Browse entries in the PDBbind-CN Database
HEADER 5D6P_COMPLEX COMPND 5D6P_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 192 ALA GLY GLN ILE GLN VAL LEU GLU GLY LEU GLU ALA VAL SEQRES 2 A 192 ARG LYS ARG PRO GLY MET TYR ILE GLY SER THR SER GLU SEQRES 3 A 192 ARG GLY LEU HIS HIS LEU VAL TRP GLU ILE VAL ASP ASN SEQRES 4 A 192 SER ILE ASP GLU ALA LEU ALA GLY TYR ALA ASN GLN ILE SEQRES 5 A 192 GLU VAL VAL ILE GLU LYS ASP ASN TRP ILE LYS VAL THR SEQRES 6 A 192 ASP ASN GLY ARG GLY ILE PRO VAL ASP ILE GLN GLU LYS SEQRES 7 A 192 MET GLY ARG PRO ALA VAL GLU VAL ILE LEU THR SER SER SEQRES 8 A 192 VAL VAL ASN ALA LEU SER GLN ASP LEU GLU VAL TYR VAL SEQRES 9 A 192 HIS ARG ASN GLU THR ILE TYR HIS GLN ALA TYR LYS LYS SEQRES 10 A 192 GLY VAL PRO GLN PHE ASP LEU LYS GLU VAL GLY THR THR SEQRES 11 A 192 ASP LYS THR GLY THR VAL ILE ARG PHE LYS ALA ASP GLY SEQRES 12 A 192 GLU ILE PHE THR GLU THR THR VAL TYR ASN TYR GLU THR SEQRES 13 A 192 LEU GLN GLN ARG ILE ARG GLU LEU ALA PHE LEU ASN LYS SEQRES 14 A 192 GLY ILE GLN ILE THR LEU ARG ASP GLU ARG ASP GLU GLU SEQRES 15 A 192 ASN VAL ARG GLU ASP SER TYR HIS TYR GLU HET UNN A 247 32 ATOM 1 N ALA A 16 4.040 0.486 23.893 1.00 90.81 N ATOM 2 CA ALA A 16 5.345 1.125 23.541 1.00 89.99 C ATOM 3 C ALA A 16 5.164 2.238 22.477 1.00 88.77 C ATOM 4 O ALA A 16 5.395 3.413 22.770 1.00 87.53 O ATOM 5 CB ALA A 16 6.364 0.068 23.103 1.00 85.09 C ATOM 6 HN3 ALA A 16 3.622 0.062 23.040 1.00 0.00 H ATOM 7 HN2 ALA A 16 3.395 1.206 24.276 1.00 0.00 H ATOM 8 HN1 ALA A 16 4.199 -0.253 24.607 1.00 0.00 H ATOM 9 N GLY A 17 4.732 1.863 21.267 1.00 87.86 N ATOM 10 CA GLY A 17 4.374 2.817 20.192 1.00 82.24 C ATOM 11 C GLY A 17 2.969 3.438 20.269 1.00 82.97 C ATOM 12 O GLY A 17 2.660 4.332 19.494 1.00 79.22 O ATOM 13 H GLY A 17 4.643 0.846 21.071 1.00 0.00 H ATOM 14 N GLN A 18 2.117 2.951 21.181 1.00 85.62 N ATOM 15 CA GLN A 18 0.831 3.604 21.534 1.00 85.50 C ATOM 16 C GLN A 18 1.037 4.925 22.348 1.00 81.87 C ATOM 17 O GLN A 18 0.242 5.859 22.277 1.00 81.11 O ATOM 18 CB GLN A 18 -0.075 2.626 22.325 1.00 83.51 C ATOM 19 CG GLN A 18 -0.510 1.352 21.590 1.00 80.38 C ATOM 20 CD GLN A 18 -1.634 1.581 20.566 1.00 84.63 C ATOM 21 OE1 GLN A 18 -2.698 2.132 20.893 1.00 70.05 O ATOM 22 NE2 GLN A 18 -1.401 1.154 19.317 1.00 84.83 N ATOM 23 HE22 GLN A 18 -0.496 0.697 19.084 1.00 0.00 H ATOM 24 HE21 GLN A 18 -2.125 1.280 18.581 1.00 0.00 H ATOM 25 H GLN A 18 2.370 2.068 21.668 1.00 0.00 H ATOM 26 N ILE A 19 2.103 4.968 23.135 1.00 78.74 N ATOM 27 CA ILE A 19 2.546 6.170 23.844 1.00 72.57 C ATOM 28 C ILE A 19 2.860 7.303 22.838 1.00 69.26 C ATOM 29 O ILE A 19 2.483 8.460 23.057 1.00 56.56 O ATOM 30 CB ILE A 19 3.787 5.822 24.742 1.00 73.27 C ATOM 31 CG1 ILE A 19 3.376 4.878 25.898 1.00 69.54 C ATOM 32 CG2 ILE A 19 4.460 7.067 25.310 1.00 72.75 C ATOM 33 CD1 ILE A 19 4.406 3.821 26.220 1.00 68.49 C ATOM 34 H ILE A 19 2.657 4.096 23.256 1.00 0.00 H ATOM 35 N GLN A 20 3.541 6.954 21.737 1.00 72.76 N ATOM 36 CA GLN A 20 3.918 7.924 20.688 1.00 71.09 C ATOM 37 C GLN A 20 2.736 8.386 19.802 1.00 69.49 C ATOM 38 O GLN A 20 2.737 9.518 19.319 1.00 62.19 O ATOM 39 CB GLN A 20 5.048 7.369 19.816 1.00 75.90 C ATOM 40 CG GLN A 20 5.437 8.300 18.672 1.00 82.17 C ATOM 41 CD GLN A 20 6.832 8.067 18.137 1.00 86.94 C ATOM 42 OE1 GLN A 20 7.807 8.655 18.635 1.00 84.87 O ATOM 43 NE2 GLN A 20 6.936 7.234 17.094 1.00 80.84 N ATOM 44 HE22 GLN A 20 6.088 6.767 16.715 1.00 0.00 H ATOM 45 HE21 GLN A 20 7.865 7.054 16.663 1.00 0.00 H ATOM 46 H GLN A 20 3.816 5.958 21.616 1.00 0.00 H ATOM 47 N VAL A 21 1.750 7.512 19.590 1.00 67.06 N ATOM 48 CA VAL A 21 0.483 7.883 18.913 1.00 72.05 C ATOM 49 C VAL A 21 -0.223 9.018 19.690 1.00 70.63 C ATOM 50 O VAL A 21 -0.534 10.068 19.111 1.00 63.95 O ATOM 51 CB VAL A 21 -0.465 6.643 18.739 1.00 72.99 C ATOM 52 CG1 VAL A 21 -1.870 7.046 18.313 1.00 73.14 C ATOM 53 CG2 VAL A 21 0.101 5.638 17.734 1.00 74.19 C ATOM 54 H VAL A 21 1.875 6.531 19.912 1.00 0.00 H ATOM 55 N LEU A 22 -0.444 8.780 20.993 1.00 69.49 N ATOM 56 CA LEU A 22 -1.042 9.748 21.945 1.00 61.36 C ATOM 57 C LEU A 22 -0.386 11.106 21.940 1.00 55.29 C ATOM 58 O LEU A 22 -1.064 12.117 21.856 1.00 48.06 O ATOM 59 CB LEU A 22 -0.979 9.210 23.379 1.00 65.84 C ATOM 60 CG LEU A 22 -2.185 8.555 24.056 1.00 68.29 C ATOM 61 CD1 LEU A 22 -3.309 8.157 23.105 1.00 73.09 C ATOM 62 CD2 LEU A 22 -1.714 7.348 24.873 1.00 71.14 C ATOM 63 H LEU A 22 -0.175 7.846 21.363 1.00 0.00 H ATOM 64 N GLU A 23 0.936 11.124 22.035 1.00 56.09 N ATOM 65 CA GLU A 23 1.682 12.381 22.063 1.00 59.88 C ATOM 66 C GLU A 23 1.579 13.145 20.726 1.00 55.59 C ATOM 67 O GLU A 23 1.657 14.391 20.701 1.00 50.87 O ATOM 68 CB GLU A 23 3.167 12.107 22.355 1.00 68.01 C ATOM 69 CG GLU A 23 3.524 11.506 23.719 1.00 69.76 C ATOM 70 CD GLU A 23 5.002 11.071 23.796 1.00 78.41 C ATOM 71 OE1 GLU A 23 5.847 11.697 23.094 1.00 85.87 O ATOM 72 OE2 GLU A 23 5.337 10.116 24.555 1.00 66.27 O ATOM 73 H GLU A 23 1.454 10.224 22.091 1.00 0.00 H ATOM 74 N GLY A 24 1.462 12.389 19.624 1.00 51.32 N ATOM 75 CA GLY A 24 1.258 12.951 18.286 1.00 54.92 C ATOM 76 C GLY A 24 -0.073 13.696 18.180 1.00 50.23 C ATOM 77 O GLY A 24 -0.147 14.758 17.539 1.00 49.60 O ATOM 78 H GLY A 24 1.519 11.355 19.724 1.00 0.00 H ATOM 79 N LEU A 25 -1.103 13.147 18.822 1.00 49.38 N ATOM 80 CA LEU A 25 -2.452 13.760 18.860 1.00 53.18 C ATOM 81 C LEU A 25 -2.477 15.032 19.704 1.00 53.35 C ATOM 82 O LEU A 25 -3.013 16.063 19.268 1.00 48.95 O ATOM 83 CB LEU A 25 -3.513 12.785 19.417 1.00 51.52 C ATOM 84 CG LEU A 25 -3.797 11.459 18.696 1.00 55.99 C ATOM 85 CD1 LEU A 25 -4.893 10.746 19.470 1.00 56.45 C ATOM 86 CD2 LEU A 25 -4.175 11.581 17.209 1.00 58.47 C ATOM 87 H LEU A 25 -0.954 12.246 19.320 1.00 0.00 H ATOM 88 N GLU A 26 -1.939 14.953 20.926 1.00 56.64 N ATOM 89 CA GLU A 26 -1.740 16.145 21.767 1.00 54.38 C ATOM 90 C GLU A 26 -1.008 17.259 20.982 1.00 50.41 C ATOM 91 O GLU A 26 -1.359 18.422 21.089 1.00 55.68 O ATOM 92 CB GLU A 26 -0.948 15.771 23.013 1.00 59.96 C ATOM 93 CG GLU A 26 -0.804 16.903 24.036 1.00 68.89 C ATOM 94 CD GLU A 26 0.314 16.679 25.053 1.00 74.77 C ATOM 95 OE1 GLU A 26 1.061 15.673 24.941 1.00 67.07 O ATOM 96 OE2 GLU A 26 0.453 17.532 25.970 1.00 81.63 O ATOM 97 H GLU A 26 -1.653 14.023 21.293 1.00 0.00 H ATOM 98 N ALA A 27 -0.013 16.884 20.177 1.00 50.13 N ATOM 99 CA ALA A 27 0.837 17.837 19.438 1.00 49.61 C ATOM 100 C ALA A 27 0.125 18.506 18.242 1.00 50.35 C ATOM 101 O ALA A 27 0.362 19.684 17.913 1.00 57.35 O ATOM 102 CB ALA A 27 2.118 17.125 18.968 1.00 49.63 C ATOM 103 H ALA A 27 0.173 15.867 20.064 1.00 0.00 H ATOM 104 N VAL A 28 -0.730 17.742 17.564 1.00 55.85 N ATOM 105 CA VAL A 28 -1.568 18.287 16.470 1.00 51.68 C ATOM 106 C VAL A 28 -2.612 19.281 17.045 1.00 47.33 C ATOM 107 O VAL A 28 -2.831 20.378 16.514 1.00 51.23 O ATOM 108 CB VAL A 28 -2.217 17.137 15.650 1.00 50.50 C ATOM 109 CG1 VAL A 28 -3.190 17.679 14.606 1.00 50.34 C ATOM 110 CG2 VAL A 28 -1.134 16.297 14.952 1.00 53.82 C ATOM 111 H VAL A 28 -0.812 16.735 17.809 1.00 0.00 H ATOM 112 N ARG A 29 -3.212 18.899 18.159 1.00 45.80 N ATOM 113 CA ARG A 29 -4.303 19.660 18.755 1.00 48.34 C ATOM 114 C ARG A 29 -3.825 20.935 19.454 1.00 49.87 C ATOM 115 O ARG A 29 -4.542 21.910 19.446 1.00 49.87 O ATOM 116 CB ARG A 29 -5.113 18.765 19.695 1.00 48.02 C ATOM 117 CG ARG A 29 -5.903 17.674 18.945 1.00 48.56 C ATOM 118 CD ARG A 29 -6.798 16.826 19.861 1.00 43.85 C ATOM 119 NE ARG A 29 -7.824 17.665 20.523 1.00 42.83 N ATOM 120 CZ ARG A 29 -8.921 18.165 19.927 1.00 45.39 C ATOM 121 NH1 ARG A 29 -9.190 17.933 18.649 1.00 40.20 N ATOM 122 NH2 ARG A 29 -9.783 18.920 20.619 1.00 46.85 N ATOM 123 HE ARG A 29 -7.685 17.885 21.530 1.00 0.00 H ATOM 124 HH12 ARG A 29 -10.047 18.334 18.217 1.00 0.00 H ATOM 125 HH11 ARG A 29 -8.544 17.350 18.079 1.00 0.00 H ATOM 126 HH22 ARG A 29 -10.629 19.304 20.152 1.00 0.00 H ATOM 127 HH21 ARG A 29 -9.606 19.123 21.624 1.00 0.00 H ATOM 128 H ARG A 29 -2.895 18.026 18.626 1.00 0.00 H ATOM 129 N LYS A 30 -2.608 20.943 20.012 1.00 53.52 N ATOM 130 CA LYS A 30 -2.032 22.161 20.576 1.00 51.37 C ATOM 131 C LYS A 30 -1.557 23.182 19.516 1.00 49.68 C ATOM 132 O LYS A 30 -1.693 24.393 19.728 1.00 49.75 O ATOM 133 CB LYS A 30 -0.893 21.797 21.546 1.00 62.04 C ATOM 134 CG LYS A 30 -0.631 22.868 22.587 1.00 66.85 C ATOM 135 CD LYS A 30 -0.071 22.289 23.869 1.00 74.90 C ATOM 136 CE LYS A 30 1.301 21.689 23.657 1.00 73.05 C ATOM 137 NZ LYS A 30 1.957 21.449 24.973 1.00 73.41 N ATOM 138 HZ1 LYS A 30 2.051 22.351 25.482 1.00 0.00 H ATOM 139 HZ2 LYS A 30 1.377 20.792 25.533 1.00 0.00 H ATOM 140 HZ3 LYS A 30 2.899 21.037 24.819 1.00 0.00 H ATOM 141 H LYS A 30 -2.059 20.060 20.045 1.00 0.00 H ATOM 142 N ARG A 31 -1.022 22.724 18.376 1.00 51.36 N ATOM 143 CA ARG A 31 -0.506 23.647 17.331 1.00 48.74 C ATOM 144 C ARG A 31 -1.054 23.398 15.908 1.00 45.38 C ATOM 145 O ARG A 31 -0.283 23.239 14.946 1.00 43.49 O ATOM 146 CB ARG A 31 1.035 23.641 17.349 1.00 58.65 C ATOM 147 CG ARG A 31 1.616 24.643 18.337 1.00 62.09 C ATOM 148 CD ARG A 31 3.089 24.415 18.653 1.00 64.73 C ATOM 149 NE ARG A 31 3.301 24.565 20.103 1.00 66.69 N ATOM 150 CZ ARG A 31 3.683 23.604 20.955 1.00 64.50 C ATOM 151 NH1 ARG A 31 3.806 23.903 22.241 1.00 70.28 N ATOM 152 NH2 ARG A 31 3.966 22.364 20.555 1.00 67.15 N ATOM 153 HE ARG A 31 3.138 25.510 20.505 1.00 0.00 H ATOM 154 HH12 ARG A 31 4.101 23.172 22.919 1.00 0.00 H ATOM 155 HH11 ARG A 31 3.607 24.869 22.572 1.00 0.00 H ATOM 156 HH22 ARG A 31 4.259 21.648 21.250 1.00 0.00 H ATOM 157 HH21 ARG A 31 3.894 22.113 19.548 1.00 0.00 H ATOM 158 H ARG A 31 -0.966 21.698 18.218 1.00 0.00 H ATOM 159 N PRO A 32 -2.401 23.400 15.760 1.00 47.15 N ATOM 160 CA PRO A 32 -3.086 23.019 14.531 1.00 41.67 C ATOM 161 C PRO A 32 -2.690 23.766 13.295 1.00 42.80 C ATOM 162 O PRO A 32 -2.509 23.133 12.256 1.00 42.62 O ATOM 163 CB PRO A 32 -4.557 23.302 14.840 1.00 46.31 C ATOM 164 CG PRO A 32 -4.516 24.259 15.964 1.00 47.71 C ATOM 165 CD PRO A 32 -3.375 23.772 16.797 1.00 44.33 C ATOM 166 N GLY A 33 -2.521 25.086 13.416 1.00 42.37 N ATOM 167 CA GLY A 33 -2.080 25.935 12.319 1.00 42.27 C ATOM 168 C GLY A 33 -0.732 25.562 11.735 1.00 44.29 C ATOM 169 O GLY A 33 -0.527 25.749 10.534 1.00 48.14 O ATOM 170 H GLY A 33 -2.714 25.528 14.338 1.00 0.00 H ATOM 171 N MET A 34 0.158 24.986 12.561 1.00 47.24 N ATOM 172 CA MET A 34 1.440 24.416 12.072 1.00 52.97 C ATOM 173 C MET A 34 1.248 23.246 11.090 1.00 57.57 C ATOM 174 O MET A 34 2.049 23.075 10.179 1.00 51.92 O ATOM 175 CB MET A 34 2.357 23.992 13.221 1.00 54.15 C ATOM 176 CG MET A 34 2.947 25.157 14.019 1.00 58.88 C ATOM 177 SD MET A 34 4.186 24.721 15.283 1.00 67.49 S ATOM 178 CE MET A 34 5.610 24.262 14.287 1.00 66.00 C ATOM 179 H MET A 34 -0.058 24.938 13.577 1.00 0.00 H ATOM 180 N TYR A 35 0.160 22.479 11.258 1.00 60.43 N ATOM 181 CA TYR A 35 -0.180 21.369 10.357 1.00 52.92 C ATOM 182 C TYR A 35 -1.053 21.753 9.178 1.00 54.60 C ATOM 183 O TYR A 35 -0.797 21.298 8.071 1.00 58.75 O ATOM 184 CB TYR A 35 -0.866 20.262 11.130 1.00 53.73 C ATOM 185 CG TYR A 35 0.014 19.681 12.194 1.00 52.11 C ATOM 186 CD1 TYR A 35 0.052 20.219 13.465 1.00 50.54 C ATOM 187 CD2 TYR A 35 0.839 18.598 11.917 1.00 52.77 C ATOM 188 CE1 TYR A 35 0.890 19.697 14.450 1.00 53.88 C ATOM 189 CE2 TYR A 35 1.648 18.039 12.906 1.00 53.11 C ATOM 190 CZ TYR A 35 1.664 18.591 14.167 1.00 51.03 C ATOM 191 OH TYR A 35 2.462 18.036 15.123 1.00 49.27 O ATOM 192 HH TYR A 35 2.363 18.542 15.968 1.00 0.00 H ATOM 193 H TYR A 35 -0.470 22.679 12.061 1.00 0.00 H ATOM 194 N ILE A 36 -2.072 22.585 9.382 1.00 51.84 N ATOM 195 CA ILE A 36 -3.086 22.832 8.319 1.00 54.59 C ATOM 196 C ILE A 36 -3.142 24.270 7.777 1.00 53.10 C ATOM 197 O ILE A 36 -4.025 24.591 6.986 1.00 61.36 O ATOM 198 CB ILE A 36 -4.491 22.343 8.760 1.00 53.24 C ATOM 199 CG1 ILE A 36 -4.945 23.028 10.046 1.00 49.27 C ATOM 200 CG2 ILE A 36 -4.465 20.835 8.978 1.00 54.84 C ATOM 201 CD1 ILE A 36 -6.440 23.045 10.179 1.00 52.93 C ATOM 202 H ILE A 36 -2.162 23.070 10.298 1.00 0.00 H ATOM 203 N GLY A 37 -2.194 25.121 8.182 1.00 54.32 N ATOM 204 CA GLY A 37 -2.115 26.497 7.681 1.00 53.84 C ATOM 205 C GLY A 37 -2.710 27.497 8.664 1.00 54.75 C ATOM 206 O GLY A 37 -2.089 28.530 8.957 1.00 54.24 O ATOM 207 H GLY A 37 -1.490 24.797 8.875 1.00 0.00 H ATOM 208 N SER A 38 -3.905 27.171 9.173 1.00 51.05 N ATOM 209 CA SER A 38 -4.711 28.058 10.025 1.00 49.42 C ATOM 210 C SER A 38 -5.883 27.266 10.582 1.00 46.59 C ATOM 211 O SER A 38 -6.092 26.111 10.191 1.00 45.60 O ATOM 212 CB SER A 38 -5.274 29.234 9.199 1.00 50.76 C ATOM 213 OG SER A 38 -6.197 28.792 8.227 1.00 44.12 O ATOM 214 HG SER A 38 -6.536 29.570 7.718 1.00 0.00 H ATOM 215 H SER A 38 -4.288 26.230 8.951 1.00 0.00 H ATOM 216 N THR A 39 -6.652 27.893 11.459 1.00 40.84 N ATOM 217 CA THR A 39 -7.888 27.313 11.948 1.00 46.80 C ATOM 218 C THR A 39 -9.126 28.084 11.472 1.00 45.03 C ATOM 219 O THR A 39 -10.225 27.839 11.942 1.00 41.01 O ATOM 220 CB THR A 39 -7.886 27.265 13.471 1.00 48.58 C ATOM 221 OG1 THR A 39 -7.701 28.586 13.973 1.00 50.86 O ATOM 222 CG2 THR A 39 -6.786 26.351 13.968 1.00 49.73 C ATOM 223 HG1 THR A 39 -6.837 28.944 13.647 1.00 0.00 H ATOM 224 H THR A 39 -6.361 28.829 11.807 1.00 0.00 H ATOM 225 N SER A 40 -8.918 28.967 10.498 1.00 47.01 N ATOM 226 CA SER A 40 -9.969 29.766 9.845 1.00 42.94 C ATOM 227 C SER A 40 -10.782 28.909 8.856 1.00 42.57 C ATOM 228 O SER A 40 -10.622 27.669 8.809 1.00 39.04 O ATOM 229 CB SER A 40 -9.274 30.889 9.082 1.00 46.78 C ATOM 230 OG SER A 40 -8.410 30.328 8.064 1.00 46.13 O ATOM 231 HG SER A 40 -7.729 29.752 8.492 1.00 0.00 H ATOM 232 H SER A 40 -7.939 29.103 10.173 1.00 0.00 H ATOM 233 N GLU A 41 -11.642 29.555 8.057 1.00 42.29 N ATOM 234 CA GLU A 41 -12.382 28.854 6.992 1.00 45.61 C ATOM 235 C GLU A 41 -11.476 28.080 6.019 1.00 47.22 C ATOM 236 O GLU A 41 -11.843 27.000 5.555 1.00 49.30 O ATOM 237 CB GLU A 41 -13.289 29.795 6.176 1.00 44.59 C ATOM 238 CG GLU A 41 -14.300 29.005 5.334 1.00 50.38 C ATOM 239 CD GLU A 41 -15.400 29.827 4.673 1.00 52.56 C ATOM 240 OE1 GLU A 41 -15.695 29.530 3.496 1.00 53.01 O ATOM 241 OE2 GLU A 41 -15.985 30.744 5.310 1.00 49.23 O ATOM 242 H GLU A 41 -11.791 30.575 8.191 1.00 0.00 H ATOM 243 N ARG A 42 -10.313 28.635 5.710 1.00 47.18 N ATOM 244 CA ARG A 42 -9.362 27.975 4.831 1.00 47.11 C ATOM 245 C ARG A 42 -8.910 26.631 5.355 1.00 