Browse entries in the PDBbind-CN Database
HEADER 6MTV_COMPLEX COMPND 6MTV_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 18 LEU ILE GLU PRO ALA ARG ILE GLU GLU GLU GLU LEU THR SEQRES 2 A 18 LEU THR ILE LEU ARG SEQRES 1 A 80 GLY GLY LEU GLY ILE SER ILE ALA GLY GLY LYS GLY SER SEQRES 2 A 80 THR PRO TYR LYS GLY ASP ASP GLU GLY ILE PHE ILE SER SEQRES 3 A 80 ARG VAL SER GLU GLU GLY PRO ALA ALA ARG ALA GLY VAL SEQRES 4 A 80 ARG VAL GLY ASP LYS LEU LEU GLU VAL ASN GLY VAL ALA SEQRES 5 A 80 LEU GLN GLY ALA GLU HIS HIS GLU ALA VAL GLU ALA LEU SEQRES 6 A 80 ARG GLY ALA GLY THR ALA VAL GLN MET ARG VAL TRP ARG SEQRES 7 A 80 GLU ARG HET HIS A 104 96 ATOM 1 N LEU A 716 -38.368 -19.535 25.631 1.00 86.06 N ATOM 2 CA LEU A 716 -36.954 -19.217 25.826 1.00 85.07 C ATOM 3 C LEU A 716 -36.302 -18.930 24.473 1.00 76.79 C ATOM 4 O LEU A 716 -36.470 -19.684 23.512 1.00 70.10 O ATOM 5 CB LEU A 716 -36.250 -20.358 26.557 1.00104.80 C ATOM 6 CG LEU A 716 -36.875 -20.683 27.919 1.00 86.61 C ATOM 7 CD1 LEU A 716 -36.144 -21.809 28.637 1.00 90.14 C ATOM 8 CD2 LEU A 716 -36.924 -19.434 28.802 1.00 90.91 C ATOM 9 HN3 LEU A 716 -38.453 -20.373 25.021 1.00 0.00 H ATOM 10 HN2 LEU A 716 -38.845 -18.728 25.181 1.00 0.00 H ATOM 11 HN1 LEU A 716 -38.809 -19.730 26.553 1.00 0.00 H ATOM 12 N ILE A 717 -35.556 -17.825 24.399 1.00 78.09 N ATOM 13 CA ILE A 717 -35.092 -17.288 23.128 1.00 85.76 C ATOM 14 C ILE A 717 -33.780 -16.547 23.336 1.00 88.65 C ATOM 15 O ILE A 717 -33.464 -16.085 24.432 1.00 90.67 O ATOM 16 CB ILE A 717 -36.147 -16.340 22.504 1.00 74.07 C ATOM 17 H ILE A 717 -35.298 -17.332 25.278 1.00 0.00 H ATOM 18 N GLU A 718 -33.007 -16.440 22.260 1.00 84.45 N ATOM 19 CA GLU A 718 -31.783 -15.658 22.299 1.00 90.78 C ATOM 20 C GLU A 718 -32.119 -14.184 22.516 1.00 90.20 C ATOM 21 O GLU A 718 -33.125 -13.693 22.003 1.00 90.74 O ATOM 22 CB GLU A 718 -30.993 -15.830 21.001 1.00 97.72 C ATOM 23 CG GLU A 718 -30.461 -17.238 20.762 1.00 99.65 C ATOM 24 CD GLU A 718 -29.538 -17.311 19.559 1.00 91.52 C ATOM 25 OE1 GLU A 718 -29.513 -18.362 18.884 1.00 79.41 O ATOM 26 OE2 GLU A 718 -28.838 -16.312 19.288 1.00 84.45 O ATOM 27 H GLU A 718 -33.281 -16.922 21.380 1.00 0.00 H ATOM 28 N PRO A 719 -31.296 -13.464 23.284 1.00 97.24 N ATOM 29 CA PRO A 719 -31.550 -12.030 23.471 1.00 91.22 C ATOM 30 C PRO A 719 -31.225 -11.218 22.239 1.00 80.81 C ATOM 31 O PRO A 719 -30.880 -11.771 21.183 1.00 78.74 O ATOM 32 CB PRO A 719 -30.623 -11.654 24.644 1.00102.24 C ATOM 33 CG PRO A 719 -30.130 -12.959 25.207 1.00105.79 C ATOM 34 CD PRO A 719 -30.141 -13.920 24.064 1.00108.91 C ATOM 35 N ALA A 720 -31.322 -9.902 22.364 1.00 78.64 N ATOM 36 CA ALA A 720 -30.858 -8.990 21.331 1.00 75.04 C ATOM 37 C ALA A 720 -29.343 -8.868 21.419 1.00 71.29 C ATOM 38 O ALA A 720 -28.799 -8.566 22.487 1.00 75.83 O ATOM 39 CB ALA A 720 -31.517 -7.622 21.501 1.00 70.80 C ATOM 40 H ALA A 720 -31.744 -9.509 23.229 1.00 0.00 H ATOM 41 N ARG A 721 -28.661 -9.102 20.302 1.00 71.62 N ATOM 42 CA ARG A 721 -27.208 -9.139 20.288 1.00 69.73 C ATOM 43 C ARG A 721 -26.660 -8.344 19.114 1.00 69.44 C ATOM 44 O ARG A 721 -27.300 -8.216 18.069 1.00 71.19 O ATOM 45 CB ARG A 721 -26.694 -10.588 20.229 1.00 68.96 C ATOM 46 CG ARG A 721 -27.097 -11.362 18.988 1.00 69.90 C ATOM 47 CD ARG A 721 -26.687 -12.822 19.123 1.00 69.06 C ATOM 48 NE ARG A 721 -26.607 -13.509 17.837 1.00 77.55 N ATOM 49 CZ ARG A 721 -27.576 -14.259 17.318 1.00 71.70 C ATOM 50 NH1 ARG A 721 -28.720 -14.429 17.971 1.00 76.65 N ATOM 51 NH2 ARG A 721 -27.398 -14.842 16.141 1.00 72.77 N ATOM 52 HE ARG A 721 -25.730 -13.405 17.288 1.00 0.00 H ATOM 53 HH12 ARG A 721 -29.472 -15.017 17.558 1.00 0.00 H ATOM 54 HH11 ARG A 721 -28.864 -13.974 18.895 1.00 0.00 H ATOM 55 HH22 ARG A 721 -28.153 -15.429 15.732 1.00 0.00 H ATOM 56 HH21 ARG A 721 -26.503 -14.713 15.627 1.00 0.00 H ATOM 57 H ARG A 721 -29.180 -9.263 19.415 1.00 0.00 H ATOM 58 N ILE A 722 -25.463 -7.802 19.310 1.00 68.23 N ATOM 59 CA ILE A 722 -24.772 -7.029 18.288 1.00 63.88 C ATOM 60 C ILE A 722 -24.001 -7.998 17.402 1.00 67.23 C ATOM 61 O ILE A 722 -23.092 -8.691 17.872 1.00 69.02 O ATOM 62 CB ILE A 722 -23.831 -5.991 18.917 1.00 66.29 C ATOM 63 CG1 ILE A 722 -24.625 -4.806 19.476 1.00 70.82 C ATOM 64 CG2 ILE A 722 -22.805 -5.507 17.897 1.00 60.08 C ATOM 65 CD1 ILE A 722 -25.297 -5.083 20.804 1.00 60.36 C ATOM 66 H ILE A 722 -25.000 -7.935 20.232 1.00 0.00 H ATOM 67 N GLU A 723 -24.368 -8.050 16.119 1.00 68.54 N ATOM 68 CA GLU A 723 -23.654 -8.891 15.167 1.00 68.64 C ATOM 69 C GLU A 723 -22.372 -8.220 14.686 1.00 65.01 C ATOM 70 O GLU A 723 -21.334 -8.876 14.553 1.00 62.33 O ATOM 71 CB GLU A 723 -24.558 -9.217 13.978 1.00 64.85 C ATOM 72 CG GLU A 723 -25.794 -10.035 14.328 1.00 65.08 C ATOM 73 CD GLU A 723 -25.457 -11.421 14.849 1.00 70.36 C ATOM 74 OE1 GLU A 723 -26.298 -12.011 15.559 1.00 68.46 O ATOM 75 OE2 GLU A 723 -24.354 -11.921 14.551 1.00 70.79 O ATOM 76 H GLU A 723 -25.176 -7.481 15.794 1.00 0.00 H ATOM 77 N GLU A 724 -22.426 -6.917 14.420 1.00 66.70 N ATOM 78 CA GLU A 724 -21.259 -6.169 13.972 1.00 63.20 C ATOM 79 C GLU A 724 -21.492 -4.696 14.269 1.00 60.71 C ATOM 80 O GLU A 724 -22.616 -4.268 14.546 1.00 59.50 O ATOM 81 CB GLU A 724 -20.982 -6.397 12.483 1.00 60.66 C ATOM 82 CG GLU A 724 -22.224 -6.600 11.632 1.00 65.33 C ATOM 83 CD GLU A 724 -21.892 -6.941 10.191 1.00 65.02 C ATOM 84 OE1 GLU A 724 -22.231 -6.140 9.295 1.00 62.12 O ATOM 85 OE2 GLU A 724 -21.285 -8.008 9.955 1.00 73.29 O ATOM 86 H GLU A 724 -23.330 -6.417 14.536 1.00 0.00 H ATOM 87 N GLU A 725 -20.411 -3.926 14.222 1.00 58.77 N ATOM 88 CA GLU A 725 -20.477 -2.512 14.566 1.00 58.65 C ATOM 89 C GLU A 725 -19.190 -1.842 14.107 1.00 59.11 C ATOM 90 O GLU A 725 -18.201 -2.506 13.782 1.00 54.33 O ATOM 91 CB GLU A 725 -20.685 -2.315 16.070 1.00 59.86 C ATOM 92 CG GLU A 725 -19.440 -2.591 16.896 1.00 60.04 C ATOM 93 CD GLU A 725 -19.734 -2.787 18.371 1.00 59.52 C ATOM 94 OE1 GLU A 725 -19.495 -3.902 18.881 1.00 56.66 O ATOM 95 OE2 GLU A 725 -20.203 -1.832 19.023 1.00 60.55 O ATOM 96 H GLU A 725 -19.501 -4.340 13.935 1.00 0.00 H ATOM 97 N GLU A 726 -19.226 -0.512 14.075 1.00 58.61 N ATOM 98 CA GLU A 726 -18.060 0.316 13.784 1.00 56.33 C ATOM 99 C GLU A 726 -17.852 1.252 14.964 1.00 53.62 C ATOM 100 O GLU A 726 -18.702 2.107 15.235 1.00 51.28 O ATOM 101 CB GLU A 726 -18.255 1.109 12.494 1.00 56.36 C ATOM 102 CG GLU A 726 -16.999 1.790 11.987 1.00 60.05 C ATOM 103 CD GLU A 726 -17.276 2.707 10.815 1.00 63.42 C ATOM 104 OE1 GLU A 726 -17.942 3.744 11.013 1.00 62.90 O ATOM 105 OE2 GLU A 726 -16.841 2.385 9.692 1.00 70.10 O ATOM 106 H GLU A 726 -20.132 -0.038 14.267 1.00 0.00 H ATOM 107 N LEU A 727 -16.732 1.088 15.662 1.00 50.79 N ATOM 108 CA LEU A 727 -16.453 1.835 16.882 1.00 51.74 C ATOM 109 C LEU A 727 -15.344 2.848 16.639 1.00 46.57 C ATOM 110 O LEU A 727 -14.295 2.504 16.086 1.00 45.55 O ATOM 111 CB LEU A 727 -16.043 0.900 18.023 1.00 44.85 C ATOM 112 CG LEU A 727 -17.100 -0.046 18.584 1.00 50.73 C ATOM 113 CD1 LEU A 727 -16.601 -0.684 19.870 1.00 55.07 C ATOM 114 CD2 LEU A 727 -18.402 0.683 18.825 1.00 53.72 C ATOM 115 H LEU A 727 -16.028 0.401 15.324 1.00 0.00 H ATOM 116 N THR A 728 -15.579 4.086 17.057 1.00 45.43 N ATOM 117 CA THR A 728 -14.539 5.101 17.157 1.00 48.30 C ATOM 118 C THR A 728 -14.044 5.113 18.601 1.00 45.00 C ATOM 119 O THR A 728 -14.821 5.396 19.523 1.00 45.09 O ATOM 120 CB THR A 728 -15.069 6.472 16.735 1.00 54.93 C ATOM 121 OG1 THR A 728 -15.598 6.387 15.403 1.00 54.05 O ATOM 122 CG2 THR A 728 -13.958 7.514 16.755 1.00 53.13 C ATOM 123 HG1 THR A 728 -15.942 7.274 15.128 1.00 0.00 H ATOM 124 H THR A 728 -16.550 4.343 17.325 1.00 0.00 H ATOM 125 N LEU A 729 -12.769 4.769 18.794 1.00 41.79 N ATOM 126 CA LEU A 729 -12.179 4.612 20.114 1.00 46.21 C ATOM 127 C LEU A 729 -10.988 5.547 20.276 1.00 45.80 C ATOM 128 O LEU A 729 -10.252 5.815 19.323 1.00 47.28 O ATOM 129 CB LEU A 729 -11.719 3.169 20.346 1.00 48.09 C ATOM 130 CG LEU A 729 -12.732 2.065 20.042 1.00 44.40 C ATOM 131 CD1 LEU