Browse entries in the PDBbind-CN Database
HEADER 5IQL_COMPLEX COMPND 5IQL_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 130 SER ARG LEU PHE VAL LYS LYS THR ILE VAL VAL GLY ASN SEQRES 2 A 130 VAL SER LYS TYR ILE PRO PRO ASP LYS ARG GLU GLU ASN SEQRES 3 A 130 ASP GLN SER THR HIS LYS TRP MET VAL TYR VAL ARG GLY SEQRES 4 A 130 SER ARG ARG GLU PRO SER ILE ASN HIS PHE VAL LYS LYS SEQRES 5 A 130 VAL TRP PHE PHE LEU HIS PRO SER TYR LYS PRO ASN ASP SEQRES 6 A 130 LEU VAL GLU VAL ARG GLU PRO PRO PHE HIS LEU THR ARG SEQRES 7 A 130 ARG GLY TRP GLY GLU PHE PRO VAL ARG VAL GLN VAL HIS SEQRES 8 A 130 PHE LYS ASP SER GLN ASN LYS ARG ILE ASP ILE ILE HIS SEQRES 9 A 130 ASN LEU LYS LEU ASP ARG THR TYR THR GLY LEU GLN THR SEQRES 10 A 130 LEU GLY ALA GLU THR VAL VAL ASP VAL GLU LEU HIS ARG HET ALA A 186 120 ATOM 1 N SER A 202 27.392 24.891 69.003 1.00 93.99 N ATOM 2 CA SER A 202 26.210 24.707 68.172 1.00 88.96 C ATOM 3 C SER A 202 26.253 23.372 67.449 1.00 85.27 C ATOM 4 O SER A 202 27.319 22.808 67.219 1.00 88.87 O ATOM 5 CB SER A 202 26.076 25.841 67.154 1.00 89.76 C ATOM 6 OG SER A 202 25.798 27.075 67.790 1.00 91.85 O ATOM 7 HG SER A 202 25.717 27.786 67.106 1.00 0.00 H ATOM 8 HN3 SER A 202 28.242 24.863 68.405 1.00 0.00 H ATOM 9 HN2 SER A 202 27.439 24.130 69.710 1.00 0.00 H ATOM 10 HN1 SER A 202 27.336 25.811 69.485 1.00 0.00 H ATOM 11 N ARG A 203 25.078 22.867 67.091 1.00 77.73 N ATOM 12 CA ARG A 203 24.961 21.615 66.353 1.00 73.04 C ATOM 13 C ARG A 203 24.641 21.976 64.903 1.00 70.89 C ATOM 14 O ARG A 203 23.491 21.975 64.464 1.00 66.70 O ATOM 15 CB ARG A 203 23.905 20.724 67.001 1.00 67.05 C ATOM 16 CG ARG A 203 24.124 20.586 68.526 1.00 73.72 C ATOM 17 CD ARG A 203 22.863 20.187 69.267 1.00 67.82 C ATOM 18 NE ARG A 203 22.331 18.943 68.740 1.00 67.59 N ATOM 19 CZ ARG A 203 21.085 18.526 68.921 1.00 64.56 C ATOM 20 NH1 ARG A 203 20.240 19.255 69.636 1.00 64.65 N ATOM 21 NH2 ARG A 203 20.693 17.380 68.386 1.00 59.29 N ATOM 22 HE ARG A 203 22.969 18.339 68.184 1.00 0.00 H ATOM 23 HH12 ARG A 203 19.263 18.928 69.778 1.00 0.00 H ATOM 24 HH11 ARG A 203 20.554 20.154 70.055 1.00 0.00 H ATOM 25 HH22 ARG A 203 19.717 17.048 68.525 1.00 0.00 H ATOM 26 HH21 ARG A 203 21.361 16.812 67.827 1.00 0.00 H ATOM 27 H ARG A 203 24.211 23.382 67.346 1.00 0.00 H ATOM 28 N LEU A 204 25.703 22.286 64.156 1.00 68.92 N ATOM 29 CA LEU A 204 25.615 22.851 62.815 1.00 68.04 C ATOM 30 C LEU A 204 25.633 21.761 61.752 1.00 71.11 C ATOM 31 O LEU A 204 26.441 20.829 61.814 1.00 65.56 O ATOM 32 CB LEU A 204 26.774 23.818 62.575 1.00 82.77 C ATOM 33 CG LEU A 204 26.688 24.663 61.306 1.00 81.06 C ATOM 34 CD1 LEU A 204 25.476 25.558 61.399 1.00 80.38 C ATOM 35 CD2 LEU A 204 27.951 25.493 61.109 1.00 85.16 C ATOM 36 H LEU A 204 26.648 22.114 64.554 1.00 0.00 H ATOM 37 N PHE A 205 24.747 21.901 60.764 1.00 62.51 N ATOM 38 CA PHE A 205 24.572 20.924 59.704 1.00 60.44 C ATOM 39 C PHE A 205 24.350 21.639 58.377 1.00 59.16 C ATOM 40 O PHE A 205 24.012 22.822 58.328 1.00 60.38 O ATOM 41 CB PHE A 205 23.367 19.998 59.972 1.00 56.15 C ATOM 42 CG PHE A 205 23.559 19.046 61.126 1.00 69.78 C ATOM 43 CD1 PHE A 205 23.366 19.467 62.436 1.00 66.55 C ATOM 44 CD2 PHE A 205 23.921 17.722 60.899 1.00 65.05 C ATOM 45 CE1 PHE A 205 23.532 18.585 63.499 1.00 64.31 C ATOM 46 CE2 PHE A 205 24.095 16.841 61.958 1.00 64.43 C ATOM 47 CZ PHE A 205 23.901 17.276 63.261 1.00 64.10 C ATOM 48 H PHE A 205 24.151 22.753 60.753 1.00 0.00 H ATOM 49 N VAL A 206 24.487 20.884 57.292 1.00 61.29 N ATOM 50 CA VAL A 206 24.111 21.341 55.960 1.00 63.70 C ATOM 51 C VAL A 206 23.274 20.256 55.301 1.00 57.92 C ATOM 52 O VAL A 206 23.548 19.062 55.468 1.00 57.30 O ATOM 53 CB VAL A 206 25.348 21.693 55.102 1.00 71.26 C ATOM 54 CG1 VAL A 206 26.296 20.505 55.008 1.00 71.96 C ATOM 55 CG2 VAL A 206 24.921 22.159 53.714 1.00 72.43 C ATOM 56 H VAL A 206 24.879 19.927 57.398 1.00 0.00 H ATOM 57 N LYS A 207 22.220 20.668 54.591 1.00 57.11 N ATOM 58 CA LYS A 207 21.420 19.749 53.796 1.00 57.59 C ATOM 59 C LYS A 207 21.998 19.650 52.398 1.00 55.68 C ATOM 60 O LYS A 207 22.376 20.658 51.797 1.00 59.95 O ATOM 61 CB LYS A 207 19.965 20.204 53.701 1.00 61.22 C ATOM 62 CG LYS A 207 19.109 19.810 54.878 1.00 62.55 C ATOM 63 CD LYS A 207 17.646 20.090 54.597 1.00 62.25 C ATOM 64 CE LYS A 207 16.817 19.978 55.872 1.00 63.21 C ATOM 65 NZ LYS A 207 15.400 20.363 55.630 1.00 63.29 N ATOM 66 HZ1 LYS A 207 15.362 21.347 55.295 1.00 0.00 H ATOM 67 HZ2 LYS A 207 14.989 19.734 54.911 1.00 0.00 H ATOM 68 HZ3 LYS A 207 14.862 20.276 56.516 1.00 0.00 H ATOM 69 H LYS A 207 21.964 21.676 54.607 1.00 0.00 H ATOM 70 N LYS A 208 22.080 18.429 51.892 1.00 49.77 N ATOM 71 CA LYS A 208 22.516 18.174 50.533 1.00 53.36 C ATOM 72 C LYS A 208 21.539 17.200 49.893 1.00 51.21 C ATOM 73 O LYS A 208 20.983 16.330 50.564 1.00 48.37 O ATOM 74 CB LYS A 208 23.942 17.613 50.489 1.00 55.01 C ATOM 75 CG LYS A 208 25.009 18.573 51.017 1.00 60.33 C ATOM 76 CD LYS A 208 25.174 19.790 50.101 1.00 65.72 C ATOM 77 CE LYS A 208 26.374 20.632 50.498 1.00 72.26 C ATOM 78 NZ LYS A 208 26.447 21.916 49.740 1.00 75.15 N ATOM 79 HZ1 LYS A 208 26.520 21.713 48.723 1.00 0.00 H ATOM 80 HZ2 LYS A 208 25.589 22.474 49.923 1.00 0.00 H ATOM 81 HZ3 LYS A 208 27.283 22.452 50.049 1.00 0.00 H ATOM 82 H LYS A 208 21.821 17.621 52.493 1.00 0.00 H ATOM 83 N THR A 209 21.339 17.357 48.589 1.00 53.09 N ATOM 84 CA THR A 209 20.378 16.556 47.844 1.00 50.19 C ATOM 85 C THR A 209 21.072 15.340 47.258 1.00 49.09 C ATOM 86 O THR A 209 22.160 15.451 46.690 1.00 53.98 O ATOM 87 CB THR A 209 19.739 17.372 46.721 1.00 52.93 C ATOM 88 OG1 THR A 209 18.995 18.451 47.293 1.00 54.78 O ATOM 89 CG2 THR A 209 18.793 16.487 45.873 1.00 46.32 C ATOM 90 HG1 THR A 209 18.289 18.087 47.884 1.00 0.00 H ATOM 91 H THR A 209 21.889 18.079 48.081 1.00 0.00 H ATOM 92 N ILE A 210 20.447 14.184 47.399 1.00 46.02 N ATOM 93 CA ILE A 210 20.929 12.961 46.781 1.00 46.74 C ATOM 94 C ILE A 210 19.804 12.422 45.909 1.00 45.07 C ATOM 95 O ILE A 210 18.708 12.128 46.409 1.00 42.03 O ATOM 96 CB ILE A 210 21.376 11.931 47.827 1.00 46.34 C ATOM 97 CG1 ILE A 210 22.581 12.480 48.615 1.00 51.23 C ATOM 98 CG2 ILE A 210 21.677 10.617 47.156 1.00 45.63 C ATOM 99 CD1 ILE A 210 23.401 11.425 49.324 1.00 51.95 C ATOM 100 H ILE A 210 19.580 14.149 47.972 1.00 0.00 H ATOM 101 N VAL A 211 20.072 12.318 44.612 1.00 43.35 N ATOM 102 CA VAL A 211 19.131 11.788 43.634 1.00 41.66 C ATOM 103 C VAL A 211 19.577 10.379 43.270 1.00 40.79 C ATOM 104 O VAL A 211 20.715 10.174 42.819 1.00 40.73 O ATOM 105 CB VAL A 211 19.064 12.671 42.375 1.00 46.25 C ATOM 106 CG1 VAL A 211 18.086 12.065 41.362 1.00 44.55 C ATOM 107 CG2 VAL A 211 18.675 14.111 42.723 1.00 45.62 C ATOM 108 H VAL A 211 21.005 12.632 44.276 1.00 0.00 H ATOM 109 N VAL A 212 18.686 9.416 43.472 1.00 36.87 N ATOM 110 CA VAL A 212 18.795 8.090 42.883 1.00 37.72 C ATOM 111 C VAL A 212 17.733 7.999 41.810 1.00 38.28 C ATOM 112 O VAL A 212 16.535 8.091 42.114 1.00 35.22 O ATOM 113 CB VAL A 212 18.579 6.966 43.904 1.00 32.46 C ATOM 114 CG1 VAL A 212 18.841 5.605 43.219 1.00 32.60 C ATOM 115 CG2 VAL A 212 19.454 7.178 45.098 1.00 33.52 C ATOM 116 H VAL A 212 17.869 9.620 44.082 1.00 0.00 H ATOM 117 N GLY A 213 18.166 7.786 40.573 1.00 36.48 N ATOM 118 CA GLY A 213 17.261 7.637 39.455 1.00 39.05 C ATOM 119 C GLY A 213 17.724 6.521 38.539 1.00 37.26 C ATOM 120 O GLY A 213 18.792 5.935 38.736 1.00 38.23 O ATOM 121 H GLY A 213 19.190 7.724 40.402 1.00 0.00 H ATOM 122 N ASN A 214 16.898 6.220 37.543 1.00 33.86 N ATOM 123 CA ASN A 214 17.342 5.263 36.539 1.00 38.19 C ATOM 124 C ASN A 214 16.764 5.622 35.185 1.00 35.90 C ATOM 125 O ASN A 214 15.699 6.235 35.081 1.00 35.97 O ATOM 126 CB ASN A 214 16.954 3.820 36.883 1.00 30.48 C ATOM 127 CG ASN A 214 15.520 3.506 36.545 1.00 30.77 C ATOM 128 OD1 ASN A 214 14.614 3.688 37.382 1.00 27.99 O ATOM 129 ND2 ASN A 214 15.297 3.010 35.324 1.00 29.63 N ATOM 130 HD22 ASN A 214 16.090 2.878 34.664 1.00 0.00 H ATOM 131 HD21 ASN A 214 14.331 2.756 35.034 1.00 0.00 H ATOM 132 H ASN A 214 15.956 6.657 37.482 1.00 0.00 H ATOM 133 N VAL A 215 17.483 5.204 34.150 1.00 33.86 N ATOM 134 CA VAL A 215 17.027 5.248 32.774 1.00 34.69 C ATOM 135 C VAL A 215 17.033 3.812 32.271 1.00 41.21 C ATOM 136 O VAL A 215 17.558 2.908 32.922 1.00 39.41 O ATOM 137 CB VAL A 215 17.922 6.135 31.890 1.00 40.34 C ATOM 138 CG1 VAL A 215 18.067 7.534 32.473 1.00 44.42 C ATOM 139 CG2 VAL A 215 19.287 5.485 31.746 1.00 41.59 C ATOM 140 H VAL A 215 18.432 4.821 34.338 1.00 0.00 H ATOM 141 N SER A 216 16.466 3.612 31.087 1.00 38.74 N ATOM 142 CA SER A 216 16.544 2.300 30.464 1.00 42.97 C ATOM 143 C SER A 216 16.161 2.440 29.004 1.00 44.64 C ATOM 144 O SER A 216 15.551 3.433 28.591 1.00 46.51 O ATOM 145 CB SER A 216 15.630 1.278 31.146 1.00 34.07 C ATOM 146 OG SER A 216 14.282 1.568 30.821 1.00 39.59 O ATOM 147 HG SER A 216 14.056 2.479 31.137 1.00 0.00 H ATOM 148 H SER A 216 15.969 4.389 30.608 1.00 0.00 H ATOM 149 N LYS A 217 16.530 1.429 28.233 1.00 43.63 N ATOM 150 CA LYS A 217 16.082 1.299 26.860 1.00 44.19 C ATOM 151 C LYS A 217 15.671 -0.145 26.627 1.00 44.79 C ATOM 152 O LYS A 217 16.205 -1.066 27.253 1.00 46.47 O ATOM 153 CB LYS A 217 17.163 1.718 25.848 1.00 47.52 C ATOM 154 CG LYS A 217 18.501 1.033 26.012 1.00 50.96 C ATOM 155 CD LYS A 217 19.466 1.450 24.877 1.00 53.37 C ATOM 156 CE LYS A 217 20.898 1.074 25.213 1.00 56.14 C ATOM 157 NZ LYS A 217 21.898 1.506 24.169 1.00 59.35 N ATOM 158 HZ1 LYS A 217 21.664 1.058 23.260 1.00 0.00 H ATOM 159 HZ2 LYS A 217 21.864 2.540 24.066 1.00 0.00 H ATOM 160 HZ3 LYS A 217 22.852 1.217 24.464 1.00 0.00 H ATOM 161 H LYS A 217 17.163 0.703 28.626 1.00 0.00 H ATOM 162 N TYR A 218 14.692 -0.326 25.741 1.00 42.27 N ATOM 163 CA TYR A 218 14.259 -1.656 25.347 1.00 42.00 C ATOM 164 C TYR A 218 15.306 -2.256 24.422 1.00 44.98 C ATOM 165 O TYR A 218 15.995 -1.536 23.701 1.00 48.43 O ATOM 166 CB TYR A 218 12.888 -1.574 24.664 1.00 43.97 C ATOM 167 CG TYR A 218 12.332 -2.861 24.081 1.00 46.45 C ATOM 168 CD1 TYR A 218 11.904 -3.892 24.912 1.00 45.95 C ATOM 169 CD2 TYR A 218 12.173 -3.021 22.697 1.00 49.43 C ATOM 170 CE1 TYR A 218 11.369 -5.065 24.387 1.00 46.78 C ATOM 171 CE2 TYR A 218 11.636 -4.197 22.160 1.00 50.75 C ATOM 172 CZ TYR A 218 11.237 -5.210 23.021 1.00 51.91 C ATOM 173 OH TYR A 218 10.702 -6.376 22.529 1.00 55.09 O ATOM 174 HH TYR A 218 10.477 -6.978 23.282 1.00 0.00 H ATOM 175 H TYR A 218 14.227 0.504 25.322 1.00 0.00 H ATOM 176 N ILE A 219 15.455 -3.573 24.476 1.00 44.09 N ATOM 177 CA ILE A 219 16.340 -4.309 23.583 1.00 48.03 C ATOM 178 C ILE A 219 15.479 -5.195 22.682 1.00 52.18 C ATOM 179 O ILE A 219 14.922 -6.199 23.134 1.00 53.54 O ATOM 180 CB ILE A 219 17.369 -5.144 24.362 1.00 51.04 C ATOM 181 CG1 ILE A 219 18.145 -4.255 25.332 1.00 49.65 C ATOM 182 CG2 ILE A 219 18.316 -5.882 23.394 1.00 50.62 C ATOM 183 CD1 ILE A 219 18.995 -5.028 26.268 1.00 52.83 C ATOM 184 H ILE A 219 14.915 -4.105 25.189 1.00 0.00 H ATOM 185 N PRO A 220 15.322 -4.836 21.416 1.00 53.45 N ATOM 186 CA PRO A 220 14.511 -5.660 20.524 1.00 56.99 C ATOM 187 C PRO A 220 15.057 -7.070 20.461 1.00 60.64 C ATOM 188 O PRO A 220 16.265 -7.299 20.668 1.00 60.96 O ATOM 189 CB PRO A 220 14.639 -4.947 19.169 1.00 60.49 C ATOM 190 CG PRO A 220 15.128 -3.561 19.482 1.00 60.11 C ATOM 191 CD PRO A 220 15.953 -3.696 20.728 1.00 56.35 C ATOM 192 N PRO A 221 14.201 -8.056 20.184 1.00 64.72 N ATOM 193 CA PRO A 221 14.688 -9.443 20.058 1.00 67.79 C ATOM 194 C PRO A 221 15.818 -9.604 19.057 1.00 68.77 C ATOM 195 O PRO A 221 16.663 -10.489 19.234 