.874 32.172 7.908 1.00 0.00 H ATOM 508 HG3 ARG A 36 50.076 30.829 7.057 1.00 0.00 H ATOM 509 HD2 ARG A 36 48.854 33.229 8.394 1.00 0.00 H ATOM 510 HD3 ARG A 36 47.902 31.750 8.120 1.00 0.00 H ATOM 511 HE ARG A 36 49.351 32.676 5.755 1.00 0.00 H ATOM 512 HH12 ARG A 36 45.422 33.689 5.949 1.00 0.00 H ATOM 513 HH11 ARG A 36 46.200 33.105 7.465 1.00 0.00 H ATOM 514 HH22 ARG A 36 46.559 33.843 4.051 1.00 0.00 H ATOM 515 HH21 ARG A 36 48.300 33.390 3.960 1.00 0.00 H ATOM 516 H ARG A 36 51.103 28.383 8.073 1.00 0.00 H ATOM 517 N ASP A 37 51.725 29.728 11.788 1.00 15.87 N ATOM 518 CA ASP A 37 51.594 29.128 13.134 1.00 13.18 C ATOM 519 C ASP A 37 50.107 29.348 13.461 1.00 15.31 C ATOM 520 O ASP A 37 49.584 30.467 13.228 1.00 9.46 O ATOM 521 CB ASP A 37 52.433 29.914 14.148 1.00 14.80 C ATOM 522 CG ASP A 37 52.528 29.280 15.538 1.00 11.17 C ATOM 523 OD1 ASP A 37 51.555 28.681 16.007 1.00 12.01 O ATOM 524 OD2 ASP A 37 53.616 29.360 16.149 1.00 20.64 O ATOM 525 HA ASP A 37 51.918 28.088 13.169 1.00 0.00 H ATOM 526 HB2 ASP A 37 53.443 30.010 13.750 1.00 0.00 H ATOM 527 HB3 ASP A 37 51.992 30.905 14.257 1.00 0.00 H ATOM 528 H ASP A 37 52.200 30.649 11.702 1.00 0.00 H ATOM 529 N ALA A 38 49.401 28.345 14.023 1.00 16.68 N ATOM 530 CA ALA A 38 47.969 28.512 14.354 1.00 16.60 C ATOM 531 C ALA A 38 47.742 29.662 15.334 1.00 15.29 C ATOM 532 O ALA A 38 46.671 30.280 15.331 1.00 17.32 O ATOM 533 CB ALA A 38 47.320 27.237 14.870 1.00 9.11 C ATOM 534 HA ALA A 38 47.480 28.759 13.412 1.00 0.00 H ATOM 535 HB1 ALA A 38 47.394 26.460 14.110 1.00 0.00 H ATOM 536 HB2 ALA A 38 47.832 26.911 15.776 1.00 0.00 H ATOM 537 HB3 ALA A 38 46.271 27.430 15.093 1.00 0.00 H ATOM 538 H ALA A 38 49.871 27.440 14.227 1.00 0.00 H ATOM 539 N ALA A 39 48.743 29.991 16.151 1.00 13.69 N ATOM 540 CA ALA A 39 48.712 31.068 17.127 1.00 22.91 C ATOM 541 C ALA A 39 48.522 32.457 16.482 1.00 27.19 C ATOM 542 O ALA A 39 47.987 33.343 17.152 1.00 25.62 O ATOM 543 CB ALA A 39 50.024 31.202 17.908 1.00 14.28 C ATOM 544 HA ALA A 39 47.875 30.794 17.770 1.00 0.00 H ATOM 545 HB1 ALA A 39 50.223 30.273 18.443 1.00 0.00 H ATOM 546 HB2 ALA A 39 50.839 31.405 17.214 1.00 0.00 H ATOM 547 HB3 ALA A 39 49.939 32.022 18.621 1.00 0.00 H ATOM 548 H ALA A 39 49.617 29.432 16.085 1.00 0.00 H ATOM 549 N SER A 40 48.960 32.639 15.238 1.00 27.16 N ATOM 550 CA SER A 40 48.828 33.907 14.529 1.00 28.25 C ATOM 551 C SER A 40 47.644 34.071 13.587 1.00 25.05 C ATOM 552 O SER A 40 47.419 35.129 12.995 1.00 29.99 O ATOM 553 CB SER A 40 50.109 33.989 13.648 1.00 37.35 C ATOM 554 OG SER A 40 49.854 33.341 12.397 1.00 41.38 O ATOM 555 HA SER A 40 48.681 34.676 15.287 1.00 0.00 H ATOM 556 HB2 SER A 40 50.935 33.492 14.156 1.00 0.00 H ATOM 557 HB3 SER A 40 50.367 35.034 13.473 1.00 0.00 H ATOM 558 HG SER A 40 49.619 32.393 12.560 1.00 0.00 H ATOM 559 H SER A 40 49.416 31.842 14.750 1.00 0.00 H ATOM 560 N VAL A 41 46.848 33.040 13.386 1.00 21.91 N ATOM 561 CA VAL A 41 45.717 32.942 12.469 1.00 18.99 C ATOM 562 C VAL A 41 44.366 33.244 13.041 1.00 21.68 C ATOM 563 O VAL A 41 44.169 33.038 14.250 1.00 23.40 O ATOM 564 CB VAL A 41 45.869 31.428 12.064 1.00 23.34 C ATOM 565 CG1 VAL A 41 44.677 30.529 12.166 1.00 19.00 C ATOM 566 CG2 VAL A 41 46.667 31.344 10.770 1.00 16.41 C ATOM 567 HA VAL A 41 45.749 33.680 11.667 1.00 0.00 H ATOM 568 HB VAL A 41 46.435 30.959 12.869 1.00 0.00 H ATOM 569 HG11 VAL A 41 44.330 30.504 13.199 1.00 0.00 H ATOM 570 HG12 VAL A 41 43.882 30.907 11.523 1.00 0.00 H ATOM 571 HG13 VAL A 41 44.954 29.523 11.850 1.00 0.00 H ATOM 572 HG21 VAL A 41 46.141 31.886 9.984 1.00 0.00 H ATOM 573 HG22 VAL A 41 47.651 31.787 10.922 1.00 0.00 H ATOM 574 HG23 VAL A 41 46.778 30.299 10.480 1.00 0.00 H ATOM 575 H VAL A 41 47.051 32.191 13.951 1.00 0.00 H ATOM 576 N GLU A 42 43.443 33.724 12.215 1.00 18.19 N ATOM 577 CA GLU A 42 42.044 34.005 12.555 1.00 24.29 C ATOM 578 C GLU A 42 41.302 32.973 11.689 1.00 19.77 C ATOM 579 O GLU A 42 41.677 32.876 10.516 1.00 20.34 O ATOM 580 CB GLU A 42 41.512 35.394 12.317 1.00 36.65 C ATOM 581 CG GLU A 42 41.976 36.481 13.282 1.00 57.62 C ATOM 582 CD GLU A 42 41.748 37.906 12.810 1.00 71.27 C ATOM 583 OE1 GLU A 42 41.289 38.180 11.671 1.00 81.88 O ATOM 584 OE2 GLU A 42 42.038 38.857 13.582 1.00 80.09 O ATOM 585 HA GLU A 42 41.910 33.938 13.635 1.00 0.00 H ATOM 586 HB2 GLU A 42 41.810 35.694 11.313 1.00 0.00 H ATOM 587 HB3 GLU A 42 40.424 35.345 12.372 1.00 0.00 H ATOM 588 HG2 GLU A 42 41.442 36.348 14.223 1.00 0.00 H ATOM 589 HG3 GLU A 42 43.045 36.348 13.451 1.00 0.00 H ATOM 590 H GLU A 42 43.740 33.918 11.237 1.00 0.00 H ATOM 591 N ALA A 43 40.370 32.207 12.204 1.00 18.14 N ATOM 592 CA ALA A 43 39.708 31.146 11.472 1.00 17.96 C ATOM 593 C ALA A 43 38.795 31.617 10.362 1.00 21.08 C ATOM 594 O ALA A 43 38.740 30.989 9.299 1.00 22.62 O ATOM 595 CB ALA A 43 39.011 30.202 12.469 1.00 16.34 C ATOM 596 HA ALA A 43 40.478 30.593 10.934 1.00 0.00 H ATOM 597 HB1 ALA A 43 39.754 29.774 13.143 1.00 0.00 H ATOM 598 HB2 ALA A 43 38.276 30.763 13.046 1.00 0.00 H ATOM 599 HB3 ALA A 43 38.512 29.402 11.922 1.00 0.00 H ATOM 600 H ALA A 43 40.091 32.370 13.192 1.00 0.00 H ATOM 601 N GLY A 44 38.081 32.710 10.524 1.00 22.53 N ATOM 602 CA GLY A 44 37.152 33.278 9.577 1.00 21.00 C ATOM 603 C GLY A 44 37.688 33.403 8.150 1.00 19.28 C ATOM 604 O GLY A 44 38.559 34.198 7.849 1.00 17.02 O ATOM 605 HA3 GLY A 44 36.878 34.274 9.925 1.00 0.00 H ATOM 606 HA2 GLY A 44 36.264 32.646 9.552 1.00 0.00 H ATOM 607 H GLY A 44 38.198 33.216 11.425 1.00 0.00 H ATOM 608 N GLY A 45 37.176 32.535 7.275 1.00 23.08 N ATOM 609 CA GLY A 45 37.561 32.470 5.883 1.00 22.76 C ATOM 610 C GLY A 45 39.037 32.236 5.666 1.00 23.14 C ATOM 611 O GLY A 45 39.555 32.505 4.573 1.00 25.06 O ATOM 612 HA3 GLY A 45 37.289 33.412 5.407 1.00 0.00 H ATOM 613 HA2 GLY A 45 37.011 31.655 5.412 1.00 0.00 H ATOM 614 H GLY A 45 36.457 31.865 7.615 1.00 0.00 H ATOM 615 N LEU A 46 39.764 31.675 6.614 1.00 16.23 N ATOM 616 CA LEU A 46 41.184 31.416 6.491 1.00 17.61 C ATOM 617 C LEU A 46 41.574 30.608 5.255 1.00 12.94 C ATOM 618 O LEU A 46 42.608 30.838 4.634 1.00 16.28 O ATOM 619 CB LEU A 46 41.611 30.698 7.808 1.00 12.71 C ATOM 620 CG LEU A 46 43.096 30.372 7.956 1.00 10.63 C ATOM 621 CD1 LEU A 46 43.947 31.626 7.953 1.00 9.32 C ATOM 622 CD2 LEU A 46 43.335 29.533 9.219 1.00 7.51 C ATOM 623 HA LEU A 46 41.710 32.361 6.351 1.00 0.00 H ATOM 624 HB2 LEU A 46 41.328 31.340 8.642 1.00 0.00 H ATOM 625 HB3 LEU A 46 41.058 29.761 7.869 1.00 0.00 H ATOM 626 HG LEU A 46 43.400 29.782 7.092 1.00 0.00 H ATOM 627 HD21 LEU A 46 43.005 30.093 10.094 1.00 0.00 H ATOM 628 HD22 LEU A 46 42.772 28.603 9.148 1.00 0.00 H ATOM 629 HD23 LEU A 46 44.398 29.309 9.309 1.00 0.00 H ATOM 630 HD11 LEU A 46 43.804 32.159 7.013 1.00 0.00 H ATOM 631 HD12 LEU A 46 43.651 32.267 8.784 1.00 0.00 H ATOM 632 HD13 LEU A 46 44.996 31.352 8.060 1.00 0.00 H ATOM 633 H LEU A 46 39.291 31.404 7.499 1.00 0.00 H ATOM 634 N PHE A 47 40.816 29.601 4.843 1.00 11.73 N ATOM 635 CA PHE A 47 41.198 28.751 3.735 1.00 10.68 C ATOM 636 C PHE A 47 40.807 29.294 2.354 1.00 19.19 C ATOM 637 O PHE A 47 41.109 28.616 1.365 1.00 18.86 O ATOM 638 CB PHE A 47 40.601 27.369 3.923 1.00 8.20 C ATOM 639 CG PHE A 47 40.914 26.675 5.227 1.00 12.88 C ATOM 640 CD1 PHE A 47 41.877 27.134 6.100 1.00 10.86 C ATOM 641 CD2 PHE A 47 40.231 25.491 5.515 1.00 12.37 C ATOM 642 CE1 PHE A 47 42.153 26.463 7.294 1.00 13.43 C ATOM 643 CE2 PHE A 47 40.481 24.801 6.711 1.00 14.95 C ATOM 644 CZ PHE A 47 41.454 25.291 7.575 1.00 14.18 C ATOM 645 HA PHE A 47 42.287 28.715 3.748 1.00 0.00 H ATOM 646 HB2 PHE A 47 39.518 27.462 3.848 1.00 0.00 H ATOM 647 HB3 PHE A 47 40.967 26.736 3.114 1.00 0.00 H ATOM 648 HD2 PHE A 47 39.500 25.101 4.807 1.00 0.00 H ATOM 649 HE2 PHE A 47 39.923 23.898 6.958 1.00 0.00 H ATOM 650 HZ PHE A 47 41.675 24.746 8.493 1.00 0.00 H ATOM 651 HE1 PHE A 47 42.898 26.848 7.990 1.00 0.00 H ATOM 652 HD1 PHE A 47 42.434 28.038 5.854 1.00 0.00 H ATOM 653 H PHE A 47 39.917 29.416 5.332 1.00 0.00 H ATOM 654 N GLU A 48 40.132 30.427 2.353 1.00 15.10 N ATOM 655 CA GLU A 48 39.716 31.034 1.104 1.00 18.17 C ATOM 656 C GLU A 48 40.892 31.430 0.226 1.00 18.08 C ATOM 657 O GLU A 48 41.883 32.062 0.664 1.00 17.20 O ATOM 658 CB GLU A 48 38.779 32.207 1.468 1.00 23.04 C ATOM 659 CG GLU A 48 37.448 31.582 1.946 1.00 31.07 C ATOM 660 CD GLU A 48 36.395 32.590 2.382 1.00 31.30 C ATOM 661 OE1 GLU A 48 36.765 33.795 2.454 1.00 35.73 O ATOM 662 OE2 GLU A 48 35.256 32.100 2.631 1.00 35.90 O ATOM 663 HA GLU A 48 39.175 30.318 0.485 1.00 0.00 H ATOM 664 HB2 GLU A 48 39.220 32.807 2.264 1.00 0.00 H ATOM 665 HB3 GLU A 48 38.607 32.835 0.594 1.00 0.00 H ATOM 666 HG2 GLU A 48 37.036 30.992 1.127 1.00 0.00 H ATOM 667 HG3 GLU A 48 37.663 30.928 2.791 1.00 0.00 H ATOM 668 H GLU A 48 39.896 30.888 3.255 1.00 0.00 H ATOM 669 N GLY A 49 40.793 31.004 -1.064 1.00 18.32 N ATOM 670 CA GLY A 49 41.839 31.319 -2.035 1.00 19.76 C ATOM 671 C GLY A 49 42.997 30.316 -2.080 1.00 21.37 C ATOM 672 O GLY A 49 43.945 30.500 -2.853 1.00 22.40 O ATOM 673 HA3 GLY A 49 42.248 32.299 -1.788 1.00 0.00 H ATOM 674 HA2 GLY A 49 41.383 31.356 -3.025 1.00 0.00 H ATOM 675 H GLY A 49 39.965 30.449 -1.361 1.00 0.00 H ATOM 676 N PHE A 50 42.910 29.261 -1.260 1.00 19.23 N ATOM 677 CA PHE A 50 43.918 28.241 -1.216 1.00 15.94 C ATOM 678 C PHE A 50 43.446 27.010 -1.979 1.00 13.97 C ATOM 679 O PHE A 50 42.300 26.580 -1.797 1.00 14.43 O ATOM 680 CB PHE A 50 44.191 27.816 0.257 1.00 19.03 C ATOM 681 CG PHE A 50 45.035 28.923 0.825 1.00 13.05 C ATOM 682 CD1 PHE A 50 46.336 29.077 0.379 1.00 11.40 C ATOM 683 CD2 PHE A 50 44.501 29.798 1.739 1.00 9.83 C ATOM 684 CE1 PHE A 50 47.112 30.125 0.874 1.00 15.23 C ATOM 685 CE2 PHE A 50 45.269 30.836 2.254 1.00 14.77 C ATOM 686 CZ PHE A 50 46.576 31.004 1.818 1.00 17.58 C ATOM 687 HA PHE A 50 44.826 28.643 -1.666 1.00 0.00 H ATOM 688 HB2 PHE A 50 43.256 27.723 0.810 1.00 0.00 H ATOM 689 HB3 PHE A 50 44.727 26.868 0.290 1.00 0.00 H ATOM 690 HD2 PHE A 50 43.467 29.678 2.063 1.00 0.00 H ATOM 691 HE2 PHE A 50 44.847 31.514 2.996 1.00 0.00 H ATOM 692 HZ PHE A 50 47.183 31.820 2.211 1.00 0.00 H ATOM 693 HE1 PHE A 50 48.136 30.258 0.524 1.00 0.00 H ATOM 694 HD1 PHE A 50 46.751 28.385 -0.353 1.00 0.00 H ATOM 695 H PHE A 50 42.084 29.178 -0.634 1.00 0.00 H ATOM 696 N ASP A 51 44.354 26.467 -2.786 1.00 11.61 N ATOM 697 CA ASP A 51 43.996 25.279 -3.536 1.00 9.57 C ATOM 698 C ASP A 51 44.153 24.048 -2.637 1.00 10.27 C ATOM 699 O ASP A 51 43.531 23.025 -2.895 1.00 8.68 O ATOM 700 CB ASP A 51 44.960 25.049 -4.743 1.00 14.55 C ATOM 701 CG ASP A 51 44.762 26.256 -5.683 1.00 17.36 C ATOM 702 OD1 ASP A 51 43.621 26.356 -6.177 1.00 21.80 O ATOM 703 OD2 ASP A 51 45.706 27.061 -5.797 1.00 17.74 O ATOM 704 HA ASP A 51 42.973 25.418 -3.886 1.00 0.00 H ATOM 705 HB2 ASP A 51 45.993 25.002 -4.399 1.00 0.00 H ATOM 706 HB3 ASP A 51 44.708 24.122 -5.258 1.00 0.00 H ATOM 707 H ASP A 51 45.301 26.886 -2.877 1.00 0.00 H ATOM 708 N LEU A 52 45.044 24.221 -1.655 1.00 11.72 N ATOM 709 CA LEU A 52 45.373 23.165 -0.740 1.00 11.60 C ATOM 710 C LEU A 52 45.658 23.778 0.655 1.00 7.39 C ATOM 711 O LEU A 52 46.301 24.784 0.813 1.00 9.84 O ATOM 712 CB LEU A 52 46.709 22.467 -1.068 1.00 10.71 C ATOM 713 CG LEU A 52 47.081 20.997 -0.917 1.00 17.45 C ATOM 714 CD1 LEU A 52 48.588 20.875 -0.668 1.00 15.91 C ATOM 715 CD2 LEU A 52 46.293 20.027 -0.066 1.00 10.85 C ATOM 716 HA LEU A 52 44.534 22.471 -0.791 1.00 0.00 H ATOM 717 HB2 LEU A 52 46.877 22.683 -2.123 1.00 0.00 H ATOM 718 HB3 LEU A 52 47.448 22.998 -0.468 1.00 0.00 H ATOM 719 HG LEU A 52 46.744 20.621 -1.883 1.00 0.00 H ATOM 720 HD21 LEU A 52 46.289 20.373 0.968 1.00 0.00 H ATOM 721 HD22 LEU A 52 45.269 19.970 -0.435 1.00 0.00 H ATOM 722 HD23 LEU A 52 46.755 19.041 -0.119 1.00 0.00 H ATOM 723 HD11 LEU A 52 49.130 21.303 -1.511 1.00 0.00 H ATOM 724 HD12 LEU A 52 48.849 21.412 0.244 1.00 0.00 H ATOM 725 HD13 LEU A 52 48.853 19.823 -0.560 1.00 0.00 H ATOM 726 H LEU A 52 45.511 25.145 -1.551 1.00 0.00 H ATOM 727 N VAL A 53 45.127 23.020 1.631 1.00 12.72 N ATOM 728 CA VAL A 53 45.358 23.453 3.031 1.00 10.83 C ATOM 729 C VAL A 53 45.877 22.210 3.763 1.00 8.19 C ATOM 730 O VAL A 53 45.320 21.105 3.765 1.00 10.33 O ATOM 731 CB VAL A 53 44.108 24.077 3.669 1.00 14.00 C ATOM 732 CG1 VAL A 53 44.441 24.456 5.147 1.00 5.53 C ATOM 733 CG2 VAL A 53 43.631 25.324 2.947 1.00 5.08 C ATOM 734 HA VAL A 53 46.089 24.260 3.090 1.00 0.00 H ATOM 735 HB VAL A 53 43.308 23.339 3.607 1.00 0.00 H ATOM 736 HG11 VAL A 53 44.730 23.559 5.695 1.00 0.00 H ATOM 737 HG12 VAL A 53 45.263 25.172 5.161 1.00 0.00 H ATOM 738 HG13 VAL A 53 43.562 24.901 5.614 1.00 0.00 H ATOM 739 HG21 VAL A 53 44.420 26.075 2.962 1.00 0.00 H ATOM 740 HG22 VAL A 53 43.386 25.073 1.915 1.00 0.00 H ATOM 741 HG23 VAL A 53 42.745 25.716 3.447 1.00 0.00 H ATOM 742 H VAL A 53 44.577 22.165 1.413 1.00 0.00 H ATOM 743 