A 729 -12.138 0.691 20.329 1.00 46.40 C ATOM 132 CD2 LEU A 729 -13.998 2.280 20.849 1.00 44.49 C ATOM 133 H LEU A 729 -12.169 4.605 17.961 1.00 0.00 H ATOM 134 N THR A 730 -10.796 6.034 21.500 1.00 48.21 N ATOM 135 CA THR A 730 -9.680 6.910 21.839 1.00 50.50 C ATOM 136 C THR A 730 -8.783 6.182 22.830 1.00 46.57 C ATOM 137 O THR A 730 -9.254 5.723 23.875 1.00 45.52 O ATOM 138 CB THR A 730 -10.175 8.233 22.428 1.00 47.99 C ATOM 139 OG1 THR A 730 -11.029 8.889 21.483 1.00 49.60 O ATOM 140 CG2 THR A 730 -9.012 9.149 22.754 1.00 50.03 C ATOM 141 HG1 THR A 730 -11.348 9.744 21.866 1.00 0.00 H ATOM 142 H THR A 730 -11.472 5.778 22.248 1.00 0.00 H ATOM 143 N ILE A 731 -7.501 6.063 22.495 1.00 47.19 N ATOM 144 CA ILE A 731 -6.515 5.415 23.353 1.00 52.64 C ATOM 145 C ILE A 731 -5.514 6.469 23.806 1.00 51.14 C ATOM 146 O ILE A 731 -4.931 7.179 22.978 1.00 54.71 O ATOM 147 CB ILE A 731 -5.803 4.259 22.631 1.00 50.67 C ATOM 148 CG1 ILE A 731 -6.823 3.259 22.081 1.00 51.59 C ATOM 149 CG2 ILE A 731 -4.851 3.554 23.584 1.00 58.12 C ATOM 150 CD1 ILE A 731 -6.209 2.112 21.292 1.00 57.45 C ATOM 151 H ILE A 731 -7.188 6.449 21.581 1.00 0.00 H ATOM 152 N LEU A 732 -5.312 6.565 25.117 1.00 52.87 N ATOM 153 CA LEU A 732 -4.390 7.525 25.711 1.00 58.87 C ATOM 154 C LEU A 732 -3.213 6.780 26.323 1.00 56.93 C ATOM 155 O LEU A 732 -3.407 5.837 27.099 1.00 55.27 O ATOM 156 CB LEU A 732 -5.091 8.372 26.779 1.00 50.01 C ATOM 157 H LEU A 732 -5.836 5.925 25.748 1.00 0.00 H ATOM 158 N ARG A 733 -1.999 7.200 25.976 1.00 61.09 N ATOM 159 CA ARG A 733 -0.798 6.598 26.545 1.00 62.70 C ATOM 160 C ARG A 733 0.218 7.666 26.933 1.00 63.40 C ATOM 161 O ARG A 733 0.097 8.300 27.982 1.00 61.33 O ATOM 162 CB ARG A 733 -0.174 5.612 25.560 1.00 63.05 C ATOM 163 CG ARG A 733 0.424 6.251 24.314 1.00 62.81 C ATOM 164 CD ARG A 733 1.920 6.481 24.460 1.00 66.89 C ATOM 165 NE ARG A 733 2.567 6.707 23.170 1.00 68.94 N ATOM 166 CZ ARG A 733 3.005 5.737 22.371 1.00 72.21 C ATOM 167 NH1 ARG A 733 2.865 4.466 22.722 1.00 71.91 N ATOM 168 NH2 ARG A 733 3.586 6.038 21.218 1.00 71.92 N ATOM 169 HE ARG A 733 2.694 7.690 22.855 1.00 0.00 H ATOM 170 HH12 ARG A 733 3.209 3.712 22.094 1.00 0.00 H ATOM 171 HH11 ARG A 733 2.411 4.223 23.626 1.00 0.00 H ATOM 172 HH22 ARG A 733 3.928 5.279 20.594 1.00 0.00 H ATOM 173 HH21 ARG A 733 3.700 7.033 20.937 1.00 0.00 H ATOM 174 H ARG A 733 -1.904 7.972 25.286 1.00 0.00 H TER 175 ARG A 733 ATOM 176 N GLY A 736 4.511 3.479 28.298 1.00 62.22 N ATOM 177 CA GLY A 736 5.039 4.113 27.105 1.00 65.56 C ATOM 178 C GLY A 736 4.420 3.598 25.820 1.00 68.29 C ATOM 179 O GLY A 736 4.488 4.259 24.783 1.00 65.52 O ATOM 180 HN3 GLY A 736 4.691 2.456 28.254 1.00 0.00 H ATOM 181 HN2 GLY A 736 3.487 3.650 28.355 1.00 0.00 H ATOM 182 HN1 GLY A 736 4.978 3.879 29.137 1.00 0.00 H ATOM 183 N GLY A 737 3.814 2.411 25.891 1.00 69.59 N ATOM 184 CA GLY A 737 3.221 1.779 24.734 1.00 63.57 C ATOM 185 C GLY A 737 1.701 1.879 24.731 1.00 65.31 C ATOM 186 O GLY A 737 1.075 2.332 25.684 1.00 62.42 O ATOM 187 H GLY A 737 3.767 1.925 26.809 1.00 0.00 H ATOM 188 N LEU A 738 1.113 1.442 23.616 1.00 60.97 N ATOM 189 CA LEU A 738 -0.337 1.463 23.463 1.00 58.77 C ATOM 190 C LEU A 738 -1.008 0.224 24.044 1.00 58.26 C ATOM 191 O LEU A 738 -2.152 0.309 24.504 1.00 53.08 O ATOM 192 CB LEU A 738 -0.707 1.604 21.982 1.00 61.19 C ATOM 193 CG LEU A 738 -0.393 2.963 21.349 1.00 66.51 C ATOM 194 CD1 LEU A 738 -0.520 2.904 19.832 1.00 73.35 C ATOM 195 CD2 LEU A 738 -1.300 4.052 21.912 1.00 61.89 C ATOM 196 H LEU A 738 1.701 1.079 22.839 1.00 0.00 H ATOM 197 N GLY A 739 -0.326 -0.918 24.042 1.00 58.96 N ATOM 198 CA GLY A 739 -0.904 -2.135 24.570 1.00 61.06 C ATOM 199 C GLY A 739 -1.600 -3.001 23.547 1.00 58.59 C ATOM 200 O GLY A 739 -2.512 -3.757 23.907 1.00 56.77 O ATOM 201 H GLY A 739 0.639 -0.937 23.654 1.00 0.00 H ATOM 202 N ILE A 740 -1.208 -2.912 22.276 1.00 58.90 N ATOM 203 CA ILE A 740 -1.811 -3.709 21.219 1.00 57.22 C ATOM 204 C ILE A 740 -0.712 -4.361 20.392 1.00 55.39 C ATOM 205 O ILE A 740 0.420 -3.878 20.321 1.00 57.45 O ATOM 206 CB ILE A 740 -2.727 -2.874 20.292 1.00 57.24 C ATOM 207 CG1 ILE A 740 -1.966 -1.661 19.750 1.00 57.76 C ATOM 208 CG2 ILE A 740 -3.991 -2.453 21.018 1.00 58.89 C ATOM 209 CD1 ILE A 740 -2.746 -0.854 18.736 1.00 53.10 C ATOM 210 H ILE A 740 -0.444 -2.250 22.032 1.00 0.00 H ATOM 211 N SER A 741 -1.069 -5.474 19.759 1.00 57.71 N ATOM 212 CA SER A 741 -0.254 -6.097 18.724 1.00 57.81 C ATOM 213 C SER A 741 -1.128 -6.258 17.491 1.00 56.55 C ATOM 214 O SER A 741 -2.130 -6.981 17.528 1.00 55.06 O ATOM 215 CB SER A 741 0.303 -7.452 19.180 1.00 55.93 C ATOM 216 OG SER A 741 1.234 -7.295 20.239 1.00 65.95 O ATOM 217 HG SER A 741 1.575 -8.184 20.511 1.00 0.00 H ATOM 218 H SER A 741 -1.973 -5.921 20.014 1.00 0.00 H ATOM 219 N ILE A 742 -0.772 -5.571 16.424 1.00 60.29 N ATOM 220 CA ILE A 742 -1.516 -5.643 15.173 1.00 54.25 C ATOM 221 C ILE A 742 -0.922 -6.744 14.308 1.00 55.69 C ATOM 222 O ILE A 742 0.281 -7.016 14.345 1.00 60.53 O ATOM 223 CB ILE A 742 -1.494 -4.286 14.445 1.00 56.17 C ATOM 224 CG1 ILE A 742 -0.065 -3.925 14.038 1.00 57.65 C ATOM 225 CG2 ILE A 742 -2.074 -3.207 15.334 1.00 52.93 C ATOM 226 CD1 ILE A 742 0.030 -2.664 13.213 1.00 56.19 C ATOM 227 H ILE A 742 0.067 -4.958 16.477 1.00 0.00 H ATOM 228 N ALA A 743 -1.773 -7.375 13.507 1.00 57.31 N ATOM 229 CA ALA A 743 -1.350 -8.452 12.627 1.00 55.55 C ATOM 230 C ALA A 743 -2.052 -8.311 11.286 1.00 56.75 C ATOM 231 O ALA A 743 -3.152 -7.757 11.197 1.00 48.97 O ATOM 232 CB ALA A 743 -1.652 -9.828 13.238 1.00 55.39 C ATOM 233 H ALA A 743 -2.773 -7.090 13.509 1.00 0.00 H ATOM 234 N GLY A 744 -1.401 -8.815 10.241 1.00 57.19 N ATOM 235 CA GLY A 744 -1.983 -8.806 8.917 1.00 55.34 C ATOM 236 C GLY A 744 -1.542 -7.632 8.071 1.00 53.44 C ATOM 237 O GLY A 744 -0.459 -7.077 8.278 1.00 58.38 O ATOM 238 H GLY A 744 -0.455 -9.224 10.379 1.00 0.00 H ATOM 239 N GLY A 745 -2.380 -7.245 7.123 1.00 53.34 N ATOM 240 CA GLY A 745 -2.051 -6.226 6.151 1.00 54.40 C ATOM 241 C GLY A 745 -1.952 -6.803 4.747 1.00 57.93 C ATOM 242 O GLY A 745 -1.830 -8.014 4.540 1.00 53.57 O ATOM 243 H GLY A 745 -3.317 -7.694 7.075 1.00 0.00 H ATOM 244 N LYS A 746 -2.021 -5.906 3.764 1.00 63.16 N ATOM 245 CA LYS A 746 -1.849 -6.305 2.370 1.00 62.32 C ATOM 246 C LYS A 746 -0.391 -6.681 2.122 1.00 61.39 C ATOM 247 O LYS A 746 0.517 -5.865 2.325 1.00 60.88 O ATOM 248 CB LYS A 746 -2.281 -5.178 1.438 1.00 61.45 C ATOM 249 CG LYS A 746 -3.724 -5.283 0.965 1.00 60.95 C ATOM 250 CD LYS A 746 -3.899 -6.432 -0.014 1.00 59.18 C ATOM 251 CE LYS A 746 -5.317 -6.500 -0.544 1.00 70.71 C ATOM 252 NZ LYS A 746 -5.683 -5.267 -1.290 1.00 70.54 N ATOM 253 HZ1 LYS A 746 -5.608 -4.445 -0.657 1.00 0.00 H ATOM 254 HZ2 LYS A 746 -5.037 -5.146 -2.096 1.00 0.00 H ATOM 255 HZ3 LYS A 746 -6.660 -5.350 -1.637 1.00 0.00 H ATOM 256 H LYS A 746 -2.200 -4.907 3.993 1.00 0.00 H ATOM 257 N GLY A 747 -0.166 -7.915 1.686 1.00 61.76 N ATOM 258 CA GLY A 747 1.171 -8.419 1.476 1.00 61.62 C ATOM 259 C GLY A 747 1.723 -9.234 2.620 1.00 63.47 C ATOM 260 O GLY A 747 2.895 -9.633 2.566 1.00 82.70 O ATOM 261 H GLY A 747 -0.976 -8.537 1.490 1.00 0.00 H ATOM 262 N SER A 748 0.925 -9.486 3.651 1.00 61.43 N ATOM 263 CA SER A 748 1.331 -10.280 4.799 1.00 63.39 C ATOM 264 C SER A 748 0.391 -11.469 4.946 1.00 67.73 C ATOM 265 O SER A 748 -0.754 -11.444 4.487 1.00 65.34 O ATOM 266 CB SER A 748 1.318 -9.452 6.091 1.00 61.97 C ATOM 267 OG SER A 748 2.162 -8.321 5.981 1.00 64.77 O ATOM 268 HG SER A 748 2.134 -7.807 6.826 1.00 0.00 H ATOM 269 H SER A 748 -0.039 -9.096 3.636 1.00 0.00 H ATOM 270 N THR A 749 0.885 -12.511 5.593 1.00 68.52 N ATOM 271 CA THR A 749 0.073 -13.697 5.833 1.00 69.67 C ATOM 272 C THR A 749 -1.178 -13.305 6.612 1.00 71.45 C ATOM 273 O THR A 749 -1.061 -12.733 7.708 1.00 70.14 O ATOM 274 CB THR A 749 0.888 -14.740 6.592 1.00 70.06 C ATOM 275 OG1 THR A 749 1.671 -14.097 7.605 1.00 73.12 O ATOM 276 CG2 THR A 749 1.812 -15.484 5.639 1.00 76.31 C ATOM 277 HG1 THR A 749 1.070 -13.626 8.236 1.00 0.00 H ATOM 278 H THR A 749 1.867 -12.484 5.935 1.00 0.00 H ATOM 279 N PRO A 750 -2.378 -13.580 6.098 1.00 72.71 N ATOM 280 CA PRO A 750 -3.588 -13.031 6.723 1.00 72.50 C ATOM 281 C PRO A 750 -3.782 -13.515 8.151 1.00 70.88 C ATOM 282 O PRO A 750 -3.210 -14.515 8.589 1.00 68.37 O ATOM 283 CB PRO A 750 -4.723 -13.526 5.813 1.00 73.04 C ATOM 284 CG PRO A 750 -4.065 -13.860 4.516 1.00 72.00 C ATOM 285 CD PRO A 750 -2.692 -14.352 4.880 1.00 74.91 C ATOM 286 N TYR A 751 -4.610 -12.777 8.884 1.00 70.83 N ATOM 287 CA TYR A 751 -4.946 -13.106 10.261 1.00 70.36 C ATOM 288 C TYR A 751 -6.228 -13.911 10.377 1.00 71.03 C ATOM 289 O TYR A 751 -6.298 -14.846 11.179 1.00 67.99 O ATOM 290 CB TYR A 751 -5.075 -11.823 11.095 1.00 64.19 C ATOM 291 CG TYR A 751 -5.600 -12.056 12.493 1.00 63.73 C ATOM 292 CD1 TYR A 751 -4.755 -12.476 13.513 1.00 61.62 C ATOM 293 CD2 TYR A 751 -6.942 -11.858 12.793 1.00 64.07 C ATOM 294 CE1 TYR A 751 -5.233 -12.693 14.793 1.00 58.00 C ATOM 295 CE2 TYR A 751 -7.429 -12.073 14.072 1.00 63.52 C ATOM 296 CZ TYR A 751 -6.569 -12.490 15.065 1.00 59.82 C ATOM 297 OH TYR A 751 -7.044 -12.707 16.336 1.00 57.66 O ATOM 298 HH TYR A 751 -6.300 -13.000 16.920 1.00 0.00 H ATOM 299 H TYR A 751 -5.035 -11.930 8.456 1.00 0.00 H ATOM 300 N LYS A 752 -7.240 -13.576 9.581 1.00 71.41 N ATOM 301 CA LYS A 752 -8.536 -14.240 9.642 1.00 74.03 C ATOM 302 C LYS A 752 -9.007 -14.516 8.222 1.00 74.36 C ATOM 303 O LYS A 752 -9.149 -13.584 7.423 1.00 72.26 O ATOM 304 CB LYS A 752 -9.559 -13.379 10.391 1.00 68.72 C ATOM 305 CG LYS A 752 -10.637 -14.178 11.108 1.00 90.66 C ATOM 306 CD LYS A 752 -11.811 -13.304 11.539 1.00 85.79 C ATOM 307 CE LYS A 752 -12.682 -12.909 10.353 1.00 85.00 C ATOM 308 NZ LYS A 752 -13.926 -12.210 10.788 1.00106.35 N ATOM 309 HZ1 LYS A 752 -14.478 -12.840 11.404 1.00 0.00 H ATOM 310 HZ2 LYS A 752 -13.673 -11.347 11.310 1.00 0.00 H ATOM 311 HZ3 LYS A 752 -14.491 -11.958 9.952 1.00 0.00 H ATOM 312 H LYS A 752 -7.101 -12.812 8.889 1.00 0.00 H ATOM 313 N GLY A 753 -9.241 -15.789 7.911 1.00 81.30 N ATOM 314 CA GLY A 753 -9.766 -16.146 6.603 1.00 91.71 C ATOM 315 C GLY A 753 -8.852 -15.672 5.493 1.00 76.71 C ATOM 316 O GLY A 753 -7.635 -15.890 5.521 1.00 78.99 O ATOM 317 H GLY A 753 -9.047 -16.535 8.610 1.00 0.00 H ATOM 318 N ASP A 754 -9.443 -15.025 4.490 1.00 76.87 N ATOM 319 CA ASP A 754 -8.690 -14.402 3.412 1.00 74.10 C ATOM 320 C ASP A 754 -8.650 -12.884 3.534 1.00 71.33 C ATOM 321 O ASP A 754 -8.030 -12.224 2.693 1.00 74.20 O ATOM 322 CB ASP A 754 -9.281 -14.797 2.053 1.00 78.34 C ATOM 323 CG ASP A 754 -8.300 -14.598 0.906 1.00 84.88 C ATOM 324 OD1 ASP A 754 -7.108 -14.336 1.177 1.00 97.95 O ATOM 325 OD2 ASP A 754 -8.720 -14.703 -0.266 1.00 87.78 O ATOM 326 H ASP A 754 -10.481 -14.963 4.477 1.00 0.00 H ATOM 327 N ASP A 755 -9.288 -12.316 4.557 1.00 69.15 N ATOM 328 CA ASP A 755 -9.256 -10.873 4.768 1.00 64.43 C ATOM 329 C ASP A 755 -7.843 -10.436 5.140 1.00 62.39 C ATOM 330 O ASP A 755 -7.323 -10.822 6.193 1.00 62.46 O ATOM 331 CB ASP A 755 -10.243 -10.475 5.863 1.00 65.00 C ATOM 332 CG ASP A 755 -10.378 -8.967 6.009 1.00 57.19 C ATOM 333 OD1 ASP A 755 -9.681 -8.230 5.278 1.00 58.56 O ATOM 334 OD2 ASP A 755 -11.184 -8.519 6.852 1.00 49.82 O ATOM 335 H ASP A 755 -9.821 -12.915 5.220 1.00 0.00 H ATOM 336 N GLU A 756 -7.227 -9.627 4.282 1.00 62.30 N ATOM 337 CA GLU A 756 -5.877 -9.137 4.502 1.00 62.62 C ATOM 338 C GLU A 756 -5.845 -7.793 5.236 1.00 56.57 C ATOM 339 O GLU A 756 -4.859 -7.059 5.119 1.00 54.44 O ATOM 340 CB GLU A 756 -5.140 -9.025 3.164 1.00 60.95 C ATOM 341 CG GLU A 756 -5.084 -10.333 2.391 1.00 63.19 C ATOM 342 CD GLU A 756 -4.149 -10.271 1.200 1.00 64.56 C ATOM 343 OE1 GLU A 756 -3.070 -9.652 1.322 1.00 62.11 O ATOM 344 OE2 GLU A 756 -4.494 -10.840 0.141 1.00 71.80 O ATOM 345 H GLU A 756 -7.731 -9.334 3.421 1.00 0.00 H ATOM 346 N GLY A 757 -6.886 -7.467 5.987 1.00 53.51 N ATOM 347 CA GLY A 757 -6.885 -6.242 6.761 1.00 57.07 C ATOM 348 C GLY A 757 -5.965 -6.323 7.967 1.00 49.42 C ATOM 349 O GLY A 757 -5.390 -7.360 8.297 1.00 45.90 O ATOM 350 H GLY A 757 -7.713 -8.097 6.022 1.00 0.00 H ATOM 351 N ILE A 758 -5.821 -5.186 8.641 1.00 44.86 N ATOM 352 CA ILE A 758 -5.031 -5.101 9.865 1.00 49.04 C ATOM 353 C ILE A 758 -5.960 -5.359 11.046 1.00 49.03 C ATOM 354 O ILE A 758 -6.985 -4.685 11.200 1.00 44.22 O ATOM 355 CB ILE A 758 -4.337 -3.737 9.989 1.00 45.33 C ATOM 356 CG1 ILE A 758 -3.298 -3.576 8.876 1.00 46.38 C ATOM 357 CG2 ILE A 758 -3.675 -3.595 11.357 1.00 50.93 C ATOM 358 CD1 ILE A 758 -3.399 -2.268 8.131 1.00 55.01 C ATOM 359 H ILE A 758 -6.287 -4.328 8.284 1.00 0.00 H ATOM 360 N PHE A 759 -5.606 -6.339 11.873 1.00 47.72 N ATOM 361 CA PHE A 759 -6.440 -6.757 12.987 1.00 46.83 C ATOM 362 C PHE A 759 -5.690 -6.603 14.302 1.00 50.75 C ATOM 363 O PHE A 759 -4.459 -6.543 14.339 1.00 49.31 O ATOM 364 CB PHE A 759 -6.894 -8.215 12.829 1.00 49.41 C ATOM 365 CG PHE A 759 -7.840 -8.436 11.689 1.00 53.93 C ATOM 366 CD1 PHE A 759 -7.368 -8.586 10.395 1.00 53.17 C ATOM 367 CD2 PHE A 759 -9.204 -8.494 11.911 1.00 52.85 C ATOM 368 CE1 PHE A 759 -8.239 -8.789 9.346 1.00 53.76 C ATOM 369 CE2 PHE A 759 -10.080 -8.697 10.867 1.00 51.62 C ATOM 370 CZ PHE A 759 -9.598 -8.847 9.582 1.00 54.85 C ATOM 371 H PHE A 759 -4.699 -6.824 11.716 1.00 0.00 H ATOM 372 N ILE A 760 -6.457 -6.533 15.383 1.00 53.14 N ATOM 373 CA ILE A 760 -5.907 -6.550 16.733 1.00 52.92 C ATOM 374 C ILE A 760 -5.728 -8.005 17.141 1.00 50.68 C ATOM 375 O ILE A 760 -6.709 -8.756 17.241 1.00 49.55 O ATOM 376 CB ILE A 760 -6.825 -5.801 17.714 1.00 53.60 C ATOM 377 CG1 ILE A 760 -6.920 -4.321 17.326 1.00 51.73 C ATOM 378 CG2 ILE A 760 -6.321 -5.945 19.137 1.00 54.00 C ATOM 379 CD1 ILE A 760 -5.598 -3.588 17.332 1.00 56.07 C ATOM 380 H ILE A 760 -7.488 -6.464 15.263 1.00 0.00 H ATOM 381 N SER A 761 -4.475 -8.417 17.341 1.00 52.16 N ATOM 382 CA SER A 761 -4.171 -9.799 17.692 1.00 57.20 C ATOM 383 C SER A 761 -3.875 -9.997 19.173 1.00 54.82 C ATOM 384 O SER A 761 -3.958 -11.131 19.656 1.00 54.11 O ATOM 385 CB SER A 761 -2.978 -10.303 16.871 1.00 54.92 C ATOM 386 OG SER A 761 -1.897 -9.386 16.906 1.00 54.48 O ATOM 387 HG SER A 761 -2.190 -8.517 16.532 1.00 0.00 H ATOM 388 H SER A 761 -3.696 -7.735 17.244 1.00 0.00 H ATOM 389 N ARG A 762 -3.547 -8.934 19.901 1.00 58.07 N ATOM 390 CA ARG A 762 -3.268 -9.034 21.326 1.00 60.24 C ATOM 391 C ARG A 762 -3.560 -7.692 21.977 1.00 56.61 C ATOM 392 O ARG A 762 -3.244 -6.639 21.416 1.00 55.91 O ATOM 393 CB ARG A 762 -1.813 -9.451 21.579 1.00 62.26 C ATOM 394 CG ARG A 762 -1.404 -9.491 23.045 1.00 65.58 C ATOM 395 CD ARG A 762 -2.265 -10.454 23.851 1.00 69.14 C ATOM 396 NE ARG A 762 -1.761 -10.634 25.211 1.00 80.02 N ATOM 397 CZ ARG A 762 -2.361 -11.372 26.140 1.00 93.44 C ATOM 398 NH1 ARG A 762 -1.827 -11.480 27.351 1.00 83.20 N ATOM 399 NH2 ARG A 762 -3.495 -12.000 25.862 1.00 99.13 N ATOM 400 HE ARG A 762 -0.875 -10.154 25.469 1.00 0.00 H ATOM 401 HH12 ARG A 762 -2.297 -12.058 28.077 1.00 0.00 H ATOM 402 HH11 ARG A 762 -0.939 -10.987 27.573 1.00 0.00 H ATOM 403 HH22 ARG A 762 -3.962 -12.577 26.591 1.00 0.00 H ATOM 404 HH21 ARG A 762 -3.917 -11.916 24.915 1.00 0.00 H ATOM 405 H ARG A 762 -3.488 -8.004 19.439 1.00 0.00 H ATOM 406 N VAL A 763 -4.169 -7.739 23.158 1.00 62.65 N ATOM 407 CA VAL A 763 -4.445 -6.550 23.959 1.00 64.06 C ATOM 408 C VAL A 763 -3.807 -6.752 25.326 1.00 61.68 C ATOM 409 O VAL A 763 -4.119 -7.726 26.024 1.00 62.16 O ATOM 410 CB VAL A 763 -5.954 -6.286 24.096 1.00 60.94 C ATOM 411 CG1 VAL A 763 -6.201 -5.121 25.037 1.00 60.72 C ATOM 412 CG2 VAL A 763 -6.581 -6.020 22.730 1.00 55.22 C ATOM 413 H VAL A 763 -4.462 -8.666 23.528 1.00 0.00 H ATOM 414 N SER A 764 -2.919 -5.837 25.710 1.00 64.23 N ATOM 415 CA SER A 764 -2.282 -5.925 27.017 1.00 62.30 C ATOM 416 C SER A 764 -3.329 -5.923 28.119 1.00 60.08 C ATOM 417 O SER A 764 -4.342 -5.222 28.036 1.00 59.32 O ATOM 418 CB SER A 764 -1.309 -4.764 27.224 1.00 61.40 C ATOM 419 OG SER A 764 -0.021 -5.084 26.730 1.00 52.02 