Browse entries in the PDBbind-CN Database
HEADER 6B4U_COMPLEX COMPND 6B4U_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 155 SER MET ASP LEU TYR ARG GLN SER LEU GLU ILE ILE SER SEQRES 2 A 155 ARG TYR LEU ARG GLU GLN ALA THR GLY ALA LYS ASP THR SEQRES 3 A 155 LYS PRO MET GLY ARG SER GLY ALA THR SER ARG LYS ALA SEQRES 4 A 155 LEU GLU THR LEU ARG ARG VAL GLY ASP GLY VAL GLN ARG SEQRES 5 A 155 ASN HIS GLU THR ALA PHE GLN GLY MET LEU ARG LYS LEU SEQRES 6 A 155 ASP ILE LYS ASN GLU ASP ASP VAL LYS SER LEU SER ARG SEQRES 7 A 155 VAL MET ILE HIS VAL PHE SER ASP GLY VAL THR ASN TRP SEQRES 8 A 155 GLY ARG ILE VAL THR LEU ILE SER PHE GLY ALA PHE VAL SEQRES 9 A 155 ALA LYS HIS LEU LYS THR ILE ASN GLN GLU SER CYS ILE SEQRES 10 A 155 GLU PRO LEU ALA GLU SER ILE THR ASP VAL LEU VAL ARG SEQRES 11 A 155 THR LYS ARG ASP TRP LEU VAL LYS GLN ARG GLY TRP ASP SEQRES 12 A 155 GLY PHE VAL GLU PHE PHE HIS VAL GLU ASP LEU GLU HET CN A 7 77 ATOM 1 N SER A 171 -1.673 28.530 19.722 1.00 41.28 N ATOM 2 CA SER A 171 -2.370 28.349 20.997 1.00 40.33 C ATOM 3 C SER A 171 -2.231 26.898 21.473 1.00 39.57 C ATOM 4 O SER A 171 -2.505 25.971 20.706 1.00 38.39 O ATOM 5 CB SER A 171 -3.845 28.733 20.860 1.00 45.64 C ATOM 6 OG SER A 171 -4.665 28.189 21.886 1.00 53.57 O ATOM 7 HG SER A 171 -5.603 28.472 21.742 1.00 0.00 H ATOM 8 HN3 SER A 171 -2.086 27.896 19.009 1.00 0.00 H ATOM 9 HN2 SER A 171 -0.665 28.306 19.845 1.00 0.00 H ATOM 10 HN1 SER A 171 -1.774 29.517 19.410 1.00 0.00 H ATOM 11 N MET A 172 -1.797 26.711 22.745 1.00 31.76 N ATOM 12 CA MET A 172 -1.645 25.394 23.362 1.00 29.16 C ATOM 13 C MET A 172 -3.010 24.688 23.463 1.00 33.51 C ATOM 14 O MET A 172 -3.126 23.518 23.077 1.00 33.44 O ATOM 15 CB MET A 172 -0.991 25.526 24.756 1.00 30.01 C ATOM 16 CG MET A 172 -1.109 24.283 25.628 1.00 30.50 C ATOM 17 SD MET A 172 -0.408 24.554 27.312 1.00 29.76 S ATOM 18 CE MET A 172 -0.890 23.309 28.015 1.00 24.86 C ATOM 19 H MET A 172 -1.560 27.550 23.312 1.00 0.00 H ATOM 20 N ASP A 173 -4.027 25.382 24.004 1.00 30.50 N ATOM 21 CA ASP A 173 -5.352 24.792 24.182 1.00 31.37 C ATOM 22 C ASP A 173 -6.035 24.438 22.850 1.00 34.72 C ATOM 23 O ASP A 173 -6.695 23.404 22.785 1.00 34.86 O ATOM 24 CB ASP A 173 -6.248 25.667 25.069 1.00 34.05 C ATOM 25 CG ASP A 173 -5.808 25.743 26.530 1.00 49.00 C ATOM 26 OD1 ASP A 173 -5.123 24.799 27.003 1.00 49.99 O ATOM 27 OD2 ASP A 173 -6.162 26.734 27.203 1.00 56.19 O ATOM 28 H ASP A 173 -3.866 26.365 24.304 1.00 0.00 H ATOM 29 N LEU A 174 -5.828 25.247 21.799 1.00 31.90 N ATOM 30 CA LEU A 174 -6.411 24.999 20.463 1.00 31.77 C ATOM 31 C LEU A 174 -5.747 23.787 19.822 1.00 33.62 C ATOM 32 O LEU A 174 -6.463 22.898 19.366 1.00 31.34 O ATOM 33 CB LEU A 174 -6.363 26.238 19.546 1.00 31.86 C ATOM 34 CG LEU A 174 -7.096 26.118 18.182 1.00 37.49 C ATOM 35 CD1 LEU A 174 -8.605 25.915 18.369 1.00 38.36 C ATOM 36 CD2 LEU A 174 -6.862 27.348 17.330 1.00 40.73 C ATOM 37 H LEU A 174 -5.230 26.087 21.931 1.00 0.00 H ATOM 38 N TYR A 175 -4.388 23.698 19.892 1.00 30.32 N ATOM 39 CA TYR A 175 -3.627 22.534 19.416 1.00 29.11 C ATOM 40 C TYR A 175 -4.062 21.252 20.129 1.00 31.62 C ATOM 41 O TYR A 175 -4.269 20.234 19.465 1.00 31.01 O ATOM 42 CB TYR A 175 -2.116 22.730 19.601 1.00 29.66 C ATOM 43 CG TYR A 175 -1.314 21.475 19.317 1.00 30.70 C ATOM 44 CD1 TYR A 175 -1.064 21.066 18.013 1.00 32.78 C ATOM 45 CD2 TYR A 175 -0.836 20.677 20.354 1.00 31.94 C ATOM 46 CE1 TYR A 175 -0.343 19.903 17.743 1.00 33.88 C ATOM 47 CE2 TYR A 175 -0.135 19.499 20.096 1.00 32.60 C ATOM 48 CZ TYR A 175 0.117 19.123 18.789 1.00 38.32 C ATOM 49 OH TYR A 175 0.821 17.982 18.526 1.00 41.41 O ATOM 50 HH TYR A 175 0.907 17.867 17.546 1.00 0.00 H ATOM 51 H TYR A 175 -3.863 24.495 20.304 1.00 0.00 H ATOM 52 N ARG A 176 -4.124 21.278 21.476 1.00 27.77 N ATOM 53 CA ARG A 176 -4.510 20.119 22.293 1.00 27.65 C ATOM 54 C ARG A 176 -5.868 19.546 21.913 1.00 29.99 C ATOM 55 O ARG A 176 -5.980 18.332 21.697 1.00 28.06 O ATOM 56 CB ARG A 176 -4.453 20.459 23.788 1.00 30.19 C ATOM 57 CG ARG A 176 -5.037 19.392 24.721 1.00 51.56 C ATOM 58 CD ARG A 176 -3.950 18.511 25.312 1.00 68.28 C ATOM 59 NE ARG A 176 -4.051 18.398 26.770 1.00 79.49 N ATOM 60 CZ ARG A 176 -3.584 19.294 27.636 1.00 88.27 C ATOM 61 NH1 ARG A 176 -2.996 20.404 27.202 1.00 73.67 N ATOM 62 NH2 ARG A 176 -3.721 19.100 28.939 1.00 70.38 N ATOM 63 HE ARG A 176 -4.522 17.555 27.156 1.00 0.00 H ATOM 64 HH12 ARG A 176 -2.633 21.101 27.883 1.00 0.00 H ATOM 65 HH11 ARG A 176 -2.899 20.576 26.181 1.00 0.00 H ATOM 66 HH22 ARG A 176 -3.354 19.804 29.611 1.00 0.00 H ATOM 67 HH21 ARG A 176 -4.196 18.244 29.290 1.00 0.00 H ATOM 68 H ARG A 176 -3.886 22.166 21.963 1.00 0.00 H ATOM 69 N GLN A 177 -6.901 20.411 21.872 1.00 28.00 N ATOM 70 CA GLN A 177 -8.281 20.047 21.525 1.00 26.97 C ATOM 71 C GLN A 177 -8.369 19.539 20.075 1.00 29.36 C ATOM 72 O GLN A 177 -9.012 18.516 19.834 1.00 29.02 O ATOM 73 CB GLN A 177 -9.221 21.248 21.744 1.00 28.37 C ATOM 74 CG GLN A 177 -10.678 20.993 21.323 1.00 28.49 C ATOM 75 CD GLN A 177 -11.578 22.166 21.567 1.00 34.59 C ATOM 76 OE1 GLN A 177 -11.208 23.299 21.322 1.00 30.37 O ATOM 77 NE2 GLN A 177 -12.797 21.920 22.037 1.00 30.09 N ATOM 78 HE22 GLN A 177 -13.089 20.942 22.238 1.00 0.00 H ATOM 79 HE21 GLN A 177 -13.458 22.705 22.203 1.00 0.00 H ATOM 80 H GLN A 177 -6.707 21.406 22.102 1.00 0.00 H ATOM 81 N SER A 178 -7.735 20.250 19.118 1.00 26.82 N ATOM 82 CA SER A 178 -7.721 19.856 17.701 1.00 25.42 C ATOM 83 C SER A 178 -7.047 18.475 17.529 1.00 28.98 C ATOM 84 O SER A 178 -7.554 17.631 16.782 1.00 26.44 O ATOM 85 CB SER A 178 -7.015 20.902 16.845 1.00 26.27 C ATOM 86 OG SER A 178 -7.663 22.160 16.920 1.00 28.24 O ATOM 87 HG SER A 178 -7.665 22.473 17.859 1.00 0.00 H ATOM 88 H SER A 178 -7.233 21.117 19.396 1.00 0.00 H ATOM 89 N LEU A 179 -5.935 18.231 18.258 1.00 24.95 N ATOM 90 CA LEU A 179 -5.229 16.953 18.169 1.00 25.97 C ATOM 91 C LEU A 179 -6.094 15.817 18.707 1.00 28.05 C ATOM 92 O LEU A 179 -6.110 14.753 18.110 1.00 27.00 O ATOM 93 CB LEU A 179 -3.851 16.979 18.880 1.00 26.58 C ATOM 94 CG LEU A 179 -3.054 15.656 18.831 1.00 31.59 C ATOM 95 CD1 LEU A 179 -2.701 15.299 17.427 1.00 32.20 C ATOM 96 CD2 LEU A 179 -1.785 15.728 19.700 1.00 35.85 C ATOM 97 H LEU A 179 -5.573 18.968 18.896 1.00 0.00 H ATOM 98 N GLU A 180 -6.779 16.036 19.834 1.00 25.39 N ATOM 99 CA GLU A 180 -7.651 15.041 20.441 1.00 25.69 C ATOM 100 C GLU A 180 -8.762 14.620 19.450 1.00 29.81 C ATOM 101 O GLU A 180 -8.989 13.433 19.263 1.00 30.53 O ATOM 102 CB GLU A 180 -8.261 15.600 21.733 1.00 27.67 C ATOM 103 CG GLU A 180 -8.898 14.528 22.596 1.00 44.43 C ATOM 104 CD GLU A 180 -8.987 14.805 24.086 1.00 70.90 C ATOM 105 OE1 GLU A 180 -9.148 15.985 24.478 1.00 58.83 O ATOM 106 OE2 GLU A 180 -8.913 13.826 24.863 1.00 69.57 O ATOM 107 H GLU A 180 -6.684 16.961 20.299 1.00 0.00 H ATOM 108 N ILE A 181 -9.431 15.591 18.819 1.00 26.20 N ATOM 109 CA ILE A 181 -10.515 15.352 17.852 1.00 25.19 C ATOM 110 C ILE A 181 -9.973 14.614 16.626 1.00 27.34 C ATOM 111 O ILE A 181 -10.486 13.543 16.265 1.00 28.11 O ATOM 112 CB ILE A 181 -11.221 16.702 17.478 1.00 28.21 C ATOM 113 CG1 ILE A 181 -11.983 17.303 18.688 1.00 28.53 C ATOM 114 CG2 ILE A 181 -12.169 16.535 16.261 1.00 28.66 C ATOM 115 CD1 ILE A 181 -12.146 18.788 18.649 1.00 30.85 C ATOM 116 H ILE A 181 -9.169 16.576 19.024 1.00 0.00 H ATOM 117 N ILE A 182 -8.919 15.169 16.005 1.00 23.63 N ATOM 118 CA ILE A 182 -8.315 14.620 14.782 1.00 23.17 C ATOM 119 C ILE A 182 -7.701 13.226 15.012 1.00 27.91 C ATOM 120 O ILE A 182 -7.979 12.335 14.214 1.00 25.95 O ATOM 121 CB ILE A 182 -7.324 15.624 14.117 1.00 25.85 C ATOM 122 CG1 ILE A 182 -8.086 16.894 13.659 1.00 26.13 C ATOM 123 CG2 ILE A 182 -6.553 14.990 12.937 1.00 26.24 C ATOM 124 CD1 ILE A 182 -7.186 18.162 13.374 1.00 27.92 C ATOM 125 H ILE A 182 -8.508 16.034 16.411 1.00 0.00 H ATOM 126 N SER A 183 -6.882 13.021 16.089 1.00 24.96 N ATOM 127 CA SER A 183 -6.315 11.689 16.318 1.00 25.45 C ATOM 128 C SER A 183 -7.396 10.652 16.623 1.00 27.58 C ATOM 129 O SER A 183 -7.264 9.530 16.152 1.00 27.28 O ATOM 130 CB SER A 183 -5.241 11.688 17.407 1.00 32.53 C ATOM 131 OG SER A 183 -5.791 12.052 18.661 1.00 46.05 O ATOM 132 HG SER A 183 -6.180 12.960 18.598 1.00 0.00 H ATOM 133 H SER A 183 -6.664 13.803 16.739 1.00 0.00 H ATOM 134 N ARG A 184 -8.464 11.013 17.367 1.00 25.17 N ATOM 135 CA ARG A 184 -9.563 10.068 17.636 1.00 25.12 C ATOM 136 C ARG A 184 -10.253 9.629 16.340 1.00 29.38 C ATOM 137 O ARG A 184 -10.514 8.444 16.155 1.00 29.23 O ATOM 138 CB ARG A 184 -10.593 10.657 18.597 1.00 25.83 C ATOM 139 CG ARG A 184 -10.215 10.419 20.052 1.00 34.59 C ATOM 140 CD ARG A 184 -11.129 11.130 21.012 1.00 43.47 C ATOM 141 NE ARG A 184 -10.501 11.238 22.332 1.00 55.91 N ATOM 142 CZ ARG A 184 -10.864 10.540 23.404 1.00 65.13 C ATOM 143 NH1 ARG A 184 -11.885 9.691 23.341 1.00 44.56 N ATOM 144 NH2 ARG A 184 -10.224 10.702 24.554 1.00 48.66 N ATOM 145 HE ARG A 184 -9.714 11.910 22.438 1.00 0.00 H ATOM 146 HH12 ARG A 184 -12.163 9.149 24.184 1.00 0.00 H ATOM 147 HH11 ARG A 184 -12.406 9.569 22.449 1.00 0.00 H ATOM 148 HH22 ARG A 184 -10.511 10.154 25.390 1.00 0.00 H ATOM 149 HH21 ARG A 184 -9.435 11.377 24.620 1.00 0.00 H ATOM 150 H ARG A 184 -8.512 11.976 17.757 1.00 0.00 H ATOM 151 N TYR A 185 -10.533 10.580 15.428 1.00 25.60 N ATOM 152 CA TYR A 185 -11.177 10.223 14.153 1.00 23.85 C ATOM 153 C TYR A 185 -10.298 9.301 13.283 1.00 27.10 C ATOM 154 O TYR A 185 -10.804 8.296 12.791 1.00 26.73 O ATOM 155 CB TYR A 185 -11.602 11.490 13.384 1.00 23.85 C ATOM 156 CG TYR A 185 -12.408 11.207 12.124 1.00 25.27 C ATOM 157 CD1 TYR A 185 -13.619 10.519 12.185 1.00 27.37 C ATOM 158 CD2 TYR A 185 -11.980 11.665 10.882 1.00 25.95 C ATOM 159 CE1 TYR A 185 -14.354 10.239 11.031 1.00 27.96 C ATOM 160 CE2 TYR A 185 -12.713 11.404 9.719 1.00 27.56 C ATOM 161 CZ TYR A 185 -13.901 10.691 9.801 1.00 31.08 C ATOM 162 OH TYR A 185 -14.633 10.440 8.665 1.00 30.71 O ATOM 163 HH TYR A 185 -15.444 9.924 8.903 1.00 0.00 H ATOM 164 H TYR A 185 -10.293 11.572 15.626 1.00 0.00 H ATOM 165 N LEU A 186 -9.003 9.631 13.092 1.00 23.37 N ATOM 166 CA LEU A 186 -8.079 8.843 12.273 1.00 23.52 C ATOM 167 C LEU A 186 -7.868 7.421 12.835 1.00 30.64 C ATOM 168 O LEU A 186 -7.875 6.449 12.076 1.00 28.53 O ATOM 169 CB LEU A 186 -6.712 9.570 12.098 1.00 22.99 C ATOM 170 CG LEU A 186 -6.572 10.483 10.867 1.00 27.13 C ATOM 171 CD1 LEU A 186 -7.644 11.616 10.846 1.00 26.62 C ATOM 172 CD2 LEU A 186 -5.166 11.097 10.782 1.00 26.97 C ATOM 173 H LEU A 186 -8.642 10.491 13.551 1.00 0.00 H ATOM 174 N ARG A 187 -7.702 7.319 14.164 1.00 29.83 N ATOM 175 CA ARG A 187 -7.487 6.048 14.859 1.00 30.63 C ATOM 176 C ARG A 187 -8.712 5.123 14.733 1.00 33.86 C ATOM 177 O ARG A 187 -8.536 3.970 14.351 1.00 33.04 O ATOM 178 CB ARG A 187 -7.119 6.282 16.340 1.00 29.90 C ATOM 179 CG ARG A 187 -5.672 6.759 16.542 1.00 45.42 C ATOM 180 CD ARG A 187 -5.254 6.926 18.003 1.00 50.58 C ATOM 181 NE ARG A 187 -6.400 7.098 18.899 1.00 64.36 N ATOM 182 CZ ARG A 187 -6.597 8.147 19.690 1.00 81.31 C ATOM 183 NH1 ARG A 187 -5.705 9.129 19.738 1.00 71.78 N ATOM 184 NH2 ARG A 187 -7.676 8.214 20.453 1.00 67.20 N ATOM 185 HE ARG A 187 -7.114 6.342 18.917 1.00 0.00 H ATOM 186 HH12 ARG A 187 -5.865 9.947 20.359 1.00 0.00 H ATOM 187 HH11 ARG A 187 -4.846 9.080 19.154 1.00 0.00 H ATOM 188 HH22 ARG A 187 -7.826 9.037 21.071 1.00 0.00 H ATOM 189 HH21 ARG A 187 -8.374 7.443 20.435 1.00 0.00 H ATOM 190 H ARG A 187 -7.728 8.191 14.731 1.00 0.00 H ATOM 191 N GLU A 188 -9.936 5.631 15.010 1.00 29.46 N ATOM 192 CA GLU A 188 -11.152 4.816 14.910 1.00 30.33 C ATOM 193 C GLU A 188 -11.498 4.462 13.455 1.00 34.48 C ATOM 194 O GLU A 188 -12.082 3.410 13.220 1.00 34.17 O ATOM 195 CB GLU A 188 -12.346 5.446 15.666 1.00 31.91 C ATOM 196 CG GLU A 188 -13.025 6.611 14.963 1.00 39.64 C ATOM 197 CD GLU A 188 -14.164 7.294 15.694 1.00 53.34 C ATOM 198 OE1 GLU A 188 -14.979 7.946 15.004 1.00 55.46 O ATOM 199 OE2 GLU A 188 -14.242 7.203 16.941 1.00 41.43 O ATOM 200 H GLU A 188 -10.017 6.626 15.302 1.00 0.00 H ATOM 201 N GLN A 189 -11.089 5.297 12.474 1.00 30.57 N ATOM 202 CA GLN A 189 -11.332 5.008 11.052 1.00 29.70 C ATOM 203 C GLN A 189 -10.444 3.868 10.602 1.00 33.30 C ATOM 204 O GLN A 189 -10.876 3.033 9.812 1.00 31.45 O ATOM 205 CB GLN A 189 -11.089 6.249 10.175 1.00 30.06 C ATOM 206 CG GLN A 189 -12.209 7.278 10.281 1.00 23.55 C ATOM 207 CD GLN A 189 -13.367 6.953 9.372 1.00 36.45 C ATOM 208 OE1 GLN A 189 -13.213 6.850 8.161 1.00 33.94 O ATOM 209 NE2 GLN A 189 -14.551 6.782 9.939 1.00 28.88 N ATOM 210 HE22 GLN A 189 -14.652 6.876 10.970 1.00 0.00 H ATOM 211 HE21 GLN A 189 -15.380 6.554 9.354 1.00 0.00 H ATOM 212 H GLN A 189 -10.587 6.171 12.732 1.00 0.00 H ATOM 213 N ALA A 190 -9.207 3.824 11.109 1.00 30.69 N ATOM 214 CA ALA A 190 -8.270 2.768 10.751 1.00 32.44 C ATOM 215 C ALA A 190 -8.586 1.465 11.495 1.00 39.42 C ATOM 216 O ALA A 190 -8.591 0.412 10.868 1.00 39.95 O ATOM 