N LEU A 54 47.032 22.317 4.410 1.00 13.93 N ATOM 744 CA LEU A 54 47.732 21.303 5.197 1.00 11.82 C ATOM 745 C LEU A 54 47.716 21.770 6.686 1.00 12.15 C ATOM 746 O LEU A 54 48.257 22.820 7.032 1.00 11.32 O ATOM 747 CB LEU A 54 49.169 21.098 4.695 1.00 7.66 C ATOM 748 CG LEU A 54 49.203 20.602 3.200 1.00 11.85 C ATOM 749 CD1 LEU A 54 50.672 20.490 2.797 1.00 9.76 C ATOM 750 CD2 LEU A 54 48.406 19.337 2.984 1.00 3.87 C ATOM 751 HA LEU A 54 47.231 20.340 5.097 1.00 0.00 H ATOM 752 HB2 LEU A 54 49.706 22.044 4.765 1.00 0.00 H ATOM 753 HB3 LEU A 54 49.660 20.356 5.324 1.00 0.00 H ATOM 754 HG LEU A 54 48.706 21.320 2.547 1.00 0.00 H ATOM 755 HD21 LEU A 54 48.813 18.542 3.608 1.00 0.00 H ATOM 756 HD22 LEU A 54 47.365 19.515 3.253 1.00 0.00 H ATOM 757 HD23 LEU A 54 48.467 19.045 1.936 1.00 0.00 H ATOM 758 HD11 LEU A 54 51.148 21.466 2.890 1.00 0.00 H ATOM 759 HD12 LEU A 54 51.173 19.776 3.451 1.00 0.00 H ATOM 760 HD13 LEU A 54 50.739 20.148 1.764 1.00 0.00 H ATOM 761 H LEU A 54 47.500 23.244 4.349 1.00 0.00 H ATOM 762 N LEU A 55 47.040 21.016 7.544 1.00 9.09 N ATOM 763 CA LEU A 55 46.898 21.340 8.969 1.00 11.15 C ATOM 764 C LEU A 55 47.787 20.394 9.783 1.00 6.61 C ATOM 765 O LEU A 55 47.673 19.175 9.695 1.00 10.36 O ATOM 766 CB LEU A 55 45.412 21.281 9.414 1.00 7.64 C ATOM 767 CG LEU A 55 44.413 22.177 8.681 1.00 10.50 C ATOM 768 CD1 LEU A 55 42.991 21.984 9.215 1.00 12.34 C ATOM 769 CD2 LEU A 55 44.828 23.660 8.666 1.00 17.10 C ATOM 770 HA LEU A 55 47.226 22.364 9.147 1.00 0.00 H ATOM 771 HB2 LEU A 55 45.076 20.251 9.292 1.00 0.00 H ATOM 772 HB3 LEU A 55 45.377 21.550 10.470 1.00 0.00 H ATOM 773 HG LEU A 55 44.421 21.857 7.639 1.00 0.00 H ATOM 774 HD21 LEU A 55 44.909 24.024 9.690 1.00 0.00 H ATOM 775 HD22 LEU A 55 45.791 23.761 8.166 1.00 0.00 H ATOM 776 HD23 LEU A 55 44.077 24.241 8.131 1.00 0.00 H ATOM 777 HD11 LEU A 55 42.690 20.945 9.077 1.00 0.00 H ATOM 778 HD12 LEU A 55 42.966 22.233 10.276 1.00 0.00 H ATOM 779 HD13 LEU A 55 42.308 22.637 8.671 1.00 0.00 H ATOM 780 H LEU A 55 46.587 20.150 7.188 1.00 0.00 H ATOM 781 N GLY A 56 48.706 20.974 10.531 1.00 7.32 N ATOM 782 CA GLY A 56 49.616 20.174 11.370 1.00 8.81 C ATOM 783 C GLY A 56 49.337 20.492 12.856 1.00 10.66 C ATOM 784 O GLY A 56 49.147 21.643 13.289 1.00 8.96 O ATOM 785 HA3 GLY A 56 50.650 20.424 11.130 1.00 0.00 H ATOM 786 HA2 GLY A 56 49.447 19.113 11.185 1.00 0.00 H ATOM 787 H GLY A 56 48.790 22.011 10.529 1.00 0.00 H ATOM 788 N CYS A 57 49.306 19.400 13.607 1.00 6.68 N ATOM 789 CA CYS A 57 49.049 19.586 15.046 1.00 7.59 C ATOM 790 C CYS A 57 49.651 18.483 15.917 1.00 6.77 C ATOM 791 O CYS A 57 49.366 17.312 15.628 1.00 9.12 O ATOM 792 CB CYS A 57 47.515 19.588 15.212 1.00 6.45 C ATOM 793 SG CYS A 57 47.077 20.177 16.861 1.00 10.09 S ATOM 794 HA CYS A 57 49.516 20.514 15.374 1.00 0.00 H ATOM 795 HB2 CYS A 57 47.135 18.575 15.077 1.00 0.00 H ATOM 796 HB3 CYS A 57 47.071 20.244 14.464 1.00 0.00 H ATOM 797 HG CYS A 57 47.637 19.345 17.809 1.00 0.00 H ATOM 798 H CYS A 57 49.456 18.455 13.199 1.00 0.00 H ATOM 799 N SER A 58 50.416 18.810 16.969 1.00 9.59 N ATOM 800 CA SER A 58 50.945 17.790 17.886 1.00 8.05 C ATOM 801 C SER A 58 49.809 17.287 18.796 1.00 6.62 C ATOM 802 O SER A 58 48.795 18.005 18.928 1.00 6.86 O ATOM 803 CB SER A 58 52.105 18.276 18.724 1.00 5.38 C ATOM 804 OG SER A 58 51.915 19.562 19.305 1.00 8.79 O ATOM 805 HA SER A 58 51.334 16.978 17.271 1.00 0.00 H ATOM 806 HB2 SER A 58 52.991 18.316 18.090 1.00 0.00 H ATOM 807 HB3 SER A 58 52.268 17.559 19.529 1.00 0.00 H ATOM 808 HG SER A 58 52.715 19.805 19.835 1.00 0.00 H ATOM 809 H SER A 58 50.641 19.811 17.140 1.00 0.00 H ATOM 810 N THR A 59 49.952 16.090 19.399 1.00 4.88 N ATOM 811 CA THR A 59 48.911 15.512 20.244 1.00 6.22 C ATOM 812 C THR A 59 49.399 15.563 21.696 1.00 8.85 C ATOM 813 O THR A 59 50.604 15.377 21.946 1.00 5.34 O ATOM 814 CB THR A 59 48.565 14.049 19.889 1.00 8.52 C ATOM 815 OG1 THR A 59 48.248 13.985 18.485 1.00 7.45 O ATOM 816 CG2 THR A 59 47.390 13.502 20.701 1.00 3.98 C ATOM 817 HA THR A 59 48.003 16.094 20.088 1.00 0.00 H ATOM 818 HB THR A 59 49.430 13.432 20.131 1.00 0.00 H ATOM 819 HG1 THR A 59 49.030 14.287 17.957 1.00 0.00 H ATOM 820 HG23 THR A 59 47.630 13.551 21.763 1.00 0.00 H ATOM 821 HG21 THR A 59 46.501 14.101 20.500 1.00 0.00 H ATOM 822 HG22 THR A 59 47.204 12.466 20.416 1.00 0.00 H ATOM 823 H THR A 59 50.835 15.559 19.257 1.00 0.00 H ATOM 824 N TRP A 60 48.499 15.917 22.616 1.00 8.89 N ATOM 825 CA TRP A 60 48.781 16.073 24.041 1.00 8.98 C ATOM 826 C TRP A 60 47.778 15.230 24.760 1.00 9.44 C ATOM 827 O TRP A 60 46.939 14.559 24.125 1.00 5.38 O ATOM 828 CB TRP A 60 48.687 17.605 24.431 1.00 9.45 C ATOM 829 CG TRP A 60 49.821 18.256 23.668 1.00 9.83 C ATOM 830 CD1 TRP A 60 49.776 18.753 22.386 1.00 1.90 C ATOM 831 CD2 TRP A 60 51.195 18.277 24.080 1.00 9.80 C ATOM 832 NE1 TRP A 60 51.041 19.126 21.996 1.00 7.21 N ATOM 833 CE2 TRP A 60 51.929 18.852 23.018 1.00 9.41 C ATOM 834 CE3 TRP A 60 51.878 17.882 25.257 1.00 4.31 C ATOM 835 CZ2 TRP A 60 53.307 19.036 23.084 1.00 7.60 C ATOM 836 CZ3 TRP A 60 53.251 18.104 25.311 1.00 10.00 C ATOM 837 CH2 TRP A 60 53.959 18.671 24.230 1.00 14.27 C ATOM 838 HA TRP A 60 49.786 15.750 24.311 1.00 0.00 H ATOM 839 HB2 TRP A 60 47.727 18.023 24.127 1.00 0.00 H ATOM 840 HB3 TRP A 60 48.817 17.739 25.505 1.00 0.00 H ATOM 841 HE1 TRP A 60 51.289 19.547 21.078 1.00 0.00 H ATOM 842 HD1 TRP A 60 48.878 18.838 21.775 1.00 0.00 H ATOM 843 HZ2 TRP A 60 53.854 19.461 22.242 1.00 0.00 H ATOM 844 HH2 TRP A 60 55.036 18.820 24.309 1.00 0.00 H ATOM 845 HZ3 TRP A 60 53.796 17.832 26.215 1.00 0.00 H ATOM 846 HE3 TRP A 60 51.347 17.421 26.090 1.00 0.00 H ATOM 847 H TRP A 60 47.526 16.095 22.295 1.00 0.00 H ATOM 848 N GLY A 61 47.851 15.242 26.086 1.00 11.37 N ATOM 849 CA GLY A 61 46.899 14.403 26.798 1.00 8.84 C ATOM 850 C GLY A 61 47.593 13.049 27.055 1.00 11.64 C ATOM 851 O GLY A 61 48.670 12.565 26.758 1.00 10.16 O ATOM 852 HA3 GLY A 61 46.004 14.256 26.193 1.00 0.00 H ATOM 853 HA2 GLY A 61 46.624 14.869 27.745 1.00 0.00 H ATOM 854 H GLY A 61 48.553 15.821 26.590 1.00 0.00 H ATOM 855 N ASP A 62 46.783 12.306 27.789 1.00 12.35 N ATOM 856 CA ASP A 62 47.150 10.953 28.256 1.00 16.68 C ATOM 857 C ASP A 62 45.991 10.028 27.929 1.00 17.57 C ATOM 858 O ASP A 62 46.031 9.251 26.951 1.00 20.23 O ATOM 859 CB ASP A 62 47.551 11.245 29.679 1.00 21.85 C ATOM 860 CG ASP A 62 47.722 10.108 30.620 1.00 34.73 C ATOM 861 OD1 ASP A 62 47.866 8.973 30.119 1.00 39.20 O ATOM 862 OD2 ASP A 62 47.691 10.410 31.839 1.00 47.84 O ATOM 863 HA ASP A 62 47.972 10.401 27.801 1.00 0.00 H ATOM 864 HB2 ASP A 62 48.502 11.777 29.642 1.00 0.00 H ATOM 865 HB3 ASP A 62 46.787 11.898 30.100 1.00 0.00 H ATOM 866 H ASP A 62 45.851 12.688 28.048 1.00 0.00 H ATOM 867 N ASP A 63 44.871 10.075 28.625 1.00 14.64 N ATOM 868 CA ASP A 63 43.676 9.254 28.441 1.00 18.31 C ATOM 869 C ASP A 63 42.609 9.881 27.540 1.00 17.32 C ATOM 870 O ASP A 63 41.486 9.469 27.277 1.00 18.64 O ATOM 871 CB ASP A 63 42.995 9.141 29.831 1.00 34.81 C ATOM 872 CG ASP A 63 43.700 8.377 30.942 1.00 41.09 C ATOM 873 OD1 ASP A 63 44.392 7.375 30.625 1.00 44.29 O ATOM 874 OD2 ASP A 63 43.577 8.769 32.147 1.00 42.39 O ATOM 875 HA ASP A 63 44.007 8.318 27.990 1.00 0.00 H ATOM 876 HB2 ASP A 63 42.838 10.157 30.193 1.00 0.00 H ATOM 877 HB3 ASP A 63 42.030 8.659 29.675 1.00 0.00 H ATOM 878 H ASP A 63 44.834 10.776 29.392 1.00 0.00 H ATOM 879 N SER A 64 42.916 11.079 27.080 1.00 17.30 N ATOM 880 CA SER A 64 42.071 11.891 26.248 1.00 17.71 C ATOM 881 C SER A 64 42.943 12.547 25.169 1.00 20.36 C ATOM 882 O SER A 64 44.092 12.840 25.443 1.00 19.72 O ATOM 883 CB SER A 64 41.447 12.964 27.104 1.00 21.27 C ATOM 884 OG SER A 64 41.664 14.320 26.802 1.00 36.18 O ATOM 885 HA SER A 64 41.291 11.288 25.782 1.00 0.00 H ATOM 886 HB2 SER A 64 41.809 12.806 28.120 1.00 0.00 H ATOM 887 HB3 SER A 64 40.369 12.803 27.074 1.00 0.00 H ATOM 888 HG SER A 64 41.185 14.884 27.460 1.00 0.00 H ATOM 889 H SER A 64 43.845 11.467 27.341 1.00 0.00 H ATOM 890 N ILE A 65 42.391 12.727 23.980 1.00 14.92 N ATOM 891 CA ILE A 65 43.166 13.440 22.967 1.00 11.18 C ATOM 892 C ILE A 65 43.038 14.923 23.308 1.00 8.54 C ATOM 893 O ILE A 65 41.956 15.493 23.498 1.00 7.65 O ATOM 894 CB ILE A 65 42.520 13.181 21.566 1.00 9.87 C ATOM 895 CG1 ILE A 65 42.681 11.712 21.233 1.00 8.74 C ATOM 896 CG2 ILE A 65 43.156 14.148 20.558 1.00 9.02 C ATOM 897 CD1 ILE A 65 41.741 11.219 20.153 1.00 10.71 C ATOM 898 HA ILE A 65 44.207 13.118 22.946 1.00 0.00 H ATOM 899 HB ILE A 65 41.449 13.381 21.544 1.00 0.00 H ATOM 900 HG12 ILE A 65 43.705 11.546 20.898 1.00 0.00 H ATOM 901 HG13 ILE A 65 42.498 11.133 22.138 1.00 0.00 H ATOM 902 HD11 ILE A 65 40.710 11.365 20.476 1.00 0.00 H ATOM 903 HD12 ILE A 65 41.919 11.779 19.235 1.00 0.00 H ATOM 904 HD13 ILE A 65 41.920 10.159 19.974 1.00 0.00 H ATOM 905 HG21 ILE A 65 42.969 15.174 20.873 1.00 0.00 H ATOM 906 HG22 ILE A 65 44.231 13.970 20.514 1.00 0.00 H ATOM 907 HG23 ILE A 65 42.719 13.984 19.573 1.00 0.00 H ATOM 908 H ILE A 65 41.436 12.372 23.773 1.00 0.00 H ATOM 909 N GLU A 66 44.148 15.650 23.367 1.00 10.57 N ATOM 910 CA GLU A 66 44.193 17.075 23.580 1.00 10.49 C ATOM 911 C GLU A 66 45.010 17.573 22.370 1.00 12.21 C ATOM 912 O GLU A 66 46.043 17.030 21.982 1.00 11.10 O ATOM 913 CB GLU A 66 44.888 17.584 24.867 1.00 8.29 C ATOM 914 CG GLU A 66 43.913 17.320 26.050 1.00 16.03 C ATOM 915 CD GLU A 66 44.561 17.425 27.402 1.00 14.69 C ATOM 916 OE1 GLU A 66 45.765 17.605 27.480 1.00 20.18 O ATOM 917 OE2 GLU A 66 43.917 17.290 28.453 1.00 17.12 O ATOM 918 HA GLU A 66 43.171 17.439 23.689 1.00 0.00 H ATOM 919 HB2 GLU A 66 45.822 17.046 25.025 1.00 0.00 H ATOM 920 HB3 GLU A 66 45.094 18.651 24.784 1.00 0.00 H ATOM 921 HG2 GLU A 66 43.104 18.048 25.998 1.00 0.00 H ATOM 922 HG3 GLU A 66 43.504 16.316 25.941 1.00 0.00 H ATOM 923 H GLU A 66 45.054 15.153 23.251 1.00 0.00 H ATOM 924 N LEU A 67 44.541 18.599 21.713 1.00 13.47 N ATOM 925 CA LEU A 67 45.188 19.239 20.583 1.00 10.70 C ATOM 926 C LEU A 67 46.208 20.236 21.097 1.00 11.97 C ATOM 927 O LEU A 67 45.970 20.815 22.154 1.00 10.95 O ATOM 928 CB LEU A 67 44.154 20.127 19.852 1.00 15.18 C ATOM 929 CG LEU A 67 43.397 19.459 18.713 1.00 17.64 C ATOM 930 CD1 LEU A 67 43.086 18.020 18.989 1.00 18.07 C ATOM 931 CD2 LEU A 67 42.170 20.296 18.390 1.00 13.29 C ATOM 932 HA LEU A 67 45.621 18.464 19.951 1.00 0.00 H ATOM 933 HB2 LEU A 67 43.423 20.465 20.587 1.00 0.00 H ATOM 934 HB3 LEU A 67 44.682 20.989 19.443 1.00 0.00 H ATOM 935 HG LEU A 67 44.033 19.424 17.828 1.00 0.00 H ATOM 936 HD21 LEU A 67 41.533 20.360 19.272 1.00 0.00 H ATOM 937 HD22 LEU A 67 42.483 21.297 18.092 1.00 0.00 H ATOM 938 HD23 LEU A 67 41.617 19.829 17.575 1.00 0.00 H ATOM 939 HD11 LEU A 67 44.016 17.471 19.139 1.00 0.00 H ATOM 940 HD12 LEU A 67 42.471 17.948 19.886 1.00 0.00 H ATOM 941 HD13 LEU A 67 42.546 17.597 18.142 1.00 0.00 H ATOM 942 H LEU A 67 43.629 18.990 22.025 1.00 0.00 H ATOM 943 N GLN A 68 47.264 20.462 20.376 1.00 9.43 N ATOM 944 CA GLN A 68 48.285 21.432 20.740 1.00 11.21 C ATOM 945 C GLN A 68 47.524 22.727 21.024 1.00 12.19 C ATOM 946 O GLN A 68 46.657 23.183 20.297 1.00 13.81 O ATOM 947 CB GLN A 68 49.278 21.580 19.597 1.00 6.40 C ATOM 948 CG GLN A 68 50.575 22.261 20.018 1.00 5.79 C ATOM 949 CD GLN A 68 50.406 23.774 19.940 1.00 2.50 C ATOM 950 OE1 GLN A 68 51.110 24.563 20.591 1.00 11.95 O ATOM 951 NE2 GLN A 68 49.426 24.151 19.137 1.00 4.17 N ATOM 952 HA GLN A 68 48.869 21.136 21.611 1.00 0.00 H ATOM 953 HB2 GLN A 68 49.515 20.588 19.212 1.00 0.00 H ATOM 954 HB3 GLN A 68 48.814 22.173 18.808 1.00 0.00 H ATOM 955 HG2 GLN A 68 50.820 21.975 21.041 1.00 0.00 H ATOM 956 HG3 GLN A 68 51.381 21.951 19.353 1.00 0.00 H ATOM 957 HE22 GLN A 68 48.874 23.437 18.620 1.00 0.00 H ATOM 958 HE21 GLN A 68 49.207 25.161 19.022 1.00 0.00 H ATOM 959 H GLN A 68 47.386 19.923 19.495 1.00 0.00 H ATOM 960 N ASP A 69 47.935 23.376 22.117 1.00 10.37 N ATOM 961 CA ASP A 69 47.311 24.574 22.620 1.00 9.73 C ATOM 962 C ASP A 69 47.019 25.665 21.639 1.00 7.43 C ATOM 963 O ASP A 69 45.962 26.296 21.623 1.00 9.18 O ATOM 964 CB ASP A 69 48.226 25.120 23.773 1.00 8.34 C ATOM 965 CG ASP A 69 47.400 26.202 24.456 1.00 17.63 C ATOM 966 OD1 ASP A 69 46.362 25.847 25.105 1.00 19.97 O ATOM 967 OD2 ASP A 69 47.792 27.381 24.262 1.00 14.73 O ATOM 968 HA ASP A 69 46.315 24.276 22.948 1.00 0.00 H ATOM 969 HB2 ASP A 69 48.472 24.324 24.476 1.00 0.00 H ATOM 970 HB3 ASP A 69 49.146 25.540 23.366 1.00 0.00 H ATOM 971 H ASP A 69 48.752 22.995 22.635 1.00 0.00 H ATOM 972 N ASP A 70 47.930 26.019 20.738 1.00 10.87 N ATOM 973 CA ASP A 70 47.739 27.092 19.758 1.00 6.09 C ATOM 974 C ASP A 70 46.762 26.711 18.659 1.00 8.68 C ATOM 975 O ASP A 70 46.232 27.626 18.047 1.00 13.00 O ATOM 976 CB ASP A 70 49.087 27.374 19.053 1.00 7.05 C ATOM 977 CG ASP A 70 50.123 27.907 20.029 1.00 12.18 C ATOM 978 OD1 ASP A 