O ATOM 420 HG SER A 764 0.587 -4.317 26.876 1.00 0.00 H ATOM 421 H SER A 764 -2.678 -5.053 25.071 1.00 0.00 H ATOM 422 N GLU A 765 -3.073 -6.709 29.161 1.00 64.39 N ATOM 423 CA GLU A 765 -4.005 -6.817 30.274 1.00 63.85 C ATOM 424 C GLU A 765 -4.139 -5.470 30.969 1.00 60.21 C ATOM 425 O GLU A 765 -3.156 -4.919 31.471 1.00 55.20 O ATOM 426 CB GLU A 765 -3.527 -7.886 31.255 1.00 63.79 C ATOM 427 CG GLU A 765 -3.215 -9.236 30.611 1.00 65.53 C ATOM 428 CD GLU A 765 -2.553 -10.208 31.577 1.00 76.07 C ATOM 429 OE1 GLU A 765 -2.634 -9.979 32.804 1.00 71.48 O ATOM 430 OE2 GLU A 765 -1.948 -11.196 31.109 1.00 75.34 O ATOM 431 H GLU A 765 -2.189 -7.257 29.181 1.00 0.00 H ATOM 432 N GLU A 766 -5.358 -4.934 30.978 1.00 58.18 N ATOM 433 CA GLU A 766 -5.663 -3.663 31.635 1.00 60.94 C ATOM 434 C GLU A 766 -4.760 -2.532 31.151 1.00 59.59 C ATOM 435 O GLU A 766 -4.554 -1.545 31.866 1.00 61.00 O ATOM 436 CB GLU A 766 -5.572 -3.799 33.160 1.00 57.58 C ATOM 437 CG GLU A 766 -6.652 -4.685 33.777 1.00 64.13 C ATOM 438 CD GLU A 766 -8.046 -4.092 33.661 1.00 62.00 C ATOM 439 OE1 GLU A 766 -8.163 -2.895 33.317 1.00 71.33 O ATOM 440 OE2 GLU A 766 -9.026 -4.826 33.913 1.00 62.63 O ATOM 441 H GLU A 766 -6.127 -5.442 30.496 1.00 0.00 H ATOM 442 N GLY A 767 -4.218 -2.649 29.934 1.00 59.14 N ATOM 443 CA GLY A 767 -3.465 -1.589 29.350 1.00 56.30 C ATOM 444 C GLY A 767 -4.359 -0.460 28.852 1.00 55.65 C ATOM 445 O GLY A 767 -5.595 -0.548 28.913 1.00 54.43 O ATOM 446 H GLY A 767 -4.349 -3.533 29.402 1.00 0.00 H ATOM 447 N PRO A 768 -3.736 0.606 28.355 1.00 54.53 N ATOM 448 CA PRO A 768 -4.533 1.743 27.866 1.00 54.79 C ATOM 449 C PRO A 768 -5.516 1.371 26.767 1.00 55.88 C ATOM 450 O PRO A 768 -6.590 1.980 26.684 1.00 55.55 O ATOM 451 CB PRO A 768 -3.469 2.737 27.372 1.00 52.19 C ATOM 452 CG PRO A 768 -2.217 1.939 27.204 1.00 55.35 C ATOM 453 CD PRO A 768 -2.287 0.831 28.218 1.00 55.67 C ATOM 454 N ALA A 769 -5.195 0.387 25.924 1.00 54.25 N ATOM 455 CA ALA A 769 -6.127 -0.009 24.872 1.00 49.72 C ATOM 456 C ALA A 769 -7.275 -0.840 25.430 1.00 50.21 C ATOM 457 O ALA A 769 -8.409 -0.734 24.951 1.00 50.62 O ATOM 458 CB ALA A 769 -5.397 -0.790 23.779 1.00 54.25 C ATOM 459 H ALA A 769 -4.280 -0.098 26.017 1.00 0.00 H ATOM 460 N ALA A 770 -6.999 -1.680 26.433 1.00 57.72 N ATOM 461 CA ALA A 770 -8.064 -2.448 27.070 1.00 54.56 C ATOM 462 C ALA A 770 -9.032 -1.541 27.816 1.00 52.80 C ATOM 463 O ALA A 770 -10.231 -1.837 27.881 1.00 47.92 O ATOM 464 CB ALA A 770 -7.471 -3.484 28.024 1.00 56.33 C ATOM 465 H ALA A 770 -6.018 -1.787 26.762 1.00 0.00 H ATOM 466 N ARG A 771 -8.535 -0.444 28.396 1.00 53.22 N ATOM 467 CA ARG A 771 -9.428 0.531 29.012 1.00 54.31 C ATOM 468 C ARG A 771 -10.256 1.266 27.961 1.00 53.55 C ATOM 469 O ARG A 771 -11.392 1.669 28.239 1.00 55.12 O ATOM 470 CB ARG A 771 -8.621 1.519 29.856 1.00 53.88 C ATOM 471 CG ARG A 771 -8.416 1.091 31.316 1.00 59.05 C ATOM 472 CD ARG A 771 -6.938 0.919 31.671 1.00 63.30 C ATOM 473 NE ARG A 771 -6.155 2.129 31.425 1.00 58.76 N ATOM 474 CZ ARG A 771 -4.828 2.192 31.493 1.00 63.18 C ATOM 475 NH1 ARG A 771 -4.202 3.336 31.249 1.00 64.63 N ATOM 476 NH2 ARG A 771 -4.123 1.112 31.800 1.00 60.43 N ATOM 477 HE ARG A 771 -6.670 2.999 31.180 1.00 0.00 H ATOM 478 HH12 ARG A 771 -3.164 3.383 31.303 1.00 0.00 H ATOM 479 HH11 ARG A 771 -4.749 4.186 31.004 1.00 0.00 H ATOM 480 HH22 ARG A 771 -3.086 1.166 31.852 1.00 0.00 H ATOM 481 HH21 ARG A 771 -4.607 0.211 31.989 1.00 0.00 H ATOM 482 H ARG A 771 -7.507 -0.285 28.408 1.00 0.00 H ATOM 483 N ALA A 772 -9.718 1.434 26.750 1.00 51.70 N ATOM 484 CA ALA A 772 -10.458 2.106 25.690 1.00 53.49 C ATOM 485 C ALA A 772 -11.594 1.251 25.144 1.00 52.79 C ATOM 486 O ALA A 772 -12.493 1.783 24.485 1.00 52.38 O ATOM 487 CB ALA A 772 -9.513 2.487 24.545 1.00 52.50 C ATOM 488 H ALA A 772 -8.758 1.080 26.561 1.00 0.00 H ATOM 489 N GLY A 773 -11.576 -0.051 25.410 1.00 51.57 N ATOM 490 CA GLY A 773 -12.547 -0.962 24.850 1.00 51.22 C ATOM 491 C GLY A 773 -12.051 -1.778 23.681 1.00 50.17 C ATOM 492 O GLY A 773 -12.849 -2.497 23.070 1.00 50.80 O ATOM 493 H GLY A 773 -10.839 -0.426 26.041 1.00 0.00 H ATOM 494 N VAL A 774 -10.757 -1.687 23.348 1.00 47.06 N ATOM 495 CA VAL A 774 -10.222 -2.451 22.230 1.00 48.48 C ATOM 496 C VAL A 774 -10.346 -3.935 22.530 1.00 49.38 C ATOM 497 O VAL A 774 -9.987 -4.399 23.618 1.00 52.46 O ATOM 498 CB VAL A 774 -8.766 -2.045 21.961 1.00 50.99 C ATOM 499 CG1 VAL A 774 -8.174 -2.900 20.855 1.00 48.98 C ATOM 500 CG2 VAL A 774 -8.681 -0.557 21.608 1.00 42.50 C ATOM 501 H VAL A 774 -10.128 -1.064 23.894 1.00 0.00 H ATOM 502 N ARG A 775 -10.864 -4.689 21.562 1.00 51.84 N ATOM 503 CA ARG A 775 -11.082 -6.120 21.706 1.00 51.10 C ATOM 504 C ARG A 775 -10.218 -6.873 20.705 1.00 51.65 C ATOM 505 O ARG A 775 -9.912 -6.369 19.620 1.00 50.21 O ATOM 506 CB ARG A 775 -12.557 -6.485 21.492 1.00 50.48 C ATOM 507 H ARG A 775 -11.124 -4.235 20.663 1.00 0.00 H ATOM 508 N VAL A 776 -9.828 -8.091 21.083 1.00 59.93 N ATOM 509 CA VAL A 776 -8.971 -8.905 20.231 1.00 54.69 C ATOM 510 C VAL A 776 -9.768 -9.368 19.021 1.00 54.10 C ATOM 511 O VAL A 776 -10.865 -9.925 19.153 1.00 55.04 O ATOM 512 CB VAL A 776 -8.407 -10.098 21.018 1.00 56.01 C ATOM 513 CG1 VAL A 776 -7.285 -10.769 20.241 1.00 55.69 C ATOM 514 CG2 VAL A 776 -7.913 -9.651 22.387 1.00 61.62 C ATOM 515 H VAL A 776 -10.141 -8.466 22.001 1.00 0.00 H ATOM 516 N GLY A 777 -9.218 -9.138 17.833 1.00 52.71 N ATOM 517 CA GLY A 777 -9.908 -9.424 16.598 1.00 54.87 C ATOM 518 C GLY A 777 -10.496 -8.216 15.907 1.00 54.91 C ATOM 519 O GLY A 777 -11.061 -8.364 14.817 1.00 51.37 O ATOM 520 H GLY A 777 -8.259 -8.739 17.792 1.00 0.00 H ATOM 521 N ASP A 778 -10.391 -7.031 16.503 1.00 56.47 N ATOM 522 CA ASP A 778 -10.901 -5.831 15.857 1.00 52.32 C ATOM 523 C ASP A 778 -10.077 -5.521 14.616 1.00 51.97 C ATOM 524 O ASP A 778 -8.850 -5.654 14.617 1.00 48.04 O ATOM 525 CB ASP A 778 -10.869 -4.643 16.816 1.00 52.36 C ATOM 526 CG ASP A 778 -11.914 -4.749 17.911 1.00 52.86 C ATOM 527 OD1 ASP A 778 -12.452 -5.858 18.118 1.00 58.39 O ATOM 528 OD2 ASP A 778 -12.203 -3.724 18.560 1.00 44.02 O ATOM 529 H ASP A 778 -9.941 -6.962 17.438 1.00 0.00 H ATOM 530 N LYS A 779 -10.761 -5.105 13.554 1.00 53.89 N ATOM 531 CA LYS A 779 -10.116 -4.735 12.301 1.00 48.86 C ATOM 532 C LYS A 779 -9.872 -3.232 12.282 1.00 48.10 C ATOM 533 O LYS A 779 -10.781 -2.447 12.560 1.00 50.64 O ATOM 534 CB LYS A 779 -10.991 -5.153 11.120 1.00 49.76 C ATOM 535 CG LYS A 779 -10.441 -4.803 9.752 1.00 48.40 C ATOM 536 CD LYS A 779 -11.552 -4.820 8.717 1.00 53.85 C ATOM 537 CE LYS A 779 -11.098 -5.445 7.415 1.00 49.40 C ATOM 538 NZ LYS A 779 -12.206 -5.490 6.418 1.00 53.04 N ATOM 539 HZ1 LYS A 779 -12.991 -6.055 6.800 1.00 0.00 H ATOM 540 HZ2 LYS A 779 -12.535 -4.523 6.224 1.00 0.00 H ATOM 541 HZ3 LYS A 779 -11.861 -5.924 5.538 1.00 0.00 H ATOM 542 H LYS A 779 -11.797 -5.041 13.621 1.00 0.00 H ATOM 543 N LEU A 780 -8.647 -2.834 11.950 1.00 50.35 N ATOM 544 CA LEU A 780 -8.302 -1.419 11.864 1.00 48.74 C ATOM 545 C LEU A 780 -8.828 -0.849 10.551 1.00 46.84 C ATOM 546 O LEU A 780 -8.344 -1.208 9.470 1.00 50.04 O ATOM 547 CB LEU A 780 -6.792 -1.219 11.959 1.00 50.03 C ATOM 548 CG LEU A 780 -6.161 -1.150 13.346 1.00 46.55 C ATOM 549 CD1 LEU A 780 -4.723 -0.657 13.226 1.00 46.35 C ATOM 550 CD2 LEU A 780 -6.960 -0.259 14.278 1.00 48.02 C ATOM 551 H LEU A 780 -7.918 -3.548 11.747 1.00 0.00 H ATOM 552 N LEU A 781 -9.806 0.048 10.641 1.00 47.77 N ATOM 553 CA LEU A 781 -10.283 0.788 9.481 1.00 49.52 C ATOM 554 C LEU A 781 -9.635 2.156 9.343 1.00 50.12 C ATOM 555 O LEU A 781 -9.537 2.672 8.227 1.00 50.91 O ATOM 556 CB LEU A 781 -11.802 0.973 9.550 1.00 53.06 C ATOM 557 CG LEU A 781 -12.664 -0.287 9.607 1.00 55.21 C ATOM 558 CD1 LEU A 781 -14.128 0.092 9.803 1.00 54.97 C ATOM 559 CD2 LEU A 781 -12.489 -1.126 8.359 1.00 51.22 C ATOM 560 H LEU A 781 -10.243 0.226 11.568 1.00 0.00 H ATOM 561 N GLU A 782 -9.182 2.751 10.446 1.00 54.55 N ATOM 562 CA GLU A 782 -8.727 4.134 10.437 1.00 54.24 C ATOM 