Browse entries in the PDBbind-CN Database
HEADER 3D9O_COMPLEX COMPND 3D9O_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 B 140 MSE GLU ALA VAL LYS THR PHE ASN SER GLU LEU TYR SER SEQRES 2 B 140 LEU MSE ASP MSE LYS PRO PRO ILE SER LYS ALA LYS MSE SEQRES 3 B 140 THR GLN ILE THR LYS ALA ALA ILE LYS ALA ILE LYS PHE SEQRES 4 B 140 TYR LYS HIS VAL VAL GLN SER VAL GLU LYS PHE ILE GLN SEQRES 5 B 140 LYS CYS LYS PRO GLU TYR LYS VAL PRO GLY LEU TYR VAL SEQRES 6 B 140 ILE ASP SER ILE VAL ARG GLN SER ARG HIS GLN PHE GLY SEQRES 7 B 140 GLN GLU LYS ASP VAL PHE ALA PRO ARG PHE SER ASN ASN SEQRES 8 B 140 ILE ILE SER THR PHE GLN ASN LEU TYR ARG CYS PRO GLY SEQRES 9 B 140 ASP ASP LYS SER LYS ILE VAL ARG VAL LEU ASN LEU TRP SEQRES 10 B 140 GLN LYS ASN ASN VAL PHE LYS SER GLU ILE ILE GLN PRO SEQRES 11 B 140 LEU LEU ASP MSE ALA ALA ALA LEU GLU HIS HET MSE B 1 19 HET MSE B 15 17 HET MSE B 17 17 HET MSE B 26 17 HET MSE B 134 17 HET PRO A 2 124 HETATM 1 N MSE B 1 33.810 24.449 7.659 1.00 53.02 N HETATM 2 CA MSE B 1 32.509 24.284 6.943 1.00 53.38 C HETATM 3 C MSE B 1 31.807 23.005 7.414 1.00 51.06 C HETATM 4 O MSE B 1 31.834 21.976 6.721 1.00 51.31 O HETATM 5 CB MSE B 1 32.725 24.258 5.421 1.00 53.46 C HETATM 6 CG MSE B 1 33.454 25.474 4.856 1.00 54.70 C HETATM 7 SE MSE B 1 33.781 25.383 2.922 1.00 58.68 S HETATM 8 CE MSE B 1 35.092 26.843 2.847 1.00 55.61 C HETATM 9 HE3 MSE B 1 35.427 26.976 1.818 1.00 0.00 H HETATM 10 HE2 MSE B 1 35.945 26.597 3.479 1.00 0.00 H HETATM 11 HE1 MSE B 1 34.629 27.764 3.202 1.00 0.00 H HETATM 12 HG2 MSE B 1 32.853 26.360 5.061 1.00 0.00 H HETATM 13 HG1 MSE B 1 34.415 25.564 5.362 1.00 0.00 H HETATM 14 HB2 MSE B 1 31.748 24.195 4.941 1.00 0.00 H HETATM 15 HB1 MSE B 1 33.307 23.370 5.176 1.00 0.00 H HETATM 16 HA MSE B 1 31.872 25.137 7.177 1.00 0.00 H HETATM 17 HN3 MSE B 1 34.420 23.631 7.460 1.00 0.00 H HETATM 18 HN2 MSE B 1 33.636 24.512 8.682 1.00 0.00 H HETATM 19 HN1 MSE B 1 34.277 25.319 7.332 1.00 0.00 H ATOM 20 N GLU B 2 31.179 23.095 8.590 1.00 49.34 N ATOM 21 CA GLU B 2 30.510 21.962 9.237 1.00 48.20 C ATOM 22 C GLU B 2 29.422 21.327 8.364 1.00 47.39 C ATOM 23 O GLU B 2 29.319 20.098 8.282 1.00 47.12 O ATOM 24 CB GLU B 2 29.919 22.393 10.584 1.00 48.24 C ATOM 25 CG GLU B 2 29.470 21.235 11.465 1.00 48.30 C ATOM 26 CD GLU B 2 28.602 21.675 12.625 1.00 48.20 C ATOM 27 OE1 GLU B 2 29.126 22.323 13.556 1.00 48.77 O ATOM 28 OE2 GLU B 2 27.395 21.353 12.611 1.00 48.02 O ATOM 29 HA GLU B 2 31.272 21.199 9.395 1.00 0.00 H ATOM 30 HB2 GLU B 2 30.676 22.961 11.124 1.00 0.00 H ATOM 31 HB3 GLU B 2 29.057 23.031 10.391 1.00 0.00 H ATOM 32 HG2 GLU B 2 28.903 20.533 10.854 1.00 0.00 H ATOM 33 HG3 GLU B 2 30.355 20.737 11.862 1.00 0.00 H ATOM 34 H GLU B 2 31.164 24.017 9.071 1.00 0.00 H ATOM 35 N ALA B 3 28.611 22.168 7.718 1.00 45.87 N ATOM 36 CA ALA B 3 27.539 21.691 6.846 1.00 43.76 C ATOM 37 C ALA B 3 28.096 20.914 5.656 1.00 42.63 C ATOM 38 O ALA B 3 27.479 19.957 5.182 1.00 42.13 O ATOM 39 CB ALA B 3 26.673 22.859 6.374 1.00 43.92 C ATOM 40 HA ALA B 3 26.915 21.009 7.423 1.00 0.00 H ATOM 41 HB1 ALA B 3 26.232 23.356 7.239 1.00 0.00 H ATOM 42 HB2 ALA B 3 27.290 23.568 5.822 1.00 0.00 H ATOM 43 HB3 ALA B 3 25.881 22.484 5.726 1.00 0.00 H ATOM 44 H ALA B 3 28.746 23.192 7.839 1.00 0.00 H ATOM 45 N VAL B 4 29.266 21.331 5.178 1.00 41.13 N ATOM 46 CA VAL B 4 29.943 20.627 4.093 1.00 40.24 C ATOM 47 C VAL B 4 30.506 19.277 4.591 1.00 38.73 C ATOM 48 O VAL B 4 30.368 18.271 3.895 1.00 38.62 O ATOM 49 CB VAL B 4 31.020 21.527 3.408 1.00 40.46 C ATOM 50 CG1 VAL B 4 31.955 20.719 2.510 1.00 41.35 C ATOM 51 CG2 VAL B 4 30.339 22.621 2.593 1.00 40.36 C ATOM 52 HA VAL B 4 29.212 20.398 3.317 1.00 0.00 H ATOM 53 HB VAL B 4 31.625 21.974 4.197 1.00 0.00 H ATOM 54 HG11 VAL B 4 32.470 19.966 3.107 1.00 0.00 H ATOM 55 HG12 VAL B 4 31.373 20.229 1.729 1.00 0.00 H ATOM 56 HG13 VAL B 4 32.687 21.387 2.055 1.00 0.00 H ATOM 57 HG21 VAL B 4 29.711 22.165 1.828 1.00 0.00 H ATOM 58 HG22 VAL B 4 29.724 23.234 3.252 1.00 0.00 H ATOM 59 HG23 VAL B 4 31.097 23.244 2.119 1.00 0.00 H ATOM 60 H VAL B 4 29.709 22.179 5.587 1.00 0.00 H ATOM 61 N LYS B 5 31.099 19.271 5.793 1.00 37.65 N ATOM 62 CA LYS B 5 31.617 18.043 6.447 1.00 36.20 C ATOM 63 C LYS B 5 30.519 16.976 6.567 1.00 35.45 C ATOM 64 O LYS B 5 30.765 15.793 6.293 1.00 35.23 O ATOM 65 CB LYS B 5 32.216 18.340 7.841 1.00 36.54 C ATOM 66 CG LYS B 5 33.595 19.018 7.870 1.00 36.24 C ATOM 67 CD LYS B 5 34.221 18.936 9.289 1.00 37.57 C ATOM 68 CE LYS B 5 35.300 19.990 9.521 1.00 37.11 C ATOM 69 NZ LYS B 5 36.021 19.801 10.853 1.00 39.35 N ATOM 70 HA LYS B 5 32.415 17.660 5.811 1.00 0.00 H ATOM 71 HB2 LYS B 5 31.518 18.989 8.369 1.00 0.00 H ATOM 72 HB3 LYS B 5 32.302 17.392 8.372 1.00 0.00 H ATOM 73 HG2 LYS B 5 34.254 18.519 7.159 1.00 0.00 H ATOM 74 HG3 LYS B 5 33.485 20.065 7.588 1.00 0.00 H ATOM 75 HD2 LYS B 5 33.431 19.077 10.027 1.00 0.00 H ATOM 76 HD3 LYS B 5 34.665 17.949 9.418 1.00 0.00 H ATOM 77 HE2 LYS B 5 34.835 20.976 9.511 1.00 0.00 H ATOM 78 HE3 LYS B 5 36.031 19.927 8.715 1.00 0.00 H ATOM 79 HZ1 LYS B 5 35.333 19.868 11.630 1.00 0.00 H ATOM 80 HZ2 LYS B 5 36.476 18.866 10.870 1.00 0.00 H ATOM 81 HZ3 LYS B 5 36.743 20.541 10.963 1.00 0.00 H ATOM 82 H LYS B 5 31.202 20.176 6.295 1.00 0.00 H ATOM 83 N THR B 6 29.312 17.416 6.974 1.00 33.98 N ATOM 84 CA THR B 6 28.104 16.578 7.020 1.00 32.84 C ATOM 85 C THR B 6 27.646 16.099 5.629 1.00 32.17 C ATOM 86 O THR B 6 27.289 14.922 5.458 1.00 32.15 O ATOM 87 CB THR B 6 26.947 17.335 7.709 1.00 32.90 C ATOM 88 OG1 THR B 6 27.360 17.740 9.018 1.00 32.24 O ATOM 89 CG2 THR B 6 25.672 16.476 7.799 1.00 32.47 C ATOM 90 HA THR B 6 28.370 15.692 7.597 1.00 0.00 H ATOM 91 HB THR B 6 26.707 18.210 7.106 1.00 0.00 H ATOM 92 HG1 THR B 6 28.148 18.334 8.945 1.00 0.00 H ATOM 93 HG23 THR B 6 25.367 16.174 6.797 1.00 0.00 H ATOM 94 HG21 THR B 6 25.874 15.590 8.401 1.00 0.00 H ATOM 95 HG22 THR B 6 24.875 17.058 8.262 1.00 0.00 H ATOM 96 H THR B 6 29.230 18.408 7.274 1.00 0.00 H ATOM 97 N PHE B 7 27.642 17.001 4.642 1.00 31.14 N ATOM 98 CA PHE B 7 27.400 16.587 3.259 1.00 29.68 C ATOM 99 C PHE B 7 28.429 15.553 2.773 1.00 29.02 C ATOM 100 O PHE B 7 28.051 14.526 2.225 1.00 28.18 O ATOM 101 CB PHE B 7 27.352 17.753 2.265 1.00 29.50 C ATOM 102 CG PHE B 7 27.229 17.290 0.832 1.00 29.34 C ATOM 103 CD1 PHE B 7 26.019 16.816 0.353 1.00 26.86 C ATOM 104 CD2 PHE B 7 28.352 17.248 -0.007 1.00 28.86 C ATOM 105 CE1 PHE B 7 25.911 16.334 -0.959 1.00 29.21 C ATOM 106 CE2 PHE B 7 28.259 16.787 -1.310 1.00 26.77 C ATOM 107 CZ PHE B 7 27.031 16.330 -1.796 1.00 28.31 C ATOM 108 HA PHE B 7 26.411 16.130 3.283 1.00 0.00 H ATOM 109 HB2 PHE B 7 26.494 18.381 2.504 1.00 0.00 H ATOM 110 HB3 PHE B 7 28.267 18.336 2.366 1.00 0.00 H ATOM 111 HD2 PHE B 7 29.316 17.585 0.373 1.00 0.00 H ATOM 112 HE2 PHE B 7 29.139 16.781 -1.953 1.00 0.00 H ATOM 113 HZ PHE B 7 26.947 15.972 -2.822 1.00 0.00 H ATOM 114 HE1 PHE B 7 24.954 15.963 -1.326 1.00 0.00 H ATOM 115 HD1 PHE B 7 25.143 16.818 1.002 1.00 0.00 H ATOM 116 H PHE B 7 27.812 18.004 4.858 1.00 0.00 H ATOM 117 N ASN B 8 29.716 15.855 2.946 1.00 28.73 N ATOM 118 CA ASN B 8 30.784 14.932 2.546 1.00 29.03 C ATOM 119 C ASN B 8 30.592 13.529 3.112 1.00 28.14 C ATOM 120 O ASN B 8 30.765 12.552 2.385 1.00 28.19 O ATOM 121 CB ASN B 8 32.168 15.483 2.907 1.00 29.17 C ATOM 122 CG ASN B 8 32.558 16.700 2.060 1.00 30.72 C ATOM 123 OD1 ASN B 8 32.092 16.868 0.934 1.00 33.18 O ATOM 124 ND2 ASN B 8 33.430 17.536 2.599 1.00 33.02 N ATOM 125 HA ASN B 8 30.723 14.847 1.461 1.00 0.00 H ATOM 126 HB2 ASN B 8 32.165 15.775 3.957 1.00 0.00 H ATOM 127 HB3 ASN B 8 32.908 14.698 2.752 1.00 0.00 H ATOM 128 HD22 ASN B 8 33.800 17.357 3.554 1.00 0.00 H ATOM 129 HD21 ASN B 8 33.746 18.372 2.067 1.00 0.00 H ATOM 130 H ASN B 8 29.969 16.768 3.375 1.00 0.00 H ATOM 131 N SER B 9 30.208 13.442 4.388 1.00 27.15 N ATOM 132 CA SER B 9 29.918 12.153 5.039 1.00 26.55 C ATOM 133 C SER B 9 28.776 11.377 4.355 1.00 26.91 C ATOM 134 O SER B 9 28.894 10.167 4.119 1.00 26.57 O ATOM 135 CB SER B 9 29.586 12.358 6.519 1.00 26.49 C ATOM 136 OG SER B 9 30.768 12.464 7.302 1.00 23.90 O ATOM 137 HA SER B 9 30.822 11.552 4.943 1.00 0.00 H ATOM 138 HB2 SER B 9 29.000 11.510 6.873 1.00 0.00 H ATOM 139 HB3 SER B 9 29.003 13.272 6.629 1.00 0.00 H ATOM 140 HG SER B 9 31.299 11.634 7.209 1.00 0.00 H ATOM 141 H SER B 9 30.110 14.316 4.942 1.00 0.00 H ATOM 142 N GLU B 10 27.674 12.065 4.058 1.00 26.58 N ATOM 143 CA GLU B 10 26.527 11.428 3.396 1.00 27.93 C ATOM 144 C GLU B 10 26.898 10.927 2.003 1.00 27.75 C ATOM 145 O GLU B 10 26.603 9.785 1.636 1.00 27.97 O ATOM 146 CB GLU B 10 25.327 12.385 3.305 1.00 27.96 C ATOM 147 CG GLU B 10 24.717 12.764 4.661 1.00 31.36 C ATOM 148 CD GLU B 10 24.207 11.568 5.457 1.00 33.30 C ATOM 149 OE1 GLU B 10 23.693 10.596 4.857 1.00 36.29 O ATOM 150 OE2 GLU B 10 24.312 11.612 6.692 1.00 35.71 O ATOM 151 HA GLU B 10 26.241 10.573 4.009 1.00 0.00 H ATOM 152 HB2 GLU B 10 25.656 13.299 2.811 1.00 0.00 H ATOM 153 HB3 GLU B 10 24.553 11.907 2.704 1.00 0.00 H ATOM 154 HG2 GLU B 10 25.479 13.272 5.252 1.00 0.00 H ATOM 155 HG3 GLU B 10 23.882 13.443 4.486 1.00 0.00 H ATOM 156 H GLU B 10 27.625 13.075 4.300 1.00 0.00 H ATOM 157 N LEU B 11 27.553 11.786 1.238 1.00 27.78 N ATOM 158 CA LEU B 11 27.968 11.437 -0.109 1.00 28.22 C ATOM 159 C LEU B 11 28.919 10.248 -0.104 1.00 28.05 C ATOM 160 O LEU B 11 28.748 9.306 -0.875 1.00 27.69 O ATOM 161 CB LEU B 11 28.620 12.636 -0.807 1.00 28.24 C ATOM 162 CG LEU B 11 29.200 12.369 -2.200 1.00 27.93 C ATOM 163 CD1 LEU B 11 28.125 11.943 -3.227 1.00 29.72 C ATOM 164 CD2 LEU B 11 29.959 13.586 -2.669 1.00 27.82 C ATOM 165 HA LEU B 11 27.074 11.154 -0.665 1.00 0.00 H ATOM 166 HB2 LEU B 11 27.865 13.417 -0.904 1.00 0.00 H ATOM 167 HB3 LEU B 11 29.430 12.992 -0.171 1.00 0.00 H ATOM 168 HG LEU B 11 29.884 11.524 -2.121 1.00 0.00 H ATOM 169 HD21 LEU B 11 29.283 14.440 -2.713 1.00 0.00 H ATOM 170 HD22 LEU B 11 30.769 13.798 -1.971 1.00 0.00 H ATOM 171 HD23 LEU B 11 30.371 13.396 -3.660 1.00 0.00 H ATOM 172 HD11 LEU B 11 27.642 11.027 -2.886 1.00 0.00 H ATOM 173 HD12 LEU B 11 27.381 12.734 -3.322 1.00 0.00 H ATOM 174 HD13 LEU B 11 28.597 11.768 -4.194 1.00 0.00 H ATOM 175 H LEU B 11 27.775 12.731 1.610 1.00 0.00 H ATOM 176 N TYR B 12 29.925 10.280 0.758 1.00 28.34 N ATOM 177 CA TYR B 12 30.847 9.154 0.787 1.00 28.66 C ATOM 178 C TYR B 12 30.240 7.873 1.380 1.00 28.86 C ATOM 179 O TYR B 12 30.677 6.783 1.038 1.00 28.10 O ATOM 180 CB TYR B 12 32.085 9.535 1.624 1.00 28.48 C ATOM 181 CG TYR B 12 33.296 8.628 1.464 1.00 28.49 C ATOM 182 CD1 TYR B 12 34.309 8.950 0.560 1.00 28.21 C ATOM 183 CD2 TYR B 12 33.443 7.464 2.233 1.00 27.99 C ATOM 184 CE1 TYR B 12 35.424 8.132 0.407 1.00 28.59 C ATOM 185 CE2 TYR B 12 34.550 6.638 2.081 1.00 27.82 C ATOM 186 CZ TYR B 12 35.538 6.980 1.168 1.00 28.03 C ATOM 187 OH TYR B 12 36.642 6.180 1.008 1.00 28.20 O ATOM 188 HA TYR B 12 31.105 8.941 -0.250 1.00 0.00 H ATOM 189 HB3 TYR B 12 31.795 9.524 2.675 1.00 0.00 H ATOM 190 HB2 TYR B 12 32.383 10.545 1.341 1.00 0.00 H ATOM 191 HD2 TYR B 12 32.676 7.203 2.962 1.00 0.00 H ATOM 192 HE2 TYR B 12 34.642 5.728 2.674 1.00 0.00 H ATOM 193 HE1 TYR B 12 36.204 8.396 -0.308 1.00 0.00 H ATOM 194 HD1 TYR B 12 34.225 9.858 -0.037 1.00 0.00 H ATOM 195 HH TYR B 12 37.237 6.574 0.322 1.00 0.00 H ATOM 196 H TYR B 12 30.053 11.090 1.398 1.00 0.00 H ATOM 197 N SER B 13 29.184 8.004 2.186 1.00 29.48 N ATOM 198 CA SER B 13 28.463 6.826 2.716 1.00 30.31 C ATOM 199 C SER B 13 27.845 5.965 1.595 1.00 31.36 C ATOM 200 O SER B 13 27.419 4.833 1.844 1.00 31.32 O ATOM 201 CB SER B 13 27.376 7.232 3.721 1.00 30.11 C ATOM 202 OG SER B 13 26.259 7.823 3.055 1.00 28.96 O ATOM 203 HA SER B 13 29.209 6.222 3.233 1.00 0.00 H ATOM 204 HB2 SER B 13 27.793 7.951 4.426 1.00 0.00 H ATOM 205 HB3 SER B 13 27.042 6.347 4.262 1.00 0.00 H ATOM 206 HG SER B 13 26.557 8.630 2.566 1.00 0.00 H ATOM 207 H SER B 13 28.860 8.957 2.448 1.00 0.00 H ATOM 208 N LEU B 14 27.791 6.507 0.376 1.00 32.76 N ATOM 209 CA LEU B 14 27.447 5.715 -0.812 1.00 34.60 C ATOM 210 C LEU B 14 28.361 4.493 -0.951 1.00 36.29 C ATOM 211 O LEU B 14 27.916 3.437 -1.396 1.00 36.82 O ATOM 212 CB LEU B 14 27.495 6.559 -2.091 1.00 34.00 C ATOM 213 CG LEU B 14 26.403 7.610 -2.367 1.00 33.93 C ATOM 214 CD1 LEU B 14 26.639 8.308 -3.694 1.00 32.60 C ATOM 215 CD2 LEU B 14 25.004 7.006 -2.339 1.00 34.48 C ATOM 216 HA LEU B 14 26.423 5.368 -0.674 1.00 0.00 H ATOM 217 HB2 LEU B 14 28.447 7.090 -2.081 1.00 0.00 H ATOM 218 HB3 LEU B 14 27.478 5.861 -2.928 1.00 0.00 H ATOM 219 HG LEU B 14 26.467 8.344 -1.564 1.00 0.00 H ATOM 220 HD21 LEU B 14 24.929 6.230 -3.101 1.00 0.00 H ATOM 221 HD22 LEU B 14 24.817 6.572 -1.357 1.00 0.00 H ATOM 222 HD23 LEU B 14 24.269 7.786 -2.539 1.00 0.00 H ATOM 223 HD11 LEU B 14 27.607 8.808 -3.673 1.00 0.00 H ATOM 224 HD12 LEU B 14 26.626 7.572 -4.498 1.00 0.00 H ATOM 225 HD13 LEU B 14 25.852 9.044 -3.861 1.00 0.00 H ATOM 226 H LEU B 14 27.999 7.520 0.264 1.00 0.00 H HETATM 227 N MSE B 15 29.623 4.639 -0.544 1.00 38.62 N HETATM 228 CA MSE B 15 30.607 3.541 -0.571 1.00 41.03 C HETATM 229 C MSE B 15 30.233 2.364 0.335 1.00 41.33 C HETATM 230 O MSE B 15 30.721 1.248 0.139 1.00 41.41 O HETATM 231 CB MSE B 15 32.006 4.030 -0.169 1.00 42.70 C HETATM 232 CG MSE B 15 32.585 5.208 -0.938 1.00 46.36 C HETATM 233 SE MSE B 15 32.385 5.130 -2.870 1.00 60.32 S HETATM 234 CE MSE B 15 33.819 6.402 -3.316 1.00 51.31 C HETATM 235 HE3 MSE B 15 33.882 6.511 -4.399 1.00 0.00 H HETATM 236 HE2 MSE B 15 34.768 6.028 -2.931 1.00 0.00 H HETATM 237 HE1 MSE B 15 33.598 7.369 -2.864 1.00 0.00 H HETATM 238 HG2 MSE B 15 32.092 6.114 -0.586 1.00 0.00 H HETATM 239 HG1 MSE B 15 33.650 5.265 -0.713 1.00 0.00 H HETATM 240 HB2 MSE B 15 32.692 3.192 -0.289 1.00 0.00 H HETATM 241 HB1 MSE B 15 31.963 4.315 0.882 1.00 0.00 H HETATM 242 HA MSE B 15 30.607 3.192 -1.604 1.00 0.00 H HETATM 243 H MSE B 15 29.927 5.569 -0.192 1.00 0.00 H ATOM 244 N ASP B 16 29.391 2.626 1.334 1.00 41.88 N ATOM 245 CA ASP B 16 28.958 1.612 2.298 1.00 42.62 C ATOM 246 C ASP B 16 27.769 0.785 1.794 1.00 43.51 C ATOM 247 O ASP B 16 27.202 -0.018 2.542 1.00 43.32 O ATOM 248 CB ASP B 16 28.591 2.272 3.634 1.00 42.33 C ATOM 249 CG ASP B 16 29.755 3.027 4.261 1.00 41.73 C ATOM 250 OD1 ASP B 16 30.781 2.384 4.597 1.00 39.80 O ATOM 251 OD2 ASP B 16 29.627 4.271 4.429 1.00 40.54 O ATOM 252 HA ASP B 16 29.798 0.931 2.434 1.00 0.00 H ATOM 253 HB2 ASP B 16 27.773 2.972 3.463 1.00 0.00 H ATOM 254 HB3 ASP B 16 28.265 1.497 4.327 1.00 0.00 H ATOM 255 H ASP B 16 29.025 3.594 1.434 1.00 0.00 H HETATM 256 N MSE B 17 27.396 0.983 0.531 1.00 44.45 N HETATM 257 CA MSE B 17 26.221 0.330 -0.050 1.00 46.38 C HETATM 258 C MSE B 17 26.441 -0.124 -1.483 1.00 44.24 C HETATM 259 O MSE B 17 27.093 0.558 -2.270 1.00 44.19 O HETATM 260 CB MSE B 17 25.031 1.285 -0.039 1.00 46.06 C HETATM 261 CG MSE B 17 24.471 1.595 1.332 1.00 48.39 C HETATM 262 SE MSE B 17 23.551 3.299 1.249 1.00 54.47 S HETATM 263 CE MSE B 17 22.108 2.813 -0.014 1.00 50.23 C HETATM 264 HE3 MSE B 17 21.469 3.680 -0.185 1.00 0.00 H HETATM 265 HE2 MSE B 17 21.516 2.001 0.408 1.00 0.00 H HETATM 266 HE1 MSE B 17 22.547 2.491 -0.959 1.00 0.00 H HETATM 267 HG2 MSE B 17 23.772 0.813 1.629 1.00 0.00 H HETATM 268 HG1 MSE B 17 25.283 1.650 2.057 1.00 0.00 H HETATM 269 HB2 MSE B 17 24.235 0.841 -0.637 1.00 0.00 H HETATM 270 HB1 MSE B 17 25.346 2.223 -0.496 1.00 0.00 H HETATM 271 HA MSE B 17 26.031 -0.550 0.564 1.00 0.00 H HETATM 272 H MSE B 17 27.959 1.624 -0.064 1.00 0.00 H ATOM 273 N LYS B 18 25.864 -1.273 -1.815 1.00 42.78 N ATOM 274 CA LYS B 18 25.858 -1.780 -3.178 1.00 41.44 C ATOM 275 C LYS B 18 24.705 -1.123 -3.942 1.00 40.07 C ATOM 276 O LYS B 18 23.568 -1.137 -3.467 1.00 39.88 O ATOM 277 CB LYS B 18 25.713 -3.315 -3.159 1.00 41.52 C ATOM 278 CG LYS B 18 25.667 -3.999 -4.527 1.00 41.80 C ATOM 279 CD LYS B 18 25.298 -5.484 -4.385 1.00 42.29 C ATOM 280 CE LYS B 18 24.874 -6.111 -5.713 1.00 43.82 C ATOM 281 NZ LYS B 18 23.701 -5.412 -6.333 1.00 44.40 N ATOM 282 HA LYS B 18 26.795 -1.538 -3.679 1.00 0.00 H ATOM 283 HB2 LYS B 18 26.561 -3.724 -2.609 1.00 0.00 H ATOM 284 HB3 LYS B 18 24.789 -3.557 -2.633 1.00 0.00 H ATOM 285 HG2 LYS B 18 24.922 -3.504 -5.149 1.00 0.00 H ATOM 286 HG3 LYS B 18 26.646 -3.918 -5.000 1.00 0.00 H ATOM 287 HD2 LYS B 18 26.164 -6.025 -4.003 1.00 0.00 H ATOM 288 HD3 LYS B 18 24.474 -5.574 -3.677 1.00 0.00 H ATOM 289 HE2 LYS B 18 24.607 -7.153 -5.538 1.00 0.00 H ATOM 290 HE3 LYS B 18 25.714 -6.064 -6.405 1.00 0.00 H ATOM 291 HZ1 LYS B 18 22.889 -5.458 -5.684 1.00 0.00 H ATOM 292 HZ2 LYS B 18 23.947 -4.418 -6.513 1.00 0.00 H ATOM 293 HZ3 LYS B 18 23.456 -5.878 -7.230 1.00 0.00 H ATOM 294 H LYS B 18 25.398 -1.832 -1.072 1.00 0.00 H ATOM 295 N PRO B 19 24.997 -0.517 -5.114 1.00 38.89 N ATOM 296 CA PRO B 19 23.940 0.031 -5.970 1.00 38.08 C ATOM 297 C PRO B 19 22.969 -1.069 -6.425 1.00 37.30 C ATOM 298 O PRO B 19 23.394 -2.212 -6.606 1.00 37.45 O ATOM 299 CB PRO B 19 24.713 0.603 -7.165 1.00 38.01 C ATOM 300 CG PRO B 19 26.096 0.796 -6.677 1.00 38.58 C ATOM 301 CD PRO B 19 26.332 -0.307 -5.700 1.00 38.62 C ATOM 302 HA PRO B 19 23.326 0.774 -5.461 1.00 0.00 H ATOM 303 HD3 PRO B 19 26.687 -1.207 -6.202 1.00 0.00 H ATOM 304 HD2 PRO B 19 27.053 -0.009 -4.938 1.00 0.00 H ATOM 305 HG3 PRO B 19 26.196 1.765 -6.189 1.00 0.00 H ATOM 306 HG2 PRO B 19 26.804 0.732 -7.503 1.00 0.00 H ATOM 307 HB2 PRO B 19 24.697 -0.096 -8.001 1.00 0.00 H ATOM 308 HB3 PRO B 19 24.282 1.554 -7.479 1.00 0.00 H ATOM 309 N PRO B 20 21.677 -0.733 -6.630 1.00 36.40 N ATOM 310 CA PRO B 20 21.108 0.617 -6.670 1.00 35.53 C ATOM 311 C PRO B 20 20.920 1.254 -5.295 1.00 34.60 C ATOM 312 O PRO B 20 20.596 0.569 -4.314 1.00 34.19 O ATOM 313 CB PRO B 20 19.752 0.401 -7.351 1.00 35.76 C ATOM 314 CG PRO B 20 19.357 -0.971 -6.932 1.00 36.00 C ATOM 315 CD PRO B 20 20.641 -1.763 -6.838 1.00 36.38 C ATOM 316 HA PRO B 20 21.772 1.308 -7.188 1.00 0.00 H ATOM 317 HD3 PRO B 20 20.609 -2.457 -5.998 1.00 0.00 H ATOM 318 HD2 PRO B 20 20.824 -2.317 -7.759 1.00 0.00 H ATOM 319 HG3 PRO B 20 18.690 -1.416 -7.671 1.00 0.00 H ATOM 320 HG2 PRO B 20 18.857 -0.943 -5.964 1.00 0.00 H ATOM 321 HB2 PRO B 20 19.024 1.136 -7.009 1.00 0.00 H ATOM 322 HB3 PRO B 20 19.847 0.464 -8.435 1.00 0.00 H ATOM 323 N ILE B 21 21.133 2.565 -5.251 1.00 33.49 N ATOM 324 CA ILE B 21 21.009 3.342 -4.028 1.00 32.56 C ATOM 325 C ILE B 21 19.530 3.588 -3.727 1.00 32.42 C ATOM 326 O ILE B 21 18.740 3.856 -4.633 1.00 31.79 