42.86 C ATOM 246 O ARG A 42 -8.869 25.682 4.594 1.00 42.75 O ATOM 247 CB ARG A 42 -8.128 28.841 4.637 1.00 54.82 C ATOM 248 CG ARG A 42 -8.420 30.059 3.812 1.00 62.20 C ATOM 249 CD ARG A 42 -7.127 30.787 3.473 1.00 69.72 C ATOM 250 NE ARG A 42 -7.399 31.845 2.509 1.00 75.12 N ATOM 251 CZ ARG A 42 -7.610 31.660 1.205 1.00 83.07 C ATOM 252 NH1 ARG A 42 -7.587 30.438 0.661 1.00 87.42 N ATOM 253 NH2 ARG A 42 -7.852 32.714 0.429 1.00 90.74 N ATOM 254 HE ARG A 42 -7.431 32.821 2.866 1.00 0.00 H ATOM 255 HH12 ARG A 42 -7.755 30.319 -0.359 1.00 0.00 H ATOM 256 HH11 ARG A 42 -7.402 29.607 1.258 1.00 0.00 H ATOM 257 HH22 ARG A 42 -8.018 32.583 -0.589 1.00 0.00 H ATOM 258 HH21 ARG A 42 -7.875 33.669 0.841 1.00 0.00 H ATOM 259 H ARG A 42 -10.075 29.566 6.106 1.00 0.00 H ATOM 260 N GLY A 43 -8.554 26.564 6.641 1.00 39.81 N ATOM 261 CA GLY A 43 -8.082 25.344 7.262 1.00 42.29 C ATOM 262 C GLY A 43 -9.193 24.320 7.429 1.00 41.28 C ATOM 263 O GLY A 43 -8.954 23.106 7.375 1.00 38.75 O ATOM 264 H GLY A 43 -8.619 27.425 7.221 1.00 0.00 H ATOM 265 N LEU A 44 -10.416 24.806 7.600 1.00 41.38 N ATOM 266 CA LEU A 44 -11.612 23.937 7.647 1.00 40.32 C ATOM 267 C LEU A 44 -11.722 23.130 6.325 1.00 34.20 C ATOM 268 O LEU A 44 -11.798 21.903 6.342 1.00 30.10 O ATOM 269 CB LEU A 44 -12.900 24.769 7.917 1.00 41.37 C ATOM 270 CG LEU A 44 -14.230 23.956 7.873 1.00 43.99 C ATOM 271 CD1 LEU A 44 -14.417 23.118 9.140 1.00 41.51 C ATOM 272 CD2 LEU A 44 -15.450 24.832 7.550 1.00 41.15 C ATOM 273 H LEU A 44 -10.538 25.834 7.705 1.00 0.00 H ATOM 274 N HIS A 45 -11.671 23.833 5.201 1.00 33.79 N ATOM 275 CA HIS A 45 -11.709 23.220 3.890 1.00 34.33 C ATOM 276 C HIS A 45 -10.489 22.383 3.575 1.00 37.71 C ATOM 277 O HIS A 45 -10.580 21.461 2.753 1.00 37.38 O ATOM 278 CB HIS A 45 -11.860 24.283 2.804 1.00 35.91 C ATOM 279 CG HIS A 45 -13.225 24.879 2.740 1.00 38.50 C ATOM 280 ND1 HIS A 45 -13.663 25.848 3.616 1.00 40.41 N ATOM 281 CD2 HIS A 45 -14.259 24.639 1.900 1.00 40.79 C ATOM 282 CE1 HIS A 45 -14.906 26.181 3.316 1.00 40.56 C ATOM 283 NE2 HIS A 45 -15.285 25.469 2.273 1.00 39.90 N ATOM 284 H HIS A 45 -11.601 24.869 5.264 1.00 0.00 H ATOM 285 N HIS A 46 -9.339 22.736 4.158 1.00 38.77 N ATOM 286 CA HIS A 46 -8.088 21.949 4.000 1.00 38.18 C ATOM 287 C HIS A 46 -8.257 20.492 4.507 1.00 34.24 C ATOM 288 O HIS A 46 -7.651 19.584 3.961 1.00 29.95 O ATOM 289 CB HIS A 46 -6.906 22.667 4.679 1.00 45.47 C ATOM 290 CG HIS A 46 -5.578 21.990 4.493 1.00 51.68 C ATOM 291 ND1 HIS A 46 -4.892 21.994 3.294 1.00 50.94 N ATOM 292 CD2 HIS A 46 -4.810 21.289 5.365 1.00 48.46 C ATOM 293 CE1 HIS A 46 -3.755 21.335 3.440 1.00 50.40 C ATOM 294 NE2 HIS A 46 -3.681 20.899 4.688 1.00 49.45 N ATOM 295 H HIS A 46 -9.319 23.594 4.745 1.00 0.00 H ATOM 296 N LEU A 47 -9.080 20.275 5.527 1.00 33.48 N ATOM 297 CA LEU A 47 -9.423 18.913 5.977 1.00 35.61 C ATOM 298 C LEU A 47 -9.976 18.012 4.853 1.00 35.54 C ATOM 299 O LEU A 47 -9.560 16.859 4.737 1.00 36.48 O ATOM 300 CB LEU A 47 -10.393 18.934 7.155 1.00 32.69 C ATOM 301 CG LEU A 47 -9.942 19.563 8.482 1.00 38.43 C ATOM 302 CD1 LEU A 47 -11.020 19.401 9.550 1.00 37.41 C ATOM 303 CD2 LEU A 47 -8.665 18.975 9.020 1.00 40.97 C ATOM 304 H LEU A 47 -9.495 21.090 6.023 1.00 0.00 H ATOM 305 N VAL A 48 -10.888 18.560 4.044 1.00 37.38 N ATOM 306 CA VAL A 48 -11.434 17.866 2.880 1.00 33.13 C ATOM 307 C VAL A 48 -10.325 17.487 1.886 1.00 35.37 C ATOM 308 O VAL A 48 -10.242 16.317 1.430 1.00 33.99 O ATOM 309 CB VAL A 48 -12.476 18.705 2.157 1.00 33.77 C ATOM 310 CG1 VAL A 48 -13.062 17.921 0.958 1.00 35.07 C ATOM 311 CG2 VAL A 48 -13.580 19.140 3.129 1.00 37.04 C ATOM 312 H VAL A 48 -11.224 19.522 4.252 1.00 0.00 H ATOM 313 N TRP A 49 -9.490 18.479 1.532 1.00 35.33 N ATOM 314 CA TRP A 49 -8.331 18.260 0.630 1.00 38.46 C ATOM 315 C TRP A 49 -7.379 17.175 1.063 1.00 35.29 C ATOM 316 O TRP A 49 -6.900 16.407 0.244 1.00 40.67 O ATOM 317 CB TRP A 49 -7.592 19.568 0.321 1.00 36.14 C ATOM 318 CG TRP A 49 -8.545 20.660 -0.074 1.00 42.75 C ATOM 319 CD1 TRP A 49 -8.513 21.956 0.346 1.00 41.70 C ATOM 320 CD2 TRP A 49 -9.731 20.534 -0.885 1.00 43.95 C ATOM 321 NE1 TRP A 49 -9.572 22.644 -0.164 1.00 43.95 N ATOM 322 CE2 TRP A 49 -10.327 21.804 -0.937 1.00 45.36 C ATOM 323 CE3 TRP A 49 -10.322 19.482 -1.603 1.00 51.04 C ATOM 324 CZ2 TRP A 49 -11.501 22.056 -1.651 1.00 48.30 C ATOM 325 CZ3 TRP A 49 -11.480 19.739 -2.338 1.00 53.28 C ATOM 326 CH2 TRP A 49 -12.068 21.009 -2.334 1.00 51.89 C ATOM 327 HE1 TRP A 49 -9.775 23.650 0.007 1.00 0.00 H ATOM 328 H TRP A 49 -9.662 19.435 1.903 1.00 0.00 H ATOM 329 N GLU A 50 -7.098 17.111 2.354 1.00 37.00 N ATOM 330 CA GLU A 50 -6.279 16.039 2.926 1.00 38.33 C ATOM 331 C GLU A 50 -6.860 14.652 2.712 1.00 37.66 C ATOM 332 O GLU A 50 -6.120 13.709 2.441 1.00 33.20 O ATOM 333 CB GLU A 50 -6.053 16.262 4.424 1.00 38.08 C ATOM 334 CG GLU A 50 -5.090 17.393 4.722 1.00 43.75 C ATOM 335 CD GLU A 50 -3.613 17.001 4.496 1.00 52.67 C ATOM 336 OE1 GLU A 50 -3.117 16.011 5.121 1.00 55.39 O ATOM 337 OE2 GLU A 50 -2.953 17.693 3.687 1.00 53.74 O ATOM 338 H GLU A 50 -7.472 17.848 2.986 1.00 0.00 H ATOM 339 N ILE A 51 -8.190 14.526 2.804 1.00 37.17 N ATOM 340 CA ILE A 51 -8.837 13.246 2.593 1.00 32.75 C ATOM 341 C ILE A 51 -8.928 12.953 1.110 1.00 33.16 C ATOM 342 O ILE A 51 -8.607 11.852 0.652 1.00 33.64 O ATOM 343 CB ILE A 51 -10.253 13.229 3.164 1.00 36.70 C ATOM 344 CG1 ILE A 51 -10.261 13.545 4.688 1.00 36.14 C ATOM 345 CG2 ILE A 51 -10.915 11.866 2.879 1.00 37.46 C ATOM 346 CD1 ILE A 51 -9.420 12.608 5.517 1.00 34.05 C ATOM 347 H ILE A 51 -8.768 15.360 3.031 1.00 0.00 H ATOM 348 N VAL A 52 -9.347 13.958 0.365 1.00 37.17 N ATOM 349 CA VAL A 52 -9.477 13.846 -1.088 1.00 39.34 C ATOM 350 C VAL A 52 -8.165 13.456 -1.783 1.00 41.72 C ATOM 351 O VAL A 52 -8.174 12.568 -2.642 1.00 40.38 O ATOM 352 CB VAL A 52 -10.059 15.113 -1.703 1.00 37.40 C ATOM 353 CG1 VAL A 52 -9.929 15.105 -3.243 1.00 40.62 C ATOM 354 CG2 VAL A 52 -11.521 15.233 -1.306 1.00 35.61 C ATOM 355 H VAL A 52 -9.593 14.858 0.825 1.00 0.00 H ATOM 356 N ASP A 53 -7.055 14.070 -1.385 1.00 44.38 N ATOM 357 CA ASP A 53 -5.719 13.685 -1.923 1.00 45.62 C ATOM 358 C ASP A 53 -5.319 12.227 -1.738 1.00 42.33 C ATOM 359 O ASP A 53 -4.631 11.691 -2.575 1.00 41.45 O ATOM 360 CB ASP A 53 -4.599 14.582 -1.377 1.00 52.40 C ATOM 361 CG ASP A 53 -4.397 15.810 -2.228 1.00 61.49 C ATOM 362 OD1 ASP A 53 -4.333 16.910 -1.651 1.00 66.22 O ATOM 363 OD2 ASP A 53 -4.340 15.678 -3.482 1.00 65.47 O ATOM 364 H ASP A 53 -7.120 14.835 -0.684 1.00 0.00 H ATOM 365 N ASN A 54 -5.755 11.579 -0.672 1.00 41.47 N ATOM 366 CA ASN A 54 -5.483 10.137 -0.511 1.00 40.95 C ATOM 367 C ASN A 54 -6.267 9.293 -1.547 1.00 40.74 C ATOM 368 O ASN A 54 -5.756 8.328 -2.125 1.00 35.43 O ATOM 369 CB ASN A 54 -5.775 9.714 0.953 1.00 46.11 C ATOM 370 CG ASN A 54 -4.833 10.410 1.984 1.00 50.27 C ATOM 371 OD1 ASN A 54 -5.255 10.784 3.085 1.00 52.63 O ATOM 372 ND2 ASN A 54 -3.574 10.624 1.599 1.00 50.05 N ATOM 373 HD22 ASN A 54 -3.253 10.296 0.666 1.00 0.00 H ATOM 374 HD21 ASN A 54 -2.914 11.119 2.232 1.00 0.00 H ATOM 375 H ASN A 54 -6.293 12.088 0.058 1.00 0.00 H ATOM 376 N SER A 55 -7.522 9.677 -1.765 1.00 41.12 N ATOM 377 CA SER A 55 -8.315 9.137 -2.855 1.00 40.04 C ATOM 378 C SER A 55 -7.698 9.366 -4.241 1.00 35.06 C ATOM 379 O SER A 55 -7.665 8.457 -5.064 1.00 33.89 O ATOM 380 CB SER A 55 -9.749 9.653 -2.758 1.00 38.11 C ATOM 381 OG SER A 55 -10.377 8.993 -1.675 1.00 40.18 O ATOM 382 HG SER A 55 -10.374 8.017 -1.839 1.00 0.00 H ATOM 383 H SER A 55 -7.948 10.386 -1.135 1.00 0.00 H ATOM 384 N ILE A 56 -7.172 10.553 -4.484 1.00 37.63 N ATOM 385 CA ILE A 56 -6.511 10.811 -5.756 1.00 39.33 C ATOM 386 C ILE A 56 -5.264 9.934 -5.975 1.00 38.74 C ATOM 387 O ILE A 56 -5.098 9.407 -7.074 1.00 32.43 O ATOM 388 CB ILE A 56 -6.288 12.317 -6.008 1.00 38.92 C ATOM 389 CG1 ILE A 56 -7.633 12.950 -6.309 1.00 38.18 C ATOM 390 CG2 ILE A 56 -5.425 12.552 -7.254 1.00 40.24 C ATOM 391 CD1 ILE A 56 -7.641 14.444 -6.286 1.00 39.03 C ATOM 392 H ILE A 56 -7.230 11.304 -3.767 1.00 0.00 H ATOM 393 N ASP A 57 -4.434 9.734 -4.935 1.00 39.78 N ATOM 394 CA ASP A 57 -3.254 8.832 -5.019 1.00 41.82 C ATOM 395 C ASP A 57 -3.670 7.415 -5.396 1.00 40.82 C ATOM 396 O ASP A 57 -3.086 6.811 -6.306 1.00 37.27 O ATOM 397 CB ASP A 57 -2.479 8.719 -3.687 1.00 45.55 C ATOM 398 CG ASP A 57 -1.747 10.016 -3.271 1.00 49.72 C ATOM 399 OD1 ASP A 57 -1.504 10.191 -2.038 1.00 52.55 O ATOM 400 OD2 ASP A 57 -1.417 10.829 -4.146 1.00 51.48 O ATOM 401 H ASP A 57 -4.624 10.228 -4.040 1.00 0.00 H ATOM 402 N GLU A 58 -4.680 6.898 -4.701 1.00 40.42 N ATOM 403 CA GLU A 58 -5.299 5.607 -5.044 1.00 41.08 C ATOM 404 C GLU A 58 -5.709 5.494 -6.523 1.00 42.21 C ATOM 405 O GLU A 58 -5.465 4.452 -7.150 1.00 40.61 O ATOM 406 CB GLU A 58 -6.519 5.378 -4.146 1.00 44.00 C ATOM 407 CG GLU A 58 -7.111 3.999 -4.211 1.00 45.47 C ATOM 408 CD GLU A 58 -6.181 2.908 -3.695 1.00 44.61 C ATOM 409 OE1 GLU A 58 -5.076 3.172 -3.178 1.00 44.23 O ATOM 410 OE2 GLU A 58 -6.569 1.751 -3.805 1.00 42.37 O ATOM 411 H GLU A 58 -5.046 7.426 -3.884 1.00 0.00 H ATOM 412 N ALA A 59 -6.269 6.573 -7.093 1.00 41.23 N ATOM 413 CA ALA A 59 -6.660 6.601 -8.525 1.00 41.75 C ATOM 414 C ALA A 59 -5.410 6.605 -9.406 1.00 38.67 C ATOM 415 O ALA A 59 -5.315 5.863 -10.384 1.00 41.56 O ATOM 416 CB ALA A 59 -7.595 7.785 -8.847 1.00 38.69 C ATOM 417 H ALA A 59 -6.435 7.419 -6.511 1.00 0.00 H ATOM 418 N LEU A 60 -4.439 7.409 -9.008 1.00 44.85 N ATOM 419 CA LEU A 60 -3.147 7.477 -9.692 1.00 46.52 C ATOM 420 C LEU A 60 -2.363 6.151 -9.686 1.00 45.41 C ATOM 421 O LEU A 60 -1.748 5.803 -10.673 1.00 44.30 O ATOM 422 CB LEU A 60 -2.332 8.658 -9.136 1.00 50.28 C ATOM 423 CG LEU A 60 -2.436 10.019 -9.871 1.00 49.71 C ATOM 424 CD1 LEU A 60 -3.643 10.229 -10.790 1.00 53.13 C ATOM 425 CD2 LEU A 60 -2.316 11.145 -8.871 1.00 50.81 C ATOM 426 H LEU A 60 -4.599 8.015 -8.178 1.00 0.00 H ATOM 427 N ALA A 61 -2.436 5.385 -8.599 1.00 50.86 N ATOM 428 CA ALA A 61 -1.816 4.047 -8.521 1.00 47.72 C ATOM 429 C ALA A 61 -2.489 3.020 -9.422 1.00 47.95 C ATOM 430 O ALA A 61 -1.955 1.920 -9.597 1.00 51.36 O ATOM 431 CB ALA A 61 -1.808 3.534 -7.084 1.00 43.83 C ATOM 432 H ALA A 61 -2.951 5.744 -7.770 1.00 0.00 H ATOM 433 N GLY A 62 -3.677 3.355 -9.926 1.00 42.57 N ATOM 434 CA GLY A 62 -4.436 2.569 -10.883 1.00 45.78 C ATOM 435 C GLY A 62 -5.695 1.905 -10.321 1.00 43.86 C ATOM 436 O GLY A 62 -6.328 1.135 -11.013 1.00 43.37 O ATOM 437 H GLY A 62 -4.095 4.253 -9.608 1.00 0.00 H ATOM 438 N TYR A 63 -6.056 2.166 -9.065 1.00 47.08 N ATOM 439 CA TYR A 63 -7.031 1.296 -8.369 1.00 48.43 C ATOM 440 C TYR A 63 -8.440 1.880 -8.134 1.00 49.46 C ATOM 441 O TYR A 63 -9.342 1.132 -7.772 1.00 55.64 O ATOM 442 CB TYR A 63 -6.396 0.776 -7.077 1.00 48.86 C ATOM 443 CG TYR A 63 -5.388 -0.309 -7.381 1.00 56.95 C ATOM 444 CD1 TYR A 63 -4.006 -0.063 -7.337 1.00 58.27 C ATOM 445 CD2 TYR A 63 -5.816 -1.570 -7.790 1.00 58.77 C ATOM 446 CE1 TYR A 63 -3.095 -1.067 -7.643 1.00 60.19 C ATOM 447 CE2 TYR A 63 -4.916 -2.567 -8.104 1.00 59.38 C ATOM 448 CZ TYR A 63 -3.563 -2.316 -8.034 1.00 62.89 C ATOM 449 OH TYR A 63 -2.697 -3.333 -8.374 1.00 71.93 O ATOM 450 HH TYR A 63 -1.764 -3.016 -8.279 1.00 0.00 H ATOM 451 H TYR A 63 -5.650 2.986 -8.571 1.00 0.00 H ATOM 452 N ALA A 64 -8.621 3.183 -8.363 1.00 43.02 N ATOM 453 CA ALA A 64 -9.895 3.897 -8.170 1.00 41.44 C ATOM 454 C ALA A 64 -10.202 4.731 -9.423 1.00 39.69 C ATOM 455 O ALA A 64 -9.284 5.124 -10.089 1.00 41.40 O ATOM 456 CB ALA A 64 -9.767 4.812 -6.974 1.00 37.93 C ATOM 457 H ALA A 64 -7.805 3.732 -8.701 1.00 0.00 H ATOM 458 N ASN A 65 -11.473 4.957 -9.762 1.00 34.49 N ATOM 459 CA ASN A 65 -11.864 5.898 -10.850 1.00 34.17 C ATOM 460 C ASN A 65 -13.058 6.798 -10.458 1.00 33.53 C ATOM 461 O ASN A 65 -13.538 7.536 -11.290 1.00 38.70 O ATOM 462 CB ASN A 65 -12.172 5.137 -12.180 1.00 34.87 C ATOM 463 CG ASN A 65 -13.426 4.273 -12.096 1.00 35.41 C ATOM 464 OD1 ASN A 65 -13.939 3.972 -11.018 1.00 41.19 O ATOM 465 ND2 ASN A 65 -13.929 3.881 -13.224 1.00 39.56 N ATOM 466 HD22 ASN A 65 -13.473 4.151 -14.119 1.00 0.00 H ATOM 467 HD21 ASN A 65 -14.789 3.296 -13.235 1.00 0.00 H ATOM 468 H ASN A 65 -12.223 4.455 -9.245 1.00 0.00 H ATOM 469 N GLN A 66 -13.456 6.804 -9.190 1.00 30.51 N ATOM 470 CA GLN A 66 -14.661 7.497 -8.712 1.00 32.47 C ATOM 471 C GLN A 66 -14.446 7.981 -7.290 1.00 31.67 C ATOM 472 O GLN A 66 -14.021 7.204 -6.448 1.00 34.88 O ATOM 473 CB GLN A 66 -15.861 6.570 -8.717 1.00 35.14 C ATOM 474 CG GLN A 66 -16.564 6.525 -10.057 1.00 40.32 C ATOM 475 CD GLN A 66 -17.582 5.403 -10.171 1.00 47.31 C ATOM 476 OE1 GLN A 66 -17.949 5.011 -11.259 1.00 56.98 O ATOM 477 NE2 GLN A 66 -18.017 4.872 -9.052 1.00 55.03 N ATOM 478 HE22 GLN A 66 -17.679 5.235 -8.138 1.00 0.00 H ATOM 479 HE21 GLN A 66 -18.700 4.088 -9.079 1.00 0.00 H ATOM 480 H GLN A 66 -12.881 6.288 -8.494 1.00 0.00 H ATOM 481 N ILE A 67 -14.674 9.265 -7.051 1.00 30.93 N ATOM 482 CA ILE A 67 -14.549 9.851 -5.709 1.00 33.84 C ATOM 483 C ILE A 67 -15.845 10.650 -5.528 1.00 32.31 C ATOM 484 O ILE A 67 -16.381 11.192 -6.481 1.00 32.84 O ATOM 485 CB ILE A 67 -13.256 10.745 -5.545 1.00 32.92 C ATOM 486 CG1 ILE A 67 -12.010 9.977 -5.936 1.00 30.83 C ATOM 487 CG2 ILE A 67 -13.126 11.351 -4.124 1.00 32.31 C ATOM 488 CD1 ILE A 67 -10.786 10.839 -6.154 1.00 32.79 C ATOM 489 H ILE A 67 -14.952 9.880 -7.842 1.00 0.00 H ATOM 490 N GLU A 68 -16.394 10.621 -4.327 1.00 36.94 N ATOM 491 CA GLU A 68 -17.639 11.316 -4.036 1.00 33.66 C ATOM 492 C GLU A 68 -17.419 12.060 -2.749 1.00 35.77 C ATOM 493 O GLU A 68 -16.962 11.445 -1.768 1.00 32.19 O ATOM 494 CB GLU A 68 -18.806 10.346 -3.899 1.00 35.92 C ATOM 495 CG GLU A 68 -20.179 11.031 -3.862 1.00 37.71 C ATOM 496 CD GLU A 68 -21.277 10.129 -3.309 1.00 41.64 C ATOM 497 OE1 GLU A 68 -22.311 9.974 -3.988 1.00 40.06 O ATOM 498 OE2 GLU A 68 -21.114 9.597 -2.187 1.00 36.10 O ATOM 499 H GLU A 68 -15.924 10.087 -3.569 1.00 0.00 H ATOM 500 N VAL A 69 -17.747 13.369 -2.773 1.00 33.76 N ATOM 501 CA VAL A 69 -17.703 14.237 -1.640 1.00 36.14 C ATOM 502 C VAL A 69 -19.147 14.708 -1.386 1.00 35.76 C ATOM 503 O VAL A 69 -19.779 15.292 -2.285 1.00 33.62 O ATOM 504 CB VAL A 69 -16.747 15.454 -1.891 1.00 39.95 C ATOM 505 CG1 VAL A 69 -16.747 16.410 -0.695 1.00 39.02 C ATOM 506 CG2 VAL A 69 -15.319 14.978 -2.153 1.00 39.39 C ATOM 507 H VAL A 