217 CB ALA A 190 -6.841 3.209 11.035 1.00 33.33 C ATOM 218 H ALA A 190 -8.906 4.563 11.776 1.00 0.00 H ATOM 219 N THR A 191 -8.875 1.535 12.810 1.00 38.16 N ATOM 220 CA THR A 191 -9.149 0.337 13.630 1.00 39.01 C ATOM 221 C THR A 191 -10.582 -0.214 13.524 1.00 45.41 C ATOM 222 O THR A 191 -10.785 -1.413 13.717 1.00 45.88 O ATOM 223 CB THR A 191 -8.809 0.584 15.108 1.00 42.99 C ATOM 224 OG1 THR A 191 -9.707 1.557 15.637 1.00 43.82 O ATOM 225 CG2 THR A 191 -7.363 1.006 15.327 1.00 43.02 C ATOM 226 HG1 THR A 191 -9.615 2.401 15.128 1.00 0.00 H ATOM 227 H THR A 191 -8.906 2.470 13.265 1.00 0.00 H ATOM 228 N GLY A 192 -11.551 0.671 13.289 1.00 42.34 N ATOM 229 CA GLY A 192 -12.971 0.330 13.245 1.00 42.57 C ATOM 230 C GLY A 192 -13.584 0.314 14.636 1.00 47.44 C ATOM 231 O GLY A 192 -14.703 -0.175 14.814 1.00 45.90 O ATOM 232 H GLY A 192 -11.280 1.662 13.128 1.00 0.00 H ATOM 233 N ALA A 193 -12.856 0.860 15.639 1.00 45.51 N ATOM 234 CA ALA A 193 -13.303 0.899 17.033 1.00 46.31 C ATOM 235 C ALA A 193 -13.062 2.251 17.702 1.00 52.10 C ATOM 236 O ALA A 193 -11.946 2.776 17.658 1.00 51.00 O ATOM 237 CB ALA A 193 -12.622 -0.207 17.829 1.00 47.09 C ATOM 238 H ALA A 193 -11.930 1.274 15.407 1.00 0.00 H ATOM 239 N LYS A 194 -14.113 2.796 18.342 1.00 50.84 N ATOM 240 CA LYS A 194 -14.088 4.071 19.065 1.00 51.71 C ATOM 241 C LYS A 194 -13.260 3.969 20.359 1.00 58.88 C ATOM 242 O LYS A 194 -13.153 2.883 20.938 1.00 59.19 O ATOM 243 CB LYS A 194 -15.520 4.529 19.387 1.00 53.70 C ATOM 244 CG LYS A 194 -16.356 4.861 18.156 1.00 63.26 C ATOM 245 CD LYS A 194 -17.827 5.011 18.491 1.00 72.31 C ATOM 246 CE LYS A 194 -18.671 5.081 17.243 1.00 84.50 C ATOM 247 NZ LYS A 194 -20.124 5.042 17.556 1.00 94.08 N ATOM 248 HZ1 LYS A 194 -20.347 4.156 18.052 1.00 0.00 H ATOM 249 HZ2 LYS A 194 -20.369 5.851 18.162 1.00 0.00 H ATOM 250 HZ3 LYS A 194 -20.669 5.092 16.672 1.00 0.00 H ATOM 251 H LYS A 194 -15.012 2.273 18.322 1.00 0.00 H ATOM 252 N ASP A 195 -12.669 5.099 20.802 1.00 56.40 N ATOM 253 CA ASP A 195 -11.862 5.192 22.025 1.00 56.54 C ATOM 254 C ASP A 195 -12.760 5.629 23.179 1.00 61.37 C ATOM 255 O ASP A 195 -13.387 6.687 23.110 1.00 60.65 O ATOM 256 CB ASP A 195 -10.690 6.180 21.832 1.00 58.57 C ATOM 257 CG ASP A 195 -9.589 6.158 22.887 1.00 68.61 C ATOM 258 OD1 ASP A 195 -9.745 5.447 23.902 1.00 69.59 O ATOM 259 OD2 ASP A 195 -8.572 6.850 22.694 1.00 73.77 O ATOM 260 H ASP A 195 -12.794 5.964 20.238 1.00 0.00 H ATOM 261 N THR A 196 -12.837 4.797 24.233 1.00 59.51 N ATOM 262 CA THR A 196 -13.678 5.053 25.409 1.00 59.68 C ATOM 263 C THR A 196 -13.028 6.008 26.408 1.00 63.57 C ATOM 264 O THR A 196 -13.718 6.506 27.301 1.00 63.59 O ATOM 265 CB THR A 196 -14.118 3.738 26.072 1.00 69.83 C ATOM 266 OG1 THR A 196 -12.970 2.920 26.310 1.00 69.83 O ATOM 267 CG2 THR A 196 -15.166 2.986 25.253 1.00 68.02 C ATOM 268 HG1 THR A 196 -13.253 2.073 26.737 1.00 0.00 H ATOM 269 H THR A 196 -12.270 3.925 24.214 1.00 0.00 H ATOM 270 N LYS A 197 -11.712 6.268 26.255 1.00 60.09 N ATOM 271 CA LYS A 197 -10.941 7.166 27.119 1.00 59.59 C ATOM 272 C LYS A 197 -11.569 8.561 27.150 1.00 62.05 C ATOM 273 O LYS A 197 -11.945 9.080 26.093 1.00 61.83 O ATOM 274 CB LYS A 197 -9.462 7.214 26.704 1.00 62.43 C ATOM 275 CG LYS A 197 -8.698 5.966 27.136 1.00 84.80 C ATOM 276 CD LYS A 197 -7.315 5.876 26.517 1.00 98.05 C ATOM 277 CE LYS A 197 -6.652 4.560 26.847 1.00110.74 C ATOM 278 NZ LYS A 197 -5.341 4.409 26.161 1.00120.11 N ATOM 279 HZ1 LYS A 197 -5.483 4.453 25.132 1.00 0.00 H ATOM 280 HZ2 LYS A 197 -4.705 5.177 26.458 1.00 0.00 H ATOM 281 HZ3 LYS A 197 -4.921 3.492 26.416 1.00 0.00 H ATOM 282 H LYS A 197 -11.212 5.800 25.472 1.00 0.00 H ATOM 283 N PRO A 198 -11.785 9.141 28.354 1.00 56.65 N ATOM 284 CA PRO A 198 -12.451 10.453 28.424 1.00 55.08 C ATOM 285 C PRO A 198 -11.695 11.584 27.734 1.00 54.58 C ATOM 286 O PRO A 198 -10.463 11.546 27.620 1.00 53.65 O ATOM 287 CB PRO A 198 -12.589 10.703 29.932 1.00 56.98 C ATOM 288 CG PRO A 198 -11.525 9.874 30.553 1.00 61.81 C ATOM 289 CD PRO A 198 -11.450 8.641 29.704 1.00 57.78 C ATOM 290 N MET A 199 -12.456 12.582 27.259 1.00 47.48 N ATOM 291 CA MET A 199 -11.918 13.765 26.607 1.00 45.81 C ATOM 292 C MET A 199 -11.348 14.686 27.687 1.00 49.52 C ATOM 293 O MET A 199 -11.896 14.744 28.794 1.00 50.19 O ATOM 294 CB MET A 199 -13.028 14.507 25.852 1.00 47.22 C ATOM 295 CG MET A 199 -13.498 13.805 24.605 1.00 49.35 C ATOM 296 SD MET A 199 -12.419 14.071 23.186 1.00 51.13 S ATOM 297 CE MET A 199 -13.583 13.704 21.892 1.00 47.65 C ATOM 298 H MET A 199 -13.488 12.505 27.363 1.00 0.00 H ATOM 299 N GLY A 200 -10.295 15.425 27.341 1.00 44.13 N ATOM 300 CA GLY A 200 -9.666 16.391 28.238 1.00 43.23 C ATOM 301 C GLY A 200 -10.456 17.680 28.318 1.00 46.18 C ATOM 302 O GLY A 200 -11.686 17.648 28.228 1.00 46.64 O ATOM 303 H GLY A 200 -9.902 15.308 26.385 1.00 0.00 H ATOM 304 N ARG A 201 -9.748 18.831 28.477 1.00 41.06 N ATOM 305 CA ARG A 201 -10.314 20.186 28.555 1.00 40.14 C ATOM 306 C ARG A 201 -11.248 20.459 27.365 1.00 42.64 C ATOM 307 O ARG A 201 -10.911 20.095 26.230 1.00 41.07 O ATOM 308 CB ARG A 201 -9.181 21.235 28.601 1.00 39.75 C ATOM 309 CG ARG A 201 -9.640 22.678 28.830 1.00 48.62 C ATOM 310 CD ARG A 201 -8.517 23.667 28.573 1.00 58.30 C ATOM 311 NE ARG A 201 -9.004 24.992 28.172 1.00 65.77 N ATOM 312 CZ ARG A 201 -9.389 25.322 26.938 1.00 76.84 C ATOM 313 NH1 ARG A 201 -9.803 26.554 26.674 1.00 63.39 N ATOM 314 NH2 ARG A 201 -9.381 24.416 25.965 1.00 57.58 N ATOM 315 HE ARG A 201 -9.053 25.729 28.904 1.00 0.00 H ATOM 316 HH12 ARG A 201 -10.102 26.807 25.711 1.00 0.00 H ATOM 317 HH11 ARG A 201 -9.828 27.267 27.430 1.00 0.00 H ATOM 318 HH22 ARG A 201 -9.683 24.681 25.006 1.00 0.00 H ATOM 319 HH21 ARG A 201 -9.073 23.443 26.163 1.00 0.00 H ATOM 320 H ARG A 201 -8.714 18.745 28.550 1.00 0.00 H ATOM 321 N SER A 202 -12.417 21.092 27.638 1.00 38.72 N ATOM 322 CA SER A 202 -13.474 21.432 26.665 1.00 38.16 C ATOM 323 C SER A 202 -13.993 20.166 25.956 1.00 41.07 C ATOM 324 O SER A 202 -14.172 20.154 24.732 1.00 40.22 O ATOM 325 CB SER A 202 -12.985 22.474 25.658 1.00 41.95 C ATOM 326 OG SER A 202 -12.333 23.563 26.289 1.00 48.69 O ATOM 327 HG SER A 202 -12.034 24.210 25.602 1.00 0.00 H ATOM 328 H SER A 202 -12.584 21.364 28.628 1.00 0.00 H ATOM 329 N GLY A 203 -14.229 19.124 26.758 1.00 37.31 N ATOM 330 CA GLY A 203 -14.684 17.807 26.320 1.00 37.11 C ATOM 331 C GLY A 203 -16.032 17.772 25.633 1.00 40.75 C ATOM 332 O GLY A 203 -16.198 17.015 24.674 1.00 40.11 O ATOM 333 H GLY A 203 -14.076 19.262 27.777 1.00 0.00 H ATOM 334 N ALA A 204 -17.010 18.572 26.129 1.00 36.70 N ATOM 335 CA ALA A 204 -18.371 18.635 25.588 1.00 36.73 C ATOM 336 C ALA A 204 -18.371 19.126 24.130 1.00 40.24 C ATOM 337 O ALA A 204 -19.067 18.541 23.302 1.00 40.57 O ATOM 338 CB ALA A 204 -19.250 19.525 26.456 1.00 37.66 C ATOM 339 H ALA A 204 -16.780 19.177 26.943 1.00 0.00 H ATOM 340 N THR A 205 -17.564 20.168 23.818 1.00 34.79 N ATOM 341 CA THR A 205 -17.394 20.695 22.458 1.00 34.61 C ATOM 342 C THR A 205 -16.666 19.638 21.597 1.00 36.38 C ATOM 343 O THR A 205 -17.099 19.370 20.472 1.00 35.98 O ATOM 344 CB THR A 205 -16.605 22.011 22.507 1.00 42.95 C ATOM 345 OG1 THR A 205 -17.352 22.971 23.264 1.00 42.00 O ATOM 346 CG2 THR A 205 -16.270 22.556 21.110 1.00 41.44 C ATOM 347 HG1 THR A 205 -18.229 23.122 22.830 1.00 0.00 H ATOM 348 H THR A 205 -17.033 20.622 24.588 1.00 0.00 H ATOM 349 N SER A 206 -15.572 19.041 22.138 1.00 30.93 N ATOM 350 CA SER A 206 -14.773 18.001 21.460 1.00 29.67 C ATOM 351 C SER A 206 -15.616 16.797 21.054 1.00 32.19 C ATOM 352 O SER A 206 -15.451 16.285 19.932 1.00 29.21 O ATOM 353 CB SER A 206 -13.599 17.567 22.329 1.00 32.28 C ATOM 354 OG SER A 206 -12.697 18.651 22.468 1.00 39.35 O ATOM 355 HG SER A 206 -11.933 18.373 23.032 1.00 0.00 H ATOM 356 H SER A 206 -15.278 19.336 23.091 1.00 0.00 H ATOM 357 N ARG A 207 -16.544 16.355 21.953 1.00 29.55 N ATOM 358 CA ARG A 207 -17.453 15.232 21.662 1.00 29.62 C ATOM 359 C ARG A 207 -18.405 15.574 20.528 1.00 31.39 C ATOM 360 O ARG A 207 -18.617 14.740 19.666 1.00 31.23 O ATOM 361 CB ARG A 207 -18.251 14.786 22.907 1.00 30.17 C ATOM 362 CG ARG A 207 -17.419 13.934 23.867 1.00 44.44 C ATOM 363 CD ARG A 207 -18.215 13.434 25.070 1.00 53.22 C ATOM 364 NE ARG A 207 -18.555 14.507 26.012 1.00 55.52 N ATOM 365 CZ ARG A 207 -17.785 14.896 27.024 1.00 65.16 C ATOM 366 NH1 ARG A 207 -16.613 14.311 27.240 1.00 50.99 N ATOM 367 NH2 ARG A 207 -18.180 15.875 27.826 1.00 50.14 N ATOM 368 HE ARG A 207 -19.462 14.998 25.879 1.00 0.00 H ATOM 369 HH12 ARG A 207 -16.016 14.620 28.033 1.00 0.00 H ATOM 370 HH11 ARG A 207 -16.292 13.543 26.616 1.00 0.00 H ATOM 371 HH22 ARG A 207 -17.575 16.176 28.616 1.00 0.00 H ATOM 372 HH21 ARG A 207 -19.095 16.342 27.665 1.00 0.00 H ATOM 373 H ARG A 207 -16.612 16.828 22.877 1.00 0.00 H ATOM 374 N LYS A 208 -18.969 16.787 20.526 1.00 29.50 N ATOM 375 CA LYS A 208 -19.893 17.253 19.477 1.00 29.87 C ATOM 376 C LYS A 208 -19.135 17.386 18.152 1.00 32.93 C ATOM 377 O LYS A 208 -19.664 17.030 17.104 1.00 32.95 O ATOM 378 CB LYS A 208 -20.491 18.619 19.851 1.00 32.41 C ATOM 379 CG LYS A 208 -21.565 18.576 20.925 1.00 41.00 C ATOM 380 CD LYS A 208 -22.139 19.984 21.189 1.00 50.62 C ATOM 381 CE LYS A 208 -21.308 20.818 22.143 1.00 59.53 C ATOM 382 NZ LYS A 208 -22.055 21.996 22.659 1.00 64.67 N ATOM 383 HZ1 LYS A 208 -22.338 22.602 21.862 1.00 0.00 H ATOM 384 HZ2 LYS A 208 -22.902 21.672 23.167 1.00 0.00 H ATOM 385 HZ3 LYS A 208 -21.445 22.535 23.307 1.00 0.00 H ATOM 386 H LYS A 208 -18.743 17.436 21.307 1.00 0.00 H ATOM 387 N ALA A 209 -17.889 17.884 18.208 1.00 30.01 N ATOM 388 CA ALA A 209 -17.023 18.029 17.031 1.00 29.46 C ATOM 389 C ALA A 209 -16.704 16.658 16.442 1.00 30.84 C ATOM 390 O ALA A 209 -16.843 16.484 15.230 1.00 28.98 O ATOM 391 CB ALA A 209 -15.748 18.777 17.395 1.00 30.25 C ATOM 392 H ALA A 209 -17.518 18.182 19.133 1.00 0.00 H ATOM 393 N LEU A 210 -16.342 15.664 17.291 1.00 26.69 N ATOM 394 CA LEU A 210 -16.061 14.313 16.790 1.00 26.38 C ATOM 395 C LEU A 210 -17.311 13.694 16.141 1.00 29.42 C ATOM 396 O LEU A 210 -17.189 13.064 15.100 1.00 27.61 O ATOM 397 CB LEU A 210 -15.458 13.397 17.881 1.00 26.19 C ATOM 398 CG LEU A 210 -15.046 11.970 17.445 1.00 30.20 C ATOM 399 CD1 LEU A 210 -14.063 11.994 16.261 1.00 30.33 C ATOM 400 CD2 LEU A 210 -14.462 11.186 18.621 1.00 32.32 C ATOM 401 H LEU A 210 -16.263 15.861 18.309 1.00 0.00 H ATOM 402 N GLU A 211 -18.508 13.907 16.732 1.00 28.57 N ATOM 403 CA GLU A 211 -19.774 13.416 16.167 1.00 28.88 C ATOM 404 C GLU A 211 -20.047 14.048 14.804 1.00 30.69 C ATOM 405 O GLU A 211 -20.450 13.345 13.887 1.00 29.19 O ATOM 406 CB GLU A 211 -20.957 13.657 17.124 1.00 31.07 C ATOM 407 CG GLU A 211 -20.928 12.697 18.313 1.00 46.85 C ATOM 408 CD GLU A 211 -21.779 13.004 19.535 1.00 70.49 C ATOM 409 OE1 GLU A 211 -22.318 14.130 19.642 1.00 71.54 O ATOM 410 OE2 GLU A 211 -21.890 12.108 20.403 1.00 63.35 O ATOM 411 H GLU A 211 -18.535 14.441 17.624 1.00 0.00 H ATOM 412 N THR A 212 -19.823 15.363 14.673 1.00 28.12 N ATOM 413 CA THR A 212 -20.003 16.094 13.408 1.00 28.02 C ATOM 414 C THR A 212 -18.990 15.558 12.379 1.00 31.00 C ATOM 415 O THR A 212 -19.384 15.237 11.263 1.00 30.80 O ATOM 416 CB THR A 212 -19.896 17.610 13.654 1.00 34.11 C ATOM 417 OG1 THR A 212 -20.961 17.990 14.522 1.00 33.89 O ATOM 418 CG2 THR A 212 -19.996 18.427 12.369 1.00 32.29 C ATOM 419 HG1 THR A 212 -20.880 17.497 15.377 1.00 0.00 H ATOM 420 H THR A 212 -19.505 15.895 15.509 1.00 0.00 H ATOM 421 N LEU A 213 -17.705 15.413 12.783 1.00 26.44 N ATOM 422 CA LEU A 213 -16.626 14.887 11.935 1.00 26.27 C ATOM 423 C LEU A 213 -16.964 13.525 11.389 1.00 30.88 C ATOM 424 O LEU A 213 -16.684 13.283 10.223 1.00 31.38 O ATOM 425 CB LEU A 213 -15.314 14.772 12.717 1.00 25.56 C ATOM 426 CG LEU A 213 -14.066 15.439 12.182 1.00 28.30 C ATOM 427 CD1 LEU A 213 -12.835 14.869 12.892 1.00 26.28 C ATOM 428 CD2 LEU A 213 -13.907 15.309 10.629 1.00 27.62 C ATOM 429 H LEU A 213 -17.467 15.692 13.756 1.00 0.00 H ATOM 430 N ARG A 214 -17.545 12.622 12.217 1.00 27.71 N ATOM 431 CA ARG A 214 -17.943 11.286 11.755 1.00 28.04 C ATOM 432 C ARG A 214 -18.999 11.417 10.672 1.00 31.26 C ATOM 433 O ARG A 214 -18.832 10.844 9.606 1.00 31.29 O ATOM 434 CB ARG A 214 -18.516 10.428 12.894 1.00 29.68 C ATOM 435 CG ARG A 214 -17.511 9.984 13.933 1.00 33.14 C ATOM 436 CD ARG A 214 -18.265 9.327 15.074 1.00 34.13 C ATOM 437 NE ARG A 214 -17.358 8.788 16.083 1.00 41.12 N ATOM 438 CZ ARG A 214 -17.468 8.995 17.390 1.00 52.46 C ATOM 439 NH1 ARG A 214 -18.463 9.733 17.872 1.00 39.90 N ATOM 440 NH2 ARG A 214 -16.587 8.466 18.227 1.00 36.21 N ATOM 441 HE ARG A 214 -16.567 8.198 15.754 1.00 0.00 H ATOM 442 HH12 ARG A 214 -18.544 9.891 18.897 1.00 0.00 H ATOM 443 HH11 ARG A 214 -19.161 10.152 17.224 1.00 0.00 H ATOM 444 HH22 ARG A 214 -16.677 8.631 19.250 1.00 0.00 H ATOM 445 HH21 ARG A 214 -15.805 7.886 17.861 1.00 0.00 H ATOM 446 H ARG A 214 -17.714 12.883 13.209 1.00 0.00 H ATOM 447 N ARG A 215 -20.076 12.178 10.937 1.00 27.80 N ATOM 448 CA ARG A 215 -21.168 12.379 9.970 1.00 27.53 C ATOM 449 C ARG A 215 -20.661 12.998 8.637 1.00 30.47 C ATOM 450 O ARG A 215 -20.809 12.388 7.571 1.00 30.68 O ATOM 451 CB ARG A 215 -22.276 13.246 10.611 1.00 29.57 C ATOM 452 CG ARG A 215 -23.436 13.626 9.664 1.00 33.29 C ATOM 453 CD ARG A 215 -24.586 14.347 10.377 1.00 36.90 C ATOM 454 NE ARG A 215 -24.190 15.605 11.038 1.00 34.84 N ATOM 455 CZ ARG A 215 -24.094 16.783 10.432 1.00 49.69 C ATOM 456 NH1 ARG A 215 -24.316 16.889 9.127 1.00 38.04 N ATOM 457 NH2 ARG A 215 -23.758 17.863 11.121 1.00 47.25 N ATOM 458 HE ARG A 215 -23.970 15.567 12.054 1.00 0.00 H ATOM 459 HH12 ARG A 215 -24.239 17.815 8.660 1.00 0.00 H ATOM 460 HH11 ARG A 215 -24.567 16.046 8.572 1.00 0.00 H ATOM 461 HH22 ARG A 215 -23.684 18.783 10.642 1.00 0.00 H ATOM 462 HH21 ARG A 215 -23.568 17.791 12.141 1.00 0.00 H ATOM 463 H ARG A 215 -20.140 12.644 11.864 1.00 0.00 H ATOM 464 N VAL A 216 -20.053 14.186 8.708 1.00 26.53 N ATOM 465 CA VAL A 216 -19.563 14.907 7.522 1.00 26.07 C ATOM 466 C VAL A 216 -18.385 14.174 6.835 1.00 29.84 C ATOM 467 O VAL A 216 -18.411 13.964 5.615 1.00 29.19 O ATOM 468 CB VAL A 216 -19.242 16.395 7.833 1.00 29.43 C ATOM 469 CG1 VAL A 216 -18.902 17.163 6.555 1.00 28.78 C ATOM 470 CG2 VAL A 216 -20.407 17.072 8.569 1.00 29.27 C ATOM 471 H VAL A 216 -19.920 14.621 9.643 1.00 0.00 H ATOM 472 N GLY A 217 -17.377 13.799 7.624 1.00 26.15 N ATOM 473 CA GLY A 217 -16.165 13.135 7.152 1.00 25.91 C ATOM 474 C GLY A 217 -16.390 11.816 6.448 1.00 28.46 C ATOM 475 O GLY A 217 -15.726 11.543 5.447 1.00 27.24 O ATOM 476 H GLY A 217 -17.460 13.992 8.643 1.00 0.00 H ATOM 477 N ASP A 218 -17.314 10.979 6.964 1.00 25.48 N ATOM 478 CA ASP A 218 -17.630 9.716 6.291 1.00 25.61 C ATOM 479 C ASP A 218 -18.276 9.994 4.932 1.00 30.03 C ATOM 480 O ASP A 218 -18.002 9.269 3.986 1.00 29.40 O ATOM 481 CB ASP A 218 -18.539 8.813 7.137 1.00 28.25 C ATOM 482 CG ASP A 218 -17.931 8.251 8.425 1.00 39.46 C ATOM 483 OD1 ASP A 218 -16.752 8.599 8.750 1.00 37.38 O ATOM 484 OD2 ASP A 218 -18.635 7.505 9.124 1.00 47.02 O ATOM 485 H ASP A 218 -17.805 11.232 7.845 1.00 0.00 H ATOM 486 N GLY A 219 -19.106 11.044 4.845 1.00 27.80 N ATOM 487 CA GLY A 219 -19.744 11.453 3.593 1.00 27.11 C ATOM 488 C GLY A 219 -18.754 11.984 2.569 1.00 29.88 C ATOM 489 O GLY A 219 -18.859 11.663 1.375 1.00 29.31 O ATOM 490 H GLY A 219 -19.305 11.592 5.706 1.00 0.00 H ATOM 491 N VAL A 220 -17.786 12.822 3.018 1.00 25.43 N ATOM 492 CA VAL A 220 -16.708 13.365 2.162 1.00 24.12 C ATOM 493 C VAL A 220 -15.901 12.206 1.533 1.00 26.96 C ATOM 494 O VAL A 220 -15.613 12.241 0.335 1.00 26.26 O ATOM 495 CB VAL A 220 -15.779 14.350 2.932 1.00 27.76 C ATOM 496 CG1 VAL A 220 -14.515 14.672 2.132 1.00 27.77 C ATOM 497 CG2 VAL A 220 -16.515 15.633 3.306 1.00 27.59 C ATOM 498 H VAL A 220 -17.803 13.098 4.020 1.00 0.00 H ATOM 499 N GLN A 221 -15.538 11.190 2.336 1.00 22.78 N ATOM 500 CA GLN A 221 -14.765 10.044 1.825 1.00 23.96 C ATOM 501 C GLN A 221 -15.535 9.240 0.773 1.00 29.83 C ATOM 502 O GLN A 221 -14.932 8.790 -0.197 1.00 30.84 O ATOM 503 CB GLN A 221 -14.296 9.137 2.965 1.00 24.80 C ATOM 504 CG GLN A 221 -13.279 9.816 3.887 1.00 25.82 C ATOM 505 CD GLN A 221 -12.877 8.878 4.980 1.00 33.87 C ATOM 506 OE1 GLN A 221 -12.160 7.919 4.736 1.00 29.17 O ATOM 507 NE2 GLN A 221 -13.360 9.111 6.201 1.00 28.10 N ATOM 508 HE22 GLN A 221 -13.967 9.938 6.371 1.00 0.00 H ATOM 509 HE21 GLN A 221 -13.129 8.466 6.983 1.00 0.00 H ATOM 510 H GLN A 221 -15.809 11.214 3.340 1.00 0.00 H ATOM 511 N ARG A 222 -16.860 9.098 0.947 1.00 28.95 N ATOM 512 CA ARG A 222 -17.739 8.414 -0.016 1.00 29.58 C ATOM 513 C ARG A 222 -17.877 9.256 -1.297 1.00 34.35 C ATOM 514 O ARG A 222 -17.616 8.758 -2.394 1.00 34.27 O ATOM 515 CB ARG A 222 -19.140 8.169 0.581 1.00 30.21 C ATOM 516 CG ARG A 222 -19.201 7.091 1.677 1.00 39.90 C ATOM 517 CD ARG A 222 -20.643 6.686 2.021 1.00 43.81 C ATOM 518 NE ARG A 222 -21.412 7.759 2.662 1.00 42.90 N ATOM 519 CZ ARG A 222 -21.513 7.932 3.980 1.00 59.93 C ATOM 520 NH1 ARG A 222 -20.909 7.098 4.815 1.00 53.60 N ATOM 521 NH2 ARG A 222 -22.222 8.940 4.470 1.00 43.56 N ATOM 522 HE ARG A 222 -21.913 8.431 2.046 1.00 0.00 H ATOM 523 HH12 ARG A 222 -20.992 7.239 5.842 1.00 0.00 H ATOM 524 HH11 ARG A 222 -20.352 6.302 4.443 1.00 0.00 H ATOM 525 HH22 ARG A 222 -22.298 9.071 5.499 1.00 0.00 H ATOM 526 HH21 ARG A 222 -22.702 9.600 3.825 1.00 0.00 H ATOM 527 H ARG A 222 -17.288 9.493 1.809 1.00 0.00 H ATOM 528 N ASN A 223 -18.254 10.537 -1.152 1.00 32.28 N ATOM 529 CA ASN A 223 -18.491 11.429 -2.294 1.00 32.55 C ATOM 530 C ASN A 223 -17.247 11.794 -3.096 1.00 35.86 C ATOM 531 O ASN A 223 -17.372 12.056 -4.290 1.00 35.84 O ATOM 532 CB ASN A 223 -19.232 12.703 -1.859 1.00 32.02 C ATOM 533 CG ASN A 223 -20.601 12.487 -1.253 1.00 41.90 C ATOM 534 OD1 ASN A 223 -21.076 13.294 -0.468 1.00 40.90 O ATOM 535 ND2 ASN A 223 -21.271 11.402 -1.577 1.00 31.56 N ATOM 536 HD22 ASN A 223 -20.862 10.718 -2.246 1.00 0.00 H ATOM 537 HD21 ASN A 223 -22.210 11.228 -1.164 1.00 0.00 H ATOM 538 H ASN A 223 -18.383 10.913 -0.191 1.00 0.00 H ATOM 539 N HIS A 224 -16.064 11.820 -2.462 1.00 31.66 N ATOM 540 CA HIS A 224 -14.822 12.209 -3.134 1.00 31.54 C ATOM 541 C HIS A 224 -13.822 11.067 -3.259 1.00 32.24 C ATOM 542 O HIS A 224 -12.624 11.312 -3.425 1.00 30.85 O ATOM 543 CB HIS A 224 -14.212 13.447 -2.454 1.00 33.77 C ATOM 544 CG HIS A 224 -15.170 14.596 -2.463 1.00 38.99 C ATOM 545 ND1 HIS A 224 -15.428 15.307 -3.622 1.00 41.84 N ATOM 546 CD2 HIS A 224 -16.005 15.030 -1.489 1.00 42.32 C ATOM 547 CE1 HIS A 224 -16.369 16.183 -3.305 1.00 42.25 C ATOM 548 NE2 HIS A 224 -16.746 16.057 -2.030 1.00 42.61 N ATOM 549 H HIS A 224 -16.028 11.554 -1.457 1.00 0.00 H ATOM 550 N GLU A 225 -14.335 9.817 -3.247 1.00 28.21 N ATOM 551 CA GLU A 225 -13.559 8.574 -3.337 1.00 28.16 C ATOM 552 C GLU A 225 -12.589 8.552 -4.517 1.00 32.57 C ATOM 553 O GLU A 225 -11.449 8.133 -4.337 1.00 31.30 O ATOM 554 CB GLU A 225 -14.501 7.355 -3.405 1.00 29.42 C ATOM 555 CG GLU A 225 -13.792 6.011 -3.388 1.00 41.45 C ATOM 556 CD GLU A 225 -14.685 4.788 -3.488 1.00 73.56 C ATOM 557 OE1 GLU A 225 -14.397 3.792 -2.785 1.00 78.40 O ATOM 558 OE2 GLU A 225 -15.663 4.816 -4.271 1.00 72.31 O ATOM 559 H GLU A 225 -15.368 9.728 -3.167 1.00 0.00 H ATOM 560 N THR A 226 -13.052 8.950 -5.723 1.00 30.42 N ATOM 561 CA THR A 226 -12.208 8.952 -6.932 1.00 30.82 C ATOM 562 C THR A 226 -11.041 9.911 -6.758 1.00 33.68 C ATOM 563 O THR A 226 -9.900 9.509 -6.987 1.00 32.97 O ATOM 564 CB THR A 226 -13.052 9.200 -8.205 1.00 39.11 C ATOM 565 OG1 THR A 226 -13.968 8.116 -8.335 1.00 39.72 O ATOM 566 CG2 THR A 226 -12.199 9.278 -9.475 1.00 37.22 C ATOM 567 HG1 THR A 226 -14.523 8.249 -9.144 1.00 0.00 H ATOM 568 H THR A 226 -14.040 9.266 -5.801 1.00 0.00 H ATOM 569 N ALA A 227 -11.315 11.152 -6.298 1.00 30.05 N ATOM 570 CA ALA A 227 -10.263 12.145 -6.054 1.00 29.20 C ATOM 571 C ALA A 227 -9.288 11.687 -4.954 1.00 30.23 C ATOM 572 O ALA A 227 -8.083 11.856 -5.109 1.00 29.61 O ATOM 573 CB ALA A 227 -10.875 13.489 -5.689 1.00 30.10 C ATOM 574 H ALA A 227 -12.305 11.412 -6.111 1.00 0.00 H ATOM 575 N PHE A 228 -9.815 11.096 -3.860 1.00 25.17 N ATOM 576 CA PHE A 228 -9.005 10.594 -2.736 1.00 23.44 C ATOM 577 C PHE A 228 -8.107 9.442 -3.201 1.00 28.14 C ATOM 578 O PHE A 228 -6.915 9.468 -2.902 1.00 26.89 O ATOM 579 CB PHE A 228 -9.899 10.201 -1.545 1.00 23.70 C ATOM 580 CG PHE A 228 -10.358 11.369 -0.686 1.00 25.14 C ATOM 581 CD1 PHE A 228 -10.129 12.690 -1.085 1.00 26.51 C ATOM 582 CD2 PHE A 228 -10.974 11.149 0.544 1.00 24.87 C ATOM 583 CE1 PHE A 228 -10.528 13.759 -0.284 1.00 27.90 C ATOM 584 CE2 PHE A 228 -11.373 12.221 1.343 1.00 27.30 C ATOM 585 CZ PHE A 228 -11.150 13.518 0.927 1.00 25.93 C ATOM 586 H PHE A 228 -10.848 10.989 -3.808 1.00 0.00 H ATOM 587 N GLN A 229 -8.653 8.483 -3.994 1.00 25.68 N ATOM 588 CA GLN A 229 -7.857 7.373 -4.569 1.00 25.90 C ATOM 589 C GLN A 229 -6.757 7.928 -5.490 1.00 30.40 C ATOM 590 O GLN A 229 -5.617 7.463 -5.443 1.00 30.75 O ATOM 591 CB GLN A 229 -8.736 6.371 -5.354 1.00 27.25 C ATOM 592 CG GLN A 229 -9.700 5.551 -4.500 1.00 40.11 C ATOM 593 CD GLN A 229 -10.711 4.742 -5.290 1.00 62.69 C ATOM 594 OE1 GLN A 229 -11.080 5.067 -6.430 1.00 58.92 O ATOM 595 NE2 GLN A 229 -11.209 3.672 -4.680 1.00 49.02 N ATOM 596 HE22 GLN A 229 -10.884 3.420 -3.725 1.00 0.00 H ATOM 597 HE21 GLN A 229 -11.924 3.087 -5.158 1.00 0.00 H ATOM 598 H GLN A 229 -9.670 8.530 -4.206 1.00 0.00 H ATOM 599 N GLY A 230 -7.108 8.939 -6.283 1.00 26.97 N ATOM 600 CA GLY A 230 -6.185 9.596 -7.203 1.00 27.10 C ATOM 601 C GLY A 230 -5.047 10.274 -6.467 1.00 30.13 C ATOM 602 O GLY A 230 -3.879 10.063 -6.794 1.00 29.81 O ATOM 603 H GLY A 230 -8.091 9.278 -6.245 1.00 0.00 H ATOM 604 N MET A 231 -5.383 11.054 -5.432 1.00 25.86 N ATOM 605 CA MET A 231 -4.389 11.759 -4.611 1.00 23.94 C ATOM 606 C MET A 231 -3.456 10.775 -3.868 1.00 29.61 C ATOM 607 O MET A 231 -2.243 11.003 -3.820 1.00 29.16 O ATOM 608 CB MET A 231 -5.101 12.722 -3.635 1.00 24.44 C ATOM 609 CG MET A 231 -4.146 13.630 -2.903 1.00 25.96 C ATOM 610 SD MET A 231 -3.299 14.849 -3.996 1.00 24.64 S ATOM 611 CE MET A 231 -2.273 15.380 -2.935 1.00 22.82 C ATOM 612 H MET A 231 -6.390 11.166 -5.199 1.00 0.00 H ATOM 613 N LEU A 232 -4.017 9.676 -3.322 1.00 27.56 N ATOM 614 CA LEU A 232 -3.256 8.646 -2.596 1.00 29.60 C ATOM 615 C LEU A 232 -2.190 8.019 -3.545 1.00 34.28 C ATOM 616 O LEU A 232 -1.049 7.792 -3.140 1.00 34.13 O ATOM 617 CB LEU A 232 -4.229 7.550 -2.111 1.00 30.50 C ATOM 618 CG LEU A 232 -4.043 6.874 -0.737 1.00 37.50 C ATOM 619 CD1 LEU A 232 -4.669 5.471 -0.743 1.00 37.33 C ATOM 620 CD2 LEU A 232 -2.605 6.820 -0.271 1.00 39.88 C ATOM 621 H LEU A 232 -5.045 9.549 -3.420 1.00 0.00 H ATOM 622 N ARG A 233 -2.573 7.766 -4.803 1.00 32.87 N ATOM 623 CA ARG A 233 -1.688 7.218 -5.830 1.00 33.74 C ATOM 624 C ARG A 233 -0.547 8.188 -6.150 1.00 38.21 C ATOM 625 O ARG A 233 0.596 7.751 -6.256 1.00 38.59 O ATOM 626 CB ARG A 233 -2.475 6.863 -7.100 1.00 34.77 C ATOM 627 CG ARG A 233 -2.919 5.413 -7.148 1.00 39.24 C ATOM 628 CD ARG A 233 -3.765 5.051 -8.365 1.00 38.04 C ATOM 629 NE ARG A 233 -3.180 5.442 -9.651 1.00 51.09 N ATOM 630 CZ ARG A 233 -2.282 4.735 -10.333 1.00 67.94 C ATOM 631 NH1 ARG A 233 -1.809 3.599 -9.841 1.00 54.06 N ATOM 632 NH2 ARG A 233 -1.832 5.173 -11.500 1.00 57.35 N ATOM 633 HE ARG A 233 -3.492 6.344 -10.064 1.00 0.00 H ATOM 634 HH12 ARG A 233 -1.107 3.051 -10.379 1.00 0.00 H ATOM 635 HH11 ARG A 233 -2.139 3.255 -8.917 1.00 0.00 H ATOM 636 HH22 ARG A 233 -1.130 4.617 -12.029 1.00 0.00 H ATOM 637 HH21 ARG A 233 -2.181 6.073 -11.887 1.00 0.00 H ATOM 638 H ARG A 233 -3.558 7.971 -5.065 1.00 0.00 H ATOM 639 N LYS A 234 -0.846 9.498 -6.280 1.00 34.51 N ATOM 640 CA LYS A 234 0.171 10.530 -6.572 1.00 33.94 C ATOM 641 C LYS A 234 1.194 10.621 -5.442 1.00 37.13 C ATOM 642 O LYS A 234 2.392 10.684 -5.708 1.00 35.93 O ATOM 643 CB LYS A 234 -0.478 11.909 -6.806 1.00 36.11 C ATOM 644 CG LYS A 234 -1.329 11.956 -8.061 1.00 49.32 C ATOM 645 CD LYS A 234 -1.882 13.338 -8.323 1.00 54.93 C ATOM 646 CE LYS A 234 -1.206 13.986 -9.495 1.00 57.38 C ATOM 647 NZ LYS A 234 -1.665 13.432 -10.797 1.00 54.96 N ATOM 648 HZ1 LYS A 234 -1.458 12.413 -10.831 1.00 0.00 H ATOM 649 HZ2 LYS A 234 -2.689 13.583 -10.895 1.00 0.00 H ATOM 650 HZ3 LYS A 234 -1.167 13.914 -11.572 1.00 0.00 H ATOM 651 H LYS A 234 -1.837 9.794 -6.170 1.00 0.00 H ATOM 652 N LEU A 235 0.719 10.601 -4.185 1.00 33.52 N ATOM 653 CA LEU A 235 1.556 10.658 -2.981 1.00 34.24 C ATOM 654 C LEU A 235 2.518 9.478 -2.851 1.00 40.26 C ATOM 655 O LEU A 235 3.607 9.644 -2.299 1.00 39.24 O ATOM 656 CB LEU A 235 0.696 10.787 -1.715 1.00 34.68 C ATOM 657 CG LEU A 235 -0.052 12.113 -1.556 1.00 39.26 C ATOM 658 CD1 LEU A 235 -1.028 12.036 -0.411 1.00 40.50 C ATOM 659 CD2 LEU A 235 0.913 13.272 -1.352 1.00 39.02 C ATOM 660 H LEU A 235 -0.311 10.541 -4.057 1.00 0.00 H ATOM 661 N ASP A 236 2.110 8.293 -3.349 1.00 39.27 N ATOM 662 CA ASP A 236 2.914 7.066 -3.362 1.00 41.20 C ATOM 663 C ASP A 236 3.564 6.771 -1.988 1.00 49.39 C ATOM 664 O ASP A 236 4.787 6.629 -1.885 1.00 49.05 O ATOM 665 CB ASP A 236 3.942 7.124 -4.523 1.00 42.45 C ATOM 666 CG ASP A 236 4.734 5.850 -4.720 1.00 52.16 C ATOM 667 OD1 ASP A 236 4.113 4.804 -5.006 1.00 50.19 O ATOM 668 OD2 ASP A 236 5.974 5.897 -4.570 1.00 61.16 O ATOM 669 H ASP A 236 1.153 8.245 -3.754 1.00 0.00 H ATOM 670 N ILE A 237 2.727 6.729 -0.928 1.00 49.42 N ATOM 671 CA ILE A 237 3.145 6.483 0.462 1.00 50.74 C ATOM 672 C ILE A 237 3.567 5.014 0.626 1.00 59.25 C ATOM 673 O ILE A 237 2.749 4.101 0.442 1.00 59.67 O ATOM 674 CB ILE A 237 2.060 6.933 1.490 1.00 53.62 C ATOM 675 CG1 ILE A 237 1.694 8.425 1.309 1.00 53.33 C ATOM 676 CG2 ILE A 237 2.505 6.648 2.939 1.00 54.68 C ATOM 677 CD1 ILE A 237 0.218 8.758 1.558 1.00 58.49 C ATOM 678 H ILE A 237 1.714 