O ATOM 327 CB ILE B 21 21.805 4.669 -4.140 1.00 32.57 C ATOM 328 CG1 ILE B 21 23.254 4.406 -4.590 1.00 31.50 C ATOM 329 CG2 ILE B 21 21.772 5.444 -2.832 1.00 31.97 C ATOM 330 CD1 ILE B 21 24.075 3.478 -3.649 1.00 31.04 C ATOM 331 HA ILE B 21 21.437 2.783 -3.196 1.00 0.00 H ATOM 332 HB ILE B 21 21.322 5.283 -4.901 1.00 0.00 H ATOM 333 HG12 ILE B 21 23.224 3.946 -5.578 1.00 0.00 H ATOM 334 HG13 ILE B 21 23.768 5.365 -4.653 1.00 0.00 H ATOM 335 HD11 ILE B 21 24.131 3.927 -2.657 1.00 0.00 H ATOM 336 HD12 ILE B 21 23.586 2.506 -3.582 1.00 0.00 H ATOM 337 HD13 ILE B 21 25.081 3.354 -4.051 1.00 0.00 H ATOM 338 HG21 ILE B 21 20.739 5.679 -2.576 1.00 0.00 H ATOM 339 HG22 ILE B 21 22.215 4.839 -2.041 1.00 0.00 H ATOM 340 HG23 ILE B 21 22.339 6.368 -2.944 1.00 0.00 H ATOM 341 H ILE B 21 21.400 3.056 -6.128 1.00 0.00 H ATOM 342 N SER B 22 19.156 3.454 -2.457 1.00 32.46 N ATOM 343 CA SER B 22 17.777 3.681 -2.034 1.00 32.81 C ATOM 344 C SER B 22 17.400 5.165 -2.091 1.00 33.15 C ATOM 345 O SER B 22 18.262 6.044 -2.011 1.00 32.30 O ATOM 346 CB SER B 22 17.552 3.131 -0.624 1.00 32.77 C ATOM 347 OG SER B 22 18.245 3.904 0.338 1.00 33.44 O ATOM 348 HA SER B 22 17.130 3.149 -2.732 1.00 0.00 H ATOM 349 HB2 SER B 22 17.910 2.103 -0.581 1.00 0.00 H ATOM 350 HB3 SER B 22 16.486 3.153 -0.398 1.00 0.00 H ATOM 351 HG SER B 22 18.084 3.529 1.240 1.00 0.00 H ATOM 352 H SER B 22 19.865 3.180 -1.747 1.00 0.00 H ATOM 353 N LYS B 23 16.100 5.413 -2.250 1.00 33.80 N ATOM 354 CA LYS B 23 15.487 6.738 -2.120 1.00 34.41 C ATOM 355 C LYS B 23 15.820 7.369 -0.772 1.00 34.12 C ATOM 356 O LYS B 23 16.085 8.564 -0.697 1.00 34.25 O ATOM 357 CB LYS B 23 13.954 6.626 -2.220 1.00 34.26 C ATOM 358 CG LYS B 23 13.390 6.478 -3.623 1.00 34.72 C ATOM 359 CD LYS B 23 11.887 6.195 -3.548 1.00 35.28 C ATOM 360 CE LYS B 23 11.260 5.948 -4.917 1.00 36.50 C ATOM 361 NZ LYS B 23 9.819 5.547 -4.767 1.00 36.61 N ATOM 362 HA LYS B 23 15.882 7.358 -2.925 1.00 0.00 H ATOM 363 HB2 LYS B 23 13.644 5.756 -1.641 1.00 0.00 H ATOM 364 HB3 LYS B 23 13.524 7.526 -1.780 1.00 0.00 H ATOM 365 HG2 LYS B 23 13.558 7.399 -4.180 1.00 0.00 H ATOM 366 HG3 LYS B 23 13.890 5.652 -4.129 1.00 0.00 H ATOM 367 HD2 LYS B 23 11.730 5.312 -2.929 1.00 0.00 H ATOM 368 HD3 LYS B 23 11.394 7.052 -3.089 1.00 0.00 H ATOM 369 HE2 LYS B 23 11.804 5.151 -5.423 1.00 0.00 H ATOM 370 HE3 LYS B 23 11.320 6.861 -5.510 1.00 0.00 H ATOM 371 HZ1 LYS B 23 9.760 4.675 -4.204 1.00 0.00 H ATOM 372 HZ2 LYS B 23 9.297 6.307 -4.286 1.00 0.00 H ATOM 373 HZ3 LYS B 23 9.407 5.382 -5.707 1.00 0.00 H ATOM 374 H LYS B 23 15.479 4.612 -2.482 1.00 0.00 H ATOM 375 N ALA B 24 15.778 6.556 0.285 1.00 34.27 N ATOM 376 CA ALA B 24 16.062 7.013 1.648 1.00 34.19 C ATOM 377 C ALA B 24 17.473 7.602 1.785 1.00 34.09 C ATOM 378 O ALA B 24 17.654 8.655 2.400 1.00 34.14 O ATOM 379 CB ALA B 24 15.851 5.889 2.638 1.00 33.95 C ATOM 380 HA ALA B 24 15.360 7.817 1.871 1.00 0.00 H ATOM 381 HB1 ALA B 24 14.816 5.550 2.586 1.00 0.00 H ATOM 382 HB2 ALA B 24 16.518 5.062 2.395 1.00 0.00 H ATOM 383 HB3 ALA B 24 16.067 6.248 3.644 1.00 0.00 H ATOM 384 H ALA B 24 15.534 5.556 0.135 1.00 0.00 H ATOM 385 N LYS B 25 18.460 6.919 1.210 1.00 33.88 N ATOM 386 CA LYS B 25 19.836 7.403 1.212 1.00 33.49 C ATOM 387 C LYS B 25 19.985 8.636 0.324 1.00 33.49 C ATOM 388 O LYS B 25 20.692 9.577 0.681 1.00 33.07 O ATOM 389 CB LYS B 25 20.810 6.294 0.788 1.00 33.57 C ATOM 390 CG LYS B 25 22.258 6.757 0.496 1.00 32.72 C ATOM 391 CD LYS B 25 22.920 7.482 1.677 1.00 33.78 C ATOM 392 CE LYS B 25 23.057 6.606 2.916 1.00 34.62 C ATOM 393 NZ LYS B 25 23.547 7.391 4.087 1.00 35.08 N ATOM 394 HA LYS B 25 20.087 7.695 2.232 1.00 0.00 H ATOM 395 HB2 LYS B 25 20.848 5.555 1.589 1.00 0.00 H ATOM 396 HB3 LYS B 25 20.417 5.828 -0.116 1.00 0.00 H ATOM 397 HG2 LYS B 25 22.857 5.881 0.249 1.00 0.00 H ATOM 398 HG3 LYS B 25 22.238 7.434 -0.358 1.00 0.00 H ATOM 399 HD2 LYS B 25 23.914 7.808 1.371 1.00 0.00 H ATOM 400 HD3 LYS B 25 22.316 8.353 1.933 1.00 0.00 H ATOM 401 HE2 LYS B 25 23.764 5.803 2.706 1.00 0.00 H ATOM 402 HE3 LYS B 25 22.084 6.178 3.158 1.00 0.00 H ATOM 403 HZ1 LYS B 25 24.478 7.798 3.865 1.00 0.00 H ATOM 404 HZ2 LYS B 25 22.874 8.156 4.296 1.00 0.00 H ATOM 405 HZ3 LYS B 25 23.629 6.764 4.913 1.00 0.00 H ATOM 406 H LYS B 25 18.244 6.014 0.746 1.00 0.00 H HETATM 407 N MSE B 26 19.318 8.630 -0.828 1.00 33.23 N HETATM 408 CA MSE B 26 19.400 9.759 -1.743 1.00 33.68 C HETATM 409 C MSE B 26 18.808 11.013 -1.099 1.00 32.44 C HETATM 410 O MSE B 26 19.346 12.108 -1.265 1.00 31.48 O HETATM 411 CB MSE B 26 18.711 9.449 -3.066 1.00 34.34 C HETATM 412 CG MSE B 26 19.227 10.292 -4.205 1.00 39.49 C HETATM 413 SE MSE B 26 21.078 9.855 -4.672 1.00 51.65 S HETATM 414 CE MSE B 26 20.848 8.046 -5.326 1.00 49.53 C HETATM 415 HE3 MSE B 26 21.814 7.647 -5.635 1.00 0.00 H HETATM 416 HE2 MSE B 26 20.167 8.053 -6.177 1.00 0.00 H HETATM 417 HE1 MSE B 26 20.434 7.424 -4.532 1.00 0.00 H HETATM 418 HG2 MSE B 26 18.596 10.126 -5.078 1.00 0.00 H HETATM 419 HG1 MSE B 26 19.176 11.342 -3.916 1.00 0.00 H HETATM 420 HB2 MSE B 26 17.642 9.631 -2.954 1.00 0.00 H HETATM 421 HB1 MSE B 26 18.876 8.399 -3.307 1.00 0.00 H HETATM 422 HA MSE B 26 20.452 9.946 -1.956 1.00 0.00 H HETATM 423 H MSE B 26 18.731 7.808 -1.077 1.00 0.00 H ATOM 424 N THR B 27 17.716 10.823 -0.360 1.00 31.54 N ATOM 425 CA THR B 27 17.065 11.883 0.413 1.00 31.11 C ATOM 426 C THR B 27 18.012 12.473 1.467 1.00 30.89 C ATOM 427 O THR B 27 18.147 13.690 1.568 1.00 30.29 O ATOM 428 CB THR B 27 15.767 11.350 1.097 1.00 31.36 C ATOM 429 OG1 THR B 27 14.805 11.019 0.092 1.00 31.59 O ATOM 430 CG2 THR B 27 15.163 12.377 2.020 1.00 30.80 C ATOM 431 HA THR B 27 16.797 12.677 -0.284 1.00 0.00 H ATOM 432 HB THR B 27 16.036 10.472 1.684 1.00 0.00 H ATOM 433 HG1 THR B 27 15.178 10.321 -0.503 1.00 0.00 H ATOM 434 HG23 THR B 27 15.886 12.639 2.792 1.00 0.00 H ATOM 435 HG21 THR B 27 14.901 13.267 1.449 1.00 0.00 H ATOM 436 HG22 THR B 27 14.267 11.964 2.484 1.00 0.00 H ATOM 437 H THR B 27 17.303 9.869 -0.330 1.00 0.00 H ATOM 438 N GLN B 28 18.656 11.596 2.242 1.00 30.25 N ATOM 439 CA GLN B 28 19.657 11.994 3.235 1.00 29.99 C ATOM 440 C GLN B 28 20.781 12.852 2.655 1.00 29.24 C ATOM 441 O GLN B 28 21.168 13.856 3.249 1.00 29.01 O ATOM 442 CB GLN B 28 20.280 10.760 3.881 1.00 30.37 C ATOM 443 CG GLN B 28 19.541 10.208 5.075 1.00 32.47 C ATOM 444 CD GLN B 28 20.363 9.161 5.794 1.00 34.98 C ATOM 445 OE1 GLN B 28 21.053 8.360 5.160 1.00 37.07 O ATOM 446 NE2 GLN B 28 20.303 9.164 7.121 1.00 35.26 N ATOM 447 HA GLN B 28 19.123 12.596 3.970 1.00 0.00 H ATOM 448 HB2 GLN B 28 20.332 9.976 3.126 1.00 0.00 H ATOM 449 HB3 GLN B 28 21.288 11.021 4.201 1.00 0.00 H ATOM 450 HG2 GLN B 28 19.321 11.023 5.765 1.00 0.00 H ATOM 451 HG3 GLN B 28 18.608 9.757 4.738 1.00 0.00 H ATOM 452 HE22 GLN B 28 19.706 9.859 7.613 1.00 0.00 H ATOM 453 HE21 GLN B 28 20.853 8.471 7.668 1.00 0.00 H ATOM 454 H GLN B 28 18.437 10.585 2.136 1.00 0.00 H ATOM 455 N ILE B 29 21.326 12.424 1.517 1.00 28.43 N ATOM 456 CA ILE B 29 22.380 13.149 0.818 1.00 28.02 C ATOM 457 C ILE B 29 21.843 14.500 0.336 1.00 28.55 C ATOM 458 O ILE B 29 22.489 15.545 0.495 1.00 28.07 O ATOM 459 CB ILE B 29 22.909 12.321 -0.395 1.00 28.10 C ATOM 460 CG1 ILE B 29 23.651 11.068 0.101 1.00 27.35 C ATOM 461 CG2 ILE B 29 23.806 13.173 -1.305 1.00 28.21 C ATOM 462 CD1 ILE B 29 23.838 9.999 -0.987 1.00 28.08 C ATOM 463 HA ILE B 29 23.208 13.313 1.508 1.00 0.00 H ATOM 464 HB ILE B 29 22.054 12.003 -0.991 1.00 0.00 H ATOM 465 HG12 ILE B 29 24.634 11.369 0.463 1.00 0.00 H ATOM 466 HG13 ILE B 29 23.082 10.631 0.921 1.00 0.00 H ATOM 467 HD11 ILE B 29 22.862 9.679 -1.352 1.00 0.00 H ATOM 468 HD12 ILE B 29 24.416 10.418 -1.811 1.00 0.00 H ATOM 469 HD13 ILE B 29 24.368 9.144 -0.567 1.00 0.00 H ATOM 470 HG21 ILE B 29 23.235 14.020 -1.686 1.00 0.00 H ATOM 471 HG22 ILE B 29 24.660 13.536 -0.734 1.00 0.00 H ATOM 472 HG23 ILE B 29 24.157 12.565 -2.139 1.00 0.00 H ATOM 473 H ILE B 29 20.984 11.531 1.108 1.00 0.00 H ATOM 474 N THR B 30 20.650 14.467 -0.240 1.00 27.83 N ATOM 475 CA THR B 30 20.026 15.669 -0.759 1.00 28.80 C ATOM 476 C THR B 30 19.741 16.680 0.359 1.00 28.29 C ATOM 477 O THR B 30 20.063 17.861 0.228 1.00 28.65 O ATOM 478 CB THR B 30 18.758 15.317 -1.531 1.00 28.84 C ATOM 479 OG1 THR B 30 19.123 14.458 -2.617 1.00 30.55 O ATOM 480 CG2 THR B 30 18.101 16.585 -2.090 1.00 29.01 C ATOM 481 HA THR B 30 20.723 16.145 -1.449 1.00 0.00 H ATOM 482 HB THR B 30 18.049 14.824 -0.866 1.00 0.00 H ATOM 483 HG1 THR B 30 18.313 14.217 -3.132 1.00 0.00 H ATOM 484 HG23 THR B 30 17.822 17.241 -1.266 1.00 0.00 H ATOM 485 HG21 THR B 30 18.805 17.100 -2.744 1.00 0.00 H ATOM 486 HG22 THR B 30 17.211 16.312 -2.656 1.00 0.00 H ATOM 487 H THR B 30 20.150 13.559 -0.322 1.00 0.00 H ATOM 488 N LYS B 31 19.178 16.204 1.461 1.00 27.93 N ATOM 489 CA LYS B 31 18.905 17.062 2.608 1.00 28.20 C ATOM 490 C LYS B 31 20.183 17.724 3.134 1.00 27.75 C ATOM 491 O LYS B 31 20.169 18.910 3.480 1.00 26.91 O ATOM 492 CB LYS B 31 18.232 16.279 3.739 1.00 28.75 C ATOM 493 CG LYS B 31 16.731 16.015 3.571 1.00 30.09 C ATOM 494 CD LYS B 31 16.192 15.426 4.883 1.00 31.43 C ATOM 495 CE LYS B 31 14.846 14.705 4.729 1.00 32.45 C ATOM 496 NZ LYS B 31 13.816 15.515 4.029 1.00 33.21 N ATOM 497 HA LYS B 31 18.226 17.842 2.263 1.00 0.00 H ATOM 498 HB2 LYS B 31 18.734 15.315 3.822 1.00 0.00 H ATOM 499 HB3 LYS B 31 18.371 16.840 4.663 1.00 0.00 H ATOM 500 HG2 LYS B 31 16.215 16.949 3.347 1.00 0.00 H ATOM 501 HG3 LYS B 31 16.570 15.309 2.757 1.00 0.00 H ATOM 502 HD2 LYS B 31 16.922 14.713 5.266 1.00 0.00 H ATOM 503 HD3 LYS B 31 16.068 16.238 5.600 1.00 0.00 H ATOM 504 HE2 LYS B 31 14.473 14.455 5.722 1.00 0.00 H ATOM 505 HE3 LYS B 31 15.008 13.788 4.162 1.00 0.00 H ATOM 506 HZ1 LYS B 31 13.642 16.390 4.564 1.00 0.00 H ATOM 507 HZ2 LYS B 31 14.153 15.753 3.074 1.00 0.00 H ATOM 508 HZ3 LYS B 31 12.934 14.968 3.960 1.00 0.00 H ATOM 509 H LYS B 31 18.925 15.196 1.508 1.00 0.00 H ATOM 510 N ALA B 32 21.272 16.950 3.206 1.00 27.11 N ATOM 511 CA ALA B 32 22.583 17.475 3.607 1.00 26.98 C ATOM 512 C ALA B 32 23.105 18.553 2.653 1.00 26.97 C ATOM 513 O ALA B 32 23.609 19.592 3.093 1.00 26.82 O ATOM 514 CB ALA B 32 23.594 16.352 3.739 1.00 26.97 C ATOM 515 HA ALA B 32 22.446 17.948 4.579 1.00 0.00 H ATOM 516 HB1 ALA B 32 23.252 15.644 4.494 1.00 0.00 H ATOM 517 HB2 ALA B 32 23.696 15.843 2.781 1.00 0.00 H ATOM 518 HB3 ALA B 32 24.558 16.765 4.037 1.00 0.00 H ATOM 519 H ALA B 32 21.187 15.941 2.970 1.00 0.00 H ATOM 520 N ALA B 33 22.991 18.299 1.354 1.00 26.98 N ATOM 521 CA ALA B 33 23.422 19.266 0.341 1.00 27.57 C ATOM 522 C ALA B 33 22.667 20.600 0.450 1.00 27.53 C ATOM 523 O ALA B 33 23.288 21.660 0.377 1.00 27.50 O ATOM 524 CB ALA B 33 23.249 18.690 -1.048 1.00 27.87 C ATOM 525 HA ALA B 33 24.477 19.468 0.523 1.00 0.00 H ATOM 526 HB1 ALA B 33 23.850 17.785 -1.142 1.00 0.00 H ATOM 527 HB2 ALA B 33 22.199 18.449 -1.212 1.00 0.00 H ATOM 528 HB3 ALA B 33 23.574 19.422 -1.787 1.00 0.00 H ATOM 529 H ALA B 33 22.586 17.391 1.048 1.00 0.00 H ATOM 530 N ILE B 34 21.342 20.528 0.611 1.00 28.21 N ATOM 531 CA ILE B 34 20.474 21.713 0.760 1.00 29.24 C ATOM 532 C ILE B 34 20.803 22.529 2.014 1.00 29.37 C ATOM 533 O ILE B 34 20.859 23.762 1.973 1.00 29.32 O ATOM 534 CB ILE B 34 18.940 21.334 0.738 1.00 29.53 C ATOM 535 CG1 ILE B 34 18.529 20.707 -0.600 1.00 31.22 C ATOM 536 CG2 ILE B 34 18.052 22.538 1.014 1.00 29.80 C ATOM 537 CD1 ILE B 34 18.711 21.596 -1.819 1.00 31.20 C ATOM 538 HA ILE B 34 20.681 22.341 -0.107 1.00 0.00 H ATOM 539 HB ILE B 34 18.800 20.602 1.534 1.00 0.00 H ATOM 540 HG12 ILE B 34 19.126 19.807 -0.748 1.00 0.00 H ATOM 541 HG13 ILE B 34 17.475 20.436 -0.535 1.00 0.00 H ATOM 542 HD11 ILE B 34 18.110 22.498 -1.702 1.00 0.00 H ATOM 543 HD12 ILE B 34 19.762 21.868 -1.915 1.00 0.00 H ATOM 544 HD13 ILE B 34 18.391 21.057 -2.711 1.00 0.00 H ATOM 545 HG21 ILE B 34 18.289 22.945 1.997 1.00 0.00 H ATOM 546 HG22 ILE B 34 18.226 23.299 0.253 1.00 0.00 H ATOM 547 HG23 ILE B 34 17.007 22.230 0.989 1.00 0.00 H ATOM 548 H ILE B 34 20.899 19.587 0.632 1.00 0.00 H ATOM 549 N LYS B 35 21.040 21.839 3.128 1.00 29.62 N ATOM 550 CA LYS B 35 21.417 22.511 4.375 1.00 29.87 C ATOM 551 C LYS B 35 22.770 23.229 4.231 1.00 29.98 C ATOM 552 O LYS B 35 23.014 24.241 4.889 1.00 30.15 O ATOM 553 CB LYS B 35 21.417 21.517 5.537 1.00 30.02 C ATOM 554 CG LYS B 35 20.030 21.222 6.063 1.00 31.00 C ATOM 555 CD LYS B 35 20.036 20.104 7.092 1.00 33.92 C ATOM 556 CE LYS B 35 18.621 19.579 7.317 1.00 35.40 C ATOM 557 NZ LYS B 35 18.609 18.220 7.945 1.00 37.30 N ATOM 558 HA LYS B 35 20.674 23.277 4.595 1.00 0.00 H ATOM 559 HB2 LYS B 35 21.865 20.584 5.196 1.00 0.00 H ATOM 560 HB3 LYS B 35 22.016 21.931 6.348 1.00 0.00 H ATOM 561 HG2 LYS B 35 19.630 22.124 6.526 1.00 0.00 H ATOM 562 HG3 LYS B 35 19.392 20.929 5.229 1.00 0.00 H ATOM 563 HD2 LYS B 35 20.668 19.291 6.735 1.00 0.00 H ATOM 564 HD3 LYS B 35 20.432 20.484 8.034 1.00 0.00 H ATOM 565 HE2 LYS B 35 18.110 19.525 6.355 1.00 0.00 H ATOM 566 HE3 LYS B 35 18.090 20.271 7.970 1.00 0.00 H ATOM 567 HZ1 LYS B 35 19.106 17.549 7.326 1.00 0.00 H ATOM 568 HZ2 LYS B 35 19.087 18.262 8.868 1.00 0.00 H ATOM 569 HZ3 LYS B 35 17.625 17.909 8.077 1.00 0.00 H ATOM 570 H LYS B 35 20.956 20.803 3.113 1.00 0.00 H ATOM 571 N ALA B 36 23.602 22.725 3.316 1.00 29.93 N ATOM 572 CA ALA B 36 24.919 23.286 3.004 1.00 30.00 C ATOM 573 C ALA B 36 24.905 24.302 1.852 1.00 30.25 C ATOM 574 O ALA B 36 25.949 24.596 1.271 1.00 30.29 O ATOM 575 CB ALA B 36 25.916 22.132 2.699 1.00 29.93 C ATOM 576 HA ALA B 36 25.240 23.843 3.885 1.00 0.00 H ATOM 577 HB1 ALA B 36 25.995 21.482 3.570 1.00 0.00 H ATOM 578 HB2 ALA B 36 25.554 21.557 1.847 1.00 0.00 H ATOM 579 HB3 ALA B 36 26.895 22.551 2.467 1.00 0.00 H ATOM 580 H ALA B 36 23.296 21.881 2.792 1.00 0.00 H ATOM 581 N ILE B 37 23.736 24.864 1.545 1.00 30.54 N ATOM 582 CA ILE B 37 23.566 25.731 0.366 1.00 31.20 C ATOM 583 C ILE B 37 24.482 26.967 0.323 1.00 31.36 C ATOM 584 O ILE B 37 24.828 27.438 -0.757 1.00 31.56 O ATOM 585 CB ILE B 37 22.084 26.109 0.140 1.00 31.12 C ATOM 586 CG1 ILE B 37 21.882 26.709 -1.259 1.00 33.35 C ATOM 587 CG2 ILE B 37 21.596 27.059 1.216 1.00 30.14 C ATOM 588 CD1 ILE B 37 20.652 26.219 -1.945 1.00 33.97 C ATOM 589 HA ILE B 37 23.898 25.117 -0.471 1.00 0.00 H ATOM 590 HB ILE B 37 21.489 25.198 0.205 1.00 0.00 H ATOM 591 HG12 ILE B 37 21.816 27.793 -1.164 1.00 0.00 H ATOM 592 HG13 ILE B 37 22.745 26.452 -1.873 1.00 0.00 H ATOM 593 HD11 ILE B 37 20.708 25.136 -2.059 1.00 0.00 H ATOM 594 HD12 ILE B 37 19.777 26.478 -1.349 1.00 0.00 H ATOM 595 HD13 ILE B 37 20.575 26.685 -2.927 1.00 0.00 H ATOM 596 HG21 ILE B 37 21.691 26.581 2.191 1.00 0.00 H ATOM 597 HG22 ILE B 37 22.197 27.968 1.196 1.00 0.00 H ATOM 598 HG23 ILE B 37 20.551 27.308 1.032 1.00 0.00 H ATOM 599 H ILE B 37 22.916 24.684 2.159 1.00 0.00 H ATOM 600 N LYS B 38 24.868 27.476 1.491 1.00 32.02 N ATOM 601 CA LYS B 38 25.847 28.566 1.612 1.00 32.45 C ATOM 602 C LYS B 38 27.132 28.197 0.874 1.00 32.55 C ATOM 603 O LYS B 38 27.798 29.063 0.296 1.00 33.02 O ATOM 604 CB LYS B 38 26.164 28.846 3.087 1.00 32.16 C ATOM 605 CG LYS B 38 27.171 29.990 3.347 1.00 32.79 C ATOM 606 CD LYS B 38 27.586 30.057 4.824 1.00 32.73 C ATOM 607 CE LYS B 38 28.733 31.031 5.069 1.00 32.93 C ATOM 608 NZ LYS B 38 29.194 31.025 6.497 1.00 34.10 N ATOM 609 HA LYS B 38 25.418 29.464 1.168 1.00 0.00 H ATOM 610 HB2 LYS B 38 25.230 29.100 3.589 1.00 0.00 H ATOM 611 HB3 LYS B 38 26.572 27.934 3.522 1.00 0.00 H ATOM 612 HG2 LYS B 38 28.059 29.824 2.737 1.00 0.00 H ATOM 613 HG3 LYS B 38 26.710 30.937 3.066 1.00 0.00 H ATOM 614 HD2 LYS B 38 26.726 30.375 5.414 1.00 0.00 H ATOM 615 HD3 LYS B 38 27.898 29.063 5.144 1.00 0.00 H ATOM 616 HE2 LYS B 38 28.399 32.037 4.813 1.00 0.00 H ATOM 617 HE3 LYS B 38 29.571 30.754 4.429 1.00 0.00 H ATOM 618 HZ1 LYS B 38 28.404 31.296 7.116 1.00 0.00 H ATOM 619 HZ2 LYS B 38 29.522 30.071 6.750 1.00 0.00 H ATOM 620 HZ3 LYS B 38 29.974 31.703 6.611 1.00 0.00 H ATOM 621 H LYS B 38 24.456 27.083 2.361 1.00 0.00 H ATOM 622 N PHE B 39 27.481 26.913 0.920 1.00 31.99 N ATOM 623 CA PHE B 39 28.664 26.422 0.232 1.00 31.98 C ATOM 624 C PHE B 39 28.297 25.490 -0.912 1.00 31.07 C ATOM 625 O PHE B 39 28.877 24.410 -1.059 1.00 30.89 O ATOM 626 CB PHE B 39 29.617 25.738 1.213 1.00 32.49 C ATOM 627 CG PHE B 39 30.049 26.618 2.347 1.00 33.56 C ATOM 628 CD1 PHE B 39 30.980 27.636 2.146 1.00 34.42 C ATOM 629 CD2 PHE B 39 29.525 26.429 3.620 1.00 34.79 C ATOM 630 CE1 PHE B 39 31.383 28.451 3.199 1.00 35.24 C ATOM 631 CE2 PHE B 39 29.921 27.234 4.680 1.00 33.80 C ATOM 632 CZ PHE B 39 30.855 28.246 4.472 1.00 34.87 C ATOM 633 HA PHE B 39 29.178 27.281 -0.199 1.00 0.00 H ATOM 634 HB2 PHE B 39 29.115 24.864 1.628 1.00 0.00 H ATOM 635 HB3 PHE B 39 30.505 25.421 0.666 1.00 0.00 H ATOM 636 HD2 PHE B 39 28.794 25.639 3.789 1.00 0.00 H ATOM 637 HE2 PHE B 39 29.502 27.074 5.673 1.00 0.00 H ATOM 638 HZ PHE B 39 31.172 28.876 5.303 1.00 0.00 H ATOM 639 HE1 PHE B 39 32.109 29.246 3.029 1.00 0.00 H ATOM 640 HD1 PHE B 39 31.397 27.795 1.152 1.00 0.00 H ATOM 641 H PHE B 39 26.894 26.246 1.460 1.00 0.00 H ATOM 642 N TYR B 40 27.337 25.923 -1.726 1.00 30.20 N ATOM 643 CA TYR B 40 26.899 25.151 -2.894 1.00 29.75 C ATOM 644 C TYR B 40 28.044 24.832 -3.848 1.00 29.29 C ATOM 645 O TYR B 40 28.033 23.794 -4.489 1.00 28.70 O ATOM 646 CB TYR B 40 25.761 25.856 -3.636 1.00 29.52 C ATOM 647 CG TYR B 40 26.163 27.101 -4.399 1.00 30.56 C ATOM 648 CD1 TYR B 40 26.373 27.062 -5.783 1.00 30.87 C ATOM 649 CD2 TYR B 40 26.305 28.321 -3.749 1.00 29.77 C ATOM 650 CE1 TYR B 40 26.725 28.221 -6.493 1.00 30.19 C ATOM 651 CE2 TYR B 40 26.657 29.479 -4.449 1.00 31.59 C ATOM 652 CZ TYR B 40 26.865 29.415 -5.820 1.00 30.35 C ATOM 653 OH TYR B 40 27.203 30.566 -6.504 1.00 30.67 O ATOM 654 HA TYR B 40 26.525 24.202 -2.510 1.00 0.00 H ATOM 655 HB3 TYR B 40 25.004 26.138 -2.904 1.00 0.00 H ATOM 656 HB2 TYR B 40 25.332 25.149 -4.346 1.00 0.00 H ATOM 657 HD2 TYR B 40 26.139 28.376 -2.673 1.00 0.00 H ATOM 658 HE2 TYR B 40 26.767 30.426 -3.921 1.00 0.00 H ATOM 659 HE1 TYR B 40 26.887 28.176 -7.570 1.00 0.00 H ATOM 660 HD1 TYR B 40 26.262 26.118 -6.317 1.00 0.00 H ATOM 661 HH TYR B 40 27.316 30.356 -7.465 1.00 0.00 H ATOM 662 H TYR B 40 26.883 26.837 -1.528 1.00 0.00 H ATOM 663 N LYS B 41 29.033 25.721 -3.925 1.00 29.03 N ATOM 664 CA LYS B 41 30.217 25.482 -4.766 1.00 29.20 C ATOM 665 C LYS B 41 31.052 24.279 -4.286 1.00 29.75 C ATOM 666 O LYS B 41 31.501 23.457 -5.089 1.00 29.11 O ATOM 667 CB LYS B 41 31.092 26.741 -4.843 1.00 28.78 C ATOM 668 CG LYS B 41 30.438 27.887 -5.587 1.00 28.99 C ATOM 669 CD LYS B 41 31.275 29.160 -5.525 1.00 28.75 C ATOM 670 CE LYS B 41 30.587 30.306 -6.254 1.00 28.61 C ATOM 671 NZ LYS B 41 31.340 31.593 -6.125 1.00 28.34 N ATOM 672 HA LYS B 41 29.849 25.240 -5.763 1.00 0.00 H ATOM 673 HB2 LYS B 41 31.314 27.070 -3.828 1.00 0.00 H ATOM 674 HB3 LYS B 41 32.021 26.485 -5.352 1.00 0.00 H ATOM 675 HG2 LYS B 41 30.309 27.601 -6.631 1.00 0.00 H ATOM 676 HG3 LYS B 41 29.463 28.085 -5.142 1.00 0.00 H ATOM 677 HD2 LYS B 41 31.422 29.439 -4.482 1.00 0.00 H ATOM 678 HD3 LYS B 41 32.243 28.973 -5.990 1.00 0.00 H ATOM 679 HE2 LYS B 41 29.589 30.440 -5.836 1.00 0.00 H ATOM 680 HE3 LYS B 41 30.506 30.051 -7.311 1.00 0.00 H ATOM 681 HZ1 LYS B 41 31.417 31.849 -5.120 1.00 0.00 H ATOM 682 HZ2 LYS B 41 32.292 31.478 -6.528 1.00 0.00 H ATOM 683 HZ3 LYS B 41 30.833 32.343 -6.637 1.00 0.00 H ATOM 684 H LYS B 41 28.967 26.604 -3.379 1.00 0.00 H ATOM 685 N HIS B 42 31.259 24.178 -2.977 1.00 30.39 N ATOM 686 CA HIS B 42 31.977 23.028 -2.428 1.00 31.14 C ATOM 687 C HIS B 42 31.180 21.724 -2.591 1.00 31.17 C ATOM 688 O HIS B 42 31.769 20.669 -2.847 1.00 31.59 O ATOM 689 CB HIS B 42 32.394 23.296 -0.976 1.00 31.42 C ATOM 690 CG HIS B 42 33.210 24.542 -0.814 1.00 33.51 C ATOM 691 ND1 HIS B 42 32.678 25.805 -0.971 1.00 36.09 N ATOM 692 CD2 HIS B 42 34.519 24.721 -0.519 1.00 35.41 C ATOM 693 CE1 HIS B 42 33.621 26.707 -0.783 1.00 35.93 C ATOM 694 NE2 HIS B 42 34.747 26.076 -0.500 1.00 37.80 N ATOM 695 HA HIS B 42 32.892 22.889 -3.004 1.00 0.00 H ATOM 696 HB2 HIS B 42 31.494 23.390 -0.369 1.00 0.00 H ATOM 697 HB3 HIS B 42 32.982 22.449 -0.623 1.00 0.00 H ATOM 698 HD2 HIS B 42 35.254 23.938 -0.332 1.00 0.00 H ATOM 699 HE1 HIS B 42 33.494 27.787 -0.850 1.00 0.00 H ATOM 700 H HIS B 42 30.908 24.921 -2.339 1.00 0.00 H ATOM 701 N VAL B 43 29.850 21.808 -2.475 1.00 30.91 N ATOM 702 CA VAL B 43 28.964 20.667 -2.699 1.00 31.01 C ATOM 703 C VAL B 43 29.120 20.151 -4.144 1.00 31.13 C ATOM 704 O VAL B 43 29.310 18.946 -4.369 1.00 30.74 O ATOM 705 CB VAL B 43 27.459 21.014 -2.403 1.00 30.83 C ATOM 706 CG1 VAL B 43 26.538 19.867 -2.782 1.00 30.79 C ATOM 707 CG2 VAL B 43 27.259 21.342 -0.937 1.00 31.63 C ATOM 708 HA VAL B 43 29.257 19.884 -2.000 1.00 0.00 H ATOM 709 HB VAL B 43 27.208 21.884 -3.010 1.00 0.00 H ATOM 710 HG11 VAL B 43 26.641 19.656 -3.846 1.00 0.00 H ATOM 711 HG12 VAL B 43 26.808 18.981 -2.207 1.00 0.00 H ATOM 712 HG13 VAL B 43 25.507 20.143 -2.563 1.00 0.00 H ATOM 713 HG21 VAL B 43 27.547 20.483 -0.331 1.00 0.00 H ATOM 714 HG22 VAL B 43 27.876 22.200 -0.670 1.00 0.00 H ATOM 715 HG23 VAL B 43 26.210 21.578 -0.759 1.00 0.00 H ATOM 716 H VAL B 43 29.429 22.723 -2.215 1.00 0.00 H ATOM 717 N VAL B 44 29.063 21.073 -5.105 1.00 30.97 N ATOM 718 CA VAL B 44 29.214 20.731 -6.522 1.00 31.18 C ATOM 719 C VAL B 44 30.592 20.086 -6.796 1.00 31.22 C ATOM 720 O VAL B 44 30.674 19.055 -7.474 1.00 31.47 O ATOM 721 CB VAL B 44 28.932 21.965 -7.430 1.00 31.15 C ATOM 722 CG1 VAL B 44 29.384 21.721 -8.878 1.00 31.04 C ATOM 723 CG2 VAL B 44 27.449 22.315 -7.392 1.00 29.94 C ATOM 724 HA VAL B 44 28.465 19.981 -6.777 1.00 0.00 H ATOM 725 HB VAL B 44 29.510 22.803 -7.041 1.00 0.00 H ATOM 726 HG11 VAL B 44 30.455 21.520 -8.894 1.00 0.00 H ATOM 727 HG12 VAL B 44 28.847 20.865 -9.286 1.00 0.00 H ATOM 728 HG13 VAL B 44 29.170 22.605 -9.478 1.00 0.00 H ATOM 729 HG21 VAL B 44 26.867 21.466 -7.751 1.00 0.00 H ATOM 730 HG22 VAL B 44 27.158 22.550 -6.368 1.00 0.00 H ATOM 731 HG23 VAL B 44 27.264 23.179 -8.030 1.00 0.00 H ATOM 732 H VAL B 44 28.906 22.067 -4.841 1.00 0.00 H ATOM 733 N GLN B 45 31.650 20.678 -6.242 1.00 31.50 N ATOM 734 CA GLN B 45 33.015 20.162 -6.379 1.00 31.51 C ATOM 735 C GLN B 45 33.160 18.741 -5.819 1.00 31.47 C ATOM 736 O GLN B 45 33.818 17.884 -6.418 1.00 30.90 O ATOM 737 CB GLN B 45 33.992 21.103 -5.671 1.00 31.44 C ATOM 738 CG GLN B 45 35.452 20.860 -5.998 1.00 31.54 C ATOM 739 CD GLN B 45 36.382 21.816 -5.277 1.00 31.62 C ATOM 740 OE1 GLN B 45 36.165 22.163 -4.112 1.00 32.59 O ATOM 741 NE2 GLN B 45 37.433 22.242 -5.967 1.00 31.78 N ATOM 742 HA GLN B 45 33.244 20.115 -7.444 1.00 0.00 H ATOM 743 HB2 GLN B 45 33.745 22.126 -5.955 1.00 0.00 H ATOM 744 HB3 GLN B 45 33.860 20.984 -4.596 1.00 0.00 H ATOM 745 HG2 GLN B 45 35.709 19.840 -5.710 1.00 0.00 H ATOM 746 HG3 GLN B 45 35.593 20.980 -7.072 1.00 0.00 H ATOM 747 HE22 GLN B 45 37.576 21.923 -6.947 1.00 0.00 H ATOM 748 HE21 GLN B 45 38.113 22.895 -5.528 1.00 0.00 H ATOM 749 H GLN B 45 31.500 21.545 -5.688 1.00 0.00 H ATOM 750 N SER B 46 32.553 18.512 -4.652 1.00 31.47 N ATOM 751 CA SER B 46 32.588 17.203 -3.992 1.00 31.11 C ATOM 752 C SER B 46 31.884 16.140 -4.816 1.00 30.68 C ATOM 753 O SER B 46 32.344 14.998 -4.882 1.00 30.66 O ATOM 754 CB SER B 46 31.959 17.265 -2.600 1.00 31.11 C ATOM 755 OG SER B 46 32.745 18.058 -1.712 1.00 32.56 O ATOM 756 HA SER B 46 33.639 16.931 -3.896 1.00 0.00 H ATOM 757 HB2 SER B 46 31.881 16.254 -2.200 1.00 0.00 H ATOM 758 HB3 SER B 46 30.963 17.701 -2.679 1.00 0.00 H ATOM 759 HG SER B 46 32.815 18.979 -2.068 1.00 0.00 H ATOM 760 H SER B 46 32.037 19.290 -4.195 1.00 0.00 H ATOM 761 N VAL B 47 30.761 16.508 -5.426 1.00 30.52 N ATOM 762 CA VAL B 47 29.987 15.583 -6.265 1.00 29.57 C ATOM 763 C VAL B 47 30.758 15.254 -7.555 1.00 29.83 C ATOM 764 O VAL B 47 30.904 14.087 -7.929 1.00 29.63 O ATOM 765 CB VAL B 47 28.564 16.120 -6.542 1.00 29.93 C ATOM 766 CG1 VAL B 47 27.809 15.264 -7.592 1.00 28.88 C ATOM 767 CG2 VAL B 47 27.763 16.164 -5.249 1.00 28.18 C ATOM 768 HA VAL B 47 29.855 14.649 -5.718 1.00 0.00 H ATOM 769 HB VAL B 47 28.671 17.126 -6.949 1.00 0.00 H ATOM 770 HG11 VAL B 47 28.363 15.271 -8.531 1.00 0.00 H ATOM 771 HG12 VAL B 47 27.720 14.240 -7.228 1.00 0.00 H ATOM 772 HG13 VAL B 47 26.815 15.681 -7.752 1.00 0.00 H ATOM 773 HG21 VAL B 47 27.693 15.159 -4.832 1.00 0.00 H ATOM 774 HG22 VAL B 47 28.262 16.820 -4.536 1.00 0.00 H ATOM 775 HG23 VAL B 47 26.762 16.544 -5.456 1.00 0.00 H ATOM 776 H VAL B 47 30.419 17.483 -5.305 1.00 0.00 H ATOM 777 N GLU B 48 31.280 16.291 -8.202 1.00 29.64 N ATOM 778 CA GLU B 48 32.120 16.130 -9.389 1.00 29.42 C ATOM 779 C GLU B 48 33.384 15.304 -9.103 1.00 29.99 C ATOM 780 O GLU B 48 33.781 14.463 -9.915 1.00 30.24 O ATOM 781 CB GLU B 48 32.486 17.509 -9.945 1.00 29.45 C ATOM 782 CG GLU B 48 31.286 18.188 -10.617 1.00 28.07 C ATOM 783 CD GLU B 48 31.559 19.608 -11.071 1.00 28.57 C ATOM 784 OE1 GLU B 48 32.660 20.146 -10.801 1.00 26.10 O ATOM 785 OE2 GLU B 48 30.647 20.187 -11.693 1.00 27.36 O ATOM 786 HA GLU B 48 31.548 15.575 -10.133 1.00 0.00 H ATOM 787 HB2 GLU B 48 32.835 18.138 -9.127 1.00 0.00 H ATOM 788 HB3 GLU B 48 33.283 17.394 -10.679 1.00 0.00 H ATOM 789 HG2 GLU B 48 31.001 17.598 -11.488 1.00 0.00 H ATOM 790 HG3 GLU B 48 30.460 18.207 -9.906 1.00 0.00 H ATOM 791 H GLU B 48 31.084 17.251 -7.852 1.00 0.00 H ATOM 792 N LYS B 49 34.002 15.546 -7.950 1.00 29.31 N ATOM 793 CA LYS B 49 35.181 14.789 -7.527 1.00 29.86 C ATOM 794 C LYS B 49 34.836 13.311 -7.323 1.00 29.54 C ATOM 795 O LYS B 49 35.571 12.435 -7.776 1.00 29.80 O ATOM 796 CB LYS B 49 35.788 15.398 -6.255 1.00 29.80 C ATOM 797 CG LYS B 49 37.111 14.794 -5.826 1.00 30.28 C ATOM 798 CD LYS B 49 37.671 15.494 -4.583 1.00 31.46 C ATOM 799 CE LYS B 49 38.700 14.617 -3.870 1.00 32.29 C ATOM 800 NZ LYS B 49 39.438 15.318 -2.757 1.00 32.84 N ATOM 801 HA LYS B 49 35.928 14.849 -8.318 1.00 0.00 H ATOM 802 HB2 LYS B 49 35.942 16.463 -6.430 1.00 0.00 H ATOM 803 HB3 LYS B 49 35.075 15.264 -5.442 1.00 0.00 H ATOM 804 HG2 LYS B 49 36.962 13.738 -5.601 1.00 0.00 H ATOM 805 HG3 LYS B 49 37.827 14.893 -6.642 1.00 0.00 H ATOM 806 HD2 LYS B 49 38.147 16.427 -4.884 1.00 0.00 H ATOM 807 HD3 LYS B 49 36.852 15.710 -3.897 1.00 0.00 H ATOM 808 HE2 LYS B 49 39.430 14.278 -4.605 1.00 0.00 H ATOM 809 HE3 LYS B 49 38.183 13.755 -3.449 1.00 0.00 H ATOM 810 HZ1 LYS B 49 39.948 16.138 -3.143 1.00 0.00 H ATOM 811 HZ2 LYS B 49 38.757 15.638 -2.039 1.00 0.00 H ATOM 812 HZ3 LYS B 49 40.116 14.659 -2.324 1.00 0.00 H ATOM 813 H LYS B 49 33.636 16.296 -7.330 1.00 0.00 H ATOM 814 N PHE B 50 33.716 13.051 -6.646 1.00 29.38 N ATOM 815 CA PHE B 50 33.179 11.692 -6.458 1.00 29.45 C ATOM 816 C PHE B 50 33.012 10.974 -7.809 1.00 29.47 C ATOM 817 O PHE B 50 33.424 9.832 -7.962 1.00 28.96 O ATOM 818 CB PHE B 50 31.849 11.744 -5.667 1.00 29.31 C ATOM 819 CG PHE B 50 31.193 10.386 -5.450 1.00 30.13 C ATOM 820 CD1 PHE B 50 31.433 9.661 -4.281 1.00 31.55 C ATOM 821 CD2 PHE B 50 30.338 9.841 -6.413 1.00 29.08 C ATOM 822 CE1 PHE B 50 30.836 8.412 -4.074 1.00 32.30 C ATOM 823 CE2 PHE B 50 29.731 8.593 -6.219 1.00 29.33 C ATOM 824 CZ PHE B 50 29.986 7.872 -5.052 1.00 30.26 C ATOM 825 HA PHE B 50 33.893 11.113 -5.873 1.00 0.00 H ATOM 826 HB2 PHE B 50 32.049 12.186 -4.691 1.00 0.00 H ATOM 827 HB3 PHE B 50 31.151 12.377 -6.215 1.00 0.00 H ATOM 828 HD2 PHE B 50 30.140 10.396 -7.330 1.00 0.00 H ATOM 829 HE2 PHE B 50 29.062 8.187 -6.977 1.00 0.00 H ATOM 830 HZ PHE B 50 29.528 6.895 -4.901 1.00 0.00 H ATOM 831 HE1 PHE B 50 31.031 7.860 -3.155 1.00 0.00 H ATOM 832 HD1 PHE B 50 32.094 10.073 -3.519 1.00 0.00 H ATOM 833 H PHE B 50 33.195 13.849 -6.229 1.00 0.00 H ATOM 834 N ILE B 51 32.408 11.661 -8.774 1.00 29.93 N ATOM 835 CA ILE B 51 32.169 11.122 -10.110 1.00 30.47 C ATOM 836 C ILE B 51 33.485 10.855 -10.872 1.00 31.02 C ATOM 837 O ILE B 51 33.585 9.877 -11.607 1.00 30.69 O ATOM 838 CB ILE B 51 31.154 12.008 -10.896 1.00 30.27 C ATOM 839 CG1 ILE B 51 29.736 11.779 -10.339 1.00 31.28 C ATOM 840 CG2 ILE B 51 31.198 11.733 -12.417 1.00 31.05 C ATOM 841 CD1 ILE B 51 28.687 12.853 -10.708 1.00 30.68 C ATOM 842 HA ILE B 51 31.701 10.143 -10.004 1.00 0.00 H ATOM 843 HB ILE B 51 31.436 13.052 -10.758 1.00 0.00 H ATOM 844 HG12 ILE B 51 29.380 10.820 -10.715 1.00 0.00 H ATOM 845 HG13 ILE B 51 29.806 11.739 -9.252 1.00 0.00 H ATOM 846 HD11 ILE B 51 29.012 13.822 -10.328 1.00 0.00 H ATOM 847 HD12 ILE B 51 28.585 12.902 -11.792 1.00 0.00 H ATOM 848 HD13 ILE B 51 27.727 12.590 -10.263 1.00 0.00 H ATOM 849 HG21 ILE B 51 32.198 11.945 -12.795 1.00 0.00 H ATOM 850 HG22 ILE B 51 30.952 10.688 -12.603 1.00 0.00 H ATOM 851 HG23 ILE B 51 30.474 12.373 -12.922 1.00 0.00 H ATOM 852 H ILE B 51 32.090 12.629 -8.567 1.00 0.00 H ATOM 853 N GLN B 52 34.484 11.714 -10.674 1.00 30.97 N ATOM 854 CA GLN B 52 35.797 11.538 -11.292 1.00 31.70 C ATOM 855 C GLN B 52 36.488 10.292 -10.743 1.00 31.24 C ATOM 856 O GLN B 52 37.094 9.535 -11.496 1.00 31.34 O ATOM 857 CB GLN B 52 36.680 12.778 -11.064 1.00 31.35 C ATOM 858 CG GLN B 52 38.139 12.658 -11.562 1.00 33.24 C ATOM 859 CD GLN B 52 39.031 13.797 -11.056 1.00 33.48 C ATOM 860 OE1 GLN B 52 38.558 14.727 -10.400 1.00 37.95 O ATOM 861 NE2 GLN B 52 40.315 13.729 -11.368 1.00 36.10 N ATOM 862 HA GLN B 52 35.649 11.411 -12.365 1.00 0.00 H ATOM 863 HB2 GLN B 52 36.217 13.619 -11.580 1.00 0.00 H ATOM 864 HB3 GLN B 52 36.706 12.980 -9.993 1.00 0.00 H ATOM 865 HG2 GLN B 52 38.550 11.711 -11.213 1.00 0.00 H ATOM 866 HG3 GLN B 52 38.138 12.673 -12.652 1.00 0.00 H ATOM 867 HE22 GLN B 52 40.673 12.926 -11.924 1.00 0.00 H ATOM 868 HE21 GLN B 52 40.966 14.478 -11.058 1.00 0.00 H ATOM 869 H GLN B 52 34.324 12.537 -10.059 1.00 0.00 H ATOM 870 N LYS B 53 36.354 10.074 -9.437 1.00 30.90 N ATOM 871 CA LYS B 53 37.185 9.112 -8.711 1.00 31.12 C ATOM 872 C LYS B 53 36.577 7.728 -8.464 1.00 30.54 C ATOM 873 O LYS B 53 37.303 6.760 -8.289 1.00 30.81 O ATOM 874 CB LYS B 53 37.632 9.731 -7.382 1.00 31.15 C ATOM 875 CG LYS B 53 38.676 10.829 -7.564 1.00 32.58 C ATOM 876 CD LYS B 53 39.955 10.228 -8.108 1.00 35.08 C ATOM 877 CE LYS B 53 40.472 10.971 -9.327 1.00 36.80 C ATOM 878 NZ LYS B 53 41.656 10.250 -9.920 1.00 37.53 N ATOM 879 HA LYS B 53 38.026 8.915 -9.376 1.00 0.00 H ATOM 880 HB2 LYS B 53 36.760 10.157 -6.885 1.00 0.00 H ATOM 881 HB3 LYS B 53 38.057 8.946 -6.757 1.00 0.00 H ATOM 882 HG2 LYS B 53 38.300 11.576 -8.263 1.00 0.00 H ATOM 883 HG3 LYS B 53 38.877 11.302 -6.603 1.00 0.00 H ATOM 884 HD2 LYS B 53 40.716 10.261 -7.329 1.00 0.00 H ATOM 885 HD3 LYS B 53 39.765 9.191 -8.385 1.00 0.00 H ATOM 886 HE2 LYS B 53 40.774 11.977 -9.034 1.00 0.00 H ATOM 887 HE3 LYS B 53 39.679 11.034 -10.072 1.00 0.00 H ATOM 888 HZ1 LYS B 53 42.415 10.191 -9.212 1.00 0.00 H ATOM 889 HZ2 LYS B 53 41.370 9.291 -10.204 1.00 0.00 H ATOM 890 HZ3 LYS B 53 41.997 10.772 -10.753 1.00 0.00 H ATOM 891 H LYS B 53 35.632 10.607 -8.912 1.00 0.00 H ATOM 892 N CYS B 54 35.254 7.640 -8.448 1.00 30.10 N ATOM 893 CA CYS B 54 34.575 6.419 -8.011 1.00 29.45 C ATOM 894 C CYS B 54 34.716 5.263 -9.005 1.00 29.25 C ATOM 895 O CYS B 54 35.061 5.466 -10.168 1.00 28.33 O ATOM 896 CB CYS B 54 33.095 6.702 -7.717 1.00 29.39 C ATOM 897 SG CYS B 54 32.102 7.155 -9.170 1.00 29.54 S ATOM 898 HA CYS B 54 35.070 6.100 -7.094 1.00 0.00 H ATOM 899 HB2 CYS B 54 33.042 7.522 -7.001 1.00 0.00 H ATOM 900 HB3 CYS B 54 32.660 5.806 -7.274 1.00 0.00 H ATOM 901 HG CYS B 54 32.136 6.125 -10.088 1.00 0.00 H ATOM 902 H CYS B 54 34.686 8.456 -8.753 1.00 0.00 H ATOM 903 N LYS B 55 34.449 4.053 -8.520 1.00 29.03 N ATOM 904 CA LYS B 55 34.390 2.871 -9.360 1.00 29.29 C ATOM 905 C LYS B 55 33.229 2.972 -10.364 1.00 29.02 C ATOM 906 O LYS B 55 32.247 3.680 -10.107 1.00 29.28 O ATOM 907 CB LYS B 55 34.284 1.601 -8.497 1.00 29.48 C ATOM 908 CG LYS B 55 35.518 1.299 -7.623 1.00 29.98 C ATOM 909 CD LYS B 55 36.705 0.835 -8.452 1.00 32.62 C ATOM 910 CE LYS B 55 37.852 0.354 -7.558 1.00 33.14 C ATOM 911 NZ LYS B 55 38.648 -0.718 -8.230 1.00 35.10 N ATOM 912 HA LYS B 55 35.314 2.806 -9.935 1.00 0.00 H ATOM 913 HB2 LYS B 55 33.422 1.711 -7.839 1.00 0.00 H ATOM 914 HB3 LYS B 55 34.125 0.752 -9.163 1.00 0.00 H ATOM 915 HG2 LYS B 55 35.798 2.204 -7.084 1.00 0.00 H ATOM 916 HG3 LYS B 55 35.260 0.517 -6.909 1.00 0.00 H ATOM 917 HD2 LYS B 55 36.389 0.015 -9.097 1.00 0.00 H ATOM 918 HD3 LYS B 55 37.056 1.665 -9.066 1.00 0.00 H ATOM 919 HE2 LYS B 55 37.438 -0.039 -6.629 1.00 0.00 H ATOM 920 HE3 LYS B 55 38.507 1.196 -7.335 1.00 0.00 H ATOM 921 HZ1 LYS B 55 38.029 -1.527 -8.441 1.00 0.00 H ATOM 922 HZ2 LYS B 55 39.049 -0.347 -9.115 1.00 0.00 H ATOM 923 HZ3 LYS B 55 39.417 -1.023 -7.600 1.00 0.00 H ATOM 924 H LYS B 55 34.276 3.950 -7.500 1.00 0.00 H ATOM 925 N PRO B 56 33.350 2.287 -11.520 1.00 28.75 N ATOM 926 CA PRO B 56 32.326 2.327 -12.580 1.00 28.64 C ATOM 927 C PRO B 56 30.882 2.190 -12.071 1.00 28.51 C ATOM 928 O PRO B 56 29.989 2.874 -12.565 1.00 28.82 O ATOM 929 CB PRO B 56 32.686 1.118 -13.455 1.00 28.35 C ATOM 930 CG PRO B 56 34.144 0.950 -13.278 1.00 28.66 C ATOM 931 CD PRO B 56 34.497 1.430 -11.898 1.00 28.82 C ATOM 932 HA PRO B 56 32.337 3.290 -13.091 1.00 0.00 H ATOM 933 HD3 PRO B 56 34.600 0.592 -11.209 1.00 0.00 H ATOM 934 HD2 PRO B 56 35.424 2.004 -11.911 1.00 0.00 H ATOM 935 HG3 PRO B 56 34.679 1.538 -14.024 1.00 0.00 H ATOM 936 HG2 PRO B 56 34.412 -0.101 -13.385 1.00 0.00 H ATOM 937 HB2 PRO B 56 32.152 0.228 -13.121 1.00 0.00 H ATOM 938 HB3 PRO B 56 32.445 1.313 -14.500 1.00 0.00 H ATOM 939 N GLU B 57 30.671 1.313 -11.092 1.00 28.29 N ATOM 940 CA GLU B 57 29.338 1.050 -10.529 1.00 28.25 C ATOM 941 C GLU B 57 28.708 2.235 -9.762 1.00 28.36 C ATOM 942 O GLU B 57 27.500 2.240 -9.522 1.00 28.53 O ATOM 943 CB GLU B 57 29.373 -0.192 -9.629 1.00 28.35 C ATOM 944 CG GLU B 57 30.369 -0.107 -8.470 1.00 28.10 C ATOM 945 CD GLU B 57 30.186 -1.211 -7.441 1.00 28.24 C ATOM 946 OE1 GLU B 57 29.056 -1.735 -7.311 1.00 28.25 O ATOM 947 OE2 GLU B 57 31.173 -1.546 -6.752 1.00 27.11 O ATOM 948 HA GLU B 57 28.694 0.882 -11.393 1.00 0.00 H ATOM 949 HB2 GLU B 57 28.377 -0.339 -9.212 1.00 0.00 H ATOM 950 HB3 GLU B 57 29.639 -1.052 -10.244 1.00 0.00 H ATOM 951 HG2 GLU B 57 31.379 -0.174 -8.875 1.00 0.00 H ATOM 952 HG3 GLU B 57 30.242 0.855 -7.973 1.00 0.00 H ATOM 953 H GLU B 57 31.485 0.791 -10.708 1.00 0.00 H ATOM 954 N TYR B 58 29.511 3.235 -9.395 1.00 27.61 N ATOM 955 CA TYR B 58 28.971 4.399 -8.687 1.00 27.98 C ATOM 956 C TYR B 58 28.761 5.627 -9.578 1.00 27.77 C ATOM 957 O TYR B 58 28.350 6.679 -9.092 1.00 27.43 O ATOM 958 CB TYR B 58 29.825 4.755 -7.461 1.00 27.75 C ATOM 959 CG TYR B 58 29.695 3.766 -6.328 1.00 28.07 C ATOM 960 CD1 TYR B 58 28.611 3.817 -5.447 1.00 26.90 C ATOM 961 CD2 TYR B 58 30.650 2.772 -6.143 1.00 27.67 C ATOM 962 CE1 TYR B 58 28.493 2.902 -4.409 1.00 28.53 C ATOM 963 CE2 TYR B 58 30.541 1.854 -5.103 1.00 29.30 C ATOM 964 CZ TYR B 58 29.461 1.930 -4.239 1.00 27.93 C ATOM 965 OH TYR B 58 29.358 1.020 -3.217 1.00 28.61 O ATOM 966 HA TYR B 58 27.979 4.098 -8.351 1.00 0.00 H ATOM 967 HB3 TYR B 58 29.518 5.736 -7.100 1.00 0.00 H ATOM 968 HB2 TYR B 58 30.870 4.793 -7.768 1.00 0.00 H ATOM 969 HD2 TYR B 58 31.499 2.711 -6.824 1.00 0.00 H ATOM 970 HE2 TYR B 58 31.299 1.082 -4.969 1.00 0.00 H ATOM 971 HE1 TYR B 58 27.641 2.950 -3.731 1.00 0.00 H ATOM 972 HD1 TYR B 58 27.848 4.585 -5.576 1.00 0.00 H ATOM 973 HH TYR B 58 28.539 1.206 -2.693 1.00 0.00 H ATOM 974 H TYR B 58 30.527 3.188 -9.613 1.00 0.00 H ATOM 975 N LYS B 59 29.032 5.488 -10.878 1.00 28.36 N ATOM 976 CA LYS B 59 28.821 6.592 -11.822 1.00 28.90 C ATOM 977 C LYS B 59 27.344 7.014 -11.869 1.00 28.90 C ATOM 978 O LYS B 59 27.034 8.191 -11.709 1.00 29.79 O ATOM 979 CB LYS B 59 29.347 6.256 -13.236 1.00 28.68 C ATOM 980 CG LYS B 59 30.834 5.848 -13.313 1.00 29.15 C ATOM 981 CD LYS B 59 31.792 6.958 -12.914 1.00 28.91 C ATOM 982 CE LYS B 59 33.244 6.555 -13.153 1.00 29.11 C ATOM 983 NZ LYS B 59 34.204 7.421 -12.387 1.00 27.68 N ATOM 984 HA LYS B 59 29.402 7.438 -11.454 1.00 0.00 H ATOM 985 HB2 LYS B 59 28.752 5.432 -13.629 1.00 0.00 H ATOM 986 HB3 LYS B 59 29.207 7.136 -13.864 1.00 0.00 H ATOM 987 HG2 LYS B 59 30.993 4.999 -12.648 1.00 0.00 H ATOM 988 HG3 LYS B 59 31.057 5.552 -14.338 1.00 0.00 H ATOM 989 HD2 LYS B 59 31.569 7.848 -13.503 1.00 0.00 H ATOM 990 HD3 LYS B 59 31.655 7.181 -11.856 1.00 0.00 H ATOM 991 HE2 LYS B 59 33.463 6.643 -14.217 1.00 0.00 H ATOM 992 HE3 LYS B 59 33.378 5.519 -12.840 1.00 0.00 H ATOM 993 HZ1 LYS B 59 34.089 8.411 -12.684 1.00 0.00 H ATOM 994 HZ2 LYS B 59 34.007 7.338 -11.369 1.00 0.00 H ATOM 995 HZ3 LYS B 59 35.178 7.111 -12.580 1.00 0.00 H ATOM 996 H LYS B 59 29.400 4.580 -11.228 1.00 0.00 H ATOM 997 N VAL B 60 26.432 6.061 -12.070 1.00 28.58 N ATOM 998 CA VAL B 60 25.001 6.397 -12.129 1.00 28.18 C ATOM 999 C VAL B 60 24.455 6.923 -10.764 1.00 27.95 C ATOM 1000 O VAL B 60 23.692 7.899 -10.728 1.00 27.54 O ATOM 1001 CB VAL B 60 24.158 5.217 -12.694 