70 49.759 28.881 20.748 1.00 15.42 O ATOM 979 OD2 ASP A 70 51.267 27.433 20.116 1.00 10.56 O ATOM 980 HA ASP A 70 47.354 27.952 20.306 1.00 0.00 H ATOM 981 HB2 ASP A 70 49.458 26.448 18.613 1.00 0.00 H ATOM 982 HB3 ASP A 70 48.928 28.111 18.266 1.00 0.00 H ATOM 983 H ASP A 70 48.833 25.503 20.728 1.00 0.00 H ATOM 984 N PHE A 71 46.583 25.410 18.445 1.00 10.93 N ATOM 985 CA PHE A 71 45.676 24.953 17.417 1.00 5.86 C ATOM 986 C PHE A 71 44.229 24.934 17.847 1.00 13.56 C ATOM 987 O PHE A 71 43.258 24.949 17.078 1.00 7.37 O ATOM 988 CB PHE A 71 46.106 23.502 17.064 1.00 6.07 C ATOM 989 CG PHE A 71 45.624 23.265 15.624 1.00 11.68 C ATOM 990 CD1 PHE A 71 44.340 22.771 15.398 1.00 7.21 C ATOM 991 CD2 PHE A 71 46.494 23.539 14.571 1.00 13.80 C ATOM 992 CE1 PHE A 71 43.857 22.564 14.126 1.00 11.50 C ATOM 993 CE2 PHE A 71 46.015 23.315 13.267 1.00 9.68 C ATOM 994 CZ PHE A 71 44.727 22.848 13.064 1.00 11.98 C ATOM 995 HA PHE A 71 45.735 25.643 16.575 1.00 0.00 H ATOM 996 HB2 PHE A 71 47.190 23.401 17.124 1.00 0.00 H ATOM 997 HB3 PHE A 71 45.638 22.790 17.744 1.00 0.00 H ATOM 998 HD2 PHE A 71 47.503 23.911 14.750 1.00 0.00 H ATOM 999 HE2 PHE A 71 46.662 23.510 12.411 1.00 0.00 H ATOM 1000 HZ PHE A 71 44.378 22.696 12.043 1.00 0.00 H ATOM 1001 HE1 PHE A 71 42.846 22.197 13.952 1.00 0.00 H ATOM 1002 HD1 PHE A 71 43.702 22.543 16.251 1.00 0.00 H ATOM 1003 H PHE A 71 47.100 24.716 19.022 1.00 0.00 H ATOM 1004 N ILE A 72 44.021 24.880 19.171 1.00 11.62 N ATOM 1005 CA ILE A 72 42.657 24.824 19.707 1.00 15.38 C ATOM 1006 C ILE A 72 41.653 25.825 19.202 1.00 12.87 C ATOM 1007 O ILE A 72 40.514 25.454 18.790 1.00 12.31 O ATOM 1008 CB ILE A 72 42.729 24.628 21.257 1.00 12.58 C ATOM 1009 CG1 ILE A 72 43.293 23.245 21.603 1.00 9.19 C ATOM 1010 CG2 ILE A 72 41.333 24.732 21.866 1.00 20.06 C ATOM 1011 CD1 ILE A 72 43.540 23.048 23.105 1.00 13.51 C ATOM 1012 HA ILE A 72 42.187 23.945 19.266 1.00 0.00 H ATOM 1013 HB ILE A 72 43.379 25.405 21.659 1.00 0.00 H ATOM 1014 HG12 ILE A 72 42.584 22.488 21.266 1.00 0.00 H ATOM 1015 HG13 ILE A 72 44.239 23.115 21.077 1.00 0.00 H ATOM 1016 HD11 ILE A 72 44.256 23.792 23.455 1.00 0.00 H ATOM 1017 HD12 ILE A 72 42.600 23.164 23.645 1.00 0.00 H ATOM 1018 HD13 ILE A 72 43.939 22.048 23.278 1.00 0.00 H ATOM 1019 HG21 ILE A 72 40.916 25.715 21.649 1.00 0.00 H ATOM 1020 HG22 ILE A 72 40.693 23.961 21.437 1.00 0.00 H ATOM 1021 HG23 ILE A 72 41.398 24.594 22.945 1.00 0.00 H ATOM 1022 H ILE A 72 44.832 24.878 19.822 1.00 0.00 H ATOM 1023 N PRO A 73 41.856 27.136 19.206 1.00 15.03 N ATOM 1024 CA PRO A 73 40.921 28.141 18.713 1.00 15.65 C ATOM 1025 C PRO A 73 40.587 27.892 17.239 1.00 15.92 C ATOM 1026 O PRO A 73 39.401 27.916 16.875 1.00 14.13 O ATOM 1027 CB PRO A 73 41.492 29.537 18.997 1.00 14.24 C ATOM 1028 CG PRO A 73 42.618 29.201 19.915 1.00 14.87 C ATOM 1029 CD PRO A 73 43.080 27.776 19.662 1.00 12.09 C ATOM 1030 HA PRO A 73 39.969 28.072 19.239 1.00 0.00 H ATOM 1031 HD3 PRO A 73 43.855 27.741 18.896 1.00 0.00 H ATOM 1032 HD2 PRO A 73 43.453 27.312 20.575 1.00 0.00 H ATOM 1033 HG3 PRO A 73 42.284 29.295 20.948 1.00 0.00 H ATOM 1034 HG2 PRO A 73 43.446 29.887 19.738 1.00 0.00 H ATOM 1035 HB2 PRO A 73 41.848 30.018 18.086 1.00 0.00 H ATOM 1036 HB3 PRO A 73 40.757 30.180 19.482 1.00 0.00 H ATOM 1037 N LEU A 74 41.593 27.626 16.385 1.00 13.84 N ATOM 1038 CA LEU A 74 41.293 27.292 14.984 1.00 10.63 C ATOM 1039 C LEU A 74 40.395 26.066 14.877 1.00 11.06 C ATOM 1040 O LEU A 74 39.358 25.976 14.195 1.00 10.50 O ATOM 1041 CB LEU A 74 42.636 27.064 14.220 1.00 11.47 C ATOM 1042 CG LEU A 74 42.454 26.641 12.735 1.00 8.19 C ATOM 1043 CD1 LEU A 74 41.496 27.593 12.016 1.00 9.39 C ATOM 1044 CD2 LEU A 74 43.861 26.576 12.157 1.00 11.50 C ATOM 1045 HA LEU A 74 40.749 28.122 14.533 1.00 0.00 H ATOM 1046 HB2 LEU A 74 43.207 27.992 14.245 1.00 0.00 H ATOM 1047 HB3 LEU A 74 43.195 26.282 14.734 1.00 0.00 H ATOM 1048 HG LEU A 74 41.979 25.667 12.614 1.00 0.00 H ATOM 1049 HD21 LEU A 74 44.331 27.556 12.238 1.00 0.00 H ATOM 1050 HD22 LEU A 74 44.447 25.843 12.712 1.00 0.00 H ATOM 1051 HD23 LEU A 74 43.809 26.282 11.109 1.00 0.00 H ATOM 1052 HD11 LEU A 74 40.525 27.572 12.511 1.00 0.00 H ATOM 1053 HD12 LEU A 74 41.899 28.605 12.048 1.00 0.00 H ATOM 1054 HD13 LEU A 74 41.383 27.278 10.979 1.00 0.00 H ATOM 1055 H LEU A 74 42.579 27.656 16.714 1.00 0.00 H ATOM 1056 N PHE A 75 40.673 24.934 15.547 1.00 8.34 N ATOM 1057 CA PHE A 75 39.851 23.759 15.487 1.00 9.04 C ATOM 1058 C PHE A 75 38.433 24.078 15.953 1.00 15.79 C ATOM 1059 O PHE A 75 37.430 23.583 15.411 1.00 12.98 O ATOM 1060 CB PHE A 75 40.458 22.633 16.365 1.00 9.03 C ATOM 1061 CG PHE A 75 39.594 21.419 16.522 1.00 11.46 C ATOM 1062 CD1 PHE A 75 38.668 21.318 17.561 1.00 12.50 C ATOM 1063 CD2 PHE A 75 39.704 20.361 15.665 1.00 8.72 C ATOM 1064 CE1 PHE A 75 37.873 20.195 17.647 1.00 15.17 C ATOM 1065 CE2 PHE A 75 38.952 19.225 15.795 1.00 8.36 C ATOM 1066 CZ PHE A 75 37.996 19.131 16.784 1.00 9.53 C ATOM 1067 HA PHE A 75 39.811 23.417 14.453 1.00 0.00 H ATOM 1068 HB2 PHE A 75 41.400 22.322 15.913 1.00 0.00 H ATOM 1069 HB3 PHE A 75 40.650 23.043 17.357 1.00 0.00 H ATOM 1070 HD2 PHE A 75 40.419 20.424 14.845 1.00 0.00 H ATOM 1071 HE2 PHE A 75 39.110 18.390 15.113 1.00 0.00 H ATOM 1072 HZ PHE A 75 37.363 18.249 16.878 1.00 0.00 H ATOM 1073 HE1 PHE A 75 37.117 20.148 18.430 1.00 0.00 H ATOM 1074 HD1 PHE A 75 38.574 22.118 18.296 1.00 0.00 H ATOM 1075 H PHE A 75 41.528 24.908 16.139 1.00 0.00 H ATOM 1076 N ASP A 76 38.304 24.858 17.040 1.00 16.69 N ATOM 1077 CA ASP A 76 37.005 25.222 17.613 1.00 15.87 C ATOM 1078 C ASP A 76 36.194 26.057 16.616 1.00 17.25 C ATOM 1079 O ASP A 76 34.957 25.998 16.609 1.00 18.49 O ATOM 1080 CB ASP A 76 37.150 26.029 18.933 1.00 16.17 C ATOM 1081 CG ASP A 76 37.603 25.216 20.145 1.00 18.69 C ATOM 1082 OD1 ASP A 76 37.569 23.962 20.046 1.00 18.02 O ATOM 1083 OD2 ASP A 76 38.043 25.827 21.162 1.00 20.39 O ATOM 1084 HA ASP A 76 36.489 24.287 17.833 1.00 0.00 H ATOM 1085 HB2 ASP A 76 37.880 26.821 18.766 1.00 0.00 H ATOM 1086 HB3 ASP A 76 36.182 26.472 19.166 1.00 0.00 H ATOM 1087 H ASP A 76 39.166 25.220 17.496 1.00 0.00 H ATOM 1088 N SER A 77 36.856 26.842 15.763 1.00 14.43 N ATOM 1089 CA SER A 77 36.142 27.629 14.748 1.00 15.42 C ATOM 1090 C SER A 77 36.425 27.087 13.350 1.00 14.32 C ATOM 1091 O SER A 77 36.374 27.821 12.349 1.00 14.51 O ATOM 1092 CB SER A 77 36.608 29.094 14.874 1.00 15.39 C ATOM 1093 OG SER A 77 35.984 29.704 15.992 1.00 22.40 O ATOM 1094 HA SER A 77 35.066 27.564 14.907 1.00 0.00 H ATOM 1095 HB2 SER A 77 36.340 29.638 13.968 1.00 0.00 H ATOM 1096 HB3 SER A 77 37.690 29.120 15.005 1.00 0.00 H ATOM 1097 HG SER A 77 36.229 29.211 16.815 1.00 0.00 H ATOM 1098 H SER A 77 37.893 26.897 15.818 1.00 0.00 H ATOM 1099 N LEU A 78 36.717 25.799 13.181 1.00 11.22 N ATOM 1100 CA LEU A 78 37.049 25.271 11.858 1.00 17.56 C ATOM 1101 C LEU A 78 35.929 25.379 10.829 1.00 19.16 C ATOM 1102 O LEU A 78 36.071 25.320 9.596 1.00 13.48 O ATOM 1103 CB LEU A 78 37.458 23.813 11.940 1.00 10.77 C ATOM 1104 CG LEU A 78 38.807 23.247 11.592 1.00 14.65 C ATOM 1105 CD1 LEU A 78 38.526 21.878 10.934 1.00 19.30 C ATOM 1106 CD2 LEU A 78 39.787 24.093 10.822 1.00 12.00 C ATOM 1107 HA LEU A 78 37.872 25.901 11.520 1.00 0.00 H ATOM 1108 HB2 LEU A 78 37.289 23.528 12.978 1.00 0.00 H ATOM 1109 HB3 LEU A 78 36.753 23.283 11.299 1.00 0.00 H ATOM 1110 HG LEU A 78 39.372 23.179 12.522 1.00 0.00 H ATOM 1111 HD21 LEU A 78 39.352 24.366 9.861 1.00 0.00 H ATOM 1112 HD22 LEU A 78 40.011 24.996 11.391 1.00 0.00 H ATOM 1113 HD23 LEU A 78 40.704 23.527 10.660 1.00 0.00 H ATOM 1114 HD11 LEU A 78 37.997 21.239 11.640 1.00 0.00 H ATOM 1115 HD12 LEU A 78 37.914 22.023 10.044 1.00 0.00 H ATOM 1116 HD13 LEU A 78 39.470 21.410 10.655 1.00 0.00 H ATOM 1117 H LEU A 78 36.709 25.159 14.001 1.00 0.00 H ATOM 1118 N GLU A 79 34.692 25.488 11.302 1.00 16.42 N ATOM 1119 CA GLU A 79 33.531 25.584 10.440 1.00 19.49 C ATOM 1120 C GLU A 79 33.490 26.944 9.771 1.00 19.58 C ATOM 1121 O GLU A 79 32.710 27.132 8.812 1.00 26.08 O ATOM 1122 CB GLU A 79 32.256 25.232 11.219 1.00 24.83 C ATOM 1123 CG GLU A 79 31.710 26.196 12.237 1.00 37.37 C ATOM 1124 CD GLU A 79 32.451 26.476 13.533 1.00 45.02 C ATOM 1125 OE1 GLU A 79 33.169 25.592 14.090 1.00 43.76 O ATOM 1126 OE2 GLU A 79 32.245 27.645 13.991 1.00 43.53 O ATOM 1127 HA GLU A 79 33.600 24.852 9.635 1.00 0.00 H ATOM 1128 HB2 GLU A 79 31.469 25.073 10.481 1.00 0.00 H ATOM 1129 HB3 GLU A 79 32.455 24.298 11.744 1.00 0.00 H ATOM 1130 HG2 GLU A 79 31.603 27.154 11.729 1.00 0.00 H ATOM 1131 HG3 GLU A 79 30.725 25.823 12.518 1.00 0.00 H ATOM 1132 H GLU A 79 34.551 25.505 12.332 1.00 0.00 H ATOM 1133 N GLU A 80 34.244 27.936 10.213 1.00 17.93 N ATOM 1134 CA GLU A 80 34.249 29.258 9.587 1.00 21.98 C ATOM 1135 C GLU A 80 35.383 29.440 8.575 1.00 16.02 C ATOM 1136 O GLU A 80 35.478 30.516 7.954 1.00 17.18 O ATOM 1137 CB GLU A 80 34.497 30.339 10.653 1.00 29.03 C ATOM 1138 CG GLU A 80 33.601 30.389 11.860 1.00 42.52 C ATOM 1139 CD GLU A 80 34.074 31.323 12.960 1.00 50.63 C ATOM 1140 OE1 GLU A 80 35.180 31.918 12.945 1.00 48.34 O ATOM 1141 OE2 GLU A 80 33.239 31.454 13.901 1.00 63.38 O ATOM 1142 HA GLU A 80 33.282 29.346 9.092 1.00 0.00 H ATOM 1143 HB2 GLU A 80 35.516 30.203 11.016 1.00 0.00 H ATOM 1144 HB3 GLU A 80 34.416 31.305 10.154 1.00 0.00 H ATOM 1145 HG2 GLU A 80 32.613 30.717 11.537 1.00 0.00 H ATOM 1146 HG3 GLU A 80 33.532 29.383 12.274 1.00 0.00 H ATOM 1147 H GLU A 80 34.857 27.770 11.037 1.00 0.00 H ATOM 1148 N THR A 81 36.277 28.479 8.430 1.00 17.87 N ATOM 1149 CA THR A 81 37.446 28.586 7.551 1.00 16.69 C ATOM 1150 C THR A 81 37.200 28.426 6.050 1.00 17.63 C ATOM 1151 O THR A 81 38.079 28.751 5.231 1.00 17.41 O ATOM 1152 CB THR A 81 38.467 27.523 7.960 1.00 11.54 C ATOM 1153 OG1 THR A 81 37.835 26.222 7.843 1.00 14.77 O ATOM 1154 CG2 THR A 81 39.028 27.689 9.351 1.00 8.62 C ATOM 1155 HA THR A 81 37.788 29.612 7.686 1.00 0.00 H ATOM 1156 HB THR A 81 39.320 27.630 7.290 1.00 0.00 H ATOM 1157 HG1 THR A 81 37.046 26.185 8.440 1.00 0.00 H ATOM 1158 HG23 THR A 81 39.502 28.667 9.436 1.00 0.00 H ATOM 1159 HG21 THR A 81 38.220 27.611 10.079 1.00 0.00 H ATOM 1160 HG22 THR A 81 39.765 26.909 9.539 1.00 0.00 H ATOM 1161 H THR A 81 36.145 27.599 8.968 1.00 0.00 H ATOM 1162 N GLY A 82 36.033 27.958 5.641 1.00 17.34 N ATOM 1163 CA GLY A 82 35.791 27.745 4.205 1.00 18.15 C ATOM 1164 C GLY A 82 36.355 26.377 3.839 1.00 16.26 C ATOM 1165 O GLY A 82 36.963 26.238 2.767 1.00 13.36 O ATOM 1166 HA3 GLY A 82 36.291 28.521 3.625 1.00 0.00 H ATOM 1167 HA2 GLY A 82 34.721 27.773 4.000 1.00 0.00 H ATOM 1168 H GLY A 82 35.287 27.741 6.333 1.00 0.00 H ATOM 1169 N ALA A 83 36.165 25.373 4.703 1.00 10.27 N ATOM 1170 CA ALA A 83 36.687 24.057 4.404 1.00 10.54 C ATOM 1171 C ALA A 83 35.812 23.215 3.495 1.00 12.04 C ATOM 1172 O ALA A 83 36.279 22.224 2.951 1.00 15.45 O ATOM 1173 CB ALA A 83 36.810 23.190 5.671 1.00 13.72 C ATOM 1174 HA ALA A 83 37.639 24.288 3.927 1.00 0.00 H ATOM 1175 HB1 ALA A 83 37.484 23.674 6.377 1.00 0.00 H ATOM 1176 HB2 ALA A 83 35.827 23.074 6.127 1.00 0.00 H ATOM 1177 HB3 ALA A 83 37.205 22.210 5.402 1.00 0.00 H ATOM 1178 H ALA A 83 35.643 25.538 5.587 1.00 0.00 H ATOM 1179 N GLN A 84 34.534 23.513 3.371 1.00 15.58 N ATOM 1180 CA GLN A 84 33.685 22.652 2.542 1.00 19.71 C ATOM 1181 C GLN A 84 34.267 22.597 1.136 1.00 19.95 C ATOM 1182 O GLN A 84 34.567 23.651 0.562 1.00 23.71 O ATOM 1183 CB GLN A 84 32.241 23.161 2.589 1.00 27.28 C ATOM 1184 CG GLN A 84 31.195 22.703 1.603 1.00 39.37 C ATOM 1185 CD GLN A 84 30.473 21.408 1.910 1.00 58.32 C ATOM 1186 OE1 GLN A 84 30.669 20.384 1.214 1.00 68.97 O ATOM 1187 NE2 GLN A 84 29.611 21.382 2.935 1.00 62.39 N ATOM 1188 HA GLN A 84 33.663 21.630 2.921 1.00 0.00 H ATOM 1189 HB2 GLN A 84 31.860 22.905 3.578 1.00 0.00 H ATOM 1190 HB3 GLN A 84 32.297 24.245 2.492 1.00 0.00 H ATOM 1191 HG2 GLN A 84 30.443 23.489 1.534 1.00 0.00 H ATOM 1192 HG3 GLN A 84 31.685 22.584 0.637 1.00 0.00 H ATOM 1193 HE22 GLN A 84 29.456 22.237 3.506 1.00 0.00 H ATOM 1194 HE21 GLN A 84 29.097 20.506 3.160 1.00 0.00 H ATOM 1195 H GLN A 84 34.135 24.344 3.853 1.00 0.00 H ATOM 1196 N GLY A 85 34.463 21.442 0.518 1.00 15.66 N ATOM 1197 CA GLY A 85 34.993 21.348 -0.829 1.00 17.69 C ATOM 1198 C GLY A 85 36.460 21.651 -0.974 1.00 19.01 C ATOM 1199 O GLY A 85 36.994 21.484 -2.080 1.00 20.04 O ATOM 1200 HA3 GLY A 85 34.442 22.049 -1.456 1.00 0.00 H ATOM 1201 HA2 GLY A 85 34.823 20.332 -1.186 1.00 0.00 H ATOM 1202 H GLY A 85 34.226 20.563 1.021 1.00 0.00 H ATOM 1203 N ARG A 86 37.127 22.058 0.108 1.00 17.08 N ATOM 1204 CA ARG A 86 38.545 22.380 0.122 1.00 15.12 C ATOM 1205 C ARG A 86 39.412 21.144 0.124 1.00 14.81 C ATOM 1206 O ARG A 86 39.091 20.197 0.880 1.00 17.61 O ATOM 1207 CB ARG A 86 38.858 23.154 1.409 1.00 17.10 C ATOM 1208 CG ARG A 86 40.208 23.801 1.508 1.00 14.76 C ATOM 1209 CD ARG