1.00 68.93 O ATOM 196 CB PRO A 221 13.432 -10.212 19.627 1.00 69.32 C ATOM 197 CG PRO A 221 12.299 -9.401 20.152 1.00 66.93 C ATOM 198 CD PRO A 221 12.736 -7.965 20.054 1.00 65.32 C ATOM 199 N ASP A 222 15.866 -8.762 18.018 1.00 72.62 N ATOM 200 CA ASP A 222 16.935 -8.842 17.028 1.00 76.27 C ATOM 201 C ASP A 222 18.308 -8.700 17.662 1.00 72.82 C ATOM 202 O ASP A 222 19.283 -9.280 17.173 1.00 76.86 O ATOM 203 CB ASP A 222 16.764 -7.749 15.972 1.00 82.54 C ATOM 204 CG ASP A 222 15.325 -7.567 15.544 1.00 83.82 C ATOM 205 OD1 ASP A 222 14.524 -7.009 16.340 1.00 77.77 O ATOM 206 OD2 ASP A 222 15.016 -7.963 14.395 1.00 86.39 O ATOM 207 H ASP A 222 15.128 -8.037 17.914 1.00 0.00 H ATOM 208 N LYS A 223 18.410 -7.924 18.732 1.00 67.89 N ATOM 209 CA LYS A 223 19.694 -7.564 19.305 1.00 70.11 C ATOM 210 C LYS A 223 19.972 -8.275 20.619 1.00 67.61 C ATOM 211 O LYS A 223 20.955 -7.947 21.285 1.00 69.43 O ATOM 212 CB LYS A 223 19.766 -6.049 19.483 1.00 72.43 C ATOM 213 CG LYS A 223 19.535 -5.330 18.178 1.00 78.52 C ATOM 214 CD LYS A 223 19.607 -3.828 18.298 1.00 80.12 C ATOM 215 CE LYS A 223 19.220 -3.184 16.967 1.00 82.96 C ATOM 216 NZ LYS A 223 17.821 -3.533 16.577 1.00 82.01 N ATOM 217 HZ1 LYS A 223 17.736 -4.565 16.481 1.00 0.00 H ATOM 218 HZ2 LYS A 223 17.164 -3.197 17.310 1.00 0.00 H ATOM 219 HZ3 LYS A 223 17.592 -3.079 15.670 1.00 0.00 H ATOM 220 H LYS A 223 17.542 -7.561 19.175 1.00 0.00 H ATOM 221 N ARG A 224 19.141 -9.236 21.007 1.00 65.83 N ATOM 222 CA ARG A 224 19.423 -10.072 22.168 1.00 66.14 C ATOM 223 C ARG A 224 20.184 -11.311 21.725 1.00 72.95 C ATOM 224 O ARG A 224 19.918 -11.866 20.655 1.00 62.72 O ATOM 225 CB ARG A 224 18.134 -10.492 22.877 1.00 59.32 C ATOM 226 CG ARG A 224 17.170 -9.359 23.144 1.00 60.82 C ATOM 227 CD ARG A 224 15.915 -9.837 23.868 1.00 59.13 C ATOM 228 NE ARG A 224 14.826 -8.887 23.718 1.00 55.82 N ATOM 229 CZ ARG A 224 13.551 -9.166 23.967 1.00 56.21 C ATOM 230 NH1 ARG A 224 13.199 -10.376 24.384 1.00 56.14 N ATOM 231 NH2 ARG A 224 12.626 -8.231 23.798 1.00 54.48 N ATOM 232 HE ARG A 224 15.060 -7.926 23.395 1.00 0.00 H ATOM 233 HH12 ARG A 224 12.200 -10.589 24.577 1.00 0.00 H ATOM 234 HH11 ARG A 224 13.923 -11.111 24.517 1.00 0.00 H ATOM 235 HH22 ARG A 224 11.627 -8.446 23.992 1.00 0.00 H ATOM 236 HH21 ARG A 224 12.899 -7.282 23.471 1.00 0.00 H ATOM 237 H ARG A 224 18.266 -9.396 20.468 1.00 0.00 H ATOM 238 N GLU A 225 21.126 -11.749 22.556 1.00 73.67 N ATOM 239 CA GLU A 225 21.784 -13.012 22.279 1.00 76.85 C ATOM 240 C GLU A 225 20.863 -14.162 22.687 1.00 73.16 C ATOM 241 O GLU A 225 19.892 -13.983 23.436 1.00 62.99 O ATOM 242 CB GLU A 225 23.137 -13.083 23.003 1.00 81.00 C ATOM 243 CG GLU A 225 24.060 -14.197 22.532 1.00 84.08 C ATOM 244 CD GLU A 225 25.490 -14.065 23.038 1.00 87.76 C ATOM 245 OE1 GLU A 225 26.200 -13.128 22.615 1.00 90.37 O ATOM 246 OE2 GLU A 225 25.910 -14.912 23.854 1.00 88.38 O ATOM 247 H GLU A 225 21.388 -11.192 23.395 1.00 0.00 H ATOM 248 N GLU A 226 21.160 -15.348 22.154 1.00 81.61 N ATOM 249 CA GLU A 226 20.369 -16.533 22.462 1.00 87.08 C ATOM 250 C GLU A 226 20.439 -16.865 23.947 1.00 87.45 C ATOM 251 O GLU A 226 21.499 -16.774 24.575 1.00 87.95 O ATOM 252 CB GLU A 226 20.852 -17.732 21.643 1.00 91.43 C ATOM 253 CG GLU A 226 20.088 -17.953 20.347 1.00 93.73 C ATOM 254 CD GLU A 226 19.693 -19.405 20.140 1.00 97.38 C ATOM 255 OE1 GLU A 226 20.575 -20.293 20.210 1.00 98.55 O ATOM 256 OE2 GLU A 226 18.490 -19.661 19.919 1.00 98.35 O ATOM 257 H GLU A 226 21.970 -15.429 21.507 1.00 0.00 H ATOM 258 N ASN A 227 19.290 -17.264 24.496 1.00 90.14 N ATOM 259 CA ASN A 227 19.119 -17.644 25.898 1.00 90.34 C ATOM 260 C ASN A 227 19.333 -16.475 26.858 1.00 90.15 C ATOM 261 O ASN A 227 19.512 -16.685 28.065 1.00 91.00 O ATOM 262 CB ASN A 227 20.024 -18.821 26.280 1.00 96.97 C ATOM 263 CG ASN A 227 19.659 -20.103 25.544 1.00102.06 C ATOM 264 OD1 ASN A 227 19.551 -20.125 24.317 1.00103.25 O ATOM 265 ND2 ASN A 227 19.456 -21.178 26.299 1.00103.83 N ATOM 266 HD22 ASN A 227 19.558 -21.115 27.332 1.00 0.00 H ATOM 267 HD21 ASN A 227 19.195 -22.082 25.857 1.00 0.00 H ATOM 268 H ASN A 227 18.453 -17.308 23.880 1.00 0.00 H ATOM 269 N ASP A 228 19.305 -15.239 26.360 1.00 87.85 N ATOM 270 CA ASP A 228 19.313 -14.053 27.214 1.00 81.90 C ATOM 271 C ASP A 228 17.869 -13.617 27.417 1.00 73.70 C ATOM 272 O ASP A 228 17.221 -13.142 26.479 1.00 72.55 O ATOM 273 CB ASP A 228 20.143 -12.926 26.604 1.00 81.88 C ATOM 274 CG ASP A 228 20.565 -11.885 27.629 1.00 81.43 C ATOM 275 OD1 ASP A 228 19.804 -11.617 28.588 1.00 75.27 O ATOM 276 OD2 ASP A 228 21.675 -11.331 27.475 1.00 85.66 O ATOM 277 H ASP A 228 19.276 -15.114 25.328 1.00 0.00 H ATOM 278 N GLN A 229 17.371 -13.775 28.640 1.00 71.83 N ATOM 279 CA GLN A 229 16.001 -13.406 28.979 1.00 71.12 C ATOM 280 C GLN A 229 15.813 -11.910 29.210 1.00 64.62 C ATOM 281 O GLN A 229 14.718 -11.505 29.615 1.00 62.56 O ATOM 282 CB GLN A 229 15.539 -14.167 30.226 1.00 74.87 C ATOM 283 CG GLN A 229 15.482 -15.676 30.049 1.00 81.02 C ATOM 284 CD GLN A 229 14.210 -16.267 30.624 1.00 83.08 C ATOM 285 OE1 GLN A 229 13.139 -16.180 30.017 1.00 83.03 O ATOM 286 NE2 GLN A 229 14.317 -16.863 31.806 1.00 84.15 N ATOM 287 HE22 GLN A 229 15.241 -16.913 32.281 1.00 0.00 H ATOM 288 HE21 GLN A 229 13.477 -17.280 32.256 1.00 0.00 H ATOM 289 H GLN A 229 17.980 -14.176 29.381 1.00 0.00 H ATOM 290 N SER A 230 16.825 -11.081 28.964 1.00 60.92 N ATOM 291 CA SER A 230 16.726 -9.659 29.275 1.00 54.94 C ATOM 292 C SER A 230 16.102 -8.896 28.112 1.00 51.91 C ATOM 293 O SER A 230 16.548 -9.004 26.969 1.00 51.12 O ATOM 294 CB SER A 230 18.093 -9.073 29.619 1.00 52.80 C ATOM 295 OG SER A 230 18.660 -9.757 30.724 1.00 50.98 O ATOM 296 HG SER A 230 18.767 -10.715 30.498 1.00 0.00 H ATOM 297 H SER A 230 17.700 -11.453 28.543 1.00 0.00 H ATOM 298 N THR A 231 15.062 -8.130 28.417 1.00 47.96 N ATOM 299 CA THR A 231 14.405 -7.287 27.437 1.00 46.76 C ATOM 300 C THR A 231 14.885 -5.844 27.482 1.00 44.79 C ATOM 301 O THR A 231 14.542 -5.063 26.586 1.00 43.86 O ATOM 302 CB THR A 231 12.899 -7.316 27.675 1.00 46.29 C ATOM 303 OG1 THR A 231 12.652 -6.907 29.022 1.00 42.87 O ATOM 304 CG2 THR A 231 12.357 -8.712 27.471 1.00 45.50 C ATOM 305 HG1 THR A 231 13.001 -5.990 29.157 1.00 0.00 H ATOM 306 H THR A 231 14.705 -8.135 29.394 1.00 0.00 H ATOM 307 N HIS A 232 15.656 -5.472 28.498 1.00 39.20 N ATOM 308 CA HIS A 232 16.015 -4.085 28.727 1.00 38.62 C ATOM 309 C HIS A 232 17.462 -4.003 29.177 1.00 42.00 C ATOM 310 O HIS A 232 18.033 -4.968 29.690 1.00 42.66 O ATOM 311 CB HIS A 232 15.150 -3.412 29.812 1.00 38.12 C ATOM 312 CG HIS A 232 13.729 -3.161 29.410 1.00 38.85 C ATOM 313 ND1 HIS A 232 12.791 -4.166 29.325 1.00 39.04 N ATOM 314 CD2 HIS A 232 13.071 -2.008 29.135 1.00 35.76 C ATOM 315 CE1 HIS A 232 11.621 -3.649 28.984 1.00 37.34 C ATOM 316 NE2 HIS A 232 11.764 -2.341 28.862 1.00 36.26 N ATOM 317 H HIS A 232 16.014 -6.199 29.150 1.00 0.00 H ATOM 318 N LYS A 233 18.035 -2.819 28.997 1.00 41.92 N ATOM 319 CA LYS A 233 19.325 -2.446 29.560 1.00 45.64 C ATOM 320 C LYS A 233 19.078 -1.190 30.377 1.00 43.16 C ATOM 321 O LYS A 233 18.563 -0.201 29.846 1.00 43.33 O ATOM 322 CB LYS A 233 20.351 -2.201 28.457 1.00 50.09 C ATOM 323 CG LYS A 233 21.771 -1.923 28.941 1.00 56.14 C ATOM 324 CD LYS A 233 22.693 -1.698 27.741 1.00 60.95 C ATOM 325 CE LYS A 233 24.137 -1.530 28.163 1.00 65.67 C ATOM 326 NZ LYS A 233 25.026 -1.370 26.976 1.00 71.06 N ATOM 327 HZ1 LYS A 233 24.951 -2.213 26.372 1.00 0.00 H ATOM 328 HZ2 LYS A 233 24.735 -0.529 26.438 1.00 0.00 H ATOM 329 HZ3 LYS A 233 26.010 -1.257 27.294 1.00 0.00 H ATOM 330 H LYS A 233 17.532 -2.116 28.419 1.00 0.00 H ATOM 331 N TRP A 234 19.373 -1.244 31.673 1.00 38.69 N ATOM 332 CA TRP A 234 19.096 -0.103 32.531 1.00 37.16 C ATOM 333 C TRP A 234 20.369 0.417 33.194 1.00 42.56 C ATOM 334 O TRP A 234 21.396 -0.266 33.261 1.00 40.16 O ATOM 335 CB TRP A 234 18.034 -0.440 33.586 1.00 34.68 C ATOM 336 CG TRP A 234 18.245 -1.676 34.433 1.00 38.23 C ATOM 337 CD1 TRP A 234 17.609 -2.878 34.299 1.00 38.74 C ATOM 338 CD2 TRP A 234 19.106 -1.808 35.579 1.00 39.99 C ATOM 339 NE1 TRP A 234 18.031 -3.761 35.284 1.00 38.02 N ATOM 340 CE2 TRP A 234 18.944 -3.125 36.082 1.00 39.84 C ATOM 341 CE3 TRP A 234 19.984 -0.938 36.239 1.00 38.99 C ATOM 342 CZ2 TRP A 234 19.630 -3.586 37.211 1.00 41.52 C ATOM 343 CZ3 TRP A 234 20.680 -1.409 37.348 1.00 38.95 C ATOM 344 CH2 TRP A 234 20.496 -2.716 37.825 1.00 38.24 C ATOM 345 HE1 TRP A 234 17.707 -4.743 35.397 1.00 0.00 H ATOM 346 H TRP A 234 19.802 -2.103 32.073 1.00 0.00 H ATOM 347 N MET A 235 20.289 1.658 33.674 1.00 40.87 N ATOM 348 CA MET A 235 21.377 2.292 34.412 1.00 41.58 C ATOM 349 C MET A 235 20.786 3.025 35.609 1.00 37.44 C ATOM 350 O MET A 235 19.946 3.911 35.447 1.00 39.80 O ATOM 351 CB MET A 235 22.175 3.263 33.534 1.00 44.85 C ATOM 352 CG MET A 235 23.421 3.836 34.232 1.00 53.79 C ATOM 353 SD MET A 235 24.271 5.150 33.295 1.00 62.60 S ATOM 354 CE MET A 235 23.079 6.460 33.630 1.00 62.42 C ATOM 355 H MET A 235 19.414 2.197 33.516 1.00 0.00 H ATOM 356 N VAL A 236 21.202 2.651 36.797 1.00 37.44 N ATOM 357 CA VAL A 236 20.845 3.379 38.014 1.00 36.68 C ATOM 358 C VAL A 236 21.962 4.369 38.316 1.00 42.83 C ATOM 359 O VAL A 236 23.150 4.035 38.185 1.00 47.74 O ATOM 360 CB VAL A 236 20.628 2.410 39.183 1.00 39.17 C ATOM 361 CG1 VAL A 236 20.475 3.169 40.526 1.00 41.33 C ATOM 362 CG2 VAL A 236 19.405 1.570 38.927 1.00 39.16 C ATOM 363 H VAL A 236 21.806 1.808 36.875 1.00 0.00 H ATOM 364 N TYR A 237 21.596 5.607 38.654 1.00 40.75 N ATOM 365 CA TYR A 237 22.601 6.612 38.968 1.00 41.70 C ATOM 366 C TYR A 237 22.312 7.250 40.321 1.00 43.44 C ATOM 367 O TYR A 237 21.161 7.311 40.789 1.00 41.09 O ATOM 368 CB TYR A 237 22.690 7.691 37.867 1.00 44.50 C ATOM 369 CG TYR A 237 21.369 8.339 37.515 1.00 49.37 C ATOM 370 CD1 TYR A 237 20.551 7.816 36.521 1.00 47.49 C ATOM 371 CD2 TYR A 237 20.941 9.477 38.185 1.00 51.64 C ATOM 372 CE1 TYR A 237 19.328 8.414 36.210 1.00 48.85 C ATOM 373 CE2 TYR A 237 19.739 10.078 37.877 1.00 52.46 C ATOM 374 CZ TYR A 237 18.933 9.548 36.887 1.00 51.14 C ATOM 375 OH TYR A 237 17.729 10.163 36.598 1.00 49.85 O ATOM 376 HH TYR A 237 17.897 11.095 36.308 1.00 0.00 H ATOM 377 H TYR A 237 20.587 5.855 38.693 1.00 0.00 H ATOM 378 N VAL A 238 23.383 7.686 40.965 1.00 45.00 N ATOM 379 CA VAL A 238 23.326 8.344 42.265 1.00 45.28 C ATOM 380 C VAL A 238 24.131 9.621 42.124 1.00 45.08 C ATOM 381 O VAL A 238 25.303 9.571 41.728 1.00 45.72 O ATOM 382 CB VAL A 238 23.888 7.458 43.388 1.00 44.99 C ATOM 383 CG1 VAL A 238 23.781 8.159 44.761 1.00 43.93 C ATOM 384 CG2 VAL A 238 23.177 6.111 43.407 1.00 37.73 C ATOM 385 H VAL A 238 24.314 7.552 40.521 1.00 0.00 H ATOM 386 N ARG A 239 23.498 10.760 42.394 1.00 43.69 N ATOM 387 CA ARG A 239 24.108 12.052 42.110 1.00 51.46 C ATOM 388 C ARG A 239 23.463 13.104 42.995 1.00 50.49 C ATOM 389 O ARG A 239 22.436 12.865 43.635 1.00 44.40 O ATOM 390 CB ARG A 239 23.949 12.438 40.635 1.00 56.78 C ATOM 391 CG ARG A 239 22.479 12.540 40.212 1.00 58.71 C ATOM 392 CD ARG A 239 22.273 13.364 38.930 1.00 65.39 C ATOM 393 NE ARG A 239 20.845 13.449 38.596 1.00 65.85 N ATOM 394 CZ ARG A 239 20.031 14.417 39.014 1.00 64.05 C ATOM 395 NH1 ARG A 239 20.500 15.396 39.782 1.00 63.09 N ATOM 396 NH2 ARG A 239 18.745 14.404 38.669 1.00 62.67 N ATOM 397 HE ARG A 239 20.443 12.703 37.993 1.00 0.00 H ATOM 398 HH12 ARG A 239 19.864 16.151 40.108 1.00 0.00 H ATOM 399 HH11 ARG A 239 21.503 15.406 40.057 1.00 0.00 H ATOM 400 HH22 ARG A 239 18.111 15.161 38.996 1.00 0.00 H ATOM 401 HH21 