Browse entries in the PDBbind-CN Database
HEADER 5Z4O_COMPLEX COMPND 5Z4O_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 83 LEU ASP ALA VAL ARG LYS ARG PRO GLY MET TYR ILE GLY SEQRES 2 A 83 ASP THR ASP ASP GLY THR GLY LEU HIS HIS MET VAL PHE SEQRES 3 A 83 GLU VAL VAL ASP ASN ALA ILE ASP GLU ALA LEU ALA GLY SEQRES 4 A 83 HIS CYS LYS GLU ILE ILE VAL THR ILE HIS ALA ASP ASN SEQRES 5 A 83 SER VAL SER VAL GLN ASP ASP GLY ARG GLY ILE PRO THR SEQRES 6 A 83 GLY ILE HIS PRO GLU GLU GLY VAL SER ALA ALA GLU VAL SEQRES 7 A 83 ILE MET THR VAL LEU SEQRES 1 A 101 VAL GLY VAL SER VAL VAL ASN ALA LEU SER GLN LYS LEU SEQRES 2 A 101 GLU LEU VAL ILE GLN ARG GLU GLY LYS ILE HIS ARG GLN SEQRES 3 A 101 ILE TYR GLU HIS GLY VAL PRO GLN ALA PRO LEU ALA VAL SEQRES 4 A 101 THR GLY GLU THR GLU LYS THR GLY THR MET VAL ARG PHE SEQRES 5 A 101 TRP PRO SER LEU GLU THR PHE THR ASN VAL THR GLU PHE SEQRES 6 A 101 GLU TYR GLU ILE LEU ALA LYS ARG LEU ARG GLU LEU SER SEQRES 7 A 101 PHE LEU ASN SER GLY VAL SER ILE ARG LEU ARG ASP LYS SEQRES 8 A 101 ARG ASP GLY LYS GLU ASP HIS PHE HIS TYR HET HX A 8 24 ATOM 1 N LEU A 16 -19.692 -11.275 -12.719 1.00 37.14 N ATOM 2 CA LEU A 16 -18.478 -11.185 -11.913 1.00 29.55 C ATOM 3 C LEU A 16 -18.602 -10.137 -10.804 1.00 32.77 C ATOM 4 O LEU A 16 -17.629 -9.860 -10.093 1.00 27.68 O ATOM 5 CB LEU A 16 -17.271 -10.855 -12.793 1.00 34.39 C ATOM 6 CG LEU A 16 -16.922 -11.837 -13.910 1.00 28.89 C ATOM 7 CD1 LEU A 16 -15.726 -11.315 -14.661 1.00 33.76 C ATOM 8 CD2 LEU A 16 -16.637 -13.194 -13.317 1.00 32.61 C ATOM 9 HN3 LEU A 16 -19.882 -10.353 -13.162 1.00 0.00 H ATOM 10 HN2 LEU A 16 -20.492 -11.539 -12.110 1.00 0.00 H ATOM 11 HN1 LEU A 16 -19.564 -11.996 -13.457 1.00 0.00 H ATOM 12 N ASP A 17 -19.795 -9.556 -10.641 1.00 30.05 N ATOM 13 CA ASP A 17 -19.933 -8.492 -9.648 1.00 30.88 C ATOM 14 C ASP A 17 -19.775 -9.020 -8.218 1.00 29.07 C ATOM 15 O ASP A 17 -19.363 -8.267 -7.329 1.00 29.45 O ATOM 16 CB ASP A 17 -21.271 -7.761 -9.837 1.00 35.01 C ATOM 17 CG ASP A 17 -21.117 -6.436 -10.603 1.00 47.60 C ATOM 18 OD1 ASP A 17 -19.968 -5.990 -10.827 1.00 39.56 O ATOM 19 OD2 ASP A 17 -22.147 -5.824 -10.967 1.00 41.16 O ATOM 20 H ASP A 17 -20.611 -9.856 -11.211 1.00 0.00 H ATOM 21 N ALA A 18 -20.046 -10.304 -7.972 1.00 27.77 N ATOM 22 CA ALA A 18 -19.811 -10.819 -6.622 1.00 30.39 C ATOM 23 C ALA A 18 -18.324 -10.824 -6.272 1.00 30.16 C ATOM 24 O ALA A 18 -17.959 -10.580 -5.114 1.00 27.22 O ATOM 25 CB ALA A 18 -20.391 -12.221 -6.473 1.00 34.47 C ATOM 26 H ALA A 18 -20.415 -10.923 -8.721 1.00 0.00 H ATOM 27 N VAL A 19 -17.459 -11.081 -7.258 1.00 28.48 N ATOM 28 CA VAL A 19 -16.013 -11.018 -7.043 1.00 27.85 C ATOM 29 C VAL A 19 -15.554 -9.580 -6.840 1.00 26.03 C ATOM 30 O VAL A 19 -14.712 -9.293 -5.978 1.00 26.19 O ATOM 31 CB VAL A 19 -15.270 -11.656 -8.233 1.00 29.32 C ATOM 32 CG1 VAL A 19 -13.762 -11.597 -7.990 1.00 26.33 C ATOM 33 CG2 VAL A 19 -15.746 -13.077 -8.469 1.00 32.79 C ATOM 34 H VAL A 19 -17.822 -11.332 -8.200 1.00 0.00 H ATOM 35 N ARG A 20 -16.062 -8.656 -7.663 1.00 26.79 N ATOM 36 CA ARG A 20 -15.622 -7.274 -7.544 1.00 22.66 C ATOM 37 C ARG A 20 -16.018 -6.697 -6.191 1.00 26.07 C ATOM 38 O ARG A 20 -15.292 -5.864 -5.644 1.00 26.31 O ATOM 39 CB ARG A 20 -16.211 -6.422 -8.671 1.00 22.58 C ATOM 40 CG ARG A 20 -15.904 -6.941 -10.107 1.00 24.80 C ATOM 41 CD ARG A 20 -16.183 -5.853 -11.160 1.00 29.50 C ATOM 42 NE ARG A 20 -15.938 -6.303 -12.544 1.00 28.56 N ATOM 43 CZ ARG A 20 -16.862 -6.866 -13.319 1.00 31.61 C ATOM 44 NH1 ARG A 20 -18.100 -7.059 -12.872 1.00 29.39 N ATOM 45 NH2 ARG A 20 -16.560 -7.223 -14.563 1.00 29.97 N ATOM 46 HE ARG A 20 -14.984 -6.172 -12.938 1.00 0.00 H ATOM 47 HH12 ARG A 20 -18.812 -7.500 -13.488 1.00 0.00 H ATOM 48 HH11 ARG A 20 -18.355 -6.769 -11.907 1.00 0.00 H ATOM 49 HH22 ARG A 20 -17.283 -7.663 -15.168 1.00 0.00 H ATOM 50 HH21 ARG A 20 -15.601 -7.063 -14.932 1.00 0.00 H ATOM 51 H ARG A 20 -16.765 -8.923 -8.381 1.00 0.00 H ATOM 52 N LYS A 21 -17.156 -7.143 -5.640 1.00 29.46 N ATOM 53 CA LYS A 21 -17.649 -6.608 -4.371 1.00 29.21 C ATOM 54 C LYS A 21 -16.721 -6.947 -3.216 1.00 33.00 C ATOM 55 O LYS A 21 -16.583 -6.157 -2.272 1.00 31.79 O ATOM 56 CB LYS A 21 -19.043 -7.160 -4.063 1.00 29.48 C ATOM 57 CG LYS A 21 -20.188 -6.253 -4.425 1.00 39.41 C ATOM 58 CD LYS A 21 -21.514 -6.822 -3.917 1.00 41.06 C ATOM 59 CE LYS A 21 -21.607 -6.781 -2.393 1.00 38.61 C ATOM 60 NZ LYS A 21 -23.026 -6.825 -1.904 1.00 36.88 N ATOM 61 HZ1 LYS A 21 -23.546 -6.007 -2.280 1.00 0.00 H ATOM 62 HZ2 LYS A 21 -23.477 -7.704 -2.230 1.00 0.00 H ATOM 63 HZ3 LYS A 21 -23.034 -6.795 -0.864 1.00 0.00 H ATOM 64 H LYS A 21 -17.700 -7.885 -6.125 1.00 0.00 H ATOM 65 N ARG A 22 -16.117 -8.130 -3.238 1.00 28.74 N ATOM 66 CA ARG A 22 -15.264 -8.594 -2.141 1.00 29.96 C ATOM 67 C ARG A 22 -14.105 -9.400 -2.708 1.00 31.53 C ATOM 68 O ARG A 22 -14.079 -10.634 -2.617 1.00 30.41 O ATOM 69 CB ARG A 22 -16.077 -9.413 -1.134 1.00 32.00 C ATOM 70 CG ARG A 22 -17.092 -8.558 -0.353 1.00 42.70 C ATOM 71 CD ARG A 22 -17.514 -9.199 0.929 1.00 50.52 C ATOM 72 NE ARG A 22 -16.447 -9.117 1.929 1.00 53.50 N ATOM 73 CZ ARG A 22 -16.498 -9.707 3.116 1.00 47.80 C ATOM 74 NH1 ARG A 22 -17.565 -10.420 3.441 1.00 53.44 N ATOM 75 NH2 ARG A 22 -15.487 -9.582 3.956 1.00 45.79 N ATOM 76 HE ARG A 22 -15.599 -8.563 1.694 1.00 0.00 H ATOM 77 HH12 ARG A 22 -17.616 -10.887 4.369 1.00 0.00 H ATOM 78 HH11 ARG A 22 -18.353 -10.513 2.768 1.00 0.00 H ATOM 79 HH22 ARG A 22 -15.525 -10.044 4.887 1.00 0.00 H ATOM 80 HH21 ARG A 22 -14.653 -9.022 3.686 1.00 0.00 H ATOM 81 H ARG A 22 -16.254 -8.748 -4.063 1.00 0.00 H ATOM 82 N PRO A 23 -13.111 -8.724 -3.300 1.00 27.12 N ATOM 83 CA PRO A 23 -12.040 -9.464 -4.000 1.00 23.13 C ATOM 84 C PRO A 23 -11.237 -10.366 -3.074 1.00 27.22 C ATOM 85 O PRO A 23 -10.896 -11.495 -3.450 1.00 27.59 O ATOM 86 CB PRO A 23 -11.165 -8.345 -4.587 1.00 27.43 C ATOM 87 CG PRO A 23 -12.006 -7.093 -4.529 1.00 36.22 C ATOM 88 CD PRO A 23 -12.894 -7.269 -3.336 1.00 30.45 C ATOM 89 N GLY A 24 -10.967 -9.914 -1.846 1.00 27.45 N ATOM 90 CA GLY A 24 -10.143 -10.699 -0.944 1.00 33.95 C ATOM 91 C GLY A 24 -10.759 -12.031 -0.558 1.00 34.77 C ATOM 92 O GLY A 24 -10.037 -12.982 -0.242 1.00 33.05 O ATOM 93 H GLY A 24 -11.348 -8.998 -1.535 1.00 0.00 H ATOM 94 N MET A 25 -12.089 -12.127 -0.584 1.00 31.69 N ATOM 95 CA MET A 25 -12.735 -13.399 -0.296 1.00 34.74 C ATOM 96 C MET A 25 -12.488 -14.429 -1.386 1.00 34.68 C ATOM 97 O MET A 25 -12.653 -15.628 -1.137 1.00 39.38 O ATOM 98 CB MET A 25 -14.234 -13.189 -0.094 1.00 37.01 C ATOM 99 CG MET A 25 -14.557 -12.416 1.163 1.00 37.26 C ATOM 100 SD MET A 25 -14.243 -13.427 2.630 1.00 52.37 S ATOM 101 CE MET A 25 -15.351 -14.798 2.307 1.00 49.30 C ATOM 102 H MET A 25 -12.665 -11.292 -0.810 1.00 0.00 H ATOM 103 N TYR A 26 -12.082 -13.997 -2.577 1.00 28.48 N ATOM 104 CA TYR A 26 -11.852 -14.909 -3.694 1.00 28.14 C ATOM 105 C TYR A 26 -10.378 -15.148 -3.973 1.00 30.88 C ATOM 106 O TYR A 26 -9.969 -16.290 -4.209 1.00 32.71 O ATOM 107 CB TYR A 26 -12.520 -14.371 -4.969 1.00 27.52 C ATOM 108 CG TYR A 26 -14.031 -14.417 -4.915 1.00 30.84 C ATOM 109 CD1 TYR A 26 -14.749 -13.411 -4.276 1.00 29.10 C ATOM 110 CD2 TYR A 26 -14.735 -15.472 -5.475 1.00 31.39 C ATOM 111 CE1 TYR A 26 -16.130 -13.456 -4.205 1.00 32.26 C ATOM 112 CE2 TYR A 26 -16.127 -15.525 -5.411 1.00 35.75 C ATOM 113 CZ TYR A 26 -16.816 -14.513 -4.767 1.00 36.02 C ATOM 114 OH TYR A 26 -18.196 -14.544 -4.687 1.00 39.70 O ATOM 115 HH TYR A 26 -18.515 -13.746 -4.195 1.00 0.00 H ATOM 116 H TYR A 26 -11.924 -12.979 -2.717 1.00 0.00 H ATOM 117 N ILE A 27 -9.566 -14.095 -3.955 1.00 26.76 N ATOM 118 CA ILE A 27 -8.179 -14.186 -4.400 1.00 26.08 C ATOM 119 C ILE A 27 -7.188 -14.146 -3.242 1.00 27.41 C ATOM 120 O ILE A 27 -6.010 -14.493 -3.438 1.00 29.29 O ATOM 121 CB ILE A 27 -7.859 -13.079 -5.433 1.00 28.04 C ATOM 122 CG1 ILE A 27 -6.637 -13.439 -6.281 1.00 25.64 C ATOM 123 CG2 ILE A 27 -7.661 -11.735 -4.752 1.00 24.77 C ATOM 124 CD1 ILE A 27 -6.851 -14.648 -7.137 1.00 30.04 C ATOM 125 H ILE A 27 -9.929 -13.182 -3.615 1.00 0.00 H ATOM 126 N GLY A 28 -7.620 -13.769 -2.047 1.00 30.31 N ATOM 127 CA GLY A 28 -6.705 -13.595 -0.930 1.00 31.85 C ATOM 128 C GLY A 28 -6.393 -12.130 -0.689 1.00 32.48 C ATOM 129 O GLY A 28 -6.811 -11.237 -1.433 1.00 32.36 O ATOM 130 H GLY A 28 -8.635 -13.594 -1.905 1.00 0.00 H ATOM 131 N ASP A 29 -5.623 -11.884 0.373 1.00 30.80 N ATOM 132 CA ASP A 29 -5.422 -10.517 0.847 1.00 35.90 C ATOM 133 C ASP A 29 -4.880 -9.610 -0.251 1.00 33.68 C ATOM 134 O ASP A 29 -3.851 -9.892 -0.867 1.00 31.92 O ATOM 135 CB ASP A 29 -4.478 -10.507 2.050 1.00 42.21 C ATOM 136 CG ASP A 29 -4.512 -9.186 2.800 1.00 42.93 C ATOM 137 OD1 ASP A 29 -3.821 -8.239 2.380 1.00 37.38 O ATOM 138 OD2 ASP A 29 -5.237 -9.095 3.812 1.00 50.11 O ATOM 139 H ASP A 29 -5.161 -12.674 0.868 1.00 0.00 H ATOM 140 N THR A 30 -5.580 -8.504 -0.490 1.00 30.88 N ATOM 141 CA THR A 30 -5.221 -7.597 -1.567 1.00 29.70 C ATOM 142 C THR A 30 -4.277 -6.484 -1.127 1.00 29.07 C ATOM 143 O THR A 30 -3.982 -5.588 -1.921 1.00 31.69 O ATOM 144 CB THR A 30 -6.488 -7.003 -2.174 1.00 28.61 C ATOM 145 OG1 THR A 30 -7.122 -6.182 -1.196 1.00 33.32 O ATOM 146 CG2 THR A 30 -7.442 -8.119 -2.575 1.00 31.61 C ATOM 147 HG1 THR A 30 -6.505 -5.456 -0.926 1.00 0.00 H ATOM 148 H THR A 30 -6.402 -8.284 0.107 1.00 0.00 H ATOM 149 N ASP A 31 -3.754 -6.541 0.103 1.00 39.55 N ATOM 150 CA ASP A 31 -2.820 -5.523 0.561 1.00 40.11 C ATOM 151 C ASP A 31 -1.422 -6.035 0.893 1.00 38.19 C ATOM 152 O ASP A 31 -0.479 -5.236 0.844 1.00 44.23 O ATOM 153 CB ASP A 31 -3.380 -4.784 1.790 1.00 42.33 C ATOM 154 CG ASP A 31 -2.641 -3.482 2.072 1.00 44.49 C ATOM 155 OD1 ASP A 31 -2.857 -2.494 1.334 1.00 39.71 O ATOM 156 OD2 ASP A 31 -1.830 -3.452 3.025 1.00 51.63 O ATOM 157 H ASP A 31 -4.018 -7.321 0.739 1.00 0.00 H ATOM 158 N ASP A 32 -1.241 -7.321 1.209 1.00 37.50 N ATOM 159 CA ASP A 32 0.082 -7.796 1.620 1.00 43.34 C ATOM 160 C ASP A 32 0.816 -8.580 0.533 1.00 41.95 C ATOM 161 O ASP A 32 1.892 -9.126 0.799 1.00 39.35 O ATOM 162 CB ASP A 32 -0.002 -8.627 2.914 1.00 45.30 C ATOM 163 CG ASP A 32 -0.782 -9.924 2.760 1.00 45.98 C ATOM 164 OD1 ASP A 32 -1.073 -10.336 1.623 1.00 41.10 O ATOM 165 OD2 ASP A 32 -1.092 -10.555 3.798 1.00 46.69 O ATOM 166 H ASP A 32 -2.040 -7.985 1.163 1.00 0.00 H ATOM 167 N GLY A 33 0.283 -8.632 -0.685 1.00 35.26 N ATOM 168 CA GLY A 33 0.912 -9.369 -1.764 1.00 33.78 C ATOM 169 C GLY A 33 0.375 -10.771 -1.971 1.00 34.65 C ATOM 170 O GLY A 33 0.650 -11.377 -3.018 1.00 34.65 O ATOM 171 H GLY A 33 -0.609 -8.130 -0.868 1.00 0.00 H ATOM 172 N THR A 34 -0.396 -11.289 -1.017 1.00 32.68 N ATOM 173 CA THR A 34 -0.919 -12.649 -1.100 1.00 32.85 C ATOM 174 C THR A 34 -1.801 -12.822 -2.331 1.00 32.00 C ATOM 175 O THR A 34 -1.522 -13.657 -3.205 1.00 32.22 O ATOM 176 CB THR A 34 -1.701 -12.961 0.181 1.00 36.39 C ATOM 177 OG1 THR A 34 -0.842 -12.761 1.311 1.00 43.33 O ATOM 178 CG2 THR A 34 -2.206 -14.385 0.197 1.00 37.05 C ATOM 179 HG1 THR A 34 -0.534 -11.820 1.327 1.00 0.00 H ATOM 180 H THR A 34 -0.633 -10.707 -0.188 1.00 0.00 H ATOM 181 N GLY A 35 -2.871 -12.027 -2.415 1.00 27.97 N ATOM 182 CA GLY A 35 -3.768 -12.114 -3.559 1.00 24.93 C ATOM 183 C GLY A 35 -3.075 -11.801 -4.868 1.00 26.69 C ATOM 184 O GLY A 35 -3.347 -12.444 -5.890 1.00 26.54 O ATOM 185 H GLY A 35 -3.065 -11.341 -1.658 1.00 0.00 H ATOM 186 N LEU A 36 -2.178 -10.802 -4.861 1.00 25.62 N ATOM 187 CA LEU A 36 -1.468 -10.415 -6.080 1.00 23.13 C ATOM 188 C LEU A 36 -0.766 -11.612 -6.700 1.00 25.23 C ATOM 189 O LEU A 36 -0.871 -11.853 -7.907 1.00 24.21 O ATOM 190 CB LEU A 36 -0.451 -9.309 -5.789 1.00 23.58 C ATOM 191 CG LEU A 36 0.349 -8.783 -6.987 1.00 29.23 C ATOM 192 CD1 LEU A 36 -0.540 -7.931 -7.858 1.00 29.03 C ATOM 193 CD2 LEU A 36 1.616 -8.000 -6.567 1.00 31.76 C ATOM 194 H LEU A 36 -1.985 -10.295 -3.974 1.00 0.00 H ATOM 195 N HIS A 37 -0.058 -12.392 -5.880 1.00 26.26 N ATOM 196 CA HIS A 37 0.658 -13.535 -6.431 1.00 24.84 C ATOM 197 C HIS A 37 -0.280 -14.702 -6.713 1.00 21.64 C ATOM 198 O HIS A 37 -0.034 -15.475 -7.647 1.00 23.69 O ATOM 199 CB HIS A 37 1.808 -13.925 -5.490 1.00 28.33 C ATOM 200 CG HIS A 37 2.883 -12.878 -5.415 1.00 26.42 C ATOM 201 ND1 HIS A 37 2.809 -11.797 -4.562 1.00 26.59 N ATOM 202 CD2 HIS A 37 4.011 -12.705 -6.141 1.00 30.67 C ATOM 203 CE1 HIS A 37 3.864 -11.024 -4.741 1.00 33.26 C ATOM 204 NE2 HIS A 37 4.608 -11.549 -5.698 1.00 30.31 N ATOM 205 H HIS A 37 -0.018 -12.186 -4.861 1.00 0.00 H ATOM 206 N HIS A 38 -1.368 -14.826 -5.949 1.00 24.65 N ATOM 207 CA HIS A 38 -2.366 -15.846 -6.261 1.00 23.64 C ATOM 208 C HIS A 38 -2.983 -15.633 -7.637 1.00 22.66 C ATOM 209 O HIS A 38 -3.398 -16.605 -8.277 1.00 22.88 O ATOM 210 CB HIS A 38 -3.463 -15.883 -5.195 1.00 27.76 C ATOM 211 CG HIS A 38 -2.963 -16.319 -3.859 1.00 46.57 C ATOM 212 ND1 HIS A 38 -3.767 -16.428 -2.751 1.00 50.29 N ATOM 213 CD2 HIS A 38 -1.724 -16.673 -3.451 1.00 48.00 C ATOM 214 CE1 HIS A 38 -3.054 -16.851 -1.721 1.00 49.91 C ATOM 215 NE2 HIS A 38 -1.803 -16.991 -2.115 1.00 45.48 N ATOM 216 H HIS A 38 -1.505 -14.197 -5.132 1.00 0.00 H ATOM 217 N MET A 39 -3.053 -14.385 -8.104 1.00 22.11 N ATOM 218 CA MET A 39 -3.505 -14.138 -9.475 1.00 23.28 C ATOM 219 C MET A 39 -2.710 -14.977 -10.467 1.00 21.87 C ATOM 220 O MET A 39 -3.280 -15.639 -11.348 1.00 23.85 O ATOM 221 CB MET A 39 -3.361 -12.652 -9.817 1.00 22.96 C ATOM 222 CG MET A 39 -4.255 -11.711 -8.997 1.00 23.01 C ATOM 223 SD MET A 39 -5.946 -11.537 -9.641 1.00 22.52 S ATOM 224 CE MET A 39 -5.637 -10.419 -11.008 1.00 21.60 C ATOM 225 H MET A 39 -2.786 -13.586 -7.493 1.00 0.00 H ATOM 226 N VAL A 40 -1.378 -14.949 -10.337 1.00 21.45 N ATOM 227 CA VAL A 40 -0.516 -15.748 -11.207 1.00 19.93 C