69 -18.053 13.774 -3.681 1.00 0.00 H ATOM 508 N VAL A 70 -19.658 14.414 -0.184 1.00 31.30 N ATOM 509 CA VAL A 70 -21.001 14.786 0.269 1.00 30.17 C ATOM 510 C VAL A 70 -20.907 15.711 1.498 1.00 32.43 C ATOM 511 O VAL A 70 -20.210 15.399 2.458 1.00 35.96 O ATOM 512 CB VAL A 70 -21.873 13.557 0.604 1.00 28.61 C ATOM 513 CG1 VAL A 70 -23.300 13.983 0.797 1.00 30.94 C ATOM 514 CG2 VAL A 70 -21.788 12.461 -0.448 1.00 30.60 C ATOM 515 H VAL A 70 -19.057 13.882 0.477 1.00 0.00 H ATOM 516 N ILE A 71 -21.540 16.894 1.421 1.00 34.76 N ATOM 517 CA ILE A 71 -21.729 17.766 2.586 1.00 34.82 C ATOM 518 C ILE A 71 -23.077 17.276 3.137 1.00 34.72 C ATOM 519 O ILE A 71 -24.143 17.454 2.513 1.00 34.01 O ATOM 520 CB ILE A 71 -21.820 19.283 2.316 1.00 34.06 C ATOM 521 CG1 ILE A 71 -20.736 19.770 1.370 1.00 36.07 C ATOM 522 CG2 ILE A 71 -21.761 20.067 3.637 1.00 32.74 C ATOM 523 CD1 ILE A 71 -20.902 21.213 0.941 1.00 39.52 C ATOM 524 H ILE A 71 -21.910 17.204 0.500 1.00 0.00 H ATOM 525 N GLU A 72 -23.005 16.617 4.263 1.00 29.33 N ATOM 526 CA GLU A 72 -24.173 16.124 4.938 1.00 34.10 C ATOM 527 C GLU A 72 -24.713 17.100 5.969 1.00 34.45 C ATOM 528 O GLU A 72 -24.107 18.139 6.249 1.00 39.18 O ATOM 529 CB GLU A 72 -23.854 14.836 5.598 1.00 35.21 C ATOM 530 CG GLU A 72 -23.250 13.828 4.657 1.00 37.94 C ATOM 531 CD GLU A 72 -23.057 12.510 5.321 1.00 43.78 C ATOM 532 OE1 GLU A 72 -22.597 12.467 6.497 1.00 51.75 O ATOM 533 OE2 GLU A 72 -23.363 11.513 4.661 1.00 42.83 O ATOM 534 H GLU A 72 -22.070 16.444 4.685 1.00 0.00 H ATOM 535 N LYS A 73 -25.895 16.772 6.478 1.00 36.52 N ATOM 536 CA LYS A 73 -26.542 17.495 7.564 1.00 42.76 C ATOM 537 C LYS A 73 -25.550 17.759 8.708 1.00 37.49 C ATOM 538 O LYS A 73 -24.778 16.889 9.068 1.00 36.30 O ATOM 539 CB LYS A 73 -27.711 16.647 8.087 1.00 49.04 C ATOM 540 CG LYS A 73 -28.926 17.420 8.549 1.00 61.76 C ATOM 541 CD LYS A 73 -30.176 16.547 8.448 1.00 71.29 C ATOM 542 CE LYS A 73 -31.265 16.982 9.420 1.00 80.04 C ATOM 543 NZ LYS A 73 -30.930 16.624 10.836 1.00 83.22 N ATOM 544 HZ1 LYS A 73 -30.817 15.593 10.914 1.00 0.00 H ATOM 545 HZ2 LYS A 73 -30.043 17.093 11.110 1.00 0.00 H ATOM 546 HZ3 LYS A 73 -31.698 16.938 11.463 1.00 0.00 H ATOM 547 H LYS A 73 -26.388 15.949 6.077 1.00 0.00 H ATOM 548 N ASP A 74 -25.579 18.967 9.237 1.00 38.11 N ATOM 549 CA ASP A 74 -24.758 19.408 10.392 1.00 42.75 C ATOM 550 C ASP A 74 -23.303 19.649 10.008 1.00 39.85 C ATOM 551 O ASP A 74 -22.421 19.655 10.855 1.00 38.52 O ATOM 552 CB ASP A 74 -24.863 18.444 11.593 1.00 49.08 C ATOM 553 CG ASP A 74 -26.323 18.153 12.009 1.00 58.11 C ATOM 554 OD1 ASP A 74 -27.155 19.097 12.034 1.00 54.78 O ATOM 555 OD2 ASP A 74 -26.624 16.970 12.311 1.00 65.96 O ATOM 556 H ASP A 74 -26.226 19.662 8.813 1.00 0.00 H ATOM 557 N ASN A 75 -23.048 19.836 8.721 1.00 38.11 N ATOM 558 CA ASN A 75 -21.675 19.993 8.202 1.00 37.10 C ATOM 559 C ASN A 75 -20.674 18.857 8.543 1.00 34.19 C ATOM 560 O ASN A 75 -19.470 19.056 8.773 1.00 37.00 O ATOM 561 CB ASN A 75 -21.167 21.397 8.488 1.00 37.11 C ATOM 562 CG ASN A 75 -21.889 22.432 7.667 1.00 43.04 C ATOM 563 OD1 ASN A 75 -21.486 22.770 6.559 1.00 42.58 O ATOM 564 ND2 ASN A 75 -22.960 22.980 8.231 1.00 45.85 N ATOM 565 HD22 ASN A 75 -23.270 22.666 9.173 1.00 0.00 H ATOM 566 HD21 ASN A 75 -23.488 23.723 7.731 1.00 0.00 H ATOM 567 H ASN A 75 -23.844 19.873 8.053 1.00 0.00 H ATOM 568 N TRP A 76 -21.202 17.641 8.509 1.00 35.81 N ATOM 569 CA TRP A 76 -20.406 16.455 8.318 1.00 32.58 C ATOM 570 C TRP A 76 -19.974 16.441 6.884 1.00 36.82 C ATOM 571 O TRP A 76 -20.723 16.899 6.010 1.00 35.45 O ATOM 572 CB TRP A 76 -21.202 15.182 8.574 1.00 35.66 C ATOM 573 CG TRP A 76 -21.411 14.857 10.011 1.00 38.40 C ATOM 574 CD1 TRP A 76 -22.319 15.450 10.856 1.00 41.77 C ATOM 575 CD2 TRP A 76 -20.718 13.857 10.787 1.00 39.45 C ATOM 576 NE1 TRP A 76 -22.216 14.893 12.114 1.00 44.12 N ATOM 577 CE2 TRP A 76 -21.251 13.907 12.101 1.00 42.54 C ATOM 578 CE3 TRP A 76 -19.683 12.937 10.506 1.00 41.30 C ATOM 579 CZ2 TRP A 76 -20.790 13.053 13.143 1.00 40.82 C ATOM 580 CZ3 TRP A 76 -19.231 12.088 11.531 1.00 42.31 C ATOM 581 CH2 TRP A 76 -19.796 12.151 12.837 1.00 38.25 C ATOM 582 HE1 TRP A 76 -22.778 15.173 12.943 1.00 0.00 H ATOM 583 H TRP A 76 -22.231 17.539 8.625 1.00 0.00 H ATOM 584 N ILE A 77 -18.772 15.904 6.648 1.00 37.58 N ATOM 585 CA ILE A 77 -18.300 15.595 5.300 1.00 37.19 C ATOM 586 C ILE A 77 -18.140 14.069 5.183 1.00 35.42 C ATOM 587 O ILE A 77 -17.751 13.414 6.132 1.00 29.91 O ATOM 588 CB ILE A 77 -16.978 16.294 5.055 1.00 39.38 C ATOM 589 CG1 ILE A 77 -17.203 17.822 5.008 1.00 36.76 C ATOM 590 CG2 ILE A 77 -16.240 15.736 3.813 1.00 39.66 C ATOM 591 CD1 ILE A 77 -17.769 18.327 3.702 1.00 40.20 C ATOM 592 H ILE A 77 -18.149 15.698 7.455 1.00 0.00 H ATOM 593 N LYS A 78 -18.529 13.529 4.036 1.00 31.62 N ATOM 594 CA LYS A 78 -18.272 12.124 3.695 1.00 33.22 C ATOM 595 C LYS A 78 -17.524 12.072 2.383 1.00 32.94 C ATOM 596 O LYS A 78 -17.970 12.673 1.371 1.00 31.40 O ATOM 597 CB LYS A 78 -19.537 11.345 3.577 1.00 34.29 C ATOM 598 CG LYS A 78 -19.347 9.870 3.283 1.00 33.87 C ATOM 599 CD LYS A 78 -20.650 9.173 3.180 1.00 42.85 C ATOM 600 CE LYS A 78 -21.570 9.855 2.168 1.00 44.36 C ATOM 601 NZ LYS A 78 -22.830 9.113 2.036 1.00 46.71 N ATOM 602 HZ1 LYS A 78 -22.629 8.145 1.712 1.00 0.00 H ATOM 603 HZ2 LYS A 78 -23.309 9.078 2.959 1.00 0.00 H ATOM 604 HZ3 LYS A 78 -23.442 9.591 1.344 1.00 0.00 H ATOM 605 H LYS A 78 -19.036 14.124 3.351 1.00 0.00 H ATOM 606 N VAL A 79 -16.355 11.423 2.424 1.00 34.94 N ATOM 607 CA VAL A 79 -15.542 11.172 1.222 1.00 32.53 C ATOM 608 C VAL A 79 -15.498 9.646 1.016 1.00 32.50 C ATOM 609 O VAL A 79 -15.299 8.878 1.944 1.00 27.34 O ATOM 610 CB VAL A 79 -14.143 11.822 1.271 1.00 34.51 C ATOM 611 CG1 VAL A 79 -13.477 11.670 -0.076 1.00 35.85 C ATOM 612 CG2 VAL A 79 -14.205 13.305 1.645 1.00 34.60 C ATOM 613 H VAL A 79 -16.006 11.082 3.342 1.00 0.00 H ATOM 614 N THR A 80 -15.801 9.232 -0.211 1.00 31.30 N ATOM 615 CA THR A 80 -15.883 7.858 -0.613 1.00 30.96 C ATOM 616 C THR A 80 -15.026 7.730 -1.888 1.00 37.02 C ATOM 617 O THR A 80 -15.051 8.638 -2.733 1.00 40.01 O ATOM 618 CB THR A 80 -17.332 7.460 -0.903 1.00 32.67 C ATOM 619 OG1 THR A 80 -18.158 7.645 0.241 1.00 32.59 O ATOM 620 CG2 THR A 80 -17.420 6.037 -1.272 1.00 34.38 C ATOM 621 HG1 THR A 80 -18.140 8.598 0.509 1.00 0.00 H ATOM 622 H THR A 80 -15.992 9.957 -0.931 1.00 0.00 H ATOM 623 N ASP A 81 -14.222 6.662 -1.981 1.00 37.67 N ATOM 624 CA ASP A 81 -13.611 6.226 -3.250 1.00 38.59 C ATOM 625 C ASP A 81 -13.830 4.752 -3.475 1.00 35.68 C ATOM 626 O ASP A 81 -14.187 4.022 -2.528 1.00 38.67 O ATOM 627 CB ASP A 81 -12.125 6.577 -3.295 1.00 37.73 C ATOM 628 CG ASP A 81 -11.246 5.701 -2.380 1.00 37.03 C ATOM 629 OD1 ASP A 81 -10.338 6.252 -1.768 1.00 38.47 O ATOM 630 OD2 ASP A 81 -11.406 4.469 -2.292 1.00 39.30 O ATOM 631 H ASP A 81 -14.020 6.116 -1.119 1.00 0.00 H ATOM 632 N ASN A 82 -13.557 4.296 -4.696 1.00 35.05 N ATOM 633 CA ASN A 82 -13.736 2.877 -5.054 1.00 31.82 C ATOM 634 C ASN A 82 -12.423 2.138 -5.297 1.00 35.39 C ATOM 635 O ASN A 82 -12.345 1.300 -6.174 1.00 36.49 O ATOM 636 CB ASN A 82 -14.721 2.708 -6.228 1.00 35.38 C ATOM 637 CG ASN A 82 -14.195 3.271 -7.548 1.00 34.82 C ATOM 638 OD1 ASN A 82 -13.271 4.068 -7.565 1.00 30.35 O ATOM 639 ND2 ASN A 82 -14.846 2.913 -8.646 1.00 35.19 N ATOM 640 HD22 ASN A 82 -15.628 2.230 -8.587 1.00 0.00 H ATOM 641 HD21 ASN A 82 -14.574 3.315 -9.566 1.00 0.00 H ATOM 642 H ASN A 82 -13.208 4.959 -5.417 1.00 0.00 H ATOM 643 N GLY A 83 -11.402 2.435 -4.493 1.00 34.18 N ATOM 644 CA GLY A 83 -10.128 1.810 -4.610 1.00 36.61 C ATOM 645 C GLY A 83 -10.087 0.548 -3.786 1.00 33.86 C ATOM 646 O GLY A 83 -11.095 -0.078 -3.556 1.00 39.00 O ATOM 647 H GLY A 83 -11.541 3.151 -3.752 1.00 0.00 H ATOM 648 N ARG A 84 -8.911 0.200 -3.318 1.00 38.05 N ATOM 649 CA ARG A 84 -8.678 -1.122 -2.708 1.00 36.84 C ATOM 650 C ARG A 84 -9.139 -1.245 -1.288 1.00 39.37 C ATOM 651 O ARG A 84 -9.283 -2.358 -0.813 1.00 36.22 O ATOM 652 CB ARG A 84 -7.220 -1.457 -2.731 1.00 37.89 C ATOM 653 CG ARG A 84 -6.766 -1.825 -4.164 1.00 40.99 C ATOM 654 CD ARG A 84 -5.270 -1.873 -4.247 1.00 39.90 C ATOM 655 NE ARG A 84 -4.693 -0.588 -3.914 1.00 46.37 N ATOM 656 CZ ARG A 84 -3.400 -0.284 -4.012 1.00 53.15 C ATOM 657 NH1 ARG A 84 -2.974 0.931 -3.682 1.00 50.40 N ATOM 658 NH2 ARG A 84 -2.536 -1.165 -4.472 1.00 51.20 N ATOM 659 HE ARG A 84 -5.337 0.154 -3.572 1.00 0.00 H ATOM 660 HH12 ARG A 84 -1.964 1.167 -3.759 1.00 0.00 H ATOM 661 HH11 ARG A 84 -3.651 1.646 -3.347 1.00 0.00 H ATOM 662 HH22 ARG A 84 -1.529 -0.917 -4.544 1.00 0.00 H ATOM 663 HH21 ARG A 84 -2.861 -2.109 -4.763 1.00 0.00 H ATOM 664 H ARG A 84 -8.122 0.875 -3.379 1.00 0.00 H ATOM 665 N GLY A 85 -9.354 -0.118 -0.606 1.00 36.52 N ATOM 666 CA GLY A 85 -9.680 -0.160 0.813 1.00 34.16 C ATOM 667 C GLY A 85 -8.420 0.007 1.612 1.00 35.36 C ATOM 668 O GLY A 85 -7.388 -0.637 1.322 1.00 38.86 O ATOM 669 H GLY A 85 -9.288 0.799 -1.092 1.00 0.00 H ATOM 670 N ILE A 86 -8.468 0.879 2.620 1.00 32.94 N ATOM 671 CA ILE A 86 -7.363 0.961 3.540 1.00 31.55 C ATOM 672 C ILE A 86 -7.116 -0.446 4.138 1.00 34.73 C ATOM 673 O ILE A 86 -8.067 -1.120 4.542 1.00 37.61 O ATOM 674 CB ILE A 86 -7.520 2.014 4.684 1.00 32.73 C ATOM 675 CG1 ILE A 86 -7.815 3.411 4.159 1.00 31.91 C ATOM 676 CG2 ILE A 86 -6.238 2.102 5.535 1.00 32.96 C ATOM 677 CD1 ILE A 86 -8.272 4.378 5.210 1.00 34.29 C ATOM 678 H ILE A 86 -9.297 1.495 2.741 1.00 0.00 H ATOM 679 N PRO A 87 -5.850 -0.894 4.201 1.00 35.40 N ATOM 680 CA PRO A 87 -5.530 -2.221 4.728 1.00 36.39 C ATOM 681 C PRO A 87 -5.949 -2.428 6.160 1.00 37.42 C ATOM 682 O PRO A 87 -5.910 -1.505 6.944 1.00 35.06 O ATOM 683 CB PRO A 87 -4.001 -2.273 4.693 1.00 39.29 C ATOM 684 CG PRO A 87 -3.594 -1.290 3.668 1.00 40.54 C ATOM 685 CD PRO A 87 -4.676 -0.245 3.591 1.00 39.47 C ATOM 686 N VAL A 88 -6.279 -3.663 6.493 1.00 39.23 N ATOM 687 CA VAL A 88 -6.805 -3.991 7.802 1.00 42.72 C ATOM 688 C VAL A 88 -5.920 -4.981 8.568 1.00 44.04 C ATOM 689 O VAL A 88 -6.216 -5.297 9.714 1.00 44.00 O ATOM 690 CB VAL A 88 -8.261 -4.511 7.663 1.00 46.00 C ATOM 691 CG1 VAL A 88 -9.136 -3.454 7.023 1.00 42.38 C ATOM 692 CG2 VAL A 88 -8.337 -5.812 6.837 1.00 51.53 C ATOM 693 H VAL A 88 -6.157 -4.423 5.794 1.00 0.00 H ATOM 694 N ASP A 89 -4.833 -5.442 7.944 1.00 43.27 N ATOM 695 CA ASP A 89 -3.958 -6.455 8.524 1.00 45.81 C ATOM 696 C ASP A 89 -3.249 -5.911 9.748 1.00 46.32 C ATOM 697 O ASP A 89 -2.992 -4.696 9.861 1.00 45.45 O ATOM 698 CB ASP A 89 -2.965 -7.001 7.483 1.00 48.89 C ATOM 699 CG ASP A 89 -2.130 -5.891 6.790 1.00 64.11 C ATOM 700 OD1 ASP A 89 -2.421 -5.514 5.611 1.00 64.12 O ATOM 701 OD2 ASP A 89 -1.174 -5.400 7.437 1.00 65.30 O ATOM 702 H ASP A 89 -4.600 -5.062 7.004 1.00 0.00 H ATOM 703 N ILE A 90 -2.985 -6.815 10.687 1.00 48.08 N ATOM 704 CA ILE A 90 -2.334 -6.490 11.951 1.00 49.01 C ATOM 705 C ILE A 90 -0.875 -6.122 11.686 1.00 52.52 C ATOM 706 O ILE A 90 -0.127 -6.931 11.157 1.00 52.82 O ATOM 707 CB ILE A 90 -2.430 -7.663 12.976 1.00 50.83 C ATOM 708 CG1 ILE A 90 -3.902 -7.929 13.364 1.00 49.15 C ATOM 709 CG2 ILE A 90 -1.571 -7.405 14.222 1.00 48.26 C ATOM 710 CD1 ILE A 90 -4.663 -6.730 13.903 1.00 48.97 C ATOM 711 H ILE A 90 -3.256 -7.803 10.511 1.00 0.00 H ATOM 712 N GLN A 91 -0.514 -4.872 11.987 1.00 55.31 N ATOM 713 CA GLN A 91 0.883 -4.468 12.098 1.00 64.07 C ATOM 714 C GLN A 91 1.523 -5.311 13.206 1.00 71.86 C ATOM 715 O GLN A 91 0.924 -5.470 14.275 1.00 79.87 O ATOM 716 CB GLN A 91 1.001 -2.988 12.486 1.00 68.29 C ATOM 717 CG GLN A 91 1.168 -1.985 11.351 1.00 66.70 C ATOM 718 CD GLN A 91 2.286 -0.989 11.660 1.00 73.69 C ATOM 719 OE1 GLN A 91 2.570 -0.690 12.826 1.00 72.64 O ATOM 720 NE2 GLN A 91 2.940 -0.495 10.626 1.00 75.25 N ATOM 721 HE22 GLN A 91 2.671 -0.771 9.660 1.00 0.00 H ATOM 722 HE21 GLN A 91 3.725 0.171 10.777 1.00 0.00 H ATOM 723 H GLN A 91 -1.256 -4.161 12.148 1.00 0.00 H ATOM 724 N GLU A 92 2.705 -5.870 12.950 1.00 71.96 N ATOM 725 CA GLU A 92 3.409 -6.683 13.955 1.00 73.85 C ATOM 726 C GLU A 92 3.947 -5.787 15.056 1.00 72.58 C ATOM 727 O GLU A 92 3.922 -6.128 16.229 1.00 71.31 O ATOM 728 CB GLU A 92 4.597 -7.420 13.336 1.00 76.19 C ATOM 729 CG GLU A 92 4.266 -8.423 12.246 1.00 73.92 C ATOM 730 CD GLU A 92 5.460 -9.298 11.895 1.00 73.21 C ATOM 731 OE1 GLU A 92 5.940 -9.248 10.744 1.00 73.46 O ATOM 732 OE2 GLU A 92 5.934 -10.032 12.780 1.00 83.62 O ATOM 733 H GLU A 92 3.141 -5.728 12.017 1.00 0.00 H ATOM 734 N LYS A 93 4.445 -4.634 14.647 1.00 79.01 N ATOM 735 CA LYS A 93 5.124 -3.713 15.554 1.00 86.59 C ATOM 736 C LYS A 93 4.212 -2.831 16.420 1.00 86.67 C ATOM 737 O LYS A 93 4.718 -2.156 17.317 1.00 82.29 O ATOM 738 CB LYS A 93 6.094 -2.832 14.756 1.00 91.43 C ATOM 739 CG LYS A 93 5.445 -2.045 13.626 1.00 86.52 C ATOM 740 CD LYS A 93 5.906 -0.612 13.630 1.00 86.59 C ATOM 741 CE LYS A 93 5.256 0.188 14.744 1.00 87.33 C ATOM 742 NZ LYS A 93 5.626 1.626 14.768 1.00 90.77 N ATOM 743 HZ1 LYS A 93 6.655 1.716 14.891 1.00 0.00 H ATOM 744 HZ2 LYS A 93 5.343 2.071 13.871 1.00 0.00 H ATOM 745 HZ3 LYS A 93 5.139 2.095 15.558 1.00 0.00 H ATOM 746 H LYS A 93 4.350 -4.373 13.645 1.00 0.00 H ATOM 747 N MET A 94 2.905 -2.785 16.124 1.00 89.89 N ATOM 748 CA MET A 94 1.886 -2.175 17.032 1.00 80.29 C ATOM 749 C MET A 94 0.924 -3.210 17.636 1.00 67.29 C ATOM 750 O MET A 94 0.335 -2.955 18.683 1.00 63.24 O ATOM 751 CB MET A 94 1.051 -1.098 16.307 1.00 88.06 C ATOM 752 CG MET A 94 1.805 0.160 15.882 1.00 95.92 C ATOM 753 SD MET A 94 2.006 1.497 17.096 1.00100.33 S ATOM 754 CE MET A 94 2.672 2.786 16.042 1.00 99.83 C ATOM 755 H MET A 94 2.586 -3.192 15.222 1.00 0.00 H ATOM 756 N GLY A 95 0.743 -4.359 16.975 1.00 55.23 N ATOM 757 CA GLY A 95 -0.346 -5.275 17.305 1.00 52.12 C ATOM 758 C GLY A 95 -1.730 -4.831 16.827 1.00 51.63 C ATOM 759 O GLY A 95 -2.684 -5.569 17.046 1.00 52.71 O ATOM 760 H GLY A 95 1.396 -4.607 16.205 1.00 0.00 H ATOM 761 N ARG A 96 -1.824 -3.672 16.138 1.00 45.40 N ATOM 762 CA ARG A 96 -3.089 -3.011 15.754 1.00 44.76 C ATOM 763 C ARG A 96 -3.274 -3.045 14.241 1.00 44.50 C ATOM 764 O ARG A 96 -2.287 -3.048 13.505 1.00 39.65 O ATOM 765 CB ARG A 96 -3.111 -1.526 16.179 1.00 43.16 C ATOM 766 CG ARG A 96 -2.698 -1.247 17.616 1.00 46.36 C ATOM 767 CD ARG A 96 -3.468 -2.101 18.612 1.00 47.11 C ATOM 768 NE ARG A 96 -4.831 -1.595 18.798 1.00 53.26 N