Browse entries in the PDBbind-CN Database
HEADER 4UDB_COMPLEX COMPND 4UDB_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 19 SER PRO VAL MET VAL LEU GLU ASN ILE GLU PRO GLU ILE SEQRES 2 A 19 VAL TYR ALA GLY TYR ASP SEQRES 1 A 225 PRO ASP THR ALA GLU ASN LEU LEU SER THR LEU ASN ARG SEQRES 2 A 225 LEU ALA GLY LYS GLN MET ILE GLN VAL VAL LYS TRP ALA SEQRES 3 A 225 LYS VAL LEU PRO GLY PHE LYS ASN LEU PRO LEU GLU ASP SEQRES 4 A 225 GLN ILE THR LEU ILE GLN TYR SER TRP MET SER LEU LEU SEQRES 5 A 225 SER PHE ALA LEU SER TRP ARG SER TYR LYS HIS THR ASN SEQRES 6 A 225 SER GLN PHE LEU TYR PHE ALA PRO ASP LEU VAL PHE ASN SEQRES 7 A 225 GLU GLU LYS MET HIS GLN SER ALA MET TYR GLU LEU CYS SEQRES 8 A 225 GLN GLY MET HIS GLN ILE SER LEU GLN PHE VAL ARG LEU SEQRES 9 A 225 GLN LEU THR PHE GLU GLU TYR THR ILE MET LYS VAL LEU SEQRES 10 A 225 LEU LEU LEU SER THR ILE PRO LYS ASP GLY LEU LYS SER SEQRES 11 A 225 GLN ALA ALA PHE GLU GLU MET ARG THR ASN TYR ILE LYS SEQRES 12 A 225 GLU LEU ARG LYS MET VAL THR LYS SER PRO ASN ASN SER SEQRES 13 A 225 GLY GLN SER TRP GLN ARG PHE TYR GLN LEU THR LYS LEU SEQRES 14 A 225 LEU ASP SER MET HIS ASP LEU VAL SER ASP LEU LEU GLU SEQRES 15 A 225 PHE CYS PHE TYR THR PHE ARG GLU SER HIS ALA LEU LYS SEQRES 16 A 225 VAL GLU PHE PRO ALA MET LEU VAL GLU ILE ILE SER ASP SEQRES 17 A 225 GLN LEU PRO LYS VAL GLU SER GLY ASN ALA LYS PRO LEU SEQRES 18 A 225 TYR PHE HIS ARG HET CV A 7 72 ATOM 1 N SER A 737 -16.849 34.810 -0.696 1.00 87.00 N ATOM 2 CA SER A 737 -17.784 33.986 0.077 1.00 86.34 C ATOM 3 C SER A 737 -18.332 32.778 -0.731 1.00 86.93 C ATOM 4 O SER A 737 -19.104 32.966 -1.682 1.00 85.89 O ATOM 5 CB SER A 737 -18.922 34.835 0.643 1.00 90.63 C ATOM 6 OG SER A 737 -19.788 34.069 1.465 1.00101.18 O ATOM 7 HG SER A 737 -20.510 34.650 1.813 1.00 0.00 H ATOM 8 HN3 SER A 737 -17.332 35.183 -1.538 1.00 0.00 H ATOM 9 HN2 SER A 737 -16.038 34.229 -0.989 1.00 0.00 H ATOM 10 HN1 SER A 737 -16.516 35.600 -0.107 1.00 0.00 H ATOM 11 N PRO A 738 -17.959 31.531 -0.345 1.00 81.48 N ATOM 12 CA PRO A 738 -18.460 30.354 -1.078 1.00 80.41 C ATOM 13 C PRO A 738 -19.922 30.000 -0.788 1.00 80.29 C ATOM 14 O PRO A 738 -20.529 29.265 -1.563 1.00 78.65 O ATOM 15 CB PRO A 738 -17.503 29.238 -0.648 1.00 82.37 C ATOM 16 CG PRO A 738 -17.056 29.629 0.701 1.00 87.01 C ATOM 17 CD PRO A 738 -17.052 31.133 0.752 1.00 82.84 C ATOM 18 N VAL A 739 -20.477 30.539 0.313 1.00 75.34 N ATOM 19 CA VAL A 739 -21.848 30.341 0.796 1.00 74.89 C ATOM 20 C VAL A 739 -22.879 30.622 -0.298 1.00 78.99 C ATOM 21 O VAL A 739 -23.790 29.813 -0.495 1.00 77.84 O ATOM 22 CB VAL A 739 -22.122 31.174 2.080 1.00 78.72 C ATOM 23 CG1 VAL A 739 -23.446 30.784 2.719 1.00 78.26 C ATOM 24 CG2 VAL A 739 -20.981 31.036 3.087 1.00 78.57 C ATOM 25 H VAL A 739 -19.869 31.162 0.882 1.00 0.00 H ATOM 26 N MET A 740 -22.718 31.757 -1.016 1.00 77.06 N ATOM 27 CA MET A 740 -23.583 32.178 -2.128 1.00 77.37 C ATOM 28 C MET A 740 -23.538 31.142 -3.271 1.00 78.06 C ATOM 29 O MET A 740 -24.602 30.744 -3.770 1.00 77.59 O ATOM 30 CB MET A 740 -23.183 33.573 -2.639 1.00 80.68 C ATOM 31 CG MET A 740 -23.336 34.677 -1.599 1.00 85.95 C ATOM 32 SD MET A 740 -23.387 36.360 -2.298 1.00 91.65 S ATOM 33 CE MET A 740 -25.080 36.407 -2.928 1.00 88.19 C ATOM 34 H MET A 740 -21.923 32.378 -0.763 1.00 0.00 H ATOM 35 N VAL A 741 -22.303 30.680 -3.642 1.00 71.22 N ATOM 36 CA VAL A 741 -22.032 29.655 -4.669 1.00 69.59 C ATOM 37 C VAL A 741 -22.676 28.317 -4.245 1.00 69.75 C ATOM 38 O VAL A 741 -23.338 27.681 -5.065 1.00 68.69 O ATOM 39 CB VAL A 741 -20.505 29.489 -4.947 1.00 73.92 C ATOM 40 CG1 VAL A 741 -20.226 28.352 -5.936 1.00 73.71 C ATOM 41 CG2 VAL A 741 -19.874 30.794 -5.434 1.00 73.80 C ATOM 42 H VAL A 741 -21.480 31.089 -3.155 1.00 0.00 H ATOM 43 N LEU A 742 -22.490 27.918 -2.960 1.00 64.07 N ATOM 44 CA LEU A 742 -23.015 26.686 -2.357 1.00 63.10 C ATOM 45 C LEU A 742 -24.541 26.553 -2.455 1.00 65.15 C ATOM 46 O LEU A 742 -25.038 25.463 -2.771 1.00 64.13 O ATOM 47 CB LEU A 742 -22.534 26.516 -0.899 1.00 63.02 C ATOM 48 CG LEU A 742 -21.030 26.255 -0.679 1.00 67.60 C ATOM 49 CD1 LEU A 742 -20.693 26.180 0.798 1.00 67.20 C ATOM 50 CD2 LEU A 742 -20.588 24.991 -1.345 1.00 71.22 C ATOM 51 H LEU A 742 -21.925 28.541 -2.348 1.00 0.00 H ATOM 52 N GLU A 743 -25.278 27.654 -2.217 1.00 61.51 N ATOM 53 CA GLU A 743 -26.738 27.648 -2.334 1.00 62.29 C ATOM 54 C GLU A 743 -27.150 27.417 -3.809 1.00 67.92 C ATOM 55 O GLU A 743 -28.087 26.658 -4.073 1.00 67.57 O ATOM 56 CB GLU A 743 -27.344 28.951 -1.781 1.00 63.77 C ATOM 57 CG GLU A 743 -28.863 29.020 -1.913 1.00 77.53 C ATOM 58 CD GLU A 743 -29.606 30.166 -1.248 1.00104.69 C ATOM 59 OE1 GLU A 743 -28.973 30.971 -0.524 1.00105.50 O ATOM 60 OE2 GLU A 743 -30.842 30.236 -1.435 1.00 97.58 O ATOM 61 H GLU A 743 -24.797 28.534 -1.942 1.00 0.00 H ATOM 62 N ASN A 744 -26.404 28.024 -4.751 1.00 65.49 N ATOM 63 CA ASN A 744 -26.671 27.936 -6.188 1.00 66.32 C ATOM 64 C ASN A 744 -26.479 26.550 -6.803 1.00 69.74 C ATOM 65 O ASN A 744 -27.308 26.138 -7.624 1.00 69.39 O ATOM 66 CB ASN A 744 -25.835 28.975 -6.959 1.00 69.50 C ATOM 67 CG ASN A 744 -26.150 30.421 -6.624 1.00 96.33 C ATOM 68 OD1 ASN A 744 -27.108 30.745 -5.898 1.00 85.55 O ATOM 69 ND2 ASN A 744 -25.339 31.330 -7.153 1.00 92.04 N ATOM 70 HD22 ASN A 744 -24.546 31.031 -7.756 1.00 0.00 H ATOM 71 HD21 ASN A 744 -25.497 32.340 -6.964 1.00 0.00 H ATOM 72 H ASN A 744 -25.589 28.590 -4.439 1.00 0.00 H ATOM 73 N ILE A 745 -25.386 25.850 -6.422 1.00 65.38 N ATOM 74 CA ILE A 745 -24.974 24.541 -6.964 1.00 64.44 C ATOM 75 C ILE A 745 -25.613 23.336 -6.254 1.00 68.61 C ATOM 76 O ILE A 745 -25.336 22.192 -6.629 1.00 66.36 O ATOM 77 CB ILE A 745 -23.425 24.421 -7.001 1.00 66.68 C ATOM 78 CG1 ILE A 745 -22.819 24.337 -5.569 1.00 66.24 C ATOM 79 CG2 ILE A 745 -22.813 25.557 -7.854 1.00 66.38 C ATOM 80 CD1 ILE A 745 -21.361 23.905 -5.496 1.00 69.35 C ATOM 81 H ILE A 745 -24.785 26.270 -5.684 1.00 0.00 H ATOM 82 N GLU A 746 -26.467 23.597 -5.244 1.00 67.48 N ATOM 83 CA GLU A 746 -27.150 22.568 -4.465 1.00 67.81 C ATOM 84 C GLU A 746 -28.017 21.645 -5.342 1.00 73.11 C ATOM 85 O GLU A 746 -28.859 22.135 -6.103 1.00 73.30 O ATOM 86 CB GLU A 746 -27.952 23.191 -3.298 1.00 69.15 C ATOM 87 CG GLU A 746 -28.661 22.200 -2.376 1.00 76.18 C ATOM 88 CD GLU A 746 -27.798 21.266 -1.547 1.00 90.33 C ATOM 89 OE1 GLU A 746 -26.556 21.422 -1.563 1.00 71.02 O ATOM 90 OE2 GLU A 746 -28.364 20.348 -0.910 1.00 94.68 O ATOM 91 H GLU A 746 -26.651 24.592 -5.005 1.00 0.00 H ATOM 92 N PRO A 747 -27.794 20.310 -5.263 1.00 69.90 N ATOM 93 CA PRO A 747 -28.594 19.379 -6.077 1.00 69.83 C ATOM 94 C PRO A 747 -30.094 19.394 -5.764 1.00 74.06 C ATOM 95 O PRO A 747 -30.505 19.672 -4.629 1.00 72.94 O ATOM 96 CB PRO A 747 -27.990 18.009 -5.734 1.00 71.29 C ATOM 97 CG PRO A 747 -26.646 18.292 -5.168 1.00 75.63 C ATOM 98 CD PRO A 747 -26.816 19.576 -4.431 1.00 71.23 C ATOM 99 N GLU A 748 -30.907 19.090 -6.785 1.00 71.51 N ATOM 100 CA GLU A 748 -32.361 18.994 -6.656 1.00 71.67 C ATOM 101 C GLU A 748 -32.711 17.575 -6.147 1.00 74.33 C ATOM 102 O GLU A 748 -31.857 16.682 -6.174 1.00 72.74 O ATOM 103 CB GLU A 748 -33.055 19.290 -8.005 1.00 73.47 C ATOM 104 CG GLU A 748 -32.792 20.686 -8.558 1.00 89.14 C ATOM 105 CD GLU A 748 -33.629 21.815 -7.984 1.00117.73 C ATOM 106 OE1 GLU A 748 -33.276 22.327 -6.897 1.00111.43 O ATOM 107 OE2 GLU A 748 -34.614 22.218 -8.645 1.00119.92 O ATOM 108 H GLU A 748 -30.482 18.913 -7.718 1.00 0.00 H ATOM 109 N ILE A 749 -33.950 17.377 -5.669 1.00 70.86 N ATOM 110 CA ILE A 749 -34.410 16.091 -5.138 1.00 70.56 C ATOM 111 C ILE A 749 -34.588 15.021 -6.240 1.00 74.46 C ATOM 112 O ILE A 749 -35.006 15.339 -7.357 1.00 74.84 O ATOM 113 CB ILE A 749 -35.686 16.278 -4.268 1.00 73.68 C ATOM 114 CG1 ILE A 749 -35.930 15.061 -3.348 1.00 73.58 C ATOM 115 CG2 ILE A 749 -36.932 16.636 -5.118 1.00 75.30 C ATOM 116 CD1 ILE A 749 -36.492 15.397 -2.046 1.00 79.21 C ATOM 117 H ILE A 749 -34.616 18.176 -5.676 1.00 0.00 H ATOM 118 N VAL A 750 -34.258 13.756 -5.909 1.00 69.71 N ATOM 119 CA VAL A 750 -34.423 12.600 -6.795 1.00 68.51 C ATOM 120 C VAL A 750 -35.410 11.593 -6.181 1.00 69.24 C ATOM 121 O VAL A 750 -35.439 11.409 -4.958 1.00 66.87 O ATOM 122 CB VAL A 750 -33.094 11.936 -7.268 1.00 72.53 C ATOM 123 CG1 VAL A 750 -32.286 12.873 -8.152 1.00 72.58 C ATOM 124 CG2 VAL A 750 -32.255 11.470 -6.100 1.00 72.45 C ATOM 125 H VAL A 750 -33.860 13.590 -4.963 1.00 0.00 H ATOM 126 N TYR A 751 -36.212 10.950 -7.043 1.00 65.36 N ATOM 127 CA TYR A 751 -37.217 9.964 -6.651 1.00 64.96 C ATOM 128 C TYR A 751 -36.638 8.558 -6.647 1.00 72.19 C ATOM 129 O TYR A 751 -35.694 8.275 -7.385 1.00 71.72 O ATOM 130 CB TYR A 751 -38.457 10.065 -7.559 1.00 64.94 C ATOM 131 CG TYR A 751 -39.291 11.300 -7.297 1.00 65.04 C ATOM 132 CD1 TYR A 751 -38.865 12.557 -7.719 1.00 66.24 C ATOM 133 CD2 TYR A 751 -40.514 11.213 -6.639 1.00 65.94 C ATOM 134 CE1 TYR A 751 -39.613 13.702 -7.453 1.00 66.54 C ATOM 135 CE2 TYR A 751 -41.285 12.349 -6.390 1.00 66.74 C ATOM 136 CZ TYR A 751 -40.827 13.593 -6.793 1.00 74.56 C ATOM 137 OH TYR A 751 -41.576 14.721 -6.541 1.00 76.87 O ATOM 138 HH TYR A 751 -41.103 15.516 -6.894 1.00 0.00 H ATOM 139 H TYR A 751 -36.112 11.167 -8.055 1.00 0.00 H ATOM 140 N ALA A 752 -37.178 7.689 -5.781 1.00 71.86 N ATOM 141 CA ALA A 752 -36.737 6.304 -5.631 1.00 73.23 C ATOM 142 C ALA A 752 -37.353 5.361 -6.670 1.00 81.16 C ATOM 143 O ALA A 752 -36.689 4.424 -7.112 1.00 80.75 O ATOM 144 CB ALA A 752 -37.065 5.807 -4.230 1.00 73.83 C ATOM 145 H ALA A 752 -37.959 8.021 -5.179 1.00 0.00 H ATOM 146 N GLY A 753 -38.618 5.609 -7.014 1.00 80.73 N ATOM 147 CA GLY A 753 -39.426 4.785 -7.902 1.00 82.01 C ATOM 148 C GLY A 753 -39.820 3.511 -7.182 1.00 90.25 C ATOM 149 O GLY A 753 -39.659 2.419 -7.738 1.00 90.54 O ATOM 150 H GLY A 753 -39.063 6.460 -6.615 1.00 0.00 H ATOM 151 N TYR A 754 -40.299 3.642 -5.910 1.00 89.01 N ATOM 152 CA TYR A 754 -40.659 2.506 -5.053 1.00 89.92 C ATOM 153 C TYR A 754 -41.882 1.723 -5.563 1.00 95.93 C ATOM 154 O TYR A 754 -42.855 2.332 -6.025 1.00 95.72 O ATOM 155 CB TYR A 754 -40.822 2.928 -3.575 1.00 91.27 C ATOM 156 CG TYR A 754 -40.683 1.786 -2.581 1.00 93.75 C ATOM 157 CD1 TYR A 754 -39.730 0.784 -2.765 1.00 96.07 C ATOM 158 CD2 TYR A 754 -41.469 1.733 -1.432 1.00 94.50 C ATOM 159 CE1 TYR A 754 -39.599 -0.270 -1.859 1.00 96.94 C ATOM 160 CE2 TYR A 754 -41.339 0.689 -0.512 1.00 95.43 C ATOM 161 CZ TYR A 754 -40.403 -0.311 -0.732 1.00104.46 C ATOM 162 OH TYR A 754 -40.263 -1.349 0.162 1.00107.46 O ATOM 163 HH TYR A 754 -39.554 -1.963 -0.155 1.00 0.00 H ATOM 164 H TYR A 754 -40.415 4.602 -5.526 1.00 0.00 H ATOM 165 N ASP A 755 -41.789 0.361 -5.484 1.00 93.07 N ATOM 166 CA ASP A 755 -42.734 -0.696 -5.911 1.00125.71 C ATOM 167 C ASP A 755 -44.113 -0.213 -6.392 1.00154.24 C ATOM 168 O ASP A 755 -44.754 -0.892 -7.195 1.00114.41 O ATOM 169 CB ASP A 755 -42.912 -1.777 -4.817 1.00127.49 C ATOM 170 CG ASP A 755 -43.307 -1.301 -3.424 1.00136.26 C ATOM 171 OD1 ASP A 755 -44.158 -0.385 -3.321 1.00136.62 O ATOM 172 OD2 ASP A 755 -42.834 -1.907 -2.435 1.00140.79 O ATOM 173 H ASP A 755 -40.910 0.010 -5.053 1.00 0.00 H TER 174 ASP A 755 ATOM 175 N PRO A 759 -42.623 -5.319 -3.658 1.00 98.43 N ATOM 176 CA PRO A 759 -42.811 -6.623 -2.995 1.00 97.99 C ATOM 177 C PRO A 759 -42.601 -6.580 -1.475 1.00 99.73 C ATOM 178 O PRO A 759 -42.908 -7.558 -0.785 1.00 99.43 O ATOM 179 CB PRO A 759 -41.818 -7.539 -3.716 1.00 99.95 C ATOM 180 CG PRO A 759 -41.638 -6.912 -5.062 1.00104.51 C ATOM 181 CD PRO A 759 -41.789 -5.427 -4.870 1.00100.08 C ATOM 182 HN2 PRO A 759 -42.163 -4.667 -2.991 1.00 0.00 H ATOM 183 HN1 PRO A 759 -43.554 -4.941 -3.924 1.00 0.00 H ATOM 184 N ASP A 760 -42.086 -5.434 -0.968 1.00 93.84 N ATOM 185 CA ASP A 760 -41.835 -5.082 0.437 1.00 92.27 C ATOM 186 C ASP A 760 -40.956 -6.091 1.223 1.00 90.16 C ATOM 187 O ASP A 760 -41.348 -6.535 2.305 1.00 90.14 O ATOM 188 CB ASP A 760 -43.166 -4.815 1.174 1.00 94.89 C ATOM 189 CG ASP A 760 -43.148 -3.625 2.126 1.00110.31 C ATOM 190 OD1 ASP A 760 -42.286 -3.603 3.037 1.00111.03 O ATOM 191 OD2 ASP A 760 -44.041 -2.753 2.005 1.00118.32 O ATOM 192 H ASP A 760 -41.835 -4.706 -1.666 1.00 0.00 H ATOM 193 N THR A 761 -39.751 -6.405 0.707 1.00 81.57 N ATOM 194 CA THR A 761 -38.790 -7.295 1.393 1.00 78.77 C ATOM 195 C THR A 761 -37.499 -6.534 1.697 1.00 76.09 C ATOM 196 O THR A 761 -37.278 -5.470 1.114 1.00 75.17 O ATOM 197 CB THR A 761 -38.491 -8.581 0.589 1.00 83.67 C ATOM 198 OG1 THR A 761 -37.903 -8.248 -0.669 1.00 78.29 O ATOM 199 CG2 THR A 761 -39.713 -9.473 0.404 1.00 83.18 C ATOM 200 HG1 THR A 761 -38.529 -7.680 -1.185 1.00 0.00 H ATOM 201 H THR A 761 -39.485 -6.003 -0.215 1.00 0.00 H ATOM 202 N ALA A 762 -36.641 -7.081 2.585 1.00 68.45 N ATOM 203 CA ALA A 762 -35.364 -6.455 2.937 1.00 66.81 C ATOM 204 C ALA A 762 -34.452 -6.257 1.703 1.00 66.79 C ATOM 205 O ALA A 762 -33.989 -5.140 1.482 1.00 65.54 O ATOM 206 CB ALA A 762 -34.654 -7.257 4.015 1.00 67.48 C ATOM 207 H ALA A 762 -36.897 -7.982 3.037 1.00 0.00 H ATOM 208 N GLU A 763 -34.274 -7.308 0.869 1.00 60.89 N ATOM 209 CA GLU A 763 -33.458 -7.277 -0.352 1.00 60.05 C ATOM 210 C GLU A 763 -33.986 -6.296 -1.409 1.00 59.50 C ATOM 211 O GLU A 763 -33.175 -5.709 -2.130 1.00 57.73 O ATOM 212 CB GLU A 763 -33.215 -8.681 -0.957 1.00 61.94 C ATOM 213 CG GLU A 763 -34.450 -9.548 -1.187 1.00 76.85 C ATOM 214 CD GLU A 763 -35.063 -10.267 0.008 1.00102.77 C ATOM 215 OE1 GLU A 763 -34.488 -10.219 1.122 1.00 81.08 O ATOM 216 OE2 GLU A 763 -36.140 -10.878 -0.176 1.00106.48 O ATOM 217 H GLU A 763 -34.749 -8.201 1.110 1.00 0.00 H ATOM 218 N ASN A 764 -35.318 -6.082 -1.479 1.00 53.78 N ATOM 219 CA ASN A 764 -35.886 -5.120 -2.423 1.00 52.79 C ATOM 220 C ASN A 764 -35.737 -3.696 -1.895 1.00 54.80 C ATOM 221 O ASN A 764 -35.469 -2.776 -2.670 1.00 53.90 O ATOM 222 CB ASN A 764 -37.339 -5.442 -2.772 1.00 55.77 C ATOM 223 CG ASN A 764 -37.530 -6.753 -3.520 1.00 95.25 C ATOM 224 OD1 ASN A 764 -38.452 -7.528 -3.226 1.00101.04 O ATOM 225 ND2 ASN A 764 -36.675 -7.042 -4.504 1.00 82.09 N ATOM 226 HD22 ASN A 764 -35.907 -6.380 -4.737 1.00 0.00 H ATOM 227 HD21 ASN A 764 -36.777 -7.929 -5.037 1.00 0.00 H ATOM 228 H ASN A 764 -35.953 -6.612 -0.849 1.00 0.00 H ATOM 229 N LEU A 765 -35.882 -3.511 -0.573 1.00 49.49 N ATOM 230 CA LEU A 765 -35.688 -2.202 0.016 1.00 48.22 C ATOM 231 C LEU A 765 -34.234 -1.763 -0.191 1.00 52.29 C ATOM 232 O LEU A 765 -34.006 -0.646 -0.669 1.00 53.28 O ATOM 233 CB LEU A 765 -36.032 -2.180 1.511 1.00 47.51 C ATOM 234 CG LEU A 765 -35.778 -0.821 2.190 1.00 51.82 C ATOM 235 CD1 LEU A 765 -36.617 0.305 1.545 1.00 51.17 C ATOM 236 CD2 LEU A 765 -35.992 -0.902 3.684 1.00 54.45 C ATOM 237 H LEU A 765 -36.136 -4.316 0.034 1.00 0.00 H ATOM 238 N LEU A 766 -33.271 -2.645 0.167 1.00 46.26 N ATOM 239 CA LEU A 766 -31.846 -2.383 0.050 1.00 45.33 C ATOM 240 C LEU A 766 -31.425 -2.082 -1.399 1.00 48.86 C ATOM 241 O LEU A 766 -30.709 -1.099 -1.622 1.00 48.76 O ATOM 242 CB LEU A 766 -31.014 -3.514 0.680 1.00 44.91 C ATOM 243 CG LEU A 766 -31.216 -3.779 2.193 1.00 48.75 C ATOM 244 CD1 LEU A 766 -30.137 -4.677 2.728 1.00 48.02 C ATOM 245 CD2 LEU A 766 -31.269 -2.482 3.012 1.00 51.56 C ATOM 246 H LEU A 766 -33.569 -3.565 0.549 1.00 0.00 H ATOM 247 N SER A 767 -31.936 -2.876 -2.378 1.00 43.32 N ATOM 248 CA SER A 767 -31.684 -2.699 -3.814 1.00 42.09 C ATOM 249 C SER A 767 -32.218 -1.373 -4.305 1.00 44.55 C ATOM 250 O SER A 767 -31.558 -0.712 -5.112 1.00 43.55 O ATOM 251 CB SER A 767 -32.302 -3.837 -4.623 1.00 43.67 C ATOM 252 OG SER A 767 -31.600 -5.049 -4.402 1.00 48.64 O ATOM 253 HG SER A 767 -31.640 -5.281 -3.440 1.00 0.00 H ATOM 254 H SER A 767 -32.549 -3.665 -2.089 1.00 0.00 H ATOM 255 N THR A 768 -33.415 -0.985 -3.835 1.00 41.58 N ATOM 256 CA THR A 768 -34.044 0.297 -4.209 1.00 41.60 C ATOM 257 C THR A 768 -33.212 1.463 -3.687 1.00 45.32 C ATOM 258 O THR A 768 -32.984 2.420 -4.431 1.00 46.26 O ATOM 259 CB THR A 768 -35.492 0.370 -3.706 1.00 46.20 C ATOM 260 OG1 THR A 768 -36.213 -0.679 -4.320 1.00 45.43 O ATOM 261 CG2 THR A 768 -36.168 1.677 -4.051 1.00 43.10 C ATOM 262 HG1 THR A 768 -35.805 -1.547 -4.073 1.00 0.00 H ATOM 263 H THR A 768 -33.920 -1.615 -3.180 1.00 0.00 H ATOM 264 N LEU A 769 -32.764 1.375 -2.408 1.00 40.08 N ATOM 265 CA LEU A 769 -31.940 2.388 -1.755 1.00 39.02 C ATOM 266 C LEU A 769 -30.614 2.546 -2.474 1.00 41.72 C ATOM 267 O LEU A 769 -30.193 3.682 -2.721 1.00 42.02 O ATOM 268 CB LEU A 769 -31.716 2.058 -0.279 1.00 38.79 C ATOM 269 CG LEU A 769 -32.934 2.192 0.628 1.00 43.85 C ATOM 270 CD1 LEU A 769 -32.624 1.713 2.019 1.00 43.29 C ATOM 271 CD2 LEU A 769 -33.440 3.615 0.674 1.00 45.86 C ATOM 272 H LEU A 769 -33.025 0.532 -1.858 1.00 0.00 H ATOM 273 N ASN A 770 -29.983 1.412 -2.849 1.00 35.84 N ATOM 274 CA ASN A 770 -28.724 1.407 -3.582 1.00 35.90 C ATOM 275 C ASN A 770 -28.868 2.044 -4.967 1.00 42.55 C ATOM 276 O ASN A 770 -28.016 2.844 -5.337 1.00 43.16 O ATOM 277 CB ASN A 770 -28.128 0.006 -3.650 1.00 35.71 C ATOM 278 CG ASN A 770 -27.548 -0.475 -2.332 1.00 52.22 C ATOM 279 OD1 ASN A 770 -27.122 0.308 -1.470 1.00 42.21 O ATOM 280 ND2 ASN A 770 -27.443 -1.782 -2.173 1.00 41.37 N ATOM 281 HD22 ASN A 770 -27.805 -2.426 -2.905 1.00 0.00 H ATOM 282 HD21 ASN A 770 -26.998 -2.167 -1.316 1.00 0.00 H ATOM 283 H ASN A 770 -30.416 0.499 -2.603 1.00 0.00 H ATOM 284 N ARG A 771 -29.972 1.767 -5.693 1.00 41.21 N ATOM 285 CA ARG A 771 -30.222 2.385 -7.006 1.00 42.55 C ATOM 286 C ARG A 771 -30.469 3.889 -6.859 1.00 44.69 C ATOM 287 O ARG A 771 -30.051 4.645 -7.727 1.00 43.62 O ATOM 288 CB ARG A 771 -31.380 1.699 -7.763 1.00 46.44 C ATOM 289 CG ARG A 771 -30.907 0.514 -8.601 1.00 63.43 C ATOM 290 CD ARG A 771 -32.053 -0.166 -9.333 1.00 80.05 C ATOM 291 NE ARG A 771 -32.366 -1.476 -8.753 1.00 90.55 N ATOM 292 CZ ARG A 771 -33.453 -1.737 -8.035 1.00103.11 C ATOM 293 NH1 ARG A 771 -34.362 -0.789 -7.821 1.00 90.50 N ATOM 294 NH2 ARG A 771 -33.651 -2.949 -7.540 1.00 88.48 N ATOM 295 HE ARG A 771 -31.693 -2.252 -8.914 1.00 0.00 H ATOM 296 HH12 ARG A 771 -35.211 -1.000 -7.258 1.00 0.00 H ATOM 297 HH11 ARG A 771 -34.224 0.163 -8.217 1.00 0.00 H ATOM 298 HH22 ARG A 771 -34.503 -3.149 -6.979 1.00 0.00 H ATOM 299 HH21 ARG A 771 -32.954 -3.701 -7.713 1.00 0.00 H ATOM 300 H ARG A 771 -30.669 1.095 -5.312 1.00 0.00 H ATOM 301 N LEU A 772 -31.105 4.315 -5.732 1.00 41.23 N ATOM 302 CA LEU A 772 -31.342 5.719 -5.393 1.00 40.87 C ATOM 303 C LEU A 772 -29.978 6.404 -5.166 1.00 44.99 C ATOM 304 O LEU A 772 -29.737 7.467 -5.740 1.00 44.85 O ATOM 305 CB LEU A 772 -32.217 5.830 -4.137 1.00 40.99 C ATOM 306 CG LEU A 772 -32.473 7.231 -3.555 1.00 45.90 C ATOM 307 CD1 LEU A 772 -33.162 8.178 -4.581 1.00 45.50 C ATOM 308 CD2 LEU A 772 -33.294 7.145 -2.259 1.00 47.07 C ATOM 309 H LEU A 772 -31.446 3.592 -5.066 1.00 0.00 H ATOM 310 N ALA A 773 -29.068 5.745 -4.402 1.00 