1.00 28.29 C ATOM 1002 CG1 VAL B 60 22.690 5.488 -12.532 1.00 28.02 C ATOM 1003 CG2 VAL B 60 24.465 5.007 -14.170 1.00 28.94 C ATOM 1004 HA VAL B 60 24.897 7.224 -12.831 1.00 0.00 H ATOM 1005 HB VAL B 60 24.421 4.319 -12.135 1.00 0.00 H ATOM 1006 HG11 VAL B 60 22.459 5.612 -11.474 1.00 0.00 H ATOM 1007 HG12 VAL B 60 22.428 6.399 -13.071 1.00 0.00 H ATOM 1008 HG13 VAL B 60 22.121 4.650 -12.934 1.00 0.00 H ATOM 1009 HG21 VAL B 60 24.223 5.915 -14.723 1.00 0.00 H ATOM 1010 HG22 VAL B 60 25.524 4.778 -14.291 1.00 0.00 H ATOM 1011 HG23 VAL B 60 23.867 4.178 -14.550 1.00 0.00 H ATOM 1012 H VAL B 60 26.735 5.073 -12.186 1.00 0.00 H ATOM 1013 N PRO B 61 24.816 6.260 -9.642 1.00 27.10 N ATOM 1014 CA PRO B 61 24.573 6.874 -8.338 1.00 27.35 C ATOM 1015 C PRO B 61 25.030 8.335 -8.241 1.00 27.11 C ATOM 1016 O PRO B 61 24.281 9.160 -7.740 1.00 27.93 O ATOM 1017 CB PRO B 61 25.357 5.963 -7.393 1.00 27.17 C ATOM 1018 CG PRO B 61 25.168 4.604 -8.030 1.00 26.53 C ATOM 1019 CD PRO B 61 25.360 4.896 -9.496 1.00 27.18 C ATOM 1020 HA PRO B 61 23.510 6.943 -8.109 1.00 0.00 H ATOM 1021 HD3 PRO B 61 26.416 4.865 -9.766 1.00 0.00 H ATOM 1022 HD2 PRO B 61 24.807 4.186 -10.112 1.00 0.00 H ATOM 1023 HG3 PRO B 61 24.170 4.213 -7.834 1.00 0.00 H ATOM 1024 HG2 PRO B 61 25.912 3.894 -7.670 1.00 0.00 H ATOM 1025 HB2 PRO B 61 26.410 6.241 -7.359 1.00 0.00 H ATOM 1026 HB3 PRO B 61 24.943 5.988 -6.385 1.00 0.00 H ATOM 1027 N GLY B 62 26.226 8.641 -8.730 1.00 27.37 N ATOM 1028 CA GLY B 62 26.734 10.011 -8.767 1.00 27.69 C ATOM 1029 C GLY B 62 25.840 10.956 -9.559 1.00 27.88 C ATOM 1030 O GLY B 62 25.592 12.077 -9.139 1.00 27.51 O ATOM 1031 HA3 GLY B 62 27.723 10.003 -9.225 1.00 0.00 H ATOM 1032 HA2 GLY B 62 26.811 10.381 -7.745 1.00 0.00 H ATOM 1033 H GLY B 62 26.825 7.876 -9.101 1.00 0.00 H ATOM 1034 N LEU B 63 25.373 10.495 -10.716 1.00 28.88 N ATOM 1035 CA LEU B 63 24.457 11.251 -11.549 1.00 28.77 C ATOM 1036 C LEU B 63 23.110 11.435 -10.842 1.00 29.14 C ATOM 1037 O LEU B 63 22.503 12.496 -10.940 1.00 29.57 O ATOM 1038 CB LEU B 63 24.267 10.544 -12.905 1.00 28.86 C ATOM 1039 CG LEU B 63 23.185 11.117 -13.835 1.00 29.03 C ATOM 1040 CD1 LEU B 63 23.482 12.595 -14.167 1.00 26.09 C ATOM 1041 CD2 LEU B 63 23.088 10.288 -15.118 1.00 28.63 C ATOM 1042 HA LEU B 63 24.883 12.238 -11.728 1.00 0.00 H ATOM 1043 HB2 LEU B 63 25.217 10.588 -13.437 1.00 0.00 H ATOM 1044 HB3 LEU B 63 24.013 9.504 -12.703 1.00 0.00 H ATOM 1045 HG LEU B 63 22.226 11.067 -13.319 1.00 0.00 H ATOM 1046 HD21 LEU B 63 24.047 10.308 -15.635 1.00 0.00 H ATOM 1047 HD22 LEU B 63 22.831 9.259 -14.866 1.00 0.00 H ATOM 1048 HD23 LEU B 63 22.317 10.709 -15.764 1.00 0.00 H ATOM 1049 HD11 LEU B 63 23.501 13.176 -13.245 1.00 0.00 H ATOM 1050 HD12 LEU B 63 24.450 12.667 -14.663 1.00 0.00 H ATOM 1051 HD13 LEU B 63 22.705 12.981 -14.826 1.00 0.00 H ATOM 1052 H LEU B 63 25.677 9.554 -11.037 1.00 0.00 H ATOM 1053 N TYR B 64 22.634 10.396 -10.152 1.00 29.17 N ATOM 1054 CA TYR B 64 21.403 10.503 -9.364 1.00 29.54 C ATOM 1055 C TYR B 64 21.507 11.554 -8.251 1.00 29.66 C ATOM 1056 O TYR B 64 20.531 12.242 -7.971 1.00 29.79 O ATOM 1057 CB TYR B 64 20.960 9.149 -8.792 1.00 29.72 C ATOM 1058 CG TYR B 64 20.434 8.163 -9.823 1.00 30.29 C ATOM 1059 CD1 TYR B 64 20.093 8.582 -11.115 1.00 31.16 C ATOM 1060 CD2 TYR B 64 20.269 6.814 -9.499 1.00 31.00 C ATOM 1061 CE1 TYR B 64 19.603 7.677 -12.064 1.00 32.38 C ATOM 1062 CE2 TYR B 64 19.783 5.905 -10.434 1.00 31.44 C ATOM 1063 CZ TYR B 64 19.449 6.345 -11.713 1.00 30.89 C ATOM 1064 OH TYR B 64 18.964 5.451 -12.635 1.00 31.79 O ATOM 1065 HA TYR B 64 20.634 10.838 -10.060 1.00 0.00 H ATOM 1066 HB3 TYR B 64 20.171 9.331 -8.062 1.00 0.00 H ATOM 1067 HB2 TYR B 64 21.816 8.695 -8.294 1.00 0.00 H ATOM 1068 HD2 TYR B 64 20.525 6.468 -8.498 1.00 0.00 H ATOM 1069 HE2 TYR B 64 19.664 4.855 -10.167 1.00 0.00 H ATOM 1070 HE1 TYR B 64 19.346 8.016 -13.067 1.00 0.00 H ATOM 1071 HD1 TYR B 64 20.211 9.631 -11.386 1.00 0.00 H ATOM 1072 HH TYR B 64 18.778 5.923 -13.485 1.00 0.00 H ATOM 1073 H TYR B 64 23.147 9.492 -10.174 1.00 0.00 H ATOM 1074 N VAL B 65 22.679 11.654 -7.618 1.00 29.85 N ATOM 1075 CA VAL B 65 22.971 12.737 -6.658 1.00 29.30 C ATOM 1076 C VAL B 65 22.739 14.112 -7.298 1.00 29.86 C ATOM 1077 O VAL B 65 22.031 14.944 -6.723 1.00 29.37 O ATOM 1078 CB VAL B 65 24.390 12.630 -6.010 1.00 28.75 C ATOM 1079 CG1 VAL B 65 24.721 13.891 -5.192 1.00 27.50 C ATOM 1080 CG2 VAL B 65 24.486 11.399 -5.073 1.00 28.13 C ATOM 1081 HA VAL B 65 22.267 12.618 -5.835 1.00 0.00 H ATOM 1082 HB VAL B 65 25.104 12.524 -6.827 1.00 0.00 H ATOM 1083 HG11 VAL B 65 24.700 14.763 -5.846 1.00 0.00 H ATOM 1084 HG12 VAL B 65 23.983 14.012 -4.399 1.00 0.00 H ATOM 1085 HG13 VAL B 65 25.714 13.788 -4.753 1.00 0.00 H ATOM 1086 HG21 VAL B 65 23.746 11.490 -4.278 1.00 0.00 H ATOM 1087 HG22 VAL B 65 24.295 10.492 -5.646 1.00 0.00 H ATOM 1088 HG23 VAL B 65 25.484 11.352 -4.638 1.00 0.00 H ATOM 1089 H VAL B 65 23.413 10.942 -7.809 1.00 0.00 H ATOM 1090 N ILE B 66 23.304 14.343 -8.487 1.00 30.62 N ATOM 1091 CA ILE B 66 23.111 15.626 -9.192 1.00 31.08 C ATOM 1092 C ILE B 66 21.622 15.857 -9.476 1.00 31.56 C ATOM 1093 O ILE B 66 21.082 16.942 -9.202 1.00 31.22 O ATOM 1094 CB ILE B 66 23.906 15.712 -10.532 1.00 31.26 C ATOM 1095 CG1 ILE B 66 25.402 15.462 -10.300 1.00 30.05 C ATOM 1096 CG2 ILE B 66 23.696 17.076 -11.189 1.00 30.83 C ATOM 1097 CD1 ILE B 66 26.215 15.370 -11.566 1.00 31.41 C ATOM 1098 HA ILE B 66 23.498 16.401 -8.530 1.00 0.00 H ATOM 1099 HB ILE B 66 23.529 14.937 -11.199 1.00 0.00 H ATOM 1100 HG12 ILE B 66 25.797 16.281 -9.698 1.00 0.00 H ATOM 1101 HG13 ILE B 66 25.512 14.525 -9.754 1.00 0.00 H ATOM 1102 HD11 ILE B 66 25.843 14.547 -12.176 1.00 0.00 H ATOM 1103 HD12 ILE B 66 26.128 16.304 -12.121 1.00 0.00 H ATOM 1104 HD13 ILE B 66 27.260 15.192 -11.313 1.00 0.00 H ATOM 1105 HG21 ILE B 66 22.635 17.219 -11.395 1.00 0.00 H ATOM 1106 HG22 ILE B 66 24.046 17.859 -10.517 1.00 0.00 H ATOM 1107 HG23 ILE B 66 24.258 17.119 -12.122 1.00 0.00 H ATOM 1108 H ILE B 66 23.891 13.604 -8.924 1.00 0.00 H ATOM 1109 N ASP B 67 20.965 14.825 -10.013 1.00 31.65 N ATOM 1110 CA ASP B 67 19.536 14.885 -10.303 1.00 31.40 C ATOM 1111 C ASP B 67 18.717 15.215 -9.056 1.00 31.47 C ATOM 1112 O ASP B 67 17.815 16.058 -9.094 1.00 31.33 O ATOM 1113 CB ASP B 67 19.042 13.553 -10.868 1.00 31.42 C ATOM 1114 CG ASP B 67 17.562 13.590 -11.236 1.00 31.70 C ATOM 1115 OD1 ASP B 67 17.204 14.272 -12.206 1.00 32.30 O ATOM 1116 OD2 ASP B 67 16.750 12.937 -10.561 1.00 31.11 O ATOM 1117 HA ASP B 67 19.399 15.678 -11.038 1.00 0.00 H ATOM 1118 HB2 ASP B 67 19.619 13.316 -11.762 1.00 0.00 H ATOM 1119 HB3 ASP B 67 19.198 12.776 -10.120 1.00 0.00 H ATOM 1120 H ASP B 67 21.488 13.953 -10.231 1.00 0.00 H ATOM 1121 N SER B 68 18.997 14.501 -7.968 1.00 30.67 N ATOM 1122 CA SER B 68 18.203 14.647 -6.748 1.00 30.99 C ATOM 1123 C SER B 68 18.426 16.030 -6.134 1.00 30.56 C ATOM 1124 O SER B 68 17.466 16.688 -5.723 1.00 30.01 O ATOM 1125 CB SER B 68 18.542 13.547 -5.744 1.00 30.95 C ATOM 1126 OG SER B 68 17.611 13.541 -4.667 1.00 32.46 O ATOM 1127 HA SER B 68 17.149 14.549 -7.008 1.00 0.00 H ATOM 1128 HB2 SER B 68 19.544 13.719 -5.350 1.00 0.00 H ATOM 1129 HB3 SER B 68 18.512 12.581 -6.248 1.00 0.00 H ATOM 1130 HG SER B 68 17.850 12.822 -4.030 1.00 0.00 H ATOM 1131 H SER B 68 19.791 13.830 -7.986 1.00 0.00 H ATOM 1132 N ILE B 69 19.686 16.464 -6.077 1.00 30.14 N ATOM 1133 CA ILE B 69 19.999 17.784 -5.532 1.00 30.76 C ATOM 1134 C ILE B 69 19.341 18.887 -6.348 1.00 30.96 C ATOM 1135 O ILE B 69 18.687 19.770 -5.788 1.00 30.60 O ATOM 1136 CB ILE B 69 21.522 18.059 -5.448 1.00 31.27 C ATOM 1137 CG1 ILE B 69 22.155 17.170 -4.377 1.00 30.00 C ATOM 1138 CG2 ILE B 69 21.783 19.547 -5.125 1.00 31.27 C ATOM 1139 CD1 ILE B 69 23.703 17.167 -4.383 1.00 30.93 C ATOM 1140 HA ILE B 69 19.600 17.785 -4.518 1.00 0.00 H ATOM 1141 HB ILE B 69 21.973 17.828 -6.413 1.00 0.00 H ATOM 1142 HG12 ILE B 69 21.818 17.519 -3.401 1.00 0.00 H ATOM 1143 HG13 ILE B 69 21.811 16.148 -4.535 1.00 0.00 H ATOM 1144 HD11 ILE B 69 24.061 16.808 -5.348 1.00 0.00 H ATOM 1145 HD12 ILE B 69 24.068 18.180 -4.213 1.00 0.00 H ATOM 1146 HD13 ILE B 69 24.067 16.511 -3.592 1.00 0.00 H ATOM 1147 HG21 ILE B 69 21.352 20.169 -5.910 1.00 0.00 H ATOM 1148 HG22 ILE B 69 21.323 19.796 -4.169 1.00 0.00 H ATOM 1149 HG23 ILE B 69 22.857 19.722 -5.070 1.00 0.00 H ATOM 1150 H ILE B 69 20.455 15.856 -6.424 1.00 0.00 H ATOM 1151 N VAL B 70 19.518 18.828 -7.667 1.00 31.36 N ATOM 1152 CA VAL B 70 19.038 19.893 -8.543 1.00 32.02 C ATOM 1153 C VAL B 70 17.513 20.009 -8.459 1.00 31.92 C ATOM 1154 O VAL B 70 16.995 21.111 -8.309 1.00 31.92 O ATOM 1155 CB VAL B 70 19.549 19.750 -10.015 1.00 31.97 C ATOM 1156 CG1 VAL B 70 18.752 20.629 -10.954 1.00 33.57 C ATOM 1157 CG2 VAL B 70 21.035 20.123 -10.106 1.00 32.85 C ATOM 1158 HA VAL B 70 19.466 20.829 -8.184 1.00 0.00 H ATOM 1159 HB VAL B 70 19.418 18.709 -10.312 1.00 0.00 H ATOM 1160 HG11 VAL B 70 17.702 20.338 -10.918 1.00 0.00 H ATOM 1161 HG12 VAL B 70 18.853 21.670 -10.648 1.00 0.00 H ATOM 1162 HG13 VAL B 70 19.129 20.509 -11.970 1.00 0.00 H ATOM 1163 HG21 VAL B 70 21.170 21.155 -9.782 1.00 0.00 H ATOM 1164 HG22 VAL B 70 21.615 19.461 -9.463 1.00 0.00 H ATOM 1165 HG23 VAL B 70 21.372 20.017 -11.137 1.00 0.00 H ATOM 1166 H VAL B 70 20.007 18.008 -8.080 1.00 0.00 H ATOM 1167 N ARG B 71 16.809 18.877 -8.505 1.00 32.16 N ATOM 1168 CA ARG B 71 15.345 18.908 -8.493 1.00 32.56 C ATOM 1169 C ARG B 71 14.787 19.334 -7.137 1.00 32.13 C ATOM 1170 O ARG B 71 13.788 20.040 -7.069 1.00 31.78 O ATOM 1171 CB ARG B 71 14.750 17.567 -8.941 1.00 33.01 C ATOM 1172 CG ARG B 71 15.088 17.197 -10.398 1.00 34.10 C ATOM 1173 CD ARG B 71 14.191 16.085 -10.922 1.00 37.77 C ATOM 1174 NE ARG B 71 14.430 14.777 -10.309 1.00 40.48 N ATOM 1175 CZ ARG B 71 13.534 14.100 -9.588 1.00 42.38 C ATOM 1176 NH1 ARG B 71 12.329 14.606 -9.349 1.00 43.38 N ATOM 1177 NH2 ARG B 71 13.842 12.910 -9.097 1.00 43.04 N ATOM 1178 HA ARG B 71 15.042 19.666 -9.216 1.00 0.00 H ATOM 1179 HB2 ARG B 71 15.135 16.784 -8.288 1.00 0.00 H ATOM 1180 HB3 ARG B 71 13.666 17.621 -8.842 1.00 0.00 H ATOM 1181 HG2 ARG B 71 14.960 18.079 -11.025 1.00 0.00 H ATOM 1182 HG3 ARG B 71 16.125 16.866 -10.447 1.00 0.00 H ATOM 1183 HD2 ARG B 71 14.353 15.993 -11.996 1.00 0.00 H ATOM 1184 HD3 ARG B 71 13.155 16.366 -10.735 1.00 0.00 H ATOM 1185 HE ARG B 71 15.366 14.344 -10.445 1.00 0.00 H ATOM 1186 HH12 ARG B 71 11.641 14.067 -8.785 1.00 0.00 H ATOM 1187 HH11 ARG B 71 12.074 15.541 -9.725 1.00 0.00 H ATOM 1188 HH22 ARG B 71 13.144 12.383 -8.535 1.00 0.00 H ATOM 1189 HH21 ARG B 71 14.782 12.502 -9.273 1.00 0.00 H ATOM 1190 H ARG B 71 17.305 17.964 -8.550 1.00 0.00 H ATOM 1191 N GLN B 72 15.439 18.912 -6.059 1.00 32.07 N ATOM 1192 CA GLN B 72 15.031 19.360 -4.729 1.00 32.28 C ATOM 1193 C GLN B 72 15.237 20.865 -4.539 1.00 31.51 C ATOM 1194 O GLN B 72 14.381 21.544 -3.986 1.00 31.62 O ATOM 1195 CB GLN B 72 15.763 18.577 -3.633 1.00 32.48 C ATOM 1196 CG GLN B 72 15.416 19.032 -2.186 1.00 34.44 C ATOM 1197 CD GLN B 72 13.945 18.884 -1.829 1.00 37.33 C ATOM 1198 OE1 GLN B 72 13.270 17.946 -2.266 1.00 37.58 O ATOM 1199 NE2 GLN B 72 13.443 19.810 -1.009 1.00 37.43 N ATOM 1200 HA GLN B 72 13.963 19.161 -4.644 1.00 0.00 H ATOM 1201 HB2 GLN B 72 15.502 17.523 -3.732 1.00 0.00 H ATOM 1202 HB3 GLN B 72 16.836 18.700 -3.783 1.00 0.00 H ATOM 1203 HG2 GLN B 72 16.001 18.433 -1.488 1.00 0.00 H ATOM 1204 HG3 GLN B 72 15.691 20.081 -2.081 1.00 0.00 H ATOM 1205 HE22 GLN B 72 14.048 20.583 -0.665 1.00 0.00 H ATOM 1206 HE21 GLN B 72 12.447 19.759 -0.714 1.00 0.00 H ATOM 1207 H GLN B 72 16.243 18.260 -6.162 1.00 0.00 H ATOM 1208 N SER B 73 16.378 21.376 -4.989 1.00 30.98 N ATOM 1209 CA SER B 73 16.661 22.815 -4.918 1.00 30.73 C ATOM 1210 C SER B 73 15.680 23.655 -5.755 1.00 30.57 C ATOM 1211 O SER B 73 15.206 24.698 -5.302 1.00 30.10 O ATOM 1212 CB SER B 73 18.104 23.083 -5.342 1.00 30.70 C ATOM 1213 OG SER B 73 18.417 24.452 -5.251 1.00 30.26 O ATOM 1214 HA SER B 73 16.525 23.123 -3.881 1.00 0.00 H ATOM 1215 HB2 SER B 73 18.238 22.755 -6.373 1.00 0.00 H ATOM 1216 HB3 SER B 73 18.775 22.521 -4.693 1.00 0.00 H ATOM 1217 HG SER B 73 19.356 24.594 -5.531 1.00 0.00 H ATOM 1218 H SER B 73 17.089 20.740 -5.402 1.00 0.00 H ATOM 1219 N ARG B 74 15.374 23.198 -6.973 1.00 30.56 N ATOM 1220 CA ARG B 74 14.388 23.873 -7.808 1.00 30.38 C ATOM 1221 C ARG B 74 13.029 23.899 -7.112 1.00 30.29 C ATOM 1222 O ARG B 74 12.328 24.912 -7.131 1.00 29.49 O ATOM 1223 CB ARG B 74 14.293 23.217 -9.191 1.00 30.29 C ATOM 1224 CG ARG B 74 15.539 23.463 -10.058 1.00 31.37 C ATOM 1225 CD ARG B 74 15.644 22.536 -11.303 1.00 30.79 C ATOM 1226 NE ARG B 74 14.462 22.568 -12.166 1.00 31.03 N ATOM 1227 CZ ARG B 74 14.180 23.507 -13.072 1.00 32.02 C ATOM 1228 NH1 ARG B 74 14.988 24.536 -13.278 1.00 32.20 N ATOM 1229 NH2 ARG B 74 13.062 23.417 -13.778 1.00 31.10 N ATOM 1230 HA ARG B 74 14.713 24.903 -7.957 1.00 0.00 H ATOM 1231 HB2 ARG B 74 14.168 22.142 -9.058 1.00 0.00 H ATOM 1232 HB3 ARG B 74 13.423 23.621 -9.709 1.00 0.00 H ATOM 1233 HG2 ARG B 74 15.517 24.497 -10.402 1.00 0.00 H ATOM 1234 HG3 ARG B 74 16.423 23.306 -9.439 1.00 0.00 H ATOM 1235 HD2 ARG B 74 15.790 21.512 -10.958 1.00 0.00 H ATOM 1236 HD3 ARG B 74 16.508 22.847 -11.891 1.00 0.00 H ATOM 1237 HE ARG B 74 13.781 21.789 -12.064 1.00 0.00 H ATOM 1238 HH12 ARG B 74 14.745 25.254 -13.990 1.00 0.00 H ATOM 1239 HH11 ARG B 74 15.866 24.626 -12.728 1.00 0.00 H ATOM 1240 HH22 ARG B 74 12.834 24.144 -14.486 1.00 0.00 H ATOM 1241 HH21 ARG B 74 12.413 22.619 -13.624 1.00 0.00 H ATOM 1242 H ARG B 74 15.848 22.345 -7.332 1.00 0.00 H ATOM 1243 N HIS B 75 12.683 22.789 -6.466 1.00 30.09 N ATOM 1244 CA HIS B 75 11.407 22.676 -5.772 1.00 30.35 C ATOM 1245 C HIS B 75 11.348 23.582 -4.543 1.00 29.98 C ATOM 1246 O HIS B 75 10.339 24.248 -4.299 1.00 29.89 O ATOM 1247 CB HIS B 75 11.166 21.213 -5.381 1.00 30.74 C ATOM 1248 CG HIS B 75 9.927 20.992 -4.575 1.00 31.94 C ATOM 1249 ND1 HIS B 75 8.661 21.108 -5.109 1.00 33.64 N ATOM 1250 CD2 HIS B 75 9.759 20.651 -3.276 1.00 32.63 C ATOM 1251 CE1 HIS B 75 7.766 20.861 -4.170 1.00 34.62 C ATOM 1252 NE2 HIS B 75 8.406 20.580 -3.049 1.00 34.12 N ATOM 1253 HA HIS B 75 10.618 23.005 -6.448 1.00 0.00 H ATOM 1254 HB2 HIS B 75 11.090 20.623 -6.294 1.00 0.00 H ATOM 1255 HB3 HIS B 75 12.020 20.869 -4.797 1.00 0.00 H ATOM 1256 HD2 HIS B 75 10.549 20.467 -2.547 1.00 0.00 H ATOM 1257 HE1 HIS B 75 6.684 20.885 -4.298 1.00 0.00 H ATOM 1258 H HIS B 75 13.339 21.982 -6.456 1.00 0.00 H ATOM 1259 N GLN B 76 12.442 23.606 -3.786 1.00 29.60 N ATOM 1260 CA GLN B 76 12.490 24.254 -2.481 1.00 29.67 C ATOM 1261 C GLN B 76 12.743 25.768 -2.570 1.00 29.53 C ATOM 1262 O GLN B 76 12.199 26.535 -1.771 1.00 29.26 O ATOM 1263 CB GLN B 76 13.540 23.564 -1.600 1.00 29.55 C ATOM 1264 CG GLN B 76 13.748 24.188 -0.219 1.00 30.71 C ATOM 1265 CD GLN B 76 14.421 23.248 0.751 1.00 30.62 C ATOM 1266 OE1 GLN B 76 14.535 22.042 0.497 1.00 31.67 O ATOM 1267 NE2 GLN B 76 14.874 23.790 1.870 1.00 29.43 N ATOM 1268 HA GLN B 76 11.506 24.145 -2.024 1.00 0.00 H ATOM 1269 HB2 GLN B 76 13.233 22.528 -1.459 1.00 0.00 H ATOM 1270 HB3 GLN B 76 14.493 23.590 -2.128 1.00 0.00 H ATOM 1271 HG2 GLN B 76 14.367 25.078 -0.328 1.00 0.00 H ATOM 1272 HG3 GLN B 76 12.776 24.470 0.186 1.00 0.00 H ATOM 1273 HE22 GLN B 76 14.755 24.809 2.039 1.00 0.00 H ATOM 1274 HE21 GLN B 76 15.349 23.197 2.580 1.00 0.00 H ATOM 1275 H GLN B 76 13.302 23.141 -4.141 1.00 0.00 H ATOM 1276 N PHE B 77 13.550 26.186 -3.545 1.00 29.05 N ATOM 1277 CA PHE B 77 13.950 27.587 -3.666 1.00 28.87 C ATOM 1278 C PHE B 77 13.341 28.300 -4.863 1.00 28.85 C ATOM 1279 O PHE B 77 13.410 29.527 -4.949 1.00 28.55 O ATOM 1280 CB PHE B 77 15.478 27.717 -3.708 1.00 28.59 C ATOM 1281 CG PHE B 77 16.165 27.192 -2.482 1.00 28.91 C ATOM 1282 CD1 PHE B 77 16.298 27.990 -1.342 1.00 27.81 C ATOM 1283 CD2 PHE B 77 16.688 25.889 -2.469 1.00 27.26 C ATOM 1284 CE1 PHE B 77 16.932 27.501 -0.194 1.00 28.47 C ATOM 1285 CE2 PHE B 77 17.319 25.397 -1.340 1.00 27.99 C ATOM 1286 CZ PHE B 77 17.444 26.211 -0.192 1.00 28.79 C ATOM 1287 HA PHE B 77 13.558 28.079 -2.776 1.00 0.00 H ATOM 1288 HB2 PHE B 77 15.846 27.164 -4.572 1.00 0.00 H ATOM 1289 HB3 PHE B 77 15.730 28.772 -3.819 1.00 0.00 H ATOM 1290 HD2 PHE B 77 16.596 25.260 -3.355 1.00 0.00 H ATOM 1291 HE2 PHE B 77 17.719 24.383 -1.336 1.00 0.00 H ATOM 1292 HZ PHE B 77 17.943 25.825 0.697 1.00 0.00 H ATOM 1293 HE1 PHE B 77 17.023 28.129 0.692 1.00 0.00 H ATOM 1294 HD1 PHE B 77 15.903 29.006 -1.347 1.00 0.00 H ATOM 1295 H PHE B 77 13.905 25.497 -4.238 1.00 0.00 H ATOM 1296 N GLY B 78 12.736 27.535 -5.772 1.00 29.15 N ATOM 1297 CA GLY B 78 12.187 28.077 -7.012 1.00 30.04 C ATOM 1298 C GLY B 78 13.089 27.745 -8.186 1.00 30.78 C ATOM 1299 O GLY B 78 14.314 27.769 -8.058 1.00 30.73 O ATOM 1300 HA3 GLY B 78 12.100 29.160 -6.922 1.00 0.00 H ATOM 1301 HA2 GLY B 78 11.200 27.647 -7.185 1.00 0.00 H ATOM 1302 H GLY B 78 12.652 26.514 -5.591 1.00 0.00 H ATOM 1303 N GLN B 79 12.486 27.419 -9.328 1.00 31.91 N ATOM 1304 CA GLN B 79 13.252 26.995 -10.509 1.00 33.21 C ATOM 1305 C GLN B 79 14.272 28.040 -10.981 1.00 32.99 C ATOM 1306 O GLN B 79 15.405 27.701 -11.319 1.00 32.69 O ATOM 1307 CB GLN B 79 12.323 26.595 -11.650 1.00 33.29 C ATOM 1308 CG GLN B 79 11.490 25.353 -11.369 1.00 34.96 C ATOM 1309 CD GLN B 79 10.491 25.055 -12.477 1.00 35.49 C ATOM 1310 OE1 GLN B 79 10.187 25.912 -13.307 1.00 37.97 O ATOM 1311 NE2 GLN B 79 9.974 23.828 -12.492 1.00 38.70 N ATOM 1312 HA GLN B 79 13.827 26.123 -10.197 1.00 0.00 H ATOM 1313 HB2 GLN B 79 11.644 27.425 -11.846 1.00 0.00 H ATOM 1314 HB3 GLN B 79 12.930 26.407 -12.536 1.00 0.00 H ATOM 1315 HG2 GLN B 79 12.160 24.500 -11.264 1.00 0.00 H ATOM 1316 HG3 GLN B 79 10.944 25.502 -10.437 1.00 0.00 H ATOM 1317 HE22 GLN B 79 10.259 23.135 -11.771 1.00 0.00 H ATOM 1318 HE21 GLN B 79 9.285 23.563 -13.225 1.00 0.00 H ATOM 1319 H GLN B 79 11.449 27.466 -9.386 1.00 0.00 H ATOM 1320 N GLU B 80 13.885 29.311 -10.967 1.00 33.08 N ATOM 1321 CA GLU B 80 14.795 30.365 -11.396 1.00 33.69 C ATOM 1322 C GLU B 80 15.791 30.801 -10.314 1.00 33.45 C ATOM 1323 O GLU B 80 16.793 31.458 -10.614 1.00 33.96 O ATOM 1324 CB GLU B 80 14.026 31.558 -11.988 1.00 34.40 C ATOM 1325 CG GLU B 80 13.149 31.224 -13.227 1.00 36.79 C ATOM 1326 CD GLU B 80 13.815 30.326 -14.283 1.00 41.57 C ATOM 1327 OE1 GLU B 80 15.063 30.316 -14.411 1.00 44.37 O ATOM 1328 OE2 GLU B 80 13.074 29.616 -15.003 1.00 43.52 