ATOM 769 CZ ARG A 96 -5.933 -2.330 18.908 1.00 55.02 C ATOM 770 NH1 ARG A 96 -7.115 -1.747 19.108 1.00 54.25 N ATOM 771 NH2 ARG A 96 -5.879 -3.649 18.813 1.00 65.87 N ATOM 772 HE ARG A 96 -4.947 -0.563 18.849 1.00 0.00 H ATOM 773 HH12 ARG A 96 -7.974 -2.328 19.193 1.00 0.00 H ATOM 774 HH11 ARG A 96 -7.179 -0.711 19.179 1.00 0.00 H ATOM 775 HH22 ARG A 96 -6.749 -4.213 18.901 1.00 0.00 H ATOM 776 HH21 ARG A 96 -4.967 -4.122 18.650 1.00 0.00 H ATOM 777 H ARG A 96 -0.937 -3.209 15.856 1.00 0.00 H ATOM 778 N PRO A 97 -4.538 -3.033 13.778 1.00 41.24 N ATOM 779 CA PRO A 97 -4.766 -3.050 12.326 1.00 39.80 C ATOM 780 C PRO A 97 -4.211 -1.811 11.639 1.00 37.40 C ATOM 781 O PRO A 97 -4.251 -0.721 12.174 1.00 36.33 O ATOM 782 CB PRO A 97 -6.301 -3.115 12.193 1.00 42.96 C ATOM 783 CG PRO A 97 -6.790 -3.580 13.541 1.00 42.05 C ATOM 784 CD PRO A 97 -5.798 -3.125 14.548 1.00 41.47 C ATOM 785 N ALA A 98 -3.681 -2.005 10.450 1.00 39.61 N ATOM 786 CA ALA A 98 -3.084 -0.936 9.688 1.00 36.26 C ATOM 787 C ALA A 98 -3.984 0.305 9.646 1.00 39.54 C ATOM 788 O ALA A 98 -3.498 1.415 9.849 1.00 39.23 O ATOM 789 CB ALA A 98 -2.784 -1.438 8.282 1.00 38.55 C ATOM 790 H ALA A 98 -3.693 -2.963 10.046 1.00 0.00 H ATOM 791 N VAL A 99 -5.302 0.103 9.405 1.00 40.09 N ATOM 792 CA VAL A 99 -6.210 1.204 9.266 1.00 38.51 C ATOM 793 C VAL A 99 -6.299 2.077 10.522 1.00 36.95 C ATOM 794 O VAL A 99 -6.336 3.325 10.440 1.00 36.91 O ATOM 795 CB VAL A 99 -7.585 0.787 8.705 1.00 36.45 C ATOM 796 CG1 VAL A 99 -8.253 -0.321 9.539 1.00 36.84 C ATOM 797 CG2 VAL A 99 -8.462 2.008 8.601 1.00 37.52 C ATOM 798 H VAL A 99 -5.662 -0.869 9.319 1.00 0.00 H ATOM 799 N GLU A 100 -6.294 1.443 11.680 1.00 37.67 N ATOM 800 CA GLU A 100 -6.216 2.170 12.929 1.00 40.05 C ATOM 801 C GLU A 100 -4.914 2.966 13.051 1.00 40.47 C ATOM 802 O GLU A 100 -4.917 4.137 13.498 1.00 38.01 O ATOM 803 CB GLU A 100 -6.356 1.216 14.133 1.00 40.28 C ATOM 804 CG GLU A 100 -6.512 1.963 15.451 1.00 44.73 C ATOM 805 CD GLU A 100 -6.549 1.028 16.635 1.00 45.96 C ATOM 806 OE1 GLU A 100 -5.649 1.142 17.464 1.00 47.92 O ATOM 807 OE2 GLU A 100 -7.445 0.173 16.708 1.00 40.96 O ATOM 808 H GLU A 100 -6.347 0.404 11.695 1.00 0.00 H ATOM 809 N VAL A 101 -3.797 2.342 12.680 1.00 38.36 N ATOM 810 CA VAL A 101 -2.473 3.016 12.803 1.00 36.11 C ATOM 811 C VAL A 101 -2.408 4.305 11.925 1.00 38.44 C ATOM 812 O VAL A 101 -1.967 5.340 12.405 1.00 41.97 O ATOM 813 CB VAL A 101 -1.297 2.022 12.528 1.00 37.02 C ATOM 814 CG1 VAL A 101 0.058 2.729 12.424 1.00 35.95 C ATOM 815 CG2 VAL A 101 -1.268 0.897 13.593 1.00 34.62 C ATOM 816 H VAL A 101 -3.849 1.375 12.301 1.00 0.00 H ATOM 817 N ILE A 102 -2.891 4.214 10.674 1.00 37.10 N ATOM 818 CA ILE A 102 -2.919 5.304 9.713 1.00 38.19 C ATOM 819 C ILE A 102 -3.838 6.431 10.186 1.00 38.41 C ATOM 820 O ILE A 102 -3.481 7.603 10.130 1.00 39.14 O ATOM 821 CB ILE A 102 -3.380 4.796 8.306 1.00 40.25 C ATOM 822 CG1 ILE A 102 -2.303 3.911 7.665 1.00 42.67 C ATOM 823 CG2 ILE A 102 -3.699 5.959 7.356 1.00 42.48 C ATOM 824 CD1 ILE A 102 -2.842 2.980 6.615 1.00 44.77 C ATOM 825 H ILE A 102 -3.273 3.295 10.371 1.00 0.00 H ATOM 826 N LEU A 103 -4.995 6.053 10.700 1.00 38.85 N ATOM 827 CA LEU A 103 -5.972 6.998 11.237 1.00 41.92 C ATOM 828 C LEU A 103 -5.628 7.617 12.600 1.00 34.75 C ATOM 829 O LEU A 103 -5.931 8.800 12.832 1.00 36.75 O ATOM 830 CB LEU A 103 -7.382 6.376 11.224 1.00 43.47 C ATOM 831 CG LEU A 103 -7.943 6.276 9.794 1.00 47.84 C ATOM 832 CD1 LEU A 103 -9.147 5.371 9.753 1.00 53.22 C ATOM 833 CD2 LEU A 103 -8.337 7.636 9.230 1.00 53.86 C ATOM 834 H LEU A 103 -5.220 5.038 10.723 1.00 0.00 H ATOM 835 N THR A 104 -4.957 6.892 13.468 1.00 37.68 N ATOM 836 CA THR A 104 -4.488 7.499 14.721 1.00 40.75 C ATOM 837 C THR A 104 -3.220 8.329 14.567 1.00 40.92 C ATOM 838 O THR A 104 -2.922 9.179 15.411 1.00 42.56 O ATOM 839 CB THR A 104 -4.283 6.456 15.832 1.00 44.95 C ATOM 840 OG1 THR A 104 -3.328 5.459 15.433 1.00 45.53 O ATOM 841 CG2 THR A 104 -5.642 5.821 16.178 1.00 41.95 C ATOM 842 HG1 THR A 104 -3.654 4.998 14.620 1.00 0.00 H ATOM 843 H THR A 104 -4.759 5.891 13.268 1.00 0.00 H ATOM 844 N SER A 128 -2.657 8.367 13.327 1.00 40.42 N ATOM 845 CA SER A 128 -1.703 9.466 13.055 1.00 40.99 C ATOM 846 C SER A 128 -2.207 10.472 11.994 1.00 40.69 C ATOM 847 O SER A 128 -1.400 11.164 11.397 1.00 41.33 O ATOM 848 CB SER A 128 -0.375 8.860 12.641 1.00 39.92 C ATOM 849 OG SER A 128 -0.557 7.969 11.559 1.00 43.48 O ATOM 850 HG SER A 128 -0.942 8.460 10.790 1.00 0.00 H ATOM 851 H SER A 128 -2.887 7.656 12.604 1.00 0.00 H ATOM 852 N SER A 129 -3.523 10.545 11.753 1.00 36.50 N ATOM 853 CA SER A 129 -4.079 11.481 10.773 1.00 35.70 C ATOM 854 C SER A 129 -4.314 12.813 11.455 1.00 37.26 C ATOM 855 O SER A 129 -4.936 12.843 12.518 1.00 34.92 O ATOM 856 CB SER A 129 -5.395 10.956 10.167 1.00 36.35 C ATOM 857 OG SER A 129 -6.244 11.994 9.716 1.00 38.38 O ATOM 858 HG SER A 129 -6.475 12.584 10.477 1.00 0.00 H ATOM 859 H SER A 129 -4.168 9.919 12.277 1.00 0.00 H ATOM 860 N VAL A 130 -3.857 13.910 10.837 1.00 35.86 N ATOM 861 CA VAL A 130 -4.271 15.285 11.268 1.00 40.85 C ATOM 862 C VAL A 130 -5.785 15.535 11.216 1.00 38.19 C ATOM 863 O VAL A 130 -6.344 16.099 12.173 1.00 34.44 O ATOM 864 CB VAL A 130 -3.549 16.444 10.538 1.00 46.32 C ATOM 865 CG1 VAL A 130 -2.051 16.418 10.834 1.00 50.91 C ATOM 866 CG2 VAL A 130 -3.805 16.421 9.042 1.00 54.58 C ATOM 867 H VAL A 130 -3.199 13.805 10.039 1.00 0.00 H ATOM 868 N VAL A 131 -6.453 15.077 10.145 1.00 38.03 N ATOM 869 CA VAL A 131 -7.901 15.266 10.016 1.00 33.52 C ATOM 870 C VAL A 131 -8.598 14.696 11.246 1.00 31.04 C ATOM 871 O VAL A 131 -9.328 15.400 11.903 1.00 34.44 O ATOM 872 CB VAL A 131 -8.476 14.697 8.705 1.00 36.64 C ATOM 873 CG1 VAL A 131 -9.998 14.737 8.722 1.00 37.47 C ATOM 874 CG2 VAL A 131 -7.934 15.486 7.521 1.00 34.18 C ATOM 875 H VAL A 131 -5.934 14.579 9.394 1.00 0.00 H ATOM 876 N ASN A 132 -8.304 13.445 11.560 1.00 34.92 N ATOM 877 CA ASN A 132 -8.889 12.708 12.691 1.00 35.93 C ATOM 878 C ASN A 132 -8.632 13.421 13.983 1.00 37.42 C ATOM 879 O ASN A 132 -9.563 13.653 14.754 1.00 36.23 O ATOM 880 CB ASN A 132 -8.272 11.305 12.716 1.00 34.19 C ATOM 881 CG ASN A 132 -9.075 10.291 13.483 1.00 35.52 C ATOM 882 OD1 ASN A 132 -10.210 10.499 13.864 1.00 35.37 O ATOM 883 ND2 ASN A 132 -8.435 9.156 13.751 1.00 39.96 N ATOM 884 HD22 ASN A 132 -7.464 9.013 13.408 1.00 0.00 H ATOM 885 HD21 ASN A 132 -8.906 8.411 14.303 1.00 0.00 H ATOM 886 H ASN A 132 -7.611 12.948 10.966 1.00 0.00 H ATOM 887 N ALA A 133 -7.380 13.836 14.198 1.00 40.87 N ATOM 888 CA ALA A 133 -7.027 14.581 15.451 1.00 45.79 C ATOM 889 C ALA A 133 -7.814 15.879 15.634 1.00 41.76 C ATOM 890 O ALA A 133 -8.133 16.245 16.750 1.00 37.25 O ATOM 891 CB ALA A 133 -5.538 14.888 15.518 1.00 42.70 C ATOM 892 H ALA A 133 -6.644 13.641 13.490 1.00 0.00 H ATOM 893 N LEU A 134 -8.105 16.553 14.519 1.00 36.75 N ATOM 894 CA LEU A 134 -8.869 17.806 14.504 1.00 34.83 C ATOM 895 C LEU A 134 -10.381 17.650 14.218 1.00 32.45 C ATOM 896 O LEU A 134 -11.092 18.634 13.996 1.00 30.61 O ATOM 897 CB LEU A 134 -8.230 18.754 13.500 1.00 35.07 C ATOM 898 CG LEU A 134 -6.721 19.040 13.735 1.00 37.30 C ATOM 899 CD1 LEU A 134 -6.190 20.102 12.745 1.00 34.80 C ATOM 900 CD2 LEU A 134 -6.457 19.430 15.202 1.00 34.03 C ATOM 901 H LEU A 134 -7.772 16.169 13.612 1.00 0.00 H ATOM 902 N SER A 135 -10.866 16.422 14.281 1.00 31.54 N ATOM 903 CA SER A 135 -12.275 16.104 14.136 1.00 34.76 C ATOM 904 C SER A 135 -12.834 15.720 15.531 1.00 37.36 C ATOM 905 O SER A 135 -12.269 14.858 16.210 1.00 38.86 O ATOM 906 CB SER A 135 -12.403 14.966 13.152 1.00 33.72 C ATOM 907 OG SER A 135 -12.154 15.435 11.812 1.00 37.14 O ATOM 908 HG SER A 135 -11.239 15.808 11.759 1.00 0.00 H ATOM 909 H SER A 135 -10.201 15.639 14.444 1.00 0.00 H ATOM 910 N GLN A 136 -13.910 16.376 15.972 1.00 40.27 N ATOM 911 CA GLN A 136 -14.632 15.905 17.211 1.00 44.27 C ATOM 912 C GLN A 136 -15.146 14.478 17.061 1.00 39.01 C ATOM 913 O GLN A 136 -15.223 13.753 18.040 1.00 37.03 O ATOM 914 CB GLN A 136 -15.768 16.865 17.627 1.00 44.01 C ATOM 915 CG GLN A 136 -16.779 17.141 16.542 1.00 47.65 C ATOM 916 CD GLN A 136 -18.099 17.629 17.085 1.00 54.68 C ATOM 917 OE1 GLN A 136 -18.238 18.801 17.430 1.00 49.86 O ATOM 918 NE2 GLN A 136 -19.107 16.739 17.098 1.00 58.89 N ATOM 919 HE22 GLN A 136 -18.939 15.758 16.796 1.00 0.00 H ATOM 920 HE21 GLN A 136 -20.055 17.032 17.410 1.00 0.00 H ATOM 921 H GLN A 136 -14.252 17.214 15.460 1.00 0.00 H ATOM 922 N ASP A 137 -15.524 14.075 15.819 1.00 38.74 N ATOM 923 CA ASP A 137 -15.832 12.675 15.487 1.00 35.26 C ATOM 924 C ASP A 137 -15.421 12.360 14.061 1.00 32.58 C ATOM 925 O ASP A 137 -15.433 13.224 13.211 1.00 33.18 O ATOM 926 CB ASP A 137 -17.332 12.363 15.543 1.00 42.31 C ATOM 927 CG ASP A 137 -17.936 12.498 16.941 1.00 42.01 C ATOM 928 OD1 ASP A 137 -17.999 11.486 17.668 1.00 37.81 O ATOM 929 OD2 ASP A 137 -18.371 13.617 17.277 1.00 44.84 O ATOM 930 H ASP A 137 -15.599 14.790 15.068 1.00 0.00 H ATOM 931 N LEU A 138 -15.167 11.094 13.811 1.00 30.52 N ATOM 932 CA LEU A 138 -14.792 10.626 12.486 1.00 33.42 C ATOM 933 C LEU A 138 -15.067 9.135 12.463 1.00 34.25 C ATOM 934 O LEU A 138 -14.874 8.456 13.449 1.00 31.11 O ATOM 935 CB LEU A 138 -13.290 10.908 12.222 1.00 36.47 C ATOM 936 CG LEU A 138 -12.695 10.467 10.865 1.00 37.81 C ATOM 937 CD1 LEU A 138 -11.620 11.430 10.370 1.00 36.52 C ATOM 938 CD2 LEU A 138 -12.195 9.021 10.854 1.00 33.14 C ATOM 939 H LEU A 138 -15.237 10.405 14.587 1.00 0.00 H ATOM 940 N GLU A 139 -15.543 8.615 11.353 1.00 34.68 N ATOM 941 CA GLU A 139 -15.521 7.178 11.225 1.00 34.12 C ATOM 942 C GLU A 139 -15.033 6.749 9.861 1.00 32.54 C ATOM 943 O GLU A 139 -14.948 7.562 8.931 1.00 35.62 O ATOM 944 CB GLU A 139 -16.875 6.634 11.523 1.00 37.00 C ATOM 945 CG GLU A 139 -17.918 6.996 10.519 1.00 37.77 C ATOM 946 CD GLU A 139 -19.339 6.654 10.996 1.00 46.20 C ATOM 947 OE1 GLU A 139 -19.539 5.695 11.792 1.00 48.44 O ATOM 948 OE2 GLU A 139 -20.251 7.343 10.536 1.00 41.64 O ATOM 949 H GLU A 139 -15.922 9.218 10.595 1.00 0.00 H ATOM 950 N VAL A 140 -14.754 5.458 9.769 1.00 35.02 N ATOM 951 CA VAL A 140 -14.218 4.858 8.594 1.00 35.64 C ATOM 952 C VAL A 140 -15.013 3.599 8.349 1.00 35.90 C ATOM 953 O VAL A 140 -15.279 2.812 9.238 1.00 33.98 O ATOM 954 CB VAL A 140 -12.681 4.567 8.661 1.00 36.41 C ATOM 955 CG1 VAL A 140 -12.338 3.572 9.751 1.00 39.46 C ATOM 956 CG2 VAL A 140 -12.143 4.030 7.305 1.00 36.53 C ATOM 957 H VAL A 140 -14.935 4.853 10.595 1.00 0.00 H ATOM 958 N TYR A 141 -15.419 3.431 7.110 1.00 32.72 N ATOM 959 CA TYR A 141 -15.827 2.126 6.632 1.00 33.37 C ATOM 960 C TYR A 141 -14.834 1.700 5.573 1.00 32.56 C ATOM 961 O TYR A 141 -14.594 2.470 4.637 1.00 30.72 O ATOM 962 CB TYR A 141 -17.207 2.213 6.020 1.00 33.05 C ATOM 963 CG TYR A 141 -18.289 2.545 7.010 1.00 36.93 C ATOM 964 CD1 TYR A 141 -18.520 3.856 7.409 1.00 38.73 C ATOM 965 CD2 TYR A 141 -19.053 1.537 7.593 1.00 36.97 C ATOM 966 CE1 TYR A 141 -19.528 4.152 8.337 1.00 39.65 C ATOM 967 CE2 TYR A 141 -20.049 1.841 8.522 1.00 36.87 C ATOM 968 CZ TYR A 141 -20.286 3.137 8.867 1.00 35.84 C ATOM 969 OH TYR A 141 -21.278 3.418 9.793 1.00 40.88 O ATOM 970 HH TYR A 141 -21.327 4.396 9.936 1.00 0.00 H ATOM 971 H TYR A 141 -15.448 4.246 6.464 1.00 0.00 H ATOM 972 N VAL A 142 -14.350 0.464 5.667 1.00 33.85 N ATOM 973 CA VAL A 142 -13.507 -0.144 4.595 1.00 34.34 C ATOM 974 C VAL A 142 -14.203 -1.345 3.975 1.00 34.66 C ATOM 975 O VAL A 142 -14.623 -2.238 4.698 1.00 36.03 O ATOM 976 CB VAL A 142 -12.164 -0.581 5.179 1.00 37.99 C ATOM 977 CG1 VAL A 142 -11.300 -1.244 4.110 1.00 37.88 C ATOM 978 CG2 VAL A 142 -11.472 0.619 5.842 1.00 39.37 C ATOM 979 H VAL A 142 -14.566 -0.097 6.515 1.00 0.00 H ATOM 980 N HIS A 143 -14.389 -1.316 2.657 1.00 31.85 N ATOM 981 CA HIS A 143 -14.807 -2.454 1.872 1.00 33.34 C ATOM 982 C HIS A 143 -13.550 -3.127 1.271 1.00 35.84 C ATOM 983 O HIS A 143 -12.887 -2.579 0.384 1.00 34.10 O ATOM 984 CB HIS A 143 -15.755 -2.044 0.726 1.00 33.03 C ATOM 985 CG HIS A 143 -17.048 -1.451 1.163 1.00 33.13 C ATOM 986 ND1 HIS A 143 -18.259 -1.947 0.738 1.00 33.02 N ATOM 987 CD2 HIS A 143 -17.328 -0.384 1.942 1.00 32.41 C ATOM 988 CE1 HIS A 143 -19.234 -1.223 1.256 1.00 35.53 C ATOM 989 NE2 HIS A 143 -18.692 -0.283 2.010 1.00 36.44 N ATOM 990 H HIS A 143 -14.223 -0.417 2.161 1.00 0.00 H ATOM 991 N ARG A 144 -13.256 -4.339 1.732 1.00 37.37 N ATOM 992 CA ARG A 144 -12.060 -5.071 1.359 1.00 35.87 C ATOM 993 C ARG A 144 -12.259 -6.539 1.789 1.00 41.94 C ATOM 994 O ARG A 144 -12.821 -6.765 2.869 1.00 38.59 O ATOM 995 CB ARG A 144 -10.885 -4.451 2.119 1.00 37.05 C ATOM 996 CG ARG A 144 -9.535 -4.927 1.664 1.00 41.11 C ATOM 997 CD ARG A 144 -8.444 -4.048 2.225 1.00 45.62 C ATOM 998 NE ARG A 144 -7.099 -4.624 2.060 1.00 43.75 N ATOM 999 CZ ARG A 144 -6.108 -4.128 1.326 1.00 43.16 C ATOM 1000 NH1 ARG A 144 -6.222 -3.025 0.566 1.00 43.42 N ATOM 1001 NH2 ARG A 144 -4.977 -4.771 1.341 1.00 46.81 N ATOM 1002 HE ARG A 144 -6.904 -5.509 2.570 1.00 0.00 H ATOM 1003 HH12 ARG A 144 -5.408 -2.687 0.014 1.00 0.00 H ATOM 1004 HH11 ARG A 144 -7.124 -2.509 0.530 1.00 0.00 H ATOM 1005 HH22 ARG A 144 -4.173 -4.421 0.782 1.00 0.00 H ATOM 1006 HH21 ARG A 144 -4.877 -5.635 1.912 1.00 0.00 H ATOM 1007 H ARG A 144 -13.919 -4.787 2.396 1.00 0.00 H ATOM 1008 N ASN A 145 -11.788 -7.524 1.008 1.00 36.91 N ATOM 1009 CA ASN A 145 -11.832 -8.964 1.429 1.00 38.50 C ATOM 1010 C ASN A 145 -13.290 -9.423 1.541 1.00 42.58 C ATOM 1011 O ASN A 145 -13.603 -10.200 2.452 1.00 39.60 O ATOM 1012 CB ASN A 145 -11.208 -9.229 2.825 1.00 40.44 C ATOM 1013 CG ASN A 145 -9.792 -8.720 2.984 1.00 40.95 C ATOM 1014 OD1 ASN A 145 -8.955 -8.937 2.114 1.00 38.48 O ATOM 1015 ND2 ASN A 145 -9.501 -8.076 4.140 1.00 38.36 N ATOM 1016 HD22 ASN A 145 -10.246 -7.916 4.848 1.00 0.00 H ATOM 1017 HD21 ASN A 145 -8.533 -7.742 4.320 1.00 0.00 H ATOM 1018 H ASN A 145 -11.380 -7.282 0.083 1.00 0.00 H ATOM 1019 N GLU A 146 -14.166 -8.888 0.669 1.00 37.63 N ATOM 1020 CA GLU A 146 -15.603 -9.099 0.719 1.00 37.94 C ATOM 1021 C GLU A 146 -16.277 -8.706 2.063 1.00 39.59 C ATOM 1022 O GLU A 146 -17.363 -9.159 2.358 1.00 45.41 O ATOM 1023 CB GLU A 146 -15.943 -10.552 0.331 1.00 44.30 C ATOM 1024 CG GLU A 146 -15.750 -10.905 -1.151 1.00 47.04 C ATOM 1025 CD GLU A 146 -14.303 -11.192 -1.533 1.00 52.41 C ATOM 