40.18 N ATOM 311 CA ALA A 773 -27.709 6.228 -4.138 1.00 39.42 C ATOM 312 C ALA A 773 -26.953 6.541 -5.456 1.00 43.55 C ATOM 313 O ALA A 773 -26.233 7.534 -5.512 1.00 43.24 O ATOM 314 CB ALA A 773 -26.936 5.197 -3.324 1.00 39.58 C ATOM 315 H ALA A 773 -29.354 4.840 -3.977 1.00 0.00 H ATOM 316 N GLY A 774 -27.128 5.698 -6.483 1.00 39.82 N ATOM 317 CA GLY A 774 -26.503 5.861 -7.798 1.00 39.54 C ATOM 318 C GLY A 774 -26.979 7.109 -8.519 1.00 42.49 C ATOM 319 O GLY A 774 -26.186 7.797 -9.161 1.00 41.16 O ATOM 320 H GLY A 774 -27.747 4.875 -6.337 1.00 0.00 H ATOM 321 N LYS A 775 -28.280 7.420 -8.407 1.00 40.05 N ATOM 322 CA LYS A 775 -28.866 8.624 -9.018 1.00 40.67 C ATOM 323 C LYS A 775 -28.334 9.866 -8.281 1.00 45.45 C ATOM 324 O LYS A 775 -27.902 10.831 -8.918 1.00 45.58 O ATOM 325 CB LYS A 775 -30.406 8.586 -8.960 1.00 42.40 C ATOM 326 CG LYS A 775 -31.044 7.549 -9.857 1.00 56.71 C ATOM 327 CD LYS A 775 -32.555 7.720 -9.830 1.00 76.61 C ATOM 328 CE LYS A 775 -33.313 6.596 -10.506 1.00 92.96 C ATOM 329 NZ LYS A 775 -34.789 6.820 -10.442 1.00100.19 N ATOM 330 HZ1 LYS A 775 -35.088 6.870 -9.447 1.00 0.00 H ATOM 331 HZ2 LYS A 775 -35.024 7.713 -10.921 1.00 0.00 H ATOM 332 HZ3 LYS A 775 -35.279 6.033 -10.914 1.00 0.00 H ATOM 333 H LYS A 775 -28.900 6.784 -7.866 1.00 0.00 H ATOM 334 N GLN A 776 -28.330 9.806 -6.936 1.00 41.60 N ATOM 335 CA GLN A 776 -27.835 10.860 -6.051 1.00 40.69 C ATOM 336 C GLN A 776 -26.348 11.118 -6.282 1.00 45.11 C ATOM 337 O GLN A 776 -25.930 12.275 -6.272 1.00 44.82 O ATOM 338 CB GLN A 776 -28.079 10.492 -4.591 1.00 40.56 C ATOM 339 CG GLN A 776 -29.550 10.541 -4.219 1.00 34.82 C ATOM 340 CD GLN A 776 -29.822 10.046 -2.828 1.00 50.72 C ATOM 341 OE1 GLN A 776 -28.920 9.659 -2.093 1.00 43.45 O ATOM 342 NE2 GLN A 776 -31.076 10.061 -2.423 1.00 50.56 N ATOM 343 HE22 GLN A 776 -31.825 10.393 -3.063 1.00 0.00 H ATOM 344 HE21 GLN A 776 -31.316 9.741 -1.463 1.00 0.00 H ATOM 345 H GLN A 776 -28.708 8.944 -6.492 1.00 0.00 H ATOM 346 N MET A 777 -25.565 10.052 -6.536 1.00 41.82 N ATOM 347 CA MET A 777 -24.131 10.175 -6.771 1.00 42.26 C ATOM 348 C MET A 777 -23.813 11.020 -7.994 1.00 48.47 C ATOM 349 O MET A 777 -22.865 11.795 -7.947 1.00 48.45 O ATOM 350 CB MET A 777 -23.421 8.816 -6.804 1.00 44.25 C ATOM 351 CG MET A 777 -23.060 8.290 -5.410 1.00 47.74 C ATOM 352 SD MET A 777 -22.314 9.485 -4.245 1.00 51.92 S ATOM 353 CE MET A 777 -20.744 9.854 -5.116 1.00 48.01 C ATOM 354 H MET A 777 -25.999 9.107 -6.566 1.00 0.00 H ATOM 355 N ILE A 778 -24.650 10.940 -9.045 1.00 45.98 N ATOM 356 CA ILE A 778 -24.499 11.746 -10.267 1.00 45.86 C ATOM 357 C ILE A 778 -24.578 13.245 -9.923 1.00 49.31 C ATOM 358 O ILE A 778 -23.740 14.021 -10.385 1.00 49.36 O ATOM 359 CB ILE A 778 -25.494 11.261 -11.363 1.00 48.93 C ATOM 360 CG1 ILE A 778 -25.051 9.854 -11.875 1.00 49.22 C ATOM 361 CG2 ILE A 778 -25.614 12.261 -12.511 1.00 49.17 C ATOM 362 CD1 ILE A 778 -26.129 9.047 -12.575 1.00 57.38 C ATOM 363 H ILE A 778 -25.446 10.273 -8.991 1.00 0.00 H ATOM 364 N GLN A 779 -25.541 13.625 -9.068 1.00 46.41 N ATOM 365 CA GLN A 779 -25.745 15.006 -8.617 1.00 46.20 C ATOM 366 C GLN A 779 -24.655 15.478 -7.633 1.00 51.03 C ATOM 367 O GLN A 779 -24.337 16.666 -7.625 1.00 52.08 O ATOM 368 CB GLN A 779 -27.164 15.216 -8.062 1.00 47.18 C ATOM 369 CG GLN A 779 -28.307 14.767 -9.009 1.00 54.23 C ATOM 370 CD GLN A 779 -28.314 15.394 -10.398 1.00 65.00 C ATOM 371 OE1 GLN A 779 -28.098 16.599 -10.577 1.00 61.67 O ATOM 372 NE2 GLN A 779 -28.611 14.590 -11.417 1.00 48.17 N ATOM 373 HE22 GLN A 779 -28.789 13.580 -11.247 1.00 0.00 H ATOM 374 HE21 GLN A 779 -28.664 14.972 -12.383 1.00 0.00 H ATOM 375 H GLN A 779 -26.183 12.894 -8.702 1.00 0.00 H ATOM 376 N VAL A 780 -24.060 14.556 -6.840 1.00 46.43 N ATOM 377 CA VAL A 780 -22.946 14.828 -5.920 1.00 45.02 C ATOM 378 C VAL A 780 -21.685 15.199 -6.716 1.00 50.16 C ATOM 379 O VAL A 780 -21.028 16.195 -6.406 1.00 51.00 O ATOM 380 CB VAL A 780 -22.711 13.637 -4.948 1.00 47.30 C ATOM 381 CG1 VAL A 780 -21.337 13.698 -4.293 1.00 46.15 C ATOM 382 CG2 VAL A 780 -23.807 13.564 -3.888 1.00 46.72 C ATOM 383 H VAL A 780 -24.418 13.581 -6.885 1.00 0.00 H ATOM 384 N VAL A 781 -21.378 14.414 -7.754 1.00 46.57 N ATOM 385 CA VAL A 781 -20.210 14.610 -8.623 1.00 46.24 C ATOM 386 C VAL A 781 -20.307 15.941 -9.391 1.00 50.77 C ATOM 387 O VAL A 781 -19.314 16.661 -9.469 1.00 51.19 O ATOM 388 CB VAL A 781 -19.960 13.387 -9.542 1.00 49.00 C ATOM 389 CG1 VAL A 781 -18.727 13.594 -10.407 1.00 48.66 C ATOM 390 CG2 VAL A 781 -19.803 12.122 -8.717 1.00 48.52 C ATOM 391 H VAL A 781 -22.007 13.612 -7.960 1.00 0.00 H ATOM 392 N LYS A 782 -21.510 16.292 -9.889 1.00 47.09 N ATOM 393 CA LYS A 782 -21.766 17.558 -10.595 1.00 46.54 C ATOM 394 C LYS A 782 -21.674 18.743 -9.633 1.00 51.53 C ATOM 395 O LYS A 782 -21.300 19.839 -10.051 1.00 53.06 O ATOM 396 CB LYS A 782 -23.123 17.535 -11.309 1.00 48.01 C ATOM 397 CG LYS A 782 -23.134 16.641 -12.539 1.00 54.64 C ATOM 398 CD LYS A 782 -24.542 16.470 -13.070 1.00 63.33 C ATOM 399 CE LYS A 782 -24.572 15.682 -14.352 1.00 77.17 C ATOM 400 NZ LYS A 782 -25.957 15.537 -14.876 1.00 89.87 N ATOM 401 HZ1 LYS A 782 -26.542 15.042 -14.173 1.00 0.00 H ATOM 402 HZ2 LYS A 782 -26.357 16.479 -15.061 1.00 0.00 H ATOM 403 HZ3 LYS A 782 -25.936 14.989 -15.759 1.00 0.00 H ATOM 404 H LYS A 782 -22.303 15.630 -9.767 1.00 0.00 H ATOM 405 N TRP A 783 -21.998 18.513 -8.345 1.00 46.41 N ATOM 406 CA TRP A 783 -21.924 19.505 -7.271 1.00 45.15 C ATOM 407 C TRP A 783 -20.464 19.757 -6.892 1.00 52.14 C ATOM 408 O TRP A 783 -20.093 20.905 -6.660 1.00 53.25 O ATOM 409 CB TRP A 783 -22.724 19.019 -6.034 1.00 42.02 C ATOM 410 CG TRP A 783 -22.374 19.675 -4.734 1.00 41.49 C ATOM 411 CD1 TRP A 783 -22.826 20.876 -4.279 1.00 44.18 C ATOM 412 CD2 TRP A 783 -21.563 19.127 -3.685 1.00 41.00 C ATOM 413 NE1 TRP A 783 -22.318 21.133 -3.028 1.00 43.20 N ATOM 414 CE2 TRP A 783 -21.545 20.070 -2.632 1.00 44.62 C ATOM 415 CE3 TRP A 783 -20.857 17.923 -3.523 1.00 42.48 C ATOM 416 CZ2 TRP A 783 -20.851 19.846 -1.432 1.00 43.82 C ATOM 417 CZ3 TRP A 783 -20.142 17.716 -2.343 1.00 43.65 C ATOM 418 CH2 TRP A 783 -20.168 18.656 -1.305 1.00 44.00 C ATOM 419 HE1 TRP A 783 -22.491 21.994 -2.471 1.00 0.00 H ATOM 420 H TRP A 783 -22.326 17.558 -8.095 1.00 0.00 H ATOM 421 N ALA A 784 -19.663 18.687 -6.771 1.00 48.97 N ATOM 422 CA ALA A 784 -18.260 18.770 -6.368 1.00 49.67 C ATOM 423 C ALA A 784 -17.390 19.373 -7.479 1.00 55.97 C ATOM 424 O ALA A 784 -16.449 20.101 -7.192 1.00 55.23 O ATOM 425 CB ALA A 784 -17.748 17.390 -5.960 1.00 50.01 C ATOM 426 H ALA A 784 -20.062 17.748 -6.975 1.00 0.00 H ATOM 427 N LYS A 785 -17.722 19.068 -8.739 1.00 54.52 N ATOM 428 CA LYS A 785 -17.076 19.549 -9.964 1.00 54.99 C ATOM 429 C LYS A 785 -16.929 21.089 -9.945 1.00 61.03 C ATOM 430 O LYS A 785 -15.870 21.601 -10.294 1.00 61.35 O ATOM 431 CB LYS A 785 -17.962 19.152 -11.162 1.00 56.45 C ATOM 432 CG LYS A 785 -17.236 18.897 -12.458 1.00 64.77 C ATOM 433 CD LYS A 785 -18.248 18.536 -13.538 1.00 72.42 C ATOM 434 CE LYS A 785 -17.668 18.591 -14.926 1.00 86.40 C ATOM 435 NZ LYS A 785 -18.710 18.334 -15.958 1.00 99.60 N ATOM 436 HZ1 LYS A 785 -19.120 17.390 -15.807 1.00 0.00 H ATOM 437 HZ2 LYS A 785 -19.457 19.054 -15.882 1.00 0.00 H ATOM 438 HZ3 LYS A 785 -18.279 18.379 -16.903 1.00 0.00 H ATOM 439 H LYS A 785 -18.525 18.419 -8.863 1.00 0.00 H ATOM 440 N VAL A 786 -17.997 21.809 -9.531 1.00 57.55 N ATOM 441 CA VAL A 786 -18.084 23.276 -9.496 1.00 56.88 C ATOM 442 C VAL A 786 -17.959 23.857 -8.068 1.00 62.92 C ATOM 443 O VAL A 786 -18.491 24.929 -7.772 1.00 64.26 O ATOM 444 CB VAL A 786 -19.366 23.772 -10.226 1.00 59.41 C ATOM 445 CG1 VAL A 786 -19.276 23.529 -11.731 1.00 58.71 C ATOM 446 CG2 VAL A 786 -20.627 23.141 -9.643 1.00 58.74 C ATOM 447 H VAL A 786 -18.831 21.277 -9.209 1.00 0.00 H ATOM 448 N LEU A 787 -17.219 23.166 -7.206 1.00 58.84 N ATOM 449 CA LEU A 787 -17.007 23.550 -5.818 1.00 57.58 C ATOM 450 C LEU A 787 -15.700 24.339 -5.650 1.00 58.79 C ATOM 451 O LEU A 787 -14.645 23.826 -6.028 1.00 58.59 O ATOM 452 CB LEU A 787 -16.979 22.262 -4.982 1.00 57.60 C ATOM 453 CG LEU A 787 -17.298 22.319 -3.517 1.00 61.74 C ATOM 454 CD1 LEU A 787 -18.726 22.715 -3.284 1.00 61.44 C ATOM 455 CD2 LEU A 787 -17.084 20.970 -2.907 1.00 63.90 C ATOM 456 H LEU A 787 -16.762 22.295 -7.545 1.00 0.00 H ATOM 457 N PRO A 788 -15.749 25.570 -5.073 1.00 53.60 N ATOM 458 CA PRO A 788 -14.515 26.358 -4.869 1.00 52.79 C ATOM 459 C PRO A 788 -13.411 25.612 -4.105 1.00 56.80 C ATOM 460 O PRO A 788 -13.652 25.020 -3.042 1.00 57.11 O ATOM 461 CB PRO A 788 -15.005 27.578 -4.077 1.00 54.36 C ATOM 462 CG PRO A 788 -16.426 27.710 -4.430 1.00 58.74 C ATOM 463 CD PRO A 788 -16.932 26.308 -4.586 1.00 54.80 C ATOM 464 N GLY A 789 -12.219 25.622 -4.685 1.00 52.00 N ATOM 465 CA GLY A 789 -11.052 24.947 -4.148 1.00 51.67 C ATOM 466 C GLY A 789 -10.922 23.552 -4.716 1.00 56.28 C ATOM 467 O GLY A 789 -9.929 23.246 -5.385 1.00 55.96 O ATOM 468 H GLY A 789 -12.114 26.145 -5.578 1.00 0.00 H ATOM 469 N PHE A 790 -11.924 22.687 -4.427 1.00 52.76 N ATOM 470 CA PHE A 790 -11.998 21.272 -4.853 1.00 51.60 C ATOM 471 C PHE A 790 -11.852 21.134 -6.373 1.00 55.20 C ATOM 472 O PHE A 790 -11.123 20.256 -6.855 1.00 53.43 O ATOM 473 CB PHE A 790 -13.310 20.623 -4.366 1.00 51.95 C ATOM 474 CG PHE A 790 -13.427 19.142 -4.611 1.00 51.82 C ATOM 475 CD1 PHE A 790 -12.962 18.229 -3.677 1.00 54.24 C ATOM 476 CD2 PHE A 790 -14.019 18.657 -5.771 1.00 53.08 C ATOM 477 CE1 PHE A 790 -13.087 16.854 -3.899 1.00 54.89 C ATOM 478 CE2 PHE A 790 -14.130 17.285 -5.997 1.00 55.24 C ATOM 479 CZ PHE A 790 -13.688 16.394 -5.047 1.00 53.16 C ATOM 480 H PHE A 790 -12.712 23.050 -3.854 1.00 0.00 H ATOM 481 N LYS A 791 -12.511 22.035 -7.107 1.00 52.99 N ATOM 482 CA LYS A 791 -12.470 22.090 -8.568 1.00 53.63 C ATOM 483 C LYS A 791 -11.031 22.226 -9.122 1.00 57.77 C ATOM 484 O LYS A 791 -10.794 21.830 -10.253 1.00 58.02 O ATOM 485 CB LYS A 791 -13.395 23.208 -9.100 1.00 55.75 C ATOM 486 CG LYS A 791 -13.003 24.639 -8.726 1.00 65.95 C ATOM 487 CD LYS A 791 -13.924 25.637 -9.399 1.00 76.24 C ATOM 488 CE LYS A 791 -13.316 27.016 -9.437 1.00 92.51 C ATOM 489 NZ LYS A 791 -14.064 27.925 -10.349 1.00102.97 N ATOM 490 HZ1 LYS A 791 -14.051 27.535 -11.313 1.00 0.00 H ATOM 491 HZ2 LYS A 791 -15.048 28.010 -10.022 1.00 0.00 H ATOM 492 HZ3 LYS A 791 -13.614 28.863 -10.347 1.00 0.00 H ATOM 493 H LYS A 791 -13.089 22.741 -6.608 1.00 0.00 H ATOM 494 N ASN A 792 -10.081 22.721 -8.302 1.00 53.84 N ATOM 495 CA ASN A 792 -8.686 22.942 -8.683 1.00 54.14 C ATOM 496 C ASN A 792 -7.706 21.847 -8.255 1.00 59.38 C ATOM 497 O ASN A 792 -6.563 21.877 -8.711 1.00 62.06 O ATOM 498 CB ASN A 792 -8.208 24.315 -8.184 1.00 58.79 C ATOM 499 CG ASN A 792 -9.087 25.477 -8.625 1.00 81.05 C ATOM 500 OD1 ASN A 792 -9.546 26.279 -7.803 1.00 81.96 O ATOM 501 ND2 ASN A 792 -9.370 25.580 -9.924 1.00 65.71 N ATOM 502 HD22 ASN A 792 -8.973 24.895 -10.599 1.00 0.00 H ATOM 503 HD21 ASN A 792 -9.987 26.345 -10.263 1.00 0.00 H ATOM 504 H ASN A 792 -10.360 22.963 -7.330 1.00 0.00 H ATOM 505 N LEU A 793 -8.128 20.866 -7.428 1.00 54.39 N ATOM 506 CA LEU A 793 -7.274 19.728 -7.020 1.00 52.80 C ATOM 507 C LEU A 793 -7.034 18.797 -8.215 1.00 52.85 C ATOM 508 O LEU A 793 -7.893 18.741 -9.100 1.00 52.66 O ATOM 509 CB LEU A 793 -7.967 18.899 -5.919 1.00 52.85 C ATOM 510 CG LEU A 793 -7.964 19.436 -4.491 1.00 57.62 C ATOM 511 CD1 LEU A 793 -8.976 18.692 -3.657 1.00 57.83 C ATOM 512 CD2 LEU A 793 -6.583 19.300 -3.838 1.00 59.61 C ATOM 513 H LEU A 793 -9.100 20.912 -7.060 1.00 0.00 H ATOM 514 N PRO A 794 -5.937 18.008 -8.265 1.00 48.44 N ATOM 515 CA PRO A 794 -5.788 17.051 -9.388 1.00 48.01 C ATOM 516 C PRO A 794 -6.929 16.015 -9.426 1.00 53.33 C ATOM 517 O PRO A 794 -7.441 15.609 -8.368 1.00 52.06 O ATOM 518 CB PRO A 794 -4.446 16.365 -9.115 1.00 48.95 C ATOM 519 CG PRO A 794 -4.159 16.598 -7.688 1.00 53.76 C ATOM 520 CD PRO A 794 -4.807 17.903 -7.316 1.00 49.96 C ATOM 521 N LEU A 795 -7.316 15.589 -10.651 1.00 50.46 N ATOM 522 CA LEU A 795 -8.371 14.604 -10.923 1.00 50.10 C ATOM 523 C LEU A 795 -8.291 13.400 -9.994 1.00 54.41 C ATOM 524 O LEU A 795 -9.311 13.005 -9.432 1.00 55.92 O ATOM 525 CB LEU A 795 -8.333 14.177 -12.396 1.00 50.18 C ATOM 526 CG LEU A 795 -9.345 13.126 -12.859 1.00 55.88 C ATOM 527 CD1 LEU A 795 -10.804 13.599 -12.646 1.00 55.94 C ATOM 528 CD2 LEU A 795 -9.063 12.704 -14.307 1.00 57.32 C ATOM 529 H LEU A 795 -6.823 15.995 -11.472 1.00 0.00 H ATOM 530 N GLU A 796 -7.073 12.879 -9.776 1.00 49.76 N ATOM 531 CA GLU A 796 -6.775 11.756 -8.898 1.00 49.53 C ATOM 532 C GLU A 796 -7.269 12.035 -7.455 1.00 53.26 C ATOM 533 O GLU A 796 -7.840 11.148 -6.831 1.00 52.55 O ATOM 534 CB GLU A 796 -5.261 11.490 -8.918 1.00 50.99 C ATOM 535 CG GLU A 796 -4.798 10.345 -8.027 1.00 68.04 C ATOM 536 CD GLU A 796 -3.305 10.253 -7.753 1.00 96.60 C ATOM 537 OE1 GLU A 796 -2.515 10.885 -8.494 1.00 77.45 O ATOM 538 OE2 GLU A 796 -2.924 9.536 -6.797 1.00 94.30 O ATOM 539 H GLU A 796 -6.273 13.315 -10.278 1.00 0.00 H ATOM 540 N ASP A 797 -7.025 13.260 -6.935 1.00 49.08 N ATOM 541 CA ASP A 797 -7.399 13.669 -5.579 1.00 47.22 C ATOM 542 C ASP A 797 -8.901 13.827 -5.438 1.00 46.32 C ATOM 543 O ASP A 797 -9.459 13.422 -4.424 1.00 45.06 O ATOM 544 CB ASP A 797 -6.665 14.954 -5.184 1.00 49.45 C ATOM 545 CG ASP A 797 -5.215 14.770 -4.766 1.00 60.36 C ATOM 546 OD1 ASP A 797 -4.789 13.600 -4.568 1.00 59.67 O ATOM 547 OD2 ASP A 797 -4.518 15.796 -4.590 1.00 66.46 O ATOM 548 H ASP A 797 -6.541 13.956 -7.537 1.00 0.00 H ATOM 549 N GLN A 798 -9.556 14.362 -6.479 1.00 41.02 N ATOM 550 CA GLN A 798 -10.996 14.555 -6.545 1.00 40.51 C ATOM 551 C GLN A 798 -11.708 13.203 -6.431 1.00 47.09 C ATOM 552 O GLN A 798 -12.678 13.080 -5.670 1.00 47.79 O ATOM 553 CB GLN A 798 -11.385 15.233 -7.859 1.00 41.45 C ATOM 554 CG GLN A 798 -10.957 16.702 -7.975 1.00 49.89 C ATOM 555 CD GLN A 798 -11.559 17.381 -9.190 1.00 60.38 C ATOM 556 OE1 GLN A 798 -11.993 16.757 -10.157 1.00 59.79 O ATOM 557 NE2 GLN A 798 -11.619 18.679 -9.166 1.00 50.91 N ATOM 558 HE22 GLN A 798 -11.250 19.202 -8.346 1.00 0.00 H ATOM 559 HE21 GLN A 798 -12.036 19.195 -9.967 1.00 0.00 H ATOM 560 H GLN A 798 -8.992 14.661 -7.300 1.00 0.00 H ATOM 561 N ILE A 799 -11.193 12.182 -7.169 1.00 42.58 N ATOM 562 CA ILE A 799 -11.711 10.815 -7.185 1.00 40.62 C ATOM 563 C ILE A 799 -11.526 10.192 -5.809 1.00 43.47 C ATOM 564 O ILE A 799 -12.491 9.687 -5.235 1.00 42.91 O ATOM 565 CB ILE A 799 -11.061 9.979 -8.324 1.00 42.80 C ATOM 566 CG1 ILE A 799 -11.482 10.510 -9.717 1.00 42.06 C ATOM 567 CG2 ILE A 799 -11.367 8.476 -8.169 1.00 42.06 C ATOM 568 CD1 ILE A 799 -10.692 9.902 -10.931 1.00 40.04 C ATOM 569 H ILE A 799 -10.368 12.390 -7.767 1.00 0.00 H ATOM 570 N THR A 800 -10.302 10.248 -5.267 1.00 40.11 N ATOM 571 CA THR A 800 -9.992 9.706 -3.939 1.00 40.51 C ATOM 572 C THR A 800 -10.985 10.231 -2.871 1.00 44.47 C ATOM 573 O THR A 800 -11.577 9.438 -2.142 1.00 44.02 O ATOM 574 CB THR A 800 -8.553 10.075 -3.571 1.00 51.63 C ATOM 575 OG1 THR A 800 -7.669 9.517 -4.546 1.00 53.28 O ATOM 576 CG2 THR A 800 -8.168 9.631 -2.160 1.00 47.11 C ATOM 577 HG1 THR A 800 -7.891 9.883 -5.439 1.00 0.00 H ATOM 578 H THR A 800 -9.537 10.696 -5.812 1.00 0.00 H ATOM 579 N LEU A 801 -11.171 11.567 -2.817 1.00 41.69 N ATOM 580 CA LEU A 801 -12.023 12.256 -1.843 1.00 40.66 C ATOM 581 C LEU A 801 -13.480 11.833 -1.942 1.00 42.82 C ATOM 582 O LEU A 801 -14.087 11.538 -0.904 1.00 41.43 O ATOM 583 CB LEU A 801 -11.851 13.794 -1.921 1.00 40.11 C ATOM 584 CG LEU A 801 -10.485 14.328 -1.408 1.00 43.88 C ATOM 585 CD1 LEU A 801 -10.361 15.819 -1.608 1.00 42.62 C ATOM 586 CD2 LEU A 801 -10.238 13.951 0.048 1.00 44.46 C ATOM 587 H LEU A 801 -10.673 12.151 -3.519 1.00 0.00 H ATOM 588 N ILE A 802 -14.026 11.770 -3.179 1.00 37.94 N ATOM 589 CA ILE A 802 -15.407 11.338 -3.410 1.00 38.01 C ATOM 590 C ILE A 802 -15.592 9.866 -2.983 1.00 42.77 C ATOM 591 O ILE A 802 -16.549 9.556 -2.266 1.00 42.20 O ATOM 592 CB ILE A 802 -15.879 11.641 -4.862 1.00 40.95 C ATOM 593 CG1 ILE A 802 -16.034 13.170 -5.075 1.00 39.80 C ATOM 594 CG2 ILE A 802 -17.196 10.889 -5.216 1.00 41.48 C ATOM 595 CD1 ILE A 802 -16.051 13.602 -6.560 1.00 40.37 C ATOM 596 H ILE A 802 -13.443 12.039 -3.997 1.00 0.00 H ATOM 597 N GLN A 803 -14.635 8.989 -3.355 1.00 39.51 N ATOM 598 CA GLN A 803 -14.674 7.563 -3.007 1.00 39.73 C ATOM 599 C GLN A 803 -14.626 7.299 -1.506 1.00 43.76 C ATOM 600 O GLN A 803 -15.218 6.320 -1.051 1.00 42.28 O ATOM 601 CB GLN A 803 -13.587 6.752 -3.741 1.00 40.39 C ATOM 602 CG GLN A 803 -13.839 6.682 -5.248 1.00 37.12 C ATOM 603 CD GLN A 803 -12.774 5.926 -6.009 1.00 53.64 C ATOM 604 OE1 GLN A 803 -11.636 5.751 -5.557 1.00 44.60 O ATOM 605 NE2 GLN A 803 -13.117 5.497 -7.215 1.00 46.62 N ATOM 606 HE22 GLN A 803 -14.081 5.658 -7.569 1.00 0.00 H ATOM 607 HE21 GLN A 803 -12.422 4.999 -7.807 1.00 0.00 H ATOM 608 H GLN A 803 -13.832 9.340 -3.915 1.00 0.00 H ATOM 609 N TYR A 804 -13.935 8.156 -0.743 1.00 41.64 N ATOM 610 CA TYR A 804 -13.866 7.993 0.704 1.00 42.83 C ATOM 611 C TYR A 804 -15.103 8.509 1.421 1.00 44.27 C ATOM 612 O TYR A 804 -15.493 7.951 2.437 1.00 44.11 O ATOM 613 CB TYR A 804 -12.672 8.757 1.281 1.00 45.58 C ATOM 614 CG TYR A 804 -11.333 8.071 1.197 1.00 49.90 C ATOM 615 CD1 TYR A 804 -11.197 6.717 1.499 1.00 52.36 C ATOM 616 CD2 TYR A 804 -10.177 8.798 0.938 1.00 51.19 C ATOM 617 CE1 TYR A 804 -9.951 6.092 1.467 1.00 53.59 C ATOM 618 CE2 TYR A 804 -8.927 8.187 0.920 1.00 52.11 C ATOM 619 CZ TYR A 804 -8.818 6.838 1.186 1.00 57.94 C ATOM 620 OH TYR A 804 -7.576 6.267 1.133 1.00 59.89 O ATOM 621 HH TYR A 804 -7.648 5.302 1.344 1.00 0.00 H ATOM 622 H TYR A 804 -13.439 8.952 -1.191 1.00 0.00 H ATOM 623 N SER A 805 -15.681 9.597 0.918 1.00 39.47 N ATOM 624 CA SER A 805 -16.740 10.345 1.573 1.00 38.49 C ATOM 625 C SER A 805 -18.126 10.237 0.989 1.00 39.56 C ATOM 626 O SER A 805 -19.020 10.832 1.575 1.00 39.66 O ATOM 627 CB SER A 805 -16.349 11.823 1.639 1.00 41.65 C ATOM 628 OG SER A 805 -16.363 12.398 0.342 1.00 48.98 O ATOM 629 HG SER A 805 -15.718 11.919 -0.237 1.00 0.00 H ATOM 630 H SER A 805 -15.352 9.935 -0.009 1.00 0.00 H ATOM 631 N TRP A 806 -18.346 9.470 -0.099 1.00 35.46 N ATOM 632 CA TRP A 806 -19.671 9.368 -0.712 1.00 34.71 C ATOM 633 C TRP A 806 -20.776 9.039 0.303 1.00 39.40 C ATOM 634 O TRP A 806 -21.846 9.649 0.262 1.00 41.78 O ATOM 635 CB TRP A 806 -19.679 8.391 -1.905 1.00 33.86 C ATOM 636 CG TRP A 806 -19.562 6.933 -1.530 1.00 35.06 C ATOM 637 CD1 TRP A 806 -18.415 6.241 -1.275 1.00 37.86 C ATOM 638 CD2 TRP A 806 -20.646 6.020 -1.286 1.00 35.10 C ATOM 639 NE1 TRP A 806 -18.715 4.949 -0.884 1.00 37.30 N ATOM 640 CE2 TRP A 806 -20.077 4.785 -0.897 1.00 38.58 C ATOM 641 CE3 TRP A 806 -22.045 6.116 -1.391 1.00 37.06 C ATOM 642 CZ2 TRP A 806 -20.852 3.647 -0.654 1.00 37.85 