Browse entries in the PDBbind-CN Database
HEADER 6FGF_COMPLEX COMPND 6FGF_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 103 HIS SER ASP LEU THR PHE CYS GLU ILE ILE LEU MET GLU SEQRES 2 A 103 MET GLU SER HIS ASP ALA ALA TRP PRO PHE LEU GLU PRO SEQRES 3 A 103 VAL ASN PRO ARG LEU VAL SER GLY TYR ARG ARG ILE ILE SEQRES 4 A 103 LYS ASN PRO MET ASP PHE SER THR MET ARG GLU ARG LEU SEQRES 5 A 103 LEU ARG GLY GLY TYR THR SER SER GLU GLU PHE ALA ALA SEQRES 6 A 103 ASP ALA LEU LEU VAL PHE ASP ASN CYS GLN THR PHE ASN SEQRES 7 A 103 GLU ASP ASP SER GLU VAL GLY LYS ALA GLY HIS ILE MET SEQRES 8 A 103 ARG ARG PHE PHE GLU SER ARG TRP GLU GLU PHE TYR HET EN A 2 46 ATOM 1 N HIS A1796 -28.251 9.330 -10.641 1.00 77.94 N ATOM 2 CA HIS A1796 -29.533 9.858 -10.185 1.00 82.72 C ATOM 3 C HIS A1796 -29.351 11.103 -9.326 1.00 80.15 C ATOM 4 O HIS A1796 -29.834 12.177 -9.677 1.00 78.95 O ATOM 5 CB HIS A1796 -30.311 8.798 -9.396 1.00 83.90 C ATOM 6 CG HIS A1796 -31.708 9.213 -9.039 1.00 88.27 C ATOM 7 ND1 HIS A1796 -32.671 9.479 -9.990 1.00 87.43 N ATOM 8 CD2 HIS A1796 -32.304 9.405 -7.837 1.00 83.62 C ATOM 9 CE1 HIS A1796 -33.799 9.819 -9.390 1.00 81.32 C ATOM 10 NE2 HIS A1796 -33.603 9.782 -8.084 1.00 79.01 N ATOM 11 HN3 HIS A1796 -27.668 9.080 -9.817 1.00 0.00 H ATOM 12 HN2 HIS A1796 -27.762 10.052 -11.207 1.00 0.00 H ATOM 13 HN1 HIS A1796 -28.413 8.483 -11.223 1.00 0.00 H ATOM 14 N SER A1797 -28.641 10.952 -8.203 1.00 81.18 N ATOM 15 CA SER A1797 -28.548 12.025 -7.215 1.00 77.66 C ATOM 16 C SER A1797 -27.906 13.291 -7.770 1.00 79.88 C ATOM 17 O SER A1797 -28.029 14.355 -7.153 1.00 76.04 O ATOM 18 CB SER A1797 -27.768 11.541 -5.992 1.00 69.48 C ATOM 19 OG SER A1797 -28.461 10.503 -5.317 1.00 74.81 O ATOM 20 HG SER A1797 -27.933 10.211 -4.532 1.00 0.00 H ATOM 21 H SER A1797 -28.146 10.054 -8.029 1.00 0.00 H ATOM 22 N ASP A1798 -27.230 13.208 -8.917 1.00 83.58 N ATOM 23 CA ASP A1798 -26.637 14.404 -9.508 1.00 81.21 C ATOM 24 C ASP A1798 -27.707 15.321 -10.083 1.00 78.17 C ATOM 25 O ASP A1798 -27.610 16.549 -9.967 1.00 76.24 O ATOM 26 CB ASP A1798 -25.625 14.016 -10.589 1.00 77.79 C ATOM 27 CG ASP A1798 -24.204 14.417 -10.228 1.00 80.43 C ATOM 28 OD1 ASP A1798 -23.956 14.719 -9.040 1.00 78.17 O ATOM 29 OD2 ASP A1798 -23.340 14.443 -11.130 1.00 74.17 O ATOM 30 H ASP A1798 -27.125 12.289 -9.392 1.00 0.00 H ATOM 31 N LEU A1799 -28.742 14.744 -10.691 1.00 71.34 N ATOM 32 CA LEU A1799 -29.793 15.518 -11.335 1.00 65.90 C ATOM 33 C LEU A1799 -30.989 15.785 -10.424 1.00 60.62 C ATOM 34 O LEU A1799 -31.822 16.636 -10.755 1.00 57.11 O ATOM 35 CB LEU A1799 -30.246 14.802 -12.611 1.00 63.65 C ATOM 36 CG LEU A1799 -29.161 14.714 -13.692 1.00 60.26 C ATOM 37 CD1 LEU A1799 -29.634 13.866 -14.863 1.00 62.69 C ATOM 38 CD2 LEU A1799 -28.744 16.100 -14.167 1.00 52.12 C ATOM 39 H LEU A1799 -28.801 13.706 -10.706 1.00 0.00 H ATOM 40 N THR A1800 -31.091 15.092 -9.287 1.00 61.28 N ATOM 41 CA THR A1800 -32.145 15.400 -8.323 1.00 61.66 C ATOM 42 C THR A1800 -31.967 16.798 -7.750 1.00 55.92 C ATOM 43 O THR A1800 -32.939 17.551 -7.623 1.00 52.98 O ATOM 44 CB THR A1800 -32.161 14.366 -7.194 1.00 66.26 C ATOM 45 OG1 THR A1800 -30.923 14.416 -6.473 1.00 70.41 O ATOM 46 CG2 THR A1800 -32.358 12.973 -7.750 1.00 68.86 C ATOM 47 HG1 THR A1800 -30.175 14.217 -7.090 1.00 0.00 H ATOM 48 H THR A1800 -30.415 14.327 -9.086 1.00 0.00 H ATOM 49 N PHE A1801 -30.734 17.163 -7.393 1.00 57.93 N ATOM 50 CA PHE A1801 -30.484 18.517 -6.919 1.00 56.23 C ATOM 51 C PHE A1801 -30.563 19.533 -8.047 1.00 51.07 C ATOM 52 O PHE A1801 -30.737 20.724 -7.778 1.00 48.21 O ATOM 53 CB PHE A1801 -29.126 18.601 -6.223 1.00 59.83 C ATOM 54 CG PHE A1801 -29.076 19.630 -5.122 1.00 65.74 C ATOM 55 CD1 PHE A1801 -28.532 20.888 -5.344 1.00 64.78 C ATOM 56 CD2 PHE A1801 -29.584 19.341 -3.864 1.00 68.57 C ATOM 57 CE1 PHE A1801 -28.493 21.835 -4.327 1.00 61.51 C ATOM 58 CE2 PHE A1801 -29.547 20.283 -2.845 1.00 59.57 C ATOM 59 CZ PHE A1801 -29.002 21.530 -3.078 1.00 56.90 C ATOM 60 H PHE A1801 -29.952 16.480 -7.453 1.00 0.00 H ATOM 61 N CYS A1802 -30.425 19.096 -9.299 1.00 50.75 N ATOM 62 CA CYS A1802 -30.756 19.974 -10.414 1.00 47.62 C ATOM 63 C CYS A1802 -32.257 20.229 -10.467 1.00 43.67 C ATOM 64 O CYS A1802 -32.695 21.342 -10.783 1.00 40.86 O ATOM 65 CB CYS A1802 -30.255 19.374 -11.728 1.00 48.40 C ATOM 66 SG CYS A1802 -28.452 19.301 -11.868 1.00 47.18 S ATOM 67 H CYS A1802 -30.082 18.131 -9.479 1.00 0.00 H ATOM 68 N GLU A1803 -33.060 19.210 -10.149 1.00 45.06 N ATOM 69 CA GLU A1803 -34.499 19.418 -10.030 1.00 38.54 C ATOM 70 C GLU A1803 -34.824 20.360 -8.877 1.00 38.33 C ATOM 71 O GLU A1803 -35.702 21.221 -9.000 1.00 38.58 O ATOM 72 CB GLU A1803 -35.209 18.078 -9.847 1.00 36.46 C ATOM 73 CG GLU A1803 -36.702 18.198 -9.589 1.00 37.60 C ATOM 74 CD GLU A1803 -37.454 18.800 -10.762 1.00 38.45 C ATOM 75 OE1 GLU A1803 -37.259 18.325 -11.904 1.00 38.37 O ATOM 76 OE2 GLU A1803 -38.235 19.752 -10.542 1.00 32.08 O ATOM 77 H GLU A1803 -32.658 18.265 -9.986 1.00 0.00 H ATOM 78 N ILE A1804 -34.123 20.218 -7.751 1.00 41.31 N ATOM 79 CA ILE A1804 -34.373 21.097 -6.611 1.00 39.91 C ATOM 80 C ILE A1804 -33.983 22.531 -6.949 1.00 37.69 C ATOM 81 O ILE A1804 -34.744 23.476 -6.701 1.00 39.76 O ATOM 82 CB ILE A1804 -33.628 20.585 -5.365 1.00 42.54 C ATOM 83 CG1 ILE A1804 -34.086 19.168 -5.011 1.00 40.70 C ATOM 84 CG2 ILE A1804 -33.856 21.521 -4.191 1.00 43.19 C ATOM 85 CD1 ILE A1804 -33.513 18.641 -3.710 1.00 44.62 C ATOM 86 H ILE A1804 -33.395 19.478 -7.684 1.00 0.00 H ATOM 87 N ILE A1805 -32.796 22.713 -7.529 1.00 36.66 N ATOM 88 CA ILE A1805 -32.321 24.052 -7.871 1.00 37.60 C ATOM 89 C ILE A1805 -33.252 24.703 -8.885 1.00 35.50 C ATOM 90 O ILE A1805 -33.658 25.861 -8.729 1.00 31.38 O ATOM 91 CB ILE A1805 -30.874 23.990 -8.392 1.00 39.60 C ATOM 92 CG1 ILE A1805 -29.900 23.789 -7.232 1.00 44.75 C ATOM 93 CG2 ILE A1805 -30.530 25.243 -9.183 1.00 37.79 C ATOM 94 CD1 ILE A1805 -28.471 23.599 -7.675 1.00 47.49 C ATOM 95 H ILE A1805 -32.199 21.889 -7.741 1.00 0.00 H ATOM 96 N LEU A1806 -33.608 23.966 -9.940 1.00 35.24 N ATOM 97 CA LEU A1806 -34.486 24.531 -10.957 1.00 29.94 C ATOM 98 C LEU A1806 -35.869 24.829 -10.398 1.00 32.01 C ATOM 99 O LEU A1806 -36.501 25.804 -10.810 1.00 29.78 O ATOM 100 CB LEU A1806 -34.590 23.591 -12.157 1.00 30.91 C ATOM 101 CG LEU A1806 -35.415 24.123 -13.331 1.00 31.65 C ATOM 102 CD1 LEU A1806 -34.880 25.468 -13.797 1.00 29.78 C ATOM 103 CD2 LEU A1806 -35.423 23.128 -14.474 1.00 32.20 C ATOM 104 H LEU A1806 -33.260 22.991 -10.036 1.00 0.00 H ATOM 105 N MET A1807 -36.357 24.005 -9.471 1.00 34.18 N ATOM 106 CA MET A1807 -37.649 24.276 -8.850 1.00 33.54 C ATOM 107 C MET A1807 -37.602 25.571 -8.048 1.00 31.59 C ATOM 108 O MET A1807 -38.464 26.450 -8.202 1.00 30.61 O ATOM 109 CB MET A1807 -38.049 23.090 -7.969 1.00 36.33 C ATOM 110 CG MET A1807 -38.961 23.425 -6.800 1.00 42.61 C ATOM 111 SD MET A1807 -39.447 21.943 -5.884 1.00 56.18 S ATOM 112 CE MET A1807 -37.852 21.270 -5.430 1.00 35.93 C ATOM 113 H MET A1807 -35.814 23.164 -9.189 1.00 0.00 H ATOM 114 N GLU A1808 -36.578 25.719 -7.205 1.00 30.18 N ATOM 115 CA GLU A1808 -36.476 26.919 -6.386 1.00 30.47 C ATOM 116 C GLU A1808 -36.252 28.162 -7.238 1.00 29.89 C ATOM 117 O GLU A1808 -36.750 29.242 -6.898 1.00 26.93 O ATOM 118 CB GLU A1808 -35.362 26.749 -5.352 1.00 32.84 C ATOM 119 CG GLU A1808 -35.635 25.630 -4.350 1.00 33.93 C ATOM 120 CD GLU A1808 -34.590 25.543 -3.255 1.00 43.61 C ATOM 121 OE1 GLU A1808 -33.481 26.086 -3.445 1.00 47.59 O ATOM 122 OE2 GLU A1808 -34.876 24.934 -2.202 1.00 45.42 O ATOM 123 H GLU A1808 -35.853 24.977 -7.133 1.00 0.00 H ATOM 124 N MET A1809 -35.528 28.030 -8.353 1.00 30.30 N ATOM 125 CA MET A1809 -35.356 29.163 -9.257 1.00 24.83 C ATOM 126 C MET A1809 -36.656 29.498 -9.973 1.00 26.08 C ATOM 127 O MET A1809 -36.990 30.674 -10.146 1.00 24.54 O ATOM 128 CB MET A1809 -34.250 28.874 -10.271 1.00 21.99 C ATOM 129 CG MET A1809 -32.851 28.909 -9.700 1.00 23.71 C ATOM 130 SD MET A1809 -31.599 29.195 -10.968 1.00 25.95 S ATOM 131 CE MET A1809 -31.763 27.732 -11.988 1.00 26.22 C ATOM 132 H MET A1809 -35.085 27.116 -8.578 1.00 0.00 H ATOM 133 N GLU A1810 -37.400 28.475 -10.401 1.00 26.07 N ATOM 134 CA GLU A1810 -38.665 28.705 -11.089 1.00 24.46 C ATOM 135 C GLU A1810 -39.660 29.422 -10.189 1.00 25.41 C ATOM 136 O GLU A1810 -40.423 30.277 -10.655 1.00 21.06 O ATOM 137 CB GLU A1810 -39.249 27.379 -11.577 1.00 25.18 C ATOM 138 CG GLU A1810 -38.628 26.848 -12.858 1.00 29.20 C ATOM 139 CD GLU A1810 -39.164 25.478 -13.236 1.00 35.35 C ATOM 140 OE1 GLU A1810 -39.714 24.791 -12.347 1.00 37.04 O ATOM 141 OE2 GLU A1810 -39.041 25.089 -14.419 1.00 34.69 O ATOM 142 H GLU A1810 -37.073 27.501 -10.241 1.00 0.00 H ATOM 143 N SER A1811 -39.666 29.095 -8.896 1.00 27.31 N ATOM 144 CA SER A1811 -40.594 29.727 -7.964 1.00 24.12 C ATOM 145 C SER A1811 -40.015 30.957 -7.271 1.00 21.03 C ATOM 146 O SER A1811 -40.682 31.529 -6.404 1.00 22.37 O ATOM 147 CB SER A1811 -41.057 28.713 -6.914 1.00 20.50 C ATOM 148 OG SER A1811 -39.953 28.113 -6.269 1.00 27.30 O ATOM 149 HG SER A1811 -39.395 27.645 -6.939 1.00 0.00 H ATOM 150 H SER A1811 -38.999 28.378 -8.546 1.00 0.00 H ATOM 151 N HIS A1812 -38.812 31.389 -7.638 1.00 23.65 N ATOM 152 CA HIS A1812 -38.182 32.532 -6.989 1.00 22.82 C ATOM 153 C HIS A1812 -38.931 33.824 -7.309 1.00 23.76 C ATOM 154 O HIS A1812 -39.581 33.952 -8.350 1.00 22.15 O ATOM 155 CB HIS A1812 -36.723 32.645 -7.433 1.00 22.23 C ATOM 156 CG HIS A1812 -35.856 33.428 -6.496 1.00 24.57 C ATOM 157 ND1 HIS A1812 -35.960 34.794 -6.347 1.00 26.25 N ATOM 158 CD2 HIS A1812 -34.849 33.037 -5.679 1.00 24.66 C ATOM 159 CE1 HIS A1812 -35.068 35.209 -5.465 1.00 25.68 C ATOM 160 NE2 HIS A1812 -34.378 34.163 -5.048 1.00 27.55 N ATOM 161 H HIS A1812 -38.309 30.900 -8.406 1.00 0.00 H ATOM 162 N ASP A1813 -38.839 34.790 -6.389 1.00 23.55 N ATOM 163 CA ASP A1813 -39.507 36.073 -6.591 1.00 21.75 C ATOM 164 C ASP A1813 -38.939 36.816 -7.793 1.00 23.97 C ATOM 165 O ASP A1813 -39.688 37.428 -8.562 1.00 31.48 O ATOM 166 CB ASP A1813 -39.390 36.938 -5.336 1.00 30.99 C ATOM 167 CG ASP A1813 -40.489 36.665 -4.325 1.00 32.45 C ATOM 168 OD1 ASP A1813 -41.233 35.676 -4.491 1.00 31.86 O ATOM 169 OD2 ASP A1813 -40.613 37.452 -3.364 1.00 33.80 O ATOM 170 H ASP A1813 -38.287 34.626 -5.523 1.00 0.00 H ATOM 171 N ALA A1814 -37.619 36.779 -7.974 1.00 23.04 N ATOM 172 CA ALA A1814 -36.952 37.506 -9.048 1.00 24.49 C ATOM 173 C ALA A1814 -36.841 36.698 -10.340 1.00 26.04 C ATOM 174 O ALA A1814 -36.001 37.017 -11.189 1.00 24.95 O ATOM 175 CB ALA A1814 -35.558 37.951 -8.596 1.00 23.06 C ATOM 176 H ALA A1814 -37.042 36.209 -7.323 1.00 0.00 H ATOM 177 N ALA A1815 -37.674 35.675 -10.515 1.00 24.95 N ATOM 178 CA ALA A1815 -37.536 34.750 -11.629 1.00 24.03 C ATOM 179 C ALA A1815 -38.256 35.201 -12.891 1.00 27.17 C ATOM 180 O ALA A1815 -38.014 34.624 -13.957 1.00 28.92 O ATOM 181 CB ALA A1815 -38.057 33.367 -11.230 1.00 22.54 C ATOM 182 H ALA A1815 -38.447 35.533 -9.834 1.00 0.00 H ATOM 183 N TRP A1816 -39.113 36.218 -12.805 1.00 27.09 N ATOM 184 CA TRP A1816 -39.988 36.540 -13.928 1.00 28.09 C ATOM 185 C TRP A1816 -39.277 36.826 -15.255 1.00 32.40 C ATOM 186 O TRP A1816 -39.851 36.474 -16.299 1.00 30.08 O ATOM 187 CB TRP A1816 -40.911 37.709 -13.545 1.00 23.08 C ATOM 188 CG TRP A1816 -40.222 38.942 -13.054 1.00 29.77 C ATOM 189 CD1 TRP A1816 -39.873 39.233 -11.765 1.00 26.75 C ATOM 190 CD2 TRP A1816 -39.821 40.069 -13.842 1.00 33.41 C ATOM 191 NE1 TRP A1816 -39.269 40.467 -11.706 1.00 25.07 N ATOM 192 CE2 TRP A1816 -39.223 41.000 -12.967 1.00 28.72 C ATOM 193 CE3 TRP A1816 -39.897 40.375 -15.205 1.00 31.33 C ATOM 194 CZ2 TRP A1816 -38.709 42.217 -13.410 1.00 28.55 C ATOM 195 CZ3 TRP A1816 -39.386 41.583 -15.642 1.00 32.96 C ATOM 196 CH2 TRP A1816 -38.800 42.489 -14.748 1.00 30.76 C ATOM 197 HE1 TRP A1816 -38.906 40.922 -10.844 1.00 0.00 H ATOM 198 H TRP A1816 -39.159 36.785 -11.934 1.00 0.00 H ATOM 199 N PRO A1817 -38.079 37.426 -15.314 1.00 31.69 N ATOM 200 CA PRO A1817 -37.478 37.681 -16.633 1.00 25.42 C ATOM 201 C PRO A1817 -36.910 36.446 -17.309 1.00 26.34 C ATOM 202 O PRO A1817 -36.418 36.555 -18.438 1.00 27.87 O ATOM 203 CB PRO A1817 -36.359 38.693 -16.324 1.00 25.01 C ATOM 204 CG PRO A1817 -36.642 39.194 -14.945 1.00 27.59 C ATOM 205 CD PRO A1817 -37.265 38.037 -14.248 1.00 27.04 C ATOM 206 N PHE A1818 -36.960 35.273 -16.673 1.00 27.11 N ATOM 207 CA PHE A1818 -36.286 34.095 -17.208 1.00 25.53 C ATOM 208 C PHE A1818 -37.197 32.873 -17.245 1.00 26.64 C ATOM 209 O PHE A1818 -36.706 31.747 -17.378 1.00 28.97 O ATOM 210 CB PHE A1818 -35.024 33.797 -16.393 1.00 26.17 C ATOM 211 CG PHE A1818 -34.306 35.031 -15.931 1.00 24.75 C ATOM 212 CD1 PHE A1818 -33.529 35.769 -16.810 1.00 26.66 C ATOM 213 CD2 PHE A1818 -34.423 35.465 -14.623 1.00 25.05 C ATOM 214 CE1 PHE A1818 -32.877 36.913 -16.391 1.00 25.10 C ATOM 215 CE2 PHE A1818 -33.773 36.609 -14.199 1.00 24.52 C ATOM 216 CZ PHE A1818 -33.003 37.333 -15.085 1.00 24.19 C ATOM 217 H PHE A1818 -37.489 35.198 -15.781 1.00 0.00 H ATOM 218 N LEU A1819 -38.510 33.068 -17.139 1.00 27.16 N ATOM 219 CA LEU A1819 -39.442 31.948 -17.086 1.00 27.78 C ATOM 220 C LEU A1819 -39.783 31.414 -18.469 1.00 32.24 C ATOM 221 O LEU A1819 -39.878 30.197 -18.654 1.00 33.20 O ATOM 222 CB LEU A1819 -40.719 32.364 -16.357 1.00 28.25 C ATOM 223 CG LEU A1819 -40.509 32.679 -14.880 1.00 24.07 C ATOM 224 CD1 LEU A1819 -41.802 33.153 -14.237 1.00 23.77 C ATOM 225 CD2 LEU A1819 -39.962 31.450 -14.171 1.00 25.56 C ATOM 226 H LEU A1819 -38.878 34.039 -17.093 1.00 0.00 H ATOM 227 N GLU A1820 -39.970 32.297 -19.440 1.00 31.88 N ATOM 228 CA GLU A1820 -40.189 31.932 -20.828 1.00 33.78 C ATOM 229 C GLU A1820 -39.101 32.567 -21.688 1.00 30.86 C ATOM 230 O GLU A1820 -38.434 33.511 -21.251 1.00 27.98 O ATOM 231 CB GLU A1820 -41.584 32.383 -21.293 1.00 37.32 C ATOM 232 CG GLU A1820 -42.737 31.760 -20.503 1.00 36.29 C ATOM 233 CD GLU A1820 -42.786 30.241 -20.620 1.00 44.13 C ATOM 234 OE1 GLU A1820 -42.252 29.697 -21.612 1.00 49.19 O ATOM 235 OE2 GLU A1820 -43.360 29.586 -19.720 1.00 40.80 O ATOM 236 H GLU A1820 -39.959 33.307 -19.194 1.00 0.00 H ATOM 237 N PRO A1821 -38.872 32.060 -22.903 1.00 31.23 N ATOM 238 CA PRO A1821 -37.824 32.649 -23.744 1.00 26.72 C ATOM 239 C PRO A1821 -38.145 34.091 -24.095 1.00 23.80 C ATOM 240 O PRO A1821 -39.305 34.469 -24.271 1.00 29.85 O ATOM 241 CB PRO A1821 -37.822 31.756 -24.990 1.00 21.06 C ATOM 242 CG PRO A1821 -38.407 30.480 -24.539 1.00 25.65 C ATOM 243 CD PRO A1821 -39.456 30.866 -23.538 1.00 32.66 C ATOM 244 N VAL A1822 -37.091 34.904 -24.180 1.00 22.39 N ATOM 245 CA VAL A1822 -37.248 36.291 -24.594 1.00 27.25 C ATOM 246 C VAL A1822 -37.910 36.339 -25.963 1.00 28.84 C ATOM 247 O VAL A1822 -37.475 35.667 -26.907 1.00 24.01 O ATOM 248 CB VAL A1822 -35.885 36.999 -24.605 1.00 28.41 C ATOM 249 CG1 VAL A1822 -36.010 38.391 -25.203 1.00 28.49 C ATOM 250 CG2 VAL A1822 -35.307 37.067 -23.201 1.00 24.81 C ATOM 251 H VAL A1822 -36.144 34.542 -23.947 1.00 0.00 H ATOM 252 N ASN A1823 -38.980 37.124 -26.072 1.00 28.81 N ATOM 253 CA ASN A1823 -39.665 37.318 -27.342 1.00 29.41 C ATOM 254 C ASN A1823 -38.941 38.395 -28.137 1.00 29.89 C ATOM 255 O ASN A1823 -39.066 39.586 -27.822 1.00 32.75 O ATOM 256 CB ASN A1823 -41.127 37.707 -27.115 1.00 30.34 C ATOM 257 CG ASN A1823 -41.959 37.631 -28.380 1.00 33.93 C ATOM 258 OD1 ASN A1823 -41.430 37.599 -29.492 1.00 33.24 O ATOM 259 ND2 ASN A1823 -43.276 37.608 -28.214 1.00 38.75 N ATOM 260 HD22 ASN A1823 -43.680 37.637 -27.256 1.00 0.00 H ATOM 261 HD21 ASN A1823 -43.904 37.561 -29.042 1.00 0.00 H ATOM 262 H ASN A1823 -39.337 37.612 -25.226 1.00 0.00 H ATOM 263 N PRO A1824 -38.184 38.024 -29.175 1.00 30.44 N ATOM 264 CA PRO A1824 -37.411 39.034 -29.912 1.00 30.88 C ATOM 265 C PRO A1824 -38.277 40.049 -30.633 1.00 29.46 C ATOM 266 O PRO A1824 -37.807 41.165 -30.888 1.00 29.51 O ATOM 267 CB PRO A1824 -36.587 38.195 -30.897 1.00 29.99 C ATOM 268 CG PRO A1824 -37.389 36.952 -31.085 1.00 28.26 C ATOM 269 CD PRO A1824 -38.044 36.680 -29.762 1.00 28.13 C ATOM 270 N ARG A1825 -39.524 39.705 -30.961 1.00 29.03 N ATOM 271 CA ARG A1825 -40.430 40.686 -31.549 1.00 32.84 C ATOM 272 C ARG A1825 -40.701 41.839 -30.591 1.00 34.58 C ATOM 273 O ARG A1825 -41.045 42.942 -31.029 1.00 36.72 O ATOM 274 CB ARG A1825 -41.747 40.019 -31.947 1.00 34.93 C ATOM 275 CG ARG A1825 -41.631 38.935 -33.010 1.00 29.55 C ATOM 276 CD ARG A1825 -42.898 38.101 -33.040 1.00 28.25 C ATOM 277 NE ARG A1825 -42.922 37.153 -34.145 1.00 31.74 N ATOM 278 CZ ARG A1825 -43.888 36.261 -34.339 1.00 32.18 C ATOM 279 NH1 ARG A1825 -44.908 36.194 -33.494 1.00 32.84 N ATOM 280 NH2 ARG A1825 -43.833 35.437 -35.376 1.00 31.96 N ATOM 281 HE ARG A1825 -42.135 37.175 -34.824 1.00 0.00 H ATOM 282 HH12 ARG A1825 -45.664 35.496 -33.646 1.00 0.00 H ATOM 283 HH11 ARG A1825 -44.952 36.839 -32.680 1.00 0.00 H ATOM 284 HH22 ARG A1825 -44.590 34.739 -35.527 1.00 0.00 H ATOM 285 HH21 ARG A1825 -43.033 35.488 -36.039 1.00 0.00 H ATOM 286 H ARG A1825 -39.852 38.732 -30.797 1.00 0.00 H ATOM 287 N LEU A1826 -40.548 41.604 -29.290 1.00 35.42 N ATOM 288 CA LEU A1826 -40.860 42.589 -28.264 1.00 33.48 C ATOM 289 C LEU A1826 -39.607 43.295 -27.770 1.00 37.55 C ATOM 290 O LEU A1826 -39.651 44.501 -27.510 1.00 41.29 O ATOM 291 CB LEU A1826 -41.639 41.922 -27.127 1.00 34.91 C ATOM 292 CG LEU A1826 -43.010 41.387 -27.525 1.00 35.91 C ATOM 293 CD1 LEU A1826 -43.618 40.546 -26.413 1.00 33.36 C ATOM 294 CD2 LEU A1826 -43.924 42.544 -27.899 1.00 35.16 C ATOM 295 H LEU A1826 -40.189 40.674 -28.993 1.00 0.00 H ATOM 296 N VAL A1827 -38.496 42.579 -27.645 1.00 36.38 N ATOM 297 CA VAL A1827 -37.256 43.133 -27.120 1.00 33.11 C ATOM 298 C VAL A1827 -36.352 43.544 -28.278 1.00 32.22 C ATOM 299 O VAL A1827 -35.733 42.700 -28.933 1.00 32.42 O ATOM 300 CB VAL A1827 -36.589 42.110 -26.199 1.00 31.02 C ATOM 301 CG1 VAL A1827 -35.369 42.711 -25.544 1.00 27.49 C ATOM 302 CG2 VAL A1827 -37.582 41.646 -25.149 1.00 36.23 C ATOM 303 H VAL A1827 -38.512 41.580 -27.934 1.00 0.00 H ATOM 304 N SER A1828 -36.269 44.849 -28.526 1.00 30.28 N ATOM 305 CA SER A1828 -35.523 45.350 -29.673 1.00 33.30 C ATOM 306 C SER A1828 -34.026 45.154 -29.457 1.00 32.35 C ATOM 307 O SER A1828 -33.464 45.640 -28.471 1.00 34.59 O ATOM 308 CB SER A1828 -35.846 46.823 -29.904 1.00 37.69 C ATOM 309 OG SER A1828 -35.423 47.237 -31.193 1.00 45.35 O ATOM 310 HG SER A1828 -35.643 48.194 -31.320 1.00 0.00 H ATOM 311 H SER A1828 -36.744 45.522 -27.891 1.00 0.00 H ATOM 312 N GLY A1829 -33.383 44.441 -30.380 1.00 30.69 N ATOM 313 CA GLY A1829 -31.958 44.200 -30.322 1.00 27.30 C ATOM 314 C GLY A1829 -31.548 42.890 -29.687 1.00 31.29 C ATOM 315 O GLY A1829 -30.354 42.557 -29.712 1.00 28.76 O ATOM 316 H GLY A1829 -33.926 44.042 -31.172 1.00 0.00 H ATOM 317 N TYR A1830 -32.494 42.129 -29.126 1.00 30.61 N ATOM 318 CA TYR A1830 -32.128 40.910 -28.411 1.00 23.70 C ATOM 319 C TYR A1830 -31.651 39.825 -29.366 1.00 24.10 C ATOM 320 O TYR A1830 -30.729 39.067 -29.041 1.00 23.67 O ATOM 321 CB TYR A1830 -33.306 40.410 -27.580 1.00 25.06 C ATOM 322 CG TYR A1830 -32.907 39.353 -26.576 1.00 25.38 C ATOM 323 CD1 TYR A1830 -32.277 39.702 -25.389 1.00 23.30 C ATOM 324 CD2 TYR A1830 -33.142 38.007 -26.824 1.00 21.69 C ATOM 325 CE1 TYR A1830 -31.901 38.739 -24.472 1.00 23.61 C ATOM 326 CE2 TYR A1830 -32.768 37.038 -25.916 1.00 22.11 C ATOM 327 CZ TYR A1830 -32.148 37.409 -24.743 1.00 24.78 C ATOM 328 OH TYR A1830 -31.776 36.444 -23.836 1.00 27.66 O ATOM 329 HH TYR A1830 -31.347 36.875 -23.055 1.00 0.00 H ATOM 330 H TYR A1830 -33.494 42.407 -29.199 1.00 0.00 H ATOM 331 N ARG A1831 -32.271 39.730 -30.544 1.00 32.20 N ATOM 332 CA ARG A1831 -31.862 38.724 -31.519 1.00 30.83 C ATOM 333 C ARG A1831 -30.425 38.952 -31.974 1.00 25.73 C ATOM 334 O ARG A1831 -29.654 37.998 -32.129 1.00 18.87 O ATOM 335 CB ARG A1831 -32.814 38.746 -32.716 1.00 33.82 C ATOM 336 CG ARG A1831 -32.770 37.490 -33.576 1.00 38.92 C ATOM 337 CD ARG A1831 -33.432 37.713 -34.931 1.00 38.09 C ATOM 338 NE ARG A1831 -34.828 38.129 -34.812 1.00 41.38 N ATOM 339 CZ ARG A1831 -35.854 37.287 -34.738 1.00 44.56 C ATOM 340 NH1 ARG A1831 -35.644 35.976 -34.767 1.00 38.37 N ATOM 341 NH2 ARG A1831 -37.093 37.754 -34.635 1.00 40.65 N ATOM 342 HE ARG A1831 -35.032 39.148 -34.783 1.00 0.00 H ATOM 343 HH12 ARG A1831 -36.448 35.319 -34.709 1.00 0.00 H ATOM 344 HH11 ARG A1831 -34.675 35.606 -34.848 1.00 0.00 H ATOM 345 HH22 ARG A1831 -37.894 37.094 -34.577 1.00 0.00 H ATOM 346 HH21 ARG A1831 -37.262 38.780 -34.612 1.00 0.00 H ATOM 347 H ARG A1831 -33.052 40.378 -30.769 1.00 0.00 H ATOM 348 N ARG A1832 -30.042 40.217 -32.168 1.00 25.61 N ATOM 349 CA ARG A1832 -28.718 40.530 -32.694 1.00 26.31 C ATOM 350 C ARG A1832 -27.623 40.340 -31.648 1.00 27.99 C ATOM 351 O ARG A1832 -26.498 39.958 -31.995 1.00 25.87 O ATOM 352 CB ARG A1832 -28.706 41.963 -33.230 1.00 25.44 C ATOM 353 CG ARG A1832 -27.341 42.461 -33.669 1.00 27.74 C ATOM 354 CD ARG A1832 -27.405 43.868 -34.250 1.00 26.88 C ATOM 355 NE ARG A1832 -28.165 44.795 -33.413 1.00 31.17 N ATOM 356 CZ ARG A1832 -27.683 45.405 -32.334 1.00 31.87 C ATOM 357 NH1 ARG A1832 -26.435 45.181 -31.939 1.00 27.90 N ATOM 358 NH2 ARG A1832 -28.452 46.237 -31.642 1.00 32.60 N ATOM 359 HE ARG A1832 -29.151 44.991 -33.680 1.00 0.00 H ATOM 360 HH12 ARG A1832 -26.063 45.661 -31.095 1.00 0.00 H ATOM 361 HH11 ARG A1832 -25.830 44.526 -32.474 1.00 0.00 H ATOM 362 HH22 ARG A1832 -28.075 46.714 -30.798 1.00 0.00 H ATOM 363 HH21 ARG A1832 -29.432 46.412 -31.944 1.00 0.00 H ATOM 364 H ARG A1832 -30.698 40.991 -31.940 1.00 0.00 H ATOM 365 N ILE A1833 -27.930 40.582 -30.375 1.00 26.33 N ATOM 366 CA ILE A1833 -26.907 40.610 -29.332 1.00 23.63 C ATOM 367 C ILE A1833 -26.711 39.242 -28.687 1.00 25.86 C ATOM 368 O ILE A1833 -25.575 38.821 -28.455 1.00 29.51 O ATOM 369 CB ILE A1833 -27.264 41.685 -28.285 1.00 27.77 C ATOM 370 CG1 ILE A1833 -27.129 43.080 -28.899 1.00 23.95 C ATOM 371 CG2 ILE A1833 -26.385 41.550 -27.045 1.00 22.97 C ATOM 372 CD1 ILE A1833 -27.582 44.197 -27.996 1.00 21.56 C ATOM 373 H ILE A1833 -28.922 40.755 -30.117 1.00 0.00 H ATOM 374 N ILE A1834 -27.790 38.529 -28.375 1.00 25.53 N ATOM 375 CA ILE A1834 -27.702 37.251 -27.673 1.00 26.64 C ATOM 376 C ILE A1834 -27.647 36.140 -28.714 1.00 27.69 C ATOM 377 O ILE A1834 -28.635 35.871 -29.406 1.00 33.40 O ATOM 378 CB ILE A1834 -28.876 37.058 -26.703 1.00 27.03 C ATOM 379 CG1 ILE A1834 -28.801 38.086 -25.575 1.00 23.99 C ATOM 380 CG2 ILE A1834 -28.881 35.642 -26.134 1.00 27.21 C ATOM 381 CD1 ILE A1834 -27.494 38.058 -24.814 1.00 22.63 C ATOM 382 H ILE A1834 -28.727 38.894 -28.640 1.00 0.00 H ATOM 383 N LYS A1835 -26.490 35.485 -28.823 1.00 25.74 N ATOM 384 CA LYS A1835 -26.302 34.447 -29.826 1.00 30.27 C ATOM 385 C LYS A1835 -26.806 33.082 -29.381 1.00 33.08 C ATOM 386 O LYS A1835 -27.041 32.219 -30.231 1.00 42.75 O ATOM 387 CB LYS A1835 -24.824 34.326 -30.204 1.00 30.93 C ATOM 388 CG LYS A1835 -24.550 34.524 -31.687 1.00 36.87 C ATOM 389 CD LYS A1835 -23.193 33.952 -32.093 1.00 48.47 C ATOM 390 CE LYS A1835 -23.138 32.439 -31.897 1.00 45.56 C ATOM 391 NZ LYS A1835 -21.888 31.835 -32.436 1.00 42.42 N ATOM 392 HZ1 LYS A1835 -21.823 32.027 -33.456 1.00 0.00 H ATOM 393 HZ2 LYS A1835 -21.067 32.250 -31.951 1.00 0.00 H ATOM 394 HZ3 LYS A1835 -21.904 30.807 -32.276 1.00 0.00 H ATOM 395 H LYS A1835 -25.708 35.720 -28.179 1.00 0.00 H ATOM 396 N ASN A1836 -26.964 32.855 -28.083 1.00 28.19 N ATOM 397 CA ASN A1836 -27.413 31.564 -27.560 1.00 32.49 C ATOM 398 C ASN A1836 -28.355 31.810 -26.393 1.00 34.81 C ATOM 399 O ASN A1836 -27.958 31.746 -25.222 1.00 36.01 O ATOM 400 CB ASN A1836 -26.223 30.698 -27.139 1.00 30.75 C ATOM 401 CG ASN A1836 -25.253 30.457 -28.279 1.00 36.13 C ATOM 402 OD1 ASN A1836 -24.050 30.681 -28.146 1.00 38.99 O ATOM 403 ND2 ASN A1836 -25.778 30.009 -29.417 1.00 34.58 N ATOM 404 HD22 ASN A1836 -26.801 29.833 -29.484 1.00 0.00 H ATOM 405 HD21 ASN A1836 -25.165 29.834 -30.239 1.00 0.00 H ATOM 406 H ASN A1836 -26.761 33.623 -27.412 1.00 0.00 H ATOM 407 N PRO A1837 -29.625 32.094 -26.679 1.00 33.33 N ATOM 408 CA PRO A1837 -30.573 32.388 -25.601 1.00 31.82 C ATOM 409 C PRO A1837 -30.908 31.147 -24.792 1.00 32.92 C ATOM 410 O PRO A1837 -30.871 30.020 -25.292 1.00 34.22 O ATOM 411 CB PRO A1837 -31.804 32.913 -26.346 1.00 30.41 C ATOM 412 CG PRO A1837 -31.727 32.264 -27.680 1.00 31.24 C ATOM 413 CD PRO A1837 -30.259 32.171 -28.007 1.00 35.61 C ATOM 414 N MET A1838 -31.241 31.373 -23.524 1.00 31.66 N ATOM 415 CA MET A1838 -31.568 30.287 -22.612 1.00 34.19 C ATOM 416 C MET A1838 -32.437 30.840 -21.492 1.00 32.34 C ATOM 417 O MET A1838 -32.237 31.973 -21.048 1.00 31.31 O ATOM 418 CB MET A1838 -30.300 29.635 -22.046 1.00 31.44 C ATOM 419 CG MET A1838 -30.545 28.426 -21.155 1.00 31.33 C ATOM 420 SD MET A1838 -31.325 27.046 -22.013 1.00 30.00 S ATOM 421 CE MET A1838 -30.086 26.641 -23.241 1.00 30.50 C ATOM 422 H MET A1838 -31.268 32.352 -23.175 1.00 0.00 H ATOM 423 N ASP A1839 -33.404 30.037 -21.051 1.00 