1026 OE1 GLU A 146 -13.560 -11.834 -0.758 1.00 59.79 O ATOM 1027 OE2 GLU A 146 -13.902 -10.791 -2.640 1.00 65.17 O ATOM 1028 H GLU A 146 -13.789 -8.284 -0.090 1.00 0.00 H ATOM 1029 N THR A 147 -15.671 -7.804 2.827 1.00 37.50 N ATOM 1030 CA THR A 147 -16.103 -7.501 4.159 1.00 34.82 C ATOM 1031 C THR A 147 -16.192 -6.020 4.323 1.00 32.81 C ATOM 1032 O THR A 147 -15.409 -5.298 3.741 1.00 27.67 O ATOM 1033 CB THR A 147 -15.137 -8.146 5.192 1.00 39.49 C ATOM 1034 OG1 THR A 147 -15.143 -9.553 4.981 1.00 34.22 O ATOM 1035 CG2 THR A 147 -15.573 -7.891 6.678 1.00 39.19 C ATOM 1036 HG1 THR A 147 -14.839 -9.749 4.059 1.00 0.00 H ATOM 1037 H THR A 147 -14.849 -7.297 2.442 1.00 0.00 H ATOM 1038 N ILE A 148 -17.135 -5.559 5.143 1.00 30.10 N ATOM 1039 CA ILE A 148 -17.222 -4.139 5.490 1.00 31.56 C ATOM 1040 C ILE A 148 -16.660 -4.054 6.936 1.00 37.66 C ATOM 1041 O ILE A 148 -17.164 -4.773 7.815 1.00 36.56 O ATOM 1042 CB ILE A 148 -18.685 -3.601 5.379 1.00 32.94 C ATOM 1043 CG1 ILE A 148 -19.274 -3.776 3.933 1.00 32.56 C ATOM 1044 CG2 ILE A 148 -18.761 -2.113 5.794 1.00 32.70 C ATOM 1045 CD1 ILE A 148 -20.719 -3.269 3.745 1.00 34.44 C ATOM 1046 H ILE A 148 -17.826 -6.223 5.546 1.00 0.00 H ATOM 1047 N TYR A 149 -15.623 -3.236 7.172 1.00 33.75 N ATOM 1048 CA TYR A 149 -15.059 -3.019 8.506 1.00 32.24 C ATOM 1049 C TYR A 149 -15.364 -1.633 8.902 1.00 35.22 C ATOM 1050 O TYR A 149 -15.510 -0.740 8.075 1.00 36.69 O ATOM 1051 CB TYR A 149 -13.557 -3.212 8.566 1.00 33.55 C ATOM 1052 CG TYR A 149 -13.051 -4.483 7.930 1.00 32.05 C ATOM 1053 CD1 TYR A 149 -12.941 -4.599 6.540 1.00 34.59 C ATOM 1054 CD2 TYR A 149 -12.662 -5.551 8.699 1.00 32.51 C ATOM 1055 CE1 TYR A 149 -12.474 -5.765 5.961 1.00 32.31 C ATOM 1056 CE2 TYR A 149 -12.188 -6.729 8.130 1.00 33.95 C ATOM 1057 CZ TYR A 149 -12.092 -6.824 6.778 1.00 36.87 C ATOM 1058 OH TYR A 149 -11.625 -7.956 6.258 1.00 37.06 O ATOM 1059 HH TYR A 149 -11.611 -7.883 5.271 1.00 0.00 H ATOM 1060 H TYR A 149 -15.199 -2.731 6.368 1.00 0.00 H ATOM 1061 N HIS A 150 -15.490 -1.436 10.191 1.00 36.94 N ATOM 1062 CA HIS A 150 -15.879 -0.134 10.701 1.00 37.10 C ATOM 1063 C HIS A 150 -15.087 0.266 11.969 1.00 40.57 C ATOM 1064 O HIS A 150 -14.842 -0.561 12.847 1.00 37.08 O ATOM 1065 CB HIS A 150 -17.370 -0.180 10.990 1.00 35.93 C ATOM 1066 CG HIS A 150 -17.895 1.083 11.559 1.00 34.42 C ATOM 1067 ND1 HIS A 150 -18.597 1.115 12.736 1.00 34.45 N ATOM 1068 CD2 HIS A 150 -17.786 2.371 11.145 1.00 33.19 C ATOM 1069 CE1 HIS A 150 -18.956 2.359 12.993 1.00 34.63 C ATOM 1070 NE2 HIS A 150 -18.455 3.143 12.060 1.00 36.07 N ATOM 1071 H HIS A 150 -15.310 -2.218 10.853 1.00 0.00 H ATOM 1072 N GLN A 151 -14.702 1.538 12.067 1.00 38.84 N ATOM 1073 CA GLN A 151 -14.135 2.049 13.309 1.00 36.87 C ATOM 1074 C GLN A 151 -14.507 3.492 13.457 1.00 34.34 C ATOM 1075 O GLN A 151 -14.650 4.162 12.453 1.00 35.26 O ATOM 1076 CB GLN A 151 -12.590 1.882 13.376 1.00 38.21 C ATOM 1077 CG GLN A 151 -12.095 1.833 14.830 1.00 37.31 C ATOM 1078 CD GLN A 151 -10.594 1.727 15.019 1.00 39.95 C ATOM 1079 OE1 GLN A 151 -9.808 2.083 14.155 1.00 37.87 O ATOM 1080 NE2 GLN A 151 -10.198 1.222 16.173 1.00 36.10 N ATOM 1081 HE22 GLN A 151 -10.901 0.931 16.882 1.00 0.00 H ATOM 1082 HE21 GLN A 151 -9.183 1.115 16.373 1.00 0.00 H ATOM 1083 H GLN A 151 -14.807 2.172 11.250 1.00 0.00 H ATOM 1084 N ALA A 152 -14.645 3.952 14.709 1.00 37.22 N ATOM 1085 CA ALA A 152 -14.911 5.352 15.022 1.00 37.69 C ATOM 1086 C ALA A 152 -13.933 5.896 16.050 1.00 41.06 C ATOM 1087 O ALA A 152 -13.330 5.143 16.803 1.00 42.20 O ATOM 1088 CB ALA A 152 -16.352 5.545 15.481 1.00 39.54 C ATOM 1089 H ALA A 152 -14.558 3.277 15.496 1.00 0.00 H ATOM 1090 N TYR A 153 -13.782 7.227 16.025 1.00 38.63 N ATOM 1091 CA TYR A 153 -12.789 7.956 16.780 1.00 40.83 C ATOM 1092 C TYR A 153 -13.408 9.248 17.269 1.00 40.81 C ATOM 1093 O TYR A 153 -14.364 9.784 16.661 1.00 33.22 O ATOM 1094 CB TYR A 153 -11.568 8.320 15.890 1.00 42.46 C ATOM 1095 CG TYR A 153 -11.048 7.183 15.031 1.00 38.46 C ATOM 1096 CD1 TYR A 153 -9.965 6.376 15.448 1.00 37.62 C ATOM 1097 CD2 TYR A 153 -11.636 6.919 13.780 1.00 36.37 C ATOM 1098 CE1 TYR A 153 -9.508 5.325 14.647 1.00 38.43 C ATOM 1099 CE2 TYR A 153 -11.200 5.853 12.988 1.00 38.83 C ATOM 1100 CZ TYR A 153 -10.147 5.067 13.403 1.00 37.71 C ATOM 1101 OH TYR A 153 -9.746 4.033 12.564 1.00 41.52 O ATOM 1102 HH TYR A 153 -8.987 3.550 12.977 1.00 0.00 H ATOM 1103 H TYR A 153 -14.426 7.775 15.419 1.00 0.00 H ATOM 1104 N LYS A 154 -12.856 9.757 18.357 1.00 40.54 N ATOM 1105 CA LYS A 154 -13.070 11.150 18.733 1.00 44.98 C ATOM 1106 C LYS A 154 -11.751 11.783 19.082 1.00 45.06 C ATOM 1107 O LYS A 154 -11.039 11.290 19.971 1.00 44.22 O ATOM 1108 CB LYS A 154 -13.961 11.273 19.961 1.00 42.21 C ATOM 1109 CG LYS A 154 -15.378 10.837 19.775 1.00 41.03 C ATOM 1110 CD LYS A 154 -16.047 10.957 21.134 1.00 43.44 C ATOM 1111 CE LYS A 154 -17.330 10.177 21.193 1.00 44.36 C ATOM 1112 NZ LYS A 154 -18.330 10.801 20.282 1.00 49.72 N ATOM 1113 HZ1 LYS A 154 -18.505 11.782 20.581 1.00 0.00 H ATOM 1114 HZ2 LYS A 154 -17.963 10.794 19.309 1.00 0.00 H ATOM 1115 HZ3 LYS A 154 -19.218 10.261 20.322 1.00 0.00 H ATOM 1116 H LYS A 154 -12.258 9.153 18.956 1.00 0.00 H ATOM 1117 N LYS A 155 -11.472 12.907 18.436 1.00 47.16 N ATOM 1118 CA LYS A 155 -10.179 13.590 18.540 1.00 45.38 C ATOM 1119 C LYS A 155 -9.023 12.607 18.320 1.00 43.65 C ATOM 1120 O LYS A 155 -8.038 12.612 19.047 1.00 46.02 O ATOM 1121 CB LYS A 155 -10.061 14.331 19.879 1.00 47.86 C ATOM 1122 CG LYS A 155 -11.179 15.343 20.094 1.00 50.44 C ATOM 1123 CD LYS A 155 -11.212 15.884 21.511 1.00 54.83 C ATOM 1124 CE LYS A 155 -12.433 16.774 21.702 1.00 56.04 C ATOM 1125 NZ LYS A 155 -12.249 17.653 22.891 1.00 57.15 N ATOM 1126 HZ1 LYS A 155 -12.120 17.065 23.739 1.00 0.00 H ATOM 1127 HZ2 LYS A 155 -11.410 18.251 22.752 1.00 0.00 H ATOM 1128 HZ3 LYS A 155 -13.089 18.254 23.009 1.00 0.00 H ATOM 1129 H LYS A 155 -12.205 13.324 17.827 1.00 0.00 H ATOM 1130 N GLY A 156 -9.152 11.756 17.309 1.00 45.11 N ATOM 1131 CA GLY A 156 -8.131 10.754 17.014 1.00 46.25 C ATOM 1132 C GLY A 156 -8.139 9.464 17.803 1.00 40.12 C ATOM 1133 O GLY A 156 -7.476 8.507 17.394 1.00 38.29 O ATOM 1134 H GLY A 156 -10.002 11.804 16.712 1.00 0.00 H ATOM 1135 N VAL A 157 -8.869 9.424 18.923 1.00 38.47 N ATOM 1136 CA VAL A 157 -8.851 8.297 19.817 1.00 35.75 C ATOM 1137 C VAL A 157 -9.902 7.262 19.406 1.00 41.42 C ATOM 1138 O VAL A 157 -11.088 7.586 19.385 1.00 40.29 O ATOM 1139 CB VAL A 157 -9.139 8.725 21.276 1.00 36.11 C ATOM 1140 CG1 VAL A 157 -9.079 7.516 22.202 1.00 33.58 C ATOM 1141 CG2 VAL A 157 -8.125 9.775 21.722 1.00 38.78 C ATOM 1142 H VAL A 157 -9.472 10.238 19.156 1.00 0.00 H ATOM 1143 N PRO A 158 -9.488 6.009 19.145 1.00 38.87 N ATOM 1144 CA PRO A 158 -10.485 4.992 18.802 1.00 40.14 C ATOM 1145 C PRO A 158 -11.498 4.800 19.915 1.00 41.74 C ATOM 1146 O PRO A 158 -11.117 4.751 21.085 1.00 40.14 O ATOM 1147 CB PRO A 158 -9.650 3.710 18.596 1.00 40.38 C ATOM 1148 CG PRO A 158 -8.243 4.185 18.472 1.00 39.98 C ATOM 1149 CD PRO A 158 -8.130 5.453 19.222 1.00 37.28 C ATOM 1150 N GLN A 159 -12.778 4.725 19.544 1.00 41.15 N ATOM 1151 CA GLN A 159 -13.864 4.469 20.478 1.00 37.66 C ATOM 1152 C GLN A 159 -14.125 2.970 20.661 1.00 41.85 C ATOM 1153 O GLN A 159 -14.815 2.584 21.585 1.00 39.14 O ATOM 1154 CB GLN A 159 -15.120 5.181 20.008 1.00 41.69 C ATOM 1155 CG GLN A 159 -14.987 6.696 19.861 1.00 42.74 C ATOM 1156 CD GLN A 159 -14.563 7.410 21.162 1.00 48.10 C ATOM 1157 OE1 GLN A 159 -15.368 7.577 22.078 1.00 45.04 O ATOM 1158 NE2 GLN A 159 -13.286 7.829 21.238 1.00 45.37 N ATOM 1159 HE22 GLN A 159 -12.638 7.668 20.441 1.00 0.00 H ATOM 1160 HE21 GLN A 159 -12.948 8.314 22.094 1.00 0.00 H ATOM 1161 H GLN A 159 -13.010 4.856 18.539 1.00 0.00 H ATOM 1162 N PHE A 160 -13.531 2.128 19.813 1.00 38.00 N ATOM 1163 CA PHE A 160 -13.717 0.673 19.877 1.00 40.97 C ATOM 1164 C PHE A 160 -12.749 0.060 18.875 1.00 41.18 C ATOM 1165 O PHE A 160 -12.209 0.806 18.030 1.00 36.73 O ATOM 1166 CB PHE A 160 -15.190 0.201 19.622 1.00 42.75 C ATOM 1167 CG PHE A 160 -15.891 0.810 18.400 1.00 46.87 C ATOM 1168 CD1 PHE A 160 -15.794 0.209 17.140 1.00 47.84 C ATOM 1169 CD2 PHE A 160 -16.744 1.926 18.535 1.00 45.60 C ATOM 1170 CE1 PHE A 160 -16.483 0.736 16.031 1.00 46.93 C ATOM 1171 CE2 PHE A 160 -17.421 2.454 17.432 1.00 47.55 C ATOM 1172 CZ PHE A 160 -17.281 1.862 16.177 1.00 43.50 C ATOM 1173 H PHE A 160 -12.910 2.519 19.076 1.00 0.00 H ATOM 1174 N ASP A 161 -12.549 -1.259 18.959 1.00 36.18 N ATOM 1175 CA ASP A 161 -11.670 -1.972 18.035 1.00 39.14 C ATOM 1176 C ASP A 161 -12.347 -2.029 16.673 1.00 40.87 C ATOM 1177 O ASP A 161 -13.576 -2.050 16.566 1.00 41.35 O ATOM 1178 CB ASP A 161 -11.370 -3.404 18.487 1.00 38.18 C ATOM 1179 CG ASP A 161 -10.408 -3.480 19.715 1.00 45.16 C ATOM 1180 OD1 ASP A 161 -9.655 -2.545 20.037 1.00 40.20 O ATOM 1181 OD2 ASP A 161 -10.381 -4.536 20.344 1.00 52.49 O ATOM 1182 H ASP A 161 -13.035 -1.795 19.706 1.00 0.00 H ATOM 1183 N LEU A 162 -11.541 -2.049 15.623 1.00 40.87 N ATOM 1184 CA LEU A 162 -12.075 -2.216 14.248 1.00 42.92 C ATOM 1185 C LEU A 162 -12.985 -3.422 14.287 1.00 43.95 C ATOM 1186 O LEU A 162 -12.579 -4.436 14.813 1.00 45.95 O ATOM 1187 CB LEU A 162 -10.936 -2.476 13.258 1.00 40.53 C ATOM 1188 CG LEU A 162 -11.302 -2.598 11.782 1.00 38.02 C ATOM 1189 CD1 LEU A 162 -11.672 -1.255 11.147 1.00 40.69 C ATOM 1190 CD2 LEU A 162 -10.147 -3.253 11.042 1.00 39.18 C ATOM 1191 H LEU A 162 -10.516 -1.946 15.764 1.00 0.00 H ATOM 1192 N LYS A 163 -14.180 -3.316 13.707 1.00 40.01 N ATOM 1193 CA LYS A 163 -15.216 -4.355 13.798 1.00 41.27 C ATOM 1194 C LYS A 163 -15.715 -4.733 12.390 1.00 38.43 C ATOM 1195 O LYS A 163 -16.045 -3.836 11.601 1.00 36.39 O ATOM 1196 CB LYS A 163 -16.359 -3.738 14.604 1.00 42.32 C ATOM 1197 CG LYS A 163 -17.502 -4.638 14.987 1.00 48.63 C ATOM 1198 CD LYS A 163 -18.694 -3.843 15.531 1.00 52.44 C ATOM 1199 CE LYS A 163 -19.893 -4.726 15.920 1.00 54.30 C ATOM 1200 NZ LYS A 163 -19.552 -5.662 17.050 1.00 56.12 N ATOM 1201 HZ1 LYS A 163 -18.768 -6.282 16.761 1.00 0.00 H ATOM 1202 HZ2 LYS A 163 -19.268 -5.108 17.883 1.00 0.00 H ATOM 1203 HZ3 LYS A 163 -20.385 -6.240 17.283 1.00 0.00 H ATOM 1204 H LYS A 163 -14.390 -2.455 13.163 1.00 0.00 H ATOM 1205 N GLU A 164 -15.794 -6.024 12.063 1.00 39.55 N ATOM 1206 CA GLU A 164 -16.552 -6.438 10.865 1.00 41.69 C ATOM 1207 C GLU A 164 -18.094 -6.222 11.067 1.00 42.79 C ATOM 1208 O GLU A 164 -18.671 -6.677 12.084 1.00 40.01 O ATOM 1209 CB GLU A 164 -16.284 -7.898 10.507 1.00 46.95 C ATOM 1210 CG GLU A 164 -14.836 -8.335 10.378 1.00 44.35 C ATOM 1211 CD GLU A 164 -14.723 -9.796 9.970 1.00 47.47 C ATOM 1212 OE1 GLU A 164 -15.722 -10.515 9.942 1.00 47.70 O ATOM 1213 OE2 GLU A 164 -13.624 -10.250 9.634 1.00 59.01 O ATOM 1214 H GLU A 164 -15.322 -6.739 12.652 1.00 0.00 H ATOM 1215 N VAL A 165 -18.741 -5.484 10.143 1.00 39.23 N ATOM 1216 CA VAL A 165 -20.166 -5.104 10.258 1.00 34.66 C ATOM 1217 C VAL A 165 -21.047 -5.563 9.086 1.00 35.62 C ATOM 1218 O VAL A 165 -22.300 -5.472 9.155 1.00 36.03 O ATOM 1219 CB VAL A 165 -20.335 -3.562 10.517 1.00 40.25 C ATOM 1220 CG1 VAL A 165 -19.618 -3.135 11.795 1.00 36.79 C ATOM 1221 CG2 VAL A 165 -19.876 -2.689 9.340 1.00 39.89 C ATOM 1222 H VAL A 165 -18.211 -5.166 9.307 1.00 0.00 H ATOM 1223 N GLY A 166 -20.450 -6.094 8.030 1.00 30.25 N ATOM 1224 CA GLY A 166 -21.226 -6.455 6.890 1.00 31.15 C ATOM 1225 C GLY A 166 -20.396 -7.115 5.826 1.00 32.88 C ATOM 1226 O GLY A 166 -19.204 -7.346 6.001 1.00 31.31 O ATOM 1227 H GLY A 166 -19.421 -6.247 8.032 1.00 0.00 H ATOM 1228 N THR A 167 -21.050 -7.448 4.716 1.00 36.07 N ATOM 1229 CA THR A 167 -20.380 -8.042 3.552 1.00 37.08 C ATOM 1230 C THR A 167 -20.575 -7.144 2.356 1.00 37.76 C ATOM 1231 O THR A 167 -21.544 -6.397 2.316 1.00 34.87 O ATOM 1232 CB THR A 167 -20.953 -9.437 3.220 1.00 34.80 C ATOM 1233 OG1 THR A 167 -22.350 -9.302 2.956 1.00 37.93 O ATOM 1234 CG2 THR A 167 -20.752 -10.385 4.396 1.00 37.01 C ATOM 1235 HG1 THR A 167 -22.731 -10.190 2.741 1.00 0.00 H ATOM 1236 H THR A 167 -22.076 -7.281 4.671 1.00 0.00 H ATOM 1237 N THR A 168 -19.685 -7.301 1.359 1.00 38.15 N ATOM 1238 CA THR A 168 -19.689 -6.507 0.157 1.00 36.66 C ATOM 1239 C THR A 168 -19.021 -7.235 -1.042 1.00 37.19 C ATOM 1240 O THR A 168 -18.191 -8.120 -0.902 1.00 41.43 O ATOM 1241 CB THR A 168 -19.031 -5.150 0.441 1.00 35.71 C ATOM 1242 OG1 THR A 168 -19.043 -4.325 -0.720 1.00 34.71 O ATOM 1243 CG2 THR A 168 -17.551 -5.300 0.949 1.00 36.05 C ATOM 1244 HG1 THR A 168 -18.614 -3.457 -0.511 1.00 0.00 H ATOM 1245 H THR A 168 -18.955 -8.035 1.462 1.00 0.00 H ATOM 1246 N ASP A 169 -19.429 -6.836 -2.230 1.00 41.92 N ATOM 1247 CA ASP A 169 -18.800 -7.251 -3.474 1.00 40.19 C ATOM 1248 C ASP A 169 -18.105 -6.057 -4.139 1.00 40.99 C ATOM 1249 O ASP A 169 -17.684 -6.169 -5.277 1.00 42.25 O ATOM 1250 CB ASP A 169 -19.842 -7.883 -4.413 1.00 44.05 C ATOM 1251 CG ASP A 169 -20.846 -6.885 -4.954 1.00 46.33 C ATOM 1252 OD1 ASP A 169 -21.058 -5.818 -4.361 1.00 52.05 O ATOM 1253 OD2 ASP A 169 -21.443 -7.173 -5.993 1.00 54.82 O ATOM 1254 H ASP A 169 -20.243 -6.191 -2.281 1.00 0.00 H ATOM 1255 N LYS A 170 -18.012 -4.935 -3.423 1.00 41.52 N ATOM 1256 CA LYS A 170 -17.183 -3.777 -3.800 1.00 44.35 C ATOM 1257 C LYS A 170 -15.977 -3.636 -2.894 1.00 41.76 C ATOM 1258 O LYS A 170 -15.908 -4.221 -1.818 1.00 39.62 O ATOM 1259 CB LYS A 170 -17.996 -2.479 -3.730 1.00 48.64 C ATOM 1260 CG LYS A 170 -19.048 -2.432 -4.830 1.00 59.17 C ATOM 1261 CD LYS A 170 -19.204 -1.029 -5.415 1.00 67.08 C ATOM 1262 CE LYS A 170 -19.826 -1.064 -6.801 1.00 65.14 C ATOM 1263 NZ LYS A 170 -21.012 -1.968 -6.817 1.00 64.10 N ATOM 1264 HZ1 LYS A 170 -20.717 -2.930 -6.554 1.00 0.00 H ATOM 1265 HZ2 LYS A 170 -21.719 -1.623 -6.137 1.00 0.00 H ATOM 1266 HZ3 LYS A 170 -21.424 -1.980 -7.772 1.00 0.00 H ATOM 1267 H LYS A 170 -18.560 -4.874 -2.541 1.00 0.00 H ATOM 1268 N THR A 171 -15.022 -2.837 -3.344 1.00 39.82 N ATOM 1269 CA THR A 171 -13.931 -2.405 -2.504 1.00 39.24 C ATOM 1270 C THR A 171 -13.899 -0.913 -2.476 1.00 35.09 C ATOM 1271 O THR A 171 -14.329 -0.269 -3.420 1.00 34.30 O ATOM 1272 CB THR A 171 -12.580 -2.911 -3.022 1.00 41.19 C ATOM 1273 OG1 THR A 171 -12.443 -2.514 -4.403 1.00 40.44 O ATOM 1274 CG2 THR A 171 -12.507 -4.466 -2.814 1.00 38.97 C ATOM 1275 HG1 THR A 171 -12.482 -1.527 -4.467 1.00 0.00 H ATOM 1276 H THR A 171 -15.059 -2.511 -4.331 1.00 0.00 H ATOM 1277 N GLY A 172 -13.365 -0.376 -1.398 1.00 31.91 N ATOM 1278 CA GLY A 172 -13.078 1.053 -1.288 1.00 31.86 C ATOM 1279 C GLY A 172 -13.124 1.581 0.114 1.00 33.40 C ATOM 1280 O GLY A 172 -13.128 0.809 1.075 1.00 29.88 O ATOM 1281 H GLY A 172 -13.138 -0.994 -0.593 1.00 0.00 H ATOM 1282 N THR A 173 -13.153 2.906 0.233 1.00 36.21 N ATOM 1283 CA THR A 173 -13.034 3.554 1.538 1.00 34.87 C ATOM 1284 C THR A 173 -13.987 4.681 1.679 1.00 35.92 C ATOM 1285 O THR A 173 -14.163 5.531 0.732 1.00 30.31 O ATOM 1286 CB THR A 173 -11.592 4.000 1.801 1.00 32.28 C ATOM 1287 OG1 THR A 173 -10.764 2.827 1.740 1.00 30.05 O ATOM 1288 CG2 THR A 173 -11.439 4.698 3.209 1.00 30.53 C ATOM 1289 HG1 THR A 173 -10.843 2.415 0.843 1.00 0.00 H ATOM 1290 H THR A 173 -13.262 3.492 -0.619 1.00 0.00 H ATOM 1291 N VAL A 174 -14.630 4.692 2.852 1.00 31.09 N ATOM 1292 CA VAL A 174 -15.520 5.785 3.194 1.00 32.63 C ATOM 1293 C VAL A 174 -14.972 6.415 4.467 1.00 34.79 C ATOM 1294 O VAL A 174 -14.721 5.740 5.434 1.00 33.22 O ATOM 1295 CB VAL A 174 -17.010 5.363 3.448 1.00 31.54 C ATOM 1296 CG1 VAL A 174 -17.843 6.593 3.801 1.00 31.18 C ATOM 1297 CG2 VAL A 174 -17.619 4.589 2.289 1.00 33.23 C ATOM 1298 H VAL A 174 -14.491 3.911 3.524 1.00 0.00 H ATOM 1299 N ILE A 175 -14.822 7.734 4.466 1.00 39.17 N ATOM 1300 CA ILE A 175 -14.467 8.485 5.693 1.00 40.85 C ATOM 1301 C ILE A 175 -15.549 9.556 5.857 1.00 37.62 C ATOM 1302 O ILE A 175 -15.769 10.348 4.929 1.00 34.95 O ATOM 1303 CB ILE A 175 -13.110 9.208 5.571 1.00 39.62 C ATOM 1304 CG1 ILE A 175 -11.942 8.239 5.330 1.00 41.64 C ATOM 1305 CG2 ILE A 175 -12.843 10.095 6.809 1.00 42.88 C ATOM 1306 CD1 ILE A 175 -11.466 7.480 6.539 1.00 47.46 C ATOM 1307 H ILE A 175 -14.958 8.256 3.577 1.00 0.00 H ATOM 1308 N ARG A 176 -16.202 9.593 7.018 1.00 39.57 N ATOM 1309 CA ARG A 176 -17.025 10.743 7.414 1.00 38.01 C ATOM 1310 C ARG A 176 -16.532 11.357 8.695 1.00 36.19 C ATOM 1311 O ARG A 176 -16.160 10.676 9.602 1.00 33.91 O ATOM 1312 CB ARG A 176 -18.558 10.464 7.457 1.00 42.07 C ATOM 1313 CG ARG A 176 -19.018 9.082 7.849 1.00 40.34 C ATOM 1314 CD ARG A 176 -20.531 8.853 7.621 1.00 42.79 C ATOM 1315 NE ARG A 176 -21.443 9.993 7.812 1.00 43.40 N ATOM 1316 CZ ARG A 176 -21.940 10.429 8.980 1.00 50.12 C ATOM 1317 NH1 ARG A 176 -22.790 11.457 8.996 1.00 51.90 N ATOM 1318 NH2 ARG A 176 -21.587 9.887 10.144 1.00 47.67 N ATOM 1319 HE ARG A 176 -21.730 10.512 6.958 1.00 0.00 H ATOM 1320 HH12 ARG A 176 -23.177 11.798 9.899 1.00 0.00 H ATOM 1321 HH11 ARG A 176 -23.066 11.918 8.105 1.00 0.00 H ATOM 1322 HH22 ARG A 176 -21.992 10.250 11.031 1.00 0.00 H ATOM 1323 HH21 ARG A 176 -20.906 9.101 10.166 1.00 0.00 H ATOM 1324 H ARG A 176 -16.126 8.782 7.664 1.00 0.00 H ATOM 1325 N PHE A 177 -16.527 12.671 8.745 1.00 38.39 N ATOM 1326 CA PHE A 177 -15.969 13.370 9.884 1.00 40.34 C ATOM 1327 C PHE A 177 -16.652 14.718 10.095 1.00 38.16 C ATOM 1328 O PHE A 177 -17.120 15.390 9.142 1.00 33.38 O ATOM 1329 CB PHE A 177 -14.474 13.595 9.716 1.00 33.82 C ATOM 1330 CG PHE A 177 -14.131 14.607 8.647 1.00 34.92 C ATOM 1331 CD1 PHE A 177 -13.978 15.961 8.952 1.00 37.28 C ATOM 1332 CD2 PHE A 177 -13.938 14.198 7.326 1.00 37.93 C ATOM 1333 CE1 PHE A 177 -13.681 16.882 7.937 1.00 37.34 C ATOM 1334 CE2 PHE A 177 -13.621 15.108 6.333 1.00 35.77 C ATOM 1335 CZ PHE A 177 -13.493 16.440 6.639 1.00 36.93 C ATOM 1336 H PHE A 177 -16.929 13.216 7.956 1.00 0.00 H ATOM 1337 N LYS A 178 -16.661 15.094 11.380 1.00 36.75 N ATOM 1338 CA LYS A 178 -17.200 16.346 11.853 1.00 35.36 C ATOM 1339 C LYS A 178 -16.061 17.203 12.465 1.00 34.95 C ATOM 1340 O LYS A 178 -15.503 16.855 13.535 1.00 32.00 O ATOM 1341 CB LYS A 178 -18.305 16.040 12.869 1.00 36.81 C ATOM 1342 CG LYS A 178 -18.947 17.318 13.368 1.00 42.44 C ATOM 1343 CD LYS A 178 -20.437 17.147 13.559 1.00 48.30 C ATOM 1344 CE LYS A 178 -21.043 18.375 14.249 1.00 49.23 C ATOM 1345 NZ LYS A 178 -20.943 19.558 13.348 1.00 45.47 N ATOM 1346 HZ1 LYS A 178 -19.943 19.743 13.130 1.00 0.00 H ATOM 1347 HZ2 LYS A 178 -21.461 19.366 12.467 1.00 0.00 H ATOM 1348 HZ3 LYS A 178 -21.355 20.388 13.820 1.00 0.00 H ATOM 1349 H LYS A 178 -16.254 14.443 12.081 1.00 0.00 H ATOM 1350 N ALA A 179 -15.711 18.308 11.778 1.00 32.20 N ATOM 1351 CA ALA A 179 -14.663 19.208 12.202 1.00 34.52 C ATOM 1352 C ALA A 179 -14.857 19.593 13.660 1.00 37.26 C ATOM 1353 O ALA A 179 -15.986 19.739 14.120 1.00 36.07 O ATOM 1354 CB ALA A 179 -14.596 20.471 11.334 1.00 34.83 C ATOM 1355 H ALA A 179 -16.221 18.524 10.898 1.00 0.00 H ATOM 1356 N ASP A 180 -13.755 19.694 14.405 1.00 39.59 N ATOM 1357 CA ASP A 180 -13.841 20.061 15.863 1.00 39.21 C ATOM 1358 C ASP A 180 -14.094 21.562 16.023 1.00 37.14 C ATOM 1359 O ASP A 180 -13.237 22.361 15.662 1.00 36.80 O ATOM 1360 CB ASP A 180 -12.568 19.650 16.651 1.00 40.11 C ATOM 1361 CG ASP A 180 -12.800 19.666 18.204 1.00 43.96 C ATOM 1362 OD1 ASP A 180 -13.782 20.330 18.690 1.00 42.55 O ATOM 1363 OD2 ASP A 180 -12.009 18.996 18.912 1.00 44.76 O ATOM 1364 H ASP A 180 -12.825 19.517 13.974 1.00 0.00 H ATOM 1365 N GLY A 181 -15.257 21.938 16.570 1.00 38.00 N ATOM 1366 CA GLY A 181 -15.602 23.368 16.840 1.00 38.59 C ATOM 1367 C GLY A 181 -14.618 24.062 17.782 1.00 42.56 C ATOM 1368 O GLY A 181 -14.343 25.267 17.612 1.00 43.11 O ATOM 1369 H GLY A 181 -15.951 21.204 16.818 1.00 0.00 H ATOM 1370 N GLU A 182 -14.057 23.268 18.720 1.00 47.23 N ATOM 1371 CA GLU A 182 -12.982 23.684 19.681 1.00 47.41 C ATOM 1372 C GLU A 182 -11.649 24.123 19.040 1.00 45.15 C ATOM 1373 O GLU A 182 -10.923 24.945 19.621 1.00 47.74 O ATOM 1374 CB GLU A 182 -12.713 22.588 20.714 1.00 48.23 C ATOM 1375 CG GLU A 182 -13.956 22.221 21.543 1.00 58.79 C ATOM 1376 CD GLU A 182 -13.745 21.102 22.588 1.00 64.91 C ATOM 1377 OE1 GLU A 182 -14.556 21.029 23.537 1.00 62.65 O ATOM 1378 OE2 GLU A 182 -12.797 20.281 22.477 1.00 61.80 O ATOM 1379 H GLU A 182 -14.398 22.287 18.781 1.00 0.00 H ATOM 1380 N ILE A 183 -11.332 23.570 17.866 1.00 41.07 N ATOM 1381 CA ILE A 183 -10.194 24.001 17.010 1.00 38.55 C ATOM 1382 C ILE A 183 -10.634 25.105 16.005 1.00 39.84 C ATOM 1383 O ILE A 183 -10.029 26.154 15.931 1.00 40.42 O ATOM 1384 CB ILE A 183 -9.620 22.769 16.250 1.00 37.63 C ATOM 1385 CG1 ILE A 183 -9.253 21.632 17.231 1.00 38.17 C ATOM 1386 CG2 ILE A 183 -8.446 23.162 15.355 1.00 42.20 C ATOM 1387 CD1 ILE A 183 -7.922 21.777 17.955 1.00 38.18 C ATOM 1388 H ILE A 183 -11.922 22.783 17.527 1.00 0.00 H ATOM 1389 N PHE A 184 -11.701 24.836 15.231 1.00 43.84 N ATOM 1390 CA PHE A 184 -12.192 25.729 14.183 1.00 41.52 C ATOM 1391 C PHE A 184 -13.236 26.688 14.760 1.00 42.05 C ATOM 1392 O PHE A 184 -14.457 26.517 14.603 1.00 36.03 O ATOM 1393 CB PHE A 184 -12.745 24.887 13.016 1.00 41.76 C ATOM 1394 CG PHE A 184 -11.718 23.996 12.395 1.00 40.63 C ATOM 1395 CD1 PHE A 184 -11.599 22.656 12.780 1.00 38.01 C ATOM 1396 CD2 PHE A 184 -10.808 24.512 11.480 1.00 41.99 C ATOM 1397 CE1 PHE A 184 -10.609 21.833 12.225 1.00 38.38 C ATOM 1398 CE2 PHE A 184 -9.801 23.697 10.924 1.00 40.14 C ATOM 1399 CZ PHE A 184 -9.729 22.345 11.292 1.00 39.39 C ATOM 1400 H PHE A 184 -12.206 23.940 15.387 1.00 0.00 H ATOM 1401 N THR A 185 -12.725 27.725 15.418 1.00 43.00 N ATOM 1402 CA THR A 185 -13.564 28.653 16.204 1.00 45.00 C ATOM 1403 C THR A 185 -14.254 29.756 15.418 1.00 42.87 C ATOM 1404 O THR A 185 -15.193 30.324 15.912 1.00 41.52 O ATOM 1405 CB THR A 185 -12.731 29.315 17.310 1.00 45.96 C ATOM 1406 OG1 THR A 185 -11.619 29.985 16.705 1.00 47.89 O ATOM 1407 CG2 THR A 185 -12.262 28.274 18.291 1.00 45.55 C ATOM 1408 HG1 THR A 185 -11.073 30.417 17.409 1.00 0.00 H ATOM 1409 H THR A 185 -11.699 27.888 15.378 1.00 0.00 H ATOM 1410 N GLU A 186 -13.793 30.059 14.210 1.00 39.40 N ATOM 1411 CA GLU A 186 -14.465 31.028 13.344 1.00 48.11 C ATOM 1412 C GLU A 186 -15.710 30.465 12.690 1.00 46.14 C ATOM 1413 O GLU A 186 -16.799 30.988 12.889 1.00 38.13 O ATOM 1414 CB GLU A 186 -13.504 31.619 12.265 1.00 51.09 C ATOM 1415 CG GLU A 186 -12.546 32.670 12.843 1.00 58.66 C ATOM 1416 CD GLU A 186 -13.274 33.689 13.741 1.00 64.77 C ATOM 1417 OE1 GLU A 186 -12.824 33.952 14.877 1.00 68.48 O ATOM 1418 OE2 GLU A 186 -14.340 34.196 13.337 1.00 61.11 O ATOM 1419 H GLU A 186 -12.928 29.593 13.869 1.00 0.00 H ATOM 1420 N THR A 187 -15.539 29.420 11.874 1.00 43.88 N ATOM 1421 CA THR A 187 -16.685 28.725 11.286 1.00 42.39 C ATOM 1422 C THR A 187 -16.462 27.210 11.147 1.00 40.55 C ATOM 1423 O THR A 187 -15.321 26.751 11.014 1.00 38.95 O ATOM 1424 CB THR A 187 -17.120 29.380 9.946 1.00 40.92 C ATOM 1425 OG1 THR A 187 -18.281 28.691 9.435 1.00 38.39 O ATOM 1426 CG2 THR A 187 -15.956 29.425 8.893 1.00 39.32 C ATOM 1427 HG1 THR A 187 -19.018 28.757 10.092 1.00 0.00 H ATOM 1428 H THR A 187 -14.576 29.096 11.653 1.00 0.00 H ATOM 1429 N THR A 188 -17.547 26.443 11.254 1.00 41.89 N ATOM 1430 CA THR A 188 -17.544 25.000 10.875 1.00 41.61 C ATOM 1431 C THR A 188 -18.575 24.724 9.737 1.00 41.08 C ATOM 1432 O THR A 188 -19.057 23.585 9.558 1.00 40.64 O ATOM 1433 CB THR A 188 -17.774 24.089 12.098 1.00 40.98 C ATOM 1434 OG1 THR A 188 -19.037 24.374 12.641 1.00 36.71 O ATOM 1435 CG2 THR A 188 -16.710 24.314 13.195 1.00 43.94 C ATOM 1436 HG1 THR A 188 -19.734 24.204 11.959 1.00 0.00 H ATOM 1437 H THR A 188 -18.426 26.865 11.614 1.00 0.00 H ATOM 1438 N VAL A 189 -18.851 25.767 8.944 1.00 37.10 N ATOM 1439 CA VAL A 189 -19.815 25.695 7.831 1.00 37.60 C ATOM 1440 C VAL A 189 -19.043 25.748 6.518 1.00 36.40 C ATOM 1441 O VAL A 189 -18.361 26.727 6.235 1.00 36.08 O ATOM 1442 CB VAL A 189 -20.811 26.867 7.864 1.00 38.11 C ATOM 1443 CG1 VAL A 189 -21.637 26.969 6.554 1.00 41.11 C ATOM 1444 CG2 VAL A 189 -21.721 26.751 9.109 1.00 36.51 C ATOM 1445 H VAL A 189 -18.363 26.668 9.121 1.00 0.00 H ATOM 1446 N TYR A 190 -19.173 24.699 5.714 1.00 37.55 N ATOM 1447 CA TYR A 190 -18.526 24.646 4.407 1.00 35.08 C ATOM 1448 C TYR A 190 -19.279 25.482 3.374 1.00 37.34 C ATOM 1449 O TYR A 190 -20.472 25.785 3.509 1.00 41.29 O ATOM 1450 CB TYR A 190 -18.401 23.194 3.932 1.00 32.84 C ATOM 1451 CG TYR A 190 -17.527 22.328 4.815 1.00 30.52 C ATOM 1452 CD1 TYR A 190 -18.082 21.634 5.882 1.00 29.89 C ATOM 1453 CD2 TYR A 190 -16.161 22.217 4.600 1.00 28.23 C ATOM 1454 CE1 TYR A 190 -17.317 20.854 6.694 1.00 34.77 C ATOM 1455 CE2 TYR A 190 -15.377 21.408 5.419 1.00 32.40 C ATOM 1456 CZ TYR A 190 -15.966 20.733 6.472 1.00 30.66 C ATOM 1457 OH TYR A 190 -15.266 19.951 7.350 1.00 32.63 O ATOM 1458 HH TYR A 190 -15.888 19.569 8.018 1.00 0.00 H ATOM 1459 H TYR A 190 -19.752 23.893 6.024 1.00 0.00 H ATOM 1460 N ASN A 191 -18.545 25.795 2.319 1.00 37.37 N ATOM 1461 CA ASN A 191 -18.940 26.665 1.249 1.00 38.91 C ATOM 1462 C ASN A 191 -18.923 25.827 -0.045 1.00 38.64 C ATOM 1463 O ASN A 191 -17.839 25.364 -0.489 1.00 38.39 O ATOM 1464 CB ASN A 191 -17.949 27.823 1.160 1.00 38.81 C ATOM 1465 CG ASN A 191 -18.277 28.814 0.035 1.00 41.70 C ATOM 1466 OD1 ASN A 191 -18.545 28.472 -1.123 1.00 40.98 O ATOM 1467 ND2 ASN A 191 -18.222 30.061 0.386 1.00 48.03 N ATOM 1468 HD22 ASN A 191 -17.994 30.315 1.368 1.00 0.00 H ATOM 1469 HD21 ASN A 191 -18.406 30.807 -0.315 1.00 0.00 H ATOM 1470 H ASN A 191 -17.597 25.372 2.260 1.00 0.00 H ATOM 1471 N TYR A 192 -20.112 25.613 -0.609 1.00 37.71 N ATOM 1472 CA TYR A 192 -20.311 24.732 -1.775 1.00 40.50 C ATOM 1473 C TYR A 192 -19.426 25.173 -2.928 1.00 39.19 C ATOM 1474 O TYR A 192 -18.705 24.335 -3.513 1.00 37.81 O ATOM 1475 CB TYR A 192 -21.818 24.691 -2.207 1.00 39.98 C ATOM 1476 CG TYR A 192 -22.117 23.678 -3.277 1.00 37.77 C ATOM 1477 CD1 TYR A 192 -22.010 23.997 -4.631 1.00 40.20 C ATOM 1478 CD2 TYR A 192 -22.430 22.365 -2.956 1.00 40.56 C ATOM 1479 CE1 TYR A 192 -22.280 23.041 -5.628 1.00 36.60 C ATOM 1480 CE2 TYR A 192 -22.687 21.402 -3.956 1.00 40.43 C ATOM 1481 CZ TYR A 192 -22.610 21.757 -5.292 1.00 40.50 C ATOM 1482 OH TYR A 192 -22.834 20.828 -6.308 1.00 38.53 O ATOM 1483 HH TYR A 192 -22.734 21.272 -7.187 1.00 0.00 H ATOM 1484 H TYR A 192 -20.942 26.092 -0.206 1.00 0.00 H ATOM 1485 N GLU A 193 -19.430 26.474 -3.254 1.00 37.56 N ATOM 1486 CA GLU A 193 -18.598 26.970 -4.412 1.00 37.13 C ATOM 1487 C GLU A 193 -17.075 26.790 -4.164 1.00 35.46 C ATOM 1488 O GLU A 193 -16.327 26.419 -5.069 1.00 35.42 O ATOM 1489 CB GLU A 193 -18.922 28.453 -4.765 1.00 41.76 C ATOM 1490 CG GLU A 193 -20.279 28.678 -5.469 1.00 48.01 C ATOM 1491 CD GLU A 193 -21.506 28.465 -4.570 1.00 51.45 C ATOM 1492 OE1 GLU A 193 -21.444 28.711 -3.334 1.00 63.88 O ATOM 1493 OE2 GLU A 193 -22.541 28.018 -5.078 1.00 55.00 O ATOM 1494 H GLU A 193 -20.008 27.143 -2.707 1.00 0.00 H ATOM 1495 N THR A 194 -16.623 27.036 -2.932 1.00 36.35 N ATOM 1496 CA THR A 194 -15.223 26.727 -2.524 1.00 35.16 C ATOM 1497 C THR A 194 -14.891 25.262 -2.813 1.00 32.21 C ATOM 1498 O THR A 194 -13.938 24.974 -3.530 1.00 29.32 O ATOM 1499 CB THR A 194 -14.903 27.073 -1.037 1.00 34.57 C ATOM 1500 OG1 THR A 194 -15.057 28.473 -0.827 1.00 37.77 O ATOM 1501 CG2 THR A 194 -13.461 26.723 -0.673 1.00 34.79 C ATOM 1502 HG1 THR A 194 -14.853 28.688 0.118 1.00 0.00 H ATOM 1503 H THR A 194 -17.269 27.457 -2.234 1.00 0.00 H ATOM 1504 N LEU A 195 -15.726 24.348 -2.337 1.00 32.38 N ATOM 1505 CA LEU A 195 -15.570 22.926 -2.692 1.00 31.00 C ATOM 1506 C LEU A 195 -15.663 22.582 -4.190 1.00 30.73 C ATOM 1507 O LEU A 195 -14.840 21.863 -4.719 1.00 30.74 O ATOM 1508 CB LEU A 195 -16.565 22.098 -1.922 1.00 31.62 C ATOM 1509 CG LEU A 195 -16.284 22.078 -0.403 1.00 30.48 C ATOM 1510 CD1 LEU A 195 -17.358 21.269 0.257 1.00 32.48 C ATOM 1511 CD2 LEU A 195 -14.932 21.482 -0.039 1.00 31.50 C ATOM 1512 H LEU A 195 -16.500 24.638 -1.706 1.00 0.00 H ATOM 1513 N GLN A 196 -16.654 23.144 -4.847 1.00 33.83 N ATOM 1514 CA GLN A 196 -16.901 22.876 -6.240 1.00 36.50 C ATOM 1515 C GLN A 196 -15.756 23.296 -7.148 1.00 35.89 C ATOM 1516 O GLN A 196 -15.370 22.504 -8.031 1.00 36.16 O ATOM 1517 CB GLN A 196 -18.204 23.537 -6.662 1.00 41.61 C ATOM 1518 CG GLN A 196 -18.591 23.425 -8.130 1.00 45.21 C ATOM 1519 CD GLN A 196 -19.756 24.327 -8.429 1.00 51.58 C ATOM 1520 OE1 GLN A 196 -20.783 23.869 -8.888 1.00 56.85 O ATOM 1521 NE2 GLN A 196 -19.618 25.625 -8.111 1.00 57.97 N ATOM 1522 HE22 GLN A 196 -18.719 25.972 -7.720 1.00 0.00 H ATOM 1523 HE21 GLN A 196 -20.410 26.283 -8.256 1.00 0.00 H ATOM 