C ATOM 643 CZ3 TRP A 806 -22.822 4.993 -1.088 1.00 38.20 C ATOM 644 CH2 TRP A 806 -22.224 3.778 -0.746 1.00 38.64 C ATOM 645 HE1 TRP A 806 -18.021 4.220 -0.623 1.00 0.00 H ATOM 646 H TRP A 806 -17.554 8.938 -0.512 1.00 0.00 H ATOM 647 N MET A 807 -20.506 8.127 1.233 1.00 34.84 N ATOM 648 CA MET A 807 -21.473 7.703 2.256 1.00 34.60 C ATOM 649 C MET A 807 -21.842 8.833 3.221 1.00 38.92 C ATOM 650 O MET A 807 -23.028 9.000 3.513 1.00 37.06 O ATOM 651 CB MET A 807 -20.965 6.455 3.012 1.00 36.14 C ATOM 652 CG MET A 807 -21.957 5.915 4.035 1.00 38.83 C ATOM 653 SD MET A 807 -23.431 5.169 3.314 1.00 41.80 S ATOM 654 CE MET A 807 -22.758 3.513 2.796 1.00 37.73 C ATOM 655 H MET A 807 -19.562 7.691 1.237 1.00 0.00 H ATOM 656 N SER A 808 -20.833 9.603 3.715 1.00 36.91 N ATOM 657 CA SER A 808 -21.074 10.726 4.634 1.00 37.08 C ATOM 658 C SER A 808 -21.943 11.780 3.951 1.00 39.80 C ATOM 659 O SER A 808 -22.850 12.318 4.582 1.00 41.01 O ATOM 660 CB SER A 808 -19.761 11.363 5.091 1.00 42.30 C ATOM 661 OG SER A 808 -18.897 10.422 5.702 1.00 57.13 O ATOM 662 HG SER A 808 -18.062 10.875 5.982 1.00 0.00 H ATOM 663 H SER A 808 -19.855 9.389 3.432 1.00 0.00 H ATOM 664 N LEU A 809 -21.693 12.035 2.651 1.00 34.35 N ATOM 665 CA LEU A 809 -22.425 13.023 1.846 1.00 33.10 C ATOM 666 C LEU A 809 -23.865 12.629 1.692 1.00 38.07 C ATOM 667 O LEU A 809 -24.739 13.469 1.885 1.00 38.41 O ATOM 668 CB LEU A 809 -21.778 13.228 0.461 1.00 31.94 C ATOM 669 CG LEU A 809 -20.352 13.807 0.456 1.00 35.76 C ATOM 670 CD1 LEU A 809 -19.788 13.867 -0.970 1.00 35.68 C ATOM 671 CD2 LEU A 809 -20.309 15.200 1.092 1.00 34.36 C ATOM 672 H LEU A 809 -20.933 11.498 2.188 1.00 0.00 H ATOM 673 N LEU A 810 -24.122 11.341 1.396 1.00 34.65 N ATOM 674 CA LEU A 810 -25.491 10.865 1.183 1.00 33.65 C ATOM 675 C LEU A 810 -26.267 10.742 2.477 1.00 37.47 C ATOM 676 O LEU A 810 -27.433 11.127 2.507 1.00 36.38 O ATOM 677 CB LEU A 810 -25.543 9.580 0.343 1.00 32.82 C ATOM 678 CG LEU A 810 -24.939 9.706 -1.080 1.00 36.44 C ATOM 679 CD1 LEU A 810 -25.233 8.467 -1.912 1.00 35.71 C ATOM 680 CD2 LEU A 810 -25.426 10.991 -1.814 1.00 34.20 C ATOM 681 H LEU A 810 -23.332 10.670 1.317 1.00 0.00 H ATOM 682 N SER A 811 -25.614 10.289 3.567 1.00 35.10 N ATOM 683 CA SER A 811 -26.304 10.189 4.846 1.00 34.68 C ATOM 684 C SER A 811 -26.574 11.581 5.423 1.00 40.01 C ATOM 685 O SER A 811 -27.669 11.802 5.946 1.00 40.46 O ATOM 686 CB SER A 811 -25.565 9.272 5.813 1.00 37.28 C ATOM 687 OG SER A 811 -24.207 9.646 5.930 1.00 50.82 O ATOM 688 HG SER A 811 -23.772 9.588 5.042 1.00 0.00 H ATOM 689 H SER A 811 -24.615 10.010 3.494 1.00 0.00 H ATOM 690 N PHE A 812 -25.634 12.551 5.224 1.00 36.51 N ATOM 691 CA PHE A 812 -25.831 13.940 5.673 1.00 36.15 C ATOM 692 C PHE A 812 -26.988 14.618 4.941 1.00 38.03 C ATOM 693 O PHE A 812 -27.835 15.238 5.593 1.00 35.73 O ATOM 694 CB PHE A 812 -24.549 14.777 5.565 1.00 37.85 C ATOM 695 CG PHE A 812 -24.464 15.941 6.538 1.00 38.62 C ATOM 696 CD1 PHE A 812 -24.386 15.718 7.915 1.00 41.07 C ATOM 697 CD2 PHE A 812 -24.399 17.252 6.076 1.00 39.16 C ATOM 698 CE1 PHE A 812 -24.265 16.788 8.809 1.00 41.33 C ATOM 699 CE2 PHE A 812 -24.267 18.321 6.969 1.00 41.94 C ATOM 700 CZ PHE A 812 -24.228 18.084 8.329 1.00 40.32 C ATOM 701 H PHE A 812 -24.749 12.301 4.739 1.00 0.00 H ATOM 702 N ALA A 813 -27.067 14.440 3.598 1.00 33.92 N ATOM 703 CA ALA A 813 -28.156 15.018 2.809 1.00 33.19 C ATOM 704 C ALA A 813 -29.492 14.362 3.203 1.00 37.60 C ATOM 705 O ALA A 813 -30.502 15.052 3.304 1.00 40.08 O ATOM 706 CB ALA A 813 -27.879 14.857 1.323 1.00 33.70 C ATOM 707 H ALA A 813 -26.335 13.879 3.117 1.00 0.00 H ATOM 708 N LEU A 814 -29.484 13.052 3.488 1.00 32.92 N ATOM 709 CA LEU A 814 -30.666 12.330 3.958 1.00 32.67 C ATOM 710 C LEU A 814 -31.168 12.951 5.287 1.00 36.48 C ATOM 711 O LEU A 814 -32.369 13.182 5.417 1.00 36.10 O ATOM 712 CB LEU A 814 -30.344 10.835 4.167 1.00 32.09 C ATOM 713 CG LEU A 814 -31.356 10.019 5.004 1.00 33.12 C ATOM 714 CD1 LEU A 814 -32.605 9.701 4.178 1.00 31.35 C ATOM 715 CD2 LEU A 814 -30.743 8.752 5.470 1.00 33.36 C ATOM 716 H LEU A 814 -28.596 12.524 3.369 1.00 0.00 H ATOM 717 N SER A 815 -30.243 13.242 6.236 1.00 33.42 N ATOM 718 CA SER A 815 -30.551 13.916 7.518 1.00 34.49 C ATOM 719 C SER A 815 -31.158 15.328 7.326 1.00 40.13 C ATOM 720 O SER A 815 -32.093 15.684 8.036 1.00 40.49 O ATOM 721 CB SER A 815 -29.318 13.981 8.405 1.00 37.66 C ATOM 722 OG SER A 815 -29.105 12.687 8.945 1.00 49.04 O ATOM 723 HG SER A 815 -29.897 12.417 9.475 1.00 0.00 H ATOM 724 H SER A 815 -29.255 12.975 6.051 1.00 0.00 H ATOM 725 N TRP A 816 -30.670 16.089 6.339 1.00 37.31 N ATOM 726 CA TRP A 816 -31.201 17.399 6.006 1.00 38.76 C ATOM 727 C TRP A 816 -32.647 17.297 5.477 1.00 45.57 C ATOM 728 O TRP A 816 -33.533 18.007 5.972 1.00 45.66 O ATOM 729 CB TRP A 816 -30.314 18.098 4.974 1.00 37.74 C ATOM 730 CG TRP A 816 -30.831 19.454 4.588 1.00 38.62 C ATOM 731 CD1 TRP A 816 -31.474 19.787 3.431 1.00 41.11 C ATOM 732 CD2 TRP A 816 -30.834 20.634 5.409 1.00 38.63 C ATOM 733 NE1 TRP A 816 -31.864 21.102 3.472 1.00 41.14 N ATOM 734 CE2 TRP A 816 -31.481 21.650 4.675 1.00 42.42 C ATOM 735 CE3 TRP A 816 -30.358 20.929 6.703 1.00 40.04 C ATOM 736 CZ2 TRP A 816 -31.654 22.945 5.181 1.00 41.11 C ATOM 737 CZ3 TRP A 816 -30.544 22.208 7.208 1.00 41.19 C ATOM 738 CH2 TRP A 816 -31.179 23.202 6.447 1.00 41.48 C ATOM 739 HE1 TRP A 816 -32.369 21.605 2.714 1.00 0.00 H ATOM 740 H TRP A 816 -29.871 15.724 5.783 1.00 0.00 H ATOM 741 N ARG A 817 -32.881 16.414 4.485 1.00 41.54 N ATOM 742 CA ARG A 817 -34.220 16.212 3.909 1.00 40.97 C ATOM 743 C ARG A 817 -35.208 15.782 5.000 1.00 44.58 C ATOM 744 O ARG A 817 -36.324 16.309 5.062 1.00 44.82 O ATOM 745 CB ARG A 817 -34.188 15.139 2.805 1.00 38.03 C ATOM 746 CG ARG A 817 -33.413 15.555 1.568 1.00 35.75 C ATOM 747 CD ARG A 817 -33.697 14.648 0.366 1.00 30.58 C ATOM 748 NE ARG A 817 -33.384 13.238 0.617 1.00 32.26 N ATOM 749 CZ ARG A 817 -32.177 12.686 0.480 1.00 48.72 C ATOM 750 NH1 ARG A 817 -31.140 13.425 0.111 1.00 38.79 N ATOM 751 NH2 ARG A 817 -32.001 11.394 0.706 1.00 39.42 N ATOM 752 HE ARG A 817 -34.162 12.621 0.925 1.00 0.00 H ATOM 753 HH12 ARG A 817 -30.202 12.989 0.006 1.00 0.00 H ATOM 754 HH11 ARG A 817 -31.265 14.441 -0.073 1.00 0.00 H ATOM 755 HH22 ARG A 817 -31.057 10.971 0.597 1.00 0.00 H ATOM 756 HH21 ARG A 817 -32.806 10.802 0.992 1.00 0.00 H ATOM 757 H ARG A 817 -32.086 15.855 4.114 1.00 0.00 H ATOM 758 N SER A 818 -34.784 14.824 5.855 1.00 39.58 N ATOM 759 CA SER A 818 -35.565 14.283 6.972 1.00 39.17 C ATOM 760 C SER A 818 -36.031 15.409 7.879 1.00 45.12 C ATOM 761 O SER A 818 -37.193 15.422 8.296 1.00 44.84 O ATOM 762 CB SER A 818 -34.722 13.294 7.772 1.00 40.42 C ATOM 763 OG SER A 818 -34.378 12.165 6.987 1.00 40.39 O ATOM 764 HG SER A 818 -33.858 12.459 6.198 1.00 0.00 H ATOM 765 H SER A 818 -33.828 14.441 5.709 1.00 0.00 H ATOM 766 N TYR A 819 -35.125 16.381 8.128 1.00 42.12 N ATOM 767 CA TYR A 819 -35.326 17.553 8.971 1.00 41.38 C ATOM 768 C TYR A 819 -36.281 18.563 8.337 1.00 45.88 C ATOM 769 O TYR A 819 -37.243 18.983 8.973 1.00 46.72 O ATOM 770 CB TYR A 819 -33.946 18.155 9.290 1.00 41.73 C ATOM 771 CG TYR A 819 -33.910 19.579 9.799 1.00 42.07 C ATOM 772 CD1 TYR A 819 -34.569 19.938 10.973 1.00 43.54 C ATOM 773 CD2 TYR A 819 -33.102 20.534 9.188 1.00 42.25 C ATOM 774 CE1 TYR A 819 -34.483 21.230 11.485 1.00 43.51 C ATOM 775 CE2 TYR A 819 -33.005 21.827 9.694 1.00 43.24 C ATOM 776 CZ TYR A 819 -33.689 22.167 10.848 1.00 48.76 C ATOM 777 OH TYR A 819 -33.609 23.438 11.335 1.00 50.57 O ATOM 778 HH TYR A 819 -32.665 23.652 11.542 1.00 0.00 H ATOM 779 H TYR A 819 -34.194 16.283 7.674 1.00 0.00 H ATOM 780 N LYS A 820 -36.025 18.940 7.093 1.00 41.09 N ATOM 781 CA LYS A 820 -36.836 19.897 6.371 1.00 40.16 C ATOM 782 C LYS A 820 -38.235 19.396 6.049 1.00 44.95 C ATOM 783 O LYS A 820 -39.183 20.162 6.175 1.00 45.14 O ATOM 784 CB LYS A 820 -36.114 20.367 5.089 1.00 41.44 C ATOM 785 CG LYS A 820 -34.871 21.225 5.340 1.00 55.15 C ATOM 786 CD LYS A 820 -34.973 22.221 6.548 1.00 59.25 C ATOM 787 CE LYS A 820 -35.613 23.552 6.243 1.00 62.27 C ATOM 788 NZ LYS A 820 -35.722 24.388 7.470 1.00 72.54 N ATOM 789 HZ1 LYS A 820 -36.304 23.892 8.175 1.00 0.00 H ATOM 790 HZ2 LYS A 820 -34.772 24.556 7.859 1.00 0.00 H ATOM 791 HZ3 LYS A 820 -36.166 25.297 7.230 1.00 0.00 H ATOM 792 H LYS A 820 -35.200 18.528 6.611 1.00 0.00 H ATOM 793 N HIS A 821 -38.377 18.133 5.643 1.00 42.35 N ATOM 794 CA HIS A 821 -39.670 17.618 5.205 1.00 43.05 C ATOM 795 C HIS A 821 -40.518 16.910 6.264 1.00 44.90 C ATOM 796 O HIS A 821 -41.733 16.800 6.067 1.00 43.25 O ATOM 797 CB HIS A 821 -39.494 16.706 3.995 1.00 44.71 C ATOM 798 CG HIS A 821 -38.874 17.395 2.822 1.00 49.82 C ATOM 799 ND1 HIS A 821 -37.533 17.212 2.498 1.00 52.62 N ATOM 800 CD2 HIS A 821 -39.418 18.265 1.938 1.00 52.16 C ATOM 801 CE1 HIS A 821 -37.321 17.952 1.419 1.00 51.89 C ATOM 802 NE2 HIS A 821 -38.417 18.618 1.059 1.00 52.02 N ATOM 803 H HIS A 821 -37.550 17.503 5.639 1.00 0.00 H ATOM 804 N THR A 822 -39.907 16.396 7.348 1.00 40.54 N ATOM 805 CA THR A 822 -40.665 15.637 8.355 1.00 39.93 C ATOM 806 C THR A 822 -40.364 16.067 9.795 1.00 43.01 C ATOM 807 O THR A 822 -40.843 15.420 10.725 1.00 42.91 O ATOM 808 CB THR A 822 -40.467 14.097 8.184 1.00 42.88 C ATOM 809 OG1 THR A 822 -39.213 13.728 8.736 1.00 45.51 O ATOM 810 CG2 THR A 822 -40.566 13.605 6.729 1.00 36.38 C ATOM 811 HG1 THR A 822 -38.490 14.212 8.264 1.00 0.00 H ATOM 812 H THR A 822 -38.885 16.537 7.475 1.00 0.00 H ATOM 813 N ASN A 823 -39.563 17.131 9.984 1.00 39.60 N ATOM 814 CA ASN A 823 -39.130 17.608 11.307 1.00 39.37 C ATOM 815 C ASN A 823 -38.365 16.469 12.016 1.00 44.59 C ATOM 816 O ASN A 823 -38.419 16.361 13.238 1.00 43.79 O ATOM 817 CB ASN A 823 -40.324 18.091 12.173 1.00 40.28 C ATOM 818 CG ASN A 823 -40.934 19.407 11.772 1.00 50.81 C ATOM 819 OD1 ASN A 823 -41.470 19.566 10.684 1.00 42.72 O ATOM 820 ND2 ASN A 823 -40.941 20.357 12.683 1.00 40.95 N ATOM 821 HD22 ASN A 823 -40.479 20.200 13.601 1.00 0.00 H ATOM 822 HD21 ASN A 823 -41.409 21.264 12.484 1.00 0.00 H ATOM 823 H ASN A 823 -39.230 17.647 9.145 1.00 0.00 H ATOM 824 N SER A 824 -37.694 15.586 11.221 1.00 41.12 N ATOM 825 CA SER A 824 -36.876 14.459 11.679 1.00 39.79 C ATOM 826 C SER A 824 -37.672 13.378 12.408 1.00 44.54 C ATOM 827 O SER A 824 -37.121 12.717 13.287 1.00 43.66 O ATOM 828 CB SER A 824 -35.688 14.933 12.515 1.00 42.06 C ATOM 829 OG SER A 824 -34.908 15.869 11.786 1.00 52.37 O ATOM 830 HG SER A 824 -34.144 16.165 12.342 1.00 0.00 H ATOM 831 H SER A 824 -37.770 15.726 10.193 1.00 0.00 H ATOM 832 N GLN A 825 -38.953 13.164 12.022 1.00 41.28 N ATOM 833 CA GLN A 825 -39.745 12.043 12.546 1.00 41.23 C ATOM 834 C GLN A 825 -39.398 10.790 11.694 1.00 43.77 C ATOM 835 O GLN A 825 -39.436 9.668 12.197 1.00 41.95 O ATOM 836 CB GLN A 825 -41.257 12.307 12.428 1.00 42.24 C ATOM 837 CG GLN A 825 -41.790 13.364 13.386 1.00 55.52 C ATOM 838 CD GLN A 825 -43.302 13.379 13.413 1.00 66.69 C ATOM 839 OE1 GLN A 825 -43.970 13.539 12.387 1.00 57.25 O ATOM 840 NE2 GLN A 825 -43.874 13.253 14.604 1.00 58.72 N ATOM 841 HE22 GLN A 825 -43.286 13.119 15.452 1.00 0.00 H ATOM 842 HE21 GLN A 825 -44.910 13.288 14.690 1.00 0.00 H ATOM 843 H GLN A 825 -39.388 13.812 11.335 1.00 0.00 H ATOM 844 N PHE A 826 -39.101 10.992 10.397 1.00 40.11 N ATOM 845 CA PHE A 826 -38.812 9.886 9.485 1.00 40.34 C ATOM 846 C PHE A 826 -37.580 10.166 8.655 1.00 44.81 C ATOM 847 O PHE A 826 -37.106 11.301 8.611 1.00 44.54 O ATOM 848 CB PHE A 826 -39.999 9.627 8.527 1.00 41.98 C ATOM 849 CG PHE A 826 -41.349 9.488 9.181 1.00 43.64 C ATOM 850 CD1 PHE A 826 -41.755 8.274 9.728 1.00 47.33 C ATOM 851 CD2 PHE A 826 -42.215 10.573 9.263 1.00 45.40 C ATOM 852 CE1 PHE A 826 -42.992 8.155 10.364 1.00 47.68 C ATOM 853 CE2 PHE A 826 -43.452 10.456 9.901 1.00 47.85 C ATOM 854 CZ PHE A 826 -43.832 9.246 10.441 1.00 46.43 C ATOM 855 H PHE A 826 -39.076 11.965 10.032 1.00 0.00 H ATOM 856 N LEU A 827 -37.064 9.118 7.999 1.00 40.73 N ATOM 857 CA LEU A 827 -35.947 9.235 7.095 1.00 40.23 C ATOM 858 C LEU A 827 -36.541 9.409 5.710 1.00 43.74 C ATOM 859 O LEU A 827 -37.178 8.516 5.154 1.00 42.47 O ATOM 860 CB LEU A 827 -34.967 8.053 7.190 1.00 40.09 C ATOM 861 CG LEU A 827 -34.228 7.860 8.540 1.00 43.78 C ATOM 862 CD1 LEU A 827 -33.477 6.561 8.535 1.00 43.52 C ATOM 863 CD2 LEU A 827 -33.240 8.988 8.810 1.00 44.87 C ATOM 864 H LEU A 827 -37.487 8.180 8.148 1.00 0.00 H ATOM 865 N TYR A 828 -36.378 10.609 5.195 1.00 40.51 N ATOM 866 CA TYR A 828 -36.887 11.024 3.913 1.00 39.96 C ATOM 867 C TYR A 828 -35.855 10.672 2.830 1.00 42.38 C ATOM 868 O TYR A 828 -35.115 11.541 2.353 1.00 41.71 O ATOM 869 CB TYR A 828 -37.197 12.524 3.997 1.00 41.08 C ATOM 870 CG TYR A 828 -38.071 13.059 2.887 1.00 43.79 C ATOM 871 CD1 TYR A 828 -37.516 13.479 1.678 1.00 45.72 C ATOM 872 CD2 TYR A 828 -39.434 13.272 3.087 1.00 44.06 C ATOM 873 CE1 TYR A 828 -38.300 14.055 0.682 1.00 46.61 C ATOM 874 CE2 TYR A 828 -40.233 13.825 2.084 1.00 45.03 C ATOM 875 CZ TYR A 828 -39.653 14.244 0.896 1.00 52.82 C ATOM 876 OH TYR A 828 -40.406 14.819 -0.097 1.00 56.00 O ATOM 877 HH TYR A 828 -41.102 14.180 -0.394 1.00 0.00 H ATOM 878 H TYR A 828 -35.845 11.306 5.752 1.00 0.00 H ATOM 879 N PHE A 829 -35.789 9.380 2.457 1.00 38.73 N ATOM 880 CA PHE A 829 -34.836 8.930 1.425 1.00 38.85 C ATOM 881 C PHE A 829 -35.089 9.603 0.089 1.00 43.33 C ATOM 882 O PHE A 829 -34.151 10.031 -0.586 1.00 43.81 O ATOM 883 CB PHE A 829 -34.832 7.399 1.285 1.00 39.98 C ATOM 884 CG PHE A 829 -34.156 6.693 2.431 1.00 40.40 C ATOM 885 CD1 PHE A 829 -32.785 6.466 2.418 1.00 42.64 C ATOM 886 CD2 PHE A 829 -34.883 6.282 3.542 1.00 41.99 C ATOM 887 CE1 PHE A 829 -32.161 5.804 3.482 1.00 43.25 C ATOM 888 CE2 PHE A 829 -34.255 5.628 4.610 1.00 43.97 C ATOM 889 CZ PHE A 829 -32.905 5.377 4.564 1.00 41.91 C ATOM 890 H PHE A 829 -36.422 8.687 2.905 1.00 0.00 H ATOM 891 N ALA A 830 -36.365 9.744 -0.251 1.00 40.16 N ATOM 892 CA ALA A 830 -36.852 10.361 -1.485 1.00 40.33 C ATOM 893 C ALA A 830 -38.314 10.740 -1.216 1.00 46.80 C ATOM 894 O ALA A 830 -38.861 10.227 -0.243 1.00 45.86 O ATOM 895 CB ALA A 830 -36.758 9.345 -2.633 1.00 40.50 C ATOM 896 H ALA A 830 -37.078 9.386 0.416 1.00 0.00 H ATOM 897 N PRO A 831 -39.001 11.600 -2.013 1.00 46.60 N ATOM 898 CA PRO A 831 -40.421 11.911 -1.686 1.00 46.84 C ATOM 899 C PRO A 831 -41.353 10.699 -1.618 1.00 52.31 C ATOM 900 O PRO A 831 -42.310 10.705 -0.844 1.00 53.13 O ATOM 901 CB PRO A 831 -40.839 12.892 -2.786 1.00 48.27 C ATOM 902 CG PRO A 831 -39.533 13.462 -3.311 1.00 52.45 C ATOM 903 CD PRO A 831 -38.541 12.350 -3.205 1.00 47.64 C ATOM 904 N ASP A 832 -41.018 9.642 -2.379 1.00 49.38 N ATOM 905 CA ASP A 832 -41.738 8.373 -2.506 1.00 49.21 C ATOM 906 C ASP A 832 -41.160 7.209 -1.671 1.00 53.18 C ATOM 907 O ASP A 832 -41.556 6.062 -1.871 1.00 53.69 O ATOM 908 CB ASP A 832 -41.845 7.978 -3.989 1.00 50.99 C ATOM 909 CG ASP A 832 -40.523 7.821 -4.731 1.00 63.49 C ATOM 910 OD1 ASP A 832 -39.533 8.488 -4.347 1.00 64.24 O ATOM 911 OD2 ASP A 832 -40.496 7.083 -5.730 1.00 67.75 O ATOM 912 H ASP A 832 -40.148 9.737 -2.942 1.00 0.00 H ATOM 913 N LEU A 833 -40.264 7.499 -0.721 1.00 48.50 N ATOM 914 CA LEU A 833 -39.662 6.494 0.161 1.00 47.78 C ATOM 915 C LEU A 833 -39.274 7.167 1.503 1.00 48.48 C ATOM 916 O LEU A 833 -38.177 7.691 1.669 1.00 47.40 O ATOM 917 CB LEU A 833 -38.493 5.790 -0.564 1.00 47.92 C ATOM 918 CG LEU A 833 -37.721 4.657 0.135 1.00 53.77 C ATOM 919 CD1 LEU A 833 -38.639 3.517 0.603 1.00 54.06 C ATOM 920 CD2 LEU A 833 -36.665 4.095 -0.806 1.00 56.75 C ATOM 921 H LEU A 833 -39.979 8.492 -0.601 1.00 0.00 H ATOM 922 N VAL A 834 -40.249 7.226 2.418 1.00 44.26 N ATOM 923 CA VAL A 834 -40.170 7.878 3.736 1.00 43.46 C ATOM 924 C VAL A 834 -40.515 6.887 4.867 1.00 48.95 C ATOM 925 O VAL A 834 -41.662 6.448 4.954 1.00 49.56 O ATOM 926 CB VAL A 834 -41.122 9.104 3.748 1.00 46.43 C ATOM 927 CG1 VAL A 834 -41.039 9.864 5.066 1.00 46.63 C ATOM 928 CG2 VAL A 834 -40.846 10.034 2.571 1.00 45.77 C ATOM 929 H VAL A 834 -41.150 6.767 2.175 1.00 0.00 H ATOM 930 N PHE A 835 -39.545 6.553 5.746 1.00 45.38 N ATOM 931 CA PHE A 835 -39.780 5.629 6.871 1.00 45.11 C ATOM 932 C PHE A 835 -38.775 5.815 7.995 1.00 50.89 C ATOM 933 O PHE A 835 -37.754 6.444 7.766 1.00 51.39 O ATOM 934 CB PHE A 835 -39.741 4.159 6.373 1.00 46.63 C ATOM 935 CG PHE A 835 -38.416 3.684 5.812 1.00 47.49 C ATOM 936 CD1 PHE A 835 -38.129 3.815 4.460 1.00 50.48 C ATOM 937 CD2 PHE A 835 -37.476 3.068 6.630 1.00 48.85 C ATOM 938 CE1 PHE A 835 -36.918 3.356 3.938 1.00 51.15 C ATOM 939 CE2 PHE A 835 -36.255 2.631 6.113 1.00 51.59 C ATOM 940 CZ PHE A 835 -35.993 2.761 4.766 1.00 50.24 C ATOM 941 H PHE A 835 -38.597 6.963 5.625 1.00 0.00 H ATOM 942 N ASN A 836 -39.017 5.210 9.188 1.00 49.33 N ATOM 943 CA ASN A 836 -38.060 5.206 10.307 1.00 49.75 C ATOM 944 C ASN A 836 -37.785 3.767 10.820 1.00 55.13 C ATOM 945 O ASN A 836 -38.177 2.816 10.153 1.00 54.39 O ATOM 946 CB ASN A 836 -38.450 6.178 11.421 1.00 50.73 C ATOM 947 CG ASN A 836 -39.800 5.972 12.069 1.00 63.54 C ATOM 948 OD1 ASN A 836 -40.366 4.880 12.130 1.00 61.24 O ATOM 949 ND2 ASN A 836 -40.306 7.027 12.648 1.00 54.71 N ATOM 950 HD22 ASN A 836 -39.814 7.941 12.586 1.00 0.00 H ATOM 951 HD21 ASN A 836 -41.202 6.954 13.172 1.00 0.00 H ATOM 952 H ASN A 836 -39.927 4.724 9.317 1.00 0.00 H ATOM 953 N GLU A 837 -37.067 3.615 11.959 1.00 54.08 N ATOM 954 CA GLU A 837 -36.667 2.332 12.586 1.00 54.53 C ATOM 955 C GLU A 837 -37.828 1.371 12.792 1.00 61.09 C ATOM 956 O GLU A 837 -37.610 0.161 12.769 1.00 61.21 O ATOM 957 CB GLU A 837 -36.063 2.525 13.995 1.00 55.46 C ATOM 958 CG GLU A 837 -35.108 3.655 14.211 1.00 67.31 C ATOM 959 CD GLU A 837 -35.814 4.948 14.519 1.00 80.09 C ATOM 960 OE1 GLU A 837 -36.198 5.159 15.692 1.00 69.25 O ATOM 961 OE2 GLU A 837 -36.077 5.701 13.555 1.00 76.28 O ATOM 962 H GLU A 837 -36.766 4.486 12.442 1.00 0.00 H ATOM 963 N GLU A 838 -39.025 1.898 13.109 1.00 59.58 N ATOM 964 CA GLU A 838 -40.212 1.092 13.415 1.00 61.35 C ATOM 965 C GLU A 838 -40.601 0.124 12.288 1.00 66.43 C ATOM 966 O GLU A 838 -41.236 -0.898 12.561 1.00 68.54 O ATOM 967 CB GLU A 838 -41.399 1.968 13.849 1.00 63.21 C ATOM 968 CG GLU A 838 -41.231 2.531 15.257 1.00 78.52 C ATOM 969 CD GLU A 838 -40.948 4.018 15.348 1.00112.30 C ATOM 970 OE1 GLU A 838 -41.849 4.818 15.004 1.00112.67 O ATOM 971 OE2 GLU A 838 -39.840 4.385 15.803 1.00112.28 O ATOM 972 H GLU A 838 -39.113 2.934 13.139 1.00 0.00 H ATOM 973 N LYS A 839 -40.164 0.401 11.051 1.00 60.45 N ATOM 974 CA LYS A 839 -40.408 -0.480 9.915 1.00 59.35 C ATOM 975 C LYS A 839 -39.333 -1.574 9.787 1.00 62.06 C ATOM 976 O LYS A 839 -39.467 -2.465 8.948 1.00 61.63 O ATOM 977 CB LYS A 839 -40.585 0.324 8.618 1.00 62.04 C ATOM 978 CG LYS A 839 -41.952 1.006 8.548 1.00 83.71 C ATOM 