ATOM 228 C VAL A 40 -0.812 -17.228 -11.037 1.00 20.75 C ATOM 229 O VAL A 40 -0.932 -17.970 -12.016 1.00 20.32 O ATOM 230 CB VAL A 40 0.969 -15.442 -10.935 1.00 19.75 C ATOM 231 CG1 VAL A 40 1.883 -16.324 -11.828 1.00 22.69 C ATOM 232 CG2 VAL A 40 1.246 -13.973 -11.175 1.00 18.99 C ATOM 233 H VAL A 40 -0.949 -14.348 -9.604 1.00 0.00 H ATOM 234 N PHE A 41 -0.904 -17.693 -9.790 1.00 20.31 N ATOM 235 CA PHE A 41 -1.085 -19.127 -9.576 1.00 22.98 C ATOM 236 C PHE A 41 -2.386 -19.643 -10.206 1.00 20.77 C ATOM 237 O PHE A 41 -2.422 -20.761 -10.729 1.00 21.40 O ATOM 238 CB PHE A 41 -1.014 -19.428 -8.075 1.00 21.38 C ATOM 239 CG PHE A 41 0.295 -18.984 -7.441 1.00 20.10 C ATOM 240 CD1 PHE A 41 1.460 -18.945 -8.200 1.00 27.15 C ATOM 241 CD2 PHE A 41 0.354 -18.603 -6.109 1.00 22.96 C ATOM 242 CE1 PHE A 41 2.657 -18.530 -7.653 1.00 27.14 C ATOM 243 CE2 PHE A 41 1.562 -18.205 -5.547 1.00 22.60 C ATOM 244 CZ PHE A 41 2.710 -18.165 -6.319 1.00 28.20 C ATOM 245 H PHE A 41 -0.848 -17.043 -8.980 1.00 0.00 H ATOM 246 N GLU A 42 -3.469 -18.851 -10.165 1.00 21.81 N ATOM 247 CA GLU A 42 -4.723 -19.300 -10.771 1.00 23.13 C ATOM 248 C GLU A 42 -4.574 -19.457 -12.281 1.00 22.63 C ATOM 249 O GLU A 42 -5.134 -20.386 -12.878 1.00 24.18 O ATOM 250 CB GLU A 42 -5.851 -18.315 -10.459 1.00 23.69 C ATOM 251 CG GLU A 42 -6.324 -18.350 -9.010 1.00 27.62 C ATOM 252 CD GLU A 42 -6.894 -19.701 -8.625 1.00 37.69 C ATOM 253 OE1 GLU A 42 -7.681 -20.259 -9.416 1.00 33.10 O ATOM 254 OE2 GLU A 42 -6.545 -20.215 -7.546 1.00 38.89 O ATOM 255 H GLU A 42 -3.417 -17.920 -9.704 1.00 0.00 H ATOM 256 N VAL A 43 -3.846 -18.542 -12.920 1.00 21.54 N ATOM 257 CA VAL A 43 -3.628 -18.677 -14.357 1.00 21.00 C ATOM 258 C VAL A 43 -2.761 -19.899 -14.643 1.00 21.07 C ATOM 259 O VAL A 43 -3.033 -20.671 -15.574 1.00 21.78 O ATOM 260 CB VAL A 43 -3.017 -17.391 -14.949 1.00 19.14 C ATOM 261 CG1 VAL A 43 -2.857 -17.540 -16.475 1.00 19.33 C ATOM 262 CG2 VAL A 43 -3.916 -16.170 -14.645 1.00 18.18 C ATOM 263 H VAL A 43 -3.437 -17.740 -12.400 1.00 0.00 H ATOM 264 N VAL A 44 -1.735 -20.105 -13.840 1.00 20.58 N ATOM 265 CA VAL A 44 -0.860 -21.235 -14.050 1.00 19.52 C ATOM 266 C VAL A 44 -1.610 -22.570 -13.934 1.00 20.07 C ATOM 267 O VAL A 44 -1.308 -23.502 -14.611 1.00 21.14 O ATOM 268 CB VAL A 44 0.362 -21.194 -13.118 1.00 21.51 C ATOM 269 CG1 VAL A 44 1.122 -22.486 -13.119 1.00 24.02 C ATOM 270 CG2 VAL A 44 1.219 -20.011 -13.457 1.00 20.28 C ATOM 271 H VAL A 44 -1.555 -19.451 -13.052 1.00 0.00 H ATOM 272 N ASP A 45 -2.585 -22.624 -13.056 1.00 20.77 N ATOM 273 CA ASP A 45 -3.360 -23.831 -12.884 1.00 21.02 C ATOM 274 C ASP A 45 -4.004 -24.205 -14.216 1.00 23.22 C ATOM 275 O ASP A 45 -4.016 -25.324 -14.591 1.00 24.84 O ATOM 276 CB ASP A 45 -4.426 -23.674 -11.800 1.00 24.82 C ATOM 277 CG ASP A 45 -3.925 -24.061 -10.384 1.00 35.57 C ATOM 278 OD1 ASP A 45 -2.886 -24.719 -10.265 1.00 35.17 O ATOM 279 OD2 ASP A 45 -4.611 -23.740 -9.398 1.00 34.14 O ATOM 280 H ASP A 45 -2.802 -21.788 -12.477 1.00 0.00 H ATOM 281 N ASN A 46 -4.547 -23.217 -14.892 1.00 20.45 N ATOM 282 CA ASN A 46 -5.226 -23.456 -16.149 1.00 22.45 C ATOM 283 C ASN A 46 -4.212 -23.814 -17.225 1.00 21.49 C ATOM 284 O ASN A 46 -4.468 -24.680 -17.994 1.00 25.64 O ATOM 285 CB ASN A 46 -6.075 -22.265 -16.570 1.00 24.96 C ATOM 286 CG ASN A 46 -7.379 -22.669 -17.175 1.00 36.22 C ATOM 287 OD1 ASN A 46 -7.431 -23.567 -18.010 1.00 34.35 O ATOM 288 ND2 ASN A 46 -8.436 -22.054 -16.736 1.00 30.72 N ATOM 289 HD22 ASN A 46 -8.341 -21.299 -16.027 1.00 0.00 H ATOM 290 HD21 ASN A 46 -9.377 -22.317 -17.093 1.00 0.00 H ATOM 291 H ASN A 46 -4.488 -22.248 -14.518 1.00 0.00 H ATOM 292 N ALA A 47 -3.065 -23.166 -17.230 1.00 19.51 N ATOM 293 CA ALA A 47 -1.990 -23.481 -18.170 1.00 19.34 C ATOM 294 C ALA A 47 -1.463 -24.906 -17.992 1.00 22.51 C ATOM 295 O ALA A 47 -1.167 -25.594 -18.979 1.00 24.45 O ATOM 296 CB ALA A 47 -0.848 -22.476 -18.008 1.00 21.22 C ATOM 297 H ALA A 47 -2.919 -22.402 -16.540 1.00 0.00 H ATOM 298 N ILE A 48 -1.318 -25.366 -16.744 1.00 22.61 N ATOM 299 CA ILE A 48 -0.841 -26.734 -16.529 1.00 24.18 C ATOM 300 C ILE A 48 -1.861 -27.755 -17.038 1.00 23.45 C ATOM 301 O ILE A 48 -1.491 -28.754 -17.675 1.00 27.77 O ATOM 302 CB ILE A 48 -0.507 -26.946 -15.042 1.00 26.54 C ATOM 303 CG1 ILE A 48 0.814 -26.249 -14.721 1.00 26.51 C ATOM 304 CG2 ILE A 48 -0.422 -28.444 -14.711 1.00 31.70 C ATOM 305 CD1 ILE A 48 1.162 -26.248 -13.227 1.00 29.84 C ATOM 306 H ILE A 48 -1.543 -24.756 -15.932 1.00 0.00 H ATOM 307 N ASP A 49 -3.149 -27.525 -16.773 1.00 24.09 N ATOM 308 CA ASP A 49 -4.182 -28.411 -17.303 1.00 27.43 C ATOM 309 C ASP A 49 -4.110 -28.490 -18.826 1.00 29.47 C ATOM 310 O ASP A 49 -4.265 -29.573 -19.407 1.00 27.31 O ATOM 311 CB ASP A 49 -5.566 -27.933 -16.854 1.00 26.93 C ATOM 312 CG ASP A 49 -6.679 -28.904 -17.226 1.00 32.04 C ATOM 313 OD1 ASP A 49 -6.612 -30.082 -16.813 1.00 37.38 O ATOM 314 OD2 ASP A 49 -7.628 -28.486 -17.926 1.00 32.35 O ATOM 315 H ASP A 49 -3.418 -26.710 -16.186 1.00 0.00 H ATOM 316 N GLU A 50 -3.874 -27.352 -19.491 1.00 24.97 N ATOM 317 CA GLU A 50 -3.769 -27.354 -20.950 1.00 26.80 C ATOM 318 C GLU A 50 -2.502 -28.048 -21.427 1.00 29.89 C ATOM 319 O GLU A 50 -2.529 -28.782 -22.428 1.00 31.39 O ATOM 320 CB GLU A 50 -3.809 -25.918 -21.488 1.00 25.01 C ATOM 321 CG GLU A 50 -5.196 -25.306 -21.458 1.00 28.61 C ATOM 322 CD GLU A 50 -6.160 -26.054 -22.355 1.00 34.39 C ATOM 323 OE1 GLU A 50 -7.175 -26.580 -21.843 1.00 34.64 O ATOM 324 OE2 GLU A 50 -5.879 -26.129 -23.574 1.00 29.27 O ATOM 325 H GLU A 50 -3.765 -26.461 -18.967 1.00 0.00 H ATOM 326 N ALA A 51 -1.375 -27.796 -20.756 1.00 26.80 N ATOM 327 CA ALA A 51 -0.117 -28.403 -21.172 1.00 27.73 C ATOM 328 C ALA A 51 -0.174 -29.918 -21.053 1.00 31.11 C ATOM 329 O ALA A 51 0.368 -30.633 -21.900 1.00 35.54 O ATOM 330 CB ALA A 51 1.043 -27.845 -20.344 1.00 29.10 C ATOM 331 H ALA A 51 -1.395 -27.163 -19.931 1.00 0.00 H ATOM 332 N LEU A 52 -0.836 -30.424 -20.012 1.00 26.32 N ATOM 333 CA LEU A 52 -0.902 -31.867 -19.802 1.00 33.87 C ATOM 334 C LEU A 52 -1.646 -32.580 -20.923 1.00 35.40 C ATOM 335 O LEU A 52 -1.417 -33.775 -21.153 1.00 33.50 O ATOM 336 CB LEU A 52 -1.568 -32.173 -18.460 1.00 31.58 C ATOM 337 CG LEU A 52 -0.677 -31.932 -17.247 1.00 32.96 C ATOM 338 CD1 LEU A 52 -1.514 -31.905 -16.002 1.00 33.38 C ATOM 339 CD2 LEU A 52 0.356 -33.038 -17.144 1.00 43.41 C ATOM 340 H LEU A 52 -1.310 -29.784 -19.343 1.00 0.00 H ATOM 341 N ALA A 53 -2.543 -31.883 -21.618 1.00 32.59 N ATOM 342 CA ALA A 53 -3.328 -32.498 -22.683 1.00 39.15 C ATOM 343 C ALA A 53 -2.646 -32.446 -24.047 1.00 38.19 C ATOM 344 O ALA A 53 -3.224 -32.929 -25.022 1.00 41.74 O ATOM 345 CB ALA A 53 -4.713 -31.838 -22.775 1.00 36.32 C ATOM 346 H ALA A 53 -2.687 -30.877 -21.397 1.00 0.00 H ATOM 347 N GLY A 54 -1.443 -31.876 -24.146 1.00 33.66 N ATOM 348 CA GLY A 54 -0.719 -31.789 -25.392 1.00 32.49 C ATOM 349 C GLY A 54 0.547 -32.629 -25.380 1.00 42.00 C ATOM 350 O GLY A 54 0.812 -33.397 -24.453 1.00 40.56 O ATOM 351 H GLY A 54 -1.009 -31.478 -23.289 1.00 0.00 H ATOM 352 N HIS A 55 1.347 -32.455 -26.435 1.00 34.01 N ATOM 353 CA HIS A 55 2.518 -33.303 -26.647 1.00 33.72 C ATOM 354 C HIS A 55 3.783 -32.798 -25.952 1.00 41.62 C ATOM 355 O HIS A 55 4.479 -33.583 -25.299 1.00 38.08 O ATOM 356 CB HIS A 55 2.775 -33.468 -28.146 1.00 39.03 C ATOM 357 CG HIS A 55 1.704 -34.240 -28.850 1.00 47.21 C ATOM 358 ND1 HIS A 55 1.675 -35.618 -28.874 1.00 43.28 N ATOM 359 CD2 HIS A 55 0.613 -33.827 -29.539 1.00 49.15 C ATOM 360 CE1 HIS A 55 0.614 -36.021 -29.552 1.00 44.29 C ATOM 361 NE2 HIS A 55 -0.044 -34.955 -29.971 1.00 46.02 N ATOM 362 H HIS A 55 1.132 -31.701 -27.119 1.00 0.00 H ATOM 363 N CYS A 56 4.123 -31.512 -26.099 1.00 37.48 N ATOM 364 CA CYS A 56 5.411 -31.042 -25.585 1.00 38.10 C ATOM 365 C CYS A 56 5.369 -30.692 -24.097 1.00 39.43 C ATOM 366 O CYS A 56 6.394 -30.795 -23.412 1.00 39.61 O ATOM 367 CB CYS A 56 5.892 -29.843 -26.402 1.00 37.72 C ATOM 368 SG CYS A 56 6.321 -30.261 -28.124 1.00 50.83 S ATOM 369 H CYS A 56 3.477 -30.851 -26.575 1.00 0.00 H ATOM 370 N LYS A 57 4.214 -30.264 -23.590 1.00 34.68 N ATOM 371 CA LYS A 57 3.986 -30.062 -22.158 1.00 33.44 C ATOM 372 C LYS A 57 4.965 -29.049 -21.555 1.00 33.27 C ATOM 373 O LYS A 57 5.673 -29.348 -20.594 1.00 33.28 O ATOM 374 CB LYS A 57 4.080 -31.395 -21.399 1.00 34.03 C ATOM 375 CG LYS A 57 3.198 -32.519 -21.932 1.00 38.75 C ATOM 376 CD LYS A 57 3.348 -33.751 -21.048 1.00 39.10 C ATOM 377 CE LYS A 57 2.125 -34.637 -21.116 1.00 44.33 C ATOM 378 NZ LYS A 57 1.866 -35.118 -22.491 1.00 41.86 N ATOM 379 HZ1 LYS A 57 1.713 -34.303 -23.119 1.00 0.00 H ATOM 380 HZ2 LYS A 57 2.684 -35.666 -22.825 1.00 0.00 H ATOM 381 HZ3 LYS A 57 1.019 -35.722 -22.492 1.00 0.00 H ATOM 382 H LYS A 57 3.433 -30.063 -24.246 1.00 0.00 H ATOM 383 N GLU A 58 4.995 -27.836 -22.114 1.00 27.94 N ATOM 384 CA GLU A 58 5.782 -26.760 -21.507 1.00 27.95 C ATOM 385 C GLU A 58 4.925 -25.515 -21.310 1.00 26.50 C ATOM 386 O GLU A 58 4.136 -25.147 -22.189 1.00 25.01 O ATOM 387 CB GLU A 58 7.031 -26.391 -22.340 1.00 30.05 C ATOM 388 CG GLU A 58 7.844 -25.202 -21.745 1.00 29.77 C ATOM 389 CD GLU A 58 9.247 -25.047 -22.335 1.00 43.05 C ATOM 390 OE1 GLU A 58 10.194 -25.686 -21.819 1.00 38.27 O ATOM 391 OE2 GLU A 58 9.401 -24.282 -23.320 1.00 40.93 O ATOM 392 H GLU A 58 4.457 -27.655 -22.985 1.00 0.00 H ATOM 393 N ILE A 59 5.108 -24.851 -20.161 1.00 24.38 N ATOM 394 CA ILE A 59 4.503 -23.550 -19.892 1.00 21.58 C ATOM 395 C ILE A 59 5.617 -22.542 -19.634 1.00 25.62 C ATOM 396 O ILE A 59 6.707 -22.903 -19.178 1.00 24.02 O ATOM 397 CB ILE A 59 3.506 -23.591 -18.705 1.00 22.18 C ATOM 398 CG1 ILE A 59 4.260 -23.767 -17.383 1.00 27.74 C ATOM 399 CG2 ILE A 59 2.511 -24.717 -18.868 1.00 23.59 C ATOM 400 CD1 ILE A 59 3.446 -23.371 -16.141 1.00 27.29 C ATOM 401 H ILE A 59 5.708 -25.281 -19.428 1.00 0.00 H ATOM 402 N ILE A 60 5.360 -21.275 -19.973 1.00 23.96 N ATOM 403 CA ILE A 60 6.318 -20.196 -19.728 1.00 24.47 C ATOM 404 C ILE A 60 5.613 -19.086 -18.965 1.00 23.85 C ATOM 405 O ILE A 60 4.585 -18.578 -19.425 1.00 22.40 O ATOM 406 CB ILE A 60 6.918 -19.637 -21.028 1.00 25.92 C ATOM 407 CG1 ILE A 60 7.558 -20.773 -21.835 1.00 29.78 C ATOM 408 CG2 ILE A 60 7.911 -18.498 -20.706 1.00 27.52 C ATOM 409 CD1 ILE A 60 8.128 -20.329 -23.170 1.00 37.75 C ATOM 410 H ILE A 60 4.451 -21.049 -20.425 1.00 0.00 H ATOM 411 N VAL A 61 6.165 -18.705 -17.810 1.00 21.91 N ATOM 412 CA VAL A 61 5.643 -17.614 -16.988 1.00 21.41 C ATOM 413 C VAL A 61 6.632 -16.461 -17.088 1.00 25.61 C ATOM 414 O VAL A 61 7.820 -16.629 -16.784 1.00 24.83 O ATOM 415 CB VAL A 61 5.435 -18.049 -15.521 1.00 19.34 C ATOM 416 CG1 VAL A 61 4.905 -16.895 -14.663 1.00 21.11 C ATOM 417 CG2 VAL A 61 4.493 -19.222 -15.446 1.00 22.68 C ATOM 418 H VAL A 61 7.011 -19.211 -17.478 1.00 0.00 H ATOM 419 N THR A 62 6.154 -15.294 -17.521 1.00 26.09 N ATOM 420 CA THR A 62 7.012 -14.139 -17.793 1.00 26.28 C ATOM 421 C THR A 62 6.556 -12.955 -16.952 1.00 30.97 C ATOM 422 O THR A 62 5.379 -12.590 -16.983 1.00 26.83 O ATOM 423 CB THR A 62 6.983 -13.762 -19.286 1.00 23.35 C ATOM 424 OG1 THR A 62 7.340 -14.899 -20.082 1.00 27.37 O ATOM 425 CG2 THR A 62 7.954 -12.615 -19.574 1.00 28.63 C ATOM 426 HG1 THR A 62 6.695 -15.632 -19.917 1.00 0.00 H ATOM 427 H THR A 62 5.129 -15.200 -17.672 1.00 0.00 H ATOM 428 N ILE A 63 7.477 -12.365 -16.187 1.00 24.62 N ATOM 429 CA ILE A 63 7.200 -11.109 -15.496 1.00 25.75 C ATOM 430 C ILE A 63 7.684 -9.989 -16.399 1.00 25.41 C ATOM 431 O ILE A 63 8.884 -9.891 -16.680 1.00 29.53 O ATOM 432 CB ILE A 63 7.901 -11.032 -14.134 1.00 26.92 C ATOM 433 CG1 ILE A 63 7.646 -12.282 -13.304 1.00 26.57 C ATOM 434 CG2 ILE A 63 7.466 -9.771 -13.400 1.00 29.36 C ATOM 435 CD1 ILE A 63 8.433 -12.275 -12.016 1.00 27.96 C ATOM 436 H ILE A 63 8.411 -12.809 -16.081 1.00 0.00 H ATOM 437 N HIS A 64 6.759 -9.152 -16.857 1.00 28.68 N ATOM 438 CA HIS A 64 7.125 -8.070 -17.757 1.00 28.02 C ATOM 439 C HIS A 64 7.527 -6.827 -16.970 1.00 24.97 C ATOM 440 O HIS A 64 7.257 -6.699 -15.771 1.00 30.61 O ATOM 441 CB HIS A 64 5.974 -7.760 -18.715 1.00 29.19 C ATOM 442 CG HIS A 64 5.608 -8.917 -19.593 1.00 25.98 C ATOM 443 ND1 HIS A 64 6.023 -9.022 -20.904 1.00 27.18 N ATOM 444 CD2 HIS A 64 4.888 -10.038 -19.335 1.00 25.98 C ATOM 445 CE1 HIS A 64 5.555 -10.144 -21.424 1.00 29.60 C ATOM 446 NE2 HIS A 64 4.868 -10.781 -20.491 1.00 29.28 N ATOM 447 H HIS A 64 5.767 -9.272 -16.570 1.00 0.00 H ATOM 448 N ALA A 65 8.203 -5.911 -17.675 1.00 34.79 N ATOM 449 CA ALA A 65 8.745 -4.702 -17.070 1.00 33.24 C ATOM 450 C ALA A 65 7.673 -3.758 -16.543 1.00 36.07 C ATOM 451 O ALA A 65 7.962 -2.969 -15.641 1.00 40.78 O ATOM 452 CB ALA A 65 9.630 -3.967 -18.085 1.00 36.49 C ATOM 453 H ALA A 65 8.346 -6.069 -18.693 1.00 0.00 H ATOM 454 N ASP A 66 6.450 -3.807 -17.076 1.00 32.93 N ATOM 455 CA ASP A 66 5.356 -2.994 -16.561 1.00 34.47 C ATOM 456 C ASP A 66 4.571 -3.715 -15.463 1.00 30.95 C ATOM 457 O ASP A 66 3.448 -3.307 -15.139 1.00 33.52 O ATOM 458 CB ASP A 66 4.441 -2.557 -17.711 1.00 34.76 C ATOM 459 CG ASP A 66 3.839 -3.725 -18.476 1.00 35.21 C ATOM 460 OD1 ASP A 66 4.182 -4.891 -18.180 1.00 31.37 O ATOM 461 OD2 ASP A 66 3.017 -3.469 -19.388 1.00 33.24 O ATOM 462 H ASP A 66 6.273 -4.442 -17.880 1.00 0.00 H ATOM 463 N ASN A 67 5.182 -4.753 -14.881 1.00 31.82 N ATOM 464 CA ASN A 67 4.564 -5.604 -13.862 1.00 35.64 C ATOM 465 C ASN A 67 3.195 -6.127 -14.290 1.00 36.72 C ATOM 466 O ASN A 67 2.239 -6.146 -13.509 1.00 35.68 O ATOM 467 CB ASN A 67 4.491 -4.894 -12.515 1.00 36.84 C ATOM 468 CG ASN A 67 5.750 -5.105 -11.699 1.00 40.41 C ATOM 469 OD1 ASN A 67 5.877 -6.102 -10.985 1.00 36.96 O ATOM 470 ND2 ASN A 67 6.705 -4.193 -11.835 1.00 34.36 N ATOM 471 HD22 ASN A 67 