32.52 N ATOM 424 CA ASP A1839 -34.317 30.434 -19.989 1.00 30.33 C ATOM 425 C ASP A1839 -34.684 29.200 -19.175 1.00 31.96 C ATOM 426 O ASP A1839 -34.256 28.082 -19.474 1.00 33.57 O ATOM 427 CB ASP A1839 -35.561 31.111 -20.558 1.00 28.92 C ATOM 428 CG ASP A1839 -36.336 30.202 -21.483 1.00 34.06 C ATOM 429 OD1 ASP A1839 -35.727 29.650 -22.427 1.00 31.54 O ATOM 430 OD2 ASP A1839 -37.550 30.025 -21.252 1.00 35.57 O ATOM 431 H ASP A1839 -33.510 29.095 -21.480 1.00 0.00 H ATOM 432 N PHE A1840 -35.501 29.409 -18.140 1.00 30.09 N ATOM 433 CA PHE A1840 -35.811 28.320 -17.220 1.00 30.76 C ATOM 434 C PHE A1840 -36.734 27.281 -17.848 1.00 34.43 C ATOM 435 O PHE A1840 -36.646 26.097 -17.504 1.00 34.08 O ATOM 436 CB PHE A1840 -36.430 28.873 -15.936 1.00 30.94 C ATOM 437 CG PHE A1840 -35.480 29.693 -15.110 1.00 28.39 C ATOM 438 CD1 PHE A1840 -34.115 29.485 -15.191 1.00 25.94 C ATOM 439 CD2 PHE A1840 -35.953 30.673 -14.251 1.00 28.04 C ATOM 440 CE1 PHE A1840 -33.237 30.237 -14.434 1.00 27.27 C ATOM 441 CE2 PHE A1840 -35.079 31.430 -13.488 1.00 29.44 C ATOM 442 CZ PHE A1840 -33.720 31.211 -13.581 1.00 26.72 C ATOM 443 H PHE A1840 -35.917 30.350 -17.989 1.00 0.00 H ATOM 444 N SER A1841 -37.620 27.691 -18.762 1.00 34.31 N ATOM 445 CA SER A1841 -38.541 26.725 -19.354 1.00 33.91 C ATOM 446 C SER A1841 -37.811 25.763 -20.280 1.00 36.12 C ATOM 447 O SER A1841 -38.138 24.571 -20.326 1.00 39.62 O ATOM 448 CB SER A1841 -39.658 27.438 -20.108 1.00 31.50 C ATOM 449 OG SER A1841 -39.174 27.997 -21.313 1.00 38.10 O ATOM 450 HG SER A1841 -38.459 28.650 -21.108 1.00 0.00 H ATOM 451 H SER A1841 -37.653 28.690 -19.049 1.00 0.00 H ATOM 452 N THR A1842 -36.821 26.261 -21.026 1.00 32.87 N ATOM 453 CA THR A1842 -36.039 25.385 -21.893 1.00 36.72 C ATOM 454 C THR A1842 -35.214 24.395 -21.076 1.00 35.18 C ATOM 455 O THR A1842 -35.142 23.205 -21.415 1.00 38.84 O ATOM 456 CB THR A1842 -35.141 26.222 -22.806 1.00 34.22 C ATOM 457 OG1 THR A1842 -35.939 27.187 -23.504 1.00 29.08 O ATOM 458 CG2 THR A1842 -34.425 25.335 -23.815 1.00 24.66 C ATOM 459 HG1 THR A1842 -36.388 27.778 -22.849 1.00 0.00 H ATOM 460 H THR A1842 -36.606 27.278 -20.989 1.00 0.00 H ATOM 461 N MET A1843 -34.597 24.865 -19.989 1.00 33.01 N ATOM 462 CA MET A1843 -33.863 23.966 -19.103 1.00 36.15 C ATOM 463 C MET A1843 -34.793 22.937 -18.473 1.00 37.42 C ATOM 464 O MET A1843 -34.408 21.778 -18.276 1.00 34.95 O ATOM 465 CB MET A1843 -33.145 24.769 -18.020 1.00 34.98 C ATOM 466 CG MET A1843 -32.187 25.819 -18.550 1.00 33.14 C ATOM 467 SD MET A1843 -31.588 26.897 -17.240 1.00 33.68 S ATOM 468 CE MET A1843 -30.775 25.710 -16.171 1.00 33.76 C ATOM 469 H MET A1843 -34.640 25.881 -19.771 1.00 0.00 H ATOM 470 N ARG A1844 -36.021 23.347 -18.143 1.00 39.12 N ATOM 471 CA ARG A1844 -37.008 22.417 -17.603 1.00 38.99 C ATOM 472 C ARG A1844 -37.357 21.337 -18.620 1.00 41.90 C ATOM 473 O ARG A1844 -37.324 20.138 -18.310 1.00 38.96 O ATOM 474 CB ARG A1844 -38.259 23.187 -17.176 1.00 36.91 C ATOM 475 CG ARG A1844 -39.486 22.321 -16.957 1.00 36.67 C ATOM 476 CD ARG A1844 -39.302 21.404 -15.765 1.00 39.23 C ATOM 477 NE ARG A1844 -39.159 22.150 -14.518 1.00 38.42 N ATOM 478 CZ ARG A1844 -38.750 21.612 -13.374 1.00 35.69 C ATOM 479 NH1 ARG A1844 -38.439 20.325 -13.320 1.00 35.39 N ATOM 480 NH2 ARG A1844 -38.646 22.362 -12.285 1.00 33.03 N ATOM 481 HE ARG A1844 -39.391 23.164 -14.526 1.00 0.00 H ATOM 482 HH12 ARG A1844 -38.119 19.905 -12.424 1.00 0.00 H ATOM 483 HH11 ARG A1844 -38.515 19.735 -14.173 1.00 0.00 H ATOM 484 HH22 ARG A1844 -38.326 21.939 -11.391 1.00 0.00 H ATOM 485 HH21 ARG A1844 -38.885 23.373 -12.325 1.00 0.00 H ATOM 486 H ARG A1844 -36.278 24.346 -18.273 1.00 0.00 H ATOM 487 N GLU A1845 -37.697 21.751 -19.846 1.00 41.40 N ATOM 488 CA GLU A1845 -37.987 20.803 -20.916 1.00 41.05 C ATOM 489 C GLU A1845 -36.846 19.814 -21.099 1.00 43.78 C ATOM 490 O GLU A1845 -37.065 18.600 -21.178 1.00 49.65 O ATOM 491 CB GLU A1845 -38.246 21.546 -22.226 1.00 44.67 C ATOM 492 CG GLU A1845 -39.547 22.319 -22.288 1.00 49.45 C ATOM 493 CD GLU A1845 -39.741 22.991 -23.636 1.00 55.07 C ATOM 494 OE1 GLU A1845 -38.873 22.805 -24.516 1.00 51.13 O ATOM 495 OE2 GLU A1845 -40.753 23.704 -23.815 1.00 61.00 O ATOM 496 H GLU A1845 -37.756 22.771 -20.040 1.00 0.00 H ATOM 497 N ARG A1846 -35.613 20.319 -21.170 1.00 41.04 N ATOM 498 CA ARG A1846 -34.479 19.428 -21.382 1.00 43.67 C ATOM 499 C ARG A1846 -34.225 18.535 -20.171 1.00 44.16 C ATOM 500 O ARG A1846 -33.698 17.427 -20.322 1.00 48.85 O ATOM 501 CB ARG A1846 -33.233 20.243 -21.723 1.00 43.61 C ATOM 502 CG ARG A1846 -32.036 19.404 -22.131 1.00 51.04 C ATOM 503 CD ARG A1846 -30.884 20.278 -22.590 1.00 54.28 C ATOM 504 NE ARG A1846 -29.597 19.621 -22.388 1.00 53.47 N ATOM 505 CZ ARG A1846 -28.420 20.217 -22.547 1.00 54.91 C ATOM 506 NH1 ARG A1846 -28.365 21.491 -22.914 1.00 54.85 N ATOM 507 NH2 ARG A1846 -27.298 19.542 -22.336 1.00 55.66 N ATOM 508 HE ARG A1846 -29.601 18.621 -22.101 1.00 0.00 H ATOM 509 HH12 ARG A1846 -27.444 21.957 -23.038 1.00 0.00 H ATOM 510 HH11 ARG A1846 -29.243 22.023 -23.077 1.00 0.00 H ATOM 511 HH22 ARG A1846 -26.378 20.010 -22.461 1.00 0.00 H ATOM 512 HH21 ARG A1846 -27.338 18.544 -22.045 1.00 0.00 H ATOM 513 H ARG A1846 -35.462 21.344 -21.075 1.00 0.00 H ATOM 514 N LEU A1847 -34.599 18.984 -18.972 1.00 43.87 N ATOM 515 CA LEU A1847 -34.377 18.166 -17.784 1.00 47.75 C ATOM 516 C LEU A1847 -35.373 17.016 -17.720 1.00 46.77 C ATOM 517 O LEU A1847 -34.989 15.860 -17.501 1.00 43.12 O ATOM 518 CB LEU A1847 -34.462 19.027 -16.522 1.00 42.78 C ATOM 519 CG LEU A1847 -34.038 18.340 -15.221 1.00 34.42 C ATOM 520 CD1 LEU A1847 -32.619 17.815 -15.333 1.00 34.94 C ATOM 521 CD2 LEU A1847 -34.162 19.295 -14.047 1.00 38.09 C ATOM 522 H LEU A1847 -35.049 19.917 -18.884 1.00 0.00 H ATOM 523 N LEU A1848 -36.661 17.317 -17.902 1.00 46.86 N ATOM 524 CA LEU A1848 -37.670 16.262 -17.927 1.00 46.57 C ATOM 525 C LEU A1848 -37.396 15.274 -19.052 1.00 48.78 C ATOM 526 O LEU A1848 -37.333 14.061 -18.828 1.00 57.03 O ATOM 527 CB LEU A1848 -39.061 16.872 -18.076 1.00 43.90 C ATOM 528 CG LEU A1848 -39.569 17.639 -16.858 1.00 41.28 C ATOM 529 CD1 LEU A1848 -40.927 18.241 -17.152 1.00 39.85 C ATOM 530 CD2 LEU A1848 -39.638 16.723 -15.649 1.00 38.47 C ATOM 531 H LEU A1848 -36.947 18.309 -18.027 1.00 0.00 H ATOM 532 N ARG A1849 -37.217 15.782 -20.273 1.00 47.41 N ATOM 533 CA ARG A1849 -36.869 14.940 -21.411 1.00 45.58 C ATOM 534 C ARG A1849 -35.536 14.226 -21.205 1.00 48.13 C ATOM 535 O ARG A1849 -35.202 13.324 -21.980 1.00 52.72 O ATOM 536 CB ARG A1849 -36.846 15.797 -22.684 1.00 44.15 C ATOM 537 CG ARG A1849 -36.841 15.028 -24.001 1.00 45.47 C ATOM 538 CD ARG A1849 -37.251 15.927 -25.169 1.00 46.72 C ATOM 539 NE ARG A1849 -36.747 15.438 -26.452 1.00 53.90 N ATOM 540 CZ ARG A1849 -37.132 15.904 -27.639 1.00 58.34 C ATOM 541 NH1 ARG A1849 -38.040 16.871 -27.716 1.00 52.23 N ATOM 542 NH2 ARG A1849 -36.614 15.398 -28.752 1.00 59.05 N ATOM 543 HE ARG A1849 -36.040 14.675 -26.436 1.00 0.00 H ATOM 544 HH12 ARG A1849 -38.338 17.232 -28.645 1.00 0.00 H ATOM 545 HH11 ARG A1849 -38.453 17.267 -26.847 1.00 0.00 H ATOM 546 HH22 ARG A1849 -36.915 15.762 -29.678 1.00 0.00 H ATOM 547 HH21 ARG A1849 -35.907 14.637 -28.697 1.00 0.00 H ATOM 548 H ARG A1849 -37.329 16.806 -20.417 1.00 0.00 H ATOM 549 N GLY A1850 -34.774 14.598 -20.174 1.00 49.66 N ATOM 550 CA GLY A1850 -33.593 13.866 -19.770 1.00 54.62 C ATOM 551 C GLY A1850 -32.295 14.288 -20.424 1.00 58.27 C ATOM 552 O GLY A1850 -31.252 13.700 -20.111 1.00 57.42 O ATOM 553 H GLY A1850 -35.040 15.449 -19.639 1.00 0.00 H ATOM 554 N GLY A1851 -32.315 15.296 -21.297 1.00 54.97 N ATOM 555 CA GLY A1851 -31.157 15.635 -22.107 1.00 54.90 C ATOM 556 C GLY A1851 -29.967 16.258 -21.400 1.00 53.86 C ATOM 557 O GLY A1851 -29.182 16.975 -22.027 1.00 56.58 O ATOM 558 H GLY A1851 -33.185 15.856 -21.401 1.00 0.00 H ATOM 559 N TYR A1852 -29.808 15.998 -20.107 1.00 52.07 N ATOM 560 CA TYR A1852 -28.669 16.497 -19.347 1.00 58.56 C ATOM 561 C TYR A1852 -27.785 15.319 -18.963 1.00 61.10 C ATOM 562 O TYR A1852 -28.207 14.441 -18.203 1.00 62.06 O ATOM 563 CB TYR A1852 -29.121 17.271 -18.109 1.00 52.76 C ATOM 564 CG TYR A1852 -29.538 18.693 -18.411 1.00 48.79 C ATOM 565 CD1 TYR A1852 -28.618 19.621 -18.879 1.00 51.36 C ATOM 566 CD2 TYR A1852 -30.849 19.107 -18.226 1.00 47.49 C ATOM 567 CE1 