ARG A 239 18.374 13.637 38.072 1.00 0.00 H ATOM 402 H ARG A 239 22.548 10.727 42.816 1.00 0.00 H ATOM 403 N GLY A 240 24.085 14.282 43.024 1.00 54.53 N ATOM 404 CA GLY A 240 23.522 15.437 43.689 1.00 60.36 C ATOM 405 C GLY A 240 22.672 16.253 42.739 1.00 63.82 C ATOM 406 O GLY A 240 22.396 15.857 41.607 1.00 64.44 O ATOM 407 H GLY A 240 25.007 14.374 42.552 1.00 0.00 H ATOM 408 N SER A 241 22.221 17.402 43.231 1.00 66.49 N ATOM 409 CA SER A 241 21.472 18.305 42.375 1.00 72.08 C ATOM 410 C SER A 241 22.420 19.182 41.568 1.00 77.56 C ATOM 411 O SER A 241 23.569 19.435 41.954 1.00 79.23 O ATOM 412 CB SER A 241 20.530 19.189 43.188 1.00 73.53 C ATOM 413 OG SER A 241 20.200 20.360 42.458 1.00 75.24 O ATOM 414 HG SER A 241 19.589 20.923 42.997 1.00 0.00 H ATOM 415 H SER A 241 22.403 17.653 44.224 1.00 0.00 H ATOM 416 N ARG A 242 21.909 19.659 40.432 1.00 82.57 N ATOM 417 CA ARG A 242 22.700 20.532 39.572 1.00 87.24 C ATOM 418 C ARG A 242 23.081 21.828 40.277 1.00 89.79 C ATOM 419 O ARG A 242 24.113 22.426 39.957 1.00 95.09 O ATOM 420 CB ARG A 242 21.924 20.840 38.291 1.00 91.83 C ATOM 421 CG ARG A 242 22.759 21.519 37.214 1.00 99.98 C ATOM 422 CD ARG A 242 21.899 22.309 36.226 1.00102.42 C ATOM 423 NE ARG A 242 22.662 22.726 35.053 1.00105.75 N ATOM 424 CZ ARG A 242 23.495 23.761 35.034 1.00111.04 C ATOM 425 NH1 ARG A 242 23.678 24.488 36.131 1.00112.03 N ATOM 426 NH2 ARG A 242 24.152 24.073 33.920 1.00113.76 N ATOM 427 HE ARG A 242 22.546 22.178 34.177 1.00 0.00 H ATOM 428 HH12 ARG A 242 24.330 25.298 36.115 1.00 0.00 H ATOM 429 HH11 ARG A 242 23.169 24.247 37.005 1.00 0.00 H ATOM 430 HH22 ARG A 242 24.803 24.884 33.910 1.00 0.00 H ATOM 431 HH21 ARG A 242 24.015 23.506 33.059 1.00 0.00 H ATOM 432 H ARG A 242 20.938 19.406 40.157 1.00 0.00 H ATOM 433 N ARG A 243 22.276 22.265 41.247 1.00 87.51 N ATOM 434 CA ARG A 243 22.384 23.593 41.841 1.00 87.08 C ATOM 435 C ARG A 243 23.112 23.605 43.180 1.00 86.22 C ATOM 436 O ARG A 243 23.082 24.625 43.878 1.00 86.71 O ATOM 437 CB ARG A 243 20.990 24.196 42.008 1.00 83.69 C ATOM 438 CG ARG A 243 20.079 23.973 40.814 1.00 80.93 C ATOM 439 CD ARG A 243 18.625 23.987 41.248 1.00 78.79 C ATOM 440 NE ARG A 243 18.338 25.159 42.064 1.00 81.92 N ATOM 441 CZ ARG A 243 17.916 25.102 43.323 1.00 82.78 C ATOM 442 NH1 ARG A 243 17.710 23.925 43.901 1.00 79.02 N ATOM 443 NH2 ARG A 243 17.694 26.223 44.000 1.00 85.07 N ATOM 444 HE ARG A 243 18.471 26.097 41.635 1.00 0.00 H ATOM 445 HH12 ARG A 243 17.380 23.880 44.886 1.00 0.00 H ATOM 446 HH11 ARG A 243 17.879 23.048 43.369 1.00 0.00 H ATOM 447 HH22 ARG A 243 17.364 26.179 44.985 1.00 0.00 H ATOM 448 HH21 ARG A 243 17.850 27.145 43.545 1.00 0.00 H ATOM 449 H ARG A 243 21.534 21.626 41.598 1.00 0.00 H ATOM 450 N GLU A 244 23.751 22.502 43.563 1.00 85.75 N ATOM 451 CA GLU A 244 24.622 22.486 44.734 1.00 87.34 C ATOM 452 C GLU A 244 25.911 21.755 44.357 1.00 89.19 C ATOM 453 O GLU A 244 25.973 21.149 43.278 1.00 88.12 O ATOM 454 CB GLU A 244 23.916 21.851 45.946 1.00 83.47 C ATOM 455 CG GLU A 244 22.746 20.912 45.670 1.00 78.82 C ATOM 456 CD GLU A 244 22.036 20.468 46.964 1.00 75.39 C ATOM 457 OE1 GLU A 244 20.967 21.028 47.301 1.00 72.41 O ATOM 458 OE2 GLU A 244 22.556 19.564 47.651 1.00 72.97 O ATOM 459 H GLU A 244 23.626 21.628 43.013 1.00 0.00 H ATOM 460 N PRO A 245 26.967 21.816 45.177 1.00 93.11 N ATOM 461 CA PRO A 245 28.245 21.211 44.771 1.00 98.73 C ATOM 462 C PRO A 245 28.140 19.714 44.507 1.00101.06 C ATOM 463 O PRO A 245 27.263 19.024 45.030 1.00 98.89 O ATOM 464 CB PRO A 245 29.166 21.505 45.960 1.00 98.28 C ATOM 465 CG PRO A 245 28.614 22.755 46.544 1.00 97.34 C ATOM 466 CD PRO A 245 27.122 22.647 46.387 1.00 93.32 C ATOM 467 N SER A 246 29.061 19.222 43.676 1.00109.02 N ATOM 468 CA SER A 246 29.065 17.827 43.250 1.00106.57 C ATOM 469 C SER A 246 29.344 16.901 44.429 1.00104.75 C ATOM 470 O SER A 246 30.009 17.279 45.399 1.00108.22 O ATOM 471 CB SER A 246 30.112 17.614 42.154 1.00112.79 C ATOM 472 OG SER A 246 29.960 16.345 41.537 1.00114.03 O ATOM 473 HG SER A 246 30.649 16.236 40.834 1.00 0.00 H ATOM 474 H SER A 246 29.803 19.857 43.319 1.00 0.00 H ATOM 475 N ILE A 247 28.843 15.661 44.331 1.00 91.18 N ATOM 476 CA ILE A 247 28.799 14.795 45.508 1.00 81.39 C ATOM 477 C ILE A 247 30.043 13.948 45.722 1.00 77.01 C ATOM 478 O ILE A 247 30.134 13.265 46.755 1.00 74.35 O ATOM 479 CB ILE A 247 27.587 13.848 45.496 1.00 75.03 C ATOM 480 CG1 ILE A 247 27.727 12.764 44.426 1.00 72.41 C ATOM 481 CG2 ILE A 247 26.326 14.638 45.315 1.00 72.36 C ATOM 482 CD1 ILE A 247 26.786 11.597 44.669 1.00 66.90 C ATOM 483 H ILE A 247 28.486 15.315 43.418 1.00 0.00 H ATOM 484 N ASN A 248 31.003 13.963 44.797 1.00 77.52 N ATOM 485 CA ASN A 248 32.292 13.351 45.095 1.00 80.28 C ATOM 486 C ASN A 248 32.959 14.000 46.302 1.00 78.26 C ATOM 487 O ASN A 248 33.779 13.358 46.963 1.00 79.51 O ATOM 488 CB ASN A 248 33.229 13.439 43.890 1.00 86.67 C ATOM 489 CG ASN A 248 34.577 12.783 44.157 1.00 93.78 C ATOM 490 OD1 ASN A 248 34.663 11.791 44.885 1.00 96.22 O ATOM 491 ND2 ASN A 248 35.633 13.335 43.577 1.00 96.94 N ATOM 492 HD22 ASN A 248 35.515 14.171 42.970 1.00 0.00 H ATOM 493 HD21 ASN A 248 36.580 12.932 43.728 1.00 0.00 H ATOM 494 H ASN A 248 30.834 14.407 43.872 1.00 0.00 H ATOM 495 N HIS A 249 32.618 15.255 46.607 1.00 75.81 N ATOM 496 CA HIS A 249 33.223 15.940 47.743 1.00 77.75 C ATOM 497 C HIS A 249 32.926 15.242 49.065 1.00 72.15 C ATOM 498 O HIS A 249 33.778 15.239 49.959 1.00 71.30 O ATOM 499 CB HIS A 249 32.743 17.391 47.797 1.00 80.72 C ATOM 500 CG HIS A 249 33.328 18.258 46.728 1.00 87.71 C ATOM 501 ND1 HIS A 249 32.830 19.508 46.428 1.00 89.94 N ATOM 502 CD2 HIS A 249 34.379 18.062 45.896 1.00 91.47 C ATOM 503 CE1 HIS A 249 33.546 20.042 45.454 1.00 92.16 C ATOM 504 NE2 HIS A 249 34.493 19.186 45.114 1.00 93.41 N ATOM 505 H HIS A 249 31.911 15.750 46.026 1.00 0.00 H ATOM 506 N PHE A 250 31.738 14.646 49.221 1.00 67.95 N ATOM 507 CA PHE A 250 31.364 14.087 50.515 1.00 65.31 C ATOM 508 C PHE A 250 31.002 12.610 50.507 1.00 61.87 C ATOM 509 O PHE A 250 30.988 12.004 51.582 1.00 61.73 O ATOM 510 CB PHE A 250 30.206 14.885 51.142 1.00 65.08 C ATOM 511 CG PHE A 250 29.017 15.090 50.233 1.00 65.95 C ATOM 512 CD1 PHE A 250 29.003 16.123 49.302 1.00 69.32 C ATOM 513 CD2 PHE A 250 27.894 14.277 50.343 1.00 62.79 C ATOM 514 CE1 PHE A 250 27.905 16.324 48.472 1.00 65.60 C ATOM 515 CE2 PHE A 250 26.787 14.471 49.518 1.00 61.20 C ATOM 516 CZ PHE A 250 26.797 15.497 48.584 1.00 64.41 C ATOM 517 H PHE A 250 31.080 14.581 48.418 1.00 0.00 H ATOM 518 N VAL A 251 30.725 12.009 49.351 1.00 61.89 N ATOM 519 CA VAL A 251 30.402 10.587 49.275 1.00 60.33 C ATOM 520 C VAL A 251 31.692 9.801 49.079 1.00 65.54 C ATOM 521 O VAL A 251 32.470 10.092 48.165 1.00 66.42 O ATOM 522 CB VAL A 251 29.415 10.306 48.131 1.00 57.26 C ATOM 523 CG1 VAL A 251 29.216 8.805 47.958 1.00 54.71 C ATOM 524 CG2 VAL A 251 28.088 11.011 48.376 1.00 53.22 C ATOM 525 H VAL A 251 30.739 12.570 48.475 1.00 0.00 H ATOM 526 N LYS A 252 31.919 8.800 49.932 1.00 67.10 N ATOM 527 CA LYS A 252 33.070 7.916 49.773 1.00 69.58 C ATOM 528 C LYS A 252 32.785 6.770 48.804 1.00 65.66 C ATOM 529 O LYS A 252 33.577 6.509 47.892 1.00 67.65 O ATOM 530 CB LYS A 252 33.501 7.346 51.125 1.00 74.27 C ATOM 531 CG LYS A 252 34.720 6.439 51.018 1.00 82.47 C ATOM 532 CD LYS A 252 34.726 5.372 52.100 1.00 86.11 C ATOM 533 CE LYS A 252 35.073 5.957 53.460 1.00 89.44 C ATOM 534 NZ LYS A 252 35.095 4.909 54.519 1.00 91.55 N ATOM 535 HZ1 LYS A 252 34.158 4.462 54.583 1.00 0.00 H ATOM 536 HZ2 LYS A 252 35.807 4.190 54.279 1.00 0.00 H ATOM 537 HZ3 LYS A 252 35.335 5.345 55.432 1.00 0.00 H ATOM 538 H LYS A 252 31.264 8.647 50.725 1.00 0.00 H ATOM 539 N LYS A 253 31.673 6.066 48.996 1.00 58.24 N ATOM 540 CA LYS A 253 31.299 4.978 48.105 1.00 55.94 C ATOM 541 C LYS A 253 29.793 4.777 48.164 1.00 52.69 C ATOM 542 O LYS A 253 29.111 5.288 49.058 1.00 51.19 O ATOM 543 CB LYS A 253 32.032 3.682 48.469 1.00 64.08 C ATOM 544 CG LYS A 253 31.665 3.135 49.821 1.00 63.57 C ATOM 545 CD LYS A 253 32.618 2.033 50.259 1.00 69.13 C ATOM 546 CE LYS A 253 32.275 1.574 51.670 1.00 69.76 C ATOM 547 NZ LYS A 253 33.258 0.596 52.206 1.00 73.22 N ATOM 548 HZ1 LYS A 253 33.280 -0.243 51.592 1.00 0.00 H ATOM 549 HZ2 LYS A 253 34.201 1.033 52.232 1.00 0.00 H ATOM 550 HZ3 LYS A 253 32.978 0.317 53.168 1.00 0.00 H ATOM 551 H LYS A 253 31.057 6.298 49.801 1.00 0.00 H ATOM 552 N VAL A 254 29.288 4.020 47.192 1.00 50.50 N ATOM 553 CA VAL A 254 27.880 3.655 47.088 1.00 47.64 C ATOM 554 C VAL A 254 27.809 2.150 46.871 1.00 49.75 C ATOM 555 O VAL A 254 28.533 1.607 46.028 1.00 54.06 O ATOM 556 CB VAL A 254 27.183 4.405 45.934 1.00 45.67 C ATOM 557 CG1 VAL A 254 25.786 3.909 45.739 1.00 43.78 C ATOM 558 CG2 VAL A 254 27.168 5.916 46.197 1.00 46.78 C ATOM 559 H VAL A 254 29.938 3.667 46.461 1.00 0.00 H ATOM 560 N TRP A 255 26.981 1.476 47.659 1.00 45.46 N ATOM 561 CA TRP A 255 26.661 0.068 47.460 1.00 44.87 C ATOM 562 C TRP A 255 25.297 -0.066 46.797 1.00 43.24 C ATOM 563 O TRP A 255 24.337 0.603 47.199 1.00 43.22 O ATOM 564 CB TRP A 255 26.627 -0.693 48.784 1.00 48.99 C ATOM 565 CG TRP A 255 27.961 -0.944 49.424 1.00 56.97 C ATOM 566 CD1 TRP A 255 28.603 -0.147 50.324 1.00 60.89 C ATOM 567 CD2 TRP A 255 28.791 -2.094 49.241 1.00 63.30 C ATOM 568 NE1 TRP A 255 29.801 -0.721 50.696 1.00 64.99 N ATOM 569 CE2 TRP A 255 29.936 -1.919 50.047 1.00 65.10 C ATOM 570 CE3 TRP A 255 28.685 -3.251 48.464 1.00 64.43 C ATOM 571 CZ2 TRP A 255 30.958 -2.857 50.103 1.00 70.15 C ATOM 572 CZ3 TRP A 255 29.707 -4.186 48.523 1.00 69.02 C ATOM 573 CH2 TRP A 255 30.829 -3.980 49.334 1.00 71.36 C ATOM 574 HE1 TRP A 255 30.488 -0.311 51.360 1.00 0.00 H ATOM 575 H TRP A 255 26.539 1.976 48.457 1.00 0.00 H ATOM 576 N PHE A 256 25.210 -0.954 45.806 1.00 41.27 N ATOM 577 CA PHE A 256 23.942 -1.358 45.204 1.00 43.02 C ATOM 578 C PHE A 256 23.602 -2.781 45.645 1.00 43.48 C ATOM 579 O PHE A 256 24.444 -3.681 45.559 1.00 48.41 O ATOM 580 CB PHE A 256 24.011 -1.278 43.672 1.00 45.53 C ATOM 581 CG PHE A 256 24.310 0.106 43.147 1.00 43.85 C ATOM 582 CD1 PHE A 256 25.613 0.549 43.027 1.00 42.14 C ATOM 583 CD2 PHE A 256 23.283 0.966 42.793 1.00 40.64 C ATOM 584 CE1 PHE A 256 25.899 1.817 42.564 1.00 42.80 C ATOM 585 CE2 PHE A 256 23.559 2.234 42.318 1.00 42.37 C ATOM 586 CZ PHE A 256 24.876 2.659 42.203 1.00 46.94 C ATOM 587 H PHE A 256 26.087 -1.379 45.444 1.00 0.00 H ATOM 588 N PHE A 257 22.381 -2.973 46.133 1.00 36.62 N ATOM 589 CA PHE A 257 21.861 -4.281 46.528 1.00 42.61 C ATOM 590 C PHE A 257 20.731 -4.627 45.558 1.00 38.23 C ATOM 591 O PHE A 257 19.702 -3.955 45.555 1.00 32.76 O ATOM 592 CB PHE A 257 21.319 -4.269 47.961 1.00 41.89 C ATOM 593 CG PHE A 257 22.355 -4.048 49.028 1.00 49.30 C ATOM 594 CD1 PHE A 257 22.976 -5.126 49.642 1.00 55.61 C ATOM 595 CD2 PHE A 257 22.663 -2.766 49.462 1.00 49.85 C ATOM 596 CE1 PHE A 257 23.916 -4.931 50.651 1.00 58.99 C ATOM 597 CE2 PHE A 257 23.611 -2.560 50.469 1.00 54.86 C ATOM 598 CZ PHE A 257 24.237 -3.645 51.056 1.00 58.87 C ATOM 599 H PHE A 257 21.760 -2.146 46.240 1.00 0.00 H ATOM 600 N LEU A 258 20.919 -5.667 44.753 1.00 39.67 N ATOM 601 CA LEU A 258 19.983 -6.031 43.697 1.00 41.45 C ATOM 602 C LEU A 258 19.143 -7.243 44.095 1.00 40.18 C ATOM 603 O LEU A 258 19.425 -7.938 45.072 1.00 37.65 O ATOM 604 CB LEU A 258 20.739 -6.332 42.388 1.00 42.05 C ATOM 605 CG LEU A 258 21.687 -5.236 41.901 1.00 41.17 C ATOM 606 CD1 LEU A 258 22.376 -5.655 40.580 1.00 44.72 C ATOM 607 CD2 LEU A 258 20.929 -3.917 41.745 1.00 35.10 C ATOM 