6.552 -3.368 -12.449 1.00 0.00 H ATOM 472 HD21 ASN A 67 7.606 -4.304 -11.327 1.00 0.00 H ATOM 473 H ASN A 67 6.157 -4.969 -15.170 1.00 0.00 H ATOM 474 N SER A 68 3.107 -6.560 -15.534 1.00 28.28 N ATOM 475 CA SER A 68 2.086 -7.515 -15.935 1.00 24.67 C ATOM 476 C SER A 68 2.753 -8.889 -15.933 1.00 24.02 C ATOM 477 O SER A 68 3.981 -8.992 -15.904 1.00 26.42 O ATOM 478 CB SER A 68 1.527 -7.177 -17.316 1.00 24.93 C ATOM 479 OG SER A 68 2.585 -7.035 -18.233 1.00 25.16 O ATOM 480 HG SER A 68 3.184 -6.306 -17.933 1.00 0.00 H ATOM 481 H SER A 68 3.783 -6.210 -16.243 1.00 0.00 H ATOM 482 N VAL A 69 1.945 -9.950 -15.941 1.00 20.63 N ATOM 483 CA VAL A 69 2.472 -11.309 -16.053 1.00 19.35 C ATOM 484 C VAL A 69 1.797 -11.991 -17.238 1.00 23.92 C ATOM 485 O VAL A 69 0.595 -11.819 -17.459 1.00 23.07 O ATOM 486 CB VAL A 69 2.279 -12.108 -14.745 1.00 19.66 C ATOM 487 CG1 VAL A 69 2.490 -13.603 -14.966 1.00 23.09 C ATOM 488 CG2 VAL A 69 3.248 -11.590 -13.698 1.00 21.89 C ATOM 489 H VAL A 69 0.918 -9.807 -15.866 1.00 0.00 H ATOM 490 N SER A 70 2.577 -12.728 -18.031 1.00 22.87 N ATOM 491 CA SER A 70 1.992 -13.616 -19.018 1.00 20.68 C ATOM 492 C SER A 70 2.311 -15.074 -18.704 1.00 22.08 C ATOM 493 O SER A 70 3.356 -15.410 -18.124 1.00 21.81 O ATOM 494 CB SER A 70 2.447 -13.257 -20.432 1.00 21.72 C ATOM 495 OG SER A 70 3.819 -13.502 -20.585 1.00 25.32 O ATOM 496 HG SER A 70 4.002 -14.461 -20.422 1.00 0.00 H ATOM 497 H SER A 70 3.611 -12.665 -17.941 1.00 0.00 H ATOM 498 N VAL A 71 1.371 -15.933 -19.077 1.00 21.90 N ATOM 499 CA VAL A 71 1.452 -17.377 -18.899 1.00 21.25 C ATOM 500 C VAL A 71 1.033 -17.994 -20.222 1.00 24.25 C ATOM 501 O VAL A 71 -0.032 -17.656 -20.746 1.00 23.06 O ATOM 502 CB VAL A 71 0.525 -17.879 -17.775 1.00 20.49 C ATOM 503 CG1 VAL A 71 0.689 -19.394 -17.602 1.00 18.89 C ATOM 504 CG2 VAL A 71 0.780 -17.104 -16.442 1.00 19.50 C ATOM 505 H VAL A 71 0.516 -15.549 -19.528 1.00 0.00 H ATOM 506 N GLN A 72 1.860 -18.878 -20.767 1.00 22.09 N ATOM 507 CA GLN A 72 1.544 -19.507 -22.039 1.00 23.20 C ATOM 508 C GLN A 72 1.788 -21.002 -21.967 1.00 24.59 C ATOM 509 O GLN A 72 2.622 -21.469 -21.194 1.00 23.82 O ATOM 510 CB GLN A 72 2.375 -18.906 -23.176 1.00 24.02 C ATOM 511 CG GLN A 72 3.876 -19.022 -23.002 1.00 25.27 C ATOM 512 CD GLN A 72 4.612 -18.170 -24.019 1.00 35.46 C ATOM 513 OE1 GLN A 72 4.647 -18.493 -25.215 1.00 32.10 O ATOM 514 NE2 GLN A 72 5.178 -17.062 -23.560 1.00 30.83 N ATOM 515 HE22 GLN A 72 5.123 -16.831 -22.547 1.00 0.00 H ATOM 516 HE21 GLN A 72 5.677 -16.424 -24.213 1.00 0.00 H ATOM 517 H GLN A 72 2.745 -19.123 -20.278 1.00 0.00 H ATOM 518 N ASP A 73 1.047 -21.755 -22.782 1.00 21.68 N ATOM 519 CA ASP A 73 1.258 -23.193 -22.882 1.00 24.86 C ATOM 520 C ASP A 73 1.256 -23.596 -24.343 1.00 25.13 C ATOM 521 O ASP A 73 0.704 -22.903 -25.197 1.00 25.36 O ATOM 522 CB ASP A 73 0.188 -24.010 -22.147 1.00 22.21 C ATOM 523 CG ASP A 73 -1.170 -23.946 -22.845 1.00 27.56 C ATOM 524 OD1 ASP A 73 -1.467 -24.786 -23.729 1.00 27.85 O ATOM 525 OD2 ASP A 73 -1.950 -23.042 -22.506 1.00 27.38 O ATOM 526 H ASP A 73 0.305 -21.307 -23.357 1.00 0.00 H ATOM 527 N ASP A 74 1.864 -24.750 -24.610 1.00 24.20 N ATOM 528 CA ASP A 74 1.922 -25.302 -25.961 1.00 26.82 C ATOM 529 C ASP A 74 0.920 -26.429 -26.173 1.00 31.71 C ATOM 530 O ASP A 74 1.166 -27.322 -26.992 1.00 28.57 O ATOM 531 CB ASP A 74 3.340 -25.773 -26.282 1.00 34.36 C ATOM 532 CG ASP A 74 3.883 -26.766 -25.267 1.00 31.29 C ATOM 533 OD1 ASP A 74 3.091 -27.353 -24.497 1.00 34.31 O ATOM 534 OD2 ASP A 74 5.117 -26.964 -25.252 1.00 37.63 O ATOM 535 H ASP A 74 2.312 -25.275 -23.832 1.00 0.00 H ATOM 536 N GLY A 75 -0.215 -26.396 -25.462 1.00 25.77 N ATOM 537 CA GLY A 75 -1.241 -27.415 -25.568 1.00 23.34 C ATOM 538 C GLY A 75 -2.111 -27.248 -26.799 1.00 25.71 C ATOM 539 O GLY A 75 -1.680 -26.704 -27.824 1.00 26.47 O ATOM 540 H GLY A 75 -0.367 -25.604 -24.805 1.00 0.00 H ATOM 541 N ARG A 76 -3.354 -27.725 -26.694 1.00 26.80 N ATOM 542 CA ARG A 76 -4.270 -27.817 -27.831 1.00 26.37 C ATOM 543 C ARG A 76 -5.008 -26.519 -28.126 1.00 30.48 C ATOM 544 O ARG A 76 -5.659 -26.431 -29.177 1.00 33.90 O ATOM 545 CB ARG A 76 -5.319 -28.908 -27.574 1.00 32.74 C ATOM 546 CG ARG A 76 -4.777 -30.221 -27.013 1.00 41.66 C ATOM 547 CD ARG A 76 -4.662 -31.254 -28.106 1.00 45.32 C ATOM 548 NE ARG A 76 -4.017 -32.495 -27.669 1.00 43.86 N ATOM 549 CZ ARG A 76 -3.495 -33.385 -28.512 1.00 49.84 C ATOM 550 NH1 ARG A 76 -3.542 -33.156 -29.818 1.00 46.73 N ATOM 551 NH2 ARG A 76 -2.921 -34.495 -28.061 1.00 41.93 N ATOM 552 HE ARG A 76 -3.964 -32.691 -26.649 1.00 0.00 H ATOM 553 HH12 ARG A 76 -3.137 -33.846 -30.482 1.00 0.00 H ATOM 554 HH11 ARG A 76 -3.984 -32.286 -30.178 1.00 0.00 H ATOM 555 HH22 ARG A 76 -2.518 -35.181 -28.731 1.00 0.00 H ATOM 556 HH21 ARG A 76 -2.875 -34.678 -27.038 1.00 0.00 H ATOM 557 H ARG A 76 -3.686 -28.046 -25.762 1.00 0.00 H ATOM 558 N GLY A 77 -4.931 -25.523 -27.236 1.00 25.62 N ATOM 559 CA GLY A 77 -5.789 -24.351 -27.335 1.00 27.94 C ATOM 560 C GLY A 77 -7.124 -24.475 -26.614 1.00 26.33 C ATOM 561 O GLY A 77 -7.825 -25.481 -26.739 1.00 26.97 O ATOM 562 H GLY A 77 -4.244 -25.587 -26.458 1.00 0.00 H ATOM 563 N ILE A 78 -7.484 -23.450 -25.843 1.00 24.99 N ATOM 564 CA ILE A 78 -8.806 -23.394 -25.206 1.00 25.61 C ATOM 565 C ILE A 78 -9.887 -23.395 -26.287 1.00 27.05 C ATOM 566 O ILE A 78 -9.693 -22.780 -27.353 1.00 25.88 O ATOM 567 CB ILE A 78 -8.902 -22.140 -24.309 1.00 26.89 C ATOM 568 CG1 ILE A 78 -8.068 -22.338 -23.042 1.00 23.24 C ATOM 569 CG2 ILE A 78 -10.336 -21.796 -23.942 1.00 28.74 C ATOM 570 CD1 ILE A 78 -8.633 -23.401 -22.106 1.00 25.28 C ATOM 571 H ILE A 78 -6.813 -22.671 -25.689 1.00 0.00 H ATOM 572 N PRO A 79 -11.010 -24.089 -26.101 1.00 29.19 N ATOM 573 CA PRO A 79 -12.029 -24.140 -27.154 1.00 31.52 C ATOM 574 C PRO A 79 -12.596 -22.763 -27.448 1.00 31.12 C ATOM 575 O PRO A 79 -12.704 -21.907 -26.568 1.00 32.21 O ATOM 576 CB PRO A 79 -13.099 -25.070 -26.572 1.00 30.54 C ATOM 577 CG PRO A 79 -12.364 -25.902 -25.565 1.00 44.48 C ATOM 578 CD PRO A 79 -11.327 -24.994 -24.979 1.00 35.03 C ATOM 579 N THR A 80 -12.969 -22.561 -28.703 1.00 30.00 N ATOM 580 CA THR A 80 -13.360 -21.246 -29.175 1.00 31.16 C ATOM 581 C THR A 80 -14.797 -21.170 -29.674 1.00 37.27 C ATOM 582 O THR A 80 -15.314 -20.057 -29.833 1.00 32.20 O ATOM 583 CB THR A 80 -12.410 -20.789 -30.295 1.00 27.58 C ATOM 584 OG1 THR A 80 -12.467 -21.728 -31.377 1.00 32.41 O ATOM 585 CG2 THR A 80 -10.975 -20.743 -29.782 1.00 29.30 C ATOM 586 HG1 THR A 80 -13.393 -21.773 -31.725 1.00 0.00 H ATOM 587 H THR A 80 -12.982 -23.363 -29.365 1.00 0.00 H ATOM 588 N GLY A 81 -15.462 -22.306 -29.906 1.00 32.81 N ATOM 589 CA GLY A 81 -16.796 -22.279 -30.479 1.00 28.79 C ATOM 590 C GLY A 81 -17.830 -21.652 -29.561 1.00 32.99 C ATOM 591 O GLY A 81 -17.659 -21.557 -28.342 1.00 30.51 O ATOM 592 H GLY A 81 -15.020 -23.218 -29.674 1.00 0.00 H ATOM 593 N ILE A 82 -18.945 -21.230 -30.169 1.00 29.73 N ATOM 594 CA ILE A 82 -20.006 -20.583 -29.409 1.00 28.35 C ATOM 595 C ILE A 82 -20.626 -21.577 -28.441 1.00 35.83 C ATOM 596 O ILE A 82 -21.000 -22.692 -28.825 1.00 33.78 O ATOM 597 CB ILE A 82 -21.082 -19.992 -30.335 1.00 26.37 C ATOM 598 CG1 ILE A 82 -20.508 -18.890 -31.219 1.00 30.57 C ATOM 599 CG2 ILE A 82 -22.233 -19.440 -29.508 1.00 33.21 C ATOM 600 CD1 ILE A 82 -19.994 -17.690 -30.442 1.00 29.08 C ATOM 601 H ILE A 82 -19.055 -21.365 -31.194 1.00 0.00 H ATOM 602 N HIS A 83 -20.755 -21.164 -27.187 1.00 29.12 N ATOM 603 CA HIS A 83 -21.386 -21.995 -26.175 1.00 32.82 C ATOM 604 C HIS A 83 -22.889 -22.006 -26.419 1.00 31.10 C ATOM 605 O HIS A 83 -23.505 -20.937 -26.482 1.00 33.03 O ATOM 606 CB HIS A 83 -21.060 -21.452 -24.782 1.00 35.78 C ATOM 607 CG HIS A 83 -21.579 -22.290 -23.650 1.00 36.45 C ATOM 608 ND1 HIS A 83 -22.903 -22.294 -23.268 1.00 36.92 N ATOM 609 CD2 HIS A 83 -20.939 -23.121 -22.792 1.00 40.02 C ATOM 610 CE1 HIS A 83 -23.062 -23.107 -22.238 1.00 37.41 C ATOM 611 NE2 HIS A 83 -21.885 -23.621 -21.929 1.00 36.25 N ATOM 612 H HIS A 83 -20.397 -20.224 -26.922 1.00 0.00 H ATOM 613 N PRO A 84 -23.512 -23.181 -26.555 1.00 37.43 N ATOM 614 CA PRO A 84 -24.922 -23.221 -26.997 1.00 42.12 C ATOM 615 C PRO A 84 -25.891 -22.477 -26.093 1.00 41.90 C ATOM 616 O PRO A 84 -26.859 -21.886 -26.589 1.00 45.02 O ATOM 617 CB PRO A 84 -25.233 -24.727 -27.032 1.00 41.86 C ATOM 618 CG PRO A 84 -23.903 -25.395 -27.144 1.00 48.41 C ATOM 619 CD PRO A 84 -22.939 -24.526 -26.381 1.00 39.55 C ATOM 620 N GLU A 85 -25.678 -22.503 -24.779 1.00 38.99 N ATOM 621 CA GLU A 85 -26.611 -21.859 -23.863 1.00 37.79 C ATOM 622 C GLU A 85 -26.232 -20.417 -23.559 1.00 34.80 C ATOM 623 O GLU A 85 -27.114 -19.557 -23.415 1.00 35.99 O ATOM 624 CB GLU A 85 -26.692 -22.655 -22.556 1.00 41.68 C ATOM 625 H GLU A 85 -24.838 -22.987 -24.403 1.00 0.00 H ATOM 626 N GLU A 86 -24.929 -20.138 -23.441 1.00 35.89 N ATOM 627 CA GLU A 86 -24.473 -18.797 -23.108 1.00 37.66 C ATOM 628 C GLU A 86 -24.462 -17.868 -24.309 1.00 30.74 C ATOM 629 O GLU A 86 -24.548 -16.650 -24.131 1.00 31.13 O ATOM 630 CB GLU A 86 -23.076 -18.857 -22.482 1.00 35.02 C ATOM 631 CG GLU A 86 -23.076 -19.527 -21.126 1.00 37.25 C ATOM 632 CD GLU A 86 -23.867 -18.745 -20.098 1.00 49.30 C ATOM 633 OE1 GLU A 86 -23.780 -17.501 -20.089 1.00 42.91 O ATOM 634 OE2 GLU A 86 -24.590 -19.377 -19.301 1.00 56.11 O ATOM 635 H GLU A 86 -24.229 -20.893 -23.590 1.00 0.00 H ATOM 636 N GLY A 87 -24.359 -18.411 -25.516 1.00 30.20 N ATOM 637 CA GLY A 87 -24.406 -17.566 -26.691 1.00 30.96 C ATOM 638 C GLY A 87 -23.160 -16.749 -26.944 1.00 31.05 C ATOM 639 O GLY A 87 -23.220 -15.784 -27.712 1.00 30.21 O ATOM 640 H GLY A 87 -24.245 -19.440 -25.617 1.00 0.00 H ATOM 641 N VAL A 88 -22.029 -17.107 -26.322 1.00 29.45 N ATOM 642 CA VAL A 88 -20.723 -16.501 -26.603 1.00 26.00 C ATOM 643 C VAL A 88 -19.674 -17.606 -26.678 1.00 23.58 C ATOM 644 O VAL A 88 -19.936 -18.758 -26.348 1.00 27.94 O ATOM 645 CB VAL A 88 -20.305 -15.448 -25.549 1.00 25.79 C ATOM 646 CG1 VAL A 88 -21.316 -14.305 -25.492 1.00 26.03 C ATOM 647 CG2 VAL A 88 -20.137 -16.095 -24.194 1.00 24.92 C ATOM 648 H VAL A 88 -22.080 -17.855 -25.601 1.00 0.00 H ATOM 649 N SER A 89 -18.459 -17.234 -27.098 1.00 24.20 N ATOM 650 CA SER A 89 -17.392 -18.216 -27.241 1.00 20.48 C ATOM 651 C SER A 89 -17.159 -18.910 -25.907 1.00 22.98 C ATOM 652 O SER A 89 -17.309 -18.305 -24.844 1.00 22.79 O ATOM 653 CB SER A 89 -16.073 -17.570 -27.696 1.00 26.03 C ATOM 654 OG SER A 89 -15.481 -16.808 -26.638 1.00 27.92 O ATOM 655 HG SER A 89 -16.105 -16.092 -26.359 1.00 0.00 H ATOM 656 H SER A 89 -18.275 -16.236 -27.324 1.00 0.00 H ATOM 657 N ALA A 90 -16.804 -20.196 -25.985 1.00 24.73 N ATOM 658 CA ALA A 90 -16.480 -20.967 -24.785 1.00 27.21 C ATOM 659 C ALA A 90 -15.390 -20.290 -23.960 1.00 26.42 C ATOM 660 O ALA A 90 -15.436 -20.298 -22.717 1.00 24.72 O ATOM 661 CB ALA A 90 -16.044 -22.376 -25.179 1.00 29.24 C ATOM 662 H ALA A 90 -16.757 -20.657 -26.916 1.00 0.00 H ATOM 663 N ALA A 91 -14.396 -19.712 -24.636 1.00 21.99 N ATOM 664 CA ALA A 91 -13.338 -18.975 -23.948 1.00 22.86 C ATOM 665 C ALA A 91 -13.920 -17.844 -23.119 1.00 23.61 C ATOM 666 O ALA A 91 -13.517 -17.639 -21.972 1.00 22.42 O ATOM 667 CB ALA A 91 -12.328 -18.415 -24.960 1.00 22.96 C ATOM 668 H ALA A 91 -14.373 -19.787 -25.673 1.00 0.00 H ATOM 669 N GLU A 92 -14.863 -17.083 -23.690 1.00 18.90 N ATOM 670 CA GLU A 92 -15.442 -15.972 -22.940 1.00 23.60 C ATOM 671 C GLU A 92 -16.294 -16.468 -21.776 1.00 25.14 C ATOM 672 O GLU A 92 -16.342 -15.817 -20.717 1.00 21.31 O ATOM 673 CB GLU A 92 -16.261 -15.067 -23.878 1.00 21.96 C ATOM 674 CG GLU A 92 -17.002 -13.944 -23.137 1.00 20.39 C ATOM 675 CD GLU A 92 -17.663 -12.889 -24.051 1.00 27.24 C ATOM 676 OE1 GLU A 92 -17.148 -12.599 -25.160 1.00 25.73 O ATOM 677 OE2 GLU A 92 -18.718 -12.351 -23.641 1.00 25.56 O ATOM 678 H GLU A 92 -15.180 -17.282 -24.660 1.00 0.00 H ATOM 679 N VAL A 93 -16.972 -17.613 -21.939 1.00 22.43 N ATOM 680 CA VAL A 93 -17.717 -18.194 -20.821 1.00 24.63 C ATOM 681 C VAL A 93 -16.784 -18.459 -19.647 1.00 23.44 C ATOM 682 O VAL A 93 -17.087 -18.097 -18.503 1.00 24.82 O ATOM 683 CB VAL A 93 -18.446 -19.483 -21.250 1.00 26.00 C ATOM 684 CG1 VAL A 93 -19.184 -20.094 -20.061 1.00 28.04 C ATOM 685 CG2 VAL A 93 -19.416 -19.215 -22.363 1.00 23.11 C ATOM 686 H VAL A 93 -16.969 -18.090 -22.863 1.00 0.00 H ATOM 687 N ILE A 94 -15.637 -19.095 -19.916 1.00 20.62 N ATOM 688 CA ILE A 94 -14.669 -19.399 -18.858 1.00 27.35 C ATOM 689 C ILE A 94 -14.153 -18.115 -18.213 1.00 25.24 C ATOM 690 O ILE A 94 -13.913 -18.058 -16.997 1.00 23.36 O ATOM 691 CB ILE A 94 -13.518 -20.251 -19.427 1.00 26.25 C ATOM 692 CG1 ILE A 94 -14.070 -21.561 -20.005 1.00 26.64 C ATOM 693 CG2 ILE A 94 -12.428 -20.513 -18.371 1.00 26.18 C ATOM 694 CD1 ILE A 94 -13.016 -22.397 -20.697 1.00 28.57 C ATOM 695 H ILE A 94 -15.429 -19.379 -20.895 1.00 0.00 H ATOM 696 N MET A 95 -13.988 -17.060 -19.011 1.00 18.84 N ATOM 697 CA MET A 95 -13.427 -15.814 -18.503 1.00 19.64 C ATOM 698 C MET A 95 -14.437 -14.942 -17.777 1.00 22.82 C ATOM 699 O MET A 95 -14.023 -14.021 -17.064 1.00 22.05 O ATOM 700 CB MET A 95 -12.825 -15.000 -19.656 1.00 19.08 C ATOM 701 CG MET A 95 -11.453 -15.461 -20.086 1.00 24.73 C ATOM 702 SD MET A 95 -10.236 -14.972 -18.830 1.00 22.67 S ATOM 703 CE MET A 95 -8.774 -15.840 -19.422 1.00 23.38 C ATOM 704 H MET A 95 -14.264 -17.127 -20.012 1.00 0.00 H ATOM 705 N THR A 96 -15.752 -15.181 -17.950 1.00 22.79 N ATOM 706 CA THR A 96 -16.756 -14.252 -17.429 1.00 22.30 C ATOM 707 C THR A 96 -17.831 -14.876 -16.545 1.00 25.56 C ATOM 708 O THR A 96 -18.719 -14.146 -16.088 1.00 24.82 O ATOM 709 CB THR A 96 -17.462 -13.514 -18.577 1.00 28.44 C ATOM 710 OG1 THR A 96 -18.111 -14.474 -19.426 