979 CD LYS A 839 -42.313 1.454 7.146 1.00 99.62 C ATOM 980 CE LYS A 839 -43.720 2.007 7.063 1.00114.18 C ATOM 981 NZ LYS A 839 -43.774 3.458 7.393 1.00122.49 N ATOM 982 HZ1 LYS A 839 -43.425 3.605 8.362 1.00 0.00 H ATOM 983 HZ2 LYS A 839 -43.178 3.987 6.724 1.00 0.00 H ATOM 984 HZ3 LYS A 839 -44.756 3.792 7.323 1.00 0.00 H ATOM 985 H LYS A 839 -39.630 1.280 10.896 1.00 0.00 H ATOM 986 N MET A 840 -38.287 -1.528 10.638 1.00 58.43 N ATOM 987 CA MET A 840 -37.176 -2.486 10.610 1.00 58.70 C ATOM 988 C MET A 840 -37.322 -3.575 11.662 1.00 69.51 C ATOM 989 O MET A 840 -37.518 -3.281 12.841 1.00 69.76 O ATOM 990 CB MET A 840 -35.817 -1.777 10.750 1.00 60.12 C ATOM 991 CG MET A 840 -35.630 -0.573 9.819 1.00 62.29 C ATOM 992 SD MET A 840 -35.300 -1.010 8.110 1.00 64.67 S ATOM 993 CE MET A 840 -36.859 -0.662 7.373 1.00 60.74 C ATOM 994 H MET A 840 -38.267 -0.773 11.353 1.00 0.00 H ATOM 995 N HIS A 841 -37.212 -4.840 11.235 1.00 70.99 N ATOM 996 CA HIS A 841 -37.339 -5.990 12.135 1.00 72.58 C ATOM 997 C HIS A 841 -35.973 -6.616 12.493 1.00 74.29 C ATOM 998 O HIS A 841 -35.821 -7.116 13.614 1.00 73.57 O ATOM 999 CB HIS A 841 -38.344 -7.013 11.573 1.00 74.74 C ATOM 1000 CG HIS A 841 -39.656 -6.385 11.175 1.00 79.53 C ATOM 1001 ND1 HIS A 841 -40.513 -5.815 12.124 1.00 81.97 N ATOM 1002 CD2 HIS A 841 -40.196 -6.213 9.944 1.00 82.02 C ATOM 1003 CE1 HIS A 841 -41.538 -5.330 11.438 1.00 81.60 C ATOM 1004 NE2 HIS A 841 -41.400 -5.549 10.126 1.00 81.99 N ATOM 1005 H HIS A 841 -37.029 -5.013 10.226 1.00 0.00 H ATOM 1006 N GLN A 842 -34.971 -6.533 11.579 1.00 68.63 N ATOM 1007 CA GLN A 842 -33.617 -7.049 11.843 1.00 67.47 C ATOM 1008 C GLN A 842 -32.848 -6.044 12.701 1.00 69.13 C ATOM 1009 O GLN A 842 -32.779 -4.863 12.359 1.00 68.71 O ATOM 1010 CB GLN A 842 -32.857 -7.367 10.545 1.00 68.87 C ATOM 1011 CG GLN A 842 -33.346 -8.625 9.834 1.00 85.04 C ATOM 1012 CD GLN A 842 -32.958 -8.647 8.376 1.00102.70 C ATOM 1013 OE1 GLN A 842 -31.772 -8.708 8.018 1.00 96.82 O ATOM 1014 NE2 GLN A 842 -33.959 -8.620 7.500 1.00 92.26 N ATOM 1015 HE22 GLN A 842 -34.942 -8.569 7.835 1.00 0.00 H ATOM 1016 HE21 GLN A 842 -33.758 -8.650 6.480 1.00 0.00 H ATOM 1017 H GLN A 842 -35.167 -6.089 10.659 1.00 0.00 H ATOM 1018 N SER A 843 -32.302 -6.522 13.830 1.00 63.83 N ATOM 1019 CA SER A 843 -31.571 -5.751 14.830 1.00 62.30 C ATOM 1020 C SER A 843 -30.555 -4.761 14.254 1.00 64.90 C ATOM 1021 O SER A 843 -30.570 -3.587 14.644 1.00 65.51 O ATOM 1022 CB SER A 843 -30.905 -6.686 15.833 1.00 64.17 C ATOM 1023 OG SER A 843 -30.609 -6.005 17.041 1.00 70.29 O ATOM 1024 HG SER A 843 -29.995 -5.251 16.852 1.00 0.00 H ATOM 1025 H SER A 843 -32.410 -7.541 14.009 1.00 0.00 H ATOM 1026 N ALA A 844 -29.686 -5.234 13.330 1.00 58.73 N ATOM 1027 CA ALA A 844 -28.628 -4.451 12.680 1.00 56.87 C ATOM 1028 C ALA A 844 -29.216 -3.339 11.816 1.00 58.12 C ATOM 1029 O ALA A 844 -28.769 -2.201 11.911 1.00 58.09 O ATOM 1030 CB ALA A 844 -27.741 -5.358 11.838 1.00 57.30 C ATOM 1031 H ALA A 844 -29.775 -6.234 13.058 1.00 0.00 H ATOM 1032 N MET A 845 -30.240 -3.662 11.017 1.00 52.45 N ATOM 1033 CA MET A 845 -30.934 -2.715 10.162 1.00 52.49 C ATOM 1034 C MET A 845 -31.646 -1.617 10.964 1.00 55.10 C ATOM 1035 O MET A 845 -31.627 -0.460 10.554 1.00 55.00 O ATOM 1036 CB MET A 845 -31.889 -3.451 9.214 1.00 55.54 C ATOM 1037 CG MET A 845 -31.176 -3.980 7.967 1.00 59.87 C ATOM 1038 SD MET A 845 -32.200 -4.893 6.780 1.00 64.43 S ATOM 1039 CE MET A 845 -33.244 -3.588 6.124 1.00 60.97 C ATOM 1040 H MET A 845 -30.558 -4.652 11.008 1.00 0.00 H ATOM 1041 N TYR A 846 -32.214 -1.969 12.137 1.00 49.73 N ATOM 1042 CA TYR A 846 -32.887 -1.049 13.047 1.00 47.70 C ATOM 1043 C TYR A 846 -31.880 -0.040 13.560 1.00 48.92 C ATOM 1044 O TYR A 846 -32.142 1.153 13.498 1.00 48.72 O ATOM 1045 CB TYR A 846 -33.545 -1.832 14.213 1.00 49.14 C ATOM 1046 CG TYR A 846 -34.288 -0.979 15.227 1.00 50.36 C ATOM 1047 CD1 TYR A 846 -33.615 -0.361 16.276 1.00 51.98 C ATOM 1048 CD2 TYR A 846 -35.670 -0.831 15.164 1.00 51.22 C ATOM 1049 CE1 TYR A 846 -34.284 0.455 17.185 1.00 53.40 C ATOM 1050 CE2 TYR A 846 -36.361 -0.068 16.107 1.00 52.34 C ATOM 1051 CZ TYR A 846 -35.659 0.598 17.100 1.00 60.91 C ATOM 1052 OH TYR A 846 -36.323 1.371 18.027 1.00 64.02 O ATOM 1053 HH TYR A 846 -35.668 1.768 18.654 1.00 0.00 H ATOM 1054 H TYR A 846 -32.168 -2.971 12.412 1.00 0.00 H ATOM 1055 N GLU A 847 -30.730 -0.517 14.061 1.00 45.56 N ATOM 1056 CA GLU A 847 -29.651 0.312 14.630 1.00 44.48 C ATOM 1057 C GLU A 847 -29.048 1.291 13.625 1.00 46.54 C ATOM 1058 O GLU A 847 -28.699 2.408 14.011 1.00 45.80 O ATOM 1059 CB GLU A 847 -28.545 -0.567 15.210 1.00 45.46 C ATOM 1060 CG GLU A 847 -28.916 -1.282 16.496 1.00 57.00 C ATOM 1061 CD GLU A 847 -28.061 -2.495 16.815 1.00 75.79 C ATOM 1062 OE1 GLU A 847 -26.817 -2.402 16.698 1.00 68.52 O ATOM 1063 OE2 GLU A 847 -28.637 -3.540 17.192 1.00 64.98 O ATOM 1064 H GLU A 847 -30.589 -1.547 14.047 1.00 0.00 H ATOM 1065 N LEU A 848 -28.891 0.866 12.345 1.00 41.22 N ATOM 1066 CA LEU A 848 -28.340 1.742 11.300 1.00 40.52 C ATOM 1067 C LEU A 848 -29.345 2.852 10.978 1.00 46.30 C ATOM 1068 O LEU A 848 -28.960 4.022 10.938 1.00 45.54 O ATOM 1069 CB LEU A 848 -27.925 0.962 10.043 1.00 39.23 C ATOM 1070 CG LEU A 848 -26.829 -0.080 10.233 1.00 41.29 C ATOM 1071 CD1 LEU A 848 -26.739 -0.943 9.039 1.00 41.95 C ATOM 1072 CD2 LEU A 848 -25.496 0.552 10.543 1.00 40.22 C ATOM 1073 H LEU A 848 -29.168 -0.105 12.097 1.00 0.00 H ATOM 1074 N CYS A 849 -30.639 2.475 10.879 1.00 44.64 N ATOM 1075 CA CYS A 849 -31.790 3.345 10.668 1.00 47.38 C ATOM 1076 C CYS A 849 -31.885 4.372 11.819 1.00 50.91 C ATOM 1077 O CYS A 849 -32.002 5.574 11.559 1.00 49.92 O ATOM 1078 CB CYS A 849 -33.058 2.504 10.553 1.00 49.81 C ATOM 1079 SG CYS A 849 -34.418 3.312 9.671 1.00 55.26 S ATOM 1080 H CYS A 849 -30.835 1.457 10.962 1.00 0.00 H ATOM 1081 N GLN A 850 -31.751 3.895 13.082 1.00 47.02 N ATOM 1082 CA GLN A 850 -31.771 4.715 14.302 1.00 46.39 C ATOM 1083 C GLN A 850 -30.618 5.693 14.362 1.00 47.24 C ATOM 1084 O GLN A 850 -30.833 6.850 14.740 1.00 46.60 O ATOM 1085 CB GLN A 850 -31.808 3.839 15.576 1.00 47.97 C ATOM 1086 CG GLN A 850 -32.153 4.629 16.833 1.00 63.19 C ATOM 1087 CD GLN A 850 -32.623 3.737 17.944 1.00 90.55 C ATOM 1088 OE1 GLN A 850 -31.820 3.127 18.661 1.00 85.29 O ATOM 1089 NE2 GLN A 850 -33.941 3.665 18.125 1.00 84.72 N ATOM 1090 HE22 GLN A 850 -34.581 4.194 17.499 1.00 0.00 H ATOM 1091 HE21 GLN A 850 -34.329 3.080 18.892 1.00 0.00 H ATOM 1092 H GLN A 850 -31.624 2.869 13.196 1.00 0.00 H ATOM 1093 N GLY A 851 -29.412 5.228 14.008 1.00 41.41 N ATOM 1094 CA GLY A 851 -28.211 6.064 13.977 1.00 39.90 C ATOM 1095 C GLY A 851 -28.390 7.246 13.043 1.00 43.15 C ATOM 1096 O GLY A 851 -28.096 8.385 13.414 1.00 43.85 O ATOM 1097 H GLY A 851 -29.325 4.226 13.743 1.00 0.00 H ATOM 1098 N MET A 852 -28.957 6.992 11.852 1.00 38.48 N ATOM 1099 CA MET A 852 -29.226 8.041 10.870 1.00 38.91 C ATOM 1100 C MET A 852 -30.308 9.003 11.346 1.00 43.11 C ATOM 1101 O MET A 852 -30.215 10.195 11.069 1.00 42.66 O ATOM 1102 CB MET A 852 -29.571 7.454 9.494 1.00 40.82 C ATOM 1103 CG MET A 852 -28.362 6.887 8.793 1.00 44.08 C ATOM 1104 SD MET A 852 -28.691 6.335 7.102 1.00 48.20 S ATOM 1105 CE MET A 852 -29.876 4.997 7.382 1.00 43.78 C ATOM 1106 H MET A 852 -29.214 6.012 11.620 1.00 0.00 H ATOM 1107 N HIS A 853 -31.330 8.480 12.048 1.00 39.86 N ATOM 1108 CA HIS A 853 -32.433 9.250 12.634 1.00 39.46 C ATOM 1109 C HIS A 853 -31.899 10.192 13.741 1.00 41.92 C ATOM 1110 O HIS A 853 -32.323 11.333 13.811 1.00 41.98 O ATOM 1111 CB HIS A 853 -33.486 8.276 13.208 1.00 40.51 C ATOM 1112 CG HIS A 853 -34.801 8.904 13.562 1.00 44.33 C ATOM 1113 ND1 HIS A 853 -35.718 8.244 14.354 1.00 46.40 N ATOM 1114 CD2 HIS A 853 -35.318 10.107 13.215 1.00 46.48 C ATOM 1115 CE1 HIS A 853 -36.767 9.038 14.439 1.00 46.10 C ATOM 1116 NE2 HIS A 853 -36.557 10.185 13.799 1.00 46.56 N ATOM 1117 H HIS A 853 -31.339 7.449 12.186 1.00 0.00 H ATOM 1118 N GLN A 854 -30.943 9.718 14.567 1.00 39.18 N ATOM 1119 CA GLN A 854 -30.295 10.466 15.653 1.00 38.44 C ATOM 1120 C GLN A 854 -29.542 11.657 15.144 1.00 42.87 C ATOM 1121 O GLN A 854 -29.543 12.673 15.817 1.00 44.18 O ATOM 1122 CB GLN A 854 -29.395 9.576 16.540 1.00 39.21 C ATOM 1123 CG GLN A 854 -30.146 8.494 17.355 1.00 45.96 C ATOM 1124 CD GLN A 854 -31.378 8.988 18.098 1.00 66.54 C ATOM 1125 OE1 GLN A 854 -31.326 9.936 18.888 1.00 57.45 O ATOM 1126 NE2 GLN A 854 -32.512 8.326 17.889 1.00 57.65 N ATOM 1127 HE22 GLN A 854 -32.534 7.531 17.219 1.00 0.00 H ATOM 1128 HE21 GLN A 854 -33.377 8.604 18.395 1.00 0.00 H ATOM 1129 H GLN A 854 -30.637 8.735 14.422 1.00 0.00 H ATOM 1130 N ILE A 855 -28.945 11.575 13.938 1.00 39.26 N ATOM 1131 CA ILE A 855 -28.282 12.736 13.329 1.00 38.45 C ATOM 1132 C ILE A 855 -29.349 13.766 12.963 1.00 41.57 C ATOM 1133 O ILE A 855 -29.198 14.940 13.290 1.00 42.10 O ATOM 1134 CB ILE A 855 -27.365 12.375 12.111 1.00 40.81 C ATOM 1135 CG1 ILE A 855 -26.221 11.424 12.525 1.00 39.90 C ATOM 1136 CG2 ILE A 855 -26.818 13.665 11.401 1.00 40.85 C ATOM 1137 CD1 ILE A 855 -25.193 11.930 13.531 1.00 45.18 C ATOM 1138 H ILE A 855 -28.954 10.669 13.427 1.00 0.00 H ATOM 1139 N SER A 856 -30.434 13.318 12.327 1.00 38.10 N ATOM 1140 CA SER A 856 -31.558 14.174 11.919 1.00 38.31 C ATOM 1141 C SER A 856 -32.125 14.928 13.111 1.00 41.10 C ATOM 1142 O SER A 856 -32.391 16.117 12.981 1.00 41.02 O ATOM 1143 CB SER A 856 -32.657 13.340 11.268 1.00 42.08 C ATOM 1144 OG SER A 856 -32.096 12.468 10.303 1.00 56.69 O ATOM 1145 HG SER A 856 -31.446 11.865 10.743 1.00 0.00 H ATOM 1146 H SER A 856 -30.487 12.303 12.107 1.00 0.00 H ATOM 1147 N LEU A 857 -32.290 14.247 14.274 1.00 37.12 N ATOM 1148 CA LEU A 857 -32.835 14.828 15.508 1.00 37.18 C ATOM 1149 C LEU A 857 -31.922 15.884 16.088 1.00 41.68 C ATOM 1150 O LEU A 857 -32.393 16.867 16.661 1.00 41.76 O ATOM 1151 CB LEU A 857 -33.149 13.731 16.538 1.00 37.55 C ATOM 1152 CG LEU A 857 -34.305 12.795 16.166 1.00 40.77 C ATOM 1153 CD1 LEU A 857 -34.343 11.598 17.069 1.00 40.27 C ATOM 1154 CD2 LEU A 857 -35.612 13.516 16.212 1.00 40.92 C ATOM 1155 H LEU A 857 -32.011 13.245 14.292 1.00 0.00 H ATOM 1156 N GLN A 858 -30.614 15.717 15.876 1.00 39.02 N ATOM 1157 CA GLN A 858 -29.606 16.692 16.261 1.00 39.40 C ATOM 1158 C GLN A 858 -29.770 17.977 15.405 1.00 41.35 C ATOM 1159 O GLN A 858 -29.471 19.061 15.894 1.00 42.09 O ATOM 1160 CB GLN A 858 -28.188 16.094 16.141 1.00 41.26 C ATOM 1161 CG GLN A 858 -27.809 15.128 17.282 1.00 54.46 C ATOM 1162 CD GLN A 858 -26.378 14.623 17.180 1.00 76.88 C ATOM 1163 OE1 GLN A 858 -25.405 15.396 17.213 1.00 67.90 O ATOM 1164 NE2 GLN A 858 -26.213 13.305 17.104 1.00 71.57 N ATOM 1165 HE22 GLN A 858 -27.042 12.678 17.078 1.00 0.00 H ATOM 1166 HE21 GLN A 858 -25.255 12.902 17.071 1.00 0.00 H ATOM 1167 H GLN A 858 -30.299 14.842 15.410 1.00 0.00 H ATOM 1168 N PHE A 859 -30.299 17.868 14.169 1.00 35.51 N ATOM 1169 CA PHE A 859 -30.572 19.041 13.328 1.00 35.38 C ATOM 1170 C PHE A 859 -31.756 19.820 13.945 1.00 43.02 C ATOM 1171 O PHE A 859 -31.751 21.046 13.919 1.00 43.09 O ATOM 1172 CB PHE A 859 -30.910 18.630 11.881 1.00 36.46 C ATOM 1173 CG PHE A 859 -29.775 18.175 10.983 1.00 37.60 C ATOM 1174 CD1 PHE A 859 -28.548 17.784 11.517 1.00 41.12 C ATOM 1175 CD2 PHE A 859 -29.933 18.138 9.607 1.00 38.58 C ATOM 1176 CE1 PHE A 859 -27.500 17.392 10.685 1.00 41.57 C ATOM 1177 CE2 PHE A 859 -28.889 17.729 8.780 1.00 41.53 C ATOM 1178 CZ PHE A 859 -27.687 17.343 9.325 1.00 39.73 C ATOM 1179 H PHE A 859 -30.521 16.922 13.799 1.00 0.00 H ATOM 1180 N VAL A 860 -32.759 19.100 14.513 1.00 40.06 N ATOM 1181 CA VAL A 860 -33.905 19.721 15.168 1.00 40.25 C ATOM 1182 C VAL A 860 -33.449 20.456 16.441 1.00 43.06 C ATOM 1183 O VAL A 860 -33.878 21.588 16.676 1.00 42.53 O ATOM 1184 CB VAL A 860 -35.066 18.719 15.444 1.00 44.06 C ATOM 1185 CG1 VAL A 860 -36.121 19.343 16.349 1.00 42.98 C ATOM 1186 CG2 VAL A 860 -35.710 18.256 14.137 1.00 43.99 C ATOM 1187 H VAL A 860 -32.707 18.062 14.479 1.00 0.00 H ATOM 1188 N ARG A 861 -32.563 19.811 17.234 1.00 38.29 N ATOM 1189 CA ARG A 861 -32.024 20.365 18.469 1.00 37.31 C ATOM 1190 C ARG A 861 -31.211 21.610 18.180 1.00 43.92 C ATOM 1191 O ARG A 861 -31.378 22.603 18.870 1.00 43.81 O ATOM 1192 CB ARG A 861 -31.208 19.315 19.240 1.00 35.12 C ATOM 1193 CG ARG A 861 -30.648 19.855 20.553 1.00 47.27 C ATOM 1194 CD ARG A 861 -29.550 18.986 21.118 1.00 51.71 C ATOM 1195 NE ARG A 861 -30.107 17.769 21.699 1.00 55.80 N ATOM 1196 CZ ARG A 861 -30.421 17.610 22.978 1.00 63.26 C ATOM 1197 NH1 ARG A 861 -30.214 18.594 23.847 1.00 44.89 N ATOM 1198 NH2 ARG A 861 -30.937 16.465 23.402 1.00 46.86 N ATOM 1199 HE ARG A 861 -30.270 16.964 21.061 1.00 0.00 H ATOM 1200 HH12 ARG A 861 -30.462 18.464 24.849 1.00 0.00 H ATOM 1201 HH11 ARG A 861 -29.804 19.494 23.525 1.00 0.00 H ATOM 1202 HH22 ARG A 861 -31.182 16.345 24.406 1.00 0.00 H ATOM 1203 HH21 ARG A 861 -31.097 15.687 22.731 1.00 0.00 H ATOM 1204 H ARG A 861 -32.248 18.863 16.945 1.00 0.00 H ATOM 1205 N LEU A 862 -30.379 21.580 17.129 1.00 43.00 N ATOM 1206 CA LEU A 862 -29.566 22.733 16.727 1.00 42.60 C ATOM 1207 C LEU A 862 -30.365 23.783 15.965 1.00 44.65 C ATOM 1208 O LEU A 862 -29.951 24.946 15.923 1.00 42.90 O ATOM 1209 CB LEU A 862 -28.376 22.295 15.848 1.00 42.00 C ATOM 1210 CG LEU A 862 -27.259 21.544 16.551 1.00 46.26 C ATOM 1211 CD1 LEU A 862 -26.483 20.707 15.572 1.00 45.52 C ATOM 1212 CD2 LEU A 862 -26.335 22.493 17.270 1.00 50.46 C ATOM 1213 H LEU A 862 -30.307 20.702 16.576 1.00 0.00 H ATOM 1214 N GLN A 863 -31.465 23.370 15.313 1.00 40.87 N ATOM 1215 CA GLN A 863 -32.218 24.225 14.393 1.00 41.72 C ATOM 1216 C GLN A 863 -31.194 24.657 13.320 1.00 47.32 C ATOM 1217 O GLN A 863 -30.894 25.840 13.152 1.00 48.42 O ATOM 1218 CB GLN A 863 -32.927 25.416 15.109 1.00 43.15 C ATOM 1219 CG GLN A 863 -34.160 24.989 15.946 1.00 48.08 C ATOM 1220 CD GLN A 863 -35.287 24.481 15.066 1.00 61.42 C ATOM 1221 OE1 GLN A 863 -35.817 25.211 14.224 1.00 57.32 O ATOM 1222 NE2 GLN A 863 -35.648 23.202 15.207 1.00 45.83 N ATOM 1223 HE22 GLN A 863 -35.186 22.607 15.924 1.00 0.00 H ATOM 1224 HE21 GLN A 863 -36.391 22.801 14.599 1.00 0.00 H ATOM 1225 H GLN A 863 -31.797 22.397 15.469 1.00 0.00 H ATOM 1226 N LEU A 864 -30.557 23.646 12.707 1.00 42.57 N ATOM 1227 CA LEU A 864 -29.519 23.808 11.696 1.00 41.51 C ATOM 1228 C LEU A 864 -30.051 24.609 10.513 1.00 44.44 C ATOM 1229 O LEU A 864 -31.172 24.364 10.049 1.00 44.29 O ATOM 1230 CB LEU A 864 -29.033 22.429 11.222 1.00 40.90 C ATOM 1231 CG LEU A 864 -27.691 22.398 10.517 1.00 43.93 C ATOM 1232 CD1 LEU A 864 -26.559 22.413 11.528 1.00 43.45 C ATOM 1233 CD2 LEU A 864 -27.585 21.193 9.647 1.00 45.86 C ATOM 1234 H LEU A 864 -30.824 22.677 12.973 1.00 0.00 H ATOM 1235 N THR A 865 -29.270 25.586 10.059 1.00 39.42 N ATOM 1236 CA THR A 865 -29.685 26.419 8.928 1.00 39.30 C ATOM 1237 C THR A 865 -29.092 25.825 7.651 1.00 44.37 C ATOM 1238 O THR A 865 -28.154 25.020 7.727 1.00 42.69 O ATOM 1239 CB THR A 865 -29.249 27.877 9.140 1.00 42.71 C ATOM 1240 OG1 THR A 865 -27.820 27.943 9.059 1.00 40.33 O ATOM 1241 CG2 THR A 865 -29.734 28.457 10.477 1.00 37.22 C ATOM 1242 HG1 THR A 865 -27.424 27.367 9.760 1.00 0.00 H ATOM 1243 H THR A 865 -28.351 25.761 10.514 1.00 0.00 H ATOM 1244 N PHE A 866 -29.613 26.247 6.484 1.00 43.38 N ATOM 1245 CA PHE A 866 -29.127 25.814 5.170 1.00 43.62 C ATOM 1246 C PHE A 866 -27.661 26.199 4.915 1.00 49.42 C ATOM 1247 O PHE A 866 -26.907 25.386 4.364 1.00 50.01 O ATOM 1248 CB PHE A 866 -30.047 26.328 4.063 1.00 45.17 C ATOM 1249 CG PHE A 866 -29.708 25.826 2.684 1.00 46.97 C ATOM 1250 CD1 PHE A 866 -30.000 24.517 2.309 1.00 49.38 C ATOM 1251 CD2 PHE A 866 -29.109 26.667 1.750 1.00 50.09 C ATOM 1252 CE1 PHE A 866 -29.694 24.055 1.027 1.00 50.48 C ATOM 1253 CE2 PHE A 866 -28.807 26.203 0.463 1.00 53.14 C ATOM 1254 CZ PHE A 866 -29.113 24.903 0.108 1.00 50.61 C ATOM 1255 H PHE A 866 -30.406 26.919 6.516 1.00 0.00 H ATOM 1256 N GLU A 867 -27.259 27.418 5.342 1.00 45.68 N ATOM 1257 CA GLU A 867 -25.890 27.954 5.224 1.00 45.13 C ATOM 1258 C GLU A 867 -24.916 27.043 5.963 1.00 45.44 C ATOM 1259 O GLU A 867 -23.863 26.726 5.430 1.00 45.91 O ATOM 1260 CB GLU A 867 -25.797 29.345 5.886 1.00 47.06 C ATOM 1261 CG GLU A 867 -26.180 30.536 5.034 1.00 64.08 C ATOM 1262 CD GLU A 867 -25.873 31.883 5.673 1.00 95.16 C ATOM 1263 OE1 GLU A 867 -24.989 31.939 6.561 1.00 85.74 O ATOM 1264 OE2 GLU A 867 -26.510 32.887 5.278 1.00101.43 O ATOM 1265 H GLU A 867 -27.973 28.027 5.790 1.00 0.00 H ATOM 1266 N GLU A 868 -25.245 26.677 7.217 1.00 39.43 N ATOM 1267 CA GLU A 868 -24.418 25.819 8.067 1.00 38.21 C ATOM 1268 C GLU A 868 -24.275 24.449 7.436 1.00 41.16 C ATOM 1269 O GLU A 868 -23.167 23.936 7.319 1.00 41.43 O ATOM 1270 CB GLU A 868 -25.067 25.658 9.442 1.00 38.98 C ATOM 1271 CG GLU A 868 -24.800 26.807 10.391 1.00 40.31 C ATOM 1272 CD GLU A 868 -25.676 26.812 11.629 1.00 48.19 C ATOM 1273 OE1 GLU A 868 -26.781 26.225 11.593 1.00 41.78 O ATOM 1274 OE2 GLU A 868 -25.275 27.446 12.628 1.00 43.36 O ATOM 1275 H GLU A 868 -26.144 27.026 7.606 1.00 0.00 H ATOM 1276 N TYR A 869 -25.401 23.894 6.982 1.00 36.24 N ATOM 1277 CA TYR A 869 -25.494 22.600 6.337 1.00 35.77 C ATOM 1278 C TYR A 869 -24.587 22.504 5.110 1.00 40.44 C ATOM 1279 O TYR A 869 -23.822 21.547 5.017 1.00 39.98 O ATOM 1280 CB TYR A 869 -26.972 22.284 5.998 1.00 36.63 C ATOM 1281 CG TYR A 869 -27.146 21.215 4.939 1.00 37.91 C ATOM 1282 CD1 TYR A 869 -26.983 19.864 5.247 1.00 39.19 C ATOM 1283 CD2 TYR A 869 -27.460 21.553 3.624 1.00 38.76 C ATOM 1284 CE1 TYR A 869 -27.105 18.879 4.270 1.00 39.70 C ATOM 1285 CE2 TYR A 869 -27.631 20.572 2.648 1.00 40.33 C ATOM 1286 CZ TYR A 869 -27.446 19.236 2.975 1.00 45.90 C ATOM 1287 OH TYR A 869 -27.614 18.277 2.020 1.00 47.60 O ATOM 1288 HH TYR A 869 -28.541 18.316 1.674 1.00 0.00 H ATOM 1289 H TYR A 869 -26.282 24.434 7.101 1.00 0.00 H ATOM 1290 N THR A 870 -24.654 23.490 4.181 1.00 38.88 N ATOM 1291 CA THR A 870 -23.839 23.454 2.948 1.00 39.10 C ATOM 1292 C THR A 870 -22.320 23.489 3.236 1.00 43.74 C ATOM 1293 O THR A 870 -21.580 22.792 2.548 1.00 44.25 O ATOM 1294 CB THR A 870 -24.258 24.509 1.925 1.00 45.54 C ATOM 1295 OG1 THR A 870 -23.932 25.796 2.401 1.00 43.89 O ATOM 1296 CG2 THR A 870 -25.731 24.436 1.560 1.00 48.73 C ATOM 1297 HG1 THR A 870 -24.407 25.961 3.254 1.00 0.00 H ATOM 1298 H THR A 870 -25.296 24.293 4.340 1.00 0.00 H ATOM 1299 N ILE A 871 -21.865 24.246 4.263 1.00 39.33 N ATOM 1300 CA ILE A 871 -20.431 24.287 4.607 1.00 39.60 C ATOM 1301 C ILE A 871 -19.995 22.963 5.227 1.00 42.58 C ATOM 1302 O ILE A 871 -18.947 22.435 4.846 1.00 43.05 O ATOM 1303 CB ILE A 871 -20.021 25.499 5.493 1.00 42.74 C ATOM 1304 CG1 ILE A 871 -20.433 26.821 4.806 1.00 43.92 C ATOM 1305 CG2 ILE A 871 -18.502 25.434 5.867 1.00 42.09 C ATOM 1306 CD1 ILE A 871 -19.523 