A 86 40.397 25.032 0.646 1.00 7.96 C ATOM 1210 NE ARG A 86 39.254 25.895 0.854 1.00 16.53 N ATOM 1211 CZ ARG A 86 38.917 26.950 0.114 1.00 20.90 C ATOM 1212 NH1 ARG A 86 39.644 27.352 -0.920 1.00 19.00 N ATOM 1213 NH2 ARG A 86 37.820 27.603 0.430 1.00 15.11 N ATOM 1214 HA ARG A 86 38.758 22.959 -0.776 1.00 0.00 H ATOM 1215 HB2 ARG A 86 38.109 23.940 1.510 1.00 0.00 H ATOM 1216 HB3 ARG A 86 38.766 22.457 2.242 1.00 0.00 H ATOM 1217 HG2 ARG A 86 40.369 24.088 2.547 1.00 0.00 H ATOM 1218 HG3 ARG A 86 40.957 23.065 1.215 1.00 0.00 H ATOM 1219 HD2 ARG A 86 40.459 24.745 -0.404 1.00 0.00 H ATOM 1220 HD3 ARG A 86 41.311 25.551 0.934 1.00 0.00 H ATOM 1221 HE ARG A 86 38.636 25.670 1.659 1.00 0.00 H ATOM 1222 HH12 ARG A 86 39.347 28.181 -1.473 1.00 0.00 H ATOM 1223 HH11 ARG A 86 40.511 26.838 -1.177 1.00 0.00 H ATOM 1224 HH22 ARG A 86 37.529 28.431 -0.128 1.00 0.00 H ATOM 1225 HH21 ARG A 86 37.244 27.291 1.238 1.00 0.00 H ATOM 1226 H ARG A 86 36.598 22.151 0.999 1.00 0.00 H ATOM 1227 N LYS A 87 40.462 21.113 -0.692 1.00 12.38 N ATOM 1228 CA LYS A 87 41.372 19.945 -0.711 1.00 14.32 C ATOM 1229 C LYS A 87 42.264 20.078 0.532 1.00 14.61 C ATOM 1230 O LYS A 87 42.862 21.152 0.738 1.00 11.80 O ATOM 1231 CB LYS A 87 42.222 19.831 -1.990 1.00 16.88 C ATOM 1232 CG LYS A 87 41.282 19.543 -3.178 1.00 19.28 C ATOM 1233 CD LYS A 87 42.043 19.287 -4.453 1.00 39.30 C ATOM 1234 CE LYS A 87 41.210 19.573 -5.691 1.00 60.03 C ATOM 1235 NZ LYS A 87 40.201 18.543 -6.082 1.00 70.03 N ATOM 1236 HA LYS A 87 40.780 19.030 -0.701 1.00 0.00 H ATOM 1237 HB2 LYS A 87 42.756 20.766 -2.161 1.00 0.00 H ATOM 1238 HB3 LYS A 87 42.940 19.018 -1.883 1.00 0.00 H ATOM 1239 HG2 LYS A 87 40.680 18.665 -2.945 1.00 0.00 H ATOM 1240 HG3 LYS A 87 40.628 20.402 -3.325 1.00 0.00 H ATOM 1241 HD2 LYS A 87 42.926 19.927 -4.469 1.00 0.00 H ATOM 1242 HD3 LYS A 87 42.353 18.242 -4.473 1.00 0.00 H ATOM 1243 HE2 LYS A 87 41.897 19.696 -6.529 1.00 0.00 H ATOM 1244 HE3 LYS A 87 40.677 20.508 -5.520 1.00 0.00 H ATOM 1245 HZ1 LYS A 87 40.683 17.641 -6.271 1.00 0.00 H ATOM 1246 HZ2 LYS A 87 39.518 18.417 -5.308 1.00 0.00 H ATOM 1247 HZ3 LYS A 87 39.702 18.856 -6.939 1.00 0.00 H ATOM 1248 H LYS A 87 40.646 21.918 -1.324 1.00 0.00 H ATOM 1249 N VAL A 88 42.272 19.075 1.403 1.00 12.78 N ATOM 1250 CA VAL A 88 43.049 19.223 2.636 1.00 11.29 C ATOM 1251 C VAL A 88 43.799 17.948 2.955 1.00 13.07 C ATOM 1252 O VAL A 88 43.538 16.911 2.355 1.00 10.57 O ATOM 1253 CB VAL A 88 42.121 19.496 3.852 1.00 11.72 C ATOM 1254 CG1 VAL A 88 41.355 20.806 3.743 1.00 11.24 C ATOM 1255 CG2 VAL A 88 41.100 18.400 4.087 1.00 8.92 C ATOM 1256 HA VAL A 88 43.734 20.055 2.472 1.00 0.00 H ATOM 1257 HB VAL A 88 42.816 19.541 4.690 1.00 0.00 H ATOM 1258 HG11 VAL A 88 42.061 21.634 3.676 1.00 0.00 H ATOM 1259 HG12 VAL A 88 40.730 20.787 2.850 1.00 0.00 H ATOM 1260 HG13 VAL A 88 40.727 20.933 4.625 1.00 0.00 H ATOM 1261 HG21 VAL A 88 40.466 18.301 3.206 1.00 0.00 H ATOM 1262 HG22 VAL A 88 41.616 17.458 4.273 1.00 0.00 H ATOM 1263 HG23 VAL A 88 40.486 18.656 4.951 1.00 0.00 H ATOM 1264 H VAL A 88 41.738 18.203 1.214 1.00 0.00 H ATOM 1265 N ALA A 89 44.731 18.106 3.917 1.00 10.98 N ATOM 1266 CA ALA A 89 45.418 16.897 4.374 1.00 8.82 C ATOM 1267 C ALA A 89 46.012 17.275 5.745 1.00 7.55 C ATOM 1268 O ALA A 89 46.273 18.443 5.975 1.00 9.36 O ATOM 1269 CB ALA A 89 46.432 16.295 3.418 1.00 16.90 C ATOM 1270 HA ALA A 89 44.706 16.074 4.438 1.00 0.00 H ATOM 1271 HB1 ALA A 89 45.935 16.023 2.487 1.00 0.00 H ATOM 1272 HB2 ALA A 89 47.215 17.025 3.214 1.00 0.00 H ATOM 1273 HB3 ALA A 89 46.872 15.406 3.870 1.00 0.00 H ATOM 1274 H ALA A 89 44.951 19.041 4.315 1.00 0.00 H ATOM 1275 N CYS A 90 46.170 16.290 6.634 1.00 11.51 N ATOM 1276 CA CYS A 90 46.699 16.600 7.967 1.00 9.20 C ATOM 1277 C CYS A 90 47.960 15.846 8.320 1.00 9.43 C ATOM 1278 O CYS A 90 48.256 14.723 7.880 1.00 10.22 O ATOM 1279 CB CYS A 90 45.617 16.282 9.016 1.00 6.29 C ATOM 1280 SG CYS A 90 44.028 16.994 8.721 1.00 15.69 S ATOM 1281 HA CYS A 90 46.963 17.658 7.960 1.00 0.00 H ATOM 1282 HB2 CYS A 90 45.971 16.642 9.982 1.00 0.00 H ATOM 1283 HB3 CYS A 90 45.497 15.199 9.055 1.00 0.00 H ATOM 1284 HG CYS A 90 43.166 16.627 9.734 1.00 0.00 H ATOM 1285 H CYS A 90 45.920 15.312 6.383 1.00 0.00 H ATOM 1286 N PHE A 91 48.779 16.556 9.147 1.00 9.19 N ATOM 1287 CA PHE A 91 50.029 15.945 9.611 1.00 9.86 C ATOM 1288 C PHE A 91 50.188 16.318 11.107 1.00 11.57 C ATOM 1289 O PHE A 91 49.526 17.227 11.650 1.00 9.55 O ATOM 1290 CB PHE A 91 51.220 16.466 8.820 1.00 6.23 C ATOM 1291 CG PHE A 91 51.461 17.950 8.860 1.00 6.69 C ATOM 1292 CD1 PHE A 91 50.784 18.810 8.002 1.00 11.58 C ATOM 1293 CD2 PHE A 91 52.419 18.487 9.696 1.00 3.94 C ATOM 1294 CE1 PHE A 91 51.004 20.173 8.050 1.00 4.43 C ATOM 1295 CE2 PHE A 91 52.680 19.845 9.715 1.00 4.05 C ATOM 1296 CZ PHE A 91 51.975 20.714 8.901 1.00 7.65 C ATOM 1297 HA PHE A 91 49.993 14.865 9.472 1.00 0.00 H ATOM 1298 HB2 PHE A 91 52.113 15.976 9.206 1.00 0.00 H ATOM 1299 HB3 PHE A 91 51.074 16.183 7.778 1.00 0.00 H ATOM 1300 HD2 PHE A 91 52.982 17.827 10.355 1.00 0.00 H ATOM 1301 HE2 PHE A 91 53.451 20.236 10.379 1.00 0.00 H ATOM 1302 HZ PHE A 91 52.170 21.786 8.922 1.00 0.00 H ATOM 1303 HE1 PHE A 91 50.414 20.836 7.417 1.00 0.00 H ATOM 1304 HD1 PHE A 91 50.072 18.404 7.284 1.00 0.00 H ATOM 1305 H PHE A 91 48.521 17.518 9.445 1.00 0.00 H ATOM 1306 N GLY A 92 51.103 15.620 11.760 1.00 13.73 N ATOM 1307 CA GLY A 92 51.314 15.973 13.181 1.00 10.16 C ATOM 1308 C GLY A 92 52.370 15.085 13.789 1.00 8.59 C ATOM 1309 O GLY A 92 52.660 14.013 13.284 1.00 8.02 O ATOM 1310 HA3 GLY A 92 50.379 15.846 13.726 1.00 0.00 H ATOM 1311 HA2 GLY A 92 51.634 17.013 13.250 1.00 0.00 H ATOM 1312 H GLY A 92 51.646 14.862 11.298 1.00 0.00 H ATOM 1313 N CYS A 93 52.921 15.556 14.887 1.00 8.50 N ATOM 1314 CA CYS A 93 53.927 14.837 15.687 1.00 9.12 C ATOM 1315 C CYS A 93 53.235 14.263 16.928 1.00 7.28 C ATOM 1316 O CYS A 93 52.250 14.800 17.451 1.00 7.14 O ATOM 1317 CB CYS A 93 55.010 15.870 15.983 1.00 9.84 C ATOM 1318 SG CYS A 93 56.047 16.102 14.497 1.00 9.28 S ATOM 1319 HA CYS A 93 54.386 13.983 15.189 1.00 0.00 H ATOM 1320 HB2 CYS A 93 55.630 15.521 16.809 1.00 0.00 H ATOM 1321 HB3 CYS A 93 54.545 16.818 16.254 1.00 0.00 H ATOM 1322 HG CYS A 93 57.027 17.036 14.763 1.00 0.00 H ATOM 1323 H CYS A 93 52.626 16.499 15.212 1.00 0.00 H ATOM 1324 N GLY A 94 53.677 13.116 17.385 1.00 10.73 N ATOM 1325 CA GLY A 94 53.133 12.395 18.525 1.00 8.99 C ATOM 1326 C GLY A 94 54.147 11.382 19.034 1.00 9.94 C ATOM 1327 O GLY A 94 55.371 11.420 18.759 1.00 12.41 O ATOM 1328 HA3 GLY A 94 52.224 11.875 18.223 1.00 0.00 H ATOM 1329 HA2 GLY A 94 52.898 13.102 19.321 1.00 0.00 H ATOM 1330 H GLY A 94 54.484 12.686 16.891 1.00 0.00 H ATOM 1331 N ALA A 95 53.609 10.431 19.802 1.00 11.68 N ATOM 1332 CA ALA A 95 54.564 9.421 20.359 1.00 11.95 C ATOM 1333 C ALA A 95 53.831 8.119 20.405 1.00 10.28 C ATOM 1334 O ALA A 95 52.735 8.072 20.989 1.00 11.85 O ATOM 1335 CB ALA A 95 55.141 9.993 21.657 1.00 12.19 C ATOM 1336 HA ALA A 95 55.451 9.212 19.761 1.00 0.00 H ATOM 1337 HB1 ALA A 95 55.659 10.928 21.442 1.00 0.00 H ATOM 1338 HB2 ALA A 95 54.331 10.179 22.362 1.00 0.00 H ATOM 1339 HB3 ALA A 95 55.842 9.278 22.088 1.00 0.00 H ATOM 1340 H ALA A 95 52.589 10.394 20.001 1.00 0.00 H ATOM 1341 N SER A 96 54.320 7.079 19.713 1.00 9.52 N ATOM 1342 CA SER A 96 53.614 5.804 19.649 1.00 14.67 C ATOM 1343 C SER A 96 53.341 5.063 20.957 1.00 14.72 C ATOM 1344 O SER A 96 52.519 4.141 21.017 1.00 14.60 O ATOM 1345 CB SER A 96 54.290 4.831 18.657 1.00 14.99 C ATOM 1346 OG SER A 96 55.651 4.787 19.077 1.00 26.62 O ATOM 1347 HA SER A 96 52.629 6.123 19.307 1.00 0.00 H ATOM 1348 HB2 SER A 96 54.213 5.205 17.636 1.00 0.00 H ATOM 1349 HB3 SER A 96 53.836 3.842 18.716 1.00 0.00 H ATOM 1350 HG SER A 96 56.040 5.696 19.028 1.00 0.00 H ATOM 1351 H SER A 96 55.224 7.184 19.210 1.00 0.00 H ATOM 1352 N SER A 97 53.936 5.421 22.062 1.00 18.80 N ATOM 1353 CA SER A 97 53.798 4.876 23.411 1.00 22.07 C ATOM 1354 C SER A 97 52.532 5.388 24.113 1.00 23.09 C ATOM 1355 O SER A 97 52.095 4.885 25.158 1.00 23.85 O ATOM 1356 CB SER A 97 55.076 5.200 24.210 1.00 17.25 C ATOM 1357 OG SER A 97 55.550 6.518 24.003 1.00 26.36 O ATOM 1358 HA SER A 97 53.681 3.794 23.349 1.00 0.00 H ATOM 1359 HB2 SER A 97 55.857 4.501 23.911 1.00 0.00 H ATOM 1360 HB3 SER A 97 54.862 5.072 25.271 1.00 0.00 H ATOM 1361 HG SER A 97 55.758 6.646 23.044 1.00 0.00 H ATOM 1362 H SER A 97 54.607 6.210 21.969 1.00 0.00 H ATOM 1363 N TYR A 98 51.888 6.410 23.531 1.00 16.96 N ATOM 1364 CA TYR A 98 50.672 6.995 24.036 1.00 14.34 C ATOM 1365 C TYR A 98 49.518 6.192 23.469 1.00 13.74 C ATOM 1366 O TYR A 98 49.583 5.505 22.467 1.00 15.82 O ATOM 1367 CB TYR A 98 50.426 8.483 23.760 1.00 12.31 C ATOM 1368 CG TYR A 98 51.303 9.293 24.674 1.00 12.26 C ATOM 1369 CD1 TYR A 98 52.673 9.409 24.396 1.00 19.42 C ATOM 1370 CD2 TYR A 98 50.794 9.897 25.788 1.00 15.71 C ATOM 1371 CE1 TYR A 98 53.510 10.122 25.226 1.00 16.74 C ATOM 1372 CE2 TYR A 98 51.635 10.650 26.637 1.00 19.42 C ATOM 1373 CZ TYR A 98 52.969 10.745 26.342 1.00 19.96 C ATOM 1374 OH TYR A 98 53.805 11.483 27.162 1.00 22.56 O ATOM 1375 HA TYR A 98 50.765 6.953 25.121 1.00 0.00 H ATOM 1376 HB3 TYR A 98 49.379 8.723 23.947 1.00 0.00 H ATOM 1377 HB2 TYR A 98 50.669 8.709 22.722 1.00 0.00 H ATOM 1378 HD2 TYR A 98 49.734 9.798 26.023 1.00 0.00 H ATOM 1379 HE2 TYR A 98 51.227 11.149 27.516 1.00 0.00 H ATOM 1380 HE1 TYR A 98 54.576 10.195 25.011 1.00 0.00 H ATOM 1381 HD1 TYR A 98 53.082 8.927 23.508 1.00 0.00 H ATOM 1382 HH TYR A 98 54.729 11.447 26.808 1.00 0.00 H ATOM 1383 H TYR A 98 52.292 6.806 22.659 1.00 0.00 H ATOM 1384 N GLU A 99 48.422 6.276 24.214 1.00 17.06 N ATOM 1385 CA GLU A 99 47.199 5.557 23.886 1.00 15.59 C ATOM 1386 C GLU A 99 46.684 5.981 22.511 1.00 15.34 C ATOM 1387 O GLU A 99 46.287 5.105 21.723 1.00 18.06 O ATOM 1388 CB GLU A 99 46.181 5.886 24.999 1.00 13.41 C ATOM 1389 CG GLU A 99 45.048 4.890 24.930 1.00 21.00 C ATOM 1390 CD GLU A 99 43.986 5.062 25.999 1.00 25.92 C ATOM 1391 OE1 GLU A 99 44.021 5.905 26.913 1.00 25.83 O ATOM 1392 OE2 GLU A 99 43.012 4.298 25.891 1.00 27.91 O ATOM 1393 HA GLU A 99 47.370 4.482 23.835 1.00 0.00 H ATOM 1394 HB2 GLU A 99 46.668 5.821 25.972 1.00 0.00 H ATOM 1395 HB3 GLU A 99 45.793 6.894 24.855 1.00 0.00 H ATOM 1396 HG2 GLU A 99 44.569 4.988 23.956 1.00 0.00 H ATOM 1397 HG3 GLU A 99 45.469 3.889 25.027 1.00 0.00 H ATOM 1398 H GLU A 99 48.438 6.877 25.063 1.00 0.00 H ATOM 1399 N TYR A 100 46.659 7.297 22.267 1.00 13.72 N ATOM 1400 CA TYR A 100 46.168 7.871 21.005 1.00 11.25 C ATOM 1401 C TYR A 100 47.346 8.524 20.289 1.00 8.55 C ATOM 1402 O TYR A 100 47.598 9.737 20.442 1.00 13.93 O ATOM 1403 CB TYR A 100 45.034 8.900 21.299 1.00 9.34 C ATOM 1404 CG TYR A 100 43.901 8.252 22.091 1.00 9.04 C ATOM 1405 CD1 TYR A 100 43.278 7.113 21.589 1.00 8.02 C ATOM 1406 CD2 TYR A 100 43.542 8.773 23.345 1.00 11.10 C ATOM 1407 CE1 TYR A 100 42.292 6.500 22.339 1.00 11.88 C ATOM 1408 CE2 TYR A 100 42.528 8.174 24.065 1.00 10.99 C ATOM 1409 CZ TYR A 100 41.924 7.038 23.577 1.00 15.40 C ATOM 1410 OH TYR A 100 40.912 6.381 24.297 1.00 12.56 O ATOM 1411 HA TYR A 100 45.747 7.096 20.364 1.00 0.00 H ATOM 1412 HB3 TYR A 100 44.640 9.276 20.355 1.00 0.00 H ATOM 1413 HB2 TYR A 100 45.445 9.729 21.876 1.00 0.00 H ATOM 1414 HD2 TYR A 100 44.060 9.644 23.747 1.00 0.00 H ATOM 1415 HE2 TYR A 100 42.207 8.599 25.016 1.00 0.00 H ATOM 1416 HE1 TYR A 100 41.802 5.600 21.967 1.00 0.00 H ATOM 1417 HD1 TYR A 100 43.564 6.710 20.617 1.00 0.00 H ATOM 1418 HH TYR A 100 40.605 5.591 23.786 1.00 0.00 H ATOM 1419 H TYR A 100 47.003 7.944 23.005 1.00 0.00 H ATOM 1420 N PHE A 101 48.057 7.647 19.576 1.00 8.93 N ATOM 1421 CA PHE A 101 49.241 8.152 18.844 1.00 9.67 C ATOM 1422 C PHE A 101 48.767 9.108 17.744 1.00 11.39 C ATOM 1423 O PHE A 101 47.972 8.794 16.826 1.00 13.35 O ATOM 1424 CB PHE A 101 49.962 6.971 18.209 1.00 15.84 C ATOM 1425 CG PHE A 101 51.040 7.390 17.224 1.00 17.64 C ATOM 1426 CD1 PHE A 101 51.968 8.333 17.591 1.00 11.80 C ATOM 1427 CD2 PHE A 101 51.060 6.868 15.928 1.00 19.69 C ATOM 1428 CE1 PHE A 101 52.986 8.723 16.736 1.00 13.92 C ATOM 1429 CE2 PHE A 101 52.043 7.260 15.043 1.00 13.51 C ATOM 1430 CZ PHE A 101 53.015 8.150 15.461 1.00 17.17 C ATOM 1431 HA PHE A 101 49.915 8.675 19.523 1.00 0.00 H ATOM 1432 HB2 PHE A 101 50.425 6.381 19.000 1.00 0.00 H ATOM 1433 HB3 PHE A 101 49.229 6.359 17.682 1.00 0.00 H ATOM 1434 HD2 PHE A 101 50.300 6.152 15.617 1.00 0.00 H ATOM 1435 HE2 PHE A 101 52.053 6.872 14.024 1.00 0.00 H ATOM 1436 HZ PHE A 101 53.824 8.412 14.779 1.00 0.00 H ATOM 1437 HE1 PHE A 101 53.737 9.450 17.046 1.00 0.00 H ATOM 1438 HD1 PHE A 101 51.902 8.786 18.580 1.00 0.00 H ATOM 1439 H PHE A 101 47.788 6.643 19.536 1.00 0.00 H ATOM 1440 N CYS A 102 49.186 10.359 17.833 1.00 5.95 N ATOM 1441 CA CYS A 102 48.774 11.361 