1.00 22.76 O ATOM 711 CG2 THR A 96 -16.452 -12.690 -19.388 1.00 22.72 C ATOM 712 HG1 THR A 96 -17.435 -15.096 -19.796 1.00 0.00 H ATOM 713 H THR A 96 -16.057 -16.035 -18.459 1.00 0.00 H ATOM 714 N VAL A 97 -17.769 -16.178 -16.276 1.00 27.38 N ATOM 715 CA VAL A 97 -18.761 -16.881 -15.467 1.00 29.64 C ATOM 716 C VAL A 97 -18.037 -17.526 -14.292 1.00 34.73 C ATOM 717 O VAL A 97 -17.060 -18.259 -14.479 1.00 33.78 O ATOM 718 CB VAL A 97 -19.524 -17.938 -16.286 1.00 28.21 C ATOM 719 CG1 VAL A 97 -20.552 -18.658 -15.407 1.00 32.10 C ATOM 720 CG2 VAL A 97 -20.190 -17.302 -17.492 1.00 31.64 C ATOM 721 H VAL A 97 -16.972 -16.723 -16.662 1.00 0.00 H ATOM 722 N LEU A 98 -18.515 -17.256 -13.088 1.00 28.72 N ATOM 723 CA LEU A 98 -17.825 -17.713 -11.895 1.00 34.70 C ATOM 724 C LEU A 98 -18.081 -19.199 -11.644 1.00 49.45 C ATOM 725 O LEU A 98 -19.058 -19.768 -12.140 1.00 40.03 O ATOM 726 CB LEU A 98 -18.271 -16.871 -10.701 1.00 32.66 C ATOM 727 CG LEU A 98 -17.744 -17.254 -9.317 1.00 51.86 C ATOM 728 CD1 LEU A 98 -16.244 -17.395 -9.365 1.00 50.72 C ATOM 729 CD2 LEU A 98 -18.126 -16.181 -8.335 1.00 50.18 C ATOM 730 H LEU A 98 -19.395 -16.710 -12.995 1.00 0.00 H TER 731 LEU A 98 ATOM 732 N VAL A 118 -10.264 -21.040 -7.844 1.00 46.00 N ATOM 733 CA VAL A 118 -11.377 -20.125 -8.079 1.00 42.88 C ATOM 734 C VAL A 118 -11.506 -19.825 -9.573 1.00 36.93 C ATOM 735 O VAL A 118 -12.573 -19.460 -10.052 1.00 37.28 O ATOM 736 CB VAL A 118 -11.208 -18.838 -7.267 1.00 46.18 C ATOM 737 CG1 VAL A 118 -11.178 -19.165 -5.783 1.00 46.55 C ATOM 738 CG2 VAL A 118 -9.941 -18.091 -7.690 1.00 30.49 C ATOM 739 HN3 VAL A 118 -9.382 -20.605 -8.182 1.00 0.00 H ATOM 740 HN2 VAL A 118 -10.433 -21.929 -8.357 1.00 0.00 H ATOM 741 HN1 VAL A 118 -10.187 -21.236 -6.826 1.00 0.00 H ATOM 742 N GLY A 119 -10.408 -19.979 -10.303 1.00 38.66 N ATOM 743 CA GLY A 119 -10.441 -19.959 -11.750 1.00 36.93 C ATOM 744 C GLY A 119 -10.097 -18.599 -12.327 1.00 33.22 C ATOM 745 O GLY A 119 -10.060 -17.574 -11.640 1.00 26.25 O ATOM 746 H GLY A 119 -9.497 -20.118 -9.821 1.00 0.00 H ATOM 747 N VAL A 120 -9.857 -18.605 -13.642 1.00 26.30 N ATOM 748 CA VAL A 120 -9.357 -17.412 -14.307 1.00 23.69 C ATOM 749 C VAL A 120 -10.404 -16.312 -14.407 1.00 23.04 C ATOM 750 O VAL A 120 -10.032 -15.165 -14.655 1.00 23.55 O ATOM 751 CB VAL A 120 -8.816 -17.738 -15.708 1.00 27.86 C ATOM 752 CG1 VAL A 120 -7.601 -18.652 -15.612 1.00 29.78 C ATOM 753 CG2 VAL A 120 -9.902 -18.356 -16.577 1.00 26.03 C ATOM 754 H VAL A 120 -10.029 -19.469 -14.194 1.00 0.00 H ATOM 755 N SER A 121 -11.699 -16.608 -14.215 1.00 23.54 N ATOM 756 CA SER A 121 -12.679 -15.519 -14.236 1.00 19.98 C ATOM 757 C SER A 121 -12.433 -14.535 -13.097 1.00 21.70 C ATOM 758 O SER A 121 -12.637 -13.328 -13.261 1.00 21.01 O ATOM 759 CB SER A 121 -14.117 -16.060 -14.183 1.00 20.36 C ATOM 760 OG SER A 121 -14.372 -16.771 -12.989 1.00 25.97 O ATOM 761 HG SER A 121 -15.305 -17.101 -12.996 1.00 0.00 H ATOM 762 H SER A 121 -12.001 -17.590 -14.055 1.00 0.00 H ATOM 763 N VAL A 122 -11.974 -15.025 -11.946 1.00 21.18 N ATOM 764 CA VAL A 122 -11.623 -14.122 -10.857 1.00 21.72 C ATOM 765 C VAL A 122 -10.445 -13.236 -11.243 1.00 19.34 C ATOM 766 O VAL A 122 -10.442 -12.027 -10.978 1.00 22.54 O ATOM 767 CB VAL A 122 -11.330 -14.936 -9.578 1.00 22.88 C ATOM 768 CG1 VAL A 122 -10.716 -14.040 -8.514 1.00 24.78 C ATOM 769 CG2 VAL A 122 -12.622 -15.601 -9.082 1.00 25.94 C ATOM 770 H VAL A 122 -11.866 -16.052 -11.825 1.00 0.00 H ATOM 771 N VAL A 123 -9.409 -13.822 -11.848 1.00 19.85 N ATOM 772 CA VAL A 123 -8.267 -13.024 -12.270 1.00 19.19 C ATOM 773 C VAL A 123 -8.725 -11.944 -13.228 1.00 20.33 C ATOM 774 O VAL A 123 -8.327 -10.780 -13.126 1.00 19.91 O ATOM 775 CB VAL A 123 -7.199 -13.924 -12.923 1.00 18.41 C ATOM 776 CG1 VAL A 123 -5.966 -13.097 -13.323 1.00 22.35 C ATOM 777 CG2 VAL A 123 -6.808 -15.036 -11.977 1.00 21.40 C ATOM 778 H VAL A 123 -9.418 -14.848 -12.018 1.00 0.00 H ATOM 779 N ASN A 124 -9.547 -12.336 -14.206 1.00 20.40 N ATOM 780 CA ASN A 124 -10.060 -11.395 -15.197 1.00 21.18 C ATOM 781 C ASN A 124 -10.778 -10.230 -14.521 1.00 21.69 C ATOM 782 O ASN A 124 -10.489 -9.055 -14.795 1.00 20.67 O ATOM 783 CB ASN A 124 -10.991 -12.156 -16.133 1.00 18.96 C ATOM 784 CG ASN A 124 -11.357 -11.379 -17.366 1.00 23.21 C ATOM 785 OD1 ASN A 124 -10.663 -10.460 -17.766 1.00 20.04 O ATOM 786 ND2 ASN A 124 -12.466 -11.753 -17.974 1.00 21.82 N ATOM 787 HD22 ASN A 124 -13.026 -12.543 -17.595 1.00 0.00 H ATOM 788 HD21 ASN A 124 -12.781 -11.257 -18.832 1.00 0.00 H ATOM 789 H ASN A 124 -9.828 -13.336 -14.262 1.00 0.00 H ATOM 790 N ALA A 125 -11.696 -10.546 -13.599 1.00 22.16 N ATOM 791 CA ALA A 125 -12.467 -9.511 -12.910 1.00 23.61 C ATOM 792 C ALA A 125 -11.572 -8.510 -12.199 1.00 20.50 C ATOM 793 O ALA A 125 -11.917 -7.329 -12.105 1.00 22.30 O ATOM 794 CB ALA A 125 -13.426 -10.155 -11.899 1.00 20.16 C ATOM 795 H ALA A 125 -11.864 -11.546 -13.368 1.00 0.00 H ATOM 796 N LEU A 126 -10.426 -8.962 -11.686 1.00 21.48 N ATOM 797 CA LEU A 126 -9.537 -8.140 -10.877 1.00 20.61 C ATOM 798 C LEU A 126 -8.325 -7.635 -11.656 1.00 24.29 C ATOM 799 O LEU A 126 -7.352 -7.179 -11.044 1.00 22.53 O ATOM 800 CB LEU A 126 -9.080 -8.924 -9.635 1.00 20.87 C ATOM 801 CG LEU A 126 -10.253 -9.466 -8.816 1.00 23.62 C ATOM 802 CD1 LEU A 126 -9.782 -10.200 -7.559 1.00 20.41 C ATOM 803 CD2 LEU A 126 -11.205 -8.317 -8.436 1.00 23.63 C ATOM 804 H LEU A 126 -10.155 -9.948 -11.873 1.00 0.00 H ATOM 805 N SER A 127 -8.356 -7.720 -12.986 1.00 21.80 N ATOM 806 CA SER A 127 -7.301 -7.200 -13.846 1.00 20.21 C ATOM 807 C SER A 127 -7.814 -5.958 -14.555 1.00 22.21 C ATOM 808 O SER A 127 -8.873 -6.000 -15.172 1.00 18.75 O ATOM 809 CB SER A 127 -6.869 -8.237 -14.896 1.00 18.58 C ATOM 810 OG SER A 127 -6.287 -9.370 -14.283 1.00 20.84 O ATOM 811 HG SER A 127 -6.946 -9.790 -13.675 1.00 0.00 H ATOM 812 H SER A 127 -9.175 -8.181 -13.432 1.00 0.00 H ATOM 813 N GLN A 128 -7.060 -4.860 -14.492 1.00 20.65 N ATOM 814 CA GLN A 128 -7.488 -3.694 -15.252 1.00 22.07 C ATOM 815 C GLN A 128 -7.404 -3.947 -16.753 1.00 22.87 C ATOM 816 O GLN A 128 -8.134 -3.305 -17.520 1.00 22.45 O ATOM 817 CB GLN A 128 -6.677 -2.458 -14.845 1.00 25.86 C ATOM 818 CG GLN A 128 -5.173 -2.622 -14.876 1.00 26.30 C ATOM 819 CD GLN A 128 -4.458 -1.468 -14.173 1.00 37.18 C ATOM 820 OE1 GLN A 128 -4.855 -1.037 -13.087 1.00 32.87 O ATOM 821 NE2 GLN A 128 -3.410 -0.956 -14.801 1.00 43.90 N ATOM 822 HE22 GLN A 128 -3.108 -1.349 -15.715 1.00 0.00 H ATOM 823 HE21 GLN A 128 -2.889 -0.161 -14.380 1.00 0.00 H ATOM 824 H GLN A 128 -6.193 -4.837 -13.918 1.00 0.00 H ATOM 825 N LYS A 129 -6.554 -4.885 -17.174 1.00 21.31 N ATOM 826 CA LYS A 129 -6.513 -5.355 -18.556 1.00 16.69 C ATOM 827 C LYS A 129 -6.120 -6.829 -18.573 1.00 17.47 C ATOM 828 O LYS A 129 -5.273 -7.263 -17.794 1.00 20.36 O ATOM 829 CB LYS A 129 -5.514 -4.548 -19.394 1.00 20.69 C ATOM 830 CG LYS A 129 -5.495 -4.936 -20.854 1.00 22.19 C ATOM 831 CD LYS A 129 -4.546 -4.033 -21.669 1.00 28.35 C ATOM 832 CE LYS A 129 -4.408 -4.568 -23.099 1.00 32.96 C ATOM 833 NZ LYS A 129 -3.639 -3.659 -24.000 1.00 31.59 N ATOM 834 HZ1 LYS A 129 -4.120 -2.739 -24.055 1.00 0.00 H ATOM 835 HZ2 LYS A 129 -2.680 -3.527 -23.621 1.00 0.00 H ATOM 836 HZ3 LYS A 129 -3.583 -4.080 -24.949 1.00 0.00 H ATOM 837 H LYS A 129 -5.892 -5.300 -16.488 1.00 0.00 H ATOM 838 N LEU A 130 -6.741 -7.601 -19.457 1.00 18.82 N ATOM 839 CA LEU A 130 -6.328 -8.983 -19.661 1.00 16.89 C ATOM 840 C LEU A 130 -6.428 -9.255 -21.146 1.00 19.58 C ATOM 841 O LEU A 130 -7.463 -8.959 -21.754 1.00 20.55 O ATOM 842 CB LEU A 130 -7.207 -9.974 -18.879 1.00 15.35 C ATOM 843 CG LEU A 130 -6.833 -11.455 -18.983 1.00 15.32 C ATOM 844 CD1 LEU A 130 -7.173 -12.187 -17.664 1.00 17.51 C ATOM 845 CD2 LEU A 130 -7.534 -12.151 -20.156 1.00 22.58 C ATOM 846 H LEU A 130 -7.532 -7.214 -20.011 1.00 0.00 H ATOM 847 N GLU A 131 -5.357 -9.792 -21.725 1.00 19.26 N ATOM 848 CA GLU A 131 -5.313 -10.086 -23.152 1.00 19.47 C ATOM 849 C GLU A 131 -5.066 -11.574 -23.355 1.00 23.36 C ATOM 850 O GLU A 131 -4.207 -12.165 -22.697 1.00 22.35 O ATOM 851 CB GLU A 131 -4.214 -9.264 -23.821 1.00 23.09 C ATOM 852 CG GLU A 131 -3.988 -9.584 -25.293 1.00 29.91 C ATOM 853 CD GLU A 131 -3.256 -8.455 -25.993 1.00 45.21 C ATOM 854 OE1 GLU A 131 -2.526 -7.704 -25.303 1.00 39.83 O ATOM 855 OE2 GLU A 131 -3.414 -8.315 -27.224 1.00 50.77 O ATOM 856 H GLU A 131 -4.525 -10.009 -21.141 1.00 0.00 H ATOM 857 N LEU A 132 -5.795 -12.193 -24.279 1.00 20.75 N ATOM 858 CA LEU A 132 -5.603 -13.617 -24.493 1.00 17.18 C ATOM 859 C LEU A 132 -5.436 -13.910 -25.966 1.00 22.65 C ATOM 860 O LEU A 132 -5.923 -13.165 -26.820 1.00 21.51 O ATOM 861 CB LEU A 132 -6.760 -14.440 -23.912 1.00 23.97 C ATOM 862 CG LEU A 132 -8.146 -14.328 -24.534 1.00 23.10 C ATOM 863 CD1 LEU A 132 -8.290 -15.279 -25.722 1.00 21.84 C ATOM 864 CD2 LEU A 132 -9.200 -14.635 -23.457 1.00 28.32 C ATOM 865 H LEU A 132 -6.493 -11.665 -24.841 1.00 0.00 H ATOM 866 N VAL A 133 -4.703 -14.985 -26.242 1.00 20.74 N ATOM 867 CA VAL A 133 -4.476 -15.492 -27.598 1.00 19.93 C ATOM 868 C VAL A 133 -4.622 -17.003 -27.566 1.00 23.07 C ATOM 869 O VAL A 133 -4.002 -17.661 -26.720 1.00 21.39 O ATOM 870 CB VAL A 133 -3.073 -15.147 -28.134 1.00 23.27 C ATOM 871 CG1 VAL A 133 -3.029 -15.323 -29.653 1.00 20.57 C ATOM 872 CG2 VAL A 133 -2.644 -13.776 -27.716 1.00 24.66 C ATOM 873 H VAL A 133 -4.265 -15.496 -25.449 1.00 0.00 H ATOM 874 N ILE A 134 -5.392 -17.557 -28.493 1.00 21.84 N ATOM 875 CA ILE A 134 -5.613 -18.991 -28.599 1.00 23.08 C ATOM 876 C ILE A 134 -5.257 -19.396 -30.012 1.00 21.98 C ATOM 877 O ILE A 134 -5.769 -18.800 -30.967 1.00 23.46 O ATOM 878 CB ILE A 134 -7.072 -19.373 -28.302 1.00 22.42 C ATOM 879 CG1 ILE A 134 -7.417 -19.061 -26.837 1.00 21.94 C ATOM 880 CG2 ILE A 134 -7.319 -20.838 -28.665 1.00 25.07 C ATOM 881 CD1 ILE A 134 -8.920 -19.100 -26.543 1.00 22.58 C ATOM 882 H ILE A 134 -5.862 -16.934 -29.180 1.00 0.00 H ATOM 883 N GLN A 135 -4.370 -20.379 -30.143 1.00 22.49 N ATOM 884 CA GLN A 135 -3.998 -20.941 -31.443 1.00 25.76 C ATOM 885 C GLN A 135 -4.571 -22.351 -31.533 1.00 27.20 C ATOM 886 O GLN A 135 -4.248 -23.215 -30.710 1.00 23.57 O ATOM 887 CB GLN A 135 -2.481 -20.927 -31.633 1.00 25.18 C ATOM 888 CG GLN A 135 -1.877 -19.519 -31.644 1.00 27.13 C ATOM 889 CD GLN A 135 -0.366 -19.525 -31.663 1.00 38.71 C ATOM 890 OE1 GLN A 135 0.255 -19.436 -32.724 1.00 43.65 O ATOM 891 NE2 GLN A 135 0.239 -19.639 -30.487 1.00 33.54 N ATOM 892 HE22 GLN A 135 -0.326 -19.711 -29.617 1.00 0.00 H ATOM 893 HE21 GLN A 135 1.278 -19.656 -30.436 1.00 0.00 H ATOM 894 H GLN A 135 -3.922 -20.764 -29.287 1.00 0.00 H ATOM 895 N ARG A 136 -5.443 -22.581 -32.517 1.00 28.40 N ATOM 896 CA ARG A 136 -6.215 -23.816 -32.507 1.00 29.94 C ATOM 897 C ARG A 136 -6.895 -23.981 -33.850 1.00 33.33 C ATOM 898 O ARG A 136 -7.421 -23.012 -34.389 1.00 31.04 O ATOM 899 CB ARG A 136 -7.264 -23.791 -31.395 1.00 31.56 C ATOM 900 CG ARG A 136 -8.124 -25.029 -31.292 1.00 33.81 C ATOM 901 CD ARG A 136 -9.110 -24.877 -30.151 1.00 33.48 C ATOM 902 NE ARG A 136 -10.081 -25.968 -30.102 1.00 33.55 N ATOM 903 CZ ARG A 136 -9.933 -27.079 -29.389 1.00 40.19 C ATOM 904 NH1 ARG A 136 -8.838 -27.275 -28.666 1.00 36.00 N ATOM 905 NH2 ARG A 136 -10.886 -28.001 -29.401 1.00 44.23 N ATOM 906 HE ARG A 136 -10.949 -25.868 -30.665 1.00 0.00 H ATOM 907 HH12 ARG A 136 -8.731 -28.148 -28.111 1.00 0.00 H ATOM 908 HH11 ARG A 136 -8.087 -26.556 -28.654 1.00 0.00 H ATOM 909 HH22 ARG A 136 -10.774 -28.872 -28.844 1.00 0.00 H ATOM 910 HH21 ARG A 136 -11.746 -27.853 -29.967 1.00 0.00 H ATOM 911 H ARG A 136 -5.570 -21.887 -33.281 1.00 0.00 H ATOM 912 N GLU A 137 -6.888 -25.210 -34.369 1.00 32.49 N ATOM 913 CA GLU A 137 -7.565 -25.538 -35.629 1.00 36.08 C ATOM 914 C GLU A 137 -7.144 -24.587 -36.750 1.00 31.36 C ATOM 915 O GLU A 137 -7.956 -24.141 -37.562 1.00 33.68 O ATOM 916 CB GLU A 137 -9.080 -25.548 -35.442 1.00 35.50 C ATOM 917 CG GLU A 137 -9.541 -26.663 -34.502 1.00 40.47 C ATOM 918 CD GLU A 137 -10.984 -26.529 -34.067 1.00 53.28 C ATOM 919 OE1 GLU A 137 -11.668 -25.596 -34.544 1.00 66.79 O ATOM 920 OE2 GLU A 137 -11.433 -27.365 -33.250 1.00 57.52 O ATOM 921 H GLU A 137 -6.383 -25.964 -33.861 1.00 0.00 H ATOM 922 N GLY A 138 -5.854 -24.260 -36.775 1.00 31.01 N ATOM 923 CA GLY A 138 -5.281 -23.469 -37.844 1.00 35.35 C ATOM 924 C GLY A 138 -5.491 -21.973 -37.763 1.00 34.97 C ATOM 925 O GLY A 138 -5.104 -21.267 -38.698 1.00 31.01 O ATOM 926 H GLY A 138 -5.238 -24.583 -36.002 1.00 0.00 H ATOM 927 N LYS A 139 -6.089 -21.459 -36.689 1.00 30.63 N ATOM 928 CA LYS A 139 -6.423 -20.045 -36.604 1.00 27.44 C ATOM 929 C LYS A 139 -5.836 -19.438 -35.333 1.00 28.20 C ATOM 930 O LYS A 139 -5.636 -20.132 -34.329 1.00 29.12 O ATOM 931 CB LYS A 139 -7.944 -19.821 -36.611 1.00 25.85 C ATOM 932 CG LYS A 139 -8.644 -20.238 -37.921 1.00 31.54 C ATOM 933 CD LYS A 139 -10.139 -20.386 -37.695 1.00 40.89 C ATOM 934 H LYS A 139 -6.323 -22.084 -35.891 1.00 0.00 H ATOM 935 N ILE A 140 -5.571 -18.134 -35.387 1.00 27.15 N ATOM 936 CA ILE A 140 -5.221 -17.328 -34.210 1.00 24.35 C ATOM 937 C ILE A 140 -6.477 -16.595 -33.778 1.00 25.59 C ATOM 938 O ILE A 140 -7.149 -15.973 -34.608 1.00 25.61 O ATOM 939 CB ILE A 140 -4.087 -16.335 -34.530 1.00 23.55 C ATOM 940 CG1 ILE A 140 -2.878 -17.064 -35.117 1.00 26.84 C ATOM 941 CG2 ILE A 140 -3.685 -15.498 -33.293 1.00 25.52 C ATOM 942 CD1 ILE A 140 -1.768 -16.145 -35.564 1.00 23.17 C ATOM 943 H ILE A 140 -5.614 -17.661 -36.312 1.00 0.00 H ATOM 944 N HIS A 141 -6.808 -16.681 -32.489 1.00 23.79 N ATOM 945 CA HIS A 141 -7.988 -16.044 -31.920 1.00 20.94 C ATOM 946 C HIS A 141 -7.507 -15.082 -30.836 1.00 22.70 C ATOM 947 O HIS A 141 -6.626 -15.440 -30.058 