28.010 4.964 1.00 61.88 C ATOM 1307 H ILE A 871 -22.539 24.809 4.820 1.00 0.00 H ATOM 1308 N MET A 872 -20.807 22.435 6.181 1.00 36.93 N ATOM 1309 CA MET A 872 -20.576 21.155 6.858 1.00 35.51 C ATOM 1310 C MET A 872 -20.537 20.027 5.814 1.00 39.18 C ATOM 1311 O MET A 872 -19.672 19.149 5.890 1.00 38.34 O ATOM 1312 CB MET A 872 -21.670 20.906 7.897 1.00 36.94 C ATOM 1313 CG MET A 872 -21.574 21.823 9.112 1.00 40.04 C ATOM 1314 SD MET A 872 -23.056 21.749 10.154 1.00 43.95 S ATOM 1315 CE MET A 872 -22.730 20.158 11.045 1.00 39.90 C ATOM 1316 H MET A 872 -21.652 22.978 6.450 1.00 0.00 H ATOM 1317 N LYS A 873 -21.413 20.105 4.786 1.00 35.81 N ATOM 1318 CA LYS A 873 -21.424 19.110 3.717 1.00 36.15 C ATOM 1319 C LYS A 873 -20.063 19.066 2.981 1.00 41.91 C ATOM 1320 O LYS A 873 -19.514 17.977 2.762 1.00 43.13 O ATOM 1321 CB LYS A 873 -22.606 19.315 2.771 1.00 37.24 C ATOM 1322 CG LYS A 873 -22.917 18.070 1.932 1.00 41.90 C ATOM 1323 CD LYS A 873 -24.242 18.173 1.215 1.00 47.75 C ATOM 1324 CE LYS A 873 -24.249 19.211 0.117 1.00 57.31 C ATOM 1325 NZ LYS A 873 -25.425 19.040 -0.768 1.00 75.84 N ATOM 1326 HZ1 LYS A 873 -25.397 18.095 -1.202 1.00 0.00 H ATOM 1327 HZ2 LYS A 873 -26.296 19.140 -0.208 1.00 0.00 H ATOM 1328 HZ3 LYS A 873 -25.405 19.765 -1.513 1.00 0.00 H ATOM 1329 H LYS A 873 -22.094 20.891 4.756 1.00 0.00 H ATOM 1330 N VAL A 874 -19.487 20.242 2.695 1.00 37.76 N ATOM 1331 CA VAL A 874 -18.168 20.390 2.060 1.00 36.84 C ATOM 1332 C VAL A 874 -17.100 19.794 2.990 1.00 39.59 C ATOM 1333 O VAL A 874 -16.227 19.062 2.530 1.00 37.53 O ATOM 1334 CB VAL A 874 -17.872 21.877 1.691 1.00 40.29 C ATOM 1335 CG1 VAL A 874 -16.447 22.059 1.178 1.00 39.71 C ATOM 1336 CG2 VAL A 874 -18.870 22.380 0.653 1.00 40.24 C ATOM 1337 H VAL A 874 -20.008 21.109 2.938 1.00 0.00 H ATOM 1338 N LEU A 875 -17.191 20.081 4.303 1.00 36.26 N ATOM 1339 CA LEU A 875 -16.236 19.541 5.266 1.00 35.84 C ATOM 1340 C LEU A 875 -16.266 18.029 5.316 1.00 41.48 C ATOM 1341 O LEU A 875 -15.237 17.429 5.566 1.00 43.80 O ATOM 1342 CB LEU A 875 -16.395 20.160 6.661 1.00 35.85 C ATOM 1343 CG LEU A 875 -16.031 21.657 6.757 1.00 40.37 C ATOM 1344 CD1 LEU A 875 -16.463 22.249 8.116 1.00 39.80 C ATOM 1345 CD2 LEU A 875 -14.541 21.868 6.526 1.00 40.12 C ATOM 1346 H LEU A 875 -17.957 20.700 4.637 1.00 0.00 H ATOM 1347 N LEU A 876 -17.408 17.404 5.014 1.00 38.42 N ATOM 1348 CA LEU A 876 -17.489 15.940 4.991 1.00 38.42 C ATOM 1349 C LEU A 876 -16.791 15.346 3.759 1.00 41.31 C ATOM 1350 O LEU A 876 -16.193 14.288 3.864 1.00 41.03 O ATOM 1351 CB LEU A 876 -18.934 15.454 5.133 1.00 38.34 C ATOM 1352 CG LEU A 876 -19.576 15.731 6.486 1.00 41.40 C ATOM 1353 CD1 LEU A 876 -21.039 15.511 6.410 1.00 41.17 C ATOM 1354 CD2 LEU A 876 -18.995 14.846 7.566 1.00 41.95 C ATOM 1355 H LEU A 876 -18.254 17.966 4.791 1.00 0.00 H ATOM 1356 N LEU A 877 -16.783 16.070 2.632 1.00 38.10 N ATOM 1357 CA LEU A 877 -16.060 15.693 1.402 1.00 38.50 C ATOM 1358 C LEU A 877 -14.547 15.714 1.667 1.00 43.87 C ATOM 1359 O LEU A 877 -13.801 14.930 1.075 1.00 43.95 O ATOM 1360 CB LEU A 877 -16.428 16.669 0.259 1.00 38.74 C ATOM 1361 CG LEU A 877 -15.722 16.525 -1.120 1.00 43.70 C ATOM 1362 CD1 LEU A 877 -15.923 15.127 -1.735 1.00 42.52 C ATOM 1363 CD2 LEU A 877 -16.204 17.593 -2.084 1.00 42.50 C ATOM 1364 H LEU A 877 -17.323 16.959 2.623 1.00 0.00 H ATOM 1365 N LEU A 878 -14.114 16.566 2.609 1.00 41.77 N ATOM 1366 CA LEU A 878 -12.704 16.750 2.983 1.00 41.45 C ATOM 1367 C LEU A 878 -12.353 16.087 4.335 1.00 43.79 C ATOM 1368 O LEU A 878 -11.302 16.389 4.903 1.00 43.99 O ATOM 1369 CB LEU A 878 -12.381 18.278 3.019 1.00 41.02 C ATOM 1370 CG LEU A 878 -12.944 19.185 1.880 1.00 44.87 C ATOM 1371 CD1 LEU A 878 -12.557 20.664 2.089 1.00 45.59 C ATOM 1372 CD2 LEU A 878 -12.496 18.739 0.511 1.00 42.78 C ATOM 1373 H LEU A 878 -14.825 17.136 3.109 1.00 0.00 H ATOM 1374 N SER A 879 -13.200 15.160 4.814 1.00 40.06 N ATOM 1375 CA SER A 879 -13.054 14.497 6.114 1.00 39.56 C ATOM 1376 C SER A 879 -12.182 13.246 6.146 1.00 42.63 C ATOM 1377 O SER A 879 -11.829 12.808 7.241 1.00 42.62 O ATOM 1378 CB SER A 879 -14.426 14.162 6.687 1.00 43.97 C ATOM 1379 OG SER A 879 -15.070 15.315 7.193 1.00 53.31 O ATOM 1380 HG SER A 879 -15.956 15.064 7.557 1.00 0.00 H ATOM 1381 H SER A 879 -14.014 14.895 4.223 1.00 0.00 H ATOM 1382 N THR A 880 -11.878 12.636 4.987 1.00 38.48 N ATOM 1383 CA THR A 880 -11.040 11.414 4.926 1.00 38.65 C ATOM 1384 C THR A 880 -10.028 11.497 3.788 1.00 44.05 C ATOM 1385 O THR A 880 -10.392 11.783 2.648 1.00 43.62 O ATOM 1386 CB THR A 880 -11.903 10.118 4.861 1.00 49.56 C ATOM 1387 OG1 THR A 880 -12.772 10.069 5.994 1.00 56.23 O ATOM 1388 CG2 THR A 880 -11.067 8.838 4.845 1.00 46.67 C ATOM 1389 HG1 THR A 880 -13.365 10.862 5.988 1.00 0.00 H ATOM 1390 H THR A 880 -12.244 13.036 4.100 1.00 0.00 H ATOM 1391 N ILE A 881 -8.765 11.196 4.098 1.00 41.72 N ATOM 1392 CA ILE A 881 -7.655 11.249 3.149 1.00 41.99 C ATOM 1393 C ILE A 881 -6.850 9.957 3.186 1.00 47.59 C ATOM 1394 O ILE A 881 -6.926 9.248 4.194 1.00 47.15 O ATOM 1395 CB ILE A 881 -6.747 12.500 3.441 1.00 44.89 C ATOM 1396 CG1 ILE A 881 -6.149 12.482 4.875 1.00 45.17 C ATOM 1397 CG2 ILE A 881 -7.488 13.810 3.140 1.00 45.09 C ATOM 1398 CD1 ILE A 881 -4.974 13.511 5.093 1.00 48.83 C ATOM 1399 H ILE A 881 -8.558 10.906 5.075 1.00 0.00 H ATOM 1400 N PRO A 882 -6.003 9.650 2.172 1.00 46.16 N ATOM 1401 CA PRO A 882 -5.135 8.463 2.288 1.00 47.13 C ATOM 1402 C PRO A 882 -4.168 8.594 3.462 1.00 53.41 C ATOM 1403 O PRO A 882 -3.723 9.706 3.748 1.00 53.21 O ATOM 1404 CB PRO A 882 -4.341 8.473 0.973 1.00 48.28 C ATOM 1405 CG PRO A 882 -5.130 9.315 0.047 1.00 52.13 C ATOM 1406 CD PRO A 882 -5.742 10.364 0.911 1.00 47.92 C ATOM 1407 N LYS A 883 -3.832 7.471 4.119 1.00 52.42 N ATOM 1408 CA LYS A 883 -2.855 7.382 5.215 1.00 54.18 C ATOM 1409 C LYS A 883 -1.578 8.241 4.950 1.00 59.80 C ATOM 1410 O LYS A 883 -1.179 9.003 5.828 1.00 59.70 O ATOM 1411 CB LYS A 883 -2.470 5.907 5.433 1.00 57.82 C ATOM 1412 CG LYS A 883 -1.436 5.657 6.541 1.00 79.05 C ATOM 1413 CD LYS A 883 -1.003 4.179 6.629 1.00 90.99 C ATOM 1414 CE LYS A 883 0.196 3.829 5.767 1.00 98.96 C ATOM 1415 NZ LYS A 883 -0.176 3.592 4.345 1.00103.56 N ATOM 1416 HZ1 LYS A 883 -0.852 2.803 4.292 1.00 0.00 H ATOM 1417 HZ2 LYS A 883 -0.613 4.451 3.954 1.00 0.00 H ATOM 1418 HZ3 LYS A 883 0.677 3.357 3.799 1.00 0.00 H ATOM 1419 H LYS A 883 -4.302 6.590 3.828 1.00 0.00 H ATOM 1420 N ASP A 884 -0.971 8.124 3.743 1.00 57.49 N ATOM 1421 CA ASP A 884 0.231 8.867 3.344 1.00 58.90 C ATOM 1422 C ASP A 884 -0.069 10.153 2.539 1.00 61.77 C ATOM 1423 O ASP A 884 0.803 10.649 1.818 1.00 60.80 O ATOM 1424 CB ASP A 884 1.230 7.960 2.586 1.00 62.22 C ATOM 1425 CG ASP A 884 1.736 6.765 3.375 1.00 80.02 C ATOM 1426 OD1 ASP A 884 2.095 6.946 4.569 1.00 81.79 O ATOM 1427 OD2 ASP A 884 1.807 5.655 2.792 1.00 86.18 O ATOM 1428 H ASP A 884 -1.384 7.464 3.054 1.00 0.00 H ATOM 1429 N GLY A 885 -1.282 10.684 2.702 1.00 56.32 N ATOM 1430 CA GLY A 885 -1.720 11.923 2.076 1.00 54.80 C ATOM 1431 C GLY A 885 -2.104 11.835 0.615 1.00 56.42 C ATOM 1432 O GLY A 885 -1.999 10.779 -0.010 1.00 55.75 O ATOM 1433 H GLY A 885 -1.956 10.182 3.314 1.00 0.00 H ATOM 1434 N LEU A 886 -2.549 12.973 0.073 1.00 52.50 N ATOM 1435 CA LEU A 886 -2.984 13.164 -1.311 1.00 52.22 C ATOM 1436 C LEU A 886 -1.837 13.674 -2.198 1.00 58.49 C ATOM 1437 O LEU A 886 -0.771 14.007 -1.688 1.00 58.86 O ATOM 1438 CB LEU A 886 -4.138 14.193 -1.332 1.00 51.54 C ATOM 1439 CG LEU A 886 -5.458 13.812 -0.645 1.00 54.23 C ATOM 1440 CD1 LEU A 886 -6.211 15.051 -0.236 1.00 53.18 C ATOM 1441 CD2 LEU A 886 -6.340 12.958 -1.555 1.00 52.98 C ATOM 1442 H LEU A 886 -2.590 13.804 0.696 1.00 0.00 H ATOM 1443 N LYS A 887 -2.071 13.762 -3.524 1.00 56.83 N ATOM 1444 CA LYS A 887 -1.114 14.298 -4.496 1.00 57.19 C ATOM 1445 C LYS A 887 -0.843 15.770 -4.112 1.00 61.21 C ATOM 1446 O LYS A 887 0.278 16.076 -3.709 1.00 62.02 O ATOM 1447 CB LYS A 887 -1.644 14.144 -5.940 1.00 59.89 C ATOM 1448 CG LYS A 887 -0.607 14.398 -7.024 1.00 75.85 C ATOM 1449 CD LYS A 887 -1.238 14.410 -8.420 1.00 85.94 C ATOM 1450 CE LYS A 887 -0.489 15.295 -9.391 1.00 90.23 C ATOM 1451 NZ LYS A 887 -1.295 15.601 -10.605 1.00 91.32 N ATOM 1452 HZ1 LYS A 887 -1.535 14.714 -11.093 1.00 0.00 H ATOM 1453 HZ2 LYS A 887 -2.168 16.092 -10.325 1.00 0.00 H ATOM 1454 HZ3 LYS A 887 -0.743 16.210 -11.242 1.00 0.00 H ATOM 1455 H LYS A 887 -2.990 13.428 -3.879 1.00 0.00 H ATOM 1456 N SER A 888 -1.883 16.637 -4.108 1.00 55.84 N ATOM 1457 CA SER A 888 -1.753 18.033 -3.670 1.00 54.53 C ATOM 1458 C SER A 888 -2.235 18.167 -2.211 1.00 56.94 C ATOM 1459 O SER A 888 -3.277 18.780 -1.941 1.00 55.78 O ATOM 1460 CB SER A 888 -2.531 18.968 -4.584 1.00 58.34 C ATOM 1461 OG SER A 888 -1.995 18.944 -5.893 1.00 72.85 O ATOM 1462 HG SER A 888 -2.513 19.557 -6.472 1.00 0.00 H ATOM 1463 H SER A 888 -2.813 16.300 -4.429 1.00 0.00 H ATOM 1464 N GLN A 889 -1.471 17.579 -1.277 1.00 53.46 N ATOM 1465 CA GLN A 889 -1.795 17.586 0.156 1.00 54.03 C ATOM 1466 C GLN A 889 -1.920 19.001 0.744 1.00 60.78 C ATOM 1467 O GLN A 889 -2.906 19.270 1.426 1.00 61.81 O ATOM 1468 CB GLN A 889 -0.805 16.720 0.955 1.00 54.70 C ATOM 1469 CG GLN A 889 -1.131 16.548 2.447 1.00 62.86 C ATOM 1470 CD GLN A 889 -2.485 15.921 2.735 1.00 74.07 C ATOM 1471 OE1 GLN A 889 -2.933 14.973 2.075 1.00 61.89 O ATOM 1472 NE2 GLN A 889 -3.167 16.451 3.735 1.00 66.36 N ATOM 1473 HE22 GLN A 889 -2.768 17.246 4.273 1.00 0.00 H ATOM 1474 HE21 GLN A 889 -4.103 16.073 3.984 1.00 0.00 H ATOM 1475 H GLN A 889 -0.604 17.093 -1.584 1.00 0.00 H ATOM 1476 N ALA A 890 -0.964 19.904 0.436 1.00 57.58 N ATOM 1477 CA ALA A 890 -0.945 21.291 0.931 1.00 56.60 C ATOM 1478 C ALA A 890 -2.134 22.110 0.469 1.00 57.50 C ATOM 1479 O ALA A 890 -2.694 22.856 1.268 1.00 58.12 O ATOM 1480 CB ALA A 890 0.352 21.984 0.542 1.00 57.25 C ATOM 1481 H ALA A 890 -0.192 19.600 -0.191 1.00 0.00 H ATOM 1482 N ALA A 891 -2.521 21.971 -0.809 1.00 51.21 N ATOM 1483 CA ALA A 891 -3.667 22.664 -1.405 1.00 49.55 C ATOM 1484 C ALA A 891 -4.972 22.173 -0.734 1.00 54.31 C ATOM 1485 O ALA A 891 -5.888 22.966 -0.508 1.00 54.21 O ATOM 1486 CB ALA A 891 -3.711 22.397 -2.900 1.00 49.41 C ATOM 1487 H ALA A 891 -1.972 21.330 -1.416 1.00 0.00 H ATOM 1488 N PHE A 892 -5.030 20.863 -0.397 1.00 49.85 N ATOM 1489 CA PHE A 892 -6.165 20.264 0.281 1.00 48.58 C ATOM 1490 C PHE A 892 -6.258 20.832 1.697 1.00 52.93 C ATOM 1491 O PHE A 892 -7.360 21.128 2.155 1.00 53.34 O ATOM 1492 CB PHE A 892 -6.042 18.724 0.317 1.00 49.25 C ATOM 1493 CG PHE A 892 -6.872 18.095 1.412 1.00 49.63 C ATOM 1494 CD1 PHE A 892 -8.229 17.846 1.224 1.00 51.19 C ATOM 1495 CD2 PHE A 892 -6.317 17.824 2.660 1.00 50.59 C ATOM 1496 CE1 PHE A 892 -9.000 17.294 2.247 1.00 50.93 C ATOM 1497 CE2 PHE A 892 -7.104 17.316 3.697 1.00 52.53 C ATOM 1498 CZ PHE A 892 -8.439 17.055 3.482 1.00 49.89 C ATOM 1499 H PHE A 892 -4.221 20.255 -0.636 1.00 0.00 H ATOM 1500 N GLU A 893 -5.110 20.937 2.399 1.00 49.29 N ATOM 1501 CA GLU A 893 -5.048 21.439 3.772 1.00 49.83 C ATOM 1502 C GLU A 893 -5.460 22.896 3.882 1.00 57.00 C ATOM 1503 O GLU A 893 -6.117 23.276 4.853 1.00 57.78 O ATOM 1504 CB GLU A 893 -3.678 21.187 4.393 1.00 51.08 C ATOM 1505 CG GLU A 893 -3.500 19.742 4.837 1.00 61.52 C ATOM 1506 CD GLU A 893 -2.193 19.379 5.514 1.00 85.46 C ATOM 1507 OE1 GLU A 893 -1.349 20.281 5.722 1.00 84.14 O ATOM 1508 OE2 GLU A 893 -2.021 18.186 5.853 1.00 80.10 O ATOM 1509 H GLU A 893 -4.223 20.646 1.940 1.00 0.00 H ATOM 1510 N GLU A 894 -5.144 23.683 2.845 1.00 54.62 N ATOM 1511 CA GLU A 894 -5.470 25.098 2.709 1.00 54.70 C ATOM 1512 C GLU A 894 -6.984 25.263 2.534 1.00 58.47 C ATOM 1513 O GLU A 894 -7.614 26.036 3.256 1.00 59.31 O ATOM 1514 CB GLU A 894 -4.716 25.671 1.498 1.00 56.48 C ATOM 1515 CG GLU A 894 -4.650 27.186 1.461 1.00 74.84 C ATOM 1516 CD GLU A 894 -4.744 27.784 0.070 1.00106.46 C ATOM 1517 OE1 GLU A 894 -5.878 27.908 -0.448 1.00112.51 O ATOM 1518 OE2 GLU A 894 -3.686 28.149 -0.492 1.00100.35 O ATOM 1519 H GLU A 894 -4.617 23.244 2.064 1.00 0.00 H ATOM 1520 N MET A 895 -7.560 24.535 1.577 1.00 54.32 N ATOM 1521 CA MET A 895 -8.987 24.538 1.275 1.00 54.10 C ATOM 1522 C MET A 895 -9.836 24.049 2.499 1.00 53.63 C ATOM 1523 O MET A 895 -10.880 24.644 2.796 1.00 53.22 O ATOM 1524 CB MET A 895 -9.213 23.662 0.057 1.00 57.48 C ATOM 1525 CG MET A 895 -10.657 23.405 -0.270 1.00 63.44 C ATOM 1526 SD MET A 895 -10.791 22.132 -1.542 1.00 69.60 S ATOM 1527 CE MET A 895 -9.796 20.839 -0.804 1.00 66.79 C ATOM 1528 H MET A 895 -6.947 23.920 1.004 1.00 0.00 H ATOM 1529 N ARG A 896 -9.372 22.993 3.199 1.00 45.48 N ATOM 1530 CA ARG A 896 -10.051 22.471 4.372 1.00 45.03 C ATOM 1531 C ARG A 896 -10.099 23.525 5.501 1.00 50.44 C ATOM 1532 O ARG A 896 -11.193 23.801 6.006 1.00 49.32 O ATOM 1533 CB ARG A 896 -9.438 21.152 4.843 1.00 42.12 C ATOM 1534 CG ARG A 896 -10.267 20.501 5.940 1.00 47.51 C ATOM 1535 CD ARG A 896 -9.713 19.154 6.357 1.00 52.88 C ATOM 1536 NE ARG A 896 -9.878 18.900 7.792 1.00 52.78 N ATOM 1537 CZ ARG A 896 -10.960 18.359 8.331 1.00 69.88 C ATOM 1538 NH1 ARG A 896 -12.002 18.035 7.566 1.00 58.44 N ATOM 1539 NH2 ARG A 896 -11.022 18.155 9.642 1.00 56.74 N ATOM 1540 HE ARG A 896 -9.096 19.161 8.426 1.00 0.00 H ATOM 1541 HH12 ARG A 896 -12.849 17.610 7.994 1.00 0.00 H ATOM 1542 HH11 ARG A 896 -11.968 18.207 6.541 1.00 0.00 H ATOM 1543 HH22 ARG A 896 -11.873 17.730 10.062 1.00 0.00 H ATOM 1544 HH21 ARG A 896 -10.220 18.420 10.248 1.00 0.00 H ATOM 1545 H ARG A 896 -8.493 22.534 2.886 1.00 0.00 H ATOM 1546 N THR A 897 -8.926 24.140 5.843 1.00 48.00 N ATOM 1547 CA THR A 897 -8.760 25.197 6.857 1.00 48.02 C ATOM 1548 C THR A 897 -9.644 26.393 6.495 1.00 52.20 C ATOM 1549 O THR A 897 -10.336 26.917 7.370 1.00 54.49 O ATOM 1550 CB THR A 897 -7.268 25.557 7.030 1.00 60.85 C ATOM 1551 OG1 THR A 897 -6.564 24.405 7.499 1.00 59.00 O ATOM 1552 CG2 THR A 897 -7.037 26.716 8.012 1.00 61.17 C ATOM 1553 HG1 THR A 897 -6.657 23.672 6.840 1.00 0.00 H ATOM 1554 H THR A 897 -8.070 23.832 5.340 1.00 0.00 H ATOM 1555 N ASN A 898 -9.695 26.758 5.211 1.00 46.15 N ATOM 1556 CA ASN A 898 -10.567 27.831 4.738 1.00 46.40 C ATOM 1557 C ASN A 898 -12.040 27.533 4.944 1.00 49.40 C ATOM 1558 O ASN A 898 -12.803 28.438 5.270 1.00 49.28 O ATOM 1559 CB ASN A 898 -10.321 28.142 3.256 1.00 48.89 C ATOM 1560 CG ASN A 898 -9.088 28.966 2.960 1.00 70.19 C ATOM 1561 OD1 ASN A 898 -8.784 29.221 1.789 1.00 70.50 O ATOM 1562 ND2 ASN A 898 -8.347 29.400 3.995 1.00 52.53 N ATOM 1563 HD22 ASN A 898 -8.629 29.169 4.969 1.00 0.00 H ATOM 1564 HD21 ASN A 898 -7.492 29.967 3.821 1.00 0.00 H ATOM 1565 H ASN A 898 -9.093 26.261 4.524 1.00 0.00 H ATOM 1566 N TYR A 899 -12.461 26.287 4.714 1.00 45.95 N ATOM 1567 CA TYR A 899 -13.870 25.942 4.905 1.00 44.52 C ATOM 1568 C TYR A 899 -14.237 25.910 6.388 1.00 46.41 C ATOM 1569 O TYR A 899 -15.310 26.395 6.737 1.00 44.09 O ATOM 1570 CB TYR A 899 -14.255 24.676 4.157 1.00 44.75 C ATOM 1571 CG TYR A 899 -14.613 24.946 2.714 1.00 46.22 C ATOM 1572 CD1 TYR A 899 -15.824 25.546 2.374 1.00 48.38 C ATOM 1573 CD2 TYR A 899 -13.759 24.569 1.679 1.00 46.42 C ATOM 1574 CE1 TYR A 899 -16.174 25.766 1.036 1.00 48.84 C ATOM 1575 CE2 TYR A 899 -14.102 24.779 0.340 1.00 46.46 C ATOM 1576 CZ TYR A 899 -15.315 25.364 0.025 1.00 51.42 C ATOM 1577 OH TYR A 899 -15.639 25.578 -1.290 1.00 51.46 O ATOM 1578 HH TYR A 899 -14.965 26.175 -1.702 1.00 0.00 H ATOM 1579 H TYR A 899 -11.787 25.561 4.399 1.00 0.00 H ATOM 1580 N ILE A 900 -13.298 25.454 7.260 1.00 44.57 N ATOM 1581 CA ILE A 900 -13.462 25.455 8.716 1.00 45.84 C ATOM 1582 C ILE A 900 -13.635 26.927 9.198 1.00 52.80 C ATOM 1583 O ILE A 900 -14.581 27.218 9.939 1.00 51.53 O ATOM 1584 CB ILE A 900 -12.294 24.718 9.431 1.00 49.09 C ATOM 1585 CG1 ILE A 900 -12.261 23.220 9.037 1.00 49.40 C ATOM 1586 CG2 ILE A 900 -12.388 24.866 10.964 1.00 50.14 C ATOM 1587 CD1 ILE A 900 -10.912 22.489 9.302 1.00 49.88 C ATOM 1588 H ILE A 900 -12.409 25.082 6.869 1.00 0.00 H ATOM 1589 N LYS A 901 -12.764 27.853 8.703 1.00 51.43 N ATOM 1590 CA LYS A 901 -12.815 29.290 9.035 1.00 51.57 C ATOM 1591 C LYS A 901 -14.106 29.956 8.573 1.00 52.25 C ATOM 1592 O LYS A 901 -14.655 30.773 9.306 1.00 52.00 O ATOM 1593 CB LYS A 901 -11.574 30.049 8.528 1.00 55.09 C ATOM 1594 CG LYS A 901 -10.346 29.821 9.406 1.00 74.64 C ATOM 1595 CD LYS A 901 -9.110 30.512 8.838 1.00 86.00 C ATOM 1596 CE LYS A 901 -7.848 30.101 9.554 1.00 95.79 C ATOM 1597 NZ LYS A 901 -6.636 30.606 8.854 1.00106.34 N ATOM 1598 HZ1 LYS A 901 -6.609 30.220 7.889 1.00 0.00 H ATOM 1599 HZ2 LYS A 901 -6.669 31.645 8.812 1.00 0.00 H ATOM 1600 HZ3 LYS A 901 -5.787 30.305 9.373 1.00 0.00 H ATOM 1601 H LYS A 901 -12.020 27.527 8.053 1.00 0.00 H ATOM 1602 N GLU A 902 -14.617 29.575 7.392 1.00 47.11 N ATOM 1603 CA GLU A 902 -15.887 30.076 6.877 1.00 47.16 C ATOM 1604 C GLU A 902 -17.022 29.639 7.814 1.00 50.79 C ATOM 1605 O GLU A 902 -17.965 30.412 8.020 1.00 50.61 O ATOM 1606 CB GLU A 902 -16.170 29.528 5.464 1.00 49.22 C ATOM 1607 CG GLU A 902 -15.681 30.410 4.327 1.00 66.96 C ATOM 1608 CD GLU A 902 -16.343 31.768 4.186 1.00 99.54 C ATOM 1609 OE1 GLU A 902 -17.517 31.919 4.599 1.00102.72 O ATOM 1610 OE2 GLU A 902 -15.689 32.678 3.628 1.00100.47 O ATOM 1611 H GLU A 902 -14.084 28.892 6.818 1.00 0.00 H ATOM 1612 N LEU A 903 -16.942 28.391 8.369 1.00 44.82 N ATOM 1613 CA LEU A 903 -17.958 27.896 9.297 1.00 43.01 C ATOM 1614 C LEU A 903 -17.893 28.678 10.614 1.00 44.31 C ATOM 1615 O LEU A 903 -18.926 29.168 11.084 1.00 42.06 O ATOM 1616 CB LEU A 903 -17.874 26.365 9.546 1.00 41.93 C ATOM 1617 CG LEU A 903 -19.021 25.752 10.365 1.00 44.33 C ATOM 1618 CD1 LEU A 903 -20.411 26.069 9.748 1.00 42.34 C ATOM 1619 CD2 LEU A 903 -18.841 24.265 10.518 1.00 46.76 C ATOM 1620 H LEU A 903 -16.138 27.779 8.125 1.00 0.00 H ATOM 1621 N ARG A 904 -16.682 28.822 11.170 1.00 41.24 N ATOM 1622 CA ARG A 904 -16.472 29.527 12.421 1.00 42.66 C ATOM 1623 C ARG A 904 -16.934 30.985 12.343 1.00 49.36 C ATOM 1624 O ARG A 904 -17.712 31.391 13.193 1.00 50.00 O ATOM 1625 CB ARG A 904 -15.020 29.399 12.890 1.00 44.18 C ATOM 1626 CG ARG A 904 -14.776 30.018 14.259 1.00 54.34 C ATOM 1627 CD ARG A 904 -13.306 30.213 14.520 1.00 66.49 C ATOM 1628 NE ARG A 904 -12.760 31.353 13.781 1.00 74.05 N ATOM 1629 CZ ARG A 904 -11.669 31.292 13.028 1.00 92.49 C ATOM 1630 NH1 ARG A 904 -11.009 30.146 12.894 1.00 89.12 N ATOM 1631 NH2 ARG A 904 -11.229 32.373 12.401 1.00 73.15 N ATOM 1632 HE ARG A 904 -13.256 32.264 13.850 1.00 0.00 H ATOM 1633 HH12 ARG A 904 -10.155 30.104 12.303 1.00 0.00 H ATOM 1634 HH11 ARG A 904 -11.347 29.291 13.381 1.00 0.00 H ATOM 1635 HH22 ARG A 904 -10.374 32.320 11.812 1.00 0.00 H ATOM 1636 HH21 ARG A 904 -11.739 33.274 12.498 1.00 0.00 H ATOM 1637 H ARG A 904 -15.859 28.412 10.685 1.00 0.00 H ATOM 1638 N LYS A 905 -16.512 31.740 11.310 