6.882 -1.107 1.00 0.00 H ATOM 679 N LYS A 238 4.855 4.800 0.952 1.00 57.85 N ATOM 680 CA LYS A 238 5.444 3.465 1.100 1.00 58.23 C ATOM 681 C LYS A 238 6.052 3.185 2.474 1.00 61.89 C ATOM 682 O LYS A 238 6.123 2.020 2.862 1.00 62.44 O ATOM 683 CB LYS A 238 6.480 3.202 -0.006 1.00 60.94 C ATOM 684 CG LYS A 238 5.871 3.036 -1.391 1.00 78.08 C ATOM 685 CD LYS A 238 6.936 2.797 -2.455 1.00 89.06 C ATOM 686 CE LYS A 238 6.353 2.576 -3.835 1.00101.20 C ATOM 687 NZ LYS A 238 5.670 1.257 -3.966 1.00109.06 N ATOM 688 HZ1 LYS A 238 6.353 0.495 -3.782 1.00 0.00 H ATOM 689 HZ2 LYS A 238 4.892 1.201 -3.278 1.00 0.00 H ATOM 690 HZ3 LYS A 238 5.290 1.159 -4.929 1.00 0.00 H ATOM 691 H LYS A 238 5.466 5.627 1.108 1.00 0.00 H ATOM 692 N ASN A 239 6.492 4.230 3.209 1.00 57.73 N ATOM 693 CA ASN A 239 7.127 4.068 4.528 1.00 57.17 C ATOM 694 C ASN A 239 7.001 5.308 5.425 1.00 61.89 C ATOM 695 O ASN A 239 6.283 6.244 5.075 1.00 61.75 O ATOM 696 CB ASN A 239 8.600 3.645 4.366 1.00 55.02 C ATOM 697 CG ASN A 239 9.309 4.337 3.228 1.00 66.31 C ATOM 698 OD1 ASN A 239 9.523 3.755 2.156 1.00 56.70 O ATOM 699 ND2 ASN A 239 9.663 5.603 3.427 1.00 54.51 N ATOM 700 HD22 ASN A 239 9.467 6.060 4.340 1.00 0.00 H ATOM 701 HD21 ASN A 239 10.135 6.136 2.669 1.00 0.00 H ATOM 702 H ASN A 239 6.377 5.190 2.827 1.00 0.00 H ATOM 703 N GLU A 240 7.696 5.306 6.582 1.00 58.66 N ATOM 704 CA GLU A 240 7.671 6.384 7.576 1.00 58.70 C ATOM 705 C GLU A 240 8.327 7.685 7.114 1.00 61.88 C ATOM 706 O GLU A 240 7.955 8.746 7.620 1.00 61.78 O ATOM 707 CB GLU A 240 8.248 5.929 8.931 1.00 60.56 C ATOM 708 CG GLU A 240 9.622 5.280 8.896 1.00 74.76 C ATOM 709 CD GLU A 240 10.032 4.714 10.241 1.00103.36 C ATOM 710 OE1 GLU A 240 9.636 3.566 10.545 1.00 99.09 O ATOM 711 OE2 GLU A 240 10.737 5.422 10.997 1.00100.23 O ATOM 712 H GLU A 240 8.293 4.479 6.784 1.00 0.00 H ATOM 713 N ASP A 241 9.298 7.619 6.176 1.00 57.27 N ATOM 714 CA ASP A 241 9.946 8.821 5.645 1.00 56.46 C ATOM 715 C ASP A 241 8.983 9.581 4.731 1.00 58.70 C ATOM 716 O ASP A 241 8.975 10.811 4.757 1.00 58.37 O ATOM 717 CB ASP A 241 11.268 8.490 4.935 1.00 58.44 C ATOM 718 CG ASP A 241 12.357 8.025 5.883 1.00 70.71 C ATOM 719 OD1 ASP A 241 12.634 8.744 6.873 1.00 70.17 O ATOM 720 OD2 ASP A 241 12.933 6.941 5.639 1.00 79.15 O ATOM 721 H ASP A 241 9.594 6.687 5.821 1.00 0.00 H ATOM 722 N ASP A 242 8.146 8.843 3.961 1.00 53.89 N ATOM 723 CA ASP A 242 7.110 9.406 3.085 1.00 53.13 C ATOM 724 C ASP A 242 6.048 10.131 3.923 1.00 55.63 C ATOM 725 O ASP A 242 5.579 11.190 3.514 1.00 54.90 O ATOM 726 CB ASP A 242 6.449 8.311 2.216 1.00 54.78 C ATOM 727 CG ASP A 242 7.360 7.637 1.199 1.00 63.74 C ATOM 728 OD1 ASP A 242 8.519 8.093 1.034 1.00 64.44 O ATOM 729 OD2 ASP A 242 6.912 6.663 0.560 1.00 67.34 O ATOM 730 H ASP A 242 8.244 7.808 3.993 1.00 0.00 H ATOM 731 N VAL A 243 5.695 9.573 5.104 1.00 51.70 N ATOM 732 CA VAL A 243 4.719 10.160 6.030 1.00 51.42 C ATOM 733 C VAL A 243 5.264 11.489 6.598 1.00 55.36 C ATOM 734 O VAL A 243 4.498 12.443 6.725 1.00 53.73 O ATOM 735 CB VAL A 243 4.242 9.158 7.128 1.00 55.39 C ATOM 736 CG1 VAL A 243 3.194 9.781 8.052 1.00 55.35 C ATOM 737 CG2 VAL A 243 3.694 7.874 6.508 1.00 54.87 C ATOM 738 H VAL A 243 6.142 8.673 5.372 1.00 0.00 H ATOM 739 N LYS A 244 6.592 11.569 6.877 1.00 53.33 N ATOM 740 CA LYS A 244 7.235 12.796 7.379 1.00 53.62 C ATOM 741 C LYS A 244 7.215 13.910 6.312 1.00 57.69 C ATOM 742 O LYS A 244 7.050 15.080 6.657 1.00 57.90 O ATOM 743 CB LYS A 244 8.675 12.525 7.854 1.00 56.27 C ATOM 744 CG LYS A 244 9.292 13.693 8.627 1.00 70.98 C ATOM 745 CD LYS A 244 10.687 13.391 9.147 1.00 81.92 C ATOM 746 CE LYS A 244 11.266 14.577 9.878 1.00 95.75 C ATOM 747 NZ LYS A 244 12.558 14.243 10.534 1.00106.98 N ATOM 748 HZ1 LYS A 244 12.409 13.476 11.220 1.00 0.00 H ATOM 749 HZ2 LYS A 244 13.242 13.937 9.813 1.00 0.00 H ATOM 750 HZ3 LYS A 244 12.923 15.084 11.025 1.00 0.00 H ATOM 751 H LYS A 244 7.181 10.725 6.729 1.00 0.00 H ATOM 752 N SER A 245 7.366 13.540 5.030 1.00 53.72 N ATOM 753 CA SER A 245 7.362 14.491 3.912 1.00 53.60 C ATOM 754 C SER A 245 5.951 14.990 3.535 1.00 55.32 C ATOM 755 O SER A 245 5.830 16.007 2.843 1.00 54.33 O ATOM 756 CB SER A 245 8.066 13.892 2.699 1.00 58.15 C ATOM 757 OG SER A 245 7.454 12.683 2.283 1.00 69.29 O ATOM 758 HG SER A 245 7.490 12.025 3.022 1.00 0.00 H ATOM 759 H SER A 245 7.492 12.529 4.819 1.00 0.00 H ATOM 760 N LEU A 246 4.891 14.287 4.011 1.00 49.80 N ATOM 761 CA LEU A 246 3.479 14.619 3.764 1.00 48.46 C ATOM 762 C LEU A 246 3.133 16.028 4.214 1.00 50.07 C ATOM 763 O LEU A 246 2.310 16.682 3.578 1.00 49.81 O ATOM 764 CB LEU A 246 2.573 13.602 4.476 1.00 48.51 C ATOM 765 CG LEU A 246 1.790 12.600 3.621 1.00 53.28 C ATOM 766 CD1 LEU A 246 2.579 12.119 2.414 1.00 53.83 C ATOM 767 CD2 LEU A 246 1.327 11.418 4.459 1.00 54.56 C ATOM 768 H LEU A 246 5.093 13.450 4.595 1.00 0.00 H ATOM 769 N SER A 247 3.786 16.496 5.298 1.00 44.16 N ATOM 770 CA SER A 247 3.620 17.817 5.886 1.00 43.35 C ATOM 771 C SER A 247 3.785 18.948 4.856 1.00 45.84 C ATOM 772 O SER A 247 2.949 19.852 4.825 1.00 45.58 O ATOM 773 CB SER A 247 4.604 18.005 7.037 1.00 46.99 C ATOM 774 OG SER A 247 4.488 19.301 7.600 1.00 57.96 O ATOM 775 HG SER A 247 3.569 19.429 7.944 1.00 0.00 H ATOM 776 H SER A 247 4.468 15.856 5.753 1.00 0.00 H ATOM 777 N ARG A 248 4.836 18.881 4.004 1.00 40.08 N ATOM 778 CA ARG A 248 5.093 19.923 3.002 1.00 38.62 C ATOM 779 C ARG A 248 4.093 19.872 1.848 1.00 38.69 C ATOM 780 O ARG A 248 3.721 20.928 1.341 1.00 36.35 O ATOM 781 CB ARG A 248 6.558 19.911 2.528 1.00 39.77 C ATOM 782 CG ARG A 248 7.510 20.481 3.587 1.00 47.14 C ATOM 783 CD ARG A 248 8.973 20.377 3.199 1.00 58.52 C ATOM 784 NE ARG A 248 9.841 20.429 4.378 1.00 65.61 N ATOM 785 CZ ARG A 248 11.073 19.930 4.430 1.00 79.01 C ATOM 786 NH1 ARG A 248 11.606 19.346 3.363 1.00 68.66 N ATOM 787 NH2 ARG A 248 11.780 20.008 5.549 1.00 62.07 N ATOM 788 HE ARG A 248 9.468 20.888 5.234 1.00 0.00 H ATOM 789 HH12 ARG A 248 12.570 18.958 3.410 1.00 0.00 H ATOM 790 HH11 ARG A 248 11.060 19.277 2.481 1.00 0.00 H ATOM 791 HH22 ARG A 248 12.743 19.616 5.584 1.00 0.00 H ATOM 792 HH21 ARG A 248 11.372 20.461 6.392 1.00 0.00 H ATOM 793 H ARG A 248 5.480 18.067 4.061 1.00 0.00 H ATOM 794 N VAL A 249 3.606 18.664 1.472 1.00 35.47 N ATOM 795 CA VAL A 249 2.572 18.510 0.424 1.00 34.51 C ATOM 796 C VAL A 249 1.263 19.106 0.977 1.00 36.10 C ATOM 797 O VAL A 249 0.571 19.836 0.270 1.00 34.55 O ATOM 798 CB VAL A 249 2.355 17.047 -0.019 1.00 39.19 C ATOM 799 CG1 VAL A 249 1.311 16.970 -1.123 1.00 39.77 C ATOM 800 CG2 VAL A 249 3.656 16.391 -0.472 1.00 39.27 C ATOM 801 H VAL A 249 3.974 17.811 1.939 1.00 0.00 H ATOM 802 N MET A 250 0.948 18.807 2.254 1.00 31.69 N ATOM 803 CA MET A 250 -0.234 19.331 2.937 1.00 30.77 C ATOM 804 C MET A 250 -0.285 20.861 2.852 1.00 39.23 C ATOM 805 O MET A 250 -1.296 21.397 2.418 1.00 38.65 O ATOM 806 CB MET A 250 -0.229 18.915 4.403 1.00 30.76 C ATOM 807 CG MET A 250 -1.000 17.687 4.696 1.00 30.19 C ATOM 808 SD MET A 250 -0.952 17.447 6.480 1.00 27.01 S ATOM 809 CE MET A 250 -0.134 15.875 6.559 1.00 25.89 C ATOM 810 H MET A 250 1.579 18.170 2.781 1.00 0.00 H ATOM 811 N ILE A 251 0.824 21.553 3.191 1.00 40.76 N ATOM 812 CA ILE A 251 0.874 23.024 3.146 1.00 42.34 C ATOM 813 C ILE A 251 0.820 23.545 1.697 1.00 46.64 C ATOM 814 O ILE A 251 0.173 24.562 1.458 1.00 46.62 O ATOM 815 CB ILE A 251 2.033 23.657 3.972 1.00 46.69 C ATOM 816 CG1 ILE A 251 3.378 23.583 3.246 1.00 48.32 C ATOM 817 CG2 ILE A 251 2.120 23.068 5.386 1.00 47.87 C ATOM 818 CD1 ILE A 251 4.357 24.614 3.676 1.00 64.70 C ATOM 819 H ILE A 251 1.670 21.030 3.494 1.00 0.00 H ATOM 820 N HIS A 252 1.449 22.840 0.731 1.00 42.82 N ATOM 821 CA HIS A 252 1.411 23.270 -0.675 1.00 42.61 C ATOM 822 C HIS A 252 -0.043 23.334 -1.177 1.00 41.77 C ATOM 823 O HIS A 252 -0.444 24.320 -1.805 1.00 40.11 O ATOM 824 CB HIS A 252 2.271 22.360 -1.574 1.00 44.10 C ATOM 825 CG HIS A 252 2.014 22.539 -3.047 1.00 48.60 C ATOM 826 ND1 HIS A 252 1.456 21.522 -3.814 1.00 51.11 N ATOM 827 CD2 HIS A 252 2.203 23.625 -3.835 1.00 51.02 C ATOM 828 CE1 HIS A 252 1.339 22.015 -5.039 1.00 50.72 C ATOM 829 NE2 HIS A 252 1.771 23.279 -5.100 1.00 51.14 N ATOM 830 H HIS A 252 1.970 21.977 0.987 1.00 0.00 H ATOM 831 N VAL A 253 -0.833 22.299 -0.859 1.00 34.90 N ATOM 832 CA VAL A 253 -2.228 22.211 -1.287 1.00 32.31 C ATOM 833 C VAL A 253 -3.140 23.101 -0.438 1.00 35.28 C ATOM 834 O VAL A 253 -3.882 23.908 -0.994 1.00 35.39 O ATOM 835 CB VAL A 253 -2.706 20.737 -1.334 1.00 34.45 C ATOM 836 CG1 VAL A 253 -4.172 20.646 -1.762 1.00 33.92 C ATOM 837 CG2 VAL A 253 -1.821 19.900 -2.262 1.00 33.65 C ATOM 838 H VAL A 253 -0.438 21.527 -0.285 1.00 0.00 H ATOM 839 N PHE A 254 -3.101 22.921 0.896 1.00 31.20 N ATOM 840 CA PHE A 254 -3.944 23.605 1.878 1.00 30.53 C ATOM 841 C PHE A 254 -3.723 25.113 1.988 1.00 38.54 C ATOM 842 O PHE A 254 -4.706 25.830 2.128 1.00 38.31 O ATOM 843 CB PHE A 254 -3.811 22.943 3.260 1.00 30.56 C ATOM 844 CG PHE A 254 -4.880 23.276 4.271 1.00 30.11 C ATOM 845 CD1 PHE A 254 -6.213 22.954 4.032 1.00 31.99 C ATOM 846 CD2 PHE A 254 -4.551 23.854 5.485 1.00 30.45 C ATOM 847 CE1 PHE A 254 -7.197 23.225 4.986 1.00 32.08 C ATOM 848 CE2 PHE A 254 -5.539 24.140 6.434 1.00 32.90 C ATOM 849 CZ PHE A 254 -6.857 23.834 6.172 1.00 30.98 C ATOM 850 H PHE A 254 -2.410 22.235 1.261 1.00 0.00 H ATOM 851 N SER A 255 -2.460 25.593 1.956 1.00 38.15 N ATOM 852 CA SER A 255 -2.145 27.031 2.081 1.00 39.26 C ATOM 853 C SER A 255 -2.430 27.853 0.813 1.00 45.01 C ATOM 854 O SER A 255 -2.382 29.083 0.862 1.00 45.68 O ATOM 855 CB SER A 255 -0.706 27.249 2.551 1.00 43.36 C ATOM 856 OG SER A 255 -0.444 26.579 3.775 1.00 53.33 O ATOM 857 HG SER A 255 -0.589 25.607 3.655 1.00 0.00 H ATOM 858 H SER A 255 -1.675 24.921 1.838 1.00 0.00 H ATOM 859 N ASP A 256 -2.715 27.189 -0.317 1.00 42.89 N ATOM 860 CA ASP A 256 -3.024 27.885 -1.567 1.00 43.14 C ATOM 861 C ASP A 256 -4.529 28.128 -1.645 1.00 47.86 C ATOM 862 O ASP A 256 -5.295 27.163 -1.641 1.00 47.37 O ATOM 863 CB ASP A 256 -2.542 27.060 -2.783 1.00 45.24 C ATOM 864 CG ASP A 256 -3.094 27.528 -4.125 1.00 55.71 C ATOM 865 OD1 ASP A 256 -2.869 28.704 -4.484 1.00 56.56 O ATOM 866 OD2 ASP A 256 -3.743 26.717 -4.813 1.00 61.48 O ATOM 867 H ASP A 256 -2.716 26.149 -0.305 1.00 0.00 H ATOM 868 N GLY A 257 -4.931 29.395 -1.737 1.00 44.29 N ATOM 869 CA GLY A 257 -6.331 29.774 -1.883 1.00 44.33 C ATOM 870 C GLY A 257 -7.091 30.130 -0.620 1.00 47.85 C ATOM 871 O GLY A 257 -6.496 30.472 0.403 1.00 48.03 O ATOM 872 H GLY A 257 -4.214 30.147 -1.703 1.00 0.00 H ATOM 873 N VAL A 258 -8.429 30.049 -0.714 1.00 44.75 N ATOM 874 CA VAL A 258 -9.430 30.390 0.314 1.00 44.67 C ATOM 875 C VAL A 258 -9.415 29.459 1.527 1.00 46.36 C ATOM 876 O VAL A 258 -9.099 28.280 1.403 1.00 46.33 O ATOM 877 CB VAL A 258 -10.875 30.490 -0.279 1.00 49.51 C ATOM 878 CG1 VAL A 258 -10.995 31.629 -1.295 1.00 49.44 C ATOM 879 CG2 VAL A 258 -11.341 29.164 -0.891 1.00 49.36 C ATOM 880 H VAL A 258 -8.804 29.704 -1.621 1.00 0.00 H ATOM 881 N THR A 259 -9.795 29.988 2.689 1.00 40.57 N ATOM 882 CA THR A 259 -9.899 29.192 3.902 1.00 39.25 C ATOM 883 C THR A 259 -11.368 29.120 4.327 1.00 37.98 C ATOM 884 O THR A 259 -12.015 30.159 4.457 1.00 37.35 O ATOM 885 CB THR A 259 -8.912 29.617 5.036 1.00 52.07 C ATOM 886 OG1 THR A 259 -9.626 29.900 6.240 1.00 55.28 O ATOM 887 CG2 THR A 259 -7.987 30.777 4.663 1.00 51.09 C ATOM 888 HG1 THR A 259 -10.266 30.637 6.077 1.00 0.00 H ATOM 889 H THR A 259 -10.024 31.002 2.730 1.00 0.00 H ATOM 890 N ASN A 260 -11.888 27.889 4.532 1.00 29.99 N ATOM 891 CA ASN A 260 -13.261 27.631 4.974 1.00 27.49 C ATOM 892 C ASN A 260 -13.357 26.271 5.678 1.00 29.56 C ATOM 893 O ASN A 260 -12.411 25.490 5.606 1.00 27.80 O ATOM 894 CB ASN A 260 -14.263 27.739 3.796 1.00 25.21 C ATOM 895 CG ASN A 260 -14.035 26.777 2.664 1.00 38.41 C ATOM 896 OD1 ASN A 260 -14.149 25.548 2.817 1.00 30.55 O ATOM 897 ND2 ASN A 260 -13.743 27.316 1.487 1.00 29.19 N ATOM 898 HD22 ASN A 260 -13.655 28.348 1.395 1.00 0.00 H ATOM 899 HD21 ASN A 260 -13.602 26.706 0.656 1.00 0.00 H ATOM 900 H ASN A 260 -11.271 27.069 4.364 1.00 0.00 H ATOM 901 N TRP A 261 -14.492 25.983 6.335 1.00 26.60 N ATOM 902 CA TRP A 261 -14.703 24.703 7.029 1.00 26.96 C ATOM 903 C TRP A 261 -14.747 23.470 6.104 1.00 27.84 C ATOM 904 O TRP A 261 -14.399 22.370 6.529 1.00 27.66 O ATOM 905 CB TRP A 261 -15.954 24.765 7.910 1.00 26.66 C ATOM 906 CG TRP A 261 -15.809 25.607 9.147 1.00 27.98 C ATOM 907 CD1 TRP A 261 -16.570 26.689 9.490 1.00 31.35 C ATOM 908 CD2 TRP A 261 -14.917 25.378 10.246 1.00 27.77 C ATOM 909 NE1 TRP A 261 -16.206 27.149 10.734 1.00 31.17 N ATOM 910 CE2 TRP A 261 -15.163 26.392 11.202 1.00 32.19 C ATOM 911 CE3 TRP A 261 -13.885 24.449 10.495 1.00 28.87 C ATOM 912 CZ2 TRP A 261 -14.435 26.491 12.390 1.00 31.32 C ATOM 913 CZ3 TRP A 261 -13.145 24.566 11.662 1.00 30.15 C ATOM 914 CH2 TRP A 261 -13.436 25.563 12.602 1.00 31.07 C ATOM 915 HE1 TRP