16.836 1.00 9.68 C ATOM 1442 C CYS A 102 47.265 11.427 16.848 1.00 11.59 C ATOM 1443 O CYS A 102 46.687 11.759 15.801 1.00 9.91 O ATOM 1444 CB CYS A 102 49.348 11.121 15.408 1.00 3.75 C ATOM 1445 SG CYS A 102 51.120 11.469 15.432 1.00 7.91 S ATOM 1446 HA CYS A 102 49.201 12.324 17.118 1.00 0.00 H ATOM 1447 HB2 CYS A 102 48.853 11.783 14.697 1.00 0.00 H ATOM 1448 HB3 CYS A 102 49.181 10.085 15.114 1.00 0.00 H ATOM 1449 HG CYS A 102 51.324 12.781 15.806 1.00 0.00 H ATOM 1450 H CYS A 102 49.813 10.638 18.615 1.00 0.00 H ATOM 1451 N GLY A 103 46.608 11.268 18.015 1.00 12.12 N ATOM 1452 CA GLY A 103 45.139 11.395 18.042 1.00 5.62 C ATOM 1453 C GLY A 103 44.718 12.787 17.590 1.00 6.95 C ATOM 1454 O GLY A 103 43.564 12.917 17.122 1.00 8.47 O ATOM 1455 HA3 GLY A 103 44.782 11.224 19.057 1.00 0.00 H ATOM 1456 HA2 GLY A 103 44.702 10.653 17.374 1.00 0.00 H ATOM 1457 H GLY A 103 47.133 11.058 18.888 1.00 0.00 H ATOM 1458 N ALA A 104 45.507 13.856 17.646 1.00 8.70 N ATOM 1459 CA ALA A 104 45.120 15.173 17.143 1.00 8.53 C ATOM 1460 C ALA A 104 44.871 15.105 15.618 1.00 11.26 C ATOM 1461 O ALA A 104 43.923 15.732 15.155 1.00 15.39 O ATOM 1462 CB ALA A 104 46.131 16.295 17.401 1.00 1.72 C ATOM 1463 HA ALA A 104 44.219 15.424 17.702 1.00 0.00 H ATOM 1464 HB1 ALA A 104 46.283 16.405 18.475 1.00 0.00 H ATOM 1465 HB2 ALA A 104 47.078 16.046 16.922 1.00 0.00 H ATOM 1466 HB3 ALA A 104 45.748 17.229 16.989 1.00 0.00 H ATOM 1467 H ALA A 104 46.450 13.749 18.071 1.00 0.00 H ATOM 1468 N VAL A 105 45.647 14.407 14.834 1.00 11.56 N ATOM 1469 CA VAL A 105 45.502 14.247 13.380 1.00 11.63 C ATOM 1470 C VAL A 105 44.128 13.610 13.159 1.00 15.02 C ATOM 1471 O VAL A 105 43.361 14.052 12.299 1.00 11.74 O ATOM 1472 CB VAL A 105 46.547 13.293 12.777 1.00 9.12 C ATOM 1473 CG1 VAL A 105 46.253 12.987 11.298 1.00 11.73 C ATOM 1474 CG2 VAL A 105 47.972 13.813 12.973 1.00 2.80 C ATOM 1475 HA VAL A 105 45.628 15.220 12.905 1.00 0.00 H ATOM 1476 HB VAL A 105 46.471 12.352 13.322 1.00 0.00 H ATOM 1477 HG11 VAL A 105 45.272 12.520 11.213 1.00 0.00 H ATOM 1478 HG12 VAL A 105 46.265 13.915 10.727 1.00 0.00 H ATOM 1479 HG13 VAL A 105 47.014 12.310 10.910 1.00 0.00 H ATOM 1480 HG21 VAL A 105 48.073 14.783 12.487 1.00 0.00 H ATOM 1481 HG22 VAL A 105 48.177 13.916 14.039 1.00 0.00 H ATOM 1482 HG23 VAL A 105 48.678 13.109 12.532 1.00 0.00 H ATOM 1483 H VAL A 105 46.447 13.916 15.282 1.00 0.00 H ATOM 1484 N ASP A 106 43.824 12.569 13.977 1.00 14.33 N ATOM 1485 CA ASP A 106 42.540 11.897 13.878 1.00 13.48 C ATOM 1486 C ASP A 106 41.367 12.825 14.154 1.00 9.81 C ATOM 1487 O ASP A 106 40.380 12.793 13.416 1.00 10.51 O ATOM 1488 CB ASP A 106 42.347 10.731 14.869 1.00 16.70 C ATOM 1489 CG ASP A 106 43.354 9.625 14.713 1.00 22.07 C ATOM 1490 OD1 ASP A 106 43.497 9.158 13.561 1.00 36.12 O ATOM 1491 OD2 ASP A 106 44.001 9.190 15.657 1.00 25.01 O ATOM 1492 HA ASP A 106 42.554 11.532 12.851 1.00 0.00 H ATOM 1493 HB2 ASP A 106 42.424 11.125 15.882 1.00 0.00 H ATOM 1494 HB3 ASP A 106 41.352 10.313 14.718 1.00 0.00 H ATOM 1495 H ASP A 106 44.518 12.249 14.682 1.00 0.00 H ATOM 1496 N ALA A 107 41.423 13.631 15.212 1.00 11.48 N ATOM 1497 CA ALA A 107 40.329 14.531 15.552 1.00 10.00 C ATOM 1498 C ALA A 107 40.103 15.598 14.491 1.00 11.26 C ATOM 1499 O ALA A 107 38.949 15.926 14.181 1.00 10.00 O ATOM 1500 CB ALA A 107 40.664 15.276 16.883 1.00 9.54 C ATOM 1501 HA ALA A 107 39.433 13.916 15.638 1.00 0.00 H ATOM 1502 HB1 ALA A 107 40.798 14.547 17.682 1.00 0.00 H ATOM 1503 HB2 ALA A 107 41.582 15.850 16.756 1.00 0.00 H ATOM 1504 HB3 ALA A 107 39.845 15.949 17.137 1.00 0.00 H ATOM 1505 H ALA A 107 42.272 13.618 15.813 1.00 0.00 H ATOM 1506 N ILE A 108 41.193 16.183 14.005 1.00 8.87 N ATOM 1507 CA ILE A 108 41.105 17.259 12.988 1.00 12.01 C ATOM 1508 C ILE A 108 40.576 16.734 11.643 1.00 13.79 C ATOM 1509 O ILE A 108 39.739 17.308 10.955 1.00 13.93 O ATOM 1510 CB ILE A 108 42.482 17.917 12.841 1.00 11.82 C ATOM 1511 CG1 ILE A 108 42.962 18.440 14.192 1.00 12.40 C ATOM 1512 CG2 ILE A 108 42.404 19.038 11.802 1.00 11.55 C ATOM 1513 CD1 ILE A 108 44.414 18.837 14.261 1.00 8.06 C ATOM 1514 HA ILE A 108 40.386 18.007 13.322 1.00 0.00 H ATOM 1515 HB ILE A 108 43.207 17.179 12.496 1.00 0.00 H ATOM 1516 HG12 ILE A 108 42.363 19.315 14.445 1.00 0.00 H ATOM 1517 HG13 ILE A 108 42.793 17.659 14.933 1.00 0.00 H ATOM 1518 HD11 ILE A 108 45.037 17.973 14.028 1.00 0.00 H ATOM 1519 HD12 ILE A 108 44.607 19.631 13.539 1.00 0.00 H ATOM 1520 HD13 ILE A 108 44.645 19.193 15.265 1.00 0.00 H ATOM 1521 HG21 ILE A 108 42.095 18.622 10.843 1.00 0.00 H ATOM 1522 HG22 ILE A 108 41.678 19.783 12.127 1.00 0.00 H ATOM 1523 HG23 ILE A 108 43.384 19.505 11.699 1.00 0.00 H ATOM 1524 H ILE A 108 42.128 15.880 14.345 1.00 0.00 H ATOM 1525 N GLU A 109 41.080 15.558 11.254 1.00 10.49 N ATOM 1526 CA GLU A 109 40.614 14.900 10.037 1.00 12.50 C ATOM 1527 C GLU A 109 39.139 14.591 10.206 1.00 17.05 C ATOM 1528 O GLU A 109 38.457 14.885 9.230 1.00 14.30 O ATOM 1529 CB GLU A 109 41.323 13.593 9.736 1.00 11.92 C ATOM 1530 CG GLU A 109 42.771 13.851 9.335 1.00 17.31 C ATOM 1531 CD GLU A 109 43.447 12.571 8.898 1.00 18.65 C ATOM 1532 OE1 GLU A 109 42.853 11.549 9.280 1.00 28.39 O ATOM 1533 OE2 GLU A 109 44.496 12.544 8.255 1.00 15.35 O ATOM 1534 HA GLU A 109 40.820 15.580 9.211 1.00 0.00 H ATOM 1535 HB2 GLU A 109 41.304 12.961 10.624 1.00 0.00 H ATOM 1536 HB3 GLU A 109 40.809 13.086 8.919 1.00 0.00 H ATOM 1537 HG2 GLU A 109 42.792 14.565 8.512 1.00 0.00 H ATOM 1538 HG3 GLU A 109 43.309 14.266 10.187 1.00 0.00 H ATOM 1539 H GLU A 109 41.818 15.104 11.829 1.00 0.00 H ATOM 1540 N GLU A 110 38.664 14.049 11.339 1.00 14.62 N ATOM 1541 CA GLU A 110 37.251 13.791 11.471 1.00 14.01 C ATOM 1542 C GLU A 110 36.498 15.126 11.388 1.00 11.48 C ATOM 1543 O GLU A 110 35.404 15.120 10.748 1.00 12.70 O ATOM 1544 CB GLU A 110 36.664 13.044 12.685 1.00 11.64 C ATOM 1545 CG GLU A 110 37.286 12.136 13.665 1.00 29.00 C ATOM 1546 CD GLU A 110 36.296 11.347 14.517 1.00 28.13 C ATOM 1547 OE1 GLU A 110 35.071 11.673 14.594 1.00 32.34 O ATOM 1548 OE2 GLU A 110 36.762 10.340 15.116 1.00 42.13 O ATOM 1549 HA GLU A 110 37.114 13.077 10.659 1.00 0.00 H ATOM 1550 HB2 GLU A 110 36.243 13.839 13.300 1.00 0.00 H ATOM 1551 HB3 GLU A 110 35.856 12.450 12.258 1.00 0.00 H ATOM 1552 HG2 GLU A 110 37.910 11.426 13.123 1.00 0.00 H ATOM 1553 HG3 GLU A 110 37.910 12.731 14.332 1.00 0.00 H ATOM 1554 H GLU A 110 39.312 13.816 12.118 1.00 0.00 H ATOM 1555 N LYS A 111 36.947 16.237 11.989 1.00 9.41 N ATOM 1556 CA LYS A 111 36.181 17.454 11.892 1.00 8.34 C ATOM 1557 C LYS A 111 36.110 17.981 10.453 1.00 11.11 C ATOM 1558 O LYS A 111 35.067 18.502 10.060 1.00 7.95 O ATOM 1559 CB LYS A 111 36.637 18.570 12.820 1.00 4.89 C ATOM 1560 CG LYS A 111 35.677 19.733 12.768 1.00 10.18 C ATOM 1561 CD LYS A 111 35.958 20.647 13.947 1.00 12.15 C ATOM 1562 CE LYS A 111 34.735 21.507 14.255 1.00 13.70 C ATOM 1563 NZ LYS A 111 35.147 22.305 15.449 1.00 15.11 N ATOM 1564 HA LYS A 111 35.185 17.159 12.223 1.00 0.00 H ATOM 1565 HB2 LYS A 111 36.684 18.190 13.841 1.00 0.00 H ATOM 1566 HB3 LYS A 111 37.627 18.909 12.513 1.00 0.00 H ATOM 1567 HG2 LYS A 111 35.815 20.282 11.836 1.00 0.00 H ATOM 1568 HG3 LYS A 111 34.652 19.366 12.824 1.00 0.00 H ATOM 1569 HD2 LYS A 111 36.202 20.043 14.821 1.00 0.00 H ATOM 1570 HD3 LYS A 111 36.802 21.294 13.707 1.00 0.00 H ATOM 1571 HE2 LYS A 111 33.870 20.884 14.484 1.00 0.00 H ATOM 1572 HE3 LYS A 111 34.498 22.160 13.415 1.00 0.00 H ATOM 1573 HZ1 LYS A 111 35.381 21.661 16.231 1.00 0.00 H ATOM 1574 HZ2 LYS A 111 35.981 22.879 15.210 1.00 0.00 H ATOM 1575 HZ3 LYS A 111 34.365 22.929 15.734 1.00 0.00 H ATOM 1576 H LYS A 111 37.841 16.221 12.521 1.00 0.00 H ATOM 1577 N LEU A 112 37.211 17.884 9.739 1.00 12.53 N ATOM 1578 CA LEU A 112 37.326 18.305 8.332 1.00 14.26 C ATOM 1579 C LEU A 112 36.323 17.515 7.469 1.00 12.72 C ATOM 1580 O LEU A 112 35.577 18.107 6.652 1.00 15.00 O ATOM 1581 CB LEU A 112 38.757 18.098 7.828 1.00 11.42 C ATOM 1582 CG LEU A 112 39.826 19.086 8.298 1.00 12.34 C ATOM 1583 CD1 LEU A 112 41.166 18.486 7.897 1.00 8.68 C ATOM 1584 CD2 LEU A 112 39.528 20.470 7.710 1.00 13.59 C ATOM 1585 HA LEU A 112 37.092 19.367 8.257 1.00 0.00 H ATOM 1586 HB2 LEU A 112 39.072 17.103 8.142 1.00 0.00 H ATOM 1587 HB3 LEU A 112 38.729 18.142 6.739 1.00 0.00 H ATOM 1588 HG LEU A 112 39.840 19.241 9.377 1.00 0.00 H ATOM 1589 HD21 LEU A 112 39.537 20.411 6.622 1.00 0.00 H ATOM 1590 HD22 LEU A 112 38.547 20.804 8.048 1.00 0.00 H ATOM 1591 HD23 LEU A 112 40.288 21.176 8.043 1.00 0.00 H ATOM 1592 HD11 LEU A 112 41.288 17.517 8.381 1.00 0.00 H ATOM 1593 HD12 LEU A 112 41.197 18.360 6.815 1.00 0.00 H ATOM 1594 HD13 LEU A 112 41.969 19.153 8.210 1.00 0.00 H ATOM 1595 H LEU A 112 38.055 17.484 10.198 1.00 0.00 H ATOM 1596 N LYS A 113 36.289 16.197 7.670 1.00 10.55 N ATOM 1597 CA LYS A 113 35.378 15.271 7.027 1.00 18.73 C ATOM 1598 C LYS A 113 33.926 15.732 7.285 1.00 23.44 C ATOM 1599 O LYS A 113 33.083 15.833 6.381 1.00 21.92 O ATOM 1600 CB LYS A 113 35.460 13.825 7.452 1.00 20.91 C ATOM 1601 CG LYS A 113 36.117 12.765 6.578 1.00 44.85 C ATOM 1602 CD LYS A 113 37.511 12.365 7.030 1.00 55.71 C ATOM 1603 CE LYS A 113 37.842 10.889 7.142 1.00 66.61 C ATOM 1604 NZ LYS A 113 38.731 10.584 8.322 1.00 72.13 N ATOM 1605 HA LYS A 113 35.680 15.295 5.980 1.00 0.00 H ATOM 1606 HB2 LYS A 113 35.997 13.815 8.401 1.00 0.00 H ATOM 1607 HB3 LYS A 113 34.434 13.495 7.613 1.00 0.00 H ATOM 1608 HG2 LYS A 113 35.486 11.876 6.585 1.00 0.00 H ATOM 1609 HG3 LYS A 113 36.185 13.153 5.562 1.00 0.00 H ATOM 1610 HD2 LYS A 113 38.216 12.800 6.322 1.00 0.00 H ATOM 1611 HD3 LYS A 113 37.669 12.806 8.014 1.00 0.00 H ATOM 1612 HE2 LYS A 113 38.350 10.574 6.231 1.00 0.00 H ATOM 1613 HE3 LYS A 113 36.913 10.329 7.250 1.00 0.00 H ATOM 1614 HZ1 LYS A 113 39.625 11.107 8.225 1.00 0.00 H ATOM 1615 HZ2 LYS A 113 38.252 10.873 9.199 1.00 0.00 H ATOM 1616 HZ3 LYS A 113 38.927 9.563 8.352 1.00 0.00 H ATOM 1617 H LYS A 113 36.974 15.800 8.345 1.00 0.00 H ATOM 1618 N ASN A 114 33.602 16.039 8.543 1.00 25.36 N ATOM 1619 CA ASN A 114 32.292 16.507 8.968 1.00 23.65 C ATOM 1620 C ASN A 114 31.985 17.872 8.339 1.00 19.35 C ATOM 1621 O ASN A 114 30.809 18.176 8.184 1.00 19.40 O ATOM 1622 CB ASN A 114 32.166 16.592 10.512 1.00 17.68 C ATOM 1623 CG ASN A 114 32.181 15.286 11.271 1.00 21.86 C ATOM 1624 OD1 ASN A 114 32.367 15.166 12.507 1.00 27.70 O ATOM 1625 ND2 ASN A 114 31.950 14.217 10.525 1.00 16.41 N ATOM 1626 HA ASN A 114 31.563 15.774 8.623 1.00 0.00 H ATOM 1627 HB2 ASN A 114 32.997 17.196 10.878 1.00 0.00 H ATOM 1628 HB3 ASN A 114 31.226 17.094 10.739 1.00 0.00 H ATOM 1629 HD22 ASN A 114 31.796 14.320 9.502 1.00 0.00 H ATOM 1630 HD21 ASN A 114 31.922 13.274 10.962 1.00 0.00 H ATOM 1631 H ASN A 114 34.338 15.936 9.271 1.00 0.00 H ATOM 1632 N LEU A 115 32.915 18.745 7.992 1.00 18.07 N ATOM 1633 CA LEU A 115 32.717 20.039 7.398 1.00 18.01 C ATOM 1634 C LEU A 115 32.684 20.014 5.854 1.00 19.06 C ATOM 1635 O LEU A 115 32.587 21.067 5.235 1.00 20.87 O ATOM 1636 CB LEU A 115 33.844 20.959 7.854 1.00 16.55 C ATOM 1637 CG LEU A 115 33.811 21.354 9.340 1.00 19.22 C ATOM 1638 CD1 LEU A 115 35.018 22.216 9.674 1.00 21.93 C ATOM 1639 CD2 LEU A 115 32.554 22.132 9.669 1.00 16.49 C ATOM 1640 HA LEU A 115 31.741 20.396 7.726 1.00 0.00 H ATOM 1641 HB2 LEU A 115 34.790 20.454 7.661 1.00 0.00 H ATOM 1642 HB3 LEU A 115 33.794 21.872 7.261 1.00 0.00 H ATOM 1643 HG LEU A 115 33.827 20.437 9.929 1.00 0.00 H ATOM 1644 HD21 LEU A 115 32.521 23.039 9.065 1.00 0.00 H ATOM 1645 HD22 LEU A 115 31.680 21.517 9.451 1.00 0.00 H ATOM 1646 HD23 LEU A 115 32.559 22.397 10.726 1.00 0.00 H ATOM 1647 HD11 LEU A 115 35.931 21.656 9.471 1.00 0.00 H ATOM 1648 HD12 LEU A 115 35.000 23.117 9.062 1.00 0.00 H ATOM 1649 HD13 LEU A 115 34.986 22.491 10.728 1.00 0.00 H ATOM 1650 H LEU A 115 33.901 18.464 8.169 1.00 0.00 H ATOM 1651 N GLY A 116 32.787 18.846 5.255 1.00 18.37 N ATOM 1652 CA GLY A 116 32.760 18.672 3.828 1.00 20.94 C ATOM 1653 C GLY A 116 34.076 18.918 3.127 1.00 20.69 C ATOM 1654 O GLY A 116 34.041 19.095 1.911 1.00 19.08 O ATOM 1655 HA3 GLY A 116 32.024 19.363 3.417 1.00 0.00 H ATOM 1656 HA2 GLY A 116 32.452 17.648 3.618 1.00 0.00 H ATOM 1657 H GLY A 116 32.894 17.999 5.849 1.00 0.00 H ATOM 1658 N ALA A 117 35.198 18.943 3.838 1.00 17.73 N ATOM 1659 CA ALA A 117 36.500 19.146 3.228 1.00 16.70 C ATOM 1660 C ALA A 117 36.877 17.919 2.404 1.00 20.98 C ATOM 1661 O ALA A 117 36.336 16.824 2.607 1.00 19.50 O ATOM 1662 CB ALA A 117 37.586 19.368 4.265 1.00 8.49 C ATOM 1663 HA ALA A 117 36.427 20.035 2.601 1.00 0.00 H ATOM 1664 HB1 ALA A 117 37.346 20.251 4.857 1.00 0.00 H ATOM 1665 HB2 ALA A 117 37.647 18.497 4.917 1.00 0.00 H ATOM 1666 HB3 ALA A 117 38.542 19.515 3.762 1.00 0.00 H ATOM 1667 H ALA A 117 35.142 18.813 4.868 1.00 0.00 H ATOM 1668 N GLU A 118 37.806 18.042 1.458 1.00 20.81 