1.00 23.78 O ATOM 948 CB HIS A 141 -8.944 -17.068 -31.289 1.00 23.23 C ATOM 949 CG HIS A 141 -9.298 -18.233 -32.164 1.00 28.03 C ATOM 950 ND1 HIS A 141 -8.415 -19.254 -32.449 1.00 25.66 N ATOM 951 CD2 HIS A 141 -10.456 -18.549 -32.795 1.00 34.77 C ATOM 952 CE1 HIS A 141 -9.013 -20.147 -33.222 1.00 29.62 C ATOM 953 NE2 HIS A 141 -10.248 -19.738 -33.456 1.00 32.17 N ATOM 954 H HIS A 141 -6.192 -17.231 -31.857 1.00 0.00 H ATOM 955 N ARG A 142 -8.052 -13.861 -30.792 1.00 18.98 N ATOM 956 CA ARG A 142 -7.604 -12.886 -29.792 1.00 22.63 C ATOM 957 C ARG A 142 -8.780 -12.178 -29.146 1.00 21.98 C ATOM 958 O ARG A 142 -9.806 -11.933 -29.789 1.00 19.70 O ATOM 959 CB ARG A 142 -6.688 -11.809 -30.383 1.00 19.66 C ATOM 960 CG ARG A 142 -5.311 -12.307 -30.872 1.00 22.55 C ATOM 961 CD ARG A 142 -4.430 -11.136 -31.347 1.00 23.36 C ATOM 962 NE ARG A 142 -3.159 -11.614 -31.895 1.00 27.19 N ATOM 963 CZ ARG A 142 -2.069 -11.853 -31.168 1.00 32.50 C ATOM 964 NH1 ARG A 142 -2.089 -11.654 -29.859 1.00 31.79 N ATOM 965 NH2 ARG A 142 -0.956 -12.288 -31.745 1.00 31.60 N ATOM 966 HE ARG A 142 -3.104 -11.778 -32.921 1.00 0.00 H ATOM 967 HH12 ARG A 142 -1.238 -11.841 -29.292 1.00 0.00 H ATOM 968 HH11 ARG A 142 -2.956 -11.311 -29.398 1.00 0.00 H ATOM 969 HH22 ARG A 142 -0.110 -12.472 -31.169 1.00 0.00 H ATOM 970 HH21 ARG A 142 -0.930 -12.445 -32.773 1.00 0.00 H ATOM 971 H ARG A 142 -8.797 -13.602 -31.470 1.00 0.00 H ATOM 972 N GLN A 143 -8.594 -11.788 -27.880 1.00 18.97 N ATOM 973 CA GLN A 143 -9.608 -11.030 -27.157 1.00 20.85 C ATOM 974 C GLN A 143 -8.959 -10.211 -26.042 1.00 20.00 C ATOM 975 O GLN A 143 -7.946 -10.613 -25.465 1.00 19.76 O ATOM 976 CB GLN A 143 -10.688 -11.953 -26.559 1.00 21.26 C ATOM 977 CG GLN A 143 -11.986 -11.221 -26.246 1.00 18.12 C ATOM 978 CD GLN A 143 -13.057 -12.132 -25.678 1.00 21.77 C ATOM 979 OE1 GLN A 143 -12.765 -13.222 -25.180 1.00 21.19 O ATOM 980 NE2 GLN A 143 -14.314 -11.679 -25.743 1.00 19.82 N ATOM 981 HE22 GLN A 143 -14.511 -10.753 -26.173 1.00 0.00 H ATOM 982 HE21 GLN A 143 -15.094 -12.253 -25.364 1.00 0.00 H ATOM 983 H GLN A 143 -7.704 -12.031 -27.400 1.00 0.00 H ATOM 984 N ILE A 144 -9.553 -9.041 -25.774 1.00 19.55 N ATOM 985 CA ILE A 144 -9.113 -8.093 -24.756 1.00 19.63 C ATOM 986 C ILE A 144 -10.258 -7.863 -23.782 1.00 21.42 C ATOM 987 O ILE A 144 -11.409 -7.698 -24.204 1.00 21.00 O ATOM 988 CB ILE A 144 -8.691 -6.741 -25.368 1.00 21.79 C ATOM 989 CG1 ILE A 144 -7.791 -6.947 -26.573 1.00 24.26 C ATOM 990 CG2 ILE A 144 -7.993 -5.878 -24.321 1.00 22.91 C ATOM 991 CD1 ILE A 144 -6.461 -7.438 -26.196 1.00 21.84 C ATOM 992 H ILE A 144 -10.392 -8.789 -26.334 1.00 0.00 H ATOM 993 N TYR A 145 -9.940 -7.837 -22.493 1.00 20.09 N ATOM 994 CA TYR A 145 -10.865 -7.495 -21.422 1.00 21.77 C ATOM 995 C TYR A 145 -10.306 -6.326 -20.623 1.00 19.08 C ATOM 996 O TYR A 145 -9.089 -6.164 -20.508 1.00 21.21 O ATOM 997 CB TYR A 145 -11.086 -8.675 -20.462 1.00 18.82 C ATOM 998 CG TYR A 145 -11.758 -9.874 -21.073 1.00 21.80 C ATOM 999 CD1 TYR A 145 -11.037 -10.773 -21.867 1.00 19.43 C ATOM 1000 CD2 TYR A 145 -13.112 -10.122 -20.851 1.00 19.37 C ATOM 1001 CE1 TYR A 145 -11.654 -11.875 -22.427 1.00 18.39 C ATOM 1002 CE2 TYR A 145 -13.735 -11.225 -21.403 1.00 21.41 C ATOM 1003 CZ TYR A 145 -13.014 -12.098 -22.185 1.00 20.27 C ATOM 1004 OH TYR A 145 -13.642 -13.200 -22.741 1.00 22.03 O ATOM 1005 HH TYR A 145 -12.986 -13.720 -23.270 1.00 0.00 H ATOM 1006 H TYR A 145 -8.963 -8.078 -22.230 1.00 0.00 H ATOM 1007 N GLU A 146 -11.203 -5.520 -20.044 1.00 20.65 N ATOM 1008 CA GLU A 146 -10.819 -4.514 -19.057 1.00 23.53 C ATOM 1009 C GLU A 146 -11.735 -4.688 -17.865 1.00 20.42 C ATOM 1010 O GLU A 146 -12.954 -4.601 -18.017 1.00 20.18 O ATOM 1011 CB GLU A 146 -10.936 -3.091 -19.607 1.00 21.93 C ATOM 1012 CG GLU A 146 -9.943 -2.779 -20.707 1.00 24.58 C ATOM 1013 CD GLU A 146 -10.099 -1.358 -21.233 1.00 35.65 C ATOM 1014 OE1 GLU A 146 -10.620 -0.491 -20.497 1.00 35.13 O ATOM 1015 OE2 GLU A 146 -9.717 -1.117 -22.392 1.00 35.43 O ATOM 1016 H GLU A 146 -12.205 -5.613 -20.305 1.00 0.00 H ATOM 1017 N HIS A 147 -11.148 -4.938 -16.694 1.00 19.19 N ATOM 1018 CA HIS A 147 -11.904 -5.188 -15.464 1.00 23.17 C ATOM 1019 C HIS A 147 -12.962 -6.280 -15.664 1.00 23.21 C ATOM 1020 O HIS A 147 -14.061 -6.235 -15.105 1.00 22.75 O ATOM 1021 CB HIS A 147 -12.508 -3.880 -14.941 1.00 25.29 C ATOM 1022 CG HIS A 147 -11.477 -2.855 -14.551 1.00 21.29 C ATOM 1023 ND1 HIS A 147 -10.791 -2.913 -13.354 1.00 22.81 N ATOM 1024 CD2 HIS A 147 -11.019 -1.751 -15.190 1.00 23.30 C ATOM 1025 CE1 HIS A 147 -9.949 -1.895 -13.277 1.00 21.51 C ATOM 1026 NE2 HIS A 147 -10.068 -1.171 -14.376 1.00 24.10 N ATOM 1027 H HIS A 147 -10.109 -4.956 -16.652 1.00 0.00 H ATOM 1028 N GLY A 148 -12.617 -7.296 -16.457 1.00 19.87 N ATOM 1029 CA GLY A 148 -13.523 -8.401 -16.702 1.00 22.26 C ATOM 1030 C GLY A 148 -14.533 -8.184 -17.811 1.00 21.38 C ATOM 1031 O GLY A 148 -15.327 -9.099 -18.093 1.00 19.69 O ATOM 1032 H GLY A 148 -11.680 -7.295 -16.908 1.00 0.00 H ATOM 1033 N VAL A 149 -14.544 -7.012 -18.431 1.00 22.23 N ATOM 1034 CA VAL A 149 -15.529 -6.653 -19.447 1.00 20.97 C ATOM 1035 C VAL A 149 -14.913 -6.912 -20.818 1.00 20.67 C ATOM 1036 O VAL A 149 -13.890 -6.291 -21.141 1.00 22.84 O ATOM 1037 CB VAL A 149 -15.949 -5.183 -19.329 1.00 24.76 C ATOM 1038 CG1 VAL A 149 -17.005 -4.858 -20.379 1.00 25.69 C ATOM 1039 CG2 VAL A 149 -16.476 -4.875 -17.909 1.00 22.44 C ATOM 1040 H VAL A 149 -13.815 -6.314 -18.181 1.00 0.00 H ATOM 1041 N PRO A 150 -15.509 -7.761 -21.659 1.00 22.88 N ATOM 1042 CA PRO A 150 -14.929 -7.984 -22.990 1.00 21.73 C ATOM 1043 C PRO A 150 -15.065 -6.735 -23.851 1.00 25.53 C ATOM 1044 O PRO A 150 -16.113 -6.089 -23.880 1.00 21.97 O ATOM 1045 CB PRO A 150 -15.749 -9.157 -23.552 1.00 19.86 C ATOM 1046 CG PRO A 150 -17.071 -9.072 -22.832 1.00 25.22 C ATOM 1047 CD PRO A 150 -16.727 -8.566 -21.446 1.00 23.57 C ATOM 1048 N GLN A 151 -13.986 -6.390 -24.543 1.00 22.01 N ATOM 1049 CA GLN A 151 -13.996 -5.201 -25.377 1.00 20.09 C ATOM 1050 C GLN A 151 -14.538 -5.482 -26.767 1.00 26.47 C ATOM 1051 O GLN A 151 -14.991 -4.545 -27.443 1.00 25.75 O ATOM 1052 CB GLN A 151 -12.582 -4.612 -25.439 1.00 26.38 C ATOM 1053 CG GLN A 151 -12.053 -4.266 -24.037 1.00 25.73 C ATOM 1054 CD GLN A 151 -12.941 -3.247 -23.337 1.00 28.47 C ATOM 1055 OE1 GLN A 151 -13.597 -3.545 -22.327 1.00 27.78 O ATOM 1056 NE2 GLN A 151 -12.970 -2.033 -23.877 1.00 28.04 N ATOM 1057 HE22 GLN A 151 -12.404 -1.827 -24.725 1.00 0.00 H ATOM 1058 HE21 GLN A 151 -13.559 -1.289 -23.452 1.00 0.00 H ATOM 1059 H GLN A 151 -13.128 -6.975 -24.488 1.00 0.00 H ATOM 1060 N ALA A 152 -14.518 -6.748 -27.183 1.00 22.28 N ATOM 1061 CA ALA A 152 -15.156 -7.242 -28.397 1.00 24.17 C ATOM 1062 C ALA A 152 -15.247 -8.764 -28.286 1.00 23.92 C ATOM 1063 O ALA A 152 -14.540 -9.366 -27.472 1.00 22.96 O ATOM 1064 CB ALA A 152 -14.365 -6.823 -29.653 1.00 25.73 C ATOM 1065 H ALA A 152 -14.007 -7.438 -26.595 1.00 0.00 H ATOM 1066 N PRO A 153 -16.087 -9.419 -29.091 1.00 20.69 N ATOM 1067 CA PRO A 153 -16.092 -10.893 -29.089 1.00 20.86 C ATOM 1068 C PRO A 153 -14.752 -11.481 -29.524 1.00 24.12 C ATOM 1069 O PRO A 153 -13.990 -10.867 -30.278 1.00 24.03 O ATOM 1070 CB PRO A 153 -17.197 -11.248 -30.095 1.00 25.05 C ATOM 1071 CG PRO A 153 -18.056 -10.019 -30.165 1.00 23.74 C ATOM 1072 CD PRO A 153 -17.119 -8.868 -29.993 1.00 26.74 C ATOM 1073 N LEU A 154 -14.458 -12.683 -29.021 1.00 21.85 N ATOM 1074 CA LEU A 154 -13.292 -13.432 -29.483 1.00 18.68 C ATOM 1075 C LEU A 154 -13.280 -13.454 -31.009 1.00 22.69 C ATOM 1076 O LEU A 154 -14.313 -13.678 -31.638 1.00 24.13 O ATOM 1077 CB LEU A 154 -13.341 -14.862 -28.927 1.00 21.09 C ATOM 1078 CG LEU A 154 -12.152 -15.780 -29.230 1.00 24.59 C ATOM 1079 CD1 LEU A 154 -10.915 -15.320 -28.470 1.00 22.36 C ATOM 1080 CD2 LEU A 154 -12.510 -17.232 -28.894 1.00 24.49 C ATOM 1081 H LEU A 154 -15.070 -13.093 -28.287 1.00 0.00 H ATOM 1082 N ALA A 155 -12.115 -13.195 -31.597 1.00 21.09 N ATOM 1083 CA ALA A 155 -12.044 -12.904 -33.022 1.00 22.32 C ATOM 1084 C ALA A 155 -10.844 -13.588 -33.656 1.00 28.01 C ATOM 1085 O ALA A 155 -9.744 -13.596 -33.090 1.00 22.13 O ATOM 1086 CB ALA A 155 -11.966 -11.393 -33.249 1.00 22.04 C ATOM 1087 H ALA A 155 -11.243 -13.200 -31.031 1.00 0.00 H ATOM 1088 N VAL A 156 -11.049 -14.137 -34.852 1.00 25.40 N ATOM 1089 CA VAL A 156 -9.953 -14.743 -35.600 1.00 22.69 C ATOM 1090 C VAL A 156 -9.168 -13.631 -36.279 1.00 25.07 C ATOM 1091 O VAL A 156 -9.741 -12.792 -36.984 1.00 27.56 O ATOM 1092 CB VAL A 156 -10.491 -15.761 -36.627 1.00 30.92 C ATOM 1093 CG1 VAL A 156 -9.387 -16.235 -37.537 1.00 29.97 C ATOM 1094 CG2 VAL A 156 -11.144 -16.946 -35.922 1.00 29.46 C ATOM 1095 H VAL A 156 -12.006 -14.134 -35.259 1.00 0.00 H ATOM 1096 N THR A 157 -7.849 -13.618 -36.070 1.00 21.23 N ATOM 1097 CA THR A 157 -6.983 -12.559 -36.580 1.00 20.58 C ATOM 1098 C THR A 157 -5.934 -13.047 -37.567 1.00 26.14 C ATOM 1099 O THR A 157 -5.186 -12.218 -38.104 1.00 29.27 O ATOM 1100 CB THR A 157 -6.266 -11.855 -35.422 1.00 31.37 C ATOM 1101 OG1 THR A 157 -5.497 -12.827 -34.699 1.00 26.25 O ATOM 1102 CG2 THR A 157 -7.281 -11.190 -34.487 1.00 23.68 C ATOM 1103 HG1 THR A 157 -5.029 -12.383 -33.948 1.00 0.00 H ATOM 1104 H THR A 157 -7.422 -14.392 -35.523 1.00 0.00 H ATOM 1105 N GLY A 158 -5.845 -14.346 -37.819 1.00 27.09 N ATOM 1106 CA GLY A 158 -4.821 -14.859 -38.713 1.00 26.68 C ATOM 1107 C GLY A 158 -4.781 -16.372 -38.675 1.00 29.50 C ATOM 1108 O GLY A 158 -5.560 -17.028 -37.974 1.00 28.00 O ATOM 1109 H GLY A 158 -6.515 -15.004 -37.372 1.00 0.00 H ATOM 1110 N GLU A 159 -3.846 -16.921 -39.451 1.00 33.00 N ATOM 1111 CA GLU A 159 -3.661 -18.362 -39.538 1.00 29.45 C ATOM 1112 C GLU A 159 -2.364 -18.786 -38.862 1.00 28.64 C ATOM 1113 O GLU A 159 -1.419 -18.003 -38.729 1.00 31.83 O ATOM 1114 CB GLU A 159 -3.675 -18.822 -41.001 1.00 33.56 C ATOM 1115 CG GLU A 159 -5.047 -18.675 -41.634 1.00 35.35 C ATOM 1116 CD GLU A 159 -5.125 -19.311 -42.994 1.00 53.64 C ATOM 1117 OE1 GLU A 159 -6.199 -19.852 -43.335 1.00 56.87 O ATOM 1118 OE2 GLU A 159 -4.105 -19.275 -43.713 1.00 48.09 O ATOM 1119 H GLU A 159 -3.229 -16.300 -40.012 1.00 0.00 H ATOM 1120 N THR A 160 -2.348 -20.030 -38.396 1.00 30.62 N ATOM 1121 CA THR A 160 -1.182 -20.558 -37.711 1.00 35.17 C ATOM 1122 C THR A 160 -1.191 -22.070 -37.822 1.00 35.42 C ATOM 1123 O THR A 160 -2.246 -22.687 -37.985 1.00 36.11 O ATOM 1124 CB THR A 160 -1.161 -20.164 -36.234 1.00 32.53 C ATOM 1125 OG1 THR A 160 0.037 -20.670 -35.636 1.00 36.30 O ATOM 1126 CG2 THR A 160 -2.376 -20.762 -35.531 1.00 31.76 C ATOM 1127 HG1 THR A 160 0.058 -20.419 -34.679 1.00 0.00 H ATOM 1128 H THR A 160 -3.184 -20.635 -38.524 1.00 0.00 H ATOM 1129 N GLU A 161 -0.002 -22.655 -37.715 1.00 36.85 N ATOM 1130 CA GLU A 161 0.151 -24.098 -37.635 1.00 40.24 C ATOM 1131 C GLU A 161 0.511 -24.555 -36.230 1.00 46.02 C ATOM 1132 O GLU A 161 0.748 -25.749 -36.021 1.00 43.44 O ATOM 1133 CB GLU A 161 1.212 -24.572 -38.638 1.00 51.34 C ATOM 1134 CG GLU A 161 0.919 -24.153 -40.077 1.00 53.34 C ATOM 1135 CD GLU A 161 1.898 -24.740 -41.080 1.00 66.33 C ATOM 1136 OE1 GLU A 161 2.104 -25.971 -41.060 1.00 61.69 O ATOM 1137 OE2 GLU A 161 2.460 -23.967 -41.889 1.00 68.06 O ATOM 1138 H GLU A 161 0.849 -22.058 -37.688 1.00 0.00 H ATOM 1139 N LYS A 162 0.562 -23.635 -35.270 1.00 42.67 N ATOM 1140 CA LYS A 162 0.840 -23.941 -33.874 1.00 40.13 C ATOM 1141 C LYS A 162 -0.461 -24.067 -33.089 1.00 30.88 C ATOM 1142 O LYS A 162 -1.538 -23.670 -33.533 1.00 30.73 O ATOM 1143 CB LYS A 162 1.725 -22.855 -33.257 1.00 42.96 C ATOM 1144 CG LYS A 162 2.855 -22.388 -34.170 1.00 45.22 C ATOM 1145 CD LYS A 162 3.934 -21.643 -33.402 1.00 55.17 C ATOM 1146 CE LYS A 162 3.582 -20.177 -33.215 1.00 45.65 C ATOM 1147 NZ LYS A 162 4.481 -19.535 -32.211 1.00 51.47 N ATOM 1148 HZ1 LYS A 162 4.382 -20.022 -31.297 1.00 0.00 H ATOM 1149 HZ2 LYS A 162 5.466 -19.603 -32.536 1.00 0.00 H ATOM 1150 HZ3 LYS A 162 4.219 -18.534 -32.102 1.00 0.00 H ATOM 1151 H LYS A 162 0.394 -22.642 -35.531 1.00 0.00 H ATOM 1152 N THR A 163 -0.355 -24.647 -31.898 1.00 33.46 N ATOM 1153 CA THR A 163 -1.480 -24.693 -30.980 1.00 29.22 C ATOM 1154 C THR A 163 -1.010 -24.224 -29.608 1.00 23.88 C ATOM 1155 O THR A 163 0.171 -24.310 -29.265 1.00 29.42 O ATOM 1156 CB THR A 163 -2.107 -26.095 -30.842 1.00 32.27 C ATOM 1157 OG1 THR A 163 -1.153 -26.994 -30.269 1.00 32.40 O ATOM 1158 CG2 THR A 163 -2.578 -26.644 -32.189 1.00 34.98 C ATOM 1159 HG1 THR A 163 -0.885 -26.664 -29.375 1.00 0.00 H ATOM 1160 H THR A 163 0.550 -25.076 -31.618 1.00 0.00 H ATOM 1161 N GLY A 164 -1.953 -23.706 -28.841 1.00 27.02 N ATOM 1162 CA GLY A 164 -1.656 -23.327 -27.475 1.00 24.24 C ATOM 1163 C GLY A 164 -2.429 -22.096 -27.052 1.00 29.69 C ATOM 1164 O GLY A 164 -3.207 -21.543 -27.829 1.00 23.55 O ATOM 1165 H GLY A 164 -2.912 -23.570 -29.220 1.00 0.00 H ATOM 1166 N THR A 165 -2.207 -21.650 -25.821 1.00 22.29 N ATOM 1167 CA THR A 165 -2.950 -20.536 -25.246 1.00 22.19 C ATOM 1168 C THR A 165 -1.972 -19.622 -24.521 1.00 24.83 C ATOM 1169 O THR A 165 -0.958 -20.091 -23.994 1.00 24.16 O ATOM 1170 CB THR A 165 -4.028 -21.049 -24.286 1.00 24.82 C ATOM 1171 OG1 THR A 165 -4.885 -21.991 -24.960 1.00 23.68 O ATOM 1172 CG2 THR A 165 -4.880 -19.901 -23.743 1.00 23.06 C ATOM 1173 HG1 THR A 165 -4.345 -22.756 -25.281 1.00 0.00 H ATOM 1174 H THR A 165 -1.475 -22.113 -25.245 1.00 0.00 H ATOM 1175 N MET A 166 -2.252 -18.308 -24.530 1.00 20.28 N ATOM 1176 CA MET A 166 -1.479 -17.350 -23.744 1.00 21.31 C ATOM 1177 C MET A 166 -2.409 -16.309 -23.141 1.00 20.49 C ATOM 1178 O MET A 166 -3.328 -15.828 -23.804 1.00 21.55 O ATOM 1179 CB MET A 166 -0.398 -16.641 -24.578 1.00 21.95 C ATOM 1180 CG MET A 166 0.463 -15.648 -23.781 1.00 22.99 C ATOM 1181 SD MET A 166 1.863 -15.115 -24.791 1.00 31.06 S ATOM 1182 CE MET A 166 2.828 -14.123 -23.675 1.00 29.85 C ATOM 1183 H MET A 166 -3.041 -17.963 -25.113 1.00 0.00 H ATOM 1184 N VAL A 167 -2.160 -15.961 -21.876 1.00 18.89 N ATOM 1185 CA VAL A 167 -2.883 -14.900 -21.184 1.00 21.30 C ATOM 1186 C VAL A 167 -1.856 -13.949 -20.590 1.00 22.72 C ATOM 1187 O VAL A 167 -0.893 -14.401 -19.964 1.00 23.14 O ATOM 1188 CB VAL A 167 -3.790 -15.454 -20.062 1.00 18.82 C ATOM 1189 CG1 VAL A 167 -4.313 -14.330 -19.211 1.00 22.51 C ATOM 1190 CG2 VAL A 167 -4.968 -16.262 -20.672 1.00 21.56 C ATOM 1191 H VAL A 167 -1.415 -16.471 -21.360 1.00 0.00 H ATOM 1192 N ARG A 168 -2.052 -12.642 -20.784 1.00 19.29 N ATOM 1193 CA ARG A 168 -1.241 -11.614 -20.138 1.00 19.06 C ATOM 1194 C ARG A 168 -2.188 -10.701 -19.377 1.00 21.11 C ATOM 1195 O ARG A 168 -3.196 -10.247 -19.931 1.00 19.55 O ATOM 1196 CB ARG A 168 -0.413 -10.807 -21.150 1.00 23.90 C ATOM 1197 CG ARG A 168 0.484 -9.737 -20.516 1.00 22.29 C ATOM 1198 CD ARG A 168 1.424 -9.127 -21.541 1.00 21.57 C ATOM 1199 NE ARG A 168 2.229 -8.042 -20.972 1.00 24.98 N ATOM 1200 CZ ARG A 168 3.155 -7.375 -21.649 1.00 29.76 C ATOM 1201 NH1 ARG A 168 3.414 -7.697 -22.913 1.00 32.93 N ATOM 1202 NH2 ARG A 168 3.830 -6.400 -21.065 1.00 32.32 N ATOM 1203 HE ARG A 168 2.065 -7.780 -19.979 1.00 0.00 H ATOM 1204 HH12 ARG A 168 4.140 -7.175 -23.444 1.00 0.00 H ATOM 1205 HH11 ARG A 168 2.891 -8.471 -23.370 1.00 0.00 H ATOM 1206 HH22 ARG A 168 4.555 -5.878 -21.597 1.00 0.00 H ATOM 1207 HH21 ARG A 168 3.636 -6.155 -20.073 1.00 0.00 H ATOM 1208 H ARG A 168 -2.816 -12.343 -21.423 1.00 0.00 H ATOM 1209 N PHE A 169 -1.907 -10.461 -18.105 1.00 19.37 N ATOM 1210 CA PHE A 169 -2.838 -9.674 -17.313 1.00 22.12 C ATOM 1211 C PHE A 169 -2.104 -8.610 -16.513 1.00 20.13 C ATOM 1212 O PHE A 169 -0.969 -8.802 -16.060 1.00 20.45 O ATOM 1213 CB PHE A 169 -3.693 -10.557 -16.377 1.00 19.86 C ATOM 1214 CG PHE A 169 -2.924 -11.206 -15.261 1.00 19.59 C ATOM 1215 CD1 PHE A 169 -2.278 -12.419 -15.451 1.00 22.24 C ATOM 1216 CD2 PHE A 169 -2.877 -10.612 -14.001 1.00 18.23 C ATOM 1217 CE1 PHE A 169 -1.557 -13.021 -14.405 1.00 21.96 C ATOM 1218 CE2 PHE A 169 -2.181 -11.214 -12.955 1.00 23.64 C ATOM 1219 CZ PHE A 169 -1.524 -12.420 -13.152 1.00 24.28 C ATOM 1220 H PHE A 169 -1.033 -10.830 -17.679 1.00 0.00 H ATOM 1221 N TRP A 170 -2.788 -7.477 -16.365 1.00 22.71 N ATOM 1222 CA TRP A 170 -2.334 -6.314 -15.614 1.00 25.35 C ATOM 1223 C TRP A 170 -3.206 -6.199 -14.371 1.00 23.08 C ATOM 1224 O TRP A 170 -4.373 -5.797 -14.471 1.00 21.39 O ATOM 1225 CB TRP A 170 -2.447 -5.050 -16.477 1.00 23.34 C ATOM 1226 CG TRP A 170 -1.442 -4.941 -17.597 1.00 23.18 C ATOM 1227 CD1 TRP A 170 -0.319 -4.169 -17.607 1.00 26.12 C ATOM 1228 CD2 TRP A 170 -1.487 -5.593 -18.882 1.00 23.71 C ATOM 1229 NE1 TRP A 170 0.338 -4.306 -18.810 1.00 27.24 N ATOM 1230 CE2 TRP A 170 -0.357 -5.170 -19.605 1.00 25.88 C ATOM 1231 CE3 TRP A 170 -2.375 -6.483 -19.486 1.00 25.87 C ATOM 1232 CZ2 TRP A 170 -0.080 -5.620 -20.905 1.00 22.82 C ATOM 1233 CZ3 TRP A 170 -2.105 -6.928 -20.771 1.00 23.63 C ATOM 1234 CH2 TRP A 170 -0.965 -6.487 -21.470 1.00 26.13 C ATOM 1235 HE1 TRP A 170 1.223 -3.827 -19.071 1.00 0.00 H ATOM 1236 H TRP A 170 -3.720 -7.418 -16.822 1.00 0.00 H ATOM 1237 N PRO A 171 -2.708 -6.572 -13.188 1.00 23.90 N ATOM 1238 CA PRO A 171 -3.537 -6.512 -11.975 1.00 22.64 C ATOM 1239 C PRO A 171 -4.085 -5.111 -11.765 1.00 24.62 C ATOM 1240 O PRO A 171 -3.384 -4.119 -11.980 1.00 24.05 O ATOM 1241 CB PRO A 171 -2.559 -6.901 -10.855 1.00 26.45 C ATOM 1242 CG PRO A 171 -1.463 -7.630 -11.530 1.00 29.65 C ATOM 1243 CD PRO A 171 -1.345 -7.064 -12.925 1.00 28.50 C ATOM 1244 N SER A 172 -5.350 -5.035 -11.346 1.00 22.21 N ATOM 1245 CA SER A 172 -5.989 -3.735 -11.163 1.00 25.91 C ATOM 1246 C SER A 172 -5.403 -3.029 -9.948 1.00 28.27 C ATOM 1247 O SER A 172 -5.488 -3.543 -8.832 1.00 26.69 O ATOM 1248 CB SER A 172 -7.494 -3.893 -10.983 1.00 28.12 C ATOM 1249 OG SER A 172 -8.052 -2.674 -10.505 1.00 31.01 O ATOM 1250 HG SER A 172 -9.029 -2.782 -10.390 1.00 0.00 H ATOM 1251 H SER A 172 -5.883 -5.906 -11.149 1.00 0.00 H ATOM 1252 N LEU A 173 -4.845 -1.837 -10.161 1.00 27.82 N ATOM 1253 CA LEU A 173 -4.295 -1.067 -9.047 1.00 30.86 C ATOM 1254 C LEU A 173 -5.382 -0.423 -8.197 1.00 32.14 C ATOM 1255 O LEU A 173 -5.060 0.173 -7.161 1.00 33.68 O ATOM 1256 CB LEU A 173 -3.342 0.006 -9.567 1.00 36.05 C ATOM 1257 CG LEU A 173 -2.140 -0.538 -10.337 1.00 42.41 C ATOM 1258 CD1 LEU A 173 -1.158 0.577 -10.681 1.00 50.81 C ATOM 1259 CD2 LEU A 173 -1.467 -1.653 -9.553 1.00 33.00 C ATOM 1260 H LEU A 173 -4.801 -1.452 -11.126 1.00 0.00 H ATOM 1261 N GLU A 174 -6.645 -0.502 -8.627 1.00 30.73 N ATOM 1262 CA GLU A 174 -7.767 -0.141 -7.765 1.00 28.68 C ATOM 1263 C GLU A 174 -8.024 -1.190 -6.697 1.00 37.82 C ATOM 1264 O GLU A 174 -8.638 -0.878 -5.670 1.00 33.90 O ATOM 1265 CB GLU A 174 -9.029 0.055 -8.607 1.00 31.56 C ATOM 1266 CG GLU A 174 -8.887 1.135 -9.662 1.00 32.47 C ATOM 1267 CD GLU A 174 -10.071 1.200 -10.622 1.00 37.74 C ATOM 1268 OE1 GLU A 174 -11.005 0.373 -10.496 1.00 35.97 O ATOM 1269 OE2 GLU A 174 -10.058 2.079 -11.515 1.00 42.18 O ATOM 1270 H GLU A 174 -6.833 -0.828 -9.597 1.00 0.00 H ATOM 1271 N THR A 175 -7.581 -2.427 -6.920 1.00 28.22 N ATOM 1272 CA THR A 175 -7.793 -3.516 -5.976 1.00 29.50 C ATOM 1273 C THR A 175 -6.536 -3.821 -5.170 1.00 34.31 C ATOM 1274 O THR A 175 -6.587 -3.890 -3.934 1.00 29.78 O ATOM 1275 CB THR A 175 -8.270 -4.785 -6.711 1.00 33.26 C ATOM 1276 OG1 THR A 175 -9.612 -4.600 -7.183 1.00 33.50 O ATOM 1277 CG2 THR A 175 -8.250 -5.990 -5.780 1.00 31.01 C ATOM 1278 HG1 THR A 175 -10.210 -4.423 -6.414 1.00 0.00 H ATOM 1279 H THR A 175 -7.064 -2.622 -7.801 1.00 0.00 H ATOM 1280 N PHE A 176 -5.398 -3.968 -5.842 1.00 26.73 N ATOM 1281 CA PHE A 176 -4.168 -4.400 -5.184 1.00 27.85 C ATOM 1282 C PHE A 176 -3.378 -3.183 -4.710 1.00 28.26 C ATOM 1283 O PHE A 176 -2.955 -2.351 -5.517 1.00 31.51 O ATOM 1284 CB PHE A 176 -3.367 -5.298 -6.128 1.00 28.31 C ATOM 1285 CG PHE A 176 -4.101 -6.570 -6.465 1.00 29.09 C ATOM 1286 CD1 PHE A 176 -4.171 -7.601 -5.539 1.00 27.14 C ATOM 1287 CD2 PHE A 176 -4.793 -6.701 -7.669 1.00 31.19 C ATOM 1288 CE1 PHE A 176 -4.876 -8.758 -5.809 1.00 29.86 C ATOM 1289 CE2 PHE A 176 -5.510 -7.865 -7.951 1.00 28.14 C ATOM 1290 CZ PHE A 176 -5.553 -8.890 -7.016 1.00 30.95 C ATOM 1291 H PHE A 176 -5.384 -3.770 -6.863 1.00 0.00 H ATOM 1292 N THR A 177 -3.196 -3.086 -3.398 1.00 34.18 N ATOM 1293 CA THR A 177 -2.572 -1.943 -2.749 1.00 39.19 C ATOM 1294 C THR A 177 -1.305 -2.381 -2.019 1.00 40.25 C ATOM 1295 O THR A 177 -1.072 -3.574 -1.804 1.00 38.04 O ATOM 1296 CB THR A 177 -3.564 -1.282 -1.778 1.00 35.26 C ATOM 1297 OG1 THR A 177 -4.119 -2.279 -0.908 1.00 35.61 O ATOM 1298 CG2 THR A 177 -4.705 -0.641 -2.556 1.00 34.53 C ATOM 1299 HG1 THR A 177 -3.390 -2.709 -0.394 1.00 0.00 H ATOM 1300 H THR A 177 -3.518 -3.873 -2.799 1.00 0.00 H ATOM 1301 N ASN A 178 -0.470 -1.397 -1.661 1.00 40.06 N ATOM 1302 CA ASN A 178 0.771 -1.638 -0.925 1.00 41.84 C ATOM 1303 C ASN A 178 1.750 -2.454 -1.766 1.00 45.29 C ATOM 1304 O ASN A 178 2.628 -1.884 -2.417 1.00 39.62 O ATOM 1305 CB ASN A 178 0.478 -2.338 0.405 1.00 46.24 C ATOM 1306 CG ASN A 178 1.708 -2.473 1.291 1.00 45.22 C ATOM 1307 OD1 ASN A 178 2.688 -1.742 1.144 1.00 48.00 O ATOM 1308 ND2 ASN A 178 1.655 -3.420 2.218 1.00 49.24 N ATOM 1309 HD22 ASN A 178 0.806 -4.014 2.306 1.00 0.00 H ATOM 1310 HD21 ASN A 178 2.462 -3.568 2.857 1.00 0.00 H ATOM 1311 H ASN A 178 -0.714 -0.419 -1.917 1.00 0.00 H ATOM 1312 N VAL A 179 1.606 -3.780 -1.757 1.00 38.36 N ATOM 1313 CA VAL A 179 2.410 -4.675 -2.593 1.00 35.48 C ATOM 1314 C VAL A 179 1.744 -4.737 -3.967 1.00 35.01 C ATOM 1315 O VAL A 179 0.718 -5.391 -4.133 1.00 35.17 O ATOM 1316 CB VAL A 179 2.543 -6.070 -1.976 1.00 36.49 C ATOM 1317 CG1 VAL A 179 3.478 -6.934 -2.816 1.00 39.59 C ATOM 1318 CG2 VAL A 179 3.014 -5.980 -0.534 1.00 41.76 C ATOM 1319 H VAL A 179 0.891 -4.197 -1.128 1.00 0.00 H ATOM 1320 N THR A 180 2.329 -4.048 -4.950 1.00 32.09 N ATOM 1321 CA THR A 180 1.823 -3.984 -6.314 1.00 37.65 C ATOM 1322 C THR A 180 2.784 -4.547 -7.349 1.00 33.23 C ATOM 1323 O THR A 180 2.407 -4.664 -8.520 1.00 42.11 O ATOM 1324 CB THR A 180 1.516 -2.532 -6.704 1.00 36.84 C ATOM 1325 OG1 THR A 180 2.725 -1.771 -6.619 1.00 37.05 O ATOM 1326 CG2 THR A 180 0.474 -1.930 -5.773 1.00 34.26 C ATOM 1327 HG1 THR A 180 2.540 -0.831 -6.869 1.00 0.00 H ATOM 1328 H THR A 180 3.200 -3.525 -4.728 1.00 0.00 H ATOM 1329 N GLU A 181 4.013 -4.871 -6.969 1.00 35.94 N ATOM 1330 CA GLU A 181 4.994 -5.417 -7.891 1.00 36.38 C ATOM 1331 C GLU A 181 5.231 -6.881 -7.556 1.00 35.33 C ATOM 1332 O GLU A 181 5.180 -7.278 -6.388 1.00 33.29 O ATOM 1333 CB GLU A 181 6.306 -4.628 -7.835 1.00 36.63 C ATOM 1334 CG GLU A 181 6.132 -3.142 -8.113 1.00 39.68 C ATOM 1335 CD GLU A 181 7.427 -2.361 -8.013 1.00 44.02 C ATOM 1336 OE1 GLU A 181 8.509 -2.974 -8.142 1.00 41.47 O ATOM 1337 OE2 GLU A 181 7.362 -1.129 -7.800 1.00 48.77 O ATOM 1338 H GLU A 181 4.284 -4.729 -5.975 1.00 0.00 H ATOM 1339 N PHE A 182 5.455 -7.684 -8.589 1.00 31.91 N ATOM 1340 CA PHE A 182 5.630 -9.112 -8.393 1.00 33.68 C ATOM 1341 C PHE A 182 7.011 -9.408 -7.828 1.00 35.82 C ATOM 1342 O PHE A 182 8.003 -8.781 -8.213 1.00 35.74 O ATOM 1343 CB PHE A 182 5.417 -9.849 -9.710 1.00 28.85 C ATOM 1344 CG PHE A 182 3.983 -9.908 -10.124 1.00 27.65 C ATOM 1345 CD1 PHE A 182 3.114 -10.801 -9.514 1.00 28.30 C ATOM 1346 CD2 PHE A 182 3.490 -9.035 -11.071 1.00 26.85 C ATOM 1347 CE1 PHE A 182 1.778 -10.839 -9.864 1.00 25.92 C ATOM 1348 CE2 PHE A 182 2.146 -9.081 -11.446 1.00 31.12 C ATOM 1349 CZ PHE A 182 1.298 -9.991 -10.837 1.00 28.82 C ATOM 1350 H PHE A 182 5.506 -7.286 -9.549 1.00 0.00 H ATOM 1351 N GLU A 183 7.062 -10.357 -6.899 1.00 31.18 N ATOM 1352 CA GLU A 183 8.313 -10.799 -6.293 1.00 40.11 C ATOM 1353 C GLU A 183 8.734 -12.116 -6.932 1.00 32.75 C ATOM 1354 O GLU A 183 8.033 -13.129 -6.805 1.00 33.16 O ATOM 1355 CB GLU A 183 8.173 -10.949 -4.780 1.00 34.00 C ATOM 1356 CG GLU A 183 9.512 -11.154 -4.062 1.00 46.07 C ATOM 1357 CD GLU A 183 9.387 -11.156 -2.548 1.00 51.37 C ATOM 1358 OE1 GLU A 183 8.397 -10.604 -2.022 1.00 60.06 O ATOM 1359 OE2 GLU A 183 10.287 -11.710 -1.881 1.00 54.08 O ATOM 1360 H GLU A 183 6.174 -10.803 -6.592 1.00 0.00 H ATOM 1361 N TYR A 184 9.886 -12.095 -7.603 1.00 33.07 N ATOM 1362 CA TYR A 184 10.353 -13.258 -8.353 1.00 31.32 C ATOM 1363 C TYR A 184 10.375 -14.524 -7.508 1.00 34.90 C ATOM 1364 O TYR A 184 9.943 -15.588 -7.965 1.00 33.20 O ATOM 1365 CB TYR A 184 11.746 -12.980 -8.929 1.00 35.94 C ATOM 1366 CG TYR A 184 12.303 -14.104 -9.783 1.00 31.56 C ATOM 1367 CD1 TYR A 184 12.903 -15.217 -9.202 1.00 36.04 C ATOM 1368 CD2 TYR A 184 12.226 -14.054 -11.168 1.00 35.15 C ATOM 1369 CE1 TYR A 184 13.412 -16.246 -9.981 1.00 35.01 C ATOM 1370 CE2 TYR A 184 12.731 -15.083 -11.951 1.00 36.13 C ATOM 1371 CZ TYR A 184 13.324 -16.171 -11.350 1.00 37.91 C ATOM 1372 OH TYR A 184 13.829 -17.195 -12.128 1.00 37.64 O ATOM 1373 HH TYR A 184 14.217 -17.892 -11.542 1.00 0.00 H ATOM 1374 H TYR A 184 10.465 -11.231 -7.592 1.00 0.00 H ATOM 1375 N GLU A 185 10.881 -14.437 -6.274 1.00 34.79 N ATOM 1376 CA GLU A 185 11.075 -15.656 -5.497 1.00 35.57 C ATOM 1377 C GLU A 185 9.755 -16.253 -5.032 1.00 33.16 C ATOM 1378 O GLU A 185 9.669 -17.471 -4.836 1.00 32.55 O ATOM 1379 CB GLU A 185 11.995 -15.395 -4.303 1.00 35.67 C ATOM 1380 CG GLU A 185 12.380 -16.665 -3.546 1.00 38.81 C ATOM 1381 CD GLU A 185 12.803 -17.814 -4.466 1.00 37.04 C ATOM 1382 OE1 GLU A 185 13.599 -17.591 -5.403 1.00 42.18 O ATOM 1383 OE2 GLU A 185 12.335 -18.951 -4.247 1.00 33.24 O ATOM 1384 H GLU A 185 11.133 -13.511 -5.873 1.00 0.00 H ATOM 1385 N ILE A 186 8.714 -15.433 -4.860 1.00 27.52 N ATOM 1386 CA ILE A 186 7.419 -15.990 -4.488 1.00 26.89 C ATOM 1387 C ILE A 186 6.869 -16.842 -5.627 1.00 27.84 C ATOM 1388 O ILE A 186 6.329 -17.938 -5.405 1.00 27.11 O ATOM 1389 CB ILE A 186 6.434 -14.878 -4.092 1.00 30.97 C ATOM 1390 CG1 ILE A 186 6.906 -14.175 -2.819 1.00 35.22 C ATOM 1391 CG2 ILE A 186 5.022 -15.461 -3.899 1.00 30.04 C ATOM 1392 CD1 ILE A 186 5.990 -13.050 -2.383 1.00 31.70 C ATOM 1393 H ILE A 186 8.826 -14.407 -4.990 1.00 0.00 H ATOM 1394 N LEU A 187 7.000 -16.358 -6.863 1.00 27.98 N ATOM 1395 CA LEU A 187 6.561 -17.164 -7.997 1.00 27.61 C ATOM 1396 C LEU A 187 7.421 -18.409 -8.148 1.00 27.84 C ATOM 1397 O LEU A 187 6.894 -19.516 -8.327 1.00 28.05 O ATOM 1398 CB LEU A 187 6.585 -16.336 -9.283 1.00 26.57 C ATOM 1399 CG LEU A 187 5.638 -15.132 -9.258 1.00 30.83 C ATOM 1400 CD1 LEU A 187 5.611 -14.437 -10.600 1.00 24.55 C ATOM 1401 CD2 LEU A 187 4.227 -15.528 -8.854 1.00 24.07 C ATOM 1402 H LEU A 187 7.411 -15.415 -7.017 1.00 0.00 H ATOM 1403 N ALA A 188 8.746 -18.248 -8.050 1.00 28.86 N ATOM 1404 CA ALA A 188 9.659 -19.371 -8.249 1.00 28.64 C ATOM 1405 C ALA A 188 9.403 -20.493 -7.251 1.00 27.29 C ATOM 1406 O ALA A 188 9.428 -21.673 -7.619 1.00 27.89 O ATOM 1407 CB ALA A 188 11.106 -18.890 -8.145 1.00 30.11 C ATOM 1408 H ALA A 188 9.132 -17.308 -7.829 1.00 0.00 H ATOM 1409 N LYS A 189 9.180 -20.152 -5.973 1.00 25.18 N ATOM 1410 CA LYS A 189 8.956 -21.195 -4.978 1.00 32.19 C ATOM 1411 C LYS A 189 7.753 -22.056 -5.338 1.00 32.30 C ATOM 1412 O LYS A 189 7.794 -23.285 -5.200 1.00 29.10 O ATOM 1413 CB LYS A 189 8.765 -20.587 -3.583 1.00 32.06 C ATOM 1414 CG LYS A 189 8.453 -21.640 -2.530 1.00 37.79 C ATOM 1415 CD LYS A 189 8.085 -21.026 -1.177 1.00 52.16 C ATOM 1416 CE LYS A 189 7.971 -22.095 -0.086 1.00 48.83 C ATOM 1417 NZ LYS A 189 7.058 -23.227 -0.442 1.00 47.30 N ATOM 1418 HZ1 LYS A 189 6.101 -22.858 -0.615 1.00 0.00 H ATOM 