O ATOM 1329 HA GLU B 80 15.407 29.932 -12.187 1.00 0.00 H ATOM 1330 HB2 GLU B 80 13.376 31.960 -11.211 1.00 0.00 H ATOM 1331 HB3 GLU B 80 14.752 32.317 -12.281 1.00 0.00 H ATOM 1332 HG2 GLU B 80 12.248 30.720 -12.876 1.00 0.00 H ATOM 1333 HG3 GLU B 80 12.874 32.163 -13.708 1.00 0.00 H ATOM 1334 H GLU B 80 12.926 29.555 -10.648 1.00 0.00 H ATOM 1335 N LYS B 81 15.530 30.429 -9.062 1.00 32.44 N ATOM 1336 CA LYS B 81 16.412 30.813 -7.970 1.00 31.82 C ATOM 1337 C LYS B 81 17.462 29.754 -7.641 1.00 31.60 C ATOM 1338 O LYS B 81 18.455 30.050 -6.973 1.00 31.13 O ATOM 1339 CB LYS B 81 15.610 31.191 -6.716 1.00 31.91 C ATOM 1340 CG LYS B 81 14.780 32.477 -6.877 1.00 31.76 C ATOM 1341 CD LYS B 81 15.668 33.674 -7.188 1.00 33.01 C ATOM 1342 CE LYS B 81 14.883 34.974 -7.129 1.00 35.39 C ATOM 1343 NZ LYS B 81 13.926 35.070 -8.268 1.00 37.60 N ATOM 1344 HA LYS B 81 16.956 31.691 -8.318 1.00 0.00 H ATOM 1345 HB2 LYS B 81 14.932 30.371 -6.480 1.00 0.00 H ATOM 1346 HB3 LYS B 81 16.308 31.332 -5.891 1.00 0.00 H ATOM 1347 HG2 LYS B 81 14.069 32.341 -7.692 1.00 0.00 H ATOM 1348 HG3 LYS B 81 14.238 32.668 -5.951 1.00 0.00 H ATOM 1349 HD2 LYS B 81 16.478 33.714 -6.460 1.00 0.00 H ATOM 1350 HD3 LYS B 81 16.086 33.556 -8.188 1.00 0.00 H ATOM 1351 HE2 LYS B 81 15.577 35.813 -7.174 1.00 0.00 H ATOM 1352 HE3 LYS B 81 14.328 35.014 -6.192 1.00 0.00 H ATOM 1353 HZ1 LYS B 81 14.452 35.037 -9.165 1.00 0.00 H ATOM 1354 HZ2 LYS B 81 13.258 34.274 -8.226 1.00 0.00 H ATOM 1355 HZ3 LYS B 81 13.402 35.966 -8.205 1.00 0.00 H ATOM 1356 H LYS B 81 14.685 29.857 -8.862 1.00 0.00 H ATOM 1357 N ASP B 82 17.231 28.535 -8.119 1.00 30.75 N ATOM 1358 CA ASP B 82 18.146 27.414 -7.891 1.00 31.37 C ATOM 1359 C ASP B 82 19.593 27.743 -8.299 1.00 31.09 C ATOM 1360 O ASP B 82 19.864 28.168 -9.426 1.00 31.10 O ATOM 1361 CB ASP B 82 17.630 26.166 -8.622 1.00 30.78 C ATOM 1362 CG ASP B 82 18.696 25.096 -8.779 1.00 32.21 C ATOM 1363 OD1 ASP B 82 19.307 24.706 -7.761 1.00 31.68 O ATOM 1364 OD2 ASP B 82 18.923 24.654 -9.930 1.00 32.21 O ATOM 1365 HA ASP B 82 18.170 27.215 -6.820 1.00 0.00 H ATOM 1366 HB2 ASP B 82 16.798 25.749 -8.055 1.00 0.00 H ATOM 1367 HB3 ASP B 82 17.282 26.460 -9.612 1.00 0.00 H ATOM 1368 H ASP B 82 16.368 28.371 -8.676 1.00 0.00 H ATOM 1369 N VAL B 83 20.510 27.560 -7.363 1.00 31.52 N ATOM 1370 CA VAL B 83 21.924 27.788 -7.606 1.00 31.71 C ATOM 1371 C VAL B 83 22.641 26.532 -8.129 1.00 31.86 C ATOM 1372 O VAL B 83 23.721 26.633 -8.719 1.00 31.91 O ATOM 1373 CB VAL B 83 22.648 28.335 -6.336 1.00 31.48 C ATOM 1374 CG1 VAL B 83 22.053 29.688 -5.894 1.00 32.20 C ATOM 1375 CG2 VAL B 83 22.614 27.305 -5.185 1.00 32.78 C ATOM 1376 HA VAL B 83 21.977 28.547 -8.387 1.00 0.00 H ATOM 1377 HB VAL B 83 23.693 28.503 -6.597 1.00 0.00 H ATOM 1378 HG11 VAL B 83 22.166 30.414 -6.699 1.00 0.00 H ATOM 1379 HG12 VAL B 83 20.995 29.561 -5.664 1.00 0.00 H ATOM 1380 HG13 VAL B 83 22.579 30.042 -5.007 1.00 0.00 H ATOM 1381 HG21 VAL B 83 21.578 27.084 -4.927 1.00 0.00 H ATOM 1382 HG22 VAL B 83 23.113 26.390 -5.503 1.00 0.00 H ATOM 1383 HG23 VAL B 83 23.126 27.717 -4.316 1.00 0.00 H ATOM 1384 H VAL B 83 20.208 27.242 -6.420 1.00 0.00 H ATOM 1385 N PHE B 84 22.047 25.353 -7.919 1.00 32.25 N ATOM 1386 CA PHE B 84 22.739 24.090 -8.238 1.00 32.14 C ATOM 1387 C PHE B 84 22.850 23.757 -9.727 1.00 32.39 C ATOM 1388 O PHE B 84 23.955 23.497 -10.211 1.00 32.98 O ATOM 1389 CB PHE B 84 22.184 22.902 -7.431 1.00 31.95 C ATOM 1390 CG PHE B 84 22.630 22.889 -5.979 1.00 32.06 C ATOM 1391 CD1 PHE B 84 23.919 22.481 -5.632 1.00 30.00 C ATOM 1392 CD2 PHE B 84 21.760 23.301 -4.966 1.00 31.22 C ATOM 1393 CE1 PHE B 84 24.331 22.453 -4.283 1.00 32.17 C ATOM 1394 CE2 PHE B 84 22.158 23.294 -3.621 1.00 31.36 C ATOM 1395 CZ PHE B 84 23.451 22.860 -3.278 1.00 31.02 C ATOM 1396 HA PHE B 84 23.766 24.271 -7.922 1.00 0.00 H ATOM 1397 HB2 PHE B 84 21.095 22.947 -7.457 1.00 0.00 H ATOM 1398 HB3 PHE B 84 22.519 21.978 -7.903 1.00 0.00 H ATOM 1399 HD2 PHE B 84 20.755 23.633 -5.225 1.00 0.00 H ATOM 1400 HE2 PHE B 84 21.468 23.624 -2.845 1.00 0.00 H ATOM 1401 HZ PHE B 84 23.764 22.841 -2.234 1.00 0.00 H ATOM 1402 HE1 PHE B 84 25.335 22.114 -4.026 1.00 0.00 H ATOM 1403 HD1 PHE B 84 24.617 22.180 -6.414 1.00 0.00 H ATOM 1404 H PHE B 84 21.085 25.326 -7.526 1.00 0.00 H ATOM 1405 N ALA B 85 21.737 23.763 -10.461 1.00 32.45 N ATOM 1406 CA ALA B 85 21.816 23.513 -11.912 1.00 32.41 C ATOM 1407 C ALA B 85 22.821 24.441 -12.631 1.00 31.94 C ATOM 1408 O ALA B 85 23.692 23.947 -13.360 1.00 31.80 O ATOM 1409 CB ALA B 85 20.432 23.549 -12.577 1.00 32.23 C ATOM 1410 HA ALA B 85 22.204 22.500 -12.022 1.00 0.00 H ATOM 1411 HB1 ALA B 85 19.797 22.783 -12.133 1.00 0.00 H ATOM 1412 HB2 ALA B 85 19.982 24.530 -12.424 1.00 0.00 H ATOM 1413 HB3 ALA B 85 20.539 23.360 -13.645 1.00 0.00 H ATOM 1414 H ALA B 85 20.817 23.943 -10.012 1.00 0.00 H ATOM 1415 N PRO B 86 22.720 25.777 -12.433 1.00 31.95 N ATOM 1416 CA PRO B 86 23.718 26.632 -13.095 1.00 31.54 C ATOM 1417 C PRO B 86 25.168 26.305 -12.734 1.00 31.36 C ATOM 1418 O PRO B 86 26.030 26.369 -13.610 1.00 31.25 O ATOM 1419 CB PRO B 86 23.344 28.051 -12.634 1.00 31.96 C ATOM 1420 CG PRO B 86 21.913 27.960 -12.259 1.00 32.48 C ATOM 1421 CD PRO B 86 21.729 26.583 -11.690 1.00 31.74 C ATOM 1422 HA PRO B 86 23.689 26.492 -14.176 1.00 0.00 H ATOM 1423 HD3 PRO B 86 21.937 26.570 -10.620 1.00 0.00 H ATOM 1424 HD2 PRO B 86 20.717 26.219 -11.866 1.00 0.00 H ATOM 1425 HG3 PRO B 86 21.280 28.097 -13.136 1.00 0.00 H ATOM 1426 HG2 PRO B 86 21.666 28.716 -11.513 1.00 0.00 H ATOM 1427 HB2 PRO B 86 23.948 28.349 -11.777 1.00 0.00 H ATOM 1428 HB3 PRO B 86 23.485 28.768 -13.443 1.00 0.00 H ATOM 1429 N ARG B 87 25.438 25.967 -11.470 1.00 30.97 N ATOM 1430 CA ARG B 87 26.802 25.642 -11.037 1.00 30.30 C ATOM 1431 C ARG B 87 27.259 24.287 -11.610 1.00 30.15 C ATOM 1432 O ARG B 87 28.360 24.180 -12.135 1.00 29.60 O ATOM 1433 CB ARG B 87 26.928 25.672 -9.497 1.00 30.30 C ATOM 1434 CG ARG B 87 28.358 25.457 -8.939 1.00 29.39 C ATOM 1435 CD ARG B 87 29.278 26.645 -9.256 1.00 29.81 C ATOM 1436 NE ARG B 87 30.677 26.380 -8.916 1.00 29.77 N ATOM 1437 CZ ARG B 87 31.632 27.304 -8.908 1.00 31.47 C ATOM 1438 NH1 ARG B 87 31.346 28.565 -9.207 1.00 31.87 N ATOM 1439 NH2 ARG B 87 32.877 26.977 -8.583 1.00 31.87 N ATOM 1440 HA ARG B 87 27.465 26.411 -11.433 1.00 0.00 H ATOM 1441 HB2 ARG B 87 26.574 26.643 -9.150 1.00 0.00 H ATOM 1442 HB3 ARG B 87 26.288 24.888 -9.092 1.00 0.00 H ATOM 1443 HG2 ARG B 87 28.300 25.334 -7.858 1.00 0.00 H ATOM 1444 HG3 ARG B 87 28.779 24.556 -9.384 1.00 0.00 H ATOM 1445 HD2 ARG B 87 28.938 27.511 -8.688 1.00 0.00 H ATOM 1446 HD3 ARG B 87 29.213 26.863 -10.322 1.00 0.00 H ATOM 1447 HE ARG B 87 30.940 25.406 -8.665 1.00 0.00 H ATOM 1448 HH12 ARG B 87 32.097 29.284 -9.199 1.00 0.00 H ATOM 1449 HH11 ARG B 87 30.371 28.834 -9.449 1.00 0.00 H ATOM 1450 HH22 ARG B 87 33.621 27.704 -8.578 1.00 0.00 H ATOM 1451 HH21 ARG B 87 33.108 25.994 -8.333 1.00 0.00 H ATOM 1452 H ARG B 87 24.663 25.933 -10.777 1.00 0.00 H ATOM 1453 N PHE B 88 26.410 23.262 -11.515 1.00 30.48 N ATOM 1454 CA PHE B 88 26.720 21.956 -12.124 1.00 30.93 C ATOM 1455 C PHE B 88 26.964 22.047 -13.634 1.00 31.18 C ATOM 1456 O PHE B 88 27.707 21.234 -14.195 1.00 31.78 O ATOM 1457 CB PHE B 88 25.612 20.938 -11.853 1.00 31.33 C ATOM 1458 CG PHE B 88 25.754 20.205 -10.527 1.00 31.27 C ATOM 1459 CD1 PHE B 88 26.855 19.395 -10.279 1.00 31.26 C ATOM 1460 CD2 PHE B 88 24.758 20.293 -9.561 1.00 30.54 C ATOM 1461 CE1 PHE B 88 26.984 18.701 -9.066 1.00 31.33 C ATOM 1462 CE2 PHE B 88 24.875 19.605 -8.331 1.00 30.48 C ATOM 1463 CZ PHE B 88 25.995 18.809 -8.090 1.00 31.86 C ATOM 1464 HA PHE B 88 27.645 21.623 -11.653 1.00 0.00 H ATOM 1465 HB2 PHE B 88 24.657 21.463 -11.854 1.00 0.00 H ATOM 1466 HB3 PHE B 88 25.621 20.200 -12.655 1.00 0.00 H ATOM 1467 HD2 PHE B 88 23.874 20.901 -9.754 1.00 0.00 H ATOM 1468 HE2 PHE B 88 24.095 19.696 -7.576 1.00 0.00 H ATOM 1469 HZ PHE B 88 26.096 18.275 -7.145 1.00 0.00 H ATOM 1470 HE1 PHE B 88 27.859 18.076 -8.887 1.00 0.00 H ATOM 1471 HD1 PHE B 88 27.631 19.297 -11.038 1.00 0.00 H ATOM 1472 H PHE B 88 25.514 23.387 -11.002 1.00 0.00 H ATOM 1473 N SER B 89 26.352 23.038 -14.283 1.00 30.88 N ATOM 1474 CA SER B 89 26.466 23.197 -15.735 1.00 31.04 C ATOM 1475 C SER B 89 27.859 23.634 -16.186 1.00 31.01 C ATOM 1476 O SER B 89 28.248 23.368 -17.321 1.00 30.69 O ATOM 1477 CB SER B 89 25.376 24.124 -16.293 1.00 31.02 C ATOM 1478 OG SER B 89 25.629 25.472 -15.964 1.00 30.67 O ATOM 1479 HA SER B 89 26.308 22.205 -16.158 1.00 0.00 H ATOM 1480 HB2 SER B 89 24.413 23.831 -15.875 1.00 0.00 H ATOM 1481 HB3 SER B 89 25.345 24.023 -17.378 1.00 0.00 H ATOM 1482 HG SER B 89 25.653 25.571 -14.979 1.00 0.00 H ATOM 1483 H SER B 89 25.778 23.717 -13.744 1.00 0.00 H ATOM 1484 N ASN B 90 28.599 24.316 -15.308 1.00 31.19 N ATOM 1485 CA ASN B 90 29.930 24.817 -15.650 1.00 31.83 C ATOM 1486 C ASN B 90 30.859 23.707 -16.166 1.00 32.17 C ATOM 1487 O ASN B 90 31.427 23.809 -17.272 1.00 32.18 O ATOM 1488 CB ASN B 90 30.578 25.563 -14.463 1.00 31.89 C ATOM 1489 CG ASN B 90 29.755 26.779 -13.981 1.00 32.88 C ATOM 1490 OD1 ASN B 90 28.714 27.116 -14.548 1.00 33.92 O ATOM 1491 ND2 ASN B 90 30.234 27.433 -12.922 1.00 30.04 N ATOM 1492 HA ASN B 90 29.791 25.528 -16.464 1.00 0.00 H ATOM 1493 HB2 ASN B 90 30.684 24.865 -13.632 1.00 0.00 H ATOM 1494 HB3 ASN B 90 31.564 25.912 -14.770 1.00 0.00 H ATOM 1495 HD22 ASN B 90 31.116 27.117 -12.471 1.00 0.00 H ATOM 1496 HD21 ASN B 90 29.725 28.259 -12.547 1.00 0.00 H ATOM 1497 H ASN B 90 28.219 24.495 -14.357 1.00 0.00 H ATOM 1498 N ASN B 91 31.006 22.649 -15.371 1.00 32.00 N ATOM 1499 CA ASN B 91 31.888 21.533 -15.737 1.00 32.35 C ATOM 1500 C ASN B 91 31.174 20.316 -16.304 1.00 32.20 C ATOM 1501 O ASN B 91 31.750 19.231 -16.314 1.00 32.44 O ATOM 1502 CB ASN B 91 32.725 21.085 -14.531 1.00 32.24 C ATOM 1503 CG ASN B 91 33.667 22.155 -14.034 1.00 32.44 C ATOM 1504 OD1 ASN B 91 34.225 22.930 -14.812 1.00 32.77 O ATOM 1505 ND2 ASN B 91 33.860 22.197 -12.721 1.00 32.47 N ATOM 1506 HA ASN B 91 32.518 21.932 -16.532 1.00 0.00 H ATOM 1507 HB2 ASN B 91 32.049 20.814 -13.720 1.00 0.00 H ATOM 1508 HB3 ASN B 91 33.312 20.213 -14.820 1.00 0.00 H ATOM 1509 HD22 ASN B 91 33.368 21.523 -12.101 1.00 0.00 H ATOM 1510 HD21 ASN B 91 34.504 22.904 -12.312 1.00 0.00 H ATOM 1511 H ASN B 91 30.485 22.612 -14.472 1.00 0.00 H ATOM 1512 N ILE B 92 29.937 20.488 -16.780 1.00 32.27 N ATOM 1513 CA ILE B 92 29.076 19.344 -17.126 1.00 32.34 C ATOM 1514 C ILE B 92 29.617 18.401 -18.228 1.00 31.77 C ATOM 1515 O ILE B 92 29.397 17.193 -18.164 1.00 31.55 O ATOM 1516 CB ILE B 92 27.604 19.771 -17.410 1.00 32.48 C ATOM 1517 CG1 ILE B 92 26.646 18.608 -17.129 1.00 33.64 C ATOM 1518 CG2 ILE B 92 27.442 20.325 -18.835 1.00 32.42 C ATOM 1519 CD1 ILE B 92 25.199 19.029 -16.799 1.00 33.22 C ATOM 1520 HA ILE B 92 29.090 18.738 -16.220 1.00 0.00 H ATOM 1521 HB ILE B 92 27.345 20.584 -16.731 1.00 0.00 H ATOM 1522 HG12 ILE B 92 26.621 17.968 -18.011 1.00 0.00 H ATOM 1523 HG13 ILE B 92 27.037 18.043 -16.283 1.00 0.00 H ATOM 1524 HD11 ILE B 92 25.199 19.659 -15.910 1.00 0.00 H ATOM 1525 HD12 ILE B 92 24.783 19.584 -17.640 1.00 0.00 H ATOM 1526 HD13 ILE B 92 24.596 18.140 -16.615 1.00 0.00 H ATOM 1527 HG21 ILE B 92 28.085 21.197 -18.960 1.00 0.00 H ATOM 1528 HG22 ILE B 92 27.724 19.558 -19.556 1.00 0.00 H ATOM 1529 HG23 ILE B 92 26.403 20.612 -18.996 1.00 0.00 H ATOM 1530 H ILE B 92 29.573 21.454 -16.909 1.00 0.00 H ATOM 1531 N ILE B 93 30.321 18.953 -19.222 1.00 31.72 N ATOM 1532 CA ILE B 93 30.982 18.147 -20.251 1.00 31.47 C ATOM 1533 C ILE B 93 31.991 17.163 -19.633 1.00 31.57 C ATOM 1534 O ILE B 93 31.988 15.972 -19.957 1.00 31.29 O ATOM 1535 CB ILE B 93 31.696 19.029 -21.326 1.00 32.09 C ATOM 1536 CG1 ILE B 93 30.684 19.868 -22.131 1.00 31.99 C ATOM 1537 CG2 ILE B 93 32.577 18.162 -22.255 1.00 31.25 C ATOM 1538 CD1 ILE B 93 29.713 19.054 -22.996 1.00 32.28 C ATOM 1539 HA ILE B 93 30.194 17.581 -20.747 1.00 0.00 H ATOM 1540 HB ILE B 93 32.349 19.727 -20.803 1.00 0.00 H ATOM 1541 HG12 ILE B 93 30.097 20.458 -21.427 1.00 0.00 H ATOM 1542 HG13 ILE B 93 31.243 20.536 -22.786 1.00 0.00 H ATOM 1543 HD11 ILE B 93 30.278 18.466 -23.719 1.00 0.00 H ATOM 1544 HD12 ILE B 93 29.132 18.388 -22.359 1.00 0.00 H ATOM 1545 HD13 ILE B 93 29.042 19.732 -23.523 1.00 0.00 H ATOM 1546 HG21 ILE B 93 33.335 17.650 -21.662 1.00 0.00 H ATOM 1547 HG22 ILE B 93 31.953 17.426 -22.763 1.00 0.00 H ATOM 1548 HG23 ILE B 93 33.062 18.800 -22.993 1.00 0.00 H ATOM 1549 H ILE B 93 30.402 19.989 -19.266 1.00 0.00 H ATOM 1550 N SER B 94 32.851 17.672 -18.748 1.00 31.54 N ATOM 1551 CA SER B 94 33.852 16.856 -18.063 1.00 31.39 C ATOM 1552 C SER B 94 33.185 15.810 -17.168 1.00 31.34 C ATOM 1553 O SER B 94 33.626 14.658 -17.106 1.00 30.96 O ATOM 1554 CB SER B 94 34.796 17.758 -17.256 1.00 31.62 C ATOM 1555 OG SER B 94 35.847 17.021 -16.662 1.00 31.75 O ATOM 1556 HA SER B 94 34.439 16.320 -18.809 1.00 0.00 H ATOM 1557 HB2 SER B 94 34.225 18.254 -16.471 1.00 0.00 H ATOM 1558 HB3 SER B 94 35.223 18.508 -17.922 1.00 0.00 H ATOM 1559 HG SER B 94 36.432 17.635 -16.152 1.00 0.00 H ATOM 1560 H SER B 94 32.807 18.690 -18.537 1.00 0.00 H ATOM 1561 N THR B 95 32.113 16.231 -16.480 1.00 31.10 N ATOM 1562 CA THR B 95 31.315 15.369 -15.606 1.00 31.11 C ATOM 1563 C THR B 95 30.761 14.171 -16.384 1.00 31.17 C ATOM 1564 O THR B 95 30.882 13.031 -15.936 1.00 31.78 O ATOM 1565 CB THR B 95 30.145 16.160 -14.923 1.00 31.02 C ATOM 1566 OG1 THR B 95 30.690 17.240 -14.146 1.00 30.28 O ATOM 1567 CG2 THR B 95 29.307 15.255 -14.013 1.00 31.17 C ATOM 1568 HA THR B 95 31.976 15.004 -14.820 1.00 0.00 H ATOM 1569 HB THR B 95 29.495 16.546 -15.708 1.00 0.00 H ATOM 1570 HG1 THR B 95 29.952 17.740 -13.715 1.00 0.00 H ATOM 1571 HG23 THR B 95 28.893 14.435 -14.600 1.00 0.00 H ATOM 1572 HG21 THR B 95 29.939 14.853 -13.221 1.00 0.00 H ATOM 1573 HG22 THR B 95 28.496 15.835 -13.573 1.00 0.00 H ATOM 1574 H THR B 95 31.832 17.228 -16.573 1.00 0.00 H ATOM 1575 N PHE B 96 30.200 14.429 -17.564 1.00 30.84 N ATOM 1576 CA PHE B 96 29.619 13.367 -18.380 1.00 31.13 C ATOM 1577 C PHE B 96 30.655 12.487 -19.099 1.00 31.30 C ATOM 1578 O PHE B 96 30.428 11.293 -19.279 1.00 32.01 O ATOM 1579 CB PHE B 96 28.532 13.916 -19.316 1.00 30.73 C ATOM 1580 CG PHE B 96 27.190 14.025 -18.659 1.00 30.18 C ATOM 1581 CD1 PHE B 96 26.179 13.131 -18.974 1.00 28.86 C ATOM 1582 CD2 PHE B 96 26.945 15.000 -17.686 1.00 30.82 C ATOM 1583 CE1 PHE B 96 24.932 13.214 -18.341 1.00 31.51 C ATOM 1584 CE2 PHE B 96 25.707 15.092 -17.062 1.00 30.90 C ATOM 1585 CZ PHE B 96 24.700 14.198 -17.388 1.00 30.55 C ATOM 1586 HA PHE B 96 29.132 12.681 -17.687 1.00 0.00 H ATOM 1587 HB2 PHE B 96 28.834 14.907 -19.655 1.00 0.00 H ATOM 1588 HB3 PHE B 96 28.445 13.250 -20.175 1.00 0.00 H ATOM 1589 HD2 PHE B 96 27.737 15.698 -17.413 1.00 0.00 H ATOM 1590 HE2 PHE B 96 25.528 15.867 -16.317 1.00 0.00 H ATOM 1591 HZ PHE B 96 23.729 14.266 -16.898 1.00 0.00 H ATOM 1592 HE1 PHE B 96 24.143 12.506 -18.596 1.00 0.00 H ATOM 1593 HD1 PHE B 96 26.356 12.357 -19.721 1.00 0.00 H ATOM 1594 H PHE B 96 30.175 15.409 -17.912 1.00 0.00 H ATOM 1595 N GLN B 97 31.799 13.059 -19.463 1.00 31.60 N ATOM 1596 CA GLN B 97 32.933 12.260 -19.929 1.00 32.25 C ATOM 1597 C GLN B 97 33.271 11.186 -18.888 1.00 32.03 C ATOM 1598 O GLN B 97 33.554 10.034 -19.232 1.00 31.97 O ATOM 1599 CB GLN B 97 34.163 13.143 -20.192 1.00 31.92 C ATOM 1600 CG GLN B 97 34.073 13.996 -21.459 1.00 32.62 C ATOM 1601 CD GLN B 97 35.248 14.952 -21.636 1.00 33.12 C ATOM 1602 OE1 GLN B 97 36.171 14.996 -20.815 1.00 34.45 O ATOM 1603 NE2 GLN B 97 35.211 15.735 -22.710 1.00 33.43 N ATOM 1604 HA GLN B 97 32.654 11.782 -20.868 1.00 0.00 H ATOM 1605 HB2 GLN B 97 34.291 13.811 -19.340 1.00 0.00 H ATOM 1606 HB3 GLN B 97 35.035 12.495 -20.279 1.00 0.00 H ATOM 1607 HG2 GLN B 97 34.037 13.330 -22.321 1.00 0.00 H ATOM 1608 HG3 GLN B 97 33.155 14.582 -21.416 1.00 0.00 H ATOM 1609 HE22 GLN B 97 34.416 15.666 -23.377 1.00 0.00 H ATOM 1610 HE21 GLN B 97 35.977 16.416 -22.884 1.00 0.00 H ATOM 1611 H GLN B 97 31.890 14.094 -19.416 1.00 0.00 H ATOM 1612 N ASN B 98 33.250 11.587 -17.617 1.00 31.73 N ATOM 1613 CA ASN B 98 33.549 10.696 -16.504 1.00 31.98 C ATOM 1614 C ASN B 98 32.424 9.700 -16.282 1.00 31.82 C ATOM 1615 O ASN B 98 32.676 8.510 -16.094 1.00 32.35 O ATOM 1616 CB ASN B 98 33.843 11.493 -15.219 1.00 31.87 C ATOM 1617 CG ASN B 98 35.157 12.270 -15.299 1.00 32.13 C ATOM 1618 OD1 ASN B 98 36.056 11.918 -16.069 1.00 33.11 O ATOM 1619 ND2 ASN B 98 35.273 13.330 -14.500 1.00 30.15 N ATOM 1620 HA ASN B 98 34.447 10.133 -16.761 1.00 0.00 H ATOM 1621 HB2 ASN B 98 33.029 12.198 -15.051 1.00 0.00 H ATOM 1622 HB3 ASN B 98 33.898 10.798 -14.381 1.00 0.00 H ATOM 1623 HD22 ASN B 98 34.491 13.592 -13.866 1.00 0.00 H ATOM 1624 HD21 ASN B 98 36.146 13.896 -14.510 1.00 0.00 H ATOM 1625 H ASN B 98 33.010 12.578 -17.411 1.00 0.00 H ATOM 1626 N LEU B 99 31.188 10.176 -16.365 1.00 32.33 N ATOM 1627 CA LEU B 99 30.007 9.321 -16.185 1.00 32.40 C ATOM 1628 C LEU B 99 29.923 8.208 -17.220 1.00 32.68 C ATOM 1629 O LEU B 99 29.494 7.099 -16.900 1.00 32.32 O ATOM 1630 CB LEU B 99 28.718 10.146 -16.237 1.00 32.26 C ATOM 1631 CG LEU B 99 28.398 11.041 -15.036 1.00 32.51 C ATOM 1632 CD1 LEU B 99 27.185 11.903 -15.371 1.00 32.68 C ATOM 1633 CD2 LEU B 99 28.141 10.204 -13.780 1.00 30.44 C ATOM 1634 HA LEU B 99 30.116 8.863 -15.202 1.00 0.00 H ATOM 1635 HB2 LEU B 99 28.777 10.788 -17.116 1.00 0.00 H ATOM 1636 HB3 LEU B 99 27.889 9.448 -16.354 1.00 0.00 H ATOM 1637 HG LEU B 99 29.254 11.683 -14.828 1.00 0.00 H ATOM 1638 HD21 LEU B 99 27.296 9.538 -13.955 1.00 0.00 H ATOM 1639 HD22 LEU B 99 29.028 9.614 -13.550 1.00 0.00 H ATOM 1640 HD23 LEU B 99 27.916 10.866 -12.944 1.00 0.00 H ATOM 1641 HD11 LEU B 99 27.408 12.520 -16.242 1.00 0.00 H ATOM 1642 HD12 LEU B 99 26.333 11.260 -15.589 1.00 0.00 H ATOM 1643 HD13 LEU B 99 26.950 12.544 -14.521 1.00 0.00 H ATOM 1644 H LEU B 99 31.051 11.188 -16.564 1.00 0.00 H ATOM 1645 N TYR B 100 30.321 8.518 -18.455 1.00 32.95 N ATOM 1646 CA TYR B 100 30.216 7.572 -19.566 1.00 33.92 C ATOM 1647 C TYR B 100 31.259 6.449 -19.490 1.00 34.33 C ATOM 1648 O TYR B 100 31.314 5.578 -20.364 1.00 34.33 O ATOM 1649 CB TYR B 100 30.258 8.294 -20.926 1.00 33.39 C ATOM 1650 CG TYR B 100 28.957 8.968 -21.300 1.00 33.44 C ATOM 1651 CD1 TYR B 100 27.739 8.264 -21.268 1.00 32.61 C ATOM 1652 CD2 TYR B 100 28.934 10.298 -21.706 1.00 33.26 C ATOM 1653 CE1 TYR B 100 