1.00 47.52 N ATOM 1639 CA LYS A 905 -16.902 33.145 11.134 1.00 48.33 C ATOM 1640 C LYS A 905 -18.406 33.300 10.967 1.00 53.11 C ATOM 1641 O LYS A 905 -19.003 34.148 11.608 1.00 53.69 O ATOM 1642 CB LYS A 905 -16.123 33.829 9.988 1.00 50.46 C ATOM 1643 CG LYS A 905 -14.666 34.101 10.345 1.00 66.55 C ATOM 1644 CD LYS A 905 -13.856 34.588 9.152 1.00 81.22 C ATOM 1645 CE LYS A 905 -12.432 34.913 9.543 1.00 93.71 C ATOM 1646 NZ LYS A 905 -11.515 34.918 8.370 1.00104.96 N ATOM 1647 HZ1 LYS A 905 -11.522 33.979 7.922 1.00 0.00 H ATOM 1648 HZ2 LYS A 905 -11.834 35.633 7.685 1.00 0.00 H ATOM 1649 HZ3 LYS A 905 -10.551 35.145 8.686 1.00 0.00 H ATOM 1650 H LYS A 905 -15.881 31.308 10.605 1.00 0.00 H ATOM 1651 N MET A 906 -19.023 32.453 10.163 1.00 50.06 N ATOM 1652 CA MET A 906 -20.466 32.477 9.953 1.00 50.18 C ATOM 1653 C MET A 906 -21.247 32.265 11.275 1.00 51.57 C ATOM 1654 O MET A 906 -22.188 33.005 11.546 1.00 51.15 O ATOM 1655 CB MET A 906 -20.840 31.406 8.943 1.00 53.25 C ATOM 1656 CG MET A 906 -22.290 31.412 8.565 1.00 58.98 C ATOM 1657 SD MET A 906 -22.716 29.757 8.010 1.00 65.20 S ATOM 1658 CE MET A 906 -22.149 29.867 6.332 1.00 61.62 C ATOM 1659 H MET A 906 -18.457 31.740 9.659 1.00 0.00 H ATOM 1660 N VAL A 907 -20.842 31.270 12.085 1.00 44.80 N ATOM 1661 CA VAL A 907 -21.503 30.938 13.343 1.00 42.81 C ATOM 1662 C VAL A 907 -21.274 32.016 14.398 1.00 47.07 C ATOM 1663 O VAL A 907 -22.241 32.460 15.034 1.00 45.22 O ATOM 1664 CB VAL A 907 -21.094 29.523 13.858 1.00 44.21 C ATOM 1665 CG1 VAL A 907 -21.626 29.261 15.274 1.00 43.18 C ATOM 1666 CG2 VAL A 907 -21.550 28.433 12.892 1.00 43.37 C ATOM 1667 H VAL A 907 -20.015 30.708 11.800 1.00 0.00 H ATOM 1668 N THR A 908 -19.992 32.405 14.602 1.00 44.63 N ATOM 1669 CA THR A 908 -19.594 33.353 15.644 1.00 44.81 C ATOM 1670 C THR A 908 -20.026 34.781 15.351 1.00 48.42 C ATOM 1671 O THR A 908 -20.214 35.533 16.300 1.00 48.26 O ATOM 1672 CB THR A 908 -18.100 33.257 15.988 1.00 51.45 C ATOM 1673 OG1 THR A 908 -17.321 33.518 14.819 1.00 49.78 O ATOM 1674 CG2 THR A 908 -17.725 31.907 16.619 1.00 48.90 C ATOM 1675 HG1 THR A 908 -17.542 32.851 14.121 1.00 0.00 H ATOM 1676 H THR A 908 -19.253 32.010 13.987 1.00 0.00 H ATOM 1677 N LYS A 909 -20.226 35.142 14.073 1.00 44.39 N ATOM 1678 CA LYS A 909 -20.628 36.503 13.701 1.00 44.79 C ATOM 1679 C LYS A 909 -22.129 36.685 13.574 1.00 50.96 C ATOM 1680 O LYS A 909 -22.596 37.823 13.508 1.00 52.00 O ATOM 1681 CB LYS A 909 -19.903 36.981 12.434 1.00 46.69 C ATOM 1682 CG LYS A 909 -18.405 37.155 12.679 1.00 57.18 C ATOM 1683 CD LYS A 909 -17.635 37.407 11.408 1.00 66.42 C ATOM 1684 CE LYS A 909 -16.417 38.264 11.671 1.00 84.54 C ATOM 1685 NZ LYS A 909 -16.770 39.674 12.026 1.00 93.56 N ATOM 1686 HZ1 LYS A 909 -17.301 40.105 11.242 1.00 0.00 H ATOM 1687 HZ2 LYS A 909 -17.355 39.678 12.886 1.00 0.00 H ATOM 1688 HZ3 LYS A 909 -15.899 40.216 12.196 1.00 0.00 H ATOM 1689 H LYS A 909 -20.092 34.434 13.323 1.00 0.00 H ATOM 1690 N SER A 910 -22.897 35.582 13.569 1.00 47.15 N ATOM 1691 CA SER A 910 -24.347 35.662 13.461 1.00 46.29 C ATOM 1692 C SER A 910 -25.002 36.189 14.754 1.00 50.64 C ATOM 1693 O SER A 910 -24.757 35.640 15.838 1.00 50.21 O ATOM 1694 CB SER A 910 -24.944 34.311 13.084 1.00 47.51 C ATOM 1695 OG SER A 910 -26.354 34.370 13.238 1.00 53.81 O ATOM 1696 HG SER A 910 -26.748 33.495 12.995 1.00 0.00 H ATOM 1697 H SER A 910 -22.445 34.649 13.644 1.00 0.00 H ATOM 1698 N PRO A 911 -25.901 37.194 14.641 1.00 47.06 N ATOM 1699 CA PRO A 911 -26.614 37.687 15.835 1.00 46.40 C ATOM 1700 C PRO A 911 -27.583 36.660 16.427 1.00 50.39 C ATOM 1701 O PRO A 911 -27.963 36.776 17.587 1.00 50.58 O ATOM 1702 CB PRO A 911 -27.361 38.929 15.327 1.00 48.09 C ATOM 1703 CG PRO A 911 -26.737 39.260 14.003 1.00 53.54 C ATOM 1704 CD PRO A 911 -26.311 37.939 13.435 1.00 49.32 C ATOM 1705 N ASN A 912 -27.967 35.647 15.644 1.00 47.23 N ATOM 1706 CA ASN A 912 -28.877 34.586 16.086 1.00 46.22 C ATOM 1707 C ASN A 912 -28.252 33.671 17.129 1.00 47.50 C ATOM 1708 O ASN A 912 -28.988 32.987 17.836 1.00 47.92 O ATOM 1709 CB ASN A 912 -29.370 33.761 14.890 1.00 47.28 C ATOM 1710 CG ASN A 912 -29.970 34.602 13.788 1.00 75.10 C ATOM 1711 OD1 ASN A 912 -29.515 34.564 12.644 1.00 67.86 O ATOM 1712 ND2 ASN A 912 -30.981 35.411 14.112 1.00 69.27 N ATOM 1713 HD22 ASN A 912 -31.346 35.423 15.086 1.00 0.00 H ATOM 1714 HD21 ASN A 912 -31.404 36.029 13.391 1.00 0.00 H ATOM 1715 H ASN A 912 -27.601 35.610 14.671 1.00 0.00 H ATOM 1716 N ASN A 913 -26.909 33.690 17.254 1.00 41.76 N ATOM 1717 CA ASN A 913 -26.152 32.835 18.169 1.00 40.65 C ATOM 1718 C ASN A 913 -25.501 33.598 19.337 1.00 45.22 C ATOM 1719 O ASN A 913 -24.696 33.015 20.068 1.00 45.02 O ATOM 1720 CB ASN A 913 -25.083 32.052 17.370 1.00 35.01 C ATOM 1721 CG ASN A 913 -25.614 31.414 16.108 1.00 49.83 C ATOM 1722 OD1 ASN A 913 -26.736 30.920 16.049 1.00 45.49 O ATOM 1723 ND2 ASN A 913 -24.849 31.460 15.052 1.00 42.87 N ATOM 1724 HD22 ASN A 913 -23.900 31.881 15.115 1.00 0.00 H ATOM 1725 HD21 ASN A 913 -25.188 31.075 14.147 1.00 0.00 H ATOM 1726 H ASN A 913 -26.376 34.357 16.660 1.00 0.00 H ATOM 1727 N SER A 914 -25.833 34.892 19.507 1.00 41.53 N ATOM 1728 CA SER A 914 -25.267 35.743 20.559 1.00 41.25 C ATOM 1729 C SER A 914 -25.302 35.070 21.922 1.00 46.39 C ATOM 1730 O SER A 914 -26.329 34.520 22.320 1.00 46.99 O ATOM 1731 CB SER A 914 -25.999 37.081 20.629 1.00 42.95 C ATOM 1732 OG SER A 914 -25.804 37.836 19.451 1.00 53.01 O ATOM 1733 HG SER A 914 -24.837 38.012 19.329 1.00 0.00 H ATOM 1734 H SER A 914 -26.529 35.311 18.857 1.00 0.00 H ATOM 1735 N GLY A 915 -24.169 35.093 22.599 1.00 43.37 N ATOM 1736 CA GLY A 915 -24.008 34.513 23.923 1.00 43.36 C ATOM 1737 C GLY A 915 -23.661 33.038 23.927 1.00 47.54 C ATOM 1738 O GLY A 915 -23.250 32.520 24.963 1.00 48.31 O ATOM 1739 H GLY A 915 -23.345 35.552 22.161 1.00 0.00 H ATOM 1740 N GLN A 916 -23.796 32.349 22.778 1.00 43.36 N ATOM 1741 CA GLN A 916 -23.515 30.902 22.674 1.00 42.86 C ATOM 1742 C GLN A 916 -22.925 30.469 21.309 1.00 46.67 C ATOM 1743 O GLN A 916 -22.968 29.276 20.980 1.00 47.01 O ATOM 1744 CB GLN A 916 -24.786 30.090 22.997 1.00 43.27 C ATOM 1745 CG GLN A 916 -25.934 30.327 22.020 1.00 68.44 C ATOM 1746 CD GLN A 916 -27.293 29.854 22.488 1.00 89.81 C ATOM 1747 OE1 GLN A 916 -28.319 30.197 21.886 1.00 85.94 O ATOM 1748 NE2 GLN A 916 -27.345 29.058 23.554 1.00 79.00 N ATOM 1749 HE22 GLN A 916 -26.468 28.784 24.042 1.00 0.00 H ATOM 1750 HE21 GLN A 916 -28.262 28.710 23.899 1.00 0.00 H ATOM 1751 H GLN A 916 -24.112 32.857 21.927 1.00 0.00 H ATOM 1752 N SER A 917 -22.380 31.434 20.524 1.00 40.86 N ATOM 1753 CA SER A 917 -21.851 31.162 19.197 1.00 40.08 C ATOM 1754 C SER A 917 -20.671 30.165 19.186 1.00 43.20 C ATOM 1755 O SER A 917 -20.668 29.277 18.340 1.00 41.40 O ATOM 1756 CB SER A 917 -21.515 32.457 18.464 1.00 42.37 C ATOM 1757 OG SER A 917 -20.256 32.987 18.825 1.00 48.02 O ATOM 1758 HG SER A 917 -20.094 33.823 18.320 1.00 0.00 H ATOM 1759 H SER A 917 -22.339 32.408 20.887 1.00 0.00 H ATOM 1760 N TRP A 918 -19.714 30.273 20.126 1.00 41.05 N ATOM 1761 CA TRP A 918 -18.597 29.315 20.207 1.00 42.52 C ATOM 1762 C TRP A 918 -19.062 27.917 20.641 1.00 47.68 C ATOM 1763 O TRP A 918 -18.605 26.914 20.090 1.00 48.20 O ATOM 1764 CB TRP A 918 -17.489 29.815 21.130 1.00 41.86 C ATOM 1765 CG TRP A 918 -16.646 30.872 20.503 1.00 43.59 C ATOM 1766 CD1 TRP A 918 -16.833 32.221 20.575 1.00 46.45 C ATOM 1767 CD2 TRP A 918 -15.547 30.665 19.612 1.00 44.23 C ATOM 1768 NE1 TRP A 918 -15.894 32.870 19.807 1.00 46.13 N ATOM 1769 CE2 TRP A 918 -15.082 31.939 19.215 1.00 47.94 C ATOM 1770 CE3 TRP A 918 -14.897 29.520 19.115 1.00 46.21 C ATOM 1771 CZ2 TRP A 918 -14.001 32.101 18.342 1.00 47.55 C ATOM 1772 CZ3 TRP A 918 -13.798 29.685 18.286 1.00 48.03 C ATOM 1773 CH2 TRP A 918 -13.372 30.961 17.894 1.00 48.48 C ATOM 1774 HE1 TRP A 918 -15.814 33.901 19.694 1.00 0.00 H ATOM 1775 H TRP A 918 -19.764 31.052 20.813 1.00 0.00 H ATOM 1776 N GLN A 919 -20.011 27.858 21.582 1.00 43.64 N ATOM 1777 CA GLN A 919 -20.600 26.602 22.042 1.00 42.82 C ATOM 1778 C GLN A 919 -21.261 25.911 20.838 1.00 43.20 C ATOM 1779 O GLN A 919 -21.121 24.699 20.676 1.00 41.93 O ATOM 1780 CB GLN A 919 -21.645 26.882 23.132 1.00 43.95 C ATOM 1781 CG GLN A 919 -21.771 25.799 24.169 1.00 73.77 C ATOM 1782 CD GLN A 919 -22.037 26.414 25.530 1.00105.75 C ATOM 1783 OE1 GLN A 919 -23.173 26.793 25.862 1.00102.99 O ATOM 1784 NE2 GLN A 919 -20.988 26.539 26.346 1.00 94.49 N ATOM 1785 HE22 GLN A 919 -20.049 26.212 26.040 1.00 0.00 H ATOM 1786 HE21 GLN A 919 -21.109 26.963 27.288 1.00 0.00 H ATOM 1787 H GLN A 919 -20.345 28.747 22.006 1.00 0.00 H ATOM 1788 N ARG A 920 -21.956 26.691 19.990 1.00 37.35 N ATOM 1789 CA ARG A 920 -22.631 26.171 18.805 1.00 37.37 C ATOM 1790 C ARG A 920 -21.613 25.642 17.772 1.00 43.60 C ATOM 1791 O ARG A 920 -21.786 24.535 17.262 1.00 43.55 O ATOM 1792 CB ARG A 920 -23.541 27.236 18.192 1.00 33.90 C ATOM 1793 CG ARG A 920 -24.365 26.702 17.052 1.00 35.81 C ATOM 1794 CD ARG A 920 -25.181 27.783 16.393 1.00 35.13 C ATOM 1795 NE ARG A 920 -25.889 27.238 15.243 1.00 37.39 N ATOM 1796 CZ ARG A 920 -27.055 26.605 15.300 1.00 53.23 C ATOM 1797 NH1 ARG A 920 -27.669 26.425 16.469 1.00 41.38 N ATOM 1798 NH2 ARG A 920 -27.614 26.135 14.194 1.00 31.85 N ATOM 1799 HE ARG A 920 -25.449 27.353 14.308 1.00 0.00 H ATOM 1800 HH12 ARG A 920 -28.582 25.928 16.506 1.00 0.00 H ATOM 1801 HH11 ARG A 920 -27.235 26.781 17.345 1.00 0.00 H ATOM 1802 HH22 ARG A 920 -28.527 25.640 14.243 1.00 0.00 H ATOM 1803 HH21 ARG A 920 -27.139 26.261 13.277 1.00 0.00 H ATOM 1804 H ARG A 920 -22.015 27.710 20.188 1.00 0.00 H ATOM 1805 N PHE A 921 -20.554 26.424 17.485 1.00 40.25 N ATOM 1806 CA PHE A 921 -19.514 26.026 16.540 1.00 39.67 C ATOM 1807 C PHE A 921 -18.939 24.661 16.957 1.00 44.61 C ATOM 1808 O PHE A 921 -18.850 23.761 16.125 1.00 43.18 O ATOM 1809 CB PHE A 921 -18.400 27.101 16.457 1.00 40.18 C ATOM 1810 CG PHE A 921 -17.223 26.667 15.615 1.00 39.85 C ATOM 1811 CD1 PHE A 921 -17.378 26.404 14.254 1.00 41.22 C ATOM 1812 CD2 PHE A 921 -15.972 26.473 16.189 1.00 40.55 C ATOM 1813 CE1 PHE A 921 -16.291 26.005 13.477 1.00 41.93 C ATOM 1814 CE2 PHE A 921 -14.880 26.077 15.410 1.00 43.10 C ATOM 1815 CZ PHE A 921 -15.046 25.848 14.058 1.00 41.23 C ATOM 1816 H PHE A 921 -20.474 27.348 17.955 1.00 0.00 H ATOM 1817 N TYR A 922 -18.608 24.498 18.256 1.00 43.20 N ATOM 1818 CA TYR A 922 -18.091 23.236 18.773 1.00 43.91 C ATOM 1819 C TYR A 922 -19.153 22.093 18.740 1.00 46.12 C ATOM 1820 O TYR A 922 -18.764 20.953 18.546 1.00 47.04 O ATOM 1821 CB TYR A 922 -17.425 23.427 20.133 1.00 46.62 C ATOM 1822 CG TYR A 922 -16.137 24.221 19.987 1.00 51.85 C ATOM 1823 CD1 TYR A 922 -15.240 23.953 18.951 1.00 54.63 C ATOM 1824 CD2 TYR A 922 -15.838 25.271 20.852 1.00 53.18 C ATOM 1825 CE1 TYR A 922 -14.064 24.689 18.800 1.00 56.99 C ATOM 1826 CE2 TYR A 922 -14.672 26.022 20.702 1.00 54.79 C ATOM 1827 CZ TYR A 922 -13.779 25.718 19.683 1.00 66.12 C ATOM 1828 OH TYR A 922 -12.617 26.442 19.539 1.00 68.31 O ATOM 1829 HH TYR A 922 -12.104 26.091 18.768 1.00 0.00 H ATOM 1830 H TYR A 922 -18.726 25.299 18.909 1.00 0.00 H ATOM 1831 N GLN A 923 -20.464 22.403 18.782 1.00 40.58 N ATOM 1832 CA GLN A 923 -21.517 21.398 18.612 1.00 40.11 C ATOM 1833 C GLN A 923 -21.569 20.916 17.141 1.00 43.72 C ATOM 1834 O GLN A 923 -21.775 19.724 16.900 1.00 42.76 O ATOM 1835 CB GLN A 923 -22.894 21.905 19.069 1.00 40.94 C ATOM 1836 CG GLN A 923 -22.996 21.947 20.594 1.00 60.21 C ATOM 1837 CD GLN A 923 -24.269 22.542 21.138 1.00 86.59 C ATOM 1838 OE1 GLN A 923 -24.779 22.081 22.159 1.00 86.44 O ATOM 1839 NE2 GLN A 923 -24.787 23.608 20.524 1.00 80.53 N ATOM 1840 HE22 GLN A 923 -24.339 23.980 19.662 1.00 0.00 H ATOM 1841 HE21 GLN A 923 -25.638 24.066 20.907 1.00 0.00 H ATOM 1842 H GLN A 923 -20.739 23.393 18.941 1.00 0.00 H ATOM 1843 N LEU A 924 -21.335 21.829 16.175 1.00 38.90 N ATOM 1844 CA LEU A 924 -21.337 21.477 14.754 1.00 38.87 C ATOM 1845 C LEU A 924 -20.118 20.612 14.423 1.00 43.18 C ATOM 1846 O LEU A 924 -20.260 19.572 13.765 1.00 42.54 O ATOM 1847 CB LEU A 924 -21.404 22.730 13.857 1.00 38.77 C ATOM 1848 CG LEU A 924 -22.617 23.677 14.065 1.00 42.65 C ATOM 1849 CD1 LEU A 924 -22.532 24.877 13.146 1.00 42.39 C ATOM 1850 CD2 LEU A 924 -23.918 22.970 13.831 1.00 42.94 C ATOM 1851 H LEU A 924 -21.147 22.815 16.449 1.00 0.00 H ATOM 1852 N THR A 925 -18.932 21.004 14.931 1.00 39.89 N ATOM 1853 CA THR A 925 -17.702 20.232 14.729 1.00 39.57 C ATOM 1854 C THR A 925 -17.806 18.867 15.443 1.00 42.59 C ATOM 1855 O THR A 925 -17.322 17.890 14.888 1.00 41.98 O ATOM 1856 CB THR A 925 -16.439 21.034 15.067 1.00 46.75 C ATOM 1857 OG1 THR A 925 -16.528 21.525 16.406 1.00 51.25 O ATOM 1858 CG2 THR A 925 -16.199 22.180 14.098 1.00 44.19 C ATOM 1859 HG1 THR A 925 -16.611 20.762 17.031 1.00 0.00 H ATOM 1860 H THR A 925 -18.888 21.883 15.485 1.00 0.00 H ATOM 1861 N LYS A 926 -18.485 18.778 16.619 1.00 38.49 N ATOM 1862 CA LYS A 926 -18.696 17.472 17.274 1.00 38.45 C ATOM 1863 C LYS A 926 -19.672 16.599 16.421 1.00 41.46 C ATOM 1864 O LYS A 926 -19.492 15.391 16.307 1.00 41.11 O ATOM 1865 CB LYS A 926 -19.218 17.610 18.721 1.00 40.39 C ATOM 1866 CG LYS A 926 -18.126 17.908 19.739 1.00 61.01 C ATOM 1867 CD LYS A 926 -18.699 18.063 21.157 1.00 81.34 C ATOM 1868 CE LYS A 926 -17.796 18.842 22.098 1.00 96.76 C ATOM 1869 NZ LYS A 926 -18.005 20.318 21.994 1.00106.03 N ATOM 1870 HZ1 LYS A 926 -17.802 20.628 21.022 1.00 0.00 H ATOM 1871 HZ2 LYS A 926 -18.992 20.545 22.233 1.00 0.00 H ATOM 1872 HZ3 LYS A 926 -17.366 20.805 22.655 1.00 0.00 H ATOM 1873 H LYS A 926 -18.860 19.641 17.062 1.00 0.00 H ATOM 1874 N LEU A 927 -20.666 17.225 15.797 1.00 38.23 N ATOM 1875 CA LEU A 927 -21.615 16.523 14.955 1.00 38.66 C ATOM 1876 C LEU A 927 -20.902 15.954 13.698 1.00 43.50 C ATOM 1877 O LEU A 927 -21.196 14.825 13.308 1.00 44.45 O ATOM 1878 CB LEU A 927 -22.823 17.419 14.647 1.00 39.09 C ATOM 1879 CG LEU A 927 -23.889 16.915 13.667 1.00 46.30 C ATOM 1880 CD1 LEU A 927 -24.418 15.532 14.056 1.00 47.18 C ATOM 1881 CD2 LEU A 927 -25.046 17.897 13.583 1.00 48.65 C ATOM 1882 H LEU A 927 -20.766 18.253 15.917 1.00 0.00 H ATOM 1883 N LEU A 928 -19.899 16.671 13.157 1.00 38.93 N ATOM 1884 CA LEU A 928 -19.083 16.218 12.023 1.00 38.68 C ATOM 1885 C LEU A 928 -18.195 15.040 12.424 1.00 44.66 C ATOM 1886 O LEU A 928 -18.079 14.082 11.664 1.00 44.90 O ATOM 1887 CB LEU A 928 -18.216 17.361 11.460 1.00 38.61 C ATOM 1888 CG LEU A 928 -18.959 18.497 10.761 1.00 43.19 C ATOM 1889 CD1 LEU A 928 -17.986 19.558 10.316 1.00 43.91 C ATOM 1890 CD2 LEU A 928 -19.791 17.995 9.564 1.00 40.92 C ATOM 1891 H LEU A 928 -19.689 17.603 13.567 1.00 0.00 H ATOM 1892 N ASP A 929 -17.594 15.090 13.631 1.00 40.91 N ATOM 1893 CA ASP A 929 -16.794 13.985 14.143 1.00 40.32 C ATOM 1894 C ASP A 929 -17.653 12.740 14.329 1.00 44.42 C ATOM 1895 O ASP A 929 -17.214 11.639 13.994 1.00 45.51 O ATOM 1896 CB ASP A 929 -16.152 14.359 15.473 1.00 41.50 C ATOM 1897 CG ASP A 929 -14.862 15.132 15.341 1.00 47.46 C ATOM 1898 OD1 ASP A 929 -14.480 15.468 14.185 1.00 43.55 O ATOM 1899 OD2 ASP A 929 -14.231 15.409 16.393 1.00 54.88 O ATOM 1900 H ASP A 929 -17.705 15.944 14.214 1.00 0.00 H ATOM 1901 N SER A 930 -18.874 12.918 14.854 1.00 38.29 N ATOM 1902 CA SER A 930 -19.797 11.821 15.111 1.00 37.24 C ATOM 1903 C SER A 930 -20.308 11.192 13.789 1.00 42.44 C ATOM 1904 O SER A 930 -20.725 10.033 13.788 1.00 42.30 O ATOM 1905 CB SER A 930 -20.912 12.264 16.055 1.00 37.87 C ATOM 1906 OG SER A 930 -21.940 12.923 15.344 1.00 50.66 O ATOM 1907 HG SER A 930 -21.568 13.721 14.892 1.00 0.00 H ATOM 1908 H SER A 930 -19.176 13.885 15.089 1.00 0.00 H ATOM 1909 N MET A 931 -20.165 11.928 12.654 1.00 38.57 N ATOM 1910 CA MET A 931 -20.486 11.428 11.318 1.00 37.34 C ATOM 1911 C MET A 931 -19.514 10.314 10.927 1.00 41.23 C ATOM 1912 O MET A 931 -19.946 9.391 10.261 1.00 41.58 O ATOM 1913 CB MET A 931 -20.506 12.544 10.254 1.00 38.86 C ATOM 1914 CG MET A 931 -21.791 13.377 10.260 1.00 41.21 C ATOM 1915 SD MET A 931 -23.289 12.414 9.954 1.00 44.08 S ATOM 1916 CE MET A 931 -23.060 12.018 8.164 1.00 40.57 C ATOM 1917 H MET A 931 -19.807 12.901 12.741 1.00 0.00 H ATOM 1918 N HIS A 932 -18.238 10.360 11.389 1.00 38.04 N ATOM 1919 CA HIS A 932 -17.237 9.312 11.145 1.00 38.80 C ATOM 1920 C HIS A 932 -17.697 7.993 11.778 1.00 43.70 C ATOM 1921 O HIS A 932 -17.560 6.943 11.157 1.00 43.63 O ATOM 1922 CB HIS A 932 -15.847 9.687 11.700 1.00 40.24 C ATOM 1923 CG HIS A 932 -15.055 10.635 10.839 1.00 44.96 C ATOM 1924 ND1 HIS A 932 -14.869 10.404 9.471 1.00 47.21 N ATOM 1925 CD2 HIS A 932 -14.371 11.754 11.188 1.00 46.14 C ATOM 1926 CE1 HIS A 932 -14.133 11.416 9.034 1.00 46.41 C ATOM 1927 NE2 HIS A 932 -13.800 12.246 10.032 1.00 46.45 N ATOM 1928 H HIS A 932 -17.951 11.188 11.950 1.00 0.00 H ATOM 1929 N ASP A 933 -18.255 8.049 12.999 1.00 41.54 N ATOM 1930 CA ASP A 933 -18.762 6.869 13.718 1.00 41.96 C ATOM 1931 C ASP A 933 -19.968 6.253 13.025 1.00 44.10 C ATOM 1932 O ASP A 933 -19.984 5.042 12.805 1.00 45.06 O ATOM 1933 CB ASP A 933 -19.109 7.225 15.165 1.00 44.90 C ATOM 1934 CG ASP A 933 -17.922 7.773 15.938 1.00 67.95 C ATOM 1935 OD1 ASP A 933 -16.850 7.106 15.944 1.00 71.02 O ATOM 1936 OD2 ASP A 933 -18.062 8.857 16.546 1.00 77.29 O ATOM 1937 H ASP A 933 -18.333 8.977 13.462 1.00 0.00 H ATOM 1938 N LEU A 934 -20.963 7.078 12.644 1.00 38.22 N ATOM 1939 CA LEU A 934 -22.143 6.562 11.966 1.00 37.19 C ATOM 1940 C LEU A 934 -21.758 5.946 10.614 1.00 40.88 C ATOM 1941 O LEU A 934 -22.145 4.816 10.324 1.00 40.50 O ATOM 1942 CB LEU A 934 -23.185 7.668 11.772 1.00 36.70 C ATOM 1943 CG LEU A 934 -24.398 7.320 10.907 1.00 40.67 C ATOM 1944 CD1 LEU A 934 -25.231 6.210 11.531 1.00 41.17 C ATOM 1945 CD2 LEU A 934 -25.253 8.528 10.681 1.00 41.30 C ATOM 1946 H LEU A 934 -20.887 8.097 12.837 1.00 0.00 H ATOM 1947 N VAL A 935 -20.976 6.689 9.817 1.00 36.68 N ATOM 1948 CA VAL A 935 -20.573 6.304 8.477 1.00 36.42 C ATOM 1949 C VAL A 935 -19.758 5.035 8.519 1.00 41.96 C ATOM 1950 O VAL A 935 -20.018 4.153 7.701 1.00 41.12 O ATOM 1951 CB VAL A 935 -19.926 7.485 7.710 1.00 39.13 C ATOM 1952 CG1 VAL A 935 -19.316 7.046 6.378 1.00 37.83 C ATOM 1953 CG2 VAL A 935 -20.986 8.569 7.482 1.00 38.82 C ATOM 1954 H VAL A 935 -20.636 7.601 10.183 1.00 0.00 H ATOM 1955 N SER A 936 -18.884 4.873 9.530 1.00 41.02 N ATOM 1956 CA SER A 936 -18.129 3.626 9.732 1.00 40.95 C ATOM 1957 C SER A 936 -19.096 2.441 9.756 1.00 42.70 C ATOM 1958 O SER A 936 -18.883 1.469 9.034 1.00 43.26 O ATOM 1959 CB SER A 936 -17.371 3.665 11.052 1.00 43.95 C ATOM 1960 OG SER A 936 -16.019 3.953 10.766 1.00 57.93 O ATOM 1961 HG SER A 936 -15.504 3.984 11.611 1.00 0.00 H ATOM 1962 H SER A 936 -18.737 5.660 10.194 1.00 0.00 H ATOM 1963 N ASP A 937 -20.182 2.550 10.549 1.00 36.59 N ATOM 1964 CA ASP A 