563 C GLU A 782 -7.907 4.409 11.689 1.00 52.49 C ATOM 564 O GLU A 782 -8.209 3.880 12.765 1.00 49.21 O ATOM 565 CB GLU A 782 -9.922 5.096 10.364 1.00 55.75 C ATOM 566 CG GLU A 782 -9.661 6.379 9.587 1.00 58.25 C ATOM 567 CD GLU A 782 -10.874 7.299 9.551 1.00 66.24 C ATOM 568 OE1 GLU A 782 -11.967 6.847 9.142 1.00 71.78 O ATOM 569 OE2 GLU A 782 -10.731 8.477 9.940 1.00 65.41 O ATOM 570 H GLU A 782 -9.153 2.214 11.336 1.00 0.00 H ATOM 571 N VAL A 783 -6.877 5.237 11.537 1.00 54.09 N ATOM 572 CA VAL A 783 -6.030 5.665 12.644 1.00 53.43 C ATOM 573 C VAL A 783 -5.678 7.130 12.424 1.00 53.18 C ATOM 574 O VAL A 783 -5.084 7.481 11.399 1.00 51.82 O ATOM 575 CB VAL A 783 -4.752 4.816 12.763 1.00 56.23 C ATOM 576 CG1 VAL A 783 -3.685 5.555 13.563 1.00 57.40 C ATOM 577 CG2 VAL A 783 -5.068 3.479 13.410 1.00 50.98 C ATOM 578 H VAL A 783 -6.666 5.596 10.584 1.00 0.00 H ATOM 579 N ASN A 784 -6.055 7.981 13.374 1.00 55.06 N ATOM 580 CA ASN A 784 -5.710 9.401 13.348 1.00 60.61 C ATOM 581 C ASN A 784 -6.043 10.042 12.005 1.00 60.71 C ATOM 582 O ASN A 784 -5.333 10.925 11.523 1.00 61.17 O ATOM 583 CB ASN A 784 -4.228 9.617 13.668 1.00 65.77 C ATOM 584 CG ASN A 784 -3.865 9.213 15.074 1.00 58.74 C ATOM 585 OD1 ASN A 784 -4.704 9.226 15.978 1.00 50.34 O ATOM 586 ND2 ASN A 784 -2.607 8.854 15.273 1.00 63.93 N ATOM 587 HD22 ASN A 784 -1.933 8.858 14.481 1.00 0.00 H ATOM 588 HD21 ASN A 784 -2.292 8.568 16.222 1.00 0.00 H ATOM 589 H ASN A 784 -6.620 7.621 14.170 1.00 0.00 H ATOM 590 N GLY A 785 -7.138 9.592 11.394 1.00 60.99 N ATOM 591 CA GLY A 785 -7.545 10.094 10.099 1.00 61.27 C ATOM 592 C GLY A 785 -6.961 9.365 8.907 1.00 61.01 C ATOM 593 O GLY A 785 -7.394 9.617 7.774 1.00 61.80 O ATOM 594 H GLY A 785 -7.715 8.862 11.859 1.00 0.00 H ATOM 595 N VAL A 786 -6.000 8.473 9.113 1.00 60.02 N ATOM 596 CA VAL A 786 -5.422 7.691 8.029 1.00 59.36 C ATOM 597 C VAL A 786 -6.272 6.441 7.832 1.00 54.06 C ATOM 598 O VAL A 786 -6.363 5.597 8.729 1.00 54.92 O ATOM 599 CB VAL A 786 -3.960 7.318 8.322 1.00 59.45 C ATOM 600 CG1 VAL A 786 -3.382 6.481 7.184 1.00 57.73 C ATOM 601 CG2 VAL A 786 -3.124 8.568 8.543 1.00 66.75 C ATOM 602 H VAL A 786 -5.648 8.328 10.081 1.00 0.00 H ATOM 603 N ALA A 787 -6.884 6.317 6.657 1.00 60.09 N ATOM 604 CA ALA A 787 -7.654 5.122 6.333 1.00 53.40 C ATOM 605 C ALA A 787 -6.709 3.952 6.096 1.00 51.02 C ATOM 606 O ALA A 787 -5.892 3.984 5.169 1.00 49.25 O ATOM 607 CB ALA A 787 -8.522 5.365 5.102 1.00 54.38 C ATOM 608 H ALA A 787 -6.812 7.084 5.959 1.00 0.00 H ATOM 609 N LEU A 788 -6.820 2.919 6.933 1.00 48.98 N ATOM 610 CA LEU A 788 -5.980 1.734 6.841 1.00 51.58 C ATOM 611 C LEU A 788 -6.706 0.554 6.201 1.00 50.13 C ATOM 612 O LEU A 788 -6.340 -0.602 6.443 1.00 50.03 O ATOM 613 CB LEU A 788 -5.470 1.344 8.228 1.00 52.46 C ATOM 614 CG LEU A 788 -4.602 2.384 8.936 1.00 56.97 C ATOM 615 CD1 LEU A 788 -4.229 1.906 10.332 1.00 58.87 C ATOM 616 CD2 LEU A 788 -3.352 2.690 8.120 1.00 55.99 C ATOM 617 H LEU A 788 -7.538 2.962 7.684 1.00 0.00 H ATOM 618 N GLN A 789 -7.730 0.822 5.399 1.00 47.26 N ATOM 619 CA GLN A 789 -8.451 -0.229 4.695 1.00 53.85 C ATOM 620 C GLN A 789 -7.688 -0.582 3.424 1.00 50.05 C ATOM 621 O GLN A 789 -7.410 0.294 2.596 1.00 48.79 O ATOM 622 CB GLN A 789 -9.870 0.228 4.366 1.00 53.39 C ATOM 623 CG GLN A 789 -10.485 1.137 5.419 1.00 58.25 C ATOM 624 CD GLN A 789 -11.887 1.580 5.058 1.00 61.56 C ATOM 625 OE1 GLN A 789 -12.231 2.755 5.184 1.00 70.07 O ATOM 626 NE2 GLN A 789 -12.710 0.635 4.614 1.00 62.89 N ATOM 627 HE22 GLN A 789 -12.375 -0.346 4.524 1.00 0.00 H ATOM 628 HE21 GLN A 789 -13.688 0.876 4.357 1.00 0.00 H ATOM 629 H GLN A 789 -8.025 1.811 5.270 1.00 0.00 H ATOM 630 N GLY A 790 -7.347 -1.856 3.269 1.00 49.09 N ATOM 631 CA GLY A 790 -6.541 -2.259 2.129 1.00 49.92 C ATOM 632 C GLY A 790 -5.155 -1.657 2.162 1.00 48.31 C ATOM 633 O GLY A 790 -4.634 -1.238 1.121 1.00 51.58 O ATOM 634 H GLY A 790 -7.657 -2.565 3.964 1.00 0.00 H ATOM 635 N ALA A 791 -4.553 -1.590 3.342 1.00 51.86 N ATOM 636 CA ALA A 791 -3.231 -1.013 3.528 1.00 57.33 C ATOM 637 C ALA A 791 -2.233 -2.106 3.881 1.00 55.31 C ATOM 638 O ALA A 791 -2.594 -3.235 4.223 1.00 51.59 O ATOM 639 CB ALA A 791 -3.252 0.061 4.622 1.00 57.58 C ATOM 640 H ALA A 791 -5.050 -1.968 4.174 1.00 0.00 H ATOM 641 N GLU A 792 -0.958 -1.751 3.791 1.00 60.94 N ATOM 642 CA GLU A 792 0.124 -2.668 4.115 1.00 63.34 C ATOM 643 C GLU A 792 0.436 -2.608 5.607 1.00 61.47 C ATOM 644 O GLU A 792 0.030 -1.682 6.315 1.00 56.22 O ATOM 645 CB GLU A 792 1.368 -2.334 3.288 1.00 64.10 C ATOM 646 CG GLU A 792 1.192 -2.585 1.792 1.00 60.11 C ATOM 647 CD GLU A 792 2.269 -1.926 0.951 1.00 60.34 C ATOM 648 OE1 GLU A 792 2.986 -1.048 1.475 1.00 57.80 O ATOM 649 OE2 GLU A 792 2.397 -2.284 -0.238 1.00 59.96 O ATOM 650 H GLU A 792 -0.725 -0.787 3.479 1.00 0.00 H ATOM 651 N HIS A 793 1.158 -3.626 6.079 1.00 64.14 N ATOM 652 CA HIS A 793 1.434 -3.738 7.505 1.00 59.55 C ATOM 653 C HIS A 793 2.248 -2.548 7.999 1.00 62.61 C ATOM 654 O HIS A 793 1.918 -1.936 9.023 1.00 64.96 O ATOM 655 CB HIS A 793 2.165 -5.048 7.795 1.00 59.41 C ATOM 656 CG HIS A 793 2.419 -5.291 9.249 1.00 65.54 C ATOM 657 ND1 HIS A 793 1.548 -6.000 10.050 1.00 61.84 N ATOM 658 CD2 HIS A 793 3.447 -4.921 10.050 1.00 60.86 C ATOM 659 CE1 HIS A 793 2.029 -6.056 11.278 1.00 59.66 C ATOM 660 NE2 HIS A 793 3.181 -5.409 11.306 1.00 59.26 N ATOM 661 H HIS A 793 1.526 -4.345 5.424 1.00 0.00 H ATOM 662 N HIS A 794 3.322 -2.205 7.284 1.00 58.90 N ATOM 663 CA HIS A 794 4.143 -1.075 7.700 1.00 63.08 C ATOM 664 C HIS A 794 3.372 0.234 7.628 1.00 64.73 C ATOM 665 O HIS A 794 3.776 1.212 8.265 1.00 65.78 O ATOM 666 CB HIS A 794 5.417 -1.004 6.850 1.00 62.43 C ATOM 667 CG HIS A 794 5.284 -0.180 5.609 1.00 63.39 C ATOM 668 ND1 HIS A 794 4.902 -0.714 4.396 1.00 63.92 N ATOM 669 CD2 HIS A 794 5.507 1.137 5.385 1.00 68.58 C ATOM 670 CE1 HIS A 794 4.883 0.241 3.484 1.00 65.29 C ATOM 671 NE2 HIS A 794 5.245 1.375 4.058 1.00 67.45 N ATOM 672 H HIS A 794 3.573 -2.744 6.431 1.00 0.00 H ATOM 673 N GLU A 795 2.265 0.267 6.883 1.00 62.20 N ATOM 674 CA GLU A 795 1.456 1.477 6.799 1.00 63.67 C ATOM 675 C GLU A 795 0.739 1.743 8.113 1.00 61.90 C ATOM 676 O GLU A 795 0.607 2.898 8.534 1.00 62.54 O ATOM 677 CB GLU A 795 0.454 1.347 5.652 1.00 66.41 C ATOM 678 CG GLU A 795 0.354 2.572 4.752 1.00 65.05 C ATOM 679 CD GLU A 795 -0.257 2.250 3.396 1.00 74.24 C ATOM 680 OE1 GLU A 795 -0.046 1.122 2.896 1.00 65.50 O ATOM 681 OE2 GLU A 795 -0.950 3.124 2.832 1.00 93.23 O ATOM 682 H GLU A 795 1.976 -0.581 6.356 1.00 0.00 H ATOM 683 N ALA A 796 0.274 0.685 8.778 1.00 63.17 N ATOM 684 CA ALA A 796 -0.393 0.837 10.064 1.00 65.02 C ATOM 685 C ALA A 796 0.600 0.998 11.206 1.00 65.12 C ATOM 686 O ALA A 796 0.301 1.686 12.189 1.00 64.46 O ATOM 687 CB ALA A 796 -1.301 -0.365 10.329 1.00 60.60 C ATOM 688 H ALA A 796 0.390 -0.265 8.371 1.00 0.00 H ATOM 689 N VAL A 797 1.776 0.376 11.100 1.00 63.49 N ATOM 690 CA VAL A 797 2.779 0.495 12.154 1.00 72.08 C ATOM 691 C VAL A 797 3.274 1.933 12.256 1.00 72.31 C ATOM 692 O VAL A 797 3.386 2.493 13.352 1.00 69.48 O ATOM 693 CB VAL A 797 3.939 -0.485 11.901 1.00 72.13 C ATOM 694 CG1 VAL A 797 5.090 -0.210 12.856 1.00 80.72 C ATOM 695 CG2 VAL A 797 3.461 -1.924 12.036 1.00 65.37 C ATOM 696 H VAL A 797 1.980 -0.199 10.258 1.00 0.00 H ATOM 697 N GLU A 798 3.577 2.556 11.115 1.00 70.49 N ATOM 698 CA GLU A 798 4.037 3.939 11.146 1.00 69.92 C ATOM 699 C GLU A 798 2.923 4.880 11.582 1.00 67.36 C ATOM 700 O GLU A 798 3.198 5.950 12.136 1.00 64.72 O ATOM 701 CB GLU A 798 4.588 4.343 9.776 1.00 73.38 C ATOM 702 CG GLU A 798 3.570 4.339 8.656 1.00 68.81 C ATOM 703 CD GLU A 798 4.207 4.518 7.285 1.00 79.13 C ATOM 704 OE1 GLU A 798 3.542 5.084 6.389 1.00 67.98 O ATOM 705 OE2 GLU A 798 5.369 4.090 7.104 1.00 71.06 O ATOM 706 H GLU A 798 3.485 2.057 10.207 1.00 0.00 H ATOM 707 N ALA A 799 1.665 4.500 11.351 1.00 63.46 N ATOM 708 CA ALA A 799 0.537 5.296 11.815 1.00 62.62 C ATOM 709 C ALA A 799 0.281 5.130 13.308 1.00 65.66 C ATOM 710 O ALA A 