1524 H GLN A 196 -17.280 23.804 -4.344 1.00 0.00 H ATOM 1525 N GLN A 197 -15.255 24.526 -6.977 1.00 36.02 N ATOM 1526 CA GLN A 197 -14.127 25.067 -7.776 1.00 36.84 C ATOM 1527 C GLN A 197 -12.897 24.171 -7.663 1.00 34.12 C ATOM 1528 O GLN A 197 -12.187 23.884 -8.623 1.00 35.62 O ATOM 1529 CB GLN A 197 -13.782 26.491 -7.270 1.00 37.17 C ATOM 1530 CG GLN A 197 -12.457 27.085 -7.738 1.00 38.54 C ATOM 1531 CD GLN A 197 -12.285 28.505 -7.223 1.00 42.90 C ATOM 1532 OE1 GLN A 197 -13.202 29.069 -6.626 1.00 45.81 O ATOM 1533 NE2 GLN A 197 -11.112 29.085 -7.445 1.00 45.13 N ATOM 1534 HE22 GLN A 197 -10.365 28.570 -7.954 1.00 0.00 H ATOM 1535 HE21 GLN A 197 -10.939 30.054 -7.110 1.00 0.00 H ATOM 1536 H GLN A 197 -15.678 25.134 -6.247 1.00 0.00 H ATOM 1537 N ARG A 198 -12.591 23.760 -6.437 1.00 34.02 N ATOM 1538 CA ARG A 198 -11.414 22.904 -6.258 1.00 36.23 C ATOM 1539 C ARG A 198 -11.628 21.466 -6.750 1.00 34.37 C ATOM 1540 O ARG A 198 -10.662 20.826 -7.225 1.00 32.01 O ATOM 1541 CB ARG A 198 -10.974 22.914 -4.804 1.00 39.81 C ATOM 1542 CG ARG A 198 -9.693 22.130 -4.460 1.00 44.81 C ATOM 1543 CD ARG A 198 -8.497 22.563 -5.292 1.00 46.41 C ATOM 1544 NE ARG A 198 -7.225 21.869 -4.984 1.00 47.94 N ATOM 1545 CZ ARG A 198 -6.178 21.792 -5.829 1.00 49.60 C ATOM 1546 NH1 ARG A 198 -6.217 22.311 -7.049 1.00 50.02 N ATOM 1547 NH2 ARG A 198 -5.079 21.150 -5.484 1.00 52.79 N ATOM 1548 HE ARG A 198 -7.134 21.411 -4.055 1.00 0.00 H ATOM 1549 HH12 ARG A 198 -5.390 22.233 -7.674 1.00 0.00 H ATOM 1550 HH11 ARG A 198 -7.075 22.796 -7.380 1.00 0.00 H ATOM 1551 HH22 ARG A 198 -4.278 21.098 -6.145 1.00 0.00 H ATOM 1552 HH21 ARG A 198 -5.013 20.696 -4.551 1.00 0.00 H ATOM 1553 H ARG A 198 -13.174 24.039 -5.622 1.00 0.00 H ATOM 1554 N ILE A 199 -12.875 20.968 -6.653 1.00 31.12 N ATOM 1555 CA ILE A 199 -13.180 19.624 -7.137 1.00 32.61 C ATOM 1556 C ILE A 199 -13.077 19.583 -8.667 1.00 33.49 C ATOM 1557 O ILE A 199 -12.538 18.636 -9.230 1.00 34.21 O ATOM 1558 CB ILE A 199 -14.501 19.093 -6.539 1.00 32.24 C ATOM 1559 CG1 ILE A 199 -14.196 18.469 -5.142 1.00 34.91 C ATOM 1560 CG2 ILE A 199 -15.223 18.094 -7.431 1.00 34.31 C ATOM 1561 CD1 ILE A 199 -15.402 18.404 -4.252 1.00 34.39 C ATOM 1562 H ILE A 199 -13.629 21.546 -6.229 1.00 0.00 H ATOM 1563 N ARG A 200 -13.635 20.576 -9.318 1.00 33.92 N ATOM 1564 CA ARG A 200 -13.571 20.694 -10.789 1.00 37.70 C ATOM 1565 C ARG A 200 -12.111 20.761 -11.308 1.00 36.60 C ATOM 1566 O ARG A 200 -11.736 20.117 -12.250 1.00 38.55 O ATOM 1567 CB ARG A 200 -14.298 21.950 -11.191 1.00 38.96 C ATOM 1568 CG ARG A 200 -14.089 22.324 -12.632 1.00 45.16 C ATOM 1569 CD ARG A 200 -15.221 23.145 -13.150 1.00 48.12 C ATOM 1570 NE ARG A 200 -15.092 23.253 -14.595 1.00 50.50 N ATOM 1571 CZ ARG A 200 -16.052 23.628 -15.424 1.00 60.15 C ATOM 1572 NH1 ARG A 200 -17.266 23.923 -14.965 1.00 74.21 N ATOM 1573 NH2 ARG A 200 -15.812 23.688 -16.739 1.00 59.88 N ATOM 1574 HE ARG A 200 -14.169 23.016 -15.011 1.00 0.00 H ATOM 1575 HH12 ARG A 200 -18.014 24.217 -15.625 1.00 0.00 H ATOM 1576 HH11 ARG A 200 -17.466 23.860 -13.946 1.00 0.00 H ATOM 1577 HH22 ARG A 200 -16.566 23.983 -17.392 1.00 0.00 H ATOM 1578 HH21 ARG A 200 -14.872 23.440 -17.108 1.00 0.00 H ATOM 1579 H ARG A 200 -14.141 21.307 -8.778 1.00 0.00 H ATOM 1580 N GLU A 201 -11.308 21.556 -10.634 1.00 43.68 N ATOM 1581 CA GLU A 201 -9.852 21.691 -10.921 1.00 43.28 C ATOM 1582 C GLU A 201 -9.074 20.362 -10.671 1.00 38.26 C ATOM 1583 O GLU A 201 -8.303 19.959 -11.508 1.00 32.32 O ATOM 1584 CB GLU A 201 -9.393 22.887 -10.124 1.00 44.95 C ATOM 1585 CG GLU A 201 -7.945 23.250 -9.987 1.00 51.51 C ATOM 1586 CD GLU A 201 -7.845 24.360 -8.942 1.00 61.29 C ATOM 1587 OE1 GLU A 201 -8.729 25.261 -8.916 1.00 67.76 O ATOM 1588 OE2 GLU A 201 -6.931 24.304 -8.091 1.00 59.77 O ATOM 1589 H GLU A 201 -11.711 22.121 -9.859 1.00 0.00 H ATOM 1590 N LEU A 202 -9.378 19.640 -9.597 1.00 35.96 N ATOM 1591 CA LEU A 202 -8.803 18.291 -9.359 1.00 38.94 C ATOM 1592 C LEU A 202 -9.193 17.287 -10.436 1.00 40.34 C ATOM 1593 O LEU A 202 -8.295 16.599 -10.965 1.00 36.36 O ATOM 1594 CB LEU A 202 -9.156 17.750 -7.969 1.00 40.95 C ATOM 1595 CG LEU A 202 -8.403 18.474 -6.846 1.00 40.75 C ATOM 1596 CD1 LEU A 202 -9.004 18.187 -5.463 1.00 42.35 C ATOM 1597 CD2 LEU A 202 -6.943 18.073 -6.895 1.00 41.80 C ATOM 1598 H LEU A 202 -10.041 20.033 -8.899 1.00 0.00 H ATOM 1599 N ALA A 203 -10.489 17.224 -10.787 1.00 32.08 N ATOM 1600 CA ALA A 203 -10.925 16.410 -11.919 1.00 35.89 C ATOM 1601 C ALA A 203 -10.260 16.786 -13.281 1.00 36.72 C ATOM 1602 O ALA A 203 -9.908 15.908 -14.082 1.00 40.06 O ATOM 1603 CB ALA A 203 -12.447 16.421 -12.057 1.00 34.74 C ATOM 1604 H ALA A 203 -11.193 17.764 -10.244 1.00 0.00 H ATOM 1605 N PHE A 204 -10.071 18.071 -13.524 1.00 39.46 N ATOM 1606 CA PHE A 204 -9.376 18.547 -14.733 1.00 40.37 C ATOM 1607 C PHE A 204 -7.892 18.199 -14.734 1.00 41.56 C ATOM 1608 O PHE A 204 -7.323 17.805 -15.768 1.00 39.89 O ATOM 1609 CB PHE A 204 -9.536 20.063 -14.857 1.00 45.34 C ATOM 1610 CG PHE A 204 -8.942 20.623 -16.107 1.00 41.59 C ATOM 1611 CD1 PHE A 204 -7.719 21.292 -16.073 1.00 45.01 C ATOM 1612 CD2 PHE A 204 -9.582 20.452 -17.317 1.00 41.65 C ATOM 1613 CE1 PHE A 204 -7.149 21.807 -17.231 1.00 44.46 C ATOM 1614 CE2 PHE A 204 -9.033 20.977 -18.479 1.00 46.53 C ATOM 1615 CZ PHE A 204 -7.802 21.632 -18.441 1.00 43.74 C ATOM 1616 H PHE A 204 -10.424 18.770 -12.839 1.00 0.00 H ATOM 1617 N LEU A 205 -7.259 18.367 -13.587 1.00 37.36 N ATOM 1618 CA LEU A 205 -5.805 18.045 -13.429 1.00 42.82 C ATOM 1619 C LEU A 205 -5.483 16.540 -13.412 1.00 40.18 C ATOM 1620 O LEU A 205 -4.390 16.142 -13.755 1.00 40.88 O ATOM 1621 CB LEU A 205 -5.263 18.696 -12.138 1.00 43.04 C ATOM 1622 CG LEU A 205 -5.277 20.236 -12.035 1.00 42.20 C ATOM 1623 CD1 LEU A 205 -4.893 20.732 -10.637 1.00 37.87 C ATOM 1624 CD2 LEU A 205 -4.303 20.816 -13.048 1.00 48.03 C ATOM 1625 H LEU A 205 -7.786 18.734 -12.769 1.00 0.00 H ATOM 1626 N ASN A 206 -6.451 15.713 -13.016 1.00 43.31 N ATOM 1627 CA ASN A 206 -6.289 14.261 -12.847 1.00 41.65 C ATOM 1628 C ASN A 206 -7.318 13.580 -13.737 1.00 40.26 C ATOM 1629 O ASN A 206 -8.324 13.034 -13.262 1.00 38.50 O ATOM 1630 CB ASN A 206 -6.536 13.891 -11.376 1.00 40.32 C ATOM 1631 CG ASN A 206 -5.509 14.500 -10.429 1.00 44.33 C ATOM 1632 OD1 ASN A 206 -5.764 15.509 -9.718 1.00 43.02 O ATOM 1633 ND2 ASN A 206 -4.340 13.864 -10.380 1.00 39.58 N ATOM 1634 HD22 ASN A 206 -4.173 13.035 -10.985 1.00 0.00 H ATOM 1635 HD21 ASN A 206 -3.594 14.196 -9.736 1.00 0.00 H ATOM 1636 H ASN A 206 -7.385 16.123 -12.813 1.00 0.00 H ATOM 1637 N LYS A 207 -7.097 13.650 -15.040 1.00 41.38 N ATOM 1638 CA LYS A 207 -8.082 13.158 -16.036 1.00 41.77 C ATOM 1639 C LYS A 207 -8.408 11.658 -15.923 1.00 36.51 C ATOM 1640 O LYS A 207 -7.569 10.852 -15.594 1.00 40.95 O ATOM 1641 CB LYS A 207 -7.633 13.521 -17.484 1.00 48.64 C ATOM 1642 CG LYS A 207 -7.881 14.972 -17.847 1.00 51.74 C ATOM 1643 CD LYS A 207 -6.781 15.525 -18.711 1.00 60.03 C ATOM 1644 CE LYS A 207 -6.918 17.038 -18.843 1.00 64.19 C ATOM 1645 NZ LYS A 207 -8.237 17.460 -19.403 1.00 68.30 N ATOM 1646 HZ1 LYS A 207 -8.358 17.048 -20.350 1.00 0.00 H ATOM 1647 HZ2 LYS A 207 -9.000 17.127 -18.779 1.00 0.00 H ATOM 1648 HZ3 LYS A 207 -8.269 18.497 -19.468 1.00 0.00 H ATOM 1649 H LYS A 207 -6.204 14.063 -15.377 1.00 0.00 H ATOM 1650 N GLY A 208 -9.637 11.295 -16.201 1.00 36.64 N ATOM 1651 CA GLY A 208 -10.052 9.899 -16.008 1.00 37.35 C ATOM 1652 C GLY A 208 -10.697 9.606 -14.649 1.00 38.29 C ATOM 1653 O GLY A 208 -11.255 8.512 -14.441 1.00 38.05 O ATOM 1654 H GLY A 208 -10.318 11.995 -16.558 1.00 0.00 H ATOM 1655 N ILE A 209 -10.655 10.549 -13.703 1.00 38.02 N ATOM 1656 CA ILE A 209 -11.329 10.317 -12.423 1.00 38.11 C ATOM 1657 C ILE A 209 -12.636 11.079 -12.413 1.00 37.53 C ATOM 1658 O ILE A 209 -12.662 12.248 -12.775 1.00 37.19 O ATOM 1659 CB ILE A 209 -10.504 10.723 -11.192 1.00 41.94 C ATOM 1660 CG1 ILE A 209 -9.064 10.275 -11.304 1.00 42.27 C ATOM 1661 CG2 ILE A 209 -11.107 10.083 -9.934 1.00 40.46 C ATOM 1662 CD1 ILE A 209 -8.222 10.833 -10.181 1.00 45.13 C ATOM 1663 H ILE A 209 -10.148 11.441 -13.874 1.00 0.00 H ATOM 1664 N GLN A 210 -13.711 10.400 -12.007 1.00 32.63 N ATOM 1665 CA GLN A 210 -14.971 11.037 -11.822 1.00 37.91 C ATOM 1666 C GLN A 210 -15.073 11.501 -10.380 1.00 37.50 C ATOM 1667 O GLN A 210 -15.044 10.653 -9.492 1.00 34.59 O ATOM 1668 CB GLN A 210 -16.097 10.076 -12.110 1.00 40.09 C ATOM 1669 CG GLN A 210 -17.435 10.747 -12.035 1.00 44.65 C ATOM 1670 CD GLN A 210 -18.519 9.728 -11.940 1.00 51.02 C ATOM 1671 OE1 GLN A 210 -18.746 9.156 -10.886 1.00 56.21 O ATOM 1672 NE2 GLN A 210 -19.153 9.446 -13.050 1.00 52.50 N ATOM 1673 HE22 GLN A 210 -18.925 9.961 -13.924 1.00 0.00 H ATOM 1674 HE21 GLN A 210 -19.885 8.707 -13.058 1.00 0.00 H ATOM 1675 H GLN A 210 -13.626 9.380 -11.821 1.00 0.00 H ATOM 1676 N ILE A 211 -15.273 12.817 -10.184 1.00 33.68 N ATOM 1677 CA ILE A 211 -15.346 13.432 -8.850 1.00 34.94 C ATOM 1678 C ILE A 211 -16.631 14.217 -8.793 1.00 33.02 C ATOM 1679 O ILE A 211 -16.895 15.106 -9.631 1.00 36.97 O ATOM 1680 CB ILE A 211 -14.135 14.355 -8.487 1.00 34.99 C ATOM 1681 CG1 ILE A 211 -12.804 13.723 -8.934 1.00 35.00 C ATOM 1682 CG2 ILE A 211 -14.086 14.613 -6.969 1.00 36.11 C ATOM 1683 CD1 ILE A 211 -11.545 14.550 -8.622 1.00 32.91 C ATOM 1684 H ILE A 211 -15.381 13.430 -11.017 1.00 0.00 H ATOM 1685 N THR A 212 -17.415 13.845 -7.803 1.00 31.38 N ATOM 1686 CA THR A 212 -18.778 14.220 -7.651 1.00 35.60 C ATOM 1687 C THR A 212 -18.919 14.951 -6.315 1.00 36.30 C ATOM 1688 O THR A 212 -18.446 14.470 -5.305 1.00 39.84 O ATOM 1689 CB THR A 212 -19.676 12.994 -7.653 1.00 33.11 C ATOM 1690 OG1 THR A 212 -19.742 12.448 -8.964 1.00 36.55 O ATOM 1691 CG2 THR A 212 -21.087 13.356 -7.231 1.00 36.55 C ATOM 1692 HG1 THR A 212 -20.111 13.126 -9.584 1.00 0.00 H ATOM 1693 H THR A 212 -17.005 13.227 -7.074 1.00 0.00 H ATOM 1694 N LEU A 213 -19.539 16.125 -6.338 1.00 35.10 N ATOM 1695 CA LEU A 213 -19.821 16.886 -5.112 1.00 34.31 C ATOM 1696 C LEU A 213 -21.326 16.923 -4.986 1.00 33.97 C ATOM 1697 O LEU A 213 -22.029 17.149 -5.980 1.00 30.23 O ATOM 1698 CB LEU A 213 -19.270 18.301 -5.195 1.00 32.99 C ATOM 1699 CG LEU A 213 -19.677 19.276 -4.075 1.00 32.81 C ATOM 1700 CD1 LEU A 213 -19.039 18.898 -2.735 1.00 36.41 C ATOM 1701 CD2 LEU A 213 -19.291 20.684 -4.507 1.00 34.39 C ATOM 1702 H LEU A 213 -19.835 16.519 -7.254 1.00 0.00 H ATOM 1703 N ARG A 214 -21.815 16.666 -3.780 1.00 32.84 N ATOM 1704 CA ARG A 214 -23.239 16.744 -3.475 1.00 34.01 C ATOM 1705 C ARG A 214 -23.441 17.521 -2.159 1.00 35.04 C ATOM 1706 O ARG A 214 -22.682 17.319 -1.198 1.00 34.73 O ATOM 1707 CB ARG A 214 -23.875 15.346 -3.441 1.00 37.87 C ATOM 1708 CG ARG A 214 -25.325 15.386 -2.999 1.00 41.08 C ATOM 1709 CD ARG A 214 -26.168 14.185 -3.367 1.00 44.52 C ATOM 1710 NE ARG A 214 -25.759 13.027 -2.608 1.00 44.20 N ATOM 1711 CZ ARG A 214 -24.910 12.083 -3.028 1.00 48.92 C ATOM 1712 NH1 ARG A 214 -24.360 12.129 -4.233 1.00 44.81 N ATOM 1713 NH2 ARG A 214 -24.594 11.069 -2.213 1.00 51.25 N ATOM 1714 HE ARG A 214 -26.158 12.918 -1.654 1.00 0.00 H ATOM 1715 HH12 ARG A 214 -23.703 11.381 -4.534 1.00 0.00 H ATOM 1716 HH11 ARG A 214 -24.586 12.913 -4.878 1.00 0.00 H ATOM 1717 HH22 ARG A 214 -23.934 10.331 -2.533 1.00 0.00 H ATOM 1718 HH21 ARG A 214 -25.008 11.019 -1.260 1.00 0.00 H ATOM 1719 H ARG A 214 -21.156 16.398 -3.021 1.00 0.00 H ATOM 1720 N ASP A 215 -24.410 18.451 -2.149 1.00 33.83 N ATOM 1721 CA ASP A 215 -24.852 19.153 -0.940 1.00 33.14 C ATOM 1722 C ASP A 215 -26.213 18.639 -0.485 1.00 34.81 C ATOM 1723 O ASP A 215 -27.193 18.857 -1.185 1.00 34.11 O ATOM 1724 CB ASP A 215 -24.909 20.663 -1.176 1.00 34.46 C ATOM 1725 CG ASP A 215 -25.125 21.457 0.126 1.00 36.28 C ATOM 1726 OD1 ASP A 215 -25.423 20.845 1.172 1.00 31.90 O ATOM 1727 OD2 ASP A 215 -25.056 22.708 0.095 1.00 43.75 O ATOM 1728 H ASP A 215 -24.873 18.687 -3.050 1.00 0.00 H ATOM 1729 N GLU A 216 -26.250 17.983 0.683 1.00 33.41 N ATOM 1730 CA GLU A 216 -27.437 17.406 1.327 1.00 34.39 C ATOM 1731 C GLU A 216 -27.837 18.053 2.630 1.00 40.42 C ATOM 1732 O GLU A 216 -28.691 17.540 3.322 1.00 40.89 O ATOM 1733 CB GLU A 216 -27.177 15.952 1.695 1.00 36.01 C ATOM 1734 CG GLU A 216 -27.414 14.985 0.591 1.00 40.38 C ATOM 1735 CD GLU A 216 -26.896 13.618 0.935 1.00 42.83 C ATOM 1736 OE1 GLU A 216 -26.558 13.320 2.099 1.00 49.08 O ATOM 1737 OE2 GLU A 216 -26.818 12.841 -0.001 1.00 45.32 O ATOM 1738 H GLU A 216 -25.346 17.871 1.185 1.00 0.00 H ATOM 1739 N ARG A 217 -27.204 19.156 2.995 1.00 45.25 N ATOM 1740 CA ARG A 217 -27.569 19.858 4.198 1.00 40.77 C ATOM 1741 C ARG A 217 -29.056 20.291 4.165 1.00 48.34 C ATOM 1742 O ARG A 217 -29.722 20.229 5.196 1.00 44.01 O ATOM 1743 CB ARG A 217 -26.636 21.064 4.371 1.00 45.89 C ATOM 1744 CG ARG A 217 -25.202 20.701 4.769 1.00 37.13 C ATOM 1745 CD ARG A 217 -24.374 21.931 4.808 1.00 35.99 C ATOM 1746 NE ARG A 217 -24.175 22.534 3.478 1.00 35.19 N ATOM 1747 CZ ARG A 217 -23.318 23.519 3.226 1.00 31.62 C ATOM 1748 NH1 ARG A 217 -23.193 23.978 2.009 1.00 31.21 N ATOM 1749 NH2 ARG A 217 -22.525 24.030 4.187 1.00 36.60 N ATOM 1750 HE ARG A 217 -24.741 22.166 2.687 1.00 0.00 H ATOM 1751 HH12 ARG A 217 -22.523 24.748 1.810 1.00 0.00 H ATOM 1752 HH11 ARG A 217 -23.763 23.573 1.239 1.00 0.00 H ATOM 1753 HH22 ARG A 217 -21.864 24.800 3.961 1.00 0.00 H ATOM 1754 HH21 ARG A 217 -22.574 23.654 5.156 1.00 0.00 H ATOM 1755 H ARG A 217 -26.431 19.522 2.404 1.00 0.00 H ATOM 1756 N ASP A 218 -29.572 20.699 2.989 1.00 41.25 N ATOM 1757 CA ASP A 218 -30.998 21.016 2.814 1.00 42.73 C ATOM 1758 C ASP A 218 -31.696 19.880 2.058 1.00 41.39 C ATOM 1759 O ASP A 218 -31.641 19.820 0.818 1.00 41.39 O ATOM 1760 CB ASP A 218 -31.133 22.369 2.101 1.00 39.98 C ATOM 1761 CG ASP A 218 -32.593 22.842 1.964 1.00 47.53 C ATOM 1762 OD1 ASP A 218 -33.516 22.158 2.494 1.00 40.71 O ATOM 1763 OD2 ASP A 218 -32.785 23.921 1.328 1.00 43.88 O ATOM 1764 H ASP A 218 -28.936 20.794 2.171 1.00 0.00 H ATOM 1765 N GLU A 219 -32.318 18.977 2.818 1.00 44.69 N ATOM 1766 CA GLU A 219 -33.161 17.866 2.315 1.00 52.78 C ATOM 1767 C GLU A 219 -34.164 18.231 1.197 1.00 48.34 C ATOM 1768 O GLU A 219 -34.461 17.395 0.354 1.00 51.02 O ATOM 1769 CB GLU A 219 -33.921 17.163 3.476 1.00 57.21 C ATOM 1770 CG GLU A 219 -34.550 18.097 4.534 1.00 