608 H LEU A 258 21.772 -6.247 44.882 1.00 0.00 H ATOM 609 N HIS A 259 18.109 -7.501 43.288 1.00 39.92 N ATOM 610 CA HIS A 259 17.265 -8.675 43.455 1.00 38.06 C ATOM 611 C HIS A 259 18.102 -9.955 43.373 1.00 40.24 C ATOM 612 O HIS A 259 19.101 -10.008 42.651 1.00 43.03 O ATOM 613 CB HIS A 259 16.178 -8.670 42.373 1.00 36.90 C ATOM 614 CG HIS A 259 15.093 -9.669 42.589 1.00 35.01 C ATOM 615 ND1 HIS A 259 15.081 -10.898 41.968 1.00 40.75 N ATOM 616 CD2 HIS A 259 13.965 -9.613 43.339 1.00 35.39 C ATOM 617 CE1 HIS A 259 13.991 -11.559 42.331 1.00 39.07 C ATOM 618 NE2 HIS A 259 13.304 -10.806 43.171 1.00 35.43 N ATOM 619 H HIS A 259 17.900 -6.839 42.513 1.00 0.00 H ATOM 620 N PRO A 260 17.720 -11.010 44.105 1.00 39.00 N ATOM 621 CA PRO A 260 18.530 -12.233 44.097 1.00 41.20 C ATOM 622 C PRO A 260 18.706 -12.840 42.713 1.00 42.69 C ATOM 623 O PRO A 260 19.637 -13.619 42.527 1.00 45.11 O ATOM 624 CB PRO A 260 17.764 -13.180 45.034 1.00 46.66 C ATOM 625 CG PRO A 260 16.909 -12.284 45.876 1.00 44.97 C ATOM 626 CD PRO A 260 16.598 -11.080 45.059 1.00 41.07 C ATOM 627 N SER A 261 17.853 -12.503 41.739 1.00 38.57 N ATOM 628 CA SER A 261 18.052 -12.986 40.376 1.00 44.57 C ATOM 629 C SER A 261 19.402 -12.570 39.809 1.00 47.58 C ATOM 630 O SER A 261 19.844 -13.152 38.818 1.00 48.55 O ATOM 631 CB SER A 261 16.930 -12.487 39.462 1.00 39.45 C ATOM 632 OG SER A 261 16.748 -11.078 39.593 1.00 36.03 O ATOM 633 HG SER A 261 16.513 -10.863 40.530 1.00 0.00 H ATOM 634 H SER A 261 17.040 -11.891 41.955 1.00 0.00 H ATOM 635 N TYR A 262 20.065 -11.583 40.414 1.00 44.68 N ATOM 636 CA TYR A 262 21.375 -11.132 39.977 1.00 46.21 C ATOM 637 C TYR A 262 22.530 -11.825 40.699 1.00 50.29 C ATOM 638 O TYR A 262 23.696 -11.478 40.462 1.00 51.70 O ATOM 639 CB TYR A 262 21.463 -9.608 40.149 1.00 44.10 C ATOM 640 CG TYR A 262 20.810 -8.839 39.010 1.00 41.73 C ATOM 641 CD1 TYR A 262 21.442 -8.721 37.769 1.00 44.24 C ATOM 642 CD2 TYR A 262 19.557 -8.255 39.165 1.00 38.46 C ATOM 643 CE1 TYR A 262 20.841 -8.031 36.725 1.00 46.42 C ATOM 644 CE2 TYR A 262 18.958 -7.564 38.142 1.00 39.45 C ATOM 645 CZ TYR A 262 19.600 -7.452 36.918 1.00 44.03 C ATOM 646 OH TYR A 262 18.978 -6.753 35.907 1.00 41.51 O ATOM 647 HH TYR A 262 19.553 -6.759 35.101 1.00 0.00 H ATOM 648 H TYR A 262 19.625 -11.117 41.233 1.00 0.00 H ATOM 649 N LYS A 263 22.255 -12.813 41.544 1.00 45.62 N ATOM 650 CA LYS A 263 23.340 -13.511 42.238 1.00 52.25 C ATOM 651 C LYS A 263 24.225 -14.249 41.235 1.00 53.39 C ATOM 652 O LYS A 263 23.734 -14.715 40.209 1.00 53.17 O ATOM 653 CB LYS A 263 22.785 -14.479 43.284 1.00 54.37 C ATOM 654 CG LYS A 263 22.158 -13.769 44.488 1.00 54.08 C ATOM 655 CD LYS A 263 21.835 -14.751 45.595 1.00 55.82 C ATOM 656 CE LYS A 263 21.350 -14.017 46.842 1.00 55.37 C ATOM 657 NZ LYS A 263 21.179 -14.959 47.990 1.00 55.16 N ATOM 658 HZ1 LYS A 263 20.479 -15.686 47.739 1.00 0.00 H ATOM 659 HZ2 LYS A 263 22.090 -15.412 48.204 1.00 0.00 H ATOM 660 HZ3 LYS A 263 20.849 -14.432 48.823 1.00 0.00 H ATOM 661 H LYS A 263 21.267 -13.091 41.713 1.00 0.00 H ATOM 662 N PRO A 264 25.535 -14.364 41.525 1.00 54.04 N ATOM 663 CA PRO A 264 26.233 -13.891 42.722 1.00 54.64 C ATOM 664 C PRO A 264 26.721 -12.458 42.599 1.00 53.80 C ATOM 665 O PRO A 264 27.584 -12.043 43.352 1.00 57.92 O ATOM 666 CB PRO A 264 27.415 -14.850 42.827 1.00 58.65 C ATOM 667 CG PRO A 264 27.752 -15.159 41.407 1.00 60.12 C ATOM 668 CD PRO A 264 26.441 -15.126 40.640 1.00 65.86 C ATOM 669 N ASN A 265 26.163 -11.708 41.660 1.00 55.73 N ATOM 670 CA ASN A 265 26.554 -10.323 41.415 1.00 55.35 C ATOM 671 C ASN A 265 25.447 -9.360 41.814 1.00 51.89 C ATOM 672 O ASN A 265 25.158 -8.389 41.111 1.00 51.82 O ATOM 673 CB ASN A 265 26.935 -10.124 39.953 1.00 56.95 C ATOM 674 CG ASN A 265 28.120 -10.961 39.562 1.00 61.25 C ATOM 675 OD1 ASN A 265 28.019 -11.863 38.728 1.00 62.96 O ATOM 676 ND2 ASN A 265 29.254 -10.680 40.178 1.00 62.03 N ATOM 677 HD22 ASN A 265 29.290 -9.909 40.875 1.00 0.00 H ATOM 678 HD21 ASN A 265 30.111 -11.230 39.966 1.00 0.00 H ATOM 679 H ASN A 265 25.413 -12.124 41.072 1.00 0.00 H ATOM 680 N ASP A 266 24.799 -9.631 42.941 1.00 50.53 N ATOM 681 CA ASP A 266 23.686 -8.807 43.387 1.00 46.93 C ATOM 682 C ASP A 266 24.141 -7.678 44.292 1.00 46.96 C ATOM 683 O ASP A 266 23.308 -6.888 44.742 1.00 48.34 O ATOM 684 CB ASP A 266 22.649 -9.669 44.109 1.00 46.85 C ATOM 685 CG ASP A 266 23.257 -10.480 45.228 1.00 55.20 C ATOM 686 OD1 ASP A 266 24.397 -10.970 45.053 1.00 58.41 O ATOM 687 OD2 ASP A 266 22.603 -10.624 46.282 1.00 56.29 O ATOM 688 H ASP A 266 25.092 -10.447 43.515 1.00 0.00 H ATOM 689 N LEU A 267 25.442 -7.579 44.551 1.00 51.63 N ATOM 690 CA LEU A 267 25.995 -6.634 45.517 1.00 55.46 C ATOM 691 C LEU A 267 27.175 -5.925 44.855 1.00 56.63 C ATOM 692 O LEU A 267 28.261 -6.493 44.765 1.00 61.54 O ATOM 693 CB LEU A 267 26.412 -7.378 46.780 1.00 64.42 C ATOM 694 CG LEU A 267 26.871 -6.577 47.997 1.00 71.77 C ATOM 695 CD1 LEU A 267 26.055 -5.315 48.099 1.00 69.83 C ATOM 696 CD2 LEU A 267 26.709 -7.413 49.255 1.00 74.81 C ATOM 697 H LEU A 267 26.097 -8.205 44.041 1.00 0.00 H ATOM 698 N VAL A 268 26.971 -4.688 44.406 1.00 54.13 N ATOM 699 CA VAL A 268 27.941 -3.951 43.597 1.00 53.29 C ATOM 700 C VAL A 268 28.399 -2.714 44.361 1.00 51.81 C ATOM 701 O VAL A 268 27.572 -1.970 44.912 1.00 48.85 O ATOM 702 CB VAL A 268 27.337 -3.535 42.243 1.00 55.62 C ATOM 703 CG1 VAL A 268 28.428 -3.011 41.313 1.00 58.23 C ATOM 704 CG2 VAL A 268 26.591 -4.695 41.608 1.00 55.34 C ATOM 705 H VAL A 268 26.073 -4.221 44.644 1.00 0.00 H ATOM 706 N GLU A 269 29.707 -2.475 44.356 1.00 53.48 N ATOM 707 CA GLU A 269 30.326 -1.344 45.034 1.00 57.16 C ATOM 708 C GLU A 269 30.968 -0.423 44.002 1.00 59.09 C ATOM 709 O GLU A 269 31.838 -0.859 43.240 1.00 57.84 O ATOM 710 CB GLU A 269 31.385 -1.824 46.031 1.00 62.52 C ATOM 711 CG GLU A 269 32.206 -0.716 46.647 1.00 66.54 C ATOM 712 CD GLU A 269 33.415 -1.229 47.410 1.00 74.60 C ATOM 713 OE1 GLU A 269 34.147 -2.090 46.872 1.00 78.99 O ATOM 714 OE2 GLU A 269 33.638 -0.767 48.550 1.00 76.74 O ATOM 715 H GLU A 269 30.324 -3.133 43.838 1.00 0.00 H ATOM 716 N VAL A 270 30.564 0.847 43.989 1.00 59.10 N ATOM 717 CA VAL A 270 31.188 1.859 43.134 1.00 59.84 C ATOM 718 C VAL A 270 31.910 2.852 44.040 1.00 58.95 C ATOM 719 O VAL A 270 31.283 3.719 44.664 1.00 57.18 O ATOM 720 CB VAL A 270 30.168 2.567 42.238 1.00 56.52 C ATOM 721 CG1 VAL A 270 30.870 3.582 41.341 1.00 59.32 C ATOM 722 CG2 VAL A 270 29.431 1.553 41.388 1.00 53.86 C ATOM 723 H VAL A 270 29.778 1.129 44.608 1.00 0.00 H ATOM 724 N ARG A 271 33.234 2.749 44.099 1.00 61.38 N ATOM 725 CA ARG A 271 34.016 3.542 45.039 1.00 68.39 C ATOM 726 C ARG A 271 34.382 4.923 44.515 1.00 71.95 C ATOM 727 O ARG A 271 34.758 5.788 45.311 1.00 75.92 O ATOM 728 CB ARG A 271 35.295 2.789 45.423 1.00 67.50 C ATOM 729 CG ARG A 271 35.015 1.401 45.966 1.00 66.53 C ATOM 730 CD ARG A 271 36.282 0.691 46.377 1.00 70.64 C ATOM 731 NE ARG A 271 36.989 1.388 47.447 1.00 76.80 N ATOM 732 CZ ARG A 271 36.752 1.210 48.745 1.00 78.42 C ATOM 733 NH1 ARG A 271 35.816 0.358 49.145 1.00 75.86 N ATOM 734 NH2 ARG A 271 37.451 1.885 49.647 1.00 81.60 N ATOM 735 HE ARG A 271 37.727 2.069 47.177 1.00 0.00 H ATOM 736 HH12 ARG A 271 35.635 0.223 50.160 1.00 0.00 H ATOM 737 HH11 ARG A 271 35.263 -0.175 48.443 1.00 0.00 H ATOM 738 HH22 ARG A 271 37.265 1.745 50.661 1.00 0.00 H ATOM 739 HH21 ARG A 271 38.186 2.555 49.341 1.00 0.00 H ATOM 740 H ARG A 271 33.722 2.089 43.461 1.00 0.00 H ATOM 741 N GLU A 272 34.283 5.158 43.212 1.00 73.48 N ATOM 742 CA GLU A 272 34.718 6.419 42.638 1.00 79.19 C ATOM 743 C GLU A 272 33.719 6.881 41.592 1.00 79.19 C ATOM 744 O GLU A 272 33.117 6.054 40.898 1.00 76.97 O ATOM 745 CB GLU A 272 36.112 6.289 42.006 1.00 87.99 C ATOM 746 CG GLU A 272 36.277 5.072 41.125 1.00 92.43 C ATOM 747 CD GLU A 272 37.718 4.849 40.723 1.00101.08 C ATOM 748 OE1 GLU A 272 38.602 5.519 41.297 1.00105.57 O ATOM 749 OE2 GLU A 272 37.970 4.007 39.834 1.00103.72 O ATOM 750 H GLU A 272 33.886 4.425 42.590 1.00 0.00 H ATOM 751 N PRO A 273 33.523 8.204 41.453 1.00 82.21 N ATOM 752 CA PRO A 273 32.545 8.772 40.517 1.00 79.83 C ATOM 753 C PRO A 273 32.844 8.389 39.072 1.00 78.74 C ATOM 754 O PRO A 273 34.013 8.199 38.731 1.00 80.36 O ATOM 755 CB PRO A 273 32.699 10.285 40.707 1.00 82.34 C ATOM 756 CG PRO A 273 33.436 10.454 41.993 1.00 84.30 C ATOM 757 CD PRO A 273 34.292 9.250 42.149 1.00 84.84 C ATOM 758 N PRO A 274 31.807 8.281 38.227 1.00 73.85 N ATOM 759 CA PRO A 274 30.372 8.388 38.541 1.00 67.42 C ATOM 760 C PRO A 274 29.789 7.177 39.278 1.00 62.95 C ATOM 761 O PRO A 274 30.181 6.046 39.006 1.00 61.37 O ATOM 762 CB PRO A 274 29.724 8.523 37.155 1.00 65.52 C ATOM 763 CG PRO A 274 30.819 9.078 36.282 1.00 71.78 C ATOM 764 CD PRO A 274 32.062 8.402 36.780 1.00 74.96 C ATOM 765 N PHE A 275 28.851 7.412 40.199 1.00 58.89 N ATOM 766 CA PHE A 275 28.217 6.321 40.932 1.00 49.76 C ATOM 767 C PHE A 275 27.042 5.813 40.089 1.00 53.03 C ATOM 768 O PHE A 275 25.882 6.172 40.289 1.00 50.36 O ATOM 769 CB PHE A 275 27.816 6.785 42.332 1.00 48.38 C ATOM 770 CG PHE A 275 28.979 7.357 43.133 1.00 54.73 C ATOM 771 CD1 PHE A 275 29.991 6.530 43.594 1.00 56.09 C ATOM 772 CD2 PHE A 275 29.071 8.718 43.385 1.00 55.89 C ATOM 773 CE1 PHE A 275 31.074 7.046 44.308 1.00 61.15 C ATOM 774 CE2 PHE A 275 30.149 9.242 44.102 1.00 61.53 C ATOM 775 CZ PHE A 275 31.147 8.406 44.562 1.00 61.70 C ATOM 776 H PHE A 275 28.567 8.392 40.398 1.00 0.00 H ATOM 777 N HIS A 276 27.377 4.958 39.111 1.00 54.91 N ATOM 778 CA HIS A 276 26.434 4.398 38.147 1.00 52.92 C ATOM 779 C HIS A 276 26.510 2.878 38.163 1.00 53.83 C ATOM 780 O HIS A 276 27.565 2.294 38.427 1.00 53.90 O ATOM 781 CB HIS A 276 26.722 4.863 36.698 1.00 53.88 C ATOM 782 CG HIS A 276 26.511 6.325 36.464 1.00 54.28 C ATOM 783 ND1 HIS A 276 26.930 6.959 35.317 1.00 56.97 N ATOM 784 CD2 HIS A 276 25.919 7.275 37.224 1.00 52.11 C ATOM 785 CE1 HIS A 276 26.605 8.237 35.380 1.00 55.81 C ATOM 786 NE2 HIS A 276 25.989 8.455 36.528 1.00 50.58 N ATOM 787 H HIS A 276 28.375 4.675 39.034 1.00 0.00 H ATOM 788 N LEU A 277 25.389 2.242 37.826 1.00 50.54 N ATOM 789 CA LEU A 277 25.330 0.793 37.676 1.00 50.60 C ATOM 790 C LEU A 277 24.500 0.471 36.445 1.00 47.15 C ATOM 791 O LEU A 277 23.306 0.791 36.402 1.00 43.45 O ATOM 792 CB LEU A 277 24.719 0.128 38.914 1.00 49.89 C ATOM 793 CG LEU A 277 24.557 -1.392 38.789 1.00 50.84 C ATOM 794 CD1 LEU A 277 25.912 -2.038 38.897 1.00 54.62 C ATOM 795 CD2 LEU A 277 23.605 -1.952 39.827 1.00 49.85 C ATOM 796 H LEU A 277 24.526 2.799 37.664 1.00 0.00 H ATOM 797 N THR A 278 25.111 -0.185 35.468 1.00 48.95 N ATOM 798 CA THR A 278 24.450 -0.522 34.214 1.00 49.37 C ATOM 799 C THR A 278 24.294 -2.032 34.100 1.00 45.87 C ATOM 800 O THR A 278 25.281 -2.765 34.205 1.00 47.36 O ATOM 801 CB THR A 278 25.245 0.030 33.035 1.00 54.17 C ATOM 802 OG1 THR A 278 25.214 1.460 33.091 1.00 56.54 O ATOM 803 CG2 THR A 278 24.657 -0.453 31.708 1.00 53.58 C ATOM 804 HG1 THR A 278 25.727 1.830 32.330 1.00 0.00 H ATOM 805 H THR A 278 26.102 -0.470 35.602 1.00 0.00 H ATOM 806 N ARG A 279 23.063 -2.488 33.855 1.00 43.94 N ATOM 807 CA ARG A 279 22.768 -3.915 33.807 1.00 46.42 C ATOM 808 C ARG A 279 21.670 -4.199 32.794 1.00 45.58 C ATOM 809 O ARG A 279 20.759 -3.389 32.610 1.00 41.36 O ATOM 810 CB ARG A 279 22.318 -4.429 35.176 1.00 48.27 C ATOM 811 CG ARG A 279 23.416 -4.421 36.210 1.00 51.70 C ATOM 812 CD ARG A 279 24.513 -5.365 35.779 1.00 58.20 C ATOM 813 NE ARG A 279 24.787 -6.317 36.837 1.00 63.36 N ATOM 814 CZ ARG A 279 25.753 -6.161 