937 -21.182 1.487 10.659 1.00 36.97 C ATOM 1965 C ASP A 937 -21.982 1.268 9.365 1.00 40.33 C ATOM 1966 O ASP A 937 -22.228 0.123 9.010 1.00 40.30 O ATOM 1967 CB ASP A 937 -22.118 1.728 11.862 1.00 39.06 C ATOM 1968 CG ASP A 937 -21.398 1.804 13.194 1.00 52.96 C ATOM 1969 OD1 ASP A 937 -20.333 1.175 13.326 1.00 56.28 O ATOM 1970 OD2 ASP A 937 -21.890 2.514 14.097 1.00 58.87 O ATOM 1971 H ASP A 937 -20.313 3.421 11.102 1.00 0.00 H ATOM 1972 N LEU A 938 -22.391 2.355 8.670 1.00 35.69 N ATOM 1973 CA LEU A 938 -23.157 2.233 7.421 1.00 34.83 C ATOM 1974 C LEU A 938 -22.271 1.593 6.359 1.00 38.59 C ATOM 1975 O LEU A 938 -22.756 0.751 5.614 1.00 39.69 O ATOM 1976 CB LEU A 938 -23.726 3.594 6.923 1.00 33.92 C ATOM 1977 CG LEU A 938 -24.674 4.393 7.873 1.00 36.59 C ATOM 1978 CD1 LEU A 938 -24.885 5.824 7.356 1.00 35.34 C ATOM 1979 CD2 LEU A 938 -26.020 3.721 8.030 1.00 33.58 C ATOM 1980 H LEU A 938 -22.157 3.303 9.029 1.00 0.00 H ATOM 1981 N LEU A 939 -20.967 1.949 6.329 1.00 34.05 N ATOM 1982 CA LEU A 939 -20.010 1.381 5.384 1.00 34.59 C ATOM 1983 C LEU A 939 -19.751 -0.105 5.660 1.00 41.37 C ATOM 1984 O LEU A 939 -19.708 -0.892 4.708 1.00 42.46 O ATOM 1985 CB LEU A 939 -18.691 2.175 5.304 1.00 33.71 C ATOM 1986 CG LEU A 939 -18.735 3.493 4.511 1.00 36.16 C ATOM 1987 CD1 LEU A 939 -17.442 4.256 4.699 1.00 34.80 C ATOM 1988 CD2 LEU A 939 -18.988 3.247 3.008 1.00 34.53 C ATOM 1989 H LEU A 939 -20.630 2.660 7.010 1.00 0.00 H ATOM 1990 N GLU A 940 -19.636 -0.506 6.939 1.00 36.66 N ATOM 1991 CA GLU A 940 -19.431 -1.928 7.243 1.00 36.53 C ATOM 1992 C GLU A 940 -20.585 -2.809 6.690 1.00 42.54 C ATOM 1993 O GLU A 940 -20.328 -3.829 6.051 1.00 41.83 O ATOM 1994 CB GLU A 940 -19.187 -2.154 8.747 1.00 37.33 C ATOM 1995 CG GLU A 940 -17.775 -1.817 9.192 1.00 41.74 C ATOM 1996 CD GLU A 940 -16.669 -2.387 8.317 1.00 61.02 C ATOM 1997 OE1 GLU A 940 -16.611 -3.627 8.142 1.00 50.58 O ATOM 1998 OE2 GLU A 940 -15.920 -1.577 7.725 1.00 51.15 O ATOM 1999 H GLU A 940 -19.692 0.189 7.710 1.00 0.00 H ATOM 2000 N PHE A 941 -21.841 -2.364 6.858 1.00 39.42 N ATOM 2001 CA PHE A 941 -22.987 -3.097 6.322 1.00 38.82 C ATOM 2002 C PHE A 941 -23.008 -3.057 4.792 1.00 42.14 C ATOM 2003 O PHE A 941 -23.421 -4.021 4.146 1.00 40.03 O ATOM 2004 CB PHE A 941 -24.293 -2.525 6.881 1.00 40.56 C ATOM 2005 CG PHE A 941 -25.496 -3.413 6.650 1.00 42.64 C ATOM 2006 CD1 PHE A 941 -25.666 -4.592 7.377 1.00 46.24 C ATOM 2007 CD2 PHE A 941 -26.457 -3.076 5.705 1.00 44.07 C ATOM 2008 CE1 PHE A 941 -26.775 -5.419 7.154 1.00 47.08 C ATOM 2009 CE2 PHE A 941 -27.576 -3.894 5.500 1.00 47.98 C ATOM 2010 CZ PHE A 941 -27.733 -5.056 6.233 1.00 45.77 C ATOM 2011 H PHE A 941 -22.002 -1.479 7.380 1.00 0.00 H ATOM 2012 N CYS A 942 -22.587 -1.922 4.218 1.00 40.25 N ATOM 2013 CA CYS A 942 -22.533 -1.720 2.770 1.00 40.34 C ATOM 2014 C CYS A 942 -21.496 -2.654 2.123 1.00 41.40 C ATOM 2015 O CYS A 942 -21.777 -3.274 1.085 1.00 40.03 O ATOM 2016 CB CYS A 942 -22.245 -0.256 2.448 1.00 40.83 C ATOM 2017 SG CYS A 942 -22.036 0.080 0.684 1.00 44.34 S ATOM 2018 H CYS A 942 -22.282 -1.142 4.835 1.00 0.00 H ATOM 2019 N PHE A 943 -20.305 -2.747 2.745 1.00 37.14 N ATOM 2020 CA PHE A 943 -19.217 -3.622 2.292 1.00 36.87 C ATOM 2021 C PHE A 943 -19.651 -5.084 2.354 1.00 42.81 C ATOM 2022 O PHE A 943 -19.373 -5.834 1.430 1.00 44.59 O ATOM 2023 CB PHE A 943 -17.927 -3.373 3.091 1.00 37.76 C ATOM 2024 CG PHE A 943 -17.300 -2.001 2.935 1.00 38.95 C ATOM 2025 CD1 PHE A 943 -17.362 -1.318 1.720 1.00 40.77 C ATOM 2026 CD2 PHE A 943 -16.610 -1.407 3.993 1.00 40.85 C ATOM 2027 CE1 PHE A 943 -16.761 -0.068 1.576 1.00 41.78 C ATOM 2028 CE2 PHE A 943 -16.006 -0.158 3.842 1.00 42.80 C ATOM 2029 CZ PHE A 943 -16.076 0.499 2.632 1.00 40.52 C ATOM 2030 H PHE A 943 -20.147 -2.167 3.593 1.00 0.00 H ATOM 2031 N TYR A 944 -20.421 -5.458 3.388 1.00 40.58 N ATOM 2032 CA TYR A 944 -20.953 -6.803 3.527 1.00 40.80 C ATOM 2033 C TYR A 944 -21.959 -7.123 2.444 1.00 43.01 C ATOM 2034 O TYR A 944 -21.791 -8.117 1.754 1.00 43.77 O ATOM 2035 CB TYR A 944 -21.591 -7.026 4.897 1.00 43.46 C ATOM 2036 CG TYR A 944 -22.074 -8.455 5.039 1.00 48.90 C ATOM 2037 CD1 TYR A 944 -21.186 -9.527 4.935 1.00 51.79 C ATOM 2038 CD2 TYR A 944 -23.429 -8.742 5.192 1.00 50.00 C ATOM 2039 CE1 TYR A 944 -21.623 -10.842 5.068 1.00 54.31 C ATOM 2040 CE2 TYR A 944 -23.877 -10.054 5.318 1.00 51.62 C ATOM 2041 CZ TYR A 944 -22.971 -11.102 5.241 1.00 64.40 C ATOM 2042 OH TYR A 944 -23.398 -12.405 5.354 1.00 74.83 O ATOM 2043 HH TYR A 944 -22.621 -13.014 5.276 1.00 0.00 H ATOM 2044 H TYR A 944 -20.646 -4.755 4.121 1.00 0.00 H ATOM 2045 N THR A 945 -23.014 -6.303 2.304 1.00 37.80 N ATOM 2046 CA THR A 945 -24.027 -6.506 1.282 1.00 38.00 C ATOM 2047 C THR A 945 -23.422 -6.446 -0.118 1.00 44.14 C ATOM 2048 O THR A 945 -23.990 -7.036 -1.023 1.00 44.34 O ATOM 2049 CB THR A 945 -25.222 -5.564 1.472 1.00 45.10 C ATOM 2050 OG1 THR A 945 -24.761 -4.216 1.380 1.00 44.87 O ATOM 2051 CG2 THR A 945 -25.964 -5.806 2.806 1.00 43.10 C ATOM 2052 HG1 THR A 945 -25.525 -3.598 1.501 1.00 0.00 H ATOM 2053 H THR A 945 -23.109 -5.494 2.950 1.00 0.00 H ATOM 2054 N PHE A 946 -22.272 -5.749 -0.297 1.00 41.76 N ATOM 2055 CA PHE A 946 -21.585 -5.691 -1.588 1.00 41.02 C ATOM 2056 C PHE A 946 -20.877 -7.012 -1.840 1.00 45.52 C ATOM 2057 O PHE A 946 -21.119 -7.621 -2.868 1.00 45.72 O ATOM 2058 CB PHE A 946 -20.616 -4.499 -1.699 1.00 41.65 C ATOM 2059 CG PHE A 946 -19.852 -4.440 -3.007 1.00 41.98 C ATOM 2060 CD1 PHE A 946 -20.449 -3.932 -4.160 1.00 43.12 C ATOM 2061 CD2 PHE A 946 -18.533 -4.888 -3.084 1.00 42.46 C ATOM 2062 CE1 PHE A 946 -19.735 -3.859 -5.362 1.00 42.77 C ATOM 2063 CE2 PHE A 946 -17.825 -4.822 -4.289 1.00 43.92 C ATOM 2064 CZ PHE A 946 -18.424 -4.282 -5.409 1.00 42.01 C ATOM 2065 H PHE A 946 -21.864 -5.238 0.512 1.00 0.00 H ATOM 2066 N ARG A 947 -20.019 -7.454 -0.917 1.00 42.23 N ATOM 2067 CA ARG A 947 -19.328 -8.740 -1.056 1.00 43.58 C ATOM 2068 C ARG A 947 -20.318 -9.915 -1.242 1.00 49.93 C ATOM 2069 O ARG A 947 -20.116 -10.720 -2.141 1.00 49.12 O ATOM 2070 CB ARG A 947 -18.386 -8.998 0.131 1.00 42.52 C ATOM 2071 CG ARG A 947 -17.061 -8.259 0.006 1.00 51.85 C ATOM 2072 CD ARG A 947 -16.125 -8.649 1.130 1.00 73.31 C ATOM 2073 NE ARG A 947 -14.734 -8.701 0.682 1.00 81.99 N ATOM 2074 CZ ARG A 947 -13.757 -7.953 1.180 1.00 94.67 C ATOM 2075 NH1 ARG A 947 -14.001 -7.098 2.165 1.00 75.35 N ATOM 2076 NH2 ARG A 947 -12.524 -8.062 0.706 1.00 87.94 N ATOM 2077 HE ARG A 947 -14.494 -9.369 -0.078 1.00 0.00 H ATOM 2078 HH12 ARG A 947 -13.231 -6.515 2.550 1.00 0.00 H ATOM 2079 HH11 ARG A 947 -14.963 -7.011 2.552 1.00 0.00 H ATOM 2080 HH22 ARG A 947 -11.762 -7.474 1.099 1.00 0.00 H ATOM 2081 HH21 ARG A 947 -12.319 -8.736 -0.059 1.00 0.00 H ATOM 2082 H ARG A 947 -19.836 -6.870 -0.076 1.00 0.00 H ATOM 2083 N GLU A 948 -21.421 -9.952 -0.448 1.00 47.14 N ATOM 2084 CA GLU A 948 -22.444 -10.997 -0.503 1.00 46.53 C ATOM 2085 C GLU A 948 -23.661 -10.625 -1.335 1.00 53.12 C ATOM 2086 O GLU A 948 -24.720 -11.235 -1.179 1.00 53.67 O ATOM 2087 CB GLU A 948 -22.848 -11.423 0.918 1.00 47.70 C ATOM 2088 CG GLU A 948 -21.752 -12.156 1.670 1.00 57.23 C ATOM 2089 CD GLU A 948 -21.199 -13.369 0.945 1.00 81.74 C ATOM 2090 OE1 GLU A 948 -21.990 -14.284 0.616 1.00 86.33 O ATOM 2091 OE2 GLU A 948 -19.981 -13.381 0.662 1.00 72.38 O ATOM 2092 H GLU A 948 -21.546 -9.186 0.245 1.00 0.00 H ATOM 2093 N SER A 949 -23.501 -9.663 -2.261 1.00 51.30 N ATOM 2094 CA SER A 949 -24.555 -9.169 -3.153 1.00 51.20 C ATOM 2095 C SER A 949 -25.382 -10.268 -3.805 1.00 57.44 C ATOM 2096 O SER A 949 -26.609 -10.250 -3.677 1.00 55.82 O ATOM 2097 CB SER A 949 -23.957 -8.237 -4.203 1.00 53.62 C ATOM 2098 OG SER A 949 -24.853 -7.910 -5.250 1.00 59.51 O ATOM 2099 HG SER A 949 -25.649 -7.458 -4.873 1.00 0.00 H ATOM 2100 H SER A 949 -22.557 -9.236 -2.352 1.00 0.00 H ATOM 2101 N HIS A 950 -24.713 -11.232 -4.480 1.00 57.95 N ATOM 2102 CA HIS A 950 -25.374 -12.336 -5.200 1.00 59.04 C ATOM 2103 C HIS A 950 -26.152 -13.274 -4.257 1.00 62.36 C ATOM 2104 O HIS A 950 -27.335 -13.516 -4.502 1.00 61.50 O ATOM 2105 CB HIS A 950 -24.382 -13.099 -6.105 1.00 60.46 C ATOM 2106 CG HIS A 950 -23.643 -12.237 -7.103 1.00 64.68 C ATOM 2107 ND1 HIS A 950 -24.078 -10.954 -7.437 1.00 66.78 N ATOM 2108 CD2 HIS A 950 -22.518 -12.506 -7.808 1.00 66.72 C ATOM 2109 CE1 HIS A 950 -23.200 -10.494 -8.314 1.00 66.13 C ATOM 2110 NE2 HIS A 950 -22.247 -11.388 -8.572 1.00 66.45 N ATOM 2111 H HIS A 950 -23.674 -11.192 -4.491 1.00 0.00 H ATOM 2112 N ALA A 951 -25.508 -13.732 -3.149 1.00 58.11 N ATOM 2113 CA ALA A 951 -26.115 -14.596 -2.127 1.00 57.08 C ATOM 2114 C ALA A 951 -27.310 -13.920 -1.450 1.00 61.65 C ATOM 2115 O ALA A 951 -28.353 -14.556 -1.308 1.00 61.29 O ATOM 2116 CB ALA A 951 -25.079 -14.970 -1.080 1.00 57.49 C ATOM 2117 H ALA A 951 -24.516 -13.450 -3.016 1.00 0.00 H ATOM 2118 N LEU A 952 -27.166 -12.619 -1.051 1.00 57.88 N ATOM 2119 CA LEU A 952 -28.217 -11.850 -0.360 1.00 56.08 C ATOM 2120 C LEU A 952 -29.246 -11.280 -1.307 1.00 56.93 C ATOM 2121 O LEU A 952 -30.291 -10.823 -0.855 1.00 56.82 O ATOM 2122 CB LEU A 952 -27.630 -10.716 0.509 1.00 56.12 C ATOM 2123 CG LEU A 952 -26.553 -11.061 1.545 1.00 60.62 C ATOM 2124 CD1 LEU A 952 -26.063 -9.807 2.249 1.00 60.30 C ATOM 2125 CD2 LEU A 952 -27.037 -12.102 2.562 1.00 63.52 C ATOM 2126 H LEU A 952 -26.261 -12.145 -1.247 1.00 0.00 H ATOM 2127 N LYS A 953 -28.968 -11.308 -2.618 1.00 52.62 N ATOM 2128 CA LYS A 953 -29.844 -10.757 -3.657 1.00 52.22 C ATOM 2129 C LYS A 953 -30.016 -9.227 -3.476 1.00 53.23 C ATOM 2130 O LYS A 953 -31.108 -8.680 -3.664 1.00 53.54 O ATOM 2131 CB LYS A 953 -31.185 -11.528 -3.771 1.00 55.14 C ATOM 2132 CG LYS A 953 -31.027 -12.939 -4.322 1.00 77.40 C ATOM 2133 CD LYS A 953 -32.361 -13.651 -4.477 1.00 93.62 C ATOM 2134 CE LYS A 953 -32.207 -15.010 -5.128 1.00111.64 C ATOM 2135 NZ LYS A 953 -33.524 -15.606 -5.498 1.00123.25 N ATOM 2136 HZ1 LYS A 953 -34.104 -15.719 -4.643 1.00 0.00 H ATOM 2137 HZ2 LYS A 953 -34.011 -14.978 -6.168 1.00 0.00 H ATOM 2138 HZ3 LYS A 953 -33.371 -16.535 -5.940 1.00 0.00 H ATOM 2139 H LYS A 953 -28.075 -11.748 -2.917 1.00 0.00 H ATOM 2140 N VAL A 954 -28.922 -8.554 -3.068 1.00 46.58 N ATOM 2141 CA VAL A 954 -28.907 -7.099 -2.870 1.00 45.33 C ATOM 2142 C VAL A 954 -28.187 -6.505 -4.070 1.00 48.24 C ATOM 2143 O VAL A 954 -27.007 -6.770 -4.271 1.00 47.90 O ATOM 2144 CB VAL A 954 -28.292 -6.654 -1.513 1.00 47.71 C ATOM 2145 CG1 VAL A 954 -28.076 -5.145 -1.475 1.00 46.71 C ATOM 2146 CG2 VAL A 954 -29.166 -7.100 -0.341 1.00 47.37 C ATOM 2147 H VAL A 954 -28.049 -9.089 -2.885 1.00 0.00 H ATOM 2148 N GLU A 955 -28.915 -5.751 -4.881 1.00 44.97 N ATOM 2149 CA GLU A 955 -28.419 -5.130 -6.118 1.00 45.17 C ATOM 2150 C GLU A 955 -27.769 -3.762 -5.869 1.00 47.34 C ATOM 2151 O GLU A 955 -28.206 -3.023 -4.996 1.00 47.45 O ATOM 2152 CB GLU A 955 -29.566 -5.015 -7.155 1.00 46.36 C ATOM 2153 CG GLU A 955 -30.126 -6.367 -7.587 1.00 53.99 C ATOM 2154 CD GLU A 955 -31.469 -6.387 -8.295 1.00 84.68 C ATOM 2155 OE1 GLU A 955 -32.357 -5.581 -7.932 1.00 79.99 O ATOM 2156 OE2 GLU A 955 -31.658 -7.271 -9.163 1.00 86.09 O ATOM 2157 H GLU A 955 -29.909 -5.587 -4.624 1.00 0.00 H ATOM 2158 N PHE A 956 -26.737 -3.440 -6.654 1.00 41.67 N ATOM 2159 CA PHE A 956 -25.977 -2.189 -6.625 1.00 40.31 C ATOM 2160 C PHE A 956 -25.932 -1.594 -8.028 1.00 44.10 C ATOM 2161 O PHE A 956 -25.724 -2.352 -8.980 1.00 44.40 O ATOM 2162 CB PHE A 956 -24.530 -2.429 -6.129 1.00 40.55 C ATOM 2163 CG PHE A 956 -24.443 -2.718 -4.652 1.00 40.66 C ATOM 2164 CD1 PHE A 956 -24.687 -3.999 -4.159 1.00 41.62 C ATOM 2165 CD2 PHE A 956 -24.166 -1.700 -3.745 1.00 41.92 C ATOM 2166 CE1 PHE A 956 -24.675 -4.253 -2.783 1.00 41.86 C ATOM 2167 CE2 PHE A 956 -24.134 -1.962 -2.366 1.00 44.47 C ATOM 2168 CZ PHE A 956 -24.377 -3.239 -1.898 1.00 41.57 C ATOM 2169 H PHE A 956 -26.444 -4.149 -7.356 1.00 0.00 H ATOM 2170 N PRO A 957 -26.068 -0.248 -8.192 1.00 38.84 N ATOM 2171 CA PRO A 957 -25.933 0.336 -9.541 1.00 37.78 C ATOM 2172 C PRO A 957 -24.452 0.378 -9.948 1.00 41.26 C ATOM 2173 O PRO A 957 -23.576 0.178 -9.100 1.00 39.41 O ATOM 2174 CB PRO A 957 -26.544 1.732 -9.385 1.00 39.10 C ATOM 2175 CG PRO A 957 -26.337 2.070 -7.962 1.00 43.28 C ATOM 2176 CD PRO A 957 -26.266 0.799 -7.167 1.00 39.18 C ATOM 2177 N ALA A 958 -24.164 0.639 -11.236 1.00 39.02 N ATOM 2178 CA ALA A 958 -22.776 0.675 -11.735 1.00 38.99 C ATOM 2179 C ALA A 958 -21.895 1.703 -11.009 1.00 43.46 C ATOM 2180 O ALA A 958 -20.729 1.431 -10.741 1.00 42.45 O ATOM 2181 CB ALA A 958 -22.772 0.941 -13.236 1.00 39.41 C ATOM 2182 H ALA A 958 -24.943 0.821 -11.900 1.00 0.00 H ATOM 2183 N MET A 959 -22.453 2.880 -10.699 1.00 41.52 N ATOM 2184 CA MET A 959 -21.734 3.928 -9.996 1.00 41.70 C ATOM 2185 C MET A 959 -21.150 3.418 -8.661 1.00 44.39 C ATOM 2186 O MET A 959 -19.954 3.603 -8.409 1.00 44.19 O ATOM 2187 CB MET A 959 -22.645 5.142 -9.806 1.00 44.81 C ATOM 2188 CG MET A 959 -22.030 6.238 -8.961 1.00 50.24 C ATOM 2189 SD MET A 959 -20.558 7.015 -9.677 1.00 55.03 S ATOM 2190 CE MET A 959 -21.318 8.256 -10.603 1.00 51.68 C ATOM 2191 H MET A 959 -23.442 3.051 -10.973 1.00 0.00 H ATOM 2192 N LEU A 960 -21.972 2.725 -7.856 1.00 41.22 N ATOM 2193 CA LEU A 960 -21.580 2.158 -6.556 1.00 41.36 C ATOM 2194 C LEU A 960 -20.650 0.954 -6.718 1.00 43.51 C ATOM 2195 O LEU A 960 -19.734 0.781 -5.924 1.00 43.50 O ATOM 2196 CB LEU A 960 -22.807 1.766 -5.704 1.00 41.66 C ATOM 2197 CG LEU A 960 -23.767 2.858 -5.125 1.00 46.94 C ATOM 2198 CD1 LEU A 960 -24.185 2.505 -3.677 1.00 46.31 C ATOM 2199 CD2 LEU A 960 -23.193 4.262 -5.161 1.00 48.61 C ATOM 2200 H LEU A 960 -22.952 2.579 -8.173 1.00 0.00 H ATOM 2201 N VAL A 961 -20.886 0.116 -7.723 1.00 39.30 N ATOM 2202 CA VAL A 961 -20.023 -1.045 -7.984 1.00 38.40 C ATOM 2203 C VAL A 961 -18.568 -0.556 -8.170 1.00 42.02 C ATOM 2204 O VAL A 961 -17.652 -1.067 -7.524 1.00 42.23 O ATOM 2205 CB VAL A 961 -20.519 -1.895 -9.203 1.00 41.09 C ATOM 2206 CG1 VAL A 961 -19.476 -2.941 -9.601 1.00 40.57 C ATOM 2207 CG2 VAL A 961 -21.857 -2.571 -8.898 1.00 40.35 C ATOM 2208 H VAL A 961 -21.704 0.287 -8.342 1.00 0.00 H ATOM 2209 N GLU A 962 -18.373 0.452 -9.017 1.00 38.16 N ATOM 2210 CA GLU A 962 -17.044 1.010 -9.301 1.00 38.07 C ATOM 2211 C GLU A 962 -16.451 1.716 -8.062 1.00 43.40 C ATOM 2212 O GLU A 962 -15.287 1.481 -7.726 1.00 43.83 O ATOM 2213 CB GLU A 962 -17.119 1.985 -10.480 1.00 38.96 C ATOM 2214 CG GLU A 962 -17.631 1.359 -11.760 1.00 41.55 C ATOM 2215 CD GLU A 962 -17.713 2.292 -12.947 1.00 56.94 C ATOM 2216 OE1 GLU A 962 -17.913 3.511 -12.743 1.00 53.57 O ATOM 2217 OE2 GLU A 962 -17.583 1.797 -14.089 1.00 47.63 O ATOM 2218 H GLU A 962 -19.198 0.863 -9.499 1.00 0.00 H ATOM 2219 N ILE A 963 -17.255 2.560 -7.378 1.00 39.84 N ATOM 2220 CA ILE A 963 -16.814 3.268 -6.176 1.00 38.59 C ATOM 2221 C ILE A 963 -16.392 2.282 -5.080 1.00 42.17 C ATOM 2222 O ILE A 963 -15.249 2.360 -4.619 1.00 42.08 O ATOM 2223 CB ILE A 963 -17.852 4.317 -5.696 1.00 40.98 C ATOM 2224 CG1 ILE A 963 -17.901 5.520 -6.671 1.00 40.28 C ATOM 2225 CG2 ILE A 963 -17.550 4.784 -4.236 1.00 41.47 C ATOM 2226 CD1 ILE A 963 -19.012 6.610 -6.332 1.00 42.15 C ATOM 2227 H ILE A 963 -18.225 2.712 -7.720 1.00 0.00 H ATOM 2228 N ILE A 964 -17.291 1.350 -4.677 1.00 39.30 N ATOM 2229 CA ILE A 964 -17.002 0.380 -3.603 1.00 39.35 C ATOM 2230 C ILE A 964 -15.783 -0.501 -3.973 1.00 43.63 C ATOM 2231 O ILE A 964 -14.916 -0.710 -3.123 1.00 42.96 O ATOM 2232 CB ILE A 964 -18.256 -0.430 -3.176 1.00 42.56 C ATOM 2233 CG1 ILE A 964 -19.361 0.517 -2.631 1.00 43.25 C ATOM 2234 CG2 ILE A 964 -17.891 -1.519 -2.141 1.00 42.01 C ATOM 2235 CD1 ILE A 964 -20.804 -0.027 -2.695 1.00 48.46 C ATOM 2236 H ILE A 964 -18.220 1.318 -5.143 1.00 0.00 H ATOM 2237 N SER A 965 -15.672 -0.921 -5.261 1.00 40.30 N ATOM 2238 CA SER A 965 -14.531 -1.709 -5.764 1.00 40.07 C ATOM 2239 C SER A 965 -13.211 -1.011 -5.509 1.00 45.08 C ATOM 2240 O SER A 965 -12.261 -1.698 -5.199 1.00 46.40 O ATOM 2241 CB SER A 965 -14.671 -2.014 -7.254 1.00 41.56 C ATOM 2242 OG SER A 965 -15.726 -2.932 -7.488 1.00 45.89 O ATOM 2243 HG SER A 965 -16.577 -2.545 -7.161 1.00 0.00 H ATOM 2244 H SER A 965 -16.432 -0.674 -5.927 1.00 0.00 H ATOM 2245 N ASP A 966 -13.138 0.329 -5.615 1.00 42.13 N ATOM 2246 CA ASP A 966 -11.895 1.080 -5.345 1.00 43.01 C ATOM 2247 C ASP A 966 -11.698 1.408 -3.858 1.00 46.56 C ATOM 2248 O ASP A 966 -10.567 1.382 -3.366 1.00 46.52 O ATOM 2249 CB ASP A 966 -11.845 2.389 -6.166 1.00 45.88 C ATOM 2250 CG ASP A 966 -11.689 2.192 -7.661 1.00 61.41 C ATOM 2251 OD1 ASP A 966 -11.105 1.159 -8.068 1.00 63.86 O ATOM 2252 OD2 ASP A 966 -12.132 3.083 -8.428 1.00 66.43 O ATOM 2253 H ASP A 966 -13.989 0.856 -5.898 1.00 0.00 H ATOM 2254 N GLN A 967 -12.798 1.751 -3.160 1.00 42.28 N ATOM 2255 CA GLN A 967 -12.798 2.127 -1.748 1.00 41.25 C ATOM 2256 C GLN A 967 -12.493 0.955 -0.818 1.00 46.65 C ATOM 2257 O GLN A 967 -11.685 1.118 0.099 1.00 48.05 O ATOM 2258 CB GLN A 967 -14.157 2.746 -1.395 1.00 41.75 C ATOM 2259 CG GLN A 967 -14.316 3.159 0.064 1.00 43.25 C ATOM 2260 CD GLN A 967 -15.748 3.472 0.413 1.00 52.59 C ATOM 2261 OE1 GLN A 967 -16.702 3.075 -0.277 1.00 44.70 O ATOM 2262 NE2 GLN A 967 -15.930 4.201 1.501 1.00 39.58 N ATOM 2263 HE22 GLN A 967 -15.111 4.518 2.058 1.00 0.00 H ATOM 2264 HE21 GLN A 967 -16.892 4.457 1.800 1.00 0.00 H ATOM 2265 H GLN A 967 -13.710 1.748 -3.660 1.00 0.00 H ATOM 2266 N LEU A 968 -13.185 -0.196 -1.001 1.00 42.25 N ATOM 2267 CA LEU A 968 -13.051 -1.363 -0.126 1.00 42.48 C ATOM 2268 C LEU A 968 -11.560 -1.779 0.081 1.00 47.18 C ATOM 2269 O LEU A 968 -11.147 -1.732 1.245 1.00 47.97 O ATOM 2270 CB LEU A 968 -13.960 -2.526 -0.575 1.00 42.39 C ATOM 2271 CG LEU A 968 -14.081 -3.759 0.303 1.00 46.88 C ATOM 2272 CD1 LEU A 968 -14.066 -3.400 1.765 1.00 47.89 C ATOM 2273 CD2 LEU A 968 -15.344 -4.526 -0.026 1.00 45.66 C ATOM 2274 H LEU A 968 -13.844 -0.253 -1.803 1.00 0.00 H ATOM 2275 N PRO A 969 -10.727 -2.064 -0.969 1.00 42.08 N ATOM 2276 CA PRO A 969 -9.295 -2.365 -0.725 1.00 41.05 C ATOM 2277 C PRO A 969 -8.521 -1.298 0.045 1.00 46.48 C ATOM 2278 O PRO A 969 -7.612 -1.642 0.794 1.00 47.48 O ATOM 2279 CB PRO A 969 -8.709 -2.555 -2.139 1.00 42.21 C ATOM 2280 CG PRO A 969 -9.685 -1.985 -3.063 1.00 47.21 C ATOM 2281 CD PRO A 969 -11.038 -2.181 -2.410 1.00 42.96 C ATOM 2282 N LYS A 970 -8.871 -0.015 -0.116 1.00 44.32 N ATOM 2283 CA LYS A 970 -8.202 1.074 0.617 1.00 44.23 C ATOM 2284 C LYS A 970 -8.560 1.018 2.107 1.00 49.23 C ATOM 2285 O LYS A 970 -7.674 1.099 2.943 1.00 50.12 O ATOM 2286 CB LYS A 970 -8.566 2.443 0.028 1.00 45.75 C ATOM 2287 CG LYS A 970 -8.064 2.680 -1.386 1.00 51.51 C ATOM 2288 CD LYS A 970 -8.311 4.133 -1.803 1.00 57.70 C ATOM 2289 CE LYS A 970 -8.170 4.335 -3.291 1.00 70.70 C ATOM 2290 NZ LYS A 970 -8.963 5.503 -3.760 1.00 80.27 N ATOM 2291 HZ1 LYS A 970 -9.968 5.348 -3.542 