70.22 C ATOM 1771 CD GLU A 219 -33.847 18.113 5.917 1.00 74.51 C ATOM 1772 OE1 GLU A 219 -32.603 18.002 6.026 1.00 75.67 O ATOM 1773 OE2 GLU A 219 -34.555 18.255 6.939 1.00 83.72 O ATOM 1774 H GLU A 219 -32.202 19.059 3.848 1.00 0.00 H ATOM 1775 N GLU A 220 -34.678 19.464 1.201 1.00 46.57 N ATOM 1776 CA GLU A 220 -35.688 19.881 0.239 1.00 44.23 C ATOM 1777 C GLU A 220 -35.093 20.385 -1.063 1.00 41.48 C ATOM 1778 O GLU A 220 -35.775 20.415 -2.097 1.00 38.33 O ATOM 1779 CB GLU A 220 -36.639 20.885 0.893 1.00 48.53 C ATOM 1780 CG GLU A 220 -37.285 20.274 2.153 1.00 51.96 C ATOM 1781 CD GLU A 220 -38.310 21.155 2.798 1.00 55.75 C ATOM 1782 OE1 GLU A 220 -38.156 22.400 2.700 1.00 53.44 O ATOM 1783 OE2 GLU A 220 -39.249 20.583 3.418 1.00 64.83 O ATOM 1784 H GLU A 220 -34.347 20.146 1.913 1.00 0.00 H ATOM 1785 N ASN A 221 -33.810 20.756 -1.031 1.00 36.88 N ATOM 1786 CA ASN A 221 -33.099 21.160 -2.242 1.00 40.62 C ATOM 1787 C ASN A 221 -31.670 20.603 -2.273 1.00 43.77 C ATOM 1788 O ASN A 221 -30.759 21.212 -1.736 1.00 44.25 O ATOM 1789 CB ASN A 221 -33.118 22.667 -2.390 1.00 46.33 C ATOM 1790 CG ASN A 221 -32.370 23.128 -3.634 1.00 53.18 C ATOM 1791 OD1 ASN A 221 -31.918 22.320 -4.466 1.00 56.49 O ATOM 1792 ND2 ASN A 221 -32.250 24.437 -3.778 1.00 59.85 N ATOM 1793 HD22 ASN A 221 -32.642 25.077 -3.059 1.00 0.00 H ATOM 1794 HD21 ASN A 221 -31.763 24.826 -4.611 1.00 0.00 H ATOM 1795 H ASN A 221 -33.305 20.757 -0.122 1.00 0.00 H ATOM 1796 N VAL A 222 -31.508 19.418 -2.874 1.00 36.88 N ATOM 1797 CA VAL A 222 -30.236 18.776 -2.962 1.00 37.95 C ATOM 1798 C VAL A 222 -29.547 19.188 -4.287 1.00 38.79 C ATOM 1799 O VAL A 222 -30.158 19.115 -5.374 1.00 35.24 O ATOM 1800 CB VAL A 222 -30.404 17.256 -2.830 1.00 35.60 C ATOM 1801 CG1 VAL A 222 -29.091 16.552 -3.106 1.00 40.60 C ATOM 1802 CG2 VAL A 222 -30.984 16.922 -1.469 1.00 37.12 C ATOM 1803 H VAL A 222 -32.337 18.949 -3.291 1.00 0.00 H ATOM 1804 N ARG A 223 -28.293 19.622 -4.183 1.00 34.63 N ATOM 1805 CA ARG A 223 -27.487 19.997 -5.359 1.00 38.46 C ATOM 1806 C ARG A 223 -26.318 19.071 -5.584 1.00 37.80 C ATOM 1807 O ARG A 223 -25.639 18.706 -4.629 1.00 37.87 O ATOM 1808 CB ARG A 223 -26.812 21.302 -5.175 1.00 41.28 C ATOM 1809 CG ARG A 223 -27.627 22.516 -4.943 1.00 51.29 C ATOM 1810 CD ARG A 223 -26.609 23.661 -4.893 1.00 56.28 C ATOM 1811 NE ARG A 223 -25.813 23.831 -6.117 1.00 55.81 N ATOM 1812 CZ ARG A 223 -24.909 24.804 -6.311 1.00 56.56 C ATOM 1813 NH1 ARG A 223 -24.635 25.720 -5.360 1.00 56.45 N ATOM 1814 NH2 ARG A 223 -24.264 24.854 -7.471 1.00 56.56 N ATOM 1815 HE ARG A 223 -25.961 23.149 -6.888 1.00 0.00 H ATOM 1816 HH12 ARG A 223 -23.929 26.462 -5.541 1.00 0.00 H ATOM 1817 HH11 ARG A 223 -25.130 25.684 -4.446 1.00 0.00 H ATOM 1818 HH22 ARG A 223 -23.559 25.600 -7.643 1.00 0.00 H ATOM 1819 HH21 ARG A 223 -24.464 24.148 -8.208 1.00 0.00 H ATOM 1820 H ARG A 223 -27.866 19.699 -3.238 1.00 0.00 H ATOM 1821 N GLU A 224 -26.006 18.804 -6.847 1.00 37.15 N ATOM 1822 CA GLU A 224 -24.918 17.893 -7.195 1.00 37.80 C ATOM 1823 C GLU A 224 -24.226 18.386 -8.456 1.00 37.32 C ATOM 1824 O GLU A 224 -24.891 18.830 -9.401 1.00 36.34 O ATOM 1825 CB GLU A 224 -25.476 16.463 -7.338 1.00 40.57 C ATOM 1826 CG GLU A 224 -24.448 15.393 -7.696 1.00 47.33 C ATOM 1827 CD GLU A 224 -25.039 13.978 -7.706 1.00 48.18 C ATOM 1828 OE1 GLU A 224 -25.537 13.538 -8.755 1.00 56.44 O ATOM 1829 OE2 GLU A 224 -24.988 13.282 -6.673 1.00 53.23 O ATOM 1830 H GLU A 224 -26.551 19.256 -7.609 1.00 0.00 H ATOM 1831 N ASP A 225 -22.900 18.395 -8.435 1.00 34.54 N ATOM 1832 CA ASP A 225 -22.074 18.669 -9.609 1.00 35.53 C ATOM 1833 C ASP A 225 -21.075 17.536 -9.724 1.00 35.73 C ATOM 1834 O ASP A 225 -20.419 17.162 -8.709 1.00 30.53 O ATOM 1835 CB ASP A 225 -21.328 19.969 -9.484 1.00 40.65 C ATOM 1836 CG ASP A 225 -22.207 21.150 -9.645 1.00 46.07 C ATOM 1837 OD1 ASP A 225 -22.425 21.623 -10.802 1.00 44.18 O ATOM 1838 OD2 ASP A 225 -22.708 21.568 -8.591 1.00 45.72 O ATOM 1839 H ASP A 225 -22.422 18.196 -7.533 1.00 0.00 H ATOM 1840 N SER A 226 -20.990 16.990 -10.935 1.00 32.79 N ATOM 1841 CA SER A 226 -20.187 15.828 -11.245 1.00 33.14 C ATOM 1842 C SER A 226 -19.225 16.069 -12.416 1.00 35.05 C ATOM 1843 O SER A 226 -19.656 16.343 -13.537 1.00 33.72 O ATOM 1844 CB SER A 226 -21.113 14.655 -11.592 1.00 34.75 C ATOM 1845 OG SER A 226 -20.360 13.475 -11.631 1.00 37.18 O ATOM 1846 HG SER A 226 -19.943 13.321 -10.746 1.00 0.00 H ATOM 1847 H SER A 226 -21.535 17.426 -11.706 1.00 0.00 H ATOM 1848 N TYR A 227 -17.929 15.865 -12.159 1.00 39.09 N ATOM 1849 CA TYR A 227 -16.864 16.239 -13.089 1.00 37.18 C ATOM 1850 C TYR A 227 -16.101 14.985 -13.498 1.00 41.52 C ATOM 1851 O TYR A 227 -15.747 14.176 -12.656 1.00 39.94 O ATOM 1852 CB TYR A 227 -15.947 17.245 -12.411 1.00 38.42 C ATOM 1853 CG TYR A 227 -16.672 18.516 -12.011 1.00 36.29 C ATOM 1854 CD1 TYR A 227 -17.068 18.725 -10.711 1.00 37.18 C ATOM 1855 CD2 TYR A 227 -17.006 19.475 -12.972 1.00 38.70 C ATOM 1856 CE1 TYR A 227 -17.745 19.867 -10.349 1.00 39.63 C ATOM 1857 CE2 TYR A 227 -17.689 20.618 -12.639 1.00 38.66 C ATOM 1858 CZ TYR A 227 -18.030 20.825 -11.313 1.00 40.61 C ATOM 1859 OH TYR A 227 -18.701 21.968 -10.988 1.00 40.55 O ATOM 1860 HH TYR A 227 -18.877 21.981 -10.014 1.00 0.00 H ATOM 1861 H TYR A 227 -17.666 15.420 -11.257 1.00 0.00 H ATOM 1862 N HIS A 228 -15.860 14.847 -14.799 1.00 39.23 N ATOM 1863 CA HIS A 228 -15.185 13.706 -15.355 1.00 39.53 C ATOM 1864 C HIS A 228 -14.612 14.082 -16.707 1.00 41.15 C ATOM 1865 O HIS A 228 -15.307 14.023 -17.724 1.00 39.15 O ATOM 1866 CB HIS A 228 -16.154 12.546 -15.491 1.00 43.92 C ATOM 1867 CG HIS A 228 -15.531 11.298 -16.016 1.00 44.45 C ATOM 1868 ND1 HIS A 228 -16.270 10.259 -16.528 1.00 49.56 N ATOM 1869 CD2 HIS A 228 -14.235 10.925 -16.124 1.00 49.75 C ATOM 1870 CE1 HIS A 228 -15.462 9.287 -16.902 1.00 48.19 C ATOM 1871 NE2 HIS A 228 -14.220 9.681 -16.693 1.00 49.28 N ATOM 1872 H HIS A 228 -16.175 15.600 -15.444 1.00 0.00 H ATOM 1873 N TYR A 229 -13.335 14.452 -16.693 1.00 43.16 N ATOM 1874 CA TYR A 229 -12.573 14.816 -17.890 1.00 42.46 C ATOM 1875 C TYR A 229 -11.959 13.558 -18.538 1.00 47.26 C ATOM 1876 O TYR A 229 -11.446 12.674 -17.828 1.00 49.01 O ATOM 1877 CB TYR A 229 -11.531 15.867 -17.525 1.00 40.78 C ATOM 1878 CG TYR A 229 -12.193 17.197 -17.205 1.00 43.10 C ATOM 1879 CD1 TYR A 229 -12.683 17.467 -15.924 1.00 41.68 C ATOM 1880 CD2 TYR A 229 -12.434 18.141 -18.209 1.00 43.80 C ATOM 1881 CE1 TYR A 229 -13.338 18.663 -15.623 1.00 44.04 C ATOM 1882 CE2 TYR A 229 -13.101 19.338 -17.918 1.00 46.45 C ATOM 1883 CZ TYR A 229 -13.538 19.599 -16.617 1.00 45.38 C ATOM 1884 OH TYR A 229 -14.175 20.780 -16.296 1.00 51.80 O ATOM 1885 HH TYR A 229 -14.406 20.778 -15.333 1.00 0.00 H ATOM 1886 H TYR A 229 -12.847 14.485 -15.775 1.00 0.00 H ATOM 1887 N GLU A 230 -12.026 13.498 -19.879 1.00 51.54 N ATOM 1888 CA GLU A 230 -11.932 12.235 -20.648 1.00 63.49 C ATOM 1889 C GLU A 230 -12.617 11.027 -19.968 1.00 69.91 C ATOM 1890 O GLU A 230 -13.505 10.374 -20.536 1.00 77.45 O ATOM 1891 CB GLU A 230 -10.474 11.888 -20.952 1.00 74.46 C ATOM 1892 CG GLU A 230 -10.152 11.858 -22.444 1.00 80.91 C ATOM 1893 CD GLU A 230 -9.922 13.226 -23.024 1.00 84.95 C ATOM 1894 OE1 GLU A 230 -9.484 13.286 -24.199 1.00 86.27 O ATOM 1895 OE2 GLU A 230 -10.165 14.222 -22.297 1.00 80.57 O ATOM 1896 H GLU A 230 -12.151 14.386 -20.405 1.00 0.00 H TER 1897 GLU A 230 HETATM 1898 O HOH 1 -12.221 -0.931 -6.979 1.00 47.73 O HETATM 1899 O HOH 2 -14.158 29.113 1.625 1.00 44.38 O HETATM 1900 O HOH 3 -8.585 -1.929 16.111 1.00 40.21 O HETATM 1901 O HOH 4 -4.159 16.889 -8.428 1.00 49.18 O HETATM 1902 O HOH 5 -1.564 8.689 8.981 1.00 48.41 O HETATM 1903 O HOH 6 -23.971 -10.940 3.931 1.00 48.92 O HETATM 1904 O HOH 7 -22.119 5.764 9.442 1.00 49.18 O HETATM 1905 O HOH 8 -9.127 -4.529 -2.086 1.00 37.42 O HETATM 1906 O HOH 9 -22.844 8.564 -0.641 1.00 57.03 O HETATM 1907 O HOH 10 -18.239 10.207 -8.569 1.00 43.28 O HETATM 1908 O HOH 11 -11.552 12.077 22.402 1.00 37.71 O HETATM 1909 O HOH 12 4.132 9.571 26.805 1.00 46.79 O HETATM 1910 O HOH 13 -16.871 9.078 16.932 1.00 43.81 O HETATM 1911 O HOH 14 -11.542 13.910 -14.533 1.00 31.97 O HETATM 1912 O HOH 15 -19.104 10.080 -0.112 1.00 36.97 O HETATM 1913 O HOH 16 -14.698 -6.353 -0.828 1.00 42.52 O HETATM 1914 O HOH 17 -15.183 -1.128 -5.795 1.00 35.50 O HETATM 1915 O HOH 18 -7.326 4.457 -11.779 1.00 50.31 O HETATM 1916 O HOH 19 -12.836 28.273 11.520 1.00 33.76 O HETATM 1917 O HOH 20 6.663 7.841 14.494 1.00 58.52 O HETATM 1918 O HOH 21 -18.261 21.213 10.532 1.00 39.88 O HETATM 1919 O HOH 22 -3.556 7.417 -0.856 1.00 52.36 O HETATM 1920 O HOH 23 -25.049 11.129 2.575 1.00 43.14 O HETATM 1921 O HOH 24 -9.621 2.759 -0.770 1.00 30.61 O HETATM 1922 O HOH 25 -17.313 -11.821 2.886 1.00 46.42 O HETATM 1923 O HOH 26 -23.284 -5.100 11.662 1.00 43.21 O HETATM 1924 O HOH 27 -19.882 28.242 11.591 1.00 39.76 O HETATM 1925 O HOH 28 -16.844 18.356 9.047 1.00 32.44 O HETATM 1926 O HOH 29 -13.592 -2.352 21.239 1.00 52.87 O HETATM 1927 O HOH 30 -11.522 26.214 -3.930 1.00 41.41 O HETATM 1928 O HOH 31 -19.205 14.464 -15.491 1.00 38.93 O HETATM 1929 O HOH 32 -27.579 11.713 -8.447 1.00 51.60 O HETATM 1930 O HOH 33 -3.386 13.655 2.017 1.00 55.68 O HETATM 1931 O HOH 34 -28.760 20.725 0.338 1.00 37.43 O HETATM 1932 O HOH 35 -25.227 14.148 9.106 1.00 38.47 O HETATM 1933 O HOH 36 -22.553 26.465 0.874 1.00 44.49 O HETATM 1934 O HOH 37 -11.830 12.108 15.670 1.00 36.85 O HETATM 1935 O HOH 38 -25.661 24.320 -2.168 1.00 53.23 O HETATM 1936 O HOH 39 -12.409 32.296 8.086 1.00 46.59 O HETATM 1937 O HOH 40 -10.456 -6.848 -1.432 1.00 36.82 O HETATM 1938 O HOH 41 -5.410 30.355 12.266 1.00 57.15 O HETATM 1939 O HOH 42 -2.191 13.537 8.464 1.00 43.92 O HETATM 1940 O HOH 43 -10.929 -11.002 -2.436 1.00 50.98 O HETATM 1941 O HOH 44 -7.153 17.467 -2.549 1.00 56.89 O HETATM 1942 O HOH 45 -5.972 -5.985 4.517 1.00 37.11 O HETATM 1943 O HOH 46 -5.921 24.691 2.269 1.00 58.16 O HETATM 1944 O HOH 47 -16.708 2.563 -13.570 1.00 42.40 O HETATM 1945 O HOH 48 -0.216 -2.951 5.772 1.00 40.45 O HETATM 1946 O HOH 49 -2.993 2.859 17.129 1.00 54.10 O HETATM 1947 O HOH 50 -27.300 14.336 5.113 1.00 40.37 O HETATM 1948 O HOH 51 -22.598 28.076 3.172 1.00 49.07 O HETATM 1949 O HOH 52 -20.691 1.686 3.448 1.00 45.73 O HETATM 1950 O HOH 53 -0.981 12.911 2.039 1.00 50.62 O HETATM 1951 O HOH 54 -21.572 3.649 5.273 1.00 51.91 O HETATM 1952 C8 UNN A 55 -7.267 5.027 0.399 1.00 0.21 C HETATM 1953 N13 UNN A 55 -8.356 5.880 0.208 1.00 -0.18 N HETATM 1954 C14 UNN A 55 -8.736 6.842 1.096 1.00 0.30 C HETATM 1955 O18 UNN A 55 -8.090 7.171 2.101 1.00 -0.39 O HETATM 1956 N15 UNN A 55 -9.880 7.471 0.847 1.00 -0.27 N HETATM 1957 C16 UNN A 55 -10.498 8.576 1.566 1.00 0.03 C HETATM 1958 C17 UNN A 55 -11.998 8.401 1.519 1.00 -0.04 C HETATM 1959 H10 UNN A 55 -12.481 9.229 2.059 1.00 0.02 H HETATM 1960 H11 UNN A 55 -12.271 7.446 1.992 1.00 0.02 H HETATM 1961 H12 UNN A 55 -12.335 8.400 0.472 1.00 0.02 H HETATM 1962 H8 UNN A 55 -10.221 9.529 1.091 1.00 0.05 H HETATM 1963 H9 UNN A 55 -10.157 8.575 2.612 1.00 0.05 H HETATM 1964 H7 UNN A 55 -10.389 7.138 0.053 1.00 0.19 H HETATM 1965 H13 UNN A 55 -8.890 5.779 -0.632 1.00 0.24 H HETATM 1966 S7 UNN A 55 -5.990 5.249 1.542 1.00 0.01 S HETATM 1967 C6 UNN A 55 -5.283 3.727 1.162 1.00 0.05 C HETATM 1968 C5 UNN A 55 -4.038 3.224 1.824 1.00 0.04 C HETATM 1969 C4 UNN A 55 -3.496 3.854 2.936 1.00 -0.09 C HETATM 1970 C3 UNN A 55 -2.390 3.087 3.241 1.00 -0.09 C HETATM 1971 C2 UNN A 55 -2.320 2.033 2.321 1.00 0.01 C HETATM 1972 N1 UNN A 55 -3.359 2.122 1.462 1.00 -0.30 N HETATM 1973 H4 UNN A 55 -3.584 1.479 0.690 1.00 0.23 H HETATM 1974 H3 UNN A 55 -1.550 1.263 2.301 1.00 0.08 H HETATM 1975 H2 UNN A 55 -1.692 3.270 4.056 1.00 0.03 H HETATM 1976 H1 UNN A 55 -3.858 4.744 3.447 1.00 0.02 H HETATM 1977 C10 UNN A 55 -6.108 3.038 0.129 1.00 0.01 C HETATM 1978 C11 UNN A 55 -5.836 1.685 -0.465 1.00 0.08 C HETATM 1979 O12 UNN A 55 -4.574 1.690 -1.131 1.00 -0.38 O HETATM 1980 H14 UNN A 55 -4.585 2.340 -1.824 1.00 0.21 H HETATM 1981 H5 UNN A 55 -6.628 1.438 -1.187 1.00 0.07 H HETATM 1982 H6 UNN A 55 -5.822 0.931 0.336 1.00 0.07 H HETATM 1983 N9 UNN A 55 -7.193 3.817 -0.230 1.00 -0.31 N CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1952 1953 1966 1983 CONECT 1953 1952 1954 1965 CONECT 1954 1953 1955 1956 CONECT 1955 1954 CONECT 1956 1954 1957 1964 CONECT 1957 1956 1958 1962 1963 CONECT 1958 1957 1959 1960 1961 CONECT 1959 1958 CONECT 1960 1958 CONECT 1961 1958 CONECT 1962 1957 CONECT 1963 1957 CONECT 1964 1956 CONECT 1965 1953 CONECT 1966 1952 1967 CONECT 1967 1966 1968 1977 CONECT 1968 1967 1969 1972 CONECT 1969 1968 1970 1976 CONECT 1970 1969 1971 1975 CONECT 1971 1970 1972 1974 CONECT 1972 1968 1971 1973 CONECT 1973 1972 CONECT 1974 1971 CONECT 1975 1970 CONECT 1976 1969 CONECT 1977 1967 1978 1983 CONECT 1978 1977 1979 1981 1982 CONECT 1979 1978 1980 CONECT 1980 1979 CONECT 1981 1978 CONECT 1982 1978 CONECT 1983 1952 1977 MASTER 0 0 0 0 0 0 0 0 1982 1 36 15 END
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Related entries of code: 5d6p
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
3ttz
RCSB PDB
PDBbind
198aa, >3TTZ_1|Chains... at 99%
3u2k
RCSB PDB
PDBbind
198aa, >3U2K_1|Chains... at 99%
5d6q
RCSB PDB
PDBbind
212aa, >5D6Q_1|Chains... at 100%
5d7c
RCSB PDB
PDBbind
212aa, >5D7C_1|Chains... at 100%
5d7r
RCSB PDB
PDBbind
212aa, >5D7R_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5d6p
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
ATP binding domain of S. aureus GyrB
Ligand Name
57U
EC.Number
E.C.5.99.1.3
Resolution
2.05(Å)
Affinity (Kd/Ki/IC50)
IC50=2.5uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) J.Med.Chem. Vol. 58: pp. 8503-8512
Ligand Properties
Formula
C
1
1
H
1
4
N
4
O
2
S
Molecular Weight
266.319
Exact Mass
266.084
No. of atoms
32
No. of bonds
33
Polar Surface Area
118.28
LOGP Value
0.29 (
Computed with XLOGP3
)
2.24 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 2
Canonical SMILES
CCNC(=O)Nc1nc(c(s1)c1ccc[nH]1)CO
InChI String
InChI=1S/C11H14N4O2S/c1-2-12-10(17)15-11-14-8(6-16)9(18-11)7-4-3-5-13-7/h3-5,13,16H,2,6H2,1H3,(H2,12,14,15,17)
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):
P0A0K8
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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