TYR A1852 -28.995 20.921 -19.160 1.00 48.94 C ATOM 568 CE2 TYR A1852 -31.234 20.405 -18.499 1.00 44.75 C ATOM 569 CZ TYR A1852 -30.304 21.307 -18.966 1.00 44.12 C ATOM 570 OH TYR A1852 -30.691 22.597 -19.240 1.00 39.19 O ATOM 571 HH TYR A1852 -29.911 23.113 -19.564 1.00 0.00 H ATOM 572 H TYR A1852 -30.521 15.418 -19.620 1.00 0.00 H ATOM 573 N THR A1853 -26.564 15.304 -19.495 1.00 61.12 N ATOM 574 CA THR A1853 -25.658 14.190 -19.245 1.00 60.89 C ATOM 575 C THR A1853 -25.137 14.209 -17.813 1.00 61.51 C ATOM 576 O THR A1853 -24.971 13.152 -17.192 1.00 63.32 O ATOM 577 CB THR A1853 -24.501 14.232 -20.243 1.00 61.83 C ATOM 578 OG1 THR A1853 -25.026 14.309 -21.576 1.00 55.89 O ATOM 579 CG2 THR A1853 -23.637 12.989 -20.116 1.00 61.81 C ATOM 580 HG1 THR A1853 -24.277 14.336 -22.223 1.00 0.00 H ATOM 581 H THR A1853 -26.254 16.095 -20.095 1.00 0.00 H ATOM 582 N SER A1854 -24.873 15.398 -17.274 1.00 64.59 N ATOM 583 CA SER A1854 -24.404 15.542 -15.903 1.00 65.05 C ATOM 584 C SER A1854 -24.884 16.883 -15.365 1.00 59.59 C ATOM 585 O SER A1854 -25.499 17.679 -16.080 1.00 56.14 O ATOM 586 CB SER A1854 -22.878 15.432 -15.818 1.00 64.21 C ATOM 587 OG SER A1854 -22.250 16.545 -16.436 1.00 63.05 O ATOM 588 HG SER A1854 -21.267 16.448 -16.367 1.00 0.00 H ATOM 589 H SER A1854 -25.006 16.252 -17.852 1.00 0.00 H ATOM 590 N SER A1855 -24.591 17.134 -14.088 1.00 60.79 N ATOM 591 CA SER A1855 -24.911 18.430 -13.504 1.00 63.76 C ATOM 592 C SER A1855 -24.142 19.564 -14.173 1.00 64.62 C ATOM 593 O SER A1855 -24.572 20.723 -14.098 1.00 61.61 O ATOM 594 CB SER A1855 -24.622 18.410 -12.003 1.00 65.10 C ATOM 595 OG SER A1855 -23.248 18.170 -11.751 1.00 66.18 O ATOM 596 HG SER A1855 -23.089 18.162 -10.774 1.00 0.00 H ATOM 597 H SER A1855 -24.133 16.403 -13.508 1.00 0.00 H ATOM 598 N GLU A1856 -23.030 19.251 -14.846 1.00 62.69 N ATOM 599 CA GLU A1856 -22.179 20.291 -15.416 1.00 59.57 C ATOM 600 C GLU A1856 -22.865 21.004 -16.575 1.00 57.16 C ATOM 601 O GLU A1856 -22.759 22.228 -16.704 1.00 52.23 O ATOM 602 CB GLU A1856 -20.849 19.691 -15.871 1.00 64.11 C ATOM 603 CG GLU A1856 -20.161 18.816 -14.829 1.00 71.56 C ATOM 604 CD GLU A1856 -19.929 19.532 -13.507 1.00 72.87 C ATOM 605 OE1 GLU A1856 -20.104 18.891 -12.449 1.00 68.75 O ATOM 606 OE2 GLU A1856 -19.574 20.730 -13.526 1.00 72.76 O ATOM 607 H GLU A1856 -22.767 18.252 -14.965 1.00 0.00 H ATOM 608 N GLU A1857 -23.564 20.258 -17.435 1.00 58.01 N ATOM 609 CA GLU A1857 -24.277 20.888 -18.544 1.00 53.65 C ATOM 610 C GLU A1857 -25.440 21.732 -18.037 1.00 51.51 C ATOM 611 O GLU A1857 -25.703 22.821 -18.564 1.00 48.04 O ATOM 612 CB GLU A1857 -24.761 19.820 -19.531 1.00 53.80 C ATOM 613 CG GLU A1857 -23.690 18.800 -19.904 1.00 53.11 C ATOM 614 CD GLU A1857 -24.087 17.909 -21.069 1.00 58.17 C ATOM 615 OE1 GLU A1857 -23.204 17.199 -21.598 1.00 57.63 O ATOM 616 OE2 GLU A1857 -25.275 17.916 -21.460 1.00 60.28 O ATOM 617 H GLU A1857 -23.601 19.226 -17.315 1.00 0.00 H ATOM 618 N PHE A1858 -26.139 21.246 -17.008 1.00 48.71 N ATOM 619 CA PHE A1858 -27.189 22.027 -16.364 1.00 45.47 C ATOM 620 C PHE A1858 -26.647 23.363 -15.866 1.00 48.26 C ATOM 621 O PHE A1858 -27.148 24.437 -16.237 1.00 47.09 O ATOM 622 CB PHE A1858 -27.787 21.213 -15.215 1.00 46.55 C ATOM 623 CG PHE A1858 -28.833 21.942 -14.427 1.00 43.15 C ATOM 624 CD1 PHE A1858 -28.518 22.538 -13.216 1.00 42.05 C ATOM 625 CD2 PHE A1858 -30.135 22.019 -14.889 1.00 40.76 C ATOM 626 CE1 PHE A1858 -29.483 23.204 -12.484 1.00 40.76 C ATOM 627 CE2 PHE A1858 -31.104 22.684 -14.163 1.00 41.70 C ATOM 628 CZ PHE A1858 -30.778 23.278 -12.959 1.00 37.83 C ATOM 629 H PHE A1858 -25.930 20.289 -16.658 1.00 0.00 H ATOM 630 N ALA A1859 -25.610 23.309 -15.022 1.00 48.16 N ATOM 631 CA ALA A1859 -24.990 24.534 -14.526 1.00 47.66 C ATOM 632 C ALA A1859 -24.540 25.429 -15.673 1.00 42.72 C ATOM 633 O ALA A1859 -24.650 26.658 -15.594 1.00 41.28 O ATOM 634 CB ALA A1859 -23.810 24.196 -13.616 1.00 48.02 C ATOM 635 H ALA A1859 -25.242 22.385 -14.716 1.00 0.00 H ATOM 636 N ALA A1860 -24.043 24.825 -16.754 1.00 43.71 N ATOM 637 CA ALA A1860 -23.664 25.603 -17.928 1.00 44.79 C ATOM 638 C ALA A1860 -24.856 26.376 -18.479 1.00 44.18 C ATOM 639 O ALA A1860 -24.732 27.551 -18.843 1.00 44.14 O ATOM 640 CB ALA A1860 -23.073 24.686 -19.000 1.00 44.10 C ATOM 641 H ALA A1860 -23.925 23.792 -16.759 1.00 0.00 H ATOM 642 N ASP A1861 -26.025 25.732 -18.544 1.00 44.16 N ATOM 643 CA ASP A1861 -27.200 26.410 -19.083 1.00 40.75 C ATOM 644 C ASP A1861 -27.651 27.548 -18.170 1.00 39.25 C ATOM 645 O ASP A1861 -28.022 28.629 -18.649 1.00 35.38 O ATOM 646 CB ASP A1861 -28.332 25.405 -19.309 1.00 42.65 C ATOM 647 CG ASP A1861 -28.346 24.846 -20.727 1.00 44.21 C ATOM 648 OD1 ASP A1861 -27.541 25.312 -21.562 1.00 41.74 O ATOM 649 OD2 ASP A1861 -29.163 23.943 -21.010 1.00 47.85 O ATOM 650 H ASP A1861 -26.098 24.749 -18.211 1.00 0.00 H ATOM 651 N ALA A1862 -27.615 27.333 -16.851 1.00 38.15 N ATOM 652 CA ALA A1862 -27.972 28.409 -15.926 1.00 35.99 C ATOM 653 C ALA A1862 -27.033 29.602 -16.082 1.00 35.05 C ATOM 654 O ALA A1862 -27.473 30.752 -16.262 1.00 33.70 O ATOM 655 CB ALA A1862 -27.952 27.890 -14.489 1.00 33.86 C ATOM 656 H ALA A1862 -27.334 26.402 -16.483 1.00 0.00 H ATOM 657 N LEU A1863 -25.724 29.344 -16.023 1.00 34.51 N ATOM 658 CA LEU A1863 -24.759 30.417 -16.214 1.00 31.09 C ATOM 659 C LEU A1863 -24.925 31.076 -17.573 1.00 30.58 C ATOM 660 O LEU A1863 -24.580 32.248 -17.741 1.00 28.44 O ATOM 661 CB LEU A1863 -23.340 29.881 -16.042 1.00 30.64 C ATOM 662 CG LEU A1863 -23.070 29.287 -14.660 1.00 35.85 C ATOM 663 CD1 LEU A1863 -21.645 28.768 -14.569 1.00 37.77 C ATOM 664 CD2 LEU A1863 -23.360 30.301 -13.555 1.00 30.53 C ATOM 665 H LEU A1863 -25.394 28.375 -15.840 1.00 0.00 H ATOM 666 N LEU A1864 -25.459 30.346 -18.553 1.00 30.83 N ATOM 667 CA LEU A1864 -25.770 30.965 -19.837 1.00 32.15 C ATOM 668 C LEU A1864 -26.936 31.939 -19.710 1.00 32.74 C ATOM 669 O LEU A1864 -26.907 33.027 -20.302 1.00 30.04 O ATOM 670 CB LEU A1864 -26.074 29.895 -20.883 1.00 30.28 C ATOM 671 CG LEU A1864 -26.440 30.437 -22.267 1.00 31.06 C ATOM 672 CD1 LEU A1864 -25.289 31.245 -22.840 1.00 28.31 C ATOM 673 CD2 LEU A1864 -26.823 29.302 -23.197 1.00 29.16 C ATOM 674 H LEU A1864 -25.654 29.336 -18.402 1.00 0.00 H ATOM 675 N VAL A1865 -27.969 31.565 -18.944 1.00 31.64 N ATOM 676 CA VAL A1865 -29.058 32.498 -18.652 1.00 30.51 C ATOM 677 C VAL A1865 -28.497 33.803 -18.104 1.00 27.30 C ATOM 678 O VAL A1865 -28.776 34.894 -18.619 1.00 26.13 O ATOM 679 CB VAL A1865 -30.066 31.872 -17.668 1.00 30.24 C ATOM 680 CG1 VAL A1865 -31.070 32.914 -17.197 1.00 26.59 C ATOM 681 CG2 VAL A1865 -30.792 30.697 -18.298 1.00 30.09 C ATOM 682 H VAL A1865 -27.998 30.602 -18.553 1.00 0.00 H ATOM 683 N PHE A1866 -27.672 33.707 -17.063 1.00 26.45 N ATOM 684 CA PHE A1866 -27.235 34.937 -16.407 1.00 25.47 C ATOM 685 C PHE A1866 -26.176 35.693 -17.209 1.00 30.36 C ATOM 686 O PHE A1866 -26.134 36.930 -17.150 1.00 27.80 O ATOM 687 CB PHE A1866 -26.754 34.606 -14.999 1.00 25.00 C ATOM 688 CG PHE A1866 -27.766 33.839 -14.208 1.00 26.38 C ATOM 689 CD1 PHE A1866 -29.083 34.264 -14.167 1.00 24.86 C ATOM 690 CD2 PHE A1866 -27.422 32.669 -13.558 1.00 26.03 C ATOM 691 CE1 PHE A1866 -30.030 33.555 -13.464 1.00 25.73 C ATOM 692 CE2 PHE A1866 -28.368 31.956 -12.848 1.00 29.24 C ATOM 693 CZ PHE A1866 -29.673 32.400 -12.801 1.00 26.82 C ATOM 694 H PHE A1866 -27.347 32.779 -16.725 1.00 0.00 H ATOM 695 N ASP A1867 -25.334 34.987 -17.972 1.00 32.14 N ATOM 696 CA ASP A1867 -24.420 35.670 -18.885 1.00 25.19 C ATOM 697 C ASP A1867 -25.191 36.473 -19.921 1.00 23.35 C ATOM 698 O ASP A1867 -24.833 37.617 -20.221 1.00 21.34 O ATOM 699 CB ASP A1867 -23.497 34.666 -19.578 1.00 27.75 C ATOM 700 CG ASP A1867 -22.461 34.072 -18.642 1.00 30.25 C ATOM 701 OD1 ASP A1867 -22.078 34.748 -17.665 1.00 27.93 O ATOM 702 OD2 ASP A1867 -22.034 32.919 -18.884 1.00 30.31 O ATOM 703 H ASP A1867 -25.330 33.949 -17.915 1.00 0.00 H ATOM 704 N ASN A1868 -26.250 35.883 -20.485 1.00 26.09 N ATOM 705 CA ASN A1868 -27.084 36.619 -21.428 1.00 23.94 C ATOM 706 C ASN A1868 -27.716 37.835 -20.762 1.00 25.62 C ATOM 707 O ASN A1868 -27.724 38.936 -21.337 1.00 21.10 O ATOM 708 CB ASN A1868 -28.163 35.700 -22.005 1.00 24.13 C ATOM 709 CG ASN A1868 -27.600 34.660 -22.954 1.00 28.54 C ATOM 710 OD1 ASN A1868 -26.548 34.860 -23.560 1.00 