26.538 8.884 -21.611 1.00 32.53 C ATOM 1654 CE2 TYR B 100 27.739 10.929 -22.046 1.00 32.95 C ATOM 1655 CZ TYR B 100 26.548 10.220 -21.995 1.00 33.43 C ATOM 1656 OH TYR B 100 25.371 10.851 -22.337 1.00 33.97 O ATOM 1657 HA TYR B 100 29.242 7.092 -19.473 1.00 0.00 H ATOM 1658 HB3 TYR B 100 30.500 7.562 -21.697 1.00 0.00 H ATOM 1659 HB2 TYR B 100 31.040 9.052 -20.889 1.00 0.00 H ATOM 1660 HD2 TYR B 100 29.868 10.857 -21.759 1.00 0.00 H ATOM 1661 HE2 TYR B 100 27.740 11.976 -22.351 1.00 0.00 H ATOM 1662 HE1 TYR B 100 25.602 8.327 -21.578 1.00 0.00 H ATOM 1663 HD1 TYR B 100 27.734 7.216 -20.970 1.00 0.00 H ATOM 1664 HH TYR B 100 25.428 11.169 -23.273 1.00 0.00 H ATOM 1665 H TYR B 100 30.719 9.462 -18.634 1.00 0.00 H ATOM 1666 N ARG B 101 32.060 6.468 -18.425 1.00 34.84 N ATOM 1667 CA ARG B 101 32.986 5.383 -18.116 1.00 35.60 C ATOM 1668 C ARG B 101 32.338 4.420 -17.112 1.00 35.46 C ATOM 1669 O ARG B 101 33.012 3.773 -16.315 1.00 35.58 O ATOM 1670 CB ARG B 101 34.314 5.943 -17.598 1.00 36.15 C ATOM 1671 CG ARG B 101 35.041 6.810 -18.626 1.00 38.84 C ATOM 1672 CD ARG B 101 36.335 7.381 -18.059 1.00 44.01 C ATOM 1673 NE ARG B 101 37.217 7.919 -19.102 1.00 46.68 N ATOM 1674 CZ ARG B 101 38.038 7.191 -19.859 1.00 49.02 C ATOM 1675 NH1 ARG B 101 38.103 5.869 -19.714 1.00 50.93 N ATOM 1676 NH2 ARG B 101 38.803 7.786 -20.772 1.00 49.27 N ATOM 1677 HA ARG B 101 33.207 4.823 -19.025 1.00 0.00 H ATOM 1678 HB2 ARG B 101 34.114 6.547 -16.713 1.00 0.00 H ATOM 1679 HB3 ARG B 101 34.961 5.108 -17.328 1.00 0.00 H ATOM 1680 HG2 ARG B 101 35.275 6.203 -19.500 1.00 0.00 H ATOM 1681 HG3 ARG B 101 34.389 7.633 -18.920 1.00 0.00 H ATOM 1682 HD2 ARG B 101 36.864 6.589 -17.528 1.00 0.00 H ATOM 1683 HD3 ARG B 101 36.088 8.182 -17.362 1.00 0.00 H ATOM 1684 HE ARG B 101 37.200 8.946 -19.263 1.00 0.00 H ATOM 1685 HH12 ARG B 101 38.747 5.312 -20.310 1.00 0.00 H ATOM 1686 HH11 ARG B 101 37.509 5.394 -19.004 1.00 0.00 H ATOM 1687 HH22 ARG B 101 39.444 7.219 -21.363 1.00 0.00 H ATOM 1688 HH21 ARG B 101 38.760 8.818 -20.894 1.00 0.00 H ATOM 1689 H ARG B 101 32.024 7.289 -17.788 1.00 0.00 H ATOM 1690 N CYS B 102 31.009 4.350 -17.172 1.00 35.14 N ATOM 1691 CA CYS B 102 30.194 3.411 -16.414 1.00 34.61 C ATOM 1692 C CYS B 102 30.192 2.045 -17.124 1.00 34.30 C ATOM 1693 O CYS B 102 30.642 1.955 -18.272 1.00 34.26 O ATOM 1694 CB CYS B 102 28.766 3.960 -16.349 1.00 34.94 C ATOM 1695 SG CYS B 102 28.043 4.214 -17.996 1.00 34.36 S ATOM 1696 HA CYS B 102 30.595 3.287 -15.408 1.00 0.00 H ATOM 1697 HB2 CYS B 102 28.782 4.914 -15.823 1.00 0.00 H ATOM 1698 HB3 CYS B 102 28.144 3.254 -15.799 1.00 0.00 H ATOM 1699 HG CYS B 102 28.006 3.011 -18.671 1.00 0.00 H ATOM 1700 H CYS B 102 30.519 5.013 -17.805 1.00 0.00 H ATOM 1701 N PRO B 103 29.680 0.976 -16.464 1.00 33.86 N ATOM 1702 CA PRO B 103 29.515 -0.275 -17.215 1.00 33.58 C ATOM 1703 C PRO B 103 28.544 -0.090 -18.383 1.00 33.46 C ATOM 1704 O PRO B 103 27.690 0.800 -18.346 1.00 32.97 O ATOM 1705 CB PRO B 103 28.912 -1.236 -16.183 1.00 33.77 C ATOM 1706 CG PRO B 103 29.273 -0.645 -14.852 1.00 33.85 C ATOM 1707 CD PRO B 103 29.252 0.830 -15.059 1.00 33.54 C ATOM 1708 HA PRO B 103 30.452 -0.629 -17.646 1.00 0.00 H ATOM 1709 HD3 PRO B 103 28.250 1.232 -14.911 1.00 0.00 H ATOM 1710 HD2 PRO B 103 29.946 1.330 -14.384 1.00 0.00 H ATOM 1711 HG3 PRO B 103 30.266 -0.974 -14.544 1.00 0.00 H ATOM 1712 HG2 PRO B 103 28.545 -0.935 -14.095 1.00 0.00 H ATOM 1713 HB2 PRO B 103 27.830 -1.293 -16.297 1.00 0.00 H ATOM 1714 HB3 PRO B 103 29.340 -2.233 -16.290 1.00 0.00 H ATOM 1715 N GLY B 104 28.692 -0.926 -19.405 1.00 33.21 N ATOM 1716 CA GLY B 104 27.864 -0.875 -20.609 1.00 33.39 C ATOM 1717 C GLY B 104 26.366 -0.767 -20.376 1.00 33.25 C ATOM 1718 O GLY B 104 25.695 0.033 -21.034 1.00 33.25 O ATOM 1719 HA3 GLY B 104 28.049 -1.784 -21.182 1.00 0.00 H ATOM 1720 HA2 GLY B 104 28.175 -0.009 -21.193 1.00 0.00 H ATOM 1721 H GLY B 104 29.434 -1.653 -19.346 1.00 0.00 H ATOM 1722 N ASP B 105 25.849 -1.551 -19.430 1.00 32.80 N ATOM 1723 CA ASP B 105 24.408 -1.589 -19.148 1.00 32.89 C ATOM 1724 C ASP B 105 23.862 -0.376 -18.384 1.00 32.63 C ATOM 1725 O ASP B 105 22.647 -0.270 -18.159 1.00 32.49 O ATOM 1726 CB ASP B 105 24.014 -2.905 -18.451 1.00 33.49 C ATOM 1727 CG ASP B 105 24.641 -3.078 -17.062 1.00 34.55 C ATOM 1728 OD1 ASP B 105 25.506 -2.284 -16.649 1.00 35.25 O ATOM 1729 OD2 ASP B 105 24.257 -4.044 -16.371 1.00 36.24 O ATOM 1730 HA ASP B 105 23.931 -1.540 -20.127 1.00 0.00 H ATOM 1731 HB2 ASP B 105 22.929 -2.927 -18.345 1.00 0.00 H ATOM 1732 HB3 ASP B 105 24.333 -3.737 -19.079 1.00 0.00 H ATOM 1733 H ASP B 105 26.487 -2.155 -18.874 1.00 0.00 H ATOM 1734 N ASP B 106 24.764 0.520 -17.987 1.00 31.51 N ATOM 1735 CA ASP B 106 24.386 1.736 -17.272 1.00 31.36 C ATOM 1736 C ASP B 106 24.259 2.937 -18.195 1.00 30.53 C ATOM 1737 O ASP B 106 23.763 3.969 -17.783 1.00 30.05 O ATOM 1738 CB ASP B 106 25.377 2.034 -16.136 1.00 31.46 C ATOM 1739 CG ASP B 106 25.095 1.211 -14.880 1.00 32.97 C ATOM 1740 OD1 ASP B 106 24.272 0.263 -14.955 1.00 33.43 O ATOM 1741 OD2 ASP B 106 25.700 1.500 -13.818 1.00 32.97 O ATOM 1742 HA ASP B 106 23.401 1.554 -16.843 1.00 0.00 H ATOM 1743 HB2 ASP B 106 26.385 1.807 -16.483 1.00 0.00 H ATOM 1744 HB3 ASP B 106 25.310 3.092 -15.883 1.00 0.00 H ATOM 1745 H ASP B 106 25.769 0.348 -18.193 1.00 0.00 H ATOM 1746 N LYS B 107 24.688 2.803 -19.448 1.00 30.19 N ATOM 1747 CA LYS B 107 24.624 3.944 -20.365 1.00 30.54 C ATOM 1748 C LYS B 107 23.190 4.408 -20.618 1.00 29.56 C ATOM 1749 O LYS B 107 22.942 5.603 -20.708 1.00 29.32 O ATOM 1750 CB LYS B 107 25.319 3.645 -21.688 1.00 30.34 C ATOM 1751 CG LYS B 107 26.836 3.769 -21.635 1.00 30.94 C ATOM 1752 CD LYS B 107 27.442 3.449 -23.009 1.00 32.06 C ATOM 1753 CE LYS B 107 27.250 1.978 -23.393 1.00 33.18 C ATOM 1754 NZ LYS B 107 27.613 1.706 -24.824 1.00 35.23 N ATOM 1755 HA LYS B 107 25.155 4.757 -19.871 1.00 0.00 H ATOM 1756 HB2 LYS B 107 25.069 2.626 -21.984 1.00 0.00 H ATOM 1757 HB3 LYS B 107 24.944 4.342 -22.437 1.00 0.00 H ATOM 1758 HG2 LYS B 107 27.105 4.786 -21.351 1.00 0.00 H ATOM 1759 HG3 LYS B 107 27.229 3.071 -20.896 1.00 0.00 H ATOM 1760 HD2 LYS B 107 26.961 4.075 -23.761 1.00 0.00 H ATOM 1761 HD3 LYS B 107 28.509 3.670 -22.983 1.00 0.00 H ATOM 1762 HE2 LYS B 107 26.205 1.710 -23.240 1.00 0.00 H ATOM 1763 HE3 LYS B 107 27.879 1.363 -22.749 1.00 0.00 H ATOM 1764 HZ1 LYS B 107 27.013 2.282 -25.448 1.00 0.00 H ATOM 1765 HZ2 LYS B 107 28.612 1.951 -24.980 1.00 0.00 H ATOM 1766 HZ3 LYS B 107 27.465 0.698 -25.032 1.00 0.00 H ATOM 1767 H LYS B 107 25.067 1.892 -19.775 1.00 0.00 H ATOM 1768 N SER B 108 22.254 3.468 -20.727 1.00 29.37 N ATOM 1769 CA SER B 108 20.844 3.818 -20.959 1.00 28.92 C ATOM 1770 C SER B 108 20.234 4.599 -19.790 1.00 28.79 C ATOM 1771 O SER B 108 19.290 5.377 -19.966 1.00 28.43 O ATOM 1772 CB SER B 108 20.023 2.567 -21.257 1.00 29.43 C ATOM 1773 OG SER B 108 20.065 1.640 -20.192 1.00 29.93 O ATOM 1774 HA SER B 108 20.817 4.475 -21.828 1.00 0.00 H ATOM 1775 HB2 SER B 108 20.419 2.091 -22.154 1.00 0.00 H ATOM 1776 HB3 SER B 108 18.987 2.859 -21.429 1.00 0.00 H ATOM 1777 HG SER B 108 19.522 0.846 -20.425 1.00 0.00 H ATOM 1778 H SER B 108 22.525 2.467 -20.647 1.00 0.00 H ATOM 1779 N LYS B 109 20.795 4.397 -18.600 1.00 28.66 N ATOM 1780 CA LYS B 109 20.321 5.065 -17.397 1.00 28.09 C ATOM 1781 C LYS B 109 20.765 6.520 -17.415 1.00 28.33 C ATOM 1782 O LYS B 109 20.041 7.396 -16.933 1.00 28.87 O ATOM 1783 CB LYS B 109 20.824 4.350 -16.133 1.00 28.13 C ATOM 1784 CG LYS B 109 20.387 2.884 -16.023 1.00 28.02 C ATOM 1785 CD LYS B 109 21.070 2.199 -14.835 1.00 27.78 C ATOM 1786 CE LYS B 109 20.871 0.685 -14.891 1.00 27.54 C ATOM 1787 NZ LYS B 109 21.545 0.006 -13.755 1.00 28.17 N ATOM 1788 HA LYS B 109 19.232 5.028 -17.379 1.00 0.00 H ATOM 1789 HB2 LYS B 109 21.913 4.383 -16.132 1.00 0.00 H ATOM 1790 HB3 LYS B 109 20.445 4.886 -15.263 1.00 0.00 H ATOM 1791 HG2 LYS B 109 19.306 2.842 -15.887 1.00 0.00 H ATOM 1792 HG3 LYS B 109 20.657 2.361 -16.941 1.00 0.00 H ATOM 1793 HD2 LYS B 109 22.137 2.420 -14.860 1.00 0.00 H ATOM 1794 HD3 LYS B 109 20.643 2.581 -13.908 1.00 0.00 H ATOM 1795 HE2 LYS B 109 21.285 0.307 -15.826 1.00 0.00 H ATOM 1796 HE3 LYS B 109 19.804 0.466 -14.853 1.00 0.00 H ATOM 1797 HZ1 LYS B 109 22.565 0.206 -13.789 1.00 0.00 H ATOM 1798 HZ2 LYS B 109 21.151 0.358 -12.859 1.00 0.00 H ATOM 1799 HZ3 LYS B 109 21.390 -1.020 -13.824 1.00 0.00 H ATOM 1800 H LYS B 109 21.598 3.740 -18.527 1.00 0.00 H ATOM 1801 N ILE B 110 21.944 6.780 -17.979 1.00 27.89 N ATOM 1802 CA ILE B 110 22.403 8.166 -18.160 1.00 28.32 C ATOM 1803 C ILE B 110 21.516 8.918 -19.178 1.00 28.14 C ATOM 1804 O ILE B 110 21.076 10.055 -18.922 1.00 28.44 O ATOM 1805 CB ILE B 110 23.913 8.249 -18.553 1.00 28.17 C ATOM 1806 CG1 ILE B 110 24.790 7.615 -17.464 1.00 28.31 C ATOM 1807 CG2 ILE B 110 24.332 9.700 -18.803 1.00 28.29 C ATOM 1808 CD1 ILE B 110 26.200 7.309 -17.919 1.00 28.33 C ATOM 1809 HA ILE B 110 22.304 8.660 -17.193 1.00 0.00 H ATOM 1810 HB ILE B 110 24.054 7.690 -19.478 1.00 0.00 H ATOM 1811 HG12 ILE B 110 24.842 8.303 -16.620 1.00 0.00 H ATOM 1812 HG13 ILE B 110 24.322 6.684 -17.144 1.00 0.00 H ATOM 1813 HD11 ILE B 110 26.167 6.612 -18.756 1.00 0.00 H ATOM 1814 HD12 ILE B 110 26.688 8.232 -18.232 1.00 0.00 H ATOM 1815 HD13 ILE B 110 26.758 6.863 -17.095 1.00 0.00 H ATOM 1816 HG21 ILE B 110 23.734 10.115 -19.615 1.00 0.00 H ATOM 1817 HG22 ILE B 110 24.172 10.284 -17.897 1.00 0.00 H ATOM 1818 HG23 ILE B 110 25.387 9.730 -19.075 1.00 0.00 H ATOM 1819 H ILE B 110 22.547 5.994 -18.295 1.00 0.00 H ATOM 1820 N VAL B 111 21.251 8.278 -20.312 1.00 28.18 N ATOM 1821 CA VAL B 111 20.388 8.858 -21.340 1.00 27.32 C ATOM 1822 C VAL B 111 18.971 9.133 -20.790 1.00 27.44 C ATOM 1823 O VAL B 111 18.401 10.198 -21.037 1.00 26.25 O ATOM 1824 CB VAL B 111 20.368 7.973 -22.620 1.00 27.93 C ATOM 1825 CG1 VAL B 111 19.366 8.500 -23.642 1.00 26.97 C ATOM 1826 CG2 VAL B 111 21.756 7.933 -23.249 1.00 27.31 C ATOM 1827 HA VAL B 111 20.805 9.823 -21.630 1.00 0.00 H ATOM 1828 HB VAL B 111 20.066 6.968 -22.325 1.00 0.00 H ATOM 1829 HG11 VAL B 111 18.368 8.500 -23.204 1.00 0.00 H ATOM 1830 HG12 VAL B 111 19.639 9.516 -23.926 1.00 0.00 H ATOM 1831 HG13 VAL B 111 19.377 7.859 -24.524 1.00 0.00 H ATOM 1832 HG21 VAL B 111 22.061 8.944 -23.517 1.00 0.00 H ATOM 1833 HG22 VAL B 111 22.465 7.515 -22.535 1.00 0.00 H ATOM 1834 HG23 VAL B 111 21.730 7.311 -24.144 1.00 0.00 H ATOM 1835 H VAL B 111 21.669 7.339 -20.473 1.00 0.00 H ATOM 1836 N ARG B 112 18.419 8.178 -20.034 1.00 27.44 N ATOM 1837 CA ARG B 112 17.108 8.363 -19.401 1.00 28.19 C ATOM 1838 C ARG B 112 17.049 9.664 -18.593 1.00 27.91 C ATOM 1839 O ARG B 112 16.088 10.436 -18.711 1.00 28.39 O ATOM 1840 CB ARG B 112 16.741 7.168 -18.516 1.00 28.00 C ATOM 1841 CG ARG B 112 15.282 7.199 -18.041 1.00 30.70 C ATOM 1842 CD ARG B 112 15.023 6.161 -16.977 1.00 35.03 C ATOM 1843 NE ARG B 112 13.598 5.939 -16.754 1.00 37.69 N ATOM 1844 CZ ARG B 112 13.087 5.063 -15.889 1.00 39.05 C ATOM 1845 NH1 ARG B 112 13.880 4.307 -15.138 1.00 39.50 N ATOM 1846 NH2 ARG B 112 11.771 4.943 -15.780 1.00 38.41 N ATOM 1847 HA ARG B 112 16.374 8.431 -20.204 1.00 0.00 H ATOM 1848 HB2 ARG B 112 16.902 6.252 -19.084 1.00 0.00 H ATOM 1849 HB3 ARG B 112 17.391 7.170 -17.641 1.00 0.00 H ATOM 1850 HG2 ARG B 112 15.063 8.186 -17.634 1.00 0.00 H ATOM 1851 HG3 ARG B 112 14.628 7.005 -18.891 1.00 0.00 H ATOM 1852 HD2 ARG B 112 15.476 6.495 -16.044 1.00 0.00 H ATOM 1853 HD3 ARG B 112 15.480 5.221 -17.286 1.00 0.00 H ATOM 1854 HE ARG B 112 12.930 6.508 -17.313 1.00 0.00 H ATOM 1855 HH12 ARG B 112 13.468 3.628 -14.467 1.00 0.00 H ATOM 1856 HH11 ARG B 112 14.913 4.395 -15.221 1.00 0.00 H ATOM 1857 HH22 ARG B 112 11.365 4.262 -15.107 1.00 0.00 H ATOM 1858 HH21 ARG B 112 11.145 5.530 -16.367 1.00 0.00 H ATOM 1859 H ARG B 112 18.930 7.284 -19.891 1.00 0.00 H ATOM 1860 N VAL B 113 18.063 9.892 -17.763 1.00 28.15 N ATOM 1861 CA VAL B 113 18.149 11.112 -16.953 1.00 27.99 C ATOM 1862 C VAL B 113 18.239 12.356 -17.843 1.00 28.40 C ATOM 1863 O VAL B 113 17.531 13.342 -17.615 1.00 27.99 O ATOM 1864 CB VAL B 113 19.368 11.089 -15.976 1.00 28.32 C ATOM 1865 CG1 VAL B 113 19.586 12.461 -15.342 1.00 28.43 C ATOM 1866 CG2 VAL B 113 19.163 10.055 -14.866 1.00 28.25 C ATOM 1867 HA VAL B 113 17.236 11.152 -16.359 1.00 0.00 H ATOM 1868 HB VAL B 113 20.246 10.818 -16.562 1.00 0.00 H ATOM 1869 HG11 VAL B 113 19.778 13.195 -16.125 1.00 0.00 H ATOM 1870 HG12 VAL B 113 18.695 12.748 -14.784 1.00 0.00 H ATOM 1871 HG13 VAL B 113 20.440 12.416 -14.667 1.00 0.00 H ATOM 1872 HG21 VAL B 113 18.266 10.305 -14.300 1.00 0.00 H ATOM 1873 HG22 VAL B 113 19.051 9.065 -15.309 1.00 0.00 H ATOM 1874 HG23 VAL B 113 20.027 10.061 -14.201 1.00 0.00 H ATOM 1875 H VAL B 113 18.819 9.182 -17.686 1.00 0.00 H ATOM 1876 N LEU B 114 19.117 12.304 -18.846 1.00 28.21 N ATOM 1877 CA LEU B 114 19.263 13.410 -19.799 1.00 28.85 C ATOM 1878 C LEU B 114 17.959 13.765 -20.502 1.00 28.46 C ATOM 1879 O LEU B 114 17.628 14.944 -20.641 1.00 28.65 O ATOM 1880 CB LEU B 114 20.350 13.094 -20.837 1.00 28.68 C ATOM 1881 CG LEU B 114 21.786 13.202 -20.329 1.00 28.52 C ATOM 1882 CD1 LEU B 114 22.767 12.638 -21.384 1.00 27.08 C ATOM 1883 CD2 LEU B 114 22.111 14.668 -19.989 1.00 27.48 C ATOM 1884 HA LEU B 114 19.560 14.281 -19.214 1.00 0.00 H ATOM 1885 HB2 LEU B 114 20.193 12.075 -21.190 1.00 0.00 H ATOM 1886 HB3 LEU B 114 20.234 13.788 -21.669 1.00 0.00 H ATOM 1887 HG LEU B 114 21.895 12.610 -19.420 1.00 0.00 H ATOM 1888 HD21 LEU B 114 21.998 15.281 -20.883 1.00 0.00 H ATOM 1889 HD22 LEU B 114 21.428 15.021 -19.216 1.00 0.00 H ATOM 1890 HD23 LEU B 114 23.137 14.737 -19.627 1.00 0.00 H ATOM 1891 HD11 LEU B 114 22.532 11.591 -21.574 1.00 0.00 H ATOM 1892 HD12 LEU B 114 22.670 13.207 -22.309 1.00 0.00 H ATOM 1893 HD13 LEU B 114 23.788 12.721 -21.010 1.00 0.00 H ATOM 1894 H LEU B 114 19.713 11.459 -18.955 1.00 0.00 H ATOM 1895 N ASN B 115 17.211 12.750 -20.932 1.00 28.73 N ATOM 1896 CA ASN B 115 15.896 12.983 -21.549 1.00 28.98 C ATOM 1897 C ASN B 115 14.865 13.624 -20.610 1.00 29.08 C ATOM 1898 O ASN B 115 14.086 14.488 -21.027 1.00 28.65 O ATOM 1899 CB ASN B 115 15.331 11.704 -22.165 1.00 28.54 C ATOM 1900 CG ASN B 115 15.924 11.402 -23.528 1.00 30.36 C ATOM 1901 OD1 ASN B 115 16.570 12.257 -24.142 1.00 31.14 O ATOM 1902 ND2 ASN B 115 15.705 10.184 -24.013 1.00 29.87 N ATOM 1903 HA ASN B 115 16.082 13.710 -22.339 1.00 0.00 H ATOM 1904 HB2 ASN B 115 15.547 10.870 -21.497 1.00 0.00 H ATOM 1905 HB3 ASN B 115 14.252 11.814 -22.270 1.00 0.00 H ATOM 1906 HD22 ASN B 115 15.155 9.496 -23.461 1.00 0.00 H ATOM 1907 HD21 ASN B 115 16.084 9.919 -24.945 1.00 0.00 H ATOM 1908 H ASN B 115 17.563 11.777 -20.830 1.00 0.00 H ATOM 1909 N LEU B 116 14.851 13.185 -19.353 1.00 29.32 N ATOM 1910 CA LEU B 116 14.000 13.800 -18.327 1.00 29.43 C ATOM 1911 C LEU B 116 14.391 15.253 -18.052 1.00 29.85 C ATOM 1912 O LEU B 116 13.517 16.125 -17.941 1.00 29.90 O ATOM 1913 CB LEU B 116 14.038 12.996 -17.024 1.00 29.26 C ATOM 1914 CG LEU B 116 13.295 11.652 -17.074 1.00 29.02 C ATOM 1915 CD1 LEU B 116 13.726 10.774 -15.901 1.00 30.62 C ATOM 1916 CD2 LEU B 116 11.772 11.835 -17.094 1.00 29.92 C ATOM 1917 HA LEU B 116 12.983 13.793 -18.719 1.00 0.00 H ATOM 1918 HB2 LEU B 116 15.081 12.798 -16.778 1.00 0.00 H ATOM 1919 HB3 LEU B 116 13.589 13.603 -16.238 1.00 0.00 H ATOM 1920 HG LEU B 116 13.564 11.156 -18.007 1.00 0.00 H ATOM 1921 HD21 LEU B 116 11.459 12.363 -16.193 1.00 0.00 H ATOM 1922 HD22 LEU B 116 11.488 12.413 -17.973 1.00 0.00 H ATOM 1923 HD23 LEU B 116 11.290 10.858 -17.129 1.00 0.00 H ATOM 1924 HD11 LEU B 116 14.799 10.594 -15.959 1.00 0.00 H ATOM 1925 HD12 LEU B 116 13.491 11.280 -14.965 1.00 0.00 H ATOM 1926 HD13 LEU B 116 13.194 9.824 -15.945 1.00 0.00 H ATOM 1927 H LEU B 116 15.460 12.384 -19.091 1.00 0.00 H ATOM 1928 N TRP B 117 15.697 15.511 -17.960 1.00 29.68 N ATOM 1929 CA TRP B 117 16.200 16.868 -17.776 1.00 30.22 C ATOM 1930 C TRP B 117 15.722 17.797 -18.894 1.00 30.75 C ATOM 1931 O TRP B 117 15.298 18.930 -18.624 1.00 30.51 O ATOM 1932 CB TRP B 117 17.726 16.879 -17.701 1.00 30.43 C ATOM 1933 CG TRP B 117 18.290 16.421 -16.365 1.00 30.81 C ATOM 1934 CD1 TRP B 117 17.584 16.067 -15.257 1.00 31.00 C ATOM 1935 CD2 TRP B 117 19.676 16.339 -16.000 1.00 32.75 C ATOM 1936 NE1 TRP B 117 18.436 15.735 -14.229 1.00 30.71 N ATOM 1937 CE2 TRP B 117 19.728 15.899 -14.650 1.00 31.39 C ATOM 1938 CE3 TRP B 117 20.876 16.563 -16.685 1.00 31.75 C ATOM 1939 CZ2 TRP B 117 20.936 15.694 -13.968 1.00 30.58 C ATOM 1940 CZ3 TRP B 117 22.078 16.359 -16.008 1.00 32.17 C ATOM 1941 CH2 TRP B 117 22.098 15.926 -14.661 1.00 31.66 C ATOM 1942 HA TRP B 117 15.801 17.237 -16.831 1.00 0.00 H ATOM 1943 HB2 TRP B 117 18.111 16.219 -18.479 1.00 0.00 H ATOM 1944 HB3 TRP B 117 18.070 17.897 -17.886 1.00 0.00 H ATOM 1945 HE1 TRP B 117 18.145 15.412 -13.284 1.00 0.00 H ATOM 1946 HD1 TRP B 117 16.496 16.049 -15.193 1.00 0.00 H ATOM 1947 HZ2 TRP B 117 20.952 15.364 -12.929 1.00 0.00 H ATOM 1948 HH2 TRP B 117 23.056 15.774 -14.163 1.00 0.00 H ATOM 1949 HZ3 TRP B 117 23.020 16.537 -16.526 1.00 0.00 H ATOM 1950 HE3 TRP B 117 20.871 16.890 -17.725 1.00 0.00 H ATOM 1951 H TRP B 117 16.374 14.724 -18.021 1.00 0.00 H ATOM 1952 N GLN B 118 15.788 17.310 -20.136 1.00 31.22 N ATOM 1953 CA GLN B 118 15.253 18.029 -21.304 1.00 32.55 C ATOM 1954 C GLN B 118 13.734 18.210 -21.244 1.00 33.19 C ATOM 1955 O GLN B 118 13.230 19.330 -21.385 1.00 33.47 O ATOM 1956 CB GLN B 118 15.670 17.348 -22.614 1.00 32.92 C ATOM 1957 CG GLN B 118 15.409 18.213 -23.863 1.00 35.70 C ATOM 1958 CD GLN B 118 16.225 17.776 -25.068 1.00 39.63 C ATOM 1959 OE1 GLN B 118 16.004 16.699 -25.627 1.00 41.41 O ATOM 1960 NE2 GLN B 118 17.174 18.620 -25.482 1.00 41.35 N ATOM 1961 HA GLN B 118 15.691 19.027 -21.278 1.00 0.00 H ATOM 1962 HB2 GLN B 118 16.736 17.125 -22.564 1.00 0.00 H ATOM 1963 HB3 GLN B 118 15.110 16.418 -22.714 1.00 0.00 H ATOM 1964 HG2 GLN B 118 14.351 18.147 -24.117 1.00 0.00 H ATOM 1965 HG3 GLN B 118 15.661 19.247 -23.629 1.00 0.00 H ATOM 1966 HE22 GLN B 118 17.326 19.518 -24.980 1.00 0.00 H ATOM 1967 HE21 GLN B 118 17.761 18.379 -26.306 1.00 0.00 H ATOM 1968 H GLN B 118 16.236 16.383 -20.284 1.00 0.00 H ATOM 1969 N LYS B 119 13.016 17.114 -21.014 1.00 33.68 N ATOM 1970 CA LYS B 119 11.558 17.123 -20.941 1.00 34.76 C ATOM 1971 C LYS B 119 11.044 18.143 -19.928 1.00 35.05 C ATOM 1972 O LYS B 119 10.081 18.862 -20.197 1.00 34.95 O ATOM 1973 CB LYS B 119 11.037 