N ATOM 1669 CA GLU A 118 38.227 16.886 0.647 1.00 21.91 C ATOM 1670 C GLU A 118 39.613 16.444 1.114 1.00 14.58 C ATOM 1671 O GLU A 118 40.610 17.055 0.757 1.00 21.30 O ATOM 1672 CB GLU A 118 38.148 17.263 -0.837 1.00 23.15 C ATOM 1673 CG GLU A 118 38.495 16.140 -1.796 1.00 49.37 C ATOM 1674 CD GLU A 118 38.738 16.562 -3.252 1.00 57.33 C ATOM 1675 OE1 GLU A 118 38.199 17.613 -3.690 1.00 57.26 O ATOM 1676 OE2 GLU A 118 39.492 15.804 -3.929 1.00 54.89 O ATOM 1677 HA GLU A 118 37.567 16.028 0.777 1.00 0.00 H ATOM 1678 HB2 GLU A 118 37.130 17.590 -1.051 1.00 0.00 H ATOM 1679 HB3 GLU A 118 38.838 18.088 -1.015 1.00 0.00 H ATOM 1680 HG2 GLU A 118 39.401 15.655 -1.431 1.00 0.00 H ATOM 1681 HG3 GLU A 118 37.673 15.425 -1.787 1.00 0.00 H ATOM 1682 H GLU A 118 38.242 18.971 1.288 1.00 0.00 H ATOM 1683 N ILE A 119 39.711 15.386 1.911 1.00 14.95 N ATOM 1684 CA ILE A 119 40.961 14.898 2.461 1.00 16.33 C ATOM 1685 C ILE A 119 41.661 14.200 1.297 1.00 17.10 C ATOM 1686 O ILE A 119 41.249 13.110 0.904 1.00 15.65 O ATOM 1687 CB ILE A 119 40.820 13.911 3.642 1.00 12.23 C ATOM 1688 CG1 ILE A 119 39.976 14.446 4.791 1.00 19.19 C ATOM 1689 CG2 ILE A 119 42.186 13.489 4.139 1.00 11.67 C ATOM 1690 CD1 ILE A 119 40.466 15.636 5.526 1.00 27.08 C ATOM 1691 HA ILE A 119 41.510 15.741 2.880 1.00 0.00 H ATOM 1692 HB ILE A 119 40.285 13.045 3.254 1.00 0.00 H ATOM 1693 HG12 ILE A 119 38.997 14.698 4.383 1.00 0.00 H ATOM 1694 HG13 ILE A 119 39.869 13.639 5.516 1.00 0.00 H ATOM 1695 HD11 ILE A 119 41.437 15.413 5.969 1.00 0.00 H ATOM 1696 HD12 ILE A 119 40.564 16.473 4.835 1.00 0.00 H ATOM 1697 HD13 ILE A 119 39.756 15.893 6.312 1.00 0.00 H ATOM 1698 HG21 ILE A 119 42.731 13.002 3.330 1.00 0.00 H ATOM 1699 HG22 ILE A 119 42.737 14.368 4.473 1.00 0.00 H ATOM 1700 HG23 ILE A 119 42.070 12.794 4.971 1.00 0.00 H ATOM 1701 H ILE A 119 38.838 14.876 2.156 1.00 0.00 H ATOM 1702 N VAL A 120 42.691 14.838 0.763 1.00 21.18 N ATOM 1703 CA VAL A 120 43.400 14.266 -0.388 1.00 18.57 C ATOM 1704 C VAL A 120 44.350 13.137 -0.096 1.00 18.74 C ATOM 1705 O VAL A 120 44.655 12.339 -0.968 1.00 17.42 O ATOM 1706 CB VAL A 120 44.151 15.359 -1.213 1.00 14.10 C ATOM 1707 CG1 VAL A 120 43.038 16.300 -1.653 1.00 18.65 C ATOM 1708 CG2 VAL A 120 45.266 16.130 -0.538 1.00 17.20 C ATOM 1709 HA VAL A 120 42.588 13.829 -0.969 1.00 0.00 H ATOM 1710 HB VAL A 120 44.704 14.862 -2.010 1.00 0.00 H ATOM 1711 HG11 VAL A 120 42.315 15.749 -2.255 1.00 0.00 H ATOM 1712 HG12 VAL A 120 42.543 16.711 -0.773 1.00 0.00 H ATOM 1713 HG13 VAL A 120 43.462 17.111 -2.245 1.00 0.00 H ATOM 1714 HG21 VAL A 120 44.868 16.657 0.329 1.00 0.00 H ATOM 1715 HG22 VAL A 120 46.044 15.436 -0.218 1.00 0.00 H ATOM 1716 HG23 VAL A 120 45.686 16.849 -1.241 1.00 0.00 H ATOM 1717 H VAL A 120 42.999 15.748 1.161 1.00 0.00 H ATOM 1718 N GLN A 121 44.840 12.978 1.115 1.00 16.74 N ATOM 1719 CA GLN A 121 45.792 11.952 1.477 1.00 18.40 C ATOM 1720 C GLN A 121 45.546 11.620 2.958 1.00 17.35 C ATOM 1721 O GLN A 121 45.085 12.508 3.672 1.00 18.00 O ATOM 1722 CB GLN A 121 47.163 12.577 1.295 1.00 16.82 C ATOM 1723 CG GLN A 121 48.561 12.127 1.212 1.00 29.17 C ATOM 1724 CD GLN A 121 48.877 10.983 0.272 1.00 42.35 C ATOM 1725 OE1 GLN A 121 48.491 10.969 -0.907 1.00 38.60 O ATOM 1726 NE2 GLN A 121 49.587 9.980 0.833 1.00 48.32 N ATOM 1727 HA GLN A 121 45.707 11.043 0.882 1.00 0.00 H ATOM 1728 HB2 GLN A 121 47.043 13.120 0.357 1.00 0.00 H ATOM 1729 HB3 GLN A 121 47.201 13.286 2.122 1.00 0.00 H ATOM 1730 HG2 GLN A 121 49.160 12.982 0.898 1.00 0.00 H ATOM 1731 HG3 GLN A 121 48.864 11.820 2.213 1.00 0.00 H ATOM 1732 HE22 GLN A 121 49.884 10.046 1.827 1.00 0.00 H ATOM 1733 HE21 GLN A 121 49.836 9.142 0.270 1.00 0.00 H ATOM 1734 H GLN A 121 44.522 13.632 1.859 1.00 0.00 H ATOM 1735 N ASP A 122 45.933 10.402 3.315 1.00 16.97 N ATOM 1736 CA ASP A 122 45.880 9.965 4.689 1.00 17.83 C ATOM 1737 C ASP A 122 46.897 10.847 5.470 1.00 13.50 C ATOM 1738 O ASP A 122 47.928 11.254 4.957 1.00 10.96 O ATOM 1739 CB ASP A 122 46.430 8.549 4.834 1.00 21.52 C ATOM 1740 CG ASP A 122 45.490 7.493 4.298 1.00 31.05 C ATOM 1741 OD1 ASP A 122 44.291 7.793 4.074 1.00 31.56 O ATOM 1742 OD2 ASP A 122 46.002 6.359 4.120 1.00 40.31 O ATOM 1743 HA ASP A 122 44.849 10.022 5.038 1.00 0.00 H ATOM 1744 HB2 ASP A 122 47.372 8.484 4.290 1.00 0.00 H ATOM 1745 HB3 ASP A 122 46.608 8.352 5.891 1.00 0.00 H ATOM 1746 H ASP A 122 46.283 9.747 2.587 1.00 0.00 H ATOM 1747 N GLY A 123 46.556 11.039 6.739 1.00 14.29 N ATOM 1748 CA GLY A 123 47.377 11.865 7.596 1.00 11.91 C ATOM 1749 C GLY A 123 48.790 11.390 7.784 1.00 8.10 C ATOM 1750 O GLY A 123 49.052 10.192 7.739 1.00 12.36 O ATOM 1751 HA3 GLY A 123 46.903 11.909 8.577 1.00 0.00 H ATOM 1752 HA2 GLY A 123 47.412 12.866 7.166 1.00 0.00 H ATOM 1753 H GLY A 123 45.696 10.594 7.118 1.00 0.00 H ATOM 1754 N LEU A 124 49.688 12.358 7.963 1.00 6.06 N ATOM 1755 CA LEU A 124 51.072 12.057 8.230 1.00 8.15 C ATOM 1756 C LEU A 124 51.192 12.056 9.786 1.00 12.76 C ATOM 1757 O LEU A 124 50.965 13.070 10.470 1.00 11.71 O ATOM 1758 CB LEU A 124 51.954 13.162 7.641 1.00 9.03 C ATOM 1759 CG LEU A 124 53.461 13.015 7.919 1.00 6.69 C ATOM 1760 CD1 LEU A 124 53.950 11.720 7.322 1.00 4.97 C ATOM 1761 CD2 LEU A 124 54.159 14.268 7.433 1.00 6.19 C ATOM 1762 HA LEU A 124 51.386 11.108 7.794 1.00 0.00 H ATOM 1763 HB2 LEU A 124 51.809 13.170 6.561 1.00 0.00 H ATOM 1764 HB3 LEU A 124 51.625 14.114 8.057 1.00 0.00 H ATOM 1765 HG LEU A 124 53.690 12.939 8.982 1.00 0.00 H ATOM 1766 HD21 LEU A 124 53.986 14.387 6.364 1.00 0.00 H ATOM 1767 HD22 LEU A 124 53.763 15.133 7.965 1.00 0.00 H ATOM 1768 HD23 LEU A 124 55.229 14.183 7.622 1.00 0.00 H ATOM 1769 HD11 LEU A 124 53.411 10.887 7.773 1.00 0.00 H ATOM 1770 HD12 LEU A 124 53.775 11.728 6.246 1.00 0.00 H ATOM 1771 HD13 LEU A 124 55.017 11.612 7.517 1.00 0.00 H ATOM 1772 H LEU A 124 49.384 13.351 7.909 1.00 0.00 H ATOM 1773 N ARG A 125 51.519 10.889 10.342 1.00 11.83 N ATOM 1774 CA ARG A 125 51.697 10.681 11.776 1.00 12.13 C ATOM 1775 C ARG A 125 53.169 10.414 12.099 1.00 10.10 C ATOM 1776 O ARG A 125 53.661 9.317 11.815 1.00 14.83 O ATOM 1777 CB ARG A 125 50.835 9.533 12.328 1.00 8.93 C ATOM 1778 CG ARG A 125 49.372 9.926 12.119 1.00 6.64 C ATOM 1779 CD ARG A 125 48.546 8.657 12.343 1.00 17.34 C ATOM 1780 NE ARG A 125 47.269 8.896 11.682 1.00 25.92 N ATOM 1781 CZ ARG A 125 46.162 9.281 12.262 1.00 33.29 C ATOM 1782 NH1 ARG A 125 46.204 9.418 13.587 1.00 41.87 N ATOM 1783 NH2 ARG A 125 45.110 9.514 11.492 1.00 29.84 N ATOM 1784 HA ARG A 125 51.367 11.599 12.262 1.00 0.00 H ATOM 1785 HB2 ARG A 125 51.054 8.610 11.792 1.00 0.00 H ATOM 1786 HB3 ARG A 125 51.036 9.392 13.390 1.00 0.00 H ATOM 1787 HG2 ARG A 125 49.082 10.696 12.834 1.00 0.00 H ATOM 1788 HG3 ARG A 125 49.223 10.299 11.106 1.00 0.00 H ATOM 1789 HD2 ARG A 125 48.396 8.484 13.409 1.00 0.00 H ATOM 1790 HD3 ARG A 125 49.047 7.795 11.903 1.00 0.00 H ATOM 1791 HE ARG A 125 47.235 8.746 10.653 1.00 0.00 H ATOM 1792 HH12 ARG A 125 45.355 9.722 14.106 1.00 0.00 H ATOM 1793 HH11 ARG A 125 47.086 9.221 14.102 1.00 0.00 H ATOM 1794 HH22 ARG A 125 44.212 9.822 11.917 1.00 0.00 H ATOM 1795 HH21 ARG A 125 45.182 9.389 10.462 1.00 0.00 H ATOM 1796 H ARG A 125 51.656 10.073 9.712 1.00 0.00 H ATOM 1797 N ILE A 126 53.855 11.386 12.690 1.00 8.03 N ATOM 1798 CA ILE A 126 55.271 11.242 13.003 1.00 13.16 C ATOM 1799 C ILE A 126 55.512 10.820 14.466 1.00 12.44 C ATOM 1800 O ILE A 126 55.146 11.583 15.344 1.00 11.90 O ATOM 1801 CB ILE A 126 56.089 12.541 12.825 1.00 10.90 C ATOM 1802 CG1 ILE A 126 55.888 13.237 11.439 1.00 15.95 C ATOM 1803 CG2 ILE A 126 57.584 12.357 13.124 1.00 9.58 C ATOM 1804 CD1 ILE A 126 56.162 12.324 10.270 1.00 12.60 C ATOM 1805 HA ILE A 126 55.598 10.481 12.295 1.00 0.00 H ATOM 1806 HB ILE A 126 55.677 13.214 13.577 1.00 0.00 H ATOM 1807 HG12 ILE A 126 54.857 13.586 11.372 1.00 0.00 H ATOM 1808 HG13 ILE A 126 56.564 14.090 11.378 1.00 0.00 H ATOM 1809 HD11 ILE A 126 57.194 11.975 10.317 1.00 0.00 H ATOM 1810 HD12 ILE A 126 55.486 11.470 10.311 1.00 0.00 H ATOM 1811 HD13 ILE A 126 56.004 12.870 9.340 1.00 0.00 H ATOM 1812 HG21 ILE A 126 57.709 12.026 14.155 1.00 0.00 H ATOM 1813 HG22 ILE A 126 57.999 11.609 12.448 1.00 0.00 H ATOM 1814 HG23 ILE A 126 58.101 13.306 12.980 1.00 0.00 H ATOM 1815 H ILE A 126 53.369 12.272 12.936 1.00 0.00 H ATOM 1816 N ASP A 127 56.160 9.689 14.633 1.00 15.27 N ATOM 1817 CA ASP A 127 56.524 9.169 15.938 1.00 14.57 C ATOM 1818 C ASP A 127 57.904 9.679 16.342 1.00 16.41 C ATOM 1819 O ASP A 127 58.896 9.405 15.649 1.00 18.03 O ATOM 1820 CB ASP A 127 56.445 7.636 15.926 1.00 14.58 C ATOM 1821 CG ASP A 127 56.757 7.049 17.307 1.00 18.14 C ATOM 1822 OD1 ASP A 127 56.578 7.740 18.346 1.00 12.37 O ATOM 1823 OD2 ASP A 127 57.225 5.894 17.338 1.00 15.93 O ATOM 1824 HA ASP A 127 55.820 9.527 16.689 1.00 0.00 H ATOM 1825 HB2 ASP A 127 55.440 7.335 15.631 1.00 0.00 H ATOM 1826 HB3 ASP A 127 57.165 7.249 15.205 1.00 0.00 H ATOM 1827 H ASP A 127 56.425 9.141 13.790 1.00 0.00 H ATOM 1828 N GLY A 128 58.029 10.463 17.420 1.00 17.65 N ATOM 1829 CA GLY A 128 59.328 10.935 17.861 1.00 17.32 C ATOM 1830 C GLY A 128 59.898 12.126 17.091 1.00 18.61 C ATOM 1831 O GLY A 128 59.169 12.920 16.509 1.00 19.73 O ATOM 1832 HA3 GLY A 128 60.033 10.109 17.770 1.00 0.00 H ATOM 1833 HA2 GLY A 128 59.242 11.224 18.909 1.00 0.00 H ATOM 1834 H GLY A 128 57.179 10.739 17.951 1.00 0.00 H ATOM 1835 N ASP A 129 61.226 12.261 17.106 1.00 11.05 N ATOM 1836 CA ASP A 129 61.900 13.385 16.456 1.00 13.76 C ATOM 1837 C ASP A 129 61.590 13.347 14.975 1.00 10.15 C ATOM 1838 O ASP A 129 61.955 12.360 14.347 1.00 14.06 O ATOM 1839 CB ASP A 129 63.391 13.176 16.692 1.00 9.58 C ATOM 1840 CG ASP A 129 64.132 14.480 16.467 1.00 11.25 C ATOM 1841 OD1 ASP A 129 63.637 15.312 15.684 1.00 11.17 O ATOM 1842 OD2 ASP A 129 65.194 14.678 17.091 1.00 16.15 O ATOM 1843 HA ASP A 129 61.576 14.349 16.849 1.00 0.00 H ATOM 1844 HB2 ASP A 129 63.552 12.839 17.716 1.00 0.00 H ATOM 1845 HB3 ASP A 129 63.766 12.422 16.000 1.00 0.00 H ATOM 1846 H ASP A 129 61.800 11.545 17.595 1.00 0.00 H ATOM 1847 N PRO A 130 60.940 14.369 14.452 1.00 14.96 N ATOM 1848 CA PRO A 130 60.567 14.460 13.038 1.00 12.59 C ATOM 1849 C PRO A 130 61.821 14.595 12.212 1.00 11.21 C ATOM 1850 O PRO A 130 61.756 14.175 11.051 1.00 14.64 O ATOM 1851 CB PRO A 130 59.626 15.672 12.885 1.00 4.84 C ATOM 1852 CG PRO A 130 60.254 16.559 13.936 1.00 6.89 C ATOM 1853 CD PRO A 130 60.499 15.587 15.136 1.00 10.34 C ATOM 1854 HA PRO A 130 60.045 13.569 12.690 1.00 0.00 H ATOM 1855 HD3 PRO A 130 61.271 15.968 15.805 1.00 0.00 H ATOM 1856 HD2 PRO A 130 59.583 15.415 15.701 1.00 0.00 H ATOM 1857 HG3 PRO A 130 59.578 17.366 14.220 1.00 0.00 H ATOM 1858 HG2 PRO A 130 61.193 16.982 13.579 1.00 0.00 H ATOM 1859 HB2 PRO A 130 59.677 16.112 11.889 1.00 0.00 H ATOM 1860 HB3 PRO A 130 58.591 15.424 13.119 1.00 0.00 H ATOM 1861 N ARG A 131 62.952 15.097 12.716 1.00 11.58 N ATOM 1862 CA ARG A 131 64.144 15.155 11.868 1.00 6.83 C ATOM 1863 C ARG A 131 64.614 13.778 11.492 1.00 11.96 C ATOM 1864 O ARG A 131 65.344 13.626 10.508 1.00 12.38 O ATOM 1865 CB ARG A 131 65.217 15.958 12.583 1.00 12.49 C ATOM 1866 CG ARG A 131 64.728 17.400 12.676 1.00 4.67 C ATOM 1867 CD ARG A 131 65.478 17.995 13.865 1.00 6.83 C ATOM 1868 NE ARG A 131 64.685 19.146 14.279 1.00 10.50 N ATOM 1869 CZ ARG A 131 63.625 19.263 15.083 1.00 17.66 C ATOM 1870 NH1 ARG A 131 63.100 18.218 15.730 1.00 16.37 N ATOM 1871 NH2 ARG A 131 63.036 20.451 15.278 1.00 13.30 N ATOM 1872 HA ARG A 131 63.904 15.656 10.930 1.00 0.00 H ATOM 1873 HB2 ARG A 131 65.379 15.555 13.583 1.00 0.00 H ATOM 1874 HB3 ARG A 131 66.150 15.917 12.020 1.00 0.00 H ATOM 1875 HG2 ARG A 131 64.964 17.945 11.762 1.00 0.00 H ATOM 1876 HG3 ARG A 131 63.652 17.430 12.847 1.00 0.00 H ATOM 1877 HD2 ARG A 131 66.479 18.307 13.569 1.00 0.00 H ATOM 1878 HD3 ARG A 131 65.550 17.269 14.675 1.00 0.00 H ATOM 1879 HE ARG A 131 65.006 20.047 13.871 1.00 0.00 H ATOM 1880 HH12 ARG A 131 62.274 18.350 16.347 1.00 0.00 H ATOM 1881 HH11 ARG A 131 63.518 17.272 15.616 1.00 0.00 H ATOM 1882 HH22 ARG A 131 62.211 20.525 15.907 1.00 0.00 H ATOM 1883 HH21 ARG A 131 63.404 21.298 14.800 1.00 0.00 H ATOM 1884 H ARG A 131 62.985 15.442 13.697 1.00 0.00 H ATOM 1885 N ALA A 132 64.254 12.731 12.218 1.00 10.33 N ATOM 1886 CA ALA A 132 64.649 11.365 11.930 1.00 8.69 C ATOM 1887 C ALA A 132 63.679 10.713 10.940 1.00 15.33 C ATOM 1888 O ALA A 132 63.909 9.570 10.536 1.00 15.78 O ATOM 1889 CB ALA A 132 64.716 10.519 13.178 1.00 12.07 C ATOM 1890 HA ALA A 132 65.645 11.417 11.491 1.00 0.00 H ATOM 1891 HB1 ALA A 132 65.445 10.946 13.866 1.00 0.00 H ATOM 1892 HB2 ALA A 132 63.735 10.497 13.653 1.00 0.00 H ATOM 1893 HB3 ALA A 132 65.016 9.505 12.912 1.00 0.00 H ATOM 1894 H ALA A 132 63.650 12.898 13.048 1.00 0.00 H ATOM 1895 N ALA A 133 62.624 11.452 10.566 1.00 12.67 N ATOM 1896 CA