A 261 -16.650 27.943 11.238 1.00 0.00 H ATOM 916 H TRP A 261 -15.252 26.693 6.354 1.00 0.00 H ATOM 917 N GLY A 262 -15.174 23.660 4.860 1.00 24.08 N ATOM 918 CA GLY A 262 -15.222 22.601 3.851 1.00 23.06 C ATOM 919 C GLY A 262 -13.840 22.055 3.551 1.00 27.35 C ATOM 920 O GLY A 262 -13.645 20.832 3.509 1.00 25.53 O ATOM 921 H GLY A 262 -15.491 24.613 4.589 1.00 0.00 H ATOM 922 N ARG A 263 -12.858 22.963 3.374 1.00 25.52 N ATOM 923 CA ARG A 263 -11.459 22.584 3.112 1.00 25.14 C ATOM 924 C ARG A 263 -10.845 21.904 4.336 1.00 27.00 C ATOM 925 O ARG A 263 -10.038 20.989 4.179 1.00 26.66 O ATOM 926 CB ARG A 263 -10.606 23.792 2.697 1.00 24.96 C ATOM 927 CG ARG A 263 -10.977 24.402 1.330 1.00 31.19 C ATOM 928 CD ARG A 263 -9.767 24.438 0.401 1.00 40.04 C ATOM 929 NE ARG A 263 -8.905 25.580 0.630 1.00 50.72 N ATOM 930 CZ ARG A 263 -7.657 25.689 0.189 1.00 59.94 C ATOM 931 NH1 ARG A 263 -7.079 24.678 -0.454 1.00 31.58 N ATOM 932 NH2 ARG A 263 -6.954 26.779 0.446 1.00 58.58 N ATOM 933 HE ARG A 263 -9.292 26.373 1.180 1.00 0.00 H ATOM 934 HH12 ARG A 263 -6.101 24.771 -0.797 1.00 0.00 H ATOM 935 HH11 ARG A 263 -7.605 23.795 -0.614 1.00 0.00 H ATOM 936 HH22 ARG A 263 -5.977 26.861 0.099 1.00 0.00 H ATOM 937 HH21 ARG A 263 -7.378 27.554 0.995 1.00 0.00 H ATOM 938 H ARG A 263 -13.099 23.973 3.425 1.00 0.00 H ATOM 939 N ILE A 264 -11.230 22.356 5.548 1.00 23.62 N ATOM 940 CA ILE A 264 -10.744 21.804 6.826 1.00 23.15 C ATOM 941 C ILE A 264 -11.260 20.381 7.014 1.00 26.46 C ATOM 942 O ILE A 264 -10.493 19.496 7.392 1.00 26.28 O ATOM 943 CB ILE A 264 -11.092 22.735 8.020 1.00 25.77 C ATOM 944 CG1 ILE A 264 -10.279 24.046 7.936 1.00 25.87 C ATOM 945 CG2 ILE A 264 -10.885 22.024 9.382 1.00 26.30 C ATOM 946 CD1 ILE A 264 -10.735 25.184 8.890 1.00 30.90 C ATOM 947 H ILE A 264 -11.911 23.141 5.583 1.00 0.00 H ATOM 948 N VAL A 265 -12.544 20.150 6.722 1.00 23.79 N ATOM 949 CA VAL A 265 -13.118 18.807 6.815 1.00 23.71 C ATOM 950 C VAL A 265 -12.492 17.906 5.722 1.00 25.74 C ATOM 951 O VAL A 265 -12.225 16.743 5.988 1.00 23.34 O ATOM 952 CB VAL A 265 -14.670 18.798 6.865 1.00 28.45 C ATOM 953 CG1 VAL A 265 -15.292 18.898 5.482 1.00 28.08 C ATOM 954 CG2 VAL A 265 -15.195 17.574 7.612 1.00 29.27 C ATOM 955 H VAL A 265 -13.148 20.942 6.422 1.00 0.00 H ATOM 956 N THR A 266 -12.164 18.470 4.535 1.00 22.23 N ATOM 957 CA THR A 266 -11.504 17.700 3.465 1.00 21.02 C ATOM 958 C THR A 266 -10.110 17.231 3.917 1.00 24.64 C ATOM 959 O THR A 266 -9.773 16.072 3.719 1.00 25.41 O ATOM 960 CB THR A 266 -11.512 18.479 2.131 1.00 28.79 C ATOM 961 OG1 THR A 266 -12.867 18.833 1.822 1.00 25.90 O ATOM 962 CG2 THR A 266 -10.946 17.658 0.964 1.00 27.53 C ATOM 963 HG1 THR A 266 -13.233 19.399 2.548 1.00 0.00 H ATOM 964 H THR A 266 -12.384 19.474 4.374 1.00 0.00 H ATOM 965 N LEU A 267 -9.323 18.132 4.541 1.00 20.97 N ATOM 966 CA LEU A 267 -7.979 17.862 5.087 1.00 21.06 C ATOM 967 C LEU A 267 -8.027 16.689 6.058 1.00 22.12 C ATOM 968 O LEU A 267 -7.247 15.743 5.934 1.00 22.40 O ATOM 969 CB LEU A 267 -7.472 19.126 5.810 1.00 21.18 C ATOM 970 CG LEU A 267 -6.080 19.046 6.517 1.00 25.01 C ATOM 971 CD1 LEU A 267 -4.924 19.133 5.507 1.00 24.20 C ATOM 972 CD2 LEU A 267 -5.948 20.130 7.546 1.00 25.54 C ATOM 973 H LEU A 267 -9.695 19.098 4.646 1.00 0.00 H ATOM 974 N ILE A 268 -8.956 16.739 7.002 1.00 19.74 N ATOM 975 CA ILE A 268 -9.109 15.699 8.027 1.00 19.34 C ATOM 976 C ILE A 268 -9.646 14.403 7.432 1.00 22.60 C ATOM 977 O ILE A 268 -9.160 13.337 7.789 1.00 22.64 O ATOM 978 CB ILE A 268 -9.939 16.207 9.237 1.00 22.74 C ATOM 979 CG1 ILE A 268 -9.299 17.509 9.832 1.00 23.60 C ATOM 980 CG2 ILE A 268 -10.078 15.114 10.307 1.00 23.39 C ATOM 981 CD1 ILE A 268 -10.197 18.290 10.777 1.00 25.38 C ATOM 982 H ILE A 268 -9.606 17.551 7.017 1.00 0.00 H ATOM 983 N SER A 269 -10.656 14.486 6.553 1.00 21.00 N ATOM 984 CA SER A 269 -11.257 13.308 5.909 1.00 20.84 C ATOM 985 C SER A 269 -10.237 12.580 5.054 1.00 23.22 C ATOM 986 O SER A 269 -10.216 11.352 5.071 1.00 21.49 O ATOM 987 CB SER A 269 -12.462 13.708 5.056 1.00 22.04 C ATOM 988 OG SER A 269 -13.428 14.342 5.880 1.00 29.57 O ATOM 989 HG SER A 269 -13.030 15.149 6.292 1.00 0.00 H ATOM 990 H SER A 269 -11.031 15.427 6.316 1.00 0.00 H ATOM 991 N PHE A 270 -9.385 13.321 4.297 1.00 20.32 N ATOM 992 CA PHE A 270 -8.342 12.667 3.506 1.00 18.93 C ATOM 993 C PHE A 270 -7.321 12.056 4.470 1.00 24.38 C ATOM 994 O PHE A 270 -6.772 11.000 4.176 1.00 24.55 O ATOM 995 CB PHE A 270 -7.647 13.633 2.528 1.00 20.39 C ATOM 996 CG PHE A 270 -6.672 12.926 1.612 1.00 21.35 C ATOM 997 CD1 PHE A 270 -7.084 11.864 0.816 1.00 24.75 C ATOM 998 CD2 PHE A 270 -5.345 13.332 1.534 1.00 23.63 C ATOM 999 CE1 PHE A 270 -6.179 11.190 -0.003 1.00 26.37 C ATOM 1000 CE2 PHE A 270 -4.436 12.659 0.714 1.00 26.37 C ATOM 1001 CZ PHE A 270 -4.859 11.594 -0.055 1.00 24.91 C ATOM 1002 H PHE A 270 -9.475 14.357 4.280 1.00 0.00 H ATOM 1003 N GLY A 271 -7.137 12.689 5.633 1.00 21.87 N ATOM 1004 CA GLY A 271 -6.289 12.170 6.699 1.00 21.69 C ATOM 1005 C GLY A 271 -6.720 10.771 7.124 1.00 25.48 C ATOM 1006 O GLY A 271 -5.894 9.868 7.212 1.00 24.64 O ATOM 1007 H GLY A 271 -7.623 13.596 5.785 1.00 0.00 H ATOM 1008 N ALA A 272 -8.035 10.570 7.314 1.00 23.75 N ATOM 1009 CA ALA A 272 -8.624 9.276 7.693 1.00 24.18 C ATOM 1010 C ALA A 272 -8.483 8.258 6.555 1.00 26.59 C ATOM 1011 O ALA A 272 -8.174 7.094 6.810 1.00 24.98 O ATOM 1012 CB ALA A 272 -10.080 9.458 8.059 1.00 25.00 C ATOM 1013 H ALA A 272 -8.676 11.379 7.185 1.00 0.00 H ATOM 1014 N PHE A 273 -8.684 8.705 5.305 1.00 24.35 N ATOM 1015 CA PHE A 273 -8.518 7.875 4.097 1.00 23.56 C ATOM 1016 C PHE A 273 -7.053 7.368 4.031 1.00 27.51 C ATOM 1017 O PHE A 273 -6.818 6.173 3.792 1.00 26.10 O ATOM 1018 CB PHE A 273 -8.871 8.692 2.849 1.00 24.56 C ATOM 1019 CG PHE A 273 -9.025 7.877 1.586 1.00 26.18 C ATOM 1020 CD1 PHE A 273 -10.253 7.321 1.244 1.00 28.57 C ATOM 1021 CD2 PHE A 273 -7.947 7.682 0.726 1.00 28.10 C ATOM 1022 CE1 PHE A 273 -10.404 6.593 0.062 1.00 29.73 C ATOM 1023 CE2 PHE A 273 -8.096 6.940 -0.452 1.00 30.39 C ATOM 1024 CZ PHE A 273 -9.323 6.399 -0.771 1.00 29.13 C ATOM 1025 H PHE A 273 -8.974 9.696 5.181 1.00 0.00 H ATOM 1026 N VAL A 274 -6.075 8.272 4.313 1.00 23.65 N ATOM 1027 CA VAL A 274 -4.644 7.931 4.356 1.00 22.98 C ATOM 1028 C VAL A 274 -4.380 6.973 5.541 1.00 26.41 C ATOM 1029 O VAL A 274 -3.700 5.969 5.350 1.00 25.80 O ATOM 1030 CB VAL A 274 -3.719 9.184 4.366 1.00 25.96 C ATOM 1031 CG1 VAL A 274 -2.246 8.797 4.549 1.00 24.87 C ATOM 1032 CG2 VAL A 274 -3.895 9.990 3.078 1.00 25.47 C ATOM 1033 H VAL A 274 -6.354 9.255 4.508 1.00 0.00 H ATOM 1034 N ALA A 275 -4.947 7.262 6.736 1.00 24.39 N ATOM 1035 CA ALA A 275 -4.811 6.401 7.926 1.00 24.33 C ATOM 1036 C ALA A 275 -5.219 4.933 7.628 1.00 29.68 C ATOM 1037 O ALA A 275 -4.485 4.012 7.983 1.00 29.39 O ATOM 1038 CB ALA A 275 -5.619 6.964 9.094 1.00 24.38 C ATOM 1039 H ALA A 275 -5.506 8.135 6.819 1.00 0.00 H ATOM 1040 N LYS A 276 -6.350 4.726 6.928 1.00 25.62 N ATOM 1041 CA LYS A 276 -6.802 3.388 6.523 1.00 25.94 C ATOM 1042 C LYS A 276 -5.787 2.687 5.605 1.00 30.55 C ATOM 1043 O LYS A 276 -5.461 1.512 5.835 1.00 29.87 O ATOM 1044 CB LYS A 276 -8.179 3.461 5.864 1.00 27.97 C ATOM 1045 CG LYS A 276 -9.283 3.670 6.883 1.00 29.98 C ATOM 1046 CD LYS A 276 -10.665 3.677 6.238 1.00 40.54 C ATOM 1047 CE LYS A 276 -11.157 5.066 5.939 1.00 44.86 C ATOM 1048 NZ LYS A 276 -12.611 5.069 5.651 1.00 51.96 N ATOM 1049 HZ1 LYS A 276 -12.801 4.464 4.826 1.00 0.00 H ATOM 1050 HZ2 LYS A 276 -13.127 4.704 6.477 1.00 0.00 H ATOM 1051 HZ3 LYS A 276 -12.921 6.041 5.449 1.00 0.00 H ATOM 1052 H LYS A 276 -6.929 5.548 6.663 1.00 0.00 H ATOM 1053 N HIS A 277 -5.234 3.423 4.617 1.00 27.21 N ATOM 1054 CA HIS A 277 -4.201 2.897 3.725 1.00 27.53 C ATOM 1055 C HIS A 277 -2.938 2.531 4.527 1.00 31.91 C ATOM 1056 O HIS A 277 -2.337 1.485 4.266 1.00 32.69 O ATOM 1057 CB HIS A 277 -3.871 3.893 2.601 1.00 28.86 C ATOM 1058 CG HIS A 277 -2.714 3.472 1.746 1.00 32.50 C ATOM 1059 ND1 HIS A 277 -2.824 2.426 0.845 1.00 34.42 N ATOM 1060 CD2 HIS A 277 -1.450 3.954 1.705 1.00 34.57 C ATOM 1061 CE1 HIS A 277 -1.626 2.298 0.296 1.00 33.86 C ATOM 1062 NE2 HIS A 277 -0.770 3.201 0.769 1.00 34.31 N ATOM 1063 H HIS A 277 -5.556 4.403 4.485 1.00 0.00 H ATOM 1064 N LEU A 278 -2.554 3.371 5.507 1.00 27.98 N ATOM 1065 CA LEU A 278 -1.387 3.120 6.371 1.00 28.87 C ATOM 1066 C LEU A 278 -1.498 1.762 7.085 1.00 34.65 C ATOM 1067 O LEU A 278 -0.526 1.012 7.080 1.00 34.25 O ATOM 1068 CB LEU A 278 -1.125 4.265 7.373 1.00 28.72 C ATOM 1069 CG LEU A 278 -0.544 5.581 6.806 1.00 32.77 C ATOM 1070 CD1 LEU A 278 -0.397 6.635 7.904 1.00 32.75 C ATOM 1071 CD2 LEU A 278 0.799 5.373 6.153 1.00 34.73 C ATOM 1072 H LEU A 278 -3.107 4.238 5.661 1.00 0.00 H ATOM 1073 N LYS A 279 -2.687 1.430 7.648 1.00 32.69 N ATOM 1074 CA LYS A 279 -2.941 0.124 8.279 1.00 33.00 C ATOM 1075 C LYS A 279 -2.679 -1.024 7.281 1.00 36.82 C ATOM 1076 O LYS A 279 -1.985 -1.977 7.616 1.00 36.88 O ATOM 1077 CB LYS A 279 -4.376 0.019 8.829 1.00 33.97 C ATOM 1078 CG LYS A 279 -4.587 -1.257 9.651 1.00 42.67 C ATOM 1079 CD LYS A 279 -5.930 -1.320 10.330 1.00 47.89 C ATOM 1080 CE LYS A 279 -6.071 -2.568 11.168 1.00 54.24 C ATOM 1081 NZ LYS A 279 -7.494 -2.986 11.306 1.00 59.22 N ATOM 1082 HZ1 LYS A 279 -8.035 -2.224 11.762 1.00 0.00 H ATOM 1083 HZ2 LYS A 279 -7.890 -3.179 10.364 1.00 0.00 H ATOM 1084 HZ3 LYS A 279 -7.546 -3.846 11.888 1.00 0.00 H ATOM 1085 H LYS A 279 -3.455 2.131 7.633 1.00 0.00 H ATOM 1086 N THR A 280 -3.222 -0.905 6.064 1.00 33.53 N ATOM 1087 CA THR A 280 -3.099 -1.860 4.969 1.00 34.21 C ATOM 1088 C THR A 280 -1.630 -2.206 4.637 1.00 39.58 C ATOM 1089 O THR A 280 -1.333 -3.369 4.350 1.00 39.72 O ATOM 1090 CB THR A 280 -3.897 -1.343 3.747 1.00 42.71 C ATOM 1091 OG1 THR A 280 -5.268 -1.191 4.120 1.00 42.59 O ATOM 1092 CG2 THR A 280 -3.831 -2.265 2.561 1.00 44.65 C ATOM 1093 HG1 THR A 280 -5.336 -0.542 4.864 1.00 0.00 H ATOM 1094 H THR A 280 -3.785 -0.050 5.882 1.00 0.00 H ATOM 1095 N ILE A 281 -0.727 -1.200 4.650 1.00 35.36 N ATOM 1096 CA ILE A 281 0.690 -1.385 4.322 1.00 33.89 C ATOM 1097 C ILE A 281 1.570 -1.597 5.577 1.00 36.86 C ATOM 1098 O ILE A 281 2.794 -1.469 5.491 1.00 36.80 O ATOM 1099 CB ILE A 281 1.232 -0.252 3.401 1.00 36.54 C ATOM 1100 CG1 ILE A 281 1.083 1.163 4.061 1.00 36.90 C ATOM 1101 CG2 ILE A 281 0.608 -0.328 2.000 1.00 35.99 C ATOM 1102 CD1 ILE A 281 1.982 2.291 3.466 1.00 44.89 C ATOM 1103 H ILE A 281 -1.054 -0.246 4.906 1.00 0.00 H ATOM 1104 N ASN A 282 0.950 -1.929 6.721 1.00 33.79 N ATOM 1105 CA ASN A 282 1.612 -2.175 8.021 1.00 34.58 C ATOM 1106 C ASN A 282 2.411 -0.973 8.520 1.00 39.78 C ATOM 1107 O ASN A 282 3.542 -1.112 9.004 1.00 39.78 O ATOM 1108 CB ASN A 282 2.468 -3.467 8.004 1.00 32.80 C ATOM 1109 CG ASN A 282 1.648 -4.685 7.704 1.00 44.02 C ATOM 1110 OD1 ASN A 282 1.749 -5.276 6.631 1.00 41.25 O ATOM 1111 ND2 ASN A 282 0.789 -5.051 8.633 1.00 36.30 N ATOM 1112 HD22 ASN A 282 0.735 -4.524 9.528 1.00 0.00 H ATOM 1113 HD21 ASN A 282 0.165 -5.867 8.472 1.00 0.00 H ATOM 1114 H ASN A 282 -0.085 -2.021 6.690 1.00 0.00 H ATOM 1115 N GLN A 283 1.802 0.215 8.407 1.00 36.03 N ATOM 1116 CA GLN A 283 2.393 1.466 8.863 1.00 35.36 C ATOM 1117 C GLN A 283 1.478 2.145 9.893 1.00 40.24 C ATOM 1118 O GLN A 283 1.460 3.373 9.970 1.00 40.37 O ATOM 1119 CB GLN A 283 2.712 2.388 7.664 1.00 35.88 C ATOM 1120 CG GLN A 283 3.830 1.880 6.738 1.00 41.22 C ATOM 1121 CD GLN A 283 5.216 1.911 7.342 1.00 54.51 C ATOM 1122 OE1 GLN A 283 5.526 2.687 8.253 1.00 47.99 O ATOM 1123 NE2 GLN A 283 6.088 1.065 6.834 1.00 43.98 N ATOM 1124 HE22 GLN A 283 5.803 0.422 6.068 1.00 0.00 H ATOM 1125 HE21 GLN A 283 7.062 1.040 7.199 1.00 0.00 H ATOM 1126 H GLN A 283 0.858 0.246 7.971 1.00 0.00 H ATOM 1127 N GLU A 284 0.748 1.343 10.717 1.00 38.08 N ATOM 1128 CA GLU A 284 -0.174 1.830 11.761 1.00 38.79 C ATOM 1129 C GLU A 284 0.517 2.761 12.772 1.00 43.14 C ATOM 1130 O GLU A 284 -0.142 3.619 13.367 1.00 42.44 O ATOM 1131 CB GLU A 284 -0.866 0.687 12.533 1.00 40.83 C ATOM 1132 CG GLU A 284 -1.290 -0.521 11.721 1.00 55.16 C ATOM 1133 CD GLU A 284 -0.349 -1.699 11.881 1.00 75.72 C ATOM 1134 OE1 GLU A 284 -0.701 -2.643 12.626 1.00 73.07 O ATOM 1135 OE2 GLU A 284 0.736 -1.683 11.258 1.00 68.90 O ATOM 1136 H GLU A 284 0.848 0.314 10.602 1.00 0.00 H ATOM 1137 N SER A 285 1.839 2.580 12.973 1.00 40.08 N ATOM 1138 CA SER A 285 2.640 3.401 13.885 1.00 39.81 C ATOM 1139 C SER A 285 2.793 4.855 13.370 1.00 40.29 C ATOM 1140 O SER A 285 3.163 5.730 14.149 1.00 38.07 O ATOM 1141 CB SER A 285 4.005 2.759 14.139 1.00 42.85 C ATOM 1142 OG SER A 285 4.783 2.714 12.953 1.00 53.49 O ATOM 1143 HG SER A 285 5.658 2.294 13.149 1.00 0.00 H ATOM 1144 H SER A 285 2.315 1.816 12.452 1.00 0.00 H ATOM 1145 N CYS A 286 2.501 5.093 12.069 1.00 36.38 N ATOM 1146 CA CYS A 286 2.546 6.399 11.411 1.00 35.62 C ATOM 1147 C CYS A 286 1.219 7.168 11.508 1.00 36.06 C ATOM 1148 O CYS A 286 1.176 8.316 11.064 1.00 