15.731 -20.577 1.00 34.90 C ATOM 1974 CG LYS B 119 9.563 15.523 -20.843 1.00 37.43 C ATOM 1975 CD LYS B 119 8.978 14.540 -19.845 1.00 40.22 C ATOM 1976 CE LYS B 119 7.652 13.997 -20.326 1.00 42.89 C ATOM 1977 NZ LYS B 119 7.093 13.069 -19.304 1.00 45.57 N ATOM 1978 HA LYS B 119 11.186 17.409 -21.925 1.00 0.00 H ATOM 1979 HB2 LYS B 119 11.595 14.996 -21.157 1.00 0.00 H ATOM 1980 HB3 LYS B 119 11.218 15.567 -19.515 1.00 0.00 H ATOM 1981 HG2 LYS B 119 9.044 16.477 -20.754 1.00 0.00 H ATOM 1982 HG3 LYS B 119 9.432 15.132 -21.852 1.00 0.00 H ATOM 1983 HD2 LYS B 119 9.674 13.712 -19.711 1.00 0.00 H ATOM 1984 HD3 LYS B 119 8.830 15.047 -18.891 1.00 0.00 H ATOM 1985 HE2 LYS B 119 7.798 13.460 -21.263 1.00 0.00 H ATOM 1986 HE3 LYS B 119 6.958 14.822 -20.486 1.00 0.00 H ATOM 1987 HZ1 LYS B 119 7.756 12.282 -19.153 1.00 0.00 H ATOM 1988 HZ2 LYS B 119 6.954 13.583 -18.410 1.00 0.00 H ATOM 1989 HZ3 LYS B 119 6.181 12.697 -19.637 1.00 0.00 H ATOM 1990 H LYS B 119 13.515 16.211 -20.880 1.00 0.00 H ATOM 1991 N ASN B 120 11.701 18.198 -18.773 1.00 35.51 N ATOM 1992 CA ASN B 120 11.245 18.998 -17.639 1.00 36.22 C ATOM 1993 C ASN B 120 12.021 20.304 -17.471 1.00 36.21 C ATOM 1994 O ASN B 120 11.866 21.000 -16.465 1.00 36.46 O ATOM 1995 CB ASN B 120 11.316 18.159 -16.356 1.00 36.30 C ATOM 1996 CG ASN B 120 10.381 16.957 -16.392 1.00 37.68 C ATOM 1997 OD1 ASN B 120 9.238 17.057 -16.830 1.00 37.87 O ATOM 1998 ND2 ASN B 120 10.867 15.816 -15.920 1.00 39.32 N ATOM 1999 HA ASN B 120 10.213 19.284 -17.841 1.00 0.00 H ATOM 2000 HB2 ASN B 120 12.338 17.803 -16.227 1.00 0.00 H ATOM 2001 HB3 ASN B 120 11.043 18.790 -15.510 1.00 0.00 H ATOM 2002 HD22 ASN B 120 11.841 15.776 -15.558 1.00 0.00 H ATOM 2003 HD21 ASN B 120 10.274 14.962 -15.912 1.00 0.00 H ATOM 2004 H ASN B 120 12.578 17.647 -18.673 1.00 0.00 H ATOM 2005 N ASN B 121 12.855 20.621 -18.459 1.00 36.36 N ATOM 2006 CA ASN B 121 13.645 21.862 -18.492 1.00 37.19 C ATOM 2007 C ASN B 121 14.491 22.105 -17.239 1.00 37.28 C ATOM 2008 O ASN B 121 14.583 23.234 -16.731 1.00 36.97 O ATOM 2009 CB ASN B 121 12.758 23.080 -18.834 1.00 37.62 C ATOM 2010 CG ASN B 121 12.051 22.930 -20.172 1.00 39.05 C ATOM 2011 OD1 ASN B 121 12.657 22.548 -21.184 1.00 40.88 O ATOM 2012 ND2 ASN B 121 10.759 23.229 -20.187 1.00 41.08 N ATOM 2013 HA ASN B 121 14.369 21.728 -19.295 1.00 0.00 H ATOM 2014 HB2 ASN B 121 12.007 23.196 -18.053 1.00 0.00 H ATOM 2015 HB3 ASN B 121 13.385 23.971 -18.868 1.00 0.00 H ATOM 2016 HD22 ASN B 121 10.288 23.546 -19.315 1.00 0.00 H ATOM 2017 HD21 ASN B 121 10.216 23.146 -21.070 1.00 0.00 H ATOM 2018 H ASN B 121 12.954 19.955 -19.251 1.00 0.00 H ATOM 2019 N VAL B 122 15.105 21.028 -16.744 1.00 37.14 N ATOM 2020 CA VAL B 122 15.944 21.084 -15.542 1.00 37.55 C ATOM 2021 C VAL B 122 17.253 21.799 -15.891 1.00 37.84 C ATOM 2022 O VAL B 122 17.783 22.584 -15.106 1.00 38.03 O ATOM 2023 CB VAL B 122 16.192 19.667 -14.961 1.00 37.54 C ATOM 2024 CG1 VAL B 122 16.953 19.733 -13.649 1.00 37.77 C ATOM 2025 CG2 VAL B 122 14.872 18.932 -14.751 1.00 36.91 C ATOM 2026 HA VAL B 122 15.431 21.646 -14.762 1.00 0.00 H ATOM 2027 HB VAL B 122 16.796 19.119 -15.684 1.00 0.00 H ATOM 2028 HG11 VAL B 122 17.917 20.214 -13.813 1.00 0.00 H ATOM 2029 HG12 VAL B 122 16.377 20.309 -12.925 1.00 0.00 H ATOM 2030 HG13 VAL B 122 17.109 18.723 -13.270 1.00 0.00 H ATOM 2031 HG21 VAL B 122 14.251 19.495 -14.055 1.00 0.00 H ATOM 2032 HG22 VAL B 122 14.355 18.836 -15.706 1.00 0.00 H ATOM 2033 HG23 VAL B 122 15.070 17.941 -14.343 1.00 0.00 H ATOM 2034 H VAL B 122 14.984 20.116 -17.228 1.00 0.00 H ATOM 2035 N PHE B 123 17.751 21.512 -17.088 1.00 38.45 N ATOM 2036 CA PHE B 123 18.888 22.209 -17.673 1.00 38.62 C ATOM 2037 C PHE B 123 18.455 22.721 -19.025 1.00 38.66 C ATOM 2038 O PHE B 123 17.521 22.189 -19.626 1.00 38.41 O ATOM 2039 CB PHE B 123 20.089 21.265 -17.839 1.00 38.72 C ATOM 2040 CG PHE B 123 20.733 20.861 -16.543 1.00 38.17 C ATOM 2041 CD1 PHE B 123 20.210 19.819 -15.783 1.00 36.74 C ATOM 2042 CD2 PHE B 123 21.864 21.531 -16.079 1.00 38.40 C ATOM 2043 CE1 PHE B 123 20.793 19.463 -14.587 1.00 37.45 C ATOM 2044 CE2 PHE B 123 22.472 21.168 -14.887 1.00 37.38 C ATOM 2045 CZ PHE B 123 21.940 20.135 -14.134 1.00 36.93 C ATOM 2046 HA PHE B 123 19.198 23.025 -17.021 1.00 0.00 H ATOM 2047 HB2 PHE B 123 19.749 20.364 -18.349 1.00 0.00 H ATOM 2048 HB3 PHE B 123 20.838 21.767 -18.452 1.00 0.00 H ATOM 2049 HD2 PHE B 123 22.277 22.354 -16.663 1.00 0.00 H ATOM 2050 HE2 PHE B 123 23.364 21.693 -14.545 1.00 0.00 H ATOM 2051 HZ PHE B 123 22.409 19.845 -13.194 1.00 0.00 H ATOM 2052 HE1 PHE B 123 20.363 18.658 -13.991 1.00 0.00 H ATOM 2053 HD1 PHE B 123 19.331 19.280 -16.137 1.00 0.00 H ATOM 2054 H PHE B 123 17.306 20.749 -17.637 1.00 0.00 H ATOM 2055 N LYS B 124 19.134 23.758 -19.504 1.00 38.90 N ATOM 2056 CA LYS B 124 18.847 24.300 -20.816 1.00 39.21 C ATOM 2057 C LYS B 124 19.202 23.265 -21.871 1.00 39.13 C ATOM 2058 O LYS B 124 20.178 22.512 -21.729 1.00 38.47 O ATOM 2059 CB LYS B 124 19.603 25.608 -21.059 1.00 39.46 C ATOM 2060 CG LYS B 124 18.849 26.866 -20.628 1.00 41.15 C ATOM 2061 CD LYS B 124 17.814 27.292 -21.696 1.00 43.44 C ATOM 2062 CE LYS B 124 17.448 28.785 -21.609 1.00 44.60 C ATOM 2063 NZ LYS B 124 16.900 29.195 -20.275 1.00 45.07 N ATOM 2064 HA LYS B 124 17.783 24.530 -20.877 1.00 0.00 H ATOM 2065 HB2 LYS B 124 20.541 25.567 -20.506 1.00 0.00 H ATOM 2066 HB3 LYS B 124 19.814 25.686 -22.125 1.00 0.00 H ATOM 2067 HG2 LYS B 124 18.331 26.666 -19.690 1.00 0.00 H ATOM 2068 HG3 LYS B 124 19.563 27.676 -20.482 1.00 0.00 H ATOM 2069 HD2 LYS B 124 18.230 27.092 -22.684 1.00 0.00 H ATOM 2070 HD3 LYS B 124 16.908 26.702 -21.558 1.00 0.00 H ATOM 2071 HE2 LYS B 124 16.698 29.001 -22.370 1.00 0.00 H ATOM 2072 HE3 LYS B 124 18.345 29.372 -21.808 1.00 0.00 H ATOM 2073 HZ1 LYS B 124 16.036 28.652 -20.075 1.00 0.00 H ATOM 2074 HZ2 LYS B 124 17.609 29.006 -19.538 1.00 0.00 H ATOM 2075 HZ3 LYS B 124 16.677 30.211 -20.291 1.00 0.00 H ATOM 2076 H LYS B 124 19.885 24.188 -18.927 1.00 0.00 H ATOM 2077 N SER B 125 18.381 23.229 -22.914 1.00 38.62 N ATOM 2078 CA SER B 125 18.500 22.259 -23.988 1.00 38.68 C ATOM 2079 C SER B 125 19.847 22.360 -24.706 1.00 38.29 C ATOM 2080 O SER B 125 20.401 21.342 -25.130 1.00 38.54 O ATOM 2081 CB SER B 125 17.337 22.440 -24.964 1.00 38.89 C ATOM 2082 OG SER B 125 17.362 21.463 -25.985 1.00 40.55 O ATOM 2083 HA SER B 125 18.455 21.259 -23.556 1.00 0.00 H ATOM 2084 HB2 SER B 125 17.405 23.429 -25.418 1.00 0.00 H ATOM 2085 HB3 SER B 125 16.398 22.357 -24.416 1.00 0.00 H ATOM 2086 HG SER B 125 18.210 21.537 -26.490 1.00 0.00 H ATOM 2087 H SER B 125 17.615 23.930 -22.964 1.00 0.00 H ATOM 2088 N GLU B 126 20.373 23.583 -24.819 1.00 37.63 N ATOM 2089 CA GLU B 126 21.683 23.834 -25.431 1.00 37.29 C ATOM 2090 C GLU B 126 22.808 23.128 -24.670 1.00 36.34 C ATOM 2091 O GLU B 126 23.816 22.749 -25.258 1.00 36.42 O ATOM 2092 CB GLU B 126 21.975 25.345 -25.526 1.00 37.35 C ATOM 2093 CG GLU B 126 22.075 26.055 -24.156 1.00 37.71 C ATOM 2094 CD GLU B 126 22.790 27.407 -24.201 1.00 38.64 C ATOM 2095 OE1 GLU B 126 23.083 27.920 -25.311 1.00 39.39 O ATOM 2096 OE2 GLU B 126 23.060 27.957 -23.108 1.00 39.82 O ATOM 2097 HA GLU B 126 21.646 23.423 -26.440 1.00 0.00 H ATOM 2098 HB2 GLU B 126 22.921 25.479 -26.051 1.00 0.00 H ATOM 2099 HB3 GLU B 126 21.174 25.814 -26.097 1.00 0.00 H ATOM 2100 HG2 GLU B 126 21.065 26.215 -23.779 1.00 0.00 H ATOM 2101 HG3 GLU B 126 22.618 25.403 -23.472 1.00 0.00 H ATOM 2102 H GLU B 126 19.830 24.393 -24.457 1.00 0.00 H ATOM 2103 N ILE B 127 22.612 22.955 -23.369 1.00 35.44 N ATOM 2104 CA ILE B 127 23.554 22.259 -22.492 1.00 34.94 C ATOM 2105 C ILE B 127 23.426 20.735 -22.605 1.00 33.91 C ATOM 2106 O ILE B 127 24.435 20.018 -22.633 1.00 34.04 O ATOM 2107 CB ILE B 127 23.347 22.699 -21.002 1.00 35.42 C ATOM 2108 CG1 ILE B 127 23.581 24.210 -20.821 1.00 35.97 C ATOM 2109 CG2 ILE B 127 24.163 21.829 -20.013 1.00 35.37 C ATOM 2110 CD1 ILE B 127 24.815 24.792 -21.522 1.00 37.80 C ATOM 2111 HA ILE B 127 24.557 22.536 -22.816 1.00 0.00 H ATOM 2112 HB ILE B 127 22.302 22.520 -20.751 1.00 0.00 H ATOM 2113 HG12 ILE B 127 22.704 24.731 -21.204 1.00 0.00 H ATOM 2114 HG13 ILE B 127 23.681 24.406 -19.753 1.00 0.00 H ATOM 2115 HD11 ILE B 127 25.712 24.300 -21.144 1.00 0.00 H ATOM 2116 HD12 ILE B 127 24.733 24.626 -22.596 1.00 0.00 H ATOM 2117 HD13 ILE B 127 24.874 25.862 -21.322 1.00 0.00 H ATOM 2118 HG21 ILE B 127 23.852 20.788 -20.105 1.00 0.00 H ATOM 2119 HG22 ILE B 127 25.224 21.914 -20.246 1.00 0.00 H ATOM 2120 HG23 ILE B 127 23.985 22.175 -18.995 1.00 0.00 H ATOM 2121 H ILE B 127 21.740 23.335 -22.949 1.00 0.00 H ATOM 2122 N ILE B 128 22.180 20.264 -22.673 1.00 32.70 N ATOM 2123 CA ILE B 128 21.863 18.832 -22.686 1.00 31.89 C ATOM 2124 C ILE B 128 22.224 18.141 -23.997 1.00 31.56 C ATOM 2125 O ILE B 128 22.718 17.004 -23.995 1.00 31.08 O ATOM 2126 CB ILE B 128 20.357 18.593 -22.377 1.00 31.74 C ATOM 2127 CG1 ILE B 128 20.054 18.958 -20.924 1.00 31.15 C ATOM 2128 CG2 ILE B 128 19.941 17.144 -22.676 1.00 31.64 C ATOM 2129 CD1 ILE B 128 18.602 19.240 -20.651 1.00 29.90 C ATOM 2130 HA ILE B 128 22.480 18.389 -21.905 1.00 0.00 H ATOM 2131 HB ILE B 128 19.771 19.239 -23.031 1.00 0.00 H ATOM 2132 HG12 ILE B 128 20.367 18.128 -20.290 1.00 0.00 H ATOM 2133 HG13 ILE B 128 20.630 19.847 -20.667 1.00 0.00 H ATOM 2134 HD11 ILE B 128 18.274 20.077 -21.268 1.00 0.00 H ATOM 2135 HD12 ILE B 128 18.010 18.356 -20.890 1.00 0.00 H ATOM 2136 HD13 ILE B 128 18.474 19.491 -19.598 1.00 0.00 H ATOM 2137 HG21 ILE B 128 20.115 16.927 -23.730 1.00 0.00 H ATOM 2138 HG22 ILE B 128 20.531 16.464 -22.062 1.00 0.00 H ATOM 2139 HG23 ILE B 128 18.883 17.017 -22.448 1.00 0.00 H ATOM 2140 H ILE B 128 21.395 20.945 -22.719 1.00 0.00 H ATOM 2141 N GLN B 129 21.966 18.816 -25.118 1.00 30.96 N ATOM 2142 CA GLN B 129 22.142 18.187 -26.417 1.00 30.47 C ATOM 2143 C GLN B 129 23.529 17.558 -26.682 1.00 29.92 C ATOM 2144 O GLN B 129 23.589 16.414 -27.150 1.00 29.72 O ATOM 2145 CB GLN B 129 21.670 19.092 -27.565 1.00 30.83 C ATOM 2146 CG GLN B 129 21.395 18.338 -28.892 1.00 33.13 C ATOM 2147 CD GLN B 129 20.369 17.202 -28.749 1.00 36.08 C ATOM 2148 OE1 GLN B 129 19.291 17.386 -28.184 1.00 38.21 O ATOM 2149 NE2 GLN B 129 20.711 16.025 -29.265 1.00 36.69 N ATOM 2150 HA GLN B 129 21.481 17.321 -26.381 1.00 0.00 H ATOM 2151 HB2 GLN B 129 20.750 19.587 -27.255 1.00 0.00 H ATOM 2152 HB3 GLN B 129 22.440 19.841 -27.750 1.00 0.00 H ATOM 2153 HG2 GLN B 129 21.019 19.053 -29.624 1.00 0.00 H ATOM 2154 HG3 GLN B 129 22.333 17.913 -29.249 1.00 0.00 H ATOM 2155 HE22 GLN B 129 21.632 15.911 -29.735 1.00 0.00 H ATOM 2156 HE21 GLN B 129 20.058 15.219 -29.199 1.00 0.00 H ATOM 2157 H GLN B 129 21.636 19.801 -25.062 1.00 0.00 H ATOM 2158 N PRO B 130 24.636 18.289 -26.399 1.00 29.38 N ATOM 2159 CA PRO B 130 25.945 17.659 -26.614 1.00 28.90 C ATOM 2160 C PRO B 130 26.166 16.437 -25.711 1.00 28.33 C ATOM 2161 O PRO B 130 26.887 15.520 -26.089 1.00 27.83 O ATOM 2162 CB PRO B 130 26.948 18.779 -26.272 1.00 29.04 C ATOM 2163 CG PRO B 130 26.169 20.042 -26.323 1.00 29.07 C ATOM 2164 CD PRO B 130 24.783 19.676 -25.905 1.00 29.45 C ATOM 2165 HA PRO B 130 26.048 17.277 -27.630 1.00 0.00 H ATOM 2166 HD3 PRO B 130 24.677 19.718 -24.821 1.00 0.00 H ATOM 2167 HD2 PRO B 130 24.048 20.336 -26.367 1.00 0.00 H ATOM 2168 HG3 PRO B 130 26.167 20.448 -27.335 1.00 0.00 H ATOM 2169 HG2 PRO B 130 26.591 20.778 -25.639 1.00 0.00 H ATOM 2170 HB2 PRO B 130 27.363 18.627 -25.275 1.00 0.00 H ATOM 2171 HB3 PRO B 130 27.757 18.801 -27.002 1.00 0.00 H ATOM 2172 N LEU B 131 25.539 16.427 -24.539 1.00 28.21 N ATOM 2173 CA LEU B 131 25.634 15.294 -23.620 1.00 28.34 C ATOM 2174 C LEU B 131 24.960 14.054 -24.196 1.00 28.66 C ATOM 2175 O LEU B 131 25.470 12.946 -24.035 1.00 28.28 O ATOM 2176 CB LEU B 131 25.020 15.637 -22.259 1.00 28.47 C ATOM 2177 CG LEU B 131 25.550 16.902 -21.579 1.00 28.63 C ATOM 2178 CD1 LEU B 131 24.854 17.150 -20.242 1.00 26.69 C ATOM 2179 CD2 LEU B 131 27.079 16.842 -21.408 1.00 28.34 C ATOM 2180 HA LEU B 131 26.693 15.078 -23.482 1.00 0.00 H ATOM 2181 HB2 LEU B 131 23.946 15.759 -22.399 1.00 0.00 H ATOM 2182 HB3 LEU B 131 25.204 14.797 -21.589 1.00 0.00 H ATOM 2183 HG LEU B 131 25.320 17.746 -22.230 1.00 0.00 H ATOM 2184 HD21 LEU B 131 27.341 15.980 -20.794 1.00 0.00 H ATOM 2185 HD22 LEU B 131 27.549 16.749 -22.387 1.00 0.00 H ATOM 2186 HD23 LEU B 131 27.425 17.754 -20.922 1.00 0.00 H ATOM 2187 HD11 LEU B 131 23.783 17.269 -20.408 1.00 0.00 H ATOM 2188 HD12 LEU B 131 25.029 16.302 -19.580 1.00 0.00 H ATOM 2189 HD13 LEU B 131 25.255 18.056 -19.788 1.00 0.00 H ATOM 2190 H LEU B 131 24.964 17.250 -24.268 1.00 0.00 H ATOM 2191 N LEU B 132 23.812 14.254 -24.843 1.00 28.59 N ATOM 2192 CA LEU B 132 23.118 13.191 -25.564 1.00 28.89 C ATOM 2193 C LEU B 132 23.924 12.739 -26.773 1.00 28.85 C ATOM 2194 O LEU B 132 24.080 11.540 -26.999 1.00 29.32 O ATOM 2195 CB LEU B 132 21.712 13.648 -25.999 1.00 29.03 C ATOM 2196 CG LEU B 132 20.619 13.737 -24.920 1.00 29.72 C ATOM 2197 CD1 LEU B 132 19.397 14.499 -25.442 1.00 28.93 C ATOM 2198 CD2 LEU B 132 20.212 12.343 -24.428 1.00 28.98 C ATOM 2199 HA LEU B 132 23.010 12.344 -24.886 1.00 0.00 H ATOM 2200 HB2 LEU B 132 21.815 14.639 -26.440 1.00 0.00 H ATOM 2201 HB3 LEU B 132 21.363 12.948 -26.758 1.00 0.00 H ATOM 2202 HG LEU B 132 21.032 14.287 -24.075 1.00 0.00 H ATOM 2203 HD21 LEU B 132 19.828 11.761 -25.266 1.00 0.00 H ATOM 2204 HD22 LEU B 132 21.081 11.841 -24.003 1.00 0.00 H ATOM 2205 HD23 LEU B 132 19.438 12.439 -23.666 1.00 0.00 H ATOM 2206 HD11 LEU B 132 19.694 15.509 -25.725 1.00 0.00 H ATOM 2207 HD12 LEU B 132 18.991 13.981 -26.311 1.00 0.00 H ATOM 2208 HD13 LEU B 132 18.639 14.548 -24.660 1.00 0.00 H ATOM 2209 H LEU B 132 23.394 15.206 -24.834 1.00 0.00 H ATOM 2210 N ASP B 133 24.428 13.691 -27.559 1.00 28.91 N ATOM 2211 CA ASP B 133 25.257 13.360 -28.725 1.00 29.04 C ATOM 2212 C ASP B 133 26.433 12.466 -28.330 1.00 29.45 C ATOM 2213 O ASP B 133 26.753 11.520 -29.027 1.00 28.36 O ATOM 2214 CB ASP B 133 25.746 14.623 -29.450 1.00 29.04 C ATOM 2215 CG ASP B 133 24.615 15.419 -30.091 1.00 29.03 C ATOM 2216 OD1 ASP B 133 23.495 14.892 -30.241 1.00 30.43 O ATOM 2217 OD2 ASP B 133 24.848 16.590 -30.449 1.00 29.65 O ATOM 2218 HA ASP B 133 24.629 12.804 -29.422 1.00 0.00 H ATOM 2219 HB2 ASP B 133 26.255 15.262 -28.729 1.00 0.00 H ATOM 2220 HB3 ASP B 133 26.447 14.326 -30.230 1.00 0.00 H ATOM 2221 H ASP B 133 24.230 14.689 -27.342 1.00 0.00 H HETATM 2222 N MSE B 134 27.063 12.766 -27.198 1.00 30.66 N HETATM 2223 CA MSE B 134 28.143 11.941 -26.658 1.00 34.09 C HETATM 2224 C MSE B 134 27.736 10.489 -26.381 1.00 32.10 C HETATM 2225 O MSE B 134 28.513 9.576 -26.645 1.00 31.15 O HETATM 2226 CB MSE B 134 28.713 12.570 -25.385 1.00 33.25 C HETATM 2227 CG MSE B 134 29.598 13.768 -25.646 1.00 35.97 C HETATM 2228 SE MSE B 134 30.007 14.680 -23.964 1.00 45.86 S HETATM 2229 CE MSE B 134 30.825 13.119 -23.095 1.00 37.99 C HETATM 2230 HE3 MSE B 134 31.150 13.392 -22.091 1.00 0.00 H HETATM 2231 HE2 MSE B 134 31.684 12.788 -23.679 1.00 0.00 H HETATM 2232 HE1 MSE B 134 30.093 12.313 -23.035 1.00 0.00 H HETATM 2233 HG2 MSE B 134 30.526 13.437 -26.112 1.00 0.00 H HETATM 2234 HG1 MSE B 134 29.083 14.458 -26.315 1.00 0.00 H HETATM 2235 HB2 MSE B 134 29.299 11.816 -24.860 1.00 0.00 H HETATM 2236 HB1 MSE B 134 27.882 12.886 -24.754 1.00 0.00 H HETATM 2237 HA MSE B 134 28.906 11.907 -27.436 1.00 0.00 H HETATM 2238 H MSE B 134 26.777 13.619 -26.677 1.00 0.00 H ATOM 2239 N ALA B 135 26.533 10.292 -25.838 1.00 31.74 N ATOM 2240 CA ALA B 135 25.989 8.950 -25.607 1.00 31.92 C ATOM 2241 C ALA B 135 25.890 8.151 -26.904 1.00 31.99 C ATOM 2242 O ALA B 135 26.407 7.040 -26.983 1.00 32.15 O ATOM 2243 CB ALA B 135 24.619 9.026 -24.918 1.00 31.67 C ATOM 2244 HA ALA B 135 26.682 8.428 -24.947 1.00 0.00 H ATOM 2245 HB1 ALA B 135 24.724 9.532 -23.959 1.00 0.00 H ATOM 2246 HB2 ALA B 135 23.926 9.582 -25.550 1.00 0.00 H ATOM 2247 HB3 ALA B 135 24.238 8.017 -24.758 1.00 0.00 H ATOM 2248 H ALA B 135 25.962 11.119 -25.569 1.00 0.00 H ATOM 2249 N ALA B 136 25.246 8.741 -27.916 1.00 32.04 N ATOM 2250 CA ALA B 136 25.048 8.119 -29.223 1.00 32.12 C ATOM 2251 C ALA B 136 26.353 7.838 -29.949 1.00 32.20 C ATOM 2252 O ALA B 136 26.507 6.794 -30.581 1.00 31.71 O ATOM 2253 CB ALA B 136 24.148 8.991 -30.088 1.00 32.29 C ATOM 2254 HA ALA B 136 24.570 7.156 -29.044 1.00 0.00 H ATOM 2255 HB1 ALA B 136 23.181 9.111 -29.599 1.00 0.00 H ATOM 2256 HB2 ALA B 136 24.612 9.968 -30.223 1.00 0.00 H ATOM 2257 HB3 ALA B 136 24.009 8.516 -31.059 1.00 0.00 H ATOM 2258 H ALA B 136 24.864 9.697 -27.764 1.00 0.00 H ATOM 2259 N ALA B 137 27.289 8.779 -29.864 1.00 32.54 N ATOM 2260 CA ALA B 137 28.598 8.616 -30.498 1.00 33.23 C ATOM 2261 C ALA B 137 29.371 7.430 -29.919 1.00 33.80 C ATOM 2262 O ALA B 137 30.102 6.754 -30.637 1.00 33.92 O ATOM 2263 CB ALA B 137 29.406 9.890 -30.377 1.00 33.05 C ATOM 2264 HA ALA B 137 28.426 8.406 -31.554 1.00 0.00 H ATOM 2265 HB1 ALA B 137 28.873 10.705 -30.867 1.00 0.00 H ATOM 2266 HB2 ALA B 137 29.549 10.129 -29.323 1.00 0.00 H ATOM 2267 HB3 ALA B 137 30.376 9.750 -30.854 1.00 0.00 H ATOM 2268 H ALA B 137 27.086 9.651 -29.335 1.00 0.00 H ATOM 2269 N LEU B 138 29.216 7.197 -28.618 1.00 34.61 N ATOM 2270 CA LEU B 138 29.792 6.024 -27.953 1.00 35.85 C ATOM 2271 C LEU B 138 29.213 4.696 -28.456 1.00 36.49 C ATOM 2272 O LEU B 138 29.919 3.689 -28.485 1.00 37.00 O ATOM 2273 CB LEU B 138 29.601 6.119 -26.433 1.00 35.74 C ATOM 2274 CG LEU B 138 30.376 7.193 -25.678 1.00 35.98 C ATOM 2275 CD1 LEU B 138 29.768 7.392 -24.299 1.00 37.25 C ATOM 2276 CD2 LEU B 138 31.877 6.895 -25.593 1.00 36.32 C ATOM 2277 HA LEU B 138 30.853 6.029 -28.201 1.00 0.00 H ATOM 2278 HB2 LEU B 138 28.541 6.295 -26.250 1.00 0.00 H ATOM 2279 HB3 LEU B 138 29.886 5.156 -26.010 1.00 0.00 H ATOM 2280 HG LEU B 138 30.290 8.121 -26.243 1.00 0.00 H ATOM 2281 HD21 LEU B 138 32.029 5.948 -25.075 1.00 0.00 H ATOM 2282 HD22 LEU B 138 32.291 6.831 -26.599 1.00 0.00 H ATOM 2283 HD23 LEU B 138 32.374 7.695 -25.044 1.00 0.00 H ATOM 2284 HD11 LEU B 138 28.728 7.702 -24.403 1.00 0.00 H ATOM 2285 HD12 LEU B 138 29.815 6.455 -23.744 1.00 0.00 H ATOM 2286 HD13 LEU B 138 30.326 8.161 -23.765 1.00 0.00 H ATOM 2287 H LEU B 138 28.665 7.873 -28.051 1.00 0.00 H ATOM 2288 N GLU B 139 27.936 4.703 -28.847 1.00 37.52 N ATOM 2289 CA GLU B 139 27.242 3.499 -29.330 1.00 38.49 C ATOM 2290 C GLU B 139 27.648 3.113 -30.748 1.00 39.08 C ATOM 2291 O GLU