799 -0.437 5.948 13.893 1.00 64.69 O ATOM 711 CB ALA A 799 -0.726 4.918 11.040 1.00 59.80 C ATOM 712 H ALA A 799 1.486 3.618 10.829 1.00 0.00 H ATOM 713 N LEU A 800 0.850 4.097 13.931 1.00 62.35 N ATOM 714 CA LEU A 800 0.655 3.839 15.349 1.00 63.54 C ATOM 715 C LEU A 800 1.923 4.003 16.173 1.00 67.46 C ATOM 716 O LEU A 800 1.845 3.991 17.407 1.00 65.60 O ATOM 717 CB LEU A 800 0.114 2.417 15.559 1.00 62.29 C ATOM 718 CG LEU A 800 -1.338 2.163 15.161 1.00 58.96 C ATOM 719 CD1 LEU A 800 -1.662 0.684 15.312 1.00 59.90 C ATOM 720 CD2 LEU A 800 -2.284 3.011 15.995 1.00 59.46 C ATOM 721 H LEU A 800 1.455 3.453 13.383 1.00 0.00 H ATOM 722 N ARG A 801 3.086 4.152 15.536 1.00 70.19 N ATOM 723 CA ARG A 801 4.321 4.251 16.302 1.00 74.56 C ATOM 724 C ARG A 801 4.549 5.659 16.838 1.00 73.87 C ATOM 725 O ARG A 801 5.156 5.813 17.904 1.00 77.83 O ATOM 726 CB ARG A 801 5.509 3.795 15.454 1.00 76.13 C ATOM 727 CG ARG A 801 5.984 4.763 14.382 1.00 70.97 C ATOM 728 CD ARG A 801 6.970 4.043 13.468 1.00 74.65 C ATOM 729 NE ARG A 801 7.414 4.828 12.320 1.00 77.70 N ATOM 730 CZ ARG A 801 8.142 4.330 11.323 1.00 75.38 C ATOM 731 NH1 ARG A 801 8.516 5.102 10.313 1.00 74.27 N ATOM 732 NH2 ARG A 801 8.493 3.051 11.337 1.00 77.97 N ATOM 733 HE ARG A 801 7.147 5.832 12.279 1.00 0.00 H ATOM 734 HH12 ARG A 801 9.085 4.705 9.538 1.00 0.00 H ATOM 735 HH11 ARG A 801 8.241 6.105 10.295 1.00 0.00 H ATOM 736 HH22 ARG A 801 9.062 2.659 10.559 1.00 0.00 H ATOM 737 HH21 ARG A 801 8.199 2.440 12.126 1.00 0.00 H ATOM 738 H ARG A 801 3.111 4.197 14.497 1.00 0.00 H ATOM 739 N GLY A 802 4.070 6.689 16.145 1.00 73.70 N ATOM 740 CA GLY A 802 4.185 8.034 16.672 1.00 74.80 C ATOM 741 C GLY A 802 3.490 8.158 18.012 1.00 77.20 C ATOM 742 O GLY A 802 4.139 8.203 19.064 1.00 80.30 O ATOM 743 H GLY A 802 3.613 6.529 15.225 1.00 0.00 H ATOM 744 N ALA A 803 2.163 8.214 17.967 1.00 74.54 N ATOM 745 CA ALA A 803 1.305 8.144 19.147 1.00 74.72 C ATOM 746 C ALA A 803 1.889 8.943 20.310 1.00 71.76 C ATOM 747 O ALA A 803 2.110 8.437 21.411 1.00 73.22 O ATOM 748 CB ALA A 803 1.063 6.685 19.541 1.00 68.09 C ATOM 749 H ALA A 803 1.709 8.314 17.037 1.00 0.00 H ATOM 750 N GLY A 804 2.138 10.224 20.037 1.00 73.02 N ATOM 751 CA GLY A 804 2.701 11.088 21.059 1.00 71.27 C ATOM 752 C GLY A 804 1.977 10.965 22.381 1.00 75.94 C ATOM 753 O GLY A 804 2.590 10.726 23.423 1.00 94.93 O ATOM 754 H GLY A 804 1.929 10.604 19.092 1.00 0.00 H ATOM 755 N THR A 805 0.660 11.105 22.353 1.00 70.99 N ATOM 756 CA THR A 805 -0.131 10.935 23.566 1.00 72.99 C ATOM 757 C THR A 805 -1.461 10.225 23.354 1.00 67.41 C ATOM 758 O THR A 805 -1.914 9.532 24.269 1.00 64.51 O ATOM 759 CB THR A 805 -0.406 12.293 24.221 1.00 73.71 C ATOM 760 OG1 THR A 805 -0.983 12.088 25.518 1.00 76.22 O ATOM 761 CG2 THR A 805 -1.360 13.118 23.376 1.00 74.45 C ATOM 762 HG1 THR A 805 -1.832 11.587 25.425 1.00 0.00 H ATOM 763 H THR A 805 0.186 11.338 21.457 1.00 0.00 H ATOM 764 N ALA A 806 -2.105 10.361 22.201 1.00 66.82 N ATOM 765 CA ALA A 806 -3.373 9.698 21.969 1.00 64.19 C ATOM 766 C ALA A 806 -3.472 9.251 20.521 1.00 57.04 C ATOM 767 O ALA A 806 -2.894 9.860 19.615 1.00 60.71 O ATOM 768 CB ALA A 806 -4.561 10.607 22.301 1.00 58.03 C ATOM 769 H ALA A 806 -1.693 10.953 21.452 1.00 0.00 H ATOM 770 N VAL A 807 -4.207 8.165 20.324 1.00 53.58 N ATOM 771 CA VAL A 807 -4.557 7.664 19.005 1.00 58.49 C ATOM 772 C VAL A 807 -6.062 7.467 18.999 1.00 53.52 C ATOM 773 O VAL A 807 -6.636 6.999 19.988 1.00 50.27 O ATOM 774 CB VAL A 807 -3.829 6.348 18.671 1.00 63.82 C ATOM 775 H VAL A 807 -4.551 7.645 21.156 1.00 0.00 H ATOM 776 N GLN A 808 -6.706 7.859 17.905 1.00 52.49 N ATOM 777 CA GLN A 808 -8.128 7.616 17.707 1.00 49.09 C ATOM 778 C GLN A 808 -8.264 6.711 16.494 1.00 48.32 C ATOM 779 O GLN A 808 -7.786 7.053 15.407 1.00 45.90 O ATOM 780 CB GLN A 808 -8.902 8.920 17.515 1.00 48.62 C ATOM 781 CG GLN A 808 -10.400 8.714 17.344 1.00 49.89 C ATOM 782 CD GLN A 808 -11.202 9.971 17.625 1.00 48.80 C ATOM 783 OE1 GLN A 808 -11.126 10.948 16.883 1.00 52.90 O ATOM 784 NE2 GLN A 808 -11.973 9.951 18.705 1.00 46.33 N ATOM 785 HE22 GLN A 808 -12.006 9.102 19.305 1.00 0.00 H ATOM 786 HE21 GLN A 808 -12.544 10.784 18.952 1.00 0.00 H ATOM 787 H GLN A 808 -6.175 8.358 17.163 1.00 0.00 H ATOM 788 N MET A 809 -8.889 5.553 16.686 1.00 45.94 N ATOM 789 CA MET A 809 -9.013 4.563 15.627 1.00 48.23 C ATOM 790 C MET A 809 -10.461 4.119 15.497 1.00 46.13 C ATOM 791 O MET A 809 -11.134 3.871 16.502 1.00 43.57 O ATOM 792 CB MET A 809 -8.103 3.353 15.891 1.00 47.04 C ATOM 793 CG MET A 809 -8.070 2.868 17.329 1.00 49.61 C ATOM 794 SD MET A 809 -6.793 1.616 17.588 1.00 62.20 S ATOM 795 CE MET A 809 -7.797 0.171 17.909 1.00 50.56 C ATOM 796 H MET A 809 -9.301 5.349 17.619 1.00 0.00 H ATOM 797 N ARG A 810 -10.938 4.046 14.256 1.00 47.68 N ATOM 798 CA ARG A 810 -12.199 3.389 13.944 1.00 46.21 C ATOM 799 C ARG A 810 -11.916 1.917 13.679 1.00 42.98 C ATOM 800 O ARG A 810 -10.973 1.580 12.954 1.00 43.04 O ATOM 801 CB ARG A 810 -12.871 4.035 12.734 1.00 54.69 C ATOM 802 CG ARG A 810 -13.391 5.445 12.996 1.00 56.36 C ATOM 803 CD ARG A 810 -13.653 6.208 11.698 1.00 68.27 C ATOM 804 NE ARG A 810 -14.972 5.932 11.134 1.00 63.01 N ATOM 805 CZ ARG A 810 -16.027 6.738 11.248 1.00 74.55 C ATOM 806 NH1 ARG A 810 -15.932 7.886 11.910 1.00 67.08 N ATOM 807 NH2 ARG A 810 -17.183 6.396 10.693 1.00 71.71 N ATOM 808 HE ARG A 810 -15.096 5.044 10.607 1.00 0.00 H ATOM 809 HH12 ARG A 810 -16.761 8.508 11.993 1.00 0.00 H ATOM 810 HH11 ARG A 810 -15.029 8.162 12.345 1.00 0.00 H ATOM 811 HH22 ARG A 810 -18.008 7.023 10.781 1.00 0.00 H ATOM 812 HH21 ARG A 810 -17.264 5.501 10.170 1.00 0.00 H ATOM 813 H ARG A 810 -10.390 4.474 13.482 1.00 0.00 H ATOM 814 N VAL A 811 -12.721 1.043 14.281 1.00 47.65 N ATOM 815 CA VAL A 811 -12.527 -0.395 14.172 1.00 50.16 C ATOM 816 C VAL A 811 -13.830 -1.049 13.734 1.00 47.83 C ATOM 817 O VAL A 811 -14.921 -0.501 13.906 1.00 45.29 O ATOM 818 CB VAL A 811 -12.042 -1.017 15.500 1.00 44.01 C ATOM 819 CG1 VAL A 811 -10.728 -0.389 15.920 1.00 41.85 C ATOM 820 CG2 VAL A 811 -13.098 -0.848 16.588 1.00 44.40 C ATOM 821 H VAL A 811 -13.516 1.401 14.849 1.00 0.00 H ATOM 822 N TRP A 812 -13.697 -2.243 13.164 1.00 49.19 N ATOM 823 CA TRP A 812 -14.836 -3.059 12.762 1.00 52.43 C ATOM 824 C TRP A 812 -14.859 -4.297 13.651 1.00 51.72 C ATOM 825 O TRP A 812 -13.958 -5.139 13.575 1.00 54.42 O ATOM 826 CB TRP A 812 -14.759 -3.447 11.287 1.00 54.75 C ATOM 827 CG TRP A 812 -16.038 -4.060 10.807 1.00 58.77 C ATOM 828 CD1 TRP A 812 -16.311 -5.389 10.668 1.00 55.90 C ATOM 829 CD2 TRP A 812 -17.230 -3.362 10.429 1.00 59.37 C ATOM 830 NE1 TRP A 812 -17.598 -5.561 10.220 1.00 60.93 N ATOM 831 CE2 TRP A 812 -18.182 -4.331 10.065 1.00 61.02 C ATOM 832 CE3 TRP A 812 -17.582 -2.012 10.363 1.00 61.94 C ATOM 833 CZ2 TRP A 812 -19.463 -3.994 9.638 1.00 63.43 C ATOM 834 CZ3 TRP A 812 -18.851 -1.678 9.938 1.00 61.18 C ATOM 835 CH2 TRP A 812 -19.777 -2.665 9.581 1.00 64.47 C ATOM 836 HE1 TRP A 812 -18.055 -6.476 10.029 1.00 0.00 H ATOM 837 H TRP A 812 -12.738 -2.611 12.998 1.00 0.00 H ATOM 838 N ARG A 813 -15.880 -4.399 14.492 1.00 53.18 N ATOM 839 CA ARG A 813 -16.056 -5.512 15.410 1.00 62.04 C ATOM 840 C ARG A 813 -17.190 -6.385 14.896 1.00 61.44 C ATOM 841 O ARG A 813 -18.224 -5.875 14.457 1.00 59.97 O ATOM 842 CB ARG A 813 -16.362 -4.998 16.816 1.00 62.39 C ATOM 843 CG ARG A 813 -16.302 -6.046 17.906 1.00 60.36 C ATOM 844 CD ARG A 813 -16.272 -5.382 19.269 1.00 61.37 C ATOM 845 NE ARG A 813 -15.005 -4.695 19.495 1.00 57.32 N ATOM 846 CZ ARG A 813 -14.814 -3.760 20.419 1.00 55.50 C ATOM 847 NH1 ARG A 813 -13.621 -3.195 20.557 1.00 56.69 N ATOM 848 NH2 ARG A 813 -15.817 -3.387 21.200 1.00 58.45 N ATOM 849 HE ARG A 813 -14.198 -4.955 18.893 1.00 0.00 H ATOM 850 HH12 ARG A 813 -13.473 -2.463 21.281 1.00 0.00 H ATOM 851 HH11 ARG A 813 -12.834 -3.484 19.941 1.00 0.00 H ATOM 852 HH22 ARG A 813 -15.668 -2.655 21.924 1.00 0.00 H ATOM 853 HH21 ARG A 813 -16.753 -3.826 21.089 1.00 0.00 H ATOM 854 