36.04 O ATOM 1149 CB CYS A 286 2.999 6.270 9.959 1.00 36.59 C ATOM 1150 SG CYS A 286 4.674 5.623 9.750 1.00 41.13 S ATOM 1151 H CYS A 286 2.221 4.277 11.488 1.00 0.00 H ATOM 1152 N ILE A 287 0.151 6.572 12.093 1.00 30.77 N ATOM 1153 CA ILE A 287 -1.169 7.223 12.182 1.00 29.80 C ATOM 1154 C ILE A 287 -1.150 8.413 13.154 1.00 34.27 C ATOM 1155 O ILE A 287 -1.617 9.498 12.785 1.00 31.78 O ATOM 1156 CB ILE A 287 -2.319 6.208 12.466 1.00 32.34 C ATOM 1157 CG1 ILE A 287 -2.497 5.283 11.233 1.00 32.25 C ATOM 1158 CG2 ILE A 287 -3.645 6.928 12.817 1.00 31.43 C ATOM 1159 CD1 ILE A 287 -3.305 3.944 11.449 1.00 36.65 C ATOM 1160 H ILE A 287 0.267 5.620 12.494 1.00 0.00 H ATOM 1161 N GLU A 288 -0.625 8.212 14.384 1.00 31.76 N ATOM 1162 CA GLU A 288 -0.502 9.287 15.370 1.00 32.72 C ATOM 1163 C GLU A 288 0.439 10.409 14.835 1.00 34.65 C ATOM 1164 O GLU A 288 -0.021 11.548 14.819 1.00 34.79 O ATOM 1165 CB GLU A 288 -0.123 8.746 16.769 1.00 35.08 C ATOM 1166 CG GLU A 288 -0.360 9.725 17.908 1.00 49.22 C ATOM 1167 CD GLU A 288 -1.786 10.206 18.120 1.00 70.93 C ATOM 1168 OE1 GLU A 288 -2.711 9.361 18.142 1.00 68.46 O ATOM 1169 OE2 GLU A 288 -1.975 11.433 18.283 1.00 63.85 O ATOM 1170 H GLU A 288 -0.297 7.259 14.639 1.00 0.00 H ATOM 1171 N PRO A 289 1.661 10.149 14.278 1.00 30.05 N ATOM 1172 CA PRO A 289 2.441 11.250 13.673 1.00 29.99 C ATOM 1173 C PRO A 289 1.695 11.935 12.505 1.00 32.97 C ATOM 1174 O PRO A 289 1.887 13.125 12.286 1.00 32.01 O ATOM 1175 CB PRO A 289 3.716 10.549 13.189 1.00 31.78 C ATOM 1176 CG PRO A 289 3.827 9.341 14.070 1.00 35.70 C ATOM 1177 CD PRO A 289 2.424 8.883 14.204 1.00 31.08 C ATOM 1178 N LEU A 290 0.832 11.197 11.774 1.00 29.32 N ATOM 1179 CA LEU A 290 0.012 11.790 10.701 1.00 27.78 C ATOM 1180 C LEU A 290 -0.990 12.783 11.297 1.00 29.09 C ATOM 1181 O LEU A 290 -1.097 13.910 10.813 1.00 28.75 O ATOM 1182 CB LEU A 290 -0.724 10.705 9.888 1.00 27.64 C ATOM 1183 CG LEU A 290 -1.632 11.195 8.741 1.00 31.50 C ATOM 1184 CD1 LEU A 290 -0.820 11.889 7.638 1.00 31.90 C ATOM 1185 CD2 LEU A 290 -2.438 10.052 8.168 1.00 30.90 C ATOM 1186 H LEU A 290 0.743 10.180 11.974 1.00 0.00 H ATOM 1187 N ALA A 291 -1.706 12.366 12.349 1.00 25.33 N ATOM 1188 CA ALA A 291 -2.681 13.176 13.058 1.00 25.66 C ATOM 1189 C ALA A 291 -2.025 14.443 13.614 1.00 28.99 C ATOM 1190 O ALA A 291 -2.615 15.519 13.517 1.00 27.66 O ATOM 1191 CB ALA A 291 -3.299 12.369 14.190 1.00 26.08 C ATOM 1192 H ALA A 291 -1.553 11.393 12.682 1.00 0.00 H ATOM 1193 N GLU A 292 -0.808 14.321 14.195 1.00 26.38 N ATOM 1194 CA GLU A 292 -0.056 15.469 14.720 1.00 25.86 C ATOM 1195 C GLU A 292 0.318 16.435 13.599 1.00 29.19 C ATOM 1196 O GLU A 292 0.152 17.631 13.779 1.00 29.82 O ATOM 1197 CB GLU A 292 1.195 15.016 15.506 1.00 28.09 C ATOM 1198 CG GLU A 292 0.871 14.568 16.922 1.00 40.72 C ATOM 1199 CD GLU A 292 2.045 14.137 17.784 1.00 69.36 C ATOM 1200 OE1 GLU A 292 2.983 14.949 17.972 1.00 66.93 O ATOM 1201 OE2 GLU A 292 2.014 12.993 18.293 1.00 57.84 O ATOM 1202 H GLU A 292 -0.387 13.373 14.273 1.00 0.00 H ATOM 1203 N SER A 293 0.762 15.923 12.432 1.00 27.14 N ATOM 1204 CA SER A 293 1.125 16.728 11.256 1.00 27.89 C ATOM 1205 C SER A 293 -0.068 17.527 10.713 1.00 29.91 C ATOM 1206 O SER A 293 0.090 18.688 10.333 1.00 27.65 O ATOM 1207 CB SER A 293 1.685 15.849 10.142 1.00 32.59 C ATOM 1208 OG SER A 293 2.785 15.088 10.603 1.00 47.84 O ATOM 1209 HG SER A 293 2.493 14.508 11.350 1.00 0.00 H ATOM 1210 H SER A 293 0.854 14.890 12.359 1.00 0.00 H ATOM 1211 N ILE A 294 -1.251 16.899 10.670 1.00 26.68 N ATOM 1212 CA ILE A 294 -2.475 17.539 10.178 1.00 25.44 C ATOM 1213 C ILE A 294 -2.866 18.652 11.148 1.00 28.89 C ATOM 1214 O ILE A 294 -3.180 19.762 10.710 1.00 29.47 O ATOM 1215 CB ILE A 294 -3.619 16.491 9.989 1.00 27.88 C ATOM 1216 CG1 ILE A 294 -3.307 15.545 8.806 1.00 28.24 C ATOM 1217 CG2 ILE A 294 -4.993 17.180 9.799 1.00 27.03 C ATOM 1218 CD1 ILE A 294 -4.142 14.195 8.844 1.00 28.21 C ATOM 1219 H ILE A 294 -1.303 15.914 11.000 1.00 0.00 H ATOM 1220 N THR A 295 -2.850 18.353 12.464 1.00 24.11 N ATOM 1221 CA THR A 295 -3.190 19.314 13.519 1.00 24.45 C ATOM 1222 C THR A 295 -2.214 20.493 13.462 1.00 30.81 C ATOM 1223 O THR A 295 -2.637 21.647 13.586 1.00 31.46 O ATOM 1224 CB THR A 295 -3.186 18.622 14.895 1.00 29.64 C ATOM 1225 OG1 THR A 295 -3.988 17.434 14.843 1.00 25.68 O ATOM 1226 CG2 THR A 295 -3.682 19.532 16.010 1.00 27.83 C ATOM 1227 HG1 THR A 295 -3.617 16.816 14.164 1.00 0.00 H ATOM 1228 H THR A 295 -2.582 17.388 12.746 1.00 0.00 H ATOM 1229 N ASP A 296 -0.921 20.195 13.236 1.00 27.49 N ATOM 1230 CA ASP A 296 0.133 21.199 13.135 1.00 28.65 C ATOM 1231 C ASP A 296 -0.150 22.163 11.967 1.00 33.71 C ATOM 1232 O ASP A 296 -0.193 23.362 12.194 1.00 32.60 O ATOM 1233 CB ASP A 296 1.510 20.553 12.993 1.00 30.21 C ATOM 1234 CG ASP A 296 2.596 21.602 12.880 1.00 41.36 C ATOM 1235 OD1 ASP A 296 2.939 22.201 13.911 1.00 38.07 O ATOM 1236 OD2 ASP A 296 3.065 21.853 11.744 1.00 46.05 O ATOM 1237 H ASP A 296 -0.659 19.194 13.127 1.00 0.00 H ATOM 1238 N VAL A 297 -0.376 21.636 10.746 1.00 31.77 N ATOM 1239 CA VAL A 297 -0.704 22.448 9.564 1.00 32.25 C ATOM 1240 C VAL A 297 -1.944 23.317 9.859 1.00 35.26 C ATOM 1241 O VAL A 297 -1.897 24.517 9.616 1.00 35.20 O ATOM 1242 CB VAL A 297 -0.865 21.595 8.269 1.00 37.86 C ATOM 1243 CG1 VAL A 297 -1.305 22.453 7.080 1.00 38.27 C ATOM 1244 CG2 VAL A 297 0.430 20.853 7.926 1.00 38.00 C ATOM 1245 H VAL A 297 -0.315 20.604 10.635 1.00 0.00 H ATOM 1246 N LEU A 298 -3.009 22.729 10.450 1.00 30.88 N ATOM 1247 CA LEU A 298 -4.269 23.420 10.750 1.00 30.31 C ATOM 1248 C LEU A 298 -4.125 24.598 11.723 1.00 35.19 C ATOM 1249 O LEU A 298 -4.523 25.715 11.388 1.00 34.21 O ATOM 1250 CB LEU A 298 -5.355 22.426 11.245 1.00 29.74 C ATOM 1251 CG LEU A 298 -6.736 23.026 11.610 1.00 33.53 C ATOM 1252 CD1 LEU A 298 -7.418 23.643 10.380 1.00 32.18 C ATOM 1253 CD2 LEU A 298 -7.673 21.964 12.232 1.00 33.89 C ATOM 1254 H LEU A 298 -2.930 21.725 10.708 1.00 0.00 H ATOM 1255 N VAL A 299 -3.587 24.338 12.920 1.00 32.33 N ATOM 1256 CA VAL A 299 -3.454 25.312 14.002 1.00 32.63 C ATOM 1257 C VAL A 299 -2.400 26.366 13.667 1.00 39.62 C ATOM 1258 O VAL A 299 -2.639 27.541 13.926 1.00 41.07 O ATOM 1259 CB VAL A 299 -3.232 24.633 15.393 1.00 36.11 C ATOM 1260 CG1 VAL A 299 -3.025 25.664 16.506 1.00 35.35 C ATOM 1261 CG2 VAL A 299 -4.397 23.703 15.745 1.00 35.75 C ATOM 1262 H VAL A 299 -3.238 23.374 13.093 1.00 0.00 H ATOM 1263 N ARG A 300 -1.271 25.962 13.071 1.00 36.89 N ATOM 1264 CA ARG A 300 -0.181 26.875 12.721 1.00 37.64 C ATOM 1265 C ARG A 300 -0.544 27.840 11.589 1.00 44.31 C ATOM 1266 O ARG A 300 -0.291 29.036 11.728 1.00 45.41 O ATOM 1267 CB ARG A 300 1.111 26.103 12.398 1.00 36.02 C ATOM 1268 CG ARG A 300 2.377 26.961 12.373 1.00 44.38 C ATOM 1269 CD ARG A 300 3.624 26.155 12.008 1.00 45.76 C ATOM 1270 NE ARG A 300 3.882 25.046 12.933 1.00 37.30 N ATOM 1271 CZ ARG A 300 4.424 25.181 14.142 1.00 50.88 C ATOM 1272 NH1 ARG A 300 4.763 26.384 14.595 1.00 36.81 N ATOM 1273 NH2 ARG A 300 4.627 24.116 14.908 1.00 36.59 N ATOM 1274 HE ARG A 300 3.624 24.087 12.623 1.00 0.00 H ATOM 1275 HH12 ARG A 300 5.186 26.484 15.540 1.00 0.00 H ATOM 1276 HH11 ARG A 300 4.605 27.225 14.004 1.00 0.00 H ATOM 1277 HH22 ARG A 300 5.051 24.227 15.851 1.00 0.00 H ATOM 1278 HH21 ARG A 300 4.362 23.171 14.565 1.00 0.00 H ATOM 1279 H ARG A 300 -1.163 24.952 12.846 1.00 0.00 H ATOM 1280 N THR A 301 -1.139 27.338 10.485 1.00 39.82 N ATOM 1281 CA THR A 301 -1.474 28.195 9.346 1.00 39.62 C ATOM 1282 C THR A 301 -2.816 28.921 9.473 1.00 43.09 C ATOM 1283 O THR A 301 -2.937 30.026 8.941 1.00 43.46 O ATOM 1284 CB THR A 301 -1.392 27.441 8.008 1.00 45.70 C ATOM 1285 OG1 THR A 301 -2.472 26.513 7.901 1.00 45.30 O ATOM 1286 CG2 THR A 301 -0.051 26.745 7.798 1.00 45.98 C ATOM 1287 HG1 THR A 301 -2.421 25.862 8.645 1.00 0.00 H ATOM 1288 H THR A 301 -1.363 26.323 10.443 1.00 0.00 H ATOM 1289 N LYS A 302 -3.815 28.321 10.154 1.00 37.45 N ATOM 1290 CA LYS A 302 -5.151 28.918 10.246 1.00 36.13 C ATOM 1291 C LYS A 302 -5.537 29.412 11.634 1.00 39.08 C ATOM 1292 O LYS A 302 -6.727 29.636 11.875 1.00 37.70 O ATOM 1293 CB LYS A 302 -6.237 27.950 9.695 1.00 37.43 C ATOM 1294 CG LYS A 302 -5.969 27.382 8.300 1.00 40.84 C ATOM 1295 CD LYS A 302 -5.935 28.453 7.205 1.00 46.19 C ATOM 1296 CE LYS A 302 -5.550 27.877 5.869 1.00 50.90 C ATOM 1297 NZ LYS A 302 -4.973 28.922 4.982 1.00 56.48 N ATOM 1298 HZ1 LYS A 302 -5.676 29.674 4.831 1.00 0.00 H ATOM 1299 HZ2 LYS A 302 -4.124 29.324 5.429 1.00 0.00 H ATOM 1300 HZ3 LYS A 302 -4.717 28.497 4.068 1.00 0.00 H ATOM 1301 H LYS A 302 -3.632 27.412 10.625 1.00 0.00 H ATOM 1302 N ARG A 303 -4.544 29.641 12.529 1.00 37.31 N ATOM 1303 CA ARG A 303 -4.736 30.123 13.908 1.00 38.29 C ATOM 1304 C ARG A 303 -5.760 31.263 14.038 1.00 42.35 C ATOM 1305 O ARG A 303 -6.771 31.102 14.727 1.00 42.19 O ATOM 1306 CB ARG A 303 -3.378 30.575 14.504 1.00 41.88 C ATOM 1307 CG ARG A 303 -3.402 30.866 16.011 1.00 55.51 C ATOM 1308 CD ARG A 303 -2.887 32.264 16.340 1.00 68.89 C ATOM 1309 NE ARG A 303 -1.594 32.553 15.712 1.00 79.69 N ATOM 1310 CZ ARG A 303 -1.123 33.774 15.475 1.00 93.28 C ATOM 1311 NH1 ARG A 303 -1.826 34.845 15.825 1.00 78.26 N ATOM 1312 NH2 ARG A 303 0.056 33.935 14.890 1.00 80.21 N ATOM 1313 HE ARG A 303 -1.002 31.745 15.432 1.00 0.00 H ATOM 1314 HH12 ARG A 303 -1.452 35.797 15.637 1.00 0.00 H ATOM 1315 HH11 ARG A 303 -2.751 34.732 16.287 1.00 0.00 H ATOM 1316 HH22 ARG A 303 0.419 34.892 14.707 1.00 0.00 H ATOM 1317 HH21 ARG A 303 0.617 33.104 14.614 1.00 0.00 H ATOM 1318 H ARG A 303 -3.568 29.462 12.217 1.00 0.00 H ATOM 1319 N ASP A 304 -5.476 32.407 13.390 1.00 39.00 N ATOM 1320 CA ASP A 304 -6.311 33.618 13.406 1.00 38.61 C ATOM 1321 C ASP A 304 -7.719 33.372 12.892 1.00 40.62 C ATOM 1322 O ASP A 304 -8.681 33.772 13.547 1.00 40.66 O ATOM 1323 CB ASP A 304 -5.630 34.748 12.615 1.00 40.39 C ATOM 1324 CG ASP A 304 -4.335 35.225 13.240 1.00 53.63 C ATOM 1325 OD1 ASP A 304 -4.248 35.244 14.492 1.00 54.58 O ATOM 1326 OD2 ASP A 304 -3.406 35.577 12.481 1.00 61.19 O ATOM 1327 H ASP A 304 -4.597 32.438 12.834 1.00 0.00 H ATOM 1328 N TRP A 305 -7.841 32.690 11.742 1.00 36.17 N ATOM 1329 CA TRP A 305 -9.133 32.341 11.148 1.00 35.26 C ATOM 1330 C TRP A 305 -9.944 31.479 12.128 1.00 38.35 C ATOM 1331 O TRP A 305 -11.077 31.839 12.444 1.00 37.84 O ATOM 1332 CB TRP A 305 -8.943 31.647 9.789 1.00 33.76 C ATOM 1333 CG TRP A 305 -10.217 31.483 9.006 1.00 34.11 C ATOM 1334 CD1 TRP A 305 -10.726 32.342 8.077 1.00 36.90 C ATOM 1335 CD2 TRP A 305 -11.141 30.389 9.092 1.00 33.62 C ATOM 1336 NE1 TRP A 305 -11.924 31.865 7.596 1.00 36.18 N ATOM 1337 CE2 TRP A 305 -12.203 30.666 8.200 1.00 37.25 C ATOM 1338 CE3 TRP A 305 -11.174 29.192 9.833 1.00 34.20 C ATOM 1339 CZ2 TRP A 305 -13.277 29.785 8.018 1.00 35.90 C ATOM 1340 CZ3 TRP A 305 -12.246 28.328 9.661 1.00 35.14 C ATOM 1341 CH2 TRP A 305 -13.269 28.615 8.748 1.00 35.52 C ATOM 1342 HE1 TRP A 305 -12.522 32.338 6.888 1.00 0.00 H ATOM 1343 H TRP A 305 -6.974 32.395 11.248 1.00 0.00 H ATOM 1344 N LEU A 306 -9.335 30.403 12.678 1.00 35.12 N ATOM 1345 CA LEU A 306 -9.979 29.499 13.643 1.00 34.31 C ATOM 1346 C LEU A 306 -10.508 30.228 14.881 1.00 38.71 C ATOM 1347 O LEU A 306 -11.626 29.950 15.311 1.00 36.66 O ATOM 1348 CB LEU A 306 -9.041 28.346 14.054 1.00 34.12 C ATOM 1349 CG LEU A 306 -8.682 27.315 12.976 1.00 37.90 C ATOM 1350 CD1 LEU A 306 -7.385 26.600 13.311 1.00 38.03 C ATOM 1351 CD2 LEU A 306 -9.828 26.334 12.725 1.00 39.75 C ATOM 1352 H LEU A 306 -8.352 30.203 12.402 1.00 0.00 H ATOM 1353 N VAL A 307 -9.721 31.178 15.434 1.00 37.90 N ATOM 1354 CA VAL A 307 -10.123 31.977 16.602 1.00 38.50 C ATOM 1355 C VAL A 307 -11.335 32.854 16.260 1.00 41.25 C ATOM 1356 O VAL A 307 -12.302 32.866 17.019 1.00 40.20 O ATOM 1357 CB VAL A 307 -8.923 32.763 17.225 1.00 43.54 C ATOM 1358 CG1 VAL A 307 -9.383 33.994 18.017 1.00 43.72 C ATOM 1359 CG2 VAL A 307 -8.082 31.844 18.114 1.00 43.33 C ATOM 1360 H VAL A 307 -8.786 31.352 15.013 1.00 0.00 H ATOM 1361 N LYS A 308 -11.315 33.519 15.091 1.00 39.28 N ATOM 1362 CA LYS A 308 -12.425 34.367 14.623 1.00 40.21 C ATOM 1363 C LYS A 308 -13.725 33.563 14.395 1.00 44.41 C ATOM 1364 O LYS A 308 -14.820 34.093 14.592 1.00 44.79 O ATOM 1365 CB LYS A 308 -12.013 35.125 13.341 1.00 43.99 C ATOM 1366 CG LYS A 308 -13.033 36.145 12.817 1.00 64.39 C ATOM 1367 CD LYS A 308 -12.974 37.491 13.546 1.00 77.79 C ATOM 1368 CE LYS A 308 -14.124 38.402 13.164 1.00 88.50 C ATOM 1369 NZ LYS A 308 -15.403 38.005 13.819 1.00 93.55 N ATOM 1370 HZ1 LYS A 308 -15.651 37.036 13.534 1.00 0.00 H ATOM 1371 HZ2 LYS A 308 -15.289 38.045 14.852 1.00 0.00 H ATOM 1372 HZ3 LYS A 308 -16.158 38.658 13.526 1.00 0.00 H ATOM 1373 H LYS A 308 -10.473 33.430 14.487 1.00 0.00 H ATOM 1374 N GLN A 309 -13.597 32.283 14.017 1.00 39.54 N ATOM 1375 CA GLN A 309 -14.733 31.404 13.747 1.00 38.34 C ATOM 1376 C GLN A 309 -15.207 30.611 14.958 1.00 42.38 C ATOM 1377 