37.730 1.00 66.56 C ATOM 815 NH1 ARG A 279 26.536 -5.093 37.671 1.00 68.57 N ATOM 816 NH2 ARG A 279 25.935 -7.071 38.676 1.00 66.42 N ATOM 817 HE ARG A 279 24.193 -7.169 36.898 1.00 0.00 H ATOM 818 HH12 ARG A 279 27.296 -4.966 38.370 1.00 0.00 H ATOM 819 HH11 ARG A 279 26.391 -4.382 36.926 1.00 0.00 H ATOM 820 HH22 ARG A 279 26.694 -6.948 39.377 1.00 0.00 H ATOM 821 HH21 ARG A 279 25.319 -7.908 38.718 1.00 0.00 H ATOM 822 H ARG A 279 22.294 -1.807 33.694 1.00 0.00 H ATOM 823 N ARG A 280 21.736 -5.377 32.171 1.00 44.53 N ATOM 824 CA ARG A 280 20.594 -5.900 31.426 1.00 44.65 C ATOM 825 C ARG A 280 19.651 -6.627 32.376 1.00 44.84 C ATOM 826 O ARG A 280 20.067 -7.149 33.412 1.00 46.70 O ATOM 827 CB ARG A 280 21.047 -6.840 30.301 1.00 49.57 C ATOM 828 CG ARG A 280 21.813 -6.105 29.224 1.00 52.71 C ATOM 829 CD ARG A 280 22.335 -7.013 28.119 1.00 62.67 C ATOM 830 NE ARG A 280 22.848 -6.184 27.035 1.00 72.81 N ATOM 831 CZ ARG A 280 22.356 -6.171 25.802 1.00 81.64 C ATOM 832 NH1 ARG A 280 21.355 -6.978 25.477 1.00 83.28 N ATOM 833 NH2 ARG A 280 22.885 -5.369 24.885 1.00 86.65 N ATOM 834 HE ARG A 280 23.654 -5.560 27.242 1.00 0.00 H ATOM 835 HH12 ARG A 280 20.971 -6.967 24.511 1.00 0.00 H ATOM 836 HH11 ARG A 280 20.954 -7.622 26.188 1.00 0.00 H ATOM 837 HH22 ARG A 280 22.500 -5.358 23.919 1.00 0.00 H ATOM 838 HH21 ARG A 280 23.684 -4.752 25.133 1.00 0.00 H ATOM 839 H ARG A 280 22.615 -5.932 32.217 1.00 0.00 H ATOM 840 N GLY A 281 18.369 -6.645 32.021 1.00 44.04 N ATOM 841 CA GLY A 281 17.364 -7.219 32.900 1.00 42.04 C ATOM 842 C GLY A 281 16.034 -7.372 32.194 1.00 42.39 C ATOM 843 O GLY A 281 15.849 -6.934 31.054 1.00 43.00 O ATOM 844 H GLY A 281 18.083 -6.244 31.105 1.00 0.00 H ATOM 845 N TRP A 282 15.099 -8.009 32.897 1.00 40.59 N ATOM 846 CA TRP A 282 13.725 -8.118 32.434 1.00 36.45 C ATOM 847 C TRP A 282 12.704 -7.527 33.382 1.00 35.54 C ATOM 848 O TRP A 282 11.542 -7.363 32.978 1.00 36.75 O ATOM 849 CB TRP A 282 13.356 -9.590 32.171 1.00 39.58 C ATOM 850 CG TRP A 282 13.563 -10.489 33.356 1.00 39.18 C ATOM 851 CD1 TRP A 282 14.662 -11.257 33.621 1.00 40.79 C ATOM 852 CD2 TRP A 282 12.656 -10.695 34.448 1.00 34.55 C ATOM 853 NE1 TRP A 282 14.492 -11.934 34.802 1.00 38.46 N ATOM 854 CE2 TRP A 282 13.273 -11.600 35.335 1.00 36.36 C ATOM 855 CE3 TRP A 282 11.385 -10.199 34.762 1.00 36.73 C ATOM 856 CZ2 TRP A 282 12.654 -12.035 36.512 1.00 34.74 C ATOM 857 CZ3 TRP A 282 10.774 -10.621 35.934 1.00 39.55 C ATOM 858 CH2 TRP A 282 11.406 -11.536 36.793 1.00 33.14 C ATOM 859 HE1 TRP A 282 15.176 -12.593 35.225 1.00 0.00 H ATOM 860 H TRP A 282 15.360 -8.442 33.806 1.00 0.00 H ATOM 861 N GLY A 283 13.076 -7.187 34.622 1.00 33.82 N ATOM 862 CA GLY A 283 12.092 -6.878 35.634 1.00 29.71 C ATOM 863 C GLY A 283 12.395 -5.636 36.452 1.00 31.31 C ATOM 864 O GLY A 283 13.543 -5.195 36.590 1.00 29.69 O ATOM 865 H GLY A 283 14.087 -7.145 34.860 1.00 0.00 H ATOM 866 N GLU A 284 11.314 -5.082 37.013 1.00 27.05 N ATOM 867 CA GLU A 284 11.365 -3.972 37.947 1.00 30.96 C ATOM 868 C GLU A 284 11.339 -4.517 39.370 1.00 30.36 C ATOM 869 O GLU A 284 10.648 -5.502 39.645 1.00 26.65 O ATOM 870 CB GLU A 284 10.174 -3.034 37.723 1.00 24.89 C ATOM 871 CG GLU A 284 10.171 -2.412 36.315 1.00 26.38 C ATOM 872 CD GLU A 284 8.879 -1.675 36.026 1.00 30.27 C ATOM 873 OE1 GLU A 284 7.841 -2.057 36.600 1.00 30.54 O ATOM 874 OE2 GLU A 284 8.899 -0.708 35.247 1.00 29.40 O ATOM 875 H GLU A 284 10.381 -5.470 36.765 1.00 0.00 H ATOM 876 N PHE A 285 12.063 -3.853 40.265 1.00 29.83 N ATOM 877 CA PHE A 285 12.219 -4.271 41.655 1.00 29.10 C ATOM 878 C PHE A 285 12.848 -3.114 42.420 1.00 30.09 C ATOM 879 O PHE A 285 13.374 -2.183 41.796 1.00 28.12 O ATOM 880 CB PHE A 285 13.095 -5.539 41.770 1.00 29.67 C ATOM 881 CG PHE A 285 14.513 -5.360 41.256 1.00 33.12 C ATOM 882 CD1 PHE A 285 14.825 -5.612 39.924 1.00 29.81 C ATOM 883 CD2 PHE A 285 15.530 -4.948 42.108 1.00 28.40 C ATOM 884 CE1 PHE A 285 16.112 -5.444 39.450 1.00 31.87 C ATOM 885 CE2 PHE A 285 16.826 -4.785 41.651 1.00 29.85 C ATOM 886 CZ PHE A 285 17.131 -5.032 40.314 1.00 31.47 C ATOM 887 H PHE A 285 12.547 -2.985 39.957 1.00 0.00 H ATOM 888 N PRO A 286 12.758 -3.118 43.758 1.00 30.16 N ATOM 889 CA PRO A 286 13.363 -2.024 44.550 1.00 26.23 C ATOM 890 C PRO A 286 14.872 -2.195 44.612 1.00 28.20 C ATOM 891 O PRO A 286 15.367 -3.214 45.094 1.00 31.07 O ATOM 892 CB PRO A 286 12.715 -2.181 45.943 1.00 29.88 C ATOM 893 CG PRO A 286 11.539 -3.137 45.755 1.00 31.92 C ATOM 894 CD PRO A 286 11.963 -4.029 44.603 1.00 32.22 C ATOM 895 N VAL A 287 15.604 -1.227 44.067 1.00 30.17 N ATOM 896 CA VAL A 287 17.057 -1.197 44.211 1.00 29.83 C ATOM 897 C VAL A 287 17.390 -0.543 45.543 1.00 33.81 C ATOM 898 O VAL A 287 16.914 0.561 45.840 1.00 34.08 O ATOM 899 CB VAL A 287 17.692 -0.417 43.048 1.00 31.59 C ATOM 900 CG1 VAL A 287 19.193 -0.396 43.176 1.00 31.20 C ATOM 901 CG2 VAL A 287 17.291 -1.028 41.693 1.00 32.56 C ATOM 902 H VAL A 287 15.131 -0.475 43.526 1.00 0.00 H ATOM 903 N ARG A 288 18.197 -1.205 46.359 1.00 36.20 N ATOM 904 CA ARG A 288 18.628 -0.606 47.612 1.00 37.14 C ATOM 905 C ARG A 288 20.015 0.000 47.428 1.00 37.63 C ATOM 906 O ARG A 288 20.979 -0.716 47.112 1.00 40.09 O ATOM 907 CB ARG A 288 18.647 -1.603 48.764 1.00 40.27 C ATOM 908 CG ARG A 288 19.489 -1.055 49.922 1.00 50.78 C ATOM 909 CD ARG A 288 18.803 -1.167 51.293 1.00 57.02 C ATOM 910 NE ARG A 288 19.007 -2.487 51.882 1.00 62.43 N ATOM 911 CZ ARG A 288 20.078 -2.827 52.593 1.00 68.90 C ATOM 912 NH1 ARG A 288 21.042 -1.941 52.807 1.00 71.95 N ATOM 913 NH2 ARG A 288 20.189 -4.054 53.088 1.00 71.05 N ATOM 914 HE ARG A 288 18.269 -3.206 51.737 1.00 0.00 H ATOM 915 HH12 ARG A 288 21.879 -2.208 53.363 1.00 0.00 H ATOM 916 HH11 ARG A 288 20.960 -0.980 52.419 1.00 0.00 H ATOM 917 HH22 ARG A 288 21.028 -4.317 53.644 1.00 0.00 H ATOM 918 HH21 ARG A 288 19.437 -4.752 52.920 1.00 0.00 H ATOM 919 H ARG A 288 18.524 -2.158 46.102 1.00 0.00 H ATOM 920 N VAL A 289 20.102 1.313 47.627 1.00 36.11 N ATOM 921 CA VAL A 289 21.337 2.079 47.508 1.00 41.41 C ATOM 922 C VAL A 289 21.796 2.459 48.910 1.00 44.09 C ATOM 923 O VAL A 289 21.010 2.984 49.710 1.00 44.02 O ATOM 924 CB VAL A 289 21.128 3.336 46.647 1.00 42.67 C ATOM 925 CG1 VAL A 289 22.371 4.211 46.652 1.00 42.38 C ATOM 926 CG2 VAL A 289 20.736 2.956 45.232 1.00 43.40 C ATOM 927 H VAL A 289 19.234 1.825 47.884 1.00 0.00 H ATOM 928 N GLN A 290 23.061 2.202 49.204 1.00 44.21 N ATOM 929 CA GLN A 290 23.657 2.559 50.483 1.00 45.81 C ATOM 930 C GLN A 290 24.789 3.531 50.196 1.00 46.62 C ATOM 931 O GLN A 290 25.778 3.165 49.554 1.00 49.08 O ATOM 932 CB GLN A 290 24.153 1.315 51.220 1.00 48.94 C ATOM 933 CG GLN A 290 24.506 1.531 52.660 1.00 53.57 C ATOM 934 CD GLN A 290 24.706 0.219 53.393 1.00 58.20 C ATOM 935 OE1 GLN A 290 23.753 -0.385 53.886 1.00 58.21 O ATOM 936 NE2 GLN A 290 25.947 -0.232 53.458 1.00 60.69 N ATOM 937 HE22 GLN A 290 26.721 0.312 53.027 1.00 0.00 H ATOM 938 HE21 GLN A 290 26.149 -1.131 53.940 1.00 0.00 H ATOM 939 H GLN A 290 23.652 1.726 48.493 1.00 0.00 H ATOM 940 N VAL A 291 24.639 4.765 50.660 1.00 44.58 N ATOM 941 CA VAL A 291 25.598 5.832 50.407 1.00 46.05 C ATOM 942 C VAL A 291 26.464 5.981 51.650 1.00 51.22 C ATOM 943 O VAL A 291 25.945 6.256 52.739 1.00 49.47 O ATOM 944 CB VAL A 291 24.881 7.146 50.061 1.00 42.36 C ATOM 945 CG1 VAL A 291 25.878 8.275 49.908 1.00 44.09 C ATOM 946 CG2 VAL A 291 24.028 6.968 48.782 1.00 39.46 C ATOM 947 H VAL A 291 23.797 4.981 51.231 1.00 0.00 H ATOM 948 N HIS A 292 27.773 5.767 51.496 1.00 52.33 N ATOM 949 CA HIS A 292 28.746 5.966 52.561 1.00 54.69 C ATOM 950 C HIS A 292 29.472 7.287 52.351 1.00 58.81 C ATOM 951 O HIS A 292 29.802 7.647 51.216 1.00 57.42 O ATOM 952 CB HIS A 292 29.766 4.825 52.602 1.00 55.21 C ATOM 953 CG HIS A 292 29.162 3.495 52.915 1.00 52.83 C ATOM 954 ND1 HIS A 292 29.496 2.770 54.039 1.00 55.65 N ATOM 955 CD2 HIS A 292 28.241 2.759 52.251 1.00 50.20 C ATOM 956 CE1 HIS A 292 28.811 1.641 54.051 1.00 54.03 C ATOM 957 NE2 HIS A 292 28.040 1.612 52.978 1.00 52.70 N ATOM 958 H HIS A 292 28.115 5.442 50.569 1.00 0.00 H ATOM 959 N PHE A 293 29.739 7.996 53.448 1.00 54.43 N ATOM 960 CA PHE A 293 30.284 9.342 53.374 1.00 56.49 C ATOM 961 C PHE A 293 31.753 9.358 53.782 1.00 64.51 C ATOM 962 O PHE A 293 32.187 8.584 54.642 1.00 67.33 O ATOM 963 CB PHE A 293 29.480 10.303 54.252 1.00 55.44 C ATOM 964 CG PHE A 293 28.047 10.416 53.855 1.00 54.05 C ATOM 965 CD1 PHE A 293 27.681 11.165 52.746 1.00 54.50 C ATOM 966 CD2 PHE A 293 27.058 9.763 54.573 1.00 55.25 C ATOM 967 CE1 PHE A 293 26.353 11.267 52.366 1.00 49.10 C ATOM 968 CE2 PHE A 293 25.719 9.863 54.195 1.00 51.11 C ATOM 969 CZ PHE A 293 25.372 10.616 53.091 1.00 45.49 C ATOM 970 H PHE A 293 29.553 7.575 54.381 1.00 0.00 H ATOM 971 N LYS A 294 32.513 10.258 53.148 1.00 67.73 N ATOM 972 CA LYS A 294 33.948 10.352 53.409 1.00 73.95 C ATOM 973 C LYS A 294 34.220 10.659 54.873 1.00 77.17 C ATOM 974 O LYS A 294 35.082 10.035 55.505 1.00 77.90 O ATOM 975 CB LYS A 294 34.578 11.426 52.521 1.00 78.29 C ATOM 976 CG LYS A 294 34.775 11.002 51.085 1.00 80.16 C ATOM 977 CD LYS A 294 35.458 12.089 50.282 1.00 85.51 C ATOM 978 CE LYS A 294 35.642 11.652 48.839 1.00 87.22 C ATOM 979 NZ LYS A 294 36.074 12.778 47.959 1.00 91.22 N ATOM 980 HZ1 LYS A 294 35.355 13.529 47.980 1.00 0.00 H ATOM 981 HZ2 LYS A 294 36.981 13.155 48.301 1.00 0.00 H ATOM 982 HZ3 LYS A 294 36.186 12.432 46.985 1.00 0.00 H ATOM 983 H LYS A 294 32.076 10.901 52.458 1.00 0.00 H ATOM 984 N ASP A 295 33.503 11.633 55.423 1.00 78.23 N ATOM 985 CA ASP A 295 33.554 11.933 56.850 1.00 79.15 C ATOM 986 C ASP A 295 32.693 10.902 57.564 1.00 75.32 C ATOM 987 O ASP A 295 31.468 11.020 57.606 1.00 71.51 O ATOM 988 CB ASP A 295 33.068 13.354 57.115 1.00 78.25 C ATOM 989 CG ASP A 295 33.126 13.729 58.581 1.00 79.52 C ATOM 990 OD1 ASP A 295 33.369 12.835 59.411 1.00 79.19 O ATOM 991 OD2 ASP A 295 32.926 14.918 58.905 1.00 80.69 O ATOM 992 H ASP A 295 32.882 12.203 54.814 1.00 0.00 H ATOM 993 N SER A 296 33.338 9.897 58.155 1.00 81.51 N ATOM 994 CA SER A 296 32.611 8.843 58.852 1.00 82.57 C ATOM 995 C SER A 296 31.760 9.360 60.006 1.00 80.87 C ATOM 996 O SER A 296 30.967 8.587 60.552 1.00 80.09 O ATOM 997 CB SER A 296 33.589 7.785 59.366 1.00 92.75 C ATOM 998 OG SER A 296 34.296 7.184 58.293 1.00 96.60 O ATOM 999 HG SER A 296 34.921 6.505 58.651 1.00 0.00 H ATOM 1000 H SER A 296 34.377 9.864 58.118 1.00 0.00 H ATOM 1001 N GLN A 297 31.908 10.630 60.396 1.00 79.82 N ATOM 1002 CA GLN A 297 30.960 11.237 61.327 1.00 77.47 C ATOM 1003 C GLN A 297 29.532 11.153 60.798 1.00 72.98 C ATOM 1004 O GLN A 297 28.580 10.998 61.572 1.00 75.19 O ATOM 1005 CB GLN A 297 31.344 12.693 61.570 1.00 82.05 C ATOM 1006 CG GLN A 297 30.752 13.332 62.804 1.00 84.35 C ATOM 1007 CD GLN A 297 31.392 14.671 63.111 1.00 87.26 C ATOM 1008 OE1 GLN A 297 32.032 15.282 62.250 1.00 89.65 O ATOM 1009 NE2 GLN A 297 31.232 15.131 64.346 1.00 87.27 N ATOM 1010 HE22 GLN A 297 30.684 14.582 65.039 1.00 0.00 H ATOM 1011 HE21 GLN A 297 31.654 16.041 64.621 1.00 0.00 H ATOM 1012 H GLN A 297 32.705 11.191 60.033 1.00 0.00 H ATOM 1013 N ASN A 298 29.365 11.265 59.482 1.00 64.53 N ATOM 1014 CA ASN A 298 28.061 11.115 58.847 1.00 58.55 C ATOM 1015 C ASN A 298 27.786 9.630 58.627 1.00 57.40 C ATOM 1016 O ASN A 298 28.525 8.961 57.896 1.00 60.99 O ATOM 1017 CB ASN A 298 28.032 11.871 57.521 1.00 56.87 C ATOM 1018 CG ASN A 298 28.444 13.323 57.665 1.00 60.52 C ATOM 1019 OD1 ASN A 298 27.880 14.062 58.467 1.00 61.47 O ATOM 1020 ND2 ASN A 298 29.437 13.736 56.889 1.00 63.87 N ATOM 