ALA A 133 61.614 10.965 9.631 1.00 12.36 C ATOM 1897 C ALA A 133 61.469 11.926 8.436 1.00 16.25 C ATOM 1898 O ALA A 133 60.371 11.989 7.833 1.00 11.58 O ATOM 1899 CB ALA A 133 60.253 10.793 10.327 1.00 14.24 C ATOM 1900 HA ALA A 133 61.944 9.992 9.266 1.00 0.00 H ATOM 1901 HB1 ALA A 133 60.351 10.075 11.141 1.00 0.00 H ATOM 1902 HB2 ALA A 133 59.926 11.753 10.725 1.00 0.00 H ATOM 1903 HB3 ALA A 133 59.521 10.429 9.606 1.00 0.00 H ATOM 1904 H ALA A 133 62.521 12.410 10.958 1.00 0.00 H ATOM 1905 N ARG A 134 62.544 12.670 8.123 1.00 17.45 N ATOM 1906 CA ARG A 134 62.539 13.630 7.025 1.00 21.89 C ATOM 1907 C ARG A 134 62.117 13.062 5.656 1.00 22.71 C ATOM 1908 O ARG A 134 61.454 13.735 4.876 1.00 18.15 O ATOM 1909 CB ARG A 134 63.927 14.257 6.810 1.00 12.89 C ATOM 1910 CG ARG A 134 63.718 15.371 5.808 1.00 21.60 C ATOM 1911 CD ARG A 134 65.030 15.992 5.469 1.00 23.19 C ATOM 1912 NE ARG A 134 64.893 16.926 4.346 1.00 28.52 N ATOM 1913 CZ ARG A 134 64.985 16.479 3.091 1.00 24.72 C ATOM 1914 NH1 ARG A 134 65.198 15.208 2.799 1.00 31.83 N ATOM 1915 NH2 ARG A 134 64.875 17.363 2.121 1.00 29.06 N ATOM 1916 HA ARG A 134 61.796 14.358 7.349 1.00 0.00 H ATOM 1917 HB2 ARG A 134 64.314 14.656 7.748 1.00 0.00 H ATOM 1918 HB3 ARG A 134 64.623 13.516 6.416 1.00 0.00 H ATOM 1919 HG2 ARG A 134 63.264 14.965 4.904 1.00 0.00 H ATOM 1920 HG3 ARG A 134 63.059 16.126 6.237 1.00 0.00 H ATOM 1921 HD2 ARG A 134 65.737 15.208 5.197 1.00 0.00 H ATOM 1922 HD3 ARG A 134 65.405 16.532 6.339 1.00 0.00 H ATOM 1923 HE ARG A 134 64.724 17.936 4.527 1.00 0.00 H ATOM 1924 HH12 ARG A 134 65.262 14.906 1.806 1.00 0.00 H ATOM 1925 HH11 ARG A 134 65.301 14.509 3.562 1.00 0.00 H ATOM 1926 HH22 ARG A 134 64.941 17.057 1.129 1.00 0.00 H ATOM 1927 HH21 ARG A 134 64.722 18.367 2.347 1.00 0.00 H ATOM 1928 H ARG A 134 63.412 12.557 8.685 1.00 0.00 H ATOM 1929 N ASP A 135 62.499 11.810 5.391 1.00 19.95 N ATOM 1930 CA ASP A 135 62.197 11.061 4.192 1.00 23.82 C ATOM 1931 C ASP A 135 60.684 10.840 4.094 1.00 26.67 C ATOM 1932 O ASP A 135 60.082 11.002 3.031 1.00 20.69 O ATOM 1933 CB ASP A 135 62.868 9.682 4.072 1.00 31.61 C ATOM 1934 CG ASP A 135 64.202 9.613 3.361 1.00 37.84 C ATOM 1935 OD1 ASP A 135 64.815 10.702 3.183 1.00 35.68 O ATOM 1936 OD2 ASP A 135 64.609 8.479 2.997 1.00 38.73 O ATOM 1937 HA ASP A 135 62.599 11.674 3.385 1.00 0.00 H ATOM 1938 HB2 ASP A 135 63.016 9.302 5.083 1.00 0.00 H ATOM 1939 HB3 ASP A 135 62.179 9.029 3.537 1.00 0.00 H ATOM 1940 H ASP A 135 63.068 11.328 6.116 1.00 0.00 H ATOM 1941 N ASP A 136 60.041 10.473 5.229 1.00 23.43 N ATOM 1942 CA ASP A 136 58.612 10.277 5.260 1.00 19.61 C ATOM 1943 C ASP A 136 57.871 11.597 5.048 1.00 13.04 C ATOM 1944 O ASP A 136 56.803 11.575 4.443 1.00 13.68 O ATOM 1945 CB ASP A 136 58.085 9.699 6.594 1.00 31.47 C ATOM 1946 CG ASP A 136 58.525 8.258 6.791 1.00 40.35 C ATOM 1947 OD1 ASP A 136 58.818 7.547 5.802 1.00 42.34 O ATOM 1948 OD2 ASP A 136 58.570 7.878 7.982 1.00 50.29 O ATOM 1949 HA ASP A 136 58.424 9.563 4.458 1.00 0.00 H ATOM 1950 HB2 ASP A 136 58.468 10.302 7.417 1.00 0.00 H ATOM 1951 HB3 ASP A 136 56.996 9.740 6.592 1.00 0.00 H ATOM 1952 H ASP A 136 60.591 10.329 6.100 1.00 0.00 H ATOM 1953 N ILE A 137 58.388 12.674 5.617 1.00 10.22 N ATOM 1954 CA ILE A 137 57.738 13.965 5.488 1.00 10.03 C ATOM 1955 C ILE A 137 57.716 14.437 4.023 1.00 9.63 C ATOM 1956 O ILE A 137 56.716 14.833 3.428 1.00 10.82 O ATOM 1957 CB ILE A 137 58.448 14.922 6.464 1.00 8.79 C ATOM 1958 CG1 ILE A 137 58.373 14.489 7.955 1.00 12.80 C ATOM 1959 CG2 ILE A 137 57.823 16.322 6.329 1.00 10.82 C ATOM 1960 CD1 ILE A 137 59.292 15.359 8.841 1.00 1.72 C ATOM 1961 HA ILE A 137 56.683 13.920 5.758 1.00 0.00 H ATOM 1962 HB ILE A 137 59.503 14.911 6.190 1.00 0.00 H ATOM 1963 HG12 ILE A 137 57.345 14.590 8.303 1.00 0.00 H ATOM 1964 HG13 ILE A 137 58.682 13.447 8.038 1.00 0.00 H ATOM 1965 HD11 ILE A 137 60.323 15.258 8.502 1.00 0.00 H ATOM 1966 HD12 ILE A 137 58.984 16.402 8.767 1.00 0.00 H ATOM 1967 HD13 ILE A 137 59.215 15.029 9.877 1.00 0.00 H ATOM 1968 HG21 ILE A 137 57.948 16.677 5.306 1.00 0.00 H ATOM 1969 HG22 ILE A 137 56.761 16.269 6.569 1.00 0.00 H ATOM 1970 HG23 ILE A 137 58.319 17.008 7.016 1.00 0.00 H ATOM 1971 H ILE A 137 59.270 12.594 6.163 1.00 0.00 H ATOM 1972 N VAL A 138 58.861 14.440 3.383 1.00 15.19 N ATOM 1973 CA VAL A 138 59.175 14.807 1.981 1.00 14.42 C ATOM 1974 C VAL A 138 58.371 13.915 1.057 1.00 9.81 C ATOM 1975 O VAL A 138 57.738 14.373 0.097 1.00 15.42 O ATOM 1976 CB VAL A 138 60.719 14.712 1.780 1.00 20.65 C ATOM 1977 CG1 VAL A 138 61.149 14.476 0.342 1.00 30.85 C ATOM 1978 CG2 VAL A 138 61.416 15.965 2.341 1.00 9.67 C ATOM 1979 HA VAL A 138 58.892 15.833 1.745 1.00 0.00 H ATOM 1980 HB VAL A 138 61.031 13.828 2.337 1.00 0.00 H ATOM 1981 HG11 VAL A 138 60.722 13.538 -0.014 1.00 0.00 H ATOM 1982 HG12 VAL A 138 60.796 15.298 -0.281 1.00 0.00 H ATOM 1983 HG13 VAL A 138 62.237 14.423 0.293 1.00 0.00 H ATOM 1984 HG21 VAL A 138 61.045 16.849 1.822 1.00 0.00 H ATOM 1985 HG22 VAL A 138 61.202 16.052 3.406 1.00 0.00 H ATOM 1986 HG23 VAL A 138 62.492 15.879 2.191 1.00 0.00 H ATOM 1987 H VAL A 138 59.679 14.137 3.949 1.00 0.00 H ATOM 1988 N GLY A 139 58.293 12.617 1.352 1.00 10.27 N ATOM 1989 CA GLY A 139 57.559 11.625 0.614 1.00 10.40 C ATOM 1990 C GLY A 139 56.066 11.933 0.668 1.00 15.57 C ATOM 1991 O GLY A 139 55.353 11.841 -0.334 1.00 12.95 O ATOM 1992 HA3 GLY A 139 57.741 10.643 1.050 1.00 0.00 H ATOM 1993 HA2 GLY A 139 57.891 11.628 -0.424 1.00 0.00 H ATOM 1994 H GLY A 139 58.811 12.292 2.193 1.00 0.00 H ATOM 1995 N TRP A 140 55.540 12.315 1.846 1.00 13.89 N ATOM 1996 CA TRP A 140 54.120 12.629 2.045 1.00 7.82 C ATOM 1997 C TRP A 140 53.780 13.919 1.342 1.00 7.01 C ATOM 1998 O TRP A 140 52.686 14.026 0.790 1.00 10.78 O ATOM 1999 CB TRP A 140 53.870 12.788 3.549 1.00 9.58 C ATOM 2000 CG TRP A 140 52.463 13.108 3.927 1.00 1.87 C ATOM 2001 CD1 TRP A 140 51.512 12.140 4.080 1.00 5.59 C ATOM 2002 CD2 TRP A 140 51.826 14.347 4.194 1.00 6.16 C ATOM 2003 NE1 TRP A 140 50.292 12.722 4.387 1.00 11.58 N ATOM 2004 CE2 TRP A 140 50.474 14.082 4.504 1.00 10.38 C ATOM 2005 CE3 TRP A 140 52.267 15.690 4.230 1.00 7.43 C ATOM 2006 CZ2 TRP A 140 49.515 15.072 4.842 1.00 4.42 C ATOM 2007 CZ3 TRP A 140 51.322 16.688 4.511 1.00 5.82 C ATOM 2008 CH2 TRP A 140 49.993 16.375 4.820 1.00 5.30 C ATOM 2009 HA TRP A 140 53.500 11.830 1.638 1.00 0.00 H ATOM 2010 HB2 TRP A 140 54.147 11.854 4.038 1.00 0.00 H ATOM 2011 HB3 TRP A 140 54.509 13.592 3.915 1.00 0.00 H ATOM 2012 HE1 TRP A 140 49.391 12.217 4.508 1.00 0.00 H ATOM 2013 HD1 TRP A 140 51.686 11.069 3.976 1.00 0.00 H ATOM 2014 HZ2 TRP A 140 48.484 14.828 5.099 1.00 0.00 H ATOM 2015 HH2 TRP A 140 49.305 17.188 5.053 1.00 0.00 H ATOM 2016 HZ3 TRP A 140 51.630 17.733 4.488 1.00 0.00 H ATOM 2017 HE3 TRP A 140 53.311 15.943 4.045 1.00 0.00 H ATOM 2018 H TRP A 140 56.177 12.392 2.664 1.00 0.00 H ATOM 2019 N ALA A 141 54.687 14.905 1.376 1.00 6.03 N ATOM 2020 CA ALA A 141 54.440 16.194 0.681 1.00 10.80 C ATOM 2021 C ALA A 141 54.394 15.949 -0.856 1.00 13.88 C ATOM 2022 O ALA A 141 53.594 16.506 -1.593 1.00 14.97 O ATOM 2023 CB ALA A 141 55.508 17.219 0.998 1.00 7.56 C ATOM 2024 HA ALA A 141 53.486 16.588 1.032 1.00 0.00 H ATOM 2025 HB1 ALA A 141 55.523 17.406 2.072 1.00 0.00 H ATOM 2026 HB2 ALA A 141 56.479 16.840 0.681 1.00 0.00 H ATOM 2027 HB3 ALA A 141 55.288 18.146 0.469 1.00 0.00 H ATOM 2028 H ALA A 141 55.577 14.766 1.896 1.00 0.00 H ATOM 2029 N HIS A 142 55.282 15.079 -1.343 1.00 16.75 N ATOM 2030 CA HIS A 142 55.388 14.622 -2.723 1.00 18.71 C ATOM 2031 C HIS A 142 54.052 13.956 -3.078 1.00 18.40 C ATOM 2032 O HIS A 142 53.450 14.354 -4.081 1.00 18.18 O ATOM 2033 CB HIS A 142 56.591 13.725 -3.005 1.00 19.28 C ATOM 2034 CG HIS A 142 56.615 13.122 -4.374 1.00 37.74 C ATOM 2035 ND1 HIS A 142 56.223 11.822 -4.639 1.00 44.23 N ATOM 2036 CD2 HIS A 142 56.949 13.637 -5.576 1.00 43.59 C ATOM 2037 CE1 HIS A 142 56.326 11.553 -5.922 1.00 44.73 C ATOM 2038 NE2 HIS A 142 56.739 12.648 -6.516 1.00 48.77 N ATOM 2039 HA HIS A 142 55.577 15.481 -3.367 1.00 0.00 H ATOM 2040 HB2 HIS A 142 57.495 14.321 -2.880 1.00 0.00 H ATOM 2041 HB3 HIS A 142 56.588 12.914 -2.277 1.00 0.00 H ATOM 2042 HD2 HIS A 142 57.316 14.645 -5.769 1.00 0.00 H ATOM 2043 HE1 HIS A 142 56.109 10.599 -6.402 1.00 0.00 H ATOM 2044 H HIS A 142 55.969 14.687 -0.668 1.00 0.00 H ATOM 2045 N ASP A 143 53.541 13.027 -2.276 1.00 16.32 N ATOM 2046 CA ASP A 143 52.266 12.382 -2.545 1.00 17.14 C ATOM 2047 C ASP A 143 51.080 13.335 -2.537 1.00 20.70 C ATOM 2048 O ASP A 143 50.161 13.161 -3.367 1.00 20.52 O ATOM 2049 CB ASP A 143 51.977 11.240 -1.535 1.00 19.25 C ATOM 2050 CG ASP A 143 52.994 10.139 -1.708 1.00 23.02 C ATOM 2051 OD1 ASP A 143 53.737 10.127 -2.720 1.00 22.00 O ATOM 2052 OD2 ASP A 143 53.072 9.312 -0.772 1.00 29.47 O ATOM 2053 HA ASP A 143 52.372 11.982 -3.553 1.00 0.00 H ATOM 2054 HB2 ASP A 143 52.035 11.631 -0.519 1.00 0.00 H ATOM 2055 HB3 ASP A 143 50.978 10.842 -1.713 1.00 0.00 H ATOM 2056 H ASP A 143 54.072 12.752 -1.425 1.00 0.00 H ATOM 2057 N VAL A 144 51.043 14.312 -1.610 1.00 14.70 N ATOM 2058 CA VAL A 144 49.955 15.250 -1.580 1.00 11.42 C ATOM 2059 C VAL A 144 49.903 16.038 -2.888 1.00 10.97 C ATOM 2060 O VAL A 144 48.796 16.271 -3.372 1.00 14.43 O ATOM 2061 CB VAL A 144 50.099 16.221 -0.375 1.00 15.58 C ATOM 2062 CG1 VAL A 144 49.198 17.399 -0.476 1.00 15.98 C ATOM 2063 CG2 VAL A 144 49.751 15.372 0.855 1.00 22.23 C ATOM 2064 HA VAL A 144 49.025 14.694 -1.464 1.00 0.00 H ATOM 2065 HB VAL A 144 51.104 16.640 -0.330 1.00 0.00 H ATOM 2066 HG11 VAL A 144 49.430 17.956 -1.384 1.00 0.00 H ATOM 2067 HG12 VAL A 144 48.162 17.061 -0.511 1.00 0.00 H ATOM 2068 HG13 VAL A 144 49.343 18.041 0.393 1.00 0.00 H ATOM 2069 HG21 VAL A 144 48.733 14.995 0.758 1.00 0.00 H ATOM 2070 HG22 VAL A 144 50.445 14.534 0.925 1.00 0.00 H ATOM 2071 HG23 VAL A 144 49.829 15.986 1.752 1.00 0.00 H ATOM 2072 H VAL A 144 51.809 14.388 -0.910 1.00 0.00 H ATOM 2073 N ARG A 145 51.014 16.498 -3.443 1.00 14.23 N ATOM 2074 CA ARG A 145 51.042 17.248 -4.713 1.00 14.51 C ATOM 2075 C ARG A 145 50.470 16.414 -5.864 1.00 17.84 C ATOM 2076 O ARG A 145 49.713 16.837 -6.742 1.00 14.51 O ATOM 2077 CB ARG A 145 52.484 17.618 -5.107 1.00 12.23 C ATOM 2078 CG ARG A 145 53.051 18.749 -4.245 1.00 17.43 C ATOM 2079 CD ARG A 145 54.305 19.364 -4.822 1.00 11.32 C ATOM 2080 NE ARG A 145 55.491 18.519 -4.738 1.00 16.94 N ATOM 2081 CZ ARG A 145 55.979 17.799 -5.748 1.00 18.76 C ATOM 2082 NH1 ARG A 145 55.372 17.817 -6.936 1.00 18.08 N ATOM 2083 NH2 ARG A 145 57.065 17.060 -5.565 1.00 18.19 N ATOM 2084 HA ARG A 145 50.442 18.144 -4.552 1.00 0.00 H ATOM 2085 HB2 ARG A 145 53.116 16.738 -4.991 1.00 0.00 H ATOM 2086 HB3 ARG A 145 52.492 17.934 -6.150 1.00 0.00 H ATOM 2087 HG2 ARG A 145 52.294 19.528 -4.152 1.00 0.00 H ATOM 2088 HG3 ARG A 145 53.283 18.350 -3.258 1.00 0.00 H ATOM 2089 HD2 ARG A 145 54.508 20.290 -4.284 1.00 0.00 H ATOM 2090 HD3 ARG A 145 54.121 19.589 -5.873 1.00 0.00 H ATOM 2091 HE ARG A 145 55.990 18.475 -3.827 1.00 0.00 H ATOM 2092 HH12 ARG A 145 55.754 17.255 -7.723 1.00 0.00 H ATOM 2093 HH11 ARG A 145 54.517 18.393 -7.075 1.00 0.00 H ATOM 2094 HH22 ARG A 145 57.449 16.497 -6.350 1.00 0.00 H ATOM 2095 HH21 ARG A 145 57.533 17.044 -4.636 1.00 0.00 H ATOM 2096 H ARG A 145 51.916 16.321 -2.957 1.00 0.00 H ATOM 2097 N GLY A 146 50.847 15.137 -5.872 1.00 23.04 N ATOM 2098 CA GLY A 146 50.431 14.145 -6.850 1.00 31.62 C ATOM 2099 C GLY A 146 48.945 13.834 -6.759 1.00 33.58 C ATOM 2100 O GLY A 146 48.291 13.449 -7.729 1.00 35.26 O ATOM 2101 HA3 GLY A 146 50.993 13.227 -6.679 1.00 0.00 H ATOM 2102 HA2 GLY A 146 50.650 14.523 -7.849 1.00 0.00 H ATOM 2103 H GLY A 146 51.491 14.824 -5.118 1.00 0.00 H ATOM 2104 N ALA A 147 48.392 14.008 -5.572 1.00 34.38 N ATOM 2105 CA ALA A 147 47.027 13.777 -5.196 1.00 36.59 C ATOM 2106 C ALA A 147 46.064 14.928 -5.391 1.00 42.84 C ATOM 2107 O ALA A 147 44.836 14.663 -5.352 1.00 46.53 O ATOM 2108 CB ALA A 147 47.030 13.421 -3.680 1.00 24.63 C ATOM 2109 HA ALA A 147 46.667 12.990 -5.858 1.00 0.00 H ATOM 2110 HB1 ALA A 147 47.632 12.527 -3.519 1.00 0.00 H ATOM 2111 HB2 ALA A 147 47.452 14.251 -3.114 1.00 0.00 H ATOM 2112 HB3 ALA A 147 46.008 13.236 -3.349 1.00 0.00 H ATOM 2113 H ALA A 147 49.022 14.354 -4.820 1.00 0.00 H ATOM 2114 N ILE A 148 46.507 16.185 -5.569 1.00 46.82 N ATOM 2115 CA ILE A 148 45.496 17.251 -5.703 1.00 51.33 C ATOM 2116 C ILE A 148 45.068 17.432 -7.154 1.00 61.07 C ATOM 2117 O ILE A 148 44.315 18.389 -7.485 1.00 68.53 O ATOM 2118 CB ILE A 148 45.857 18.548 -4.958 1.00 43.25 C ATOM 2119 CG1 ILE A 148 46.910 19.416 -5.656 1.00 36.07 C ATOM 2120 CG2 ILE A 148 46.295 18.274 -3.513 1.00 40.73 C ATOM 2121 CD1 ILE A 148 46.765 20.909 -5.374 1.00 29.40 C ATOM 2122 HA ILE A 148 44.603 16.917 -5.175 1.00 0.00 H ATOM 2123 OXT ILE A 148 45.397 16.622 -8.066 1.00 71.38 