O GLN A 309 -16.074 29.752 14.812 1.00 42.65 O ATOM 1378 CB GLN A 309 -14.426 30.473 12.563 1.00 39.22 C ATOM 1379 CG GLN A 309 -14.082 31.210 11.262 1.00 51.58 C ATOM 1380 CD GLN A 309 -15.161 32.126 10.733 1.00 65.13 C ATOM 1381 OE1 GLN A 309 -14.882 33.226 10.254 1.00 64.31 O ATOM 1382 NE2 GLN A 309 -16.413 31.699 10.791 1.00 52.78 N ATOM 1383 HE22 GLN A 309 -16.626 30.767 11.200 1.00 0.00 H ATOM 1384 HE21 GLN A 309 -17.183 32.296 10.428 1.00 0.00 H ATOM 1385 H GLN A 309 -12.638 31.895 13.910 1.00 0.00 H ATOM 1386 N ARG A 310 -14.669 30.923 16.158 1.00 38.06 N ATOM 1387 CA ARG A 310 -14.987 30.305 17.454 1.00 37.50 C ATOM 1388 C ARG A 310 -14.557 28.817 17.534 1.00 39.79 C ATOM 1389 O ARG A 310 -15.214 28.004 18.196 1.00 39.86 O ATOM 1390 CB ARG A 310 -16.470 30.505 17.871 1.00 39.11 C ATOM 1391 CG ARG A 310 -17.026 31.932 17.665 1.00 50.40 C ATOM 1392 CD ARG A 310 -18.529 32.058 17.902 1.00 59.61 C ATOM 1393 NE ARG A 310 -19.309 31.008 17.238 1.00 67.30 N ATOM 1394 CZ ARG A 310 -19.960 30.039 17.876 1.00 82.84 C ATOM 1395 NH1 ARG A 310 -19.946 29.980 19.204 1.00 68.20 N ATOM 1396 NH2 ARG A 310 -20.628 29.120 17.193 1.00 71.97 N ATOM 1397 HE ARG A 310 -19.356 31.022 16.199 1.00 0.00 H ATOM 1398 HH12 ARG A 310 -20.457 29.220 19.696 1.00 0.00 H ATOM 1399 HH11 ARG A 310 -19.424 30.694 19.751 1.00 0.00 H ATOM 1400 HH22 ARG A 310 -21.135 28.365 17.696 1.00 0.00 H ATOM 1401 HH21 ARG A 310 -20.645 29.154 16.154 1.00 0.00 H ATOM 1402 H ARG A 310 -13.955 31.679 16.166 1.00 0.00 H ATOM 1403 N GLY A 311 -13.427 28.502 16.899 1.00 34.37 N ATOM 1404 CA GLY A 311 -12.816 27.180 16.927 1.00 32.96 C ATOM 1405 C GLY A 311 -13.757 26.044 16.602 1.00 33.94 C ATOM 1406 O GLY A 311 -14.525 26.131 15.637 1.00 32.21 O ATOM 1407 H GLY A 311 -12.953 29.247 16.350 1.00 0.00 H ATOM 1408 N TRP A 312 -13.743 25.005 17.446 1.00 29.42 N ATOM 1409 CA TRP A 312 -14.541 23.802 17.258 1.00 29.53 C ATOM 1410 C TRP A 312 -16.046 23.995 17.499 1.00 34.55 C ATOM 1411 O TRP A 312 -16.823 23.198 16.978 1.00 33.97 O ATOM 1412 CB TRP A 312 -13.966 22.634 18.062 1.00 28.57 C ATOM 1413 CG TRP A 312 -12.665 22.186 17.468 1.00 30.04 C ATOM 1414 CD1 TRP A 312 -11.413 22.507 17.909 1.00 32.85 C ATOM 1415 CD2 TRP A 312 -12.488 21.526 16.205 1.00 30.20 C ATOM 1416 NE1 TRP A 312 -10.468 22.015 17.042 1.00 32.59 N ATOM 1417 CE2 TRP A 312 -11.098 21.412 15.984 1.00 34.04 C ATOM 1418 CE3 TRP A 312 -13.373 20.981 15.251 1.00 31.68 C ATOM 1419 CZ2 TRP A 312 -10.568 20.753 14.866 1.00 34.05 C ATOM 1420 CZ3 TRP A 312 -12.847 20.340 14.138 1.00 33.16 C ATOM 1421 CH2 TRP A 312 -11.463 20.230 13.953 1.00 33.88 C ATOM 1422 HE1 TRP A 312 -9.438 22.088 17.168 1.00 0.00 H ATOM 1423 H TRP A 312 -13.128 25.060 18.283 1.00 0.00 H ATOM 1424 N ASP A 313 -16.467 25.060 18.234 1.00 31.32 N ATOM 1425 CA ASP A 313 -17.886 25.384 18.417 1.00 30.50 C ATOM 1426 C ASP A 313 -18.419 25.919 17.093 1.00 32.50 C ATOM 1427 O ASP A 313 -19.548 25.624 16.725 1.00 32.57 O ATOM 1428 CB ASP A 313 -18.085 26.434 19.527 1.00 32.76 C ATOM 1429 CG ASP A 313 -17.959 25.881 20.937 1.00 42.92 C ATOM 1430 OD1 ASP A 313 -18.561 24.820 21.219 1.00 44.20 O ATOM 1431 OD2 ASP A 313 -17.280 26.521 21.762 1.00 50.51 O ATOM 1432 H ASP A 313 -15.754 25.669 18.684 1.00 0.00 H ATOM 1433 N GLY A 314 -17.583 26.687 16.397 1.00 29.36 N ATOM 1434 CA GLY A 314 -17.863 27.230 15.076 1.00 28.93 C ATOM 1435 C GLY A 314 -17.992 26.129 14.049 1.00 31.48 C ATOM 1436 O GLY A 314 -18.887 26.198 13.215 1.00 30.06 O ATOM 1437 H GLY A 314 -16.664 26.915 16.828 1.00 0.00 H ATOM 1438 N PHE A 315 -17.117 25.076 14.124 1.00 27.39 N ATOM 1439 CA PHE A 315 -17.164 23.902 13.236 1.00 26.70 C ATOM 1440 C PHE A 315 -18.522 23.192 13.397 1.00 32.75 C ATOM 1441 O PHE A 315 -19.205 22.921 12.398 1.00 31.55 O ATOM 1442 CB PHE A 315 -16.014 22.919 13.575 1.00 27.26 C ATOM 1443 CG PHE A 315 -16.033 21.576 12.865 1.00 27.84 C ATOM 1444 CD1 PHE A 315 -15.527 21.444 11.572 1.00 30.51 C ATOM 1445 CD2 PHE A 315 -16.510 20.434 13.508 1.00 27.28 C ATOM 1446 CE1 PHE A 315 -15.493 20.192 10.938 1.00 30.84 C ATOM 1447 CE2 PHE A 315 -16.496 19.190 12.869 1.00 30.03 C ATOM 1448 CZ PHE A 315 -15.984 19.076 11.585 1.00 28.75 C ATOM 1449 H PHE A 315 -16.375 25.108 14.852 1.00 0.00 H ATOM 1450 N VAL A 316 -18.909 22.901 14.662 1.00 29.61 N ATOM 1451 CA VAL A 316 -20.177 22.225 14.982 1.00 29.75 C ATOM 1452 C VAL A 316 -21.376 23.013 14.447 1.00 34.97 C ATOM 1453 O VAL A 316 -22.230 22.429 13.776 1.00 35.72 O ATOM 1454 CB VAL A 316 -20.310 21.873 16.492 1.00 32.65 C ATOM 1455 CG1 VAL A 316 -21.694 21.291 16.814 1.00 32.48 C ATOM 1456 CG2 VAL A 316 -19.213 20.901 16.912 1.00 32.04 C ATOM 1457 H VAL A 316 -18.280 23.168 15.446 1.00 0.00 H ATOM 1458 N GLU A 317 -21.420 24.330 14.722 1.00 32.78 N ATOM 1459 CA GLU A 317 -22.488 25.236 14.258 1.00 32.70 C ATOM 1460 C GLU A 317 -22.560 25.286 12.721 1.00 33.82 C ATOM 1461 O GLU A 317 -23.662 25.258 12.158 1.00 32.73 O ATOM 1462 CB GLU A 317 -22.304 26.654 14.844 1.00 34.37 C ATOM 1463 CG GLU A 317 -23.456 27.599 14.516 1.00 48.11 C ATOM 1464 CD GLU A 317 -23.335 29.021 15.028 1.00 74.10 C ATOM 1465 OE1 GLU A 317 -23.242 29.208 16.262 1.00 80.36 O ATOM 1466 OE2 GLU A 317 -23.368 29.953 14.194 1.00 65.46 O ATOM 1467 H GLU A 317 -20.654 24.734 15.297 1.00 0.00 H ATOM 1468 N PHE A 318 -21.401 25.340 12.046 1.00 29.06 N ATOM 1469 CA PHE A 318 -21.367 25.384 10.585 1.00 29.02 C ATOM 1470 C PHE A 318 -22.060 24.196 9.931 1.00 32.09 C ATOM 1471 O PHE A 318 -22.837 24.378 8.997 1.00 31.47 O ATOM 1472 CB PHE A 318 -19.937 25.558 10.044 1.00 30.90 C ATOM 1473 CG PHE A 318 -19.873 25.610 8.534 1.00 32.08 C ATOM 1474 CD1 PHE A 318 -20.166 26.783 7.849 1.00 35.45 C ATOM 1475 CD2 PHE A 318 -19.546 24.479 7.797 1.00 33.85 C ATOM 1476 CE1 PHE A 318 -20.106 26.829 6.454 1.00 36.71 C ATOM 1477 CE2 PHE A 318 -19.476 24.529 6.401 1.00 36.63 C ATOM 1478 CZ PHE A 318 -19.753 25.703 5.740 1.00 34.73 C ATOM 1479 H PHE A 318 -20.506 25.351 12.575 1.00 0.00 H ATOM 1480 N PHE A 319 -21.811 22.991 10.423 1.00 27.73 N ATOM 1481 CA PHE A 319 -22.429 21.809 9.833 1.00 27.38 C ATOM 1482 C PHE A 319 -23.799 21.442 10.426 1.00 33.48 C ATOM 1483 O PHE A 319 -24.364 20.401 10.072 1.00 34.68 O ATOM 1484 CB PHE A 319 -21.458 20.625 9.911 1.00 28.75 C ATOM 1485 CG PHE A 319 -20.273 20.815 8.996 1.00 29.39 C ATOM 1486 CD1 PHE A 319 -20.425 20.751 7.613 1.00 29.22 C ATOM 1487 CD2 PHE A 319 -19.007 21.079 9.515 1.00 30.86 C ATOM 1488 CE1 PHE A 319 -19.329 20.940 6.765 1.00 30.64 C ATOM 1489 CE2 PHE A 319 -17.910 21.254 8.667 1.00 32.50 C ATOM 1490 CZ PHE A 319 -18.080 21.185 7.297 1.00 30.72 C ATOM 1491 H PHE A 319 -21.170 22.887 11.236 1.00 0.00 H ATOM 1492 N HIS A 320 -24.330 22.296 11.306 1.00 28.51 N ATOM 1493 CA HIS A 320 -25.624 22.106 11.942 1.00 28.39 C ATOM 1494 C HIS A 320 -26.728 22.804 11.120 1.00 31.52 C ATOM 1495 O HIS A 320 -26.880 24.021 11.188 1.00 30.22 O ATOM 1496 CB HIS A 320 -25.566 22.591 13.396 1.00 29.74 C ATOM 1497 CG HIS A 320 -26.849 22.382 14.126 1.00 33.97 C ATOM 1498 ND1 HIS A 320 -27.342 21.113 14.359 1.00 36.55 N ATOM 1499 CD2 HIS A 320 -27.728 23.290 14.601 1.00 36.08 C ATOM 1500 CE1 HIS A 320 -28.496 21.286 14.982 1.00 36.19 C ATOM 1501 NE2 HIS A 320 -28.775 22.578 15.141 1.00 36.32 N ATOM 1502 H HIS A 320 -23.785 23.147 11.551 1.00 0.00 H ATOM 1503 N VAL A 321 -27.478 22.030 10.323 1.00 30.25 N ATOM 1504 CA VAL A 321 -28.499 22.590 9.421 1.00 30.88 C ATOM 1505 C VAL A 321 -29.939 22.169 9.748 1.00 37.49 C ATOM 1506 O VAL A 321 -30.888 22.784 9.243 1.00 37.46 O ATOM 1507 CB VAL A 321 -28.167 22.307 7.924 1.00 33.99 C ATOM 1508 CG1 VAL A 321 -26.942 23.103 7.458 1.00 33.50 C ATOM 1509 CG2 VAL A 321 -27.972 20.813 7.662 1.00 33.55 C ATOM 1510 H VAL A 321 -27.334 21.000 10.342 1.00 0.00 H ATOM 1511 N GLU A 322 -30.114 21.141 10.566 1.00 37.09 N ATOM 1512 CA GLU A 322 -31.445 20.605 10.880 1.00 38.34 C ATOM 1513 C GLU A 322 -32.400 21.601 11.598 1.00 43.07 C ATOM 1514 O GLU A 322 -33.598 21.321 11.660 1.00 44.92 O ATOM 1515 CB GLU A 322 -31.333 19.274 11.656 1.00 39.92 C ATOM 1516 CG GLU A 322 -30.750 19.384 13.053 1.00 50.85 C ATOM 1517 CD GLU A 322 -30.584 18.066 13.788 1.00 75.56 C ATOM 1518 OE1 GLU A 322 -31.116 17.951 14.915 1.00 67.81 O ATOM 1519 OE2 GLU A 322 -29.919 17.151 13.248 1.00 73.60 O ATOM 1520 H GLU A 322 -29.279 20.698 11.001 1.00 0.00 H ATOM 1521 N ASP A 323 -31.896 22.751 12.098 1.00 38.68 N ATOM 1522 CA ASP A 323 -32.716 23.750 12.818 1.00 37.83 C ATOM 1523 C ASP A 323 -32.917 25.087 12.075 1.00 41.30 C ATOM 1524 O ASP A 323 -33.342 26.069 12.692 1.00 40.78 O ATOM 1525 CB ASP A 323 -32.134 24.008 14.230 1.00 39.29 C ATOM 1526 CG ASP A 323 -32.082 22.792 15.139 1.00 47.26 C ATOM 1527 OD1 ASP A 323 -32.800 21.813 14.864 1.00 46.68 O ATOM 1528 OD2 ASP A 323 -31.326 22.827 16.133 1.00 53.93 O ATOM 1529 H ASP A 323 -30.882 22.943 11.970 1.00 0.00 H ATOM 1530 N LEU A 324 -32.624 25.136 10.763 1.00 37.71 N ATOM 1531 CA LEU A 324 -32.759 26.379 9.993 1.00 37.28 C ATOM 1532 C LEU A 324 -34.209 26.856 9.827 1.00 40.55 C ATOM 1533 O LEU A 324 -34.419 28.053 9.640 1.00 39.52 O ATOM 1534 CB LEU A 324 -32.050 26.296 8.633 1.00 37.16 C ATOM 1535 CG LEU A 324 -30.518 26.171 8.651 1.00 41.94 C ATOM 1536 CD1 LEU A 324 -29.984 25.945 7.247 1.00 42.27 C ATOM 1537 CD2 LEU A 324 -29.850 27.399 9.259 1.00 44.09 C ATOM 1538 H LEU A 324 -32.294 24.274 10.283 1.00 0.00 H ATOM 1539 N GLU A 325 -35.190 25.926 9.940 1.00 38.10 N ATOM 1540 CA GLU A 325 -36.663 26.080 9.855 1.00 61.83 C ATOM 1541 C GLU A 325 -37.191 25.900 8.435 1.00102.17 C ATOM 1542 O GLU A 325 -37.803 24.877 8.128 1.00 69.62 O ATOM 1543 CB GLU A 325 -37.198 27.383 10.489 1.00 62.96 C ATOM 1544 CG GLU A 325 -37.854 27.189 11.846 1.00 71.70 C ATOM 1545 CD GLU A 325 -36.967 27.292 13.075 1.00 86.97 C ATOM 1546 OE1 GLU A 325 -37.450 26.947 14.179 1.00 76.15 O ATOM 1547 OE2 GLU A 325 -35.801 27.726 12.945 1.00 77.51 O ATOM 1548 H GLU A 325 -34.858 24.956 10.113 1.00 0.00 H TER 1549 GLU A 325 HETATM 1550 O HOH 1 -18.062 6.838 11.614 1.00 37.81 O HETATM 1551 O HOH 2 -9.977 6.858 18.229 1.00 38.46 O HETATM 1552 O HOH 3 -31.538 22.171 18.728 1.00 47.00 O HETATM 1553 O HOH 4 -16.795 6.907 4.450 1.00 33.44 O HETATM 1554 O HOH 5 -9.712 4.174 18.215 1.00 38.10 O HETATM 1555 O HOH 6 -35.440 21.701 14.339 1.00 49.52 O HETATM 1556 O HOH 7 4.119 14.436 13.038 1.00 44.31 O HETATM 1557 O HOH 8 -21.153 17.041 24.130 1.00 42.20 O HETATM 1558 O HOH 9 -22.908 19.828 13.505 1.00 31.03 O HETATM 1559 O HOH 10 0.037 -4.829 2.530 1.00 59.68 O HETATM 1560 O HOH 11 -22.040 11.166 14.139 1.00 43.04 O HETATM 1561 O HOH 12 -11.126 17.954 24.581 1.00 48.85 O HETATM 1562 O HOH 13 -12.422 25.344 20.017 1.00 36.60 O HETATM 1563 O HOH 14 -9.768 25.044 22.820 1.00 42.20 O HETATM 1564 O HOH 15 -32.645 30.047 10.162 1.00 58.25 O HETATM 1565 O HOH 16 -13.699 32.161 5.211 1.00 56.92 O HETATM 1566 O HOH 17 -35.263 23.207 10.617 1.00 48.68 O HETATM 1567 O HOH 18 -22.702 27.725 18.483 1.00 61.54 O HETATM 1568 O HOH 19 -17.817 6.126 -3.077 1.00 54.95 O HETATM 1569 O HOH 20 -5.664 28.373 2.359 1.00 48.97 O HETATM 1570 O HOH 21 3.048 19.521 9.906 1.00 58.19 O HETATM 1571 O HOH 22 -15.496 6.864 12.549 1.00 36.92 O HETATM 1572 O HOH 23 -33.797 18.474 14.824 1.00 56.06 O HETATM 1573 O HOH 24 -7.656 22.317 25.102 1.00 36.47 O HETATM 1574 O HOH 25 -8.463 19.648 25.098 1.00 52.87 O HETATM 1575 O HOH 26 -21.687 25.048 18.336 1.00 44.57 O HETATM 1576 O HOH 27 -15.376 6.142 6.618 1.00 44.15 O HETATM 1577 O HOH 28 -19.559 15.165 0.881 1.00 47.62 O HETATM 1578 O HOH 29 -12.471 7.281 19.078 1.00 42.61 O HETATM 1579 O HOH 30 0.838 -7.539 9.867 1.00 53.93 O HETATM 1580 O HOH 31 -29.428 24.572 12.149 1.00 32.63 O HETATM 1581 O HOH 32 -10.384 22.490 -4.612 1.00 64.57 O HETATM 1582 O HOH 33 -13.862 8.629 21.171 1.00 47.25 O HETATM 1583 O HOH 34 -5.410 4.785 -4.702 1.00 44.01 O HETATM 1584 O HOH 35 -8.016 4.288 2.114 1.00 28.85 O HETATM 1585 O HOH 36 -3.578 9.721 -9.560 1.00 32.37 O HETATM 1586 O HOH 37 -4.258 16.366 22.711 1.00 37.04 O HETATM 1587 O HOH 38 -17.619 29.406 11.868 1.00 43.18 O HETATM 1588 O HOH 39 -4.164 23.959 -3.787 1.00 55.53 O HETATM 1589 O HOH 40 -5.534 22.024 26.852 1.00 44.64 O HETATM 1590 O HOH 41 -22.568 17.114 16.690 1.00 47.20 O HETATM 1591 O HOH 42 -5.416 1.306 0.545 1.00 41.82 O HETATM 1592 O HOH 43 3.386 9.780 -8.218 1.00 51.64 O HETATM 1593 O HOH 44 -24.733 19.229 7.492 1.00 40.46 O HETATM 1594 O HOH 45 -0.108 5.536 15.511 1.00 42.25 O HETATM 1595 O HOH 46 -12.808 20.690 -0.396 1.00 50.40 O HETATM 1596 O HOH 47 -27.506 19.157 10.672 1.00 43.27 O HETATM 1597 O HOH 48 -8.718 7.772 -9.011 1.00 42.31 O HETATM 1598 O HOH 49 -7.470 26.202 3.260 1.00 37.78 O HETATM 1599 O HOH 50 -22.714 13.267 5.537 1.00 44.71 O HETATM 1600 O HOH 51 -14.081 24.420 22.850 1.00 47.57 O HETATM 1601 O HOH 52 -21.462 8.241 9.363 1.00 57.55 O HETATM 1602 O HOH 53 -22.248 9.839 7.284 1.00 37.76 O HETATM 1603 O HOH 54 -6.121 5.193 23.432 1.00 