32.97 O ATOM 711 ND2 ASN A1868 -28.305 33.544 -23.093 1.00 30.75 N ATOM 712 HD22 ASN A1868 -29.189 33.418 -22.560 1.00 0.00 H ATOM 713 HD21 ASN A1868 -27.973 32.796 -23.735 1.00 0.00 H ATOM 714 H ASN A1868 -26.480 34.896 -20.250 1.00 0.00 H ATOM 715 N CYS A1869 -28.239 37.657 -19.543 1.00 23.81 N ATOM 716 CA CYS A1869 -28.842 38.773 -18.822 1.00 23.46 C ATOM 717 C CYS A1869 -27.855 39.923 -18.661 1.00 24.71 C ATOM 718 O CYS A1869 -28.190 41.088 -18.913 1.00 20.71 O ATOM 719 CB CYS A1869 -29.348 38.305 -17.458 1.00 24.82 C ATOM 720 SG CYS A1869 -30.314 39.545 -16.560 1.00 20.70 S ATOM 721 H CYS A1869 -28.215 36.714 -19.105 1.00 0.00 H ATOM 722 N GLN A1870 -26.622 39.614 -18.252 1.00 26.08 N ATOM 723 CA GLN A1870 -25.636 40.669 -18.054 1.00 24.56 C ATOM 724 C GLN A1870 -25.118 41.234 -19.368 1.00 21.90 C ATOM 725 O GLN A1870 -24.649 42.376 -19.392 1.00 24.07 O ATOM 726 CB GLN A1870 -24.476 40.152 -17.205 1.00 19.59 C ATOM 727 CG GLN A1870 -24.895 39.752 -15.811 1.00 19.10 C ATOM 728 CD GLN A1870 -23.788 39.068 -15.044 1.00 23.20 C ATOM 729 OE1 GLN A1870 -23.760 37.843 -14.940 1.00 25.23 O ATOM 730 NE2 GLN A1870 -22.870 39.857 -14.493 1.00 23.15 N ATOM 731 HE22 GLN A1870 -22.935 40.889 -14.608 1.00 0.00 H ATOM 732 HE21 GLN A1870 -22.088 39.442 -13.948 1.00 0.00 H ATOM 733 H GLN A1870 -26.366 38.622 -18.075 1.00 0.00 H ATOM 734 N THR A1871 -25.200 40.472 -20.460 1.00 21.85 N ATOM 735 CA THR A1871 -24.768 41.002 -21.750 1.00 21.88 C ATOM 736 C THR A1871 -25.777 41.999 -22.303 1.00 22.36 C ATOM 737 O THR A1871 -25.391 43.043 -22.840 1.00 26.17 O ATOM 738 CB THR A1871 -24.549 39.870 -22.754 1.00 19.90 C ATOM 739 OG1 THR A1871 -23.697 38.869 -22.186 1.00 20.36 O ATOM 740 CG2 THR A1871 -23.898 40.408 -24.010 1.00 19.58 C ATOM 741 HG1 THR A1871 -24.119 38.503 -21.369 1.00 0.00 H ATOM 742 H THR A1871 -25.571 39.503 -20.393 1.00 0.00 H ATOM 743 N PHE A1872 -27.071 41.706 -22.175 1.00 22.45 N ATOM 744 CA PHE A1872 -28.073 42.547 -22.821 1.00 21.29 C ATOM 745 C PHE A1872 -28.584 43.694 -21.952 1.00 21.92 C ATOM 746 O PHE A1872 -28.939 44.748 -22.491 1.00 22.38 O ATOM 747 CB PHE A1872 -29.265 41.698 -23.271 1.00 22.52 C ATOM 748 CG PHE A1872 -30.297 42.473 -24.034 1.00 22.99 C ATOM 749 CD1 PHE A1872 -30.155 42.680 -25.398 1.00 22.68 C ATOM 750 CD2 PHE A1872 -31.401 43.011 -23.387 1.00 22.26 C ATOM 751 CE1 PHE A1872 -31.094 43.401 -26.106 1.00 22.78 C ATOM 752 CE2 PHE A1872 -32.342 43.733 -24.088 1.00 24.63 C ATOM 753 CZ PHE A1872 -32.189 43.928 -25.453 1.00 26.84 C ATOM 754 H PHE A1872 -27.366 40.880 -21.616 1.00 0.00 H ATOM 755 N ASN A1873 -28.650 43.528 -20.634 1.00 22.29 N ATOM 756 CA ASN A1873 -29.319 44.488 -19.766 1.00 20.48 C ATOM 757 C ASN A1873 -28.325 45.223 -18.877 1.00 25.48 C ATOM 758 O ASN A1873 -27.339 44.641 -18.413 1.00 28.69 O ATOM 759 CB ASN A1873 -30.363 43.797 -18.891 1.00 23.19 C ATOM 760 CG ASN A1873 -31.487 43.199 -19.698 1.00 24.55 C ATOM 761 OD1 ASN A1873 -32.543 43.812 -19.858 1.00 25.53 O ATOM 762 ND2 ASN A1873 -31.267 41.996 -20.221 1.00 21.93 N ATOM 763 HD22 ASN A1873 -30.359 41.517 -20.059 1.00 0.00 H ATOM 764 HD21 ASN A1873 -32.003 41.535 -20.792 1.00 0.00 H ATOM 765 H ASN A1873 -28.210 42.686 -20.210 1.00 0.00 H ATOM 766 N GLU A1874 -28.603 46.502 -18.636 1.00 27.98 N ATOM 767 CA GLU A1874 -27.810 47.277 -17.694 1.00 27.79 C ATOM 768 C GLU A1874 -27.883 46.652 -16.305 1.00 28.16 C ATOM 769 O GLU A1874 -28.875 46.017 -15.936 1.00 30.56 O ATOM 770 CB GLU A1874 -28.309 48.722 -17.644 1.00 25.95 C ATOM 771 CG GLU A1874 -28.464 49.372 -19.005 1.00 30.04 C ATOM 772 CD GLU A1874 -27.516 50.535 -19.204 1.00 35.11 C ATOM 773 OE1 GLU A1874 -27.729 51.326 -20.150 1.00 37.44 O ATOM 774 OE2 GLU A1874 -26.557 50.661 -18.411 1.00 36.36 O ATOM 775 H GLU A1874 -29.399 46.954 -19.129 1.00 0.00 H ATOM 776 N ASP A1875 -26.811 46.829 -15.530 1.00 29.88 N ATOM 777 CA ASP A1875 -26.799 46.306 -14.169 1.00 22.96 C ATOM 778 C ASP A1875 -27.865 46.950 -13.297 1.00 23.66 C ATOM 779 O ASP A1875 -28.294 46.339 -12.314 1.00 25.34 O ATOM 780 CB ASP A1875 -25.424 46.502 -13.537 1.00 20.40 C ATOM 781 CG ASP A1875 -24.394 45.537 -14.080 1.00 22.02 C ATOM 782 OD1 ASP A1875 -24.757 44.372 -14.345 1.00 21.10 O ATOM 783 OD2 ASP A1875 -23.224 45.942 -14.244 1.00 24.17 O ATOM 784 H ASP A1875 -25.983 47.341 -15.897 1.00 0.00 H ATOM 785 N ASP A1876 -28.306 48.163 -13.631 1.00 25.56 N ATOM 786 CA ASP A1876 -29.330 48.850 -12.856 1.00 25.79 C ATOM 787 C ASP A1876 -30.688 48.848 -13.545 1.00 24.76 C ATOM 788 O ASP A1876 -31.598 49.553 -13.098 1.00 24.42 O ATOM 789 CB ASP A1876 -28.894 50.283 -12.540 1.00 23.62 C ATOM 790 CG ASP A1876 -28.672 51.119 -13.773 1.00 22.16 C ATOM 791 OD1 ASP A1876 -28.369 50.548 -14.837 1.00 29.43 O ATOM 792 OD2 ASP A1876 -28.787 52.355 -13.671 1.00 23.21 O ATOM 793 H ASP A1876 -27.907 48.632 -14.469 1.00 0.00 H ATOM 794 N SER A1877 -30.846 48.079 -14.617 1.00 23.20 N ATOM 795 CA SER A1877 -32.168 47.861 -15.180 1.00 24.22 C ATOM 796 C SER A1877 -32.948 46.884 -14.305 1.00 26.29 C ATOM 797 O SER A1877 -32.382 46.174 -13.471 1.00 27.93 O ATOM 798 CB SER A1877 -32.066 47.320 -16.604 1.00 24.03 C ATOM 799 OG SER A1877 -31.551 46.002 -16.603 1.00 25.10 O ATOM 800 HG SER A1877 -30.649 46.002 -16.195 1.00 0.00 H ATOM 801 H SER A1877 -30.017 47.630 -15.056 1.00 0.00 H ATOM 802 N GLU A1878 -34.267 46.851 -14.504 1.00 23.92 N ATOM 803 CA GLU A1878 -35.099 45.918 -13.748 1.00 23.14 C ATOM 804 C GLU A1878 -34.702 44.472 -14.038 1.00 22.70 C ATOM 805 O GLU A1878 -34.494 43.672 -13.115 1.00 24.04 O ATOM 806 CB GLU A1878 -36.573 46.161 -14.068 1.00 22.75 C ATOM 807 CG GLU A1878 -37.082 47.522 -13.609 1.00 27.89 C ATOM 808 CD GLU A1878 -37.210 47.624 -12.095 1.00 38.56 C ATOM 809 OE1 GLU A1878 -37.735 46.671 -11.471 1.00 35.32 O ATOM 810 OE2 GLU A1878 -36.780 48.655 -11.527 1.00 34.54 O ATOM 811 H GLU A1878 -34.703 47.490 -15.198 1.00 0.00 H ATOM 812 N VAL A1879 -34.580 44.124 -15.321 1.00 21.69 N ATOM 813 CA VAL A1879 -34.086 42.801 -15.693 1.00 23.19 C ATOM 814 C VAL A1879 -32.682 42.586 -15.152 1.00 23.29 C ATOM 815 O VAL A1879 -32.324 41.471 -14.761 1.00 21.62 O ATOM 816 CB VAL A1879 -34.132 42.626 -17.226 1.00 23.85 C ATOM 817 CG1 VAL A1879 -33.492 41.308 -17.638 1.00 20.79 C ATOM 818 CG2 VAL A1879 -35.564 42.706 -17.730 1.00 23.50 C ATOM 819 H VAL A1879 -34.840 44.803 -16.065 1.00 0.00 H ATOM 820 N GLY A1880 -31.869 43.642 -15.118 1.00 24.73 N ATOM 821 CA GLY A1880 -30.521 43.508 -14.589 1.00 24.01 C ATOM 822 C GLY A1880 -30.507 43.153 -13.117 1.00 24.49 C ATOM 823 O GLY A1880 -29.852 42.190 -12.705 1.00 25.69 O ATOM 824 H GLY A1880 -32.199 44.563 -15.470 1.00 0.00 H ATOM 825 N LYS A1881 -31.232 43.927 -12.305 1.00 20.95 N ATOM 826 CA LYS A1881 -31.300 43.653 -10.874 1.00 22.18 C ATOM 827 C LYS A1881 -31.866 42.261 -10.606 1.00 20.31 C ATOM 828 O LYS A1881 -31.320 41.495 -9.796 1.00 21.32 O ATOM 829 CB LYS A1881 -32.133 44.732 -10.178 1.00 23.27 C ATOM 830 CG LYS A1881 -31.680 46.163 -10.483 1.00 20.65 C ATOM 831 CD LYS A1881 -32.136 47.170 -9.429 1.00 25.12 C ATOM 832 CE LYS A1881 -33.651 47.317 -9.379 1.00 36.87 C ATOM 833 NZ LYS A1881 -34.228 47.842 -10.652 1.00 33.26 N ATOM 834 HZ1 LYS A1881 -33.825 48.780 -10.853 1.00 0.00 H ATOM 835 HZ2 LYS A1881 -33.999 47.191 -11.430 1.00 0.00 H ATOM 836 HZ3 LYS A1881 -35.261 47.920 -10.557 1.00 0.00 H ATOM 837 H LYS A1881 -31.755 44.736 -12.698 1.00 0.00 H ATOM 838 N ALA A1882 -32.960 41.910 -11.290 1.00 20.52 N ATOM 839 CA ALA A1882 -33.516 40.567 -11.150 1.00 20.27 C ATOM 840 C ALA A1882 -32.471 39.509 -11.482 1.00 23.68 C ATOM 841 O ALA A1882 -32.291 38.537 -10.738 1.00 25.69 O ATOM 842 CB ALA A1882 -34.744 40.409 -12.046 1.00 18.84 C ATOM 843 H ALA A1882 -33.417 42.596 -11.924 1.00 0.00 H ATOM 844 N GLY A1883 -31.757 39.696 -12.592 1.00 22.89 N ATOM 845 CA GLY A1883 -30.747 38.735 -12.988 1.00 22.16 C ATOM 846 C GLY A1883 -29.630 38.596 -11.979 1.00 24.35 C ATOM 847 O GLY A1883 -29.098 37.501 -11.788 1.00 26.35 O ATOM 848 H GLY A1883 -31.926 40.538 -13.178 1.00 0.00 H ATOM 849 N HIS A1884 -29.254 39.694 -11.321 1.00 20.05 N ATOM 850 CA HIS A1884 -28.225 39.603 -10.291 1.00 21.54 C ATOM 851 C HIS A1884 -28.724 38.814 -9.088 1.00 25.12 C ATOM 852 O HIS A1884 -28.005 37.948 -8.565 1.00 22.05 O ATOM 853 CB HIS A1884 -27.768 41.000 -9.879 1.00 20.44 C ATOM 854 CG HIS A1884 -26.862 41.647 -10.874 1.00 20.51 C ATOM 855 ND1 HIS A1884 -25.846 40.962 -11.505 1.00 18.20 N ATOM 856 CD2 HIS A1884 -26.827 42.909 -11.363 1.00 20.12 C ATOM 857 CE1 HIS A1884 -25.220 41.776 -12.336 1.00 19.88 C ATOM 858 NE2 HIS A1884 -25.795 42.962 -12.269 1.00 21.75 N ATOM 859 H HIS A1884 -29.693 40.611 -11.541 1.00 0.00 H ATOM 860 N ILE A1885 -29.957 39.088 -8.646 1.00 24.28 N ATOM 861 CA ILE A1885 -30.529 38.312 -7.547 1.00 21.78 C ATOM 862 C ILE A1885 -30.572 36.830 -7.906 1.00 25.09 C ATOM 863 O ILE A1885 -30.223 35.967 -7.088 1.00 26.54 O ATOM 864 CB ILE A1885 -31.923 38.850 -7.179 1.00 19.88 C ATOM 865 CG1 ILE A1885 -31.838 40.325 -6.775 1.00 18.85 C ATOM 866 CG2 ILE A1885 -32.526 38.027 -6.058 1.00 20.86 C ATOM 867 CD1 ILE A1885 -33.147 40.911 -6.315 1.00 13.45 C ATOM 868 H ILE A1885 -30.508 39.853 -9.084 1.00 0.00 H ATOM 869 N MET A1886 -30.963 36.512 -9.145 1.00 25.50 N ATOM 870 CA MET A1886 -31.104 35.114 -9.547 1.00 27.98 C ATOM 871 C MET A1886 -29.753 34.425 -9.678 1.00 26.90 C ATOM 872 O MET A1886 -29.616 33.248 -9.324 1.00 30.13 O ATOM 873 CB MET A1886 -31.876 35.008 -10.864 1.00 24.80 C ATOM 874 CG MET A1886 -33.357 35.296 -10.744 1.00 26.63 C ATOM 875 SD MET A1886 -34.109 34.375 -9.392 1.00 24.04 S ATOM 876 CE MET A1886 -33.728 32.685 -9.854 1.00 24.24 C ATOM 877 H MET A1886 -31.169 37.267 -9.829 1.00 0.00 H ATOM 878 N ARG A1887 -28.750 35.128 -10.206 1.00 25.08 N ATOM 879 CA ARG A1887 -27.421 34.540 -10.335 1.00 25.68 C ATOM 880 C ARG A1887 -26.817 34.263 -8.963 1.00 29.09 C ATOM 881 O ARG A1887 -26.294 33.169 -8.711 1.00 32.08 O ATOM 882 CB ARG A1887 -26.522 35.466 -11.157 1.00 27.04 C ATOM 883 CG ARG A1887 -25.140 34.914 -11.469 1.00 24.23 C ATOM 884 CD ARG A1887 -24.299 35.959 -12.187 1.00 21.40 C ATOM 885 NE ARG A1887 -24.498 37.288 -11.613 1.00 23.02 N ATOM 886 CZ ARG A1887 -23.917 37.719 -10.497 1.00 21.92 C ATOM 887 NH1 ARG A1887 -23.091 36.929 -9.825 1.00 21.77 N ATOM 888 NH2 ARG A1887 -24.163 38.943 -10.049 1.00 20.87 N ATOM 889 HE ARG A1887 -25.137 37.941 -12.111 1.00 0.00 H ATOM 890 HH12 ARG A1887 -22.639 37.271 -8.953 1.00 0.00 H ATOM 891 HH11 ARG A1887 -22.895 35.968 -10.170 1.00 0.00 H ATOM 892 HH22 ARG A1887 -23.708 39.279 -9.176 1.00 0.00 H ATOM 893 HH21 ARG A1887 -24.811 39.567 -10.571 1.00 0.00 H ATOM 894 H ARG A1887 -28.917 36.103 -10.528 1.00 0.00 H ATOM 895 N ARG A1888 -26.899 35.242 -8.052 1.00 26.22 N ATOM 896 CA ARG A1888 -26.394 35.024 -6.699 1.00 24.60 C ATOM 897 C ARG A1888 -27.129 33.879 -6.010 1.00 29.89 C ATOM 898 O ARG A1888 -26.509 33.063 -5.316 1.00 31.87 O ATOM 899 CB ARG A1888 -26.506 36.306 -5.875 1.00 24.27 C ATOM 900 CG ARG A1888 -25.417 37.320 -6.173 1.00 20.11 C ATOM 901 CD ARG A1888 -25.391 38.430 -5.148 1.00 15.58 C ATOM 902 NE ARG A1888 -26.636 39.186 -5.122 1.00 17.78 N ATOM 903 CZ ARG A1888 -26.866 40.272 -5.853 1.00 19.49 C ATOM 904 NH1 ARG A1888 -25.932 40.730 -6.676 1.00 20.58 N ATOM 905 NH2 ARG A1888 -28.029 40.902 -5.764 1.00 19.86 N ATOM 906 HE ARG A1888 -27.393 38.855 -4.491 1.00 0.00 H ATOM 907 HH12 ARG A1888 -26.114 41.580 -7.247 1.00 0.00 H ATOM 908 HH11 ARG A1888 -25.018 40.239 -6.750 1.00 0.00 H ATOM 909 HH22 ARG A1888 -28.205 41.751 -6.337 1.00 0.00 H ATOM 910 HH21 ARG A1888 -28.765 40.547 -5.121 1.00 0.00 H ATOM 911 H ARG A1888 -27.322 36.157 -8.308 1.00 0.00 H ATOM 912 N PHE A1889 -28.451 33.798 -6.195 1.00 32.62 N ATOM 913 CA PHE A1889 -29.206 32.681 -5.633 1.00 31.00 C ATOM 914 C PHE A1889 -28.741 31.349 -6.209 1.00 34.09 C ATOM 915 O PHE A1889 -28.585 30.366 -5.472 1.00 36.76 O ATOM 916 CB PHE A1889 -30.701 32.874 -5.882 1.00 30.93 C ATOM 917 CG PHE A1889 -31.548 31.728 -5.400 1.00 34.19 C ATOM 918 CD1 PHE A1889 -31.869 31.604 -4.057 1.00 35.53 C ATOM 919 CD2 PHE A1889 -32.025 30.776 -6.288 1.00 31.34 C ATOM 920 CE1 PHE A1889 -32.648 30.550 -3.608 1.00 36.23 C ATOM 921 CE2 PHE A1889 -32.802 29.721 -5.847 1.00 30.55 C ATOM 922 CZ PHE A1889 -33.113 29.607 -4.504 1.00 35.85 C ATOM 923 H PHE A1889 -28.944 34.533 -6.741 1.00 0.00 H ATOM 924 N PHE A1890 -28.508 31.296 -7.524 1.00 32.61 N ATOM 925 CA PHE A1890 -28.131 30.032 -8.148 1.00 31.95 C ATOM 926 C PHE A1890 -26.764 29.566 -7.674 1.00 36.38 C ATOM 927 O PHE A1890 -26.583 28.391 -7.342 1.00 41.13 O ATOM 928 CB PHE A1890 -28.130 30.138 -9.668 1.00 30.40 C ATOM 929 CG PHE A1890 -27.401 29.003 -10.330 1.00 33.31 C ATOM 930 CD1 PHE A1890 -27.928 27.721 -10.302 1.00 32.03 C ATOM 931 CD2 PHE A1890 -26.173 29.203 -10.937 1.00 33.18 C ATOM 932 CE1 PHE A1890 -27.260 26.668 -10.888 1.00 31.47 C ATOM 933 CE2 PHE A1890 -25.498 28.149 -11.524 1.00 36.69 C ATOM 934 CZ PHE A1890 -26.045 26.880 -11.500 1.00 35.53 C ATOM 935 H PHE A1890 -28.595 32.156 -8.103 1.00 0.00 H ATOM 936 N GLU A1891 -25.775 30.459 -7.676 1.00 35.32 N ATOM 937 CA GLU A1891 -24.454 30.054 -7.208 1.00 42.17 C ATOM 938 C GLU A1891 -24.494 29.699 -5.727 1.00 45.01 C ATOM 939 O GLU A1891 -23.833 28.748 -5.286 1.00 48.34 O ATOM 940 CB GLU A1891 -23.438 31.159 -7.493 1.00 39.64 C ATOM 941 CG GLU A1891 -23.491 31.633 -8.936 1.00 42.08 C ATOM 942 CD GLU A1891 -22.144 32.052 -9.478 1.00 49.02 C ATOM 943 OE1 GLU A1891 -21.769 33.230 -9.299 1.00 51.20 O ATOM 944 OE2 GLU A1891 -21.461 31.198 -10.086 1.00 49.74 O ATOM 945 H GLU A1891 -25.942 31.431 -8.006 1.00 0.00 H ATOM 946 N SER A1892 -25.299 30.433 -4.956 1.00 41.17 N ATOM 947 CA SER A1892 -25.496 30.131 -3.544 1.00 43.46 C ATOM 948 C SER A1892 -25.965 28.691 -3.346 1.00 48.06 C ATOM 949 O SER A1892 -25.285 27.886 -2.699 1.00 50.00 O ATOM 950 CB SER A1892 -26.499 31.125 -2.949 1.00 43.71 C ATOM 951 OG SER A1892 -26.528 31.065 -1.534 1.00 50.41 O ATOM 952 HG SER A1892 -27.186 31.720 -1.191 1.00 0.00 H ATOM 953 H SER A1892 -25.800 31.243 -5.374 1.00 0.00 H ATOM 954 N ARG A1893 -27.127 28.344 -3.914 1.00 48.63 N ATOM 955 CA ARG A1893 -27.678 27.006 -3.702 1.00 50.46 C ATOM 956 C ARG A1893 -26.811 25.930 -4.351 1.00 52.43 C ATOM 957 O ARG A1893 -26.684 24.823 -3.814 1.00 58.25 O ATOM 958 CB ARG A1893 -29.111 26.928 -4.234 1.00 46.69 C ATOM 959 CG ARG A1893 -30.126 27.750 -3.448 1.00 45.94 C ATOM 960 CD ARG A1893 -30.481 27.120 -2.102 1.00 49.98 C ATOM 961 NE ARG A1893 -31.403 25.992 -2.225 1.00 49.71 N ATOM 962 CZ ARG A1893 -31.087 24.726 -1.962 1.00 55.26 C ATOM 963 NH1 ARG A1893 -29.866 24.411 -1.550 1.00 58.96 N ATOM 964 NH2 ARG A1893 -31.997 23.771 -2.105 1.00 50.03 N ATOM 965 HE ARG A1893 -32.374 26.193 -2.540 1.00 0.00 H ATOM 966 HH12 ARG A1893 -29.625 23.420 -1.346 1.00 0.00 H ATOM 967 HH11 ARG A1893 -29.149 25.155 -1.431 1.00 0.00 H ATOM 968 HH22 ARG A1893 -31.750 22.782 -1.899 1.00 0.00 H ATOM 969 HH21 ARG A1893 -32.958 24.011 -2.423 1.00 0.00 H ATOM 970 H ARG A1893 -27.639 29.028 -4.507 1.00 0.00 H ATOM 971 N TRP A1894 -26.210 26.230 -5.504 1.00 47.01 N ATOM 972 CA TRP A1894 -25.366 25.244 -6.172 1.00 49.39 C ATOM 973 C TRP A1894 -24.150 24.896 -5.326 1.00 53.71 C ATOM 974 O TRP A1894 -23.711 23.741 -5.303 1.00 56.34 O ATOM 975 CB TRP A1894 -24.930 25.761 -7.545 1.00 48.23 C ATOM 976 CG TRP A1894 -24.069 24.790 -8.318 1.00 50.74 C ATOM 977 CD1 TRP A1894 -22.710 24.669 -8.259 1.00 55.17 C ATOM 978 CD2 TRP A1894 -24.515 23.815 -9.271 1.00 49.71 C ATOM 979 NE1 TRP A1894 -22.284 23.677 -9.111 1.00 54.52 N ATOM 980 CE2 TRP A1894 -23.373 23.138 -9.743 1.00 53.29 C ATOM 981 CE3 TRP A1894 -25.769 23.447 -9.766 1.00 49.76 C ATOM 982 CZ2 TRP A1894 -23.450 22.114 -10.684 1.00 56.58 C ATOM 983 CZ3 TRP A1894 -25.842 22.432 -10.700 1.00 52.68 C ATOM 984 CH2 TRP A1894 -24.690 21.778 -11.150 1.00 54.03 C ATOM 985 HE1 TRP A1894 -21.296 23.384 -9.252 1.00 0.00 H ATOM 986 H TRP A1894 -26.343 27.170 -5.928 1.00 0.00 H ATOM 987 N GLU A1895 -23.594 25.880 -4.614 1.00 58.33 N ATOM 988 CA GLU A1895 -22.379 25.619 -3.849 1.00 58.90 C ATOM 989 C GLU A1895 -22.657 24.818 -2.582 1.00 63.32 C ATOM 990 O GLU A1895 -21.783 24.070 -2.126 1.00 65.37 O ATOM 991 CB GLU A1895 -21.673 26.934 -3.520 1.00 56.76 C ATOM 992 CG GLU A1895 -20.708 27.384 -4.611 1.00 61.52 C ATOM 993 CD GLU A1895 -20.335 28.849 -4.498 1.00 65.63 C ATOM 994 OE1 GLU A1895 -20.231 29.522 -5.550 1.00 56.56 O ATOM 995 OE2 GLU A1895 -20.157 29.331 -3.357 1.00 65.42 O ATOM 996 H GLU A1895 -24.025 26.827 -4.605 1.00 0.00 H ATOM 997 N GLU A1896 -23.855 24.938 -2.003 1.00 61.29 N ATOM 998 CA GLU A1896 -24.173 24.160 -0.812 1.00 62.58 C ATOM 999 C GLU A1896 -24.629 