1021 HD22 ASN A 298 29.886 13.075 56.223 1.00 0.00 H ATOM 1022 HD21 ASN A 298 29.767 14.721 56.946 1.00 0.00 H ATOM 1023 H ASN A 298 30.193 11.466 58.886 1.00 0.00 H ATOM 1024 N LYS A 299 26.735 9.110 59.256 1.00 52.87 N ATOM 1025 CA LYS A 299 26.430 7.691 59.126 1.00 57.04 C ATOM 1026 C LYS A 299 25.817 7.399 57.762 1.00 57.73 C ATOM 1027 O LYS A 299 25.133 8.239 57.176 1.00 57.43 O ATOM 1028 CB LYS A 299 25.485 7.235 60.238 1.00 58.59 C ATOM 1029 CG LYS A 299 26.110 7.312 61.643 1.00 65.74 C ATOM 1030 CD LYS A 299 25.186 6.693 62.683 1.00 68.75 C ATOM 1031 CE LYS A 299 25.743 6.832 64.088 1.00 74.06 C ATOM 1032 NZ LYS A 299 24.925 6.073 65.072 1.00 76.02 N ATOM 1033 HZ1 LYS A 299 23.951 6.436 65.065 1.00 0.00 H ATOM 1034 HZ2 LYS A 299 24.922 5.065 64.815 1.00 0.00 H ATOM 1035 HZ3 LYS A 299 25.332 6.189 66.022 1.00 0.00 H ATOM 1036 H LYS A 299 26.129 9.719 59.843 1.00 0.00 H ATOM 1037 N ARG A 300 26.091 6.194 57.257 1.00 59.54 N ATOM 1038 CA ARG A 300 25.624 5.774 55.942 1.00 56.76 C ATOM 1039 C ARG A 300 24.103 5.761 55.892 1.00 50.61 C ATOM 1040 O ARG A 300 23.429 5.490 56.888 1.00 51.03 O ATOM 1041 CB ARG A 300 26.158 4.380 55.613 1.00 63.30 C ATOM 1042 CG ARG A 300 25.884 3.365 56.713 1.00 69.50 C ATOM 1043 CD ARG A 300 25.926 1.945 56.196 1.00 74.77 C ATOM 1044 NE ARG A 300 24.889 1.121 56.814 1.00 78.77 N ATOM 1045 CZ ARG A 300 25.114 0.195 57.742 1.00 83.43 C ATOM 1046 NH1 ARG A 300 26.350 -0.045 58.164 1.00 86.96 N ATOM 1047 NH2 ARG A 300 24.099 -0.501 58.240 1.00 83.73 N ATOM 1048 HE ARG A 300 23.907 1.269 56.507 1.00 0.00 H ATOM 1049 HH12 ARG A 300 26.520 -0.770 58.890 1.00 0.00 H ATOM 1050 HH11 ARG A 300 27.148 0.492 57.769 1.00 0.00 H ATOM 1051 HH22 ARG A 300 24.272 -1.226 58.966 1.00 0.00 H ATOM 1052 HH21 ARG A 300 23.131 -0.322 57.904 1.00 0.00 H ATOM 1053 H ARG A 300 26.658 5.531 57.823 1.00 0.00 H ATOM 1054 N ILE A 301 23.554 6.048 54.719 1.00 47.14 N ATOM 1055 CA ILE A 301 22.111 6.152 54.560 1.00 48.70 C ATOM 1056 C ILE A 301 21.641 5.197 53.472 1.00 44.72 C ATOM 1057 O ILE A 301 22.323 4.985 52.459 1.00 45.01 O ATOM 1058 CB ILE A 301 21.674 7.597 54.259 1.00 55.35 C ATOM 1059 CG1 ILE A 301 22.207 8.056 52.914 1.00 60.43 C ATOM 1060 CG2 ILE A 301 22.150 8.531 55.367 1.00 58.93 C ATOM 1061 CD1 ILE A 301 21.161 8.762 52.095 1.00 61.97 C ATOM 1062 H ILE A 301 24.169 6.202 53.894 1.00 0.00 H ATOM 1063 N ASP A 302 20.472 4.615 53.699 1.00 38.28 N ATOM 1064 CA ASP A 302 19.874 3.659 52.790 1.00 39.60 C ATOM 1065 C ASP A 302 18.766 4.362 52.013 1.00 40.06 C ATOM 1066 O ASP A 302 17.928 5.055 52.598 1.00 41.26 O ATOM 1067 CB ASP A 302 19.328 2.445 53.549 1.00 43.19 C ATOM 1068 CG ASP A 302 20.435 1.605 54.199 1.00 53.78 C ATOM 1069 OD1 ASP A 302 21.544 1.522 53.638 1.00 54.49 O ATOM 1070 OD2 ASP A 302 20.206 1.026 55.285 1.00 59.69 O ATOM 1071 H ASP A 302 19.960 4.856 54.571 1.00 0.00 H ATOM 1072 N ILE A 303 18.783 4.209 50.701 1.00 36.01 N ATOM 1073 CA ILE A 303 17.739 4.748 49.838 1.00 36.65 C ATOM 1074 C ILE A 303 17.205 3.599 49.012 1.00 34.81 C ATOM 1075 O ILE A 303 17.990 2.802 48.485 1.00 38.33 O ATOM 1076 CB ILE A 303 18.261 5.865 48.921 1.00 35.15 C ATOM 1077 CG1 ILE A 303 18.855 7.005 49.755 1.00 33.68 C ATOM 1078 CG2 ILE A 303 17.147 6.349 47.984 1.00 34.68 C ATOM 1079 CD1 ILE A 303 19.666 7.988 48.926 1.00 36.68 C ATOM 1080 H ILE A 303 19.570 3.685 50.268 1.00 0.00 H ATOM 1081 N ILE A 304 15.880 3.497 48.915 1.00 29.15 N ATOM 1082 CA ILE A 304 15.240 2.446 48.128 1.00 30.41 C ATOM 1083 C ILE A 304 14.700 3.086 46.857 1.00 31.24 C ATOM 1084 O ILE A 304 13.916 4.039 46.916 1.00 29.39 O ATOM 1085 CB ILE A 304 14.127 1.743 48.920 1.00 33.87 C ATOM 1086 CG1 ILE A 304 14.721 1.087 50.164 1.00 38.37 C ATOM 1087 CG2 ILE A 304 13.432 0.702 48.035 1.00 33.85 C ATOM 1088 CD1 ILE A 304 13.689 0.529 51.127 1.00 40.86 C ATOM 1089 H ILE A 304 15.283 4.187 49.415 1.00 0.00 H ATOM 1090 N HIS A 305 15.125 2.582 45.707 1.00 29.09 N ATOM 1091 CA HIS A 305 14.697 3.130 44.433 1.00 27.55 C ATOM 1092 C HIS A 305 13.921 2.068 43.664 1.00 28.47 C ATOM 1093 O HIS A 305 14.421 0.964 43.441 1.00 33.66 O ATOM 1094 CB HIS A 305 15.890 3.631 43.597 1.00 26.14 C ATOM 1095 CG HIS A 305 15.488 4.114 42.243 1.00 32.83 C ATOM 1096 ND1 HIS A 305 14.797 5.290 42.053 1.00 32.18 N ATOM 1097 CD2 HIS A 305 15.619 3.551 41.016 1.00 31.91 C ATOM 1098 CE1 HIS A 305 14.552 5.451 40.763 1.00 30.34 C ATOM 1099 NE2 HIS A 305 15.037 4.409 40.113 1.00 29.54 N ATOM 1100 H HIS A 305 15.781 1.775 45.718 1.00 0.00 H ATOM 1101 N ASN A 306 12.719 2.421 43.229 1.00 30.49 N ATOM 1102 CA ASN A 306 11.850 1.519 42.479 1.00 25.54 C ATOM 1103 C ASN A 306 12.236 1.619 41.008 1.00 25.07 C ATOM 1104 O ASN A 306 11.909 2.594 40.333 1.00 25.08 O ATOM 1105 CB ASN A 306 10.383 1.879 42.717 1.00 29.87 C ATOM 1106 CG ASN A 306 9.956 1.652 44.168 1.00 33.07 C ATOM 1107 OD1 ASN A 306 10.303 0.640 44.759 1.00 33.30 O ATOM 1108 ND2 ASN A 306 9.213 2.594 44.735 1.00 32.19 N ATOM 1109 HD22 ASN A 306 8.942 3.439 44.193 1.00 0.00 H ATOM 1110 HD21 ASN A 306 8.902 2.487 45.722 1.00 0.00 H ATOM 1111 H ASN A 306 12.380 3.383 43.431 1.00 0.00 H ATOM 1112 N LEU A 307 12.956 0.619 40.522 1.00 26.59 N ATOM 1113 CA LEU A 307 13.382 0.604 39.126 1.00 27.83 C ATOM 1114 C LEU A 307 12.177 0.683 38.197 1.00 31.08 C ATOM 1115 O LEU A 307 11.215 -0.069 38.356 1.00 33.86 O ATOM 1116 CB LEU A 307 14.167 -0.674 38.843 1.00 28.34 C ATOM 1117 CG LEU A 307 14.976 -0.712 37.551 1.00 31.32 C ATOM 1118 CD1 LEU A 307 16.244 0.135 37.746 1.00 29.34 C ATOM 1119 CD2 LEU A 307 15.331 -2.143 37.246 1.00 31.63 C ATOM 1120 H LEU A 307 13.222 -0.169 41.146 1.00 0.00 H ATOM 1121 N LYS A 308 12.231 1.593 37.224 1.00 30.37 N ATOM 1122 CA LYS A 308 11.169 1.761 36.236 1.00 29.36 C ATOM 1123 C LYS A 308 11.752 1.531 34.850 1.00 31.97 C ATOM 1124 O LYS A 308 12.691 2.228 34.443 1.00 30.48 O ATOM 1125 CB LYS A 308 10.545 3.153 36.314 1.00 27.60 C ATOM 1126 CG LYS A 308 9.276 3.296 35.466 1.00 29.33 C ATOM 1127 CD LYS A 308 8.060 2.663 36.181 1.00 33.69 C ATOM 1128 CE LYS A 308 6.772 2.922 35.409 1.00 38.17 C ATOM 1129 NZ LYS A 308 5.590 2.702 36.271 1.00 41.61 N ATOM 1130 HZ1 LYS A 308 5.587 1.718 36.609 1.00 0.00 H ATOM 1131 HZ2 LYS A 308 5.630 3.349 37.084 1.00 0.00 H ATOM 1132 HZ3 LYS A 308 4.725 2.884 35.724 1.00 0.00 H ATOM 1133 H LYS A 308 13.066 2.210 37.166 1.00 0.00 H ATOM 1134 N LEU A 309 11.177 0.580 34.122 1.00 32.61 N ATOM 1135 CA LEU A 309 11.687 0.168 32.823 1.00 31.44 C ATOM 1136 C LEU A 309 10.862 0.781 31.698 1.00 31.09 C ATOM 1137 O LEU A 309 9.667 1.042 31.861 1.00 30.94 O ATOM 1138 CB LEU A 309 11.701 -1.362 32.724 1.00 34.49 C ATOM 1139 CG LEU A 309 12.729 -2.077 33.631 1.00 35.78 C ATOM 1140 CD1 LEU A 309 12.809 -3.577 33.322 1.00 36.39 C ATOM 1141 CD2 LEU A 309 14.129 -1.438 33.463 1.00 34.10 C ATOM 1142 H LEU A 309 10.328 0.111 34.496 1.00 0.00 H ATOM 1143 N ASP A 310 11.522 0.998 30.549 1.00 32.58 N ATOM 1144 CA ASP A 310 10.910 1.620 29.378 1.00 34.13 C ATOM 1145 C ASP A 310 9.710 0.820 28.889 1.00 38.21 C ATOM 1146 O ASP A 310 9.765 -0.409 28.783 1.00 39.55 O ATOM 1147 CB ASP A 310 11.952 1.742 28.251 1.00 37.10 C ATOM 1148 CG ASP A 310 11.349 2.179 26.909 1.00 40.32 C ATOM 1149 OD1 ASP A 310 11.051 3.383 26.768 1.00 39.74 O ATOM 1150 OD2 ASP A 310 11.213 1.342 25.969 1.00 39.00 O ATOM 1151 H ASP A 310 12.519 0.709 30.490 1.00 0.00 H ATOM 1152 N ARG A 311 8.625 1.532 28.565 1.00 37.47 N ATOM 1153 CA ARG A 311 7.480 0.933 27.893 1.00 40.65 C ATOM 1154 C ARG A 311 7.205 1.510 26.510 1.00 47.10 C ATOM 1155 O ARG A 311 6.206 1.122 25.891 1.00 51.56 O ATOM 1156 CB ARG A 311 6.218 1.057 28.750 1.00 42.95 C ATOM 1157 CG ARG A 311 6.361 0.425 30.138 1.00 46.58 C ATOM 1158 CD ARG A 311 5.115 0.666 30.978 1.00 49.45 C ATOM 1159 NE ARG A 311 5.303 0.233 32.361 1.00 50.60 N ATOM 1160 CZ ARG A 311 4.308 -0.080 33.175 1.00 54.81 C ATOM 1161 NH1 ARG A 311 4.563 -0.468 34.421 1.00 58.45 N ATOM 1162 NH2 ARG A 311 3.057 -0.008 32.735 1.00 56.32 N ATOM 1163 HE ARG A 311 6.274 0.167 32.726 1.00 0.00 H ATOM 1164 HH12 ARG A 311 3.780 -0.714 35.060 1.00 0.00 H ATOM 1165 HH11 ARG A 311 5.546 -0.526 34.757 1.00 0.00 H ATOM 1166 HH22 ARG A 311 2.268 -0.252 33.368 1.00 0.00 H ATOM 1167 HH21 ARG A 311 2.866 0.292 31.758 1.00 0.00 H ATOM 1168 H ARG A 311 8.598 2.545 28.800 1.00 0.00 H ATOM 1169 N THR A 312 8.054 2.410 25.993 1.00 46.76 N ATOM 1170 CA THR A 312 7.866 2.885 24.625 1.00 46.23 C ATOM 1171 C THR A 312 8.407 1.898 23.605 1.00 50.77 C ATOM 1172 O THR A 312 7.995 1.940 22.433 1.00 49.97 O ATOM 1173 CB THR A 312 8.546 4.237 24.422 1.00 47.69 C ATOM 1174 OG1 THR A 312 9.962 4.044 24.435 1.00 48.86 O ATOM 1175 CG2 THR A 312 8.171 5.215 25.546 1.00 48.67 C ATOM 1176 HG1 THR A 312 10.233 3.658 25.305 1.00 0.00 H ATOM 1177 H THR A 312 8.845 2.769 26.565 1.00 0.00 H ATOM 1178 N TYR A 313 9.347 1.045 24.020 1.00 51.53 N ATOM 1179 CA TYR A 313 9.777 -0.112 23.241 1.00 54.71 C ATOM 1180 C TYR A 313 10.282 0.282 21.857 1.00 58.68 C ATOM 1181 O TYR A 313 10.142 -0.478 20.900 1.00 64.01 O ATOM 1182 CB TYR A 313 8.652 -1.153 23.143 1.00 55.63 C ATOM 1183 CG TYR A 313 8.594 -2.106 24.327 1.00 54.90 C ATOM 1184 CD1 TYR A 313 8.947 -1.685 25.600 1.00 53.06 C ATOM 1185 CD2 TYR A 313 8.216 -3.439 24.162 1.00 57.73 C ATOM 1186 CE1 TYR A 313 8.909 -2.543 26.678 1.00 53.83 C ATOM 1187 CE2 TYR A 313 8.174 -4.316 25.246 1.00 57.60 C ATOM 1188 CZ TYR A 313 8.523 -3.857 26.510 1.00 56.59 C ATOM 1189 OH TYR A 313 8.497 -4.709 27.605 1.00 54.04 O ATOM 1190 HH TYR A 313 8.774 -4.212 28.415 1.00 0.00 H ATOM 1191 H TYR A 313 9.795 1.213 24.944 1.00 0.00 H ATOM 1192 N THR A 314 10.881 1.470 21.745 1.00 58.65 N ATOM 1193 CA THR A 314 11.527 1.921 20.520 1.00 60.17 C ATOM 1194 C THR A 314 13.001 1.556 20.459 1.00 58.25 C ATOM 1195 O THR A 314 13.611 1.697 19.393 1.00 52.97 O ATOM 1196 CB THR A 314 11.426 3.444 20.372 1.00 62.99 C ATOM 1197 OG1 THR A 314 12.154 4.067 21.445 1.00 62.86 O ATOM 1198 CG2 THR A 314 9.968 3.903 20.392 1.00 60.90 C ATOM 1199 HG1 THR A 314 12.093 5.051 21.356 1.00 0.00 H ATOM 1200 H THR A 314 10.887 2.102 22.571 1.00 0.00 H ATOM 1201 N GLY A 315 13.600 1.140 21.575 1.00 53.72 N ATOM 1202 CA GLY A 315 15.030 0.937 21.601 1.00 54.64 C ATOM 1203 C GLY A 315 15.830 2.178 21.912 1.00 54.78 C ATOM 1204 O GLY A 315 17.057 2.095 21.996 1.00 59.53 O ATOM 1205 H GLY A 315 13.036 0.961 22.430 1.00 0.00 H ATOM 1206 N LEU A 316 15.185 3.321 22.070 1.00 52.05 N ATOM 1207 CA LEU A 316 15.843 4.514 22.569 1.00 52.09 C ATOM 1208 C LEU A 316 15.772 4.538 24.094 1.00 50.19 C ATOM 1209 O LEU A 316 14.885 3.939 24.710 1.00 42.94 O ATOM 1210 CB LEU A 316 15.195 5.771 21.986 1.00 55.73 C ATOM 1211 CG LEU A 316 15.312 5.951 20.465 1.00 60.28 C ATOM 1212 CD1 LEU A 316 14.728 7.284 20.038 1.00 62.78 C ATOM 1213 CD2 LEU A 316 16.751 5.830 19.994 1.00 61.65 C ATOM 1214 H LEU A 316 14.174 3.367 21.829 1.00 0.00 H ATOM 1215 N GLN A 317 16.728 5.241 24.695 1.00 49.64 N ATOM 1216 CA GLN A 317 16.802 5.355 26.144 1.00 53.99 C ATOM 1217 C GLN A 317 15.784 6.372 26.649 1.00 50.60 C ATOM 1218 O GLN A 317 15.715 7.492 26.137 1.00 50.51 O ATOM 1219 CB GLN A 317 18.214 5.768 26.560 1.00 59.25 C ATOM 1220 CG GLN A 317 18.331 6.157 28.024 1.00 62.59 C ATOM 1221 CD GLN A 317 19.770 6.388 28.443 1.00 68.25 C ATOM 1222 OE1 GLN A 317 20.564 5.449 28.523 1.00 71.12 O ATOM 1223 NE2 GLN A 317 20.112 7.640 28.714 1.00 69.22 N ATOM 1224 HE22 GLN A 317 19.408 8.401 28.633 1.00 0.00 H ATOM 1225 HE21 GLN A 317 21.085 7.861 29.008 1.00 0.00 H ATOM 1226 H GLN A 317 17.443 5.723 24.113 1.00 0.00 H ATOM 1227 N THR A 318 