76.18 O HETATM 1604 O HOH 55 -18.085 14.196 -6.186 1.00 59.73 O HETATM 1605 O HOH 56 -13.336 25.804 -1.022 1.00 43.03 O HETATM 1606 O HOH 57 -24.596 15.030 6.843 1.00 61.03 O HETATM 1607 O HOH 58 6.573 9.182 -2.354 1.00 50.14 O HETATM 1608 O HOH 59 -14.172 12.175 -6.528 1.00 36.79 O HETATM 1609 O HOH 60 -4.302 17.832 31.645 1.00 51.87 O HETATM 1610 O HOH 61 -3.156 32.647 11.414 1.00 52.08 O HETATM 1611 O HOH 62 -16.567 28.235 6.373 1.00 27.84 O HETATM 1612 O HOH 63 -9.346 26.300 5.180 1.00 42.18 O HETATM 1613 O HOH 64 -9.670 0.029 8.012 1.00 52.75 O HETATM 1614 O HOH 65 -35.965 19.609 12.651 1.00 69.30 O HETATM 1615 O HOH 66 -11.190 23.610 -2.282 1.00 51.67 O HETATM 1616 O HOH 67 -5.579 32.490 9.639 1.00 53.41 O HETATM 1617 O HOH 68 -1.578 24.078 -4.683 1.00 38.65 O HETATM 1618 O HOH 69 -15.648 24.600 25.342 1.00 60.22 O HETATM 1619 O HOH 70 -16.042 9.852 -6.210 1.00 38.06 O HETATM 1620 O HOH 71 -36.831 23.902 13.270 1.00 56.75 O HETATM 1621 O HOH 72 -21.342 9.765 16.390 1.00 44.64 O HETATM 1622 O HOH 73 -26.748 18.183 13.096 1.00 69.98 O HETATM 1623 O HOH 74 1.194 16.813 21.564 1.00 37.59 O HETATM 1624 O HOH 75 -17.658 29.861 8.278 1.00 40.69 O HETATM 1625 O HOH 76 -27.036 15.380 13.538 1.00 67.90 O HETATM 1626 O HOH 77 -5.766 37.930 11.638 1.00 76.17 O HETATM 1627 O HOH 78 -7.158 1.362 2.617 1.00 55.73 O HETATM 1628 O HOH 79 6.501 22.265 12.622 1.00 66.01 O HETATM 1629 O HOH 80 6.052 11.079 -4.402 1.00 45.28 O HETATM 1630 O HOH 81 -16.358 19.437 1.284 1.00 58.47 O HETATM 1631 O HOH 82 -6.197 -3.187 6.987 1.00 37.54 O HETATM 1632 O HOH 83 -6.923 11.776 22.199 1.00 65.24 O HETATM 1633 O HOH 84 -1.404 8.706 -10.808 1.00 41.17 O HETATM 1634 O HOH 85 -4.152 13.265 21.708 1.00 57.49 O HETATM 1635 O HOH 86 -18.879 8.658 -5.846 1.00 60.02 O HETATM 1636 O HOH 87 -24.173 24.244 17.167 1.00 62.18 O HETATM 1637 O HOH 88 -11.378 2.978 -0.817 1.00 52.48 O HETATM 1638 O HOH 89 -8.927 -0.258 3.956 1.00 60.22 O HETATM 1639 O HOH 90 -8.703 25.828 -3.762 1.00 64.89 O HETATM 1640 O HOH 91 -21.955 28.871 10.494 1.00 30.06 O HETATM 1641 O HOH 92 1.493 17.773 -4.880 1.00 42.50 O HETATM 1642 O HOH 93 -12.049 29.727 20.334 1.00 79.03 O HETATM 1643 O HOH 94 1.533 5.135 17.641 1.00 48.69 O HETATM 1644 O HOH 95 -17.751 26.727 1.786 1.00 52.54 O HETATM 1645 O HOH 96 -25.307 21.824 17.663 1.00 51.51 O HETATM 1646 O HOH 97 6.364 13.408 10.971 1.00 51.96 O HETATM 1647 O HOH 98 -7.362 -4.356 2.799 1.00 45.21 O HETATM 1648 O HOH 99 -10.718 3.871 2.263 1.00 37.80 O HETATM 1649 O HOH 100 -24.727 12.938 14.061 1.00 52.93 O HETATM 1650 O HOH 101 -9.020 -3.189 17.109 1.00 56.05 O HETATM 1651 O HOH 102 5.644 20.344 -3.104 1.00 68.08 O HETATM 1652 O HOH 103 -4.179 32.273 19.481 1.00 71.29 O HETATM 1653 O HOH 104 -7.172 3.300 -0.295 1.00 40.35 O HETATM 1654 O HOH 105 -9.960 27.851 21.081 1.00 68.08 O HETATM 1655 O HOH 106 -3.723 0.611 14.322 1.00 69.35 O HETATM 1656 O HOH 107 -11.429 1.101 3.136 1.00 63.27 O HETATM 1657 O HOH 108 2.149 15.384 -3.773 1.00 32.91 O HETATM 1658 C4 CN A 7 -10.225 17.097 -6.458 1.00 -0.07 C HETATM 1659 C13 CN A 7 -11.007 17.096 -5.325 1.00 -0.06 C HETATM 1660 C20 CN A 7 -10.426 16.994 -4.078 1.00 -0.04 C HETATM 1661 C18 CN A 7 -9.046 16.897 -3.959 1.00 -0.02 C HETATM 1662 C11 CN A 7 -8.276 16.879 -5.101 1.00 -0.06 C HETATM 1663 C3 CN A 7 -8.860 16.984 -6.344 1.00 -0.07 C HETATM 1664 H14 CN A 7 -8.242 16.977 -7.234 1.00 0.06 H HETATM 1665 H16 CN A 7 -7.199 16.781 -5.021 1.00 0.06 H HETATM 1666 C19 CN A 7 -8.382 16.791 -2.683 1.00 -0.00 C HETATM 1667 C22 CN A 7 -8.245 17.817 -1.752 1.00 0.07 C HETATM 1668 C17 CN A 7 -7.660 17.609 -0.506 1.00 -0.01 C HETATM 1669 C21 CN A 7 -7.694 18.833 0.223 1.00 -0.03 C HETATM 1670 C24 CN A 7 -8.268 19.782 -0.593 1.00 0.09 C HETATM 1671 C25 CN A 7 -8.605 21.148 -0.295 1.00 0.08 C HETATM 1672 O38 CN A 7 -9.727 21.604 -0.438 1.00 -0.56 O HETATM 1673 O40 CN A 7 -7.582 21.861 0.221 1.00 -0.56 O HETATM 1674 N36 CN A 7 -8.600 19.151 -1.768 1.00 -0.26 N HETATM 1675 C33 CN A 7 -9.043 19.910 -2.933 1.00 0.09 C HETATM 1676 C34 CN A 7 -7.769 20.243 -3.701 1.00 -0.01 C HETATM 1677 N37 CN A 7 -7.925 21.213 -4.819 1.00 0.24 N HETATM 1678 C26 CN A 7 -8.198 20.475 -6.092 1.00 -0.01 C HETATM 1679 C28 CN A 7 -8.126 21.459 -7.250 1.00 0.09 C HETATM 1680 O39 CN A 7 -6.824 22.047 -7.259 1.00 -0.37 O HETATM 1681 C29 CN A 7 -6.652 22.874 -6.108 1.00 0.09 C HETATM 1682 C27 CN A 7 -6.645 21.982 -4.877 1.00 -0.01 C HETATM 1683 H19 CN A 7 -6.548 22.602 -3.974 1.00 0.08 H HETATM 1684 H20 CN A 7 -5.798 21.282 -4.935 1.00 0.08 H HETATM 1685 H21 CN A 7 -5.698 23.417 -6.179 1.00 0.06 H HETATM 1686 H22 CN A 7 -7.480 23.595 -6.041 1.00 0.06 H HETATM 1687 H10 CN A 7 -8.887 22.243 -7.120 1.00 0.06 H HETATM 1688 H11 CN A 7 -8.302 20.931 -8.199 1.00 0.06 H HETATM 1689 H8 CN A 7 -7.446 19.684 -6.230 1.00 0.08 H HETATM 1690 H9 CN A 7 -9.200 20.024 -6.051 1.00 0.08 H HETATM 1691 H36 CN A 7 -8.691 21.841 -4.632 1.00 0.20 H HETATM 1692 H32 CN A 7 -7.372 19.306 -4.119 1.00 0.08 H HETATM 1693 H33 CN A 7 -7.044 20.663 -2.988 1.00 0.08 H HETATM 1694 H30 CN A 7 -9.720 19.304 -3.553 1.00 0.06 H HETATM 1695 H31 CN A 7 -9.557 20.831 -2.621 1.00 0.06 H HETATM 1696 C31 CN A 7 -7.240 19.032 1.618 1.00 -0.03 C HETATM 1697 C32 CN A 7 -5.860 19.642 1.773 1.00 -0.02 C HETATM 1698 C35 CN A 7 -4.743 18.731 1.304 1.00 0.07 C HETATM 1699 O41 CN A 7 -4.735 17.576 2.141 1.00 -0.31 O HETATM 1700 C23 CN A 7 -3.639 16.735 1.973 1.00 0.10 C HETATM 1701 C14 CN A 7 -2.772 16.784 0.888 1.00 -0.03 C HETATM 1702 C6 CN A 7 -1.716 15.899 0.819 1.00 -0.07 C HETATM 1703 C10 CN A 7 -1.530 14.958 1.807 1.00 -0.07 C HETATM 1704 C15 CN A 7 -2.405 14.895 2.870 1.00 -0.03 C HETATM 1705 C7 CN A 7 -2.229 13.925 3.835 1.00 -0.06 C HETATM 1706 C1 CN A 7 -3.085 13.832 4.909 1.00 -0.06 C HETATM 1707 C2 CN A 7 -4.139 14.715 5.009 1.00 -0.06 C HETATM 1708 C8 CN A 7 -4.330 15.672 4.039 1.00 -0.05 C HETATM 1709 C16 CN A 7 -3.461 15.784 2.962 1.00 0.02 C HETATM 1710 H5 CN A 7 -5.173 16.349 4.117 1.00 0.06 H HETATM 1711 H13 CN A 7 -4.818 14.655 5.852 1.00 0.06 H HETATM 1712 H12 CN A 7 -2.932 13.073 5.668 1.00 0.06 H HETATM 1713 H4 CN A 7 -1.405 13.226 3.746 1.00 0.06 H HETATM 1714 H6 CN A 7 -0.696 14.268 1.749 1.00 0.05 H HETATM 1715 H3 CN A 7 -1.029 15.945 -0.018 1.00 0.06 H HETATM 1716 H18 CN A 7 -2.925 17.513 0.101 1.00 0.05 H HETATM 1717 H34 CN A 7 -3.778 19.254 1.380 1.00 0.06 H HETATM 1718 H35 CN A 7 -4.918 18.434 0.259 1.00 0.06 H HETATM 1719 H28 CN A 7 -5.698 19.873 2.836 1.00 0.03 H HETATM 1720 H29 CN A 7 -5.822 20.571 1.186 1.00 0.03 H HETATM 1721 H26 CN A 7 -7.235 18.051 2.116 1.00 0.04 H HETATM 1722 H27 CN A 7 -7.962 19.694 2.119 1.00 0.04 H HETATM 1723 C9 CN A 7 -7.189 16.346 -0.169 1.00 -0.07 C HETATM 1724 C5 CN A 7 -7.278 15.341 -1.105 1.00 -0.08 C HETATM 1725 C12 CN A 7 -7.869 15.559 -2.327 1.00 -0.07 C HETATM 1726 H17 CN A 7 -7.934 14.739 -3.033 1.00 0.05 H HETATM 1727 H2 CN A 7 -6.875 14.361 -0.875 1.00 0.05 H HETATM 1728 H15 CN A 7 -6.761 16.157 0.809 1.00 0.06 H HETATM 1729 C30 CN A 7 -11.352 16.997 -2.901 1.00 -0.03 C HETATM 1730 H23 CN A 7 -12.391 17.083 -3.252 1.00 0.04 H HETATM 1731 H24 CN A 7 -11.114 17.850 -2.249 1.00 0.04 H HETATM 1732 H25 CN A 7 -11.232 16.060 -2.337 1.00 0.04 H HETATM 1733 H7 CN A 7 -12.085 17.176 -5.413 1.00 0.06 H HETATM 1734 H1 CN A 7 -10.684 17.186 -7.436 1.00 0.06 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1658 1659 1663 1734 CONECT 1659 1658 1660 1733 CONECT 1660 1659 1661 1729 CONECT 1661 1660 1662 1666 CONECT 1662 1661 1663 1665 CONECT 1663 1658 1662 1664 CONECT 1664 1663 CONECT 1665 1662 CONECT 1666 1661 1667 1725 CONECT 1667 1666 1668 1674 CONECT 1668 1667 1669 1723 CONECT 1669 1668 1670 1696 CONECT 1670 1669 1671 1674 CONECT 1671 1670 1672 1673 CONECT 1672 1671 CONECT 1673 1671 CONECT 1674 1667 1670 1675 CONECT 1675 1674 1676 1694 1695 CONECT 1676 1675 1677 1692 1693 CONECT 1677 1676 1678 1682 1691 CONECT 1678 1677 1679 1689 1690 CONECT 1679 1678 1680 1687 1688 CONECT 1680 1679 1681 CONECT 1681 1680 1682 1685 1686 CONECT 1682 1677 1681 1683 1684 CONECT 1683 1682 CONECT 1684 1682 CONECT 1685 1681 CONECT 1686 1681 CONECT 1687 1679 CONECT 1688 1679 CONECT 1689 1678 CONECT 1690 1678 CONECT 1691 1677 CONECT 1692 1676 CONECT 1693 1676 CONECT 1694 1675 CONECT 1695 1675 CONECT 1696 1669 1697 1721 1722 CONECT 1697 1696 1698 1719 1720 CONECT 1698 1697 1699 1717 1718 CONECT 1699 1698 1700 CONECT 1700 1699 1701 1709 CONECT 1701 1700 1702 1716 CONECT 1702 1701 1703 1715 CONECT 1703 1702 1704 1714 CONECT 1704 1703 1705 1709 CONECT 1705 1704 1706 1713 CONECT 1706 1705 1707 1712 CONECT 1707 1706 1708 1711 CONECT 1708 1707 1709 1710 CONECT 1709 1700 1704 1708 CONECT 1710 1708 CONECT 1711 1707 CONECT 1712 1706 CONECT 1713 1705 CONECT 1714 1703 CONECT 1715 1702 CONECT 1716 1701 CONECT 1717 1698 CONECT 1718 1698 CONECT 1719 1697 CONECT 1720 1697 CONECT 1721 1696 CONECT 1722 1696 CONECT 1723 1668 1724 1728 CONECT 1724 1723 1725 1727 CONECT 1725 1666 1724 1726 CONECT 1726 1725 CONECT 1727 1724 CONECT 1728 1723 CONECT 1729 1660 1730 1731 1732 CONECT 1730 1729 CONECT 1731 1729 CONECT 1732 1729 CONECT 1733 1659 CONECT 1734 1658 MASTER 0 0 0 0 0 0 0 0 1733 1 81 12 END
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Related entries of code: 6b4u
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
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PDBbind
161aa, >3WIX_1|Chains... at 90%
3wiy
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PDBbind
161aa, >3WIY_1|Chains... at 90%
4hw2
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PDBbind
153aa, >4HW2_1|Chains... at 96%
4hw3
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PDBbind
153aa, >4HW3_1|Chains... at 96%
4oq6
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PDBbind
157aa, >4OQ6_1|Chains... at 92%
4wgi
RCSB PDB
PDBbind
518aa, >4WGI_1|Chain... *
4wmu
RCSB PDB
PDBbind
518aa, >4WMU_1|Chain... at 100%
4wmv
RCSB PDB
PDBbind
518aa, >4WMV_1|Chain... at 100%
4wmx
RCSB PDB
PDBbind
518aa, >4WMX_1|Chain... at 100%
4zbf
RCSB PDB
PDBbind
157aa, >4ZBF_1|Chains... at 93%
4zbi
RCSB PDB
PDBbind
157aa, >4ZBI_1|Chains... at 93%
5fdo
RCSB PDB
PDBbind
150aa, >5FDO_1|Chains... at 97%
5fdr
RCSB PDB
PDBbind
158aa, >5FDR_1|Chains... at 92%
5iez
RCSB PDB
PDBbind
159aa, >5IEZ_1|Chains... at 91%
5if4
RCSB PDB
PDBbind
159aa, >5IF4_1|Chains... at 91%
5vkc
RCSB PDB
PDBbind
157aa, >5VKC_1|Chains... at 92%
6b4l
RCSB PDB
PDBbind
157aa, >6B4L_1|Chains... at 92%
6bw2
RCSB PDB
PDBbind
158aa, >6BW2_1|Chains... at 92%
6bw8
RCSB PDB
PDBbind
158aa, >6BW8_1|Chains... at 92%
6dm8
RCSB PDB
PDBbind
518aa, >6DM8_1|Chains... at 96%
6fs1
RCSB PDB
PDBbind
150aa, >6FS1_1|Chains... at 92%
6qz7
RCSB PDB
PDBbind
518aa, >6QZ7_1|Chain... at 99%
6qyo
RCSB PDB
PDBbind
518aa, >6QYO_1|Chain... at 99%
6qyn
RCSB PDB
PDBbind
518aa, >6QYN_1|Chain... at 99%
6qyl
RCSB PDB
PDBbind
518aa, >6QYL_1|Chain... at 99%
6qyk
RCSB PDB
PDBbind
518aa, >6QYK_1|Chain... at 99%
6qxj
RCSB PDB
PDBbind
518aa, >6QXJ_1|Chain... at 99%
6p3p
RCSB PDB
PDBbind
157aa, >6P3P_1|Chain... at 92%
6oqn
RCSB PDB
PDBbind
157aa, >6OQN_1|Chains... at 92%
6oqd
RCSB PDB
PDBbind
157aa, >6OQD_1|Chain... at 92%
6oqc
RCSB PDB
PDBbind
157aa, >6OQC_1|Chains... at 92%
6oqb
RCSB PDB
PDBbind
157aa, >6OQB_1|Chain... at 92%
6o6g
RCSB PDB
PDBbind
156aa, >6O6G_1|Chain... at 93%
6o6f
RCSB PDB
PDBbind
158aa, >6O6F_1|Chains... at 92%
6ne5
RCSB PDB
PDBbind
159aa, >6NE5_1|Chains... at 91%
6ud2
RCSB PDB
PDBbind
157aa, >6UD2_1|Chain... at 92%
6udi
RCSB PDB
PDBbind
157aa, >6UDI_1|Chain... at 92%
6udt
RCSB PDB
PDBbind
157aa, >6UDT_1|Chain... at 92%
6udu
RCSB PDB
PDBbind
157aa, >6UDU_1|Chain... at 92%
6udv
RCSB PDB
PDBbind
157aa, >6UDV_1|Chain... at 92%
6udx
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PDBbind
157aa, >6UDX_1|Chains... at 92%
6udy
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PDBbind
157aa, >6UDY_1|Chains... at 92%
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
6b4u
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Myeloid cell leukemia 1
Ligand Name
CN7
EC.Number
E.C.-.-.-.-
Resolution
1.95(Å)
Affinity (Kd/Ki/IC50)
Ki=21nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) J. Med. Chem. Vol. 58: pp. 2180-2194
Ligand Properties
Formula
C
3
5
H
3
7
N
2
O
4
Molecular Weight
549.679
Exact Mass
549.275
No. of atoms
78
No. of bonds
83
Polar Surface Area
65.13
LOGP Value
5.49 (
Computed with XLOGP3
)
6.96 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 6
Canonical SMILES
Cc1ccccc1c1cccc2c1n(CC[NH+]1CCOCC1)c(c2CCCOc1cccc2c1cccc2)C(=O)O
InChI String
InChI=1S/C35H36N2O4/c1-25-9-2-4-12-27(25)29-14-7-15-30-31(16-8-22-41-32-17-6-11-26-10-3-5-13-28(26)32)34(35(38)39)37(33(29)30)19-18-36-20-23-40-24-21-36/h2-7,9-15,17H,8,16,18-24H2,1H3,(H,38,39)/p+1
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):
Q07820
Entrez Gene ID
NCBI Entrez Gene ID:
4170
ASD
Information of known allosteric effects of PDB entries
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