B 139 27.257 2.051 -31.247 1.00 39.23 O ATOM 2292 CB GLU B 139 25.710 3.655 -29.258 1.00 38.43 C ATOM 2293 CG GLU B 139 25.134 3.956 -27.865 1.00 39.82 C ATOM 2294 CD GLU B 139 25.335 2.830 -26.849 1.00 40.42 C ATOM 2295 OE1 GLU B 139 25.864 1.760 -27.201 1.00 41.45 O ATOM 2296 OE2 GLU B 139 24.950 3.021 -25.679 1.00 43.20 O ATOM 2297 HA GLU B 139 27.550 2.696 -28.661 1.00 0.00 H ATOM 2298 HB2 GLU B 139 25.425 4.471 -29.922 1.00 0.00 H ATOM 2299 HB3 GLU B 139 25.262 2.727 -29.612 1.00 0.00 H ATOM 2300 HG2 GLU B 139 25.618 4.854 -27.481 1.00 0.00 H ATOM 2301 HG3 GLU B 139 24.064 4.137 -27.969 1.00 0.00 H ATOM 2302 H GLU B 139 27.409 5.599 -28.808 1.00 0.00 H ATOM 2303 N HIS B 140 28.430 3.977 -31.394 1.00 39.77 N ATOM 2304 CA HIS B 140 28.960 3.702 -32.728 1.00 40.21 C ATOM 2305 C HIS B 140 30.481 3.523 -32.691 1.00 40.49 C ATOM 2306 O HIS B 140 31.141 3.892 -31.714 1.00 40.59 O ATOM 2307 CB HIS B 140 28.582 4.828 -33.697 1.00 40.41 C ATOM 2308 CG HIS B 140 27.123 4.870 -34.048 1.00 40.65 C ATOM 2309 ND1 HIS B 140 26.255 5.806 -33.523 1.00 39.93 N ATOM 2310 CD2 HIS B 140 26.385 4.101 -34.884 1.00 40.29 C ATOM 2311 CE1 HIS B 140 25.047 5.609 -34.019 1.00 39.77 C ATOM 2312 NE2 HIS B 140 25.097 4.578 -34.844 1.00 40.69 N ATOM 2313 HA HIS B 140 28.517 2.771 -33.080 1.00 0.00 H ATOM 2314 HB2 HIS B 140 28.852 5.779 -33.239 1.00 0.00 H ATOM 2315 HB3 HIS B 140 29.152 4.695 -34.616 1.00 0.00 H ATOM 2316 HD2 HIS B 140 26.746 3.261 -35.478 1.00 0.00 H ATOM 2317 HE1 HIS B 140 24.159 6.197 -33.787 1.00 0.00 H ATOM 2318 H HIS B 140 28.671 4.878 -30.933 1.00 0.00 H TER 2319 HIS B 140 HETATM 2320 N PRO A 1 12.856 0.958 -1.329 1.00 0.25 N HETATM 2321 CA PRO A 1 12.730 1.337 -2.736 1.00 0.07 C HETATM 2322 C PRO A 1 13.945 2.118 -3.227 1.00 0.23 C HETATM 2323 O PRO A 1 14.400 3.048 -2.556 1.00 -0.39 O HETATM 2324 N PRO A 1 14.457 1.734 -4.393 1.00 -0.26 N HETATM 2325 CA PRO A 1 15.622 2.385 -4.990 1.00 0.15 C HETATM 2326 C PRO A 1 15.239 3.714 -5.621 1.00 0.21 C HETATM 2327 O PRO A 1 14.082 3.919 -6.000 1.00 -0.39 O HETATM 2328 N PRO A 1 16.217 4.612 -5.733 1.00 -0.26 N HETATM 2329 CA PRO A 1 15.987 5.938 -6.297 1.00 0.14 C HETATM 2330 C PRO A 1 15.679 5.884 -7.788 1.00 0.21 C HETATM 2331 O PRO A 1 16.379 5.220 -8.559 1.00 -0.39 O HETATM 2332 N PRO A 1 14.625 6.600 -8.166 1.00 -0.26 N HETATM 2333 CA PRO A 1 14.235 6.778 -9.549 1.00 0.15 C HETATM 2334 C PRO A 1 14.278 8.273 -9.874 1.00 0.21 C HETATM 2335 O PRO A 1 13.779 9.092 -9.085 1.00 -0.39 O HETATM 2336 N PRO A 1 14.869 8.636 -11.032 1.00 -0.25 N HETATM 2337 CA PRO A 1 14.870 10.030 -11.482 1.00 0.13 C HETATM 2338 C PRO A 1 13.478 10.514 -11.924 1.00 0.20 C HETATM 2339 O PRO A 1 13.322 11.677 -12.287 1.00 -0.39 O HETATM 2340 N PRO A 1 12.491 9.616 -11.900 1.00 -0.26 N HETATM 2341 CA PRO A 1 11.085 9.974 -12.144 1.00 0.16 C HETATM 2342 C PRO A 1 10.328 10.360 -10.868 1.00 0.21 C HETATM 2343 O PRO A 1 9.240 10.941 -10.935 1.00 -0.39 O HETATM 2344 N PRO A 1 10.893 10.017 -9.713 1.00 -0.26 N HETATM 2345 CA PRO A 1 10.236 10.243 -8.420 1.00 0.15 C HETATM 2346 C PRO A 1 10.274 11.707 -7.976 1.00 0.21 C HETATM 2347 O PRO A 1 11.329 12.346 -8.046 1.00 -0.39 O HETATM 2348 N PRO A 1 9.117 12.243 -7.533 1.00 -0.25 N HETATM 2349 CA PRO A 1 9.000 13.625 -7.052 1.00 0.13 C HETATM 2350 C PRO A 1 9.934 13.969 -5.887 1.00 0.20 C HETATM 2351 O PRO A 1 10.302 13.092 -5.099 1.00 -0.39 O HETATM 2352 N PRO A 1 10.298 15.246 -5.789 1.00 -0.26 N HETATM 2353 CA PRO A 1 11.173 15.753 -4.726 1.00 0.14 C HETATM 2354 C PRO A 1 10.502 15.804 -3.352 1.00 0.13 C HETATM 2355 O PRO A 1 9.313 15.506 -3.209 1.00 -0.37 O HETATM 2356 H57 PRO A 1 11.085 16.109 -2.484 1.00 0.14 H HETATM 2357 CB PRO A 1 11.711 17.137 -5.100 1.00 0.08 C HETATM 2358 OG PRO A 1 12.535 17.057 -6.255 1.00 -0.39 O HETATM 2359 H60 PRO A 1 13.268 16.478 -6.080 1.00 0.21 H HETATM 2360 H58 PRO A 1 12.302 17.534 -4.261 1.00 0.06 H HETATM 2361 H59 PRO A 1 10.866 17.810 -5.305 1.00 0.06 H HETATM 2362 H56 PRO A 1 12.028 15.065 -4.649 1.00 0.08 H HETATM 2363 H55 PRO A 1 9.958 15.891 -6.473 1.00 0.19 H HETATM 2364 CB PRO A 1 7.536 13.717 -6.603 1.00 -0.01 C HETATM 2365 CG PRO A 1 6.834 12.681 -7.408 1.00 -0.03 C HETATM 2366 CD PRO A 1 7.812 11.551 -7.499 1.00 0.04 C HETATM 2367 H53 PRO A 1 7.737 10.892 -6.622 1.00 0.05 H HETATM 2368 H54 PRO A 1 7.652 10.963 -8.415 1.00 0.05 H HETATM 2369 H51 PRO A 1 6.590 13.066 -8.409 1.00 0.03 H HETATM 2370 H52 PRO A 1 5.911 12.357 -6.905 1.00 0.03 H HETATM 2371 H49 PRO A 1 7.127 14.716 -6.813 1.00 0.03 H HETATM 2372 H50 PRO A 1 7.445 13.502 -5.528 1.00 0.03 H HETATM 2373 H48 PRO A 1 9.198 14.325 -7.877 1.00 0.08 H HETATM 2374 CB PRO A 1 10.832 9.335 -7.337 1.00 0.08 C HETATM 2375 OG PRO A 1 10.095 8.126 -7.230 1.00 -0.39 O HETATM 2376 H47 PRO A 1 10.481 7.580 -6.555 1.00 0.21 H HETATM 2377 H45 PRO A 1 10.805 9.860 -6.371 1.00 0.06 H HETATM 2378 H46 PRO A 1 11.874 9.100 -7.597 1.00 0.06 H HETATM 2379 H44 PRO A 1 9.178 9.967 -8.541 1.00 0.08 H HETATM 2380 H43 PRO A 1 11.797 9.590 -9.726 1.00 0.19 H HETATM 2381 CB PRO A 1 10.310 8.821 -12.816 1.00 0.09 C HETATM 2382 OG1 PRO A 1 10.403 7.645 -12.003 1.00 -0.39 O HETATM 2383 H39 PRO A 1 11.316 7.400 -11.906 1.00 0.21 H HETATM 2384 CG2 PRO A 1 10.862 8.527 -14.201 1.00 -0.03 C HETATM 2385 H40 PRO A 1 10.292 7.703 -14.655 1.00 0.03 H HETATM 2386 H41 PRO A 1 11.921 8.240 -14.120 1.00 0.03 H HETATM 2387 H42 PRO A 1 10.772 9.425 -14.830 1.00 0.03 H HETATM 2388 H38 PRO A 1 9.253 9.111 -12.910 1.00 0.06 H HETATM 2389 H37 PRO A 1 11.079 10.840 -12.822 1.00 0.08 H HETATM 2390 H36 PRO A 1 12.716 8.661 -11.708 1.00 0.19 H HETATM 2391 CB PRO A 1 15.844 10.012 -12.669 1.00 -0.01 C HETATM 2392 CG PRO A 1 15.745 8.630 -13.206 1.00 -0.03 C HETATM 2393 CD PRO A 1 15.582 7.759 -11.986 1.00 0.04 C HETATM 2394 H34 PRO A 1 14.987 6.864 -12.218 1.00 0.05 H HETATM 2395 H35 PRO A 1 16.561 7.455 -11.586 1.00 0.05 H HETATM 2396 H32 PRO A 1 16.659 8.361 -13.756 1.00 0.03 H HETATM 2397 H33 PRO A 1 14.874 8.533 -13.871 1.00 0.03 H HETATM 2398 H30 PRO A 1 16.870 10.227 -12.335 1.00 0.03 H HETATM 2399 H31 PRO A 1 15.544 10.748 -13.430 1.00 0.03 H HETATM 2400 H29 PRO A 1 15.240 10.690 -10.684 1.00 0.08 H HETATM 2401 CB PRO A 1 12.821 6.233 -9.769 1.00 0.08 C HETATM 2402 OG PRO A 1 12.401 6.406 -11.112 1.00 -0.39 O HETATM 2403 H28 PRO A 1 11.523 6.059 -11.215 1.00 0.21 H HETATM 2404 H26 PRO A 1 12.125 6.767 -9.105 1.00 0.06 H HETATM 2405 H27 PRO A 1 12.809 5.160 -9.526 1.00 0.06 H HETATM 2406 H25 PRO A 1 14.937 6.239 -10.202 1.00 0.08 H HETATM 2407 H24 PRO A 1 14.072 7.039 -7.458 1.00 0.19 H HETATM 2408 CB PRO A 1 17.184 6.861 -6.049 1.00 0.02 C HETATM 2409 CG PRO A 1 17.012 8.259 -6.605 1.00 -0.05 C HETATM 2410 CD1 PRO A 1 16.367 9.248 -5.866 1.00 -0.07 C HETATM 2411 CE1 PRO A 1 16.223 10.534 -6.362 1.00 -0.04 C HETATM 2412 CZ PRO A 1 16.726 10.847 -7.620 1.00 0.08 C HETATM 2413 CE2 PRO A 1 17.363 9.888 -8.379 1.00 -0.04 C HETATM 2414 CD2 PRO A 1 17.510 8.598 -7.866 1.00 -0.07 C HETATM 2415 H20 PRO A 1 18.020 7.845 -8.457 1.00 0.05 H HETATM 2416 H22 PRO A 1 17.745 10.133 -9.363 1.00 0.05 H HETATM 2417 OH PRO A 1 16.582 12.114 -8.126 1.00 -0.34 O HETATM 2418 H23 PRO A 1 16.080 12.077 -8.932 1.00 0.25 H HETATM 2419 H21 PRO A 1 15.721 11.292 -5.772 1.00 0.05 H HETATM 2420 H19 PRO A 1 15.971 9.008 -4.886 1.00 0.05 H HETATM 2421 H17 PRO A 1 18.071 6.410 -6.517 1.00 0.05 H HETATM 2422 H18 PRO A 1 17.342 6.938 -4.963 1.00 0.05 H HETATM 2423 H16 PRO A 1 15.113 6.369 -5.787 1.00 0.08 H HETATM 2424 H15 PRO A 1 17.136 4.370 -5.421 1.00 0.19 H HETATM 2425 CB PRO A 1 16.266 1.473 -6.034 1.00 0.08 C HETATM 2426 OG PRO A 1 16.540 0.193 -5.484 1.00 -0.39 O HETATM 2427 H14 PRO A 1 17.135 0.286 -4.749 1.00 0.21 H HETATM 2428 H12 PRO A 1 17.207 1.927 -6.378 1.00 0.06 H HETATM 2429 H13 PRO A 1 15.580 1.360 -6.887 1.00 0.06 H HETATM 2430 H11 PRO A 1 16.357 2.578 -4.194 1.00 0.08 H HETATM 2431 H10 PRO A 1 14.029 0.972 -4.879 1.00 0.19 H HETATM 2432 CB PRO A 1 11.479 2.230 -2.754 1.00 0.01 C HETATM 2433 CG PRO A 1 11.292 2.674 -1.339 1.00 -0.01 C HETATM 2434 CD PRO A 1 11.771 1.522 -0.508 1.00 -0.03 C HETATM 2435 H8 PRO A 1 12.149 1.866 0.466 1.00 0.08 H HETATM 2436 H9 PRO A 1 10.969 0.786 -0.351 1.00 0.08 H HETATM 2437 H6 PRO A 1 10.231 2.883 -1.136 1.00 0.03 H HETATM 2438 H7 PRO A 1 11.889 3.574 -1.133 1.00 0.03 H HETATM 2439 H4 PRO A 1 10.603 1.660 -3.098 1.00 0.03 H HETATM 2440 H5 PRO A 1 11.634 3.097 -3.413 1.00 0.03 H HETATM 2441 H3 PRO A 1 12.589 0.447 -3.367 1.00 0.11 H HETATM 2442 H1 PRO A 1 13.739 1.296 -0.979 1.00 0.20 H HETATM 2443 H2 PRO A 1 12.829 -0.047 -1.259 1.00 0.20 H HETATM 2444 O HOH 1 13.805 9.723 -19.900 1.00 24.56 O HETATM 2445 O HOH 2 30.452 22.700 -12.584 1.00 18.63 O HETATM 2446 O HOH 3 28.961 19.068 -13.328 1.00 20.14 O HETATM 2447 O HOH 4 12.120 20.399 -9.079 1.00 23.55 O HETATM 2448 O HOH 5 18.026 6.363 -15.024 1.00 19.68 O HETATM 2449 O HOH 6 17.695 25.684 -12.127 1.00 26.11 O HETATM 2450 O HOH 7 24.228 26.496 4.348 1.00 22.89 O HETATM 2451 O HOH 8 10.287 26.165 0.025 1.00 30.00 O HETATM 2452 O HOH 9 33.331 14.704 -12.685 1.00 24.91 O HETATM 2453 O HOH 10 13.214 14.576 -23.689 1.00 29.25 O HETATM 2454 O HOH 11 31.924 24.218 -7.659 1.00 25.74 O HETATM 2455 O HOH 12 16.806 4.053 -15.728 1.00 30.76 O HETATM 2456 O HOH 13 27.400 3.437 -13.097 1.00 35.16 O HETATM 2457 O HOH 14 18.185 28.441 -11.633 1.00 28.93 O HETATM 2458 O HOH 15 24.842 19.571 5.528 1.00 25.01 O HETATM 2459 O HOH 16 32.182 24.147 -10.952 1.00 25.54 O HETATM 2460 O HOH 17 24.771 29.077 -9.206 1.00 25.77 O HETATM 2461 O HOH 18 12.140 8.062 -18.105 1.00 29.45 O HETATM 2462 O HOH 19 33.354 17.226 -13.527 1.00 23.67 O HETATM 2463 O HOH 20 13.057 15.315 -14.291 1.00 32.74 O HETATM 2464 O HOH 21 23.901 30.220 -0.942 1.00 40.78 O HETATM 2465 O HOH 22 29.491 28.386 -2.150 1.00 34.49 O HETATM 2466 O HOH 23 13.085 20.312 -11.560 1.00 29.26 O HETATM 2467 O HOH 24 10.291 22.600 -9.568 1.00 41.10 O HETATM 2468 O HOH 25 26.971 21.642 -22.896 1.00 29.07 O HETATM 2469 O HOH 26 21.576 3.706 -7.804 1.00 28.78 O HETATM 2470 O HOH 27 23.588 22.635 -28.142 1.00 27.57 O HETATM 2471 O HOH 28 19.579 32.646 -6.916 1.00 36.38 O HETATM 2472 O HOH 29 20.925 25.829 -15.422 1.00 32.39 O HETATM 2473 O HOH 30 21.014 -2.677 -15.601 1.00 40.29 O HETATM 2474 O HOH 31 16.019 12.228 -3.010 1.00 35.26 O HETATM 2475 O HOH 32 35.538 22.010 -17.160 1.00 42.80 O HETATM 2476 O HOH 33 22.474 2.355 -9.880 1.00 30.94 O HETATM 2477 O HOH 34 33.738 20.852 -18.640 1.00 31.26 O HETATM 2478 O HOH 35 9.631 28.728 -10.008 1.00 38.49 O HETATM 2479 O HOH 36 27.615 24.753 -19.472 1.00 34.71 O HETATM 2480 O HOH 37 11.554 16.725 -24.578 1.00 41.17 O HETATM 2481 O HOH 38 36.003 24.004 -11.107 1.00 46.26 O HETATM 2482 O HOH 39 21.385 24.751 -17.834 1.00 36.31 O HETATM 2483 O HOH 40 26.634 29.217 -13.531 1.00 38.98 O HETATM 2484 O HOH 41 17.610 19.922 3.721 1.00 25.60 O HETATM 2485 O HOH 42 26.405 23.438 -25.348 1.00 38.57 O HETATM 2486 O HOH 43 30.152 8.524 5.766 1.00 37.55 O HETATM 2487 O HOH 44 18.546 2.972 -11.835 1.00 29.83 O HETATM 2488 O HOH 45 36.020 17.741 -2.557 1.00 36.52 O HETATM 2489 O HOH 46 18.394 24.984 -14.754 1.00 31.85 O HETATM 2490 O HOH 47 30.411 22.261 -19.407 1.00 26.14 O HETATM 2491 O HOH 48 28.617 23.007 -21.415 1.00 33.09 O HETATM 2492 O HOH 49 25.991 26.909 -18.845 1.00 31.84 O HETATM 2493 O HOH 50 25.280 1.456 -11.191 1.00 33.94 O HETATM 2494 O HOH 51 17.422 3.416 -18.419 1.00 32.02 O HETATM 2495 O HOH 52 15.467 21.985 -21.479 1.00 34.44 O HETATM 2496 O HOH 53 31.396 10.005 8.104 1.00 38.28 O HETATM 2497 O HOH 54 18.953 22.566 -27.976 1.00 47.17 O HETATM 2498 O HOH 55 34.282 13.705 -3.490 1.00 23.98 O HETATM 2499 O HOH 56 16.096 9.529 4.417 1.00 37.52 O HETATM 2500 O HOH 57 34.109 20.712 -1.275 1.00 48.38 O HETATM 2501 O HOH 58 14.980 15.582 -5.567 1.00 28.85 O HETATM 2502 O HOH 59 20.892 14.241 5.783 1.00 27.75 O HETATM 2503 O HOH 60 33.321 22.221 -9.300 1.00 28.66 O HETATM 2504 O HOH 61 22.950 3.919 -36.620 1.00 47.46 O HETATM 2505 O HOH 62 34.078 3.990 -5.600 1.00 39.68 O HETATM 2506 O HOH 63 14.867 24.641 -22.833 1.00 46.20 O HETATM 2507 O HOH 64 23.547 2.016 -38.448 1.00 52.09 O HETATM 2508 O HOH 65 22.173 -5.277 -17.280 1.00 45.72 O HETATM 2509 O HOH 66 11.499 31.358 -4.753 1.00 26.79 O HETATM 2510 O HOH 67 14.878 13.558 -13.422 1.00 24.19 O HETATM 2511 O HOH 68 14.247 3.706 0.301 1.00 35.00 O HETATM 2512 O HOH 69 12.141 17.738 -12.907 1.00 37.81 O HETATM 2513 O HOH 70 17.749 0.363 -2.825 1.00 41.31 O CONECT 1 2 17 18 19 CONECT 2 1 3 5 16 CONECT 3 2 4 20 CONECT 4 3 CONECT 5 2 6 14 15 CONECT 6 5 7 12 13 CONECT 7 6 8 CONECT 8 7 9 10 11 CONECT 9 8 CONECT 10 8 CONECT 11 8 CONECT 12 6 CONECT 13 6 CONECT 14 5 CONECT 15 5 CONECT 16 2 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 227 210 228 243 CONECT 228 227 229 231 242 CONECT 229 228 230 244 CONECT 230 229 CONECT 231 228 232 240 241 CONECT 232 231 233 238 239 CONECT 233 232 234 CONECT 234 233 235 236 237 CONECT 235 234 CONECT 236 234 CONECT 237 234 CONECT 238 232 CONECT 239 232 CONECT 240 231 CONECT 241 231 CONECT 242 228 CONECT 243 227 CONECT 256 246 257 272 CONECT 257 256 258 260 271 CONECT 258 257 259 273 CONECT 259 258 CONECT 260 257 261 269 270 CONECT 261 260 262 267 268 CONECT 262 261 263 CONECT 263 262 264 265 266 CONECT 264 263 CONECT 265 263 CONECT 266 263 CONECT 267 261 CONECT 268 261 CONECT 269 260 CONECT 270 260 CONECT 271 257 CONECT 272 256 CONECT 407 387 408 423 CONECT 408 407 409 411 422 CONECT 409 408 410 424 CONECT 410 409 CONECT 411 408 412 420 421 CONECT 412 411 413 418 419 CONECT 413 412 414 CONECT 414 413 415 416 417 CONECT 415 414 CONECT 416 414 CONECT 417 414 CONECT 418 412 CONECT 419 412 CONECT 420 411 CONECT 421 411 CONECT 422 408 CONECT 423 407 CONECT 2222 2212 2223 2238 CONECT 2223 2222 2224 2226 2237 CONECT 2224 2223 2225 2239 CONECT 2225 2224 CONECT 2226 2223 2227 2235 2236 CONECT 2227 2226 2228 2233 2234 CONECT 2228 2227 2229 CONECT 2229 2228 2230 2231 2232 CONECT 2230 2229 CONECT 2231 2229 CONECT 2232 2229 CONECT 2233 2227 CONECT 2234 2227 CONECT 2235 2226 CONECT 2236 2226 CONECT 2237 2223 CONECT 2238 2222 CONECT 2320 2321 2434 2442 2443 CONECT 2321 2320 2322 2432 2441 CONECT 2322 2321 2323 2324 CONECT 2323 2322 CONECT 2324 2322 2325 2431 CONECT 2325 2324 2326 2425 2430 CONECT 2326 2325 2327 2328 CONECT 2327 2326 CONECT 2328 2326 2329 2424 CONECT 2329 2328 2330 2408 2423 CONECT 2330 2329 2331 2332 CONECT 2331 2330 CONECT 2332 2330 2333 2407 CONECT 2333 2332 2334 2401 2406 CONECT 2334 2333 2335 2336 CONECT 2335 2334 CONECT 2336 2334 2337 2393 CONECT 2337 2336 2338 2391 2400 CONECT 2338 2337 2339 2340 CONECT 2339 2338 CONECT 2340 2338 2341 2390 CONECT 2341 2340 2342 2381 2389 CONECT 2342 2341 2343 2344 CONECT 2343 2342 CONECT 2344 2342 2345 2380 CONECT 2345 2344 2346 2374 2379 CONECT 2346 2345 2347 2348 CONECT 2347 2346 CONECT 2348 2346 2349 2366 CONECT 2349 2348 2350 2364 2373 CONECT 2350 2349 2351 2352 CONECT 2351 2350 CONECT 2352 2350 2353 2363 CONECT 2353 2352 2354 2357 2362 CONECT 2354 2353 2355 2356 CONECT 2355 2354 CONECT 2356 2354 CONECT 2357 2353 2358 2360 2361 CONECT 2358 2357 2359 CONECT 2359 2358 CONECT 2360 2357 CONECT 2361 2357 CONECT 2362 2353 CONECT 2363 2352 CONECT 2364 2349 2365 2371 2372 CONECT 2365 2364 2366 2369 2370 CONECT 2366 2348 2365 2367 2368 CONECT 2367 2366 CONECT 2368 2366 CONECT 2369 2365 CONECT 2370 2365 CONECT 2371 2364 CONECT 2372 2364 CONECT 2373 2349 CONECT 2374 2345 2375 2377 2378 CONECT 2375 2374 2376 CONECT 2376 2375 CONECT 2377 2374 CONECT 2378 2374 CONECT 2379 2345 CONECT 2380 2344 CONECT 2381 2341 2382 2384 2388 CONECT 2382 2381 2383 CONECT 2383 2382 CONECT 2384 2381 2385 2386 2387 CONECT 2385 2384 CONECT 2386 2384 CONECT 2387 2384 CONECT 2388 2381 CONECT 2389 2341 CONECT 2390 2340 CONECT 2391 2337 2392 2398 2399 CONECT 2392 2391 2393 2396 2397 CONECT 2393 2336 2392 2394 2395 CONECT 2394 2393 CONECT 2395 2393 CONECT 2396 2392 CONECT 2397 2392 CONECT 2398 2391 CONECT 2399 2391 CONECT 2400 2337 CONECT 2401 2333 2402 2404 2405 CONECT 2402 2401 2403 CONECT 2403 2402 CONECT 2404 2401 CONECT 2405 2401 CONECT 2406 2333 CONECT 2407 2332 CONECT 2408 2329 2409 2421 2422 CONECT 2409 2408 2410 2414 CONECT 2410 2409 2411 2420 CONECT 2411 2410 2412 2419 CONECT 2412 2411 2413 2417 CONECT 2413 2412 2414 2416 CONECT 2414 2409 2413 2415 CONECT 2415 2414 CONECT 2416 2413 CONECT 2417 2412 2418 CONECT 2418 2417 CONECT 2419 2411 CONECT 2420 2410 CONECT 2421 2408 CONECT 2422 2408 CONECT 2423 2329 CONECT 2424 2328 CONECT 2425 2325 2426 2428 2429 CONECT 2426 2425 2427 CONECT 2427 2426 CONECT 2428 2425 CONECT 2429 2425 CONECT 2430 2325 CONECT 2431 2324 CONECT 2432 2321 2433 2439 2440 CONECT 2433 2432 2434 2437 2438 CONECT 2434 2320 2433 2435 2436 CONECT 2435 2434 CONECT 2436 2434 CONECT 2437 2433 CONECT 2438 2433 CONECT 2439 2432 CONECT 2440 2432 CONECT 2441 2321 CONECT 2442 2320 CONECT 2443 2320 MASTER 0 0 0 0 0 0 0 0 2512 1 211 11 END
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Entry Information
PDB ID
3d9o
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
CTD INTERACTING DOMAIN of RNA processing factor SCAF8(N15M/Y17M)
Ligand Name
14-mer
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=1mM
Release Year
2008
Protein/NA Sequence
Check fasta file
Primary Reference
(2008) J.Biol.Chem. Vol. 283: pp. 22659-22669
Ligand Properties
Formula
C
4
0
H
6
0
N
9
O
1
5
Molecular Weight
906.956
Exact Mass
906.421
No. of atoms
124
No. of bonds
127
Polar Surface Area
370.28
LOGP Value
-5.15 (
Computed with XLOGP3
)
-4.11 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 13
No. of Hydrogen Bond Acceptors: 15
No. of Rotatable Bonds: 36
No. of Nitrogen and Oxygen Atoms: 24
No. of Rings: 4
Canonical SMILES
OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C=O)CO)CO)[C@H](O)C)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CO
InChI String
InChI=1S/C40H59N9O15/c1-21(55)32(38(62)46-29(20-54)40(64)48-13-3-6-30(48)36(60)42-23(16-50)17-51)47-37(61)31-7-4-14-49(31)39(63)28(19-53)45-34(58)26(15-22-8-10-24(56)11-9-22)43-35(59)27(18-52)44-33(57)25-5-2-12-41-25/h8-11,16,21,23,25-32,41,51-56H,2-7,12-15,17-20H2,1H3,(H,42,60)(H,43,59)(H,44,57)(H,45,58)(H,46,62)(H,47,61)/p+1/t21-,23-,25+,26+,27+,28+,29+,30+,31+,32+/m1/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):
Q9UPN6
P24928
Entrez Gene ID
NCBI Entrez Gene ID:
22828
5430
ASD
Information of known allosteric effects of PDB entries
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