15.014 5.996 27.679 1.00 46.41 N ATOM 1228 CA THR A 318 14.042 6.899 28.275 1.00 42.63 C ATOM 1229 C THR A 318 14.257 7.002 29.781 1.00 41.36 C ATOM 1230 O THR A 318 14.765 6.083 30.429 1.00 42.16 O ATOM 1231 CB THR A 318 12.592 6.460 28.011 1.00 43.01 C ATOM 1232 OG1 THR A 318 12.352 5.198 28.638 1.00 39.02 O ATOM 1233 CG2 THR A 318 12.294 6.368 26.482 1.00 44.80 C ATOM 1234 HG1 THR A 318 12.499 5.282 29.613 1.00 0.00 H ATOM 1235 H THR A 318 15.114 5.034 28.062 1.00 0.00 H ATOM 1236 N LEU A 319 13.846 8.137 30.332 1.00 40.14 N ATOM 1237 CA LEU A 319 13.994 8.399 31.755 1.00 38.48 C ATOM 1238 C LEU A 319 12.946 7.602 32.512 1.00 35.52 C ATOM 1239 O LEU A 319 11.767 7.623 32.152 1.00 39.02 O ATOM 1240 CB LEU A 319 13.855 9.902 32.027 1.00 40.81 C ATOM 1241 CG LEU A 319 14.033 10.380 33.478 1.00 42.86 C ATOM 1242 CD1 LEU A 319 15.159 9.639 34.165 1.00 43.17 C ATOM 1243 CD2 LEU A 319 14.288 11.874 33.506 1.00 48.09 C ATOM 1244 H LEU A 319 13.405 8.860 29.729 1.00 0.00 H ATOM 1245 N GLY A 320 13.372 6.868 33.539 1.00 33.64 N ATOM 1246 CA GLY A 320 12.435 6.009 34.250 1.00 30.81 C ATOM 1247 C GLY A 320 11.828 6.600 35.515 1.00 31.01 C ATOM 1248 O GLY A 320 10.603 6.763 35.611 1.00 30.16 O ATOM 1249 H GLY A 320 14.369 6.908 33.832 1.00 0.00 H ATOM 1250 N ALA A 321 12.667 6.907 36.509 1.00 30.80 N ATOM 1251 CA ALA A 321 12.173 7.376 37.801 1.00 28.85 C ATOM 1252 C ALA A 321 13.293 8.077 38.556 1.00 30.24 C ATOM 1253 O ALA A 321 14.472 7.873 38.262 1.00 31.13 O ATOM 1254 CB ALA A 321 11.626 6.218 38.641 1.00 26.45 C ATOM 1255 H ALA A 321 13.692 6.810 36.360 1.00 0.00 H ATOM 1256 N GLU A 322 12.913 8.910 39.543 1.00 31.34 N ATOM 1257 CA GLU A 322 13.897 9.512 40.446 1.00 32.45 C ATOM 1258 C GLU A 322 13.378 9.495 41.874 1.00 35.69 C ATOM 1259 O GLU A 322 12.186 9.723 42.120 1.00 38.00 O ATOM 1260 CB GLU A 322 14.257 10.950 40.044 1.00 32.91 C ATOM 1261 CG GLU A 322 15.169 11.012 38.818 1.00 38.47 C ATOM 1262 CD GLU A 322 15.657 12.417 38.509 1.00 45.70 C ATOM 1263 OE1 GLU A 322 15.059 13.388 39.003 1.00 51.09 O ATOM 1264 OE2 GLU A 322 16.654 12.545 37.783 1.00 52.76 O ATOM 1265 H GLU A 322 11.904 9.130 39.666 1.00 0.00 H ATOM 1266 N THR A 323 14.279 9.166 42.800 1.00 31.44 N ATOM 1267 CA THR A 323 14.010 9.098 44.231 1.00 30.43 C ATOM 1268 C THR A 323 14.946 10.132 44.840 1.00 35.66 C ATOM 1269 O THR A 323 16.171 10.012 44.716 1.00 35.85 O ATOM 1270 CB THR A 323 14.261 7.687 44.782 1.00 32.40 C ATOM 1271 OG1 THR A 323 13.516 6.726 44.008 1.00 28.43 O ATOM 1272 CG2 THR A 323 13.859 7.560 46.305 1.00 33.02 C ATOM 1273 HG1 THR A 323 13.808 6.767 43.063 1.00 0.00 H ATOM 1274 H THR A 323 15.242 8.942 42.478 1.00 0.00 H ATOM 1275 N VAL A 324 14.381 11.195 45.407 1.00 36.57 N ATOM 1276 CA VAL A 324 15.165 12.331 45.881 1.00 37.45 C ATOM 1277 C VAL A 324 15.092 12.358 47.398 1.00 39.03 C ATOM 1278 O VAL A 324 13.997 12.253 47.973 1.00 38.58 O ATOM 1279 CB VAL A 324 14.667 13.654 45.277 1.00 37.11 C ATOM 1280 CG1 VAL A 324 15.550 14.830 45.741 1.00 38.93 C ATOM 1281 CG2 VAL A 324 14.659 13.582 43.760 1.00 33.56 C ATOM 1282 H VAL A 324 13.347 11.217 45.516 1.00 0.00 H ATOM 1283 N VAL A 325 16.256 12.478 48.055 1.00 37.90 N ATOM 1284 CA VAL A 325 16.300 12.605 49.510 1.00 41.04 C ATOM 1285 C VAL A 325 17.297 13.686 49.911 1.00 42.32 C ATOM 1286 O VAL A 325 18.314 13.899 49.248 1.00 45.74 O ATOM 1287 CB VAL A 325 16.658 11.269 50.209 1.00 43.69 C ATOM 1288 CG1 VAL A 325 15.792 10.135 49.684 1.00 43.13 C ATOM 1289 CG2 VAL A 325 18.117 10.945 50.015 1.00 47.33 C ATOM 1290 H VAL A 325 17.146 12.481 47.517 1.00 0.00 H ATOM 1291 N ASP A 326 16.995 14.379 51.008 1.00 43.53 N ATOM 1292 CA ASP A 326 17.948 15.293 51.627 1.00 49.34 C ATOM 1293 C ASP A 326 18.742 14.546 52.687 1.00 47.20 C ATOM 1294 O ASP A 326 18.169 13.795 53.483 1.00 46.28 O ATOM 1295 CB ASP A 326 17.240 16.493 52.254 1.00 50.34 C ATOM 1296 CG ASP A 326 16.808 17.503 51.223 1.00 54.73 C ATOM 1297 OD1 ASP A 326 17.432 17.530 50.135 1.00 55.67 O ATOM 1298 OD2 ASP A 326 15.848 18.258 51.483 1.00 57.33 O ATOM 1299 H ASP A 326 16.053 14.265 51.435 1.00 0.00 H ATOM 1300 N VAL A 327 20.057 14.741 52.680 1.00 47.59 N ATOM 1301 CA VAL A 327 20.947 14.210 53.706 1.00 48.58 C ATOM 1302 C VAL A 327 21.540 15.371 54.490 1.00 48.18 C ATOM 1303 O VAL A 327 21.755 16.468 53.959 1.00 49.89 O ATOM 1304 CB VAL A 327 22.065 13.335 53.107 1.00 49.94 C ATOM 1305 CG1 VAL A 327 21.463 12.275 52.219 1.00 49.66 C ATOM 1306 CG2 VAL A 327 23.039 14.179 52.316 1.00 51.47 C ATOM 1307 H VAL A 327 20.471 15.299 51.906 1.00 0.00 H ATOM 1308 N GLU A 328 21.791 15.124 55.771 1.00 46.04 N ATOM 1309 CA GLU A 328 22.435 16.082 56.658 1.00 49.92 C ATOM 1310 C GLU A 328 23.897 15.704 56.825 1.00 55.50 C ATOM 1311 O GLU A 328 24.212 14.549 57.128 1.00 60.36 O ATOM 1312 CB GLU A 328 21.757 16.106 58.027 1.00 55.59 C ATOM 1313 CG GLU A 328 20.337 16.597 57.993 1.00 61.04 C ATOM 1314 CD GLU A 328 19.537 16.126 59.183 1.00 63.57 C ATOM 1315 OE1 GLU A 328 20.144 15.666 60.180 1.00 64.25 O ATOM 1316 OE2 GLU A 328 18.296 16.210 59.108 1.00 64.51 O ATOM 1317 H GLU A 328 21.514 14.200 56.160 1.00 0.00 H ATOM 1318 N LEU A 329 24.780 16.672 56.644 1.00 51.89 N ATOM 1319 CA LEU A 329 26.201 16.483 56.867 1.00 54.86 C ATOM 1320 C LEU A 329 26.643 17.394 58.001 1.00 60.46 C ATOM 1321 O LEU A 329 26.189 18.537 58.098 1.00 61.56 O ATOM 1322 CB LEU A 329 27.002 16.783 55.601 1.00 60.58 C ATOM 1323 CG LEU A 329 26.521 16.045 54.351 1.00 59.16 C ATOM 1324 CD1 LEU A 329 27.361 16.426 53.131 1.00 58.44 C ATOM 1325 CD2 LEU A 329 26.548 14.548 54.589 1.00 57.60 C ATOM 1326 H LEU A 329 24.443 17.604 56.330 1.00 0.00 H ATOM 1327 N HIS A 330 27.519 16.881 58.861 1.00 63.34 N ATOM 1328 CA HIS A 330 28.075 17.704 59.928 1.00 69.02 C ATOM 1329 C HIS A 330 28.917 18.824 59.334 1.00 74.90 C ATOM 1330 O HIS A 330 29.613 18.633 58.333 1.00 77.35 O ATOM 1331 CB HIS A 330 28.919 16.855 60.879 1.00 72.77 C ATOM 1332 CG HIS A 330 28.114 16.055 61.858 1.00 74.14 C ATOM 1333 ND1 HIS A 330 27.405 14.928 61.498 1.00 73.09 N ATOM 1334 CD2 HIS A 330 27.905 16.221 63.187 1.00 76.70 C ATOM 1335 CE1 HIS A 330 26.795 14.435 62.562 1.00 72.31 C ATOM 1336 NE2 HIS A 330 27.082 15.200 63.600 1.00 74.01 N ATOM 1337 H HIS A 330 27.809 15.886 58.771 1.00 0.00 H ATOM 1338 N ARG A 331 28.829 20.002 59.938 1.00 78.38 N ATOM 1339 CA ARG A 331 29.615 21.144 59.495 1.00 83.66 C ATOM 1340 C ARG A 331 30.222 21.883 60.684 1.00 87.39 C ATOM 1341 O ARG A 331 30.696 21.262 61.634 1.00 88.45 O ATOM 1342 CB ARG A 331 28.765 22.107 58.665 1.00 85.44 C ATOM 1343 CG ARG A 331 29.545 23.340 58.220 1.00 94.08 C ATOM 1344 CD ARG A 331 28.749 24.210 57.265 1.00 95.81 C ATOM 1345 NE ARG A 331 29.568 25.268 56.679 1.00 99.88 N ATOM 1346 CZ ARG A 331 30.072 25.224 55.449 1.00101.99 C ATOM 1347 NH1 ARG A 331 29.833 24.176 54.667 1.00 99.48 N ATOM 1348 NH2 ARG A 331 30.809 26.229 54.995 1.00106.94 N ATOM 1349 HE ARG A 331 29.769 26.107 57.259 1.00 0.00 H ATOM 1350 HH12 ARG A 331 30.228 24.144 53.706 1.00 0.00 H ATOM 1351 HH11 ARG A 331 29.251 23.388 55.017 1.00 0.00 H ATOM 1352 HH22 ARG A 331 31.202 26.192 54.033 1.00 0.00 H ATOM 1353 HH21 ARG A 331 30.994 27.054 55.601 1.00 0.00 H ATOM 1354 H ARG A 331 28.184 20.112 60.746 1.00 0.00 H TER 1355 ARG A 331 HETATM 1356 O HOH 1 21.667 -15.431 40.145 1.00 70.74 O HETATM 1357 O HOH 2 13.447 3.508 32.009 1.00 38.10 O HETATM 1358 O HOH 3 23.441 17.775 46.234 1.00 48.52 O HETATM 1359 O HOH 4 17.149 -4.859 45.637 1.00 49.34 O HETATM 1360 O HOH 5 27.166 10.158 40.044 1.00 46.65 O HETATM 1361 O HOH 6 25.901 10.708 37.797 1.00 60.35 O HETATM 1362 O HOH 7 27.636 -0.765 35.543 1.00 60.00 O HETATM 1363 O HOH 8 20.010 -10.526 46.158 1.00 46.25 O HETATM 1364 O HOH 9 11.445 5.066 43.681 1.00 31.33 O HETATM 1365 O HOH 10 13.527 1.668 24.266 1.00 41.84 O HETATM 1366 O HOH 11 30.350 16.245 57.346 1.00 55.64 O HETATM 1367 O HOH 12 10.580 -7.926 30.409 1.00 30.07 O HETATM 1368 O HOH 13 9.759 -0.199 47.276 1.00 42.21 O HETATM 1369 O HOH 14 9.568 3.887 39.899 1.00 28.97 O HETATM 1370 O HOH 15 19.097 5.256 55.977 1.00 49.58 O HETATM 1371 O HOH 16 11.066 4.976 31.069 1.00 35.16 O HETATM 1372 O HOH 17 9.675 -0.739 40.554 1.00 33.98 O HETATM 1373 O HOH 18 14.661 13.619 52.302 1.00 47.24 O HETATM 1374 O HOH 19 16.114 -5.890 35.675 1.00 36.51 O HETATM 1375 O HOH 20 32.496 4.732 38.061 1.00 66.55 O HETATM 1376 O HOH 21 29.001 6.815 55.944 1.00 50.04 O HETATM 1377 O HOH 22 32.575 -1.757 40.617 1.00 76.85 O HETATM 1378 O HOH 23 19.055 -16.325 43.305 1.00 51.50 O HETATM 1379 O HOH 24 10.198 9.014 30.179 1.00 38.88 O HETATM 1380 O HOH 25 23.670 22.903 50.451 1.00 60.80 O HETATM 1381 O HOH 26 23.421 10.568 58.075 1.00 56.87 O HETATM 1382 O HOH 27 12.261 10.093 28.612 1.00 45.76 O HETATM 1383 O HOH 28 31.253 13.379 54.316 1.00 55.96 O HETATM 1384 O HOH 29 20.205 2.329 29.354 1.00 47.40 O HETATM 1385 O HOH 30 11.288 6.569 23.218 1.00 46.96 O HETATM 1386 O HOH 31 10.115 -1.682 42.707 1.00 49.87 O HETATM 1387 O HOH 32 16.883 -3.800 50.011 1.00 53.93 O HETATM 1388 O HOH 33 24.344 -7.154 32.360 1.00 56.50 O HETATM 1389 O HOH 34 17.734 9.746 29.224 1.00 64.80 O HETATM 1390 O HOH 35 13.078 15.151 49.269 1.00 55.54 O HETATM 1391 O HOH 36 8.687 2.285 48.005 1.00 57.42 O HETATM 1392 O HOH 37 15.106 7.171 52.214 1.00 64.64 O HETATM 1393 O HOH 38 15.482 -7.339 45.745 1.00 43.76 O HETATM 1394 O HOH 39 6.433 1.755 42.294 1.00 49.91 O HETATM 1395 O HOH 40 9.166 5.493 42.089 1.00 41.74 O HETATM 1396 O HOH 41 7.312 -8.855 21.891 1.00 63.25 O HETATM 1397 O HOH 42 7.472 2.157 40.082 1.00 55.76 O HETATM 1398 O HOH 43 10.795 -1.799 48.921 1.00 46.06 O HETATM 1399 O HOH 44 12.195 -10.835 51.615 1.00 47.31 O HETATM 1400 O HOH 45 7.526 -7.316 48.621 1.00 51.31 O HETATM 1401 O HOH 46 2.718 -3.554 34.328 1.00 40.09 O HETATM 1402 O HOH 47 6.457 -4.465 36.722 1.00 30.63 O HETATM 1403 O HOH 48 12.887 -7.041 45.258 1.00 46.95 O HETATM 1404 O HOH 49 8.335 -6.198 30.268 1.00 49.05 O HETATM 1405 O HOH 50 7.030 -9.124 28.503 1.00 44.00 O HETATM 1406 O HOH 51 10.231 -6.837 47.009 1.00 34.71 O HETATM 1407 O HOH 52 5.204 -14.045 50.795 1.00 32.49 O HETATM 1408 O HOH 53 8.834 -5.246 42.769 1.00 49.24 O HETATM 1409 O HOH 54 8.433 -5.028 45.114 1.00 51.11 O HETATM 1410 O HOH 55 12.499 -6.290 48.202 1.00 62.37 O HETATM 1411 N ALA A 56 9.941 -11.611 51.280 1.00 0.24 N HETATM 1412 CA ALA A 56 10.078 -12.044 49.885 1.00 0.06 C HETATM 1413 C ALA A 56 10.655 -10.913 49.030 1.00 0.23 C HETATM 1414 O ALA A 56 10.305 -9.754 49.216 1.00 -0.39 O HETATM 1415 N ALA A 56 11.559 -11.233 48.110 1.00 -0.26 N HETATM 1416 CA ALA A 56 12.090 -10.244 47.175 1.00 0.13 C HETATM 1417 C ALA A 56 11.350 -10.404 45.845 1.00 0.20 C HETATM 1418 O ALA A 56 11.490 -11.424 45.161 1.00 -0.39 O HETATM 1419 N ALA A 56 10.550 -9.407 45.487 1.00 -0.26 N HETATM 1420 CA ALA A 56 9.679 -9.521 44.317 1.00 0.13 C HETATM 1421 C ALA A 56 10.206 -8.738 43.135 1.00 0.20 C HETATM 1422 O ALA A 56 10.801 -7.679 43.313 1.00 -0.39 O HETATM 1423 N ALA A 56 9.932 -9.224 41.928 1.00 -0.26 N HETATM 1424 CA ALA A 56 10.356 -8.560 40.729 1.00 0.13 C HETATM 1425 CB ALA A 56 11.699 -9.128 40.360 1.00 -0.01 C HETATM 1426 CG ALA A 56 12.237 -8.678 39.015 1.00 -0.05 C HETATM 1427 CD ALA A 56 13.688 -9.108 38.900 1.00 -0.03 C HETATM 1428 CE ALA A 56 14.327 -8.838 37.560 1.00 0.03 C HETATM 1429 NZ ALA A 56 15.513 -9.616 37.470 1.00 -0.29 N HETATM 1430 CH ALA A 56 16.313 -9.514 36.321 1.00 0.18 C HETATM 1431 OH ALA A 56 15.960 -8.745 35.441 1.00 -0.40 O HETATM 1432 CX ALA A 56 17.584 -10.350 36.209 1.00 -0.00 C HETATM 1433 CY ALA A 56 18.359 -10.240 35.101 1.00 -0.06 C HETATM 1434 CH3 ALA A 56 19.631 -11.066 34.939 1.00 -0.03 C HETATM 1435 H39 ALA A 56 20.105 -10.825 33.976 1.00 0.05 H HETATM 1436 H40 ALA A 56 19.379 -12.136 34.966 1.00 0.05 H HETATM 1437 H41 ALA A 56 20.327 -10.832 35.758 1.00 0.05 H HETATM 1438 H38 ALA A 56 18.067 -9.549 34.312 1.00 0.08 H HETATM 1439 H37 ALA A 56 17.867 -11.029 37.012 1.00 0.05 H HETATM 1440 H36 ALA A 56 15.774 -10.229 38.216 1.00 0.18 H HETATM 1441 H34 ALA A 56 14.575 -7.770 37.474 1.00 0.05 H HETATM 1442 H35 ALA A 56 13.634 -9.120 36.753 1.00 0.05 H HETATM 1443 H32 ALA A 56 13.740 -10.190 39.091 1.00 0.03 H HETATM 1444 H33 ALA A 56 14.265 -8.572 39.668 1.00 0.03 H HETATM 1445 H30 ALA A 56 12.169 -7.583 38.937 1.00 0.03 H HETATM 1446 H31 ALA A 56 11.649 -9.140 38.208 1.00 0.03 H HETATM 1447 H28 ALA A 56 11.613 -10.225 40.344 1.00 0.03 H HETATM 1448 H29 ALA A 56 12.421 -8.828 41.134 1.00 0.03 H HETATM 1449 C ALA A 56 9.379 -8.872 39.627 1.00 0.20 C HETATM 1450 O ALA A 56 8.937 -10.038 39.538 1.00 -0.39 O HETATM 1451 N ALA A 56 9.046 -7.910 38.766 1.00 -0.26 N HETATM 1452 CA ALA A 56 8.035 -8.189 37.752 1.00 0.15 C HETATM 1453 C ALA A 56 8.281 -7.442 36.444 1.00 0.21 C HETATM 1454 O ALA A 56 8.773 -6.284 36.430 1.00 -0.39 O HETATM 1455 N ALA A 56 7.923 -8.108 35.334 1.00 -0.26 N HETATM 1456 CA ALA A 56 8.111 -7.491 34.019 1.00 0.13 C HETATM 1457 C ALA A 56 6.992 -6.498 33.761 1.00 0.21 C HETATM 1458 O ALA A 56 5.814 -6.844 33.920 1.00 -0.39 O HETATM 1459 N ALA A 56 7.308 -5.267 33.381 1.00 -0.23 N HETATM 1460 CA ALA A 56 6.245 -4.288 33.083 1.00 0.15 C HETATM 1461 C ALA A 56 5.207 -4.773 32.086 1.00 0.21 C HETATM 1462 O ALA A 56 4.030 -4.399 32.186 1.00 -0.39 O HETATM 1463 N ALA A 56 5.604 -5.601 31.128 1.00 -0.27 N HETATM 1464 CA ALA A 56 4.680 -6.049 30.101 1.00 0.09 C HETATM 1465 C ALA A 56 4.559 -7.558 30.149 1.00 0.06 C HETATM 1466 O ALA A 56 4.274 -8.156 29.125 1.00 -0.57 O HETATM 1467 OXT ALA A 56 4.735 -8.206 31.202 1.00 -0.57 O HETATM 1468 CB ALA A 56 5.137 -5.581 28.712 1.00 -0.03 C HETATM 1469 H59 ALA A 56 4.422 -5.932 27.953 1.00 0.03 H HETATM 1470 H60 ALA A 56 6.133 -5.993 28.496 1.00 0.03 H HETATM 1471 H61 ALA A 56 5.183 -4.482 28.692 1.00 0.03 H HETATM 1472 H58 ALA A 56 3.691 -5.612 30.305 1.00 0.07 H HETATM 1473 H57 ALA A 56 6.551 -5.921 31.113 1.00 0.19 H HETATM 1474 CB ALA A 56 7.016 -3.095 32.501 1.00 -0.05 C HETATM 1475 CG ALA A 56 8.389 -3.285 32.824 1.00 -0.07 C HETATM 1476 CD ALA A 56 8.647 -4.743 33.110 1.00 0.06 C HETATM 1477 H55 ALA A 56 9.099 -5.243 32.240 1.00 0.07 H HETATM 1478 H56 ALA A 56 9.303 -4.864 33.984 1.00 0.07 H HETATM 1479 H54 ALA A 56 9.140 -2.497 32.859 1.00 0.05 H HETATM 1480 H53 ALA A 56 6.592 -2.260 31.945 1.00 0.05 H HETATM 1481 H52 ALA A 56 5.730 -4.003 34.012 1.00 0.09 H HETATM 1482 CB ALA A 56 8.144 -8.551 32.917 1.00 -0.02 C HETATM 1483 H49 ALA A 56 8.286 -8.062 31.942 1.00 0.03 H HETATM 1484 H50 ALA A 56 7.194 -9.106 32.914 1.00 0.03 H HETATM 1485 H51 ALA A 56 8.975 -9.247 33.102 1.00 0.03 H HETATM 1486 H48 ALA A 56 9.071 -6.953 34.016 1.00 0.08 H HETATM 1487 H47 ALA A 56 7.529 -9.024 35.405 1.00 0.19 H HETATM 1488 CB ALA A 56 6.631 -7.855 38.291 1.00 0.08 C HETATM 1489 OG ALA A 56 6.467 -6.459 38.472 1.00 -0.39 O HETATM 1490 H46 ALA A 56 6.585 -6.017 37.639 1.00 0.21 H HETATM 1491 H44 ALA A 56 6.489 -8.361 39.258 1.00 0.06 H HETATM 1492 H45 ALA A 56 5.878 -8.214 37.575 1.00 0.06 H HETATM 1493 H43 ALA A 56 8.072 -9.266 37.533 1.00 0.08 H HETATM 1494 H42 ALA A 56 9.482 -7.011 38.815 1.00 0.19 H HETATM 1495 H27 ALA A 56 10.422 -7.473 40.887 1.00 0.08 H HETATM 1496 H26 ALA A 56 9.415 -10.077 41.854 1.00 0.19 H HETATM 1497 CB ALA A 56 8.266 -9.038 44.655 1.00 -0.01 C HETATM 1498 CG ALA A 56 7.664 -9.784 45.808 1.00 -0.02 C HETATM 1499 CD ALA A 56 6.228 -9.360 46.150 1.00 0.06 C HETATM 1500 NE ALA A 56 5.588 -10.443 46.914 1.00 -0.27 N HETATM 1501 CZ ALA A 56 5.727 -10.579 48.222 1.00 0.29 C HETATM 1502 NH1 ALA A 56 6.468 -9.694 48.871 1.00 -0.28 N HETATM 1503 H22 ALA A 56 6.593 -9.776 49.890 1.00 0.26 H HETATM 1504 H23 ALA A 56 6.919 -8.924 48.357 1.00 0.26 H HETATM 1505 NH2 ALA A 56 5.151 -11.587 48.876 1.00 -0.28 N HETATM 1506 H24 ALA A 56 4.576 -12.271 48.364 1.00 0.26 H HETATM 1507 H25 ALA A 56 5.281 -11.682 49.893 1.00 0.26 H HETATM 1508 H21 ALA A 56 5.006 -11.125 46.407 1.00 0.26 H HETATM 1509 H19 ALA A 56 5.665 -9.178 45.223 1.00 0.07 H HETATM 1510 H20 ALA A 56 6.247 -8.441 46.755 1.00 0.07 H HETATM 1511 H17 ALA A 56 8.294 -9.616 46.694 1.00 0.03 H HETATM 1512 H18 ALA A 56 7.658 -10.856 45.560 1.00 0.03 H HETATM 1513 H15 ALA A 56 7.625 -9.177 43.772 1.00 0.03 H HETATM 1514 H16 ALA A 56 8.310 -7.969 44.911 1.00 0.03 H HETATM 1515 H14 ALA A 56 9.628 -10.582 44.032 1.00 0.08 H HETATM 1516 H13 ALA A 56 10.543 -8.565 46.026 1.00 0.19 H HETATM 1517 CB ALA A 56 13.604 -10.404 47.014 1.00 -0.02 C HETATM 1518 H10 ALA A 56 13.979 -9.650 46.307 1.00 0.03 H HETATM 1519 H11 ALA A 56 13.828 -11.410 46.630 1.00 0.03 H HETATM 1520 H12 ALA A 56 14.093 -10.267 47.990 1.00 0.03 H HETATM 1521 H9 ALA A 56 11.892 -9.237 47.570 1.00 0.08 H HETATM 1522 H8 ALA A 56 11.885 -12.177 48.056 1.00 0.19 H HETATM 1523 CB ALA A 56 8.735 -12.490 49.344 1.00 -0.00 C HETATM 1524 H5 ALA A 56 8.850 -12.812 48.298 1.00 0.03 H HETATM 1525 H6 ALA A 56 8.023 -11.653 49.394 1.00 0.03 H HETATM 1526 H7 ALA A 56 8.357 -13.329 49.947 1.00 0.03 H HETATM 1527 H4 ALA A 56 10.771 -12.898 49.849 1.00 0.11 H HETATM 1528 H1 ALA A 56 9.560 -12.365 51.830 1.00 0.20 H HETATM 1529 H2 ALA A 56 9.323 -10.816 51.326 1.00 0.20 H HETATM 1530 H3 ALA A 56 10.846 -11.354 51.642 1.00 0.20 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1411 1412 1528 1529 1530 CONECT 1412 1411 1413 1523 1527 CONECT 1413 1412 1414 1415 CONECT 1414 1413 CONECT 1415 1413 1416 1522 CONECT 1416 1415 1417 1517 1521 CONECT 1417 1416 1418 1419 CONECT 1418 1417 CONECT 1419 1417 1420 1516 CONECT 1420 1419 1421 1497 1515 CONECT 1421 1420 1422 1423 CONECT 1422 1421 CONECT 1423 1421 1424 1496 CONECT 1424 1423 1425 1449 1495 CONECT 1425 1424 1426 1447 1448 CONECT 1426 1425 1427 1445 1446 CONECT 1427 1426 1428 1443 1444 CONECT 1428 1427 1429 1441 1442 CONECT 1429 1428 1430 1440 CONECT 1430 1429 1431 1432 CONECT 1431 1430 CONECT 1432 1430 1433 1439 CONECT 1433 1432 1434 1438 CONECT 1434 1433 1435 1436 1437 CONECT 1435 1434 CONECT 1436 1434 CONECT 1437 1434 CONECT 1438 1433 CONECT 1439 1432 CONECT 1440 1429 CONECT 1441 1428 CONECT 1442 1428 CONECT 1443 1427 CONECT 1444 1427 CONECT 1445 1426 CONECT 1446 1426 CONECT 1447 1425 CONECT 1448 1425 CONECT 1449 1424 1450 1451 CONECT 1450 1449 CONECT 1451 1449 1452 1494 CONECT 1452 1451 1453 1488 1493 CONECT 1453 1452 1454 1455 CONECT 1454 1453 CONECT 1455 1453 1456 1487 CONECT 1456 1455 1457 1482 1486 CONECT 1457 1456 1458 1459 CONECT 1458 1457 CONECT 1459 1457 1460 1476 CONECT 1460 1459 1461 1474 1481 CONECT 1461 1460 1462 1463 CONECT 1462 1461 CONECT 1463 1461 1464 1473 CONECT 1464 1463 1465 1468 1472 CONECT 1465 1464 1466 1467 CONECT 1466 1465 CONECT 1467 1465 CONECT 1468 1464 1469 1470 1471 CONECT 1469 1468 CONECT 1470 1468 CONECT 1471 1468 CONECT 1472 1464 CONECT 1473 1463 CONECT 1474 1460 1475 1480 CONECT 1475 1474 1476 1479 CONECT 1476 1459 1475 1477 1478 CONECT 1477 1476 CONECT 1478 1476 CONECT 1479 1475 CONECT 1480 1474 CONECT 1481 1460 CONECT 1482 1456 1483 1484 1485 CONECT 1483 1482 CONECT 1484 1482 CONECT 1485 1482 CONECT 1486 1456 CONECT 1487 1455 CONECT 1488 1452 1489 1491 1492 CONECT 1489 1488 1490 CONECT 1490 1489 CONECT 1491 1488 CONECT 1492 1488 CONECT 1493 1452 CONECT 1494 1451 CONECT 1495 1424 CONECT 1496 1423 CONECT 1497 1420 1498 1513 1514 CONECT 1498 1497 1499 1511 1512 CONECT 1499 1498 1500 1509 1510 CONECT 1500 1499 1501 1508 CONECT 1501 1500 1502 1505 CONECT 1502 1501 1503 1504 CONECT 1503 1502 CONECT 1504 1502 CONECT 1505 1501 1506 1507 CONECT 1506 1505 CONECT 1507 1505 CONECT 1508 1500 CONECT 1509 1499 CONECT 1510 1499 CONECT 1511 1498 CONECT 1512 1498 CONECT 1513 1497 CONECT 1514 1497 CONECT 1515 1420 CONECT 1516 1419 CONECT 1517 1416 1518 1519 1520 CONECT 1518 1517 CONECT 1519 1517 CONECT 1520 1517 CONECT 1521 1416 CONECT 1522 1415 CONECT 1523 1412 1524 1525 1526 CONECT 1524 1523 CONECT 1525 1523 CONECT 1526 1523 CONECT 1527 1412 CONECT 1528 1411 CONECT 1529 1411 CONECT 1530 1411 MASTER 0 0 0 0 0 0 0 0 1529 1 124 10 END
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PDBbind
8-mer
5emb
RCSB PDB
PDBbind
8-mer
5fjx
RCSB PDB
PDBbind
8-mer
5fpi
RCSB PDB
PDBbind
8-mer
5gmv
RCSB PDB
PDBbind
8-mer
5hjb
RCSB PDB
PDBbind
8-mer
5i25
RCSB PDB
PDBbind
8-mer
5iok
RCSB PDB
PDBbind
8-mer
5jjm
RCSB PDB
PDBbind
8-mer
5mgx
RCSB PDB
PDBbind
8-mer
5n70
RCSB PDB
PDBbind
8-mer
5svi
RCSB PDB
PDBbind
8-mer
5sxm
RCSB PDB
PDBbind
8-mer
5t6p
RCSB PDB
PDBbind
8-mer
5t78
RCSB PDB
PDBbind
8-mer
5teg
RCSB PDB
PDBbind
8-mer
5tkj
RCSB PDB
PDBbind
8-mer
5tkk
RCSB PDB
PDBbind
8-mer
5vwi
RCSB PDB
PDBbind
8-mer
5vwk
RCSB PDB
PDBbind
8-mer
5wou
RCSB PDB
PDBbind
8-mer
5wtt
RCSB PDB
PDBbind
8-mer
5xjm
RCSB PDB
PDBbind
8-mer
5xn3
RCSB PDB
PDBbind
8-mer
5yba
RCSB PDB
PDBbind
8-mer
6cdm
RCSB PDB
PDBbind
8-mer
6cdo
RCSB PDB
PDBbind
8-mer
6cdp
RCSB PDB
PDBbind
8-mer
6e86
RCSB PDB
PDBbind
8-mer
6eww
RCSB PDB
PDBbind
8-mer
6fau
RCSB PDB
PDBbind
8-mer
6fav
RCSB PDB
PDBbind
8-mer
6faw
RCSB PDB
PDBbind
8-mer
6fbw
RCSB PDB
PDBbind
8-mer
6fby
RCSB PDB
PDBbind
8-mer
6fel
RCSB PDB
PDBbind
8-mer
6fi4
RCSB PDB
PDBbind
8-mer
6fi5
RCSB PDB
PDBbind
8-mer
6fmp
RCSB PDB
PDBbind
8-mer
6fx1
RCSB PDB
PDBbind
8-mer
6hpg
RCSB PDB
PDBbind
8-mer
6min
RCSB PDB
PDBbind
8-mer
6miq
RCSB PDB
PDBbind
8-mer
6q3q
RCSB PDB
PDBbind
8-mer
6r0x
RCSB PDB
PDBbind
8-mer
6qk8
RCSB PDB
PDBbind
8-mer
6q4q
RCSB PDB
PDBbind
8-mer
6mtv
RCSB PDB
PDBbind
8-mer
6mtu
RCSB PDB
PDBbind
8-mer
6ms1
RCSB PDB
PDBbind
8-mer
6mqe
RCSB PDB
PDBbind
8-mer
6mqc
RCSB PDB
PDBbind
8-mer
6jax
RCSB PDB
PDBbind
8-mer
6hmt
RCSB PDB
PDBbind
8-mer
6hhp
RCSB PDB
PDBbind
8-mer
6dtn
RCSB PDB
PDBbind
8-mer
6dql
RCSB PDB
PDBbind
8-mer
6do1
RCSB PDB
PDBbind
8-mer
Entry Information
PDB ID
5iql
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
YEATS domain-containing protein 2 (YEATS2)
Ligand Name
8-mer
EC.Number
E.C.-.-.-.-
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
Kd=27.5uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Cell Res. Vol. 26: pp. 629-632
Ligand Properties
Formula
C
3
6
H
6
2
N
1
2
O
1
1
Molecular Weight
838.951
Exact Mass
838.466
No. of atoms
121
No. of bonds
121
Polar Surface Area
375.19
LOGP Value
-2.98 (
Computed with XLOGP3
)
-3.50 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 9
No. of Hydrogen Bond Acceptors: 11
No. of Rotatable Bonds: 33
No. of Nitrogen and Oxygen Atoms: 23
No. of Rings: 1
Canonical SMILES
C/C=C/C(=O)NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CC=C[C@H]1C(=O)N[C@H](C(=O)O)C)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CCC[NH+]=C(N)N
InChI String
InChI=1S/C36H60N12O11/c1-6-11-27(50)40-15-8-7-12-23(46-30(53)24(13-9-16-41-36(38)39)45-29(52)20(3)42-28(51)19(2)37)31(54)47-25(18-49)32(55)43-21(4)34(57)48-17-10-14-26(48)33(56)44-22(5)35(58)59/h6,10-11,14,19-26,49H,7-9,12-13,15-18,37H2,1-5H3,(H,40,50)(H,42,51)(H,43,55)(H,44,56)(H,45,52)(H,46,53)(H,47,54)(H,58,59)(H4,38,39,41)/p+2/b11-6+/t19-,20-,21-,22-,23-,24-,25-,26-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9ULM3
P68431
Entrez Gene ID
NCBI Entrez Gene ID:
55689
8350
8351
8352
8353
8354
8355
8356
8357
8358
8968
ASD
Information of known allosteric effects of PDB entries
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