1419 HZ2 LYS A 189 7.409 -23.697 -1.300 1.00 0.00 H ATOM 1420 HZ3 LYS A 189 7.031 -23.909 0.342 1.00 0.00 H ATOM 1421 H LYS A 189 9.167 -19.150 -5.693 1.00 0.00 H ATOM 1422 N ARG A 190 6.679 -21.429 -5.825 1.00 27.29 N ATOM 1423 CA ARG A 190 5.458 -22.174 -6.111 1.00 25.56 C ATOM 1424 C ARG A 190 5.609 -23.009 -7.372 1.00 22.11 C ATOM 1425 O ARG A 190 5.169 -24.165 -7.411 1.00 21.37 O ATOM 1426 CB ARG A 190 4.274 -21.213 -6.259 1.00 25.85 C ATOM 1427 CG ARG A 190 2.916 -21.903 -6.568 1.00 22.77 C ATOM 1428 CD ARG A 190 2.369 -22.677 -5.348 1.00 27.79 C ATOM 1429 NE ARG A 190 1.985 -21.788 -4.240 1.00 27.02 N ATOM 1430 CZ ARG A 190 0.751 -21.334 -4.038 1.00 27.80 C ATOM 1431 NH1 ARG A 190 -0.234 -21.689 -4.854 1.00 37.23 N ATOM 1432 NH2 ARG A 190 0.494 -20.532 -3.004 1.00 30.91 N ATOM 1433 HE ARG A 190 2.726 -21.496 -3.572 1.00 0.00 H ATOM 1434 HH12 ARG A 190 -1.197 -21.332 -4.693 1.00 0.00 H ATOM 1435 HH11 ARG A 190 -0.042 -22.324 -5.655 1.00 0.00 H ATOM 1436 HH22 ARG A 190 -0.471 -20.178 -2.848 1.00 0.00 H ATOM 1437 HH21 ARG A 190 1.259 -20.260 -2.354 1.00 0.00 H ATOM 1438 H ARG A 190 6.713 -20.405 -6.001 1.00 0.00 H ATOM 1439 N LEU A 191 6.198 -22.422 -8.420 1.00 24.27 N ATOM 1440 CA LEU A 191 6.401 -23.154 -9.670 1.00 25.44 C ATOM 1441 C LEU A 191 7.299 -24.368 -9.452 1.00 26.10 C ATOM 1442 O LEU A 191 7.086 -25.427 -10.062 1.00 23.95 O ATOM 1443 CB LEU A 191 6.988 -22.220 -10.735 1.00 24.07 C ATOM 1444 CG LEU A 191 6.072 -21.061 -11.158 1.00 27.43 C ATOM 1445 CD1 LEU A 191 6.766 -20.084 -12.118 1.00 24.52 C ATOM 1446 CD2 LEU A 191 4.784 -21.625 -11.789 1.00 24.99 C ATOM 1447 H LEU A 191 6.515 -21.434 -8.345 1.00 0.00 H ATOM 1448 N ARG A 192 8.308 -24.236 -8.585 1.00 26.22 N ATOM 1449 CA ARG A 192 9.135 -25.390 -8.222 1.00 26.35 C ATOM 1450 C ARG A 192 8.297 -26.503 -7.590 1.00 25.37 C ATOM 1451 O ARG A 192 8.394 -27.674 -7.993 1.00 26.24 O ATOM 1452 CB ARG A 192 10.257 -24.954 -7.276 1.00 29.72 C ATOM 1453 CG ARG A 192 11.083 -26.113 -6.751 1.00 29.44 C ATOM 1454 CD ARG A 192 12.240 -25.631 -5.860 1.00 34.91 C ATOM 1455 NE ARG A 192 13.015 -26.765 -5.353 1.00 35.79 N ATOM 1456 CZ ARG A 192 12.739 -27.415 -4.227 1.00 38.86 C ATOM 1457 NH1 ARG A 192 11.710 -27.047 -3.477 1.00 35.91 N ATOM 1458 NH2 ARG A 192 13.498 -28.434 -3.842 1.00 46.87 N ATOM 1459 HE ARG A 192 13.834 -27.082 -5.910 1.00 0.00 H ATOM 1460 HH12 ARG A 192 11.499 -27.559 -2.597 1.00 0.00 H ATOM 1461 HH11 ARG A 192 11.114 -26.246 -3.769 1.00 0.00 H ATOM 1462 HH22 ARG A 192 13.280 -28.941 -2.961 1.00 0.00 H ATOM 1463 HH21 ARG A 192 14.311 -28.725 -4.422 1.00 0.00 H ATOM 1464 H ARG A 192 8.508 -23.306 -8.164 1.00 0.00 H ATOM 1465 N GLU A 193 7.443 -26.161 -6.611 1.00 25.81 N ATOM 1466 CA GLU A 193 6.572 -27.184 -6.025 1.00 20.02 C ATOM 1467 C GLU A 193 5.711 -27.844 -7.090 1.00 28.92 C ATOM 1468 O GLU A 193 5.516 -29.066 -7.084 1.00 23.00 O ATOM 1469 CB GLU A 193 5.655 -26.594 -4.948 1.00 26.06 C ATOM 1470 CG GLU A 193 6.333 -25.879 -3.778 1.00 30.98 C ATOM 1471 CD GLU A 193 6.858 -26.791 -2.664 1.00 28.53 C ATOM 1472 OE1 GLU A 193 6.354 -27.914 -2.428 1.00 25.92 O ATOM 1473 OE2 GLU A 193 7.808 -26.348 -2.007 1.00 36.25 O ATOM 1474 H GLU A 193 7.400 -25.179 -6.272 1.00 0.00 H ATOM 1475 N LEU A 194 5.169 -27.038 -8.005 1.00 25.04 N ATOM 1476 CA LEU A 194 4.271 -27.576 -9.021 1.00 20.13 C ATOM 1477 C LEU A 194 4.994 -28.510 -9.984 1.00 22.35 C ATOM 1478 O LEU A 194 4.375 -29.445 -10.508 1.00 22.72 O ATOM 1479 CB LEU A 194 3.620 -26.433 -9.795 1.00 22.43 C ATOM 1480 CG LEU A 194 2.556 -25.647 -9.027 1.00 22.17 C ATOM 1481 CD1 LEU A 194 2.258 -24.309 -9.739 1.00 24.06 C ATOM 1482 CD2 LEU A 194 1.319 -26.512 -8.943 1.00 22.54 C ATOM 1483 H LEU A 194 5.388 -26.021 -7.994 1.00 0.00 H ATOM 1484 N SER A 195 6.293 -28.295 -10.204 1.00 23.00 N ATOM 1485 CA SER A 195 7.010 -29.136 -11.163 1.00 25.83 C ATOM 1486 C SER A 195 7.187 -30.553 -10.630 1.00 27.42 C ATOM 1487 O SER A 195 7.142 -31.520 -11.397 1.00 26.18 O ATOM 1488 CB SER A 195 8.366 -28.523 -11.521 1.00 27.07 C ATOM 1489 OG SER A 195 9.255 -28.484 -10.407 1.00 29.52 O ATOM 1490 HG SER A 195 8.853 -27.939 -9.685 1.00 0.00 H ATOM 1491 H SER A 195 6.792 -27.536 -9.698 1.00 0.00 H ATOM 1492 N PHE A 196 7.404 -30.701 -9.320 1.00 22.21 N ATOM 1493 CA PHE A 196 7.445 -32.043 -8.742 1.00 23.39 C ATOM 1494 C PHE A 196 6.092 -32.744 -8.841 1.00 27.29 C ATOM 1495 O PHE A 196 6.020 -33.948 -9.116 1.00 21.51 O ATOM 1496 CB PHE A 196 7.884 -31.963 -7.277 1.00 23.34 C ATOM 1497 CG PHE A 196 9.354 -31.716 -7.095 1.00 28.48 C ATOM 1498 CD1 PHE A 196 9.860 -30.420 -7.016 1.00 26.88 C ATOM 1499 CD2 PHE A 196 10.230 -32.781 -6.982 1.00 31.32 C ATOM 1500 CE1 PHE A 196 11.225 -30.189 -6.833 1.00 27.50 C ATOM 1501 CE2 PHE A 196 11.596 -32.561 -6.801 1.00 36.03 C ATOM 1502 CZ PHE A 196 12.091 -31.267 -6.724 1.00 28.70 C ATOM 1503 H PHE A 196 7.543 -29.866 -8.715 1.00 0.00 H ATOM 1504 N LEU A 197 5.006 -32.022 -8.557 1.00 25.00 N ATOM 1505 CA LEU A 197 3.701 -32.659 -8.545 1.00 23.30 C ATOM 1506 C LEU A 197 3.240 -32.983 -9.958 1.00 25.31 C ATOM 1507 O LEU A 197 2.558 -33.991 -10.186 1.00 29.12 O ATOM 1508 CB LEU A 197 2.696 -31.743 -7.854 1.00 22.41 C ATOM 1509 CG LEU A 197 1.280 -32.276 -7.782 1.00 25.00 C ATOM 1510 CD1 LEU A 197 1.244 -33.568 -6.985 1.00 32.34 C ATOM 1511 CD2 LEU A 197 0.370 -31.212 -7.166 1.00 34.08 C ATOM 1512 H LEU A 197 5.094 -31.008 -8.345 1.00 0.00 H ATOM 1513 N ASN A 198 3.593 -32.136 -10.913 1.00 25.15 N ATOM 1514 CA ASN A 198 3.225 -32.324 -12.310 1.00 26.60 C ATOM 1515 C ASN A 198 4.473 -32.735 -13.085 1.00 30.24 C ATOM 1516 O ASN A 198 5.004 -31.993 -13.901 1.00 30.16 O ATOM 1517 CB ASN A 198 2.615 -31.034 -12.861 1.00 25.24 C ATOM 1518 CG ASN A 198 1.396 -30.589 -12.081 1.00 25.06 C ATOM 1519 OD1 ASN A 198 1.461 -29.688 -11.230 1.00 28.80 O ATOM 1520 ND2 ASN A 198 0.268 -31.219 -12.366 1.00 24.14 N ATOM 1521 HD22 ASN A 198 0.259 -31.969 -13.087 1.00 0.00 H ATOM 1522 HD21 ASN A 198 -0.610 -30.965 -11.869 1.00 0.00 H ATOM 1523 H ASN A 198 4.157 -31.301 -10.655 1.00 0.00 H ATOM 1524 N SER A 199 4.944 -33.944 -12.799 1.00 30.20 N ATOM 1525 CA SER A 199 6.156 -34.437 -13.430 1.00 30.52 C ATOM 1526 C SER A 199 5.975 -34.487 -14.938 1.00 31.73 C ATOM 1527 O SER A 199 4.885 -34.767 -15.443 1.00 37.58 O ATOM 1528 CB SER A 199 6.505 -35.822 -12.892 1.00 33.29 C ATOM 1529 OG SER A 199 6.618 -35.788 -11.486 1.00 34.41 O ATOM 1530 HG SER A 199 5.757 -35.496 -11.094 1.00 0.00 H ATOM 1531 H SER A 199 4.439 -34.544 -12.116 1.00 0.00 H ATOM 1532 N GLY A 200 7.047 -34.197 -15.662 1.00 40.46 N ATOM 1533 CA GLY A 200 6.974 -34.194 -17.102 1.00 38.23 C ATOM 1534 C GLY A 200 6.460 -32.904 -17.704 1.00 34.50 C ATOM 1535 O GLY A 200 6.540 -32.742 -18.923 1.00 38.43 O ATOM 1536 H GLY A 200 7.945 -33.971 -15.189 1.00 0.00 H ATOM 1537 N VAL A 201 5.952 -31.971 -16.895 1.00 35.71 N ATOM 1538 CA VAL A 201 5.635 -30.630 -17.379 1.00 28.69 C ATOM 1539 C VAL A 201 6.832 -29.726 -17.143 1.00 31.56 C ATOM 1540 O VAL A 201 7.338 -29.622 -16.017 1.00 34.09 O ATOM 1541 CB VAL A 201 4.392 -30.057 -16.688 1.00 28.90 C ATOM 1542 CG1 VAL A 201 4.189 -28.623 -17.154 1.00 30.39 C ATOM 1543 CG2 VAL A 201 3.161 -30.903 -17.006 1.00 25.27 C ATOM 1544 H VAL A 201 5.778 -32.205 -15.897 1.00 0.00 H ATOM 1545 N SER A 202 7.272 -29.058 -18.197 1.00 25.49 N ATOM 1546 CA SER A 202 8.390 -28.131 -18.113 1.00 26.94 C ATOM 1547 C SER A 202 7.863 -26.736 -17.826 1.00 27.24 C ATOM 1548 O SER A 202 6.978 -26.252 -18.530 1.00 26.30 O ATOM 1549 CB SER A 202 9.183 -28.138 -19.423 1.00 26.97 C ATOM 1550 OG SER A 202 10.044 -27.015 -19.500 1.00 35.55 O ATOM 1551 HG SER A 202 10.681 -27.036 -18.742 1.00 0.00 H ATOM 1552 H SER A 202 6.804 -29.200 -19.115 1.00 0.00 H ATOM 1553 N ILE A 203 8.410 -26.084 -16.803 1.00 26.29 N ATOM 1554 CA ILE A 203 7.955 -24.759 -16.397 1.00 27.90 C ATOM 1555 C ILE A 203 9.137 -23.806 -16.451 1.00 27.16 C ATOM 1556 O ILE A 203 10.094 -23.958 -15.681 1.00 28.32 O ATOM 1557 CB ILE A 203 7.345 -24.780 -14.986 1.00 26.41 C ATOM 1558 CG1 ILE A 203 6.196 -25.786 -14.924 1.00 26.28 C ATOM 1559 CG2 ILE A 203 6.864 -23.387 -14.606 1.00 25.12 C ATOM 1560 CD1 ILE A 203 5.536 -25.878 -13.536 1.00 29.74 C ATOM 1561 H ILE A 203 9.186 -26.533 -16.276 1.00 0.00 H ATOM 1562 N ARG A 204 9.071 -22.815 -17.336 1.00 25.25 N ATOM 1563 CA ARG A 204 10.096 -21.782 -17.396 1.00 26.80 C ATOM 1564 C ARG A 204 9.575 -20.493 -16.768 1.00 30.86 C ATOM 1565 O ARG A 204 8.417 -20.113 -16.972 1.00 26.35 O ATOM 1566 CB ARG A 204 10.544 -21.542 -18.837 1.00 31.69 C ATOM 1567 CG ARG A 204 11.289 -22.745 -19.427 1.00 35.46 C ATOM 1568 CD ARG A 204 11.625 -22.547 -20.893 1.00 45.96 C ATOM 1569 NE ARG A 204 12.327 -23.705 -21.444 1.00 38.34 N ATOM 1570 CZ ARG A 204 13.654 -23.835 -21.454 1.00 40.75 C ATOM 1571 NH1 ARG A 204 14.419 -22.885 -20.932 1.00 35.27 N ATOM 1572 NH2 ARG A 204 14.217 -24.916 -21.980 1.00 42.02 N ATOM 1573 HE ARG A 204 11.757 -24.473 -21.853 1.00 0.00 H ATOM 1574 HH12 ARG A 204 15.454 -22.988 -20.940 1.00 0.00 H ATOM 1575 HH11 ARG A 204 13.984 -22.038 -20.514 1.00 0.00 H ATOM 1576 HH22 ARG A 204 15.252 -25.013 -21.985 1.00 0.00 H ATOM 1577 HH21 ARG A 204 13.623 -25.666 -22.387 1.00 0.00 H ATOM 1578 H ARG A 204 8.271 -22.777 -17.999 1.00 0.00 H ATOM 1579 N LEU A 205 10.432 -19.830 -15.989 1.00 24.82 N ATOM 1580 CA LEU A 205 10.114 -18.556 -15.366 1.00 23.23 C ATOM 1581 C LEU A 205 11.135 -17.524 -15.817 1.00 25.52 C ATOM 1582 O LEU A 205 12.341 -17.775 -15.750 1.00 28.38 O ATOM 1583 CB LEU A 205 10.111 -18.673 -13.832 1.00 28.80 C ATOM 1584 CG LEU A 205 9.970 -17.379 -13.029 1.00 26.68 C ATOM 1585 CD1 LEU A 205 8.630 -16.683 -13.333 1.00 29.35 C ATOM 1586 CD2 LEU A 205 10.098 -17.681 -11.522 1.00 27.89 C ATOM 1587 H LEU A 205 11.371 -20.244 -15.820 1.00 0.00 H ATOM 1588 N ARG A 206 10.655 -16.379 -16.302 1.00 29.41 N ATOM 1589 CA ARG A 206 11.527 -15.333 -16.820 1.00 32.28 C ATOM 1590 C ARG A 206 11.145 -13.985 -16.219 1.00 33.51 C ATOM 1591 O ARG A 206 9.962 -13.633 -16.159 1.00 28.41 O ATOM 1592 CB ARG A 206 11.443 -15.253 -18.351 1.00 33.46 C ATOM 1593 CG ARG A 206 11.843 -16.526 -19.087 1.00 37.81 C ATOM 1594 CD ARG A 206 11.374 -16.485 -20.541 1.00 43.39 C ATOM 1595 NE ARG A 206 11.892 -17.615 -21.312 1.00 45.79 N ATOM 1596 CZ ARG A 206 11.495 -17.935 -22.540 1.00 48.98 C ATOM 1597 NH1 ARG A 206 10.560 -17.216 -23.148 1.00 47.87 N ATOM 1598 NH2 ARG A 206 12.032 -18.979 -23.161 1.00 55.80 N ATOM 1599 HE ARG A 206 12.621 -18.209 -20.869 1.00 0.00 H ATOM 1600 HH12 ARG A 206 10.252 -17.469 -24.109 1.00 0.00 H ATOM 1601 HH11 ARG A 206 10.135 -16.399 -22.664 1.00 0.00 H ATOM 1602 HH22 ARG A 206 11.721 -19.229 -24.121 1.00 0.00 H ATOM 1603 HH21 ARG A 206 12.763 -19.546 -22.687 1.00 0.00 H ATOM 1604 H ARG A 206 9.626 -16.228 -16.311 1.00 0.00 H ATOM 1605 N ASP A 207 12.145 -13.218 -15.795 1.00 31.81 N ATOM 1606 CA ASP A 207 11.920 -11.873 -15.276 1.00 32.18 C ATOM 1607 C ASP A 207 12.562 -10.870 -16.229 1.00 36.63 C ATOM 1608 O ASP A 207 13.793 -10.770 -16.300 1.00 39.10 O ATOM 1609 CB ASP A 207 12.485 -11.729 -13.867 1.00 31.92 C ATOM 1610 CG ASP A 207 11.975 -10.490 -13.159 1.00 35.36 C ATOM 1611 OD1 ASP A 207 11.555 -9.534 -13.839 1.00 34.57 O ATOM 1612 OD2 ASP A 207 11.980 -10.472 -11.912 1.00 37.22 O ATOM 1613 H ASP A 207 13.116 -13.588 -15.834 1.00 0.00 H ATOM 1614 N LYS A 208 11.732 -10.116 -16.953 1.00 32.30 N ATOM 1615 CA LYS A 208 12.276 -9.142 -17.892 1.00 33.22 C ATOM 1616 C LYS A 208 12.750 -7.865 -17.208 1.00 35.59 C ATOM 1617 O LYS A 208 13.353 -7.012 -17.870 1.00 46.12 O ATOM 1618 CB LYS A 208 11.241 -8.809 -18.971 1.00 35.73 C ATOM 1619 CG LYS A 208 10.868 -10.005 -19.830 1.00 36.81 C ATOM 1620 CD LYS A 208 9.848 -9.655 -20.896 1.00 38.25 C ATOM 1621 CE LYS A 208 10.506 -8.976 -22.086 1.00 46.01 C ATOM 1622 NZ LYS A 208 9.639 -9.015 -23.290 1.00 37.74 N ATOM 1623 HZ1 LYS A 208 9.445 -10.005 -23.544 1.00 0.00 H ATOM 1624 HZ2 LYS A 208 8.744 -8.526 -23.087 1.00 0.00 H ATOM 1625 HZ3 LYS A 208 10.123 -8.542 -24.080 1.00 0.00 H ATOM 1626 H LYS A 208 10.703 -10.223 -16.848 1.00 0.00 H ATOM 1627 N ARG A 209 12.508 -7.716 -15.910 1.00 36.18 N ATOM 1628 CA ARG A 209 12.966 -6.525 -15.205 1.00 37.42 C ATOM 1629 C ARG A 209 14.470 -6.559 -14.959 1.00 47.01 C ATOM 1630 O ARG A 209 15.148 -5.535 -15.104 1.00 48.19 O ATOM 1631 CB ARG A 209 12.215 -6.386 -13.885 1.00 40.05 C ATOM 1632 CG ARG A 209 10.722 -6.196 -14.058 1.00 40.16 C ATOM 1633 CD ARG A 209 10.010 -6.279 -12.734 1.00 39.96 C ATOM 1634 NE ARG A 209 10.249 -7.557 -12.072 1.00 39.75 N ATOM 1635 CZ ARG A 209 9.619 -7.961 -10.974 1.00 37.49 C ATOM 1636 NH1 ARG A 209 8.700 -7.190 -10.406 1.00 38.88 N ATOM 1637 NH2 ARG A 209 9.903 -9.143 -10.446 1.00 31.42 N ATOM 1638 HE ARG A 209 10.959 -8.194 -12.487 1.00 0.00 H ATOM 1639 HH12 ARG A 209 8.210 -7.512 -9.547 1.00 0.00 H ATOM 1640 HH11 ARG A 209 8.470 -6.264 -10.820 1.00 0.00 H ATOM 1641 HH22 ARG A 209 9.411 -9.460 -9.587 1.00 0.00 H ATOM 1642 HH21 ARG A 209 10.618 -9.753 -10.891 1.00 0.00 H ATOM 1643 H ARG A 209 11.988 -8.454 -15.393 1.00 0.00 H ATOM 1644 N ASP A 210 15.005 -7.727 -14.591 1.00 38.54 N ATOM 1645 CA ASP A 210 16.423 -7.873 -14.283 1.00 38.98 C ATOM 1646 C ASP A 210 17.071 -9.060 -14.988 1.00 47.78 C ATOM 1647 O ASP A 210 18.240 -9.360 -14.714 1.00 47.09 O ATOM 1648 CB ASP A 210 16.628 -8.002 -12.771 1.00 50.85 C ATOM 1649 CG ASP A 210 15.956 -9.233 -12.190 1.00 48.62 C ATOM 1650 OD1 ASP A 210 15.246 -9.945 -12.935 1.00 44.49 O ATOM 1651 OD2 ASP A 210 16.137 -9.492 -10.982 1.00 52.00 O ATOM 1652 H ASP A 210 14.388 -8.562 -14.522 1.00 0.00 H ATOM 1653 N GLY A 211 16.350 -9.748 -15.878 1.00 45.43 N ATOM 1654 CA GLY A 211 16.914 -10.836 -16.652 1.00 42.62 C