H ARG A 813 -16.593 -3.642 14.495 1.00 0.00 H ATOM 855 N GLU A 814 -16.986 -7.702 14.921 1.00 63.56 N ATOM 856 CA GLU A 814 -17.965 -8.657 14.404 1.00 62.47 C ATOM 857 C GLU A 814 -18.219 -9.713 15.471 1.00 66.45 C ATOM 858 O GLU A 814 -17.361 -10.565 15.722 1.00 68.76 O ATOM 859 CB GLU A 814 -17.480 -9.296 13.102 1.00 69.06 C ATOM 860 CG GLU A 814 -18.291 -8.888 11.880 1.00 66.05 C ATOM 861 CD GLU A 814 -17.563 -9.147 10.576 1.00 71.33 C ATOM 862 OE1 GLU A 814 -17.900 -8.489 9.566 1.00 63.62 O ATOM 863 OE2 GLU A 814 -16.650 -10.000 10.563 1.00 70.84 O ATOM 864 H GLU A 814 -16.098 -8.064 15.323 1.00 0.00 H ATOM 865 N ARG A 815 -19.400 -9.661 16.083 1.00 66.98 N ATOM 866 CA ARG A 815 -19.737 -10.518 17.216 1.00 77.95 C ATOM 867 C ARG A 815 -18.711 -10.358 18.335 1.00 78.90 C ATOM 868 O ARG A 815 -19.070 -10.206 19.503 1.00 85.40 O ATOM 869 CB ARG A 815 -19.822 -11.985 16.795 1.00 75.52 C ATOM 870 CG ARG A 815 -21.238 -12.480 16.540 1.00 78.21 C ATOM 871 CD ARG A 815 -21.394 -13.938 16.958 1.00103.90 C ATOM 872 NE ARG A 815 -21.310 -14.104 18.408 1.00 88.48 N ATOM 873 CZ ARG A 815 -22.357 -14.085 19.229 1.00 88.01 C ATOM 874 NH1 ARG A 815 -23.581 -13.909 18.749 1.00 83.44 N ATOM 875 NH2 ARG A 815 -22.181 -14.244 20.534 1.00 95.22 N ATOM 876 HE ARG A 815 -20.368 -14.247 18.826 1.00 0.00 H ATOM 877 HH12 ARG A 815 -24.396 -13.895 19.395 1.00 0.00 H ATOM 878 HH11 ARG A 815 -23.726 -13.785 17.727 1.00 0.00 H ATOM 879 HH22 ARG A 815 -23.000 -14.229 21.175 1.00 0.00 H ATOM 880 HH21 ARG A 815 -21.224 -14.384 20.916 1.00 0.00 H ATOM 881 H ARG A 815 -20.111 -8.983 15.741 1.00 0.00 H TER 882 ARG A 815 HETATM 883 O HOH 1 4.425 4.541 30.186 1.00 63.09 O HETATM 884 O HOH 2 -6.863 -2.650 7.402 1.00 40.48 O HETATM 885 O HOH 3 -8.057 -17.710 -0.741 1.00 89.88 O HETATM 886 O HOH 4 -6.614 -11.315 26.244 1.00 94.54 O HETATM 887 O HOH 5 3.357 7.615 29.323 1.00 54.07 O HETATM 888 N HIS A 6 2.809 -18.822 13.164 1.00 0.24 N HETATM 889 CA HIS A 6 3.435 -17.508 13.113 1.00 0.06 C HETATM 890 C HIS A 6 2.955 -16.770 11.878 1.00 0.23 C HETATM 891 O HIS A 6 3.196 -17.218 10.757 1.00 -0.39 O HETATM 892 N HIS A 6 2.285 -15.639 12.080 1.00 -0.26 N HETATM 893 CA HIS A 6 1.697 -14.905 10.970 1.00 0.13 C HETATM 894 C HIS A 6 1.752 -13.397 11.214 1.00 0.20 C HETATM 895 O HIS A 6 0.739 -12.708 11.272 1.00 -0.39 O HETATM 896 N HIS A 6 2.962 -12.863 11.367 1.00 -0.26 N HETATM 897 CA HIS A 6 3.231 -11.427 11.273 1.00 0.15 C HETATM 898 C HIS A 6 2.367 -10.610 12.242 1.00 0.21 C HETATM 899 O HIS A 6 1.439 -9.900 11.852 1.00 -0.39 O HETATM 900 N HIS A 6 2.726 -10.700 13.521 1.00 -0.26 N HETATM 901 CA HIS A 6 2.210 -9.793 14.539 1.00 0.13 C HETATM 902 C HIS A 6 3.300 -8.790 14.905 1.00 0.20 C HETATM 903 O HIS A 6 4.484 -9.139 14.956 1.00 -0.39 O HETATM 904 N HIS A 6 2.899 -7.547 15.161 1.00 -0.26 N HETATM 905 CA HIS A 6 3.819 -6.484 15.549 1.00 0.16 C HETATM 906 C HIS A 6 3.344 -5.878 16.861 1.00 0.21 C HETATM 907 O HIS A 6 2.176 -5.497 16.979 1.00 -0.39 O HETATM 908 N HIS A 6 4.243 -5.783 17.838 1.00 -0.26 N HETATM 909 CA HIS A 6 3.879 -5.274 19.155 1.00 0.15 C HETATM 910 C HIS A 6 3.925 -3.751 19.182 1.00 0.21 C HETATM 911 O HIS A 6 4.819 -3.130 18.601 1.00 -0.39 O HETATM 912 N HIS A 6 2.959 -3.153 19.875 1.00 -0.27 N HETATM 913 CA HIS A 6 2.840 -1.699 19.941 1.00 0.09 C HETATM 914 C HIS A 6 2.267 -1.226 21.272 1.00 0.06 C HETATM 915 O HIS A 6 1.555 -1.959 21.958 1.00 -0.57 O HETATM 916 OXT HIS A 6 2.499 -0.090 21.691 1.00 -0.57 O HETATM 917 CB HIS A 6 1.959 -1.192 18.798 1.00 -0.02 C HETATM 918 CG HIS A 6 2.663 -0.830 17.494 1.00 -0.04 C HETATM 919 CD1 HIS A 6 1.690 -0.905 16.330 1.00 -0.06 C HETATM 920 H42 HIS A 6 2.212 -0.642 15.398 1.00 0.02 H HETATM 921 H43 HIS A 6 0.862 -0.201 16.498 1.00 0.02 H HETATM 922 H44 HIS A 6 1.291 -1.927 16.251 1.00 0.02 H HETATM 923 CD2 HIS A 6 3.271 0.561 17.593 1.00 -0.06 C HETATM 924 H45 HIS A 6 3.972 0.595 18.440 1.00 0.02 H HETATM 925 H46 HIS A 6 2.471 1.300 17.748 1.00 0.02 H HETATM 926 H47 HIS A 6 3.809 0.793 16.662 1.00 0.02 H HETATM 927 H41 HIS A 6 3.473 -1.554 17.320 1.00 0.03 H HETATM 928 H39 HIS A 6 1.437 -0.292 19.155 1.00 0.03 H HETATM 929 H40 HIS A 6 1.223 -1.978 18.572 1.00 0.03 H HETATM 930 H38 HIS A 6 3.846 -1.268 19.827 1.00 0.07 H HETATM 931 H37 HIS A 6 2.294 -3.716 20.366 1.00 0.19 H HETATM 932 CB HIS A 6 4.814 -5.839 20.223 1.00 0.08 C HETATM 933 OG HIS A 6 4.459 -5.361 21.507 1.00 -0.39 O HETATM 934 H36 HIS A 6 5.052 -5.724 22.154 1.00 0.21 H HETATM 935 H34 HIS A 6 5.846 -5.533 19.997 1.00 0.06 H HETATM 936 H35 HIS A 6 4.747 -6.937 20.216 1.00 0.06 H HETATM 937 H33 HIS A 6 2.852 -5.597 19.381 1.00 0.08 H HETATM 938 H32 HIS A 6 5.186 -6.066 17.665 1.00 0.19 H HETATM 939 CB HIS A 6 3.907 -5.403 14.466 1.00 0.09 C HETATM 940 OG1 HIS A 6 4.517 -5.944 13.287 1.00 -0.39 O HETATM 941 H28 HIS A 6 4.568 -5.269 12.620 1.00 0.21 H HETATM 942 CG2 HIS A 6 4.721 -4.220 14.955 1.00 -0.03 C HETATM 943 H29 HIS A 6 4.771 -3.458 14.164 1.00 0.03 H HETATM 944 H30 HIS A 6 5.738 -4.554 15.207 1.00 0.03 H HETATM 945 H31 HIS A 6 4.244 -3.791 15.848 1.00 0.03 H HETATM 946 H27 HIS A 6 2.891 -5.061 14.222 1.00 0.06 H HETATM 947 H26 HIS A 6 4.820 -6.916 15.695 1.00 0.08 H HETATM 948 H25 HIS A 6 1.925 -7.333 15.084 1.00 0.19 H HETATM 949 CB HIS A 6 1.756 -10.538 15.800 1.00 -0.00 C HETATM 950 CG HIS A 6 1.071 -11.870 15.543 1.00 0.00 C HETATM 951 CD HIS A 6 0.224 -12.334 16.720 1.00 0.04 C HETATM 952 OE1 HIS A 6 0.079 -11.568 17.695 1.00 -0.57 O HETATM 953 OE2 HIS A 6 -0.305 -13.465 16.666 1.00 -0.57 O HETATM 954 H23 HIS A 6 1.842 -12.629 15.344 1.00 0.04 H HETATM 955 H24 HIS A 6 0.421 -11.767 14.661 1.00 0.04 H HETATM 956 H21 HIS A 6 1.052 -9.891 16.345 1.00 0.03 H HETATM 957 H22 HIS A 6 2.642 -10.724 16.425 1.00 0.03 H HETATM 958 H20 HIS A 6 1.347 -9.252 14.123 1.00 0.08 H HETATM 959 H19 HIS A 6 3.371 -11.414 13.793 1.00 0.19 H HETATM 960 CB HIS A 6 3.017 -10.951 9.828 1.00 0.08 C HETATM 961 CG HIS A 6 3.594 -9.582 9.570 1.00 0.18 C HETATM 962 OD1 HIS A 6 3.528 -8.697 10.422 1.00 -0.40 O HETATM 963 ND2 HIS A 6 4.181 -9.401 8.393 1.00 -0.30 N HETATM 964 H17 HIS A 6 4.582 -8.514 8.165 1.00 0.18 H HETATM 965 H18 HIS A 6 4.222 -10.152 7.734 1.00 0.18 H HETATM 966 H15 HIS A 6 1.936 -10.920 9.625 1.00 0.06 H HETATM 967 H16 HIS A 6 3.498 -11.669 9.147 1.00 0.06 H HETATM 968 H14 HIS A 6 4.285 -11.261 11.539 1.00 0.08 H HETATM 969 H13 HIS A 6 3.729 -13.476 11.556 1.00 0.19 H HETATM 970 CB HIS A 6 0.261 -15.368 10.735 1.00 -0.02 C HETATM 971 H10 HIS A 6 -0.172 -14.806 9.894 1.00 0.03 H HETATM 972 H11 HIS A 6 -0.335 -15.189 11.642 1.00 0.03 H HETATM 973 H12 HIS A 6 0.256 -16.442 10.499 1.00 0.03 H HETATM 974 H9 HIS A 6 2.282 -15.125 10.065 1.00 0.08 H HETATM 975 H8 HIS A 6 2.184 -15.287 13.011 1.00 0.19 H HETATM 976 CB HIS A 6 4.934 -17.628 13.097 1.00 -0.00 C HETATM 977 H5 HIS A 6 5.382 -16.624 13.058 1.00 0.03 H HETATM 978 H6 HIS A 6 5.246 -18.203 12.213 1.00 0.03 H HETATM 979 H7 HIS A 6 5.270 -18.145 14.008 1.00 0.03 H HETATM 980 H4 HIS A 6 3.138 -16.939 14.006 1.00 0.11 H HETATM 981 H1 HIS A 6 3.127 -19.314 13.984 1.00 0.20 H HETATM 982 H2 HIS A 6 3.059 -19.346 12.340 1.00 0.20 H HETATM 983 H3 HIS A 6 1.807 -18.716 13.203 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 176 177 180 181 182 CONECT 180 176 CONECT 181 176 CONECT 182 176 CONECT 888 889 981 982 983 CONECT 889 888 890 976 980 CONECT 890 889 891 892 CONECT 891 890 CONECT 892 890 893 975 CONECT 893 892 894 970 974 CONECT 894 893 895 896 CONECT 895 894 CONECT 896 894 897 969 CONECT 897 896 898 960 968 CONECT 898 897 899 900 CONECT 899 898 CONECT 900 898 901 959 CONECT 901 900 902 949 958 CONECT 902 901 903 904 CONECT 903 902 CONECT 904 902 905 948 CONECT 905 904 906 939 947 CONECT 906 905 907 908 CONECT 907 906 CONECT 908 906 909 938 CONECT 909 908 910 932 937 CONECT 910 909 911 912 CONECT 911 910 CONECT 912 910 913 931 CONECT 913 912 914 917 930 CONECT 914 913 915 916 CONECT 915 914 CONECT 916 914 CONECT 917 913 918 928 929 CONECT 918 917 919 923 927 CONECT 919 918 920 921 922 CONECT 920 919 CONECT 921 919 CONECT 922 919 CONECT 923 918 924 925 926 CONECT 924 923 CONECT 925 923 CONECT 926 923 CONECT 927 918 CONECT 928 917 CONECT 929 917 CONECT 930 913 CONECT 931 912 CONECT 932 909 933 935 936 CONECT 933 932 934 CONECT 934 933 CONECT 935 932 CONECT 936 932 CONECT 937 909 CONECT 938 908 CONECT 939 905 940 942 946 CONECT 940 939 941 CONECT 941 940 CONECT 942 939 943 944 945 CONECT 943 942 CONECT 944 942 CONECT 945 942 CONECT 946 939 CONECT 947 905 CONECT 948 904 CONECT 949 901 950 956 957 CONECT 950 949 951 954 955 CONECT 951 950 952 953 CONECT 952 951 CONECT 953 951 CONECT 954 950 CONECT 955 950 CONECT 956 949 CONECT 957 949 CONECT 958 901 CONECT 959 900 CONECT 960 897 961 966 967 CONECT 961 960 962 963 CONECT 962 961 CONECT 963 961 964 965 CONECT 964 963 CONECT 965 963 CONECT 966 960 CONECT 967 960 CONECT 968 897 CONECT 969 896 CONECT 970 893 971 972 973 CONECT 971 970 CONECT 972 970 CONECT 973 970 CONECT 974 893 CONECT 975 892 CONECT 976 889 977 978 979 CONECT 977 976 CONECT 978 976 CONECT 979 976 CONECT 980 889 CONECT 981 888 CONECT 982 888 CONECT 983 888 MASTER 0 0 0 0 0 0 0 0 981 2 104 9 END