O ATOM 2124 HB ILE A 148 44.929 19.120 -4.961 1.00 0.00 H ATOM 2125 HG12 ILE A 148 47.896 19.097 -5.319 1.00 0.00 H ATOM 2126 HG13 ILE A 148 46.826 19.260 -6.731 1.00 0.00 H ATOM 2127 HD11 ILE A 148 45.787 21.249 -5.716 1.00 0.00 H ATOM 2128 HD12 ILE A 148 46.858 21.086 -4.302 1.00 0.00 H ATOM 2129 HD13 ILE A 148 47.546 21.455 -5.903 1.00 0.00 H ATOM 2130 HG21 ILE A 148 45.483 17.785 -2.975 1.00 0.00 H ATOM 2131 HG22 ILE A 148 47.172 17.626 -3.517 1.00 0.00 H ATOM 2132 HG23 ILE A 148 46.541 19.217 -3.024 1.00 0.00 H ATOM 2133 H ILE A 148 47.524 16.398 -5.611 1.00 0.00 H TER 2134 ILE A 148 HETATM 2135 O HOH 1 49.643 14.666 16.406 1.00 2.43 O HETATM 2136 O HOH 2 57.009 13.509 17.863 1.00 10.38 O HETATM 2137 O HOH 3 46.942 9.315 24.530 1.00 11.29 O HETATM 2138 O HOH 4 50.188 22.294 23.673 1.00 6.04 O HETATM 2139 O HOH 5 46.502 21.554 24.925 1.00 10.35 O HETATM 2140 O HOH 6 45.077 13.964 6.002 1.00 9.05 O HETATM 2141 O HOH 7 45.813 30.191 19.395 1.00 19.01 O HETATM 2142 O HOH 8 52.204 25.526 23.757 1.00 16.04 O HETATM 2143 O HOH 9 36.865 15.791 15.914 1.00 10.10 O HETATM 2144 O HOH 10 56.557 26.764 8.168 1.00 14.85 O HETATM 2145 O HOH 11 59.943 19.253 -3.876 1.00 10.28 O HETATM 2146 O HOH 12 52.041 8.507 8.631 1.00 13.99 O HETATM 2147 O HOH 13 45.423 23.673 26.064 1.00 14.33 O HETATM 2148 O HOH 14 52.074 27.630 -8.165 1.00 13.46 O HETATM 2149 O HOH 15 58.237 13.180 20.800 1.00 20.47 O HETATM 2150 O HOH 16 53.072 32.798 11.602 1.00 18.64 O HETATM 2151 O HOH 17 52.229 26.616 17.483 1.00 13.72 O HETATM 2152 O HOH 18 60.436 27.247 2.266 1.00 20.96 O HETATM 2153 O HOH 19 41.981 19.670 22.943 1.00 13.73 O HETATM 2154 O HOH 20 55.759 19.957 27.165 1.00 21.74 O HETATM 2155 O HOH 21 61.083 23.972 14.815 1.00 25.71 O HETATM 2156 O HOH 22 61.915 19.928 2.484 1.00 18.02 O HETATM 2157 O HOH 23 54.920 26.955 17.274 1.00 16.35 O HETATM 2158 O HOH 24 48.238 26.462 -9.994 1.00 20.23 O HETATM 2159 O HOH 25 34.997 17.704 15.629 1.00 14.18 O HETATM 2160 O HOH 26 57.370 8.219 12.365 1.00 16.13 O HETATM 2161 O HOH 27 45.983 29.133 -7.613 1.00 22.70 O HETATM 2162 O HOH 28 61.851 8.460 6.795 1.00 28.86 O HETATM 2163 O HOH 29 49.920 10.715 -4.757 1.00 33.80 O HETATM 2164 O HOH 30 58.094 28.357 -5.125 1.00 20.95 O HETATM 2165 O HOH 31 40.175 7.367 26.612 1.00 12.30 O HETATM 2166 O HOH 32 60.440 25.951 4.967 1.00 17.14 O HETATM 2167 O HOH 33 66.258 16.755 17.122 1.00 16.54 O HETATM 2168 O HOH 34 40.807 23.285 -2.600 1.00 13.67 O HETATM 2169 O HOH 35 33.198 28.157 6.302 1.00 19.94 O HETATM 2170 O HOH 36 56.173 25.414 26.201 1.00 25.25 O HETATM 2171 O HOH 37 61.111 9.856 13.977 1.00 19.81 O HETATM 2172 O HOH 38 32.746 26.177 4.061 1.00 20.39 O HETATM 2173 O HOH 39 64.341 9.760 7.235 1.00 32.44 O HETATM 2174 O HOH 40 42.540 30.721 15.200 1.00 26.98 O HETATM 2175 O HOH 41 55.531 30.960 -7.083 1.00 27.10 O HETATM 2176 O HOH 42 32.569 17.712 14.218 1.00 21.97 O HETATM 2177 O HOH 43 53.826 29.822 19.068 1.00 30.83 O HETATM 2178 O HOH 44 58.324 27.150 6.108 1.00 38.87 O HETATM 2179 O HOH 45 62.141 26.541 -2.215 1.00 29.00 O HETATM 2180 O HOH 46 55.435 31.281 4.606 1.00 26.40 O HETATM 2181 O HOH 47 53.486 6.169 11.955 1.00 39.27 O HETATM 2182 O HOH 48 62.004 18.838 -0.174 1.00 20.88 O HETATM 2183 O HOH 49 64.972 20.082 4.376 1.00 27.87 O HETATM 2184 O HOH 50 57.575 6.095 22.260 1.00 19.18 O HETATM 2185 O HOH 51 48.581 7.194 26.951 1.00 15.80 O HETATM 2186 O HOH 52 34.773 25.459 7.103 1.00 15.17 O HETATM 2187 O HOH 53 57.083 3.742 21.237 1.00 18.01 O HETATM 2188 O HOH 54 49.298 29.547 -10.610 1.00 67.72 O HETATM 2189 O HOH 55 34.975 8.451 12.877 1.00 45.08 O HETATM 2190 O HOH 56 55.455 9.291 3.368 1.00 26.97 O HETATM 2191 O HOH 57 40.168 32.056 15.665 1.00 30.29 O HETATM 2192 O HOH 58 49.779 6.044 9.819 1.00 38.45 O HETATM 2193 O HOH 59 45.832 11.603 23.613 1.00 27.02 O HETATM 2194 O HOH 60 57.607 17.909 25.837 1.00 28.73 O HETATM 2195 O HOH 61 44.615 35.857 9.757 1.00 32.44 O HETATM 2196 O HOH 62 40.092 3.639 23.839 1.00 31.51 O HETATM 2197 O HOH 63 32.466 24.061 6.198 1.00 38.82 O HETATM 2198 O HOH 64 46.606 8.263 1.105 1.00 25.16 O HETATM 2199 O HOH 65 55.263 27.289 20.617 1.00 35.92 O HETATM 2200 O HOH 66 47.135 4.901 19.025 1.00 33.41 O HETATM 2201 O HOH 67 37.896 29.589 18.118 1.00 30.22 O HETATM 2202 O HOH 68 58.582 15.074 -7.756 1.00 29.66 O HETATM 2203 O HOH 69 42.467 33.451 3.026 1.00 37.25 O HETATM 2204 O HOH 70 41.340 34.318 8.398 1.00 32.32 O HETATM 2205 O HOH 71 50.268 19.653 -7.466 1.00 26.02 O HETATM 2206 O HOH 72 51.790 11.629 29.810 1.00 42.06 O HETATM 2207 O HOH 73 57.672 28.149 1.949 1.00 37.56 O HETATM 2208 O HOH 74 53.102 27.299 22.079 1.00 24.57 O HETATM 2209 O HOH 75 34.699 29.065 1.316 1.00 34.11 O HETATM 2210 O HOH 76 29.636 24.018 12.211 1.00 22.06 O HETATM 2211 O HOH 77 37.390 13.668 2.179 1.00 33.04 O HETATM 2212 O HOH 78 43.104 8.386 18.094 1.00 29.62 O HETATM 2213 O HOH 79 41.976 15.264 33.015 1.00 29.74 O HETATM 2214 O HOH 80 50.013 8.825 4.852 1.00 34.04 O HETATM 2215 O HOH 81 42.908 12.052 -3.261 1.00 39.33 O HETATM 2216 O HOH 82 34.238 11.664 10.426 1.00 39.46 O HETATM 2217 O HOH 83 47.920 3.779 16.124 1.00 35.22 O HETATM 2218 O HOH 84 65.819 12.505 4.019 1.00 23.17 O HETATM 2219 O HOH 85 29.967 16.403 4.987 1.00 37.54 O HETATM 2220 O HOH 86 49.905 31.193 -6.931 1.00 25.81 O HETATM 2221 O HOH 87 57.215 16.795 23.502 1.00 26.37 O HETATM 2222 O HOH 88 38.119 21.778 21.651 1.00 32.47 O HETATM 2223 O HOH 89 29.797 21.948 6.567 1.00 34.93 O HETATM 2224 O HOH 90 61.881 20.520 17.899 1.00 28.96 O HETATM 2225 O HOH 91 37.372 24.999 -2.618 1.00 43.40 O HETATM 2226 O HOH 92 46.205 6.316 28.575 1.00 36.11 O HETATM 2227 O HOH 93 40.718 16.593 28.047 1.00 29.47 O HETATM 2228 O HOH 94 38.629 19.198 21.368 1.00 34.61 O HETATM 2229 O HOH 95 44.373 31.908 17.815 1.00 33.79 O HETATM 2230 O HOH 96 40.933 3.828 27.703 1.00 37.21 O HETATM 2231 O HOH 97 39.040 7.625 15.312 1.00 30.93 O HETATM 2232 O HOH 98 49.034 18.306 -11.490 1.00 64.83 O HETATM 2233 O HOH 99 52.217 31.065 20.895 1.00 42.69 O HETATM 2234 O HOH 100 47.825 33.627 20.298 1.00 39.64 O HETATM 2235 O HOH 101 53.973 13.171 30.990 1.00 51.83 O HETATM 2236 O HOH 102 40.906 28.431 -4.626 1.00 32.19 O HETATM 2237 O HOH 103 49.599 28.435 23.483 1.00 31.91 O HETATM 2238 O HOH 104 53.142 15.269 -8.754 1.00 29.07 O HETATM 2239 O HOH 105 56.237 29.508 14.838 1.00 31.77 O HETATM 2240 O HOH 106 43.881 32.059 22.570 1.00 47.48 O HETATM 2241 O HOH 107 63.449 23.071 8.787 1.00 32.36 O HETATM 2242 O HOH 108 63.217 21.326 6.812 1.00 38.59 O HETATM 2243 O HOH 109 47.382 17.768 -8.711 1.00 43.77 O HETATM 2244 O HOH 110 59.603 29.922 14.994 1.00 41.32 O HETATM 2245 O HOH 111 43.121 35.088 5.919 1.00 40.79 O HETATM 2246 O HOH 112 58.082 28.371 10.570 1.00 41.54 O HETATM 2247 O HOH 113 61.016 5.958 14.270 1.00 85.37 O HETATM 2248 O HOH 114 50.267 13.800 -10.446 1.00 69.41 O HETATM 2249 O HOH 115 56.772 16.093 -9.111 1.00 32.43 O HETATM 2250 O HOH 116 35.260 14.017 -0.702 1.00 40.33 O HETATM 2251 O HOH 117 39.490 22.257 -5.498 1.00 54.47 O HETATM 2252 O HOH 118 63.310 6.413 9.210 1.00 49.21 O HETATM 2253 O HOH 119 55.815 14.082 -12.748 1.00 35.29 O HETATM 2254 O HOH 120 43.685 27.491 23.488 1.00 59.17 O HETATM 2255 O HOH 121 51.826 7.186 28.314 1.00 48.54 O HETATM 2256 O HOH 122 47.583 8.350 9.457 1.00 29.51 O HETATM 2257 O HOH 123 50.455 3.189 19.028 1.00 41.84 O HETATM 2258 O HOH 124 44.269 28.709 16.447 1.00 30.45 O HETATM 2259 O HOH 125 48.797 28.944 -8.012 1.00 25.54 O HETATM 2260 N1 FMN A 126 51.795 11.987 21.491 1.00 -0.19 N HETATM 2261 C2 FMN A 126 50.723 11.232 21.040 1.00 0.32 C HETATM 2262 O2 FMN A 126 50.911 10.617 19.850 1.00 -0.39 O HETATM 2263 N3 FMN A 126 49.546 11.076 21.729 1.00 -0.19 N HETATM 2264 C4 FMN A 126 49.390 11.693 22.969 1.00 0.20 C HETATM 2265 O4 FMN A 126 48.242 11.580 23.707 1.00 -0.42 O HETATM 2266 C4A FMN A 126 50.446 12.491 23.467 1.00 0.13 C HETATM 2267 N5 FMN A 126 50.294 13.116 24.695 1.00 -0.32 N HETATM 2268 C5A FMN A 126 51.406 13.727 25.276 1.00 0.06 C HETATM 2269 C6 FMN A 126 51.310 14.205 26.608 1.00 -0.06 C HETATM 2270 C7 FMN A 126 52.469 14.763 27.179 1.00 -0.07 C HETATM 2271 C7M FMN A 126 52.436 15.221 28.559 1.00 -0.04 C HETATM 2272 H5 FMN A 126 51.434 15.050 28.978 1.00 0.04 H HETATM 2273 H6 FMN A 126 52.670 16.295 28.595 1.00 0.04 H HETATM 2274 H7 FMN A 126 53.180 14.664 29.148 1.00 0.04 H HETATM 2275 C8 FMN A 126 53.647 14.877 26.430 1.00 -0.07 C HETATM 2276 C8M FMN A 126 54.866 15.409 26.948 1.00 -0.04 C HETATM 2277 H8 FMN A 126 55.637 15.389 26.164 1.00 0.03 H HETATM 2278 H9 FMN A 126 55.197 14.801 27.803 1.00 0.03 H HETATM 2279 H10 FMN A 126 54.703 16.446 27.276 1.00 0.03 H HETATM 2280 C9 FMN A 126 53.713 14.419 25.085 1.00 -0.06 C HETATM 2281 C9A FMN A 126 52.578 13.814 24.508 1.00 0.07 C HETATM 2282 N10 FMN A 126 52.673 13.394 23.165 1.00 -0.24 N HETATM 2283 C10 FMN A 126 51.602 12.660 22.681 1.00 0.19 C HETATM 2284 C1 FMN A 126 53.820 13.450 22.362 1.00 0.07 C HETATM 2285 C2 FMN A 126 53.959 14.818 21.696 1.00 0.11 C HETATM 2286 O2 FMN A 126 52.834 15.002 20.802 1.00 -0.39 O HETATM 2287 H15 FMN A 126 52.026 14.961 21.299 1.00 0.21 H HETATM 2288 C3 FMN A 126 55.312 14.818 20.948 1.00 0.11 C HETATM 2289 O3 FMN A 126 56.389 15.032 21.894 1.00 -0.39 O HETATM 2290 H17 FMN A 126 56.267 15.868 22.327 1.00 0.21 H HETATM 2291 C4 FMN A 126 55.419 15.799 19.823 1.00 0.11 C HETATM 2292 O4 FMN A 126 56.694 15.573 19.120 1.00 -0.39 O HETATM 2293 H19 FMN A 126 56.714 14.687 18.779 1.00 0.21 H HETATM 2294 C5 FMN A 126 55.411 17.185 20.190 1.00 0.11 C HETATM 2295 O5 FMN A 126 55.198 17.940 18.978 1.00 -0.27 O HETATM 2296 P FMN A 126 55.258 19.578 18.989 1.00 0.20 P HETATM 2297 O1P FMN A 126 54.128 20.343 19.954 1.00 -0.55 O HETATM 2298 O2P FMN A 126 54.960 20.118 17.395 1.00 -0.55 O HETATM 2299 O3P FMN A 126 56.786 20.036 19.399 1.00 -0.55 O HETATM 2300 H20 FMN A 126 56.374 17.462 20.643 1.00 0.06 H HETATM 2301 H21 FMN A 126 54.599 17.382 20.906 1.00 0.06 H HETATM 2302 H18 FMN A 126 54.578 15.618 19.138 1.00 0.06 H HETATM 2303 H16 FMN A 126 55.437 13.816 20.511 1.00 0.06 H HETATM 2304 H14 FMN A 126 53.956 15.616 22.453 1.00 0.06 H HETATM 2305 H12 FMN A 126 53.751 12.677 21.583 1.00 0.06 H HETATM 2306 H13 FMN A 126 54.706 13.263 22.987 1.00 0.06 H HETATM 2307 H11 FMN A 126 54.625 14.534 24.511 1.00 0.04 H HETATM 2308 H4 FMN A 126 50.381 14.143 27.164 1.00 0.04 H HETATM 2309 H3 FMN A 126 49.380 13.129 25.169 1.00 0.18 H HETATM 2310 H2 FMN A 126 48.806 10.524 21.344 1.00 0.22 H HETATM 2311 H1 FMN A 126 52.656 12.041 20.985 1.00 0.24 H CONECT 2260 2261 2283 2311 CONECT 2261 2260 2262 2263 CONECT 2262 2261 CONECT 2263 2261 2264 2310 CONECT 2264 2263 2265 2266 CONECT 2265 2264 CONECT 2266 2264 2267 2283 CONECT 2267 2266 2268 2309 CONECT 2268 2267 2269 2281 CONECT 2269 2268 2270 2308 CONECT 2270 2269 2271 2275 CONECT 2271 2270 2272 2273 2274 CONECT 2272 2271 CONECT 2273 2271 CONECT 2274 2271 CONECT 2275 2270 2276 2280 CONECT 2276 2275 2277 2278 2279 CONECT 2277 2276 CONECT 2278 2276 CONECT 2279 2276 CONECT 2280 2275 2281 2307 CONECT 2281 2268 2280 2282 CONECT 2282 2281 2283 2284 CONECT 2283 2260 2266 2282 CONECT 2284 2282 2285 2305 2306 CONECT 2285 2284 2286 2288 2304 CONECT 2286 2285 2287 CONECT 2287 2286 CONECT 2288 2285 2289 2291 2303 CONECT 2289 2288 2290 CONECT 2290 2289 CONECT 2291 2288 2292 2294 2302 CONECT 2292 2291 2293 CONECT 2293 2292 CONECT 2294 2291 2295 2300 2301 CONECT 2295 2294 2296 CONECT 2296 2295 2297 2298 2299 CONECT 2297 2296 CONECT 2298 2296 CONECT 2299 2296 CONECT 2300 2294 CONECT 2301 2294 CONECT 2302 2291 CONECT 2303 2288 CONECT 2304 2285 CONECT 2305 2284 CONECT 2306 2284 CONECT 2307 2280 CONECT 2308 2269 CONECT 2309 2267 CONECT 2310 2263 CONECT 2311 2260 MASTER 0 0 0 0 0 0 0 0 2310 1 52 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: 1akv
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%
1akw
RCSB PDB
PDBbind
147aa, >1AKW_1|Chain... at 98%
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
1czl
RCSB PDB
PDBbind
FMN sq
Entry Information
PDB ID
1akv
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
flavodoxin
Ligand Name
FMN sq
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=0.0026nM
Release Year
1998
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistryv41;pp.10950-10962
Ligand Properties
Formula
C
1
7
H
2
4
N
4
O
9
P
Molecular Weight
459.368
Exact Mass
459.128
No. of atoms
55
No. of bonds
57
Polar Surface Area
230.64
LOGP Value
-2.43 (
Computed with XLOGP3
)
-1.57 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
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([nH]1)n(C[C@@H]([C@@H]([C@@H](COP(O)(O)O)O)O)O)c1c([nH]2)cc(c(c1)C)C
InChI String
InChI=1S/C17H25N4O9P/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/h3-4,11-12,14,18,22-24,27-29,31H,5-6H2,1-2H3,(H2,19,20,25,26)/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