ATOM 1655 C GLY A 211 16.966 -12.181 -15.958 1.00 41.34 C ATOM 1656 O GLY A 211 17.466 -13.146 -16.551 1.00 45.58 O ATOM 1657 H GLY A 211 15.351 -9.495 -16.020 1.00 0.00 H ATOM 1658 N LYS A 212 16.456 -12.290 -14.738 1.00 36.29 N ATOM 1659 CA LYS A 212 16.556 -13.539 -13.999 1.00 40.28 C ATOM 1660 C LYS A 212 15.632 -14.592 -14.609 1.00 44.81 C ATOM 1661 O LYS A 212 14.527 -14.280 -15.061 1.00 42.44 O ATOM 1662 CB LYS A 212 16.222 -13.302 -12.526 1.00 40.59 C ATOM 1663 CG LYS A 212 16.701 -14.405 -11.597 1.00 50.04 C ATOM 1664 CD LYS A 212 17.195 -13.831 -10.275 1.00 61.65 C ATOM 1665 CE LYS A 212 17.667 -14.932 -9.332 1.00 64.66 C ATOM 1666 NZ LYS A 212 16.618 -15.329 -8.345 1.00 58.67 N ATOM 1667 HZ1 LYS A 212 16.356 -14.504 -7.769 1.00 0.00 H ATOM 1668 HZ2 LYS A 212 15.781 -15.679 -8.853 1.00 0.00 H ATOM 1669 HZ3 LYS A 212 16.990 -16.080 -7.729 1.00 0.00 H ATOM 1670 H LYS A 212 15.979 -11.473 -14.305 1.00 0.00 H ATOM 1671 N GLU A 213 16.103 -15.843 -14.632 1.00 43.43 N ATOM 1672 CA GLU A 213 15.403 -16.943 -15.290 1.00 31.49 C ATOM 1673 C GLU A 213 15.614 -18.237 -14.512 1.00 36.22 C ATOM 1674 O GLU A 213 16.637 -18.421 -13.847 1.00 38.62 O ATOM 1675 CB GLU A 213 15.897 -17.124 -16.724 1.00 42.35 C ATOM 1676 CG GLU A 213 17.386 -17.399 -16.772 1.00 48.10 C ATOM 1677 CD GLU A 213 17.794 -18.250 -17.950 1.00 65.32 C ATOM 1678 OE1 GLU A 213 18.623 -19.170 -17.753 1.00 62.48 O ATOM 1679 OE2 GLU A 213 17.293 -17.997 -19.066 1.00 63.80 O ATOM 1680 H GLU A 213 17.008 -16.042 -14.160 1.00 0.00 H ATOM 1681 N ASP A 214 14.633 -19.137 -14.605 1.00 34.71 N ATOM 1682 CA ASP A 214 14.738 -20.473 -14.036 1.00 32.17 C ATOM 1683 C ASP A 214 14.012 -21.462 -14.935 1.00 31.76 C ATOM 1684 O ASP A 214 13.148 -21.090 -15.731 1.00 31.88 O ATOM 1685 CB ASP A 214 14.156 -20.541 -12.616 1.00 33.92 C ATOM 1686 CG ASP A 214 15.159 -20.177 -11.555 1.00 43.62 C ATOM 1687 OD1 ASP A 214 16.079 -20.987 -11.303 1.00 42.23 O ATOM 1688 OD2 ASP A 214 15.016 -19.088 -10.954 1.00 42.21 O ATOM 1689 H ASP A 214 13.759 -18.874 -15.104 1.00 0.00 H ATOM 1690 N HIS A 215 14.363 -22.736 -14.790 1.00 27.83 N ATOM 1691 CA HIS A 215 13.715 -23.818 -15.525 1.00 26.90 C ATOM 1692 C HIS A 215 13.472 -24.968 -14.557 1.00 33.96 C ATOM 1693 O HIS A 215 14.422 -25.618 -14.106 1.00 33.66 O ATOM 1694 CB HIS A 215 14.575 -24.267 -16.712 1.00 33.78 C ATOM 1695 CG HIS A 215 13.929 -25.294 -17.589 1.00 33.76 C ATOM 1696 ND1 HIS A 215 14.648 -26.049 -18.492 1.00 35.53 N ATOM 1697 CD2 HIS A 215 12.636 -25.682 -17.720 1.00 29.00 C ATOM 1698 CE1 HIS A 215 13.829 -26.868 -19.129 1.00 37.39 C ATOM 1699 NE2 HIS A 215 12.603 -26.665 -18.680 1.00 34.62 N ATOM 1700 H HIS A 215 15.129 -22.971 -14.127 1.00 0.00 H ATOM 1701 N PHE A 216 12.205 -25.215 -14.236 1.00 30.15 N ATOM 1702 CA PHE A 216 11.815 -26.302 -13.350 1.00 24.28 C ATOM 1703 C PHE A 216 11.260 -27.450 -14.182 1.00 35.10 C ATOM 1704 O PHE A 216 10.270 -27.278 -14.901 1.00 30.34 O ATOM 1705 CB PHE A 216 10.770 -25.818 -12.338 1.00 25.68 C ATOM 1706 CG PHE A 216 11.177 -24.574 -11.612 1.00 30.88 C ATOM 1707 CD1 PHE A 216 12.137 -24.625 -10.615 1.00 34.53 C ATOM 1708 CD2 PHE A 216 10.625 -23.346 -11.945 1.00 32.12 C ATOM 1709 CE1 PHE A 216 12.529 -23.477 -9.953 1.00 34.25 C ATOM 1710 CE2 PHE A 216 11.010 -22.192 -11.274 1.00 32.12 C ATOM 1711 CZ PHE A 216 11.970 -22.262 -10.283 1.00 32.73 C ATOM 1712 H PHE A 216 11.462 -24.606 -14.635 1.00 0.00 H ATOM 1713 N HIS A 217 11.902 -28.612 -14.095 1.00 30.32 N ATOM 1714 CA HIS A 217 11.475 -29.791 -14.840 1.00 31.95 C ATOM 1715 C HIS A 217 11.924 -31.021 -14.067 1.00 34.66 C ATOM 1716 O HIS A 217 13.129 -31.206 -13.880 1.00 37.98 O ATOM 1717 CB HIS A 217 12.081 -29.774 -16.249 1.00 33.19 C ATOM 1718 CG HIS A 217 11.424 -30.716 -17.207 1.00 35.16 C ATOM 1719 ND1 HIS A 217 10.262 -31.395 -16.911 1.00 35.21 N ATOM 1720 CD2 HIS A 217 11.765 -31.083 -18.465 1.00 35.13 C ATOM 1721 CE1 HIS A 217 9.915 -32.140 -17.946 1.00 36.11 C ATOM 1722 NE2 HIS A 217 10.809 -31.966 -18.902 1.00 36.47 N ATOM 1723 H HIS A 217 12.735 -28.682 -13.476 1.00 0.00 H ATOM 1724 N TYR A 218 10.977 -31.842 -13.611 1.00 37.47 N ATOM 1725 CA TYR A 218 11.301 -33.010 -12.788 1.00 30.93 C ATOM 1726 C TYR A 218 11.534 -34.304 -13.589 1.00 45.69 C ATOM 1727 O TYR A 218 11.139 -34.420 -14.749 1.00 49.60 O ATOM 1728 CB TYR A 218 10.198 -33.238 -11.753 1.00 36.13 C ATOM 1729 CG TYR A 218 10.430 -34.456 -10.890 1.00 39.03 C ATOM 1730 CD1 TYR A 218 11.524 -34.532 -10.041 1.00 39.59 C ATOM 1731 CD2 TYR A 218 9.556 -35.533 -10.925 1.00 40.93 C ATOM 1732 CE1 TYR A 218 11.739 -35.654 -9.246 1.00 41.95 C ATOM 1733 CE2 TYR A 218 9.763 -36.655 -10.135 1.00 40.46 C ATOM 1734 CZ TYR A 218 10.849 -36.707 -9.300 1.00 42.08 C ATOM 1735 OH TYR A 218 11.049 -37.824 -8.524 1.00 45.96 O ATOM 1736 HH TYR A 218 11.869 -37.705 -7.982 1.00 0.00 H ATOM 1737 H TYR A 218 9.983 -31.648 -13.846 1.00 0.00 H TER 1738 TYR A 218 HETATM 1739 O HOH 1 2.581 -34.582 -15.071 1.00 40.73 O HETATM 1740 O HOH 2 -11.963 -1.237 -8.934 1.00 34.88 O HETATM 1741 O HOH 3 6.777 -4.197 -20.385 1.00 40.53 O HETATM 1742 O HOH 4 -1.254 -6.297 -2.814 1.00 37.15 O HETATM 1743 O HOH 5 6.691 -7.306 -4.268 1.00 38.42 O HETATM 1744 O HOH 6 -19.887 -12.521 -21.374 1.00 33.74 O HETATM 1745 O HOH 7 -2.052 -34.760 -31.541 1.00 35.72 O HETATM 1746 O HOH 8 12.625 -21.348 -5.087 1.00 44.49 O HETATM 1747 O HOH 9 -0.500 -9.878 6.203 1.00 51.33 O HETATM 1748 O HOH 10 4.243 -29.366 -2.656 1.00 24.34 O HETATM 1749 O HOH 11 -6.476 -3.383 -0.918 1.00 40.21 O HETATM 1750 O HOH 12 16.306 -22.997 -12.948 1.00 35.52 O HETATM 1751 O HOH 13 -10.389 -3.289 -9.486 1.00 29.46 O HETATM 1752 O HOH 14 0.029 -34.397 -10.789 1.00 41.35 O HETATM 1753 O HOH 15 -0.932 -3.643 -12.841 1.00 35.42 O HETATM 1754 O HOH 16 -18.379 -10.777 -26.627 1.00 28.79 O HETATM 1755 O HOH 17 -17.927 -9.640 -18.110 1.00 39.87 O HETATM 1756 O HOH 18 -11.296 -3.452 -5.473 1.00 35.42 O HETATM 1757 O HOH 19 -18.126 -5.713 -25.591 1.00 31.13 O HETATM 1758 O HOH 20 8.058 -31.058 -13.886 1.00 34.49 O HETATM 1759 O HOH 21 -4.471 -28.603 -24.257 1.00 31.40 O HETATM 1760 O HOH 22 -13.155 1.572 -9.447 1.00 36.82 O HETATM 1761 O HOH 23 -16.225 -14.132 -27.151 1.00 23.31 O HETATM 1762 O HOH 24 -11.589 -9.680 -30.059 1.00 23.38 O HETATM 1763 O HOH 25 -13.638 -4.202 -6.965 1.00 32.32 O HETATM 1764 O HOH 26 -10.079 -21.329 -14.728 1.00 40.47 O HETATM 1765 O HOH 27 -3.930 -24.580 -24.810 1.00 24.31 O HETATM 1766 O HOH 28 2.779 -29.699 -27.588 1.00 33.92 O HETATM 1767 O HOH 29 -12.058 -0.216 -18.214 1.00 30.98 O HETATM 1768 O HOH 30 8.881 -6.189 -20.294 1.00 37.14 O HETATM 1769 O HOH 31 -11.634 -4.742 -11.298 1.00 28.94 O HETATM 1770 O HOH 32 7.328 -23.715 -25.004 1.00 36.55 O HETATM 1771 O HOH 33 -5.787 -28.490 -30.974 1.00 33.78 O HETATM 1772 O HOH 34 -8.379 -0.649 -18.160 1.00 38.07 O HETATM 1773 O HOH 35 -0.823 -22.851 -9.917 1.00 26.59 O HETATM 1774 O HOH 36 -3.359 -24.486 -35.436 1.00 40.01 O HETATM 1775 O HOH 37 -2.308 -25.611 -7.720 1.00 33.28 O HETATM 1776 O HOH 38 4.949 -16.094 -20.781 1.00 25.43 O HETATM 1777 O HOH 39 -3.972 -11.058 -27.916 1.00 33.90 O HETATM 1778 O HOH 40 -18.165 -4.180 -1.140 1.00 27.59 O HETATM 1779 O HOH 41 -8.283 -27.201 -24.609 1.00 35.88 O HETATM 1780 O HOH 42 -14.511 -21.671 -33.281 1.00 40.79 O HETATM 1781 O HOH 43 5.551 -18.888 -2.884 1.00 33.60 O HETATM 1782 O HOH 44 -16.901 -14.620 -31.072 1.00 24.71 O HETATM 1783 O HOH 45 -2.045 -8.865 -2.762 1.00 29.16 O HETATM 1784 O HOH 46 3.391 -11.249 -0.287 1.00 46.38 O HETATM 1785 O HOH 47 9.014 -14.906 -22.353 1.00 37.25 O HETATM 1786 O HOH 48 -9.852 -7.763 -17.445 1.00 22.41 O HETATM 1787 O HOH 49 -2.539 -12.930 4.374 1.00 45.87 O HETATM 1788 O HOH 50 -14.155 -2.033 -18.218 1.00 25.88 O HETATM 1789 O HOH 51 4.798 -30.825 -4.960 1.00 22.79 O HETATM 1790 O HOH 52 -7.572 -21.866 -12.758 1.00 34.78 O HETATM 1791 O HOH 53 11.526 -9.757 -7.551 1.00 38.40 O HETATM 1792 O HOH 54 -7.563 -29.413 -21.795 1.00 43.72 O HETATM 1793 O HOH 55 -2.418 0.448 -5.792 1.00 40.34 O HETATM 1794 O HOH 56 -5.835 -27.791 -33.707 1.00 37.11 O HETATM 1795 O HOH 57 18.894 -16.233 -14.088 1.00 47.08 O HETATM 1796 O HOH 58 9.750 -24.784 -3.727 1.00 32.59 O HETATM 1797 O HOH 59 1.420 -29.688 -24.570 1.00 34.98 O HETATM 1798 O HOH 60 -5.267 -32.092 -18.365 1.00 39.40 O HETATM 1799 O HOH 61 -20.286 -5.577 -7.771 1.00 37.78 O HETATM 1800 O HOH 62 8.078 -31.288 -20.888 1.00 34.02 O HETATM 1801 O HOH 63 -24.156 -9.469 -2.332 1.00 38.56 O HETATM 1802 O HOH 64 -15.215 -1.699 -20.769 1.00 33.82 O HETATM 1803 O HOH 65 -0.395 -23.354 -7.237 1.00 25.50 O HETATM 1804 O HOH 66 13.973 -20.829 -18.514 1.00 41.71 O HETATM 1805 O HOH 67 -11.295 -7.899 -27.842 1.00 27.90 O HETATM 1806 O HOH 68 -19.464 -21.976 -32.973 1.00 32.19 O HETATM 1807 O HOH 69 2.073 -22.151 -28.537 1.00 44.85 O HETATM 1808 O HOH 70 -1.099 -29.327 -9.722 1.00 29.20 O HETATM 1809 O HOH 71 -0.115 -34.015 -13.368 1.00 44.73 O HETATM 1810 O HOH 72 5.105 -22.787 -23.762 1.00 33.62 O HETATM 1811 O HOH 73 -3.013 -5.063 -26.653 1.00 46.73 O HETATM 1812 O HOH 74 17.538 -25.216 -18.700 1.00 38.37 O HETATM 1813 O HOH 75 -1.281 -18.679 -28.055 1.00 34.89 O HETATM 1814 O HOH 76 0.753 -20.194 -26.552 1.00 37.31 O HETATM 1815 O HOH 77 4.661 -21.925 -2.808 1.00 39.20 O HETATM 1816 O HOH 78 5.289 -3.392 -4.637 1.00 37.07 O HETATM 1817 O HOH 79 0.136 -30.199 -28.140 1.00 41.74 O HETATM 1818 O HOH 80 2.889 -10.305 -24.494 1.00 43.08 O HETATM 1819 O HOH 81 14.690 -19.854 -7.954 1.00 51.37 O HETATM 1820 O HOH 82 0.337 -11.335 -27.925 1.00 48.17 O HETATM 1821 O HOH 83 12.516 -28.594 -10.280 1.00 45.11 O HETATM 1822 O HOH 84 2.596 -18.602 -36.560 1.00 34.50 O HETATM 1823 O HOH 85 -2.326 -32.071 -10.294 1.00 46.30 O HETATM 1824 O HOH 86 11.565 -36.491 -4.946 1.00 41.37 O HETATM 1825 O HOH 87 2.776 -13.981 -0.768 1.00 40.57 O HETATM 1826 O HOH 88 -7.198 -30.000 -24.419 1.00 44.86 O HETATM 1827 O HOH 89 -18.722 -24.262 -33.036 1.00 43.51 O HETATM 1828 O HOH 90 -23.147 -6.266 -6.859 1.00 38.43 O HETATM 1829 O HOH 91 -17.239 -25.966 -31.353 1.00 50.43 O HETATM 1830 O HOH 92 -22.354 -10.636 -4.082 1.00 39.12 O HETATM 1831 O HOH 93 -10.554 -5.226 -28.652 1.00 34.18 O HETATM 1832 O HOH 94 -13.910 -3.658 -9.445 1.00 31.94 O HETATM 1833 O HOH 95 -9.623 -3.203 -26.938 1.00 36.84 O HETATM 1834 C1 HX A 8 -8.120 -18.526 -22.255 1.00 -0.07 C HETATM 1835 C2 HX A 8 -9.478 -18.555 -22.021 1.00 -0.07 C HETATM 1836 C3 HX A 8 -9.959 -19.081 -20.843 1.00 -0.07 C HETATM 1837 C4 HX A 8 -9.089 -19.592 -19.895 1.00 -0.03 C HETATM 1838 C5 HX A 8 -7.729 -19.601 -20.156 1.00 0.11 C HETATM 1839 C6 HX A 8 -7.235 -19.054 -21.327 1.00 -0.03 C HETATM 1840 H5 HX A 8 -6.168 -19.038 -21.517 1.00 0.06 H HETATM 1841 O7 HX A 8 -6.835 -20.129 -19.214 1.00 -0.26 O HETATM 1842 C8 HX A 8 -5.486 -20.261 -19.553 1.00 0.10 C HETATM 1843 C9 HX A 8 -5.200 -21.435 -20.233 1.00 -0.04 C HETATM 1844 C10 HX A 8 -3.911 -21.689 -20.663 1.00 -0.04 C HETATM 1845 C11 HX A 8 -2.904 -20.768 -20.421 1.00 0.08 C HETATM 1846 C12 HX A 8 -3.190 -19.597 -19.732 1.00 -0.04 C HETATM 1847 C13 HX A 8 -4.481 -19.348 -19.292 1.00 -0.04 C HETATM 1848 H9 HX A 8 -4.702 -18.439 -18.744 1.00 0.05 H HETATM 1849 H8 HX A 8 -2.403 -18.877 -19.538 1.00 0.05 H HETATM 1850 O14 HX A 8 -1.643 -20.998 -20.895 1.00 -0.34 O HETATM 1851 H10 HX A 8 -1.621 -21.838 -21.338 1.00 0.24 H HETATM 1852 H7 HX A 8 -3.688 -22.610 -21.190 1.00 0.05 H HETATM 1853 H6 HX A 8 -5.988 -22.154 -20.427 1.00 0.05 H HETATM 1854 H4 HX A 8 -9.469 -19.981 -18.957 1.00 0.06 H HETATM 1855 H3 HX A 8 -11.027 -19.095 -20.656 1.00 0.06 H HETATM 1856 H2 HX A 8 -10.166 -18.165 -22.763 1.00 0.05 H HETATM 1857 H1 HX A 8 -7.741 -18.087 -23.171 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 732 733 739 740 741 CONECT 739 732 CONECT 740 732 CONECT 741 732 CONECT 1834 1835 1839 1857 CONECT 1835 1834 1836 1856 CONECT 1836 1835 1837 1855 CONECT 1837 1836 1838 1854 CONECT 1838 1837 1839 1841 CONECT 1839 1834 1838 1840 CONECT 1840 1839 CONECT 1841 1838 1842 CONECT 1842 1841 1843 1847 CONECT 1843 1842 1844 1853 CONECT 1844 1843 1845 1852 CONECT 1845 1844 1846 1850 CONECT 1846 1845 1847 1849 CONECT 1847 1842 1846 1848 CONECT 1848 1847 CONECT 1849 1846 CONECT 1850 1845 1851 CONECT 1851 1850 CONECT 1852 1844 CONECT 1853 1843 CONECT 1854 1837 CONECT 1855 1836 CONECT 1856 1835 CONECT 1857 1834 MASTER 0 0 0 0 0 0 0 0 1855 2 32 15 END
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Structure:
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Related entries of code: 5z4o
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Protein Sequence Similarity
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PDBbind
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PDBbind
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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
5z4o
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
DNA gyrase ATPase domain
Ligand Name
HX8
EC.Number
E.C.-.-.-.-
Resolution
1.73(Å)
Affinity (Kd/Ki/IC50)
IC50=0.53mM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Medchemcomm Vol. 9: pp. 1619-1629
Ligand Properties
Formula
C
1
2
H
1
0
O
2
Molecular Weight
186.207
Exact Mass
186.068
No. of atoms
24
No. of bonds
25
Polar Surface Area
29.46
LOGP Value
3.10 (
Computed with XLOGP3
)
3.18 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 2
Canonical SMILES
Oc1ccc(cc1)Oc1ccccc1
InChI String
InChI=1S/C12H10O2/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9,13H
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):
P0AES6
Entrez Gene ID
NCBI Entrez Gene ID:
61752852
948211
ASD
Information of known allosteric effects of PDB entries
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