22.739 -1.134 1.00 66.32 C ATOM 1000 O GLU A1896 -25.290 22.104 -0.304 1.00 70.73 O ATOM 1001 CB GLU A1896 -25.220 24.877 0.046 1.00 61.21 C ATOM 1002 CG GLU A1896 -26.545 25.157 -0.622 1.00 59.00 C ATOM 1003 CD GLU A1896 -27.505 25.870 0.315 1.00 65.59 C ATOM 1004 OE1 GLU A1896 -27.662 25.412 1.469 1.00 70.61 O ATOM 1005 OE2 GLU A1896 -28.084 26.899 -0.093 1.00 63.48 O ATOM 1006 H GLU A1896 -24.562 25.588 -2.403 1.00 0.00 H ATOM 1007 N PHE A1897 -24.303 22.241 -2.326 1.00 65.56 N ATOM 1008 CA PHE A1897 -24.288 20.808 -2.600 1.00 68.37 C ATOM 1009 C PHE A1897 -22.888 20.352 -2.984 1.00 78.19 C ATOM 1010 O PHE A1897 -22.327 19.470 -2.323 1.00 81.07 O ATOM 1011 CB PHE A1897 -25.296 20.454 -3.702 1.00 68.95 C ATOM 1012 CG PHE A1897 -25.400 18.972 -3.983 1.00 80.36 C ATOM 1013 CD1 PHE A1897 -25.028 18.032 -3.028 1.00 81.68 C ATOM 1014 CD2 PHE A1897 -25.866 18.519 -5.207 1.00 82.90 C ATOM 1015 CE1 PHE A1897 -25.122 16.674 -3.291 1.00 83.86 C ATOM 1016 CE2 PHE A1897 -25.965 17.160 -5.476 1.00 85.97 C ATOM 1017 CZ PHE A1897 -25.592 16.237 -4.516 1.00 85.84 C ATOM 1018 H PHE A1897 -24.049 22.899 -3.090 1.00 0.00 H ATOM 1019 N TYR A1898 -22.298 20.936 -4.024 1.00 75.38 N ATOM 1020 CA TYR A1898 -20.951 20.579 -4.453 1.00 72.47 C ATOM 1021 C TYR A1898 -19.916 21.526 -3.847 1.00 68.00 C ATOM 1022 O TYR A1898 -19.301 21.222 -2.824 1.00 67.23 O ATOM 1023 CB TYR A1898 -20.851 20.605 -5.979 1.00 69.27 C ATOM 1024 CG TYR A1898 -22.094 20.118 -6.692 1.00 70.56 C ATOM 1025 CD1 TYR A1898 -23.101 21.004 -7.054 1.00 67.87 C ATOM 1026 CD2 TYR A1898 -22.260 18.775 -7.008 1.00 77.89 C ATOM 1027 CE1 TYR A1898 -24.241 20.567 -7.709 1.00 71.50 C ATOM 1028 CE2 TYR A1898 -23.397 18.328 -7.666 1.00 80.16 C ATOM 1029 CZ TYR A1898 -24.383 19.230 -8.016 1.00 76.21 C ATOM 1030 OH TYR A1898 -25.517 18.795 -8.668 1.00 68.79 O ATOM 1031 HH TYR A1898 -26.113 19.566 -8.841 1.00 0.00 H ATOM 1032 H TYR A1898 -22.815 21.671 -4.548 1.00 0.00 H TER 1033 TYR A1898 HETATM 1034 O HOH 1 -30.929 37.692 -21.579 1.00 23.68 O HETATM 1035 O HOH 2 -40.033 26.408 -16.208 1.00 30.55 O HETATM 1036 O HOH 3 -31.844 34.070 -23.135 1.00 29.59 O HETATM 1037 O HOH 4 -36.064 34.955 -20.413 1.00 24.28 O HETATM 1038 O HOH 5 -40.039 20.280 -8.753 1.00 30.72 O HETATM 1039 O HOH 6 -30.978 35.878 -19.582 1.00 26.33 O HETATM 1040 O HOH 7 -41.304 32.773 -10.220 1.00 21.03 O HETATM 1041 O HOH 8 -40.222 35.391 -18.738 1.00 26.01 O HETATM 1042 O HOH 9 -33.301 34.489 -20.493 1.00 29.44 O HETATM 1043 O HOH 10 -40.833 38.482 -19.181 1.00 29.57 O HETATM 1044 O HOH 11 -34.499 33.674 -24.347 1.00 27.26 O HETATM 1045 O HOH 12 -27.317 43.045 -15.991 1.00 26.72 O HETATM 1046 O HOH 13 -39.952 38.780 -23.882 1.00 33.68 O HETATM 1047 O HOH 14 -46.694 34.391 -34.961 1.00 40.96 O HETATM 1048 O HOH 15 -27.865 40.831 -14.420 1.00 21.13 O HETATM 1049 O HOH 16 -38.305 34.137 -3.458 1.00 30.25 O HETATM 1050 C01 EN A 2 -33.715 37.718 -19.854 1.00 0.02 C HETATM 1051 N02 EN A 2 -34.311 38.936 -20.369 1.00 -0.27 N HETATM 1052 C03 EN A 2 -35.741 39.222 -20.103 1.00 0.05 C HETATM 1053 C04 EN A 2 -36.371 40.501 -20.637 1.00 0.07 C HETATM 1054 C05 EN A 2 -35.558 41.465 -21.433 1.00 -0.01 C HETATM 1055 C06 EN A 2 -34.120 41.172 -21.697 1.00 0.04 C HETATM 1056 C07 EN A 2 -33.491 39.890 -21.157 1.00 0.18 C HETATM 1057 O08 EN A 2 -32.350 39.651 -21.366 1.00 -0.40 O HETATM 1058 H9 EN A 2 -33.543 42.010 -21.278 1.00 0.05 H HETATM 1059 H10 EN A 2 -33.995 41.151 -22.790 1.00 0.05 H HETATM 1060 H7 EN A 2 -35.596 42.429 -20.904 1.00 0.03 H HETATM 1061 H8 EN A 2 -36.049 41.565 -22.412 1.00 0.03 H HETATM 1062 C09 EN A 2 -37.842 40.775 -20.357 1.00 0.18 C HETATM 1063 N11 EN A 2 -38.449 42.027 -20.783 1.00 -0.29 N HETATM 1064 C12 EN A 2 -39.851 42.312 -20.531 1.00 0.03 C HETATM 1065 C13 EN A 2 -40.754 41.254 -21.169 1.00 -0.01 C HETATM 1066 C14 EN A 2 -41.278 41.645 -22.546 1.00 0.03 C HETATM 1067 N15 EN A 2 -42.728 41.723 -22.477 1.00 -0.29 N HETATM 1068 C16 EN A 2 -43.559 42.825 -22.961 1.00 0.20 C HETATM 1069 C18 EN A 2 -43.044 44.106 -23.642 1.00 0.05 C HETATM 1070 C19 EN A 2 -41.877 44.145 -24.391 1.00 -0.04 C HETATM 1071 C20 EN A 2 -41.462 45.321 -24.989 1.00 -0.02 C HETATM 1072 C21 EN A 2 -42.214 46.474 -24.862 1.00 0.14 C HETATM 1073 C23 EN A 2 -43.388 46.449 -24.125 1.00 -0.02 C HETATM 1074 C24 EN A 2 -43.799 45.267 -23.524 1.00 -0.04 C HETATM 1075 H20 EN A 2 -44.721 45.249 -22.955 1.00 0.07 H HETATM 1076 H19 EN A 2 -43.983 47.349 -24.018 1.00 0.06 H HETATM 1077 F22 EN A 2 -41.787 47.624 -25.464 1.00 -0.18 F HETATM 1078 H18 EN A 2 -40.541 45.339 -25.561 1.00 0.06 H HETATM 1079 H17 EN A 2 -41.285 43.245 -24.509 1.00 0.07 H HETATM 1080 O17 EN A 2 -44.730 42.717 -22.810 1.00 -0.39 O HETATM 1081 H22 EN A 2 -43.203 40.949 -22.058 1.00 0.18 H HETATM 1082 H15 EN A 2 -40.981 40.887 -23.286 1.00 0.05 H HETATM 1083 H16 EN A 2 -40.866 42.623 -22.837 1.00 0.05 H HETATM 1084 H13 EN A 2 -41.615 41.086 -20.505 1.00 0.03 H HETATM 1085 H14 EN A 2 -40.179 40.321 -21.268 1.00 0.03 H HETATM 1086 H11 EN A 2 -40.025 42.325 -19.445 1.00 0.05 H HETATM 1087 H12 EN A 2 -40.099 43.297 -20.953 1.00 0.05 H HETATM 1088 H21 EN A 2 -37.889 42.705 -21.259 1.00 0.19 H HETATM 1089 O10 EN A 2 -38.470 39.947 -19.794 1.00 -0.40 O HETATM 1090 H6 EN A 2 -36.093 41.030 -19.713 1.00 0.06 H HETATM 1091 H4 EN A 2 -36.316 38.384 -20.524 1.00 0.06 H HETATM 1092 H5 EN A 2 -35.864 39.239 -19.010 1.00 0.06 H HETATM 1093 H1 EN A 2 -34.473 37.144 -19.301 1.00 0.05 H HETATM 1094 H2 EN A 2 -32.884 37.973 -19.180 1.00 0.05 H HETATM 1095 H3 EN A 2 -33.336 37.113 -20.691 1.00 0.05 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 1050 1051 1093 1094 1095 CONECT 1051 1050 1052 1056 CONECT 1052 1051 1053 1091 1092 CONECT 1053 1052 1054 1062 1090 CONECT 1054 1053 1055 1060 1061 CONECT 1055 1054 1056 1058 1059 CONECT 1056 1051 1055 1057 CONECT 1057 1056 CONECT 1058 1055 CONECT 1059 1055 CONECT 1060 1054 CONECT 1061 1054 CONECT 1062 1053 1063 1089 CONECT 1063 1062 1064 1088 CONECT 1064 1063 1065 1086 1087 CONECT 1065 1064 1066 1084 1085 CONECT 1066 1065 1067 1082 1083 CONECT 1067 1066 1068 1081 CONECT 1068 1067 1069 1080 CONECT 1069 1068 1070 1074 CONECT 1070 1069 1071 1079 CONECT 1071 1070 1072 1078 CONECT 1072 1071 1073 1077 CONECT 1073 1072 1074 1076 CONECT 1074 1069 1073 1075 CONECT 1075 1074 CONECT 1076 1073 CONECT 1077 1072 CONECT 1078 1071 CONECT 1079 1070 CONECT 1080 1068 CONECT 1081 1067 CONECT 1082 1066 CONECT 1083 1066 CONECT 1084 1065 CONECT 1085 1065 CONECT 1086 1064 CONECT 1087 1064 CONECT 1088 1063 CONECT 1089 1062 CONECT 1090 1053 CONECT 1091 1052 CONECT 1092 1052 CONECT 1093 1050 CONECT 1094 1050 CONECT 1095 1050 MASTER 0 0 0 0 0 0 0 0 1094 1 50 8 END
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Structure:
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Related entries of code: 6fgf
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4qbm
RCSB PDB
PDBbind
106aa, >4QBM_1|Chains... *
5mgj
RCSB PDB
PDBbind
105aa, >5MGJ_1|Chain... at 100%
5mgk
RCSB PDB
PDBbind
105aa, >5MGK_1|Chain... at 100%
5mgl
RCSB PDB
PDBbind
105aa, >5MGL_1|Chain... at 100%
5mgm
RCSB PDB
PDBbind
105aa, >5MGM_1|Chain... at 100%
6fg6
RCSB PDB
PDBbind
105aa, >6FG6_1|Chain... at 100%
6fgg
RCSB PDB
PDBbind
106aa, >6FGG_1|Chain... at 100%
6fgl
RCSB PDB
PDBbind
105aa, >6FGL_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
6fh7
RCSB PDB
PDBbind
EN2
Entry Information
PDB ID
6fgf
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
BAZ2A bromodomain
Ligand Name
EN2
EC.Number
E.C.-.-.-.-
Resolution
2.8(Å)
Affinity (Kd/Ki/IC50)
Kd=110uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) ChemMedChem Vol. 13: pp. 1479-1487
Ligand Properties
Formula
C
1
7
H
2
2
FN
3
O
3
Molecular Weight
335.373
Exact Mass
335.165
No. of atoms
46
No. of bonds
47
Polar Surface Area
78.51
LOGP Value
0.50 (
Computed with XLOGP3
)
1.65 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 2
Canonical SMILES
Fc1ccc(cc1)C(=O)NCCCNC(=O)[C@@H]1CCC(=O)N(C1)C
InChI String
InChI=1S/C17H22FN3O3/c1-21-11-13(5-8-15(21)22)17(24)20-10-2-9-19-16(23)12-3-6-14(18)7-4-12/h3-4,6-7,13H,2,5,8-11H2,1H3,(H,19,23)(H,20,24)/t13-/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):
Q9UIF9
Entrez Gene ID
NCBI Entrez Gene ID:
11176
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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