1.00 0.00 H ATOM 2292 HZ2 LYS A 970 -8.631 6.362 -3.278 1.00 0.00 H ATOM 2293 HZ3 LYS A 970 -8.843 5.612 -4.787 1.00 0.00 H ATOM 2294 H LYS A 970 -9.638 0.219 -0.778 1.00 0.00 H ATOM 2295 N VAL A 971 -9.849 0.855 2.438 1.00 46.28 N ATOM 2296 CA VAL A 971 -10.359 0.755 3.822 1.00 45.96 C ATOM 2297 C VAL A 971 -9.796 -0.510 4.521 1.00 48.87 C ATOM 2298 O VAL A 971 -9.251 -0.417 5.614 1.00 47.90 O ATOM 2299 CB VAL A 971 -11.918 0.807 3.833 1.00 49.33 C ATOM 2300 CG1 VAL A 971 -12.492 0.477 5.207 1.00 49.05 C ATOM 2301 CG2 VAL A 971 -12.433 2.161 3.334 1.00 48.90 C ATOM 2302 H VAL A 971 -10.541 0.794 1.664 1.00 0.00 H ATOM 2303 N GLU A 972 -9.892 -1.666 3.853 1.00 46.78 N ATOM 2304 CA GLU A 972 -9.437 -2.972 4.327 1.00 47.54 C ATOM 2305 C GLU A 972 -7.950 -3.007 4.670 1.00 54.14 C ATOM 2306 O GLU A 972 -7.570 -3.655 5.644 1.00 54.46 O ATOM 2307 CB GLU A 972 -9.735 -4.029 3.266 1.00 49.12 C ATOM 2308 CG GLU A 972 -10.285 -5.321 3.832 1.00 63.47 C ATOM 2309 CD GLU A 972 -10.593 -6.380 2.794 1.00 88.01 C ATOM 2310 OE1 GLU A 972 -10.731 -6.027 1.598 1.00 77.52 O ATOM 2311 OE2 GLU A 972 -10.697 -7.567 3.180 1.00 87.37 O ATOM 2312 H GLU A 972 -10.330 -1.632 2.911 1.00 0.00 H ATOM 2313 N SER A 973 -7.117 -2.323 3.869 1.00 51.79 N ATOM 2314 CA SER A 973 -5.667 -2.253 4.061 1.00 52.28 C ATOM 2315 C SER A 973 -5.210 -1.176 5.075 1.00 57.39 C ATOM 2316 O SER A 973 -4.014 -1.067 5.350 1.00 56.50 O ATOM 2317 CB SER A 973 -4.966 -2.056 2.719 1.00 55.24 C ATOM 2318 OG SER A 973 -5.315 -0.814 2.134 1.00 62.59 O ATOM 2319 HG SER A 973 -6.293 -0.783 1.987 1.00 0.00 H ATOM 2320 H SER A 973 -7.527 -1.811 3.062 1.00 0.00 H ATOM 2321 N GLY A 974 -6.157 -0.411 5.627 1.00 54.47 N ATOM 2322 CA GLY A 974 -5.861 0.658 6.577 1.00 53.49 C ATOM 2323 C GLY A 974 -5.416 1.937 5.899 1.00 57.64 C ATOM 2324 O GLY A 974 -4.903 2.838 6.567 1.00 58.78 O ATOM 2325 H GLY A 974 -7.149 -0.585 5.368 1.00 0.00 H ATOM 2326 N ASN A 975 -5.605 2.032 4.565 1.00 52.97 N ATOM 2327 CA ASN A 975 -5.267 3.229 3.794 1.00 53.45 C ATOM 2328 C ASN A 975 -6.483 4.171 3.752 1.00 58.40 C ATOM 2329 O ASN A 975 -7.149 4.301 2.711 1.00 59.43 O ATOM 2330 CB ASN A 975 -4.766 2.875 2.374 1.00 52.14 C ATOM 2331 CG ASN A 975 -4.331 4.074 1.542 1.00 72.10 C ATOM 2332 OD1 ASN A 975 -4.516 4.112 0.322 1.00 67.93 O ATOM 2333 ND2 ASN A 975 -3.754 5.087 2.173 1.00 65.30 N ATOM 2334 HD22 ASN A 975 -3.604 5.042 3.201 1.00 0.00 H ATOM 2335 HD21 ASN A 975 -3.451 5.927 1.640 1.00 0.00 H ATOM 2336 H ASN A 975 -6.010 1.216 4.062 1.00 0.00 H ATOM 2337 N ALA A 976 -6.825 4.737 4.918 1.00 53.07 N ATOM 2338 CA ALA A 976 -7.942 5.671 5.102 1.00 52.80 C ATOM 2339 C ALA A 976 -7.731 6.373 6.418 1.00 57.86 C ATOM 2340 O ALA A 976 -7.727 5.730 7.470 1.00 59.47 O ATOM 2341 CB ALA A 976 -9.274 4.939 5.094 1.00 53.38 C ATOM 2342 H ALA A 976 -6.256 4.496 5.755 1.00 0.00 H ATOM 2343 N LYS A 977 -7.453 7.675 6.358 1.00 53.05 N ATOM 2344 CA LYS A 977 -7.191 8.477 7.542 1.00 52.20 C ATOM 2345 C LYS A 977 -8.352 9.441 7.808 1.00 55.27 C ATOM 2346 O LYS A 977 -8.421 10.503 7.177 1.00 55.85 O ATOM 2347 CB LYS A 977 -5.850 9.221 7.404 1.00 54.05 C ATOM 2348 CG LYS A 977 -5.334 9.859 8.685 1.00 56.79 C ATOM 2349 CD LYS A 977 -4.136 10.727 8.360 1.00 69.89 C ATOM 2350 CE LYS A 977 -3.498 11.353 9.574 1.00 86.08 C ATOM 2351 NZ LYS A 977 -2.391 12.270 9.185 1.00100.67 N ATOM 2352 HZ1 LYS A 977 -1.666 11.735 8.666 1.00 0.00 H ATOM 2353 HZ2 LYS A 977 -2.766 13.027 8.578 1.00 0.00 H ATOM 2354 HZ3 LYS A 977 -1.971 12.686 10.040 1.00 0.00 H ATOM 2355 H LYS A 977 -7.422 8.136 5.426 1.00 0.00 H ATOM 2356 N PRO A 978 -9.288 9.096 8.717 1.00 50.78 N ATOM 2357 CA PRO A 978 -10.360 10.051 9.042 1.00 50.22 C ATOM 2358 C PRO A 978 -9.801 11.249 9.823 1.00 51.22 C ATOM 2359 O PRO A 978 -9.011 11.072 10.759 1.00 50.55 O ATOM 2360 CB PRO A 978 -11.334 9.230 9.890 1.00 52.01 C ATOM 2361 CG PRO A 978 -10.519 8.147 10.473 1.00 56.52 C ATOM 2362 CD PRO A 978 -9.368 7.881 9.554 1.00 52.30 C ATOM 2363 N LEU A 979 -10.184 12.461 9.411 1.00 44.92 N ATOM 2364 CA LEU A 979 -9.749 13.692 10.060 1.00 44.38 C ATOM 2365 C LEU A 979 -10.773 14.115 11.089 1.00 49.49 C ATOM 2366 O LEU A 979 -11.954 14.231 10.778 1.00 48.90 O ATOM 2367 CB LEU A 979 -9.480 14.821 9.035 1.00 43.76 C ATOM 2368 CG LEU A 979 -8.484 14.511 7.873 1.00 46.82 C ATOM 2369 CD1 LEU A 979 -8.393 15.687 6.902 1.00 46.50 C ATOM 2370 CD2 LEU A 979 -7.087 14.109 8.390 1.00 42.17 C ATOM 2371 H LEU A 979 -10.820 12.529 8.591 1.00 0.00 H ATOM 2372 N TYR A 980 -10.327 14.310 12.325 1.00 48.78 N ATOM 2373 CA TYR A 980 -11.208 14.723 13.425 1.00 49.47 C ATOM 2374 C TYR A 980 -10.998 16.171 13.896 1.00 54.39 C ATOM 2375 O TYR A 980 -9.908 16.728 13.734 1.00 54.97 O ATOM 2376 CB TYR A 980 -11.031 13.770 14.602 1.00 50.10 C ATOM 2377 CG TYR A 980 -11.580 12.388 14.342 1.00 51.50 C ATOM 2378 CD1 TYR A 980 -12.909 12.080 14.622 1.00 53.60 C ATOM 2379 CD2 TYR A 980 -10.757 11.366 13.881 1.00 51.70 C ATOM 2380 CE1 TYR A 980 -13.413 10.793 14.420 1.00 54.39 C ATOM 2381 CE2 TYR A 980 -11.249 10.077 13.677 1.00 52.45 C ATOM 2382 CZ TYR A 980 -12.578 9.795 13.947 1.00 59.96 C ATOM 2383 OH TYR A 980 -13.066 8.528 13.736 1.00 62.65 O ATOM 2384 HH TYR A 980 -14.026 8.501 13.978 1.00 0.00 H ATOM 2385 H TYR A 980 -9.316 14.165 12.521 1.00 0.00 H ATOM 2386 N PHE A 981 -12.035 16.766 14.498 1.00 51.30 N ATOM 2387 CA PHE A 981 -11.938 18.101 15.104 1.00 51.70 C ATOM 2388 C PHE A 981 -11.525 18.008 16.581 1.00 57.10 C ATOM 2389 O PHE A 981 -10.684 18.781 17.018 1.00 56.40 O ATOM 2390 CB PHE A 981 -13.242 18.902 14.970 1.00 52.87 C ATOM 2391 CG PHE A 981 -13.501 19.350 13.557 1.00 53.70 C ATOM 2392 CD1 PHE A 981 -12.843 20.454 13.029 1.00 56.13 C ATOM 2393 CD2 PHE A 981 -14.386 18.654 12.743 1.00 54.91 C ATOM 2394 CE1 PHE A 981 -13.062 20.851 11.706 1.00 57.28 C ATOM 2395 CE2 PHE A 981 -14.603 19.050 11.421 1.00 57.94 C ATOM 2396 CZ PHE A 981 -13.937 20.142 10.908 1.00 56.26 C ATOM 2397 H PHE A 981 -12.945 16.264 14.538 1.00 0.00 H ATOM 2398 N HIS A 982 -12.098 17.048 17.325 1.00 55.41 N ATOM 2399 CA HIS A 982 -11.869 16.857 18.756 1.00 56.58 C ATOM 2400 C HIS A 982 -11.204 15.523 19.122 1.00 63.88 C ATOM 2401 O HIS A 982 -11.223 15.137 20.299 1.00 65.03 O ATOM 2402 CB HIS A 982 -13.186 17.037 19.522 1.00 57.38 C ATOM 2403 CG HIS A 982 -13.965 18.237 19.080 1.00 61.32 C ATOM 2404 ND1 HIS A 982 -13.759 19.477 19.648 1.00 63.26 N ATOM 2405 CD2 HIS A 982 -14.920 18.344 18.125 1.00 63.63 C ATOM 2406 CE1 HIS A 982 -14.595 20.296 19.032 1.00 63.13 C ATOM 2407 NE2 HIS A 982 -15.303 19.662 18.096 1.00 63.53 N ATOM 2408 H HIS A 982 -12.751 16.394 16.849 1.00 0.00 H ATOM 2409 N ARG A 983 -10.625 14.818 18.126 1.00 60.97 N ATOM 2410 CA ARG A 983 -9.939 13.527 18.310 1.00 84.41 C ATOM 2411 C ARG A 983 -8.656 13.508 17.470 1.00129.44 C ATOM 2412 O ARG A 983 -7.794 12.649 17.656 1.00 99.57 O ATOM 2413 CB ARG A 983 -10.848 12.330 17.927 1.00 82.48 C ATOM 2414 CG ARG A 983 -12.201 12.282 18.633 1.00 85.65 C ATOM 2415 CD ARG A 983 -13.100 11.197 18.074 1.00 83.84 C ATOM 2416 NE ARG A 983 -14.516 11.538 18.225 1.00 85.49 N ATOM 2417 CZ ARG A 983 -15.525 10.820 17.735 1.00 94.36 C ATOM 2418 NH1 ARG A 983 -15.286 9.706 17.049 1.00 78.39 N ATOM 2419 NH2 ARG A 983 -16.780 11.210 17.925 1.00 73.34 N ATOM 2420 HE ARG A 983 -14.751 12.403 18.753 1.00 0.00 H ATOM 2421 HH12 ARG A 983 -16.078 9.149 16.669 1.00 0.00 H ATOM 2422 HH11 ARG A 983 -14.307 9.391 16.893 1.00 0.00 H ATOM 2423 HH22 ARG A 983 -17.564 10.645 17.540 1.00 0.00 H ATOM 2424 HH21 ARG A 983 -16.979 12.080 18.459 1.00 0.00 H ATOM 2425 H ARG A 983 -10.666 15.213 17.165 1.00 0.00 H TER 2426 ARG A 983 HETATM 2427 O HOH 1 -28.511 6.078 -13.961 1.00 64.17 O HETATM 2428 O HOH 2 -8.542 21.220 13.914 1.00 66.23 O HETATM 2429 O HOH 3 -24.306 22.890 -1.972 1.00 59.89 O HETATM 2430 O HOH 4 -25.136 21.112 -9.117 1.00 73.20 O HETATM 2431 O HOH 5 -30.136 18.462 -0.155 1.00 70.68 O HETATM 2432 O HOH 6 -32.454 13.741 -3.485 1.00 57.92 O HETATM 2433 O HOH 7 -33.515 11.358 -2.919 1.00 49.01 O HETATM 2434 O HOH 8 -29.221 4.239 -10.364 1.00 48.94 O HETATM 2435 O HOH 9 -27.115 5.607 -11.456 1.00 54.79 O HETATM 2436 O HOH 10 -28.998 11.473 0.241 1.00 42.46 O HETATM 2437 O HOH 11 -26.260 18.432 -9.140 1.00 63.24 O HETATM 2438 O HOH 12 -10.480 19.348 -12.670 1.00 71.46 O HETATM 2439 O HOH 13 -7.815 7.904 -7.306 1.00 66.15 O HETATM 2440 O HOH 14 -5.023 10.755 -4.226 1.00 49.97 O HETATM 2441 O HOH 15 -10.471 6.869 -1.693 1.00 58.64 O HETATM 2442 O HOH 16 -13.072 12.562 2.270 1.00 41.14 O HETATM 2443 O HOH 17 -8.873 5.543 -6.611 1.00 63.98 O HETATM 2444 O HOH 18 -15.075 5.128 -9.155 1.00 44.75 O HETATM 2445 O HOH 19 -14.179 5.533 3.235 1.00 39.39 O HETATM 2446 O HOH 20 -14.826 10.869 4.400 1.00 48.81 O HETATM 2447 O HOH 21 -17.236 11.726 7.465 1.00 51.37 O HETATM 2448 O HOH 22 -43.137 15.040 0.250 1.00 52.91 O HETATM 2449 O HOH 23 -44.687 8.716 0.977 1.00 65.90 O HETATM 2450 O HOH 24 -43.461 6.156 2.084 1.00 72.95 O HETATM 2451 O HOH 25 -41.899 4.228 9.331 1.00 59.28 O HETATM 2452 O HOH 26 -35.738 -5.061 15.418 1.00 73.64 O HETATM 2453 O HOH 27 -22.862 14.503 17.771 1.00 69.91 O HETATM 2454 O HOH 28 -23.376 18.047 18.579 1.00 56.66 O HETATM 2455 O HOH 29 -30.812 28.564 14.282 1.00 50.76 O HETATM 2456 O HOH 30 -32.295 27.904 6.785 1.00 48.23 O HETATM 2457 O HOH 31 -29.216 29.817 5.827 1.00 50.08 O HETATM 2458 O HOH 32 -24.080 17.187 -2.399 1.00 64.57 O HETATM 2459 O HOH 33 -14.167 17.050 8.995 1.00 71.58 O HETATM 2460 O HOH 34 -16.590 13.451 9.448 1.00 49.82 O HETATM 2461 O HOH 35 -1.456 6.502 1.441 1.00 62.54 O HETATM 2462 O HOH 36 2.230 16.469 -1.699 1.00 72.04 O HETATM 2463 O HOH 37 -3.368 15.703 7.938 1.00 59.80 O HETATM 2464 O HOH 38 -9.023 19.351 12.055 1.00 64.64 O HETATM 2465 O HOH 39 -22.637 35.710 17.536 1.00 39.57 O HETATM 2466 O HOH 40 -28.551 29.993 14.338 1.00 48.81 O HETATM 2467 O HOH 41 -23.324 38.184 18.468 1.00 48.44 O HETATM 2468 O HOH 42 -19.744 32.526 22.378 1.00 35.82 O HETATM 2469 O HOH 43 -20.293 30.177 23.535 1.00 41.40 O HETATM 2470 O HOH 44 -22.696 -2.273 10.306 1.00 40.20 O HETATM 2471 O HOH 45 -20.720 -11.421 -4.888 1.00 65.64 O HETATM 2472 O HOH 46 -28.597 -2.585 -9.941 1.00 51.73 O HETATM 2473 O HOH 47 -25.004 3.857 -12.039 1.00 44.72 O HETATM 2474 O HOH 48 -26.557 1.046 -13.200 1.00 24.20 O HETATM 2475 O HOH 49 -17.257 5.403 -10.764 1.00 49.73 O HETATM 2476 O HOH 50 -16.162 0.026 -15.481 1.00 47.39 O HETATM 2477 O HOH 51 -8.280 0.664 -4.788 1.00 57.02 O HETATM 2478 O HOH 52 -8.005 2.609 -6.797 1.00 60.10 O HETATM 2479 O HOH 53 -9.027 -4.939 8.151 1.00 65.31 O HETATM 2480 O HOH 54 -4.528 5.272 8.499 1.00 74.71 O HETATM 2481 O HOH 55 -7.396 13.964 13.015 1.00 66.48 O HETATM 2482 O HOH 56 -7.064 17.416 11.680 1.00 65.77 O HETATM 2483 O HOH 57 -13.708 5.443 5.885 1.00 50.49 O HETATM 2484 O HOH 58 -10.791 5.150 -14.054 1.00 69.57 O HETATM 2485 O HOH 59 -12.239 5.993 -10.761 1.00 61.88 O HETATM 2486 O HOH 60 -16.488 12.710 -20.149 1.00 70.85 O HETATM 2487 C1 CV A 7 -25.768 1.455 1.495 1.00 -0.06 C HETATM 2488 C2 CV A 7 -27.131 1.526 2.210 1.00 0.01 C HETATM 2489 C3 CV A 7 -28.283 1.754 1.225 1.00 -0.02 C HETATM 2490 C4 CV A 7 -28.238 3.119 0.549 1.00 0.05 C HETATM 2491 C6 CV A 7 -28.119 4.311 1.523 1.00 -0.05 C HETATM 2492 C8 CV A 7 -27.122 4.077 2.692 1.00 -0.04 C HETATM 2493 C10 CV A 7 -27.215 2.648 3.241 1.00 -0.03 C HETATM 2494 C12 CV A 7 -26.344 2.158 4.382 1.00 -0.02 C HETATM 2495 C13 CV A 7 -26.552 0.645 4.384 1.00 0.10 C HETATM 2496 C15 CV A 7 -27.304 0.286 3.107 1.00 0.17 C HETATM 2497 O16 CV A 7 -28.672 0.086 3.516 1.00 -0.34 O HETATM 2498 C17 CV A 7 -28.631 -0.213 4.907 1.00 0.16 C HETATM 2499 O19 CV A 7 -27.421 0.295 5.456 1.00 -0.35 O HETATM 2500 C20 CV A 7 -29.738 0.435 5.698 1.00 0.01 C HETATM 2501 C21 CV A 7 -30.707 1.270 4.899 1.00 -0.05 C HETATM 2502 C22 CV A 7 -31.690 1.971 5.818 1.00 -0.05 C HETATM 2503 C23 CV A 7 -32.391 1.003 6.745 1.00 -0.05 C HETATM 2504 C24 CV A 7 -31.409 0.106 7.475 1.00 -0.05 C HETATM 2505 C25 CV A 7 -30.487 -0.602 6.501 1.00 -0.05 C HETATM 2506 H23 CV A 7 -29.772 -1.227 7.056 1.00 0.03 H HETATM 2507 H24 CV A 7 -31.080 -1.236 5.825 1.00 0.03 H HETATM 2508 H21 CV A 7 -31.969 -0.646 8.051 1.00 0.03 H HETATM 2509 H22 CV A 7 -30.805 0.718 8.161 1.00 0.03 H HETATM 2510 H19 CV A 7 -33.074 0.375 6.153 1.00 0.03 H HETATM 2511 H20 CV A 7 -32.968 1.575 7.486 1.00 0.03 H HETATM 2512 H17 CV A 7 -32.445 2.485 5.205 1.00 0.03 H HETATM 2513 H18 CV A 7 -31.145 2.710 6.423 1.00 0.03 H HETATM 2514 H15 CV A 7 -31.261 0.619 4.207 1.00 0.03 H HETATM 2515 H16 CV A 7 -30.148 2.024 4.325 1.00 0.03 H HETATM 2516 H14 CV A 7 -29.252 1.118 6.411 1.00 0.04 H HETATM 2517 H13 CV A 7 -28.681 -1.304 5.035 1.00 0.09 H HETATM 2518 C26 CV A 7 -26.808 -1.027 2.500 1.00 0.19 C HETATM 2519 O27 CV A 7 -25.721 -1.495 2.802 1.00 -0.33 O HETATM 2520 C28 CV A 7 -27.694 -1.774 1.523 1.00 0.12 C HETATM 2521 O29 CV A 7 -26.874 -2.610 0.706 1.00 -0.38 O HETATM 2522 H27 CV A 7 -26.407 -3.228 1.256 1.00 0.21 H HETATM 2523 H25 CV A 7 -28.235 -1.055 0.890 1.00 0.08 H HETATM 2524 H26 CV A 7 -28.416 -2.392 2.077 1.00 0.08 H HETATM 2525 H12 CV A 7 -25.592 0.113 4.455 1.00 0.06 H HETATM 2526 H10 CV A 7 -26.667 2.598 5.337 1.00 0.03 H HETATM 2527 H11 CV A 7 -25.288 2.407 4.202 1.00 0.03 H HETATM 2528 H9 CV A 7 -28.240 2.615 3.640 1.00 0.03 H HETATM 2529 C30 CV A 7 -27.385 5.132 3.774 1.00 -0.04 C HETATM 2530 C31 CV A 7 -27.279 6.560 3.237 1.00 -0.03 C HETATM 2531 C32 CV A 7 -28.080 6.708 1.979 1.00 -0.08 C HETATM 2532 C33 CV A 7 -28.973 7.701 1.898 1.00 0.03 C HETATM 2533 C34 CV A 7 -29.805 7.839 0.668 1.00 0.25 C HETATM 2534 O35 CV A 7 -30.593 8.761 0.551 1.00 -0.27 O HETATM 2535 C36 CV A 7 -29.712 6.836 -0.417 1.00 0.04 C HETATM 2536 C37 CV A 7 -28.805 5.865 -0.269 1.00 -0.10 C HETATM 2537 C38 CV A 7 -27.859 5.695 0.883 1.00 -0.05 C HETATM 2538 C39 CV A 7 -26.455 5.908 0.297 1.00 -0.10 C HETATM 2539 H35 CV A 7 -26.385 6.920 -0.128 1.00 0.01 H HETATM 2540 H36 CV A 7 -26.271 5.165 -0.493 1.00 0.01 H HETATM 2541 H37 CV A 7 -25.704 5.792 1.092 1.00 0.01 H HETATM 2542 H34 CV A 7 -28.747 5.123 -1.064 1.00 0.05 H HETATM 2543 H33 CV A 7 -30.353 6.887 -1.296 1.00 0.12 H HETATM 2544 H32 CV A 7 -29.091 8.402 2.723 1.00 0.11 H HETATM 2545 H30 CV A 7 -26.224 6.789 3.024 1.00 0.04 H HETATM 2546 H31 CV A 7 -27.661 7.261 3.994 1.00 0.04 H HETATM 2547 H28 CV A 7 -26.648 5.003 4.580 1.00 0.03 H HETATM 2548 H29 CV A 7 -28.398 4.981 4.176 1.00 0.03 H HETATM 2549 H8 CV A 7 -26.101 4.221 2.311 1.00 0.03 H HETATM 2550 H7 CV A 7 -29.113 4.388 1.988 1.00 0.02 H HETATM 2551 O40 CV A 7 -27.220 3.093 -0.455 1.00 -0.39 O HETATM 2552 H38 CV A 7 -27.351 2.339 -1.018 1.00 0.21 H HETATM 2553 H6 CV A 7 -29.199 3.250 0.030 1.00 0.06 H HETATM 2554 H4 CV A 7 -29.233 1.667 1.773 1.00 0.03 H HETATM 2555 H5 CV A 7 -28.236 0.978 0.447 1.00 0.03 H HETATM 2556 H1 CV A 7 -25.644 2.340 0.854 1.00 0.02 H HETATM 2557 H2 CV A 7 -25.725 0.546 0.877 1.00 0.02 H HETATM 2558 H3 CV A 7 -24.962 1.428 2.243 1.00 0.02 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 175 176 181 182 183 CONECT 182 175 CONECT 183 175 CONECT 2487 2488 2556 2557 2558 CONECT 2488 2487 2489 2493 2496 CONECT 2489 2488 2490 2554 2555 CONECT 2490 2489 2491 2551 2553 CONECT 2491 2490 2492 2537 2550 CONECT 2492 2491 2493 2529 2549 CONECT 2493 2488 2492 2494 2528 CONECT 2494 2493 2495 2526 2527 CONECT 2495 2494 2496 2499 2525 CONECT 2496 2488 2495 2497 2518 CONECT 2497 2496 2498 CONECT 2498 2497 2499 2500 2517 CONECT 2499 2495 2498 CONECT 2500 2498 2501 2505 2516 CONECT 2501 2500 2502 2514 2515 CONECT 2502 2501 2503 2512 2513 CONECT 2503 2502 2504 2510 2511 CONECT 2504 2503 2505 2508 2509 CONECT 2505 2500 2504 2506 2507 CONECT 2506 2505 CONECT 2507 2505 CONECT 2508 2504 CONECT 2509 2504 CONECT 2510 2503 CONECT 2511 2503 CONECT 2512 2502 CONECT 2513 2502 CONECT 2514 2501 CONECT 2515 2501 CONECT 2516 2500 CONECT 2517 2498 CONECT 2518 2496 2519 2520 CONECT 2519 2518 CONECT 2520 2518 2521 2523 2524 CONECT 2521 2520 2522 CONECT 2522 2521 CONECT 2523 2520 CONECT 2524 2520 CONECT 2525 2495 CONECT 2526 2494 CONECT 2527 2494 CONECT 2528 2493 CONECT 2529 2492 2530 2547 2548 CONECT 2530 2529 2531 2545 2546 CONECT 2531 2530 2532 2537 CONECT 2532 2531 2533 2544 CONECT 2533 2532 2534 2535 CONECT 2534 2533 CONECT 2535 2533 2536 2543 CONECT 2536 2535 2537 2542 CONECT 2537 2491 2531 2536 2538 CONECT 2538 2537 2539 2540 2541 CONECT 2539 2538 CONECT 2540 2538 CONECT 2541 2538 CONECT 2542 2536 CONECT 2543 2535 CONECT 2544 2532 CONECT 2545 2530 CONECT 2546 2530 CONECT 2547 2529 CONECT 2548 2529 CONECT 2549 2492 CONECT 2550 2491 CONECT 2551 2490 2552 CONECT 2552 2551 CONECT 2553 2490 CONECT 2554 2489 CONECT 2555 2489 CONECT 2556 2487 CONECT 2557 2487 CONECT 2558 2487 MASTER 0 0 0 0 0 0 0 0 2556 2 79 20 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 4udb
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2a3i
RCSB PDB
PDBbind
12aa, >2A3I_2|Chain... at 100%
2aa6
RCSB PDB
PDBbind
275aa, >2AA6_1|Chains... at 90%
2oax
RCSB PDB
PDBbind
256aa, >2OAX_1|Chains... at 96%
3vhv
RCSB PDB
PDBbind
260aa, >3VHV_1|Chain... at 95%
3wff
RCSB PDB
PDBbind
275aa, >3WFF_1|Chain... at 90%
3wfg
RCSB PDB
PDBbind
275aa, >3WFG_1|Chain... at 90%
4pf3
RCSB PDB
PDBbind
275aa, >4PF3_1|Chain... at 90%
4uda
RCSB PDB
PDBbind
251aa, >4UDA_1|Chain... at 99%
5hcv
RCSB PDB
PDBbind
257aa, >5HCV_1|Chains... at 96%
5l7e
RCSB PDB
PDBbind
305aa, >5L7E_1|Chain... *
5l7g
RCSB PDB
PDBbind
305aa, >5L7G_1|Chain... at 100%
5l7h
RCSB PDB
PDBbind
305aa, >5L7H_1|Chain... at 100%
5mwp
RCSB PDB
PDBbind
15aa, >5MWP_2|Chain... at 100%
5mwy
RCSB PDB
PDBbind
15aa, >5MWY_2|Chain... at 100%
6ggg
RCSB PDB
PDBbind
305aa, >6GGG_1|Chain... at 100%
6gg8
RCSB PDB
PDBbind
305aa, >6GG8_1|Chain... at 99%
6gev
RCSB PDB
PDBbind
15aa, >6GEV_2|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4udb
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
mineralocorticoid receptor, MR
Ligand Name
CV7
EC.Number
E.C.-.-.-.-
Resolution
2.36(Å)
Affinity (Kd/Ki/IC50)
IC50=0.7nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Structure Vol. 23: pp. 2280-2290
Ligand Properties
Formula
C
2
8
H
3
8
O
6
Molecular Weight
470.598
Exact Mass
470.267
No. of atoms
72
No. of bonds
77
Polar Surface Area
93.06
LOGP Value
3.67 (
Computed with XLOGP3
)
3.50 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 6
Canonical SMILES
OCC(=O)[C@@]12O[C@@H](O[C@@H]1C[C@@H]1[C@]2(C)C[C@H](O)[C@H]2[C@H]1CCC1=CC(=O)C=C[C@]21C)C1CCCCC1
InChI String
InChI=1S/C28H38O6/c1-26-11-10-18(30)12-17(26)8-9-19-20-13-23-28(22(32)15-29,27(20,2)14-21(31)24(19)26)34-25(33-23)16-6-4-3-5-7-16/h10-12,16,19-21,23-25,29,31H,3-9,13-15H2,1-2H3/t19-,20-,21-,23+,24+,25+,26-,27-,28+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P08235
Q15788
Entrez Gene ID
NCBI Entrez Gene ID:
4306
8648
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com