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Related entries of code: 6mtv
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
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RCSB PDB
PDBbind
122aa, >5VWK_1|Chains... *
6mtu
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PDBbind
118aa, >6MTU_1|Chains... at 99%
6ms1
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PDBbind
94aa, >6MS1_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
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Ligand Name
1fo0
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1g7q
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1lek
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1nlp
RCSB PDB
PDBbind
8-mer
1nzl
RCSB PDB
PDBbind
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1nzv
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PDBbind
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1obx
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1okx
RCSB PDB
PDBbind
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1p2g
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PDBbind
8-mer
1pig
RCSB PDB
PDBbind
8-mer
1pz5
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PDBbind
8-mer
1qja
RCSB PDB
PDBbind
8-mer
1qjb
RCSB PDB
PDBbind
8-mer
1qr3
RCSB PDB
PDBbind
8-mer
1sle
RCSB PDB
PDBbind
8-mer
1tps
RCSB PDB
PDBbind
8-mer
2c1n
RCSB PDB
PDBbind
8-mer
2clv
RCSB PDB
PDBbind
8-mer
2er0
RCSB PDB
PDBbind
8-mer
2er9
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PDBbind
8-mer
2fo4
RCSB PDB
PDBbind
8-mer
2h6k
RCSB PDB
PDBbind
8-mer
2kbs
RCSB PDB
PDBbind
8-mer
2qbw
RCSB PDB
PDBbind
8-mer
2r03
RCSB PDB
PDBbind
8-mer
2r9b
RCSB PDB
PDBbind
8-mer
2rly
RCSB PDB
PDBbind
8-mer
2rt5
RCSB PDB
PDBbind
8-mer
2v88
RCSB PDB
PDBbind
8-mer
2w16
RCSB PDB
PDBbind
8-mer
2w3o
RCSB PDB
PDBbind
8-mer
2ynn
RCSB PDB
PDBbind
8-mer
2zpk
RCSB PDB
PDBbind
8-mer
3agm
RCSB PDB
PDBbind
8-mer
3av9
RCSB PDB
PDBbind
8-mer
3ava
RCSB PDB
PDBbind
8-mer
3avb
RCSB PDB
PDBbind
8-mer
3avf
RCSB PDB
PDBbind
8-mer
3avg
RCSB PDB
PDBbind
8-mer
3avh
RCSB PDB
PDBbind
8-mer
3avi
RCSB PDB
PDBbind
8-mer
3avj
RCSB PDB
PDBbind
8-mer
3avk
RCSB PDB
PDBbind
8-mer
3avl
RCSB PDB
PDBbind
8-mer
3avm
RCSB PDB
PDBbind
8-mer
3avn
RCSB PDB
PDBbind
8-mer
3drf
RCSB PDB
PDBbind
8-mer
3ds9
RCSB PDB
PDBbind
8-mer
3eyu
RCSB PDB
PDBbind
8-mer
3h85
RCSB PDB
PDBbind
8-mer
3i91
RCSB PDB
PDBbind
8-mer
3jvk
RCSB PDB
PDBbind
8-mer
3kze
RCSB PDB
PDBbind
8-mer
3muk
RCSB PDB
PDBbind
8-mer
3n5e
RCSB PDB
PDBbind
8-mer
3nf3
RCSB PDB
PDBbind
8-mer
3omc
RCSB PDB
PDBbind
8-mer
3omg
RCSB PDB
PDBbind
8-mer
3p9l
RCSB PDB
PDBbind
8-mer
3p9m
RCSB PDB
PDBbind
8-mer
3pab
RCSB PDB
PDBbind
8-mer
3qg6
RCSB PDB
PDBbind
8-mer
3rdv
RCSB PDB
PDBbind
8-mer
3rwh
RCSB PDB
PDBbind
8-mer
3rwj
RCSB PDB
PDBbind
8-mer
3unn
RCSB PDB
PDBbind
8-mer
3uqp
RCSB PDB
PDBbind
8-mer
3uri
RCSB PDB
PDBbind
8-mer
3uyr
RCSB PDB
PDBbind
8-mer
3zev
RCSB PDB
PDBbind
8-mer
3zvy
RCSB PDB
PDBbind
8-mer
3zyr
RCSB PDB
PDBbind
8-mer
4aa1
RCSB PDB
PDBbind
8-mer
4aph
RCSB PDB
PDBbind
8-mer
4apr
RCSB PDB
PDBbind
8-mer
4dv9
RCSB PDB
PDBbind
8-mer
4e67
RCSB PDB
PDBbind
8-mer
4eoy
RCSB PDB
PDBbind
8-mer
4ep2
RCSB PDB
PDBbind
8-mer
4eqj
RCSB PDB
PDBbind
8-mer
4ezr
RCSB PDB
PDBbind
8-mer
4fmo
RCSB PDB
PDBbind
8-mer
4fn5
RCSB PDB
PDBbind
8-mer
4gpk
RCSB PDB
PDBbind
8-mer
4gvc
RCSB PDB
PDBbind
8-mer
4gvd
RCSB PDB
PDBbind
8-mer
4gvu
RCSB PDB
PDBbind
8-mer
4h36
RCSB PDB
PDBbind
8-mer
4h75
RCSB PDB
PDBbind
8-mer
4ii9
RCSB PDB
PDBbind
8-mer
4jiz
RCSB PDB
PDBbind
8-mer
4lkl
RCSB PDB
PDBbind
8-mer
4lkm
RCSB PDB
PDBbind
8-mer
4mji
RCSB PDB
PDBbind
8-mer
4nxq
RCSB PDB
PDBbind
8-mer
4nxr
RCSB PDB
PDBbind
8-mer
4o2f
RCSB PDB
PDBbind
8-mer
4rxh
RCSB PDB
PDBbind
8-mer
4y7r
RCSB PDB
PDBbind
8-mer
4ysi
RCSB PDB
PDBbind
8-mer
5d7e
RCSB PDB
PDBbind
8-mer
5e2q
RCSB PDB
PDBbind
8-mer
5elq
RCSB PDB
PDBbind
8-mer
5em9
RCSB PDB
PDBbind
8-mer
5ema
RCSB PDB
PDBbind
8-mer
5emb
RCSB PDB
PDBbind
8-mer
5fjx
RCSB PDB
PDBbind
8-mer
5fpi
RCSB PDB
PDBbind
8-mer
5gmv
RCSB PDB
PDBbind
8-mer
5hjb
RCSB PDB
PDBbind
8-mer
5i25
RCSB PDB
PDBbind
8-mer
5iok
RCSB PDB
PDBbind
8-mer
5iql
RCSB PDB
PDBbind
8-mer
5jjm
RCSB PDB
PDBbind
8-mer
5mgx
RCSB PDB
PDBbind
8-mer
5n70
RCSB PDB
PDBbind
8-mer
5svi
RCSB PDB
PDBbind
8-mer
5sxm
RCSB PDB
PDBbind
8-mer
5t6p
RCSB PDB
PDBbind
8-mer
5t78
RCSB PDB
PDBbind
8-mer
5teg
RCSB PDB
PDBbind
8-mer
5tkj
RCSB PDB
PDBbind
8-mer
5tkk
RCSB PDB
PDBbind
8-mer
5vwi
RCSB PDB
PDBbind
8-mer
5vwk
RCSB PDB
PDBbind
8-mer
5wou
RCSB PDB
PDBbind
8-mer
5wtt
RCSB PDB
PDBbind
8-mer
5xjm
RCSB PDB
PDBbind
8-mer
5xn3
RCSB PDB
PDBbind
8-mer
5yba
RCSB PDB
PDBbind
8-mer
6cdm
RCSB PDB
PDBbind
8-mer
6cdo
RCSB PDB
PDBbind
8-mer
6cdp
RCSB PDB
PDBbind
8-mer
6e86
RCSB PDB
PDBbind
8-mer
6eww
RCSB PDB
PDBbind
8-mer
6fau
RCSB PDB
PDBbind
8-mer
6fav
RCSB PDB
PDBbind
8-mer
6faw
RCSB PDB
PDBbind
8-mer
6fbw
RCSB PDB
PDBbind
8-mer
6fby
RCSB PDB
PDBbind
8-mer
6fel
RCSB PDB
PDBbind
8-mer
6fi4
RCSB PDB
PDBbind
8-mer
6fi5
RCSB PDB
PDBbind
8-mer
6fmp
RCSB PDB
PDBbind
8-mer
6fx1
RCSB PDB
PDBbind
8-mer
6hpg
RCSB PDB
PDBbind
8-mer
6min
RCSB PDB
PDBbind
8-mer
6miq
RCSB PDB
PDBbind
8-mer
6q3q
RCSB PDB
PDBbind
8-mer
6r0x
RCSB PDB
PDBbind
8-mer
6qk8
RCSB PDB
PDBbind
8-mer
6q4q
RCSB PDB
PDBbind
8-mer
6mtu
RCSB PDB
PDBbind
8-mer
6ms1
RCSB PDB
PDBbind
8-mer
6mqe
RCSB PDB
PDBbind
8-mer
6mqc
RCSB PDB
PDBbind
8-mer
6jax
RCSB PDB
PDBbind
8-mer
6hmt
RCSB PDB
PDBbind
8-mer
6hhp
RCSB PDB
PDBbind
8-mer
6dtn
RCSB PDB
PDBbind
8-mer
6dql
RCSB PDB
PDBbind
8-mer
6do1
RCSB PDB
PDBbind
8-mer
Entry Information
PDB ID
6mtv
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
PDZ1
Ligand Name
8-mer
EC.Number
E.C.-.-.-.-
Resolution
2.6(Å)
Affinity (Kd/Ki/IC50)
Kd=7715nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Febs J. Vol. 286: pp. 4910-4925
Ligand Properties
Formula
C
2
8
H
4
9
N
8
O
1
3
Molecular Weight
705.734
Exact Mass
705.342
No. of atoms
98
No. of bonds
97
Polar Surface Area
360.39
LOGP Value
-4.57 (
Computed with XLOGP3
)
-3.16 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 10
No. of Hydrogen Bond Acceptors: 13
No. of Rotatable Bonds: 28
No. of Nitrogen and Oxygen Atoms: 21
No. of Rings: 0
Canonical SMILES
OC[C@@H](C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CC(=O)N)CCC(=O)O
InChI String
InChI=1S/C28H48N8O13/c1-11(2)8-17(28(48)49)34-26(46)18(10-37)35-27(47)21(14(5)38)36-24(44)15(6-7-20(40)41)32-25(45)16(9-19(30)39)33-23(43)13(4)31-22(42)12(3)29/h11-18,21,37-38H,6-10,29H2,1-5H3,(H2,30,39)(H,31,42)(H,32,45)(H,33,43)(H,34,46)(H,35,47)(H,36,44)(H,40,41)(H,48,49)/p+1/t12-,13-,14+,15-,16-,17-,18-,21-/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):
P23508
Q14160
Entrez Gene ID
NCBI Entrez Gene ID:
4163
23513
ASD
Information of known allosteric effects of PDB entries
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